data_nef_c34365_6qwr 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 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 6QWR stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 ASN middle . . 3 A 3 GLU middle . . 4 A 4 ASN middle . . 5 A 5 TYR middle . . 6 A 6 PRO middle . false 7 A 7 ALA middle . . 8 A 8 LYS middle . . 9 A 9 SER middle . . 10 A 10 ALA middle . . 11 A 11 GLY middle . false 12 A 12 TYR middle . . 13 A 13 ASN middle . . 14 A 14 GLN middle . . 15 A 15 GLY middle . false 16 A 16 ASP middle . . 17 A 17 TRP middle . . 18 A 18 VAL middle . . 19 A 19 ALA middle . . 20 A 20 SER middle . . 21 A 21 PHE middle . . 22 A 22 ASN middle . . 23 A 23 PHE middle . . 24 A 24 SER middle . . 25 A 25 LYS middle . . 26 A 26 VAL middle . . 27 A 27 TYR middle . . 28 A 28 VAL middle . . 29 A 29 GLY middle . false 30 A 30 GLU middle . . 31 A 31 GLU middle . . 32 A 32 LEU middle . . 33 A 33 GLY middle . false 34 A 34 ASP middle . . 35 A 35 LEU middle . . 36 A 36 ASN middle . . 37 A 37 VAL middle . . 38 A 38 GLY middle . false 39 A 39 GLY middle . false 40 A 40 GLY middle . false 41 A 41 ALA middle . . 42 A 42 LEU middle . . 43 A 43 PRO middle . false 44 A 44 ASN middle . . 45 A 45 ALA middle . . 46 A 46 ASP middle . . 47 A 47 VAL middle . . 48 A 48 SER middle . . 49 A 49 ILE middle . . 50 A 50 GLY middle . false 51 A 51 ASN middle . . 52 A 52 ASP middle . . 53 A 53 THR middle . . 54 A 54 THR middle . . 55 A 55 LEU middle . . 56 A 56 THR middle . . 57 A 57 PHE middle . . 58 A 58 ASP middle . . 59 A 59 ILE middle . . 60 A 60 ALA middle . . 61 A 61 TYR middle . . 62 A 62 PHE middle . . 63 A 63 VAL middle . . 64 A 64 SER middle . . 65 A 65 SER middle . . 66 A 66 ASN middle . . 67 A 67 ILE middle . . 68 A 68 ALA middle . . 69 A 69 VAL middle . . 70 A 70 ASP middle . . 71 A 71 PHE middle . . 72 A 72 PHE middle . . 73 A 73 VAL middle . . 74 A 74 GLY middle . false 75 A 75 VAL middle . . 76 A 76 PRO middle . false 77 A 77 ALA middle . . 78 A 78 ARG middle . . 79 A 79 ALA middle . . 80 A 80 LYS middle . . 81 A 81 PHE middle . . 82 A 82 GLN middle . . 83 A 83 GLY middle . false 84 A 84 GLU middle . . 85 A 85 LYS middle . . 86 A 86 SER middle . . 87 A 87 ILE middle . . 88 A 88 SER middle . . 89 A 89 SER middle . . 90 A 90 LEU middle . . 91 A 91 GLY middle . false 92 A 92 ARG middle . . 93 A 93 VAL middle . . 94 A 94 SER middle . . 95 A 95 GLU middle . . 96 A 96 VAL middle . . 97 A 97 ASP middle . . 98 A 98 TYR middle . . 99 A 99 GLY middle . false 100 A 100 PRO middle . false 101 A 101 ALA middle . . 102 A 102 ILE middle . . 103 A 103 LEU middle . . 104 A 104 SER middle . . 105 A 105 LEU middle . . 106 A 106 GLN middle . . 107 A 107 TYR middle . . 108 A 108 HIS middle . . 109 A 109 TYR middle . . 110 A 110 ASP middle . . 111 A 111 SER middle . . 112 A 112 PHE middle . . 113 A 113 GLU middle . . 114 A 114 ARG middle . . 115 A 115 LEU middle . . 116 A 116 TYR middle . . 117 A 117 PRO middle . false 118 A 118 TYR middle . . 119 A 119 VAL middle . . 120 A 120 GLY middle . false 121 A 121 VAL middle . . 122 A 122 GLY middle . false 123 A 123 VAL middle . . 124 A 124 GLY middle . false 125 A 125 ARG middle . . 126 A 126 VAL middle . . 127 A 127 LEU middle . . 128 A 128 PHE middle . . 129 A 129 PHE middle . . 130 A 130 ASP middle . . 131 A 131 LYS middle . . 132 A 132 THR middle . . 133 A 133 ASP middle . . 134 A 134 GLY middle . false 135 A 135 ALA middle . . 136 A 136 LEU middle . . 137 A 137 SER middle . . 138 A 138 SER middle . . 139 A 139 PHE middle . . 140 A 140 ASP middle . . 141 A 141 ILE middle . . 142 A 142 LYS middle . . 143 A 143 ASP middle . . 144 A 144 LYS middle . . 145 A 145 TRP middle . . 146 A 146 ALA middle . . 147 A 147 PRO middle . false 148 A 148 ALA middle . . 149 A 149 PHE middle . . 150 A 150 GLN middle . . 151 A 151 VAL middle . . 152 A 152 GLY middle . false 153 A 153 LEU middle . . 154 A 154 ARG middle . . 155 A 155 TYR middle . . 156 A 156 ASP middle . . 157 A 157 LEU middle . . 158 A 158 GLY middle . false 159 A 159 ASN middle . . 160 A 160 SER middle . . 161 A 161 TRP middle . . 162 A 162 MET middle . . 163 A 163 LEU middle . . 164 A 164 ASN middle . . 165 A 165 SER middle . . 166 A 166 ASP middle . . 167 A 167 VAL middle . . 168 A 168 ARG middle . . 169 A 169 TYR middle . . 170 A 170 ILE middle . . 171 A 171 PRO middle . false 172 A 172 PHE middle . . 173 A 173 LYS middle . . 174 A 174 THR middle . . 175 A 175 ASP middle . . 176 A 176 VAL middle . . 177 A 177 THR middle . . 178 A 178 GLY middle . false 179 A 179 THR middle . . 180 A 180 LEU middle . . 181 A 181 GLY middle . false 182 A 182 PRO middle . false 183 A 183 VAL middle . . 184 A 184 PRO middle . false 185 A 185 VAL middle . . 186 A 186 SER middle . . 187 A 187 THR middle . . 188 A 188 LYS middle . . 189 A 189 ILE middle . . 190 A 190 GLU middle . . 191 A 191 VAL middle . . 192 A 192 ASP middle . . 193 A 193 PRO middle . false 194 A 194 PHE middle . . 195 A 195 ILE middle . . 196 A 196 LEU middle . . 197 A 197 SER middle . . 198 A 198 LEU middle . . 199 A 199 GLY middle . false 200 A 200 ALA middle . . 201 A 201 SER middle . . 202 A 202 TYR middle . . 203 A 203 VAL middle . . 204 A 204 PHE middle . . 205 A 205 LYS middle . . 206 A 206 LEU middle . . 207 A 207 ALA middle . . 208 A 208 ALA middle . . 209 A 209 ALA middle . . 210 A 210 LEU middle . . 211 A 211 GLU middle . . 212 A 212 HIS middle . . 213 A 213 HIS middle . . 214 A 214 HIS middle . . 215 A 215 HIS middle . . 216 A 216 HIS middle . . 217 A 217 HIS middle . . 218 A 218 HIS middle . . 219 A 219 HIS end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_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 11 GLY C C 13 172.840 0.000 A 12 TYR H H 1 7.595 0.054 A 12 TYR HA H 1 3.888 0.029 A 12 TYR HBx H 1 1.129 0.000 A 12 TYR HBy H 1 1.677 0.000 A 12 TYR C C 13 174.749 0.467 A 12 TYR CA C 13 55.799 0.096 A 12 TYR CB C 13 41.694 0.012 A 12 TYR N N 15 120.480 0.134 A 13 ASN H H 1 8.330 0.031 A 13 ASN HA H 1 4.497 0.021 A 13 ASN HBx H 1 2.230 0.008 A 13 ASN HBy H 1 2.324 0.010 A 13 ASN C C 13 173.117 0.079 A 13 ASN CA C 13 51.294 0.077 A 13 ASN CB C 13 42.617 0.117 A 13 ASN N N 15 118.531 0.065 A 14 GLN H H 1 8.086 0.033 A 14 GLN HA H 1 3.177 0.015 A 14 GLN HBx H 1 1.460 0.006 A 14 GLN HBy H 1 1.710 0.053 A 14 GLN C C 13 176.290 0.096 A 14 GLN CA C 13 57.478 0.074 A 14 GLN CB C 13 27.976 0.094 A 14 GLN CG C 13 33.477 0.067 A 14 GLN N N 15 119.397 0.076 A 15 GLY H H 1 8.780 0.023 A 15 GLY HAx H 1 3.327 0.022 A 15 GLY HAy H 1 4.074 0.014 A 15 GLY C C 13 173.434 0.071 A 15 GLY CA C 13 44.403 0.054 A 15 GLY N N 15 116.487 0.156 A 16 ASP H H 1 7.505 0.043 A 16 ASP HA H 1 4.310 0.019 A 16 ASP C C 13 174.876 0.167 A 16 ASP CA C 13 55.375 0.104 A 16 ASP CB C 13 40.868 0.136 A 16 ASP N N 15 120.679 0.152 A 17 TRP H H 1 8.185 0.062 A 17 TRP HA H 1 5.680 0.029 A 17 TRP HBx H 1 2.909 0.024 A 17 TRP HBy H 1 3.070 0.000 A 17 TRP C C 13 176.421 0.042 A 17 TRP CA C 13 55.480 0.158 A 17 TRP CB C 13 32.503 0.079 A 17 TRP N N 15 117.515 0.052 A 18 VAL H H 1 9.414 0.055 A 18 VAL HA H 1 5.097 0.104 A 18 VAL HB H 1 1.478 0.060 A 18 VAL HGx% H 1 0.608 0.000 A 18 VAL C C 13 176.411 0.056 A 18 VAL CA C 13 60.592 0.113 A 18 VAL CB C 13 34.965 0.023 A 18 VAL CGx C 13 21.349 0.022 A 18 VAL CGy C 13 23.113 0.000 A 18 VAL N N 15 119.338 0.236 A 19 ALA H H 1 9.290 0.026 A 19 ALA HA H 1 4.884 0.034 A 19 ALA HB% H 1 1.420 0.018 A 19 ALA C C 13 174.534 0.103 A 19 ALA CA C 13 50.374 0.055 A 19 ALA CB C 13 21.545 0.126 A 19 ALA N N 15 134.411 0.124 A 20 SER H H 1 8.581 0.042 A 20 SER HA H 1 5.428 0.031 A 20 SER HBx H 1 3.151 0.008 A 20 SER HBy H 1 3.351 0.044 A 20 SER C C 13 171.205 0.162 A 20 SER CA C 13 57.523 0.059 A 20 SER CB C 13 64.889 0.071 A 20 SER N N 15 117.571 0.143 A 21 PHE H H 1 8.748 0.024 A 21 PHE HA H 1 5.048 0.020 A 21 PHE HBx H 1 2.602 0.011 A 21 PHE HBy H 1 2.901 0.018 A 21 PHE C C 13 173.716 0.104 A 21 PHE CA C 13 55.427 0.058 A 21 PHE CB C 13 42.030 0.179 A 21 PHE N N 15 122.974 0.116 A 22 ASN H H 1 8.536 0.040 A 22 ASN HA H 1 5.333 0.021 A 22 ASN HBx H 1 2.006 0.004 A 22 ASN HBy H 1 2.059 0.016 A 22 ASN C C 13 174.154 0.104 A 22 ASN CA C 13 52.665 0.068 A 22 ASN CB C 13 43.966 0.133 A 22 ASN N N 15 118.498 0.174 A 23 PHE H H 1 9.142 0.033 A 23 PHE HA H 1 4.646 0.013 A 23 PHE C C 13 175.318 0.135 A 23 PHE CA C 13 57.904 0.049 A 23 PHE CB C 13 40.392 0.000 A 23 PHE N N 15 120.880 0.198 A 24 SER H H 1 8.390 0.064 A 24 SER HA H 1 5.625 0.041 A 24 SER C C 13 171.927 0.100 A 24 SER CA C 13 57.340 0.029 A 24 SER CB C 13 64.531 0.000 A 24 SER N N 15 121.197 0.103 A 25 LYS H H 1 9.232 0.046 A 25 LYS HA H 1 4.334 0.049 A 25 LYS C C 13 173.706 0.238 A 25 LYS CA C 13 54.181 0.100 A 25 LYS CB C 13 37.904 0.000 A 25 LYS N N 15 126.227 0.193 A 26 VAL H H 1 8.803 0.035 A 26 VAL HA H 1 4.400 0.023 A 26 VAL C C 13 174.926 0.154 A 26 VAL CA C 13 61.202 0.076 A 26 VAL CB C 13 31.916 0.030 A 26 VAL N N 15 126.503 0.299 A 27 TYR H H 1 9.149 0.025 A 27 TYR HA H 1 4.455 0.030 A 27 TYR C C 13 174.879 0.106 A 27 TYR CA C 13 56.764 0.045 A 27 TYR CB C 13 39.323 0.000 A 27 TYR N N 15 126.489 0.152 A 28 VAL H H 1 8.312 0.023 A 28 VAL C C 13 171.843 0.210 A 28 VAL CA C 13 60.459 0.000 A 28 VAL CB C 13 34.835 0.000 A 28 VAL N N 15 122.355 0.094 A 29 GLY H H 1 7.582 0.022 A 29 GLY C C 13 172.331 0.108 A 29 GLY CA C 13 45.103 0.000 A 29 GLY N N 15 106.692 0.060 A 30 GLU H H 1 7.969 0.021 A 30 GLU C C 13 171.272 0.076 A 30 GLU CA C 13 61.471 0.000 A 30 GLU CB C 13 31.585 0.000 A 30 GLU N N 15 120.719 0.115 A 31 GLU H H 1 7.571 0.041 A 31 GLU HA H 1 4.544 0.002 A 31 GLU C C 13 174.996 0.069 A 31 GLU CA C 13 56.420 0.094 A 31 GLU CB C 13 32.280 0.000 A 31 GLU N N 15 116.860 0.144 A 32 LEU H H 1 8.993 0.030 A 32 LEU HA H 1 4.476 0.041 A 32 LEU C C 13 177.586 0.183 A 32 LEU CA C 13 54.874 0.019 A 32 LEU N N 15 128.831 0.142 A 33 GLY H H 1 8.163 0.027 A 33 GLY HAx H 1 2.913 0.000 A 33 GLY HAy H 1 5.356 0.052 A 33 GLY C C 13 171.147 0.139 A 33 GLY CA C 13 44.027 0.084 A 33 GLY N N 15 111.353 0.279 A 34 ASP H H 1 7.990 0.038 A 34 ASP CA C 13 55.476 0.000 A 34 ASP CB C 13 40.498 0.000 A 34 ASP N N 15 118.627 0.076 A 37 VAL C C 13 174.305 0.000 A 38 GLY H H 1 8.047 0.010 A 38 GLY C C 13 176.901 0.000 A 38 GLY CA C 13 45.455 0.000 A 38 GLY N N 15 106.341 0.242 A 39 GLY H H 1 7.862 0.008 A 39 GLY C C 13 174.197 0.000 A 39 GLY CA C 13 45.070 0.000 A 39 GLY N N 15 107.653 0.461 A 40 GLY H H 1 7.515 0.021 A 40 GLY CA C 13 44.136 0.000 A 40 GLY N N 15 108.446 0.138 A 41 ALA H H 1 8.162 0.006 A 41 ALA CA C 13 51.164 0.000 A 41 ALA CB C 13 20.210 0.000 A 41 ALA N N 15 124.064 0.142 A 45 ALA H H 1 8.796 0.015 A 45 ALA HA H 1 5.010 0.000 A 45 ALA C C 13 175.727 0.145 A 45 ALA CA C 13 51.862 0.116 A 45 ALA CB C 13 22.002 0.000 A 45 ALA N N 15 127.399 0.198 A 46 ASP H H 1 7.132 0.015 A 46 ASP HA H 1 4.835 0.015 A 46 ASP HBx H 1 2.182 0.000 A 46 ASP HBy H 1 2.422 0.000 A 46 ASP C C 13 173.129 0.115 A 46 ASP CA C 13 52.889 0.085 A 46 ASP CB C 13 44.605 0.008 A 46 ASP N N 15 117.468 0.178 A 47 VAL H H 1 8.604 0.042 A 47 VAL HA H 1 5.069 0.020 A 47 VAL HB H 1 1.792 0.024 A 47 VAL HGx% H 1 1.066 0.000 A 47 VAL HGy% H 1 1.019 0.001 A 47 VAL C C 13 173.201 0.087 A 47 VAL CA C 13 58.914 0.074 A 47 VAL CB C 13 36.407 0.148 A 47 VAL CGx C 13 20.245 0.080 A 47 VAL CGy C 13 22.203 0.056 A 47 VAL N N 15 115.219 0.248 A 48 SER H H 1 9.072 0.029 A 48 SER HA H 1 4.715 0.020 A 48 SER HBy H 1 3.673 0.018 A 48 SER HBx H 1 3.648 0.000 A 48 SER C C 13 173.112 0.037 A 48 SER CA C 13 56.199 0.070 A 48 SER CB C 13 65.644 0.065 A 48 SER N N 15 115.832 0.312 A 49 ILE H H 1 7.891 0.015 A 49 ILE HA H 1 4.228 0.016 A 49 ILE CA C 13 60.321 0.085 A 49 ILE N N 15 119.594 0.056 A 54 THR H H 1 9.003 0.049 A 54 THR HA H 1 4.389 0.022 A 54 THR HB H 1 3.669 0.020 A 54 THR HG2% H 1 0.665 0.012 A 54 THR C C 13 171.111 0.082 A 54 THR CA C 13 58.527 0.120 A 54 THR CB C 13 69.944 0.128 A 54 THR CG2 C 13 17.730 0.052 A 54 THR N N 15 115.481 0.156 A 55 LEU H H 1 7.822 0.041 A 55 LEU HA H 1 5.027 0.035 A 55 LEU HBy H 1 1.209 0.059 A 55 LEU HBx H 1 1.186 0.013 A 55 LEU HG H 1 1.393 0.022 A 55 LEU C C 13 175.698 0.100 A 55 LEU CA C 13 53.426 0.582 A 55 LEU CB C 13 45.369 0.144 A 55 LEU CG C 13 27.356 0.279 A 55 LEU N N 15 122.332 0.170 A 56 THR H H 1 9.078 0.026 A 56 THR HA H 1 4.467 0.032 A 56 THR HB H 1 3.401 0.025 A 56 THR HG2% H 1 0.718 0.016 A 56 THR C C 13 171.098 0.048 A 56 THR CA C 13 59.929 0.102 A 56 THR CB C 13 71.632 0.069 A 56 THR CG2 C 13 21.846 0.109 A 56 THR N N 15 112.244 0.161 A 57 PHE H H 1 7.926 0.022 A 57 PHE HA H 1 5.412 0.027 A 57 PHE HBx H 1 2.361 0.001 A 57 PHE HBy H 1 2.708 0.026 A 57 PHE C C 13 173.208 0.005 A 57 PHE CA C 13 54.925 0.021 A 57 PHE CB C 13 44.263 0.081 A 57 PHE N N 15 117.394 0.124 A 58 ASP H H 1 8.159 0.029 A 58 ASP HA H 1 5.212 0.033 A 58 ASP HBx H 1 2.170 0.000 A 58 ASP HBy H 1 2.274 0.009 A 58 ASP C C 13 171.817 0.072 A 58 ASP CA C 13 53.662 0.088 A 58 ASP CB C 13 44.643 0.126 A 58 ASP N N 15 117.241 0.143 A 59 ILE H H 1 8.642 0.017 A 59 ILE HA H 1 5.296 0.037 A 59 ILE HB H 1 1.677 0.021 A 59 ILE HD1% H 1 0.988 0.040 A 59 ILE HG1x H 1 1.341 0.018 A 59 ILE HG1y H 1 1.575 0.029 A 59 ILE C C 13 171.163 0.186 A 59 ILE CA C 13 55.690 0.117 A 59 ILE CB C 13 42.187 0.092 A 59 ILE CD1 C 13 14.736 0.096 A 59 ILE CG1 C 13 29.396 0.079 A 59 ILE CG2 C 13 17.529 0.000 A 59 ILE N N 15 119.922 0.118 A 60 ALA H H 1 8.662 0.060 A 60 ALA HA H 1 5.755 0.032 A 60 ALA HB% H 1 0.838 0.031 A 60 ALA C C 13 175.096 0.085 A 60 ALA CA C 13 49.049 0.101 A 60 ALA CB C 13 23.196 0.090 A 60 ALA N N 15 128.497 0.163 A 61 TYR H H 1 8.066 0.039 A 61 TYR HA H 1 4.323 0.021 A 61 TYR HBx H 1 2.497 0.015 A 61 TYR HBy H 1 2.993 0.033 A 61 TYR C C 13 174.734 0.042 A 61 TYR CA C 13 55.490 0.080 A 61 TYR CB C 13 41.457 0.087 A 61 TYR N N 15 119.589 0.086 A 62 PHE H H 1 7.828 0.036 A 62 PHE HA H 1 3.751 0.044 A 62 PHE HBx H 1 2.301 0.078 A 62 PHE HBy H 1 2.763 0.013 A 62 PHE C C 13 175.397 0.075 A 62 PHE CA C 13 59.306 0.104 A 62 PHE CB C 13 36.736 0.168 A 62 PHE N N 15 127.821 0.074 A 63 VAL H H 1 7.697 0.031 A 63 VAL HA H 1 3.710 0.016 A 63 VAL HB H 1 2.005 0.057 A 63 VAL HGx% H 1 0.485 0.000 A 63 VAL HGy% H 1 0.886 0.000 A 63 VAL C C 13 175.366 0.102 A 63 VAL CA C 13 62.194 0.215 A 63 VAL CB C 13 31.672 0.144 A 63 VAL CGx C 13 19.178 0.000 A 63 VAL CGy C 13 21.209 0.000 A 63 VAL N N 15 121.961 0.073 A 64 SER H H 1 8.161 0.011 A 64 SER HA H 1 4.491 0.044 A 64 SER HBx H 1 4.256 0.011 A 64 SER HBy H 1 4.439 0.017 A 64 SER C C 13 172.353 0.092 A 64 SER CA C 13 56.061 0.077 A 64 SER CB C 13 66.238 0.073 A 64 SER N N 15 115.326 0.096 A 65 SER H H 1 8.426 0.024 A 65 SER HA H 1 3.706 0.024 A 65 SER HBx H 1 3.719 0.030 A 65 SER HBy H 1 3.870 0.002 A 65 SER C C 13 172.810 0.055 A 65 SER CA C 13 61.546 0.058 A 65 SER CB C 13 63.351 0.095 A 65 SER N N 15 111.566 0.147 A 66 ASN H H 1 7.437 0.021 A 66 ASN HA H 1 4.804 0.015 A 66 ASN HBx H 1 1.790 0.000 A 66 ASN HBy H 1 1.986 0.000 A 66 ASN C C 13 172.863 0.035 A 66 ASN CA C 13 54.376 0.027 A 66 ASN CB C 13 43.132 0.038 A 66 ASN N N 15 110.875 0.162 A 67 ILE H H 1 7.158 0.021 A 67 ILE HA H 1 4.882 0.024 A 67 ILE HB H 1 1.515 0.011 A 67 ILE HG2% H 1 0.488 0.001 A 67 ILE C C 13 173.316 0.060 A 67 ILE CA C 13 59.231 0.097 A 67 ILE CB C 13 38.496 0.068 A 67 ILE CG1 C 13 28.220 0.000 A 67 ILE CG2 C 13 17.173 0.096 A 67 ILE N N 15 118.623 0.110 A 68 ALA H H 1 8.326 0.029 A 68 ALA HA H 1 4.666 0.026 A 68 ALA HB% H 1 -0.561 0.029 A 68 ALA C C 13 175.932 0.043 A 68 ALA CA C 13 48.575 0.049 A 68 ALA CB C 13 21.508 0.087 A 68 ALA N N 15 126.828 0.123 A 69 VAL H H 1 8.197 0.043 A 69 VAL HA H 1 4.571 0.040 A 69 VAL HB H 1 1.657 0.038 A 69 VAL HGx% H 1 0.634 0.048 A 69 VAL HGy% H 1 0.697 0.051 A 69 VAL C C 13 173.966 0.062 A 69 VAL CA C 13 60.327 0.064 A 69 VAL CB C 13 32.915 0.085 A 69 VAL CGy C 13 21.824 0.289 A 69 VAL CGx C 13 21.351 0.465 A 69 VAL N N 15 119.260 0.099 A 70 ASP H H 1 9.005 0.031 A 70 ASP HA H 1 5.493 0.028 A 70 ASP HBx H 1 1.855 0.028 A 70 ASP HBy H 1 2.210 0.035 A 70 ASP C C 13 172.676 0.024 A 70 ASP CA C 13 51.534 0.076 A 70 ASP CB C 13 43.955 0.059 A 70 ASP N N 15 124.526 0.075 A 71 PHE H H 1 9.318 0.041 A 71 PHE HA H 1 5.420 0.019 A 71 PHE HBx H 1 2.587 0.004 A 71 PHE HBy H 1 2.763 0.023 A 71 PHE C C 13 171.756 0.083 A 71 PHE CA C 13 56.436 0.052 A 71 PHE CB C 13 42.443 0.062 A 71 PHE N N 15 125.961 0.071 A 72 PHE H H 1 8.098 0.033 A 72 PHE HA H 1 4.928 0.022 A 72 PHE HBx H 1 2.335 0.025 A 72 PHE HBy H 1 2.627 0.016 A 72 PHE C C 13 172.545 0.062 A 72 PHE CA C 13 55.161 0.049 A 72 PHE CB C 13 42.945 0.088 A 72 PHE N N 15 129.078 0.074 A 73 VAL H H 1 8.012 0.041 A 73 VAL HA H 1 3.881 0.041 A 73 VAL HB H 1 2.007 0.002 A 73 VAL HGx% H 1 0.788 0.000 A 73 VAL HGy% H 1 0.726 0.000 A 73 VAL C C 13 175.347 0.037 A 73 VAL CA C 13 60.164 0.054 A 73 VAL CB C 13 32.211 1.043 A 73 VAL CGy C 13 22.630 0.117 A 73 VAL CGx C 13 21.142 0.032 A 73 VAL N N 15 121.367 0.135 A 74 GLY CA C 13 46.748 0.000 A 75 VAL H H 1 8.197 0.043 A 75 VAL N N 15 115.403 0.098 A 76 PRO HA H 1 3.998 0.015 A 76 PRO HBx H 1 1.582 0.017 A 76 PRO HBy H 1 1.827 0.043 A 76 PRO HDx H 1 1.148 0.018 A 76 PRO HDy H 1 3.519 0.031 A 76 PRO HGx H 1 1.316 0.029 A 76 PRO HGy H 1 1.859 0.031 A 76 PRO C C 13 175.053 0.170 A 76 PRO CA C 13 64.454 0.055 A 76 PRO CB C 13 32.427 0.106 A 76 PRO CD C 13 47.352 0.080 A 76 PRO CG C 13 27.016 0.076 A 77 ALA H H 1 7.740 0.035 A 77 ALA HA H 1 4.199 0.018 A 77 ALA HB% H 1 0.765 0.005 A 77 ALA C C 13 174.243 0.019 A 77 ALA CA C 13 49.986 0.052 A 77 ALA CB C 13 20.135 0.135 A 77 ALA N N 15 125.141 0.107 A 78 ARG H H 1 9.251 0.015 A 78 ARG HA H 1 5.130 0.022 A 78 ARG HBy H 1 1.447 0.026 A 78 ARG HBx H 1 1.403 0.000 A 78 ARG HGx H 1 1.335 0.000 A 78 ARG HGy H 1 1.335 0.000 A 78 ARG C C 13 176.505 0.080 A 78 ARG CA C 13 55.127 0.067 A 78 ARG CB C 13 33.060 0.152 A 78 ARG CG C 13 24.456 0.061 A 78 ARG N N 15 119.759 0.161 A 79 ALA H H 1 9.858 0.037 A 79 ALA HA H 1 4.671 0.032 A 79 ALA HB% H 1 1.052 0.025 A 79 ALA C C 13 175.265 0.090 A 79 ALA CA C 13 50.523 0.055 A 79 ALA CB C 13 19.815 0.074 A 79 ALA N N 15 131.262 0.133 A 80 LYS H H 1 8.650 0.044 A 80 LYS HA H 1 4.542 0.016 A 80 LYS HBx H 1 1.430 0.033 A 80 LYS HBy H 1 1.654 0.023 A 80 LYS HGx H 1 1.058 0.010 A 80 LYS HGy H 1 1.058 0.010 A 80 LYS C C 13 175.285 0.079 A 80 LYS CA C 13 55.161 0.071 A 80 LYS CB C 13 32.415 0.067 A 80 LYS CG C 13 25.225 0.075 A 80 LYS N N 15 123.611 0.118 A 81 PHE H H 1 8.399 0.057 A 81 PHE HA H 1 4.555 0.016 A 81 PHE HBx H 1 2.821 0.016 A 81 PHE HBy H 1 2.821 0.016 A 81 PHE C C 13 174.566 0.088 A 81 PHE CA C 13 57.031 0.124 A 81 PHE CB C 13 39.076 0.077 A 81 PHE N N 15 123.875 0.162 A 82 GLN H H 1 9.175 0.025 A 82 GLN HA H 1 4.792 0.023 A 82 GLN HBx H 1 1.783 0.010 A 82 GLN HBy H 1 2.064 0.039 A 82 GLN C C 13 175.811 0.095 A 82 GLN CA C 13 53.740 0.074 A 82 GLN CB C 13 30.696 0.081 A 82 GLN CG C 13 33.169 0.030 A 82 GLN N N 15 127.249 0.238 A 83 GLY H H 1 9.105 0.032 A 83 GLY HAx H 1 3.387 0.026 A 83 GLY HAy H 1 3.739 0.016 A 83 GLY C C 13 172.106 0.076 A 83 GLY CA C 13 46.677 0.051 A 83 GLY N N 15 112.458 0.136 A 84 GLU H H 1 7.846 0.015 A 84 GLU HA H 1 4.665 0.020 A 84 GLU HBx H 1 2.062 0.014 A 84 GLU HBy H 1 2.115 0.055 A 84 GLU HGx H 1 2.030 0.010 A 84 GLU HGy H 1 2.135 0.024 A 84 GLU C C 13 175.689 0.029 A 84 GLU CA C 13 53.560 0.075 A 84 GLU CB C 13 34.446 0.118 A 84 GLU CG C 13 37.108 0.220 A 84 GLU N N 15 121.491 0.148 A 85 LYS H H 1 9.410 0.023 A 85 LYS HA H 1 3.668 0.023 A 85 LYS HBx H 1 1.797 0.029 A 85 LYS HBy H 1 2.005 0.037 A 85 LYS HDx H 1 1.514 0.000 A 85 LYS HDy H 1 1.662 0.000 A 85 LYS HEx H 1 2.812 0.000 A 85 LYS HEy H 1 2.812 0.000 A 85 LYS HGx H 1 1.373 0.030 A 85 LYS HGy H 1 1.373 0.030 A 85 LYS C C 13 179.643 0.102 A 85 LYS CA C 13 58.519 0.058 A 85 LYS CB C 13 30.161 0.087 A 85 LYS CD C 13 29.840 0.048 A 85 LYS CE C 13 42.467 0.000 A 85 LYS CG C 13 26.109 0.113 A 85 LYS N N 15 119.122 0.089 A 86 SER H H 1 8.633 0.038 A 86 SER HA H 1 4.225 0.043 A 86 SER HBx H 1 3.876 0.021 A 86 SER HBy H 1 4.210 0.010 A 86 SER C C 13 176.071 0.160 A 86 SER CA C 13 61.447 0.072 A 86 SER CB C 13 63.152 0.102 A 86 SER N N 15 120.187 0.122 A 87 ILE H H 1 7.671 0.035 A 87 ILE HA H 1 4.582 0.034 A 87 ILE HB H 1 2.181 0.025 A 87 ILE HD1% H 1 0.058 0.041 A 87 ILE HG1x H 1 1.034 0.028 A 87 ILE HG1y H 1 1.601 0.009 A 87 ILE HG2% H 1 0.626 0.008 A 87 ILE C C 13 176.442 0.083 A 87 ILE CA C 13 60.582 0.103 A 87 ILE CB C 13 37.120 0.132 A 87 ILE CD1 C 13 14.473 0.108 A 87 ILE CG1 C 13 27.792 0.139 A 87 ILE CG2 C 13 18.176 0.051 A 87 ILE N N 15 111.054 0.169 A 88 SER H H 1 7.635 0.019 A 88 SER HA H 1 3.681 0.013 A 88 SER HBx H 1 3.713 0.014 A 88 SER HBy H 1 3.853 0.030 A 88 SER C C 13 177.371 0.149 A 88 SER CA C 13 61.258 0.313 A 88 SER CB C 13 62.620 0.375 A 88 SER N N 15 119.498 0.208 A 89 SER H H 1 8.349 0.027 A 89 SER HA H 1 3.975 0.032 A 89 SER HBx H 1 3.692 0.009 A 89 SER HBy H 1 3.806 0.020 A 89 SER C C 13 175.379 0.113 A 89 SER CA C 13 60.178 0.106 A 89 SER CB C 13 62.575 0.058 A 89 SER N N 15 115.585 0.130 A 90 LEU H H 1 7.455 0.024 A 90 LEU HA H 1 3.924 0.017 A 90 LEU HG H 1 1.803 0.000 A 90 LEU C C 13 177.481 0.105 A 90 LEU CA C 13 55.852 0.069 A 90 LEU CB C 13 41.736 0.053 A 90 LEU CG C 13 26.996 0.006 A 90 LEU N N 15 119.532 0.244 A 91 GLY H H 1 7.089 0.022 A 91 GLY HAx H 1 3.530 0.012 A 91 GLY HAy H 1 3.720 0.017 A 91 GLY C C 13 173.815 0.076 A 91 GLY CA C 13 46.315 0.056 A 91 GLY N N 15 103.266 0.099 A 92 ARG H H 1 8.225 0.028 A 92 ARG HA H 1 4.263 0.018 A 92 ARG HBx H 1 1.649 0.015 A 92 ARG HBy H 1 1.889 0.018 A 92 ARG C C 13 175.961 0.151 A 92 ARG CA C 13 56.013 0.102 A 92 ARG CB C 13 28.735 0.126 A 92 ARG CG C 13 26.223 0.054 A 92 ARG N N 15 126.963 0.110 A 93 VAL H H 1 9.151 0.026 A 93 VAL HA H 1 3.317 0.030 A 93 VAL HB H 1 1.666 0.031 A 93 VAL HGx% H 1 0.650 0.013 A 93 VAL HGy% H 1 0.622 0.008 A 93 VAL C C 13 174.721 0.020 A 93 VAL CA C 13 66.712 0.066 A 93 VAL CB C 13 32.822 0.107 A 93 VAL CGx C 13 21.065 0.122 A 93 VAL CGy C 13 22.315 0.024 A 93 VAL N N 15 133.102 0.195 A 94 SER H H 1 7.239 0.027 A 94 SER HA H 1 4.087 0.019 A 94 SER HBx H 1 2.450 0.019 A 94 SER HBy H 1 3.429 0.023 A 94 SER C C 13 172.655 0.107 A 94 SER CA C 13 57.588 0.062 A 94 SER CB C 13 63.523 0.070 A 94 SER N N 15 106.105 0.086 A 95 GLU H H 1 8.625 0.024 A 95 GLU HA H 1 5.332 0.030 A 95 GLU HBx H 1 1.700 0.019 A 95 GLU HBy H 1 2.104 0.008 A 95 GLU C C 13 173.790 0.097 A 95 GLU CA C 13 55.009 0.116 A 95 GLU CB C 13 34.413 0.192 A 95 GLU CG C 13 37.154 0.000 A 95 GLU N N 15 115.021 0.107 A 96 VAL H H 1 8.936 0.027 A 96 VAL HA H 1 4.780 0.017 A 96 VAL HB H 1 2.413 0.027 A 96 VAL HGx% H 1 1.093 0.026 A 96 VAL HGy% H 1 1.288 0.024 A 96 VAL C C 13 171.989 0.076 A 96 VAL CA C 13 61.257 0.073 A 96 VAL CB C 13 35.803 0.100 A 96 VAL CGx C 13 20.374 0.077 A 96 VAL CGy C 13 24.382 0.188 A 96 VAL N N 15 118.253 0.117 A 97 ASP H H 1 8.680 0.041 A 97 ASP HA H 1 6.088 0.029 A 97 ASP HBy H 1 2.689 0.012 A 97 ASP HBx H 1 2.322 0.022 A 97 ASP C C 13 176.588 0.061 A 97 ASP CA C 13 53.302 0.072 A 97 ASP CB C 13 42.095 0.072 A 97 ASP N N 15 127.293 0.123 A 98 TYR H H 1 9.493 0.025 A 98 TYR HA H 1 5.297 0.056 A 98 TYR HBy H 1 2.604 0.011 A 98 TYR HBx H 1 2.375 0.004 A 98 TYR C C 13 173.760 0.086 A 98 TYR CA C 13 55.548 0.105 A 98 TYR CB C 13 42.305 0.063 A 98 TYR N N 15 119.516 0.137 A 99 GLY H H 1 8.495 0.028 A 99 GLY HAy H 1 2.480 0.019 A 99 GLY HAx H 1 2.132 0.025 A 99 GLY C C 13 176.992 0.154 A 99 GLY CA C 13 44.416 0.083 A 99 GLY N N 15 106.540 0.145 A 100 PRO HA H 1 4.511 0.019 A 100 PRO HBx H 1 1.521 0.025 A 100 PRO HBy H 1 1.719 0.000 A 100 PRO HDx H 1 3.597 0.000 A 100 PRO HDy H 1 4.049 0.000 A 100 PRO HGx H 1 1.714 0.008 A 100 PRO HGy H 1 1.714 0.008 A 100 PRO C C 13 175.132 0.029 A 100 PRO CA C 13 60.617 0.085 A 100 PRO CB C 13 32.328 0.079 A 100 PRO CD C 13 49.577 0.071 A 100 PRO CG C 13 26.482 0.038 A 101 ALA H H 1 8.267 0.019 A 101 ALA HA H 1 5.187 0.038 A 101 ALA HB% H 1 1.155 0.014 A 101 ALA C C 13 176.929 0.124 A 101 ALA CA C 13 50.444 0.053 A 101 ALA CB C 13 20.386 0.075 A 101 ALA N N 15 125.877 0.193 A 102 ILE H H 1 8.502 0.037 A 102 ILE HA H 1 4.642 0.035 A 102 ILE HB H 1 1.121 0.031 A 102 ILE HD1% H 1 0.070 0.048 A 102 ILE HG1x H 1 0.098 0.023 A 102 ILE HG1y H 1 1.106 0.042 A 102 ILE HG2% H 1 0.158 0.088 A 102 ILE C C 13 175.290 0.053 A 102 ILE CA C 13 60.543 0.112 A 102 ILE CB C 13 43.083 0.104 A 102 ILE CD1 C 13 13.812 0.146 A 102 ILE CG1 C 13 27.057 0.124 A 102 ILE CG2 C 13 17.365 0.135 A 102 ILE N N 15 118.910 0.151 A 103 LEU H H 1 8.920 0.025 A 103 LEU HA H 1 5.395 0.086 A 103 LEU HBx H 1 1.264 0.000 A 103 LEU HBy H 1 2.006 0.000 A 103 LEU C C 13 173.709 0.174 A 103 LEU CA C 13 53.386 0.114 A 103 LEU CB C 13 45.430 0.109 A 103 LEU N N 15 135.240 0.107 A 104 SER H H 1 9.549 0.020 A 104 SER HA H 1 4.959 0.020 A 104 SER HBy H 1 3.221 0.000 A 104 SER HBx H 1 2.995 0.022 A 104 SER C C 13 171.837 0.096 A 104 SER CA C 13 56.520 0.098 A 104 SER CB C 13 67.468 0.111 A 104 SER N N 15 118.423 0.100 A 105 LEU H H 1 8.481 0.024 A 105 LEU HA H 1 4.967 0.008 A 105 LEU HBy H 1 1.292 0.076 A 105 LEU HBx H 1 1.259 0.017 A 105 LEU HG H 1 1.393 0.033 A 105 LEU C C 13 175.012 0.046 A 105 LEU CA C 13 53.100 0.054 A 105 LEU CB C 13 45.299 0.104 A 105 LEU CG C 13 27.339 0.163 A 105 LEU N N 15 120.268 0.136 A 106 GLN H H 1 8.999 0.031 A 106 GLN HA H 1 5.294 0.011 A 106 GLN HBx H 1 1.099 0.043 A 106 GLN HBy H 1 1.622 0.007 A 106 GLN HE2x H 1 6.726 0.038 A 106 GLN HE2y H 1 7.640 0.027 A 106 GLN C C 13 174.788 0.071 A 106 GLN CA C 13 52.494 0.076 A 106 GLN CB C 13 33.325 0.146 A 106 GLN CD C 13 179.863 0.004 A 106 GLN CG C 13 32.878 0.019 A 106 GLN N N 15 117.198 0.120 A 106 GLN NE2 N 15 117.241 0.039 A 107 TYR H H 1 8.854 0.026 A 107 TYR HA H 1 4.866 0.058 A 107 TYR HBy H 1 2.596 0.004 A 107 TYR HBx H 1 2.245 0.018 A 107 TYR C C 13 173.668 0.007 A 107 TYR CA C 13 56.943 0.074 A 107 TYR CB C 13 41.314 0.166 A 107 TYR N N 15 121.505 0.103 A 108 HIS H H 1 8.629 0.017 A 108 HIS HA H 1 4.575 0.017 A 108 HIS HBy H 1 2.895 0.039 A 108 HIS HBx H 1 2.542 0.015 A 108 HIS HD1 H 1 9.707 0.017 A 108 HIS C C 13 174.350 0.032 A 108 HIS CA C 13 54.675 0.125 A 108 HIS CB C 13 32.831 0.091 A 108 HIS N N 15 128.001 0.239 A 108 HIS ND1 N 15 162.828 0.148 A 109 TYR H H 1 6.548 0.013 A 109 TYR HA H 1 5.130 0.022 A 109 TYR CA C 13 56.657 0.007 A 109 TYR CB C 13 40.839 0.000 A 109 TYR N N 15 124.002 0.073 A 115 LEU H H 1 8.515 0.000 A 115 LEU HA H 1 4.796 0.036 A 115 LEU C C 13 175.127 0.097 A 115 LEU CA C 13 53.430 0.181 A 115 LEU N N 15 125.875 0.020 A 116 TYR H H 1 9.088 0.027 A 116 TYR HA H 1 5.047 0.001 A 116 TYR C C 13 174.558 0.106 A 116 TYR CA C 13 54.556 0.007 A 116 TYR N N 15 122.356 0.158 A 117 PRO HA H 1 5.328 0.020 A 117 PRO HBx H 1 1.804 0.014 A 117 PRO HBy H 1 2.185 0.017 A 117 PRO HDx H 1 3.516 0.011 A 117 PRO HDy H 1 3.983 0.020 A 117 PRO HGx H 1 1.769 0.000 A 117 PRO HGy H 1 1.906 0.107 A 117 PRO C C 13 174.583 0.133 A 117 PRO CA C 13 62.209 0.070 A 117 PRO CB C 13 32.633 0.107 A 117 PRO CD C 13 51.275 0.140 A 117 PRO CG C 13 27.574 0.080 A 118 TYR H H 1 8.949 0.028 A 118 TYR HA H 1 5.497 0.016 A 118 TYR HBy H 1 2.720 0.018 A 118 TYR HBx H 1 2.467 0.000 A 118 TYR C C 13 172.558 0.103 A 118 TYR CA C 13 55.998 0.104 A 118 TYR CB C 13 42.204 0.147 A 118 TYR N N 15 118.244 0.151 A 119 VAL H H 1 8.325 0.029 A 119 VAL HA H 1 4.960 0.018 A 119 VAL HB H 1 2.121 0.038 A 119 VAL HGx% H 1 0.869 0.053 A 119 VAL HGy% H 1 0.976 0.003 A 119 VAL C C 13 174.465 0.069 A 119 VAL CA C 13 58.166 0.069 A 119 VAL CB C 13 36.510 0.082 A 119 VAL CGx C 13 19.695 0.058 A 119 VAL CGy C 13 22.241 0.074 A 119 VAL N N 15 111.891 0.232 A 120 GLY H H 1 8.695 0.022 A 120 GLY HAx H 1 4.055 0.029 A 120 GLY HAy H 1 4.956 0.040 A 120 GLY C C 13 171.808 0.130 A 120 GLY CA C 13 46.719 0.067 A 120 GLY N N 15 108.034 0.157 A 121 VAL H H 1 8.323 0.024 A 121 VAL HA H 1 4.835 0.011 A 121 VAL HB H 1 1.793 0.005 A 121 VAL HGx% H 1 0.639 0.000 A 121 VAL HGy% H 1 0.711 0.029 A 121 VAL C C 13 173.219 0.048 A 121 VAL CA C 13 59.408 0.093 A 121 VAL CB C 13 35.372 0.072 A 121 VAL CGx C 13 20.284 0.058 A 121 VAL CGy C 13 21.546 0.101 A 121 VAL N N 15 115.610 0.130 A 122 GLY H H 1 8.487 0.014 A 122 GLY HAx H 1 3.776 0.010 A 122 GLY HAy H 1 4.045 0.024 A 122 GLY C C 13 170.010 0.042 A 122 GLY CA C 13 46.037 0.080 A 122 GLY N N 15 112.138 0.096 A 123 VAL H H 1 8.564 0.020 A 123 VAL HA H 1 4.666 0.038 A 123 VAL HB H 1 1.617 0.038 A 123 VAL HGx% H 1 0.672 0.030 A 123 VAL HGy% H 1 0.711 0.012 A 123 VAL C C 13 172.721 0.115 A 123 VAL CA C 13 59.029 0.061 A 123 VAL CB C 13 35.246 0.125 A 123 VAL CGx C 13 20.502 0.148 A 123 VAL CGy C 13 22.233 0.042 A 123 VAL N N 15 118.429 0.162 A 124 GLY H H 1 9.451 0.016 A 124 GLY HAx H 1 3.387 0.065 A 124 GLY HAy H 1 4.202 0.038 A 124 GLY C C 13 171.266 0.118 A 124 GLY CA C 13 44.249 0.121 A 124 GLY N N 15 111.820 0.141 A 125 ARG H H 1 8.698 0.038 A 125 ARG HA H 1 4.440 0.023 A 125 ARG HBx H 1 0.825 0.000 A 125 ARG HBy H 1 1.507 0.000 A 125 ARG C C 13 174.191 0.066 A 125 ARG CA C 13 52.642 0.066 A 125 ARG CB C 13 32.397 0.108 A 125 ARG N N 15 121.076 0.139 A 126 VAL H H 1 8.756 0.022 A 126 VAL HA H 1 3.110 0.031 A 126 VAL HB H 1 0.930 0.027 A 126 VAL HGx% H 1 -0.058 0.022 A 126 VAL HGy% H 1 -0.467 0.037 A 126 VAL C C 13 172.827 0.099 A 126 VAL CA C 13 63.354 0.137 A 126 VAL CB C 13 30.791 0.113 A 126 VAL CGx C 13 19.846 0.084 A 126 VAL CGy C 13 20.707 0.068 A 126 VAL N N 15 127.971 0.109 A 127 LEU H H 1 6.678 0.050 A 127 LEU HA H 1 3.858 0.045 A 127 LEU HBx H 1 0.798 0.013 A 127 LEU HBy H 1 0.956 0.014 A 127 LEU HDx% H 1 0.186 0.000 A 127 LEU HDy% H 1 0.186 0.000 A 127 LEU HG H 1 1.453 0.014 A 127 LEU C C 13 174.617 0.062 A 127 LEU CA C 13 53.472 0.121 A 127 LEU CB C 13 44.455 0.104 A 127 LEU CDx C 13 20.852 0.000 A 127 LEU CDy C 13 20.852 0.000 A 127 LEU CG C 13 26.768 0.173 A 127 LEU N N 15 125.820 0.056 A 128 PHE H H 1 8.005 0.023 A 128 PHE HA H 1 4.543 0.008 A 128 PHE HBx H 1 2.527 0.027 A 128 PHE HBy H 1 2.759 0.015 A 128 PHE HEx H 1 6.794 0.000 A 128 PHE C C 13 175.335 0.062 A 128 PHE CA C 13 54.988 0.063 A 128 PHE CB C 13 42.134 0.064 A 128 PHE N N 15 117.540 0.086 A 129 PHE H H 1 7.990 0.048 A 129 PHE HA H 1 4.617 0.011 A 129 PHE HBx H 1 2.402 0.015 A 129 PHE HBy H 1 2.623 0.013 A 129 PHE C C 13 174.610 0.060 A 129 PHE CA C 13 54.855 0.052 A 129 PHE CB C 13 42.734 0.192 A 129 PHE N N 15 117.623 0.168 A 130 ASP H H 1 7.371 0.020 A 130 ASP HA H 1 5.780 0.027 A 130 ASP C C 13 175.195 0.023 A 130 ASP CA C 13 54.139 0.103 A 130 ASP CB C 13 41.036 0.000 A 130 ASP N N 15 120.269 0.065 A 131 LYS H H 1 8.436 0.026 A 131 LYS HA H 1 4.178 0.026 A 131 LYS HBy H 1 1.888 0.009 A 131 LYS HBx H 1 1.720 0.000 A 131 LYS HGx H 1 1.243 0.000 A 131 LYS HGy H 1 1.861 0.000 A 131 LYS C C 13 176.935 0.156 A 131 LYS CA C 13 59.069 0.112 A 131 LYS CB C 13 32.115 0.166 A 131 LYS CG C 13 27.277 0.040 A 131 LYS N N 15 120.566 0.125 A 132 THR H H 1 9.094 0.026 A 132 THR HA H 1 4.426 0.037 A 132 THR HB H 1 3.788 0.031 A 132 THR HG2% H 1 1.056 0.008 A 132 THR C C 13 172.502 0.041 A 132 THR CA C 13 62.251 0.080 A 132 THR CB C 13 71.310 0.065 A 132 THR CG2 C 13 19.923 0.074 A 132 THR N N 15 122.596 0.249 A 133 ASP H H 1 8.555 0.037 A 133 ASP HA H 1 4.361 0.032 A 133 ASP HBx H 1 2.492 0.017 A 133 ASP HBy H 1 2.995 0.031 A 133 ASP C C 13 176.878 0.040 A 133 ASP CA C 13 55.437 0.064 A 133 ASP CB C 13 41.448 0.065 A 133 ASP N N 15 128.279 0.158 A 134 GLY H H 1 7.386 0.030 A 134 GLY HAx H 1 2.883 0.031 A 134 GLY HAy H 1 4.102 0.032 A 134 GLY C C 13 173.517 0.069 A 134 GLY CA C 13 45.892 0.063 A 134 GLY N N 15 111.778 0.120 A 135 ALA H H 1 8.698 0.036 A 135 ALA HA H 1 3.996 0.021 A 135 ALA HB% H 1 1.292 0.031 A 135 ALA C C 13 177.898 0.188 A 135 ALA CA C 13 54.825 0.092 A 135 ALA CB C 13 20.161 0.085 A 135 ALA N N 15 131.807 0.097 A 136 LEU H H 1 8.174 0.041 A 136 LEU HA H 1 4.423 0.051 A 136 LEU HBx H 1 1.059 0.006 A 136 LEU HBy H 1 1.612 0.031 A 136 LEU C C 13 175.297 0.107 A 136 LEU CA C 13 53.579 0.090 A 136 LEU CB C 13 44.858 0.094 A 136 LEU CG C 13 27.032 0.201 A 136 LEU N N 15 113.703 0.193 A 137 SER H H 1 8.662 0.049 A 137 SER HA H 1 4.556 0.017 A 137 SER HBx H 1 3.700 0.024 A 137 SER HBy H 1 3.784 0.007 A 137 SER C C 13 174.186 0.070 A 137 SER CA C 13 56.807 0.138 A 137 SER CB C 13 64.829 0.068 A 137 SER N N 15 117.996 0.173 A 138 SER H H 1 9.251 0.025 A 138 SER HA H 1 3.866 0.029 A 138 SER HBx H 1 3.702 0.010 A 138 SER HBy H 1 3.868 0.000 A 138 SER C C 13 174.189 0.046 A 138 SER CA C 13 58.008 0.066 A 138 SER CB C 13 61.755 0.111 A 138 SER N N 15 115.402 0.168 A 139 PHE H H 1 8.334 0.019 A 139 PHE HA H 1 4.648 0.007 A 139 PHE HBx H 1 2.713 0.010 A 139 PHE HBy H 1 3.026 0.005 A 139 PHE C C 13 174.784 0.084 A 139 PHE CA C 13 57.063 0.054 A 139 PHE CB C 13 39.041 0.094 A 139 PHE N N 15 119.492 0.180 A 140 ASP H H 1 8.462 0.025 A 140 ASP HA H 1 4.114 0.020 A 140 ASP HBy H 1 2.198 0.021 A 140 ASP HBx H 1 1.984 0.020 A 140 ASP C C 13 171.773 0.078 A 140 ASP CA C 13 52.336 0.052 A 140 ASP CB C 13 44.189 0.048 A 140 ASP N N 15 127.640 0.097 A 141 ILE H H 1 7.162 0.025 A 141 ILE HA H 1 4.700 0.011 A 141 ILE HB H 1 0.942 0.043 A 141 ILE HD1% H 1 -0.153 0.037 A 141 ILE HG1y H 1 0.902 0.015 A 141 ILE HG1x H 1 -0.420 0.009 A 141 ILE C C 13 172.973 0.018 A 141 ILE CA C 13 58.381 0.062 A 141 ILE CB C 13 40.243 0.077 A 141 ILE CD1 C 13 14.489 0.101 A 141 ILE CG1 C 13 27.598 0.104 A 141 ILE N N 15 119.444 0.118 A 142 LYS H H 1 6.462 0.036 A 142 LYS HA H 1 4.293 0.007 A 142 LYS HBx H 1 1.772 0.000 A 142 LYS HBy H 1 1.772 0.000 A 142 LYS C C 13 176.465 0.094 A 142 LYS CA C 13 55.155 0.043 A 142 LYS CB C 13 33.326 0.082 A 142 LYS N N 15 123.986 0.126 A 143 ASP H H 1 8.177 0.016 A 143 ASP HA H 1 4.550 0.017 A 143 ASP HBy H 1 2.329 0.003 A 143 ASP HBx H 1 2.007 0.015 A 143 ASP C C 13 176.193 0.076 A 143 ASP CA C 13 55.356 0.045 A 143 ASP CB C 13 40.759 0.090 A 143 ASP N N 15 124.838 0.082 A 144 LYS H H 1 7.191 0.028 A 144 LYS HA H 1 4.679 0.005 A 144 LYS C C 13 177.219 0.088 A 144 LYS CA C 13 53.265 0.059 A 144 LYS CB C 13 36.980 0.010 A 144 LYS N N 15 115.966 0.272 A 145 TRP H H 1 8.581 0.016 A 145 TRP HA H 1 5.294 0.019 A 145 TRP HBx H 1 2.814 0.012 A 145 TRP HBy H 1 3.030 0.028 A 145 TRP C C 13 175.581 0.067 A 145 TRP CA C 13 56.540 0.109 A 145 TRP CB C 13 31.221 0.086 A 145 TRP N N 15 122.064 0.233 A 146 ALA H H 1 9.047 0.023 A 146 ALA HA H 1 4.739 0.026 A 146 ALA HB% H 1 1.054 0.011 A 146 ALA C C 13 173.341 0.105 A 146 ALA CA C 13 50.488 0.075 A 146 ALA CB C 13 21.979 0.033 A 146 ALA N N 15 123.577 0.187 A 147 PRO HA H 1 4.517 0.042 A 147 PRO HBx H 1 1.540 0.005 A 147 PRO HBy H 1 1.729 0.019 A 147 PRO HDx H 1 3.469 0.000 A 147 PRO HDy H 1 3.799 0.000 A 147 PRO HGy H 1 2.075 0.073 A 147 PRO HGx H 1 1.845 0.009 A 147 PRO C C 13 172.382 0.060 A 147 PRO CA C 13 62.102 0.052 A 147 PRO CB C 13 31.857 0.142 A 147 PRO CD C 13 49.464 0.086 A 147 PRO CG C 13 26.408 0.090 A 147 PRO N N 15 133.328 0.019 A 148 ALA H H 1 7.164 0.025 A 148 ALA HA H 1 4.827 0.024 A 148 ALA HB% H 1 0.558 0.027 A 148 ALA C C 13 175.478 0.091 A 148 ALA CA C 13 49.471 0.059 A 148 ALA CB C 13 23.984 0.078 A 148 ALA N N 15 117.238 0.051 A 149 PHE H H 1 8.510 0.022 A 149 PHE HA H 1 5.106 0.018 A 149 PHE HBx H 1 2.726 0.033 A 149 PHE HBy H 1 3.139 0.012 A 149 PHE C C 13 176.004 0.053 A 149 PHE CA C 13 55.890 0.081 A 149 PHE CB C 13 43.996 0.064 A 149 PHE N N 15 119.118 0.153 A 150 GLN H H 1 8.575 0.036 A 150 GLN HA H 1 5.451 0.036 A 150 GLN HBy H 1 1.942 0.048 A 150 GLN HE2y H 1 7.520 0.023 A 150 GLN HE2x H 1 6.481 0.031 A 150 GLN C C 13 173.459 0.174 A 150 GLN CA C 13 54.734 0.081 A 150 GLN CB C 13 32.753 0.102 A 150 GLN CG C 13 33.591 0.060 A 150 GLN N N 15 124.663 0.060 A 150 GLN NE2 N 15 116.110 0.138 A 151 VAL H H 1 8.345 0.020 A 151 VAL HA H 1 4.602 0.014 A 151 VAL HB H 1 1.438 0.004 A 151 VAL HGx% H 1 0.526 0.022 A 151 VAL HGy% H 1 0.532 0.021 A 151 VAL C C 13 172.911 0.046 A 151 VAL CA C 13 60.286 0.106 A 151 VAL CB C 13 35.020 0.056 A 151 VAL CGy C 13 21.363 0.149 A 151 VAL CGx C 13 21.199 0.156 A 151 VAL N N 15 121.596 0.072 A 152 GLY H H 1 8.511 0.024 A 152 GLY HAy H 1 4.210 0.037 A 152 GLY HAx H 1 2.462 0.036 A 152 GLY C C 13 170.597 0.050 A 152 GLY CA C 13 44.866 0.078 A 152 GLY N N 15 111.601 0.106 A 153 LEU H H 1 8.990 0.038 A 153 LEU HA H 1 4.580 0.018 A 153 LEU HBx H 1 1.241 0.008 A 153 LEU HBy H 1 1.440 0.008 A 153 LEU C C 13 174.678 0.092 A 153 LEU CA C 13 54.904 0.065 A 153 LEU CB C 13 46.655 0.119 A 153 LEU N N 15 117.992 0.084 A 154 ARG H H 1 7.366 0.034 A 154 ARG HA H 1 5.815 0.020 A 154 ARG HBy H 1 1.824 0.021 A 154 ARG HBx H 1 1.492 0.033 A 154 ARG HDx H 1 2.793 0.025 A 154 ARG HDy H 1 3.231 0.026 A 154 ARG HE H 1 7.455 0.018 A 154 ARG C C 13 175.145 0.113 A 154 ARG CA C 13 54.176 0.065 A 154 ARG CB C 13 34.428 0.117 A 154 ARG CD C 13 43.761 0.067 A 154 ARG CG C 13 29.669 0.022 A 154 ARG N N 15 120.357 0.121 A 154 ARG NE N 15 90.184 0.000 A 155 TYR H H 1 8.572 0.024 A 155 TYR HA H 1 5.339 0.012 A 155 TYR HBx H 1 2.524 0.013 A 155 TYR HBy H 1 2.789 0.025 A 155 TYR C C 13 174.838 0.109 A 155 TYR CA C 13 55.861 0.111 A 155 TYR CB C 13 42.807 0.018 A 155 TYR N N 15 120.886 0.088 A 156 ASP H H 1 8.478 0.008 A 156 ASP HA H 1 4.447 0.014 A 156 ASP HBx H 1 2.428 0.021 A 156 ASP HBy H 1 2.611 0.083 A 156 ASP C C 13 174.865 0.058 A 156 ASP CA C 13 55.045 0.102 A 156 ASP CB C 13 41.940 0.119 A 156 ASP N N 15 127.823 0.119 A 157 LEU H H 1 7.082 0.018 A 157 LEU C C 13 175.617 0.000 A 157 LEU CA C 13 53.877 0.000 A 157 LEU N N 15 120.394 0.038 A 158 GLY H H 1 9.248 0.032 A 158 GLY CA C 13 46.701 0.000 A 158 GLY N N 15 112.984 0.067 A 161 TRP H H 1 8.609 0.027 A 161 TRP HA H 1 5.316 0.023 A 161 TRP HBy H 1 3.279 0.011 A 161 TRP HBx H 1 2.944 0.049 A 161 TRP C C 13 176.896 0.066 A 161 TRP CA C 13 56.385 0.110 A 161 TRP CB C 13 32.060 0.076 A 161 TRP N N 15 122.961 0.055 A 162 MET H H 1 9.519 0.031 A 162 MET HA H 1 5.282 0.052 A 162 MET HBx H 1 1.431 0.024 A 162 MET HBy H 1 1.944 0.039 A 162 MET HGx H 1 2.016 0.006 A 162 MET HGy H 1 2.171 0.017 A 162 MET C C 13 175.991 0.084 A 162 MET CA C 13 53.796 0.070 A 162 MET CB C 13 37.416 0.124 A 162 MET CG C 13 32.209 0.097 A 162 MET N N 15 116.679 0.091 A 163 LEU H H 1 8.902 0.027 A 163 LEU HA H 1 4.991 0.027 A 163 LEU HBx H 1 1.835 0.017 A 163 LEU HBy H 1 1.998 0.079 A 163 LEU C C 13 175.977 0.094 A 163 LEU CA C 13 54.261 0.110 A 163 LEU CB C 13 43.631 0.033 A 163 LEU CG C 13 27.406 0.000 A 163 LEU N N 15 120.197 0.160 A 164 ASN H H 1 8.941 0.025 A 164 ASN HA H 1 5.232 0.013 A 164 ASN HBy H 1 2.468 0.011 A 164 ASN HBx H 1 2.068 0.012 A 164 ASN HD2x H 1 7.503 0.026 A 164 ASN HD2y H 1 9.125 0.000 A 164 ASN C C 13 173.075 0.098 A 164 ASN CA C 13 54.256 0.064 A 164 ASN CB C 13 44.433 0.090 A 164 ASN CG C 13 179.988 0.032 A 164 ASN N N 15 121.362 0.156 A 164 ASN ND2 N 15 121.709 0.061 A 165 SER H H 1 8.299 0.035 A 165 SER HA H 1 5.357 0.047 A 165 SER HBx H 1 3.527 0.025 A 165 SER HBy H 1 3.527 0.025 A 165 SER C C 13 173.027 0.077 A 165 SER CA C 13 56.643 0.071 A 165 SER CB C 13 66.681 0.067 A 165 SER N N 15 118.523 0.140 A 166 ASP H H 1 8.947 0.023 A 166 ASP HA H 1 4.980 0.038 A 166 ASP HBx H 1 2.087 0.031 A 166 ASP HBy H 1 2.567 0.030 A 166 ASP C C 13 172.178 0.105 A 166 ASP CA C 13 54.711 0.078 A 166 ASP CB C 13 46.418 0.061 A 166 ASP N N 15 121.899 0.085 A 167 VAL H H 1 9.202 0.036 A 167 VAL HA H 1 5.287 0.015 A 167 VAL HB H 1 1.631 0.024 A 167 VAL HGx% H 1 0.620 0.001 A 167 VAL HGy% H 1 0.746 0.013 A 167 VAL C C 13 173.989 0.062 A 167 VAL CA C 13 59.253 0.080 A 167 VAL CB C 13 34.947 0.091 A 167 VAL CGy C 13 22.944 0.003 A 167 VAL CGx C 13 22.298 0.080 A 167 VAL N N 15 118.822 0.086 A 168 ARG H H 1 8.486 0.029 A 168 ARG HA H 1 5.249 0.024 A 168 ARG HBx H 1 0.755 0.049 A 168 ARG HBy H 1 1.045 0.021 A 168 ARG HDx H 1 1.320 0.025 A 168 ARG HDy H 1 1.965 0.006 A 168 ARG HE H 1 7.943 0.027 A 168 ARG HGx H 1 0.774 0.000 A 168 ARG HGy H 1 1.692 0.000 A 168 ARG C C 13 174.819 0.113 A 168 ARG CA C 13 53.033 0.078 A 168 ARG CB C 13 34.496 0.104 A 168 ARG CD C 13 42.927 0.073 A 168 ARG CG C 13 28.382 0.059 A 168 ARG N N 15 122.853 0.069 A 168 ARG NE N 15 93.194 0.051 A 169 TYR H H 1 8.481 0.025 A 169 TYR HA H 1 5.382 0.020 A 169 TYR HBx H 1 2.372 0.015 A 169 TYR HBy H 1 2.708 0.018 A 169 TYR C C 13 174.406 0.040 A 169 TYR CA C 13 54.623 0.058 A 169 TYR CB C 13 43.091 0.045 A 169 TYR N N 15 121.964 0.056 A 171 PRO HA H 1 4.462 0.012 A 171 PRO HBx H 1 1.521 0.005 A 171 PRO HBy H 1 1.751 0.034 A 171 PRO HGy H 1 2.014 0.000 A 171 PRO HGx H 1 1.544 0.000 A 171 PRO C C 13 177.287 0.081 A 171 PRO CA C 13 62.293 0.074 A 171 PRO CB C 13 31.870 0.084 A 171 PRO CD C 13 49.926 0.084 A 171 PRO CG C 13 26.639 0.221 A 172 PHE H H 1 8.158 0.028 A 172 PHE HA H 1 4.976 0.018 A 172 PHE HBy H 1 2.656 0.023 A 172 PHE HBx H 1 2.463 0.026 A 172 PHE C C 13 171.810 0.099 A 172 PHE CA C 13 56.032 0.096 A 172 PHE CB C 13 41.233 0.068 A 172 PHE N N 15 113.845 0.162 A 173 LYS H H 1 8.107 0.019 A 173 LYS HA H 1 5.295 0.018 A 173 LYS HBy H 1 1.626 0.023 A 173 LYS HBx H 1 1.488 0.013 A 173 LYS HGy H 1 1.170 0.026 A 173 LYS HGx H 1 1.085 0.023 A 173 LYS C C 13 175.776 0.057 A 173 LYS CA C 13 54.287 0.065 A 173 LYS CB C 13 35.484 0.083 A 173 LYS CD C 13 29.779 0.054 A 173 LYS CE C 13 41.995 0.032 A 173 LYS CG C 13 24.855 0.056 A 173 LYS N N 15 120.148 0.138 A 174 THR H H 1 8.593 0.022 A 174 THR HA H 1 4.890 0.018 A 174 THR HB H 1 4.009 0.030 A 174 THR HG2% H 1 0.970 0.044 A 174 THR C C 13 171.378 0.057 A 174 THR CA C 13 58.968 0.070 A 174 THR CB C 13 69.921 0.064 A 174 THR CG2 C 13 21.236 0.104 A 174 THR N N 15 116.477 0.152 A 175 ASP H H 1 7.531 0.040 A 175 ASP HA H 1 5.009 0.004 A 175 ASP HBy H 1 2.436 0.006 A 175 ASP HBx H 1 2.074 0.019 A 175 ASP C C 13 174.738 0.033 A 175 ASP CA C 13 54.336 0.079 A 175 ASP CB C 13 44.068 0.051 A 175 ASP N N 15 123.264 0.140 A 176 VAL H H 1 8.352 0.051 A 176 VAL HA H 1 4.593 0.011 A 176 VAL HB H 1 1.593 0.007 A 176 VAL HGx% H 1 0.565 0.012 A 176 VAL HGy% H 1 0.487 0.015 A 176 VAL C C 13 174.829 0.064 A 176 VAL CA C 13 60.465 0.123 A 176 VAL CB C 13 34.992 0.089 A 176 VAL CGy C 13 21.306 0.167 A 176 VAL CGx C 13 20.925 0.063 A 176 VAL N N 15 121.697 0.168 A 177 THR H H 1 8.184 0.022 A 177 THR HA H 1 4.956 0.018 A 177 THR HB H 1 4.203 0.028 A 177 THR HG2% H 1 0.998 0.035 A 177 THR C C 13 172.554 0.101 A 177 THR CA C 13 58.931 0.073 A 177 THR CB C 13 73.177 0.062 A 177 THR CG2 C 13 22.218 0.091 A 177 THR N N 15 115.999 0.138 A 178 GLY H H 1 7.744 0.033 A 178 GLY HAx H 1 3.775 0.027 A 178 GLY HAy H 1 4.049 0.019 A 178 GLY C C 13 172.027 0.092 A 178 GLY CA C 13 45.754 0.096 A 178 GLY N N 15 103.141 0.087 A 179 THR H H 1 9.264 0.022 A 179 THR HA H 1 4.998 0.026 A 179 THR HB H 1 3.793 0.019 A 179 THR HG2% H 1 0.768 0.019 A 179 THR C C 13 172.558 0.126 A 179 THR CA C 13 60.007 0.091 A 179 THR CB C 13 71.374 0.086 A 179 THR CG2 C 13 21.206 0.075 A 179 THR N N 15 114.542 0.111 A 180 LEU H H 1 8.874 0.020 A 180 LEU HA H 1 4.703 0.023 A 180 LEU HBx H 1 1.184 0.037 A 180 LEU HBy H 1 1.397 0.008 A 180 LEU HG H 1 1.429 0.000 A 180 LEU C C 13 176.526 0.141 A 180 LEU CA C 13 52.385 0.089 A 180 LEU CB C 13 42.233 0.120 A 180 LEU CG C 13 27.040 0.064 A 180 LEU N N 15 126.022 0.159 A 181 GLY H H 1 8.819 0.044 A 181 GLY HAx H 1 3.395 0.007 A 181 GLY HAy H 1 4.110 0.024 A 181 GLY C C 13 173.804 0.078 A 181 GLY CA C 13 44.861 0.101 A 181 GLY N N 15 115.445 0.119 A 182 PRO HA H 1 4.498 0.037 A 182 PRO HBx H 1 1.817 0.016 A 182 PRO HBy H 1 2.140 0.024 A 182 PRO HGx H 1 1.633 0.004 A 182 PRO HGy H 1 1.942 0.003 A 182 PRO C C 13 176.060 0.079 A 182 PRO CA C 13 63.229 0.197 A 182 PRO CB C 13 32.478 0.094 A 182 PRO CD C 13 49.582 0.042 A 182 PRO CG C 13 26.301 0.083 A 183 VAL H H 1 8.550 0.030 A 183 VAL HA H 1 5.042 0.016 A 183 VAL HB H 1 1.564 0.000 A 183 VAL C C 13 172.942 0.191 A 183 VAL CA C 13 60.350 0.087 A 183 VAL CB C 13 35.059 0.078 A 183 VAL N N 15 121.932 0.078 A 184 PRO HA H 1 4.450 0.031 A 184 PRO HBx H 1 1.800 0.006 A 184 PRO HBy H 1 2.175 0.007 A 184 PRO HDx H 1 3.671 0.009 A 184 PRO HDy H 1 3.958 0.000 A 184 PRO HGx H 1 1.879 0.050 A 184 PRO HGy H 1 1.931 0.000 A 184 PRO C C 13 176.025 0.031 A 184 PRO CA C 13 63.472 0.108 A 184 PRO CB C 13 32.589 0.051 A 184 PRO CD C 13 51.207 0.070 A 184 PRO CG C 13 27.683 0.058 A 185 VAL H H 1 8.593 0.035 A 185 VAL HA H 1 4.852 0.010 A 185 VAL HB H 1 1.420 0.009 A 185 VAL HGx% H 1 0.709 0.007 A 185 VAL C C 13 175.464 0.045 A 185 VAL CA C 13 60.442 0.069 A 185 VAL CB C 13 35.087 0.130 A 185 VAL CGx C 13 21.187 0.045 A 185 VAL N N 15 121.934 0.087 A 186 SER H H 1 8.653 0.025 A 186 SER HA H 1 5.102 0.022 A 186 SER HBx H 1 3.749 0.015 A 186 SER HBy H 1 3.776 0.017 A 186 SER C C 13 172.709 0.028 A 186 SER CA C 13 57.108 0.076 A 186 SER CB C 13 65.767 0.109 A 186 SER N N 15 119.694 0.155 A 187 THR H H 1 8.803 0.022 A 187 THR HA H 1 4.720 0.019 A 187 THR HB H 1 4.078 0.039 A 187 THR HG2% H 1 0.565 0.043 A 187 THR C C 13 171.769 0.043 A 187 THR CA C 13 60.392 0.109 A 187 THR CB C 13 68.694 0.157 A 187 THR CG2 C 13 17.771 0.228 A 187 THR N N 15 117.653 0.153 A 188 LYS H H 1 8.349 0.044 A 188 LYS HA H 1 5.211 0.020 A 188 LYS HBx H 1 1.453 0.013 A 188 LYS HBy H 1 1.571 0.018 A 188 LYS HDx H 1 2.762 0.024 A 188 LYS HDy H 1 2.878 0.000 A 188 LYS HEx H 1 2.753 0.023 A 188 LYS HEy H 1 2.804 0.074 A 188 LYS HGy H 1 1.408 0.022 A 188 LYS HGx H 1 1.206 0.022 A 188 LYS C C 13 174.588 0.206 A 188 LYS CA C 13 54.882 0.122 A 188 LYS CB C 13 36.189 0.055 A 188 LYS CD C 13 29.555 0.094 A 188 LYS CE C 13 42.022 0.082 A 188 LYS CG C 13 24.989 0.076 A 188 LYS N N 15 124.152 0.210 A 189 ILE H H 1 8.822 0.045 A 189 ILE HA H 1 4.728 0.044 A 189 ILE C C 13 172.603 0.145 A 189 ILE CA C 13 58.909 0.067 A 189 ILE N N 15 120.118 0.129 A 190 GLU H H 1 8.501 0.058 A 190 GLU HA H 1 4.363 0.035 A 190 GLU HBx H 1 1.802 0.000 A 190 GLU HBy H 1 2.030 0.000 A 190 GLU C C 13 174.720 0.113 A 190 GLU CA C 13 55.210 0.122 A 190 GLU CB C 13 30.590 0.058 A 190 GLU N N 15 128.107 0.281 A 191 VAL H H 1 8.630 0.023 A 191 VAL HA H 1 4.129 0.041 A 191 VAL HB H 1 0.233 0.024 A 191 VAL HGx% H 1 0.573 0.004 A 191 VAL HGy% H 1 0.791 0.000 A 191 VAL C C 13 173.440 0.052 A 191 VAL CA C 13 61.010 0.106 A 191 VAL CB C 13 32.908 0.155 A 191 VAL CGx C 13 21.124 0.029 A 191 VAL CGy C 13 21.592 0.020 A 191 VAL N N 15 126.076 0.151 A 193 PRO HA H 1 5.355 0.020 A 193 PRO HBx H 1 1.586 0.054 A 193 PRO HBy H 1 1.697 0.009 A 193 PRO HDx H 1 1.151 0.049 A 193 PRO HDy H 1 3.515 0.005 A 193 PRO HGx H 1 1.282 0.060 A 193 PRO HGy H 1 1.897 0.043 A 193 PRO C C 13 175.125 0.003 A 193 PRO CA C 13 61.165 0.070 A 193 PRO CB C 13 30.347 0.135 A 193 PRO CD C 13 47.346 0.087 A 193 PRO CG C 13 27.181 0.127 A 194 PHE H H 1 9.236 0.035 A 194 PHE HA H 1 5.392 0.028 A 194 PHE HBx H 1 2.502 0.004 A 194 PHE HBy H 1 2.782 0.003 A 194 PHE C C 13 174.909 0.115 A 194 PHE CA C 13 55.980 0.075 A 194 PHE CB C 13 41.634 0.098 A 194 PHE N N 15 122.731 0.110 A 195 ILE H H 1 9.338 0.022 A 195 ILE HA H 1 4.752 0.060 A 195 ILE HB H 1 1.526 0.061 A 195 ILE HD1% H 1 0.433 0.005 A 195 ILE HG1x H 1 0.693 0.010 A 195 ILE HG1y H 1 1.370 0.013 A 195 ILE HG2% H 1 0.502 0.015 A 195 ILE C C 13 175.766 0.054 A 195 ILE CA C 13 60.326 0.079 A 195 ILE CB C 13 39.341 0.144 A 195 ILE CD1 C 13 13.329 0.081 A 195 ILE CG1 C 13 26.974 0.056 A 195 ILE CG2 C 13 17.754 0.126 A 195 ILE N N 15 121.796 0.148 A 196 LEU H H 1 9.696 0.028 A 196 LEU HA H 1 4.947 0.008 A 196 LEU HBx H 1 2.090 0.000 A 196 LEU HBy H 1 2.494 0.000 A 196 LEU C C 13 174.634 0.138 A 196 LEU CA C 13 54.440 0.046 A 196 LEU CB C 13 43.727 0.000 A 196 LEU N N 15 134.505 0.065 A 197 SER H H 1 9.429 0.022 A 197 SER HA H 1 5.336 0.031 A 197 SER HBx H 1 2.939 0.004 A 197 SER HBy H 1 3.654 0.035 A 197 SER C C 13 172.070 0.026 A 197 SER CA C 13 58.700 0.064 A 197 SER CB C 13 64.761 0.086 A 197 SER N N 15 124.217 0.284 A 198 LEU H H 1 8.856 0.040 A 198 LEU HA H 1 5.137 0.027 A 198 LEU HBx H 1 1.417 0.032 A 198 LEU HBy H 1 1.704 0.039 A 198 LEU C C 13 175.777 0.116 A 198 LEU CA C 13 53.529 0.112 A 198 LEU CB C 13 46.700 0.059 A 198 LEU N N 15 124.968 0.088 A 199 GLY H H 1 8.802 0.029 A 199 GLY HAx H 1 3.802 0.044 A 199 GLY HAy H 1 4.808 0.053 A 199 GLY C C 13 172.261 0.095 A 199 GLY CA C 13 47.817 0.101 A 199 GLY N N 15 111.522 0.160 A 200 ALA H H 1 8.642 0.033 A 200 ALA HA H 1 5.432 0.014 A 200 ALA HB% H 1 1.463 0.028 A 200 ALA C C 13 175.123 0.108 A 200 ALA CA C 13 50.567 0.062 A 200 ALA CB C 13 24.005 0.091 A 200 ALA N N 15 123.595 0.160 A 201 SER H H 1 9.081 0.026 A 201 SER HA H 1 5.380 0.044 A 201 SER HBx H 1 2.951 0.000 A 201 SER HBy H 1 3.290 0.000 A 201 SER C C 13 171.616 0.035 A 201 SER CA C 13 57.749 0.082 A 201 SER CB C 13 66.128 0.100 A 201 SER N N 15 114.658 0.117 A 202 TYR H H 1 9.074 0.021 A 202 TYR HA H 1 4.409 0.023 A 202 TYR HBx H 1 2.184 0.000 A 202 TYR HBy H 1 2.626 0.000 A 202 TYR C C 13 175.125 0.043 A 202 TYR CA C 13 56.390 0.103 A 202 TYR CB C 13 41.661 0.055 A 202 TYR N N 15 124.888 0.133 A 203 VAL H H 1 8.437 0.008 A 203 VAL C C 13 174.761 0.368 A 203 VAL CA C 13 56.706 0.000 A 203 VAL N N 15 120.911 0.028 A 204 PHE H H 1 9.287 0.028 A 204 PHE CA C 13 56.721 0.000 A 204 PHE N N 15 126.178 0.232 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 132 THR HA A 132 THR HG2% 1.0 . 3.23 2 2 A 102 ILE HA A 103 LEU HA 1.0 . 4.63 3 3 A 87 ILE HA A 87 ILE HG2% 1.0 . 2.89 4 4 A 102 ILE HA A 102 ILE HG2% 1.0 . 3.64 5 5 A 69 VAL HA A 106 GLN H 1.0 . 3.53 6 6 A 151 VAL HA A 152 GLY H 1.0 . 3.05 7 7 A 176 VAL HA A 177 THR H 1.0 . 3.22 8 8 A 56 THR HA A 57 PHE H 1.0 . 3.49 9 9 A 81 PHE HA A 82 GLN H 1.0 . 3.42 10 10 A 31 GLU HA A 32 LEU H 1.0 . 3.37 11 11 A 64 SER HA A 65 SER HA 1.0 . 4.38 12 12 A 80 LYS HA A 80 LYS HGx 1.0 . 3.60 13 12 A 80 LYS HA A 80 LYS HGy 1.0 . 3.60 14 13 A 143 ASP HA A 175 ASP H 1.0 . 4.52 15 14 A 143 ASP HA A 144 LYS H 1.0 . 3.48 16 15 A 156 ASP HA A 157 LEU H 1.0 . 3.51 17 16 A 95 GLU H A 133 ASP HA 1.0 . 3.37 18 17 A 32 LEU HA A 33 GLY H 1.0 . 3.48 19 18 A 156 ASP HA A 162 MET HBy 1.0 . 3.32 20 19 A 80 LYS HA A 95 GLU HA 1.0 . 3.20 21 20 A 84 GLU HA A 93 VAL HGy% 1.0 . 4.79 22 21 A 13 ASN HA A 14 GLN H 1.0 . 3.36 23 22 A 68 ALA HA A 69 VAL H 1.0 . 3.35 24 23 A 68 ALA HA A 62 PHE HA 1.0 . 4.11 25 24 A 57 PHE H A 56 THR HB 1.0 . 3.98 26 25 A 132 THR H A 132 THR HB 1.0 . 3.80 27 26 A 93 VAL HA A 135 ALA HB% 1.0 . 3.80 28 27 A 87 ILE HG2% A 93 VAL HA 1.0 . 3.69 29 28 A 93 VAL HGy% A 93 VAL HA 1.0 . 4.03 30 29 A 184 PRO HA A 185 VAL H 1.0 . 3.56 31 30 A 184 PRO HA A 185 VAL HA 1.0 . 4.54 32 31 A 65 SER HA A 64 SER H 1.0 . 5.04 33 32 A 82 GLN HBy A 88 SER HA 1.0 . 4.17 34 33 A 88 SER HA A 93 VAL HB 1.0 . 4.95 35 34 A 62 PHE HA A 68 ALA HB% 1.0 . 3.95 36 35 A 54 THR HA A 54 THR HG2% 1.0 . 3.99 37 36 A 137 SER HA A 138 SER HA 1.0 . 4.87 38 37 A 92 ARG HA A 93 VAL H 1.0 . 3.56 39 38 A 133 ASP HA A 134 GLY H 1.0 . 3.39 40 39 A 62 PHE HA A 61 TYR HA 1.0 . 4.51 41 40 A 173 LYS HBx A 190 GLU HA 1.0 . 3.30 42 41 A 93 VAL HGy% A 135 ALA HA 1.0 . 4.78 43 42 A 125 ARG HA A 145 TRP H 1.0 . 4.99 44 43 A 140 ASP HA A 141 ILE H 1.0 . 3.44 45 44 A 83 GLY HAy A 93 VAL HGx% 1.0 . 4.09 46 45 A 93 VAL HGy% A 83 GLY HAy 1.0 . 4.40 47 46 A 93 VAL HGx% A 83 GLY HAx 1.0 . 4.44 48 47 A 93 VAL HGy% A 83 GLY HAx 1.0 . 4.35 49 48 A 140 ASP H A 140 ASP HBy 1.0 . 3.91 50 49 A 154 ARG HE A 164 ASN HBy 1.0 . 4.15 51 50 A 141 ILE H A 140 ASP HBy 1.0 . 4.21 52 51 A 141 ILE H A 140 ASP HBx 1.0 . 4.21 53 52 A 164 ASN HBy A 154 ARG HBy 1.0 . 3.84 54 53 A 164 ASN HBy A 60 ALA HB% 1.0 . 5.73 55 54 A 162 MET HBy A 154 ARG HDx 1.0 . 4.11 56 55 A 162 MET HBy A 154 ARG HDy 1.0 . 4.11 57 56 A 14 GLN H A 13 ASN HBy 1.0 . 4.17 58 57 A 59 ILE H A 59 ILE HB 1.0 . 4.00 59 58 A 59 ILE HB A 59 ILE HD1% 1.0 . 3.34 60 59 A 85 LYS HEy A 85 LYS HGx 1.0 . 3.38 61 59 A 85 LYS HEx A 85 LYS HGx 1.0 . 3.38 62 59 A 85 LYS HGy A 85 LYS HEx 1.0 . 3.38 63 59 A 85 LYS HGy A 85 LYS HEy 1.0 . 3.38 64 60 A 133 ASP H A 133 ASP HBx 1.0 . 4.18 65 61 A 133 ASP H A 133 ASP HBy 1.0 . 4.18 66 62 A 141 ILE HB A 141 ILE HD1% 1.0 . 3.97 67 63 A 176 VAL HA A 141 ILE HB 1.0 . 4.83 68 64 A 81 PHE H A 81 PHE HBx 1.0 . 3.89 69 64 A 81 PHE H A 81 PHE HBy 1.0 . 3.89 70 65 A 93 VAL HGy% A 87 ILE HB 1.0 . 3.85 71 66 A 47 VAL HB A 48 SER H 1.0 . 4.17 72 67 A 185 VAL H A 185 VAL HB 1.0 . 3.63 73 68 A 167 VAL HB A 168 ARG H 1.0 . 4.36 74 69 A 173 LYS HBy A 190 GLU H 1.0 . 4.90 75 70 A 183 VAL H A 183 VAL HB 1.0 . 3.88 76 71 A 151 VAL H A 151 VAL HB 1.0 . 3.81 77 72 A 167 VAL HB A 167 VAL H 1.0 . 4.03 78 73 A 195 ILE HB A 168 ARG HBy 1.0 . 4.13 79 74 A 195 ILE HB A 168 ARG HBx 1.0 . 4.13 80 75 A 69 VAL H A 69 VAL HB 1.0 . 3.72 81 76 A 117 PRO HBy A 118 TYR H 1.0 . 4.11 82 77 A 178 GLY H A 184 PRO HBy 1.0 . 4.09 83 78 A 69 VAL HB A 105 LEU HA 1.0 . 3.91 84 79 A 93 VAL HB A 83 GLY H 1.0 . 3.98 85 80 A 183 VAL H A 182 PRO HBy 1.0 . 4.61 86 81 A 93 VAL HB A 81 PHE H 1.0 . 5.24 87 82 A 69 VAL HB A 105 LEU H 1.0 . 5.50 88 83 A 93 VAL HB A 94 SER H 1.0 . 3.77 89 84 A 184 PRO HBy A 179 THR HB 1.0 . 5.96 90 85 A 185 VAL H A 184 PRO HBy 1.0 . 4.04 91 86 A 183 VAL H A 182 PRO HBx 1.0 . 4.31 92 87 A 178 GLY H A 184 PRO HBx 1.0 . 4.13 93 88 A 184 PRO HBx A 179 THR HA 1.0 . 5.50 94 89 A 184 PRO HBx A 177 THR HA 1.0 . 4.67 95 90 A 117 PRO HBx A 153 LEU H 1.0 . 5.09 96 91 A 69 VAL HB A 61 TYR H 1.0 . 4.73 97 92 A 93 VAL HB A 81 PHE HBx 1.0 . 5.34 98 92 A 93 VAL HB A 81 PHE HBy 1.0 . 5.34 99 93 A 127 LEU HA A 127 LEU HG 1.0 . 3.92 100 94 A 85 LYS HA A 85 LYS HGx 1.0 . 4.10 101 94 A 85 LYS HGy A 85 LYS HA 1.0 . 4.10 102 95 A 93 VAL HGx% A 80 LYS HGx 1.0 . 5.40 103 95 A 80 LYS HGy A 93 VAL HGx% 1.0 . 5.40 104 96 A 154 ARG HBy A 60 ALA HB% 1.0 . 5.48 105 97 A 93 VAL HGy% A 87 ILE HD1% 1.0 . 4.14 106 98 A 119 VAL HA A 119 VAL HGy% 1.0 . 3.89 107 99 A 69 VAL HA A 69 VAL HGy% 1.0 . 4.13 108 100 A 56 THR HA A 56 THR HG2% 1.0 . 4.17 109 101 A 93 VAL HGy% A 88 SER HA 1.0 . 4.64 110 102 A 69 VAL HGy% A 105 LEU HBx 1.0 . 4.31 111 103 A 105 LEU HBx A 69 VAL HGx% 1.0 . 4.36 112 104 A 69 VAL HGx% A 105 LEU HBy 1.0 . 4.65 113 105 A 93 VAL HGy% A 135 ALA HB% 1.0 . 3.94 114 106 A 87 ILE HG2% A 87 ILE HD1% 1.0 . 3.88 115 107 A 118 TYR H A 117 PRO HA 1.0 . 3.57 116 108 A 132 THR H A 96 VAL HA 1.0 . 3.97 117 109 A 96 VAL HA A 78 ARG HGx 1.0 . 3.82 118 109 A 96 VAL HA A 78 ARG HGy 1.0 . 3.82 119 110 A 27 TYR H A 193 PRO HA 1.0 . 4.35 120 111 A 184 PRO HBy A 179 THR HA 1.0 . 4.13 121 112 A 179 THR HA A 179 THR HG2% 1.0 . 3.25 122 113 A 121 VAL HA A 122 GLY H 1.0 . 3.41 123 114 A 195 ILE HB A 167 VAL HA 1.0 . 4.77 124 115 A 185 VAL HB A 177 THR HA 1.0 . 4.74 125 116 A 167 VAL HA A 167 VAL HGx% 1.0 . 3.99 126 117 A 167 VAL HA A 167 VAL HGy% 1.0 . 3.99 127 118 A 175 ASP H A 174 THR HA 1.0 . 3.56 128 119 A 48 SER H A 47 VAL HA 1.0 . 3.45 129 120 A 83 GLY HAy A 47 VAL HA 1.0 . 4.07 130 121 A 174 THR HA A 174 THR HG2% 1.0 . 3.42 131 122 A 141 ILE HD1% A 141 ILE HA 1.0 . 4.07 132 123 A 118 TYR H A 119 VAL HA 1.0 . 5.24 133 124 A 141 ILE HA A 142 LYS HA 1.0 . 4.66 134 125 A 119 VAL HA A 119 VAL HGx% 1.0 . 3.89 135 126 A 20 SER HA A 201 SER HA 1.0 . 3.21 136 127 A 201 SER HA A 202 TYR HA 1.0 . 4.63 137 128 A 186 SER HA A 187 THR H 1.0 . 3.38 138 129 A 186 SER HA A 177 THR HG2% 1.0 . 4.05 139 130 A 186 SER HA A 187 THR HG2% 1.0 . 3.95 140 131 A 165 SER HA A 166 ASP H 1.0 . 3.34 141 132 A 105 LEU H A 104 SER HA 1.0 . 3.52 142 133 A 144 LYS HA A 145 TRP HA 1.0 . 4.69 143 134 A 71 PHE HA A 103 LEU HBy 1.0 . 4.00 144 135 A 104 SER HA A 103 LEU HBx 1.0 . 4.94 145 136 A 105 LEU HBx A 104 SER HA 1.0 . 5.19 146 137 A 145 TRP HA A 125 ARG HBx 1.0 . 3.82 147 138 A 144 LYS H A 145 TRP HA 1.0 . 5.17 148 139 A 125 ARG HA A 145 TRP HA 1.0 . 3.75 149 140 A 118 TYR HA A 119 VAL HB 1.0 . 4.91 150 141 A 71 PHE HA A 103 LEU HBx 1.0 . 4.08 151 142 A 118 TYR HA A 119 VAL H 1.0 . 3.46 152 143 A 118 TYR HA A 108 HIS HA 1.0 . 4.90 153 144 A 117 PRO HBx A 118 TYR HA 1.0 . 5.19 154 145 A 145 TRP HA A 125 ARG HBy 1.0 . 3.82 155 146 A 155 TYR HA A 156 ASP H 1.0 . 3.49 156 147 A 149 PHE HA A 150 GLN H 1.0 . 3.29 157 148 A 59 ILE HA A 59 ILE HG1y 1.0 . 3.91 158 149 A 59 ILE HA A 59 ILE HG1x 1.0 . 3.91 159 150 A 78 ARG HA A 97 ASP HA 1.0 . 4.02 160 151 A 56 THR HA A 57 PHE HA 1.0 . 4.60 161 152 A 188 LYS HA A 189 ILE H 1.0 . 3.29 162 153 A 151 VAL HA A 150 GLN HA 1.0 . 4.57 163 154 A 151 VAL H A 150 GLN HA 1.0 . 3.26 164 155 A 95 GLU HA A 94 SER HA 1.0 . 4.57 165 156 A 163 LEU HA A 164 ASN H 1.0 . 3.40 166 157 A 175 ASP HA A 176 VAL H 1.0 . 3.53 167 158 A 154 ARG HE A 163 LEU HA 1.0 . 5.20 168 159 A 190 GLU HA A 173 LYS HA 1.0 . 3.62 169 160 A 163 LEU HA A 200 ALA HB% 1.0 . 3.30 170 161 A 173 LYS HA A 174 THR H 1.0 . 3.36 171 162 A 154 ARG HE A 164 ASN HA 1.0 . 4.00 172 163 A 164 ASN HA A 154 ARG HA 1.0 . 3.92 173 164 A 164 ASN HBy A 154 ARG HA 1.0 . 3.94 174 165 A 83 GLY H A 82 GLN HA 1.0 . 3.41 175 166 A 92 ARG HA A 82 GLN HA 1.0 . 5.40 176 167 A 198 LEU HA A 199 GLY H 1.0 . 3.33 177 168 A 84 GLU HA A 46 ASP H 1.0 . 4.15 178 169 A 168 ARG HA A 168 ARG HDx 1.0 . 4.64 179 170 A 46 ASP HA A 47 VAL H 1.0 . 3.48 180 171 A 105 LEU HA A 106 GLN HA 1.0 . 4.62 181 172 A 106 GLN HA A 107 TYR H 1.0 . 3.54 182 173 A 168 ARG HA A 168 ARG HDy 1.0 . 4.64 183 174 A 180 LEU HA A 181 GLY H 1.0 . 3.40 184 175 A 60 ALA HB% A 70 ASP HA 1.0 . 3.88 185 176 A 164 ASN H A 200 ALA HA 1.0 . 3.55 186 177 A 163 LEU HA A 200 ALA HA 1.0 . 3.96 187 178 A 19 ALA HA A 20 SER H 1.0 . 3.56 188 179 A 102 ILE HA A 101 ALA HA 1.0 . 4.48 189 180 A 68 ALA HA A 63 VAL H 1.0 . 3.94 190 181 A 102 ILE HD1% A 103 LEU H 1.0 . 5.50 191 182 A 19 ALA H A 19 ALA HB% 1.0 . 4.19 192 183 A 93 VAL HA A 135 ALA H 1.0 . 4.25 193 184 A 135 ALA HB% A 135 ALA H 1.0 . 3.72 194 185 A 79 ALA H A 78 ARG HGx 1.0 . 4.09 195 185 A 78 ARG HGy A 79 ALA H 1.0 . 4.09 196 186 A 132 THR H A 133 ASP H 1.0 . 3.98 197 187 A 132 THR HA A 133 ASP H 1.0 . 2.95 198 188 A 132 THR HB A 133 ASP H 1.0 . 4.67 199 189 A 59 ILE HD1% A 60 ALA H 1.0 . 4.14 200 190 A 126 VAL H A 126 VAL HB 1.0 . 3.68 201 191 A 59 ILE HB A 60 ALA H 1.0 . 4.50 202 192 A 173 LYS HBx A 190 GLU H 1.0 . 4.77 203 193 A 67 ILE HG2% A 108 HIS H 1.0 . 4.04 204 194 A 140 ASP H A 139 PHE HA 1.0 . 3.26 205 195 A 156 ASP H A 156 ASP HBy 1.0 . 3.87 206 196 A 140 ASP H A 177 THR HG2% 1.0 . 4.51 207 197 A 61 TYR H A 62 PHE H 1.0 . 4.36 208 198 A 156 ASP H A 156 ASP HBx 1.0 . 3.87 209 199 A 140 ASP H A 140 ASP HBx 1.0 . 3.91 210 200 A 82 GLN H A 82 GLN HBx 1.0 . 3.95 211 201 A 78 ARG HBy A 97 ASP H 1.0 . 4.56 212 202 A 82 GLN H A 93 VAL HB 1.0 . 4.69 213 203 A 82 GLN H A 82 GLN HBy 1.0 . 4.04 214 204 A 67 ILE HA A 68 ALA H 1.0 . 3.39 215 205 A 82 GLN HBx A 92 ARG H 1.0 . 5.69 216 206 A 68 ALA HB% A 68 ALA H 1.0 . 3.70 217 207 A 27 TYR H A 193 PRO HBx 1.0 . 4.90 218 208 A 67 ILE HG2% A 68 ALA H 1.0 . 4.47 219 209 A 26 VAL H A 195 ILE HG2% 1.0 . 4.72 220 210 A 173 LYS HBx A 191 VAL H 1.0 . 4.28 221 211 A 195 ILE HG2% A 25 LYS H 1.0 . 3.99 222 212 A 27 TYR H A 195 ILE HA 1.0 . 3.94 223 213 A 27 TYR H A 193 PRO HBy 1.0 . 4.90 224 214 A 180 LEU H A 180 LEU HBx 1.0 . 4.12 225 215 A 59 ILE HD1% A 71 PHE H 1.0 . 5.16 226 216 A 191 VAL H A 191 VAL HB 1.0 . 3.82 227 217 A 71 PHE H A 72 PHE H 1.0 . 4.42 228 218 A 179 THR HB A 180 LEU H 1.0 . 4.44 229 219 A 70 ASP HA A 71 PHE H 1.0 . 3.46 230 220 A 180 LEU H A 180 LEU HBy 1.0 . 4.12 231 221 A 71 PHE H A 70 ASP H 1.0 . 4.34 232 222 A 23 PHE HA A 198 LEU H 1.0 . 4.68 233 223 A 143 ASP H A 142 LYS HBx 1.0 . 4.14 234 223 A 142 LYS HBy A 143 ASP H 1.0 . 4.14 235 224 A 20 SER H A 202 TYR H 1.0 . 4.85 236 225 A 142 LYS HA A 143 ASP H 1.0 . 3.50 237 226 A 150 GLN H A 121 VAL HB 1.0 . 4.05 238 227 A 105 LEU HA A 70 ASP H 1.0 . 3.67 239 228 A 19 ALA HB% A 202 TYR H 1.0 . 3.86 240 229 A 69 VAL HGy% A 70 ASP H 1.0 . 3.41 241 230 A 69 VAL HA A 70 ASP H 1.0 . 3.22 242 231 A 69 VAL HB A 70 ASP H 1.0 . 3.72 243 232 A 187 THR HG2% A 188 LYS H 1.0 . 4.31 244 233 A 163 LEU HA A 200 ALA H 1.0 . 4.80 245 234 A 93 VAL HGx% A 81 PHE H 1.0 . 5.62 246 235 A 80 LYS H A 80 LYS HBy 1.0 . 4.04 247 236 A 146 ALA H A 146 ALA HB% 1.0 . 4.03 248 237 A 200 ALA H A 22 ASN HBy 1.0 . 4.05 249 238 A 80 LYS H A 80 LYS HBx 1.0 . 4.04 250 239 A 27 TYR HA A 194 PHE H 1.0 . 4.64 251 240 A 168 ARG H A 167 VAL HA 1.0 . 3.54 252 241 A 168 ARG H A 195 ILE HB 1.0 . 3.92 253 242 A 132 THR H A 96 VAL HB 1.0 . 4.24 254 243 A 148 ALA HB% A 169 TYR H 1.0 . 3.64 255 244 A 183 VAL H A 184 PRO HDx 1.0 . 4.92 256 245 A 195 ILE H A 195 ILE HG1x 1.0 . 4.09 257 246 A 169 TYR H A 169 TYR HBx 1.0 . 4.05 258 247 A 176 VAL H A 176 VAL HB 1.0 . 3.92 259 248 A 69 VAL HGx% A 63 VAL H 1.0 . 4.60 260 249 A 169 TYR H A 169 TYR HBy 1.0 . 4.05 261 250 A 195 ILE HB A 195 ILE H 1.0 . 4.04 262 251 A 151 VAL H A 167 VAL HA 1.0 . 4.60 263 252 A 183 VAL H A 184 PRO HDy 1.0 . 4.92 264 253 A 164 ASN HBy A 164 ASN H 1.0 . 3.87 265 254 A 195 ILE H A 195 ILE HG1y 1.0 . 4.09 266 255 A 195 ILE HG2% A 195 ILE H 1.0 . 3.92 267 256 A 119 VAL H A 107 TYR H 1.0 . 3.74 268 257 A 93 VAL HGy% A 84 GLU H 1.0 . 3.73 269 258 A 88 SER HA A 84 GLU H 1.0 . 4.46 270 259 A 167 VAL HB A 151 VAL H 1.0 . 3.95 271 260 A 101 ALA HB% A 125 ARG H 1.0 . 3.83 272 261 A 154 ARG HBx A 155 TYR H 1.0 . 5.00 273 262 A 164 ASN HBy A 155 TYR H 1.0 . 4.32 274 263 A 131 LYS H A 131 LYS HBy 1.0 . 3.96 275 264 A 131 LYS H A 131 LYS HBx 1.0 . 3.96 276 265 A 164 ASN HA A 155 TYR H 1.0 . 3.68 277 266 A 154 ARG HBy A 155 TYR H 1.0 . 3.99 278 267 A 31 GLU HA A 30 GLU H 1.0 . 4.90 279 268 A 96 VAL HB A 131 LYS H 1.0 . 4.49 280 269 A 162 MET HBx A 163 LEU H 1.0 . 3.62 281 270 A 105 LEU H A 105 LEU HBx 1.0 . 3.84 282 271 A 173 LYS HBy A 189 ILE H 1.0 . 3.88 283 272 A 173 LYS HBx A 173 LYS H 1.0 . 4.12 284 273 A 86 SER H A 85 LYS HGx 1.0 . 3.85 285 273 A 85 LYS HGy A 86 SER H 1.0 . 3.85 286 274 A 105 LEU H A 105 LEU HG 1.0 . 4.39 287 275 A 59 ILE H A 59 ILE HD1% 1.0 . 3.69 288 276 A 185 VAL HA A 186 SER H 1.0 . 3.47 289 277 A 60 ALA HB% A 61 TYR H 1.0 . 3.85 290 278 A 78 ARG HBy A 78 ARG H 1.0 . 4.08 291 279 A 132 THR HG2% A 139 PHE H 1.0 . 4.28 292 280 A 187 THR HG2% A 186 SER H 1.0 . 4.09 293 281 A 14 GLN H A 13 ASN HBx 1.0 . 4.17 294 282 A 61 TYR H A 69 VAL HGy% 1.0 . 3.93 295 283 A 141 ILE H A 141 ILE HD1% 1.0 . 4.88 296 284 A 68 ALA HB% A 61 TYR H 1.0 . 3.83 297 285 A 61 TYR H A 60 ALA H 1.0 . 4.64 298 286 A 62 PHE HA A 61 TYR H 1.0 . 4.91 299 287 A 185 VAL HB A 186 SER H 1.0 . 4.48 300 288 A 141 ILE H A 141 ILE HB 1.0 . 4.04 301 289 A 69 VAL H A 69 VAL HGy% 1.0 . 3.58 302 290 A 69 VAL H A 68 ALA HB% 1.0 . 3.81 303 291 A 148 ALA HA A 149 PHE H 1.0 . 3.48 304 292 A 85 LYS H A 85 LYS HDy 1.0 . 4.06 305 293 A 60 ALA HB% A 18 VAL H 1.0 . 4.10 306 294 A 148 ALA HB% A 149 PHE H 1.0 . 3.57 307 295 A 167 VAL H A 151 VAL HGx% 1.0 . 5.38 308 296 A 167 VAL H A 151 VAL HGy% 1.0 . 5.38 309 297 A 84 GLU HA A 85 LYS H 1.0 . 3.52 310 298 A 85 LYS H A 85 LYS HDx 1.0 . 4.06 311 299 A 101 ALA HB% A 102 ILE H 1.0 . 4.04 312 300 A 101 ALA HA A 102 ILE H 1.0 . 3.40 313 301 A 85 LYS H A 85 LYS HGx 1.0 . 3.95 314 301 A 85 LYS HGy A 85 LYS H 1.0 . 3.95 315 302 A 164 ASN H A 165 SER H 1.0 . 4.83 316 303 A 166 ASP H A 165 SER H 1.0 . 5.14 317 304 A 151 VAL HA A 167 VAL H 1.0 . 4.55 318 305 A 165 SER H A 164 ASN HBx 1.0 . 4.26 319 306 A 164 ASN HBy A 165 SER H 1.0 . 4.16 320 307 A 67 ILE H A 67 ILE HB 1.0 . 4.04 321 308 A 103 LEU HA A 104 SER H 1.0 . 3.49 322 309 A 164 ASN HA A 165 SER H 1.0 . 3.28 323 310 A 21 PHE HA A 22 ASN H 1.0 . 3.41 324 311 A 12 TYR HA A 13 ASN H 1.0 . 3.46 325 312 A 123 VAL H A 123 VAL HB 1.0 . 4.09 326 313 A 70 ASP H A 104 SER H 1.0 . 3.83 327 314 A 80 LYS HA A 96 VAL H 1.0 . 3.76 328 315 A 96 VAL H A 79 ALA HB% 1.0 . 4.64 329 316 A 137 SER H A 137 SER HBy 1.0 . 3.98 330 317 A 118 TYR H A 117 PRO HBx 1.0 . 3.89 331 318 A 153 LEU H A 166 ASP HA 1.0 . 4.10 332 319 A 177 THR HA A 187 THR H 1.0 . 4.35 333 320 A 137 SER H A 137 SER HBx 1.0 . 3.98 334 321 A 187 THR H A 177 THR HB 1.0 . 4.09 335 322 A 96 VAL H A 78 ARG HGx 1.0 . 3.60 336 322 A 78 ARG HGy A 96 VAL H 1.0 . 3.60 337 323 A 59 ILE HD1% A 20 SER H 1.0 . 4.09 338 324 A 187 THR H A 187 THR HB 1.0 . 4.13 339 325 A 59 ILE HA A 20 SER H 1.0 . 3.88 340 326 A 187 THR H A 186 SER HBx 1.0 . 4.92 341 327 A 187 THR H A 186 SER HBy 1.0 . 4.92 342 328 A 21 PHE HA A 58 ASP H 1.0 . 3.96 343 329 A 148 ALA HB% A 148 ALA H 1.0 . 3.59 344 330 A 187 THR H A 187 THR HG2% 1.0 . 3.77 345 331 A 106 GLN H A 105 LEU HBy 1.0 . 4.05 346 332 A 177 THR H A 177 THR HB 1.0 . 3.90 347 333 A 105 LEU HG A 121 VAL H 1.0 . 3.97 348 334 A 177 THR H A 177 THR HG2% 1.0 . 3.67 349 335 A 54 THR HG2% A 54 THR H 1.0 . 3.93 350 336 A 48 SER H A 49 ILE HA 1.0 . 4.72 351 337 A 89 SER H A 89 SER HBy 1.0 . 4.08 352 338 A 89 SER H A 89 SER HBx 1.0 . 4.08 353 339 A 121 VAL HB A 121 VAL H 1.0 . 3.96 354 340 A 137 SER HA A 138 SER H 1.0 . 3.33 355 341 A 83 GLY HAx A 47 VAL H 1.0 . 4.05 356 342 A 95 GLU H A 132 THR H 1.0 . 4.11 357 343 A 83 GLY HAy A 47 VAL H 1.0 . 5.50 358 344 A 95 GLU H A 132 THR HB 1.0 . 5.50 359 345 A 163 LEU HA A 201 SER H 1.0 . 3.94 360 346 A 200 ALA H A 201 SER H 1.0 . 4.60 361 347 A 162 MET HBx A 201 SER H 1.0 . 4.07 362 348 A 179 THR HG2% A 179 THR H 1.0 . 3.94 363 349 A 93 VAL HGy% A 83 GLY H 1.0 . 3.89 364 350 A 119 VAL H A 108 HIS H 1.0 . 5.09 365 351 A 119 VAL H A 108 HIS HA 1.0 . 3.83 366 352 A 134 GLY H A 94 SER HA 1.0 . 3.88 367 353 A 152 GLY H A 117 PRO HBx 1.0 . 3.91 368 354 A 119 VAL H A 120 GLY H 1.0 . 4.97 369 355 A 121 VAL H A 120 GLY H 1.0 . 5.34 370 356 A 119 VAL HB A 120 GLY H 1.0 . 4.39 371 357 A 93 VAL HGy% A 94 SER H 1.0 . 4.16 372 358 A 93 VAL H A 94 SER H 1.0 . 3.81 373 359 A 93 VAL HGx% A 94 SER H 1.0 . 4.10 374 360 A 90 LEU H A 91 GLY H 1.0 . 3.67 375 361 A 178 GLY H A 177 THR HA 1.0 . 3.35 376 362 A 178 GLY H A 177 THR HB 1.0 . 3.82 377 363 A 178 GLY H A 177 THR HG2% 1.0 . 3.70 378 364 A 148 ALA H A 123 VAL HA 1.0 . 3.85 379 365 A 91 GLY H A 90 LEU N 1.0 . 3.78 380 366 A 94 SER H A 95 GLU N 1.0 . 3.88 381 367 A 135 ALA H A 134 GLY N 1.0 . 4.07 382 368 A 134 GLY H A 135 ALA N 1.0 . 4.15 383 369 A 178 GLY H A 185 VAL N 1.0 . 4.29 384 370 A 46 ASP H A 85 LYS N 1.0 . 3.85 385 371 A 123 VAL H A 103 LEU N 1.0 . 4.32 386 372 A 149 PHE H A 150 GLN N 1.0 . 4.28 387 373 A 167 VAL H A 166 ASP N 1.0 . 3.94 388 374 A 62 PHE H A 18 VAL N 1.0 . 4.56 389 375 A 68 ALA H A 69 VAL N 1.0 . 4.02 390 376 A 168 ARG H A 167 VAL N 1.0 . 3.86 391 377 A 81 PHE H A 95 GLU N 1.0 . 4.38 392 378 A 86 SER H A 87 ILE N 1.0 . 3.94 393 379 A 90 LEU H A 91 GLY N 1.0 . 3.93 394 380 A 134 GLY H A 94 SER N 1.0 . 4.27 395 381 A 87 ILE N A 88 SER H 1.0 . 3.85 396 382 A 88 SER H A 84 GLU N 1.0 . 3.99 397 383 A 64 SER N A 66 ASN H 1.0 . 5.08 398 384 A 12 TYR H A 13 ASN N 1.0 . 3.70 399 385 A 165 SER H A 166 ASP N 1.0 . 3.97 400 386 A 14 GLN N A 15 GLY H 1.0 . 3.86 401 387 A 18 VAL N A 17 TRP H 1.0 . 4.43 402 388 A 61 TYR H A 62 PHE N 1.0 . 4.19 403 389 A 69 VAL H A 62 PHE N 1.0 . 4.44 404 390 A 71 PHE H A 70 ASP N 1.0 . 3.94 405 391 A 83 GLY H A 84 GLU N 1.0 . 4.42 406 392 A 84 GLU H A 85 LYS N 1.0 . 4.32 407 393 A 95 GLU H A 133 ASP N 1.0 . 4.14 408 394 A 94 SER H A 134 GLY N 1.0 . 5.46 409 395 A 107 TYR H A 108 HIS N 1.0 . 4.09 410 396 A 119 VAL H A 108 HIS N 1.0 . 4.26 411 397 A 122 GLY H A 148 ALA N 1.0 . 4.32 412 398 A 126 VAL H A 127 LEU N 1.0 . 4.11 413 399 A 105 LEU H A 122 GLY N 1.0 . 4.35 414 400 A 70 ASP H A 71 PHE N 1.0 . 3.94 415 401 A 133 ASP HA A 132 THR CA 1.0 . 4.04 416 402 A 195 ILE HA A 196 LEU CA 1.0 . 4.00 417 403 A 145 TRP HA A 144 LYS CA 1.0 . 4.16 418 404 A 92 ARG H A 91 GLY H 1.0 . 3.77 419 405 A 140 ASP H A 178 GLY H 1.0 . 4.65 420 406 A 13 ASN H A 12 TYR H 1.0 . 4.00 421 407 A 153 LEU H A 165 SER H 1.0 . 3.30 422 408 A 165 SER H A 164 ASN HD2y 1.0 . 3.82 423 409 A 61 TYR H A 18 VAL H 1.0 . 5.14 424 410 A 14 GLN H A 15 GLY H 1.0 . 4.63 425 411 A 62 PHE H A 16 ASP H 1.0 . 4.10 426 412 A 13 ASN H A 16 ASP H 1.0 . 4.37 427 413 A 15 GLY H A 16 ASP H 1.0 . 3.71 428 414 A 62 PHE H A 17 TRP H 1.0 . 4.64 429 415 A 17 TRP H A 16 ASP H 1.0 . 4.66 430 416 A 59 ILE H A 58 ASP H 1.0 . 4.51 431 417 A 20 SER H A 19 ALA H 1.0 . 4.50 432 418 A 123 VAL H A 148 ALA H 1.0 . 4.77 433 419 A 48 SER H A 47 VAL H 1.0 . 4.67 434 420 A 57 PHE H A 56 THR H 1.0 . 4.60 435 421 A 20 SER H A 58 ASP H 1.0 . 4.03 436 422 A 60 ALA H A 71 PHE H 1.0 . 4.64 437 423 A 60 ALA H A 18 VAL H 1.0 . 4.23 438 424 A 14 GLN H A 16 ASP H 1.0 . 5.10 439 425 A 62 PHE H A 15 GLY H 1.0 . 5.10 440 426 A 64 SER H A 63 VAL H 1.0 . 3.72 441 427 A 63 VAL H A 15 GLY H 1.0 . 4.45 442 428 A 64 SER H A 66 ASN H 1.0 . 5.21 443 429 A 67 ILE H A 65 SER H 1.0 . 4.12 444 430 A 152 GLY H A 167 VAL H 1.0 . 4.88 445 431 A 66 ASN H A 65 SER H 1.0 . 4.05 446 432 A 67 ILE H A 66 ASN H 1.0 . 3.73 447 433 A 64 SER H A 67 ILE H 1.0 . 3.93 448 434 A 68 ALA H A 67 ILE H 1.0 . 4.38 449 435 A 69 VAL H A 63 VAL H 1.0 . 4.32 450 436 A 105 LEU H A 70 ASP H 1.0 . 4.77 451 437 A 69 VAL H A 70 ASP H 1.0 . 4.70 452 438 A 61 TYR H A 70 ASP H 1.0 . 4.77 453 439 A 26 VAL H A 25 LYS H 1.0 . 4.33 454 440 A 59 ILE H A 72 PHE H 1.0 . 5.02 455 441 A 103 LEU H A 72 PHE H 1.0 . 5.06 456 442 A 30 GLU H A 29 GLY H 1.0 . 3.75 457 443 A 30 GLU H A 31 GLU H 1.0 . 4.64 458 444 A 97 ASP HA A 79 ALA H 1.0 . 4.28 459 445 A 83 GLY H A 84 GLU H 1.0 . 3.97 460 446 A 84 GLU H A 85 LYS H 1.0 . 4.62 461 447 A 86 SER H A 87 ILE H 1.0 . 3.88 462 448 A 86 SER H A 85 LYS H 1.0 . 3.90 463 449 A 89 SER H A 87 ILE H 1.0 . 4.90 464 450 A 86 SER H A 88 SER H 1.0 . 4.04 465 451 A 83 GLY H A 88 SER H 1.0 . 4.56 466 452 A 89 SER H A 90 LEU H 1.0 . 3.71 467 453 A 89 SER H A 88 SER H 1.0 . 3.56 468 454 A 91 GLY H A 88 SER H 1.0 . 5.00 469 455 A 83 GLY H A 91 GLY H 1.0 . 6.17 470 456 A 92 ARG H A 90 LEU H 1.0 . 4.56 471 457 A 93 VAL H A 92 ARG H 1.0 . 3.95 472 458 A 81 PHE H A 94 SER H 1.0 . 3.92 473 459 A 95 GLU H A 94 SER H 1.0 . 4.38 474 460 A 46 ASP H A 47 VAL H 1.0 . 4.44 475 461 A 95 GLU H A 134 GLY H 1.0 . 4.21 476 462 A 32 LEU H A 47 VAL H 1.0 . 3.68 477 463 A 97 ASP H A 98 TYR H 1.0 . 4.79 478 464 A 22 ASN H A 56 THR H 1.0 . 3.64 479 465 A 103 LEU H A 104 SER H 1.0 . 4.47 480 466 A 103 LEU H A 102 ILE H 1.0 . 4.60 481 467 A 104 SER H A 123 VAL H 1.0 . 5.15 482 468 A 131 LYS H A 130 ASP H 1.0 . 4.33 483 469 A 132 THR H A 131 LYS H 1.0 . 3.44 484 470 A 105 LEU H A 104 SER H 1.0 . 4.50 485 471 A 106 GLN H A 68 ALA H 1.0 . 3.86 486 472 A 106 GLN H A 69 VAL H 1.0 . 4.90 487 473 A 108 HIS H A 108 HIS HD1 1.0 . 5.25 488 474 A 152 GLY H A 118 TYR H 1.0 . 3.37 489 475 A 118 TYR H A 119 VAL H 1.0 . 4.57 490 476 A 151 VAL H A 120 GLY H 1.0 . 5.50 491 477 A 107 TYR H A 120 GLY H 1.0 . 4.48 492 478 A 89 SER H A 91 GLY H 1.0 . 4.44 493 479 A 103 LEU H A 123 VAL H 1.0 . 3.61 494 480 A 22 ASN H A 23 PHE H 1.0 . 4.47 495 481 A 123 VAL H A 124 GLY H 1.0 . 4.49 496 482 A 125 ARG H A 124 GLY H 1.0 . 4.43 497 483 A 144 LYS H A 126 VAL H 1.0 . 4.18 498 484 A 126 VAL H A 146 ALA H 1.0 . 4.48 499 485 A 153 LEU H A 154 ARG H 1.0 . 4.43 500 486 A 203 VAL H A 204 PHE H 1.0 . 4.72 501 487 A 134 GLY H A 133 ASP H 1.0 . 4.63 502 488 A 134 GLY H A 135 ALA H 1.0 . 4.36 503 489 A 94 SER H A 135 ALA H 1.0 . 6.49 504 490 A 137 SER H A 136 LEU H 1.0 . 4.43 505 491 A 137 SER H A 138 SER H 1.0 . 4.29 506 492 A 177 THR H A 141 ILE H 1.0 . 4.87 507 493 A 141 ILE H A 140 ASP H 1.0 . 4.62 508 494 A 141 ILE H A 142 LYS H 1.0 . 4.72 509 495 A 144 LYS H A 143 ASP H 1.0 . 4.61 510 496 A 144 LYS H A 145 TRP H 1.0 . 4.45 511 497 A 46 ASP H A 88 SER H 1.0 . 5.20 512 498 A 46 ASP H A 45 ALA H 1.0 . 4.64 513 499 A 32 LEU H A 46 ASP H 1.0 . 4.35 514 500 A 149 PHE H A 148 ALA H 1.0 . 4.61 515 501 A 23 PHE H A 24 SER H 1.0 . 4.42 516 502 A 130 ASP H A 129 PHE H 1.0 . 4.62 517 503 A 155 TYR H A 154 ARG H 1.0 . 4.58 518 504 A 154 ARG HE A 155 TYR H 1.0 . 4.12 519 505 A 157 LEU H A 156 ASP H 1.0 . 4.56 520 506 A 154 ARG HE A 163 LEU H 1.0 . 4.71 521 507 A 157 LEU H A 163 LEU H 1.0 . 4.27 522 508 A 163 LEU H A 162 MET H 1.0 . 4.61 523 509 A 154 ARG HE A 164 ASN H 1.0 . 4.82 524 510 A 165 SER H A 164 ASN HD2x 1.0 . 3.82 525 511 A 168 ARG H A 167 VAL H 1.0 . 4.59 526 512 A 169 TYR H A 195 ILE H 1.0 . 5.22 527 513 A 135 ALA H A 136 LEU H 1.0 . 4.00 528 514 A 175 ASP H A 174 THR H 1.0 . 4.64 529 515 A 174 THR H A 173 LYS H 1.0 . 4.60 530 516 A 175 ASP H A 143 ASP H 1.0 . 5.23 531 517 A 175 ASP H A 189 ILE H 1.0 . 5.20 532 518 A 175 ASP H A 176 VAL H 1.0 . 4.51 533 519 A 177 THR H A 178 GLY H 1.0 . 4.44 534 520 A 140 ASP H A 179 THR H 1.0 . 5.18 535 521 A 180 LEU H A 179 THR H 1.0 . 4.31 536 522 A 187 THR H A 176 VAL H 1.0 . 3.49 537 523 A 195 ILE H A 196 LEU H 1.0 . 4.46 538 524 A 198 LEU H A 197 SER H 1.0 . 4.64 539 525 A 199 GLY H A 165 SER H 1.0 . 5.17 540 526 A 199 GLY H A 23 PHE H 1.0 . 4.99 541 527 A 202 TYR H A 203 VAL H 1.0 . 4.44 542 528 A 19 ALA H A 202 TYR H 1.0 . 3.38 543 529 A 25 LYS H A 196 LEU H 1.0 . 3.85 544 530 A 79 ALA H A 96 VAL H 1.0 . 3.88 545 531 A 72 PHE H A 102 ILE H 1.0 . 3.90 546 532 A 107 TYR H A 108 HIS H 1.0 . 4.49 547 533 A 133 ASP H A 139 PHE H 1.0 . 4.14 548 534 A 191 VAL H A 172 PHE H 1.0 . 3.92 549 535 A 99 GLY H A 127 LEU H 1.0 . 4.14 550 536 A 198 LEU H A 23 PHE H 1.0 . 3.82 551 537 A 146 ALA H A 124 GLY H 1.0 . 3.92 552 538 A 175 ASP H A 142 LYS H 1.0 . 4.50 553 539 A 168 ARG H A 195 ILE H 1.0 . 3.81 554 540 A 27 TYR H A 194 PHE H 1.0 . 3.91 555 541 A 169 TYR H A 149 PHE H 1.0 . 3.93 556 542 A 185 VAL H A 178 GLY H 1.0 . 3.68 557 543 A 125 ARG H A 101 ALA H 1.0 . 4.21 558 544 A 164 ASN H A 199 GLY H 1.0 . 3.94 559 545 A 155 TYR H A 163 LEU H 1.0 . 4.00 560 546 A 105 LEU H A 121 VAL H 1.0 . 3.61 561 547 A 59 ILE H A 71 PHE H 1.0 . 3.54 562 548 A 151 VAL H A 167 VAL H 1.0 . 3.31 563 549 A 17 TRP H A 204 PHE H 1.0 . 4.43 564 550 A 46 ASP H A 84 GLU H 1.0 . 4.17 565 551 A 57 PHE H A 73 VAL H 1.0 . 4.12 566 552 A 122 GLY H A 148 ALA H 1.0 . 3.77 567 553 A 189 ILE H A 174 THR H 1.0 . 4.10 568 554 A 201 SER H A 162 MET H 1.0 . 3.89 569 555 A 177 THR H A 140 ASP H 1.0 . 3.93 570 556 A 82 GLN H A 48 SER H 1.0 . 4.00 571 557 A 139 PHE H A 138 SER H 1.0 . 3.55 572 558 A 152 GLY H A 151 VAL H 1.0 . 4.42 573 559 A 150 GLN H A 120 GLY H 1.0 . 3.86 574 560 A 69 VAL H A 61 TYR H 1.0 . 3.23 575 561 A 13 ASN H A 12 TYR HBx 1.0 . 4.24 576 561 A 13 ASN H A 12 TYR HBy 1.0 . 4.24 577 562 A 13 ASN H A 13 ASN HBy 1.0 . 3.38 578 562 A 13 ASN H A 13 ASN HBx 1.0 . 3.38 579 563 A 14 GLN H A 13 ASN HBy 1.0 . 3.56 580 563 A 14 GLN H A 13 ASN HBx 1.0 . 3.56 581 564 A 14 GLN HBx A 15 GLY HAx 1.0 . 4.62 582 564 A 14 GLN HBy A 15 GLY HAx 1.0 . 4.62 583 564 A 15 GLY HAy A 14 GLN HBx 1.0 . 4.62 584 564 A 14 GLN HBy A 15 GLY HAy 1.0 . 4.62 585 565 A 16 ASP H A 62 PHE HBx 1.0 . 3.97 586 565 A 16 ASP H A 62 PHE HBy 1.0 . 3.97 587 566 A 19 ALA HB% A 202 TYR HBx 1.0 . 4.06 588 566 A 19 ALA HB% A 202 TYR HBy 1.0 . 4.06 589 567 A 20 SER HA A 201 SER HBx 1.0 . 3.82 590 567 A 20 SER HA A 201 SER HBy 1.0 . 3.82 591 568 A 20 SER HBx A 201 SER HBx 1.0 . 3.67 592 568 A 20 SER HBy A 201 SER HBx 1.0 . 3.67 593 568 A 201 SER HBy A 20 SER HBx 1.0 . 3.67 594 568 A 201 SER HBy A 20 SER HBy 1.0 . 3.67 595 569 A 21 PHE H A 21 PHE HBx 1.0 . 3.63 596 569 A 21 PHE H A 21 PHE HBy 1.0 . 3.63 597 570 A 58 ASP H A 21 PHE HBx 1.0 . 4.82 598 570 A 58 ASP H A 21 PHE HBy 1.0 . 4.82 599 571 A 27 TYR H A 193 PRO HBx 1.0 . 4.05 600 571 A 27 TYR H A 193 PRO HBy 1.0 . 4.05 601 572 A 27 TYR H A 195 ILE HG1y 1.0 . 4.77 602 572 A 27 TYR H A 195 ILE HG1x 1.0 . 4.77 603 573 A 47 VAL H A 47 VAL HGx% 1.0 . 4.13 604 573 A 47 VAL H A 47 VAL HGy% 1.0 . 4.13 605 574 A 83 GLY HAy A 47 VAL HGx% 1.0 . 4.09 606 574 A 83 GLY HAy A 47 VAL HGy% 1.0 . 4.09 607 575 A 71 PHE H A 58 ASP HBx 1.0 . 4.03 608 575 A 71 PHE H A 58 ASP HBy 1.0 . 4.03 609 576 A 59 ILE H A 59 ILE HG1y 1.0 . 4.19 610 576 A 59 ILE H A 59 ILE HG1x 1.0 . 4.19 611 577 A 59 ILE H A 71 PHE HBx 1.0 . 3.73 612 577 A 59 ILE H A 71 PHE HBy 1.0 . 3.73 613 578 A 59 ILE HA A 59 ILE HG1y 1.0 . 3.38 614 578 A 59 ILE HA A 59 ILE HG1x 1.0 . 3.38 615 579 A 60 ALA HA A 70 ASP HBx 1.0 . 4.74 616 579 A 60 ALA HA A 70 ASP HBy 1.0 . 4.74 617 580 A 63 VAL H A 63 VAL HGx% 1.0 . 4.06 618 580 A 63 VAL H A 63 VAL HGy% 1.0 . 4.06 619 581 A 63 VAL H A 64 SER HBx 1.0 . 4.76 620 581 A 63 VAL H A 64 SER HBy 1.0 . 4.76 621 582 A 65 SER H A 65 SER HBx 1.0 . 3.65 622 582 A 65 SER H A 65 SER HBy 1.0 . 3.65 623 583 A 69 VAL HA A 70 ASP HBx 1.0 . 4.40 624 583 A 69 VAL HA A 70 ASP HBy 1.0 . 4.40 625 584 A 69 VAL HGy% A 70 ASP HBx 1.0 . 5.09 626 584 A 69 VAL HGy% A 70 ASP HBy 1.0 . 5.09 627 585 A 70 ASP H A 70 ASP HBx 1.0 . 3.62 628 585 A 70 ASP H A 70 ASP HBy 1.0 . 3.62 629 586 A 71 PHE H A 70 ASP HBx 1.0 . 4.04 630 586 A 71 PHE H A 70 ASP HBy 1.0 . 4.04 631 587 A 71 PHE HA A 70 ASP HBx 1.0 . 4.78 632 587 A 71 PHE HA A 70 ASP HBy 1.0 . 4.78 633 588 A 105 LEU HA A 70 ASP HBx 1.0 . 5.09 634 588 A 105 LEU HA A 70 ASP HBy 1.0 . 5.09 635 589 A 71 PHE HBy A 73 VAL HGx% 1.0 . 4.16 636 589 A 71 PHE HBx A 73 VAL HGx% 1.0 . 4.16 637 589 A 73 VAL HGy% A 71 PHE HBx 1.0 . 4.16 638 589 A 71 PHE HBy A 73 VAL HGy% 1.0 . 4.16 639 590 A 72 PHE H A 72 PHE HBx 1.0 . 3.68 640 590 A 72 PHE H A 72 PHE HBy 1.0 . 3.68 641 591 A 102 ILE H A 72 PHE HBx 1.0 . 4.21 642 591 A 102 ILE H A 72 PHE HBy 1.0 . 4.21 643 592 A 73 VAL H A 73 VAL HGx% 1.0 . 3.93 644 592 A 73 VAL H A 73 VAL HGy% 1.0 . 3.93 645 593 A 98 TYR H A 76 PRO HBx 1.0 . 3.89 646 593 A 98 TYR H A 76 PRO HBy 1.0 . 3.89 647 594 A 76 PRO HBy A 98 TYR HBy 1.0 . 4.16 648 594 A 76 PRO HBx A 98 TYR HBy 1.0 . 4.16 649 594 A 98 TYR HBx A 76 PRO HBx 1.0 . 4.16 650 594 A 76 PRO HBy A 98 TYR HBx 1.0 . 4.16 651 595 A 98 TYR HA A 76 PRO HGx 1.0 . 4.82 652 595 A 76 PRO HGy A 98 TYR HA 1.0 . 4.82 653 596 A 76 PRO HGx A 98 TYR HBy 1.0 . 3.87 654 596 A 76 PRO HGy A 98 TYR HBy 1.0 . 3.87 655 596 A 98 TYR HBx A 76 PRO HGx 1.0 . 3.87 656 596 A 98 TYR HBx A 76 PRO HGy 1.0 . 3.87 657 597 A 76 PRO HGx A 100 PRO HDx 1.0 . 3.82 658 597 A 76 PRO HGy A 100 PRO HDx 1.0 . 3.82 659 597 A 100 PRO HDy A 76 PRO HGx 1.0 . 3.82 660 597 A 76 PRO HGy A 100 PRO HDy 1.0 . 3.82 661 598 A 76 PRO HDy A 100 PRO HDx 1.0 . 3.79 662 598 A 76 PRO HDx A 100 PRO HDx 1.0 . 3.79 663 598 A 100 PRO HDy A 76 PRO HDx 1.0 . 3.79 664 598 A 100 PRO HDy A 76 PRO HDy 1.0 . 3.79 665 599 A 78 ARG HA A 97 ASP HBy 1.0 . 4.64 666 599 A 78 ARG HA A 97 ASP HBx 1.0 . 4.64 667 600 A 78 ARG HBy A 97 ASP HBy 1.0 . 4.77 668 600 A 78 ARG HBy A 97 ASP HBx 1.0 . 4.77 669 601 A 79 ALA HA A 80 LYS HBy 1.0 . 4.36 670 601 A 79 ALA HA A 80 LYS HBx 1.0 . 4.36 671 602 A 80 LYS H A 80 LYS HBy 1.0 . 3.49 672 602 A 80 LYS H A 80 LYS HBx 1.0 . 3.49 673 603 A 80 LYS HA A 95 GLU HBx 1.0 . 3.70 674 603 A 80 LYS HA A 95 GLU HBy 1.0 . 3.70 675 604 A 81 PHE H A 80 LYS HBy 1.0 . 3.82 676 604 A 81 PHE H A 80 LYS HBx 1.0 . 3.82 677 605 A 82 GLN HBx A 88 SER HBx 1.0 . 4.74 678 605 A 82 GLN HBx A 88 SER HBy 1.0 . 4.74 679 606 A 83 GLY HAx A 87 ILE HG1x 1.0 . 7.03 680 606 A 83 GLY HAx A 87 ILE HG1y 1.0 . 7.03 681 607 A 84 GLU H A 84 GLU HBx 1.0 . 3.67 682 607 A 84 GLU H A 84 GLU HBy 1.0 . 3.67 683 608 A 84 GLU H A 87 ILE HG1x 1.0 . 5.46 684 608 A 84 GLU H A 87 ILE HG1y 1.0 . 5.46 685 609 A 84 GLU HA A 84 GLU HGx 1.0 . 3.54 686 609 A 84 GLU HA A 84 GLU HGy 1.0 . 3.54 687 610 A 84 GLU HA A 87 ILE HG1x 1.0 . 4.55 688 610 A 84 GLU HA A 87 ILE HG1y 1.0 . 4.55 689 611 A 84 GLU HA A 88 SER HBx 1.0 . 4.46 690 611 A 84 GLU HA A 88 SER HBy 1.0 . 4.46 691 612 A 84 GLU HBy A 88 SER HBx 1.0 . 4.10 692 612 A 88 SER HBy A 84 GLU HBx 1.0 . 4.10 693 612 A 88 SER HBy A 84 GLU HBy 1.0 . 4.10 694 612 A 84 GLU HBx A 88 SER HBx 1.0 . 4.10 695 613 A 85 LYS H A 84 GLU HGx 1.0 . 3.96 696 613 A 85 LYS H A 84 GLU HGy 1.0 . 3.96 697 614 A 84 GLU HGx A 85 LYS HGx 1.0 . 4.73 698 614 A 84 GLU HGy A 85 LYS HGx 1.0 . 4.73 699 614 A 85 LYS HGy A 84 GLU HGx 1.0 . 4.73 700 614 A 85 LYS HGy A 84 GLU HGy 1.0 . 4.73 701 615 A 84 GLU HGy A 85 LYS HDy 1.0 . 4.05 702 615 A 84 GLU HGx A 85 LYS HDy 1.0 . 4.05 703 615 A 85 LYS HDx A 84 GLU HGx 1.0 . 4.05 704 615 A 84 GLU HGy A 85 LYS HDx 1.0 . 4.05 705 616 A 86 SER H A 85 LYS HBx 1.0 . 3.76 706 616 A 86 SER H A 85 LYS HBy 1.0 . 3.76 707 617 A 86 SER H A 85 LYS HDy 1.0 . 4.45 708 617 A 86 SER H A 85 LYS HDx 1.0 . 4.45 709 618 A 86 SER HA A 85 LYS HDy 1.0 . 6.06 710 618 A 85 LYS HDx A 86 SER HA 1.0 . 6.06 711 619 A 85 LYS HDy A 185 VAL HGx% 1.0 . 6.99 712 619 A 85 LYS HDx A 185 VAL HGx% 1.0 . 6.99 713 619 A 185 VAL HG21 A 85 LYS HDy 1.0 . 6.99 714 619 A 85 LYS HDx A 185 VAL HG21 1.0 . 6.99 715 620 A 86 SER H A 86 SER HBx 1.0 . 3.60 716 620 A 86 SER H A 86 SER HBy 1.0 . 3.60 717 621 A 88 SER H A 87 ILE HG1x 1.0 . 4.07 718 621 A 88 SER H A 87 ILE HG1y 1.0 . 4.07 719 622 A 88 SER HA A 87 ILE HG1x 1.0 . 5.65 720 622 A 88 SER HA A 87 ILE HG1y 1.0 . 5.65 721 623 A 93 VAL HA A 87 ILE HG1x 1.0 . 4.91 722 623 A 93 VAL HA A 87 ILE HG1y 1.0 . 4.91 723 624 A 93 VAL HGy% A 87 ILE HG1x 1.0 . 4.22 724 624 A 93 VAL HGy% A 87 ILE HG1y 1.0 . 4.22 725 625 A 89 SER H A 88 SER HBx 1.0 . 3.82 726 625 A 89 SER H A 88 SER HBy 1.0 . 3.82 727 626 A 93 VAL HGy% A 88 SER HBx 1.0 . 4.74 728 626 A 93 VAL HGy% A 88 SER HBy 1.0 . 4.74 729 627 A 89 SER H A 89 SER HBy 1.0 . 3.29 730 627 A 89 SER H A 89 SER HBx 1.0 . 3.29 731 628 A 92 ARG HA A 91 GLY HAx 1.0 . 4.38 732 628 A 92 ARG HA A 91 GLY HAy 1.0 . 4.38 733 629 A 93 VAL HA A 134 GLY HAx 1.0 . 4.74 734 629 A 93 VAL HA A 134 GLY HAy 1.0 . 4.74 735 630 A 94 SER HA A 133 ASP HBx 1.0 . 4.10 736 630 A 94 SER HA A 133 ASP HBy 1.0 . 4.10 737 631 A 94 SER HA A 134 GLY HAx 1.0 . 4.27 738 631 A 94 SER HA A 134 GLY HAy 1.0 . 4.27 739 632 A 133 ASP HA A 94 SER HBx 1.0 . 4.04 740 632 A 133 ASP HA A 94 SER HBy 1.0 . 4.04 741 633 A 95 GLU H A 95 GLU HBx 1.0 . 3.69 742 633 A 95 GLU H A 95 GLU HBy 1.0 . 3.69 743 634 A 96 VAL HGx% A 129 PHE HBx 1.0 . 3.93 744 634 A 96 VAL HGy% A 129 PHE HBx 1.0 . 3.93 745 634 A 129 PHE HBy A 96 VAL HGx% 1.0 . 3.93 746 634 A 96 VAL HGy% A 129 PHE HBy 1.0 . 3.93 747 635 A 130 ASP H A 96 VAL HGx% 1.0 . 4.80 748 635 A 130 ASP H A 96 VAL HGy% 1.0 . 4.80 749 636 A 131 LYS H A 96 VAL HGx% 1.0 . 3.93 750 636 A 131 LYS H A 96 VAL HGy% 1.0 . 3.93 751 637 A 132 THR H A 96 VAL HGx% 1.0 . 4.15 752 637 A 132 THR H A 96 VAL HGy% 1.0 . 4.15 753 638 A 97 ASP H A 129 PHE HBx 1.0 . 5.29 754 638 A 97 ASP H A 129 PHE HBy 1.0 . 5.29 755 639 A 101 ALA H A 100 PRO HBx 1.0 . 3.86 756 639 A 101 ALA H A 100 PRO HBy 1.0 . 3.86 757 640 A 102 ILE HG2% A 168 ARG HGx 1.0 . 3.87 758 640 A 102 ILE HG2% A 168 ARG HGy 1.0 . 3.87 759 641 A 103 LEU H A 102 ILE HG1x 1.0 . 5.20 760 641 A 103 LEU H A 102 ILE HG1y 1.0 . 5.20 761 642 A 102 ILE HG1x A 168 ARG HGx 1.0 . 4.95 762 642 A 168 ARG HGy A 102 ILE HG1x 1.0 . 4.95 763 642 A 168 ARG HGy A 102 ILE HG1y 1.0 . 4.95 764 642 A 102 ILE HG1y A 168 ARG HGx 1.0 . 4.95 765 643 A 103 LEU H A 123 VAL HGx% 1.0 . 3.87 766 643 A 103 LEU H A 123 VAL HGy% 1.0 . 3.87 767 644 A 103 LEU HBy A 123 VAL HGx% 1.0 . 4.42 768 644 A 103 LEU HBy A 123 VAL HGy% 1.0 . 4.42 769 645 A 105 LEU H A 104 SER HBy 1.0 . 3.97 770 645 A 105 LEU H A 104 SER HBx 1.0 . 3.97 771 646 A 106 GLN H A 106 GLN HBx 1.0 . 3.60 772 646 A 106 GLN H A 106 GLN HBy 1.0 . 3.60 773 647 A 107 TYR H A 106 GLN HBx 1.0 . 4.39 774 647 A 107 TYR H A 106 GLN HBy 1.0 . 4.39 775 648 A 107 TYR HA A 106 GLN HBx 1.0 . 4.76 776 648 A 106 GLN HBy A 107 TYR HA 1.0 . 4.76 777 649 A 119 VAL H A 106 GLN HBx 1.0 . 5.03 778 649 A 119 VAL H A 106 GLN HBy 1.0 . 5.03 779 650 A 107 TYR H A 118 TYR HBy 1.0 . 3.81 780 650 A 107 TYR H A 118 TYR HBx 1.0 . 3.81 781 651 A 108 HIS H A 118 TYR HBy 1.0 . 4.04 782 651 A 108 HIS H A 118 TYR HBx 1.0 . 4.04 783 652 A 108 HIS HBy A 118 TYR HBy 1.0 . 4.40 784 652 A 108 HIS HBx A 118 TYR HBy 1.0 . 4.40 785 652 A 118 TYR HBx A 108 HIS HBy 1.0 . 4.40 786 652 A 118 TYR HBx A 108 HIS HBx 1.0 . 4.40 787 653 A 117 PRO HBx A 118 TYR HBy 1.0 . 4.84 788 653 A 117 PRO HBx A 118 TYR HBx 1.0 . 4.84 789 654 A 117 PRO HBx A 151 VAL HGy% 1.0 . 3.99 790 654 A 117 PRO HBx A 151 VAL HGx% 1.0 . 3.99 791 655 A 118 TYR H A 151 VAL HGy% 1.0 . 4.37 792 655 A 118 TYR H A 151 VAL HGx% 1.0 . 4.37 793 656 A 118 TYR H A 152 GLY HAy 1.0 . 4.35 794 656 A 118 TYR H A 152 GLY HAx 1.0 . 4.35 795 657 A 118 TYR HA A 119 VAL HGy% 1.0 . 3.87 796 657 A 118 TYR HA A 119 VAL HGx% 1.0 . 3.87 797 658 A 152 GLY H A 118 TYR HBy 1.0 . 4.72 798 658 A 152 GLY H A 118 TYR HBx 1.0 . 4.72 799 659 A 119 VAL H A 119 VAL HGy% 1.0 . 3.80 800 659 A 119 VAL H A 119 VAL HGx% 1.0 . 3.80 801 660 A 119 VAL HA A 120 GLY HAx 1.0 . 4.35 802 660 A 119 VAL HA A 120 GLY HAy 1.0 . 4.35 803 661 A 121 VAL HA A 120 GLY HAx 1.0 . 4.35 804 661 A 121 VAL HA A 120 GLY HAy 1.0 . 4.35 805 662 A 121 VAL H A 121 VAL HGx% 1.0 . 3.84 806 662 A 121 VAL H A 121 VAL HGy% 1.0 . 3.84 807 663 A 121 VAL HA A 122 GLY HAx 1.0 . 4.36 808 663 A 121 VAL HA A 122 GLY HAy 1.0 . 4.36 809 664 A 122 GLY H A 121 VAL HGx% 1.0 . 3.71 810 664 A 122 GLY H A 121 VAL HGy% 1.0 . 3.71 811 665 A 150 GLN H A 121 VAL HGx% 1.0 . 4.01 812 665 A 150 GLN H A 121 VAL HGy% 1.0 . 4.01 813 666 A 124 GLY H A 123 VAL HGx% 1.0 . 3.99 814 666 A 124 GLY H A 123 VAL HGy% 1.0 . 3.99 815 667 A 125 ARG H A 125 ARG HBy 1.0 . 3.51 816 667 A 125 ARG H A 125 ARG HBx 1.0 . 3.51 817 668 A 125 ARG HBy A 145 TRP HBx 1.0 . 4.03 818 668 A 125 ARG HBx A 145 TRP HBx 1.0 . 4.03 819 668 A 145 TRP HBy A 125 ARG HBy 1.0 . 4.03 820 668 A 125 ARG HBx A 145 TRP HBy 1.0 . 4.03 821 669 A 146 ALA H A 125 ARG HBy 1.0 . 3.98 822 669 A 146 ALA H A 125 ARG HBx 1.0 . 3.98 823 670 A 131 LYS H A 131 LYS HBx 1.0 . 3.43 824 670 A 131 LYS H A 131 LYS HBy 1.0 . 3.43 825 671 A 131 LYS H A 131 LYS HGx 1.0 . 4.36 826 671 A 131 LYS H A 131 LYS HGy 1.0 . 4.36 827 672 A 131 LYS HA A 131 LYS HGx 1.0 . 3.69 828 672 A 131 LYS HGy A 131 LYS HA 1.0 . 3.69 829 673 A 132 THR H A 131 LYS HBx 1.0 . 3.88 830 673 A 132 THR H A 131 LYS HBy 1.0 . 3.88 831 674 A 133 ASP H A 139 PHE HBx 1.0 . 4.41 832 674 A 133 ASP H A 139 PHE HBy 1.0 . 4.41 833 675 A 134 GLY H A 133 ASP HBx 1.0 . 3.99 834 675 A 134 GLY H A 133 ASP HBy 1.0 . 3.99 835 676 A 133 ASP HBx A 139 PHE HBx 1.0 . 3.14 836 676 A 133 ASP HBy A 139 PHE HBx 1.0 . 3.14 837 676 A 139 PHE HBy A 133 ASP HBx 1.0 . 3.14 838 676 A 133 ASP HBy A 139 PHE HBy 1.0 . 3.14 839 677 A 134 GLY H A 139 PHE HBx 1.0 . 4.73 840 677 A 134 GLY H A 139 PHE HBy 1.0 . 4.73 841 678 A 134 GLY HAx A 139 PHE HBx 1.0 . 4.33 842 678 A 134 GLY HAy A 139 PHE HBx 1.0 . 4.33 843 678 A 139 PHE HBy A 134 GLY HAx 1.0 . 4.33 844 678 A 134 GLY HAy A 139 PHE HBy 1.0 . 4.33 845 679 A 137 SER HA A 138 SER HBx 1.0 . 4.91 846 679 A 137 SER HA A 138 SER HBy 1.0 . 4.91 847 680 A 138 SER H A 137 SER HBy 1.0 . 4.45 848 680 A 138 SER H A 137 SER HBx 1.0 . 4.45 849 681 A 139 PHE H A 139 PHE HBx 1.0 . 3.23 850 681 A 139 PHE H A 139 PHE HBy 1.0 . 3.23 851 682 A 139 PHE HA A 140 ASP HBy 1.0 . 4.33 852 682 A 139 PHE HA A 140 ASP HBx 1.0 . 4.33 853 683 A 140 ASP H A 140 ASP HBy 1.0 . 3.33 854 683 A 140 ASP H A 140 ASP HBx 1.0 . 3.33 855 684 A 140 ASP H A 176 VAL HGx% 1.0 . 4.41 856 684 A 140 ASP H A 176 VAL HGy% 1.0 . 4.41 857 685 A 140 ASP H A 178 GLY HAx 1.0 . 4.19 858 685 A 140 ASP H A 178 GLY HAy 1.0 . 4.19 859 686 A 141 ILE HA A 140 ASP HBy 1.0 . 4.37 860 686 A 141 ILE HA A 140 ASP HBx 1.0 . 4.37 861 687 A 177 THR H A 140 ASP HBy 1.0 . 4.54 862 687 A 177 THR H A 140 ASP HBx 1.0 . 4.54 863 688 A 177 THR HG2% A 140 ASP HBy 1.0 . 4.85 864 688 A 177 THR HG2% A 140 ASP HBx 1.0 . 4.85 865 689 A 141 ILE HA A 141 ILE HG1y 1.0 . 3.71 866 689 A 141 ILE HA A 141 ILE HG1x 1.0 . 3.71 867 690 A 141 ILE HA A 176 VAL HGx% 1.0 . 3.58 868 690 A 141 ILE HA A 176 VAL HGy% 1.0 . 3.58 869 691 A 141 ILE HB A 176 VAL HGx% 1.0 . 3.91 870 691 A 141 ILE HB A 176 VAL HGy% 1.0 . 3.91 871 692 A 141 ILE HG1x A 176 VAL HGx% 1.0 . 3.88 872 692 A 141 ILE HG1y A 176 VAL HGx% 1.0 . 3.88 873 692 A 176 VAL HGy% A 141 ILE HG1y 1.0 . 3.88 874 692 A 176 VAL HGy% A 141 ILE HG1x 1.0 . 3.88 875 693 A 143 ASP H A 143 ASP HBy 1.0 . 3.67 876 693 A 143 ASP H A 143 ASP HBx 1.0 . 3.67 877 694 A 144 LYS H A 143 ASP HBy 1.0 . 4.00 878 694 A 144 LYS H A 143 ASP HBx 1.0 . 4.00 879 695 A 148 ALA H A 147 PRO HBx 1.0 . 3.87 880 695 A 148 ALA H A 147 PRO HBy 1.0 . 3.87 881 696 A 148 ALA HB% A 168 ARG HBy 1.0 . 4.72 882 696 A 148 ALA HB% A 168 ARG HBx 1.0 . 4.72 883 697 A 149 PHE H A 149 PHE HBx 1.0 . 3.50 884 697 A 149 PHE H A 149 PHE HBy 1.0 . 3.50 885 698 A 149 PHE H A 169 TYR HBy 1.0 . 4.61 886 698 A 149 PHE H A 169 TYR HBx 1.0 . 4.61 887 699 A 150 GLN H A 150 GLN HBx 1.0 . 3.68 888 699 A 150 GLN H A 150 GLN HBy 1.0 . 3.68 889 700 A 151 VAL H A 150 GLN HBx 1.0 . 4.06 890 700 A 151 VAL H A 150 GLN HBy 1.0 . 4.06 891 701 A 151 VAL H A 150 GLN HE2x 1.0 . 4.65 892 701 A 151 VAL H A 150 GLN HE2y 1.0 . 4.65 893 702 A 167 VAL H A 150 GLN HE2x 1.0 . 5.18 894 702 A 167 VAL H A 150 GLN HE2y 1.0 . 5.18 895 703 A 168 ARG H A 150 GLN HE2x 1.0 . 4.52 896 703 A 168 ARG H A 150 GLN HE2y 1.0 . 4.52 897 704 A 151 VAL H A 167 VAL HGy% 1.0 . 3.95 898 704 A 151 VAL H A 167 VAL HGx% 1.0 . 3.95 899 705 A 167 VAL H A 151 VAL HGy% 1.0 . 4.40 900 705 A 167 VAL H A 151 VAL HGx% 1.0 . 4.40 901 706 A 167 VAL HB A 151 VAL HGy% 1.0 . 4.56 902 706 A 167 VAL HB A 151 VAL HGx% 1.0 . 4.56 903 707 A 166 ASP HA A 152 GLY HAy 1.0 . 3.69 904 707 A 166 ASP HA A 152 GLY HAx 1.0 . 3.69 905 708 A 153 LEU H A 164 ASN HD2x 1.0 . 4.83 906 708 A 153 LEU H A 164 ASN HD2y 1.0 . 4.83 907 709 A 153 LEU H A 166 ASP HBx 1.0 . 5.16 908 709 A 153 LEU H A 166 ASP HBy 1.0 . 5.16 909 710 A 154 ARG H A 153 LEU HBx 1.0 . 4.21 910 710 A 154 ARG H A 153 LEU HBy 1.0 . 4.21 911 711 A 154 ARG HBx A 154 ARG HDx 1.0 . 3.67 912 711 A 154 ARG HBx A 154 ARG HDy 1.0 . 3.67 913 712 A 155 TYR H A 154 ARG HDx 1.0 . 3.88 914 712 A 155 TYR H A 154 ARG HDy 1.0 . 3.88 915 713 A 155 TYR HA A 154 ARG HDx 1.0 . 3.80 916 713 A 155 TYR HA A 154 ARG HDy 1.0 . 3.80 917 714 A 162 MET HBy A 154 ARG HDx 1.0 . 3.55 918 714 A 162 MET HBy A 154 ARG HDy 1.0 . 3.55 919 715 A 154 ARG HE A 164 ASN HD2x 1.0 . 3.90 920 715 A 154 ARG HE A 164 ASN HD2y 1.0 . 3.90 921 716 A 155 TYR H A 155 TYR HBx 1.0 . 3.62 922 716 A 155 TYR H A 155 TYR HBy 1.0 . 3.62 923 717 A 155 TYR H A 163 LEU HBx 1.0 . 5.08 924 717 A 155 TYR H A 163 LEU HBy 1.0 . 5.08 925 718 A 156 ASP HBx A 162 MET HGx 1.0 . 4.68 926 718 A 156 ASP HBy A 162 MET HGx 1.0 . 4.68 927 718 A 162 MET HGy A 156 ASP HBx 1.0 . 4.68 928 718 A 156 ASP HBy A 162 MET HGy 1.0 . 4.68 929 719 A 163 LEU H A 156 ASP HBx 1.0 . 4.93 930 719 A 163 LEU H A 156 ASP HBy 1.0 . 4.93 931 720 A 163 LEU HA A 201 SER HBx 1.0 . 5.04 932 720 A 163 LEU HA A 201 SER HBy 1.0 . 5.04 933 721 A 164 ASN H A 163 LEU HBx 1.0 . 3.71 934 721 A 164 ASN H A 163 LEU HBy 1.0 . 3.71 935 722 A 164 ASN HBx A 164 ASN HD2x 1.0 . 3.55 936 722 A 164 ASN HBx A 164 ASN HD2y 1.0 . 3.55 937 723 A 165 SER H A 164 ASN HD2x 1.0 . 3.24 938 723 A 165 SER H A 164 ASN HD2y 1.0 . 3.24 939 724 A 166 ASP H A 164 ASN HD2x 1.0 . 5.34 940 724 A 166 ASP H A 164 ASN HD2y 1.0 . 5.34 941 725 A 166 ASP H A 167 VAL HGy% 1.0 . 4.02 942 725 A 166 ASP H A 167 VAL HGx% 1.0 . 4.02 943 726 A 166 ASP HA A 167 VAL HGy% 1.0 . 3.40 944 726 A 166 ASP HA A 167 VAL HGx% 1.0 . 3.40 945 727 A 167 VAL H A 166 ASP HBx 1.0 . 4.03 946 727 A 167 VAL H A 166 ASP HBy 1.0 . 4.03 947 728 A 167 VAL H A 167 VAL HGy% 1.0 . 3.63 948 728 A 167 VAL H A 167 VAL HGx% 1.0 . 3.63 949 729 A 195 ILE H A 167 VAL HGy% 1.0 . 4.57 950 729 A 195 ILE H A 167 VAL HGx% 1.0 . 4.57 951 730 A 168 ARG H A 168 ARG HBy 1.0 . 3.45 952 730 A 168 ARG H A 168 ARG HBx 1.0 . 3.45 953 731 A 168 ARG H A 168 ARG HDx 1.0 . 4.56 954 731 A 168 ARG H A 168 ARG HDy 1.0 . 4.56 955 732 A 168 ARG HA A 168 ARG HDx 1.0 . 4.00 956 732 A 168 ARG HA A 168 ARG HDy 1.0 . 4.00 957 733 A 169 TYR H A 168 ARG HBy 1.0 . 4.35 958 733 A 169 TYR H A 168 ARG HBx 1.0 . 4.35 959 734 A 195 ILE H A 168 ARG HBy 1.0 . 4.02 960 734 A 195 ILE H A 168 ARG HBx 1.0 . 4.02 961 735 A 195 ILE HB A 168 ARG HBy 1.0 . 3.60 962 735 A 195 ILE HB A 168 ARG HBx 1.0 . 3.60 963 736 A 195 ILE HG2% A 168 ARG HBy 1.0 . 3.89 964 736 A 195 ILE HG2% A 168 ARG HBx 1.0 . 3.89 965 737 A 195 ILE HB A 168 ARG HGx 1.0 . 4.45 966 737 A 195 ILE HB A 168 ARG HGy 1.0 . 4.45 967 738 A 169 TYR H A 168 ARG HDx 1.0 . 4.51 968 738 A 169 TYR H A 168 ARG HDy 1.0 . 4.51 969 739 A 195 ILE H A 168 ARG HDx 1.0 . 4.27 970 739 A 195 ILE H A 168 ARG HDy 1.0 . 4.27 971 740 A 195 ILE HB A 168 ARG HDx 1.0 . 3.83 972 740 A 195 ILE HB A 168 ARG HDy 1.0 . 3.83 973 741 A 168 ARG HDx A 195 ILE HG1y 1.0 . 3.85 974 741 A 168 ARG HDy A 195 ILE HG1y 1.0 . 3.85 975 741 A 195 ILE HG1x A 168 ARG HDx 1.0 . 3.85 976 741 A 195 ILE HG1x A 168 ARG HDy 1.0 . 3.85 977 742 A 173 LYS H A 172 PHE HBy 1.0 . 4.06 978 742 A 173 LYS H A 172 PHE HBx 1.0 . 4.06 979 743 A 173 LYS HA A 173 LYS HGy 1.0 . 3.59 980 743 A 173 LYS HA A 173 LYS HGx 1.0 . 3.59 981 744 A 174 THR HA A 175 ASP HBy 1.0 . 4.28 982 744 A 174 THR HA A 175 ASP HBx 1.0 . 4.28 983 745 A 175 ASP HA A 176 VAL HGx% 1.0 . 4.12 984 745 A 175 ASP HA A 176 VAL HGy% 1.0 . 4.12 985 746 A 177 THR H A 176 VAL HGx% 1.0 . 3.46 986 746 A 177 THR H A 176 VAL HGy% 1.0 . 3.46 987 747 A 177 THR HA A 176 VAL HGx% 1.0 . 3.66 988 747 A 177 THR HA A 176 VAL HGy% 1.0 . 3.66 989 748 A 187 THR H A 176 VAL HGx% 1.0 . 4.35 990 748 A 187 THR H A 176 VAL HGy% 1.0 . 4.35 991 749 A 177 THR HA A 186 SER HBy 1.0 . 4.74 992 749 A 177 THR HA A 186 SER HBx 1.0 . 4.74 993 750 A 177 THR HB A 186 SER HBy 1.0 . 4.13 994 750 A 177 THR HB A 186 SER HBx 1.0 . 4.13 995 751 A 177 THR HG2% A 186 SER HBy 1.0 . 4.11 996 751 A 177 THR HG2% A 186 SER HBx 1.0 . 4.11 997 752 A 184 PRO HBy A 178 GLY HAx 1.0 . 5.88 998 752 A 184 PRO HBy A 178 GLY HAy 1.0 . 5.88 999 753 A 179 THR H A 180 LEU HBx 1.0 . 5.84 1000 753 A 179 THR H A 180 LEU HBy 1.0 . 5.84 1001 754 A 183 VAL H A 182 PRO HBx 1.0 . 3.99 1002 754 A 183 VAL H A 182 PRO HBy 1.0 . 3.99 1003 755 A 183 VAL HA A 184 PRO HDx 1.0 . 3.29 1004 755 A 183 VAL HA A 184 PRO HDy 1.0 . 3.29 1005 756 A 183 VAL HB A 184 PRO HDx 1.0 . 4.27 1006 756 A 183 VAL HB A 184 PRO HDy 1.0 . 4.27 1007 757 A 187 THR H A 186 SER HBy 1.0 . 4.21 1008 757 A 187 THR H A 186 SER HBx 1.0 . 4.21 1009 758 A 189 ILE H A 188 LYS HGy 1.0 . 3.75 1010 758 A 189 ILE H A 188 LYS HGx 1.0 . 3.75 1011 759 A 189 ILE HA A 188 LYS HGy 1.0 . 3.89 1012 759 A 188 LYS HGx A 189 ILE HA 1.0 . 3.89 1013 760 A 190 GLU H A 188 LYS HGy 1.0 . 4.80 1014 760 A 190 GLU H A 188 LYS HGx 1.0 . 4.80 1015 761 A 189 ILE HA A 188 LYS HEx 1.0 . 4.29 1016 761 A 189 ILE HA A 188 LYS HEy 1.0 . 4.29 1017 762 A 190 GLU HA A 191 VAL HGx% 1.0 . 4.11 1018 762 A 190 GLU HA A 191 VAL HGy% 1.0 . 4.11 1019 763 A 191 VAL H A 191 VAL HGx% 1.0 . 4.00 1020 763 A 191 VAL H A 191 VAL HGy% 1.0 . 4.00 1021 764 A 194 PHE H A 193 PRO HBx 1.0 . 3.82 1022 764 A 194 PHE H A 193 PRO HBy 1.0 . 3.82 1023 765 A 195 ILE H A 194 PHE HBx 1.0 . 4.24 1024 765 A 195 ILE H A 194 PHE HBy 1.0 . 4.24 1025 766 A 195 ILE H A 195 ILE HG1y 1.0 . 3.59 1026 766 A 195 ILE H A 195 ILE HG1x 1.0 . 3.59 1027 767 A 195 ILE HA A 195 ILE HG1y 1.0 . 3.60 1028 767 A 195 ILE HA A 195 ILE HG1x 1.0 . 3.60 1029 768 A 195 ILE HA A 196 LEU HBx 1.0 . 4.71 1030 768 A 195 ILE HA A 196 LEU HBy 1.0 . 4.71 1031 769 A 202 TYR H A 202 TYR HBx 1.0 . 3.67 1032 769 A 202 TYR H A 202 TYR HBy 1.0 . 3.67 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 16 ASP H A 62 PHE O 1.0 . 2.05 2 2 A 62 PHE O A 16 ASP N 1.0 . 3.05 3 3 A 62 PHE H A 16 ASP O 1.0 . 2.05 4 4 A 62 PHE N A 16 ASP O 1.0 . 3.05 5 5 A 18 VAL H A 60 ALA O 1.0 . 2.05 6 6 A 18 VAL N A 60 ALA O 1.0 . 3.05 7 7 A 60 ALA H A 18 VAL O 1.0 . 2.05 8 8 A 18 VAL O A 60 ALA N 1.0 . 3.05 9 9 A 20 SER H A 58 ASP O 1.0 . 2.05 10 10 A 58 ASP O A 20 SER N 1.0 . 3.05 11 11 A 58 ASP H A 20 SER O 1.0 . 2.05 12 12 A 20 SER O A 58 ASP N 1.0 . 3.05 13 13 A 22 ASN H A 56 THR O 1.0 . 2.05 14 14 A 56 THR O A 22 ASN N 1.0 . 3.05 15 15 A 56 THR H A 22 ASN O 1.0 . 2.05 16 16 A 22 ASN O A 56 THR N 1.0 . 3.05 17 17 A 45 ALA H A 34 ASP H 1.0 . 5.00 18 18 A 32 LEU H A 47 VAL H 1.0 . 5.00 19 19 A 33 GLY H A 188 LYS H 1.0 . 5.00 20 20 A 61 TYR H A 69 VAL O 1.0 . 2.05 21 21 A 69 VAL O A 61 TYR N 1.0 . 3.05 22 22 A 69 VAL H A 61 TYR O 1.0 . 2.05 23 23 A 69 VAL N A 61 TYR O 1.0 . 3.05 24 24 A 59 ILE H A 71 PHE O 1.0 . 2.05 25 25 A 71 PHE O A 59 ILE N 1.0 . 3.05 26 26 A 71 PHE H A 59 ILE O 1.0 . 2.05 27 27 A 71 PHE N A 59 ILE O 1.0 . 3.05 28 28 A 57 PHE H A 73 VAL O 1.0 . 2.05 29 29 A 73 VAL O A 57 PHE N 1.0 . 3.05 30 30 A 73 VAL H A 57 PHE O 1.0 . 2.05 31 31 A 57 PHE O A 73 VAL N 1.0 . 3.05 32 32 A 48 SER H A 82 GLN O 1.0 . 2.05 33 33 A 82 GLN O A 48 SER N 1.0 . 3.05 34 34 A 82 GLN H A 48 SER O 1.0 . 2.05 35 35 A 48 SER O A 82 GLN N 1.0 . 3.05 36 36 A 46 ASP H A 84 GLU H 1.0 . 5.00 37 37 A 68 ALA H A 106 GLN O 1.0 . 2.05 38 38 A 106 GLN O A 68 ALA N 1.0 . 3.05 39 39 A 106 GLN H A 68 ALA O 1.0 . 2.05 40 40 A 68 ALA O A 106 GLN N 1.0 . 3.05 41 41 A 70 ASP H A 104 SER O 1.0 . 2.05 42 42 A 70 ASP N A 104 SER O 1.0 . 3.05 43 43 A 104 SER H A 70 ASP O 1.0 . 2.05 44 44 A 70 ASP O A 104 SER N 1.0 . 3.05 45 45 A 72 PHE H A 102 ILE O 1.0 . 2.05 46 46 A 102 ILE O A 72 PHE N 1.0 . 3.05 47 47 A 102 ILE H A 72 PHE O 1.0 . 2.05 48 48 A 72 PHE O A 102 ILE N 1.0 . 3.05 49 49 A 79 ALA H A 96 VAL O 1.0 . 2.05 50 50 A 96 VAL O A 79 ALA N 1.0 . 3.05 51 51 A 96 VAL H A 79 ALA O 1.0 . 2.05 52 52 A 79 ALA O A 96 VAL N 1.0 . 3.05 53 53 A 81 PHE H A 94 SER O 1.0 . 2.05 54 54 A 94 SER O A 81 PHE N 1.0 . 3.05 55 55 A 94 SER H A 81 PHE O 1.0 . 2.05 56 56 A 94 SER N A 81 PHE O 1.0 . 3.05 57 57 A 83 GLY H A 91 GLY H 1.0 . 6.20 58 58 A 107 TYR H A 119 VAL O 1.0 . 2.05 59 59 A 119 VAL O A 107 TYR N 1.0 . 3.05 60 60 A 119 VAL H A 107 TYR O 1.0 . 2.05 61 61 A 107 TYR O A 119 VAL N 1.0 . 3.05 62 62 A 105 LEU H A 121 VAL O 1.0 . 2.05 63 63 A 121 VAL O A 105 LEU N 1.0 . 3.05 64 64 A 121 VAL H A 105 LEU O 1.0 . 2.05 65 65 A 105 LEU O A 121 VAL N 1.0 . 3.05 66 66 A 103 LEU H A 123 VAL O 1.0 . 2.05 67 67 A 103 LEU N A 123 VAL O 1.0 . 3.05 68 68 A 123 VAL H A 103 LEU O 1.0 . 2.05 69 69 A 103 LEU O A 123 VAL N 1.0 . 3.05 70 70 A 101 ALA H A 125 ARG O 1.0 . 2.05 71 71 A 125 ARG O A 101 ALA N 1.0 . 3.05 72 72 A 125 ARG H A 101 ALA O 1.0 . 2.05 73 73 A 101 ALA O A 125 ARG N 1.0 . 3.05 74 74 A 99 GLY H A 127 LEU O 1.0 . 2.05 75 75 A 127 LEU O A 99 GLY N 1.0 . 3.05 76 76 A 127 LEU H A 99 GLY O 1.0 . 2.05 77 77 A 127 LEU N A 99 GLY O 1.0 . 3.05 78 78 A 95 GLU H A 132 THR O 1.0 . 2.05 79 79 A 95 GLU N A 132 THR O 1.0 . 3.05 80 80 A 132 THR H A 95 GLU O 1.0 . 2.05 81 81 A 95 GLU O A 132 THR N 1.0 . 3.05 82 82 A 118 TYR H A 152 GLY O 1.0 . 2.05 83 83 A 152 GLY O A 118 TYR N 1.0 . 3.05 84 84 A 152 GLY H A 118 TYR O 1.0 . 2.05 85 85 A 118 TYR O A 152 GLY N 1.0 . 3.05 86 86 A 120 GLY H A 150 GLN O 1.0 . 2.05 87 87 A 150 GLN O A 120 GLY N 1.0 . 3.05 88 88 A 150 GLN H A 120 GLY O 1.0 . 2.05 89 89 A 150 GLN N A 120 GLY O 1.0 . 3.05 90 90 A 122 GLY H A 148 ALA O 1.0 . 2.05 91 91 A 122 GLY N A 148 ALA O 1.0 . 3.05 92 92 A 148 ALA H A 122 GLY O 1.0 . 2.05 93 93 A 148 ALA N A 122 GLY O 1.0 . 3.05 94 94 A 124 GLY H A 146 ALA O 1.0 . 2.05 95 95 A 146 ALA O A 124 GLY N 1.0 . 3.05 96 96 A 146 ALA H A 124 GLY O 1.0 . 2.05 97 97 A 124 GLY O A 146 ALA N 1.0 . 3.05 98 98 A 126 VAL H A 144 LYS O 1.0 . 2.05 99 99 A 144 LYS O A 126 VAL N 1.0 . 3.05 100 100 A 144 LYS H A 126 VAL O 1.0 . 2.05 101 101 A 126 VAL O A 144 LYS N 1.0 . 3.05 102 102 A 133 ASP H A 139 PHE O 1.0 . 2.05 103 103 A 133 ASP N A 139 PHE O 1.0 . 3.05 104 104 A 139 PHE H A 133 ASP O 1.0 . 2.05 105 105 A 133 ASP O A 139 PHE N 1.0 . 3.05 106 106 A 155 TYR H A 163 LEU O 1.0 . 2.05 107 107 A 163 LEU O A 155 TYR N 1.0 . 3.05 108 108 A 163 LEU H A 155 TYR O 1.0 . 2.05 109 109 A 155 TYR O A 163 LEU N 1.0 . 3.05 110 110 A 153 LEU H A 165 SER O 1.0 . 2.05 111 111 A 165 SER O A 153 LEU N 1.0 . 3.05 112 112 A 165 SER H A 153 LEU O 1.0 . 2.05 113 113 A 153 LEU O A 165 SER N 1.0 . 3.05 114 114 A 151 VAL H A 167 VAL O 1.0 . 2.05 115 115 A 167 VAL O A 151 VAL N 1.0 . 3.05 116 116 A 167 VAL H A 151 VAL O 1.0 . 2.05 117 117 A 167 VAL N A 151 VAL O 1.0 . 3.05 118 118 A 149 PHE H A 169 TYR O 1.0 . 2.05 119 119 A 169 TYR O A 149 PHE N 1.0 . 3.05 120 120 A 169 TYR H A 149 PHE O 1.0 . 2.05 121 121 A 149 PHE O A 169 TYR N 1.0 . 3.05 122 122 A 142 LYS H A 175 ASP O 1.0 . 2.05 123 123 A 175 ASP O A 142 LYS N 1.0 . 3.05 124 124 A 175 ASP H A 142 LYS O 1.0 . 2.05 125 125 A 142 LYS O A 175 ASP N 1.0 . 3.05 126 126 A 140 ASP H A 177 THR O 1.0 . 2.05 127 127 A 177 THR O A 140 ASP N 1.0 . 3.05 128 128 A 177 THR H A 140 ASP O 1.0 . 2.05 129 129 A 140 ASP O A 177 THR N 1.0 . 3.05 130 130 A 162 MET H A 201 SER O 1.0 . 2.05 131 131 A 201 SER O A 162 MET N 1.0 . 3.05 132 132 A 201 SER H A 162 MET O 1.0 . 2.05 133 133 A 162 MET O A 201 SER N 1.0 . 3.05 134 134 A 164 ASN H A 199 GLY O 1.0 . 2.05 135 135 A 199 GLY O A 164 ASN N 1.0 . 3.05 136 136 A 199 GLY H A 164 ASN O 1.0 . 2.05 137 137 A 164 ASN O A 199 GLY N 1.0 . 3.05 138 138 A 166 ASP H A 197 SER O 1.0 . 2.05 139 139 A 166 ASP N A 197 SER O 1.0 . 3.05 140 140 A 197 SER H A 166 ASP O 1.0 . 2.05 141 141 A 166 ASP O A 197 SER N 1.0 . 3.05 142 142 A 168 ARG H A 195 ILE O 1.0 . 2.05 143 143 A 195 ILE O A 168 ARG N 1.0 . 3.05 144 144 A 195 ILE H A 168 ARG O 1.0 . 2.05 145 145 A 168 ARG O A 195 ILE N 1.0 . 3.05 146 146 A 174 THR H A 189 ILE O 1.0 . 2.05 147 147 A 189 ILE O A 174 THR N 1.0 . 3.05 148 148 A 189 ILE H A 174 THR O 1.0 . 2.05 149 149 A 174 THR O A 189 ILE N 1.0 . 3.05 150 150 A 172 PHE H A 191 VAL O 1.0 . 2.05 151 151 A 191 VAL O A 172 PHE N 1.0 . 3.05 152 152 A 191 VAL H A 172 PHE O 1.0 . 2.05 153 153 A 172 PHE O A 191 VAL N 1.0 . 3.05 154 154 A 176 VAL H A 187 THR O 1.0 . 2.05 155 155 A 187 THR O A 176 VAL N 1.0 . 3.05 156 156 A 187 THR H A 176 VAL O 1.0 . 2.05 157 157 A 176 VAL O A 187 THR N 1.0 . 3.05 158 158 A 185 VAL H A 178 GLY H 1.0 . 5.00 159 159 A 204 PHE H A 17 TRP O 1.0 . 2.05 160 160 A 17 TRP O A 204 PHE N 1.0 . 3.05 161 161 A 17 TRP H A 204 PHE O 1.0 . 2.05 162 162 A 204 PHE O A 17 TRP N 1.0 . 3.05 163 163 A 202 TYR H A 19 ALA O 1.0 . 2.05 164 164 A 19 ALA O A 202 TYR N 1.0 . 3.05 165 165 A 19 ALA H A 202 TYR O 1.0 . 2.05 166 166 A 202 TYR O A 19 ALA N 1.0 . 3.05 167 167 A 200 ALA H A 21 PHE O 1.0 . 2.05 168 168 A 21 PHE O A 200 ALA N 1.0 . 3.05 169 169 A 21 PHE H A 200 ALA O 1.0 . 2.05 170 170 A 200 ALA O A 21 PHE N 1.0 . 3.05 171 171 A 198 LEU H A 23 PHE O 1.0 . 2.05 172 172 A 23 PHE O A 198 LEU N 1.0 . 3.05 173 173 A 23 PHE H A 198 LEU O 1.0 . 2.05 174 174 A 198 LEU O A 23 PHE N 1.0 . 3.05 175 175 A 196 LEU H A 25 LYS O 1.0 . 2.05 176 176 A 25 LYS O A 196 LEU N 1.0 . 3.05 177 177 A 25 LYS H A 196 LEU O 1.0 . 2.05 178 178 A 196 LEU O A 25 LYS N 1.0 . 3.05 179 179 A 194 PHE H A 27 TYR O 1.0 . 2.05 180 180 A 27 TYR O A 194 PHE N 1.0 . 3.05 181 181 A 27 TYR H A 194 PHE O 1.0 . 2.05 182 182 A 194 PHE O A 27 TYR N 1.0 . 3.05 183 183 A 88 SER H A 84 GLU O 1.0 . 3.05 184 184 A 84 GLU O A 88 SER N 1.0 . 3.85 185 185 A 89 SER H A 85 LYS O 1.0 . 3.05 186 186 A 85 LYS O A 89 SER N 1.0 . 3.85 187 187 A 90 LEU H A 86 SER O 1.0 . 2.55 188 188 A 90 LEU N A 86 SER O 1.0 . 3.55 189 189 A 91 GLY H A 87 ILE O 1.0 . 2.55 190 190 A 91 GLY N A 87 ILE O 1.0 . 3.55 stop_ save_ save_DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 12 TYR C A 13 ASN N A 13 ASN CA A 13 ASN C 1.0 -168.225 -99.177 PHI 2 2 A 13 ASN N A 13 ASN CA A 13 ASN C A 14 GLN N 1.0 133.899 185.439 PSI 3 3 A 13 ASN C A 14 GLN N A 14 GLN CA A 14 GLN C 1.0 -69.275 -42.125 PHI 4 4 A 14 GLN N A 14 GLN CA A 14 GLN C A 15 GLY N 1.0 119.987 141.695 PSI 5 5 A 14 GLN C A 15 GLY N A 15 GLY CA A 15 GLY C 1.0 83.709 110.673 PHI 6 6 A 15 GLY N A 15 GLY CA A 15 GLY C A 16 ASP N 1.0 -31.814 4.264 PSI 7 7 A 15 GLY C A 16 ASP N A 16 ASP CA A 16 ASP C 1.0 -81.801 -54.873 PHI 8 8 A 16 ASP N A 16 ASP CA A 16 ASP C A 17 TRP N 1.0 126.950 173.438 PSI 9 9 A 16 ASP C A 17 TRP N A 17 TRP CA A 17 TRP C 1.0 -162.485 -69.635 PHI 10 10 A 17 TRP N A 17 TRP CA A 17 TRP C A 18 VAL N 1.0 121.984 169.750 PSI 11 11 A 17 TRP C A 18 VAL N A 18 VAL CA A 18 VAL C 1.0 -153.241 -103.405 PHI 12 12 A 18 VAL N A 18 VAL CA A 18 VAL C A 19 ALA N 1.0 106.228 160.312 PSI 13 13 A 18 VAL C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -154.835 -83.735 PHI 14 14 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 SER N 1.0 101.880 168.552 PSI 15 15 A 19 ALA C A 20 SER N A 20 SER CA A 20 SER C 1.0 -178.121 -74.525 PHI 16 16 A 20 SER N A 20 SER CA A 20 SER C A 21 PHE N 1.0 109.877 165.323 PSI 17 17 A 20 SER C A 21 PHE N A 21 PHE CA A 21 PHE C 1.0 -169.575 -97.155 PHI 18 18 A 21 PHE N A 21 PHE CA A 21 PHE C A 22 ASN N 1.0 117.581 183.953 PSI 19 19 A 21 PHE C A 22 ASN N A 22 ASN CA A 22 ASN C 1.0 -176.941 -99.163 PHI 20 20 A 22 ASN N A 22 ASN CA A 22 ASN C A 23 PHE N 1.0 115.507 172.033 PSI 21 21 A 22 ASN C A 23 PHE N A 23 PHE CA A 23 PHE C 1.0 -165.293 -45.443 PHI 22 22 A 23 PHE N A 23 PHE CA A 23 PHE C A 24 SER N 1.0 100.136 160.994 PSI 23 23 A 23 PHE C A 24 SER N A 24 SER CA A 24 SER C 1.0 -153.129 -79.005 PHI 24 24 A 24 SER N A 24 SER CA A 24 SER C A 25 LYS N 1.0 105.289 158.449 PSI 25 25 A 24 SER C A 25 LYS N A 25 LYS CA A 25 LYS C 1.0 -174.305 -87.893 PHI 26 26 A 25 LYS N A 25 LYS CA A 25 LYS C A 26 VAL N 1.0 107.063 168.455 PSI 27 27 A 25 LYS C A 26 VAL N A 26 VAL CA A 26 VAL C 1.0 -133.673 -76.247 PHI 28 28 A 26 VAL N A 26 VAL CA A 26 VAL C A 27 TYR N 1.0 105.372 146.616 PSI 29 29 A 26 VAL C A 27 TYR N A 27 TYR CA A 27 TYR C 1.0 -134.962 -72.568 PHI 30 30 A 27 TYR N A 27 TYR CA A 27 TYR C A 28 VAL N 1.0 99.729 155.781 PSI 31 31 A 27 TYR C A 28 VAL N A 28 VAL CA A 28 VAL C 1.0 -183.165 -73.131 PHI 32 32 A 28 VAL N A 28 VAL CA A 28 VAL C A 29 GLY N 1.0 80.120 201.536 PSI 33 33 A 29 GLY C A 30 GLU N A 30 GLU CA A 30 GLU C 1.0 -89.636 -47.228 PHI 34 34 A 30 GLU N A 30 GLU CA A 30 GLU C A 31 GLU N 1.0 -65.791 -8.203 PSI 35 35 A 30 GLU C A 31 GLU N A 31 GLU CA A 31 GLU C 1.0 -201.721 -58.549 PHI 36 36 A 31 GLU N A 31 GLU CA A 31 GLU C A 32 LEU N 1.0 90.899 190.481 PSI 37 37 A 31 GLU C A 32 LEU N A 32 LEU CA A 32 LEU C 1.0 -110.140 -38.158 PHI 38 38 A 32 LEU N A 32 LEU CA A 32 LEU C A 33 GLY N 1.0 83.166 191.778 PSI 39 39 A 40 GLY C A 41 ALA N A 41 ALA CA A 41 ALA C 1.0 -123.325 -35.455 PHI 40 40 A 41 ALA N A 41 ALA CA A 41 ALA C A 42 LEU N 1.0 95.895 180.939 PSI 41 41 A 45 ALA C A 46 ASP N A 46 ASP CA A 46 ASP C 1.0 -179.778 -121.320 PHI 42 42 A 46 ASP N A 46 ASP CA A 46 ASP C A 47 VAL N 1.0 126.256 192.706 PSI 43 43 A 46 ASP C A 47 VAL N A 47 VAL CA A 47 VAL C 1.0 -165.197 -105.191 PHI 44 44 A 47 VAL N A 47 VAL CA A 47 VAL C A 48 SER N 1.0 128.840 171.350 PSI 45 45 A 47 VAL C A 48 SER N A 48 SER CA A 48 SER C 1.0 -174.780 -97.248 PHI 46 46 A 48 SER N A 48 SER CA A 48 SER C A 49 ILE N 1.0 119.331 188.199 PSI 47 47 A 48 SER C A 49 ILE N A 49 ILE CA A 49 ILE C 1.0 -156.247 -50.875 PHI 48 48 A 49 ILE N A 49 ILE CA A 49 ILE C A 50 GLY N 1.0 100.677 157.887 PSI 49 49 A 53 THR C A 54 THR N A 54 THR CA A 54 THR C 1.0 -162.844 -90.118 PHI 50 50 A 54 THR N A 54 THR CA A 54 THR C A 55 LEU N 1.0 106.952 192.704 PSI 51 51 A 54 THR C A 55 LEU N A 55 LEU CA A 55 LEU C 1.0 -159.775 -89.989 PHI 52 52 A 55 LEU N A 55 LEU CA A 55 LEU C A 56 THR N 1.0 114.919 169.189 PSI 53 53 A 55 LEU C A 56 THR N A 56 THR CA A 56 THR C 1.0 -181.113 -98.583 PHI 54 54 A 56 THR N A 56 THR CA A 56 THR C A 57 PHE N 1.0 130.378 183.952 PSI 55 55 A 56 THR C A 57 PHE N A 57 PHE CA A 57 PHE C 1.0 -172.041 -103.143 PHI 56 56 A 57 PHE N A 57 PHE CA A 57 PHE C A 58 ASP N 1.0 133.501 174.937 PSI 57 57 A 57 PHE C A 58 ASP N A 58 ASP CA A 58 ASP C 1.0 -174.944 -117.824 PHI 58 58 A 58 ASP N A 58 ASP CA A 58 ASP C A 59 ILE N 1.0 116.245 184.843 PSI 59 59 A 58 ASP C A 59 ILE N A 59 ILE CA A 59 ILE C 1.0 -155.198 -109.394 PHI 60 60 A 59 ILE N A 59 ILE CA A 59 ILE C A 60 ALA N 1.0 115.733 174.347 PSI 61 61 A 59 ILE C A 60 ALA N A 60 ALA CA A 60 ALA C 1.0 -153.279 -101.823 PHI 62 62 A 60 ALA N A 60 ALA CA A 60 ALA C A 61 TYR N 1.0 106.232 177.932 PSI 63 63 A 60 ALA C A 61 TYR N A 61 TYR CA A 61 TYR C 1.0 -162.946 -87.460 PHI 64 64 A 61 TYR N A 61 TYR CA A 61 TYR C A 62 PHE N 1.0 99.844 153.940 PSI 65 65 A 61 TYR C A 62 PHE N A 62 PHE CA A 62 PHE C 1.0 -102.310 -44.644 PHI 66 66 A 62 PHE N A 62 PHE CA A 62 PHE C A 63 VAL N 1.0 95.095 159.565 PSI 67 67 A 62 PHE C A 63 VAL N A 63 VAL CA A 63 VAL C 1.0 -128.790 -47.820 PHI 68 68 A 63 VAL N A 63 VAL CA A 63 VAL C A 64 SER N 1.0 -67.816 5.036 PSI 69 69 A 63 VAL C A 64 SER N A 64 SER CA A 64 SER C 1.0 -173.341 -124.417 PHI 70 70 A 64 SER N A 64 SER CA A 64 SER C A 65 SER N 1.0 158.901 198.609 PSI 71 71 A 64 SER C A 65 SER N A 65 SER CA A 65 SER C 1.0 -87.220 -38.920 PHI 72 72 A 65 SER N A 65 SER CA A 65 SER C A 66 ASN N 1.0 -53.904 2.364 PSI 73 73 A 65 SER C A 66 ASN N A 66 ASN CA A 66 ASN C 1.0 -140.749 -102.499 PHI 74 74 A 66 ASN N A 66 ASN CA A 66 ASN C A 67 ILE N 1.0 -33.810 28.938 PSI 75 75 A 66 ASN C A 67 ILE N A 67 ILE CA A 67 ILE C 1.0 -180.590 -61.694 PHI 76 76 A 67 ILE N A 67 ILE CA A 67 ILE C A 68 ALA N 1.0 91.942 172.264 PSI 77 77 A 67 ILE C A 68 ALA N A 68 ALA CA A 68 ALA C 1.0 -161.544 -92.370 PHI 78 78 A 68 ALA N A 68 ALA CA A 68 ALA C A 69 VAL N 1.0 118.200 172.626 PSI 79 79 A 68 ALA C A 69 VAL N A 69 VAL CA A 69 VAL C 1.0 -152.326 -78.970 PHI 80 80 A 69 VAL N A 69 VAL CA A 69 VAL C A 70 ASP N 1.0 109.014 150.948 PSI 81 81 A 69 VAL C A 70 ASP N A 70 ASP CA A 70 ASP C 1.0 -148.271 -100.457 PHI 82 82 A 70 ASP N A 70 ASP CA A 70 ASP C A 71 PHE N 1.0 107.954 170.726 PSI 83 83 A 70 ASP C A 71 PHE N A 71 PHE CA A 71 PHE C 1.0 -149.977 -86.707 PHI 84 84 A 71 PHE N A 71 PHE CA A 71 PHE C A 72 PHE N 1.0 111.156 149.496 PSI 85 85 A 71 PHE C A 72 PHE N A 72 PHE CA A 72 PHE C 1.0 -157.371 -81.549 PHI 86 86 A 72 PHE N A 72 PHE CA A 72 PHE C A 73 VAL N 1.0 93.149 175.517 PSI 87 87 A 72 PHE C A 73 VAL N A 73 VAL CA A 73 VAL C 1.0 -161.261 -54.911 PHI 88 88 A 73 VAL N A 73 VAL CA A 73 VAL C A 74 GLY N 1.0 91.075 163.105 PSI 89 89 A 76 PRO N A 76 PRO CA A 76 PRO C A 77 ALA N 1.0 119.587 162.565 PSI 90 90 A 76 PRO C A 77 ALA N A 77 ALA CA A 77 ALA C 1.0 -184.620 -67.572 PHI 91 91 A 77 ALA N A 77 ALA CA A 77 ALA C A 78 ARG N 1.0 95.695 202.777 PSI 92 92 A 77 ALA C A 78 ARG N A 78 ARG CA A 78 ARG C 1.0 -143.528 -78.338 PHI 93 93 A 78 ARG N A 78 ARG CA A 78 ARG C A 79 ALA N 1.0 96.978 154.614 PSI 94 94 A 78 ARG C A 79 ALA N A 79 ALA CA A 79 ALA C 1.0 -133.635 -84.771 PHI 95 95 A 79 ALA N A 79 ALA CA A 79 ALA C A 80 LYS N 1.0 96.520 150.508 PSI 96 96 A 79 ALA C A 80 LYS N A 80 LYS CA A 80 LYS C 1.0 -134.511 -60.909 PHI 97 97 A 80 LYS N A 80 LYS CA A 80 LYS C A 81 PHE N 1.0 92.619 149.943 PSI 98 98 A 80 LYS C A 81 PHE N A 81 PHE CA A 81 PHE C 1.0 -141.792 -58.818 PHI 99 99 A 81 PHE N A 81 PHE CA A 81 PHE C A 82 GLN N 1.0 92.897 158.009 PSI 100 100 A 81 PHE C A 82 GLN N A 82 GLN CA A 82 GLN C 1.0 -148.416 -72.726 PHI 101 101 A 82 GLN N A 82 GLN CA A 82 GLN C A 83 GLY N 1.0 95.549 187.403 PSI 102 102 A 83 GLY C A 84 GLU N A 84 GLU CA A 84 GLU C 1.0 -178.227 -101.853 PHI 103 103 A 84 GLU N A 84 GLU CA A 84 GLU C A 85 LYS N 1.0 117.489 199.065 PSI 104 104 A 84 GLU C A 85 LYS N A 85 LYS CA A 85 LYS C 1.0 -84.431 -3.405 PHI 105 105 A 85 LYS N A 85 LYS CA A 85 LYS C A 86 SER N 1.0 -67.988 2.974 PSI 106 106 A 85 LYS C A 86 SER N A 86 SER CA A 86 SER C 1.0 -82.776 -45.644 PHI 107 107 A 86 SER N A 86 SER CA A 86 SER C A 87 ILE N 1.0 -49.386 -6.888 PSI 108 108 A 86 SER C A 87 ILE N A 87 ILE CA A 87 ILE C 1.0 -146.588 -64.092 PHI 109 109 A 87 ILE N A 87 ILE CA A 87 ILE C A 88 SER N 1.0 -32.573 54.603 PSI 110 110 A 87 ILE C A 88 SER N A 88 SER CA A 88 SER C 1.0 -73.338 -45.108 PHI 111 111 A 88 SER N A 88 SER CA A 88 SER C A 89 SER N 1.0 -58.959 -15.705 PSI 112 112 A 88 SER C A 89 SER N A 89 SER CA A 89 SER C 1.0 -83.204 -45.998 PHI 113 113 A 89 SER N A 89 SER CA A 89 SER C A 90 LEU N 1.0 -50.900 -5.156 PSI 114 114 A 89 SER C A 90 LEU N A 90 LEU CA A 90 LEU C 1.0 -98.059 -54.541 PHI 115 115 A 90 LEU N A 90 LEU CA A 90 LEU C A 91 GLY N 1.0 -52.951 14.939 PSI 116 116 A 90 LEU C A 91 GLY N A 91 GLY CA A 91 GLY C 1.0 47.880 156.348 PHI 117 117 A 91 GLY N A 91 GLY CA A 91 GLY C A 92 ARG N 1.0 -13.103 43.519 PSI 118 118 A 91 GLY C A 92 ARG N A 92 ARG CA A 92 ARG C 1.0 -119.973 -34.129 PHI 119 119 A 92 ARG N A 92 ARG CA A 92 ARG C A 93 VAL N 1.0 81.419 177.673 PSI 120 120 A 92 ARG C A 93 VAL N A 93 VAL CA A 93 VAL C 1.0 -112.900 -31.838 PHI 121 121 A 93 VAL N A 93 VAL CA A 93 VAL C A 94 SER N 1.0 -62.927 -20.465 PSI 122 122 A 93 VAL C A 94 SER N A 94 SER CA A 94 SER C 1.0 -194.816 -141.182 PHI 123 123 A 94 SER N A 94 SER CA A 94 SER C A 95 GLU N 1.0 144.558 192.378 PSI 124 124 A 94 SER C A 95 GLU N A 95 GLU CA A 95 GLU C 1.0 -175.881 -108.837 PHI 125 125 A 95 GLU N A 95 GLU CA A 95 GLU C A 96 VAL N 1.0 120.111 182.829 PSI 126 126 A 95 GLU C A 96 VAL N A 96 VAL CA A 96 VAL C 1.0 -177.323 -102.035 PHI 127 127 A 96 VAL N A 96 VAL CA A 96 VAL C A 97 ASP N 1.0 102.607 183.223 PSI 128 128 A 96 VAL C A 97 ASP N A 97 ASP CA A 97 ASP C 1.0 -153.383 -66.167 PHI 129 129 A 97 ASP N A 97 ASP CA A 97 ASP C A 98 TYR N 1.0 94.457 172.433 PSI 130 130 A 97 ASP C A 98 TYR N A 98 TYR CA A 98 TYR C 1.0 -177.272 -93.392 PHI 131 131 A 98 TYR N A 98 TYR CA A 98 TYR C A 99 GLY N 1.0 126.276 185.646 PSI 132 132 A 100 PRO N A 100 PRO CA A 100 PRO C A 101 ALA N 1.0 112.629 182.517 PSI 133 133 A 100 PRO C A 101 ALA N A 101 ALA CA A 101 ALA C 1.0 -171.631 -56.479 PHI 134 134 A 101 ALA N A 101 ALA CA A 101 ALA C A 102 ILE N 1.0 95.502 184.668 PSI 135 135 A 101 ALA C A 102 ILE N A 102 ILE CA A 102 ILE C 1.0 -154.737 -108.501 PHI 136 136 A 102 ILE N A 102 ILE CA A 102 ILE C A 103 LEU N 1.0 112.759 153.115 PSI 137 137 A 102 ILE C A 103 LEU N A 103 LEU CA A 103 LEU C 1.0 -151.263 -96.231 PHI 138 138 A 103 LEU N A 103 LEU CA A 103 LEU C A 104 SER N 1.0 110.331 154.137 PSI 139 139 A 103 LEU C A 104 SER N A 104 SER CA A 104 SER C 1.0 -177.042 -102.114 PHI 140 140 A 104 SER N A 104 SER CA A 104 SER C A 105 LEU N 1.0 114.814 192.148 PSI 141 141 A 104 SER C A 105 LEU N A 105 LEU CA A 105 LEU C 1.0 -174.109 -88.813 PHI 142 142 A 105 LEU N A 105 LEU CA A 105 LEU C A 106 GLN N 1.0 102.817 181.543 PSI 143 143 A 105 LEU C A 106 GLN N A 106 GLN CA A 106 GLN C 1.0 -159.977 -102.749 PHI 144 144 A 106 GLN N A 106 GLN CA A 106 GLN C A 107 TYR N 1.0 115.488 179.886 PSI 145 145 A 106 GLN C A 107 TYR N A 107 TYR CA A 107 TYR C 1.0 -162.933 -82.281 PHI 146 146 A 107 TYR N A 107 TYR CA A 107 TYR C A 108 HIS N 1.0 95.618 163.898 PSI 147 147 A 107 TYR C A 108 HIS N A 108 HIS CA A 108 HIS C 1.0 -147.726 -60.774 PHI 148 148 A 108 HIS N A 108 HIS CA A 108 HIS C A 109 TYR N 1.0 105.146 161.006 PSI 149 149 A 108 HIS C A 109 TYR N A 109 TYR CA A 109 TYR C 1.0 -160.167 -77.457 PHI 150 150 A 109 TYR N A 109 TYR CA A 109 TYR C A 110 ASP N 1.0 107.501 188.525 PSI 151 151 A 114 ARG C A 115 LEU N A 115 LEU CA A 115 LEU C 1.0 -144.306 -64.224 PHI 152 152 A 115 LEU N A 115 LEU CA A 115 LEU C A 116 TYR N 1.0 86.880 165.792 PSI 153 153 A 115 LEU C A 116 TYR N A 116 TYR CA A 116 TYR C 1.0 -173.983 -59.215 PHI 154 154 A 116 TYR N A 116 TYR CA A 116 TYR C A 117 PRO N 1.0 66.022 204.076 PSI 155 155 A 117 PRO N A 117 PRO CA A 117 PRO C A 118 TYR N 1.0 116.373 177.273 PSI 156 156 A 117 PRO C A 118 TYR N A 118 TYR CA A 118 TYR C 1.0 -173.355 -110.949 PHI 157 157 A 118 TYR N A 118 TYR CA A 118 TYR C A 119 VAL N 1.0 130.147 180.583 PSI 158 158 A 118 TYR C A 119 VAL N A 119 VAL CA A 119 VAL C 1.0 -158.412 -99.894 PHI 159 159 A 119 VAL N A 119 VAL CA A 119 VAL C A 120 GLY N 1.0 121.731 177.069 PSI 160 160 A 119 VAL C A 120 GLY N A 120 GLY CA A 120 GLY C 1.0 -215.357 -110.285 PHI 161 161 A 120 GLY N A 120 GLY CA A 120 GLY C A 121 VAL N 1.0 123.109 216.841 PSI 162 162 A 120 GLY C A 121 VAL N A 121 VAL CA A 121 VAL C 1.0 -178.572 -100.212 PHI 163 163 A 121 VAL N A 121 VAL CA A 121 VAL C A 122 GLY N 1.0 121.665 174.771 PSI 164 164 A 121 VAL C A 122 GLY N A 122 GLY CA A 122 GLY C 1.0 -207.748 -91.372 PHI 165 165 A 122 GLY N A 122 GLY CA A 122 GLY C A 123 VAL N 1.0 115.583 212.945 PSI 166 166 A 122 GLY C A 123 VAL N A 123 VAL CA A 123 VAL C 1.0 -161.311 -108.493 PHI 167 167 A 123 VAL N A 123 VAL CA A 123 VAL C A 124 GLY N 1.0 107.141 184.691 PSI 168 168 A 123 VAL C A 124 GLY N A 124 GLY CA A 124 GLY C 1.0 -169.156 -52.522 PHI 169 169 A 124 GLY N A 124 GLY CA A 124 GLY C A 125 ARG N 1.0 107.175 183.183 PSI 170 170 A 124 GLY C A 125 ARG N A 125 ARG CA A 125 ARG C 1.0 -169.683 -69.789 PHI 171 171 A 125 ARG N A 125 ARG CA A 125 ARG C A 126 VAL N 1.0 88.627 177.055 PSI 172 172 A 125 ARG C A 126 VAL N A 126 VAL CA A 126 VAL C 1.0 -117.213 -35.373 PHI 173 173 A 126 VAL N A 126 VAL CA A 126 VAL C A 127 LEU N 1.0 109.588 151.924 PSI 174 174 A 126 VAL C A 127 LEU N A 127 LEU CA A 127 LEU C 1.0 -158.786 -70.130 PHI 175 175 A 127 LEU N A 127 LEU CA A 127 LEU C A 128 PHE N 1.0 98.637 170.223 PSI 176 176 A 127 LEU C A 128 PHE N A 128 PHE CA A 128 PHE C 1.0 -158.665 -76.201 PHI 177 177 A 128 PHE N A 128 PHE CA A 128 PHE C A 129 PHE N 1.0 103.608 178.560 PSI 178 178 A 128 PHE C A 129 PHE N A 129 PHE CA A 129 PHE C 1.0 -160.299 -102.927 PHI 179 179 A 129 PHE N A 129 PHE CA A 129 PHE C A 130 ASP N 1.0 120.327 179.265 PSI 180 180 A 129 PHE C A 130 ASP N A 130 ASP CA A 130 ASP C 1.0 -111.058 -46.582 PHI 181 181 A 130 ASP N A 130 ASP CA A 130 ASP C A 131 LYS N 1.0 96.120 211.670 PSI 182 182 A 131 LYS C A 132 THR N A 132 THR CA A 132 THR C 1.0 -173.958 -24.780 PHI 183 183 A 132 THR N A 132 THR CA A 132 THR C A 133 ASP N 1.0 48.112 215.800 PSI 184 184 A 135 ALA C A 136 LEU N A 136 LEU CA A 136 LEU C 1.0 -164.342 -87.350 PHI 185 185 A 136 LEU N A 136 LEU CA A 136 LEU C A 137 SER N 1.0 100.568 181.442 PSI 186 186 A 136 LEU C A 137 SER N A 137 SER CA A 137 SER C 1.0 -197.002 -42.268 PHI 187 187 A 137 SER N A 137 SER CA A 137 SER C A 138 SER N 1.0 80.639 215.423 PSI 188 188 A 137 SER C A 138 SER N A 138 SER CA A 138 SER C 1.0 40.294 67.876 PHI 189 189 A 138 SER N A 138 SER CA A 138 SER C A 139 PHE N 1.0 21.080 73.664 PSI 190 190 A 138 SER C A 139 PHE N A 139 PHE CA A 139 PHE C 1.0 -109.387 -56.479 PHI 191 191 A 139 PHE N A 139 PHE CA A 139 PHE C A 140 ASP N 1.0 96.192 158.064 PSI 192 192 A 139 PHE C A 140 ASP N A 140 ASP CA A 140 ASP C 1.0 -187.611 -60.303 PHI 193 193 A 140 ASP N A 140 ASP CA A 140 ASP C A 141 ILE N 1.0 90.625 188.299 PSI 194 194 A 140 ASP C A 141 ILE N A 141 ILE CA A 141 ILE C 1.0 -177.485 -63.617 PHI 195 195 A 141 ILE N A 141 ILE CA A 141 ILE C A 142 LYS N 1.0 94.860 193.026 PSI 196 196 A 141 ILE C A 142 LYS N A 142 LYS CA A 142 LYS C 1.0 -122.601 -33.567 PHI 197 197 A 142 LYS N A 142 LYS CA A 142 LYS C A 143 ASP N 1.0 96.703 179.947 PSI 198 198 A 143 ASP C A 144 LYS N A 144 LYS CA A 144 LYS C 1.0 -169.907 -103.355 PHI 199 199 A 144 LYS N A 144 LYS CA A 144 LYS C A 145 TRP N 1.0 114.657 192.945 PSI 200 200 A 144 LYS C A 145 TRP N A 145 TRP CA A 145 TRP C 1.0 -193.338 -33.330 PHI 201 201 A 145 TRP N A 145 TRP CA A 145 TRP C A 146 ALA N 1.0 107.811 174.561 PSI 202 202 A 145 TRP C A 146 ALA N A 146 ALA CA A 146 ALA C 1.0 -195.458 -67.748 PHI 203 203 A 146 ALA N A 146 ALA CA A 146 ALA C A 147 PRO N 1.0 76.013 197.867 PSI 204 204 A 147 PRO N A 147 PRO CA A 147 PRO C A 148 ALA N 1.0 125.606 168.698 PSI 205 205 A 147 PRO C A 148 ALA N A 148 ALA CA A 148 ALA C 1.0 -174.623 -112.565 PHI 206 206 A 148 ALA N A 148 ALA CA A 148 ALA C A 149 PHE N 1.0 125.488 187.942 PSI 207 207 A 148 ALA C A 149 PHE N A 149 PHE CA A 149 PHE C 1.0 -158.928 -91.524 PHI 208 208 A 149 PHE N A 149 PHE CA A 149 PHE C A 150 GLN N 1.0 103.217 181.379 PSI 209 209 A 149 PHE C A 150 GLN N A 150 GLN CA A 150 GLN C 1.0 -173.162 -88.418 PHI 210 210 A 150 GLN N A 150 GLN CA A 150 GLN C A 151 VAL N 1.0 102.647 177.185 PSI 211 211 A 150 GLN C A 151 VAL N A 151 VAL CA A 151 VAL C 1.0 -166.530 -104.736 PHI 212 212 A 151 VAL N A 151 VAL CA A 151 VAL C A 152 GLY N 1.0 97.607 186.083 PSI 213 213 A 151 VAL C A 152 GLY N A 152 GLY CA A 152 GLY C 1.0 -196.317 -94.317 PHI 214 214 A 152 GLY N A 152 GLY CA A 152 GLY C A 153 LEU N 1.0 120.977 200.621 PSI 215 215 A 152 GLY C A 153 LEU N A 153 LEU CA A 153 LEU C 1.0 -175.403 -102.377 PHI 216 216 A 153 LEU N A 153 LEU CA A 153 LEU C A 154 ARG N 1.0 117.666 173.646 PSI 217 217 A 153 LEU C A 154 ARG N A 154 ARG CA A 154 ARG C 1.0 -164.574 -87.510 PHI 218 218 A 154 ARG N A 154 ARG CA A 154 ARG C A 155 TYR N 1.0 107.805 182.781 PSI 219 219 A 154 ARG C A 155 TYR N A 155 TYR CA A 155 TYR C 1.0 -165.819 -96.003 PHI 220 220 A 155 TYR N A 155 TYR CA A 155 TYR C A 156 ASP N 1.0 111.621 179.295 PSI 221 221 A 155 TYR C A 156 ASP N A 156 ASP CA A 156 ASP C 1.0 -121.147 -40.957 PHI 222 222 A 156 ASP N A 156 ASP CA A 156 ASP C A 157 LEU N 1.0 80.837 183.575 PSI 223 223 A 156 ASP C A 157 LEU N A 157 LEU CA A 157 LEU C 1.0 -102.762 -37.308 PHI 224 224 A 157 LEU N A 157 LEU CA A 157 LEU C A 158 GLY N 1.0 97.494 164.670 PSI 225 225 A 160 SER C A 161 TRP N A 161 TRP CA A 161 TRP C 1.0 -193.294 -44.434 PHI 226 226 A 161 TRP N A 161 TRP CA A 161 TRP C A 162 MET N 1.0 98.053 192.523 PSI 227 227 A 161 TRP C A 162 MET N A 162 MET CA A 162 MET C 1.0 -168.113 -92.909 PHI 228 228 A 162 MET N A 162 MET CA A 162 MET C A 163 LEU N 1.0 88.976 191.810 PSI 229 229 A 162 MET C A 163 LEU N A 163 LEU CA A 163 LEU C 1.0 -139.376 -74.210 PHI 230 230 A 163 LEU N A 163 LEU CA A 163 LEU C A 164 ASN N 1.0 112.255 164.425 PSI 231 231 A 163 LEU C A 164 ASN N A 164 ASN CA A 164 ASN C 1.0 -168.139 -108.139 PHI 232 232 A 164 ASN N A 164 ASN CA A 164 ASN C A 165 SER N 1.0 126.062 168.722 PSI 233 233 A 164 ASN C A 165 SER N A 165 SER CA A 165 SER C 1.0 -164.295 -109.149 PHI 234 234 A 165 SER N A 165 SER CA A 165 SER C A 166 ASP N 1.0 122.670 174.792 PSI 235 235 A 165 SER C A 166 ASP N A 166 ASP CA A 166 ASP C 1.0 -164.583 -131.985 PHI 236 236 A 166 ASP N A 166 ASP CA A 166 ASP C A 167 VAL N 1.0 114.987 186.999 PSI 237 237 A 166 ASP C A 167 VAL N A 167 VAL CA A 167 VAL C 1.0 -163.252 -98.026 PHI 238 238 A 167 VAL N A 167 VAL CA A 167 VAL C A 168 ARG N 1.0 117.512 174.764 PSI 239 239 A 167 VAL C A 168 ARG N A 168 ARG CA A 168 ARG C 1.0 -167.500 -86.968 PHI 240 240 A 168 ARG N A 168 ARG CA A 168 ARG C A 169 TYR N 1.0 108.277 187.285 PSI 241 241 A 168 ARG C A 169 TYR N A 169 TYR CA A 169 TYR C 1.0 -163.293 -89.217 PHI 242 242 A 169 TYR N A 169 TYR CA A 169 TYR C A 170 ILE N 1.0 112.256 176.120 PSI 243 243 A 169 TYR C A 170 ILE N A 170 ILE CA A 170 ILE C 1.0 -176.052 -39.036 PHI 244 244 A 170 ILE N A 170 ILE CA A 170 ILE C A 171 PRO N 1.0 78.993 174.153 PSI 245 245 A 171 PRO C A 172 PHE N A 172 PHE CA A 172 PHE C 1.0 -181.073 -118.295 PHI 246 246 A 172 PHE N A 172 PHE CA A 172 PHE C A 173 LYS N 1.0 145.673 177.101 PSI 247 247 A 172 PHE C A 173 LYS N A 173 LYS CA A 173 LYS C 1.0 -164.827 -81.487 PHI 248 248 A 173 LYS N A 173 LYS CA A 173 LYS C A 174 THR N 1.0 108.407 180.575 PSI 249 249 A 173 LYS C A 174 THR N A 174 THR CA A 174 THR C 1.0 -166.408 -92.020 PHI 250 250 A 174 THR N A 174 THR CA A 174 THR C A 175 ASP N 1.0 111.224 179.210 PSI 251 251 A 174 THR C A 175 ASP N A 175 ASP CA A 175 ASP C 1.0 -190.350 -69.348 PHI 252 252 A 175 ASP N A 175 ASP CA A 175 ASP C A 176 VAL N 1.0 101.484 173.778 PSI 253 253 A 175 ASP C A 176 VAL N A 176 VAL CA A 176 VAL C 1.0 -166.168 -88.966 PHI 254 254 A 176 VAL N A 176 VAL CA A 176 VAL C A 177 THR N 1.0 96.514 180.670 PSI 255 255 A 176 VAL C A 177 THR N A 177 THR CA A 177 THR C 1.0 -165.967 -95.053 PHI 256 256 A 177 THR N A 177 THR CA A 177 THR C A 178 GLY N 1.0 130.013 177.599 PSI 257 257 A 177 THR C A 178 GLY N A 178 GLY CA A 178 GLY C 1.0 119.499 235.695 PHI 258 258 A 178 GLY N A 178 GLY CA A 178 GLY C A 179 THR N 1.0 -216.512 -134.678 PSI 259 259 A 178 GLY C A 179 THR N A 179 THR CA A 179 THR C 1.0 -171.934 -88.234 PHI 260 260 A 179 THR N A 179 THR CA A 179 THR C A 180 LEU N 1.0 97.889 187.295 PSI 261 261 A 179 THR C A 180 LEU N A 180 LEU CA A 180 LEU C 1.0 -139.900 -61.858 PHI 262 262 A 180 LEU N A 180 LEU CA A 180 LEU C A 181 GLY N 1.0 90.191 166.469 PSI 263 263 A 182 PRO N A 182 PRO CA A 182 PRO C A 183 VAL N 1.0 86.170 204.394 PSI 264 264 A 182 PRO C A 183 VAL N A 183 VAL CA A 183 VAL C 1.0 -200.359 -55.447 PHI 265 265 A 183 VAL N A 183 VAL CA A 183 VAL C A 184 PRO N 1.0 89.572 191.020 PSI 266 266 A 184 PRO N A 184 PRO CA A 184 PRO C A 185 VAL N 1.0 117.405 165.225 PSI 267 267 A 184 PRO C A 185 VAL N A 185 VAL CA A 185 VAL C 1.0 -151.548 -96.228 PHI 268 268 A 185 VAL N A 185 VAL CA A 185 VAL C A 186 SER N 1.0 107.993 166.181 PSI 269 269 A 185 VAL C A 186 SER N A 186 SER CA A 186 SER C 1.0 -170.103 -75.999 PHI 270 270 A 186 SER N A 186 SER CA A 186 SER C A 187 THR N 1.0 104.954 172.736 PSI 271 271 A 186 SER C A 187 THR N A 187 THR CA A 187 THR C 1.0 -174.463 -53.671 PHI 272 272 A 187 THR N A 187 THR CA A 187 THR C A 188 LYS N 1.0 88.573 175.855 PSI 273 273 A 187 THR C A 188 LYS N A 188 LYS CA A 188 LYS C 1.0 -158.773 -97.261 PHI 274 274 A 188 LYS N A 188 LYS CA A 188 LYS C A 189 ILE N 1.0 115.739 176.435 PSI 275 275 A 188 LYS C A 189 ILE N A 189 ILE CA A 189 ILE C 1.0 -177.814 -77.152 PHI 276 276 A 189 ILE N A 189 ILE CA A 189 ILE C A 190 GLU N 1.0 88.444 185.128 PSI 277 277 A 189 ILE C A 190 GLU N A 190 GLU CA A 190 GLU C 1.0 -131.186 -58.832 PHI 278 278 A 190 GLU N A 190 GLU CA A 190 GLU C A 191 VAL N 1.0 87.293 153.875 PSI 279 279 A 190 GLU C A 191 VAL N A 191 VAL CA A 191 VAL C 1.0 -135.623 -56.693 PHI 280 280 A 191 VAL N A 191 VAL CA A 191 VAL C A 192 ASP N 1.0 84.251 177.053 PSI 281 281 A 191 VAL C A 192 ASP N A 192 ASP CA A 192 ASP C 1.0 -104.556 -34.626 PHI 282 282 A 192 ASP N A 192 ASP CA A 192 ASP C A 193 PRO N 1.0 92.805 183.861 PSI 283 283 A 193 PRO N A 193 PRO CA A 193 PRO C A 194 PHE N 1.0 112.082 173.414 PSI 284 284 A 193 PRO C A 194 PHE N A 194 PHE CA A 194 PHE C 1.0 -138.006 -100.662 PHI 285 285 A 194 PHE N A 194 PHE CA A 194 PHE C A 195 ILE N 1.0 102.482 173.774 PSI 286 286 A 194 PHE C A 195 ILE N A 195 ILE CA A 195 ILE C 1.0 -129.946 -88.162 PHI 287 287 A 195 ILE N A 195 ILE CA A 195 ILE C A 196 LEU N 1.0 102.594 141.342 PSI 288 288 A 195 ILE C A 196 LEU N A 196 LEU CA A 196 LEU C 1.0 -136.192 -76.150 PHI 289 289 A 196 LEU N A 196 LEU CA A 196 LEU C A 197 SER N 1.0 109.551 140.919 PSI 290 290 A 196 LEU C A 197 SER N A 197 SER CA A 197 SER C 1.0 -156.512 -71.912 PHI 291 291 A 197 SER N A 197 SER CA A 197 SER C A 198 LEU N 1.0 100.619 162.275 PSI 292 292 A 197 SER C A 198 LEU N A 198 LEU CA A 198 LEU C 1.0 -159.305 -102.527 PHI 293 293 A 198 LEU N A 198 LEU CA A 198 LEU C A 199 GLY N 1.0 108.325 170.371 PSI 294 294 A 198 LEU C A 199 GLY N A 199 GLY CA A 199 GLY C 1.0 -200.207 -137.177 PHI 295 295 A 199 GLY N A 199 GLY CA A 199 GLY C A 200 ALA N 1.0 -213.739 -132.907 PSI 296 296 A 199 GLY C A 200 ALA N A 200 ALA CA A 200 ALA C 1.0 -179.294 -108.560 PHI 297 297 A 200 ALA N A 200 ALA CA A 200 ALA C A 201 SER N 1.0 132.145 172.513 PSI 298 298 A 200 ALA C A 201 SER N A 201 SER CA A 201 SER C 1.0 -170.546 -99.920 PHI 299 299 A 201 SER N A 201 SER CA A 201 SER C A 202 TYR N 1.0 116.541 177.621 PSI 300 300 A 201 SER C A 202 TYR N A 202 TYR CA A 202 TYR C 1.0 -158.477 -78.845 PHI 301 301 A 202 TYR N A 202 TYR CA A 202 TYR C A 203 VAL N 1.0 98.183 173.225 PSI 302 302 A 202 TYR C A 203 VAL N A 203 VAL CA A 203 VAL C 1.0 -132.872 -77.570 PHI 303 303 A 203 VAL N A 203 VAL CA A 203 VAL C A 204 PHE N 1.0 102.872 161.186 PSI stop_ save_