NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
545382 | 2lgz | 16701 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lgz save_distance_constraint_statistics_1 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 1 _Distance_constraint_stats_list.Constraint_count 1409 _Distance_constraint_stats_list.Viol_count 4014 _Distance_constraint_stats_list.Viol_total 7401.975 _Distance_constraint_stats_list.Viol_max 2.472 _Distance_constraint_stats_list.Viol_rms 0.1350 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0525 _Distance_constraint_stats_list.Viol_average_violations_only 0.1844 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * Administrative tag * 3 * Administrative tag * 4 * ID of the restraint list. * 5 * Number of restraints in list. * 6 * Number of violated restraints (each model violation is used). * 7 * Sum of violations in Angstrom. * 8 * Maximum violation of a restraint without averaging in any way. * 9 * Rms of violations over all restraints. * 10 * Average violation over all restraints. * 11 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998). * 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table. * 13 * This tag Description of the tags in the per residue table below: * 1 * Chain identifier (can be absent if none defined) * 2 * Residue number * 3 * Residue name * 4 * Maximum violation in ensemble of models (without any averaging) * 5 * Model number with the maximum violation * 6 * Number of models with a violation above cutoff * 7 * List of models (1 character per model) with a violation above cutoff. An '*' marks a violation above the cutoff. A '+' indicates the largest violation above the cutoff and a '-' marks the smallest violation over cutoff. For models 5, 15, 25,... a ' ' is replaced by a '.'. For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1. * 8 * Administrative tag * 9 * Administrative tag Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. First node, FIRST member, first atom's: * 2 * Chain identifier (can be absent if none defined) * 3 * Residue number * 4 * Residue name * 5 * Name of (pseudo-)atom First node, SECOND member, first atom's: * 6 * Chain identifier (can be absent if none defined) * 7 * Residue number * 8 * Residue name * 9 * Name of (pseudo-)atom FIRST node's: * 10 * Target distance value (Angstrom) * 11 * Lower bound distance (Angstrom) * 12 * Upper bound distance (Angstrom) * 13 * Average distance in ensemble of models * 14 * Minimum distance in ensemble of models * 15 * Maximum distance in ensemble of models * 16 * Maximum violation (without any averaging) * 17 * Model number with the maximum violation * 18 * Number of models with a violation above cutoff * 19 * List of models with a violation above cutoff. See description above. * 20 * Administrative tag * 21 * Administrative tag ; loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 21 SER 4.654 0.451 2 0 "[ . 1]" 1 22 THR 10.288 0.811 6 8 "[-** .+****]" 1 23 TRP 14.210 1.276 1 7 "[+**-.* **1]" 1 24 VAL 12.594 0.710 8 4 "[*- .* + 1]" 1 25 THR 9.522 0.703 1 6 "[+ **.* *-]" 1 26 ARG 7.299 0.640 10 4 "[ *-. *+]" 1 27 THR 6.612 0.710 8 2 "[ .- + 1]" 1 28 ALA 7.524 0.703 1 6 "[+***. *-]" 1 29 TYR 11.050 1.170 6 4 "[*- .+ *]" 1 30 SER 0.000 0.000 . 0 "[ . 1]" 1 31 SER 0.141 0.141 8 0 "[ . 1]" 1 32 PRO 0.000 0.000 . 0 "[ . 1]" 1 33 SER 3.223 0.680 2 2 "[ + . -]" 1 34 VAL 6.770 0.755 2 3 "[-+ . *]" 1 35 VAL 5.079 0.723 7 5 "[- .*+ **]" 1 36 LEU 4.987 0.564 1 1 "[+ . 1]" 1 37 PRO 0.000 0.000 . 0 "[ . 1]" 1 38 SER 0.498 0.498 2 0 "[ . 1]" 1 39 GLN 3.245 0.680 2 2 "[ + . -]" 1 40 THR 4.960 0.755 2 5 "[ + .-* **]" 1 41 PRO 1.964 0.437 1 0 "[ . 1]" 1 42 ASP 1.193 0.285 8 0 "[ . 1]" 1 43 GLY 0.004 0.004 8 0 "[ . 1]" 1 44 LYS 5.962 0.579 5 2 "[ + - 1]" 1 45 LEU 20.694 1.276 1 6 "[+* ***- 1]" 1 46 ALA 15.560 1.170 6 5 "[*- .+ * *]" 1 47 LEU 11.759 0.718 9 5 "[ * .* -+*]" 1 48 ILE 10.659 0.640 10 3 "[ .- * +]" 1 49 ASP 11.967 0.652 7 4 "[ .-+**1]" 1 50 ASP 7.568 0.772 8 2 "[ . -+ 1]" 1 51 PHE 15.550 0.680 7 5 "[ *.*+- *]" 1 52 ARG 18.244 0.676 10 5 "[ .-***+]" 1 53 GLU 16.164 0.772 8 4 "[ -.**+ 1]" 1 54 ALA 18.753 0.928 10 4 "[ * - * +]" 1 55 TYR 7.614 0.576 7 3 "[ . +*-1]" 1 56 TYR 17.789 1.276 9 6 "[ -***+*]" 1 57 TRP 8.721 0.689 10 3 "[ -.* +]" 1 58 LEU 3.533 0.775 7 2 "[ . + -1]" 1 59 ARG 9.570 0.720 1 5 "[+ *-* * 1]" 1 60 MET 6.683 0.689 10 5 "[ *.*- *+]" 1 61 ASN 3.615 0.720 1 3 "[+ *.- 1]" 1 62 SER 3.188 0.646 9 2 "[ . +-]" 1 63 ASP 2.062 0.304 8 0 "[ . 1]" 1 64 GLU 4.888 0.759 1 1 "[+ . 1]" 1 65 ASP 0.897 0.156 6 0 "[ . 1]" 1 66 SER 4.063 0.702 9 1 "[ . +1]" 1 67 LYS 6.694 0.646 9 2 "[ . +*]" 1 68 VAL 6.571 0.779 10 1 "[ . +]" 1 69 ALA 9.606 0.920 7 3 "[ . + **]" 1 70 ALA 7.977 0.836 10 3 "[ .* -+]" 1 71 TRP 6.721 0.600 9 2 "[ -. +1]" 1 72 TRP 12.719 0.820 10 2 "[ . -+]" 1 73 ASP 4.471 0.659 10 1 "[ . +]" 1 74 TYR 12.979 0.836 10 4 "[ *.- *+]" 1 75 GLY 5.897 0.530 9 1 "[ . +1]" 1 76 TYR 18.889 1.276 9 4 "[ .* -+*]" 1 77 GLN 8.833 0.533 6 1 "[ .+ 1]" 1 78 ILE 10.938 0.757 10 3 "[ * . - +]" 1 79 GLY 9.901 0.680 7 2 "[ - . + 1]" 1 80 GLY 4.153 0.678 10 2 "[ - . +]" 1 81 MET 5.600 0.757 10 4 "[ * - * +]" 1 82 ALA 10.305 0.928 10 5 "[ -**. *+]" 1 83 ASP 6.446 0.657 7 3 "[ - +* 1]" 1 84 ARG 7.391 0.814 8 4 "[* - *+ 1]" 1 85 THR 3.046 0.703 8 3 "[- . *+ 1]" 1 86 THR 2.195 0.422 1 0 "[ . 1]" 1 87 LEU 6.922 0.814 8 4 "[* . *+-1]" 1 88 VAL 5.018 0.703 8 3 "[- . *+ 1]" 1 89 ASP 4.131 0.453 10 0 "[ . 1]" 1 90 ASN 2.065 0.345 3 0 "[ . 1]" 1 91 ASN 3.714 0.431 7 0 "[ . 1]" 1 92 THR 9.521 0.484 10 0 "[ . 1]" 1 93 TRP 9.553 0.759 1 1 "[+ . 1]" 1 94 ASN 0.815 0.134 5 0 "[ . 1]" 1 95 ASN 2.997 0.324 7 0 "[ . 1]" 1 96 THR 6.393 0.484 10 0 "[ . 1]" 1 97 HIS 4.574 0.450 10 0 "[ . 1]" 1 98 ILE 8.673 0.408 7 0 "[ . 1]" 1 99 ALA 4.773 0.334 5 0 "[ . 1]" 1 100 ILE 8.519 0.616 10 1 "[ . +]" 1 101 VAL 36.146 2.472 7 9 "[******+ -*]" 1 102 GLY 5.285 0.771 5 1 "[ + 1]" 1 103 LYS 5.199 0.309 4 0 "[ . 1]" 1 104 ALA 12.582 0.600 5 2 "[ + * 1]" 1 105 ASN 7.454 0.788 5 3 "[ *+ -1]" 1 106 ALA 13.477 0.771 5 3 "[ * + -]" 1 107 SER 2.408 0.330 5 0 "[ . 1]" 1 108 PRO 1.581 0.375 5 0 "[ . 1]" 1 109 GLU 3.801 0.515 2 1 "[ + . 1]" 1 110 GLU 4.948 0.495 5 0 "[ . 1]" 1 111 LYS 6.950 0.515 2 1 "[ + . 1]" 1 112 SER 1.979 0.520 5 1 "[ + 1]" 1 113 TYR 9.314 0.663 5 3 "[ * + *]" 1 114 GLU 6.642 0.540 5 1 "[ + 1]" 1 115 ILE 4.430 0.416 5 0 "[ . 1]" 1 116 LEU 6.033 0.543 2 2 "[ + - 1]" 1 117 LYS 7.464 0.529 5 1 "[ + 1]" 1 118 GLU 8.447 0.494 5 0 "[ . 1]" 1 119 HIS 4.162 0.543 2 1 "[ + . 1]" 1 120 ASP 8.858 0.567 6 2 "[ -+ 1]" 1 121 VAL 13.419 0.531 9 2 "[ - +1]" 1 122 ASP 3.659 0.449 9 0 "[ . 1]" 1 123 TYR 15.933 2.401 4 5 "[- *+* *1]" 1 124 VAL 8.551 0.567 6 3 "[ -+ *1]" 1 125 LEU 5.321 0.486 3 0 "[ . 1]" 1 126 VAL 4.329 0.449 9 0 "[ . 1]" 1 127 ILE 6.114 0.542 3 1 "[ + . 1]" 1 128 PHE 4.084 0.642 3 1 "[ + . 1]" 1 129 GLY 3.441 0.486 3 0 "[ . 1]" 1 130 GLY 8.948 0.543 7 2 "[ - . + 1]" 1 131 LEU 3.442 0.642 3 1 "[ + . 1]" 1 132 ILE 4.946 0.533 5 1 "[ + 1]" 1 133 GLY 0.793 0.248 6 0 "[ . 1]" 1 134 PHE 2.082 0.869 3 1 "[ + . 1]" 1 135 GLY 2.757 0.464 3 0 "[ . 1]" 1 136 GLY 0.495 0.147 6 0 "[ . 1]" 1 137 ASP 0.489 0.138 3 0 "[ . 1]" 1 138 ASP 0.895 0.344 2 0 "[ . 1]" 1 141 LYS 1.251 0.590 9 1 "[ . +1]" 1 142 PHE 5.594 0.626 4 3 "[* +. -1]" 1 143 LEU 0.176 0.172 7 0 "[ . 1]" 1 144 TRP 14.749 0.728 9 3 "[ * *. +1]" 1 145 ASN 1.585 0.518 4 1 "[ +. 1]" 1 146 ILE 0.000 0.000 . 0 "[ . 1]" 1 147 ARG 0.000 0.000 . 0 "[ . 1]" 1 148 ILE 1.818 0.281 1 0 "[ . 1]" 1 149 SER 1.457 0.281 1 0 "[ . 1]" 1 150 GLU 1.322 0.230 6 0 "[ . 1]" 1 151 GLY 1.964 0.477 9 0 "[ . 1]" 1 152 ILE 0.899 0.200 8 0 "[ . 1]" 1 153 TRP 2.504 0.477 9 0 "[ . 1]" 1 154 PRO 2.810 0.419 1 0 "[ . 1]" 1 155 GLU 1.711 0.173 3 0 "[ . 1]" 1 156 GLU 4.530 0.376 8 0 "[ . 1]" 1 157 ILE 1.615 0.105 7 0 "[ . 1]" 1 158 LYS 2.939 0.326 8 0 "[ . 1]" 1 159 GLU 1.856 0.176 1 0 "[ . 1]" 1 160 ARG 0.800 0.108 7 0 "[ . 1]" 1 161 ASP 1.326 0.115 2 0 "[ . 1]" 1 162 PHE 1.167 0.105 8 0 "[ . 1]" 1 163 TYR 1.636 0.223 10 0 "[ . 1]" 1 164 THR 0.000 0.000 . 0 "[ . 1]" 1 165 ALA 0.710 0.223 10 0 "[ . 1]" 1 166 GLU 0.792 0.131 3 0 "[ . 1]" 1 167 GLY 0.033 0.019 4 0 "[ . 1]" 1 168 GLU 0.070 0.023 3 0 "[ . 1]" 1 169 TYR 0.070 0.023 3 0 "[ . 1]" 1 170 ARG 0.000 0.000 . 0 "[ . 1]" 1 171 VAL 3.140 0.393 3 0 "[ . 1]" 1 172 ASP 0.655 0.131 3 0 "[ . 1]" 1 173 ALA 3.950 0.979 8 2 "[- . + 1]" 1 174 ARG 5.184 0.550 8 1 "[ . + 1]" 1 175 ALA 4.700 1.422 8 3 "[- . + *]" 1 176 SER 7.646 1.422 8 1 "[ . + 1]" 1 177 GLU 9.980 0.710 8 2 "[ * . + 1]" 1 178 THR 9.394 0.863 9 3 "[-* . +1]" 1 179 MET 13.486 0.779 8 6 "[*** . +-*]" 1 180 ARG 9.510 0.785 9 3 "[ - . *+1]" 1 181 ASN 5.187 0.616 9 3 "[ * .- +1]" 1 182 SER 10.077 0.865 9 3 "[** . +1]" 1 183 LEU 13.982 0.785 9 6 "[ **- *+*]" 1 184 LEU 9.933 0.729 8 6 "[ *.**+**]" 1 185 TYR 10.135 0.869 3 3 "[- + . *1]" 1 186 LYS 7.878 0.729 8 5 "[ -*. +**]" 1 187 MET 13.556 0.873 5 7 "[ *+**-**]" 1 188 SER 8.957 0.904 5 5 "[ *+ **-1]" 1 189 TYR 7.744 0.508 3 1 "[ + . 1]" 1 190 LYS 4.337 0.732 2 2 "[-+ . 1]" 1 191 ASP 9.980 0.904 5 6 "[ *+-***1]" 1 192 PHE 3.526 0.732 2 2 "[-+ . 1]" 1 193 PRO 0.000 0.000 . 0 "[ . 1]" 1 194 GLN 4.246 0.856 1 2 "[+ .- 1]" 1 195 LEU 1.909 0.856 1 1 "[+ . 1]" 1 196 PHE 0.042 0.042 7 0 "[ . 1]" 1 197 ASN 8.757 0.631 1 3 "[+ .- *]" 1 198 GLY 3.637 0.510 1 1 "[+ . 1]" 1 199 GLY 3.092 0.510 1 1 "[+ . 1]" 1 200 GLN 4.677 0.403 9 0 "[ . 1]" 1 201 ALA 1.212 0.364 6 0 "[ . 1]" 1 202 THR 18.144 0.863 9 3 "[* . +-]" 1 203 ASP 4.469 0.289 9 0 "[ . 1]" 1 204 ARG 6.212 0.491 2 0 "[ . 1]" 1 205 VAL 7.628 0.865 9 1 "[ . +1]" 1 206 ARG 6.356 0.416 4 0 "[ . 1]" 1 207 GLN 7.652 0.659 6 3 "[ *.+- 1]" 1 208 GLN 4.205 0.355 9 0 "[ . 1]" 1 209 MET 4.580 0.491 2 0 "[ . 1]" 1 210 ILE 9.133 0.659 6 3 "[ *.+- 1]" 1 211 THR 7.233 0.459 9 0 "[ . 1]" 1 212 PRO 1.549 0.401 5 0 "[ . 1]" 1 213 LEU 7.021 0.590 4 2 "[ +- 1]" 1 214 ASP 4.466 0.662 9 2 "[ -. +1]" 1 215 VAL 5.259 0.662 9 2 "[ -. +1]" 1 217 PRO 0.000 0.000 . 0 "[ . 1]" 1 218 LEU 4.565 0.590 4 2 "[ +- 1]" 1 219 ASP 9.407 0.708 5 1 "[ + 1]" 1 220 TYR 7.473 0.645 8 3 "[ * - + 1]" 1 221 PHE 8.393 0.579 7 3 "[ -* + 1]" 1 222 ASP 6.096 0.482 7 0 "[ . 1]" 1 223 GLU 34.379 2.472 7 10 [******+**-] 1 224 VAL 11.168 0.674 4 5 "[** +* - 1]" 1 225 PHE 2.317 0.482 7 0 "[ . 1]" 1 226 THR 11.377 2.401 4 6 "[* *+. -**1]" 1 227 SER 5.833 0.631 5 3 "[ + * -]" 1 228 GLU 4.108 0.781 9 2 "[ -. +1]" 1 229 ASN 6.016 0.527 6 1 "[ .+ 1]" 1 230 TRP 7.657 0.761 3 2 "[ + . - 1]" 1 231 ASN 7.605 0.725 3 3 "[ + * -]" 1 232 VAL 9.876 0.781 9 2 "[ -. +1]" 1 233 ARG 14.321 0.869 3 4 "[- + .* * 1]" 1 234 ILE 15.907 0.869 3 5 "[* + * * -]" 1 235 TYR 9.450 0.608 7 2 "[ .-+ 1]" 1 236 GLN 6.413 0.464 8 0 "[ . 1]" 1 237 LEU 10.741 0.533 5 2 "[- + 1]" 1 238 LYS 10.999 0.640 1 3 "[+- . * 1]" 1 239 LYS 2.996 0.248 6 0 "[ . 1]" 1 240 ASP 3.100 0.226 4 0 "[ . 1]" 1 241 ASP 4.090 0.340 4 0 "[ . 1]" 1 242 ALA 4.318 0.609 8 2 "[ - . + 1]" 1 243 GLN 3.537 0.459 9 0 "[ . 1]" 1 244 GLY 2.334 0.725 8 1 "[ . + 1]" 1 245 ARG 0.124 0.049 10 0 "[ . 1]" 1 246 THR 2.985 0.725 8 1 "[ . + 1]" 1 247 LEU 9.430 0.464 8 0 "[ . 1]" 1 248 ARG 4.972 0.455 9 0 "[ . 1]" 1 249 ASP 2.917 0.400 7 0 "[ . 1]" 1 250 VAL 5.316 0.392 6 0 "[ . 1]" 1 251 GLY 8.419 0.455 9 0 "[ . 1]" 1 252 GLU 3.456 0.400 7 0 "[ . 1]" 1 253 LEU 2.411 0.253 9 0 "[ . 1]" 1 254 THR 3.697 0.432 3 0 "[ . 1]" 1 255 ARG 2.621 0.419 7 0 "[ . 1]" 1 256 SER 0.455 0.110 6 0 "[ . 1]" 1 259 LYS 0.000 0.000 . 0 "[ . 1]" 1 260 THR 3.169 0.296 8 0 "[ . 1]" 1 261 ARG 5.415 0.549 7 1 "[ . + 1]" 1 262 ARG 1.396 0.263 8 0 "[ . 1]" 1 263 SER 1.596 0.256 3 0 "[ . 1]" 1 264 ILE 3.315 0.549 7 1 "[ . + 1]" 1 265 LYS 3.944 0.578 7 1 "[ . + 1]" 1 266 ARG 3.813 0.484 5 0 "[ . 1]" 1 267 PRO 0.221 0.127 8 0 "[ . 1]" 1 268 GLU 1.382 0.289 5 0 "[ . 1]" 1 269 LEU 1.455 0.324 7 0 "[ . 1]" 1 270 GLY 2.180 0.578 7 1 "[ . + 1]" 1 271 LEU 0.703 0.324 7 0 "[ . 1]" 1 272 ARG 0.778 0.272 3 0 "[ . 1]" 1 273 VAL 2.774 0.484 5 0 "[ . 1]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 21 SER H 1 22 THR H . . 2.800 2.022 1.807 2.730 . 0 0 "[ . 1]" 1 2 1 21 SER H 1 23 TRP H . . 4.200 3.846 2.665 4.486 0.286 2 0 "[ . 1]" 1 3 1 21 SER H 1 148 ILE MD . . 5.500 4.329 1.885 5.169 . 0 0 "[ . 1]" 1 4 1 21 SER HA 1 22 THR H . . 3.500 3.247 2.807 3.566 0.066 9 0 "[ . 1]" 1 5 1 21 SER HA 1 23 TRP H . . 4.400 3.898 2.918 4.405 0.005 8 0 "[ . 1]" 1 6 1 21 SER HA 1 24 VAL H . . 3.400 3.678 3.450 3.851 0.451 2 0 "[ . 1]" 1 7 1 21 SER HA 1 25 THR H . . 4.200 4.244 3.516 4.433 0.233 8 0 "[ . 1]" 1 8 1 21 SER QB 1 22 THR H . . 4.200 3.321 2.215 3.875 . 0 0 "[ . 1]" 1 9 1 22 THR H 1 23 TRP H . . 2.800 2.699 2.392 2.853 0.053 5 0 "[ . 1]" 1 10 1 22 THR H 1 24 VAL H . . 4.200 4.236 4.069 4.366 0.166 5 0 "[ . 1]" 1 11 1 22 THR H 1 47 LEU H . . 5.750 6.146 5.859 6.468 0.718 9 4 "[ - .* +*]" 1 12 1 22 THR H 1 148 ILE HA . . 5.500 5.449 5.012 5.649 0.149 4 0 "[ . 1]" 1 13 1 22 THR HA 1 23 TRP H . . 3.500 3.454 3.123 3.565 0.065 2 0 "[ . 1]" 1 14 1 22 THR HA 1 24 VAL H . . 4.400 3.950 3.546 4.582 0.182 6 0 "[ . 1]" 1 15 1 22 THR HA 1 25 THR H . . 3.400 3.030 2.770 3.923 0.523 6 1 "[ .+ 1]" 1 16 1 22 THR HA 1 26 ARG H . . 4.200 2.948 2.223 3.714 . 0 0 "[ . 1]" 1 17 1 22 THR HA 1 47 LEU H . . 5.500 4.793 3.926 5.115 . 0 0 "[ . 1]" 1 18 1 22 THR HB 1 45 LEU H . . 5.500 5.892 5.397 6.311 0.811 6 5 "[-* .+** 1]" 1 19 1 23 TRP H 1 24 VAL H . . 2.800 2.671 1.928 3.036 0.236 2 0 "[ . 1]" 1 20 1 23 TRP H 1 25 THR H . . 4.200 3.736 2.793 4.108 . 0 0 "[ . 1]" 1 21 1 23 TRP H 1 45 LEU HA . . 5.950 6.473 5.924 7.226 1.276 1 4 "[+- .* * 1]" 1 22 1 23 TRP HA 1 24 VAL H . . 3.500 3.490 3.392 3.545 0.045 8 0 "[ . 1]" 1 23 1 23 TRP HA 1 25 THR H . . 4.400 4.560 4.402 4.779 0.379 2 0 "[ . 1]" 1 24 1 23 TRP HA 1 26 ARG H . . 3.800 4.173 3.780 4.362 0.562 3 3 "[ +-. *1]" 1 25 1 23 TRP HA 1 27 THR H . . 4.200 4.117 3.823 4.694 0.494 8 0 "[ . 1]" 1 26 1 23 TRP QB 1 24 VAL H . . 4.200 3.117 2.701 3.717 . 0 0 "[ . 1]" 1 27 1 23 TRP QB 1 25 THR H . . 6.000 4.736 4.446 5.136 . 0 0 "[ . 1]" 1 28 1 23 TRP QB 1 26 ARG H . . 5.500 5.244 5.026 5.519 0.019 4 0 "[ . 1]" 1 29 1 23 TRP HZ3 1 191 ASP H . . 5.500 5.116 3.239 6.056 0.556 6 1 "[ .+ 1]" 1 30 1 24 VAL H 1 25 THR H . . 2.800 1.993 1.747 2.323 . 0 0 "[ . 1]" 1 31 1 24 VAL H 1 26 ARG H . . 4.200 3.421 3.158 3.697 . 0 0 "[ . 1]" 1 32 1 24 VAL H 1 192 PHE QE . . 5.500 5.475 4.841 5.756 0.256 1 0 "[ . 1]" 1 33 1 24 VAL HA 1 25 THR H . . 3.500 3.431 3.349 3.496 . 0 0 "[ . 1]" 1 34 1 24 VAL HA 1 26 ARG H . . 4.400 4.062 3.732 4.488 0.088 3 0 "[ . 1]" 1 35 1 24 VAL HA 1 27 THR H . . 3.600 3.904 3.608 4.310 0.710 8 2 "[ .- + 1]" 1 36 1 24 VAL HA 1 28 ALA H . . 4.200 4.559 4.197 4.857 0.657 1 2 "[+- . 1]" 1 37 1 24 VAL HB 1 25 THR H . . 5.020 3.889 3.019 4.215 . 0 0 "[ . 1]" 1 38 1 24 VAL HB 1 156 GLU H . . 5.500 4.613 3.285 5.244 . 0 0 "[ . 1]" 1 39 1 24 VAL HB 1 157 ILE H . . 5.500 4.806 3.323 5.574 0.074 3 0 "[ . 1]" 1 40 1 24 VAL QG 1 26 ARG H . . 5.500 4.104 3.945 4.300 . 0 0 "[ . 1]" 1 41 1 24 VAL QG 1 157 ILE H . . 5.500 4.330 2.599 5.448 . 0 0 "[ . 1]" 1 42 1 25 THR H 1 26 ARG H . . 2.800 2.201 1.954 2.459 . 0 0 "[ . 1]" 1 43 1 25 THR H 1 27 THR H . . 4.200 3.825 3.239 4.575 0.375 8 0 "[ . 1]" 1 44 1 25 THR HA 1 26 ARG H . . 3.500 3.322 3.178 3.493 . 0 0 "[ . 1]" 1 45 1 25 THR HA 1 27 THR H . . 4.400 4.442 4.248 4.559 0.159 5 0 "[ . 1]" 1 46 1 25 THR HA 1 28 ALA H . . 3.600 3.933 3.369 4.303 0.703 1 5 "[+ **. *-]" 1 47 1 25 THR HB 1 26 ARG H . . 5.050 3.411 2.889 3.738 . 0 0 "[ . 1]" 1 48 1 25 THR HG1 1 156 GLU H . . 5.500 5.628 5.503 5.876 0.376 8 0 "[ . 1]" 1 49 1 26 ARG H 1 27 THR H . . 2.800 2.111 1.898 2.444 . 0 0 "[ . 1]" 1 50 1 26 ARG H 1 28 ALA H . . 4.200 3.581 3.261 4.053 . 0 0 "[ . 1]" 1 51 1 26 ARG H 1 45 LEU H . . 5.500 5.242 4.546 5.786 0.286 7 0 "[ . 1]" 1 52 1 26 ARG H 1 45 LEU HA . . 5.500 4.739 4.239 5.410 . 0 0 "[ . 1]" 1 53 1 26 ARG H 1 46 ALA MB . . 5.500 5.173 4.223 5.635 0.135 3 0 "[ . 1]" 1 54 1 26 ARG H 1 121 VAL MG1 . . 5.990 5.639 5.468 5.827 . 0 0 "[ . 1]" 1 55 1 26 ARG HA 1 27 THR H . . 3.500 3.490 3.407 3.553 0.053 8 0 "[ . 1]" 1 56 1 26 ARG HA 1 28 ALA H . . 4.400 4.049 3.687 4.486 0.086 8 0 "[ . 1]" 1 57 1 26 ARG HA 1 45 LEU H . . 5.500 3.674 2.287 4.770 . 0 0 "[ . 1]" 1 58 1 26 ARG HA 1 46 ALA H . . 5.500 3.070 1.908 3.882 . 0 0 "[ . 1]" 1 59 1 26 ARG HA 1 47 LEU H . . 5.500 4.913 3.999 5.639 0.139 10 0 "[ . 1]" 1 60 1 26 ARG QB 1 27 THR H . . 5.050 3.076 2.523 3.475 . 0 0 "[ . 1]" 1 61 1 26 ARG QB 1 45 LEU H . . 5.500 3.197 2.597 4.454 . 0 0 "[ . 1]" 1 62 1 26 ARG QB 1 47 LEU H . . 5.500 2.898 2.424 4.075 . 0 0 "[ . 1]" 1 63 1 26 ARG QD 1 47 LEU H . . 6.000 3.342 2.543 4.784 . 0 0 "[ . 1]" 1 64 1 26 ARG QD 1 48 ILE H . . 6.000 4.652 2.880 6.640 0.640 10 1 "[ . +]" 1 65 1 26 ARG QG 1 29 TYR H . . 5.500 5.126 4.231 5.991 0.491 4 0 "[ . 1]" 1 66 1 26 ARG QG 1 45 LEU H . . 5.500 3.989 2.696 5.615 0.115 6 0 "[ . 1]" 1 67 1 26 ARG QG 1 47 LEU H . . 5.500 2.784 1.663 4.271 . 0 0 "[ . 1]" 1 68 1 26 ARG QG 1 49 ASP H . . 6.000 5.419 4.320 6.107 0.107 7 0 "[ . 1]" 1 69 1 27 THR H 1 28 ALA H . . 2.830 2.466 2.072 2.671 . 0 0 "[ . 1]" 1 70 1 27 THR HA 1 28 ALA H . . 3.500 3.454 3.379 3.511 0.011 9 0 "[ . 1]" 1 71 1 27 THR HA 1 29 TYR H . . 4.400 3.796 3.391 3.999 . 0 0 "[ . 1]" 1 72 1 27 THR HA 1 46 ALA H . . 5.700 5.597 4.575 6.400 0.700 8 1 "[ . + 1]" 1 73 1 27 THR HB 1 28 ALA H . . 5.000 3.639 2.966 4.158 . 0 0 "[ . 1]" 1 74 1 27 THR HB 1 29 TYR H . . 5.500 5.223 4.877 5.607 0.107 6 0 "[ . 1]" 1 75 1 28 ALA H 1 29 TYR H . . 2.680 2.337 2.139 2.765 0.085 1 0 "[ . 1]" 1 76 1 28 ALA HA 1 29 TYR H . . 3.500 3.235 3.179 3.431 . 0 0 "[ . 1]" 1 77 1 28 ALA MB 1 29 TYR H . . 5.062 3.338 2.969 3.429 . 0 0 "[ . 1]" 1 78 1 29 TYR H 1 45 LEU HA . . 5.500 5.501 4.633 5.959 0.459 7 0 "[ . 1]" 1 79 1 29 TYR H 1 46 ALA H . . 5.500 5.571 5.223 5.986 0.486 6 0 "[ . 1]" 1 80 1 29 TYR H 1 46 ALA MB . . 5.900 5.936 5.148 7.070 1.170 6 2 "[- .+ 1]" 1 81 1 29 TYR HA 1 46 ALA H . . 5.750 6.182 5.788 6.440 0.690 10 3 "[*- . +]" 1 82 1 29 TYR QB 1 30 SER H . . 6.000 2.226 1.834 3.177 . 0 0 "[ . 1]" 1 83 1 30 SER QB 1 31 SER H . . 5.280 3.141 2.369 3.971 . 0 0 "[ . 1]" 1 84 1 31 SER HA 1 33 SER H . . 5.500 4.521 3.183 5.641 0.141 8 0 "[ . 1]" 1 85 1 32 PRO HA 1 33 SER H . . 3.780 3.112 2.164 3.570 . 0 0 "[ . 1]" 1 86 1 32 PRO QB 1 33 SER H . . 5.610 3.127 1.854 3.979 . 0 0 "[ . 1]" 1 87 1 33 SER H 1 34 VAL H . . 5.500 3.244 1.678 4.617 . 0 0 "[ . 1]" 1 88 1 33 SER H 1 39 GLN HA . . 5.500 5.503 4.603 6.180 0.680 2 2 "[ + . -]" 1 89 1 33 SER HA 1 34 VAL H . . 3.630 3.166 2.370 3.569 . 0 0 "[ . 1]" 1 90 1 33 SER HA 1 35 VAL H . . 5.480 4.840 3.925 5.515 0.035 3 0 "[ . 1]" 1 91 1 33 SER QB 1 34 VAL H . . 5.030 2.417 1.736 3.029 . 0 0 "[ . 1]" 1 92 1 33 SER QB 1 36 LEU H . . 5.500 4.772 3.610 5.901 0.401 1 0 "[ . 1]" 1 93 1 33 SER HB2 1 34 VAL H . . 2.950 2.736 1.925 3.143 0.193 10 0 "[ . 1]" 1 94 1 34 VAL H 1 35 VAL H . . 3.330 2.931 1.883 3.500 0.170 7 0 "[ . 1]" 1 95 1 34 VAL H 1 36 LEU H . . 5.500 5.191 3.753 6.005 0.505 1 1 "[+ . 1]" 1 96 1 34 VAL H 1 39 GLN H . . 5.500 4.659 2.845 5.617 0.117 3 0 "[ . 1]" 1 97 1 34 VAL H 1 40 THR H . . 5.500 3.861 1.866 5.642 0.142 4 0 "[ . 1]" 1 98 1 34 VAL H 1 40 THR HA . . 5.500 4.797 3.603 5.643 0.143 10 0 "[ . 1]" 1 99 1 34 VAL HA 1 35 VAL H . . 3.580 2.763 2.314 3.571 . 0 0 "[ . 1]" 1 100 1 34 VAL HA 1 39 GLN H . . 5.500 4.846 2.811 5.896 0.396 2 0 "[ . 1]" 1 101 1 34 VAL HA 1 40 THR H . . 5.500 3.705 2.219 6.255 0.755 2 1 "[ + . 1]" 1 102 1 34 VAL HB 1 35 VAL H . . 4.630 4.141 2.124 4.635 0.005 6 0 "[ . 1]" 1 103 1 34 VAL QG 1 39 GLN H . . 5.500 5.365 4.122 5.735 0.235 6 0 "[ . 1]" 1 104 1 34 VAL QG 1 100 ILE MD . . 6.000 6.246 6.039 6.616 0.616 10 1 "[ . +]" 1 105 1 34 VAL MG1 1 120 ASP H . . 5.900 5.337 4.488 5.782 . 0 0 "[ . 1]" 1 106 1 35 VAL H 1 36 LEU H . . 4.150 2.669 1.884 3.871 . 0 0 "[ . 1]" 1 107 1 35 VAL H 1 36 LEU HA . . 4.580 4.539 4.069 5.144 0.564 1 1 "[+ . 1]" 1 108 1 35 VAL H 1 39 GLN H . . 5.500 3.595 2.054 4.809 . 0 0 "[ . 1]" 1 109 1 35 VAL H 1 40 THR H . . 5.500 4.473 3.359 5.607 0.107 5 0 "[ . 1]" 1 110 1 35 VAL H 1 40 THR HA . . 5.500 5.618 4.519 6.223 0.723 7 4 "[ .-+ **]" 1 111 1 35 VAL H 1 102 GLY QA . . 5.500 4.364 3.786 5.317 . 0 0 "[ . 1]" 1 112 1 35 VAL HA 1 36 LEU H . . 4.730 3.383 2.358 3.570 . 0 0 "[ . 1]" 1 113 1 35 VAL HA 1 102 GLY H . . 5.500 4.440 3.617 5.795 0.295 10 0 "[ . 1]" 1 114 1 35 VAL HB 1 36 LEU H . . 4.530 2.681 1.825 4.466 . 0 0 "[ . 1]" 1 115 1 36 LEU H 1 99 ALA HA . . 5.500 5.394 4.826 5.789 0.289 6 0 "[ . 1]" 1 116 1 36 LEU QB 1 38 SER H . . 6.000 4.493 3.731 5.858 . 0 0 "[ . 1]" 1 117 1 36 LEU QD 1 100 ILE H . . 5.500 4.793 3.936 5.645 0.145 10 0 "[ . 1]" 1 118 1 36 LEU QD 1 101 VAL H . . 5.500 5.567 4.915 5.944 0.444 1 0 "[ . 1]" 1 119 1 37 PRO HA 1 38 SER H . . 4.130 3.061 2.317 3.570 . 0 0 "[ . 1]" 1 120 1 37 PRO QB 1 38 SER H . . 6.000 3.329 1.507 3.999 . 0 0 "[ . 1]" 1 121 1 37 PRO HB2 1 38 SER H . . 4.980 3.538 1.511 4.352 . 0 0 "[ . 1]" 1 122 1 38 SER HA 1 39 GLN H . . 4.370 3.163 2.272 3.569 . 0 0 "[ . 1]" 1 123 1 38 SER QB 1 39 GLN H . . 4.500 3.185 1.985 3.915 . 0 0 "[ . 1]" 1 124 1 38 SER QB 1 40 THR H . . 6.000 5.561 4.588 6.498 0.498 2 0 "[ . 1]" 1 125 1 38 SER HB2 1 39 GLN H . . 4.500 3.585 2.062 4.491 . 0 0 "[ . 1]" 1 126 1 39 GLN HA 1 40 THR H . . 4.220 2.546 2.140 3.565 . 0 0 "[ . 1]" 1 127 1 39 GLN QB 1 40 THR H . . 6.000 2.884 1.744 3.949 . 0 0 "[ . 1]" 1 128 1 39 GLN HB2 1 40 THR H . . 5.500 3.475 1.960 4.515 . 0 0 "[ . 1]" 1 129 1 41 PRO HA 1 42 ASP H . . 4.360 3.056 2.174 3.572 . 0 0 "[ . 1]" 1 130 1 41 PRO QB 1 42 ASP H . . 6.000 2.886 1.890 3.947 . 0 0 "[ . 1]" 1 131 1 41 PRO HB2 1 42 ASP H . . 5.500 3.025 1.900 4.300 . 0 0 "[ . 1]" 1 132 1 41 PRO QD 1 44 LYS H . . 6.000 5.858 3.388 6.437 0.437 1 0 "[ . 1]" 1 133 1 42 ASP H 1 43 GLY H . . 5.500 3.292 2.080 4.502 . 0 0 "[ . 1]" 1 134 1 42 ASP HA 1 43 GLY H . . 4.390 2.756 2.171 3.568 . 0 0 "[ . 1]" 1 135 1 42 ASP HA 1 44 LYS H . . 4.870 4.169 3.084 4.929 0.059 5 0 "[ . 1]" 1 136 1 42 ASP QB 1 43 GLY H . . 6.000 3.268 1.840 4.046 . 0 0 "[ . 1]" 1 137 1 42 ASP QB 1 44 LYS H . . 4.650 4.161 2.531 4.935 0.285 8 0 "[ . 1]" 1 138 1 42 ASP HB2 1 43 GLY H . . 5.500 3.673 1.848 4.614 . 0 0 "[ . 1]" 1 139 1 43 GLY QA 1 44 LYS H . . 4.380 2.793 2.300 2.919 . 0 0 "[ . 1]" 1 140 1 43 GLY HA2 1 44 LYS H . . 3.510 3.141 2.332 3.514 0.004 8 0 "[ . 1]" 1 141 1 43 GLY HA3 1 44 LYS H . . 4.380 3.283 2.896 3.529 . 0 0 "[ . 1]" 1 142 1 44 LYS H 1 45 LEU H . . 3.800 3.936 3.086 4.379 0.579 5 2 "[ + - 1]" 1 143 1 44 LYS HA 1 45 LEU H . . 3.400 2.716 2.155 3.514 0.114 7 0 "[ . 1]" 1 144 1 45 LEU H 1 46 ALA H . . 2.800 3.017 2.727 3.869 1.069 6 1 "[ .+ 1]" 1 145 1 45 LEU HA 1 46 ALA H . . 3.500 2.474 2.142 2.782 . 0 0 "[ . 1]" 1 146 1 45 LEU HA 1 48 ILE H . . 3.700 3.735 3.414 4.216 0.516 6 1 "[ .+ 1]" 1 147 1 45 LEU HA 1 49 ASP H . . 4.400 4.680 4.505 4.891 0.491 4 0 "[ . 1]" 1 148 1 45 LEU QB 1 46 ALA H . . 6.000 3.833 3.394 3.943 . 0 0 "[ . 1]" 1 149 1 46 ALA H 1 47 LEU H . . 2.800 2.821 2.625 3.127 0.327 7 0 "[ . 1]" 1 150 1 46 ALA H 1 48 ILE H . . 4.200 4.097 2.833 4.506 0.306 7 0 "[ . 1]" 1 151 1 46 ALA HA 1 47 LEU H . . 3.500 3.489 3.366 3.571 0.071 1 0 "[ . 1]" 1 152 1 46 ALA HA 1 48 ILE H . . 4.400 4.261 3.805 4.636 0.236 7 0 "[ . 1]" 1 153 1 46 ALA HA 1 49 ASP H . . 3.400 3.407 2.998 3.614 0.214 9 0 "[ . 1]" 1 154 1 46 ALA HA 1 50 ASP H . . 4.200 4.012 3.566 4.437 0.237 2 0 "[ . 1]" 1 155 1 46 ALA MB 1 47 LEU H . . 4.800 2.712 1.958 3.175 . 0 0 "[ . 1]" 1 156 1 47 LEU H 1 48 ILE H . . 2.800 2.512 2.135 2.802 0.002 6 0 "[ . 1]" 1 157 1 47 LEU H 1 49 ASP H . . 4.200 3.804 3.454 4.288 0.088 6 0 "[ . 1]" 1 158 1 47 LEU H 1 121 VAL QG . . 6.000 6.233 5.844 6.457 0.457 8 0 "[ . 1]" 1 159 1 47 LEU H 1 144 TRP HE1 . . 5.500 4.421 3.850 4.814 . 0 0 "[ . 1]" 1 160 1 47 LEU HA 1 48 ILE H . . 3.500 3.479 3.333 3.552 0.052 7 0 "[ . 1]" 1 161 1 47 LEU HA 1 49 ASP H . . 4.400 4.332 4.173 4.495 0.095 1 0 "[ . 1]" 1 162 1 47 LEU HA 1 50 ASP H . . 3.700 3.930 3.734 4.151 0.451 8 0 "[ . 1]" 1 163 1 47 LEU HA 1 51 PHE H . . 4.800 4.923 4.696 5.301 0.501 8 1 "[ . + 1]" 1 164 1 47 LEU QB 1 48 ILE H . . 4.200 2.841 2.507 3.235 . 0 0 "[ . 1]" 1 165 1 48 ILE H 1 49 ASP H . . 2.800 2.261 1.918 2.523 . 0 0 "[ . 1]" 1 166 1 48 ILE H 1 50 ASP H . . 4.200 4.018 3.637 4.346 0.146 2 0 "[ . 1]" 1 167 1 48 ILE H 1 144 TRP HD1 . . 5.900 6.046 5.742 6.230 0.330 1 0 "[ . 1]" 1 168 1 48 ILE H 1 144 TRP HZ2 . . 5.900 6.030 5.692 6.268 0.368 8 0 "[ . 1]" 1 169 1 48 ILE HA 1 49 ASP H . . 3.500 3.460 3.379 3.513 0.013 6 0 "[ . 1]" 1 170 1 48 ILE HA 1 50 ASP H . . 4.400 4.288 4.057 4.526 0.126 9 0 "[ . 1]" 1 171 1 48 ILE HA 1 51 PHE H . . 3.400 3.401 3.155 3.597 0.197 5 0 "[ . 1]" 1 172 1 48 ILE HA 1 52 ARG H . . 4.200 4.442 4.221 4.734 0.534 8 1 "[ . + 1]" 1 173 1 48 ILE HB 1 49 ASP H . . 4.590 3.348 2.760 4.260 . 0 0 "[ . 1]" 1 174 1 48 ILE MD 1 51 PHE H . . 6.000 4.850 4.235 6.015 0.015 1 0 "[ . 1]" 1 175 1 48 ILE MD 1 52 ARG H . . 6.000 5.079 3.859 6.094 0.094 8 0 "[ . 1]" 1 176 1 49 ASP H 1 50 ASP H . . 2.800 2.550 2.365 2.785 . 0 0 "[ . 1]" 1 177 1 49 ASP H 1 51 PHE H . . 4.400 3.858 3.691 4.135 . 0 0 "[ . 1]" 1 178 1 49 ASP H 1 144 TRP HD1 . . 5.500 5.788 5.547 6.017 0.517 9 1 "[ . +1]" 1 179 1 49 ASP HA 1 50 ASP H . . 3.500 3.520 3.472 3.556 0.056 9 0 "[ . 1]" 1 180 1 49 ASP HA 1 51 PHE H . . 4.200 4.008 3.665 4.391 0.191 5 0 "[ . 1]" 1 181 1 49 ASP HA 1 52 ARG H . . 3.400 3.554 3.242 3.901 0.501 6 1 "[ .+ 1]" 1 182 1 49 ASP HA 1 53 GLU H . . 4.400 4.638 4.121 5.052 0.652 7 3 "[ .-+* 1]" 1 183 1 49 ASP QB 1 50 ASP H . . 4.930 2.815 2.485 3.421 . 0 0 "[ . 1]" 1 184 1 50 ASP H 1 51 PHE H . . 2.800 2.501 2.358 2.590 . 0 0 "[ . 1]" 1 185 1 50 ASP H 1 52 ARG H . . 4.200 4.145 3.925 4.441 0.241 6 0 "[ . 1]" 1 186 1 50 ASP HA 1 51 PHE H . . 3.500 3.411 3.255 3.535 0.035 5 0 "[ . 1]" 1 187 1 50 ASP HA 1 52 ARG H . . 4.400 4.202 3.868 4.436 0.036 5 0 "[ . 1]" 1 188 1 50 ASP HA 1 53 GLU H . . 3.600 3.832 3.485 4.372 0.772 8 2 "[ . -+ 1]" 1 189 1 50 ASP HA 1 54 ALA H . . 4.200 4.212 3.762 4.867 0.667 7 1 "[ . + 1]" 1 190 1 50 ASP QB 1 51 PHE H . . 4.670 3.276 2.821 3.839 . 0 0 "[ . 1]" 1 191 1 51 PHE H 1 52 ARG H . . 2.800 2.389 2.065 2.633 . 0 0 "[ . 1]" 1 192 1 51 PHE H 1 52 ARG HE . . 5.500 5.361 4.359 5.692 0.192 2 0 "[ . 1]" 1 193 1 51 PHE H 1 53 GLU H . . 4.200 4.313 4.114 4.541 0.341 4 0 "[ . 1]" 1 194 1 51 PHE H 1 79 GLY QA . . 5.500 5.272 4.185 6.180 0.680 7 1 "[ . + 1]" 1 195 1 51 PHE H 1 80 GLY QA . . 5.750 5.439 3.163 6.428 0.678 10 1 "[ . +]" 1 196 1 51 PHE H 1 81 MET HA . . 5.900 5.779 4.954 6.259 0.359 7 0 "[ . 1]" 1 197 1 51 PHE H 1 144 TRP HD1 . . 5.500 4.351 2.668 5.876 0.376 8 0 "[ . 1]" 1 198 1 51 PHE HA 1 52 ARG H . . 3.500 3.480 3.349 3.537 0.037 10 0 "[ . 1]" 1 199 1 51 PHE HA 1 53 GLU H . . 4.400 4.691 4.517 4.991 0.591 6 2 "[ -.+ 1]" 1 200 1 51 PHE HA 1 54 ALA H . . 3.400 3.618 3.459 3.790 0.390 6 0 "[ . 1]" 1 201 1 51 PHE HA 1 55 TYR H . . 4.200 4.364 3.840 4.776 0.576 7 1 "[ . + 1]" 1 202 1 51 PHE QB 1 52 ARG H . . 5.080 2.860 2.593 3.230 . 0 0 "[ . 1]" 1 203 1 51 PHE QB 1 54 ALA H . . 6.000 5.144 4.999 5.383 . 0 0 "[ . 1]" 1 204 1 52 ARG H 1 53 GLU H . . 2.800 2.733 2.435 2.979 0.179 7 0 "[ . 1]" 1 205 1 52 ARG H 1 54 ALA H . . 4.200 4.035 3.641 4.294 0.094 10 0 "[ . 1]" 1 206 1 52 ARG H 1 76 TYR H . . 5.750 6.168 5.869 6.426 0.676 10 4 "[ .* -*+]" 1 207 1 52 ARG HA 1 53 GLU H . . 3.500 3.561 3.548 3.572 0.072 8 0 "[ . 1]" 1 208 1 52 ARG HA 1 54 ALA H . . 4.400 4.571 4.336 4.778 0.378 9 0 "[ . 1]" 1 209 1 52 ARG HA 1 55 TYR H . . 3.400 3.701 3.472 3.916 0.516 8 2 "[ . +-1]" 1 210 1 52 ARG HA 1 56 TYR H . . 4.200 4.455 4.003 4.778 0.578 7 1 "[ . + 1]" 1 211 1 52 ARG QB 1 53 GLU H . . 5.220 2.347 2.104 2.543 . 0 0 "[ . 1]" 1 212 1 53 GLU H 1 54 ALA H . . 2.800 2.680 2.495 2.835 0.035 7 0 "[ . 1]" 1 213 1 53 GLU H 1 55 TYR H . . 4.200 4.068 3.767 4.390 0.190 7 0 "[ . 1]" 1 214 1 53 GLU H 1 75 GLY H . . 5.900 5.621 5.097 6.099 0.199 6 0 "[ . 1]" 1 215 1 53 GLU H 1 79 GLY H . . 4.800 5.034 4.865 5.285 0.485 9 0 "[ . 1]" 1 216 1 53 GLU H 1 80 GLY H . . 4.430 4.050 2.756 4.702 0.272 4 0 "[ . 1]" 1 217 1 53 GLU HA 1 54 ALA H . . 3.500 3.537 3.498 3.555 0.055 10 0 "[ . 1]" 1 218 1 53 GLU HA 1 55 TYR H . . 4.400 3.998 3.650 4.406 0.006 1 0 "[ . 1]" 1 219 1 53 GLU HA 1 56 TYR H . . 3.400 3.264 2.921 3.541 0.141 10 0 "[ . 1]" 1 220 1 53 GLU HA 1 57 TRP H . . 4.200 4.279 3.944 4.559 0.359 4 0 "[ . 1]" 1 221 1 53 GLU QB 1 54 ALA H . . 5.600 2.716 2.381 3.274 . 0 0 "[ . 1]" 1 222 1 53 GLU QB 1 55 TYR H . . 6.000 4.633 4.289 5.009 . 0 0 "[ . 1]" 1 223 1 53 GLU QB 1 56 TYR H . . 6.000 4.861 4.508 5.151 . 0 0 "[ . 1]" 1 224 1 54 ALA H 1 55 TYR H . . 2.800 2.702 2.584 2.890 0.090 7 0 "[ . 1]" 1 225 1 54 ALA H 1 56 TYR H . . 4.200 4.213 3.977 4.591 0.391 10 0 "[ . 1]" 1 226 1 54 ALA H 1 58 LEU QD . . 6.000 5.916 5.468 6.205 0.205 7 0 "[ . 1]" 1 227 1 54 ALA H 1 81 MET HA . . 5.500 5.462 4.893 6.001 0.501 5 1 "[ + 1]" 1 228 1 54 ALA H 1 82 ALA H . . 5.500 5.793 5.573 6.147 0.647 10 2 "[ - . +]" 1 229 1 54 ALA HA 1 55 TYR H . . 3.500 3.470 3.353 3.547 0.047 1 0 "[ . 1]" 1 230 1 54 ALA HA 1 56 TYR H . . 4.400 4.495 4.366 4.612 0.212 10 0 "[ . 1]" 1 231 1 54 ALA HA 1 57 TRP H . . 3.400 3.690 3.424 3.883 0.483 7 0 "[ . 1]" 1 232 1 54 ALA HA 1 58 LEU H . . 4.400 4.373 3.864 5.175 0.775 7 1 "[ . + 1]" 1 233 1 54 ALA HA 1 82 ALA H . . 5.950 6.063 5.761 6.878 0.928 10 1 "[ . +]" 1 234 1 54 ALA HA 1 142 PHE H . . 5.500 4.904 3.294 5.793 0.293 7 0 "[ . 1]" 1 235 1 54 ALA MB 1 55 TYR H . . 4.200 2.838 2.481 3.165 . 0 0 "[ . 1]" 1 236 1 55 TYR H 1 56 TYR H . . 2.800 2.399 2.090 2.710 . 0 0 "[ . 1]" 1 237 1 55 TYR H 1 57 TRP H . . 4.200 3.763 3.392 4.250 0.050 7 0 "[ . 1]" 1 238 1 55 TYR HA 1 56 TYR H . . 3.500 3.515 3.457 3.555 0.055 10 0 "[ . 1]" 1 239 1 55 TYR HA 1 57 TRP H . . 4.400 3.970 3.707 4.422 0.022 10 0 "[ . 1]" 1 240 1 55 TYR HA 1 58 LEU H . . 3.400 3.439 3.183 3.931 0.531 9 1 "[ . +1]" 1 241 1 55 TYR HA 1 59 ARG H . . 4.200 3.927 2.984 4.634 0.434 9 0 "[ . 1]" 1 242 1 55 TYR QB 1 56 TYR H . . 4.200 2.702 2.452 2.919 . 0 0 "[ . 1]" 1 243 1 55 TYR QB 1 58 LEU H . . 6.000 4.946 4.798 5.325 . 0 0 "[ . 1]" 1 244 1 56 TYR H 1 57 TRP H . . 2.800 2.519 2.311 2.796 . 0 0 "[ . 1]" 1 245 1 56 TYR H 1 58 LEU H . . 4.200 4.050 3.717 4.288 0.088 7 0 "[ . 1]" 1 246 1 56 TYR H 1 69 ALA HA . . 5.750 5.466 4.846 5.881 0.131 7 0 "[ . 1]" 1 247 1 56 TYR H 1 72 TRP H . . 5.950 6.262 5.963 6.770 0.820 10 2 "[ . -+]" 1 248 1 56 TYR H 1 76 TYR HA . . 5.950 6.388 6.021 7.226 1.276 9 3 "[ .- +*]" 1 249 1 56 TYR HA 1 57 TRP H . . 3.500 3.411 3.235 3.532 0.032 10 0 "[ . 1]" 1 250 1 56 TYR HA 1 58 LEU H . . 4.400 4.272 3.744 4.503 0.103 1 0 "[ . 1]" 1 251 1 56 TYR HA 1 59 ARG H . . 3.400 3.486 2.917 3.978 0.578 8 2 "[ - + 1]" 1 252 1 56 TYR HA 1 60 MET H . . 4.200 3.361 2.646 4.090 . 0 0 "[ . 1]" 1 253 1 56 TYR HA 1 69 ALA H . . 5.500 5.744 5.465 6.420 0.920 7 1 "[ . + 1]" 1 254 1 56 TYR QB 1 57 TRP H . . 4.700 3.292 2.998 3.534 . 0 0 "[ . 1]" 1 255 1 57 TRP H 1 58 LEU H . . 2.800 2.280 1.866 2.681 . 0 0 "[ . 1]" 1 256 1 57 TRP H 1 59 ARG H . . 4.200 3.479 3.106 3.901 . 0 0 "[ . 1]" 1 257 1 57 TRP HA 1 58 LEU H . . 3.500 3.470 3.305 3.536 0.036 7 0 "[ . 1]" 1 258 1 57 TRP HA 1 59 ARG H . . 4.400 4.138 3.955 4.264 . 0 0 "[ . 1]" 1 259 1 57 TRP HA 1 60 MET H . . 3.400 3.811 3.520 4.089 0.689 10 3 "[ -.* +]" 1 260 1 57 TRP QB 1 58 LEU H . . 5.070 2.854 2.565 3.313 . 0 0 "[ . 1]" 1 261 1 58 LEU H 1 59 ARG H . . 2.800 2.146 1.911 2.347 . 0 0 "[ . 1]" 1 262 1 58 LEU H 1 60 MET H . . 4.300 3.591 3.317 4.318 0.018 9 0 "[ . 1]" 1 263 1 58 LEU HA 1 59 ARG H . . 3.500 3.358 3.273 3.433 . 0 0 "[ . 1]" 1 264 1 58 LEU HA 1 60 MET H . . 5.000 4.305 3.939 4.828 . 0 0 "[ . 1]" 1 265 1 58 LEU QB 1 59 ARG H . . 4.700 3.284 3.023 3.821 . 0 0 "[ . 1]" 1 266 1 59 ARG H 1 60 MET H . . 2.800 1.982 1.841 2.573 . 0 0 "[ . 1]" 1 267 1 59 ARG H 1 61 ASN H . . 4.200 3.884 2.918 4.920 0.720 1 3 "[+ *.- 1]" 1 268 1 59 ARG H 1 142 PHE QB . . 6.200 6.563 6.395 6.826 0.626 4 2 "[- +. 1]" 1 269 1 59 ARG HA 1 60 MET H . . 3.500 3.353 3.201 3.558 0.058 9 0 "[ . 1]" 1 270 1 59 ARG HA 1 61 ASN H . . 4.400 4.103 3.226 4.739 0.339 10 0 "[ . 1]" 1 271 1 59 ARG QB 1 60 MET H . . 4.450 3.138 2.380 3.492 . 0 0 "[ . 1]" 1 272 1 60 MET H 1 69 ALA HA . . 5.500 5.693 5.313 6.044 0.544 9 2 "[ . - +1]" 1 273 1 60 MET HA 1 61 ASN H . . 3.500 3.479 3.282 3.570 0.070 4 0 "[ . 1]" 1 274 1 60 MET QB 1 61 ASN H . . 5.150 3.000 2.212 3.573 . 0 0 "[ . 1]" 1 275 1 61 ASN QB 1 62 SER H . . 6.000 2.407 1.852 3.719 . 0 0 "[ . 1]" 1 276 1 62 SER HA 1 63 ASP H . . 3.830 2.568 2.173 3.176 . 0 0 "[ . 1]" 1 277 1 62 SER HA 1 65 ASP H . . 5.500 5.177 3.930 5.656 0.156 6 0 "[ . 1]" 1 278 1 62 SER HA 1 67 LYS H . . 5.000 5.281 5.026 5.646 0.646 9 2 "[ . +-]" 1 279 1 62 SER QB 1 63 ASP H . . 4.030 2.443 1.924 3.243 . 0 0 "[ . 1]" 1 280 1 63 ASP H 1 64 GLU H . . 2.800 2.600 1.863 2.946 0.146 9 0 "[ . 1]" 1 281 1 63 ASP H 1 264 ILE H . . 5.500 4.576 2.829 5.693 0.193 7 0 "[ . 1]" 1 282 1 63 ASP H 1 265 LYS H . . 5.500 5.587 5.234 5.804 0.304 8 0 "[ . 1]" 1 283 1 63 ASP HA 1 64 GLU H . . 4.820 3.256 2.350 3.561 . 0 0 "[ . 1]" 1 284 1 63 ASP QB 1 64 GLU H . . 5.210 2.802 1.944 4.007 . 0 0 "[ . 1]" 1 285 1 64 GLU H 1 262 ARG HA . . 5.500 4.852 3.075 5.621 0.121 4 0 "[ . 1]" 1 286 1 64 GLU H 1 263 SER H . . 5.500 5.079 3.827 5.756 0.256 3 0 "[ . 1]" 1 287 1 64 GLU H 1 264 ILE H . . 5.500 4.898 3.628 5.596 0.096 5 0 "[ . 1]" 1 288 1 64 GLU HA 1 65 ASP H . . 3.490 3.354 2.648 3.568 0.078 6 0 "[ . 1]" 1 289 1 64 GLU HA 1 93 TRP H . . 5.500 5.820 5.602 6.259 0.759 1 1 "[+ . 1]" 1 290 1 64 GLU QB 1 65 ASP H . . 4.740 2.805 2.100 3.900 . 0 0 "[ . 1]" 1 291 1 65 ASP H 1 66 SER H . . 2.800 2.566 1.823 2.865 0.065 10 0 "[ . 1]" 1 292 1 65 ASP HA 1 66 SER H . . 4.530 3.507 3.120 3.569 . 0 0 "[ . 1]" 1 293 1 65 ASP QB 1 66 SER H . . 6.000 2.784 2.045 3.591 . 0 0 "[ . 1]" 1 294 1 66 SER H 1 67 LYS H . . 3.000 3.164 3.059 3.553 0.553 9 1 "[ . +1]" 1 295 1 66 SER HA 1 67 LYS H . . 4.020 2.454 2.184 2.620 . 0 0 "[ . 1]" 1 296 1 66 SER HA 1 68 VAL H . . 4.400 4.526 4.390 4.653 0.253 10 0 "[ . 1]" 1 297 1 66 SER HA 1 69 ALA H . . 3.400 3.484 3.296 4.102 0.702 9 1 "[ . +1]" 1 298 1 66 SER QB 1 67 LYS H . . 4.840 3.929 3.897 3.970 . 0 0 "[ . 1]" 1 299 1 67 LYS H 1 68 VAL H . . 3.650 3.236 3.140 3.342 . 0 0 "[ . 1]" 1 300 1 67 LYS H 1 69 ALA H . . 4.200 3.651 3.522 4.092 . 0 0 "[ . 1]" 1 301 1 67 LYS HA 1 68 VAL H . . 4.220 3.549 3.539 3.567 . 0 0 "[ . 1]" 1 302 1 67 LYS HA 1 69 ALA H . . 4.400 4.230 4.003 4.430 0.030 6 0 "[ . 1]" 1 303 1 67 LYS HA 1 70 ALA H . . 3.900 4.034 3.434 4.297 0.397 7 0 "[ . 1]" 1 304 1 67 LYS HA 1 253 LEU H . . 5.500 5.174 4.360 5.753 0.253 9 0 "[ . 1]" 1 305 1 67 LYS QB 1 68 VAL H . . 4.500 2.147 1.920 2.386 . 0 0 "[ . 1]" 1 306 1 68 VAL H 1 69 ALA H . . 2.840 2.549 2.440 2.821 . 0 0 "[ . 1]" 1 307 1 68 VAL H 1 70 ALA H . . 4.200 4.236 4.119 4.447 0.247 10 0 "[ . 1]" 1 308 1 68 VAL H 1 253 LEU HA . . 5.500 5.439 5.052 5.669 0.169 2 0 "[ . 1]" 1 309 1 68 VAL H 1 253 LEU QB . . 6.000 5.945 4.868 6.164 0.164 4 0 "[ . 1]" 1 310 1 68 VAL H 1 253 LEU HG . . 5.500 5.467 5.153 5.556 0.056 10 0 "[ . 1]" 1 311 1 68 VAL HA 1 69 ALA H . . 3.500 3.399 3.245 3.513 0.013 9 0 "[ . 1]" 1 312 1 68 VAL HA 1 71 TRP H . . 3.900 3.837 3.307 4.085 0.185 10 0 "[ . 1]" 1 313 1 68 VAL HA 1 72 TRP H . . 5.500 5.716 5.311 6.279 0.779 10 1 "[ . +]" 1 314 1 68 VAL QG 1 70 ALA H . . 6.000 4.371 3.983 4.639 . 0 0 "[ . 1]" 1 315 1 69 ALA H 1 70 ALA H . . 2.800 2.454 2.133 2.741 . 0 0 "[ . 1]" 1 316 1 69 ALA H 1 71 TRP H . . 4.200 4.370 4.096 4.604 0.404 10 0 "[ . 1]" 1 317 1 69 ALA HA 1 70 ALA H . . 3.500 3.462 3.413 3.542 0.042 10 0 "[ . 1]" 1 318 1 69 ALA HA 1 71 TRP H . . 4.400 4.079 3.888 4.446 0.046 1 0 "[ . 1]" 1 319 1 69 ALA HA 1 72 TRP H . . 3.400 3.450 3.233 3.779 0.379 7 0 "[ . 1]" 1 320 1 69 ALA HA 1 73 ASP H . . 4.420 4.454 4.240 5.079 0.659 10 1 "[ . +]" 1 321 1 69 ALA MB 1 70 ALA H . . 4.200 2.916 2.513 3.080 . 0 0 "[ . 1]" 1 322 1 69 ALA MB 1 72 TRP H . . 5.500 4.373 3.919 4.850 . 0 0 "[ . 1]" 1 323 1 70 ALA H 1 71 TRP H . . 2.800 2.770 2.433 3.138 0.338 10 0 "[ . 1]" 1 324 1 70 ALA H 1 72 TRP H . . 4.200 4.232 4.076 4.410 0.210 7 0 "[ . 1]" 1 325 1 70 ALA HA 1 71 TRP H . . 3.500 3.530 3.451 3.555 0.055 1 0 "[ . 1]" 1 326 1 70 ALA HA 1 72 TRP H . . 4.400 4.089 3.547 4.378 . 0 0 "[ . 1]" 1 327 1 70 ALA HA 1 73 ASP H . . 3.400 3.035 2.885 3.157 . 0 0 "[ . 1]" 1 328 1 70 ALA HA 1 74 TYR H . . 4.400 4.804 4.560 5.236 0.836 10 3 "[ .* -+]" 1 329 1 70 ALA MB 1 71 TRP H . . 4.440 2.658 2.529 2.968 . 0 0 "[ . 1]" 1 330 1 70 ALA MB 1 73 ASP H . . 5.490 4.219 4.055 4.385 . 0 0 "[ . 1]" 1 331 1 71 TRP H 1 72 TRP H . . 2.800 2.741 2.552 2.832 0.032 1 0 "[ . 1]" 1 332 1 71 TRP H 1 73 ASP H . . 4.200 3.832 3.662 4.163 . 0 0 "[ . 1]" 1 333 1 71 TRP H 1 252 GLU HA . . 5.500 3.416 2.949 4.873 . 0 0 "[ . 1]" 1 334 1 71 TRP H 1 252 GLU QG . . 5.500 4.006 1.879 4.776 . 0 0 "[ . 1]" 1 335 1 71 TRP H 1 255 ARG QB . . 5.500 5.105 4.772 5.514 0.014 1 0 "[ . 1]" 1 336 1 71 TRP H 1 255 ARG QG . . 5.500 5.568 5.188 5.919 0.419 7 0 "[ . 1]" 1 337 1 71 TRP HA 1 72 TRP H . . 3.500 3.502 3.372 3.545 0.045 7 0 "[ . 1]" 1 338 1 71 TRP HA 1 73 ASP H . . 4.400 4.211 4.043 4.332 . 0 0 "[ . 1]" 1 339 1 71 TRP HA 1 74 TYR H . . 4.420 4.613 4.309 5.020 0.600 9 2 "[ -. +1]" 1 340 1 71 TRP QB 1 72 TRP H . . 5.110 2.764 2.527 3.163 . 0 0 "[ . 1]" 1 341 1 72 TRP H 1 73 ASP H . . 2.800 2.202 2.117 2.280 . 0 0 "[ . 1]" 1 342 1 72 TRP H 1 74 TYR H . . 4.200 4.282 3.934 4.515 0.315 9 0 "[ . 1]" 1 343 1 72 TRP HA 1 73 ASP H . . 3.500 3.387 3.267 3.463 . 0 0 "[ . 1]" 1 344 1 72 TRP HA 1 74 TYR H . . 4.400 3.601 3.397 3.853 . 0 0 "[ . 1]" 1 345 1 72 TRP HA 1 75 GLY H . . 3.400 3.612 3.402 3.930 0.530 9 1 "[ . +1]" 1 346 1 72 TRP HA 1 76 TYR H . . 4.640 4.734 4.205 5.324 0.684 9 1 "[ . +1]" 1 347 1 72 TRP QB 1 73 ASP H . . 5.200 3.253 3.003 3.694 . 0 0 "[ . 1]" 1 348 1 73 ASP H 1 74 TYR H . . 2.800 2.772 2.713 2.830 0.030 8 0 "[ . 1]" 1 349 1 73 ASP H 1 75 GLY H . . 4.200 4.379 4.284 4.545 0.345 9 0 "[ . 1]" 1 350 1 73 ASP HA 1 74 TYR H . . 3.500 3.486 3.400 3.523 0.023 8 0 "[ . 1]" 1 351 1 73 ASP HA 1 75 GLY H . . 4.400 3.859 3.673 4.123 . 0 0 "[ . 1]" 1 352 1 73 ASP HA 1 76 TYR H . . 3.400 2.939 2.825 3.206 . 0 0 "[ . 1]" 1 353 1 73 ASP HA 1 77 GLN H . . 4.200 4.303 3.793 4.582 0.382 3 0 "[ . 1]" 1 354 1 73 ASP QB 1 74 TYR H . . 4.720 2.859 2.684 3.143 . 0 0 "[ . 1]" 1 355 1 73 ASP QB 1 75 GLY H . . 6.000 4.730 4.540 4.895 . 0 0 "[ . 1]" 1 356 1 74 TYR H 1 75 GLY H . . 2.800 2.749 2.438 2.911 0.111 9 0 "[ . 1]" 1 357 1 74 TYR H 1 76 TYR H . . 4.200 3.998 3.809 4.189 . 0 0 "[ . 1]" 1 358 1 74 TYR HA 1 75 GLY H . . 3.680 3.500 3.447 3.539 . 0 0 "[ . 1]" 1 359 1 74 TYR HA 1 76 TYR H . . 4.400 4.604 4.343 4.775 0.375 10 0 "[ . 1]" 1 360 1 74 TYR HA 1 77 GLN H . . 4.200 4.520 4.414 4.733 0.533 6 1 "[ .+ 1]" 1 361 1 74 TYR QB 1 75 GLY H . . 4.550 2.838 2.584 3.419 . 0 0 "[ . 1]" 1 362 1 74 TYR QB 1 76 TYR H . . 6.000 4.682 4.481 5.089 . 0 0 "[ . 1]" 1 363 1 75 GLY H 1 76 TYR H . . 2.910 2.162 2.007 2.318 . 0 0 "[ . 1]" 1 364 1 75 GLY H 1 77 GLN H . . 4.200 4.000 3.818 4.242 0.042 8 0 "[ . 1]" 1 365 1 75 GLY H 1 78 ILE QG . . 6.000 6.006 4.620 6.321 0.321 3 0 "[ . 1]" 1 366 1 75 GLY QA 1 76 TYR H . . 3.500 2.818 2.774 2.875 . 0 0 "[ . 1]" 1 367 1 75 GLY QA 1 78 ILE H . . 3.900 3.736 3.133 3.962 0.062 5 0 "[ . 1]" 1 368 1 75 GLY QA 1 79 GLY H . . 6.000 4.215 3.996 4.488 . 0 0 "[ . 1]" 1 369 1 76 TYR H 1 77 GLN H . . 2.800 2.751 2.591 2.862 0.062 9 0 "[ . 1]" 1 370 1 76 TYR H 1 78 ILE H . . 4.200 4.419 3.940 4.584 0.384 4 0 "[ . 1]" 1 371 1 76 TYR HA 1 77 GLN H . . 3.970 3.471 3.424 3.512 . 0 0 "[ . 1]" 1 372 1 76 TYR HA 1 78 ILE H . . 4.400 3.616 3.516 3.825 . 0 0 "[ . 1]" 1 373 1 76 TYR HA 1 79 GLY H . . 3.400 2.727 2.526 3.548 0.148 8 0 "[ . 1]" 1 374 1 76 TYR HA 1 87 LEU H . . 6.190 6.553 6.141 6.786 0.596 9 1 "[ . +1]" 1 375 1 76 TYR QB 1 77 GLN H . . 4.830 3.078 2.725 3.487 . 0 0 "[ . 1]" 1 376 1 76 TYR QB 1 78 ILE H . . 5.500 4.715 4.518 4.901 . 0 0 "[ . 1]" 1 377 1 77 GLN H 1 78 ILE H . . 2.800 2.810 2.464 2.972 0.172 4 0 "[ . 1]" 1 378 1 77 GLN H 1 79 GLY H . . 4.200 3.807 3.739 4.013 . 0 0 "[ . 1]" 1 379 1 77 GLN H 1 98 ILE MD . . 5.500 3.911 3.573 4.441 . 0 0 "[ . 1]" 1 380 1 77 GLN H 1 98 ILE HG13 . . 5.500 5.669 5.508 5.896 0.396 7 0 "[ . 1]" 1 381 1 77 GLN HA 1 78 ILE H . . 3.780 3.462 3.237 3.528 . 0 0 "[ . 1]" 1 382 1 77 GLN HA 1 79 GLY H . . 4.400 4.508 3.898 4.727 0.327 5 0 "[ . 1]" 1 383 1 77 GLN QB 1 78 ILE H . . 5.050 3.320 2.629 3.845 . 0 0 "[ . 1]" 1 384 1 77 GLN QB 1 79 GLY H . . 6.000 4.776 4.196 5.080 . 0 0 "[ . 1]" 1 385 1 78 ILE H 1 79 GLY H . . 2.840 1.800 1.681 1.951 . 0 0 "[ . 1]" 1 386 1 78 ILE H 1 84 ARG H . . 5.900 5.765 5.201 6.292 0.392 9 0 "[ . 1]" 1 387 1 78 ILE HA 1 79 GLY H . . 4.350 3.264 3.064 3.435 . 0 0 "[ . 1]" 1 388 1 78 ILE HA 1 83 ASP H . . 5.950 6.220 5.886 6.607 0.657 7 1 "[ . + 1]" 1 389 1 78 ILE HA 1 84 ARG H . . 5.200 4.391 3.805 5.372 0.172 8 0 "[ . 1]" 1 390 1 78 ILE HA 1 84 ARG HA . . 5.000 3.121 2.031 4.971 . 0 0 "[ . 1]" 1 391 1 78 ILE MD 1 80 GLY H . . 6.000 4.743 2.161 6.326 0.326 10 0 "[ . 1]" 1 392 1 78 ILE QG 1 81 MET H . . 6.000 6.155 5.715 6.757 0.757 10 2 "[ - . +]" 1 393 1 79 GLY H 1 80 GLY H . . 3.860 3.965 3.543 4.463 0.603 3 1 "[ + . 1]" 1 394 1 79 GLY H 1 80 GLY QA . . 6.000 4.866 4.307 5.217 . 0 0 "[ . 1]" 1 395 1 79 GLY H 1 83 ASP QB . . 6.000 5.393 4.398 6.340 0.340 5 0 "[ . 1]" 1 396 1 79 GLY H 1 98 ILE MD . . 6.500 6.650 6.500 6.907 0.407 7 0 "[ . 1]" 1 397 1 79 GLY QA 1 80 GLY H . . 4.400 2.246 2.113 2.362 . 0 0 "[ . 1]" 1 398 1 79 GLY QA 1 82 ALA H . . 6.000 4.186 3.532 5.099 . 0 0 "[ . 1]" 1 399 1 79 GLY HA2 1 80 GLY H . . 4.450 2.546 2.205 3.241 . 0 0 "[ . 1]" 1 400 1 79 GLY HA3 1 80 GLY H . . 3.850 3.026 2.141 3.547 . 0 0 "[ . 1]" 1 401 1 80 GLY QA 1 81 MET H . . 3.570 2.882 2.747 2.920 . 0 0 "[ . 1]" 1 402 1 80 GLY HA2 1 81 MET H . . 4.690 3.328 3.089 3.527 . 0 0 "[ . 1]" 1 403 1 80 GLY HA3 1 81 MET H . . 3.570 3.193 2.865 3.426 . 0 0 "[ . 1]" 1 404 1 81 MET H 1 83 ASP HB2 . . 5.500 5.356 4.893 6.054 0.554 8 1 "[ . + 1]" 1 405 1 81 MET H 1 144 TRP H . . 5.500 5.110 4.289 5.615 0.115 9 0 "[ . 1]" 1 406 1 81 MET H 1 144 TRP HD1 . . 5.500 5.211 4.347 5.732 0.232 8 0 "[ . 1]" 1 407 1 81 MET HA 1 82 ALA H . . 4.120 3.523 3.386 3.571 . 0 0 "[ . 1]" 1 408 1 81 MET HA 1 143 LEU H . . 5.700 4.926 3.468 5.872 0.172 7 0 "[ . 1]" 1 409 1 81 MET QB 1 82 ALA H . . 4.870 2.699 1.797 3.535 . 0 0 "[ . 1]" 1 410 1 81 MET HB2 1 82 ALA H . . 4.370 3.792 3.223 4.436 0.066 10 0 "[ . 1]" 1 411 1 82 ALA H 1 144 TRP H . . 5.500 5.433 5.006 5.696 0.196 8 0 "[ . 1]" 1 412 1 82 ALA H 1 144 TRP HA . . 5.500 5.494 4.844 5.975 0.475 4 0 "[ . 1]" 1 413 1 82 ALA HA 1 83 ASP H . . 3.640 2.864 2.453 3.567 . 0 0 "[ . 1]" 1 414 1 82 ALA HA 1 144 TRP H . . 5.900 6.198 5.371 6.628 0.728 9 3 "[ - *. +1]" 1 415 1 82 ALA MB 1 83 ASP H . . 4.190 3.364 1.981 3.719 . 0 0 "[ . 1]" 1 416 1 82 ALA MB 1 84 ARG H . . 6.000 5.155 2.717 5.985 . 0 0 "[ . 1]" 1 417 1 83 ASP H 1 84 ARG H . . 2.810 2.793 2.023 3.330 0.520 5 1 "[ + 1]" 1 418 1 83 ASP HA 1 84 ARG H . . 3.420 3.233 2.240 3.557 0.137 3 0 "[ . 1]" 1 419 1 83 ASP QB 1 84 ARG H . . 4.480 2.609 1.897 4.015 . 0 0 "[ . 1]" 1 420 1 84 ARG H 1 85 THR H . . 2.800 2.854 2.736 3.126 0.326 8 0 "[ . 1]" 1 421 1 84 ARG H 1 86 THR H . . 4.300 4.349 4.008 4.722 0.422 1 0 "[ . 1]" 1 422 1 84 ARG HA 1 85 THR H . . 4.520 2.770 2.266 3.484 . 0 0 "[ . 1]" 1 423 1 84 ARG HA 1 87 LEU H . . 3.960 4.154 3.784 4.774 0.814 8 3 "[* . -+ 1]" 1 424 1 84 ARG QB 1 85 THR H . . 6.000 3.872 3.498 4.051 . 0 0 "[ . 1]" 1 425 1 84 ARG QG 1 86 THR H . . 6.000 4.699 1.846 6.007 0.007 4 0 "[ . 1]" 1 426 1 85 THR H 1 86 THR H . . 2.860 2.264 1.861 2.928 0.068 8 0 "[ . 1]" 1 427 1 85 THR H 1 87 LEU H . . 4.300 3.376 2.432 4.108 . 0 0 "[ . 1]" 1 428 1 85 THR HA 1 86 THR H . . 4.420 3.376 3.035 3.559 . 0 0 "[ . 1]" 1 429 1 85 THR HA 1 88 VAL H . . 3.960 4.150 3.833 4.663 0.703 8 3 "[- . *+ 1]" 1 430 1 86 THR H 1 87 LEU H . . 2.880 2.602 2.233 2.884 0.004 8 0 "[ . 1]" 1 431 1 86 THR H 1 88 VAL H . . 4.300 4.209 3.791 4.605 0.305 8 0 "[ . 1]" 1 432 1 86 THR HA 1 87 LEU H . . 4.490 3.286 2.830 3.520 . 0 0 "[ . 1]" 1 433 1 86 THR HB 1 87 LEU H . . 4.130 3.822 3.193 4.183 0.053 7 0 "[ . 1]" 1 434 1 87 LEU H 1 88 VAL H . . 2.800 2.727 2.397 2.994 0.194 8 0 "[ . 1]" 1 435 1 87 LEU HA 1 88 VAL H . . 4.570 3.200 2.782 3.440 . 0 0 "[ . 1]" 1 436 1 87 LEU HA 1 89 ASP H . . 4.730 4.096 3.649 4.856 0.126 2 0 "[ . 1]" 1 437 1 87 LEU HA 1 90 ASN H . . 3.830 3.010 2.767 3.370 . 0 0 "[ . 1]" 1 438 1 87 LEU QB 1 88 VAL H . . 6.000 3.735 2.986 4.041 . 0 0 "[ . 1]" 1 439 1 87 LEU HG 1 90 ASN H . . 5.500 5.291 4.822 5.630 0.130 9 0 "[ . 1]" 1 440 1 88 VAL H 1 89 ASP H . . 2.800 2.806 2.592 3.040 0.240 5 0 "[ . 1]" 1 441 1 88 VAL HA 1 89 ASP H . . 3.740 3.543 3.502 3.570 . 0 0 "[ . 1]" 1 442 1 88 VAL HA 1 91 ASN H . . 3.960 4.045 3.858 4.318 0.358 8 0 "[ . 1]" 1 443 1 88 VAL QG 1 90 ASN H . . 6.000 3.899 3.516 4.620 . 0 0 "[ . 1]" 1 444 1 89 ASP H 1 90 ASN H . . 3.040 2.258 2.008 2.412 . 0 0 "[ . 1]" 1 445 1 89 ASP HA 1 90 ASN H . . 3.500 3.368 3.228 3.537 0.037 3 0 "[ . 1]" 1 446 1 89 ASP HA 1 92 THR H . . 4.420 4.750 4.521 4.873 0.453 10 0 "[ . 1]" 1 447 1 89 ASP QB 1 90 ASN H . . 5.920 3.145 2.609 3.458 . 0 0 "[ . 1]" 1 448 1 90 ASN H 1 91 ASN H . . 2.800 2.226 1.959 2.526 . 0 0 "[ . 1]" 1 449 1 90 ASN H 1 92 THR H . . 4.300 4.439 4.225 4.645 0.345 3 0 "[ . 1]" 1 450 1 90 ASN HA 1 91 ASN H . . 3.500 3.319 3.273 3.381 . 0 0 "[ . 1]" 1 451 1 90 ASN HA 1 93 TRP H . . 3.400 3.328 3.035 3.542 0.142 9 0 "[ . 1]" 1 452 1 90 ASN QB 1 91 ASN H . . 6.000 3.294 3.179 3.379 . 0 0 "[ . 1]" 1 453 1 91 ASN H 1 92 THR H . . 2.800 2.805 2.686 2.871 0.071 7 0 "[ . 1]" 1 454 1 91 ASN H 1 93 TRP H . . 4.300 4.540 4.387 4.731 0.431 7 0 "[ . 1]" 1 455 1 91 ASN HA 1 92 THR H . . 3.500 3.488 3.449 3.503 0.003 5 0 "[ . 1]" 1 456 1 91 ASN HA 1 94 ASN H . . 3.400 3.237 2.974 3.425 0.025 6 0 "[ . 1]" 1 457 1 91 ASN HA 1 95 ASN H . . 4.200 3.490 3.035 4.041 . 0 0 "[ . 1]" 1 458 1 91 ASN QB 1 92 THR H . . 6.000 2.974 2.777 3.582 . 0 0 "[ . 1]" 1 459 1 92 THR H 1 93 TRP H . . 2.800 2.724 2.511 2.823 0.023 7 0 "[ . 1]" 1 460 1 92 THR H 1 94 ASN H . . 4.300 3.696 3.519 3.965 . 0 0 "[ . 1]" 1 461 1 92 THR HA 1 93 TRP H . . 3.560 3.546 3.512 3.568 0.008 7 0 "[ . 1]" 1 462 1 92 THR HA 1 95 ASN H . . 3.900 4.039 3.854 4.224 0.324 7 0 "[ . 1]" 1 463 1 92 THR HA 1 96 THR H . . 4.600 4.897 4.798 5.084 0.484 10 0 "[ . 1]" 1 464 1 92 THR HB 1 93 TRP H . . 4.580 2.996 2.277 3.921 . 0 0 "[ . 1]" 1 465 1 93 TRP H 1 94 ASN H . . 2.800 2.337 2.171 2.509 . 0 0 "[ . 1]" 1 466 1 93 TRP H 1 95 ASN H . . 4.300 4.173 3.869 4.442 0.142 6 0 "[ . 1]" 1 467 1 93 TRP HA 1 94 ASN H . . 3.560 3.328 3.217 3.529 . 0 0 "[ . 1]" 1 468 1 93 TRP HA 1 96 THR H . . 3.420 3.597 3.440 3.841 0.421 8 0 "[ . 1]" 1 469 1 93 TRP HA 1 97 HIS H . . 4.200 4.349 4.134 4.481 0.281 9 0 "[ . 1]" 1 470 1 93 TRP QB 1 94 ASN H . . 4.650 3.264 2.642 3.504 . 0 0 "[ . 1]" 1 471 1 94 ASN H 1 95 ASN H . . 2.800 2.317 2.055 2.646 . 0 0 "[ . 1]" 1 472 1 94 ASN H 1 95 ASN HA . . 5.280 4.985 4.759 5.253 . 0 0 "[ . 1]" 1 473 1 94 ASN H 1 96 THR H . . 5.500 3.787 3.463 4.180 . 0 0 "[ . 1]" 1 474 1 94 ASN HA 1 95 ASN H . . 3.500 3.522 3.506 3.544 0.044 10 0 "[ . 1]" 1 475 1 94 ASN HA 1 97 HIS H . . 3.400 3.412 3.245 3.534 0.134 5 0 "[ . 1]" 1 476 1 94 ASN HA 1 98 ILE H . . 4.200 4.087 3.712 4.265 0.065 5 0 "[ . 1]" 1 477 1 94 ASN QB 1 95 ASN H . . 6.000 2.898 2.669 3.252 . 0 0 "[ . 1]" 1 478 1 95 ASN H 1 96 THR H . . 2.800 2.565 2.423 2.698 . 0 0 "[ . 1]" 1 479 1 95 ASN H 1 97 HIS H . . 4.300 4.026 3.753 4.283 . 0 0 "[ . 1]" 1 480 1 95 ASN HA 1 96 THR H . . 3.500 3.502 3.459 3.526 0.026 4 0 "[ . 1]" 1 481 1 95 ASN HA 1 98 ILE H . . 3.400 3.495 3.378 3.645 0.245 8 0 "[ . 1]" 1 482 1 95 ASN HA 1 99 ALA H . . 4.200 4.025 3.828 4.233 0.033 8 0 "[ . 1]" 1 483 1 95 ASN QB 1 96 THR H . . 6.000 2.754 2.599 2.906 . 0 0 "[ . 1]" 1 484 1 96 THR H 1 97 HIS H . . 2.800 2.468 2.260 2.642 . 0 0 "[ . 1]" 1 485 1 96 THR H 1 98 ILE H . . 4.200 3.846 3.722 3.926 . 0 0 "[ . 1]" 1 486 1 96 THR HA 1 97 HIS H . . 3.500 3.488 3.403 3.547 0.047 5 0 "[ . 1]" 1 487 1 96 THR HA 1 98 ILE H . . 4.400 4.190 3.955 4.301 . 0 0 "[ . 1]" 1 488 1 96 THR HA 1 99 ALA H . . 3.400 3.464 3.301 3.572 0.172 8 0 "[ . 1]" 1 489 1 96 THR HA 1 100 ILE H . . 4.200 4.123 3.938 4.409 0.209 10 0 "[ . 1]" 1 490 1 96 THR HB 1 99 ALA H . . 5.500 5.369 5.124 5.555 0.055 1 0 "[ . 1]" 1 491 1 97 HIS H 1 98 ILE H . . 2.800 2.367 2.194 2.539 . 0 0 "[ . 1]" 1 492 1 97 HIS H 1 99 ALA H . . 4.200 3.768 3.553 4.004 . 0 0 "[ . 1]" 1 493 1 97 HIS HA 1 98 ILE H . . 3.890 3.463 3.390 3.487 . 0 0 "[ . 1]" 1 494 1 97 HIS HA 1 99 ALA H . . 4.400 4.187 4.028 4.342 . 0 0 "[ . 1]" 1 495 1 97 HIS HA 1 100 ILE H . . 3.900 3.781 3.604 3.869 . 0 0 "[ . 1]" 1 496 1 97 HIS HA 1 101 VAL H . . 4.600 4.842 4.586 5.050 0.450 10 0 "[ . 1]" 1 497 1 97 HIS QB 1 98 ILE H . . 4.200 2.922 2.818 3.117 . 0 0 "[ . 1]" 1 498 1 98 ILE H 1 99 ALA H . . 2.800 2.251 2.159 2.297 . 0 0 "[ . 1]" 1 499 1 98 ILE H 1 100 ILE H . . 4.200 3.998 3.751 4.241 0.041 4 0 "[ . 1]" 1 500 1 98 ILE H 1 255 ARG QG . . 5.500 5.488 4.697 5.779 0.279 4 0 "[ . 1]" 1 501 1 98 ILE HA 1 99 ALA H . . 3.500 3.442 3.410 3.482 . 0 0 "[ . 1]" 1 502 1 98 ILE HA 1 100 ILE H . . 4.400 4.344 4.051 4.478 0.078 4 0 "[ . 1]" 1 503 1 98 ILE HA 1 101 VAL H . . 3.600 3.797 3.657 4.008 0.408 7 0 "[ . 1]" 1 504 1 98 ILE HA 1 102 GLY H . . 4.500 4.580 4.271 4.837 0.337 7 0 "[ . 1]" 1 505 1 98 ILE HB 1 99 ALA H . . 5.500 3.151 2.974 3.332 . 0 0 "[ . 1]" 1 506 1 99 ALA H 1 100 ILE H . . 2.800 2.446 2.279 2.518 . 0 0 "[ . 1]" 1 507 1 99 ALA H 1 101 VAL H . . 4.200 4.263 4.127 4.456 0.256 10 0 "[ . 1]" 1 508 1 99 ALA HA 1 100 ILE H . . 3.520 3.519 3.478 3.547 0.027 4 0 "[ . 1]" 1 509 1 99 ALA HA 1 101 VAL H . . 4.400 4.479 4.223 4.734 0.334 5 0 "[ . 1]" 1 510 1 99 ALA HA 1 102 GLY H . . 3.400 3.330 3.080 3.520 0.120 8 0 "[ . 1]" 1 511 1 99 ALA HA 1 103 LYS H . . 4.200 4.261 4.019 4.453 0.253 3 0 "[ . 1]" 1 512 1 99 ALA MB 1 100 ILE H . . 4.760 2.685 2.569 2.814 . 0 0 "[ . 1]" 1 513 1 100 ILE H 1 101 VAL H . . 2.800 2.804 2.720 2.892 0.092 4 0 "[ . 1]" 1 514 1 100 ILE H 1 102 GLY H . . 4.200 4.017 3.802 4.224 0.024 1 0 "[ . 1]" 1 515 1 100 ILE HA 1 101 VAL H . . 3.500 3.555 3.543 3.567 0.067 5 0 "[ . 1]" 1 516 1 100 ILE HA 1 102 GLY H . . 4.400 4.309 4.085 4.483 0.083 1 0 "[ . 1]" 1 517 1 100 ILE HA 1 103 LYS H . . 3.400 3.544 3.413 3.691 0.291 7 0 "[ . 1]" 1 518 1 100 ILE HA 1 104 ALA H . . 4.200 4.354 3.878 4.599 0.399 9 0 "[ . 1]" 1 519 1 100 ILE HB 1 101 VAL H . . 5.380 3.591 3.207 3.998 . 0 0 "[ . 1]" 1 520 1 100 ILE MD 1 223 GLU H . . 5.500 5.295 4.659 5.919 0.419 7 0 "[ . 1]" 1 521 1 101 VAL H 1 102 GLY H . . 2.800 2.599 2.435 2.762 . 0 0 "[ . 1]" 1 522 1 101 VAL H 1 103 LYS H . . 4.200 4.026 3.822 4.228 0.028 4 0 "[ . 1]" 1 523 1 101 VAL H 1 219 ASP HA . . 5.750 5.765 5.149 6.458 0.708 5 1 "[ + 1]" 1 524 1 101 VAL HA 1 102 GLY H . . 3.500 3.501 3.428 3.545 0.045 1 0 "[ . 1]" 1 525 1 101 VAL HA 1 103 LYS H . . 4.400 4.065 3.777 4.444 0.044 8 0 "[ . 1]" 1 526 1 101 VAL HA 1 104 ALA H . . 3.400 3.561 3.404 3.682 0.282 2 0 "[ . 1]" 1 527 1 101 VAL HA 1 105 ASN H . . 4.200 4.568 4.121 4.988 0.788 5 3 "[ *+ -1]" 1 528 1 101 VAL HA 1 223 GLU H . . 5.500 5.745 5.380 5.900 0.400 6 0 "[ . 1]" 1 529 1 101 VAL HA 1 223 GLU HA . . 5.300 7.085 5.348 7.772 2.472 7 9 "[***-**+ **]" 1 530 1 101 VAL HB 1 102 GLY H . . 5.240 3.434 2.754 3.969 . 0 0 "[ . 1]" 1 531 1 102 GLY H 1 103 LYS H . . 2.800 2.494 2.313 2.630 . 0 0 "[ . 1]" 1 532 1 102 GLY H 1 104 ALA H . . 4.200 4.095 3.751 4.291 0.091 5 0 "[ . 1]" 1 533 1 102 GLY QA 1 103 LYS H . . 3.500 2.844 2.732 2.914 . 0 0 "[ . 1]" 1 534 1 102 GLY QA 1 104 ALA H . . 4.400 4.032 3.639 4.244 . 0 0 "[ . 1]" 1 535 1 102 GLY QA 1 105 ASN H . . 3.800 3.791 3.648 3.948 0.148 5 0 "[ . 1]" 1 536 1 102 GLY QA 1 106 ALA H . . 4.200 4.468 4.250 4.971 0.771 5 1 "[ + 1]" 1 537 1 103 LYS H 1 104 ALA H . . 2.800 2.340 2.182 2.578 . 0 0 "[ . 1]" 1 538 1 103 LYS H 1 105 ASN H . . 4.200 4.154 3.774 4.509 0.309 4 0 "[ . 1]" 1 539 1 103 LYS HA 1 105 ASN H . . 4.400 4.410 4.221 4.563 0.163 9 0 "[ . 1]" 1 540 1 103 LYS HA 1 106 ALA H . . 3.400 3.484 3.349 3.650 0.250 10 0 "[ . 1]" 1 541 1 103 LYS HA 1 107 SER H . . 4.200 4.197 3.854 4.488 0.288 3 0 "[ . 1]" 1 542 1 103 LYS QB 1 104 ALA H . . 4.200 2.938 2.607 3.786 . 0 0 "[ . 1]" 1 543 1 103 LYS QB 1 105 ASN H . . 6.000 4.999 4.748 5.365 . 0 0 "[ . 1]" 1 544 1 103 LYS QD 1 105 ASN H . . 6.000 5.661 4.868 6.014 0.014 1 0 "[ . 1]" 1 545 1 104 ALA H 1 105 ASN H . . 2.800 2.702 2.339 3.108 0.308 5 0 "[ . 1]" 1 546 1 104 ALA H 1 106 ALA H . . 4.200 4.145 3.607 4.592 0.392 5 0 "[ . 1]" 1 547 1 104 ALA H 1 220 TYR HA . . 5.500 5.299 4.262 5.740 0.240 9 0 "[ . 1]" 1 548 1 104 ALA HA 1 105 ASN H . . 3.500 3.546 3.522 3.569 0.069 5 0 "[ . 1]" 1 549 1 104 ALA HA 1 106 ALA H . . 4.400 4.466 3.781 4.738 0.338 10 0 "[ . 1]" 1 550 1 104 ALA HA 1 107 SER H . . 3.400 3.502 3.261 3.697 0.297 10 0 "[ . 1]" 1 551 1 104 ALA HA 1 220 TYR H . . 5.500 4.670 4.189 6.100 0.600 5 1 "[ + 1]" 1 552 1 104 ALA HA 1 221 PHE H . . 5.900 6.211 5.834 6.479 0.579 7 2 "[ - + 1]" 1 553 1 104 ALA MB 1 105 ASN H . . 5.080 2.527 2.370 2.645 . 0 0 "[ . 1]" 1 554 1 105 ASN H 1 106 ALA H . . 2.800 2.676 2.450 2.982 0.182 5 0 "[ . 1]" 1 555 1 105 ASN H 1 107 SER H . . 4.200 3.946 3.688 4.240 0.040 3 0 "[ . 1]" 1 556 1 105 ASN HA 1 106 ALA H . . 3.500 3.511 3.299 3.564 0.064 5 0 "[ . 1]" 1 557 1 105 ASN HA 1 107 SER H . . 4.400 4.133 3.801 4.730 0.330 5 0 "[ . 1]" 1 558 1 105 ASN HA 1 111 LYS HA . . 5.500 5.018 4.747 5.594 0.094 2 0 "[ . 1]" 1 559 1 105 ASN HA 1 112 SER H . . 5.400 4.789 2.660 5.441 0.041 1 0 "[ . 1]" 1 560 1 105 ASN QB 1 106 ALA H . . 4.200 2.940 2.325 3.821 . 0 0 "[ . 1]" 1 561 1 106 ALA H 1 107 SER H . . 2.800 2.495 2.040 2.831 0.031 3 0 "[ . 1]" 1 562 1 106 ALA H 1 113 TYR H . . 5.500 5.907 5.620 6.163 0.663 5 3 "[ * + -]" 1 563 1 106 ALA H 1 115 ILE MD . . 5.500 5.553 4.916 5.784 0.284 6 0 "[ . 1]" 1 564 1 106 ALA HA 1 107 SER H . . 3.500 3.441 3.230 3.544 0.044 5 0 "[ . 1]" 1 565 1 106 ALA HA 1 111 LYS H . . 5.500 5.032 4.164 5.963 0.463 2 0 "[ . 1]" 1 566 1 106 ALA HA 1 111 LYS HA . . 5.500 3.679 2.054 5.702 0.202 5 0 "[ . 1]" 1 567 1 106 ALA HA 1 113 TYR H . . 5.500 4.994 3.601 5.625 0.125 1 0 "[ . 1]" 1 568 1 106 ALA MB 1 107 SER H . . 4.700 2.912 2.493 3.346 . 0 0 "[ . 1]" 1 569 1 108 PRO HA 1 109 GLU H . . 3.480 2.575 2.292 3.513 0.033 7 0 "[ . 1]" 1 570 1 108 PRO QB 1 109 GLU H . . 5.420 3.144 1.913 3.942 . 0 0 "[ . 1]" 1 571 1 108 PRO HB2 1 109 GLU H . . 3.920 3.345 1.930 4.295 0.375 5 0 "[ . 1]" 1 572 1 109 GLU H 1 110 GLU H . . 3.840 3.311 2.038 4.224 0.384 8 0 "[ . 1]" 1 573 1 109 GLU H 1 111 LYS H . . 5.500 4.352 2.762 5.833 0.333 10 0 "[ . 1]" 1 574 1 109 GLU H 1 111 LYS HB2 . . 5.500 5.055 3.877 6.015 0.515 2 1 "[ + . 1]" 1 575 1 109 GLU HA 1 110 GLU H . . 4.680 3.350 2.188 3.571 . 0 0 "[ . 1]" 1 576 1 110 GLU H 1 215 VAL HB . . 5.750 6.020 5.811 6.245 0.495 5 0 "[ . 1]" 1 577 1 110 GLU HA 1 111 LYS H . . 3.360 3.459 2.938 3.563 0.203 4 0 "[ . 1]" 1 578 1 110 GLU QB 1 111 LYS H . . 2.900 2.379 1.860 3.057 0.157 8 0 "[ . 1]" 1 579 1 111 LYS H 1 112 SER H . . 4.070 3.725 2.074 4.221 0.151 6 0 "[ . 1]" 1 580 1 111 LYS H 1 113 TYR HB2 . . 5.500 5.531 4.043 5.959 0.459 8 0 "[ . 1]" 1 581 1 111 LYS HA 1 112 SER H . . 4.170 2.446 2.140 3.461 . 0 0 "[ . 1]" 1 582 1 111 LYS QB 1 112 SER H . . 5.880 3.363 1.802 3.991 . 0 0 "[ . 1]" 1 583 1 112 SER H 1 113 TYR H . . 4.120 3.876 2.962 4.640 0.520 5 1 "[ + 1]" 1 584 1 112 SER HA 1 113 TYR H . . 3.990 2.592 2.146 3.569 . 0 0 "[ . 1]" 1 585 1 112 SER QB 1 113 TYR H . . 5.190 3.348 1.930 3.988 . 0 0 "[ . 1]" 1 586 1 113 TYR H 1 114 GLU H . . 4.300 4.310 3.465 4.636 0.336 10 0 "[ . 1]" 1 587 1 113 TYR H 1 115 ILE MD . . 4.750 3.046 1.944 4.672 . 0 0 "[ . 1]" 1 588 1 113 TYR H 1 115 ILE HG12 . . 5.500 4.426 3.739 5.126 . 0 0 "[ . 1]" 1 589 1 113 TYR HA 1 114 GLU H . . 3.380 2.771 2.476 3.562 0.182 7 0 "[ . 1]" 1 590 1 113 TYR HA 1 115 ILE H . . 4.200 4.063 3.614 4.188 . 0 0 "[ . 1]" 1 591 1 113 TYR QB 1 114 GLU H . . 5.270 2.283 1.896 2.683 . 0 0 "[ . 1]" 1 592 1 113 TYR HB2 1 115 ILE H . . 5.500 3.810 3.533 5.280 . 0 0 "[ . 1]" 1 593 1 113 TYR QE 1 115 ILE H . . 6.000 5.785 5.093 6.251 0.251 7 0 "[ . 1]" 1 594 1 114 GLU H 1 115 ILE H . . 2.800 2.600 2.485 2.759 . 0 0 "[ . 1]" 1 595 1 114 GLU H 1 116 LEU H . . 4.200 4.441 4.233 4.740 0.540 5 1 "[ + 1]" 1 596 1 114 GLU HA 1 115 ILE H . . 3.500 3.322 3.245 3.457 . 0 0 "[ . 1]" 1 597 1 114 GLU HA 1 116 LEU H . . 4.400 3.348 3.120 3.566 . 0 0 "[ . 1]" 1 598 1 114 GLU HA 1 117 LYS H . . 3.400 3.391 3.091 3.604 0.204 7 0 "[ . 1]" 1 599 1 114 GLU HA 1 118 GLU H . . 4.400 4.668 4.511 4.894 0.494 5 0 "[ . 1]" 1 600 1 114 GLU QB 1 115 ILE H . . 4.880 3.261 2.980 3.414 . 0 0 "[ . 1]" 1 601 1 115 ILE H 1 116 LEU H . . 2.800 2.632 2.394 2.821 0.021 5 0 "[ . 1]" 1 602 1 115 ILE H 1 117 LYS H . . 4.200 4.390 4.031 4.616 0.416 5 0 "[ . 1]" 1 603 1 115 ILE HA 1 116 LEU H . . 3.500 3.373 3.239 3.470 . 0 0 "[ . 1]" 1 604 1 115 ILE HA 1 117 LYS H . . 4.400 4.180 3.758 4.448 0.048 5 0 "[ . 1]" 1 605 1 115 ILE HA 1 118 GLU H . . 3.400 3.356 2.960 3.727 0.327 7 0 "[ . 1]" 1 606 1 115 ILE HA 1 119 HIS H . . 4.200 3.980 3.371 4.268 0.068 9 0 "[ . 1]" 1 607 1 116 LEU H 1 117 LYS H . . 4.200 2.423 2.072 2.707 . 0 0 "[ . 1]" 1 608 1 116 LEU H 1 118 GLU H . . 4.200 3.758 3.525 4.042 . 0 0 "[ . 1]" 1 609 1 116 LEU HA 1 117 LYS H . . 3.500 3.485 3.271 3.552 0.052 5 0 "[ . 1]" 1 610 1 116 LEU HA 1 118 GLU H . . 4.400 4.325 4.146 4.505 0.105 5 0 "[ . 1]" 1 611 1 116 LEU HA 1 119 HIS H . . 3.400 3.652 3.486 3.943 0.543 2 1 "[ + . 1]" 1 612 1 116 LEU HA 1 120 ASP H . . 4.200 4.205 3.628 4.456 0.256 1 0 "[ . 1]" 1 613 1 116 LEU QB 1 117 LYS H . . 4.700 3.103 2.536 3.655 . 0 0 "[ . 1]" 1 614 1 117 LYS H 1 118 GLU H . . 2.800 2.332 1.915 2.614 . 0 0 "[ . 1]" 1 615 1 117 LYS H 1 119 HIS H . . 4.200 3.783 3.226 4.170 . 0 0 "[ . 1]" 1 616 1 117 LYS HA 1 118 GLU H . . 3.500 3.477 3.401 3.532 0.032 5 0 "[ . 1]" 1 617 1 117 LYS HA 1 119 HIS H . . 4.400 4.134 3.804 4.476 0.076 10 0 "[ . 1]" 1 618 1 117 LYS HA 1 120 ASP H . . 3.400 3.563 3.346 3.751 0.351 7 0 "[ . 1]" 1 619 1 117 LYS HA 1 121 VAL H . . 4.200 4.489 4.292 4.729 0.529 5 1 "[ + 1]" 1 620 1 117 LYS QB 1 118 GLU H . . 4.700 3.391 2.580 3.703 . 0 0 "[ . 1]" 1 621 1 118 GLU H 1 119 HIS H . . 2.800 2.371 2.166 2.558 . 0 0 "[ . 1]" 1 622 1 118 GLU H 1 120 ASP H . . 4.200 3.953 3.646 4.406 0.206 5 0 "[ . 1]" 1 623 1 118 GLU HA 1 119 HIS H . . 3.500 3.442 3.338 3.539 0.039 10 0 "[ . 1]" 1 624 1 118 GLU HA 1 120 ASP H . . 4.400 4.346 4.099 4.508 0.108 5 0 "[ . 1]" 1 625 1 118 GLU HA 1 121 VAL H . . 3.600 3.816 3.677 4.029 0.429 7 0 "[ . 1]" 1 626 1 118 GLU HA 1 122 ASP H . . 4.200 4.402 4.099 4.556 0.356 4 0 "[ . 1]" 1 627 1 118 GLU QB 1 119 HIS H . . 4.520 3.143 2.661 3.756 . 0 0 "[ . 1]" 1 628 1 118 GLU QB 1 122 ASP H . . 5.500 5.168 4.924 5.340 . 0 0 "[ . 1]" 1 629 1 119 HIS H 1 120 ASP H . . 2.800 2.349 2.101 2.630 . 0 0 "[ . 1]" 1 630 1 119 HIS H 1 121 VAL H . . 4.200 4.073 3.521 4.387 0.187 10 0 "[ . 1]" 1 631 1 119 HIS HA 1 120 ASP H . . 3.500 3.493 3.406 3.542 0.042 5 0 "[ . 1]" 1 632 1 119 HIS HA 1 121 VAL H . . 4.400 4.324 3.687 4.611 0.211 6 0 "[ . 1]" 1 633 1 119 HIS HA 1 122 ASP H . . 3.400 3.260 3.110 3.369 . 0 0 "[ . 1]" 1 634 1 119 HIS HA 1 123 TYR H . . 4.200 3.707 3.342 4.452 0.252 2 0 "[ . 1]" 1 635 1 119 HIS QB 1 120 ASP H . . 4.870 3.194 2.661 3.654 . 0 0 "[ . 1]" 1 636 1 120 ASP H 1 121 VAL H . . 2.800 2.663 2.489 2.812 0.012 6 0 "[ . 1]" 1 637 1 120 ASP H 1 122 ASP H . . 4.200 3.790 3.676 3.960 . 0 0 "[ . 1]" 1 638 1 120 ASP HA 1 121 VAL H . . 3.500 3.511 3.253 3.559 0.059 6 0 "[ . 1]" 1 639 1 120 ASP HA 1 122 ASP H . . 4.400 4.176 3.963 4.430 0.030 8 0 "[ . 1]" 1 640 1 120 ASP HA 1 123 TYR H . . 3.500 3.758 3.586 3.915 0.415 4 0 "[ . 1]" 1 641 1 120 ASP HA 1 124 VAL H . . 4.200 4.447 3.969 4.767 0.567 6 2 "[ -+ 1]" 1 642 1 120 ASP QB 1 121 VAL H . . 4.200 2.688 2.466 3.410 . 0 0 "[ . 1]" 1 643 1 120 ASP QB 1 122 ASP H . . 5.500 4.462 4.256 4.923 . 0 0 "[ . 1]" 1 644 1 121 VAL H 1 122 ASP H . . 2.800 2.337 1.858 2.488 . 0 0 "[ . 1]" 1 645 1 121 VAL H 1 123 TYR H . . 4.200 3.978 3.183 4.327 0.127 5 0 "[ . 1]" 1 646 1 121 VAL HA 1 122 ASP H . . 3.500 3.420 3.314 3.502 0.002 8 0 "[ . 1]" 1 647 1 121 VAL HA 1 123 TYR H . . 4.400 4.315 3.710 4.483 0.083 5 0 "[ . 1]" 1 648 1 121 VAL HA 1 124 VAL H . . 3.400 3.660 3.565 3.931 0.531 9 1 "[ . +1]" 1 649 1 121 VAL HA 1 125 LEU H . . 4.200 4.331 4.047 4.466 0.266 6 0 "[ . 1]" 1 650 1 121 VAL HB 1 122 ASP H . . 5.500 3.135 2.808 3.519 . 0 0 "[ . 1]" 1 651 1 122 ASP H 1 123 TYR H . . 2.800 2.325 1.945 2.507 . 0 0 "[ . 1]" 1 652 1 122 ASP H 1 124 VAL H . . 4.200 3.854 3.311 4.223 0.023 7 0 "[ . 1]" 1 653 1 122 ASP HA 1 123 TYR H . . 3.500 3.482 3.256 3.543 0.043 5 0 "[ . 1]" 1 654 1 122 ASP HA 1 124 VAL H . . 4.400 4.263 3.931 4.523 0.123 7 0 "[ . 1]" 1 655 1 122 ASP HA 1 125 LEU H . . 3.900 3.516 3.254 4.050 0.150 9 0 "[ . 1]" 1 656 1 122 ASP HA 1 126 VAL H . . 4.200 4.123 3.557 4.649 0.449 9 0 "[ . 1]" 1 657 1 122 ASP QB 1 123 TYR H . . 4.700 2.866 2.657 3.739 . 0 0 "[ . 1]" 1 658 1 123 TYR H 1 124 VAL H . . 2.800 2.471 2.053 2.767 . 0 0 "[ . 1]" 1 659 1 123 TYR H 1 125 LEU H . . 4.200 3.903 3.371 4.271 0.071 1 0 "[ . 1]" 1 660 1 123 TYR H 1 224 VAL HA . . 5.500 5.864 5.587 6.174 0.674 4 3 "[- +* 1]" 1 661 1 123 TYR HA 1 124 VAL H . . 3.600 3.477 3.241 3.553 . 0 0 "[ . 1]" 1 662 1 123 TYR HA 1 125 LEU H . . 4.400 4.228 3.955 4.563 0.163 1 0 "[ . 1]" 1 663 1 123 TYR HA 1 126 VAL H . . 3.400 3.555 3.387 3.788 0.388 2 0 "[ . 1]" 1 664 1 123 TYR HA 1 127 ILE H . . 4.200 4.102 3.768 4.326 0.126 9 0 "[ . 1]" 1 665 1 123 TYR HA 1 226 THR H . . 6.000 6.562 5.194 8.401 2.401 4 3 "[ *+. -1]" 1 666 1 123 TYR QB 1 124 VAL H . . 4.790 2.987 2.479 3.515 . 0 0 "[ . 1]" 1 667 1 124 VAL H 1 125 LEU H . . 2.800 2.409 2.078 2.615 . 0 0 "[ . 1]" 1 668 1 124 VAL H 1 126 VAL H . . 4.200 3.877 3.526 4.164 . 0 0 "[ . 1]" 1 669 1 124 VAL HA 1 125 LEU H . . 3.500 3.463 3.366 3.548 0.048 1 0 "[ . 1]" 1 670 1 124 VAL HA 1 126 VAL H . . 4.400 4.259 3.917 4.492 0.092 10 0 "[ . 1]" 1 671 1 124 VAL HA 1 127 ILE H . . 3.400 3.589 3.412 3.838 0.438 9 0 "[ . 1]" 1 672 1 124 VAL HA 1 128 PHE H . . 4.600 4.419 3.840 4.976 0.376 3 0 "[ . 1]" 1 673 1 124 VAL HB 1 125 LEU H . . 4.500 3.828 2.859 4.307 . 0 0 "[ . 1]" 1 674 1 125 LEU H 1 126 VAL H . . 2.800 2.346 2.011 2.678 . 0 0 "[ . 1]" 1 675 1 125 LEU H 1 127 ILE H . . 4.200 3.834 3.408 4.215 0.015 9 0 "[ . 1]" 1 676 1 125 LEU HA 1 126 VAL H . . 3.500 3.469 3.380 3.542 0.042 4 0 "[ . 1]" 1 677 1 125 LEU HA 1 127 ILE H . . 4.400 4.283 3.912 4.440 0.040 7 0 "[ . 1]" 1 678 1 125 LEU HA 1 128 PHE H . . 3.900 3.762 3.449 4.078 0.178 3 0 "[ . 1]" 1 679 1 125 LEU HA 1 129 GLY H . . 4.200 4.257 3.320 4.686 0.486 3 0 "[ . 1]" 1 680 1 125 LEU QB 1 126 VAL H . . 5.190 3.173 2.515 3.695 . 0 0 "[ . 1]" 1 681 1 125 LEU HG 1 127 ILE H . . 5.500 5.262 4.655 5.895 0.395 10 0 "[ . 1]" 1 682 1 126 VAL H 1 127 ILE H . . 2.800 2.363 2.108 2.682 . 0 0 "[ . 1]" 1 683 1 126 VAL H 1 128 PHE H . . 4.200 4.024 3.620 4.337 0.137 10 0 "[ . 1]" 1 684 1 126 VAL HA 1 127 ILE H . . 3.500 3.477 3.371 3.547 0.047 9 0 "[ . 1]" 1 685 1 126 VAL HA 1 128 PHE H . . 4.400 4.244 3.997 4.422 0.022 7 0 "[ . 1]" 1 686 1 126 VAL HA 1 129 GLY H . . 3.400 3.296 2.959 3.574 0.174 1 0 "[ . 1]" 1 687 1 126 VAL HA 1 130 GLY H . . 4.200 4.134 3.150 4.461 0.261 9 0 "[ . 1]" 1 688 1 126 VAL HB 1 127 ILE H . . 4.490 3.315 2.543 4.192 . 0 0 "[ . 1]" 1 689 1 126 VAL QG 1 128 PHE H . . 6.000 4.405 4.018 4.755 . 0 0 "[ . 1]" 1 690 1 126 VAL MG1 1 129 GLY H . . 5.500 4.705 4.405 5.095 . 0 0 "[ . 1]" 1 691 1 127 ILE H 1 128 PHE H . . 2.800 2.554 2.276 2.836 0.036 3 0 "[ . 1]" 1 692 1 127 ILE H 1 129 GLY H . . 4.200 3.806 3.586 4.158 . 0 0 "[ . 1]" 1 693 1 127 ILE HA 1 128 PHE H . . 3.500 3.511 3.436 3.546 0.046 3 0 "[ . 1]" 1 694 1 127 ILE HA 1 129 GLY H . . 4.400 4.342 4.140 4.465 0.065 8 0 "[ . 1]" 1 695 1 127 ILE HA 1 130 GLY H . . 3.600 3.850 3.635 4.142 0.542 3 1 "[ + . 1]" 1 696 1 127 ILE HB 1 128 PHE H . . 4.850 3.416 2.764 3.919 . 0 0 "[ . 1]" 1 697 1 127 ILE HB 1 129 GLY H . . 5.500 5.310 4.909 5.669 0.169 2 0 "[ . 1]" 1 698 1 128 PHE H 1 129 GLY H . . 2.800 2.300 2.050 2.528 . 0 0 "[ . 1]" 1 699 1 128 PHE H 1 130 GLY H . . 4.200 3.885 3.624 4.260 0.060 9 0 "[ . 1]" 1 700 1 128 PHE HA 1 129 GLY H . . 3.500 3.463 3.386 3.522 0.022 9 0 "[ . 1]" 1 701 1 128 PHE HA 1 130 GLY H . . 4.400 3.948 3.657 4.379 . 0 0 "[ . 1]" 1 702 1 128 PHE HA 1 131 LEU H . . 3.400 3.641 3.342 4.042 0.642 3 1 "[ + . 1]" 1 703 1 128 PHE QB 1 129 GLY H . . 5.120 3.061 2.666 3.598 . 0 0 "[ . 1]" 1 704 1 128 PHE QB 1 130 GLY H . . 6.000 4.787 4.527 4.988 . 0 0 "[ . 1]" 1 705 1 128 PHE QB 1 131 LEU H . . 5.500 5.187 4.918 5.533 0.033 3 0 "[ . 1]" 1 706 1 129 GLY H 1 130 GLY H . . 3.760 2.471 2.264 2.773 . 0 0 "[ . 1]" 1 707 1 129 GLY H 1 130 GLY QA . . 5.470 4.394 4.265 4.668 . 0 0 "[ . 1]" 1 708 1 129 GLY H 1 131 LEU H . . 4.200 4.061 3.311 4.560 0.360 3 0 "[ . 1]" 1 709 1 129 GLY QA 1 130 GLY H . . 4.440 2.865 2.699 2.921 . 0 0 "[ . 1]" 1 710 1 129 GLY QA 1 131 LEU H . . 4.400 4.101 3.893 4.384 . 0 0 "[ . 1]" 1 711 1 130 GLY H 1 131 LEU H . . 2.820 2.219 1.709 2.651 . 0 0 "[ . 1]" 1 712 1 130 GLY H 1 132 ILE H . . 4.200 4.356 3.920 4.573 0.373 5 0 "[ . 1]" 1 713 1 130 GLY H 1 135 GLY H . . 5.880 5.537 4.467 6.344 0.464 3 0 "[ . 1]" 1 714 1 130 GLY QA 1 131 LEU H . . 5.020 2.801 2.706 2.919 . 0 0 "[ . 1]" 1 715 1 130 GLY QA 1 234 ILE HA . . 5.500 5.778 5.544 6.043 0.543 7 1 "[ . + 1]" 1 716 1 131 LEU H 1 132 ILE H . . 2.980 2.816 2.677 3.169 0.189 6 0 "[ . 1]" 1 717 1 131 LEU HA 1 132 ILE H . . 4.790 3.244 2.639 3.510 . 0 0 "[ . 1]" 1 718 1 131 LEU QB 1 132 ILE H . . 5.590 3.463 2.694 3.974 . 0 0 "[ . 1]" 1 719 1 132 ILE H 1 133 GLY H . . 3.680 2.396 1.787 3.387 . 0 0 "[ . 1]" 1 720 1 132 ILE H 1 133 GLY QA . . 6.000 4.052 3.709 4.710 . 0 0 "[ . 1]" 1 721 1 132 ILE H 1 134 PHE H . . 5.000 3.541 2.410 4.992 . 0 0 "[ . 1]" 1 722 1 132 ILE H 1 233 ARG QB . . 5.500 5.243 4.548 5.649 0.149 5 0 "[ . 1]" 1 723 1 132 ILE H 1 237 LEU QB . . 5.500 5.580 5.319 5.789 0.289 5 0 "[ . 1]" 1 724 1 132 ILE H 1 237 LEU HG . . 5.500 5.461 4.957 6.033 0.533 5 1 "[ + 1]" 1 725 1 132 ILE HA 1 133 GLY H . . 3.800 3.012 2.314 3.559 . 0 0 "[ . 1]" 1 726 1 132 ILE HB 1 133 GLY H . . 4.990 3.840 1.937 4.602 . 0 0 "[ . 1]" 1 727 1 133 GLY H 1 237 LEU HG . . 5.500 3.918 3.077 4.884 . 0 0 "[ . 1]" 1 728 1 133 GLY QA 1 134 PHE H . . 3.630 2.560 2.230 2.918 . 0 0 "[ . 1]" 1 729 1 133 GLY QA 1 234 ILE H . . 5.500 4.533 3.800 5.079 . 0 0 "[ . 1]" 1 730 1 133 GLY QA 1 235 TYR H . . 5.500 5.458 5.036 5.748 0.248 6 0 "[ . 1]" 1 731 1 134 PHE H 1 135 GLY H . . 3.970 3.158 2.164 4.416 0.446 3 0 "[ . 1]" 1 732 1 134 PHE H 1 233 ARG QB . . 5.500 4.769 2.727 5.819 0.319 7 0 "[ . 1]" 1 733 1 134 PHE H 1 234 ILE HA . . 5.400 5.184 4.423 6.269 0.869 3 1 "[ + . 1]" 1 734 1 134 PHE H 1 234 ILE MD . . 5.500 4.202 3.516 4.971 . 0 0 "[ . 1]" 1 735 1 134 PHE H 1 237 LEU QB . . 5.500 4.703 2.081 5.483 . 0 0 "[ . 1]" 1 736 1 134 PHE H 1 237 LEU QD . . 5.500 4.667 1.934 5.470 . 0 0 "[ . 1]" 1 737 1 134 PHE HA 1 135 GLY H . . 3.850 2.800 2.162 3.568 . 0 0 "[ . 1]" 1 738 1 134 PHE QB 1 135 GLY H . . 6.000 3.151 1.975 4.036 . 0 0 "[ . 1]" 1 739 1 135 GLY H 1 136 GLY H . . 4.330 3.868 1.899 4.477 0.147 6 0 "[ . 1]" 1 740 1 135 GLY H 1 136 GLY QA . . 4.730 4.438 3.760 4.796 0.066 8 0 "[ . 1]" 1 741 1 135 GLY H 1 137 ASP HB2 . . 5.500 5.470 4.843 5.638 0.138 3 0 "[ . 1]" 1 742 1 135 GLY QA 1 136 GLY H . . 3.540 2.302 2.119 2.859 . 0 0 "[ . 1]" 1 743 1 135 GLY QA 1 138 ASP H . . 5.330 5.364 4.869 5.674 0.344 2 0 "[ . 1]" 1 744 1 136 GLY H 1 137 ASP H . . 3.200 2.695 1.875 3.280 0.080 2 0 "[ . 1]" 1 745 1 136 GLY QA 1 137 ASP H . . 4.380 2.770 2.599 2.912 . 0 0 "[ . 1]" 1 746 1 136 GLY QA 1 138 ASP H . . 5.370 3.332 2.824 3.876 . 0 0 "[ . 1]" 1 747 1 137 ASP H 1 138 ASP H . . 5.440 3.052 2.535 3.564 . 0 0 "[ . 1]" 1 748 1 137 ASP HA 1 138 ASP H . . 4.090 2.920 2.531 3.459 . 0 0 "[ . 1]" 1 749 1 137 ASP QB 1 138 ASP H . . 4.230 3.650 2.999 3.939 . 0 0 "[ . 1]" 1 750 1 141 LYS H 1 142 PHE H . . 3.250 3.024 2.465 3.840 0.590 9 1 "[ . +1]" 1 751 1 142 PHE H 1 143 LEU H . . 4.540 3.453 2.305 4.545 0.005 3 0 "[ . 1]" 1 752 1 143 LEU H 1 144 TRP H . . 5.500 3.400 2.742 4.365 . 0 0 "[ . 1]" 1 753 1 144 TRP H 1 145 ASN H . . 4.280 3.920 3.372 4.645 0.365 1 0 "[ . 1]" 1 754 1 144 TRP HA 1 145 ASN H . . 2.230 2.278 2.141 2.748 0.518 4 1 "[ +. 1]" 1 755 1 144 TRP QB 1 145 ASN H . . 4.630 3.545 2.081 4.048 . 0 0 "[ . 1]" 1 756 1 145 ASN H 1 146 ILE H . . 5.500 3.500 1.884 4.630 . 0 0 "[ . 1]" 1 757 1 147 ARG HA 1 148 ILE H . . 2.860 2.211 2.142 2.297 . 0 0 "[ . 1]" 1 758 1 147 ARG QB 1 148 ILE H . . 4.150 3.573 2.846 4.023 . 0 0 "[ . 1]" 1 759 1 148 ILE H 1 149 SER H . . 3.950 3.851 3.247 4.231 0.281 1 0 "[ . 1]" 1 760 1 148 ILE HA 1 149 SER H . . 2.380 2.232 2.148 2.530 0.150 7 0 "[ . 1]" 1 761 1 148 ILE HB 1 149 SER H . . 5.500 4.215 3.135 4.513 . 0 0 "[ . 1]" 1 762 1 148 ILE MD 1 150 GLU H . . 4.480 4.320 3.777 4.704 0.224 2 0 "[ . 1]" 1 763 1 149 SER H 1 150 GLU H . . 4.000 3.465 2.222 4.126 0.126 2 0 "[ . 1]" 1 764 1 149 SER HA 1 150 GLU H . . 2.620 2.377 2.188 2.782 0.162 5 0 "[ . 1]" 1 765 1 149 SER QB 1 150 GLU H . . 5.220 3.911 3.444 4.048 . 0 0 "[ . 1]" 1 766 1 149 SER HB2 1 150 GLU H . . 5.220 4.585 4.284 4.667 . 0 0 "[ . 1]" 1 767 1 150 GLU H 1 151 GLY H . . 5.500 3.867 2.341 4.632 . 0 0 "[ . 1]" 1 768 1 150 GLU HA 1 151 GLY H . . 2.440 2.320 2.145 2.670 0.230 6 0 "[ . 1]" 1 769 1 150 GLU QB 1 151 GLY H . . 5.420 3.527 2.275 3.939 . 0 0 "[ . 1]" 1 770 1 151 GLY H 1 152 ILE H . . 4.190 3.373 1.889 4.378 0.188 7 0 "[ . 1]" 1 771 1 151 GLY QA 1 152 ILE H . . 3.020 2.311 2.110 2.780 . 0 0 "[ . 1]" 1 772 1 151 GLY HA2 1 153 TRP H . . 5.500 5.599 5.081 5.977 0.477 9 0 "[ . 1]" 1 773 1 152 ILE H 1 153 TRP H . . 4.980 4.226 3.253 4.574 . 0 0 "[ . 1]" 1 774 1 152 ILE HA 1 153 TRP H . . 2.270 2.183 2.139 2.387 0.117 8 0 "[ . 1]" 1 775 1 152 ILE HB 1 153 TRP H . . 4.400 4.163 3.169 4.600 0.200 8 0 "[ . 1]" 1 776 1 152 ILE HG12 1 156 GLU H . . 6.000 5.728 4.933 6.078 0.078 2 0 "[ . 1]" 1 777 1 153 TRP H 1 154 PRO HA . . 5.500 5.532 5.128 5.919 0.419 1 0 "[ . 1]" 1 778 1 154 PRO HA 1 158 LYS H . . 4.200 4.303 4.123 4.526 0.326 8 0 "[ . 1]" 1 779 1 154 PRO QD 1 156 GLU H . . 5.500 5.355 4.677 5.781 0.281 5 0 "[ . 1]" 1 780 1 155 GLU H 1 156 GLU H . . 2.800 2.474 1.939 2.973 0.173 3 0 "[ . 1]" 1 781 1 155 GLU H 1 157 ILE H . . 4.200 3.882 2.876 4.284 0.084 7 0 "[ . 1]" 1 782 1 155 GLU HA 1 156 GLU H . . 3.790 3.514 3.414 3.568 . 0 0 "[ . 1]" 1 783 1 155 GLU HA 1 157 ILE H . . 4.400 4.377 4.188 4.505 0.105 7 0 "[ . 1]" 1 784 1 155 GLU HA 1 158 LYS H . . 3.400 3.476 3.329 3.570 0.170 8 0 "[ . 1]" 1 785 1 155 GLU HA 1 159 GLU H . . 4.200 4.140 3.905 4.281 0.081 2 0 "[ . 1]" 1 786 1 155 GLU QB 1 156 GLU H . . 4.700 2.733 2.247 3.445 . 0 0 "[ . 1]" 1 787 1 156 GLU H 1 157 ILE H . . 2.800 2.552 2.393 2.752 . 0 0 "[ . 1]" 1 788 1 156 GLU H 1 157 ILE HA . . 5.500 5.189 5.066 5.349 . 0 0 "[ . 1]" 1 789 1 156 GLU H 1 158 LYS H . . 4.200 3.935 3.779 4.136 . 0 0 "[ . 1]" 1 790 1 156 GLU HA 1 157 ILE H . . 3.500 3.515 3.446 3.545 0.045 7 0 "[ . 1]" 1 791 1 156 GLU HA 1 158 LYS H . . 4.400 4.286 4.139 4.426 0.026 1 0 "[ . 1]" 1 792 1 156 GLU HA 1 159 GLU H . . 3.400 3.516 3.482 3.576 0.176 1 0 "[ . 1]" 1 793 1 156 GLU HA 1 160 ARG H . . 4.200 4.236 4.176 4.308 0.108 7 0 "[ . 1]" 1 794 1 156 GLU QB 1 157 ILE H . . 4.200 3.074 2.616 3.491 . 0 0 "[ . 1]" 1 795 1 157 ILE H 1 158 LYS H . . 2.800 2.470 2.317 2.586 . 0 0 "[ . 1]" 1 796 1 157 ILE H 1 158 LYS HA . . 5.330 5.118 4.984 5.214 . 0 0 "[ . 1]" 1 797 1 157 ILE H 1 159 GLU H . . 4.200 3.939 3.795 4.091 . 0 0 "[ . 1]" 1 798 1 157 ILE HA 1 158 LYS H . . 3.500 3.492 3.443 3.520 0.020 4 0 "[ . 1]" 1 799 1 157 ILE HA 1 159 GLU H . . 4.400 4.216 4.081 4.325 . 0 0 "[ . 1]" 1 800 1 157 ILE HA 1 160 ARG H . . 3.400 3.440 3.381 3.494 0.094 7 0 "[ . 1]" 1 801 1 157 ILE HA 1 161 ASP H . . 4.200 4.210 4.084 4.257 0.057 10 0 "[ . 1]" 1 802 1 157 ILE HB 1 158 LYS H . . 4.440 3.478 2.699 4.101 . 0 0 "[ . 1]" 1 803 1 158 LYS H 1 159 GLU H . . 2.800 2.433 2.327 2.546 . 0 0 "[ . 1]" 1 804 1 158 LYS H 1 159 GLU HA . . 5.500 5.090 4.994 5.185 . 0 0 "[ . 1]" 1 805 1 158 LYS H 1 160 ARG H . . 4.200 3.867 3.735 3.934 . 0 0 "[ . 1]" 1 806 1 158 LYS HA 1 159 GLU H . . 3.500 3.485 3.444 3.518 0.018 8 0 "[ . 1]" 1 807 1 158 LYS HA 1 160 ARG H . . 4.400 4.200 4.111 4.325 . 0 0 "[ . 1]" 1 808 1 158 LYS HA 1 161 ASP H . . 3.400 3.465 3.405 3.499 0.099 1 0 "[ . 1]" 1 809 1 158 LYS HA 1 162 PHE H . . 4.200 4.169 4.049 4.280 0.080 8 0 "[ . 1]" 1 810 1 158 LYS QB 1 159 GLU H . . 4.200 2.828 2.667 2.981 . 0 0 "[ . 1]" 1 811 1 159 GLU H 1 160 ARG H . . 2.800 2.365 2.289 2.456 . 0 0 "[ . 1]" 1 812 1 159 GLU H 1 161 ASP H . . 4.300 3.764 3.685 3.834 . 0 0 "[ . 1]" 1 813 1 159 GLU HA 1 160 ARG H . . 3.500 3.469 3.441 3.498 . 0 0 "[ . 1]" 1 814 1 159 GLU HA 1 161 ASP H . . 4.400 4.058 3.978 4.149 . 0 0 "[ . 1]" 1 815 1 159 GLU HA 1 162 PHE H . . 3.400 3.445 3.378 3.505 0.105 8 0 "[ . 1]" 1 816 1 159 GLU QB 1 160 ARG H . . 4.700 2.886 2.747 2.990 . 0 0 "[ . 1]" 1 817 1 159 GLU QB 1 161 ASP H . . 5.500 4.622 4.539 4.741 . 0 0 "[ . 1]" 1 818 1 160 ARG H 1 161 ASP H . . 2.800 2.295 2.256 2.356 . 0 0 "[ . 1]" 1 819 1 160 ARG H 1 162 PHE H . . 4.200 3.696 3.616 3.805 . 0 0 "[ . 1]" 1 820 1 160 ARG HA 1 161 ASP H . . 3.500 3.420 3.377 3.451 . 0 0 "[ . 1]" 1 821 1 160 ARG HA 1 162 PHE H . . 4.400 4.022 3.962 4.116 . 0 0 "[ . 1]" 1 822 1 160 ARG QB 1 162 PHE H . . 5.500 4.673 4.628 4.712 . 0 0 "[ . 1]" 1 823 1 161 ASP H 1 162 PHE H . . 2.800 2.132 2.024 2.194 . 0 0 "[ . 1]" 1 824 1 161 ASP H 1 163 TYR H . . 4.200 4.229 4.109 4.315 0.115 2 0 "[ . 1]" 1 825 1 161 ASP HA 1 162 PHE H . . 3.690 3.345 3.250 3.423 . 0 0 "[ . 1]" 1 826 1 161 ASP HA 1 163 TYR H . . 4.400 3.450 3.268 3.638 . 0 0 "[ . 1]" 1 827 1 161 ASP QB 1 162 PHE H . . 4.890 3.219 3.035 3.410 . 0 0 "[ . 1]" 1 828 1 161 ASP QB 1 163 TYR H . . 5.500 4.660 4.530 4.807 . 0 0 "[ . 1]" 1 829 1 162 PHE H 1 163 TYR H . . 2.850 2.715 2.638 2.784 . 0 0 "[ . 1]" 1 830 1 162 PHE HA 1 163 TYR H . . 3.410 3.456 3.433 3.505 0.095 4 0 "[ . 1]" 1 831 1 162 PHE QB 1 163 TYR H . . 4.480 2.967 2.826 3.033 . 0 0 "[ . 1]" 1 832 1 163 TYR H 1 164 THR H . . 5.500 4.167 3.428 4.622 . 0 0 "[ . 1]" 1 833 1 163 TYR H 1 165 ALA H . . 5.500 5.570 5.494 5.723 0.223 10 0 "[ . 1]" 1 834 1 163 TYR HA 1 164 THR H . . 5.330 2.271 2.156 2.496 . 0 0 "[ . 1]" 1 835 1 163 TYR QB 1 164 THR H . . 6.000 3.129 2.310 3.986 . 0 0 "[ . 1]" 1 836 1 164 THR HA 1 165 ALA H . . 5.230 3.154 2.825 3.571 . 0 0 "[ . 1]" 1 837 1 164 THR HB 1 165 ALA H . . 5.500 3.795 2.062 4.630 . 0 0 "[ . 1]" 1 838 1 165 ALA H 1 166 GLU H . . 5.500 4.544 4.334 4.636 . 0 0 "[ . 1]" 1 839 1 165 ALA HA 1 166 GLU H . . 3.710 2.611 2.162 2.745 . 0 0 "[ . 1]" 1 840 1 165 ALA MB 1 166 GLU H . . 5.500 2.220 1.979 3.071 . 0 0 "[ . 1]" 1 841 1 166 GLU H 1 167 GLY H . . 4.180 2.972 1.874 3.994 . 0 0 "[ . 1]" 1 842 1 166 GLU H 1 167 GLY QA . . 5.320 4.383 3.581 5.009 . 0 0 "[ . 1]" 1 843 1 166 GLU H 1 171 VAL QG . . 6.000 5.800 4.669 6.070 0.070 10 0 "[ . 1]" 1 844 1 166 GLU H 1 172 ASP HA . . 5.500 5.425 4.843 5.631 0.131 3 0 "[ . 1]" 1 845 1 166 GLU H 1 172 ASP QB . . 6.000 5.459 4.228 6.102 0.102 7 0 "[ . 1]" 1 846 1 166 GLU HA 1 167 GLY H . . 5.300 2.870 2.146 3.560 . 0 0 "[ . 1]" 1 847 1 166 GLU QB 1 167 GLY H . . 6.000 3.281 2.088 3.994 . 0 0 "[ . 1]" 1 848 1 167 GLY H 1 172 ASP HA . . 5.500 4.981 3.255 5.519 0.019 4 0 "[ . 1]" 1 849 1 167 GLY QA 1 168 GLU H . . 3.880 2.341 2.113 2.892 . 0 0 "[ . 1]" 1 850 1 168 GLU HA 1 169 TYR H . . 3.540 2.994 2.149 3.563 0.023 3 0 "[ . 1]" 1 851 1 168 GLU QB 1 169 TYR H . . 6.000 2.720 1.952 3.915 . 0 0 "[ . 1]" 1 852 1 169 TYR HA 1 170 ARG H . . 4.690 2.821 2.143 3.568 . 0 0 "[ . 1]" 1 853 1 169 TYR QB 1 170 ARG H . . 6.000 3.114 1.987 4.014 . 0 0 "[ . 1]" 1 854 1 170 ARG QB 1 171 VAL H . . 4.560 2.065 1.938 2.657 . 0 0 "[ . 1]" 1 855 1 171 VAL H 1 172 ASP H . . 5.110 3.508 2.624 4.644 . 0 0 "[ . 1]" 1 856 1 171 VAL H 1 199 GLY QA . . 5.500 4.682 2.777 5.592 0.092 3 0 "[ . 1]" 1 857 1 171 VAL HA 1 172 ASP H . . 4.520 2.999 2.574 3.480 . 0 0 "[ . 1]" 1 858 1 171 VAL HA 1 174 ARG H . . 5.500 5.594 4.481 5.893 0.393 3 0 "[ . 1]" 1 859 1 171 VAL HA 1 199 GLY H . . 5.500 4.562 2.737 5.676 0.176 1 0 "[ . 1]" 1 860 1 171 VAL HB 1 172 ASP H . . 5.500 3.375 1.861 4.559 . 0 0 "[ . 1]" 1 861 1 171 VAL HB 1 173 ALA H . . 5.140 4.641 2.883 5.364 0.224 6 0 "[ . 1]" 1 862 1 171 VAL MG1 1 173 ALA H . . 5.500 4.137 3.321 5.027 . 0 0 "[ . 1]" 1 863 1 172 ASP H 1 173 ALA H . . 5.500 2.784 2.577 3.176 . 0 0 "[ . 1]" 1 864 1 172 ASP HA 1 173 ALA H . . 3.570 2.974 2.381 3.379 . 0 0 "[ . 1]" 1 865 1 172 ASP QB 1 173 ALA H . . 5.500 3.831 3.185 4.058 . 0 0 "[ . 1]" 1 866 1 173 ALA HA 1 174 ARG H . . 3.780 2.491 2.141 3.381 . 0 0 "[ . 1]" 1 867 1 173 ALA HA 1 176 SER H . . 5.750 5.477 4.841 6.729 0.979 8 1 "[ . + 1]" 1 868 1 173 ALA HA 1 178 THR H . . 5.500 5.217 4.043 6.009 0.509 1 1 "[+ . 1]" 1 869 1 173 ALA HA 1 202 THR H . . 5.500 4.987 3.168 5.979 0.479 9 0 "[ . 1]" 1 870 1 173 ALA MB 1 174 ARG H . . 5.500 2.881 1.761 3.686 . 0 0 "[ . 1]" 1 871 1 174 ARG H 1 177 GLU HB2 . . 5.370 5.431 4.711 5.920 0.550 8 1 "[ . + 1]" 1 872 1 174 ARG H 1 198 GLY QA . . 5.500 4.727 1.898 5.815 0.315 6 0 "[ . 1]" 1 873 1 174 ARG QB 1 175 ALA H . . 6.000 2.883 1.864 3.916 . 0 0 "[ . 1]" 1 874 1 175 ALA H 1 176 SER H . . 2.800 2.729 1.818 4.222 1.422 8 1 "[ . + 1]" 1 875 1 175 ALA HA 1 176 SER H . . 4.200 3.203 2.273 3.559 . 0 0 "[ . 1]" 1 876 1 175 ALA HA 1 179 MET H . . 4.200 4.473 3.656 4.979 0.779 8 3 "[- . + *]" 1 877 1 175 ALA MB 1 176 SER H . . 5.500 3.017 2.087 3.632 . 0 0 "[ . 1]" 1 878 1 176 SER H 1 177 GLU H . . 2.800 2.703 2.454 2.924 0.124 4 0 "[ . 1]" 1 879 1 176 SER H 1 178 THR H . . 4.200 3.494 2.649 4.584 0.384 8 0 "[ . 1]" 1 880 1 176 SER HA 1 177 GLU H . . 3.500 3.503 3.364 3.557 0.057 10 0 "[ . 1]" 1 881 1 176 SER HA 1 178 THR H . . 4.200 4.221 3.584 4.431 0.231 6 0 "[ . 1]" 1 882 1 176 SER HA 1 179 MET H . . 3.400 3.437 2.908 3.860 0.460 9 0 "[ . 1]" 1 883 1 176 SER HA 1 180 ARG H . . 4.200 3.886 2.270 4.444 0.244 4 0 "[ . 1]" 1 884 1 176 SER QB 1 177 GLU H . . 4.200 2.466 1.889 3.510 . 0 0 "[ . 1]" 1 885 1 177 GLU H 1 178 THR H . . 2.800 2.696 2.451 2.927 0.127 10 0 "[ . 1]" 1 886 1 177 GLU H 1 179 MET H . . 4.200 4.017 3.711 4.197 . 0 0 "[ . 1]" 1 887 1 177 GLU H 1 202 THR HA . . 5.500 5.604 4.597 5.897 0.397 10 0 "[ . 1]" 1 888 1 177 GLU HA 1 178 THR H . . 3.500 3.487 3.392 3.543 0.043 3 0 "[ . 1]" 1 889 1 177 GLU HA 1 179 MET H . . 4.400 4.315 3.568 4.665 0.265 10 0 "[ . 1]" 1 890 1 177 GLU HA 1 180 ARG H . . 3.600 3.873 3.066 4.310 0.710 8 2 "[ - . + 1]" 1 891 1 177 GLU HA 1 181 ASN H . . 4.200 4.000 2.686 4.486 0.286 4 0 "[ . 1]" 1 892 1 177 GLU QB 1 178 THR H . . 4.200 2.906 2.501 3.702 . 0 0 "[ . 1]" 1 893 1 178 THR H 1 179 MET H . . 2.800 2.318 1.834 2.572 . 0 0 "[ . 1]" 1 894 1 178 THR H 1 180 ARG H . . 4.200 3.878 3.098 4.242 0.042 4 0 "[ . 1]" 1 895 1 178 THR H 1 202 THR H . . 6.090 6.370 5.959 6.953 0.863 9 1 "[ . +1]" 1 896 1 178 THR HA 1 179 MET H . . 3.500 3.429 3.208 3.534 0.034 3 0 "[ . 1]" 1 897 1 178 THR HA 1 180 ARG H . . 4.400 4.207 3.546 4.496 0.096 2 0 "[ . 1]" 1 898 1 178 THR HA 1 181 ASN H . . 3.400 3.475 3.073 4.016 0.616 9 2 "[ - . +1]" 1 899 1 178 THR HA 1 182 SER H . . 4.200 3.777 3.067 4.672 0.472 1 0 "[ . 1]" 1 900 1 178 THR HB 1 179 MET H . . 4.200 3.807 2.690 4.389 0.189 5 0 "[ . 1]" 1 901 1 179 MET H 1 180 ARG H . . 2.800 2.368 1.797 2.799 . 0 0 "[ . 1]" 1 902 1 179 MET H 1 181 ASN H . . 4.200 3.638 3.028 4.035 . 0 0 "[ . 1]" 1 903 1 179 MET HA 1 180 ARG H . . 3.500 3.453 3.269 3.557 0.057 4 0 "[ . 1]" 1 904 1 179 MET HA 1 181 ASN H . . 4.400 4.360 3.972 4.597 0.197 10 0 "[ . 1]" 1 905 1 179 MET HA 1 182 SER H . . 3.600 3.964 3.681 4.235 0.635 1 3 "[+* . -1]" 1 906 1 179 MET HA 1 183 LEU H . . 4.600 4.846 4.446 5.135 0.535 3 1 "[ + . 1]" 1 907 1 179 MET QB 1 180 ARG H . . 4.200 2.899 2.403 3.375 . 0 0 "[ . 1]" 1 908 1 180 ARG H 1 181 ASN H . . 2.800 2.156 1.815 2.420 . 0 0 "[ . 1]" 1 909 1 180 ARG H 1 181 ASN HA . . 5.500 4.830 4.576 5.082 . 0 0 "[ . 1]" 1 910 1 180 ARG H 1 182 SER H . . 4.200 3.728 2.920 4.347 0.147 3 0 "[ . 1]" 1 911 1 180 ARG HA 1 181 ASN H . . 3.500 3.439 3.247 3.506 0.006 8 0 "[ . 1]" 1 912 1 180 ARG HA 1 182 SER H . . 4.400 4.208 3.728 4.542 0.142 8 0 "[ . 1]" 1 913 1 180 ARG HA 1 183 LEU H . . 3.600 3.802 3.030 4.385 0.785 9 1 "[ . +1]" 1 914 1 180 ARG HA 1 184 LEU H . . 4.800 4.801 4.142 5.529 0.729 8 1 "[ . + 1]" 1 915 1 180 ARG QB 1 181 ASN H . . 4.940 2.975 2.774 3.412 . 0 0 "[ . 1]" 1 916 1 181 ASN H 1 182 SER H . . 2.800 2.346 1.920 2.830 0.030 1 0 "[ . 1]" 1 917 1 181 ASN H 1 183 LEU H . . 4.200 3.945 3.587 4.271 0.071 7 0 "[ . 1]" 1 918 1 181 ASN HA 1 182 SER H . . 3.500 3.423 3.227 3.554 0.054 3 0 "[ . 1]" 1 919 1 181 ASN HA 1 183 LEU H . . 4.400 4.032 3.484 4.480 0.080 2 0 "[ . 1]" 1 920 1 181 ASN HA 1 184 LEU H . . 3.400 3.547 3.219 3.905 0.505 6 1 "[ .+ 1]" 1 921 1 181 ASN HA 1 185 TYR H . . 4.200 3.800 2.688 4.301 0.101 1 0 "[ . 1]" 1 922 1 181 ASN QB 1 182 SER H . . 4.840 3.143 2.579 3.492 . 0 0 "[ . 1]" 1 923 1 182 SER H 1 183 LEU H . . 2.800 2.445 2.017 2.788 . 0 0 "[ . 1]" 1 924 1 182 SER H 1 205 VAL QG . . 5.500 5.283 4.016 6.365 0.865 9 1 "[ . +1]" 1 925 1 182 SER HA 1 183 LEU H . . 3.500 3.394 3.181 3.531 0.031 3 0 "[ . 1]" 1 926 1 182 SER HA 1 184 LEU H . . 4.200 4.095 3.727 4.354 0.154 9 0 "[ . 1]" 1 927 1 182 SER HA 1 185 TYR H . . 3.400 3.576 2.887 4.025 0.625 9 1 "[ . +1]" 1 928 1 182 SER HA 1 186 LYS H . . 4.200 3.539 2.244 4.572 0.372 3 0 "[ . 1]" 1 929 1 182 SER QB 1 183 LEU H . . 4.200 3.336 2.804 3.928 . 0 0 "[ . 1]" 1 930 1 183 LEU H 1 184 LEU H . . 2.800 2.301 1.882 2.760 . 0 0 "[ . 1]" 1 931 1 183 LEU H 1 185 TYR H . . 4.200 3.664 2.983 4.317 0.117 3 0 "[ . 1]" 1 932 1 183 LEU HA 1 184 LEU H . . 3.520 3.424 3.233 3.530 0.010 5 0 "[ . 1]" 1 933 1 183 LEU HA 1 185 TYR H . . 4.400 4.505 4.262 4.719 0.319 9 0 "[ . 1]" 1 934 1 183 LEU HA 1 186 LYS H . . 3.600 3.964 3.639 4.329 0.729 8 4 "[ -. +**]" 1 935 1 183 LEU HA 1 187 MET H . . 4.200 4.520 4.205 4.764 0.564 8 2 "[ - + 1]" 1 936 1 183 LEU QB 1 184 LEU H . . 4.790 2.984 2.632 3.413 . 0 0 "[ . 1]" 1 937 1 184 LEU H 1 185 TYR H . . 2.800 2.090 1.847 2.467 . 0 0 "[ . 1]" 1 938 1 184 LEU H 1 186 LYS H . . 4.200 3.473 3.083 3.782 . 0 0 "[ . 1]" 1 939 1 184 LEU HA 1 185 TYR H . . 3.500 3.455 3.246 3.544 0.044 7 0 "[ . 1]" 1 940 1 184 LEU HA 1 186 LYS H . . 4.400 4.209 3.846 4.436 0.036 8 0 "[ . 1]" 1 941 1 184 LEU HA 1 187 MET H . . 3.600 3.855 3.211 4.247 0.647 9 4 "[ *. -+*]" 1 942 1 184 LEU HA 1 188 SER H . . 4.600 4.680 3.552 5.259 0.659 4 3 "[ +. - *1]" 1 943 1 184 LEU QB 1 185 TYR H . . 4.600 2.912 2.589 3.396 . 0 0 "[ . 1]" 1 944 1 185 TYR H 1 186 LYS H . . 2.800 2.262 1.912 2.602 . 0 0 "[ . 1]" 1 945 1 185 TYR H 1 187 MET H . . 4.200 3.993 3.573 4.454 0.254 7 0 "[ . 1]" 1 946 1 185 TYR HA 1 186 LYS H . . 3.500 3.434 3.326 3.523 0.023 3 0 "[ . 1]" 1 947 1 185 TYR HA 1 187 MET H . . 4.400 4.267 4.001 4.456 0.056 4 0 "[ . 1]" 1 948 1 185 TYR HA 1 188 SER H . . 3.400 3.490 3.357 3.661 0.261 2 0 "[ . 1]" 1 949 1 185 TYR HA 1 189 TYR H . . 4.200 4.206 3.916 4.545 0.345 4 0 "[ . 1]" 1 950 1 185 TYR HA 1 230 TRP H . . 5.500 4.012 2.538 5.669 0.169 2 0 "[ . 1]" 1 951 1 185 TYR QB 1 186 LYS H . . 4.700 3.198 2.819 3.521 . 0 0 "[ . 1]" 1 952 1 185 TYR QB 1 233 ARG H . . 5.950 6.290 6.020 6.819 0.869 3 2 "[- + . 1]" 1 953 1 186 LYS H 1 187 MET H . . 2.800 2.479 2.295 2.799 . 0 0 "[ . 1]" 1 954 1 186 LYS H 1 188 SER H . . 4.200 3.955 3.706 4.304 0.104 7 0 "[ . 1]" 1 955 1 186 LYS HA 1 187 MET H . . 3.500 3.505 3.401 3.553 0.053 7 0 "[ . 1]" 1 956 1 186 LYS HA 1 188 SER H . . 4.400 4.298 3.825 4.610 0.210 5 0 "[ . 1]" 1 957 1 186 LYS HA 1 189 TYR H . . 3.400 3.556 3.226 3.908 0.508 3 1 "[ + . 1]" 1 958 1 186 LYS HA 1 190 LYS H . . 4.200 3.971 3.579 4.391 0.191 2 0 "[ . 1]" 1 959 1 186 LYS QB 1 187 MET H . . 4.530 2.852 2.482 3.703 . 0 0 "[ . 1]" 1 960 1 187 MET H 1 188 SER H . . 2.800 2.514 2.117 2.781 . 0 0 "[ . 1]" 1 961 1 187 MET H 1 189 TYR H . . 4.200 3.960 3.710 4.542 0.342 4 0 "[ . 1]" 1 962 1 187 MET HA 1 188 SER H . . 4.160 3.478 3.198 3.551 . 0 0 "[ . 1]" 1 963 1 187 MET HA 1 189 TYR H . . 4.400 4.254 3.954 4.625 0.225 4 0 "[ . 1]" 1 964 1 187 MET HA 1 190 LYS H . . 3.400 3.510 3.213 3.769 0.369 7 0 "[ . 1]" 1 965 1 187 MET HA 1 191 ASP H . . 4.400 4.590 3.178 5.273 0.873 5 5 "[ +-***1]" 1 966 1 187 MET QB 1 188 SER H . . 3.500 2.881 2.516 3.484 . 0 0 "[ . 1]" 1 967 1 188 SER H 1 189 TYR H . . 2.800 2.436 1.999 2.664 . 0 0 "[ . 1]" 1 968 1 188 SER H 1 190 LYS H . . 4.200 3.849 3.222 4.306 0.106 7 0 "[ . 1]" 1 969 1 188 SER HA 1 189 TYR H . . 3.520 3.472 3.355 3.559 0.039 4 0 "[ . 1]" 1 970 1 188 SER HA 1 190 LYS H . . 4.400 4.338 4.043 4.574 0.174 10 0 "[ . 1]" 1 971 1 188 SER HA 1 191 ASP H . . 3.600 4.013 3.635 4.504 0.904 5 4 "[ *+ *-1]" 1 972 1 188 SER QB 1 189 TYR H . . 4.200 3.029 2.404 3.521 . 0 0 "[ . 1]" 1 973 1 189 TYR H 1 190 LYS H . . 2.800 2.318 2.062 2.638 . 0 0 "[ . 1]" 1 974 1 189 TYR H 1 190 LYS HA . . 5.530 4.926 4.699 5.246 . 0 0 "[ . 1]" 1 975 1 189 TYR H 1 191 ASP H . . 4.200 3.984 3.371 4.439 0.239 5 0 "[ . 1]" 1 976 1 189 TYR H 1 230 TRP H . . 5.500 5.344 4.728 5.868 0.368 1 0 "[ . 1]" 1 977 1 189 TYR HA 1 190 LYS H . . 3.500 3.464 3.369 3.540 0.040 10 0 "[ . 1]" 1 978 1 189 TYR HA 1 191 ASP H . . 4.400 3.910 3.485 4.448 0.048 1 0 "[ . 1]" 1 979 1 189 TYR HA 1 192 PHE H . . 3.800 3.772 3.437 4.166 0.366 4 0 "[ . 1]" 1 980 1 189 TYR HA 1 230 TRP H . . 5.500 5.625 5.284 5.875 0.375 5 0 "[ . 1]" 1 981 1 189 TYR QB 1 190 LYS H . . 5.890 3.050 2.598 3.729 . 0 0 "[ . 1]" 1 982 1 189 TYR QB 1 191 ASP H . . 5.500 4.734 4.405 5.120 . 0 0 "[ . 1]" 1 983 1 189 TYR QB 1 192 PHE H . . 6.000 4.943 4.445 5.425 . 0 0 "[ . 1]" 1 984 1 189 TYR QD 1 191 ASP H . . 5.500 5.189 4.417 5.607 0.107 8 0 "[ . 1]" 1 985 1 190 LYS H 1 191 ASP H . . 3.240 2.605 1.860 2.823 . 0 0 "[ . 1]" 1 986 1 190 LYS H 1 192 PHE H . . 4.400 4.213 3.474 4.505 0.105 2 0 "[ . 1]" 1 987 1 190 LYS HA 1 191 ASP H . . 3.530 3.474 3.365 3.531 0.001 5 0 "[ . 1]" 1 988 1 190 LYS HA 1 192 PHE H . . 4.400 4.050 3.510 5.132 0.732 2 2 "[-+ . 1]" 1 989 1 190 LYS QB 1 191 ASP H . . 4.250 3.080 2.717 3.483 . 0 0 "[ . 1]" 1 990 1 191 ASP H 1 192 PHE H . . 3.620 2.611 2.064 2.869 . 0 0 "[ . 1]" 1 991 1 191 ASP HA 1 192 PHE H . . 3.540 3.460 3.098 3.567 0.027 2 0 "[ . 1]" 1 992 1 191 ASP QB 1 192 PHE H . . 4.920 3.000 2.456 3.620 . 0 0 "[ . 1]" 1 993 1 193 PRO HA 1 194 GLN H . . 4.680 2.435 2.162 2.710 . 0 0 "[ . 1]" 1 994 1 193 PRO QB 1 194 GLN H . . 4.210 2.714 1.914 3.914 . 0 0 "[ . 1]" 1 995 1 194 GLN H 1 195 LEU H . . 3.490 3.377 2.730 4.346 0.856 1 1 "[+ . 1]" 1 996 1 194 GLN H 1 196 PHE H . . 5.500 5.118 4.462 5.542 0.042 7 0 "[ . 1]" 1 997 1 194 GLN HA 1 195 LEU H . . 3.920 2.521 2.150 3.563 . 0 0 "[ . 1]" 1 998 1 194 GLN HA 1 196 PHE H . . 4.400 3.641 3.278 4.377 . 0 0 "[ . 1]" 1 999 1 194 GLN HA 1 197 ASN H . . 5.500 5.776 5.390 6.035 0.535 6 1 "[ .+ 1]" 1 1000 1 194 GLN QB 1 195 LEU H . . 4.800 3.274 1.718 4.004 . 0 0 "[ . 1]" 1 1001 1 194 GLN QB 1 196 PHE H . . 6.000 4.166 2.139 5.292 . 0 0 "[ . 1]" 1 1002 1 194 GLN QG 1 196 PHE H . . 6.000 4.361 3.072 5.829 . 0 0 "[ . 1]" 1 1003 1 195 LEU H 1 196 PHE H . . 3.490 2.114 1.732 2.862 . 0 0 "[ . 1]" 1 1004 1 195 LEU H 1 196 PHE HA . . 5.500 4.334 3.794 5.293 . 0 0 "[ . 1]" 1 1005 1 195 LEU H 1 197 ASN H . . 5.500 4.270 3.380 5.566 0.066 3 0 "[ . 1]" 1 1006 1 195 LEU HA 1 196 PHE H . . 3.880 3.174 2.625 3.476 . 0 0 "[ . 1]" 1 1007 1 195 LEU QB 1 196 PHE H . . 4.880 3.397 2.905 3.940 . 0 0 "[ . 1]" 1 1008 1 195 LEU QD 1 232 VAL QG . . 6.000 4.918 3.642 6.458 0.458 2 0 "[ . 1]" 1 1009 1 196 PHE H 1 197 ASN H . . 4.140 2.829 2.022 3.538 . 0 0 "[ . 1]" 1 1010 1 196 PHE HA 1 197 ASN H . . 4.480 2.783 2.176 3.493 . 0 0 "[ . 1]" 1 1011 1 196 PHE QB 1 197 ASN H . . 4.950 3.700 2.799 4.022 . 0 0 "[ . 1]" 1 1012 1 197 ASN H 1 198 GLY H . . 4.260 4.258 3.762 4.651 0.391 6 0 "[ . 1]" 1 1013 1 197 ASN H 1 198 GLY QA . . 6.000 4.918 4.280 5.206 . 0 0 "[ . 1]" 1 1014 1 197 ASN HA 1 198 GLY H . . 3.640 2.365 2.144 3.453 . 0 0 "[ . 1]" 1 1015 1 197 ASN HA 1 202 THR H . . 4.500 4.579 3.739 5.131 0.631 1 1 "[+ . 1]" 1 1016 1 197 ASN HA 1 202 THR HA . . 4.500 4.825 4.534 5.067 0.567 10 1 "[ . +]" 1 1017 1 197 ASN QB 1 198 GLY H . . 6.000 3.225 1.822 4.011 . 0 0 "[ . 1]" 1 1018 1 198 GLY H 1 199 GLY H . . 4.010 3.956 2.893 4.520 0.510 1 1 "[+ . 1]" 1 1019 1 198 GLY QA 1 199 GLY H . . 4.810 2.215 2.113 2.409 . 0 0 "[ . 1]" 1 1020 1 199 GLY H 1 200 GLN HA . . 5.500 5.468 4.870 5.862 0.362 6 0 "[ . 1]" 1 1021 1 199 GLY QA 1 200 GLN H . . 4.120 2.285 2.111 2.721 . 0 0 "[ . 1]" 1 1022 1 200 GLN H 1 201 ALA H . . 2.840 2.250 1.857 2.860 0.020 10 0 "[ . 1]" 1 1023 1 200 GLN H 1 202 THR H . . 4.200 4.232 3.947 4.365 0.165 9 0 "[ . 1]" 1 1024 1 200 GLN HA 1 201 ALA H . . 3.890 3.401 3.285 3.538 . 0 0 "[ . 1]" 1 1025 1 200 GLN HA 1 202 THR H . . 4.400 4.274 4.048 4.500 0.100 1 0 "[ . 1]" 1 1026 1 200 GLN HA 1 203 ASP H . . 3.400 3.513 3.362 3.689 0.289 9 0 "[ . 1]" 1 1027 1 200 GLN HA 1 204 ARG H . . 4.200 4.364 4.217 4.603 0.403 9 0 "[ . 1]" 1 1028 1 200 GLN QB 1 201 ALA H . . 5.380 3.144 2.626 3.744 . 0 0 "[ . 1]" 1 1029 1 201 ALA H 1 202 THR H . . 2.800 2.625 2.331 2.928 0.128 2 0 "[ . 1]" 1 1030 1 201 ALA H 1 202 THR HB . . 5.460 5.076 4.517 5.824 0.364 6 0 "[ . 1]" 1 1031 1 201 ALA H 1 203 ASP H . . 4.200 4.157 3.901 4.326 0.126 9 0 "[ . 1]" 1 1032 1 201 ALA HA 1 202 THR H . . 3.690 3.535 3.492 3.569 . 0 0 "[ . 1]" 1 1033 1 201 ALA HA 1 203 ASP H . . 4.400 4.274 3.987 4.417 0.017 6 0 "[ . 1]" 1 1034 1 201 ALA HA 1 204 ARG H . . 3.400 3.252 3.082 3.407 0.007 1 0 "[ . 1]" 1 1035 1 201 ALA HA 1 205 VAL H . . 4.200 3.983 3.661 4.368 0.168 9 0 "[ . 1]" 1 1036 1 201 ALA MB 1 202 THR H . . 4.390 2.585 2.213 2.833 . 0 0 "[ . 1]" 1 1037 1 202 THR H 1 203 ASP H . . 2.800 2.748 2.563 2.961 0.161 9 0 "[ . 1]" 1 1038 1 202 THR H 1 204 ARG H . . 4.200 4.030 3.753 4.226 0.026 1 0 "[ . 1]" 1 1039 1 202 THR HA 1 203 ASP H . . 3.600 3.529 3.488 3.557 . 0 0 "[ . 1]" 1 1040 1 202 THR HA 1 204 ARG H . . 4.400 4.386 4.132 4.490 0.090 7 0 "[ . 1]" 1 1041 1 202 THR HA 1 205 VAL H . . 3.400 3.589 3.425 3.739 0.339 4 0 "[ . 1]" 1 1042 1 202 THR HA 1 206 ARG H . . 4.200 4.346 4.238 4.516 0.316 4 0 "[ . 1]" 1 1043 1 202 THR HB 1 203 ASP H . . 4.500 3.231 2.428 4.032 . 0 0 "[ . 1]" 1 1044 1 202 THR HB 1 205 VAL H . . 5.400 5.563 5.234 5.861 0.461 8 0 "[ . 1]" 1 1045 1 203 ASP H 1 204 ARG H . . 2.800 2.443 2.254 2.579 . 0 0 "[ . 1]" 1 1046 1 203 ASP H 1 205 VAL H . . 4.200 3.836 3.661 4.038 . 0 0 "[ . 1]" 1 1047 1 203 ASP HA 1 204 ARG H . . 3.500 3.497 3.449 3.532 0.032 1 0 "[ . 1]" 1 1048 1 203 ASP HA 1 205 VAL H . . 4.400 4.069 3.680 4.341 . 0 0 "[ . 1]" 1 1049 1 203 ASP HA 1 206 ARG H . . 3.400 3.507 3.386 3.630 0.230 4 0 "[ . 1]" 1 1050 1 203 ASP HA 1 207 GLN H . . 4.200 4.327 4.070 4.442 0.242 7 0 "[ . 1]" 1 1051 1 203 ASP QB 1 204 ARG H . . 4.200 2.798 2.576 3.029 . 0 0 "[ . 1]" 1 1052 1 204 ARG H 1 205 VAL H . . 2.800 2.420 2.276 2.611 . 0 0 "[ . 1]" 1 1053 1 204 ARG H 1 206 ARG H . . 4.200 4.004 3.757 4.191 . 0 0 "[ . 1]" 1 1054 1 204 ARG HA 1 205 VAL H . . 3.590 3.435 3.267 3.522 . 0 0 "[ . 1]" 1 1055 1 204 ARG HA 1 206 ARG H . . 4.400 4.230 4.096 4.371 . 0 0 "[ . 1]" 1 1056 1 204 ARG HA 1 207 GLN H . . 3.400 3.536 3.400 3.662 0.262 8 0 "[ . 1]" 1 1057 1 204 ARG HA 1 208 GLN H . . 4.200 4.033 3.715 4.286 0.086 2 0 "[ . 1]" 1 1058 1 204 ARG HA 1 209 MET H . . 6.000 6.249 5.905 6.491 0.491 2 0 "[ . 1]" 1 1059 1 204 ARG QB 1 205 VAL H . . 4.200 2.982 2.662 3.394 . 0 0 "[ . 1]" 1 1060 1 205 VAL H 1 206 ARG H . . 2.800 2.350 2.091 2.490 . 0 0 "[ . 1]" 1 1061 1 205 VAL H 1 207 GLN H . . 4.200 3.845 3.364 4.315 0.115 1 0 "[ . 1]" 1 1062 1 205 VAL HA 1 206 ARG H . . 3.440 3.485 3.425 3.523 0.083 5 0 "[ . 1]" 1 1063 1 205 VAL HA 1 207 GLN H . . 4.400 4.255 4.056 4.479 0.079 7 0 "[ . 1]" 1 1064 1 205 VAL HA 1 208 GLN H . . 3.400 3.542 3.436 3.755 0.355 9 0 "[ . 1]" 1 1065 1 205 VAL HB 1 206 ARG H . . 4.500 3.425 2.758 4.031 . 0 0 "[ . 1]" 1 1066 1 205 VAL HB 1 207 GLN H . . 5.500 5.381 4.979 5.664 0.164 4 0 "[ . 1]" 1 1067 1 205 VAL QG 1 207 GLN H . . 6.000 4.256 3.908 4.768 . 0 0 "[ . 1]" 1 1068 1 206 ARG H 1 207 GLN H . . 2.800 2.398 2.160 2.613 . 0 0 "[ . 1]" 1 1069 1 206 ARG H 1 208 GLN H . . 4.200 3.859 3.628 4.042 . 0 0 "[ . 1]" 1 1070 1 206 ARG HA 1 207 GLN H . . 3.500 3.468 3.343 3.547 0.047 1 0 "[ . 1]" 1 1071 1 206 ARG HA 1 208 GLN H . . 4.400 4.319 4.137 4.539 0.139 8 0 "[ . 1]" 1 1072 1 206 ARG HA 1 209 MET H . . 3.400 3.584 3.299 3.816 0.416 4 0 "[ . 1]" 1 1073 1 206 ARG QB 1 207 GLN H . . 4.090 2.957 2.513 3.422 . 0 0 "[ . 1]" 1 1074 1 206 ARG QB 1 208 GLN H . . 4.700 4.780 4.611 4.981 0.281 2 0 "[ . 1]" 1 1075 1 207 GLN H 1 208 GLN H . . 2.800 2.333 2.059 2.548 . 0 0 "[ . 1]" 1 1076 1 207 GLN H 1 209 MET H . . 4.200 3.676 3.454 3.844 . 0 0 "[ . 1]" 1 1077 1 207 GLN HA 1 208 GLN H . . 3.720 3.480 3.399 3.527 . 0 0 "[ . 1]" 1 1078 1 207 GLN HA 1 209 MET H . . 4.400 3.928 3.618 4.417 0.017 5 0 "[ . 1]" 1 1079 1 207 GLN HA 1 210 ILE H . . 3.800 4.188 3.947 4.459 0.659 6 3 "[ *.+- 1]" 1 1080 1 207 GLN QB 1 208 GLN H . . 4.030 2.897 2.631 3.524 . 0 0 "[ . 1]" 1 1081 1 208 GLN H 1 209 MET H . . 3.070 2.333 2.104 2.556 . 0 0 "[ . 1]" 1 1082 1 208 GLN HA 1 211 THR H . . 4.200 4.262 3.585 4.552 0.352 2 0 "[ . 1]" 1 1083 1 208 GLN QB 1 209 MET H . . 4.220 3.403 3.078 3.786 . 0 0 "[ . 1]" 1 1084 1 209 MET H 1 210 ILE H . . 2.800 2.589 2.395 2.836 0.036 4 0 "[ . 1]" 1 1085 1 209 MET HA 1 210 ILE H . . 3.950 3.449 3.358 3.541 . 0 0 "[ . 1]" 1 1086 1 209 MET QB 1 210 ILE H . . 3.770 3.267 2.737 3.652 . 0 0 "[ . 1]" 1 1087 1 210 ILE H 1 211 THR H . . 3.120 3.136 2.242 3.456 0.336 6 0 "[ . 1]" 1 1088 1 210 ILE H 1 232 VAL QG . . 5.500 4.685 3.697 5.671 0.171 7 0 "[ . 1]" 1 1089 1 210 ILE HA 1 211 THR H . . 3.650 3.052 2.253 3.569 . 0 0 "[ . 1]" 1 1090 1 210 ILE HA 1 235 TYR H . . 6.200 6.559 6.267 6.808 0.608 7 2 "[ .-+ 1]" 1 1091 1 210 ILE HB 1 211 THR H . . 4.530 3.575 1.792 4.610 0.080 5 0 "[ . 1]" 1 1092 1 211 THR H 1 232 VAL QG . . 5.500 5.539 5.329 5.773 0.273 3 0 "[ . 1]" 1 1093 1 211 THR H 1 243 GLN QB . . 5.750 6.104 5.874 6.209 0.459 9 0 "[ . 1]" 1 1094 1 212 PRO HA 1 213 LEU H . . 3.080 2.989 2.235 3.481 0.401 5 0 "[ . 1]" 1 1095 1 212 PRO QB 1 213 LEU H . . 3.020 1.948 1.653 2.953 . 0 0 "[ . 1]" 1 1096 1 213 LEU H 1 214 ASP H . . 3.480 3.224 2.515 3.726 0.246 7 0 "[ . 1]" 1 1097 1 213 LEU H 1 214 ASP HA . . 5.240 5.022 3.918 5.528 0.288 3 0 "[ . 1]" 1 1098 1 213 LEU H 1 218 LEU QD . . 5.500 5.120 4.759 5.491 . 0 0 "[ . 1]" 1 1099 1 213 LEU H 1 218 LEU HG . . 5.500 5.686 5.180 6.090 0.590 4 2 "[ +- 1]" 1 1100 1 213 LEU HA 1 214 ASP H . . 3.980 2.461 2.138 3.122 . 0 0 "[ . 1]" 1 1101 1 213 LEU QB 1 214 ASP H . . 5.240 3.742 3.311 3.973 . 0 0 "[ . 1]" 1 1102 1 213 LEU QD 1 247 LEU H . . 6.000 6.079 5.442 6.251 0.251 7 0 "[ . 1]" 1 1103 1 214 ASP H 1 215 VAL H . . 3.700 3.312 2.743 4.362 0.662 9 2 "[ -. +1]" 1 1104 1 214 ASP HA 1 215 VAL H . . 3.350 3.295 2.555 3.568 0.218 10 0 "[ . 1]" 1 1105 1 214 ASP QB 1 215 VAL H . . 4.070 2.266 1.823 3.947 . 0 0 "[ . 1]" 1 1106 1 217 PRO HA 1 218 LEU H . . 4.130 2.657 2.191 3.408 . 0 0 "[ . 1]" 1 1107 1 218 LEU H 1 219 ASP H . . 2.800 2.561 2.038 2.851 0.051 10 0 "[ . 1]" 1 1108 1 218 LEU H 1 220 TYR H . . 4.200 4.110 3.150 4.533 0.333 7 0 "[ . 1]" 1 1109 1 218 LEU HA 1 219 ASP H . . 3.500 3.397 3.149 3.566 0.066 5 0 "[ . 1]" 1 1110 1 218 LEU HA 1 220 TYR H . . 4.400 4.202 3.871 4.533 0.133 7 0 "[ . 1]" 1 1111 1 218 LEU HA 1 221 PHE H . . 3.400 3.350 2.985 3.668 0.268 3 0 "[ . 1]" 1 1112 1 218 LEU HA 1 222 ASP H . . 4.200 3.718 3.025 4.268 0.068 7 0 "[ . 1]" 1 1113 1 218 LEU QB 1 219 ASP H . . 4.640 2.999 2.450 3.532 . 0 0 "[ . 1]" 1 1114 1 219 ASP H 1 220 TYR H . . 2.800 2.486 1.992 2.843 0.043 8 0 "[ . 1]" 1 1115 1 219 ASP H 1 221 PHE H . . 4.200 3.723 3.251 4.148 . 0 0 "[ . 1]" 1 1116 1 219 ASP HA 1 220 TYR H . . 3.500 3.506 3.440 3.554 0.054 7 0 "[ . 1]" 1 1117 1 219 ASP HA 1 221 PHE H . . 4.400 4.512 3.831 4.814 0.414 5 0 "[ . 1]" 1 1118 1 219 ASP HA 1 222 ASP H . . 3.600 3.934 3.621 4.080 0.480 1 0 "[ . 1]" 1 1119 1 219 ASP HA 1 223 GLU H . . 4.250 4.459 4.054 4.900 0.650 5 1 "[ + 1]" 1 1120 1 219 ASP QB 1 220 TYR H . . 4.620 2.779 2.503 3.075 . 0 0 "[ . 1]" 1 1121 1 220 TYR H 1 221 PHE H . . 2.800 2.235 1.957 2.448 . 0 0 "[ . 1]" 1 1122 1 220 TYR H 1 222 ASP H . . 4.200 3.686 3.423 4.013 . 0 0 "[ . 1]" 1 1123 1 220 TYR HA 1 221 PHE H . . 3.500 3.472 3.293 3.529 0.029 5 0 "[ . 1]" 1 1124 1 220 TYR HA 1 222 ASP H . . 4.400 3.977 3.580 4.424 0.024 1 0 "[ . 1]" 1 1125 1 220 TYR HA 1 223 GLU H . . 3.450 3.704 3.471 4.095 0.645 8 1 "[ . + 1]" 1 1126 1 220 TYR HA 1 224 VAL H . . 4.200 4.435 4.232 4.803 0.603 2 1 "[ + . 1]" 1 1127 1 220 TYR QB 1 221 PHE H . . 4.600 3.005 2.835 3.386 . 0 0 "[ . 1]" 1 1128 1 220 TYR QD 1 222 ASP H . . 6.000 5.253 4.956 5.675 . 0 0 "[ . 1]" 1 1129 1 221 PHE H 1 222 ASP H . . 2.800 2.398 2.059 2.566 . 0 0 "[ . 1]" 1 1130 1 221 PHE H 1 223 GLU H . . 4.400 4.117 3.718 4.456 0.056 5 0 "[ . 1]" 1 1131 1 221 PHE HA 1 222 ASP H . . 3.500 3.340 3.156 3.508 0.008 6 0 "[ . 1]" 1 1132 1 221 PHE HA 1 223 GLU H . . 4.400 4.335 3.905 4.491 0.091 6 0 "[ . 1]" 1 1133 1 221 PHE HA 1 224 VAL H . . 3.400 3.615 3.358 3.925 0.525 4 1 "[ +. 1]" 1 1134 1 221 PHE HA 1 225 PHE H . . 4.200 3.694 2.763 4.279 0.079 4 0 "[ . 1]" 1 1135 1 221 PHE QB 1 222 ASP H . . 4.720 3.172 2.738 3.548 . 0 0 "[ . 1]" 1 1136 1 222 ASP H 1 223 GLU H . . 2.800 2.294 1.917 2.697 . 0 0 "[ . 1]" 1 1137 1 222 ASP H 1 224 VAL H . . 4.200 3.720 3.129 4.255 0.055 1 0 "[ . 1]" 1 1138 1 222 ASP HA 1 223 GLU H . . 3.500 3.503 3.371 3.554 0.054 5 0 "[ . 1]" 1 1139 1 222 ASP HA 1 224 VAL H . . 4.400 4.330 3.992 4.518 0.118 4 0 "[ . 1]" 1 1140 1 222 ASP HA 1 225 PHE H . . 3.450 3.544 3.181 3.932 0.482 7 0 "[ . 1]" 1 1141 1 222 ASP HA 1 226 THR H . . 4.200 3.916 3.295 4.361 0.161 5 0 "[ . 1]" 1 1142 1 222 ASP QB 1 223 GLU H . . 4.600 2.747 2.539 3.185 . 0 0 "[ . 1]" 1 1143 1 222 ASP QB 1 224 VAL H . . 4.900 4.691 4.421 4.954 0.054 1 0 "[ . 1]" 1 1144 1 223 GLU H 1 224 VAL H . . 2.800 2.446 1.947 2.816 0.016 2 0 "[ . 1]" 1 1145 1 223 GLU H 1 225 PHE H . . 4.200 3.714 3.143 3.981 . 0 0 "[ . 1]" 1 1146 1 223 GLU HA 1 224 VAL H . . 3.500 3.462 3.283 3.548 0.048 2 0 "[ . 1]" 1 1147 1 223 GLU HA 1 225 PHE H . . 4.400 4.334 4.080 4.583 0.183 7 0 "[ . 1]" 1 1148 1 223 GLU HA 1 226 THR H . . 3.500 3.878 3.741 4.033 0.533 8 3 "[* . -+ 1]" 1 1149 1 223 GLU HA 1 227 SER H . . 4.400 4.699 4.162 5.031 0.631 5 2 "[ + -]" 1 1150 1 223 GLU QB 1 224 VAL H . . 4.630 2.995 2.534 3.360 . 0 0 "[ . 1]" 1 1151 1 224 VAL H 1 225 PHE H . . 2.800 2.209 1.869 2.454 . 0 0 "[ . 1]" 1 1152 1 224 VAL H 1 226 THR H . . 4.400 3.787 3.073 4.318 . 0 0 "[ . 1]" 1 1153 1 224 VAL HA 1 225 PHE H . . 3.500 3.455 3.387 3.516 0.016 6 0 "[ . 1]" 1 1154 1 224 VAL HA 1 226 THR H . . 4.400 4.188 3.746 4.639 0.239 4 0 "[ . 1]" 1 1155 1 224 VAL HA 1 227 SER H . . 3.400 3.518 2.888 3.919 0.519 8 1 "[ . + 1]" 1 1156 1 224 VAL HB 1 225 PHE H . . 5.230 3.192 2.726 4.186 . 0 0 "[ . 1]" 1 1157 1 225 PHE H 1 226 THR H . . 2.800 2.384 2.085 2.684 . 0 0 "[ . 1]" 1 1158 1 225 PHE H 1 227 SER H . . 4.200 3.784 3.595 4.026 . 0 0 "[ . 1]" 1 1159 1 225 PHE HA 1 226 THR H . . 3.500 3.459 3.329 3.549 0.049 5 0 "[ . 1]" 1 1160 1 225 PHE HA 1 227 SER H . . 4.400 3.985 3.753 4.201 . 0 0 "[ . 1]" 1 1161 1 225 PHE QB 1 226 THR H . . 4.860 2.934 2.660 3.289 . 0 0 "[ . 1]" 1 1162 1 226 THR H 1 227 SER H . . 2.800 2.342 1.990 2.635 . 0 0 "[ . 1]" 1 1163 1 226 THR H 1 228 GLU H . . 5.500 4.484 3.320 5.332 . 0 0 "[ . 1]" 1 1164 1 226 THR HA 1 227 SER H . . 3.500 3.397 3.268 3.475 . 0 0 "[ . 1]" 1 1165 1 227 SER H 1 228 GLU H . . 2.890 2.656 2.035 3.140 0.250 5 0 "[ . 1]" 1 1166 1 227 SER HA 1 228 GLU H . . 4.110 3.475 3.189 3.563 . 0 0 "[ . 1]" 1 1167 1 227 SER QB 1 228 GLU H . . 5.600 2.864 1.815 3.894 . 0 0 "[ . 1]" 1 1168 1 228 GLU HA 1 232 VAL H . . 5.100 5.434 5.032 5.881 0.781 9 2 "[ -. +1]" 1 1169 1 229 ASN H 1 231 ASN H . . 4.200 3.899 2.434 4.495 0.295 2 0 "[ . 1]" 1 1170 1 229 ASN HA 1 231 ASN H . . 4.400 4.207 3.834 4.563 0.163 7 0 "[ . 1]" 1 1171 1 229 ASN HA 1 232 VAL H . . 3.960 4.185 3.629 4.453 0.493 1 0 "[ . 1]" 1 1172 1 229 ASN HA 1 233 ARG H . . 4.200 4.382 3.824 4.727 0.527 6 1 "[ .+ 1]" 1 1173 1 230 TRP H 1 232 VAL H . . 4.200 4.191 3.880 4.526 0.326 1 0 "[ . 1]" 1 1174 1 230 TRP HA 1 232 VAL H . . 4.400 4.299 3.944 4.472 0.072 1 0 "[ . 1]" 1 1175 1 230 TRP HA 1 233 ARG H . . 3.400 3.562 3.148 4.161 0.761 3 2 "[ + . - 1]" 1 1176 1 230 TRP HA 1 234 ILE H . . 4.200 4.092 3.411 4.665 0.465 3 0 "[ . 1]" 1 1177 1 230 TRP HE3 1 232 VAL H . . 5.500 5.289 4.770 5.653 0.153 3 0 "[ . 1]" 1 1178 1 231 ASN H 1 232 VAL H . . 2.800 2.324 1.863 2.753 . 0 0 "[ . 1]" 1 1179 1 231 ASN H 1 233 ARG H . . 4.200 3.625 3.310 4.078 . 0 0 "[ . 1]" 1 1180 1 231 ASN HA 1 232 VAL H . . 3.500 3.461 3.320 3.546 0.046 7 0 "[ . 1]" 1 1181 1 231 ASN HA 1 233 ARG H . . 4.400 4.304 3.974 4.510 0.110 1 0 "[ . 1]" 1 1182 1 231 ASN HA 1 234 ILE H . . 3.600 3.999 3.761 4.325 0.725 3 3 "[ + * -]" 1 1183 1 231 ASN HA 1 235 TYR H . . 4.200 4.432 4.186 4.681 0.481 6 0 "[ . 1]" 1 1184 1 231 ASN QB 1 232 VAL H . . 4.900 2.883 2.585 3.311 . 0 0 "[ . 1]" 1 1185 1 232 VAL H 1 233 ARG H . . 2.740 2.187 1.866 2.579 . 0 0 "[ . 1]" 1 1186 1 232 VAL H 1 234 ILE H . . 4.200 3.947 3.590 4.234 0.034 7 0 "[ . 1]" 1 1187 1 232 VAL HA 1 233 ARG H . . 3.550 3.435 3.331 3.522 . 0 0 "[ . 1]" 1 1188 1 232 VAL HA 1 234 ILE H . . 4.400 4.234 4.003 4.428 0.028 10 0 "[ . 1]" 1 1189 1 232 VAL HA 1 235 TYR H . . 3.400 3.330 3.112 3.625 0.225 8 0 "[ . 1]" 1 1190 1 232 VAL HA 1 236 GLN H . . 4.200 3.724 3.442 4.207 0.007 8 0 "[ . 1]" 1 1191 1 232 VAL HB 1 233 ARG H . . 5.010 3.355 2.954 4.024 . 0 0 "[ . 1]" 1 1192 1 233 ARG H 1 234 ILE H . . 2.800 2.483 2.241 2.756 . 0 0 "[ . 1]" 1 1193 1 233 ARG H 1 235 TYR H . . 4.200 3.812 3.485 4.022 . 0 0 "[ . 1]" 1 1194 1 233 ARG HA 1 234 ILE H . . 3.500 3.513 3.496 3.533 0.033 3 0 "[ . 1]" 1 1195 1 233 ARG HA 1 235 TYR H . . 4.400 4.424 4.303 4.513 0.113 7 0 "[ . 1]" 1 1196 1 233 ARG HA 1 236 GLN H . . 3.400 3.692 3.509 3.857 0.457 7 0 "[ . 1]" 1 1197 1 233 ARG HA 1 237 LEU H . . 4.250 4.425 4.193 4.762 0.512 1 1 "[+ . 1]" 1 1198 1 233 ARG QB 1 234 ILE H . . 4.940 3.197 2.586 3.507 . 0 0 "[ . 1]" 1 1199 1 233 ARG QB 1 235 TYR H . . 5.500 4.926 4.539 5.127 . 0 0 "[ . 1]" 1 1200 1 234 ILE H 1 235 TYR H . . 2.800 2.341 2.250 2.498 . 0 0 "[ . 1]" 1 1201 1 234 ILE H 1 236 GLN H . . 4.200 3.784 3.680 3.848 . 0 0 "[ . 1]" 1 1202 1 234 ILE HA 1 235 TYR H . . 3.500 3.490 3.454 3.518 0.018 4 0 "[ . 1]" 1 1203 1 234 ILE HA 1 236 GLN H . . 4.400 4.188 3.977 4.323 . 0 0 "[ . 1]" 1 1204 1 234 ILE HA 1 237 LEU H . . 3.400 3.657 3.374 3.820 0.420 4 0 "[ . 1]" 1 1205 1 234 ILE HA 1 238 LYS H . . 4.200 4.538 4.193 4.840 0.640 1 1 "[+ . 1]" 1 1206 1 234 ILE HB 1 235 TYR H . . 4.940 3.034 2.807 3.882 . 0 0 "[ . 1]" 1 1207 1 234 ILE HB 1 236 GLN H . . 5.390 5.108 4.903 5.617 0.227 4 0 "[ . 1]" 1 1208 1 234 ILE MD 1 236 GLN H . . 6.000 5.543 5.234 6.125 0.125 6 0 "[ . 1]" 1 1209 1 234 ILE QG 1 236 GLN H . . 6.000 5.671 5.308 6.041 0.041 3 0 "[ . 1]" 1 1210 1 235 TYR H 1 236 GLN H . . 2.940 2.379 2.278 2.488 . 0 0 "[ . 1]" 1 1211 1 235 TYR H 1 237 LEU H . . 4.200 4.078 3.911 4.278 0.078 1 0 "[ . 1]" 1 1212 1 235 TYR HA 1 236 GLN H . . 3.540 3.465 3.388 3.501 . 0 0 "[ . 1]" 1 1213 1 235 TYR HA 1 237 LEU H . . 4.400 4.292 4.169 4.438 0.038 5 0 "[ . 1]" 1 1214 1 235 TYR HA 1 238 LYS H . . 3.400 3.523 3.387 3.706 0.306 2 0 "[ . 1]" 1 1215 1 235 TYR HA 1 239 LYS H . . 4.200 4.040 3.839 4.329 0.129 2 0 "[ . 1]" 1 1216 1 235 TYR QB 1 236 GLN H . . 4.960 2.938 2.840 3.155 . 0 0 "[ . 1]" 1 1217 1 235 TYR QB 1 237 LEU H . . 6.000 4.825 4.689 4.952 . 0 0 "[ . 1]" 1 1218 1 235 TYR QD 1 237 LEU H . . 6.000 5.922 5.730 6.168 0.168 4 0 "[ . 1]" 1 1219 1 236 GLN H 1 237 LEU H . . 2.800 2.514 2.298 2.636 . 0 0 "[ . 1]" 1 1220 1 236 GLN H 1 238 LYS H . . 4.200 4.089 3.885 4.310 0.110 2 0 "[ . 1]" 1 1221 1 236 GLN H 1 247 LEU QD . . 5.500 5.655 5.233 5.964 0.464 8 0 "[ . 1]" 1 1222 1 236 GLN HA 1 237 LEU H . . 3.510 3.516 3.484 3.542 0.032 10 0 "[ . 1]" 1 1223 1 236 GLN HA 1 238 LYS H . . 4.430 4.432 4.222 4.624 0.194 1 0 "[ . 1]" 1 1224 1 236 GLN HA 1 239 LYS H . . 3.400 3.434 3.263 3.564 0.164 8 0 "[ . 1]" 1 1225 1 236 GLN HA 1 240 ASP H . . 4.200 3.833 3.611 4.117 . 0 0 "[ . 1]" 1 1226 1 236 GLN QB 1 237 LEU H . . 4.960 3.018 2.584 3.547 . 0 0 "[ . 1]" 1 1227 1 237 LEU H 1 238 LYS H . . 2.800 2.598 2.471 2.697 . 0 0 "[ . 1]" 1 1228 1 237 LEU H 1 239 LYS H . . 4.200 3.910 3.784 4.084 . 0 0 "[ . 1]" 1 1229 1 237 LEU HA 1 238 LYS H . . 3.530 3.529 3.491 3.551 0.021 1 0 "[ . 1]" 1 1230 1 237 LEU HA 1 239 LYS H . . 4.400 4.356 4.118 4.525 0.125 6 0 "[ . 1]" 1 1231 1 237 LEU HA 1 240 ASP H . . 3.400 3.548 3.416 3.626 0.226 4 0 "[ . 1]" 1 1232 1 237 LEU HA 1 241 ASP H . . 4.200 4.322 3.927 4.513 0.313 4 0 "[ . 1]" 1 1233 1 237 LEU QB 1 238 LYS H . . 4.930 2.574 2.419 2.755 . 0 0 "[ . 1]" 1 1234 1 237 LEU QD 1 239 LYS H . . 5.590 4.585 4.333 4.929 . 0 0 "[ . 1]" 1 1235 1 238 LYS H 1 239 LYS H . . 2.800 2.465 2.335 2.623 . 0 0 "[ . 1]" 1 1236 1 238 LYS H 1 240 ASP H . . 4.250 3.890 3.768 4.003 . 0 0 "[ . 1]" 1 1237 1 238 LYS HA 1 239 LYS H . . 3.500 3.494 3.440 3.538 0.038 6 0 "[ . 1]" 1 1238 1 238 LYS HA 1 240 ASP H . . 4.290 4.252 4.081 4.463 0.173 4 0 "[ . 1]" 1 1239 1 238 LYS HA 1 241 ASP H . . 3.400 3.625 3.441 3.740 0.340 4 0 "[ . 1]" 1 1240 1 238 LYS HA 1 242 ALA H . . 4.200 4.431 3.844 4.809 0.609 8 2 "[ - . + 1]" 1 1241 1 238 LYS QB 1 239 LYS H . . 4.150 2.850 2.528 3.528 . 0 0 "[ . 1]" 1 1242 1 238 LYS QG 1 240 ASP H . . 6.000 5.437 4.379 5.837 . 0 0 "[ . 1]" 1 1243 1 239 LYS H 1 240 ASP H . . 2.800 2.401 2.309 2.516 . 0 0 "[ . 1]" 1 1244 1 239 LYS H 1 241 ASP H . . 4.200 3.997 3.628 4.242 0.042 9 0 "[ . 1]" 1 1245 1 239 LYS HA 1 240 ASP H . . 3.380 3.480 3.435 3.523 0.143 4 0 "[ . 1]" 1 1246 1 239 LYS HA 1 241 ASP H . . 4.400 4.200 3.823 4.445 0.045 2 0 "[ . 1]" 1 1247 1 239 LYS HA 1 242 ALA H . . 3.400 3.354 3.032 3.648 0.248 6 0 "[ . 1]" 1 1248 1 239 LYS HA 1 243 GLN H . . 5.500 2.912 2.002 4.625 . 0 0 "[ . 1]" 1 1249 1 239 LYS QB 1 240 ASP H . . 4.570 2.921 2.734 3.645 . 0 0 "[ . 1]" 1 1250 1 239 LYS QB 1 242 ALA H . . 5.480 4.819 4.470 5.111 . 0 0 "[ . 1]" 1 1251 1 239 LYS QE 1 241 ASP H . . 5.920 5.556 4.792 5.940 0.020 1 0 "[ . 1]" 1 1252 1 240 ASP H 1 241 ASP H . . 2.800 2.502 2.254 2.717 . 0 0 "[ . 1]" 1 1253 1 240 ASP H 1 242 ALA H . . 4.200 3.828 3.641 3.950 . 0 0 "[ . 1]" 1 1254 1 240 ASP HA 1 241 ASP H . . 3.500 3.488 3.363 3.539 0.039 9 0 "[ . 1]" 1 1255 1 240 ASP HA 1 242 ALA H . . 4.400 4.136 3.907 4.374 . 0 0 "[ . 1]" 1 1256 1 240 ASP QB 1 241 ASP H . . 4.900 2.944 2.639 3.678 . 0 0 "[ . 1]" 1 1257 1 241 ASP H 1 242 ALA H . . 2.800 2.346 2.025 2.655 . 0 0 "[ . 1]" 1 1258 1 241 ASP HA 1 242 ALA H . . 3.500 3.441 3.378 3.507 0.007 6 0 "[ . 1]" 1 1259 1 241 ASP QB 1 242 ALA H . . 4.900 2.989 2.734 3.194 . 0 0 "[ . 1]" 1 1260 1 242 ALA HA 1 243 GLN H . . 4.330 3.492 3.250 3.572 . 0 0 "[ . 1]" 1 1261 1 242 ALA HA 1 244 GLY H . . 4.950 4.878 4.059 5.109 0.159 8 0 "[ . 1]" 1 1262 1 242 ALA MB 1 243 GLN H . . 4.620 2.206 1.837 3.347 . 0 0 "[ . 1]" 1 1263 1 243 GLN H 1 244 GLY QA . . 6.000 4.661 4.124 5.075 . 0 0 "[ . 1]" 1 1264 1 243 GLN HA 1 244 GLY H . . 3.700 3.300 2.280 3.575 . 0 0 "[ . 1]" 1 1265 1 243 GLN QB 1 244 GLY H . . 6.000 2.713 2.000 3.873 . 0 0 "[ . 1]" 1 1266 1 244 GLY H 1 245 ARG H . . 4.850 3.352 1.798 4.413 . 0 0 "[ . 1]" 1 1267 1 244 GLY H 1 245 ARG HA . . 5.500 4.604 3.920 5.534 0.034 4 0 "[ . 1]" 1 1268 1 244 GLY H 1 246 THR H . . 5.410 5.472 4.531 6.135 0.725 8 1 "[ . + 1]" 1 1269 1 244 GLY QA 1 245 ARG H . . 3.150 2.331 2.110 2.808 . 0 0 "[ . 1]" 1 1270 1 245 ARG H 1 246 THR H . . 4.640 3.100 1.827 4.648 0.008 8 0 "[ . 1]" 1 1271 1 245 ARG HA 1 246 THR H . . 3.520 2.670 2.141 3.472 . 0 0 "[ . 1]" 1 1272 1 245 ARG HA 1 248 ARG H . . 5.500 4.986 4.079 5.549 0.049 10 0 "[ . 1]" 1 1273 1 245 ARG QB 1 246 THR H . . 4.110 3.620 1.846 4.013 . 0 0 "[ . 1]" 1 1274 1 246 THR H 1 247 LEU H . . 5.000 1.908 1.502 2.505 . 0 0 "[ . 1]" 1 1275 1 246 THR H 1 248 ARG H . . 4.400 3.730 3.134 4.582 0.182 1 0 "[ . 1]" 1 1276 1 246 THR HA 1 247 LEU H . . 3.970 3.328 3.085 3.542 . 0 0 "[ . 1]" 1 1277 1 246 THR HA 1 248 ARG H . . 4.400 3.514 3.240 3.941 . 0 0 "[ . 1]" 1 1278 1 246 THR HA 1 249 ASP H . . 5.500 2.851 2.747 3.034 . 0 0 "[ . 1]" 1 1279 1 246 THR HA 1 250 VAL H . . 4.200 4.291 4.134 4.411 0.211 6 0 "[ . 1]" 1 1280 1 246 THR HB 1 247 LEU H . . 3.730 3.500 2.675 3.890 0.160 10 0 "[ . 1]" 1 1281 1 246 THR HB 1 248 ARG H . . 5.500 4.992 4.808 5.349 . 0 0 "[ . 1]" 1 1282 1 246 THR MG 1 249 ASP H . . 5.360 3.581 2.863 4.666 . 0 0 "[ . 1]" 1 1283 1 246 THR MG 1 250 VAL H . . 5.500 3.886 3.041 5.287 . 0 0 "[ . 1]" 1 1284 1 247 LEU H 1 248 ARG H . . 2.800 2.745 2.624 2.844 0.044 5 0 "[ . 1]" 1 1285 1 247 LEU H 1 249 ASP H . . 4.200 4.115 3.875 4.216 0.016 4 0 "[ . 1]" 1 1286 1 247 LEU HA 1 248 ARG H . . 3.720 3.474 3.447 3.513 . 0 0 "[ . 1]" 1 1287 1 247 LEU HA 1 249 ASP H . . 4.400 4.436 4.291 4.525 0.125 3 0 "[ . 1]" 1 1288 1 247 LEU HA 1 250 VAL H . . 3.400 3.724 3.606 3.792 0.392 6 0 "[ . 1]" 1 1289 1 247 LEU HA 1 251 GLY H . . 4.200 4.342 4.232 4.437 0.237 1 0 "[ . 1]" 1 1290 1 247 LEU QB 1 248 ARG H . . 4.920 3.554 3.467 3.597 . 0 0 "[ . 1]" 1 1291 1 247 LEU HB2 1 250 VAL H . . 5.500 5.541 5.349 5.623 0.123 1 0 "[ . 1]" 1 1292 1 247 LEU MD2 1 250 VAL H . . 5.500 5.063 4.958 5.162 . 0 0 "[ . 1]" 1 1293 1 247 LEU HG 1 250 VAL H . . 5.500 5.446 5.260 5.535 0.035 6 0 "[ . 1]" 1 1294 1 248 ARG H 1 249 ASP H . . 2.800 2.270 2.173 2.437 . 0 0 "[ . 1]" 1 1295 1 248 ARG H 1 250 VAL H . . 4.200 3.619 3.567 3.707 . 0 0 "[ . 1]" 1 1296 1 248 ARG HA 1 249 ASP H . . 3.760 3.492 3.450 3.518 . 0 0 "[ . 1]" 1 1297 1 248 ARG HA 1 250 VAL H . . 4.630 3.741 3.698 3.793 . 0 0 "[ . 1]" 1 1298 1 248 ARG HA 1 251 GLY H . . 3.600 3.663 3.628 3.732 0.132 2 0 "[ . 1]" 1 1299 1 248 ARG HA 1 252 GLU H . . 4.600 4.677 4.621 4.736 0.136 9 0 "[ . 1]" 1 1300 1 248 ARG QB 1 249 ASP H . . 4.920 3.440 2.768 3.619 . 0 0 "[ . 1]" 1 1301 1 248 ARG QB 1 250 VAL H . . 6.000 4.694 4.363 4.814 . 0 0 "[ . 1]" 1 1302 1 248 ARG HB2 1 251 GLY H . . 5.500 5.663 5.578 5.955 0.455 9 0 "[ . 1]" 1 1303 1 248 ARG QD 1 250 VAL H . . 6.000 5.582 5.422 5.838 . 0 0 "[ . 1]" 1 1304 1 248 ARG HG2 1 251 GLY H . . 5.500 5.662 5.518 5.748 0.248 5 0 "[ . 1]" 1 1305 1 249 ASP H 1 250 VAL H . . 2.800 2.403 2.315 2.463 . 0 0 "[ . 1]" 1 1306 1 249 ASP H 1 251 GLY H . . 4.200 4.156 4.076 4.258 0.058 5 0 "[ . 1]" 1 1307 1 249 ASP HA 1 250 VAL H . . 3.530 3.254 3.216 3.291 . 0 0 "[ . 1]" 1 1308 1 249 ASP HA 1 251 GLY H . . 4.400 4.268 4.135 4.379 . 0 0 "[ . 1]" 1 1309 1 249 ASP HA 1 252 GLU H . . 3.400 3.630 3.515 3.800 0.400 7 0 "[ . 1]" 1 1310 1 249 ASP HA 1 253 LEU H . . 4.200 3.822 3.327 4.233 0.033 9 0 "[ . 1]" 1 1311 1 249 ASP QB 1 250 VAL H . . 4.920 3.413 3.356 3.466 . 0 0 "[ . 1]" 1 1312 1 249 ASP QB 1 253 LEU H . . 6.000 4.982 4.458 5.397 . 0 0 "[ . 1]" 1 1313 1 250 VAL H 1 251 GLY H . . 2.800 2.098 2.040 2.143 . 0 0 "[ . 1]" 1 1314 1 250 VAL H 1 252 GLU H . . 4.200 3.494 3.392 3.630 . 0 0 "[ . 1]" 1 1315 1 250 VAL HA 1 251 GLY H . . 3.640 3.495 3.473 3.515 . 0 0 "[ . 1]" 1 1316 1 250 VAL HA 1 252 GLU H . . 4.400 4.048 3.949 4.186 . 0 0 "[ . 1]" 1 1317 1 250 VAL HA 1 253 LEU H . . 3.900 3.697 3.465 4.012 0.112 5 0 "[ . 1]" 1 1318 1 250 VAL HA 1 254 THR H . . 4.200 3.957 3.411 4.285 0.085 4 0 "[ . 1]" 1 1319 1 250 VAL HB 1 251 GLY H . . 4.930 3.608 2.806 3.971 . 0 0 "[ . 1]" 1 1320 1 251 GLY H 1 252 GLU H . . 2.820 2.358 2.236 2.523 . 0 0 "[ . 1]" 1 1321 1 251 GLY H 1 253 LEU H . . 4.200 3.940 3.707 4.215 0.015 10 0 "[ . 1]" 1 1322 1 251 GLY QA 1 252 GLU H . . 3.530 2.888 2.814 2.920 . 0 0 "[ . 1]" 1 1323 1 251 GLY QA 1 253 LEU H . . 4.400 4.153 3.781 4.299 . 0 0 "[ . 1]" 1 1324 1 251 GLY QA 1 254 THR H . . 3.400 3.705 3.542 3.832 0.432 3 0 "[ . 1]" 1 1325 1 252 GLU H 1 253 LEU H . . 2.800 2.114 1.905 2.285 . 0 0 "[ . 1]" 1 1326 1 252 GLU H 1 254 THR H . . 4.200 3.449 3.139 3.767 . 0 0 "[ . 1]" 1 1327 1 252 GLU HA 1 253 LEU H . . 3.520 3.477 3.263 3.536 0.016 10 0 "[ . 1]" 1 1328 1 252 GLU HA 1 254 THR H . . 4.400 4.141 3.935 4.408 0.008 9 0 "[ . 1]" 1 1329 1 252 GLU HA 1 255 ARG H . . 3.900 3.838 3.670 4.062 0.162 9 0 "[ . 1]" 1 1330 1 252 GLU QB 1 253 LEU H . . 4.680 3.374 2.651 3.860 . 0 0 "[ . 1]" 1 1331 1 253 LEU H 1 254 THR H . . 2.810 2.303 1.819 2.500 . 0 0 "[ . 1]" 1 1332 1 253 LEU H 1 255 ARG H . . 4.200 3.955 3.267 4.216 0.016 1 0 "[ . 1]" 1 1333 1 253 LEU HA 1 254 THR H . . 3.510 3.426 3.315 3.513 0.003 7 0 "[ . 1]" 1 1334 1 253 LEU HA 1 255 ARG H . . 4.400 3.919 3.495 4.450 0.050 10 0 "[ . 1]" 1 1335 1 253 LEU QB 1 254 THR H . . 4.700 2.998 2.680 3.276 . 0 0 "[ . 1]" 1 1336 1 254 THR H 1 255 ARG H . . 2.840 2.442 2.018 2.714 . 0 0 "[ . 1]" 1 1337 1 254 THR H 1 256 SER H . . 4.200 4.173 3.856 4.310 0.110 6 0 "[ . 1]" 1 1338 1 254 THR HA 1 255 ARG H . . 3.610 3.427 3.244 3.526 . 0 0 "[ . 1]" 1 1339 1 254 THR HA 1 256 SER H . . 4.400 3.649 3.273 4.053 . 0 0 "[ . 1]" 1 1340 1 254 THR HB 1 255 ARG H . . 5.330 3.540 2.755 4.233 . 0 0 "[ . 1]" 1 1341 1 254 THR MG 1 256 SER H . . 6.000 4.440 4.187 4.782 . 0 0 "[ . 1]" 1 1342 1 255 ARG HA 1 256 SER H . . 5.120 3.427 3.244 3.506 . 0 0 "[ . 1]" 1 1343 1 255 ARG QB 1 256 SER H . . 6.000 3.086 2.792 3.530 . 0 0 "[ . 1]" 1 1344 1 259 LYS H 1 260 THR H . . 5.500 4.064 1.893 4.642 . 0 0 "[ . 1]" 1 1345 1 259 LYS HA 1 260 THR H . . 3.870 2.545 2.151 3.524 . 0 0 "[ . 1]" 1 1346 1 259 LYS QB 1 260 THR H . . 6.000 2.760 1.921 3.895 . 0 0 "[ . 1]" 1 1347 1 260 THR H 1 261 ARG H . . 4.070 3.990 2.705 4.366 0.296 8 0 "[ . 1]" 1 1348 1 260 THR HA 1 261 ARG H . . 3.290 2.503 2.144 3.546 0.256 7 0 "[ . 1]" 1 1349 1 260 THR HA 1 265 LYS H . . 5.100 4.845 3.233 5.376 0.276 7 0 "[ . 1]" 1 1350 1 260 THR HB 1 261 ARG H . . 3.890 3.071 1.879 4.150 0.260 6 0 "[ . 1]" 1 1351 1 260 THR MG 1 262 ARG H . . 6.000 4.603 1.842 6.164 0.164 8 0 "[ . 1]" 1 1352 1 261 ARG H 1 262 ARG H . . 3.750 2.928 2.084 4.013 0.263 8 0 "[ . 1]" 1 1353 1 261 ARG H 1 264 ILE HA . . 4.970 4.954 3.254 5.519 0.549 7 1 "[ . + 1]" 1 1354 1 261 ARG H 1 265 LYS H . . 5.500 3.933 2.760 5.219 . 0 0 "[ . 1]" 1 1355 1 261 ARG HA 1 262 ARG H . . 3.350 2.983 2.146 3.571 0.221 9 0 "[ . 1]" 1 1356 1 261 ARG QB 1 262 ARG H . . 4.750 3.234 1.978 3.859 . 0 0 "[ . 1]" 1 1357 1 261 ARG QB 1 263 SER H . . 4.210 3.457 2.687 4.373 0.163 1 0 "[ . 1]" 1 1358 1 261 ARG QD 1 263 SER H . . 6.000 5.150 2.879 6.078 0.078 5 0 "[ . 1]" 1 1359 1 261 ARG QG 1 263 SER H . . 6.000 4.734 2.464 6.209 0.209 5 0 "[ . 1]" 1 1360 1 262 ARG HA 1 263 SER H . . 4.170 3.198 2.798 3.569 . 0 0 "[ . 1]" 1 1361 1 262 ARG QB 1 263 SER H . . 4.690 3.400 2.318 4.048 . 0 0 "[ . 1]" 1 1362 1 263 SER H 1 264 ILE H . . 3.550 2.482 1.668 3.445 . 0 0 "[ . 1]" 1 1363 1 263 SER H 1 265 LYS H . . 5.500 3.993 2.724 5.455 . 0 0 "[ . 1]" 1 1364 1 263 SER HA 1 264 ILE H . . 3.370 3.029 2.527 3.557 0.187 6 0 "[ . 1]" 1 1365 1 263 SER QB 1 264 ILE H . . 4.520 3.414 1.957 4.002 . 0 0 "[ . 1]" 1 1366 1 263 SER QB 1 265 LYS H . . 5.500 4.750 3.298 5.556 0.056 6 0 "[ . 1]" 1 1367 1 264 ILE HA 1 265 LYS H . . 3.460 2.620 2.150 3.405 . 0 0 "[ . 1]" 1 1368 1 264 ILE HB 1 265 LYS H . . 4.820 4.391 4.091 4.542 . 0 0 "[ . 1]" 1 1369 1 264 ILE QG 1 266 ARG H . . 4.980 4.310 1.954 5.202 0.222 4 0 "[ . 1]" 1 1370 1 265 LYS H 1 266 ARG H . . 4.890 3.908 2.732 4.636 . 0 0 "[ . 1]" 1 1371 1 265 LYS H 1 266 ARG HA . . 5.500 5.492 5.083 5.750 0.250 5 0 "[ . 1]" 1 1372 1 265 LYS H 1 270 GLY H . . 5.500 5.611 5.399 6.078 0.578 7 1 "[ . + 1]" 1 1373 1 265 LYS QB 1 266 ARG H . . 4.010 3.237 1.911 4.016 0.006 7 0 "[ . 1]" 1 1374 1 266 ARG H 1 273 VAL H . . 5.500 5.653 5.387 5.984 0.484 5 0 "[ . 1]" 1 1375 1 266 ARG HE 1 269 LEU H . . 4.860 4.232 2.308 4.999 0.139 5 0 "[ . 1]" 1 1376 1 266 ARG QH1 1 269 LEU H . . 6.000 5.778 5.079 6.196 0.196 8 0 "[ . 1]" 1 1377 1 267 PRO HA 1 268 GLU H . . 3.360 2.476 2.152 3.191 . 0 0 "[ . 1]" 1 1378 1 267 PRO HA 1 272 ARG H . . 5.400 4.890 4.016 5.527 0.127 8 0 "[ . 1]" 1 1379 1 267 PRO HA 1 273 VAL H . . 4.000 3.075 2.134 4.024 0.024 2 0 "[ . 1]" 1 1380 1 267 PRO QB 1 268 GLU H . . 5.280 3.801 3.353 3.982 . 0 0 "[ . 1]" 1 1381 1 268 GLU H 1 269 LEU H . . 3.270 2.377 1.887 2.760 . 0 0 "[ . 1]" 1 1382 1 268 GLU H 1 272 ARG H . . 5.530 4.156 2.604 5.343 . 0 0 "[ . 1]" 1 1383 1 268 GLU H 1 273 VAL H . . 3.900 3.244 1.987 4.082 0.182 3 0 "[ . 1]" 1 1384 1 268 GLU H 1 273 VAL HA . . 3.900 3.815 3.252 4.118 0.218 8 0 "[ . 1]" 1 1385 1 268 GLU HA 1 269 LEU H . . 3.790 3.272 2.670 3.570 . 0 0 "[ . 1]" 1 1386 1 268 GLU HA 1 271 LEU H . . 5.500 4.849 3.921 5.789 0.289 5 0 "[ . 1]" 1 1387 1 268 GLU HA 1 273 VAL H . . 5.800 4.211 2.916 5.823 0.023 1 0 "[ . 1]" 1 1388 1 268 GLU QB 1 269 LEU H . . 4.460 3.092 2.118 3.970 . 0 0 "[ . 1]" 1 1389 1 268 GLU QB 1 270 GLY H . . 5.500 4.577 3.105 5.570 0.070 7 0 "[ . 1]" 1 1390 1 268 GLU QB 1 271 LEU H . . 6.000 4.488 3.020 5.816 . 0 0 "[ . 1]" 1 1391 1 268 GLU QG 1 270 GLY H . . 6.000 5.275 4.298 6.010 0.010 4 0 "[ . 1]" 1 1392 1 269 LEU H 1 270 GLY H . . 4.310 2.986 2.016 4.041 . 0 0 "[ . 1]" 1 1393 1 269 LEU H 1 270 GLY QA . . 6.000 4.642 3.957 5.174 . 0 0 "[ . 1]" 1 1394 1 269 LEU H 1 271 LEU H . . 4.370 3.880 2.773 4.426 0.056 10 0 "[ . 1]" 1 1395 1 269 LEU HA 1 270 GLY H . . 3.470 3.001 2.224 3.558 0.088 1 0 "[ . 1]" 1 1396 1 269 LEU HA 1 271 LEU H . . 4.270 4.180 3.569 4.594 0.324 7 0 "[ . 1]" 1 1397 1 269 LEU QB 1 270 GLY H . . 4.640 3.112 2.043 4.038 . 0 0 "[ . 1]" 1 1398 1 270 GLY H 1 271 LEU H . . 4.540 2.787 1.790 3.267 . 0 0 "[ . 1]" 1 1399 1 270 GLY H 1 272 ARG H . . 5.500 3.990 2.821 4.843 . 0 0 "[ . 1]" 1 1400 1 270 GLY QA 1 271 LEU H . . 3.870 2.760 2.569 2.911 . 0 0 "[ . 1]" 1 1401 1 270 GLY QA 1 272 ARG H . . 4.250 4.007 3.143 4.522 0.272 3 0 "[ . 1]" 1 1402 1 271 LEU H 1 272 ARG H . . 4.110 2.194 1.668 2.754 . 0 0 "[ . 1]" 1 1403 1 271 LEU H 1 273 VAL H . . 5.500 3.747 2.599 4.490 . 0 0 "[ . 1]" 1 1404 1 271 LEU HA 1 272 ARG H . . 3.560 3.112 2.641 3.571 0.011 3 0 "[ . 1]" 1 1405 1 271 LEU QB 1 272 ARG H . . 4.730 3.381 2.045 3.889 . 0 0 "[ . 1]" 1 1406 1 272 ARG H 1 273 VAL H . . 4.020 2.558 1.875 3.152 . 0 0 "[ . 1]" 1 1407 1 272 ARG H 1 273 VAL HA . . 5.400 4.733 3.981 5.105 . 0 0 "[ . 1]" 1 1408 1 272 ARG HA 1 273 VAL H . . 3.610 2.794 2.265 3.359 . 0 0 "[ . 1]" 1 1409 1 272 ARG QB 1 273 VAL H . . 6.000 3.752 3.226 3.998 . 0 0 "[ . 1]" 1 stop_ save_
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