NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
460517 | 2asy | 6868 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2asy 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 3279 _Distance_constraint_stats_list.Viol_count 7279 _Distance_constraint_stats_list.Viol_total 21528.871 _Distance_constraint_stats_list.Viol_max 1.907 _Distance_constraint_stats_list.Viol_rms 0.0804 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0164 _Distance_constraint_stats_list.Viol_average_violations_only 0.1479 _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 23 MET 9.480 1.548 20 4 "[ * -*1 . +]" 1 24 ALA 9.649 0.702 19 1 "[ . 1 . +2]" 1 25 THR 2.844 0.261 11 0 "[ . 1 . 2]" 1 26 LEU 2.831 0.262 8 0 "[ . 1 . 2]" 1 27 LEU 2.621 0.904 19 2 "[ -. 1 . +2]" 1 28 GLN 1.626 0.262 8 0 "[ . 1 . 2]" 1 29 LEU 10.450 0.321 9 0 "[ . 1 . 2]" 1 30 HIS 10.335 0.489 14 0 "[ . 1 . 2]" 1 31 PHE 12.932 0.411 6 0 "[ . 1 . 2]" 1 32 ALA 1.780 0.290 15 0 "[ . 1 . 2]" 1 33 PHE 1.055 0.115 4 0 "[ . 1 . 2]" 1 34 ASN 2.667 0.202 9 0 "[ . 1 . 2]" 1 35 GLY 5.536 0.340 16 0 "[ . 1 . 2]" 1 36 PRO 0.372 0.128 20 0 "[ . 1 . 2]" 1 37 PHE 8.344 0.340 16 0 "[ . 1 . 2]" 1 38 GLY 1.688 0.139 12 0 "[ . 1 . 2]" 1 39 ASP 1.648 0.137 12 0 "[ . 1 . 2]" 1 40 ALA 1.251 0.163 17 0 "[ . 1 . 2]" 1 41 MET 4.001 0.343 15 0 "[ . 1 . 2]" 1 42 ALA 9.894 0.609 18 4 "[ - . *1 . + *]" 1 43 GLU 10.318 0.848 12 5 "[ . * 1 + .*- *2]" 1 44 GLN 4.388 0.269 18 0 "[ . 1 . 2]" 1 45 LEU 23.816 0.848 12 14 "[* *** **1 +- ******]" 1 46 LYS 12.740 0.607 3 4 "[ + . 1 - ** 2]" 1 47 PRO 24.946 0.804 1 11 "[+***** *1- * * *]" 1 48 LEU 33.188 0.804 1 9 "[+* *** 1- * * *]" 1 49 ALA 25.264 0.607 3 4 "[ + . 1 - ** 2]" 1 50 GLU 0.203 0.063 19 0 "[ . 1 . 2]" 1 51 SER 3.517 0.143 14 0 "[ . 1 . 2]" 1 52 ILE 11.766 0.221 3 0 "[ . 1 . 2]" 1 53 ASN 6.879 0.215 2 0 "[ . 1 . 2]" 1 54 GLN 9.648 0.887 6 9 "[ * *+ *-1*** . *2]" 1 55 GLU 6.255 0.850 5 5 "[ + * * * - 2]" 1 56 PRO 2.109 0.549 17 1 "[ . 1 . + 2]" 1 57 GLY 11.155 0.767 18 3 "[ . 1 * . + -]" 1 58 PHE 9.842 0.767 18 4 "[ . 1 * . -+ *]" 1 59 LEU 10.157 0.199 12 0 "[ . 1 . 2]" 1 60 TRP 15.575 0.734 20 5 "[ * . * * - . +]" 1 61 LYS 12.241 0.814 6 5 "[ *+- *1 . * 2]" 1 62 VAL 0.202 0.039 9 0 "[ . 1 . 2]" 1 63 TRP 4.038 0.166 16 0 "[ . 1 . 2]" 1 64 THR 5.195 0.185 7 0 "[ . 1 . 2]" 1 65 GLU 10.793 0.764 6 7 "[ * .+ 1* .-***2]" 1 66 SER 3.203 0.207 17 0 "[ . 1 . 2]" 1 67 GLU 9.301 0.555 2 2 "[ + . 1 -. 2]" 1 68 LYS 30.922 0.991 15 14 "[ * -** *1** *+*****]" 1 69 ASN 3.398 0.614 11 2 "[ - 1+ . 2]" 1 70 HIS 14.332 0.991 15 13 "[ -** *1** *+*****]" 1 71 GLU 11.839 1.023 3 10 "[ *+*.* - ** *.* * 2]" 1 72 ALA 3.799 0.175 7 0 "[ . 1 . 2]" 1 73 GLY 16.321 1.023 3 10 "[ *+*.* - ** *.* * 2]" 1 74 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 75 ILE 3.278 0.489 14 0 "[ . 1 . 2]" 1 76 TYR 0.135 0.052 7 0 "[ . 1 . 2]" 1 77 LEU 2.510 0.169 17 0 "[ . 1 . 2]" 1 78 PHE 9.667 0.197 13 0 "[ . 1 . 2]" 1 79 THR 7.194 0.207 18 0 "[ . 1 . 2]" 1 80 ASP 8.716 0.719 5 1 "[ + 1 . 2]" 1 81 GLU 12.882 1.548 20 3 "[ . -*1 . +]" 1 82 LYS 23.624 0.558 13 5 "[ ** . -1 + . *]" 1 83 SER 10.873 0.558 13 5 "[ ** . -1 + . *]" 1 84 ALA 4.805 0.242 4 0 "[ . 1 . 2]" 1 85 LEU 15.989 0.383 6 0 "[ . 1 . 2]" 1 86 ALA 6.281 0.267 6 0 "[ . 1 . 2]" 1 87 TYR 9.439 0.551 9 1 "[ . +1 . 2]" 1 88 LEU 43.036 1.863 12 19 [****.******+*****-**] 1 89 GLU 35.566 1.863 12 19 [****.******+*****-**] 1 90 LYS 9.375 0.850 5 6 "[ + -* * * * 2]" 1 91 HIS 11.553 0.904 19 5 "[* *.* 1 - . +2]" 1 92 THR 45.995 0.865 11 20 [**********+********-] 1 93 ALA 0.903 0.154 15 0 "[ . 1 . 2]" 1 94 ARG 6.865 0.312 1 0 "[ . 1 . 2]" 1 95 LEU 21.768 1.007 9 7 "[ -* +1 *. * **]" 1 96 LYS 46.438 0.865 11 20 [**********+********-] 1 97 ASN 1.297 0.228 14 0 "[ . 1 . 2]" 1 98 LEU 11.476 0.303 14 0 "[ . 1 . 2]" 1 99 GLY 5.691 0.266 6 0 "[ . 1 . 2]" 1 100 VAL 6.198 0.321 9 0 "[ . 1 . 2]" 1 101 GLU 9.026 0.321 9 0 "[ . 1 . 2]" 1 102 GLU 2.738 0.186 11 0 "[ . 1 . 2]" 1 103 VAL 21.770 1.007 9 7 "[ *- +1 *. * **]" 1 104 VAL 5.762 0.199 17 0 "[ . 1 . 2]" 1 105 ALA 1.718 0.188 14 0 "[ . 1 . 2]" 1 106 LYS 0.878 0.099 4 0 "[ . 1 . 2]" 1 107 VAL 3.133 0.734 17 1 "[ . 1 . + 2]" 1 108 PHE 5.730 0.734 17 1 "[ . 1 . + 2]" 1 109 ASP 0.861 0.145 2 0 "[ . 1 . 2]" 1 110 VAL 0.809 0.072 9 0 "[ . 1 . 2]" 1 111 ASN 4.068 0.330 15 0 "[ . 1 . 2]" 1 112 GLU 14.728 0.826 10 14 "[* **.- * +** **** **]" 1 113 PRO 15.196 0.826 10 15 "[* **.* *-+** **** **]" 1 114 LEU 16.022 0.927 10 5 "[* * + * . - 2]" 1 115 SER 1.244 0.169 10 0 "[ . 1 . 2]" 1 116 GLN 0.369 0.086 7 0 "[ . 1 . 2]" 1 117 ILE 7.572 0.303 12 0 "[ . 1 . 2]" 1 118 ASN 4.109 0.214 19 0 "[ . 1 . 2]" 1 119 GLN 15.946 0.801 18 5 "[ *- * 1 * . + 2]" 1 120 ALA 7.603 0.812 18 4 "[ *- *1 . + 2]" 1 121 LYS 16.209 1.711 20 9 "[ ** .* 1* **-* +]" 1 122 LEU 5.015 0.309 20 0 "[ . 1 . 2]" 1 123 ALA 13.178 1.711 20 9 "[ ** .* 1- **** +]" 2 23 MET 17.040 1.616 20 8 "[ * **1 *- .* *+]" 2 24 ALA 6.495 0.256 12 0 "[ . 1 . 2]" 2 25 THR 2.191 0.184 11 0 "[ . 1 . 2]" 2 26 LEU 2.928 0.269 16 0 "[ . 1 . 2]" 2 27 LEU 2.779 0.990 19 2 "[ -. 1 . +2]" 2 28 GLN 1.897 0.269 16 0 "[ . 1 . 2]" 2 29 LEU 10.582 0.325 9 0 "[ . 1 . 2]" 2 30 HIS 10.372 0.539 14 1 "[ . 1 +. 2]" 2 31 PHE 15.620 0.656 17 2 "[ . 1 . + -2]" 2 32 ALA 2.057 0.199 13 0 "[ . 1 . 2]" 2 33 PHE 1.334 0.119 4 0 "[ . 1 . 2]" 2 34 ASN 2.684 0.182 9 0 "[ . 1 . 2]" 2 35 GLY 5.048 0.327 14 0 "[ . 1 . 2]" 2 36 PRO 0.437 0.134 20 0 "[ . 1 . 2]" 2 37 PHE 7.585 0.327 14 0 "[ . 1 . 2]" 2 38 GLY 1.614 0.147 13 0 "[ . 1 . 2]" 2 39 ASP 1.739 0.122 4 0 "[ . 1 . 2]" 2 40 ALA 1.424 0.178 17 0 "[ . 1 . 2]" 2 41 MET 4.143 0.237 16 0 "[ . 1 . 2]" 2 42 ALA 4.684 0.503 9 1 "[ . +1 . 2]" 2 43 GLU 2.885 0.138 16 0 "[ . 1 . 2]" 2 44 GLN 4.212 0.297 3 0 "[ . 1 . 2]" 2 45 LEU 9.008 0.433 4 0 "[ . 1 . 2]" 2 46 LYS 15.859 0.927 10 5 "[* * + * . - 2]" 2 47 PRO 15.718 0.584 4 6 "[** +. 1 * -* 2]" 2 48 LEU 30.978 0.584 4 6 "[** +. 1 * -* 2]" 2 49 ALA 20.580 0.390 4 0 "[ . 1 . 2]" 2 50 GLU 0.078 0.027 4 0 "[ . 1 . 2]" 2 51 SER 2.938 0.103 14 0 "[ . 1 . 2]" 2 52 ILE 14.240 0.377 1 0 "[ . 1 . 2]" 2 53 ASN 14.435 0.926 1 5 "[+ * . 1-* .* 2]" 2 54 GLN 12.851 0.926 1 10 "[+ *** - *1** .* *2]" 2 55 GLU 6.435 0.898 5 5 "[ + * * * - 2]" 2 56 PRO 2.095 0.496 17 0 "[ . 1 . 2]" 2 57 GLY 11.165 0.779 12 3 "[ . 1 + . * -]" 2 58 PHE 9.576 0.779 12 3 "[ . 1 + . * -]" 2 59 LEU 10.025 0.194 18 0 "[ . 1 . 2]" 2 60 TRP 13.015 0.532 4 1 "[ +. 1 . 2]" 2 61 LYS 14.481 0.812 18 6 "[ -** *1 * . + 2]" 2 62 VAL 0.199 0.067 7 0 "[ . 1 . 2]" 2 63 TRP 4.217 0.184 16 0 "[ . 1 . 2]" 2 64 THR 7.863 0.330 15 0 "[ . 1 . 2]" 2 65 GLU 3.998 0.287 17 0 "[ . 1 . 2]" 2 66 SER 3.612 0.237 17 0 "[ . 1 . 2]" 2 67 GLU 8.358 0.561 2 1 "[ + . 1 . 2]" 2 68 LYS 31.531 0.965 11 16 "[****** **+- ******2]" 2 69 ASN 4.018 0.717 11 2 "[ - 1+ . 2]" 2 70 HIS 14.421 0.965 11 15 "[* -*** **+* ******2]" 2 71 GLU 11.708 1.018 3 9 "[ *+*.* ** *.* -]" 2 72 ALA 3.588 0.174 4 0 "[ . 1 . 2]" 2 73 GLY 16.209 1.018 3 9 "[ *+*.* ** *.* -]" 2 74 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 2 75 ILE 2.817 0.539 14 1 "[ . 1 +. 2]" 2 76 TYR 0.077 0.033 8 0 "[ . 1 . 2]" 2 77 LEU 2.653 0.341 17 0 "[ . 1 . 2]" 2 78 PHE 9.291 0.228 9 0 "[ . 1 . 2]" 2 79 THR 7.140 0.194 18 0 "[ . 1 . 2]" 2 80 ASP 12.030 0.951 19 4 "[ . *1 *- . +2]" 2 81 GLU 16.546 1.616 20 5 "[ * **1 .- +]" 2 82 LYS 23.870 0.594 13 6 "[ -. * 1 + .* * *]" 2 83 SER 9.994 0.594 13 6 "[ -. * 1 + .* * *]" 2 84 ALA 4.915 0.266 12 0 "[ . 1 . 2]" 2 85 LEU 16.388 0.398 6 0 "[ . 1 . 2]" 2 86 ALA 6.328 0.268 6 0 "[ . 1 . 2]" 2 87 TYR 11.730 1.008 3 2 "[ + . -1 . 2]" 2 88 LEU 44.940 1.907 14 20 [***-*********+******] 2 89 GLU 37.174 1.907 14 20 [***-*********+******] 2 90 LYS 11.155 1.008 3 7 "[ + * -* * * * 2]" 2 91 HIS 11.293 0.990 19 4 "[* *. 1 - . +2]" 2 92 THR 44.706 0.842 17 20 [*****-**********+***] 2 93 ALA 0.937 0.143 8 0 "[ . 1 . 2]" 2 94 ARG 6.641 0.315 9 0 "[ . 1 . 2]" 2 95 LEU 22.344 1.097 4 8 "[** +. -**1 * .* 2]" 2 96 LYS 47.004 0.842 17 20 [*****-**********+***] 2 97 ASN 1.632 0.196 14 0 "[ . 1 . 2]" 2 98 LEU 10.787 0.275 17 0 "[ . 1 . 2]" 2 99 GLY 5.478 0.275 17 0 "[ . 1 . 2]" 2 100 VAL 7.897 0.656 17 2 "[ . 1 . + -2]" 2 101 GLU 8.056 0.327 2 0 "[ . 1 . 2]" 2 102 GLU 2.247 0.153 11 0 "[ . 1 . 2]" 2 103 VAL 23.733 1.097 4 8 "[** +. *-*1 * .* 2]" 2 104 VAL 5.900 0.208 8 0 "[ . 1 . 2]" 2 105 ALA 1.704 0.212 14 0 "[ . 1 . 2]" 2 106 LYS 1.301 0.204 7 0 "[ . 1 . 2]" 2 107 VAL 2.345 0.204 7 0 "[ . 1 . 2]" 2 108 PHE 9.079 0.764 6 7 "[ * .+ 1* .-***2]" 2 109 ASP 1.477 0.208 2 0 "[ . 1 . 2]" 2 110 VAL 0.935 0.126 11 0 "[ . 1 . 2]" 2 111 ASN 3.197 0.131 12 0 "[ . 1 . 2]" 2 112 GLU 14.756 0.791 19 13 "[* **.* *** ***- +*]" 2 113 PRO 14.892 0.791 19 14 "[* **.* **** ***- +*]" 2 114 LEU 10.887 0.343 15 0 "[ . 1 . 2]" 2 115 SER 1.410 0.207 10 0 "[ . 1 . 2]" 2 116 GLN 0.270 0.106 7 0 "[ . 1 . 2]" 2 117 ILE 7.272 0.280 12 0 "[ . 1 . 2]" 2 118 ASN 3.696 0.237 16 0 "[ . 1 . 2]" 2 119 GLN 10.601 0.629 18 2 "[ . - 1 . + 2]" 2 120 ALA 7.267 0.814 6 4 "[ *+ *1 . - 2]" 2 121 LYS 27.990 1.577 6 15 "[* * -+* ** ********]" 2 122 LEU 7.874 0.734 20 5 "[ * . * * - . +]" 2 123 ALA 15.625 1.577 6 15 "[* * -+* ** ********]" 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 23 MET HA 1 23 MET QG . . 3.630 2.714 2.411 2.991 . 0 0 "[ . 1 . 2]" 1 2 1 23 MET HA 1 24 ALA H . . 3.500 3.243 3.009 3.421 . 0 0 "[ . 1 . 2]" 1 3 1 23 MET HA 1 24 ALA HA . . 5.500 5.108 4.876 5.268 . 0 0 "[ . 1 . 2]" 1 4 1 23 MET HA 1 24 ALA MB . . 4.550 3.948 3.734 4.093 . 0 0 "[ . 1 . 2]" 1 5 1 23 MET QB 1 24 ALA H . . 4.440 3.228 2.729 3.599 . 0 0 "[ . 1 . 2]" 1 6 1 23 MET QB 1 24 ALA HA . . 5.500 4.822 4.418 5.224 . 0 0 "[ . 1 . 2]" 1 7 1 23 MET QB 1 24 ALA MB . . 4.550 4.426 4.186 4.539 . 0 0 "[ . 1 . 2]" 1 8 1 23 MET QB 1 80 ASP HA . . 4.220 2.682 2.114 3.376 . 0 0 "[ . 1 . 2]" 1 9 1 23 MET QG 1 80 ASP QB . . 4.760 4.087 3.260 5.479 0.719 5 1 "[ + 1 . 2]" 1 10 1 23 MET QG 1 81 GLU H . . 5.340 4.935 3.799 6.888 1.548 20 1 "[ . 1 . +]" 1 11 1 23 MET QG 1 81 GLU QG . . 4.760 4.498 3.407 6.286 1.526 20 3 "[ . -*1 . +]" 1 12 1 23 MET HG2 1 24 ALA H . . 5.500 5.107 4.389 5.663 0.163 16 0 "[ . 1 . 2]" 1 13 1 23 MET HG3 1 24 ALA H . . 5.500 5.123 4.346 5.712 0.212 4 0 "[ . 1 . 2]" 1 14 1 24 ALA H 1 24 ALA HA . . 2.910 2.246 2.220 2.271 . 0 0 "[ . 1 . 2]" 1 15 1 24 ALA H 1 24 ALA MB . . 3.010 2.899 2.823 2.964 . 0 0 "[ . 1 . 2]" 1 16 1 24 ALA H 1 25 THR HB . . 5.500 4.952 4.750 5.308 . 0 0 "[ . 1 . 2]" 1 17 1 24 ALA H 1 58 PHE HB2 . . 5.500 5.446 5.231 5.788 0.288 12 0 "[ . 1 . 2]" 1 18 1 24 ALA H 1 58 PHE HB3 . . 5.500 5.470 4.526 5.617 0.117 3 0 "[ . 1 . 2]" 1 19 1 24 ALA H 1 59 LEU QD . . 4.560 1.919 1.717 2.151 . 0 0 "[ . 1 . 2]" 1 20 1 24 ALA H 1 77 LEU HG . . 5.320 4.983 4.650 5.324 0.004 9 0 "[ . 1 . 2]" 1 21 1 24 ALA H 1 79 THR HA . . 4.420 3.472 3.131 3.809 . 0 0 "[ . 1 . 2]" 1 22 1 24 ALA H 1 80 ASP H . . 5.500 5.446 5.180 5.631 0.131 5 0 "[ . 1 . 2]" 1 23 1 24 ALA H 1 80 ASP HA . . 5.500 5.190 4.787 5.647 0.147 5 0 "[ . 1 . 2]" 1 24 1 24 ALA H 2 121 LYS QE . . 5.340 5.151 4.672 5.563 0.223 8 0 "[ . 1 . 2]" 1 25 1 24 ALA H 2 121 LYS QG . . 5.340 5.375 4.968 5.571 0.231 8 0 "[ . 1 . 2]" 1 26 1 24 ALA HA 1 25 THR H . . 2.860 2.783 2.350 2.917 0.057 7 0 "[ . 1 . 2]" 1 27 1 24 ALA HA 1 25 THR HA . . 5.500 4.682 4.464 4.769 . 0 0 "[ . 1 . 2]" 1 28 1 24 ALA HA 1 59 LEU HA . . 5.500 5.567 5.519 5.612 0.112 8 0 "[ . 1 . 2]" 1 29 1 24 ALA HA 1 59 LEU QB . . 4.530 3.521 3.384 3.652 . 0 0 "[ . 1 . 2]" 1 30 1 24 ALA HA 1 59 LEU MD1 . . 3.780 3.196 3.029 3.384 . 0 0 "[ . 1 . 2]" 1 31 1 24 ALA HA 1 59 LEU MD2 . . 3.780 2.432 2.156 2.665 . 0 0 "[ . 1 . 2]" 1 32 1 24 ALA HA 1 59 LEU HG . . 3.130 1.903 1.807 1.976 . 0 0 "[ . 1 . 2]" 1 33 1 24 ALA HA 1 77 LEU HA . . 5.500 4.576 4.361 4.775 . 0 0 "[ . 1 . 2]" 1 34 1 24 ALA HA 1 77 LEU MD2 . . 3.990 2.166 1.917 2.507 . 0 0 "[ . 1 . 2]" 1 35 1 24 ALA HA 1 77 LEU HG . . 4.160 2.962 2.677 3.214 . 0 0 "[ . 1 . 2]" 1 36 1 24 ALA HA 1 78 PHE H . . 5.160 4.383 4.078 4.561 . 0 0 "[ . 1 . 2]" 1 37 1 24 ALA HA 1 79 THR HA . . 5.500 4.966 4.263 5.336 . 0 0 "[ . 1 . 2]" 1 38 1 24 ALA HA 2 121 LYS QB . . 5.340 5.158 4.827 5.399 0.059 20 0 "[ . 1 . 2]" 1 39 1 24 ALA HA 2 121 LYS QD . . 5.340 4.549 3.004 5.386 0.046 4 0 "[ . 1 . 2]" 1 40 1 24 ALA HA 2 121 LYS HG2 . . 5.500 5.076 3.865 6.202 0.702 19 1 "[ . 1 . +2]" 1 41 1 24 ALA HA 2 121 LYS HG3 . . 5.500 4.743 3.801 5.594 0.094 3 0 "[ . 1 . 2]" 1 42 1 24 ALA MB 1 25 THR H . . 4.220 3.664 3.634 3.714 . 0 0 "[ . 1 . 2]" 1 43 1 24 ALA MB 1 25 THR HA . . 4.840 4.343 4.282 4.408 . 0 0 "[ . 1 . 2]" 1 44 1 24 ALA MB 1 77 LEU QB . . 4.500 3.737 3.480 3.880 . 0 0 "[ . 1 . 2]" 1 45 1 24 ALA MB 1 77 LEU MD2 . . 2.690 1.971 1.799 2.076 . 0 0 "[ . 1 . 2]" 1 46 1 24 ALA MB 1 77 LEU HG . . 4.430 3.263 3.081 3.375 . 0 0 "[ . 1 . 2]" 1 47 1 25 THR H 1 25 THR HB . . 3.390 2.509 2.378 2.613 . 0 0 "[ . 1 . 2]" 1 48 1 25 THR H 1 25 THR MG . . 3.970 3.690 3.603 3.753 . 0 0 "[ . 1 . 2]" 1 49 1 25 THR H 1 26 LEU H . . 5.500 4.564 4.463 4.632 . 0 0 "[ . 1 . 2]" 1 50 1 25 THR H 1 59 LEU MD1 . . 4.840 4.754 4.619 4.865 0.025 7 0 "[ . 1 . 2]" 1 51 1 25 THR H 1 59 LEU QD . . 4.200 3.009 2.790 3.172 . 0 0 "[ . 1 . 2]" 1 52 1 25 THR H 1 59 LEU MD2 . . 4.840 3.044 2.808 3.216 . 0 0 "[ . 1 . 2]" 1 53 1 25 THR H 1 59 LEU HG . . 4.700 4.295 4.071 4.482 . 0 0 "[ . 1 . 2]" 1 54 1 25 THR H 1 77 LEU MD2 . . 5.140 4.314 3.931 4.569 . 0 0 "[ . 1 . 2]" 1 55 1 25 THR H 1 77 LEU HG . . 3.940 3.841 3.385 3.988 0.048 13 0 "[ . 1 . 2]" 1 56 1 25 THR H 1 78 PHE H . . 5.490 3.478 2.959 3.729 . 0 0 "[ . 1 . 2]" 1 57 1 25 THR H 1 79 THR H . . 5.500 5.283 4.912 5.527 0.027 18 0 "[ . 1 . 2]" 1 58 1 25 THR H 1 79 THR HA . . 5.500 4.362 4.144 4.689 . 0 0 "[ . 1 . 2]" 1 59 1 25 THR H 1 80 ASP H . . 5.500 4.368 4.157 4.505 . 0 0 "[ . 1 . 2]" 1 60 1 25 THR H 1 81 GLU QG . . 5.340 5.414 4.948 5.601 0.261 11 0 "[ . 1 . 2]" 1 61 1 25 THR HA 1 25 THR MG . . 2.980 2.324 2.248 2.402 . 0 0 "[ . 1 . 2]" 1 62 1 25 THR HA 1 26 LEU H . . 3.230 2.253 2.194 2.325 . 0 0 "[ . 1 . 2]" 1 63 1 25 THR HA 1 26 LEU QB . . 5.220 4.056 3.993 4.114 . 0 0 "[ . 1 . 2]" 1 64 1 25 THR HA 1 77 LEU MD1 . . 5.500 4.937 4.661 5.076 . 0 0 "[ . 1 . 2]" 1 65 1 25 THR HA 1 77 LEU HG . . 5.150 4.153 3.951 4.293 . 0 0 "[ . 1 . 2]" 1 66 1 25 THR HA 1 80 ASP HA . . 5.500 5.048 4.644 5.609 0.109 13 0 "[ . 1 . 2]" 1 67 1 25 THR HB 1 26 LEU H . . 4.630 3.970 3.821 4.126 . 0 0 "[ . 1 . 2]" 1 68 1 25 THR HB 1 59 LEU QD . . 5.440 4.229 4.067 4.366 . 0 0 "[ . 1 . 2]" 1 69 1 25 THR HB 1 78 PHE H . . 4.710 2.986 2.752 3.204 . 0 0 "[ . 1 . 2]" 1 70 1 25 THR HB 1 78 PHE HB2 . . 5.500 3.917 3.814 4.007 . 0 0 "[ . 1 . 2]" 1 71 1 25 THR HB 1 78 PHE HB3 . . 3.710 2.784 2.642 2.942 . 0 0 "[ . 1 . 2]" 1 72 1 25 THR HB 1 78 PHE HD2 . . 5.500 4.514 4.292 4.725 . 0 0 "[ . 1 . 2]" 1 73 1 25 THR HB 1 80 ASP HA . . 4.490 3.263 2.608 3.916 . 0 0 "[ . 1 . 2]" 1 74 1 25 THR HB 1 81 GLU H . . 5.400 4.397 3.951 4.803 . 0 0 "[ . 1 . 2]" 1 75 1 25 THR HB 1 81 GLU HA . . 5.500 3.988 3.827 4.206 . 0 0 "[ . 1 . 2]" 1 76 1 25 THR HB 1 81 GLU QB . . 5.340 4.564 3.917 5.360 0.020 4 0 "[ . 1 . 2]" 1 77 1 25 THR HB 1 81 GLU QG . . 5.340 4.167 3.741 4.560 . 0 0 "[ . 1 . 2]" 1 78 1 25 THR HB 1 107 VAL MG1 . . 5.500 4.456 4.160 4.676 . 0 0 "[ . 1 . 2]" 1 79 1 25 THR MG 1 26 LEU H . . 2.740 2.441 2.238 2.631 . 0 0 "[ . 1 . 2]" 1 80 1 25 THR MG 1 26 LEU HA . . 5.500 3.931 3.820 4.088 . 0 0 "[ . 1 . 2]" 1 81 1 25 THR MG 1 26 LEU QB . . 5.340 3.950 3.724 4.096 . 0 0 "[ . 1 . 2]" 1 82 1 25 THR MG 1 77 LEU HA . . 5.500 4.787 4.589 5.025 . 0 0 "[ . 1 . 2]" 1 83 1 25 THR MG 1 78 PHE H . . 4.980 3.972 3.760 4.198 . 0 0 "[ . 1 . 2]" 1 84 1 25 THR MG 1 80 ASP H . . 4.990 4.222 3.983 4.445 . 0 0 "[ . 1 . 2]" 1 85 1 25 THR MG 1 80 ASP HA . . 5.490 3.459 3.031 3.919 . 0 0 "[ . 1 . 2]" 1 86 1 25 THR MG 1 81 GLU H . . 4.730 3.124 2.700 3.536 . 0 0 "[ . 1 . 2]" 1 87 1 25 THR MG 1 81 GLU HA . . 5.500 2.226 1.923 2.637 . 0 0 "[ . 1 . 2]" 1 88 1 25 THR MG 1 81 GLU QB . . 4.570 2.225 1.680 3.041 . 0 0 "[ . 1 . 2]" 1 89 1 25 THR MG 1 81 GLU HG2 . . 3.560 2.586 1.762 3.433 . 0 0 "[ . 1 . 2]" 1 90 1 25 THR MG 1 81 GLU HG3 . . 3.560 2.900 2.153 3.670 0.110 15 0 "[ . 1 . 2]" 1 91 1 25 THR MG 1 107 VAL HA . . 5.180 4.300 3.991 4.708 . 0 0 "[ . 1 . 2]" 1 92 1 25 THR MG 1 107 VAL HB . . 5.500 4.431 4.081 4.893 . 0 0 "[ . 1 . 2]" 1 93 1 26 LEU H 1 26 LEU QB . . 2.890 2.311 2.255 2.357 . 0 0 "[ . 1 . 2]" 1 94 1 26 LEU H 1 27 LEU H . . 4.840 4.360 4.305 4.392 . 0 0 "[ . 1 . 2]" 1 95 1 26 LEU H 1 27 LEU QB . . 5.480 4.787 4.726 4.887 . 0 0 "[ . 1 . 2]" 1 96 1 26 LEU H 1 77 LEU MD1 . . 4.350 4.233 3.968 4.376 0.026 4 0 "[ . 1 . 2]" 1 97 1 26 LEU H 1 78 PHE H . . 5.500 4.757 4.659 4.879 . 0 0 "[ . 1 . 2]" 1 98 1 26 LEU HA 1 26 LEU MD1 . . 3.940 2.103 2.060 2.141 . 0 0 "[ . 1 . 2]" 1 99 1 26 LEU HA 1 26 LEU HG . . 3.190 3.090 2.988 3.144 . 0 0 "[ . 1 . 2]" 1 100 1 26 LEU HA 1 27 LEU HA . . 4.590 4.309 4.275 4.351 . 0 0 "[ . 1 . 2]" 1 101 1 26 LEU HA 1 27 LEU QB . . 5.500 3.879 3.832 3.951 . 0 0 "[ . 1 . 2]" 1 102 1 26 LEU HA 1 75 ILE MG . . 5.050 4.068 3.776 4.264 . 0 0 "[ . 1 . 2]" 1 103 1 26 LEU HA 1 77 LEU HA . . 5.500 2.389 2.241 2.802 . 0 0 "[ . 1 . 2]" 1 104 1 26 LEU HA 1 77 LEU MD1 . . 3.250 2.393 2.142 2.548 . 0 0 "[ . 1 . 2]" 1 105 1 26 LEU HA 1 77 LEU HG . . 3.680 3.216 3.068 3.483 . 0 0 "[ . 1 . 2]" 1 106 1 26 LEU HA 1 78 PHE H . . 5.500 3.538 3.250 3.873 . 0 0 "[ . 1 . 2]" 1 107 1 26 LEU QB 1 108 PHE H . . 5.340 4.667 3.401 5.125 . 0 0 "[ . 1 . 2]" 1 108 1 26 LEU HB2 1 26 LEU MD1 . . 3.330 2.338 2.296 2.369 . 0 0 "[ . 1 . 2]" 1 109 1 26 LEU HB3 1 26 LEU MD1 . . 3.330 3.196 3.182 3.209 . 0 0 "[ . 1 . 2]" 1 110 1 26 LEU MD1 1 27 LEU H . . 2.670 2.463 2.281 2.699 0.029 4 0 "[ . 1 . 2]" 1 111 1 26 LEU MD1 1 27 LEU HA . . 5.020 4.478 4.378 4.658 . 0 0 "[ . 1 . 2]" 1 112 1 26 LEU MD1 1 28 GLN HA . . 5.500 5.060 4.896 5.270 . 0 0 "[ . 1 . 2]" 1 113 1 26 LEU MD1 1 75 ILE HA . . 4.670 4.208 3.930 4.517 . 0 0 "[ . 1 . 2]" 1 114 1 26 LEU MD1 1 75 ILE HB . . 5.500 3.220 2.943 3.603 . 0 0 "[ . 1 . 2]" 1 115 1 26 LEU MD1 1 75 ILE MG . . 2.440 1.859 1.772 1.949 . 0 0 "[ . 1 . 2]" 1 116 1 26 LEU MD1 1 76 TYR QB . . 5.340 4.288 4.020 4.948 . 0 0 "[ . 1 . 2]" 1 117 1 26 LEU MD1 1 77 LEU H . . 5.040 3.785 3.456 4.570 . 0 0 "[ . 1 . 2]" 1 118 1 26 LEU MD1 1 77 LEU HA . . 4.340 3.239 2.994 3.710 . 0 0 "[ . 1 . 2]" 1 119 1 26 LEU MD1 1 77 LEU QB . . 5.340 4.185 4.031 4.702 . 0 0 "[ . 1 . 2]" 1 120 1 26 LEU MD1 1 77 LEU MD1 . . 2.770 1.894 1.803 2.207 . 0 0 "[ . 1 . 2]" 1 121 1 26 LEU MD1 1 77 LEU MD2 . . 5.500 4.089 3.869 4.265 . 0 0 "[ . 1 . 2]" 1 122 1 26 LEU MD2 1 28 GLN HG3 . . 5.500 5.409 4.778 5.762 0.262 8 0 "[ . 1 . 2]" 1 123 1 26 LEU MD2 1 108 PHE QD . . 5.500 3.892 2.187 4.274 . 0 0 "[ . 1 . 2]" 1 124 1 26 LEU HG 1 27 LEU H . . 3.830 3.112 3.004 3.223 . 0 0 "[ . 1 . 2]" 1 125 1 26 LEU HG 1 27 LEU HA . . 3.720 3.776 3.740 3.812 0.092 6 0 "[ . 1 . 2]" 1 126 1 26 LEU HG 1 27 LEU QB . . 5.460 4.872 4.818 4.916 . 0 0 "[ . 1 . 2]" 1 127 1 26 LEU HG 1 28 GLN HG3 . . 5.360 4.923 4.467 5.268 . 0 0 "[ . 1 . 2]" 1 128 1 26 LEU HG 1 75 ILE HB . . 5.500 4.788 4.478 5.237 . 0 0 "[ . 1 . 2]" 1 129 1 26 LEU HG 1 75 ILE QG . . 5.340 5.200 4.967 5.338 . 0 0 "[ . 1 . 2]" 1 130 1 26 LEU HG 1 75 ILE MG . . 3.020 2.363 2.173 2.593 . 0 0 "[ . 1 . 2]" 1 131 1 26 LEU HG 1 77 LEU HA . . 5.500 5.231 5.057 5.543 0.043 4 0 "[ . 1 . 2]" 1 132 1 26 LEU HG 1 107 VAL HA . . 5.500 5.407 4.923 5.613 0.113 10 0 "[ . 1 . 2]" 1 133 1 26 LEU HG 1 108 PHE QD . . 5.500 4.510 2.271 5.078 . 0 0 "[ . 1 . 2]" 1 134 1 27 LEU H 1 27 LEU QB . . 3.190 2.527 2.446 2.574 . 0 0 "[ . 1 . 2]" 1 135 1 27 LEU H 1 27 LEU QD . . 5.050 2.897 2.587 3.544 . 0 0 "[ . 1 . 2]" 1 136 1 27 LEU H 1 27 LEU HG . . 5.500 3.968 3.859 4.116 . 0 0 "[ . 1 . 2]" 1 137 1 27 LEU H 1 28 GLN H . . 4.680 4.332 4.274 4.361 . 0 0 "[ . 1 . 2]" 1 138 1 27 LEU H 1 75 ILE MG . . 5.310 3.242 2.975 3.407 . 0 0 "[ . 1 . 2]" 1 139 1 27 LEU H 1 77 LEU MD1 . . 5.500 3.687 3.171 3.935 . 0 0 "[ . 1 . 2]" 1 140 1 27 LEU H 1 78 PHE H . . 5.500 3.928 3.718 4.263 . 0 0 "[ . 1 . 2]" 1 141 1 27 LEU HA 1 27 LEU QD . . 4.170 3.325 2.995 3.392 . 0 0 "[ . 1 . 2]" 1 142 1 27 LEU HA 1 28 GLN H . . 3.050 2.140 2.078 2.178 . 0 0 "[ . 1 . 2]" 1 143 1 27 LEU HA 1 28 GLN HG3 . . 5.170 3.513 3.284 3.774 . 0 0 "[ . 1 . 2]" 1 144 1 27 LEU HA 1 84 ALA MB . . 5.010 4.547 4.237 4.805 . 0 0 "[ . 1 . 2]" 1 145 1 27 LEU HA 1 107 VAL H . . 5.490 5.108 4.883 5.264 . 0 0 "[ . 1 . 2]" 1 146 1 27 LEU HA 1 107 VAL HA . . 5.010 2.516 2.312 2.679 . 0 0 "[ . 1 . 2]" 1 147 1 27 LEU HA 1 107 VAL MG1 . . 4.010 3.438 3.221 3.669 . 0 0 "[ . 1 . 2]" 1 148 1 27 LEU HA 1 107 VAL MG2 . . 5.470 3.223 2.846 3.489 . 0 0 "[ . 1 . 2]" 1 149 1 27 LEU HA 1 108 PHE H . . 5.140 3.555 3.002 3.921 . 0 0 "[ . 1 . 2]" 1 150 1 27 LEU QB 1 27 LEU QD . . 2.700 1.870 1.849 1.892 . 0 0 "[ . 1 . 2]" 1 151 1 27 LEU QB 1 28 GLN H . . 5.140 3.124 2.968 3.485 . 0 0 "[ . 1 . 2]" 1 152 1 27 LEU QB 1 75 ILE MG . . 5.500 4.554 4.350 4.684 . 0 0 "[ . 1 . 2]" 1 153 1 27 LEU QB 1 78 PHE HB2 . . 4.710 2.565 2.093 2.929 . 0 0 "[ . 1 . 2]" 1 154 1 27 LEU QB 1 78 PHE HB3 . . 5.500 3.460 3.117 3.564 . 0 0 "[ . 1 . 2]" 1 155 1 27 LEU QB 1 78 PHE HD2 . . 5.500 4.963 4.637 5.281 . 0 0 "[ . 1 . 2]" 1 156 1 27 LEU QB 1 81 GLU HA . . 5.020 4.255 4.076 4.413 . 0 0 "[ . 1 . 2]" 1 157 1 27 LEU QB 1 84 ALA HA . . 5.500 4.667 4.398 4.890 . 0 0 "[ . 1 . 2]" 1 158 1 27 LEU QB 1 84 ALA MB . . 3.090 2.601 2.288 2.793 . 0 0 "[ . 1 . 2]" 1 159 1 27 LEU QB 1 106 LYS H . . 5.500 4.621 4.321 4.934 . 0 0 "[ . 1 . 2]" 1 160 1 27 LEU QB 1 107 VAL HA . . 4.910 3.212 2.945 3.584 . 0 0 "[ . 1 . 2]" 1 161 1 27 LEU QB 1 107 VAL HB . . 5.500 4.880 4.656 5.384 . 0 0 "[ . 1 . 2]" 1 162 1 27 LEU QB 1 107 VAL MG2 . . 2.800 2.160 1.979 2.763 . 0 0 "[ . 1 . 2]" 1 163 1 27 LEU QD 1 28 GLN H . . 4.470 3.316 3.081 3.403 . 0 0 "[ . 1 . 2]" 1 164 1 27 LEU QD 1 28 GLN HB2 . . 5.500 4.338 4.216 4.455 . 0 0 "[ . 1 . 2]" 1 165 1 27 LEU QD 1 29 LEU H . . 5.160 3.942 3.798 4.123 . 0 0 "[ . 1 . 2]" 1 166 1 27 LEU QD 1 29 LEU HB2 . . 5.500 2.080 1.960 2.246 . 0 0 "[ . 1 . 2]" 1 167 1 27 LEU QD 1 29 LEU QB . . 4.600 2.044 1.927 2.206 . 0 0 "[ . 1 . 2]" 1 168 1 27 LEU QD 1 29 LEU HB3 . . 5.500 3.018 2.828 3.227 . 0 0 "[ . 1 . 2]" 1 169 1 27 LEU QD 1 29 LEU QD . . 5.440 1.994 1.756 2.184 . 0 0 "[ . 1 . 2]" 1 170 1 27 LEU QD 1 29 LEU HG . . 5.500 3.165 2.710 3.755 . 0 0 "[ . 1 . 2]" 1 171 1 27 LEU QD 1 78 PHE H . . 5.360 3.774 3.614 3.988 . 0 0 "[ . 1 . 2]" 1 172 1 27 LEU QD 1 78 PHE HA . . 5.500 3.867 3.720 4.093 . 0 0 "[ . 1 . 2]" 1 173 1 27 LEU QD 1 78 PHE HB3 . . 4.540 3.340 3.179 3.539 . 0 0 "[ . 1 . 2]" 1 174 1 27 LEU QD 1 78 PHE HD2 . . 5.270 4.062 3.778 4.285 . 0 0 "[ . 1 . 2]" 1 175 1 27 LEU QD 1 81 GLU HA . . 5.500 4.520 4.224 4.720 . 0 0 "[ . 1 . 2]" 1 176 1 27 LEU QD 1 84 ALA HA . . 5.370 2.915 2.725 3.085 . 0 0 "[ . 1 . 2]" 1 177 1 27 LEU QD 1 84 ALA MB . . 2.420 1.693 1.655 1.755 . 0 0 "[ . 1 . 2]" 1 178 1 27 LEU QD 1 85 LEU HA . . 5.500 3.903 3.470 4.137 . 0 0 "[ . 1 . 2]" 1 179 1 27 LEU QD 1 91 HIS HD2 . . 5.500 5.156 4.510 6.404 0.904 19 2 "[ -. 1 . +2]" 1 180 1 27 LEU HG 1 28 GLN HA . . 5.500 3.627 3.560 3.702 . 0 0 "[ . 1 . 2]" 1 181 1 27 LEU HG 1 28 GLN HG3 . . 5.500 4.824 4.590 5.131 . 0 0 "[ . 1 . 2]" 1 182 1 27 LEU HG 1 29 LEU QB . . 4.010 2.513 2.335 2.767 . 0 0 "[ . 1 . 2]" 1 183 1 27 LEU HG 1 29 LEU QD . . 5.440 3.558 3.367 3.820 . 0 0 "[ . 1 . 2]" 1 184 1 27 LEU HG 1 78 PHE HB2 . . 5.380 4.757 4.382 5.080 . 0 0 "[ . 1 . 2]" 1 185 1 27 LEU HG 1 84 ALA MB . . 5.500 4.119 3.937 4.185 . 0 0 "[ . 1 . 2]" 1 186 1 28 GLN H 1 28 GLN HG3 . . 3.300 2.158 1.970 2.388 . 0 0 "[ . 1 . 2]" 1 187 1 28 GLN H 1 29 LEU H . . 4.500 4.433 4.364 4.474 . 0 0 "[ . 1 . 2]" 1 188 1 28 GLN H 1 75 ILE MD . . 4.910 4.181 3.936 4.649 . 0 0 "[ . 1 . 2]" 1 189 1 28 GLN H 1 75 ILE MG . . 5.500 3.533 3.373 3.699 . 0 0 "[ . 1 . 2]" 1 190 1 28 GLN H 1 105 ALA HA . . 5.500 4.258 3.849 4.443 . 0 0 "[ . 1 . 2]" 1 191 1 28 GLN H 1 106 LYS H . . 3.260 2.914 2.676 3.129 . 0 0 "[ . 1 . 2]" 1 192 1 28 GLN H 1 106 LYS HB2 . . 5.500 4.158 3.814 4.464 . 0 0 "[ . 1 . 2]" 1 193 1 28 GLN H 1 106 LYS QB . . 4.820 3.984 3.701 4.234 . 0 0 "[ . 1 . 2]" 1 194 1 28 GLN H 1 106 LYS HB3 . . 5.500 5.132 4.537 5.504 0.004 7 0 "[ . 1 . 2]" 1 195 1 28 GLN H 1 107 VAL H . . 5.500 4.859 4.771 5.001 . 0 0 "[ . 1 . 2]" 1 196 1 28 GLN H 1 107 VAL HA . . 4.900 3.244 3.051 3.411 . 0 0 "[ . 1 . 2]" 1 197 1 28 GLN H 1 107 VAL MG2 . . 4.870 4.085 3.938 4.436 . 0 0 "[ . 1 . 2]" 1 198 1 28 GLN H 1 108 PHE H . . 5.110 4.172 3.789 4.774 . 0 0 "[ . 1 . 2]" 1 199 1 28 GLN HA 1 29 LEU H . . 2.910 2.227 2.190 2.262 . 0 0 "[ . 1 . 2]" 1 200 1 28 GLN HA 1 75 ILE MD . . 3.150 2.311 1.884 3.247 0.097 10 0 "[ . 1 . 2]" 1 201 1 28 GLN HA 1 75 ILE QG . . 4.440 3.384 1.835 3.993 . 0 0 "[ . 1 . 2]" 1 202 1 28 GLN HA 1 75 ILE MG . . 3.460 2.302 2.106 2.524 . 0 0 "[ . 1 . 2]" 1 203 1 28 GLN HB2 1 29 LEU H . . 5.450 4.061 3.917 4.189 . 0 0 "[ . 1 . 2]" 1 204 1 28 GLN HB2 1 29 LEU HA . . 5.500 4.338 4.041 4.502 . 0 0 "[ . 1 . 2]" 1 205 1 28 GLN HB2 1 75 ILE MD . . 5.430 3.912 3.447 4.680 . 0 0 "[ . 1 . 2]" 1 206 1 28 GLN HB2 1 105 ALA H . . 5.500 5.322 4.678 5.688 0.188 14 0 "[ . 1 . 2]" 1 207 1 28 GLN HB2 1 106 LYS H . . 4.960 1.932 1.665 2.301 . 0 0 "[ . 1 . 2]" 1 208 1 28 GLN HB2 1 106 LYS QB . . 5.340 2.885 2.327 3.417 . 0 0 "[ . 1 . 2]" 1 209 1 28 GLN HB2 1 107 VAL HA . . 5.500 4.988 4.722 5.357 . 0 0 "[ . 1 . 2]" 1 210 1 28 GLN HB3 1 29 LEU HA . . 5.500 4.456 4.165 4.628 . 0 0 "[ . 1 . 2]" 1 211 1 28 GLN HB3 1 75 ILE HA . . 5.500 4.529 4.218 4.701 . 0 0 "[ . 1 . 2]" 1 212 1 28 GLN HB3 1 75 ILE MD . . 5.080 2.798 2.195 3.618 . 0 0 "[ . 1 . 2]" 1 213 1 28 GLN HB3 1 75 ILE MG . . 5.500 3.983 3.597 4.288 . 0 0 "[ . 1 . 2]" 1 214 1 28 GLN HB3 1 106 LYS QB . . 5.340 4.121 3.617 4.554 . 0 0 "[ . 1 . 2]" 1 215 1 28 GLN HG2 1 29 LEU H . . 5.500 4.741 4.603 4.897 . 0 0 "[ . 1 . 2]" 1 216 1 28 GLN HG2 1 75 ILE HA . . 5.500 4.502 4.050 4.804 . 0 0 "[ . 1 . 2]" 1 217 1 28 GLN HG2 1 75 ILE MD . . 2.740 1.958 1.780 2.358 . 0 0 "[ . 1 . 2]" 1 218 1 28 GLN HG2 1 75 ILE QG . . 5.340 3.603 2.368 4.100 . 0 0 "[ . 1 . 2]" 1 219 1 28 GLN HG2 1 75 ILE MG . . 3.350 2.731 2.073 3.134 . 0 0 "[ . 1 . 2]" 1 220 1 28 GLN HG3 1 75 ILE MD . . 3.720 3.391 3.153 3.644 . 0 0 "[ . 1 . 2]" 1 221 1 28 GLN HG3 1 106 LYS H . . 4.810 3.657 2.921 3.928 . 0 0 "[ . 1 . 2]" 1 222 1 28 GLN HG3 1 107 VAL HA . . 5.360 3.786 3.711 4.170 . 0 0 "[ . 1 . 2]" 1 223 1 29 LEU H 1 29 LEU HB2 . . 3.250 3.116 3.073 3.212 . 0 0 "[ . 1 . 2]" 1 224 1 29 LEU H 1 29 LEU QB . . 2.770 2.669 2.585 2.739 . 0 0 "[ . 1 . 2]" 1 225 1 29 LEU H 1 29 LEU HB3 . . 3.250 2.904 2.780 2.984 . 0 0 "[ . 1 . 2]" 1 226 1 29 LEU H 1 62 VAL QG . . 5.440 4.429 4.126 4.814 . 0 0 "[ . 1 . 2]" 1 227 1 29 LEU H 1 74 GLY H . . 4.630 3.899 3.477 4.189 . 0 0 "[ . 1 . 2]" 1 228 1 29 LEU H 1 75 ILE MD . . 4.620 3.211 2.529 4.726 0.106 13 0 "[ . 1 . 2]" 1 229 1 29 LEU H 1 76 TYR H . . 5.030 4.152 3.988 4.300 . 0 0 "[ . 1 . 2]" 1 230 1 29 LEU H 1 105 ALA HA . . 5.270 4.472 4.366 4.595 . 0 0 "[ . 1 . 2]" 1 231 1 29 LEU HA 1 29 LEU QD . . 3.290 2.571 2.008 3.091 . 0 0 "[ . 1 . 2]" 1 232 1 29 LEU HA 1 29 LEU HG . . 3.560 3.068 2.436 3.811 0.251 15 0 "[ . 1 . 2]" 1 233 1 29 LEU HA 1 30 HIS H . . 3.310 2.146 2.105 2.191 . 0 0 "[ . 1 . 2]" 1 234 1 29 LEU HA 1 104 VAL H . . 5.020 4.556 4.432 4.755 . 0 0 "[ . 1 . 2]" 1 235 1 29 LEU HA 1 104 VAL HB . . 5.500 4.548 4.201 4.744 . 0 0 "[ . 1 . 2]" 1 236 1 29 LEU HA 1 104 VAL MG1 . . 5.500 4.866 4.470 5.202 . 0 0 "[ . 1 . 2]" 1 237 1 29 LEU HA 1 104 VAL MG2 . . 5.500 5.554 5.346 5.633 0.133 18 0 "[ . 1 . 2]" 1 238 1 29 LEU HA 1 105 ALA HA . . 4.720 2.644 2.408 2.954 . 0 0 "[ . 1 . 2]" 1 239 1 29 LEU HA 1 105 ALA MB . . 5.500 2.840 2.626 3.205 . 0 0 "[ . 1 . 2]" 1 240 1 29 LEU HA 1 106 LYS H . . 4.990 4.284 3.997 4.713 . 0 0 "[ . 1 . 2]" 1 241 1 29 LEU QB 1 30 HIS HA . . 5.340 4.365 4.306 4.463 . 0 0 "[ . 1 . 2]" 1 242 1 29 LEU QB 1 62 VAL QG . . 5.280 3.469 3.154 3.939 . 0 0 "[ . 1 . 2]" 1 243 1 29 LEU QB 1 75 ILE HA . . 5.340 3.980 3.582 4.235 . 0 0 "[ . 1 . 2]" 1 244 1 29 LEU QB 1 76 TYR QD . . 4.260 3.016 2.629 3.334 . 0 0 "[ . 1 . 2]" 1 245 1 29 LEU QB 1 105 ALA HA . . 5.340 3.935 3.441 4.329 . 0 0 "[ . 1 . 2]" 1 246 1 29 LEU QB 1 105 ALA MB . . 4.540 3.366 2.909 3.550 . 0 0 "[ . 1 . 2]" 1 247 1 29 LEU QD 1 30 HIS H . . 4.610 3.071 2.811 3.481 . 0 0 "[ . 1 . 2]" 1 248 1 29 LEU QD 1 30 HIS HB2 . . 5.440 4.904 4.765 5.141 . 0 0 "[ . 1 . 2]" 1 249 1 29 LEU QD 1 30 HIS HB3 . . 5.440 4.445 4.279 4.615 . 0 0 "[ . 1 . 2]" 1 250 1 29 LEU QD 1 31 PHE H . . 5.140 4.301 4.054 4.499 . 0 0 "[ . 1 . 2]" 1 251 1 29 LEU QD 1 31 PHE HA . . 5.440 5.430 5.143 5.564 0.124 17 0 "[ . 1 . 2]" 1 252 1 29 LEU QD 1 31 PHE HB3 . . 4.330 4.515 4.193 4.651 0.321 9 0 "[ . 1 . 2]" 1 253 1 29 LEU QD 1 31 PHE QD . . 2.800 2.775 2.453 2.868 0.068 20 0 "[ . 1 . 2]" 1 254 1 29 LEU QD 1 73 GLY HA3 . . 5.440 3.868 3.540 4.158 . 0 0 "[ . 1 . 2]" 1 255 1 29 LEU QD 1 74 GLY H . . 5.280 4.048 3.873 4.325 . 0 0 "[ . 1 . 2]" 1 256 1 29 LEU QD 1 76 TYR QE . . 3.920 2.249 1.883 2.803 . 0 0 "[ . 1 . 2]" 1 257 1 29 LEU QD 1 88 LEU HA . . 3.510 3.153 2.572 3.583 0.073 17 0 "[ . 1 . 2]" 1 258 1 29 LEU QD 1 103 VAL HA . . 5.440 4.461 4.139 4.892 . 0 0 "[ . 1 . 2]" 1 259 1 29 LEU QD 1 103 VAL QG . . 3.870 1.871 1.747 2.109 . 0 0 "[ . 1 . 2]" 1 260 1 29 LEU QD 1 105 ALA HA . . 5.440 3.824 3.095 4.693 . 0 0 "[ . 1 . 2]" 1 261 1 29 LEU MD1 1 76 TYR QE . . 4.750 2.430 1.947 2.996 . 0 0 "[ . 1 . 2]" 1 262 1 29 LEU MD2 1 76 TYR QE . . 4.750 3.067 1.997 4.020 . 0 0 "[ . 1 . 2]" 1 263 1 29 LEU HG 1 30 HIS H . . 5.210 4.429 3.359 5.326 0.116 7 0 "[ . 1 . 2]" 1 264 1 29 LEU HG 1 30 HIS HA . . 5.500 5.270 4.562 5.700 0.200 8 0 "[ . 1 . 2]" 1 265 1 29 LEU HG 1 103 VAL QG . . 5.240 2.871 1.821 3.891 . 0 0 "[ . 1 . 2]" 1 266 1 29 LEU HG 1 105 ALA MB . . 5.500 3.312 2.261 4.372 . 0 0 "[ . 1 . 2]" 1 267 1 30 HIS H 1 31 PHE H . . 4.420 4.271 4.208 4.323 . 0 0 "[ . 1 . 2]" 1 268 1 30 HIS H 1 31 PHE HA . . 5.500 4.729 4.655 4.838 . 0 0 "[ . 1 . 2]" 1 269 1 30 HIS H 1 31 PHE HB3 . . 5.500 4.898 4.689 5.056 . 0 0 "[ . 1 . 2]" 1 270 1 30 HIS H 1 73 GLY HA3 . . 5.500 4.803 4.565 5.067 . 0 0 "[ . 1 . 2]" 1 271 1 30 HIS H 1 103 VAL HA . . 5.480 4.490 4.332 4.701 . 0 0 "[ . 1 . 2]" 1 272 1 30 HIS H 1 103 VAL QG . . 4.430 2.649 2.362 2.979 . 0 0 "[ . 1 . 2]" 1 273 1 30 HIS H 1 104 VAL HB . . 5.150 3.087 2.855 3.282 . 0 0 "[ . 1 . 2]" 1 274 1 30 HIS H 1 104 VAL QG . . 4.900 3.743 3.604 3.840 . 0 0 "[ . 1 . 2]" 1 275 1 30 HIS H 1 105 ALA H . . 5.500 4.979 4.813 5.075 . 0 0 "[ . 1 . 2]" 1 276 1 30 HIS H 1 105 ALA HA . . 5.500 3.894 3.777 4.056 . 0 0 "[ . 1 . 2]" 1 277 1 30 HIS HA 1 30 HIS HD2 . . 4.860 4.758 4.644 4.847 . 0 0 "[ . 1 . 2]" 1 278 1 30 HIS HA 1 31 PHE H . . 2.450 2.255 2.141 2.367 . 0 0 "[ . 1 . 2]" 1 279 1 30 HIS HA 1 31 PHE HB3 . . 5.090 4.593 4.535 4.692 . 0 0 "[ . 1 . 2]" 1 280 1 30 HIS HA 1 31 PHE QD . . 3.230 3.241 3.129 3.293 0.063 6 0 "[ . 1 . 2]" 1 281 1 30 HIS HA 1 73 GLY H . . 5.500 4.774 4.543 5.125 . 0 0 "[ . 1 . 2]" 1 282 1 30 HIS HA 1 74 GLY H . . 5.380 3.598 3.207 4.079 . 0 0 "[ . 1 . 2]" 1 283 1 30 HIS HA 1 103 VAL HA . . 5.460 5.261 5.152 5.399 . 0 0 "[ . 1 . 2]" 1 284 1 30 HIS HA 1 104 VAL H . . 4.910 4.718 4.603 4.829 . 0 0 "[ . 1 . 2]" 1 285 1 30 HIS HA 1 104 VAL QG . . 5.440 5.122 5.029 5.258 . 0 0 "[ . 1 . 2]" 1 286 1 30 HIS HB2 1 30 HIS HD2 . . 3.340 2.564 2.533 2.598 . 0 0 "[ . 1 . 2]" 1 287 1 30 HIS HB2 1 31 PHE H . . 3.020 2.573 2.334 2.892 . 0 0 "[ . 1 . 2]" 1 288 1 30 HIS HB2 1 71 GLU QG . . 5.070 2.928 2.528 3.255 . 0 0 "[ . 1 . 2]" 1 289 1 30 HIS HB2 1 72 ALA H . . 5.500 3.993 3.665 4.252 . 0 0 "[ . 1 . 2]" 1 290 1 30 HIS HB2 1 73 GLY H . . 5.290 3.967 3.845 4.153 . 0 0 "[ . 1 . 2]" 1 291 1 30 HIS HB2 1 73 GLY HA3 . . 5.010 2.768 2.621 3.019 . 0 0 "[ . 1 . 2]" 1 292 1 30 HIS HB2 1 103 VAL QG . . 5.440 4.953 4.506 5.334 . 0 0 "[ . 1 . 2]" 1 293 1 30 HIS HB2 1 104 VAL QG . . 5.440 4.907 4.736 5.150 . 0 0 "[ . 1 . 2]" 1 294 1 30 HIS HB3 1 30 HIS HE1 . . 4.970 4.868 4.821 4.911 . 0 0 "[ . 1 . 2]" 1 295 1 30 HIS HB3 1 31 PHE H . . 4.360 3.834 3.696 3.974 . 0 0 "[ . 1 . 2]" 1 296 1 30 HIS HB3 1 73 GLY HA3 . . 4.170 2.840 2.503 3.012 . 0 0 "[ . 1 . 2]" 1 297 1 30 HIS HB3 1 75 ILE HA . . 5.500 5.555 5.322 5.989 0.489 14 0 "[ . 1 . 2]" 1 298 1 30 HIS HB3 1 104 VAL QG . . 5.380 5.121 4.994 5.264 . 0 0 "[ . 1 . 2]" 1 299 1 30 HIS HD2 1 31 PHE HA . . 4.600 4.622 4.146 4.780 0.180 17 0 "[ . 1 . 2]" 1 300 1 30 HIS HD2 1 71 GLU QB . . 4.310 3.916 3.538 4.059 . 0 0 "[ . 1 . 2]" 1 301 1 30 HIS HD2 1 71 GLU QG . . 3.640 2.274 1.770 2.824 . 0 0 "[ . 1 . 2]" 1 302 1 30 HIS HD2 1 73 GLY H . . 5.500 5.681 5.634 5.744 0.244 5 0 "[ . 1 . 2]" 1 303 1 30 HIS HD2 1 73 GLY HA3 . . 5.500 5.287 5.134 5.563 0.063 9 0 "[ . 1 . 2]" 1 304 1 30 HIS HD2 1 104 VAL HB . . 5.500 4.818 4.377 5.232 . 0 0 "[ . 1 . 2]" 1 305 1 30 HIS HD2 2 106 LYS HB2 . . 5.500 4.698 3.753 5.045 . 0 0 "[ . 1 . 2]" 1 306 1 30 HIS HD2 2 106 LYS QD . . 5.230 3.707 2.589 4.417 . 0 0 "[ . 1 . 2]" 1 307 1 30 HIS HE1 1 104 VAL HB . . 3.340 2.726 2.464 3.021 . 0 0 "[ . 1 . 2]" 1 308 1 30 HIS HE1 1 104 VAL MG1 . . 3.390 2.443 2.305 2.724 . 0 0 "[ . 1 . 2]" 1 309 1 30 HIS HE1 1 104 VAL QG . . 2.670 2.394 2.272 2.622 . 0 0 "[ . 1 . 2]" 1 310 1 30 HIS HE1 1 104 VAL MG2 . . 3.390 3.458 3.413 3.517 0.127 9 0 "[ . 1 . 2]" 1 311 1 30 HIS HE1 2 106 LYS QD . . 5.340 4.445 3.486 5.330 . 0 0 "[ . 1 . 2]" 1 312 1 31 PHE H 1 31 PHE QD . . 4.610 3.058 2.772 3.299 . 0 0 "[ . 1 . 2]" 1 313 1 31 PHE H 1 32 ALA MB . . 5.500 5.458 5.391 5.523 0.023 5 0 "[ . 1 . 2]" 1 314 1 31 PHE H 1 71 GLU QB . . 5.500 5.557 5.213 5.911 0.411 6 0 "[ . 1 . 2]" 1 315 1 31 PHE H 1 71 GLU QG . . 5.250 3.569 3.247 3.936 . 0 0 "[ . 1 . 2]" 1 316 1 31 PHE H 1 72 ALA H . . 4.170 3.267 2.812 3.658 . 0 0 "[ . 1 . 2]" 1 317 1 31 PHE H 1 72 ALA MB . . 4.690 4.132 3.868 4.615 . 0 0 "[ . 1 . 2]" 1 318 1 31 PHE H 1 73 GLY H . . 5.240 4.756 4.511 5.040 . 0 0 "[ . 1 . 2]" 1 319 1 31 PHE H 1 73 GLY HA2 . . 4.910 4.765 4.595 4.921 0.011 15 0 "[ . 1 . 2]" 1 320 1 31 PHE H 1 73 GLY HA3 . . 4.610 3.154 2.983 3.353 . 0 0 "[ . 1 . 2]" 1 321 1 31 PHE H 1 103 VAL HA . . 5.210 4.774 4.510 5.042 . 0 0 "[ . 1 . 2]" 1 322 1 31 PHE H 1 103 VAL MG1 . . 5.500 4.917 4.086 5.712 0.212 6 0 "[ . 1 . 2]" 1 323 1 31 PHE H 1 103 VAL MG2 . . 5.500 4.271 3.176 5.214 . 0 0 "[ . 1 . 2]" 1 324 1 31 PHE H 1 104 VAL H . . 5.320 4.707 4.581 4.826 . 0 0 "[ . 1 . 2]" 1 325 1 31 PHE HA 1 104 VAL H . . 5.500 3.235 3.080 3.430 . 0 0 "[ . 1 . 2]" 1 326 1 31 PHE HB2 1 32 ALA H . . 2.770 2.212 2.037 2.394 . 0 0 "[ . 1 . 2]" 1 327 1 31 PHE HB2 1 100 VAL QG . . 3.380 2.990 2.701 3.250 . 0 0 "[ . 1 . 2]" 1 328 1 31 PHE HB2 1 101 GLU H . . 5.500 4.357 4.118 4.611 . 0 0 "[ . 1 . 2]" 1 329 1 31 PHE HB2 1 102 GLU H . . 5.340 4.510 3.952 4.850 . 0 0 "[ . 1 . 2]" 1 330 1 31 PHE HB2 1 103 VAL H . . 5.500 5.149 4.941 5.252 . 0 0 "[ . 1 . 2]" 1 331 1 31 PHE HB2 1 103 VAL HA . . 4.500 3.368 3.188 3.571 . 0 0 "[ . 1 . 2]" 1 332 1 31 PHE HB2 1 103 VAL QG . . 4.380 3.617 3.299 3.901 . 0 0 "[ . 1 . 2]" 1 333 1 31 PHE HB3 1 31 PHE QD . . 2.860 2.396 2.356 2.426 . 0 0 "[ . 1 . 2]" 1 334 1 31 PHE HB3 1 32 ALA H . . 3.610 3.524 3.411 3.640 0.030 4 0 "[ . 1 . 2]" 1 335 1 31 PHE HB3 1 100 VAL QG . . 4.890 4.275 4.008 4.590 . 0 0 "[ . 1 . 2]" 1 336 1 31 PHE HB3 1 103 VAL H . . 5.160 4.128 3.849 4.289 . 0 0 "[ . 1 . 2]" 1 337 1 31 PHE HB3 1 103 VAL HA . . 3.740 1.866 1.764 1.944 . 0 0 "[ . 1 . 2]" 1 338 1 31 PHE HB3 1 103 VAL MG1 . . 4.840 3.413 2.930 3.803 . 0 0 "[ . 1 . 2]" 1 339 1 31 PHE HB3 1 103 VAL QG . . 3.850 2.406 2.159 2.702 . 0 0 "[ . 1 . 2]" 1 340 1 31 PHE HB3 1 103 VAL MG2 . . 4.840 2.466 2.197 2.885 . 0 0 "[ . 1 . 2]" 1 341 1 31 PHE HB3 1 104 VAL H . . 5.040 3.280 2.936 3.471 . 0 0 "[ . 1 . 2]" 1 342 1 31 PHE HB3 1 104 VAL QG . . 5.440 4.071 3.661 4.469 . 0 0 "[ . 1 . 2]" 1 343 1 31 PHE QD 1 32 ALA H . . 5.500 3.439 3.144 3.734 . 0 0 "[ . 1 . 2]" 1 344 1 31 PHE QD 1 73 GLY HA3 . . 5.500 4.605 4.366 4.973 . 0 0 "[ . 1 . 2]" 1 345 1 31 PHE QD 1 95 LEU QD . . 3.550 2.760 2.606 2.926 . 0 0 "[ . 1 . 2]" 1 346 1 31 PHE QD 1 103 VAL H . . 5.500 5.162 4.943 5.358 . 0 0 "[ . 1 . 2]" 1 347 1 31 PHE QD 1 103 VAL HA . . 3.370 3.282 2.980 3.482 0.112 9 0 "[ . 1 . 2]" 1 348 1 31 PHE QD 1 103 VAL HB . . 4.520 3.731 2.158 4.603 0.083 7 0 "[ . 1 . 2]" 1 349 1 31 PHE QD 1 103 VAL MG1 . . 3.360 2.752 2.086 3.461 0.101 19 0 "[ . 1 . 2]" 1 350 1 31 PHE QD 1 103 VAL QG . . 2.740 1.888 1.731 1.999 . 0 0 "[ . 1 . 2]" 1 351 1 31 PHE QD 1 103 VAL MG2 . . 3.360 1.979 1.736 2.258 . 0 0 "[ . 1 . 2]" 1 352 1 31 PHE QD 1 104 VAL H . . 4.070 4.144 3.860 4.269 0.199 17 0 "[ . 1 . 2]" 1 353 1 31 PHE QD 1 104 VAL QG . . 5.440 5.067 4.822 5.247 . 0 0 "[ . 1 . 2]" 1 354 1 32 ALA H 1 32 ALA HA . . 2.850 2.837 2.797 2.859 0.009 19 0 "[ . 1 . 2]" 1 355 1 32 ALA H 1 32 ALA MB . . 2.400 2.239 2.204 2.272 . 0 0 "[ . 1 . 2]" 1 356 1 32 ALA H 1 100 VAL MG1 . . 4.450 2.708 2.282 2.948 . 0 0 "[ . 1 . 2]" 1 357 1 32 ALA H 1 100 VAL MG2 . . 4.450 4.027 3.813 4.323 . 0 0 "[ . 1 . 2]" 1 358 1 32 ALA H 1 101 GLU H . . 5.010 4.365 4.113 4.659 . 0 0 "[ . 1 . 2]" 1 359 1 32 ALA H 1 101 GLU HB2 . . 5.030 4.547 3.784 5.320 0.290 15 0 "[ . 1 . 2]" 1 360 1 32 ALA H 1 102 GLU H . . 5.500 4.694 4.135 4.948 . 0 0 "[ . 1 . 2]" 1 361 1 32 ALA H 1 103 VAL HA . . 5.200 4.769 4.350 5.084 . 0 0 "[ . 1 . 2]" 1 362 1 32 ALA HA 1 33 PHE H . . 2.400 2.250 2.158 2.357 . 0 0 "[ . 1 . 2]" 1 363 1 32 ALA HA 1 71 GLU H . . 5.500 4.730 4.520 4.947 . 0 0 "[ . 1 . 2]" 1 364 1 32 ALA HA 1 71 GLU HA . . 5.500 2.005 1.812 2.171 . 0 0 "[ . 1 . 2]" 1 365 1 32 ALA MB 1 33 PHE H . . 3.640 2.595 2.448 2.783 . 0 0 "[ . 1 . 2]" 1 366 1 32 ALA MB 1 33 PHE QD . . 5.500 5.502 5.410 5.570 0.070 4 0 "[ . 1 . 2]" 1 367 1 32 ALA MB 1 35 GLY H . . 5.470 4.953 4.433 5.484 0.014 18 0 "[ . 1 . 2]" 1 368 1 32 ALA MB 1 70 HIS HB2 . . 5.430 4.748 4.347 5.083 . 0 0 "[ . 1 . 2]" 1 369 1 32 ALA MB 1 70 HIS HB3 . . 5.500 4.084 3.486 4.505 . 0 0 "[ . 1 . 2]" 1 370 1 32 ALA MB 1 71 GLU H . . 5.500 5.400 5.150 5.563 0.063 20 0 "[ . 1 . 2]" 1 371 1 32 ALA MB 1 71 GLU HA . . 3.770 3.532 3.341 3.764 . 0 0 "[ . 1 . 2]" 1 372 1 32 ALA MB 1 101 GLU H . . 4.930 3.873 3.561 4.144 . 0 0 "[ . 1 . 2]" 1 373 1 32 ALA MB 1 101 GLU QG . . 4.600 3.737 2.842 4.422 . 0 0 "[ . 1 . 2]" 1 374 1 32 ALA MB 1 102 GLU H . . 4.910 4.917 4.531 5.036 0.126 5 0 "[ . 1 . 2]" 1 375 1 33 PHE H 1 33 PHE QB . . 3.090 2.238 2.175 2.282 . 0 0 "[ . 1 . 2]" 1 376 1 33 PHE H 1 33 PHE QD . . 4.910 4.178 4.143 4.210 . 0 0 "[ . 1 . 2]" 1 377 1 33 PHE H 1 34 ASN H . . 4.660 4.579 4.520 4.621 . 0 0 "[ . 1 . 2]" 1 378 1 33 PHE H 1 70 HIS H . . 5.500 5.423 5.037 5.551 0.051 17 0 "[ . 1 . 2]" 1 379 1 33 PHE H 1 70 HIS HA . . 3.870 3.764 3.204 3.985 0.115 4 0 "[ . 1 . 2]" 1 380 1 33 PHE H 1 70 HIS HB2 . . 5.500 4.635 4.226 4.881 . 0 0 "[ . 1 . 2]" 1 381 1 33 PHE H 1 70 HIS HB3 . . 5.290 3.691 3.051 3.971 . 0 0 "[ . 1 . 2]" 1 382 1 33 PHE H 1 71 GLU H . . 3.990 3.768 3.522 3.983 . 0 0 "[ . 1 . 2]" 1 383 1 33 PHE H 1 71 GLU HA . . 2.860 2.142 1.791 2.656 . 0 0 "[ . 1 . 2]" 1 384 1 33 PHE H 1 71 GLU QB . . 5.490 3.900 3.434 4.446 . 0 0 "[ . 1 . 2]" 1 385 1 33 PHE H 1 71 GLU QG . . 5.500 4.238 3.680 4.829 . 0 0 "[ . 1 . 2]" 1 386 1 33 PHE H 1 72 ALA H . . 4.220 3.712 3.259 4.216 . 0 0 "[ . 1 . 2]" 1 387 1 33 PHE H 1 72 ALA MB . . 4.990 4.261 3.759 4.543 . 0 0 "[ . 1 . 2]" 1 388 1 33 PHE H 1 100 VAL QG . . 5.230 4.014 3.698 4.353 . 0 0 "[ . 1 . 2]" 1 389 1 33 PHE HA 1 35 GLY H . . 5.420 3.033 2.743 3.667 . 0 0 "[ . 1 . 2]" 1 390 1 33 PHE HA 1 71 GLU H . . 5.500 5.295 4.735 5.546 0.046 12 0 "[ . 1 . 2]" 1 391 1 33 PHE HA 1 72 ALA MB . . 5.430 3.045 2.564 3.361 . 0 0 "[ . 1 . 2]" 1 392 1 33 PHE HA 1 100 VAL QG . . 4.610 4.251 3.988 4.473 . 0 0 "[ . 1 . 2]" 1 393 1 33 PHE QB 1 33 PHE QD . . 2.450 2.124 2.112 2.136 . 0 0 "[ . 1 . 2]" 1 394 1 33 PHE QB 1 71 GLU H . . 3.630 2.856 2.440 3.130 . 0 0 "[ . 1 . 2]" 1 395 1 33 PHE QB 1 72 ALA H . . 5.340 3.774 3.327 4.270 . 0 0 "[ . 1 . 2]" 1 396 1 33 PHE QB 1 72 ALA MB . . 5.340 2.930 2.330 3.483 . 0 0 "[ . 1 . 2]" 1 397 1 33 PHE QD 1 34 ASN QB . . 4.260 3.068 2.814 3.470 . 0 0 "[ . 1 . 2]" 1 398 1 33 PHE QD 1 35 GLY H . . 5.500 4.615 4.425 4.738 . 0 0 "[ . 1 . 2]" 1 399 1 34 ASN H 1 34 ASN HA . . 2.550 2.273 2.224 2.302 . 0 0 "[ . 1 . 2]" 1 400 1 34 ASN H 1 34 ASN QB . . 3.160 3.077 3.022 3.159 . 0 0 "[ . 1 . 2]" 1 401 1 34 ASN H 1 35 GLY H . . 3.880 2.316 2.194 2.533 . 0 0 "[ . 1 . 2]" 1 402 1 34 ASN H 1 36 PRO HD2 . . 5.500 3.309 2.491 3.674 . 0 0 "[ . 1 . 2]" 1 403 1 34 ASN H 1 36 PRO QG . . 5.350 4.243 3.746 5.079 . 0 0 "[ . 1 . 2]" 1 404 1 34 ASN H 1 38 GLY HA2 . . 4.540 4.503 4.194 4.664 0.124 2 0 "[ . 1 . 2]" 1 405 1 34 ASN HA 1 35 GLY H . . 3.040 2.847 2.377 3.050 0.010 9 0 "[ . 1 . 2]" 1 406 1 34 ASN HA 1 37 PHE H . . 5.450 5.532 5.040 5.652 0.202 9 0 "[ . 1 . 2]" 1 407 1 34 ASN QB 1 35 GLY H . . 4.200 3.744 3.571 3.953 . 0 0 "[ . 1 . 2]" 1 408 1 34 ASN QB 1 35 GLY QA . . 4.590 4.361 4.229 4.587 . 0 0 "[ . 1 . 2]" 1 409 1 35 GLY H 1 36 PRO HA . . 4.920 4.694 4.594 4.797 . 0 0 "[ . 1 . 2]" 1 410 1 35 GLY H 1 36 PRO HD3 . . 4.580 3.264 2.687 3.490 . 0 0 "[ . 1 . 2]" 1 411 1 35 GLY H 1 37 PHE H . . 5.500 5.762 5.677 5.840 0.340 16 0 "[ . 1 . 2]" 1 412 1 35 GLY H 1 38 GLY HA2 . . 5.500 5.386 4.961 5.639 0.139 12 0 "[ . 1 . 2]" 1 413 1 35 GLY H 1 72 ALA MB . . 5.500 5.088 4.509 5.516 0.016 4 0 "[ . 1 . 2]" 1 414 1 35 GLY H 1 100 VAL QG . . 5.440 3.648 3.304 4.008 . 0 0 "[ . 1 . 2]" 1 415 1 35 GLY QA 1 36 PRO HA . . 5.340 4.083 4.045 4.123 . 0 0 "[ . 1 . 2]" 1 416 1 35 GLY QA 1 98 LEU MD1 . . 5.340 3.956 3.633 4.665 . 0 0 "[ . 1 . 2]" 1 417 1 35 GLY QA 1 100 VAL HB . . 4.330 2.629 2.160 3.154 . 0 0 "[ . 1 . 2]" 1 418 1 35 GLY QA 1 100 VAL QG . . 2.980 2.337 1.918 2.933 . 0 0 "[ . 1 . 2]" 1 419 1 36 PRO HA 1 37 PHE H . . 2.780 2.500 2.383 2.811 0.031 7 0 "[ . 1 . 2]" 1 420 1 36 PRO HA 1 37 PHE QD . . 5.500 4.398 3.996 4.822 . 0 0 "[ . 1 . 2]" 1 421 1 36 PRO HA 1 40 ALA MB . . 4.370 4.046 3.631 4.428 0.058 8 0 "[ . 1 . 2]" 1 422 1 36 PRO HA 1 98 LEU MD1 . . 4.460 3.137 2.567 3.885 . 0 0 "[ . 1 . 2]" 1 423 1 36 PRO QB 1 37 PHE H . . 4.090 2.475 1.849 2.672 . 0 0 "[ . 1 . 2]" 1 424 1 36 PRO QB 1 37 PHE QB . . 4.590 4.056 3.853 4.242 . 0 0 "[ . 1 . 2]" 1 425 1 36 PRO QB 1 37 PHE QD . . 5.500 4.132 3.749 4.356 . 0 0 "[ . 1 . 2]" 1 426 1 36 PRO QB 1 38 GLY H . . 4.690 2.368 2.178 2.609 . 0 0 "[ . 1 . 2]" 1 427 1 36 PRO QB 1 38 GLY HA2 . . 5.500 3.860 3.520 4.228 . 0 0 "[ . 1 . 2]" 1 428 1 36 PRO QB 1 40 ALA MB . . 2.890 2.029 1.829 2.380 . 0 0 "[ . 1 . 2]" 1 429 1 36 PRO HD2 1 38 GLY H . . 5.500 4.753 4.088 5.069 . 0 0 "[ . 1 . 2]" 1 430 1 36 PRO HD2 1 100 VAL QG . . 5.440 4.319 3.830 4.949 . 0 0 "[ . 1 . 2]" 1 431 1 36 PRO HD3 1 98 LEU MD1 . . 5.500 4.711 4.201 5.524 0.024 3 0 "[ . 1 . 2]" 1 432 1 36 PRO QG 1 38 GLY HA2 . . 5.350 2.776 2.576 3.862 . 0 0 "[ . 1 . 2]" 1 433 1 36 PRO QG 1 41 MET QG . . 3.160 2.622 1.777 3.288 0.128 20 0 "[ . 1 . 2]" 1 434 1 37 PHE H 1 37 PHE QB . . 3.020 2.559 2.478 2.716 . 0 0 "[ . 1 . 2]" 1 435 1 37 PHE H 1 38 GLY H . . 3.710 2.536 2.227 2.787 . 0 0 "[ . 1 . 2]" 1 436 1 37 PHE H 1 39 ASP H . . 5.500 4.753 4.287 5.357 . 0 0 "[ . 1 . 2]" 1 437 1 37 PHE H 1 40 ALA H . . 5.210 4.278 4.093 4.480 . 0 0 "[ . 1 . 2]" 1 438 1 37 PHE H 1 40 ALA MB . . 4.560 3.533 2.705 4.053 . 0 0 "[ . 1 . 2]" 1 439 1 37 PHE HA 1 38 GLY HA2 . . 5.130 4.889 4.744 5.097 . 0 0 "[ . 1 . 2]" 1 440 1 37 PHE QB 1 38 GLY H . . 3.100 2.718 2.530 2.928 . 0 0 "[ . 1 . 2]" 1 441 1 37 PHE QB 1 39 ASP H . . 5.340 3.048 2.562 3.570 . 0 0 "[ . 1 . 2]" 1 442 1 37 PHE QB 1 40 ALA H . . 4.670 3.680 2.542 4.322 . 0 0 "[ . 1 . 2]" 1 443 1 37 PHE QD 1 38 GLY H . . 3.970 3.999 3.767 4.062 0.092 3 0 "[ . 1 . 2]" 1 444 1 37 PHE QD 1 39 ASP QB . . 5.340 4.923 3.663 5.381 0.041 14 0 "[ . 1 . 2]" 1 445 1 37 PHE QD 1 40 ALA H . . 4.920 4.421 3.020 4.952 0.032 1 0 "[ . 1 . 2]" 1 446 1 37 PHE QD 1 40 ALA MB . . 5.500 3.743 2.079 4.700 . 0 0 "[ . 1 . 2]" 1 447 1 38 GLY H 1 39 ASP H . . 3.890 2.798 2.439 3.278 . 0 0 "[ . 1 . 2]" 1 448 1 38 GLY H 1 39 ASP QB . . 5.090 4.557 4.217 4.829 . 0 0 "[ . 1 . 2]" 1 449 1 38 GLY H 1 40 ALA H . . 4.350 2.776 2.613 2.940 . 0 0 "[ . 1 . 2]" 1 450 1 38 GLY H 1 41 MET H . . 5.500 4.183 3.826 4.563 . 0 0 "[ . 1 . 2]" 1 451 1 38 GLY HA2 1 39 ASP HA . . 5.470 4.775 4.641 4.910 . 0 0 "[ . 1 . 2]" 1 452 1 38 GLY HA2 1 40 ALA H . . 4.940 4.122 3.864 4.407 . 0 0 "[ . 1 . 2]" 1 453 1 38 GLY HA3 1 39 ASP H . . 3.060 2.666 2.413 2.951 . 0 0 "[ . 1 . 2]" 1 454 1 38 GLY HA3 1 40 ALA H . . 5.080 4.380 4.062 4.619 . 0 0 "[ . 1 . 2]" 1 455 1 38 GLY HA3 1 41 MET H . . 5.410 4.815 4.598 5.084 . 0 0 "[ . 1 . 2]" 1 456 1 39 ASP H 1 39 ASP QB . . 2.960 2.509 2.351 2.749 . 0 0 "[ . 1 . 2]" 1 457 1 39 ASP H 1 40 ALA H . . 3.520 2.658 2.544 2.793 . 0 0 "[ . 1 . 2]" 1 458 1 39 ASP H 1 40 ALA MB . . 5.500 4.258 4.097 4.400 . 0 0 "[ . 1 . 2]" 1 459 1 39 ASP H 1 41 MET H . . 4.990 4.323 4.094 4.546 . 0 0 "[ . 1 . 2]" 1 460 1 39 ASP H 1 42 ALA MB . . 5.500 4.340 4.000 4.802 . 0 0 "[ . 1 . 2]" 1 461 1 39 ASP HA 1 39 ASP QB . . 2.440 2.349 2.163 2.433 . 0 0 "[ . 1 . 2]" 1 462 1 39 ASP HA 1 42 ALA H . . 3.510 2.960 2.660 3.252 . 0 0 "[ . 1 . 2]" 1 463 1 39 ASP HA 1 42 ALA MB . . 2.680 2.111 1.951 2.425 . 0 0 "[ . 1 . 2]" 1 464 1 39 ASP QB 1 40 ALA HA . . 5.340 4.127 3.768 4.742 . 0 0 "[ . 1 . 2]" 1 465 1 39 ASP QB 1 42 ALA H . . 5.040 4.683 4.454 4.930 . 0 0 "[ . 1 . 2]" 1 466 1 39 ASP QB 1 42 ALA MB . . 3.730 3.687 3.225 3.850 0.120 4 0 "[ . 1 . 2]" 1 467 1 39 ASP QB 1 43 GLU H . . 4.980 3.586 3.164 4.147 . 0 0 "[ . 1 . 2]" 1 468 1 39 ASP QB 1 43 GLU HA . . 5.340 5.304 4.940 5.477 0.137 12 0 "[ . 1 . 2]" 1 469 1 40 ALA H 1 40 ALA HA . . 2.830 2.744 2.698 2.778 . 0 0 "[ . 1 . 2]" 1 470 1 40 ALA H 1 40 ALA MB . . 2.400 2.208 2.178 2.232 . 0 0 "[ . 1 . 2]" 1 471 1 40 ALA H 1 41 MET H . . 3.080 2.818 2.662 2.921 . 0 0 "[ . 1 . 2]" 1 472 1 40 ALA H 1 42 ALA H . . 4.500 4.326 4.035 4.521 0.021 7 0 "[ . 1 . 2]" 1 473 1 40 ALA H 1 42 ALA MB . . 5.500 4.861 4.656 5.083 . 0 0 "[ . 1 . 2]" 1 474 1 40 ALA H 1 44 GLN HB2 . . 5.080 3.862 3.713 4.006 . 0 0 "[ . 1 . 2]" 1 475 1 40 ALA HA 1 41 MET QG . . 5.340 5.006 4.732 5.280 . 0 0 "[ . 1 . 2]" 1 476 1 40 ALA HA 1 44 GLN H . . 4.620 3.483 3.330 3.628 . 0 0 "[ . 1 . 2]" 1 477 1 40 ALA HA 1 44 GLN HA . . 5.500 4.598 4.475 4.692 . 0 0 "[ . 1 . 2]" 1 478 1 40 ALA HA 1 44 GLN HB2 . . 2.650 1.719 1.624 1.803 . 0 0 "[ . 1 . 2]" 1 479 1 40 ALA HA 1 44 GLN HB3 . . 5.500 2.831 2.640 2.942 . 0 0 "[ . 1 . 2]" 1 480 1 40 ALA HA 1 45 LEU H . . 4.270 4.289 4.079 4.433 0.163 17 0 "[ . 1 . 2]" 1 481 1 40 ALA HA 1 48 LEU MD1 . . 5.500 4.297 3.717 4.811 . 0 0 "[ . 1 . 2]" 1 482 1 40 ALA MB 1 41 MET H . . 2.810 2.731 2.520 2.847 0.037 2 0 "[ . 1 . 2]" 1 483 1 40 ALA MB 1 41 MET QG . . 3.540 3.043 2.833 3.300 . 0 0 "[ . 1 . 2]" 1 484 1 40 ALA MB 1 44 GLN H . . 5.090 4.792 4.675 4.932 . 0 0 "[ . 1 . 2]" 1 485 1 40 ALA MB 1 44 GLN HB2 . . 5.200 3.486 3.402 3.567 . 0 0 "[ . 1 . 2]" 1 486 1 40 ALA MB 1 44 GLN HB3 . . 4.750 4.118 3.846 4.296 . 0 0 "[ . 1 . 2]" 1 487 1 41 MET H 1 41 MET HB2 . . 2.850 2.590 2.315 2.732 . 0 0 "[ . 1 . 2]" 1 488 1 41 MET H 1 42 ALA H . . 2.870 2.238 2.020 2.403 . 0 0 "[ . 1 . 2]" 1 489 1 41 MET H 1 42 ALA MB . . 4.080 3.896 3.766 4.026 . 0 0 "[ . 1 . 2]" 1 490 1 41 MET H 1 43 GLU H . . 4.720 3.891 3.655 4.416 . 0 0 "[ . 1 . 2]" 1 491 1 41 MET H 1 45 LEU H . . 5.100 4.707 4.445 5.027 . 0 0 "[ . 1 . 2]" 1 492 1 41 MET H 1 45 LEU QD . . 4.900 4.418 3.767 4.857 . 0 0 "[ . 1 . 2]" 1 493 1 41 MET HA 1 41 MET HB3 . . 2.400 2.439 2.366 2.556 0.156 12 0 "[ . 1 . 2]" 1 494 1 41 MET HA 1 41 MET QG . . 3.100 2.828 2.368 3.160 0.060 15 0 "[ . 1 . 2]" 1 495 1 41 MET HA 1 45 LEU H . . 4.890 3.354 2.849 3.805 . 0 0 "[ . 1 . 2]" 1 496 1 41 MET HA 1 45 LEU HB2 . . 5.500 1.828 1.678 2.042 . 0 0 "[ . 1 . 2]" 1 497 1 41 MET HA 1 45 LEU HB3 . . 5.500 3.325 2.764 3.731 . 0 0 "[ . 1 . 2]" 1 498 1 41 MET HA 1 45 LEU HG . . 5.500 3.875 2.864 4.674 . 0 0 "[ . 1 . 2]" 1 499 1 41 MET HA 2 114 LEU HG . . 5.500 4.833 4.006 5.582 0.082 15 0 "[ . 1 . 2]" 1 500 1 41 MET HB2 1 41 MET QG . . 2.520 2.217 2.140 2.400 . 0 0 "[ . 1 . 2]" 1 501 1 41 MET HB2 1 42 ALA H . . 3.840 2.397 2.013 2.936 . 0 0 "[ . 1 . 2]" 1 502 1 41 MET HB2 1 42 ALA HA . . 4.350 4.017 3.694 4.368 0.018 6 0 "[ . 1 . 2]" 1 503 1 41 MET HB2 2 114 LEU HG . . 5.500 5.603 5.371 5.843 0.343 15 0 "[ . 1 . 2]" 1 504 1 41 MET HB3 1 45 LEU QD . . 3.940 2.894 2.650 3.781 . 0 0 "[ . 1 . 2]" 1 505 1 41 MET HB3 2 114 LEU HG . . 5.500 4.596 4.055 5.415 . 0 0 "[ . 1 . 2]" 1 506 1 41 MET QG 1 42 ALA H . . 5.100 3.864 3.543 4.187 . 0 0 "[ . 1 . 2]" 1 507 1 41 MET QG 1 45 LEU QD . . 4.310 3.149 1.924 3.693 . 0 0 "[ . 1 . 2]" 1 508 1 42 ALA H 1 42 ALA MB . . 3.620 2.213 2.177 2.254 . 0 0 "[ . 1 . 2]" 1 509 1 42 ALA H 1 43 GLU H . . 3.210 2.876 2.617 3.084 . 0 0 "[ . 1 . 2]" 1 510 1 42 ALA H 1 43 GLU HA . . 5.340 5.393 5.257 5.480 0.140 17 0 "[ . 1 . 2]" 1 511 1 42 ALA H 1 44 GLN H . . 4.540 4.270 3.996 4.576 0.036 1 0 "[ . 1 . 2]" 1 512 1 42 ALA H 1 45 LEU QD . . 5.350 4.860 4.618 5.038 . 0 0 "[ . 1 . 2]" 1 513 1 42 ALA H 2 114 LEU MD1 . . 5.500 4.567 3.746 5.206 . 0 0 "[ . 1 . 2]" 1 514 1 42 ALA H 2 114 LEU QD . . 4.620 3.881 3.574 4.240 . 0 0 "[ . 1 . 2]" 1 515 1 42 ALA H 2 114 LEU MD2 . . 5.500 4.447 3.692 5.346 . 0 0 "[ . 1 . 2]" 1 516 1 42 ALA H 2 114 LEU HG . . 5.500 5.464 4.971 5.635 0.135 6 0 "[ . 1 . 2]" 1 517 1 42 ALA HA 2 113 PRO QD . . 5.350 4.748 4.094 5.270 . 0 0 "[ . 1 . 2]" 1 518 1 42 ALA HA 2 114 LEU MD1 . . 5.500 3.538 2.493 4.219 . 0 0 "[ . 1 . 2]" 1 519 1 42 ALA HA 2 114 LEU QD . . 4.500 2.492 1.831 3.712 . 0 0 "[ . 1 . 2]" 1 520 1 42 ALA HA 2 114 LEU MD2 . . 5.500 2.857 1.839 4.352 . 0 0 "[ . 1 . 2]" 1 521 1 42 ALA HA 2 114 LEU HG . . 5.500 3.747 2.624 4.344 . 0 0 "[ . 1 . 2]" 1 522 1 42 ALA MB 1 43 GLU H . . 5.500 2.635 2.189 3.222 . 0 0 "[ . 1 . 2]" 1 523 1 42 ALA MB 1 43 GLU HB2 . . 3.340 3.429 3.129 3.661 0.321 18 0 "[ . 1 . 2]" 1 524 1 42 ALA MB 1 43 GLU HB3 . . 5.500 4.033 3.733 4.715 . 0 0 "[ . 1 . 2]" 1 525 1 42 ALA MB 1 44 GLN H . . 4.380 4.233 3.825 4.519 0.139 20 0 "[ . 1 . 2]" 1 526 1 42 ALA MB 1 45 LEU HB2 . . 5.500 5.643 5.178 6.109 0.609 18 3 "[ - . 1 . + *]" 1 527 1 42 ALA MB 2 113 PRO HB2 . . 5.500 4.666 3.816 5.594 0.094 9 0 "[ . 1 . 2]" 1 528 1 42 ALA MB 2 113 PRO HB3 . . 5.500 5.002 4.129 6.064 0.564 9 1 "[ . +1 . 2]" 1 529 1 42 ALA MB 2 114 LEU MD1 . . 5.500 4.500 3.764 5.001 . 0 0 "[ . 1 . 2]" 1 530 1 42 ALA MB 2 114 LEU QD . . 4.780 3.651 3.238 4.470 . 0 0 "[ . 1 . 2]" 1 531 1 42 ALA MB 2 114 LEU MD2 . . 5.500 4.029 3.312 5.135 . 0 0 "[ . 1 . 2]" 1 532 1 42 ALA MB 2 114 LEU HG . . 5.500 5.105 3.999 5.568 0.068 7 0 "[ . 1 . 2]" 1 533 1 43 GLU H 1 43 GLU HB2 . . 3.180 2.990 2.484 3.402 0.222 9 0 "[ . 1 . 2]" 1 534 1 43 GLU H 1 44 GLN H . . 4.270 1.991 1.878 2.085 . 0 0 "[ . 1 . 2]" 1 535 1 43 GLU H 1 45 LEU H . . 3.630 3.312 2.695 3.688 0.058 19 0 "[ . 1 . 2]" 1 536 1 43 GLU H 1 45 LEU HB3 . . 5.060 5.106 3.873 5.908 0.848 12 5 "[ . * 1 + .*- *2]" 1 537 1 43 GLU H 1 46 LYS H . . 5.290 4.882 4.349 5.211 . 0 0 "[ . 1 . 2]" 1 538 1 43 GLU H 2 114 LEU QD . . 5.280 3.810 2.868 4.764 . 0 0 "[ . 1 . 2]" 1 539 1 43 GLU HA 1 43 GLU HG2 . . 3.780 3.246 2.418 3.838 0.058 18 0 "[ . 1 . 2]" 1 540 1 43 GLU HA 1 43 GLU QG . . 3.160 2.706 2.386 3.170 0.010 18 0 "[ . 1 . 2]" 1 541 1 43 GLU HA 1 43 GLU HG3 . . 3.780 3.042 2.545 3.676 . 0 0 "[ . 1 . 2]" 1 542 1 43 GLU HA 2 114 LEU QD . . 5.440 3.478 2.679 4.311 . 0 0 "[ . 1 . 2]" 1 543 1 43 GLU HB3 1 44 GLN H . . 4.270 2.645 2.109 4.010 . 0 0 "[ . 1 . 2]" 1 544 1 44 GLN H 1 44 GLN HB2 . . 3.840 2.275 2.158 2.400 . 0 0 "[ . 1 . 2]" 1 545 1 44 GLN H 1 44 GLN QG . . 3.690 2.621 2.235 3.101 . 0 0 "[ . 1 . 2]" 1 546 1 44 GLN H 1 45 LEU H . . 2.910 2.582 2.298 2.779 . 0 0 "[ . 1 . 2]" 1 547 1 44 GLN H 1 46 LYS H . . 5.400 4.273 3.974 4.625 . 0 0 "[ . 1 . 2]" 1 548 1 44 GLN H 1 47 PRO HD3 . . 5.070 5.092 4.971 5.166 0.096 5 0 "[ . 1 . 2]" 1 549 1 44 GLN H 2 114 LEU QD . . 5.390 4.362 4.016 4.803 . 0 0 "[ . 1 . 2]" 1 550 1 44 GLN HA 1 47 PRO HG2 . . 5.430 3.188 2.845 3.384 . 0 0 "[ . 1 . 2]" 1 551 1 44 GLN HA 1 47 PRO HG3 . . 5.020 3.698 3.227 4.090 . 0 0 "[ . 1 . 2]" 1 552 1 44 GLN HA 1 48 LEU MD2 . . 5.500 4.469 3.969 4.764 . 0 0 "[ . 1 . 2]" 1 553 1 44 GLN HB2 1 45 LEU H . . 4.360 3.467 3.121 3.796 . 0 0 "[ . 1 . 2]" 1 554 1 44 GLN HB2 1 45 LEU HA . . 5.500 4.812 4.472 5.163 . 0 0 "[ . 1 . 2]" 1 555 1 44 GLN HB3 1 45 LEU H . . 4.900 4.081 3.790 4.268 . 0 0 "[ . 1 . 2]" 1 556 1 44 GLN HB3 1 45 LEU HA . . 5.500 4.612 4.445 4.756 . 0 0 "[ . 1 . 2]" 1 557 1 44 GLN QE 1 48 LEU MD1 . . 3.360 1.980 1.776 2.472 . 0 0 "[ . 1 . 2]" 1 558 1 44 GLN QE 1 48 LEU MD2 . . 3.010 2.948 2.546 3.204 0.194 18 0 "[ . 1 . 2]" 1 559 1 44 GLN QE 1 48 LEU HG . . 4.540 3.019 2.342 3.533 . 0 0 "[ . 1 . 2]" 1 560 1 44 GLN HE21 1 48 LEU MD2 . . 3.480 3.595 3.376 3.749 0.269 15 0 "[ . 1 . 2]" 1 561 1 44 GLN HE22 1 48 LEU MD2 . . 3.480 3.157 2.602 3.749 0.269 18 0 "[ . 1 . 2]" 1 562 1 45 LEU H 1 45 LEU HB2 . . 4.030 2.357 2.037 2.705 . 0 0 "[ . 1 . 2]" 1 563 1 45 LEU H 1 46 LYS H . . 3.030 2.339 2.102 2.645 . 0 0 "[ . 1 . 2]" 1 564 1 45 LEU H 1 47 PRO HD3 . . 5.100 4.403 3.994 4.665 . 0 0 "[ . 1 . 2]" 1 565 1 45 LEU H 1 49 ALA H . . 5.500 5.604 5.518 5.737 0.237 17 0 "[ . 1 . 2]" 1 566 1 45 LEU H 2 114 LEU QD . . 4.880 2.999 2.677 3.278 . 0 0 "[ . 1 . 2]" 1 567 1 45 LEU H 2 114 LEU HG . . 5.500 4.992 4.372 5.384 . 0 0 "[ . 1 . 2]" 1 568 1 45 LEU HA 1 45 LEU QD . . 4.190 2.139 1.933 2.998 . 0 0 "[ . 1 . 2]" 1 569 1 45 LEU HA 1 47 PRO HG2 . . 5.500 5.979 5.679 6.276 0.776 4 8 "[* *+* *1 - * *]" 1 570 1 45 LEU HA 1 48 LEU HB3 . . 5.500 5.500 5.069 5.936 0.436 4 0 "[ . 1 . 2]" 1 571 1 45 LEU HA 1 48 LEU MD1 . . 5.430 4.974 4.332 5.447 0.017 9 0 "[ . 1 . 2]" 1 572 1 45 LEU HA 1 48 LEU HG . . 5.500 5.062 4.608 5.502 0.002 9 0 "[ . 1 . 2]" 1 573 1 45 LEU HB2 1 45 LEU QD . . 2.430 2.175 2.076 2.355 . 0 0 "[ . 1 . 2]" 1 574 1 45 LEU HB2 1 46 LYS H . . 4.280 3.601 3.139 4.153 . 0 0 "[ . 1 . 2]" 1 575 1 45 LEU HB2 2 114 LEU QD . . 5.440 2.861 2.262 3.557 . 0 0 "[ . 1 . 2]" 1 576 1 45 LEU HB2 2 114 LEU HG . . 5.500 4.215 3.399 5.275 . 0 0 "[ . 1 . 2]" 1 577 1 45 LEU HB3 1 45 LEU QD . . 2.670 2.304 2.099 2.437 . 0 0 "[ . 1 . 2]" 1 578 1 45 LEU HB3 1 46 LYS H . . 4.150 2.626 2.172 3.187 . 0 0 "[ . 1 . 2]" 1 579 1 45 LEU HB3 2 114 LEU QB . . 5.340 4.123 3.597 4.514 . 0 0 "[ . 1 . 2]" 1 580 1 45 LEU HB3 2 114 LEU QD . . 5.440 1.902 1.692 2.259 . 0 0 "[ . 1 . 2]" 1 581 1 45 LEU HB3 2 114 LEU HG . . 5.500 3.344 2.296 4.231 . 0 0 "[ . 1 . 2]" 1 582 1 45 LEU QD 1 46 LYS H . . 5.060 3.904 3.419 4.247 . 0 0 "[ . 1 . 2]" 1 583 1 45 LEU QD 1 46 LYS HA . . 5.440 3.981 3.087 4.687 . 0 0 "[ . 1 . 2]" 1 584 1 45 LEU QD 1 46 LYS QB . . 5.280 4.598 3.966 4.950 . 0 0 "[ . 1 . 2]" 1 585 1 45 LEU QD 1 49 ALA HA . . 4.460 2.477 2.004 3.366 . 0 0 "[ . 1 . 2]" 1 586 1 45 LEU QD 2 114 LEU QD . . 2.680 2.487 1.687 2.766 0.086 20 0 "[ . 1 . 2]" 1 587 1 45 LEU QD 2 114 LEU HG . . 5.440 3.361 1.910 4.999 . 0 0 "[ . 1 . 2]" 1 588 1 45 LEU MD1 1 49 ALA MB . . 5.500 2.233 1.667 4.336 . 0 0 "[ . 1 . 2]" 1 589 1 45 LEU MD2 1 49 ALA MB . . 5.500 3.633 2.174 4.238 . 0 0 "[ . 1 . 2]" 1 590 1 45 LEU HG 2 114 LEU QB . . 5.340 4.454 3.651 5.253 . 0 0 "[ . 1 . 2]" 1 591 1 45 LEU HG 2 114 LEU QD . . 5.440 2.940 1.994 4.384 . 0 0 "[ . 1 . 2]" 1 592 1 46 LYS H 1 46 LYS QB . . 3.430 2.427 2.021 2.935 . 0 0 "[ . 1 . 2]" 1 593 1 46 LYS H 1 46 LYS QE . . 4.880 4.240 3.606 4.940 0.060 4 0 "[ . 1 . 2]" 1 594 1 46 LYS H 1 47 PRO HD3 . . 3.800 2.956 2.668 3.339 . 0 0 "[ . 1 . 2]" 1 595 1 46 LYS H 1 49 ALA H . . 4.930 4.812 4.649 4.938 0.008 6 0 "[ . 1 . 2]" 1 596 1 46 LYS H 2 114 LEU QB . . 5.340 5.352 5.078 5.484 0.144 8 0 "[ . 1 . 2]" 1 597 1 46 LYS H 2 114 LEU QD . . 3.170 2.439 2.176 2.670 . 0 0 "[ . 1 . 2]" 1 598 1 46 LYS H 2 114 LEU HG . . 5.110 4.794 4.410 5.034 . 0 0 "[ . 1 . 2]" 1 599 1 46 LYS H 2 117 ILE MD . . 4.770 4.132 3.818 4.601 . 0 0 "[ . 1 . 2]" 1 600 1 46 LYS HA 1 49 ALA H . . 4.710 4.444 3.904 4.714 0.004 3 0 "[ . 1 . 2]" 1 601 1 46 LYS HA 1 49 ALA MB . . 3.570 3.819 3.081 4.177 0.607 3 4 "[ + . 1 - ** 2]" 1 602 1 46 LYS HA 2 114 LEU QD . . 5.380 2.915 2.635 3.490 . 0 0 "[ . 1 . 2]" 1 603 1 46 LYS HA 2 114 LEU HG . . 5.500 5.562 5.130 5.778 0.278 15 0 "[ . 1 . 2]" 1 604 1 46 LYS HA 2 117 ILE MD . . 5.270 2.585 2.002 3.145 . 0 0 "[ . 1 . 2]" 1 605 1 46 LYS QB 1 46 LYS QD . . 3.210 2.237 1.983 2.418 . 0 0 "[ . 1 . 2]" 1 606 1 46 LYS QB 1 46 LYS QG . . 2.280 2.061 2.015 2.092 . 0 0 "[ . 1 . 2]" 1 607 1 46 LYS QB 1 47 PRO HA . . 5.150 4.500 3.729 4.897 . 0 0 "[ . 1 . 2]" 1 608 1 46 LYS QB 1 47 PRO HD3 . . 3.030 2.286 1.773 3.257 0.227 17 0 "[ . 1 . 2]" 1 609 1 46 LYS QB 2 114 LEU QD . . 4.530 2.312 1.939 3.607 . 0 0 "[ . 1 . 2]" 1 610 1 46 LYS QB 2 116 GLN QB . . 5.340 4.372 3.778 5.144 . 0 0 "[ . 1 . 2]" 1 611 1 46 LYS QB 2 117 ILE HB . . 5.340 5.024 4.023 5.481 0.141 9 0 "[ . 1 . 2]" 1 612 1 46 LYS QB 2 117 ILE MD . . 4.770 2.148 1.673 2.628 . 0 0 "[ . 1 . 2]" 1 613 1 46 LYS QB 2 117 ILE MG . . 5.340 4.951 4.049 5.457 0.117 13 0 "[ . 1 . 2]" 1 614 1 46 LYS HB2 2 117 ILE MD . . 5.500 2.471 2.106 3.596 . 0 0 "[ . 1 . 2]" 1 615 1 46 LYS HB3 2 117 ILE MD . . 5.500 3.030 1.697 3.904 . 0 0 "[ . 1 . 2]" 1 616 1 46 LYS QD 2 114 LEU HA . . 4.610 3.413 2.693 4.252 . 0 0 "[ . 1 . 2]" 1 617 1 46 LYS QD 2 114 LEU QD . . 4.850 3.098 2.281 3.892 . 0 0 "[ . 1 . 2]" 1 618 1 46 LYS QD 2 116 GLN QB . . 5.290 3.053 2.484 3.892 . 0 0 "[ . 1 . 2]" 1 619 1 46 LYS QD 2 117 ILE HB . . 5.340 5.426 5.195 5.589 0.249 16 0 "[ . 1 . 2]" 1 620 1 46 LYS QD 2 117 ILE MD . . 4.890 2.219 1.906 2.698 . 0 0 "[ . 1 . 2]" 1 621 1 46 LYS QE 2 116 GLN QB . . 5.330 4.257 3.136 4.976 . 0 0 "[ . 1 . 2]" 1 622 1 46 LYS HE2 2 117 ILE MD . . 5.500 3.909 2.447 4.521 . 0 0 "[ . 1 . 2]" 1 623 1 46 LYS HE3 2 117 ILE MD . . 5.500 3.987 2.462 4.780 . 0 0 "[ . 1 . 2]" 1 624 1 46 LYS QG 1 47 PRO HA . . 5.340 4.176 3.399 5.600 0.260 6 0 "[ . 1 . 2]" 1 625 1 46 LYS QG 1 47 PRO HG3 . . 5.210 4.018 3.330 4.731 . 0 0 "[ . 1 . 2]" 1 626 1 46 LYS QG 2 114 LEU QD . . 5.280 3.250 1.746 4.084 . 0 0 "[ . 1 . 2]" 1 627 1 46 LYS QG 2 117 ILE MD . . 5.340 2.504 1.760 3.502 . 0 0 "[ . 1 . 2]" 1 628 1 47 PRO HA 1 49 ALA H . . 5.080 4.276 4.019 4.478 . 0 0 "[ . 1 . 2]" 1 629 1 47 PRO HB2 1 48 LEU HA . . 5.500 4.125 4.004 4.232 . 0 0 "[ . 1 . 2]" 1 630 1 47 PRO HB2 1 48 LEU MD2 . . 3.710 2.582 2.316 2.873 . 0 0 "[ . 1 . 2]" 1 631 1 47 PRO HB2 1 48 LEU HG . . 3.860 3.762 3.523 3.959 0.099 12 0 "[ . 1 . 2]" 1 632 1 47 PRO HD3 1 48 LEU HG . . 4.290 4.344 4.215 4.427 0.137 18 0 "[ . 1 . 2]" 1 633 1 47 PRO HG2 1 48 LEU H . . 2.400 2.853 2.569 3.204 0.804 1 9 "[+* *** 1- * * *]" 1 634 1 47 PRO HG2 1 48 LEU MD2 . . 3.830 2.574 2.481 2.666 . 0 0 "[ . 1 . 2]" 1 635 1 47 PRO HG2 1 48 LEU HG . . 5.470 2.168 1.953 2.458 . 0 0 "[ . 1 . 2]" 1 636 1 47 PRO HG2 1 49 ALA H . . 5.040 5.170 4.934 5.390 0.350 1 0 "[ . 1 . 2]" 1 637 1 48 LEU H 1 48 LEU HA . . 2.800 2.920 2.893 2.937 0.137 2 0 "[ . 1 . 2]" 1 638 1 48 LEU H 1 48 LEU HB2 . . 4.050 2.737 2.652 2.859 . 0 0 "[ . 1 . 2]" 1 639 1 48 LEU H 1 48 LEU MD1 . . 3.830 3.897 3.847 3.948 0.118 1 0 "[ . 1 . 2]" 1 640 1 48 LEU H 1 48 LEU HG . . 2.450 2.501 2.413 2.571 0.121 1 0 "[ . 1 . 2]" 1 641 1 48 LEU H 1 49 ALA H . . 2.890 2.362 2.213 2.518 . 0 0 "[ . 1 . 2]" 1 642 1 48 LEU HA 1 48 LEU HB3 . . 2.610 2.341 2.297 2.372 . 0 0 "[ . 1 . 2]" 1 643 1 48 LEU HA 1 48 LEU MD2 . . 2.750 2.327 2.193 2.468 . 0 0 "[ . 1 . 2]" 1 644 1 48 LEU HA 1 49 ALA H . . 3.500 3.296 3.209 3.439 . 0 0 "[ . 1 . 2]" 1 645 1 48 LEU HA 1 51 SER H . . 4.370 3.503 3.412 3.609 . 0 0 "[ . 1 . 2]" 1 646 1 48 LEU HA 1 51 SER QB . . 3.050 3.101 3.009 3.193 0.143 14 0 "[ . 1 . 2]" 1 647 1 48 LEU HA 1 52 ILE H . . 4.490 4.112 3.879 4.250 . 0 0 "[ . 1 . 2]" 1 648 1 48 LEU HB2 1 48 LEU MD1 . . 2.860 2.307 2.253 2.358 . 0 0 "[ . 1 . 2]" 1 649 1 48 LEU HB2 1 48 LEU MD2 . . 3.200 3.207 3.190 3.215 0.015 17 0 "[ . 1 . 2]" 1 650 1 48 LEU HB2 1 49 ALA H . . 4.510 3.578 3.278 3.704 . 0 0 "[ . 1 . 2]" 1 651 1 48 LEU HB2 1 49 ALA MB . . 4.670 4.915 4.732 5.064 0.394 7 0 "[ . 1 . 2]" 1 652 1 48 LEU HB2 1 52 ILE MG . . 4.490 2.865 2.644 2.960 . 0 0 "[ . 1 . 2]" 1 653 1 48 LEU HB3 1 48 LEU MD1 . . 2.840 2.281 2.235 2.326 . 0 0 "[ . 1 . 2]" 1 654 1 48 LEU HB3 1 48 LEU MD2 . . 2.620 2.447 2.405 2.488 . 0 0 "[ . 1 . 2]" 1 655 1 48 LEU HB3 1 49 ALA H . . 4.110 4.392 4.219 4.492 0.382 4 0 "[ . 1 . 2]" 1 656 1 48 LEU HB3 1 52 ILE MG . . 2.860 2.519 2.045 2.816 . 0 0 "[ . 1 . 2]" 1 657 1 48 LEU MD1 1 52 ILE H . . 5.320 4.640 4.344 4.908 . 0 0 "[ . 1 . 2]" 1 658 1 48 LEU MD1 1 52 ILE HB . . 5.460 4.749 4.436 5.131 . 0 0 "[ . 1 . 2]" 1 659 1 48 LEU MD1 1 52 ILE MG . . 3.410 2.521 2.301 2.740 . 0 0 "[ . 1 . 2]" 1 660 1 48 LEU MD2 1 51 SER QB . . 3.660 3.662 3.518 3.727 0.067 5 0 "[ . 1 . 2]" 1 661 1 48 LEU MD2 1 52 ILE QG . . 5.500 4.422 4.226 4.696 . 0 0 "[ . 1 . 2]" 1 662 1 49 ALA H 1 49 ALA MB . . 2.550 2.273 2.099 2.337 . 0 0 "[ . 1 . 2]" 1 663 1 49 ALA H 1 51 SER H . . 5.110 4.188 4.108 4.328 . 0 0 "[ . 1 . 2]" 1 664 1 49 ALA H 1 52 ILE H . . 5.040 4.676 4.584 4.745 . 0 0 "[ . 1 . 2]" 1 665 1 49 ALA H 1 52 ILE QG . . 5.300 3.658 3.380 3.765 . 0 0 "[ . 1 . 2]" 1 666 1 49 ALA HA 1 52 ILE H . . 4.260 3.699 3.486 3.869 . 0 0 "[ . 1 . 2]" 1 667 1 49 ALA HA 1 52 ILE HB . . 4.940 5.062 4.967 5.129 0.189 15 0 "[ . 1 . 2]" 1 668 1 49 ALA HA 1 52 ILE MD . . 4.820 2.254 2.070 2.497 . 0 0 "[ . 1 . 2]" 1 669 1 49 ALA HA 1 52 ILE MG . . 5.500 4.885 4.585 5.031 . 0 0 "[ . 1 . 2]" 1 670 1 49 ALA HA 1 53 ASN H . . 3.050 2.937 2.672 3.135 0.085 16 0 "[ . 1 . 2]" 1 671 1 49 ALA HA 1 53 ASN QB . . 4.030 2.947 2.483 3.444 . 0 0 "[ . 1 . 2]" 1 672 1 49 ALA MB 1 50 GLU QG . . 5.340 3.846 3.557 4.169 . 0 0 "[ . 1 . 2]" 1 673 1 49 ALA MB 1 52 ILE QG . . 5.500 3.988 3.755 4.136 . 0 0 "[ . 1 . 2]" 1 674 1 49 ALA MB 2 117 ILE HB . . 5.500 5.551 5.080 5.732 0.232 1 0 "[ . 1 . 2]" 1 675 1 49 ALA MB 2 117 ILE MG . . 4.780 3.849 3.352 4.148 . 0 0 "[ . 1 . 2]" 1 676 1 50 GLU H 1 50 GLU HB3 . . 2.700 2.583 2.486 2.676 . 0 0 "[ . 1 . 2]" 1 677 1 50 GLU H 1 50 GLU QG . . 2.620 1.948 1.820 2.104 . 0 0 "[ . 1 . 2]" 1 678 1 50 GLU H 1 51 SER H . . 2.740 2.648 2.588 2.716 . 0 0 "[ . 1 . 2]" 1 679 1 50 GLU H 1 52 ILE H . . 4.470 4.422 4.246 4.495 0.025 19 0 "[ . 1 . 2]" 1 680 1 50 GLU H 1 53 ASN H . . 5.410 4.984 4.848 5.176 . 0 0 "[ . 1 . 2]" 1 681 1 50 GLU HA 1 50 GLU HB2 . . 2.560 2.476 2.428 2.514 . 0 0 "[ . 1 . 2]" 1 682 1 50 GLU HA 1 50 GLU HB3 . . 2.700 2.405 2.349 2.460 . 0 0 "[ . 1 . 2]" 1 683 1 50 GLU HA 1 50 GLU HG2 . . 3.860 3.707 3.648 3.793 . 0 0 "[ . 1 . 2]" 1 684 1 50 GLU HA 1 50 GLU HG3 . . 3.860 3.777 3.730 3.863 0.003 2 0 "[ . 1 . 2]" 1 685 1 50 GLU HA 1 51 SER H . . 3.540 3.410 3.373 3.442 . 0 0 "[ . 1 . 2]" 1 686 1 50 GLU QG 1 51 SER H . . 2.640 2.537 2.375 2.663 0.023 1 0 "[ . 1 . 2]" 1 687 1 50 GLU QG 1 51 SER QB . . 3.920 3.427 2.738 3.831 . 0 0 "[ . 1 . 2]" 1 688 1 50 GLU QG 1 52 ILE H . . 5.070 4.528 4.362 4.699 . 0 0 "[ . 1 . 2]" 1 689 1 50 GLU HG2 1 51 SER H . . 3.130 2.982 2.730 3.193 0.063 19 0 "[ . 1 . 2]" 1 690 1 50 GLU HG3 1 51 SER H . . 3.130 2.781 2.466 3.118 . 0 0 "[ . 1 . 2]" 1 691 1 51 SER H 1 51 SER QB . . 2.390 2.412 2.309 2.463 0.073 3 0 "[ . 1 . 2]" 1 692 1 51 SER H 1 52 ILE H . . 3.310 2.325 2.171 2.413 . 0 0 "[ . 1 . 2]" 1 693 1 51 SER H 1 52 ILE MD . . 4.830 4.668 4.479 4.846 0.016 2 0 "[ . 1 . 2]" 1 694 1 51 SER H 1 52 ILE QG . . 3.450 3.501 3.459 3.550 0.100 20 0 "[ . 1 . 2]" 1 695 1 51 SER H 1 53 ASN H . . 4.390 3.921 3.707 4.037 . 0 0 "[ . 1 . 2]" 1 696 1 51 SER QB 1 52 ILE H . . 3.080 2.386 2.241 2.691 . 0 0 "[ . 1 . 2]" 1 697 1 52 ILE H 1 52 ILE HB . . 3.660 3.654 3.631 3.699 0.039 3 0 "[ . 1 . 2]" 1 698 1 52 ILE H 1 52 ILE MD . . 3.630 3.350 3.164 3.545 . 0 0 "[ . 1 . 2]" 1 699 1 52 ILE H 1 52 ILE QG . . 2.860 1.877 1.809 1.984 . 0 0 "[ . 1 . 2]" 1 700 1 52 ILE H 1 52 ILE MG . . 3.110 2.700 2.577 2.864 . 0 0 "[ . 1 . 2]" 1 701 1 52 ILE H 1 53 ASN H . . 3.100 2.624 2.471 2.809 . 0 0 "[ . 1 . 2]" 1 702 1 52 ILE H 1 54 GLN H . . 4.340 3.639 3.193 3.940 . 0 0 "[ . 1 . 2]" 1 703 1 52 ILE HA 1 52 ILE QG . . 3.890 3.406 3.375 3.433 . 0 0 "[ . 1 . 2]" 1 704 1 52 ILE HA 1 52 ILE MG . . 3.630 2.216 2.178 2.263 . 0 0 "[ . 1 . 2]" 1 705 1 52 ILE HA 1 54 GLN H . . 5.330 4.548 4.235 4.980 . 0 0 "[ . 1 . 2]" 1 706 1 52 ILE HA 1 54 GLN QB . . 5.340 4.863 4.253 5.561 0.221 3 0 "[ . 1 . 2]" 1 707 1 52 ILE HB 1 52 ILE MD . . 2.880 2.264 2.233 2.287 . 0 0 "[ . 1 . 2]" 1 708 1 52 ILE HB 1 53 ASN H . . 3.290 3.415 3.343 3.505 0.215 2 0 "[ . 1 . 2]" 1 709 1 52 ILE HB 1 53 ASN QB . . 4.730 4.528 4.170 4.917 0.187 16 0 "[ . 1 . 2]" 1 710 1 52 ILE HB 1 54 GLN H . . 5.500 5.359 5.099 5.615 0.115 6 0 "[ . 1 . 2]" 1 711 1 52 ILE MD 1 52 ILE MG . . 3.030 3.079 3.040 3.118 0.088 9 0 "[ . 1 . 2]" 1 712 1 52 ILE MD 1 53 ASN H . . 3.270 1.910 1.784 2.163 . 0 0 "[ . 1 . 2]" 1 713 1 52 ILE MD 1 53 ASN HA . . 5.500 3.149 2.916 3.329 . 0 0 "[ . 1 . 2]" 1 714 1 52 ILE MD 1 54 GLN H . . 4.150 3.852 3.694 4.009 . 0 0 "[ . 1 . 2]" 1 715 1 52 ILE MD 1 55 GLU H . . 5.500 5.264 4.658 5.561 0.061 9 0 "[ . 1 . 2]" 1 716 1 52 ILE QG 1 52 ILE MG . . 2.820 2.041 2.027 2.056 . 0 0 "[ . 1 . 2]" 1 717 1 52 ILE QG 1 53 ASN H . . 3.340 2.467 2.270 2.638 . 0 0 "[ . 1 . 2]" 1 718 1 52 ILE QG 1 54 GLN H . . 4.440 4.239 3.924 4.460 0.020 9 0 "[ . 1 . 2]" 1 719 1 52 ILE MG 1 53 ASN H . . 3.950 4.049 4.000 4.098 0.148 5 0 "[ . 1 . 2]" 1 720 1 52 ILE MG 1 53 ASN HA . . 5.500 5.360 5.271 5.417 . 0 0 "[ . 1 . 2]" 1 721 1 52 ILE MG 1 53 ASN QB . . 5.340 5.220 5.026 5.502 0.162 3 0 "[ . 1 . 2]" 1 722 1 53 ASN H 1 54 GLN H . . 2.810 2.211 2.084 2.347 . 0 0 "[ . 1 . 2]" 1 723 1 53 ASN QB 1 54 GLN H . . 2.800 2.688 2.428 2.950 0.150 10 0 "[ . 1 . 2]" 1 724 1 53 ASN QB 1 55 GLU H . . 4.580 2.807 2.392 3.476 . 0 0 "[ . 1 . 2]" 1 725 1 54 GLN H 1 54 GLN HA . . 2.710 2.234 2.150 2.295 . 0 0 "[ . 1 . 2]" 1 726 1 54 GLN H 1 54 GLN HB2 . . 4.200 3.305 2.988 4.010 . 0 0 "[ . 1 . 2]" 1 727 1 54 GLN H 1 54 GLN QB . . 3.610 3.033 2.847 3.352 . 0 0 "[ . 1 . 2]" 1 728 1 54 GLN H 1 54 GLN HB3 . . 4.200 3.657 2.961 4.129 . 0 0 "[ . 1 . 2]" 1 729 1 54 GLN H 1 54 GLN QE . . 4.630 4.878 3.391 5.517 0.887 6 9 "[ * *+ *-1*** . *2]" 1 730 1 54 GLN H 1 54 GLN QG . . 4.660 3.988 2.826 4.607 . 0 0 "[ . 1 . 2]" 1 731 1 54 GLN H 1 55 GLU H . . 2.990 2.705 2.412 3.083 0.093 8 0 "[ . 1 . 2]" 1 732 1 54 GLN HA 1 54 GLN QG . . 3.330 2.761 2.252 3.371 0.041 14 0 "[ . 1 . 2]" 1 733 1 54 GLN HA 1 55 GLU HA . . 5.270 4.520 4.255 4.734 . 0 0 "[ . 1 . 2]" 1 734 1 54 GLN QB 1 55 GLU H . . 4.470 3.651 2.820 4.031 . 0 0 "[ . 1 . 2]" 1 735 1 55 GLU H 1 55 GLU QB . . 3.420 2.669 2.053 3.140 . 0 0 "[ . 1 . 2]" 1 736 1 55 GLU HA 1 55 GLU QB . . 2.490 2.194 2.139 2.366 . 0 0 "[ . 1 . 2]" 1 737 1 55 GLU HA 1 90 LYS QB . . 5.500 4.385 3.676 4.801 . 0 0 "[ . 1 . 2]" 1 738 1 55 GLU HA 1 90 LYS HG2 . . 5.500 3.518 2.981 4.082 . 0 0 "[ . 1 . 2]" 1 739 1 55 GLU HA 1 90 LYS HG3 . . 5.500 4.840 3.752 5.576 0.076 20 0 "[ . 1 . 2]" 1 740 1 55 GLU QB 1 56 PRO QD . . 3.480 2.587 2.044 3.486 0.006 4 0 "[ . 1 . 2]" 1 741 1 55 GLU QB 1 90 LYS QB . . 3.550 3.467 2.043 4.400 0.850 5 5 "[ + * * * - 2]" 1 742 1 55 GLU QB 1 90 LYS QG . . 3.850 3.369 2.047 3.997 0.147 3 0 "[ . 1 . 2]" 1 743 1 56 PRO HA 1 58 PHE H . . 5.190 4.228 3.882 5.270 0.080 18 0 "[ . 1 . 2]" 1 744 1 56 PRO HB2 1 57 GLY H . . 2.950 2.427 2.068 2.882 . 0 0 "[ . 1 . 2]" 1 745 1 56 PRO HB2 1 58 PHE H . . 3.470 3.275 2.631 4.019 0.549 17 1 "[ . 1 . + 2]" 1 746 1 56 PRO QG 1 57 GLY H . . 4.020 2.395 1.875 3.297 . 0 0 "[ . 1 . 2]" 1 747 1 56 PRO QG 1 79 THR H . . 5.350 4.843 4.241 5.353 0.003 9 0 "[ . 1 . 2]" 1 748 1 57 GLY H 1 57 GLY HA3 . . 2.560 2.904 2.821 2.956 0.396 1 0 "[ . 1 . 2]" 1 749 1 57 GLY H 1 58 PHE H . . 3.310 3.220 2.692 3.586 0.276 17 0 "[ . 1 . 2]" 1 750 1 57 GLY H 1 58 PHE QB . . 5.340 4.488 4.226 4.708 . 0 0 "[ . 1 . 2]" 1 751 1 57 GLY H 1 59 LEU QD . . 5.440 5.408 5.258 5.512 0.072 6 0 "[ . 1 . 2]" 1 752 1 57 GLY H 1 78 PHE HA . . 5.500 4.748 4.198 5.158 . 0 0 "[ . 1 . 2]" 1 753 1 57 GLY H 1 79 THR H . . 4.640 4.203 3.746 4.695 0.055 20 0 "[ . 1 . 2]" 1 754 1 57 GLY H 1 79 THR MG . . 4.750 3.549 2.734 4.476 . 0 0 "[ . 1 . 2]" 1 755 1 57 GLY HA2 1 59 LEU QD . . 5.440 4.500 4.408 4.652 . 0 0 "[ . 1 . 2]" 1 756 1 57 GLY HA3 1 58 PHE H . . 2.780 2.692 2.371 3.547 0.767 18 3 "[ . 1 * . + -]" 1 757 1 57 GLY HA3 1 58 PHE QB . . 5.340 4.752 4.614 5.413 0.073 18 0 "[ . 1 . 2]" 1 758 1 57 GLY HA3 1 60 TRP H . . 5.500 4.439 4.092 4.925 . 0 0 "[ . 1 . 2]" 1 759 1 58 PHE H 1 58 PHE HD1 . . 4.910 3.160 2.452 3.982 . 0 0 "[ . 1 . 2]" 1 760 1 58 PHE H 1 78 PHE HA . . 5.450 5.213 3.745 5.567 0.117 17 0 "[ . 1 . 2]" 1 761 1 58 PHE H 1 79 THR H . . 5.500 4.742 3.275 5.200 . 0 0 "[ . 1 . 2]" 1 762 1 58 PHE HA 1 60 TRP H . . 5.500 5.448 5.160 5.611 0.111 10 0 "[ . 1 . 2]" 1 763 1 58 PHE HA 1 79 THR H . . 5.500 5.588 5.527 5.707 0.207 18 0 "[ . 1 . 2]" 1 764 1 58 PHE QB 1 58 PHE HD1 . . 3.180 2.487 2.401 2.595 . 0 0 "[ . 1 . 2]" 1 765 1 58 PHE QB 1 59 LEU H . . 3.360 2.660 2.489 2.877 . 0 0 "[ . 1 . 2]" 1 766 1 58 PHE QB 1 79 THR H . . 5.340 2.986 2.740 3.228 . 0 0 "[ . 1 . 2]" 1 767 1 58 PHE HD1 1 59 LEU H . . 5.400 4.789 4.583 5.518 0.118 12 0 "[ . 1 . 2]" 1 768 1 59 LEU H 1 59 LEU QD . . 2.660 1.912 1.759 2.019 . 0 0 "[ . 1 . 2]" 1 769 1 59 LEU H 1 59 LEU HG . . 4.520 4.089 3.984 4.164 . 0 0 "[ . 1 . 2]" 1 770 1 59 LEU H 1 60 TRP H . . 4.520 2.556 2.388 2.738 . 0 0 "[ . 1 . 2]" 1 771 1 59 LEU H 1 60 TRP HD1 . . 5.500 5.005 4.835 5.187 . 0 0 "[ . 1 . 2]" 1 772 1 59 LEU H 1 77 LEU HB2 . . 5.500 4.964 4.702 5.116 . 0 0 "[ . 1 . 2]" 1 773 1 59 LEU H 1 77 LEU QB . . 4.650 4.039 3.776 4.238 . 0 0 "[ . 1 . 2]" 1 774 1 59 LEU H 1 77 LEU HB3 . . 5.500 4.278 3.977 4.522 . 0 0 "[ . 1 . 2]" 1 775 1 59 LEU H 1 79 THR H . . 5.220 3.988 3.785 4.322 . 0 0 "[ . 1 . 2]" 1 776 1 59 LEU H 1 79 THR HA . . 5.500 4.442 4.100 4.872 . 0 0 "[ . 1 . 2]" 1 777 1 59 LEU HA 1 59 LEU QD . . 3.410 2.105 2.043 2.203 . 0 0 "[ . 1 . 2]" 1 778 1 59 LEU HA 1 59 LEU HG . . 3.690 3.691 3.625 3.727 0.037 12 0 "[ . 1 . 2]" 1 779 1 59 LEU HA 1 60 TRP HD1 . . 5.500 3.804 3.597 4.009 . 0 0 "[ . 1 . 2]" 1 780 1 59 LEU HA 1 77 LEU QB . . 5.340 4.508 4.368 4.699 . 0 0 "[ . 1 . 2]" 1 781 1 59 LEU QB 1 60 TRP HE1 . . 5.250 3.419 3.066 3.640 . 0 0 "[ . 1 . 2]" 1 782 1 59 LEU QB 2 122 LEU QD . . 5.280 4.814 4.459 5.357 0.077 5 0 "[ . 1 . 2]" 1 783 1 59 LEU QD 1 60 TRP H . . 4.540 3.411 3.207 3.494 . 0 0 "[ . 1 . 2]" 1 784 1 59 LEU QD 1 60 TRP HA . . 5.440 5.166 5.047 5.255 . 0 0 "[ . 1 . 2]" 1 785 1 59 LEU QD 1 60 TRP HD1 . . 4.840 4.050 3.937 4.225 . 0 0 "[ . 1 . 2]" 1 786 1 59 LEU QD 1 77 LEU QB . . 4.180 2.100 1.941 2.268 . 0 0 "[ . 1 . 2]" 1 787 1 59 LEU QD 1 78 PHE HA . . 4.000 2.966 2.781 3.075 . 0 0 "[ . 1 . 2]" 1 788 1 59 LEU QD 1 78 PHE HB3 . . 5.440 4.301 4.253 4.337 . 0 0 "[ . 1 . 2]" 1 789 1 59 LEU QD 1 78 PHE HD2 . . 5.440 5.288 4.971 5.584 0.144 6 0 "[ . 1 . 2]" 1 790 1 59 LEU QD 1 79 THR H . . 4.280 2.956 2.851 3.070 . 0 0 "[ . 1 . 2]" 1 791 1 59 LEU QD 1 79 THR HA . . 3.020 2.259 2.121 2.412 . 0 0 "[ . 1 . 2]" 1 792 1 59 LEU QD 1 79 THR HB . . 4.680 3.487 3.222 3.651 . 0 0 "[ . 1 . 2]" 1 793 1 59 LEU QD 1 79 THR MG . . 5.180 3.963 3.864 4.080 . 0 0 "[ . 1 . 2]" 1 794 1 59 LEU QD 1 80 ASP H . . 5.440 4.166 4.069 4.258 . 0 0 "[ . 1 . 2]" 1 795 1 59 LEU QD 1 80 ASP HA . . 5.050 4.978 4.640 5.201 0.151 13 0 "[ . 1 . 2]" 1 796 1 59 LEU MD1 1 60 TRP HD1 . . 5.500 4.422 4.210 4.679 . 0 0 "[ . 1 . 2]" 1 797 1 59 LEU MD1 1 78 PHE HA . . 5.320 5.405 5.252 5.509 0.189 18 0 "[ . 1 . 2]" 1 798 1 59 LEU MD1 1 79 THR H . . 4.880 5.018 4.977 5.079 0.199 12 0 "[ . 1 . 2]" 1 799 1 59 LEU MD1 1 79 THR HA . . 3.530 3.658 3.587 3.727 0.197 11 0 "[ . 1 . 2]" 1 800 1 59 LEU MD1 1 79 THR HB . . 5.350 4.818 4.680 4.949 . 0 0 "[ . 1 . 2]" 1 801 1 59 LEU MD2 1 60 TRP HD1 . . 5.500 4.708 4.603 4.842 . 0 0 "[ . 1 . 2]" 1 802 1 59 LEU MD2 1 78 PHE HA . . 5.320 2.979 2.791 3.092 . 0 0 "[ . 1 . 2]" 1 803 1 59 LEU MD2 1 79 THR H . . 4.880 2.977 2.868 3.096 . 0 0 "[ . 1 . 2]" 1 804 1 59 LEU MD2 1 79 THR HA . . 3.530 2.281 2.137 2.447 . 0 0 "[ . 1 . 2]" 1 805 1 59 LEU MD2 1 79 THR HB . . 5.350 3.578 3.283 3.763 . 0 0 "[ . 1 . 2]" 1 806 1 59 LEU HG 1 77 LEU HA . . 5.500 5.093 4.881 5.308 . 0 0 "[ . 1 . 2]" 1 807 1 59 LEU HG 1 77 LEU MD2 . . 2.820 2.396 2.061 2.876 0.056 4 0 "[ . 1 . 2]" 1 808 1 59 LEU HG 1 77 LEU HG . . 5.500 3.990 3.777 4.207 . 0 0 "[ . 1 . 2]" 1 809 1 59 LEU HG 1 78 PHE H . . 5.090 5.002 4.785 5.144 0.054 20 0 "[ . 1 . 2]" 1 810 1 60 TRP H 1 60 TRP HB2 . . 4.040 3.979 3.926 4.056 0.016 11 0 "[ . 1 . 2]" 1 811 1 60 TRP H 1 60 TRP QB . . 3.520 3.428 3.371 3.476 . 0 0 "[ . 1 . 2]" 1 812 1 60 TRP H 1 60 TRP HB3 . . 4.040 3.742 3.666 3.812 . 0 0 "[ . 1 . 2]" 1 813 1 60 TRP H 1 60 TRP HE1 . . 5.170 5.074 4.821 5.196 0.026 19 0 "[ . 1 . 2]" 1 814 1 60 TRP H 1 61 LYS H . . 4.490 4.338 4.291 4.392 . 0 0 "[ . 1 . 2]" 1 815 1 60 TRP H 1 77 LEU H . . 5.420 4.064 3.683 4.330 . 0 0 "[ . 1 . 2]" 1 816 1 60 TRP H 1 77 LEU QB . . 3.810 3.380 3.177 3.607 . 0 0 "[ . 1 . 2]" 1 817 1 60 TRP H 1 78 PHE H . . 5.500 5.602 5.509 5.677 0.177 4 0 "[ . 1 . 2]" 1 818 1 60 TRP HA 2 119 GLN H . . 5.500 5.559 5.262 5.691 0.191 4 0 "[ . 1 . 2]" 1 819 1 60 TRP QB 1 61 LYS H . . 2.920 1.910 1.789 2.097 . 0 0 "[ . 1 . 2]" 1 820 1 60 TRP QB 2 118 ASN H . . 5.130 4.358 4.004 4.817 . 0 0 "[ . 1 . 2]" 1 821 1 60 TRP QB 2 119 GLN H . . 5.290 4.337 4.041 4.913 . 0 0 "[ . 1 . 2]" 1 822 1 60 TRP HB2 1 61 LYS H . . 3.360 1.923 1.797 2.118 . 0 0 "[ . 1 . 2]" 1 823 1 60 TRP HB2 2 120 ALA MB . . 5.500 4.784 4.355 5.212 . 0 0 "[ . 1 . 2]" 1 824 1 60 TRP HB3 1 61 LYS H . . 3.360 3.278 3.105 3.402 0.042 18 0 "[ . 1 . 2]" 1 825 1 60 TRP HB3 2 120 ALA MB . . 5.500 3.347 2.885 3.772 . 0 0 "[ . 1 . 2]" 1 826 1 60 TRP HD1 1 77 LEU QB . . 5.340 2.981 2.801 3.320 . 0 0 "[ . 1 . 2]" 1 827 1 60 TRP HD1 1 77 LEU MD1 . . 5.500 4.387 4.161 5.040 . 0 0 "[ . 1 . 2]" 1 828 1 60 TRP HD1 1 77 LEU MD2 . . 5.500 3.285 3.009 3.729 . 0 0 "[ . 1 . 2]" 1 829 1 60 TRP HD1 2 120 ALA H . . 5.500 4.904 4.500 5.306 . 0 0 "[ . 1 . 2]" 1 830 1 60 TRP HD1 2 121 LYS HA . . 5.500 4.586 4.373 4.780 . 0 0 "[ . 1 . 2]" 1 831 1 60 TRP HD1 2 121 LYS HB2 . . 5.500 2.242 1.816 2.969 . 0 0 "[ . 1 . 2]" 1 832 1 60 TRP HD1 2 121 LYS HB3 . . 5.500 2.788 1.659 3.896 . 0 0 "[ . 1 . 2]" 1 833 1 60 TRP HD1 2 121 LYS QE . . 5.340 4.947 4.431 5.393 0.053 16 0 "[ . 1 . 2]" 1 834 1 60 TRP HE1 1 77 LEU HB2 . . 5.500 2.382 2.165 2.695 . 0 0 "[ . 1 . 2]" 1 835 1 60 TRP HE1 1 77 LEU HB3 . . 5.500 3.769 3.559 3.963 . 0 0 "[ . 1 . 2]" 1 836 1 60 TRP HE1 1 77 LEU MD2 . . 2.540 1.756 1.655 1.861 . 0 0 "[ . 1 . 2]" 1 837 1 60 TRP HE1 2 121 LYS H . . 5.500 4.954 4.368 5.285 . 0 0 "[ . 1 . 2]" 1 838 1 60 TRP HE1 2 121 LYS HA . . 5.500 5.549 4.915 5.797 0.297 16 0 "[ . 1 . 2]" 1 839 1 60 TRP HE1 2 121 LYS QB . . 2.830 2.674 2.056 2.903 0.073 3 0 "[ . 1 . 2]" 1 840 1 60 TRP HE1 2 121 LYS QE . . 5.340 4.830 4.133 5.463 0.123 8 0 "[ . 1 . 2]" 1 841 1 60 TRP HE1 2 122 LEU H . . 5.500 4.943 4.289 5.502 0.002 7 0 "[ . 1 . 2]" 1 842 1 60 TRP HE1 2 122 LEU HA . . 5.160 5.335 4.407 5.894 0.734 20 5 "[ * . * * - . +]" 1 843 1 60 TRP HE1 2 122 LEU QD . . 4.640 2.942 2.673 3.183 . 0 0 "[ . 1 . 2]" 1 844 1 60 TRP HE3 1 77 LEU MD1 . . 5.500 5.407 5.260 5.550 0.050 17 0 "[ . 1 . 2]" 1 845 1 60 TRP HZ2 1 77 LEU MD1 . . 3.160 1.907 1.754 1.991 . 0 0 "[ . 1 . 2]" 1 846 1 60 TRP HZ3 1 77 LEU H . . 4.300 4.400 4.322 4.469 0.169 17 0 "[ . 1 . 2]" 1 847 1 60 TRP HZ3 2 122 LEU QD . . 3.840 3.744 3.240 4.007 0.167 5 0 "[ . 1 . 2]" 1 848 1 60 TRP HZ3 2 122 LEU HG . . 5.470 5.350 3.603 5.519 0.049 7 0 "[ . 1 . 2]" 1 849 1 61 LYS H 1 61 LYS QB . . 3.560 2.570 2.391 2.812 . 0 0 "[ . 1 . 2]" 1 850 1 61 LYS H 1 61 LYS QD . . 5.340 4.372 2.617 4.970 . 0 0 "[ . 1 . 2]" 1 851 1 61 LYS H 1 62 VAL H . . 4.670 4.375 4.318 4.437 . 0 0 "[ . 1 . 2]" 1 852 1 61 LYS H 1 63 TRP HD1 . . 5.180 4.283 3.613 4.932 . 0 0 "[ . 1 . 2]" 1 853 1 61 LYS H 1 63 TRP HE1 . . 5.500 5.291 4.376 5.610 0.110 10 0 "[ . 1 . 2]" 1 854 1 61 LYS H 2 117 ILE MG . . 5.500 3.594 2.692 5.060 . 0 0 "[ . 1 . 2]" 1 855 1 61 LYS H 2 118 ASN H . . 5.500 4.768 4.463 5.086 . 0 0 "[ . 1 . 2]" 1 856 1 61 LYS H 2 118 ASN HB2 . . 5.470 3.735 1.822 5.353 . 0 0 "[ . 1 . 2]" 1 857 1 61 LYS H 2 118 ASN QB . . 4.750 3.426 1.725 4.492 . 0 0 "[ . 1 . 2]" 1 858 1 61 LYS H 2 118 ASN HB3 . . 5.470 4.410 2.131 5.530 0.060 17 0 "[ . 1 . 2]" 1 859 1 61 LYS H 2 119 GLN H . . 5.500 5.717 5.249 6.129 0.629 18 2 "[ . - 1 . + 2]" 1 860 1 61 LYS H 2 120 ALA H . . 5.500 5.813 5.225 6.314 0.814 6 4 "[ *+ *1 . - 2]" 1 861 1 61 LYS QB 2 117 ILE MG . . 5.260 2.777 2.032 3.769 . 0 0 "[ . 1 . 2]" 1 862 1 61 LYS QD 2 117 ILE MG . . 5.340 3.357 1.940 4.781 . 0 0 "[ . 1 . 2]" 1 863 1 61 LYS QG 1 62 VAL H . . 4.930 3.049 1.753 4.057 . 0 0 "[ . 1 . 2]" 1 864 1 62 VAL H 1 62 VAL QG . . 3.150 2.009 1.881 2.177 . 0 0 "[ . 1 . 2]" 1 865 1 62 VAL H 1 63 TRP H . . 5.500 4.398 4.214 4.479 . 0 0 "[ . 1 . 2]" 1 866 1 62 VAL H 1 63 TRP HD1 . . 5.500 4.942 4.633 5.539 0.039 9 0 "[ . 1 . 2]" 1 867 1 62 VAL HA 1 62 VAL QG . . 2.710 2.310 2.253 2.373 . 0 0 "[ . 1 . 2]" 1 868 1 62 VAL HA 1 63 TRP H . . 2.960 2.072 2.019 2.118 . 0 0 "[ . 1 . 2]" 1 869 1 62 VAL HA 1 63 TRP HD1 . . 4.250 3.228 2.742 3.861 . 0 0 "[ . 1 . 2]" 1 870 1 62 VAL HA 1 64 THR H . . 5.500 4.748 4.176 5.226 . 0 0 "[ . 1 . 2]" 1 871 1 62 VAL HB 1 75 ILE HA . . 5.500 5.137 4.378 5.537 0.037 7 0 "[ . 1 . 2]" 1 872 1 62 VAL HB 1 76 TYR QD . . 4.770 2.125 1.961 2.330 . 0 0 "[ . 1 . 2]" 1 873 1 62 VAL QG 1 63 TRP H . . 3.020 2.565 2.255 3.030 0.010 18 0 "[ . 1 . 2]" 1 874 1 62 VAL QG 1 63 TRP HA . . 3.630 3.461 3.311 3.646 0.016 10 0 "[ . 1 . 2]" 1 875 1 62 VAL QG 1 64 THR H . . 5.440 2.580 2.064 3.070 . 0 0 "[ . 1 . 2]" 1 876 1 62 VAL QG 1 64 THR HB . . 3.750 2.544 2.343 2.739 . 0 0 "[ . 1 . 2]" 1 877 1 62 VAL QG 1 73 GLY HA3 . . 5.440 3.051 2.807 3.348 . 0 0 "[ . 1 . 2]" 1 878 1 62 VAL QG 1 74 GLY H . . 4.530 1.863 1.733 2.346 . 0 0 "[ . 1 . 2]" 1 879 1 62 VAL QG 1 75 ILE H . . 5.080 3.004 2.103 3.919 . 0 0 "[ . 1 . 2]" 1 880 1 62 VAL QG 1 76 TYR QD . . 3.620 2.711 1.973 3.038 . 0 0 "[ . 1 . 2]" 1 881 1 62 VAL QG 1 76 TYR QE . . 4.180 2.852 2.540 3.024 . 0 0 "[ . 1 . 2]" 1 882 1 63 TRP H 1 64 THR H . . 4.180 3.547 3.119 3.845 . 0 0 "[ . 1 . 2]" 1 883 1 63 TRP H 2 111 ASN H . . 5.500 5.249 4.893 5.562 0.062 4 0 "[ . 1 . 2]" 1 884 1 63 TRP HA 2 113 PRO QG . . 5.350 5.429 5.264 5.516 0.166 16 0 "[ . 1 . 2]" 1 885 1 63 TRP HA 2 114 LEU H . . 5.500 4.337 4.038 4.793 . 0 0 "[ . 1 . 2]" 1 886 1 63 TRP QB 1 63 TRP HE1 . . 4.620 4.459 4.396 4.504 . 0 0 "[ . 1 . 2]" 1 887 1 63 TRP QB 1 64 THR H . . 4.190 3.885 3.756 3.994 . 0 0 "[ . 1 . 2]" 1 888 1 63 TRP QB 2 111 ASN H . . 5.260 3.207 2.807 3.735 . 0 0 "[ . 1 . 2]" 1 889 1 63 TRP QB 2 114 LEU H . . 4.200 3.207 2.859 3.698 . 0 0 "[ . 1 . 2]" 1 890 1 63 TRP HD1 2 114 LEU QB . . 4.580 3.961 3.000 4.584 0.004 7 0 "[ . 1 . 2]" 1 891 1 63 TRP HD1 2 115 SER HA . . 5.500 3.548 2.365 4.706 . 0 0 "[ . 1 . 2]" 1 892 1 63 TRP HE1 2 122 LEU HG . . 5.500 4.494 2.957 5.498 . 0 0 "[ . 1 . 2]" 1 893 1 63 TRP HZ2 2 122 LEU HB2 . . 5.500 5.525 5.069 5.659 0.159 16 0 "[ . 1 . 2]" 1 894 1 63 TRP HZ2 2 122 LEU HB3 . . 5.500 5.325 4.566 5.569 0.069 1 0 "[ . 1 . 2]" 1 895 1 63 TRP HZ2 2 122 LEU QD . . 5.010 3.335 2.425 4.584 . 0 0 "[ . 1 . 2]" 1 896 1 64 THR H 1 65 GLU H . . 4.590 4.245 4.150 4.375 . 0 0 "[ . 1 . 2]" 1 897 1 64 THR H 1 72 ALA MB . . 5.500 5.129 4.786 5.495 . 0 0 "[ . 1 . 2]" 1 898 1 64 THR H 1 73 GLY H . . 4.680 4.583 4.234 4.735 0.055 20 0 "[ . 1 . 2]" 1 899 1 64 THR H 1 73 GLY HA3 . . 5.500 5.623 5.555 5.685 0.185 7 0 "[ . 1 . 2]" 1 900 1 64 THR HA 1 65 GLU H . . 3.050 2.163 2.099 2.266 . 0 0 "[ . 1 . 2]" 1 901 1 64 THR HA 1 73 GLY HA2 . . 5.500 5.334 5.172 5.525 0.025 16 0 "[ . 1 . 2]" 1 902 1 64 THR HA 2 111 ASN H . . 3.440 2.499 2.084 2.908 . 0 0 "[ . 1 . 2]" 1 903 1 64 THR HB 1 65 GLU H . . 4.200 4.015 3.840 4.143 . 0 0 "[ . 1 . 2]" 1 904 1 64 THR HB 1 72 ALA MB . . 4.750 4.817 4.608 4.925 0.175 7 0 "[ . 1 . 2]" 1 905 1 64 THR HB 1 73 GLY HA2 . . 5.500 2.557 2.263 2.884 . 0 0 "[ . 1 . 2]" 1 906 1 64 THR HB 1 73 GLY HA3 . . 4.650 3.943 3.727 4.222 . 0 0 "[ . 1 . 2]" 1 907 1 64 THR HB 2 108 PHE QB . . 5.500 4.287 4.163 4.471 . 0 0 "[ . 1 . 2]" 1 908 1 64 THR HB 2 108 PHE QD . . 4.640 4.412 3.556 4.708 0.068 6 0 "[ . 1 . 2]" 1 909 1 64 THR HB 2 111 ASN H . . 5.500 5.316 5.018 5.616 0.116 15 0 "[ . 1 . 2]" 1 910 1 64 THR MG 1 65 GLU H . . 2.840 2.434 2.212 2.563 . 0 0 "[ . 1 . 2]" 1 911 1 64 THR MG 1 66 SER H . . 4.530 3.723 3.206 4.082 . 0 0 "[ . 1 . 2]" 1 912 1 64 THR MG 1 72 ALA HA . . 3.200 3.182 2.775 3.368 0.168 4 0 "[ . 1 . 2]" 1 913 1 64 THR MG 1 73 GLY H . . 5.000 2.315 2.093 2.497 . 0 0 "[ . 1 . 2]" 1 914 1 64 THR MG 2 108 PHE HA . . 5.500 3.795 3.619 4.045 . 0 0 "[ . 1 . 2]" 1 915 1 64 THR MG 2 108 PHE QB . . 5.500 1.916 1.810 2.097 . 0 0 "[ . 1 . 2]" 1 916 1 64 THR MG 2 108 PHE QD . . 3.730 2.048 1.743 2.384 . 0 0 "[ . 1 . 2]" 1 917 1 65 GLU H 1 65 GLU QB . . 3.360 2.760 2.567 2.822 . 0 0 "[ . 1 . 2]" 1 918 1 65 GLU H 1 65 GLU QG . . 5.040 4.134 4.024 4.204 . 0 0 "[ . 1 . 2]" 1 919 1 65 GLU H 1 66 SER HA . . 5.500 4.373 4.033 4.577 . 0 0 "[ . 1 . 2]" 1 920 1 65 GLU H 1 72 ALA MB . . 5.490 4.831 4.440 5.201 . 0 0 "[ . 1 . 2]" 1 921 1 65 GLU H 1 73 GLY H . . 5.200 4.435 4.089 4.647 . 0 0 "[ . 1 . 2]" 1 922 1 65 GLU H 2 108 PHE QB . . 5.500 4.427 4.194 4.710 . 0 0 "[ . 1 . 2]" 1 923 1 65 GLU H 2 108 PHE QD . . 4.310 4.747 4.396 5.074 0.764 6 7 "[ * .+ 1* .-***2]" 1 924 1 65 GLU H 2 109 ASP H . . 3.650 3.683 3.364 3.858 0.208 2 0 "[ . 1 . 2]" 1 925 1 65 GLU H 2 111 ASN H . . 4.530 3.774 2.971 4.352 . 0 0 "[ . 1 . 2]" 1 926 1 65 GLU H 2 111 ASN HA . . 5.500 4.777 4.244 5.401 . 0 0 "[ . 1 . 2]" 1 927 1 65 GLU HA 1 65 GLU HG2 . . 4.030 2.991 2.823 3.106 . 0 0 "[ . 1 . 2]" 1 928 1 65 GLU HA 1 65 GLU QG . . 3.200 2.462 2.383 2.555 . 0 0 "[ . 1 . 2]" 1 929 1 65 GLU HA 1 65 GLU HG3 . . 4.030 2.624 2.497 2.728 . 0 0 "[ . 1 . 2]" 1 930 1 65 GLU HA 1 66 SER H . . 2.910 2.180 2.106 2.270 . 0 0 "[ . 1 . 2]" 1 931 1 65 GLU HA 1 72 ALA MB . . 2.930 2.540 2.147 2.959 0.029 3 0 "[ . 1 . 2]" 1 932 1 65 GLU HA 1 73 GLY H . . 5.180 3.427 3.133 3.649 . 0 0 "[ . 1 . 2]" 1 933 1 65 GLU QG 1 66 SER H . . 3.190 2.986 2.600 3.244 0.054 18 0 "[ . 1 . 2]" 1 934 1 65 GLU QG 1 67 GLU H . . 5.340 3.649 3.064 4.419 . 0 0 "[ . 1 . 2]" 1 935 1 65 GLU QG 1 72 ALA MB . . 4.790 2.749 2.331 3.238 . 0 0 "[ . 1 . 2]" 1 936 1 65 GLU QG 1 73 GLY H . . 5.340 5.326 5.096 5.428 0.088 17 0 "[ . 1 . 2]" 1 937 1 66 SER H 1 66 SER HB2 . . 3.860 3.051 2.558 3.810 . 0 0 "[ . 1 . 2]" 1 938 1 66 SER H 1 66 SER QB . . 3.350 2.716 2.468 3.205 . 0 0 "[ . 1 . 2]" 1 939 1 66 SER H 1 66 SER HB3 . . 3.860 3.356 2.638 3.916 0.056 1 0 "[ . 1 . 2]" 1 940 1 66 SER H 1 67 GLU H . . 4.010 3.887 3.587 4.177 0.167 17 0 "[ . 1 . 2]" 1 941 1 66 SER H 1 68 LYS H . . 5.500 5.544 5.395 5.707 0.207 17 0 "[ . 1 . 2]" 1 942 1 66 SER H 1 69 ASN H . . 5.500 5.189 5.062 5.350 . 0 0 "[ . 1 . 2]" 1 943 1 66 SER H 1 69 ASN QB . . 5.500 4.562 4.210 5.299 . 0 0 "[ . 1 . 2]" 1 944 1 66 SER H 1 70 HIS H . . 5.270 5.100 4.893 5.242 . 0 0 "[ . 1 . 2]" 1 945 1 66 SER H 1 71 GLU H . . 3.720 3.689 3.328 3.844 0.124 2 0 "[ . 1 . 2]" 1 946 1 66 SER H 1 72 ALA MB . . 4.620 3.155 2.710 3.714 . 0 0 "[ . 1 . 2]" 1 947 1 66 SER H 1 73 GLY H . . 5.500 4.261 3.702 4.622 . 0 0 "[ . 1 . 2]" 1 948 1 66 SER H 2 109 ASP H . . 5.500 4.477 4.019 5.247 . 0 0 "[ . 1 . 2]" 1 949 1 66 SER H 2 109 ASP QB . . 5.340 4.414 3.619 5.335 . 0 0 "[ . 1 . 2]" 1 950 1 66 SER HA 1 67 GLU H . . 2.830 2.153 2.013 2.292 . 0 0 "[ . 1 . 2]" 1 951 1 66 SER HA 1 68 LYS H . . 3.650 3.537 3.357 3.698 0.048 15 0 "[ . 1 . 2]" 1 952 1 66 SER HA 1 68 LYS QE . . 5.340 3.972 2.650 5.042 . 0 0 "[ . 1 . 2]" 1 953 1 66 SER HA 1 71 GLU H . . 5.500 4.977 4.654 5.277 . 0 0 "[ . 1 . 2]" 1 954 1 66 SER QB 1 67 GLU H . . 4.020 3.711 3.387 4.012 . 0 0 "[ . 1 . 2]" 1 955 1 66 SER QB 1 68 LYS QD . . 3.650 3.185 2.425 3.788 0.138 7 0 "[ . 1 . 2]" 1 956 1 66 SER QB 1 71 GLU H . . 4.690 3.100 2.436 4.093 . 0 0 "[ . 1 . 2]" 1 957 1 67 GLU H 1 67 GLU QB . . 3.540 2.634 2.518 2.835 . 0 0 "[ . 1 . 2]" 1 958 1 67 GLU H 1 67 GLU QG . . 2.920 2.263 1.718 3.051 0.131 12 0 "[ . 1 . 2]" 1 959 1 67 GLU H 1 68 LYS H . . 3.070 2.475 2.363 2.684 . 0 0 "[ . 1 . 2]" 1 960 1 67 GLU H 1 68 LYS QD . . 3.060 2.918 2.633 3.111 0.051 17 0 "[ . 1 . 2]" 1 961 1 67 GLU H 1 68 LYS HE2 . . 5.500 4.965 3.935 5.603 0.103 16 0 "[ . 1 . 2]" 1 962 1 67 GLU H 1 68 LYS HE3 . . 5.500 4.791 3.749 5.697 0.197 14 0 "[ . 1 . 2]" 1 963 1 67 GLU H 1 68 LYS QG . . 4.630 4.813 4.419 5.130 0.500 6 0 "[ . 1 . 2]" 1 964 1 67 GLU H 1 69 ASN H . . 4.290 3.981 3.726 4.195 . 0 0 "[ . 1 . 2]" 1 965 1 67 GLU H 1 71 GLU H . . 5.470 5.169 4.894 5.430 . 0 0 "[ . 1 . 2]" 1 966 1 67 GLU HA 1 67 GLU QB . . 2.420 2.174 2.144 2.190 . 0 0 "[ . 1 . 2]" 1 967 1 67 GLU HA 1 67 GLU QG . . 3.680 3.417 3.324 3.553 . 0 0 "[ . 1 . 2]" 1 968 1 67 GLU HA 1 70 HIS H . . 3.280 3.235 3.078 3.400 0.120 17 0 "[ . 1 . 2]" 1 969 1 67 GLU HA 1 70 HIS HD2 . . 5.500 5.390 4.848 5.571 0.071 14 0 "[ . 1 . 2]" 1 970 1 67 GLU HA 1 71 GLU H . . 5.160 4.059 3.662 4.585 . 0 0 "[ . 1 . 2]" 1 971 1 67 GLU QB 1 68 LYS H . . 4.120 3.511 3.398 3.664 . 0 0 "[ . 1 . 2]" 1 972 1 67 GLU QB 1 68 LYS QD . . 5.180 4.377 4.038 4.655 . 0 0 "[ . 1 . 2]" 1 973 1 67 GLU QB 1 70 HIS H . . 5.340 4.699 4.539 4.878 . 0 0 "[ . 1 . 2]" 1 974 1 67 GLU QG 1 68 LYS H . . 2.770 2.436 2.157 2.993 0.223 2 0 "[ . 1 . 2]" 1 975 1 67 GLU QG 1 68 LYS HA . . 4.470 3.692 3.237 5.025 0.555 2 2 "[ + . 1 -. 2]" 1 976 1 67 GLU QG 1 68 LYS QB . . 5.050 3.392 2.942 4.615 . 0 0 "[ . 1 . 2]" 1 977 1 67 GLU QG 1 68 LYS QD . . 3.160 2.943 2.292 3.320 0.160 2 0 "[ . 1 . 2]" 1 978 1 68 LYS H 1 68 LYS QD . . 2.390 1.704 1.576 1.888 . 0 0 "[ . 1 . 2]" 1 979 1 68 LYS H 1 68 LYS QG . . 2.700 3.004 2.632 3.324 0.624 11 2 "[ . 1+- . 2]" 1 980 1 68 LYS H 1 69 ASN H . . 3.030 2.526 2.146 2.792 . 0 0 "[ . 1 . 2]" 1 981 1 68 LYS H 1 70 HIS HA . . 5.500 5.390 5.140 5.584 0.084 17 0 "[ . 1 . 2]" 1 982 1 68 LYS HA 1 68 LYS QG . . 3.660 3.554 3.499 3.616 . 0 0 "[ . 1 . 2]" 1 983 1 68 LYS HA 1 70 HIS HD2 . . 5.500 3.686 3.151 4.114 . 0 0 "[ . 1 . 2]" 1 984 1 68 LYS QB 1 68 LYS QE . . 4.120 2.996 1.911 3.894 . 0 0 "[ . 1 . 2]" 1 985 1 68 LYS QB 1 68 LYS QG . . 2.310 2.006 1.996 2.015 . 0 0 "[ . 1 . 2]" 1 986 1 68 LYS QB 1 70 HIS H . . 5.340 4.931 4.798 5.260 . 0 0 "[ . 1 . 2]" 1 987 1 68 LYS QD 1 68 LYS QE . . 2.250 2.050 1.996 2.096 . 0 0 "[ . 1 . 2]" 1 988 1 68 LYS QD 1 70 HIS H . . 5.340 4.600 4.016 4.961 . 0 0 "[ . 1 . 2]" 1 989 1 68 LYS QG 1 69 ASN H . . 2.640 2.759 2.212 3.254 0.614 11 2 "[ - 1+ . 2]" 1 990 1 68 LYS QG 1 70 HIS H . . 4.100 4.698 4.276 5.091 0.991 15 13 "[ -** *1** *+*****]" 1 991 1 69 ASN H 1 69 ASN QB . . 2.630 2.310 2.243 2.448 . 0 0 "[ . 1 . 2]" 1 992 1 69 ASN H 1 70 HIS HD2 . . 5.040 4.191 3.923 4.414 . 0 0 "[ . 1 . 2]" 1 993 1 69 ASN H 1 71 GLU H . . 4.400 3.768 3.475 4.059 . 0 0 "[ . 1 . 2]" 1 994 1 69 ASN HA 1 70 HIS HD2 . . 4.770 3.537 3.285 3.910 . 0 0 "[ . 1 . 2]" 1 995 1 69 ASN HA 1 71 GLU H . . 5.500 4.833 4.588 5.123 . 0 0 "[ . 1 . 2]" 1 996 1 69 ASN HA 1 71 GLU QB . . 5.500 4.695 4.458 4.994 . 0 0 "[ . 1 . 2]" 1 997 1 69 ASN QB 1 70 HIS H . . 3.630 2.974 2.687 3.169 . 0 0 "[ . 1 . 2]" 1 998 1 69 ASN QB 1 70 HIS HB2 . . 5.500 5.028 4.886 5.145 . 0 0 "[ . 1 . 2]" 1 999 1 69 ASN QB 1 70 HIS HD2 . . 5.270 4.899 4.827 4.975 . 0 0 "[ . 1 . 2]" 1 1000 1 69 ASN QB 1 71 GLU H . . 4.170 2.915 2.470 3.091 . 0 0 "[ . 1 . 2]" 1 1001 1 70 HIS H 1 70 HIS HA . . 2.740 2.258 2.236 2.275 . 0 0 "[ . 1 . 2]" 1 1002 1 70 HIS H 1 71 GLU H . . 2.770 2.502 2.325 2.649 . 0 0 "[ . 1 . 2]" 1 1003 1 70 HIS H 1 71 GLU HA . . 5.500 5.161 5.032 5.228 . 0 0 "[ . 1 . 2]" 1 1004 1 70 HIS H 1 71 GLU QB . . 5.500 4.211 3.858 4.423 . 0 0 "[ . 1 . 2]" 1 1005 1 70 HIS HA 1 70 HIS HD2 . . 4.960 3.822 3.470 3.981 . 0 0 "[ . 1 . 2]" 1 1006 1 70 HIS HA 1 71 GLU H . . 3.170 2.674 2.464 2.821 . 0 0 "[ . 1 . 2]" 1 1007 1 70 HIS HA 1 72 ALA MB . . 5.500 5.494 5.325 5.587 0.087 16 0 "[ . 1 . 2]" 1 1008 1 70 HIS HB2 1 71 GLU H . . 5.340 4.258 4.162 4.386 . 0 0 "[ . 1 . 2]" 1 1009 1 70 HIS HB3 1 71 GLU H . . 5.060 4.399 4.328 4.436 . 0 0 "[ . 1 . 2]" 1 1010 1 71 GLU H 1 72 ALA H . . 4.440 4.281 4.204 4.350 . 0 0 "[ . 1 . 2]" 1 1011 1 71 GLU HA 1 71 GLU QG . . 3.220 2.484 2.353 2.626 . 0 0 "[ . 1 . 2]" 1 1012 1 71 GLU HA 1 72 ALA MB . . 5.500 3.888 3.791 4.031 . 0 0 "[ . 1 . 2]" 1 1013 1 71 GLU QB 1 72 ALA H . . 4.930 3.537 3.401 3.663 . 0 0 "[ . 1 . 2]" 1 1014 1 71 GLU QG 1 72 ALA H . . 4.380 2.424 1.977 2.588 . 0 0 "[ . 1 . 2]" 1 1015 1 71 GLU QG 1 72 ALA HA . . 4.880 3.740 3.141 4.424 . 0 0 "[ . 1 . 2]" 1 1016 1 71 GLU QG 1 73 GLY H . . 3.680 4.056 3.177 4.703 1.023 3 10 "[ *+*.* - ** *.* * 2]" 1 1017 1 72 ALA H 1 72 ALA MB . . 2.880 2.633 2.573 2.703 . 0 0 "[ . 1 . 2]" 1 1018 1 72 ALA H 1 73 GLY H . . 4.370 3.974 3.705 4.170 . 0 0 "[ . 1 . 2]" 1 1019 1 72 ALA H 1 73 GLY HA2 . . 5.500 5.518 5.354 5.600 0.100 2 0 "[ . 1 . 2]" 1 1020 1 72 ALA MB 1 73 GLY H . . 4.060 3.162 2.934 3.405 . 0 0 "[ . 1 . 2]" 1 1021 1 72 ALA MB 1 73 GLY HA2 . . 4.500 4.098 3.937 4.229 . 0 0 "[ . 1 . 2]" 1 1022 1 72 ALA MB 1 73 GLY HA3 . . 5.000 4.200 4.109 4.360 . 0 0 "[ . 1 . 2]" 1 1023 1 73 GLY H 1 74 GLY H . . 4.850 4.273 4.080 4.412 . 0 0 "[ . 1 . 2]" 1 1024 1 73 GLY HA2 1 74 GLY H . . 3.310 2.520 2.268 2.758 . 0 0 "[ . 1 . 2]" 1 1025 1 73 GLY HA3 1 74 GLY H . . 2.940 2.600 2.382 2.846 . 0 0 "[ . 1 . 2]" 1 1026 1 74 GLY QA 1 75 ILE QG . . 3.690 3.018 2.754 3.172 . 0 0 "[ . 1 . 2]" 1 1027 1 75 ILE H 1 75 ILE HB . . 3.130 2.839 2.729 2.885 . 0 0 "[ . 1 . 2]" 1 1028 1 75 ILE H 1 75 ILE QG . . 3.520 2.648 2.500 3.026 . 0 0 "[ . 1 . 2]" 1 1029 1 75 ILE H 1 75 ILE MG . . 4.080 3.930 3.898 3.946 . 0 0 "[ . 1 . 2]" 1 1030 1 75 ILE H 1 76 TYR H . . 4.450 4.267 4.037 4.342 . 0 0 "[ . 1 . 2]" 1 1031 1 75 ILE H 1 76 TYR QB . . 5.340 4.244 4.069 4.417 . 0 0 "[ . 1 . 2]" 1 1032 1 75 ILE HA 1 75 ILE MD . . 3.600 2.745 2.353 3.789 0.189 10 0 "[ . 1 . 2]" 1 1033 1 75 ILE HA 1 75 ILE MG . . 3.710 2.345 2.284 2.434 . 0 0 "[ . 1 . 2]" 1 1034 1 75 ILE HA 1 76 TYR QD . . 4.330 3.718 3.391 3.992 . 0 0 "[ . 1 . 2]" 1 1035 1 75 ILE HA 1 76 TYR QE . . 5.500 5.334 5.040 5.520 0.020 19 0 "[ . 1 . 2]" 1 1036 1 75 ILE HB 1 75 ILE MD . . 3.340 3.079 2.516 3.268 . 0 0 "[ . 1 . 2]" 1 1037 1 75 ILE HB 1 76 TYR H . . 4.260 3.989 3.779 4.312 0.052 7 0 "[ . 1 . 2]" 1 1038 1 75 ILE MD 1 75 ILE MG . . 2.400 1.980 1.869 2.099 . 0 0 "[ . 1 . 2]" 1 1039 1 75 ILE MD 2 75 ILE QG . . 5.340 2.488 1.910 2.763 . 0 0 "[ . 1 . 2]" 1 1040 1 75 ILE QG 2 75 ILE MD . . 5.340 2.617 1.912 3.802 . 0 0 "[ . 1 . 2]" 1 1041 1 75 ILE MG 1 76 TYR H . . 3.800 2.701 2.418 3.105 . 0 0 "[ . 1 . 2]" 1 1042 1 75 ILE MG 1 77 LEU HA . . 5.500 5.222 4.860 5.437 . 0 0 "[ . 1 . 2]" 1 1043 1 76 TYR H 1 76 TYR QB . . 3.660 3.223 3.092 3.320 . 0 0 "[ . 1 . 2]" 1 1044 1 76 TYR H 1 76 TYR QD . . 5.490 3.090 2.771 3.408 . 0 0 "[ . 1 . 2]" 1 1045 1 76 TYR HA 1 77 LEU H . . 2.630 2.488 2.380 2.649 0.019 6 0 "[ . 1 . 2]" 1 1046 1 76 TYR QB 1 77 LEU H . . 2.570 2.159 1.969 2.319 . 0 0 "[ . 1 . 2]" 1 1047 1 77 LEU H 1 78 PHE H . . 4.680 4.455 4.393 4.547 . 0 0 "[ . 1 . 2]" 1 1048 1 77 LEU H 2 122 LEU QD . . 5.440 4.741 4.550 5.104 . 0 0 "[ . 1 . 2]" 1 1049 1 77 LEU HA 1 77 LEU HG . . 4.270 2.569 2.514 2.659 . 0 0 "[ . 1 . 2]" 1 1050 1 77 LEU QB 1 77 LEU MD2 . . 3.160 2.088 2.059 2.112 . 0 0 "[ . 1 . 2]" 1 1051 1 77 LEU QB 1 78 PHE H . . 3.870 3.083 2.901 3.174 . 0 0 "[ . 1 . 2]" 1 1052 1 77 LEU QB 2 122 LEU QD . . 5.280 4.381 4.218 4.656 . 0 0 "[ . 1 . 2]" 1 1053 1 77 LEU HB2 1 78 PHE H . . 4.560 4.239 4.152 4.285 . 0 0 "[ . 1 . 2]" 1 1054 1 77 LEU HB3 1 78 PHE H . . 4.560 3.167 2.962 3.272 . 0 0 "[ . 1 . 2]" 1 1055 1 77 LEU MD2 2 121 LYS HG2 . . 5.500 3.402 1.732 4.589 . 0 0 "[ . 1 . 2]" 1 1056 1 77 LEU MD2 2 121 LYS QG . . 4.650 2.573 1.720 3.715 . 0 0 "[ . 1 . 2]" 1 1057 1 77 LEU MD2 2 121 LYS HG3 . . 5.500 2.920 2.298 3.957 . 0 0 "[ . 1 . 2]" 1 1058 1 77 LEU MD2 2 122 LEU MD1 . . 5.500 4.948 4.378 5.574 0.074 5 0 "[ . 1 . 2]" 1 1059 1 77 LEU MD2 2 122 LEU QD . . 4.730 3.658 3.052 4.060 . 0 0 "[ . 1 . 2]" 1 1060 1 77 LEU MD2 2 122 LEU MD2 . . 5.500 3.806 3.115 4.619 . 0 0 "[ . 1 . 2]" 1 1061 1 77 LEU HG 1 78 PHE H . . 5.500 3.594 3.356 3.761 . 0 0 "[ . 1 . 2]" 1 1062 1 78 PHE H 1 79 THR H . . 4.690 4.337 4.306 4.376 . 0 0 "[ . 1 . 2]" 1 1063 1 78 PHE H 1 80 ASP H . . 4.380 4.464 4.289 4.567 0.187 4 0 "[ . 1 . 2]" 1 1064 1 78 PHE HA 1 78 PHE HD2 . . 4.610 4.107 3.863 4.465 . 0 0 "[ . 1 . 2]" 1 1065 1 78 PHE HA 1 79 THR H . . 2.870 2.184 2.133 2.248 . 0 0 "[ . 1 . 2]" 1 1066 1 78 PHE HA 1 79 THR MG . . 4.380 3.618 3.516 3.732 . 0 0 "[ . 1 . 2]" 1 1067 1 78 PHE HA 1 80 ASP H . . 4.010 4.036 3.927 4.115 0.105 9 0 "[ . 1 . 2]" 1 1068 1 78 PHE HA 1 84 ALA MB . . 5.500 5.189 5.109 5.260 . 0 0 "[ . 1 . 2]" 1 1069 1 78 PHE HB2 1 78 PHE HD2 . . 3.540 3.529 3.324 3.648 0.108 18 0 "[ . 1 . 2]" 1 1070 1 78 PHE HB2 1 84 ALA MB . . 3.400 3.327 3.258 3.420 0.020 4 0 "[ . 1 . 2]" 1 1071 1 78 PHE HB3 1 78 PHE HD2 . . 2.780 2.344 2.318 2.427 . 0 0 "[ . 1 . 2]" 1 1072 1 78 PHE HB3 1 79 THR H . . 5.100 3.453 3.348 3.584 . 0 0 "[ . 1 . 2]" 1 1073 1 78 PHE HB3 1 79 THR MG . . 4.520 3.753 3.607 3.923 . 0 0 "[ . 1 . 2]" 1 1074 1 78 PHE HB3 1 80 ASP HA . . 5.500 4.453 3.994 4.783 . 0 0 "[ . 1 . 2]" 1 1075 1 78 PHE HB3 1 81 GLU H . . 5.500 5.372 5.143 5.517 0.017 4 0 "[ . 1 . 2]" 1 1076 1 78 PHE HB3 1 84 ALA MB . . 3.150 2.857 2.755 2.970 . 0 0 "[ . 1 . 2]" 1 1077 1 78 PHE HD2 1 79 THR MG . . 5.500 2.551 2.206 3.171 . 0 0 "[ . 1 . 2]" 1 1078 1 78 PHE HD2 1 80 ASP HA . . 5.500 4.566 4.297 4.791 . 0 0 "[ . 1 . 2]" 1 1079 1 78 PHE HD2 1 81 GLU HA . . 5.500 4.474 3.778 4.919 . 0 0 "[ . 1 . 2]" 1 1080 1 78 PHE HD2 1 83 SER HA . . 5.500 5.601 5.485 5.697 0.197 13 0 "[ . 1 . 2]" 1 1081 1 78 PHE HD2 1 83 SER QB . . 5.340 3.306 2.771 4.850 . 0 0 "[ . 1 . 2]" 1 1082 1 78 PHE HD2 1 84 ALA HA . . 5.500 3.129 2.552 3.420 . 0 0 "[ . 1 . 2]" 1 1083 1 78 PHE HD2 1 84 ALA MB . . 3.030 2.677 2.108 3.121 0.091 18 0 "[ . 1 . 2]" 1 1084 1 79 THR H 1 79 THR HA . . 2.900 2.701 2.659 2.740 . 0 0 "[ . 1 . 2]" 1 1085 1 79 THR H 1 79 THR HB . . 2.820 2.479 2.342 2.605 . 0 0 "[ . 1 . 2]" 1 1086 1 79 THR H 1 79 THR MG . . 2.720 1.942 1.852 2.054 . 0 0 "[ . 1 . 2]" 1 1087 1 79 THR H 1 80 ASP H . . 4.630 2.969 2.868 3.053 . 0 0 "[ . 1 . 2]" 1 1088 1 79 THR HB 1 80 ASP H . . 5.000 4.205 4.072 4.381 . 0 0 "[ . 1 . 2]" 1 1089 1 79 THR MG 1 80 ASP H . . 2.870 2.408 2.138 2.733 . 0 0 "[ . 1 . 2]" 1 1090 1 79 THR MG 1 80 ASP HA . . 4.340 4.243 4.080 4.358 0.018 8 0 "[ . 1 . 2]" 1 1091 1 79 THR MG 1 80 ASP QB . . 4.550 3.255 2.334 3.886 . 0 0 "[ . 1 . 2]" 1 1092 1 80 ASP H 1 81 GLU H . . 5.500 4.283 4.211 4.359 . 0 0 "[ . 1 . 2]" 1 1093 1 80 ASP H 1 84 ALA MB . . 5.180 3.885 3.615 4.038 . 0 0 "[ . 1 . 2]" 1 1094 1 80 ASP HA 1 80 ASP QB . . 2.540 2.298 2.153 2.502 . 0 0 "[ . 1 . 2]" 1 1095 1 80 ASP HA 1 81 GLU H . . 2.690 2.501 2.296 2.637 . 0 0 "[ . 1 . 2]" 1 1096 1 80 ASP HA 1 81 GLU QG . . 3.830 3.371 3.107 3.630 . 0 0 "[ . 1 . 2]" 1 1097 1 80 ASP HA 1 84 ALA H . . 5.500 5.482 5.228 5.613 0.113 6 0 "[ . 1 . 2]" 1 1098 1 80 ASP QB 1 81 GLU H . . 2.610 2.274 1.828 2.912 0.302 13 0 "[ . 1 . 2]" 1 1099 1 80 ASP QB 1 81 GLU HA . . 4.570 4.358 4.086 4.535 . 0 0 "[ . 1 . 2]" 1 1100 1 80 ASP QB 1 82 LYS H . . 3.300 2.983 2.648 3.656 0.356 13 0 "[ . 1 . 2]" 1 1101 1 80 ASP QB 1 82 LYS HA . . 5.340 5.282 4.636 5.563 0.223 13 0 "[ . 1 . 2]" 1 1102 1 80 ASP QB 1 83 SER H . . 5.340 3.021 2.048 3.689 . 0 0 "[ . 1 . 2]" 1 1103 1 81 GLU H 1 81 GLU QB . . 3.410 2.913 2.665 3.156 . 0 0 "[ . 1 . 2]" 1 1104 1 81 GLU H 1 81 GLU QG . . 2.480 1.922 1.708 2.228 . 0 0 "[ . 1 . 2]" 1 1105 1 81 GLU H 1 82 LYS H . . 2.600 2.188 2.004 2.466 . 0 0 "[ . 1 . 2]" 1 1106 1 81 GLU H 1 82 LYS QG . . 4.400 3.107 2.870 3.419 . 0 0 "[ . 1 . 2]" 1 1107 1 81 GLU H 1 83 SER H . . 4.150 3.758 3.134 4.124 . 0 0 "[ . 1 . 2]" 1 1108 1 81 GLU H 1 84 ALA H . . 5.500 4.372 3.804 4.623 . 0 0 "[ . 1 . 2]" 1 1109 1 81 GLU H 1 107 VAL MG2 . . 4.950 4.661 4.419 4.972 0.022 7 0 "[ . 1 . 2]" 1 1110 1 81 GLU HA 1 81 GLU QB . . 2.570 2.175 2.124 2.261 . 0 0 "[ . 1 . 2]" 1 1111 1 81 GLU HA 1 84 ALA H . . 4.840 3.312 3.163 3.520 . 0 0 "[ . 1 . 2]" 1 1112 1 81 GLU HA 1 84 ALA MB . . 3.120 2.303 2.087 2.457 . 0 0 "[ . 1 . 2]" 1 1113 1 81 GLU HA 1 107 VAL HA . . 5.500 5.513 5.020 5.641 0.141 6 0 "[ . 1 . 2]" 1 1114 1 81 GLU HA 1 107 VAL MG1 . . 5.500 3.100 2.659 3.440 . 0 0 "[ . 1 . 2]" 1 1115 1 81 GLU HA 1 107 VAL MG2 . . 5.080 2.263 2.012 2.572 . 0 0 "[ . 1 . 2]" 1 1116 1 81 GLU QB 1 82 LYS H . . 3.470 2.895 2.241 3.468 . 0 0 "[ . 1 . 2]" 1 1117 1 81 GLU QB 1 84 ALA MB . . 3.740 3.618 3.324 3.759 0.019 8 0 "[ . 1 . 2]" 1 1118 1 81 GLU QB 1 107 VAL HA . . 5.030 4.967 4.565 5.086 0.056 8 0 "[ . 1 . 2]" 1 1119 1 81 GLU QB 1 107 VAL HB . . 4.190 3.284 2.819 3.667 . 0 0 "[ . 1 . 2]" 1 1120 1 81 GLU QB 1 107 VAL MG2 . . 3.790 2.371 2.001 2.836 . 0 0 "[ . 1 . 2]" 1 1121 1 81 GLU HB2 1 84 ALA MB . . 4.300 4.217 3.706 4.542 0.242 4 0 "[ . 1 . 2]" 1 1122 1 81 GLU HB2 1 107 VAL MG1 . . 5.500 2.920 2.305 3.588 . 0 0 "[ . 1 . 2]" 1 1123 1 81 GLU HB3 1 84 ALA MB . . 4.300 3.954 3.757 4.137 . 0 0 "[ . 1 . 2]" 1 1124 1 81 GLU HB3 1 107 VAL MG1 . . 5.500 1.894 1.694 2.103 . 0 0 "[ . 1 . 2]" 1 1125 1 81 GLU QG 1 82 LYS H . . 3.800 3.102 2.246 3.347 . 0 0 "[ . 1 . 2]" 1 1126 1 81 GLU QG 1 82 LYS QG . . 5.340 3.976 3.260 4.188 . 0 0 "[ . 1 . 2]" 1 1127 1 81 GLU QG 1 107 VAL MG1 . . 3.760 3.012 2.189 3.626 . 0 0 "[ . 1 . 2]" 1 1128 1 82 LYS H 1 82 LYS HA . . 2.850 2.797 2.757 2.890 0.040 13 0 "[ . 1 . 2]" 1 1129 1 82 LYS H 1 82 LYS QG . . 3.100 1.790 1.669 1.996 . 0 0 "[ . 1 . 2]" 1 1130 1 82 LYS H 1 83 SER H . . 3.920 2.660 2.176 2.852 . 0 0 "[ . 1 . 2]" 1 1131 1 82 LYS H 1 84 ALA H . . 4.100 3.808 3.362 4.041 . 0 0 "[ . 1 . 2]" 1 1132 1 82 LYS HA 1 82 LYS HB2 . . 2.870 2.515 2.458 2.557 . 0 0 "[ . 1 . 2]" 1 1133 1 82 LYS HA 1 82 LYS QB . . 2.490 2.160 2.144 2.179 . 0 0 "[ . 1 . 2]" 1 1134 1 82 LYS HA 1 82 LYS HB3 . . 2.870 2.354 2.304 2.391 . 0 0 "[ . 1 . 2]" 1 1135 1 82 LYS HA 1 82 LYS HE2 . . 5.500 5.757 5.679 5.880 0.380 5 0 "[ . 1 . 2]" 1 1136 1 82 LYS HA 1 82 LYS HE3 . . 5.500 5.744 5.678 5.809 0.309 17 0 "[ . 1 . 2]" 1 1137 1 82 LYS HA 1 82 LYS QG . . 3.700 3.213 3.189 3.247 . 0 0 "[ . 1 . 2]" 1 1138 1 82 LYS HA 1 84 ALA MB . . 5.500 4.575 4.156 4.885 . 0 0 "[ . 1 . 2]" 1 1139 1 82 LYS HA 1 85 LEU QD . . 4.330 2.378 1.985 2.854 . 0 0 "[ . 1 . 2]" 1 1140 1 82 LYS QB 1 82 LYS QD . . 2.270 2.107 2.057 2.163 . 0 0 "[ . 1 . 2]" 1 1141 1 82 LYS QB 1 82 LYS QE . . 3.150 3.359 3.341 3.375 0.225 7 0 "[ . 1 . 2]" 1 1142 1 82 LYS QE 1 82 LYS QG . . 2.390 1.933 1.885 1.964 . 0 0 "[ . 1 . 2]" 1 1143 1 82 LYS QE 1 83 SER QB . . 4.150 4.107 3.521 4.288 0.138 10 0 "[ . 1 . 2]" 1 1144 1 82 LYS QG 1 83 SER H . . 2.800 1.979 1.811 2.288 . 0 0 "[ . 1 . 2]" 1 1145 1 82 LYS QG 1 83 SER HA . . 4.980 3.649 3.438 3.909 . 0 0 "[ . 1 . 2]" 1 1146 1 82 LYS QG 1 83 SER QB . . 3.120 3.469 3.020 3.678 0.558 13 5 "[ ** . -1 + . *]" 1 1147 1 82 LYS QG 1 84 ALA MB . . 5.500 5.010 4.897 5.082 . 0 0 "[ . 1 . 2]" 1 1148 1 83 SER H 1 83 SER QB . . 2.610 2.513 2.222 2.753 0.144 6 0 "[ . 1 . 2]" 1 1149 1 83 SER H 1 84 ALA H . . 2.990 2.359 2.231 2.445 . 0 0 "[ . 1 . 2]" 1 1150 1 83 SER HA 1 84 ALA H . . 3.550 3.432 3.345 3.487 . 0 0 "[ . 1 . 2]" 1 1151 1 83 SER HA 1 87 TYR H . . 4.180 4.160 3.975 4.339 0.159 12 0 "[ . 1 . 2]" 1 1152 1 83 SER QB 1 87 TYR H . . 5.150 4.568 4.279 5.188 0.038 8 0 "[ . 1 . 2]" 1 1153 1 84 ALA H 1 84 ALA HA . . 2.800 2.771 2.735 2.822 0.022 13 0 "[ . 1 . 2]" 1 1154 1 84 ALA H 1 84 ALA MB . . 2.580 2.189 2.144 2.238 . 0 0 "[ . 1 . 2]" 1 1155 1 84 ALA H 1 86 ALA H . . 4.080 4.007 3.716 4.192 0.112 2 0 "[ . 1 . 2]" 1 1156 1 84 ALA H 1 86 ALA MB . . 5.500 4.657 4.429 4.973 . 0 0 "[ . 1 . 2]" 1 1157 1 84 ALA H 1 87 TYR H . . 4.790 4.651 4.537 4.743 . 0 0 "[ . 1 . 2]" 1 1158 1 84 ALA HA 1 85 LEU QD . . 5.440 4.731 4.612 5.259 . 0 0 "[ . 1 . 2]" 1 1159 1 84 ALA HA 1 86 ALA H . . 4.650 4.301 4.195 4.395 . 0 0 "[ . 1 . 2]" 1 1160 1 84 ALA HA 1 86 ALA MB . . 5.500 5.077 4.936 5.336 . 0 0 "[ . 1 . 2]" 1 1161 1 84 ALA HA 1 87 TYR H . . 4.570 3.604 3.416 3.735 . 0 0 "[ . 1 . 2]" 1 1162 1 84 ALA HA 1 87 TYR QB . . 5.340 2.869 2.353 3.145 . 0 0 "[ . 1 . 2]" 1 1163 1 84 ALA HA 1 88 LEU H . . 5.380 4.907 4.787 5.005 . 0 0 "[ . 1 . 2]" 1 1164 1 84 ALA MB 1 85 LEU H . . 2.610 2.343 2.258 2.570 . 0 0 "[ . 1 . 2]" 1 1165 1 84 ALA MB 1 85 LEU HA . . 3.810 3.767 3.674 3.823 0.013 17 0 "[ . 1 . 2]" 1 1166 1 84 ALA MB 1 85 LEU QD . . 5.440 3.189 2.984 3.454 . 0 0 "[ . 1 . 2]" 1 1167 1 84 ALA MB 1 86 ALA H . . 4.330 4.217 4.112 4.375 0.045 6 0 "[ . 1 . 2]" 1 1168 1 84 ALA MB 1 87 TYR H . . 4.690 4.544 4.415 4.635 . 0 0 "[ . 1 . 2]" 1 1169 1 84 ALA MB 1 88 LEU H . . 5.150 5.276 5.215 5.359 0.209 12 0 "[ . 1 . 2]" 1 1170 1 85 LEU H 1 85 LEU HB2 . . 3.740 3.693 3.573 3.722 . 0 0 "[ . 1 . 2]" 1 1171 1 85 LEU H 1 85 LEU HB3 . . 2.400 2.690 2.578 2.783 0.383 6 0 "[ . 1 . 2]" 1 1172 1 85 LEU H 1 85 LEU QD . . 2.400 1.752 1.603 2.610 0.210 13 0 "[ . 1 . 2]" 1 1173 1 85 LEU H 1 86 ALA H . . 2.810 2.534 2.489 2.589 . 0 0 "[ . 1 . 2]" 1 1174 1 85 LEU H 1 87 TYR H . . 4.210 4.011 3.853 4.115 . 0 0 "[ . 1 . 2]" 1 1175 1 85 LEU HA 1 85 LEU HB2 . . 2.810 2.389 2.361 2.469 . 0 0 "[ . 1 . 2]" 1 1176 1 85 LEU HA 1 85 LEU HB3 . . 2.870 2.433 2.362 2.483 . 0 0 "[ . 1 . 2]" 1 1177 1 85 LEU HA 1 86 ALA HA . . 5.500 4.674 4.607 4.732 . 0 0 "[ . 1 . 2]" 1 1178 1 85 LEU HA 1 87 TYR H . . 5.480 4.001 3.889 4.091 . 0 0 "[ . 1 . 2]" 1 1179 1 85 LEU HA 1 88 LEU HA . . 5.480 5.333 4.993 5.589 0.109 12 0 "[ . 1 . 2]" 1 1180 1 85 LEU HA 1 88 LEU QD . . 4.920 2.507 2.132 3.186 . 0 0 "[ . 1 . 2]" 1 1181 1 85 LEU HA 1 106 LYS HA . . 5.500 4.863 3.868 5.321 . 0 0 "[ . 1 . 2]" 1 1182 1 85 LEU HB3 1 85 LEU QD . . 2.620 2.109 2.094 2.134 . 0 0 "[ . 1 . 2]" 1 1183 1 85 LEU HB3 1 86 ALA H . . 3.940 4.136 4.043 4.207 0.267 6 0 "[ . 1 . 2]" 1 1184 1 85 LEU HB3 1 87 TYR H . . 5.500 5.721 5.554 5.825 0.325 19 0 "[ . 1 . 2]" 1 1185 1 85 LEU HB3 1 106 LYS HA . . 5.500 4.058 2.926 4.412 . 0 0 "[ . 1 . 2]" 1 1186 1 85 LEU QD 1 86 ALA H . . 2.840 2.689 2.355 2.895 0.055 6 0 "[ . 1 . 2]" 1 1187 1 85 LEU HG 1 86 ALA H . . 2.770 2.809 2.452 2.904 0.134 9 0 "[ . 1 . 2]" 1 1188 1 85 LEU HG 1 86 ALA HA . . 5.290 3.643 3.475 4.462 . 0 0 "[ . 1 . 2]" 1 1189 1 86 ALA H 1 86 ALA MB . . 2.850 2.252 2.230 2.279 . 0 0 "[ . 1 . 2]" 1 1190 1 86 ALA H 1 87 TYR H . . 2.860 2.381 2.224 2.450 . 0 0 "[ . 1 . 2]" 1 1191 1 86 ALA H 1 87 TYR QB . . 4.220 4.189 3.858 4.292 0.072 18 0 "[ . 1 . 2]" 1 1192 1 86 ALA H 1 88 LEU H . . 4.070 4.014 3.933 4.114 0.044 7 0 "[ . 1 . 2]" 1 1193 1 86 ALA MB 1 87 TYR H . . 2.980 2.726 2.631 2.877 . 0 0 "[ . 1 . 2]" 1 1194 1 87 TYR H 1 87 TYR HB2 . . 3.430 2.254 2.192 2.473 . 0 0 "[ . 1 . 2]" 1 1195 1 87 TYR H 1 87 TYR QB . . 2.660 2.205 2.121 2.244 . 0 0 "[ . 1 . 2]" 1 1196 1 87 TYR H 1 87 TYR HB3 . . 3.430 3.362 2.308 3.524 0.094 1 0 "[ . 1 . 2]" 1 1197 1 87 TYR H 1 88 LEU H . . 3.020 2.601 2.478 2.696 . 0 0 "[ . 1 . 2]" 1 1198 1 87 TYR H 1 88 LEU HA . . 5.270 5.041 4.934 5.229 . 0 0 "[ . 1 . 2]" 1 1199 1 87 TYR H 1 89 GLU H . . 4.640 4.425 4.229 4.563 . 0 0 "[ . 1 . 2]" 1 1200 1 87 TYR H 1 90 LYS QB . . 5.500 5.288 4.678 6.014 0.514 9 1 "[ . +1 . 2]" 1 1201 1 87 TYR H 1 105 ALA MB . . 5.500 5.396 4.766 5.546 0.046 16 0 "[ . 1 . 2]" 1 1202 1 87 TYR HA 1 89 GLU H . . 4.060 3.668 3.425 4.054 . 0 0 "[ . 1 . 2]" 1 1203 1 87 TYR HA 1 90 LYS QB . . 3.360 2.864 2.078 3.911 0.551 9 1 "[ . +1 . 2]" 1 1204 1 87 TYR HA 1 90 LYS QG . . 5.340 4.334 3.550 5.288 . 0 0 "[ . 1 . 2]" 1 1205 1 87 TYR QB 1 87 TYR HD1 . . 2.940 2.514 2.384 2.893 . 0 0 "[ . 1 . 2]" 1 1206 1 87 TYR QB 1 87 TYR HE1 . . 4.630 4.465 4.399 4.642 0.012 1 0 "[ . 1 . 2]" 1 1207 1 87 TYR QB 1 88 LEU H . . 3.450 3.332 2.816 3.510 0.060 5 0 "[ . 1 . 2]" 1 1208 1 87 TYR QB 1 88 LEU QD . . 5.280 5.125 4.755 5.227 . 0 0 "[ . 1 . 2]" 1 1209 1 87 TYR HB2 1 88 LEU H . . 4.050 3.725 3.522 4.098 0.048 12 0 "[ . 1 . 2]" 1 1210 1 87 TYR HB3 1 88 LEU H . . 4.050 3.843 2.870 4.120 0.070 5 0 "[ . 1 . 2]" 1 1211 1 88 LEU H 1 88 LEU HB3 . . 2.450 2.672 2.366 2.757 0.307 15 0 "[ . 1 . 2]" 1 1212 1 88 LEU H 1 88 LEU MD1 . . 4.800 3.704 3.529 4.140 . 0 0 "[ . 1 . 2]" 1 1213 1 88 LEU H 1 88 LEU QD . . 4.100 3.135 2.407 3.246 . 0 0 "[ . 1 . 2]" 1 1214 1 88 LEU H 1 88 LEU MD2 . . 4.800 3.414 2.423 3.507 . 0 0 "[ . 1 . 2]" 1 1215 1 88 LEU H 1 88 LEU HG . . 4.860 2.481 2.271 3.978 . 0 0 "[ . 1 . 2]" 1 1216 1 88 LEU H 1 89 GLU H . . 2.910 2.616 2.448 2.796 . 0 0 "[ . 1 . 2]" 1 1217 1 88 LEU H 1 89 GLU HB2 . . 5.500 4.695 3.997 4.913 . 0 0 "[ . 1 . 2]" 1 1218 1 88 LEU H 1 90 LYS H . . 4.360 4.105 3.746 4.315 . 0 0 "[ . 1 . 2]" 1 1219 1 88 LEU HA 1 88 LEU HB2 . . 2.830 2.410 2.270 2.444 . 0 0 "[ . 1 . 2]" 1 1220 1 88 LEU HA 1 88 LEU HB3 . . 3.000 2.410 2.364 2.597 . 0 0 "[ . 1 . 2]" 1 1221 1 88 LEU HA 1 88 LEU MD1 . . 4.170 3.711 3.662 4.032 . 0 0 "[ . 1 . 2]" 1 1222 1 88 LEU HA 1 88 LEU QD . . 3.500 3.438 3.422 3.453 . 0 0 "[ . 1 . 2]" 1 1223 1 88 LEU HA 1 88 LEU MD2 . . 4.170 4.078 3.699 4.156 . 0 0 "[ . 1 . 2]" 1 1224 1 88 LEU HA 1 89 GLU HA . . 5.500 4.801 4.659 4.945 . 0 0 "[ . 1 . 2]" 1 1225 1 88 LEU HA 1 91 HIS H . . 3.810 3.447 3.318 3.633 . 0 0 "[ . 1 . 2]" 1 1226 1 88 LEU HA 1 91 HIS HD2 . . 5.500 2.034 1.870 2.486 . 0 0 "[ . 1 . 2]" 1 1227 1 88 LEU HA 1 103 VAL QG . . 5.440 2.993 2.647 3.274 . 0 0 "[ . 1 . 2]" 1 1228 1 88 LEU HB2 1 88 LEU QD . . 2.660 2.144 2.123 2.185 . 0 0 "[ . 1 . 2]" 1 1229 1 88 LEU HB2 1 91 HIS HD2 . . 4.150 4.053 2.901 4.452 0.302 17 0 "[ . 1 . 2]" 1 1230 1 88 LEU HB2 1 92 THR HB . . 5.500 4.195 3.802 4.528 . 0 0 "[ . 1 . 2]" 1 1231 1 88 LEU HB3 1 88 LEU MD1 . . 3.560 3.162 2.450 3.221 . 0 0 "[ . 1 . 2]" 1 1232 1 88 LEU HB3 1 88 LEU QD . . 2.560 2.169 2.133 2.195 . 0 0 "[ . 1 . 2]" 1 1233 1 88 LEU HB3 1 88 LEU MD2 . . 3.560 2.216 2.184 2.346 . 0 0 "[ . 1 . 2]" 1 1234 1 88 LEU HB3 1 89 GLU H . . 3.790 4.002 3.691 4.095 0.305 12 0 "[ . 1 . 2]" 1 1235 1 88 LEU QD 1 89 GLU H . . 3.030 2.352 1.824 2.544 . 0 0 "[ . 1 . 2]" 1 1236 1 88 LEU QD 1 89 GLU HA . . 3.270 2.499 2.316 3.301 0.031 9 0 "[ . 1 . 2]" 1 1237 1 88 LEU QD 1 89 GLU HB2 . . 3.880 2.787 2.604 3.254 . 0 0 "[ . 1 . 2]" 1 1238 1 88 LEU QD 1 90 LYS H . . 4.520 4.302 4.223 4.375 . 0 0 "[ . 1 . 2]" 1 1239 1 88 LEU QD 1 91 HIS HD2 . . 5.440 4.698 4.153 4.974 . 0 0 "[ . 1 . 2]" 1 1240 1 88 LEU QD 1 92 THR HB . . 3.390 3.085 2.699 3.616 0.226 9 0 "[ . 1 . 2]" 1 1241 1 88 LEU QD 1 92 THR MG . . 4.420 3.116 2.710 3.381 . 0 0 "[ . 1 . 2]" 1 1242 1 88 LEU QD 1 105 ALA HA . . 5.440 4.263 3.993 4.749 . 0 0 "[ . 1 . 2]" 1 1243 1 88 LEU QD 1 105 ALA MB . . 2.390 2.022 1.794 2.450 0.060 9 0 "[ . 1 . 2]" 1 1244 1 88 LEU HG 1 89 GLU H . . 2.890 2.648 2.391 2.877 . 0 0 "[ . 1 . 2]" 1 1245 1 88 LEU HG 1 89 GLU HA . . 4.510 4.462 3.078 4.633 0.123 12 0 "[ . 1 . 2]" 1 1246 1 88 LEU HG 1 89 GLU HB2 . . 5.500 3.895 3.259 4.214 . 0 0 "[ . 1 . 2]" 1 1247 1 88 LEU HG 1 89 GLU QG . . 4.030 5.403 3.551 5.893 1.863 12 19 [****.******+*****-**] 1 1248 1 88 LEU HG 1 92 THR HB . . 5.500 5.285 2.883 5.604 0.104 15 0 "[ . 1 . 2]" 1 1249 1 89 GLU H 1 89 GLU HB2 . . 2.400 2.330 1.979 2.486 0.086 13 0 "[ . 1 . 2]" 1 1250 1 89 GLU H 1 89 GLU QG . . 4.350 3.858 2.793 4.020 . 0 0 "[ . 1 . 2]" 1 1251 1 89 GLU H 1 90 LYS H . . 2.700 2.643 2.450 2.792 0.092 9 0 "[ . 1 . 2]" 1 1252 1 89 GLU H 1 91 HIS H . . 4.720 4.328 4.156 4.599 . 0 0 "[ . 1 . 2]" 1 1253 1 89 GLU H 1 91 HIS HD2 . . 5.500 4.728 4.256 5.558 0.058 11 0 "[ . 1 . 2]" 1 1254 1 89 GLU H 1 92 THR MG . . 4.860 4.860 4.130 5.014 0.154 15 0 "[ . 1 . 2]" 1 1255 1 89 GLU HA 1 89 GLU QG . . 3.510 2.622 2.309 3.018 . 0 0 "[ . 1 . 2]" 1 1256 1 89 GLU HA 1 90 LYS QB . . 5.500 5.192 5.106 5.357 . 0 0 "[ . 1 . 2]" 1 1257 1 89 GLU HA 1 92 THR H . . 4.900 3.451 3.203 3.879 . 0 0 "[ . 1 . 2]" 1 1258 1 89 GLU HA 1 92 THR MG . . 3.760 2.702 1.886 3.092 . 0 0 "[ . 1 . 2]" 1 1259 1 89 GLU HA 1 93 ALA H . . 4.840 3.600 3.282 4.042 . 0 0 "[ . 1 . 2]" 1 1260 1 89 GLU HA 1 93 ALA HA . . 5.500 5.239 5.060 5.488 . 0 0 "[ . 1 . 2]" 1 1261 1 89 GLU HB2 1 89 GLU QG . . 2.420 2.269 2.132 2.388 . 0 0 "[ . 1 . 2]" 1 1262 1 90 LYS H 1 90 LYS QB . . 3.550 2.196 2.078 2.308 . 0 0 "[ . 1 . 2]" 1 1263 1 90 LYS H 1 90 LYS QE . . 3.440 3.205 2.305 3.553 0.113 15 0 "[ . 1 . 2]" 1 1264 1 90 LYS H 1 91 HIS H . . 2.850 2.630 2.478 2.908 0.058 19 0 "[ . 1 . 2]" 1 1265 1 90 LYS H 1 92 THR H . . 4.620 3.957 3.837 4.166 . 0 0 "[ . 1 . 2]" 1 1266 1 90 LYS H 1 93 ALA H . . 4.730 4.560 4.366 4.699 . 0 0 "[ . 1 . 2]" 1 1267 1 90 LYS HA 1 90 LYS QE . . 4.320 2.583 1.889 3.117 . 0 0 "[ . 1 . 2]" 1 1268 1 90 LYS HA 1 91 HIS HA . . 5.500 4.678 4.415 4.827 . 0 0 "[ . 1 . 2]" 1 1269 1 90 LYS HA 1 93 ALA MB . . 5.500 3.238 2.827 3.677 . 0 0 "[ . 1 . 2]" 1 1270 1 90 LYS QB 1 90 LYS QE . . 4.050 2.273 1.846 3.259 . 0 0 "[ . 1 . 2]" 1 1271 1 90 LYS QB 1 90 LYS QG . . 2.470 1.988 1.972 2.016 . 0 0 "[ . 1 . 2]" 1 1272 1 90 LYS QB 1 91 HIS H . . 2.850 2.362 2.021 2.736 . 0 0 "[ . 1 . 2]" 1 1273 1 90 LYS QB 1 91 HIS HA . . 5.120 3.810 3.657 3.940 . 0 0 "[ . 1 . 2]" 1 1274 1 90 LYS QE 1 90 LYS QG . . 3.140 2.403 2.255 2.695 . 0 0 "[ . 1 . 2]" 1 1275 1 90 LYS QE 1 91 HIS H . . 5.060 4.795 4.412 5.034 . 0 0 "[ . 1 . 2]" 1 1276 1 90 LYS QG 1 91 HIS H . . 5.000 3.975 3.473 4.611 . 0 0 "[ . 1 . 2]" 1 1277 1 91 HIS H 1 91 HIS HE1 . . 5.170 5.397 4.507 5.809 0.639 1 3 "[+ .* 1 - . 2]" 1 1278 1 91 HIS H 1 92 THR H . . 3.120 2.357 2.227 2.523 . 0 0 "[ . 1 . 2]" 1 1279 1 91 HIS H 1 92 THR HB . . 4.830 4.064 3.842 4.289 . 0 0 "[ . 1 . 2]" 1 1280 1 91 HIS H 1 92 THR MG . . 5.360 5.180 4.316 5.463 0.103 4 0 "[ . 1 . 2]" 1 1281 1 91 HIS H 1 93 ALA H . . 4.180 3.941 3.785 4.136 . 0 0 "[ . 1 . 2]" 1 1282 1 91 HIS HA 1 91 HIS HB3 . . 2.680 2.390 2.237 2.464 . 0 0 "[ . 1 . 2]" 1 1283 1 91 HIS HB2 1 92 THR H . . 3.240 2.488 2.151 3.972 0.732 19 1 "[ . 1 . +2]" 1 1284 1 91 HIS HB2 1 92 THR HA . . 4.210 3.918 3.593 4.618 0.408 19 0 "[ . 1 . 2]" 1 1285 1 91 HIS HB3 1 91 HIS HE1 . . 5.000 4.698 4.626 4.885 . 0 0 "[ . 1 . 2]" 1 1286 1 92 THR H 1 92 THR HA . . 2.760 2.734 2.706 2.789 0.029 19 0 "[ . 1 . 2]" 1 1287 1 92 THR H 1 92 THR HB . . 2.920 2.147 1.995 2.329 . 0 0 "[ . 1 . 2]" 1 1288 1 92 THR H 1 92 THR MG . . 3.600 3.498 2.811 3.660 0.060 9 0 "[ . 1 . 2]" 1 1289 1 92 THR H 1 93 ALA H . . 2.940 2.842 2.652 2.941 0.001 2 0 "[ . 1 . 2]" 1 1290 1 92 THR H 1 93 ALA MB . . 4.720 4.524 4.319 4.647 . 0 0 "[ . 1 . 2]" 1 1291 1 92 THR H 1 94 ARG H . . 4.320 4.232 4.091 4.360 0.040 10 0 "[ . 1 . 2]" 1 1292 1 92 THR H 1 103 VAL H . . 5.500 4.585 4.194 5.270 . 0 0 "[ . 1 . 2]" 1 1293 1 92 THR H 1 103 VAL QG . . 4.610 2.898 2.559 3.323 . 0 0 "[ . 1 . 2]" 1 1294 1 92 THR HA 1 92 THR MG . . 3.290 2.730 2.531 3.107 . 0 0 "[ . 1 . 2]" 1 1295 1 92 THR HA 1 95 LEU H . . 4.450 3.110 2.883 3.275 . 0 0 "[ . 1 . 2]" 1 1296 1 92 THR HA 1 95 LEU QD . . 4.990 2.456 2.277 2.551 . 0 0 "[ . 1 . 2]" 1 1297 1 92 THR HA 1 96 LYS H . . 4.270 3.448 3.338 3.549 . 0 0 "[ . 1 . 2]" 1 1298 1 92 THR HA 1 96 LYS HA . . 5.250 5.442 5.290 5.587 0.337 10 0 "[ . 1 . 2]" 1 1299 1 92 THR HA 1 96 LYS QB . . 3.680 4.405 4.249 4.543 0.863 4 20 [***+*-**************] 1 1300 1 92 THR HA 1 96 LYS HG2 . . 5.500 4.166 4.055 4.299 . 0 0 "[ . 1 . 2]" 1 1301 1 92 THR HA 1 103 VAL H . . 5.330 3.544 3.213 3.962 . 0 0 "[ . 1 . 2]" 1 1302 1 92 THR HA 1 103 VAL HB . . 4.860 4.292 4.046 4.537 . 0 0 "[ . 1 . 2]" 1 1303 1 92 THR HA 1 103 VAL QG . . 3.310 2.668 2.277 3.095 . 0 0 "[ . 1 . 2]" 1 1304 1 92 THR HB 1 93 ALA H . . 3.790 3.082 2.783 3.842 0.052 11 0 "[ . 1 . 2]" 1 1305 1 92 THR HB 1 94 ARG H . . 5.230 5.067 4.919 5.391 0.161 18 0 "[ . 1 . 2]" 1 1306 1 92 THR HB 1 95 LEU QD . . 4.030 4.277 3.777 4.411 0.381 2 0 "[ . 1 . 2]" 1 1307 1 92 THR HB 1 95 LEU HG . . 4.630 4.712 4.307 4.780 0.150 2 0 "[ . 1 . 2]" 1 1308 1 92 THR HB 1 96 LYS HG2 . . 4.470 4.862 4.498 5.335 0.865 11 4 "[ .* 1+ . * -]" 1 1309 1 92 THR HB 1 103 VAL QG . . 3.510 3.403 2.534 3.773 0.263 2 0 "[ . 1 . 2]" 1 1310 1 92 THR MG 1 93 ALA H . . 3.030 2.964 2.485 3.184 0.154 15 0 "[ . 1 . 2]" 1 1311 1 92 THR MG 1 93 ALA HA . . 3.550 3.157 3.010 3.264 . 0 0 "[ . 1 . 2]" 1 1312 1 92 THR MG 1 94 ARG H . . 4.130 4.380 4.303 4.442 0.312 1 0 "[ . 1 . 2]" 1 1313 1 92 THR MG 1 95 LEU QD . . 4.750 3.219 2.854 3.834 . 0 0 "[ . 1 . 2]" 1 1314 1 92 THR MG 1 96 LYS QB . . 3.860 2.442 2.240 2.635 . 0 0 "[ . 1 . 2]" 1 1315 1 92 THR MG 1 96 LYS QE . . 3.970 1.755 1.637 1.880 . 0 0 "[ . 1 . 2]" 1 1316 1 92 THR MG 1 96 LYS HG2 . . 3.010 2.592 2.312 2.839 . 0 0 "[ . 1 . 2]" 1 1317 1 92 THR MG 1 103 VAL H . . 4.440 3.372 2.999 4.215 . 0 0 "[ . 1 . 2]" 1 1318 1 93 ALA H 1 93 ALA HA . . 2.840 2.794 2.771 2.824 . 0 0 "[ . 1 . 2]" 1 1319 1 93 ALA H 1 93 ALA MB . . 2.400 2.252 2.228 2.273 . 0 0 "[ . 1 . 2]" 1 1320 1 93 ALA H 1 94 ARG H . . 2.960 2.717 2.648 2.782 . 0 0 "[ . 1 . 2]" 1 1321 1 93 ALA H 1 94 ARG QD . . 5.340 3.832 3.440 4.127 . 0 0 "[ . 1 . 2]" 1 1322 1 93 ALA H 1 95 LEU QD . . 5.450 4.950 4.734 5.097 . 0 0 "[ . 1 . 2]" 1 1323 1 93 ALA H 1 96 LYS H . . 4.790 4.724 4.679 4.766 . 0 0 "[ . 1 . 2]" 1 1324 1 93 ALA H 1 96 LYS QE . . 5.340 4.281 3.719 4.804 . 0 0 "[ . 1 . 2]" 1 1325 1 93 ALA HA 1 96 LYS HD2 . . 3.290 2.401 2.085 2.877 . 0 0 "[ . 1 . 2]" 1 1326 1 93 ALA HA 1 96 LYS QE . . 3.890 3.202 2.629 3.846 . 0 0 "[ . 1 . 2]" 1 1327 1 93 ALA HA 1 96 LYS HG2 . . 2.990 2.174 2.080 2.408 . 0 0 "[ . 1 . 2]" 1 1328 1 93 ALA MB 1 94 ARG H . . 3.720 2.968 2.841 3.145 . 0 0 "[ . 1 . 2]" 1 1329 1 94 ARG H 1 94 ARG QB . . 2.550 2.342 2.202 2.552 0.002 19 0 "[ . 1 . 2]" 1 1330 1 94 ARG H 1 94 ARG QD . . 5.340 2.435 2.128 2.699 . 0 0 "[ . 1 . 2]" 1 1331 1 94 ARG H 1 95 LEU H . . 2.920 2.359 2.242 2.433 . 0 0 "[ . 1 . 2]" 1 1332 1 94 ARG H 1 95 LEU HA . . 5.050 4.967 4.866 5.020 . 0 0 "[ . 1 . 2]" 1 1333 1 94 ARG H 1 95 LEU QD . . 4.700 4.356 4.209 4.471 . 0 0 "[ . 1 . 2]" 1 1334 1 94 ARG H 1 95 LEU HG . . 4.200 4.064 3.738 4.305 0.105 11 0 "[ . 1 . 2]" 1 1335 1 94 ARG H 1 96 LYS H . . 3.650 3.700 3.624 3.757 0.107 9 0 "[ . 1 . 2]" 1 1336 1 94 ARG H 1 97 ASN H . . 5.020 4.737 4.559 4.832 . 0 0 "[ . 1 . 2]" 1 1337 1 94 ARG HA 1 94 ARG QG . . 2.610 2.488 2.388 2.620 0.010 13 0 "[ . 1 . 2]" 1 1338 1 94 ARG HA 1 98 LEU H . . 4.340 4.195 4.024 4.379 0.039 13 0 "[ . 1 . 2]" 1 1339 1 94 ARG QB 1 94 ARG QD . . 3.390 2.362 2.248 2.432 . 0 0 "[ . 1 . 2]" 1 1340 1 94 ARG QB 1 95 LEU H . . 2.770 2.438 2.258 2.648 . 0 0 "[ . 1 . 2]" 1 1341 1 94 ARG QB 1 95 LEU HB3 . . 4.790 3.601 3.354 3.855 . 0 0 "[ . 1 . 2]" 1 1342 1 95 LEU H 1 95 LEU HA . . 2.900 2.846 2.833 2.856 . 0 0 "[ . 1 . 2]" 1 1343 1 95 LEU H 1 95 LEU HG . . 2.850 2.346 2.073 2.526 . 0 0 "[ . 1 . 2]" 1 1344 1 95 LEU H 1 96 LYS H . . 2.610 2.581 2.499 2.634 0.024 9 0 "[ . 1 . 2]" 1 1345 1 95 LEU H 1 97 ASN H . . 4.060 3.994 3.866 4.086 0.026 16 0 "[ . 1 . 2]" 1 1346 1 95 LEU H 1 98 LEU H . . 4.820 4.679 4.627 4.792 . 0 0 "[ . 1 . 2]" 1 1347 1 95 LEU H 1 99 GLY H . . 4.770 4.738 4.683 4.792 0.022 1 0 "[ . 1 . 2]" 1 1348 1 95 LEU HA 1 95 LEU HB3 . . 2.620 2.453 2.406 2.506 . 0 0 "[ . 1 . 2]" 1 1349 1 95 LEU HA 1 95 LEU QD . . 4.140 3.334 3.270 3.360 . 0 0 "[ . 1 . 2]" 1 1350 1 95 LEU HA 1 95 LEU HG . . 4.100 3.722 3.681 3.752 . 0 0 "[ . 1 . 2]" 1 1351 1 95 LEU HA 1 97 ASN H . . 3.860 3.763 3.626 3.886 0.026 3 0 "[ . 1 . 2]" 1 1352 1 95 LEU HA 1 98 LEU H . . 4.350 3.004 2.890 3.099 . 0 0 "[ . 1 . 2]" 1 1353 1 95 LEU HA 1 98 LEU HB3 . . 5.500 5.344 5.100 5.576 0.076 10 0 "[ . 1 . 2]" 1 1354 1 95 LEU HA 1 99 GLY H . . 2.610 2.205 2.114 2.295 . 0 0 "[ . 1 . 2]" 1 1355 1 95 LEU HB2 1 95 LEU QD . . 2.840 2.045 1.982 2.084 . 0 0 "[ . 1 . 2]" 1 1356 1 95 LEU HB2 1 99 GLY HA3 . . 5.500 2.182 1.913 2.470 . 0 0 "[ . 1 . 2]" 1 1357 1 95 LEU HB2 1 100 VAL H . . 4.040 2.281 2.038 2.451 . 0 0 "[ . 1 . 2]" 1 1358 1 95 LEU HB3 1 96 LYS H . . 4.630 4.169 4.082 4.220 . 0 0 "[ . 1 . 2]" 1 1359 1 95 LEU QD 1 96 LYS H . . 3.160 2.810 2.432 2.999 . 0 0 "[ . 1 . 2]" 1 1360 1 95 LEU QD 1 96 LYS HA . . 4.600 2.648 2.424 2.743 . 0 0 "[ . 1 . 2]" 1 1361 1 95 LEU QD 1 96 LYS QB . . 4.030 3.285 2.898 3.424 . 0 0 "[ . 1 . 2]" 1 1362 1 95 LEU QD 1 97 ASN H . . 4.470 4.362 4.184 4.419 . 0 0 "[ . 1 . 2]" 1 1363 1 95 LEU QD 1 98 LEU H . . 5.260 5.051 5.008 5.098 . 0 0 "[ . 1 . 2]" 1 1364 1 95 LEU QD 1 99 GLY H . . 4.140 4.045 3.922 4.163 0.023 6 0 "[ . 1 . 2]" 1 1365 1 95 LEU QD 1 100 VAL H . . 2.980 2.355 2.098 2.880 . 0 0 "[ . 1 . 2]" 1 1366 1 95 LEU QD 1 100 VAL HA . . 5.120 4.291 4.117 4.775 . 0 0 "[ . 1 . 2]" 1 1367 1 95 LEU QD 1 100 VAL HB . . 5.500 4.276 4.031 4.806 . 0 0 "[ . 1 . 2]" 1 1368 1 95 LEU QD 1 100 VAL QG . . 3.160 2.284 1.990 2.782 . 0 0 "[ . 1 . 2]" 1 1369 1 95 LEU QD 1 101 GLU H . . 5.400 2.333 2.168 2.745 . 0 0 "[ . 1 . 2]" 1 1370 1 95 LEU QD 1 102 GLU H . . 4.830 2.917 2.775 3.076 . 0 0 "[ . 1 . 2]" 1 1371 1 95 LEU QD 1 102 GLU HB3 . . 5.500 3.949 3.810 4.194 . 0 0 "[ . 1 . 2]" 1 1372 1 95 LEU QD 1 102 GLU QG . . 5.340 3.551 3.105 3.869 . 0 0 "[ . 1 . 2]" 1 1373 1 95 LEU QD 1 103 VAL H . . 4.240 2.743 2.556 2.981 . 0 0 "[ . 1 . 2]" 1 1374 1 95 LEU QD 1 103 VAL HB . . 3.690 3.177 2.071 3.770 0.080 18 0 "[ . 1 . 2]" 1 1375 1 95 LEU QD 1 103 VAL MG1 . . 5.460 3.327 2.507 3.817 . 0 0 "[ . 1 . 2]" 1 1376 1 95 LEU QD 1 103 VAL QG . . 2.450 2.002 1.679 2.572 0.122 14 0 "[ . 1 . 2]" 1 1377 1 95 LEU QD 1 103 VAL MG2 . . 5.460 2.352 1.682 3.579 . 0 0 "[ . 1 . 2]" 1 1378 1 95 LEU QD 1 104 VAL H . . 5.500 4.761 4.573 4.947 . 0 0 "[ . 1 . 2]" 1 1379 1 95 LEU HG 1 96 LYS H . . 2.540 2.667 2.615 2.727 0.187 6 0 "[ . 1 . 2]" 1 1380 1 95 LEU HG 1 96 LYS HA . . 5.500 4.370 4.072 4.647 . 0 0 "[ . 1 . 2]" 1 1381 1 95 LEU HG 1 97 ASN H . . 5.360 4.927 4.848 4.997 . 0 0 "[ . 1 . 2]" 1 1382 1 95 LEU HG 1 102 GLU QG . . 5.340 5.227 4.849 5.526 0.186 11 0 "[ . 1 . 2]" 1 1383 1 95 LEU HG 1 103 VAL QG . . 2.990 3.476 3.113 3.997 1.007 9 7 "[ -* +1 *. * **]" 1 1384 1 96 LYS H 1 96 LYS QB . . 2.400 2.721 2.655 2.788 0.388 14 0 "[ . 1 . 2]" 1 1385 1 96 LYS H 1 96 LYS QE . . 5.320 4.175 3.918 4.591 . 0 0 "[ . 1 . 2]" 1 1386 1 96 LYS H 1 96 LYS HG2 . . 3.180 2.269 2.152 2.385 . 0 0 "[ . 1 . 2]" 1 1387 1 96 LYS H 1 97 ASN QB . . 5.340 4.238 4.089 4.390 . 0 0 "[ . 1 . 2]" 1 1388 1 96 LYS H 1 103 VAL QG . . 5.110 5.432 5.055 5.815 0.705 9 7 "[ *- +1 *. * **]" 1 1389 1 96 LYS HA 1 96 LYS QB . . 2.700 2.178 2.166 2.193 . 0 0 "[ . 1 . 2]" 1 1390 1 96 LYS HA 1 96 LYS QE . . 5.340 4.455 4.129 5.207 . 0 0 "[ . 1 . 2]" 1 1391 1 96 LYS HA 1 96 LYS HG3 . . 3.630 3.685 3.648 3.722 0.092 11 0 "[ . 1 . 2]" 1 1392 1 96 LYS HA 1 97 ASN HA . . 5.500 4.660 4.616 4.764 . 0 0 "[ . 1 . 2]" 1 1393 1 96 LYS HA 1 97 ASN QB . . 5.340 5.190 5.069 5.345 0.005 5 0 "[ . 1 . 2]" 1 1394 1 96 LYS QB 1 96 LYS QE . . 4.200 2.256 1.906 2.937 . 0 0 "[ . 1 . 2]" 1 1395 1 96 LYS QB 1 96 LYS HG2 . . 2.400 2.235 2.201 2.272 . 0 0 "[ . 1 . 2]" 1 1396 1 96 LYS HD2 1 96 LYS QE . . 2.620 2.301 2.152 2.433 . 0 0 "[ . 1 . 2]" 1 1397 1 96 LYS HD2 1 96 LYS HG3 . . 2.400 2.467 2.386 2.542 0.142 20 0 "[ . 1 . 2]" 1 1398 1 96 LYS HD2 1 97 ASN H . . 4.690 4.731 4.569 4.918 0.228 14 0 "[ . 1 . 2]" 1 1399 1 96 LYS HG3 1 97 ASN H . . 2.750 2.342 2.182 2.461 . 0 0 "[ . 1 . 2]" 1 1400 1 96 LYS HG3 1 97 ASN QB . . 4.280 3.222 2.994 3.497 . 0 0 "[ . 1 . 2]" 1 1401 1 97 ASN H 1 97 ASN QB . . 3.310 2.241 2.192 2.281 . 0 0 "[ . 1 . 2]" 1 1402 1 97 ASN H 1 98 LEU MD2 . . 5.380 5.315 5.209 5.382 0.002 17 0 "[ . 1 . 2]" 1 1403 1 97 ASN QB 1 98 LEU H . . 3.870 2.447 2.202 2.614 . 0 0 "[ . 1 . 2]" 1 1404 1 97 ASN QB 1 98 LEU MD2 . . 5.340 3.813 3.570 4.081 . 0 0 "[ . 1 . 2]" 1 1405 1 97 ASN HB2 1 98 LEU H . . 4.460 3.287 2.569 3.988 . 0 0 "[ . 1 . 2]" 1 1406 1 97 ASN HB3 1 98 LEU H . . 4.460 2.797 2.219 3.394 . 0 0 "[ . 1 . 2]" 1 1407 1 98 LEU H 1 98 LEU HB3 . . 2.850 3.054 2.950 3.153 0.303 14 0 "[ . 1 . 2]" 1 1408 1 98 LEU H 1 98 LEU MD2 . . 3.540 3.613 3.579 3.690 0.150 14 0 "[ . 1 . 2]" 1 1409 1 98 LEU H 1 98 LEU HG . . 2.760 2.140 2.079 2.198 . 0 0 "[ . 1 . 2]" 1 1410 1 98 LEU H 1 99 GLY H . . 2.460 2.119 1.996 2.202 . 0 0 "[ . 1 . 2]" 1 1411 1 98 LEU HA 1 98 LEU HB2 . . 2.400 2.453 2.430 2.469 0.069 12 0 "[ . 1 . 2]" 1 1412 1 98 LEU HA 1 99 GLY HA2 . . 5.500 4.546 4.502 4.600 . 0 0 "[ . 1 . 2]" 1 1413 1 98 LEU MD1 1 99 GLY H . . 4.480 2.837 2.581 3.089 . 0 0 "[ . 1 . 2]" 1 1414 1 98 LEU MD1 1 99 GLY HA2 . . 4.250 2.405 2.323 2.526 . 0 0 "[ . 1 . 2]" 1 1415 1 98 LEU MD2 1 99 GLY H . . 5.080 4.676 4.531 4.803 . 0 0 "[ . 1 . 2]" 1 1416 1 98 LEU MD2 1 99 GLY HA2 . . 4.910 5.118 5.075 5.176 0.266 6 0 "[ . 1 . 2]" 1 1417 1 98 LEU HG 1 99 GLY H . . 4.630 3.304 3.084 3.457 . 0 0 "[ . 1 . 2]" 1 1418 1 98 LEU HG 1 99 GLY HA3 . . 4.470 4.447 4.267 4.552 0.082 6 0 "[ . 1 . 2]" 1 1419 1 99 GLY H 1 99 GLY HA2 . . 2.850 2.901 2.888 2.909 0.059 20 0 "[ . 1 . 2]" 1 1420 1 99 GLY H 1 99 GLY HA3 . . 2.930 2.343 2.320 2.359 . 0 0 "[ . 1 . 2]" 1 1421 1 99 GLY HA2 1 100 VAL HA . . 5.350 4.432 4.308 4.523 . 0 0 "[ . 1 . 2]" 1 1422 1 99 GLY HA3 1 100 VAL H . . 2.540 2.210 2.125 2.266 . 0 0 "[ . 1 . 2]" 1 1423 1 99 GLY HA3 1 100 VAL MG1 . . 5.500 3.469 3.303 3.826 . 0 0 "[ . 1 . 2]" 1 1424 1 99 GLY HA3 1 100 VAL MG2 . . 5.500 5.339 5.221 5.435 . 0 0 "[ . 1 . 2]" 1 1425 1 100 VAL H 1 100 VAL MG1 . . 3.950 2.397 2.153 2.527 . 0 0 "[ . 1 . 2]" 1 1426 1 100 VAL H 1 100 VAL QG . . 2.510 2.378 2.143 2.502 . 0 0 "[ . 1 . 2]" 1 1427 1 100 VAL H 1 100 VAL MG2 . . 3.950 3.969 3.903 4.014 0.064 17 0 "[ . 1 . 2]" 1 1428 1 100 VAL H 1 101 GLU H . . 3.180 2.987 2.756 3.164 . 0 0 "[ . 1 . 2]" 1 1429 1 100 VAL HA 1 100 VAL QG . . 3.080 2.338 2.219 2.414 . 0 0 "[ . 1 . 2]" 1 1430 1 100 VAL HA 1 101 GLU QG . . 4.600 4.067 3.783 4.236 . 0 0 "[ . 1 . 2]" 1 1431 1 100 VAL HB 1 101 GLU HA . . 5.500 5.785 5.748 5.821 0.321 9 0 "[ . 1 . 2]" 1 1432 1 100 VAL QG 1 101 GLU H . . 2.430 1.575 1.526 1.694 . 0 0 "[ . 1 . 2]" 1 1433 1 100 VAL QG 1 101 GLU HA . . 3.780 3.533 3.448 3.630 . 0 0 "[ . 1 . 2]" 1 1434 1 100 VAL QG 1 101 GLU HB2 . . 5.440 2.977 2.780 3.146 . 0 0 "[ . 1 . 2]" 1 1435 1 100 VAL QG 1 101 GLU HB3 . . 4.060 3.991 3.898 4.067 0.007 2 0 "[ . 1 . 2]" 1 1436 1 100 VAL QG 1 101 GLU QG . . 2.830 1.867 1.723 2.044 . 0 0 "[ . 1 . 2]" 1 1437 1 100 VAL MG1 1 101 GLU H . . 3.690 1.589 1.539 1.732 . 0 0 "[ . 1 . 2]" 1 1438 1 100 VAL MG2 1 101 GLU H . . 3.690 2.692 2.289 3.247 . 0 0 "[ . 1 . 2]" 1 1439 1 101 GLU H 1 101 GLU HB2 . . 2.600 2.684 2.506 2.785 0.185 9 0 "[ . 1 . 2]" 1 1440 1 101 GLU H 1 101 GLU HB3 . . 3.780 3.793 3.678 3.849 0.069 9 0 "[ . 1 . 2]" 1 1441 1 101 GLU H 1 102 GLU H . . 3.000 2.875 2.690 3.013 0.013 10 0 "[ . 1 . 2]" 1 1442 1 101 GLU H 1 102 GLU HA . . 4.710 4.363 4.159 4.471 . 0 0 "[ . 1 . 2]" 1 1443 1 101 GLU HA 1 101 GLU QG . . 2.510 2.514 2.405 2.763 0.253 11 0 "[ . 1 . 2]" 1 1444 1 101 GLU HB2 1 101 GLU QG . . 2.560 2.330 2.140 2.421 . 0 0 "[ . 1 . 2]" 1 1445 1 101 GLU HB2 1 102 GLU H . . 3.230 1.790 1.641 1.965 . 0 0 "[ . 1 . 2]" 1 1446 1 101 GLU HB2 1 102 GLU HA . . 5.500 4.566 4.438 4.713 . 0 0 "[ . 1 . 2]" 1 1447 1 101 GLU QG 1 102 GLU H . . 4.550 3.767 3.657 3.885 . 0 0 "[ . 1 . 2]" 1 1448 1 101 GLU HG2 1 102 GLU H . . 5.370 4.442 4.159 4.623 . 0 0 "[ . 1 . 2]" 1 1449 1 101 GLU HG3 1 102 GLU H . . 5.370 4.073 3.956 4.219 . 0 0 "[ . 1 . 2]" 1 1450 1 102 GLU H 1 102 GLU HA . . 2.910 2.877 2.835 2.901 . 0 0 "[ . 1 . 2]" 1 1451 1 102 GLU H 1 102 GLU HB2 . . 3.380 2.934 2.836 3.088 . 0 0 "[ . 1 . 2]" 1 1452 1 102 GLU H 1 102 GLU HB3 . . 3.850 3.818 3.122 3.965 0.115 5 0 "[ . 1 . 2]" 1 1453 1 102 GLU H 1 103 VAL H . . 4.540 4.252 4.199 4.310 . 0 0 "[ . 1 . 2]" 1 1454 1 102 GLU H 1 103 VAL HA . . 5.500 4.511 4.173 4.829 . 0 0 "[ . 1 . 2]" 1 1455 1 102 GLU HA 1 102 GLU QG . . 2.770 2.497 2.352 2.766 . 0 0 "[ . 1 . 2]" 1 1456 1 102 GLU HA 1 103 VAL H . . 2.550 2.358 2.247 2.541 . 0 0 "[ . 1 . 2]" 1 1457 1 102 GLU HA 1 103 VAL QG . . 5.440 3.737 3.579 3.945 . 0 0 "[ . 1 . 2]" 1 1458 1 102 GLU HB3 1 103 VAL H . . 4.140 2.574 2.337 3.264 . 0 0 "[ . 1 . 2]" 1 1459 1 102 GLU HB3 1 103 VAL HA . . 5.500 4.548 4.178 4.711 . 0 0 "[ . 1 . 2]" 1 1460 1 102 GLU HB3 1 104 VAL HA . . 5.500 5.200 4.915 5.626 0.126 5 0 "[ . 1 . 2]" 1 1461 1 102 GLU QG 1 103 VAL H . . 4.360 3.724 2.055 4.263 . 0 0 "[ . 1 . 2]" 1 1462 1 103 VAL H 1 103 VAL QG . . 3.340 2.265 2.026 2.498 . 0 0 "[ . 1 . 2]" 1 1463 1 103 VAL H 1 104 VAL H . . 4.650 4.466 4.426 4.510 . 0 0 "[ . 1 . 2]" 1 1464 1 103 VAL H 1 104 VAL HA . . 5.500 5.262 5.118 5.354 . 0 0 "[ . 1 . 2]" 1 1465 1 103 VAL HA 1 103 VAL MG1 . . 3.220 2.720 2.412 3.195 . 0 0 "[ . 1 . 2]" 1 1466 1 103 VAL HA 1 103 VAL QG . . 2.770 2.214 2.105 2.413 . 0 0 "[ . 1 . 2]" 1 1467 1 103 VAL HA 1 103 VAL MG2 . . 3.220 2.370 2.264 2.498 . 0 0 "[ . 1 . 2]" 1 1468 1 103 VAL HA 1 104 VAL H . . 2.770 2.121 2.056 2.179 . 0 0 "[ . 1 . 2]" 1 1469 1 103 VAL HA 1 104 VAL HA . . 5.500 4.344 4.240 4.406 . 0 0 "[ . 1 . 2]" 1 1470 1 103 VAL HA 1 104 VAL HB . . 5.500 4.705 4.594 4.825 . 0 0 "[ . 1 . 2]" 1 1471 1 103 VAL HB 1 104 VAL H . . 4.580 4.054 3.857 4.184 . 0 0 "[ . 1 . 2]" 1 1472 1 103 VAL QG 1 104 VAL H . . 2.500 2.484 2.339 2.627 0.127 11 0 "[ . 1 . 2]" 1 1473 1 103 VAL QG 1 104 VAL HA . . 3.880 3.694 3.579 3.795 . 0 0 "[ . 1 . 2]" 1 1474 1 104 VAL H 1 104 VAL HB . . 2.730 2.608 2.527 2.664 . 0 0 "[ . 1 . 2]" 1 1475 1 104 VAL H 1 104 VAL QG . . 2.800 2.129 1.973 2.281 . 0 0 "[ . 1 . 2]" 1 1476 1 104 VAL H 1 105 ALA H . . 5.500 4.213 4.013 4.399 . 0 0 "[ . 1 . 2]" 1 1477 1 104 VAL HA 1 104 VAL MG1 . . 2.810 2.339 2.295 2.389 . 0 0 "[ . 1 . 2]" 1 1478 1 104 VAL HA 1 104 VAL QG . . 2.340 2.158 2.140 2.175 . 0 0 "[ . 1 . 2]" 1 1479 1 104 VAL HA 1 104 VAL MG2 . . 2.810 2.536 2.460 2.613 . 0 0 "[ . 1 . 2]" 1 1480 1 104 VAL HA 1 105 ALA H . . 2.400 2.160 2.132 2.194 . 0 0 "[ . 1 . 2]" 1 1481 1 104 VAL HA 1 106 LYS QD . . 5.340 4.431 3.748 5.439 0.099 4 0 "[ . 1 . 2]" 1 1482 1 104 VAL QG 1 105 ALA H . . 3.100 3.080 2.832 3.190 0.090 3 0 "[ . 1 . 2]" 1 1483 1 104 VAL QG 1 106 LYS QG . . 4.550 3.455 2.184 4.261 . 0 0 "[ . 1 . 2]" 1 1484 1 105 ALA H 1 105 ALA MB . . 2.850 2.544 2.459 2.620 . 0 0 "[ . 1 . 2]" 1 1485 1 105 ALA H 1 106 LYS H . . 4.110 4.121 3.927 4.208 0.098 14 0 "[ . 1 . 2]" 1 1486 1 105 ALA H 1 106 LYS HA . . 5.120 4.868 4.656 4.950 . 0 0 "[ . 1 . 2]" 1 1487 1 105 ALA H 1 106 LYS QE . . 5.340 4.197 3.447 5.386 0.046 15 0 "[ . 1 . 2]" 1 1488 1 105 ALA HA 1 106 LYS H . . 2.510 2.065 2.020 2.119 . 0 0 "[ . 1 . 2]" 1 1489 1 105 ALA MB 1 106 LYS H . . 3.600 3.103 2.885 3.255 . 0 0 "[ . 1 . 2]" 1 1490 1 105 ALA MB 1 106 LYS QB . . 5.340 4.842 4.709 4.944 . 0 0 "[ . 1 . 2]" 1 1491 1 106 LYS H 1 106 LYS QB . . 2.820 2.728 2.602 2.797 . 0 0 "[ . 1 . 2]" 1 1492 1 106 LYS H 1 107 VAL H . . 4.980 4.298 4.235 4.355 . 0 0 "[ . 1 . 2]" 1 1493 1 106 LYS HA 1 106 LYS QG . . 3.740 2.562 2.386 2.683 . 0 0 "[ . 1 . 2]" 1 1494 1 106 LYS HA 1 107 VAL H . . 2.400 2.289 2.150 2.393 . 0 0 "[ . 1 . 2]" 1 1495 1 106 LYS HA 1 107 VAL HA . . 4.570 4.400 4.343 4.450 . 0 0 "[ . 1 . 2]" 1 1496 1 106 LYS QB 1 107 VAL H . . 4.280 2.556 2.214 2.979 . 0 0 "[ . 1 . 2]" 1 1497 1 106 LYS QB 1 107 VAL HA . . 5.340 4.045 3.858 4.234 . 0 0 "[ . 1 . 2]" 1 1498 1 106 LYS QB 1 107 VAL HB . . 5.340 4.822 4.562 5.172 . 0 0 "[ . 1 . 2]" 1 1499 1 106 LYS QB 1 108 PHE HA . . 5.340 4.615 3.962 4.990 . 0 0 "[ . 1 . 2]" 1 1500 1 106 LYS QB 2 30 HIS HD2 . . 5.340 4.453 3.593 4.844 . 0 0 "[ . 1 . 2]" 1 1501 1 106 LYS QD 2 30 HIS HD2 . . 5.230 3.712 2.597 4.408 . 0 0 "[ . 1 . 2]" 1 1502 1 106 LYS QD 2 30 HIS HE1 . . 5.340 4.527 3.436 5.397 0.057 10 0 "[ . 1 . 2]" 1 1503 1 107 VAL H 1 107 VAL HB . . 2.710 2.600 2.533 2.689 . 0 0 "[ . 1 . 2]" 1 1504 1 107 VAL H 1 107 VAL MG2 . . 3.600 2.581 2.438 2.716 . 0 0 "[ . 1 . 2]" 1 1505 1 107 VAL H 1 108 PHE H . . 4.480 4.215 4.028 4.459 . 0 0 "[ . 1 . 2]" 1 1506 1 107 VAL H 1 108 PHE HA . . 5.260 4.639 4.464 4.853 . 0 0 "[ . 1 . 2]" 1 1507 1 107 VAL H 1 108 PHE QB . . 5.340 5.190 4.882 6.074 0.734 17 1 "[ . 1 . + 2]" 1 1508 1 107 VAL HA 1 108 PHE H . . 2.480 2.191 2.109 2.262 . 0 0 "[ . 1 . 2]" 1 1509 1 107 VAL MG1 1 108 PHE H . . 3.940 2.957 2.477 3.177 . 0 0 "[ . 1 . 2]" 1 1510 1 108 PHE H 1 108 PHE QB . . 3.410 2.804 2.532 2.996 . 0 0 "[ . 1 . 2]" 1 1511 1 108 PHE H 1 109 ASP H . . 4.550 4.433 4.368 4.471 . 0 0 "[ . 1 . 2]" 1 1512 1 108 PHE HA 1 109 ASP H . . 2.590 2.435 2.250 2.598 0.008 1 0 "[ . 1 . 2]" 1 1513 1 108 PHE HA 1 109 ASP HA . . 5.500 4.387 4.297 4.465 . 0 0 "[ . 1 . 2]" 1 1514 1 108 PHE HA 1 109 ASP QB . . 5.340 3.884 3.590 4.315 . 0 0 "[ . 1 . 2]" 1 1515 1 108 PHE HA 2 64 THR MG . . 5.500 3.803 3.317 4.152 . 0 0 "[ . 1 . 2]" 1 1516 1 108 PHE QB 1 109 ASP H . . 3.390 2.110 1.920 2.322 . 0 0 "[ . 1 . 2]" 1 1517 1 108 PHE QB 2 65 GLU H . . 5.340 4.265 4.078 4.537 . 0 0 "[ . 1 . 2]" 1 1518 1 108 PHE HB2 2 64 THR HB . . 5.500 4.639 4.316 5.790 0.290 17 0 "[ . 1 . 2]" 1 1519 1 108 PHE HB2 2 64 THR MG . . 5.500 2.077 1.817 3.021 . 0 0 "[ . 1 . 2]" 1 1520 1 108 PHE HB3 2 64 THR HB . . 5.500 5.455 4.399 5.675 0.175 6 0 "[ . 1 . 2]" 1 1521 1 108 PHE HB3 2 64 THR MG . . 5.500 2.886 1.726 3.176 . 0 0 "[ . 1 . 2]" 1 1522 1 108 PHE QD 1 109 ASP H . . 3.350 3.014 2.687 3.489 0.139 17 0 "[ . 1 . 2]" 1 1523 1 108 PHE QD 1 109 ASP QB . . 5.060 4.667 4.354 5.161 0.101 17 0 "[ . 1 . 2]" 1 1524 1 108 PHE QD 2 64 THR HB . . 4.640 4.350 3.720 4.680 0.040 6 0 "[ . 1 . 2]" 1 1525 1 108 PHE QD 2 64 THR MG . . 3.730 1.936 1.842 2.173 . 0 0 "[ . 1 . 2]" 1 1526 1 108 PHE QD 2 65 GLU H . . 4.310 4.446 4.289 4.597 0.287 17 0 "[ . 1 . 2]" 1 1527 1 109 ASP H 1 109 ASP QB . . 2.740 2.534 2.341 2.661 . 0 0 "[ . 1 . 2]" 1 1528 1 109 ASP H 1 110 VAL H . . 4.560 4.304 4.105 4.416 . 0 0 "[ . 1 . 2]" 1 1529 1 109 ASP H 2 65 GLU H . . 3.650 3.581 3.292 3.795 0.145 2 0 "[ . 1 . 2]" 1 1530 1 109 ASP H 2 66 SER H . . 5.500 4.467 4.012 5.205 . 0 0 "[ . 1 . 2]" 1 1531 1 109 ASP QB 1 110 VAL H . . 4.480 3.321 2.279 3.831 . 0 0 "[ . 1 . 2]" 1 1532 1 109 ASP QB 2 66 SER H . . 5.340 4.461 3.807 5.361 0.021 11 0 "[ . 1 . 2]" 1 1533 1 110 VAL H 1 110 VAL MG1 . . 4.800 2.635 1.885 3.775 . 0 0 "[ . 1 . 2]" 1 1534 1 110 VAL H 1 110 VAL QG . . 3.920 1.970 1.873 2.284 . 0 0 "[ . 1 . 2]" 1 1535 1 110 VAL H 1 110 VAL MG2 . . 4.800 2.301 1.929 3.789 . 0 0 "[ . 1 . 2]" 1 1536 1 110 VAL H 1 111 ASN H . . 4.520 4.501 4.368 4.571 0.051 18 0 "[ . 1 . 2]" 1 1537 1 110 VAL H 1 111 ASN HA . . 5.300 5.298 5.039 5.372 0.072 9 0 "[ . 1 . 2]" 1 1538 1 110 VAL HB 1 111 ASN H . . 5.420 3.336 2.505 4.287 . 0 0 "[ . 1 . 2]" 1 1539 1 110 VAL QG 1 111 ASN H . . 4.100 3.104 2.309 3.625 . 0 0 "[ . 1 . 2]" 1 1540 1 110 VAL QG 1 111 ASN HA . . 5.440 3.761 3.261 4.214 . 0 0 "[ . 1 . 2]" 1 1541 1 110 VAL QG 1 112 GLU H . . 5.210 4.081 3.201 4.929 . 0 0 "[ . 1 . 2]" 1 1542 1 110 VAL MG1 1 111 ASN H . . 4.770 3.575 2.651 3.957 . 0 0 "[ . 1 . 2]" 1 1543 1 110 VAL MG2 1 111 ASN H . . 4.770 3.660 2.328 4.238 . 0 0 "[ . 1 . 2]" 1 1544 1 111 ASN H 1 111 ASN QB . . 2.690 2.536 2.326 2.957 0.267 6 0 "[ . 1 . 2]" 1 1545 1 111 ASN H 1 112 GLU H . . 4.630 4.166 3.880 4.454 . 0 0 "[ . 1 . 2]" 1 1546 1 111 ASN H 1 112 GLU QG . . 5.340 4.812 3.880 5.461 0.121 2 0 "[ . 1 . 2]" 1 1547 1 111 ASN H 2 63 TRP H . . 5.500 5.273 4.921 5.577 0.077 4 0 "[ . 1 . 2]" 1 1548 1 111 ASN H 2 63 TRP QB . . 5.260 3.212 2.771 3.682 . 0 0 "[ . 1 . 2]" 1 1549 1 111 ASN H 2 64 THR HA . . 3.440 2.542 2.152 3.016 . 0 0 "[ . 1 . 2]" 1 1550 1 111 ASN H 2 64 THR HB . . 5.500 5.373 5.101 5.830 0.330 15 0 "[ . 1 . 2]" 1 1551 1 111 ASN H 2 65 GLU H . . 4.530 3.846 3.125 4.435 . 0 0 "[ . 1 . 2]" 1 1552 1 111 ASN HA 1 112 GLU H . . 3.520 2.113 2.055 2.217 . 0 0 "[ . 1 . 2]" 1 1553 1 111 ASN HA 1 112 GLU HB2 . . 5.500 4.785 4.440 5.639 0.139 5 0 "[ . 1 . 2]" 1 1554 1 111 ASN HA 1 112 GLU HB3 . . 5.500 5.330 4.358 5.631 0.131 12 0 "[ . 1 . 2]" 1 1555 1 111 ASN HA 1 113 PRO QD . . 4.450 3.191 2.818 3.511 . 0 0 "[ . 1 . 2]" 1 1556 1 111 ASN HA 2 65 GLU H . . 5.500 4.908 4.302 5.514 0.014 18 0 "[ . 1 . 2]" 1 1557 1 112 GLU H 1 112 GLU QG . . 3.540 2.233 1.826 2.677 . 0 0 "[ . 1 . 2]" 1 1558 1 112 GLU H 1 113 PRO HA . . 5.390 5.413 5.198 5.563 0.173 20 0 "[ . 1 . 2]" 1 1559 1 112 GLU H 1 113 PRO HD2 . . 3.220 2.211 1.708 2.918 . 0 0 "[ . 1 . 2]" 1 1560 1 112 GLU H 1 113 PRO QD . . 2.770 2.160 1.699 2.651 . 0 0 "[ . 1 . 2]" 1 1561 1 112 GLU H 1 113 PRO HD3 . . 3.220 3.213 2.958 3.334 0.114 20 0 "[ . 1 . 2]" 1 1562 1 112 GLU H 1 114 LEU H . . 5.500 4.690 4.309 4.964 . 0 0 "[ . 1 . 2]" 1 1563 1 112 GLU H 1 115 SER QB . . 5.340 5.185 4.524 5.509 0.169 10 0 "[ . 1 . 2]" 1 1564 1 112 GLU HA 1 115 SER H . . 5.200 3.435 2.902 3.858 . 0 0 "[ . 1 . 2]" 1 1565 1 112 GLU QB 1 112 GLU QG . . 2.310 2.065 1.984 2.094 . 0 0 "[ . 1 . 2]" 1 1566 1 112 GLU QB 1 113 PRO QD . . 4.530 2.983 2.144 4.025 . 0 0 "[ . 1 . 2]" 1 1567 1 112 GLU QG 1 113 PRO HA . . 5.340 5.733 4.212 6.166 0.826 10 14 "[* **.- * +** **** **]" 1 1568 1 112 GLU QG 1 113 PRO QD . . 4.170 3.697 2.753 4.159 . 0 0 "[ . 1 . 2]" 1 1569 1 113 PRO HA 1 117 ILE MD . . 5.500 5.208 4.656 5.557 0.057 1 0 "[ . 1 . 2]" 1 1570 1 113 PRO QB 1 115 SER H . . 4.580 4.584 4.490 4.648 0.068 5 0 "[ . 1 . 2]" 1 1571 1 113 PRO HB2 2 42 ALA MB . . 5.500 4.642 3.649 5.532 0.032 9 0 "[ . 1 . 2]" 1 1572 1 113 PRO HB3 2 42 ALA MB . . 5.500 4.975 4.002 6.003 0.503 9 1 "[ . +1 . 2]" 1 1573 1 113 PRO QD 1 114 LEU QD . . 5.280 3.946 2.730 4.971 . 0 0 "[ . 1 . 2]" 1 1574 1 113 PRO QD 1 115 SER H . . 5.350 4.542 4.233 4.710 . 0 0 "[ . 1 . 2]" 1 1575 1 113 PRO QD 2 42 ALA HA . . 5.350 4.749 4.028 5.241 . 0 0 "[ . 1 . 2]" 1 1576 1 113 PRO QG 1 114 LEU HG . . 5.350 3.727 2.433 4.880 . 0 0 "[ . 1 . 2]" 1 1577 1 113 PRO QG 2 63 TRP HA . . 5.350 5.435 5.326 5.534 0.184 16 0 "[ . 1 . 2]" 1 1578 1 114 LEU H 1 114 LEU HB2 . . 3.900 2.544 2.429 2.704 . 0 0 "[ . 1 . 2]" 1 1579 1 114 LEU H 1 114 LEU QB . . 3.360 2.498 2.395 2.645 . 0 0 "[ . 1 . 2]" 1 1580 1 114 LEU H 1 114 LEU HB3 . . 3.900 3.653 3.582 3.745 . 0 0 "[ . 1 . 2]" 1 1581 1 114 LEU H 1 114 LEU MD1 . . 3.610 3.489 3.041 3.763 0.153 3 0 "[ . 1 . 2]" 1 1582 1 114 LEU H 1 114 LEU QD . . 2.940 2.480 1.784 3.118 0.178 19 0 "[ . 1 . 2]" 1 1583 1 114 LEU H 1 114 LEU MD2 . . 3.610 2.583 1.794 3.340 . 0 0 "[ . 1 . 2]" 1 1584 1 114 LEU H 1 114 LEU HG . . 4.040 3.237 2.333 4.096 0.056 18 0 "[ . 1 . 2]" 1 1585 1 114 LEU H 1 115 SER H . . 2.870 2.524 2.383 2.729 . 0 0 "[ . 1 . 2]" 1 1586 1 114 LEU H 1 116 GLN H . . 4.840 4.429 4.224 4.703 . 0 0 "[ . 1 . 2]" 1 1587 1 114 LEU H 2 63 TRP HA . . 5.500 4.349 3.962 4.746 . 0 0 "[ . 1 . 2]" 1 1588 1 114 LEU H 2 63 TRP QB . . 4.200 3.216 2.866 3.715 . 0 0 "[ . 1 . 2]" 1 1589 1 114 LEU HA 1 114 LEU QD . . 2.450 2.016 1.827 2.139 . 0 0 "[ . 1 . 2]" 1 1590 1 114 LEU HA 1 114 LEU HG . . 3.960 3.468 3.105 3.793 . 0 0 "[ . 1 . 2]" 1 1591 1 114 LEU HA 1 116 GLN H . . 3.430 3.240 2.944 3.447 0.017 8 0 "[ . 1 . 2]" 1 1592 1 114 LEU HA 1 117 ILE HB . . 5.500 4.039 3.717 4.361 . 0 0 "[ . 1 . 2]" 1 1593 1 114 LEU HA 1 117 ILE MD . . 2.400 2.054 1.873 2.329 . 0 0 "[ . 1 . 2]" 1 1594 1 114 LEU HA 1 118 ASN H . . 5.500 5.420 5.109 5.610 0.110 9 0 "[ . 1 . 2]" 1 1595 1 114 LEU HA 2 46 LYS QD . . 4.610 3.440 2.695 4.452 . 0 0 "[ . 1 . 2]" 1 1596 1 114 LEU QB 1 116 GLN H . . 5.340 4.434 4.078 4.627 . 0 0 "[ . 1 . 2]" 1 1597 1 114 LEU QB 1 117 ILE MD . . 5.210 2.886 2.386 3.286 . 0 0 "[ . 1 . 2]" 1 1598 1 114 LEU QB 1 118 ASN H . . 5.340 5.282 5.047 5.405 0.065 12 0 "[ . 1 . 2]" 1 1599 1 114 LEU QB 2 45 LEU QB . . 5.340 3.993 3.588 4.293 . 0 0 "[ . 1 . 2]" 1 1600 1 114 LEU QB 2 45 LEU HG . . 5.340 4.478 3.729 5.370 0.030 10 0 "[ . 1 . 2]" 1 1601 1 114 LEU QB 2 46 LYS H . . 5.340 5.343 5.059 5.458 0.118 13 0 "[ . 1 . 2]" 1 1602 1 114 LEU QB 2 63 TRP HD1 . . 4.580 3.962 2.941 4.575 . 0 0 "[ . 1 . 2]" 1 1603 1 114 LEU HB2 1 115 SER H . . 5.250 3.600 3.324 3.784 . 0 0 "[ . 1 . 2]" 1 1604 1 114 LEU HB3 1 115 SER H . . 5.250 4.299 4.146 4.414 . 0 0 "[ . 1 . 2]" 1 1605 1 114 LEU QD 1 115 SER H . . 4.960 4.034 3.678 4.331 . 0 0 "[ . 1 . 2]" 1 1606 1 114 LEU QD 1 116 GLN H . . 5.020 4.554 4.354 4.769 . 0 0 "[ . 1 . 2]" 1 1607 1 114 LEU QD 1 117 ILE HB . . 4.600 4.102 3.511 4.605 0.005 11 0 "[ . 1 . 2]" 1 1608 1 114 LEU QD 1 117 ILE MD . . 3.030 2.404 1.902 2.730 . 0 0 "[ . 1 . 2]" 1 1609 1 114 LEU QD 1 117 ILE HG13 . . 5.440 4.825 4.202 5.246 . 0 0 "[ . 1 . 2]" 1 1610 1 114 LEU QD 1 117 ILE MG . . 5.440 4.474 3.983 4.967 . 0 0 "[ . 1 . 2]" 1 1611 1 114 LEU QD 2 42 ALA H . . 4.620 3.869 3.605 4.161 . 0 0 "[ . 1 . 2]" 1 1612 1 114 LEU QD 2 42 ALA HA . . 4.500 2.509 1.801 3.560 . 0 0 "[ . 1 . 2]" 1 1613 1 114 LEU QD 2 42 ALA MB . . 4.780 3.644 3.222 4.361 . 0 0 "[ . 1 . 2]" 1 1614 1 114 LEU QD 2 43 GLU H . . 5.280 3.773 2.965 4.648 . 0 0 "[ . 1 . 2]" 1 1615 1 114 LEU QD 2 43 GLU HA . . 5.440 3.406 2.766 4.207 . 0 0 "[ . 1 . 2]" 1 1616 1 114 LEU QD 2 44 GLN H . . 5.390 4.346 3.994 4.743 . 0 0 "[ . 1 . 2]" 1 1617 1 114 LEU QD 2 45 LEU H . . 4.880 3.029 2.768 3.237 . 0 0 "[ . 1 . 2]" 1 1618 1 114 LEU QD 2 45 LEU QB . . 5.440 1.900 1.681 2.340 . 0 0 "[ . 1 . 2]" 1 1619 1 114 LEU QD 2 45 LEU QD . . 2.680 2.441 1.772 2.783 0.103 20 0 "[ . 1 . 2]" 1 1620 1 114 LEU QD 2 45 LEU HG . . 5.440 2.974 1.974 4.384 . 0 0 "[ . 1 . 2]" 1 1621 1 114 LEU QD 2 46 LYS H . . 3.170 2.507 2.173 2.725 . 0 0 "[ . 1 . 2]" 1 1622 1 114 LEU QD 2 46 LYS HA . . 5.380 3.055 2.697 3.514 . 0 0 "[ . 1 . 2]" 1 1623 1 114 LEU QD 2 46 LYS QB . . 4.530 2.404 1.927 3.692 . 0 0 "[ . 1 . 2]" 1 1624 1 114 LEU QD 2 46 LYS QD . . 4.850 3.119 2.288 3.952 . 0 0 "[ . 1 . 2]" 1 1625 1 114 LEU QD 2 46 LYS QG . . 5.280 3.307 1.806 4.128 . 0 0 "[ . 1 . 2]" 1 1626 1 114 LEU MD1 2 42 ALA H . . 5.500 4.512 3.708 5.594 0.094 15 0 "[ . 1 . 2]" 1 1627 1 114 LEU MD1 2 42 ALA HA . . 5.500 3.493 2.494 4.453 . 0 0 "[ . 1 . 2]" 1 1628 1 114 LEU MD1 2 42 ALA MB . . 5.500 4.479 3.770 5.257 . 0 0 "[ . 1 . 2]" 1 1629 1 114 LEU MD2 2 42 ALA H . . 5.500 4.425 3.754 5.080 . 0 0 "[ . 1 . 2]" 1 1630 1 114 LEU MD2 2 42 ALA HA . . 5.500 2.823 1.806 4.152 . 0 0 "[ . 1 . 2]" 1 1631 1 114 LEU MD2 2 42 ALA MB . . 5.500 3.987 3.290 4.973 . 0 0 "[ . 1 . 2]" 1 1632 1 114 LEU HG 1 117 ILE MD . . 4.340 4.311 3.945 4.394 0.054 5 0 "[ . 1 . 2]" 1 1633 1 114 LEU HG 2 41 MET HA . . 5.500 4.930 4.021 5.653 0.153 19 0 "[ . 1 . 2]" 1 1634 1 114 LEU HG 2 41 MET HB2 . . 5.500 5.595 5.250 5.737 0.237 16 0 "[ . 1 . 2]" 1 1635 1 114 LEU HG 2 41 MET HB3 . . 5.500 4.615 3.927 5.407 . 0 0 "[ . 1 . 2]" 1 1636 1 114 LEU HG 2 42 ALA H . . 5.500 5.435 4.904 5.621 0.121 6 0 "[ . 1 . 2]" 1 1637 1 114 LEU HG 2 42 ALA HA . . 5.500 3.640 2.515 4.313 . 0 0 "[ . 1 . 2]" 1 1638 1 114 LEU HG 2 42 ALA MB . . 5.500 5.020 3.892 5.547 0.047 20 0 "[ . 1 . 2]" 1 1639 1 114 LEU HG 2 45 LEU H . . 5.500 5.097 4.481 5.570 0.070 1 0 "[ . 1 . 2]" 1 1640 1 114 LEU HG 2 45 LEU QB . . 5.500 3.356 2.356 4.191 . 0 0 "[ . 1 . 2]" 1 1641 1 114 LEU HG 2 45 LEU QD . . 5.440 3.471 1.918 5.080 . 0 0 "[ . 1 . 2]" 1 1642 1 114 LEU HG 2 46 LYS H . . 5.110 4.936 4.590 5.298 0.188 3 0 "[ . 1 . 2]" 1 1643 1 114 LEU HG 2 46 LYS HA . . 5.500 5.797 5.099 6.427 0.927 10 5 "[* * + * . - 2]" 1 1644 1 115 SER H 1 116 GLN H . . 3.080 2.578 2.409 2.860 . 0 0 "[ . 1 . 2]" 1 1645 1 115 SER H 1 117 ILE MD . . 4.350 4.162 3.994 4.408 0.058 4 0 "[ . 1 . 2]" 1 1646 1 115 SER HA 1 118 ASN H . . 4.240 3.290 2.853 3.601 . 0 0 "[ . 1 . 2]" 1 1647 1 115 SER HA 2 63 TRP HD1 . . 5.500 3.571 2.481 4.571 . 0 0 "[ . 1 . 2]" 1 1648 1 115 SER QB 1 116 GLN H . . 4.460 3.338 2.980 3.777 . 0 0 "[ . 1 . 2]" 1 1649 1 115 SER QB 1 116 GLN QB . . 5.180 4.773 4.364 5.247 0.067 3 0 "[ . 1 . 2]" 1 1650 1 116 GLN H 1 116 GLN HB2 . . 4.010 2.415 2.181 2.591 . 0 0 "[ . 1 . 2]" 1 1651 1 116 GLN H 1 116 GLN QB . . 3.390 2.334 2.084 2.538 . 0 0 "[ . 1 . 2]" 1 1652 1 116 GLN H 1 116 GLN HB3 . . 4.010 3.225 2.600 3.705 . 0 0 "[ . 1 . 2]" 1 1653 1 116 GLN H 1 117 ILE H . . 3.220 2.362 1.739 2.610 . 0 0 "[ . 1 . 2]" 1 1654 1 116 GLN H 1 117 ILE MD . . 3.090 2.750 2.224 2.985 . 0 0 "[ . 1 . 2]" 1 1655 1 116 GLN H 1 118 ASN H . . 4.030 3.723 3.340 3.910 . 0 0 "[ . 1 . 2]" 1 1656 1 116 GLN H 1 119 GLN H . . 5.500 5.397 5.225 5.586 0.086 7 0 "[ . 1 . 2]" 1 1657 1 116 GLN HA 1 117 ILE MD . . 4.990 4.115 3.860 4.324 . 0 0 "[ . 1 . 2]" 1 1658 1 116 GLN QB 1 117 ILE HA . . 5.340 4.027 3.800 4.338 . 0 0 "[ . 1 . 2]" 1 1659 1 116 GLN QB 1 117 ILE HB . . 5.340 4.680 4.235 5.209 . 0 0 "[ . 1 . 2]" 1 1660 1 116 GLN QB 1 117 ILE MD . . 3.690 2.151 1.761 2.664 . 0 0 "[ . 1 . 2]" 1 1661 1 116 GLN QB 2 46 LYS QB . . 5.180 4.446 3.799 5.169 . 0 0 "[ . 1 . 2]" 1 1662 1 116 GLN QB 2 46 LYS QD . . 5.130 3.071 2.519 4.018 . 0 0 "[ . 1 . 2]" 1 1663 1 116 GLN QB 2 46 LYS QE . . 5.160 4.422 3.341 5.208 0.048 8 0 "[ . 1 . 2]" 1 1664 1 117 ILE H 1 117 ILE MD . . 2.460 1.907 1.706 2.162 . 0 0 "[ . 1 . 2]" 1 1665 1 117 ILE H 1 117 ILE HG13 . . 3.280 3.383 3.039 3.583 0.303 12 0 "[ . 1 . 2]" 1 1666 1 117 ILE H 1 118 ASN H . . 4.590 2.187 2.042 2.348 . 0 0 "[ . 1 . 2]" 1 1667 1 117 ILE H 1 118 ASN QB . . 5.340 3.818 3.295 4.382 . 0 0 "[ . 1 . 2]" 1 1668 1 117 ILE HA 1 117 ILE HG13 . . 2.830 2.529 2.428 2.621 . 0 0 "[ . 1 . 2]" 1 1669 1 117 ILE HA 1 117 ILE MG . . 2.510 2.438 2.368 2.529 0.019 7 0 "[ . 1 . 2]" 1 1670 1 117 ILE HA 1 119 GLN H . . 3.690 3.578 3.243 3.886 0.196 7 0 "[ . 1 . 2]" 1 1671 1 117 ILE HB 1 117 ILE MD . . 2.770 2.320 2.222 2.400 . 0 0 "[ . 1 . 2]" 1 1672 1 117 ILE HB 1 117 ILE HG13 . . 3.010 3.005 2.969 3.033 0.023 17 0 "[ . 1 . 2]" 1 1673 1 117 ILE HB 1 118 ASN HA . . 5.500 4.566 4.347 4.699 . 0 0 "[ . 1 . 2]" 1 1674 1 117 ILE HB 1 119 GLN H . . 5.400 5.269 4.989 5.454 0.054 1 0 "[ . 1 . 2]" 1 1675 1 117 ILE HB 2 46 LYS QB . . 5.340 5.013 4.077 5.484 0.144 9 0 "[ . 1 . 2]" 1 1676 1 117 ILE HB 2 46 LYS QD . . 5.340 5.404 5.201 5.536 0.196 13 0 "[ . 1 . 2]" 1 1677 1 117 ILE HB 2 49 ALA MB . . 5.500 5.548 5.028 5.728 0.228 1 0 "[ . 1 . 2]" 1 1678 1 117 ILE MD 2 46 LYS H . . 4.770 4.129 3.738 4.628 . 0 0 "[ . 1 . 2]" 1 1679 1 117 ILE MD 2 46 LYS HA . . 5.270 2.685 2.207 3.275 . 0 0 "[ . 1 . 2]" 1 1680 1 117 ILE MD 2 46 LYS HB2 . . 5.500 2.466 2.065 3.597 . 0 0 "[ . 1 . 2]" 1 1681 1 117 ILE MD 2 46 LYS QB . . 4.770 2.138 1.753 2.617 . 0 0 "[ . 1 . 2]" 1 1682 1 117 ILE MD 2 46 LYS HB3 . . 5.500 3.050 1.864 3.917 . 0 0 "[ . 1 . 2]" 1 1683 1 117 ILE MD 2 46 LYS QD . . 4.890 2.158 1.859 2.511 . 0 0 "[ . 1 . 2]" 1 1684 1 117 ILE MD 2 46 LYS HE2 . . 5.500 4.050 2.601 4.688 . 0 0 "[ . 1 . 2]" 1 1685 1 117 ILE MD 2 46 LYS HE3 . . 5.500 4.004 2.601 4.891 . 0 0 "[ . 1 . 2]" 1 1686 1 117 ILE MD 2 46 LYS QG . . 5.340 2.437 1.829 3.488 . 0 0 "[ . 1 . 2]" 1 1687 1 117 ILE MG 1 118 ASN HA . . 4.210 4.073 3.660 4.316 0.106 1 0 "[ . 1 . 2]" 1 1688 1 117 ILE MG 2 46 LYS QB . . 5.340 4.893 3.967 5.390 0.050 9 0 "[ . 1 . 2]" 1 1689 1 117 ILE MG 2 49 ALA MB . . 4.780 3.854 3.282 4.098 . 0 0 "[ . 1 . 2]" 1 1690 1 117 ILE MG 2 61 LYS H . . 5.500 3.586 2.757 4.800 . 0 0 "[ . 1 . 2]" 1 1691 1 117 ILE MG 2 61 LYS QB . . 5.260 2.802 1.991 3.720 . 0 0 "[ . 1 . 2]" 1 1692 1 117 ILE MG 2 61 LYS QD . . 5.340 3.271 1.975 5.035 . 0 0 "[ . 1 . 2]" 1 1693 1 118 ASN H 1 118 ASN QB . . 2.980 2.375 2.099 2.932 . 0 0 "[ . 1 . 2]" 1 1694 1 118 ASN H 1 119 GLN H . . 3.230 2.266 2.077 2.524 . 0 0 "[ . 1 . 2]" 1 1695 1 118 ASN H 1 119 GLN QB . . 5.000 4.239 3.922 4.579 . 0 0 "[ . 1 . 2]" 1 1696 1 118 ASN H 1 119 GLN HG2 . . 5.380 4.169 2.725 5.042 . 0 0 "[ . 1 . 2]" 1 1697 1 118 ASN H 1 119 GLN QG . . 4.540 3.182 2.599 3.840 . 0 0 "[ . 1 . 2]" 1 1698 1 118 ASN H 1 119 GLN HG3 . . 5.380 3.644 2.641 5.404 0.024 6 0 "[ . 1 . 2]" 1 1699 1 118 ASN H 1 120 ALA H . . 5.160 4.714 4.390 4.984 . 0 0 "[ . 1 . 2]" 1 1700 1 118 ASN H 2 60 TRP QB . . 5.130 4.347 3.981 4.818 . 0 0 "[ . 1 . 2]" 1 1701 1 118 ASN H 2 61 LYS H . . 5.500 4.799 4.514 5.108 . 0 0 "[ . 1 . 2]" 1 1702 1 118 ASN HA 1 119 GLN HA . . 4.830 4.693 4.537 4.884 0.054 5 0 "[ . 1 . 2]" 1 1703 1 118 ASN HA 1 119 GLN QB . . 5.340 5.325 5.011 5.445 0.105 8 0 "[ . 1 . 2]" 1 1704 1 118 ASN HA 1 119 GLN HG2 . . 5.500 5.435 4.566 5.714 0.214 19 0 "[ . 1 . 2]" 1 1705 1 118 ASN HA 1 119 GLN HG3 . . 5.500 5.138 4.769 5.630 0.130 8 0 "[ . 1 . 2]" 1 1706 1 118 ASN HA 1 120 ALA H . . 4.140 3.556 3.170 3.772 . 0 0 "[ . 1 . 2]" 1 1707 1 118 ASN QB 1 119 GLN H . . 4.310 3.357 2.899 4.013 . 0 0 "[ . 1 . 2]" 1 1708 1 118 ASN QB 2 61 LYS H . . 4.750 3.510 1.788 4.737 . 0 0 "[ . 1 . 2]" 1 1709 1 118 ASN HB2 2 61 LYS H . . 5.470 3.799 1.970 5.624 0.154 9 0 "[ . 1 . 2]" 1 1710 1 118 ASN HB3 2 61 LYS H . . 5.470 4.566 2.050 5.509 0.039 17 0 "[ . 1 . 2]" 1 1711 1 119 GLN H 1 119 GLN QG . . 2.930 2.139 1.757 2.566 . 0 0 "[ . 1 . 2]" 1 1712 1 119 GLN H 1 120 ALA H . . 3.060 2.979 2.771 3.236 0.176 20 0 "[ . 1 . 2]" 1 1713 1 119 GLN H 2 60 TRP HA . . 5.500 5.720 5.214 6.032 0.532 4 1 "[ +. 1 . 2]" 1 1714 1 119 GLN H 2 60 TRP QB . . 5.290 4.379 4.105 5.002 . 0 0 "[ . 1 . 2]" 1 1715 1 119 GLN H 2 61 LYS H . . 5.500 5.803 5.271 6.301 0.801 18 4 "[ - * 1 * . + 2]" 1 1716 1 119 GLN HA 1 119 GLN QG . . 3.680 2.629 2.196 3.329 . 0 0 "[ . 1 . 2]" 1 1717 1 119 GLN QB 1 119 GLN QG . . 2.350 2.081 2.065 2.090 . 0 0 "[ . 1 . 2]" 1 1718 1 119 GLN QB 1 123 ALA H . . 5.340 4.936 4.014 5.334 . 0 0 "[ . 1 . 2]" 1 1719 1 120 ALA H 1 120 ALA MB . . 2.400 2.293 2.234 2.373 . 0 0 "[ . 1 . 2]" 1 1720 1 120 ALA H 1 121 LYS H . . 3.860 2.648 2.341 2.958 . 0 0 "[ . 1 . 2]" 1 1721 1 120 ALA H 1 122 LEU H . . 5.500 3.358 2.900 3.985 . 0 0 "[ . 1 . 2]" 1 1722 1 120 ALA H 1 123 ALA H . . 5.500 4.694 4.079 5.173 . 0 0 "[ . 1 . 2]" 1 1723 1 120 ALA H 2 60 TRP HD1 . . 5.500 4.789 4.503 5.194 . 0 0 "[ . 1 . 2]" 1 1724 1 120 ALA H 2 61 LYS H . . 5.500 5.826 5.243 6.312 0.812 18 4 "[ *- *1 . + 2]" 1 1725 1 120 ALA MB 1 121 LYS H . . 4.140 2.284 1.995 3.216 . 0 0 "[ . 1 . 2]" 1 1726 1 120 ALA MB 2 60 TRP HB2 . . 5.500 4.785 4.323 5.306 . 0 0 "[ . 1 . 2]" 1 1727 1 120 ALA MB 2 60 TRP HB3 . . 5.500 3.335 2.787 3.914 . 0 0 "[ . 1 . 2]" 1 1728 1 121 LYS H 1 121 LYS QE . . 5.340 4.967 4.375 5.890 0.550 17 1 "[ . 1 . + 2]" 1 1729 1 121 LYS H 1 122 LEU H . . 3.820 2.309 1.734 2.552 . 0 0 "[ . 1 . 2]" 1 1730 1 121 LYS H 1 122 LEU QB . . 5.340 4.430 3.652 4.733 . 0 0 "[ . 1 . 2]" 1 1731 1 121 LYS H 1 123 ALA H . . 4.840 3.986 3.178 4.343 . 0 0 "[ . 1 . 2]" 1 1732 1 121 LYS H 2 60 TRP HE1 . . 5.500 4.821 4.312 5.196 . 0 0 "[ . 1 . 2]" 1 1733 1 121 LYS HA 1 121 LYS QE . . 3.990 3.265 2.719 4.077 0.087 17 0 "[ . 1 . 2]" 1 1734 1 121 LYS HA 1 121 LYS QG . . 3.570 2.826 2.356 3.119 . 0 0 "[ . 1 . 2]" 1 1735 1 121 LYS HA 1 122 LEU QD . . 5.440 4.499 4.183 5.186 . 0 0 "[ . 1 . 2]" 1 1736 1 121 LYS HA 1 123 ALA H . . 3.460 3.450 3.268 3.577 0.117 6 0 "[ . 1 . 2]" 1 1737 1 121 LYS HA 2 60 TRP HD1 . . 5.500 4.534 4.210 4.662 . 0 0 "[ . 1 . 2]" 1 1738 1 121 LYS HA 2 60 TRP HE1 . . 5.500 5.425 5.016 5.592 0.092 11 0 "[ . 1 . 2]" 1 1739 1 121 LYS QB 2 24 ALA HA . . 5.340 5.165 4.735 5.452 0.112 20 0 "[ . 1 . 2]" 1 1740 1 121 LYS QB 2 60 TRP HE1 . . 2.830 2.549 2.157 2.808 . 0 0 "[ . 1 . 2]" 1 1741 1 121 LYS HB2 2 60 TRP HD1 . . 5.500 2.053 1.722 3.108 . 0 0 "[ . 1 . 2]" 1 1742 1 121 LYS HB3 2 60 TRP HD1 . . 5.500 3.014 1.696 3.761 . 0 0 "[ . 1 . 2]" 1 1743 1 121 LYS QD 1 121 LYS QG . . 2.250 2.028 1.996 2.091 . 0 0 "[ . 1 . 2]" 1 1744 1 121 LYS QD 2 24 ALA HA . . 5.340 5.142 4.748 5.367 0.027 4 0 "[ . 1 . 2]" 1 1745 1 121 LYS QE 1 123 ALA H . . 5.340 5.972 5.504 7.051 1.711 20 9 "[ ** .* 1- **** +]" 1 1746 1 121 LYS QE 2 24 ALA H . . 5.340 5.068 4.459 5.412 0.072 11 0 "[ . 1 . 2]" 1 1747 1 121 LYS QE 2 60 TRP HD1 . . 5.340 4.734 3.803 5.256 . 0 0 "[ . 1 . 2]" 1 1748 1 121 LYS QE 2 60 TRP HE1 . . 5.340 4.616 3.000 5.446 0.106 3 0 "[ . 1 . 2]" 1 1749 1 121 LYS QG 2 24 ALA H . . 5.340 5.190 4.742 5.473 0.133 6 0 "[ . 1 . 2]" 1 1750 1 121 LYS QG 2 77 LEU MD2 . . 4.650 2.483 2.034 3.109 . 0 0 "[ . 1 . 2]" 1 1751 1 121 LYS HG2 2 24 ALA HA . . 5.500 5.188 3.902 5.638 0.138 13 0 "[ . 1 . 2]" 1 1752 1 121 LYS HG2 2 77 LEU MD2 . . 5.500 3.633 2.105 4.497 . 0 0 "[ . 1 . 2]" 1 1753 1 121 LYS HG3 2 24 ALA HA . . 5.500 4.311 3.791 5.564 0.064 16 0 "[ . 1 . 2]" 1 1754 1 121 LYS HG3 2 77 LEU MD2 . . 5.500 2.647 2.195 3.169 . 0 0 "[ . 1 . 2]" 1 1755 1 122 LEU H 1 122 LEU HG . . 4.920 3.546 2.645 4.628 . 0 0 "[ . 1 . 2]" 1 1756 1 122 LEU H 1 123 ALA H . . 2.920 2.603 2.264 2.963 0.043 3 0 "[ . 1 . 2]" 1 1757 1 122 LEU H 2 60 TRP HE1 . . 5.500 4.740 3.947 5.185 . 0 0 "[ . 1 . 2]" 1 1758 1 122 LEU HA 2 60 TRP HE1 . . 5.160 5.178 4.453 5.469 0.309 20 0 "[ . 1 . 2]" 1 1759 1 122 LEU QB 1 123 ALA H . . 4.000 3.611 3.400 3.808 . 0 0 "[ . 1 . 2]" 1 1760 1 122 LEU HB2 1 123 ALA H . . 4.740 3.912 3.581 4.248 . 0 0 "[ . 1 . 2]" 1 1761 1 122 LEU HB2 2 63 TRP HZ2 . . 5.500 5.526 5.112 5.663 0.163 9 0 "[ . 1 . 2]" 1 1762 1 122 LEU HB3 1 123 ALA H . . 4.740 4.270 3.818 4.429 . 0 0 "[ . 1 . 2]" 1 1763 1 122 LEU HB3 2 63 TRP HZ2 . . 5.500 5.320 4.522 5.582 0.082 15 0 "[ . 1 . 2]" 1 1764 1 122 LEU QD 2 59 LEU QB . . 5.280 4.736 4.422 5.266 . 0 0 "[ . 1 . 2]" 1 1765 1 122 LEU QD 2 60 TRP HE1 . . 4.640 2.750 2.461 3.067 . 0 0 "[ . 1 . 2]" 1 1766 1 122 LEU QD 2 60 TRP HZ3 . . 3.840 3.747 3.311 4.040 0.200 5 0 "[ . 1 . 2]" 1 1767 1 122 LEU QD 2 63 TRP HZ2 . . 5.010 3.350 2.410 4.564 . 0 0 "[ . 1 . 2]" 1 1768 1 122 LEU QD 2 77 LEU H . . 5.440 4.695 4.557 5.085 . 0 0 "[ . 1 . 2]" 1 1769 1 122 LEU QD 2 77 LEU HB2 . . 5.440 4.414 4.351 4.493 . 0 0 "[ . 1 . 2]" 1 1770 1 122 LEU QD 2 77 LEU MD2 . . 4.730 3.552 3.018 3.963 . 0 0 "[ . 1 . 2]" 1 1771 1 122 LEU MD1 2 77 LEU MD2 . . 5.500 4.884 4.304 5.546 0.046 5 0 "[ . 1 . 2]" 1 1772 1 122 LEU MD2 2 77 LEU MD2 . . 5.500 3.686 3.082 4.522 . 0 0 "[ . 1 . 2]" 1 1773 1 122 LEU HG 2 60 TRP HZ3 . . 5.470 5.361 3.688 5.521 0.051 7 0 "[ . 1 . 2]" 1 1774 1 122 LEU HG 2 63 TRP HE1 . . 5.500 4.463 2.876 5.484 . 0 0 "[ . 1 . 2]" 1 1775 2 23 MET HA 2 23 MET QG . . 3.630 2.769 2.291 3.113 . 0 0 "[ . 1 . 2]" 1 1776 2 23 MET HA 2 24 ALA H . . 3.500 3.219 3.014 3.402 . 0 0 "[ . 1 . 2]" 1 1777 2 23 MET HA 2 24 ALA HA . . 5.500 5.082 4.865 5.242 . 0 0 "[ . 1 . 2]" 1 1778 2 23 MET HA 2 24 ALA MB . . 4.550 3.912 3.713 4.036 . 0 0 "[ . 1 . 2]" 1 1779 2 23 MET QB 2 24 ALA H . . 4.350 3.248 2.885 3.572 . 0 0 "[ . 1 . 2]" 1 1780 2 23 MET QB 2 24 ALA HA . . 5.340 4.881 4.628 5.230 . 0 0 "[ . 1 . 2]" 1 1781 2 23 MET QB 2 24 ALA MB . . 4.450 4.479 4.128 4.540 0.090 14 0 "[ . 1 . 2]" 1 1782 2 23 MET QB 2 80 ASP HA . . 4.090 2.725 2.030 3.466 . 0 0 "[ . 1 . 2]" 1 1783 2 23 MET QG 2 80 ASP QB . . 4.760 4.539 2.832 5.711 0.951 19 4 "[ . *1 *- . +2]" 1 1784 2 23 MET QG 2 81 GLU H . . 5.340 5.102 3.734 6.956 1.616 20 5 "[ * **1 .- +]" 1 1785 2 23 MET QG 2 81 GLU QG . . 4.760 4.459 3.030 6.301 1.541 20 5 "[ * *-1 .* +]" 1 1786 2 23 MET HG2 2 24 ALA H . . 5.500 5.166 4.410 5.623 0.123 9 0 "[ . 1 . 2]" 1 1787 2 23 MET HG3 2 24 ALA H . . 5.500 4.807 4.132 5.645 0.145 16 0 "[ . 1 . 2]" 1 1788 2 24 ALA H 2 24 ALA HA . . 2.910 2.244 2.212 2.273 . 0 0 "[ . 1 . 2]" 1 1789 2 24 ALA H 2 24 ALA MB . . 3.010 2.890 2.837 2.929 . 0 0 "[ . 1 . 2]" 1 1790 2 24 ALA H 2 25 THR HB . . 5.500 4.949 4.784 5.155 . 0 0 "[ . 1 . 2]" 1 1791 2 24 ALA H 2 58 PHE HB2 . . 5.500 5.443 5.182 5.756 0.256 12 0 "[ . 1 . 2]" 1 1792 2 24 ALA H 2 58 PHE HB3 . . 5.500 5.466 4.406 5.602 0.102 3 0 "[ . 1 . 2]" 1 1793 2 24 ALA H 2 59 LEU QD . . 4.560 1.893 1.707 2.092 . 0 0 "[ . 1 . 2]" 1 1794 2 24 ALA H 2 77 LEU HG . . 5.320 4.979 4.591 5.275 . 0 0 "[ . 1 . 2]" 1 1795 2 24 ALA H 2 79 THR HA . . 4.420 3.417 3.070 3.707 . 0 0 "[ . 1 . 2]" 1 1796 2 24 ALA H 2 80 ASP H . . 5.500 5.463 5.208 5.611 0.111 10 0 "[ . 1 . 2]" 1 1797 2 24 ALA H 2 80 ASP HA . . 5.500 5.248 4.673 5.497 . 0 0 "[ . 1 . 2]" 1 1798 2 24 ALA HA 2 25 THR H . . 2.860 2.786 2.500 2.894 0.034 7 0 "[ . 1 . 2]" 1 1799 2 24 ALA HA 2 25 THR HA . . 5.500 4.682 4.514 4.761 . 0 0 "[ . 1 . 2]" 1 1800 2 24 ALA HA 2 59 LEU HA . . 5.500 5.560 5.497 5.610 0.110 18 0 "[ . 1 . 2]" 1 1801 2 24 ALA HA 2 59 LEU QB . . 4.530 3.521 3.363 3.667 . 0 0 "[ . 1 . 2]" 1 1802 2 24 ALA HA 2 59 LEU MD1 . . 3.780 3.179 3.011 3.342 . 0 0 "[ . 1 . 2]" 1 1803 2 24 ALA HA 2 59 LEU MD2 . . 3.780 2.396 2.198 2.593 . 0 0 "[ . 1 . 2]" 1 1804 2 24 ALA HA 2 59 LEU HG . . 3.130 1.896 1.812 1.943 . 0 0 "[ . 1 . 2]" 1 1805 2 24 ALA HA 2 77 LEU HA . . 5.500 4.546 4.330 4.861 . 0 0 "[ . 1 . 2]" 1 1806 2 24 ALA HA 2 77 LEU MD2 . . 3.990 2.198 1.984 2.486 . 0 0 "[ . 1 . 2]" 1 1807 2 24 ALA HA 2 77 LEU HG . . 4.160 2.950 2.628 3.220 . 0 0 "[ . 1 . 2]" 1 1808 2 24 ALA HA 2 78 PHE H . . 5.160 4.393 4.166 4.556 . 0 0 "[ . 1 . 2]" 1 1809 2 24 ALA HA 2 79 THR HA . . 5.500 4.911 4.383 5.268 . 0 0 "[ . 1 . 2]" 1 1810 2 24 ALA MB 2 25 THR H . . 4.220 3.658 3.616 3.709 . 0 0 "[ . 1 . 2]" 1 1811 2 24 ALA MB 2 25 THR HA . . 4.840 4.333 4.296 4.395 . 0 0 "[ . 1 . 2]" 1 1812 2 24 ALA MB 2 77 LEU HB2 . . 5.500 4.744 4.539 4.844 . 0 0 "[ . 1 . 2]" 1 1813 2 24 ALA MB 2 77 LEU HB3 . . 4.780 3.926 3.692 4.090 . 0 0 "[ . 1 . 2]" 1 1814 2 24 ALA MB 2 77 LEU MD2 . . 2.690 1.984 1.927 2.081 . 0 0 "[ . 1 . 2]" 1 1815 2 24 ALA MB 2 77 LEU HG . . 4.430 3.248 3.082 3.449 . 0 0 "[ . 1 . 2]" 1 1816 2 25 THR H 2 25 THR HB . . 3.390 2.510 2.366 2.613 . 0 0 "[ . 1 . 2]" 1 1817 2 25 THR H 2 25 THR MG . . 3.970 3.689 3.636 3.731 . 0 0 "[ . 1 . 2]" 1 1818 2 25 THR H 2 26 LEU H . . 5.500 4.566 4.510 4.612 . 0 0 "[ . 1 . 2]" 1 1819 2 25 THR H 2 59 LEU MD1 . . 4.840 4.754 4.600 4.873 0.033 7 0 "[ . 1 . 2]" 1 1820 2 25 THR H 2 59 LEU QD . . 4.200 2.997 2.799 3.120 . 0 0 "[ . 1 . 2]" 1 1821 2 25 THR H 2 59 LEU MD2 . . 4.840 3.030 2.820 3.158 . 0 0 "[ . 1 . 2]" 1 1822 2 25 THR H 2 59 LEU HG . . 4.700 4.315 4.074 4.477 . 0 0 "[ . 1 . 2]" 1 1823 2 25 THR H 2 77 LEU MD2 . . 5.140 4.350 3.959 4.543 . 0 0 "[ . 1 . 2]" 1 1824 2 25 THR H 2 77 LEU HG . . 3.940 3.866 3.604 3.978 0.038 14 0 "[ . 1 . 2]" 1 1825 2 25 THR H 2 78 PHE H . . 5.490 3.502 3.129 3.804 . 0 0 "[ . 1 . 2]" 1 1826 2 25 THR H 2 79 THR H . . 5.500 5.259 4.945 5.503 0.003 18 0 "[ . 1 . 2]" 1 1827 2 25 THR H 2 79 THR HA . . 5.500 4.302 3.909 4.712 . 0 0 "[ . 1 . 2]" 1 1828 2 25 THR H 2 80 ASP H . . 5.500 4.379 4.152 4.541 . 0 0 "[ . 1 . 2]" 1 1829 2 25 THR H 2 81 GLU QG . . 5.340 5.376 4.876 5.524 0.184 11 0 "[ . 1 . 2]" 1 1830 2 25 THR HA 2 25 THR MG . . 2.980 2.318 2.240 2.390 . 0 0 "[ . 1 . 2]" 1 1831 2 25 THR HA 2 26 LEU H . . 3.230 2.251 2.171 2.333 . 0 0 "[ . 1 . 2]" 1 1832 2 25 THR HA 2 26 LEU QB . . 5.220 4.053 3.983 4.130 . 0 0 "[ . 1 . 2]" 1 1833 2 25 THR HA 2 77 LEU MD1 . . 5.500 4.938 4.620 5.107 . 0 0 "[ . 1 . 2]" 1 1834 2 25 THR HA 2 77 LEU HG . . 5.150 4.186 4.065 4.306 . 0 0 "[ . 1 . 2]" 1 1835 2 25 THR HA 2 80 ASP HA . . 5.500 5.144 4.661 5.611 0.111 12 0 "[ . 1 . 2]" 1 1836 2 25 THR HB 2 26 LEU H . . 4.630 3.973 3.793 4.111 . 0 0 "[ . 1 . 2]" 1 1837 2 25 THR HB 2 59 LEU QD . . 5.440 4.229 4.048 4.339 . 0 0 "[ . 1 . 2]" 1 1838 2 25 THR HB 2 78 PHE H . . 4.710 2.996 2.758 3.235 . 0 0 "[ . 1 . 2]" 1 1839 2 25 THR HB 2 78 PHE QB . . 3.650 2.719 2.591 2.887 . 0 0 "[ . 1 . 2]" 1 1840 2 25 THR HB 2 78 PHE HD2 . . 5.500 4.494 4.258 4.716 . 0 0 "[ . 1 . 2]" 1 1841 2 25 THR HB 2 80 ASP HA . . 4.490 3.356 2.730 3.967 . 0 0 "[ . 1 . 2]" 1 1842 2 25 THR HB 2 81 GLU H . . 5.400 4.441 4.079 4.830 . 0 0 "[ . 1 . 2]" 1 1843 2 25 THR HB 2 81 GLU HA . . 5.500 3.998 3.844 4.282 . 0 0 "[ . 1 . 2]" 1 1844 2 25 THR HB 2 81 GLU QB . . 5.340 4.577 4.018 5.368 0.028 5 0 "[ . 1 . 2]" 1 1845 2 25 THR HB 2 81 GLU QG . . 5.340 4.144 3.693 4.490 . 0 0 "[ . 1 . 2]" 1 1846 2 25 THR HB 2 107 VAL MG1 . . 5.500 4.441 4.159 4.663 . 0 0 "[ . 1 . 2]" 1 1847 2 25 THR MG 2 26 LEU H . . 2.740 2.449 2.215 2.622 . 0 0 "[ . 1 . 2]" 1 1848 2 25 THR MG 2 26 LEU HA . . 5.500 3.942 3.789 4.099 . 0 0 "[ . 1 . 2]" 1 1849 2 25 THR MG 2 26 LEU QB . . 5.340 3.957 3.748 4.099 . 0 0 "[ . 1 . 2]" 1 1850 2 25 THR MG 2 77 LEU HA . . 5.500 4.811 4.586 5.013 . 0 0 "[ . 1 . 2]" 1 1851 2 25 THR MG 2 78 PHE H . . 4.980 3.981 3.732 4.183 . 0 0 "[ . 1 . 2]" 1 1852 2 25 THR MG 2 80 ASP H . . 4.990 4.226 3.957 4.422 . 0 0 "[ . 1 . 2]" 1 1853 2 25 THR MG 2 80 ASP HA . . 5.490 3.506 3.078 3.916 . 0 0 "[ . 1 . 2]" 1 1854 2 25 THR MG 2 81 GLU H . . 4.730 3.158 2.929 3.560 . 0 0 "[ . 1 . 2]" 1 1855 2 25 THR MG 2 81 GLU HA . . 5.500 2.226 1.938 2.510 . 0 0 "[ . 1 . 2]" 1 1856 2 25 THR MG 2 81 GLU QB . . 4.570 2.220 1.723 3.061 . 0 0 "[ . 1 . 2]" 1 1857 2 25 THR MG 2 81 GLU HG2 . . 3.560 2.695 1.786 3.455 . 0 0 "[ . 1 . 2]" 1 1858 2 25 THR MG 2 81 GLU HG3 . . 3.560 2.792 2.244 3.652 0.092 11 0 "[ . 1 . 2]" 1 1859 2 25 THR MG 2 107 VAL HA . . 5.180 4.316 4.010 4.628 . 0 0 "[ . 1 . 2]" 1 1860 2 25 THR MG 2 107 VAL HB . . 5.500 4.414 4.027 4.884 . 0 0 "[ . 1 . 2]" 1 1861 2 26 LEU H 2 26 LEU QB . . 2.890 2.311 2.253 2.362 . 0 0 "[ . 1 . 2]" 1 1862 2 26 LEU H 2 27 LEU H . . 4.840 4.359 4.320 4.404 . 0 0 "[ . 1 . 2]" 1 1863 2 26 LEU H 2 27 LEU QB . . 5.480 4.783 4.725 4.883 . 0 0 "[ . 1 . 2]" 1 1864 2 26 LEU H 2 77 LEU MD1 . . 4.350 4.234 3.962 4.382 0.032 19 0 "[ . 1 . 2]" 1 1865 2 26 LEU H 2 78 PHE H . . 5.500 4.747 4.658 4.860 . 0 0 "[ . 1 . 2]" 1 1866 2 26 LEU HA 2 26 LEU MD1 . . 3.940 2.100 2.063 2.138 . 0 0 "[ . 1 . 2]" 1 1867 2 26 LEU HA 2 26 LEU HG . . 3.190 3.094 2.981 3.154 . 0 0 "[ . 1 . 2]" 1 1868 2 26 LEU HA 2 27 LEU HA . . 4.590 4.305 4.275 4.339 . 0 0 "[ . 1 . 2]" 1 1869 2 26 LEU HA 2 27 LEU QB . . 5.500 3.881 3.829 3.965 . 0 0 "[ . 1 . 2]" 1 1870 2 26 LEU HA 2 75 ILE MG . . 5.050 4.068 3.802 4.220 . 0 0 "[ . 1 . 2]" 1 1871 2 26 LEU HA 2 77 LEU HA . . 5.500 2.396 2.237 2.843 . 0 0 "[ . 1 . 2]" 1 1872 2 26 LEU HA 2 77 LEU MD1 . . 3.250 2.389 2.151 2.535 . 0 0 "[ . 1 . 2]" 1 1873 2 26 LEU HA 2 77 LEU HG . . 3.680 3.241 3.019 3.458 . 0 0 "[ . 1 . 2]" 1 1874 2 26 LEU HA 2 78 PHE H . . 5.500 3.518 3.286 3.907 . 0 0 "[ . 1 . 2]" 1 1875 2 26 LEU QB 2 108 PHE H . . 5.340 4.673 3.403 5.173 . 0 0 "[ . 1 . 2]" 1 1876 2 26 LEU HB2 2 26 LEU MD1 . . 3.330 2.338 2.296 2.361 . 0 0 "[ . 1 . 2]" 1 1877 2 26 LEU HB3 2 26 LEU MD1 . . 3.330 3.196 3.181 3.204 . 0 0 "[ . 1 . 2]" 1 1878 2 26 LEU MD1 2 27 LEU H . . 2.670 2.457 2.286 2.710 0.040 4 0 "[ . 1 . 2]" 1 1879 2 26 LEU MD1 2 27 LEU HA . . 5.020 4.469 4.375 4.634 . 0 0 "[ . 1 . 2]" 1 1880 2 26 LEU MD1 2 28 GLN HA . . 5.500 5.069 4.877 5.258 . 0 0 "[ . 1 . 2]" 1 1881 2 26 LEU MD1 2 75 ILE HA . . 4.670 4.196 3.906 4.518 . 0 0 "[ . 1 . 2]" 1 1882 2 26 LEU MD1 2 75 ILE HB . . 5.500 3.194 2.906 3.620 . 0 0 "[ . 1 . 2]" 1 1883 2 26 LEU MD1 2 75 ILE MG . . 2.440 1.856 1.760 1.946 . 0 0 "[ . 1 . 2]" 1 1884 2 26 LEU MD1 2 76 TYR QB . . 5.340 4.294 4.051 4.992 . 0 0 "[ . 1 . 2]" 1 1885 2 26 LEU MD1 2 77 LEU H . . 5.040 3.805 3.517 4.623 . 0 0 "[ . 1 . 2]" 1 1886 2 26 LEU MD1 2 77 LEU HA . . 4.340 3.237 3.010 3.711 . 0 0 "[ . 1 . 2]" 1 1887 2 26 LEU MD1 2 77 LEU HB3 . . 5.500 5.020 4.853 5.481 . 0 0 "[ . 1 . 2]" 1 1888 2 26 LEU MD1 2 77 LEU MD1 . . 2.770 1.887 1.796 2.166 . 0 0 "[ . 1 . 2]" 1 1889 2 26 LEU MD1 2 77 LEU MD2 . . 5.500 4.095 3.871 4.229 . 0 0 "[ . 1 . 2]" 1 1890 2 26 LEU MD2 2 28 GLN HG3 . . 5.500 5.415 4.675 5.769 0.269 16 0 "[ . 1 . 2]" 1 1891 2 26 LEU MD2 2 108 PHE QD . . 5.500 3.891 3.251 4.301 . 0 0 "[ . 1 . 2]" 1 1892 2 26 LEU HG 2 27 LEU H . . 3.830 3.124 3.031 3.277 . 0 0 "[ . 1 . 2]" 1 1893 2 26 LEU HG 2 27 LEU HA . . 3.720 3.778 3.741 3.816 0.096 5 0 "[ . 1 . 2]" 1 1894 2 26 LEU HG 2 27 LEU QB . . 5.460 4.879 4.839 4.935 . 0 0 "[ . 1 . 2]" 1 1895 2 26 LEU HG 2 28 GLN HG3 . . 5.360 4.927 4.458 5.200 . 0 0 "[ . 1 . 2]" 1 1896 2 26 LEU HG 2 75 ILE HB . . 5.500 4.785 4.418 5.109 . 0 0 "[ . 1 . 2]" 1 1897 2 26 LEU HG 2 75 ILE QG . . 5.340 5.196 4.999 5.372 0.032 3 0 "[ . 1 . 2]" 1 1898 2 26 LEU HG 2 75 ILE MG . . 3.020 2.370 2.126 2.605 . 0 0 "[ . 1 . 2]" 1 1899 2 26 LEU HG 2 77 LEU HA . . 5.500 5.244 5.065 5.565 0.065 5 0 "[ . 1 . 2]" 1 1900 2 26 LEU HG 2 107 VAL HA . . 5.500 5.417 4.962 5.609 0.109 10 0 "[ . 1 . 2]" 1 1901 2 26 LEU HG 2 108 PHE QD . . 5.500 4.612 3.930 5.026 . 0 0 "[ . 1 . 2]" 1 1902 2 27 LEU H 2 27 LEU QB . . 3.190 2.531 2.459 2.582 . 0 0 "[ . 1 . 2]" 1 1903 2 27 LEU H 2 27 LEU QD . . 5.050 2.883 2.610 3.526 . 0 0 "[ . 1 . 2]" 1 1904 2 27 LEU H 2 27 LEU HG . . 5.500 3.973 3.863 4.088 . 0 0 "[ . 1 . 2]" 1 1905 2 27 LEU H 2 28 GLN H . . 4.680 4.334 4.283 4.370 . 0 0 "[ . 1 . 2]" 1 1906 2 27 LEU H 2 75 ILE MG . . 5.310 3.246 2.998 3.422 . 0 0 "[ . 1 . 2]" 1 1907 2 27 LEU H 2 77 LEU MD1 . . 5.500 3.702 3.174 3.928 . 0 0 "[ . 1 . 2]" 1 1908 2 27 LEU H 2 78 PHE H . . 5.500 3.899 3.736 4.120 . 0 0 "[ . 1 . 2]" 1 1909 2 27 LEU HA 2 27 LEU QD . . 4.170 3.331 3.024 3.387 . 0 0 "[ . 1 . 2]" 1 1910 2 27 LEU HA 2 28 GLN H . . 3.050 2.138 2.074 2.183 . 0 0 "[ . 1 . 2]" 1 1911 2 27 LEU HA 2 28 GLN HG3 . . 5.170 3.547 3.288 3.924 . 0 0 "[ . 1 . 2]" 1 1912 2 27 LEU HA 2 84 ALA MB . . 5.010 4.557 4.248 4.778 . 0 0 "[ . 1 . 2]" 1 1913 2 27 LEU HA 2 107 VAL H . . 5.490 5.118 4.834 5.246 . 0 0 "[ . 1 . 2]" 1 1914 2 27 LEU HA 2 107 VAL HA . . 5.010 2.511 2.292 2.653 . 0 0 "[ . 1 . 2]" 1 1915 2 27 LEU HA 2 107 VAL MG1 . . 4.010 3.401 2.947 3.583 . 0 0 "[ . 1 . 2]" 1 1916 2 27 LEU HA 2 107 VAL MG2 . . 5.470 3.217 2.909 3.481 . 0 0 "[ . 1 . 2]" 1 1917 2 27 LEU HA 2 108 PHE H . . 5.140 3.532 3.043 3.787 . 0 0 "[ . 1 . 2]" 1 1918 2 27 LEU QB 2 27 LEU QD . . 2.700 1.867 1.840 1.882 . 0 0 "[ . 1 . 2]" 1 1919 2 27 LEU QB 2 28 GLN H . . 5.140 3.109 2.980 3.467 . 0 0 "[ . 1 . 2]" 1 1920 2 27 LEU QB 2 75 ILE MG . . 5.500 4.568 4.355 4.721 . 0 0 "[ . 1 . 2]" 1 1921 2 27 LEU QB 2 78 PHE HB2 . . 5.500 2.578 2.132 2.918 . 0 0 "[ . 1 . 2]" 1 1922 2 27 LEU QB 2 78 PHE QB . . 4.460 2.508 2.104 2.780 . 0 0 "[ . 1 . 2]" 1 1923 2 27 LEU QB 2 78 PHE HB3 . . 5.500 3.457 3.229 3.576 . 0 0 "[ . 1 . 2]" 1 1924 2 27 LEU QB 2 78 PHE HD2 . . 5.500 4.971 4.579 5.252 . 0 0 "[ . 1 . 2]" 1 1925 2 27 LEU QB 2 81 GLU HA . . 5.020 4.263 4.100 4.368 . 0 0 "[ . 1 . 2]" 1 1926 2 27 LEU QB 2 84 ALA HA . . 5.500 4.675 4.370 4.877 . 0 0 "[ . 1 . 2]" 1 1927 2 27 LEU QB 2 84 ALA MB . . 3.090 2.606 2.313 2.778 . 0 0 "[ . 1 . 2]" 1 1928 2 27 LEU QB 2 106 LYS H . . 5.500 4.615 4.383 4.894 . 0 0 "[ . 1 . 2]" 1 1929 2 27 LEU QB 2 107 VAL HA . . 4.910 3.195 2.948 3.475 . 0 0 "[ . 1 . 2]" 1 1930 2 27 LEU QB 2 107 VAL HB . . 5.500 4.851 4.641 5.347 . 0 0 "[ . 1 . 2]" 1 1931 2 27 LEU QB 2 107 VAL MG2 . . 2.800 2.136 1.892 2.721 . 0 0 "[ . 1 . 2]" 1 1932 2 27 LEU QD 2 28 GLN H . . 4.470 3.326 3.109 3.414 . 0 0 "[ . 1 . 2]" 1 1933 2 27 LEU QD 2 28 GLN HB2 . . 5.500 4.349 4.247 4.506 . 0 0 "[ . 1 . 2]" 1 1934 2 27 LEU QD 2 29 LEU H . . 5.160 3.917 3.771 4.105 . 0 0 "[ . 1 . 2]" 1 1935 2 27 LEU QD 2 29 LEU QB . . 4.930 2.032 1.909 2.197 . 0 0 "[ . 1 . 2]" 1 1936 2 27 LEU QD 2 29 LEU QD . . 5.440 2.033 1.840 2.323 . 0 0 "[ . 1 . 2]" 1 1937 2 27 LEU QD 2 29 LEU HG . . 5.500 3.154 2.687 3.679 . 0 0 "[ . 1 . 2]" 1 1938 2 27 LEU QD 2 78 PHE H . . 5.360 3.748 3.570 3.999 . 0 0 "[ . 1 . 2]" 1 1939 2 27 LEU QD 2 78 PHE HA . . 5.500 3.869 3.702 4.062 . 0 0 "[ . 1 . 2]" 1 1940 2 27 LEU QD 2 78 PHE QB . . 4.440 2.017 1.822 2.221 . 0 0 "[ . 1 . 2]" 1 1941 2 27 LEU QD 2 78 PHE HD2 . . 5.270 4.067 3.737 4.266 . 0 0 "[ . 1 . 2]" 1 1942 2 27 LEU QD 2 81 GLU HA . . 5.500 4.530 4.265 4.756 . 0 0 "[ . 1 . 2]" 1 1943 2 27 LEU QD 2 84 ALA HA . . 5.370 2.916 2.634 3.090 . 0 0 "[ . 1 . 2]" 1 1944 2 27 LEU QD 2 84 ALA MB . . 2.420 1.691 1.652 1.726 . 0 0 "[ . 1 . 2]" 1 1945 2 27 LEU QD 2 85 LEU HA . . 5.500 3.916 3.461 4.247 . 0 0 "[ . 1 . 2]" 1 1946 2 27 LEU QD 2 91 HIS HD2 . . 5.500 5.163 4.521 6.490 0.990 19 2 "[ -. 1 . +2]" 1 1947 2 27 LEU HG 2 28 GLN HA . . 5.500 3.619 3.474 3.682 . 0 0 "[ . 1 . 2]" 1 1948 2 27 LEU HG 2 28 GLN HG3 . . 5.500 4.859 4.604 5.272 . 0 0 "[ . 1 . 2]" 1 1949 2 27 LEU HG 2 29 LEU QB . . 4.120 2.512 2.338 2.678 . 0 0 "[ . 1 . 2]" 1 1950 2 27 LEU HG 2 29 LEU QD . . 5.440 3.588 3.391 3.807 . 0 0 "[ . 1 . 2]" 1 1951 2 27 LEU HG 2 78 PHE QB . . 5.230 4.597 4.361 4.842 . 0 0 "[ . 1 . 2]" 1 1952 2 27 LEU HG 2 84 ALA MB . . 5.500 4.115 3.947 4.200 . 0 0 "[ . 1 . 2]" 1 1953 2 28 GLN H 2 28 GLN HG3 . . 3.300 2.202 1.969 2.578 . 0 0 "[ . 1 . 2]" 1 1954 2 28 GLN H 2 29 LEU H . . 4.500 4.426 4.363 4.464 . 0 0 "[ . 1 . 2]" 1 1955 2 28 GLN H 2 75 ILE MD . . 4.910 4.142 3.939 4.643 . 0 0 "[ . 1 . 2]" 1 1956 2 28 GLN H 2 75 ILE MG . . 5.500 3.562 3.408 3.700 . 0 0 "[ . 1 . 2]" 1 1957 2 28 GLN H 2 105 ALA HA . . 5.500 4.267 3.924 4.469 . 0 0 "[ . 1 . 2]" 1 1958 2 28 GLN H 2 106 LYS H . . 3.260 2.931 2.734 3.110 . 0 0 "[ . 1 . 2]" 1 1959 2 28 GLN H 2 106 LYS HB2 . . 5.500 4.169 3.874 4.432 . 0 0 "[ . 1 . 2]" 1 1960 2 28 GLN H 2 106 LYS HB3 . . 5.330 5.152 4.847 5.491 0.161 7 0 "[ . 1 . 2]" 1 1961 2 28 GLN H 2 107 VAL H . . 5.500 4.862 4.697 4.948 . 0 0 "[ . 1 . 2]" 1 1962 2 28 GLN H 2 107 VAL HA . . 4.900 3.219 3.037 3.406 . 0 0 "[ . 1 . 2]" 1 1963 2 28 GLN H 2 107 VAL MG2 . . 4.870 4.066 3.865 4.403 . 0 0 "[ . 1 . 2]" 1 1964 2 28 GLN H 2 108 PHE H . . 5.110 4.148 3.761 4.542 . 0 0 "[ . 1 . 2]" 1 1965 2 28 GLN HA 2 29 LEU H . . 2.910 2.223 2.182 2.256 . 0 0 "[ . 1 . 2]" 1 1966 2 28 GLN HA 2 75 ILE MD . . 3.150 2.215 1.899 3.258 0.108 10 0 "[ . 1 . 2]" 1 1967 2 28 GLN HA 2 75 ILE QG . . 4.440 3.579 1.842 4.006 . 0 0 "[ . 1 . 2]" 1 1968 2 28 GLN HA 2 75 ILE MG . . 3.460 2.323 2.135 2.560 . 0 0 "[ . 1 . 2]" 1 1969 2 28 GLN HB2 2 29 LEU H . . 5.450 4.090 3.863 4.198 . 0 0 "[ . 1 . 2]" 1 1970 2 28 GLN HB2 2 29 LEU HA . . 5.500 4.378 4.101 4.572 . 0 0 "[ . 1 . 2]" 1 1971 2 28 GLN HB2 2 75 ILE MD . . 5.430 3.861 3.591 4.675 . 0 0 "[ . 1 . 2]" 1 1972 2 28 GLN HB2 2 105 ALA H . . 5.500 5.354 4.805 5.712 0.212 14 0 "[ . 1 . 2]" 1 1973 2 28 GLN HB2 2 106 LYS H . . 4.960 1.941 1.676 2.302 . 0 0 "[ . 1 . 2]" 1 1974 2 28 GLN HB2 2 106 LYS HB3 . . 5.500 4.453 4.042 4.777 . 0 0 "[ . 1 . 2]" 1 1975 2 28 GLN HB2 2 107 VAL HA . . 5.500 4.931 4.699 5.231 . 0 0 "[ . 1 . 2]" 1 1976 2 28 GLN HB3 2 29 LEU HA . . 5.500 4.453 4.201 4.637 . 0 0 "[ . 1 . 2]" 1 1977 2 28 GLN HB3 2 75 ILE HA . . 5.500 4.550 4.256 4.813 . 0 0 "[ . 1 . 2]" 1 1978 2 28 GLN HB3 2 75 ILE MD . . 5.080 2.752 2.431 3.621 . 0 0 "[ . 1 . 2]" 1 1979 2 28 GLN HB3 2 75 ILE MG . . 5.500 4.011 3.773 4.281 . 0 0 "[ . 1 . 2]" 1 1980 2 28 GLN HB3 2 106 LYS HB2 . . 5.500 4.188 3.689 4.609 . 0 0 "[ . 1 . 2]" 1 1981 2 28 GLN HG2 2 29 LEU H . . 5.500 4.713 4.540 4.843 . 0 0 "[ . 1 . 2]" 1 1982 2 28 GLN HG2 2 75 ILE HA . . 5.500 4.448 3.901 4.721 . 0 0 "[ . 1 . 2]" 1 1983 2 28 GLN HG2 2 75 ILE MD . . 2.740 1.913 1.713 2.338 . 0 0 "[ . 1 . 2]" 1 1984 2 28 GLN HG2 2 75 ILE QG . . 5.340 3.669 2.418 4.082 . 0 0 "[ . 1 . 2]" 1 1985 2 28 GLN HG2 2 75 ILE MG . . 3.350 2.699 2.017 3.122 . 0 0 "[ . 1 . 2]" 1 1986 2 28 GLN HG3 2 75 ILE MD . . 3.720 3.359 3.143 3.576 . 0 0 "[ . 1 . 2]" 1 1987 2 28 GLN HG3 2 106 LYS H . . 4.810 3.713 3.079 3.998 . 0 0 "[ . 1 . 2]" 1 1988 2 28 GLN HG3 2 107 VAL HA . . 5.360 3.811 3.607 4.324 . 0 0 "[ . 1 . 2]" 1 1989 2 29 LEU H 2 29 LEU QB . . 3.000 2.661 2.582 2.732 . 0 0 "[ . 1 . 2]" 1 1990 2 29 LEU H 2 62 VAL QG . . 5.440 4.428 4.152 4.794 . 0 0 "[ . 1 . 2]" 1 1991 2 29 LEU H 2 74 GLY H . . 4.630 3.904 3.464 4.240 . 0 0 "[ . 1 . 2]" 1 1992 2 29 LEU H 2 75 ILE MD . . 4.620 3.057 2.497 4.701 0.081 13 0 "[ . 1 . 2]" 1 1993 2 29 LEU H 2 76 TYR H . . 5.030 4.143 3.977 4.389 . 0 0 "[ . 1 . 2]" 1 1994 2 29 LEU H 2 105 ALA HA . . 5.270 4.486 4.375 4.563 . 0 0 "[ . 1 . 2]" 1 1995 2 29 LEU HA 2 29 LEU QD . . 3.290 2.528 2.030 3.070 . 0 0 "[ . 1 . 2]" 1 1996 2 29 LEU HA 2 29 LEU HG . . 3.560 3.125 2.435 3.803 0.243 15 0 "[ . 1 . 2]" 1 1997 2 29 LEU HA 2 30 HIS H . . 3.310 2.146 2.095 2.200 . 0 0 "[ . 1 . 2]" 1 1998 2 29 LEU HA 2 104 VAL H . . 5.020 4.553 4.364 4.723 . 0 0 "[ . 1 . 2]" 1 1999 2 29 LEU HA 2 104 VAL HB . . 5.500 4.545 4.177 4.845 . 0 0 "[ . 1 . 2]" 1 2000 2 29 LEU HA 2 104 VAL MG1 . . 5.500 4.876 4.462 5.364 . 0 0 "[ . 1 . 2]" 1 2001 2 29 LEU HA 2 104 VAL MG2 . . 5.500 5.548 5.327 5.657 0.157 20 0 "[ . 1 . 2]" 1 2002 2 29 LEU HA 2 105 ALA HA . . 4.720 2.659 2.388 2.950 . 0 0 "[ . 1 . 2]" 1 2003 2 29 LEU HA 2 105 ALA MB . . 5.500 2.838 2.641 3.232 . 0 0 "[ . 1 . 2]" 1 2004 2 29 LEU HA 2 106 LYS H . . 4.990 4.289 3.993 4.648 . 0 0 "[ . 1 . 2]" 1 2005 2 29 LEU QB 2 30 HIS H . . 4.880 3.898 3.846 3.929 . 0 0 "[ . 1 . 2]" 1 2006 2 29 LEU QB 2 30 HIS HA . . 5.500 4.373 4.308 4.439 . 0 0 "[ . 1 . 2]" 1 2007 2 29 LEU QB 2 62 VAL QG . . 5.440 3.477 3.135 3.951 . 0 0 "[ . 1 . 2]" 1 2008 2 29 LEU QB 2 75 ILE HA . . 5.500 4.002 3.592 4.243 . 0 0 "[ . 1 . 2]" 1 2009 2 29 LEU QB 2 76 TYR QD . . 4.430 3.014 2.608 3.372 . 0 0 "[ . 1 . 2]" 1 2010 2 29 LEU QB 2 105 ALA HA . . 5.500 3.952 3.430 4.365 . 0 0 "[ . 1 . 2]" 1 2011 2 29 LEU QB 2 105 ALA MB . . 4.640 3.371 2.951 3.555 . 0 0 "[ . 1 . 2]" 1 2012 2 29 LEU QD 2 30 HIS H . . 4.610 3.057 2.790 3.400 . 0 0 "[ . 1 . 2]" 1 2013 2 29 LEU QD 2 30 HIS HB2 . . 5.440 4.901 4.774 5.157 . 0 0 "[ . 1 . 2]" 1 2014 2 29 LEU QD 2 30 HIS HB3 . . 5.440 4.435 4.279 4.628 . 0 0 "[ . 1 . 2]" 1 2015 2 29 LEU QD 2 31 PHE H . . 5.140 4.285 4.026 4.502 . 0 0 "[ . 1 . 2]" 1 2016 2 29 LEU QD 2 31 PHE HA . . 5.440 5.420 5.172 5.550 0.110 16 0 "[ . 1 . 2]" 1 2017 2 29 LEU QD 2 31 PHE HB3 . . 4.330 4.513 4.381 4.655 0.325 9 0 "[ . 1 . 2]" 1 2018 2 29 LEU QD 2 31 PHE QD . . 2.800 2.784 2.618 2.891 0.091 20 0 "[ . 1 . 2]" 1 2019 2 29 LEU QD 2 73 GLY HA3 . . 5.440 3.858 3.577 4.214 . 0 0 "[ . 1 . 2]" 1 2020 2 29 LEU QD 2 74 GLY H . . 5.280 4.037 3.802 4.278 . 0 0 "[ . 1 . 2]" 1 2021 2 29 LEU QD 2 76 TYR QE . . 3.920 2.276 1.902 2.718 . 0 0 "[ . 1 . 2]" 1 2022 2 29 LEU QD 2 88 LEU HA . . 3.510 3.117 2.555 3.618 0.108 17 0 "[ . 1 . 2]" 1 2023 2 29 LEU QD 2 103 VAL HA . . 5.440 4.464 4.159 4.891 . 0 0 "[ . 1 . 2]" 1 2024 2 29 LEU QD 2 103 VAL QG . . 3.870 1.865 1.707 2.129 . 0 0 "[ . 1 . 2]" 1 2025 2 29 LEU QD 2 105 ALA HA . . 5.440 3.780 3.077 4.729 . 0 0 "[ . 1 . 2]" 1 2026 2 29 LEU MD1 2 76 TYR QE . . 4.750 2.464 2.050 3.063 . 0 0 "[ . 1 . 2]" 1 2027 2 29 LEU MD2 2 76 TYR QE . . 4.750 3.100 2.007 4.105 . 0 0 "[ . 1 . 2]" 1 2028 2 29 LEU HG 2 30 HIS H . . 5.210 4.486 3.315 5.308 0.098 7 0 "[ . 1 . 2]" 1 2029 2 29 LEU HG 2 30 HIS HA . . 5.500 5.304 4.573 5.724 0.224 13 0 "[ . 1 . 2]" 1 2030 2 29 LEU HG 2 103 VAL QG . . 5.240 2.935 1.770 3.885 . 0 0 "[ . 1 . 2]" 1 2031 2 29 LEU HG 2 105 ALA MB . . 5.500 3.396 2.291 4.401 . 0 0 "[ . 1 . 2]" 1 2032 2 30 HIS H 2 31 PHE H . . 4.420 4.269 4.209 4.336 . 0 0 "[ . 1 . 2]" 1 2033 2 30 HIS H 2 31 PHE HA . . 5.500 4.735 4.637 4.862 . 0 0 "[ . 1 . 2]" 1 2034 2 30 HIS H 2 31 PHE HB3 . . 5.500 4.913 4.715 5.116 . 0 0 "[ . 1 . 2]" 1 2035 2 30 HIS H 2 73 GLY HA3 . . 5.500 4.798 4.561 5.093 . 0 0 "[ . 1 . 2]" 1 2036 2 30 HIS H 2 103 VAL HA . . 5.480 4.481 4.291 4.654 . 0 0 "[ . 1 . 2]" 1 2037 2 30 HIS H 2 103 VAL QG . . 4.430 2.611 2.372 2.908 . 0 0 "[ . 1 . 2]" 1 2038 2 30 HIS H 2 104 VAL HB . . 5.150 3.086 2.864 3.367 . 0 0 "[ . 1 . 2]" 1 2039 2 30 HIS H 2 104 VAL QG . . 4.900 3.737 3.598 3.851 . 0 0 "[ . 1 . 2]" 1 2040 2 30 HIS H 2 105 ALA H . . 5.500 4.974 4.798 5.066 . 0 0 "[ . 1 . 2]" 1 2041 2 30 HIS H 2 105 ALA HA . . 5.500 3.896 3.779 4.006 . 0 0 "[ . 1 . 2]" 1 2042 2 30 HIS HA 2 30 HIS HD2 . . 4.860 4.726 4.541 4.827 . 0 0 "[ . 1 . 2]" 1 2043 2 30 HIS HA 2 31 PHE H . . 2.450 2.249 2.133 2.372 . 0 0 "[ . 1 . 2]" 1 2044 2 30 HIS HA 2 31 PHE HB3 . . 5.090 4.601 4.510 4.692 . 0 0 "[ . 1 . 2]" 1 2045 2 30 HIS HA 2 31 PHE QD . . 3.230 3.239 3.170 3.306 0.076 4 0 "[ . 1 . 2]" 1 2046 2 30 HIS HA 2 73 GLY H . . 5.500 4.757 4.560 5.108 . 0 0 "[ . 1 . 2]" 1 2047 2 30 HIS HA 2 74 GLY H . . 5.380 3.592 3.135 4.055 . 0 0 "[ . 1 . 2]" 1 2048 2 30 HIS HA 2 103 VAL HA . . 5.460 5.252 5.093 5.381 . 0 0 "[ . 1 . 2]" 1 2049 2 30 HIS HA 2 104 VAL H . . 4.910 4.699 4.591 4.804 . 0 0 "[ . 1 . 2]" 1 2050 2 30 HIS HA 2 104 VAL QG . . 5.440 5.104 4.981 5.256 . 0 0 "[ . 1 . 2]" 1 2051 2 30 HIS HB2 2 30 HIS HD2 . . 3.340 2.549 2.522 2.575 . 0 0 "[ . 1 . 2]" 1 2052 2 30 HIS HB2 2 31 PHE H . . 3.020 2.601 2.352 2.899 . 0 0 "[ . 1 . 2]" 1 2053 2 30 HIS HB2 2 71 GLU QG . . 5.070 2.973 2.589 3.274 . 0 0 "[ . 1 . 2]" 1 2054 2 30 HIS HB2 2 72 ALA H . . 5.500 4.018 3.744 4.261 . 0 0 "[ . 1 . 2]" 1 2055 2 30 HIS HB2 2 73 GLY H . . 5.290 3.958 3.772 4.140 . 0 0 "[ . 1 . 2]" 1 2056 2 30 HIS HB2 2 73 GLY HA3 . . 5.010 2.774 2.642 3.037 . 0 0 "[ . 1 . 2]" 1 2057 2 30 HIS HB2 2 103 VAL QG . . 5.440 4.896 4.522 5.296 . 0 0 "[ . 1 . 2]" 1 2058 2 30 HIS HB2 2 104 VAL QG . . 5.440 4.871 4.628 5.081 . 0 0 "[ . 1 . 2]" 1 2059 2 30 HIS HB3 2 30 HIS HE1 . . 4.970 4.863 4.796 4.909 . 0 0 "[ . 1 . 2]" 1 2060 2 30 HIS HB3 2 31 PHE H . . 4.360 3.849 3.687 3.996 . 0 0 "[ . 1 . 2]" 1 2061 2 30 HIS HB3 2 73 GLY HA3 . . 4.170 2.849 2.550 3.037 . 0 0 "[ . 1 . 2]" 1 2062 2 30 HIS HB3 2 75 ILE HA . . 5.500 5.547 5.341 6.039 0.539 14 1 "[ . 1 +. 2]" 1 2063 2 30 HIS HB3 2 104 VAL QG . . 5.380 5.098 4.983 5.223 . 0 0 "[ . 1 . 2]" 1 2064 2 30 HIS HD2 2 31 PHE HA . . 4.600 4.568 3.995 4.697 0.097 14 0 "[ . 1 . 2]" 1 2065 2 30 HIS HD2 2 71 GLU QB . . 4.310 4.017 3.689 4.213 . 0 0 "[ . 1 . 2]" 1 2066 2 30 HIS HD2 2 71 GLU QG . . 3.640 2.351 1.996 2.910 . 0 0 "[ . 1 . 2]" 1 2067 2 30 HIS HD2 2 73 GLY H . . 5.500 5.693 5.634 5.785 0.285 5 0 "[ . 1 . 2]" 1 2068 2 30 HIS HD2 2 73 GLY HA3 . . 5.500 5.284 5.127 5.567 0.067 9 0 "[ . 1 . 2]" 1 2069 2 30 HIS HD2 2 104 VAL HB . . 5.500 4.733 4.334 5.121 . 0 0 "[ . 1 . 2]" 1 2070 2 30 HIS HE1 2 104 VAL HB . . 3.340 2.722 2.410 3.053 . 0 0 "[ . 1 . 2]" 1 2071 2 30 HIS HE1 2 104 VAL MG1 . . 3.390 2.436 2.268 2.630 . 0 0 "[ . 1 . 2]" 1 2072 2 30 HIS HE1 2 104 VAL QG . . 2.670 2.389 2.240 2.556 . 0 0 "[ . 1 . 2]" 1 2073 2 30 HIS HE1 2 104 VAL MG2 . . 3.390 3.467 3.408 3.535 0.145 9 0 "[ . 1 . 2]" 1 2074 2 31 PHE H 2 31 PHE QD . . 4.610 3.030 2.782 3.291 . 0 0 "[ . 1 . 2]" 1 2075 2 31 PHE H 2 32 ALA MB . . 5.500 5.454 5.361 5.546 0.046 16 0 "[ . 1 . 2]" 1 2076 2 31 PHE H 2 71 GLU QB . . 5.500 5.613 5.368 5.942 0.442 2 0 "[ . 1 . 2]" 1 2077 2 31 PHE H 2 71 GLU QG . . 5.250 3.616 3.343 3.978 . 0 0 "[ . 1 . 2]" 1 2078 2 31 PHE H 2 72 ALA H . . 4.170 3.303 3.120 3.661 . 0 0 "[ . 1 . 2]" 1 2079 2 31 PHE H 2 72 ALA MB . . 4.690 4.143 3.810 4.649 . 0 0 "[ . 1 . 2]" 1 2080 2 31 PHE H 2 73 GLY H . . 5.240 4.743 4.498 4.949 . 0 0 "[ . 1 . 2]" 1 2081 2 31 PHE H 2 73 GLY HA2 . . 4.910 4.740 4.567 4.915 0.005 11 0 "[ . 1 . 2]" 1 2082 2 31 PHE H 2 73 GLY HA3 . . 4.610 3.129 2.914 3.325 . 0 0 "[ . 1 . 2]" 1 2083 2 31 PHE H 2 103 VAL HA . . 5.210 4.740 4.511 5.041 . 0 0 "[ . 1 . 2]" 1 2084 2 31 PHE H 2 103 VAL MG1 . . 5.500 4.955 4.032 5.677 0.177 8 0 "[ . 1 . 2]" 1 2085 2 31 PHE H 2 103 VAL MG2 . . 5.500 4.154 3.145 5.158 . 0 0 "[ . 1 . 2]" 1 2086 2 31 PHE H 2 104 VAL H . . 5.320 4.687 4.523 4.825 . 0 0 "[ . 1 . 2]" 1 2087 2 31 PHE HA 2 104 VAL H . . 5.500 3.228 2.942 3.428 . 0 0 "[ . 1 . 2]" 1 2088 2 31 PHE HB2 2 32 ALA H . . 2.770 2.194 2.025 2.430 . 0 0 "[ . 1 . 2]" 1 2089 2 31 PHE HB2 2 100 VAL QG . . 3.380 3.095 2.746 4.036 0.656 17 2 "[ . 1 . + -2]" 1 2090 2 31 PHE HB2 2 101 GLU H . . 5.500 4.368 4.172 4.610 . 0 0 "[ . 1 . 2]" 1 2091 2 31 PHE HB2 2 102 GLU H . . 5.340 4.516 3.888 4.894 . 0 0 "[ . 1 . 2]" 1 2092 2 31 PHE HB2 2 103 VAL H . . 5.500 5.135 4.852 5.290 . 0 0 "[ . 1 . 2]" 1 2093 2 31 PHE HB2 2 103 VAL HA . . 4.500 3.360 3.128 3.558 . 0 0 "[ . 1 . 2]" 1 2094 2 31 PHE HB2 2 103 VAL QG . . 4.380 3.603 3.275 3.897 . 0 0 "[ . 1 . 2]" 1 2095 2 31 PHE HB3 2 31 PHE QD . . 2.860 2.394 2.362 2.433 . 0 0 "[ . 1 . 2]" 1 2096 2 31 PHE HB3 2 32 ALA H . . 3.610 3.518 3.422 3.648 0.038 4 0 "[ . 1 . 2]" 1 2097 2 31 PHE HB3 2 100 VAL QG . . 4.890 4.372 4.039 5.278 0.388 17 0 "[ . 1 . 2]" 1 2098 2 31 PHE HB3 2 103 VAL H . . 5.160 4.104 3.801 4.310 . 0 0 "[ . 1 . 2]" 1 2099 2 31 PHE HB3 2 103 VAL HA . . 3.740 1.871 1.761 1.943 . 0 0 "[ . 1 . 2]" 1 2100 2 31 PHE HB3 2 103 VAL MG1 . . 4.840 3.437 2.930 3.804 . 0 0 "[ . 1 . 2]" 1 2101 2 31 PHE HB3 2 103 VAL QG . . 3.850 2.373 2.116 2.642 . 0 0 "[ . 1 . 2]" 1 2102 2 31 PHE HB3 2 103 VAL MG2 . . 4.840 2.425 2.171 2.797 . 0 0 "[ . 1 . 2]" 1 2103 2 31 PHE HB3 2 104 VAL H . . 5.040 3.314 2.945 3.487 . 0 0 "[ . 1 . 2]" 1 2104 2 31 PHE HB3 2 104 VAL QG . . 5.440 4.094 3.676 4.476 . 0 0 "[ . 1 . 2]" 1 2105 2 31 PHE QD 2 32 ALA H . . 5.500 3.412 3.198 3.724 . 0 0 "[ . 1 . 2]" 1 2106 2 31 PHE QD 2 73 GLY HA3 . . 5.500 4.577 4.327 4.926 . 0 0 "[ . 1 . 2]" 1 2107 2 31 PHE QD 2 95 LEU QD . . 3.550 2.765 2.618 2.908 . 0 0 "[ . 1 . 2]" 1 2108 2 31 PHE QD 2 103 VAL H . . 5.500 5.157 4.960 5.325 . 0 0 "[ . 1 . 2]" 1 2109 2 31 PHE QD 2 103 VAL HA . . 3.370 3.308 3.040 3.506 0.136 13 0 "[ . 1 . 2]" 1 2110 2 31 PHE QD 2 103 VAL HB . . 4.520 3.632 2.189 4.580 0.060 11 0 "[ . 1 . 2]" 1 2111 2 31 PHE QD 2 103 VAL MG1 . . 3.360 2.814 2.091 3.509 0.149 7 0 "[ . 1 . 2]" 1 2112 2 31 PHE QD 2 103 VAL QG . . 2.740 1.874 1.737 2.000 . 0 0 "[ . 1 . 2]" 1 2113 2 31 PHE QD 2 103 VAL MG2 . . 3.360 1.956 1.741 2.231 . 0 0 "[ . 1 . 2]" 1 2114 2 31 PHE QD 2 104 VAL H . . 4.070 4.162 3.893 4.278 0.208 8 0 "[ . 1 . 2]" 1 2115 2 31 PHE QD 2 104 VAL QG . . 5.440 5.072 4.835 5.254 . 0 0 "[ . 1 . 2]" 1 2116 2 32 ALA H 2 32 ALA HA . . 2.850 2.844 2.796 2.884 0.034 19 0 "[ . 1 . 2]" 1 2117 2 32 ALA H 2 32 ALA MB . . 2.400 2.234 2.204 2.256 . 0 0 "[ . 1 . 2]" 1 2118 2 32 ALA H 2 100 VAL MG1 . . 4.450 2.816 2.510 3.690 . 0 0 "[ . 1 . 2]" 1 2119 2 32 ALA H 2 100 VAL MG2 . . 4.450 3.973 3.545 4.353 . 0 0 "[ . 1 . 2]" 1 2120 2 32 ALA H 2 101 GLU H . . 5.010 4.345 4.067 4.652 . 0 0 "[ . 1 . 2]" 1 2121 2 32 ALA H 2 101 GLU HB2 . . 5.030 4.582 3.647 5.229 0.199 13 0 "[ . 1 . 2]" 1 2122 2 32 ALA H 2 102 GLU H . . 5.500 4.693 4.069 4.920 . 0 0 "[ . 1 . 2]" 1 2123 2 32 ALA H 2 103 VAL HA . . 5.200 4.731 4.334 5.055 . 0 0 "[ . 1 . 2]" 1 2124 2 32 ALA HA 2 33 PHE H . . 2.400 2.259 2.165 2.361 . 0 0 "[ . 1 . 2]" 1 2125 2 32 ALA HA 2 71 GLU H . . 5.500 4.752 4.587 4.928 . 0 0 "[ . 1 . 2]" 1 2126 2 32 ALA HA 2 71 GLU HA . . 5.500 2.017 1.823 2.211 . 0 0 "[ . 1 . 2]" 1 2127 2 32 ALA MB 2 33 PHE H . . 3.640 2.594 2.408 2.815 . 0 0 "[ . 1 . 2]" 1 2128 2 32 ALA MB 2 33 PHE QD . . 5.500 5.509 5.425 5.590 0.090 4 0 "[ . 1 . 2]" 1 2129 2 32 ALA MB 2 35 GLY H . . 5.470 4.984 4.558 5.461 . 0 0 "[ . 1 . 2]" 1 2130 2 32 ALA MB 2 70 HIS HB2 . . 5.430 4.758 4.362 5.098 . 0 0 "[ . 1 . 2]" 1 2131 2 32 ALA MB 2 70 HIS HB3 . . 5.500 4.111 3.622 4.523 . 0 0 "[ . 1 . 2]" 1 2132 2 32 ALA MB 2 71 GLU H . . 5.500 5.407 5.177 5.570 0.070 20 0 "[ . 1 . 2]" 1 2133 2 32 ALA MB 2 71 GLU HA . . 3.770 3.529 3.353 3.778 0.008 15 0 "[ . 1 . 2]" 1 2134 2 32 ALA MB 2 101 GLU H . . 4.930 3.863 3.523 4.139 . 0 0 "[ . 1 . 2]" 1 2135 2 32 ALA MB 2 101 GLU QG . . 4.600 3.797 2.811 4.326 . 0 0 "[ . 1 . 2]" 1 2136 2 32 ALA MB 2 102 GLU H . . 4.910 4.910 4.469 5.023 0.113 5 0 "[ . 1 . 2]" 1 2137 2 33 PHE H 2 33 PHE QB . . 3.090 2.239 2.184 2.281 . 0 0 "[ . 1 . 2]" 1 2138 2 33 PHE H 2 33 PHE QD . . 4.910 4.178 4.148 4.211 . 0 0 "[ . 1 . 2]" 1 2139 2 33 PHE H 2 34 ASN H . . 4.660 4.578 4.537 4.623 . 0 0 "[ . 1 . 2]" 1 2140 2 33 PHE H 2 70 HIS H . . 5.500 5.442 5.115 5.564 0.064 4 0 "[ . 1 . 2]" 1 2141 2 33 PHE H 2 70 HIS HA . . 3.870 3.788 3.367 3.989 0.119 4 0 "[ . 1 . 2]" 1 2142 2 33 PHE H 2 70 HIS HB2 . . 5.500 4.648 4.338 4.946 . 0 0 "[ . 1 . 2]" 1 2143 2 33 PHE H 2 70 HIS HB3 . . 5.290 3.720 3.203 4.061 . 0 0 "[ . 1 . 2]" 1 2144 2 33 PHE H 2 71 GLU H . . 3.990 3.777 3.545 4.010 0.020 7 0 "[ . 1 . 2]" 1 2145 2 33 PHE H 2 71 GLU HA . . 2.860 2.133 1.754 2.645 . 0 0 "[ . 1 . 2]" 1 2146 2 33 PHE H 2 71 GLU QB . . 5.490 3.891 3.400 4.468 . 0 0 "[ . 1 . 2]" 1 2147 2 33 PHE H 2 71 GLU QG . . 5.500 4.235 3.631 4.781 . 0 0 "[ . 1 . 2]" 1 2148 2 33 PHE H 2 72 ALA H . . 4.220 3.709 3.262 4.044 . 0 0 "[ . 1 . 2]" 1 2149 2 33 PHE H 2 72 ALA MB . . 4.990 4.246 3.754 4.492 . 0 0 "[ . 1 . 2]" 1 2150 2 33 PHE H 2 100 VAL QG . . 5.230 4.016 3.604 4.414 . 0 0 "[ . 1 . 2]" 1 2151 2 33 PHE HA 2 35 GLY H . . 5.420 3.054 2.789 3.710 . 0 0 "[ . 1 . 2]" 1 2152 2 33 PHE HA 2 71 GLU H . . 5.500 5.307 4.861 5.532 0.032 12 0 "[ . 1 . 2]" 1 2153 2 33 PHE HA 2 72 ALA MB . . 5.430 3.038 2.533 3.365 . 0 0 "[ . 1 . 2]" 1 2154 2 33 PHE HA 2 100 VAL QG . . 4.610 4.217 3.824 4.524 . 0 0 "[ . 1 . 2]" 1 2155 2 33 PHE QB 2 33 PHE QD . . 2.450 2.125 2.114 2.137 . 0 0 "[ . 1 . 2]" 1 2156 2 33 PHE QB 2 71 GLU H . . 3.630 2.857 2.520 3.181 . 0 0 "[ . 1 . 2]" 1 2157 2 33 PHE QB 2 72 ALA H . . 5.340 3.777 3.294 4.298 . 0 0 "[ . 1 . 2]" 1 2158 2 33 PHE QB 2 72 ALA MB . . 5.340 2.926 2.356 3.449 . 0 0 "[ . 1 . 2]" 1 2159 2 33 PHE QD 2 34 ASN QB . . 4.260 3.061 2.829 3.686 . 0 0 "[ . 1 . 2]" 1 2160 2 33 PHE QD 2 35 GLY H . . 5.500 4.621 4.475 4.762 . 0 0 "[ . 1 . 2]" 1 2161 2 34 ASN H 2 34 ASN HA . . 2.550 2.269 2.214 2.289 . 0 0 "[ . 1 . 2]" 1 2162 2 34 ASN H 2 34 ASN QB . . 3.160 3.072 3.026 3.137 . 0 0 "[ . 1 . 2]" 1 2163 2 34 ASN H 2 35 GLY H . . 3.880 2.309 2.158 2.482 . 0 0 "[ . 1 . 2]" 1 2164 2 34 ASN H 2 36 PRO HD2 . . 5.500 3.296 2.426 3.613 . 0 0 "[ . 1 . 2]" 1 2165 2 34 ASN H 2 36 PRO QG . . 5.350 4.260 3.702 4.978 . 0 0 "[ . 1 . 2]" 1 2166 2 34 ASN H 2 38 GLY HA2 . . 4.540 4.514 4.199 4.687 0.147 13 0 "[ . 1 . 2]" 1 2167 2 34 ASN HA 2 35 GLY H . . 3.040 2.812 2.319 3.008 . 0 0 "[ . 1 . 2]" 1 2168 2 34 ASN HA 2 37 PHE H . . 5.450 5.526 5.044 5.632 0.182 9 0 "[ . 1 . 2]" 1 2169 2 34 ASN QB 2 35 GLY H . . 4.200 3.756 3.638 3.942 . 0 0 "[ . 1 . 2]" 1 2170 2 34 ASN QB 2 35 GLY QA . . 4.590 4.379 4.252 4.484 . 0 0 "[ . 1 . 2]" 1 2171 2 35 GLY H 2 36 PRO HA . . 4.920 4.667 4.539 4.810 . 0 0 "[ . 1 . 2]" 1 2172 2 35 GLY H 2 36 PRO HD3 . . 4.580 3.247 2.724 3.477 . 0 0 "[ . 1 . 2]" 1 2173 2 35 GLY H 2 37 PHE H . . 5.500 5.738 5.625 5.827 0.327 14 0 "[ . 1 . 2]" 1 2174 2 35 GLY H 2 38 GLY HA2 . . 5.500 5.384 4.981 5.595 0.095 13 0 "[ . 1 . 2]" 1 2175 2 35 GLY H 2 72 ALA MB . . 5.500 5.095 4.498 5.520 0.020 4 0 "[ . 1 . 2]" 1 2176 2 35 GLY H 2 100 VAL QG . . 5.440 3.575 3.064 3.809 . 0 0 "[ . 1 . 2]" 1 2177 2 35 GLY QA 2 36 PRO HA . . 5.340 4.080 4.050 4.131 . 0 0 "[ . 1 . 2]" 1 2178 2 35 GLY QA 2 98 LEU MD1 . . 5.340 3.947 3.609 4.710 . 0 0 "[ . 1 . 2]" 1 2179 2 35 GLY QA 2 100 VAL HB . . 4.330 2.790 2.134 4.082 . 0 0 "[ . 1 . 2]" 1 2180 2 35 GLY QA 2 100 VAL QG . . 2.980 2.237 1.868 2.644 . 0 0 "[ . 1 . 2]" 1 2181 2 36 PRO HA 2 37 PHE H . . 2.780 2.497 2.400 2.813 0.033 7 0 "[ . 1 . 2]" 1 2182 2 36 PRO HA 2 37 PHE QD . . 5.500 4.378 3.989 4.773 . 0 0 "[ . 1 . 2]" 1 2183 2 36 PRO HA 2 40 ALA MB . . 4.370 4.040 3.625 4.441 0.071 8 0 "[ . 1 . 2]" 1 2184 2 36 PRO HA 2 98 LEU MD1 . . 4.460 3.151 2.563 3.911 . 0 0 "[ . 1 . 2]" 1 2185 2 36 PRO QB 2 37 PHE H . . 4.090 2.475 1.871 2.712 . 0 0 "[ . 1 . 2]" 1 2186 2 36 PRO QB 2 37 PHE QB . . 4.590 4.045 3.815 4.262 . 0 0 "[ . 1 . 2]" 1 2187 2 36 PRO QB 2 37 PHE QD . . 5.500 4.085 3.633 4.345 . 0 0 "[ . 1 . 2]" 1 2188 2 36 PRO QB 2 38 GLY H . . 4.690 2.381 2.181 2.706 . 0 0 "[ . 1 . 2]" 1 2189 2 36 PRO QB 2 38 GLY HA2 . . 5.500 3.885 3.558 4.356 . 0 0 "[ . 1 . 2]" 1 2190 2 36 PRO QB 2 40 ALA MB . . 2.890 2.020 1.782 2.388 . 0 0 "[ . 1 . 2]" 1 2191 2 36 PRO HD2 2 38 GLY H . . 5.500 4.735 4.150 5.114 . 0 0 "[ . 1 . 2]" 1 2192 2 36 PRO HD2 2 100 VAL QG . . 5.440 4.260 3.654 4.861 . 0 0 "[ . 1 . 2]" 1 2193 2 36 PRO HD3 2 98 LEU MD1 . . 5.500 4.712 4.067 5.555 0.055 3 0 "[ . 1 . 2]" 1 2194 2 36 PRO QG 2 38 GLY HA2 . . 5.350 2.796 2.604 3.765 . 0 0 "[ . 1 . 2]" 1 2195 2 36 PRO QG 2 41 MET QG . . 3.160 2.629 1.835 3.294 0.134 20 0 "[ . 1 . 2]" 1 2196 2 37 PHE H 2 37 PHE QB . . 3.020 2.560 2.486 2.667 . 0 0 "[ . 1 . 2]" 1 2197 2 37 PHE H 2 38 GLY H . . 3.710 2.549 2.229 2.813 . 0 0 "[ . 1 . 2]" 1 2198 2 37 PHE H 2 39 ASP H . . 5.500 4.774 4.336 5.408 . 0 0 "[ . 1 . 2]" 1 2199 2 37 PHE H 2 40 ALA H . . 5.210 4.280 4.035 4.571 . 0 0 "[ . 1 . 2]" 1 2200 2 37 PHE H 2 40 ALA MB . . 4.560 3.524 2.602 4.076 . 0 0 "[ . 1 . 2]" 1 2201 2 37 PHE HA 2 38 GLY HA2 . . 5.130 4.893 4.736 5.091 . 0 0 "[ . 1 . 2]" 1 2202 2 37 PHE QB 2 38 GLY H . . 3.100 2.706 2.428 2.975 . 0 0 "[ . 1 . 2]" 1 2203 2 37 PHE QB 2 39 ASP H . . 5.340 3.040 2.509 3.540 . 0 0 "[ . 1 . 2]" 1 2204 2 37 PHE QB 2 40 ALA H . . 4.670 3.651 2.564 4.224 . 0 0 "[ . 1 . 2]" 1 2205 2 37 PHE QD 2 38 GLY H . . 3.970 3.978 3.782 4.099 0.129 15 0 "[ . 1 . 2]" 1 2206 2 37 PHE QD 2 39 ASP QB . . 5.340 4.902 3.692 5.416 0.076 10 0 "[ . 1 . 2]" 1 2207 2 37 PHE QD 2 40 ALA H . . 4.920 4.390 3.198 4.960 0.040 7 0 "[ . 1 . 2]" 1 2208 2 37 PHE QD 2 40 ALA MB . . 5.500 3.691 2.080 4.752 . 0 0 "[ . 1 . 2]" 1 2209 2 38 GLY H 2 39 ASP H . . 3.890 2.811 2.474 3.322 . 0 0 "[ . 1 . 2]" 1 2210 2 38 GLY H 2 39 ASP QB . . 5.090 4.551 4.225 4.884 . 0 0 "[ . 1 . 2]" 1 2211 2 38 GLY H 2 40 ALA H . . 4.350 2.764 2.570 2.953 . 0 0 "[ . 1 . 2]" 1 2212 2 38 GLY H 2 41 MET H . . 5.500 4.173 3.711 4.568 . 0 0 "[ . 1 . 2]" 1 2213 2 38 GLY HA2 2 39 ASP HA . . 5.470 4.784 4.681 4.855 . 0 0 "[ . 1 . 2]" 1 2214 2 38 GLY HA2 2 40 ALA H . . 4.940 4.113 3.923 4.430 . 0 0 "[ . 1 . 2]" 1 2215 2 38 GLY HA3 2 39 ASP H . . 3.060 2.660 2.432 2.922 . 0 0 "[ . 1 . 2]" 1 2216 2 38 GLY HA3 2 40 ALA H . . 5.080 4.368 4.002 4.617 . 0 0 "[ . 1 . 2]" 1 2217 2 38 GLY HA3 2 41 MET H . . 5.410 4.814 4.609 5.123 . 0 0 "[ . 1 . 2]" 1 2218 2 39 ASP H 2 39 ASP QB . . 2.960 2.500 2.371 2.646 . 0 0 "[ . 1 . 2]" 1 2219 2 39 ASP H 2 40 ALA H . . 3.520 2.663 2.541 2.799 . 0 0 "[ . 1 . 2]" 1 2220 2 39 ASP H 2 40 ALA MB . . 5.500 4.267 4.090 4.402 . 0 0 "[ . 1 . 2]" 1 2221 2 39 ASP H 2 41 MET H . . 4.990 4.328 4.127 4.535 . 0 0 "[ . 1 . 2]" 1 2222 2 39 ASP H 2 42 ALA MB . . 5.500 4.327 3.991 4.888 . 0 0 "[ . 1 . 2]" 1 2223 2 39 ASP HA 2 39 ASP QB . . 2.440 2.353 2.167 2.433 . 0 0 "[ . 1 . 2]" 1 2224 2 39 ASP HA 2 42 ALA H . . 3.510 2.966 2.708 3.206 . 0 0 "[ . 1 . 2]" 1 2225 2 39 ASP HA 2 42 ALA MB . . 2.680 2.099 1.967 2.474 . 0 0 "[ . 1 . 2]" 1 2226 2 39 ASP QB 2 40 ALA HA . . 5.340 4.128 3.875 4.707 . 0 0 "[ . 1 . 2]" 1 2227 2 39 ASP QB 2 42 ALA H . . 5.040 4.691 4.470 4.877 . 0 0 "[ . 1 . 2]" 1 2228 2 39 ASP QB 2 42 ALA MB . . 3.730 3.687 3.321 3.852 0.122 4 0 "[ . 1 . 2]" 1 2229 2 39 ASP QB 2 43 GLU H . . 4.980 3.587 3.191 4.011 . 0 0 "[ . 1 . 2]" 1 2230 2 39 ASP QB 2 43 GLU HA . . 5.340 5.302 4.905 5.457 0.117 12 0 "[ . 1 . 2]" 1 2231 2 40 ALA H 2 40 ALA HA . . 2.830 2.744 2.703 2.772 . 0 0 "[ . 1 . 2]" 1 2232 2 40 ALA H 2 40 ALA MB . . 2.400 2.212 2.184 2.235 . 0 0 "[ . 1 . 2]" 1 2233 2 40 ALA H 2 41 MET H . . 3.080 2.816 2.702 2.917 . 0 0 "[ . 1 . 2]" 1 2234 2 40 ALA H 2 42 ALA H . . 4.500 4.328 4.031 4.540 0.040 7 0 "[ . 1 . 2]" 1 2235 2 40 ALA H 2 42 ALA MB . . 5.500 4.852 4.675 5.073 . 0 0 "[ . 1 . 2]" 1 2236 2 40 ALA H 2 44 GLN HB2 . . 5.080 3.861 3.754 4.032 . 0 0 "[ . 1 . 2]" 1 2237 2 40 ALA HA 2 41 MET QG . . 5.340 5.015 4.719 5.306 . 0 0 "[ . 1 . 2]" 1 2238 2 40 ALA HA 2 44 GLN H . . 4.620 3.499 3.302 3.693 . 0 0 "[ . 1 . 2]" 1 2239 2 40 ALA HA 2 44 GLN HA . . 5.500 4.607 4.471 4.707 . 0 0 "[ . 1 . 2]" 1 2240 2 40 ALA HA 2 44 GLN HB2 . . 2.650 1.715 1.627 1.793 . 0 0 "[ . 1 . 2]" 1 2241 2 40 ALA HA 2 44 GLN HB3 . . 5.500 2.840 2.708 2.949 . 0 0 "[ . 1 . 2]" 1 2242 2 40 ALA HA 2 45 LEU H . . 4.270 4.294 4.110 4.448 0.178 17 0 "[ . 1 . 2]" 1 2243 2 40 ALA HA 2 48 LEU MD1 . . 5.500 4.310 3.747 4.728 . 0 0 "[ . 1 . 2]" 1 2244 2 40 ALA MB 2 41 MET H . . 2.810 2.735 2.575 2.849 0.039 2 0 "[ . 1 . 2]" 1 2245 2 40 ALA MB 2 41 MET QG . . 3.540 3.055 2.843 3.308 . 0 0 "[ . 1 . 2]" 1 2246 2 40 ALA MB 2 44 GLN H . . 5.090 4.807 4.700 4.949 . 0 0 "[ . 1 . 2]" 1 2247 2 40 ALA MB 2 44 GLN HB2 . . 5.200 3.482 3.362 3.532 . 0 0 "[ . 1 . 2]" 1 2248 2 40 ALA MB 2 44 GLN HB3 . . 4.750 4.127 3.865 4.270 . 0 0 "[ . 1 . 2]" 1 2249 2 41 MET H 2 41 MET HB2 . . 2.850 2.584 2.312 2.697 . 0 0 "[ . 1 . 2]" 1 2250 2 41 MET H 2 42 ALA H . . 2.870 2.243 1.995 2.417 . 0 0 "[ . 1 . 2]" 1 2251 2 41 MET H 2 42 ALA MB . . 4.080 3.895 3.776 4.039 . 0 0 "[ . 1 . 2]" 1 2252 2 41 MET H 2 43 GLU H . . 4.720 3.893 3.656 4.388 . 0 0 "[ . 1 . 2]" 1 2253 2 41 MET H 2 45 LEU H . . 5.100 4.705 4.456 4.996 . 0 0 "[ . 1 . 2]" 1 2254 2 41 MET H 2 45 LEU QD . . 4.900 4.425 3.812 4.831 . 0 0 "[ . 1 . 2]" 1 2255 2 41 MET HA 2 41 MET HB3 . . 2.400 2.443 2.377 2.569 0.169 12 0 "[ . 1 . 2]" 1 2256 2 41 MET HA 2 41 MET QG . . 3.100 2.829 2.377 3.146 0.046 8 0 "[ . 1 . 2]" 1 2257 2 41 MET HA 2 45 LEU H . . 4.890 3.358 2.901 3.766 . 0 0 "[ . 1 . 2]" 1 2258 2 41 MET HA 2 45 LEU QB . . 5.500 1.903 1.666 3.598 . 0 0 "[ . 1 . 2]" 1 2259 2 41 MET HA 2 45 LEU HG . . 5.500 3.816 1.683 4.629 . 0 0 "[ . 1 . 2]" 1 2260 2 41 MET HB2 2 41 MET QG . . 2.520 2.217 2.147 2.395 . 0 0 "[ . 1 . 2]" 1 2261 2 41 MET HB2 2 42 ALA H . . 3.840 2.385 2.080 3.024 . 0 0 "[ . 1 . 2]" 1 2262 2 41 MET HB2 2 42 ALA HA . . 4.350 4.018 3.725 4.386 0.036 6 0 "[ . 1 . 2]" 1 2263 2 41 MET HB3 2 45 LEU QD . . 3.940 2.878 2.647 3.782 . 0 0 "[ . 1 . 2]" 1 2264 2 41 MET QG 2 42 ALA H . . 5.100 3.864 3.606 4.196 . 0 0 "[ . 1 . 2]" 1 2265 2 41 MET QG 2 45 LEU QD . . 4.310 3.155 1.943 3.708 . 0 0 "[ . 1 . 2]" 1 2266 2 42 ALA H 2 42 ALA MB . . 3.620 2.213 2.182 2.261 . 0 0 "[ . 1 . 2]" 1 2267 2 42 ALA H 2 43 GLU H . . 3.210 2.879 2.580 3.103 . 0 0 "[ . 1 . 2]" 1 2268 2 42 ALA H 2 43 GLU HA . . 5.340 5.396 5.228 5.478 0.138 16 0 "[ . 1 . 2]" 1 2269 2 42 ALA H 2 44 GLN H . . 4.540 4.286 3.914 4.587 0.047 1 0 "[ . 1 . 2]" 1 2270 2 42 ALA H 2 45 LEU QD . . 5.350 4.851 4.644 4.998 . 0 0 "[ . 1 . 2]" 1 2271 2 42 ALA MB 2 43 GLU H . . 5.500 2.632 2.188 3.174 . 0 0 "[ . 1 . 2]" 1 2272 2 42 ALA MB 2 43 GLU QB . . 3.300 3.239 3.039 3.367 0.067 10 0 "[ . 1 . 2]" 1 2273 2 42 ALA MB 2 44 GLN H . . 4.380 4.232 3.864 4.456 0.076 20 0 "[ . 1 . 2]" 1 2274 2 42 ALA MB 2 45 LEU QB . . 5.500 5.195 4.811 5.863 0.363 15 0 "[ . 1 . 2]" 1 2275 2 43 GLU H 2 43 GLU QB . . 3.090 2.494 2.240 2.682 . 0 0 "[ . 1 . 2]" 1 2276 2 43 GLU H 2 44 GLN H . . 4.270 1.988 1.863 2.093 . 0 0 "[ . 1 . 2]" 1 2277 2 43 GLU H 2 45 LEU H . . 3.630 3.311 2.739 3.713 0.083 12 0 "[ . 1 . 2]" 1 2278 2 43 GLU H 2 45 LEU QB . . 5.060 4.326 3.603 4.780 . 0 0 "[ . 1 . 2]" 1 2279 2 43 GLU H 2 46 LYS H . . 5.290 4.924 4.482 5.299 0.009 10 0 "[ . 1 . 2]" 1 2280 2 43 GLU HA 2 43 GLU HG2 . . 3.780 3.242 2.665 3.842 0.062 6 0 "[ . 1 . 2]" 1 2281 2 43 GLU HA 2 43 GLU QG . . 3.160 2.680 2.381 3.129 . 0 0 "[ . 1 . 2]" 1 2282 2 43 GLU HA 2 43 GLU HG3 . . 3.780 2.963 2.483 3.671 . 0 0 "[ . 1 . 2]" 1 2283 2 43 GLU QB 2 44 GLN H . . 4.190 2.484 2.088 3.263 . 0 0 "[ . 1 . 2]" 1 2284 2 44 GLN H 2 44 GLN HB2 . . 3.840 2.271 2.196 2.442 . 0 0 "[ . 1 . 2]" 1 2285 2 44 GLN H 2 44 GLN QG . . 3.690 2.571 2.239 3.072 . 0 0 "[ . 1 . 2]" 1 2286 2 44 GLN H 2 45 LEU H . . 2.910 2.594 2.218 2.778 . 0 0 "[ . 1 . 2]" 1 2287 2 44 GLN H 2 46 LYS H . . 5.400 4.318 3.898 4.672 . 0 0 "[ . 1 . 2]" 1 2288 2 44 GLN H 2 47 PRO HD3 . . 5.070 5.099 4.932 5.212 0.142 6 0 "[ . 1 . 2]" 1 2289 2 44 GLN HA 2 47 PRO QG . . 5.020 2.990 2.802 3.192 . 0 0 "[ . 1 . 2]" 1 2290 2 44 GLN HA 2 48 LEU MD2 . . 5.500 4.467 4.113 4.852 . 0 0 "[ . 1 . 2]" 1 2291 2 44 GLN HB2 2 45 LEU H . . 4.360 3.451 3.099 3.743 . 0 0 "[ . 1 . 2]" 1 2292 2 44 GLN HB2 2 45 LEU HA . . 5.500 4.789 4.490 4.981 . 0 0 "[ . 1 . 2]" 1 2293 2 44 GLN HB3 2 45 LEU H . . 4.900 4.086 3.876 4.231 . 0 0 "[ . 1 . 2]" 1 2294 2 44 GLN HB3 2 45 LEU HA . . 5.500 4.618 4.499 4.749 . 0 0 "[ . 1 . 2]" 1 2295 2 44 GLN QE 2 48 LEU MD1 . . 3.360 2.006 1.769 2.590 . 0 0 "[ . 1 . 2]" 1 2296 2 44 GLN QE 2 48 LEU MD2 . . 3.010 2.911 2.610 3.161 0.151 13 0 "[ . 1 . 2]" 1 2297 2 44 GLN QE 2 48 LEU HG . . 4.540 2.921 2.275 3.435 . 0 0 "[ . 1 . 2]" 1 2298 2 44 GLN HE21 2 48 LEU MD2 . . 3.480 3.601 3.325 3.777 0.297 3 0 "[ . 1 . 2]" 1 2299 2 44 GLN HE22 2 48 LEU MD2 . . 3.480 3.097 2.672 3.588 0.108 13 0 "[ . 1 . 2]" 1 2300 2 45 LEU H 2 46 LYS H . . 3.030 2.377 2.193 2.668 . 0 0 "[ . 1 . 2]" 1 2301 2 45 LEU H 2 47 PRO HD3 . . 5.100 4.426 4.024 4.821 . 0 0 "[ . 1 . 2]" 1 2302 2 45 LEU H 2 49 ALA H . . 5.500 5.604 5.465 5.764 0.264 17 0 "[ . 1 . 2]" 1 2303 2 45 LEU HA 2 45 LEU QD . . 4.190 2.135 1.939 2.970 . 0 0 "[ . 1 . 2]" 1 2304 2 45 LEU HA 2 47 PRO QG . . 5.500 5.635 5.367 5.933 0.433 4 0 "[ . 1 . 2]" 1 2305 2 45 LEU HA 2 48 LEU HB3 . . 5.500 5.504 5.056 5.887 0.387 4 0 "[ . 1 . 2]" 1 2306 2 45 LEU HA 2 48 LEU MD1 . . 5.430 4.962 4.391 5.464 0.034 9 0 "[ . 1 . 2]" 1 2307 2 45 LEU HA 2 48 LEU HG . . 5.500 5.049 4.691 5.518 0.018 9 0 "[ . 1 . 2]" 1 2308 2 45 LEU QB 2 45 LEU QD . . 2.430 1.985 1.904 2.086 . 0 0 "[ . 1 . 2]" 1 2309 2 45 LEU QB 2 46 LYS H . . 4.150 2.541 2.139 3.087 . 0 0 "[ . 1 . 2]" 1 2310 2 45 LEU QD 2 46 LYS H . . 5.060 3.899 3.337 4.291 . 0 0 "[ . 1 . 2]" 1 2311 2 45 LEU QD 2 46 LYS HA . . 5.440 4.009 3.021 4.821 . 0 0 "[ . 1 . 2]" 1 2312 2 45 LEU QD 2 46 LYS QB . . 5.280 4.630 4.069 5.273 . 0 0 "[ . 1 . 2]" 1 2313 2 45 LEU QD 2 49 ALA HA . . 4.460 2.458 2.044 3.201 . 0 0 "[ . 1 . 2]" 1 2314 2 45 LEU MD1 2 49 ALA MB . . 5.500 2.288 1.832 4.233 . 0 0 "[ . 1 . 2]" 1 2315 2 45 LEU MD2 2 49 ALA MB . . 5.500 3.587 1.936 4.154 . 0 0 "[ . 1 . 2]" 1 2316 2 46 LYS H 2 46 LYS QB . . 3.430 2.412 2.132 2.874 . 0 0 "[ . 1 . 2]" 1 2317 2 46 LYS H 2 46 LYS QE . . 4.880 4.142 3.706 4.766 . 0 0 "[ . 1 . 2]" 1 2318 2 46 LYS H 2 47 PRO HD3 . . 3.800 2.982 2.695 3.325 . 0 0 "[ . 1 . 2]" 1 2319 2 46 LYS H 2 49 ALA H . . 4.930 4.779 4.665 4.883 . 0 0 "[ . 1 . 2]" 1 2320 2 46 LYS HA 2 49 ALA H . . 4.710 4.362 3.806 4.617 . 0 0 "[ . 1 . 2]" 1 2321 2 46 LYS HA 2 49 ALA MB . . 3.570 3.706 3.038 3.928 0.358 15 0 "[ . 1 . 2]" 1 2322 2 46 LYS QB 2 46 LYS QD . . 3.210 2.249 2.035 2.385 . 0 0 "[ . 1 . 2]" 1 2323 2 46 LYS QB 2 46 LYS QG . . 2.280 2.064 2.010 2.092 . 0 0 "[ . 1 . 2]" 1 2324 2 46 LYS QB 2 47 PRO HA . . 5.150 4.517 3.859 4.812 . 0 0 "[ . 1 . 2]" 1 2325 2 46 LYS QB 2 47 PRO HD3 . . 3.030 2.300 1.745 3.461 0.431 17 0 "[ . 1 . 2]" 1 2326 2 46 LYS QG 2 47 PRO HA . . 5.340 4.150 3.356 5.644 0.304 13 0 "[ . 1 . 2]" 1 2327 2 46 LYS QG 2 47 PRO QG . . 5.210 3.940 3.332 4.613 . 0 0 "[ . 1 . 2]" 1 2328 2 47 PRO HA 2 49 ALA H . . 5.080 4.267 4.010 4.476 . 0 0 "[ . 1 . 2]" 1 2329 2 47 PRO HB2 2 48 LEU HA . . 5.500 4.143 3.964 4.271 . 0 0 "[ . 1 . 2]" 1 2330 2 47 PRO HB2 2 48 LEU MD2 . . 3.710 2.564 2.262 2.821 . 0 0 "[ . 1 . 2]" 1 2331 2 47 PRO HB2 2 48 LEU HG . . 3.860 3.753 3.451 3.958 0.098 18 0 "[ . 1 . 2]" 1 2332 2 47 PRO HD3 2 48 LEU HG . . 4.290 4.343 4.272 4.407 0.117 9 0 "[ . 1 . 2]" 1 2333 2 47 PRO QG 2 48 LEU H . . 2.400 2.809 2.450 2.984 0.584 4 6 "[** +. 1 * -* 2]" 1 2334 2 47 PRO QG 2 48 LEU MD2 . . 3.830 2.528 2.279 2.655 . 0 0 "[ . 1 . 2]" 1 2335 2 47 PRO QG 2 48 LEU HG . . 5.470 2.147 1.920 2.370 . 0 0 "[ . 1 . 2]" 1 2336 2 47 PRO QG 2 49 ALA H . . 5.040 4.916 4.701 5.089 0.049 4 0 "[ . 1 . 2]" 1 2337 2 48 LEU H 2 48 LEU HA . . 2.800 2.920 2.900 2.938 0.138 15 0 "[ . 1 . 2]" 1 2338 2 48 LEU H 2 48 LEU HB2 . . 4.050 2.741 2.646 2.851 . 0 0 "[ . 1 . 2]" 1 2339 2 48 LEU H 2 48 LEU MD1 . . 3.830 3.897 3.828 3.935 0.105 4 0 "[ . 1 . 2]" 1 2340 2 48 LEU H 2 48 LEU HG . . 2.450 2.500 2.396 2.557 0.107 15 0 "[ . 1 . 2]" 1 2341 2 48 LEU H 2 49 ALA H . . 2.890 2.330 2.211 2.484 . 0 0 "[ . 1 . 2]" 1 2342 2 48 LEU HA 2 48 LEU HB3 . . 2.610 2.338 2.303 2.366 . 0 0 "[ . 1 . 2]" 1 2343 2 48 LEU HA 2 48 LEU MD2 . . 2.750 2.329 2.188 2.449 . 0 0 "[ . 1 . 2]" 1 2344 2 48 LEU HA 2 49 ALA H . . 3.500 3.289 3.190 3.410 . 0 0 "[ . 1 . 2]" 1 2345 2 48 LEU HA 2 51 SER H . . 4.370 3.480 3.346 3.615 . 0 0 "[ . 1 . 2]" 1 2346 2 48 LEU HA 2 51 SER QB . . 3.050 3.077 2.922 3.153 0.103 14 0 "[ . 1 . 2]" 1 2347 2 48 LEU HA 2 52 ILE H . . 4.490 4.083 3.801 4.222 . 0 0 "[ . 1 . 2]" 1 2348 2 48 LEU HB2 2 48 LEU MD1 . . 2.860 2.308 2.262 2.340 . 0 0 "[ . 1 . 2]" 1 2349 2 48 LEU HB2 2 48 LEU MD2 . . 3.200 3.207 3.200 3.216 0.016 19 0 "[ . 1 . 2]" 1 2350 2 48 LEU HB2 2 49 ALA H . . 4.510 3.568 3.319 3.721 . 0 0 "[ . 1 . 2]" 1 2351 2 48 LEU HB2 2 49 ALA MB . . 4.670 4.906 4.688 5.040 0.370 7 0 "[ . 1 . 2]" 1 2352 2 48 LEU HB2 2 52 ILE MG . . 4.490 2.857 2.499 2.964 . 0 0 "[ . 1 . 2]" 1 2353 2 48 LEU HB3 2 48 LEU MD1 . . 2.840 2.281 2.224 2.326 . 0 0 "[ . 1 . 2]" 1 2354 2 48 LEU HB3 2 48 LEU MD2 . . 2.620 2.448 2.405 2.480 . 0 0 "[ . 1 . 2]" 1 2355 2 48 LEU HB3 2 49 ALA H . . 4.110 4.388 4.236 4.500 0.390 4 0 "[ . 1 . 2]" 1 2356 2 48 LEU HB3 2 52 ILE MG . . 2.860 2.513 2.041 2.812 . 0 0 "[ . 1 . 2]" 1 2357 2 48 LEU MD1 2 52 ILE H . . 5.320 4.634 4.281 4.840 . 0 0 "[ . 1 . 2]" 1 2358 2 48 LEU MD1 2 52 ILE HB . . 5.460 4.748 4.435 5.080 . 0 0 "[ . 1 . 2]" 1 2359 2 48 LEU MD1 2 52 ILE MG . . 3.410 2.518 2.215 2.757 . 0 0 "[ . 1 . 2]" 1 2360 2 48 LEU MD2 2 51 SER QB . . 3.660 3.667 3.552 3.724 0.064 2 0 "[ . 1 . 2]" 1 2361 2 48 LEU MD2 2 52 ILE QG . . 5.500 4.416 4.212 4.670 . 0 0 "[ . 1 . 2]" 1 2362 2 49 ALA H 2 49 ALA MB . . 2.550 2.263 2.141 2.324 . 0 0 "[ . 1 . 2]" 1 2363 2 49 ALA H 2 51 SER H . . 5.110 4.171 4.073 4.319 . 0 0 "[ . 1 . 2]" 1 2364 2 49 ALA H 2 52 ILE H . . 5.040 4.670 4.610 4.782 . 0 0 "[ . 1 . 2]" 1 2365 2 49 ALA H 2 52 ILE QG . . 5.300 3.652 3.454 3.765 . 0 0 "[ . 1 . 2]" 1 2366 2 49 ALA HA 2 52 ILE H . . 4.260 3.717 3.552 3.841 . 0 0 "[ . 1 . 2]" 1 2367 2 49 ALA HA 2 52 ILE HB . . 4.940 5.071 4.979 5.147 0.207 13 0 "[ . 1 . 2]" 1 2368 2 49 ALA HA 2 52 ILE MD . . 4.820 2.251 2.072 2.526 . 0 0 "[ . 1 . 2]" 1 2369 2 49 ALA HA 2 52 ILE MG . . 5.500 4.898 4.647 5.040 . 0 0 "[ . 1 . 2]" 1 2370 2 49 ALA HA 2 53 ASN H . . 3.050 2.953 2.595 3.206 0.156 1 0 "[ . 1 . 2]" 1 2371 2 49 ALA HA 2 53 ASN HB2 . . 4.100 3.169 2.603 3.655 . 0 0 "[ . 1 . 2]" 1 2372 2 49 ALA MB 2 50 GLU QG . . 5.340 3.843 3.592 4.132 . 0 0 "[ . 1 . 2]" 1 2373 2 49 ALA MB 2 52 ILE QG . . 5.500 3.999 3.805 4.101 . 0 0 "[ . 1 . 2]" 1 2374 2 50 GLU H 2 50 GLU HB3 . . 2.700 2.594 2.545 2.645 . 0 0 "[ . 1 . 2]" 1 2375 2 50 GLU H 2 50 GLU QG . . 2.620 1.937 1.820 2.091 . 0 0 "[ . 1 . 2]" 1 2376 2 50 GLU H 2 51 SER H . . 2.740 2.646 2.579 2.711 . 0 0 "[ . 1 . 2]" 1 2377 2 50 GLU H 2 52 ILE H . . 4.470 4.422 4.230 4.497 0.027 4 0 "[ . 1 . 2]" 1 2378 2 50 GLU H 2 53 ASN H . . 5.410 4.990 4.848 5.248 . 0 0 "[ . 1 . 2]" 1 2379 2 50 GLU HA 2 50 GLU HB2 . . 2.560 2.484 2.444 2.513 . 0 0 "[ . 1 . 2]" 1 2380 2 50 GLU HA 2 50 GLU HB3 . . 2.700 2.406 2.366 2.462 . 0 0 "[ . 1 . 2]" 1 2381 2 50 GLU HA 2 50 GLU HG2 . . 3.860 3.720 3.639 3.791 . 0 0 "[ . 1 . 2]" 1 2382 2 50 GLU HA 2 50 GLU HG3 . . 3.860 3.772 3.721 3.842 . 0 0 "[ . 1 . 2]" 1 2383 2 50 GLU HA 2 51 SER H . . 3.540 3.413 3.393 3.448 . 0 0 "[ . 1 . 2]" 1 2384 2 50 GLU QG 2 51 SER H . . 2.640 2.535 2.340 2.642 0.002 13 0 "[ . 1 . 2]" 1 2385 2 50 GLU QG 2 51 SER QB . . 3.920 3.381 2.623 3.780 . 0 0 "[ . 1 . 2]" 1 2386 2 50 GLU QG 2 52 ILE H . . 5.070 4.509 4.337 4.643 . 0 0 "[ . 1 . 2]" 1 2387 2 50 GLU HG2 2 51 SER H . . 3.130 3.027 2.878 3.129 . 0 0 "[ . 1 . 2]" 1 2388 2 50 GLU HG3 2 51 SER H . . 3.130 2.731 2.477 3.025 . 0 0 "[ . 1 . 2]" 1 2389 2 51 SER H 2 51 SER QB . . 2.390 2.410 2.312 2.474 0.084 16 0 "[ . 1 . 2]" 1 2390 2 51 SER H 2 52 ILE H . . 3.310 2.315 2.180 2.379 . 0 0 "[ . 1 . 2]" 1 2391 2 51 SER H 2 52 ILE MD . . 4.830 4.644 4.500 4.812 . 0 0 "[ . 1 . 2]" 1 2392 2 51 SER H 2 52 ILE QG . . 3.450 3.494 3.404 3.545 0.095 20 0 "[ . 1 . 2]" 1 2393 2 51 SER H 2 53 ASN H . . 4.390 3.901 3.723 4.084 . 0 0 "[ . 1 . 2]" 1 2394 2 51 SER QB 2 52 ILE H . . 3.080 2.397 2.218 2.780 . 0 0 "[ . 1 . 2]" 1 2395 2 52 ILE H 2 52 ILE HB . . 3.660 3.655 3.634 3.700 0.040 3 0 "[ . 1 . 2]" 1 2396 2 52 ILE H 2 52 ILE MD . . 3.630 3.346 3.182 3.546 . 0 0 "[ . 1 . 2]" 1 2397 2 52 ILE H 2 52 ILE QG . . 2.860 1.887 1.814 2.025 . 0 0 "[ . 1 . 2]" 1 2398 2 52 ILE H 2 52 ILE MG . . 3.110 2.706 2.572 2.863 . 0 0 "[ . 1 . 2]" 1 2399 2 52 ILE H 2 53 ASN H . . 3.100 2.629 2.480 2.817 . 0 0 "[ . 1 . 2]" 1 2400 2 52 ILE H 2 54 GLN H . . 4.340 3.654 3.215 3.992 . 0 0 "[ . 1 . 2]" 1 2401 2 52 ILE HA 2 52 ILE QG . . 3.890 3.410 3.387 3.432 . 0 0 "[ . 1 . 2]" 1 2402 2 52 ILE HA 2 52 ILE MG . . 3.630 2.216 2.170 2.267 . 0 0 "[ . 1 . 2]" 1 2403 2 52 ILE HA 2 54 GLN H . . 5.330 4.559 4.160 4.979 . 0 0 "[ . 1 . 2]" 1 2404 2 52 ILE HA 2 54 GLN QB . . 5.340 4.912 4.384 5.504 0.164 3 0 "[ . 1 . 2]" 1 2405 2 52 ILE HB 2 52 ILE MD . . 2.880 2.266 2.244 2.288 . 0 0 "[ . 1 . 2]" 1 2406 2 52 ILE HB 2 53 ASN H . . 3.290 3.413 3.271 3.509 0.219 2 0 "[ . 1 . 2]" 1 2407 2 52 ILE HB 2 53 ASN HB2 . . 4.850 4.744 4.424 5.194 0.344 1 0 "[ . 1 . 2]" 1 2408 2 52 ILE HB 2 54 GLN H . . 5.500 5.364 4.968 5.603 0.103 6 0 "[ . 1 . 2]" 1 2409 2 52 ILE MD 2 52 ILE MG . . 3.030 3.082 3.046 3.109 0.079 9 0 "[ . 1 . 2]" 1 2410 2 52 ILE MD 2 53 ASN H . . 3.270 1.897 1.759 2.150 . 0 0 "[ . 1 . 2]" 1 2411 2 52 ILE MD 2 53 ASN HA . . 5.500 3.149 2.926 3.398 . 0 0 "[ . 1 . 2]" 1 2412 2 52 ILE MD 2 54 GLN H . . 4.150 3.844 3.685 4.036 . 0 0 "[ . 1 . 2]" 1 2413 2 52 ILE MD 2 55 GLU H . . 5.500 5.256 4.685 5.574 0.074 9 0 "[ . 1 . 2]" 1 2414 2 52 ILE QG 2 52 ILE MG . . 2.820 2.038 2.022 2.053 . 0 0 "[ . 1 . 2]" 1 2415 2 52 ILE QG 2 53 ASN H . . 3.340 2.489 2.288 2.629 . 0 0 "[ . 1 . 2]" 1 2416 2 52 ILE QG 2 54 GLN H . . 4.440 4.266 4.015 4.448 0.008 7 0 "[ . 1 . 2]" 1 2417 2 52 ILE MG 2 53 ASN H . . 3.950 4.052 4.020 4.101 0.151 5 0 "[ . 1 . 2]" 1 2418 2 52 ILE MG 2 53 ASN HA . . 5.500 5.359 5.294 5.424 . 0 0 "[ . 1 . 2]" 1 2419 2 52 ILE MG 2 53 ASN HB2 . . 5.500 5.556 5.319 5.877 0.377 1 0 "[ . 1 . 2]" 1 2420 2 53 ASN H 2 54 GLN H . . 2.810 2.218 2.068 2.332 . 0 0 "[ . 1 . 2]" 1 2421 2 53 ASN HA 2 53 ASN HB2 . . 2.980 2.739 2.407 3.014 0.034 1 0 "[ . 1 . 2]" 1 2422 2 53 ASN HB2 2 54 GLN H . . 5.500 3.349 2.558 3.938 . 0 0 "[ . 1 . 2]" 1 2423 2 53 ASN HB3 2 54 GLN H . . 2.820 2.992 2.364 3.746 0.926 1 5 "[+ * . 1-* .* 2]" 1 2424 2 53 ASN HB3 2 55 GLU H . . 4.690 2.910 2.424 3.686 . 0 0 "[ . 1 . 2]" 1 2425 2 54 GLN H 2 54 GLN HA . . 2.710 2.227 2.128 2.264 . 0 0 "[ . 1 . 2]" 1 2426 2 54 GLN H 2 54 GLN HB2 . . 4.200 3.349 3.035 3.976 . 0 0 "[ . 1 . 2]" 1 2427 2 54 GLN H 2 54 GLN QB . . 3.610 3.045 2.881 3.305 . 0 0 "[ . 1 . 2]" 1 2428 2 54 GLN H 2 54 GLN HB3 . . 4.200 3.676 3.021 4.127 . 0 0 "[ . 1 . 2]" 1 2429 2 54 GLN H 2 54 GLN QE . . 4.630 4.797 3.359 5.467 0.837 5 6 "[ **+ - *1 . *2]" 1 2430 2 54 GLN H 2 54 GLN QG . . 4.660 3.844 2.828 4.592 . 0 0 "[ . 1 . 2]" 1 2431 2 54 GLN H 2 55 GLU H . . 2.990 2.720 2.349 3.119 0.129 8 0 "[ . 1 . 2]" 1 2432 2 54 GLN HA 2 54 GLN QG . . 3.330 2.689 2.234 3.378 0.048 1 0 "[ . 1 . 2]" 1 2433 2 54 GLN HA 2 55 GLU HA . . 5.270 4.501 4.163 4.792 . 0 0 "[ . 1 . 2]" 1 2434 2 54 GLN QB 2 55 GLU H . . 4.470 3.614 2.820 4.007 . 0 0 "[ . 1 . 2]" 1 2435 2 55 GLU H 2 55 GLU QB . . 3.420 2.701 2.059 3.115 . 0 0 "[ . 1 . 2]" 1 2436 2 55 GLU HA 2 55 GLU QB . . 2.490 2.186 2.138 2.303 . 0 0 "[ . 1 . 2]" 1 2437 2 55 GLU HA 2 90 LYS QB . . 5.500 4.395 3.696 4.828 . 0 0 "[ . 1 . 2]" 1 2438 2 55 GLU HA 2 90 LYS HG2 . . 5.500 3.585 2.868 4.479 . 0 0 "[ . 1 . 2]" 1 2439 2 55 GLU HA 2 90 LYS HG3 . . 5.500 4.702 3.147 5.561 0.061 20 0 "[ . 1 . 2]" 1 2440 2 55 GLU QB 2 56 PRO QD . . 3.480 2.531 2.063 3.468 . 0 0 "[ . 1 . 2]" 1 2441 2 55 GLU QB 2 90 LYS QB . . 3.550 3.474 1.974 4.448 0.898 5 5 "[ + * * * - 2]" 1 2442 2 55 GLU QB 2 90 LYS QG . . 3.850 3.368 2.182 3.978 0.128 15 0 "[ . 1 . 2]" 1 2443 2 56 PRO HA 2 58 PHE H . . 5.190 4.212 3.867 5.228 0.038 18 0 "[ . 1 . 2]" 1 2444 2 56 PRO HB2 2 57 GLY H . . 2.950 2.438 1.892 3.021 0.071 18 0 "[ . 1 . 2]" 1 2445 2 56 PRO HB2 2 58 PHE H . . 3.470 3.269 2.600 3.966 0.496 17 0 "[ . 1 . 2]" 1 2446 2 56 PRO QG 2 57 GLY H . . 4.020 2.398 1.900 3.282 . 0 0 "[ . 1 . 2]" 1 2447 2 56 PRO QG 2 79 THR H . . 5.350 4.841 4.169 5.357 0.007 8 0 "[ . 1 . 2]" 1 2448 2 57 GLY H 2 57 GLY HA3 . . 2.560 2.903 2.804 2.955 0.395 8 0 "[ . 1 . 2]" 1 2449 2 57 GLY H 2 58 PHE H . . 3.310 3.223 2.735 3.556 0.246 17 0 "[ . 1 . 2]" 1 2450 2 57 GLY H 2 58 PHE QB . . 5.340 4.489 4.239 4.716 . 0 0 "[ . 1 . 2]" 1 2451 2 57 GLY H 2 59 LEU QD . . 5.440 5.418 5.297 5.491 0.051 16 0 "[ . 1 . 2]" 1 2452 2 57 GLY H 2 78 PHE HA . . 5.500 4.749 4.287 5.197 . 0 0 "[ . 1 . 2]" 1 2453 2 57 GLY H 2 79 THR H . . 4.640 4.203 3.770 4.659 0.019 20 0 "[ . 1 . 2]" 1 2454 2 57 GLY H 2 79 THR MG . . 4.750 3.551 2.730 4.474 . 0 0 "[ . 1 . 2]" 1 2455 2 57 GLY HA2 2 59 LEU QD . . 5.440 4.504 4.410 4.647 . 0 0 "[ . 1 . 2]" 1 2456 2 57 GLY HA3 2 58 PHE H . . 2.780 2.694 2.408 3.559 0.779 12 3 "[ . 1 + . * -]" 1 2457 2 57 GLY HA3 2 58 PHE QB . . 5.340 4.752 4.622 5.423 0.083 18 0 "[ . 1 . 2]" 1 2458 2 57 GLY HA3 2 60 TRP H . . 5.500 4.445 4.139 4.850 . 0 0 "[ . 1 . 2]" 1 2459 2 58 PHE H 2 58 PHE HD1 . . 4.910 3.168 2.430 4.074 . 0 0 "[ . 1 . 2]" 1 2460 2 58 PHE H 2 78 PHE HA . . 5.450 5.210 3.775 5.549 0.099 17 0 "[ . 1 . 2]" 1 2461 2 58 PHE H 2 79 THR H . . 5.500 4.732 3.259 5.230 . 0 0 "[ . 1 . 2]" 1 2462 2 58 PHE HA 2 60 TRP H . . 5.500 5.472 5.213 5.612 0.112 10 0 "[ . 1 . 2]" 1 2463 2 58 PHE HA 2 79 THR H . . 5.500 5.584 5.479 5.672 0.172 18 0 "[ . 1 . 2]" 1 2464 2 58 PHE QB 2 58 PHE HD1 . . 3.180 2.490 2.401 2.672 . 0 0 "[ . 1 . 2]" 1 2465 2 58 PHE QB 2 59 LEU H . . 3.360 2.657 2.485 3.002 . 0 0 "[ . 1 . 2]" 1 2466 2 58 PHE QB 2 79 THR H . . 5.340 2.988 2.769 3.278 . 0 0 "[ . 1 . 2]" 1 2467 2 58 PHE HD1 2 59 LEU H . . 5.400 4.801 4.630 5.532 0.132 12 0 "[ . 1 . 2]" 1 2468 2 59 LEU H 2 59 LEU QD . . 2.660 1.909 1.796 2.032 . 0 0 "[ . 1 . 2]" 1 2469 2 59 LEU H 2 59 LEU HG . . 4.520 4.080 3.991 4.203 . 0 0 "[ . 1 . 2]" 1 2470 2 59 LEU H 2 60 TRP H . . 4.520 2.577 2.391 2.728 . 0 0 "[ . 1 . 2]" 1 2471 2 59 LEU H 2 60 TRP HD1 . . 5.500 5.063 4.905 5.248 . 0 0 "[ . 1 . 2]" 1 2472 2 59 LEU H 2 77 LEU HB2 . . 5.500 5.027 4.852 5.186 . 0 0 "[ . 1 . 2]" 1 2473 2 59 LEU H 2 77 LEU HB3 . . 5.010 4.262 3.937 4.462 . 0 0 "[ . 1 . 2]" 1 2474 2 59 LEU H 2 79 THR H . . 5.220 3.960 3.700 4.299 . 0 0 "[ . 1 . 2]" 1 2475 2 59 LEU H 2 79 THR HA . . 5.500 4.425 4.039 4.803 . 0 0 "[ . 1 . 2]" 1 2476 2 59 LEU HA 2 59 LEU QD . . 3.410 2.112 2.060 2.202 . 0 0 "[ . 1 . 2]" 1 2477 2 59 LEU HA 2 59 LEU HG . . 3.690 3.691 3.655 3.725 0.035 12 0 "[ . 1 . 2]" 1 2478 2 59 LEU HA 2 60 TRP HD1 . . 5.500 3.806 3.553 4.014 . 0 0 "[ . 1 . 2]" 1 2479 2 59 LEU HA 2 77 LEU HB3 . . 5.500 4.873 4.697 5.073 . 0 0 "[ . 1 . 2]" 1 2480 2 59 LEU QB 2 60 TRP HE1 . . 5.250 3.433 3.119 3.679 . 0 0 "[ . 1 . 2]" 1 2481 2 59 LEU QD 2 60 TRP H . . 4.540 3.404 3.186 3.497 . 0 0 "[ . 1 . 2]" 1 2482 2 59 LEU QD 2 60 TRP HA . . 5.440 5.156 5.037 5.248 . 0 0 "[ . 1 . 2]" 1 2483 2 59 LEU QD 2 60 TRP HD1 . . 4.840 4.082 3.935 4.261 . 0 0 "[ . 1 . 2]" 1 2484 2 59 LEU QD 2 77 LEU HB3 . . 4.270 2.152 1.982 2.304 . 0 0 "[ . 1 . 2]" 1 2485 2 59 LEU QD 2 78 PHE HA . . 4.000 2.965 2.856 3.037 . 0 0 "[ . 1 . 2]" 1 2486 2 59 LEU QD 2 78 PHE QB . . 5.280 3.946 3.915 3.975 . 0 0 "[ . 1 . 2]" 1 2487 2 59 LEU QD 2 78 PHE HD2 . . 5.440 5.281 5.008 5.585 0.145 6 0 "[ . 1 . 2]" 1 2488 2 59 LEU QD 2 79 THR H . . 4.280 2.950 2.843 3.068 . 0 0 "[ . 1 . 2]" 1 2489 2 59 LEU QD 2 79 THR HA . . 3.020 2.252 2.110 2.476 . 0 0 "[ . 1 . 2]" 1 2490 2 59 LEU QD 2 79 THR HB . . 4.680 3.464 3.292 3.718 . 0 0 "[ . 1 . 2]" 1 2491 2 59 LEU QD 2 79 THR MG . . 5.180 3.962 3.841 4.081 . 0 0 "[ . 1 . 2]" 1 2492 2 59 LEU QD 2 80 ASP H . . 5.440 4.186 4.043 4.288 . 0 0 "[ . 1 . 2]" 1 2493 2 59 LEU QD 2 80 ASP HA . . 5.050 5.031 4.753 5.186 0.136 13 0 "[ . 1 . 2]" 1 2494 2 59 LEU MD1 2 60 TRP HD1 . . 5.500 4.438 4.255 4.681 . 0 0 "[ . 1 . 2]" 1 2495 2 59 LEU MD1 2 78 PHE HA . . 5.320 5.404 5.316 5.495 0.175 18 0 "[ . 1 . 2]" 1 2496 2 59 LEU MD1 2 79 THR H . . 4.880 5.017 4.971 5.074 0.194 18 0 "[ . 1 . 2]" 1 2497 2 59 LEU MD1 2 79 THR HA . . 3.530 3.663 3.621 3.721 0.191 17 0 "[ . 1 . 2]" 1 2498 2 59 LEU MD1 2 79 THR HB . . 5.350 4.797 4.639 5.001 . 0 0 "[ . 1 . 2]" 1 2499 2 59 LEU MD2 2 60 TRP HD1 . . 5.500 4.771 4.635 4.938 . 0 0 "[ . 1 . 2]" 1 2500 2 59 LEU MD2 2 78 PHE HA . . 5.320 2.979 2.867 3.052 . 0 0 "[ . 1 . 2]" 1 2501 2 59 LEU MD2 2 79 THR H . . 4.880 2.970 2.860 3.094 . 0 0 "[ . 1 . 2]" 1 2502 2 59 LEU MD2 2 79 THR HA . . 3.530 2.273 2.124 2.515 . 0 0 "[ . 1 . 2]" 1 2503 2 59 LEU MD2 2 79 THR HB . . 5.350 3.555 3.365 3.841 . 0 0 "[ . 1 . 2]" 1 2504 2 59 LEU HG 2 77 LEU HA . . 5.500 5.068 4.883 5.286 . 0 0 "[ . 1 . 2]" 1 2505 2 59 LEU HG 2 77 LEU MD2 . . 2.820 2.373 2.065 2.846 0.026 4 0 "[ . 1 . 2]" 1 2506 2 59 LEU HG 2 77 LEU HG . . 5.500 3.956 3.774 4.149 . 0 0 "[ . 1 . 2]" 1 2507 2 59 LEU HG 2 78 PHE H . . 5.090 5.029 4.862 5.156 0.066 20 0 "[ . 1 . 2]" 1 2508 2 60 TRP H 2 60 TRP HB2 . . 4.040 3.980 3.904 4.057 0.017 11 0 "[ . 1 . 2]" 1 2509 2 60 TRP H 2 60 TRP QB . . 3.520 3.429 3.380 3.465 . 0 0 "[ . 1 . 2]" 1 2510 2 60 TRP H 2 60 TRP HB3 . . 4.040 3.744 3.678 3.817 . 0 0 "[ . 1 . 2]" 1 2511 2 60 TRP H 2 60 TRP HE1 . . 5.170 5.088 4.852 5.195 0.025 11 0 "[ . 1 . 2]" 1 2512 2 60 TRP H 2 61 LYS H . . 4.490 4.341 4.284 4.411 . 0 0 "[ . 1 . 2]" 1 2513 2 60 TRP H 2 77 LEU H . . 5.420 4.011 3.616 4.304 . 0 0 "[ . 1 . 2]" 1 2514 2 60 TRP H 2 77 LEU HB2 . . 5.230 3.659 3.482 3.931 . 0 0 "[ . 1 . 2]" 1 2515 2 60 TRP H 2 77 LEU HB3 . . 3.920 3.875 3.561 4.261 0.341 17 0 "[ . 1 . 2]" 1 2516 2 60 TRP H 2 78 PHE H . . 5.500 5.569 5.397 5.637 0.137 4 0 "[ . 1 . 2]" 1 2517 2 60 TRP QB 2 61 LYS H . . 2.920 1.894 1.776 2.066 . 0 0 "[ . 1 . 2]" 1 2518 2 60 TRP HB2 2 61 LYS H . . 3.360 1.907 1.786 2.090 . 0 0 "[ . 1 . 2]" 1 2519 2 60 TRP HB3 2 61 LYS H . . 3.360 3.254 3.007 3.387 0.027 11 0 "[ . 1 . 2]" 1 2520 2 60 TRP HD1 2 77 LEU HB3 . . 5.500 4.094 3.841 4.389 . 0 0 "[ . 1 . 2]" 1 2521 2 60 TRP HD1 2 77 LEU MD1 . . 5.500 4.472 4.265 5.062 . 0 0 "[ . 1 . 2]" 1 2522 2 60 TRP HD1 2 77 LEU MD2 . . 5.500 3.337 3.077 3.723 . 0 0 "[ . 1 . 2]" 1 2523 2 60 TRP HE1 2 77 LEU HB2 . . 5.500 2.454 2.217 2.687 . 0 0 "[ . 1 . 2]" 1 2524 2 60 TRP HE1 2 77 LEU HB3 . . 5.500 3.795 3.543 3.972 . 0 0 "[ . 1 . 2]" 1 2525 2 60 TRP HE1 2 77 LEU MD2 . . 2.540 1.786 1.684 1.902 . 0 0 "[ . 1 . 2]" 1 2526 2 60 TRP HE3 2 77 LEU MD1 . . 5.500 5.394 5.162 5.528 0.028 17 0 "[ . 1 . 2]" 1 2527 2 60 TRP HZ2 2 77 LEU MD1 . . 3.160 1.934 1.767 2.063 . 0 0 "[ . 1 . 2]" 1 2528 2 60 TRP HZ3 2 77 LEU H . . 4.300 4.357 4.282 4.445 0.145 17 0 "[ . 1 . 2]" 1 2529 2 61 LYS H 2 61 LYS QB . . 3.560 2.554 2.298 2.820 . 0 0 "[ . 1 . 2]" 1 2530 2 61 LYS H 2 61 LYS QD . . 5.340 4.296 2.511 5.005 . 0 0 "[ . 1 . 2]" 1 2531 2 61 LYS H 2 62 VAL H . . 4.670 4.370 4.299 4.457 . 0 0 "[ . 1 . 2]" 1 2532 2 61 LYS H 2 63 TRP HD1 . . 5.180 4.298 3.640 4.885 . 0 0 "[ . 1 . 2]" 1 2533 2 61 LYS H 2 63 TRP HE1 . . 5.500 5.314 4.437 5.651 0.151 16 0 "[ . 1 . 2]" 1 2534 2 61 LYS QG 2 62 VAL H . . 4.930 2.995 1.756 4.096 . 0 0 "[ . 1 . 2]" 1 2535 2 62 VAL H 2 62 VAL QG . . 3.150 1.998 1.864 2.162 . 0 0 "[ . 1 . 2]" 1 2536 2 62 VAL H 2 63 TRP H . . 5.500 4.402 4.212 4.484 . 0 0 "[ . 1 . 2]" 1 2537 2 62 VAL H 2 63 TRP HD1 . . 5.500 4.934 4.696 5.419 . 0 0 "[ . 1 . 2]" 1 2538 2 62 VAL HA 2 62 VAL QG . . 2.710 2.314 2.250 2.388 . 0 0 "[ . 1 . 2]" 1 2539 2 62 VAL HA 2 63 TRP H . . 2.960 2.075 2.022 2.130 . 0 0 "[ . 1 . 2]" 1 2540 2 62 VAL HA 2 63 TRP HD1 . . 4.250 3.208 2.753 3.786 . 0 0 "[ . 1 . 2]" 1 2541 2 62 VAL HA 2 64 THR H . . 5.500 4.729 4.182 5.168 . 0 0 "[ . 1 . 2]" 1 2542 2 62 VAL HB 2 75 ILE HA . . 5.500 5.136 4.400 5.567 0.067 7 0 "[ . 1 . 2]" 1 2543 2 62 VAL HB 2 76 TYR QD . . 4.770 2.109 1.944 2.309 . 0 0 "[ . 1 . 2]" 1 2544 2 62 VAL QG 2 63 TRP H . . 3.020 2.549 2.233 3.032 0.012 18 0 "[ . 1 . 2]" 1 2545 2 62 VAL QG 2 63 TRP HA . . 3.630 3.453 3.323 3.646 0.016 10 0 "[ . 1 . 2]" 1 2546 2 62 VAL QG 2 64 THR H . . 5.440 2.552 2.096 3.006 . 0 0 "[ . 1 . 2]" 1 2547 2 62 VAL QG 2 64 THR HB . . 3.750 2.533 2.295 2.722 . 0 0 "[ . 1 . 2]" 1 2548 2 62 VAL QG 2 73 GLY HA3 . . 5.440 3.065 2.819 3.371 . 0 0 "[ . 1 . 2]" 1 2549 2 62 VAL QG 2 74 GLY H . . 4.530 1.867 1.734 2.336 . 0 0 "[ . 1 . 2]" 1 2550 2 62 VAL QG 2 75 ILE H . . 5.080 2.995 2.073 3.886 . 0 0 "[ . 1 . 2]" 1 2551 2 62 VAL QG 2 76 TYR QD . . 3.620 2.700 1.947 3.018 . 0 0 "[ . 1 . 2]" 1 2552 2 62 VAL QG 2 76 TYR QE . . 4.180 2.845 2.584 2.992 . 0 0 "[ . 1 . 2]" 1 2553 2 63 TRP H 2 64 THR H . . 4.180 3.523 3.190 3.859 . 0 0 "[ . 1 . 2]" 1 2554 2 63 TRP QB 2 63 TRP HE1 . . 4.620 4.459 4.400 4.502 . 0 0 "[ . 1 . 2]" 1 2555 2 63 TRP QB 2 64 THR H . . 4.190 3.886 3.749 3.997 . 0 0 "[ . 1 . 2]" 1 2556 2 64 THR H 2 65 GLU H . . 4.590 4.273 4.185 4.356 . 0 0 "[ . 1 . 2]" 1 2557 2 64 THR H 2 72 ALA MB . . 5.500 5.153 4.840 5.517 0.017 20 0 "[ . 1 . 2]" 1 2558 2 64 THR H 2 73 GLY H . . 4.680 4.616 4.342 4.766 0.086 5 0 "[ . 1 . 2]" 1 2559 2 64 THR H 2 73 GLY HA3 . . 5.500 5.630 5.579 5.698 0.198 7 0 "[ . 1 . 2]" 1 2560 2 64 THR HA 2 65 GLU H . . 3.050 2.177 2.115 2.263 . 0 0 "[ . 1 . 2]" 1 2561 2 64 THR HA 2 73 GLY HA2 . . 5.500 5.337 5.155 5.548 0.048 17 0 "[ . 1 . 2]" 1 2562 2 64 THR HB 2 65 GLU H . . 4.200 3.945 3.702 4.127 . 0 0 "[ . 1 . 2]" 1 2563 2 64 THR HB 2 72 ALA MB . . 4.750 4.812 4.653 4.913 0.163 7 0 "[ . 1 . 2]" 1 2564 2 64 THR HB 2 73 GLY HA2 . . 5.500 2.545 2.233 3.003 . 0 0 "[ . 1 . 2]" 1 2565 2 64 THR HB 2 73 GLY HA3 . . 4.650 3.935 3.716 4.187 . 0 0 "[ . 1 . 2]" 1 2566 2 64 THR MG 2 65 GLU H . . 2.840 2.316 1.906 2.522 . 0 0 "[ . 1 . 2]" 1 2567 2 64 THR MG 2 66 SER H . . 4.530 3.736 3.368 4.152 . 0 0 "[ . 1 . 2]" 1 2568 2 64 THR MG 2 72 ALA HA . . 3.200 3.163 2.728 3.374 0.174 4 0 "[ . 1 . 2]" 1 2569 2 64 THR MG 2 73 GLY H . . 5.000 2.286 2.049 2.557 . 0 0 "[ . 1 . 2]" 1 2570 2 65 GLU H 2 65 GLU QB . . 3.360 2.825 2.613 2.937 . 0 0 "[ . 1 . 2]" 1 2571 2 65 GLU H 2 65 GLU QG . . 5.040 4.167 4.069 4.247 . 0 0 "[ . 1 . 2]" 1 2572 2 65 GLU H 2 66 SER HA . . 5.500 4.373 3.832 4.638 . 0 0 "[ . 1 . 2]" 1 2573 2 65 GLU H 2 72 ALA MB . . 5.490 4.838 4.439 5.215 . 0 0 "[ . 1 . 2]" 1 2574 2 65 GLU H 2 73 GLY H . . 5.200 4.369 4.076 4.649 . 0 0 "[ . 1 . 2]" 1 2575 2 65 GLU HA 2 65 GLU HG2 . . 4.030 2.965 2.787 3.100 . 0 0 "[ . 1 . 2]" 1 2576 2 65 GLU HA 2 65 GLU QG . . 3.200 2.448 2.350 2.558 . 0 0 "[ . 1 . 2]" 1 2577 2 65 GLU HA 2 65 GLU HG3 . . 4.030 2.612 2.458 2.783 . 0 0 "[ . 1 . 2]" 1 2578 2 65 GLU HA 2 66 SER H . . 2.910 2.178 2.117 2.282 . 0 0 "[ . 1 . 2]" 1 2579 2 65 GLU HA 2 72 ALA MB . . 2.930 2.569 2.157 2.968 0.038 3 0 "[ . 1 . 2]" 1 2580 2 65 GLU HA 2 73 GLY H . . 5.180 3.448 3.167 3.671 . 0 0 "[ . 1 . 2]" 1 2581 2 65 GLU QG 2 66 SER H . . 3.190 2.982 2.484 3.330 0.140 17 0 "[ . 1 . 2]" 1 2582 2 65 GLU QG 2 67 GLU H . . 5.340 3.672 3.147 4.433 . 0 0 "[ . 1 . 2]" 1 2583 2 65 GLU QG 2 72 ALA MB . . 4.790 2.742 2.331 3.152 . 0 0 "[ . 1 . 2]" 1 2584 2 65 GLU QG 2 73 GLY H . . 5.340 5.319 5.126 5.427 0.087 8 0 "[ . 1 . 2]" 1 2585 2 66 SER H 2 66 SER HB2 . . 3.860 3.075 2.542 3.843 . 0 0 "[ . 1 . 2]" 1 2586 2 66 SER H 2 66 SER QB . . 3.350 2.723 2.416 3.244 . 0 0 "[ . 1 . 2]" 1 2587 2 66 SER H 2 66 SER HB3 . . 3.860 3.321 2.602 3.898 0.038 1 0 "[ . 1 . 2]" 1 2588 2 66 SER H 2 67 GLU H . . 4.010 3.885 3.545 4.172 0.162 17 0 "[ . 1 . 2]" 1 2589 2 66 SER H 2 68 LYS H . . 5.500 5.545 5.387 5.737 0.237 17 0 "[ . 1 . 2]" 1 2590 2 66 SER H 2 69 ASN H . . 5.500 5.167 4.977 5.337 . 0 0 "[ . 1 . 2]" 1 2591 2 66 SER H 2 69 ASN QB . . 5.500 4.572 4.180 5.283 . 0 0 "[ . 1 . 2]" 1 2592 2 66 SER H 2 70 HIS H . . 5.270 5.108 4.830 5.300 0.030 5 0 "[ . 1 . 2]" 1 2593 2 66 SER H 2 71 GLU H . . 3.720 3.679 3.299 3.852 0.132 2 0 "[ . 1 . 2]" 1 2594 2 66 SER H 2 72 ALA MB . . 4.620 3.190 2.730 3.688 . 0 0 "[ . 1 . 2]" 1 2595 2 66 SER H 2 73 GLY H . . 5.500 4.295 3.687 4.730 . 0 0 "[ . 1 . 2]" 1 2596 2 66 SER HA 2 67 GLU H . . 2.830 2.139 2.008 2.268 . 0 0 "[ . 1 . 2]" 1 2597 2 66 SER HA 2 68 LYS H . . 3.650 3.544 3.334 3.746 0.096 9 0 "[ . 1 . 2]" 1 2598 2 66 SER HA 2 68 LYS QE . . 5.340 4.040 2.797 5.129 . 0 0 "[ . 1 . 2]" 1 2599 2 66 SER HA 2 71 GLU H . . 5.500 4.992 4.749 5.261 . 0 0 "[ . 1 . 2]" 1 2600 2 66 SER QB 2 67 GLU H . . 4.020 3.705 3.266 4.000 . 0 0 "[ . 1 . 2]" 1 2601 2 66 SER QB 2 68 LYS QD . . 3.650 3.051 2.214 3.769 0.119 14 0 "[ . 1 . 2]" 1 2602 2 66 SER QB 2 71 GLU H . . 4.690 3.174 2.650 4.460 . 0 0 "[ . 1 . 2]" 1 2603 2 67 GLU H 2 67 GLU QB . . 3.540 2.635 2.533 2.831 . 0 0 "[ . 1 . 2]" 1 2604 2 67 GLU H 2 67 GLU QG . . 2.920 2.298 1.765 3.032 0.112 11 0 "[ . 1 . 2]" 1 2605 2 67 GLU H 2 68 LYS H . . 3.070 2.476 2.369 2.607 . 0 0 "[ . 1 . 2]" 1 2606 2 67 GLU H 2 68 LYS QD . . 3.060 2.906 2.619 3.099 0.039 17 0 "[ . 1 . 2]" 1 2607 2 67 GLU H 2 68 LYS HE2 . . 5.500 5.013 4.155 5.592 0.092 16 0 "[ . 1 . 2]" 1 2608 2 67 GLU H 2 68 LYS HE3 . . 5.500 4.830 3.803 5.737 0.237 14 0 "[ . 1 . 2]" 1 2609 2 67 GLU H 2 68 LYS QG . . 4.630 4.827 4.561 5.117 0.487 6 0 "[ . 1 . 2]" 1 2610 2 67 GLU H 2 69 ASN H . . 4.290 3.981 3.684 4.193 . 0 0 "[ . 1 . 2]" 1 2611 2 67 GLU H 2 71 GLU H . . 5.470 5.163 4.853 5.375 . 0 0 "[ . 1 . 2]" 1 2612 2 67 GLU HA 2 67 GLU QB . . 2.420 2.176 2.143 2.192 . 0 0 "[ . 1 . 2]" 1 2613 2 67 GLU HA 2 67 GLU QG . . 3.680 3.418 3.329 3.562 . 0 0 "[ . 1 . 2]" 1 2614 2 67 GLU HA 2 70 HIS H . . 3.280 3.224 3.006 3.384 0.104 18 0 "[ . 1 . 2]" 1 2615 2 67 GLU HA 2 70 HIS HD2 . . 5.500 5.410 4.942 5.576 0.076 14 0 "[ . 1 . 2]" 1 2616 2 67 GLU HA 2 71 GLU H . . 5.160 4.037 3.600 4.447 . 0 0 "[ . 1 . 2]" 1 2617 2 67 GLU QB 2 68 LYS H . . 4.120 3.491 3.358 3.614 . 0 0 "[ . 1 . 2]" 1 2618 2 67 GLU QB 2 68 LYS QD . . 5.180 4.379 4.098 4.655 . 0 0 "[ . 1 . 2]" 1 2619 2 67 GLU QB 2 70 HIS H . . 5.340 4.676 4.482 4.805 . 0 0 "[ . 1 . 2]" 1 2620 2 67 GLU QG 2 68 LYS H . . 2.770 2.360 1.906 2.958 0.188 2 0 "[ . 1 . 2]" 1 2621 2 67 GLU QG 2 68 LYS HA . . 4.470 3.618 3.299 5.031 0.561 2 1 "[ + . 1 . 2]" 1 2622 2 67 GLU QG 2 68 LYS QB . . 5.050 3.308 2.866 4.604 . 0 0 "[ . 1 . 2]" 1 2623 2 67 GLU QG 2 68 LYS QD . . 3.160 2.934 2.440 3.302 0.142 2 0 "[ . 1 . 2]" 1 2624 2 68 LYS H 2 68 LYS QD . . 2.390 1.708 1.567 1.886 . 0 0 "[ . 1 . 2]" 1 2625 2 68 LYS H 2 68 LYS QG . . 2.700 3.028 2.765 3.298 0.598 11 2 "[ . 1+- . 2]" 1 2626 2 68 LYS H 2 69 ASN H . . 3.030 2.549 2.195 2.865 . 0 0 "[ . 1 . 2]" 1 2627 2 68 LYS H 2 70 HIS HA . . 5.500 5.403 5.264 5.648 0.148 18 0 "[ . 1 . 2]" 1 2628 2 68 LYS HA 2 68 LYS QG . . 3.660 3.553 3.491 3.603 . 0 0 "[ . 1 . 2]" 1 2629 2 68 LYS HA 2 70 HIS HD2 . . 5.500 3.722 3.260 4.422 . 0 0 "[ . 1 . 2]" 1 2630 2 68 LYS QB 2 68 LYS QE . . 4.120 2.904 1.951 3.889 . 0 0 "[ . 1 . 2]" 1 2631 2 68 LYS QB 2 68 LYS QG . . 2.310 2.006 1.990 2.018 . 0 0 "[ . 1 . 2]" 1 2632 2 68 LYS QB 2 70 HIS H . . 5.340 4.930 4.770 5.253 . 0 0 "[ . 1 . 2]" 1 2633 2 68 LYS QD 2 68 LYS QE . . 2.250 2.055 1.997 2.101 . 0 0 "[ . 1 . 2]" 1 2634 2 68 LYS QD 2 70 HIS H . . 5.340 4.559 4.103 4.981 . 0 0 "[ . 1 . 2]" 1 2635 2 68 LYS QG 2 69 ASN H . . 2.640 2.783 2.215 3.357 0.717 11 2 "[ - 1+ . 2]" 1 2636 2 68 LYS QG 2 70 HIS H . . 4.100 4.690 4.279 5.065 0.965 11 15 "[* -*** **+* ******2]" 1 2637 2 69 ASN H 2 69 ASN QB . . 2.630 2.324 2.242 2.447 . 0 0 "[ . 1 . 2]" 1 2638 2 69 ASN H 2 70 HIS HD2 . . 5.040 4.159 3.814 4.379 . 0 0 "[ . 1 . 2]" 1 2639 2 69 ASN H 2 71 GLU H . . 4.400 3.742 3.433 4.025 . 0 0 "[ . 1 . 2]" 1 2640 2 69 ASN HA 2 70 HIS HD2 . . 4.770 3.477 3.170 3.806 . 0 0 "[ . 1 . 2]" 1 2641 2 69 ASN HA 2 71 GLU H . . 5.500 4.836 4.589 5.145 . 0 0 "[ . 1 . 2]" 1 2642 2 69 ASN HA 2 71 GLU QB . . 5.500 4.692 4.400 5.009 . 0 0 "[ . 1 . 2]" 1 2643 2 69 ASN QB 2 70 HIS H . . 3.630 3.014 2.743 3.300 . 0 0 "[ . 1 . 2]" 1 2644 2 69 ASN QB 2 70 HIS HB2 . . 5.500 5.051 4.907 5.132 . 0 0 "[ . 1 . 2]" 1 2645 2 69 ASN QB 2 70 HIS HD2 . . 5.270 4.883 4.820 4.973 . 0 0 "[ . 1 . 2]" 1 2646 2 69 ASN QB 2 71 GLU H . . 4.170 2.973 2.596 3.183 . 0 0 "[ . 1 . 2]" 1 2647 2 70 HIS H 2 70 HIS HA . . 2.740 2.258 2.239 2.282 . 0 0 "[ . 1 . 2]" 1 2648 2 70 HIS H 2 71 GLU H . . 2.770 2.514 2.355 2.596 . 0 0 "[ . 1 . 2]" 1 2649 2 70 HIS H 2 71 GLU HA . . 5.500 5.166 5.052 5.214 . 0 0 "[ . 1 . 2]" 1 2650 2 70 HIS H 2 71 GLU QB . . 5.500 4.208 3.917 4.440 . 0 0 "[ . 1 . 2]" 1 2651 2 70 HIS HA 2 70 HIS HD2 . . 4.960 3.826 3.426 4.024 . 0 0 "[ . 1 . 2]" 1 2652 2 70 HIS HA 2 71 GLU H . . 3.170 2.681 2.458 2.831 . 0 0 "[ . 1 . 2]" 1 2653 2 70 HIS HA 2 72 ALA MB . . 5.500 5.510 5.365 5.600 0.100 11 0 "[ . 1 . 2]" 1 2654 2 70 HIS HB2 2 71 GLU H . . 5.340 4.256 4.162 4.387 . 0 0 "[ . 1 . 2]" 1 2655 2 70 HIS HB3 2 71 GLU H . . 5.060 4.405 4.324 4.435 . 0 0 "[ . 1 . 2]" 1 2656 2 71 GLU H 2 72 ALA H . . 4.440 4.292 4.201 4.376 . 0 0 "[ . 1 . 2]" 1 2657 2 71 GLU HA 2 71 GLU QG . . 3.220 2.488 2.359 2.656 . 0 0 "[ . 1 . 2]" 1 2658 2 71 GLU HA 2 72 ALA MB . . 5.500 3.884 3.779 4.036 . 0 0 "[ . 1 . 2]" 1 2659 2 71 GLU QB 2 72 ALA H . . 4.930 3.538 3.314 3.672 . 0 0 "[ . 1 . 2]" 1 2660 2 71 GLU QG 2 72 ALA H . . 4.380 2.422 2.130 2.615 . 0 0 "[ . 1 . 2]" 1 2661 2 71 GLU QG 2 72 ALA HA . . 4.880 3.734 3.135 4.418 . 0 0 "[ . 1 . 2]" 1 2662 2 71 GLU QG 2 73 GLY H . . 3.680 4.005 3.068 4.698 1.018 3 9 "[ *+*.* ** *.* -]" 1 2663 2 72 ALA H 2 72 ALA MB . . 2.880 2.637 2.581 2.684 . 0 0 "[ . 1 . 2]" 1 2664 2 72 ALA H 2 73 GLY H . . 4.370 3.946 3.629 4.169 . 0 0 "[ . 1 . 2]" 1 2665 2 72 ALA H 2 73 GLY HA2 . . 5.500 5.504 5.295 5.605 0.105 2 0 "[ . 1 . 2]" 1 2666 2 72 ALA MB 2 73 GLY H . . 4.060 3.191 2.968 3.440 . 0 0 "[ . 1 . 2]" 1 2667 2 72 ALA MB 2 73 GLY HA2 . . 4.500 4.104 3.932 4.241 . 0 0 "[ . 1 . 2]" 1 2668 2 72 ALA MB 2 73 GLY HA3 . . 5.000 4.210 4.132 4.363 . 0 0 "[ . 1 . 2]" 1 2669 2 73 GLY H 2 74 GLY H . . 4.850 4.263 4.066 4.411 . 0 0 "[ . 1 . 2]" 1 2670 2 73 GLY HA2 2 74 GLY H . . 3.310 2.517 2.257 2.769 . 0 0 "[ . 1 . 2]" 1 2671 2 73 GLY HA3 2 74 GLY H . . 2.940 2.611 2.408 2.876 . 0 0 "[ . 1 . 2]" 1 2672 2 74 GLY QA 2 75 ILE QG . . 3.690 3.026 2.878 3.163 . 0 0 "[ . 1 . 2]" 1 2673 2 75 ILE H 2 75 ILE HB . . 3.130 2.845 2.794 2.908 . 0 0 "[ . 1 . 2]" 1 2674 2 75 ILE H 2 75 ILE QG . . 3.520 2.617 2.438 3.010 . 0 0 "[ . 1 . 2]" 1 2675 2 75 ILE H 2 75 ILE MG . . 4.080 3.929 3.908 3.956 . 0 0 "[ . 1 . 2]" 1 2676 2 75 ILE H 2 76 TYR H . . 4.450 4.277 4.168 4.354 . 0 0 "[ . 1 . 2]" 1 2677 2 75 ILE H 2 76 TYR QB . . 5.340 4.258 4.045 4.416 . 0 0 "[ . 1 . 2]" 1 2678 2 75 ILE HA 2 75 ILE MD . . 3.600 2.610 2.353 3.786 0.186 10 0 "[ . 1 . 2]" 1 2679 2 75 ILE HA 2 75 ILE MG . . 3.710 2.332 2.277 2.437 . 0 0 "[ . 1 . 2]" 1 2680 2 75 ILE HA 2 76 TYR QD . . 4.330 3.754 3.469 4.068 . 0 0 "[ . 1 . 2]" 1 2681 2 75 ILE HA 2 76 TYR QE . . 5.500 5.365 5.070 5.533 0.033 8 0 "[ . 1 . 2]" 1 2682 2 75 ILE HB 2 75 ILE MD . . 3.340 3.151 2.515 3.271 . 0 0 "[ . 1 . 2]" 1 2683 2 75 ILE HB 2 76 TYR H . . 4.260 3.967 3.737 4.133 . 0 0 "[ . 1 . 2]" 1 2684 2 75 ILE MD 2 75 ILE MG . . 2.400 1.991 1.870 2.130 . 0 0 "[ . 1 . 2]" 1 2685 2 75 ILE MG 2 76 TYR H . . 3.800 2.694 2.457 2.995 . 0 0 "[ . 1 . 2]" 1 2686 2 75 ILE MG 2 77 LEU HA . . 5.500 5.230 4.957 5.453 . 0 0 "[ . 1 . 2]" 1 2687 2 76 TYR H 2 76 TYR QB . . 3.660 3.228 3.149 3.325 . 0 0 "[ . 1 . 2]" 1 2688 2 76 TYR H 2 76 TYR QD . . 5.490 3.122 2.953 3.421 . 0 0 "[ . 1 . 2]" 1 2689 2 76 TYR HA 2 77 LEU H . . 2.630 2.490 2.367 2.610 . 0 0 "[ . 1 . 2]" 1 2690 2 76 TYR QB 2 77 LEU H . . 2.570 2.141 2.004 2.292 . 0 0 "[ . 1 . 2]" 1 2691 2 77 LEU H 2 78 PHE H . . 4.680 4.436 4.386 4.548 . 0 0 "[ . 1 . 2]" 1 2692 2 77 LEU HA 2 77 LEU HG . . 4.270 2.543 2.463 2.623 . 0 0 "[ . 1 . 2]" 1 2693 2 77 LEU HB2 2 78 PHE H . . 4.560 4.284 4.214 4.338 . 0 0 "[ . 1 . 2]" 1 2694 2 77 LEU HB3 2 77 LEU MD2 . . 3.300 2.334 2.266 2.410 . 0 0 "[ . 1 . 2]" 1 2695 2 77 LEU HB3 2 78 PHE H . . 4.190 3.253 3.071 3.378 . 0 0 "[ . 1 . 2]" 1 2696 2 77 LEU HG 2 78 PHE H . . 5.500 3.603 3.345 3.785 . 0 0 "[ . 1 . 2]" 1 2697 2 78 PHE H 2 79 THR H . . 4.690 4.344 4.287 4.385 . 0 0 "[ . 1 . 2]" 1 2698 2 78 PHE H 2 80 ASP H . . 4.380 4.480 4.223 4.608 0.228 9 0 "[ . 1 . 2]" 1 2699 2 78 PHE HA 2 78 PHE HD2 . . 4.610 4.104 3.865 4.484 . 0 0 "[ . 1 . 2]" 1 2700 2 78 PHE HA 2 79 THR H . . 2.870 2.184 2.151 2.248 . 0 0 "[ . 1 . 2]" 1 2701 2 78 PHE HA 2 79 THR MG . . 4.380 3.635 3.545 3.810 . 0 0 "[ . 1 . 2]" 1 2702 2 78 PHE HA 2 80 ASP H . . 4.010 4.031 3.859 4.130 0.120 5 0 "[ . 1 . 2]" 1 2703 2 78 PHE HA 2 84 ALA MB . . 5.500 5.215 5.125 5.285 . 0 0 "[ . 1 . 2]" 1 2704 2 78 PHE QB 2 78 PHE HD2 . . 2.680 2.311 2.284 2.381 . 0 0 "[ . 1 . 2]" 1 2705 2 78 PHE QB 2 79 THR MG . . 4.420 3.614 3.480 3.765 . 0 0 "[ . 1 . 2]" 1 2706 2 78 PHE QB 2 80 ASP HA . . 5.340 4.403 4.103 4.666 . 0 0 "[ . 1 . 2]" 1 2707 2 78 PHE QB 2 81 GLU H . . 5.340 5.224 5.066 5.359 0.019 5 0 "[ . 1 . 2]" 1 2708 2 78 PHE QB 2 84 ALA MB . . 2.900 2.738 2.635 2.894 . 0 0 "[ . 1 . 2]" 1 2709 2 78 PHE HB2 2 78 PHE HD2 . . 3.540 3.530 3.338 3.636 0.096 18 0 "[ . 1 . 2]" 1 2710 2 78 PHE HB2 2 84 ALA MB . . 3.400 3.342 3.278 3.398 . 0 0 "[ . 1 . 2]" 1 2711 2 78 PHE HB3 2 78 PHE HD2 . . 3.540 2.343 2.314 2.413 . 0 0 "[ . 1 . 2]" 1 2712 2 78 PHE HB3 2 84 ALA MB . . 3.400 2.911 2.761 3.135 . 0 0 "[ . 1 . 2]" 1 2713 2 78 PHE HD2 2 79 THR MG . . 5.500 2.555 2.261 3.213 . 0 0 "[ . 1 . 2]" 1 2714 2 78 PHE HD2 2 80 ASP HA . . 5.500 4.545 4.315 4.796 . 0 0 "[ . 1 . 2]" 1 2715 2 78 PHE HD2 2 81 GLU HA . . 5.500 4.513 3.788 4.865 . 0 0 "[ . 1 . 2]" 1 2716 2 78 PHE HD2 2 83 SER HA . . 5.500 5.578 5.345 5.705 0.205 11 0 "[ . 1 . 2]" 1 2717 2 78 PHE HD2 2 83 SER QB . . 5.340 3.086 2.737 4.436 . 0 0 "[ . 1 . 2]" 1 2718 2 78 PHE HD2 2 84 ALA HA . . 5.500 3.153 2.661 3.412 . 0 0 "[ . 1 . 2]" 1 2719 2 78 PHE HD2 2 84 ALA MB . . 3.030 2.731 2.158 3.209 0.179 9 0 "[ . 1 . 2]" 1 2720 2 79 THR H 2 79 THR HA . . 2.900 2.705 2.672 2.749 . 0 0 "[ . 1 . 2]" 1 2721 2 79 THR H 2 79 THR HB . . 2.820 2.469 2.334 2.584 . 0 0 "[ . 1 . 2]" 1 2722 2 79 THR H 2 79 THR MG . . 2.720 1.955 1.871 2.037 . 0 0 "[ . 1 . 2]" 1 2723 2 79 THR H 2 80 ASP H . . 4.630 2.966 2.861 3.037 . 0 0 "[ . 1 . 2]" 1 2724 2 79 THR HB 2 80 ASP H . . 5.000 4.208 4.111 4.353 . 0 0 "[ . 1 . 2]" 1 2725 2 79 THR MG 2 80 ASP H . . 2.870 2.403 2.180 2.665 . 0 0 "[ . 1 . 2]" 1 2726 2 79 THR MG 2 80 ASP HA . . 4.340 4.197 4.043 4.344 0.004 18 0 "[ . 1 . 2]" 1 2727 2 79 THR MG 2 80 ASP QB . . 4.550 3.092 2.358 3.802 . 0 0 "[ . 1 . 2]" 1 2728 2 80 ASP H 2 81 GLU H . . 5.500 4.293 4.246 4.350 . 0 0 "[ . 1 . 2]" 1 2729 2 80 ASP H 2 84 ALA MB . . 5.180 3.881 3.623 4.019 . 0 0 "[ . 1 . 2]" 1 2730 2 80 ASP HA 2 80 ASP QB . . 2.540 2.316 2.168 2.494 . 0 0 "[ . 1 . 2]" 1 2731 2 80 ASP HA 2 81 GLU H . . 2.690 2.492 2.328 2.643 . 0 0 "[ . 1 . 2]" 1 2732 2 80 ASP HA 2 81 GLU QG . . 3.830 3.328 3.108 3.453 . 0 0 "[ . 1 . 2]" 1 2733 2 80 ASP HA 2 84 ALA H . . 5.500 5.444 5.259 5.640 0.140 6 0 "[ . 1 . 2]" 1 2734 2 80 ASP QB 2 81 GLU H . . 2.610 2.246 1.812 2.989 0.379 11 0 "[ . 1 . 2]" 1 2735 2 80 ASP QB 2 81 GLU HA . . 4.570 4.290 3.940 4.534 . 0 0 "[ . 1 . 2]" 1 2736 2 80 ASP QB 2 82 LYS H . . 3.300 2.951 2.534 3.625 0.325 13 0 "[ . 1 . 2]" 1 2737 2 80 ASP QB 2 82 LYS HA . . 5.340 5.184 4.609 5.613 0.273 11 0 "[ . 1 . 2]" 1 2738 2 80 ASP QB 2 83 SER H . . 5.340 2.834 1.965 3.691 . 0 0 "[ . 1 . 2]" 1 2739 2 81 GLU H 2 81 GLU QB . . 3.410 2.941 2.701 3.150 . 0 0 "[ . 1 . 2]" 1 2740 2 81 GLU H 2 81 GLU QG . . 2.480 1.966 1.798 2.312 . 0 0 "[ . 1 . 2]" 1 2741 2 81 GLU H 2 82 LYS H . . 2.600 2.161 1.954 2.304 . 0 0 "[ . 1 . 2]" 1 2742 2 81 GLU H 2 82 LYS QG . . 4.400 3.080 2.897 3.287 . 0 0 "[ . 1 . 2]" 1 2743 2 81 GLU H 2 83 SER H . . 4.150 3.665 3.194 4.060 . 0 0 "[ . 1 . 2]" 1 2744 2 81 GLU H 2 84 ALA H . . 5.500 4.324 3.851 4.563 . 0 0 "[ . 1 . 2]" 1 2745 2 81 GLU H 2 107 VAL MG2 . . 4.950 4.666 4.477 4.989 0.039 7 0 "[ . 1 . 2]" 1 2746 2 81 GLU HA 2 81 GLU QB . . 2.570 2.172 2.128 2.236 . 0 0 "[ . 1 . 2]" 1 2747 2 81 GLU HA 2 84 ALA H . . 4.840 3.316 3.178 3.429 . 0 0 "[ . 1 . 2]" 1 2748 2 81 GLU HA 2 84 ALA MB . . 3.120 2.298 2.089 2.420 . 0 0 "[ . 1 . 2]" 1 2749 2 81 GLU HA 2 107 VAL HA . . 5.500 5.510 5.096 5.640 0.140 15 0 "[ . 1 . 2]" 1 2750 2 81 GLU HA 2 107 VAL MG1 . . 5.500 3.065 2.509 3.333 . 0 0 "[ . 1 . 2]" 1 2751 2 81 GLU HA 2 107 VAL MG2 . . 5.080 2.238 1.963 2.589 . 0 0 "[ . 1 . 2]" 1 2752 2 81 GLU QB 2 82 LYS H . . 3.470 2.888 2.255 3.469 . 0 0 "[ . 1 . 2]" 1 2753 2 81 GLU QB 2 84 ALA MB . . 3.740 3.661 3.470 3.806 0.066 12 0 "[ . 1 . 2]" 1 2754 2 81 GLU QB 2 107 VAL HA . . 5.030 4.999 4.746 5.089 0.059 5 0 "[ . 1 . 2]" 1 2755 2 81 GLU QB 2 107 VAL HB . . 4.190 3.305 2.788 3.744 . 0 0 "[ . 1 . 2]" 1 2756 2 81 GLU QB 2 107 VAL MG2 . . 3.790 2.421 2.151 2.913 . 0 0 "[ . 1 . 2]" 1 2757 2 81 GLU HB2 2 84 ALA MB . . 4.300 4.279 3.904 4.505 0.205 8 0 "[ . 1 . 2]" 1 2758 2 81 GLU HB2 2 107 VAL MG1 . . 5.500 2.963 2.380 3.648 . 0 0 "[ . 1 . 2]" 1 2759 2 81 GLU HB3 2 84 ALA MB . . 4.300 3.990 3.783 4.173 . 0 0 "[ . 1 . 2]" 1 2760 2 81 GLU HB3 2 107 VAL MG1 . . 5.500 1.884 1.705 2.175 . 0 0 "[ . 1 . 2]" 1 2761 2 81 GLU QG 2 82 LYS H . . 3.800 3.195 2.357 3.427 . 0 0 "[ . 1 . 2]" 1 2762 2 81 GLU QG 2 82 LYS QG . . 5.340 4.049 3.263 4.199 . 0 0 "[ . 1 . 2]" 1 2763 2 81 GLU QG 2 107 VAL MG1 . . 3.760 3.061 2.067 3.660 . 0 0 "[ . 1 . 2]" 1 2764 2 82 LYS H 2 82 LYS HA . . 2.850 2.800 2.758 2.883 0.033 13 0 "[ . 1 . 2]" 1 2765 2 82 LYS H 2 82 LYS QG . . 3.100 1.805 1.690 1.941 . 0 0 "[ . 1 . 2]" 1 2766 2 82 LYS H 2 83 SER H . . 3.920 2.640 2.231 2.839 . 0 0 "[ . 1 . 2]" 1 2767 2 82 LYS H 2 84 ALA H . . 4.100 3.817 3.423 4.075 . 0 0 "[ . 1 . 2]" 1 2768 2 82 LYS HA 2 82 LYS HB2 . . 2.870 2.512 2.456 2.551 . 0 0 "[ . 1 . 2]" 1 2769 2 82 LYS HA 2 82 LYS QB . . 2.490 2.159 2.142 2.174 . 0 0 "[ . 1 . 2]" 1 2770 2 82 LYS HA 2 82 LYS HB3 . . 2.870 2.355 2.311 2.386 . 0 0 "[ . 1 . 2]" 1 2771 2 82 LYS HA 2 82 LYS HE2 . . 5.500 5.765 5.668 5.837 0.337 9 0 "[ . 1 . 2]" 1 2772 2 82 LYS HA 2 82 LYS HE3 . . 5.500 5.750 5.659 5.805 0.305 2 0 "[ . 1 . 2]" 1 2773 2 82 LYS HA 2 82 LYS QG . . 3.700 3.217 3.198 3.250 . 0 0 "[ . 1 . 2]" 1 2774 2 82 LYS HA 2 84 ALA MB . . 5.500 4.607 4.030 4.925 . 0 0 "[ . 1 . 2]" 1 2775 2 82 LYS HA 2 85 LEU QD . . 4.330 2.350 1.998 2.789 . 0 0 "[ . 1 . 2]" 1 2776 2 82 LYS QB 2 82 LYS QD . . 2.270 2.102 2.069 2.130 . 0 0 "[ . 1 . 2]" 1 2777 2 82 LYS QB 2 82 LYS QE . . 3.150 3.359 3.345 3.370 0.220 19 0 "[ . 1 . 2]" 1 2778 2 82 LYS QE 2 82 LYS QG . . 2.390 1.937 1.913 1.965 . 0 0 "[ . 1 . 2]" 1 2779 2 82 LYS QE 2 83 SER QB . . 4.150 4.006 3.227 4.340 0.190 16 0 "[ . 1 . 2]" 1 2780 2 82 LYS QG 2 83 SER H . . 2.800 1.986 1.833 2.247 . 0 0 "[ . 1 . 2]" 1 2781 2 82 LYS QG 2 83 SER HA . . 4.980 3.629 3.453 3.838 . 0 0 "[ . 1 . 2]" 1 2782 2 82 LYS QG 2 83 SER QB . . 3.120 3.397 2.721 3.714 0.594 13 6 "[ -. * 1 + .* * *]" 1 2783 2 82 LYS QG 2 84 ALA MB . . 5.500 5.018 4.917 5.083 . 0 0 "[ . 1 . 2]" 1 2784 2 83 SER H 2 83 SER QB . . 2.610 2.436 2.190 2.730 0.120 11 0 "[ . 1 . 2]" 1 2785 2 83 SER H 2 84 ALA H . . 2.990 2.357 2.294 2.439 . 0 0 "[ . 1 . 2]" 1 2786 2 83 SER HA 2 84 ALA H . . 3.550 3.441 3.355 3.478 . 0 0 "[ . 1 . 2]" 1 2787 2 83 SER HA 2 87 TYR H . . 4.180 4.171 4.006 4.342 0.162 12 0 "[ . 1 . 2]" 1 2788 2 83 SER QB 2 87 TYR H . . 5.150 4.707 4.346 5.211 0.061 17 0 "[ . 1 . 2]" 1 2789 2 84 ALA H 2 84 ALA HA . . 2.800 2.775 2.724 2.820 0.020 13 0 "[ . 1 . 2]" 1 2790 2 84 ALA H 2 84 ALA MB . . 2.580 2.161 2.039 2.241 . 0 0 "[ . 1 . 2]" 1 2791 2 84 ALA H 2 86 ALA H . . 4.080 4.004 3.771 4.220 0.140 2 0 "[ . 1 . 2]" 1 2792 2 84 ALA H 2 86 ALA MB . . 5.500 4.655 4.440 5.031 . 0 0 "[ . 1 . 2]" 1 2793 2 84 ALA H 2 87 TYR H . . 4.790 4.647 4.529 4.728 . 0 0 "[ . 1 . 2]" 1 2794 2 84 ALA HA 2 85 LEU QD . . 5.440 4.737 4.601 5.267 . 0 0 "[ . 1 . 2]" 1 2795 2 84 ALA HA 2 86 ALA H . . 4.650 4.296 4.167 4.430 . 0 0 "[ . 1 . 2]" 1 2796 2 84 ALA HA 2 86 ALA MB . . 5.500 5.057 4.896 5.359 . 0 0 "[ . 1 . 2]" 1 2797 2 84 ALA HA 2 87 TYR H . . 4.570 3.596 3.384 3.696 . 0 0 "[ . 1 . 2]" 1 2798 2 84 ALA HA 2 87 TYR QB . . 5.340 2.874 2.346 3.175 . 0 0 "[ . 1 . 2]" 1 2799 2 84 ALA HA 2 88 LEU H . . 5.380 4.903 4.777 5.020 . 0 0 "[ . 1 . 2]" 1 2800 2 84 ALA MB 2 85 LEU H . . 2.610 2.334 2.193 2.591 . 0 0 "[ . 1 . 2]" 1 2801 2 84 ALA MB 2 85 LEU HA . . 3.810 3.751 3.659 3.829 0.019 6 0 "[ . 1 . 2]" 1 2802 2 84 ALA MB 2 85 LEU QD . . 5.440 3.210 3.068 3.480 . 0 0 "[ . 1 . 2]" 1 2803 2 84 ALA MB 2 86 ALA H . . 4.330 4.217 4.135 4.364 0.034 6 0 "[ . 1 . 2]" 1 2804 2 84 ALA MB 2 87 TYR H . . 4.690 4.545 4.413 4.634 . 0 0 "[ . 1 . 2]" 1 2805 2 84 ALA MB 2 88 LEU H . . 5.150 5.277 5.203 5.416 0.266 12 0 "[ . 1 . 2]" 1 2806 2 85 LEU H 2 85 LEU HB2 . . 3.740 3.695 3.573 3.728 . 0 0 "[ . 1 . 2]" 1 2807 2 85 LEU H 2 85 LEU HB3 . . 2.400 2.690 2.582 2.798 0.398 6 0 "[ . 1 . 2]" 1 2808 2 85 LEU H 2 85 LEU QD . . 2.400 1.758 1.633 2.619 0.219 13 0 "[ . 1 . 2]" 1 2809 2 85 LEU H 2 86 ALA H . . 2.810 2.538 2.496 2.584 . 0 0 "[ . 1 . 2]" 1 2810 2 85 LEU H 2 87 TYR H . . 4.210 4.022 3.864 4.126 . 0 0 "[ . 1 . 2]" 1 2811 2 85 LEU HA 2 85 LEU HB2 . . 2.810 2.388 2.354 2.463 . 0 0 "[ . 1 . 2]" 1 2812 2 85 LEU HA 2 85 LEU HB3 . . 2.870 2.432 2.355 2.478 . 0 0 "[ . 1 . 2]" 1 2813 2 85 LEU HA 2 86 ALA HA . . 5.500 4.677 4.607 4.716 . 0 0 "[ . 1 . 2]" 1 2814 2 85 LEU HA 2 87 TYR H . . 5.480 4.027 3.888 4.130 . 0 0 "[ . 1 . 2]" 1 2815 2 85 LEU HA 2 88 LEU HA . . 5.480 5.343 4.978 5.594 0.114 2 0 "[ . 1 . 2]" 1 2816 2 85 LEU HA 2 88 LEU QD . . 4.920 2.515 2.150 3.157 . 0 0 "[ . 1 . 2]" 1 2817 2 85 LEU HA 2 106 LYS HA . . 5.500 4.868 3.851 5.350 . 0 0 "[ . 1 . 2]" 1 2818 2 85 LEU HB3 2 85 LEU QD . . 2.620 2.110 2.091 2.133 . 0 0 "[ . 1 . 2]" 1 2819 2 85 LEU HB3 2 86 ALA H . . 3.940 4.136 4.054 4.208 0.268 6 0 "[ . 1 . 2]" 1 2820 2 85 LEU HB3 2 87 TYR H . . 5.500 5.740 5.554 5.849 0.349 9 0 "[ . 1 . 2]" 1 2821 2 85 LEU HB3 2 106 LYS HA . . 5.500 4.067 2.862 4.515 . 0 0 "[ . 1 . 2]" 1 2822 2 85 LEU QD 2 86 ALA H . . 2.840 2.687 2.320 2.911 0.071 6 0 "[ . 1 . 2]" 1 2823 2 85 LEU HG 2 86 ALA H . . 2.770 2.812 2.475 2.876 0.106 17 0 "[ . 1 . 2]" 1 2824 2 85 LEU HG 2 86 ALA HA . . 5.290 3.642 3.458 4.486 . 0 0 "[ . 1 . 2]" 1 2825 2 86 ALA H 2 86 ALA MB . . 2.850 2.251 2.229 2.292 . 0 0 "[ . 1 . 2]" 1 2826 2 86 ALA H 2 87 TYR H . . 2.860 2.382 2.204 2.476 . 0 0 "[ . 1 . 2]" 1 2827 2 86 ALA H 2 87 TYR QB . . 4.220 4.197 3.846 4.310 0.090 17 0 "[ . 1 . 2]" 1 2828 2 86 ALA H 2 88 LEU H . . 4.070 4.012 3.933 4.103 0.033 10 0 "[ . 1 . 2]" 1 2829 2 86 ALA MB 2 87 TYR H . . 2.980 2.691 2.588 2.888 . 0 0 "[ . 1 . 2]" 1 2830 2 87 TYR H 2 87 TYR HB2 . . 3.430 2.252 2.196 2.454 . 0 0 "[ . 1 . 2]" 1 2831 2 87 TYR H 2 87 TYR QB . . 2.660 2.204 2.119 2.244 . 0 0 "[ . 1 . 2]" 1 2832 2 87 TYR H 2 87 TYR HB3 . . 3.430 3.367 2.317 3.527 0.097 19 0 "[ . 1 . 2]" 1 2833 2 87 TYR H 2 88 LEU H . . 3.020 2.622 2.521 2.726 . 0 0 "[ . 1 . 2]" 1 2834 2 87 TYR H 2 88 LEU HA . . 5.270 5.054 4.962 5.259 . 0 0 "[ . 1 . 2]" 1 2835 2 87 TYR H 2 89 GLU H . . 4.640 4.449 4.244 4.597 . 0 0 "[ . 1 . 2]" 1 2836 2 87 TYR H 2 90 LYS QB . . 5.500 5.333 4.657 6.508 1.008 3 2 "[ + . -1 . 2]" 1 2837 2 87 TYR H 2 105 ALA MB . . 5.500 5.404 4.698 5.579 0.079 17 0 "[ . 1 . 2]" 1 2838 2 87 TYR HA 2 89 GLU H . . 4.060 3.662 3.364 4.067 0.007 6 0 "[ . 1 . 2]" 1 2839 2 87 TYR HA 2 90 LYS QB . . 3.360 2.916 2.052 4.293 0.933 3 2 "[ + . -1 . 2]" 1 2840 2 87 TYR HA 2 90 LYS QG . . 5.340 4.225 2.407 5.077 . 0 0 "[ . 1 . 2]" 1 2841 2 87 TYR QB 2 87 TYR HD1 . . 2.940 2.518 2.368 2.877 . 0 0 "[ . 1 . 2]" 1 2842 2 87 TYR QB 2 87 TYR HE1 . . 4.630 4.470 4.392 4.636 0.006 1 0 "[ . 1 . 2]" 1 2843 2 87 TYR QB 2 88 LEU H . . 3.450 3.345 2.838 3.485 0.035 10 0 "[ . 1 . 2]" 1 2844 2 87 TYR QB 2 88 LEU QD . . 5.280 5.140 4.807 5.266 . 0 0 "[ . 1 . 2]" 1 2845 2 87 TYR HB2 2 88 LEU H . . 4.050 3.737 3.515 4.095 0.045 6 0 "[ . 1 . 2]" 1 2846 2 87 TYR HB3 2 88 LEU H . . 4.050 3.861 2.894 4.083 0.033 14 0 "[ . 1 . 2]" 1 2847 2 88 LEU H 2 88 LEU HB3 . . 2.450 2.670 2.377 2.746 0.296 15 0 "[ . 1 . 2]" 1 2848 2 88 LEU H 2 88 LEU MD1 . . 4.800 3.716 3.592 4.181 . 0 0 "[ . 1 . 2]" 1 2849 2 88 LEU H 2 88 LEU QD . . 4.100 3.140 2.401 3.238 . 0 0 "[ . 1 . 2]" 1 2850 2 88 LEU H 2 88 LEU MD2 . . 4.800 3.418 2.416 3.509 . 0 0 "[ . 1 . 2]" 1 2851 2 88 LEU H 2 88 LEU HG . . 4.860 2.492 2.307 3.952 . 0 0 "[ . 1 . 2]" 1 2852 2 88 LEU H 2 89 GLU H . . 2.910 2.628 2.438 2.773 . 0 0 "[ . 1 . 2]" 1 2853 2 88 LEU H 2 89 GLU QB . . 5.340 4.292 4.138 4.588 . 0 0 "[ . 1 . 2]" 1 2854 2 88 LEU H 2 90 LYS H . . 4.360 4.108 3.713 4.339 . 0 0 "[ . 1 . 2]" 1 2855 2 88 LEU HA 2 88 LEU HB2 . . 2.830 2.404 2.266 2.430 . 0 0 "[ . 1 . 2]" 1 2856 2 88 LEU HA 2 88 LEU HB3 . . 3.000 2.410 2.365 2.611 . 0 0 "[ . 1 . 2]" 1 2857 2 88 LEU HA 2 88 LEU MD1 . . 4.170 3.708 3.656 4.022 . 0 0 "[ . 1 . 2]" 1 2858 2 88 LEU HA 2 88 LEU QD . . 3.500 3.436 3.421 3.452 . 0 0 "[ . 1 . 2]" 1 2859 2 88 LEU HA 2 88 LEU MD2 . . 4.170 4.075 3.705 4.155 . 0 0 "[ . 1 . 2]" 1 2860 2 88 LEU HA 2 89 GLU HA . . 5.500 4.772 4.583 4.921 . 0 0 "[ . 1 . 2]" 1 2861 2 88 LEU HA 2 91 HIS H . . 3.810 3.447 3.323 3.632 . 0 0 "[ . 1 . 2]" 1 2862 2 88 LEU HA 2 91 HIS HD2 . . 5.500 2.039 1.855 2.526 . 0 0 "[ . 1 . 2]" 1 2863 2 88 LEU HA 2 103 VAL QG . . 5.440 2.990 2.666 3.261 . 0 0 "[ . 1 . 2]" 1 2864 2 88 LEU HB2 2 88 LEU QD . . 2.660 2.142 2.128 2.181 . 0 0 "[ . 1 . 2]" 1 2865 2 88 LEU HB2 2 91 HIS HD2 . . 4.150 4.041 2.887 4.461 0.311 17 0 "[ . 1 . 2]" 1 2866 2 88 LEU HB2 2 92 THR HB . . 5.500 4.208 3.929 4.543 . 0 0 "[ . 1 . 2]" 1 2867 2 88 LEU HB3 2 88 LEU MD1 . . 3.560 3.162 2.482 3.210 . 0 0 "[ . 1 . 2]" 1 2868 2 88 LEU HB3 2 88 LEU QD . . 2.560 2.167 2.127 2.189 . 0 0 "[ . 1 . 2]" 1 2869 2 88 LEU HB3 2 88 LEU MD2 . . 3.560 2.211 2.188 2.314 . 0 0 "[ . 1 . 2]" 1 2870 2 88 LEU HB3 2 89 GLU H . . 3.790 4.017 3.695 4.090 0.300 5 0 "[ . 1 . 2]" 1 2871 2 88 LEU QD 2 89 GLU H . . 3.030 2.375 1.880 2.547 . 0 0 "[ . 1 . 2]" 1 2872 2 88 LEU QD 2 89 GLU HA . . 3.270 2.503 2.315 3.291 0.021 9 0 "[ . 1 . 2]" 1 2873 2 88 LEU QD 2 89 GLU QB . . 3.810 2.712 2.494 2.922 . 0 0 "[ . 1 . 2]" 1 2874 2 88 LEU QD 2 90 LYS H . . 4.520 4.307 4.216 4.384 . 0 0 "[ . 1 . 2]" 1 2875 2 88 LEU QD 2 91 HIS HD2 . . 5.440 4.692 4.110 4.994 . 0 0 "[ . 1 . 2]" 1 2876 2 88 LEU QD 2 92 THR HB . . 3.390 3.068 2.708 3.578 0.188 9 0 "[ . 1 . 2]" 1 2877 2 88 LEU QD 2 92 THR MG . . 4.420 3.115 2.850 3.354 . 0 0 "[ . 1 . 2]" 1 2878 2 88 LEU QD 2 105 ALA HA . . 5.440 4.249 3.999 4.707 . 0 0 "[ . 1 . 2]" 1 2879 2 88 LEU QD 2 105 ALA MB . . 2.390 2.015 1.771 2.436 0.046 9 0 "[ . 1 . 2]" 1 2880 2 88 LEU HG 2 89 GLU H . . 2.890 2.664 2.455 2.873 . 0 0 "[ . 1 . 2]" 1 2881 2 88 LEU HG 2 89 GLU HA . . 4.510 4.462 2.997 4.606 0.096 12 0 "[ . 1 . 2]" 1 2882 2 88 LEU HG 2 89 GLU QB . . 5.340 3.770 3.243 4.053 . 0 0 "[ . 1 . 2]" 1 2883 2 88 LEU HG 2 89 GLU QG . . 4.030 5.515 4.796 5.937 1.907 14 20 [***-*********+******] 1 2884 2 88 LEU HG 2 92 THR HB . . 5.500 5.275 2.846 5.597 0.097 15 0 "[ . 1 . 2]" 1 2885 2 89 GLU H 2 89 GLU QB . . 2.390 2.178 2.008 2.330 . 0 0 "[ . 1 . 2]" 1 2886 2 89 GLU H 2 89 GLU QG . . 4.350 3.915 3.655 4.047 . 0 0 "[ . 1 . 2]" 1 2887 2 89 GLU H 2 90 LYS H . . 2.700 2.638 2.450 2.781 0.081 3 0 "[ . 1 . 2]" 1 2888 2 89 GLU H 2 91 HIS H . . 4.720 4.335 4.088 4.589 . 0 0 "[ . 1 . 2]" 1 2889 2 89 GLU H 2 91 HIS HD2 . . 5.500 4.744 4.327 5.573 0.073 11 0 "[ . 1 . 2]" 1 2890 2 89 GLU H 2 92 THR MG . . 4.860 4.873 4.164 5.022 0.162 19 0 "[ . 1 . 2]" 1 2891 2 89 GLU HA 2 89 GLU QG . . 3.510 2.578 2.095 3.074 . 0 0 "[ . 1 . 2]" 1 2892 2 89 GLU HA 2 90 LYS QB . . 5.500 5.189 4.997 5.518 0.018 3 0 "[ . 1 . 2]" 1 2893 2 89 GLU HA 2 92 THR H . . 4.900 3.392 2.915 3.784 . 0 0 "[ . 1 . 2]" 1 2894 2 89 GLU HA 2 92 THR MG . . 3.760 2.697 1.738 3.020 . 0 0 "[ . 1 . 2]" 1 2895 2 89 GLU HA 2 93 ALA H . . 4.840 3.578 3.207 3.922 . 0 0 "[ . 1 . 2]" 1 2896 2 89 GLU HA 2 93 ALA HA . . 5.500 5.227 5.043 5.472 . 0 0 "[ . 1 . 2]" 1 2897 2 89 GLU QB 2 89 GLU QG . . 2.250 2.040 1.984 2.091 . 0 0 "[ . 1 . 2]" 1 2898 2 90 LYS H 2 90 LYS QB . . 3.550 2.223 2.109 2.621 . 0 0 "[ . 1 . 2]" 1 2899 2 90 LYS H 2 90 LYS QE . . 3.440 3.208 2.352 3.551 0.111 5 0 "[ . 1 . 2]" 1 2900 2 90 LYS H 2 91 HIS H . . 2.850 2.621 2.487 2.908 0.058 19 0 "[ . 1 . 2]" 1 2901 2 90 LYS H 2 92 THR H . . 4.620 3.938 3.768 4.090 . 0 0 "[ . 1 . 2]" 1 2902 2 90 LYS H 2 93 ALA H . . 4.730 4.550 4.407 4.714 . 0 0 "[ . 1 . 2]" 1 2903 2 90 LYS HA 2 90 LYS QE . . 4.320 2.593 1.859 3.018 . 0 0 "[ . 1 . 2]" 1 2904 2 90 LYS HA 2 91 HIS HA . . 5.500 4.679 4.424 4.810 . 0 0 "[ . 1 . 2]" 1 2905 2 90 LYS HA 2 93 ALA MB . . 5.500 3.222 2.810 3.642 . 0 0 "[ . 1 . 2]" 1 2906 2 90 LYS QB 2 90 LYS QE . . 4.050 2.262 1.833 3.283 . 0 0 "[ . 1 . 2]" 1 2907 2 90 LYS QB 2 90 LYS QG . . 2.470 1.984 1.971 2.010 . 0 0 "[ . 1 . 2]" 1 2908 2 90 LYS QB 2 91 HIS H . . 2.850 2.356 1.967 2.771 . 0 0 "[ . 1 . 2]" 1 2909 2 90 LYS QB 2 91 HIS HA . . 5.120 3.821 3.674 3.969 . 0 0 "[ . 1 . 2]" 1 2910 2 90 LYS QE 2 90 LYS QG . . 3.140 2.394 2.217 2.614 . 0 0 "[ . 1 . 2]" 1 2911 2 90 LYS QE 2 91 HIS H . . 5.060 4.814 4.398 5.044 . 0 0 "[ . 1 . 2]" 1 2912 2 90 LYS QG 2 91 HIS H . . 5.000 3.933 3.431 4.639 . 0 0 "[ . 1 . 2]" 1 2913 2 91 HIS H 2 91 HIS HE1 . . 5.170 5.381 4.453 5.779 0.609 1 2 "[+ . 1 - . 2]" 1 2914 2 91 HIS H 2 92 THR H . . 3.120 2.361 2.226 2.535 . 0 0 "[ . 1 . 2]" 1 2915 2 91 HIS H 2 92 THR HB . . 4.830 4.071 3.905 4.301 . 0 0 "[ . 1 . 2]" 1 2916 2 91 HIS H 2 92 THR MG . . 5.360 5.204 4.349 5.466 0.106 4 0 "[ . 1 . 2]" 1 2917 2 91 HIS H 2 93 ALA H . . 4.180 3.944 3.777 4.156 . 0 0 "[ . 1 . 2]" 1 2918 2 91 HIS HA 2 91 HIS HB3 . . 2.680 2.390 2.243 2.459 . 0 0 "[ . 1 . 2]" 1 2919 2 91 HIS HB2 2 92 THR H . . 3.240 2.493 2.180 3.939 0.699 19 1 "[ . 1 . +2]" 1 2920 2 91 HIS HB2 2 92 THR HA . . 4.210 3.922 3.630 4.583 0.373 19 0 "[ . 1 . 2]" 1 2921 2 91 HIS HB3 2 91 HIS HE1 . . 5.000 4.699 4.632 4.917 . 0 0 "[ . 1 . 2]" 1 2922 2 92 THR H 2 92 THR HA . . 2.760 2.735 2.706 2.796 0.036 19 0 "[ . 1 . 2]" 1 2923 2 92 THR H 2 92 THR HB . . 2.920 2.145 2.015 2.281 . 0 0 "[ . 1 . 2]" 1 2924 2 92 THR H 2 92 THR MG . . 3.600 3.511 2.866 3.657 0.057 9 0 "[ . 1 . 2]" 1 2925 2 92 THR H 2 93 ALA H . . 2.940 2.838 2.663 2.946 0.006 2 0 "[ . 1 . 2]" 1 2926 2 92 THR H 2 93 ALA MB . . 4.720 4.522 4.326 4.643 . 0 0 "[ . 1 . 2]" 1 2927 2 92 THR H 2 94 ARG H . . 4.320 4.236 4.088 4.377 0.057 15 0 "[ . 1 . 2]" 1 2928 2 92 THR H 2 103 VAL H . . 5.500 4.577 4.230 5.342 . 0 0 "[ . 1 . 2]" 1 2929 2 92 THR H 2 103 VAL QG . . 4.610 2.892 2.665 3.384 . 0 0 "[ . 1 . 2]" 1 2930 2 92 THR HA 2 92 THR MG . . 3.290 2.727 2.602 3.121 . 0 0 "[ . 1 . 2]" 1 2931 2 92 THR HA 2 95 LEU H . . 4.450 3.105 2.950 3.212 . 0 0 "[ . 1 . 2]" 1 2932 2 92 THR HA 2 95 LEU QD . . 4.990 2.448 2.250 2.551 . 0 0 "[ . 1 . 2]" 1 2933 2 92 THR HA 2 96 LYS H . . 4.270 3.441 3.287 3.564 . 0 0 "[ . 1 . 2]" 1 2934 2 92 THR HA 2 96 LYS HA . . 5.250 5.439 5.322 5.574 0.324 10 0 "[ . 1 . 2]" 1 2935 2 92 THR HA 2 96 LYS QB . . 3.680 4.402 4.256 4.522 0.842 17 20 [****************+-**] 1 2936 2 92 THR HA 2 96 LYS HG2 . . 5.500 4.163 4.069 4.270 . 0 0 "[ . 1 . 2]" 1 2937 2 92 THR HA 2 103 VAL H . . 5.330 3.535 3.274 4.109 . 0 0 "[ . 1 . 2]" 1 2938 2 92 THR HA 2 103 VAL HB . . 4.860 4.284 3.953 4.644 . 0 0 "[ . 1 . 2]" 1 2939 2 92 THR HA 2 103 VAL QG . . 3.310 2.700 2.303 3.193 . 0 0 "[ . 1 . 2]" 1 2940 2 92 THR HB 2 93 ALA H . . 3.790 3.083 2.809 3.810 0.020 11 0 "[ . 1 . 2]" 1 2941 2 92 THR HB 2 94 ARG H . . 5.230 5.067 4.883 5.388 0.158 18 0 "[ . 1 . 2]" 1 2942 2 92 THR HB 2 95 LEU QD . . 4.030 4.278 3.883 4.428 0.398 12 0 "[ . 1 . 2]" 1 2943 2 92 THR HB 2 95 LEU HG . . 4.630 4.717 4.385 4.780 0.150 9 0 "[ . 1 . 2]" 1 2944 2 92 THR HB 2 96 LYS HG2 . . 4.470 4.843 4.491 5.262 0.792 18 4 "[ .- 1* . + *]" 1 2945 2 92 THR HB 2 103 VAL QG . . 3.510 3.395 2.728 3.721 0.211 19 0 "[ . 1 . 2]" 1 2946 2 92 THR MG 2 93 ALA H . . 3.030 2.986 2.480 3.173 0.143 8 0 "[ . 1 . 2]" 1 2947 2 92 THR MG 2 93 ALA HA . . 3.550 3.159 3.018 3.336 . 0 0 "[ . 1 . 2]" 1 2948 2 92 THR MG 2 94 ARG H . . 4.130 4.380 4.264 4.445 0.315 9 0 "[ . 1 . 2]" 1 2949 2 92 THR MG 2 95 LEU QD . . 4.750 3.214 2.832 3.881 . 0 0 "[ . 1 . 2]" 1 2950 2 92 THR MG 2 96 LYS QB . . 3.860 2.419 2.221 2.615 . 0 0 "[ . 1 . 2]" 1 2951 2 92 THR MG 2 96 LYS QE . . 3.970 1.772 1.685 1.858 . 0 0 "[ . 1 . 2]" 1 2952 2 92 THR MG 2 96 LYS HG2 . . 3.010 2.571 2.299 2.815 . 0 0 "[ . 1 . 2]" 1 2953 2 92 THR MG 2 103 VAL H . . 4.440 3.385 3.033 4.013 . 0 0 "[ . 1 . 2]" 1 2954 2 93 ALA H 2 93 ALA HA . . 2.840 2.797 2.757 2.842 0.002 5 0 "[ . 1 . 2]" 1 2955 2 93 ALA H 2 93 ALA MB . . 2.400 2.252 2.226 2.289 . 0 0 "[ . 1 . 2]" 1 2956 2 93 ALA H 2 94 ARG H . . 2.960 2.709 2.648 2.788 . 0 0 "[ . 1 . 2]" 1 2957 2 93 ALA H 2 94 ARG QD . . 5.340 3.819 3.498 4.321 . 0 0 "[ . 1 . 2]" 1 2958 2 93 ALA H 2 95 LEU QD . . 5.450 4.940 4.722 5.093 . 0 0 "[ . 1 . 2]" 1 2959 2 93 ALA H 2 96 LYS H . . 4.790 4.721 4.680 4.765 . 0 0 "[ . 1 . 2]" 1 2960 2 93 ALA H 2 96 LYS QE . . 5.340 4.322 3.671 4.855 . 0 0 "[ . 1 . 2]" 1 2961 2 93 ALA HA 2 96 LYS HD2 . . 3.290 2.437 2.031 2.825 . 0 0 "[ . 1 . 2]" 1 2962 2 93 ALA HA 2 96 LYS QE . . 3.890 3.235 2.608 3.906 0.016 14 0 "[ . 1 . 2]" 1 2963 2 93 ALA HA 2 96 LYS HG2 . . 2.990 2.191 2.085 2.376 . 0 0 "[ . 1 . 2]" 1 2964 2 93 ALA MB 2 94 ARG H . . 3.720 2.967 2.842 3.190 . 0 0 "[ . 1 . 2]" 1 2965 2 94 ARG H 2 94 ARG QB . . 2.550 2.344 2.221 2.550 0.000 19 0 "[ . 1 . 2]" 1 2966 2 94 ARG H 2 94 ARG QD . . 5.340 2.439 2.144 2.821 . 0 0 "[ . 1 . 2]" 1 2967 2 94 ARG H 2 95 LEU H . . 2.920 2.352 2.206 2.409 . 0 0 "[ . 1 . 2]" 1 2968 2 94 ARG H 2 95 LEU HA . . 5.050 4.959 4.827 5.019 . 0 0 "[ . 1 . 2]" 1 2969 2 94 ARG H 2 95 LEU QD . . 4.700 4.346 4.227 4.462 . 0 0 "[ . 1 . 2]" 1 2970 2 94 ARG H 2 95 LEU HG . . 4.200 4.062 3.725 4.254 0.054 11 0 "[ . 1 . 2]" 1 2971 2 94 ARG H 2 96 LYS H . . 3.650 3.694 3.591 3.767 0.117 14 0 "[ . 1 . 2]" 1 2972 2 94 ARG H 2 97 ASN H . . 5.020 4.731 4.629 4.873 . 0 0 "[ . 1 . 2]" 1 2973 2 94 ARG HA 2 94 ARG HG3 . . 2.630 2.521 2.388 2.661 0.031 13 0 "[ . 1 . 2]" 1 2974 2 94 ARG HA 2 98 LEU H . . 4.340 4.192 3.999 4.369 0.029 10 0 "[ . 1 . 2]" 1 2975 2 94 ARG QB 2 94 ARG QD . . 3.390 2.357 2.250 2.413 . 0 0 "[ . 1 . 2]" 1 2976 2 94 ARG QB 2 95 LEU H . . 2.770 2.439 2.270 2.619 . 0 0 "[ . 1 . 2]" 1 2977 2 94 ARG QB 2 95 LEU QB . . 4.680 3.511 3.270 3.726 . 0 0 "[ . 1 . 2]" 1 2978 2 95 LEU H 2 95 LEU HA . . 2.900 2.846 2.827 2.862 . 0 0 "[ . 1 . 2]" 1 2979 2 95 LEU H 2 95 LEU HG . . 2.850 2.347 2.011 2.547 . 0 0 "[ . 1 . 2]" 1 2980 2 95 LEU H 2 96 LYS H . . 2.610 2.582 2.511 2.636 0.026 13 0 "[ . 1 . 2]" 1 2981 2 95 LEU H 2 97 ASN H . . 4.060 3.989 3.844 4.079 0.019 5 0 "[ . 1 . 2]" 1 2982 2 95 LEU H 2 98 LEU H . . 4.820 4.686 4.611 4.774 . 0 0 "[ . 1 . 2]" 1 2983 2 95 LEU H 2 99 GLY H . . 4.770 4.733 4.610 4.790 0.020 10 0 "[ . 1 . 2]" 1 2984 2 95 LEU HA 2 95 LEU QB . . 2.470 2.137 2.122 2.147 . 0 0 "[ . 1 . 2]" 1 2985 2 95 LEU HA 2 95 LEU QD . . 4.140 3.330 3.230 3.355 . 0 0 "[ . 1 . 2]" 1 2986 2 95 LEU HA 2 95 LEU HG . . 4.100 3.717 3.668 3.751 . 0 0 "[ . 1 . 2]" 1 2987 2 95 LEU HA 2 97 ASN H . . 3.860 3.755 3.629 3.889 0.029 3 0 "[ . 1 . 2]" 1 2988 2 95 LEU HA 2 98 LEU H . . 4.350 3.017 2.889 3.162 . 0 0 "[ . 1 . 2]" 1 2989 2 95 LEU HA 2 98 LEU HB3 . . 5.500 5.346 5.059 5.586 0.086 7 0 "[ . 1 . 2]" 1 2990 2 95 LEU HA 2 99 GLY H . . 2.610 2.201 2.082 2.298 . 0 0 "[ . 1 . 2]" 1 2991 2 95 LEU QB 2 95 LEU QD . . 2.760 1.857 1.827 1.880 . 0 0 "[ . 1 . 2]" 1 2992 2 95 LEU QB 2 99 GLY HA3 . . 5.340 2.173 1.919 2.457 . 0 0 "[ . 1 . 2]" 1 2993 2 95 LEU QB 2 100 VAL H . . 3.970 2.265 2.010 2.436 . 0 0 "[ . 1 . 2]" 1 2994 2 95 LEU QD 2 96 LYS H . . 3.160 2.824 2.424 3.072 . 0 0 "[ . 1 . 2]" 1 2995 2 95 LEU QD 2 96 LYS HA . . 4.600 2.670 2.419 2.864 . 0 0 "[ . 1 . 2]" 1 2996 2 95 LEU QD 2 96 LYS QB . . 4.030 3.297 2.876 3.498 . 0 0 "[ . 1 . 2]" 1 2997 2 95 LEU QD 2 97 ASN H . . 4.470 4.367 4.188 4.435 . 0 0 "[ . 1 . 2]" 1 2998 2 95 LEU QD 2 98 LEU H . . 5.260 5.060 5.007 5.137 . 0 0 "[ . 1 . 2]" 1 2999 2 95 LEU QD 2 99 GLY H . . 4.140 4.047 3.893 4.162 0.022 6 0 "[ . 1 . 2]" 1 3000 2 95 LEU QD 2 100 VAL H . . 2.980 2.367 2.089 2.855 . 0 0 "[ . 1 . 2]" 1 3001 2 95 LEU QD 2 100 VAL HA . . 5.120 4.290 4.102 4.807 . 0 0 "[ . 1 . 2]" 1 3002 2 95 LEU QD 2 100 VAL HB . . 5.500 4.152 2.784 4.845 . 0 0 "[ . 1 . 2]" 1 3003 2 95 LEU QD 2 100 VAL QG . . 3.160 2.369 1.976 3.213 0.053 17 0 "[ . 1 . 2]" 1 3004 2 95 LEU QD 2 101 GLU H . . 5.400 2.358 2.156 2.834 . 0 0 "[ . 1 . 2]" 1 3005 2 95 LEU QD 2 102 GLU H . . 4.830 2.907 2.744 3.121 . 0 0 "[ . 1 . 2]" 1 3006 2 95 LEU QD 2 102 GLU HB3 . . 5.500 3.954 3.888 4.164 . 0 0 "[ . 1 . 2]" 1 3007 2 95 LEU QD 2 102 GLU QG . . 5.340 3.544 3.034 3.833 . 0 0 "[ . 1 . 2]" 1 3008 2 95 LEU QD 2 103 VAL H . . 4.240 2.725 2.434 2.938 . 0 0 "[ . 1 . 2]" 1 3009 2 95 LEU QD 2 103 VAL HB . . 3.690 3.080 1.995 3.773 0.083 10 0 "[ . 1 . 2]" 1 3010 2 95 LEU QD 2 103 VAL MG1 . . 5.460 3.281 2.521 3.873 . 0 0 "[ . 1 . 2]" 1 3011 2 95 LEU QD 2 103 VAL QG . . 2.450 2.051 1.685 2.549 0.099 1 0 "[ . 1 . 2]" 1 3012 2 95 LEU QD 2 103 VAL MG2 . . 5.460 2.423 1.688 3.554 . 0 0 "[ . 1 . 2]" 1 3013 2 95 LEU QD 2 104 VAL H . . 5.500 4.763 4.555 4.923 . 0 0 "[ . 1 . 2]" 1 3014 2 95 LEU HG 2 96 LYS H . . 2.540 2.669 2.595 2.772 0.232 6 0 "[ . 1 . 2]" 1 3015 2 95 LEU HG 2 96 LYS HA . . 5.500 4.371 4.140 4.734 . 0 0 "[ . 1 . 2]" 1 3016 2 95 LEU HG 2 97 ASN H . . 5.360 4.920 4.770 4.983 . 0 0 "[ . 1 . 2]" 1 3017 2 95 LEU HG 2 102 GLU QG . . 5.340 5.206 4.860 5.493 0.153 11 0 "[ . 1 . 2]" 1 3018 2 95 LEU HG 2 103 VAL QG . . 2.990 3.528 3.089 4.087 1.097 4 8 "[** +. -**1 * .* 2]" 1 3019 2 96 LYS H 2 96 LYS QB . . 2.400 2.725 2.652 2.787 0.387 14 0 "[ . 1 . 2]" 1 3020 2 96 LYS H 2 96 LYS QE . . 5.320 4.199 3.971 4.520 . 0 0 "[ . 1 . 2]" 1 3021 2 96 LYS H 2 96 LYS HG2 . . 3.180 2.276 2.138 2.345 . 0 0 "[ . 1 . 2]" 1 3022 2 96 LYS H 2 97 ASN QB . . 5.340 4.227 4.060 4.378 . 0 0 "[ . 1 . 2]" 1 3023 2 96 LYS H 2 103 VAL QG . . 5.110 5.468 5.053 5.924 0.814 4 7 "[** +. -*1 * .* 2]" 1 3024 2 96 LYS HA 2 96 LYS QB . . 2.700 2.177 2.159 2.197 . 0 0 "[ . 1 . 2]" 1 3025 2 96 LYS HA 2 96 LYS QE . . 5.340 4.498 4.092 5.183 . 0 0 "[ . 1 . 2]" 1 3026 2 96 LYS HA 2 96 LYS HG3 . . 3.630 3.677 3.637 3.726 0.096 20 0 "[ . 1 . 2]" 1 3027 2 96 LYS HA 2 97 ASN HA . . 5.500 4.653 4.603 4.703 . 0 0 "[ . 1 . 2]" 1 3028 2 96 LYS HA 2 97 ASN QB . . 5.340 5.182 5.065 5.349 0.009 18 0 "[ . 1 . 2]" 1 3029 2 96 LYS QB 2 96 LYS QE . . 4.200 2.297 1.945 2.907 . 0 0 "[ . 1 . 2]" 1 3030 2 96 LYS QB 2 96 LYS HG2 . . 2.400 2.232 2.200 2.273 . 0 0 "[ . 1 . 2]" 1 3031 2 96 LYS HD2 2 96 LYS QE . . 2.620 2.295 2.151 2.417 . 0 0 "[ . 1 . 2]" 1 3032 2 96 LYS HD2 2 96 LYS HG3 . . 2.400 2.464 2.370 2.545 0.145 20 0 "[ . 1 . 2]" 1 3033 2 96 LYS HD2 2 97 ASN H . . 4.690 4.739 4.535 4.886 0.196 14 0 "[ . 1 . 2]" 1 3034 2 96 LYS HG3 2 97 ASN H . . 2.750 2.351 2.132 2.437 . 0 0 "[ . 1 . 2]" 1 3035 2 96 LYS HG3 2 97 ASN QB . . 4.280 3.224 2.964 3.545 . 0 0 "[ . 1 . 2]" 1 3036 2 97 ASN H 2 97 ASN QB . . 3.310 2.238 2.132 2.281 . 0 0 "[ . 1 . 2]" 1 3037 2 97 ASN H 2 98 LEU MD2 . . 5.380 5.301 5.204 5.383 0.003 7 0 "[ . 1 . 2]" 1 3038 2 97 ASN QB 2 98 LEU H . . 3.870 2.422 2.165 2.574 . 0 0 "[ . 1 . 2]" 1 3039 2 97 ASN QB 2 98 LEU MD2 . . 5.340 3.786 3.493 4.023 . 0 0 "[ . 1 . 2]" 1 3040 2 97 ASN HB2 2 98 LEU H . . 4.460 3.261 2.537 3.886 . 0 0 "[ . 1 . 2]" 1 3041 2 97 ASN HB3 2 98 LEU H . . 4.460 2.771 2.183 3.395 . 0 0 "[ . 1 . 2]" 1 3042 2 98 LEU H 2 98 LEU HB3 . . 2.850 3.045 2.954 3.107 0.257 7 0 "[ . 1 . 2]" 1 3043 2 98 LEU H 2 98 LEU MD2 . . 3.540 3.604 3.549 3.636 0.096 14 0 "[ . 1 . 2]" 1 3044 2 98 LEU H 2 98 LEU HG . . 2.760 2.139 2.077 2.211 . 0 0 "[ . 1 . 2]" 1 3045 2 98 LEU H 2 99 GLY H . . 2.460 2.121 2.021 2.186 . 0 0 "[ . 1 . 2]" 1 3046 2 98 LEU HA 2 98 LEU HB2 . . 2.400 2.452 2.430 2.466 0.066 12 0 "[ . 1 . 2]" 1 3047 2 98 LEU HA 2 99 GLY HA2 . . 5.500 4.540 4.485 4.598 . 0 0 "[ . 1 . 2]" 1 3048 2 98 LEU MD1 2 99 GLY H . . 4.480 2.836 2.610 3.093 . 0 0 "[ . 1 . 2]" 1 3049 2 98 LEU MD1 2 99 GLY HA2 . . 4.250 2.399 2.318 2.497 . 0 0 "[ . 1 . 2]" 1 3050 2 98 LEU MD2 2 99 GLY H . . 5.080 4.662 4.539 4.828 . 0 0 "[ . 1 . 2]" 1 3051 2 98 LEU MD2 2 99 GLY HA2 . . 4.910 5.116 5.078 5.185 0.275 17 0 "[ . 1 . 2]" 1 3052 2 98 LEU HG 2 99 GLY H . . 4.630 3.280 3.101 3.475 . 0 0 "[ . 1 . 2]" 1 3053 2 98 LEU HG 2 99 GLY HA3 . . 4.470 4.427 4.239 4.545 0.075 6 0 "[ . 1 . 2]" 1 3054 2 99 GLY H 2 99 GLY HA2 . . 2.850 2.900 2.884 2.913 0.063 20 0 "[ . 1 . 2]" 1 3055 2 99 GLY H 2 99 GLY HA3 . . 2.930 2.342 2.313 2.367 . 0 0 "[ . 1 . 2]" 1 3056 2 99 GLY HA2 2 100 VAL HA . . 5.350 4.433 4.325 4.544 . 0 0 "[ . 1 . 2]" 1 3057 2 99 GLY HA3 2 100 VAL H . . 2.540 2.201 2.114 2.287 . 0 0 "[ . 1 . 2]" 1 3058 2 99 GLY HA3 2 100 VAL MG1 . . 5.500 3.634 3.277 5.448 . 0 0 "[ . 1 . 2]" 1 3059 2 99 GLY HA3 2 100 VAL MG2 . . 5.500 5.151 3.442 5.447 . 0 0 "[ . 1 . 2]" 1 3060 2 100 VAL H 2 100 VAL MG1 . . 3.950 2.534 2.150 3.921 . 0 0 "[ . 1 . 2]" 1 3061 2 100 VAL H 2 100 VAL QG . . 2.510 2.384 2.139 2.579 0.069 17 0 "[ . 1 . 2]" 1 3062 2 100 VAL H 2 100 VAL MG2 . . 3.950 3.828 2.591 4.017 0.067 12 0 "[ . 1 . 2]" 1 3063 2 100 VAL H 2 101 GLU H . . 3.180 3.019 2.834 3.209 0.029 7 0 "[ . 1 . 2]" 1 3064 2 100 VAL HA 2 100 VAL QG . . 3.080 2.325 2.113 2.406 . 0 0 "[ . 1 . 2]" 1 3065 2 100 VAL HA 2 101 GLU QG . . 4.600 4.050 3.754 4.286 . 0 0 "[ . 1 . 2]" 1 3066 2 100 VAL HB 2 101 GLU HA . . 5.500 5.657 4.470 5.827 0.327 2 0 "[ . 1 . 2]" 1 3067 2 100 VAL QG 2 101 GLU H . . 2.430 1.662 1.543 2.454 0.024 19 0 "[ . 1 . 2]" 1 3068 2 100 VAL QG 2 101 GLU HA . . 3.780 3.540 3.419 3.699 . 0 0 "[ . 1 . 2]" 1 3069 2 100 VAL QG 2 101 GLU HB2 . . 5.440 2.983 2.719 3.170 . 0 0 "[ . 1 . 2]" 1 3070 2 100 VAL QG 2 101 GLU HB3 . . 4.060 3.990 3.879 4.126 0.066 19 0 "[ . 1 . 2]" 1 3071 2 100 VAL QG 2 101 GLU QG . . 2.830 1.837 1.680 2.140 . 0 0 "[ . 1 . 2]" 1 3072 2 100 VAL MG1 2 101 GLU H . . 3.690 1.682 1.551 2.514 . 0 0 "[ . 1 . 2]" 1 3073 2 100 VAL MG2 2 101 GLU H . . 3.690 2.706 2.277 3.567 . 0 0 "[ . 1 . 2]" 1 3074 2 101 GLU H 2 101 GLU HB2 . . 2.600 2.666 2.455 2.793 0.193 13 0 "[ . 1 . 2]" 1 3075 2 101 GLU H 2 101 GLU HB3 . . 3.780 3.782 3.636 3.856 0.076 13 0 "[ . 1 . 2]" 1 3076 2 101 GLU H 2 102 GLU H . . 3.000 2.860 2.716 3.017 0.017 10 0 "[ . 1 . 2]" 1 3077 2 101 GLU H 2 102 GLU HA . . 4.710 4.383 4.254 4.495 . 0 0 "[ . 1 . 2]" 1 3078 2 101 GLU HA 2 101 GLU QG . . 2.510 2.509 2.360 2.816 0.306 11 0 "[ . 1 . 2]" 1 3079 2 101 GLU HB2 2 101 GLU QG . . 2.560 2.334 2.145 2.443 . 0 0 "[ . 1 . 2]" 1 3080 2 101 GLU HB2 2 102 GLU H . . 3.230 1.796 1.582 2.008 . 0 0 "[ . 1 . 2]" 1 3081 2 101 GLU HB2 2 102 GLU HA . . 5.500 4.572 4.401 4.750 . 0 0 "[ . 1 . 2]" 1 3082 2 101 GLU QG 2 102 GLU H . . 4.550 3.768 3.635 3.916 . 0 0 "[ . 1 . 2]" 1 3083 2 101 GLU HG2 2 102 GLU H . . 5.370 4.444 4.122 4.598 . 0 0 "[ . 1 . 2]" 1 3084 2 101 GLU HG3 2 102 GLU H . . 5.370 4.074 3.890 4.254 . 0 0 "[ . 1 . 2]" 1 3085 2 102 GLU H 2 102 GLU HA . . 2.910 2.878 2.851 2.906 . 0 0 "[ . 1 . 2]" 1 3086 2 102 GLU H 2 102 GLU HB2 . . 3.380 2.920 2.809 3.144 . 0 0 "[ . 1 . 2]" 1 3087 2 102 GLU H 2 102 GLU HB3 . . 3.850 3.805 3.166 3.980 0.130 5 0 "[ . 1 . 2]" 1 3088 2 102 GLU H 2 103 VAL H . . 4.540 4.248 4.205 4.301 . 0 0 "[ . 1 . 2]" 1 3089 2 102 GLU H 2 103 VAL HA . . 5.500 4.491 4.250 4.717 . 0 0 "[ . 1 . 2]" 1 3090 2 102 GLU HA 2 102 GLU QG . . 2.770 2.479 2.253 2.682 . 0 0 "[ . 1 . 2]" 1 3091 2 102 GLU HA 2 103 VAL H . . 2.550 2.354 2.254 2.427 . 0 0 "[ . 1 . 2]" 1 3092 2 102 GLU HA 2 103 VAL QG . . 5.440 3.740 3.564 3.936 . 0 0 "[ . 1 . 2]" 1 3093 2 102 GLU HB3 2 103 VAL H . . 4.140 2.587 2.258 3.279 . 0 0 "[ . 1 . 2]" 1 3094 2 102 GLU HB3 2 103 VAL HA . . 5.500 4.529 4.412 4.750 . 0 0 "[ . 1 . 2]" 1 3095 2 102 GLU HB3 2 104 VAL HA . . 5.500 5.146 4.866 5.574 0.074 5 0 "[ . 1 . 2]" 1 3096 2 102 GLU QG 2 103 VAL H . . 4.360 3.714 2.051 4.267 . 0 0 "[ . 1 . 2]" 1 3097 2 103 VAL H 2 103 VAL QG . . 3.340 2.257 1.973 2.556 . 0 0 "[ . 1 . 2]" 1 3098 2 103 VAL H 2 104 VAL H . . 4.650 4.461 4.435 4.527 . 0 0 "[ . 1 . 2]" 1 3099 2 103 VAL H 2 104 VAL HA . . 5.500 5.250 5.128 5.400 . 0 0 "[ . 1 . 2]" 1 3100 2 103 VAL HA 2 103 VAL MG1 . . 3.220 2.756 2.429 3.193 . 0 0 "[ . 1 . 2]" 1 3101 2 103 VAL HA 2 103 VAL QG . . 2.770 2.215 2.057 2.413 . 0 0 "[ . 1 . 2]" 1 3102 2 103 VAL HA 2 103 VAL MG2 . . 3.220 2.361 2.181 2.497 . 0 0 "[ . 1 . 2]" 1 3103 2 103 VAL HA 2 104 VAL H . . 2.770 2.124 2.083 2.167 . 0 0 "[ . 1 . 2]" 1 3104 2 103 VAL HA 2 104 VAL HA . . 5.500 4.342 4.260 4.409 . 0 0 "[ . 1 . 2]" 1 3105 2 103 VAL HA 2 104 VAL HB . . 5.500 4.707 4.551 4.783 . 0 0 "[ . 1 . 2]" 1 3106 2 103 VAL HB 2 104 VAL H . . 4.580 4.043 3.889 4.209 . 0 0 "[ . 1 . 2]" 1 3107 2 103 VAL QG 2 104 VAL H . . 2.500 2.456 2.281 2.637 0.137 11 0 "[ . 1 . 2]" 1 3108 2 103 VAL QG 2 104 VAL HA . . 3.880 3.702 3.611 3.805 . 0 0 "[ . 1 . 2]" 1 3109 2 104 VAL H 2 104 VAL HB . . 2.730 2.607 2.474 2.685 . 0 0 "[ . 1 . 2]" 1 3110 2 104 VAL H 2 104 VAL QG . . 2.800 2.124 2.010 2.253 . 0 0 "[ . 1 . 2]" 1 3111 2 104 VAL H 2 105 ALA H . . 5.500 4.223 4.048 4.407 . 0 0 "[ . 1 . 2]" 1 3112 2 104 VAL HA 2 104 VAL MG1 . . 2.810 2.340 2.289 2.389 . 0 0 "[ . 1 . 2]" 1 3113 2 104 VAL HA 2 104 VAL QG . . 2.340 2.161 2.142 2.175 . 0 0 "[ . 1 . 2]" 1 3114 2 104 VAL HA 2 104 VAL MG2 . . 2.810 2.542 2.455 2.638 . 0 0 "[ . 1 . 2]" 1 3115 2 104 VAL HA 2 105 ALA H . . 2.400 2.160 2.131 2.200 . 0 0 "[ . 1 . 2]" 1 3116 2 104 VAL HA 2 106 LYS QD . . 5.340 4.416 3.682 5.484 0.144 4 0 "[ . 1 . 2]" 1 3117 2 104 VAL QG 2 105 ALA H . . 3.100 3.069 2.806 3.180 0.080 3 0 "[ . 1 . 2]" 1 3118 2 104 VAL QG 2 106 LYS QG . . 4.550 3.428 2.191 4.159 . 0 0 "[ . 1 . 2]" 1 3119 2 105 ALA H 2 105 ALA MB . . 2.850 2.551 2.452 2.663 . 0 0 "[ . 1 . 2]" 1 3120 2 105 ALA H 2 106 LYS H . . 4.110 4.116 3.986 4.173 0.063 14 0 "[ . 1 . 2]" 1 3121 2 105 ALA H 2 106 LYS HA . . 5.120 4.870 4.704 4.944 . 0 0 "[ . 1 . 2]" 1 3122 2 105 ALA H 2 106 LYS QE . . 5.340 4.160 3.308 5.399 0.059 15 0 "[ . 1 . 2]" 1 3123 2 105 ALA HA 2 106 LYS H . . 2.510 2.058 2.015 2.112 . 0 0 "[ . 1 . 2]" 1 3124 2 105 ALA MB 2 106 LYS H . . 3.600 3.099 2.903 3.269 . 0 0 "[ . 1 . 2]" 1 3125 2 105 ALA MB 2 106 LYS HB2 . . 5.500 5.243 5.086 5.449 . 0 0 "[ . 1 . 2]" 1 3126 2 106 LYS H 2 106 LYS HB2 . . 2.870 2.786 2.697 2.884 0.014 15 0 "[ . 1 . 2]" 1 3127 2 106 LYS H 2 107 VAL H . . 4.980 4.295 4.213 4.361 . 0 0 "[ . 1 . 2]" 1 3128 2 106 LYS HA 2 106 LYS QG . . 3.740 2.565 2.436 2.686 . 0 0 "[ . 1 . 2]" 1 3129 2 106 LYS HA 2 107 VAL H . . 2.400 2.283 2.154 2.385 . 0 0 "[ . 1 . 2]" 1 3130 2 106 LYS HA 2 107 VAL HA . . 4.570 4.398 4.334 4.442 . 0 0 "[ . 1 . 2]" 1 3131 2 106 LYS HB2 2 107 VAL H . . 4.370 3.719 3.460 4.060 . 0 0 "[ . 1 . 2]" 1 3132 2 106 LYS HB3 2 107 VAL HA . . 5.500 4.494 4.142 4.977 . 0 0 "[ . 1 . 2]" 1 3133 2 106 LYS HB3 2 107 VAL HB . . 5.500 5.092 4.838 5.704 0.204 7 0 "[ . 1 . 2]" 1 3134 2 106 LYS HB3 2 108 PHE HA . . 5.500 4.913 4.198 5.450 . 0 0 "[ . 1 . 2]" 1 3135 2 107 VAL H 2 107 VAL HB . . 2.710 2.599 2.527 2.699 . 0 0 "[ . 1 . 2]" 1 3136 2 107 VAL H 2 107 VAL MG2 . . 3.600 2.577 2.419 2.721 . 0 0 "[ . 1 . 2]" 1 3137 2 107 VAL H 2 108 PHE H . . 4.480 4.221 4.062 4.429 . 0 0 "[ . 1 . 2]" 1 3138 2 107 VAL H 2 108 PHE HA . . 5.260 4.634 4.456 4.777 . 0 0 "[ . 1 . 2]" 1 3139 2 107 VAL H 2 108 PHE QB . . 5.500 5.150 4.922 5.525 0.025 4 0 "[ . 1 . 2]" 1 3140 2 107 VAL HA 2 108 PHE H . . 2.480 2.183 2.127 2.279 . 0 0 "[ . 1 . 2]" 1 3141 2 107 VAL MG1 2 108 PHE H . . 3.940 2.950 2.568 3.116 . 0 0 "[ . 1 . 2]" 1 3142 2 108 PHE H 2 108 PHE QB . . 3.610 2.845 2.531 3.093 . 0 0 "[ . 1 . 2]" 1 3143 2 108 PHE H 2 109 ASP H . . 4.550 4.445 4.390 4.496 . 0 0 "[ . 1 . 2]" 1 3144 2 108 PHE HA 2 109 ASP H . . 2.590 2.456 2.302 2.614 0.024 1 0 "[ . 1 . 2]" 1 3145 2 108 PHE HA 2 109 ASP HA . . 5.500 4.377 4.240 4.488 . 0 0 "[ . 1 . 2]" 1 3146 2 108 PHE HA 2 109 ASP QB . . 5.340 3.847 3.575 4.361 . 0 0 "[ . 1 . 2]" 1 3147 2 108 PHE QB 2 109 ASP H . . 3.450 2.102 1.936 2.393 . 0 0 "[ . 1 . 2]" 1 3148 2 108 PHE QD 2 109 ASP H . . 3.350 3.073 2.788 3.521 0.171 17 0 "[ . 1 . 2]" 1 3149 2 108 PHE QD 2 109 ASP QB . . 5.060 4.714 4.377 5.033 . 0 0 "[ . 1 . 2]" 1 3150 2 109 ASP H 2 109 ASP QB . . 2.740 2.525 2.340 2.624 . 0 0 "[ . 1 . 2]" 1 3151 2 109 ASP H 2 110 VAL H . . 4.560 4.297 4.044 4.433 . 0 0 "[ . 1 . 2]" 1 3152 2 109 ASP QB 2 110 VAL H . . 4.480 3.368 2.171 3.839 . 0 0 "[ . 1 . 2]" 1 3153 2 110 VAL H 2 110 VAL MG1 . . 4.800 2.634 1.862 3.793 . 0 0 "[ . 1 . 2]" 1 3154 2 110 VAL H 2 110 VAL QG . . 3.920 1.973 1.842 2.296 . 0 0 "[ . 1 . 2]" 1 3155 2 110 VAL H 2 110 VAL MG2 . . 4.800 2.298 1.907 3.829 . 0 0 "[ . 1 . 2]" 1 3156 2 110 VAL H 2 111 ASN H . . 4.520 4.498 4.361 4.569 0.049 18 0 "[ . 1 . 2]" 1 3157 2 110 VAL H 2 111 ASN HA . . 5.300 5.313 5.066 5.426 0.126 11 0 "[ . 1 . 2]" 1 3158 2 110 VAL HB 2 111 ASN H . . 5.420 3.364 2.553 4.277 . 0 0 "[ . 1 . 2]" 1 3159 2 110 VAL QG 2 111 ASN H . . 4.100 3.120 2.421 3.600 . 0 0 "[ . 1 . 2]" 1 3160 2 110 VAL QG 2 111 ASN HA . . 5.440 3.804 3.290 4.198 . 0 0 "[ . 1 . 2]" 1 3161 2 110 VAL QG 2 112 GLU H . . 5.210 4.132 3.191 5.064 . 0 0 "[ . 1 . 2]" 1 3162 2 110 VAL MG1 2 111 ASN H . . 4.770 3.574 2.735 4.020 . 0 0 "[ . 1 . 2]" 1 3163 2 110 VAL MG2 2 111 ASN H . . 4.770 3.694 2.452 4.206 . 0 0 "[ . 1 . 2]" 1 3164 2 111 ASN H 2 111 ASN QB . . 2.690 2.501 2.300 2.754 0.064 3 0 "[ . 1 . 2]" 1 3165 2 111 ASN H 2 112 GLU H . . 4.630 4.185 3.783 4.459 . 0 0 "[ . 1 . 2]" 1 3166 2 111 ASN H 2 112 GLU QG . . 5.340 4.848 4.090 5.416 0.076 17 0 "[ . 1 . 2]" 1 3167 2 111 ASN HA 2 112 GLU H . . 3.520 2.121 2.058 2.235 . 0 0 "[ . 1 . 2]" 1 3168 2 111 ASN HA 2 112 GLU HB2 . . 5.500 4.821 4.419 5.615 0.115 9 0 "[ . 1 . 2]" 1 3169 2 111 ASN HA 2 112 GLU HB3 . . 5.500 5.316 4.385 5.631 0.131 12 0 "[ . 1 . 2]" 1 3170 2 111 ASN HA 2 113 PRO QD . . 4.450 3.188 2.809 3.528 . 0 0 "[ . 1 . 2]" 1 3171 2 112 GLU H 2 112 GLU QG . . 3.540 2.232 1.832 2.665 . 0 0 "[ . 1 . 2]" 1 3172 2 112 GLU H 2 113 PRO HA . . 5.390 5.399 5.141 5.564 0.174 20 0 "[ . 1 . 2]" 1 3173 2 112 GLU H 2 113 PRO HD2 . . 3.220 2.186 1.693 2.807 . 0 0 "[ . 1 . 2]" 1 3174 2 112 GLU H 2 113 PRO QD . . 2.770 2.137 1.682 2.598 . 0 0 "[ . 1 . 2]" 1 3175 2 112 GLU H 2 113 PRO HD3 . . 3.220 3.199 2.812 3.346 0.126 20 0 "[ . 1 . 2]" 1 3176 2 112 GLU H 2 114 LEU H . . 5.500 4.669 4.296 5.030 . 0 0 "[ . 1 . 2]" 1 3177 2 112 GLU H 2 115 SER QB . . 5.340 5.220 4.530 5.547 0.207 10 0 "[ . 1 . 2]" 1 3178 2 112 GLU HA 2 115 SER H . . 5.200 3.437 2.896 4.077 . 0 0 "[ . 1 . 2]" 1 3179 2 112 GLU QB 2 112 GLU QG . . 2.310 2.057 1.981 2.092 . 0 0 "[ . 1 . 2]" 1 3180 2 112 GLU QB 2 113 PRO QD . . 4.530 2.994 2.103 3.973 . 0 0 "[ . 1 . 2]" 1 3181 2 112 GLU QG 2 113 PRO HA . . 5.340 5.730 4.262 6.131 0.791 19 13 "[* **.* *** ***- +*]" 1 3182 2 112 GLU QG 2 113 PRO QD . . 4.170 3.673 2.726 4.155 . 0 0 "[ . 1 . 2]" 1 3183 2 113 PRO HA 2 117 ILE MD . . 5.500 5.211 4.677 5.565 0.065 9 0 "[ . 1 . 2]" 1 3184 2 113 PRO QB 2 115 SER H . . 4.580 4.583 4.506 4.648 0.068 5 0 "[ . 1 . 2]" 1 3185 2 113 PRO QD 2 114 LEU QD . . 5.280 3.921 2.798 5.013 . 0 0 "[ . 1 . 2]" 1 3186 2 113 PRO QD 2 115 SER H . . 5.350 4.541 4.285 4.745 . 0 0 "[ . 1 . 2]" 1 3187 2 113 PRO QG 2 114 LEU HG . . 5.350 3.856 2.579 4.767 . 0 0 "[ . 1 . 2]" 1 3188 2 114 LEU H 2 114 LEU HB2 . . 3.900 2.533 2.401 2.735 . 0 0 "[ . 1 . 2]" 1 3189 2 114 LEU H 2 114 LEU QB . . 3.360 2.489 2.366 2.672 . 0 0 "[ . 1 . 2]" 1 3190 2 114 LEU H 2 114 LEU HB3 . . 3.900 3.655 3.575 3.751 . 0 0 "[ . 1 . 2]" 1 3191 2 114 LEU H 2 114 LEU MD1 . . 3.610 3.480 2.941 3.791 0.181 15 0 "[ . 1 . 2]" 1 3192 2 114 LEU H 2 114 LEU QD . . 2.940 2.459 1.801 3.175 0.235 17 0 "[ . 1 . 2]" 1 3193 2 114 LEU H 2 114 LEU MD2 . . 3.610 2.568 1.812 3.458 . 0 0 "[ . 1 . 2]" 1 3194 2 114 LEU H 2 114 LEU HG . . 4.040 3.338 2.378 4.105 0.065 1 0 "[ . 1 . 2]" 1 3195 2 114 LEU H 2 115 SER H . . 2.870 2.529 2.380 2.762 . 0 0 "[ . 1 . 2]" 1 3196 2 114 LEU H 2 116 GLN H . . 4.840 4.426 4.289 4.669 . 0 0 "[ . 1 . 2]" 1 3197 2 114 LEU HA 2 114 LEU QD . . 2.450 2.004 1.897 2.154 . 0 0 "[ . 1 . 2]" 1 3198 2 114 LEU HA 2 114 LEU HG . . 3.960 3.468 3.011 3.815 . 0 0 "[ . 1 . 2]" 1 3199 2 114 LEU HA 2 116 GLN H . . 3.430 3.240 2.900 3.456 0.026 3 0 "[ . 1 . 2]" 1 3200 2 114 LEU HA 2 117 ILE HB . . 5.500 4.005 3.616 4.314 . 0 0 "[ . 1 . 2]" 1 3201 2 114 LEU HA 2 117 ILE MD . . 2.400 2.077 1.870 2.269 . 0 0 "[ . 1 . 2]" 1 3202 2 114 LEU HA 2 118 ASN H . . 5.500 5.431 5.249 5.571 0.071 2 0 "[ . 1 . 2]" 1 3203 2 114 LEU QB 2 116 GLN H . . 5.340 4.438 4.048 4.659 . 0 0 "[ . 1 . 2]" 1 3204 2 114 LEU QB 2 117 ILE MD . . 5.210 2.930 2.358 3.380 . 0 0 "[ . 1 . 2]" 1 3205 2 114 LEU QB 2 118 ASN H . . 5.340 5.294 5.161 5.435 0.095 12 0 "[ . 1 . 2]" 1 3206 2 114 LEU HB2 2 115 SER H . . 5.250 3.619 3.398 3.741 . 0 0 "[ . 1 . 2]" 1 3207 2 114 LEU HB3 2 115 SER H . . 5.250 4.297 4.149 4.431 . 0 0 "[ . 1 . 2]" 1 3208 2 114 LEU QD 2 115 SER H . . 4.960 4.027 3.689 4.372 . 0 0 "[ . 1 . 2]" 1 3209 2 114 LEU QD 2 116 GLN H . . 5.020 4.539 4.330 4.770 . 0 0 "[ . 1 . 2]" 1 3210 2 114 LEU QD 2 117 ILE HB . . 4.600 4.017 3.561 4.535 . 0 0 "[ . 1 . 2]" 1 3211 2 114 LEU QD 2 117 ILE MD . . 3.030 2.356 2.138 2.752 . 0 0 "[ . 1 . 2]" 1 3212 2 114 LEU QD 2 117 ILE HG13 . . 5.440 4.789 4.471 5.235 . 0 0 "[ . 1 . 2]" 1 3213 2 114 LEU QD 2 117 ILE MG . . 5.440 4.407 4.013 4.927 . 0 0 "[ . 1 . 2]" 1 3214 2 114 LEU HG 2 117 ILE MD . . 4.340 4.272 3.883 4.394 0.054 7 0 "[ . 1 . 2]" 1 3215 2 115 SER H 2 116 GLN H . . 3.080 2.562 2.414 2.855 . 0 0 "[ . 1 . 2]" 1 3216 2 115 SER H 2 117 ILE MD . . 4.350 4.182 4.016 4.408 0.058 4 0 "[ . 1 . 2]" 1 3217 2 115 SER HA 2 118 ASN H . . 4.240 3.281 2.944 3.658 . 0 0 "[ . 1 . 2]" 1 3218 2 115 SER QB 2 116 GLN H . . 4.460 3.374 2.973 3.738 . 0 0 "[ . 1 . 2]" 1 3219 2 115 SER QB 2 116 GLN QB . . 5.340 4.806 4.342 5.306 . 0 0 "[ . 1 . 2]" 1 3220 2 116 GLN H 2 116 GLN QB . . 3.650 2.298 2.041 2.546 . 0 0 "[ . 1 . 2]" 1 3221 2 116 GLN H 2 117 ILE H . . 3.220 2.367 1.750 2.691 . 0 0 "[ . 1 . 2]" 1 3222 2 116 GLN H 2 117 ILE MD . . 3.090 2.777 2.299 3.063 . 0 0 "[ . 1 . 2]" 1 3223 2 116 GLN H 2 118 ASN H . . 4.030 3.735 3.345 3.918 . 0 0 "[ . 1 . 2]" 1 3224 2 116 GLN H 2 119 GLN H . . 5.500 5.446 5.264 5.606 0.106 7 0 "[ . 1 . 2]" 1 3225 2 116 GLN HA 2 117 ILE MD . . 4.990 4.109 3.922 4.284 . 0 0 "[ . 1 . 2]" 1 3226 2 116 GLN QB 2 117 ILE H . . 4.890 2.808 2.388 3.178 . 0 0 "[ . 1 . 2]" 1 3227 2 116 GLN QB 2 117 ILE HA . . 5.500 3.980 3.814 4.273 . 0 0 "[ . 1 . 2]" 1 3228 2 116 GLN QB 2 117 ILE HB . . 5.500 4.586 4.186 4.948 . 0 0 "[ . 1 . 2]" 1 3229 2 116 GLN QB 2 117 ILE MD . . 3.850 2.065 1.734 2.430 . 0 0 "[ . 1 . 2]" 1 3230 2 117 ILE H 2 117 ILE MD . . 2.460 1.900 1.723 2.099 . 0 0 "[ . 1 . 2]" 1 3231 2 117 ILE H 2 117 ILE HG13 . . 3.280 3.365 3.113 3.560 0.280 12 0 "[ . 1 . 2]" 1 3232 2 117 ILE H 2 118 ASN H . . 4.590 2.231 2.022 2.371 . 0 0 "[ . 1 . 2]" 1 3233 2 117 ILE H 2 118 ASN QB . . 5.340 3.868 3.460 4.324 . 0 0 "[ . 1 . 2]" 1 3234 2 117 ILE HA 2 117 ILE HG13 . . 2.830 2.514 2.361 2.632 . 0 0 "[ . 1 . 2]" 1 3235 2 117 ILE HA 2 117 ILE MG . . 2.510 2.447 2.354 2.545 0.035 4 0 "[ . 1 . 2]" 1 3236 2 117 ILE HA 2 119 GLN H . . 3.690 3.524 3.216 3.872 0.182 7 0 "[ . 1 . 2]" 1 3237 2 117 ILE HB 2 117 ILE MD . . 2.770 2.311 2.197 2.385 . 0 0 "[ . 1 . 2]" 1 3238 2 117 ILE HB 2 117 ILE HG13 . . 3.010 3.003 2.966 3.027 0.017 17 0 "[ . 1 . 2]" 1 3239 2 117 ILE HB 2 118 ASN HA . . 5.500 4.604 4.368 4.790 . 0 0 "[ . 1 . 2]" 1 3240 2 117 ILE HB 2 119 GLN H . . 5.400 5.258 4.963 5.445 0.045 10 0 "[ . 1 . 2]" 1 3241 2 117 ILE MG 2 118 ASN HA . . 4.210 4.069 3.652 4.262 0.052 1 0 "[ . 1 . 2]" 1 3242 2 118 ASN H 2 118 ASN QB . . 2.980 2.423 2.153 2.917 . 0 0 "[ . 1 . 2]" 1 3243 2 118 ASN H 2 119 GLN H . . 3.230 2.262 2.100 2.495 . 0 0 "[ . 1 . 2]" 1 3244 2 118 ASN H 2 119 GLN QB . . 5.000 4.192 3.932 4.491 . 0 0 "[ . 1 . 2]" 1 3245 2 118 ASN H 2 119 GLN HG2 . . 5.380 4.205 3.053 4.789 . 0 0 "[ . 1 . 2]" 1 3246 2 118 ASN H 2 119 GLN QG . . 4.540 3.160 2.589 4.068 . 0 0 "[ . 1 . 2]" 1 3247 2 118 ASN H 2 119 GLN HG3 . . 5.380 3.577 2.639 5.446 0.066 5 0 "[ . 1 . 2]" 1 3248 2 118 ASN H 2 120 ALA H . . 5.160 4.703 4.369 5.010 . 0 0 "[ . 1 . 2]" 1 3249 2 118 ASN HA 2 119 GLN HA . . 4.830 4.668 4.557 4.839 0.009 6 0 "[ . 1 . 2]" 1 3250 2 118 ASN HA 2 119 GLN QB . . 5.340 5.301 4.903 5.403 0.063 1 0 "[ . 1 . 2]" 1 3251 2 118 ASN HA 2 119 GLN HG2 . . 5.500 5.450 4.578 5.729 0.229 7 0 "[ . 1 . 2]" 1 3252 2 118 ASN HA 2 119 GLN HG3 . . 5.500 5.119 4.799 5.737 0.237 16 0 "[ . 1 . 2]" 1 3253 2 118 ASN HA 2 120 ALA H . . 4.140 3.544 3.119 3.821 . 0 0 "[ . 1 . 2]" 1 3254 2 118 ASN QB 2 119 GLN H . . 4.310 3.437 2.934 3.959 . 0 0 "[ . 1 . 2]" 1 3255 2 119 GLN H 2 119 GLN QG . . 2.930 2.199 1.783 2.484 . 0 0 "[ . 1 . 2]" 1 3256 2 119 GLN H 2 120 ALA H . . 3.060 2.915 2.698 3.235 0.175 20 0 "[ . 1 . 2]" 1 3257 2 119 GLN HA 2 119 GLN QG . . 3.680 2.591 2.264 3.338 . 0 0 "[ . 1 . 2]" 1 3258 2 119 GLN QB 2 119 GLN QG . . 2.350 2.078 2.062 2.089 . 0 0 "[ . 1 . 2]" 1 3259 2 119 GLN QB 2 123 ALA H . . 5.340 4.933 3.947 5.329 . 0 0 "[ . 1 . 2]" 1 3260 2 120 ALA H 2 120 ALA MB . . 2.400 2.277 2.164 2.403 0.003 17 0 "[ . 1 . 2]" 1 3261 2 120 ALA H 2 121 LYS H . . 3.860 2.621 2.297 2.989 . 0 0 "[ . 1 . 2]" 1 3262 2 120 ALA H 2 122 LEU H . . 5.500 3.333 2.937 4.006 . 0 0 "[ . 1 . 2]" 1 3263 2 120 ALA H 2 123 ALA H . . 5.500 4.661 3.951 5.255 . 0 0 "[ . 1 . 2]" 1 3264 2 120 ALA MB 2 121 LYS H . . 4.140 2.324 1.994 3.005 . 0 0 "[ . 1 . 2]" 1 3265 2 121 LYS H 2 121 LYS QE . . 5.340 5.233 4.296 5.978 0.638 13 6 "[* . 1* +*.*- 2]" 1 3266 2 121 LYS H 2 122 LEU H . . 3.820 2.297 1.698 2.572 . 0 0 "[ . 1 . 2]" 1 3267 2 121 LYS H 2 122 LEU QB . . 5.340 4.413 3.662 4.729 . 0 0 "[ . 1 . 2]" 1 3268 2 121 LYS H 2 123 ALA H . . 4.840 3.949 3.153 4.285 . 0 0 "[ . 1 . 2]" 1 3269 2 121 LYS HA 2 121 LYS QE . . 3.990 3.416 1.961 4.076 0.086 11 0 "[ . 1 . 2]" 1 3270 2 121 LYS HA 2 121 LYS QG . . 3.570 2.719 2.256 3.100 . 0 0 "[ . 1 . 2]" 1 3271 2 121 LYS HA 2 122 LEU QD . . 5.440 4.567 4.187 5.227 . 0 0 "[ . 1 . 2]" 1 3272 2 121 LYS HA 2 123 ALA H . . 3.460 3.420 3.032 3.548 0.088 6 0 "[ . 1 . 2]" 1 3273 2 121 LYS QD 2 121 LYS QG . . 2.250 2.038 2.004 2.089 . 0 0 "[ . 1 . 2]" 1 3274 2 121 LYS QE 2 123 ALA H . . 5.340 6.081 5.162 6.917 1.577 6 15 "[* * -+* ** ********]" 1 3275 2 122 LEU H 2 122 LEU HG . . 4.920 3.634 2.808 4.755 . 0 0 "[ . 1 . 2]" 1 3276 2 122 LEU H 2 123 ALA H . . 2.920 2.549 2.227 2.848 . 0 0 "[ . 1 . 2]" 1 3277 2 122 LEU QB 2 123 ALA H . . 4.000 3.623 3.435 3.781 . 0 0 "[ . 1 . 2]" 1 3278 2 122 LEU HB2 2 123 ALA H . . 4.740 3.932 3.708 4.227 . 0 0 "[ . 1 . 2]" 1 3279 2 122 LEU HB3 2 123 ALA H . . 4.740 4.272 3.747 4.413 . 0 0 "[ . 1 . 2]" 1 stop_ save_
Contact the webmaster for help, if required. Thursday, May 16, 2024 11:33:39 AM GMT (wattos1)