NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
629748 |
6fdt   |
34224 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6fdt
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 3613
_Distance_constraint_stats_list.Viol_count 10263
_Distance_constraint_stats_list.Viol_total 5701.832
_Distance_constraint_stats_list.Viol_max 1.339
_Distance_constraint_stats_list.Viol_rms 0.0216
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0039
_Distance_constraint_stats_list.Viol_average_violations_only 0.0278
_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 2 PRO 0.353 0.040 1 0 "[ . 1 . 2]"
1 3 HIS 1.495 0.046 20 0 "[ . 1 . 2]"
1 4 MET 1.711 0.046 20 0 "[ . 1 . 2]"
1 5 GLN 3.271 0.077 14 0 "[ . 1 . 2]"
1 6 ALA 4.832 0.084 14 0 "[ . 1 . 2]"
1 7 ILE 5.890 0.084 14 0 "[ . 1 . 2]"
1 8 SER 1.848 0.051 12 0 "[ . 1 . 2]"
1 9 GLU 4.655 0.094 16 0 "[ . 1 . 2]"
1 10 LYS 5.435 0.089 19 0 "[ . 1 . 2]"
1 11 ASP 3.239 0.074 9 0 "[ . 1 . 2]"
1 12 ARG 1.825 0.054 13 0 "[ . 1 . 2]"
1 13 GLY 1.093 0.044 12 0 "[ . 1 . 2]"
1 14 ASN 2.158 0.065 5 0 "[ . 1 . 2]"
1 15 GLY 3.394 0.378 7 0 "[ . 1 . 2]"
1 16 PHE 2.660 0.061 2 0 "[ . 1 . 2]"
1 17 PHE 4.786 0.072 13 0 "[ . 1 . 2]"
1 18 LYS 9.788 0.378 7 0 "[ . 1 . 2]"
1 19 GLU 4.618 0.305 2 0 "[ . 1 . 2]"
1 20 GLY 1.014 0.056 11 0 "[ . 1 . 2]"
1 21 LYS 3.062 0.305 2 0 "[ . 1 . 2]"
1 22 TYR 3.090 0.066 7 0 "[ . 1 . 2]"
1 23 GLU 2.074 0.072 13 0 "[ . 1 . 2]"
1 24 ARG 2.158 0.078 14 0 "[ . 1 . 2]"
1 25 ALA 1.894 0.040 17 0 "[ . 1 . 2]"
1 26 ILE 9.925 0.200 10 0 "[ . 1 . 2]"
1 27 GLU 3.962 0.089 10 0 "[ . 1 . 2]"
1 28 CYS 4.592 0.087 18 0 "[ . 1 . 2]"
1 29 TYR 6.300 0.200 10 0 "[ . 1 . 2]"
1 30 THR 5.179 0.094 16 0 "[ . 1 . 2]"
1 31 ARG 3.316 0.069 6 0 "[ . 1 . 2]"
1 32 GLY 0.933 0.036 19 0 "[ . 1 . 2]"
1 33 ILE 4.897 0.066 17 0 "[ . 1 . 2]"
1 34 ALA 3.568 0.065 11 0 "[ . 1 . 2]"
1 35 ALA 2.929 0.077 13 0 "[ . 1 . 2]"
1 36 ASP 1.746 0.053 14 0 "[ . 1 . 2]"
1 37 GLY 0.831 0.039 11 0 "[ . 1 . 2]"
1 38 ALA 0.620 0.039 11 0 "[ . 1 . 2]"
1 39 ASN 5.327 0.089 19 0 "[ . 1 . 2]"
1 40 ALA 4.501 0.065 4 0 "[ . 1 . 2]"
1 41 LEU 7.383 0.104 4 0 "[ . 1 . 2]"
1 42 LEU 8.111 0.102 4 0 "[ . 1 . 2]"
1 43 PRO 5.763 0.092 15 0 "[ . 1 . 2]"
1 44 ALA 2.403 0.056 11 0 "[ . 1 . 2]"
1 45 ASN 3.332 0.104 4 0 "[ . 1 . 2]"
1 46 ARG 3.788 0.094 11 0 "[ . 1 . 2]"
1 47 ALA 1.222 0.031 11 0 "[ . 1 . 2]"
1 48 MET 1.132 0.045 8 0 "[ . 1 . 2]"
1 49 ALA 4.302 0.151 10 0 "[ . 1 . 2]"
1 50 TYR 17.824 1.261 17 15 "[ ********1 * -* +***]"
1 51 LEU 8.380 0.081 12 0 "[ . 1 . 2]"
1 52 LYS 6.019 0.151 10 0 "[ . 1 . 2]"
1 53 ILE 13.155 0.483 19 0 "[ . 1 . 2]"
1 54 GLN 4.252 0.138 15 0 "[ . 1 . 2]"
1 55 LYS 27.908 1.261 17 15 "[ ********1 * -* +***]"
1 56 TYR 5.273 0.081 12 0 "[ . 1 . 2]"
1 57 GLU 1.907 0.065 12 0 "[ . 1 . 2]"
1 58 GLU 4.577 0.159 9 0 "[ . 1 . 2]"
1 59 ALA 1.918 0.071 16 0 "[ . 1 . 2]"
1 60 GLU 1.088 0.047 14 0 "[ . 1 . 2]"
1 61 LYS 1.867 0.111 9 0 "[ . 1 . 2]"
1 62 ASP 1.699 0.062 16 0 "[ . 1 . 2]"
1 63 CYS 2.004 0.038 15 0 "[ . 1 . 2]"
1 64 THR 3.081 0.038 15 0 "[ . 1 . 2]"
1 65 GLN 5.342 0.063 4 0 "[ . 1 . 2]"
1 66 ALA 1.871 0.037 3 0 "[ . 1 . 2]"
1 67 ILE 6.853 0.110 17 0 "[ . 1 . 2]"
1 68 LEU 5.245 0.091 20 0 "[ . 1 . 2]"
1 69 LEU 5.681 0.089 14 0 "[ . 1 . 2]"
1 70 ASP 4.825 0.091 20 0 "[ . 1 . 2]"
1 71 GLY 2.771 0.082 3 0 "[ . 1 . 2]"
1 72 SER 3.081 0.082 3 0 "[ . 1 . 2]"
1 73 TYR 7.474 0.110 17 0 "[ . 1 . 2]"
1 74 SER 4.024 0.099 14 0 "[ . 1 . 2]"
1 75 LYS 5.713 0.070 19 0 "[ . 1 . 2]"
1 76 ALA 2.978 0.059 10 0 "[ . 1 . 2]"
1 77 PHE 3.371 0.097 4 0 "[ . 1 . 2]"
1 78 ALA 1.652 0.046 18 0 "[ . 1 . 2]"
1 79 ARG 4.407 0.070 14 0 "[ . 1 . 2]"
1 80 ARG 5.026 0.104 15 0 "[ . 1 . 2]"
1 81 GLY 2.067 0.052 13 0 "[ . 1 . 2]"
1 82 THR 2.950 0.091 7 0 "[ . 1 . 2]"
1 83 ALA 4.286 0.070 18 0 "[ . 1 . 2]"
1 84 ARG 8.038 0.111 9 0 "[ . 1 . 2]"
1 85 THR 2.334 0.045 8 0 "[ . 1 . 2]"
1 86 PHE 1.423 0.049 19 0 "[ . 1 . 2]"
1 87 LEU 7.549 0.054 9 0 "[ . 1 . 2]"
1 88 GLY 2.071 0.054 18 0 "[ . 1 . 2]"
1 89 LYS 1.110 0.077 18 0 "[ . 1 . 2]"
1 90 LEU 6.122 0.091 7 0 "[ . 1 . 2]"
1 91 ASN 3.322 0.089 14 0 "[ . 1 . 2]"
1 92 GLU 2.340 0.089 14 0 "[ . 1 . 2]"
1 93 ALA 2.486 0.098 9 0 "[ . 1 . 2]"
1 94 LYS 4.088 0.062 11 0 "[ . 1 . 2]"
1 95 GLN 3.793 0.106 8 0 "[ . 1 . 2]"
1 96 ASP 3.370 0.078 3 0 "[ . 1 . 2]"
1 97 PHE 5.546 0.054 12 0 "[ . 1 . 2]"
1 98 GLU 3.854 0.058 11 0 "[ . 1 . 2]"
1 99 THR 4.407 0.099 14 0 "[ . 1 . 2]"
1 100 VAL 3.003 0.055 15 0 "[ . 1 . 2]"
1 101 LEU 2.765 0.077 2 0 "[ . 1 . 2]"
1 102 LEU 4.784 0.077 2 0 "[ . 1 . 2]"
1 103 LEU 1.650 0.048 17 0 "[ . 1 . 2]"
1 104 GLU 2.244 0.059 12 0 "[ . 1 . 2]"
1 105 PRO 0.398 0.040 1 0 "[ . 1 . 2]"
1 106 GLY 0.672 0.053 6 0 "[ . 1 . 2]"
1 107 ASN 4.958 0.092 13 0 "[ . 1 . 2]"
1 108 LYS 3.478 0.092 13 0 "[ . 1 . 2]"
1 109 GLN 4.802 0.060 7 0 "[ . 1 . 2]"
1 110 ALA 3.551 0.070 8 0 "[ . 1 . 2]"
1 111 VAL 4.659 0.069 2 0 "[ . 1 . 2]"
1 112 THR 3.545 0.069 10 0 "[ . 1 . 2]"
1 113 GLU 3.183 0.103 9 0 "[ . 1 . 2]"
1 114 LEU 8.562 0.085 12 0 "[ . 1 . 2]"
1 115 SER 3.941 1.339 9 1 "[ . +1 . 2]"
1 116 LYS 2.306 0.090 12 0 "[ . 1 . 2]"
1 117 ILE 3.954 0.090 12 0 "[ . 1 . 2]"
1 118 LYS 1.238 0.062 2 0 "[ . 1 . 2]"
1 119 LYS 2.101 1.339 9 1 "[ . +1 . 2]"
1 120 LYS 0.833 0.062 19 0 "[ . 1 . 2]"
2 2 GLY 0.098 0.017 4 0 "[ . 1 . 2]"
2 3 PRO 1.709 0.413 14 0 "[ . 1 . 2]"
2 4 THR 11.765 0.673 15 5 "[ . * **+ * 2]"
2 5 ILE 18.980 0.826 15 6 "[* . * -1 * + * 2]"
2 6 GLU 15.245 0.826 15 6 "[* . * -1 * + * 2]"
2 7 GLU 4.984 0.640 14 4 "[ . * +- * 2]"
2 8 VAL 5.779 0.279 15 0 "[ . 1 . 2]"
2 9 ASP 2.162 0.064 3 0 "[ . 1 . 2]"
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 2 PRO HA 1 3 HIS QB . . 5.230 5.214 5.164 5.264 0.034 16 0 "[ . 1 . 2]" 1
2 1 2 PRO HA 1 4 MET H . . 5.250 4.784 4.321 5.017 . 0 0 "[ . 1 . 2]" 1
3 1 2 PRO HA 1 5 GLN H . . 3.780 3.530 3.037 3.797 0.017 19 0 "[ . 1 . 2]" 1
4 1 2 PRO HA 1 5 GLN QB . . 2.760 2.495 2.158 2.771 0.011 12 0 "[ . 1 . 2]" 1
5 1 2 PRO HA 1 5 GLN QG . . 4.170 3.784 3.396 4.133 . 0 0 "[ . 1 . 2]" 1
6 1 2 PRO HA 1 6 ALA H . . 5.730 4.983 4.752 5.413 . 0 0 "[ . 1 . 2]" 1
7 1 2 PRO HA 1 35 ALA MB . . 3.760 3.396 2.858 3.785 0.025 7 0 "[ . 1 . 2]" 1
8 1 2 PRO HB2 1 3 HIS H . . 4.330 3.229 2.548 3.872 . 0 0 "[ . 1 . 2]" 1
9 1 2 PRO HB2 1 3 HIS QB . . 4.950 4.411 3.970 4.958 0.008 2 0 "[ . 1 . 2]" 1
10 1 2 PRO HB3 1 35 ALA MB . . 4.320 3.880 3.148 4.326 0.006 3 0 "[ . 1 . 2]" 1
11 1 2 PRO HD2 1 4 MET H . . 5.120 5.086 4.889 5.160 0.040 1 0 "[ . 1 . 2]" 1
12 1 2 PRO HD3 1 3 HIS H . . 4.780 4.252 4.038 4.560 . 0 0 "[ . 1 . 2]" 1
13 1 3 HIS H 1 3 HIS QB . . 3.520 2.280 2.193 2.346 . 0 0 "[ . 1 . 2]" 1
14 1 3 HIS H 1 4 MET H . . 5.060 2.604 2.330 2.878 . 0 0 "[ . 1 . 2]" 1
15 1 3 HIS HA 1 3 HIS QB . . 2.750 2.361 2.335 2.389 . 0 0 "[ . 1 . 2]" 1
16 1 3 HIS HA 1 3 HIS HD2 . . 4.180 3.965 3.779 4.157 . 0 0 "[ . 1 . 2]" 1
17 1 3 HIS HA 1 6 ALA H . . 4.240 3.749 3.616 3.839 . 0 0 "[ . 1 . 2]" 1
18 1 3 HIS HA 1 6 ALA MB . . 3.440 3.246 2.990 3.414 . 0 0 "[ . 1 . 2]" 1
19 1 3 HIS HA 1 7 ILE H . . 5.570 5.253 4.970 5.444 . 0 0 "[ . 1 . 2]" 1
20 1 3 HIS QB 1 3 HIS HD2 . . 3.330 2.777 2.719 2.851 . 0 0 "[ . 1 . 2]" 1
21 1 3 HIS QB 1 4 MET H . . 3.460 2.407 2.264 2.542 . 0 0 "[ . 1 . 2]" 1
22 1 3 HIS QB 1 4 MET HA . . 4.310 4.219 4.137 4.311 0.001 14 0 "[ . 1 . 2]" 1
23 1 3 HIS QB 1 4 MET HB2 . . 4.890 4.661 4.503 4.862 . 0 0 "[ . 1 . 2]" 1
24 1 3 HIS QB 1 4 MET ME . . 5.400 4.086 2.714 5.408 0.008 7 0 "[ . 1 . 2]" 1
25 1 3 HIS QB 1 4 MET QG . . 4.620 3.439 3.124 4.093 . 0 0 "[ . 1 . 2]" 1
26 1 3 HIS QB 1 5 GLN H . . 4.860 4.512 4.417 4.646 . 0 0 "[ . 1 . 2]" 1
27 1 3 HIS QB 1 6 ALA H . . 5.060 5.081 5.044 5.102 0.042 5 0 "[ . 1 . 2]" 1
28 1 3 HIS QB 1 6 ALA MB . . 4.760 4.721 4.547 4.779 0.019 10 0 "[ . 1 . 2]" 1
29 1 3 HIS QB 1 7 ILE MD . . 4.210 4.190 4.086 4.230 0.020 17 0 "[ . 1 . 2]" 1
30 1 3 HIS HD2 1 4 MET H . . 4.640 3.349 3.170 3.482 . 0 0 "[ . 1 . 2]" 1
31 1 3 HIS HD2 1 4 MET HA . . 4.600 2.864 2.763 3.011 . 0 0 "[ . 1 . 2]" 1
32 1 3 HIS HD2 1 4 MET HB2 . . 4.940 4.927 4.706 4.986 0.046 20 0 "[ . 1 . 2]" 1
33 1 3 HIS HD2 1 4 MET QG . . 4.510 3.137 2.626 3.627 . 0 0 "[ . 1 . 2]" 1
34 1 3 HIS HD2 1 6 ALA MB . . 5.030 4.678 4.373 5.040 0.010 14 0 "[ . 1 . 2]" 1
35 1 3 HIS HD2 1 7 ILE HB . . 4.920 4.927 4.747 4.958 0.038 12 0 "[ . 1 . 2]" 1
36 1 3 HIS HD2 1 7 ILE MD . . 4.530 2.367 2.287 2.477 . 0 0 "[ . 1 . 2]" 1
37 1 4 MET H 1 4 MET HB2 . . 3.770 2.513 2.403 2.676 . 0 0 "[ . 1 . 2]" 1
38 1 4 MET H 1 4 MET QG . . 3.060 2.492 2.132 3.080 0.020 2 0 "[ . 1 . 2]" 1
39 1 4 MET H 1 5 GLN H . . 3.420 2.698 2.593 2.783 . 0 0 "[ . 1 . 2]" 1
40 1 4 MET HA 1 4 MET QG . . 3.280 2.677 2.253 3.096 . 0 0 "[ . 1 . 2]" 1
41 1 4 MET HA 1 5 GLN H . . 3.460 3.475 3.453 3.500 0.040 19 0 "[ . 1 . 2]" 1
42 1 4 MET HA 1 6 ALA H . . 3.950 3.653 3.446 3.836 . 0 0 "[ . 1 . 2]" 1
43 1 4 MET HA 1 7 ILE H . . 3.700 3.125 2.889 3.279 . 0 0 "[ . 1 . 2]" 1
44 1 4 MET HA 1 7 ILE HB . . 3.150 2.908 2.747 3.054 . 0 0 "[ . 1 . 2]" 1
45 1 4 MET HA 1 7 ILE MD . . 3.450 2.075 1.986 2.169 . 0 0 "[ . 1 . 2]" 1
46 1 4 MET HA 1 7 ILE HG12 . . 4.480 4.487 4.328 4.524 0.044 19 0 "[ . 1 . 2]" 1
47 1 4 MET HA 1 7 ILE HG13 . . 4.740 4.582 4.422 4.762 0.022 17 0 "[ . 1 . 2]" 1
48 1 4 MET HB2 1 5 GLN HA . . 4.490 4.505 4.411 4.529 0.039 9 0 "[ . 1 . 2]" 1
49 1 4 MET HB2 1 8 SER H . . 5.820 5.538 5.335 5.767 . 0 0 "[ . 1 . 2]" 1
50 1 4 MET HB3 1 4 MET QG . . 2.610 2.286 2.145 2.435 . 0 0 "[ . 1 . 2]" 1
51 1 4 MET HB3 1 7 ILE HB . . 4.580 4.035 3.737 4.234 . 0 0 "[ . 1 . 2]" 1
52 1 4 MET HB3 1 7 ILE MD . . 3.950 3.865 3.647 3.965 0.015 17 0 "[ . 1 . 2]" 1
53 1 4 MET HB3 1 8 SER H . . 5.080 4.665 4.382 4.870 . 0 0 "[ . 1 . 2]" 1
54 1 4 MET QG 1 7 ILE MD . . 4.570 3.475 2.879 4.012 . 0 0 "[ . 1 . 2]" 1
55 1 5 GLN H 1 5 GLN QB . . 2.630 2.183 2.103 2.254 . 0 0 "[ . 1 . 2]" 1
56 1 5 GLN H 1 5 GLN QG . . 4.080 4.034 3.913 4.086 0.006 4 0 "[ . 1 . 2]" 1
57 1 5 GLN H 1 6 ALA H . . 3.320 2.642 2.578 2.687 . 0 0 "[ . 1 . 2]" 1
58 1 5 GLN H 1 6 ALA MB . . 4.220 4.256 4.237 4.271 0.051 20 0 "[ . 1 . 2]" 1
59 1 5 GLN H 1 7 ILE H . . 4.510 4.223 4.131 4.357 . 0 0 "[ . 1 . 2]" 1
60 1 5 GLN HA 1 5 GLN QB . . 2.680 2.423 2.275 2.497 . 0 0 "[ . 1 . 2]" 1
61 1 5 GLN HA 1 5 GLN QG . . 3.150 2.867 2.379 3.131 . 0 0 "[ . 1 . 2]" 1
62 1 5 GLN HA 1 6 ALA H . . 3.400 3.451 3.403 3.477 0.077 14 0 "[ . 1 . 2]" 1
63 1 5 GLN HA 1 8 SER H . . 3.970 3.303 3.096 3.593 . 0 0 "[ . 1 . 2]" 1
64 1 5 GLN QB 1 5 GLN QE . . 3.980 3.535 2.493 3.781 . 0 0 "[ . 1 . 2]" 1
65 1 5 GLN QB 1 6 ALA H . . 3.400 2.995 2.764 3.404 0.004 18 0 "[ . 1 . 2]" 1
66 1 5 GLN QB 1 7 ILE H . . 5.450 4.883 4.676 5.130 . 0 0 "[ . 1 . 2]" 1
67 1 5 GLN QB 1 8 SER H . . 5.610 4.995 4.855 5.292 . 0 0 "[ . 1 . 2]" 1
68 1 5 GLN QB 1 35 ALA H . . 6.000 5.727 5.522 6.007 0.007 10 0 "[ . 1 . 2]" 1
69 1 5 GLN QB 1 35 ALA HA . . 5.160 5.146 5.045 5.191 0.031 5 0 "[ . 1 . 2]" 1
70 1 5 GLN QB 1 35 ALA MB . . 3.250 2.717 2.588 2.786 . 0 0 "[ . 1 . 2]" 1
71 1 5 GLN QE 1 5 GLN QG . . 3.080 2.210 2.085 2.387 . 0 0 "[ . 1 . 2]" 1
72 1 5 GLN QE 1 35 ALA MB . . 4.000 3.859 3.014 4.048 0.048 17 0 "[ . 1 . 2]" 1
73 1 5 GLN QG 1 6 ALA H . . 4.540 4.176 3.679 4.442 . 0 0 "[ . 1 . 2]" 1
74 1 5 GLN QG 1 6 ALA HA . . 4.610 4.215 3.557 4.599 . 0 0 "[ . 1 . 2]" 1
75 1 5 GLN QG 1 35 ALA HA . . 4.440 4.395 4.214 4.517 0.077 13 0 "[ . 1 . 2]" 1
76 1 5 GLN QG 1 35 ALA MB . . 3.440 2.153 2.030 2.304 . 0 0 "[ . 1 . 2]" 1
77 1 6 ALA H 1 6 ALA HA . . 2.940 2.945 2.937 2.962 0.022 18 0 "[ . 1 . 2]" 1
78 1 6 ALA H 1 6 ALA MB . . 2.640 2.241 2.217 2.276 . 0 0 "[ . 1 . 2]" 1
79 1 6 ALA H 1 7 ILE H . . 3.200 2.366 2.271 2.423 . 0 0 "[ . 1 . 2]" 1
80 1 6 ALA H 1 7 ILE HA . . 5.100 5.099 4.999 5.125 0.025 14 0 "[ . 1 . 2]" 1
81 1 6 ALA H 1 7 ILE HB . . 4.420 4.466 4.448 4.489 0.069 13 0 "[ . 1 . 2]" 1
82 1 6 ALA H 1 7 ILE MD . . 4.860 3.359 3.206 3.474 . 0 0 "[ . 1 . 2]" 1
83 1 6 ALA H 1 7 ILE MG . . 5.730 5.674 5.634 5.688 . 0 0 "[ . 1 . 2]" 1
84 1 6 ALA H 1 8 SER H . . 4.290 3.788 3.662 3.857 . 0 0 "[ . 1 . 2]" 1
85 1 6 ALA H 1 36 ASP HB2 . . 5.440 4.826 4.388 5.275 . 0 0 "[ . 1 . 2]" 1
86 1 6 ALA HA 1 7 ILE MD . . 4.970 4.913 4.704 4.984 0.014 16 0 "[ . 1 . 2]" 1
87 1 6 ALA HA 1 7 ILE HG13 . . 5.570 5.612 5.597 5.654 0.084 14 0 "[ . 1 . 2]" 1
88 1 6 ALA HA 1 9 GLU H . . 4.070 3.654 3.488 3.825 . 0 0 "[ . 1 . 2]" 1
89 1 6 ALA HA 1 9 GLU HB2 . . 4.080 3.660 3.475 3.842 . 0 0 "[ . 1 . 2]" 1
90 1 6 ALA HA 1 9 GLU HG2 . . 3.920 3.438 3.165 3.664 . 0 0 "[ . 1 . 2]" 1
91 1 6 ALA HA 1 9 GLU HG3 . . 4.650 4.640 4.518 4.702 0.052 18 0 "[ . 1 . 2]" 1
92 1 6 ALA HA 1 10 LYS H . . 5.030 4.387 4.123 4.730 . 0 0 "[ . 1 . 2]" 1
93 1 6 ALA HA 1 32 GLY H . . 5.380 5.325 5.046 5.411 0.031 13 0 "[ . 1 . 2]" 1
94 1 6 ALA HA 1 32 GLY HA2 . . 3.720 3.497 3.111 3.721 0.001 16 0 "[ . 1 . 2]" 1
95 1 6 ALA HA 1 32 GLY HA3 . . 3.930 3.330 3.001 3.484 . 0 0 "[ . 1 . 2]" 1
96 1 6 ALA HA 1 42 LEU MD1 . . 3.990 2.661 2.424 2.762 . 0 0 "[ . 1 . 2]" 1
97 1 6 ALA HA 1 42 LEU MD2 . . 4.330 2.710 2.433 2.971 . 0 0 "[ . 1 . 2]" 1
98 1 6 ALA MB 1 7 ILE H . . 3.070 2.785 2.475 3.038 . 0 0 "[ . 1 . 2]" 1
99 1 6 ALA MB 1 8 SER H . . 4.900 4.626 4.506 4.745 . 0 0 "[ . 1 . 2]" 1
100 1 6 ALA MB 1 32 GLY HA3 . . 4.390 4.214 3.990 4.389 . 0 0 "[ . 1 . 2]" 1
101 1 6 ALA MB 1 36 ASP HB2 . . 3.510 2.855 2.481 3.446 . 0 0 "[ . 1 . 2]" 1
102 1 6 ALA MB 1 36 ASP HB3 . . 3.760 3.184 2.734 3.510 . 0 0 "[ . 1 . 2]" 1
103 1 6 ALA MB 1 39 ASN HB2 . . 4.840 3.565 3.342 3.810 . 0 0 "[ . 1 . 2]" 1
104 1 6 ALA MB 1 39 ASN HD22 . . 4.910 4.665 4.332 4.943 0.033 10 0 "[ . 1 . 2]" 1
105 1 6 ALA MB 1 42 LEU MD1 . . 3.070 2.302 2.091 2.521 . 0 0 "[ . 1 . 2]" 1
106 1 7 ILE H 1 7 ILE HB . . 3.070 2.382 2.343 2.440 . 0 0 "[ . 1 . 2]" 1
107 1 7 ILE H 1 7 ILE MD . . 3.630 2.144 1.916 2.268 . 0 0 "[ . 1 . 2]" 1
108 1 7 ILE H 1 7 ILE HG12 . . 4.110 4.054 3.875 4.130 0.020 19 0 "[ . 1 . 2]" 1
109 1 7 ILE H 1 7 ILE HG13 . . 3.440 3.068 2.833 3.228 . 0 0 "[ . 1 . 2]" 1
110 1 7 ILE H 1 7 ILE MG . . 3.770 3.780 3.771 3.796 0.026 18 0 "[ . 1 . 2]" 1
111 1 7 ILE H 1 8 SER H . . 3.550 2.482 2.328 2.721 . 0 0 "[ . 1 . 2]" 1
112 1 7 ILE H 1 9 GLU HG2 . . 5.900 5.669 5.507 5.890 . 0 0 "[ . 1 . 2]" 1
113 1 7 ILE H 1 10 LYS H . . 4.940 4.744 4.648 4.866 . 0 0 "[ . 1 . 2]" 1
114 1 7 ILE H 1 10 LYS HE3 . . 5.180 5.015 4.768 5.187 0.007 19 0 "[ . 1 . 2]" 1
115 1 7 ILE H 1 42 LEU MD1 . . 6.000 5.441 5.130 5.570 . 0 0 "[ . 1 . 2]" 1
116 1 7 ILE H 1 42 LEU MD2 . . 5.550 5.213 4.958 5.349 . 0 0 "[ . 1 . 2]" 1
117 1 7 ILE HA 1 7 ILE MD . . 3.580 3.503 3.413 3.550 . 0 0 "[ . 1 . 2]" 1
118 1 7 ILE HA 1 7 ILE HG12 . . 3.660 3.345 3.282 3.474 . 0 0 "[ . 1 . 2]" 1
119 1 7 ILE HA 1 7 ILE HG13 . . 3.760 2.268 2.203 2.356 . 0 0 "[ . 1 . 2]" 1
120 1 7 ILE HA 1 7 ILE MG . . 2.930 2.426 2.377 2.489 . 0 0 "[ . 1 . 2]" 1
121 1 7 ILE HA 1 8 SER H . . 3.570 3.558 3.536 3.589 0.019 13 0 "[ . 1 . 2]" 1
122 1 7 ILE HA 1 10 LYS H . . 3.850 3.273 3.105 3.389 . 0 0 "[ . 1 . 2]" 1
123 1 7 ILE HA 1 10 LYS QB . . 3.440 2.191 2.100 2.285 . 0 0 "[ . 1 . 2]" 1
124 1 7 ILE HA 1 10 LYS HE2 . . 4.040 2.421 2.207 2.665 . 0 0 "[ . 1 . 2]" 1
125 1 7 ILE HA 1 10 LYS HE3 . . 4.580 2.200 2.070 2.375 . 0 0 "[ . 1 . 2]" 1
126 1 7 ILE HA 1 11 ASP H . . 4.240 3.736 3.624 3.877 . 0 0 "[ . 1 . 2]" 1
127 1 7 ILE HB 1 7 ILE MD . . 3.060 2.256 2.235 2.279 . 0 0 "[ . 1 . 2]" 1
128 1 7 ILE HB 1 8 SER H . . 3.630 2.693 2.628 2.749 . 0 0 "[ . 1 . 2]" 1
129 1 7 ILE HB 1 8 SER HB2 . . 4.940 4.972 4.951 4.991 0.051 12 0 "[ . 1 . 2]" 1
130 1 7 ILE HB 1 10 LYS HE3 . . 4.590 4.500 4.372 4.614 0.024 17 0 "[ . 1 . 2]" 1
131 1 7 ILE MD 1 7 ILE MG . . 3.110 3.041 2.989 3.106 . 0 0 "[ . 1 . 2]" 1
132 1 7 ILE MD 1 8 SER H . . 4.210 3.973 3.815 4.050 . 0 0 "[ . 1 . 2]" 1
133 1 7 ILE MD 1 10 LYS HE2 . . 4.790 4.504 4.249 4.796 0.006 17 0 "[ . 1 . 2]" 1
134 1 7 ILE MD 1 10 LYS HE3 . . 4.720 4.557 4.370 4.731 0.011 17 0 "[ . 1 . 2]" 1
135 1 7 ILE HG12 1 7 ILE MG . . 2.810 2.148 2.121 2.177 . 0 0 "[ . 1 . 2]" 1
136 1 7 ILE HG12 1 8 SER H . . 5.230 5.258 5.215 5.276 0.046 8 0 "[ . 1 . 2]" 1
137 1 7 ILE HG13 1 7 ILE MG . . 3.290 2.859 2.813 2.891 . 0 0 "[ . 1 . 2]" 1
138 1 7 ILE HG13 1 8 SER H . . 4.820 4.747 4.699 4.791 . 0 0 "[ . 1 . 2]" 1
139 1 7 ILE MG 1 8 SER H . . 3.610 3.401 3.345 3.454 . 0 0 "[ . 1 . 2]" 1
140 1 7 ILE MG 1 8 SER HA . . 4.030 3.436 3.295 3.571 . 0 0 "[ . 1 . 2]" 1
141 1 7 ILE MG 1 8 SER HB2 . . 5.170 5.141 5.042 5.199 0.029 17 0 "[ . 1 . 2]" 1
142 1 7 ILE MG 1 10 LYS H . . 4.690 4.412 4.218 4.527 . 0 0 "[ . 1 . 2]" 1
143 1 7 ILE MG 1 10 LYS HE2 . . 3.560 3.532 3.323 3.590 0.030 1 0 "[ . 1 . 2]" 1
144 1 7 ILE MG 1 10 LYS HE3 . . 3.310 2.155 2.010 2.298 . 0 0 "[ . 1 . 2]" 1
145 1 7 ILE MG 1 11 ASP H . . 4.170 3.413 3.275 3.504 . 0 0 "[ . 1 . 2]" 1
146 1 7 ILE MG 1 11 ASP HA . . 4.770 4.821 4.788 4.844 0.074 9 0 "[ . 1 . 2]" 1
147 1 7 ILE MG 1 11 ASP HB2 . . 3.920 3.652 3.508 3.747 . 0 0 "[ . 1 . 2]" 1
148 1 7 ILE MG 1 11 ASP HB3 . . 4.610 4.608 4.501 4.639 0.029 19 0 "[ . 1 . 2]" 1
149 1 8 SER H 1 8 SER HB2 . . 3.580 2.376 2.292 2.460 . 0 0 "[ . 1 . 2]" 1
150 1 8 SER H 1 8 SER HB3 . . 4.100 3.593 3.550 3.632 . 0 0 "[ . 1 . 2]" 1
151 1 8 SER H 1 9 GLU HB2 . . 5.410 5.432 5.410 5.442 0.032 20 0 "[ . 1 . 2]" 1
152 1 8 SER H 1 11 ASP H . . 5.060 4.854 4.748 4.958 . 0 0 "[ . 1 . 2]" 1
153 1 8 SER HA 1 11 ASP H . . 4.190 3.784 3.407 3.966 . 0 0 "[ . 1 . 2]" 1
154 1 8 SER HA 1 12 ARG H . . 4.160 3.811 3.621 3.980 . 0 0 "[ . 1 . 2]" 1
155 1 8 SER HA 1 12 ARG HD2 . . 4.620 3.910 3.279 4.489 . 0 0 "[ . 1 . 2]" 1
156 1 8 SER HA 1 12 ARG QG . . 3.950 3.616 3.288 3.789 . 0 0 "[ . 1 . 2]" 1
157 1 8 SER HB2 1 9 GLU H . . 3.730 2.637 2.497 2.869 . 0 0 "[ . 1 . 2]" 1
158 1 8 SER HB2 1 10 LYS H . . 5.230 4.941 4.822 5.112 . 0 0 "[ . 1 . 2]" 1
159 1 8 SER HB3 1 9 GLU H . . 3.640 3.405 3.181 3.641 0.001 14 0 "[ . 1 . 2]" 1
160 1 8 SER HB3 1 10 LYS H . . 5.590 5.428 5.320 5.515 . 0 0 "[ . 1 . 2]" 1
161 1 8 SER HB3 1 12 ARG H . . 5.170 4.996 4.703 5.184 0.014 12 0 "[ . 1 . 2]" 1
162 1 8 SER HB3 1 12 ARG QB . . 4.730 4.574 4.277 4.761 0.031 14 0 "[ . 1 . 2]" 1
163 1 9 GLU H 1 9 GLU HB2 . . 3.740 2.684 2.594 2.762 . 0 0 "[ . 1 . 2]" 1
164 1 9 GLU H 1 9 GLU HB3 . . 3.930 3.667 3.633 3.700 . 0 0 "[ . 1 . 2]" 1
165 1 9 GLU H 1 9 GLU HG2 . . 3.410 2.270 2.103 2.397 . 0 0 "[ . 1 . 2]" 1
166 1 9 GLU H 1 9 GLU HG3 . . 4.230 3.729 3.622 3.793 . 0 0 "[ . 1 . 2]" 1
167 1 9 GLU H 1 10 LYS H . . 3.410 2.709 2.645 2.766 . 0 0 "[ . 1 . 2]" 1
168 1 9 GLU H 1 12 ARG QB . . 5.380 4.718 4.535 4.868 . 0 0 "[ . 1 . 2]" 1
169 1 9 GLU H 1 42 LEU MD2 . . 4.290 3.997 3.750 4.148 . 0 0 "[ . 1 . 2]" 1
170 1 9 GLU HA 1 9 GLU HG2 . . 3.680 3.532 3.383 3.685 0.005 16 0 "[ . 1 . 2]" 1
171 1 9 GLU HA 1 10 LYS HA . . 4.910 4.818 4.760 4.869 . 0 0 "[ . 1 . 2]" 1
172 1 9 GLU HA 1 12 ARG H . . 4.610 3.503 3.370 3.740 . 0 0 "[ . 1 . 2]" 1
173 1 9 GLU HA 1 12 ARG QB . . 3.300 2.462 2.172 2.785 . 0 0 "[ . 1 . 2]" 1
174 1 9 GLU HA 1 12 ARG HD2 . . 5.000 3.186 2.613 3.985 . 0 0 "[ . 1 . 2]" 1
175 1 9 GLU HA 1 12 ARG HD3 . . 4.710 4.329 3.827 4.734 0.024 9 0 "[ . 1 . 2]" 1
176 1 9 GLU HA 1 13 GLY H . . 4.190 3.055 2.976 3.177 . 0 0 "[ . 1 . 2]" 1
177 1 9 GLU HA 1 13 GLY HA3 . . 4.500 4.507 4.430 4.542 0.042 4 0 "[ . 1 . 2]" 1
178 1 9 GLU HA 1 28 CYS HB3 . . 4.240 2.905 2.754 3.051 . 0 0 "[ . 1 . 2]" 1
179 1 9 GLU HA 1 28 CYS HG . . 4.090 4.109 4.095 4.118 0.028 19 0 "[ . 1 . 2]" 1
180 1 9 GLU HA 1 29 TYR H . . 5.300 5.239 5.117 5.311 0.011 16 0 "[ . 1 . 2]" 1
181 1 9 GLU HA 1 42 LEU MD2 . . 4.900 4.669 4.556 4.768 . 0 0 "[ . 1 . 2]" 1
182 1 9 GLU HB2 1 10 LYS H . . 3.850 2.991 2.891 3.085 . 0 0 "[ . 1 . 2]" 1
183 1 9 GLU HB2 1 29 TYR HA . . 4.370 2.945 2.836 3.020 . 0 0 "[ . 1 . 2]" 1
184 1 9 GLU HB2 1 32 GLY H . . 4.220 3.764 3.550 3.891 . 0 0 "[ . 1 . 2]" 1
185 1 9 GLU HB3 1 10 LYS H . . 4.180 4.063 3.975 4.144 . 0 0 "[ . 1 . 2]" 1
186 1 9 GLU HB3 1 10 LYS HA . . 4.820 4.811 4.766 4.861 0.041 20 0 "[ . 1 . 2]" 1
187 1 9 GLU HB3 1 13 GLY H . . 4.910 4.312 4.228 4.462 . 0 0 "[ . 1 . 2]" 1
188 1 9 GLU HB3 1 28 CYS HA . . 4.700 3.846 3.712 3.971 . 0 0 "[ . 1 . 2]" 1
189 1 9 GLU HB3 1 29 TYR H . . 4.300 3.697 3.552 3.836 . 0 0 "[ . 1 . 2]" 1
190 1 9 GLU HB3 1 29 TYR HA . . 4.310 2.284 2.205 2.423 . 0 0 "[ . 1 . 2]" 1
191 1 9 GLU HB3 1 30 THR H . . 4.820 4.879 4.844 4.914 0.094 16 0 "[ . 1 . 2]" 1
192 1 9 GLU HB3 1 32 GLY H . . 4.830 3.605 3.513 3.719 . 0 0 "[ . 1 . 2]" 1
193 1 9 GLU HB3 1 42 LEU MD2 . . 4.420 3.244 3.145 3.411 . 0 0 "[ . 1 . 2]" 1
194 1 9 GLU HG2 1 10 LYS H . . 4.290 4.308 4.238 4.327 0.037 6 0 "[ . 1 . 2]" 1
195 1 9 GLU HG2 1 29 TYR HA . . 4.460 4.495 4.421 4.525 0.065 3 0 "[ . 1 . 2]" 1
196 1 9 GLU HG2 1 32 GLY H . . 3.800 3.543 3.423 3.677 . 0 0 "[ . 1 . 2]" 1
197 1 9 GLU HG2 1 32 GLY HA2 . . 5.040 3.266 3.038 3.528 . 0 0 "[ . 1 . 2]" 1
198 1 9 GLU HG2 1 32 GLY HA3 . . 4.970 3.209 2.987 3.422 . 0 0 "[ . 1 . 2]" 1
199 1 9 GLU HG2 1 42 LEU MD2 . . 3.520 3.541 3.396 3.599 0.079 15 0 "[ . 1 . 2]" 1
200 1 9 GLU HG3 1 28 CYS HA . . 5.370 4.352 4.191 4.580 . 0 0 "[ . 1 . 2]" 1
201 1 9 GLU HG3 1 31 ARG HA . . 4.920 4.649 4.538 4.732 . 0 0 "[ . 1 . 2]" 1
202 1 9 GLU HG3 1 31 ARG HE . . 5.120 3.595 3.424 3.781 . 0 0 "[ . 1 . 2]" 1
203 1 9 GLU HG3 1 32 GLY H . . 3.790 2.156 2.056 2.285 . 0 0 "[ . 1 . 2]" 1
204 1 9 GLU HG3 1 32 GLY HA3 . . 4.880 2.944 2.798 3.093 . 0 0 "[ . 1 . 2]" 1
205 1 9 GLU HG3 1 33 ILE H . . 4.790 4.690 4.574 4.806 0.016 20 0 "[ . 1 . 2]" 1
206 1 9 GLU HG3 1 42 LEU MD2 . . 4.730 3.536 3.414 3.677 . 0 0 "[ . 1 . 2]" 1
207 1 10 LYS H 1 10 LYS QB . . 3.260 2.159 2.105 2.191 . 0 0 "[ . 1 . 2]" 1
208 1 10 LYS H 1 10 LYS HE2 . . 4.450 4.330 4.181 4.431 . 0 0 "[ . 1 . 2]" 1
209 1 10 LYS H 1 10 LYS HE3 . . 4.270 4.317 4.276 4.351 0.081 17 0 "[ . 1 . 2]" 1
210 1 10 LYS H 1 10 LYS HG2 . . 4.240 4.202 4.056 4.266 0.026 5 0 "[ . 1 . 2]" 1
211 1 10 LYS H 1 10 LYS HG3 . . 4.720 4.568 4.494 4.618 . 0 0 "[ . 1 . 2]" 1
212 1 10 LYS H 1 11 ASP H . . 3.700 2.749 2.632 2.833 . 0 0 "[ . 1 . 2]" 1
213 1 10 LYS H 1 11 ASP HB2 . . 5.280 4.714 4.531 4.846 . 0 0 "[ . 1 . 2]" 1
214 1 10 LYS H 1 13 GLY H . . 4.980 4.627 4.562 4.695 . 0 0 "[ . 1 . 2]" 1
215 1 10 LYS H 1 14 ASN H . . 5.490 5.533 5.515 5.552 0.062 4 0 "[ . 1 . 2]" 1
216 1 10 LYS H 1 42 LEU MD2 . . 3.690 3.462 3.143 3.612 . 0 0 "[ . 1 . 2]" 1
217 1 10 LYS HA 1 10 LYS HE2 . . 4.720 4.759 4.728 4.781 0.061 16 0 "[ . 1 . 2]" 1
218 1 10 LYS HA 1 10 LYS HE3 . . 4.990 4.954 4.860 5.002 0.012 18 0 "[ . 1 . 2]" 1
219 1 10 LYS HA 1 10 LYS HG2 . . 3.730 3.345 3.217 3.532 . 0 0 "[ . 1 . 2]" 1
220 1 10 LYS HA 1 11 ASP HA . . 4.930 4.769 4.722 4.837 . 0 0 "[ . 1 . 2]" 1
221 1 10 LYS HA 1 13 GLY H . . 4.980 4.123 4.017 4.234 . 0 0 "[ . 1 . 2]" 1
222 1 10 LYS HA 1 14 ASN H . . 3.980 3.642 3.592 3.739 . 0 0 "[ . 1 . 2]" 1
223 1 10 LYS HA 1 14 ASN HD22 . . 5.640 3.995 3.789 4.178 . 0 0 "[ . 1 . 2]" 1
224 1 10 LYS HA 1 28 CYS HB3 . . 5.560 5.570 5.477 5.618 0.058 18 0 "[ . 1 . 2]" 1
225 1 10 LYS HA 1 29 TYR QD . . 3.990 3.006 2.861 3.197 . 0 0 "[ . 1 . 2]" 1
226 1 10 LYS HA 1 29 TYR QE . . 4.350 2.217 2.128 2.330 . 0 0 "[ . 1 . 2]" 1
227 1 10 LYS HA 1 41 LEU MD1 . . 4.440 4.002 3.761 4.283 . 0 0 "[ . 1 . 2]" 1
228 1 10 LYS HA 1 42 LEU MD2 . . 4.130 3.704 3.529 3.850 . 0 0 "[ . 1 . 2]" 1
229 1 10 LYS QB 1 10 LYS HD2 . . 3.510 3.335 3.274 3.365 . 0 0 "[ . 1 . 2]" 1
230 1 10 LYS QB 1 10 LYS HE2 . . 3.880 2.203 2.153 2.237 . 0 0 "[ . 1 . 2]" 1
231 1 10 LYS QB 1 10 LYS HE3 . . 3.680 2.194 2.122 2.277 . 0 0 "[ . 1 . 2]" 1
232 1 10 LYS QB 1 11 ASP H . . 3.650 2.473 2.392 2.601 . 0 0 "[ . 1 . 2]" 1
233 1 10 LYS QB 1 11 ASP HA . . 4.520 4.456 4.355 4.528 0.008 15 0 "[ . 1 . 2]" 1
234 1 10 LYS QB 1 11 ASP HB3 . . 6.000 5.725 5.625 5.822 . 0 0 "[ . 1 . 2]" 1
235 1 10 LYS QB 1 14 ASN HD21 . . 5.110 4.717 4.619 4.860 . 0 0 "[ . 1 . 2]" 1
236 1 10 LYS HD3 1 14 ASN HD21 . . 5.470 4.745 4.476 4.994 . 0 0 "[ . 1 . 2]" 1
237 1 10 LYS HD3 1 14 ASN HD22 . . 4.470 3.880 3.641 4.121 . 0 0 "[ . 1 . 2]" 1
238 1 10 LYS HD3 1 39 ASN HD21 . . 5.190 5.248 5.220 5.279 0.089 19 0 "[ . 1 . 2]" 1
239 1 10 LYS HD3 1 41 LEU HB2 . . 5.330 5.240 5.089 5.349 0.019 1 0 "[ . 1 . 2]" 1
240 1 10 LYS HD3 1 41 LEU MD1 . . 3.860 3.240 2.752 3.652 . 0 0 "[ . 1 . 2]" 1
241 1 10 LYS HE2 1 11 ASP H . . 4.880 4.691 4.538 4.882 0.002 10 0 "[ . 1 . 2]" 1
242 1 10 LYS HE2 1 14 ASN HD22 . . 5.900 5.697 5.524 5.803 . 0 0 "[ . 1 . 2]" 1
243 1 10 LYS HE2 1 41 LEU MD1 . . 4.930 4.684 4.127 4.946 0.016 9 0 "[ . 1 . 2]" 1
244 1 10 LYS HE2 1 41 LEU MD2 . . 3.550 2.722 2.335 2.947 . 0 0 "[ . 1 . 2]" 1
245 1 10 LYS HE2 1 42 LEU MD2 . . 5.200 4.972 4.763 5.190 . 0 0 "[ . 1 . 2]" 1
246 1 10 LYS HE3 1 10 LYS HG2 . . 3.600 2.755 2.589 2.999 . 0 0 "[ . 1 . 2]" 1
247 1 10 LYS HE3 1 11 ASP H . . 3.910 3.668 3.456 3.868 . 0 0 "[ . 1 . 2]" 1
248 1 10 LYS HE3 1 14 ASN HD21 . . 6.000 5.578 5.204 5.805 . 0 0 "[ . 1 . 2]" 1
249 1 10 LYS HE3 1 14 ASN HD22 . . 5.630 5.568 5.257 5.684 0.054 18 0 "[ . 1 . 2]" 1
250 1 10 LYS HE3 1 41 LEU MD2 . . 4.080 3.975 3.742 4.100 0.020 5 0 "[ . 1 . 2]" 1
251 1 10 LYS HG2 1 11 ASP H . . 4.120 2.849 2.610 3.001 . 0 0 "[ . 1 . 2]" 1
252 1 10 LYS HG2 1 11 ASP HA . . 4.370 3.207 3.100 3.382 . 0 0 "[ . 1 . 2]" 1
253 1 10 LYS HG2 1 14 ASN H . . 5.320 4.925 4.666 5.189 . 0 0 "[ . 1 . 2]" 1
254 1 10 LYS HG2 1 14 ASN HD21 . . 4.920 2.962 2.689 3.273 . 0 0 "[ . 1 . 2]" 1
255 1 10 LYS HG2 1 14 ASN HD22 . . 4.630 3.147 2.793 3.595 . 0 0 "[ . 1 . 2]" 1
256 1 10 LYS HG2 1 45 ASN HD21 . . 6.000 5.460 5.139 5.695 . 0 0 "[ . 1 . 2]" 1
257 1 10 LYS HG3 1 14 ASN HD21 . . 5.050 3.009 2.645 3.170 . 0 0 "[ . 1 . 2]" 1
258 1 10 LYS HG3 1 14 ASN HD22 . . 4.720 2.169 2.103 2.304 . 0 0 "[ . 1 . 2]" 1
259 1 10 LYS HG3 1 45 ASN HD21 . . 5.360 3.973 3.624 4.288 . 0 0 "[ . 1 . 2]" 1
260 1 11 ASP H 1 11 ASP HB2 . . 3.770 2.423 2.384 2.479 . 0 0 "[ . 1 . 2]" 1
261 1 11 ASP H 1 11 ASP HB3 . . 4.180 3.597 3.576 3.614 . 0 0 "[ . 1 . 2]" 1
262 1 11 ASP H 1 12 ARG H . . 3.580 2.909 2.792 3.053 . 0 0 "[ . 1 . 2]" 1
263 1 11 ASP H 1 12 ARG QG . . 4.870 4.729 4.442 4.871 0.001 19 0 "[ . 1 . 2]" 1
264 1 11 ASP H 1 13 GLY H . . 4.710 4.541 4.429 4.631 . 0 0 "[ . 1 . 2]" 1
265 1 11 ASP H 1 14 ASN H . . 5.340 4.726 4.659 4.781 . 0 0 "[ . 1 . 2]" 1
266 1 11 ASP H 1 14 ASN HD21 . . 4.920 4.931 4.871 4.953 0.033 5 0 "[ . 1 . 2]" 1
267 1 11 ASP H 1 41 LEU MD2 . . 5.880 5.818 5.637 5.907 0.027 7 0 "[ . 1 . 2]" 1
268 1 11 ASP HA 1 12 ARG HA . . 5.710 4.878 4.769 4.956 . 0 0 "[ . 1 . 2]" 1
269 1 11 ASP HA 1 12 ARG QG . . 5.470 5.220 4.957 5.442 . 0 0 "[ . 1 . 2]" 1
270 1 11 ASP HA 1 13 GLY H . . 5.080 4.951 4.798 5.081 0.001 12 0 "[ . 1 . 2]" 1
271 1 11 ASP HA 1 14 ASN H . . 4.070 3.912 3.780 4.045 . 0 0 "[ . 1 . 2]" 1
272 1 11 ASP HA 1 14 ASN HB2 . . 3.800 2.839 2.677 2.918 . 0 0 "[ . 1 . 2]" 1
273 1 11 ASP HA 1 14 ASN HB3 . . 4.440 4.411 4.251 4.463 0.023 2 0 "[ . 1 . 2]" 1
274 1 11 ASP HA 1 14 ASN HD21 . . 4.110 3.362 3.265 3.478 . 0 0 "[ . 1 . 2]" 1
275 1 11 ASP HA 1 14 ASN HD22 . . 4.690 4.704 4.629 4.755 0.065 5 0 "[ . 1 . 2]" 1
276 1 11 ASP HA 1 15 GLY H . . 4.200 4.060 3.875 4.203 0.003 2 0 "[ . 1 . 2]" 1
277 1 11 ASP HB2 1 12 ARG H . . 3.800 2.516 2.421 2.678 . 0 0 "[ . 1 . 2]" 1
278 1 11 ASP HB2 1 12 ARG HA . . 4.470 4.493 4.481 4.507 0.037 10 0 "[ . 1 . 2]" 1
279 1 11 ASP HB2 1 12 ARG QB . . 4.480 4.497 4.374 4.519 0.039 18 0 "[ . 1 . 2]" 1
280 1 11 ASP HB2 1 14 ASN H . . 5.810 5.742 5.631 5.810 . 2 0 "[ . 1 . 2]" 1
281 1 11 ASP HB3 1 12 ARG H . . 3.700 3.344 3.178 3.560 . 0 0 "[ . 1 . 2]" 1
282 1 11 ASP HB3 1 12 ARG HA . . 4.850 4.233 4.006 4.446 . 0 0 "[ . 1 . 2]" 1
283 1 11 ASP HB3 1 12 ARG QB . . 6.000 5.138 4.858 5.301 . 0 0 "[ . 1 . 2]" 1
284 1 12 ARG H 1 12 ARG QB . . 3.080 2.347 2.294 2.386 . 0 0 "[ . 1 . 2]" 1
285 1 12 ARG H 1 12 ARG HD2 . . 3.950 3.696 3.560 3.887 . 0 0 "[ . 1 . 2]" 1
286 1 12 ARG H 1 12 ARG HD3 . . 4.750 4.655 4.579 4.754 0.004 4 0 "[ . 1 . 2]" 1
287 1 12 ARG H 1 12 ARG QG . . 3.290 2.399 2.279 2.500 . 0 0 "[ . 1 . 2]" 1
288 1 12 ARG H 1 13 GLY H . . 3.490 2.793 2.665 2.902 . 0 0 "[ . 1 . 2]" 1
289 1 12 ARG H 1 13 GLY HA3 . . 5.270 5.011 4.883 5.122 . 0 0 "[ . 1 . 2]" 1
290 1 12 ARG H 1 14 ASN H . . 4.640 4.183 4.019 4.299 . 0 0 "[ . 1 . 2]" 1
291 1 12 ARG H 1 15 GLY H . . 5.070 4.748 4.595 4.840 . 0 0 "[ . 1 . 2]" 1
292 1 12 ARG HA 1 12 ARG HD2 . . 4.810 4.627 4.528 4.710 . 0 0 "[ . 1 . 2]" 1
293 1 12 ARG HA 1 12 ARG HD3 . . 4.490 4.486 4.429 4.524 0.034 9 0 "[ . 1 . 2]" 1
294 1 12 ARG HA 1 12 ARG HE . . 5.080 4.989 4.792 5.124 0.044 6 0 "[ . 1 . 2]" 1
295 1 12 ARG HA 1 12 ARG QG . . 3.010 2.452 2.344 2.505 . 0 0 "[ . 1 . 2]" 1
296 1 12 ARG HA 1 15 GLY H . . 4.110 3.693 3.311 3.997 . 0 0 "[ . 1 . 2]" 1
297 1 12 ARG HA 1 16 PHE H . . 4.880 4.637 4.392 4.849 . 0 0 "[ . 1 . 2]" 1
298 1 12 ARG HA 1 16 PHE QD . . 5.170 5.170 4.970 5.224 0.054 13 0 "[ . 1 . 2]" 1
299 1 12 ARG HA 1 16 PHE QE . . 5.580 5.313 4.938 5.589 0.009 4 0 "[ . 1 . 2]" 1
300 1 12 ARG HA 1 28 CYS HG . . 5.080 4.196 3.922 5.080 0.000 16 0 "[ . 1 . 2]" 1
301 1 12 ARG QB 1 12 ARG HD2 . . 3.350 2.335 2.100 2.586 . 0 0 "[ . 1 . 2]" 1
302 1 12 ARG QB 1 12 ARG HD3 . . 3.290 2.397 2.316 2.601 . 0 0 "[ . 1 . 2]" 1
303 1 12 ARG QB 1 12 ARG HE . . 4.130 3.946 3.879 4.020 . 0 0 "[ . 1 . 2]" 1
304 1 12 ARG QB 1 13 GLY H . . 3.390 2.412 2.206 2.705 . 0 0 "[ . 1 . 2]" 1
305 1 12 ARG QB 1 13 GLY HA3 . . 4.830 4.192 3.984 4.470 . 0 0 "[ . 1 . 2]" 1
306 1 12 ARG QB 1 14 ASN H . . 4.930 4.712 4.558 4.910 . 0 0 "[ . 1 . 2]" 1
307 1 12 ARG QB 1 28 CYS HB3 . . 4.910 3.309 2.925 3.613 . 0 0 "[ . 1 . 2]" 1
308 1 12 ARG HE 1 12 ARG QG . . 3.830 2.272 2.105 2.347 . 0 0 "[ . 1 . 2]" 1
309 1 12 ARG QG 1 13 GLY H . . 4.250 4.201 4.108 4.271 0.021 7 0 "[ . 1 . 2]" 1
310 1 13 GLY H 1 15 GLY H . . 4.900 4.326 4.098 4.440 . 0 0 "[ . 1 . 2]" 1
311 1 13 GLY H 1 16 PHE H . . 5.080 4.858 4.777 4.940 . 0 0 "[ . 1 . 2]" 1
312 1 13 GLY H 1 16 PHE QD . . 5.710 5.250 4.516 5.715 0.005 12 0 "[ . 1 . 2]" 1
313 1 13 GLY H 1 25 ALA HA . . 4.980 4.905 4.773 5.005 0.025 19 0 "[ . 1 . 2]" 1
314 1 13 GLY H 1 28 CYS H . . 6.000 6.027 6.014 6.044 0.044 12 0 "[ . 1 . 2]" 1
315 1 13 GLY H 1 28 CYS HA . . 5.480 5.429 5.295 5.486 0.006 17 0 "[ . 1 . 2]" 1
316 1 13 GLY H 1 28 CYS HB2 . . 4.100 3.862 3.769 3.944 . 0 0 "[ . 1 . 2]" 1
317 1 13 GLY H 1 28 CYS HB3 . . 4.700 2.881 2.789 2.938 . 0 0 "[ . 1 . 2]" 1
318 1 13 GLY H 1 29 TYR QD . . 4.910 4.475 4.368 4.600 . 0 0 "[ . 1 . 2]" 1
319 1 13 GLY H 1 29 TYR QE . . 4.970 3.816 3.713 3.967 . 0 0 "[ . 1 . 2]" 1
320 1 13 GLY H 1 42 LEU MD2 . . 6.000 5.786 5.655 5.971 . 0 0 "[ . 1 . 2]" 1
321 1 13 GLY HA2 1 16 PHE H . . 3.980 3.383 3.292 3.458 . 0 0 "[ . 1 . 2]" 1
322 1 13 GLY HA2 1 16 PHE HA . . 5.480 5.462 5.356 5.508 0.028 1 0 "[ . 1 . 2]" 1
323 1 13 GLY HA2 1 16 PHE HB2 . . 4.870 2.620 2.509 2.722 . 0 0 "[ . 1 . 2]" 1
324 1 13 GLY HA2 1 25 ALA H . . 5.600 4.897 4.781 5.035 . 0 0 "[ . 1 . 2]" 1
325 1 13 GLY HA2 1 25 ALA HA . . 3.860 2.242 2.144 2.389 . 0 0 "[ . 1 . 2]" 1
326 1 13 GLY HA2 1 25 ALA MB . . 4.600 2.831 2.658 2.951 . 0 0 "[ . 1 . 2]" 1
327 1 13 GLY HA2 1 28 CYS HB2 . . 5.530 2.648 2.452 2.754 . 0 0 "[ . 1 . 2]" 1
328 1 13 GLY HA3 1 25 ALA HA . . 3.680 3.321 3.108 3.517 . 0 0 "[ . 1 . 2]" 1
329 1 13 GLY HA3 1 25 ALA MB . . 4.510 3.163 3.069 3.292 . 0 0 "[ . 1 . 2]" 1
330 1 13 GLY HA3 1 28 CYS HB2 . . 4.750 2.846 2.592 2.989 . 0 0 "[ . 1 . 2]" 1
331 1 13 GLY HA3 1 28 CYS HB3 . . 4.740 2.835 2.711 2.985 . 0 0 "[ . 1 . 2]" 1
332 1 13 GLY HA3 1 29 TYR H . . 4.060 3.828 3.712 3.914 . 0 0 "[ . 1 . 2]" 1
333 1 14 ASN H 1 14 ASN HB2 . . 3.540 2.449 2.419 2.475 . 0 0 "[ . 1 . 2]" 1
334 1 14 ASN H 1 14 ASN HB3 . . 3.740 3.600 3.584 3.620 . 0 0 "[ . 1 . 2]" 1
335 1 14 ASN H 1 14 ASN HD21 . . 4.420 4.139 4.052 4.243 . 0 0 "[ . 1 . 2]" 1
336 1 14 ASN H 1 14 ASN HD22 . . 4.790 4.505 4.404 4.612 . 0 0 "[ . 1 . 2]" 1
337 1 14 ASN H 1 15 GLY H . . 3.520 2.884 2.795 2.970 . 0 0 "[ . 1 . 2]" 1
338 1 14 ASN H 1 16 PHE H . . 4.520 4.122 4.045 4.208 . 0 0 "[ . 1 . 2]" 1
339 1 14 ASN H 1 17 PHE H . . 4.800 4.648 4.599 4.702 . 0 0 "[ . 1 . 2]" 1
340 1 14 ASN H 1 25 ALA MB . . 4.850 4.586 4.506 4.666 . 0 0 "[ . 1 . 2]" 1
341 1 14 ASN H 1 29 TYR QD . . 5.340 4.879 4.753 4.967 . 0 0 "[ . 1 . 2]" 1
342 1 14 ASN H 1 29 TYR QE . . 4.600 2.884 2.765 2.960 . 0 0 "[ . 1 . 2]" 1
343 1 14 ASN H 1 45 ASN QB . . 5.490 5.437 5.284 5.500 0.010 18 0 "[ . 1 . 2]" 1
344 1 14 ASN H 2 8 VAL MG2 . . 4.790 4.789 4.733 4.810 0.020 20 0 "[ . 1 . 2]" 1
345 1 14 ASN HA 1 14 ASN HD21 . . 4.640 4.483 4.466 4.503 . 0 0 "[ . 1 . 2]" 1
346 1 14 ASN HA 1 14 ASN HD22 . . 5.020 4.652 4.626 4.691 . 0 0 "[ . 1 . 2]" 1
347 1 14 ASN HA 1 17 PHE H . . 4.120 3.105 2.967 3.247 . 0 0 "[ . 1 . 2]" 1
348 1 14 ASN HA 1 17 PHE HB2 . . 4.820 3.573 3.395 3.742 . 0 0 "[ . 1 . 2]" 1
349 1 14 ASN HA 1 17 PHE HB3 . . 3.770 2.433 2.340 2.535 . 0 0 "[ . 1 . 2]" 1
350 1 14 ASN HA 1 17 PHE QD . . 4.400 3.890 3.670 3.950 . 0 0 "[ . 1 . 2]" 1
351 1 14 ASN HA 1 18 LYS H . . 4.170 3.650 3.460 3.840 . 0 0 "[ . 1 . 2]" 1
352 1 14 ASN HA 1 18 LYS HG2 . . 4.880 4.549 4.332 4.740 . 0 0 "[ . 1 . 2]" 1
353 1 14 ASN HA 1 18 LYS HG3 . . 4.620 3.486 3.225 3.703 . 0 0 "[ . 1 . 2]" 1
354 1 14 ASN HA 1 25 ALA MB . . 4.440 4.136 4.040 4.272 . 0 0 "[ . 1 . 2]" 1
355 1 14 ASN HA 2 8 VAL HB . . 4.750 4.262 4.088 4.564 . 0 0 "[ . 1 . 2]" 1
356 1 14 ASN HA 2 8 VAL MG1 . . 5.280 3.972 3.717 4.222 . 0 0 "[ . 1 . 2]" 1
357 1 14 ASN HA 2 8 VAL MG2 . . 3.140 2.670 2.594 2.803 . 0 0 "[ . 1 . 2]" 1
358 1 14 ASN HB2 1 15 GLY H . . 3.680 2.641 2.573 2.700 . 0 0 "[ . 1 . 2]" 1
359 1 14 ASN HB2 1 18 LYS HG3 . . 5.170 4.798 4.622 4.991 . 0 0 "[ . 1 . 2]" 1
360 1 14 ASN HB2 2 8 VAL MG2 . . 4.370 4.259 4.164 4.374 0.004 7 0 "[ . 1 . 2]" 1
361 1 14 ASN HB3 1 15 GLY H . . 3.790 3.521 3.426 3.629 . 0 0 "[ . 1 . 2]" 1
362 1 14 ASN HB3 2 8 VAL MG2 . . 3.480 3.080 2.955 3.278 . 0 0 "[ . 1 . 2]" 1
363 1 14 ASN HD21 1 15 GLY H . . 5.120 5.074 4.957 5.149 0.029 3 0 "[ . 1 . 2]" 1
364 1 14 ASN HD21 1 45 ASN HD21 . . 5.500 5.001 4.720 5.244 . 0 0 "[ . 1 . 2]" 1
365 1 14 ASN HD21 1 45 ASN HD22 . . 5.490 4.578 4.454 4.759 . 0 0 "[ . 1 . 2]" 1
366 1 14 ASN HD21 2 8 VAL MG2 . . 4.140 4.027 3.851 4.151 0.011 11 0 "[ . 1 . 2]" 1
367 1 14 ASN HD22 1 18 LYS HE3 . . 5.450 5.079 4.667 5.455 0.005 10 0 "[ . 1 . 2]" 1
368 1 14 ASN HD22 1 41 LEU MD1 . . 4.110 3.518 3.366 3.663 . 0 0 "[ . 1 . 2]" 1
369 1 14 ASN HD22 1 45 ASN HD21 . . 5.010 3.629 3.343 3.898 . 0 0 "[ . 1 . 2]" 1
370 1 14 ASN HD22 1 45 ASN HD22 . . 4.430 2.889 2.744 3.102 . 0 0 "[ . 1 . 2]" 1
371 1 14 ASN HD22 2 8 VAL HA . . 6.000 5.581 5.383 5.875 . 0 0 "[ . 1 . 2]" 1
372 1 14 ASN HD22 2 8 VAL HB . . 3.990 3.673 3.458 3.910 . 0 0 "[ . 1 . 2]" 1
373 1 14 ASN HD22 2 8 VAL MG2 . . 3.740 3.634 3.438 3.748 0.008 5 0 "[ . 1 . 2]" 1
374 1 14 ASN HD22 2 9 ASP H . . 4.950 4.431 4.266 4.657 . 0 0 "[ . 1 . 2]" 1
375 1 14 ASN HD22 2 9 ASP HA . . 5.310 4.709 4.376 5.028 . 0 0 "[ . 1 . 2]" 1
376 1 15 GLY H 1 16 PHE H . . 3.370 2.816 2.779 2.861 . 0 0 "[ . 1 . 2]" 1
377 1 15 GLY H 1 16 PHE HB2 . . 4.880 4.896 4.880 4.915 0.035 3 0 "[ . 1 . 2]" 1
378 1 15 GLY H 1 17 PHE H . . 4.390 4.224 4.159 4.291 . 0 0 "[ . 1 . 2]" 1
379 1 15 GLY H 1 18 LYS H . . 5.120 4.969 4.894 5.037 . 0 0 "[ . 1 . 2]" 1
380 1 15 GLY QA 1 16 PHE H . . 3.370 2.879 2.776 2.942 . 0 0 "[ . 1 . 2]" 1
381 1 15 GLY QA 1 17 PHE H . . 4.140 4.118 4.058 4.161 0.021 18 0 "[ . 1 . 2]" 1
382 1 15 GLY QA 1 18 LYS H . . 3.940 3.831 3.616 3.946 0.006 7 0 "[ . 1 . 2]" 1
383 1 15 GLY QA 1 18 LYS QB . . 4.520 3.360 3.017 3.585 . 0 0 "[ . 1 . 2]" 1
384 1 15 GLY QA 1 18 LYS QD . . 4.660 4.754 4.466 5.038 0.378 7 0 "[ . 1 . 2]" 1
385 1 15 GLY QA 1 19 GLU H . . 4.200 4.221 4.199 4.245 0.045 3 0 "[ . 1 . 2]" 1
386 1 16 PHE H 1 16 PHE HB2 . . 3.530 2.301 2.257 2.333 . 0 0 "[ . 1 . 2]" 1
387 1 16 PHE H 1 16 PHE HB3 . . 3.610 3.566 3.532 3.592 . 0 0 "[ . 1 . 2]" 1
388 1 16 PHE H 1 16 PHE QD . . 3.550 3.401 3.116 3.559 0.009 7 0 "[ . 1 . 2]" 1
389 1 16 PHE H 1 17 PHE H . . 3.430 2.407 2.330 2.554 . 0 0 "[ . 1 . 2]" 1
390 1 16 PHE H 1 17 PHE HB3 . . 4.440 4.466 4.436 4.498 0.058 13 0 "[ . 1 . 2]" 1
391 1 16 PHE H 1 18 LYS H . . 4.290 4.116 4.020 4.260 . 0 0 "[ . 1 . 2]" 1
392 1 16 PHE H 1 19 GLU QB . . 4.730 4.736 4.630 4.791 0.061 2 0 "[ . 1 . 2]" 1
393 1 16 PHE H 1 19 GLU QG . . 5.350 5.328 5.193 5.391 0.041 13 0 "[ . 1 . 2]" 1
394 1 16 PHE H 1 25 ALA HA . . 4.960 4.629 4.254 4.778 . 0 0 "[ . 1 . 2]" 1
395 1 16 PHE H 1 25 ALA MB . . 3.760 3.705 3.607 3.772 0.012 11 0 "[ . 1 . 2]" 1
396 1 16 PHE HA 1 16 PHE QD . . 3.170 2.167 2.062 2.280 . 0 0 "[ . 1 . 2]" 1
397 1 16 PHE HA 1 17 PHE HA . . 4.840 4.774 4.740 4.817 . 0 0 "[ . 1 . 2]" 1
398 1 16 PHE HA 1 19 GLU H . . 3.810 3.510 3.323 3.694 . 0 0 "[ . 1 . 2]" 1
399 1 16 PHE HA 1 19 GLU QB . . 3.500 2.437 2.211 2.632 . 0 0 "[ . 1 . 2]" 1
400 1 16 PHE HA 1 19 GLU QG . . 4.120 4.025 3.846 4.134 0.014 18 0 "[ . 1 . 2]" 1
401 1 16 PHE HA 1 21 LYS H . . 4.060 3.844 3.756 3.922 . 0 0 "[ . 1 . 2]" 1
402 1 16 PHE HA 1 21 LYS QB . . 3.740 2.764 2.535 2.983 . 0 0 "[ . 1 . 2]" 1
403 1 16 PHE HA 1 21 LYS QD . . 4.660 2.949 2.316 4.690 0.030 11 0 "[ . 1 . 2]" 1
404 1 16 PHE HA 1 21 LYS QE . . 4.560 4.170 2.195 4.608 0.048 4 0 "[ . 1 . 2]" 1
405 1 16 PHE HA 1 21 LYS QG . . 4.260 3.909 3.578 4.112 . 0 0 "[ . 1 . 2]" 1
406 1 16 PHE HA 1 25 ALA H . . 5.590 5.555 5.298 5.620 0.030 15 0 "[ . 1 . 2]" 1
407 1 16 PHE HA 1 25 ALA MB . . 4.990 4.278 4.166 4.387 . 0 0 "[ . 1 . 2]" 1
408 1 16 PHE HB2 1 17 PHE H . . 4.060 2.946 2.778 3.060 . 0 0 "[ . 1 . 2]" 1
409 1 16 PHE HB2 1 17 PHE HA . . 5.120 4.558 4.414 4.711 . 0 0 "[ . 1 . 2]" 1
410 1 16 PHE HB2 1 18 LYS H . . 5.510 5.309 5.149 5.417 . 0 0 "[ . 1 . 2]" 1
411 1 16 PHE HB2 1 25 ALA H . . 4.180 3.736 3.452 3.915 . 0 0 "[ . 1 . 2]" 1
412 1 16 PHE HB2 1 25 ALA HA . . 4.160 2.719 2.419 2.875 . 0 0 "[ . 1 . 2]" 1
413 1 16 PHE HB2 1 25 ALA MB . . 3.460 2.301 2.208 2.366 . 0 0 "[ . 1 . 2]" 1
414 1 16 PHE HB3 1 19 GLU QB . . 4.830 4.521 4.286 4.731 . 0 0 "[ . 1 . 2]" 1
415 1 16 PHE HB3 1 21 LYS QB . . 4.470 2.304 2.216 2.419 . 0 0 "[ . 1 . 2]" 1
416 1 16 PHE HB3 1 21 LYS QG . . 5.090 4.445 4.330 4.583 . 0 0 "[ . 1 . 2]" 1
417 1 16 PHE HB3 1 24 ARG H . . 4.830 4.334 4.051 4.562 . 0 0 "[ . 1 . 2]" 1
418 1 16 PHE HB3 1 25 ALA H . . 3.870 3.073 2.735 3.198 . 0 0 "[ . 1 . 2]" 1
419 1 16 PHE HB3 1 25 ALA HA . . 4.850 3.527 3.367 3.664 . 0 0 "[ . 1 . 2]" 1
420 1 16 PHE HB3 1 25 ALA MB . . 4.110 2.603 2.416 2.782 . 0 0 "[ . 1 . 2]" 1
421 1 16 PHE QD 1 21 LYS QB . . 3.810 3.489 2.386 3.853 0.043 15 0 "[ . 1 . 2]" 1
422 1 16 PHE QD 1 24 ARG H . . 5.040 5.016 4.759 5.077 0.037 6 0 "[ . 1 . 2]" 1
423 1 16 PHE QD 1 24 ARG HA . . 5.120 4.369 4.018 4.882 . 0 0 "[ . 1 . 2]" 1
424 1 16 PHE QD 1 24 ARG HB3 . . 4.800 3.117 2.629 3.551 . 0 0 "[ . 1 . 2]" 1
425 1 16 PHE QD 1 24 ARG QG . . 5.140 4.476 3.714 4.821 . 0 0 "[ . 1 . 2]" 1
426 1 16 PHE QD 1 25 ALA H . . 4.010 3.728 3.398 4.034 0.024 7 0 "[ . 1 . 2]" 1
427 1 16 PHE QD 1 25 ALA HA . . 3.810 2.544 2.295 2.775 . 0 0 "[ . 1 . 2]" 1
428 1 16 PHE QD 1 28 CYS H . . 5.540 4.376 4.095 4.576 . 0 0 "[ . 1 . 2]" 1
429 1 17 PHE H 1 17 PHE HB2 . . 3.540 2.645 2.576 2.718 . 0 0 "[ . 1 . 2]" 1
430 1 17 PHE H 1 17 PHE HB3 . . 3.290 2.288 2.176 2.340 . 0 0 "[ . 1 . 2]" 1
431 1 17 PHE H 1 17 PHE QD . . 4.210 4.138 4.065 4.170 . 0 0 "[ . 1 . 2]" 1
432 1 17 PHE H 1 18 LYS H . . 3.620 2.531 2.500 2.564 . 0 0 "[ . 1 . 2]" 1
433 1 17 PHE H 1 18 LYS HA . . 5.320 5.204 5.167 5.244 . 0 0 "[ . 1 . 2]" 1
434 1 17 PHE H 1 18 LYS QB . . 4.660 4.674 4.660 4.688 0.028 3 0 "[ . 1 . 2]" 1
435 1 17 PHE H 1 18 LYS HG2 . . 4.960 5.012 4.990 5.031 0.071 17 0 "[ . 1 . 2]" 1
436 1 17 PHE H 1 18 LYS HG3 . . 4.290 4.287 4.157 4.333 0.043 13 0 "[ . 1 . 2]" 1
437 1 17 PHE H 1 19 GLU H . . 4.550 3.755 3.708 3.844 . 0 0 "[ . 1 . 2]" 1
438 1 17 PHE H 1 20 GLY H . . 5.110 5.037 4.911 5.122 0.012 20 0 "[ . 1 . 2]" 1
439 1 17 PHE H 1 22 TYR QD . . 5.370 5.256 5.133 5.374 0.004 5 0 "[ . 1 . 2]" 1
440 1 17 PHE H 1 25 ALA H . . 5.780 5.323 5.216 5.421 . 0 0 "[ . 1 . 2]" 1
441 1 17 PHE H 1 25 ALA HA . . 4.920 4.743 4.514 4.902 . 0 0 "[ . 1 . 2]" 1
442 1 17 PHE H 1 25 ALA MB . . 3.570 2.787 2.743 2.826 . 0 0 "[ . 1 . 2]" 1
443 1 17 PHE H 2 8 VAL MG2 . . 4.710 4.713 4.593 4.744 0.034 9 0 "[ . 1 . 2]" 1
444 1 17 PHE HA 1 17 PHE QD . . 3.580 2.915 2.838 3.002 . 0 0 "[ . 1 . 2]" 1
445 1 17 PHE HA 1 18 LYS HA . . 4.740 4.732 4.695 4.756 0.016 2 0 "[ . 1 . 2]" 1
446 1 17 PHE HA 1 18 LYS QB . . 5.620 5.586 5.561 5.607 . 0 0 "[ . 1 . 2]" 1
447 1 17 PHE HA 1 18 LYS HG2 . . 5.600 5.398 5.294 5.549 . 0 0 "[ . 1 . 2]" 1
448 1 17 PHE HA 1 19 GLU H . . 4.080 4.053 3.945 4.100 0.020 10 0 "[ . 1 . 2]" 1
449 1 17 PHE HA 1 20 GLY H . . 4.190 3.611 3.492 3.715 . 0 0 "[ . 1 . 2]" 1
450 1 17 PHE HA 1 20 GLY HA2 . . 5.560 4.307 4.145 4.453 . 0 0 "[ . 1 . 2]" 1
451 1 17 PHE HA 1 21 LYS H . . 4.160 3.478 3.361 3.584 . 0 0 "[ . 1 . 2]" 1
452 1 17 PHE HA 1 21 LYS QB . . 4.900 4.397 4.201 4.532 . 0 0 "[ . 1 . 2]" 1
453 1 17 PHE HA 1 22 TYR H . . 4.520 4.080 3.909 4.170 . 0 0 "[ . 1 . 2]" 1
454 1 17 PHE HA 1 22 TYR HA . . 4.030 2.836 2.671 2.947 . 0 0 "[ . 1 . 2]" 1
455 1 17 PHE HA 1 22 TYR QD . . 3.760 2.454 2.312 2.596 . 0 0 "[ . 1 . 2]" 1
456 1 17 PHE HA 1 22 TYR QE . . 4.280 3.761 3.568 3.859 . 0 0 "[ . 1 . 2]" 1
457 1 17 PHE HA 1 23 GLU H . . 6.000 5.936 5.749 6.019 0.019 7 0 "[ . 1 . 2]" 1
458 1 17 PHE HA 1 25 ALA H . . 4.890 4.754 4.661 4.846 . 0 0 "[ . 1 . 2]" 1
459 1 17 PHE HA 1 25 ALA MB . . 3.170 2.930 2.840 2.978 . 0 0 "[ . 1 . 2]" 1
460 1 17 PHE HA 1 49 ALA HA . . 5.880 5.478 5.354 5.598 . 0 0 "[ . 1 . 2]" 1
461 1 17 PHE HA 1 49 ALA MB . . 5.180 4.520 4.418 4.605 . 0 0 "[ . 1 . 2]" 1
462 1 17 PHE HA 1 52 LYS QG . . 5.810 5.773 5.612 5.843 0.033 12 0 "[ . 1 . 2]" 1
463 1 17 PHE HB2 1 18 LYS H . . 4.110 3.961 3.892 3.989 . 0 0 "[ . 1 . 2]" 1
464 1 17 PHE HB2 1 25 ALA MB . . 3.530 2.285 2.228 2.369 . 0 0 "[ . 1 . 2]" 1
465 1 17 PHE HB2 1 49 ALA H . . 5.640 5.670 5.649 5.686 0.046 4 0 "[ . 1 . 2]" 1
466 1 17 PHE HB2 1 49 ALA MB . . 4.480 3.647 3.558 3.722 . 0 0 "[ . 1 . 2]" 1
467 1 17 PHE HB2 2 8 VAL MG2 . . 4.480 4.099 3.973 4.227 . 0 0 "[ . 1 . 2]" 1
468 1 17 PHE HB3 1 18 LYS H . . 3.370 2.608 2.552 2.683 . 0 0 "[ . 1 . 2]" 1
469 1 17 PHE HB3 1 18 LYS HA . . 4.580 4.599 4.587 4.614 0.034 11 0 "[ . 1 . 2]" 1
470 1 17 PHE HB3 1 18 LYS HG3 . . 4.940 3.526 3.315 3.697 . 0 0 "[ . 1 . 2]" 1
471 1 17 PHE HB3 1 25 ALA MB . . 4.350 3.444 3.368 3.507 . 0 0 "[ . 1 . 2]" 1
472 1 17 PHE HB3 2 8 VAL MG2 . . 3.670 2.964 2.833 3.044 . 0 0 "[ . 1 . 2]" 1
473 1 17 PHE QD 1 18 LYS QB . . 4.770 4.321 4.189 4.447 . 0 0 "[ . 1 . 2]" 1
474 1 17 PHE QD 1 22 TYR H . . 4.980 4.979 4.909 4.995 0.015 2 0 "[ . 1 . 2]" 1
475 1 17 PHE QD 1 22 TYR HA . . 4.380 2.739 2.698 2.776 . 0 0 "[ . 1 . 2]" 1
476 1 17 PHE QD 1 22 TYR QD . . 3.490 2.292 2.136 2.379 . 0 0 "[ . 1 . 2]" 1
477 1 17 PHE QD 1 22 TYR QE . . 4.100 3.983 3.700 4.124 0.024 14 0 "[ . 1 . 2]" 1
478 1 17 PHE QD 1 23 GLU H . . 6.000 6.034 6.009 6.072 0.072 13 0 "[ . 1 . 2]" 1
479 1 17 PHE QD 1 25 ALA MB . . 3.360 3.140 3.083 3.224 . 0 0 "[ . 1 . 2]" 1
480 1 17 PHE QD 1 26 ILE MD . . 5.290 5.212 5.142 5.315 0.025 8 0 "[ . 1 . 2]" 1
481 1 17 PHE QD 1 48 MET HB2 . . 5.400 5.058 4.939 5.139 . 0 0 "[ . 1 . 2]" 1
482 1 17 PHE QD 1 49 ALA MB . . 3.490 2.365 2.316 2.461 . 0 0 "[ . 1 . 2]" 1
483 1 17 PHE QD 2 8 VAL HB . . 4.590 4.592 4.503 4.607 0.017 2 0 "[ . 1 . 2]" 1
484 1 17 PHE QD 2 8 VAL MG1 . . 4.240 2.917 2.804 3.079 . 0 0 "[ . 1 . 2]" 1
485 1 17 PHE QD 2 8 VAL MG2 . . 3.340 2.284 2.227 2.340 . 0 0 "[ . 1 . 2]" 1
486 1 18 LYS H 1 18 LYS QB . . 2.940 2.527 2.502 2.565 . 0 0 "[ . 1 . 2]" 1
487 1 18 LYS H 1 18 LYS QD . . 4.440 4.169 4.118 4.230 . 0 0 "[ . 1 . 2]" 1
488 1 18 LYS H 1 18 LYS HE3 . . 4.590 4.573 4.356 4.643 0.053 16 0 "[ . 1 . 2]" 1
489 1 18 LYS H 1 18 LYS HG2 . . 3.260 2.825 2.748 2.923 . 0 0 "[ . 1 . 2]" 1
490 1 18 LYS H 1 18 LYS HG3 . . 3.570 2.341 2.294 2.405 . 0 0 "[ . 1 . 2]" 1
491 1 18 LYS H 1 19 GLU H . . 3.280 2.598 2.470 2.659 . 0 0 "[ . 1 . 2]" 1
492 1 18 LYS H 1 19 GLU HA . . 5.330 5.330 5.246 5.353 0.023 16 0 "[ . 1 . 2]" 1
493 1 18 LYS H 1 19 GLU QG . . 4.820 4.649 4.340 4.827 0.007 17 0 "[ . 1 . 2]" 1
494 1 18 LYS H 1 20 GLY H . . 4.220 4.033 3.940 4.140 . 0 0 "[ . 1 . 2]" 1
495 1 18 LYS H 1 25 ALA MB . . 4.750 4.749 4.716 4.769 0.019 2 0 "[ . 1 . 2]" 1
496 1 18 LYS H 2 8 VAL MG2 . . 4.280 4.159 4.019 4.261 . 0 0 "[ . 1 . 2]" 1
497 1 18 LYS HA 1 18 LYS QD . . 3.920 3.681 3.587 3.843 . 0 0 "[ . 1 . 2]" 1
498 1 18 LYS HA 1 18 LYS HE2 . . 6.000 5.017 4.762 5.639 . 0 0 "[ . 1 . 2]" 1
499 1 18 LYS HA 1 18 LYS HE3 . . 6.000 5.400 5.205 5.523 . 0 0 "[ . 1 . 2]" 1
500 1 18 LYS HA 1 18 LYS HG2 . . 3.180 2.461 2.391 2.625 . 0 0 "[ . 1 . 2]" 1
501 1 18 LYS HA 1 18 LYS HG3 . . 3.600 3.497 3.465 3.543 . 0 0 "[ . 1 . 2]" 1
502 1 18 LYS HA 1 19 GLU H . . 3.530 3.407 3.342 3.450 . 0 0 "[ . 1 . 2]" 1
503 1 18 LYS HA 1 20 GLY H . . 4.080 3.388 3.209 3.619 . 0 0 "[ . 1 . 2]" 1
504 1 18 LYS HA 1 22 TYR QE . . 4.410 4.400 4.211 4.462 0.052 3 0 "[ . 1 . 2]" 1
505 1 18 LYS HA 2 8 VAL MG2 . . 5.310 4.895 4.623 5.092 . 0 0 "[ . 1 . 2]" 1
506 1 18 LYS QB 1 18 LYS QD . . 3.110 2.197 2.122 2.252 . 0 0 "[ . 1 . 2]" 1
507 1 18 LYS QB 1 20 GLY H . . 5.160 4.578 4.473 4.669 . 0 0 "[ . 1 . 2]" 1
508 1 18 LYS QB 2 8 VAL MG2 . . 4.570 4.537 4.351 4.589 0.019 13 0 "[ . 1 . 2]" 1
509 1 18 LYS QD 2 7 GLU HA . . 5.500 5.499 5.429 5.556 0.056 14 0 "[ . 1 . 2]" 1
510 1 18 LYS QD 2 8 VAL MG2 . . 3.470 3.652 3.426 3.749 0.279 15 0 "[ . 1 . 2]" 1
511 1 18 LYS HE2 2 8 VAL HA . . 6.000 5.697 5.365 6.046 0.046 3 0 "[ . 1 . 2]" 1
512 1 18 LYS HE2 2 8 VAL MG2 . . 3.700 2.116 1.856 2.403 . 0 0 "[ . 1 . 2]" 1
513 1 18 LYS HE3 1 18 LYS HG3 . . 4.220 2.304 2.146 2.395 . 0 0 "[ . 1 . 2]" 1
514 1 18 LYS HE3 2 8 VAL MG2 . . 3.680 2.484 2.110 2.817 . 0 0 "[ . 1 . 2]" 1
515 1 18 LYS HG2 1 19 GLU H . . 4.780 4.799 4.783 4.819 0.039 8 0 "[ . 1 . 2]" 1
516 1 18 LYS HG2 2 8 VAL MG2 . . 3.630 3.048 2.755 3.184 . 0 0 "[ . 1 . 2]" 1
517 1 18 LYS HG3 2 8 VAL MG2 . . 3.880 3.156 2.976 3.241 . 0 0 "[ . 1 . 2]" 1
518 1 19 GLU H 1 19 GLU QB . . 2.950 2.337 2.271 2.417 . 0 0 "[ . 1 . 2]" 1
519 1 19 GLU H 1 19 GLU QG . . 3.210 2.850 2.679 2.980 . 0 0 "[ . 1 . 2]" 1
520 1 19 GLU H 1 20 GLY H . . 3.080 2.524 2.472 2.580 . 0 0 "[ . 1 . 2]" 1
521 1 19 GLU H 1 20 GLY HA2 . . 4.880 4.813 4.757 4.869 . 0 0 "[ . 1 . 2]" 1
522 1 19 GLU H 1 20 GLY HA3 . . 5.140 5.174 5.149 5.196 0.056 11 0 "[ . 1 . 2]" 1
523 1 19 GLU H 1 21 LYS H . . 3.730 3.585 3.472 3.690 . 0 0 "[ . 1 . 2]" 1
524 1 19 GLU H 1 21 LYS QE . . 6.000 5.214 4.431 5.511 . 0 0 "[ . 1 . 2]" 1
525 1 19 GLU H 1 21 LYS QG . . 4.780 4.637 4.245 4.810 0.030 2 0 "[ . 1 . 2]" 1
526 1 19 GLU HA 1 19 GLU QB . . 2.770 2.441 2.409 2.478 . 0 0 "[ . 1 . 2]" 1
527 1 19 GLU HA 1 19 GLU QG . . 2.860 2.236 2.123 2.381 . 0 0 "[ . 1 . 2]" 1
528 1 19 GLU HA 1 20 GLY HA3 . . 4.740 4.480 4.358 4.568 . 0 0 "[ . 1 . 2]" 1
529 1 19 GLU HA 1 21 LYS QG . . 5.300 4.589 4.351 4.798 . 0 0 "[ . 1 . 2]" 1
530 1 19 GLU QB 1 20 GLY H . . 3.610 3.527 3.317 3.623 0.013 18 0 "[ . 1 . 2]" 1
531 1 19 GLU QB 1 21 LYS H . . 3.530 3.196 2.923 3.370 . 0 0 "[ . 1 . 2]" 1
532 1 19 GLU QB 1 21 LYS QG . . 4.250 2.678 2.313 2.963 . 0 0 "[ . 1 . 2]" 1
533 1 19 GLU QG 1 20 GLY H . . 4.540 4.540 4.468 4.572 0.032 8 0 "[ . 1 . 2]" 1
534 1 19 GLU QG 1 21 LYS H . . 5.130 5.115 4.959 5.177 0.047 2 0 "[ . 1 . 2]" 1
535 1 19 GLU QG 1 21 LYS QE . . 4.520 3.991 3.623 4.298 . 0 0 "[ . 1 . 2]" 1
536 1 19 GLU QG 1 21 LYS QG . . 4.690 4.698 4.336 4.995 0.305 2 0 "[ . 1 . 2]" 1
537 1 20 GLY H 1 21 LYS QG . . 4.430 4.230 3.972 4.434 0.004 2 0 "[ . 1 . 2]" 1
538 1 20 GLY H 1 22 TYR QE . . 4.310 3.635 3.305 3.851 . 0 0 "[ . 1 . 2]" 1
539 1 20 GLY HA2 1 21 LYS HA . . 5.070 4.781 4.686 4.836 . 0 0 "[ . 1 . 2]" 1
540 1 20 GLY HA2 1 22 TYR QE . . 4.460 2.625 2.353 2.946 . 0 0 "[ . 1 . 2]" 1
541 1 20 GLY HA3 1 22 TYR QE . . 4.840 4.120 3.941 4.306 . 0 0 "[ . 1 . 2]" 1
542 1 21 LYS H 1 21 LYS QB . . 3.410 2.490 2.413 2.583 . 0 0 "[ . 1 . 2]" 1
543 1 21 LYS H 1 21 LYS QE . . 4.270 4.192 3.599 4.301 0.031 8 0 "[ . 1 . 2]" 1
544 1 21 LYS H 1 21 LYS QG . . 3.380 2.365 2.184 2.513 . 0 0 "[ . 1 . 2]" 1
545 1 21 LYS H 1 22 TYR H . . 3.960 3.527 3.398 3.634 . 0 0 "[ . 1 . 2]" 1
546 1 21 LYS H 1 22 TYR HA . . 5.080 4.635 4.518 4.730 . 0 0 "[ . 1 . 2]" 1
547 1 21 LYS H 1 22 TYR QD . . 4.680 4.449 4.279 4.561 . 0 0 "[ . 1 . 2]" 1
548 1 21 LYS H 1 22 TYR QE . . 4.880 4.783 4.440 4.891 0.011 11 0 "[ . 1 . 2]" 1
549 1 21 LYS H 1 24 ARG HB2 . . 5.250 5.258 5.217 5.308 0.058 2 0 "[ . 1 . 2]" 1
550 1 21 LYS HA 1 21 LYS QG . . 3.230 2.564 2.421 2.661 . 0 0 "[ . 1 . 2]" 1
551 1 21 LYS HA 1 22 TYR H . . 2.900 2.592 2.553 2.640 . 0 0 "[ . 1 . 2]" 1
552 1 21 LYS HA 1 22 TYR HA . . 4.790 4.732 4.693 4.789 . 0 0 "[ . 1 . 2]" 1
553 1 21 LYS HA 1 23 GLU H . . 4.030 3.798 3.624 3.983 . 0 0 "[ . 1 . 2]" 1
554 1 21 LYS HA 1 24 ARG H . . 4.460 3.869 3.746 4.013 . 0 0 "[ . 1 . 2]" 1
555 1 21 LYS HA 1 24 ARG HB2 . . 4.260 4.271 4.198 4.298 0.038 7 0 "[ . 1 . 2]" 1
556 1 21 LYS HA 1 25 ALA H . . 5.120 5.001 4.915 5.060 . 0 0 "[ . 1 . 2]" 1
557 1 21 LYS HA 1 25 ALA MB . . 5.500 5.345 5.242 5.432 . 0 0 "[ . 1 . 2]" 1
558 1 21 LYS HA 1 53 ILE MG . . 5.950 5.494 5.366 5.720 . 0 0 "[ . 1 . 2]" 1
559 1 21 LYS QB 1 22 TYR H . . 4.040 3.982 3.951 4.022 . 0 0 "[ . 1 . 2]" 1
560 1 21 LYS QB 1 23 GLU H . . 4.850 4.663 4.533 4.817 . 0 0 "[ . 1 . 2]" 1
561 1 21 LYS QB 1 24 ARG H . . 3.690 3.299 3.181 3.505 . 0 0 "[ . 1 . 2]" 1
562 1 21 LYS QB 1 24 ARG QG . . 3.920 2.429 2.107 2.688 . 0 0 "[ . 1 . 2]" 1
563 1 21 LYS QB 1 25 ALA H . . 3.810 3.789 3.671 3.827 0.017 4 0 "[ . 1 . 2]" 1
564 1 21 LYS QG 1 22 TYR H . . 4.660 4.576 4.445 4.676 0.016 8 0 "[ . 1 . 2]" 1
565 1 22 TYR H 1 22 TYR HB2 . . 3.440 2.692 2.611 2.773 . 0 0 "[ . 1 . 2]" 1
566 1 22 TYR H 1 22 TYR HB3 . . 3.590 3.520 3.500 3.543 . 0 0 "[ . 1 . 2]" 1
567 1 22 TYR H 1 22 TYR QD . . 3.160 2.939 2.888 2.975 . 0 0 "[ . 1 . 2]" 1
568 1 22 TYR H 1 22 TYR QE . . 4.200 4.109 4.025 4.198 . 0 0 "[ . 1 . 2]" 1
569 1 22 TYR H 1 23 GLU H . . 3.370 2.720 2.660 2.789 . 0 0 "[ . 1 . 2]" 1
570 1 22 TYR H 1 23 GLU HB2 . . 5.390 4.899 4.606 5.058 . 0 0 "[ . 1 . 2]" 1
571 1 22 TYR H 1 23 GLU HB3 . . 4.960 4.834 4.597 4.980 0.020 12 0 "[ . 1 . 2]" 1
572 1 22 TYR H 1 24 ARG H . . 4.260 4.187 4.049 4.264 0.004 17 0 "[ . 1 . 2]" 1
573 1 22 TYR H 1 25 ALA H . . 4.720 4.703 4.615 4.731 0.011 7 0 "[ . 1 . 2]" 1
574 1 22 TYR H 1 25 ALA MB . . 4.560 4.566 4.475 4.588 0.028 17 0 "[ . 1 . 2]" 1
575 1 22 TYR H 1 26 ILE MD . . 5.270 5.324 5.306 5.336 0.066 7 0 "[ . 1 . 2]" 1
576 1 22 TYR H 1 53 ILE MG . . 4.130 4.058 3.974 4.145 0.015 20 0 "[ . 1 . 2]" 1
577 1 22 TYR HA 1 22 TYR QD . . 3.260 2.399 2.307 2.440 . 0 0 "[ . 1 . 2]" 1
578 1 22 TYR HA 1 22 TYR QE . . 4.610 4.641 4.590 4.659 0.049 14 0 "[ . 1 . 2]" 1
579 1 22 TYR HA 1 23 GLU HB3 . . 5.940 5.829 5.722 5.944 0.004 18 0 "[ . 1 . 2]" 1
580 1 22 TYR HA 1 24 ARG H . . 4.490 4.276 4.034 4.393 . 0 0 "[ . 1 . 2]" 1
581 1 22 TYR HA 1 25 ALA H . . 4.120 3.386 3.306 3.436 . 0 0 "[ . 1 . 2]" 1
582 1 22 TYR HA 1 25 ALA MB . . 3.400 2.500 2.415 2.536 . 0 0 "[ . 1 . 2]" 1
583 1 22 TYR HA 1 26 ILE H . . 4.780 4.313 4.211 4.390 . 0 0 "[ . 1 . 2]" 1
584 1 22 TYR HA 1 26 ILE MD . . 4.800 4.170 4.135 4.211 . 0 0 "[ . 1 . 2]" 1
585 1 22 TYR HA 1 49 ALA MB . . 3.850 2.890 2.811 2.964 . 0 0 "[ . 1 . 2]" 1
586 1 22 TYR HB2 1 23 GLU H . . 3.670 2.367 2.294 2.438 . 0 0 "[ . 1 . 2]" 1
587 1 22 TYR HB2 1 26 ILE MD . . 4.000 3.631 3.560 3.719 . 0 0 "[ . 1 . 2]" 1
588 1 22 TYR HB2 1 49 ALA HA . . 4.630 4.063 3.929 4.205 . 0 0 "[ . 1 . 2]" 1
589 1 22 TYR HB2 1 49 ALA MB . . 4.060 3.636 3.508 3.723 . 0 0 "[ . 1 . 2]" 1
590 1 22 TYR HB2 1 53 ILE H . . 5.180 4.575 4.398 4.724 . 0 0 "[ . 1 . 2]" 1
591 1 22 TYR HB2 1 53 ILE MD . . 4.160 3.369 3.242 3.554 . 0 0 "[ . 1 . 2]" 1
592 1 22 TYR HB2 1 53 ILE MG . . 3.400 2.201 2.122 2.342 . 0 0 "[ . 1 . 2]" 1
593 1 22 TYR HB3 1 23 GLU H . . 3.890 3.665 3.592 3.723 . 0 0 "[ . 1 . 2]" 1
594 1 22 TYR HB3 1 25 ALA H . . 5.350 5.285 5.212 5.341 . 0 0 "[ . 1 . 2]" 1
595 1 22 TYR HB3 1 25 ALA MB . . 4.380 4.146 4.058 4.229 . 0 0 "[ . 1 . 2]" 1
596 1 22 TYR HB3 1 26 ILE MD . . 4.110 3.483 3.398 3.563 . 0 0 "[ . 1 . 2]" 1
597 1 22 TYR HB3 1 49 ALA MB . . 4.130 2.403 2.340 2.470 . 0 0 "[ . 1 . 2]" 1
598 1 22 TYR HB3 1 53 ILE MD . . 4.580 3.979 3.849 4.111 . 0 0 "[ . 1 . 2]" 1
599 1 22 TYR HB3 1 53 ILE MG . . 3.530 3.298 3.080 3.479 . 0 0 "[ . 1 . 2]" 1
600 1 22 TYR QD 1 23 GLU H . . 4.160 3.914 3.803 4.035 . 0 0 "[ . 1 . 2]" 1
601 1 22 TYR QD 1 24 ARG H . . 5.990 5.817 5.650 5.878 . 0 0 "[ . 1 . 2]" 1
602 1 22 TYR QD 1 25 ALA H . . 5.530 5.468 5.383 5.534 0.004 3 0 "[ . 1 . 2]" 1
603 1 22 TYR QD 1 25 ALA MB . . 4.050 3.982 3.848 4.046 . 0 0 "[ . 1 . 2]" 1
604 1 22 TYR QD 1 49 ALA HA . . 3.950 3.626 3.442 3.823 . 0 0 "[ . 1 . 2]" 1
605 1 22 TYR QD 1 49 ALA MB . . 3.890 3.755 3.585 3.858 . 0 0 "[ . 1 . 2]" 1
606 1 22 TYR QD 1 52 LYS H . . 4.940 4.961 4.940 4.980 0.040 19 0 "[ . 1 . 2]" 1
607 1 22 TYR QD 1 53 ILE H . . 4.400 4.365 4.268 4.418 0.018 1 0 "[ . 1 . 2]" 1
608 1 22 TYR QD 1 53 ILE HA . . 4.330 4.006 3.872 4.268 . 0 0 "[ . 1 . 2]" 1
609 1 22 TYR QD 1 53 ILE HB . . 5.390 5.015 4.922 5.235 . 0 0 "[ . 1 . 2]" 1
610 1 22 TYR QD 1 53 ILE MG . . 3.320 2.158 2.083 2.311 . 0 0 "[ . 1 . 2]" 1
611 1 22 TYR QE 1 52 LYS HA . . 4.790 4.783 4.702 4.817 0.027 20 0 "[ . 1 . 2]" 1
612 1 22 TYR QE 1 52 LYS HB2 . . 4.600 3.960 3.815 4.037 . 0 0 "[ . 1 . 2]" 1
613 1 22 TYR QE 1 52 LYS HB3 . . 4.350 2.928 2.722 3.059 . 0 0 "[ . 1 . 2]" 1
614 1 22 TYR QE 1 52 LYS QD . . 5.680 3.825 3.323 4.196 . 0 0 "[ . 1 . 2]" 1
615 1 22 TYR QE 1 52 LYS QG . . 4.340 3.507 3.227 3.725 . 0 0 "[ . 1 . 2]" 1
616 1 22 TYR QE 1 53 ILE MG . . 4.460 3.980 3.875 4.183 . 0 0 "[ . 1 . 2]" 1
617 1 23 GLU H 1 23 GLU HB2 . . 3.200 2.370 2.146 2.502 . 0 0 "[ . 1 . 2]" 1
618 1 23 GLU H 1 23 GLU HB3 . . 3.100 2.551 2.409 2.653 . 0 0 "[ . 1 . 2]" 1
619 1 23 GLU H 1 24 ARG H . . 3.150 2.810 2.721 2.909 . 0 0 "[ . 1 . 2]" 1
620 1 23 GLU H 1 24 ARG HB2 . . 5.220 5.071 4.937 5.180 . 0 0 "[ . 1 . 2]" 1
621 1 23 GLU H 1 24 ARG QG . . 4.260 4.264 4.098 4.299 0.039 11 0 "[ . 1 . 2]" 1
622 1 23 GLU H 1 25 ALA H . . 4.130 4.121 4.050 4.156 0.026 16 0 "[ . 1 . 2]" 1
623 1 23 GLU H 1 25 ALA MB . . 4.880 4.747 4.699 4.791 . 0 0 "[ . 1 . 2]" 1
624 1 23 GLU H 1 26 ILE H . . 4.880 4.836 4.706 4.902 0.022 18 0 "[ . 1 . 2]" 1
625 1 23 GLU H 1 26 ILE MD . . 4.160 3.612 3.565 3.676 . 0 0 "[ . 1 . 2]" 1
626 1 23 GLU H 1 26 ILE HG13 . . 5.510 5.527 5.512 5.541 0.031 11 0 "[ . 1 . 2]" 1
627 1 23 GLU H 1 49 ALA MB . . 5.270 4.543 4.479 4.639 . 0 0 "[ . 1 . 2]" 1
628 1 23 GLU H 1 52 LYS HB2 . . 6.000 5.976 5.809 6.030 0.030 1 0 "[ . 1 . 2]" 1
629 1 23 GLU H 1 53 ILE MD . . 4.210 3.627 3.469 3.800 . 0 0 "[ . 1 . 2]" 1
630 1 23 GLU H 1 53 ILE HG12 . . 5.420 5.221 4.919 5.423 0.003 1 0 "[ . 1 . 2]" 1
631 1 23 GLU H 1 53 ILE MG . . 3.800 3.116 2.929 3.263 . 0 0 "[ . 1 . 2]" 1
632 1 23 GLU HA 1 23 GLU HG3 . . 3.140 2.450 2.295 2.595 . 0 0 "[ . 1 . 2]" 1
633 1 23 GLU HA 1 26 ILE H . . 3.780 3.696 3.404 3.798 0.018 5 0 "[ . 1 . 2]" 1
634 1 23 GLU HA 1 26 ILE HA . . 5.710 5.636 5.309 5.730 0.020 13 0 "[ . 1 . 2]" 1
635 1 23 GLU HA 1 26 ILE MD . . 3.120 1.998 1.950 2.040 . 0 0 "[ . 1 . 2]" 1
636 1 23 GLU HA 1 27 GLU H . . 4.890 4.749 4.441 4.908 0.018 18 0 "[ . 1 . 2]" 1
637 1 23 GLU HA 1 53 ILE MD . . 3.970 2.715 2.519 2.932 . 0 0 "[ . 1 . 2]" 1
638 1 23 GLU HB2 1 23 GLU HG3 . . 2.850 2.507 2.433 2.626 . 0 0 "[ . 1 . 2]" 1
639 1 23 GLU HB2 1 24 ARG H . . 4.050 3.974 3.806 4.077 0.027 20 0 "[ . 1 . 2]" 1
640 1 23 GLU HB3 1 23 GLU HG2 . . 2.820 2.454 2.345 2.545 . 0 0 "[ . 1 . 2]" 1
641 1 23 GLU HB3 1 24 ARG H . . 3.480 2.809 2.554 3.006 . 0 0 "[ . 1 . 2]" 1
642 1 23 GLU HB3 1 24 ARG QG . . 4.640 3.166 2.720 3.687 . 0 0 "[ . 1 . 2]" 1
643 1 23 GLU HG2 1 24 ARG H . . 4.870 4.063 3.758 4.520 . 0 0 "[ . 1 . 2]" 1
644 1 23 GLU HG2 1 24 ARG QG . . 5.850 4.245 3.728 5.015 . 0 0 "[ . 1 . 2]" 1
645 1 23 GLU HG3 1 24 ARG H . . 5.580 4.853 4.589 5.150 . 0 0 "[ . 1 . 2]" 1
646 1 23 GLU HG3 1 26 ILE MD . . 4.380 3.604 3.113 3.952 . 0 0 "[ . 1 . 2]" 1
647 1 23 GLU HG3 1 50 TYR QE . . 5.690 5.449 4.730 5.713 0.023 17 0 "[ . 1 . 2]" 1
648 1 23 GLU HG3 1 53 ILE MD . . 4.710 3.329 2.697 3.691 . 0 0 "[ . 1 . 2]" 1
649 1 24 ARG H 1 24 ARG HB2 . . 3.370 2.493 2.417 2.700 . 0 0 "[ . 1 . 2]" 1
650 1 24 ARG H 1 24 ARG HB3 . . 3.740 3.604 3.546 3.676 . 0 0 "[ . 1 . 2]" 1
651 1 24 ARG H 1 24 ARG HD2 . . 4.280 4.141 3.247 4.358 0.078 14 0 "[ . 1 . 2]" 1
652 1 24 ARG H 1 24 ARG QD . . 3.750 3.247 2.878 3.736 . 0 0 "[ . 1 . 2]" 1
653 1 24 ARG H 1 24 ARG HD3 . . 4.280 3.529 2.939 4.306 0.026 3 0 "[ . 1 . 2]" 1
654 1 24 ARG H 1 24 ARG QG . . 3.040 2.286 2.158 2.408 . 0 0 "[ . 1 . 2]" 1
655 1 24 ARG H 1 25 ALA H . . 3.280 2.385 2.255 2.586 . 0 0 "[ . 1 . 2]" 1
656 1 24 ARG H 1 25 ALA MB . . 4.190 4.083 3.921 4.195 0.005 19 0 "[ . 1 . 2]" 1
657 1 24 ARG H 1 26 ILE H . . 4.550 3.868 3.739 4.088 . 0 0 "[ . 1 . 2]" 1
658 1 24 ARG H 1 26 ILE MD . . 4.770 4.479 4.373 4.586 . 0 0 "[ . 1 . 2]" 1
659 1 24 ARG HA 1 24 ARG HD2 . . 3.740 2.511 2.197 2.911 . 0 0 "[ . 1 . 2]" 1
660 1 24 ARG HA 1 24 ARG QD . . 3.240 2.163 1.965 2.342 . 0 0 "[ . 1 . 2]" 1
661 1 24 ARG HA 1 24 ARG HD3 . . 3.740 2.656 1.998 3.780 0.040 18 0 "[ . 1 . 2]" 1
662 1 24 ARG HA 1 24 ARG HE . . 4.910 4.545 2.566 4.938 0.028 19 0 "[ . 1 . 2]" 1
663 1 24 ARG HA 1 24 ARG QG . . 3.320 3.120 2.995 3.230 . 0 0 "[ . 1 . 2]" 1
664 1 24 ARG HA 1 24 ARG QH1 . . 5.380 3.885 2.770 4.445 . 0 0 "[ . 1 . 2]" 1
665 1 24 ARG HA 1 26 ILE H . . 4.870 4.071 3.891 4.270 . 0 0 "[ . 1 . 2]" 1
666 1 24 ARG HA 1 27 GLU H . . 3.860 3.442 3.193 3.864 0.004 19 0 "[ . 1 . 2]" 1
667 1 24 ARG HA 1 27 GLU HB2 . . 3.890 3.419 3.104 3.890 . 18 0 "[ . 1 . 2]" 1
668 1 24 ARG HA 1 27 GLU HB3 . . 5.250 4.836 4.577 5.268 0.018 18 0 "[ . 1 . 2]" 1
669 1 24 ARG HA 1 27 GLU HG2 . . 4.740 4.288 4.072 4.747 0.007 20 0 "[ . 1 . 2]" 1
670 1 24 ARG HA 1 27 GLU HG3 . . 3.490 2.563 2.318 3.015 . 0 0 "[ . 1 . 2]" 1
671 1 24 ARG HB2 1 24 ARG QD . . 3.620 3.378 3.282 3.558 . 0 0 "[ . 1 . 2]" 1
672 1 24 ARG HB2 1 24 ARG HE . . 5.100 4.569 3.623 5.126 0.026 5 0 "[ . 1 . 2]" 1
673 1 24 ARG HB2 1 25 ALA H . . 3.670 2.815 2.718 2.904 . 0 0 "[ . 1 . 2]" 1
674 1 24 ARG HB2 1 25 ALA MB . . 4.200 4.090 3.804 4.218 0.018 7 0 "[ . 1 . 2]" 1
675 1 24 ARG HB3 1 24 ARG HD2 . . 4.060 2.682 2.375 3.437 . 0 0 "[ . 1 . 2]" 1
676 1 24 ARG HB3 1 24 ARG HD3 . . 4.060 3.465 3.118 3.915 . 0 0 "[ . 1 . 2]" 1
677 1 24 ARG HB3 1 25 ALA H . . 3.940 3.893 3.798 3.955 0.015 14 0 "[ . 1 . 2]" 1
678 1 24 ARG HD2 1 24 ARG QH1 . . 4.350 2.420 1.987 3.661 . 0 0 "[ . 1 . 2]" 1
679 1 24 ARG HD3 1 24 ARG QH1 . . 4.350 2.516 2.123 3.527 . 0 0 "[ . 1 . 2]" 1
680 1 24 ARG QG 1 25 ALA H . . 4.110 4.060 3.940 4.121 0.011 15 0 "[ . 1 . 2]" 1
681 1 25 ALA H 1 25 ALA MB . . 2.930 2.230 2.187 2.256 . 0 0 "[ . 1 . 2]" 1
682 1 25 ALA H 1 26 ILE H . . 3.580 2.590 2.522 2.644 . 0 0 "[ . 1 . 2]" 1
683 1 25 ALA H 1 26 ILE HA . . 6.000 5.258 5.198 5.311 . 0 0 "[ . 1 . 2]" 1
684 1 25 ALA H 1 26 ILE HB . . 4.660 4.560 4.444 4.648 . 0 0 "[ . 1 . 2]" 1
685 1 25 ALA H 1 26 ILE MD . . 4.440 4.466 4.453 4.479 0.039 13 0 "[ . 1 . 2]" 1
686 1 25 ALA H 1 26 ILE MG . . 5.980 5.758 5.682 5.847 . 0 0 "[ . 1 . 2]" 1
687 1 25 ALA H 1 27 GLU H . . 4.590 4.416 4.342 4.551 . 0 0 "[ . 1 . 2]" 1
688 1 25 ALA H 1 27 GLU HG3 . . 5.420 5.120 4.954 5.319 . 0 0 "[ . 1 . 2]" 1
689 1 25 ALA HA 1 26 ILE HA . . 5.070 4.875 4.827 4.921 . 0 0 "[ . 1 . 2]" 1
690 1 25 ALA HA 1 28 CYS HB2 . . 4.430 2.465 2.397 2.548 . 0 0 "[ . 1 . 2]" 1
691 1 25 ALA HA 1 28 CYS HB3 . . 4.860 4.013 3.954 4.120 . 0 0 "[ . 1 . 2]" 1
692 1 25 ALA HA 1 28 CYS HG . . 4.340 3.837 3.497 4.367 0.027 19 0 "[ . 1 . 2]" 1
693 1 25 ALA HA 1 29 TYR H . . 4.700 4.192 4.097 4.323 . 0 0 "[ . 1 . 2]" 1
694 1 25 ALA MB 1 26 ILE H . . 3.410 2.770 2.691 2.862 . 0 0 "[ . 1 . 2]" 1
695 1 25 ALA MB 1 26 ILE HA . . 4.370 3.997 3.940 4.067 . 0 0 "[ . 1 . 2]" 1
696 1 25 ALA MB 1 26 ILE MD . . 4.370 4.129 4.039 4.191 . 0 0 "[ . 1 . 2]" 1
697 1 25 ALA MB 1 26 ILE HG13 . . 4.080 3.631 3.483 3.736 . 0 0 "[ . 1 . 2]" 1
698 1 25 ALA MB 1 28 CYS HB3 . . 4.840 4.854 4.818 4.880 0.040 17 0 "[ . 1 . 2]" 1
699 1 25 ALA MB 1 29 TYR H . . 4.810 4.421 4.368 4.472 . 0 0 "[ . 1 . 2]" 1
700 1 26 ILE H 1 26 ILE HB . . 3.340 2.276 2.242 2.320 . 0 0 "[ . 1 . 2]" 1
701 1 26 ILE H 1 26 ILE MD . . 3.400 3.055 3.025 3.109 . 0 0 "[ . 1 . 2]" 1
702 1 26 ILE H 1 26 ILE HG12 . . 4.290 4.012 3.962 4.108 . 0 0 "[ . 1 . 2]" 1
703 1 26 ILE H 1 26 ILE HG13 . . 3.780 2.645 2.577 2.793 . 0 0 "[ . 1 . 2]" 1
704 1 26 ILE H 1 26 ILE MG . . 3.870 3.709 3.676 3.753 . 0 0 "[ . 1 . 2]" 1
705 1 26 ILE H 1 27 GLU H . . 3.580 2.727 2.655 2.802 . 0 0 "[ . 1 . 2]" 1
706 1 26 ILE H 1 27 GLU HB2 . . 5.280 5.033 4.870 5.221 . 0 0 "[ . 1 . 2]" 1
707 1 26 ILE H 1 27 GLU HG2 . . 5.320 5.316 4.634 5.375 0.055 4 0 "[ . 1 . 2]" 1
708 1 26 ILE H 1 27 GLU HG3 . . 4.260 4.196 3.985 4.311 0.051 1 0 "[ . 1 . 2]" 1
709 1 26 ILE H 1 28 CYS H . . 4.580 3.965 3.892 4.033 . 0 0 "[ . 1 . 2]" 1
710 1 26 ILE H 1 28 CYS HB2 . . 4.780 4.828 4.800 4.867 0.087 18 0 "[ . 1 . 2]" 1
711 1 26 ILE H 1 29 TYR H . . 5.340 4.973 4.906 5.065 . 0 0 "[ . 1 . 2]" 1
712 1 26 ILE H 1 29 TYR QD . . 4.950 4.503 4.366 4.625 . 0 0 "[ . 1 . 2]" 1
713 1 26 ILE H 1 46 ARG HA . . 5.210 5.164 5.052 5.244 0.034 19 0 "[ . 1 . 2]" 1
714 1 26 ILE H 1 46 ARG HG3 . . 5.130 4.828 4.702 4.913 . 0 0 "[ . 1 . 2]" 1
715 1 26 ILE H 1 49 ALA MB . . 4.000 3.496 3.416 3.607 . 0 0 "[ . 1 . 2]" 1
716 1 26 ILE H 1 53 ILE MD . . 5.310 5.226 5.172 5.315 0.005 19 0 "[ . 1 . 2]" 1
717 1 26 ILE HA 1 26 ILE MD . . 3.950 3.758 3.734 3.789 . 0 0 "[ . 1 . 2]" 1
718 1 26 ILE HA 1 26 ILE HG12 . . 3.760 2.770 2.742 2.799 . 0 0 "[ . 1 . 2]" 1
719 1 26 ILE HA 1 26 ILE HG13 . . 4.080 2.394 2.362 2.443 . 0 0 "[ . 1 . 2]" 1
720 1 26 ILE HA 1 26 ILE MG . . 3.310 2.589 2.556 2.625 . 0 0 "[ . 1 . 2]" 1
721 1 26 ILE HA 1 27 GLU HA . . 5.110 4.848 4.790 4.896 . 0 0 "[ . 1 . 2]" 1
722 1 26 ILE HA 1 29 TYR H . . 4.750 3.609 3.528 3.682 . 0 0 "[ . 1 . 2]" 1
723 1 26 ILE HA 1 29 TYR HA . . 6.000 5.850 5.747 5.954 . 0 0 "[ . 1 . 2]" 1
724 1 26 ILE HA 1 29 TYR HB2 . . 4.440 3.438 3.289 3.600 . 0 0 "[ . 1 . 2]" 1
725 1 26 ILE HA 1 29 TYR HB3 . . 5.410 5.125 4.976 5.273 . 0 0 "[ . 1 . 2]" 1
726 1 26 ILE HA 1 29 TYR QD . . 4.130 2.512 2.401 2.586 . 0 0 "[ . 1 . 2]" 1
727 1 26 ILE HA 1 30 THR H . . 4.500 3.996 3.912 4.079 . 0 0 "[ . 1 . 2]" 1
728 1 26 ILE HA 1 46 ARG H . . 5.490 5.214 5.121 5.268 . 0 0 "[ . 1 . 2]" 1
729 1 26 ILE HA 1 46 ARG HA . . 4.280 3.024 2.954 3.084 . 0 0 "[ . 1 . 2]" 1
730 1 26 ILE HA 1 46 ARG HD2 . . 5.050 3.743 3.552 3.942 . 0 0 "[ . 1 . 2]" 1
731 1 26 ILE HA 1 46 ARG HG3 . . 4.320 2.106 2.001 2.185 . 0 0 "[ . 1 . 2]" 1
732 1 26 ILE HA 1 49 ALA MB . . 4.120 3.519 3.456 3.579 . 0 0 "[ . 1 . 2]" 1
733 1 26 ILE HA 1 50 TYR H . . 5.770 5.621 5.530 5.681 . 0 0 "[ . 1 . 2]" 1
734 1 26 ILE HA 1 50 TYR QE . . 5.560 5.407 5.277 5.582 0.022 12 0 "[ . 1 . 2]" 1
735 1 26 ILE HA 1 53 ILE MD . . 5.990 6.003 5.987 6.023 0.033 6 0 "[ . 1 . 2]" 1
736 1 26 ILE HB 1 26 ILE MD . . 3.080 2.263 2.227 2.291 . 0 0 "[ . 1 . 2]" 1
737 1 26 ILE HB 1 27 GLU H . . 3.630 2.503 2.465 2.550 . 0 0 "[ . 1 . 2]" 1
738 1 26 ILE MD 1 26 ILE MG . . 2.790 2.371 2.294 2.438 . 0 0 "[ . 1 . 2]" 1
739 1 26 ILE MD 1 27 GLU H . . 4.290 4.314 4.297 4.329 0.039 16 0 "[ . 1 . 2]" 1
740 1 26 ILE MD 1 46 ARG HA . . 4.680 4.377 4.260 4.450 . 0 0 "[ . 1 . 2]" 1
741 1 26 ILE MD 1 49 ALA H . . 4.950 4.773 4.708 4.829 . 0 0 "[ . 1 . 2]" 1
742 1 26 ILE MD 1 49 ALA MB . . 3.240 2.398 2.341 2.455 . 0 0 "[ . 1 . 2]" 1
743 1 26 ILE MD 1 50 TYR H . . 3.930 2.906 2.787 3.002 . 0 0 "[ . 1 . 2]" 1
744 1 26 ILE MD 1 50 TYR HA . . 3.690 2.555 2.447 2.638 . 0 0 "[ . 1 . 2]" 1
745 1 26 ILE MD 1 50 TYR HB2 . . 4.160 4.078 3.847 4.166 0.006 1 0 "[ . 1 . 2]" 1
746 1 26 ILE MD 1 50 TYR HB3 . . 4.420 4.342 4.186 4.422 0.002 1 0 "[ . 1 . 2]" 1
747 1 26 ILE MD 1 50 TYR QD . . 3.340 3.012 2.903 3.174 . 0 0 "[ . 1 . 2]" 1
748 1 26 ILE MD 1 50 TYR QE . . 3.600 3.196 3.039 3.397 . 0 0 "[ . 1 . 2]" 1
749 1 26 ILE MD 1 51 LEU H . . 5.300 4.897 4.814 4.976 . 0 0 "[ . 1 . 2]" 1
750 1 26 ILE MD 1 52 LYS H . . 5.300 4.998 4.843 5.064 . 0 0 "[ . 1 . 2]" 1
751 1 26 ILE MD 1 53 ILE H . . 4.790 4.658 4.453 4.730 . 0 0 "[ . 1 . 2]" 1
752 1 26 ILE MD 1 53 ILE MD . . 2.790 1.993 1.958 2.017 . 0 0 "[ . 1 . 2]" 1
753 1 26 ILE MD 1 53 ILE HG12 . . 3.590 3.215 3.057 3.275 . 0 0 "[ . 1 . 2]" 1
754 1 26 ILE MD 1 53 ILE MG . . 3.860 3.648 3.503 3.754 . 0 0 "[ . 1 . 2]" 1
755 1 26 ILE HG12 1 26 ILE MG . . 3.120 2.295 2.272 2.329 . 0 0 "[ . 1 . 2]" 1
756 1 26 ILE HG13 1 26 ILE MG . . 3.310 3.181 3.163 3.199 . 0 0 "[ . 1 . 2]" 1
757 1 26 ILE HG13 1 27 GLU H . . 4.700 4.527 4.460 4.591 . 0 0 "[ . 1 . 2]" 1
758 1 26 ILE HG13 1 49 ALA MB . . 3.800 1.997 1.981 2.023 . 0 0 "[ . 1 . 2]" 1
759 1 26 ILE HG13 1 50 TYR H . . 4.710 3.855 3.768 3.926 . 0 0 "[ . 1 . 2]" 1
760 1 26 ILE MG 1 27 GLU H . . 3.460 2.826 2.766 2.896 . 0 0 "[ . 1 . 2]" 1
761 1 26 ILE MG 1 27 GLU HA . . 3.450 3.106 3.040 3.176 . 0 0 "[ . 1 . 2]" 1
762 1 26 ILE MG 1 27 GLU HG2 . . 3.970 3.340 2.784 3.544 . 0 0 "[ . 1 . 2]" 1
763 1 26 ILE MG 1 27 GLU HG3 . . 4.210 3.806 3.556 4.015 . 0 0 "[ . 1 . 2]" 1
764 1 26 ILE MG 1 28 CYS H . . 4.570 4.613 4.580 4.630 0.060 5 0 "[ . 1 . 2]" 1
765 1 26 ILE MG 1 29 TYR H . . 4.990 4.967 4.929 4.993 0.003 12 0 "[ . 1 . 2]" 1
766 1 26 ILE MG 1 29 TYR QD . . 4.340 4.474 4.391 4.540 0.200 10 0 "[ . 1 . 2]" 1
767 1 26 ILE MG 1 30 THR H . . 3.980 4.028 4.002 4.050 0.070 16 0 "[ . 1 . 2]" 1
768 1 26 ILE MG 1 30 THR HA . . 4.820 4.840 4.815 4.860 0.040 18 0 "[ . 1 . 2]" 1
769 1 26 ILE MG 1 30 THR HB . . 4.360 4.164 4.058 4.276 . 0 0 "[ . 1 . 2]" 1
770 1 26 ILE MG 1 30 THR HG1 . . 3.440 2.561 2.498 2.628 . 0 0 "[ . 1 . 2]" 1
771 1 26 ILE MG 1 30 THR MG . . 4.220 4.056 3.974 4.116 . 0 0 "[ . 1 . 2]" 1
772 1 26 ILE MG 1 46 ARG HA . . 4.190 4.139 4.055 4.196 0.006 13 0 "[ . 1 . 2]" 1
773 1 26 ILE MG 1 46 ARG HB2 . . 4.980 4.495 4.439 4.559 . 0 0 "[ . 1 . 2]" 1
774 1 26 ILE MG 1 46 ARG HD2 . . 3.580 2.108 2.025 2.185 . 0 0 "[ . 1 . 2]" 1
775 1 26 ILE MG 1 46 ARG HD3 . . 3.460 3.338 3.208 3.473 0.013 14 0 "[ . 1 . 2]" 1
776 1 26 ILE MG 1 46 ARG HE . . 4.890 4.390 4.117 4.548 . 0 0 "[ . 1 . 2]" 1
777 1 26 ILE MG 1 46 ARG HG2 . . 2.950 2.830 2.649 2.938 . 0 0 "[ . 1 . 2]" 1
778 1 26 ILE MG 1 46 ARG HG3 . . 4.360 2.359 2.271 2.445 . 0 0 "[ . 1 . 2]" 1
779 1 26 ILE MG 1 49 ALA MB . . 4.340 4.172 4.120 4.218 . 0 0 "[ . 1 . 2]" 1
780 1 26 ILE MG 1 50 TYR H . . 5.060 5.043 4.958 5.071 0.011 5 0 "[ . 1 . 2]" 1
781 1 26 ILE MG 1 50 TYR HA . . 5.250 5.200 5.049 5.276 0.026 16 0 "[ . 1 . 2]" 1
782 1 26 ILE MG 1 50 TYR QD . . 4.000 3.937 3.859 4.052 0.052 15 0 "[ . 1 . 2]" 1
783 1 26 ILE MG 1 50 TYR QE . . 3.340 2.935 2.798 3.109 . 0 0 "[ . 1 . 2]" 1
784 1 27 GLU H 1 27 GLU HB2 . . 3.210 2.784 2.665 2.856 . 0 0 "[ . 1 . 2]" 1
785 1 27 GLU H 1 27 GLU HB3 . . 3.640 3.619 3.573 3.654 0.014 9 0 "[ . 1 . 2]" 1
786 1 27 GLU H 1 27 GLU HG2 . . 3.260 2.800 2.285 2.910 . 0 0 "[ . 1 . 2]" 1
787 1 27 GLU H 1 27 GLU HG3 . . 2.950 2.055 1.880 2.338 . 0 0 "[ . 1 . 2]" 1
788 1 27 GLU H 1 28 CYS H . . 3.290 2.806 2.737 2.867 . 0 0 "[ . 1 . 2]" 1
789 1 27 GLU H 1 28 CYS HB2 . . 4.860 4.740 4.654 4.869 0.009 9 0 "[ . 1 . 2]" 1
790 1 27 GLU H 1 29 TYR QD . . 6.000 5.600 5.509 5.678 . 0 0 "[ . 1 . 2]" 1
791 1 27 GLU H 1 30 THR HG1 . . 4.130 4.158 4.144 4.172 0.042 10 0 "[ . 1 . 2]" 1
792 1 27 GLU HA 1 27 GLU HB3 . . 2.840 2.355 2.313 2.397 . 0 0 "[ . 1 . 2]" 1
793 1 27 GLU HA 1 27 GLU HG2 . . 3.360 2.580 2.489 2.674 . 0 0 "[ . 1 . 2]" 1
794 1 27 GLU HA 1 27 GLU HG3 . . 3.750 3.403 3.260 3.663 . 0 0 "[ . 1 . 2]" 1
795 1 27 GLU HA 1 29 TYR H . . 5.070 5.072 4.981 5.096 0.026 14 0 "[ . 1 . 2]" 1
796 1 27 GLU HA 1 30 THR H . . 3.830 3.740 3.650 3.809 . 0 0 "[ . 1 . 2]" 1
797 1 27 GLU HA 1 30 THR HB . . 3.510 2.648 2.570 2.741 . 0 0 "[ . 1 . 2]" 1
798 1 27 GLU HA 1 30 THR HG1 . . 3.680 2.766 2.639 2.898 . 0 0 "[ . 1 . 2]" 1
799 1 27 GLU HA 1 30 THR MG . . 3.760 3.621 3.543 3.681 . 0 0 "[ . 1 . 2]" 1
800 1 27 GLU HB2 1 28 CYS H . . 3.480 2.799 2.628 2.960 . 0 0 "[ . 1 . 2]" 1
801 1 27 GLU HB2 1 28 CYS HA . . 4.220 4.234 4.109 4.290 0.070 20 0 "[ . 1 . 2]" 1
802 1 27 GLU HB3 1 28 CYS H . . 4.280 3.910 3.814 4.068 . 0 0 "[ . 1 . 2]" 1
803 1 27 GLU HB3 1 28 CYS HA . . 4.800 4.684 4.589 4.803 0.003 1 0 "[ . 1 . 2]" 1
804 1 27 GLU HB3 1 30 THR H . . 5.530 5.580 5.553 5.619 0.089 10 0 "[ . 1 . 2]" 1
805 1 27 GLU HB3 1 30 THR MG . . 5.120 5.001 4.857 5.128 0.008 4 0 "[ . 1 . 2]" 1
806 1 27 GLU HG2 1 28 CYS H . . 4.950 4.818 4.502 4.915 . 0 0 "[ . 1 . 2]" 1
807 1 27 GLU HG2 1 30 THR MG . . 5.180 5.176 5.035 5.221 0.041 10 0 "[ . 1 . 2]" 1
808 1 27 GLU HG3 1 28 CYS H . . 4.590 4.136 3.954 4.263 . 0 0 "[ . 1 . 2]" 1
809 1 28 CYS H 1 28 CYS HB2 . . 3.580 2.204 2.122 2.333 . 0 0 "[ . 1 . 2]" 1
810 1 28 CYS H 1 28 CYS HB3 . . 3.570 3.513 3.450 3.578 0.008 19 0 "[ . 1 . 2]" 1
811 1 28 CYS H 1 29 TYR H . . 3.400 2.877 2.778 2.946 . 0 0 "[ . 1 . 2]" 1
812 1 28 CYS H 1 29 TYR HB2 . . 5.420 5.188 5.073 5.285 . 0 0 "[ . 1 . 2]" 1
813 1 28 CYS H 1 30 THR H . . 4.530 3.888 3.819 3.954 . 0 0 "[ . 1 . 2]" 1
814 1 28 CYS H 1 30 THR HB . . 4.870 4.756 4.694 4.817 . 0 0 "[ . 1 . 2]" 1
815 1 28 CYS HA 1 30 THR H . . 4.490 4.302 4.247 4.368 . 0 0 "[ . 1 . 2]" 1
816 1 28 CYS HA 1 31 ARG H . . 4.180 3.701 3.608 3.785 . 0 0 "[ . 1 . 2]" 1
817 1 28 CYS HA 1 31 ARG HB2 . . 4.460 3.989 3.841 4.111 . 0 0 "[ . 1 . 2]" 1
818 1 28 CYS HA 1 31 ARG HD3 . . 4.590 4.197 3.945 4.393 . 0 0 "[ . 1 . 2]" 1
819 1 28 CYS HA 1 31 ARG HE . . 4.270 3.015 2.493 3.729 . 0 0 "[ . 1 . 2]" 1
820 1 28 CYS HA 1 31 ARG HG2 . . 4.500 4.528 4.508 4.551 0.051 8 0 "[ . 1 . 2]" 1
821 1 28 CYS HA 1 31 ARG HG3 . . 4.170 2.824 2.776 2.856 . 0 0 "[ . 1 . 2]" 1
822 1 28 CYS HA 1 32 GLY H . . 5.460 5.157 5.023 5.278 . 0 0 "[ . 1 . 2]" 1
823 1 28 CYS HB2 1 29 TYR H . . 3.560 2.562 2.233 2.700 . 0 0 "[ . 1 . 2]" 1
824 1 28 CYS HB3 1 29 TYR H . . 3.440 2.976 2.842 3.162 . 0 0 "[ . 1 . 2]" 1
825 1 28 CYS HB3 1 29 TYR HA . . 4.330 4.035 3.949 4.225 . 0 0 "[ . 1 . 2]" 1
826 1 28 CYS HB3 1 32 GLY H . . 6.000 5.863 5.763 6.007 0.007 16 0 "[ . 1 . 2]" 1
827 1 29 TYR H 1 29 TYR HB2 . . 3.730 2.701 2.645 2.766 . 0 0 "[ . 1 . 2]" 1
828 1 29 TYR H 1 29 TYR HB3 . . 3.780 3.595 3.571 3.616 . 0 0 "[ . 1 . 2]" 1
829 1 29 TYR H 1 29 TYR QD . . 3.860 2.990 2.961 3.006 . 0 0 "[ . 1 . 2]" 1
830 1 29 TYR H 1 29 TYR QE . . 4.540 4.319 4.296 4.363 . 0 0 "[ . 1 . 2]" 1
831 1 29 TYR H 1 30 THR H . . 3.490 2.745 2.701 2.816 . 0 0 "[ . 1 . 2]" 1
832 1 29 TYR H 1 30 THR HB . . 5.790 4.921 4.838 5.004 . 0 0 "[ . 1 . 2]" 1
833 1 29 TYR H 1 30 THR HG1 . . 5.370 4.403 4.338 4.481 . 0 0 "[ . 1 . 2]" 1
834 1 29 TYR H 1 31 ARG H . . 4.480 4.482 4.455 4.504 0.024 15 0 "[ . 1 . 2]" 1
835 1 29 TYR H 1 31 ARG HG3 . . 5.360 5.268 5.189 5.337 . 0 0 "[ . 1 . 2]" 1
836 1 29 TYR H 1 42 LEU MD2 . . 4.970 4.795 4.714 4.861 . 0 0 "[ . 1 . 2]" 1
837 1 29 TYR H 1 45 ASN QB . . 5.400 5.398 5.339 5.437 0.037 15 0 "[ . 1 . 2]" 1
838 1 29 TYR H 1 46 ARG H . . 5.820 5.828 5.790 5.849 0.029 17 0 "[ . 1 . 2]" 1
839 1 29 TYR H 1 46 ARG HB2 . . 4.810 4.812 4.760 4.823 0.013 20 0 "[ . 1 . 2]" 1
840 1 29 TYR H 1 46 ARG HG3 . . 4.680 4.684 4.491 4.714 0.034 3 0 "[ . 1 . 2]" 1
841 1 29 TYR HA 1 29 TYR QD . . 3.650 2.494 2.465 2.530 . 0 0 "[ . 1 . 2]" 1
842 1 29 TYR HA 1 31 ARG HG3 . . 5.780 5.429 5.326 5.527 . 0 0 "[ . 1 . 2]" 1
843 1 29 TYR HA 1 32 GLY H . . 4.090 3.236 3.201 3.277 . 0 0 "[ . 1 . 2]" 1
844 1 29 TYR HA 1 32 GLY HA3 . . 4.120 3.829 3.712 3.954 . 0 0 "[ . 1 . 2]" 1
845 1 29 TYR HA 1 33 ILE H . . 4.660 4.341 4.279 4.416 . 0 0 "[ . 1 . 2]" 1
846 1 29 TYR HA 1 33 ILE HG13 . . 6.000 5.201 5.056 5.371 . 0 0 "[ . 1 . 2]" 1
847 1 29 TYR HA 1 42 LEU HA . . 4.280 4.267 4.165 4.303 0.023 11 0 "[ . 1 . 2]" 1
848 1 29 TYR HA 1 42 LEU MD2 . . 3.440 2.460 2.368 2.537 . 0 0 "[ . 1 . 2]" 1
849 1 29 TYR HA 1 42 LEU HG . . 5.500 5.362 5.253 5.448 . 0 0 "[ . 1 . 2]" 1
850 1 29 TYR HA 1 46 ARG H . . 5.750 5.779 5.756 5.799 0.049 18 0 "[ . 1 . 2]" 1
851 1 29 TYR HB2 1 30 THR H . . 3.900 2.905 2.835 2.988 . 0 0 "[ . 1 . 2]" 1
852 1 29 TYR HB2 1 32 GLY H . . 5.350 5.372 5.360 5.386 0.036 19 0 "[ . 1 . 2]" 1
853 1 29 TYR HB2 1 33 ILE H . . 5.480 5.447 5.342 5.494 0.014 18 0 "[ . 1 . 2]" 1
854 1 29 TYR HB2 1 33 ILE MD . . 3.970 3.596 3.531 3.628 . 0 0 "[ . 1 . 2]" 1
855 1 29 TYR HB2 1 42 LEU MD2 . . 4.320 4.247 4.171 4.323 0.003 11 0 "[ . 1 . 2]" 1
856 1 29 TYR HB2 1 43 PRO HA . . 4.880 4.879 4.763 4.912 0.032 20 0 "[ . 1 . 2]" 1
857 1 29 TYR HB2 1 46 ARG H . . 3.710 3.585 3.477 3.679 . 0 0 "[ . 1 . 2]" 1
858 1 29 TYR HB2 1 46 ARG HA . . 4.140 3.662 3.595 3.729 . 0 0 "[ . 1 . 2]" 1
859 1 29 TYR HB2 1 46 ARG HB2 . . 4.730 2.224 2.173 2.269 . 0 0 "[ . 1 . 2]" 1
860 1 29 TYR HB3 1 30 THR H . . 4.140 4.028 3.974 4.092 . 0 0 "[ . 1 . 2]" 1
861 1 29 TYR HB3 1 32 GLY H . . 4.980 4.929 4.895 4.957 . 0 0 "[ . 1 . 2]" 1
862 1 29 TYR HB3 1 33 ILE MD . . 4.190 3.309 3.172 3.413 . 0 0 "[ . 1 . 2]" 1
863 1 29 TYR HB3 1 42 LEU MD2 . . 4.110 2.920 2.834 3.004 . 0 0 "[ . 1 . 2]" 1
864 1 29 TYR HB3 1 46 ARG H . . 4.220 3.502 3.454 3.535 . 0 0 "[ . 1 . 2]" 1
865 1 29 TYR HB3 1 46 ARG HB2 . . 4.820 2.913 2.784 3.054 . 0 0 "[ . 1 . 2]" 1
866 1 29 TYR QD 1 30 THR H . . 4.420 4.308 4.274 4.351 . 0 0 "[ . 1 . 2]" 1
867 1 29 TYR QD 1 31 ARG H . . 6.000 6.003 5.964 6.017 0.017 3 0 "[ . 1 . 2]" 1
868 1 29 TYR QD 1 32 GLY H . . 5.420 5.424 5.379 5.445 0.025 12 0 "[ . 1 . 2]" 1
869 1 29 TYR QD 1 42 LEU MD2 . . 3.630 2.583 2.459 2.710 . 0 0 "[ . 1 . 2]" 1
870 1 29 TYR QD 1 45 ASN H . . 5.170 5.096 5.036 5.135 . 0 0 "[ . 1 . 2]" 1
871 1 29 TYR QD 1 46 ARG H . . 4.240 3.250 3.181 3.323 . 0 0 "[ . 1 . 2]" 1
872 1 29 TYR QD 1 46 ARG HA . . 3.840 2.306 2.220 2.440 . 0 0 "[ . 1 . 2]" 1
873 1 29 TYR QD 1 49 ALA MB . . 4.070 3.554 3.466 3.619 . 0 0 "[ . 1 . 2]" 1
874 1 30 THR H 1 30 THR HB . . 3.290 2.489 2.397 2.545 . 0 0 "[ . 1 . 2]" 1
875 1 30 THR H 1 30 THR HG1 . . 3.180 2.199 2.095 2.269 . 0 0 "[ . 1 . 2]" 1
876 1 30 THR H 1 30 THR MG . . 3.820 3.790 3.748 3.818 . 0 0 "[ . 1 . 2]" 1
877 1 30 THR H 1 31 ARG H . . 3.450 2.843 2.809 2.894 . 0 0 "[ . 1 . 2]" 1
878 1 30 THR H 1 31 ARG HG2 . . 5.330 5.329 5.197 5.350 0.020 4 0 "[ . 1 . 2]" 1
879 1 30 THR H 1 31 ARG HG3 . . 4.410 4.283 4.156 4.380 . 0 0 "[ . 1 . 2]" 1
880 1 30 THR H 1 33 ILE MD . . 4.380 4.124 4.062 4.229 . 0 0 "[ . 1 . 2]" 1
881 1 30 THR H 1 42 LEU MD2 . . 5.220 5.133 5.050 5.204 . 0 0 "[ . 1 . 2]" 1
882 1 30 THR H 1 46 ARG HA . . 5.790 5.801 5.756 5.822 0.032 17 0 "[ . 1 . 2]" 1
883 1 30 THR H 1 46 ARG HD3 . . 4.310 2.991 2.850 3.065 . 0 0 "[ . 1 . 2]" 1
884 1 30 THR HA 1 30 THR MG . . 3.050 2.466 2.412 2.533 . 0 0 "[ . 1 . 2]" 1
885 1 30 THR HA 1 33 ILE H . . 4.130 3.681 3.605 3.778 . 0 0 "[ . 1 . 2]" 1
886 1 30 THR HA 1 33 ILE HB . . 4.100 3.120 2.969 3.322 . 0 0 "[ . 1 . 2]" 1
887 1 30 THR HA 1 33 ILE MD . . 3.340 2.497 2.366 2.604 . 0 0 "[ . 1 . 2]" 1
888 1 30 THR HA 1 33 ILE MG . . 4.810 4.399 4.229 4.599 . 0 0 "[ . 1 . 2]" 1
889 1 30 THR HA 1 34 ALA H . . 4.800 4.518 4.426 4.612 . 0 0 "[ . 1 . 2]" 1
890 1 30 THR HA 1 34 ALA MB . . 4.890 4.659 4.548 4.866 . 0 0 "[ . 1 . 2]" 1
891 1 30 THR HA 1 46 ARG HD3 . . 4.930 2.821 2.695 2.914 . 0 0 "[ . 1 . 2]" 1
892 1 30 THR HA 1 46 ARG HE . . 5.670 4.639 4.466 4.836 . 0 0 "[ . 1 . 2]" 1
893 1 30 THR HB 1 31 ARG H . . 3.520 2.745 2.687 2.795 . 0 0 "[ . 1 . 2]" 1
894 1 30 THR HB 1 32 GLY H . . 5.100 5.044 4.981 5.102 0.002 16 0 "[ . 1 . 2]" 1
895 1 30 THR HG1 1 30 THR MG . . 3.150 2.950 2.894 2.998 . 0 0 "[ . 1 . 2]" 1
896 1 30 THR HG1 1 33 ILE MD . . 5.460 4.653 4.556 4.752 . 0 0 "[ . 1 . 2]" 1
897 1 30 THR MG 1 31 ARG H . . 3.520 3.517 3.475 3.537 0.017 9 0 "[ . 1 . 2]" 1
898 1 30 THR MG 1 31 ARG HA . . 3.740 3.540 3.433 3.625 . 0 0 "[ . 1 . 2]" 1
899 1 30 THR MG 1 32 GLY H . . 5.110 5.014 4.971 5.050 . 0 0 "[ . 1 . 2]" 1
900 1 30 THR MG 1 33 ILE H . . 5.100 5.005 4.916 5.067 . 0 0 "[ . 1 . 2]" 1
901 1 30 THR MG 1 33 ILE HB . . 4.320 4.214 4.035 4.327 0.007 13 0 "[ . 1 . 2]" 1
902 1 30 THR MG 1 33 ILE MD . . 4.150 4.105 3.957 4.165 0.015 3 0 "[ . 1 . 2]" 1
903 1 30 THR MG 1 34 ALA H . . 4.600 4.574 4.479 4.625 0.025 16 0 "[ . 1 . 2]" 1
904 1 30 THR MG 1 46 ARG HD2 . . 4.020 3.929 3.862 3.998 . 0 0 "[ . 1 . 2]" 1
905 1 30 THR MG 1 46 ARG HD3 . . 4.380 4.197 4.080 4.296 . 0 0 "[ . 1 . 2]" 1
906 1 30 THR MG 1 46 ARG QH1 . . 3.870 2.164 2.094 2.267 . 0 0 "[ . 1 . 2]" 1
907 1 31 ARG H 1 31 ARG HD2 . . 4.630 4.671 4.650 4.694 0.064 4 0 "[ . 1 . 2]" 1
908 1 31 ARG H 1 31 ARG HD3 . . 4.660 4.521 4.425 4.602 . 0 0 "[ . 1 . 2]" 1
909 1 31 ARG H 1 31 ARG HE . . 5.210 4.153 3.861 4.517 . 0 0 "[ . 1 . 2]" 1
910 1 31 ARG H 1 31 ARG HG2 . . 3.520 2.890 2.832 2.929 . 0 0 "[ . 1 . 2]" 1
911 1 31 ARG H 1 31 ARG HG3 . . 3.780 2.065 1.974 2.158 . 0 0 "[ . 1 . 2]" 1
912 1 31 ARG H 1 32 GLY H . . 3.460 2.607 2.547 2.674 . 0 0 "[ . 1 . 2]" 1
913 1 31 ARG H 1 32 GLY HA3 . . 5.040 4.906 4.821 4.984 . 0 0 "[ . 1 . 2]" 1
914 1 31 ARG H 1 33 ILE H . . 4.870 4.446 4.376 4.513 . 0 0 "[ . 1 . 2]" 1
915 1 31 ARG H 1 33 ILE MD . . 5.270 5.099 5.040 5.154 . 0 0 "[ . 1 . 2]" 1
916 1 31 ARG H 1 34 ALA H . . 5.000 4.930 4.839 5.004 0.004 4 0 "[ . 1 . 2]" 1
917 1 31 ARG H 1 42 LEU MD2 . . 5.110 5.122 5.074 5.142 0.032 13 0 "[ . 1 . 2]" 1
918 1 31 ARG HA 1 31 ARG HD2 . . 4.200 4.104 4.027 4.206 0.006 19 0 "[ . 1 . 2]" 1
919 1 31 ARG HA 1 31 ARG HD3 . . 4.620 4.670 4.647 4.689 0.069 6 0 "[ . 1 . 2]" 1
920 1 31 ARG HA 1 33 ILE H . . 4.960 4.783 4.698 4.910 . 0 0 "[ . 1 . 2]" 1
921 1 31 ARG HA 1 34 ALA H . . 3.850 3.626 3.522 3.758 . 0 0 "[ . 1 . 2]" 1
922 1 31 ARG HA 1 34 ALA MB . . 2.970 2.621 2.479 2.779 . 0 0 "[ . 1 . 2]" 1
923 1 31 ARG HA 1 35 ALA H . . 4.650 4.627 4.537 4.667 0.017 12 0 "[ . 1 . 2]" 1
924 1 31 ARG HB2 1 31 ARG HE . . 3.970 2.425 2.308 2.561 . 0 0 "[ . 1 . 2]" 1
925 1 31 ARG HB2 1 32 GLY H . . 3.690 2.817 2.712 2.926 . 0 0 "[ . 1 . 2]" 1
926 1 31 ARG HB3 1 31 ARG HD2 . . 3.940 2.321 2.243 2.447 . 0 0 "[ . 1 . 2]" 1
927 1 31 ARG HB3 1 31 ARG HD3 . . 3.960 3.578 3.515 3.659 . 0 0 "[ . 1 . 2]" 1
928 1 31 ARG HB3 1 31 ARG HE . . 3.930 3.282 3.032 3.456 . 0 0 "[ . 1 . 2]" 1
929 1 31 ARG HB3 1 34 ALA H . . 5.590 5.342 5.215 5.462 . 0 0 "[ . 1 . 2]" 1
930 1 31 ARG HB3 1 35 ALA H . . 6.000 5.471 5.329 5.618 . 0 0 "[ . 1 . 2]" 1
931 1 31 ARG HD2 1 32 GLY H . . 6.000 5.790 5.694 5.904 . 0 0 "[ . 1 . 2]" 1
932 1 31 ARG HE 1 31 ARG HG3 . . 4.070 2.666 2.343 3.057 . 0 0 "[ . 1 . 2]" 1
933 1 32 GLY H 1 33 ILE H . . 3.520 2.707 2.651 2.801 . 0 0 "[ . 1 . 2]" 1
934 1 32 GLY H 1 33 ILE MD . . 4.590 4.583 4.529 4.599 0.009 5 0 "[ . 1 . 2]" 1
935 1 32 GLY H 1 34 ALA H . . 4.430 3.843 3.739 3.948 . 0 0 "[ . 1 . 2]" 1
936 1 32 GLY H 1 34 ALA MB . . 5.000 4.653 4.552 4.765 . 0 0 "[ . 1 . 2]" 1
937 1 32 GLY H 1 35 ALA H . . 5.000 4.631 4.586 4.697 . 0 0 "[ . 1 . 2]" 1
938 1 32 GLY H 1 35 ALA MB . . 4.460 4.449 4.379 4.491 0.031 18 0 "[ . 1 . 2]" 1
939 1 32 GLY H 1 42 LEU MD2 . . 3.660 3.255 3.197 3.308 . 0 0 "[ . 1 . 2]" 1
940 1 32 GLY HA2 1 33 ILE HA . . 4.880 4.864 4.846 4.883 0.003 6 0 "[ . 1 . 2]" 1
941 1 32 GLY HA2 1 34 ALA H . . 4.170 4.022 3.959 4.099 . 0 0 "[ . 1 . 2]" 1
942 1 32 GLY HA2 1 35 ALA H . . 4.250 3.144 3.065 3.226 . 0 0 "[ . 1 . 2]" 1
943 1 32 GLY HA2 1 35 ALA MB . . 3.590 2.266 2.197 2.321 . 0 0 "[ . 1 . 2]" 1
944 1 32 GLY HA2 1 36 ASP HB2 . . 5.760 4.775 4.506 5.084 . 0 0 "[ . 1 . 2]" 1
945 1 32 GLY HA2 1 42 LEU MD1 . . 3.310 3.239 3.172 3.313 0.003 11 0 "[ . 1 . 2]" 1
946 1 32 GLY HA2 1 42 LEU MD2 . . 4.680 3.602 3.520 3.659 . 0 0 "[ . 1 . 2]" 1
947 1 32 GLY HA3 1 35 ALA H . . 4.640 4.292 4.234 4.355 . 0 0 "[ . 1 . 2]" 1
948 1 32 GLY HA3 1 35 ALA MB . . 3.980 3.799 3.707 3.874 . 0 0 "[ . 1 . 2]" 1
949 1 32 GLY HA3 1 42 LEU MD1 . . 3.300 2.399 2.339 2.521 . 0 0 "[ . 1 . 2]" 1
950 1 32 GLY HA3 1 42 LEU MD2 . . 2.900 2.151 2.087 2.190 . 0 0 "[ . 1 . 2]" 1
951 1 32 GLY HA3 1 42 LEU HG . . 4.990 4.475 4.420 4.527 . 0 0 "[ . 1 . 2]" 1
952 1 33 ILE H 1 33 ILE HB . . 3.330 2.404 2.357 2.451 . 0 0 "[ . 1 . 2]" 1
953 1 33 ILE H 1 33 ILE MD . . 3.420 2.927 2.779 2.989 . 0 0 "[ . 1 . 2]" 1
954 1 33 ILE H 1 33 ILE HG12 . . 4.000 3.903 3.828 3.958 . 0 0 "[ . 1 . 2]" 1
955 1 33 ILE H 1 33 ILE HG13 . . 3.600 2.470 2.373 2.544 . 0 0 "[ . 1 . 2]" 1
956 1 33 ILE H 1 33 ILE MG . . 3.910 3.785 3.767 3.817 . 0 0 "[ . 1 . 2]" 1
957 1 33 ILE H 1 34 ALA H . . 3.370 2.668 2.640 2.689 . 0 0 "[ . 1 . 2]" 1
958 1 33 ILE H 1 34 ALA HA . . 5.350 5.338 5.310 5.353 0.003 16 0 "[ . 1 . 2]" 1
959 1 33 ILE H 1 34 ALA MB . . 4.620 4.339 4.274 4.370 . 0 0 "[ . 1 . 2]" 1
960 1 33 ILE H 1 35 ALA H . . 4.330 4.004 3.969 4.030 . 0 0 "[ . 1 . 2]" 1
961 1 33 ILE H 1 35 ALA MB . . 5.050 4.827 4.738 4.890 . 0 0 "[ . 1 . 2]" 1
962 1 33 ILE H 1 36 ASP H . . 5.010 4.872 4.824 4.961 . 0 0 "[ . 1 . 2]" 1
963 1 33 ILE H 1 37 GLY HA2 . . 5.840 5.411 5.108 5.537 . 0 0 "[ . 1 . 2]" 1
964 1 33 ILE H 1 42 LEU HB2 . . 4.670 4.432 4.313 4.609 . 0 0 "[ . 1 . 2]" 1
965 1 33 ILE H 1 42 LEU MD1 . . 3.710 2.943 2.897 3.050 . 0 0 "[ . 1 . 2]" 1
966 1 33 ILE H 1 42 LEU MD2 . . 3.300 3.306 3.298 3.311 0.011 1 0 "[ . 1 . 2]" 1
967 1 33 ILE H 1 43 PRO HD3 . . 5.420 5.201 5.078 5.286 . 0 0 "[ . 1 . 2]" 1
968 1 33 ILE HA 1 33 ILE MD . . 3.960 3.833 3.804 3.847 . 0 0 "[ . 1 . 2]" 1
969 1 33 ILE HA 1 33 ILE HG12 . . 3.720 2.895 2.838 2.989 . 0 0 "[ . 1 . 2]" 1
970 1 33 ILE HA 1 33 ILE HG13 . . 3.740 2.516 2.457 2.560 . 0 0 "[ . 1 . 2]" 1
971 1 33 ILE HA 1 33 ILE MG . . 3.120 2.520 2.488 2.554 . 0 0 "[ . 1 . 2]" 1
972 1 33 ILE HA 1 34 ALA HA . . 4.890 4.693 4.674 4.732 . 0 0 "[ . 1 . 2]" 1
973 1 33 ILE HA 1 35 ALA H . . 4.000 3.996 3.960 4.016 0.016 4 0 "[ . 1 . 2]" 1
974 1 33 ILE HA 1 36 ASP H . . 3.660 3.558 3.481 3.632 . 0 0 "[ . 1 . 2]" 1
975 1 33 ILE HA 1 37 GLY HA2 . . 4.580 2.542 2.237 2.682 . 0 0 "[ . 1 . 2]" 1
976 1 33 ILE HA 1 42 LEU HB2 . . 4.350 4.065 3.978 4.187 . 0 0 "[ . 1 . 2]" 1
977 1 33 ILE HA 1 42 LEU HB3 . . 4.260 4.148 4.037 4.211 . 0 0 "[ . 1 . 2]" 1
978 1 33 ILE HA 1 42 LEU MD1 . . 3.360 2.837 2.724 2.925 . 0 0 "[ . 1 . 2]" 1
979 1 33 ILE HA 1 43 PRO HD2 . . 6.000 5.958 5.857 6.005 0.005 20 0 "[ . 1 . 2]" 1
980 1 33 ILE HA 1 43 PRO HD3 . . 4.690 4.340 4.229 4.386 . 0 0 "[ . 1 . 2]" 1
981 1 33 ILE HB 1 33 ILE MD . . 3.070 2.184 2.142 2.211 . 0 0 "[ . 1 . 2]" 1
982 1 33 ILE HB 1 34 ALA H . . 3.270 2.947 2.896 2.987 . 0 0 "[ . 1 . 2]" 1
983 1 33 ILE HB 1 34 ALA HA . . 4.600 4.604 4.545 4.624 0.024 1 0 "[ . 1 . 2]" 1
984 1 33 ILE HB 1 34 ALA MB . . 4.090 3.958 3.887 4.093 0.003 16 0 "[ . 1 . 2]" 1
985 1 33 ILE HB 1 35 ALA H . . 5.190 4.988 4.937 5.023 . 0 0 "[ . 1 . 2]" 1
986 1 33 ILE HB 1 37 GLY HA2 . . 5.030 4.951 4.706 5.055 0.025 19 0 "[ . 1 . 2]" 1
987 1 33 ILE MD 1 33 ILE MG . . 2.750 2.381 2.317 2.479 . 0 0 "[ . 1 . 2]" 1
988 1 33 ILE MD 1 34 ALA H . . 4.500 4.480 4.391 4.509 0.009 6 0 "[ . 1 . 2]" 1
989 1 33 ILE MD 1 42 LEU H . . 5.130 5.145 5.131 5.152 0.022 11 0 "[ . 1 . 2]" 1
990 1 33 ILE MD 1 42 LEU HB3 . . 3.470 2.765 2.641 2.836 . 0 0 "[ . 1 . 2]" 1
991 1 33 ILE MD 1 42 LEU MD1 . . 4.500 4.006 3.866 4.097 . 0 0 "[ . 1 . 2]" 1
992 1 33 ILE MD 1 42 LEU MD2 . . 4.130 3.935 3.847 4.009 . 0 0 "[ . 1 . 2]" 1
993 1 33 ILE MD 1 43 PRO HA . . 3.330 2.120 2.086 2.173 . 0 0 "[ . 1 . 2]" 1
994 1 33 ILE MD 1 43 PRO HB2 . . 3.950 3.892 3.816 3.951 0.001 2 0 "[ . 1 . 2]" 1
995 1 33 ILE MD 1 43 PRO HD2 . . 4.430 4.142 4.079 4.198 . 0 0 "[ . 1 . 2]" 1
996 1 33 ILE MD 1 43 PRO HD3 . . 3.660 3.003 2.932 3.077 . 0 0 "[ . 1 . 2]" 1
997 1 33 ILE MD 1 44 ALA H . . 4.890 4.786 4.719 4.829 . 0 0 "[ . 1 . 2]" 1
998 1 33 ILE MD 1 46 ARG H . . 4.380 4.250 4.155 4.350 . 0 0 "[ . 1 . 2]" 1
999 1 33 ILE MD 1 46 ARG HB2 . . 3.390 3.158 3.058 3.245 . 0 0 "[ . 1 . 2]" 1
1000 1 33 ILE MD 1 46 ARG HB3 . . 3.990 3.368 3.299 3.453 . 0 0 "[ . 1 . 2]" 1
1001 1 33 ILE MD 1 46 ARG HD2 . . 4.410 3.943 3.860 4.090 . 0 0 "[ . 1 . 2]" 1
1002 1 33 ILE MD 1 46 ARG HE . . 4.740 2.901 2.683 3.216 . 0 0 "[ . 1 . 2]" 1
1003 1 33 ILE MD 1 46 ARG QH1 . . 4.270 3.182 2.857 3.625 . 0 0 "[ . 1 . 2]" 1
1004 1 33 ILE MD 1 47 ALA H . . 5.500 5.188 5.097 5.305 . 0 0 "[ . 1 . 2]" 1
1005 1 33 ILE HG12 1 33 ILE MG . . 3.140 2.202 2.178 2.237 . 0 0 "[ . 1 . 2]" 1
1006 1 33 ILE HG12 1 42 LEU MD1 . . 4.420 3.937 3.794 4.202 . 0 0 "[ . 1 . 2]" 1
1007 1 33 ILE HG12 1 43 PRO HD2 . . 4.790 4.210 4.142 4.249 . 0 0 "[ . 1 . 2]" 1
1008 1 33 ILE HG12 1 65 GLN HE21 . . 5.580 5.624 5.602 5.638 0.058 1 0 "[ . 1 . 2]" 1
1009 1 33 ILE HG13 1 35 ALA H . . 5.850 5.757 5.692 5.789 . 0 0 "[ . 1 . 2]" 1
1010 1 33 ILE HG13 1 39 ASN H . . 6.000 5.980 5.787 6.022 0.022 13 0 "[ . 1 . 2]" 1
1011 1 33 ILE HG13 1 42 LEU HB2 . . 4.720 2.630 2.567 2.728 . 0 0 "[ . 1 . 2]" 1
1012 1 33 ILE HG13 1 42 LEU MD1 . . 3.660 2.746 2.572 2.908 . 0 0 "[ . 1 . 2]" 1
1013 1 33 ILE MG 1 34 ALA H . . 3.600 3.568 3.524 3.602 0.002 13 0 "[ . 1 . 2]" 1
1014 1 33 ILE MG 1 34 ALA HA . . 3.480 3.523 3.501 3.541 0.061 9 0 "[ . 1 . 2]" 1
1015 1 33 ILE MG 1 34 ALA MB . . 3.950 3.795 3.723 3.906 . 0 0 "[ . 1 . 2]" 1
1016 1 33 ILE MG 1 35 ALA H . . 4.860 4.868 4.838 4.891 0.031 16 0 "[ . 1 . 2]" 1
1017 1 33 ILE MG 1 36 ASP H . . 4.860 4.892 4.865 4.913 0.053 14 0 "[ . 1 . 2]" 1
1018 1 33 ILE MG 1 37 GLY H . . 4.330 3.975 3.870 4.062 . 0 0 "[ . 1 . 2]" 1
1019 1 33 ILE MG 1 37 GLY HA2 . . 3.720 2.605 2.476 2.701 . 0 0 "[ . 1 . 2]" 1
1020 1 33 ILE MG 1 37 GLY HA3 . . 4.700 3.606 3.371 3.793 . 0 0 "[ . 1 . 2]" 1
1021 1 33 ILE MG 1 38 ALA H . . 5.390 5.305 5.190 5.401 0.011 1 0 "[ . 1 . 2]" 1
1022 1 33 ILE MG 1 43 PRO HA . . 4.790 4.835 4.813 4.856 0.066 17 0 "[ . 1 . 2]" 1
1023 1 33 ILE MG 1 43 PRO HD3 . . 4.400 4.169 4.140 4.219 . 0 0 "[ . 1 . 2]" 1
1024 1 33 ILE MG 1 46 ARG QH1 . . 4.740 4.002 3.527 4.742 0.002 8 0 "[ . 1 . 2]" 1
1025 1 33 ILE MG 1 65 GLN HE22 . . 4.820 4.834 4.763 4.865 0.045 9 0 "[ . 1 . 2]" 1
1026 1 33 ILE MG 1 65 GLN HG2 . . 4.380 3.380 3.203 3.500 . 0 0 "[ . 1 . 2]" 1
1027 1 33 ILE MG 1 65 GLN HG3 . . 4.840 4.322 4.165 4.422 . 0 0 "[ . 1 . 2]" 1
1028 1 34 ALA H 1 34 ALA MB . . 2.600 2.254 2.211 2.283 . 0 0 "[ . 1 . 2]" 1
1029 1 34 ALA H 1 35 ALA H . . 3.120 2.380 2.362 2.396 . 0 0 "[ . 1 . 2]" 1
1030 1 34 ALA H 1 35 ALA HA . . 5.010 5.054 5.037 5.067 0.057 10 0 "[ . 1 . 2]" 1
1031 1 34 ALA H 1 35 ALA MB . . 4.050 4.014 3.974 4.051 0.001 7 0 "[ . 1 . 2]" 1
1032 1 34 ALA H 1 36 ASP H . . 3.940 3.957 3.923 3.979 0.039 16 0 "[ . 1 . 2]" 1
1033 1 34 ALA H 1 42 LEU MD1 . . 4.580 4.622 4.600 4.645 0.065 11 0 "[ . 1 . 2]" 1
1034 1 34 ALA HA 1 36 ASP H . . 4.470 4.284 4.186 4.389 . 0 0 "[ . 1 . 2]" 1
1035 1 34 ALA MB 1 35 ALA H . . 3.230 3.115 3.051 3.171 . 0 0 "[ . 1 . 2]" 1
1036 1 34 ALA MB 1 35 ALA HA . . 4.180 4.162 4.014 4.204 0.024 3 0 "[ . 1 . 2]" 1
1037 1 34 ALA MB 1 36 ASP H . . 4.690 4.697 4.603 4.720 0.030 12 0 "[ . 1 . 2]" 1
1038 1 35 ALA H 1 35 ALA MB . . 2.520 2.294 2.250 2.334 . 0 0 "[ . 1 . 2]" 1
1039 1 35 ALA H 1 36 ASP H . . 2.880 2.174 2.126 2.226 . 0 0 "[ . 1 . 2]" 1
1040 1 35 ALA H 1 36 ASP HA . . 4.990 4.993 4.956 5.016 0.026 5 0 "[ . 1 . 2]" 1
1041 1 35 ALA H 1 36 ASP HB2 . . 4.890 4.813 4.627 4.923 0.033 16 0 "[ . 1 . 2]" 1
1042 1 35 ALA H 1 36 ASP HB3 . . 5.110 4.258 4.032 4.416 . 0 0 "[ . 1 . 2]" 1
1043 1 35 ALA H 1 37 GLY H . . 5.090 3.973 3.814 4.117 . 0 0 "[ . 1 . 2]" 1
1044 1 35 ALA H 1 42 LEU MD1 . . 4.460 4.478 4.404 4.509 0.049 20 0 "[ . 1 . 2]" 1
1045 1 35 ALA MB 1 36 ASP H . . 3.080 2.884 2.683 3.061 . 0 0 "[ . 1 . 2]" 1
1046 1 35 ALA MB 1 36 ASP HA . . 4.440 4.201 4.007 4.343 . 0 0 "[ . 1 . 2]" 1
1047 1 35 ALA MB 1 36 ASP HB2 . . 3.920 3.452 3.103 3.668 . 0 0 "[ . 1 . 2]" 1
1048 1 35 ALA MB 1 42 LEU MD1 . . 4.230 4.151 3.864 4.242 0.012 8 0 "[ . 1 . 2]" 1
1049 1 36 ASP H 1 36 ASP HB2 . . 3.470 3.199 3.079 3.307 . 0 0 "[ . 1 . 2]" 1
1050 1 36 ASP H 1 36 ASP HB3 . . 3.540 2.576 2.423 2.696 . 0 0 "[ . 1 . 2]" 1
1051 1 36 ASP H 1 37 GLY H . . 3.770 2.270 2.153 2.400 . 0 0 "[ . 1 . 2]" 1
1052 1 36 ASP H 1 37 GLY HA2 . . 4.480 4.236 4.121 4.401 . 0 0 "[ . 1 . 2]" 1
1053 1 36 ASP H 1 37 GLY HA3 . . 4.270 4.255 4.169 4.301 0.031 5 0 "[ . 1 . 2]" 1
1054 1 36 ASP H 1 38 ALA H . . 4.790 4.718 4.647 4.792 0.002 10 0 "[ . 1 . 2]" 1
1055 1 36 ASP H 1 42 LEU MD1 . . 4.170 4.058 3.914 4.182 0.012 19 0 "[ . 1 . 2]" 1
1056 1 36 ASP HA 1 37 GLY HA3 . . 4.830 4.788 4.727 4.838 0.008 13 0 "[ . 1 . 2]" 1
1057 1 36 ASP HA 1 38 ALA H . . 4.660 4.236 4.143 4.388 . 0 0 "[ . 1 . 2]" 1
1058 1 36 ASP HA 1 38 ALA MB . . 4.470 4.262 4.070 4.468 . 0 0 "[ . 1 . 2]" 1
1059 1 36 ASP HB2 1 37 GLY H . . 4.140 3.740 3.643 3.839 . 0 0 "[ . 1 . 2]" 1
1060 1 36 ASP HB2 1 38 ALA H . . 4.660 4.493 4.406 4.572 . 0 0 "[ . 1 . 2]" 1
1061 1 36 ASP HB2 1 42 LEU MD1 . . 4.280 3.899 3.571 4.268 . 0 0 "[ . 1 . 2]" 1
1062 1 36 ASP HB3 1 37 GLY H . . 4.120 2.282 2.142 2.423 . 0 0 "[ . 1 . 2]" 1
1063 1 36 ASP HB3 1 38 ALA H . . 3.540 3.394 3.195 3.576 0.036 6 0 "[ . 1 . 2]" 1
1064 1 36 ASP HB3 1 39 ASN H . . 4.490 3.980 3.809 4.205 . 0 0 "[ . 1 . 2]" 1
1065 1 36 ASP HB3 1 42 LEU MD1 . . 3.860 2.829 2.575 3.075 . 0 0 "[ . 1 . 2]" 1
1066 1 37 GLY H 1 38 ALA H . . 3.340 2.772 2.678 2.865 . 0 0 "[ . 1 . 2]" 1
1067 1 37 GLY H 1 38 ALA MB . . 4.440 4.462 4.443 4.479 0.039 11 0 "[ . 1 . 2]" 1
1068 1 37 GLY H 1 39 ASN H . . 4.280 4.037 3.896 4.198 . 0 0 "[ . 1 . 2]" 1
1069 1 37 GLY H 1 42 LEU MD1 . . 4.110 3.342 3.207 3.571 . 0 0 "[ . 1 . 2]" 1
1070 1 37 GLY H 1 69 LEU MD1 . . 5.540 4.761 4.599 4.945 . 0 0 "[ . 1 . 2]" 1
1071 1 37 GLY HA2 1 39 ASN H . . 4.430 4.395 4.226 4.453 0.023 7 0 "[ . 1 . 2]" 1
1072 1 37 GLY HA2 1 69 LEU MD1 . . 4.050 3.443 3.238 3.668 . 0 0 "[ . 1 . 2]" 1
1073 1 37 GLY HA3 1 39 ASN H . . 5.370 5.263 5.143 5.376 0.006 19 0 "[ . 1 . 2]" 1
1074 1 38 ALA H 1 38 ALA MB . . 2.730 2.380 2.309 2.457 . 0 0 "[ . 1 . 2]" 1
1075 1 38 ALA H 1 39 ASN H . . 2.960 2.039 1.926 2.119 . 0 0 "[ . 1 . 2]" 1
1076 1 38 ALA H 1 39 ASN HB2 . . 4.940 4.345 3.960 4.577 . 0 0 "[ . 1 . 2]" 1
1077 1 38 ALA H 1 42 LEU MD1 . . 4.120 3.968 3.847 4.108 . 0 0 "[ . 1 . 2]" 1
1078 1 38 ALA H 1 69 LEU MD1 . . 4.360 3.534 3.312 3.689 . 0 0 "[ . 1 . 2]" 1
1079 1 38 ALA H 1 69 LEU MD2 . . 4.540 4.499 4.356 4.561 0.021 15 0 "[ . 1 . 2]" 1
1080 1 38 ALA HA 1 69 LEU MD1 . . 3.390 2.751 2.575 2.951 . 0 0 "[ . 1 . 2]" 1
1081 1 38 ALA HA 1 69 LEU MD2 . . 2.970 2.416 2.273 2.583 . 0 0 "[ . 1 . 2]" 1
1082 1 38 ALA HA 1 69 LEU HG . . 5.300 4.905 4.724 5.121 . 0 0 "[ . 1 . 2]" 1
1083 1 38 ALA MB 1 39 ASN H . . 3.230 3.058 2.927 3.186 . 0 0 "[ . 1 . 2]" 1
1084 1 38 ALA MB 1 39 ASN HA . . 4.300 4.230 4.142 4.294 . 0 0 "[ . 1 . 2]" 1
1085 1 38 ALA MB 1 69 LEU MD1 . . 4.120 3.969 3.874 4.086 . 0 0 "[ . 1 . 2]" 1
1086 1 39 ASN H 1 39 ASN HB2 . . 3.180 2.563 2.252 2.763 . 0 0 "[ . 1 . 2]" 1
1087 1 39 ASN H 1 39 ASN HB3 . . 4.140 2.741 2.592 2.926 . 0 0 "[ . 1 . 2]" 1
1088 1 39 ASN H 1 39 ASN HD21 . . 5.040 5.013 4.939 5.070 0.030 19 0 "[ . 1 . 2]" 1
1089 1 39 ASN H 1 40 ALA H . . 4.700 4.497 4.453 4.562 . 0 0 "[ . 1 . 2]" 1
1090 1 39 ASN H 1 40 ALA HA . . 5.470 5.376 5.280 5.450 . 0 0 "[ . 1 . 2]" 1
1091 1 39 ASN H 1 41 LEU H . . 5.340 5.364 5.349 5.384 0.044 7 0 "[ . 1 . 2]" 1
1092 1 39 ASN H 1 42 LEU HB2 . . 4.770 4.639 4.532 4.710 . 0 0 "[ . 1 . 2]" 1
1093 1 39 ASN H 1 42 LEU MD1 . . 3.850 3.201 3.135 3.312 . 0 0 "[ . 1 . 2]" 1
1094 1 39 ASN H 1 43 PRO HD3 . . 5.170 5.148 5.014 5.183 0.013 1 0 "[ . 1 . 2]" 1
1095 1 39 ASN H 1 43 PRO HG3 . . 6.000 5.988 5.835 6.020 0.020 12 0 "[ . 1 . 2]" 1
1096 1 39 ASN H 1 69 LEU MD1 . . 3.950 3.217 3.143 3.281 . 0 0 "[ . 1 . 2]" 1
1097 1 39 ASN H 1 69 LEU MD2 . . 4.870 4.858 4.808 4.891 0.021 4 0 "[ . 1 . 2]" 1
1098 1 39 ASN HA 1 39 ASN HD21 . . 4.390 4.432 4.375 4.457 0.067 1 0 "[ . 1 . 2]" 1
1099 1 39 ASN HA 1 39 ASN HD22 . . 4.860 4.480 4.400 4.566 . 0 0 "[ . 1 . 2]" 1
1100 1 39 ASN HA 1 40 ALA H . . 2.830 2.141 2.083 2.197 . 0 0 "[ . 1 . 2]" 1
1101 1 39 ASN HA 1 40 ALA HA . . 4.560 4.459 4.427 4.499 . 0 0 "[ . 1 . 2]" 1
1102 1 39 ASN HA 1 40 ALA MB . . 4.660 3.965 3.885 4.033 . 0 0 "[ . 1 . 2]" 1
1103 1 39 ASN HA 1 41 LEU H . . 3.990 3.704 3.657 3.803 . 0 0 "[ . 1 . 2]" 1
1104 1 39 ASN HA 1 42 LEU H . . 5.090 4.991 4.937 5.044 . 0 0 "[ . 1 . 2]" 1
1105 1 39 ASN HA 1 42 LEU MD1 . . 4.810 4.807 4.764 4.840 0.030 13 0 "[ . 1 . 2]" 1
1106 1 39 ASN HA 1 69 LEU MD1 . . 4.080 3.893 3.793 3.998 . 0 0 "[ . 1 . 2]" 1
1107 1 39 ASN HA 1 69 LEU MD2 . . 5.530 5.486 5.358 5.550 0.020 1 0 "[ . 1 . 2]" 1
1108 1 39 ASN HB2 1 39 ASN HD22 . . 3.910 3.705 3.596 3.850 . 0 0 "[ . 1 . 2]" 1
1109 1 39 ASN HB2 1 42 LEU MD1 . . 4.250 3.345 2.962 3.574 . 0 0 "[ . 1 . 2]" 1
1110 1 39 ASN HB3 1 40 ALA H . . 4.010 4.053 4.013 4.075 0.065 4 0 "[ . 1 . 2]" 1
1111 1 39 ASN HB3 1 42 LEU H . . 4.500 3.025 2.831 3.148 . 0 0 "[ . 1 . 2]" 1
1112 1 39 ASN HB3 1 42 LEU MD1 . . 3.270 2.364 2.264 2.450 . 0 0 "[ . 1 . 2]" 1
1113 1 39 ASN HB3 1 42 LEU MD2 . . 4.430 4.432 4.408 4.454 0.024 6 0 "[ . 1 . 2]" 1
1114 1 39 ASN HB3 1 42 LEU HG . . 4.580 2.912 2.877 2.987 . 0 0 "[ . 1 . 2]" 1
1115 1 39 ASN HD21 1 40 ALA H . . 5.250 5.254 5.133 5.292 0.042 6 0 "[ . 1 . 2]" 1
1116 1 39 ASN HD21 1 41 LEU HB3 . . 4.540 3.129 2.817 3.693 . 0 0 "[ . 1 . 2]" 1
1117 1 39 ASN HD21 1 41 LEU MD1 . . 4.810 4.770 4.656 4.838 0.028 6 0 "[ . 1 . 2]" 1
1118 1 39 ASN HD21 1 41 LEU MD2 . . 4.140 2.791 2.593 2.930 . 0 0 "[ . 1 . 2]" 1
1119 1 39 ASN HD21 1 42 LEU H . . 4.970 3.615 3.459 3.758 . 0 0 "[ . 1 . 2]" 1
1120 1 39 ASN HD21 1 42 LEU MD1 . . 3.650 3.624 3.490 3.685 0.035 4 0 "[ . 1 . 2]" 1
1121 1 39 ASN HD21 1 42 LEU MD2 . . 4.290 4.285 4.164 4.320 0.030 11 0 "[ . 1 . 2]" 1
1122 1 39 ASN HD21 1 42 LEU HG . . 4.170 3.063 2.906 3.142 . 0 0 "[ . 1 . 2]" 1
1123 1 39 ASN HD22 1 41 LEU H . . 4.320 3.793 3.413 4.330 0.010 13 0 "[ . 1 . 2]" 1
1124 1 39 ASN HD22 1 41 LEU HB3 . . 4.660 2.568 2.257 3.099 . 0 0 "[ . 1 . 2]" 1
1125 1 39 ASN HD22 1 41 LEU MD2 . . 4.240 2.150 1.794 2.544 . 0 0 "[ . 1 . 2]" 1
1126 1 39 ASN HD22 1 42 LEU MD1 . . 5.020 5.014 4.923 5.057 0.037 11 0 "[ . 1 . 2]" 1
1127 1 39 ASN HD22 1 42 LEU HG . . 5.260 4.553 4.239 4.838 . 0 0 "[ . 1 . 2]" 1
1128 1 40 ALA H 1 40 ALA MB . . 2.850 2.212 2.180 2.269 . 0 0 "[ . 1 . 2]" 1
1129 1 40 ALA H 1 41 LEU H . . 3.440 2.579 2.524 2.663 . 0 0 "[ . 1 . 2]" 1
1130 1 40 ALA H 1 41 LEU HB3 . . 4.540 4.280 4.203 4.380 . 0 0 "[ . 1 . 2]" 1
1131 1 40 ALA H 1 42 LEU H . . 4.620 4.660 4.640 4.677 0.057 17 0 "[ . 1 . 2]" 1
1132 1 40 ALA H 1 42 LEU MD1 . . 5.960 5.676 5.609 5.762 . 0 0 "[ . 1 . 2]" 1
1133 1 40 ALA H 1 69 LEU H . . 6.000 5.985 5.858 6.018 0.018 1 0 "[ . 1 . 2]" 1
1134 1 40 ALA H 1 69 LEU HB2 . . 4.330 3.521 3.316 3.621 . 0 0 "[ . 1 . 2]" 1
1135 1 40 ALA H 1 69 LEU HB3 . . 3.980 3.749 3.627 3.866 . 0 0 "[ . 1 . 2]" 1
1136 1 40 ALA H 1 69 LEU MD1 . . 3.740 3.656 3.564 3.708 . 0 0 "[ . 1 . 2]" 1
1137 1 40 ALA H 1 70 ASP H . . 5.450 5.460 5.344 5.490 0.040 15 0 "[ . 1 . 2]" 1
1138 1 40 ALA H 1 70 ASP QB . . 5.600 4.075 3.944 4.205 . 0 0 "[ . 1 . 2]" 1
1139 1 40 ALA HA 1 42 LEU H . . 4.540 4.465 4.378 4.544 0.004 4 0 "[ . 1 . 2]" 1
1140 1 40 ALA HA 1 43 PRO HD2 . . 4.130 2.962 2.872 3.040 . 0 0 "[ . 1 . 2]" 1
1141 1 40 ALA HA 1 43 PRO HD3 . . 4.520 4.035 3.941 4.134 . 0 0 "[ . 1 . 2]" 1
1142 1 40 ALA HA 1 44 ALA H . . 4.770 4.404 4.316 4.511 . 0 0 "[ . 1 . 2]" 1
1143 1 40 ALA HA 1 66 ALA H . . 5.290 5.173 5.105 5.242 . 0 0 "[ . 1 . 2]" 1
1144 1 40 ALA HA 1 69 LEU H . . 4.610 4.310 4.218 4.379 . 0 0 "[ . 1 . 2]" 1
1145 1 40 ALA HA 1 69 LEU HB2 . . 3.530 2.465 2.398 2.559 . 0 0 "[ . 1 . 2]" 1
1146 1 40 ALA HA 1 69 LEU HB3 . . 4.040 3.724 3.557 3.829 . 0 0 "[ . 1 . 2]" 1
1147 1 40 ALA HA 1 69 LEU MD1 . . 3.140 2.098 2.055 2.124 . 0 0 "[ . 1 . 2]" 1
1148 1 40 ALA HA 1 69 LEU MD2 . . 4.750 4.661 4.599 4.706 . 0 0 "[ . 1 . 2]" 1
1149 1 40 ALA HA 1 70 ASP H . . 4.760 4.667 4.533 4.772 0.012 6 0 "[ . 1 . 2]" 1
1150 1 40 ALA HA 1 70 ASP QB . . 5.330 4.406 4.332 4.517 . 0 0 "[ . 1 . 2]" 1
1151 1 40 ALA HA 1 73 TYR QD . . 5.200 4.554 4.455 4.724 . 0 0 "[ . 1 . 2]" 1
1152 1 40 ALA MB 1 41 LEU H . . 3.240 3.064 3.011 3.119 . 0 0 "[ . 1 . 2]" 1
1153 1 40 ALA MB 1 42 LEU H . . 5.080 4.955 4.882 5.033 . 0 0 "[ . 1 . 2]" 1
1154 1 40 ALA MB 1 43 PRO HD2 . . 4.760 4.253 4.155 4.327 . 0 0 "[ . 1 . 2]" 1
1155 1 40 ALA MB 1 66 ALA H . . 5.320 5.085 4.972 5.159 . 0 0 "[ . 1 . 2]" 1
1156 1 40 ALA MB 1 67 ILE H . . 5.610 4.790 4.707 4.857 . 0 0 "[ . 1 . 2]" 1
1157 1 40 ALA MB 1 69 LEU H . . 3.530 3.575 3.555 3.589 0.059 16 0 "[ . 1 . 2]" 1
1158 1 40 ALA MB 1 69 LEU HB2 . . 3.250 2.069 2.046 2.091 . 0 0 "[ . 1 . 2]" 1
1159 1 40 ALA MB 1 69 LEU HB3 . . 4.050 3.233 3.072 3.337 . 0 0 "[ . 1 . 2]" 1
1160 1 40 ALA MB 1 69 LEU MD1 . . 3.300 3.318 3.304 3.339 0.039 14 0 "[ . 1 . 2]" 1
1161 1 40 ALA MB 1 70 ASP H . . 3.250 2.803 2.688 2.888 . 0 0 "[ . 1 . 2]" 1
1162 1 40 ALA MB 1 70 ASP HA . . 3.730 3.630 3.511 3.736 0.006 14 0 "[ . 1 . 2]" 1
1163 1 40 ALA MB 1 70 ASP HB2 . . 3.500 2.059 1.994 2.156 . 0 0 "[ . 1 . 2]" 1
1164 1 40 ALA MB 1 70 ASP HB3 . . 3.500 2.926 2.847 3.014 . 0 0 "[ . 1 . 2]" 1
1165 1 40 ALA MB 1 71 GLY H . . 4.410 4.349 4.256 4.417 0.007 20 0 "[ . 1 . 2]" 1
1166 1 40 ALA MB 1 72 SER H . . 5.540 5.560 5.525 5.594 0.054 14 0 "[ . 1 . 2]" 1
1167 1 40 ALA MB 1 73 TYR H . . 5.070 5.079 4.997 5.108 0.038 13 0 "[ . 1 . 2]" 1
1168 1 40 ALA MB 1 73 TYR QD . . 3.680 2.209 2.128 2.388 . 0 0 "[ . 1 . 2]" 1
1169 1 40 ALA MB 1 73 TYR QE . . 3.890 3.074 2.811 3.352 . 0 0 "[ . 1 . 2]" 1
1170 1 41 LEU H 1 41 LEU HB2 . . 3.300 3.045 2.884 3.267 . 0 0 "[ . 1 . 2]" 1
1171 1 41 LEU H 1 41 LEU HB3 . . 2.980 2.043 1.992 2.080 . 0 0 "[ . 1 . 2]" 1
1172 1 41 LEU H 1 41 LEU MD1 . . 4.370 4.318 4.263 4.366 . 0 0 "[ . 1 . 2]" 1
1173 1 41 LEU H 1 41 LEU MD2 . . 4.340 3.983 3.841 4.119 . 0 0 "[ . 1 . 2]" 1
1174 1 41 LEU H 1 41 LEU HG . . 3.960 3.862 3.650 3.975 0.015 13 0 "[ . 1 . 2]" 1
1175 1 41 LEU H 1 42 LEU H . . 3.450 2.662 2.567 2.755 . 0 0 "[ . 1 . 2]" 1
1176 1 41 LEU H 1 42 LEU MD1 . . 5.240 5.028 4.951 5.122 . 0 0 "[ . 1 . 2]" 1
1177 1 41 LEU H 1 43 PRO HD2 . . 4.430 3.460 3.412 3.528 . 0 0 "[ . 1 . 2]" 1
1178 1 41 LEU H 1 43 PRO HG2 . . 4.720 4.773 4.765 4.784 0.064 13 0 "[ . 1 . 2]" 1
1179 1 41 LEU H 1 43 PRO HG3 . . 5.620 5.576 5.534 5.626 0.006 9 0 "[ . 1 . 2]" 1
1180 1 41 LEU H 1 44 ALA H . . 4.680 4.686 4.644 4.702 0.022 18 0 "[ . 1 . 2]" 1
1181 1 41 LEU H 1 44 ALA MB . . 4.460 4.380 4.314 4.433 . 0 0 "[ . 1 . 2]" 1
1182 1 41 LEU H 1 69 LEU HB2 . . 6.000 5.305 5.169 5.380 . 0 0 "[ . 1 . 2]" 1
1183 1 41 LEU H 1 69 LEU MD1 . . 5.220 4.534 4.496 4.599 . 0 0 "[ . 1 . 2]" 1
1184 1 41 LEU H 1 73 TYR QE . . 4.510 4.228 3.968 4.515 0.005 17 0 "[ . 1 . 2]" 1
1185 1 41 LEU HA 1 41 LEU HB3 . . 3.010 2.932 2.829 2.982 . 0 0 "[ . 1 . 2]" 1
1186 1 41 LEU HA 1 41 LEU MD1 . . 3.120 2.672 2.501 2.987 . 0 0 "[ . 1 . 2]" 1
1187 1 41 LEU HA 1 41 LEU MD2 . . 4.300 4.025 3.963 4.103 . 0 0 "[ . 1 . 2]" 1
1188 1 41 LEU HA 1 44 ALA H . . 3.900 3.313 3.186 3.409 . 0 0 "[ . 1 . 2]" 1
1189 1 41 LEU HA 1 44 ALA MB . . 3.200 2.199 2.140 2.242 . 0 0 "[ . 1 . 2]" 1
1190 1 41 LEU HA 1 45 ASN H . . 4.010 3.811 3.744 3.861 . 0 0 "[ . 1 . 2]" 1
1191 1 41 LEU HA 1 73 TYR QE . . 3.450 2.688 2.415 2.942 . 0 0 "[ . 1 . 2]" 1
1192 1 41 LEU HA 2 9 ASP HB2 . . 4.810 4.110 3.827 4.811 0.001 15 0 "[ . 1 . 2]" 1
1193 1 41 LEU HA 2 9 ASP HB3 . . 4.480 4.168 3.890 4.502 0.022 4 0 "[ . 1 . 2]" 1
1194 1 41 LEU HB2 1 41 LEU MD1 . . 3.090 2.392 2.327 2.476 . 0 0 "[ . 1 . 2]" 1
1195 1 41 LEU HB2 1 41 LEU MD2 . . 2.960 2.479 2.416 2.554 . 0 0 "[ . 1 . 2]" 1
1196 1 41 LEU HB2 1 42 LEU H . . 4.030 4.095 4.066 4.132 0.102 4 0 "[ . 1 . 2]" 1
1197 1 41 LEU HB2 2 9 ASP HA . . 5.680 5.540 5.317 5.687 0.007 1 0 "[ . 1 . 2]" 1
1198 1 41 LEU HB2 2 9 ASP HB2 . . 4.300 3.467 3.126 3.677 . 0 0 "[ . 1 . 2]" 1
1199 1 41 LEU HB2 2 9 ASP HB3 . . 4.060 2.671 2.434 2.883 . 0 0 "[ . 1 . 2]" 1
1200 1 41 LEU HB3 1 41 LEU MD2 . . 3.040 2.231 2.138 2.364 . 0 0 "[ . 1 . 2]" 1
1201 1 41 LEU HB3 1 42 LEU H . . 4.060 2.982 2.841 3.247 . 0 0 "[ . 1 . 2]" 1
1202 1 41 LEU HB3 2 9 ASP HB2 . . 5.330 5.126 4.775 5.339 0.009 13 0 "[ . 1 . 2]" 1
1203 1 41 LEU HB3 2 9 ASP HB3 . . 4.180 4.106 3.905 4.234 0.054 7 0 "[ . 1 . 2]" 1
1204 1 41 LEU MD1 1 42 LEU H . . 4.300 3.699 3.575 3.802 . 0 0 "[ . 1 . 2]" 1
1205 1 41 LEU MD1 1 42 LEU HA . . 5.150 3.263 3.091 3.451 . 0 0 "[ . 1 . 2]" 1
1206 1 41 LEU MD1 1 44 ALA H . . 4.370 4.391 4.377 4.405 0.035 4 0 "[ . 1 . 2]" 1
1207 1 41 LEU MD1 1 44 ALA MB . . 3.650 3.210 3.113 3.402 . 0 0 "[ . 1 . 2]" 1
1208 1 41 LEU MD1 1 45 ASN H . . 4.120 3.091 3.047 3.132 . 0 0 "[ . 1 . 2]" 1
1209 1 41 LEU MD1 1 45 ASN HA . . 4.540 4.422 4.348 4.477 . 0 0 "[ . 1 . 2]" 1
1210 1 41 LEU MD1 1 45 ASN HD21 . . 5.720 2.780 2.700 2.868 . 0 0 "[ . 1 . 2]" 1
1211 1 41 LEU MD1 1 45 ASN HD22 . . 3.590 1.998 1.943 2.061 . 0 0 "[ . 1 . 2]" 1
1212 1 41 LEU MD1 1 46 ARG H . . 5.030 4.913 4.816 5.034 0.004 1 0 "[ . 1 . 2]" 1
1213 1 41 LEU MD1 2 8 VAL HA . . 4.160 4.170 4.024 4.225 0.065 7 0 "[ . 1 . 2]" 1
1214 1 41 LEU MD1 2 8 VAL HB . . 4.340 3.853 3.740 3.998 . 0 0 "[ . 1 . 2]" 1
1215 1 41 LEU MD1 2 9 ASP H . . 4.520 2.483 2.419 2.547 . 0 0 "[ . 1 . 2]" 1
1216 1 41 LEU MD1 2 9 ASP HA . . 3.880 3.810 3.702 3.889 0.009 12 0 "[ . 1 . 2]" 1
1217 1 41 LEU MD1 2 9 ASP HB2 . . 2.870 2.434 2.134 2.899 0.029 12 0 "[ . 1 . 2]" 1
1218 1 41 LEU MD1 2 9 ASP HB3 . . 2.830 2.169 2.011 2.415 . 0 0 "[ . 1 . 2]" 1
1219 1 41 LEU MD2 1 42 LEU H . . 4.470 3.989 3.919 4.042 . 0 0 "[ . 1 . 2]" 1
1220 1 41 LEU MD2 1 44 ALA MB . . 5.040 5.056 5.043 5.070 0.030 6 0 "[ . 1 . 2]" 1
1221 1 41 LEU MD2 2 9 ASP H . . 5.100 4.263 4.133 4.342 . 0 0 "[ . 1 . 2]" 1
1222 1 41 LEU MD2 2 9 ASP HA . . 4.230 4.262 4.241 4.289 0.059 18 0 "[ . 1 . 2]" 1
1223 1 41 LEU MD2 2 9 ASP HB2 . . 4.620 3.720 3.535 3.921 . 0 0 "[ . 1 . 2]" 1
1224 1 41 LEU MD2 2 9 ASP HB3 . . 3.020 2.244 2.052 2.637 . 0 0 "[ . 1 . 2]" 1
1225 1 41 LEU HG 1 42 LEU H . . 4.140 2.688 2.486 2.798 . 0 0 "[ . 1 . 2]" 1
1226 1 41 LEU HG 1 45 ASN H . . 4.790 4.855 4.813 4.894 0.104 4 0 "[ . 1 . 2]" 1
1227 1 41 LEU HG 1 45 ASN HD22 . . 4.390 4.388 4.196 4.412 0.022 17 0 "[ . 1 . 2]" 1
1228 1 41 LEU HG 2 9 ASP HB3 . . 4.400 4.300 4.056 4.464 0.064 3 0 "[ . 1 . 2]" 1
1229 1 42 LEU H 1 42 LEU HB2 . . 3.600 2.470 2.438 2.497 . 0 0 "[ . 1 . 2]" 1
1230 1 42 LEU H 1 42 LEU MD1 . . 3.550 3.427 3.371 3.538 . 0 0 "[ . 1 . 2]" 1
1231 1 42 LEU H 1 42 LEU HG . . 3.270 2.407 2.355 2.499 . 0 0 "[ . 1 . 2]" 1
1232 1 42 LEU H 1 43 PRO HD2 . . 3.650 2.435 2.361 2.521 . 0 0 "[ . 1 . 2]" 1
1233 1 42 LEU H 1 43 PRO HD3 . . 3.850 3.383 3.280 3.489 . 0 0 "[ . 1 . 2]" 1
1234 1 42 LEU H 1 69 LEU MD1 . . 5.190 4.722 4.613 4.800 . 0 0 "[ . 1 . 2]" 1
1235 1 42 LEU HA 1 42 LEU MD2 . . 2.970 2.212 2.171 2.287 . 0 0 "[ . 1 . 2]" 1
1236 1 42 LEU HA 1 42 LEU HG . . 3.900 2.847 2.806 2.890 . 0 0 "[ . 1 . 2]" 1
1237 1 42 LEU HA 1 45 ASN H . . 4.290 3.855 3.804 3.905 . 0 0 "[ . 1 . 2]" 1
1238 1 42 LEU HA 1 45 ASN QB . . 4.600 3.504 3.423 3.604 . 0 0 "[ . 1 . 2]" 1
1239 1 42 LEU HA 1 46 ARG H . . 4.600 4.170 4.103 4.235 . 0 0 "[ . 1 . 2]" 1
1240 1 42 LEU HB2 1 42 LEU MD1 . . 3.260 2.219 2.207 2.249 . 0 0 "[ . 1 . 2]" 1
1241 1 42 LEU MD1 1 43 PRO HD2 . . 4.300 4.257 4.193 4.300 . 0 0 "[ . 1 . 2]" 1
1242 1 42 LEU MD1 1 43 PRO HD3 . . 3.960 3.616 3.544 3.677 . 0 0 "[ . 1 . 2]" 1
1243 1 42 LEU MD2 1 43 PRO HA . . 5.610 5.623 5.582 5.645 0.035 6 0 "[ . 1 . 2]" 1
1244 1 42 LEU MD2 1 43 PRO HD3 . . 4.590 4.618 4.594 4.631 0.041 17 0 "[ . 1 . 2]" 1
1245 1 42 LEU MD2 1 46 ARG H . . 5.500 5.342 5.293 5.417 . 0 0 "[ . 1 . 2]" 1
1246 1 42 LEU HG 1 43 PRO HD3 . . 4.320 4.398 4.389 4.412 0.092 15 0 "[ . 1 . 2]" 1
1247 1 43 PRO HA 1 45 ASN H . . 4.830 4.688 4.564 4.783 . 0 0 "[ . 1 . 2]" 1
1248 1 43 PRO HA 1 46 ARG H . . 3.810 3.563 3.444 3.659 . 0 0 "[ . 1 . 2]" 1
1249 1 43 PRO HA 1 46 ARG HA . . 5.740 5.302 5.205 5.397 . 0 0 "[ . 1 . 2]" 1
1250 1 43 PRO HA 1 46 ARG HB2 . . 4.100 3.205 3.071 3.310 . 0 0 "[ . 1 . 2]" 1
1251 1 43 PRO HA 1 46 ARG HB3 . . 4.000 2.615 2.498 2.724 . 0 0 "[ . 1 . 2]" 1
1252 1 43 PRO HA 1 46 ARG HE . . 5.080 3.369 3.053 3.659 . 0 0 "[ . 1 . 2]" 1
1253 1 43 PRO HA 1 47 ALA H . . 4.260 3.875 3.789 3.996 . 0 0 "[ . 1 . 2]" 1
1254 1 43 PRO HA 1 47 ALA MB . . 4.620 4.532 4.469 4.603 . 0 0 "[ . 1 . 2]" 1
1255 1 43 PRO HA 1 62 ASP HA . . 4.760 4.643 4.482 4.785 0.025 2 0 "[ . 1 . 2]" 1
1256 1 43 PRO HA 1 62 ASP HB3 . . 4.790 3.671 3.478 3.970 . 0 0 "[ . 1 . 2]" 1
1257 1 43 PRO HA 1 66 ALA H . . 5.550 5.388 5.311 5.428 . 0 0 "[ . 1 . 2]" 1
1258 1 43 PRO HA 1 66 ALA MB . . 4.470 4.486 4.474 4.497 0.027 12 0 "[ . 1 . 2]" 1
1259 1 43 PRO HB2 1 44 ALA H . . 4.080 3.561 3.494 3.602 . 0 0 "[ . 1 . 2]" 1
1260 1 43 PRO HB2 1 44 ALA MB . . 4.770 4.626 4.592 4.662 . 0 0 "[ . 1 . 2]" 1
1261 1 43 PRO HB2 1 47 ALA MB . . 4.510 4.253 4.206 4.293 . 0 0 "[ . 1 . 2]" 1
1262 1 43 PRO HB2 1 66 ALA H . . 3.890 2.688 2.614 2.726 . 0 0 "[ . 1 . 2]" 1
1263 1 43 PRO HB2 1 66 ALA HA . . 4.580 3.602 3.527 3.690 . 0 0 "[ . 1 . 2]" 1
1264 1 43 PRO HB2 1 66 ALA MB . . 4.310 2.675 2.631 2.713 . 0 0 "[ . 1 . 2]" 1
1265 1 43 PRO HD2 1 44 ALA H . . 4.050 2.779 2.760 2.807 . 0 0 "[ . 1 . 2]" 1
1266 1 43 PRO HD2 1 44 ALA MB . . 4.500 4.117 4.099 4.136 . 0 0 "[ . 1 . 2]" 1
1267 1 43 PRO HD2 1 66 ALA MB . . 5.150 3.893 3.859 3.944 . 0 0 "[ . 1 . 2]" 1
1268 1 43 PRO HD2 1 69 LEU MD1 . . 3.880 3.290 3.226 3.367 . 0 0 "[ . 1 . 2]" 1
1269 1 43 PRO HD3 1 44 ALA H . . 4.250 4.003 3.991 4.015 . 0 0 "[ . 1 . 2]" 1
1270 1 43 PRO HD3 1 44 ALA MB . . 5.390 5.404 5.397 5.412 0.022 3 0 "[ . 1 . 2]" 1
1271 1 43 PRO HD3 1 45 ASN H . . 6.000 5.831 5.759 5.885 . 0 0 "[ . 1 . 2]" 1
1272 1 43 PRO HG2 1 44 ALA H . . 3.400 2.660 2.596 2.736 . 0 0 "[ . 1 . 2]" 1
1273 1 43 PRO HG2 1 44 ALA MB . . 3.750 3.759 3.752 3.766 0.016 11 0 "[ . 1 . 2]" 1
1274 1 43 PRO HG2 1 66 ALA H . . 3.640 3.504 3.472 3.551 . 0 0 "[ . 1 . 2]" 1
1275 1 43 PRO HG2 1 69 LEU MD1 . . 3.650 3.062 2.998 3.117 . 0 0 "[ . 1 . 2]" 1
1276 1 43 PRO HG3 1 66 ALA HA . . 3.680 2.979 2.882 3.052 . 0 0 "[ . 1 . 2]" 1
1277 1 43 PRO HG3 1 67 ILE H . . 6.000 5.994 5.944 6.014 0.014 6 0 "[ . 1 . 2]" 1
1278 1 44 ALA H 1 44 ALA MB . . 2.870 2.214 2.200 2.227 . 0 0 "[ . 1 . 2]" 1
1279 1 44 ALA H 1 45 ASN H . . 3.370 2.811 2.750 2.873 . 0 0 "[ . 1 . 2]" 1
1280 1 44 ALA H 1 46 ARG H . . 4.590 4.261 4.153 4.383 . 0 0 "[ . 1 . 2]" 1
1281 1 44 ALA H 1 47 ALA H . . 4.740 4.618 4.538 4.689 . 0 0 "[ . 1 . 2]" 1
1282 1 44 ALA H 1 47 ALA MB . . 4.690 4.649 4.612 4.689 . 0 0 "[ . 1 . 2]" 1
1283 1 44 ALA H 1 66 ALA H . . 5.010 5.003 4.902 5.023 0.013 15 0 "[ . 1 . 2]" 1
1284 1 44 ALA H 1 66 ALA HA . . 4.810 4.339 4.249 4.377 . 0 0 "[ . 1 . 2]" 1
1285 1 44 ALA H 1 66 ALA MB . . 3.180 2.719 2.654 2.761 . 0 0 "[ . 1 . 2]" 1
1286 1 44 ALA H 1 69 LEU MD1 . . 5.170 5.149 5.088 5.179 0.009 19 0 "[ . 1 . 2]" 1
1287 1 44 ALA H 1 73 TYR QE . . 4.790 4.125 3.927 4.360 . 0 0 "[ . 1 . 2]" 1
1288 1 44 ALA HA 1 47 ALA H . . 3.990 3.490 3.351 3.581 . 0 0 "[ . 1 . 2]" 1
1289 1 44 ALA HA 1 47 ALA MB . . 3.710 2.672 2.604 2.730 . 0 0 "[ . 1 . 2]" 1
1290 1 44 ALA HA 1 48 MET H . . 4.660 4.089 3.965 4.233 . 0 0 "[ . 1 . 2]" 1
1291 1 44 ALA HA 1 66 ALA MB . . 3.270 2.770 2.702 2.821 . 0 0 "[ . 1 . 2]" 1
1292 1 44 ALA HA 1 73 TYR QE . . 5.010 4.659 4.575 4.858 . 0 0 "[ . 1 . 2]" 1
1293 1 44 ALA HA 1 79 ARG HD3 . . 5.560 4.099 3.858 4.416 . 0 0 "[ . 1 . 2]" 1
1294 1 44 ALA MB 1 45 ASN H . . 3.180 2.467 2.419 2.520 . 0 0 "[ . 1 . 2]" 1
1295 1 44 ALA MB 1 45 ASN HA . . 4.100 3.913 3.876 3.947 . 0 0 "[ . 1 . 2]" 1
1296 1 44 ALA MB 1 46 ARG H . . 4.730 4.644 4.576 4.728 . 0 0 "[ . 1 . 2]" 1
1297 1 44 ALA MB 1 47 ALA H . . 4.800 4.612 4.517 4.687 . 0 0 "[ . 1 . 2]" 1
1298 1 44 ALA MB 1 47 ALA MB . . 4.160 3.887 3.813 3.935 . 0 0 "[ . 1 . 2]" 1
1299 1 44 ALA MB 1 63 CYS HA . . 5.000 4.579 4.465 4.669 . 0 0 "[ . 1 . 2]" 1
1300 1 44 ALA MB 1 66 ALA HA . . 4.560 4.281 4.221 4.377 . 0 0 "[ . 1 . 2]" 1
1301 1 44 ALA MB 1 66 ALA MB . . 2.890 2.250 2.191 2.331 . 0 0 "[ . 1 . 2]" 1
1302 1 44 ALA MB 1 73 TYR QD . . 4.210 3.495 3.387 3.587 . 0 0 "[ . 1 . 2]" 1
1303 1 44 ALA MB 1 73 TYR QE . . 2.910 2.144 2.078 2.287 . 0 0 "[ . 1 . 2]" 1
1304 1 44 ALA MB 1 76 ALA MB . . 3.710 3.381 3.321 3.440 . 0 0 "[ . 1 . 2]" 1
1305 1 44 ALA MB 1 79 ARG HD2 . . 4.520 3.501 3.224 3.732 . 0 0 "[ . 1 . 2]" 1
1306 1 44 ALA MB 2 8 VAL HA . . 4.970 4.965 4.878 5.014 0.044 3 0 "[ . 1 . 2]" 1
1307 1 44 ALA MB 2 9 ASP H . . 4.430 4.464 4.446 4.486 0.056 11 0 "[ . 1 . 2]" 1
1308 1 45 ASN H 1 45 ASN QB . . 3.210 2.454 2.433 2.485 . 0 0 "[ . 1 . 2]" 1
1309 1 45 ASN H 1 45 ASN HD21 . . 4.520 4.396 4.355 4.440 . 0 0 "[ . 1 . 2]" 1
1310 1 45 ASN H 1 46 ARG H . . 3.390 2.778 2.728 2.828 . 0 0 "[ . 1 . 2]" 1
1311 1 45 ASN H 1 46 ARG HA . . 5.590 5.380 5.345 5.414 . 0 0 "[ . 1 . 2]" 1
1312 1 45 ASN H 1 46 ARG HB3 . . 5.350 5.136 5.064 5.211 . 0 0 "[ . 1 . 2]" 1
1313 1 45 ASN H 1 47 ALA H . . 4.120 4.142 4.135 4.151 0.031 11 0 "[ . 1 . 2]" 1
1314 1 45 ASN H 1 47 ALA MB . . 5.800 4.811 4.761 4.851 . 0 0 "[ . 1 . 2]" 1
1315 1 45 ASN H 1 66 ALA MB . . 4.870 4.865 4.825 4.881 0.011 19 0 "[ . 1 . 2]" 1
1316 1 45 ASN H 1 73 TYR QE . . 5.630 5.315 5.129 5.433 . 0 0 "[ . 1 . 2]" 1
1317 1 45 ASN H 2 8 VAL MG1 . . 4.450 4.461 4.449 4.473 0.023 10 0 "[ . 1 . 2]" 1
1318 1 45 ASN HA 1 45 ASN HD21 . . 4.760 4.372 4.352 4.395 . 0 0 "[ . 1 . 2]" 1
1319 1 45 ASN HA 1 46 ARG HA . . 5.230 4.859 4.826 4.885 . 0 0 "[ . 1 . 2]" 1
1320 1 45 ASN HA 1 47 ALA H . . 4.550 4.330 4.249 4.388 . 0 0 "[ . 1 . 2]" 1
1321 1 45 ASN HA 1 47 ALA MB . . 5.090 4.695 4.620 4.750 . 0 0 "[ . 1 . 2]" 1
1322 1 45 ASN HA 1 48 MET H . . 3.900 3.265 3.170 3.347 . 0 0 "[ . 1 . 2]" 1
1323 1 45 ASN HA 1 48 MET HB3 . . 4.760 4.107 4.003 4.336 . 0 0 "[ . 1 . 2]" 1
1324 1 45 ASN HA 1 48 MET HG2 . . 4.430 3.757 3.629 4.077 . 0 0 "[ . 1 . 2]" 1
1325 1 45 ASN HA 1 48 MET HG3 . . 4.620 3.929 3.796 4.306 . 0 0 "[ . 1 . 2]" 1
1326 1 45 ASN HA 1 49 ALA H . . 4.750 3.835 3.725 3.939 . 0 0 "[ . 1 . 2]" 1
1327 1 45 ASN HA 1 49 ALA MB . . 5.540 4.590 4.509 4.695 . 0 0 "[ . 1 . 2]" 1
1328 1 45 ASN HA 2 8 VAL HA . . 4.140 4.041 3.846 4.162 0.022 2 0 "[ . 1 . 2]" 1
1329 1 45 ASN HA 2 8 VAL HB . . 4.910 4.277 4.097 4.452 . 0 0 "[ . 1 . 2]" 1
1330 1 45 ASN HA 2 8 VAL MG1 . . 3.970 2.343 2.262 2.421 . 0 0 "[ . 1 . 2]" 1
1331 1 45 ASN HA 2 8 VAL MG2 . . 5.170 5.067 4.912 5.182 0.012 8 0 "[ . 1 . 2]" 1
1332 1 45 ASN QB 1 46 ARG H . . 3.460 2.604 2.573 2.645 . 0 0 "[ . 1 . 2]" 1
1333 1 45 ASN QB 2 8 VAL HA . . 4.830 4.431 4.319 4.578 . 0 0 "[ . 1 . 2]" 1
1334 1 45 ASN QB 2 8 VAL HB . . 4.240 3.336 3.132 3.498 . 0 0 "[ . 1 . 2]" 1
1335 1 45 ASN QB 2 8 VAL MG1 . . 4.700 2.515 2.462 2.607 . 0 0 "[ . 1 . 2]" 1
1336 1 45 ASN HD21 1 46 ARG H . . 5.110 5.153 5.143 5.169 0.059 4 0 "[ . 1 . 2]" 1
1337 1 45 ASN HD21 2 8 VAL HB . . 3.990 2.975 2.861 3.095 . 0 0 "[ . 1 . 2]" 1
1338 1 45 ASN HD21 2 8 VAL MG2 . . 4.310 4.075 3.986 4.203 . 0 0 "[ . 1 . 2]" 1
1339 1 45 ASN HD21 2 9 ASP H . . 4.670 4.073 3.864 4.369 . 0 0 "[ . 1 . 2]" 1
1340 1 45 ASN HD22 2 8 VAL HB . . 4.410 2.411 2.272 2.585 . 0 0 "[ . 1 . 2]" 1
1341 1 45 ASN HD22 2 8 VAL MG2 . . 4.120 3.834 3.702 3.996 . 0 0 "[ . 1 . 2]" 1
1342 1 45 ASN HD22 2 9 ASP H . . 4.530 2.528 2.337 2.786 . 0 0 "[ . 1 . 2]" 1
1343 1 46 ARG H 1 46 ARG HB2 . . 3.550 2.246 2.199 2.275 . 0 0 "[ . 1 . 2]" 1
1344 1 46 ARG H 1 46 ARG HB3 . . 3.570 2.802 2.764 2.835 . 0 0 "[ . 1 . 2]" 1
1345 1 46 ARG H 1 46 ARG HE . . 4.910 4.973 4.937 5.004 0.094 11 0 "[ . 1 . 2]" 1
1346 1 46 ARG H 1 46 ARG HG2 . . 4.800 4.569 4.538 4.600 . 0 0 "[ . 1 . 2]" 1
1347 1 46 ARG H 1 47 ALA H . . 3.480 2.906 2.866 2.967 . 0 0 "[ . 1 . 2]" 1
1348 1 46 ARG H 1 48 MET H . . 4.780 4.509 4.457 4.614 . 0 0 "[ . 1 . 2]" 1
1349 1 46 ARG H 1 49 ALA H . . 5.100 4.915 4.857 4.963 . 0 0 "[ . 1 . 2]" 1
1350 1 46 ARG H 1 62 ASP HB3 . . 5.840 5.078 4.913 5.297 . 0 0 "[ . 1 . 2]" 1
1351 1 46 ARG HA 1 46 ARG HD3 . . 4.570 4.197 4.160 4.241 . 0 0 "[ . 1 . 2]" 1
1352 1 46 ARG HA 1 46 ARG HE . . 5.310 4.771 4.606 4.865 . 0 0 "[ . 1 . 2]" 1
1353 1 46 ARG HA 1 46 ARG HG2 . . 3.750 2.921 2.828 2.983 . 0 0 "[ . 1 . 2]" 1
1354 1 46 ARG HA 1 47 ALA MB . . 5.110 5.062 5.045 5.077 . 0 0 "[ . 1 . 2]" 1
1355 1 46 ARG HA 1 48 MET H . . 4.970 4.714 4.676 4.771 . 0 0 "[ . 1 . 2]" 1
1356 1 46 ARG HA 1 49 ALA H . . 4.480 3.676 3.595 3.713 . 0 0 "[ . 1 . 2]" 1
1357 1 46 ARG HA 1 49 ALA HA . . 6.000 5.482 5.440 5.545 . 0 0 "[ . 1 . 2]" 1
1358 1 46 ARG HA 1 49 ALA MB . . 3.860 2.546 2.509 2.612 . 0 0 "[ . 1 . 2]" 1
1359 1 46 ARG HA 1 50 TYR H . . 4.610 4.005 3.950 4.099 . 0 0 "[ . 1 . 2]" 1
1360 1 46 ARG HA 1 50 TYR QD . . 4.860 4.565 4.471 4.738 . 0 0 "[ . 1 . 2]" 1
1361 1 46 ARG HB2 1 46 ARG HE . . 4.470 3.258 3.171 3.340 . 0 0 "[ . 1 . 2]" 1
1362 1 46 ARG HB3 1 46 ARG HE . . 4.730 2.283 2.221 2.355 . 0 0 "[ . 1 . 2]" 1
1363 1 46 ARG HB3 1 47 ALA H . . 4.030 2.698 2.665 2.768 . 0 0 "[ . 1 . 2]" 1
1364 1 46 ARG HB3 1 50 TYR QE . . 4.980 4.477 4.225 4.773 . 0 0 "[ . 1 . 2]" 1
1365 1 46 ARG HD2 1 50 TYR QE . . 4.250 3.312 3.115 3.527 . 0 0 "[ . 1 . 2]" 1
1366 1 46 ARG HD3 1 50 TYR QE . . 4.900 4.658 4.500 4.819 . 0 0 "[ . 1 . 2]" 1
1367 1 46 ARG HE 1 47 ALA H . . 4.820 4.657 4.516 4.755 . 0 0 "[ . 1 . 2]" 1
1368 1 46 ARG HE 1 47 ALA MB . . 5.230 5.146 5.035 5.231 0.001 8 0 "[ . 1 . 2]" 1
1369 1 46 ARG HE 1 50 TYR QD . . 4.870 4.307 3.900 4.618 . 0 0 "[ . 1 . 2]" 1
1370 1 46 ARG HE 1 50 TYR QE . . 3.890 3.422 2.890 3.897 0.007 6 0 "[ . 1 . 2]" 1
1371 1 46 ARG HE 1 62 ASP HB3 . . 5.050 3.696 3.586 3.782 . 0 0 "[ . 1 . 2]" 1
1372 1 46 ARG HG2 1 47 ALA H . . 4.500 4.231 4.197 4.290 . 0 0 "[ . 1 . 2]" 1
1373 1 46 ARG HG2 1 50 TYR H . . 4.840 4.518 4.385 4.647 . 0 0 "[ . 1 . 2]" 1
1374 1 46 ARG HG2 1 50 TYR QD . . 4.000 2.857 2.768 3.064 . 0 0 "[ . 1 . 2]" 1
1375 1 46 ARG HG2 1 50 TYR QE . . 3.830 2.550 2.356 2.818 . 0 0 "[ . 1 . 2]" 1
1376 1 47 ALA H 1 47 ALA MB . . 2.960 2.235 2.216 2.249 . 0 0 "[ . 1 . 2]" 1
1377 1 47 ALA H 1 48 MET H . . 3.710 2.843 2.822 2.866 . 0 0 "[ . 1 . 2]" 1
1378 1 47 ALA H 1 48 MET HA . . 5.660 5.446 5.421 5.462 . 0 0 "[ . 1 . 2]" 1
1379 1 47 ALA H 1 48 MET HG2 . . 5.210 5.212 5.195 5.226 0.016 18 0 "[ . 1 . 2]" 1
1380 1 47 ALA H 1 49 ALA H . . 4.450 4.424 4.358 4.460 0.010 8 0 "[ . 1 . 2]" 1
1381 1 47 ALA H 1 50 TYR QD . . 4.980 4.467 4.281 4.730 . 0 0 "[ . 1 . 2]" 1
1382 1 47 ALA H 1 62 ASP HA . . 5.480 5.397 5.244 5.484 0.004 8 0 "[ . 1 . 2]" 1
1383 1 47 ALA H 1 62 ASP HB2 . . 4.160 3.927 3.753 4.172 0.012 15 0 "[ . 1 . 2]" 1
1384 1 47 ALA H 1 62 ASP HB3 . . 3.930 2.866 2.713 2.933 . 0 0 "[ . 1 . 2]" 1
1385 1 47 ALA HA 1 50 TYR H . . 3.840 3.592 3.516 3.681 . 0 0 "[ . 1 . 2]" 1
1386 1 47 ALA HA 1 50 TYR HB2 . . 3.830 2.702 2.613 2.825 . 0 0 "[ . 1 . 2]" 1
1387 1 47 ALA HA 1 50 TYR HB3 . . 4.620 4.267 4.178 4.399 . 0 0 "[ . 1 . 2]" 1
1388 1 47 ALA HA 1 50 TYR QD . . 3.570 2.746 2.397 2.988 . 0 0 "[ . 1 . 2]" 1
1389 1 47 ALA HA 1 51 LEU H . . 4.740 4.176 4.109 4.244 . 0 0 "[ . 1 . 2]" 1
1390 1 47 ALA HA 1 59 ALA MB . . 3.320 2.976 2.816 3.106 . 0 0 "[ . 1 . 2]" 1
1391 1 47 ALA HA 1 62 ASP H . . 4.600 4.550 4.473 4.607 0.007 7 0 "[ . 1 . 2]" 1
1392 1 47 ALA HA 1 62 ASP HB2 . . 4.240 2.581 2.466 2.750 . 0 0 "[ . 1 . 2]" 1
1393 1 47 ALA HA 1 62 ASP HB3 . . 4.350 3.069 2.838 3.289 . 0 0 "[ . 1 . 2]" 1
1394 1 47 ALA MB 1 48 MET H . . 3.200 2.373 2.329 2.425 . 0 0 "[ . 1 . 2]" 1
1395 1 47 ALA MB 1 48 MET HA . . 4.160 3.857 3.824 3.888 . 0 0 "[ . 1 . 2]" 1
1396 1 47 ALA MB 1 48 MET HG2 . . 4.100 3.645 3.591 3.730 . 0 0 "[ . 1 . 2]" 1
1397 1 47 ALA MB 1 49 ALA H . . 4.680 4.691 4.677 4.704 0.024 8 0 "[ . 1 . 2]" 1
1398 1 47 ALA MB 1 50 TYR H . . 4.850 4.765 4.722 4.822 . 0 0 "[ . 1 . 2]" 1
1399 1 47 ALA MB 1 50 TYR QD . . 4.720 4.223 3.944 4.425 . 0 0 "[ . 1 . 2]" 1
1400 1 47 ALA MB 1 59 ALA HA . . 3.430 2.951 2.810 3.087 . 0 0 "[ . 1 . 2]" 1
1401 1 47 ALA MB 1 62 ASP H . . 3.960 3.930 3.877 3.979 0.019 7 0 "[ . 1 . 2]" 1
1402 1 47 ALA MB 1 62 ASP HA . . 3.900 3.916 3.901 3.929 0.029 9 0 "[ . 1 . 2]" 1
1403 1 47 ALA MB 1 62 ASP HB2 . . 3.300 2.594 2.419 2.833 . 0 0 "[ . 1 . 2]" 1
1404 1 47 ALA MB 1 62 ASP HB3 . . 3.380 2.077 2.031 2.110 . 0 0 "[ . 1 . 2]" 1
1405 1 47 ALA MB 1 63 CYS H . . 3.390 2.650 2.584 2.728 . 0 0 "[ . 1 . 2]" 1
1406 1 47 ALA MB 1 63 CYS HA . . 3.880 2.916 2.805 3.005 . 0 0 "[ . 1 . 2]" 1
1407 1 47 ALA MB 1 63 CYS HG . . 3.490 2.237 2.184 2.285 . 0 0 "[ . 1 . 2]" 1
1408 1 47 ALA MB 1 66 ALA H . . 4.890 4.696 4.577 4.785 . 0 0 "[ . 1 . 2]" 1
1409 1 48 MET H 1 48 MET HB3 . . 3.880 3.591 3.578 3.611 . 0 0 "[ . 1 . 2]" 1
1410 1 48 MET H 1 48 MET ME . . 4.440 4.443 4.410 4.454 0.014 3 0 "[ . 1 . 2]" 1
1411 1 48 MET H 1 48 MET HG2 . . 3.450 2.673 2.658 2.686 . 0 0 "[ . 1 . 2]" 1
1412 1 48 MET H 1 48 MET HG3 . . 3.930 3.939 3.934 3.947 0.017 18 0 "[ . 1 . 2]" 1
1413 1 48 MET H 1 49 ALA H . . 3.340 2.938 2.908 2.979 . 0 0 "[ . 1 . 2]" 1
1414 1 48 MET H 1 50 TYR H . . 4.540 4.510 4.448 4.542 0.002 18 0 "[ . 1 . 2]" 1
1415 1 48 MET H 1 50 TYR QD . . 6.000 5.750 5.501 5.982 . 0 0 "[ . 1 . 2]" 1
1416 1 48 MET H 1 51 LEU H . . 5.000 4.754 4.712 4.810 . 0 0 "[ . 1 . 2]" 1
1417 1 48 MET H 1 51 LEU MD1 . . 5.290 4.846 4.778 4.952 . 0 0 "[ . 1 . 2]" 1
1418 1 48 MET H 1 62 ASP HB3 . . 5.230 5.236 5.111 5.275 0.045 8 0 "[ . 1 . 2]" 1
1419 1 48 MET H 1 79 ARG HD3 . . 4.230 3.966 3.857 4.095 . 0 0 "[ . 1 . 2]" 1
1420 1 48 MET H 2 8 VAL MG1 . . 5.110 4.659 4.535 4.837 . 0 0 "[ . 1 . 2]" 1
1421 1 48 MET HA 1 48 MET HG2 . . 4.050 2.943 2.909 2.976 . 0 0 "[ . 1 . 2]" 1
1422 1 48 MET HA 1 48 MET HG3 . . 3.950 3.649 3.616 3.662 . 0 0 "[ . 1 . 2]" 1
1423 1 48 MET HA 1 51 LEU H . . 4.000 3.393 3.267 3.454 . 0 0 "[ . 1 . 2]" 1
1424 1 48 MET HA 1 51 LEU HB2 . . 4.300 2.498 2.385 2.618 . 0 0 "[ . 1 . 2]" 1
1425 1 48 MET HA 1 51 LEU HB3 . . 3.890 3.267 3.141 3.452 . 0 0 "[ . 1 . 2]" 1
1426 1 48 MET HA 1 51 LEU MD1 . . 3.650 3.255 3.157 3.381 . 0 0 "[ . 1 . 2]" 1
1427 1 48 MET HB2 1 48 MET ME . . 3.620 3.500 3.483 3.527 . 0 0 "[ . 1 . 2]" 1
1428 1 48 MET HB2 2 8 VAL MG1 . . 4.670 2.969 2.815 3.154 . 0 0 "[ . 1 . 2]" 1
1429 1 48 MET HB3 1 48 MET ME . . 3.390 2.194 2.163 2.219 . 0 0 "[ . 1 . 2]" 1
1430 1 48 MET HB3 1 49 ALA H . . 4.180 3.171 3.118 3.245 . 0 0 "[ . 1 . 2]" 1
1431 1 48 MET HB3 1 49 ALA HA . . 4.900 4.198 4.154 4.233 . 0 0 "[ . 1 . 2]" 1
1432 1 48 MET HB3 1 50 TYR H . . 6.000 5.718 5.659 5.764 . 0 0 "[ . 1 . 2]" 1
1433 1 48 MET HB3 1 52 LYS QG . . 4.780 3.604 3.494 3.696 . 0 0 "[ . 1 . 2]" 1
1434 1 48 MET HB3 2 6 GLU HA . . 4.110 4.068 3.675 4.131 0.021 1 0 "[ . 1 . 2]" 1
1435 1 48 MET HB3 2 8 VAL MG1 . . 4.590 3.384 3.176 3.645 . 0 0 "[ . 1 . 2]" 1
1436 1 48 MET ME 1 48 MET HG2 . . 3.660 3.455 3.439 3.471 . 0 0 "[ . 1 . 2]" 1
1437 1 48 MET ME 1 48 MET HG3 . . 3.180 2.786 2.741 2.834 . 0 0 "[ . 1 . 2]" 1
1438 1 48 MET ME 1 49 ALA H . . 4.670 4.417 4.384 4.466 . 0 0 "[ . 1 . 2]" 1
1439 1 48 MET ME 1 49 ALA HA . . 4.610 4.623 4.614 4.632 0.022 5 0 "[ . 1 . 2]" 1
1440 1 48 MET ME 1 51 LEU H . . 4.420 4.371 4.219 4.427 0.007 17 0 "[ . 1 . 2]" 1
1441 1 48 MET ME 1 51 LEU HA . . 5.450 5.260 5.056 5.390 . 0 0 "[ . 1 . 2]" 1
1442 1 48 MET ME 1 51 LEU HB2 . . 3.970 3.360 3.185 3.459 . 0 0 "[ . 1 . 2]" 1
1443 1 48 MET ME 1 51 LEU HB3 . . 3.110 2.839 2.598 3.004 . 0 0 "[ . 1 . 2]" 1
1444 1 48 MET ME 1 51 LEU MD1 . . 3.800 3.407 3.239 3.578 . 0 0 "[ . 1 . 2]" 1
1445 1 48 MET ME 1 52 LYS H . . 4.360 4.136 3.958 4.250 . 0 0 "[ . 1 . 2]" 1
1446 1 48 MET ME 1 52 LYS HA . . 4.900 4.769 4.547 4.881 . 0 0 "[ . 1 . 2]" 1
1447 1 48 MET ME 1 52 LYS QD . . 4.430 3.485 3.143 3.842 . 0 0 "[ . 1 . 2]" 1
1448 1 48 MET ME 1 52 LYS HE2 . . 3.490 2.320 2.178 2.526 . 0 0 "[ . 1 . 2]" 1
1449 1 48 MET ME 1 52 LYS QG . . 3.180 2.657 2.550 2.784 . 0 0 "[ . 1 . 2]" 1
1450 1 48 MET ME 1 82 THR MG . . 5.170 4.483 4.121 4.674 . 0 0 "[ . 1 . 2]" 1
1451 1 48 MET ME 2 5 ILE HG12 . . 4.900 4.625 4.404 4.842 . 0 0 "[ . 1 . 2]" 1
1452 1 48 MET ME 2 5 ILE HG13 . . 4.090 3.699 3.581 3.867 . 0 0 "[ . 1 . 2]" 1
1453 1 48 MET ME 2 6 GLU H . . 4.460 4.414 4.293 4.472 0.012 17 0 "[ . 1 . 2]" 1
1454 1 48 MET ME 2 6 GLU HA . . 2.940 2.122 2.078 2.185 . 0 0 "[ . 1 . 2]" 1
1455 1 48 MET ME 2 6 GLU HB2 . . 3.870 2.511 2.236 2.912 . 0 0 "[ . 1 . 2]" 1
1456 1 48 MET ME 2 6 GLU HB3 . . 3.570 2.720 2.366 2.945 . 0 0 "[ . 1 . 2]" 1
1457 1 48 MET ME 2 8 VAL MG1 . . 5.020 4.204 4.000 4.516 . 0 0 "[ . 1 . 2]" 1
1458 1 48 MET HG2 1 49 ALA H . . 4.740 4.649 4.611 4.696 . 0 0 "[ . 1 . 2]" 1
1459 1 48 MET HG2 2 8 VAL MG1 . . 5.300 4.211 3.957 4.482 . 0 0 "[ . 1 . 2]" 1
1460 1 48 MET HG3 1 79 ARG HD3 . . 4.910 3.648 3.424 3.758 . 0 0 "[ . 1 . 2]" 1
1461 1 49 ALA H 1 49 ALA MB . . 3.300 2.141 2.131 2.151 . 0 0 "[ . 1 . 2]" 1
1462 1 49 ALA H 1 50 TYR H . . 3.430 3.119 3.087 3.151 . 0 0 "[ . 1 . 2]" 1
1463 1 49 ALA H 1 51 LEU H . . 4.290 4.242 4.193 4.299 0.009 5 0 "[ . 1 . 2]" 1
1464 1 49 ALA H 1 52 LYS QG . . 4.470 4.524 4.495 4.547 0.077 8 0 "[ . 1 . 2]" 1
1465 1 49 ALA H 2 8 VAL MG1 . . 4.810 4.200 4.081 4.380 . 0 0 "[ . 1 . 2]" 1
1466 1 49 ALA HA 1 51 LEU H . . 4.510 4.356 4.316 4.398 . 0 0 "[ . 1 . 2]" 1
1467 1 49 ALA HA 1 52 LYS H . . 3.970 3.295 3.231 3.368 . 0 0 "[ . 1 . 2]" 1
1468 1 49 ALA HA 1 52 LYS HB2 . . 3.400 2.715 2.550 2.863 . 0 0 "[ . 1 . 2]" 1
1469 1 49 ALA HA 1 52 LYS QG . . 3.170 3.064 2.945 3.146 . 0 0 "[ . 1 . 2]" 1
1470 1 49 ALA HA 1 53 ILE H . . 5.160 4.743 4.619 4.842 . 0 0 "[ . 1 . 2]" 1
1471 1 49 ALA MB 1 50 TYR H . . 3.160 2.457 2.406 2.501 . 0 0 "[ . 1 . 2]" 1
1472 1 49 ALA MB 1 50 TYR HA . . 4.300 4.089 4.028 4.147 . 0 0 "[ . 1 . 2]" 1
1473 1 49 ALA MB 1 50 TYR HB2 . . 4.470 4.409 4.363 4.477 0.007 17 0 "[ . 1 . 2]" 1
1474 1 49 ALA MB 1 51 LEU H . . 4.430 4.454 4.444 4.466 0.036 5 0 "[ . 1 . 2]" 1
1475 1 49 ALA MB 1 52 LYS HB2 . . 4.670 4.142 4.049 4.266 . 0 0 "[ . 1 . 2]" 1
1476 1 49 ALA MB 1 52 LYS QG . . 4.260 4.338 4.235 4.411 0.151 10 0 "[ . 1 . 2]" 1
1477 1 49 ALA MB 1 53 ILE MD . . 4.460 3.875 3.803 3.988 . 0 0 "[ . 1 . 2]" 1
1478 1 49 ALA MB 1 53 ILE MG . . 4.670 4.520 4.327 4.632 . 0 0 "[ . 1 . 2]" 1
1479 1 50 TYR H 1 50 TYR HB2 . . 3.500 2.286 2.255 2.339 . 0 0 "[ . 1 . 2]" 1
1480 1 50 TYR H 1 50 TYR HB3 . . 3.680 3.548 3.528 3.576 . 0 0 "[ . 1 . 2]" 1
1481 1 50 TYR H 1 50 TYR QD . . 3.530 3.315 3.208 3.437 . 0 0 "[ . 1 . 2]" 1
1482 1 50 TYR H 1 50 TYR QE . . 5.230 5.026 4.905 5.123 . 0 0 "[ . 1 . 2]" 1
1483 1 50 TYR H 1 51 LEU H . . 3.350 2.813 2.772 2.858 . 0 0 "[ . 1 . 2]" 1
1484 1 50 TYR H 1 51 LEU HB2 . . 4.770 4.622 4.560 4.719 . 0 0 "[ . 1 . 2]" 1
1485 1 50 TYR H 1 52 LYS H . . 4.600 4.135 4.094 4.181 . 0 0 "[ . 1 . 2]" 1
1486 1 50 TYR H 1 52 LYS HB2 . . 6.000 5.383 5.292 5.445 . 0 0 "[ . 1 . 2]" 1
1487 1 50 TYR H 1 53 ILE H . . 5.030 5.062 5.034 5.075 0.045 13 0 "[ . 1 . 2]" 1
1488 1 50 TYR H 1 53 ILE MD . . 4.250 4.141 4.086 4.180 . 0 0 "[ . 1 . 2]" 1
1489 1 50 TYR H 1 53 ILE HG12 . . 4.560 4.417 4.338 4.484 . 0 0 "[ . 1 . 2]" 1
1490 1 50 TYR H 1 59 ALA MB . . 4.090 4.005 3.934 4.096 0.006 14 0 "[ . 1 . 2]" 1
1491 1 50 TYR H 1 62 ASP HB2 . . 6.000 5.788 5.610 5.973 . 0 0 "[ . 1 . 2]" 1
1492 1 50 TYR HA 1 50 TYR QD . . 3.390 2.243 2.172 2.291 . 0 0 "[ . 1 . 2]" 1
1493 1 50 TYR HA 1 50 TYR QE . . 4.320 4.337 4.304 4.362 0.042 11 0 "[ . 1 . 2]" 1
1494 1 50 TYR HA 1 52 LYS H . . 4.270 4.041 3.956 4.100 . 0 0 "[ . 1 . 2]" 1
1495 1 50 TYR HA 1 53 ILE H . . 3.980 3.404 3.333 3.455 . 0 0 "[ . 1 . 2]" 1
1496 1 50 TYR HA 1 53 ILE HB . . 4.700 4.741 4.725 4.758 0.058 1 0 "[ . 1 . 2]" 1
1497 1 50 TYR HA 1 53 ILE MD . . 3.550 2.080 2.054 2.104 . 0 0 "[ . 1 . 2]" 1
1498 1 50 TYR HA 1 53 ILE HG12 . . 3.880 2.308 2.211 2.396 . 0 0 "[ . 1 . 2]" 1
1499 1 50 TYR HA 1 53 ILE HG13 . . 3.640 2.500 2.404 2.603 . 0 0 "[ . 1 . 2]" 1
1500 1 50 TYR HA 1 53 ILE MG . . 4.320 4.292 4.189 4.331 0.011 9 0 "[ . 1 . 2]" 1
1501 1 50 TYR HA 1 54 GLN H . . 6.000 5.053 4.919 5.125 . 0 0 "[ . 1 . 2]" 1
1502 1 50 TYR HA 1 55 LYS H . . 4.370 3.958 3.883 4.020 . 0 0 "[ . 1 . 2]" 1
1503 1 50 TYR HA 1 55 LYS HB2 . . 4.020 2.720 2.635 2.804 . 0 0 "[ . 1 . 2]" 1
1504 1 50 TYR HA 1 55 LYS HG2 . . 4.280 4.267 4.031 4.324 0.044 3 0 "[ . 1 . 2]" 1
1505 1 50 TYR HA 1 58 GLU QG . . 5.460 5.418 5.220 5.492 0.032 13 0 "[ . 1 . 2]" 1
1506 1 50 TYR HB2 1 51 LEU H . . 4.110 2.820 2.669 2.929 . 0 0 "[ . 1 . 2]" 1
1507 1 50 TYR HB2 1 53 ILE H . . 6.000 5.643 5.595 5.699 . 0 0 "[ . 1 . 2]" 1
1508 1 50 TYR HB2 1 55 LYS HB2 . . 5.040 4.008 3.866 4.158 . 0 0 "[ . 1 . 2]" 1
1509 1 50 TYR HB2 1 59 ALA H . . 3.970 3.787 3.666 3.888 . 0 0 "[ . 1 . 2]" 1
1510 1 50 TYR HB2 1 59 ALA HA . . 3.970 2.980 2.788 3.197 . 0 0 "[ . 1 . 2]" 1
1511 1 50 TYR HB2 1 59 ALA MB . . 3.320 2.319 2.263 2.432 . 0 0 "[ . 1 . 2]" 1
1512 1 50 TYR HB3 1 51 LEU H . . 4.160 3.435 3.356 3.501 . 0 0 "[ . 1 . 2]" 1
1513 1 50 TYR HB3 1 53 ILE MD . . 4.420 4.086 4.024 4.154 . 0 0 "[ . 1 . 2]" 1
1514 1 50 TYR HB3 1 55 LYS H . . 4.240 3.919 3.825 3.991 . 0 0 "[ . 1 . 2]" 1
1515 1 50 TYR HB3 1 55 LYS HB2 . . 4.490 2.382 2.252 2.536 . 0 0 "[ . 1 . 2]" 1
1516 1 50 TYR HB3 1 55 LYS HG2 . . 5.730 4.932 4.739 5.017 . 0 0 "[ . 1 . 2]" 1
1517 1 50 TYR HB3 1 56 TYR H . . 5.290 5.266 5.213 5.296 0.006 19 0 "[ . 1 . 2]" 1
1518 1 50 TYR HB3 1 58 GLU HB2 . . 4.410 2.809 2.669 2.942 . 0 0 "[ . 1 . 2]" 1
1519 1 50 TYR HB3 1 59 ALA H . . 3.610 2.896 2.743 2.988 . 0 0 "[ . 1 . 2]" 1
1520 1 50 TYR HB3 1 59 ALA HA . . 4.150 3.598 3.448 3.826 . 0 0 "[ . 1 . 2]" 1
1521 1 50 TYR HB3 1 59 ALA MB . . 3.420 2.250 2.202 2.375 . 0 0 "[ . 1 . 2]" 1
1522 1 50 TYR QD 1 51 LEU H . . 4.750 4.639 4.500 4.715 . 0 0 "[ . 1 . 2]" 1
1523 1 50 TYR QD 1 53 ILE HB . . 5.700 5.138 5.013 5.249 . 0 0 "[ . 1 . 2]" 1
1524 1 50 TYR QD 1 53 ILE MD . . 3.310 2.176 2.123 2.256 . 0 0 "[ . 1 . 2]" 1
1525 1 50 TYR QD 1 55 LYS H . . 4.860 4.518 4.416 4.592 . 0 0 "[ . 1 . 2]" 1
1526 1 50 TYR QD 1 55 LYS HB2 . . 3.330 2.285 2.186 2.374 . 0 0 "[ . 1 . 2]" 1
1527 1 50 TYR QD 1 55 LYS HB3 . . 3.240 2.800 2.713 2.917 . 0 0 "[ . 1 . 2]" 1
1528 1 50 TYR QD 1 55 LYS QD . . 4.140 3.846 3.591 4.182 0.042 19 0 "[ . 1 . 2]" 1
1529 1 50 TYR QD 1 55 LYS HG2 . . 4.350 3.854 3.731 3.931 . 0 0 "[ . 1 . 2]" 1
1530 1 50 TYR QD 1 55 LYS HG3 . . 3.770 2.472 2.342 2.688 . 0 0 "[ . 1 . 2]" 1
1531 1 50 TYR QD 1 58 GLU H . . 5.120 4.990 4.832 5.079 . 0 0 "[ . 1 . 2]" 1
1532 1 50 TYR QD 1 58 GLU HA . . 5.710 5.200 5.068 5.385 . 0 0 "[ . 1 . 2]" 1
1533 1 50 TYR QD 1 58 GLU HB2 . . 4.970 3.138 3.031 3.228 . 0 0 "[ . 1 . 2]" 1
1534 1 50 TYR QD 1 58 GLU QG . . 4.580 3.526 3.344 3.702 . 0 0 "[ . 1 . 2]" 1
1535 1 50 TYR QD 1 59 ALA H . . 4.360 4.266 4.168 4.340 . 0 0 "[ . 1 . 2]" 1
1536 1 50 TYR QD 1 59 ALA HA . . 3.700 3.255 3.075 3.507 . 0 0 "[ . 1 . 2]" 1
1537 1 50 TYR QD 1 59 ALA MB . . 3.850 3.748 3.631 3.857 0.007 6 0 "[ . 1 . 2]" 1
1538 1 50 TYR QD 1 62 ASP H . . 4.920 4.856 4.702 4.921 0.001 12 0 "[ . 1 . 2]" 1
1539 1 50 TYR QD 1 63 CYS H . . 6.000 5.981 5.712 6.027 0.027 16 0 "[ . 1 . 2]" 1
1540 1 50 TYR QE 1 53 ILE MD . . 3.810 3.273 3.136 3.374 . 0 0 "[ . 1 . 2]" 1
1541 1 50 TYR QE 1 55 LYS HB2 . . 4.450 4.414 4.248 4.464 0.014 1 0 "[ . 1 . 2]" 1
1542 1 50 TYR QE 1 55 LYS QD . . 3.490 4.211 3.880 4.751 1.261 17 15 "[ ********1 * -* +***]" 1
1543 1 50 TYR QE 1 55 LYS QE . . 5.240 4.577 4.160 5.076 . 0 0 "[ . 1 . 2]" 1
1544 1 50 TYR QE 1 55 LYS HG3 . . 3.820 3.782 3.573 3.877 0.057 15 0 "[ . 1 . 2]" 1
1545 1 50 TYR QE 1 58 GLU HA . . 6.000 5.298 5.095 5.498 . 0 0 "[ . 1 . 2]" 1
1546 1 50 TYR QE 1 58 GLU HB2 . . 5.690 3.780 3.547 3.897 . 0 0 "[ . 1 . 2]" 1
1547 1 50 TYR QE 1 58 GLU HB3 . . 4.220 3.382 3.216 3.641 . 0 0 "[ . 1 . 2]" 1
1548 1 50 TYR QE 1 58 GLU QG . . 4.300 3.140 2.920 3.458 . 0 0 "[ . 1 . 2]" 1
1549 1 50 TYR QE 1 62 ASP HB3 . . 6.000 5.079 4.405 5.465 . 0 0 "[ . 1 . 2]" 1
1550 1 51 LEU H 1 51 LEU HB2 . . 3.450 2.047 2.021 2.084 . 0 0 "[ . 1 . 2]" 1
1551 1 51 LEU H 1 51 LEU HB3 . . 3.570 3.185 3.150 3.250 . 0 0 "[ . 1 . 2]" 1
1552 1 51 LEU H 1 51 LEU MD1 . . 3.750 3.779 3.770 3.790 0.040 16 0 "[ . 1 . 2]" 1
1553 1 51 LEU H 1 51 LEU HG . . 4.020 3.788 3.758 3.823 . 0 0 "[ . 1 . 2]" 1
1554 1 51 LEU H 1 52 LYS H . . 3.740 2.688 2.650 2.740 . 0 0 "[ . 1 . 2]" 1
1555 1 51 LEU H 1 52 LYS HA . . 5.400 5.360 5.334 5.403 0.003 2 0 "[ . 1 . 2]" 1
1556 1 51 LEU H 1 52 LYS HB2 . . 4.940 4.913 4.850 4.951 0.011 16 0 "[ . 1 . 2]" 1
1557 1 51 LEU H 1 52 LYS QG . . 4.390 4.407 4.393 4.420 0.030 11 0 "[ . 1 . 2]" 1
1558 1 51 LEU H 1 53 ILE H . . 4.610 4.168 4.096 4.249 . 0 0 "[ . 1 . 2]" 1
1559 1 51 LEU H 1 53 ILE MD . . 5.120 5.160 5.143 5.172 0.052 17 0 "[ . 1 . 2]" 1
1560 1 51 LEU H 1 54 GLN H . . 5.680 5.238 5.060 5.372 . 0 0 "[ . 1 . 2]" 1
1561 1 51 LEU H 1 55 LYS H . . 4.670 4.705 4.684 4.730 0.060 4 0 "[ . 1 . 2]" 1
1562 1 51 LEU H 1 55 LYS HB2 . . 5.130 4.798 4.692 4.928 . 0 0 "[ . 1 . 2]" 1
1563 1 51 LEU H 1 59 ALA MB . . 3.510 2.786 2.677 2.850 . 0 0 "[ . 1 . 2]" 1
1564 1 51 LEU HA 1 51 LEU MD1 . . 4.040 3.677 3.661 3.701 . 0 0 "[ . 1 . 2]" 1
1565 1 51 LEU HA 1 51 LEU MD2 . . 3.030 2.562 2.518 2.609 . 0 0 "[ . 1 . 2]" 1
1566 1 51 LEU HA 1 51 LEU HG . . 3.690 2.216 2.190 2.238 . 0 0 "[ . 1 . 2]" 1
1567 1 51 LEU HA 1 52 LYS HA . . 4.880 4.749 4.714 4.779 . 0 0 "[ . 1 . 2]" 1
1568 1 51 LEU HA 1 52 LYS QG . . 5.480 5.279 5.029 5.371 . 0 0 "[ . 1 . 2]" 1
1569 1 51 LEU HA 1 53 ILE H . . 4.530 4.044 3.906 4.201 . 0 0 "[ . 1 . 2]" 1
1570 1 51 LEU HA 1 54 GLN H . . 4.240 3.589 3.379 3.793 . 0 0 "[ . 1 . 2]" 1
1571 1 51 LEU HA 1 54 GLN HA . . 4.350 3.597 3.280 3.851 . 0 0 "[ . 1 . 2]" 1
1572 1 51 LEU HA 1 55 LYS H . . 3.800 3.133 3.079 3.187 . 0 0 "[ . 1 . 2]" 1
1573 1 51 LEU HA 1 56 TYR H . . 4.980 4.332 4.203 4.424 . 0 0 "[ . 1 . 2]" 1
1574 1 51 LEU HA 1 56 TYR HA . . 4.150 3.825 3.626 4.015 . 0 0 "[ . 1 . 2]" 1
1575 1 51 LEU HA 1 56 TYR QD . . 3.890 3.362 3.216 3.459 . 0 0 "[ . 1 . 2]" 1
1576 1 51 LEU HA 1 56 TYR QE . . 4.100 3.761 3.623 3.842 . 0 0 "[ . 1 . 2]" 1
1577 1 51 LEU HA 1 59 ALA MB . . 3.840 3.151 3.081 3.260 . 0 0 "[ . 1 . 2]" 1
1578 1 51 LEU HA 1 83 ALA HA . . 5.180 5.001 4.889 5.099 . 0 0 "[ . 1 . 2]" 1
1579 1 51 LEU HB2 1 51 LEU MD1 . . 3.150 2.260 2.243 2.301 . 0 0 "[ . 1 . 2]" 1
1580 1 51 LEU HB2 1 51 LEU MD2 . . 3.380 3.141 3.132 3.153 . 0 0 "[ . 1 . 2]" 1
1581 1 51 LEU HB2 1 52 LYS H . . 3.750 3.599 3.541 3.654 . 0 0 "[ . 1 . 2]" 1
1582 1 51 LEU HB2 1 52 LYS HA . . 5.500 5.486 5.431 5.517 0.017 16 0 "[ . 1 . 2]" 1
1583 1 51 LEU HB2 1 52 LYS QG . . 4.420 4.394 4.223 4.438 0.018 15 0 "[ . 1 . 2]" 1
1584 1 51 LEU HB2 1 59 ALA MB . . 3.830 2.935 2.838 3.004 . 0 0 "[ . 1 . 2]" 1
1585 1 51 LEU HB2 1 82 THR MG . . 5.420 5.184 5.085 5.286 . 0 0 "[ . 1 . 2]" 1
1586 1 51 LEU HB3 1 51 LEU MD1 . . 3.150 2.652 2.599 2.729 . 0 0 "[ . 1 . 2]" 1
1587 1 51 LEU HB3 1 51 LEU MD2 . . 2.680 2.245 2.221 2.275 . 0 0 "[ . 1 . 2]" 1
1588 1 51 LEU HB3 1 52 LYS H . . 3.330 3.352 3.324 3.371 0.041 19 0 "[ . 1 . 2]" 1
1589 1 51 LEU HB3 1 56 TYR QE . . 4.700 4.719 4.646 4.736 0.036 5 0 "[ . 1 . 2]" 1
1590 1 51 LEU MD1 1 52 LYS H . . 5.270 5.177 5.146 5.223 . 0 0 "[ . 1 . 2]" 1
1591 1 51 LEU MD1 1 56 TYR QD . . 4.020 3.521 3.499 3.544 . 0 0 "[ . 1 . 2]" 1
1592 1 51 LEU MD1 1 56 TYR QE . . 4.470 4.474 4.427 4.492 0.022 18 0 "[ . 1 . 2]" 1
1593 1 51 LEU MD1 1 59 ALA MB . . 3.330 2.357 2.268 2.439 . 0 0 "[ . 1 . 2]" 1
1594 1 51 LEU MD1 1 60 GLU HA . . 5.020 5.035 4.982 5.062 0.042 11 0 "[ . 1 . 2]" 1
1595 1 51 LEU MD1 1 79 ARG HB3 . . 4.540 3.023 2.947 3.154 . 0 0 "[ . 1 . 2]" 1
1596 1 51 LEU MD1 1 79 ARG HD3 . . 4.920 4.553 4.465 4.740 . 0 0 "[ . 1 . 2]" 1
1597 1 51 LEU MD1 1 80 ARG H . . 4.690 4.724 4.692 4.749 0.059 17 0 "[ . 1 . 2]" 1
1598 1 51 LEU MD1 1 80 ARG HA . . 4.340 3.932 3.854 3.981 . 0 0 "[ . 1 . 2]" 1
1599 1 51 LEU MD1 1 81 GLY H . . 5.510 5.525 5.510 5.546 0.036 15 0 "[ . 1 . 2]" 1
1600 1 51 LEU MD1 1 82 THR H . . 4.100 4.122 4.106 4.134 0.034 19 0 "[ . 1 . 2]" 1
1601 1 51 LEU MD1 1 82 THR HB . . 3.370 2.654 2.490 2.817 . 0 0 "[ . 1 . 2]" 1
1602 1 51 LEU MD1 1 83 ALA MB . . 2.950 2.175 2.129 2.201 . 0 0 "[ . 1 . 2]" 1
1603 1 51 LEU MD1 1 84 ARG H . . 4.780 4.788 4.754 4.807 0.027 20 0 "[ . 1 . 2]" 1
1604 1 51 LEU MD2 1 52 LYS H . . 4.620 4.520 4.446 4.595 . 0 0 "[ . 1 . 2]" 1
1605 1 51 LEU MD2 1 54 GLN H . . 4.830 4.562 4.434 4.738 . 0 0 "[ . 1 . 2]" 1
1606 1 51 LEU MD2 1 54 GLN HA . . 4.800 4.107 3.896 4.313 . 0 0 "[ . 1 . 2]" 1
1607 1 51 LEU MD2 1 55 LYS H . . 4.900 4.915 4.900 4.929 0.029 14 0 "[ . 1 . 2]" 1
1608 1 51 LEU MD2 1 56 TYR HA . . 4.600 4.166 4.034 4.249 . 0 0 "[ . 1 . 2]" 1
1609 1 51 LEU MD2 1 56 TYR HB3 . . 4.440 4.348 4.263 4.440 . 0 0 "[ . 1 . 2]" 1
1610 1 51 LEU MD2 1 56 TYR QD . . 2.920 2.211 2.160 2.289 . 0 0 "[ . 1 . 2]" 1
1611 1 51 LEU MD2 1 56 TYR QE . . 3.360 2.029 1.969 2.062 . 0 0 "[ . 1 . 2]" 1
1612 1 51 LEU MD2 1 82 THR HB . . 3.730 3.142 2.996 3.290 . 0 0 "[ . 1 . 2]" 1
1613 1 51 LEU MD2 1 82 THR MG . . 2.810 1.937 1.902 1.964 . 0 0 "[ . 1 . 2]" 1
1614 1 51 LEU MD2 1 83 ALA H . . 3.990 3.640 3.567 3.685 . 0 0 "[ . 1 . 2]" 1
1615 1 51 LEU MD2 1 83 ALA HA . . 3.020 2.693 2.617 2.772 . 0 0 "[ . 1 . 2]" 1
1616 1 51 LEU MD2 1 83 ALA MB . . 3.370 3.376 3.364 3.383 0.013 5 0 "[ . 1 . 2]" 1
1617 1 51 LEU MD2 1 86 PHE QD . . 4.300 3.305 2.905 3.805 . 0 0 "[ . 1 . 2]" 1
1618 1 51 LEU HG 1 52 LYS H . . 5.340 5.208 5.167 5.234 . 0 0 "[ . 1 . 2]" 1
1619 1 51 LEU HG 1 56 TYR H . . 4.810 4.859 4.842 4.891 0.081 12 0 "[ . 1 . 2]" 1
1620 1 51 LEU HG 1 56 TYR QE . . 3.910 3.746 3.613 3.826 . 0 0 "[ . 1 . 2]" 1
1621 1 51 LEU HG 1 59 ALA MB . . 3.020 2.571 2.494 2.678 . 0 0 "[ . 1 . 2]" 1
1622 1 51 LEU HG 1 82 THR MG . . 4.090 4.130 4.119 4.140 0.050 19 0 "[ . 1 . 2]" 1
1623 1 51 LEU HG 1 83 ALA H . . 4.490 4.448 4.393 4.495 0.005 6 0 "[ . 1 . 2]" 1
1624 1 51 LEU HG 1 83 ALA HA . . 4.050 3.232 3.116 3.321 . 0 0 "[ . 1 . 2]" 1
1625 1 52 LYS H 1 52 LYS HB2 . . 3.660 2.438 2.386 2.481 . 0 0 "[ . 1 . 2]" 1
1626 1 52 LYS H 1 52 LYS HB3 . . 3.760 3.629 3.594 3.656 . 0 0 "[ . 1 . 2]" 1
1627 1 52 LYS H 1 52 LYS QD . . 4.240 3.875 3.626 4.251 0.011 2 0 "[ . 1 . 2]" 1
1628 1 52 LYS H 1 52 LYS HE2 . . 5.190 5.143 5.020 5.214 0.024 17 0 "[ . 1 . 2]" 1
1629 1 52 LYS H 1 52 LYS QG . . 3.580 2.637 2.584 2.679 . 0 0 "[ . 1 . 2]" 1
1630 1 52 LYS H 1 53 ILE H . . 3.600 2.460 2.403 2.501 . 0 0 "[ . 1 . 2]" 1
1631 1 52 LYS H 1 53 ILE MD . . 4.800 4.858 4.838 4.874 0.074 15 0 "[ . 1 . 2]" 1
1632 1 52 LYS H 1 53 ILE MG . . 4.720 4.444 4.285 4.588 . 0 0 "[ . 1 . 2]" 1
1633 1 52 LYS H 1 54 GLN H . . 4.250 3.917 3.761 4.031 . 0 0 "[ . 1 . 2]" 1
1634 1 52 LYS HA 1 52 LYS HD2 . . 4.010 2.984 2.624 3.680 . 0 0 "[ . 1 . 2]" 1
1635 1 52 LYS HA 1 52 LYS QD . . 3.390 2.191 2.069 2.410 . 0 0 "[ . 1 . 2]" 1
1636 1 52 LYS HA 1 52 LYS HD3 . . 4.010 2.265 2.138 2.444 . 0 0 "[ . 1 . 2]" 1
1637 1 52 LYS HA 1 52 LYS HE3 . . 4.870 4.870 4.726 4.906 0.036 11 0 "[ . 1 . 2]" 1
1638 1 52 LYS HA 1 52 LYS QG . . 3.590 2.942 2.710 3.073 . 0 0 "[ . 1 . 2]" 1
1639 1 52 LYS HA 1 53 ILE HA . . 4.690 4.592 4.468 4.650 . 0 0 "[ . 1 . 2]" 1
1640 1 52 LYS HA 1 54 GLN H . . 4.250 3.600 3.427 3.754 . 0 0 "[ . 1 . 2]" 1
1641 1 52 LYS HB2 1 52 LYS QD . . 3.640 3.343 3.283 3.375 . 0 0 "[ . 1 . 2]" 1
1642 1 52 LYS HB2 1 53 ILE H . . 4.140 3.307 3.125 3.496 . 0 0 "[ . 1 . 2]" 1
1643 1 52 LYS HE2 1 52 LYS QG . . 3.570 2.466 2.355 2.575 . 0 0 "[ . 1 . 2]" 1
1644 1 52 LYS HE2 2 6 GLU HB3 . . 4.550 3.989 3.533 4.512 . 0 0 "[ . 1 . 2]" 1
1645 1 53 ILE H 1 53 ILE HB . . 3.690 3.683 3.652 3.700 0.010 10 0 "[ . 1 . 2]" 1
1646 1 53 ILE H 1 53 ILE MD . . 3.610 3.609 3.555 3.628 0.018 12 0 "[ . 1 . 2]" 1
1647 1 53 ILE H 1 53 ILE HG12 . . 3.440 1.933 1.884 1.988 . 0 0 "[ . 1 . 2]" 1
1648 1 53 ILE H 1 53 ILE HG13 . . 3.390 2.644 2.508 2.767 . 0 0 "[ . 1 . 2]" 1
1649 1 53 ILE H 1 53 ILE MG . . 3.250 2.950 2.827 3.016 . 0 0 "[ . 1 . 2]" 1
1650 1 53 ILE H 1 54 GLN H . . 3.240 2.388 2.264 2.456 . 0 0 "[ . 1 . 2]" 1
1651 1 53 ILE H 1 54 GLN HA . . 4.760 4.414 4.289 4.481 . 0 0 "[ . 1 . 2]" 1
1652 1 53 ILE H 1 54 GLN HB2 . . 5.650 5.612 5.442 5.674 0.024 15 0 "[ . 1 . 2]" 1
1653 1 53 ILE H 1 54 GLN HG3 . . 4.870 4.574 4.334 4.719 . 0 0 "[ . 1 . 2]" 1
1654 1 53 ILE H 1 55 LYS H . . 3.740 3.480 3.414 3.532 . 0 0 "[ . 1 . 2]" 1
1655 1 53 ILE H 1 55 LYS HB2 . . 4.320 4.406 4.381 4.433 0.113 20 0 "[ . 1 . 2]" 1
1656 1 53 ILE H 1 55 LYS QE . . 6.000 5.791 5.360 6.008 0.008 1 0 "[ . 1 . 2]" 1
1657 1 53 ILE HA 1 53 ILE HB . . 3.020 2.563 2.527 2.588 . 0 0 "[ . 1 . 2]" 1
1658 1 53 ILE HA 1 53 ILE MD . . 4.270 4.248 4.228 4.273 0.003 1 0 "[ . 1 . 2]" 1
1659 1 53 ILE HA 1 53 ILE HG12 . . 3.990 3.675 3.650 3.706 . 0 0 "[ . 1 . 2]" 1
1660 1 53 ILE HA 1 53 ILE HG13 . . 3.960 3.749 3.721 3.772 . 0 0 "[ . 1 . 2]" 1
1661 1 53 ILE HA 1 53 ILE MG . . 2.810 2.183 2.142 2.232 . 0 0 "[ . 1 . 2]" 1
1662 1 53 ILE HA 1 54 GLN HA . . 5.060 4.906 4.866 4.941 . 0 0 "[ . 1 . 2]" 1
1663 1 53 ILE HA 1 54 GLN HE21 . . 4.170 3.535 3.175 3.907 . 0 0 "[ . 1 . 2]" 1
1664 1 53 ILE HA 1 54 GLN HE22 . . 4.860 4.850 4.326 4.936 0.076 9 0 "[ . 1 . 2]" 1
1665 1 53 ILE HA 1 54 GLN HG2 . . 5.200 5.177 5.130 5.215 0.015 3 0 "[ . 1 . 2]" 1
1666 1 53 ILE HA 1 54 GLN HG3 . . 3.890 3.442 3.396 3.511 . 0 0 "[ . 1 . 2]" 1
1667 1 53 ILE HA 1 55 LYS H . . 5.170 4.868 4.825 4.912 . 0 0 "[ . 1 . 2]" 1
1668 1 53 ILE HB 1 53 ILE MD . . 2.890 2.498 2.459 2.532 . 0 0 "[ . 1 . 2]" 1
1669 1 53 ILE HB 1 54 GLN H . . 4.370 4.360 4.323 4.378 0.008 7 0 "[ . 1 . 2]" 1
1670 1 53 ILE HB 1 55 LYS H . . 4.690 4.708 4.653 4.729 0.039 7 0 "[ . 1 . 2]" 1
1671 1 53 ILE HB 1 55 LYS QE . . 3.950 3.315 2.874 3.707 . 0 0 "[ . 1 . 2]" 1
1672 1 53 ILE MD 1 54 GLN H . . 5.290 5.009 4.923 5.058 . 0 0 "[ . 1 . 2]" 1
1673 1 53 ILE MD 1 55 LYS H . . 4.770 4.457 4.391 4.524 . 0 0 "[ . 1 . 2]" 1
1674 1 53 ILE MD 1 55 LYS HA . . 5.320 5.355 5.338 5.369 0.049 19 0 "[ . 1 . 2]" 1
1675 1 53 ILE MD 1 55 LYS QD . . 3.720 3.961 3.838 4.203 0.483 19 0 "[ . 1 . 2]" 1
1676 1 53 ILE MD 1 55 LYS QE . . 3.380 2.948 2.683 3.342 . 0 0 "[ . 1 . 2]" 1
1677 1 53 ILE HG12 1 53 ILE MG . . 3.410 2.403 2.331 2.448 . 0 0 "[ . 1 . 2]" 1
1678 1 53 ILE HG12 1 55 LYS H . . 4.840 4.109 3.886 4.280 . 0 0 "[ . 1 . 2]" 1
1679 1 53 ILE HG13 1 53 ILE MG . . 3.480 3.235 3.213 3.251 . 0 0 "[ . 1 . 2]" 1
1680 1 53 ILE HG13 1 54 GLN H . . 4.030 3.694 3.577 3.761 . 0 0 "[ . 1 . 2]" 1
1681 1 53 ILE MG 1 54 GLN H . . 4.490 4.324 4.282 4.353 . 0 0 "[ . 1 . 2]" 1
1682 1 53 ILE MG 1 54 GLN HA . . 6.000 6.014 5.987 6.029 0.029 16 0 "[ . 1 . 2]" 1
1683 1 53 ILE MG 1 54 GLN HE21 . . 5.200 4.931 4.556 5.215 0.015 20 0 "[ . 1 . 2]" 1
1684 1 53 ILE MG 1 54 GLN HG3 . . 5.090 5.102 5.086 5.122 0.032 2 0 "[ . 1 . 2]" 1
1685 1 54 GLN H 1 54 GLN HB2 . . 3.800 3.640 3.548 3.690 . 0 0 "[ . 1 . 2]" 1
1686 1 54 GLN H 1 54 GLN HG2 . . 3.940 3.711 3.535 3.914 . 0 0 "[ . 1 . 2]" 1
1687 1 54 GLN H 1 54 GLN HG3 . . 3.580 2.563 2.424 2.669 . 0 0 "[ . 1 . 2]" 1
1688 1 54 GLN H 1 55 LYS H . . 3.310 2.686 2.652 2.725 . 0 0 "[ . 1 . 2]" 1
1689 1 54 GLN H 1 55 LYS HA . . 6.000 5.382 5.312 5.432 . 0 0 "[ . 1 . 2]" 1
1690 1 54 GLN H 1 55 LYS HB2 . . 5.190 4.765 4.707 4.809 . 0 0 "[ . 1 . 2]" 1
1691 1 54 GLN H 1 56 TYR H . . 5.350 5.200 5.073 5.301 . 0 0 "[ . 1 . 2]" 1
1692 1 54 GLN H 1 56 TYR QE . . 4.930 4.693 4.556 4.841 . 0 0 "[ . 1 . 2]" 1
1693 1 54 GLN HA 1 54 GLN HE21 . . 5.060 5.036 4.878 5.093 0.033 4 0 "[ . 1 . 2]" 1
1694 1 54 GLN HA 1 54 GLN HG2 . . 3.380 2.977 2.836 3.192 . 0 0 "[ . 1 . 2]" 1
1695 1 54 GLN HA 1 54 GLN HG3 . . 3.610 2.932 2.847 3.030 . 0 0 "[ . 1 . 2]" 1
1696 1 54 GLN HA 1 55 LYS H . . 3.470 2.653 2.551 2.764 . 0 0 "[ . 1 . 2]" 1
1697 1 54 GLN HA 1 55 LYS HA . . 5.370 4.552 4.514 4.615 . 0 0 "[ . 1 . 2]" 1
1698 1 54 GLN HA 1 55 LYS HB2 . . 5.550 5.096 4.944 5.200 . 0 0 "[ . 1 . 2]" 1
1699 1 54 GLN HA 1 55 LYS QD . . 5.910 5.701 5.297 5.925 0.015 1 0 "[ . 1 . 2]" 1
1700 1 54 GLN HA 1 55 LYS HG3 . . 6.000 6.095 6.068 6.138 0.138 15 0 "[ . 1 . 2]" 1
1701 1 54 GLN HA 1 56 TYR QD . . 4.590 4.002 3.828 4.174 . 0 0 "[ . 1 . 2]" 1
1702 1 54 GLN HA 1 56 TYR QE . . 3.980 3.245 3.151 3.369 . 0 0 "[ . 1 . 2]" 1
1703 1 54 GLN HB2 1 54 GLN HE21 . . 4.210 3.687 2.931 4.135 . 0 0 "[ . 1 . 2]" 1
1704 1 54 GLN HB2 1 54 GLN HE22 . . 4.540 4.078 3.788 4.363 . 0 0 "[ . 1 . 2]" 1
1705 1 54 GLN HB3 1 55 LYS H . . 5.370 4.511 4.468 4.558 . 0 0 "[ . 1 . 2]" 1
1706 1 54 GLN HB3 1 56 TYR H . . 4.960 4.658 4.525 4.807 . 0 0 "[ . 1 . 2]" 1
1707 1 54 GLN HE21 1 54 GLN HG2 . . 3.520 3.244 2.984 3.524 0.004 12 0 "[ . 1 . 2]" 1
1708 1 54 GLN HE21 1 54 GLN HG3 . . 3.540 2.213 2.130 2.322 . 0 0 "[ . 1 . 2]" 1
1709 1 54 GLN HE22 1 54 GLN HG2 . . 3.910 3.937 3.819 4.003 0.093 12 0 "[ . 1 . 2]" 1
1710 1 54 GLN HE22 1 54 GLN HG3 . . 4.050 3.468 3.438 3.509 . 0 0 "[ . 1 . 2]" 1
1711 1 54 GLN HG2 1 55 LYS H . . 5.770 5.441 5.275 5.616 . 0 0 "[ . 1 . 2]" 1
1712 1 54 GLN HG2 1 56 TYR QE . . 4.350 3.873 3.632 4.185 . 0 0 "[ . 1 . 2]" 1
1713 1 54 GLN HG3 1 55 LYS H . . 4.890 4.762 4.671 4.858 . 0 0 "[ . 1 . 2]" 1
1714 1 54 GLN HG3 1 56 TYR QE . . 5.370 4.805 4.602 5.138 . 0 0 "[ . 1 . 2]" 1
1715 1 55 LYS H 1 55 LYS HB2 . . 3.450 2.453 2.396 2.489 . 0 0 "[ . 1 . 2]" 1
1716 1 55 LYS H 1 55 LYS HB3 . . 4.050 3.688 3.664 3.711 . 0 0 "[ . 1 . 2]" 1
1717 1 55 LYS H 1 55 LYS QD . . 4.540 4.174 3.969 4.314 . 0 0 "[ . 1 . 2]" 1
1718 1 55 LYS H 1 55 LYS HG2 . . 4.360 2.770 2.576 2.892 . 0 0 "[ . 1 . 2]" 1
1719 1 55 LYS H 1 55 LYS HG3 . . 3.860 3.794 3.698 3.882 0.022 19 0 "[ . 1 . 2]" 1
1720 1 55 LYS H 1 56 TYR H . . 3.720 3.193 3.078 3.309 . 0 0 "[ . 1 . 2]" 1
1721 1 55 LYS H 1 56 TYR QD . . 4.720 4.632 4.549 4.727 0.007 18 0 "[ . 1 . 2]" 1
1722 1 55 LYS H 1 56 TYR QE . . 4.880 4.873 4.726 4.917 0.037 1 0 "[ . 1 . 2]" 1
1723 1 55 LYS HA 1 55 LYS QD . . 3.750 2.336 2.162 2.472 . 0 0 "[ . 1 . 2]" 1
1724 1 55 LYS HA 1 55 LYS QE . . 4.240 4.126 3.967 4.244 0.004 18 0 "[ . 1 . 2]" 1
1725 1 55 LYS HA 1 55 LYS HG2 . . 3.610 2.908 2.768 3.033 . 0 0 "[ . 1 . 2]" 1
1726 1 55 LYS HA 1 56 TYR H . . 2.860 2.657 2.578 2.721 . 0 0 "[ . 1 . 2]" 1
1727 1 55 LYS HA 1 56 TYR HA . . 4.880 4.752 4.708 4.790 . 0 0 "[ . 1 . 2]" 1
1728 1 55 LYS HA 1 57 GLU H . . 3.840 3.478 3.397 3.546 . 0 0 "[ . 1 . 2]" 1
1729 1 55 LYS HA 1 58 GLU H . . 4.330 3.891 3.807 4.003 . 0 0 "[ . 1 . 2]" 1
1730 1 55 LYS HA 1 58 GLU QG . . 4.810 3.993 3.597 4.296 . 0 0 "[ . 1 . 2]" 1
1731 1 55 LYS HA 1 59 ALA H . . 4.950 4.912 4.832 4.964 0.014 5 0 "[ . 1 . 2]" 1
1732 1 55 LYS HB2 1 56 TYR H . . 4.790 4.341 4.302 4.391 . 0 0 "[ . 1 . 2]" 1
1733 1 55 LYS HB2 1 58 GLU H . . 4.200 4.275 4.243 4.297 0.097 12 0 "[ . 1 . 2]" 1
1734 1 55 LYS HB3 1 55 LYS QD . . 2.460 2.360 2.245 2.471 0.011 20 0 "[ . 1 . 2]" 1
1735 1 55 LYS HB3 1 56 TYR H . . 4.910 4.459 4.426 4.505 . 0 0 "[ . 1 . 2]" 1
1736 1 55 LYS QE 1 58 GLU QG . . 4.940 4.748 4.493 5.099 0.159 9 0 "[ . 1 . 2]" 1
1737 1 55 LYS HG2 1 56 TYR H . . 5.560 4.893 4.844 4.945 . 0 0 "[ . 1 . 2]" 1
1738 1 56 TYR H 1 56 TYR HB2 . . 3.450 2.725 2.694 2.762 . 0 0 "[ . 1 . 2]" 1
1739 1 56 TYR H 1 56 TYR HB3 . . 3.630 3.498 3.473 3.525 . 0 0 "[ . 1 . 2]" 1
1740 1 56 TYR H 1 56 TYR QD . . 3.230 2.598 2.495 2.737 . 0 0 "[ . 1 . 2]" 1
1741 1 56 TYR H 1 56 TYR QE . . 4.250 3.889 3.804 4.011 . 0 0 "[ . 1 . 2]" 1
1742 1 56 TYR H 1 57 GLU H . . 3.260 2.871 2.774 2.931 . 0 0 "[ . 1 . 2]" 1
1743 1 56 TYR H 1 57 GLU HB3 . . 4.970 4.931 4.726 5.035 0.065 12 0 "[ . 1 . 2]" 1
1744 1 56 TYR H 1 58 GLU H . . 4.640 4.338 4.263 4.386 . 0 0 "[ . 1 . 2]" 1
1745 1 56 TYR H 1 59 ALA MB . . 5.200 4.270 4.159 4.405 . 0 0 "[ . 1 . 2]" 1
1746 1 56 TYR H 1 60 GLU H . . 5.940 5.832 5.795 5.882 . 0 0 "[ . 1 . 2]" 1
1747 1 56 TYR H 1 83 ALA MB . . 5.250 4.777 4.732 4.909 . 0 0 "[ . 1 . 2]" 1
1748 1 56 TYR H 1 87 LEU MD1 . . 4.100 4.105 4.089 4.119 0.019 19 0 "[ . 1 . 2]" 1
1749 1 56 TYR H 1 87 LEU MD2 . . 5.460 5.267 5.221 5.303 . 0 0 "[ . 1 . 2]" 1
1750 1 56 TYR HA 1 56 TYR QD . . 3.280 2.726 2.658 2.807 . 0 0 "[ . 1 . 2]" 1
1751 1 56 TYR HA 1 56 TYR QE . . 4.830 4.774 4.699 4.833 0.003 5 0 "[ . 1 . 2]" 1
1752 1 56 TYR HA 1 59 ALA H . . 3.690 3.202 3.140 3.292 . 0 0 "[ . 1 . 2]" 1
1753 1 56 TYR HA 1 59 ALA MB . . 3.080 2.175 2.083 2.275 . 0 0 "[ . 1 . 2]" 1
1754 1 56 TYR HA 1 60 GLU H . . 3.730 3.520 3.461 3.601 . 0 0 "[ . 1 . 2]" 1
1755 1 56 TYR HA 1 83 ALA MB . . 3.330 2.506 2.428 2.634 . 0 0 "[ . 1 . 2]" 1
1756 1 56 TYR HA 1 87 LEU MD1 . . 5.020 4.389 4.332 4.424 . 0 0 "[ . 1 . 2]" 1
1757 1 56 TYR HA 1 87 LEU MD2 . . 4.570 4.299 4.207 4.352 . 0 0 "[ . 1 . 2]" 1
1758 1 56 TYR HB2 1 57 GLU H . . 3.640 2.782 2.665 2.900 . 0 0 "[ . 1 . 2]" 1
1759 1 56 TYR HB2 1 59 ALA H . . 5.610 5.466 5.414 5.520 . 0 0 "[ . 1 . 2]" 1
1760 1 56 TYR HB2 1 83 ALA HA . . 4.430 4.124 4.034 4.214 . 0 0 "[ . 1 . 2]" 1
1761 1 56 TYR HB2 1 83 ALA MB . . 4.120 3.834 3.777 3.919 . 0 0 "[ . 1 . 2]" 1
1762 1 56 TYR HB2 1 84 ARG HA . . 5.270 5.167 5.077 5.214 . 0 0 "[ . 1 . 2]" 1
1763 1 56 TYR HB2 1 86 PHE H . . 5.220 5.218 5.148 5.242 0.022 20 0 "[ . 1 . 2]" 1
1764 1 56 TYR HB2 1 87 LEU H . . 4.400 4.148 4.062 4.214 . 0 0 "[ . 1 . 2]" 1
1765 1 56 TYR HB2 1 87 LEU MD1 . . 3.240 2.029 2.000 2.053 . 0 0 "[ . 1 . 2]" 1
1766 1 56 TYR HB2 1 87 LEU MD2 . . 4.260 3.255 3.192 3.290 . 0 0 "[ . 1 . 2]" 1
1767 1 56 TYR HB3 1 57 GLU H . . 4.070 3.963 3.876 4.053 . 0 0 "[ . 1 . 2]" 1
1768 1 56 TYR HB3 1 58 GLU H . . 6.000 5.621 5.554 5.693 . 0 0 "[ . 1 . 2]" 1
1769 1 56 TYR HB3 1 59 ALA MB . . 4.090 3.998 3.901 4.095 0.005 8 0 "[ . 1 . 2]" 1
1770 1 56 TYR HB3 1 83 ALA HA . . 4.360 2.454 2.373 2.554 . 0 0 "[ . 1 . 2]" 1
1771 1 56 TYR HB3 1 83 ALA MB . . 4.050 2.451 2.384 2.535 . 0 0 "[ . 1 . 2]" 1
1772 1 56 TYR HB3 1 86 PHE H . . 4.990 4.407 4.351 4.492 . 0 0 "[ . 1 . 2]" 1
1773 1 56 TYR HB3 1 87 LEU H . . 4.570 3.905 3.746 4.021 . 0 0 "[ . 1 . 2]" 1
1774 1 56 TYR HB3 1 87 LEU HA . . 4.810 4.497 4.320 4.646 . 0 0 "[ . 1 . 2]" 1
1775 1 56 TYR HB3 1 87 LEU MD1 . . 3.420 3.219 3.128 3.281 . 0 0 "[ . 1 . 2]" 1
1776 1 56 TYR HB3 1 87 LEU MD2 . . 3.970 3.241 3.139 3.282 . 0 0 "[ . 1 . 2]" 1
1777 1 56 TYR QD 1 57 GLU H . . 4.110 3.857 3.739 4.003 . 0 0 "[ . 1 . 2]" 1
1778 1 56 TYR QD 1 59 ALA MB . . 3.840 3.705 3.527 3.799 . 0 0 "[ . 1 . 2]" 1
1779 1 56 TYR QD 1 83 ALA H . . 4.520 4.539 4.518 4.553 0.033 1 0 "[ . 1 . 2]" 1
1780 1 56 TYR QD 1 83 ALA HA . . 3.130 2.029 1.988 2.060 . 0 0 "[ . 1 . 2]" 1
1781 1 56 TYR QD 1 83 ALA MB . . 3.740 3.121 3.085 3.198 . 0 0 "[ . 1 . 2]" 1
1782 1 56 TYR QD 1 87 LEU H . . 4.600 4.563 4.426 4.619 0.019 3 0 "[ . 1 . 2]" 1
1783 1 56 TYR QD 1 87 LEU HA . . 3.980 3.868 3.672 3.993 0.013 19 0 "[ . 1 . 2]" 1
1784 1 56 TYR QD 1 87 LEU MD1 . . 3.550 3.282 3.247 3.312 . 0 0 "[ . 1 . 2]" 1
1785 1 56 TYR QD 1 87 LEU MD2 . . 4.700 4.732 4.672 4.754 0.054 9 0 "[ . 1 . 2]" 1
1786 1 56 TYR QE 1 59 ALA MB . . 5.540 5.267 5.149 5.338 . 0 0 "[ . 1 . 2]" 1
1787 1 56 TYR QE 1 82 THR MG . . 4.360 3.544 3.353 3.736 . 0 0 "[ . 1 . 2]" 1
1788 1 56 TYR QE 1 83 ALA HA . . 3.890 3.940 3.913 3.960 0.070 18 0 "[ . 1 . 2]" 1
1789 1 56 TYR QE 1 86 PHE H . . 5.030 4.938 4.832 5.040 0.010 19 0 "[ . 1 . 2]" 1
1790 1 56 TYR QE 1 86 PHE QB . . 4.920 2.729 2.595 2.851 . 0 0 "[ . 1 . 2]" 1
1791 1 56 TYR QE 1 87 LEU MD1 . . 5.140 5.176 5.158 5.187 0.047 12 0 "[ . 1 . 2]" 1
1792 1 57 GLU H 1 57 GLU HB2 . . 3.050 2.501 2.396 2.596 . 0 0 "[ . 1 . 2]" 1
1793 1 57 GLU H 1 57 GLU HB3 . . 3.040 2.401 2.359 2.434 . 0 0 "[ . 1 . 2]" 1
1794 1 57 GLU H 1 57 GLU HG2 . . 4.640 4.424 4.372 4.468 . 0 0 "[ . 1 . 2]" 1
1795 1 57 GLU H 1 57 GLU HG3 . . 4.530 4.418 4.368 4.463 . 0 0 "[ . 1 . 2]" 1
1796 1 57 GLU H 1 58 GLU H . . 3.110 2.751 2.643 2.819 . 0 0 "[ . 1 . 2]" 1
1797 1 57 GLU H 1 58 GLU HA . . 5.390 5.396 5.312 5.422 0.032 18 0 "[ . 1 . 2]" 1
1798 1 57 GLU H 1 58 GLU HB2 . . 5.460 5.174 5.039 5.342 . 0 0 "[ . 1 . 2]" 1
1799 1 57 GLU H 1 58 GLU QG . . 4.930 4.266 4.030 4.424 . 0 0 "[ . 1 . 2]" 1
1800 1 57 GLU H 1 59 ALA H . . 4.130 4.125 4.001 4.149 0.019 16 0 "[ . 1 . 2]" 1
1801 1 57 GLU H 1 59 ALA MB . . 4.900 4.784 4.625 4.858 . 0 0 "[ . 1 . 2]" 1
1802 1 57 GLU H 1 60 GLU H . . 4.790 4.769 4.657 4.813 0.023 14 0 "[ . 1 . 2]" 1
1803 1 57 GLU H 1 87 LEU MD1 . . 3.210 2.724 2.678 2.778 . 0 0 "[ . 1 . 2]" 1
1804 1 57 GLU H 1 87 LEU MD2 . . 3.770 3.751 3.680 3.783 0.013 7 0 "[ . 1 . 2]" 1
1805 1 57 GLU HA 1 57 GLU HB2 . . 2.950 2.452 2.432 2.489 . 0 0 "[ . 1 . 2]" 1
1806 1 57 GLU HA 1 57 GLU HG2 . . 3.520 3.348 3.273 3.446 . 0 0 "[ . 1 . 2]" 1
1807 1 57 GLU HA 1 57 GLU HG3 . . 3.340 2.480 2.385 2.539 . 0 0 "[ . 1 . 2]" 1
1808 1 57 GLU HA 1 58 GLU HA . . 4.760 4.688 4.641 4.738 . 0 0 "[ . 1 . 2]" 1
1809 1 57 GLU HA 1 60 GLU H . . 4.240 4.018 3.770 4.203 . 0 0 "[ . 1 . 2]" 1
1810 1 57 GLU HA 1 87 LEU MD1 . . 3.220 2.453 2.266 2.617 . 0 0 "[ . 1 . 2]" 1
1811 1 57 GLU HA 1 87 LEU MD2 . . 3.110 2.273 2.208 2.327 . 0 0 "[ . 1 . 2]" 1
1812 1 57 GLU HB3 1 58 GLU H . . 3.200 2.743 2.647 2.895 . 0 0 "[ . 1 . 2]" 1
1813 1 57 GLU HB3 1 87 LEU MD1 . . 3.730 3.636 3.573 3.691 . 0 0 "[ . 1 . 2]" 1
1814 1 57 GLU HG2 1 58 GLU H . . 4.050 3.797 3.619 4.054 0.004 4 0 "[ . 1 . 2]" 1
1815 1 57 GLU HG2 1 58 GLU HA . . 4.810 3.820 3.555 4.184 . 0 0 "[ . 1 . 2]" 1
1816 1 57 GLU HG2 1 61 LYS QD . . 4.700 4.410 4.045 4.709 0.009 11 0 "[ . 1 . 2]" 1
1817 1 57 GLU HG2 1 61 LYS QE . . 4.250 2.960 2.661 3.391 . 0 0 "[ . 1 . 2]" 1
1818 1 57 GLU HG3 1 58 GLU H . . 4.590 4.597 4.480 4.624 0.034 11 0 "[ . 1 . 2]" 1
1819 1 57 GLU HG3 1 58 GLU HA . . 4.820 4.834 4.639 4.874 0.054 19 0 "[ . 1 . 2]" 1
1820 1 57 GLU HG3 1 87 LEU MD1 . . 3.710 3.540 3.420 3.719 0.009 6 0 "[ . 1 . 2]" 1
1821 1 57 GLU HG3 1 87 LEU MD2 . . 3.750 3.724 3.512 3.784 0.034 3 0 "[ . 1 . 2]" 1
1822 1 58 GLU H 1 58 GLU HB2 . . 3.490 2.587 2.486 2.672 . 0 0 "[ . 1 . 2]" 1
1823 1 58 GLU H 1 58 GLU HB3 . . 3.690 3.677 3.647 3.715 0.025 7 0 "[ . 1 . 2]" 1
1824 1 58 GLU H 1 58 GLU QG . . 2.910 2.301 2.184 2.386 . 0 0 "[ . 1 . 2]" 1
1825 1 58 GLU H 1 59 ALA H . . 3.280 2.283 2.241 2.342 . 0 0 "[ . 1 . 2]" 1
1826 1 58 GLU H 1 59 ALA HA . . 5.320 5.008 4.971 5.064 . 0 0 "[ . 1 . 2]" 1
1827 1 58 GLU H 1 59 ALA MB . . 4.140 4.016 3.954 4.081 . 0 0 "[ . 1 . 2]" 1
1828 1 58 GLU H 1 60 GLU H . . 4.390 3.974 3.864 4.056 . 0 0 "[ . 1 . 2]" 1
1829 1 58 GLU H 1 61 LYS H . . 5.260 5.096 4.978 5.161 . 0 0 "[ . 1 . 2]" 1
1830 1 58 GLU H 1 87 LEU MD1 . . 4.710 4.739 4.718 4.756 0.046 5 0 "[ . 1 . 2]" 1
1831 1 58 GLU H 1 87 LEU MD2 . . 5.140 4.967 4.894 5.029 . 0 0 "[ . 1 . 2]" 1
1832 1 58 GLU HA 1 58 GLU QG . . 3.160 3.091 2.948 3.174 0.014 20 0 "[ . 1 . 2]" 1
1833 1 58 GLU HA 1 59 ALA HA . . 5.120 4.819 4.783 4.848 . 0 0 "[ . 1 . 2]" 1
1834 1 58 GLU HA 1 61 LYS H . . 3.910 3.637 3.503 3.728 . 0 0 "[ . 1 . 2]" 1
1835 1 58 GLU HA 1 61 LYS QD . . 3.340 2.243 2.154 2.320 . 0 0 "[ . 1 . 2]" 1
1836 1 58 GLU HA 1 61 LYS QE . . 4.040 3.188 2.799 3.407 . 0 0 "[ . 1 . 2]" 1
1837 1 58 GLU HA 1 61 LYS HG3 . . 4.020 3.416 3.084 3.646 . 0 0 "[ . 1 . 2]" 1
1838 1 58 GLU HA 1 62 ASP H . . 4.710 4.518 4.276 4.715 0.005 18 0 "[ . 1 . 2]" 1
1839 1 58 GLU HB2 1 59 ALA H . . 3.710 2.608 2.490 2.762 . 0 0 "[ . 1 . 2]" 1
1840 1 58 GLU HB2 1 59 ALA MB . . 4.360 3.892 3.792 3.981 . 0 0 "[ . 1 . 2]" 1
1841 1 58 GLU HB3 1 59 ALA H . . 4.100 3.778 3.647 3.943 . 0 0 "[ . 1 . 2]" 1
1842 1 58 GLU HB3 1 59 ALA HA . . 4.840 4.616 4.425 4.860 0.020 17 0 "[ . 1 . 2]" 1
1843 1 58 GLU HB3 1 61 LYS H . . 5.520 5.380 5.146 5.533 0.013 8 0 "[ . 1 . 2]" 1
1844 1 58 GLU QG 1 59 ALA H . . 3.820 3.858 3.835 3.891 0.071 16 0 "[ . 1 . 2]" 1
1845 1 59 ALA H 1 59 ALA MB . . 2.910 2.258 2.224 2.295 . 0 0 "[ . 1 . 2]" 1
1846 1 59 ALA H 1 60 GLU H . . 3.390 2.815 2.727 2.895 . 0 0 "[ . 1 . 2]" 1
1847 1 59 ALA H 1 60 GLU QB . . 4.990 4.416 4.290 4.529 . 0 0 "[ . 1 . 2]" 1
1848 1 59 ALA H 1 83 ALA MB . . 4.430 4.199 4.102 4.324 . 0 0 "[ . 1 . 2]" 1
1849 1 59 ALA H 1 87 LEU MD2 . . 5.350 5.345 5.226 5.372 0.022 5 0 "[ . 1 . 2]" 1
1850 1 59 ALA HA 1 61 LYS H . . 4.640 4.206 4.094 4.307 . 0 0 "[ . 1 . 2]" 1
1851 1 59 ALA HA 1 62 ASP H . . 3.750 3.236 3.140 3.320 . 0 0 "[ . 1 . 2]" 1
1852 1 59 ALA HA 1 62 ASP HB2 . . 4.200 2.513 2.435 2.572 . 0 0 "[ . 1 . 2]" 1
1853 1 59 ALA HA 1 62 ASP HB3 . . 4.400 4.044 3.797 4.179 . 0 0 "[ . 1 . 2]" 1
1854 1 59 ALA HA 1 63 CYS H . . 4.270 3.647 3.434 3.782 . 0 0 "[ . 1 . 2]" 1
1855 1 59 ALA MB 1 60 GLU H . . 3.130 2.777 2.649 2.874 . 0 0 "[ . 1 . 2]" 1
1856 1 59 ALA MB 1 61 LYS H . . 4.810 4.654 4.558 4.708 . 0 0 "[ . 1 . 2]" 1
1857 1 59 ALA MB 1 62 ASP HB2 . . 4.010 4.050 4.000 4.072 0.062 16 0 "[ . 1 . 2]" 1
1858 1 59 ALA MB 1 62 ASP HB3 . . 5.340 5.085 4.916 5.191 . 0 0 "[ . 1 . 2]" 1
1859 1 59 ALA MB 1 87 LEU MD2 . . 5.100 4.967 4.895 5.041 . 0 0 "[ . 1 . 2]" 1
1860 1 60 GLU H 1 60 GLU HB2 . . 3.330 2.602 2.455 2.691 . 0 0 "[ . 1 . 2]" 1
1861 1 60 GLU H 1 60 GLU QB . . 2.850 2.167 2.127 2.232 . 0 0 "[ . 1 . 2]" 1
1862 1 60 GLU H 1 60 GLU HB3 . . 3.330 2.322 2.231 2.401 . 0 0 "[ . 1 . 2]" 1
1863 1 60 GLU H 1 60 GLU HG2 . . 4.550 4.348 4.278 4.414 . 0 0 "[ . 1 . 2]" 1
1864 1 60 GLU H 1 61 LYS H . . 3.380 2.813 2.762 2.875 . 0 0 "[ . 1 . 2]" 1
1865 1 60 GLU H 1 62 ASP H . . 4.640 4.387 4.308 4.453 . 0 0 "[ . 1 . 2]" 1
1866 1 60 GLU H 1 63 CYS H . . 4.860 4.778 4.720 4.862 0.002 15 0 "[ . 1 . 2]" 1
1867 1 60 GLU H 1 63 CYS HG . . 5.070 4.538 4.442 4.654 . 0 0 "[ . 1 . 2]" 1
1868 1 60 GLU H 1 83 ALA MB . . 3.300 2.837 2.758 2.943 . 0 0 "[ . 1 . 2]" 1
1869 1 60 GLU H 1 84 ARG H . . 6.000 5.897 5.802 6.016 0.016 11 0 "[ . 1 . 2]" 1
1870 1 60 GLU H 1 84 ARG HE . . 6.000 6.021 5.940 6.047 0.047 14 0 "[ . 1 . 2]" 1
1871 1 60 GLU H 1 87 LEU MD2 . . 3.970 3.854 3.731 3.946 . 0 0 "[ . 1 . 2]" 1
1872 1 60 GLU HA 1 60 GLU HG2 . . 3.750 3.336 3.156 3.490 . 0 0 "[ . 1 . 2]" 1
1873 1 60 GLU HA 1 61 LYS HA . . 4.770 4.771 4.722 4.791 0.021 11 0 "[ . 1 . 2]" 1
1874 1 60 GLU HA 1 63 CYS H . . 4.160 3.860 3.737 3.998 . 0 0 "[ . 1 . 2]" 1
1875 1 60 GLU HA 1 63 CYS HG . . 4.030 3.510 3.343 3.647 . 0 0 "[ . 1 . 2]" 1
1876 1 60 GLU HA 1 80 ARG HD2 . . 4.660 3.913 3.782 4.046 . 0 0 "[ . 1 . 2]" 1
1877 1 60 GLU HA 1 80 ARG HD3 . . 4.780 4.252 4.074 4.413 . 0 0 "[ . 1 . 2]" 1
1878 1 60 GLU HA 1 83 ALA MB . . 3.560 2.733 2.685 2.816 . 0 0 "[ . 1 . 2]" 1
1879 1 60 GLU HA 1 84 ARG HE . . 4.950 4.108 3.984 4.255 . 0 0 "[ . 1 . 2]" 1
1880 1 60 GLU HA 1 87 LEU MD2 . . 4.770 4.583 4.435 4.646 . 0 0 "[ . 1 . 2]" 1
1881 1 60 GLU QB 1 61 LYS H . . 3.430 2.512 2.396 2.600 . 0 0 "[ . 1 . 2]" 1
1882 1 60 GLU QB 1 80 ARG QG . . 4.730 3.725 3.644 3.884 . 0 0 "[ . 1 . 2]" 1
1883 1 60 GLU QB 1 83 ALA MB . . 4.270 2.734 2.635 2.863 . 0 0 "[ . 1 . 2]" 1
1884 1 60 GLU QB 1 87 LEU MD2 . . 3.600 2.488 2.384 2.604 . 0 0 "[ . 1 . 2]" 1
1885 1 60 GLU HG2 1 61 LYS H . . 4.000 3.308 3.149 3.590 . 0 0 "[ . 1 . 2]" 1
1886 1 60 GLU HG2 1 84 ARG HE . . 4.580 3.178 2.847 3.357 . 0 0 "[ . 1 . 2]" 1
1887 1 60 GLU HG3 1 80 ARG HE . . 5.770 5.314 5.087 5.642 . 0 0 "[ . 1 . 2]" 1
1888 1 60 GLU HG3 1 80 ARG QG . . 4.830 2.875 2.662 3.132 . 0 0 "[ . 1 . 2]" 1
1889 1 60 GLU HG3 1 83 ALA MB . . 4.710 4.155 3.830 4.333 . 0 0 "[ . 1 . 2]" 1
1890 1 60 GLU HG3 1 84 ARG HD3 . . 5.370 4.074 3.789 4.345 . 0 0 "[ . 1 . 2]" 1
1891 1 60 GLU HG3 1 84 ARG HE . . 3.850 1.762 1.667 1.873 . 0 0 "[ . 1 . 2]" 1
1892 1 61 LYS H 1 61 LYS QB . . 2.800 2.516 2.433 2.575 . 0 0 "[ . 1 . 2]" 1
1893 1 61 LYS H 1 61 LYS QD . . 3.470 3.475 3.443 3.494 0.024 13 0 "[ . 1 . 2]" 1
1894 1 61 LYS H 1 61 LYS QE . . 4.460 4.045 3.970 4.191 . 0 0 "[ . 1 . 2]" 1
1895 1 61 LYS H 1 61 LYS HG3 . . 3.670 2.083 1.954 2.213 . 0 0 "[ . 1 . 2]" 1
1896 1 61 LYS H 1 62 ASP H . . 3.230 2.667 2.563 2.728 . 0 0 "[ . 1 . 2]" 1
1897 1 61 LYS H 1 62 ASP HA . . 5.440 5.346 5.229 5.397 . 0 0 "[ . 1 . 2]" 1
1898 1 61 LYS H 1 62 ASP HB2 . . 4.720 4.636 4.477 4.731 0.011 1 0 "[ . 1 . 2]" 1
1899 1 61 LYS H 1 63 CYS H . . 4.310 4.125 4.025 4.206 . 0 0 "[ . 1 . 2]" 1
1900 1 61 LYS H 1 64 THR HB . . 5.850 5.379 5.168 5.558 . 0 0 "[ . 1 . 2]" 1
1901 1 61 LYS H 1 83 ALA MB . . 5.410 4.967 4.894 5.114 . 0 0 "[ . 1 . 2]" 1
1902 1 61 LYS H 1 87 LEU MD2 . . 5.490 5.146 5.011 5.365 . 0 0 "[ . 1 . 2]" 1
1903 1 61 LYS HA 1 61 LYS HG2 . . 3.240 2.899 2.779 2.979 . 0 0 "[ . 1 . 2]" 1
1904 1 61 LYS HA 1 61 LYS HG3 . . 3.190 3.117 3.000 3.213 0.023 13 0 "[ . 1 . 2]" 1
1905 1 61 LYS HA 1 62 ASP HA . . 5.010 4.821 4.765 4.858 . 0 0 "[ . 1 . 2]" 1
1906 1 61 LYS HA 1 64 THR H . . 3.730 3.508 3.408 3.664 . 0 0 "[ . 1 . 2]" 1
1907 1 61 LYS HA 1 64 THR HB . . 3.420 2.828 2.595 3.010 . 0 0 "[ . 1 . 2]" 1
1908 1 61 LYS HA 1 64 THR HG1 . . 4.090 3.041 2.746 3.418 . 0 0 "[ . 1 . 2]" 1
1909 1 61 LYS HA 1 65 GLN H . . 4.480 4.095 3.933 4.228 . 0 0 "[ . 1 . 2]" 1
1910 1 61 LYS HA 1 84 ARG HE . . 6.000 6.067 6.041 6.111 0.111 9 0 "[ . 1 . 2]" 1
1911 1 61 LYS QB 1 61 LYS QD . . 2.940 2.086 2.040 2.138 . 0 0 "[ . 1 . 2]" 1
1912 1 61 LYS QB 1 62 ASP H . . 3.030 2.417 2.355 2.496 . 0 0 "[ . 1 . 2]" 1
1913 1 61 LYS QB 1 62 ASP HA . . 3.980 3.914 3.826 3.986 0.006 19 0 "[ . 1 . 2]" 1
1914 1 61 LYS QB 1 62 ASP HB2 . . 5.010 4.220 3.989 4.340 . 0 0 "[ . 1 . 2]" 1
1915 1 61 LYS QB 1 63 CYS H . . 4.690 4.698 4.677 4.712 0.022 6 0 "[ . 1 . 2]" 1
1916 1 61 LYS QB 1 64 THR H . . 5.570 4.893 4.798 4.971 . 0 0 "[ . 1 . 2]" 1
1917 1 61 LYS QB 1 64 THR HB . . 4.830 4.338 4.141 4.461 . 0 0 "[ . 1 . 2]" 1
1918 1 61 LYS QD 1 62 ASP H . . 4.330 4.228 4.146 4.333 0.003 19 0 "[ . 1 . 2]" 1
1919 1 61 LYS HG2 1 64 THR HB . . 5.770 5.432 5.211 5.634 . 0 0 "[ . 1 . 2]" 1
1920 1 61 LYS HG3 1 62 ASP H . . 4.430 4.176 4.039 4.253 . 0 0 "[ . 1 . 2]" 1
1921 1 62 ASP H 1 62 ASP HB2 . . 3.300 2.254 2.198 2.294 . 0 0 "[ . 1 . 2]" 1
1922 1 62 ASP H 1 62 ASP HB3 . . 3.650 3.533 3.492 3.558 . 0 0 "[ . 1 . 2]" 1
1923 1 62 ASP H 1 63 CYS H . . 3.290 2.713 2.649 2.782 . 0 0 "[ . 1 . 2]" 1
1924 1 62 ASP H 1 63 CYS HA . . 5.440 5.381 5.323 5.440 0.000 2 0 "[ . 1 . 2]" 1
1925 1 62 ASP H 1 65 GLN QB . . 4.970 4.649 4.544 4.772 . 0 0 "[ . 1 . 2]" 1
1926 1 62 ASP HA 1 65 GLN H . . 3.750 3.119 2.981 3.220 . 0 0 "[ . 1 . 2]" 1
1927 1 62 ASP HA 1 65 GLN QB . . 3.470 2.275 2.158 2.383 . 0 0 "[ . 1 . 2]" 1
1928 1 62 ASP HA 1 65 GLN HG2 . . 4.480 3.975 3.861 4.142 . 0 0 "[ . 1 . 2]" 1
1929 1 62 ASP HA 1 66 ALA H . . 4.470 3.918 3.825 4.045 . 0 0 "[ . 1 . 2]" 1
1930 1 62 ASP HA 1 66 ALA MB . . 5.450 4.833 4.725 4.966 . 0 0 "[ . 1 . 2]" 1
1931 1 62 ASP HB2 1 63 CYS H . . 3.800 3.038 2.837 3.223 . 0 0 "[ . 1 . 2]" 1
1932 1 62 ASP HB3 1 63 CYS H . . 4.040 3.558 3.456 3.652 . 0 0 "[ . 1 . 2]" 1
1933 1 63 CYS H 1 63 CYS HB2 . . 3.900 2.438 2.410 2.475 . 0 0 "[ . 1 . 2]" 1
1934 1 63 CYS HA 1 64 THR HA . . 4.840 4.852 4.845 4.859 0.019 5 0 "[ . 1 . 2]" 1
1935 1 63 CYS HA 1 65 GLN H . . 4.630 4.613 4.557 4.640 0.010 8 0 "[ . 1 . 2]" 1
1936 1 63 CYS HA 1 66 ALA H . . 3.850 3.509 3.439 3.612 . 0 0 "[ . 1 . 2]" 1
1937 1 63 CYS HA 1 66 ALA MB . . 3.320 2.792 2.705 2.869 . 0 0 "[ . 1 . 2]" 1
1938 1 63 CYS HA 1 67 ILE H . . 4.970 4.572 4.466 4.644 . 0 0 "[ . 1 . 2]" 1
1939 1 63 CYS HA 1 67 ILE MD . . 4.530 4.302 4.207 4.455 . 0 0 "[ . 1 . 2]" 1
1940 1 63 CYS HA 1 76 ALA MB . . 3.990 3.373 3.295 3.470 . 0 0 "[ . 1 . 2]" 1
1941 1 63 CYS HA 1 79 ARG HB2 . . 4.630 4.428 4.226 4.587 . 0 0 "[ . 1 . 2]" 1
1942 1 63 CYS HA 1 80 ARG QB . . 4.580 4.407 4.368 4.459 . 0 0 "[ . 1 . 2]" 1
1943 1 63 CYS HB2 1 64 THR H . . 4.290 2.589 2.551 2.624 . 0 0 "[ . 1 . 2]" 1
1944 1 63 CYS HB2 1 64 THR MG . . 5.940 5.653 5.595 5.702 . 0 0 "[ . 1 . 2]" 1
1945 1 63 CYS HB2 1 76 ALA MB . . 5.860 5.131 4.974 5.237 . 0 0 "[ . 1 . 2]" 1
1946 1 63 CYS HB2 1 80 ARG QG . . 4.510 2.335 2.254 2.452 . 0 0 "[ . 1 . 2]" 1
1947 1 63 CYS HB2 1 83 ALA MB . . 4.550 4.251 4.138 4.391 . 0 0 "[ . 1 . 2]" 1
1948 1 63 CYS HB3 1 64 THR H . . 3.410 3.440 3.428 3.448 0.038 15 0 "[ . 1 . 2]" 1
1949 1 63 CYS HB3 1 64 THR HA . . 5.230 4.353 4.302 4.385 . 0 0 "[ . 1 . 2]" 1
1950 1 63 CYS HB3 1 66 ALA MB . . 5.070 4.436 4.334 4.533 . 0 0 "[ . 1 . 2]" 1
1951 1 63 CYS HB3 1 67 ILE H . . 5.790 5.380 5.264 5.519 . 0 0 "[ . 1 . 2]" 1
1952 1 63 CYS HB3 1 67 ILE MD . . 3.760 3.229 3.113 3.363 . 0 0 "[ . 1 . 2]" 1
1953 1 63 CYS HB3 1 76 ALA MB . . 4.240 3.717 3.532 3.852 . 0 0 "[ . 1 . 2]" 1
1954 1 63 CYS HB3 1 79 ARG HB2 . . 4.930 3.714 3.585 3.801 . 0 0 "[ . 1 . 2]" 1
1955 1 63 CYS HB3 1 80 ARG H . . 3.870 3.006 2.886 3.129 . 0 0 "[ . 1 . 2]" 1
1956 1 63 CYS HB3 1 83 ALA MB . . 5.410 5.131 5.027 5.260 . 0 0 "[ . 1 . 2]" 1
1957 1 63 CYS HG 1 80 ARG H . . 4.390 4.403 4.387 4.421 0.031 11 0 "[ . 1 . 2]" 1
1958 1 63 CYS HG 1 80 ARG HA . . 3.950 3.216 3.161 3.254 . 0 0 "[ . 1 . 2]" 1
1959 1 63 CYS HG 1 83 ALA H . . 5.130 5.154 5.145 5.165 0.035 5 0 "[ . 1 . 2]" 1
1960 1 63 CYS HG 1 83 ALA MB . . 4.060 3.429 3.355 3.499 . 0 0 "[ . 1 . 2]" 1
1961 1 64 THR H 1 64 THR HB . . 3.280 2.608 2.495 2.645 . 0 0 "[ . 1 . 2]" 1
1962 1 64 THR H 1 64 THR HG1 . . 3.660 2.905 2.187 3.433 . 0 0 "[ . 1 . 2]" 1
1963 1 64 THR H 1 64 THR MG . . 3.810 3.808 3.801 3.818 0.008 10 0 "[ . 1 . 2]" 1
1964 1 64 THR H 1 65 GLN H . . 3.370 2.839 2.803 2.869 . 0 0 "[ . 1 . 2]" 1
1965 1 64 THR H 1 65 GLN HA . . 5.350 5.374 5.358 5.382 0.032 4 0 "[ . 1 . 2]" 1
1966 1 64 THR H 1 65 GLN QB . . 4.920 4.507 4.437 4.570 . 0 0 "[ . 1 . 2]" 1
1967 1 64 THR H 1 66 ALA H . . 4.680 4.445 4.376 4.515 . 0 0 "[ . 1 . 2]" 1
1968 1 64 THR H 1 67 ILE MD . . 4.010 3.916 3.853 4.014 0.004 3 0 "[ . 1 . 2]" 1
1969 1 64 THR H 1 68 LEU MD1 . . 6.000 6.023 6.010 6.032 0.032 6 0 "[ . 1 . 2]" 1
1970 1 64 THR H 1 80 ARG QB . . 5.120 4.384 4.288 4.457 . 0 0 "[ . 1 . 2]" 1
1971 1 64 THR H 1 80 ARG QG . . 3.830 3.763 3.651 3.841 0.011 7 0 "[ . 1 . 2]" 1
1972 1 64 THR HA 1 64 THR MG . . 3.140 2.335 2.297 2.423 . 0 0 "[ . 1 . 2]" 1
1973 1 64 THR HA 1 66 ALA H . . 4.820 4.648 4.584 4.689 . 0 0 "[ . 1 . 2]" 1
1974 1 64 THR HA 1 67 ILE H . . 4.040 3.396 3.347 3.459 . 0 0 "[ . 1 . 2]" 1
1975 1 64 THR HA 1 67 ILE HB . . 3.800 2.779 2.708 2.855 . 0 0 "[ . 1 . 2]" 1
1976 1 64 THR HA 1 67 ILE MD . . 3.840 2.045 2.017 2.069 . 0 0 "[ . 1 . 2]" 1
1977 1 64 THR HA 1 67 ILE MG . . 4.170 4.153 4.093 4.193 0.023 10 0 "[ . 1 . 2]" 1
1978 1 64 THR HA 1 77 PHE QE . . 6.000 6.017 6.004 6.029 0.029 3 0 "[ . 1 . 2]" 1
1979 1 64 THR HA 1 80 ARG QB . . 4.850 4.632 4.536 4.716 . 0 0 "[ . 1 . 2]" 1
1980 1 64 THR HA 1 80 ARG HD2 . . 5.550 3.908 3.716 4.092 . 0 0 "[ . 1 . 2]" 1
1981 1 64 THR HA 1 80 ARG HD3 . . 4.780 2.883 2.713 2.982 . 0 0 "[ . 1 . 2]" 1
1982 1 64 THR HA 1 80 ARG HE . . 5.210 4.948 4.824 5.120 . 0 0 "[ . 1 . 2]" 1
1983 1 64 THR HA 1 80 ARG QH2 . . 4.830 4.667 4.521 4.838 0.008 17 0 "[ . 1 . 2]" 1
1984 1 64 THR HB 1 65 GLN H . . 3.530 2.534 2.426 2.625 . 0 0 "[ . 1 . 2]" 1
1985 1 64 THR HB 1 65 GLN QB . . 4.550 4.104 3.964 4.201 . 0 0 "[ . 1 . 2]" 1
1986 1 64 THR HB 1 66 ALA H . . 5.510 5.276 5.180 5.363 . 0 0 "[ . 1 . 2]" 1
1987 1 64 THR HB 1 67 ILE HB . . 5.460 5.461 5.432 5.479 0.019 1 0 "[ . 1 . 2]" 1
1988 1 64 THR HB 1 67 ILE MD . . 4.820 4.772 4.731 4.822 0.002 10 0 "[ . 1 . 2]" 1
1989 1 64 THR HG1 1 64 THR MG . . 3.480 2.558 2.197 2.997 . 0 0 "[ . 1 . 2]" 1
1990 1 64 THR HG1 1 65 GLN H . . 4.640 4.380 4.024 4.652 0.012 15 0 "[ . 1 . 2]" 1
1991 1 64 THR MG 1 65 GLN H . . 3.460 3.432 3.307 3.468 0.008 4 0 "[ . 1 . 2]" 1
1992 1 64 THR MG 1 65 GLN HA . . 3.550 3.489 3.354 3.554 0.004 17 0 "[ . 1 . 2]" 1
1993 1 64 THR MG 1 67 ILE HB . . 3.890 3.503 3.413 3.587 . 0 0 "[ . 1 . 2]" 1
1994 1 64 THR MG 1 67 ILE MD . . 3.990 3.513 3.384 3.654 . 0 0 "[ . 1 . 2]" 1
1995 1 64 THR MG 1 68 LEU H . . 4.030 4.050 4.031 4.064 0.034 8 0 "[ . 1 . 2]" 1
1996 1 64 THR MG 1 68 LEU MD1 . . 3.500 2.448 2.364 2.527 . 0 0 "[ . 1 . 2]" 1
1997 1 64 THR MG 1 68 LEU MD2 . . 3.300 2.786 2.481 2.973 . 0 0 "[ . 1 . 2]" 1
1998 1 64 THR MG 1 68 LEU HG . . 3.370 2.507 2.437 2.605 . 0 0 "[ . 1 . 2]" 1
1999 1 64 THR MG 1 80 ARG HD2 . . 4.400 4.101 4.034 4.165 . 0 0 "[ . 1 . 2]" 1
2000 1 64 THR MG 1 80 ARG HD3 . . 4.090 4.093 4.006 4.110 0.020 16 0 "[ . 1 . 2]" 1
2001 1 64 THR MG 1 80 ARG QH2 . . 4.460 4.195 4.097 4.305 . 0 0 "[ . 1 . 2]" 1
2002 1 65 GLN H 1 65 GLN QB . . 2.950 2.226 2.204 2.248 . 0 0 "[ . 1 . 2]" 1
2003 1 65 GLN H 1 65 GLN HG2 . . 4.690 4.589 4.567 4.613 . 0 0 "[ . 1 . 2]" 1
2004 1 65 GLN H 1 65 GLN HG3 . . 4.460 4.470 4.464 4.481 0.021 15 0 "[ . 1 . 2]" 1
2005 1 65 GLN H 1 66 ALA H . . 3.210 3.007 2.972 3.051 . 0 0 "[ . 1 . 2]" 1
2006 1 65 GLN H 1 67 ILE MD . . 5.270 5.037 5.003 5.087 . 0 0 "[ . 1 . 2]" 1
2007 1 65 GLN HA 1 65 GLN QB . . 2.780 2.367 2.349 2.379 . 0 0 "[ . 1 . 2]" 1
2008 1 65 GLN HA 1 65 GLN HE21 . . 3.540 3.156 2.914 3.335 . 0 0 "[ . 1 . 2]" 1
2009 1 65 GLN HA 1 65 GLN HE22 . . 4.230 3.802 3.629 3.939 . 0 0 "[ . 1 . 2]" 1
2010 1 65 GLN HA 1 65 GLN HG2 . . 3.970 3.890 3.826 3.937 . 0 0 "[ . 1 . 2]" 1
2011 1 65 GLN HA 1 65 GLN HG3 . . 3.830 3.121 3.064 3.167 . 0 0 "[ . 1 . 2]" 1
2012 1 65 GLN HA 1 67 ILE H . . 4.680 4.076 4.010 4.139 . 0 0 "[ . 1 . 2]" 1
2013 1 65 GLN HA 1 67 ILE MD . . 5.860 5.899 5.881 5.912 0.052 6 0 "[ . 1 . 2]" 1
2014 1 65 GLN HA 1 68 LEU H . . 3.580 3.228 3.146 3.280 . 0 0 "[ . 1 . 2]" 1
2015 1 65 GLN HA 1 68 LEU HB2 . . 3.450 2.744 2.661 2.823 . 0 0 "[ . 1 . 2]" 1
2016 1 65 GLN HA 1 68 LEU MD1 . . 3.190 2.373 2.314 2.422 . 0 0 "[ . 1 . 2]" 1
2017 1 65 GLN HA 1 69 LEU MD1 . . 5.050 4.916 4.793 5.053 0.003 3 0 "[ . 1 . 2]" 1
2018 1 65 GLN QB 1 66 ALA H . . 3.250 2.549 2.494 2.632 . 0 0 "[ . 1 . 2]" 1
2019 1 65 GLN QB 1 67 ILE H . . 4.940 4.677 4.636 4.753 . 0 0 "[ . 1 . 2]" 1
2020 1 65 GLN QB 1 68 LEU H . . 4.900 4.886 4.807 4.913 0.013 1 0 "[ . 1 . 2]" 1
2021 1 65 GLN HE21 1 65 GLN HG2 . . 3.510 3.391 3.325 3.460 . 0 0 "[ . 1 . 2]" 1
2022 1 65 GLN HE21 1 65 GLN HG3 . . 3.320 2.182 2.143 2.230 . 0 0 "[ . 1 . 2]" 1
2023 1 65 GLN HE21 1 66 ALA HA . . 4.830 4.551 4.444 4.695 . 0 0 "[ . 1 . 2]" 1
2024 1 65 GLN HE21 1 68 LEU H . . 4.530 4.502 4.252 4.563 0.033 18 0 "[ . 1 . 2]" 1
2025 1 65 GLN HE21 1 68 LEU HB2 . . 4.060 2.913 2.645 2.995 . 0 0 "[ . 1 . 2]" 1
2026 1 65 GLN HE21 1 68 LEU HB3 . . 4.290 4.222 3.964 4.294 0.004 7 0 "[ . 1 . 2]" 1
2027 1 65 GLN HE21 1 69 LEU HB2 . . 4.550 4.523 4.369 4.578 0.028 6 0 "[ . 1 . 2]" 1
2028 1 65 GLN HE21 1 69 LEU HB3 . . 5.060 4.925 4.805 5.023 . 0 0 "[ . 1 . 2]" 1
2029 1 65 GLN HE21 1 69 LEU MD1 . . 3.380 2.572 2.441 2.839 . 0 0 "[ . 1 . 2]" 1
2030 1 65 GLN HE21 1 69 LEU MD2 . . 3.220 2.201 2.140 2.338 . 0 0 "[ . 1 . 2]" 1
2031 1 65 GLN HE21 1 69 LEU HG . . 3.760 2.185 2.067 2.282 . 0 0 "[ . 1 . 2]" 1
2032 1 65 GLN HE22 1 65 GLN HG3 . . 3.610 3.490 3.464 3.518 . 0 0 "[ . 1 . 2]" 1
2033 1 65 GLN HE22 1 68 LEU H . . 5.620 5.605 5.477 5.653 0.033 7 0 "[ . 1 . 2]" 1
2034 1 65 GLN HE22 1 68 LEU HB2 . . 4.030 3.455 3.286 3.573 . 0 0 "[ . 1 . 2]" 1
2035 1 65 GLN HE22 1 68 LEU HB3 . . 4.450 4.209 3.982 4.351 . 0 0 "[ . 1 . 2]" 1
2036 1 65 GLN HE22 1 69 LEU H . . 5.430 5.187 5.035 5.332 . 0 0 "[ . 1 . 2]" 1
2037 1 65 GLN HE22 1 69 LEU MD1 . . 3.900 3.641 3.467 3.780 . 0 0 "[ . 1 . 2]" 1
2038 1 65 GLN HE22 1 69 LEU MD2 . . 3.140 2.501 2.402 2.694 . 0 0 "[ . 1 . 2]" 1
2039 1 65 GLN HE22 1 69 LEU HG . . 4.020 3.725 3.602 3.865 . 0 0 "[ . 1 . 2]" 1
2040 1 65 GLN HG2 1 66 ALA H . . 4.360 4.383 4.367 4.395 0.035 18 0 "[ . 1 . 2]" 1
2041 1 65 GLN HG2 1 66 ALA HA . . 5.080 5.102 5.094 5.117 0.037 3 0 "[ . 1 . 2]" 1
2042 1 65 GLN HG2 1 66 ALA MB . . 5.330 5.156 5.100 5.228 . 0 0 "[ . 1 . 2]" 1
2043 1 65 GLN HG2 1 69 LEU MD1 . . 4.090 3.776 3.660 3.897 . 0 0 "[ . 1 . 2]" 1
2044 1 65 GLN HG3 1 66 ALA H . . 4.410 3.548 3.509 3.582 . 0 0 "[ . 1 . 2]" 1
2045 1 65 GLN HG3 1 66 ALA HA . . 4.560 3.623 3.591 3.659 . 0 0 "[ . 1 . 2]" 1
2046 1 65 GLN HG3 1 66 ALA MB . . 4.390 4.349 4.310 4.385 . 0 0 "[ . 1 . 2]" 1
2047 1 65 GLN HG3 1 68 LEU HB2 . . 4.410 4.321 4.220 4.415 0.005 1 0 "[ . 1 . 2]" 1
2048 1 65 GLN HG3 1 69 LEU H . . 4.640 4.680 4.657 4.703 0.063 4 0 "[ . 1 . 2]" 1
2049 1 65 GLN HG3 1 69 LEU MD1 . . 3.600 2.780 2.674 2.915 . 0 0 "[ . 1 . 2]" 1
2050 1 65 GLN HG3 1 69 LEU MD2 . . 3.780 3.796 3.781 3.808 0.028 10 0 "[ . 1 . 2]" 1
2051 1 66 ALA H 1 66 ALA MB . . 2.840 2.181 2.166 2.192 . 0 0 "[ . 1 . 2]" 1
2052 1 66 ALA H 1 67 ILE MD . . 5.090 4.993 4.948 5.078 . 0 0 "[ . 1 . 2]" 1
2053 1 66 ALA H 1 67 ILE HG13 . . 5.140 4.589 4.548 4.643 . 0 0 "[ . 1 . 2]" 1
2054 1 66 ALA H 1 69 LEU H . . 5.120 5.098 5.030 5.130 0.010 20 0 "[ . 1 . 2]" 1
2055 1 66 ALA H 1 69 LEU MD1 . . 5.040 4.893 4.833 4.961 . 0 0 "[ . 1 . 2]" 1
2056 1 66 ALA H 1 76 ALA MB . . 4.460 4.313 4.189 4.379 . 0 0 "[ . 1 . 2]" 1
2057 1 66 ALA HA 1 68 LEU H . . 4.480 4.206 4.145 4.259 . 0 0 "[ . 1 . 2]" 1
2058 1 66 ALA HA 1 69 LEU H . . 3.920 3.496 3.423 3.546 . 0 0 "[ . 1 . 2]" 1
2059 1 66 ALA HA 1 69 LEU MD1 . . 3.580 3.104 3.072 3.150 . 0 0 "[ . 1 . 2]" 1
2060 1 66 ALA HA 1 69 LEU MD2 . . 4.920 4.875 4.797 4.933 0.013 20 0 "[ . 1 . 2]" 1
2061 1 66 ALA HA 1 70 ASP H . . 4.520 4.396 4.333 4.480 . 0 0 "[ . 1 . 2]" 1
2062 1 66 ALA HA 1 73 TYR QD . . 5.190 4.233 4.060 4.346 . 0 0 "[ . 1 . 2]" 1
2063 1 66 ALA HA 1 76 ALA MB . . 4.780 4.521 4.369 4.598 . 0 0 "[ . 1 . 2]" 1
2064 1 66 ALA MB 1 67 ILE H . . 3.550 2.856 2.781 2.922 . 0 0 "[ . 1 . 2]" 1
2065 1 66 ALA MB 1 67 ILE HA . . 4.240 4.066 4.008 4.127 . 0 0 "[ . 1 . 2]" 1
2066 1 66 ALA MB 1 67 ILE MD . . 4.230 4.219 4.179 4.238 0.008 17 0 "[ . 1 . 2]" 1
2067 1 66 ALA MB 1 67 ILE HG13 . . 4.240 3.269 3.207 3.327 . 0 0 "[ . 1 . 2]" 1
2068 1 66 ALA MB 1 69 LEU MD1 . . 4.210 4.227 4.221 4.233 0.023 15 0 "[ . 1 . 2]" 1
2069 1 66 ALA MB 1 73 TYR QD . . 3.630 2.549 2.445 2.639 . 0 0 "[ . 1 . 2]" 1
2070 1 66 ALA MB 1 73 TYR QE . . 3.940 3.024 2.833 3.197 . 0 0 "[ . 1 . 2]" 1
2071 1 66 ALA MB 1 76 ALA MB . . 2.810 2.259 2.179 2.309 . 0 0 "[ . 1 . 2]" 1
2072 1 67 ILE H 1 67 ILE HB . . 3.650 2.478 2.455 2.499 . 0 0 "[ . 1 . 2]" 1
2073 1 67 ILE H 1 67 ILE MD . . 3.420 3.334 3.291 3.374 . 0 0 "[ . 1 . 2]" 1
2074 1 67 ILE H 1 67 ILE HG12 . . 4.560 3.848 3.803 3.876 . 0 0 "[ . 1 . 2]" 1
2075 1 67 ILE H 1 67 ILE HG13 . . 3.790 2.452 2.400 2.484 . 0 0 "[ . 1 . 2]" 1
2076 1 67 ILE H 1 67 ILE MG . . 3.870 3.791 3.780 3.803 . 0 0 "[ . 1 . 2]" 1
2077 1 67 ILE H 1 68 LEU H . . 3.260 2.402 2.332 2.439 . 0 0 "[ . 1 . 2]" 1
2078 1 67 ILE H 1 68 LEU HB2 . . 4.600 4.642 4.630 4.651 0.051 2 0 "[ . 1 . 2]" 1
2079 1 67 ILE H 1 68 LEU MD2 . . 4.980 4.895 4.713 4.980 . 0 0 "[ . 1 . 2]" 1
2080 1 67 ILE H 1 68 LEU HG . . 4.150 4.079 3.957 4.145 . 0 0 "[ . 1 . 2]" 1
2081 1 67 ILE H 1 69 LEU H . . 4.250 4.061 4.010 4.093 . 0 0 "[ . 1 . 2]" 1
2082 1 67 ILE H 1 69 LEU HB2 . . 6.000 5.721 5.565 5.821 . 0 0 "[ . 1 . 2]" 1
2083 1 67 ILE H 1 70 ASP H . . 4.800 4.809 4.774 4.832 0.032 20 0 "[ . 1 . 2]" 1
2084 1 67 ILE H 1 76 ALA MB . . 3.640 3.440 3.370 3.490 . 0 0 "[ . 1 . 2]" 1
2085 1 67 ILE H 1 80 ARG HD3 . . 6.000 5.606 5.364 5.708 . 0 0 "[ . 1 . 2]" 1
2086 1 67 ILE HA 1 67 ILE MD . . 3.930 3.929 3.915 3.936 0.006 3 0 "[ . 1 . 2]" 1
2087 1 67 ILE HA 1 67 ILE HG12 . . 3.520 2.776 2.764 2.791 . 0 0 "[ . 1 . 2]" 1
2088 1 67 ILE HA 1 67 ILE HG13 . . 3.630 2.831 2.808 2.862 . 0 0 "[ . 1 . 2]" 1
2089 1 67 ILE HA 1 67 ILE MG . . 3.160 2.375 2.354 2.409 . 0 0 "[ . 1 . 2]" 1
2090 1 67 ILE HA 1 68 LEU HA . . 4.920 4.775 4.729 4.814 . 0 0 "[ . 1 . 2]" 1
2091 1 67 ILE HA 1 68 LEU HB2 . . 6.000 5.839 5.812 5.888 . 0 0 "[ . 1 . 2]" 1
2092 1 67 ILE HA 1 68 LEU MD2 . . 5.400 5.273 5.223 5.327 . 0 0 "[ . 1 . 2]" 1
2093 1 67 ILE HA 1 68 LEU HG . . 6.000 5.578 5.524 5.662 . 0 0 "[ . 1 . 2]" 1
2094 1 67 ILE HA 1 69 LEU H . . 4.530 4.172 4.112 4.249 . 0 0 "[ . 1 . 2]" 1
2095 1 67 ILE HA 1 70 ASP H . . 3.590 3.358 3.292 3.433 . 0 0 "[ . 1 . 2]" 1
2096 1 67 ILE HA 1 71 GLY H . . 4.600 2.505 2.385 2.647 . 0 0 "[ . 1 . 2]" 1
2097 1 67 ILE HA 1 71 GLY HA2 . . 4.180 3.700 3.477 3.907 . 0 0 "[ . 1 . 2]" 1
2098 1 67 ILE HA 1 71 GLY HA3 . . 5.320 5.031 4.838 5.211 . 0 0 "[ . 1 . 2]" 1
2099 1 67 ILE HA 1 72 SER H . . 5.120 4.949 4.863 5.024 . 0 0 "[ . 1 . 2]" 1
2100 1 67 ILE HA 1 73 TYR H . . 4.430 3.995 3.916 4.052 . 0 0 "[ . 1 . 2]" 1
2101 1 67 ILE HA 1 76 ALA H . . 6.000 5.996 5.891 6.031 0.031 18 0 "[ . 1 . 2]" 1
2102 1 67 ILE HA 1 76 ALA MB . . 4.060 3.355 3.297 3.405 . 0 0 "[ . 1 . 2]" 1
2103 1 67 ILE HA 1 77 PHE QD . . 5.630 5.553 5.457 5.632 0.002 13 0 "[ . 1 . 2]" 1
2104 1 67 ILE HA 1 77 PHE QE . . 5.140 4.747 4.653 4.876 . 0 0 "[ . 1 . 2]" 1
2105 1 67 ILE HB 1 67 ILE MD . . 3.160 2.299 2.273 2.318 . 0 0 "[ . 1 . 2]" 1
2106 1 67 ILE HB 1 68 LEU H . . 3.390 2.984 2.943 3.039 . 0 0 "[ . 1 . 2]" 1
2107 1 67 ILE HB 1 68 LEU HB2 . . 5.330 5.264 5.223 5.331 0.001 8 0 "[ . 1 . 2]" 1
2108 1 67 ILE HB 1 69 LEU H . . 5.240 5.250 5.238 5.263 0.023 6 0 "[ . 1 . 2]" 1
2109 1 67 ILE HB 1 77 PHE QE . . 5.030 4.887 4.793 4.943 . 0 0 "[ . 1 . 2]" 1
2110 1 67 ILE MD 1 67 ILE MG . . 2.880 2.172 2.145 2.200 . 0 0 "[ . 1 . 2]" 1
2111 1 67 ILE MD 1 68 LEU H . . 4.640 4.636 4.601 4.670 0.030 18 0 "[ . 1 . 2]" 1
2112 1 67 ILE MD 1 68 LEU MD2 . . 4.950 4.877 4.716 4.954 0.004 11 0 "[ . 1 . 2]" 1
2113 1 67 ILE MD 1 68 LEU HG . . 5.200 5.079 5.042 5.145 . 0 0 "[ . 1 . 2]" 1
2114 1 67 ILE MD 1 73 TYR H . . 6.000 5.960 5.869 6.007 0.007 1 0 "[ . 1 . 2]" 1
2115 1 67 ILE MD 1 76 ALA H . . 5.180 5.099 5.022 5.180 . 0 0 "[ . 1 . 2]" 1
2116 1 67 ILE MD 1 76 ALA HA . . 4.680 4.272 4.218 4.317 . 0 0 "[ . 1 . 2]" 1
2117 1 67 ILE MD 1 76 ALA MB . . 3.450 2.864 2.813 2.910 . 0 0 "[ . 1 . 2]" 1
2118 1 67 ILE MD 1 77 PHE H . . 3.930 3.706 3.591 3.850 . 0 0 "[ . 1 . 2]" 1
2119 1 67 ILE MD 1 77 PHE HA . . 3.360 2.481 2.374 2.547 . 0 0 "[ . 1 . 2]" 1
2120 1 67 ILE MD 1 77 PHE QD . . 4.100 3.100 2.949 3.167 . 0 0 "[ . 1 . 2]" 1
2121 1 67 ILE MD 1 77 PHE QE . . 3.610 3.001 2.885 3.044 . 0 0 "[ . 1 . 2]" 1
2122 1 67 ILE MD 1 78 ALA H . . 5.420 5.306 5.206 5.376 . 0 0 "[ . 1 . 2]" 1
2123 1 67 ILE MD 1 79 ARG HB2 . . 5.240 5.246 5.205 5.258 0.018 11 0 "[ . 1 . 2]" 1
2124 1 67 ILE MD 1 80 ARG H . . 4.440 4.219 4.111 4.283 . 0 0 "[ . 1 . 2]" 1
2125 1 67 ILE MD 1 80 ARG QB . . 4.190 2.871 2.727 2.956 . 0 0 "[ . 1 . 2]" 1
2126 1 67 ILE MD 1 80 ARG HD3 . . 3.830 2.687 2.489 2.833 . 0 0 "[ . 1 . 2]" 1
2127 1 67 ILE MD 1 80 ARG HE . . 4.430 3.263 3.126 3.407 . 0 0 "[ . 1 . 2]" 1
2128 1 67 ILE MD 1 80 ARG QH2 . . 4.480 3.017 2.764 3.275 . 0 0 "[ . 1 . 2]" 1
2129 1 67 ILE HG12 1 67 ILE MG . . 3.200 2.241 2.228 2.261 . 0 0 "[ . 1 . 2]" 1
2130 1 67 ILE HG12 1 77 PHE HA . . 4.280 4.184 4.000 4.259 . 0 0 "[ . 1 . 2]" 1
2131 1 67 ILE HG13 1 67 ILE MG . . 3.360 3.159 3.154 3.167 . 0 0 "[ . 1 . 2]" 1
2132 1 67 ILE HG13 1 68 LEU H . . 4.590 4.470 4.430 4.513 . 0 0 "[ . 1 . 2]" 1
2133 1 67 ILE HG13 1 76 ALA MB . . 3.790 2.026 1.999 2.050 . 0 0 "[ . 1 . 2]" 1
2134 1 67 ILE HG13 1 77 PHE H . . 5.080 4.621 4.513 4.720 . 0 0 "[ . 1 . 2]" 1
2135 1 67 ILE MG 1 68 LEU H . . 3.910 3.720 3.687 3.765 . 0 0 "[ . 1 . 2]" 1
2136 1 67 ILE MG 1 68 LEU HA . . 3.630 3.661 3.616 3.682 0.052 11 0 "[ . 1 . 2]" 1
2137 1 67 ILE MG 1 68 LEU MD2 . . 3.380 3.387 3.362 3.397 0.017 6 0 "[ . 1 . 2]" 1
2138 1 67 ILE MG 1 68 LEU HG . . 4.660 4.421 4.332 4.590 . 0 0 "[ . 1 . 2]" 1
2139 1 67 ILE MG 1 70 ASP H . . 4.670 4.603 4.496 4.674 0.004 8 0 "[ . 1 . 2]" 1
2140 1 67 ILE MG 1 70 ASP QB . . 5.810 4.485 4.398 4.585 . 0 0 "[ . 1 . 2]" 1
2141 1 67 ILE MG 1 71 GLY H . . 4.050 3.116 3.013 3.215 . 0 0 "[ . 1 . 2]" 1
2142 1 67 ILE MG 1 71 GLY HA2 . . 3.740 2.469 2.274 2.681 . 0 0 "[ . 1 . 2]" 1
2143 1 67 ILE MG 1 71 GLY HA3 . . 4.230 3.950 3.748 4.165 . 0 0 "[ . 1 . 2]" 1
2144 1 67 ILE MG 1 72 SER H . . 4.640 4.647 4.576 4.668 0.028 2 0 "[ . 1 . 2]" 1
2145 1 67 ILE MG 1 73 TYR H . . 4.030 4.046 4.005 4.064 0.034 9 0 "[ . 1 . 2]" 1
2146 1 67 ILE MG 1 73 TYR QD . . 5.540 5.572 5.440 5.650 0.110 17 0 "[ . 1 . 2]" 1
2147 1 67 ILE MG 1 76 ALA MB . . 3.770 3.804 3.794 3.813 0.043 7 0 "[ . 1 . 2]" 1
2148 1 67 ILE MG 1 77 PHE H . . 5.390 5.261 5.206 5.339 . 0 0 "[ . 1 . 2]" 1
2149 1 67 ILE MG 1 77 PHE HA . . 4.990 4.997 4.862 5.024 0.034 2 0 "[ . 1 . 2]" 1
2150 1 67 ILE MG 1 77 PHE QD . . 3.770 3.807 3.746 3.867 0.097 4 0 "[ . 1 . 2]" 1
2151 1 67 ILE MG 1 77 PHE QE . . 3.140 2.592 2.517 2.655 . 0 0 "[ . 1 . 2]" 1
2152 1 67 ILE MG 1 99 THR MG . . 4.720 4.578 4.447 4.699 . 0 0 "[ . 1 . 2]" 1
2153 1 68 LEU H 1 68 LEU HB2 . . 2.730 2.480 2.444 2.530 . 0 0 "[ . 1 . 2]" 1
2154 1 68 LEU H 1 68 LEU MD1 . . 4.690 3.721 3.667 3.796 . 0 0 "[ . 1 . 2]" 1
2155 1 68 LEU H 1 68 LEU MD2 . . 3.300 3.297 3.216 3.322 0.022 18 0 "[ . 1 . 2]" 1
2156 1 68 LEU H 1 69 LEU H . . 3.230 2.637 2.576 2.687 . 0 0 "[ . 1 . 2]" 1
2157 1 68 LEU H 1 70 ASP H . . 3.970 4.042 4.013 4.061 0.091 20 0 "[ . 1 . 2]" 1
2158 1 68 LEU H 1 76 ALA MB . . 5.380 5.311 5.220 5.381 0.001 5 0 "[ . 1 . 2]" 1
2159 1 68 LEU HA 1 68 LEU MD2 . . 2.650 2.135 2.091 2.206 . 0 0 "[ . 1 . 2]" 1
2160 1 68 LEU HA 1 70 ASP H . . 4.440 4.350 4.222 4.456 0.016 12 0 "[ . 1 . 2]" 1
2161 1 68 LEU HB2 1 68 LEU MD1 . . 2.850 2.379 2.359 2.398 . 0 0 "[ . 1 . 2]" 1
2162 1 68 LEU HB2 1 69 LEU H . . 3.250 2.945 2.833 3.019 . 0 0 "[ . 1 . 2]" 1
2163 1 68 LEU HB2 1 69 LEU MD2 . . 3.100 3.128 3.114 3.151 0.051 4 0 "[ . 1 . 2]" 1
2164 1 68 LEU HB2 1 70 ASP H . . 5.180 5.077 4.995 5.147 . 0 0 "[ . 1 . 2]" 1
2165 1 68 LEU MD2 1 71 GLY H . . 5.960 5.911 5.791 5.967 0.007 9 0 "[ . 1 . 2]" 1
2166 1 69 LEU H 1 69 LEU HB2 . . 3.350 2.563 2.465 2.653 . 0 0 "[ . 1 . 2]" 1
2167 1 69 LEU H 1 69 LEU HB3 . . 3.720 3.646 3.607 3.689 . 0 0 "[ . 1 . 2]" 1
2168 1 69 LEU H 1 69 LEU MD1 . . 3.830 3.664 3.615 3.731 . 0 0 "[ . 1 . 2]" 1
2169 1 69 LEU H 1 69 LEU MD2 . . 3.140 3.110 3.071 3.154 0.014 8 0 "[ . 1 . 2]" 1
2170 1 69 LEU H 1 69 LEU HG . . 3.190 2.186 2.144 2.245 . 0 0 "[ . 1 . 2]" 1
2171 1 69 LEU H 1 70 ASP H . . 3.040 2.341 2.289 2.376 . 0 0 "[ . 1 . 2]" 1
2172 1 69 LEU H 1 70 ASP HA . . 5.140 5.136 5.098 5.161 0.021 6 0 "[ . 1 . 2]" 1
2173 1 69 LEU H 1 70 ASP HB2 . . 5.170 4.933 4.792 5.068 . 0 0 "[ . 1 . 2]" 1
2174 1 69 LEU H 1 70 ASP QB . . 4.490 4.355 4.273 4.438 . 0 0 "[ . 1 . 2]" 1
2175 1 69 LEU H 1 70 ASP HB3 . . 5.170 4.849 4.714 4.993 . 0 0 "[ . 1 . 2]" 1
2176 1 69 LEU HA 1 69 LEU MD2 . . 2.400 2.287 2.237 2.354 . 0 0 "[ . 1 . 2]" 1
2177 1 69 LEU HB2 1 69 LEU MD1 . . 3.100 2.323 2.261 2.383 . 0 0 "[ . 1 . 2]" 1
2178 1 69 LEU HB2 1 70 ASP H . . 3.440 2.989 2.871 3.175 . 0 0 "[ . 1 . 2]" 1
2179 1 69 LEU HB3 1 69 LEU MD1 . . 3.340 2.385 2.353 2.418 . 0 0 "[ . 1 . 2]" 1
2180 1 69 LEU HB3 1 69 LEU MD2 . . 2.920 2.481 2.445 2.528 . 0 0 "[ . 1 . 2]" 1
2181 1 69 LEU HB3 1 70 ASP H . . 4.210 4.049 3.956 4.186 . 0 0 "[ . 1 . 2]" 1
2182 1 69 LEU MD1 1 70 ASP H . . 4.920 4.765 4.699 4.844 . 0 0 "[ . 1 . 2]" 1
2183 1 69 LEU MD2 1 70 ASP H . . 4.590 4.593 4.564 4.616 0.026 20 0 "[ . 1 . 2]" 1
2184 1 69 LEU HG 1 70 ASP H . . 4.100 4.166 4.146 4.189 0.089 14 0 "[ . 1 . 2]" 1
2185 1 70 ASP H 1 70 ASP HB2 . . 3.580 2.948 2.822 3.065 . 0 0 "[ . 1 . 2]" 1
2186 1 70 ASP H 1 70 ASP HB3 . . 3.580 2.721 2.612 2.823 . 0 0 "[ . 1 . 2]" 1
2187 1 70 ASP H 1 71 GLY H . . 3.660 2.708 2.612 2.784 . 0 0 "[ . 1 . 2]" 1
2188 1 70 ASP H 1 71 GLY HA2 . . 5.500 4.614 4.529 4.700 . 0 0 "[ . 1 . 2]" 1
2189 1 70 ASP H 1 71 GLY HA3 . . 5.020 4.905 4.790 4.985 . 0 0 "[ . 1 . 2]" 1
2190 1 70 ASP H 1 73 TYR HB2 . . 4.780 4.756 4.631 4.806 0.026 14 0 "[ . 1 . 2]" 1
2191 1 70 ASP H 1 73 TYR QD . . 4.980 4.860 4.639 5.001 0.021 17 0 "[ . 1 . 2]" 1
2192 1 70 ASP HA 1 71 GLY HA2 . . 5.450 5.321 5.305 5.341 . 0 0 "[ . 1 . 2]" 1
2193 1 70 ASP HA 1 71 GLY HA3 . . 4.580 4.611 4.602 4.622 0.042 8 0 "[ . 1 . 2]" 1
2194 1 70 ASP HA 1 72 SER H . . 4.190 4.016 3.901 4.104 . 0 0 "[ . 1 . 2]" 1
2195 1 70 ASP HA 1 73 TYR H . . 5.280 5.132 5.042 5.224 . 0 0 "[ . 1 . 2]" 1
2196 1 70 ASP QB 1 71 GLY H . . 3.510 2.225 2.093 2.359 . 0 0 "[ . 1 . 2]" 1
2197 1 70 ASP QB 1 72 SER H . . 4.060 3.220 3.107 3.319 . 0 0 "[ . 1 . 2]" 1
2198 1 70 ASP QB 1 73 TYR HB3 . . 4.880 3.205 3.108 3.318 . 0 0 "[ . 1 . 2]" 1
2199 1 70 ASP QB 1 73 TYR QE . . 5.590 4.764 4.537 4.921 . 0 0 "[ . 1 . 2]" 1
2200 1 70 ASP HB2 1 71 GLY H . . 4.030 3.714 3.610 3.829 . 0 0 "[ . 1 . 2]" 1
2201 1 70 ASP HB2 1 72 SER H . . 4.670 4.480 4.421 4.522 . 0 0 "[ . 1 . 2]" 1
2202 1 70 ASP HB2 1 73 TYR H . . 4.420 4.439 4.413 4.469 0.049 3 0 "[ . 1 . 2]" 1
2203 1 70 ASP HB3 1 71 GLY H . . 4.030 2.243 2.107 2.382 . 0 0 "[ . 1 . 2]" 1
2204 1 70 ASP HB3 1 72 SER H . . 4.670 3.301 3.174 3.416 . 0 0 "[ . 1 . 2]" 1
2205 1 70 ASP HB3 1 73 TYR H . . 4.420 2.912 2.869 2.980 . 0 0 "[ . 1 . 2]" 1
2206 1 71 GLY H 1 72 SER H . . 3.370 2.836 2.781 2.915 . 0 0 "[ . 1 . 2]" 1
2207 1 71 GLY H 1 72 SER HA . . 5.010 5.067 5.031 5.092 0.082 3 0 "[ . 1 . 2]" 1
2208 1 71 GLY H 1 73 TYR H . . 4.060 3.027 2.916 3.143 . 0 0 "[ . 1 . 2]" 1
2209 1 71 GLY H 1 73 TYR HB2 . . 5.100 3.732 3.542 3.889 . 0 0 "[ . 1 . 2]" 1
2210 1 71 GLY H 1 73 TYR HB3 . . 5.020 4.079 3.875 4.266 . 0 0 "[ . 1 . 2]" 1
2211 1 71 GLY H 1 77 PHE QE . . 5.180 4.942 4.682 5.160 . 0 0 "[ . 1 . 2]" 1
2212 1 71 GLY HA2 1 73 TYR H . . 4.250 4.129 4.008 4.267 0.017 8 0 "[ . 1 . 2]" 1
2213 1 71 GLY HA2 1 77 PHE QE . . 4.780 4.045 3.777 4.385 . 0 0 "[ . 1 . 2]" 1
2214 1 71 GLY HA3 1 73 TYR H . . 4.480 4.527 4.498 4.562 0.082 20 0 "[ . 1 . 2]" 1
2215 1 71 GLY HA3 1 77 PHE QE . . 5.630 5.248 5.000 5.573 . 0 0 "[ . 1 . 2]" 1
2216 1 72 SER H 1 72 SER HB2 . . 3.650 3.687 3.650 3.722 0.072 10 0 "[ . 1 . 2]" 1
2217 1 72 SER H 1 72 SER QB . . 3.140 2.919 2.722 3.103 . 0 0 "[ . 1 . 2]" 1
2218 1 72 SER H 1 72 SER HB3 . . 3.650 3.068 2.802 3.356 . 0 0 "[ . 1 . 2]" 1
2219 1 72 SER H 1 73 TYR H . . 3.020 2.236 2.121 2.330 . 0 0 "[ . 1 . 2]" 1
2220 1 72 SER H 1 73 TYR HB2 . . 4.010 3.858 3.763 3.922 . 0 0 "[ . 1 . 2]" 1
2221 1 72 SER H 1 74 SER H . . 5.940 5.834 5.738 5.920 . 0 0 "[ . 1 . 2]" 1
2222 1 72 SER H 1 76 ALA MB . . 6.000 5.991 5.948 6.023 0.023 3 0 "[ . 1 . 2]" 1
2223 1 72 SER H 1 103 LEU MD2 . . 4.790 4.801 4.735 4.838 0.048 17 0 "[ . 1 . 2]" 1
2224 1 72 SER HA 1 99 THR MG . . 5.490 5.073 4.701 5.326 . 0 0 "[ . 1 . 2]" 1
2225 1 72 SER HA 1 103 LEU MD1 . . 4.340 2.830 2.627 3.046 . 0 0 "[ . 1 . 2]" 1
2226 1 72 SER HA 1 103 LEU MD2 . . 3.410 2.412 2.356 2.470 . 0 0 "[ . 1 . 2]" 1
2227 1 72 SER HA 1 103 LEU HG . . 4.900 4.704 4.509 4.854 . 0 0 "[ . 1 . 2]" 1
2228 1 72 SER QB 1 73 TYR H . . 3.990 3.933 3.903 3.974 . 0 0 "[ . 1 . 2]" 1
2229 1 72 SER QB 1 103 LEU MD1 . . 3.970 3.783 3.625 3.971 0.001 9 0 "[ . 1 . 2]" 1
2230 1 72 SER QB 1 103 LEU MD2 . . 2.870 2.494 2.248 2.722 . 0 0 "[ . 1 . 2]" 1
2231 1 72 SER HB2 1 73 TYR H . . 4.780 4.345 4.221 4.443 . 0 0 "[ . 1 . 2]" 1
2232 1 72 SER HB2 1 103 LEU MD1 . . 4.680 4.013 3.792 4.286 . 0 0 "[ . 1 . 2]" 1
2233 1 72 SER HB2 1 103 LEU MD2 . . 3.660 2.589 2.283 2.927 . 0 0 "[ . 1 . 2]" 1
2234 1 72 SER HB3 1 73 TYR H . . 4.780 4.501 4.389 4.600 . 0 0 "[ . 1 . 2]" 1
2235 1 72 SER HB3 1 103 LEU MD1 . . 4.680 4.643 4.343 4.701 0.021 3 0 "[ . 1 . 2]" 1
2236 1 72 SER HB3 1 103 LEU MD2 . . 3.660 3.324 3.006 3.498 . 0 0 "[ . 1 . 2]" 1
2237 1 73 TYR H 1 73 TYR HB2 . . 3.160 2.262 2.190 2.336 . 0 0 "[ . 1 . 2]" 1
2238 1 73 TYR H 1 73 TYR HB3 . . 3.140 2.651 2.598 2.700 . 0 0 "[ . 1 . 2]" 1
2239 1 73 TYR H 1 73 TYR QD . . 4.130 4.159 4.139 4.186 0.056 19 0 "[ . 1 . 2]" 1
2240 1 73 TYR H 1 74 SER H . . 4.180 4.160 4.087 4.196 0.016 14 0 "[ . 1 . 2]" 1
2241 1 73 TYR H 1 76 ALA MB . . 4.300 4.252 4.191 4.305 0.005 20 0 "[ . 1 . 2]" 1
2242 1 73 TYR H 1 103 LEU MD1 . . 4.260 4.128 3.990 4.258 . 0 0 "[ . 1 . 2]" 1
2243 1 73 TYR H 1 103 LEU MD2 . . 4.730 4.746 4.738 4.758 0.028 10 0 "[ . 1 . 2]" 1
2244 1 73 TYR HA 1 73 TYR QD . . 4.020 2.047 1.987 2.127 . 0 0 "[ . 1 . 2]" 1
2245 1 73 TYR HA 1 73 TYR QE . . 4.200 4.259 4.246 4.273 0.073 4 0 "[ . 1 . 2]" 1
2246 1 73 TYR HA 1 74 SER H . . 2.780 2.248 2.205 2.266 . 0 0 "[ . 1 . 2]" 1
2247 1 73 TYR HA 1 75 LYS H . . 3.940 3.807 3.728 3.880 . 0 0 "[ . 1 . 2]" 1
2248 1 73 TYR HA 1 76 ALA H . . 4.420 4.153 4.073 4.268 . 0 0 "[ . 1 . 2]" 1
2249 1 73 TYR HA 1 77 PHE H . . 5.790 5.693 5.610 5.772 . 0 0 "[ . 1 . 2]" 1
2250 1 73 TYR HB2 1 74 SER H . . 4.870 4.601 4.571 4.626 . 0 0 "[ . 1 . 2]" 1
2251 1 73 TYR HB2 1 76 ALA H . . 4.470 4.510 4.486 4.529 0.059 10 0 "[ . 1 . 2]" 1
2252 1 73 TYR HB2 1 76 ALA MB . . 4.200 3.535 3.484 3.600 . 0 0 "[ . 1 . 2]" 1
2253 1 73 TYR HB3 1 74 SER H . . 4.350 4.408 4.400 4.420 0.070 18 0 "[ . 1 . 2]" 1
2254 1 73 TYR HB3 1 76 ALA H . . 4.080 3.202 3.162 3.243 . 0 0 "[ . 1 . 2]" 1
2255 1 73 TYR HB3 1 103 LEU MD1 . . 5.720 5.126 5.040 5.190 . 0 0 "[ . 1 . 2]" 1
2256 1 73 TYR QD 1 74 SER H . . 3.470 3.005 2.919 3.071 . 0 0 "[ . 1 . 2]" 1
2257 1 73 TYR QD 1 75 LYS H . . 4.490 2.730 2.570 2.888 . 0 0 "[ . 1 . 2]" 1
2258 1 73 TYR QD 1 75 LYS HB3 . . 4.720 4.501 4.222 4.726 0.006 19 0 "[ . 1 . 2]" 1
2259 1 73 TYR QD 1 76 ALA MB . . 3.700 2.626 2.459 2.844 . 0 0 "[ . 1 . 2]" 1
2260 1 73 TYR QE 1 74 SER H . . 5.150 5.113 4.996 5.171 0.021 1 0 "[ . 1 . 2]" 1
2261 1 73 TYR QE 1 75 LYS H . . 4.010 3.843 3.738 4.011 0.001 15 0 "[ . 1 . 2]" 1
2262 1 73 TYR QE 1 75 LYS HB2 . . 3.180 2.492 2.340 2.668 . 0 0 "[ . 1 . 2]" 1
2263 1 73 TYR QE 1 75 LYS HB3 . . 4.880 3.813 3.624 4.022 . 0 0 "[ . 1 . 2]" 1
2264 1 73 TYR QE 1 75 LYS HD2 . . 3.910 2.405 2.215 2.740 . 0 0 "[ . 1 . 2]" 1
2265 1 73 TYR QE 1 75 LYS QE . . 5.260 4.428 4.280 4.856 . 0 0 "[ . 1 . 2]" 1
2266 1 73 TYR QE 1 76 ALA H . . 4.120 4.110 4.010 4.153 0.033 17 0 "[ . 1 . 2]" 1
2267 1 73 TYR QE 1 76 ALA MB . . 3.890 3.625 3.508 3.855 . 0 0 "[ . 1 . 2]" 1
2268 1 73 TYR QE 2 9 ASP HB2 . . 4.710 4.572 4.386 4.722 0.012 15 0 "[ . 1 . 2]" 1
2269 1 73 TYR QE 2 9 ASP HB3 . . 6.000 5.265 4.638 5.495 . 0 0 "[ . 1 . 2]" 1
2270 1 74 SER H 1 74 SER HB2 . . 3.840 3.606 3.588 3.627 . 0 0 "[ . 1 . 2]" 1
2271 1 74 SER H 1 74 SER HB3 . . 4.080 2.380 2.345 2.431 . 0 0 "[ . 1 . 2]" 1
2272 1 74 SER H 1 75 LYS H . . 3.580 2.832 2.709 2.913 . 0 0 "[ . 1 . 2]" 1
2273 1 74 SER H 1 75 LYS HB2 . . 4.800 4.718 4.542 4.804 0.004 10 0 "[ . 1 . 2]" 1
2274 1 74 SER H 1 75 LYS HD2 . . 5.860 5.570 5.204 5.865 0.005 16 0 "[ . 1 . 2]" 1
2275 1 74 SER H 1 76 ALA H . . 4.600 4.337 4.264 4.437 . 0 0 "[ . 1 . 2]" 1
2276 1 74 SER H 1 76 ALA MB . . 5.080 5.026 4.961 5.084 0.004 17 0 "[ . 1 . 2]" 1
2277 1 74 SER H 1 77 PHE H . . 5.180 5.107 5.025 5.183 0.003 5 0 "[ . 1 . 2]" 1
2278 1 74 SER H 1 103 LEU HB2 . . 4.560 4.510 4.326 4.582 0.022 20 0 "[ . 1 . 2]" 1
2279 1 74 SER H 1 103 LEU HB3 . . 4.430 3.939 3.725 4.126 . 0 0 "[ . 1 . 2]" 1
2280 1 74 SER H 1 103 LEU MD1 . . 3.510 2.868 2.724 2.992 . 0 0 "[ . 1 . 2]" 1
2281 1 74 SER H 1 103 LEU MD2 . . 4.240 4.070 3.867 4.161 . 0 0 "[ . 1 . 2]" 1
2282 1 74 SER HA 1 75 LYS HB2 . . 5.620 5.614 5.553 5.635 0.015 16 0 "[ . 1 . 2]" 1
2283 1 74 SER HA 1 77 PHE HB2 . . 4.910 3.006 2.885 3.129 . 0 0 "[ . 1 . 2]" 1
2284 1 74 SER HA 1 77 PHE HB3 . . 4.820 4.674 4.558 4.801 . 0 0 "[ . 1 . 2]" 1
2285 1 74 SER HA 1 77 PHE QD . . 4.230 2.519 2.270 2.673 . 0 0 "[ . 1 . 2]" 1
2286 1 74 SER HA 1 100 VAL HA . . 4.570 3.204 3.130 3.299 . 0 0 "[ . 1 . 2]" 1
2287 1 74 SER HA 1 100 VAL MG1 . . 3.990 3.506 3.413 3.604 . 0 0 "[ . 1 . 2]" 1
2288 1 74 SER HA 1 100 VAL MG2 . . 4.090 3.516 3.395 3.622 . 0 0 "[ . 1 . 2]" 1
2289 1 74 SER HA 1 103 LEU HB2 . . 3.920 3.603 3.445 3.751 . 0 0 "[ . 1 . 2]" 1
2290 1 74 SER HA 1 103 LEU HB3 . . 4.800 4.199 4.051 4.405 . 0 0 "[ . 1 . 2]" 1
2291 1 74 SER HA 1 103 LEU MD1 . . 3.850 2.166 2.073 2.253 . 0 0 "[ . 1 . 2]" 1
2292 1 74 SER HB2 1 75 LYS H . . 4.250 3.900 3.828 3.992 . 0 0 "[ . 1 . 2]" 1
2293 1 74 SER HB2 1 75 LYS QE . . 6.000 6.015 5.778 6.047 0.047 8 0 "[ . 1 . 2]" 1
2294 1 74 SER HB2 1 77 PHE HB2 . . 4.700 4.451 4.295 4.560 . 0 0 "[ . 1 . 2]" 1
2295 1 74 SER HB2 1 77 PHE HB3 . . 6.000 5.906 5.734 6.003 0.003 6 0 "[ . 1 . 2]" 1
2296 1 74 SER HB2 1 77 PHE QD . . 4.830 4.716 4.408 4.839 0.009 3 0 "[ . 1 . 2]" 1
2297 1 74 SER HB2 1 99 THR MG . . 4.710 4.783 4.755 4.809 0.099 14 0 "[ . 1 . 2]" 1
2298 1 74 SER HB2 1 100 VAL HA . . 4.030 2.538 2.371 2.696 . 0 0 "[ . 1 . 2]" 1
2299 1 74 SER HB2 1 100 VAL MG1 . . 3.780 2.129 2.084 2.182 . 0 0 "[ . 1 . 2]" 1
2300 1 74 SER HB2 1 100 VAL MG2 . . 3.750 3.533 3.407 3.647 . 0 0 "[ . 1 . 2]" 1
2301 1 74 SER HB2 1 103 LEU HB2 . . 4.220 2.575 2.400 2.670 . 0 0 "[ . 1 . 2]" 1
2302 1 74 SER HB2 1 103 LEU HB3 . . 4.150 3.494 3.333 3.628 . 0 0 "[ . 1 . 2]" 1
2303 1 74 SER HB2 1 103 LEU MD1 . . 3.430 2.926 2.755 3.110 . 0 0 "[ . 1 . 2]" 1
2304 1 74 SER HB2 1 103 LEU HG . . 5.580 4.836 4.687 4.932 . 0 0 "[ . 1 . 2]" 1
2305 1 74 SER HB2 1 104 GLU HB2 . . 4.580 3.941 3.788 4.084 . 0 0 "[ . 1 . 2]" 1
2306 1 74 SER HB2 1 110 ALA MB . . 5.700 5.243 5.177 5.319 . 0 0 "[ . 1 . 2]" 1
2307 1 74 SER HB3 1 75 LYS H . . 3.820 3.837 3.791 3.873 0.053 19 0 "[ . 1 . 2]" 1
2308 1 74 SER HB3 1 77 PHE QD . . 5.200 4.848 4.598 5.041 . 0 0 "[ . 1 . 2]" 1
2309 1 74 SER HB3 1 100 VAL HA . . 4.140 3.858 3.719 3.978 . 0 0 "[ . 1 . 2]" 1
2310 1 74 SER HB3 1 103 LEU H . . 4.780 4.683 4.499 4.787 0.007 8 0 "[ . 1 . 2]" 1
2311 1 74 SER HB3 1 103 LEU HB2 . . 3.080 2.361 2.214 2.461 . 0 0 "[ . 1 . 2]" 1
2312 1 74 SER HB3 1 103 LEU MD1 . . 3.550 2.430 2.215 2.580 . 0 0 "[ . 1 . 2]" 1
2313 1 74 SER HB3 1 104 GLU HB2 . . 4.780 4.707 4.534 4.805 0.025 19 0 "[ . 1 . 2]" 1
2314 1 74 SER HB3 1 104 GLU HG2 . . 4.640 4.530 4.167 4.654 0.014 1 0 "[ . 1 . 2]" 1
2315 1 74 SER HB3 1 104 GLU HG3 . . 4.520 2.983 2.739 3.195 . 0 0 "[ . 1 . 2]" 1
2316 1 75 LYS H 1 75 LYS HB2 . . 3.850 2.265 2.219 2.295 . 0 0 "[ . 1 . 2]" 1
2317 1 75 LYS H 1 75 LYS HB3 . . 3.510 3.530 3.514 3.542 0.032 6 0 "[ . 1 . 2]" 1
2318 1 75 LYS H 1 75 LYS HD2 . . 3.950 3.532 3.306 3.733 . 0 0 "[ . 1 . 2]" 1
2319 1 75 LYS H 1 75 LYS QE . . 4.350 4.112 3.893 4.392 0.042 1 0 "[ . 1 . 2]" 1
2320 1 75 LYS H 1 75 LYS HG2 . . 5.140 3.940 3.827 4.040 . 0 0 "[ . 1 . 2]" 1
2321 1 75 LYS H 1 75 LYS HG3 . . 3.270 2.647 2.528 2.787 . 0 0 "[ . 1 . 2]" 1
2322 1 75 LYS H 1 76 ALA H . . 3.380 2.889 2.859 2.934 . 0 0 "[ . 1 . 2]" 1
2323 1 75 LYS H 1 76 ALA MB . . 4.480 4.507 4.496 4.523 0.043 1 0 "[ . 1 . 2]" 1
2324 1 75 LYS H 1 77 PHE H . . 4.220 4.227 4.194 4.249 0.029 5 0 "[ . 1 . 2]" 1
2325 1 75 LYS H 1 100 VAL MG1 . . 4.450 4.392 4.266 4.453 0.003 9 0 "[ . 1 . 2]" 1
2326 1 75 LYS H 1 103 LEU MD1 . . 4.890 4.747 4.674 4.847 . 0 0 "[ . 1 . 2]" 1
2327 1 75 LYS H 2 5 ILE MG . . 4.930 4.549 4.472 4.629 . 0 0 "[ . 1 . 2]" 1
2328 1 75 LYS HA 1 75 LYS HG3 . . 4.140 2.510 2.217 2.654 . 0 0 "[ . 1 . 2]" 1
2329 1 75 LYS HA 1 77 PHE H . . 4.270 4.088 3.978 4.200 . 0 0 "[ . 1 . 2]" 1
2330 1 75 LYS HA 1 78 ALA H . . 3.560 3.306 3.115 3.461 . 0 0 "[ . 1 . 2]" 1
2331 1 75 LYS HA 2 5 ILE HA . . 4.350 4.209 4.094 4.331 . 0 0 "[ . 1 . 2]" 1
2332 1 75 LYS HA 2 5 ILE MG . . 2.810 2.323 2.167 2.446 . 0 0 "[ . 1 . 2]" 1
2333 1 75 LYS HB2 1 75 LYS HD2 . . 2.930 2.350 2.241 2.425 . 0 0 "[ . 1 . 2]" 1
2334 1 75 LYS HB2 1 75 LYS QE . . 4.570 3.888 3.813 4.071 . 0 0 "[ . 1 . 2]" 1
2335 1 75 LYS HB2 1 76 ALA H . . 3.700 2.795 2.701 2.945 . 0 0 "[ . 1 . 2]" 1
2336 1 75 LYS HB2 1 77 PHE H . . 5.300 5.064 5.019 5.133 . 0 0 "[ . 1 . 2]" 1
2337 1 75 LYS HB2 2 5 ILE HA . . 5.000 4.502 4.249 4.726 . 0 0 "[ . 1 . 2]" 1
2338 1 75 LYS HB2 2 5 ILE MG . . 4.320 4.279 4.122 4.348 0.028 16 0 "[ . 1 . 2]" 1
2339 1 75 LYS HB3 1 75 LYS HD2 . . 3.700 3.260 3.111 3.393 . 0 0 "[ . 1 . 2]" 1
2340 1 75 LYS HB3 1 75 LYS QE . . 4.720 4.171 4.115 4.298 . 0 0 "[ . 1 . 2]" 1
2341 1 75 LYS HB3 1 76 ALA H . . 3.490 3.428 3.293 3.518 0.028 8 0 "[ . 1 . 2]" 1
2342 1 75 LYS HB3 1 77 PHE H . . 5.200 5.255 5.243 5.267 0.067 12 0 "[ . 1 . 2]" 1
2343 1 75 LYS HB3 2 5 ILE HA . . 4.700 3.172 2.900 3.412 . 0 0 "[ . 1 . 2]" 1
2344 1 75 LYS HD2 2 5 ILE HA . . 4.760 4.404 4.091 4.693 . 0 0 "[ . 1 . 2]" 1
2345 1 75 LYS HD2 2 5 ILE MG . . 4.640 4.636 4.490 4.673 0.033 19 0 "[ . 1 . 2]" 1
2346 1 75 LYS HD3 2 5 ILE HA . . 3.270 2.922 2.564 3.284 0.014 7 0 "[ . 1 . 2]" 1
2347 1 75 LYS HD3 2 5 ILE MG . . 4.040 3.992 3.820 4.069 0.029 15 0 "[ . 1 . 2]" 1
2348 1 75 LYS QE 2 3 PRO HA . . 3.830 3.197 2.585 3.685 . 0 0 "[ . 1 . 2]" 1
2349 1 75 LYS QE 2 3 PRO HB2 . . 4.380 3.620 2.857 4.400 0.020 18 0 "[ . 1 . 2]" 1
2350 1 75 LYS QE 2 3 PRO HB3 . . 4.380 4.262 3.750 4.426 0.046 17 0 "[ . 1 . 2]" 1
2351 1 75 LYS QE 2 4 THR H . . 4.050 3.509 2.545 4.073 0.023 11 0 "[ . 1 . 2]" 1
2352 1 75 LYS QE 2 4 THR HA . . 4.230 3.730 3.396 3.978 . 0 0 "[ . 1 . 2]" 1
2353 1 75 LYS QE 2 4 THR HB . . 5.220 5.201 4.912 5.282 0.062 7 0 "[ . 1 . 2]" 1
2354 1 75 LYS QE 2 4 THR MG . . 5.130 5.004 4.743 5.162 0.032 16 0 "[ . 1 . 2]" 1
2355 1 75 LYS QE 2 5 ILE HA . . 3.840 3.454 3.128 3.852 0.012 1 0 "[ . 1 . 2]" 1
2356 1 75 LYS QE 2 5 ILE MG . . 4.580 3.324 2.940 3.715 . 0 0 "[ . 1 . 2]" 1
2357 1 75 LYS HG2 2 5 ILE HA . . 3.370 2.161 2.127 2.211 . 0 0 "[ . 1 . 2]" 1
2358 1 75 LYS HG2 2 5 ILE HB . . 4.600 3.017 2.903 3.192 . 0 0 "[ . 1 . 2]" 1
2359 1 75 LYS HG2 2 5 ILE MD . . 4.700 4.667 4.557 4.728 0.028 8 0 "[ . 1 . 2]" 1
2360 1 75 LYS HG2 2 5 ILE MG . . 3.770 2.034 1.987 2.095 . 0 0 "[ . 1 . 2]" 1
2361 1 75 LYS HG3 1 100 VAL MG1 . . 4.700 4.564 4.235 4.710 0.010 15 0 "[ . 1 . 2]" 1
2362 1 75 LYS HG3 2 5 ILE HA . . 3.830 3.884 3.861 3.900 0.070 19 0 "[ . 1 . 2]" 1
2363 1 75 LYS HG3 2 5 ILE MG . . 4.020 2.916 2.607 3.135 . 0 0 "[ . 1 . 2]" 1
2364 1 76 ALA H 1 76 ALA MB . . 2.910 2.180 2.158 2.195 . 0 0 "[ . 1 . 2]" 1
2365 1 76 ALA H 1 77 PHE H . . 2.970 2.764 2.723 2.820 . 0 0 "[ . 1 . 2]" 1
2366 1 76 ALA H 1 77 PHE HB2 . . 4.960 4.925 4.846 4.959 . 0 0 "[ . 1 . 2]" 1
2367 1 76 ALA H 1 78 ALA H . . 4.540 4.531 4.450 4.553 0.013 12 0 "[ . 1 . 2]" 1
2368 1 76 ALA H 1 79 ARG H . . 5.090 4.894 4.852 4.936 . 0 0 "[ . 1 . 2]" 1
2369 1 76 ALA H 1 79 ARG HD2 . . 5.090 4.068 3.925 4.216 . 0 0 "[ . 1 . 2]" 1
2370 1 76 ALA H 1 79 ARG HG3 . . 4.920 4.919 4.867 4.939 0.019 1 0 "[ . 1 . 2]" 1
2371 1 76 ALA H 1 103 LEU MD1 . . 5.660 5.471 5.400 5.529 . 0 0 "[ . 1 . 2]" 1
2372 1 76 ALA HA 1 77 PHE H . . 3.530 3.532 3.524 3.537 0.007 17 0 "[ . 1 . 2]" 1
2373 1 76 ALA HA 1 79 ARG H . . 4.150 3.739 3.648 3.782 . 0 0 "[ . 1 . 2]" 1
2374 1 76 ALA HA 1 79 ARG HB2 . . 3.870 2.639 2.582 2.716 . 0 0 "[ . 1 . 2]" 1
2375 1 76 ALA HA 1 79 ARG HB3 . . 4.720 4.198 4.142 4.282 . 0 0 "[ . 1 . 2]" 1
2376 1 76 ALA HA 1 79 ARG HD2 . . 4.040 2.342 2.258 2.428 . 0 0 "[ . 1 . 2]" 1
2377 1 76 ALA HA 1 79 ARG HD3 . . 3.880 3.778 3.640 3.882 0.002 4 0 "[ . 1 . 2]" 1
2378 1 76 ALA HA 1 79 ARG HG3 . . 4.360 3.716 3.680 3.741 . 0 0 "[ . 1 . 2]" 1
2379 1 76 ALA MB 1 77 PHE H . . 3.250 2.834 2.780 2.879 . 0 0 "[ . 1 . 2]" 1
2380 1 76 ALA MB 1 77 PHE HA . . 4.530 4.099 4.051 4.144 . 0 0 "[ . 1 . 2]" 1
2381 1 76 ALA MB 1 79 ARG H . . 5.300 4.914 4.825 4.950 . 0 0 "[ . 1 . 2]" 1
2382 1 76 ALA MB 1 79 ARG HG3 . . 5.070 5.082 5.071 5.098 0.028 7 0 "[ . 1 . 2]" 1
2383 1 76 ALA MB 1 80 ARG H . . 5.640 4.653 4.599 4.735 . 0 0 "[ . 1 . 2]" 1
2384 1 76 ALA MB 1 80 ARG HD3 . . 6.000 5.198 5.110 5.349 . 0 0 "[ . 1 . 2]" 1
2385 1 77 PHE H 1 77 PHE HB2 . . 3.530 2.377 2.338 2.414 . 0 0 "[ . 1 . 2]" 1
2386 1 77 PHE H 1 77 PHE HB3 . . 3.640 3.616 3.598 3.630 . 0 0 "[ . 1 . 2]" 1
2387 1 77 PHE H 1 77 PHE QE . . 4.940 4.879 4.771 4.942 0.002 17 0 "[ . 1 . 2]" 1
2388 1 77 PHE H 1 78 ALA H . . 3.170 2.668 2.629 2.729 . 0 0 "[ . 1 . 2]" 1
2389 1 77 PHE H 1 78 ALA MB . . 4.360 4.203 4.145 4.270 . 0 0 "[ . 1 . 2]" 1
2390 1 77 PHE H 1 79 ARG H . . 4.370 4.080 4.005 4.153 . 0 0 "[ . 1 . 2]" 1
2391 1 77 PHE H 1 80 ARG QB . . 5.390 4.867 4.772 4.949 . 0 0 "[ . 1 . 2]" 1
2392 1 77 PHE H 1 99 THR MG . . 5.450 5.141 4.982 5.351 . 0 0 "[ . 1 . 2]" 1
2393 1 77 PHE H 1 100 VAL MG1 . . 5.210 4.897 4.801 4.994 . 0 0 "[ . 1 . 2]" 1
2394 1 77 PHE H 1 100 VAL MG2 . . 4.100 3.690 3.617 3.763 . 0 0 "[ . 1 . 2]" 1
2395 1 77 PHE H 1 103 LEU MD1 . . 5.700 4.675 4.555 4.766 . 0 0 "[ . 1 . 2]" 1
2396 1 77 PHE HA 1 77 PHE QD . . 3.860 2.707 2.621 2.796 . 0 0 "[ . 1 . 2]" 1
2397 1 77 PHE HA 1 77 PHE QE . . 5.190 4.484 4.431 4.567 . 0 0 "[ . 1 . 2]" 1
2398 1 77 PHE HA 1 78 ALA MB . . 5.050 5.045 5.021 5.057 0.007 2 0 "[ . 1 . 2]" 1
2399 1 77 PHE HA 1 79 ARG HB2 . . 5.410 5.169 5.110 5.248 . 0 0 "[ . 1 . 2]" 1
2400 1 77 PHE HA 1 80 ARG H . . 4.020 3.512 3.408 3.591 . 0 0 "[ . 1 . 2]" 1
2401 1 77 PHE HA 1 80 ARG QB . . 4.380 2.763 2.646 2.848 . 0 0 "[ . 1 . 2]" 1
2402 1 77 PHE HA 1 80 ARG HD3 . . 4.930 4.731 4.592 4.859 . 0 0 "[ . 1 . 2]" 1
2403 1 77 PHE HA 1 80 ARG HE . . 4.920 3.687 3.530 3.838 . 0 0 "[ . 1 . 2]" 1
2404 1 77 PHE HA 1 81 GLY H . . 4.710 4.028 3.904 4.126 . 0 0 "[ . 1 . 2]" 1
2405 1 77 PHE HA 1 96 ASP HA . . 4.740 4.598 4.394 4.757 0.017 3 0 "[ . 1 . 2]" 1
2406 1 77 PHE HA 1 96 ASP HB2 . . 4.690 4.684 4.544 4.719 0.029 11 0 "[ . 1 . 2]" 1
2407 1 77 PHE HA 1 96 ASP HB3 . . 4.220 3.052 2.901 3.096 . 0 0 "[ . 1 . 2]" 1
2408 1 77 PHE HB2 1 78 ALA H . . 3.690 2.680 2.615 2.743 . 0 0 "[ . 1 . 2]" 1
2409 1 77 PHE HB2 1 99 THR HB . . 4.990 3.927 3.667 4.151 . 0 0 "[ . 1 . 2]" 1
2410 1 77 PHE HB2 1 99 THR MG . . 4.170 3.458 3.290 3.677 . 0 0 "[ . 1 . 2]" 1
2411 1 77 PHE HB2 1 100 VAL H . . 4.400 4.048 3.955 4.194 . 0 0 "[ . 1 . 2]" 1
2412 1 77 PHE HB2 1 100 VAL MG2 . . 3.400 2.270 2.201 2.355 . 0 0 "[ . 1 . 2]" 1
2413 1 77 PHE HB2 1 103 LEU MD1 . . 4.610 3.755 3.567 3.891 . 0 0 "[ . 1 . 2]" 1
2414 1 77 PHE HB3 1 78 ALA H . . 3.860 3.359 3.296 3.429 . 0 0 "[ . 1 . 2]" 1
2415 1 77 PHE HB3 1 96 ASP HA . . 4.060 3.346 3.113 3.544 . 0 0 "[ . 1 . 2]" 1
2416 1 77 PHE HB3 1 99 THR MG . . 4.170 3.579 3.435 3.723 . 0 0 "[ . 1 . 2]" 1
2417 1 77 PHE HB3 1 100 VAL MG2 . . 3.480 2.461 2.393 2.547 . 0 0 "[ . 1 . 2]" 1
2418 1 77 PHE HB3 1 103 LEU MD1 . . 6.000 4.743 4.556 4.913 . 0 0 "[ . 1 . 2]" 1
2419 1 77 PHE QD 1 80 ARG HE . . 4.940 3.627 3.420 3.785 . 0 0 "[ . 1 . 2]" 1
2420 1 77 PHE QD 1 96 ASP H . . 5.230 5.237 5.149 5.253 0.023 17 0 "[ . 1 . 2]" 1
2421 1 77 PHE QD 1 96 ASP HA . . 3.520 2.574 2.432 2.661 . 0 0 "[ . 1 . 2]" 1
2422 1 77 PHE QD 1 99 THR H . . 5.320 5.102 4.978 5.266 . 0 0 "[ . 1 . 2]" 1
2423 1 77 PHE QD 1 99 THR HB . . 3.760 3.312 3.090 3.473 . 0 0 "[ . 1 . 2]" 1
2424 1 77 PHE QD 1 99 THR MG . . 3.450 2.969 2.848 3.104 . 0 0 "[ . 1 . 2]" 1
2425 1 77 PHE QD 1 100 VAL HA . . 4.870 4.454 4.327 4.585 . 0 0 "[ . 1 . 2]" 1
2426 1 77 PHE QD 1 100 VAL MG2 . . 4.430 3.833 3.766 3.899 . 0 0 "[ . 1 . 2]" 1
2427 1 77 PHE QD 1 103 LEU MD1 . . 3.920 2.780 2.664 2.947 . 0 0 "[ . 1 . 2]" 1
2428 1 77 PHE QD 1 103 LEU MD2 . . 5.400 4.919 4.744 5.089 . 0 0 "[ . 1 . 2]" 1
2429 1 77 PHE QE 1 80 ARG HE . . 5.160 4.631 4.468 4.817 . 0 0 "[ . 1 . 2]" 1
2430 1 77 PHE QE 1 96 ASP HA . . 4.200 4.138 3.965 4.208 0.008 2 0 "[ . 1 . 2]" 1
2431 1 77 PHE QE 1 99 THR MG . . 3.310 2.991 2.911 3.095 . 0 0 "[ . 1 . 2]" 1
2432 1 77 PHE QE 1 103 LEU MD1 . . 4.030 2.970 2.715 3.211 . 0 0 "[ . 1 . 2]" 1
2433 1 77 PHE QE 1 103 LEU MD2 . . 4.810 4.478 4.256 4.763 . 0 0 "[ . 1 . 2]" 1
2434 1 78 ALA H 1 78 ALA MB . . 2.870 2.150 2.114 2.204 . 0 0 "[ . 1 . 2]" 1
2435 1 78 ALA H 1 79 ARG H . . 3.510 2.801 2.779 2.826 . 0 0 "[ . 1 . 2]" 1
2436 1 78 ALA H 1 100 VAL HA . . 4.930 4.919 4.883 4.941 0.011 17 0 "[ . 1 . 2]" 1
2437 1 78 ALA H 1 100 VAL HB . . 5.150 5.080 5.027 5.137 . 0 0 "[ . 1 . 2]" 1
2438 1 78 ALA H 1 100 VAL MG1 . . 3.990 3.614 3.542 3.674 . 0 0 "[ . 1 . 2]" 1
2439 1 78 ALA H 1 100 VAL MG2 . . 3.170 2.211 2.156 2.252 . 0 0 "[ . 1 . 2]" 1
2440 1 78 ALA H 1 103 LEU MD1 . . 5.770 5.531 5.355 5.671 . 0 0 "[ . 1 . 2]" 1
2441 1 78 ALA H 2 5 ILE MG . . 3.980 3.980 3.909 4.010 0.030 11 0 "[ . 1 . 2]" 1
2442 1 78 ALA HA 1 81 GLY H . . 3.620 3.494 3.412 3.628 0.008 18 0 "[ . 1 . 2]" 1
2443 1 78 ALA HA 1 81 GLY HA3 . . 4.400 3.805 3.728 3.905 . 0 0 "[ . 1 . 2]" 1
2444 1 78 ALA HA 1 97 PHE HA . . 4.360 3.502 3.311 3.639 . 0 0 "[ . 1 . 2]" 1
2445 1 78 ALA HA 1 97 PHE QD . . 3.860 2.665 2.573 2.771 . 0 0 "[ . 1 . 2]" 1
2446 1 78 ALA HA 1 97 PHE QE . . 3.880 2.599 2.449 2.794 . 0 0 "[ . 1 . 2]" 1
2447 1 78 ALA HA 1 100 VAL HB . . 4.850 4.879 4.864 4.896 0.046 18 0 "[ . 1 . 2]" 1
2448 1 78 ALA HA 1 100 VAL MG1 . . 4.690 4.249 4.192 4.291 . 0 0 "[ . 1 . 2]" 1
2449 1 78 ALA HA 1 100 VAL MG2 . . 3.260 2.501 2.448 2.537 . 0 0 "[ . 1 . 2]" 1
2450 1 78 ALA HA 2 5 ILE MD . . 4.080 3.928 3.840 4.025 . 0 0 "[ . 1 . 2]" 1
2451 1 78 ALA HA 2 5 ILE MG . . 4.620 4.497 4.300 4.573 . 0 0 "[ . 1 . 2]" 1
2452 1 78 ALA MB 1 79 ARG H . . 3.210 2.449 2.287 2.624 . 0 0 "[ . 1 . 2]" 1
2453 1 78 ALA MB 1 79 ARG HG3 . . 3.620 3.309 3.120 3.558 . 0 0 "[ . 1 . 2]" 1
2454 1 78 ALA MB 1 81 GLY H . . 4.850 4.672 4.607 4.754 . 0 0 "[ . 1 . 2]" 1
2455 1 78 ALA MB 1 97 PHE HA . . 4.320 4.113 4.037 4.236 . 0 0 "[ . 1 . 2]" 1
2456 1 78 ALA MB 1 97 PHE QD . . 3.690 3.095 2.966 3.215 . 0 0 "[ . 1 . 2]" 1
2457 1 78 ALA MB 1 97 PHE QE . . 3.870 2.724 2.576 2.870 . 0 0 "[ . 1 . 2]" 1
2458 1 78 ALA MB 1 100 VAL HA . . 4.950 4.843 4.780 4.889 . 0 0 "[ . 1 . 2]" 1
2459 1 78 ALA MB 1 100 VAL HB . . 4.020 3.840 3.760 3.953 . 0 0 "[ . 1 . 2]" 1
2460 1 78 ALA MB 1 100 VAL MG1 . . 3.130 2.432 2.361 2.499 . 0 0 "[ . 1 . 2]" 1
2461 1 78 ALA MB 1 100 VAL MG2 . . 2.840 2.033 2.008 2.074 . 0 0 "[ . 1 . 2]" 1
2462 1 78 ALA MB 1 107 ASN HD22 . . 5.040 4.088 3.886 4.447 . 0 0 "[ . 1 . 2]" 1
2463 1 78 ALA MB 1 109 GLN HE21 . . 5.330 5.309 5.151 5.353 0.023 10 0 "[ . 1 . 2]" 1
2464 1 78 ALA MB 1 109 GLN HE22 . . 5.320 5.349 5.331 5.365 0.045 13 0 "[ . 1 . 2]" 1
2465 1 78 ALA MB 1 110 ALA MB . . 3.750 3.612 3.404 3.759 0.009 2 0 "[ . 1 . 2]" 1
2466 1 78 ALA MB 2 5 ILE HB . . 3.880 3.373 3.123 3.570 . 0 0 "[ . 1 . 2]" 1
2467 1 78 ALA MB 2 5 ILE MD . . 2.770 2.114 2.028 2.310 . 0 0 "[ . 1 . 2]" 1
2468 1 78 ALA MB 2 5 ILE MG . . 2.460 1.915 1.871 1.948 . 0 0 "[ . 1 . 2]" 1
2469 1 79 ARG H 1 79 ARG HD2 . . 4.400 3.780 3.693 3.838 . 0 0 "[ . 1 . 2]" 1
2470 1 79 ARG H 1 79 ARG HD3 . . 4.660 4.617 4.564 4.667 0.007 3 0 "[ . 1 . 2]" 1
2471 1 79 ARG H 1 79 ARG HG2 . . 3.820 3.461 3.406 3.519 . 0 0 "[ . 1 . 2]" 1
2472 1 79 ARG H 1 79 ARG HG3 . . 3.510 2.163 2.117 2.210 . 0 0 "[ . 1 . 2]" 1
2473 1 79 ARG H 1 100 VAL MG2 . . 4.420 4.433 4.407 4.453 0.033 8 0 "[ . 1 . 2]" 1
2474 1 79 ARG H 2 5 ILE MD . . 4.170 2.838 2.758 2.931 . 0 0 "[ . 1 . 2]" 1
2475 1 79 ARG H 2 5 ILE HG13 . . 4.730 4.756 4.740 4.773 0.043 1 0 "[ . 1 . 2]" 1
2476 1 79 ARG H 2 5 ILE MG . . 3.650 3.538 3.394 3.666 0.016 2 0 "[ . 1 . 2]" 1
2477 1 79 ARG HA 1 80 ARG HA . . 5.620 4.810 4.782 4.835 . 0 0 "[ . 1 . 2]" 1
2478 1 79 ARG HA 1 82 THR H . . 3.860 3.475 3.388 3.590 . 0 0 "[ . 1 . 2]" 1
2479 1 79 ARG HA 2 5 ILE MD . . 3.290 2.481 2.351 2.556 . 0 0 "[ . 1 . 2]" 1
2480 1 79 ARG HA 2 5 ILE HG12 . . 5.080 5.026 4.899 5.106 0.026 7 0 "[ . 1 . 2]" 1
2481 1 79 ARG HB2 1 81 GLY H . . 5.190 5.124 5.065 5.190 0.000 10 0 "[ . 1 . 2]" 1
2482 1 79 ARG HB3 1 80 ARG H . . 3.480 3.492 3.481 3.501 0.021 7 0 "[ . 1 . 2]" 1
2483 1 79 ARG HD2 2 5 ILE MD . . 5.100 4.825 4.656 4.977 . 0 0 "[ . 1 . 2]" 1
2484 1 79 ARG HD2 2 5 ILE MG . . 5.150 4.887 4.747 4.970 . 0 0 "[ . 1 . 2]" 1
2485 1 79 ARG HD3 2 5 ILE MD . . 4.920 4.927 4.857 4.956 0.036 18 0 "[ . 1 . 2]" 1
2486 1 79 ARG HD3 2 5 ILE MG . . 5.540 5.559 5.504 5.588 0.048 2 0 "[ . 1 . 2]" 1
2487 1 79 ARG HG2 2 5 ILE HA . . 5.060 4.459 4.319 4.593 . 0 0 "[ . 1 . 2]" 1
2488 1 79 ARG HG2 2 5 ILE MD . . 3.940 2.808 2.753 2.847 . 0 0 "[ . 1 . 2]" 1
2489 1 79 ARG HG2 2 5 ILE MG . . 3.970 4.016 3.998 4.032 0.062 18 0 "[ . 1 . 2]" 1
2490 1 79 ARG HG3 1 80 ARG H . . 4.280 4.336 4.313 4.350 0.070 14 0 "[ . 1 . 2]" 1
2491 1 79 ARG HG3 2 5 ILE MD . . 2.970 2.666 2.494 2.844 . 0 0 "[ . 1 . 2]" 1
2492 1 79 ARG HG3 2 5 ILE MG . . 3.880 3.194 3.127 3.237 . 0 0 "[ . 1 . 2]" 1
2493 1 80 ARG H 1 80 ARG QB . . 3.590 2.206 2.186 2.222 . 0 0 "[ . 1 . 2]" 1
2494 1 80 ARG H 1 80 ARG HE . . 4.800 4.885 4.843 4.904 0.104 15 0 "[ . 1 . 2]" 1
2495 1 80 ARG H 1 80 ARG QG . . 3.890 3.901 3.889 3.911 0.021 14 0 "[ . 1 . 2]" 1
2496 1 80 ARG H 1 81 GLY H . . 3.480 2.929 2.879 2.968 . 0 0 "[ . 1 . 2]" 1
2497 1 80 ARG H 1 83 ALA H . . 5.010 4.826 4.783 4.894 . 0 0 "[ . 1 . 2]" 1
2498 1 80 ARG H 1 83 ALA MB . . 4.960 4.837 4.755 4.896 . 0 0 "[ . 1 . 2]" 1
2499 1 80 ARG HA 1 80 ARG HD3 . . 4.500 4.116 4.076 4.153 . 0 0 "[ . 1 . 2]" 1
2500 1 80 ARG HA 1 80 ARG HE . . 4.790 4.702 4.656 4.734 . 0 0 "[ . 1 . 2]" 1
2501 1 80 ARG HA 1 80 ARG QG . . 3.630 2.157 2.140 2.175 . 0 0 "[ . 1 . 2]" 1
2502 1 80 ARG HA 1 83 ALA H . . 3.970 3.321 3.266 3.369 . 0 0 "[ . 1 . 2]" 1
2503 1 80 ARG HA 1 83 ALA MB . . 3.380 2.657 2.536 2.741 . 0 0 "[ . 1 . 2]" 1
2504 1 80 ARG HA 1 84 ARG H . . 4.820 3.915 3.840 3.991 . 0 0 "[ . 1 . 2]" 1
2505 1 80 ARG HA 1 84 ARG HE . . 5.500 5.428 5.251 5.519 0.019 20 0 "[ . 1 . 2]" 1
2506 1 80 ARG QB 1 80 ARG HE . . 4.420 2.140 2.113 2.162 . 0 0 "[ . 1 . 2]" 1
2507 1 80 ARG QB 1 81 GLY H . . 4.030 2.516 2.465 2.591 . 0 0 "[ . 1 . 2]" 1
2508 1 80 ARG QB 1 83 ALA H . . 5.020 4.985 4.955 5.024 0.004 9 0 "[ . 1 . 2]" 1
2509 1 80 ARG QB 1 96 ASP HB3 . . 4.760 3.084 2.976 3.235 . 0 0 "[ . 1 . 2]" 1
2510 1 80 ARG HD2 1 84 ARG HE . . 4.810 3.244 3.018 3.463 . 0 0 "[ . 1 . 2]" 1
2511 1 80 ARG HE 1 84 ARG HD2 . . 4.900 4.463 4.206 4.696 . 0 0 "[ . 1 . 2]" 1
2512 1 80 ARG HE 1 84 ARG HG3 . . 4.640 4.600 4.413 4.666 0.026 7 0 "[ . 1 . 2]" 1
2513 1 80 ARG QG 1 84 ARG HE . . 3.970 2.951 2.787 3.084 . 0 0 "[ . 1 . 2]" 1
2514 1 80 ARG QH2 1 84 ARG HE . . 5.610 5.624 5.531 5.648 0.038 11 0 "[ . 1 . 2]" 1
2515 1 81 GLY H 1 82 THR H . . 3.710 2.961 2.853 3.061 . 0 0 "[ . 1 . 2]" 1
2516 1 81 GLY H 1 82 THR HA . . 5.660 5.549 5.487 5.599 . 0 0 "[ . 1 . 2]" 1
2517 1 81 GLY H 1 83 ALA H . . 4.400 4.338 4.301 4.373 . 0 0 "[ . 1 . 2]" 1
2518 1 81 GLY H 1 84 ARG H . . 5.090 4.810 4.771 4.854 . 0 0 "[ . 1 . 2]" 1
2519 1 81 GLY H 1 84 ARG HG3 . . 4.660 4.501 4.416 4.635 . 0 0 "[ . 1 . 2]" 1
2520 1 81 GLY H 1 93 ALA MB . . 4.520 4.496 4.448 4.535 0.015 1 0 "[ . 1 . 2]" 1
2521 1 81 GLY H 1 96 ASP H . . 5.960 5.772 5.654 5.903 . 0 0 "[ . 1 . 2]" 1
2522 1 81 GLY H 1 96 ASP HB2 . . 4.060 3.220 3.073 3.373 . 0 0 "[ . 1 . 2]" 1
2523 1 81 GLY H 1 96 ASP HB3 . . 3.860 3.194 2.925 3.376 . 0 0 "[ . 1 . 2]" 1
2524 1 81 GLY H 1 97 PHE HA . . 5.620 5.597 5.448 5.637 0.017 4 0 "[ . 1 . 2]" 1
2525 1 81 GLY H 1 97 PHE QD . . 5.250 5.053 4.960 5.121 . 0 0 "[ . 1 . 2]" 1
2526 1 81 GLY H 1 97 PHE HZ . . 4.670 4.667 4.552 4.703 0.033 13 0 "[ . 1 . 2]" 1
2527 1 81 GLY H 1 100 VAL MG2 . . 5.390 4.899 4.837 4.979 . 0 0 "[ . 1 . 2]" 1
2528 1 81 GLY HA2 1 83 ALA H . . 4.810 4.520 4.449 4.620 . 0 0 "[ . 1 . 2]" 1
2529 1 81 GLY HA2 1 84 ARG H . . 4.480 3.540 3.481 3.599 . 0 0 "[ . 1 . 2]" 1
2530 1 81 GLY HA2 1 93 ALA HA . . 4.340 2.102 2.023 2.320 . 0 0 "[ . 1 . 2]" 1
2531 1 81 GLY HA2 1 93 ALA MB . . 3.750 2.206 2.080 2.289 . 0 0 "[ . 1 . 2]" 1
2532 1 81 GLY HA2 1 94 LYS H . . 5.170 5.205 5.183 5.222 0.052 13 0 "[ . 1 . 2]" 1
2533 1 81 GLY HA2 1 96 ASP H . . 5.010 4.755 4.660 4.907 . 0 0 "[ . 1 . 2]" 1
2534 1 81 GLY HA2 1 96 ASP HB2 . . 4.710 3.003 2.878 3.152 . 0 0 "[ . 1 . 2]" 1
2535 1 81 GLY HA2 1 96 ASP HB3 . . 4.780 4.262 4.090 4.426 . 0 0 "[ . 1 . 2]" 1
2536 1 81 GLY HA2 1 97 PHE QE . . 4.220 3.805 3.705 3.885 . 0 0 "[ . 1 . 2]" 1
2537 1 81 GLY HA3 1 83 ALA H . . 4.910 4.849 4.788 4.910 0.000 5 0 "[ . 1 . 2]" 1
2538 1 81 GLY HA3 1 85 THR H . . 5.500 4.970 4.907 5.068 . 0 0 "[ . 1 . 2]" 1
2539 1 81 GLY HA3 1 93 ALA HA . . 4.260 3.288 3.151 3.569 . 0 0 "[ . 1 . 2]" 1
2540 1 81 GLY HA3 1 93 ALA MB . . 3.630 2.769 2.692 2.895 . 0 0 "[ . 1 . 2]" 1
2541 1 81 GLY HA3 1 94 LYS H . . 5.690 5.722 5.707 5.738 0.048 8 0 "[ . 1 . 2]" 1
2542 1 81 GLY HA3 1 96 ASP H . . 5.180 4.947 4.813 5.072 . 0 0 "[ . 1 . 2]" 1
2543 1 81 GLY HA3 1 96 ASP HB2 . . 4.840 2.945 2.623 3.247 . 0 0 "[ . 1 . 2]" 1
2544 1 81 GLY HA3 1 96 ASP HB3 . . 4.780 3.948 3.612 4.146 . 0 0 "[ . 1 . 2]" 1
2545 1 81 GLY HA3 1 97 PHE H . . 4.450 4.122 3.996 4.222 . 0 0 "[ . 1 . 2]" 1
2546 1 82 THR H 1 82 THR HB . . 3.570 2.495 2.416 2.577 . 0 0 "[ . 1 . 2]" 1
2547 1 82 THR H 1 82 THR MG . . 3.800 3.788 3.766 3.810 0.010 8 0 "[ . 1 . 2]" 1
2548 1 82 THR H 1 83 ALA H . . 3.540 2.823 2.790 2.890 . 0 0 "[ . 1 . 2]" 1
2549 1 82 THR H 1 84 ARG H . . 4.730 4.472 4.392 4.564 . 0 0 "[ . 1 . 2]" 1
2550 1 82 THR H 2 5 ILE MD . . 4.590 4.146 4.022 4.356 . 0 0 "[ . 1 . 2]" 1
2551 1 82 THR HA 1 82 THR MG . . 3.100 2.473 2.431 2.513 . 0 0 "[ . 1 . 2]" 1
2552 1 82 THR HA 1 85 THR H . . 3.900 3.586 3.479 3.670 . 0 0 "[ . 1 . 2]" 1
2553 1 82 THR HA 1 85 THR MG . . 4.050 3.690 3.589 3.800 . 0 0 "[ . 1 . 2]" 1
2554 1 82 THR HA 1 86 PHE QD . . 4.900 4.193 3.881 4.375 . 0 0 "[ . 1 . 2]" 1
2555 1 82 THR HA 1 90 LEU MD1 . . 6.000 6.061 6.030 6.091 0.091 7 0 "[ . 1 . 2]" 1
2556 1 82 THR HA 1 97 PHE HZ . . 4.270 2.874 2.736 3.086 . 0 0 "[ . 1 . 2]" 1
2557 1 82 THR HA 2 5 ILE MD . . 5.880 5.366 5.180 5.525 . 0 0 "[ . 1 . 2]" 1
2558 1 82 THR HB 1 83 ALA H . . 3.460 2.787 2.663 2.910 . 0 0 "[ . 1 . 2]" 1
2559 1 82 THR HB 1 83 ALA MB . . 4.370 4.237 4.088 4.373 0.003 4 0 "[ . 1 . 2]" 1
2560 1 82 THR HB 1 84 ARG H . . 5.480 5.413 5.305 5.504 0.024 4 0 "[ . 1 . 2]" 1
2561 1 82 THR HB 2 5 ILE MD . . 4.000 3.616 3.381 3.870 . 0 0 "[ . 1 . 2]" 1
2562 1 82 THR MG 1 83 ALA H . . 3.590 3.565 3.494 3.598 0.008 6 0 "[ . 1 . 2]" 1
2563 1 82 THR MG 1 83 ALA HA . . 3.610 3.629 3.590 3.647 0.037 1 0 "[ . 1 . 2]" 1
2564 1 82 THR MG 1 85 THR HB . . 4.400 3.786 3.650 3.880 . 0 0 "[ . 1 . 2]" 1
2565 1 82 THR MG 1 86 PHE H . . 4.800 4.521 4.353 4.670 . 0 0 "[ . 1 . 2]" 1
2566 1 82 THR MG 1 86 PHE QB . . 5.500 4.480 4.316 4.683 . 0 0 "[ . 1 . 2]" 1
2567 1 82 THR MG 1 86 PHE QD . . 3.620 2.869 2.619 3.099 . 0 0 "[ . 1 . 2]" 1
2568 1 83 ALA H 1 83 ALA MB . . 2.930 2.258 2.236 2.278 . 0 0 "[ . 1 . 2]" 1
2569 1 83 ALA H 1 84 ARG H . . 3.570 2.845 2.786 2.906 . 0 0 "[ . 1 . 2]" 1
2570 1 83 ALA H 1 85 THR H . . 4.470 4.097 4.067 4.132 . 0 0 "[ . 1 . 2]" 1
2571 1 83 ALA H 1 86 PHE H . . 5.360 5.310 5.194 5.379 0.019 17 0 "[ . 1 . 2]" 1
2572 1 83 ALA H 1 87 LEU MD2 . . 6.000 6.029 6.014 6.041 0.041 13 0 "[ . 1 . 2]" 1
2573 1 83 ALA H 1 97 PHE HZ . . 5.240 5.254 5.188 5.274 0.034 6 0 "[ . 1 . 2]" 1
2574 1 83 ALA HA 1 85 THR H . . 4.550 4.262 4.157 4.328 . 0 0 "[ . 1 . 2]" 1
2575 1 83 ALA HA 1 86 PHE H . . 3.960 3.854 3.775 3.940 . 0 0 "[ . 1 . 2]" 1
2576 1 83 ALA HA 1 86 PHE QB . . 4.080 3.713 3.518 3.897 . 0 0 "[ . 1 . 2]" 1
2577 1 83 ALA HA 1 87 LEU H . . 4.960 4.640 4.514 4.717 . 0 0 "[ . 1 . 2]" 1
2578 1 83 ALA MB 1 84 ARG H . . 3.210 2.348 2.317 2.385 . 0 0 "[ . 1 . 2]" 1
2579 1 83 ALA MB 1 84 ARG HE . . 4.760 4.804 4.781 4.819 0.059 7 0 "[ . 1 . 2]" 1
2580 1 83 ALA MB 1 84 ARG HG2 . . 3.770 3.314 3.206 3.424 . 0 0 "[ . 1 . 2]" 1
2581 1 83 ALA MB 1 85 THR H . . 4.350 4.327 4.272 4.355 0.005 13 0 "[ . 1 . 2]" 1
2582 1 83 ALA MB 1 87 LEU MD2 . . 3.650 3.343 3.292 3.374 . 0 0 "[ . 1 . 2]" 1
2583 1 84 ARG H 1 84 ARG HB2 . . 3.710 2.570 2.384 2.752 . 0 0 "[ . 1 . 2]" 1
2584 1 84 ARG H 1 84 ARG HB3 . . 3.710 3.602 3.548 3.639 . 0 0 "[ . 1 . 2]" 1
2585 1 84 ARG H 1 84 ARG HD2 . . 4.440 4.450 4.413 4.468 0.028 13 0 "[ . 1 . 2]" 1
2586 1 84 ARG H 1 84 ARG HD3 . . 4.680 4.708 4.695 4.726 0.046 20 0 "[ . 1 . 2]" 1
2587 1 84 ARG H 1 84 ARG HG2 . . 3.800 2.714 2.657 2.763 . 0 0 "[ . 1 . 2]" 1
2588 1 84 ARG H 1 84 ARG HG3 . . 3.570 2.306 2.237 2.347 . 0 0 "[ . 1 . 2]" 1
2589 1 84 ARG H 1 85 THR H . . 3.610 2.684 2.653 2.716 . 0 0 "[ . 1 . 2]" 1
2590 1 84 ARG H 1 85 THR HB . . 4.880 4.859 4.769 4.899 0.019 12 0 "[ . 1 . 2]" 1
2591 1 84 ARG H 1 86 PHE H . . 4.840 4.723 4.619 4.768 . 0 0 "[ . 1 . 2]" 1
2592 1 84 ARG H 1 87 LEU H . . 4.890 4.888 4.835 4.916 0.026 11 0 "[ . 1 . 2]" 1
2593 1 84 ARG H 1 87 LEU MD2 . . 4.680 4.355 4.297 4.449 . 0 0 "[ . 1 . 2]" 1
2594 1 84 ARG H 1 93 ALA MB . . 3.740 3.681 3.559 3.756 0.016 5 0 "[ . 1 . 2]" 1
2595 1 84 ARG H 1 97 PHE QE . . 6.000 6.024 6.007 6.037 0.037 3 0 "[ . 1 . 2]" 1
2596 1 84 ARG HA 1 84 ARG HD2 . . 4.940 4.675 4.585 4.811 . 0 0 "[ . 1 . 2]" 1
2597 1 84 ARG HA 1 84 ARG HD3 . . 4.580 3.882 3.783 4.028 . 0 0 "[ . 1 . 2]" 1
2598 1 84 ARG HA 1 84 ARG HE . . 5.120 4.817 4.619 4.993 . 0 0 "[ . 1 . 2]" 1
2599 1 84 ARG HA 1 84 ARG HG2 . . 3.970 2.543 2.424 2.611 . 0 0 "[ . 1 . 2]" 1
2600 1 84 ARG HA 1 84 ARG HG3 . . 3.610 3.556 3.475 3.607 . 0 0 "[ . 1 . 2]" 1
2601 1 84 ARG HA 1 87 LEU H . . 3.780 3.307 3.174 3.368 . 0 0 "[ . 1 . 2]" 1
2602 1 84 ARG HA 1 87 LEU HA . . 4.880 4.877 4.809 4.898 0.018 14 0 "[ . 1 . 2]" 1
2603 1 84 ARG HA 1 87 LEU HB2 . . 4.670 2.552 2.487 2.602 . 0 0 "[ . 1 . 2]" 1
2604 1 84 ARG HA 1 87 LEU HB3 . . 3.330 2.222 2.135 2.271 . 0 0 "[ . 1 . 2]" 1
2605 1 84 ARG HA 1 87 LEU MD1 . . 4.360 4.385 4.362 4.401 0.041 9 0 "[ . 1 . 2]" 1
2606 1 84 ARG HA 1 87 LEU MD2 . . 3.520 2.588 2.515 2.699 . 0 0 "[ . 1 . 2]" 1
2607 1 84 ARG HA 1 89 LYS H . . 4.840 3.758 3.667 3.883 . 0 0 "[ . 1 . 2]" 1
2608 1 84 ARG HA 1 89 LYS QE . . 5.540 4.730 4.478 5.015 . 0 0 "[ . 1 . 2]" 1
2609 1 84 ARG HA 1 89 LYS QG . . 4.200 4.042 3.809 4.201 0.001 3 0 "[ . 1 . 2]" 1
2610 1 84 ARG QB 1 85 THR H . . 4.090 2.866 2.721 3.022 . 0 0 "[ . 1 . 2]" 1
2611 1 84 ARG QB 1 93 ALA H . . 3.630 2.993 2.812 3.155 . 0 0 "[ . 1 . 2]" 1
2612 1 84 ARG HD2 1 92 GLU H . . 5.590 5.150 4.915 5.585 . 0 0 "[ . 1 . 2]" 1
2613 1 84 ARG HD2 1 92 GLU HA . . 5.020 4.573 4.350 4.969 . 0 0 "[ . 1 . 2]" 1
2614 1 84 ARG HD2 1 92 GLU HG3 . . 5.060 4.651 4.250 5.062 0.002 20 0 "[ . 1 . 2]" 1
2615 1 84 ARG HD2 1 93 ALA H . . 4.310 3.894 3.670 4.243 . 0 0 "[ . 1 . 2]" 1
2616 1 84 ARG HD3 1 92 GLU H . . 5.830 5.036 4.804 5.388 . 0 0 "[ . 1 . 2]" 1
2617 1 84 ARG HD3 1 92 GLU HB2 . . 5.250 2.588 2.377 2.834 . 0 0 "[ . 1 . 2]" 1
2618 1 84 ARG HD3 1 92 GLU QB . . 4.390 2.407 2.240 2.622 . 0 0 "[ . 1 . 2]" 1
2619 1 84 ARG HD3 1 92 GLU HB3 . . 5.250 2.870 2.611 3.152 . 0 0 "[ . 1 . 2]" 1
2620 1 84 ARG HD3 1 92 GLU HG3 . . 4.020 3.729 3.303 4.056 0.036 20 0 "[ . 1 . 2]" 1
2621 1 84 ARG HD3 1 93 ALA H . . 4.660 4.440 4.225 4.670 0.010 8 0 "[ . 1 . 2]" 1
2622 1 84 ARG HE 1 84 ARG HG3 . . 4.110 3.172 3.118 3.247 . 0 0 "[ . 1 . 2]" 1
2623 1 84 ARG HE 1 87 LEU MD2 . . 5.050 4.222 4.013 4.389 . 0 0 "[ . 1 . 2]" 1
2624 1 84 ARG HE 1 89 LYS QE . . 5.760 5.458 5.011 5.769 0.009 12 0 "[ . 1 . 2]" 1
2625 1 84 ARG HG2 1 85 THR H . . 4.720 4.746 4.726 4.762 0.042 6 0 "[ . 1 . 2]" 1
2626 1 84 ARG HG3 1 85 THR H . . 4.310 4.318 4.264 4.341 0.031 10 0 "[ . 1 . 2]" 1
2627 1 84 ARG HG3 1 93 ALA HA . . 3.770 3.687 3.548 3.782 0.012 19 0 "[ . 1 . 2]" 1
2628 1 84 ARG HG3 1 93 ALA MB . . 3.610 3.684 3.653 3.708 0.098 9 0 "[ . 1 . 2]" 1
2629 1 85 THR H 1 85 THR HB . . 3.420 2.504 2.452 2.550 . 0 0 "[ . 1 . 2]" 1
2630 1 85 THR H 1 85 THR HG1 . . 4.300 2.173 2.137 2.237 . 0 0 "[ . 1 . 2]" 1
2631 1 85 THR H 1 85 THR MG . . 3.820 3.805 3.773 3.826 0.006 12 0 "[ . 1 . 2]" 1
2632 1 85 THR H 1 86 PHE H . . 3.470 2.919 2.857 2.965 . 0 0 "[ . 1 . 2]" 1
2633 1 85 THR H 1 86 PHE HA . . 5.570 5.527 5.451 5.575 0.005 4 0 "[ . 1 . 2]" 1
2634 1 85 THR H 1 86 PHE QB . . 4.840 4.852 4.818 4.870 0.030 17 0 "[ . 1 . 2]" 1
2635 1 85 THR H 1 86 PHE QD . . 5.200 4.859 4.528 5.076 . 0 0 "[ . 1 . 2]" 1
2636 1 85 THR H 1 87 LEU H . . 4.010 3.791 3.739 3.821 . 0 0 "[ . 1 . 2]" 1
2637 1 85 THR H 1 87 LEU MD2 . . 5.640 5.394 5.325 5.487 . 0 0 "[ . 1 . 2]" 1
2638 1 85 THR H 1 88 GLY H . . 5.180 5.164 5.026 5.208 0.028 11 0 "[ . 1 . 2]" 1
2639 1 85 THR H 1 90 LEU MD1 . . 4.620 4.530 4.498 4.584 . 0 0 "[ . 1 . 2]" 1
2640 1 85 THR H 1 93 ALA MB . . 3.400 2.768 2.604 2.905 . 0 0 "[ . 1 . 2]" 1
2641 1 85 THR H 1 117 ILE MD . . 5.150 4.349 4.202 4.501 . 0 0 "[ . 1 . 2]" 1
2642 1 85 THR HA 1 85 THR MG . . 3.030 2.543 2.506 2.582 . 0 0 "[ . 1 . 2]" 1
2643 1 85 THR HA 1 87 LEU H . . 4.200 4.153 4.087 4.209 0.009 1 0 "[ . 1 . 2]" 1
2644 1 85 THR HA 1 88 GLY H . . 4.420 4.075 3.927 4.212 . 0 0 "[ . 1 . 2]" 1
2645 1 85 THR HA 1 90 LEU H . . 4.180 4.193 4.135 4.216 0.036 10 0 "[ . 1 . 2]" 1
2646 1 85 THR HA 1 90 LEU MD1 . . 2.870 1.966 1.933 2.019 . 0 0 "[ . 1 . 2]" 1
2647 1 85 THR HA 1 90 LEU HG . . 3.750 3.718 3.562 3.768 0.018 15 0 "[ . 1 . 2]" 1
2648 1 85 THR HA 1 93 ALA MB . . 3.440 3.079 2.868 3.207 . 0 0 "[ . 1 . 2]" 1
2649 1 85 THR HA 1 97 PHE QE . . 5.480 5.202 5.030 5.360 . 0 0 "[ . 1 . 2]" 1
2650 1 85 THR HB 1 86 PHE H . . 3.470 2.341 2.226 2.451 . 0 0 "[ . 1 . 2]" 1
2651 1 85 THR HB 1 87 LEU H . . 4.640 4.480 4.408 4.557 . 0 0 "[ . 1 . 2]" 1
2652 1 85 THR HB 1 90 LEU MD1 . . 4.140 4.103 4.033 4.153 0.013 14 0 "[ . 1 . 2]" 1
2653 1 85 THR HB 1 93 ALA MB . . 4.910 4.082 3.947 4.177 . 0 0 "[ . 1 . 2]" 1
2654 1 85 THR HB 1 117 ILE MD . . 4.180 4.041 3.977 4.147 . 0 0 "[ . 1 . 2]" 1
2655 1 85 THR HG1 1 86 PHE H . . 4.920 4.092 4.015 4.159 . 0 0 "[ . 1 . 2]" 1
2656 1 85 THR MG 1 86 PHE H . . 3.490 3.114 3.066 3.162 . 0 0 "[ . 1 . 2]" 1
2657 1 85 THR MG 1 86 PHE QD . . 3.940 3.461 3.160 3.841 . 0 0 "[ . 1 . 2]" 1
2658 1 85 THR MG 1 87 LEU H . . 4.620 4.647 4.631 4.665 0.045 8 0 "[ . 1 . 2]" 1
2659 1 85 THR MG 1 88 GLY H . . 4.960 4.908 4.782 4.985 0.025 7 0 "[ . 1 . 2]" 1
2660 1 85 THR MG 1 90 LEU HA . . 4.160 3.958 3.807 4.088 . 0 0 "[ . 1 . 2]" 1
2661 1 85 THR MG 1 90 LEU MD1 . . 2.780 2.048 2.016 2.100 . 0 0 "[ . 1 . 2]" 1
2662 1 85 THR MG 1 90 LEU HG . . 3.910 3.525 3.399 3.650 . 0 0 "[ . 1 . 2]" 1
2663 1 86 PHE H 1 86 PHE QB . . 3.120 2.287 2.229 2.346 . 0 0 "[ . 1 . 2]" 1
2664 1 86 PHE H 1 86 PHE QD . . 3.450 2.850 2.446 3.073 . 0 0 "[ . 1 . 2]" 1
2665 1 86 PHE H 1 87 LEU H . . 3.370 2.445 2.355 2.519 . 0 0 "[ . 1 . 2]" 1
2666 1 86 PHE H 1 87 LEU HA . . 5.140 5.069 5.023 5.129 . 0 0 "[ . 1 . 2]" 1
2667 1 86 PHE H 1 87 LEU HB2 . . 4.220 4.217 4.170 4.246 0.026 13 0 "[ . 1 . 2]" 1
2668 1 86 PHE H 1 87 LEU MD1 . . 5.530 5.544 5.515 5.560 0.030 11 0 "[ . 1 . 2]" 1
2669 1 86 PHE H 1 87 LEU MD2 . . 5.810 5.609 5.533 5.660 . 0 0 "[ . 1 . 2]" 1
2670 1 86 PHE H 1 88 GLY H . . 4.450 4.242 4.097 4.305 . 0 0 "[ . 1 . 2]" 1
2671 1 86 PHE H 1 89 LYS H . . 5.930 5.686 5.457 5.894 . 0 0 "[ . 1 . 2]" 1
2672 1 86 PHE H 1 90 LEU MD1 . . 4.570 4.591 4.519 4.619 0.049 19 0 "[ . 1 . 2]" 1
2673 1 86 PHE HA 1 86 PHE QD . . 3.270 2.558 2.345 3.067 . 0 0 "[ . 1 . 2]" 1
2674 1 86 PHE HA 1 88 GLY H . . 4.300 3.749 3.433 3.930 . 0 0 "[ . 1 . 2]" 1
2675 1 86 PHE QB 1 87 LEU H . . 3.660 3.159 2.995 3.292 . 0 0 "[ . 1 . 2]" 1
2676 1 86 PHE QB 1 88 GLY H . . 5.590 4.768 4.622 4.891 . 0 0 "[ . 1 . 2]" 1
2677 1 87 LEU H 1 87 LEU HB2 . . 3.060 2.249 2.212 2.274 . 0 0 "[ . 1 . 2]" 1
2678 1 87 LEU H 1 87 LEU MD1 . . 3.810 3.845 3.828 3.860 0.050 8 0 "[ . 1 . 2]" 1
2679 1 87 LEU H 1 87 LEU MD2 . . 4.380 4.081 4.031 4.126 . 0 0 "[ . 1 . 2]" 1
2680 1 87 LEU H 1 88 GLY H . . 3.280 2.509 2.449 2.567 . 0 0 "[ . 1 . 2]" 1
2681 1 87 LEU H 1 89 LYS H . . 4.350 3.795 3.637 4.018 . 0 0 "[ . 1 . 2]" 1
2682 1 87 LEU H 1 89 LYS QG . . 5.360 5.144 5.015 5.373 0.013 8 0 "[ . 1 . 2]" 1
2683 1 87 LEU H 1 90 LEU MD1 . . 4.910 4.944 4.929 4.961 0.051 5 0 "[ . 1 . 2]" 1
2684 1 87 LEU HA 1 87 LEU MD1 . . 2.740 2.004 1.976 2.038 . 0 0 "[ . 1 . 2]" 1
2685 1 87 LEU HA 1 87 LEU MD2 . . 3.840 3.799 3.780 3.821 . 0 0 "[ . 1 . 2]" 1
2686 1 87 LEU HA 1 89 LYS H . . 4.660 4.515 4.344 4.664 0.004 8 0 "[ . 1 . 2]" 1
2687 1 87 LEU HB2 1 87 LEU MD1 . . 3.030 2.405 2.375 2.436 . 0 0 "[ . 1 . 2]" 1
2688 1 87 LEU HB2 1 87 LEU MD2 . . 3.120 2.234 2.205 2.264 . 0 0 "[ . 1 . 2]" 1
2689 1 87 LEU HB2 1 88 GLY H . . 3.930 3.956 3.938 3.973 0.043 19 0 "[ . 1 . 2]" 1
2690 1 87 LEU HB2 1 89 LYS H . . 4.560 4.199 4.097 4.373 . 0 0 "[ . 1 . 2]" 1
2691 1 87 LEU HB3 1 88 GLY H . . 3.670 3.162 3.040 3.242 . 0 0 "[ . 1 . 2]" 1
2692 1 87 LEU HB3 1 88 GLY HA2 . . 5.170 5.120 5.043 5.177 0.007 3 0 "[ . 1 . 2]" 1
2693 1 87 LEU HB3 1 88 GLY HA3 . . 4.740 4.737 4.652 4.764 0.024 4 0 "[ . 1 . 2]" 1
2694 1 87 LEU HB3 1 89 LYS H . . 3.340 2.585 2.447 2.740 . 0 0 "[ . 1 . 2]" 1
2695 1 87 LEU MD1 1 88 GLY H . . 4.810 4.669 4.626 4.697 . 0 0 "[ . 1 . 2]" 1
2696 1 87 LEU MD1 1 88 GLY HA2 . . 6.000 6.020 5.947 6.042 0.042 4 0 "[ . 1 . 2]" 1
2697 1 87 LEU MD1 1 88 GLY HA3 . . 5.440 5.247 5.118 5.338 . 0 0 "[ . 1 . 2]" 1
2698 1 87 LEU MD1 1 89 LYS H . . 5.250 4.942 4.757 5.141 . 0 0 "[ . 1 . 2]" 1
2699 1 87 LEU MD2 1 88 GLY H . . 5.130 5.065 4.956 5.141 0.011 3 0 "[ . 1 . 2]" 1
2700 1 87 LEU MD2 1 89 LYS H . . 4.420 4.302 4.161 4.437 0.017 7 0 "[ . 1 . 2]" 1
2701 1 87 LEU MD2 1 89 LYS QE . . 3.680 2.563 2.177 2.939 . 0 0 "[ . 1 . 2]" 1
2702 1 87 LEU HG 1 89 LYS H . . 4.980 4.072 3.823 4.348 . 0 0 "[ . 1 . 2]" 1
2703 1 88 GLY H 1 89 LYS H . . 3.210 2.404 2.242 2.558 . 0 0 "[ . 1 . 2]" 1
2704 1 88 GLY H 1 89 LYS HA . . 5.120 5.041 4.936 5.124 0.004 15 0 "[ . 1 . 2]" 1
2705 1 88 GLY H 1 89 LYS HB2 . . 4.980 4.675 4.445 4.941 . 0 0 "[ . 1 . 2]" 1
2706 1 88 GLY H 1 89 LYS QG . . 4.430 4.341 4.181 4.436 0.006 13 0 "[ . 1 . 2]" 1
2707 1 88 GLY H 1 90 LEU H . . 4.140 4.172 4.145 4.194 0.054 18 0 "[ . 1 . 2]" 1
2708 1 88 GLY H 1 90 LEU HA . . 5.260 5.117 4.970 5.262 0.002 7 0 "[ . 1 . 2]" 1
2709 1 88 GLY H 1 90 LEU MD1 . . 4.110 4.003 3.858 4.100 . 0 0 "[ . 1 . 2]" 1
2710 1 88 GLY HA2 1 90 LEU H . . 4.530 3.674 3.482 3.765 . 0 0 "[ . 1 . 2]" 1
2711 1 88 GLY HA2 1 90 LEU MD1 . . 4.600 3.908 3.545 4.149 . 0 0 "[ . 1 . 2]" 1
2712 1 88 GLY HA2 1 90 LEU MD2 . . 6.000 5.510 5.129 5.741 . 0 0 "[ . 1 . 2]" 1
2713 1 88 GLY HA3 1 89 LYS H . . 3.500 3.222 3.077 3.397 . 0 0 "[ . 1 . 2]" 1
2714 1 88 GLY HA3 1 90 LEU H . . 4.790 4.515 4.328 4.691 . 0 0 "[ . 1 . 2]" 1
2715 1 89 LYS H 1 89 LYS HB2 . . 3.450 2.529 2.393 2.696 . 0 0 "[ . 1 . 2]" 1
2716 1 89 LYS H 1 89 LYS HB3 . . 3.830 3.653 3.590 3.743 . 0 0 "[ . 1 . 2]" 1
2717 1 89 LYS H 1 89 LYS QE . . 4.400 4.402 4.230 4.431 0.031 5 0 "[ . 1 . 2]" 1
2718 1 89 LYS H 1 89 LYS QG . . 3.320 2.397 2.273 2.614 . 0 0 "[ . 1 . 2]" 1
2719 1 89 LYS H 1 90 LEU H . . 3.520 3.262 3.044 3.381 . 0 0 "[ . 1 . 2]" 1
2720 1 89 LYS H 1 90 LEU HA . . 4.960 4.709 4.384 4.956 . 0 0 "[ . 1 . 2]" 1
2721 1 89 LYS H 1 90 LEU MD1 . . 5.010 4.717 4.448 4.965 . 0 0 "[ . 1 . 2]" 1
2722 1 89 LYS HA 1 89 LYS QD . . 4.130 3.981 3.915 4.043 . 0 0 "[ . 1 . 2]" 1
2723 1 89 LYS HA 1 89 LYS QE . . 5.160 4.831 4.708 5.023 . 0 0 "[ . 1 . 2]" 1
2724 1 89 LYS HA 1 89 LYS QG . . 3.310 2.592 2.505 2.729 . 0 0 "[ . 1 . 2]" 1
2725 1 89 LYS HA 1 90 LEU H . . 3.000 2.679 2.622 2.751 . 0 0 "[ . 1 . 2]" 1
2726 1 89 LYS HA 1 90 LEU MD1 . . 5.640 5.460 5.316 5.572 . 0 0 "[ . 1 . 2]" 1
2727 1 89 LYS HA 1 91 ASN H . . 4.040 3.831 3.713 3.980 . 0 0 "[ . 1 . 2]" 1
2728 1 89 LYS HA 1 92 GLU H . . 4.660 3.713 3.644 3.776 . 0 0 "[ . 1 . 2]" 1
2729 1 89 LYS HB3 1 92 GLU H . . 3.850 3.297 3.153 3.438 . 0 0 "[ . 1 . 2]" 1
2730 1 89 LYS HB3 1 92 GLU HG3 . . 3.360 2.621 2.325 2.910 . 0 0 "[ . 1 . 2]" 1
2731 1 89 LYS QD 1 92 GLU H . . 5.030 5.047 4.812 5.107 0.077 18 0 "[ . 1 . 2]" 1
2732 1 89 LYS QG 1 90 LEU H . . 4.720 4.571 4.487 4.643 . 0 0 "[ . 1 . 2]" 1
2733 1 89 LYS QG 1 92 GLU H . . 5.100 5.089 4.951 5.116 0.016 19 0 "[ . 1 . 2]" 1
2734 1 90 LEU H 1 90 LEU HB2 . . 3.070 2.036 2.007 2.062 . 0 0 "[ . 1 . 2]" 1
2735 1 90 LEU H 1 90 LEU HB3 . . 3.130 3.077 2.977 3.145 0.015 14 0 "[ . 1 . 2]" 1
2736 1 90 LEU H 1 90 LEU MD1 . . 3.350 3.288 3.162 3.367 0.017 12 0 "[ . 1 . 2]" 1
2737 1 90 LEU H 1 90 LEU MD2 . . 4.430 4.226 4.164 4.271 . 0 0 "[ . 1 . 2]" 1
2738 1 90 LEU H 1 91 ASN H . . 3.290 2.992 2.889 3.101 . 0 0 "[ . 1 . 2]" 1
2739 1 90 LEU H 1 91 ASN HA . . 5.710 5.570 5.491 5.643 . 0 0 "[ . 1 . 2]" 1
2740 1 90 LEU H 1 91 ASN HB2 . . 4.960 4.986 4.930 5.015 0.055 18 0 "[ . 1 . 2]" 1
2741 1 90 LEU H 1 92 GLU H . . 4.380 4.349 4.237 4.407 0.027 8 0 "[ . 1 . 2]" 1
2742 1 90 LEU H 1 93 ALA H . . 4.930 4.866 4.789 4.938 0.008 11 0 "[ . 1 . 2]" 1
2743 1 90 LEU H 1 93 ALA MB . . 4.990 4.742 4.532 4.855 . 0 0 "[ . 1 . 2]" 1
2744 1 90 LEU HA 1 90 LEU HB2 . . 2.990 2.806 2.775 2.834 . 0 0 "[ . 1 . 2]" 1
2745 1 90 LEU HA 1 90 LEU MD1 . . 2.830 2.307 2.252 2.392 . 0 0 "[ . 1 . 2]" 1
2746 1 90 LEU HA 1 90 LEU MD2 . . 3.870 3.778 3.751 3.798 . 0 0 "[ . 1 . 2]" 1
2747 1 90 LEU HA 1 90 LEU HG . . 3.260 2.450 2.395 2.497 . 0 0 "[ . 1 . 2]" 1
2748 1 90 LEU HA 1 92 GLU H . . 4.550 4.459 4.321 4.563 0.013 20 0 "[ . 1 . 2]" 1
2749 1 90 LEU HA 1 93 ALA H . . 3.950 3.542 3.429 3.628 . 0 0 "[ . 1 . 2]" 1
2750 1 90 LEU HA 1 93 ALA MB . . 3.490 2.698 2.567 2.809 . 0 0 "[ . 1 . 2]" 1
2751 1 90 LEU HB2 1 90 LEU MD1 . . 3.100 2.306 2.262 2.355 . 0 0 "[ . 1 . 2]" 1
2752 1 90 LEU HB2 1 90 LEU MD2 . . 2.910 2.515 2.457 2.555 . 0 0 "[ . 1 . 2]" 1
2753 1 90 LEU HB2 1 91 ASN H . . 3.430 3.316 3.240 3.372 . 0 0 "[ . 1 . 2]" 1
2754 1 90 LEU HB3 1 90 LEU MD1 . . 3.260 3.223 3.200 3.244 . 0 0 "[ . 1 . 2]" 1
2755 1 90 LEU HB3 1 90 LEU MD2 . . 2.890 2.214 2.193 2.236 . 0 0 "[ . 1 . 2]" 1
2756 1 90 LEU HB3 1 91 ASN H . . 3.550 2.479 2.449 2.518 . 0 0 "[ . 1 . 2]" 1
2757 1 90 LEU HB3 1 91 ASN HA . . 3.930 3.954 3.943 3.962 0.032 16 0 "[ . 1 . 2]" 1
2758 1 90 LEU HB3 1 117 ILE MG . . 4.090 2.923 2.768 3.033 . 0 0 "[ . 1 . 2]" 1
2759 1 90 LEU MD1 1 91 ASN H . . 4.800 4.748 4.720 4.782 . 0 0 "[ . 1 . 2]" 1
2760 1 90 LEU MD1 1 93 ALA H . . 5.390 5.373 5.227 5.407 0.017 19 0 "[ . 1 . 2]" 1
2761 1 90 LEU MD2 1 91 ASN H . . 4.250 4.274 4.258 4.287 0.037 8 0 "[ . 1 . 2]" 1
2762 1 90 LEU MD2 1 117 ILE MG . . 2.830 2.480 2.337 2.578 . 0 0 "[ . 1 . 2]" 1
2763 1 90 LEU MD2 1 118 LYS H . . 4.720 4.674 4.574 4.724 0.004 16 0 "[ . 1 . 2]" 1
2764 1 90 LEU MD2 1 118 LYS HA . . 4.580 4.619 4.597 4.642 0.062 2 0 "[ . 1 . 2]" 1
2765 1 90 LEU MD2 1 119 LYS H . . 5.380 5.056 4.451 5.385 0.005 3 0 "[ . 1 . 2]" 1
2766 1 90 LEU HG 1 91 ASN H . . 4.630 4.527 4.464 4.623 . 0 0 "[ . 1 . 2]" 1
2767 1 90 LEU HG 1 117 ILE HA . . 3.140 2.346 2.196 2.486 . 0 0 "[ . 1 . 2]" 1
2768 1 90 LEU HG 1 117 ILE MD . . 2.710 2.106 2.045 2.172 . 0 0 "[ . 1 . 2]" 1
2769 1 90 LEU HG 1 117 ILE MG . . 2.900 2.148 2.094 2.238 . 0 0 "[ . 1 . 2]" 1
2770 1 91 ASN H 1 91 ASN HB2 . . 2.980 2.334 2.231 2.439 . 0 0 "[ . 1 . 2]" 1
2771 1 91 ASN H 1 91 ASN HB3 . . 3.570 3.569 3.542 3.585 0.015 7 0 "[ . 1 . 2]" 1
2772 1 91 ASN H 1 91 ASN HD21 . . 4.190 2.251 2.020 3.156 . 0 0 "[ . 1 . 2]" 1
2773 1 91 ASN H 1 91 ASN HD22 . . 4.510 3.616 3.403 3.885 . 0 0 "[ . 1 . 2]" 1
2774 1 91 ASN H 1 92 GLU H . . 3.160 2.873 2.758 2.970 . 0 0 "[ . 1 . 2]" 1
2775 1 91 ASN H 1 92 GLU HG2 . . 4.970 4.626 4.395 4.876 . 0 0 "[ . 1 . 2]" 1
2776 1 91 ASN H 1 93 ALA H . . 4.260 4.196 4.034 4.265 0.005 14 0 "[ . 1 . 2]" 1
2777 1 91 ASN H 1 94 LYS H . . 4.960 4.910 4.823 4.974 0.014 3 0 "[ . 1 . 2]" 1
2778 1 91 ASN H 1 117 ILE MG . . 3.970 3.967 3.880 3.996 0.026 11 0 "[ . 1 . 2]" 1
2779 1 91 ASN HA 1 91 ASN HB3 . . 2.930 2.579 2.447 2.699 . 0 0 "[ . 1 . 2]" 1
2780 1 91 ASN HA 1 91 ASN HD21 . . 4.400 3.764 3.340 4.334 . 0 0 "[ . 1 . 2]" 1
2781 1 91 ASN HA 1 91 ASN HD22 . . 4.750 4.175 3.778 4.596 . 0 0 "[ . 1 . 2]" 1
2782 1 91 ASN HA 1 93 ALA H . . 4.280 4.243 4.135 4.304 0.024 8 0 "[ . 1 . 2]" 1
2783 1 91 ASN HA 1 94 LYS H . . 3.720 3.331 3.111 3.478 . 0 0 "[ . 1 . 2]" 1
2784 1 91 ASN HA 1 94 LYS QD . . 3.850 3.353 3.037 3.539 . 0 0 "[ . 1 . 2]" 1
2785 1 91 ASN HA 1 94 LYS HG2 . . 4.860 4.657 4.434 4.863 0.003 5 0 "[ . 1 . 2]" 1
2786 1 91 ASN HA 1 95 GLN H . . 4.730 4.498 4.352 4.663 . 0 0 "[ . 1 . 2]" 1
2787 1 91 ASN HA 1 117 ILE MD . . 5.200 4.835 4.721 5.082 . 0 0 "[ . 1 . 2]" 1
2788 1 91 ASN HA 1 117 ILE MG . . 3.560 2.949 2.833 3.130 . 0 0 "[ . 1 . 2]" 1
2789 1 91 ASN HB2 1 91 ASN HD21 . . 3.230 2.302 2.167 2.408 . 0 0 "[ . 1 . 2]" 1
2790 1 91 ASN HB2 1 91 ASN HD22 . . 3.520 3.534 3.480 3.553 0.033 9 0 "[ . 1 . 2]" 1
2791 1 91 ASN HB2 1 92 GLU H . . 3.340 2.969 2.761 3.271 . 0 0 "[ . 1 . 2]" 1
2792 1 91 ASN HB3 1 93 ALA H . . 6.000 5.510 5.371 5.732 . 0 0 "[ . 1 . 2]" 1
2793 1 91 ASN HB3 1 95 GLN H . . 5.390 5.390 5.185 5.442 0.052 5 0 "[ . 1 . 2]" 1
2794 1 91 ASN HD21 1 92 GLU H . . 4.820 4.578 4.354 4.783 . 0 0 "[ . 1 . 2]" 1
2795 1 91 ASN HD21 1 117 ILE MG . . 5.740 4.879 4.357 5.759 0.019 10 0 "[ . 1 . 2]" 1
2796 1 91 ASN HD22 1 92 GLU H . . 6.000 6.013 5.849 6.089 0.089 14 0 "[ . 1 . 2]" 1
2797 1 92 GLU H 1 92 GLU HB2 . . 3.730 2.520 2.433 2.610 . 0 0 "[ . 1 . 2]" 1
2798 1 92 GLU H 1 92 GLU QB . . 3.150 2.476 2.396 2.556 . 0 0 "[ . 1 . 2]" 1
2799 1 92 GLU H 1 92 GLU HB3 . . 3.730 3.635 3.580 3.674 . 0 0 "[ . 1 . 2]" 1
2800 1 92 GLU H 1 92 GLU HG2 . . 3.290 2.321 2.216 2.424 . 0 0 "[ . 1 . 2]" 1
2801 1 92 GLU H 1 92 GLU HG3 . . 3.680 3.661 3.472 3.724 0.044 11 0 "[ . 1 . 2]" 1
2802 1 92 GLU H 1 93 ALA H . . 3.270 2.550 2.429 2.635 . 0 0 "[ . 1 . 2]" 1
2803 1 92 GLU H 1 93 ALA MB . . 4.470 4.239 4.109 4.321 . 0 0 "[ . 1 . 2]" 1
2804 1 92 GLU H 1 94 LYS H . . 4.430 4.241 4.070 4.324 . 0 0 "[ . 1 . 2]" 1
2805 1 92 GLU H 1 95 GLN H . . 5.400 5.066 4.958 5.185 . 0 0 "[ . 1 . 2]" 1
2806 1 92 GLU H 1 95 GLN HG3 . . 6.000 5.424 5.305 5.665 . 0 0 "[ . 1 . 2]" 1
2807 1 92 GLU H 1 117 ILE MG . . 5.110 5.083 4.965 5.125 0.015 6 0 "[ . 1 . 2]" 1
2808 1 92 GLU HA 1 95 GLN H . . 4.000 3.470 3.326 3.604 . 0 0 "[ . 1 . 2]" 1
2809 1 92 GLU HA 1 95 GLN HE21 . . 4.400 2.639 2.299 3.202 . 0 0 "[ . 1 . 2]" 1
2810 1 92 GLU HA 1 95 GLN HE22 . . 4.270 2.784 2.578 3.104 . 0 0 "[ . 1 . 2]" 1
2811 1 92 GLU HA 1 95 GLN HG3 . . 4.160 3.458 3.248 3.694 . 0 0 "[ . 1 . 2]" 1
2812 1 92 GLU QB 1 93 ALA H . . 3.240 2.757 2.597 2.821 . 0 0 "[ . 1 . 2]" 1
2813 1 92 GLU HB2 1 93 ALA H . . 3.820 2.826 2.648 2.901 . 0 0 "[ . 1 . 2]" 1
2814 1 92 GLU HB3 1 93 ALA H . . 3.820 3.839 3.752 3.866 0.046 17 0 "[ . 1 . 2]" 1
2815 1 92 GLU HG2 1 93 ALA H . . 4.540 4.399 4.284 4.528 . 0 0 "[ . 1 . 2]" 1
2816 1 92 GLU HG2 1 95 GLN HE22 . . 4.360 3.990 3.723 4.372 0.012 2 0 "[ . 1 . 2]" 1
2817 1 92 GLU HG3 1 93 ALA H . . 5.400 5.061 4.875 5.157 . 0 0 "[ . 1 . 2]" 1
2818 1 92 GLU HG3 1 95 GLN HE22 . . 5.450 4.916 4.669 5.336 . 0 0 "[ . 1 . 2]" 1
2819 1 93 ALA H 1 93 ALA MB . . 2.940 2.242 2.196 2.275 . 0 0 "[ . 1 . 2]" 1
2820 1 93 ALA H 1 94 LYS H . . 3.340 2.751 2.650 2.819 . 0 0 "[ . 1 . 2]" 1
2821 1 93 ALA H 1 95 GLN H . . 4.500 4.325 4.249 4.415 . 0 0 "[ . 1 . 2]" 1
2822 1 93 ALA H 1 96 ASP H . . 5.140 4.934 4.794 5.036 . 0 0 "[ . 1 . 2]" 1
2823 1 93 ALA H 1 117 ILE MD . . 4.540 4.201 4.081 4.387 . 0 0 "[ . 1 . 2]" 1
2824 1 93 ALA H 1 117 ILE MG . . 4.420 4.397 4.284 4.436 0.016 20 0 "[ . 1 . 2]" 1
2825 1 93 ALA HA 1 96 ASP H . . 3.800 3.312 3.188 3.403 . 0 0 "[ . 1 . 2]" 1
2826 1 93 ALA HA 1 97 PHE H . . 4.550 4.265 4.143 4.415 . 0 0 "[ . 1 . 2]" 1
2827 1 93 ALA MB 1 94 LYS H . . 3.100 2.561 2.475 2.652 . 0 0 "[ . 1 . 2]" 1
2828 1 93 ALA MB 1 95 GLN H . . 4.670 4.654 4.597 4.692 0.022 11 0 "[ . 1 . 2]" 1
2829 1 93 ALA MB 1 96 ASP H . . 4.430 4.402 4.330 4.436 0.006 1 0 "[ . 1 . 2]" 1
2830 1 93 ALA MB 1 97 PHE H . . 4.530 4.429 4.338 4.541 0.011 10 0 "[ . 1 . 2]" 1
2831 1 93 ALA MB 1 97 PHE QD . . 3.800 3.159 3.047 3.408 . 0 0 "[ . 1 . 2]" 1
2832 1 93 ALA MB 1 97 PHE QE . . 3.730 2.347 2.221 2.653 . 0 0 "[ . 1 . 2]" 1
2833 1 93 ALA MB 1 117 ILE MD . . 2.680 2.132 2.025 2.277 . 0 0 "[ . 1 . 2]" 1
2834 1 94 LYS H 1 94 LYS HB2 . . 3.130 2.968 2.901 3.031 . 0 0 "[ . 1 . 2]" 1
2835 1 94 LYS H 1 94 LYS HB3 . . 3.130 2.214 2.168 2.285 . 0 0 "[ . 1 . 2]" 1
2836 1 94 LYS H 1 94 LYS QE . . 5.600 5.605 5.429 5.662 0.062 11 0 "[ . 1 . 2]" 1
2837 1 94 LYS H 1 94 LYS HG2 . . 4.280 4.182 4.117 4.263 . 0 0 "[ . 1 . 2]" 1
2838 1 94 LYS H 1 95 GLN H . . 3.310 2.875 2.816 2.964 . 0 0 "[ . 1 . 2]" 1
2839 1 94 LYS H 1 95 GLN HG3 . . 4.630 4.521 4.366 4.638 0.008 20 0 "[ . 1 . 2]" 1
2840 1 94 LYS H 1 96 ASP H . . 4.060 4.040 3.969 4.073 0.013 4 0 "[ . 1 . 2]" 1
2841 1 94 LYS H 1 96 ASP HB2 . . 5.460 5.320 5.228 5.405 . 0 0 "[ . 1 . 2]" 1
2842 1 94 LYS H 1 97 PHE QD . . 4.710 3.997 3.882 4.106 . 0 0 "[ . 1 . 2]" 1
2843 1 94 LYS H 1 114 LEU MD1 . . 4.060 4.047 3.991 4.076 0.016 20 0 "[ . 1 . 2]" 1
2844 1 94 LYS H 1 117 ILE MD . . 3.700 3.506 3.375 3.653 . 0 0 "[ . 1 . 2]" 1
2845 1 94 LYS H 1 117 ILE HG13 . . 3.540 3.431 3.176 3.543 0.003 18 0 "[ . 1 . 2]" 1
2846 1 94 LYS H 1 117 ILE MG . . 3.490 2.693 2.639 2.757 . 0 0 "[ . 1 . 2]" 1
2847 1 94 LYS HA 1 94 LYS HG3 . . 3.400 2.965 2.892 3.091 . 0 0 "[ . 1 . 2]" 1
2848 1 94 LYS HA 1 96 ASP H . . 4.050 3.912 3.853 3.986 . 0 0 "[ . 1 . 2]" 1
2849 1 94 LYS HA 1 97 PHE H . . 3.570 3.110 3.048 3.183 . 0 0 "[ . 1 . 2]" 1
2850 1 94 LYS HA 1 97 PHE HB2 . . 4.120 2.672 2.623 2.700 . 0 0 "[ . 1 . 2]" 1
2851 1 94 LYS HA 1 97 PHE HB3 . . 4.380 4.388 4.350 4.407 0.027 7 0 "[ . 1 . 2]" 1
2852 1 94 LYS HA 1 97 PHE QD . . 3.700 2.510 2.400 2.626 . 0 0 "[ . 1 . 2]" 1
2853 1 94 LYS HA 1 114 LEU MD1 . . 3.110 1.993 1.962 2.022 . 0 0 "[ . 1 . 2]" 1
2854 1 94 LYS HB2 1 114 LEU MD1 . . 3.320 2.380 2.320 2.417 . 0 0 "[ . 1 . 2]" 1
2855 1 94 LYS HB2 1 114 LEU MD2 . . 4.460 4.448 4.368 4.476 0.016 4 0 "[ . 1 . 2]" 1
2856 1 94 LYS HB2 1 117 ILE MD . . 4.190 4.197 4.157 4.212 0.022 6 0 "[ . 1 . 2]" 1
2857 1 94 LYS HB2 1 117 ILE MG . . 3.380 2.080 2.053 2.109 . 0 0 "[ . 1 . 2]" 1
2858 1 94 LYS HB3 1 95 GLN H . . 3.430 2.844 2.785 2.926 . 0 0 "[ . 1 . 2]" 1
2859 1 94 LYS HB3 1 96 ASP H . . 4.970 4.983 4.955 4.999 0.029 4 0 "[ . 1 . 2]" 1
2860 1 94 LYS QD 1 95 GLN H . . 4.790 4.372 4.240 4.460 . 0 0 "[ . 1 . 2]" 1
2861 1 94 LYS QD 1 95 GLN HE21 . . 5.790 4.923 4.538 5.483 . 0 0 "[ . 1 . 2]" 1
2862 1 94 LYS QD 1 98 GLU HG3 . . 4.420 4.398 4.270 4.436 0.016 11 0 "[ . 1 . 2]" 1
2863 1 94 LYS QE 1 95 GLN H . . 4.660 4.541 4.271 4.689 0.029 11 0 "[ . 1 . 2]" 1
2864 1 94 LYS QE 1 95 GLN HA . . 4.550 4.478 4.220 4.568 0.018 14 0 "[ . 1 . 2]" 1
2865 1 94 LYS HG2 1 95 GLN H . . 4.070 2.859 2.679 2.939 . 0 0 "[ . 1 . 2]" 1
2866 1 94 LYS HG2 1 98 GLU H . . 4.750 4.763 4.710 4.778 0.028 9 0 "[ . 1 . 2]" 1
2867 1 94 LYS HG2 1 98 GLU HG3 . . 4.710 3.491 3.154 3.786 . 0 0 "[ . 1 . 2]" 1
2868 1 94 LYS HG3 1 95 GLN H . . 4.090 4.052 3.943 4.103 0.013 2 0 "[ . 1 . 2]" 1
2869 1 94 LYS HG3 1 98 GLU H . . 4.110 4.142 4.120 4.164 0.054 15 0 "[ . 1 . 2]" 1
2870 1 94 LYS HG3 1 98 GLU HG3 . . 4.440 2.427 2.334 2.541 . 0 0 "[ . 1 . 2]" 1
2871 1 94 LYS HG3 1 114 LEU MD1 . . 2.890 2.356 2.205 2.520 . 0 0 "[ . 1 . 2]" 1
2872 1 95 GLN H 1 95 GLN HB2 . . 2.880 2.515 2.459 2.578 . 0 0 "[ . 1 . 2]" 1
2873 1 95 GLN H 1 95 GLN HG2 . . 3.540 3.518 3.441 3.555 0.015 19 0 "[ . 1 . 2]" 1
2874 1 95 GLN H 1 95 GLN HG3 . . 3.160 2.079 2.011 2.111 . 0 0 "[ . 1 . 2]" 1
2875 1 95 GLN H 1 96 ASP H . . 3.170 2.699 2.676 2.745 . 0 0 "[ . 1 . 2]" 1
2876 1 95 GLN H 1 96 ASP HA . . 5.370 5.393 5.384 5.410 0.040 12 0 "[ . 1 . 2]" 1
2877 1 95 GLN H 1 97 PHE H . . 4.350 4.349 4.301 4.380 0.030 11 0 "[ . 1 . 2]" 1
2878 1 95 GLN H 1 98 GLU H . . 4.960 4.881 4.777 4.964 0.004 5 0 "[ . 1 . 2]" 1
2879 1 95 GLN H 1 114 LEU MD1 . . 4.750 4.765 4.748 4.788 0.038 12 0 "[ . 1 . 2]" 1
2880 1 95 GLN H 1 117 ILE MG . . 4.800 4.775 4.710 4.820 0.020 18 0 "[ . 1 . 2]" 1
2881 1 95 GLN HA 1 95 GLN HB3 . . 2.640 2.495 2.469 2.519 . 0 0 "[ . 1 . 2]" 1
2882 1 95 GLN HA 1 95 GLN HG2 . . 3.080 2.755 2.652 2.845 . 0 0 "[ . 1 . 2]" 1
2883 1 95 GLN HA 1 95 GLN HG3 . . 3.280 2.909 2.811 3.044 . 0 0 "[ . 1 . 2]" 1
2884 1 95 GLN HA 1 96 ASP HA . . 4.830 4.699 4.631 4.749 . 0 0 "[ . 1 . 2]" 1
2885 1 95 GLN HA 1 97 PHE H . . 4.680 4.660 4.528 4.708 0.028 17 0 "[ . 1 . 2]" 1
2886 1 95 GLN HA 1 98 GLU H . . 3.930 3.837 3.711 3.932 0.002 14 0 "[ . 1 . 2]" 1
2887 1 95 GLN HA 1 98 GLU HG3 . . 4.280 3.929 3.367 4.283 0.003 17 0 "[ . 1 . 2]" 1
2888 1 95 GLN HB2 1 95 GLN HE21 . . 4.280 3.665 3.193 4.158 . 0 0 "[ . 1 . 2]" 1
2889 1 95 GLN HB2 1 95 GLN HE22 . . 5.000 4.111 3.863 4.300 . 0 0 "[ . 1 . 2]" 1
2890 1 95 GLN HB2 1 96 ASP H . . 3.180 3.020 2.813 3.176 . 0 0 "[ . 1 . 2]" 1
2891 1 95 GLN HB2 1 96 ASP HA . . 5.310 4.634 4.389 4.843 . 0 0 "[ . 1 . 2]" 1
2892 1 95 GLN HB3 1 95 GLN HG2 . . 2.810 2.407 2.342 2.435 . 0 0 "[ . 1 . 2]" 1
2893 1 95 GLN HB3 1 96 ASP HA . . 5.040 4.747 4.548 4.888 . 0 0 "[ . 1 . 2]" 1
2894 1 95 GLN HE21 1 95 GLN HG2 . . 3.340 3.207 2.942 3.354 0.014 8 0 "[ . 1 . 2]" 1
2895 1 95 GLN HE21 1 95 GLN HG3 . . 3.320 2.193 2.133 2.349 . 0 0 "[ . 1 . 2]" 1
2896 1 95 GLN HE22 1 95 GLN HG2 . . 3.880 3.928 3.854 3.986 0.106 8 0 "[ . 1 . 2]" 1
2897 1 95 GLN HE22 1 95 GLN HG3 . . 3.690 3.483 3.453 3.511 . 0 0 "[ . 1 . 2]" 1
2898 1 95 GLN HG3 1 96 ASP H . . 4.350 4.400 4.367 4.422 0.072 9 0 "[ . 1 . 2]" 1
2899 1 96 ASP H 1 96 ASP HB2 . . 3.220 2.584 2.524 2.678 . 0 0 "[ . 1 . 2]" 1
2900 1 96 ASP H 1 96 ASP HB3 . . 3.850 3.706 3.676 3.737 . 0 0 "[ . 1 . 2]" 1
2901 1 96 ASP H 1 97 PHE H . . 3.300 2.529 2.453 2.590 . 0 0 "[ . 1 . 2]" 1
2902 1 96 ASP H 1 97 PHE HA . . 5.250 5.192 5.124 5.250 . 0 0 "[ . 1 . 2]" 1
2903 1 96 ASP H 1 97 PHE HB2 . . 4.680 4.647 4.584 4.691 0.011 11 0 "[ . 1 . 2]" 1
2904 1 96 ASP H 1 97 PHE QD . . 4.710 4.653 4.559 4.721 0.011 4 0 "[ . 1 . 2]" 1
2905 1 96 ASP H 1 98 GLU H . . 4.060 4.011 3.940 4.083 0.023 13 0 "[ . 1 . 2]" 1
2906 1 96 ASP H 1 100 VAL MG2 . . 5.820 5.770 5.711 5.843 0.023 5 0 "[ . 1 . 2]" 1
2907 1 96 ASP H 1 114 LEU MD1 . . 5.070 5.072 5.047 5.087 0.017 8 0 "[ . 1 . 2]" 1
2908 1 96 ASP H 1 114 LEU MD2 . . 6.000 5.877 5.814 5.948 . 0 0 "[ . 1 . 2]" 1
2909 1 96 ASP H 1 117 ILE MG . . 6.000 6.035 5.969 6.078 0.078 3 0 "[ . 1 . 2]" 1
2910 1 96 ASP HA 1 98 GLU H . . 4.690 4.587 4.480 4.699 0.009 7 0 "[ . 1 . 2]" 1
2911 1 96 ASP HA 1 99 THR H . . 3.890 3.542 3.383 3.723 . 0 0 "[ . 1 . 2]" 1
2912 1 96 ASP HA 1 99 THR HB . . 3.720 2.979 2.651 3.149 . 0 0 "[ . 1 . 2]" 1
2913 1 96 ASP HA 1 99 THR MG . . 4.400 4.295 4.037 4.419 0.019 10 0 "[ . 1 . 2]" 1
2914 1 96 ASP HA 1 100 VAL H . . 4.960 4.632 4.374 4.870 . 0 0 "[ . 1 . 2]" 1
2915 1 96 ASP HA 1 100 VAL MG2 . . 4.620 4.382 4.246 4.547 . 0 0 "[ . 1 . 2]" 1
2916 1 96 ASP HB2 1 97 PHE H . . 3.660 2.839 2.695 2.976 . 0 0 "[ . 1 . 2]" 1
2917 1 96 ASP HB3 1 97 PHE H . . 4.710 3.753 3.659 3.832 . 0 0 "[ . 1 . 2]" 1
2918 1 96 ASP HB3 1 99 THR HB . . 5.630 4.475 4.336 4.640 . 0 0 "[ . 1 . 2]" 1
2919 1 97 PHE H 1 97 PHE HB2 . . 3.480 2.379 2.335 2.410 . 0 0 "[ . 1 . 2]" 1
2920 1 97 PHE H 1 97 PHE HB3 . . 3.660 3.584 3.559 3.605 . 0 0 "[ . 1 . 2]" 1
2921 1 97 PHE H 1 97 PHE QD . . 3.560 3.035 2.980 3.085 . 0 0 "[ . 1 . 2]" 1
2922 1 97 PHE H 1 97 PHE QE . . 4.830 4.710 4.630 4.777 . 0 0 "[ . 1 . 2]" 1
2923 1 97 PHE H 1 98 GLU H . . 3.270 2.637 2.555 2.691 . 0 0 "[ . 1 . 2]" 1
2924 1 97 PHE H 1 98 GLU HG3 . . 4.440 4.464 4.409 4.494 0.054 12 0 "[ . 1 . 2]" 1
2925 1 97 PHE H 1 99 THR H . . 4.220 3.996 3.867 4.171 . 0 0 "[ . 1 . 2]" 1
2926 1 97 PHE H 1 100 VAL MG2 . . 4.570 4.266 4.178 4.335 . 0 0 "[ . 1 . 2]" 1
2927 1 97 PHE H 1 114 LEU MD1 . . 3.920 3.764 3.703 3.817 . 0 0 "[ . 1 . 2]" 1
2928 1 97 PHE H 1 114 LEU MD2 . . 4.140 4.166 4.156 4.175 0.035 17 0 "[ . 1 . 2]" 1
2929 1 97 PHE H 1 117 ILE MD . . 5.900 5.652 5.582 5.752 . 0 0 "[ . 1 . 2]" 1
2930 1 97 PHE HA 1 97 PHE QD . . 3.450 2.337 2.293 2.392 . 0 0 "[ . 1 . 2]" 1
2931 1 97 PHE HA 1 97 PHE QE . . 4.390 4.414 4.402 4.427 0.037 1 0 "[ . 1 . 2]" 1
2932 1 97 PHE HA 1 98 GLU HA . . 5.240 4.846 4.782 4.908 . 0 0 "[ . 1 . 2]" 1
2933 1 97 PHE HA 1 99 THR H . . 4.360 3.879 3.618 4.093 . 0 0 "[ . 1 . 2]" 1
2934 1 97 PHE HA 1 99 THR HB . . 5.620 4.829 4.746 4.938 . 0 0 "[ . 1 . 2]" 1
2935 1 97 PHE HA 1 99 THR MG . . 6.000 5.664 5.564 5.762 . 0 0 "[ . 1 . 2]" 1
2936 1 97 PHE HA 1 100 VAL H . . 3.890 3.078 2.982 3.203 . 0 0 "[ . 1 . 2]" 1
2937 1 97 PHE HA 1 100 VAL HB . . 3.880 3.148 3.047 3.336 . 0 0 "[ . 1 . 2]" 1
2938 1 97 PHE HA 1 100 VAL MG1 . . 4.460 4.268 4.217 4.393 . 0 0 "[ . 1 . 2]" 1
2939 1 97 PHE HA 1 100 VAL MG2 . . 3.500 2.181 2.102 2.252 . 0 0 "[ . 1 . 2]" 1
2940 1 97 PHE HA 1 110 ALA MB . . 3.650 3.519 3.402 3.659 0.009 17 0 "[ . 1 . 2]" 1
2941 1 97 PHE HA 1 114 LEU MD1 . . 4.950 4.765 4.728 4.799 . 0 0 "[ . 1 . 2]" 1
2942 1 97 PHE HA 1 114 LEU MD2 . . 4.330 4.117 4.049 4.201 . 0 0 "[ . 1 . 2]" 1
2943 1 97 PHE HB2 1 98 GLU H . . 4.190 2.713 2.641 2.784 . 0 0 "[ . 1 . 2]" 1
2944 1 97 PHE HB2 1 99 THR H . . 5.260 4.933 4.801 5.142 . 0 0 "[ . 1 . 2]" 1
2945 1 97 PHE HB2 1 110 ALA HA . . 5.140 4.729 4.600 4.837 . 0 0 "[ . 1 . 2]" 1
2946 1 97 PHE HB2 1 114 LEU H . . 5.730 5.096 4.999 5.172 . 0 0 "[ . 1 . 2]" 1
2947 1 97 PHE HB2 1 114 LEU HA . . 4.720 3.768 3.687 3.844 . 0 0 "[ . 1 . 2]" 1
2948 1 97 PHE HB2 1 114 LEU HB2 . . 4.310 2.835 2.776 2.914 . 0 0 "[ . 1 . 2]" 1
2949 1 97 PHE HB2 1 114 LEU MD1 . . 3.460 2.110 2.086 2.140 . 0 0 "[ . 1 . 2]" 1
2950 1 97 PHE HB2 1 114 LEU MD2 . . 3.580 2.282 2.230 2.379 . 0 0 "[ . 1 . 2]" 1
2951 1 97 PHE HB2 1 114 LEU HG . . 4.390 4.414 4.403 4.427 0.037 5 0 "[ . 1 . 2]" 1
2952 1 97 PHE HB2 1 117 ILE MD . . 5.340 5.216 5.143 5.284 . 0 0 "[ . 1 . 2]" 1
2953 1 97 PHE HB2 1 117 ILE HG13 . . 4.960 4.323 4.205 4.422 . 0 0 "[ . 1 . 2]" 1
2954 1 97 PHE HB3 1 98 GLU H . . 3.900 3.618 3.570 3.690 . 0 0 "[ . 1 . 2]" 1
2955 1 97 PHE HB3 1 98 GLU HA . . 5.020 4.476 4.391 4.593 . 0 0 "[ . 1 . 2]" 1
2956 1 97 PHE HB3 1 101 LEU H . . 6.000 5.306 5.175 5.539 . 0 0 "[ . 1 . 2]" 1
2957 1 97 PHE HB3 1 110 ALA MB . . 3.770 3.282 3.165 3.355 . 0 0 "[ . 1 . 2]" 1
2958 1 97 PHE HB3 1 111 VAL H . . 6.000 5.788 5.659 5.888 . 0 0 "[ . 1 . 2]" 1
2959 1 97 PHE HB3 1 114 LEU H . . 4.310 4.263 4.154 4.327 0.017 16 0 "[ . 1 . 2]" 1
2960 1 97 PHE HB3 1 114 LEU HA . . 4.540 4.076 3.973 4.167 . 0 0 "[ . 1 . 2]" 1
2961 1 97 PHE HB3 1 114 LEU HB2 . . 4.610 2.188 2.099 2.255 . 0 0 "[ . 1 . 2]" 1
2962 1 97 PHE HB3 1 114 LEU MD1 . . 3.160 3.121 3.089 3.156 . 0 0 "[ . 1 . 2]" 1
2963 1 97 PHE HB3 1 114 LEU MD2 . . 3.400 2.333 2.288 2.414 . 0 0 "[ . 1 . 2]" 1
2964 1 97 PHE HB3 1 114 LEU HG . . 4.600 4.611 4.591 4.627 0.027 9 0 "[ . 1 . 2]" 1
2965 1 97 PHE QD 1 98 GLU H . . 4.430 4.443 4.385 4.467 0.037 3 0 "[ . 1 . 2]" 1
2966 1 97 PHE QD 1 100 VAL MG2 . . 3.610 2.646 2.549 2.800 . 0 0 "[ . 1 . 2]" 1
2967 1 97 PHE QD 1 110 ALA HA . . 3.700 2.464 2.378 2.611 . 0 0 "[ . 1 . 2]" 1
2968 1 97 PHE QD 1 110 ALA MB . . 4.360 3.390 3.253 3.514 . 0 0 "[ . 1 . 2]" 1
2969 1 97 PHE QD 1 113 GLU H . . 5.460 5.189 5.103 5.238 . 0 0 "[ . 1 . 2]" 1
2970 1 97 PHE QD 1 114 LEU H . . 4.680 4.409 4.360 4.457 . 0 0 "[ . 1 . 2]" 1
2971 1 97 PHE QD 1 114 LEU HA . . 4.630 2.992 2.853 3.097 . 0 0 "[ . 1 . 2]" 1
2972 1 97 PHE QD 1 114 LEU HB2 . . 4.380 3.415 3.364 3.493 . 0 0 "[ . 1 . 2]" 1
2973 1 97 PHE QD 1 114 LEU MD1 . . 3.650 2.268 2.245 2.303 . 0 0 "[ . 1 . 2]" 1
2974 1 97 PHE QD 1 114 LEU MD2 . . 3.990 3.847 3.792 3.919 . 0 0 "[ . 1 . 2]" 1
2975 1 97 PHE QD 1 117 ILE MD . . 3.450 3.272 3.199 3.363 . 0 0 "[ . 1 . 2]" 1
2976 1 97 PHE QD 1 117 ILE MG . . 4.410 4.248 4.178 4.332 . 0 0 "[ . 1 . 2]" 1
2977 1 97 PHE QE 1 113 GLU HA . . 4.780 4.812 4.786 4.831 0.051 18 0 "[ . 1 . 2]" 1
2978 1 97 PHE QE 1 113 GLU HG3 . . 4.850 3.188 2.900 3.373 . 0 0 "[ . 1 . 2]" 1
2979 1 97 PHE QE 1 114 LEU MD1 . . 4.100 4.133 4.119 4.148 0.048 11 0 "[ . 1 . 2]" 1
2980 1 97 PHE QE 1 117 ILE H . . 5.910 5.196 4.932 5.356 . 0 0 "[ . 1 . 2]" 1
2981 1 97 PHE QE 1 117 ILE MD . . 3.570 2.154 2.112 2.217 . 0 0 "[ . 1 . 2]" 1
2982 1 97 PHE QE 2 5 ILE MD . . 4.450 3.529 3.326 3.697 . 0 0 "[ . 1 . 2]" 1
2983 1 97 PHE HZ 2 5 ILE MD . . 5.780 4.636 4.420 4.911 . 0 0 "[ . 1 . 2]" 1
2984 1 98 GLU H 1 98 GLU HB2 . . 3.110 2.458 2.381 2.544 . 0 0 "[ . 1 . 2]" 1
2985 1 98 GLU H 1 98 GLU HB3 . . 3.630 3.602 3.549 3.634 0.004 3 0 "[ . 1 . 2]" 1
2986 1 98 GLU H 1 98 GLU HG2 . . 3.710 3.302 3.216 3.373 . 0 0 "[ . 1 . 2]" 1
2987 1 98 GLU H 1 98 GLU HG3 . . 3.250 2.343 2.267 2.446 . 0 0 "[ . 1 . 2]" 1
2988 1 98 GLU H 1 99 THR H . . 3.360 2.741 2.694 2.803 . 0 0 "[ . 1 . 2]" 1
2989 1 98 GLU H 1 99 THR HA . . 5.450 5.419 5.367 5.460 0.010 16 0 "[ . 1 . 2]" 1
2990 1 98 GLU H 1 99 THR MG . . 6.000 6.017 5.968 6.041 0.041 15 0 "[ . 1 . 2]" 1
2991 1 98 GLU H 1 100 VAL H . . 4.380 4.322 4.266 4.357 . 0 0 "[ . 1 . 2]" 1
2992 1 98 GLU H 1 100 VAL MG2 . . 4.840 4.752 4.619 4.852 0.012 7 0 "[ . 1 . 2]" 1
2993 1 98 GLU H 1 101 LEU H . . 5.360 5.256 5.015 5.393 0.033 1 0 "[ . 1 . 2]" 1
2994 1 98 GLU H 1 114 LEU MD1 . . 3.720 3.599 3.482 3.688 . 0 0 "[ . 1 . 2]" 1
2995 1 98 GLU H 1 114 LEU MD2 . . 3.690 2.962 2.820 3.056 . 0 0 "[ . 1 . 2]" 1
2996 1 98 GLU HA 1 98 GLU HG2 . . 3.590 2.344 2.260 2.453 . 0 0 "[ . 1 . 2]" 1
2997 1 98 GLU HA 1 98 GLU HG3 . . 3.700 3.156 3.055 3.270 . 0 0 "[ . 1 . 2]" 1
2998 1 98 GLU HA 1 100 VAL HB . . 5.510 5.207 5.039 5.433 . 0 0 "[ . 1 . 2]" 1
2999 1 98 GLU HA 1 101 LEU H . . 3.980 3.681 3.429 3.902 . 0 0 "[ . 1 . 2]" 1
3000 1 98 GLU HA 1 114 LEU MD2 . . 3.010 3.002 2.915 3.049 0.039 3 0 "[ . 1 . 2]" 1
3001 1 98 GLU HB2 1 99 THR H . . 3.400 3.129 2.812 3.371 . 0 0 "[ . 1 . 2]" 1
3002 1 98 GLU HB2 1 114 LEU MD2 . . 4.650 4.220 4.052 4.415 . 0 0 "[ . 1 . 2]" 1
3003 1 98 GLU HB3 1 99 THR H . . 4.060 3.965 3.763 4.097 0.037 4 0 "[ . 1 . 2]" 1
3004 1 98 GLU HG2 1 99 THR H . . 5.050 5.074 5.024 5.108 0.058 11 0 "[ . 1 . 2]" 1
3005 1 98 GLU HG2 1 114 LEU MD1 . . 3.570 3.594 3.580 3.611 0.041 10 0 "[ . 1 . 2]" 1
3006 1 98 GLU HG2 1 114 LEU MD2 . . 3.280 2.243 2.114 2.403 . 0 0 "[ . 1 . 2]" 1
3007 1 98 GLU HG3 1 99 THR H . . 4.680 4.645 4.532 4.712 0.032 14 0 "[ . 1 . 2]" 1
3008 1 98 GLU HG3 1 114 LEU MD1 . . 3.410 2.809 2.538 3.139 . 0 0 "[ . 1 . 2]" 1
3009 1 98 GLU HG3 1 114 LEU MD2 . . 3.460 2.547 2.234 2.908 . 0 0 "[ . 1 . 2]" 1
3010 1 99 THR H 1 99 THR HB . . 3.210 2.482 2.392 2.553 . 0 0 "[ . 1 . 2]" 1
3011 1 99 THR H 1 99 THR MG . . 3.760 3.784 3.764 3.807 0.047 4 0 "[ . 1 . 2]" 1
3012 1 99 THR H 1 100 VAL H . . 3.320 2.529 2.350 2.682 . 0 0 "[ . 1 . 2]" 1
3013 1 99 THR H 1 100 VAL HA . . 5.320 5.183 5.021 5.308 . 0 0 "[ . 1 . 2]" 1
3014 1 99 THR H 1 100 VAL MG2 . . 3.960 3.783 3.599 3.968 0.008 7 0 "[ . 1 . 2]" 1
3015 1 99 THR H 1 101 LEU H . . 4.460 4.172 4.059 4.332 . 0 0 "[ . 1 . 2]" 1
3016 1 99 THR HA 1 99 THR MG . . 2.910 2.376 2.312 2.485 . 0 0 "[ . 1 . 2]" 1
3017 1 99 THR HA 1 101 LEU H . . 5.300 4.265 4.130 4.400 . 0 0 "[ . 1 . 2]" 1
3018 1 99 THR HA 1 102 LEU H . . 3.790 3.385 3.159 3.548 . 0 0 "[ . 1 . 2]" 1
3019 1 99 THR HA 1 102 LEU HB2 . . 3.930 3.504 3.242 3.634 . 0 0 "[ . 1 . 2]" 1
3020 1 99 THR HA 1 102 LEU HB3 . . 4.850 4.658 4.463 4.771 . 0 0 "[ . 1 . 2]" 1
3021 1 99 THR HA 1 102 LEU MD1 . . 3.280 2.315 2.189 2.402 . 0 0 "[ . 1 . 2]" 1
3022 1 99 THR HA 1 102 LEU MD2 . . 3.930 3.662 3.551 3.777 . 0 0 "[ . 1 . 2]" 1
3023 1 99 THR HA 1 103 LEU H . . 5.080 4.694 4.503 4.859 . 0 0 "[ . 1 . 2]" 1
3024 1 99 THR HA 1 103 LEU MD1 . . 4.970 4.685 4.561 4.833 . 0 0 "[ . 1 . 2]" 1
3025 1 99 THR HB 1 100 VAL H . . 3.530 2.777 2.666 2.888 . 0 0 "[ . 1 . 2]" 1
3026 1 99 THR HB 1 100 VAL HB . . 5.980 5.395 5.284 5.482 . 0 0 "[ . 1 . 2]" 1
3027 1 99 THR HB 1 100 VAL MG2 . . 3.520 3.499 3.379 3.559 0.039 9 0 "[ . 1 . 2]" 1
3028 1 99 THR HB 1 102 LEU MD1 . . 4.870 4.520 4.304 4.651 . 0 0 "[ . 1 . 2]" 1
3029 1 99 THR MG 1 100 VAL H . . 3.710 3.332 3.238 3.413 . 0 0 "[ . 1 . 2]" 1
3030 1 99 THR MG 1 100 VAL HA . . 4.000 3.262 3.108 3.415 . 0 0 "[ . 1 . 2]" 1
3031 1 99 THR MG 1 100 VAL HB . . 5.290 5.219 5.089 5.293 0.003 7 0 "[ . 1 . 2]" 1
3032 1 99 THR MG 1 100 VAL MG2 . . 3.760 3.717 3.571 3.775 0.015 7 0 "[ . 1 . 2]" 1
3033 1 99 THR MG 1 102 LEU H . . 4.160 4.081 4.016 4.168 0.008 7 0 "[ . 1 . 2]" 1
3034 1 99 THR MG 1 102 LEU HB2 . . 3.440 3.237 3.058 3.354 . 0 0 "[ . 1 . 2]" 1
3035 1 99 THR MG 1 102 LEU HB3 . . 4.670 4.571 4.394 4.676 0.006 6 0 "[ . 1 . 2]" 1
3036 1 99 THR MG 1 102 LEU MD1 . . 3.050 2.484 2.293 2.729 . 0 0 "[ . 1 . 2]" 1
3037 1 99 THR MG 1 102 LEU MD2 . . 4.750 4.640 4.564 4.715 . 0 0 "[ . 1 . 2]" 1
3038 1 99 THR MG 1 102 LEU HG . . 3.540 3.577 3.564 3.596 0.056 16 0 "[ . 1 . 2]" 1
3039 1 99 THR MG 1 103 LEU H . . 3.930 3.927 3.814 3.966 0.036 13 0 "[ . 1 . 2]" 1
3040 1 99 THR MG 1 103 LEU HA . . 5.930 5.563 5.353 5.671 . 0 0 "[ . 1 . 2]" 1
3041 1 99 THR MG 1 103 LEU MD1 . . 2.860 2.272 2.123 2.394 . 0 0 "[ . 1 . 2]" 1
3042 1 99 THR MG 1 103 LEU MD2 . . 4.120 3.872 3.629 4.052 . 0 0 "[ . 1 . 2]" 1
3043 1 100 VAL H 1 100 VAL HB . . 3.340 2.686 2.642 2.751 . 0 0 "[ . 1 . 2]" 1
3044 1 100 VAL H 1 100 VAL MG1 . . 3.810 3.820 3.814 3.826 0.016 12 0 "[ . 1 . 2]" 1
3045 1 100 VAL H 1 100 VAL MG2 . . 2.970 1.937 1.895 1.994 . 0 0 "[ . 1 . 2]" 1
3046 1 100 VAL H 1 101 LEU H . . 3.450 2.800 2.751 2.878 . 0 0 "[ . 1 . 2]" 1
3047 1 100 VAL H 1 102 LEU H . . 4.400 4.240 4.177 4.304 . 0 0 "[ . 1 . 2]" 1
3048 1 100 VAL H 1 103 LEU MD1 . . 4.770 4.496 4.353 4.688 . 0 0 "[ . 1 . 2]" 1
3049 1 100 VAL H 1 110 ALA MB . . 4.390 4.051 3.968 4.140 . 0 0 "[ . 1 . 2]" 1
3050 1 100 VAL HA 1 100 VAL MG1 . . 3.160 2.389 2.365 2.413 . 0 0 "[ . 1 . 2]" 1
3051 1 100 VAL HA 1 100 VAL MG2 . . 3.230 2.560 2.517 2.584 . 0 0 "[ . 1 . 2]" 1
3052 1 100 VAL HA 1 102 LEU H . . 4.480 4.121 4.062 4.213 . 0 0 "[ . 1 . 2]" 1
3053 1 100 VAL HA 1 103 LEU H . . 4.080 3.621 3.547 3.730 . 0 0 "[ . 1 . 2]" 1
3054 1 100 VAL HA 1 103 LEU HB2 . . 3.920 3.004 2.865 3.173 . 0 0 "[ . 1 . 2]" 1
3055 1 100 VAL HA 1 103 LEU MD1 . . 3.750 2.708 2.561 2.924 . 0 0 "[ . 1 . 2]" 1
3056 1 100 VAL HA 1 104 GLU H . . 4.740 4.124 3.946 4.343 . 0 0 "[ . 1 . 2]" 1
3057 1 100 VAL HA 1 104 GLU HB2 . . 5.260 4.757 4.605 4.862 . 0 0 "[ . 1 . 2]" 1
3058 1 100 VAL HA 1 104 GLU HG3 . . 5.580 4.927 4.575 5.168 . 0 0 "[ . 1 . 2]" 1
3059 1 100 VAL HA 1 110 ALA MB . . 4.430 4.376 4.328 4.424 . 0 0 "[ . 1 . 2]" 1
3060 1 100 VAL HB 1 101 LEU H . . 3.530 2.655 2.515 2.785 . 0 0 "[ . 1 . 2]" 1
3061 1 100 VAL HB 1 101 LEU HA . . 4.450 4.240 4.094 4.396 . 0 0 "[ . 1 . 2]" 1
3062 1 100 VAL HB 1 101 LEU HB2 . . 4.350 3.934 3.783 4.097 . 0 0 "[ . 1 . 2]" 1
3063 1 100 VAL HB 1 101 LEU MD1 . . 4.480 4.480 4.349 4.501 0.021 9 0 "[ . 1 . 2]" 1
3064 1 100 VAL HB 1 102 LEU H . . 5.010 4.998 4.942 5.030 0.020 5 0 "[ . 1 . 2]" 1
3065 1 100 VAL HB 1 110 ALA MB . . 3.360 2.039 1.997 2.077 . 0 0 "[ . 1 . 2]" 1
3066 1 100 VAL MG1 1 101 LEU H . . 3.720 3.676 3.590 3.725 0.005 5 0 "[ . 1 . 2]" 1
3067 1 100 VAL MG1 1 104 GLU H . . 4.160 3.814 3.728 3.917 . 0 0 "[ . 1 . 2]" 1
3068 1 100 VAL MG1 1 104 GLU HA . . 5.310 5.338 5.319 5.355 0.045 5 0 "[ . 1 . 2]" 1
3069 1 100 VAL MG1 1 104 GLU HB2 . . 3.410 2.816 2.741 2.886 . 0 0 "[ . 1 . 2]" 1
3070 1 100 VAL MG1 1 104 GLU HG3 . . 4.170 3.729 3.476 3.892 . 0 0 "[ . 1 . 2]" 1
3071 1 100 VAL MG1 1 107 ASN HB2 . . 3.530 3.020 2.877 3.258 . 0 0 "[ . 1 . 2]" 1
3072 1 100 VAL MG1 1 107 ASN HB3 . . 3.450 2.920 2.830 3.102 . 0 0 "[ . 1 . 2]" 1
3073 1 100 VAL MG1 1 107 ASN HD21 . . 3.720 2.655 2.455 2.881 . 0 0 "[ . 1 . 2]" 1
3074 1 100 VAL MG1 1 107 ASN HD22 . . 3.840 2.930 2.767 3.245 . 0 0 "[ . 1 . 2]" 1
3075 1 100 VAL MG1 1 110 ALA H . . 3.880 3.631 3.555 3.687 . 0 0 "[ . 1 . 2]" 1
3076 1 100 VAL MG1 1 110 ALA HA . . 3.950 3.895 3.818 3.954 0.004 13 0 "[ . 1 . 2]" 1
3077 1 100 VAL MG1 1 110 ALA MB . . 2.670 2.103 2.065 2.172 . 0 0 "[ . 1 . 2]" 1
3078 1 100 VAL MG2 1 101 LEU H . . 3.990 3.805 3.707 3.891 . 0 0 "[ . 1 . 2]" 1
3079 1 100 VAL MG2 1 102 LEU H . . 5.300 5.311 5.298 5.326 0.026 15 0 "[ . 1 . 2]" 1
3080 1 100 VAL MG2 1 103 LEU H . . 5.730 5.518 5.454 5.622 . 0 0 "[ . 1 . 2]" 1
3081 1 100 VAL MG2 1 103 LEU MD1 . . 4.130 4.001 3.838 4.130 0.000 1 0 "[ . 1 . 2]" 1
3082 1 100 VAL MG2 1 104 GLU HB2 . . 6.000 5.478 5.388 5.583 . 0 0 "[ . 1 . 2]" 1
3083 1 100 VAL MG2 1 104 GLU HG3 . . 6.000 5.883 5.642 6.023 0.023 1 0 "[ . 1 . 2]" 1
3084 1 100 VAL MG2 1 109 GLN HB3 . . 6.000 5.141 5.010 5.268 . 0 0 "[ . 1 . 2]" 1
3085 1 100 VAL MG2 1 110 ALA MB . . 3.380 2.978 2.880 3.036 . 0 0 "[ . 1 . 2]" 1
3086 1 100 VAL MG2 2 5 ILE MG . . 4.220 4.248 4.204 4.275 0.055 15 0 "[ . 1 . 2]" 1
3087 1 101 LEU H 1 101 LEU HB2 . . 2.990 2.198 2.159 2.237 . 0 0 "[ . 1 . 2]" 1
3088 1 101 LEU H 1 101 LEU HB3 . . 3.430 2.712 2.617 2.791 . 0 0 "[ . 1 . 2]" 1
3089 1 101 LEU H 1 101 LEU MD1 . . 3.740 3.730 3.674 3.759 0.019 7 0 "[ . 1 . 2]" 1
3090 1 101 LEU H 1 101 LEU MD2 . . 4.360 4.179 4.075 4.301 . 0 0 "[ . 1 . 2]" 1
3091 1 101 LEU H 1 102 LEU H . . 3.370 2.719 2.598 2.805 . 0 0 "[ . 1 . 2]" 1
3092 1 101 LEU H 1 103 LEU H . . 4.800 4.368 4.227 4.499 . 0 0 "[ . 1 . 2]" 1
3093 1 101 LEU H 1 107 ASN HB2 . . 6.000 5.807 5.557 5.990 . 0 0 "[ . 1 . 2]" 1
3094 1 101 LEU H 1 110 ALA MB . . 3.720 3.130 3.006 3.215 . 0 0 "[ . 1 . 2]" 1
3095 1 101 LEU HA 1 101 LEU MD1 . . 2.830 2.023 2.011 2.046 . 0 0 "[ . 1 . 2]" 1
3096 1 101 LEU HA 1 101 LEU MD2 . . 3.980 3.820 3.797 3.836 . 0 0 "[ . 1 . 2]" 1
3097 1 101 LEU HA 1 104 GLU H . . 3.910 3.127 3.029 3.315 . 0 0 "[ . 1 . 2]" 1
3098 1 101 LEU HA 1 104 GLU HB2 . . 4.040 3.787 3.600 3.943 . 0 0 "[ . 1 . 2]" 1
3099 1 101 LEU HA 1 105 PRO HA . . 3.820 3.296 2.879 3.600 . 0 0 "[ . 1 . 2]" 1
3100 1 101 LEU HA 1 105 PRO HD2 . . 6.000 5.853 5.615 6.015 0.015 4 0 "[ . 1 . 2]" 1
3101 1 101 LEU HA 1 106 GLY H . . 4.000 3.827 3.506 4.008 0.008 15 0 "[ . 1 . 2]" 1
3102 1 101 LEU HA 1 107 ASN H . . 4.240 3.745 3.513 3.884 . 0 0 "[ . 1 . 2]" 1
3103 1 101 LEU HA 1 107 ASN HB3 . . 4.450 3.823 3.543 3.978 . 0 0 "[ . 1 . 2]" 1
3104 1 101 LEU HB2 1 101 LEU MD1 . . 3.100 2.279 2.255 2.302 . 0 0 "[ . 1 . 2]" 1
3105 1 101 LEU HB2 1 101 LEU MD2 . . 2.940 2.418 2.358 2.514 . 0 0 "[ . 1 . 2]" 1
3106 1 101 LEU HB3 1 101 LEU MD1 . . 3.440 3.207 3.189 3.222 . 0 0 "[ . 1 . 2]" 1
3107 1 101 LEU HB3 1 101 LEU MD2 . . 2.870 2.258 2.196 2.290 . 0 0 "[ . 1 . 2]" 1
3108 1 101 LEU HB3 1 102 LEU H . . 3.650 3.124 3.063 3.195 . 0 0 "[ . 1 . 2]" 1
3109 1 101 LEU HB3 1 103 LEU H . . 6.000 5.360 5.255 5.489 . 0 0 "[ . 1 . 2]" 1
3110 1 101 LEU HB3 1 105 PRO HA . . 5.020 4.742 4.440 5.023 0.003 6 0 "[ . 1 . 2]" 1
3111 1 101 LEU MD1 1 102 LEU H . . 4.750 4.813 4.795 4.827 0.077 2 0 "[ . 1 . 2]" 1
3112 1 101 LEU MD1 1 104 GLU H . . 5.190 4.527 4.452 4.686 . 0 0 "[ . 1 . 2]" 1
3113 1 101 LEU MD1 1 104 GLU HB2 . . 4.450 4.332 4.199 4.434 . 0 0 "[ . 1 . 2]" 1
3114 1 101 LEU MD1 1 105 PRO HA . . 3.690 2.867 2.535 3.234 . 0 0 "[ . 1 . 2]" 1
3115 1 101 LEU MD1 1 106 GLY H . . 3.330 2.705 2.426 2.948 . 0 0 "[ . 1 . 2]" 1
3116 1 101 LEU MD1 1 106 GLY QA . . 3.640 3.100 2.806 3.447 . 0 0 "[ . 1 . 2]" 1
3117 1 101 LEU MD1 1 107 ASN H . . 3.180 2.392 2.227 2.486 . 0 0 "[ . 1 . 2]" 1
3118 1 101 LEU MD1 1 107 ASN HA . . 4.870 4.582 4.328 4.699 . 0 0 "[ . 1 . 2]" 1
3119 1 101 LEU MD1 1 107 ASN HB2 . . 3.720 3.589 3.352 3.724 0.004 16 0 "[ . 1 . 2]" 1
3120 1 101 LEU MD1 1 107 ASN HB3 . . 3.340 2.969 2.712 3.150 . 0 0 "[ . 1 . 2]" 1
3121 1 101 LEU MD1 1 110 ALA MB . . 2.650 2.468 2.290 2.596 . 0 0 "[ . 1 . 2]" 1
3122 1 101 LEU MD1 1 111 VAL H . . 4.310 4.114 3.962 4.235 . 0 0 "[ . 1 . 2]" 1
3123 1 101 LEU MD1 1 111 VAL HA . . 4.260 4.225 3.957 4.271 0.011 10 0 "[ . 1 . 2]" 1
3124 1 101 LEU MD1 1 111 VAL HB . . 5.150 4.819 4.656 4.917 . 0 0 "[ . 1 . 2]" 1
3125 1 101 LEU MD2 1 102 LEU H . . 4.810 4.848 4.820 4.871 0.061 7 0 "[ . 1 . 2]" 1
3126 1 101 LEU MD2 1 105 PRO HA . . 4.480 4.076 3.690 4.491 0.011 6 0 "[ . 1 . 2]" 1
3127 1 101 LEU MD2 1 106 GLY H . . 5.070 5.067 4.883 5.097 0.027 20 0 "[ . 1 . 2]" 1
3128 1 101 LEU MD2 1 107 ASN H . . 5.060 5.039 4.879 5.082 0.022 17 0 "[ . 1 . 2]" 1
3129 1 102 LEU H 1 102 LEU HB2 . . 2.980 2.708 2.662 2.753 . 0 0 "[ . 1 . 2]" 1
3130 1 102 LEU H 1 102 LEU HB3 . . 3.620 3.654 3.645 3.667 0.047 20 0 "[ . 1 . 2]" 1
3131 1 102 LEU H 1 102 LEU MD1 . . 3.650 3.673 3.664 3.682 0.032 7 0 "[ . 1 . 2]" 1
3132 1 102 LEU H 1 102 LEU MD2 . . 3.210 3.041 2.901 3.206 . 0 0 "[ . 1 . 2]" 1
3133 1 102 LEU H 1 102 LEU HG . . 2.920 2.144 2.082 2.236 . 0 0 "[ . 1 . 2]" 1
3134 1 102 LEU H 1 103 LEU H . . 3.110 2.490 2.437 2.568 . 0 0 "[ . 1 . 2]" 1
3135 1 102 LEU H 1 103 LEU MD1 . . 4.690 4.682 4.555 4.708 0.018 14 0 "[ . 1 . 2]" 1
3136 1 102 LEU H 1 104 GLU H . . 4.140 3.841 3.728 3.964 . 0 0 "[ . 1 . 2]" 1
3137 1 102 LEU HA 1 102 LEU HB3 . . 2.810 2.380 2.358 2.409 . 0 0 "[ . 1 . 2]" 1
3138 1 102 LEU HA 1 102 LEU MD1 . . 4.560 3.925 3.905 3.962 . 0 0 "[ . 1 . 2]" 1
3139 1 102 LEU HA 1 102 LEU MD2 . . 2.640 2.316 2.245 2.372 . 0 0 "[ . 1 . 2]" 1
3140 1 102 LEU HB2 1 102 LEU MD1 . . 3.090 2.293 2.264 2.314 . 0 0 "[ . 1 . 2]" 1
3141 1 102 LEU HB2 1 102 LEU MD2 . . 3.200 3.222 3.215 3.227 0.027 15 0 "[ . 1 . 2]" 1
3142 1 102 LEU HB2 1 103 LEU H . . 3.150 2.461 2.304 2.582 . 0 0 "[ . 1 . 2]" 1
3143 1 102 LEU HB3 1 102 LEU MD1 . . 3.450 2.367 2.338 2.412 . 0 0 "[ . 1 . 2]" 1
3144 1 102 LEU HB3 1 102 LEU MD2 . . 2.850 2.426 2.370 2.470 . 0 0 "[ . 1 . 2]" 1
3145 1 102 LEU HB3 1 103 LEU H . . 3.780 3.704 3.512 3.799 0.019 16 0 "[ . 1 . 2]" 1
3146 1 102 LEU MD1 1 103 LEU H . . 4.900 4.278 4.146 4.386 . 0 0 "[ . 1 . 2]" 1
3147 1 102 LEU MD2 1 103 LEU H . . 4.540 4.523 4.462 4.553 0.013 10 0 "[ . 1 . 2]" 1
3148 1 102 LEU HG 1 103 LEU H . . 3.960 3.884 3.776 3.965 0.005 11 0 "[ . 1 . 2]" 1
3149 1 103 LEU H 1 103 LEU HB3 . . 4.120 3.537 3.514 3.563 . 0 0 "[ . 1 . 2]" 1
3150 1 103 LEU H 1 103 LEU MD1 . . 3.570 3.279 3.182 3.357 . 0 0 "[ . 1 . 2]" 1
3151 1 103 LEU H 1 103 LEU MD2 . . 3.690 3.709 3.695 3.728 0.038 20 0 "[ . 1 . 2]" 1
3152 1 103 LEU H 1 103 LEU HG . . 4.300 2.356 2.293 2.435 . 0 0 "[ . 1 . 2]" 1
3153 1 103 LEU H 1 104 GLU H . . 3.390 2.556 2.473 2.651 . 0 0 "[ . 1 . 2]" 1
3154 1 103 LEU H 1 104 GLU HA . . 5.380 5.268 5.198 5.347 . 0 0 "[ . 1 . 2]" 1
3155 1 103 LEU HA 1 103 LEU MD1 . . 4.020 3.937 3.914 3.973 . 0 0 "[ . 1 . 2]" 1
3156 1 103 LEU HA 1 103 LEU MD2 . . 3.000 2.287 2.207 2.410 . 0 0 "[ . 1 . 2]" 1
3157 1 103 LEU HA 1 103 LEU HG . . 3.350 2.940 2.875 3.010 . 0 0 "[ . 1 . 2]" 1
3158 1 103 LEU HB2 1 103 LEU MD1 . . 3.350 2.263 2.247 2.295 . 0 0 "[ . 1 . 2]" 1
3159 1 103 LEU HB2 1 104 GLU H . . 3.860 2.778 2.609 2.977 . 0 0 "[ . 1 . 2]" 1
3160 1 103 LEU HB3 1 103 LEU MD1 . . 3.370 2.560 2.518 2.614 . 0 0 "[ . 1 . 2]" 1
3161 1 103 LEU HB3 1 103 LEU MD2 . . 3.240 2.307 2.286 2.329 . 0 0 "[ . 1 . 2]" 1
3162 1 103 LEU HB3 1 104 GLU H . . 4.280 3.768 3.633 3.946 . 0 0 "[ . 1 . 2]" 1
3163 1 103 LEU MD1 1 104 GLU H . . 4.680 4.518 4.386 4.666 . 0 0 "[ . 1 . 2]" 1
3164 1 103 LEU HG 1 104 GLU H . . 5.650 4.500 4.428 4.580 . 0 0 "[ . 1 . 2]" 1
3165 1 104 GLU H 1 104 GLU HB2 . . 4.060 2.686 2.611 2.763 . 0 0 "[ . 1 . 2]" 1
3166 1 104 GLU H 1 104 GLU HG2 . . 4.260 3.986 3.825 4.170 . 0 0 "[ . 1 . 2]" 1
3167 1 104 GLU H 1 104 GLU HG3 . . 4.390 3.197 3.095 3.464 . 0 0 "[ . 1 . 2]" 1
3168 1 104 GLU H 1 105 PRO HA . . 4.640 4.453 4.287 4.633 . 0 0 "[ . 1 . 2]" 1
3169 1 104 GLU H 1 105 PRO HD2 . . 4.760 4.493 4.330 4.605 . 0 0 "[ . 1 . 2]" 1
3170 1 104 GLU H 1 105 PRO HD3 . . 4.800 3.626 3.191 3.776 . 0 0 "[ . 1 . 2]" 1
3171 1 104 GLU HA 1 104 GLU HG2 . . 3.460 2.403 2.318 2.493 . 0 0 "[ . 1 . 2]" 1
3172 1 104 GLU HA 1 104 GLU HG3 . . 3.930 3.209 3.064 3.293 . 0 0 "[ . 1 . 2]" 1
3173 1 104 GLU HA 1 105 PRO HD2 . . 3.190 2.197 2.100 2.448 . 0 0 "[ . 1 . 2]" 1
3174 1 104 GLU HA 1 105 PRO HD3 . . 3.130 2.635 2.416 2.792 . 0 0 "[ . 1 . 2]" 1
3175 1 104 GLU HB2 1 106 GLY H . . 4.060 4.077 4.061 4.113 0.053 6 0 "[ . 1 . 2]" 1
3176 1 104 GLU HB2 1 107 ASN H . . 4.260 3.783 3.601 3.907 . 0 0 "[ . 1 . 2]" 1
3177 1 104 GLU HB2 1 107 ASN HB2 . . 4.100 2.248 2.154 2.319 . 0 0 "[ . 1 . 2]" 1
3178 1 104 GLU HB2 1 107 ASN HB3 . . 4.430 3.591 3.496 3.693 . 0 0 "[ . 1 . 2]" 1
3179 1 104 GLU HB2 1 107 ASN HD21 . . 3.970 2.619 2.390 2.802 . 0 0 "[ . 1 . 2]" 1
3180 1 104 GLU HB2 1 110 ALA MB . . 4.780 4.404 4.265 4.514 . 0 0 "[ . 1 . 2]" 1
3181 1 104 GLU HB3 1 107 ASN H . . 4.120 3.575 3.441 3.778 . 0 0 "[ . 1 . 2]" 1
3182 1 104 GLU HB3 1 107 ASN HB2 . . 4.520 2.550 2.418 2.721 . 0 0 "[ . 1 . 2]" 1
3183 1 104 GLU HB3 1 107 ASN HB3 . . 5.300 4.243 4.098 4.437 . 0 0 "[ . 1 . 2]" 1
3184 1 104 GLU HB3 1 107 ASN HD21 . . 4.370 3.185 3.081 3.259 . 0 0 "[ . 1 . 2]" 1
3185 1 104 GLU HB3 1 107 ASN HD22 . . 4.870 4.841 4.729 4.890 0.020 13 0 "[ . 1 . 2]" 1
3186 1 104 GLU HG2 1 105 PRO HD2 . . 4.620 4.368 4.221 4.628 0.008 1 0 "[ . 1 . 2]" 1
3187 1 104 GLU HG2 1 105 PRO HD3 . . 4.930 4.896 4.659 4.961 0.031 19 0 "[ . 1 . 2]" 1
3188 1 104 GLU HG2 1 107 ASN HB2 . . 4.930 4.813 4.661 4.959 0.029 7 0 "[ . 1 . 2]" 1
3189 1 104 GLU HG3 1 105 PRO HD2 . . 5.420 5.391 5.240 5.460 0.040 1 0 "[ . 1 . 2]" 1
3190 1 104 GLU HG3 1 107 ASN HB2 . . 4.420 4.441 4.396 4.465 0.045 14 0 "[ . 1 . 2]" 1
3191 1 104 GLU HG3 1 107 ASN HD22 . . 5.160 5.155 4.908 5.219 0.059 12 0 "[ . 1 . 2]" 1
3192 1 105 PRO HA 1 106 GLY H . . 2.890 2.722 2.467 2.908 0.018 12 0 "[ . 1 . 2]" 1
3193 1 105 PRO HA 1 106 GLY QA . . 4.080 4.040 3.940 4.100 0.020 20 0 "[ . 1 . 2]" 1
3194 1 105 PRO HA 1 107 ASN H . . 4.260 4.008 3.895 4.190 . 0 0 "[ . 1 . 2]" 1
3195 1 105 PRO HA 1 107 ASN HB2 . . 5.840 5.441 5.326 5.608 . 0 0 "[ . 1 . 2]" 1
3196 1 105 PRO QB 1 106 GLY H . . 4.100 4.029 3.874 4.059 . 0 0 "[ . 1 . 2]" 1
3197 1 105 PRO HD2 1 106 GLY H . . 4.570 4.129 3.874 4.502 . 0 0 "[ . 1 . 2]" 1
3198 1 105 PRO HD3 1 106 GLY H . . 5.050 4.611 4.486 4.791 . 0 0 "[ . 1 . 2]" 1
3199 1 105 PRO QG 1 106 GLY H . . 4.660 4.235 3.953 4.686 0.026 1 0 "[ . 1 . 2]" 1
3200 1 106 GLY H 1 107 ASN H . . 3.320 1.740 1.662 1.843 . 0 0 "[ . 1 . 2]" 1
3201 1 106 GLY H 1 107 ASN HA . . 4.310 4.144 4.058 4.224 . 0 0 "[ . 1 . 2]" 1
3202 1 106 GLY H 1 107 ASN HB2 . . 4.440 3.475 3.394 3.533 . 0 0 "[ . 1 . 2]" 1
3203 1 106 GLY H 1 107 ASN HB3 . . 4.530 4.085 3.995 4.209 . 0 0 "[ . 1 . 2]" 1
3204 1 106 GLY H 1 110 ALA MB . . 5.220 5.000 4.888 5.169 . 0 0 "[ . 1 . 2]" 1
3205 1 106 GLY QA 1 107 ASN H . . 3.540 2.947 2.853 2.999 . 0 0 "[ . 1 . 2]" 1
3206 1 107 ASN H 1 107 ASN HB2 . . 3.160 2.301 2.178 2.396 . 0 0 "[ . 1 . 2]" 1
3207 1 107 ASN H 1 107 ASN HB3 . . 3.200 2.510 2.428 2.609 . 0 0 "[ . 1 . 2]" 1
3208 1 107 ASN H 1 107 ASN HD21 . . 4.900 4.590 4.387 4.712 . 0 0 "[ . 1 . 2]" 1
3209 1 107 ASN H 1 108 LYS H . . 4.620 4.545 4.478 4.602 . 0 0 "[ . 1 . 2]" 1
3210 1 107 ASN H 1 110 ALA MB . . 4.160 3.771 3.661 3.882 . 0 0 "[ . 1 . 2]" 1
3211 1 107 ASN HA 1 107 ASN HD21 . . 3.920 3.732 3.477 3.908 . 0 0 "[ . 1 . 2]" 1
3212 1 107 ASN HA 1 107 ASN HD22 . . 4.390 4.238 4.106 4.356 . 0 0 "[ . 1 . 2]" 1
3213 1 107 ASN HA 1 108 LYS H . . 2.730 2.128 2.098 2.171 . 0 0 "[ . 1 . 2]" 1
3214 1 107 ASN HA 1 108 LYS HA . . 4.490 4.405 4.375 4.440 . 0 0 "[ . 1 . 2]" 1
3215 1 107 ASN HA 1 108 LYS QG . . 4.990 3.750 3.553 3.894 . 0 0 "[ . 1 . 2]" 1
3216 1 107 ASN HA 1 109 GLN H . . 3.940 3.963 3.938 3.976 0.036 2 0 "[ . 1 . 2]" 1
3217 1 107 ASN HA 1 110 ALA MB . . 5.420 4.425 4.379 4.471 . 0 0 "[ . 1 . 2]" 1
3218 1 107 ASN HA 1 111 VAL H . . 5.700 5.366 5.282 5.442 . 0 0 "[ . 1 . 2]" 1
3219 1 107 ASN HB2 1 107 ASN HD22 . . 3.580 3.549 3.521 3.584 0.004 1 0 "[ . 1 . 2]" 1
3220 1 107 ASN HB2 1 108 LYS H . . 4.530 4.351 4.308 4.408 . 0 0 "[ . 1 . 2]" 1
3221 1 107 ASN HB2 1 109 GLN H . . 5.280 5.138 5.030 5.239 . 0 0 "[ . 1 . 2]" 1
3222 1 107 ASN HB2 1 110 ALA H . . 4.270 4.276 4.240 4.300 0.030 3 0 "[ . 1 . 2]" 1
3223 1 107 ASN HB2 1 110 ALA MB . . 4.050 3.387 3.332 3.417 . 0 0 "[ . 1 . 2]" 1
3224 1 107 ASN HB2 1 111 VAL H . . 6.000 5.707 5.662 5.756 . 0 0 "[ . 1 . 2]" 1
3225 1 107 ASN HB2 1 111 VAL MG2 . . 5.040 5.100 5.090 5.109 0.069 2 0 "[ . 1 . 2]" 1
3226 1 107 ASN HB3 1 107 ASN HD22 . . 4.050 3.949 3.902 3.989 . 0 0 "[ . 1 . 2]" 1
3227 1 107 ASN HB3 1 108 LYS H . . 4.120 4.187 4.169 4.212 0.092 13 0 "[ . 1 . 2]" 1
3228 1 107 ASN HB3 1 109 GLN H . . 4.640 4.424 4.307 4.539 . 0 0 "[ . 1 . 2]" 1
3229 1 107 ASN HB3 1 110 ALA H . . 4.110 2.907 2.850 2.967 . 0 0 "[ . 1 . 2]" 1
3230 1 107 ASN HB3 1 110 ALA MB . . 3.500 2.045 2.008 2.070 . 0 0 "[ . 1 . 2]" 1
3231 1 107 ASN HB3 1 111 VAL MG2 . . 4.380 3.897 3.842 3.938 . 0 0 "[ . 1 . 2]" 1
3232 1 107 ASN HD21 1 108 LYS H . . 5.290 5.089 4.875 5.254 . 0 0 "[ . 1 . 2]" 1
3233 1 107 ASN HD21 1 109 GLN H . . 5.240 5.200 5.070 5.256 0.016 13 0 "[ . 1 . 2]" 1
3234 1 107 ASN HD21 1 110 ALA H . . 4.670 4.682 4.553 4.740 0.070 8 0 "[ . 1 . 2]" 1
3235 1 107 ASN HD21 2 5 ILE MG . . 4.790 4.726 4.606 4.819 0.029 2 0 "[ . 1 . 2]" 1
3236 1 107 ASN HD22 1 108 LYS H . . 5.060 4.874 4.694 5.011 . 0 0 "[ . 1 . 2]" 1
3237 1 107 ASN HD22 1 109 GLN H . . 4.430 4.251 4.021 4.366 . 0 0 "[ . 1 . 2]" 1
3238 1 107 ASN HD22 1 109 GLN HB2 . . 3.870 3.503 3.337 3.696 . 0 0 "[ . 1 . 2]" 1
3239 1 107 ASN HD22 1 110 ALA H . . 4.410 4.100 3.967 4.205 . 0 0 "[ . 1 . 2]" 1
3240 1 107 ASN HD22 1 110 ALA MB . . 4.480 4.037 3.842 4.216 . 0 0 "[ . 1 . 2]" 1
3241 1 107 ASN HD22 2 5 ILE MG . . 4.160 3.445 3.253 3.550 . 0 0 "[ . 1 . 2]" 1
3242 1 108 LYS H 1 108 LYS QB . . 2.850 2.493 2.320 2.658 . 0 0 "[ . 1 . 2]" 1
3243 1 108 LYS H 1 108 LYS QD . . 4.350 4.022 3.817 4.370 0.020 18 0 "[ . 1 . 2]" 1
3244 1 108 LYS H 1 108 LYS QE . . 5.300 4.438 3.757 4.838 . 0 0 "[ . 1 . 2]" 1
3245 1 108 LYS H 1 108 LYS HG2 . . 3.520 3.446 3.033 3.552 0.032 16 0 "[ . 1 . 2]" 1
3246 1 108 LYS H 1 108 LYS QG . . 3.020 2.329 2.103 2.474 . 0 0 "[ . 1 . 2]" 1
3247 1 108 LYS H 1 108 LYS HG3 . . 3.520 2.370 2.129 2.526 . 0 0 "[ . 1 . 2]" 1
3248 1 108 LYS H 1 109 GLN H . . 3.130 2.584 2.533 2.658 . 0 0 "[ . 1 . 2]" 1
3249 1 108 LYS H 1 109 GLN HB2 . . 4.410 4.433 4.421 4.451 0.041 16 0 "[ . 1 . 2]" 1
3250 1 108 LYS H 1 109 GLN HG3 . . 5.400 5.394 5.278 5.438 0.038 14 0 "[ . 1 . 2]" 1
3251 1 108 LYS H 1 111 VAL MG2 . . 4.710 4.729 4.709 4.750 0.040 3 0 "[ . 1 . 2]" 1
3252 1 108 LYS HA 1 108 LYS QD . . 3.970 3.949 3.822 3.993 0.023 20 0 "[ . 1 . 2]" 1
3253 1 108 LYS HA 1 108 LYS QE . . 4.600 4.557 4.377 4.629 0.029 13 0 "[ . 1 . 2]" 1
3254 1 108 LYS HA 1 108 LYS HG2 . . 3.510 2.471 2.373 2.566 . 0 0 "[ . 1 . 2]" 1
3255 1 108 LYS HA 1 108 LYS QG . . 3.010 2.388 2.307 2.486 . 0 0 "[ . 1 . 2]" 1
3256 1 108 LYS HA 1 108 LYS HG3 . . 3.510 3.163 3.033 3.442 . 0 0 "[ . 1 . 2]" 1
3257 1 108 LYS HA 1 110 ALA H . . 4.520 4.397 4.301 4.511 . 0 0 "[ . 1 . 2]" 1
3258 1 108 LYS HA 1 111 VAL H . . 3.790 3.369 3.230 3.528 . 0 0 "[ . 1 . 2]" 1
3259 1 108 LYS HA 1 111 VAL HA . . 5.630 5.491 5.373 5.641 0.011 10 0 "[ . 1 . 2]" 1
3260 1 108 LYS HA 1 111 VAL HB . . 3.230 2.735 2.601 2.872 . 0 0 "[ . 1 . 2]" 1
3261 1 108 LYS HA 1 111 VAL MG1 . . 4.320 4.146 4.008 4.276 . 0 0 "[ . 1 . 2]" 1
3262 1 108 LYS HA 1 111 VAL MG2 . . 3.280 3.287 3.239 3.306 0.026 15 0 "[ . 1 . 2]" 1
3263 1 108 LYS HA 1 112 THR H . . 4.070 3.908 3.789 4.046 . 0 0 "[ . 1 . 2]" 1
3264 1 108 LYS QB 1 109 GLN H . . 3.110 2.767 2.591 2.947 . 0 0 "[ . 1 . 2]" 1
3265 1 108 LYS QB 1 109 GLN HG3 . . 4.460 3.980 3.657 4.269 . 0 0 "[ . 1 . 2]" 1
3266 1 108 LYS QB 1 110 ALA H . . 4.930 4.837 4.743 4.929 . 0 0 "[ . 1 . 2]" 1
3267 1 108 LYS QB 1 111 VAL H . . 4.770 4.785 4.771 4.796 0.026 10 0 "[ . 1 . 2]" 1
3268 1 108 LYS QB 1 112 THR H . . 4.670 4.580 4.496 4.649 . 0 0 "[ . 1 . 2]" 1
3269 1 108 LYS QB 1 112 THR HB . . 4.520 4.506 4.340 4.562 0.042 19 0 "[ . 1 . 2]" 1
3270 1 108 LYS QG 1 109 GLN H . . 4.410 4.148 3.975 4.289 . 0 0 "[ . 1 . 2]" 1
3271 1 109 GLN H 1 109 GLN HB2 . . 2.670 2.136 2.083 2.170 . 0 0 "[ . 1 . 2]" 1
3272 1 109 GLN H 1 109 GLN HG2 . . 4.510 4.239 4.157 4.313 . 0 0 "[ . 1 . 2]" 1
3273 1 109 GLN H 1 109 GLN HG3 . . 3.910 3.149 3.035 3.265 . 0 0 "[ . 1 . 2]" 1
3274 1 109 GLN H 1 110 ALA H . . 2.980 2.614 2.544 2.703 . 0 0 "[ . 1 . 2]" 1
3275 1 109 GLN H 1 111 VAL H . . 4.060 3.955 3.825 4.037 . 0 0 "[ . 1 . 2]" 1
3276 1 109 GLN H 1 111 VAL MG2 . . 5.320 5.142 5.076 5.200 . 0 0 "[ . 1 . 2]" 1
3277 1 109 GLN H 1 112 THR HB . . 5.030 4.927 4.852 4.997 . 0 0 "[ . 1 . 2]" 1
3278 1 109 GLN H 2 5 ILE MG . . 5.210 4.977 4.740 5.077 . 0 0 "[ . 1 . 2]" 1
3279 1 109 GLN HA 1 109 GLN HE21 . . 5.020 4.687 4.572 4.816 . 0 0 "[ . 1 . 2]" 1
3280 1 109 GLN HA 1 109 GLN HG2 . . 3.680 2.500 2.371 2.610 . 0 0 "[ . 1 . 2]" 1
3281 1 109 GLN HA 1 109 GLN HG3 . . 4.000 2.413 2.362 2.481 . 0 0 "[ . 1 . 2]" 1
3282 1 109 GLN HA 1 111 VAL H . . 4.620 4.140 4.065 4.218 . 0 0 "[ . 1 . 2]" 1
3283 1 109 GLN HA 1 112 THR H . . 3.570 3.322 3.156 3.452 . 0 0 "[ . 1 . 2]" 1
3284 1 109 GLN HA 1 112 THR HB . . 3.470 2.596 2.402 2.733 . 0 0 "[ . 1 . 2]" 1
3285 1 109 GLN HA 1 112 THR MG . . 4.020 3.993 3.851 4.036 0.016 20 0 "[ . 1 . 2]" 1
3286 1 109 GLN HA 1 113 GLU H . . 3.880 3.061 2.906 3.208 . 0 0 "[ . 1 . 2]" 1
3287 1 109 GLN HB2 1 109 GLN HE22 . . 5.230 4.638 4.571 4.708 . 0 0 "[ . 1 . 2]" 1
3288 1 109 GLN HB2 1 110 ALA H . . 3.560 3.018 2.927 3.077 . 0 0 "[ . 1 . 2]" 1
3289 1 109 GLN HB2 1 110 ALA MB . . 5.390 4.403 4.293 4.493 . 0 0 "[ . 1 . 2]" 1
3290 1 109 GLN HB2 2 4 THR HA . . 4.840 4.461 4.114 4.779 . 0 0 "[ . 1 . 2]" 1
3291 1 109 GLN HB2 2 4 THR MG . . 4.900 4.522 4.298 4.783 . 0 0 "[ . 1 . 2]" 1
3292 1 109 GLN HB2 2 5 ILE MG . . 3.760 3.202 2.975 3.300 . 0 0 "[ . 1 . 2]" 1
3293 1 109 GLN HB3 1 109 GLN HE21 . . 4.210 4.042 3.932 4.142 . 0 0 "[ . 1 . 2]" 1
3294 1 109 GLN HB3 1 109 GLN HE22 . . 4.910 4.649 4.527 4.804 . 0 0 "[ . 1 . 2]" 1
3295 1 109 GLN HB3 1 110 ALA H . . 3.380 3.329 3.243 3.386 0.006 3 0 "[ . 1 . 2]" 1
3296 1 109 GLN HB3 1 110 ALA HA . . 4.140 4.159 4.143 4.182 0.042 10 0 "[ . 1 . 2]" 1
3297 1 109 GLN HB3 1 110 ALA MB . . 5.310 4.362 4.318 4.410 . 0 0 "[ . 1 . 2]" 1
3298 1 109 GLN HB3 2 5 ILE MD . . 3.560 3.063 2.975 3.156 . 0 0 "[ . 1 . 2]" 1
3299 1 109 GLN HB3 2 5 ILE MG . . 4.160 3.078 2.900 3.328 . 0 0 "[ . 1 . 2]" 1
3300 1 109 GLN HE21 1 109 GLN HG2 . . 3.270 2.244 2.191 2.311 . 0 0 "[ . 1 . 2]" 1
3301 1 109 GLN HE21 1 109 GLN HG3 . . 3.210 3.032 2.923 3.178 . 0 0 "[ . 1 . 2]" 1
3302 1 109 GLN HE21 1 113 GLU HG2 . . 5.240 4.796 4.394 5.152 . 0 0 "[ . 1 . 2]" 1
3303 1 109 GLN HE21 1 113 GLU HG3 . . 4.820 4.357 3.900 4.803 . 0 0 "[ . 1 . 2]" 1
3304 1 109 GLN HE21 2 4 THR HB . . 4.640 4.424 4.009 4.663 0.023 13 0 "[ . 1 . 2]" 1
3305 1 109 GLN HE21 2 4 THR MG . . 4.010 4.022 3.825 4.055 0.045 4 0 "[ . 1 . 2]" 1
3306 1 109 GLN HE21 2 5 ILE H . . 4.010 3.797 3.634 3.980 . 0 0 "[ . 1 . 2]" 1
3307 1 109 GLN HE21 2 5 ILE MD . . 3.410 3.270 3.083 3.408 . 0 0 "[ . 1 . 2]" 1
3308 1 109 GLN HE21 2 5 ILE HG12 . . 4.220 2.893 2.737 3.039 . 0 0 "[ . 1 . 2]" 1
3309 1 109 GLN HE21 2 5 ILE HG13 . . 5.360 4.514 4.379 4.660 . 0 0 "[ . 1 . 2]" 1
3310 1 109 GLN HE21 2 5 ILE MG . . 3.860 3.868 3.737 3.899 0.039 19 0 "[ . 1 . 2]" 1
3311 1 109 GLN HE21 2 6 GLU H . . 4.440 4.146 3.945 4.417 . 0 0 "[ . 1 . 2]" 1
3312 1 109 GLN HE22 1 109 GLN HG3 . . 3.960 3.790 3.723 3.862 . 0 0 "[ . 1 . 2]" 1
3313 1 109 GLN HE22 2 4 THR HB . . 3.180 2.843 2.459 3.119 . 0 0 "[ . 1 . 2]" 1
3314 1 109 GLN HE22 2 4 THR MG . . 3.390 3.202 3.013 3.390 0.000 17 0 "[ . 1 . 2]" 1
3315 1 109 GLN HE22 2 5 ILE H . . 3.490 2.281 2.089 2.511 . 0 0 "[ . 1 . 2]" 1
3316 1 109 GLN HE22 2 5 ILE HA . . 4.810 4.727 4.559 4.834 0.024 16 0 "[ . 1 . 2]" 1
3317 1 109 GLN HE22 2 5 ILE HB . . 4.840 4.791 4.658 4.876 0.036 15 0 "[ . 1 . 2]" 1
3318 1 109 GLN HE22 2 5 ILE MD . . 3.560 3.439 3.187 3.567 0.007 18 0 "[ . 1 . 2]" 1
3319 1 109 GLN HE22 2 5 ILE HG12 . . 4.070 2.166 1.941 2.350 . 0 0 "[ . 1 . 2]" 1
3320 1 109 GLN HE22 2 5 ILE MG . . 3.530 3.251 3.144 3.332 . 0 0 "[ . 1 . 2]" 1
3321 1 109 GLN HE22 2 6 GLU QG . . 3.810 3.090 2.201 3.853 0.043 15 0 "[ . 1 . 2]" 1
3322 1 109 GLN HG2 1 110 ALA H . . 5.310 5.150 5.069 5.192 . 0 0 "[ . 1 . 2]" 1
3323 1 109 GLN HG2 1 112 THR HB . . 5.090 4.499 4.071 4.671 . 0 0 "[ . 1 . 2]" 1
3324 1 109 GLN HG2 1 112 THR MG . . 5.100 4.937 4.513 5.106 0.006 7 0 "[ . 1 . 2]" 1
3325 1 109 GLN HG2 1 113 GLU H . . 5.110 4.548 4.336 4.741 . 0 0 "[ . 1 . 2]" 1
3326 1 109 GLN HG2 1 113 GLU HG3 . . 4.300 3.014 2.748 3.272 . 0 0 "[ . 1 . 2]" 1
3327 1 109 GLN HG2 2 4 THR MG . . 4.870 4.703 4.469 4.885 0.015 10 0 "[ . 1 . 2]" 1
3328 1 109 GLN HG2 2 5 ILE H . . 5.580 4.819 4.687 4.915 . 0 0 "[ . 1 . 2]" 1
3329 1 109 GLN HG2 2 5 ILE MD . . 3.890 3.455 3.315 3.566 . 0 0 "[ . 1 . 2]" 1
3330 1 109 GLN HG2 2 5 ILE MG . . 4.000 3.963 3.870 4.014 0.014 20 0 "[ . 1 . 2]" 1
3331 1 109 GLN HG3 1 110 ALA H . . 4.890 4.898 4.868 4.913 0.023 20 0 "[ . 1 . 2]" 1
3332 1 109 GLN HG3 1 112 THR HB . . 4.750 4.492 4.352 4.725 . 0 0 "[ . 1 . 2]" 1
3333 1 109 GLN HG3 1 112 THR MG . . 5.270 5.118 4.963 5.273 0.003 1 0 "[ . 1 . 2]" 1
3334 1 109 GLN HG3 1 113 GLU H . . 5.390 5.274 5.111 5.407 0.017 5 0 "[ . 1 . 2]" 1
3335 1 109 GLN HG3 1 113 GLU HG3 . . 4.910 4.620 4.386 4.912 0.002 19 0 "[ . 1 . 2]" 1
3336 1 109 GLN HG3 2 4 THR MG . . 4.220 3.713 3.355 3.948 . 0 0 "[ . 1 . 2]" 1
3337 1 109 GLN HG3 2 5 ILE H . . 6.000 4.780 4.600 4.953 . 0 0 "[ . 1 . 2]" 1
3338 1 109 GLN HG3 2 5 ILE MD . . 4.600 4.611 4.525 4.642 0.042 17 0 "[ . 1 . 2]" 1
3339 1 109 GLN HG3 2 5 ILE HG12 . . 5.140 5.175 5.154 5.200 0.060 7 0 "[ . 1 . 2]" 1
3340 1 109 GLN HG3 2 5 ILE MG . . 4.520 4.362 4.266 4.438 . 0 0 "[ . 1 . 2]" 1
3341 1 110 ALA H 1 110 ALA MB . . 2.860 2.232 2.200 2.253 . 0 0 "[ . 1 . 2]" 1
3342 1 110 ALA H 1 111 VAL H . . 3.220 2.607 2.585 2.623 . 0 0 "[ . 1 . 2]" 1
3343 1 110 ALA H 1 111 VAL HA . . 5.240 5.273 5.257 5.284 0.044 14 0 "[ . 1 . 2]" 1
3344 1 110 ALA H 1 111 VAL MG2 . . 4.250 4.130 4.071 4.189 . 0 0 "[ . 1 . 2]" 1
3345 1 110 ALA H 1 112 THR H . . 4.100 4.127 4.106 4.154 0.054 8 0 "[ . 1 . 2]" 1
3346 1 110 ALA H 1 113 GLU H . . 4.930 4.924 4.883 4.950 0.020 19 0 "[ . 1 . 2]" 1
3347 1 110 ALA HA 1 113 GLU H . . 4.390 4.215 4.156 4.317 . 0 0 "[ . 1 . 2]" 1
3348 1 110 ALA HA 1 113 GLU HB2 . . 4.050 3.676 3.555 3.798 . 0 0 "[ . 1 . 2]" 1
3349 1 110 ALA HA 1 114 LEU H . . 3.960 3.995 3.974 4.010 0.050 10 0 "[ . 1 . 2]" 1
3350 1 110 ALA MB 1 111 VAL H . . 3.270 2.838 2.815 2.874 . 0 0 "[ . 1 . 2]" 1
3351 1 110 ALA MB 1 111 VAL HA . . 3.970 3.985 3.975 3.999 0.029 17 0 "[ . 1 . 2]" 1
3352 1 110 ALA MB 1 111 VAL MG2 . . 3.140 3.029 2.971 3.089 . 0 0 "[ . 1 . 2]" 1
3353 1 110 ALA MB 1 112 THR H . . 4.730 4.670 4.649 4.728 . 0 0 "[ . 1 . 2]" 1
3354 1 111 VAL H 1 111 VAL HB . . 3.100 2.435 2.399 2.483 . 0 0 "[ . 1 . 2]" 1
3355 1 111 VAL H 1 111 VAL MG1 . . 3.930 3.783 3.763 3.797 . 0 0 "[ . 1 . 2]" 1
3356 1 111 VAL H 1 111 VAL MG2 . . 2.770 2.419 2.365 2.454 . 0 0 "[ . 1 . 2]" 1
3357 1 111 VAL H 1 112 THR H . . 3.140 2.378 2.344 2.411 . 0 0 "[ . 1 . 2]" 1
3358 1 111 VAL H 1 112 THR HA . . 5.200 5.084 5.043 5.109 . 0 0 "[ . 1 . 2]" 1
3359 1 111 VAL H 1 112 THR HB . . 4.500 4.509 4.442 4.525 0.025 18 0 "[ . 1 . 2]" 1
3360 1 111 VAL H 1 113 GLU H . . 4.420 4.384 4.329 4.423 0.003 14 0 "[ . 1 . 2]" 1
3361 1 111 VAL H 1 114 LEU HB2 . . 6.000 5.354 5.276 5.421 . 0 0 "[ . 1 . 2]" 1
3362 1 111 VAL HA 1 111 VAL MG1 . . 3.000 2.418 2.316 2.455 . 0 0 "[ . 1 . 2]" 1
3363 1 111 VAL HA 1 111 VAL MG2 . . 2.860 2.444 2.423 2.501 . 0 0 "[ . 1 . 2]" 1
3364 1 111 VAL HA 1 112 THR HA . . 4.710 4.730 4.721 4.747 0.037 5 0 "[ . 1 . 2]" 1
3365 1 111 VAL HA 1 114 LEU H . . 4.210 4.226 4.211 4.248 0.038 11 0 "[ . 1 . 2]" 1
3366 1 111 VAL HA 1 114 LEU HB2 . . 4.420 4.224 4.171 4.293 . 0 0 "[ . 1 . 2]" 1
3367 1 111 VAL HA 1 114 LEU HB3 . . 3.850 3.101 3.056 3.152 . 0 0 "[ . 1 . 2]" 1
3368 1 111 VAL HA 1 114 LEU MD2 . . 3.790 3.589 3.505 3.765 . 0 0 "[ . 1 . 2]" 1
3369 1 111 VAL HA 1 114 LEU HG . . 5.210 4.884 4.761 4.987 . 0 0 "[ . 1 . 2]" 1
3370 1 111 VAL HA 1 115 SER H . . 4.580 4.521 4.388 4.595 0.015 10 0 "[ . 1 . 2]" 1
3371 1 111 VAL HB 1 112 THR H . . 3.080 2.721 2.652 2.797 . 0 0 "[ . 1 . 2]" 1
3372 1 111 VAL HB 1 112 THR HA . . 4.570 4.414 4.323 4.482 . 0 0 "[ . 1 . 2]" 1
3373 1 111 VAL MG1 1 112 THR H . . 3.670 3.501 3.443 3.560 . 0 0 "[ . 1 . 2]" 1
3374 1 111 VAL MG1 1 112 THR HA . . 3.580 3.477 3.421 3.580 . 0 0 "[ . 1 . 2]" 1
3375 1 111 VAL MG1 1 112 THR HB . . 5.040 5.043 4.955 5.065 0.025 1 0 "[ . 1 . 2]" 1
3376 1 111 VAL MG1 1 114 LEU H . . 5.230 5.207 5.172 5.236 0.006 17 0 "[ . 1 . 2]" 1
3377 1 111 VAL MG1 1 114 LEU HB3 . . 4.520 4.532 4.433 4.547 0.027 9 0 "[ . 1 . 2]" 1
3378 1 111 VAL MG1 1 115 SER H . . 4.700 4.661 4.544 4.713 0.013 8 0 "[ . 1 . 2]" 1
3379 1 111 VAL MG2 1 112 THR H . . 4.030 3.962 3.909 4.024 . 0 0 "[ . 1 . 2]" 1
3380 1 112 THR H 1 112 THR HB . . 3.040 2.392 2.345 2.433 . 0 0 "[ . 1 . 2]" 1
3381 1 112 THR H 1 112 THR MG . . 3.890 3.756 3.734 3.780 . 0 0 "[ . 1 . 2]" 1
3382 1 112 THR H 1 113 GLU H . . 3.290 2.808 2.731 2.863 . 0 0 "[ . 1 . 2]" 1
3383 1 112 THR H 1 113 GLU HA . . 5.410 5.399 5.339 5.417 0.007 3 0 "[ . 1 . 2]" 1
3384 1 112 THR H 1 114 LEU H . . 3.800 3.806 3.751 3.836 0.036 19 0 "[ . 1 . 2]" 1
3385 1 112 THR HA 1 112 THR MG . . 2.840 2.421 2.364 2.495 . 0 0 "[ . 1 . 2]" 1
3386 1 112 THR HA 1 114 LEU H . . 4.830 4.074 3.992 4.151 . 0 0 "[ . 1 . 2]" 1
3387 1 112 THR HA 1 114 LEU HB3 . . 5.400 5.130 5.008 5.254 . 0 0 "[ . 1 . 2]" 1
3388 1 112 THR HA 1 115 SER H . . 3.570 3.327 3.201 3.409 . 0 0 "[ . 1 . 2]" 1
3389 1 112 THR HB 1 113 GLU H . . 3.250 2.455 2.347 2.574 . 0 0 "[ . 1 . 2]" 1
3390 1 112 THR HB 1 113 GLU HA . . 4.470 4.470 4.361 4.523 0.053 19 0 "[ . 1 . 2]" 1
3391 1 112 THR HB 1 113 GLU HG2 . . 3.860 3.102 2.891 3.286 . 0 0 "[ . 1 . 2]" 1
3392 1 112 THR HB 1 114 LEU H . . 4.760 4.635 4.537 4.742 . 0 0 "[ . 1 . 2]" 1
3393 1 112 THR MG 1 113 GLU H . . 3.470 3.067 2.953 3.141 . 0 0 "[ . 1 . 2]" 1
3394 1 112 THR MG 1 113 GLU HA . . 3.490 3.224 2.998 3.311 . 0 0 "[ . 1 . 2]" 1
3395 1 112 THR MG 1 113 GLU HG2 . . 3.700 3.317 2.918 3.599 . 0 0 "[ . 1 . 2]" 1
3396 1 112 THR MG 1 114 LEU H . . 4.530 4.570 4.536 4.599 0.069 10 0 "[ . 1 . 2]" 1
3397 1 112 THR MG 1 115 SER H . . 4.450 4.467 4.426 4.494 0.044 20 0 "[ . 1 . 2]" 1
3398 1 112 THR MG 1 116 LYS QE . . 3.380 2.431 2.113 2.864 . 0 0 "[ . 1 . 2]" 1
3399 1 112 THR MG 1 116 LYS HG3 . . 3.630 3.613 3.461 3.671 0.041 19 0 "[ . 1 . 2]" 1
3400 1 113 GLU H 1 113 GLU HB2 . . 3.470 2.446 2.378 2.490 . 0 0 "[ . 1 . 2]" 1
3401 1 113 GLU H 1 113 GLU HB3 . . 3.720 3.510 3.477 3.561 . 0 0 "[ . 1 . 2]" 1
3402 1 113 GLU H 1 113 GLU HG2 . . 3.040 2.008 1.901 2.172 . 0 0 "[ . 1 . 2]" 1
3403 1 113 GLU H 1 113 GLU HG3 . . 3.260 3.327 3.305 3.363 0.103 9 0 "[ . 1 . 2]" 1
3404 1 113 GLU H 1 114 LEU H . . 3.230 2.606 2.561 2.648 . 0 0 "[ . 1 . 2]" 1
3405 1 113 GLU H 1 114 LEU HA . . 5.470 5.296 5.236 5.348 . 0 0 "[ . 1 . 2]" 1
3406 1 113 GLU H 1 115 SER H . . 4.490 4.170 4.091 4.238 . 0 0 "[ . 1 . 2]" 1
3407 1 113 GLU H 1 116 LYS H . . 5.310 5.145 4.997 5.273 . 0 0 "[ . 1 . 2]" 1
3408 1 113 GLU HA 1 113 GLU HG2 . . 3.500 3.110 2.861 3.250 . 0 0 "[ . 1 . 2]" 1
3409 1 113 GLU HA 1 114 LEU H . . 3.500 3.439 3.406 3.475 . 0 0 "[ . 1 . 2]" 1
3410 1 113 GLU HA 1 115 SER H . . 4.710 4.241 4.130 4.397 . 0 0 "[ . 1 . 2]" 1
3411 1 113 GLU HA 1 116 LYS H . . 4.000 3.496 3.249 3.694 . 0 0 "[ . 1 . 2]" 1
3412 1 113 GLU HA 1 116 LYS QD . . 3.580 2.472 2.291 2.954 . 0 0 "[ . 1 . 2]" 1
3413 1 113 GLU HA 1 116 LYS QE . . 3.860 2.771 2.464 3.270 . 0 0 "[ . 1 . 2]" 1
3414 1 113 GLU HB2 1 114 LEU H . . 3.480 2.970 2.897 3.052 . 0 0 "[ . 1 . 2]" 1
3415 1 113 GLU HB3 1 114 LEU H . . 3.930 3.971 3.931 4.015 0.085 12 0 "[ . 1 . 2]" 1
3416 1 113 GLU HG2 1 114 LEU H . . 4.420 4.325 4.237 4.450 0.030 19 0 "[ . 1 . 2]" 1
3417 1 114 LEU H 1 114 LEU HB2 . . 3.110 2.553 2.477 2.614 . 0 0 "[ . 1 . 2]" 1
3418 1 114 LEU H 1 114 LEU HB3 . . 2.970 2.493 2.462 2.542 . 0 0 "[ . 1 . 2]" 1
3419 1 114 LEU H 1 114 LEU MD1 . . 4.270 4.147 4.101 4.199 . 0 0 "[ . 1 . 2]" 1
3420 1 114 LEU H 1 114 LEU MD2 . . 4.730 4.289 4.238 4.354 . 0 0 "[ . 1 . 2]" 1
3421 1 114 LEU H 1 115 SER H . . 3.140 2.418 2.367 2.487 . 0 0 "[ . 1 . 2]" 1
3422 1 114 LEU H 1 115 SER HA . . 5.090 5.123 5.106 5.151 0.061 8 0 "[ . 1 . 2]" 1
3423 1 114 LEU H 1 115 SER QB . . 4.360 4.355 4.223 4.398 0.038 2 0 "[ . 1 . 2]" 1
3424 1 114 LEU H 1 116 LYS H . . 4.250 3.973 3.795 4.091 . 0 0 "[ . 1 . 2]" 1
3425 1 114 LEU H 1 117 ILE H . . 5.150 5.006 4.846 5.117 . 0 0 "[ . 1 . 2]" 1
3426 1 114 LEU HA 1 114 LEU MD1 . . 2.790 2.081 2.051 2.123 . 0 0 "[ . 1 . 2]" 1
3427 1 114 LEU HA 1 117 ILE H . . 3.920 3.264 3.124 3.365 . 0 0 "[ . 1 . 2]" 1
3428 1 114 LEU HA 1 118 LYS H . . 4.970 4.771 4.496 4.984 0.014 1 0 "[ . 1 . 2]" 1
3429 1 114 LEU HB2 1 114 LEU MD1 . . 3.440 2.523 2.495 2.561 . 0 0 "[ . 1 . 2]" 1
3430 1 114 LEU HB2 1 114 LEU MD2 . . 3.060 2.345 2.317 2.380 . 0 0 "[ . 1 . 2]" 1
3431 1 114 LEU HB2 1 115 SER H . . 3.940 3.954 3.920 3.969 0.029 8 0 "[ . 1 . 2]" 1
3432 1 114 LEU HB3 1 114 LEU MD1 . . 3.360 3.236 3.228 3.245 . 0 0 "[ . 1 . 2]" 1
3433 1 114 LEU HB3 1 114 LEU MD2 . . 3.110 2.453 2.417 2.481 . 0 0 "[ . 1 . 2]" 1
3434 1 114 LEU HB3 1 115 SER H . . 3.400 2.832 2.772 2.905 . 0 0 "[ . 1 . 2]" 1
3435 1 114 LEU MD1 1 115 SER H . . 4.420 4.455 4.440 4.471 0.051 15 0 "[ . 1 . 2]" 1
3436 1 114 LEU MD1 1 118 LYS H . . 4.860 4.117 3.878 4.421 . 0 0 "[ . 1 . 2]" 1
3437 1 114 LEU MD2 1 115 SER H . . 5.690 4.813 4.750 4.896 . 0 0 "[ . 1 . 2]" 1
3438 1 114 LEU HG 1 115 SER H . . 4.260 4.162 4.070 4.270 0.010 15 0 "[ . 1 . 2]" 1
3439 1 114 LEU HG 1 115 SER HA . . 4.660 4.275 4.049 4.491 . 0 0 "[ . 1 . 2]" 1
3440 1 115 SER H 1 115 SER QB . . 2.770 2.358 2.228 2.501 . 0 0 "[ . 1 . 2]" 1
3441 1 115 SER H 1 116 LYS H . . 3.290 2.706 2.650 2.790 . 0 0 "[ . 1 . 2]" 1
3442 1 115 SER HA 1 115 SER QB . . 2.560 2.410 2.372 2.499 . 0 0 "[ . 1 . 2]" 1
3443 1 115 SER HA 1 117 ILE H . . 4.520 4.183 4.057 4.354 . 0 0 "[ . 1 . 2]" 1
3444 1 115 SER HA 1 117 ILE HG12 . . 5.720 5.352 5.166 5.578 . 0 0 "[ . 1 . 2]" 1
3445 1 115 SER HA 1 118 LYS H . . 3.910 3.319 3.084 3.672 . 0 0 "[ . 1 . 2]" 1
3446 1 115 SER HA 1 118 LYS HB2 . . 3.490 2.841 2.454 3.313 . 0 0 "[ . 1 . 2]" 1
3447 1 115 SER HA 1 118 LYS QD . . 4.880 3.052 2.322 4.360 . 0 0 "[ . 1 . 2]" 1
3448 1 115 SER HA 1 118 LYS HG3 . . 4.420 3.771 3.451 4.250 . 0 0 "[ . 1 . 2]" 1
3449 1 115 SER QB 1 116 LYS H . . 3.450 2.909 2.753 3.147 . 0 0 "[ . 1 . 2]" 1
3450 1 115 SER QB 1 119 LYS QE . . 4.270 3.126 2.075 4.117 . 0 0 "[ . 1 . 2]" 1
3451 1 115 SER QB 1 119 LYS QG . . 4.500 3.893 3.211 5.839 1.339 9 1 "[ . +1 . 2]" 1
3452 1 116 LYS H 1 116 LYS QB . . 3.090 2.575 2.486 2.639 . 0 0 "[ . 1 . 2]" 1
3453 1 116 LYS H 1 116 LYS QD . . 4.080 3.801 3.662 3.969 . 0 0 "[ . 1 . 2]" 1
3454 1 116 LYS H 1 116 LYS QE . . 4.720 4.150 3.932 4.344 . 0 0 "[ . 1 . 2]" 1
3455 1 116 LYS H 1 116 LYS HG2 . . 3.760 3.175 3.080 3.298 . 0 0 "[ . 1 . 2]" 1
3456 1 116 LYS H 1 116 LYS HG3 . . 3.290 2.015 1.926 2.165 . 0 0 "[ . 1 . 2]" 1
3457 1 116 LYS H 1 117 ILE H . . 3.090 2.548 2.376 2.617 . 0 0 "[ . 1 . 2]" 1
3458 1 116 LYS H 1 117 ILE HB . . 5.120 4.974 4.815 5.112 . 0 0 "[ . 1 . 2]" 1
3459 1 116 LYS H 1 117 ILE MD . . 4.510 4.538 4.521 4.551 0.041 7 0 "[ . 1 . 2]" 1
3460 1 116 LYS H 1 117 ILE HG12 . . 4.340 3.861 3.761 3.997 . 0 0 "[ . 1 . 2]" 1
3461 1 116 LYS H 1 118 LYS H . . 4.230 4.116 3.949 4.233 0.003 20 0 "[ . 1 . 2]" 1
3462 1 116 LYS HA 1 116 LYS QB . . 2.710 2.326 2.296 2.351 . 0 0 "[ . 1 . 2]" 1
3463 1 116 LYS HA 1 116 LYS QD . . 4.180 4.034 3.912 4.097 . 0 0 "[ . 1 . 2]" 1
3464 1 116 LYS HA 1 116 LYS HG2 . . 3.380 2.625 2.558 2.686 . 0 0 "[ . 1 . 2]" 1
3465 1 116 LYS QB 1 116 LYS QD . . 3.160 2.160 2.069 2.209 . 0 0 "[ . 1 . 2]" 1
3466 1 116 LYS QB 1 117 ILE H . . 3.020 2.683 2.562 2.765 . 0 0 "[ . 1 . 2]" 1
3467 1 116 LYS QB 1 117 ILE MD . . 3.330 3.095 2.921 3.286 . 0 0 "[ . 1 . 2]" 1
3468 1 116 LYS QD 1 116 LYS HG2 . . 2.560 2.403 2.363 2.454 . 0 0 "[ . 1 . 2]" 1
3469 1 116 LYS QD 1 117 ILE H . . 4.780 4.783 4.706 4.820 0.040 16 0 "[ . 1 . 2]" 1
3470 1 116 LYS HG2 1 117 ILE H . . 5.100 4.890 4.822 4.942 . 0 0 "[ . 1 . 2]" 1
3471 1 116 LYS HG3 1 117 ILE H . . 4.000 4.061 4.033 4.090 0.090 12 0 "[ . 1 . 2]" 1
3472 1 117 ILE H 1 117 ILE HB . . 3.240 2.746 2.686 2.801 . 0 0 "[ . 1 . 2]" 1
3473 1 117 ILE H 1 117 ILE MD . . 3.020 2.832 2.751 2.920 . 0 0 "[ . 1 . 2]" 1
3474 1 117 ILE H 1 117 ILE HG12 . . 3.300 1.985 1.922 2.066 . 0 0 "[ . 1 . 2]" 1
3475 1 117 ILE H 1 117 ILE HG13 . . 3.640 3.569 3.506 3.642 0.002 16 0 "[ . 1 . 2]" 1
3476 1 117 ILE H 1 117 ILE MG . . 3.960 3.846 3.809 3.879 . 0 0 "[ . 1 . 2]" 1
3477 1 117 ILE H 1 118 LYS H . . 3.010 2.676 2.616 2.753 . 0 0 "[ . 1 . 2]" 1
3478 1 117 ILE H 1 118 LYS HA . . 5.410 5.337 5.293 5.399 . 0 0 "[ . 1 . 2]" 1
3479 1 117 ILE HA 1 117 ILE MD . . 2.920 2.284 2.246 2.343 . 0 0 "[ . 1 . 2]" 1
3480 1 117 ILE HA 1 117 ILE HG12 . . 3.320 3.337 3.318 3.348 0.028 4 0 "[ . 1 . 2]" 1
3481 1 117 ILE HA 1 117 ILE MG . . 2.780 2.309 2.268 2.352 . 0 0 "[ . 1 . 2]" 1
3482 1 117 ILE HB 1 117 ILE MD . . 3.670 3.268 3.253 3.285 . 0 0 "[ . 1 . 2]" 1
3483 1 117 ILE HB 1 118 LYS H . . 2.910 2.708 2.524 2.907 . 0 0 "[ . 1 . 2]" 1
3484 1 117 ILE HB 1 118 LYS HA . . 4.240 4.153 3.939 4.250 0.010 10 0 "[ . 1 . 2]" 1
3485 1 117 ILE HB 1 118 LYS QE . . 4.870 4.145 3.612 4.900 0.030 19 0 "[ . 1 . 2]" 1
3486 1 117 ILE MD 1 118 LYS H . . 4.710 4.573 4.524 4.616 . 0 0 "[ . 1 . 2]" 1
3487 1 117 ILE HG12 1 117 ILE MG . . 3.320 3.217 3.202 3.229 . 0 0 "[ . 1 . 2]" 1
3488 1 117 ILE HG12 1 118 LYS H . . 4.080 3.990 3.885 4.091 0.011 9 0 "[ . 1 . 2]" 1
3489 1 117 ILE HG13 1 117 ILE MG . . 3.260 2.262 2.243 2.284 . 0 0 "[ . 1 . 2]" 1
3490 1 117 ILE MG 1 118 LYS H . . 3.890 3.750 3.557 3.877 . 0 0 "[ . 1 . 2]" 1
3491 1 117 ILE MG 1 118 LYS HA . . 3.810 3.722 3.445 3.840 0.030 3 0 "[ . 1 . 2]" 1
3492 1 117 ILE MG 1 118 LYS HB2 . . 5.240 5.223 5.039 5.270 0.030 10 0 "[ . 1 . 2]" 1
3493 1 118 LYS H 1 118 LYS HB2 . . 2.900 2.387 2.312 2.497 . 0 0 "[ . 1 . 2]" 1
3494 1 118 LYS H 1 118 LYS QE . . 4.750 4.453 3.487 4.762 0.012 19 0 "[ . 1 . 2]" 1
3495 1 118 LYS H 1 118 LYS HG3 . . 3.340 2.475 2.314 2.637 . 0 0 "[ . 1 . 2]" 1
3496 1 118 LYS HA 1 118 LYS HB3 . . 2.710 2.534 2.453 2.585 . 0 0 "[ . 1 . 2]" 1
3497 1 118 LYS HA 1 118 LYS QE . . 4.700 4.541 3.546 4.712 0.012 18 0 "[ . 1 . 2]" 1
3498 1 118 LYS HA 1 118 LYS HG2 . . 3.020 2.561 2.432 2.719 . 0 0 "[ . 1 . 2]" 1
3499 1 118 LYS HA 1 118 LYS HG3 . . 3.480 3.025 2.753 3.287 . 0 0 "[ . 1 . 2]" 1
3500 1 118 LYS HB2 1 118 LYS QE . . 4.620 3.870 2.154 4.055 . 0 0 "[ . 1 . 2]" 1
3501 1 118 LYS HB3 1 119 LYS H . . 3.870 3.782 3.489 3.908 0.038 19 0 "[ . 1 . 2]" 1
3502 1 119 LYS H 1 119 LYS HB2 . . 2.940 2.391 2.280 2.630 . 0 0 "[ . 1 . 2]" 1
3503 1 119 LYS H 1 119 LYS HB3 . . 4.110 3.608 3.535 3.770 . 0 0 "[ . 1 . 2]" 1
3504 1 119 LYS H 1 119 LYS QE . . 4.590 4.427 3.878 4.608 0.018 19 0 "[ . 1 . 2]" 1
3505 1 119 LYS H 1 119 LYS QG . . 3.270 2.508 2.355 3.291 0.021 9 0 "[ . 1 . 2]" 1
3506 1 119 LYS HA 1 119 LYS HB3 . . 2.680 2.537 2.420 2.638 . 0 0 "[ . 1 . 2]" 1
3507 1 119 LYS HA 1 119 LYS QE . . 4.400 4.402 4.051 4.442 0.042 16 0 "[ . 1 . 2]" 1
3508 1 119 LYS HA 1 119 LYS QG . . 2.900 2.346 2.268 2.922 0.022 14 0 "[ . 1 . 2]" 1
3509 1 119 LYS HA 1 120 LYS H . . 2.610 2.236 2.077 2.620 0.010 10 0 "[ . 1 . 2]" 1
3510 1 119 LYS HB2 1 119 LYS QE . . 4.920 4.005 3.856 4.272 . 0 0 "[ . 1 . 2]" 1
3511 1 120 LYS H 1 120 LYS HA . . 2.930 2.928 2.780 2.977 0.047 2 0 "[ . 1 . 2]" 1
3512 1 120 LYS H 1 120 LYS HB2 . . 2.830 2.497 2.295 2.734 . 0 0 "[ . 1 . 2]" 1
3513 1 120 LYS H 1 120 LYS QE . . 5.380 4.704 3.815 5.232 . 0 0 "[ . 1 . 2]" 1
3514 1 120 LYS H 1 120 LYS QG . . 3.140 2.671 2.041 3.147 0.007 5 0 "[ . 1 . 2]" 1
3515 1 120 LYS HA 1 120 LYS HB3 . . 2.820 2.505 2.408 2.619 . 0 0 "[ . 1 . 2]" 1
3516 1 120 LYS HA 1 120 LYS QE . . 4.310 4.259 3.606 4.372 0.062 19 0 "[ . 1 . 2]" 1
3517 1 120 LYS HA 1 120 LYS QG . . 3.490 2.465 2.222 3.158 . 0 0 "[ . 1 . 2]" 1
3518 2 2 GLY QA 2 3 PRO HA . . 4.160 4.022 3.874 4.136 . 0 0 "[ . 1 . 2]" 1
3519 2 2 GLY QA 2 3 PRO HB2 . . 5.240 5.229 5.177 5.257 0.017 4 0 "[ . 1 . 2]" 1
3520 2 2 GLY QA 2 3 PRO QB . . 4.370 4.223 4.072 4.375 0.005 15 0 "[ . 1 . 2]" 1
3521 2 2 GLY QA 2 3 PRO HB3 . . 5.240 4.461 4.259 4.681 . 0 0 "[ . 1 . 2]" 1
3522 2 2 GLY QA 2 3 PRO QD . . 3.000 2.053 2.016 2.105 . 0 0 "[ . 1 . 2]" 1
3523 2 2 GLY QA 2 3 PRO QG . . 4.310 3.797 3.733 3.843 . 0 0 "[ . 1 . 2]" 1
3524 2 2 GLY QA 2 4 THR H . . 4.570 4.005 3.152 4.582 0.012 12 0 "[ . 1 . 2]" 1
3525 2 3 PRO HA 2 4 THR H . . 2.950 2.579 2.118 2.956 0.006 4 0 "[ . 1 . 2]" 1
3526 2 3 PRO HA 2 4 THR HA . . 4.610 4.517 4.155 4.646 0.036 5 0 "[ . 1 . 2]" 1
3527 2 3 PRO HA 2 4 THR MG . . 4.760 4.688 4.443 4.812 0.052 4 0 "[ . 1 . 2]" 1
3528 2 3 PRO HA 2 5 ILE MG . . 6.000 5.895 5.076 6.051 0.051 2 0 "[ . 1 . 2]" 1
3529 2 3 PRO QD 2 4 THR H . . 4.610 4.105 3.458 4.580 . 0 0 "[ . 1 . 2]" 1
3530 2 3 PRO QG 2 4 THR MG . . 4.490 4.236 3.608 4.903 0.413 14 0 "[ . 1 . 2]" 1
3531 2 4 THR HA 2 4 THR HB . . 3.020 2.542 2.475 2.622 . 0 0 "[ . 1 . 2]" 1
3532 2 4 THR HA 2 4 THR MG . . 2.430 2.265 2.193 2.306 . 0 0 "[ . 1 . 2]" 1
3533 2 4 THR HA 2 5 ILE H . . 3.400 2.211 2.150 2.364 . 0 0 "[ . 1 . 2]" 1
3534 2 4 THR HA 2 5 ILE HA . . 4.500 4.255 4.165 4.316 . 0 0 "[ . 1 . 2]" 1
3535 2 4 THR HA 2 5 ILE MD . . 6.000 5.295 5.150 5.530 . 0 0 "[ . 1 . 2]" 1
3536 2 4 THR HA 2 5 ILE HG12 . . 5.470 4.783 4.662 4.943 . 0 0 "[ . 1 . 2]" 1
3537 2 4 THR HA 2 5 ILE MG . . 3.600 3.218 3.043 3.380 . 0 0 "[ . 1 . 2]" 1
3538 2 4 THR HB 2 5 ILE H . . 3.420 2.527 2.423 2.624 . 0 0 "[ . 1 . 2]" 1
3539 2 4 THR HB 2 5 ILE MG . . 4.210 4.262 4.232 4.298 0.088 18 0 "[ . 1 . 2]" 1
3540 2 4 THR HB 2 6 GLU H . . 3.840 2.640 2.268 2.934 . 0 0 "[ . 1 . 2]" 1
3541 2 4 THR HB 2 6 GLU HB3 . . 5.460 5.036 4.534 5.515 0.055 13 0 "[ . 1 . 2]" 1
3542 2 4 THR HB 2 6 GLU QG . . 5.080 3.122 2.337 3.659 . 0 0 "[ . 1 . 2]" 1
3543 2 4 THR HB 2 7 GLU QB . . 4.210 4.245 4.224 4.268 0.058 16 0 "[ . 1 . 2]" 1
3544 2 4 THR HB 2 7 GLU QG . . 5.120 4.558 3.562 5.145 0.025 6 0 "[ . 1 . 2]" 1
3545 2 4 THR MG 2 5 ILE H . . 3.460 3.286 3.177 3.413 . 0 0 "[ . 1 . 2]" 1
3546 2 4 THR MG 2 6 GLU QG . . 3.780 3.884 3.180 4.453 0.673 15 2 "[ . 1 - + 2]" 1
3547 2 4 THR MG 2 7 GLU H . . 5.550 5.107 4.727 5.347 . 0 0 "[ . 1 . 2]" 1
3548 2 4 THR MG 2 7 GLU QG . . 4.940 4.890 4.116 5.580 0.640 14 4 "[ . * +- * 2]" 1
3549 2 5 ILE H 2 5 ILE HB . . 3.780 3.615 3.586 3.680 . 0 0 "[ . 1 . 2]" 1
3550 2 5 ILE H 2 5 ILE MD . . 3.880 3.692 3.634 3.811 . 0 0 "[ . 1 . 2]" 1
3551 2 5 ILE H 2 5 ILE HG12 . . 4.140 2.647 2.570 2.838 . 0 0 "[ . 1 . 2]" 1
3552 2 5 ILE H 2 5 ILE MG . . 3.260 2.147 1.879 2.269 . 0 0 "[ . 1 . 2]" 1
3553 2 5 ILE HA 2 5 ILE MD . . 4.190 4.200 4.188 4.214 0.024 17 0 "[ . 1 . 2]" 1
3554 2 5 ILE HA 2 5 ILE HG12 . . 4.180 3.781 3.751 3.817 . 0 0 "[ . 1 . 2]" 1
3555 2 5 ILE HA 2 5 ILE HG13 . . 4.220 3.685 3.660 3.714 . 0 0 "[ . 1 . 2]" 1
3556 2 5 ILE HA 2 5 ILE MG . . 3.010 2.480 2.425 2.568 . 0 0 "[ . 1 . 2]" 1
3557 2 5 ILE HA 2 6 GLU HA . . 5.030 4.649 4.590 4.730 . 0 0 "[ . 1 . 2]" 1
3558 2 5 ILE HA 2 6 GLU QG . . 5.430 5.384 5.039 5.494 0.064 13 0 "[ . 1 . 2]" 1
3559 2 5 ILE HA 2 7 GLU H . . 5.300 3.834 3.552 4.084 . 0 0 "[ . 1 . 2]" 1
3560 2 5 ILE HB 2 5 ILE MD . . 3.100 2.544 2.477 2.585 . 0 0 "[ . 1 . 2]" 1
3561 2 5 ILE MD 2 5 ILE MG . . 2.740 2.033 1.983 2.057 . 0 0 "[ . 1 . 2]" 1
3562 2 5 ILE MD 2 6 GLU H . . 4.800 4.287 4.156 4.405 . 0 0 "[ . 1 . 2]" 1
3563 2 5 ILE MD 2 6 GLU HA . . 5.760 4.815 4.653 4.937 . 0 0 "[ . 1 . 2]" 1
3564 2 5 ILE MD 2 6 GLU HB3 . . 5.060 4.228 3.886 4.484 . 0 0 "[ . 1 . 2]" 1
3565 2 5 ILE MD 2 6 GLU QG . . 4.990 5.010 4.518 5.539 0.549 15 1 "[ . 1 + 2]" 1
3566 2 5 ILE HG12 2 5 ILE MG . . 3.400 2.605 2.548 2.784 . 0 0 "[ . 1 . 2]" 1
3567 2 5 ILE HG12 2 6 GLU H . . 4.470 2.676 2.531 2.829 . 0 0 "[ . 1 . 2]" 1
3568 2 5 ILE HG12 2 6 GLU HA . . 4.480 4.120 3.917 4.293 . 0 0 "[ . 1 . 2]" 1
3569 2 5 ILE HG12 2 6 GLU QG . . 4.620 3.888 3.341 4.549 . 0 0 "[ . 1 . 2]" 1
3570 2 5 ILE HG13 2 5 ILE MG . . 3.220 3.225 3.206 3.245 0.025 8 0 "[ . 1 . 2]" 1
3571 2 5 ILE HG13 2 6 GLU H . . 3.580 3.345 3.149 3.521 . 0 0 "[ . 1 . 2]" 1
3572 2 5 ILE HG13 2 6 GLU HA . . 4.420 3.396 3.222 3.540 . 0 0 "[ . 1 . 2]" 1
3573 2 5 ILE HG13 2 6 GLU HB3 . . 5.130 3.438 3.018 3.728 . 0 0 "[ . 1 . 2]" 1
3574 2 5 ILE HG13 2 7 GLU H . . 6.000 5.098 4.847 5.370 . 0 0 "[ . 1 . 2]" 1
3575 2 5 ILE MG 2 6 GLU HA . . 5.480 5.438 5.320 5.492 0.012 1 0 "[ . 1 . 2]" 1
3576 2 5 ILE MG 2 6 GLU QG . . 4.830 5.225 4.713 5.656 0.826 15 6 "[* . * -1 * + * 2]" 1
3577 2 6 GLU H 2 6 GLU HB2 . . 4.010 3.695 3.637 3.734 . 0 0 "[ . 1 . 2]" 1
3578 2 6 GLU H 2 6 GLU HB3 . . 3.440 2.771 2.610 2.904 . 0 0 "[ . 1 . 2]" 1
3579 2 6 GLU H 2 6 GLU QG . . 3.610 2.186 1.930 2.374 . 0 0 "[ . 1 . 2]" 1
3580 2 6 GLU H 2 7 GLU H . . 3.690 2.622 2.480 2.817 . 0 0 "[ . 1 . 2]" 1
3581 2 6 GLU HA 2 6 GLU QG . . 3.680 3.364 3.335 3.417 . 0 0 "[ . 1 . 2]" 1
3582 2 6 GLU HA 2 8 VAL MG1 . . 6.000 4.843 4.569 5.280 . 0 0 "[ . 1 . 2]" 1
3583 2 6 GLU HB2 2 6 GLU QG . . 2.670 2.392 2.182 2.490 . 0 0 "[ . 1 . 2]" 1
3584 2 6 GLU QG 2 7 GLU H . . 4.510 3.258 2.912 3.784 . 0 0 "[ . 1 . 2]" 1
3585 2 6 GLU QG 2 7 GLU HA . . 4.560 4.279 3.994 4.593 0.033 10 0 "[ . 1 . 2]" 1
3586 2 7 GLU H 2 7 GLU QG . . 4.580 3.015 2.152 3.558 . 0 0 "[ . 1 . 2]" 1
3587 2 7 GLU HA 2 7 GLU HG2 . . 3.880 2.765 2.180 3.858 . 0 0 "[ . 1 . 2]" 1
3588 2 7 GLU HA 2 7 GLU QG . . 3.410 2.627 2.140 3.363 . 0 0 "[ . 1 . 2]" 1
3589 2 7 GLU HA 2 7 GLU HG3 . . 3.880 3.511 2.543 3.794 . 0 0 "[ . 1 . 2]" 1
3590 2 7 GLU HA 2 8 VAL H . . 3.150 2.311 2.121 2.485 . 0 0 "[ . 1 . 2]" 1
3591 2 7 GLU HA 2 8 VAL MG1 . . 4.480 3.814 3.564 4.201 . 0 0 "[ . 1 . 2]" 1
3592 2 7 GLU HA 2 8 VAL MG2 . . 3.880 3.490 3.335 3.793 . 0 0 "[ . 1 . 2]" 1
3593 2 7 GLU QB 2 8 VAL H . . 4.240 2.749 2.428 3.163 . 0 0 "[ . 1 . 2]" 1
3594 2 7 GLU QG 2 8 VAL H . . 4.300 3.785 3.059 4.319 0.019 2 0 "[ . 1 . 2]" 1
3595 2 7 GLU HG2 2 8 VAL H . . 4.880 4.235 3.367 4.901 0.021 2 0 "[ . 1 . 2]" 1
3596 2 7 GLU HG2 2 8 VAL MG2 . . 6.000 5.311 4.214 6.010 0.010 2 0 "[ . 1 . 2]" 1
3597 2 7 GLU HG3 2 8 VAL H . . 4.880 4.465 3.129 4.901 0.021 13 0 "[ . 1 . 2]" 1
3598 2 7 GLU HG3 2 8 VAL MG2 . . 6.000 5.644 4.774 6.032 0.032 9 0 "[ . 1 . 2]" 1
3599 2 8 VAL H 2 8 VAL MG1 . . 4.560 3.078 2.910 3.324 . 0 0 "[ . 1 . 2]" 1
3600 2 8 VAL H 2 8 VAL MG2 . . 2.580 2.117 1.958 2.332 . 0 0 "[ . 1 . 2]" 1
3601 2 8 VAL H 2 9 ASP H . . 5.000 4.560 4.457 4.629 . 0 0 "[ . 1 . 2]" 1
3602 2 8 VAL H 2 9 ASP HA . . 5.070 5.018 4.758 5.128 0.058 5 0 "[ . 1 . 2]" 1
3603 2 8 VAL HA 2 8 VAL MG1 . . 3.480 2.212 2.188 2.239 . 0 0 "[ . 1 . 2]" 1
3604 2 8 VAL HA 2 8 VAL MG2 . . 3.630 3.271 3.251 3.285 . 0 0 "[ . 1 . 2]" 1
3605 2 8 VAL HA 2 9 ASP H . . 3.290 2.239 2.138 2.301 . 0 0 "[ . 1 . 2]" 1
3606 2 8 VAL HA 2 9 ASP HA . . 4.380 4.260 4.054 4.360 . 0 0 "[ . 1 . 2]" 1
3607 2 8 VAL HA 2 9 ASP HB2 . . 4.650 4.016 3.655 4.291 . 0 0 "[ . 1 . 2]" 1
3608 2 8 VAL HA 2 9 ASP HB3 . . 5.650 5.266 5.081 5.427 . 0 0 "[ . 1 . 2]" 1
3609 2 8 VAL HB 2 9 ASP H . . 3.860 2.880 2.697 3.053 . 0 0 "[ . 1 . 2]" 1
3610 2 8 VAL MG1 2 9 ASP H . . 4.660 3.530 3.375 3.628 . 0 0 "[ . 1 . 2]" 1
3611 2 8 VAL MG1 2 9 ASP HA . . 6.000 5.553 5.434 5.613 . 0 0 "[ . 1 . 2]" 1
3612 2 8 VAL MG2 2 9 ASP H . . 4.350 4.053 3.890 4.142 . 0 0 "[ . 1 . 2]" 1
3613 2 8 VAL MG2 2 9 ASP HA . . 4.980 4.745 4.640 4.867 . 0 0 "[ . 1 . 2]" 1
stop_
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