NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
511123 |
2l4w   |
17257 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l4w
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 2031
_Distance_constraint_stats_list.Viol_count 2164
_Distance_constraint_stats_list.Viol_total 1907.837
_Distance_constraint_stats_list.Viol_max 0.544
_Distance_constraint_stats_list.Viol_rms 0.0136
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0023
_Distance_constraint_stats_list.Viol_average_violations_only 0.0441
_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 5 THR 0.975 0.189 9 0 "[ . 1 . 2]"
1 6 LYS 0.291 0.189 9 0 "[ . 1 . 2]"
1 7 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ALA 0.549 0.104 3 0 "[ . 1 . 2]"
1 9 PRO 0.673 0.104 3 0 "[ . 1 . 2]"
1 10 ASP 0.862 0.123 20 0 "[ . 1 . 2]"
1 11 PHE 1.642 0.544 1 1 "[+ . 1 . 2]"
1 12 GLY 0.385 0.063 3 0 "[ . 1 . 2]"
1 13 GLY 0.549 0.087 10 0 "[ . 1 . 2]"
1 14 ARG 1.151 0.188 1 0 "[ . 1 . 2]"
1 15 TRP 1.818 0.431 11 0 "[ . 1 . 2]"
1 16 LYS 0.777 0.127 16 0 "[ . 1 . 2]"
1 17 HIS 1.863 0.130 1 0 "[ . 1 . 2]"
1 18 VAL 2.656 0.130 1 0 "[ . 1 . 2]"
1 19 ASN 0.646 0.130 9 0 "[ . 1 . 2]"
1 20 HIS 0.116 0.114 2 0 "[ . 1 . 2]"
1 21 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 ASP 0.061 0.033 14 0 "[ . 1 . 2]"
1 23 GLU 1.782 0.229 7 0 "[ . 1 . 2]"
1 24 ALA 2.632 0.229 7 0 "[ . 1 . 2]"
1 25 PRO 0.635 0.078 8 0 "[ . 1 . 2]"
1 26 THR 0.892 0.108 10 0 "[ . 1 . 2]"
1 27 GLU 0.761 0.109 18 0 "[ . 1 . 2]"
1 28 ILE 0.572 0.109 18 0 "[ . 1 . 2]"
1 29 PRO 0.601 0.192 1 0 "[ . 1 . 2]"
1 30 LEU 2.213 0.192 1 0 "[ . 1 . 2]"
1 31 TYR 1.626 0.106 18 0 "[ . 1 . 2]"
1 32 THR 4.822 0.160 7 0 "[ . 1 . 2]"
1 33 SER 2.700 0.121 4 0 "[ . 1 . 2]"
1 34 TYR 3.369 0.152 11 0 "[ . 1 . 2]"
1 35 THR 2.238 0.149 6 0 "[ . 1 . 2]"
1 36 TYR 3.202 0.161 18 0 "[ . 1 . 2]"
1 37 GLN 2.397 0.144 6 0 "[ . 1 . 2]"
1 38 ALA 0.729 0.111 20 0 "[ . 1 . 2]"
1 39 THR 1.523 0.102 11 0 "[ . 1 . 2]"
1 40 PRO 0.448 0.061 13 0 "[ . 1 . 2]"
1 41 MET 1.032 0.118 4 0 "[ . 1 . 2]"
1 42 ASP 0.751 0.113 18 0 "[ . 1 . 2]"
1 43 GLY 1.029 0.118 4 0 "[ . 1 . 2]"
1 44 THR 2.661 0.123 3 0 "[ . 1 . 2]"
1 45 LEU 1.266 0.181 12 0 "[ . 1 . 2]"
1 46 LYS 1.051 0.166 5 0 "[ . 1 . 2]"
1 47 THR 1.857 0.123 3 0 "[ . 1 . 2]"
1 48 MET 1.219 0.083 14 0 "[ . 1 . 2]"
1 49 LEU 0.571 0.181 12 0 "[ . 1 . 2]"
1 50 GLU 0.271 0.060 20 0 "[ . 1 . 2]"
1 51 ARG 0.186 0.067 15 0 "[ . 1 . 2]"
1 52 TRP 1.162 0.083 14 0 "[ . 1 . 2]"
1 53 ALA 1.720 0.076 9 0 "[ . 1 . 2]"
1 54 ALA 0.771 0.091 2 0 "[ . 1 . 2]"
1 55 ASP 1.994 0.152 11 0 "[ . 1 . 2]"
1 56 SER 0.809 0.091 2 0 "[ . 1 . 2]"
1 57 ASN 0.496 0.065 3 0 "[ . 1 . 2]"
1 58 MET 3.692 0.192 17 0 "[ . 1 . 2]"
1 59 GLN 0.650 0.106 16 0 "[ . 1 . 2]"
1 60 LEU 2.887 0.174 5 0 "[ . 1 . 2]"
1 61 SER 4.507 0.174 5 0 "[ . 1 . 2]"
1 62 TYR 2.839 0.104 4 0 "[ . 1 . 2]"
1 63 ASN 0.489 0.089 17 0 "[ . 1 . 2]"
1 64 LEU 1.933 0.127 19 0 "[ . 1 . 2]"
1 65 PRO 0.255 0.058 1 0 "[ . 1 . 2]"
1 66 SER 0.385 0.058 1 0 "[ . 1 . 2]"
1 67 ASP 0.250 0.052 4 0 "[ . 1 . 2]"
1 68 TYR 0.800 0.079 8 0 "[ . 1 . 2]"
1 69 THR 0.386 0.107 16 0 "[ . 1 . 2]"
1 70 LEU 6.240 0.279 2 0 "[ . 1 . 2]"
1 71 ILE 1.293 0.111 2 0 "[ . 1 . 2]"
1 72 GLY 0.734 0.074 7 0 "[ . 1 . 2]"
1 73 PRO 0.186 0.039 15 0 "[ . 1 . 2]"
1 74 VAL 3.817 0.197 14 0 "[ . 1 . 2]"
1 75 SER 3.000 0.197 14 0 "[ . 1 . 2]"
1 76 ALA 0.257 0.035 2 0 "[ . 1 . 2]"
1 77 ILE 3.517 0.092 11 0 "[ . 1 . 2]"
1 78 SER 1.249 0.089 3 0 "[ . 1 . 2]"
1 79 THR 1.663 0.130 8 0 "[ . 1 . 2]"
1 80 THR 2.153 0.130 8 0 "[ . 1 . 2]"
1 81 SER 0.370 0.071 14 0 "[ . 1 . 2]"
1 82 VAL 0.913 0.161 18 0 "[ . 1 . 2]"
1 83 GLN 0.959 0.095 3 0 "[ . 1 . 2]"
1 84 GLN 2.228 0.120 14 0 "[ . 1 . 2]"
1 85 ALA 0.773 0.085 17 0 "[ . 1 . 2]"
1 86 ALA 0.681 0.072 19 0 "[ . 1 . 2]"
1 87 THR 1.577 0.083 6 0 "[ . 1 . 2]"
1 88 GLU 0.920 0.066 1 0 "[ . 1 . 2]"
1 89 LEU 3.860 0.189 20 0 "[ . 1 . 2]"
1 90 SER 1.728 0.066 17 0 "[ . 1 . 2]"
1 91 ALA 1.157 0.066 1 0 "[ . 1 . 2]"
1 92 VAL 3.325 0.189 20 0 "[ . 1 . 2]"
1 93 TYR 2.288 0.119 4 0 "[ . 1 . 2]"
1 94 ALA 1.527 0.089 19 0 "[ . 1 . 2]"
1 95 ALA 0.264 0.059 2 0 "[ . 1 . 2]"
1 96 GLN 0.196 0.057 4 0 "[ . 1 . 2]"
1 97 GLY 0.087 0.041 5 0 "[ . 1 . 2]"
1 98 VAL 2.265 0.089 19 0 "[ . 1 . 2]"
1 99 SER 2.442 0.135 11 0 "[ . 1 . 2]"
1 100 VAL 2.442 0.112 6 0 "[ . 1 . 2]"
1 101 SER 0.662 0.072 19 0 "[ . 1 . 2]"
1 102 VAL 7.214 0.263 17 0 "[ . 1 . 2]"
1 103 SER 2.380 0.178 13 0 "[ . 1 . 2]"
1 104 ALA 0.573 0.114 10 0 "[ . 1 . 2]"
1 105 ASN 0.654 0.135 2 0 "[ . 1 . 2]"
1 106 LYS 2.742 0.152 14 0 "[ . 1 . 2]"
1 107 LEU 5.679 0.263 17 0 "[ . 1 . 2]"
1 108 LEU 2.666 0.107 14 0 "[ . 1 . 2]"
1 109 VAL 1.152 0.085 3 0 "[ . 1 . 2]"
1 110 GLN 0.419 0.068 11 0 "[ . 1 . 2]"
1 111 PRO 0.845 0.081 3 0 "[ . 1 . 2]"
1 112 VAL 4.800 0.135 11 0 "[ . 1 . 2]"
1 113 PRO 1.699 0.086 11 0 "[ . 1 . 2]"
1 114 VAL 3.157 0.162 16 0 "[ . 1 . 2]"
1 115 SER 1.597 0.162 16 0 "[ . 1 . 2]"
1 119 LYS 0.000 0.000 . 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 5 THR HA 1 5 THR HB 2.840 . 2.840 2.732 2.456 2.996 0.156 13 0 "[ . 1 . 2]" 1
2 1 5 THR HA 1 5 THR MG 3.490 . 3.490 2.543 2.141 3.225 . 0 0 "[ . 1 . 2]" 1
3 1 5 THR HA 1 6 LYS H 3.460 . 3.460 2.407 2.148 3.492 0.032 2 0 "[ . 1 . 2]" 1
4 1 5 THR HA 1 6 LYS QB 4.670 . 4.670 4.336 3.898 4.859 0.189 9 0 "[ . 1 . 2]" 1
5 1 6 LYS H 1 6 LYS HA 2.940 . 2.940 2.861 2.261 2.948 0.008 13 0 "[ . 1 . 2]" 1
6 1 6 LYS HA 1 7 PRO HD2 3.180 . 3.180 2.256 1.978 2.802 . 0 0 "[ . 1 . 2]" 1
7 1 6 LYS HA 1 7 PRO QD 2.780 . 2.780 2.004 1.905 2.229 . 0 0 "[ . 1 . 2]" 1
8 1 6 LYS HA 1 7 PRO HD3 3.180 . 3.180 2.341 2.002 2.815 . 0 0 "[ . 1 . 2]" 1
9 1 6 LYS QB 1 7 PRO QD 3.960 . 3.960 3.146 2.036 3.841 . 0 0 "[ . 1 . 2]" 1
10 1 7 PRO HA 1 8 ALA H 3.150 . 3.150 2.287 2.147 2.637 . 0 0 "[ . 1 . 2]" 1
11 1 8 ALA HA 1 9 PRO HD2 3.070 . 3.070 2.432 2.240 2.740 . 0 0 "[ . 1 . 2]" 1
12 1 8 ALA HA 1 9 PRO QD 2.660 . 2.660 2.032 1.789 2.164 . 0 0 "[ . 1 . 2]" 1
13 1 8 ALA HA 1 9 PRO HD3 3.070 . 3.070 2.235 1.813 2.555 . 0 0 "[ . 1 . 2]" 1
14 1 8 ALA HA 1 9 PRO QG 4.320 . 4.320 3.941 3.682 4.081 . 0 0 "[ . 1 . 2]" 1
15 1 8 ALA MB 1 9 PRO HD2 3.380 . 3.380 2.329 1.932 3.164 . 0 0 "[ . 1 . 2]" 1
16 1 8 ALA MB 1 9 PRO QD 2.950 . 2.950 2.273 1.920 2.894 . 0 0 "[ . 1 . 2]" 1
17 1 8 ALA MB 1 9 PRO HD3 3.380 . 3.380 3.367 3.116 3.484 0.104 3 0 "[ . 1 . 2]" 1
18 1 9 PRO HA 1 10 ASP H 3.110 . 3.110 2.331 2.124 2.886 . 0 0 "[ . 1 . 2]" 1
19 1 9 PRO QD 1 10 ASP H 4.960 . 4.960 4.731 3.429 5.001 0.041 16 0 "[ . 1 . 2]" 1
20 1 10 ASP H 1 10 ASP QB 3.750 . 3.750 2.383 2.122 2.871 . 0 0 "[ . 1 . 2]" 1
21 1 10 ASP QB 1 11 PHE H 4.410 . 4.410 2.601 2.119 3.973 . 0 0 "[ . 1 . 2]" 1
22 1 10 ASP QB 1 11 PHE QB 4.400 . 4.400 4.282 3.388 4.523 0.123 20 0 "[ . 1 . 2]" 1
23 1 11 PHE H 1 11 PHE QB 3.650 . 3.650 2.609 2.112 3.384 . 0 0 "[ . 1 . 2]" 1
24 1 11 PHE HA 1 11 PHE HD1 3.890 . 3.890 2.792 2.161 3.859 . 0 0 "[ . 1 . 2]" 1
25 1 11 PHE HA 1 11 PHE HE1 4.880 . 4.880 4.759 4.355 5.424 0.544 1 1 "[+ . 1 . 2]" 1
26 1 12 GLY H 1 13 GLY H 4.400 . 4.400 3.715 2.036 4.463 0.063 3 0 "[ . 1 . 2]" 1
27 1 12 GLY QA 1 14 ARG QB 4.790 . 4.790 4.507 3.839 4.851 0.061 6 0 "[ . 1 . 2]" 1
28 1 13 GLY QA 1 14 ARG HA 4.670 . 4.670 4.071 3.953 4.286 . 0 0 "[ . 1 . 2]" 1
29 1 13 GLY QA 1 14 ARG QB 5.050 . 5.050 4.344 3.878 4.673 . 0 0 "[ . 1 . 2]" 1
30 1 13 GLY QA 1 15 TRP HD1 5.500 . 5.500 5.376 4.937 5.587 0.087 10 0 "[ . 1 . 2]" 1
31 1 13 GLY QA 1 16 LYS QD 4.550 . 4.550 3.518 2.278 4.464 . 0 0 "[ . 1 . 2]" 1
32 1 13 GLY QA 1 16 LYS QE 4.170 . 4.170 3.096 2.032 4.218 0.048 9 0 "[ . 1 . 2]" 1
33 1 13 GLY QA 1 16 LYS QG 4.190 . 4.190 3.110 1.973 4.209 0.019 19 0 "[ . 1 . 2]" 1
34 1 14 ARG H 1 14 ARG QB 3.910 . 3.910 2.373 2.140 2.954 . 0 0 "[ . 1 . 2]" 1
35 1 14 ARG H 1 14 ARG QG 4.280 . 4.280 3.408 2.202 4.381 0.101 2 0 "[ . 1 . 2]" 1
36 1 14 ARG HA 1 14 ARG QD 4.030 . 4.030 3.676 1.967 4.218 0.188 1 0 "[ . 1 . 2]" 1
37 1 14 ARG HA 1 14 ARG QG 3.410 . 3.410 2.547 2.187 3.353 . 0 0 "[ . 1 . 2]" 1
38 1 14 ARG HA 1 15 TRP QB 5.340 . 5.340 5.075 3.993 5.428 0.088 20 0 "[ . 1 . 2]" 1
39 1 14 ARG HA 1 15 TRP HD1 5.450 . 5.450 4.889 3.372 5.496 0.046 12 0 "[ . 1 . 2]" 1
40 1 14 ARG QB 1 14 ARG QD 3.130 . 3.130 2.235 2.067 2.652 . 0 0 "[ . 1 . 2]" 1
41 1 14 ARG QB 1 15 TRP H 4.610 . 4.610 2.878 1.799 3.848 . 0 0 "[ . 1 . 2]" 1
42 1 14 ARG QB 1 15 TRP HD1 5.200 . 5.200 3.044 1.937 5.179 . 0 0 "[ . 1 . 2]" 1
43 1 14 ARG QD 1 15 TRP HD1 5.130 . 5.130 4.245 3.136 5.157 0.027 16 0 "[ . 1 . 2]" 1
44 1 14 ARG QG 1 15 TRP HD1 5.350 . 5.350 3.967 2.093 5.061 . 0 0 "[ . 1 . 2]" 1
45 1 15 TRP H 1 15 TRP QB 3.600 . 3.600 2.653 2.207 3.372 . 0 0 "[ . 1 . 2]" 1
46 1 15 TRP HA 1 15 TRP HD1 3.870 . 3.870 3.828 3.549 4.301 0.431 11 0 "[ . 1 . 2]" 1
47 1 15 TRP HA 1 15 TRP HE3 3.840 . 3.840 3.620 3.268 4.115 0.275 11 0 "[ . 1 . 2]" 1
48 1 15 TRP QB 1 15 TRP HD1 3.380 . 3.380 2.705 2.602 2.774 . 0 0 "[ . 1 . 2]" 1
49 1 15 TRP QB 1 16 LYS HA 5.340 . 5.340 4.209 3.836 4.502 . 0 0 "[ . 1 . 2]" 1
50 1 16 LYS H 1 16 LYS QD 4.950 . 4.950 4.115 2.638 4.716 . 0 0 "[ . 1 . 2]" 1
51 1 16 LYS H 1 16 LYS QG 4.650 . 4.650 2.664 2.016 3.136 . 0 0 "[ . 1 . 2]" 1
52 1 16 LYS HA 1 16 LYS QD 4.110 . 4.110 3.714 1.941 4.237 0.127 16 0 "[ . 1 . 2]" 1
53 1 16 LYS HA 1 16 LYS QG 3.510 . 3.510 2.686 2.262 3.371 . 0 0 "[ . 1 . 2]" 1
54 1 16 LYS HA 1 17 HIS QB 5.340 . 5.340 4.692 4.222 5.254 . 0 0 "[ . 1 . 2]" 1
55 1 16 LYS HA 1 18 VAL MG1 4.410 . 4.410 4.083 3.426 4.454 0.044 2 0 "[ . 1 . 2]" 1
56 1 16 LYS HA 1 18 VAL MG2 4.790 . 4.790 3.755 2.620 4.834 0.044 7 0 "[ . 1 . 2]" 1
57 1 16 LYS QB 1 18 VAL MG2 5.260 . 5.260 3.707 2.606 5.022 . 0 0 "[ . 1 . 2]" 1
58 1 16 LYS QD 1 18 VAL MG2 5.500 . 5.500 4.726 3.839 5.532 0.032 19 0 "[ . 1 . 2]" 1
59 1 16 LYS QE 1 16 LYS QG 3.290 . 3.290 2.255 2.128 2.588 . 0 0 "[ . 1 . 2]" 1
60 1 17 HIS HA 1 17 HIS HD2 4.330 . 4.330 3.306 2.759 4.236 . 0 0 "[ . 1 . 2]" 1
61 1 17 HIS HA 1 18 VAL MG2 3.850 . 3.850 3.687 3.187 3.878 0.028 20 0 "[ . 1 . 2]" 1
62 1 17 HIS HD2 1 18 VAL MG1 4.540 . 4.540 4.582 4.449 4.670 0.130 1 0 "[ . 1 . 2]" 1
63 1 17 HIS HD2 1 18 VAL MG2 4.980 . 4.980 4.887 4.000 5.092 0.112 11 0 "[ . 1 . 2]" 1
64 1 17 HIS HD2 1 19 ASN QB 5.140 . 5.140 4.380 3.112 5.193 0.053 19 0 "[ . 1 . 2]" 1
65 1 18 VAL H 1 18 VAL MG1 4.440 . 4.440 3.312 2.729 3.586 . 0 0 "[ . 1 . 2]" 1
66 1 18 VAL H 1 18 VAL MG2 4.330 . 4.330 2.186 1.983 2.289 . 0 0 "[ . 1 . 2]" 1
67 1 18 VAL HA 1 18 VAL MG1 3.020 . 3.020 2.237 2.172 2.352 . 0 0 "[ . 1 . 2]" 1
68 1 18 VAL HA 1 18 VAL MG2 3.250 . 3.250 3.170 3.118 3.208 . 0 0 "[ . 1 . 2]" 1
69 1 18 VAL HB 1 19 ASN QB 4.970 . 4.970 4.924 4.469 5.100 0.130 9 0 "[ . 1 . 2]" 1
70 1 18 VAL MG1 1 19 ASN QB 5.500 . 5.500 5.299 4.914 5.538 0.038 5 0 "[ . 1 . 2]" 1
71 1 18 VAL MG2 1 19 ASN HA 4.740 . 4.740 4.313 3.663 4.716 . 0 0 "[ . 1 . 2]" 1
72 1 18 VAL MG2 1 19 ASN QB 5.500 . 5.500 4.643 2.828 5.340 . 0 0 "[ . 1 . 2]" 1
73 1 20 HIS HA 1 20 HIS HD2 4.490 . 4.490 3.493 2.323 4.604 0.114 2 0 "[ . 1 . 2]" 1
74 1 21 PHE HA 1 21 PHE HD1 4.790 . 4.790 3.054 2.223 4.306 . 0 0 "[ . 1 . 2]" 1
75 1 21 PHE QB 1 22 ASP H 4.340 . 4.340 3.483 2.000 4.021 . 0 0 "[ . 1 . 2]" 1
76 1 22 ASP H 1 22 ASP QB 3.690 . 3.690 2.445 2.087 3.163 . 0 0 "[ . 1 . 2]" 1
77 1 22 ASP HA 1 23 GLU QG 5.500 . 5.500 4.397 3.491 5.533 0.033 14 0 "[ . 1 . 2]" 1
78 1 23 GLU HA 1 23 GLU QG 3.590 . 3.590 2.803 2.150 3.424 . 0 0 "[ . 1 . 2]" 1
79 1 23 GLU QB 1 24 ALA MB 4.260 . 4.260 4.012 3.089 4.400 0.140 5 0 "[ . 1 . 2]" 1
80 1 23 GLU QG 1 24 ALA HA 5.500 . 5.500 4.844 3.721 5.729 0.229 7 0 "[ . 1 . 2]" 1
81 1 23 GLU QG 1 24 ALA MB 5.310 . 5.310 4.660 2.811 5.451 0.141 7 0 "[ . 1 . 2]" 1
82 1 24 ALA HA 1 25 PRO HD2 3.970 . 3.970 2.396 2.235 2.872 . 0 0 "[ . 1 . 2]" 1
83 1 24 ALA HA 1 25 PRO HD3 3.970 . 3.970 2.291 1.891 2.592 . 0 0 "[ . 1 . 2]" 1
84 1 24 ALA MB 1 25 PRO HD2 3.420 . 3.420 2.314 2.046 3.156 . 0 0 "[ . 1 . 2]" 1
85 1 24 ALA MB 1 25 PRO HD3 3.420 . 3.420 3.399 3.014 3.498 0.078 8 0 "[ . 1 . 2]" 1
86 1 24 ALA MB 1 26 THR HA 4.670 . 4.670 4.573 4.208 4.756 0.086 10 0 "[ . 1 . 2]" 1
87 1 26 THR HA 1 26 THR MG 3.310 . 3.310 2.384 2.226 3.213 . 0 0 "[ . 1 . 2]" 1
88 1 26 THR MG 1 27 GLU QB 4.830 . 4.830 4.760 4.192 4.927 0.097 16 0 "[ . 1 . 2]" 1
89 1 26 THR MG 1 28 ILE MD 4.110 . 4.110 3.102 2.031 4.146 0.036 8 0 "[ . 1 . 2]" 1
90 1 26 THR MG 1 28 ILE QG 4.560 . 4.560 2.841 1.893 4.144 . 0 0 "[ . 1 . 2]" 1
91 1 26 THR MG 1 28 ILE MG 3.860 . 3.860 2.825 2.075 3.968 0.108 10 0 "[ . 1 . 2]" 1
92 1 27 GLU HA 1 27 GLU QG 3.710 . 3.710 2.657 2.163 3.485 . 0 0 "[ . 1 . 2]" 1
93 1 27 GLU HA 1 28 ILE MD 5.500 . 5.500 5.225 4.595 5.609 0.109 18 0 "[ . 1 . 2]" 1
94 1 27 GLU QB 1 28 ILE MG 4.660 . 4.660 4.464 3.108 4.736 0.076 5 0 "[ . 1 . 2]" 1
95 1 28 ILE HA 1 28 ILE MD 4.540 . 4.540 4.162 3.750 4.197 . 0 0 "[ . 1 . 2]" 1
96 1 28 ILE HA 1 28 ILE MG 3.460 . 3.460 2.258 2.175 2.383 . 0 0 "[ . 1 . 2]" 1
97 1 28 ILE HA 1 29 PRO HD2 3.610 . 3.610 2.388 1.997 3.075 . 0 0 "[ . 1 . 2]" 1
98 1 28 ILE HA 1 29 PRO HD3 3.610 . 3.610 2.307 1.864 2.786 . 0 0 "[ . 1 . 2]" 1
99 1 28 ILE MD 1 28 ILE MG 2.940 . 2.940 1.940 1.837 2.042 . 0 0 "[ . 1 . 2]" 1
100 1 28 ILE QG 1 28 ILE MG 3.020 . 3.020 2.331 2.272 2.525 . 0 0 "[ . 1 . 2]" 1
101 1 28 ILE HG12 1 28 ILE MG 3.550 . 3.550 2.420 2.325 3.155 . 0 0 "[ . 1 . 2]" 1
102 1 28 ILE HG13 1 28 ILE MG 3.550 . 3.550 3.176 2.657 3.208 . 0 0 "[ . 1 . 2]" 1
103 1 28 ILE MG 1 29 PRO HD2 4.680 . 4.680 3.375 2.495 4.436 . 0 0 "[ . 1 . 2]" 1
104 1 28 ILE MG 1 29 PRO QD 3.850 . 3.850 3.126 2.452 3.784 . 0 0 "[ . 1 . 2]" 1
105 1 28 ILE MG 1 29 PRO HD3 4.680 . 4.680 3.879 3.175 4.442 . 0 0 "[ . 1 . 2]" 1
106 1 29 PRO HA 1 30 LEU H 2.920 . 2.920 2.276 2.136 2.670 . 0 0 "[ . 1 . 2]" 1
107 1 29 PRO HB2 1 30 LEU H 4.370 . 4.370 3.830 2.676 4.294 . 0 0 "[ . 1 . 2]" 1
108 1 29 PRO HB3 1 30 LEU H 4.370 . 4.370 4.105 3.229 4.562 0.192 1 0 "[ . 1 . 2]" 1
109 1 30 LEU H 1 30 LEU QB 3.130 . 3.130 2.497 2.243 2.825 . 0 0 "[ . 1 . 2]" 1
110 1 30 LEU H 1 30 LEU QD 4.840 . 4.840 3.800 3.280 4.059 . 0 0 "[ . 1 . 2]" 1
111 1 30 LEU H 1 31 TYR HA 4.790 . 4.790 4.716 4.444 4.896 0.106 18 0 "[ . 1 . 2]" 1
112 1 30 LEU HA 1 30 LEU MD1 3.750 . 3.750 2.638 2.008 3.767 0.017 14 0 "[ . 1 . 2]" 1
113 1 30 LEU HA 1 30 LEU QD 2.940 . 2.940 2.075 1.852 2.921 . 0 0 "[ . 1 . 2]" 1
114 1 30 LEU HA 1 30 LEU MD2 3.750 . 3.750 2.816 1.875 3.860 0.110 6 0 "[ . 1 . 2]" 1
115 1 30 LEU HA 1 30 LEU HG 3.910 . 3.910 3.088 2.289 3.663 . 0 0 "[ . 1 . 2]" 1
116 1 30 LEU HA 1 31 TYR H 3.230 . 3.230 2.215 2.109 2.554 . 0 0 "[ . 1 . 2]" 1
117 1 30 LEU QD 1 32 THR HA 4.340 . 4.340 4.095 3.542 4.434 0.094 14 0 "[ . 1 . 2]" 1
118 1 30 LEU HG 1 31 TYR H 5.160 . 5.160 4.330 2.350 5.228 0.068 3 0 "[ . 1 . 2]" 1
119 1 31 TYR H 1 31 TYR HB2 4.180 . 4.180 2.503 2.258 3.023 . 0 0 "[ . 1 . 2]" 1
120 1 31 TYR H 1 31 TYR QB 3.480 . 3.480 2.380 2.233 2.619 . 0 0 "[ . 1 . 2]" 1
121 1 31 TYR H 1 31 TYR HB3 4.180 . 4.180 3.266 2.619 3.795 . 0 0 "[ . 1 . 2]" 1
122 1 31 TYR HA 1 31 TYR HD1 4.660 . 4.660 3.527 2.914 3.970 . 0 0 "[ . 1 . 2]" 1
123 1 31 TYR HA 1 31 TYR HD2 4.980 . 4.980 3.461 3.099 4.026 . 0 0 "[ . 1 . 2]" 1
124 1 31 TYR HA 1 31 TYR HE1 5.500 . 5.500 5.243 4.803 5.592 0.092 13 0 "[ . 1 . 2]" 1
125 1 31 TYR HA 1 31 TYR HE2 5.500 . 5.500 5.197 4.922 5.586 0.086 15 0 "[ . 1 . 2]" 1
126 1 31 TYR HA 1 32 THR H 3.110 . 3.110 2.176 2.107 2.294 . 0 0 "[ . 1 . 2]" 1
127 1 31 TYR HA 1 32 THR HA 4.470 . 4.470 4.379 4.307 4.469 . 0 0 "[ . 1 . 2]" 1
128 1 31 TYR HA 1 32 THR HB 5.470 . 5.470 5.240 5.029 5.477 0.007 15 0 "[ . 1 . 2]" 1
129 1 31 TYR HA 1 32 THR MG 5.470 . 5.470 5.139 4.986 5.258 . 0 0 "[ . 1 . 2]" 1
130 1 31 TYR QB 1 32 THR H 3.820 . 3.820 3.498 2.718 3.854 0.034 9 0 "[ . 1 . 2]" 1
131 1 31 TYR HB2 1 32 THR H 4.420 . 4.420 4.346 3.919 4.483 0.063 1 0 "[ . 1 . 2]" 1
132 1 31 TYR HB3 1 32 THR H 4.420 . 4.420 3.724 2.772 4.220 . 0 0 "[ . 1 . 2]" 1
133 1 32 THR H 1 32 THR HB 3.990 . 3.990 3.120 2.966 3.230 . 0 0 "[ . 1 . 2]" 1
134 1 32 THR H 1 32 THR MG 3.980 . 3.980 3.500 3.364 3.756 . 0 0 "[ . 1 . 2]" 1
135 1 32 THR HA 1 32 THR HB 2.780 . 2.780 2.897 2.865 2.940 0.160 7 0 "[ . 1 . 2]" 1
136 1 32 THR HA 1 32 THR MG 2.820 . 2.820 2.155 2.135 2.193 . 0 0 "[ . 1 . 2]" 1
137 1 32 THR HA 1 33 SER H 2.980 . 2.980 2.148 2.124 2.209 . 0 0 "[ . 1 . 2]" 1
138 1 32 THR HA 1 33 SER QB 5.180 . 5.180 4.544 4.331 4.697 . 0 0 "[ . 1 . 2]" 1
139 1 32 THR HB 1 33 SER H 3.940 . 3.940 3.850 3.498 3.996 0.056 3 0 "[ . 1 . 2]" 1
140 1 32 THR HB 1 33 SER HA 4.150 . 4.150 4.225 4.173 4.271 0.121 4 0 "[ . 1 . 2]" 1
141 1 32 THR MG 1 33 SER H 4.200 . 4.200 3.056 2.473 3.330 . 0 0 "[ . 1 . 2]" 1
142 1 32 THR MG 1 33 SER HA 4.640 . 4.640 4.429 4.025 4.674 0.034 18 0 "[ . 1 . 2]" 1
143 1 32 THR MG 1 33 SER QB 5.340 . 5.340 5.110 4.686 5.304 . 0 0 "[ . 1 . 2]" 1
144 1 32 THR MG 1 34 TYR HA 5.070 . 5.070 4.886 4.371 5.108 0.038 20 0 "[ . 1 . 2]" 1
145 1 33 SER H 1 33 SER HB2 4.190 . 4.190 2.903 2.713 3.012 . 0 0 "[ . 1 . 2]" 1
146 1 33 SER H 1 33 SER HB3 4.190 . 4.190 3.881 3.726 3.950 . 0 0 "[ . 1 . 2]" 1
147 1 33 SER H 1 34 TYR H 3.820 . 3.820 3.727 3.332 3.908 0.088 19 0 "[ . 1 . 2]" 1
148 1 33 SER HA 1 34 TYR H 2.920 . 2.920 2.194 2.120 2.293 . 0 0 "[ . 1 . 2]" 1
149 1 33 SER HA 1 80 THR MG 3.760 . 3.760 3.709 3.444 3.807 0.047 2 0 "[ . 1 . 2]" 1
150 1 33 SER QB 1 34 TYR H 3.750 . 3.750 3.671 3.511 3.809 0.059 8 0 "[ . 1 . 2]" 1
151 1 33 SER QB 1 80 THR HB 3.590 . 3.590 2.538 2.082 3.109 . 0 0 "[ . 1 . 2]" 1
152 1 33 SER QB 1 80 THR MG 3.040 . 3.040 2.166 1.935 2.553 . 0 0 "[ . 1 . 2]" 1
153 1 33 SER HB2 1 34 TYR H 4.550 . 4.550 4.371 4.254 4.462 . 0 0 "[ . 1 . 2]" 1
154 1 33 SER HB2 1 80 THR HB 4.250 . 4.250 3.920 3.309 4.289 0.039 4 0 "[ . 1 . 2]" 1
155 1 33 SER HB2 1 80 THR MG 3.610 . 3.610 2.599 2.334 3.030 . 0 0 "[ . 1 . 2]" 1
156 1 33 SER HB3 1 34 TYR H 4.550 . 4.550 3.951 3.719 4.223 . 0 0 "[ . 1 . 2]" 1
157 1 33 SER HB3 1 80 THR HB 4.250 . 4.250 2.575 2.092 3.191 . 0 0 "[ . 1 . 2]" 1
158 1 33 SER HB3 1 80 THR MG 3.610 . 3.610 2.350 2.048 2.853 . 0 0 "[ . 1 . 2]" 1
159 1 34 TYR H 1 34 TYR HB2 3.270 . 3.270 2.649 2.453 2.854 . 0 0 "[ . 1 . 2]" 1
160 1 34 TYR H 1 34 TYR HB3 3.210 . 3.210 2.429 2.304 2.599 . 0 0 "[ . 1 . 2]" 1
161 1 34 TYR H 1 34 TYR HD1 5.500 . 5.500 4.706 4.519 4.856 . 0 0 "[ . 1 . 2]" 1
162 1 34 TYR H 1 34 TYR HD2 5.230 . 5.230 4.711 4.520 4.884 . 0 0 "[ . 1 . 2]" 1
163 1 34 TYR H 1 35 THR H 4.530 . 4.530 4.504 4.415 4.559 0.029 8 0 "[ . 1 . 2]" 1
164 1 34 TYR H 1 80 THR MG 4.380 . 4.380 3.929 3.616 4.267 . 0 0 "[ . 1 . 2]" 1
165 1 34 TYR HA 1 34 TYR HD1 3.930 . 3.930 2.268 2.119 2.424 . 0 0 "[ . 1 . 2]" 1
166 1 34 TYR HA 1 34 TYR HE1 4.960 . 4.960 4.624 4.473 4.797 . 0 0 "[ . 1 . 2]" 1
167 1 34 TYR HA 1 35 THR H 2.790 . 2.790 2.146 2.125 2.171 . 0 0 "[ . 1 . 2]" 1
168 1 34 TYR HB2 1 34 TYR HE1 4.970 . 4.970 4.916 4.878 4.972 0.002 4 0 "[ . 1 . 2]" 1
169 1 34 TYR HB2 1 35 THR H 4.490 . 4.490 4.214 4.072 4.351 . 0 0 "[ . 1 . 2]" 1
170 1 34 TYR HB3 1 34 TYR HD2 3.720 . 3.720 2.298 2.274 2.320 . 0 0 "[ . 1 . 2]" 1
171 1 34 TYR HB3 1 34 TYR HE2 4.870 . 4.870 4.605 4.586 4.618 . 0 0 "[ . 1 . 2]" 1
172 1 34 TYR HB3 1 35 THR H 4.390 . 4.390 4.233 4.060 4.387 . 0 0 "[ . 1 . 2]" 1
173 1 34 TYR HD1 1 35 THR H 4.280 . 4.280 2.765 2.489 3.176 . 0 0 "[ . 1 . 2]" 1
174 1 34 TYR HD2 1 36 TYR HE1 3.870 . 3.870 2.606 2.151 2.959 . 0 0 "[ . 1 . 2]" 1
175 1 34 TYR HE1 1 35 THR H 4.690 . 4.690 4.235 3.989 4.663 . 0 0 "[ . 1 . 2]" 1
176 1 34 TYR HE2 1 36 TYR HA 3.970 . 3.970 3.973 3.764 4.048 0.078 10 0 "[ . 1 . 2]" 1
177 1 34 TYR HE2 1 36 TYR HD1 4.030 . 4.030 3.142 2.820 3.404 . 0 0 "[ . 1 . 2]" 1
178 1 34 TYR HE2 1 36 TYR HE1 3.980 . 3.980 3.321 2.837 3.790 . 0 0 "[ . 1 . 2]" 1
179 1 34 TYR HE2 1 37 GLN H 5.240 . 5.240 5.127 4.888 5.345 0.105 11 0 "[ . 1 . 2]" 1
180 1 34 TYR HE2 1 52 TRP HA 4.950 . 4.950 2.255 1.830 3.547 . 0 0 "[ . 1 . 2]" 1
181 1 34 TYR HE2 1 55 ASP HA 5.500 . 5.500 5.596 5.556 5.652 0.152 11 0 "[ . 1 . 2]" 1
182 1 34 TYR HE2 1 55 ASP QB 3.880 . 3.880 2.734 2.580 3.143 . 0 0 "[ . 1 . 2]" 1
183 1 35 THR H 1 35 THR HB 3.230 . 3.230 2.652 2.535 2.757 . 0 0 "[ . 1 . 2]" 1
184 1 35 THR H 1 35 THR MG 4.220 . 4.220 3.782 3.763 3.812 . 0 0 "[ . 1 . 2]" 1
185 1 35 THR H 1 36 TYR H 4.750 . 4.750 4.405 4.272 4.491 . 0 0 "[ . 1 . 2]" 1
186 1 35 THR H 1 80 THR HA 5.220 . 5.220 4.578 4.236 4.857 . 0 0 "[ . 1 . 2]" 1
187 1 35 THR H 1 80 THR MG 4.440 . 4.440 3.584 3.229 3.890 . 0 0 "[ . 1 . 2]" 1
188 1 35 THR HA 1 35 THR MG 3.030 . 3.030 2.297 2.236 2.366 . 0 0 "[ . 1 . 2]" 1
189 1 35 THR HA 1 36 TYR H 2.860 . 2.860 2.120 2.082 2.151 . 0 0 "[ . 1 . 2]" 1
190 1 35 THR HA 1 80 THR H 4.660 . 4.660 4.337 4.213 4.466 . 0 0 "[ . 1 . 2]" 1
191 1 35 THR HA 1 80 THR HA 3.640 . 3.640 2.270 2.111 2.453 . 0 0 "[ . 1 . 2]" 1
192 1 35 THR HA 1 80 THR HB 5.070 . 5.070 4.610 4.412 4.798 . 0 0 "[ . 1 . 2]" 1
193 1 35 THR HA 1 80 THR MG 3.470 . 3.470 2.625 2.471 2.960 . 0 0 "[ . 1 . 2]" 1
194 1 35 THR HB 1 36 TYR H 4.110 . 4.110 4.168 4.073 4.259 0.149 6 0 "[ . 1 . 2]" 1
195 1 35 THR HB 1 37 GLN QB 4.820 . 4.820 4.363 3.780 4.800 . 0 0 "[ . 1 . 2]" 1
196 1 35 THR HB 1 80 THR MG 4.660 . 4.660 4.305 4.119 4.588 . 0 0 "[ . 1 . 2]" 1
197 1 35 THR MG 1 36 TYR H 3.390 . 3.390 2.906 2.766 3.141 . 0 0 "[ . 1 . 2]" 1
198 1 35 THR MG 1 37 GLN H 4.370 . 4.370 4.270 3.760 4.423 0.053 10 0 "[ . 1 . 2]" 1
199 1 35 THR MG 1 37 GLN HA 4.670 . 4.670 4.559 4.281 4.695 0.025 7 0 "[ . 1 . 2]" 1
200 1 35 THR MG 1 37 GLN QB 3.330 . 3.330 2.875 2.415 3.336 0.006 15 0 "[ . 1 . 2]" 1
201 1 35 THR MG 1 37 GLN QG 3.960 . 3.960 3.529 2.312 4.104 0.144 6 0 "[ . 1 . 2]" 1
202 1 35 THR MG 1 78 SER HA 3.360 . 3.360 2.955 2.759 3.191 . 0 0 "[ . 1 . 2]" 1
203 1 35 THR MG 1 78 SER HB2 4.730 . 4.730 3.352 2.562 4.053 . 0 0 "[ . 1 . 2]" 1
204 1 35 THR MG 1 78 SER QB 4.040 . 4.040 2.408 2.128 3.605 . 0 0 "[ . 1 . 2]" 1
205 1 35 THR MG 1 78 SER HB3 4.730 . 4.730 2.531 2.167 4.040 . 0 0 "[ . 1 . 2]" 1
206 1 35 THR MG 1 79 THR H 3.240 . 3.240 3.136 2.879 3.282 0.042 4 0 "[ . 1 . 2]" 1
207 1 35 THR MG 1 79 THR HA 4.050 . 4.050 3.334 3.051 3.645 . 0 0 "[ . 1 . 2]" 1
208 1 35 THR MG 1 79 THR MG 4.560 . 4.560 4.311 4.108 4.472 . 0 0 "[ . 1 . 2]" 1
209 1 35 THR MG 1 80 THR H 4.680 . 4.680 3.935 3.628 4.299 . 0 0 "[ . 1 . 2]" 1
210 1 35 THR MG 1 80 THR HA 4.380 . 4.380 3.562 3.283 3.920 . 0 0 "[ . 1 . 2]" 1
211 1 35 THR MG 1 80 THR MG 3.370 . 3.370 2.952 2.541 3.297 . 0 0 "[ . 1 . 2]" 1
212 1 36 TYR H 1 36 TYR HB2 3.380 . 3.380 2.465 2.394 2.559 . 0 0 "[ . 1 . 2]" 1
213 1 36 TYR H 1 36 TYR HD2 3.860 . 3.860 2.762 2.500 3.256 . 0 0 "[ . 1 . 2]" 1
214 1 36 TYR H 1 36 TYR HE2 5.500 . 5.500 4.675 4.335 4.961 . 0 0 "[ . 1 . 2]" 1
215 1 36 TYR H 1 79 THR H 3.720 . 3.720 3.340 3.227 3.548 . 0 0 "[ . 1 . 2]" 1
216 1 36 TYR H 1 79 THR MG 3.860 . 3.860 3.681 3.442 3.828 . 0 0 "[ . 1 . 2]" 1
217 1 36 TYR H 1 80 THR HA 3.820 . 3.820 2.974 2.771 3.229 . 0 0 "[ . 1 . 2]" 1
218 1 36 TYR H 1 80 THR MG 4.470 . 4.470 4.128 3.897 4.454 . 0 0 "[ . 1 . 2]" 1
219 1 36 TYR HA 1 36 TYR HD1 4.280 . 4.280 2.663 2.272 2.915 . 0 0 "[ . 1 . 2]" 1
220 1 36 TYR HA 1 36 TYR HE1 5.000 . 5.000 4.760 4.558 4.901 . 0 0 "[ . 1 . 2]" 1
221 1 36 TYR HA 1 37 GLN H 2.850 . 2.850 2.133 2.101 2.171 . 0 0 "[ . 1 . 2]" 1
222 1 36 TYR HA 1 52 TRP HE1 4.200 . 4.200 3.611 3.357 3.879 . 0 0 "[ . 1 . 2]" 1
223 1 36 TYR HA 1 79 THR MG 5.500 . 5.500 5.270 5.086 5.440 . 0 0 "[ . 1 . 2]" 1
224 1 36 TYR HA 1 85 ALA MB 5.080 . 5.080 4.817 4.617 5.044 . 0 0 "[ . 1 . 2]" 1
225 1 36 TYR HB2 1 36 TYR HE2 4.770 . 4.770 4.632 4.597 4.663 . 0 0 "[ . 1 . 2]" 1
226 1 36 TYR HB2 1 37 GLN H 4.530 . 4.530 4.342 4.259 4.449 . 0 0 "[ . 1 . 2]" 1
227 1 36 TYR HB2 1 79 THR H 3.920 . 3.920 3.401 3.168 3.760 . 0 0 "[ . 1 . 2]" 1
228 1 36 TYR HB2 1 79 THR MG 3.990 . 3.990 2.912 2.745 3.131 . 0 0 "[ . 1 . 2]" 1
229 1 36 TYR HB2 1 85 ALA HA 4.850 . 4.850 4.705 4.400 4.884 0.034 17 0 "[ . 1 . 2]" 1
230 1 36 TYR HB2 1 85 ALA MB 3.940 . 3.940 2.470 2.282 2.676 . 0 0 "[ . 1 . 2]" 1
231 1 36 TYR HB3 1 37 GLN H 4.620 . 4.620 3.610 3.391 3.869 . 0 0 "[ . 1 . 2]" 1
232 1 36 TYR HB3 1 52 TRP HD1 5.500 . 5.500 4.846 4.323 5.212 . 0 0 "[ . 1 . 2]" 1
233 1 36 TYR HB3 1 52 TRP HE1 5.430 . 5.430 4.156 3.766 4.508 . 0 0 "[ . 1 . 2]" 1
234 1 36 TYR HB3 1 79 THR MG 4.700 . 4.700 4.218 4.043 4.551 . 0 0 "[ . 1 . 2]" 1
235 1 36 TYR HB3 1 85 ALA MB 3.900 . 3.900 2.956 2.760 3.152 . 0 0 "[ . 1 . 2]" 1
236 1 36 TYR HD1 1 52 TRP HA 4.560 . 4.560 2.941 2.524 3.234 . 0 0 "[ . 1 . 2]" 1
237 1 36 TYR HD1 1 52 TRP QB 4.250 . 4.250 2.552 2.238 3.334 . 0 0 "[ . 1 . 2]" 1
238 1 36 TYR HD1 1 82 VAL QG 5.440 . 5.440 4.106 3.605 4.696 . 0 0 "[ . 1 . 2]" 1
239 1 36 TYR HD2 1 79 THR MG 4.350 . 4.350 3.044 2.722 3.276 . 0 0 "[ . 1 . 2]" 1
240 1 36 TYR HD2 1 80 THR HA 4.340 . 4.340 3.413 3.033 3.999 . 0 0 "[ . 1 . 2]" 1
241 1 36 TYR HD2 1 80 THR MG 5.500 . 5.500 4.991 4.683 5.494 . 0 0 "[ . 1 . 2]" 1
242 1 36 TYR HD2 1 82 VAL HA 5.240 . 5.240 2.941 2.603 3.213 . 0 0 "[ . 1 . 2]" 1
243 1 36 TYR HD2 1 82 VAL QG 4.990 . 4.990 3.932 3.448 4.210 . 0 0 "[ . 1 . 2]" 1
244 1 36 TYR HD2 1 85 ALA MB 4.550 . 4.550 3.194 2.521 3.501 . 0 0 "[ . 1 . 2]" 1
245 1 36 TYR HE1 1 52 TRP HA 4.440 . 4.440 3.090 2.475 3.338 . 0 0 "[ . 1 . 2]" 1
246 1 36 TYR HE1 1 52 TRP QB 3.810 . 3.810 2.870 2.411 3.515 . 0 0 "[ . 1 . 2]" 1
247 1 36 TYR HE1 1 52 TRP HD1 5.080 . 5.080 4.978 4.323 5.118 0.038 14 0 "[ . 1 . 2]" 1
248 1 36 TYR HE2 1 58 MET ME 5.500 . 5.500 5.487 4.910 5.576 0.076 19 0 "[ . 1 . 2]" 1
249 1 36 TYR HE2 1 79 THR MG 4.940 . 4.940 4.855 4.309 5.008 0.068 1 0 "[ . 1 . 2]" 1
250 1 36 TYR HE2 1 80 THR HA 5.050 . 5.050 4.244 3.654 4.804 . 0 0 "[ . 1 . 2]" 1
251 1 36 TYR HE2 1 81 SER HA 5.110 . 5.110 3.625 3.188 3.920 . 0 0 "[ . 1 . 2]" 1
252 1 36 TYR HE2 1 82 VAL H 4.100 . 4.100 2.642 2.398 2.895 . 0 0 "[ . 1 . 2]" 1
253 1 36 TYR HE2 1 82 VAL HA 4.270 . 4.270 3.288 2.327 3.618 . 0 0 "[ . 1 . 2]" 1
254 1 36 TYR HE2 1 82 VAL HB 3.860 . 3.860 2.668 2.315 4.021 0.161 18 0 "[ . 1 . 2]" 1
255 1 36 TYR HE2 1 82 VAL MG1 4.100 . 4.100 3.625 2.717 3.901 . 0 0 "[ . 1 . 2]" 1
256 1 36 TYR HE2 1 82 VAL QG 3.510 . 3.510 3.217 1.780 3.506 . 0 0 "[ . 1 . 2]" 1
257 1 36 TYR HE2 1 82 VAL MG2 4.100 . 4.100 3.679 1.805 4.109 0.009 4 0 "[ . 1 . 2]" 1
258 1 37 GLN H 1 37 GLN HB2 3.990 . 3.990 3.540 3.014 3.936 . 0 0 "[ . 1 . 2]" 1
259 1 37 GLN H 1 37 GLN QB 3.330 . 3.330 2.991 2.584 3.303 . 0 0 "[ . 1 . 2]" 1
260 1 37 GLN H 1 37 GLN HB3 3.990 . 3.990 3.235 2.754 3.709 . 0 0 "[ . 1 . 2]" 1
261 1 37 GLN H 1 37 GLN QG 4.320 . 4.320 3.200 2.265 4.236 . 0 0 "[ . 1 . 2]" 1
262 1 37 GLN H 1 38 ALA H 4.550 . 4.550 4.342 4.289 4.399 . 0 0 "[ . 1 . 2]" 1
263 1 37 GLN H 1 52 TRP HD1 4.830 . 4.830 4.258 3.957 4.543 . 0 0 "[ . 1 . 2]" 1
264 1 37 GLN H 1 52 TRP HE1 3.270 . 3.270 2.534 2.165 2.925 . 0 0 "[ . 1 . 2]" 1
265 1 37 GLN H 1 52 TRP HZ2 4.040 . 4.040 3.321 3.135 3.671 . 0 0 "[ . 1 . 2]" 1
266 1 37 GLN HA 1 37 GLN QG 3.860 . 3.860 2.915 2.317 3.349 . 0 0 "[ . 1 . 2]" 1
267 1 37 GLN HA 1 38 ALA H 3.170 . 3.170 2.306 2.221 2.528 . 0 0 "[ . 1 . 2]" 1
268 1 37 GLN HA 1 52 TRP HZ2 3.870 . 3.870 2.653 2.431 2.917 . 0 0 "[ . 1 . 2]" 1
269 1 37 GLN HA 1 77 ILE H 4.690 . 4.690 4.692 4.562 4.758 0.068 7 0 "[ . 1 . 2]" 1
270 1 37 GLN HA 1 77 ILE MD 5.500 . 5.500 5.513 5.388 5.568 0.068 13 0 "[ . 1 . 2]" 1
271 1 37 GLN HA 1 77 ILE MG 4.560 . 4.560 4.000 3.823 4.297 . 0 0 "[ . 1 . 2]" 1
272 1 37 GLN HA 1 78 SER QB 4.860 . 4.860 4.393 3.977 4.784 . 0 0 "[ . 1 . 2]" 1
273 1 37 GLN QB 1 37 GLN QE 3.850 . 3.850 3.202 1.961 3.639 . 0 0 "[ . 1 . 2]" 1
274 1 37 GLN QB 1 38 ALA H 3.650 . 3.650 2.977 2.191 3.594 . 0 0 "[ . 1 . 2]" 1
275 1 37 GLN QB 1 38 ALA MB 4.980 . 4.980 4.417 3.931 4.844 . 0 0 "[ . 1 . 2]" 1
276 1 37 GLN QB 1 39 THR HA 5.230 . 5.230 5.123 4.976 5.258 0.028 16 0 "[ . 1 . 2]" 1
277 1 37 GLN QB 1 39 THR MG 4.070 . 4.070 3.628 2.983 4.134 0.064 7 0 "[ . 1 . 2]" 1
278 1 37 GLN QB 1 52 TRP HZ2 5.030 . 5.030 4.348 4.179 4.654 . 0 0 "[ . 1 . 2]" 1
279 1 37 GLN QB 1 78 SER HA 4.100 . 4.100 2.425 2.078 3.079 . 0 0 "[ . 1 . 2]" 1
280 1 37 GLN QB 1 79 THR H 4.990 . 4.990 4.133 3.873 4.552 . 0 0 "[ . 1 . 2]" 1
281 1 37 GLN HB2 1 38 ALA H 4.220 . 4.220 3.296 2.229 4.239 0.019 13 0 "[ . 1 . 2]" 1
282 1 37 GLN HB3 1 38 ALA H 4.220 . 4.220 3.752 3.232 3.956 . 0 0 "[ . 1 . 2]" 1
283 1 37 GLN QG 1 38 ALA H 4.120 . 4.120 3.123 1.835 4.219 0.099 15 0 "[ . 1 . 2]" 1
284 1 37 GLN QG 1 78 SER HA 4.260 . 4.260 3.493 2.541 4.276 0.016 20 0 "[ . 1 . 2]" 1
285 1 38 ALA H 1 38 ALA MB 3.150 . 3.150 2.220 2.061 2.374 . 0 0 "[ . 1 . 2]" 1
286 1 38 ALA H 1 52 TRP HZ2 4.490 . 4.490 3.211 2.873 3.781 . 0 0 "[ . 1 . 2]" 1
287 1 38 ALA H 1 74 VAL QG 4.590 . 4.590 3.764 3.453 4.185 . 0 0 "[ . 1 . 2]" 1
288 1 38 ALA HA 1 39 THR H 3.010 . 3.010 2.157 2.119 2.222 . 0 0 "[ . 1 . 2]" 1
289 1 38 ALA HA 1 39 THR MG 3.940 . 3.940 3.639 3.414 3.901 . 0 0 "[ . 1 . 2]" 1
290 1 38 ALA HA 1 48 MET ME 4.710 . 4.710 4.103 3.409 4.485 . 0 0 "[ . 1 . 2]" 1
291 1 38 ALA HA 1 48 MET QG 4.430 . 4.430 2.422 2.148 2.759 . 0 0 "[ . 1 . 2]" 1
292 1 38 ALA HA 1 52 TRP HE1 4.100 . 4.100 3.491 3.248 3.833 . 0 0 "[ . 1 . 2]" 1
293 1 38 ALA HA 1 52 TRP HZ2 5.210 . 5.210 3.536 3.209 3.893 . 0 0 "[ . 1 . 2]" 1
294 1 38 ALA HA 1 70 LEU MD1 5.010 . 5.010 4.692 4.373 4.992 . 0 0 "[ . 1 . 2]" 1
295 1 38 ALA HA 1 70 LEU QD 4.220 . 4.220 3.868 2.934 4.310 0.090 12 0 "[ . 1 . 2]" 1
296 1 38 ALA HA 1 70 LEU MD2 5.010 . 5.010 4.174 2.981 4.946 . 0 0 "[ . 1 . 2]" 1
297 1 38 ALA HA 1 70 LEU HG 4.990 . 4.990 4.594 4.060 5.023 0.033 13 0 "[ . 1 . 2]" 1
298 1 38 ALA HA 1 74 VAL QG 4.380 . 4.380 4.087 3.812 4.384 0.004 3 0 "[ . 1 . 2]" 1
299 1 38 ALA MB 1 39 THR H 3.460 . 3.460 3.159 2.912 3.382 . 0 0 "[ . 1 . 2]" 1
300 1 38 ALA MB 1 39 THR HA 4.390 . 4.390 4.174 4.066 4.272 . 0 0 "[ . 1 . 2]" 1
301 1 38 ALA MB 1 48 MET ME 3.670 . 3.670 3.127 2.043 3.707 0.037 18 0 "[ . 1 . 2]" 1
302 1 38 ALA MB 1 52 TRP HZ2 4.570 . 4.570 3.546 3.158 3.846 . 0 0 "[ . 1 . 2]" 1
303 1 38 ALA MB 1 70 LEU MD1 3.600 . 3.600 3.150 2.737 3.506 . 0 0 "[ . 1 . 2]" 1
304 1 38 ALA MB 1 70 LEU QD 3.160 . 3.160 2.628 2.028 3.003 . 0 0 "[ . 1 . 2]" 1
305 1 38 ALA MB 1 70 LEU MD2 3.600 . 3.600 2.863 2.053 3.509 . 0 0 "[ . 1 . 2]" 1
306 1 38 ALA MB 1 74 VAL HB 4.020 . 4.020 2.853 2.145 4.131 0.111 20 0 "[ . 1 . 2]" 1
307 1 38 ALA MB 1 74 VAL MG1 4.150 . 4.150 2.118 1.964 2.333 . 0 0 "[ . 1 . 2]" 1
308 1 38 ALA MB 1 74 VAL QG 2.870 . 2.870 2.063 1.797 2.293 . 0 0 "[ . 1 . 2]" 1
309 1 38 ALA MB 1 74 VAL MG2 4.150 . 4.150 3.509 1.932 4.141 . 0 0 "[ . 1 . 2]" 1
310 1 38 ALA MB 1 75 SER H 4.130 . 4.130 3.177 2.892 3.488 . 0 0 "[ . 1 . 2]" 1
311 1 38 ALA MB 1 75 SER HA 3.850 . 3.850 1.984 1.872 2.138 . 0 0 "[ . 1 . 2]" 1
312 1 38 ALA MB 1 77 ILE HB 5.500 . 5.500 4.368 3.916 4.793 . 0 0 "[ . 1 . 2]" 1
313 1 38 ALA MB 1 77 ILE MG 5.500 . 5.500 5.209 4.849 5.569 0.069 1 0 "[ . 1 . 2]" 1
314 1 39 THR H 1 39 THR MG 3.540 . 3.540 2.616 2.315 3.075 . 0 0 "[ . 1 . 2]" 1
315 1 39 THR H 1 42 ASP H 4.180 . 4.180 3.845 3.636 4.218 0.038 4 0 "[ . 1 . 2]" 1
316 1 39 THR H 1 42 ASP QB 4.350 . 4.350 3.257 3.046 3.900 . 0 0 "[ . 1 . 2]" 1
317 1 39 THR H 1 70 LEU MD1 5.500 . 5.500 5.371 4.932 5.542 0.042 17 0 "[ . 1 . 2]" 1
318 1 39 THR H 1 70 LEU QD 4.770 . 4.770 3.895 3.152 4.485 . 0 0 "[ . 1 . 2]" 1
319 1 39 THR H 1 70 LEU MD2 5.500 . 5.500 4.018 3.177 4.829 . 0 0 "[ . 1 . 2]" 1
320 1 39 THR HA 1 39 THR MG 3.090 . 3.090 2.385 2.253 2.497 . 0 0 "[ . 1 . 2]" 1
321 1 39 THR HA 1 40 PRO HB3 4.920 . 4.920 4.928 4.822 4.981 0.061 13 0 "[ . 1 . 2]" 1
322 1 39 THR HA 1 40 PRO HD2 3.800 . 3.800 2.453 2.264 2.764 . 0 0 "[ . 1 . 2]" 1
323 1 39 THR HA 1 40 PRO HD3 3.800 . 3.800 2.426 2.296 2.503 . 0 0 "[ . 1 . 2]" 1
324 1 39 THR HA 1 41 MET H 4.510 . 4.510 3.885 3.714 3.980 . 0 0 "[ . 1 . 2]" 1
325 1 39 THR HB 1 40 PRO HD2 4.050 . 4.050 1.997 1.881 2.523 . 0 0 "[ . 1 . 2]" 1
326 1 39 THR HB 1 40 PRO QD 3.550 . 3.550 1.984 1.871 2.493 . 0 0 "[ . 1 . 2]" 1
327 1 39 THR HB 1 40 PRO HD3 4.050 . 4.050 3.451 3.184 3.879 . 0 0 "[ . 1 . 2]" 1
328 1 39 THR HB 1 40 PRO QG 4.730 . 4.730 3.620 3.482 4.009 . 0 0 "[ . 1 . 2]" 1
329 1 39 THR HB 1 41 MET H 3.640 . 3.640 2.638 2.374 2.853 . 0 0 "[ . 1 . 2]" 1
330 1 39 THR HB 1 41 MET ME 5.410 . 5.410 4.168 2.388 5.411 0.001 6 0 "[ . 1 . 2]" 1
331 1 39 THR HB 1 41 MET HG2 5.240 . 5.240 4.120 2.207 5.287 0.047 4 0 "[ . 1 . 2]" 1
332 1 39 THR HB 1 41 MET HG3 5.240 . 5.240 3.853 3.089 5.034 . 0 0 "[ . 1 . 2]" 1
333 1 39 THR MG 1 40 PRO QD 3.540 . 3.540 3.113 2.812 3.356 . 0 0 "[ . 1 . 2]" 1
334 1 39 THR MG 1 41 MET H 4.420 . 4.420 4.114 4.034 4.186 . 0 0 "[ . 1 . 2]" 1
335 1 39 THR MG 1 41 MET QB 4.910 . 4.910 4.287 3.878 5.012 0.102 11 0 "[ . 1 . 2]" 1
336 1 39 THR MG 1 42 ASP H 4.800 . 4.800 4.657 4.325 4.847 0.047 1 0 "[ . 1 . 2]" 1
337 1 39 THR MG 1 52 TRP HD1 5.500 . 5.500 5.361 4.763 5.567 0.067 11 0 "[ . 1 . 2]" 1
338 1 39 THR MG 1 52 TRP HE1 4.960 . 4.960 4.160 3.752 4.456 . 0 0 "[ . 1 . 2]" 1
339 1 40 PRO HA 1 70 LEU QD 5.440 . 5.440 3.967 2.999 5.050 . 0 0 "[ . 1 . 2]" 1
340 1 40 PRO QD 1 41 MET H 3.780 . 3.780 2.874 2.768 3.068 . 0 0 "[ . 1 . 2]" 1
341 1 41 MET H 1 41 MET HB2 3.670 . 3.670 2.763 2.366 3.740 0.070 1 0 "[ . 1 . 2]" 1
342 1 41 MET H 1 41 MET QB 2.960 . 2.960 2.495 2.335 2.852 . 0 0 "[ . 1 . 2]" 1
343 1 41 MET H 1 41 MET HB3 3.670 . 3.670 3.423 2.618 3.709 0.039 18 0 "[ . 1 . 2]" 1
344 1 41 MET H 1 41 MET HG2 3.910 . 3.910 3.105 1.952 3.885 . 0 0 "[ . 1 . 2]" 1
345 1 41 MET H 1 41 MET HG3 3.910 . 3.910 3.002 2.299 3.952 0.042 18 0 "[ . 1 . 2]" 1
346 1 41 MET H 1 42 ASP H 2.880 . 2.880 2.278 2.063 2.501 . 0 0 "[ . 1 . 2]" 1
347 1 41 MET H 1 42 ASP QB 4.690 . 4.690 4.394 3.874 4.713 0.023 13 0 "[ . 1 . 2]" 1
348 1 41 MET H 1 43 GLY H 4.850 . 4.850 4.430 4.172 4.788 . 0 0 "[ . 1 . 2]" 1
349 1 41 MET HA 1 41 MET HG2 3.850 . 3.850 3.015 2.383 3.885 0.035 17 0 "[ . 1 . 2]" 1
350 1 41 MET HA 1 41 MET HG3 3.850 . 3.850 3.335 2.425 3.823 . 0 0 "[ . 1 . 2]" 1
351 1 41 MET HA 1 43 GLY H 4.910 . 4.910 4.796 4.541 5.028 0.118 4 0 "[ . 1 . 2]" 1
352 1 41 MET QB 1 42 ASP H 3.880 . 3.880 3.219 2.658 3.916 0.036 11 0 "[ . 1 . 2]" 1
353 1 41 MET HB2 1 42 ASP H 4.440 . 4.440 3.411 2.726 4.415 . 0 0 "[ . 1 . 2]" 1
354 1 41 MET HB3 1 42 ASP H 4.440 . 4.440 4.085 3.685 4.395 . 0 0 "[ . 1 . 2]" 1
355 1 41 MET ME 1 41 MET QG 3.260 . 3.260 2.277 2.202 2.469 . 0 0 "[ . 1 . 2]" 1
356 1 41 MET HG2 1 42 ASP H 5.500 . 5.500 4.573 2.846 5.223 . 0 0 "[ . 1 . 2]" 1
357 1 41 MET HG3 1 42 ASP H 5.500 . 5.500 4.357 2.799 5.487 . 0 0 "[ . 1 . 2]" 1
358 1 42 ASP H 1 42 ASP HB2 3.660 . 3.660 2.623 2.319 3.564 . 0 0 "[ . 1 . 2]" 1
359 1 42 ASP H 1 42 ASP QB 3.200 . 3.200 2.485 2.286 2.913 . 0 0 "[ . 1 . 2]" 1
360 1 42 ASP H 1 42 ASP HB3 3.660 . 3.660 3.484 2.708 3.630 . 0 0 "[ . 1 . 2]" 1
361 1 42 ASP H 1 43 GLY H 3.540 . 3.540 2.627 2.452 2.861 . 0 0 "[ . 1 . 2]" 1
362 1 42 ASP H 1 43 GLY QA 5.170 . 5.170 4.307 4.177 4.467 . 0 0 "[ . 1 . 2]" 1
363 1 42 ASP H 1 70 LEU QD 4.560 . 4.560 4.046 3.592 4.592 0.032 1 0 "[ . 1 . 2]" 1
364 1 42 ASP HA 1 44 THR H 4.660 . 4.660 4.283 4.033 4.531 . 0 0 "[ . 1 . 2]" 1
365 1 42 ASP HA 1 47 THR MG 3.250 . 3.250 2.889 2.356 3.362 0.112 4 0 "[ . 1 . 2]" 1
366 1 42 ASP QB 1 44 THR H 4.310 . 4.310 3.365 2.807 3.596 . 0 0 "[ . 1 . 2]" 1
367 1 42 ASP QB 1 47 THR MG 5.330 . 5.330 3.683 3.231 4.088 . 0 0 "[ . 1 . 2]" 1
368 1 42 ASP QB 1 48 MET H 4.370 . 4.370 2.981 2.690 4.385 0.015 4 0 "[ . 1 . 2]" 1
369 1 42 ASP QB 1 70 LEU QD 3.740 . 3.740 2.497 2.088 3.268 . 0 0 "[ . 1 . 2]" 1
370 1 42 ASP HB2 1 43 GLY H 4.190 . 4.190 2.443 2.165 3.405 . 0 0 "[ . 1 . 2]" 1
371 1 42 ASP HB2 1 44 THR H 5.050 . 5.050 4.119 2.836 4.655 . 0 0 "[ . 1 . 2]" 1
372 1 42 ASP HB2 1 70 LEU MD1 5.080 . 5.080 4.237 3.669 5.161 0.081 4 0 "[ . 1 . 2]" 1
373 1 42 ASP HB2 1 70 LEU MD2 5.080 . 5.080 2.698 2.143 3.801 . 0 0 "[ . 1 . 2]" 1
374 1 42 ASP HB3 1 43 GLY H 4.190 . 4.190 3.339 1.926 3.833 . 0 0 "[ . 1 . 2]" 1
375 1 42 ASP HB3 1 44 THR H 5.050 . 5.050 3.774 3.216 4.842 . 0 0 "[ . 1 . 2]" 1
376 1 42 ASP HB3 1 70 LEU MD1 5.080 . 5.080 4.419 3.934 5.193 0.113 18 0 "[ . 1 . 2]" 1
377 1 42 ASP HB3 1 70 LEU MD2 5.080 . 5.080 3.407 2.396 4.738 . 0 0 "[ . 1 . 2]" 1
378 1 43 GLY H 1 44 THR H 3.620 . 3.620 3.545 3.018 3.677 0.057 11 0 "[ . 1 . 2]" 1
379 1 43 GLY H 1 44 THR MG 5.180 . 5.180 5.161 4.961 5.253 0.073 13 0 "[ . 1 . 2]" 1
380 1 43 GLY H 1 47 THR MG 5.440 . 5.440 5.203 4.902 5.490 0.050 11 0 "[ . 1 . 2]" 1
381 1 43 GLY H 1 70 LEU QD 3.820 . 3.820 2.614 2.317 3.203 . 0 0 "[ . 1 . 2]" 1
382 1 43 GLY QA 1 44 THR MG 3.840 . 3.840 3.091 2.983 3.186 . 0 0 "[ . 1 . 2]" 1
383 1 43 GLY QA 1 70 LEU QD 4.530 . 4.530 3.035 2.671 3.563 . 0 0 "[ . 1 . 2]" 1
384 1 43 GLY HA2 1 44 THR MG 4.520 . 4.520 4.066 3.936 4.286 . 0 0 "[ . 1 . 2]" 1
385 1 43 GLY HA3 1 44 THR MG 4.520 . 4.520 3.205 3.073 3.343 . 0 0 "[ . 1 . 2]" 1
386 1 44 THR H 1 44 THR MG 3.380 . 3.380 2.685 2.473 3.012 . 0 0 "[ . 1 . 2]" 1
387 1 44 THR H 1 45 LEU H 4.670 . 4.670 4.465 4.427 4.500 . 0 0 "[ . 1 . 2]" 1
388 1 44 THR H 1 47 THR H 4.400 . 4.400 3.824 3.441 4.300 . 0 0 "[ . 1 . 2]" 1
389 1 44 THR H 1 47 THR HB 3.390 . 3.390 2.811 2.526 3.143 . 0 0 "[ . 1 . 2]" 1
390 1 44 THR H 1 47 THR MG 4.160 . 4.160 3.918 3.704 4.141 . 0 0 "[ . 1 . 2]" 1
391 1 44 THR H 1 70 LEU MD1 5.480 . 5.480 4.414 4.136 5.072 . 0 0 "[ . 1 . 2]" 1
392 1 44 THR H 1 70 LEU QD 4.680 . 4.680 3.447 3.011 3.747 . 0 0 "[ . 1 . 2]" 1
393 1 44 THR H 1 70 LEU MD2 5.480 . 5.480 3.609 3.085 3.957 . 0 0 "[ . 1 . 2]" 1
394 1 44 THR HA 1 44 THR MG 3.350 . 3.350 2.430 2.352 2.517 . 0 0 "[ . 1 . 2]" 1
395 1 44 THR HA 1 45 LEU H 3.130 . 3.130 2.417 2.351 2.523 . 0 0 "[ . 1 . 2]" 1
396 1 44 THR HA 1 45 LEU QB 4.830 . 4.830 4.202 4.113 4.316 . 0 0 "[ . 1 . 2]" 1
397 1 44 THR HA 1 45 LEU QD 5.440 . 5.440 5.200 4.844 5.302 . 0 0 "[ . 1 . 2]" 1
398 1 44 THR HA 1 46 LYS H 4.650 . 4.650 4.483 4.308 4.689 0.039 16 0 "[ . 1 . 2]" 1
399 1 44 THR HA 1 69 THR HA 3.760 . 3.760 1.926 1.709 2.133 . 0 0 "[ . 1 . 2]" 1
400 1 44 THR HA 1 69 THR MG 4.360 . 4.360 3.064 2.654 4.467 0.107 16 0 "[ . 1 . 2]" 1
401 1 44 THR HA 1 70 LEU H 4.150 . 4.150 2.849 2.242 3.397 . 0 0 "[ . 1 . 2]" 1
402 1 44 THR HA 1 70 LEU MD1 4.760 . 4.760 2.977 2.626 3.524 . 0 0 "[ . 1 . 2]" 1
403 1 44 THR HA 1 70 LEU QD 4.130 . 4.130 2.667 2.557 2.757 . 0 0 "[ . 1 . 2]" 1
404 1 44 THR HA 1 70 LEU MD2 4.760 . 4.760 3.194 2.717 3.624 . 0 0 "[ . 1 . 2]" 1
405 1 44 THR HA 1 70 LEU HG 5.480 . 5.480 5.537 5.468 5.592 0.112 17 0 "[ . 1 . 2]" 1
406 1 44 THR HB 1 45 LEU H 3.210 . 3.210 2.263 2.098 2.357 . 0 0 "[ . 1 . 2]" 1
407 1 44 THR HB 1 68 TYR H 4.590 . 4.590 3.632 3.214 4.442 . 0 0 "[ . 1 . 2]" 1
408 1 44 THR HB 1 69 THR HA 4.360 . 4.360 3.173 2.820 3.445 . 0 0 "[ . 1 . 2]" 1
409 1 44 THR HB 1 70 LEU MD1 5.500 . 5.500 4.597 4.403 4.882 . 0 0 "[ . 1 . 2]" 1
410 1 44 THR HB 1 70 LEU MD2 5.500 . 5.500 5.201 4.755 5.538 0.038 13 0 "[ . 1 . 2]" 1
411 1 44 THR MG 1 45 LEU H 3.860 . 3.860 3.686 3.535 3.794 . 0 0 "[ . 1 . 2]" 1
412 1 44 THR MG 1 47 THR MG 4.780 . 4.780 4.797 4.573 4.903 0.123 3 0 "[ . 1 . 2]" 1
413 1 44 THR MG 1 68 TYR H 5.500 . 5.500 4.647 4.213 5.335 . 0 0 "[ . 1 . 2]" 1
414 1 44 THR MG 1 69 THR HA 4.080 . 4.080 2.525 2.217 2.976 . 0 0 "[ . 1 . 2]" 1
415 1 44 THR MG 1 69 THR MG 3.400 . 3.400 2.210 1.902 3.445 0.045 16 0 "[ . 1 . 2]" 1
416 1 45 LEU H 1 45 LEU HB2 3.340 . 3.340 2.498 1.980 2.629 . 0 0 "[ . 1 . 2]" 1
417 1 45 LEU H 1 45 LEU QB 2.920 . 2.920 2.193 1.960 2.227 . 0 0 "[ . 1 . 2]" 1
418 1 45 LEU H 1 45 LEU HB3 3.340 . 3.340 2.471 2.355 3.145 . 0 0 "[ . 1 . 2]" 1
419 1 45 LEU H 1 45 LEU MD1 4.310 . 4.310 4.069 3.490 4.167 . 0 0 "[ . 1 . 2]" 1
420 1 45 LEU H 1 45 LEU MD2 4.310 . 4.310 4.212 4.059 4.386 0.076 17 0 "[ . 1 . 2]" 1
421 1 45 LEU H 1 45 LEU HG 4.690 . 4.690 4.401 3.801 4.555 . 0 0 "[ . 1 . 2]" 1
422 1 45 LEU H 1 46 LYS H 3.710 . 3.710 2.721 2.599 2.807 . 0 0 "[ . 1 . 2]" 1
423 1 45 LEU H 1 67 ASP HA 5.500 . 5.500 5.182 4.669 5.550 0.050 4 0 "[ . 1 . 2]" 1
424 1 45 LEU H 1 68 TYR H 4.180 . 4.180 3.527 3.094 3.912 . 0 0 "[ . 1 . 2]" 1
425 1 45 LEU H 1 68 TYR HB2 4.860 . 4.860 4.134 3.878 4.400 . 0 0 "[ . 1 . 2]" 1
426 1 45 LEU H 1 69 THR HA 4.180 . 4.180 3.188 2.664 3.584 . 0 0 "[ . 1 . 2]" 1
427 1 45 LEU H 1 70 LEU QD 3.830 . 3.830 3.058 2.941 3.202 . 0 0 "[ . 1 . 2]" 1
428 1 45 LEU HA 1 45 LEU MD1 4.620 . 4.620 2.363 2.023 3.489 . 0 0 "[ . 1 . 2]" 1
429 1 45 LEU HA 1 45 LEU QD 3.330 . 3.330 2.247 2.007 2.808 . 0 0 "[ . 1 . 2]" 1
430 1 45 LEU HA 1 45 LEU MD2 4.620 . 4.620 3.761 2.021 3.956 . 0 0 "[ . 1 . 2]" 1
431 1 45 LEU HA 1 48 MET H 3.850 . 3.850 3.568 3.301 3.730 . 0 0 "[ . 1 . 2]" 1
432 1 45 LEU HA 1 48 MET ME 3.840 . 3.840 2.849 2.623 3.198 . 0 0 "[ . 1 . 2]" 1
433 1 45 LEU HA 1 49 LEU H 4.780 . 4.780 3.842 3.700 4.033 . 0 0 "[ . 1 . 2]" 1
434 1 45 LEU HA 1 49 LEU QD 5.440 . 5.440 4.046 3.219 4.555 . 0 0 "[ . 1 . 2]" 1
435 1 45 LEU HA 1 70 LEU QD 3.440 . 3.440 2.534 2.287 2.820 . 0 0 "[ . 1 . 2]" 1
436 1 45 LEU HA 1 74 VAL QG 4.840 . 4.840 4.407 4.190 4.612 . 0 0 "[ . 1 . 2]" 1
437 1 45 LEU QB 1 46 LYS H 3.440 . 3.440 2.530 2.412 2.651 . 0 0 "[ . 1 . 2]" 1
438 1 45 LEU QB 1 68 TYR H 3.460 . 3.460 2.892 2.556 3.019 . 0 0 "[ . 1 . 2]" 1
439 1 45 LEU QB 1 70 LEU QD 4.920 . 4.920 3.113 2.671 3.632 . 0 0 "[ . 1 . 2]" 1
440 1 45 LEU HB2 1 46 LYS H 4.100 . 4.100 3.845 3.147 3.949 . 0 0 "[ . 1 . 2]" 1
441 1 45 LEU HB2 1 68 TYR H 4.210 . 4.210 4.021 2.625 4.245 0.035 5 0 "[ . 1 . 2]" 1
442 1 45 LEU HB3 1 46 LYS H 4.100 . 4.100 2.569 2.440 2.694 . 0 0 "[ . 1 . 2]" 1
443 1 45 LEU HB3 1 68 TYR H 4.210 . 4.210 3.006 2.805 3.521 . 0 0 "[ . 1 . 2]" 1
444 1 45 LEU QD 1 48 MET ME 2.990 . 2.990 2.020 1.884 2.916 . 0 0 "[ . 1 . 2]" 1
445 1 45 LEU QD 1 48 MET QG 5.260 . 5.260 4.280 3.621 5.162 . 0 0 "[ . 1 . 2]" 1
446 1 45 LEU QD 1 49 LEU H 4.440 . 4.440 3.601 2.677 4.154 . 0 0 "[ . 1 . 2]" 1
447 1 45 LEU QD 1 49 LEU QD 2.980 . 2.980 2.062 1.840 2.214 . 0 0 "[ . 1 . 2]" 1
448 1 45 LEU QD 1 49 LEU HG 4.280 . 4.280 2.345 1.918 4.162 . 0 0 "[ . 1 . 2]" 1
449 1 45 LEU QD 1 62 TYR HD1 5.440 . 5.440 3.947 3.507 4.324 . 0 0 "[ . 1 . 2]" 1
450 1 45 LEU QD 1 62 TYR HE1 3.910 . 3.910 2.234 1.935 2.659 . 0 0 "[ . 1 . 2]" 1
451 1 45 LEU QD 1 68 TYR H 4.320 . 4.320 3.745 3.425 3.928 . 0 0 "[ . 1 . 2]" 1
452 1 45 LEU QD 1 68 TYR HB2 4.630 . 4.630 3.196 2.124 4.608 . 0 0 "[ . 1 . 2]" 1
453 1 45 LEU QD 1 68 TYR HD2 4.390 . 4.390 3.008 2.494 3.909 . 0 0 "[ . 1 . 2]" 1
454 1 45 LEU QD 1 68 TYR HE2 4.830 . 4.830 4.516 3.849 4.857 0.027 12 0 "[ . 1 . 2]" 1
455 1 45 LEU QD 1 70 LEU HA 4.710 . 4.710 4.579 4.253 4.790 0.080 11 0 "[ . 1 . 2]" 1
456 1 45 LEU QD 1 70 LEU QD 3.390 . 3.390 3.034 2.608 3.299 . 0 0 "[ . 1 . 2]" 1
457 1 45 LEU QD 1 74 VAL QG 3.440 . 3.440 3.296 3.043 3.564 0.124 17 0 "[ . 1 . 2]" 1
458 1 45 LEU QD 1 89 LEU QB 5.280 . 5.280 3.971 3.404 4.361 . 0 0 "[ . 1 . 2]" 1
459 1 45 LEU QD 1 89 LEU QD 3.430 . 3.430 2.569 2.080 3.413 . 0 0 "[ . 1 . 2]" 1
460 1 45 LEU QD 1 93 TYR HD2 4.670 . 4.670 2.826 2.390 3.702 . 0 0 "[ . 1 . 2]" 1
461 1 45 LEU QD 1 93 TYR HE2 3.690 . 3.690 1.801 1.709 2.143 . 0 0 "[ . 1 . 2]" 1
462 1 45 LEU QD 1 100 VAL QG 4.040 . 4.040 2.568 2.241 2.897 . 0 0 "[ . 1 . 2]" 1
463 1 45 LEU QD 1 109 VAL MG2 4.160 . 4.160 3.362 2.992 3.711 . 0 0 "[ . 1 . 2]" 1
464 1 45 LEU MD1 1 93 TYR HE2 4.740 . 4.740 2.065 1.853 3.238 . 0 0 "[ . 1 . 2]" 1
465 1 45 LEU MD2 1 93 TYR HE2 4.740 . 4.740 2.103 1.911 2.913 . 0 0 "[ . 1 . 2]" 1
466 1 45 LEU HG 1 46 LYS H 4.970 . 4.970 3.778 3.463 5.019 0.049 12 0 "[ . 1 . 2]" 1
467 1 45 LEU HG 1 49 LEU H 5.500 . 5.500 4.403 3.998 5.681 0.181 12 0 "[ . 1 . 2]" 1
468 1 45 LEU HG 1 49 LEU MD1 5.150 . 5.150 2.383 2.024 4.074 . 0 0 "[ . 1 . 2]" 1
469 1 45 LEU HG 1 49 LEU QD 3.960 . 3.960 2.352 2.018 3.861 . 0 0 "[ . 1 . 2]" 1
470 1 45 LEU HG 1 49 LEU MD2 5.150 . 5.150 4.131 2.909 5.145 . 0 0 "[ . 1 . 2]" 1
471 1 45 LEU HG 1 62 TYR HE1 4.570 . 4.570 2.666 2.141 4.628 0.058 17 0 "[ . 1 . 2]" 1
472 1 45 LEU HG 1 68 TYR H 5.260 . 5.260 5.220 4.918 5.339 0.079 8 0 "[ . 1 . 2]" 1
473 1 45 LEU HG 1 93 TYR HE2 5.500 . 5.500 3.931 2.032 4.363 . 0 0 "[ . 1 . 2]" 1
474 1 46 LYS H 1 46 LYS HB2 3.580 . 3.580 2.385 2.078 2.610 . 0 0 "[ . 1 . 2]" 1
475 1 46 LYS H 1 46 LYS HB3 3.580 . 3.580 2.699 2.470 3.232 . 0 0 "[ . 1 . 2]" 1
476 1 46 LYS H 1 47 THR H 3.490 . 3.490 2.829 2.737 2.919 . 0 0 "[ . 1 . 2]" 1
477 1 46 LYS H 1 48 MET H 4.600 . 4.600 4.057 3.818 4.164 . 0 0 "[ . 1 . 2]" 1
478 1 46 LYS H 1 49 LEU QD 5.260 . 5.260 4.558 4.209 5.189 . 0 0 "[ . 1 . 2]" 1
479 1 46 LYS H 1 68 TYR H 4.390 . 4.390 3.779 3.421 4.284 . 0 0 "[ . 1 . 2]" 1
480 1 46 LYS H 1 70 LEU QD 5.440 . 5.440 4.750 4.593 4.866 . 0 0 "[ . 1 . 2]" 1
481 1 46 LYS HA 1 46 LYS QD 4.970 . 4.970 3.787 2.205 4.237 . 0 0 "[ . 1 . 2]" 1
482 1 46 LYS HA 1 46 LYS HE2 4.850 . 4.850 4.655 4.067 4.921 0.071 17 0 "[ . 1 . 2]" 1
483 1 46 LYS HA 1 46 LYS QE 4.140 . 4.140 4.073 3.861 4.306 0.166 5 0 "[ . 1 . 2]" 1
484 1 46 LYS HA 1 46 LYS HE3 4.850 . 4.850 4.555 4.079 4.886 0.036 15 0 "[ . 1 . 2]" 1
485 1 46 LYS HA 1 49 LEU H 4.090 . 4.090 3.753 3.562 3.900 . 0 0 "[ . 1 . 2]" 1
486 1 46 LYS HA 1 49 LEU HB2 4.930 . 4.930 3.106 2.789 3.501 . 0 0 "[ . 1 . 2]" 1
487 1 46 LYS HA 1 49 LEU QD 4.260 . 4.260 3.201 2.662 3.984 . 0 0 "[ . 1 . 2]" 1
488 1 46 LYS HA 1 50 GLU H 4.580 . 4.580 4.040 3.899 4.322 . 0 0 "[ . 1 . 2]" 1
489 1 46 LYS HA 1 60 LEU MD1 5.280 . 5.280 4.404 4.086 4.807 . 0 0 "[ . 1 . 2]" 1
490 1 46 LYS HA 1 60 LEU QD 3.910 . 3.910 3.087 2.707 3.467 . 0 0 "[ . 1 . 2]" 1
491 1 46 LYS HA 1 60 LEU MD2 5.280 . 5.280 3.156 2.745 3.556 . 0 0 "[ . 1 . 2]" 1
492 1 46 LYS HA 1 62 TYR HE1 4.190 . 4.190 3.203 2.878 3.533 . 0 0 "[ . 1 . 2]" 1
493 1 46 LYS QB 1 46 LYS QD 3.330 . 3.330 2.245 2.095 2.381 . 0 0 "[ . 1 . 2]" 1
494 1 46 LYS QB 1 47 THR H 3.460 . 3.460 2.309 2.162 2.492 . 0 0 "[ . 1 . 2]" 1
495 1 46 LYS QB 1 62 TYR HE1 5.050 . 5.050 3.622 3.016 4.606 . 0 0 "[ . 1 . 2]" 1
496 1 46 LYS QB 1 68 TYR H 5.340 . 5.340 4.289 3.993 4.816 . 0 0 "[ . 1 . 2]" 1
497 1 46 LYS HB2 1 47 THR H 4.150 . 4.150 3.599 3.027 3.847 . 0 0 "[ . 1 . 2]" 1
498 1 46 LYS HB3 1 47 THR H 4.150 . 4.150 2.341 2.181 2.529 . 0 0 "[ . 1 . 2]" 1
499 1 46 LYS QE 1 62 TYR QB 4.280 . 4.280 3.044 2.080 4.288 0.008 15 0 "[ . 1 . 2]" 1
500 1 46 LYS QE 1 62 TYR HD1 5.340 . 5.340 4.435 3.482 5.027 . 0 0 "[ . 1 . 2]" 1
501 1 46 LYS QE 1 62 TYR HD2 4.130 . 4.130 3.062 2.563 3.828 . 0 0 "[ . 1 . 2]" 1
502 1 46 LYS QG 1 47 THR H 4.650 . 4.650 3.654 3.261 4.326 . 0 0 "[ . 1 . 2]" 1
503 1 46 LYS QG 1 50 GLU QG 5.340 . 5.340 2.863 2.194 4.468 . 0 0 "[ . 1 . 2]" 1
504 1 46 LYS QG 1 60 LEU QD 3.670 . 3.670 3.026 2.532 3.719 0.049 12 0 "[ . 1 . 2]" 1
505 1 46 LYS QG 1 62 TYR HD1 5.500 . 5.500 3.711 3.197 4.594 . 0 0 "[ . 1 . 2]" 1
506 1 46 LYS QG 1 62 TYR HD2 5.480 . 5.480 4.230 3.309 5.035 . 0 0 "[ . 1 . 2]" 1
507 1 46 LYS QG 1 62 TYR HE1 4.520 . 4.520 4.192 3.305 4.624 0.104 4 0 "[ . 1 . 2]" 1
508 1 47 THR H 1 47 THR HB 3.430 . 3.430 2.876 2.542 3.258 . 0 0 "[ . 1 . 2]" 1
509 1 47 THR H 1 47 THR MG 3.620 . 3.620 3.616 3.289 3.734 0.114 4 0 "[ . 1 . 2]" 1
510 1 47 THR H 1 48 MET H 3.180 . 3.180 2.698 2.605 2.784 . 0 0 "[ . 1 . 2]" 1
511 1 47 THR H 1 49 LEU H 4.650 . 4.650 4.437 4.295 4.616 . 0 0 "[ . 1 . 2]" 1
512 1 47 THR HA 1 47 THR MG 2.890 . 2.890 2.234 2.149 2.432 . 0 0 "[ . 1 . 2]" 1
513 1 47 THR HA 1 49 LEU H 5.400 . 5.400 4.729 4.572 4.859 . 0 0 "[ . 1 . 2]" 1
514 1 47 THR HA 1 50 GLU HB2 3.750 . 3.750 2.426 2.236 2.618 . 0 0 "[ . 1 . 2]" 1
515 1 47 THR HA 1 50 GLU HB3 4.340 . 4.340 3.894 3.601 4.113 . 0 0 "[ . 1 . 2]" 1
516 1 47 THR HA 1 50 GLU QG 4.360 . 4.360 3.293 2.724 3.808 . 0 0 "[ . 1 . 2]" 1
517 1 47 THR HA 1 51 ARG H 4.310 . 4.310 4.149 3.974 4.336 0.026 16 0 "[ . 1 . 2]" 1
518 1 47 THR HB 1 48 MET H 3.520 . 3.520 2.720 2.552 2.951 . 0 0 "[ . 1 . 2]" 1
519 1 47 THR MG 1 48 MET H 4.500 . 4.500 3.907 3.497 4.168 . 0 0 "[ . 1 . 2]" 1
520 1 47 THR MG 1 50 GLU HB2 4.260 . 4.260 3.707 3.420 3.947 . 0 0 "[ . 1 . 2]" 1
521 1 47 THR MG 1 50 GLU HB3 4.850 . 4.850 4.548 4.236 4.879 0.029 11 0 "[ . 1 . 2]" 1
522 1 47 THR MG 1 50 GLU QG 5.340 . 5.340 4.538 3.819 5.038 . 0 0 "[ . 1 . 2]" 1
523 1 48 MET H 1 48 MET HB2 3.290 . 3.290 2.419 2.158 2.620 . 0 0 "[ . 1 . 2]" 1
524 1 48 MET H 1 48 MET HB3 3.290 . 3.290 2.622 2.453 2.892 . 0 0 "[ . 1 . 2]" 1
525 1 48 MET H 1 48 MET ME 4.660 . 4.660 4.389 4.238 4.619 . 0 0 "[ . 1 . 2]" 1
526 1 48 MET H 1 48 MET HG2 4.680 . 4.680 4.425 4.162 4.515 . 0 0 "[ . 1 . 2]" 1
527 1 48 MET H 1 48 MET QG 4.080 . 4.080 3.940 3.772 4.029 . 0 0 "[ . 1 . 2]" 1
528 1 48 MET H 1 48 MET HG3 4.680 . 4.680 4.427 4.317 4.621 . 0 0 "[ . 1 . 2]" 1
529 1 48 MET H 1 50 GLU H 4.490 . 4.490 3.957 3.790 4.081 . 0 0 "[ . 1 . 2]" 1
530 1 48 MET H 1 51 ARG H 5.040 . 5.040 4.770 4.622 4.916 . 0 0 "[ . 1 . 2]" 1
531 1 48 MET H 1 51 ARG QB 5.340 . 5.340 5.096 4.749 5.407 0.067 15 0 "[ . 1 . 2]" 1
532 1 48 MET H 1 70 LEU QD 4.470 . 4.470 3.940 3.688 4.218 . 0 0 "[ . 1 . 2]" 1
533 1 48 MET HA 1 48 MET QG 3.710 . 3.710 2.397 2.135 2.522 . 0 0 "[ . 1 . 2]" 1
534 1 48 MET HA 1 52 TRP H 4.700 . 4.700 4.335 4.112 4.700 . 0 0 "[ . 1 . 2]" 1
535 1 48 MET QB 1 48 MET ME 3.240 . 3.240 2.090 1.979 2.421 . 0 0 "[ . 1 . 2]" 1
536 1 48 MET QB 1 49 LEU H 3.240 . 3.240 2.315 2.224 2.409 . 0 0 "[ . 1 . 2]" 1
537 1 48 MET HB2 1 48 MET ME 3.920 . 3.920 3.265 3.157 3.418 . 0 0 "[ . 1 . 2]" 1
538 1 48 MET HB2 1 49 LEU H 3.840 . 3.840 3.659 3.382 3.824 . 0 0 "[ . 1 . 2]" 1
539 1 48 MET HB3 1 48 MET ME 3.920 . 3.920 2.116 1.998 2.483 . 0 0 "[ . 1 . 2]" 1
540 1 48 MET HB3 1 49 LEU H 3.840 . 3.840 2.341 2.251 2.436 . 0 0 "[ . 1 . 2]" 1
541 1 48 MET ME 1 48 MET HG2 3.690 . 3.690 2.665 2.390 3.394 . 0 0 "[ . 1 . 2]" 1
542 1 48 MET ME 1 48 MET HG3 3.690 . 3.690 3.135 2.292 3.397 . 0 0 "[ . 1 . 2]" 1
543 1 48 MET ME 1 49 LEU H 3.950 . 3.950 3.430 3.165 3.893 . 0 0 "[ . 1 . 2]" 1
544 1 48 MET ME 1 49 LEU HA 4.850 . 4.850 3.819 3.533 4.355 . 0 0 "[ . 1 . 2]" 1
545 1 48 MET ME 1 49 LEU HB2 5.100 . 5.100 4.674 4.391 5.128 0.028 14 0 "[ . 1 . 2]" 1
546 1 48 MET ME 1 49 LEU MD1 4.050 . 4.050 3.628 2.027 3.965 . 0 0 "[ . 1 . 2]" 1
547 1 48 MET ME 1 49 LEU QD 3.140 . 3.140 2.563 2.022 2.957 . 0 0 "[ . 1 . 2]" 1
548 1 48 MET ME 1 49 LEU MD2 4.050 . 4.050 2.721 2.242 4.088 0.038 20 0 "[ . 1 . 2]" 1
549 1 48 MET ME 1 49 LEU HG 4.420 . 4.420 2.793 2.440 4.213 . 0 0 "[ . 1 . 2]" 1
550 1 48 MET ME 1 52 TRP HD1 5.500 . 5.500 5.489 5.292 5.583 0.083 14 0 "[ . 1 . 2]" 1
551 1 48 MET ME 1 52 TRP HE1 5.340 . 5.340 4.468 4.206 4.650 . 0 0 "[ . 1 . 2]" 1
552 1 48 MET ME 1 52 TRP HH2 3.940 . 3.940 3.164 2.669 3.875 . 0 0 "[ . 1 . 2]" 1
553 1 48 MET ME 1 52 TRP HZ2 3.840 . 3.840 3.365 2.887 3.862 0.022 13 0 "[ . 1 . 2]" 1
554 1 48 MET ME 1 52 TRP HZ3 4.450 . 4.450 3.690 3.313 4.396 . 0 0 "[ . 1 . 2]" 1
555 1 48 MET ME 1 70 LEU HA 5.500 . 5.500 5.262 4.923 5.542 0.042 9 0 "[ . 1 . 2]" 1
556 1 48 MET ME 1 74 VAL HA 5.310 . 5.310 5.140 4.850 5.349 0.039 4 0 "[ . 1 . 2]" 1
557 1 48 MET ME 1 89 LEU HA 5.500 . 5.500 5.466 5.256 5.579 0.079 3 0 "[ . 1 . 2]" 1
558 1 48 MET ME 1 89 LEU MD1 3.050 . 3.050 2.551 2.021 3.085 0.035 16 0 "[ . 1 . 2]" 1
559 1 48 MET ME 1 89 LEU QD 2.480 . 2.480 1.972 1.820 2.161 . 0 0 "[ . 1 . 2]" 1
560 1 48 MET ME 1 89 LEU MD2 3.050 . 3.050 2.215 1.855 3.002 . 0 0 "[ . 1 . 2]" 1
561 1 48 MET ME 1 93 TYR HE2 4.710 . 4.710 4.153 3.307 4.689 . 0 0 "[ . 1 . 2]" 1
562 1 48 MET QG 1 49 LEU H 4.670 . 4.670 3.718 3.472 4.273 . 0 0 "[ . 1 . 2]" 1
563 1 48 MET QG 1 52 TRP HD1 5.340 . 5.340 3.939 3.546 4.834 . 0 0 "[ . 1 . 2]" 1
564 1 48 MET QG 1 52 TRP HE1 3.900 . 3.900 3.029 2.644 3.917 0.017 3 0 "[ . 1 . 2]" 1
565 1 48 MET QG 1 70 LEU QD 4.530 . 4.530 3.185 2.089 3.802 . 0 0 "[ . 1 . 2]" 1
566 1 49 LEU H 1 49 LEU HB2 3.250 . 3.250 2.404 2.124 2.526 . 0 0 "[ . 1 . 2]" 1
567 1 49 LEU H 1 49 LEU MD1 3.980 . 3.980 3.519 2.458 3.752 . 0 0 "[ . 1 . 2]" 1
568 1 49 LEU H 1 49 LEU QD 3.470 . 3.470 3.107 2.434 3.277 . 0 0 "[ . 1 . 2]" 1
569 1 49 LEU H 1 49 LEU MD2 3.980 . 3.980 3.514 3.299 3.924 . 0 0 "[ . 1 . 2]" 1
570 1 49 LEU H 1 49 LEU HG 3.950 . 3.950 2.475 2.165 4.067 0.117 20 0 "[ . 1 . 2]" 1
571 1 49 LEU H 1 50 GLU H 3.240 . 3.240 2.638 2.569 2.700 . 0 0 "[ . 1 . 2]" 1
572 1 49 LEU H 1 50 GLU QG 5.340 . 5.340 4.746 4.413 5.268 . 0 0 "[ . 1 . 2]" 1
573 1 49 LEU H 1 51 ARG H 4.310 . 4.310 4.233 4.057 4.342 0.032 1 0 "[ . 1 . 2]" 1
574 1 49 LEU H 1 51 ARG QB 5.340 . 5.340 5.091 4.863 5.264 . 0 0 "[ . 1 . 2]" 1
575 1 49 LEU H 1 52 TRP H 4.900 . 4.900 4.748 4.643 4.896 . 0 0 "[ . 1 . 2]" 1
576 1 49 LEU H 1 60 LEU MD1 5.500 . 5.500 4.824 4.668 5.020 . 0 0 "[ . 1 . 2]" 1
577 1 49 LEU H 1 60 LEU MD2 5.500 . 5.500 4.267 3.967 4.608 . 0 0 "[ . 1 . 2]" 1
578 1 49 LEU HA 1 49 LEU MD1 4.530 . 4.530 3.776 2.324 3.889 . 0 0 "[ . 1 . 2]" 1
579 1 49 LEU HA 1 49 LEU QD 3.200 . 3.200 2.040 1.945 2.303 . 0 0 "[ . 1 . 2]" 1
580 1 49 LEU HA 1 49 LEU MD2 4.530 . 4.530 2.118 1.951 3.739 . 0 0 "[ . 1 . 2]" 1
581 1 49 LEU HA 1 52 TRP QB 4.800 . 4.800 2.364 2.111 2.571 . 0 0 "[ . 1 . 2]" 1
582 1 49 LEU HA 1 52 TRP HD1 5.000 . 5.000 4.726 4.420 4.960 . 0 0 "[ . 1 . 2]" 1
583 1 49 LEU HA 1 60 LEU MD1 5.500 . 5.500 4.117 3.956 4.269 . 0 0 "[ . 1 . 2]" 1
584 1 49 LEU HA 1 60 LEU QD 4.520 . 4.520 3.764 3.606 3.919 . 0 0 "[ . 1 . 2]" 1
585 1 49 LEU HA 1 60 LEU MD2 5.500 . 5.500 4.373 4.045 4.694 . 0 0 "[ . 1 . 2]" 1
586 1 49 LEU HA 1 107 LEU MD1 5.500 . 5.500 3.423 3.036 5.539 0.039 17 0 "[ . 1 . 2]" 1
587 1 49 LEU HA 1 107 LEU QD 4.790 . 4.790 3.337 2.998 4.550 . 0 0 "[ . 1 . 2]" 1
588 1 49 LEU HA 1 107 LEU MD2 5.500 . 5.500 5.151 4.643 5.520 0.020 14 0 "[ . 1 . 2]" 1
589 1 49 LEU HB2 1 50 GLU H 3.560 . 3.560 2.770 2.622 3.045 . 0 0 "[ . 1 . 2]" 1
590 1 49 LEU HB2 1 60 LEU MD1 4.760 . 4.760 2.845 2.608 3.083 . 0 0 "[ . 1 . 2]" 1
591 1 49 LEU HB2 1 60 LEU QD 4.040 . 4.040 2.370 2.111 2.685 . 0 0 "[ . 1 . 2]" 1
592 1 49 LEU HB2 1 60 LEU MD2 4.760 . 4.760 2.557 2.177 3.080 . 0 0 "[ . 1 . 2]" 1
593 1 49 LEU HB2 1 109 VAL MG2 4.550 . 4.550 4.121 3.960 4.242 . 0 0 "[ . 1 . 2]" 1
594 1 49 LEU HB3 1 50 GLU H 4.010 . 4.010 3.657 3.417 3.796 . 0 0 "[ . 1 . 2]" 1
595 1 49 LEU HB3 1 60 LEU MD1 4.860 . 4.860 2.036 1.971 2.155 . 0 0 "[ . 1 . 2]" 1
596 1 49 LEU HB3 1 60 LEU QD 3.660 . 3.660 1.981 1.918 2.097 . 0 0 "[ . 1 . 2]" 1
597 1 49 LEU HB3 1 60 LEU MD2 4.860 . 4.860 2.762 2.382 3.177 . 0 0 "[ . 1 . 2]" 1
598 1 49 LEU HB3 1 107 LEU HB3 4.600 . 4.600 4.076 3.792 4.401 . 0 0 "[ . 1 . 2]" 1
599 1 49 LEU HB3 1 107 LEU QD 5.430 . 5.430 2.816 2.519 3.834 . 0 0 "[ . 1 . 2]" 1
600 1 49 LEU QD 1 52 TRP H 4.920 . 4.920 4.642 4.462 4.790 . 0 0 "[ . 1 . 2]" 1
601 1 49 LEU QD 1 52 TRP QB 4.860 . 4.860 3.240 2.935 3.614 . 0 0 "[ . 1 . 2]" 1
602 1 49 LEU QD 1 52 TRP HZ2 5.440 . 5.440 5.048 4.637 5.385 . 0 0 "[ . 1 . 2]" 1
603 1 49 LEU QD 1 52 TRP HZ3 4.380 . 4.380 3.271 3.057 3.620 . 0 0 "[ . 1 . 2]" 1
604 1 49 LEU QD 1 60 LEU QD 3.350 . 3.350 2.101 1.952 2.269 . 0 0 "[ . 1 . 2]" 1
605 1 49 LEU QD 1 60 LEU HG 5.440 . 5.440 4.236 4.000 4.406 . 0 0 "[ . 1 . 2]" 1
606 1 49 LEU QD 1 62 TYR HD1 4.360 . 4.360 2.871 2.486 3.419 . 0 0 "[ . 1 . 2]" 1
607 1 49 LEU QD 1 62 TYR HE1 3.770 . 3.770 2.927 2.544 3.616 . 0 0 "[ . 1 . 2]" 1
608 1 49 LEU QD 1 85 ALA MB 4.820 . 4.820 4.577 4.343 4.821 0.001 1 0 "[ . 1 . 2]" 1
609 1 49 LEU QD 1 86 ALA HA 5.440 . 5.440 4.485 4.206 4.844 . 0 0 "[ . 1 . 2]" 1
610 1 49 LEU QD 1 89 LEU QD 3.340 . 3.340 2.465 2.206 3.221 . 0 0 "[ . 1 . 2]" 1
611 1 49 LEU QD 1 93 TYR HE2 4.660 . 4.660 4.206 3.174 4.651 . 0 0 "[ . 1 . 2]" 1
612 1 49 LEU QD 1 100 VAL QG 3.410 . 3.410 2.202 1.935 2.428 . 0 0 "[ . 1 . 2]" 1
613 1 49 LEU QD 1 107 LEU HB3 5.440 . 5.440 3.072 2.637 3.341 . 0 0 "[ . 1 . 2]" 1
614 1 49 LEU QD 1 109 VAL MG1 4.170 . 4.170 2.904 2.669 3.161 . 0 0 "[ . 1 . 2]" 1
615 1 49 LEU QD 1 109 VAL MG2 2.930 . 2.930 1.981 1.822 2.117 . 0 0 "[ . 1 . 2]" 1
616 1 49 LEU MD1 1 50 GLU H 4.820 . 4.820 4.584 4.302 4.779 . 0 0 "[ . 1 . 2]" 1
617 1 49 LEU MD1 1 109 VAL MG2 3.890 . 3.890 2.083 1.834 3.910 0.020 20 0 "[ . 1 . 2]" 1
618 1 49 LEU MD2 1 50 GLU H 4.820 . 4.820 4.736 4.672 4.880 0.060 20 0 "[ . 1 . 2]" 1
619 1 49 LEU MD2 1 109 VAL MG2 3.890 . 3.890 3.498 2.059 3.926 0.036 12 0 "[ . 1 . 2]" 1
620 1 50 GLU H 1 50 GLU HB2 2.950 . 2.950 2.272 2.084 2.414 . 0 0 "[ . 1 . 2]" 1
621 1 50 GLU H 1 50 GLU HB3 3.700 . 3.700 3.533 3.379 3.594 . 0 0 "[ . 1 . 2]" 1
622 1 50 GLU H 1 50 GLU QG 3.220 . 3.220 2.696 2.384 3.152 . 0 0 "[ . 1 . 2]" 1
623 1 50 GLU H 1 51 ARG H 3.130 . 3.130 2.685 2.604 2.757 . 0 0 "[ . 1 . 2]" 1
624 1 50 GLU H 1 52 TRP H 4.360 . 4.360 4.098 3.926 4.224 . 0 0 "[ . 1 . 2]" 1
625 1 50 GLU H 1 53 ALA H 5.090 . 5.090 4.792 4.729 4.883 . 0 0 "[ . 1 . 2]" 1
626 1 50 GLU H 1 60 LEU QD 3.780 . 3.780 2.977 2.689 3.208 . 0 0 "[ . 1 . 2]" 1
627 1 50 GLU HA 1 50 GLU HG2 3.930 . 3.930 2.451 2.166 2.787 . 0 0 "[ . 1 . 2]" 1
628 1 50 GLU HA 1 50 GLU HG3 3.930 . 3.930 3.337 2.895 3.706 . 0 0 "[ . 1 . 2]" 1
629 1 50 GLU HA 1 52 TRP H 5.470 . 5.470 4.493 4.230 4.621 . 0 0 "[ . 1 . 2]" 1
630 1 50 GLU HA 1 53 ALA H 3.980 . 3.980 3.704 3.569 3.944 . 0 0 "[ . 1 . 2]" 1
631 1 50 GLU HA 1 53 ALA MB 3.890 . 3.890 2.950 2.744 3.275 . 0 0 "[ . 1 . 2]" 1
632 1 50 GLU HA 1 54 ALA MB 4.830 . 4.830 4.250 4.083 4.471 . 0 0 "[ . 1 . 2]" 1
633 1 50 GLU HA 1 60 LEU MD1 4.810 . 4.810 4.234 4.046 4.501 . 0 0 "[ . 1 . 2]" 1
634 1 50 GLU HA 1 60 LEU QD 3.560 . 3.560 2.579 2.363 2.787 . 0 0 "[ . 1 . 2]" 1
635 1 50 GLU HA 1 60 LEU MD2 4.810 . 4.810 2.603 2.375 2.822 . 0 0 "[ . 1 . 2]" 1
636 1 50 GLU HB2 1 51 ARG H 3.360 . 3.360 2.719 2.477 2.962 . 0 0 "[ . 1 . 2]" 1
637 1 50 GLU HB2 1 54 ALA MB 5.500 . 5.500 5.213 5.050 5.496 . 0 0 "[ . 1 . 2]" 1
638 1 50 GLU HB2 1 60 LEU QD 4.540 . 4.540 3.870 3.524 4.109 . 0 0 "[ . 1 . 2]" 1
639 1 50 GLU HB3 1 51 ARG H 3.570 . 3.570 3.329 2.996 3.586 0.016 5 0 "[ . 1 . 2]" 1
640 1 50 GLU HB3 1 51 ARG HA 4.930 . 4.930 4.130 3.903 4.326 . 0 0 "[ . 1 . 2]" 1
641 1 50 GLU HB3 1 52 TRP H 5.500 . 5.500 5.440 5.261 5.521 0.021 19 0 "[ . 1 . 2]" 1
642 1 50 GLU HB3 1 54 ALA MB 4.660 . 4.660 4.036 3.884 4.291 . 0 0 "[ . 1 . 2]" 1
643 1 50 GLU HB3 1 60 LEU QD 4.760 . 4.760 4.142 3.872 4.386 . 0 0 "[ . 1 . 2]" 1
644 1 50 GLU QG 1 54 ALA MB 5.340 . 5.340 5.206 4.907 5.372 0.032 1 0 "[ . 1 . 2]" 1
645 1 50 GLU QG 1 60 LEU QD 3.310 . 3.310 2.112 1.875 2.471 . 0 0 "[ . 1 . 2]" 1
646 1 51 ARG H 1 51 ARG HB2 3.650 . 3.650 2.403 2.080 2.649 . 0 0 "[ . 1 . 2]" 1
647 1 51 ARG H 1 51 ARG QB 2.980 . 2.980 2.251 2.061 2.492 . 0 0 "[ . 1 . 2]" 1
648 1 51 ARG H 1 51 ARG HB3 3.650 . 3.650 3.017 2.417 3.619 . 0 0 "[ . 1 . 2]" 1
649 1 51 ARG H 1 51 ARG HE 5.300 . 5.300 4.842 3.719 5.341 0.041 16 0 "[ . 1 . 2]" 1
650 1 51 ARG H 1 51 ARG QG 4.310 . 4.310 3.354 2.112 4.053 . 0 0 "[ . 1 . 2]" 1
651 1 51 ARG H 1 52 TRP H 3.220 . 3.220 2.604 2.491 2.669 . 0 0 "[ . 1 . 2]" 1
652 1 51 ARG H 1 53 ALA H 4.510 . 4.510 4.297 4.181 4.442 . 0 0 "[ . 1 . 2]" 1
653 1 51 ARG H 1 54 ALA MB 4.710 . 4.710 4.541 4.414 4.697 . 0 0 "[ . 1 . 2]" 1
654 1 51 ARG HA 1 51 ARG QD 4.880 . 4.880 3.154 1.967 4.235 . 0 0 "[ . 1 . 2]" 1
655 1 51 ARG HA 1 53 ALA H 4.870 . 4.870 4.686 4.466 4.851 . 0 0 "[ . 1 . 2]" 1
656 1 51 ARG HA 1 54 ALA MB 3.660 . 3.660 2.614 2.464 2.838 . 0 0 "[ . 1 . 2]" 1
657 1 51 ARG QB 1 51 ARG HE 4.170 . 4.170 2.816 1.944 4.056 . 0 0 "[ . 1 . 2]" 1
658 1 51 ARG QB 1 52 TRP H 3.250 . 3.250 2.546 2.394 2.733 . 0 0 "[ . 1 . 2]" 1
659 1 51 ARG HB2 1 52 TRP H 3.960 . 3.960 3.276 2.432 3.924 . 0 0 "[ . 1 . 2]" 1
660 1 51 ARG HB3 1 52 TRP H 3.960 . 3.960 2.948 2.431 3.723 . 0 0 "[ . 1 . 2]" 1
661 1 51 ARG QG 1 52 TRP H 4.650 . 4.650 3.968 3.491 4.460 . 0 0 "[ . 1 . 2]" 1
662 1 51 ARG QG 1 54 ALA MB 5.130 . 5.130 4.151 3.554 5.021 . 0 0 "[ . 1 . 2]" 1
663 1 51 ARG HG2 1 52 TRP H 5.500 . 5.500 4.397 3.639 5.071 . 0 0 "[ . 1 . 2]" 1
664 1 51 ARG HG3 1 52 TRP H 5.500 . 5.500 4.658 3.703 5.264 . 0 0 "[ . 1 . 2]" 1
665 1 52 TRP H 1 52 TRP HB2 3.720 . 3.720 2.362 2.284 2.450 . 0 0 "[ . 1 . 2]" 1
666 1 52 TRP H 1 52 TRP QB 3.050 . 3.050 2.330 2.258 2.411 . 0 0 "[ . 1 . 2]" 1
667 1 52 TRP H 1 52 TRP HB3 3.720 . 3.720 3.571 3.548 3.589 . 0 0 "[ . 1 . 2]" 1
668 1 52 TRP H 1 52 TRP HD1 3.740 . 3.740 2.714 2.510 2.960 . 0 0 "[ . 1 . 2]" 1
669 1 52 TRP H 1 52 TRP HE1 5.360 . 5.360 4.865 4.637 5.078 . 0 0 "[ . 1 . 2]" 1
670 1 52 TRP H 1 53 ALA H 3.320 . 3.320 2.781 2.668 2.846 . 0 0 "[ . 1 . 2]" 1
671 1 52 TRP H 1 53 ALA MB 4.570 . 4.570 4.417 4.302 4.491 . 0 0 "[ . 1 . 2]" 1
672 1 52 TRP H 1 54 ALA H 4.650 . 4.650 4.133 3.798 4.384 . 0 0 "[ . 1 . 2]" 1
673 1 52 TRP H 1 55 ASP H 5.080 . 5.080 4.837 4.658 5.073 . 0 0 "[ . 1 . 2]" 1
674 1 52 TRP HA 1 52 TRP HD1 3.570 . 3.570 2.391 2.282 2.466 . 0 0 "[ . 1 . 2]" 1
675 1 52 TRP HA 1 54 ALA H 4.940 . 4.940 4.637 4.214 4.926 . 0 0 "[ . 1 . 2]" 1
676 1 52 TRP HA 1 55 ASP H 4.390 . 4.390 3.880 3.581 4.089 . 0 0 "[ . 1 . 2]" 1
677 1 52 TRP HA 1 56 SER H 5.280 . 5.280 4.719 4.377 5.251 . 0 0 "[ . 1 . 2]" 1
678 1 52 TRP QB 1 53 ALA H 3.120 . 3.120 2.344 2.267 2.418 . 0 0 "[ . 1 . 2]" 1
679 1 52 TRP QB 1 107 LEU QD 4.390 . 4.390 2.687 2.412 3.578 . 0 0 "[ . 1 . 2]" 1
680 1 52 TRP HB2 1 53 ALA H 3.680 . 3.680 2.408 2.333 2.497 . 0 0 "[ . 1 . 2]" 1
681 1 52 TRP HB3 1 53 ALA H 3.680 . 3.680 3.226 3.027 3.385 . 0 0 "[ . 1 . 2]" 1
682 1 52 TRP HH2 1 77 ILE MD 4.490 . 4.490 4.287 3.943 4.540 0.050 14 0 "[ . 1 . 2]" 1
683 1 52 TRP HH2 1 77 ILE MG 4.050 . 4.050 3.500 3.212 3.784 . 0 0 "[ . 1 . 2]" 1
684 1 52 TRP HH2 1 85 ALA MB 3.600 . 3.600 2.847 2.278 3.184 . 0 0 "[ . 1 . 2]" 1
685 1 52 TRP HH2 1 89 LEU MD1 4.070 . 4.070 2.287 1.981 3.267 . 0 0 "[ . 1 . 2]" 1
686 1 52 TRP HH2 1 89 LEU MD2 4.070 . 4.070 2.888 1.903 3.247 . 0 0 "[ . 1 . 2]" 1
687 1 52 TRP HZ2 1 74 VAL QG 4.900 . 4.900 4.080 3.574 4.520 . 0 0 "[ . 1 . 2]" 1
688 1 52 TRP HZ2 1 77 ILE HB 5.500 . 5.500 4.683 4.451 4.910 . 0 0 "[ . 1 . 2]" 1
689 1 52 TRP HZ2 1 77 ILE MD 5.500 . 5.500 5.409 5.292 5.516 0.016 5 0 "[ . 1 . 2]" 1
690 1 52 TRP HZ2 1 77 ILE MG 4.970 . 4.970 4.601 4.164 4.924 . 0 0 "[ . 1 . 2]" 1
691 1 52 TRP HZ2 1 85 ALA MB 4.920 . 4.920 4.433 3.850 4.788 . 0 0 "[ . 1 . 2]" 1
692 1 52 TRP HZ2 1 89 LEU MD1 4.550 . 4.550 3.980 3.445 4.599 0.049 6 0 "[ . 1 . 2]" 1
693 1 52 TRP HZ2 1 89 LEU QD 3.930 . 3.930 3.647 3.309 3.910 . 0 0 "[ . 1 . 2]" 1
694 1 52 TRP HZ2 1 89 LEU MD2 4.550 . 4.550 4.335 3.667 4.597 0.047 8 0 "[ . 1 . 2]" 1
695 1 52 TRP HZ3 1 77 ILE MG 5.080 . 5.080 4.806 4.448 5.096 0.016 3 0 "[ . 1 . 2]" 1
696 1 52 TRP HZ3 1 85 ALA MB 3.840 . 3.840 2.344 2.065 2.695 . 0 0 "[ . 1 . 2]" 1
697 1 52 TRP HZ3 1 89 LEU MD1 4.420 . 4.420 2.649 1.968 3.974 . 0 0 "[ . 1 . 2]" 1
698 1 52 TRP HZ3 1 89 LEU QD 3.620 . 3.620 2.346 1.961 3.003 . 0 0 "[ . 1 . 2]" 1
699 1 52 TRP HZ3 1 89 LEU MD2 4.420 . 4.420 3.320 2.344 4.413 . 0 0 "[ . 1 . 2]" 1
700 1 53 ALA H 1 53 ALA MB 2.850 . 2.850 2.211 2.074 2.238 . 0 0 "[ . 1 . 2]" 1
701 1 53 ALA H 1 54 ALA H 3.230 . 3.230 2.712 2.606 2.784 . 0 0 "[ . 1 . 2]" 1
702 1 53 ALA H 1 54 ALA MB 4.420 . 4.420 4.374 4.278 4.446 0.026 3 0 "[ . 1 . 2]" 1
703 1 53 ALA H 1 58 MET HB2 5.310 . 5.310 4.904 4.605 5.159 . 0 0 "[ . 1 . 2]" 1
704 1 53 ALA H 1 107 LEU MD1 5.380 . 5.380 3.161 2.918 5.425 0.045 17 0 "[ . 1 . 2]" 1
705 1 53 ALA H 1 107 LEU QD 3.900 . 3.900 3.052 2.905 3.554 . 0 0 "[ . 1 . 2]" 1
706 1 53 ALA H 1 107 LEU MD2 5.380 . 5.380 5.296 3.604 5.439 0.059 11 0 "[ . 1 . 2]" 1
707 1 53 ALA H 1 107 LEU HG 5.500 . 5.500 5.319 4.723 5.549 0.049 13 0 "[ . 1 . 2]" 1
708 1 53 ALA HA 1 54 ALA MB 5.320 . 5.320 5.035 4.984 5.054 . 0 0 "[ . 1 . 2]" 1
709 1 53 ALA HA 1 56 SER H 4.050 . 4.050 3.563 3.445 3.694 . 0 0 "[ . 1 . 2]" 1
710 1 53 ALA HA 1 56 SER QB 4.820 . 4.820 3.458 2.681 4.316 . 0 0 "[ . 1 . 2]" 1
711 1 53 ALA HA 1 58 MET H 3.920 . 3.920 3.341 3.159 3.601 . 0 0 "[ . 1 . 2]" 1
712 1 53 ALA HA 1 58 MET HA 5.380 . 5.380 5.097 4.852 5.403 0.023 5 0 "[ . 1 . 2]" 1
713 1 53 ALA HA 1 58 MET HB2 3.780 . 3.780 2.258 1.909 2.619 . 0 0 "[ . 1 . 2]" 1
714 1 53 ALA HA 1 58 MET HB3 4.330 . 4.330 3.866 3.446 4.308 . 0 0 "[ . 1 . 2]" 1
715 1 53 ALA HA 1 58 MET ME 3.990 . 3.990 3.239 2.691 3.593 . 0 0 "[ . 1 . 2]" 1
716 1 53 ALA HA 1 107 LEU QD 3.970 . 3.970 3.057 2.633 3.422 . 0 0 "[ . 1 . 2]" 1
717 1 53 ALA MB 1 54 ALA H 3.030 . 3.030 2.535 2.324 2.803 . 0 0 "[ . 1 . 2]" 1
718 1 53 ALA MB 1 55 ASP H 4.620 . 4.620 4.561 4.467 4.660 0.040 7 0 "[ . 1 . 2]" 1
719 1 53 ALA MB 1 56 SER H 4.610 . 4.610 4.604 4.505 4.686 0.076 9 0 "[ . 1 . 2]" 1
720 1 53 ALA MB 1 58 MET H 4.000 . 4.000 3.264 3.023 3.552 . 0 0 "[ . 1 . 2]" 1
721 1 53 ALA MB 1 58 MET HA 4.700 . 4.700 4.286 4.041 4.505 . 0 0 "[ . 1 . 2]" 1
722 1 53 ALA MB 1 58 MET HB2 2.780 . 2.780 2.518 2.258 2.794 0.014 4 0 "[ . 1 . 2]" 1
723 1 53 ALA MB 1 58 MET HB3 3.910 . 3.910 3.367 3.051 3.684 . 0 0 "[ . 1 . 2]" 1
724 1 53 ALA MB 1 58 MET ME 3.510 . 3.510 3.448 3.079 3.566 0.056 3 0 "[ . 1 . 2]" 1
725 1 53 ALA MB 1 59 GLN H 4.100 . 4.100 3.809 3.431 4.125 0.025 13 0 "[ . 1 . 2]" 1
726 1 53 ALA MB 1 59 GLN HA 4.090 . 4.090 3.411 3.056 3.688 . 0 0 "[ . 1 . 2]" 1
727 1 53 ALA MB 1 59 GLN HB3 5.500 . 5.500 5.201 4.911 5.419 . 0 0 "[ . 1 . 2]" 1
728 1 53 ALA MB 1 60 LEU H 4.440 . 4.440 4.015 3.738 4.230 . 0 0 "[ . 1 . 2]" 1
729 1 53 ALA MB 1 60 LEU HA 4.060 . 4.060 3.857 3.712 4.079 0.019 18 0 "[ . 1 . 2]" 1
730 1 53 ALA MB 1 60 LEU HB2 4.160 . 4.160 2.645 2.315 2.943 . 0 0 "[ . 1 . 2]" 1
731 1 53 ALA MB 1 60 LEU QB 3.400 . 3.400 2.586 2.268 2.840 . 0 0 "[ . 1 . 2]" 1
732 1 53 ALA MB 1 60 LEU HB3 4.160 . 4.160 3.663 3.247 4.055 . 0 0 "[ . 1 . 2]" 1
733 1 53 ALA MB 1 107 LEU QD 3.000 . 3.000 2.000 1.812 2.223 . 0 0 "[ . 1 . 2]" 1
734 1 54 ALA H 1 54 ALA MB 2.740 . 2.740 2.224 2.049 2.249 . 0 0 "[ . 1 . 2]" 1
735 1 54 ALA H 1 55 ASP H 3.110 . 3.110 2.746 2.646 2.865 . 0 0 "[ . 1 . 2]" 1
736 1 54 ALA H 1 55 ASP HA 5.490 . 5.490 5.331 5.253 5.426 . 0 0 "[ . 1 . 2]" 1
737 1 54 ALA H 1 55 ASP QB 4.720 . 4.720 4.504 4.362 4.619 . 0 0 "[ . 1 . 2]" 1
738 1 54 ALA H 1 56 SER H 4.420 . 4.420 4.176 3.889 4.344 . 0 0 "[ . 1 . 2]" 1
739 1 54 ALA H 1 57 ASN H 5.150 . 5.150 4.947 4.807 5.156 0.006 15 0 "[ . 1 . 2]" 1
740 1 54 ALA HA 1 56 SER H 4.500 . 4.500 4.242 3.782 4.413 . 0 0 "[ . 1 . 2]" 1
741 1 54 ALA HA 1 57 ASN H 4.010 . 4.010 3.475 3.344 3.563 . 0 0 "[ . 1 . 2]" 1
742 1 54 ALA HA 1 58 MET H 4.380 . 4.380 3.621 3.345 3.894 . 0 0 "[ . 1 . 2]" 1
743 1 54 ALA MB 1 55 ASP H 3.100 . 3.100 2.558 2.432 2.781 . 0 0 "[ . 1 . 2]" 1
744 1 54 ALA MB 1 55 ASP HA 4.130 . 4.130 3.792 3.733 3.849 . 0 0 "[ . 1 . 2]" 1
745 1 54 ALA MB 1 56 SER H 4.510 . 4.510 4.451 4.224 4.601 0.091 2 0 "[ . 1 . 2]" 1
746 1 54 ALA MB 1 57 ASN H 4.440 . 4.440 4.448 4.327 4.505 0.065 3 0 "[ . 1 . 2]" 1
747 1 55 ASP H 1 55 ASP HB2 3.550 . 3.550 2.329 2.133 2.675 . 0 0 "[ . 1 . 2]" 1
748 1 55 ASP H 1 55 ASP HB3 3.550 . 3.550 2.818 2.428 3.153 . 0 0 "[ . 1 . 2]" 1
749 1 55 ASP H 1 56 SER H 3.310 . 3.310 2.641 2.535 2.783 . 0 0 "[ . 1 . 2]" 1
750 1 55 ASP H 1 57 ASN H 4.510 . 4.510 3.943 3.789 4.123 . 0 0 "[ . 1 . 2]" 1
751 1 55 ASP QB 1 56 SER H 3.670 . 3.670 2.763 2.570 3.198 . 0 0 "[ . 1 . 2]" 1
752 1 55 ASP QB 1 56 SER QB 5.180 . 5.180 4.165 3.574 4.405 . 0 0 "[ . 1 . 2]" 1
753 1 55 ASP HB2 1 56 SER H 4.310 . 4.310 3.788 3.611 3.970 . 0 0 "[ . 1 . 2]" 1
754 1 55 ASP HB3 1 56 SER H 4.310 . 4.310 2.854 2.617 3.452 . 0 0 "[ . 1 . 2]" 1
755 1 56 SER H 1 56 SER HB2 3.850 . 3.850 2.820 2.464 3.578 . 0 0 "[ . 1 . 2]" 1
756 1 56 SER H 1 56 SER QB 3.320 . 3.320 2.637 2.351 2.993 . 0 0 "[ . 1 . 2]" 1
757 1 56 SER H 1 56 SER HB3 3.850 . 3.850 3.480 2.691 3.791 . 0 0 "[ . 1 . 2]" 1
758 1 56 SER H 1 57 ASN H 3.030 . 3.030 2.432 2.181 2.545 . 0 0 "[ . 1 . 2]" 1
759 1 56 SER H 1 57 ASN HA 4.610 . 4.610 4.554 4.278 4.639 0.029 6 0 "[ . 1 . 2]" 1
760 1 56 SER H 1 58 MET H 4.000 . 4.000 3.612 3.346 3.954 . 0 0 "[ . 1 . 2]" 1
761 1 56 SER QB 1 57 ASN H 3.930 . 3.930 3.622 3.364 3.880 . 0 0 "[ . 1 . 2]" 1
762 1 56 SER QB 1 58 MET H 4.250 . 4.250 3.583 3.164 4.233 . 0 0 "[ . 1 . 2]" 1
763 1 56 SER QB 1 58 MET ME 4.020 . 4.020 3.466 2.708 3.926 . 0 0 "[ . 1 . 2]" 1
764 1 56 SER QB 1 58 MET QG 4.110 . 4.110 2.202 1.887 2.613 . 0 0 "[ . 1 . 2]" 1
765 1 56 SER QB 1 82 VAL QG 4.740 . 4.740 3.960 3.204 4.329 . 0 0 "[ . 1 . 2]" 1
766 1 56 SER HB2 1 57 ASN H 4.590 . 4.590 3.901 3.636 4.360 . 0 0 "[ . 1 . 2]" 1
767 1 56 SER HB3 1 57 ASN H 4.590 . 4.590 4.399 3.537 4.608 0.018 2 0 "[ . 1 . 2]" 1
768 1 57 ASN H 1 57 ASN HA 2.780 . 2.780 2.272 2.262 2.279 . 0 0 "[ . 1 . 2]" 1
769 1 57 ASN H 1 57 ASN HB2 4.190 . 4.190 3.179 3.019 3.512 . 0 0 "[ . 1 . 2]" 1
770 1 57 ASN H 1 57 ASN QB 3.620 . 3.620 3.035 2.900 3.312 . 0 0 "[ . 1 . 2]" 1
771 1 57 ASN H 1 57 ASN HB3 4.190 . 4.190 3.850 3.587 4.109 . 0 0 "[ . 1 . 2]" 1
772 1 57 ASN H 1 58 MET H 3.090 . 3.090 2.742 2.618 2.850 . 0 0 "[ . 1 . 2]" 1
773 1 57 ASN H 1 58 MET HB2 5.160 . 5.160 4.846 4.660 4.987 . 0 0 "[ . 1 . 2]" 1
774 1 57 ASN HA 1 58 MET H 3.230 . 3.230 2.717 2.583 2.886 . 0 0 "[ . 1 . 2]" 1
775 1 57 ASN HB2 1 58 MET H 4.680 . 4.680 4.480 4.262 4.640 . 0 0 "[ . 1 . 2]" 1
776 1 57 ASN HB3 1 58 MET H 4.680 . 4.680 4.296 4.105 4.417 . 0 0 "[ . 1 . 2]" 1
777 1 58 MET H 1 58 MET HB2 3.280 . 3.280 2.536 2.335 2.641 . 0 0 "[ . 1 . 2]" 1
778 1 58 MET H 1 58 MET HB3 3.820 . 3.820 3.708 3.592 3.784 . 0 0 "[ . 1 . 2]" 1
779 1 58 MET H 1 58 MET QG 3.590 . 3.590 2.853 2.624 3.131 . 0 0 "[ . 1 . 2]" 1
780 1 58 MET H 1 59 GLN H 4.580 . 4.580 4.477 4.429 4.530 . 0 0 "[ . 1 . 2]" 1
781 1 58 MET HA 1 58 MET ME 4.540 . 4.540 4.193 4.001 4.341 . 0 0 "[ . 1 . 2]" 1
782 1 58 MET HA 1 58 MET HG2 4.020 . 4.020 2.551 2.355 2.776 . 0 0 "[ . 1 . 2]" 1
783 1 58 MET HA 1 58 MET QG 3.440 . 3.440 2.412 2.314 2.532 . 0 0 "[ . 1 . 2]" 1
784 1 58 MET HA 1 58 MET HG3 4.020 . 4.020 3.136 2.729 3.514 . 0 0 "[ . 1 . 2]" 1
785 1 58 MET HA 1 59 GLN H 2.930 . 2.930 2.478 2.369 2.525 . 0 0 "[ . 1 . 2]" 1
786 1 58 MET HA 1 59 GLN HG2 5.500 . 5.500 4.170 3.680 5.606 0.106 16 0 "[ . 1 . 2]" 1
787 1 58 MET HA 1 59 GLN QG 4.630 . 4.630 3.900 3.454 4.673 0.043 16 0 "[ . 1 . 2]" 1
788 1 58 MET HA 1 59 GLN HG3 5.500 . 5.500 5.292 3.504 5.583 0.083 9 0 "[ . 1 . 2]" 1
789 1 58 MET HA 1 105 ASN QB 4.100 . 4.100 3.400 2.696 4.152 0.052 11 0 "[ . 1 . 2]" 1
790 1 58 MET HB2 1 58 MET ME 2.830 . 2.830 2.503 2.200 2.814 . 0 0 "[ . 1 . 2]" 1
791 1 58 MET HB2 1 59 GLN H 3.870 . 3.870 3.480 3.376 3.646 . 0 0 "[ . 1 . 2]" 1
792 1 58 MET HB2 1 82 VAL QG 4.840 . 4.840 4.589 4.130 4.830 . 0 0 "[ . 1 . 2]" 1
793 1 58 MET HB3 1 58 MET ME 3.180 . 3.180 2.220 2.057 2.349 . 0 0 "[ . 1 . 2]" 1
794 1 58 MET HB3 1 59 GLN H 3.240 . 3.240 2.267 2.147 2.520 . 0 0 "[ . 1 . 2]" 1
795 1 58 MET HB3 1 106 LYS HA 5.070 . 5.070 3.119 2.769 3.471 . 0 0 "[ . 1 . 2]" 1
796 1 58 MET HB3 1 107 LEU H 4.320 . 4.320 3.993 3.698 4.224 . 0 0 "[ . 1 . 2]" 1
797 1 58 MET HB3 1 107 LEU MD1 5.500 . 5.500 4.452 4.101 4.798 . 0 0 "[ . 1 . 2]" 1
798 1 58 MET HB3 1 107 LEU QD 4.150 . 4.150 4.053 2.519 4.240 0.090 14 0 "[ . 1 . 2]" 1
799 1 58 MET HB3 1 107 LEU MD2 5.500 . 5.500 4.869 2.540 5.501 0.001 7 0 "[ . 1 . 2]" 1
800 1 58 MET ME 1 58 MET HG2 3.490 . 3.490 2.940 2.417 3.410 . 0 0 "[ . 1 . 2]" 1
801 1 58 MET ME 1 58 MET QG 2.820 . 2.820 2.493 2.367 2.582 . 0 0 "[ . 1 . 2]" 1
802 1 58 MET ME 1 58 MET HG3 3.490 . 3.490 3.022 2.579 3.413 . 0 0 "[ . 1 . 2]" 1
803 1 58 MET ME 1 82 VAL HA 5.150 . 5.150 5.032 4.873 5.183 0.033 12 0 "[ . 1 . 2]" 1
804 1 58 MET ME 1 82 VAL MG1 3.090 . 3.090 2.301 1.932 2.860 . 0 0 "[ . 1 . 2]" 1
805 1 58 MET ME 1 82 VAL QG 2.700 . 2.700 1.870 1.755 1.956 . 0 0 "[ . 1 . 2]" 1
806 1 58 MET ME 1 82 VAL MG2 3.090 . 3.090 2.073 1.851 3.137 0.047 14 0 "[ . 1 . 2]" 1
807 1 58 MET ME 1 86 ALA MB 5.500 . 5.500 5.311 5.000 5.520 0.020 14 0 "[ . 1 . 2]" 1
808 1 58 MET ME 1 102 VAL HA 4.550 . 4.550 4.377 4.181 4.596 0.046 10 0 "[ . 1 . 2]" 1
809 1 58 MET ME 1 102 VAL MG1 3.570 . 3.570 2.816 2.056 3.682 0.112 3 0 "[ . 1 . 2]" 1
810 1 58 MET ME 1 102 VAL QG 2.390 . 2.390 2.072 1.926 2.235 . 0 0 "[ . 1 . 2]" 1
811 1 58 MET ME 1 102 VAL MG2 3.570 . 3.570 2.738 1.933 3.463 . 0 0 "[ . 1 . 2]" 1
812 1 58 MET ME 1 105 ASN H 5.040 . 5.040 4.539 4.132 4.928 . 0 0 "[ . 1 . 2]" 1
813 1 58 MET ME 1 105 ASN HA 3.330 . 3.330 2.934 2.155 3.465 0.135 2 0 "[ . 1 . 2]" 1
814 1 58 MET ME 1 105 ASN QB 4.450 . 4.450 4.134 3.552 4.496 0.046 8 0 "[ . 1 . 2]" 1
815 1 58 MET ME 1 106 LYS H 3.910 . 3.910 3.793 3.416 3.952 0.042 5 0 "[ . 1 . 2]" 1
816 1 58 MET ME 1 106 LYS HA 3.660 . 3.660 3.568 3.300 3.678 0.018 19 0 "[ . 1 . 2]" 1
817 1 58 MET ME 1 107 LEU H 4.170 . 4.170 3.640 3.483 3.877 . 0 0 "[ . 1 . 2]" 1
818 1 58 MET ME 1 107 LEU HA 4.480 . 4.480 4.112 3.950 4.338 . 0 0 "[ . 1 . 2]" 1
819 1 58 MET ME 1 107 LEU HB2 4.800 . 4.800 4.285 3.873 4.681 . 0 0 "[ . 1 . 2]" 1
820 1 58 MET ME 1 107 LEU HB3 5.360 . 5.360 4.759 4.609 4.967 . 0 0 "[ . 1 . 2]" 1
821 1 58 MET ME 1 107 LEU MD1 3.420 . 3.420 2.874 1.926 3.184 . 0 0 "[ . 1 . 2]" 1
822 1 58 MET ME 1 107 LEU QD 2.960 . 2.960 2.376 1.639 2.656 . 0 0 "[ . 1 . 2]" 1
823 1 58 MET ME 1 107 LEU MD2 3.420 . 3.420 2.585 1.775 3.102 . 0 0 "[ . 1 . 2]" 1
824 1 58 MET ME 1 107 LEU HG 3.150 . 3.150 2.301 2.120 3.342 0.192 17 0 "[ . 1 . 2]" 1
825 1 58 MET QG 1 59 GLN H 4.560 . 4.560 3.827 3.561 4.010 . 0 0 "[ . 1 . 2]" 1
826 1 58 MET QG 1 105 ASN HA 4.430 . 4.430 3.322 2.530 4.064 . 0 0 "[ . 1 . 2]" 1
827 1 58 MET QG 1 105 ASN QB 4.770 . 4.770 2.956 2.184 3.709 . 0 0 "[ . 1 . 2]" 1
828 1 58 MET HG2 1 105 ASN HA 5.170 . 5.170 3.407 2.549 4.292 . 0 0 "[ . 1 . 2]" 1
829 1 58 MET HG3 1 105 ASN HA 5.170 . 5.170 4.752 4.236 5.194 0.024 9 0 "[ . 1 . 2]" 1
830 1 59 GLN H 1 59 GLN HB2 3.620 . 3.620 2.392 2.232 2.498 . 0 0 "[ . 1 . 2]" 1
831 1 59 GLN H 1 59 GLN HB3 3.880 . 3.880 3.608 3.391 3.692 . 0 0 "[ . 1 . 2]" 1
832 1 59 GLN H 1 59 GLN QG 3.820 . 3.820 3.030 2.662 3.619 . 0 0 "[ . 1 . 2]" 1
833 1 59 GLN H 1 60 LEU H 4.590 . 4.590 4.539 4.501 4.573 . 0 0 "[ . 1 . 2]" 1
834 1 59 GLN H 1 105 ASN QB 4.860 . 4.860 3.923 3.348 4.439 . 0 0 "[ . 1 . 2]" 1
835 1 59 GLN H 1 106 LYS HA 3.280 . 3.280 2.505 2.316 2.694 . 0 0 "[ . 1 . 2]" 1
836 1 59 GLN H 1 106 LYS HG3 4.590 . 4.590 3.642 3.392 3.930 . 0 0 "[ . 1 . 2]" 1
837 1 59 GLN H 1 107 LEU H 4.130 . 4.130 3.892 3.641 4.112 . 0 0 "[ . 1 . 2]" 1
838 1 59 GLN H 1 107 LEU QD 5.250 . 5.250 5.023 3.719 5.248 . 0 0 "[ . 1 . 2]" 1
839 1 59 GLN HA 1 59 GLN HG2 3.760 . 3.760 2.889 2.249 3.625 . 0 0 "[ . 1 . 2]" 1
840 1 59 GLN HA 1 59 GLN QG 3.260 . 3.260 2.665 2.225 3.000 . 0 0 "[ . 1 . 2]" 1
841 1 59 GLN HA 1 59 GLN HG3 3.760 . 3.760 3.496 2.369 3.728 . 0 0 "[ . 1 . 2]" 1
842 1 59 GLN HA 1 60 LEU H 2.710 . 2.710 2.371 2.271 2.507 . 0 0 "[ . 1 . 2]" 1
843 1 59 GLN HA 1 60 LEU HA 4.680 . 4.680 4.443 4.383 4.502 . 0 0 "[ . 1 . 2]" 1
844 1 59 GLN HA 1 106 LYS QE 5.450 . 5.450 4.767 4.279 5.473 0.023 4 0 "[ . 1 . 2]" 1
845 1 59 GLN HB2 1 106 LYS HA 4.440 . 4.440 2.968 2.605 3.289 . 0 0 "[ . 1 . 2]" 1
846 1 59 GLN HB2 1 106 LYS HB2 4.910 . 4.910 2.979 2.562 3.382 . 0 0 "[ . 1 . 2]" 1
847 1 59 GLN HB2 1 106 LYS QD 4.390 . 4.390 3.586 3.035 4.261 . 0 0 "[ . 1 . 2]" 1
848 1 59 GLN HB2 1 106 LYS QE 4.410 . 4.410 3.022 2.518 3.533 . 0 0 "[ . 1 . 2]" 1
849 1 59 GLN HB2 1 106 LYS HG2 4.640 . 4.640 3.790 3.533 3.938 . 0 0 "[ . 1 . 2]" 1
850 1 59 GLN HB2 1 106 LYS HG3 4.630 . 4.630 2.087 1.897 2.259 . 0 0 "[ . 1 . 2]" 1
851 1 59 GLN HB2 1 107 LEU H 4.560 . 4.560 4.315 3.956 4.546 . 0 0 "[ . 1 . 2]" 1
852 1 59 GLN HB3 1 60 LEU H 4.120 . 4.120 2.567 2.260 2.807 . 0 0 "[ . 1 . 2]" 1
853 1 59 GLN HB3 1 60 LEU HA 5.020 . 5.020 4.329 4.081 4.547 . 0 0 "[ . 1 . 2]" 1
854 1 59 GLN HB3 1 106 LYS HA 5.500 . 5.500 4.129 3.726 4.486 . 0 0 "[ . 1 . 2]" 1
855 1 59 GLN HB3 1 106 LYS HB2 5.500 . 5.500 4.287 3.788 4.795 . 0 0 "[ . 1 . 2]" 1
856 1 59 GLN HB3 1 106 LYS QD 5.500 . 5.500 3.946 3.272 4.534 . 0 0 "[ . 1 . 2]" 1
857 1 59 GLN HB3 1 106 LYS QE 3.450 . 3.450 2.484 1.942 3.357 . 0 0 "[ . 1 . 2]" 1
858 1 59 GLN HB3 1 106 LYS HG2 5.500 . 5.500 4.000 3.286 4.362 . 0 0 "[ . 1 . 2]" 1
859 1 59 GLN HB3 1 106 LYS HG3 4.040 . 4.040 2.451 1.938 2.859 . 0 0 "[ . 1 . 2]" 1
860 1 59 GLN QG 1 60 LEU H 4.600 . 4.600 4.094 3.608 4.387 . 0 0 "[ . 1 . 2]" 1
861 1 59 GLN QG 1 106 LYS QD 5.340 . 5.340 4.429 3.769 5.294 . 0 0 "[ . 1 . 2]" 1
862 1 59 GLN QG 1 106 LYS QE 4.370 . 4.370 3.496 3.102 3.900 . 0 0 "[ . 1 . 2]" 1
863 1 59 GLN QG 1 106 LYS HG3 4.840 . 4.840 3.806 3.621 4.022 . 0 0 "[ . 1 . 2]" 1
864 1 59 GLN HG2 1 60 LEU H 5.470 . 5.470 4.594 3.861 4.990 . 0 0 "[ . 1 . 2]" 1
865 1 59 GLN HG2 1 106 LYS HA 5.500 . 5.500 5.046 4.470 5.502 0.002 20 0 "[ . 1 . 2]" 1
866 1 59 GLN HG2 1 106 LYS QE 4.990 . 4.990 4.563 3.720 4.897 . 0 0 "[ . 1 . 2]" 1
867 1 59 GLN HG3 1 60 LEU H 5.470 . 5.470 4.641 3.793 4.992 . 0 0 "[ . 1 . 2]" 1
868 1 59 GLN HG3 1 106 LYS HA 5.500 . 5.500 5.315 4.543 5.576 0.076 18 0 "[ . 1 . 2]" 1
869 1 59 GLN HG3 1 106 LYS QE 4.990 . 4.990 3.729 3.171 4.857 . 0 0 "[ . 1 . 2]" 1
870 1 60 LEU H 1 60 LEU HB2 3.410 . 3.410 3.271 3.114 3.380 . 0 0 "[ . 1 . 2]" 1
871 1 60 LEU H 1 60 LEU QB 2.830 . 2.830 2.522 2.407 2.629 . 0 0 "[ . 1 . 2]" 1
872 1 60 LEU H 1 60 LEU HB3 3.410 . 3.410 2.624 2.506 2.742 . 0 0 "[ . 1 . 2]" 1
873 1 60 LEU H 1 60 LEU MD1 4.590 . 4.590 4.464 4.387 4.535 . 0 0 "[ . 1 . 2]" 1
874 1 60 LEU H 1 60 LEU QD 4.030 . 4.030 3.968 3.910 4.024 . 0 0 "[ . 1 . 2]" 1
875 1 60 LEU H 1 60 LEU MD2 4.590 . 4.590 4.445 4.375 4.533 . 0 0 "[ . 1 . 2]" 1
876 1 60 LEU H 1 60 LEU HG 5.280 . 5.280 4.334 4.247 4.439 . 0 0 "[ . 1 . 2]" 1
877 1 60 LEU H 1 61 SER H 4.300 . 4.300 4.319 4.225 4.353 0.053 17 0 "[ . 1 . 2]" 1
878 1 60 LEU H 1 107 LEU H 4.950 . 4.950 4.564 4.427 4.743 . 0 0 "[ . 1 . 2]" 1
879 1 60 LEU H 1 107 LEU HB2 5.500 . 5.500 5.102 4.940 5.300 . 0 0 "[ . 1 . 2]" 1
880 1 60 LEU HA 1 60 LEU MD1 4.170 . 4.170 2.326 2.238 2.388 . 0 0 "[ . 1 . 2]" 1
881 1 60 LEU HA 1 60 LEU QD 3.170 . 3.170 2.310 2.225 2.370 . 0 0 "[ . 1 . 2]" 1
882 1 60 LEU HA 1 60 LEU MD2 4.170 . 4.170 3.960 3.920 3.988 . 0 0 "[ . 1 . 2]" 1
883 1 60 LEU HA 1 60 LEU HG 4.140 . 4.140 3.121 3.055 3.188 . 0 0 "[ . 1 . 2]" 1
884 1 60 LEU HA 1 61 SER H 2.800 . 2.800 2.129 2.075 2.155 . 0 0 "[ . 1 . 2]" 1
885 1 60 LEU HA 1 61 SER HA 4.640 . 4.640 4.376 4.342 4.408 . 0 0 "[ . 1 . 2]" 1
886 1 60 LEU HA 1 61 SER HB2 5.390 . 5.390 4.207 4.027 5.030 . 0 0 "[ . 1 . 2]" 1
887 1 60 LEU HA 1 61 SER QB 4.590 . 4.590 4.071 3.910 4.628 0.038 17 0 "[ . 1 . 2]" 1
888 1 60 LEU HA 1 61 SER HB3 5.390 . 5.390 5.468 5.292 5.564 0.174 5 0 "[ . 1 . 2]" 1
889 1 60 LEU HA 1 106 LYS QE 5.350 . 5.350 4.379 3.837 5.364 0.014 4 0 "[ . 1 . 2]" 1
890 1 60 LEU HA 1 107 LEU HA 5.310 . 5.310 4.616 4.480 4.771 . 0 0 "[ . 1 . 2]" 1
891 1 60 LEU HA 1 107 LEU HB2 4.180 . 4.180 2.432 2.277 2.647 . 0 0 "[ . 1 . 2]" 1
892 1 60 LEU HA 1 107 LEU HB3 4.210 . 4.210 3.927 3.607 4.161 . 0 0 "[ . 1 . 2]" 1
893 1 60 LEU HA 1 107 LEU QD 4.550 . 4.550 3.709 2.923 4.053 . 0 0 "[ . 1 . 2]" 1
894 1 60 LEU QB 1 61 SER H 3.840 . 3.840 3.639 3.540 3.739 . 0 0 "[ . 1 . 2]" 1
895 1 60 LEU QB 1 107 LEU HB2 5.340 . 5.340 3.112 2.762 3.468 . 0 0 "[ . 1 . 2]" 1
896 1 60 LEU QB 1 107 LEU QD 4.700 . 4.700 3.121 2.705 3.526 . 0 0 "[ . 1 . 2]" 1
897 1 60 LEU HB2 1 61 SER H 4.380 . 4.380 4.019 3.903 4.137 . 0 0 "[ . 1 . 2]" 1
898 1 60 LEU HB3 1 61 SER H 4.380 . 4.380 4.160 4.040 4.263 . 0 0 "[ . 1 . 2]" 1
899 1 60 LEU QD 1 61 SER H 3.220 . 3.220 2.243 2.079 2.436 . 0 0 "[ . 1 . 2]" 1
900 1 60 LEU QD 1 61 SER HA 4.360 . 4.360 4.104 4.003 4.222 . 0 0 "[ . 1 . 2]" 1
901 1 60 LEU QD 1 61 SER QB 4.850 . 4.850 4.031 3.891 4.164 . 0 0 "[ . 1 . 2]" 1
902 1 60 LEU QD 1 62 TYR H 4.090 . 4.090 3.715 3.628 3.832 . 0 0 "[ . 1 . 2]" 1
903 1 60 LEU QD 1 62 TYR HA 3.850 . 3.850 3.670 3.535 3.811 . 0 0 "[ . 1 . 2]" 1
904 1 60 LEU QD 1 62 TYR QB 3.700 . 3.700 2.796 2.618 3.013 . 0 0 "[ . 1 . 2]" 1
905 1 60 LEU QD 1 62 TYR HD1 3.340 . 3.340 2.770 2.558 2.990 . 0 0 "[ . 1 . 2]" 1
906 1 60 LEU QD 1 62 TYR HE1 4.770 . 4.770 4.185 3.955 4.482 . 0 0 "[ . 1 . 2]" 1
907 1 60 LEU QD 1 63 ASN H 5.440 . 5.440 5.176 5.036 5.296 . 0 0 "[ . 1 . 2]" 1
908 1 60 LEU QD 1 107 LEU HA 4.980 . 4.980 4.198 4.084 4.374 . 0 0 "[ . 1 . 2]" 1
909 1 60 LEU QD 1 107 LEU HB2 3.570 . 3.570 2.119 1.945 2.320 . 0 0 "[ . 1 . 2]" 1
910 1 60 LEU QD 1 107 LEU HB3 3.300 . 3.300 2.575 2.235 2.815 . 0 0 "[ . 1 . 2]" 1
911 1 60 LEU QD 1 108 LEU HA 4.330 . 4.330 4.006 3.586 4.337 0.007 13 0 "[ . 1 . 2]" 1
912 1 60 LEU QD 1 109 VAL H 4.310 . 4.310 3.903 3.651 4.105 . 0 0 "[ . 1 . 2]" 1
913 1 60 LEU QD 1 109 VAL MG1 4.810 . 4.810 4.055 3.873 4.390 . 0 0 "[ . 1 . 2]" 1
914 1 60 LEU MD1 1 62 TYR H 5.180 . 5.180 4.246 4.059 4.427 . 0 0 "[ . 1 . 2]" 1
915 1 60 LEU MD1 1 62 TYR HA 4.420 . 4.420 3.915 3.713 4.137 . 0 0 "[ . 1 . 2]" 1
916 1 60 LEU MD1 1 62 TYR HB2 5.500 . 5.500 3.779 3.503 4.120 . 0 0 "[ . 1 . 2]" 1
917 1 60 LEU MD1 1 62 TYR HB3 5.500 . 5.500 5.211 4.968 5.523 0.023 8 0 "[ . 1 . 2]" 1
918 1 60 LEU MD1 1 62 TYR HD1 3.880 . 3.880 3.140 2.876 3.511 . 0 0 "[ . 1 . 2]" 1
919 1 60 LEU MD2 1 62 TYR H 5.180 . 5.180 4.109 3.944 4.311 . 0 0 "[ . 1 . 2]" 1
920 1 60 LEU MD2 1 62 TYR HA 4.420 . 4.420 4.442 4.383 4.488 0.068 20 0 "[ . 1 . 2]" 1
921 1 60 LEU MD2 1 62 TYR HB2 5.500 . 5.500 2.940 2.752 3.176 . 0 0 "[ . 1 . 2]" 1
922 1 60 LEU MD2 1 62 TYR HB3 5.500 . 5.500 4.363 4.131 4.649 . 0 0 "[ . 1 . 2]" 1
923 1 60 LEU MD2 1 62 TYR HD1 3.880 . 3.880 3.090 2.866 3.368 . 0 0 "[ . 1 . 2]" 1
924 1 60 LEU HG 1 61 SER H 4.280 . 4.280 2.836 2.526 3.133 . 0 0 "[ . 1 . 2]" 1
925 1 60 LEU HG 1 62 TYR H 3.940 . 3.940 3.162 3.075 3.284 . 0 0 "[ . 1 . 2]" 1
926 1 60 LEU HG 1 62 TYR HD1 4.440 . 4.440 4.036 3.761 4.389 . 0 0 "[ . 1 . 2]" 1
927 1 61 SER H 1 61 SER HB2 3.680 . 3.680 2.469 2.275 3.010 . 0 0 "[ . 1 . 2]" 1
928 1 61 SER H 1 61 SER HB3 3.680 . 3.680 3.537 3.293 3.684 0.004 17 0 "[ . 1 . 2]" 1
929 1 61 SER H 1 62 TYR H 4.300 . 4.300 3.926 3.850 3.991 . 0 0 "[ . 1 . 2]" 1
930 1 61 SER H 1 106 LYS QD 5.270 . 5.270 4.889 3.796 5.187 . 0 0 "[ . 1 . 2]" 1
931 1 61 SER H 1 107 LEU H 4.160 . 4.160 3.880 3.700 4.167 0.007 19 0 "[ . 1 . 2]" 1
932 1 61 SER H 1 107 LEU HB2 4.470 . 4.470 3.487 3.221 3.965 . 0 0 "[ . 1 . 2]" 1
933 1 61 SER H 1 107 LEU HB3 4.290 . 4.290 4.251 3.996 4.391 0.101 14 0 "[ . 1 . 2]" 1
934 1 61 SER H 1 108 LEU HA 3.790 . 3.790 3.128 2.762 3.439 . 0 0 "[ . 1 . 2]" 1
935 1 61 SER H 1 108 LEU MD1 5.380 . 5.380 4.583 4.005 5.473 0.093 14 0 "[ . 1 . 2]" 1
936 1 61 SER H 1 108 LEU QD 4.590 . 4.590 3.780 2.835 4.434 . 0 0 "[ . 1 . 2]" 1
937 1 61 SER H 1 108 LEU MD2 5.380 . 5.380 4.124 2.845 4.946 . 0 0 "[ . 1 . 2]" 1
938 1 61 SER H 1 109 VAL H 4.790 . 4.790 3.762 3.636 3.884 . 0 0 "[ . 1 . 2]" 1
939 1 61 SER H 1 109 VAL MG2 4.480 . 4.480 3.427 3.176 3.654 . 0 0 "[ . 1 . 2]" 1
940 1 61 SER HA 1 62 TYR H 2.830 . 2.830 2.199 2.174 2.243 . 0 0 "[ . 1 . 2]" 1
941 1 61 SER HA 1 106 LYS QE 5.340 . 5.340 3.787 3.074 5.054 . 0 0 "[ . 1 . 2]" 1
942 1 61 SER HA 1 108 LEU QD 4.620 . 4.620 4.367 4.113 4.684 0.064 9 0 "[ . 1 . 2]" 1
943 1 61 SER QB 1 62 TYR H 4.120 . 4.120 3.756 3.685 3.840 . 0 0 "[ . 1 . 2]" 1
944 1 61 SER QB 1 63 ASN QD 4.230 . 4.230 2.762 2.153 3.929 . 0 0 "[ . 1 . 2]" 1
945 1 61 SER QB 1 106 LYS QD 3.780 . 3.780 3.442 2.104 3.816 0.036 20 0 "[ . 1 . 2]" 1
946 1 61 SER QB 1 106 LYS QE 3.700 . 3.700 3.006 2.149 3.759 0.059 4 0 "[ . 1 . 2]" 1
947 1 61 SER QB 1 106 LYS HG2 4.380 . 4.380 3.253 2.633 3.832 . 0 0 "[ . 1 . 2]" 1
948 1 61 SER QB 1 106 LYS HG3 5.050 . 5.050 4.418 3.787 5.037 . 0 0 "[ . 1 . 2]" 1
949 1 61 SER QB 1 108 LEU HA 3.220 . 3.220 2.304 2.151 2.583 . 0 0 "[ . 1 . 2]" 1
950 1 61 SER QB 1 108 LEU HB2 5.330 . 5.330 4.516 4.180 4.819 . 0 0 "[ . 1 . 2]" 1
951 1 61 SER QB 1 108 LEU HB3 4.640 . 4.640 4.027 3.338 4.564 . 0 0 "[ . 1 . 2]" 1
952 1 61 SER QB 1 108 LEU QD 2.730 . 2.730 2.036 1.730 2.414 . 0 0 "[ . 1 . 2]" 1
953 1 61 SER QB 1 108 LEU HG 4.510 . 4.510 3.440 1.875 4.549 0.039 17 0 "[ . 1 . 2]" 1
954 1 61 SER QB 1 109 VAL H 4.040 . 4.040 3.118 2.550 3.440 . 0 0 "[ . 1 . 2]" 1
955 1 61 SER QB 1 109 VAL MG2 5.340 . 5.340 4.067 3.751 4.276 . 0 0 "[ . 1 . 2]" 1
956 1 61 SER HB2 1 62 TYR H 4.750 . 4.750 4.560 4.212 4.657 . 0 0 "[ . 1 . 2]" 1
957 1 61 SER HB2 1 106 LYS QD 4.660 . 4.660 3.600 2.122 4.664 0.004 17 0 "[ . 1 . 2]" 1
958 1 61 SER HB2 1 108 LEU HA 3.770 . 3.770 2.397 2.174 2.716 . 0 0 "[ . 1 . 2]" 1
959 1 61 SER HB2 1 108 LEU HB3 5.500 . 5.500 4.407 3.768 4.950 . 0 0 "[ . 1 . 2]" 1
960 1 61 SER HB2 1 108 LEU MD1 4.270 . 4.270 2.859 1.902 3.942 . 0 0 "[ . 1 . 2]" 1
961 1 61 SER HB2 1 108 LEU MD2 4.270 . 4.270 2.706 1.756 3.404 . 0 0 "[ . 1 . 2]" 1
962 1 61 SER HB3 1 62 TYR H 4.750 . 4.750 4.001 3.920 4.114 . 0 0 "[ . 1 . 2]" 1
963 1 61 SER HB3 1 106 LYS QD 4.660 . 4.660 4.552 3.458 4.812 0.152 14 0 "[ . 1 . 2]" 1
964 1 61 SER HB3 1 108 LEU HA 3.770 . 3.770 3.261 2.505 3.755 . 0 0 "[ . 1 . 2]" 1
965 1 61 SER HB3 1 108 LEU HB3 5.500 . 5.500 4.795 3.726 5.568 0.068 17 0 "[ . 1 . 2]" 1
966 1 61 SER HB3 1 108 LEU MD1 4.270 . 4.270 3.396 2.297 4.370 0.100 9 0 "[ . 1 . 2]" 1
967 1 61 SER HB3 1 108 LEU MD2 4.270 . 4.270 3.177 2.372 4.089 . 0 0 "[ . 1 . 2]" 1
968 1 62 TYR H 1 62 TYR HB2 3.580 . 3.580 2.462 2.346 2.532 . 0 0 "[ . 1 . 2]" 1
969 1 62 TYR H 1 62 TYR QB 3.110 . 3.110 2.289 2.234 2.341 . 0 0 "[ . 1 . 2]" 1
970 1 62 TYR H 1 62 TYR HB3 3.580 . 3.580 2.727 2.636 2.810 . 0 0 "[ . 1 . 2]" 1
971 1 62 TYR H 1 62 TYR HD1 4.590 . 4.590 4.515 4.330 4.614 0.024 14 0 "[ . 1 . 2]" 1
972 1 62 TYR H 1 63 ASN H 4.670 . 4.670 4.179 4.053 4.306 . 0 0 "[ . 1 . 2]" 1
973 1 62 TYR HA 1 62 TYR HD1 3.870 . 3.870 2.705 2.510 2.891 . 0 0 "[ . 1 . 2]" 1
974 1 62 TYR HA 1 63 ASN H 2.940 . 2.940 2.213 2.185 2.237 . 0 0 "[ . 1 . 2]" 1
975 1 62 TYR HA 1 64 LEU H 4.340 . 4.340 3.480 3.194 3.848 . 0 0 "[ . 1 . 2]" 1
976 1 62 TYR HA 1 64 LEU QD 4.980 . 4.980 4.196 2.831 4.332 . 0 0 "[ . 1 . 2]" 1
977 1 62 TYR HA 1 109 VAL H 4.020 . 4.020 3.533 3.278 3.721 . 0 0 "[ . 1 . 2]" 1
978 1 62 TYR HA 1 109 VAL HB 3.710 . 3.710 2.225 1.946 2.498 . 0 0 "[ . 1 . 2]" 1
979 1 62 TYR HA 1 109 VAL MG1 4.430 . 4.430 3.604 3.260 3.986 . 0 0 "[ . 1 . 2]" 1
980 1 62 TYR HA 1 109 VAL MG2 3.690 . 3.690 2.609 2.306 2.839 . 0 0 "[ . 1 . 2]" 1
981 1 62 TYR QB 1 62 TYR HD1 3.290 . 3.290 2.534 2.441 2.610 . 0 0 "[ . 1 . 2]" 1
982 1 62 TYR QB 1 62 TYR HD2 3.230 . 3.230 2.303 2.273 2.353 . 0 0 "[ . 1 . 2]" 1
983 1 62 TYR QB 1 63 ASN H 4.140 . 4.140 3.957 3.902 3.984 . 0 0 "[ . 1 . 2]" 1
984 1 62 TYR HB2 1 63 ASN H 4.710 . 4.710 4.608 4.576 4.626 . 0 0 "[ . 1 . 2]" 1
985 1 62 TYR HB3 1 63 ASN H 4.710 . 4.710 4.310 4.231 4.359 . 0 0 "[ . 1 . 2]" 1
986 1 62 TYR HD1 1 63 ASN H 5.090 . 5.090 4.660 4.387 4.883 . 0 0 "[ . 1 . 2]" 1
987 1 62 TYR HD1 1 64 LEU MD1 5.500 . 5.500 4.152 3.913 5.595 0.095 19 0 "[ . 1 . 2]" 1
988 1 62 TYR HD1 1 64 LEU QD 4.670 . 4.670 3.921 2.889 4.111 . 0 0 "[ . 1 . 2]" 1
989 1 62 TYR HD1 1 64 LEU MD2 5.500 . 5.500 5.389 2.899 5.578 0.078 3 0 "[ . 1 . 2]" 1
990 1 62 TYR HD1 1 109 VAL HB 4.190 . 4.190 3.443 3.253 3.740 . 0 0 "[ . 1 . 2]" 1
991 1 62 TYR HD1 1 109 VAL MG1 4.240 . 4.240 3.226 2.871 3.559 . 0 0 "[ . 1 . 2]" 1
992 1 62 TYR HD1 1 109 VAL MG2 3.800 . 3.800 2.218 1.994 2.371 . 0 0 "[ . 1 . 2]" 1
993 1 62 TYR HD2 1 64 LEU H 3.640 . 3.640 3.121 2.949 3.411 . 0 0 "[ . 1 . 2]" 1
994 1 62 TYR HD2 1 64 LEU MD1 5.500 . 5.500 4.704 4.376 5.546 0.046 19 0 "[ . 1 . 2]" 1
995 1 62 TYR HD2 1 64 LEU QD 4.520 . 4.520 4.386 3.617 4.516 . 0 0 "[ . 1 . 2]" 1
996 1 62 TYR HD2 1 64 LEU MD2 5.500 . 5.500 5.435 3.665 5.564 0.064 13 0 "[ . 1 . 2]" 1
997 1 62 TYR HD2 1 67 ASP HA 5.350 . 5.350 5.008 4.520 5.351 0.001 12 0 "[ . 1 . 2]" 1
998 1 62 TYR HE1 1 64 LEU MD1 5.500 . 5.500 2.913 2.677 5.150 . 0 0 "[ . 1 . 2]" 1
999 1 62 TYR HE1 1 64 LEU QD 4.130 . 4.130 2.785 2.669 3.011 . 0 0 "[ . 1 . 2]" 1
1000 1 62 TYR HE1 1 64 LEU MD2 5.500 . 5.500 5.038 2.835 5.254 . 0 0 "[ . 1 . 2]" 1
1001 1 62 TYR HE1 1 98 VAL MG1 5.500 . 5.500 4.667 4.463 4.912 . 0 0 "[ . 1 . 2]" 1
1002 1 62 TYR HE1 1 98 VAL MG2 5.500 . 5.500 5.521 5.421 5.571 0.071 16 0 "[ . 1 . 2]" 1
1003 1 62 TYR HE1 1 109 VAL MG1 3.790 . 3.790 3.009 2.754 3.242 . 0 0 "[ . 1 . 2]" 1
1004 1 62 TYR HE1 1 109 VAL MG2 3.560 . 3.560 3.373 2.932 3.596 0.036 13 0 "[ . 1 . 2]" 1
1005 1 62 TYR HE2 1 64 LEU H 4.500 . 4.500 4.069 3.792 4.314 . 0 0 "[ . 1 . 2]" 1
1006 1 62 TYR HE2 1 64 LEU HA 5.500 . 5.500 5.251 5.067 5.527 0.027 3 0 "[ . 1 . 2]" 1
1007 1 62 TYR HE2 1 64 LEU HB2 3.730 . 3.730 2.461 2.354 2.576 . 0 0 "[ . 1 . 2]" 1
1008 1 62 TYR HE2 1 64 LEU HB3 4.230 . 4.230 3.757 3.545 3.898 . 0 0 "[ . 1 . 2]" 1
1009 1 62 TYR HE2 1 64 LEU MD1 5.500 . 5.500 3.616 3.217 5.116 . 0 0 "[ . 1 . 2]" 1
1010 1 62 TYR HE2 1 64 LEU QD 4.220 . 4.220 3.486 3.187 3.616 . 0 0 "[ . 1 . 2]" 1
1011 1 62 TYR HE2 1 64 LEU MD2 5.500 . 5.500 5.111 3.672 5.231 . 0 0 "[ . 1 . 2]" 1
1012 1 62 TYR HE2 1 66 SER H 5.270 . 5.270 4.075 3.645 4.591 . 0 0 "[ . 1 . 2]" 1
1013 1 62 TYR HE2 1 67 ASP HA 5.160 . 5.160 2.696 2.087 3.042 . 0 0 "[ . 1 . 2]" 1
1014 1 63 ASN H 1 63 ASN HB2 3.980 . 3.980 2.438 2.344 2.545 . 0 0 "[ . 1 . 2]" 1
1015 1 63 ASN H 1 63 ASN QB 3.160 . 3.160 2.404 2.315 2.503 . 0 0 "[ . 1 . 2]" 1
1016 1 63 ASN H 1 63 ASN HB3 3.980 . 3.980 3.649 3.597 3.709 . 0 0 "[ . 1 . 2]" 1
1017 1 63 ASN H 1 63 ASN HD21 5.010 . 5.010 3.392 2.556 4.642 . 0 0 "[ . 1 . 2]" 1
1018 1 63 ASN H 1 63 ASN QD 4.160 . 4.160 3.252 2.518 4.249 0.089 17 0 "[ . 1 . 2]" 1
1019 1 63 ASN H 1 63 ASN HD22 5.010 . 5.010 4.373 3.800 4.927 . 0 0 "[ . 1 . 2]" 1
1020 1 63 ASN H 1 64 LEU H 3.430 . 3.430 2.729 2.410 3.073 . 0 0 "[ . 1 . 2]" 1
1021 1 63 ASN H 1 64 LEU HA 4.750 . 4.750 4.746 4.660 4.807 0.057 1 0 "[ . 1 . 2]" 1
1022 1 63 ASN H 1 64 LEU MD1 5.500 . 5.500 4.805 3.944 5.046 . 0 0 "[ . 1 . 2]" 1
1023 1 63 ASN H 1 64 LEU QD 4.700 . 4.700 3.629 2.309 3.817 . 0 0 "[ . 1 . 2]" 1
1024 1 63 ASN H 1 64 LEU MD2 5.500 . 5.500 3.761 2.325 3.956 . 0 0 "[ . 1 . 2]" 1
1025 1 63 ASN H 1 64 LEU HG 5.420 . 5.420 3.519 3.230 5.359 . 0 0 "[ . 1 . 2]" 1
1026 1 63 ASN H 1 109 VAL H 3.910 . 3.910 3.505 3.123 3.829 . 0 0 "[ . 1 . 2]" 1
1027 1 63 ASN H 1 109 VAL HB 3.470 . 3.470 2.417 2.249 2.781 . 0 0 "[ . 1 . 2]" 1
1028 1 63 ASN H 1 109 VAL MG1 4.150 . 4.150 3.750 3.292 4.179 0.029 19 0 "[ . 1 . 2]" 1
1029 1 63 ASN H 1 109 VAL MG2 4.500 . 4.500 3.727 3.433 3.990 . 0 0 "[ . 1 . 2]" 1
1030 1 63 ASN H 1 110 GLN HA 4.340 . 4.340 4.088 3.722 4.378 0.038 6 0 "[ . 1 . 2]" 1
1031 1 63 ASN HA 1 64 LEU H 3.260 . 3.260 2.949 2.643 3.242 . 0 0 "[ . 1 . 2]" 1
1032 1 63 ASN HA 1 64 LEU QD 5.440 . 5.440 4.630 3.963 4.914 . 0 0 "[ . 1 . 2]" 1
1033 1 63 ASN QB 1 64 LEU H 4.060 . 4.060 3.732 3.415 3.884 . 0 0 "[ . 1 . 2]" 1
1034 1 63 ASN QB 1 110 GLN HA 4.080 . 4.080 2.655 2.240 3.241 . 0 0 "[ . 1 . 2]" 1
1035 1 63 ASN QB 1 110 GLN QG 4.860 . 4.860 3.412 2.506 4.812 . 0 0 "[ . 1 . 2]" 1
1036 1 63 ASN HB2 1 64 LEU H 4.620 . 4.620 4.049 3.601 4.337 . 0 0 "[ . 1 . 2]" 1
1037 1 63 ASN HB2 1 110 GLN HA 4.640 . 4.640 2.710 2.260 3.349 . 0 0 "[ . 1 . 2]" 1
1038 1 63 ASN HB3 1 64 LEU H 4.620 . 4.620 4.382 4.242 4.462 . 0 0 "[ . 1 . 2]" 1
1039 1 63 ASN HB3 1 110 GLN HA 4.640 . 4.640 3.848 3.384 4.315 . 0 0 "[ . 1 . 2]" 1
1040 1 63 ASN QD 1 108 LEU QD 3.860 . 3.860 2.805 2.019 3.714 . 0 0 "[ . 1 . 2]" 1
1041 1 64 LEU H 1 64 LEU HB2 3.350 . 3.350 2.520 2.436 2.604 . 0 0 "[ . 1 . 2]" 1
1042 1 64 LEU H 1 64 LEU HB3 3.860 . 3.860 3.657 3.600 3.715 . 0 0 "[ . 1 . 2]" 1
1043 1 64 LEU H 1 64 LEU MD1 4.710 . 4.710 3.902 2.998 4.115 . 0 0 "[ . 1 . 2]" 1
1044 1 64 LEU H 1 64 LEU QD 3.980 . 3.980 3.061 1.710 3.302 . 0 0 "[ . 1 . 2]" 1
1045 1 64 LEU H 1 64 LEU MD2 4.710 . 4.710 3.207 1.720 3.477 . 0 0 "[ . 1 . 2]" 1
1046 1 64 LEU H 1 64 LEU HG 3.710 . 3.710 2.692 2.340 3.837 0.127 19 0 "[ . 1 . 2]" 1
1047 1 64 LEU H 1 65 PRO QD 5.350 . 5.350 4.382 4.346 4.419 . 0 0 "[ . 1 . 2]" 1
1048 1 64 LEU H 1 109 VAL HB 4.690 . 4.690 3.973 3.663 4.454 . 0 0 "[ . 1 . 2]" 1
1049 1 64 LEU H 1 109 VAL MG1 4.600 . 4.600 4.232 3.904 4.593 . 0 0 "[ . 1 . 2]" 1
1050 1 64 LEU H 1 111 PRO QD 5.500 . 5.500 4.565 4.110 5.027 . 0 0 "[ . 1 . 2]" 1
1051 1 64 LEU HA 1 64 LEU MD1 4.000 . 4.000 3.711 2.067 3.844 . 0 0 "[ . 1 . 2]" 1
1052 1 64 LEU HA 1 64 LEU QD 3.050 . 3.050 2.035 1.975 2.113 . 0 0 "[ . 1 . 2]" 1
1053 1 64 LEU HA 1 64 LEU MD2 4.000 . 4.000 2.100 1.982 3.187 . 0 0 "[ . 1 . 2]" 1
1054 1 64 LEU HA 1 65 PRO HD2 4.090 . 4.090 2.202 2.101 2.447 . 0 0 "[ . 1 . 2]" 1
1055 1 64 LEU HA 1 65 PRO QD 3.570 . 3.570 2.045 1.974 2.143 . 0 0 "[ . 1 . 2]" 1
1056 1 64 LEU HA 1 65 PRO HD3 4.090 . 4.090 2.441 2.326 2.515 . 0 0 "[ . 1 . 2]" 1
1057 1 64 LEU HA 1 65 PRO HG2 4.970 . 4.970 4.368 4.277 4.551 . 0 0 "[ . 1 . 2]" 1
1058 1 64 LEU HA 1 65 PRO HG3 4.640 . 4.640 4.483 4.409 4.583 . 0 0 "[ . 1 . 2]" 1
1059 1 64 LEU HA 1 111 PRO QD 4.510 . 4.510 3.252 2.792 3.864 . 0 0 "[ . 1 . 2]" 1
1060 1 64 LEU HA 1 111 PRO HG3 5.480 . 5.480 3.415 2.871 4.493 . 0 0 "[ . 1 . 2]" 1
1061 1 64 LEU HB2 1 66 SER H 4.360 . 4.360 3.645 3.429 3.990 . 0 0 "[ . 1 . 2]" 1
1062 1 64 LEU HB3 1 64 LEU MD1 3.670 . 3.670 2.325 2.282 2.483 . 0 0 "[ . 1 . 2]" 1
1063 1 64 LEU HB3 1 64 LEU MD2 3.670 . 3.670 2.490 2.382 3.172 . 0 0 "[ . 1 . 2]" 1
1064 1 64 LEU HB3 1 65 PRO HD2 5.190 . 5.190 2.297 2.072 2.550 . 0 0 "[ . 1 . 2]" 1
1065 1 64 LEU HB3 1 65 PRO QD 4.360 . 4.360 2.279 2.060 2.522 . 0 0 "[ . 1 . 2]" 1
1066 1 64 LEU HB3 1 65 PRO HD3 5.190 . 5.190 3.797 3.492 3.972 . 0 0 "[ . 1 . 2]" 1
1067 1 64 LEU HB3 1 66 SER H 3.370 . 3.370 2.913 2.669 3.313 . 0 0 "[ . 1 . 2]" 1
1068 1 64 LEU QD 1 65 PRO QD 3.370 . 3.370 2.624 2.413 2.851 . 0 0 "[ . 1 . 2]" 1
1069 1 64 LEU QD 1 67 ASP HA 5.190 . 5.190 3.963 3.431 4.909 . 0 0 "[ . 1 . 2]" 1
1070 1 64 LEU QD 1 68 TYR HE2 3.580 . 3.580 2.031 1.829 2.483 . 0 0 "[ . 1 . 2]" 1
1071 1 64 LEU QD 1 98 VAL HA 4.070 . 4.070 3.032 2.676 3.283 . 0 0 "[ . 1 . 2]" 1
1072 1 64 LEU QD 1 98 VAL QG 2.760 . 2.760 1.831 1.681 2.302 . 0 0 "[ . 1 . 2]" 1
1073 1 64 LEU QD 1 99 SER H 4.370 . 4.370 3.474 3.113 3.716 . 0 0 "[ . 1 . 2]" 1
1074 1 64 LEU QD 1 109 VAL HA 5.440 . 5.440 4.088 3.774 4.236 . 0 0 "[ . 1 . 2]" 1
1075 1 64 LEU QD 1 109 VAL HB 4.960 . 4.960 3.287 2.052 3.622 . 0 0 "[ . 1 . 2]" 1
1076 1 64 LEU QD 1 109 VAL MG1 2.690 . 2.690 1.856 1.745 1.957 . 0 0 "[ . 1 . 2]" 1
1077 1 64 LEU QD 1 110 GLN H 4.500 . 4.500 3.652 3.420 3.891 . 0 0 "[ . 1 . 2]" 1
1078 1 64 LEU QD 1 110 GLN HA 4.000 . 4.000 3.066 2.697 3.289 . 0 0 "[ . 1 . 2]" 1
1079 1 64 LEU QD 1 110 GLN QG 4.890 . 4.890 4.671 4.442 4.947 0.057 1 0 "[ . 1 . 2]" 1
1080 1 64 LEU QD 1 111 PRO HA 3.340 . 3.340 2.916 2.668 3.185 . 0 0 "[ . 1 . 2]" 1
1081 1 64 LEU QD 1 111 PRO HB2 4.420 . 4.420 3.835 3.681 4.214 . 0 0 "[ . 1 . 2]" 1
1082 1 64 LEU QD 1 111 PRO HB3 3.640 . 3.640 2.436 2.252 2.853 . 0 0 "[ . 1 . 2]" 1
1083 1 64 LEU QD 1 111 PRO QD 3.270 . 3.270 2.165 1.940 2.352 . 0 0 "[ . 1 . 2]" 1
1084 1 64 LEU QD 1 111 PRO HG2 4.520 . 4.520 4.147 3.954 4.437 . 0 0 "[ . 1 . 2]" 1
1085 1 64 LEU QD 1 111 PRO HG3 3.870 . 3.870 3.182 2.842 3.544 . 0 0 "[ . 1 . 2]" 1
1086 1 64 LEU MD1 1 65 PRO HD2 5.420 . 5.420 3.828 2.866 4.126 . 0 0 "[ . 1 . 2]" 1
1087 1 64 LEU MD1 1 65 PRO HD3 5.420 . 5.420 5.125 3.633 5.391 . 0 0 "[ . 1 . 2]" 1
1088 1 64 LEU MD1 1 66 SER H 5.500 . 5.500 4.444 4.231 4.748 . 0 0 "[ . 1 . 2]" 1
1089 1 64 LEU MD1 1 68 TYR HE2 4.230 . 4.230 2.066 1.868 2.523 . 0 0 "[ . 1 . 2]" 1
1090 1 64 LEU MD1 1 98 VAL HA 5.360 . 5.360 3.954 3.268 4.320 . 0 0 "[ . 1 . 2]" 1
1091 1 64 LEU MD1 1 98 VAL MG1 3.710 . 3.710 2.168 2.029 2.844 . 0 0 "[ . 1 . 2]" 1
1092 1 64 LEU MD1 1 98 VAL MG2 3.710 . 3.710 2.242 2.065 2.617 . 0 0 "[ . 1 . 2]" 1
1093 1 64 LEU MD1 1 109 VAL MG1 3.340 . 3.340 2.069 1.885 2.988 . 0 0 "[ . 1 . 2]" 1
1094 1 64 LEU MD2 1 65 PRO HD2 5.420 . 5.420 2.858 2.520 4.667 . 0 0 "[ . 1 . 2]" 1
1095 1 64 LEU MD2 1 65 PRO HD3 5.420 . 5.420 3.647 3.304 5.198 . 0 0 "[ . 1 . 2]" 1
1096 1 64 LEU MD2 1 66 SER H 5.500 . 5.500 4.748 4.492 5.234 . 0 0 "[ . 1 . 2]" 1
1097 1 64 LEU MD2 1 68 TYR HE2 4.230 . 4.230 3.049 2.604 3.696 . 0 0 "[ . 1 . 2]" 1
1098 1 64 LEU MD2 1 98 VAL HA 5.360 . 5.360 3.220 2.736 4.739 . 0 0 "[ . 1 . 2]" 1
1099 1 64 LEU MD2 1 98 VAL MG1 3.710 . 3.710 2.437 2.084 3.004 . 0 0 "[ . 1 . 2]" 1
1100 1 64 LEU MD2 1 98 VAL MG2 3.710 . 3.710 2.611 2.213 3.779 0.069 19 0 "[ . 1 . 2]" 1
1101 1 64 LEU MD2 1 109 VAL MG1 3.340 . 3.340 2.169 1.773 2.316 . 0 0 "[ . 1 . 2]" 1
1102 1 64 LEU HG 1 98 VAL QG 4.790 . 4.790 3.559 2.863 3.775 . 0 0 "[ . 1 . 2]" 1
1103 1 64 LEU HG 1 109 VAL MG1 3.340 . 3.340 2.307 2.010 3.399 0.059 19 0 "[ . 1 . 2]" 1
1104 1 65 PRO HA 1 66 SER HA 4.750 . 4.750 4.557 4.514 4.588 . 0 0 "[ . 1 . 2]" 1
1105 1 65 PRO HB2 1 66 SER HA 4.710 . 4.710 4.563 4.383 4.707 . 0 0 "[ . 1 . 2]" 1
1106 1 65 PRO HB2 1 66 SER QB 4.180 . 4.180 4.043 3.703 4.212 0.032 2 0 "[ . 1 . 2]" 1
1107 1 65 PRO HB3 1 66 SER H 4.420 . 4.420 4.118 3.964 4.212 . 0 0 "[ . 1 . 2]" 1
1108 1 65 PRO QD 1 66 SER H 3.490 . 3.490 2.900 2.634 3.059 . 0 0 "[ . 1 . 2]" 1
1109 1 65 PRO HD2 1 66 SER H 4.190 . 4.190 2.975 2.680 3.154 . 0 0 "[ . 1 . 2]" 1
1110 1 65 PRO HD3 1 66 SER H 4.190 . 4.190 4.023 3.873 4.119 . 0 0 "[ . 1 . 2]" 1
1111 1 65 PRO HG2 1 66 SER H 3.810 . 3.810 2.436 2.212 2.537 . 0 0 "[ . 1 . 2]" 1
1112 1 65 PRO HG2 1 66 SER HA 5.400 . 5.400 5.007 4.879 5.160 . 0 0 "[ . 1 . 2]" 1
1113 1 65 PRO HG2 1 66 SER QB 4.660 . 4.660 3.869 3.553 4.320 . 0 0 "[ . 1 . 2]" 1
1114 1 65 PRO HG3 1 66 SER H 4.000 . 4.000 3.969 3.805 4.058 0.058 1 0 "[ . 1 . 2]" 1
1115 1 66 SER H 1 66 SER QB 3.380 . 3.380 2.875 2.736 3.223 . 0 0 "[ . 1 . 2]" 1
1116 1 66 SER H 1 67 ASP H 4.470 . 4.470 4.390 4.330 4.425 . 0 0 "[ . 1 . 2]" 1
1117 1 66 SER H 1 68 TYR HE1 5.280 . 5.280 4.997 4.335 5.317 0.037 4 0 "[ . 1 . 2]" 1
1118 1 66 SER H 1 68 TYR HE2 5.500 . 5.500 3.813 3.140 4.553 . 0 0 "[ . 1 . 2]" 1
1119 1 66 SER QB 1 67 ASP H 4.140 . 4.140 2.425 2.224 2.972 . 0 0 "[ . 1 . 2]" 1
1120 1 66 SER QB 1 68 TYR HE1 4.180 . 4.180 3.534 2.390 4.214 0.034 20 0 "[ . 1 . 2]" 1
1121 1 67 ASP H 1 68 TYR H 4.800 . 4.800 4.545 4.445 4.597 . 0 0 "[ . 1 . 2]" 1
1122 1 67 ASP HA 1 68 TYR H 3.140 . 3.140 2.207 2.143 2.266 . 0 0 "[ . 1 . 2]" 1
1123 1 67 ASP HA 1 68 TYR HE2 5.210 . 5.210 5.131 4.816 5.262 0.052 4 0 "[ . 1 . 2]" 1
1124 1 67 ASP QB 1 68 TYR H 3.970 . 3.970 3.090 2.744 3.775 . 0 0 "[ . 1 . 2]" 1
1125 1 68 TYR H 1 68 TYR HB2 3.510 . 3.510 2.645 2.502 2.871 . 0 0 "[ . 1 . 2]" 1
1126 1 68 TYR H 1 68 TYR HB3 4.000 . 4.000 3.755 3.681 3.844 . 0 0 "[ . 1 . 2]" 1
1127 1 68 TYR H 1 68 TYR HD2 4.220 . 4.220 3.175 2.710 3.563 . 0 0 "[ . 1 . 2]" 1
1128 1 68 TYR H 1 69 THR H 4.640 . 4.640 4.456 4.381 4.548 . 0 0 "[ . 1 . 2]" 1
1129 1 68 TYR HB2 1 68 TYR HE2 4.820 . 4.820 4.623 4.605 4.649 . 0 0 "[ . 1 . 2]" 1
1130 1 68 TYR HB2 1 69 THR H 4.490 . 4.490 3.901 3.457 4.192 . 0 0 "[ . 1 . 2]" 1
1131 1 68 TYR HB2 1 98 VAL QG 5.440 . 5.440 3.815 3.438 4.306 . 0 0 "[ . 1 . 2]" 1
1132 1 68 TYR HB3 1 68 TYR HE1 4.980 . 4.980 4.785 4.725 4.854 . 0 0 "[ . 1 . 2]" 1
1133 1 68 TYR HB3 1 69 THR H 4.130 . 4.130 2.923 2.414 3.285 . 0 0 "[ . 1 . 2]" 1
1134 1 68 TYR HD2 1 98 VAL QG 5.010 . 5.010 2.740 2.347 3.213 . 0 0 "[ . 1 . 2]" 1
1135 1 68 TYR HE2 1 98 VAL MG1 5.030 . 5.030 4.412 3.918 4.907 . 0 0 "[ . 1 . 2]" 1
1136 1 68 TYR HE2 1 98 VAL QG 3.770 . 3.770 2.816 2.291 3.437 . 0 0 "[ . 1 . 2]" 1
1137 1 68 TYR HE2 1 98 VAL MG2 5.030 . 5.030 2.852 2.305 3.510 . 0 0 "[ . 1 . 2]" 1
1138 1 68 TYR HE2 1 109 VAL MG1 5.310 . 5.310 5.082 4.793 5.325 0.015 7 0 "[ . 1 . 2]" 1
1139 1 69 THR H 1 69 THR MG 3.700 . 3.700 3.220 1.804 3.791 0.091 13 0 "[ . 1 . 2]" 1
1140 1 69 THR HA 1 69 THR MG 3.230 . 3.230 2.248 2.142 3.185 . 0 0 "[ . 1 . 2]" 1
1141 1 69 THR HA 1 70 LEU H 3.420 . 3.420 2.374 2.285 2.584 . 0 0 "[ . 1 . 2]" 1
1142 1 69 THR HA 1 70 LEU MD1 5.170 . 5.170 3.470 3.297 3.749 . 0 0 "[ . 1 . 2]" 1
1143 1 69 THR HA 1 70 LEU QD 4.510 . 4.510 3.214 2.979 3.637 . 0 0 "[ . 1 . 2]" 1
1144 1 69 THR HA 1 70 LEU MD2 5.170 . 5.170 3.938 3.194 4.902 . 0 0 "[ . 1 . 2]" 1
1145 1 70 LEU H 1 70 LEU QB 3.540 . 3.540 2.323 2.033 2.623 . 0 0 "[ . 1 . 2]" 1
1146 1 70 LEU H 1 70 LEU MD1 5.060 . 5.060 2.444 2.163 2.812 . 0 0 "[ . 1 . 2]" 1
1147 1 70 LEU H 1 70 LEU QD 4.350 . 4.350 2.077 1.679 2.410 . 0 0 "[ . 1 . 2]" 1
1148 1 70 LEU H 1 70 LEU MD2 5.060 . 5.060 2.426 1.719 3.279 . 0 0 "[ . 1 . 2]" 1
1149 1 70 LEU H 1 70 LEU HG 3.990 . 3.990 4.088 3.837 4.269 0.279 2 0 "[ . 1 . 2]" 1
1150 1 70 LEU HA 1 70 LEU MD1 3.920 . 3.920 1.966 1.847 2.188 . 0 0 "[ . 1 . 2]" 1
1151 1 70 LEU HA 1 70 LEU QD 2.970 . 2.970 1.957 1.842 2.168 . 0 0 "[ . 1 . 2]" 1
1152 1 70 LEU HA 1 70 LEU MD2 3.920 . 3.920 3.608 3.413 3.778 . 0 0 "[ . 1 . 2]" 1
1153 1 70 LEU HA 1 71 ILE MD 5.350 . 5.350 5.069 4.977 5.162 . 0 0 "[ . 1 . 2]" 1
1154 1 70 LEU HA 1 74 VAL MG1 4.110 . 4.110 3.716 2.443 4.137 0.027 16 0 "[ . 1 . 2]" 1
1155 1 70 LEU HA 1 74 VAL MG2 4.110 . 4.110 2.812 2.352 3.989 . 0 0 "[ . 1 . 2]" 1
1156 1 70 LEU QB 1 74 VAL QG 4.220 . 4.220 2.625 2.144 3.156 . 0 0 "[ . 1 . 2]" 1
1157 1 70 LEU QD 1 71 ILE H 4.310 . 4.310 3.528 3.283 3.786 . 0 0 "[ . 1 . 2]" 1
1158 1 70 LEU QD 1 74 VAL HA 5.440 . 5.440 5.154 4.892 5.509 0.069 14 0 "[ . 1 . 2]" 1
1159 1 70 LEU QD 1 74 VAL HB 4.860 . 4.860 3.329 2.983 4.065 . 0 0 "[ . 1 . 2]" 1
1160 1 70 LEU QD 1 74 VAL QG 2.800 . 2.800 2.145 1.950 2.414 . 0 0 "[ . 1 . 2]" 1
1161 1 70 LEU MD1 1 75 SER H 5.500 . 5.500 5.474 5.215 5.595 0.095 2 0 "[ . 1 . 2]" 1
1162 1 70 LEU MD2 1 75 SER H 5.500 . 5.500 5.486 4.807 5.676 0.176 4 0 "[ . 1 . 2]" 1
1163 1 71 ILE H 1 71 ILE MG 4.540 . 4.540 2.615 2.359 2.953 . 0 0 "[ . 1 . 2]" 1
1164 1 71 ILE H 1 74 VAL QG 4.280 . 4.280 2.493 2.198 2.882 . 0 0 "[ . 1 . 2]" 1
1165 1 71 ILE HB 1 71 ILE MD 3.200 . 3.200 2.380 2.313 2.443 . 0 0 "[ . 1 . 2]" 1
1166 1 71 ILE HB 1 72 GLY H 3.560 . 3.560 3.495 1.723 3.634 0.074 7 0 "[ . 1 . 2]" 1
1167 1 71 ILE HB 1 73 PRO HD2 4.960 . 4.960 2.810 2.574 3.028 . 0 0 "[ . 1 . 2]" 1
1168 1 71 ILE HB 1 73 PRO HD3 4.960 . 4.960 4.131 3.360 4.430 . 0 0 "[ . 1 . 2]" 1
1169 1 71 ILE HB 1 74 VAL QG 4.870 . 4.870 4.207 3.948 4.587 . 0 0 "[ . 1 . 2]" 1
1170 1 71 ILE MD 1 71 ILE MG 2.880 . 2.880 1.985 1.870 2.077 . 0 0 "[ . 1 . 2]" 1
1171 1 71 ILE MD 1 73 PRO HD2 4.170 . 4.170 2.812 2.390 3.064 . 0 0 "[ . 1 . 2]" 1
1172 1 71 ILE MD 1 73 PRO QD 3.350 . 3.350 2.755 2.358 2.992 . 0 0 "[ . 1 . 2]" 1
1173 1 71 ILE MD 1 73 PRO HD3 4.170 . 4.170 3.954 3.602 4.185 0.015 16 0 "[ . 1 . 2]" 1
1174 1 71 ILE MD 1 74 VAL H 4.480 . 4.480 4.024 3.077 4.489 0.009 18 0 "[ . 1 . 2]" 1
1175 1 71 ILE MD 1 74 VAL HB 5.500 . 5.500 5.059 2.619 5.552 0.052 4 0 "[ . 1 . 2]" 1
1176 1 71 ILE MD 1 74 VAL QG 3.200 . 3.200 2.889 2.710 3.311 0.111 2 0 "[ . 1 . 2]" 1
1177 1 71 ILE MD 1 93 TYR HA 5.500 . 5.500 3.477 2.797 3.898 . 0 0 "[ . 1 . 2]" 1
1178 1 71 ILE MD 1 93 TYR HD1 4.850 . 4.850 2.753 2.358 3.367 . 0 0 "[ . 1 . 2]" 1
1179 1 71 ILE MD 1 93 TYR HE1 4.460 . 4.460 2.542 2.092 3.748 . 0 0 "[ . 1 . 2]" 1
1180 1 71 ILE QG 1 73 PRO QD 4.350 . 4.350 2.280 2.071 3.039 . 0 0 "[ . 1 . 2]" 1
1181 1 71 ILE QG 1 74 VAL H 4.450 . 4.450 3.018 2.081 3.412 . 0 0 "[ . 1 . 2]" 1
1182 1 71 ILE MG 1 73 PRO QD 4.970 . 4.970 4.133 3.957 4.292 . 0 0 "[ . 1 . 2]" 1
1183 1 72 GLY H 1 73 PRO HD2 4.370 . 4.370 2.708 2.035 2.956 . 0 0 "[ . 1 . 2]" 1
1184 1 72 GLY H 1 73 PRO QD 3.840 . 3.840 2.670 2.020 2.911 . 0 0 "[ . 1 . 2]" 1
1185 1 72 GLY H 1 73 PRO HD3 4.370 . 4.370 4.096 3.426 4.367 . 0 0 "[ . 1 . 2]" 1
1186 1 72 GLY QA 1 75 SER H 4.410 . 4.410 4.070 3.761 4.434 0.024 1 0 "[ . 1 . 2]" 1
1187 1 72 GLY HA2 1 74 VAL H 4.810 . 4.810 3.890 3.731 4.097 . 0 0 "[ . 1 . 2]" 1
1188 1 72 GLY HA3 1 74 VAL H 4.810 . 4.810 4.094 4.009 4.295 . 0 0 "[ . 1 . 2]" 1
1189 1 73 PRO HA 1 74 VAL QG 5.390 . 5.390 4.555 4.434 4.767 . 0 0 "[ . 1 . 2]" 1
1190 1 73 PRO HA 1 75 SER H 4.640 . 4.640 4.022 3.818 4.287 . 0 0 "[ . 1 . 2]" 1
1191 1 73 PRO HA 1 76 ALA H 4.100 . 4.100 3.411 3.331 3.540 . 0 0 "[ . 1 . 2]" 1
1192 1 73 PRO HA 1 76 ALA MB 4.670 . 4.670 2.819 2.604 3.055 . 0 0 "[ . 1 . 2]" 1
1193 1 73 PRO QB 1 74 VAL H 3.840 . 3.840 3.538 3.109 3.798 . 0 0 "[ . 1 . 2]" 1
1194 1 73 PRO QB 1 92 VAL QG 3.350 . 3.350 2.641 2.265 2.926 . 0 0 "[ . 1 . 2]" 1
1195 1 73 PRO HB2 1 74 VAL H 4.670 . 4.670 3.720 3.190 4.063 . 0 0 "[ . 1 . 2]" 1
1196 1 73 PRO HB2 1 92 VAL MG1 5.080 . 5.080 3.233 2.703 3.811 . 0 0 "[ . 1 . 2]" 1
1197 1 73 PRO HB2 1 92 VAL MG2 5.080 . 5.080 3.084 2.323 3.691 . 0 0 "[ . 1 . 2]" 1
1198 1 73 PRO HB3 1 74 VAL H 4.670 . 4.670 4.446 4.300 4.566 . 0 0 "[ . 1 . 2]" 1
1199 1 73 PRO HB3 1 92 VAL MG1 5.080 . 5.080 4.470 3.801 5.118 0.038 10 0 "[ . 1 . 2]" 1
1200 1 73 PRO HB3 1 92 VAL MG2 5.080 . 5.080 4.244 3.503 5.109 0.029 7 0 "[ . 1 . 2]" 1
1201 1 73 PRO QD 1 74 VAL H 4.000 . 4.000 3.116 2.815 3.234 . 0 0 "[ . 1 . 2]" 1
1202 1 73 PRO QG 1 74 VAL H 4.620 . 4.620 3.190 2.900 4.007 . 0 0 "[ . 1 . 2]" 1
1203 1 73 PRO QG 1 74 VAL QG 4.760 . 4.760 3.397 2.994 4.270 . 0 0 "[ . 1 . 2]" 1
1204 1 73 PRO QG 1 76 ALA MB 5.220 . 5.220 4.988 4.791 5.209 . 0 0 "[ . 1 . 2]" 1
1205 1 73 PRO QG 1 92 VAL MG1 4.280 . 4.280 2.740 1.880 4.105 . 0 0 "[ . 1 . 2]" 1
1206 1 73 PRO QG 1 92 VAL QG 3.700 . 3.700 2.076 1.872 2.414 . 0 0 "[ . 1 . 2]" 1
1207 1 73 PRO QG 1 92 VAL MG2 4.280 . 4.280 2.895 1.921 3.939 . 0 0 "[ . 1 . 2]" 1
1208 1 73 PRO QG 1 93 TYR HE1 5.190 . 5.190 4.597 3.975 5.229 0.039 15 0 "[ . 1 . 2]" 1
1209 1 74 VAL H 1 74 VAL HB 3.060 . 3.060 2.763 2.426 3.035 . 0 0 "[ . 1 . 2]" 1
1210 1 74 VAL H 1 74 VAL MG1 4.100 . 4.100 3.486 2.127 3.771 . 0 0 "[ . 1 . 2]" 1
1211 1 74 VAL H 1 74 VAL QG 3.000 . 3.000 1.871 1.737 2.157 . 0 0 "[ . 1 . 2]" 1
1212 1 74 VAL H 1 74 VAL MG2 4.100 . 4.100 2.118 1.740 3.791 . 0 0 "[ . 1 . 2]" 1
1213 1 74 VAL H 1 75 SER H 2.840 . 2.840 2.589 2.424 2.681 . 0 0 "[ . 1 . 2]" 1
1214 1 74 VAL H 1 75 SER HA 5.500 . 5.500 5.210 5.072 5.283 . 0 0 "[ . 1 . 2]" 1
1215 1 74 VAL H 1 75 SER QB 5.100 . 5.100 4.851 4.503 5.116 0.016 1 0 "[ . 1 . 2]" 1
1216 1 74 VAL H 1 76 ALA H 4.310 . 4.310 3.906 3.771 4.079 . 0 0 "[ . 1 . 2]" 1
1217 1 74 VAL H 1 77 ILE MD 4.370 . 4.370 4.358 4.197 4.420 0.050 6 0 "[ . 1 . 2]" 1
1218 1 74 VAL H 1 92 VAL QG 4.790 . 4.790 4.112 3.680 4.427 . 0 0 "[ . 1 . 2]" 1
1219 1 74 VAL HA 1 74 VAL MG1 3.480 . 3.480 2.410 2.176 3.219 . 0 0 "[ . 1 . 2]" 1
1220 1 74 VAL HA 1 74 VAL QG 3.010 . 3.010 2.143 2.093 2.284 . 0 0 "[ . 1 . 2]" 1
1221 1 74 VAL HA 1 74 VAL MG2 3.480 . 3.480 2.529 2.310 2.730 . 0 0 "[ . 1 . 2]" 1
1222 1 74 VAL HA 1 75 SER HA 4.710 . 4.710 4.755 4.734 4.782 0.072 11 0 "[ . 1 . 2]" 1
1223 1 74 VAL HA 1 76 ALA H 4.330 . 4.330 3.681 3.558 3.796 . 0 0 "[ . 1 . 2]" 1
1224 1 74 VAL HA 1 76 ALA MB 5.050 . 5.050 4.617 4.491 4.732 . 0 0 "[ . 1 . 2]" 1
1225 1 74 VAL HA 1 77 ILE H 4.170 . 4.170 3.817 3.643 4.060 . 0 0 "[ . 1 . 2]" 1
1226 1 74 VAL HA 1 77 ILE MD 3.090 . 3.090 2.041 1.984 2.151 . 0 0 "[ . 1 . 2]" 1
1227 1 74 VAL HA 1 77 ILE HG13 4.810 . 4.810 3.232 2.879 3.729 . 0 0 "[ . 1 . 2]" 1
1228 1 74 VAL HA 1 77 ILE MG 4.870 . 4.870 4.709 4.548 4.886 0.016 12 0 "[ . 1 . 2]" 1
1229 1 74 VAL HA 1 89 LEU HA 5.000 . 5.000 4.907 4.536 5.057 0.057 1 0 "[ . 1 . 2]" 1
1230 1 74 VAL HA 1 89 LEU QD 4.690 . 4.690 3.399 3.084 3.807 . 0 0 "[ . 1 . 2]" 1
1231 1 74 VAL HA 1 92 VAL QG 3.760 . 3.760 3.645 3.157 3.834 0.074 11 0 "[ . 1 . 2]" 1
1232 1 74 VAL HB 1 75 SER H 3.670 . 3.670 2.841 2.475 3.867 0.197 14 0 "[ . 1 . 2]" 1
1233 1 74 VAL HB 1 77 ILE MD 4.630 . 4.630 4.352 3.721 4.624 . 0 0 "[ . 1 . 2]" 1
1234 1 74 VAL HB 1 93 TYR HE1 4.860 . 4.860 4.339 2.057 4.890 0.030 15 0 "[ . 1 . 2]" 1
1235 1 74 VAL QG 1 75 SER HA 4.170 . 4.170 3.756 2.992 4.147 . 0 0 "[ . 1 . 2]" 1
1236 1 74 VAL QG 1 75 SER QB 5.050 . 5.050 4.455 3.523 4.680 . 0 0 "[ . 1 . 2]" 1
1237 1 74 VAL QG 1 77 ILE H 5.440 . 5.440 4.233 4.008 4.476 . 0 0 "[ . 1 . 2]" 1
1238 1 74 VAL QG 1 77 ILE HB 4.190 . 4.190 3.610 3.427 3.895 . 0 0 "[ . 1 . 2]" 1
1239 1 74 VAL QG 1 77 ILE HG13 5.440 . 5.440 4.250 4.031 4.607 . 0 0 "[ . 1 . 2]" 1
1240 1 74 VAL QG 1 89 LEU QD 3.180 . 3.180 2.115 1.883 2.638 . 0 0 "[ . 1 . 2]" 1
1241 1 74 VAL QG 1 92 VAL QG 4.170 . 4.170 3.149 2.673 4.038 . 0 0 "[ . 1 . 2]" 1
1242 1 74 VAL QG 1 93 TYR HE1 3.420 . 3.420 2.099 1.890 2.868 . 0 0 "[ . 1 . 2]" 1
1243 1 74 VAL MG1 1 75 SER H 4.170 . 4.170 3.578 2.021 4.047 . 0 0 "[ . 1 . 2]" 1
1244 1 74 VAL MG1 1 75 SER HA 5.500 . 5.500 3.888 3.142 4.403 . 0 0 "[ . 1 . 2]" 1
1245 1 74 VAL MG1 1 93 TYR HE1 4.100 . 4.100 3.197 2.506 3.687 . 0 0 "[ . 1 . 2]" 1
1246 1 74 VAL MG2 1 75 SER H 4.170 . 4.170 3.495 3.174 3.829 . 0 0 "[ . 1 . 2]" 1
1247 1 74 VAL MG2 1 75 SER HA 5.500 . 5.500 5.028 3.757 5.361 . 0 0 "[ . 1 . 2]" 1
1248 1 74 VAL MG2 1 93 TYR HE1 4.100 . 4.100 2.143 1.908 2.997 . 0 0 "[ . 1 . 2]" 1
1249 1 75 SER H 1 75 SER QB 3.050 . 3.050 2.660 2.386 2.874 . 0 0 "[ . 1 . 2]" 1
1250 1 75 SER H 1 76 ALA H 3.150 . 3.150 2.624 2.545 2.739 . 0 0 "[ . 1 . 2]" 1
1251 1 75 SER H 1 77 ILE H 4.420 . 4.420 4.212 4.130 4.305 . 0 0 "[ . 1 . 2]" 1
1252 1 75 SER HA 1 77 ILE H 4.200 . 4.200 3.503 3.331 3.617 . 0 0 "[ . 1 . 2]" 1
1253 1 75 SER QB 1 76 ALA H 4.100 . 4.100 3.274 3.120 3.530 . 0 0 "[ . 1 . 2]" 1
1254 1 75 SER QB 1 76 ALA MB 4.680 . 4.680 4.027 3.897 4.314 . 0 0 "[ . 1 . 2]" 1
1255 1 76 ALA H 1 76 ALA MB 2.840 . 2.840 2.287 2.252 2.337 . 0 0 "[ . 1 . 2]" 1
1256 1 76 ALA H 1 77 ILE H 3.070 . 3.070 2.377 2.219 2.479 . 0 0 "[ . 1 . 2]" 1
1257 1 76 ALA H 1 77 ILE HB 4.760 . 4.760 4.539 4.418 4.655 . 0 0 "[ . 1 . 2]" 1
1258 1 76 ALA H 1 77 ILE MD 4.290 . 4.290 4.268 4.046 4.321 0.031 7 0 "[ . 1 . 2]" 1
1259 1 76 ALA H 1 77 ILE HG13 4.150 . 4.150 3.521 3.309 3.762 . 0 0 "[ . 1 . 2]" 1
1260 1 76 ALA MB 1 77 ILE H 3.600 . 3.600 3.255 3.137 3.345 . 0 0 "[ . 1 . 2]" 1
1261 1 76 ALA MB 1 77 ILE HA 4.260 . 4.260 4.062 3.991 4.120 . 0 0 "[ . 1 . 2]" 1
1262 1 76 ALA MB 1 77 ILE HB 5.190 . 5.190 4.993 4.869 5.105 . 0 0 "[ . 1 . 2]" 1
1263 1 76 ALA MB 1 77 ILE MD 4.370 . 4.370 4.275 3.952 4.405 0.035 2 0 "[ . 1 . 2]" 1
1264 1 76 ALA MB 1 77 ILE HG13 4.690 . 4.690 3.257 3.096 3.381 . 0 0 "[ . 1 . 2]" 1
1265 1 76 ALA MB 1 77 ILE MG 5.380 . 5.380 5.117 5.071 5.188 . 0 0 "[ . 1 . 2]" 1
1266 1 77 ILE H 1 77 ILE HB 3.000 . 3.000 2.525 2.482 2.559 . 0 0 "[ . 1 . 2]" 1
1267 1 77 ILE H 1 77 ILE MD 3.540 . 3.540 3.492 3.303 3.580 0.040 3 0 "[ . 1 . 2]" 1
1268 1 77 ILE H 1 77 ILE HG12 4.280 . 4.280 3.861 3.725 4.035 . 0 0 "[ . 1 . 2]" 1
1269 1 77 ILE H 1 77 ILE HG13 3.030 . 3.030 2.485 2.364 2.648 . 0 0 "[ . 1 . 2]" 1
1270 1 77 ILE H 1 78 SER H 4.220 . 4.220 4.265 4.170 4.309 0.089 3 0 "[ . 1 . 2]" 1
1271 1 77 ILE HA 1 77 ILE MD 3.940 . 3.940 3.889 3.875 3.906 . 0 0 "[ . 1 . 2]" 1
1272 1 77 ILE HA 1 77 ILE HG12 3.970 . 3.970 2.718 2.646 2.808 . 0 0 "[ . 1 . 2]" 1
1273 1 77 ILE HA 1 77 ILE HG13 4.090 . 4.090 2.826 2.705 2.933 . 0 0 "[ . 1 . 2]" 1
1274 1 77 ILE HA 1 77 ILE MG 3.210 . 3.210 2.408 2.373 2.452 . 0 0 "[ . 1 . 2]" 1
1275 1 77 ILE HA 1 78 SER H 2.810 . 2.810 2.147 2.110 2.190 . 0 0 "[ . 1 . 2]" 1
1276 1 77 ILE HA 1 89 LEU QD 5.440 . 5.440 5.280 4.962 5.532 0.092 11 0 "[ . 1 . 2]" 1
1277 1 77 ILE HB 1 77 ILE MD 3.290 . 3.290 2.272 2.207 2.310 . 0 0 "[ . 1 . 2]" 1
1278 1 77 ILE HB 1 78 SER HA 5.040 . 5.040 4.767 4.717 4.819 . 0 0 "[ . 1 . 2]" 1
1279 1 77 ILE MD 1 88 GLU HA 5.500 . 5.500 4.474 4.099 4.792 . 0 0 "[ . 1 . 2]" 1
1280 1 77 ILE MD 1 88 GLU HB2 4.620 . 4.620 3.160 2.674 3.840 . 0 0 "[ . 1 . 2]" 1
1281 1 77 ILE MD 1 89 LEU H 4.640 . 4.640 3.485 3.261 3.811 . 0 0 "[ . 1 . 2]" 1
1282 1 77 ILE MD 1 89 LEU HA 3.670 . 3.670 2.588 2.163 2.892 . 0 0 "[ . 1 . 2]" 1
1283 1 77 ILE MD 1 89 LEU HB2 5.500 . 5.500 4.267 3.833 4.661 . 0 0 "[ . 1 . 2]" 1
1284 1 77 ILE MD 1 89 LEU HB3 5.500 . 5.500 4.483 4.128 4.792 . 0 0 "[ . 1 . 2]" 1
1285 1 77 ILE MD 1 89 LEU QD 3.390 . 3.390 1.882 1.830 1.986 . 0 0 "[ . 1 . 2]" 1
1286 1 77 ILE MD 1 89 LEU HG 5.300 . 5.300 3.211 2.472 4.469 . 0 0 "[ . 1 . 2]" 1
1287 1 77 ILE MD 1 90 SER H 5.500 . 5.500 5.258 5.012 5.480 . 0 0 "[ . 1 . 2]" 1
1288 1 77 ILE MD 1 92 VAL HB 4.930 . 4.930 3.786 3.194 4.278 . 0 0 "[ . 1 . 2]" 1
1289 1 77 ILE MD 1 93 TYR HE1 4.940 . 4.940 4.489 3.754 4.936 . 0 0 "[ . 1 . 2]" 1
1290 1 77 ILE HG12 1 77 ILE MG 3.620 . 3.620 2.255 2.205 2.304 . 0 0 "[ . 1 . 2]" 1
1291 1 77 ILE HG12 1 78 SER H 5.160 . 5.160 4.713 4.598 4.839 . 0 0 "[ . 1 . 2]" 1
1292 1 77 ILE HG12 1 88 GLU HB3 5.500 . 5.500 2.864 2.381 3.362 . 0 0 "[ . 1 . 2]" 1
1293 1 77 ILE HG13 1 92 VAL QG 4.990 . 4.990 4.151 3.633 4.704 . 0 0 "[ . 1 . 2]" 1
1294 1 77 ILE MG 1 78 SER H 3.400 . 3.400 3.076 2.931 3.191 . 0 0 "[ . 1 . 2]" 1
1295 1 77 ILE MG 1 78 SER HA 3.770 . 3.770 3.563 3.466 3.656 . 0 0 "[ . 1 . 2]" 1
1296 1 77 ILE MG 1 78 SER HB2 5.500 . 5.500 5.300 4.988 5.537 0.037 13 0 "[ . 1 . 2]" 1
1297 1 77 ILE MG 1 78 SER HB3 5.500 . 5.500 5.426 5.171 5.537 0.037 5 0 "[ . 1 . 2]" 1
1298 1 77 ILE MG 1 79 THR HB 4.910 . 4.910 3.831 3.393 4.208 . 0 0 "[ . 1 . 2]" 1
1299 1 77 ILE MG 1 85 ALA HA 3.520 . 3.520 2.807 2.566 3.080 . 0 0 "[ . 1 . 2]" 1
1300 1 77 ILE MG 1 88 GLU H 5.050 . 5.050 4.301 4.138 4.528 . 0 0 "[ . 1 . 2]" 1
1301 1 77 ILE MG 1 88 GLU HA 5.200 . 5.200 4.755 4.367 5.066 . 0 0 "[ . 1 . 2]" 1
1302 1 77 ILE MG 1 88 GLU HB2 4.040 . 4.040 2.443 2.222 2.608 . 0 0 "[ . 1 . 2]" 1
1303 1 77 ILE MG 1 88 GLU HB3 4.350 . 4.350 2.849 2.339 3.253 . 0 0 "[ . 1 . 2]" 1
1304 1 77 ILE MG 1 88 GLU HG2 4.680 . 4.680 4.331 4.078 4.553 . 0 0 "[ . 1 . 2]" 1
1305 1 77 ILE MG 1 88 GLU HG3 4.800 . 4.800 3.633 3.169 3.920 . 0 0 "[ . 1 . 2]" 1
1306 1 77 ILE MG 1 89 LEU H 4.230 . 4.230 3.738 3.213 3.942 . 0 0 "[ . 1 . 2]" 1
1307 1 77 ILE MG 1 89 LEU HA 5.500 . 5.500 4.270 3.479 4.720 . 0 0 "[ . 1 . 2]" 1
1308 1 77 ILE MG 1 89 LEU QD 4.360 . 4.360 2.700 2.203 3.144 . 0 0 "[ . 1 . 2]" 1
1309 1 77 ILE MG 1 89 LEU HG 4.930 . 4.930 4.000 2.588 4.953 0.023 5 0 "[ . 1 . 2]" 1
1310 1 78 SER H 1 78 SER HB2 3.900 . 3.900 3.034 2.872 3.629 . 0 0 "[ . 1 . 2]" 1
1311 1 78 SER H 1 78 SER HB3 3.900 . 3.900 3.802 2.813 3.922 0.022 3 0 "[ . 1 . 2]" 1
1312 1 78 SER H 1 79 THR H 4.350 . 4.350 3.789 3.654 3.934 . 0 0 "[ . 1 . 2]" 1
1313 1 78 SER HA 1 79 THR H 2.810 . 2.810 2.207 2.165 2.255 . 0 0 "[ . 1 . 2]" 1
1314 1 78 SER HA 1 79 THR MG 4.730 . 4.730 3.966 3.870 4.062 . 0 0 "[ . 1 . 2]" 1
1315 1 78 SER QB 1 79 THR H 3.970 . 3.970 3.692 3.574 3.998 0.028 11 0 "[ . 1 . 2]" 1
1316 1 78 SER QB 1 79 THR MG 5.340 . 5.340 5.055 4.977 5.220 . 0 0 "[ . 1 . 2]" 1
1317 1 78 SER HB2 1 79 THR H 4.530 . 4.530 4.314 3.941 4.526 . 0 0 "[ . 1 . 2]" 1
1318 1 78 SER HB3 1 79 THR H 4.530 . 4.530 4.030 3.805 4.451 . 0 0 "[ . 1 . 2]" 1
1319 1 79 THR H 1 79 THR HB 4.090 . 4.090 3.168 3.027 3.225 . 0 0 "[ . 1 . 2]" 1
1320 1 79 THR H 1 79 THR MG 2.950 . 2.950 2.209 2.148 2.315 . 0 0 "[ . 1 . 2]" 1
1321 1 79 THR H 1 80 THR H 4.460 . 4.460 4.446 4.427 4.468 0.008 5 0 "[ . 1 . 2]" 1
1322 1 79 THR HA 1 79 THR MG 3.510 . 3.510 3.204 3.196 3.213 . 0 0 "[ . 1 . 2]" 1
1323 1 79 THR HA 1 80 THR H 2.900 . 2.900 2.335 2.291 2.376 . 0 0 "[ . 1 . 2]" 1
1324 1 79 THR HA 1 81 SER H 4.310 . 4.310 3.886 3.781 4.045 . 0 0 "[ . 1 . 2]" 1
1325 1 79 THR HB 1 80 THR H 4.250 . 4.250 3.917 3.815 3.982 . 0 0 "[ . 1 . 2]" 1
1326 1 79 THR HB 1 81 SER H 4.530 . 4.530 4.147 4.030 4.310 . 0 0 "[ . 1 . 2]" 1
1327 1 79 THR HB 1 85 ALA MB 4.830 . 4.830 4.504 4.398 4.617 . 0 0 "[ . 1 . 2]" 1
1328 1 79 THR MG 1 80 THR H 4.360 . 4.360 3.492 3.401 3.604 . 0 0 "[ . 1 . 2]" 1
1329 1 79 THR MG 1 80 THR HB 5.500 . 5.500 5.548 5.400 5.630 0.130 8 0 "[ . 1 . 2]" 1
1330 1 79 THR MG 1 81 SER H 3.420 . 3.420 2.531 2.200 2.744 . 0 0 "[ . 1 . 2]" 1
1331 1 79 THR MG 1 81 SER HA 4.980 . 4.980 4.337 4.210 4.418 . 0 0 "[ . 1 . 2]" 1
1332 1 79 THR MG 1 81 SER QB 5.230 . 5.230 3.263 3.037 3.497 . 0 0 "[ . 1 . 2]" 1
1333 1 79 THR MG 1 82 VAL H 4.930 . 4.930 4.658 4.522 4.804 . 0 0 "[ . 1 . 2]" 1
1334 1 79 THR MG 1 82 VAL QG 5.110 . 5.110 4.668 4.557 4.796 . 0 0 "[ . 1 . 2]" 1
1335 1 79 THR MG 1 84 GLN H 3.910 . 3.910 3.862 3.763 3.955 0.045 2 0 "[ . 1 . 2]" 1
1336 1 79 THR MG 1 84 GLN HA 4.660 . 4.660 4.312 4.137 4.437 . 0 0 "[ . 1 . 2]" 1
1337 1 79 THR MG 1 84 GLN HB2 4.530 . 4.530 3.787 3.606 3.995 . 0 0 "[ . 1 . 2]" 1
1338 1 79 THR MG 1 84 GLN HB3 3.540 . 3.540 2.263 2.096 2.468 . 0 0 "[ . 1 . 2]" 1
1339 1 79 THR MG 1 84 GLN HG2 4.070 . 4.070 2.906 2.351 3.369 . 0 0 "[ . 1 . 2]" 1
1340 1 79 THR MG 1 84 GLN QG 3.490 . 3.490 2.549 2.331 2.841 . 0 0 "[ . 1 . 2]" 1
1341 1 79 THR MG 1 84 GLN HG3 4.070 . 4.070 3.126 2.482 4.028 . 0 0 "[ . 1 . 2]" 1
1342 1 79 THR MG 1 85 ALA HA 3.400 . 3.400 2.457 2.294 2.628 . 0 0 "[ . 1 . 2]" 1
1343 1 79 THR MG 1 88 GLU H 5.500 . 5.500 4.856 4.578 5.076 . 0 0 "[ . 1 . 2]" 1
1344 1 79 THR MG 1 88 GLU HB2 5.000 . 5.000 4.327 3.960 4.698 . 0 0 "[ . 1 . 2]" 1
1345 1 79 THR MG 1 88 GLU HG3 5.380 . 5.380 4.007 3.579 4.586 . 0 0 "[ . 1 . 2]" 1
1346 1 80 THR H 1 80 THR HB 3.480 . 3.480 3.459 3.346 3.549 0.069 17 0 "[ . 1 . 2]" 1
1347 1 80 THR H 1 80 THR MG 3.140 . 3.140 3.077 2.800 3.224 0.084 19 0 "[ . 1 . 2]" 1
1348 1 80 THR H 1 81 SER H 3.130 . 3.130 2.341 2.237 2.544 . 0 0 "[ . 1 . 2]" 1
1349 1 80 THR H 1 81 SER HA 5.090 . 5.090 4.940 4.876 5.062 . 0 0 "[ . 1 . 2]" 1
1350 1 80 THR H 1 81 SER QB 4.580 . 4.580 4.252 3.961 4.634 0.054 15 0 "[ . 1 . 2]" 1
1351 1 80 THR HA 1 80 THR MG 2.920 . 2.920 2.186 2.148 2.261 . 0 0 "[ . 1 . 2]" 1
1352 1 80 THR HB 1 81 SER H 4.320 . 4.320 3.849 3.655 4.081 . 0 0 "[ . 1 . 2]" 1
1353 1 80 THR MG 1 81 SER H 4.600 . 4.600 4.365 4.231 4.460 . 0 0 "[ . 1 . 2]" 1
1354 1 81 SER H 1 81 SER HB2 3.690 . 3.690 2.884 2.513 3.274 . 0 0 "[ . 1 . 2]" 1
1355 1 81 SER H 1 81 SER QB 3.020 . 3.020 2.442 2.257 2.763 . 0 0 "[ . 1 . 2]" 1
1356 1 81 SER H 1 81 SER HB3 3.690 . 3.690 2.952 2.322 3.696 0.006 5 0 "[ . 1 . 2]" 1
1357 1 81 SER H 1 82 VAL H 4.540 . 4.540 4.364 4.298 4.450 . 0 0 "[ . 1 . 2]" 1
1358 1 81 SER H 1 84 GLN H 4.760 . 4.760 4.728 4.525 4.809 0.049 17 0 "[ . 1 . 2]" 1
1359 1 81 SER H 1 84 GLN HB2 5.030 . 5.030 4.707 4.486 4.915 . 0 0 "[ . 1 . 2]" 1
1360 1 81 SER H 1 84 GLN HB3 4.250 . 4.250 3.546 3.341 3.727 . 0 0 "[ . 1 . 2]" 1
1361 1 81 SER HA 1 82 VAL H 2.830 . 2.830 2.154 2.121 2.172 . 0 0 "[ . 1 . 2]" 1
1362 1 81 SER HA 1 82 VAL MG1 5.500 . 5.500 4.064 3.722 5.317 . 0 0 "[ . 1 . 2]" 1
1363 1 81 SER HA 1 82 VAL QG 4.140 . 4.140 3.784 3.254 3.983 . 0 0 "[ . 1 . 2]" 1
1364 1 81 SER HA 1 82 VAL MG2 5.500 . 5.500 5.250 3.283 5.491 . 0 0 "[ . 1 . 2]" 1
1365 1 81 SER HA 1 83 GLN H 4.030 . 4.030 3.729 3.583 4.101 0.071 14 0 "[ . 1 . 2]" 1
1366 1 81 SER HA 1 84 GLN H 4.570 . 4.570 4.271 4.174 4.366 . 0 0 "[ . 1 . 2]" 1
1367 1 81 SER HA 1 84 GLN HB2 5.500 . 5.500 5.343 5.050 5.498 . 0 0 "[ . 1 . 2]" 1
1368 1 81 SER HA 1 84 GLN HB3 5.050 . 5.050 4.720 4.641 4.858 . 0 0 "[ . 1 . 2]" 1
1369 1 81 SER QB 1 82 VAL H 3.970 . 3.970 3.644 3.241 3.889 . 0 0 "[ . 1 . 2]" 1
1370 1 81 SER QB 1 83 GLN H 4.300 . 4.300 3.639 3.129 4.022 . 0 0 "[ . 1 . 2]" 1
1371 1 81 SER QB 1 84 GLN H 3.810 . 3.810 2.688 2.308 2.991 . 0 0 "[ . 1 . 2]" 1
1372 1 81 SER QB 1 84 GLN HB2 4.190 . 4.190 2.498 2.140 2.734 . 0 0 "[ . 1 . 2]" 1
1373 1 81 SER QB 1 84 GLN HB3 4.060 . 4.060 2.142 2.029 2.281 . 0 0 "[ . 1 . 2]" 1
1374 1 81 SER QB 1 84 GLN QG 5.180 . 5.180 3.608 3.314 3.976 . 0 0 "[ . 1 . 2]" 1
1375 1 81 SER QB 1 85 ALA H 4.540 . 4.540 3.782 3.541 3.961 . 0 0 "[ . 1 . 2]" 1
1376 1 81 SER HB2 1 82 VAL H 4.670 . 4.670 4.212 4.086 4.298 . 0 0 "[ . 1 . 2]" 1
1377 1 81 SER HB2 1 84 GLN HB2 4.780 . 4.780 3.239 2.179 4.062 . 0 0 "[ . 1 . 2]" 1
1378 1 81 SER HB2 1 84 GLN HB3 4.660 . 4.660 3.094 2.048 4.023 . 0 0 "[ . 1 . 2]" 1
1379 1 81 SER HB3 1 82 VAL H 4.670 . 4.670 4.048 3.400 4.447 . 0 0 "[ . 1 . 2]" 1
1380 1 81 SER HB3 1 84 GLN HB2 4.780 . 4.780 3.045 2.423 3.794 . 0 0 "[ . 1 . 2]" 1
1381 1 81 SER HB3 1 84 GLN HB3 4.660 . 4.660 2.866 2.065 3.956 . 0 0 "[ . 1 . 2]" 1
1382 1 82 VAL H 1 82 VAL HB 3.180 . 3.180 2.545 2.423 3.046 . 0 0 "[ . 1 . 2]" 1
1383 1 82 VAL H 1 82 VAL MG1 3.920 . 3.920 2.373 2.062 3.665 . 0 0 "[ . 1 . 2]" 1
1384 1 82 VAL H 1 82 VAL QG 2.950 . 2.950 2.155 1.600 2.340 . 0 0 "[ . 1 . 2]" 1
1385 1 82 VAL H 1 82 VAL MG2 3.920 . 3.920 3.550 1.602 3.786 . 0 0 "[ . 1 . 2]" 1
1386 1 82 VAL H 1 83 GLN H 3.180 . 3.180 2.626 2.521 2.821 . 0 0 "[ . 1 . 2]" 1
1387 1 82 VAL H 1 84 GLN H 4.560 . 4.560 4.202 4.004 4.288 . 0 0 "[ . 1 . 2]" 1
1388 1 82 VAL H 1 85 ALA MB 5.330 . 5.330 4.581 4.392 4.794 . 0 0 "[ . 1 . 2]" 1
1389 1 82 VAL HA 1 82 VAL MG1 3.650 . 3.650 3.114 2.188 3.224 . 0 0 "[ . 1 . 2]" 1
1390 1 82 VAL HA 1 82 VAL QG 3.010 . 3.010 2.226 2.106 2.327 . 0 0 "[ . 1 . 2]" 1
1391 1 82 VAL HA 1 82 VAL MG2 3.650 . 3.650 2.331 2.207 2.752 . 0 0 "[ . 1 . 2]" 1
1392 1 82 VAL HA 1 85 ALA H 3.710 . 3.710 3.336 3.245 3.517 . 0 0 "[ . 1 . 2]" 1
1393 1 82 VAL HA 1 85 ALA MB 3.460 . 3.460 2.452 2.284 2.715 . 0 0 "[ . 1 . 2]" 1
1394 1 82 VAL HA 1 86 ALA H 4.820 . 4.820 4.042 3.902 4.234 . 0 0 "[ . 1 . 2]" 1
1395 1 82 VAL HB 1 83 GLN H 4.120 . 4.120 3.831 2.434 4.037 . 0 0 "[ . 1 . 2]" 1
1396 1 82 VAL HB 1 102 VAL QG 5.360 . 5.360 3.752 2.203 4.497 . 0 0 "[ . 1 . 2]" 1
1397 1 82 VAL QG 1 83 GLN H 2.950 . 2.950 2.342 2.128 3.006 0.056 18 0 "[ . 1 . 2]" 1
1398 1 82 VAL QG 1 83 GLN HA 3.890 . 3.890 3.143 2.977 3.959 0.069 18 0 "[ . 1 . 2]" 1
1399 1 82 VAL QG 1 83 GLN QB 4.440 . 4.440 3.699 3.479 4.484 0.044 18 0 "[ . 1 . 2]" 1
1400 1 82 VAL QG 1 83 GLN QG 3.620 . 3.620 2.548 2.255 3.641 0.021 14 0 "[ . 1 . 2]" 1
1401 1 82 VAL QG 1 84 GLN H 4.350 . 4.350 4.217 4.048 4.470 0.120 14 0 "[ . 1 . 2]" 1
1402 1 82 VAL QG 1 85 ALA MB 3.590 . 3.590 3.109 2.997 3.364 . 0 0 "[ . 1 . 2]" 1
1403 1 82 VAL QG 1 86 ALA H 4.540 . 4.540 3.814 3.685 4.148 . 0 0 "[ . 1 . 2]" 1
1404 1 82 VAL QG 1 86 ALA MB 4.390 . 4.390 3.403 3.260 3.758 . 0 0 "[ . 1 . 2]" 1
1405 1 82 VAL QG 1 102 VAL HB 5.000 . 5.000 3.029 2.446 3.874 . 0 0 "[ . 1 . 2]" 1
1406 1 82 VAL QG 1 102 VAL QG 2.620 . 2.620 1.795 1.679 2.120 . 0 0 "[ . 1 . 2]" 1
1407 1 82 VAL QG 1 107 LEU QD 2.910 . 2.910 1.985 1.859 2.155 . 0 0 "[ . 1 . 2]" 1
1408 1 82 VAL QG 1 107 LEU HG 4.850 . 4.850 3.486 2.952 3.826 . 0 0 "[ . 1 . 2]" 1
1409 1 82 VAL MG1 1 83 GLN H 4.190 . 4.190 2.438 2.141 3.831 . 0 0 "[ . 1 . 2]" 1
1410 1 82 VAL MG1 1 83 GLN HA 5.260 . 5.260 3.282 3.079 4.141 . 0 0 "[ . 1 . 2]" 1
1411 1 82 VAL MG2 1 83 GLN H 4.190 . 4.190 3.792 3.123 3.996 . 0 0 "[ . 1 . 2]" 1
1412 1 82 VAL MG2 1 83 GLN HA 5.260 . 5.260 4.035 3.746 5.036 . 0 0 "[ . 1 . 2]" 1
1413 1 83 GLN H 1 83 GLN QB 2.830 . 2.830 2.363 2.245 2.487 . 0 0 "[ . 1 . 2]" 1
1414 1 83 GLN H 1 83 GLN HG2 3.990 . 3.990 3.585 3.265 3.904 . 0 0 "[ . 1 . 2]" 1
1415 1 83 GLN H 1 83 GLN QG 3.490 . 3.490 2.393 2.138 2.642 . 0 0 "[ . 1 . 2]" 1
1416 1 83 GLN H 1 83 GLN HG3 3.990 . 3.990 2.431 2.166 2.687 . 0 0 "[ . 1 . 2]" 1
1417 1 83 GLN H 1 84 GLN H 3.100 . 3.100 2.578 2.515 2.657 . 0 0 "[ . 1 . 2]" 1
1418 1 83 GLN H 1 84 GLN HB2 5.240 . 5.240 5.007 4.826 5.113 . 0 0 "[ . 1 . 2]" 1
1419 1 83 GLN H 1 85 ALA H 4.200 . 4.200 3.983 3.789 4.188 . 0 0 "[ . 1 . 2]" 1
1420 1 83 GLN H 1 85 ALA MB 4.800 . 4.800 4.607 4.427 4.826 0.026 18 0 "[ . 1 . 2]" 1
1421 1 83 GLN H 1 86 ALA H 5.480 . 5.480 4.811 4.681 4.949 . 0 0 "[ . 1 . 2]" 1
1422 1 83 GLN H 1 102 VAL QG 4.210 . 4.210 3.362 3.126 3.590 . 0 0 "[ . 1 . 2]" 1
1423 1 83 GLN HA 1 83 GLN HG2 3.840 . 3.840 2.501 2.413 2.682 . 0 0 "[ . 1 . 2]" 1
1424 1 83 GLN HA 1 83 GLN HG3 3.840 . 3.840 2.995 2.734 3.226 . 0 0 "[ . 1 . 2]" 1
1425 1 83 GLN HA 1 86 ALA MB 3.690 . 3.690 2.994 2.853 3.187 . 0 0 "[ . 1 . 2]" 1
1426 1 83 GLN HA 1 102 VAL H 4.720 . 4.720 4.032 3.799 4.459 . 0 0 "[ . 1 . 2]" 1
1427 1 83 GLN HA 1 102 VAL HB 4.860 . 4.860 3.652 2.903 4.359 . 0 0 "[ . 1 . 2]" 1
1428 1 83 GLN HA 1 102 VAL MG1 4.280 . 4.280 3.125 1.894 4.239 . 0 0 "[ . 1 . 2]" 1
1429 1 83 GLN HA 1 102 VAL QG 3.080 . 3.080 2.100 1.891 2.302 . 0 0 "[ . 1 . 2]" 1
1430 1 83 GLN HA 1 102 VAL MG2 4.280 . 4.280 3.128 2.067 4.375 0.095 3 0 "[ . 1 . 2]" 1
1431 1 83 GLN QB 1 84 GLN H 3.250 . 3.250 2.579 2.426 2.768 . 0 0 "[ . 1 . 2]" 1
1432 1 83 GLN QB 1 85 ALA H 4.760 . 4.760 4.661 4.483 4.773 0.013 18 0 "[ . 1 . 2]" 1
1433 1 83 GLN QB 1 86 ALA MB 4.900 . 4.900 4.433 4.304 4.673 . 0 0 "[ . 1 . 2]" 1
1434 1 83 GLN QB 1 102 VAL MG1 5.190 . 5.190 4.170 3.164 5.068 . 0 0 "[ . 1 . 2]" 1
1435 1 83 GLN QB 1 102 VAL QG 4.200 . 4.200 3.507 3.128 3.829 . 0 0 "[ . 1 . 2]" 1
1436 1 83 GLN QB 1 102 VAL MG2 5.190 . 5.190 4.394 3.716 5.149 . 0 0 "[ . 1 . 2]" 1
1437 1 83 GLN QG 1 84 GLN H 5.090 . 5.090 4.124 3.865 4.269 . 0 0 "[ . 1 . 2]" 1
1438 1 83 GLN QG 1 102 VAL HB 4.490 . 4.490 3.357 2.214 4.563 0.073 13 0 "[ . 1 . 2]" 1
1439 1 83 GLN QG 1 102 VAL QG 3.160 . 3.160 2.396 1.891 2.884 . 0 0 "[ . 1 . 2]" 1
1440 1 83 GLN HG2 1 102 VAL MG1 4.140 . 4.140 2.906 1.941 4.014 . 0 0 "[ . 1 . 2]" 1
1441 1 83 GLN HG2 1 102 VAL MG2 4.140 . 4.140 3.460 3.055 4.029 . 0 0 "[ . 1 . 2]" 1
1442 1 83 GLN HG3 1 102 VAL MG1 4.140 . 4.140 3.272 2.419 4.072 . 0 0 "[ . 1 . 2]" 1
1443 1 83 GLN HG3 1 102 VAL MG2 4.140 . 4.140 3.749 3.094 4.118 . 0 0 "[ . 1 . 2]" 1
1444 1 84 GLN H 1 84 GLN HB2 3.200 . 3.200 2.576 2.467 2.663 . 0 0 "[ . 1 . 2]" 1
1445 1 84 GLN H 1 84 GLN HB3 3.280 . 3.280 2.495 2.399 2.565 . 0 0 "[ . 1 . 2]" 1
1446 1 84 GLN H 1 84 GLN QG 4.450 . 4.450 4.000 3.954 4.028 . 0 0 "[ . 1 . 2]" 1
1447 1 84 GLN H 1 85 ALA H 3.100 . 3.100 2.562 2.470 2.633 . 0 0 "[ . 1 . 2]" 1
1448 1 84 GLN H 1 86 ALA H 4.570 . 4.570 4.261 4.166 4.358 . 0 0 "[ . 1 . 2]" 1
1449 1 84 GLN H 1 86 ALA MB 5.500 . 5.500 5.004 4.918 5.116 . 0 0 "[ . 1 . 2]" 1
1450 1 84 GLN H 1 87 THR H 5.080 . 5.080 4.668 4.609 4.729 . 0 0 "[ . 1 . 2]" 1
1451 1 84 GLN HA 1 84 GLN HG2 3.790 . 3.790 3.642 3.123 3.825 0.035 4 0 "[ . 1 . 2]" 1
1452 1 84 GLN HA 1 84 GLN HG3 3.790 . 3.790 2.835 2.424 3.157 . 0 0 "[ . 1 . 2]" 1
1453 1 84 GLN HA 1 86 ALA H 4.730 . 4.730 4.544 4.415 4.630 . 0 0 "[ . 1 . 2]" 1
1454 1 84 GLN HA 1 87 THR HB 3.580 . 3.580 2.468 2.276 2.607 . 0 0 "[ . 1 . 2]" 1
1455 1 84 GLN HA 1 87 THR MG 4.090 . 4.090 3.727 3.586 3.882 . 0 0 "[ . 1 . 2]" 1
1456 1 84 GLN HB2 1 85 ALA H 4.270 . 4.270 3.861 3.752 3.910 . 0 0 "[ . 1 . 2]" 1
1457 1 84 GLN HB2 1 87 THR MG 5.500 . 5.500 5.449 5.221 5.559 0.059 14 0 "[ . 1 . 2]" 1
1458 1 84 GLN HB3 1 85 ALA H 3.490 . 3.490 2.583 2.502 2.676 . 0 0 "[ . 1 . 2]" 1
1459 1 84 GLN QG 1 85 ALA H 3.990 . 3.990 3.605 3.421 3.742 . 0 0 "[ . 1 . 2]" 1
1460 1 84 GLN QG 1 85 ALA HA 4.340 . 4.340 3.687 3.479 3.871 . 0 0 "[ . 1 . 2]" 1
1461 1 84 GLN QG 1 87 THR HB 4.970 . 4.970 3.685 3.352 3.951 . 0 0 "[ . 1 . 2]" 1
1462 1 84 GLN QG 1 87 THR MG 4.500 . 4.500 4.441 4.090 4.583 0.083 6 0 "[ . 1 . 2]" 1
1463 1 84 GLN HG2 1 85 ALA H 4.550 . 4.550 4.320 3.526 4.625 0.075 2 0 "[ . 1 . 2]" 1
1464 1 84 GLN HG2 1 88 GLU HG3 4.610 . 4.610 3.550 2.443 4.453 . 0 0 "[ . 1 . 2]" 1
1465 1 84 GLN HG3 1 85 ALA H 4.550 . 4.550 4.033 3.626 4.635 0.085 17 0 "[ . 1 . 2]" 1
1466 1 84 GLN HG3 1 88 GLU HG3 4.610 . 4.610 2.552 2.071 3.312 . 0 0 "[ . 1 . 2]" 1
1467 1 85 ALA H 1 85 ALA MB 2.670 . 2.670 2.228 2.198 2.241 . 0 0 "[ . 1 . 2]" 1
1468 1 85 ALA H 1 86 ALA H 3.140 . 3.140 2.821 2.774 2.870 . 0 0 "[ . 1 . 2]" 1
1469 1 85 ALA H 1 86 ALA MB 4.530 . 4.530 4.460 4.381 4.516 . 0 0 "[ . 1 . 2]" 1
1470 1 85 ALA HA 1 88 GLU H 3.850 . 3.850 3.581 3.511 3.638 . 0 0 "[ . 1 . 2]" 1
1471 1 85 ALA HA 1 88 GLU HB2 4.390 . 4.390 3.008 2.804 3.247 . 0 0 "[ . 1 . 2]" 1
1472 1 85 ALA HA 1 88 GLU HB3 4.950 . 4.950 4.683 4.410 4.937 . 0 0 "[ . 1 . 2]" 1
1473 1 85 ALA HA 1 89 LEU H 4.260 . 4.260 3.972 3.816 4.101 . 0 0 "[ . 1 . 2]" 1
1474 1 85 ALA MB 1 86 ALA H 3.050 . 3.050 2.344 2.293 2.406 . 0 0 "[ . 1 . 2]" 1
1475 1 85 ALA MB 1 86 ALA MB 3.970 . 3.970 3.600 3.563 3.640 . 0 0 "[ . 1 . 2]" 1
1476 1 85 ALA MB 1 87 THR H 4.490 . 4.490 4.311 4.222 4.455 . 0 0 "[ . 1 . 2]" 1
1477 1 85 ALA MB 1 88 GLU H 5.500 . 5.500 4.697 4.661 4.753 . 0 0 "[ . 1 . 2]" 1
1478 1 85 ALA MB 1 89 LEU QB 5.340 . 5.340 4.388 3.997 4.751 . 0 0 "[ . 1 . 2]" 1
1479 1 85 ALA MB 1 89 LEU QD 4.980 . 4.980 3.037 2.731 3.567 . 0 0 "[ . 1 . 2]" 1
1480 1 85 ALA MB 1 107 LEU QD 5.440 . 5.440 4.141 3.899 4.661 . 0 0 "[ . 1 . 2]" 1
1481 1 86 ALA H 1 86 ALA MB 2.740 . 2.740 2.225 2.103 2.240 . 0 0 "[ . 1 . 2]" 1
1482 1 86 ALA H 1 87 THR H 3.020 . 3.020 2.618 2.577 2.678 . 0 0 "[ . 1 . 2]" 1
1483 1 86 ALA H 1 87 THR HB 4.970 . 4.970 4.839 4.716 4.947 . 0 0 "[ . 1 . 2]" 1
1484 1 86 ALA H 1 88 GLU H 4.660 . 4.660 4.337 4.207 4.467 . 0 0 "[ . 1 . 2]" 1
1485 1 86 ALA H 1 100 VAL QG 4.790 . 4.790 4.435 4.215 4.661 . 0 0 "[ . 1 . 2]" 1
1486 1 86 ALA H 1 101 SER HA 5.360 . 5.360 5.364 5.190 5.432 0.072 19 0 "[ . 1 . 2]" 1
1487 1 86 ALA H 1 102 VAL QG 4.140 . 4.140 3.647 3.261 4.166 0.026 2 0 "[ . 1 . 2]" 1
1488 1 86 ALA HA 1 88 GLU H 4.800 . 4.800 4.598 4.463 4.726 . 0 0 "[ . 1 . 2]" 1
1489 1 86 ALA HA 1 89 LEU H 3.910 . 3.910 3.538 3.418 3.697 . 0 0 "[ . 1 . 2]" 1
1490 1 86 ALA HA 1 89 LEU HB2 4.510 . 4.510 2.504 2.232 2.990 . 0 0 "[ . 1 . 2]" 1
1491 1 86 ALA HA 1 89 LEU QB 3.870 . 3.870 2.463 2.207 2.765 . 0 0 "[ . 1 . 2]" 1
1492 1 86 ALA HA 1 89 LEU HB3 4.510 . 4.510 3.791 3.256 4.274 . 0 0 "[ . 1 . 2]" 1
1493 1 86 ALA HA 1 89 LEU MD1 5.500 . 5.500 3.264 2.173 4.620 . 0 0 "[ . 1 . 2]" 1
1494 1 86 ALA HA 1 89 LEU QD 3.980 . 3.980 2.857 2.168 3.666 . 0 0 "[ . 1 . 2]" 1
1495 1 86 ALA HA 1 89 LEU MD2 5.500 . 5.500 3.983 2.920 4.986 . 0 0 "[ . 1 . 2]" 1
1496 1 86 ALA HA 1 90 SER H 4.380 . 4.380 3.831 3.712 4.007 . 0 0 "[ . 1 . 2]" 1
1497 1 86 ALA HA 1 100 VAL HB 4.220 . 4.220 3.591 3.196 3.921 . 0 0 "[ . 1 . 2]" 1
1498 1 86 ALA HA 1 100 VAL MG1 4.570 . 4.570 4.401 4.123 4.613 0.043 10 0 "[ . 1 . 2]" 1
1499 1 86 ALA HA 1 100 VAL QG 3.410 . 3.410 2.166 1.938 2.414 . 0 0 "[ . 1 . 2]" 1
1500 1 86 ALA HA 1 100 VAL MG2 4.570 . 4.570 2.172 1.942 2.422 . 0 0 "[ . 1 . 2]" 1
1501 1 86 ALA HA 1 102 VAL QG 5.180 . 5.180 4.606 4.170 5.208 0.028 2 0 "[ . 1 . 2]" 1
1502 1 86 ALA MB 1 87 THR H 3.070 . 3.070 2.654 2.476 2.767 . 0 0 "[ . 1 . 2]" 1
1503 1 86 ALA MB 1 87 THR HA 4.120 . 4.120 3.851 3.772 3.883 . 0 0 "[ . 1 . 2]" 1
1504 1 86 ALA MB 1 89 LEU QD 4.750 . 4.750 3.879 3.352 4.547 . 0 0 "[ . 1 . 2]" 1
1505 1 86 ALA MB 1 90 SER H 4.950 . 4.950 4.443 4.289 4.623 . 0 0 "[ . 1 . 2]" 1
1506 1 86 ALA MB 1 100 VAL HA 4.510 . 4.510 4.316 4.184 4.540 0.030 13 0 "[ . 1 . 2]" 1
1507 1 86 ALA MB 1 100 VAL HB 3.800 . 3.800 2.982 2.721 3.231 . 0 0 "[ . 1 . 2]" 1
1508 1 86 ALA MB 1 100 VAL QG 2.850 . 2.850 2.467 2.321 2.738 . 0 0 "[ . 1 . 2]" 1
1509 1 86 ALA MB 1 101 SER H 4.300 . 4.300 3.510 3.266 3.672 . 0 0 "[ . 1 . 2]" 1
1510 1 86 ALA MB 1 101 SER HA 3.370 . 3.370 2.148 2.094 2.221 . 0 0 "[ . 1 . 2]" 1
1511 1 86 ALA MB 1 101 SER QB 4.180 . 4.180 3.853 3.630 3.957 . 0 0 "[ . 1 . 2]" 1
1512 1 86 ALA MB 1 102 VAL H 3.950 . 3.950 3.111 2.696 3.389 . 0 0 "[ . 1 . 2]" 1
1513 1 86 ALA MB 1 102 VAL HA 4.750 . 4.750 4.382 4.171 4.571 . 0 0 "[ . 1 . 2]" 1
1514 1 86 ALA MB 1 102 VAL QG 2.930 . 2.930 2.282 1.946 2.666 . 0 0 "[ . 1 . 2]" 1
1515 1 86 ALA MB 1 107 LEU QD 3.320 . 3.320 2.950 2.454 3.321 0.001 17 0 "[ . 1 . 2]" 1
1516 1 87 THR H 1 87 THR HB 3.000 . 3.000 2.502 2.394 2.569 . 0 0 "[ . 1 . 2]" 1
1517 1 87 THR H 1 88 GLU H 3.150 . 3.150 2.677 2.624 2.732 . 0 0 "[ . 1 . 2]" 1
1518 1 87 THR H 1 88 GLU HA 5.490 . 5.490 5.282 5.248 5.317 . 0 0 "[ . 1 . 2]" 1
1519 1 87 THR H 1 88 GLU HB2 4.740 . 4.740 4.762 4.726 4.785 0.045 11 0 "[ . 1 . 2]" 1
1520 1 87 THR H 1 89 LEU H 4.300 . 4.300 4.008 3.877 4.132 . 0 0 "[ . 1 . 2]" 1
1521 1 87 THR HA 1 87 THR MG 2.790 . 2.790 2.406 2.341 2.499 . 0 0 "[ . 1 . 2]" 1
1522 1 87 THR HA 1 89 LEU H 4.820 . 4.820 4.555 4.453 4.733 . 0 0 "[ . 1 . 2]" 1
1523 1 87 THR HA 1 90 SER H 3.940 . 3.940 3.817 3.659 3.942 0.002 2 0 "[ . 1 . 2]" 1
1524 1 87 THR HA 1 91 ALA H 5.040 . 5.040 4.534 4.334 4.817 . 0 0 "[ . 1 . 2]" 1
1525 1 87 THR HB 1 88 GLU H 3.270 . 3.270 2.452 2.367 2.555 . 0 0 "[ . 1 . 2]" 1
1526 1 87 THR HB 1 88 GLU HA 4.510 . 4.510 4.278 4.188 4.408 . 0 0 "[ . 1 . 2]" 1
1527 1 87 THR HB 1 89 LEU H 5.500 . 5.500 4.891 4.813 4.963 . 0 0 "[ . 1 . 2]" 1
1528 1 87 THR MG 1 88 GLU H 3.730 . 3.730 3.336 3.138 3.481 . 0 0 "[ . 1 . 2]" 1
1529 1 87 THR MG 1 88 GLU HA 3.610 . 3.610 3.433 3.246 3.564 . 0 0 "[ . 1 . 2]" 1
1530 1 87 THR MG 1 88 GLU HG2 4.220 . 4.220 3.746 3.260 4.068 . 0 0 "[ . 1 . 2]" 1
1531 1 87 THR MG 1 88 GLU HG3 4.240 . 4.240 4.136 3.765 4.291 0.051 8 0 "[ . 1 . 2]" 1
1532 1 87 THR MG 1 90 SER H 5.430 . 5.430 5.062 4.945 5.139 . 0 0 "[ . 1 . 2]" 1
1533 1 87 THR MG 1 91 ALA MB 4.340 . 4.340 3.708 3.465 4.008 . 0 0 "[ . 1 . 2]" 1
1534 1 88 GLU H 1 88 GLU HB2 3.220 . 3.220 2.401 2.319 2.461 . 0 0 "[ . 1 . 2]" 1
1535 1 88 GLU H 1 88 GLU HB3 3.810 . 3.810 3.578 3.560 3.588 . 0 0 "[ . 1 . 2]" 1
1536 1 88 GLU H 1 88 GLU HG2 3.600 . 3.600 3.191 2.824 3.445 . 0 0 "[ . 1 . 2]" 1
1537 1 88 GLU H 1 88 GLU HG3 3.210 . 3.210 2.549 2.389 2.883 . 0 0 "[ . 1 . 2]" 1
1538 1 88 GLU H 1 89 LEU H 3.230 . 3.230 2.616 2.512 2.707 . 0 0 "[ . 1 . 2]" 1
1539 1 88 GLU H 1 90 SER H 4.450 . 4.450 4.330 4.239 4.421 . 0 0 "[ . 1 . 2]" 1
1540 1 88 GLU HA 1 88 GLU HG2 3.730 . 3.730 2.335 2.266 2.405 . 0 0 "[ . 1 . 2]" 1
1541 1 88 GLU HA 1 88 GLU HG3 3.920 . 3.920 3.317 3.135 3.530 . 0 0 "[ . 1 . 2]" 1
1542 1 88 GLU HA 1 91 ALA H 3.790 . 3.790 3.473 3.339 3.632 . 0 0 "[ . 1 . 2]" 1
1543 1 88 GLU HA 1 91 ALA MB 3.700 . 3.700 2.682 2.553 2.881 . 0 0 "[ . 1 . 2]" 1
1544 1 88 GLU HA 1 92 VAL QG 5.440 . 5.440 4.401 3.868 4.925 . 0 0 "[ . 1 . 2]" 1
1545 1 88 GLU HB2 1 89 LEU H 3.490 . 3.490 2.664 2.526 2.766 . 0 0 "[ . 1 . 2]" 1
1546 1 88 GLU HB2 1 89 LEU HA 5.050 . 5.050 4.378 4.258 4.506 . 0 0 "[ . 1 . 2]" 1
1547 1 88 GLU HB2 1 89 LEU QD 4.350 . 4.350 3.768 3.143 4.353 0.003 9 0 "[ . 1 . 2]" 1
1548 1 88 GLU HB2 1 90 SER H 5.480 . 5.480 5.261 5.166 5.347 . 0 0 "[ . 1 . 2]" 1
1549 1 88 GLU HB2 1 91 ALA H 5.500 . 5.500 5.488 5.411 5.566 0.066 1 0 "[ . 1 . 2]" 1
1550 1 88 GLU HG2 1 89 LEU H 4.930 . 4.930 4.845 4.702 4.944 0.014 17 0 "[ . 1 . 2]" 1
1551 1 88 GLU HG2 1 91 ALA MB 4.770 . 4.770 4.353 4.151 4.601 . 0 0 "[ . 1 . 2]" 1
1552 1 88 GLU HG3 1 89 LEU H 4.770 . 4.770 4.441 4.274 4.612 . 0 0 "[ . 1 . 2]" 1
1553 1 89 LEU H 1 89 LEU HB2 3.570 . 3.570 2.205 2.069 2.406 . 0 0 "[ . 1 . 2]" 1
1554 1 89 LEU H 1 89 LEU HB3 3.570 . 3.570 3.448 3.056 3.583 0.013 4 0 "[ . 1 . 2]" 1
1555 1 89 LEU H 1 89 LEU MD1 4.100 . 4.100 3.255 2.617 4.152 0.052 6 0 "[ . 1 . 2]" 1
1556 1 89 LEU H 1 89 LEU MD2 4.100 . 4.100 3.779 2.513 4.176 0.076 7 0 "[ . 1 . 2]" 1
1557 1 89 LEU H 1 89 LEU HG 4.350 . 4.350 3.462 2.447 4.447 0.097 7 0 "[ . 1 . 2]" 1
1558 1 89 LEU H 1 90 SER H 3.180 . 3.180 2.793 2.712 2.921 . 0 0 "[ . 1 . 2]" 1
1559 1 89 LEU H 1 90 SER QB 5.500 . 5.500 4.911 4.695 5.208 . 0 0 "[ . 1 . 2]" 1
1560 1 89 LEU H 1 91 ALA H 4.370 . 4.370 3.999 3.915 4.094 . 0 0 "[ . 1 . 2]" 1
1561 1 89 LEU HA 1 89 LEU MD1 3.860 . 3.860 3.013 2.097 3.864 0.004 4 0 "[ . 1 . 2]" 1
1562 1 89 LEU HA 1 89 LEU QD 3.310 . 3.310 2.153 1.838 2.511 . 0 0 "[ . 1 . 2]" 1
1563 1 89 LEU HA 1 89 LEU MD2 3.860 . 3.860 2.866 1.918 3.782 . 0 0 "[ . 1 . 2]" 1
1564 1 89 LEU HA 1 92 VAL H 3.780 . 3.780 3.609 3.531 3.742 . 0 0 "[ . 1 . 2]" 1
1565 1 89 LEU HA 1 92 VAL HB 4.790 . 4.790 4.163 3.297 4.880 0.090 3 0 "[ . 1 . 2]" 1
1566 1 89 LEU HA 1 92 VAL MG1 4.900 . 4.900 3.624 2.300 4.962 0.062 14 0 "[ . 1 . 2]" 1
1567 1 89 LEU HA 1 92 VAL QG 3.390 . 3.390 2.783 2.296 3.420 0.030 6 0 "[ . 1 . 2]" 1
1568 1 89 LEU HA 1 92 VAL MG2 4.900 . 4.900 4.107 2.998 5.089 0.189 20 0 "[ . 1 . 2]" 1
1569 1 89 LEU HA 1 93 TYR H 4.530 . 4.530 3.967 3.795 4.144 . 0 0 "[ . 1 . 2]" 1
1570 1 89 LEU QB 1 89 LEU QD 2.820 . 2.820 1.936 1.906 2.051 . 0 0 "[ . 1 . 2]" 1
1571 1 89 LEU QB 1 92 VAL QG 5.280 . 5.280 4.277 3.720 4.849 . 0 0 "[ . 1 . 2]" 1
1572 1 89 LEU QB 1 100 VAL QG 3.290 . 3.290 1.909 1.805 2.014 . 0 0 "[ . 1 . 2]" 1
1573 1 89 LEU HB2 1 89 LEU MD1 3.670 . 3.670 2.368 2.265 3.150 . 0 0 "[ . 1 . 2]" 1
1574 1 89 LEU HB2 1 89 LEU MD2 3.670 . 3.670 2.780 2.339 3.197 . 0 0 "[ . 1 . 2]" 1
1575 1 89 LEU HB2 1 90 SER H 3.710 . 3.710 2.696 2.409 3.251 . 0 0 "[ . 1 . 2]" 1
1576 1 89 LEU HB2 1 100 VAL MG1 4.460 . 4.460 4.330 3.904 4.545 0.085 7 0 "[ . 1 . 2]" 1
1577 1 89 LEU HB2 1 100 VAL MG2 4.460 . 4.460 2.287 1.955 2.702 . 0 0 "[ . 1 . 2]" 1
1578 1 89 LEU HB3 1 89 LEU MD1 3.670 . 3.670 2.765 2.233 3.201 . 0 0 "[ . 1 . 2]" 1
1579 1 89 LEU HB3 1 89 LEU MD2 3.670 . 3.670 2.354 2.216 3.183 . 0 0 "[ . 1 . 2]" 1
1580 1 89 LEU HB3 1 90 SER H 3.710 . 3.710 2.998 2.494 3.324 . 0 0 "[ . 1 . 2]" 1
1581 1 89 LEU HB3 1 100 VAL MG1 4.460 . 4.460 3.669 3.392 3.868 . 0 0 "[ . 1 . 2]" 1
1582 1 89 LEU HB3 1 100 VAL MG2 4.460 . 4.460 2.149 1.857 2.485 . 0 0 "[ . 1 . 2]" 1
1583 1 89 LEU QD 1 92 VAL QG 3.730 . 3.730 3.552 2.919 3.823 0.093 13 0 "[ . 1 . 2]" 1
1584 1 89 LEU QD 1 93 TYR HD2 4.640 . 4.640 4.080 3.623 4.473 . 0 0 "[ . 1 . 2]" 1
1585 1 89 LEU QD 1 93 TYR HE1 4.710 . 4.710 3.842 3.191 4.706 . 0 0 "[ . 1 . 2]" 1
1586 1 89 LEU QD 1 93 TYR HE2 3.880 . 3.880 3.488 2.185 3.953 0.073 11 0 "[ . 1 . 2]" 1
1587 1 89 LEU QD 1 100 VAL HB 4.590 . 4.590 3.870 3.600 4.702 0.112 6 0 "[ . 1 . 2]" 1
1588 1 89 LEU QD 1 100 VAL QG 4.160 . 4.160 2.159 1.851 2.639 . 0 0 "[ . 1 . 2]" 1
1589 1 89 LEU HG 1 100 VAL QG 5.440 . 5.440 3.652 2.754 3.886 . 0 0 "[ . 1 . 2]" 1
1590 1 90 SER H 1 90 SER QB 3.440 . 3.440 2.568 2.404 2.787 . 0 0 "[ . 1 . 2]" 1
1591 1 90 SER H 1 91 ALA H 3.310 . 3.310 2.705 2.632 2.747 . 0 0 "[ . 1 . 2]" 1
1592 1 90 SER H 1 91 ALA HA 5.240 . 5.240 5.272 5.216 5.306 0.066 17 0 "[ . 1 . 2]" 1
1593 1 90 SER H 1 92 VAL H 4.530 . 4.530 4.408 4.250 4.548 0.018 15 0 "[ . 1 . 2]" 1
1594 1 90 SER H 1 92 VAL QG 5.440 . 5.440 4.754 4.453 5.133 . 0 0 "[ . 1 . 2]" 1
1595 1 90 SER H 1 100 VAL HB 5.500 . 5.500 5.438 5.155 5.560 0.060 2 0 "[ . 1 . 2]" 1
1596 1 90 SER H 1 100 VAL MG1 4.940 . 4.940 4.970 4.805 5.002 0.062 3 0 "[ . 1 . 2]" 1
1597 1 90 SER H 1 100 VAL MG2 4.940 . 4.940 2.668 2.484 2.741 . 0 0 "[ . 1 . 2]" 1
1598 1 90 SER HA 1 93 TYR H 4.700 . 4.700 3.328 3.117 3.598 . 0 0 "[ . 1 . 2]" 1
1599 1 90 SER HA 1 94 ALA H 4.510 . 4.510 3.540 3.317 3.696 . 0 0 "[ . 1 . 2]" 1
1600 1 90 SER HA 1 98 VAL QG 5.090 . 5.090 4.258 3.992 4.415 . 0 0 "[ . 1 . 2]" 1
1601 1 90 SER HA 1 99 SER H 5.500 . 5.500 5.339 5.132 5.505 0.005 10 0 "[ . 1 . 2]" 1
1602 1 90 SER HA 1 100 VAL H 4.120 . 4.120 3.039 2.640 3.320 . 0 0 "[ . 1 . 2]" 1
1603 1 90 SER HA 1 100 VAL QG 4.180 . 4.180 3.032 2.622 3.324 . 0 0 "[ . 1 . 2]" 1
1604 1 90 SER QB 1 91 ALA H 3.680 . 3.680 3.037 2.724 3.612 . 0 0 "[ . 1 . 2]" 1
1605 1 90 SER QB 1 99 SER QB 5.220 . 5.220 3.418 2.867 4.243 . 0 0 "[ . 1 . 2]" 1
1606 1 90 SER QB 1 100 VAL H 4.630 . 4.630 2.726 1.792 3.267 . 0 0 "[ . 1 . 2]" 1
1607 1 91 ALA H 1 91 ALA MB 2.810 . 2.810 2.240 2.223 2.268 . 0 0 "[ . 1 . 2]" 1
1608 1 91 ALA H 1 92 VAL H 3.220 . 3.220 2.631 2.491 2.709 . 0 0 "[ . 1 . 2]" 1
1609 1 91 ALA H 1 92 VAL HB 5.500 . 5.500 5.174 4.873 5.406 . 0 0 "[ . 1 . 2]" 1
1610 1 91 ALA H 1 92 VAL QG 4.400 . 4.400 3.799 3.684 3.980 . 0 0 "[ . 1 . 2]" 1
1611 1 91 ALA H 1 93 TYR H 4.300 . 4.300 3.875 3.679 4.206 . 0 0 "[ . 1 . 2]" 1
1612 1 91 ALA MB 1 92 VAL H 3.180 . 3.180 2.527 2.392 2.638 . 0 0 "[ . 1 . 2]" 1
1613 1 91 ALA MB 1 92 VAL HA 4.200 . 4.200 3.893 3.848 3.928 . 0 0 "[ . 1 . 2]" 1
1614 1 91 ALA MB 1 92 VAL HB 4.650 . 4.650 4.220 3.662 4.708 0.058 12 0 "[ . 1 . 2]" 1
1615 1 91 ALA MB 1 92 VAL MG1 5.020 . 5.020 4.177 3.461 4.868 . 0 0 "[ . 1 . 2]" 1
1616 1 91 ALA MB 1 92 VAL QG 3.610 . 3.610 3.124 2.643 3.666 0.056 10 0 "[ . 1 . 2]" 1
1617 1 91 ALA MB 1 92 VAL MG2 5.020 . 5.020 3.761 2.657 4.855 . 0 0 "[ . 1 . 2]" 1
1618 1 91 ALA MB 1 93 TYR H 4.630 . 4.630 4.400 4.236 4.635 0.005 6 0 "[ . 1 . 2]" 1
1619 1 92 VAL H 1 92 VAL HB 3.120 . 3.120 2.725 2.544 2.877 . 0 0 "[ . 1 . 2]" 1
1620 1 92 VAL H 1 92 VAL MG1 3.910 . 3.910 2.905 1.830 3.812 . 0 0 "[ . 1 . 2]" 1
1621 1 92 VAL H 1 92 VAL QG 2.840 . 2.840 1.997 1.826 2.127 . 0 0 "[ . 1 . 2]" 1
1622 1 92 VAL H 1 92 VAL MG2 3.910 . 3.910 2.891 1.871 3.819 . 0 0 "[ . 1 . 2]" 1
1623 1 92 VAL H 1 94 ALA H 4.490 . 4.490 3.881 3.766 3.998 . 0 0 "[ . 1 . 2]" 1
1624 1 92 VAL HA 1 94 ALA H 4.690 . 4.690 4.149 4.037 4.309 . 0 0 "[ . 1 . 2]" 1
1625 1 92 VAL HB 1 93 TYR H 4.170 . 4.170 3.326 2.359 4.101 . 0 0 "[ . 1 . 2]" 1
1626 1 92 VAL HB 1 93 TYR HD1 4.740 . 4.740 3.578 2.461 4.509 . 0 0 "[ . 1 . 2]" 1
1627 1 92 VAL HB 1 93 TYR HE1 5.500 . 5.500 4.760 3.779 5.619 0.119 4 0 "[ . 1 . 2]" 1
1628 1 92 VAL QG 1 93 TYR H 3.760 . 3.760 2.700 1.905 3.340 . 0 0 "[ . 1 . 2]" 1
1629 1 92 VAL QG 1 93 TYR HA 4.410 . 4.410 3.449 3.055 3.855 . 0 0 "[ . 1 . 2]" 1
1630 1 92 VAL QG 1 93 TYR HD1 4.200 . 4.200 2.448 1.755 3.330 . 0 0 "[ . 1 . 2]" 1
1631 1 92 VAL QG 1 93 TYR HE1 4.010 . 4.010 3.239 2.568 3.927 . 0 0 "[ . 1 . 2]" 1
1632 1 92 VAL MG1 1 93 TYR H 4.310 . 4.310 2.959 1.913 3.875 . 0 0 "[ . 1 . 2]" 1
1633 1 92 VAL MG1 1 93 TYR HD1 4.840 . 4.840 2.498 1.760 3.436 . 0 0 "[ . 1 . 2]" 1
1634 1 92 VAL MG1 1 93 TYR HE1 4.960 . 4.960 3.358 2.609 4.133 . 0 0 "[ . 1 . 2]" 1
1635 1 92 VAL MG2 1 93 TYR H 4.310 . 4.310 3.628 3.382 4.001 . 0 0 "[ . 1 . 2]" 1
1636 1 92 VAL MG2 1 93 TYR HD1 4.840 . 4.840 3.675 2.525 4.612 . 0 0 "[ . 1 . 2]" 1
1637 1 92 VAL MG2 1 93 TYR HE1 4.960 . 4.960 4.366 3.388 5.011 0.051 17 0 "[ . 1 . 2]" 1
1638 1 93 TYR H 1 93 TYR HB2 3.440 . 3.440 2.221 2.168 2.354 . 0 0 "[ . 1 . 2]" 1
1639 1 93 TYR H 1 93 TYR HB3 3.880 . 3.880 3.506 3.474 3.555 . 0 0 "[ . 1 . 2]" 1
1640 1 93 TYR H 1 93 TYR HD1 4.130 . 4.130 2.667 2.408 2.950 . 0 0 "[ . 1 . 2]" 1
1641 1 93 TYR H 1 94 ALA H 3.170 . 3.170 2.564 2.437 2.733 . 0 0 "[ . 1 . 2]" 1
1642 1 93 TYR H 1 94 ALA MB 4.890 . 4.890 4.246 4.096 4.413 . 0 0 "[ . 1 . 2]" 1
1643 1 93 TYR H 1 98 VAL HB 5.500 . 5.500 5.365 5.259 5.479 . 0 0 "[ . 1 . 2]" 1
1644 1 93 TYR HA 1 93 TYR HD1 4.340 . 4.340 2.277 1.885 3.050 . 0 0 "[ . 1 . 2]" 1
1645 1 93 TYR HA 1 95 ALA H 4.250 . 4.250 3.867 3.496 4.257 0.007 19 0 "[ . 1 . 2]" 1
1646 1 93 TYR HA 1 96 GLN H 4.340 . 4.340 3.263 2.986 3.470 . 0 0 "[ . 1 . 2]" 1
1647 1 93 TYR HA 1 98 VAL MG1 5.070 . 5.070 4.915 4.473 5.093 0.023 6 0 "[ . 1 . 2]" 1
1648 1 93 TYR HA 1 98 VAL QG 4.410 . 4.410 4.288 4.029 4.432 0.022 2 0 "[ . 1 . 2]" 1
1649 1 93 TYR HA 1 98 VAL MG2 5.070 . 5.070 4.729 4.530 4.947 . 0 0 "[ . 1 . 2]" 1
1650 1 93 TYR HB2 1 94 ALA H 4.290 . 4.290 3.193 2.979 3.313 . 0 0 "[ . 1 . 2]" 1
1651 1 93 TYR HB2 1 98 VAL H 4.860 . 4.860 4.626 4.382 4.855 . 0 0 "[ . 1 . 2]" 1
1652 1 93 TYR HB2 1 98 VAL HB 4.740 . 4.740 3.578 3.427 3.676 . 0 0 "[ . 1 . 2]" 1
1653 1 93 TYR HB2 1 98 VAL MG1 5.290 . 5.290 3.668 3.433 3.867 . 0 0 "[ . 1 . 2]" 1
1654 1 93 TYR HB2 1 98 VAL QG 4.250 . 4.250 3.581 3.381 3.757 . 0 0 "[ . 1 . 2]" 1
1655 1 93 TYR HB2 1 98 VAL MG2 5.290 . 5.290 5.023 4.893 5.107 . 0 0 "[ . 1 . 2]" 1
1656 1 93 TYR HB3 1 93 TYR HE2 5.010 . 5.010 4.700 4.604 4.855 . 0 0 "[ . 1 . 2]" 1
1657 1 93 TYR HB3 1 94 ALA H 4.720 . 4.720 3.727 3.674 3.810 . 0 0 "[ . 1 . 2]" 1
1658 1 93 TYR HB3 1 96 GLN QB 4.450 . 4.450 3.747 3.521 4.004 . 0 0 "[ . 1 . 2]" 1
1659 1 93 TYR HB3 1 98 VAL H 4.100 . 4.100 3.210 3.018 3.378 . 0 0 "[ . 1 . 2]" 1
1660 1 93 TYR HB3 1 98 VAL HB 4.690 . 4.690 1.891 1.803 1.983 . 0 0 "[ . 1 . 2]" 1
1661 1 93 TYR HB3 1 98 VAL MG1 4.640 . 4.640 2.844 2.517 2.995 . 0 0 "[ . 1 . 2]" 1
1662 1 93 TYR HB3 1 98 VAL MG2 4.640 . 4.640 3.613 3.509 3.697 . 0 0 "[ . 1 . 2]" 1
1663 1 93 TYR HD2 1 98 VAL MG1 4.930 . 4.930 2.124 1.935 2.398 . 0 0 "[ . 1 . 2]" 1
1664 1 93 TYR HD2 1 98 VAL MG2 4.930 . 4.930 3.497 2.928 4.619 . 0 0 "[ . 1 . 2]" 1
1665 1 93 TYR HD2 1 100 VAL QG 5.040 . 5.040 3.272 2.161 3.867 . 0 0 "[ . 1 . 2]" 1
1666 1 93 TYR HD2 1 109 VAL MG1 4.810 . 4.810 4.373 3.905 4.711 . 0 0 "[ . 1 . 2]" 1
1667 1 93 TYR HE2 1 98 VAL MG1 5.500 . 5.500 3.446 3.182 3.805 . 0 0 "[ . 1 . 2]" 1
1668 1 93 TYR HE2 1 98 VAL MG2 5.500 . 5.500 4.468 3.907 5.547 0.047 13 0 "[ . 1 . 2]" 1
1669 1 93 TYR HE2 1 100 VAL MG1 5.220 . 5.220 4.138 2.495 4.661 . 0 0 "[ . 1 . 2]" 1
1670 1 93 TYR HE2 1 100 VAL QG 4.420 . 4.420 3.912 2.420 4.359 . 0 0 "[ . 1 . 2]" 1
1671 1 93 TYR HE2 1 100 VAL MG2 5.220 . 5.220 4.830 3.132 5.309 0.089 20 0 "[ . 1 . 2]" 1
1672 1 94 ALA H 1 94 ALA MB 2.800 . 2.800 2.222 2.176 2.249 . 0 0 "[ . 1 . 2]" 1
1673 1 94 ALA H 1 95 ALA H 3.350 . 3.350 2.851 2.725 3.000 . 0 0 "[ . 1 . 2]" 1
1674 1 94 ALA H 1 95 ALA MB 4.620 . 4.620 4.519 4.381 4.629 0.009 19 0 "[ . 1 . 2]" 1
1675 1 94 ALA H 1 96 GLN H 4.300 . 4.300 4.148 4.022 4.357 0.057 4 0 "[ . 1 . 2]" 1
1676 1 94 ALA H 1 98 VAL HB 5.230 . 5.230 5.270 5.228 5.319 0.089 19 0 "[ . 1 . 2]" 1
1677 1 94 ALA HA 1 96 GLN H 4.500 . 4.500 3.942 3.644 4.363 . 0 0 "[ . 1 . 2]" 1
1678 1 94 ALA HA 1 97 GLY H 3.630 . 3.630 3.310 2.927 3.476 . 0 0 "[ . 1 . 2]" 1
1679 1 94 ALA HA 1 98 VAL H 3.810 . 3.810 3.026 2.739 3.276 . 0 0 "[ . 1 . 2]" 1
1680 1 94 ALA HA 1 112 VAL MG2 4.130 . 4.130 2.574 2.261 2.871 . 0 0 "[ . 1 . 2]" 1
1681 1 94 ALA HA 1 114 VAL MG1 5.080 . 5.080 4.292 3.810 4.987 . 0 0 "[ . 1 . 2]" 1
1682 1 94 ALA MB 1 95 ALA H 3.130 . 3.130 2.681 2.389 2.927 . 0 0 "[ . 1 . 2]" 1
1683 1 94 ALA MB 1 95 ALA HA 3.870 . 3.870 3.856 3.795 3.929 0.059 2 0 "[ . 1 . 2]" 1
1684 1 94 ALA MB 1 97 GLY H 4.610 . 4.610 4.381 4.241 4.459 . 0 0 "[ . 1 . 2]" 1
1685 1 94 ALA MB 1 99 SER HA 4.870 . 4.870 4.689 4.326 4.895 0.025 18 0 "[ . 1 . 2]" 1
1686 1 94 ALA MB 1 112 VAL MG1 4.170 . 4.170 4.138 3.863 4.239 0.069 9 0 "[ . 1 . 2]" 1
1687 1 94 ALA MB 1 112 VAL MG2 3.970 . 3.970 3.134 2.908 3.541 . 0 0 "[ . 1 . 2]" 1
1688 1 95 ALA H 1 95 ALA MB 2.710 . 2.710 2.238 2.213 2.258 . 0 0 "[ . 1 . 2]" 1
1689 1 95 ALA H 1 96 GLN H 3.310 . 3.310 2.553 2.430 2.642 . 0 0 "[ . 1 . 2]" 1
1690 1 95 ALA H 1 96 GLN QB 4.790 . 4.790 4.551 4.279 4.806 0.016 5 0 "[ . 1 . 2]" 1
1691 1 95 ALA H 1 97 GLY H 4.240 . 4.240 3.896 3.701 4.029 . 0 0 "[ . 1 . 2]" 1
1692 1 95 ALA HA 1 114 VAL HB 5.500 . 5.500 4.401 3.095 5.420 . 0 0 "[ . 1 . 2]" 1
1693 1 95 ALA HA 1 114 VAL MG1 5.050 . 5.050 4.196 2.705 5.053 0.003 9 0 "[ . 1 . 2]" 1
1694 1 95 ALA HA 1 114 VAL MG2 4.740 . 4.740 3.557 2.834 4.332 . 0 0 "[ . 1 . 2]" 1
1695 1 95 ALA MB 1 96 GLN H 4.000 . 4.000 2.900 2.560 3.146 . 0 0 "[ . 1 . 2]" 1
1696 1 95 ALA MB 1 96 GLN HA 4.110 . 4.110 3.981 3.878 4.104 . 0 0 "[ . 1 . 2]" 1
1697 1 95 ALA MB 1 96 GLN HE21 4.730 . 4.730 3.711 2.642 4.762 0.032 5 0 "[ . 1 . 2]" 1
1698 1 95 ALA MB 1 96 GLN QE 4.020 . 4.020 3.059 2.342 3.981 . 0 0 "[ . 1 . 2]" 1
1699 1 95 ALA MB 1 96 GLN HE22 4.730 . 4.730 3.559 2.412 4.418 . 0 0 "[ . 1 . 2]" 1
1700 1 95 ALA MB 1 96 GLN QG 4.470 . 4.470 3.688 3.005 4.446 . 0 0 "[ . 1 . 2]" 1
1701 1 95 ALA MB 1 97 GLY H 4.560 . 4.560 4.367 4.222 4.523 . 0 0 "[ . 1 . 2]" 1
1702 1 96 GLN H 1 96 GLN QB 3.650 . 3.650 2.380 2.172 2.708 . 0 0 "[ . 1 . 2]" 1
1703 1 96 GLN H 1 96 GLN QG 3.850 . 3.850 3.104 2.045 3.768 . 0 0 "[ . 1 . 2]" 1
1704 1 96 GLN H 1 97 GLY H 3.060 . 3.060 2.233 2.060 2.410 . 0 0 "[ . 1 . 2]" 1
1705 1 96 GLN H 1 98 VAL H 4.300 . 4.300 3.452 3.188 3.839 . 0 0 "[ . 1 . 2]" 1
1706 1 96 GLN H 1 98 VAL QG 5.140 . 5.140 4.573 4.401 4.780 . 0 0 "[ . 1 . 2]" 1
1707 1 96 GLN HA 1 96 GLN QG 3.600 . 3.600 2.640 2.308 3.209 . 0 0 "[ . 1 . 2]" 1
1708 1 96 GLN QB 1 97 GLY H 4.350 . 4.350 3.183 2.895 3.430 . 0 0 "[ . 1 . 2]" 1
1709 1 96 GLN QB 1 97 GLY HA2 5.500 . 5.500 4.869 4.719 4.996 . 0 0 "[ . 1 . 2]" 1
1710 1 96 GLN QB 1 97 GLY QA 4.620 . 4.620 4.078 3.945 4.218 . 0 0 "[ . 1 . 2]" 1
1711 1 96 GLN QB 1 97 GLY HA3 5.500 . 5.500 4.377 4.230 4.546 . 0 0 "[ . 1 . 2]" 1
1712 1 96 GLN QB 1 98 VAL H 4.390 . 4.390 3.324 3.073 3.519 . 0 0 "[ . 1 . 2]" 1
1713 1 96 GLN QB 1 98 VAL QG 4.590 . 4.590 2.846 2.616 3.057 . 0 0 "[ . 1 . 2]" 1
1714 1 96 GLN QG 1 97 GLY H 5.040 . 5.040 4.533 3.924 4.907 . 0 0 "[ . 1 . 2]" 1
1715 1 97 GLY H 1 98 VAL H 3.110 . 3.110 2.265 2.090 2.492 . 0 0 "[ . 1 . 2]" 1
1716 1 97 GLY H 1 98 VAL HB 4.810 . 4.810 4.608 4.279 4.823 0.013 18 0 "[ . 1 . 2]" 1
1717 1 97 GLY H 1 98 VAL QG 4.430 . 4.430 3.973 3.782 4.166 . 0 0 "[ . 1 . 2]" 1
1718 1 97 GLY H 1 112 VAL H 5.500 . 5.500 5.130 4.790 5.341 . 0 0 "[ . 1 . 2]" 1
1719 1 97 GLY H 1 112 VAL MG2 4.290 . 4.290 3.414 3.168 3.649 . 0 0 "[ . 1 . 2]" 1
1720 1 97 GLY H 1 114 VAL MG2 4.060 . 4.060 2.856 2.469 3.322 . 0 0 "[ . 1 . 2]" 1
1721 1 97 GLY QA 1 112 VAL HB 5.340 . 5.340 4.244 4.110 4.413 . 0 0 "[ . 1 . 2]" 1
1722 1 97 GLY QA 1 112 VAL MG2 3.000 . 3.000 1.953 1.858 2.101 . 0 0 "[ . 1 . 2]" 1
1723 1 97 GLY QA 1 114 VAL MG1 3.940 . 3.940 3.608 3.013 3.981 0.041 5 0 "[ . 1 . 2]" 1
1724 1 97 GLY QA 1 114 VAL MG2 4.010 . 4.010 1.978 1.878 2.089 . 0 0 "[ . 1 . 2]" 1
1725 1 97 GLY HA2 1 112 VAL H 4.300 . 4.300 3.219 2.844 3.474 . 0 0 "[ . 1 . 2]" 1
1726 1 97 GLY HA2 1 112 VAL MG2 3.510 . 3.510 1.966 1.868 2.118 . 0 0 "[ . 1 . 2]" 1
1727 1 97 GLY HA2 1 114 VAL MG2 4.720 . 4.720 2.028 1.911 2.129 . 0 0 "[ . 1 . 2]" 1
1728 1 97 GLY HA3 1 112 VAL H 4.300 . 4.300 3.770 3.563 4.082 . 0 0 "[ . 1 . 2]" 1
1729 1 97 GLY HA3 1 112 VAL MG2 3.510 . 3.510 3.332 3.134 3.513 0.003 19 0 "[ . 1 . 2]" 1
1730 1 97 GLY HA3 1 114 VAL MG2 4.720 . 4.720 2.800 2.216 3.028 . 0 0 "[ . 1 . 2]" 1
1731 1 98 VAL H 1 98 VAL HB 3.160 . 3.160 2.681 2.635 2.728 . 0 0 "[ . 1 . 2]" 1
1732 1 98 VAL H 1 98 VAL MG1 4.100 . 4.100 3.864 3.834 3.896 . 0 0 "[ . 1 . 2]" 1
1733 1 98 VAL H 1 98 VAL QG 3.210 . 3.210 2.785 2.697 2.868 . 0 0 "[ . 1 . 2]" 1
1734 1 98 VAL H 1 98 VAL MG2 4.100 . 4.100 2.857 2.750 2.959 . 0 0 "[ . 1 . 2]" 1
1735 1 98 VAL H 1 99 SER H 4.430 . 4.430 4.366 4.282 4.425 . 0 0 "[ . 1 . 2]" 1
1736 1 98 VAL H 1 112 VAL MG1 5.050 . 5.050 5.055 4.664 5.136 0.086 10 0 "[ . 1 . 2]" 1
1737 1 98 VAL H 1 112 VAL MG2 4.200 . 4.200 3.032 2.804 3.177 . 0 0 "[ . 1 . 2]" 1
1738 1 98 VAL HA 1 99 SER H 2.870 . 2.870 2.186 2.139 2.258 . 0 0 "[ . 1 . 2]" 1
1739 1 98 VAL HA 1 109 VAL MG1 4.680 . 4.680 4.204 3.899 4.526 . 0 0 "[ . 1 . 2]" 1
1740 1 98 VAL HA 1 111 PRO HA 4.260 . 4.260 2.421 2.249 2.606 . 0 0 "[ . 1 . 2]" 1
1741 1 98 VAL HA 1 112 VAL H 4.150 . 4.150 3.238 3.014 3.420 . 0 0 "[ . 1 . 2]" 1
1742 1 98 VAL HA 1 112 VAL MG2 4.160 . 4.160 3.263 3.125 3.393 . 0 0 "[ . 1 . 2]" 1
1743 1 98 VAL QG 1 99 SER H 3.350 . 3.350 2.464 2.293 2.700 . 0 0 "[ . 1 . 2]" 1
1744 1 98 VAL QG 1 99 SER HA 5.000 . 5.000 3.358 3.211 3.530 . 0 0 "[ . 1 . 2]" 1
1745 1 98 VAL QG 1 100 VAL H 4.440 . 4.440 3.813 3.293 4.220 . 0 0 "[ . 1 . 2]" 1
1746 1 98 VAL QG 1 100 VAL HA 5.180 . 5.180 4.325 4.042 4.583 . 0 0 "[ . 1 . 2]" 1
1747 1 98 VAL QG 1 100 VAL QG 3.120 . 3.120 2.424 2.193 2.665 . 0 0 "[ . 1 . 2]" 1
1748 1 98 VAL QG 1 109 VAL MG1 3.000 . 3.000 2.222 2.041 2.438 . 0 0 "[ . 1 . 2]" 1
1749 1 98 VAL QG 1 109 VAL MG2 4.740 . 4.740 4.075 3.859 4.214 . 0 0 "[ . 1 . 2]" 1
1750 1 98 VAL QG 1 111 PRO HA 5.410 . 5.410 3.344 3.195 3.509 . 0 0 "[ . 1 . 2]" 1
1751 1 98 VAL MG1 1 99 SER H 4.390 . 4.390 2.490 2.310 2.740 . 0 0 "[ . 1 . 2]" 1
1752 1 98 VAL MG2 1 99 SER H 4.390 . 4.390 3.935 3.825 4.068 . 0 0 "[ . 1 . 2]" 1
1753 1 99 SER H 1 99 SER QB 3.280 . 3.280 2.578 2.428 2.673 . 0 0 "[ . 1 . 2]" 1
1754 1 99 SER H 1 100 VAL H 4.430 . 4.430 4.194 3.934 4.339 . 0 0 "[ . 1 . 2]" 1
1755 1 99 SER H 1 109 VAL HA 4.860 . 4.860 4.545 4.294 4.767 . 0 0 "[ . 1 . 2]" 1
1756 1 99 SER H 1 109 VAL MG1 4.260 . 4.260 3.622 3.269 3.979 . 0 0 "[ . 1 . 2]" 1
1757 1 99 SER H 1 110 GLN H 3.590 . 3.590 3.154 2.948 3.287 . 0 0 "[ . 1 . 2]" 1
1758 1 99 SER H 1 111 PRO HA 4.080 . 4.080 3.308 3.067 3.622 . 0 0 "[ . 1 . 2]" 1
1759 1 99 SER H 1 112 VAL H 4.540 . 4.540 4.115 3.818 4.392 . 0 0 "[ . 1 . 2]" 1
1760 1 99 SER H 1 112 VAL MG1 4.190 . 4.190 3.855 3.590 4.135 . 0 0 "[ . 1 . 2]" 1
1761 1 99 SER H 1 112 VAL MG2 4.840 . 4.840 3.651 3.472 3.889 . 0 0 "[ . 1 . 2]" 1
1762 1 99 SER HA 1 100 VAL H 2.840 . 2.840 2.167 2.113 2.244 . 0 0 "[ . 1 . 2]" 1
1763 1 99 SER HA 1 100 VAL MG1 4.570 . 4.570 3.919 3.749 4.200 . 0 0 "[ . 1 . 2]" 1
1764 1 99 SER HA 1 100 VAL QG 3.620 . 3.620 3.283 3.175 3.434 . 0 0 "[ . 1 . 2]" 1
1765 1 99 SER HA 1 100 VAL MG2 4.570 . 4.570 3.527 3.413 3.777 . 0 0 "[ . 1 . 2]" 1
1766 1 99 SER HA 1 110 GLN H 5.200 . 5.200 4.866 4.711 5.001 . 0 0 "[ . 1 . 2]" 1
1767 1 99 SER HA 1 112 VAL MG1 4.790 . 4.790 4.273 4.003 4.415 . 0 0 "[ . 1 . 2]" 1
1768 1 99 SER HA 1 112 VAL MG2 4.320 . 4.320 4.229 4.029 4.354 0.034 14 0 "[ . 1 . 2]" 1
1769 1 99 SER QB 1 100 VAL H 4.070 . 4.070 3.372 2.938 3.880 . 0 0 "[ . 1 . 2]" 1
1770 1 99 SER QB 1 100 VAL HA 5.500 . 5.500 4.311 4.172 4.559 . 0 0 "[ . 1 . 2]" 1
1771 1 99 SER QB 1 110 GLN H 4.380 . 4.380 3.653 3.281 3.906 . 0 0 "[ . 1 . 2]" 1
1772 1 99 SER QB 1 110 GLN QB 4.560 . 4.560 3.452 2.559 4.623 0.063 13 0 "[ . 1 . 2]" 1
1773 1 99 SER QB 1 110 GLN QG 5.100 . 5.100 4.527 2.545 5.168 0.068 11 0 "[ . 1 . 2]" 1
1774 1 99 SER QB 1 111 PRO HA 5.500 . 5.500 4.414 4.211 4.663 . 0 0 "[ . 1 . 2]" 1
1775 1 99 SER QB 1 112 VAL H 4.720 . 4.720 4.250 3.947 4.497 . 0 0 "[ . 1 . 2]" 1
1776 1 99 SER QB 1 112 VAL HA 4.580 . 4.580 4.636 4.351 4.715 0.135 11 0 "[ . 1 . 2]" 1
1777 1 99 SER QB 1 112 VAL HB 4.950 . 4.950 4.808 4.166 5.037 0.087 5 0 "[ . 1 . 2]" 1
1778 1 99 SER QB 1 112 VAL MG1 2.950 . 2.950 2.149 1.835 2.327 . 0 0 "[ . 1 . 2]" 1
1779 1 99 SER QB 1 112 VAL MG2 3.220 . 3.220 3.180 2.626 3.277 0.057 10 0 "[ . 1 . 2]" 1
1780 1 100 VAL H 1 100 VAL HB 3.900 . 3.900 3.716 3.632 3.811 . 0 0 "[ . 1 . 2]" 1
1781 1 100 VAL H 1 100 VAL MG1 3.960 . 3.960 2.956 2.580 3.162 . 0 0 "[ . 1 . 2]" 1
1782 1 100 VAL H 1 100 VAL QG 3.290 . 3.290 1.998 1.876 2.136 . 0 0 "[ . 1 . 2]" 1
1783 1 100 VAL H 1 100 VAL MG2 3.960 . 3.960 2.033 1.912 2.172 . 0 0 "[ . 1 . 2]" 1
1784 1 100 VAL H 1 101 SER H 4.690 . 4.690 4.461 4.354 4.544 . 0 0 "[ . 1 . 2]" 1
1785 1 100 VAL HA 1 100 VAL MG1 3.450 . 3.450 2.294 2.231 2.386 . 0 0 "[ . 1 . 2]" 1
1786 1 100 VAL HA 1 100 VAL QG 3.000 . 3.000 2.245 2.191 2.325 . 0 0 "[ . 1 . 2]" 1
1787 1 100 VAL HA 1 100 VAL MG2 3.450 . 3.450 3.199 3.187 3.210 . 0 0 "[ . 1 . 2]" 1
1788 1 100 VAL HA 1 101 SER H 2.840 . 2.840 2.210 2.155 2.284 . 0 0 "[ . 1 . 2]" 1
1789 1 100 VAL HA 1 109 VAL HA 3.380 . 3.380 2.384 2.236 2.574 . 0 0 "[ . 1 . 2]" 1
1790 1 100 VAL HA 1 109 VAL MG1 3.840 . 3.840 3.411 2.852 3.679 . 0 0 "[ . 1 . 2]" 1
1791 1 100 VAL HA 1 109 VAL MG2 3.770 . 3.770 3.634 3.389 3.794 0.024 14 0 "[ . 1 . 2]" 1
1792 1 100 VAL HB 1 101 SER H 4.340 . 4.340 2.898 2.670 3.106 . 0 0 "[ . 1 . 2]" 1
1793 1 100 VAL HB 1 101 SER QB 5.340 . 5.340 5.254 5.097 5.376 0.036 12 0 "[ . 1 . 2]" 1
1794 1 100 VAL HB 1 107 LEU HB3 5.500 . 5.500 4.473 4.218 4.962 . 0 0 "[ . 1 . 2]" 1
1795 1 100 VAL HB 1 107 LEU QD 5.440 . 5.440 3.841 3.391 4.351 . 0 0 "[ . 1 . 2]" 1
1796 1 100 VAL HB 1 109 VAL MG1 5.140 . 5.140 4.178 3.908 4.340 . 0 0 "[ . 1 . 2]" 1
1797 1 100 VAL HB 1 109 VAL MG2 4.670 . 4.670 3.651 3.260 4.033 . 0 0 "[ . 1 . 2]" 1
1798 1 100 VAL QG 1 101 SER H 3.650 . 3.650 3.351 3.262 3.439 . 0 0 "[ . 1 . 2]" 1
1799 1 100 VAL QG 1 101 SER HA 4.040 . 4.040 3.867 3.653 4.037 . 0 0 "[ . 1 . 2]" 1
1800 1 100 VAL QG 1 109 VAL HA 3.830 . 3.830 2.461 2.221 2.989 . 0 0 "[ . 1 . 2]" 1
1801 1 100 VAL QG 1 109 VAL MG1 3.050 . 3.050 1.872 1.727 1.976 . 0 0 "[ . 1 . 2]" 1
1802 1 100 VAL QG 1 109 VAL MG2 3.010 . 3.010 2.030 1.904 2.182 . 0 0 "[ . 1 . 2]" 1
1803 1 100 VAL QG 1 110 GLN H 4.800 . 4.800 3.720 3.513 4.135 . 0 0 "[ . 1 . 2]" 1
1804 1 100 VAL MG1 1 101 SER H 4.220 . 4.220 3.643 3.548 3.744 . 0 0 "[ . 1 . 2]" 1
1805 1 100 VAL MG1 1 109 VAL MG1 4.290 . 4.290 1.874 1.729 1.980 . 0 0 "[ . 1 . 2]" 1
1806 1 100 VAL MG2 1 101 SER H 4.220 . 4.220 3.920 3.699 4.080 . 0 0 "[ . 1 . 2]" 1
1807 1 100 VAL MG2 1 109 VAL MG1 4.290 . 4.290 4.084 3.878 4.231 . 0 0 "[ . 1 . 2]" 1
1808 1 101 SER H 1 101 SER HB2 4.170 . 4.170 3.053 2.809 3.834 . 0 0 "[ . 1 . 2]" 1
1809 1 101 SER H 1 101 SER HB3 4.170 . 4.170 3.898 3.575 3.973 . 0 0 "[ . 1 . 2]" 1
1810 1 101 SER H 1 102 VAL H 4.390 . 4.390 4.342 4.255 4.403 0.013 6 0 "[ . 1 . 2]" 1
1811 1 101 SER H 1 108 LEU H 3.360 . 3.360 2.937 2.763 3.075 . 0 0 "[ . 1 . 2]" 1
1812 1 101 SER H 1 108 LEU HB2 4.550 . 4.550 3.628 3.264 4.125 . 0 0 "[ . 1 . 2]" 1
1813 1 101 SER H 1 109 VAL MG2 4.400 . 4.400 4.271 3.893 4.428 0.028 4 0 "[ . 1 . 2]" 1
1814 1 101 SER HA 1 102 VAL H 2.960 . 2.960 2.352 2.215 2.582 . 0 0 "[ . 1 . 2]" 1
1815 1 101 SER HA 1 102 VAL QG 3.690 . 3.690 3.325 3.126 3.692 0.002 10 0 "[ . 1 . 2]" 1
1816 1 101 SER HA 1 108 LEU H 5.280 . 5.280 4.700 4.615 4.817 . 0 0 "[ . 1 . 2]" 1
1817 1 101 SER QB 1 102 VAL H 3.340 . 3.340 2.648 2.267 3.025 . 0 0 "[ . 1 . 2]" 1
1818 1 101 SER QB 1 102 VAL QG 4.600 . 4.600 4.039 3.884 4.135 . 0 0 "[ . 1 . 2]" 1
1819 1 102 VAL H 1 102 VAL HB 3.080 . 3.080 2.958 2.737 3.241 0.161 10 0 "[ . 1 . 2]" 1
1820 1 102 VAL H 1 102 VAL MG1 4.140 . 4.140 3.043 1.870 3.934 . 0 0 "[ . 1 . 2]" 1
1821 1 102 VAL H 1 102 VAL QG 3.200 . 3.200 2.185 1.865 2.479 . 0 0 "[ . 1 . 2]" 1
1822 1 102 VAL H 1 102 VAL MG2 4.140 . 4.140 3.010 2.208 3.964 . 0 0 "[ . 1 . 2]" 1
1823 1 102 VAL H 1 103 SER HA 5.340 . 5.340 4.994 4.648 5.207 . 0 0 "[ . 1 . 2]" 1
1824 1 102 VAL H 1 103 SER QB 5.260 . 5.260 5.354 5.295 5.438 0.178 13 0 "[ . 1 . 2]" 1
1825 1 102 VAL H 1 107 LEU HA 5.100 . 5.100 4.817 4.615 4.978 . 0 0 "[ . 1 . 2]" 1
1826 1 102 VAL H 1 107 LEU QD 4.530 . 4.530 4.141 3.694 4.466 . 0 0 "[ . 1 . 2]" 1
1827 1 102 VAL HA 1 102 VAL MG1 3.300 . 3.300 2.685 2.230 3.217 . 0 0 "[ . 1 . 2]" 1
1828 1 102 VAL HA 1 102 VAL QG 2.800 . 2.800 2.249 2.105 2.432 . 0 0 "[ . 1 . 2]" 1
1829 1 102 VAL HA 1 102 VAL MG2 3.300 . 3.300 2.533 2.340 2.600 . 0 0 "[ . 1 . 2]" 1
1830 1 102 VAL HA 1 103 SER H 2.710 . 2.710 2.137 2.094 2.176 . 0 0 "[ . 1 . 2]" 1
1831 1 102 VAL HA 1 103 SER HA 4.790 . 4.790 4.384 4.356 4.413 . 0 0 "[ . 1 . 2]" 1
1832 1 102 VAL HA 1 106 LYS H 4.470 . 4.470 4.161 3.959 4.514 0.044 10 0 "[ . 1 . 2]" 1
1833 1 102 VAL HA 1 107 LEU H 5.420 . 5.420 4.694 4.512 4.800 . 0 0 "[ . 1 . 2]" 1
1834 1 102 VAL HA 1 107 LEU HA 3.620 . 3.620 2.346 2.154 2.480 . 0 0 "[ . 1 . 2]" 1
1835 1 102 VAL HA 1 107 LEU HB2 5.500 . 5.500 5.308 5.049 5.446 . 0 0 "[ . 1 . 2]" 1
1836 1 102 VAL HA 1 107 LEU QD 3.630 . 3.630 2.746 2.461 3.107 . 0 0 "[ . 1 . 2]" 1
1837 1 102 VAL HA 1 107 LEU HG 5.500 . 5.500 4.503 3.793 5.404 . 0 0 "[ . 1 . 2]" 1
1838 1 102 VAL HB 1 107 LEU QD 3.590 . 3.590 2.991 1.920 3.853 0.263 17 0 "[ . 1 . 2]" 1
1839 1 102 VAL QG 1 103 SER H 3.060 . 3.060 2.780 2.619 2.933 . 0 0 "[ . 1 . 2]" 1
1840 1 102 VAL QG 1 103 SER HA 3.770 . 3.770 3.527 3.144 3.823 0.053 20 0 "[ . 1 . 2]" 1
1841 1 102 VAL QG 1 104 ALA H 4.090 . 4.090 4.014 3.517 4.159 0.069 14 0 "[ . 1 . 2]" 1
1842 1 102 VAL QG 1 104 ALA MB 5.340 . 5.340 5.021 4.424 5.187 . 0 0 "[ . 1 . 2]" 1
1843 1 102 VAL QG 1 105 ASN H 4.540 . 4.540 3.216 2.958 4.213 . 0 0 "[ . 1 . 2]" 1
1844 1 102 VAL QG 1 105 ASN HA 3.790 . 3.790 3.103 2.784 3.425 . 0 0 "[ . 1 . 2]" 1
1845 1 102 VAL QG 1 106 LYS H 3.950 . 3.950 2.837 2.559 3.060 . 0 0 "[ . 1 . 2]" 1
1846 1 102 VAL QG 1 107 LEU HA 3.540 . 3.540 2.982 2.449 3.370 . 0 0 "[ . 1 . 2]" 1
1847 1 102 VAL QG 1 107 LEU QD 2.810 . 2.810 2.109 1.627 2.764 . 0 0 "[ . 1 . 2]" 1
1848 1 102 VAL QG 1 107 LEU HG 3.840 . 3.840 3.203 2.706 3.773 . 0 0 "[ . 1 . 2]" 1
1849 1 102 VAL QG 1 108 LEU H 5.320 . 5.320 4.119 3.726 4.552 . 0 0 "[ . 1 . 2]" 1
1850 1 102 VAL MG1 1 103 SER H 4.390 . 4.390 3.431 2.657 4.219 . 0 0 "[ . 1 . 2]" 1
1851 1 102 VAL MG1 1 107 LEU HA 4.460 . 4.460 3.743 2.820 4.544 0.084 2 0 "[ . 1 . 2]" 1
1852 1 102 VAL MG2 1 103 SER H 4.390 . 4.390 3.610 2.651 4.332 . 0 0 "[ . 1 . 2]" 1
1853 1 102 VAL MG2 1 107 LEU HA 4.460 . 4.460 3.272 2.460 3.474 . 0 0 "[ . 1 . 2]" 1
1854 1 103 SER H 1 103 SER QB 3.210 . 3.210 2.717 2.380 2.814 . 0 0 "[ . 1 . 2]" 1
1855 1 103 SER H 1 104 ALA H 4.400 . 4.400 4.134 4.042 4.244 . 0 0 "[ . 1 . 2]" 1
1856 1 103 SER H 1 104 ALA MB 4.800 . 4.800 4.690 4.590 4.823 0.023 20 0 "[ . 1 . 2]" 1
1857 1 103 SER H 1 106 LYS H 3.470 . 3.470 2.916 2.757 3.159 . 0 0 "[ . 1 . 2]" 1
1858 1 103 SER H 1 106 LYS HA 4.870 . 4.870 4.768 4.674 4.879 0.009 14 0 "[ . 1 . 2]" 1
1859 1 103 SER H 1 106 LYS HB2 5.010 . 5.010 4.913 4.732 5.027 0.017 14 0 "[ . 1 . 2]" 1
1860 1 103 SER H 1 106 LYS HB3 3.810 . 3.810 3.515 3.304 3.663 . 0 0 "[ . 1 . 2]" 1
1861 1 103 SER H 1 106 LYS HG2 5.030 . 5.030 4.901 4.780 5.021 . 0 0 "[ . 1 . 2]" 1
1862 1 103 SER H 1 107 LEU HA 4.180 . 4.180 3.585 3.450 3.690 . 0 0 "[ . 1 . 2]" 1
1863 1 103 SER H 1 108 LEU H 4.460 . 4.460 3.945 3.801 4.111 . 0 0 "[ . 1 . 2]" 1
1864 1 103 SER HA 1 104 ALA H 2.820 . 2.820 2.129 2.109 2.165 . 0 0 "[ . 1 . 2]" 1
1865 1 103 SER HA 1 104 ALA HA 4.560 . 4.560 4.346 4.329 4.379 . 0 0 "[ . 1 . 2]" 1
1866 1 103 SER HA 1 104 ALA MB 4.320 . 4.320 4.060 3.994 4.133 . 0 0 "[ . 1 . 2]" 1
1867 1 103 SER QB 1 104 ALA H 4.000 . 4.000 3.333 3.107 3.566 . 0 0 "[ . 1 . 2]" 1
1868 1 103 SER QB 1 104 ALA MB 4.290 . 4.290 3.421 3.337 3.513 . 0 0 "[ . 1 . 2]" 1
1869 1 103 SER QB 1 106 LYS H 4.660 . 4.660 4.455 3.913 4.622 . 0 0 "[ . 1 . 2]" 1
1870 1 103 SER QB 1 106 LYS HB2 5.500 . 5.500 5.328 4.334 5.556 0.056 4 0 "[ . 1 . 2]" 1
1871 1 103 SER QB 1 106 LYS HB3 4.280 . 4.280 3.916 3.019 4.142 . 0 0 "[ . 1 . 2]" 1
1872 1 103 SER QB 1 106 LYS QD 5.030 . 5.030 4.757 4.033 5.069 0.039 17 0 "[ . 1 . 2]" 1
1873 1 103 SER QB 1 108 LEU HB2 4.770 . 4.770 4.149 3.784 4.743 . 0 0 "[ . 1 . 2]" 1
1874 1 103 SER QB 1 108 LEU HB3 5.500 . 5.500 5.368 4.922 5.552 0.052 12 0 "[ . 1 . 2]" 1
1875 1 103 SER QB 1 108 LEU QD 3.460 . 3.460 2.526 2.140 3.123 . 0 0 "[ . 1 . 2]" 1
1876 1 103 SER QB 1 108 LEU HG 5.500 . 5.500 4.209 3.040 5.473 . 0 0 "[ . 1 . 2]" 1
1877 1 104 ALA H 1 104 ALA HA 2.820 . 2.820 2.263 2.250 2.273 . 0 0 "[ . 1 . 2]" 1
1878 1 104 ALA H 1 104 ALA MB 3.420 . 3.420 2.887 2.845 2.923 . 0 0 "[ . 1 . 2]" 1
1879 1 104 ALA H 1 105 ASN H 4.120 . 4.120 2.816 2.608 4.144 0.024 10 0 "[ . 1 . 2]" 1
1880 1 104 ALA HA 1 106 LYS H 4.550 . 4.550 4.426 4.248 4.664 0.114 10 0 "[ . 1 . 2]" 1
1881 1 104 ALA MB 1 105 ASN HA 5.150 . 5.150 5.043 4.061 5.111 . 0 0 "[ . 1 . 2]" 1
1882 1 104 ALA MB 1 105 ASN QB 4.040 . 4.040 3.931 3.246 4.043 0.003 5 0 "[ . 1 . 2]" 1
1883 1 104 ALA MB 1 106 LYS H 4.080 . 4.080 3.831 3.371 4.070 . 0 0 "[ . 1 . 2]" 1
1884 1 104 ALA MB 1 108 LEU QD 5.440 . 5.440 4.459 4.063 5.449 0.009 10 0 "[ . 1 . 2]" 1
1885 1 105 ASN H 1 105 ASN QB 3.300 . 3.300 3.093 2.538 3.313 0.013 4 0 "[ . 1 . 2]" 1
1886 1 105 ASN H 1 106 LYS H 3.140 . 3.140 2.642 2.181 2.743 . 0 0 "[ . 1 . 2]" 1
1887 1 105 ASN H 1 106 LYS HB2 5.500 . 5.500 5.045 3.595 5.236 . 0 0 "[ . 1 . 2]" 1
1888 1 105 ASN H 1 106 LYS HB3 5.360 . 5.360 5.054 4.151 5.247 . 0 0 "[ . 1 . 2]" 1
1889 1 105 ASN HA 1 106 LYS HA 4.740 . 4.740 4.397 4.340 4.453 . 0 0 "[ . 1 . 2]" 1
1890 1 105 ASN QB 1 106 LYS H 4.050 . 4.050 3.776 3.702 3.845 . 0 0 "[ . 1 . 2]" 1
1891 1 105 ASN QB 1 106 LYS HB2 5.350 . 5.350 4.290 4.153 4.389 . 0 0 "[ . 1 . 2]" 1
1892 1 106 LYS H 1 106 LYS HB2 3.600 . 3.600 3.079 2.896 3.183 . 0 0 "[ . 1 . 2]" 1
1893 1 106 LYS H 1 106 LYS HB3 3.200 . 3.200 2.804 2.706 2.938 . 0 0 "[ . 1 . 2]" 1
1894 1 106 LYS H 1 106 LYS HG2 4.680 . 4.680 4.548 4.475 4.602 . 0 0 "[ . 1 . 2]" 1
1895 1 106 LYS H 1 106 LYS HG3 4.930 . 4.930 4.743 4.668 4.850 . 0 0 "[ . 1 . 2]" 1
1896 1 106 LYS H 1 107 LEU H 4.570 . 4.570 4.264 4.161 4.350 . 0 0 "[ . 1 . 2]" 1
1897 1 106 LYS HA 1 106 LYS QD 4.300 . 4.300 4.041 3.971 4.180 . 0 0 "[ . 1 . 2]" 1
1898 1 106 LYS HA 1 106 LYS QE 5.500 . 5.500 4.451 4.273 4.565 . 0 0 "[ . 1 . 2]" 1
1899 1 106 LYS HA 1 106 LYS HG2 4.080 . 4.080 2.981 2.826 3.104 . 0 0 "[ . 1 . 2]" 1
1900 1 106 LYS HA 1 106 LYS HG3 3.960 . 3.960 2.555 2.457 2.738 . 0 0 "[ . 1 . 2]" 1
1901 1 106 LYS HA 1 107 LEU H 2.720 . 2.720 2.166 2.134 2.218 . 0 0 "[ . 1 . 2]" 1
1902 1 106 LYS HA 1 107 LEU HA 5.500 . 5.500 4.369 4.349 4.388 . 0 0 "[ . 1 . 2]" 1
1903 1 106 LYS HA 1 107 LEU QD 5.060 . 5.060 4.303 2.843 4.658 . 0 0 "[ . 1 . 2]" 1
1904 1 106 LYS HB2 1 107 LEU H 4.590 . 4.590 4.263 4.192 4.338 . 0 0 "[ . 1 . 2]" 1
1905 1 106 LYS HB2 1 108 LEU QD 4.690 . 4.690 4.057 3.764 4.380 . 0 0 "[ . 1 . 2]" 1
1906 1 106 LYS HB3 1 106 LYS QD 3.430 . 3.430 2.402 2.195 2.491 . 0 0 "[ . 1 . 2]" 1
1907 1 106 LYS HB3 1 106 LYS QE 4.470 . 4.470 3.998 3.371 4.074 . 0 0 "[ . 1 . 2]" 1
1908 1 106 LYS HB3 1 107 LEU H 3.990 . 3.990 4.031 3.970 4.084 0.094 8 0 "[ . 1 . 2]" 1
1909 1 106 LYS HB3 1 108 LEU QD 4.060 . 4.060 2.772 2.574 3.066 . 0 0 "[ . 1 . 2]" 1
1910 1 106 LYS QD 1 107 LEU H 4.990 . 4.990 4.696 4.459 4.816 . 0 0 "[ . 1 . 2]" 1
1911 1 106 LYS QD 1 108 LEU HA 5.200 . 5.200 4.872 4.037 5.161 . 0 0 "[ . 1 . 2]" 1
1912 1 106 LYS QD 1 108 LEU MD1 3.830 . 3.830 3.135 2.196 3.841 0.011 18 0 "[ . 1 . 2]" 1
1913 1 106 LYS QD 1 108 LEU QD 3.160 . 3.160 2.299 1.869 2.832 . 0 0 "[ . 1 . 2]" 1
1914 1 106 LYS QD 1 108 LEU MD2 3.830 . 3.830 2.696 1.877 3.691 . 0 0 "[ . 1 . 2]" 1
1915 1 106 LYS QE 1 106 LYS HG2 3.480 . 3.480 2.688 2.531 3.284 . 0 0 "[ . 1 . 2]" 1
1916 1 106 LYS QE 1 106 LYS HG3 3.360 . 3.360 2.221 2.021 2.321 . 0 0 "[ . 1 . 2]" 1
1917 1 106 LYS QE 1 108 LEU MD1 4.380 . 4.380 4.192 3.807 4.487 0.107 14 0 "[ . 1 . 2]" 1
1918 1 106 LYS QE 1 108 LEU MD2 4.380 . 4.380 3.760 2.626 4.396 0.016 4 0 "[ . 1 . 2]" 1
1919 1 106 LYS HG2 1 107 LEU H 3.530 . 3.530 2.873 2.656 3.072 . 0 0 "[ . 1 . 2]" 1
1920 1 106 LYS HG2 1 108 LEU QD 3.340 . 3.340 2.678 2.032 3.376 0.036 4 0 "[ . 1 . 2]" 1
1921 1 106 LYS HG3 1 107 LEU H 4.590 . 4.590 3.274 2.995 3.520 . 0 0 "[ . 1 . 2]" 1
1922 1 107 LEU H 1 107 LEU HB2 3.240 . 3.240 2.384 2.253 2.489 . 0 0 "[ . 1 . 2]" 1
1923 1 107 LEU H 1 107 LEU MD1 4.810 . 4.810 3.638 3.206 3.863 . 0 0 "[ . 1 . 2]" 1
1924 1 107 LEU H 1 107 LEU QD 3.960 . 3.960 3.222 2.063 3.448 . 0 0 "[ . 1 . 2]" 1
1925 1 107 LEU H 1 107 LEU MD2 4.810 . 4.810 3.682 2.088 4.096 . 0 0 "[ . 1 . 2]" 1
1926 1 107 LEU H 1 108 LEU H 5.150 . 5.150 4.425 4.405 4.449 . 0 0 "[ . 1 . 2]" 1
1927 1 107 LEU H 1 108 LEU HA 5.500 . 5.500 5.096 5.027 5.172 . 0 0 "[ . 1 . 2]" 1
1928 1 107 LEU H 1 108 LEU QD 4.850 . 4.850 4.182 3.733 4.891 0.041 19 0 "[ . 1 . 2]" 1
1929 1 107 LEU HA 1 107 LEU MD1 3.930 . 3.930 3.775 2.016 3.905 . 0 0 "[ . 1 . 2]" 1
1930 1 107 LEU HA 1 107 LEU QD 3.050 . 3.050 2.087 1.997 2.194 . 0 0 "[ . 1 . 2]" 1
1931 1 107 LEU HA 1 107 LEU MD2 3.930 . 3.930 2.158 2.026 3.242 . 0 0 "[ . 1 . 2]" 1
1932 1 107 LEU HA 1 107 LEU HG 4.020 . 4.020 2.986 2.701 3.704 . 0 0 "[ . 1 . 2]" 1
1933 1 107 LEU HA 1 108 LEU H 2.770 . 2.770 2.144 2.114 2.175 . 0 0 "[ . 1 . 2]" 1
1934 1 107 LEU HA 1 108 LEU HA 4.600 . 4.600 4.377 4.362 4.396 . 0 0 "[ . 1 . 2]" 1
1935 1 107 LEU HB2 1 107 LEU QD 2.970 . 2.970 2.208 2.076 2.296 . 0 0 "[ . 1 . 2]" 1
1936 1 107 LEU HB3 1 107 LEU MD1 3.590 . 3.590 2.465 2.350 2.583 . 0 0 "[ . 1 . 2]" 1
1937 1 107 LEU HB3 1 107 LEU QD 2.790 . 2.790 2.136 2.101 2.429 . 0 0 "[ . 1 . 2]" 1
1938 1 107 LEU HB3 1 107 LEU MD2 3.590 . 3.590 2.363 2.264 3.156 . 0 0 "[ . 1 . 2]" 1
1939 1 107 LEU HB3 1 109 VAL MG2 4.000 . 4.000 3.536 3.290 3.814 . 0 0 "[ . 1 . 2]" 1
1940 1 107 LEU QD 1 108 LEU H 4.060 . 4.060 3.487 3.192 3.616 . 0 0 "[ . 1 . 2]" 1
1941 1 108 LEU H 1 108 LEU HB2 3.350 . 3.350 2.368 2.248 2.712 . 0 0 "[ . 1 . 2]" 1
1942 1 108 LEU H 1 108 LEU QD 4.320 . 4.320 3.033 2.683 3.536 . 0 0 "[ . 1 . 2]" 1
1943 1 108 LEU H 1 108 LEU HG 4.630 . 4.630 3.993 2.657 4.515 . 0 0 "[ . 1 . 2]" 1
1944 1 108 LEU H 1 109 VAL H 4.380 . 4.380 4.298 4.232 4.389 0.009 7 0 "[ . 1 . 2]" 1
1945 1 108 LEU HA 1 108 LEU MD1 3.770 . 3.770 2.782 1.953 3.806 0.036 7 0 "[ . 1 . 2]" 1
1946 1 108 LEU HA 1 108 LEU QD 3.090 . 3.090 2.280 1.859 2.915 . 0 0 "[ . 1 . 2]" 1
1947 1 108 LEU HA 1 108 LEU MD2 3.770 . 3.770 2.575 1.979 3.124 . 0 0 "[ . 1 . 2]" 1
1948 1 108 LEU HA 1 108 LEU HG 3.970 . 3.970 3.062 2.171 3.691 . 0 0 "[ . 1 . 2]" 1
1949 1 108 LEU HA 1 109 VAL H 2.790 . 2.790 2.109 2.079 2.146 . 0 0 "[ . 1 . 2]" 1
1950 1 108 LEU HA 1 109 VAL MG2 4.820 . 4.820 3.438 3.256 3.584 . 0 0 "[ . 1 . 2]" 1
1951 1 108 LEU HB2 1 108 LEU MD1 3.470 . 3.470 2.694 2.108 3.200 . 0 0 "[ . 1 . 2]" 1
1952 1 108 LEU HB2 1 108 LEU QD 3.040 . 3.040 2.228 2.058 2.430 . 0 0 "[ . 1 . 2]" 1
1953 1 108 LEU HB2 1 108 LEU MD2 3.470 . 3.470 2.685 2.337 3.191 . 0 0 "[ . 1 . 2]" 1
1954 1 108 LEU HB2 1 109 VAL H 4.430 . 4.430 4.409 3.935 4.515 0.085 3 0 "[ . 1 . 2]" 1
1955 1 108 LEU HB2 1 110 GLN QG 5.500 . 5.500 4.438 3.648 5.043 . 0 0 "[ . 1 . 2]" 1
1956 1 108 LEU HB3 1 108 LEU MD1 3.330 . 3.330 2.556 2.173 2.976 . 0 0 "[ . 1 . 2]" 1
1957 1 108 LEU HB3 1 108 LEU QD 2.850 . 2.850 2.179 2.041 2.324 . 0 0 "[ . 1 . 2]" 1
1958 1 108 LEU HB3 1 108 LEU MD2 3.330 . 3.330 2.701 2.079 3.206 . 0 0 "[ . 1 . 2]" 1
1959 1 108 LEU HB3 1 109 VAL H 4.010 . 4.010 3.523 3.135 3.690 . 0 0 "[ . 1 . 2]" 1
1960 1 108 LEU QD 1 109 VAL H 3.860 . 3.860 3.326 2.763 3.853 . 0 0 "[ . 1 . 2]" 1
1961 1 108 LEU QD 1 109 VAL HA 5.270 . 5.270 4.958 4.616 5.292 0.022 2 0 "[ . 1 . 2]" 1
1962 1 108 LEU QD 1 110 GLN QB 5.440 . 5.440 4.623 3.622 5.256 . 0 0 "[ . 1 . 2]" 1
1963 1 108 LEU QD 1 110 GLN QE 3.700 . 3.700 2.856 1.962 3.668 . 0 0 "[ . 1 . 2]" 1
1964 1 108 LEU QD 1 110 GLN QG 3.990 . 3.990 3.268 2.645 4.041 0.051 13 0 "[ . 1 . 2]" 1
1965 1 108 LEU HG 1 109 VAL H 5.290 . 5.290 4.817 4.043 5.366 0.076 17 0 "[ . 1 . 2]" 1
1966 1 109 VAL H 1 109 VAL HB 3.540 . 3.540 2.762 2.708 2.878 . 0 0 "[ . 1 . 2]" 1
1967 1 109 VAL H 1 109 VAL MG1 4.350 . 4.350 3.854 3.818 3.881 . 0 0 "[ . 1 . 2]" 1
1968 1 109 VAL H 1 109 VAL MG2 3.400 . 3.400 2.228 2.077 2.383 . 0 0 "[ . 1 . 2]" 1
1969 1 109 VAL H 1 110 GLN H 4.440 . 4.440 4.318 4.271 4.384 . 0 0 "[ . 1 . 2]" 1
1970 1 109 VAL HA 1 109 VAL MG1 3.320 . 3.320 2.260 2.201 2.351 . 0 0 "[ . 1 . 2]" 1
1971 1 109 VAL HA 1 109 VAL MG2 3.450 . 3.450 2.567 2.493 2.655 . 0 0 "[ . 1 . 2]" 1
1972 1 109 VAL HA 1 110 GLN H 2.790 . 2.790 2.163 2.138 2.189 . 0 0 "[ . 1 . 2]" 1
1973 1 109 VAL HA 1 110 GLN QG 5.130 . 5.130 3.767 3.442 4.346 . 0 0 "[ . 1 . 2]" 1
1974 1 109 VAL MG1 1 110 GLN H 3.480 . 3.480 2.923 2.816 3.003 . 0 0 "[ . 1 . 2]" 1
1975 1 109 VAL MG1 1 110 GLN HA 4.710 . 4.710 3.936 3.740 4.212 . 0 0 "[ . 1 . 2]" 1
1976 1 109 VAL MG1 1 110 GLN QG 5.500 . 5.500 4.621 4.384 4.973 . 0 0 "[ . 1 . 2]" 1
1977 1 109 VAL MG2 1 110 GLN H 4.420 . 4.420 4.309 4.251 4.345 . 0 0 "[ . 1 . 2]" 1
1978 1 110 GLN H 1 110 GLN QB 3.880 . 3.880 2.754 2.578 3.177 . 0 0 "[ . 1 . 2]" 1
1979 1 110 GLN H 1 110 GLN QG 3.790 . 3.790 2.853 2.110 3.376 . 0 0 "[ . 1 . 2]" 1
1980 1 110 GLN H 1 111 PRO QD 4.460 . 4.460 4.263 4.171 4.320 . 0 0 "[ . 1 . 2]" 1
1981 1 110 GLN HA 1 110 GLN QG 3.930 . 3.930 2.683 2.346 3.343 . 0 0 "[ . 1 . 2]" 1
1982 1 110 GLN HA 1 111 PRO QD 3.580 . 3.580 1.993 1.945 2.062 . 0 0 "[ . 1 . 2]" 1
1983 1 110 GLN HA 1 111 PRO HG2 4.600 . 4.600 4.444 4.308 4.539 . 0 0 "[ . 1 . 2]" 1
1984 1 110 GLN HA 1 111 PRO HG3 4.750 . 4.750 4.349 4.307 4.423 . 0 0 "[ . 1 . 2]" 1
1985 1 110 GLN QB 1 111 PRO QD 4.280 . 4.280 2.529 2.246 2.794 . 0 0 "[ . 1 . 2]" 1
1986 1 111 PRO HA 1 112 VAL H 2.820 . 2.820 2.190 2.127 2.271 . 0 0 "[ . 1 . 2]" 1
1987 1 111 PRO HB2 1 112 VAL H 3.940 . 3.940 3.298 2.947 3.461 . 0 0 "[ . 1 . 2]" 1
1988 1 111 PRO HB2 1 112 VAL HA 4.630 . 4.630 4.490 4.301 4.650 0.020 12 0 "[ . 1 . 2]" 1
1989 1 111 PRO HB2 1 112 VAL MG2 4.780 . 4.780 4.738 4.528 4.861 0.081 3 0 "[ . 1 . 2]" 1
1990 1 111 PRO HB3 1 112 VAL H 3.940 . 3.940 3.904 3.716 4.005 0.065 8 0 "[ . 1 . 2]" 1
1991 1 111 PRO HG2 1 112 VAL H 4.860 . 4.860 4.818 4.586 4.904 0.044 12 0 "[ . 1 . 2]" 1
1992 1 112 VAL H 1 112 VAL HB 3.900 . 3.900 3.655 3.545 3.731 . 0 0 "[ . 1 . 2]" 1
1993 1 112 VAL H 1 112 VAL MG1 3.890 . 3.890 3.054 2.884 3.240 . 0 0 "[ . 1 . 2]" 1
1994 1 112 VAL H 1 112 VAL MG2 3.220 . 3.220 1.930 1.811 2.089 . 0 0 "[ . 1 . 2]" 1
1995 1 112 VAL HA 1 112 VAL MG1 3.150 . 3.150 2.228 2.164 2.306 . 0 0 "[ . 1 . 2]" 1
1996 1 112 VAL HA 1 112 VAL MG2 3.230 . 3.230 3.179 3.145 3.199 . 0 0 "[ . 1 . 2]" 1
1997 1 112 VAL HA 1 113 PRO HD2 3.000 . 3.000 2.633 2.496 3.010 0.010 4 0 "[ . 1 . 2]" 1
1998 1 112 VAL HA 1 113 PRO HD3 2.950 . 2.950 2.055 1.815 2.260 . 0 0 "[ . 1 . 2]" 1
1999 1 112 VAL HB 1 113 PRO HD2 3.710 . 3.710 2.443 2.215 2.862 . 0 0 "[ . 1 . 2]" 1
2000 1 112 VAL HB 1 113 PRO HD3 3.500 . 3.500 3.485 3.150 3.577 0.077 10 0 "[ . 1 . 2]" 1
2001 1 112 VAL HB 1 114 VAL H 5.500 . 5.500 4.520 3.853 5.268 . 0 0 "[ . 1 . 2]" 1
2002 1 112 VAL MG1 1 113 PRO HD2 3.520 . 3.520 2.937 2.398 3.508 . 0 0 "[ . 1 . 2]" 1
2003 1 112 VAL MG1 1 113 PRO HD3 4.530 . 4.530 3.300 2.792 3.562 . 0 0 "[ . 1 . 2]" 1
2004 1 112 VAL MG2 1 113 PRO HD2 4.240 . 4.240 4.025 3.867 4.314 0.074 8 0 "[ . 1 . 2]" 1
2005 1 112 VAL MG2 1 113 PRO HD3 4.730 . 4.730 4.530 4.319 4.625 . 0 0 "[ . 1 . 2]" 1
2006 1 113 PRO HA 1 114 VAL H 2.640 . 2.640 2.336 2.160 2.587 . 0 0 "[ . 1 . 2]" 1
2007 1 113 PRO HA 1 114 VAL HA 4.420 . 4.420 4.396 4.374 4.453 0.033 8 0 "[ . 1 . 2]" 1
2008 1 113 PRO HA 1 114 VAL MG1 4.400 . 4.400 4.315 4.162 4.438 0.038 15 0 "[ . 1 . 2]" 1
2009 1 113 PRO HA 1 114 VAL MG2 4.510 . 4.510 3.915 3.550 4.345 . 0 0 "[ . 1 . 2]" 1
2010 1 113 PRO QB 1 114 VAL H 4.030 . 4.030 3.828 3.626 3.976 . 0 0 "[ . 1 . 2]" 1
2011 1 113 PRO HD2 1 114 VAL MG1 4.280 . 4.280 3.787 3.400 4.262 . 0 0 "[ . 1 . 2]" 1
2012 1 113 PRO HD2 1 114 VAL MG2 5.000 . 5.000 4.879 4.472 5.061 0.061 4 0 "[ . 1 . 2]" 1
2013 1 113 PRO HD3 1 114 VAL MG1 5.460 . 5.460 4.971 4.703 5.325 . 0 0 "[ . 1 . 2]" 1
2014 1 113 PRO HD3 1 114 VAL MG2 5.500 . 5.500 5.502 5.308 5.586 0.086 11 0 "[ . 1 . 2]" 1
2015 1 113 PRO QG 1 114 VAL H 5.030 . 5.030 4.750 4.477 5.000 . 0 0 "[ . 1 . 2]" 1
2016 1 114 VAL H 1 114 VAL HB 4.030 . 4.030 3.774 3.644 3.847 . 0 0 "[ . 1 . 2]" 1
2017 1 114 VAL H 1 114 VAL MG2 3.200 . 3.200 2.110 1.840 2.293 . 0 0 "[ . 1 . 2]" 1
2018 1 114 VAL H 1 115 SER HA 5.120 . 5.120 4.753 4.120 5.140 0.020 12 0 "[ . 1 . 2]" 1
2019 1 114 VAL HA 1 114 VAL HB 3.020 . 3.020 2.530 2.470 2.600 . 0 0 "[ . 1 . 2]" 1
2020 1 114 VAL HA 1 114 VAL MG1 2.760 . 2.760 2.293 2.222 2.373 . 0 0 "[ . 1 . 2]" 1
2021 1 114 VAL HA 1 114 VAL MG2 3.160 . 3.160 3.187 3.162 3.206 0.046 5 0 "[ . 1 . 2]" 1
2022 1 114 VAL HA 1 115 SER H 2.880 . 2.880 2.630 2.123 3.006 0.126 19 0 "[ . 1 . 2]" 1
2023 1 114 VAL HA 1 115 SER HA 4.720 . 4.720 4.491 4.301 4.692 . 0 0 "[ . 1 . 2]" 1
2024 1 114 VAL HB 1 115 SER H 4.440 . 4.440 3.030 1.651 4.376 . 0 0 "[ . 1 . 2]" 1
2025 1 114 VAL MG1 1 115 SER H 4.540 . 4.540 3.836 3.215 4.398 . 0 0 "[ . 1 . 2]" 1
2026 1 114 VAL MG1 1 115 SER HA 5.500 . 5.500 5.454 5.292 5.556 0.056 18 0 "[ . 1 . 2]" 1
2027 1 114 VAL MG2 1 115 SER H 4.800 . 4.800 3.458 3.024 4.037 . 0 0 "[ . 1 . 2]" 1
2028 1 114 VAL MG2 1 115 SER HA 4.250 . 4.250 3.922 3.526 4.310 0.060 20 0 "[ . 1 . 2]" 1
2029 1 114 VAL MG2 1 115 SER QB 4.770 . 4.770 4.712 4.337 4.932 0.162 16 0 "[ . 1 . 2]" 1
2030 1 115 SER H 1 115 SER QB 3.840 . 3.840 2.825 2.523 3.334 . 0 0 "[ . 1 . 2]" 1
2031 1 119 LYS QD 1 119 LYS QG 2.400 . 2.400 2.063 2.002 2.094 . 0 0 "[ . 1 . 2]" 1
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