NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
643121 |
6qvw   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6qvw
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 1698
_Distance_constraint_stats_list.Viol_count 2633
_Distance_constraint_stats_list.Viol_total 2692.130
_Distance_constraint_stats_list.Viol_max 0.351
_Distance_constraint_stats_list.Viol_rms 0.0117
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0018
_Distance_constraint_stats_list.Viol_average_violations_only 0.0341
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 PRO 0.421 0.083 12 0 "[ . 1 . 2 . 3]"
1 3 LEU 0.833 0.102 24 0 "[ . 1 . 2 . 3]"
1 4 GLY 0.412 0.102 24 0 "[ . 1 . 2 . 3]"
1 5 SER 0.495 0.115 17 0 "[ . 1 . 2 . 3]"
1 6 ALA 1.240 0.115 17 0 "[ . 1 . 2 . 3]"
1 7 TRP 1.903 0.098 25 0 "[ . 1 . 2 . 3]"
1 8 GLY 0.365 0.047 26 0 "[ . 1 . 2 . 3]"
1 9 ASN 0.395 0.047 26 0 "[ . 1 . 2 . 3]"
1 10 LEU 2.715 0.133 28 0 "[ . 1 . 2 . 3]"
1 11 SER 0.063 0.012 29 0 "[ . 1 . 2 . 3]"
1 12 TYR 0.741 0.099 19 0 "[ . 1 . 2 . 3]"
1 13 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 14 ASP 0.081 0.033 30 0 "[ . 1 . 2 . 3]"
1 15 LEU 1.953 0.166 2 0 "[ . 1 . 2 . 3]"
1 16 ILE 10.318 0.244 29 0 "[ . 1 . 2 . 3]"
1 17 THR 11.759 0.143 28 0 "[ . 1 . 2 . 3]"
1 18 LYS 1.782 0.166 2 0 "[ . 1 . 2 . 3]"
1 19 ALA 5.461 0.190 29 0 "[ . 1 . 2 . 3]"
1 20 ILE 6.374 0.143 28 0 "[ . 1 . 2 . 3]"
1 21 GLU 3.318 0.115 23 0 "[ . 1 . 2 . 3]"
1 22 SER 1.817 0.087 3 0 "[ . 1 . 2 . 3]"
1 23 SER 3.043 0.109 29 0 "[ . 1 . 2 . 3]"
1 24 ALA 0.361 0.095 28 0 "[ . 1 . 2 . 3]"
1 25 GLU 0.107 0.037 11 0 "[ . 1 . 2 . 3]"
1 26 LYS 2.620 0.095 28 0 "[ . 1 . 2 . 3]"
1 27 ARG 0.578 0.035 29 0 "[ . 1 . 2 . 3]"
1 28 LEU 3.551 0.079 26 0 "[ . 1 . 2 . 3]"
1 29 THR 0.736 0.047 10 0 "[ . 1 . 2 . 3]"
1 30 LEU 1.543 0.125 7 0 "[ . 1 . 2 . 3]"
1 31 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 32 GLN 2.823 0.198 29 0 "[ . 1 . 2 . 3]"
1 33 ILE 5.828 0.198 29 0 "[ . 1 . 2 . 3]"
1 34 TYR 1.763 0.080 29 0 "[ . 1 . 2 . 3]"
1 35 GLU 0.184 0.049 19 0 "[ . 1 . 2 . 3]"
1 36 TRP 2.377 0.090 6 0 "[ . 1 . 2 . 3]"
1 37 MET 0.009 0.009 1 0 "[ . 1 . 2 . 3]"
1 38 VAL 0.996 0.069 24 0 "[ . 1 . 2 . 3]"
1 39 LYS 0.321 0.058 24 0 "[ . 1 . 2 . 3]"
1 40 SER 0.176 0.026 29 0 "[ . 1 . 2 . 3]"
1 41 VAL 2.947 0.120 29 0 "[ . 1 . 2 . 3]"
1 42 PRO 0.725 0.120 29 0 "[ . 1 . 2 . 3]"
1 43 TYR 1.650 0.094 28 0 "[ . 1 . 2 . 3]"
1 44 PHE 1.378 0.082 23 0 "[ . 1 . 2 . 3]"
1 45 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 46 ASP 0.602 0.071 28 0 "[ . 1 . 2 . 3]"
1 47 LYS 1.345 0.082 13 0 "[ . 1 . 2 . 3]"
1 48 GLY 0.501 0.082 13 0 "[ . 1 . 2 . 3]"
1 49 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 50 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 51 ASN 1.280 0.117 29 0 "[ . 1 . 2 . 3]"
1 52 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 53 SER 0.001 0.001 9 0 "[ . 1 . 2 . 3]"
1 54 ALA 1.399 0.117 29 0 "[ . 1 . 2 . 3]"
1 55 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 56 TRP 2.235 0.166 23 0 "[ . 1 . 2 . 3]"
1 57 LYS 0.996 0.114 18 0 "[ . 1 . 2 . 3]"
1 58 ASN 0.746 0.082 23 0 "[ . 1 . 2 . 3]"
1 59 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 60 ILE 5.924 0.244 29 0 "[ . 1 . 2 . 3]"
1 61 ARG 3.286 0.135 29 0 "[ . 1 . 2 . 3]"
1 62 HIS 0.095 0.020 29 0 "[ . 1 . 2 . 3]"
1 63 ASN 0.216 0.126 23 0 "[ . 1 . 2 . 3]"
1 64 LEU 0.457 0.078 11 0 "[ . 1 . 2 . 3]"
1 65 SER 0.236 0.128 24 0 "[ . 1 . 2 . 3]"
1 66 LEU 0.244 0.128 24 0 "[ . 1 . 2 . 3]"
1 69 LYS 2.617 0.351 27 0 "[ . 1 . 2 . 3]"
1 70 PHE 1.890 0.087 5 0 "[ . 1 . 2 . 3]"
1 71 ILE 9.691 0.351 27 0 "[ . 1 . 2 . 3]"
1 72 ARG 0.086 0.035 27 0 "[ . 1 . 2 . 3]"
1 73 VAL 10.043 0.242 14 0 "[ . 1 . 2 . 3]"
1 74 GLN 1.282 0.132 13 0 "[ . 1 . 2 . 3]"
1 75 ASN 4.124 0.242 14 0 "[ . 1 . 2 . 3]"
1 76 GLU 0.500 0.083 29 0 "[ . 1 . 2 . 3]"
1 77 GLY 0.943 0.129 28 0 "[ . 1 . 2 . 3]"
1 78 THR 3.103 0.213 17 0 "[ . 1 . 2 . 3]"
1 79 GLY 2.444 0.213 17 0 "[ . 1 . 2 . 3]"
1 80 LYS 1.273 0.171 14 0 "[ . 1 . 2 . 3]"
1 81 SER 0.676 0.171 14 0 "[ . 1 . 2 . 3]"
1 82 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 83 TRP 4.935 0.139 29 0 "[ . 1 . 2 . 3]"
1 84 TRP 0.729 0.047 10 0 "[ . 1 . 2 . 3]"
1 85 MET 7.571 0.302 28 0 "[ . 1 . 2 . 3]"
1 86 LEU 9.837 0.190 29 0 "[ . 1 . 2 . 3]"
1 87 ASN 1.060 0.060 29 0 "[ . 1 . 2 . 3]"
1 88 PRO 1.574 0.078 28 0 "[ . 1 . 2 . 3]"
1 89 GLU 0.919 0.078 28 0 "[ . 1 . 2 . 3]"
1 90 GLY 0.292 0.033 3 0 "[ . 1 . 2 . 3]"
1 91 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 92 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 93 SER 0.001 0.001 26 0 "[ . 1 . 2 . 3]"
1 94 GLY 0.001 0.001 26 0 "[ . 1 . 2 . 3]"
1 95 LYS 0.183 0.059 8 0 "[ . 1 . 2 . 3]"
1 96 SER 0.183 0.059 8 0 "[ . 1 . 2 . 3]"
1 97 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 98 ARG 0.243 0.074 13 0 "[ . 1 . 2 . 3]"
1 99 ARG 0.303 0.054 25 0 "[ . 1 . 2 . 3]"
1 100 ARG 0.135 0.048 28 0 "[ . 1 . 2 . 3]"
1 101 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 102 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 103 SER 0.034 0.022 12 0 "[ . 1 . 2 . 3]"
1 104 MET 0.034 0.022 12 0 "[ . 1 . 2 . 3]"
1 105 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 109 LYS 0.038 0.010 15 0 "[ . 1 . 2 . 3]"
1 110 PHE 0.038 0.010 15 0 "[ . 1 . 2 . 3]"
1 111 ALA 0.009 0.009 10 0 "[ . 1 . 2 . 3]"
1 112 LYS 0.009 0.009 10 0 "[ . 1 . 2 . 3]"
1 113 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 116 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 117 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 119 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 PRO HA 1 3 LEU H . . 3.160 2.496 2.298 3.243 0.083 12 0 "[ . 1 . 2 . 3]" 1
2 1 2 PRO QB 1 3 LEU H . . 3.380 2.806 2.344 3.408 0.028 25 0 "[ . 1 . 2 . 3]" 1
3 1 2 PRO HB2 1 3 LEU H . . 4.090 2.907 2.385 3.637 . 0 0 "[ . 1 . 2 . 3]" 1
4 1 2 PRO HB3 1 3 LEU H . . 4.090 3.743 3.456 4.118 0.028 12 0 "[ . 1 . 2 . 3]" 1
5 1 3 LEU H 1 3 LEU QB . . 3.500 2.665 2.157 3.342 . 0 0 "[ . 1 . 2 . 3]" 1
6 1 3 LEU H 1 3 LEU MD1 . . 5.290 4.126 2.702 4.643 . 0 0 "[ . 1 . 2 . 3]" 1
7 1 3 LEU H 1 3 LEU QD . . 4.580 3.678 2.670 4.068 . 0 0 "[ . 1 . 2 . 3]" 1
8 1 3 LEU H 1 3 LEU MD2 . . 5.290 4.280 3.035 5.036 . 0 0 "[ . 1 . 2 . 3]" 1
9 1 3 LEU H 1 4 GLY H . . 4.370 4.153 2.948 4.411 0.041 9 0 "[ . 1 . 2 . 3]" 1
10 1 3 LEU HA 1 3 LEU MD1 . . 4.050 3.061 2.120 3.938 . 0 0 "[ . 1 . 2 . 3]" 1
11 1 3 LEU HA 1 3 LEU QD . . 3.120 2.209 1.983 3.071 . 0 0 "[ . 1 . 2 . 3]" 1
12 1 3 LEU HA 1 3 LEU MD2 . . 4.050 2.979 2.099 3.934 . 0 0 "[ . 1 . 2 . 3]" 1
13 1 3 LEU HA 1 4 GLY H . . 3.210 2.317 1.994 2.718 . 0 0 "[ . 1 . 2 . 3]" 1
14 1 3 LEU QB 1 4 GLY H . . 4.020 3.342 2.440 3.928 . 0 0 "[ . 1 . 2 . 3]" 1
15 1 3 LEU QD 1 4 GLY H . . 4.780 3.045 1.961 4.378 . 0 0 "[ . 1 . 2 . 3]" 1
16 1 3 LEU MD1 1 4 GLY H . . 5.500 3.853 2.129 5.602 0.102 24 0 "[ . 1 . 2 . 3]" 1
17 1 3 LEU MD2 1 4 GLY H . . 5.500 3.852 1.966 5.537 0.037 17 0 "[ . 1 . 2 . 3]" 1
18 1 3 LEU HG 1 4 GLY H . . 5.500 3.967 2.054 5.219 . 0 0 "[ . 1 . 2 . 3]" 1
19 1 4 GLY H 1 5 SER H . . 4.640 3.773 1.938 4.595 . 0 0 "[ . 1 . 2 . 3]" 1
20 1 5 SER H 1 6 ALA H . . 5.270 3.697 1.770 4.693 . 0 0 "[ . 1 . 2 . 3]" 1
21 1 5 SER HA 1 6 ALA H . . 3.490 2.753 2.199 3.502 0.012 16 0 "[ . 1 . 2 . 3]" 1
22 1 5 SER HA 1 6 ALA MB . . 4.470 4.154 3.787 4.573 0.103 28 0 "[ . 1 . 2 . 3]" 1
23 1 5 SER QB 1 6 ALA H . . 4.300 3.136 1.853 4.049 . 0 0 "[ . 1 . 2 . 3]" 1
24 1 5 SER QB 1 6 ALA MB . . 4.700 4.098 3.238 4.815 0.115 17 0 "[ . 1 . 2 . 3]" 1
25 1 6 ALA H 1 6 ALA MB . . 3.530 2.609 2.225 2.949 . 0 0 "[ . 1 . 2 . 3]" 1
26 1 6 ALA H 1 7 TRP H . . 4.510 4.202 2.589 4.572 0.062 14 0 "[ . 1 . 2 . 3]" 1
27 1 6 ALA HA 1 7 TRP H . . 3.400 2.805 2.309 3.459 0.059 27 0 "[ . 1 . 2 . 3]" 1
28 1 6 ALA MB 1 7 TRP H . . 3.640 2.125 1.776 3.030 . 0 0 "[ . 1 . 2 . 3]" 1
29 1 6 ALA MB 1 7 TRP HA . . 4.540 4.213 4.028 4.461 . 0 0 "[ . 1 . 2 . 3]" 1
30 1 6 ALA MB 1 7 TRP HD1 . . 5.500 5.031 3.931 5.595 0.095 18 0 "[ . 1 . 2 . 3]" 1
31 1 6 ALA MB 1 7 TRP HE3 . . 4.280 3.453 2.396 4.304 0.024 7 0 "[ . 1 . 2 . 3]" 1
32 1 6 ALA MB 1 7 TRP HZ3 . . 5.040 4.176 2.962 5.076 0.036 29 0 "[ . 1 . 2 . 3]" 1
33 1 7 TRP H 1 7 TRP HB2 . . 3.930 3.238 2.316 3.943 0.013 4 0 "[ . 1 . 2 . 3]" 1
34 1 7 TRP H 1 7 TRP QB . . 3.310 2.771 2.286 3.335 0.025 21 0 "[ . 1 . 2 . 3]" 1
35 1 7 TRP H 1 7 TRP HB3 . . 3.930 3.281 2.621 3.946 0.016 20 0 "[ . 1 . 2 . 3]" 1
36 1 7 TRP H 1 7 TRP HD1 . . 4.500 3.942 3.092 4.521 0.021 2 0 "[ . 1 . 2 . 3]" 1
37 1 7 TRP H 1 7 TRP HE3 . . 4.450 3.158 2.301 4.452 0.002 20 0 "[ . 1 . 2 . 3]" 1
38 1 7 TRP H 1 8 GLY H . . 4.560 3.962 2.082 4.595 0.035 6 0 "[ . 1 . 2 . 3]" 1
39 1 7 TRP HA 1 7 TRP HD1 . . 4.580 3.796 2.556 4.447 . 0 0 "[ . 1 . 2 . 3]" 1
40 1 7 TRP HA 1 7 TRP HE3 . . 4.860 4.558 4.281 4.885 0.025 9 0 "[ . 1 . 2 . 3]" 1
41 1 7 TRP HA 1 8 GLY H . . 3.560 2.625 2.146 3.524 . 0 0 "[ . 1 . 2 . 3]" 1
42 1 7 TRP QB 1 7 TRP HE3 . . 3.550 2.579 2.299 2.990 . 0 0 "[ . 1 . 2 . 3]" 1
43 1 7 TRP QB 1 8 GLY H . . 4.350 2.980 2.079 3.989 . 0 0 "[ . 1 . 2 . 3]" 1
44 1 7 TRP QB 1 10 LEU QD . . 3.590 2.348 1.887 2.750 . 0 0 "[ . 1 . 2 . 3]" 1
45 1 7 TRP HB2 1 10 LEU MD1 . . 4.920 3.245 2.010 4.537 . 0 0 "[ . 1 . 2 . 3]" 1
46 1 7 TRP HB2 1 10 LEU MD2 . . 4.920 3.490 2.431 4.910 . 0 0 "[ . 1 . 2 . 3]" 1
47 1 7 TRP HB3 1 10 LEU MD1 . . 4.920 3.177 2.038 4.881 . 0 0 "[ . 1 . 2 . 3]" 1
48 1 7 TRP HB3 1 10 LEU MD2 . . 4.920 3.339 2.346 4.812 . 0 0 "[ . 1 . 2 . 3]" 1
49 1 7 TRP HD1 1 10 LEU HB2 . . 5.500 5.073 2.440 5.542 0.042 23 0 "[ . 1 . 2 . 3]" 1
50 1 7 TRP HD1 1 10 LEU MD1 . . 5.160 3.076 1.831 4.381 . 0 0 "[ . 1 . 2 . 3]" 1
51 1 7 TRP HD1 1 10 LEU QD . . 4.130 2.752 1.806 3.799 . 0 0 "[ . 1 . 2 . 3]" 1
52 1 7 TRP HD1 1 10 LEU MD2 . . 5.160 3.580 1.912 4.798 . 0 0 "[ . 1 . 2 . 3]" 1
53 1 7 TRP HD1 1 10 LEU HG . . 5.500 3.666 2.546 5.554 0.054 28 0 "[ . 1 . 2 . 3]" 1
54 1 7 TRP HE3 1 10 LEU QD . . 4.320 3.926 3.221 4.348 0.028 6 0 "[ . 1 . 2 . 3]" 1
55 1 7 TRP HZ3 1 10 LEU QD . . 5.440 5.039 3.796 5.538 0.098 25 0 "[ . 1 . 2 . 3]" 1
56 1 8 GLY H 1 9 ASN H . . 4.190 3.073 2.063 4.237 0.047 26 0 "[ . 1 . 2 . 3]" 1
57 1 9 ASN H 1 9 ASN HB2 . . 4.170 3.198 2.403 3.793 . 0 0 "[ . 1 . 2 . 3]" 1
58 1 9 ASN H 1 9 ASN QB . . 3.550 2.794 2.260 3.402 . 0 0 "[ . 1 . 2 . 3]" 1
59 1 9 ASN H 1 9 ASN HB3 . . 4.170 3.262 2.646 4.077 . 0 0 "[ . 1 . 2 . 3]" 1
60 1 9 ASN H 1 10 LEU H . . 3.710 3.593 2.734 3.751 0.041 20 0 "[ . 1 . 2 . 3]" 1
61 1 9 ASN QB 1 10 LEU H . . 4.100 3.925 3.553 4.075 . 0 0 "[ . 1 . 2 . 3]" 1
62 1 9 ASN HB2 1 10 LEU H . . 4.660 4.480 4.027 4.665 0.005 17 0 "[ . 1 . 2 . 3]" 1
63 1 9 ASN HB3 1 10 LEU H . . 4.660 4.354 3.762 4.497 . 0 0 "[ . 1 . 2 . 3]" 1
64 1 10 LEU H 1 10 LEU HB2 . . 3.220 2.341 2.061 2.616 . 0 0 "[ . 1 . 2 . 3]" 1
65 1 10 LEU H 1 10 LEU HB3 . . 3.880 3.573 3.365 3.751 . 0 0 "[ . 1 . 2 . 3]" 1
66 1 10 LEU H 1 10 LEU MD1 . . 4.170 3.553 2.408 4.217 0.047 25 0 "[ . 1 . 2 . 3]" 1
67 1 10 LEU H 1 10 LEU MD2 . . 4.170 3.831 3.449 4.197 0.027 2 0 "[ . 1 . 2 . 3]" 1
68 1 10 LEU H 1 10 LEU HG . . 4.000 3.048 2.282 4.085 0.085 28 0 "[ . 1 . 2 . 3]" 1
69 1 10 LEU H 1 11 SER H . . 4.620 4.567 4.387 4.632 0.012 29 0 "[ . 1 . 2 . 3]" 1
70 1 10 LEU HA 1 10 LEU MD1 . . 3.940 3.597 2.369 3.915 . 0 0 "[ . 1 . 2 . 3]" 1
71 1 10 LEU HA 1 10 LEU QD . . 2.800 2.189 2.048 2.603 . 0 0 "[ . 1 . 2 . 3]" 1
72 1 10 LEU HA 1 10 LEU MD2 . . 3.940 2.446 2.057 3.838 . 0 0 "[ . 1 . 2 . 3]" 1
73 1 10 LEU HA 1 10 LEU HG . . 3.770 2.893 2.186 3.155 . 0 0 "[ . 1 . 2 . 3]" 1
74 1 10 LEU HA 1 11 SER H . . 3.160 2.173 2.096 2.246 . 0 0 "[ . 1 . 2 . 3]" 1
75 1 10 LEU HA 1 14 ASP HB2 . . 4.520 3.578 2.689 4.553 0.033 30 0 "[ . 1 . 2 . 3]" 1
76 1 10 LEU HA 1 14 ASP HB3 . . 4.520 4.203 3.376 4.524 0.004 20 0 "[ . 1 . 2 . 3]" 1
77 1 10 LEU HB2 1 10 LEU QD . . 2.880 2.218 2.089 2.289 . 0 0 "[ . 1 . 2 . 3]" 1
78 1 10 LEU HB2 1 11 SER H . . 4.720 4.203 4.059 4.457 . 0 0 "[ . 1 . 2 . 3]" 1
79 1 10 LEU HB2 1 14 ASP QB . . 4.220 3.789 3.567 4.097 . 0 0 "[ . 1 . 2 . 3]" 1
80 1 10 LEU HB2 1 15 LEU QD . . 3.400 2.513 2.248 2.967 . 0 0 "[ . 1 . 2 . 3]" 1
81 1 10 LEU HB2 1 15 LEU HG . . 4.730 3.068 2.515 3.533 . 0 0 "[ . 1 . 2 . 3]" 1
82 1 10 LEU HB3 1 10 LEU MD1 . . 3.640 2.528 2.263 3.231 . 0 0 "[ . 1 . 2 . 3]" 1
83 1 10 LEU HB3 1 10 LEU QD . . 2.980 2.136 2.082 2.321 . 0 0 "[ . 1 . 2 . 3]" 1
84 1 10 LEU HB3 1 10 LEU MD2 . . 3.640 2.373 2.160 2.486 . 0 0 "[ . 1 . 2 . 3]" 1
85 1 10 LEU HB3 1 11 SER H . . 4.170 3.114 2.811 3.520 . 0 0 "[ . 1 . 2 . 3]" 1
86 1 10 LEU HB3 1 14 ASP HB2 . . 3.970 2.413 2.084 3.441 . 0 0 "[ . 1 . 2 . 3]" 1
87 1 10 LEU HB3 1 14 ASP HB3 . . 3.970 3.104 2.123 3.817 . 0 0 "[ . 1 . 2 . 3]" 1
88 1 10 LEU HB3 1 15 LEU H . . 4.840 3.631 3.318 3.879 . 0 0 "[ . 1 . 2 . 3]" 1
89 1 10 LEU HB3 1 15 LEU HA . . 4.870 4.331 3.930 4.628 . 0 0 "[ . 1 . 2 . 3]" 1
90 1 10 LEU HB3 1 15 LEU MD1 . . 4.230 3.718 3.309 4.082 . 0 0 "[ . 1 . 2 . 3]" 1
91 1 10 LEU HB3 1 15 LEU MD2 . . 4.230 2.978 2.642 3.221 . 0 0 "[ . 1 . 2 . 3]" 1
92 1 10 LEU HB3 1 15 LEU HG . . 4.330 2.508 2.069 2.805 . 0 0 "[ . 1 . 2 . 3]" 1
93 1 10 LEU QD 1 11 SER H . . 4.060 3.410 2.669 4.013 . 0 0 "[ . 1 . 2 . 3]" 1
94 1 10 LEU QD 1 14 ASP QB . . 3.380 2.194 2.013 2.804 . 0 0 "[ . 1 . 2 . 3]" 1
95 1 10 LEU QD 1 15 LEU H . . 4.410 3.959 3.178 4.285 . 0 0 "[ . 1 . 2 . 3]" 1
96 1 10 LEU QD 1 15 LEU HA . . 4.260 3.399 2.599 3.830 . 0 0 "[ . 1 . 2 . 3]" 1
97 1 10 LEU QD 1 15 LEU QD . . 2.860 2.178 2.043 2.588 . 0 0 "[ . 1 . 2 . 3]" 1
98 1 10 LEU QD 1 15 LEU HG . . 4.480 3.239 2.541 3.665 . 0 0 "[ . 1 . 2 . 3]" 1
99 1 10 LEU QD 1 18 LYS QB . . 4.010 3.808 3.179 4.137 0.127 8 0 "[ . 1 . 2 . 3]" 1
100 1 10 LEU QD 1 18 LYS QD . . 3.460 2.473 2.055 3.271 . 0 0 "[ . 1 . 2 . 3]" 1
101 1 10 LEU QD 1 18 LYS QE . . 4.690 2.931 1.896 4.476 . 0 0 "[ . 1 . 2 . 3]" 1
102 1 10 LEU QD 1 36 TRP HH2 . . 4.160 3.923 3.533 4.250 0.090 6 0 "[ . 1 . 2 . 3]" 1
103 1 10 LEU MD1 1 11 SER H . . 5.210 4.707 4.190 5.110 . 0 0 "[ . 1 . 2 . 3]" 1
104 1 10 LEU MD1 1 14 ASP HB2 . . 4.550 3.689 3.124 4.149 . 0 0 "[ . 1 . 2 . 3]" 1
105 1 10 LEU MD1 1 14 ASP HB3 . . 4.550 3.281 2.243 4.111 . 0 0 "[ . 1 . 2 . 3]" 1
106 1 10 LEU MD1 1 15 LEU H . . 5.500 4.674 3.997 5.633 0.133 28 0 "[ . 1 . 2 . 3]" 1
107 1 10 LEU MD2 1 11 SER H . . 5.210 3.584 2.690 5.000 . 0 0 "[ . 1 . 2 . 3]" 1
108 1 10 LEU MD2 1 14 ASP HB2 . . 4.550 2.878 2.560 3.532 . 0 0 "[ . 1 . 2 . 3]" 1
109 1 10 LEU MD2 1 14 ASP HB3 . . 4.550 2.411 2.109 3.381 . 0 0 "[ . 1 . 2 . 3]" 1
110 1 10 LEU MD2 1 15 LEU H . . 5.500 4.567 3.196 5.050 . 0 0 "[ . 1 . 2 . 3]" 1
111 1 10 LEU HG 1 11 SER H . . 5.230 4.687 3.343 5.088 . 0 0 "[ . 1 . 2 . 3]" 1
112 1 10 LEU HG 1 14 ASP HB2 . . 5.500 4.533 2.469 5.533 0.033 6 0 "[ . 1 . 2 . 3]" 1
113 1 10 LEU HG 1 14 ASP QB . . 4.820 3.972 1.990 4.614 . 0 0 "[ . 1 . 2 . 3]" 1
114 1 10 LEU HG 1 14 ASP HB3 . . 5.500 4.431 2.099 5.286 . 0 0 "[ . 1 . 2 . 3]" 1
115 1 11 SER H 1 11 SER HB2 . . 4.140 2.547 2.389 3.636 . 0 0 "[ . 1 . 2 . 3]" 1
116 1 11 SER H 1 11 SER QB . . 3.480 2.421 2.263 2.527 . 0 0 "[ . 1 . 2 . 3]" 1
117 1 11 SER H 1 11 SER HB3 . . 4.140 3.491 2.445 3.622 . 0 0 "[ . 1 . 2 . 3]" 1
118 1 11 SER H 1 14 ASP H . . 4.550 3.669 3.367 4.240 . 0 0 "[ . 1 . 2 . 3]" 1
119 1 11 SER H 1 14 ASP HB2 . . 4.360 2.763 2.459 3.498 . 0 0 "[ . 1 . 2 . 3]" 1
120 1 11 SER H 1 14 ASP QB . . 3.690 2.704 2.429 3.221 . 0 0 "[ . 1 . 2 . 3]" 1
121 1 11 SER H 1 14 ASP HB3 . . 4.360 3.942 3.515 4.104 . 0 0 "[ . 1 . 2 . 3]" 1
122 1 11 SER QB 1 14 ASP H . . 4.530 2.725 2.332 3.697 . 0 0 "[ . 1 . 2 . 3]" 1
123 1 11 SER QB 1 14 ASP QB . . 4.330 3.524 2.557 4.202 . 0 0 "[ . 1 . 2 . 3]" 1
124 1 11 SER HB2 1 12 TYR H . . 4.200 3.467 2.340 3.832 . 0 0 "[ . 1 . 2 . 3]" 1
125 1 11 SER HB2 1 13 ALA H . . 4.620 3.329 3.017 4.545 . 0 0 "[ . 1 . 2 . 3]" 1
126 1 11 SER HB3 1 12 TYR H . . 4.200 2.541 2.184 3.851 . 0 0 "[ . 1 . 2 . 3]" 1
127 1 11 SER HB3 1 13 ALA H . . 4.620 3.179 2.881 4.539 . 0 0 "[ . 1 . 2 . 3]" 1
128 1 12 TYR H 1 12 TYR HB2 . . 4.190 2.237 2.123 2.348 . 0 0 "[ . 1 . 2 . 3]" 1
129 1 12 TYR H 1 12 TYR QB . . 3.580 2.214 2.104 2.319 . 0 0 "[ . 1 . 2 . 3]" 1
130 1 12 TYR H 1 12 TYR HB3 . . 4.190 3.531 3.451 3.588 . 0 0 "[ . 1 . 2 . 3]" 1
131 1 12 TYR H 1 12 TYR QD . . 4.110 2.678 2.263 3.023 . 0 0 "[ . 1 . 2 . 3]" 1
132 1 12 TYR HA 1 12 TYR QD . . 3.700 2.918 2.795 3.053 . 0 0 "[ . 1 . 2 . 3]" 1
133 1 12 TYR HA 1 12 TYR QE . . 4.530 4.531 4.493 4.554 0.024 28 0 "[ . 1 . 2 . 3]" 1
134 1 12 TYR HA 1 15 LEU H . . 4.360 3.521 3.444 3.666 . 0 0 "[ . 1 . 2 . 3]" 1
135 1 12 TYR HA 1 15 LEU HB2 . . 3.980 2.844 2.731 2.956 . 0 0 "[ . 1 . 2 . 3]" 1
136 1 12 TYR HA 1 15 LEU HB3 . . 5.240 4.490 4.358 4.625 . 0 0 "[ . 1 . 2 . 3]" 1
137 1 12 TYR HA 1 15 LEU QD . . 3.320 2.626 2.287 2.788 . 0 0 "[ . 1 . 2 . 3]" 1
138 1 12 TYR HA 1 15 LEU HG . . 4.810 3.920 3.718 4.105 . 0 0 "[ . 1 . 2 . 3]" 1
139 1 12 TYR HA 1 16 ILE MD . . 4.350 4.061 3.949 4.300 . 0 0 "[ . 1 . 2 . 3]" 1
140 1 12 TYR QB 1 13 ALA H . . 3.510 2.555 2.436 2.643 . 0 0 "[ . 1 . 2 . 3]" 1
141 1 12 TYR QB 1 13 ALA MB . . 3.930 3.805 3.713 3.872 . 0 0 "[ . 1 . 2 . 3]" 1
142 1 12 TYR QB 1 15 LEU QD . . 5.280 4.446 4.175 4.573 . 0 0 "[ . 1 . 2 . 3]" 1
143 1 12 TYR QB 1 16 ILE MD . . 3.920 2.574 2.412 2.832 . 0 0 "[ . 1 . 2 . 3]" 1
144 1 12 TYR QB 1 63 ASN QD . . 4.200 2.580 2.261 3.672 . 0 0 "[ . 1 . 2 . 3]" 1
145 1 12 TYR HB2 1 13 ALA H . . 4.080 2.709 2.534 2.824 . 0 0 "[ . 1 . 2 . 3]" 1
146 1 12 TYR HB3 1 13 ALA H . . 4.080 3.151 2.934 3.374 . 0 0 "[ . 1 . 2 . 3]" 1
147 1 12 TYR QD 1 15 LEU QD . . 4.130 4.095 3.797 4.229 0.099 19 0 "[ . 1 . 2 . 3]" 1
148 1 12 TYR QD 1 16 ILE MD . . 4.050 3.084 2.791 3.389 . 0 0 "[ . 1 . 2 . 3]" 1
149 1 12 TYR QD 1 16 ILE QG . . 4.640 3.511 3.167 4.134 . 0 0 "[ . 1 . 2 . 3]" 1
150 1 12 TYR QD 1 60 ILE MD . . 4.350 3.666 3.393 4.141 . 0 0 "[ . 1 . 2 . 3]" 1
151 1 12 TYR QD 1 60 ILE MG . . 5.450 4.276 4.049 4.594 . 0 0 "[ . 1 . 2 . 3]" 1
152 1 12 TYR QE 1 60 ILE MD . . 4.570 3.307 2.928 3.966 . 0 0 "[ . 1 . 2 . 3]" 1
153 1 13 ALA H 1 13 ALA MB . . 3.140 2.226 2.214 2.235 . 0 0 "[ . 1 . 2 . 3]" 1
154 1 13 ALA H 1 14 ASP H . . 3.650 2.817 2.706 2.919 . 0 0 "[ . 1 . 2 . 3]" 1
155 1 13 ALA H 1 15 LEU H . . 4.700 4.310 4.216 4.475 . 0 0 "[ . 1 . 2 . 3]" 1
156 1 13 ALA HA 1 16 ILE HB . . 3.970 2.784 2.677 2.869 . 0 0 "[ . 1 . 2 . 3]" 1
157 1 13 ALA HA 1 16 ILE MD . . 3.290 2.200 2.036 2.347 . 0 0 "[ . 1 . 2 . 3]" 1
158 1 13 ALA HA 1 16 ILE QG . . 4.330 3.709 3.504 3.812 . 0 0 "[ . 1 . 2 . 3]" 1
159 1 13 ALA HA 1 16 ILE MG . . 4.360 4.127 4.053 4.210 . 0 0 "[ . 1 . 2 . 3]" 1
160 1 13 ALA HA 1 70 PHE QE . . 4.410 2.999 2.669 3.186 . 0 0 "[ . 1 . 2 . 3]" 1
161 1 13 ALA HA 1 70 PHE HZ . . 4.310 2.404 2.187 2.691 . 0 0 "[ . 1 . 2 . 3]" 1
162 1 13 ALA MB 1 14 ASP H . . 3.530 2.591 2.556 2.687 . 0 0 "[ . 1 . 2 . 3]" 1
163 1 13 ALA MB 1 14 ASP QB . . 5.270 4.344 3.836 4.476 . 0 0 "[ . 1 . 2 . 3]" 1
164 1 13 ALA MB 1 15 LEU H . . 5.060 4.579 4.540 4.677 . 0 0 "[ . 1 . 2 . 3]" 1
165 1 13 ALA MB 1 16 ILE MD . . 3.680 3.570 3.419 3.677 . 0 0 "[ . 1 . 2 . 3]" 1
166 1 13 ALA MB 1 70 PHE QD . . 4.920 4.636 4.481 4.846 . 0 0 "[ . 1 . 2 . 3]" 1
167 1 13 ALA MB 1 70 PHE QE . . 3.590 2.769 2.544 3.028 . 0 0 "[ . 1 . 2 . 3]" 1
168 1 13 ALA MB 1 70 PHE HZ . . 3.740 2.783 2.456 3.346 . 0 0 "[ . 1 . 2 . 3]" 1
169 1 14 ASP H 1 14 ASP HB2 . . 3.810 2.501 2.056 2.628 . 0 0 "[ . 1 . 2 . 3]" 1
170 1 14 ASP H 1 14 ASP QB . . 3.280 2.451 2.027 2.568 . 0 0 "[ . 1 . 2 . 3]" 1
171 1 14 ASP H 1 14 ASP HB3 . . 3.810 3.540 2.840 3.638 . 0 0 "[ . 1 . 2 . 3]" 1
172 1 14 ASP H 1 15 LEU H . . 3.700 2.629 2.552 2.671 . 0 0 "[ . 1 . 2 . 3]" 1
173 1 14 ASP QB 1 15 LEU QD . . 3.950 3.576 3.425 3.806 . 0 0 "[ . 1 . 2 . 3]" 1
174 1 14 ASP QB 1 15 LEU HG . . 4.500 3.136 2.912 3.355 . 0 0 "[ . 1 . 2 . 3]" 1
175 1 14 ASP HB2 1 15 LEU H . . 3.910 2.610 2.378 3.632 . 0 0 "[ . 1 . 2 . 3]" 1
176 1 14 ASP HB3 1 15 LEU H . . 3.910 3.559 2.571 3.770 . 0 0 "[ . 1 . 2 . 3]" 1
177 1 15 LEU H 1 15 LEU HB2 . . 3.590 2.394 2.346 2.433 . 0 0 "[ . 1 . 2 . 3]" 1
178 1 15 LEU H 1 15 LEU HB3 . . 3.830 3.587 3.553 3.603 . 0 0 "[ . 1 . 2 . 3]" 1
179 1 15 LEU H 1 15 LEU MD1 . . 3.810 3.487 3.399 3.552 . 0 0 "[ . 1 . 2 . 3]" 1
180 1 15 LEU H 1 15 LEU QD . . 3.250 3.150 3.102 3.207 . 0 0 "[ . 1 . 2 . 3]" 1
181 1 15 LEU H 1 15 LEU MD2 . . 3.810 3.594 3.484 3.700 . 0 0 "[ . 1 . 2 . 3]" 1
182 1 15 LEU H 1 15 LEU HG . . 3.910 2.376 2.273 2.472 . 0 0 "[ . 1 . 2 . 3]" 1
183 1 15 LEU H 1 16 ILE H . . 3.780 2.654 2.544 2.814 . 0 0 "[ . 1 . 2 . 3]" 1
184 1 15 LEU HA 1 15 LEU MD1 . . 3.930 3.876 3.857 3.910 . 0 0 "[ . 1 . 2 . 3]" 1
185 1 15 LEU HA 1 15 LEU QD . . 2.660 2.126 2.095 2.196 . 0 0 "[ . 1 . 2 . 3]" 1
186 1 15 LEU HA 1 15 LEU MD2 . . 3.930 2.135 2.104 2.207 . 0 0 "[ . 1 . 2 . 3]" 1
187 1 15 LEU HA 1 15 LEU HG . . 4.250 2.980 2.899 3.059 . 0 0 "[ . 1 . 2 . 3]" 1
188 1 15 LEU HA 1 18 LYS H . . 4.600 3.215 3.092 3.321 . 0 0 "[ . 1 . 2 . 3]" 1
189 1 15 LEU HA 1 18 LYS QB . . 3.500 2.377 2.155 2.561 . 0 0 "[ . 1 . 2 . 3]" 1
190 1 15 LEU HA 1 18 LYS QD . . 4.400 3.409 2.741 4.340 . 0 0 "[ . 1 . 2 . 3]" 1
191 1 15 LEU HA 1 18 LYS HG2 . . 5.140 4.862 4.297 5.181 0.041 29 0 "[ . 1 . 2 . 3]" 1
192 1 15 LEU HA 1 18 LYS QG . . 4.360 3.469 2.775 3.940 . 0 0 "[ . 1 . 2 . 3]" 1
193 1 15 LEU HA 1 18 LYS HG3 . . 5.140 3.555 2.810 4.093 . 0 0 "[ . 1 . 2 . 3]" 1
194 1 15 LEU HA 1 19 ALA H . . 4.510 4.097 3.984 4.217 . 0 0 "[ . 1 . 2 . 3]" 1
195 1 15 LEU HA 1 36 TRP HH2 . . 4.490 3.220 2.915 3.440 . 0 0 "[ . 1 . 2 . 3]" 1
196 1 15 LEU HA 1 36 TRP HZ3 . . 4.620 3.124 2.931 3.359 . 0 0 "[ . 1 . 2 . 3]" 1
197 1 15 LEU HA 1 41 VAL QG . . 4.750 4.670 4.531 4.763 0.013 8 0 "[ . 1 . 2 . 3]" 1
198 1 15 LEU HB2 1 15 LEU MD1 . . 3.400 2.253 2.213 2.276 . 0 0 "[ . 1 . 2 . 3]" 1
199 1 15 LEU HB2 1 15 LEU QD . . 2.900 2.212 2.174 2.233 . 0 0 "[ . 1 . 2 . 3]" 1
200 1 15 LEU HB2 1 15 LEU MD2 . . 3.400 3.227 3.198 3.238 . 0 0 "[ . 1 . 2 . 3]" 1
201 1 15 LEU HB2 1 16 ILE H . . 4.040 2.641 2.531 2.719 . 0 0 "[ . 1 . 2 . 3]" 1
202 1 15 LEU HB2 1 33 ILE MG . . 5.500 5.309 5.193 5.439 . 0 0 "[ . 1 . 2 . 3]" 1
203 1 15 LEU HB2 1 36 TRP HZ3 . . 4.730 4.026 3.813 4.297 . 0 0 "[ . 1 . 2 . 3]" 1
204 1 15 LEU HB2 1 37 MET ME . . 3.860 2.379 2.229 2.478 . 0 0 "[ . 1 . 2 . 3]" 1
205 1 15 LEU HB2 1 41 VAL QG . . 5.440 4.576 4.245 4.875 . 0 0 "[ . 1 . 2 . 3]" 1
206 1 15 LEU HB2 1 44 PHE QE . . 5.350 4.489 3.484 5.038 . 0 0 "[ . 1 . 2 . 3]" 1
207 1 15 LEU HB3 1 15 LEU MD1 . . 3.560 2.433 2.405 2.514 . 0 0 "[ . 1 . 2 . 3]" 1
208 1 15 LEU HB3 1 15 LEU QD . . 2.940 2.117 2.101 2.131 . 0 0 "[ . 1 . 2 . 3]" 1
209 1 15 LEU HB3 1 15 LEU MD2 . . 3.560 2.329 2.287 2.360 . 0 0 "[ . 1 . 2 . 3]" 1
210 1 15 LEU HB3 1 16 ILE H . . 4.320 3.608 3.526 3.691 . 0 0 "[ . 1 . 2 . 3]" 1
211 1 15 LEU HB3 1 36 TRP HH2 . . 4.820 4.105 3.855 4.372 . 0 0 "[ . 1 . 2 . 3]" 1
212 1 15 LEU HB3 1 36 TRP HZ3 . . 4.190 2.286 2.068 2.563 . 0 0 "[ . 1 . 2 . 3]" 1
213 1 15 LEU HB3 1 41 VAL QG . . 4.180 3.612 3.248 3.855 . 0 0 "[ . 1 . 2 . 3]" 1
214 1 15 LEU QD 1 16 ILE H . . 4.100 4.104 4.013 4.145 0.045 19 0 "[ . 1 . 2 . 3]" 1
215 1 15 LEU QD 1 18 LYS H . . 5.290 4.686 4.565 4.870 . 0 0 "[ . 1 . 2 . 3]" 1
216 1 15 LEU QD 1 18 LYS QB . . 3.610 3.368 3.178 3.544 . 0 0 "[ . 1 . 2 . 3]" 1
217 1 15 LEU QD 1 18 LYS QD . . 3.710 2.993 2.321 3.876 0.166 2 0 "[ . 1 . 2 . 3]" 1
218 1 15 LEU QD 1 18 LYS QE . . 5.200 4.288 3.247 5.258 0.058 5 0 "[ . 1 . 2 . 3]" 1
219 1 15 LEU QD 1 19 ALA MB . . 5.440 4.931 4.811 5.047 . 0 0 "[ . 1 . 2 . 3]" 1
220 1 15 LEU QD 1 36 TRP HH2 . . 3.340 2.639 2.315 2.878 . 0 0 "[ . 1 . 2 . 3]" 1
221 1 15 LEU QD 1 36 TRP HZ3 . . 3.290 2.292 2.124 2.495 . 0 0 "[ . 1 . 2 . 3]" 1
222 1 15 LEU QD 1 37 MET ME . . 3.680 3.057 2.917 3.131 . 0 0 "[ . 1 . 2 . 3]" 1
223 1 15 LEU QD 1 37 MET HG3 . . 5.110 4.433 4.208 4.682 . 0 0 "[ . 1 . 2 . 3]" 1
224 1 15 LEU QD 1 41 VAL HA . . 5.440 4.639 4.392 4.834 . 0 0 "[ . 1 . 2 . 3]" 1
225 1 15 LEU QD 1 41 VAL QG . . 2.580 1.968 1.891 2.031 . 0 0 "[ . 1 . 2 . 3]" 1
226 1 15 LEU QD 1 43 TYR HB3 . . 5.440 4.790 4.420 5.018 . 0 0 "[ . 1 . 2 . 3]" 1
227 1 15 LEU QD 1 44 PHE QE . . 3.790 2.128 1.964 2.313 . 0 0 "[ . 1 . 2 . 3]" 1
228 1 15 LEU MD1 1 16 ILE H . . 4.820 4.464 4.312 4.535 . 0 0 "[ . 1 . 2 . 3]" 1
229 1 15 LEU MD1 1 36 TRP HZ3 . . 4.720 3.692 3.504 3.924 . 0 0 "[ . 1 . 2 . 3]" 1
230 1 15 LEU MD1 1 37 MET ME . . 4.500 3.176 3.018 3.264 . 0 0 "[ . 1 . 2 . 3]" 1
231 1 15 LEU MD1 1 37 MET HG2 . . 4.940 3.483 3.132 3.834 . 0 0 "[ . 1 . 2 . 3]" 1
232 1 15 LEU MD1 1 41 VAL MG1 . . 3.610 3.081 2.727 3.430 . 0 0 "[ . 1 . 2 . 3]" 1
233 1 15 LEU MD1 1 41 VAL MG2 . . 3.610 2.455 2.173 3.055 . 0 0 "[ . 1 . 2 . 3]" 1
234 1 15 LEU MD2 1 16 ILE H . . 4.820 4.788 4.760 4.819 . 0 0 "[ . 1 . 2 . 3]" 1
235 1 15 LEU MD2 1 36 TRP HZ3 . . 4.720 2.315 2.142 2.524 . 0 0 "[ . 1 . 2 . 3]" 1
236 1 15 LEU MD2 1 37 MET ME . . 4.500 3.988 3.868 4.083 . 0 0 "[ . 1 . 2 . 3]" 1
237 1 15 LEU MD2 1 37 MET HG2 . . 4.940 3.683 3.340 3.978 . 0 0 "[ . 1 . 2 . 3]" 1
238 1 15 LEU MD2 1 41 VAL MG1 . . 3.610 3.482 3.239 3.628 0.018 22 0 "[ . 1 . 2 . 3]" 1
239 1 15 LEU MD2 1 41 VAL MG2 . . 3.610 2.143 1.988 2.252 . 0 0 "[ . 1 . 2 . 3]" 1
240 1 15 LEU HG 1 41 VAL MG1 . . 5.500 5.373 5.099 5.508 0.008 12 0 "[ . 1 . 2 . 3]" 1
241 1 15 LEU HG 1 41 VAL QG . . 4.240 4.180 4.065 4.314 0.074 29 0 "[ . 1 . 2 . 3]" 1
242 1 15 LEU HG 1 41 VAL MG2 . . 5.500 4.360 4.236 4.532 . 0 0 "[ . 1 . 2 . 3]" 1
243 1 16 ILE H 1 16 ILE HB . . 3.540 2.510 2.485 2.537 . 0 0 "[ . 1 . 2 . 3]" 1
244 1 16 ILE H 1 16 ILE MD . . 3.450 3.341 3.290 3.405 . 0 0 "[ . 1 . 2 . 3]" 1
245 1 16 ILE H 1 16 ILE HG12 . . 3.920 3.658 3.617 3.703 . 0 0 "[ . 1 . 2 . 3]" 1
246 1 16 ILE H 1 16 ILE QG . . 3.300 2.211 2.166 2.260 . 0 0 "[ . 1 . 2 . 3]" 1
247 1 16 ILE H 1 16 ILE HG13 . . 3.920 2.230 2.183 2.280 . 0 0 "[ . 1 . 2 . 3]" 1
248 1 16 ILE H 1 16 ILE MG . . 3.860 3.803 3.786 3.818 . 0 0 "[ . 1 . 2 . 3]" 1
249 1 16 ILE H 1 17 THR H . . 3.810 2.630 2.602 2.673 . 0 0 "[ . 1 . 2 . 3]" 1
250 1 16 ILE H 1 19 ALA H . . 5.470 4.808 4.750 4.907 . 0 0 "[ . 1 . 2 . 3]" 1
251 1 16 ILE H 1 33 ILE MG . . 4.570 4.588 4.525 4.634 0.064 14 0 "[ . 1 . 2 . 3]" 1
252 1 16 ILE H 1 37 MET ME . . 4.380 3.004 2.926 3.090 . 0 0 "[ . 1 . 2 . 3]" 1
253 1 16 ILE H 1 70 PHE HZ . . 5.500 4.323 4.021 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
254 1 16 ILE HA 1 16 ILE MD . . 3.950 3.941 3.914 3.959 0.009 23 0 "[ . 1 . 2 . 3]" 1
255 1 16 ILE HA 1 16 ILE HG12 . . 3.770 2.727 2.699 2.749 . 0 0 "[ . 1 . 2 . 3]" 1
256 1 16 ILE HA 1 16 ILE HG13 . . 3.770 2.821 2.778 2.857 . 0 0 "[ . 1 . 2 . 3]" 1
257 1 16 ILE HA 1 16 ILE MG . . 3.110 2.464 2.439 2.484 . 0 0 "[ . 1 . 2 . 3]" 1
258 1 16 ILE HA 1 19 ALA H . . 3.980 3.559 3.425 3.651 . 0 0 "[ . 1 . 2 . 3]" 1
259 1 16 ILE HA 1 19 ALA MB . . 3.390 2.922 2.786 3.062 . 0 0 "[ . 1 . 2 . 3]" 1
260 1 16 ILE HA 1 33 ILE MG . . 3.590 2.393 2.299 2.468 . 0 0 "[ . 1 . 2 . 3]" 1
261 1 16 ILE HA 1 37 MET ME . . 3.660 2.709 2.478 2.844 . 0 0 "[ . 1 . 2 . 3]" 1
262 1 16 ILE HA 1 60 ILE MD . . 5.500 4.928 4.694 5.131 . 0 0 "[ . 1 . 2 . 3]" 1
263 1 16 ILE HB 1 16 ILE MD . . 3.150 2.291 2.260 2.332 . 0 0 "[ . 1 . 2 . 3]" 1
264 1 16 ILE HB 1 17 THR H . . 3.840 2.480 2.417 2.529 . 0 0 "[ . 1 . 2 . 3]" 1
265 1 16 ILE HB 1 20 ILE MD . . 4.600 4.215 4.091 4.327 . 0 0 "[ . 1 . 2 . 3]" 1
266 1 16 ILE HB 1 60 ILE MG . . 5.350 4.462 4.408 4.524 . 0 0 "[ . 1 . 2 . 3]" 1
267 1 16 ILE HB 1 70 PHE QE . . 4.260 3.181 3.025 3.294 . 0 0 "[ . 1 . 2 . 3]" 1
268 1 16 ILE HB 1 70 PHE HZ . . 3.920 2.504 2.110 2.882 . 0 0 "[ . 1 . 2 . 3]" 1
269 1 16 ILE MD 1 16 ILE MG . . 2.800 2.152 2.128 2.183 . 0 0 "[ . 1 . 2 . 3]" 1
270 1 16 ILE MD 1 17 THR H . . 4.480 4.287 4.233 4.368 . 0 0 "[ . 1 . 2 . 3]" 1
271 1 16 ILE MD 1 37 MET ME . . 3.920 3.218 3.109 3.296 . 0 0 "[ . 1 . 2 . 3]" 1
272 1 16 ILE MD 1 60 ILE HA . . 3.310 2.137 2.022 2.380 . 0 0 "[ . 1 . 2 . 3]" 1
273 1 16 ILE MD 1 60 ILE MD . . 4.500 4.022 3.870 4.178 . 0 0 "[ . 1 . 2 . 3]" 1
274 1 16 ILE MD 1 60 ILE MG . . 3.050 2.214 2.152 2.249 . 0 0 "[ . 1 . 2 . 3]" 1
275 1 16 ILE MD 1 63 ASN H . . 4.580 3.946 3.726 4.177 . 0 0 "[ . 1 . 2 . 3]" 1
276 1 16 ILE MD 1 63 ASN HB2 . . 3.670 2.330 2.245 2.488 . 0 0 "[ . 1 . 2 . 3]" 1
277 1 16 ILE MD 1 63 ASN QB . . 3.090 2.135 2.041 2.292 . 0 0 "[ . 1 . 2 . 3]" 1
278 1 16 ILE MD 1 63 ASN HB3 . . 3.670 2.501 2.295 2.952 . 0 0 "[ . 1 . 2 . 3]" 1
279 1 16 ILE MD 1 63 ASN QD . . 4.170 3.681 3.205 4.296 0.126 23 0 "[ . 1 . 2 . 3]" 1
280 1 16 ILE MD 1 64 LEU HA . . 4.620 4.105 3.608 4.490 . 0 0 "[ . 1 . 2 . 3]" 1
281 1 16 ILE MD 1 64 LEU MD1 . . 3.970 3.712 3.537 3.919 . 0 0 "[ . 1 . 2 . 3]" 1
282 1 16 ILE MD 1 64 LEU MD2 . . 3.550 3.120 2.931 3.272 . 0 0 "[ . 1 . 2 . 3]" 1
283 1 16 ILE MD 1 64 LEU HG . . 3.600 2.599 2.339 2.815 . 0 0 "[ . 1 . 2 . 3]" 1
284 1 16 ILE MD 1 70 PHE QD . . 4.370 4.386 4.225 4.457 0.087 5 0 "[ . 1 . 2 . 3]" 1
285 1 16 ILE MD 1 70 PHE QE . . 3.680 3.293 2.944 3.545 . 0 0 "[ . 1 . 2 . 3]" 1
286 1 16 ILE MD 1 70 PHE HZ . . 3.870 3.283 3.164 3.517 . 0 0 "[ . 1 . 2 . 3]" 1
287 1 16 ILE QG 1 16 ILE MG . . 2.820 2.191 2.153 2.214 . 0 0 "[ . 1 . 2 . 3]" 1
288 1 16 ILE QG 1 33 ILE MG . . 4.020 2.461 2.342 2.595 . 0 0 "[ . 1 . 2 . 3]" 1
289 1 16 ILE QG 1 37 MET ME . . 3.970 2.095 2.034 2.181 . 0 0 "[ . 1 . 2 . 3]" 1
290 1 16 ILE QG 1 60 ILE MD . . 4.710 3.423 3.231 3.613 . 0 0 "[ . 1 . 2 . 3]" 1
291 1 16 ILE QG 1 60 ILE MG . . 3.430 2.121 2.036 2.223 . 0 0 "[ . 1 . 2 . 3]" 1
292 1 16 ILE HG12 1 16 ILE MG . . 3.390 2.234 2.192 2.258 . 0 0 "[ . 1 . 2 . 3]" 1
293 1 16 ILE HG12 1 60 ILE MG . . 4.300 2.141 2.054 2.246 . 0 0 "[ . 1 . 2 . 3]" 1
294 1 16 ILE HG13 1 16 ILE MG . . 3.390 3.171 3.152 3.185 . 0 0 "[ . 1 . 2 . 3]" 1
295 1 16 ILE HG13 1 60 ILE MG . . 4.300 3.434 3.257 3.540 . 0 0 "[ . 1 . 2 . 3]" 1
296 1 16 ILE MG 1 17 THR H . . 3.830 3.365 3.287 3.428 . 0 0 "[ . 1 . 2 . 3]" 1
297 1 16 ILE MG 1 17 THR HB . . 5.060 5.131 5.083 5.190 0.130 29 0 "[ . 1 . 2 . 3]" 1
298 1 16 ILE MG 1 17 THR MG . . 4.890 4.966 4.912 5.028 0.138 28 0 "[ . 1 . 2 . 3]" 1
299 1 16 ILE MG 1 19 ALA MB . . 4.170 3.677 3.543 3.817 . 0 0 "[ . 1 . 2 . 3]" 1
300 1 16 ILE MG 1 20 ILE H . . 4.510 4.252 4.137 4.378 . 0 0 "[ . 1 . 2 . 3]" 1
301 1 16 ILE MG 1 20 ILE MD . . 2.830 2.269 2.146 2.392 . 0 0 "[ . 1 . 2 . 3]" 1
302 1 16 ILE MG 1 20 ILE HG12 . . 4.650 4.256 4.123 4.401 . 0 0 "[ . 1 . 2 . 3]" 1
303 1 16 ILE MG 1 20 ILE HG13 . . 4.100 3.342 3.213 3.502 . 0 0 "[ . 1 . 2 . 3]" 1
304 1 16 ILE MG 1 33 ILE HA . . 5.500 5.108 4.948 5.267 . 0 0 "[ . 1 . 2 . 3]" 1
305 1 16 ILE MG 1 33 ILE MD . . 3.150 2.461 2.314 2.589 . 0 0 "[ . 1 . 2 . 3]" 1
306 1 16 ILE MG 1 33 ILE MG . . 3.210 2.242 2.097 2.369 . 0 0 "[ . 1 . 2 . 3]" 1
307 1 16 ILE MG 1 37 MET ME . . 4.400 3.706 3.579 3.808 . 0 0 "[ . 1 . 2 . 3]" 1
308 1 16 ILE MG 1 60 ILE HA . . 5.500 4.797 4.652 5.021 . 0 0 "[ . 1 . 2 . 3]" 1
309 1 16 ILE MG 1 60 ILE HB . . 5.500 5.620 5.545 5.744 0.244 29 0 "[ . 1 . 2 . 3]" 1
310 1 16 ILE MG 1 60 ILE MG . . 3.910 2.912 2.846 3.010 . 0 0 "[ . 1 . 2 . 3]" 1
311 1 16 ILE MG 1 63 ASN HB2 . . 5.500 4.728 4.423 5.182 . 0 0 "[ . 1 . 2 . 3]" 1
312 1 16 ILE MG 1 63 ASN QB . . 4.820 4.123 3.919 4.409 . 0 0 "[ . 1 . 2 . 3]" 1
313 1 16 ILE MG 1 63 ASN HB3 . . 5.500 4.556 4.256 4.957 . 0 0 "[ . 1 . 2 . 3]" 1
314 1 16 ILE MG 1 64 LEU MD2 . . 3.140 2.151 2.074 2.278 . 0 0 "[ . 1 . 2 . 3]" 1
315 1 16 ILE MG 1 64 LEU HG . . 4.270 3.007 2.776 3.258 . 0 0 "[ . 1 . 2 . 3]" 1
316 1 16 ILE MG 1 70 PHE QB . . 4.520 4.234 4.025 4.410 . 0 0 "[ . 1 . 2 . 3]" 1
317 1 16 ILE MG 1 70 PHE QD . . 3.760 3.403 3.174 3.521 . 0 0 "[ . 1 . 2 . 3]" 1
318 1 16 ILE MG 1 70 PHE QE . . 3.310 2.607 2.462 2.743 . 0 0 "[ . 1 . 2 . 3]" 1
319 1 16 ILE MG 1 70 PHE HZ . . 3.690 3.321 2.924 3.648 . 0 0 "[ . 1 . 2 . 3]" 1
320 1 16 ILE MG 1 86 LEU MD2 . . 3.910 3.883 3.729 3.984 0.074 4 0 "[ . 1 . 2 . 3]" 1
321 1 17 THR H 1 17 THR HB . . 3.870 2.432 2.389 2.485 . 0 0 "[ . 1 . 2 . 3]" 1
322 1 17 THR H 1 17 THR HG1 . . 3.880 2.273 2.156 2.332 . 0 0 "[ . 1 . 2 . 3]" 1
323 1 17 THR H 1 17 THR MG . . 3.960 3.739 3.724 3.759 . 0 0 "[ . 1 . 2 . 3]" 1
324 1 17 THR H 1 18 LYS H . . 3.700 2.790 2.711 2.850 . 0 0 "[ . 1 . 2 . 3]" 1
325 1 17 THR H 1 18 LYS QB . . 4.720 4.611 4.398 4.738 0.018 23 0 "[ . 1 . 2 . 3]" 1
326 1 17 THR H 1 70 PHE QD . . 5.500 5.505 5.356 5.534 0.034 29 0 "[ . 1 . 2 . 3]" 1
327 1 17 THR H 1 70 PHE QE . . 4.580 3.249 3.083 3.319 . 0 0 "[ . 1 . 2 . 3]" 1
328 1 17 THR H 1 70 PHE HZ . . 4.260 3.146 2.635 3.368 . 0 0 "[ . 1 . 2 . 3]" 1
329 1 17 THR HA 1 17 THR MG . . 2.800 2.397 2.373 2.441 . 0 0 "[ . 1 . 2 . 3]" 1
330 1 17 THR HA 1 18 LYS QB . . 5.470 5.367 5.251 5.442 . 0 0 "[ . 1 . 2 . 3]" 1
331 1 17 THR HB 1 18 LYS H . . 4.260 2.542 2.492 2.609 . 0 0 "[ . 1 . 2 . 3]" 1
332 1 17 THR HB 1 20 ILE MD . . 4.990 5.001 4.973 5.036 0.046 17 0 "[ . 1 . 2 . 3]" 1
333 1 17 THR HB 1 70 PHE QE . . 4.200 4.153 4.034 4.202 0.002 1 0 "[ . 1 . 2 . 3]" 1
334 1 17 THR HB 1 86 LEU MD1 . . 4.490 4.553 4.518 4.628 0.138 29 0 "[ . 1 . 2 . 3]" 1
335 1 17 THR HB 1 86 LEU MD2 . . 3.860 3.896 3.866 3.956 0.096 27 0 "[ . 1 . 2 . 3]" 1
336 1 17 THR MG 1 18 LYS H . . 3.730 3.298 3.225 3.348 . 0 0 "[ . 1 . 2 . 3]" 1
337 1 17 THR MG 1 18 LYS HA . . 3.640 3.371 3.293 3.463 . 0 0 "[ . 1 . 2 . 3]" 1
338 1 17 THR MG 1 19 ALA H . . 5.500 4.908 4.837 4.963 . 0 0 "[ . 1 . 2 . 3]" 1
339 1 17 THR MG 1 20 ILE H . . 4.500 4.527 4.474 4.558 0.058 28 0 "[ . 1 . 2 . 3]" 1
340 1 17 THR MG 1 20 ILE HB . . 4.690 3.639 3.531 3.743 . 0 0 "[ . 1 . 2 . 3]" 1
341 1 17 THR MG 1 20 ILE MD . . 4.200 3.848 3.792 3.896 . 0 0 "[ . 1 . 2 . 3]" 1
342 1 17 THR MG 1 20 ILE MG . . 4.240 4.327 4.280 4.383 0.143 28 0 "[ . 1 . 2 . 3]" 1
343 1 17 THR MG 1 21 GLU H . . 4.080 3.800 3.693 3.866 . 0 0 "[ . 1 . 2 . 3]" 1
344 1 17 THR MG 1 21 GLU HB2 . . 4.330 4.067 3.871 4.227 . 0 0 "[ . 1 . 2 . 3]" 1
345 1 17 THR MG 1 21 GLU HB3 . . 4.820 4.785 4.697 4.863 0.043 3 0 "[ . 1 . 2 . 3]" 1
346 1 17 THR MG 1 21 GLU HG2 . . 3.280 2.970 2.639 3.268 . 0 0 "[ . 1 . 2 . 3]" 1
347 1 17 THR MG 1 21 GLU HG3 . . 3.720 2.536 2.300 2.836 . 0 0 "[ . 1 . 2 . 3]" 1
348 1 17 THR MG 1 70 PHE QE . . 4.040 3.755 3.587 3.865 . 0 0 "[ . 1 . 2 . 3]" 1
349 1 17 THR MG 1 70 PHE HZ . . 5.500 4.771 4.501 4.915 . 0 0 "[ . 1 . 2 . 3]" 1
350 1 17 THR MG 1 86 LEU HG . . 3.860 3.681 3.616 3.763 . 0 0 "[ . 1 . 2 . 3]" 1
351 1 18 LYS H 1 18 LYS QB . . 2.980 2.244 2.078 2.380 . 0 0 "[ . 1 . 2 . 3]" 1
352 1 18 LYS H 1 18 LYS QD . . 4.930 4.182 3.739 4.714 . 0 0 "[ . 1 . 2 . 3]" 1
353 1 18 LYS H 1 18 LYS HG2 . . 3.950 3.653 2.890 3.956 0.006 18 0 "[ . 1 . 2 . 3]" 1
354 1 18 LYS H 1 18 LYS QG . . 3.330 2.761 2.459 3.146 . 0 0 "[ . 1 . 2 . 3]" 1
355 1 18 LYS H 1 18 LYS HG3 . . 3.950 2.903 2.501 3.557 . 0 0 "[ . 1 . 2 . 3]" 1
356 1 18 LYS H 1 19 ALA H . . 3.520 2.773 2.722 2.855 . 0 0 "[ . 1 . 2 . 3]" 1
357 1 18 LYS H 1 19 ALA MB . . 4.520 4.427 4.373 4.504 . 0 0 "[ . 1 . 2 . 3]" 1
358 1 18 LYS H 1 86 LEU MD2 . . 5.500 5.065 4.973 5.139 . 0 0 "[ . 1 . 2 . 3]" 1
359 1 18 LYS HA 1 18 LYS HD2 . . 4.780 4.554 4.198 4.785 0.005 12 0 "[ . 1 . 2 . 3]" 1
360 1 18 LYS HA 1 18 LYS QD . . 4.180 3.884 3.132 4.174 . 0 0 "[ . 1 . 2 . 3]" 1
361 1 18 LYS HA 1 18 LYS HD3 . . 4.780 4.226 3.229 4.598 . 0 0 "[ . 1 . 2 . 3]" 1
362 1 18 LYS HA 1 18 LYS HG2 . . 3.750 2.311 2.125 2.508 . 0 0 "[ . 1 . 2 . 3]" 1
363 1 18 LYS HA 1 18 LYS HG3 . . 3.750 3.074 2.625 3.598 . 0 0 "[ . 1 . 2 . 3]" 1
364 1 18 LYS HA 1 19 ALA HA . . 5.020 4.779 4.731 4.807 . 0 0 "[ . 1 . 2 . 3]" 1
365 1 18 LYS HA 1 19 ALA MB . . 5.060 5.009 4.990 5.030 . 0 0 "[ . 1 . 2 . 3]" 1
366 1 18 LYS HA 1 21 GLU H . . 3.900 3.334 3.121 3.533 . 0 0 "[ . 1 . 2 . 3]" 1
367 1 18 LYS HA 1 21 GLU HB2 . . 3.640 2.511 2.227 2.783 . 0 0 "[ . 1 . 2 . 3]" 1
368 1 18 LYS HA 1 21 GLU HB3 . . 4.630 4.116 3.694 4.410 . 0 0 "[ . 1 . 2 . 3]" 1
369 1 18 LYS HA 1 21 GLU HG2 . . 4.900 4.122 3.667 4.670 . 0 0 "[ . 1 . 2 . 3]" 1
370 1 18 LYS HA 1 21 GLU HG3 . . 4.180 2.949 2.462 3.635 . 0 0 "[ . 1 . 2 . 3]" 1
371 1 18 LYS HA 1 86 LEU MD1 . . 5.420 5.015 4.847 5.164 . 0 0 "[ . 1 . 2 . 3]" 1
372 1 18 LYS QB 1 18 LYS QE . . 4.140 2.950 2.073 3.658 . 0 0 "[ . 1 . 2 . 3]" 1
373 1 18 LYS QB 1 19 ALA H . . 3.190 2.726 2.592 2.854 . 0 0 "[ . 1 . 2 . 3]" 1
374 1 18 LYS QB 1 19 ALA MB . . 4.170 3.911 3.793 4.058 . 0 0 "[ . 1 . 2 . 3]" 1
375 1 18 LYS QB 1 36 TRP HH2 . . 3.410 2.446 2.307 2.602 . 0 0 "[ . 1 . 2 . 3]" 1
376 1 18 LYS QB 1 36 TRP HZ2 . . 3.660 2.410 2.207 2.543 . 0 0 "[ . 1 . 2 . 3]" 1
377 1 18 LYS QB 1 36 TRP HZ3 . . 4.500 3.642 3.425 3.779 . 0 0 "[ . 1 . 2 . 3]" 1
378 1 18 LYS QB 1 41 VAL QG . . 5.260 5.128 4.904 5.306 0.046 8 0 "[ . 1 . 2 . 3]" 1
379 1 18 LYS QD 1 36 TRP HH2 . . 3.770 2.507 2.215 2.780 . 0 0 "[ . 1 . 2 . 3]" 1
380 1 18 LYS QD 1 36 TRP HZ2 . . 4.030 3.103 2.450 4.040 0.010 11 0 "[ . 1 . 2 . 3]" 1
381 1 18 LYS QD 1 41 VAL QG . . 5.280 4.889 4.570 5.399 0.119 5 0 "[ . 1 . 2 . 3]" 1
382 1 18 LYS HD2 1 36 TRP HH2 . . 4.310 3.387 2.243 4.322 0.012 17 0 "[ . 1 . 2 . 3]" 1
383 1 18 LYS HD3 1 36 TRP HH2 . . 4.310 2.846 2.378 4.065 . 0 0 "[ . 1 . 2 . 3]" 1
384 1 18 LYS QE 1 36 TRP HZ2 . . 4.770 3.908 2.361 4.839 0.069 30 0 "[ . 1 . 2 . 3]" 1
385 1 18 LYS QG 1 36 TRP HH2 . . 4.110 3.916 3.465 4.118 0.008 30 0 "[ . 1 . 2 . 3]" 1
386 1 18 LYS QG 1 36 TRP HZ2 . . 4.540 4.276 4.076 4.539 . 0 0 "[ . 1 . 2 . 3]" 1
387 1 18 LYS HG2 1 36 TRP HH2 . . 4.690 4.671 4.499 4.711 0.021 28 0 "[ . 1 . 2 . 3]" 1
388 1 18 LYS HG3 1 36 TRP HH2 . . 4.690 4.248 3.569 4.690 . 0 0 "[ . 1 . 2 . 3]" 1
389 1 19 ALA H 1 19 ALA MB . . 2.820 2.211 2.189 2.233 . 0 0 "[ . 1 . 2 . 3]" 1
390 1 19 ALA H 1 20 ILE H . . 3.530 2.682 2.596 2.739 . 0 0 "[ . 1 . 2 . 3]" 1
391 1 19 ALA H 1 20 ILE HB . . 5.500 4.838 4.735 4.922 . 0 0 "[ . 1 . 2 . 3]" 1
392 1 19 ALA H 1 20 ILE MD . . 5.200 4.903 4.784 4.975 . 0 0 "[ . 1 . 2 . 3]" 1
393 1 19 ALA H 1 20 ILE HG13 . . 4.530 4.461 4.346 4.532 0.002 15 0 "[ . 1 . 2 . 3]" 1
394 1 19 ALA H 1 21 GLU H . . 4.740 4.113 3.977 4.301 . 0 0 "[ . 1 . 2 . 3]" 1
395 1 19 ALA H 1 33 ILE MG . . 4.920 4.379 4.258 4.517 . 0 0 "[ . 1 . 2 . 3]" 1
396 1 19 ALA H 1 36 TRP HE1 . . 5.500 5.494 5.368 5.519 0.019 2 0 "[ . 1 . 2 . 3]" 1
397 1 19 ALA H 1 36 TRP HH2 . . 5.390 4.583 4.439 4.780 . 0 0 "[ . 1 . 2 . 3]" 1
398 1 19 ALA H 1 36 TRP HZ3 . . 5.040 4.460 4.319 4.723 . 0 0 "[ . 1 . 2 . 3]" 1
399 1 19 ALA H 1 37 MET ME . . 5.200 4.779 4.594 4.962 . 0 0 "[ . 1 . 2 . 3]" 1
400 1 19 ALA HA 1 20 ILE HA . . 5.300 4.784 4.770 4.804 . 0 0 "[ . 1 . 2 . 3]" 1
401 1 19 ALA HA 1 21 GLU H . . 4.870 4.514 4.449 4.643 . 0 0 "[ . 1 . 2 . 3]" 1
402 1 19 ALA HA 1 22 SER H . . 4.010 3.488 3.357 3.580 . 0 0 "[ . 1 . 2 . 3]" 1
403 1 19 ALA HA 1 22 SER QB . . 3.980 2.713 2.488 2.866 . 0 0 "[ . 1 . 2 . 3]" 1
404 1 19 ALA HA 1 23 SER H . . 5.170 4.644 4.573 4.777 . 0 0 "[ . 1 . 2 . 3]" 1
405 1 19 ALA HA 1 28 LEU MD1 . . 4.230 3.410 3.350 3.486 . 0 0 "[ . 1 . 2 . 3]" 1
406 1 19 ALA HA 1 36 TRP HD1 . . 4.390 3.435 3.227 3.545 . 0 0 "[ . 1 . 2 . 3]" 1
407 1 19 ALA HA 1 36 TRP HE1 . . 3.880 3.254 3.177 3.331 . 0 0 "[ . 1 . 2 . 3]" 1
408 1 19 ALA HA 1 36 TRP HE3 . . 4.790 4.373 4.193 4.543 . 0 0 "[ . 1 . 2 . 3]" 1
409 1 19 ALA HA 1 36 TRP HZ2 . . 4.640 4.115 3.963 4.278 . 0 0 "[ . 1 . 2 . 3]" 1
410 1 19 ALA MB 1 20 ILE H . . 3.130 2.436 2.390 2.481 . 0 0 "[ . 1 . 2 . 3]" 1
411 1 19 ALA MB 1 20 ILE HA . . 4.300 3.788 3.744 3.828 . 0 0 "[ . 1 . 2 . 3]" 1
412 1 19 ALA MB 1 20 ILE HG13 . . 3.420 2.954 2.907 3.010 . 0 0 "[ . 1 . 2 . 3]" 1
413 1 19 ALA MB 1 21 GLU H . . 4.710 4.479 4.406 4.579 . 0 0 "[ . 1 . 2 . 3]" 1
414 1 19 ALA MB 1 22 SER H . . 4.800 4.517 4.411 4.591 . 0 0 "[ . 1 . 2 . 3]" 1
415 1 19 ALA MB 1 22 SER QB . . 4.230 3.991 3.820 4.134 . 0 0 "[ . 1 . 2 . 3]" 1
416 1 19 ALA MB 1 23 SER H . . 4.980 5.020 4.994 5.089 0.109 29 0 "[ . 1 . 2 . 3]" 1
417 1 19 ALA MB 1 23 SER HB3 . . 5.500 4.985 4.878 5.127 . 0 0 "[ . 1 . 2 . 3]" 1
418 1 19 ALA MB 1 28 LEU HB3 . . 4.840 4.442 4.346 4.526 . 0 0 "[ . 1 . 2 . 3]" 1
419 1 19 ALA MB 1 28 LEU MD1 . . 2.940 2.121 2.042 2.199 . 0 0 "[ . 1 . 2 . 3]" 1
420 1 19 ALA MB 1 28 LEU MD2 . . 4.390 4.330 4.230 4.428 0.038 11 0 "[ . 1 . 2 . 3]" 1
421 1 19 ALA MB 1 28 LEU HG . . 4.290 4.182 4.060 4.295 0.005 2 0 "[ . 1 . 2 . 3]" 1
422 1 19 ALA MB 1 33 ILE H . . 5.330 4.713 4.613 4.796 . 0 0 "[ . 1 . 2 . 3]" 1
423 1 19 ALA MB 1 33 ILE HA . . 3.680 2.512 2.441 2.623 . 0 0 "[ . 1 . 2 . 3]" 1
424 1 19 ALA MB 1 33 ILE HG12 . . 4.160 2.621 2.486 2.706 . 0 0 "[ . 1 . 2 . 3]" 1
425 1 19 ALA MB 1 33 ILE MG . . 3.320 2.465 2.358 2.607 . 0 0 "[ . 1 . 2 . 3]" 1
426 1 19 ALA MB 1 36 TRP H . . 4.760 4.306 4.207 4.430 . 0 0 "[ . 1 . 2 . 3]" 1
427 1 19 ALA MB 1 36 TRP HA . . 5.500 4.731 4.638 4.843 . 0 0 "[ . 1 . 2 . 3]" 1
428 1 19 ALA MB 1 36 TRP HB2 . . 3.900 2.928 2.786 3.072 . 0 0 "[ . 1 . 2 . 3]" 1
429 1 19 ALA MB 1 36 TRP HB3 . . 3.900 2.468 2.403 2.575 . 0 0 "[ . 1 . 2 . 3]" 1
430 1 19 ALA MB 1 36 TRP HE1 . . 4.640 4.484 4.420 4.557 . 0 0 "[ . 1 . 2 . 3]" 1
431 1 19 ALA MB 1 36 TRP HE3 . . 3.390 2.755 2.685 2.871 . 0 0 "[ . 1 . 2 . 3]" 1
432 1 19 ALA MB 1 36 TRP HZ2 . . 4.780 4.799 4.742 4.845 0.065 28 0 "[ . 1 . 2 . 3]" 1
433 1 19 ALA MB 1 36 TRP HZ3 . . 4.130 3.906 3.815 4.035 . 0 0 "[ . 1 . 2 . 3]" 1
434 1 19 ALA MB 1 37 MET H . . 5.500 4.333 4.231 4.499 . 0 0 "[ . 1 . 2 . 3]" 1
435 1 19 ALA MB 1 37 MET HA . . 5.500 5.014 4.914 5.203 . 0 0 "[ . 1 . 2 . 3]" 1
436 1 19 ALA MB 1 37 MET ME . . 4.360 3.724 3.562 3.874 . 0 0 "[ . 1 . 2 . 3]" 1
437 1 19 ALA MB 1 37 MET HG2 . . 4.760 4.314 4.163 4.605 . 0 0 "[ . 1 . 2 . 3]" 1
438 1 19 ALA MB 1 86 LEU MD2 . . 5.500 5.614 5.542 5.690 0.190 29 0 "[ . 1 . 2 . 3]" 1
439 1 20 ILE H 1 20 ILE HB . . 3.180 2.444 2.415 2.494 . 0 0 "[ . 1 . 2 . 3]" 1
440 1 20 ILE H 1 20 ILE MD . . 3.330 3.285 3.252 3.319 . 0 0 "[ . 1 . 2 . 3]" 1
441 1 20 ILE H 1 20 ILE HG12 . . 3.860 3.673 3.621 3.732 . 0 0 "[ . 1 . 2 . 3]" 1
442 1 20 ILE H 1 20 ILE HG13 . . 3.570 2.244 2.197 2.305 . 0 0 "[ . 1 . 2 . 3]" 1
443 1 20 ILE H 1 20 ILE MG . . 3.810 3.769 3.751 3.796 . 0 0 "[ . 1 . 2 . 3]" 1
444 1 20 ILE H 1 21 GLU H . . 3.420 2.623 2.574 2.702 . 0 0 "[ . 1 . 2 . 3]" 1
445 1 20 ILE H 1 22 SER H . . 4.780 3.924 3.856 3.983 . 0 0 "[ . 1 . 2 . 3]" 1
446 1 20 ILE H 1 28 LEU MD1 . . 4.050 3.549 3.476 3.593 . 0 0 "[ . 1 . 2 . 3]" 1
447 1 20 ILE H 1 86 LEU MD1 . . 5.160 4.820 4.653 4.967 . 0 0 "[ . 1 . 2 . 3]" 1
448 1 20 ILE H 1 86 LEU MD2 . . 4.700 4.417 4.277 4.514 . 0 0 "[ . 1 . 2 . 3]" 1
449 1 20 ILE HA 1 20 ILE MD . . 4.060 3.911 3.885 3.930 . 0 0 "[ . 1 . 2 . 3]" 1
450 1 20 ILE HA 1 20 ILE HG12 . . 3.310 2.693 2.655 2.723 . 0 0 "[ . 1 . 2 . 3]" 1
451 1 20 ILE HA 1 20 ILE HG13 . . 3.740 2.766 2.726 2.811 . 0 0 "[ . 1 . 2 . 3]" 1
452 1 20 ILE HA 1 20 ILE MG . . 3.050 2.446 2.423 2.476 . 0 0 "[ . 1 . 2 . 3]" 1
453 1 20 ILE HA 1 22 SER H . . 4.710 4.116 3.936 4.224 . 0 0 "[ . 1 . 2 . 3]" 1
454 1 20 ILE HA 1 23 SER H . . 4.190 3.414 3.282 3.491 . 0 0 "[ . 1 . 2 . 3]" 1
455 1 20 ILE HA 1 23 SER HB3 . . 4.540 3.236 3.022 3.430 . 0 0 "[ . 1 . 2 . 3]" 1
456 1 20 ILE HA 1 27 ARG H . . 4.750 4.349 4.237 4.466 . 0 0 "[ . 1 . 2 . 3]" 1
457 1 20 ILE HA 1 28 LEU HB3 . . 5.500 4.745 4.567 4.896 . 0 0 "[ . 1 . 2 . 3]" 1
458 1 20 ILE HA 1 28 LEU MD1 . . 3.250 2.825 2.699 2.957 . 0 0 "[ . 1 . 2 . 3]" 1
459 1 20 ILE HA 1 28 LEU MD2 . . 3.970 3.977 3.941 4.006 0.036 5 0 "[ . 1 . 2 . 3]" 1
460 1 20 ILE HA 1 28 LEU HG . . 3.700 2.313 2.255 2.400 . 0 0 "[ . 1 . 2 . 3]" 1
461 1 20 ILE HA 1 33 ILE MD . . 5.500 5.097 4.847 5.346 . 0 0 "[ . 1 . 2 . 3]" 1
462 1 20 ILE HA 1 86 LEU MD1 . . 5.500 5.410 5.222 5.522 0.022 18 0 "[ . 1 . 2 . 3]" 1
463 1 20 ILE HA 1 86 LEU MD2 . . 5.500 5.420 5.234 5.518 0.018 13 0 "[ . 1 . 2 . 3]" 1
464 1 20 ILE HB 1 20 ILE MD . . 3.310 2.344 2.328 2.370 . 0 0 "[ . 1 . 2 . 3]" 1
465 1 20 ILE HB 1 21 GLU H . . 3.420 2.658 2.596 2.703 . 0 0 "[ . 1 . 2 . 3]" 1
466 1 20 ILE HB 1 22 SER H . . 5.200 4.878 4.772 4.952 . 0 0 "[ . 1 . 2 . 3]" 1
467 1 20 ILE HB 1 28 LEU MD1 . . 4.990 4.893 4.785 4.997 0.007 29 0 "[ . 1 . 2 . 3]" 1
468 1 20 ILE HB 1 28 LEU HG . . 5.460 5.277 5.226 5.334 . 0 0 "[ . 1 . 2 . 3]" 1
469 1 20 ILE HB 1 85 MET HA . . 4.770 4.271 4.160 4.348 . 0 0 "[ . 1 . 2 . 3]" 1
470 1 20 ILE HB 1 86 LEU MD1 . . 4.270 3.089 2.933 3.217 . 0 0 "[ . 1 . 2 . 3]" 1
471 1 20 ILE HB 1 86 LEU MD2 . . 4.440 2.808 2.604 2.917 . 0 0 "[ . 1 . 2 . 3]" 1
472 1 20 ILE HB 1 86 LEU HG . . 4.370 2.939 2.827 3.100 . 0 0 "[ . 1 . 2 . 3]" 1
473 1 20 ILE MD 1 20 ILE MG . . 2.700 2.163 2.141 2.191 . 0 0 "[ . 1 . 2 . 3]" 1
474 1 20 ILE MD 1 21 GLU H . . 4.460 4.470 4.399 4.495 0.035 11 0 "[ . 1 . 2 . 3]" 1
475 1 20 ILE MD 1 27 ARG HA . . 4.470 4.244 4.172 4.390 . 0 0 "[ . 1 . 2 . 3]" 1
476 1 20 ILE MD 1 28 LEU H . . 4.210 4.200 4.147 4.244 0.034 17 0 "[ . 1 . 2 . 3]" 1
477 1 20 ILE MD 1 28 LEU HB2 . . 4.880 4.146 4.085 4.212 . 0 0 "[ . 1 . 2 . 3]" 1
478 1 20 ILE MD 1 33 ILE MD . . 3.450 3.137 2.985 3.337 . 0 0 "[ . 1 . 2 . 3]" 1
479 1 20 ILE MD 1 33 ILE HG13 . . 5.090 4.940 4.722 5.094 0.004 23 0 "[ . 1 . 2 . 3]" 1
480 1 20 ILE MD 1 64 LEU MD1 . . 5.380 4.673 4.329 5.071 . 0 0 "[ . 1 . 2 . 3]" 1
481 1 20 ILE MD 1 64 LEU MD2 . . 4.180 3.169 2.914 3.501 . 0 0 "[ . 1 . 2 . 3]" 1
482 1 20 ILE MD 1 70 PHE QB . . 4.400 3.986 3.762 4.169 . 0 0 "[ . 1 . 2 . 3]" 1
483 1 20 ILE MD 1 70 PHE QD . . 3.460 2.585 2.430 2.743 . 0 0 "[ . 1 . 2 . 3]" 1
484 1 20 ILE MD 1 70 PHE QE . . 3.570 2.551 2.255 2.773 . 0 0 "[ . 1 . 2 . 3]" 1
485 1 20 ILE MD 1 70 PHE HZ . . 5.410 4.547 4.187 4.796 . 0 0 "[ . 1 . 2 . 3]" 1
486 1 20 ILE MD 1 84 TRP HA . . 4.860 4.724 4.604 4.819 . 0 0 "[ . 1 . 2 . 3]" 1
487 1 20 ILE MD 1 84 TRP HB2 . . 4.150 3.578 3.401 3.701 . 0 0 "[ . 1 . 2 . 3]" 1
488 1 20 ILE MD 1 84 TRP QB . . 3.540 3.112 2.967 3.202 . 0 0 "[ . 1 . 2 . 3]" 1
489 1 20 ILE MD 1 84 TRP HB3 . . 4.150 3.423 3.268 3.534 . 0 0 "[ . 1 . 2 . 3]" 1
490 1 20 ILE MD 1 85 MET H . . 4.150 3.821 3.731 3.893 . 0 0 "[ . 1 . 2 . 3]" 1
491 1 20 ILE MD 1 85 MET HA . . 3.420 2.273 2.152 2.431 . 0 0 "[ . 1 . 2 . 3]" 1
492 1 20 ILE MD 1 85 MET HB2 . . 4.560 4.252 4.117 4.474 . 0 0 "[ . 1 . 2 . 3]" 1
493 1 20 ILE MD 1 85 MET HG2 . . 5.500 5.394 5.312 5.507 0.007 21 0 "[ . 1 . 2 . 3]" 1
494 1 20 ILE MD 1 86 LEU H . . 3.950 3.357 3.123 3.553 . 0 0 "[ . 1 . 2 . 3]" 1
495 1 20 ILE MD 1 86 LEU HA . . 4.300 3.777 3.651 3.890 . 0 0 "[ . 1 . 2 . 3]" 1
496 1 20 ILE MD 1 86 LEU MD1 . . 3.730 3.751 3.677 3.835 0.105 24 0 "[ . 1 . 2 . 3]" 1
497 1 20 ILE MD 1 86 LEU MD2 . . 3.050 2.208 2.104 2.263 . 0 0 "[ . 1 . 2 . 3]" 1
498 1 20 ILE MD 1 86 LEU HG . . 3.460 2.899 2.753 3.046 . 0 0 "[ . 1 . 2 . 3]" 1
499 1 20 ILE HG12 1 20 ILE MG . . 3.480 2.279 2.260 2.321 . 0 0 "[ . 1 . 2 . 3]" 1
500 1 20 ILE HG12 1 28 LEU H . . 4.400 3.061 2.974 3.165 . 0 0 "[ . 1 . 2 . 3]" 1
501 1 20 ILE HG12 1 28 LEU HB2 . . 4.190 2.857 2.725 2.986 . 0 0 "[ . 1 . 2 . 3]" 1
502 1 20 ILE HG12 1 28 LEU HB3 . . 5.440 4.606 4.462 4.735 . 0 0 "[ . 1 . 2 . 3]" 1
503 1 20 ILE HG12 1 28 LEU MD1 . . 4.600 3.755 3.564 3.874 . 0 0 "[ . 1 . 2 . 3]" 1
504 1 20 ILE HG12 1 28 LEU HG . . 4.330 3.714 3.601 3.814 . 0 0 "[ . 1 . 2 . 3]" 1
505 1 20 ILE HG12 1 33 ILE MD . . 5.050 3.512 3.241 3.823 . 0 0 "[ . 1 . 2 . 3]" 1
506 1 20 ILE HG13 1 20 ILE MG . . 3.700 3.194 3.183 3.211 . 0 0 "[ . 1 . 2 . 3]" 1
507 1 20 ILE HG13 1 28 LEU H . . 4.720 4.615 4.520 4.721 0.001 24 0 "[ . 1 . 2 . 3]" 1
508 1 20 ILE HG13 1 28 LEU MD1 . . 4.100 3.272 3.134 3.374 . 0 0 "[ . 1 . 2 . 3]" 1
509 1 20 ILE HG13 1 33 ILE MD . . 4.150 3.523 3.364 3.715 . 0 0 "[ . 1 . 2 . 3]" 1
510 1 20 ILE HG13 1 33 ILE HG12 . . 4.650 3.162 3.031 3.392 . 0 0 "[ . 1 . 2 . 3]" 1
511 1 20 ILE MG 1 21 GLU H . . 3.620 3.419 3.308 3.510 . 0 0 "[ . 1 . 2 . 3]" 1
512 1 20 ILE MG 1 21 GLU HG2 . . 4.390 3.727 3.396 3.996 . 0 0 "[ . 1 . 2 . 3]" 1
513 1 20 ILE MG 1 23 SER H . . 4.590 4.445 4.308 4.507 . 0 0 "[ . 1 . 2 . 3]" 1
514 1 20 ILE MG 1 26 LYS H . . 4.490 4.497 4.434 4.531 0.041 29 0 "[ . 1 . 2 . 3]" 1
515 1 20 ILE MG 1 26 LYS HA . . 3.530 2.778 2.670 2.849 . 0 0 "[ . 1 . 2 . 3]" 1
516 1 20 ILE MG 1 26 LYS HB2 . . 4.840 4.306 4.100 4.440 . 0 0 "[ . 1 . 2 . 3]" 1
517 1 20 ILE MG 1 26 LYS QB . . 4.000 3.135 2.962 3.308 . 0 0 "[ . 1 . 2 . 3]" 1
518 1 20 ILE MG 1 26 LYS HB3 . . 4.840 3.221 3.038 3.423 . 0 0 "[ . 1 . 2 . 3]" 1
519 1 20 ILE MG 1 26 LYS QD . . 4.410 3.475 2.852 3.787 . 0 0 "[ . 1 . 2 . 3]" 1
520 1 20 ILE MG 1 27 ARG H . . 3.820 3.358 3.287 3.482 . 0 0 "[ . 1 . 2 . 3]" 1
521 1 20 ILE MG 1 27 ARG HA . . 3.390 2.332 2.245 2.529 . 0 0 "[ . 1 . 2 . 3]" 1
522 1 20 ILE MG 1 28 LEU H . . 3.940 3.457 3.304 3.575 . 0 0 "[ . 1 . 2 . 3]" 1
523 1 20 ILE MG 1 28 LEU HB2 . . 4.710 4.121 3.914 4.240 . 0 0 "[ . 1 . 2 . 3]" 1
524 1 20 ILE MG 1 28 LEU MD1 . . 4.720 4.341 4.183 4.435 . 0 0 "[ . 1 . 2 . 3]" 1
525 1 20 ILE MG 1 28 LEU HG . . 3.720 3.721 3.622 3.764 0.044 28 0 "[ . 1 . 2 . 3]" 1
526 1 20 ILE MG 1 85 MET HA . . 3.150 2.052 1.998 2.095 . 0 0 "[ . 1 . 2 . 3]" 1
527 1 20 ILE MG 1 85 MET HB2 . . 3.930 2.959 2.816 3.176 . 0 0 "[ . 1 . 2 . 3]" 1
528 1 20 ILE MG 1 85 MET HB3 . . 3.750 3.435 3.307 3.584 . 0 0 "[ . 1 . 2 . 3]" 1
529 1 20 ILE MG 1 85 MET HG2 . . 5.240 5.048 4.957 5.124 . 0 0 "[ . 1 . 2 . 3]" 1
530 1 20 ILE MG 1 86 LEU H . . 3.390 2.344 2.203 2.514 . 0 0 "[ . 1 . 2 . 3]" 1
531 1 20 ILE MG 1 86 LEU HA . . 4.920 4.237 4.093 4.332 . 0 0 "[ . 1 . 2 . 3]" 1
532 1 20 ILE MG 1 86 LEU MD1 . . 3.330 2.995 2.866 3.094 . 0 0 "[ . 1 . 2 . 3]" 1
533 1 20 ILE MG 1 86 LEU MD2 . . 3.200 3.084 2.907 3.203 0.003 13 0 "[ . 1 . 2 . 3]" 1
534 1 20 ILE MG 1 86 LEU HG . . 3.020 2.089 2.021 2.189 . 0 0 "[ . 1 . 2 . 3]" 1
535 1 21 GLU H 1 21 GLU HB2 . . 3.230 2.414 2.182 2.560 . 0 0 "[ . 1 . 2 . 3]" 1
536 1 21 GLU H 1 21 GLU HB3 . . 3.640 3.584 3.478 3.627 . 0 0 "[ . 1 . 2 . 3]" 1
537 1 21 GLU H 1 21 GLU HG2 . . 3.380 2.590 2.241 3.050 . 0 0 "[ . 1 . 2 . 3]" 1
538 1 21 GLU H 1 21 GLU HG3 . . 3.560 3.011 2.207 3.422 . 0 0 "[ . 1 . 2 . 3]" 1
539 1 21 GLU H 1 22 SER H . . 3.200 2.555 2.469 2.645 . 0 0 "[ . 1 . 2 . 3]" 1
540 1 21 GLU H 1 23 SER H . . 4.500 4.081 3.989 4.173 . 0 0 "[ . 1 . 2 . 3]" 1
541 1 21 GLU H 1 86 LEU MD1 . . 3.750 3.597 3.367 3.706 . 0 0 "[ . 1 . 2 . 3]" 1
542 1 21 GLU H 1 86 LEU MD2 . . 4.670 4.442 4.196 4.553 . 0 0 "[ . 1 . 2 . 3]" 1
543 1 21 GLU HA 1 21 GLU HG2 . . 3.990 2.540 2.330 2.818 . 0 0 "[ . 1 . 2 . 3]" 1
544 1 21 GLU HA 1 21 GLU HG3 . . 3.890 3.638 3.276 3.775 . 0 0 "[ . 1 . 2 . 3]" 1
545 1 21 GLU HA 1 23 SER H . . 4.620 4.032 3.909 4.132 . 0 0 "[ . 1 . 2 . 3]" 1
546 1 21 GLU HA 1 26 LYS QD . . 3.710 2.468 2.140 3.162 . 0 0 "[ . 1 . 2 . 3]" 1
547 1 21 GLU HA 1 26 LYS QE . . 4.530 3.805 2.374 4.394 . 0 0 "[ . 1 . 2 . 3]" 1
548 1 21 GLU HA 1 86 LEU MD1 . . 3.930 3.773 3.497 3.936 0.006 15 0 "[ . 1 . 2 . 3]" 1
549 1 21 GLU HB2 1 22 SER H . . 3.760 2.761 2.606 2.937 . 0 0 "[ . 1 . 2 . 3]" 1
550 1 21 GLU HB2 1 86 LEU MD1 . . 4.540 4.396 4.116 4.573 0.033 30 0 "[ . 1 . 2 . 3]" 1
551 1 21 GLU HB3 1 22 SER H . . 3.870 3.717 3.298 3.884 0.014 6 0 "[ . 1 . 2 . 3]" 1
552 1 21 GLU HB3 1 86 LEU MD1 . . 4.510 4.519 4.310 4.625 0.115 23 0 "[ . 1 . 2 . 3]" 1
553 1 21 GLU HG2 1 22 SER H . . 4.700 4.527 4.298 4.744 0.044 24 0 "[ . 1 . 2 . 3]" 1
554 1 21 GLU HG2 1 86 LEU MD1 . . 3.270 2.115 2.039 2.223 . 0 0 "[ . 1 . 2 . 3]" 1
555 1 21 GLU HG2 1 86 LEU MD2 . . 4.040 4.017 3.820 4.149 0.109 29 0 "[ . 1 . 2 . 3]" 1
556 1 21 GLU HG3 1 22 SER H . . 4.690 4.639 4.206 4.777 0.087 3 0 "[ . 1 . 2 . 3]" 1
557 1 21 GLU HG3 1 86 LEU MD1 . . 3.340 3.022 2.465 3.274 . 0 0 "[ . 1 . 2 . 3]" 1
558 1 22 SER H 1 22 SER QB . . 2.990 2.371 2.080 2.504 . 0 0 "[ . 1 . 2 . 3]" 1
559 1 22 SER H 1 28 LEU MD1 . . 5.090 4.564 4.387 4.688 . 0 0 "[ . 1 . 2 . 3]" 1
560 1 22 SER H 1 28 LEU HG . . 5.500 5.524 5.511 5.548 0.048 29 0 "[ . 1 . 2 . 3]" 1
561 1 22 SER H 1 36 TRP HE1 . . 5.500 4.750 4.464 5.019 . 0 0 "[ . 1 . 2 . 3]" 1
562 1 22 SER QB 1 23 SER H . . 3.770 2.896 2.818 3.128 . 0 0 "[ . 1 . 2 . 3]" 1
563 1 22 SER QB 1 36 TRP HE1 . . 3.510 2.521 2.283 2.706 . 0 0 "[ . 1 . 2 . 3]" 1
564 1 22 SER QB 1 36 TRP HZ2 . . 4.680 4.190 3.641 4.682 0.002 16 0 "[ . 1 . 2 . 3]" 1
565 1 23 SER H 1 23 SER HB2 . . 3.670 3.604 3.585 3.644 . 0 0 "[ . 1 . 2 . 3]" 1
566 1 23 SER H 1 23 SER HB3 . . 3.120 2.400 2.323 2.512 . 0 0 "[ . 1 . 2 . 3]" 1
567 1 23 SER H 1 23 SER HG . . 3.590 2.317 2.218 2.479 . 0 0 "[ . 1 . 2 . 3]" 1
568 1 23 SER H 1 24 ALA H . . 4.840 4.656 4.611 4.695 . 0 0 "[ . 1 . 2 . 3]" 1
569 1 23 SER H 1 26 LYS H . . 4.860 4.505 4.439 4.575 . 0 0 "[ . 1 . 2 . 3]" 1
570 1 23 SER H 1 26 LYS HA . . 5.000 4.235 4.063 4.358 . 0 0 "[ . 1 . 2 . 3]" 1
571 1 23 SER H 1 26 LYS QD . . 5.340 4.187 3.865 4.405 . 0 0 "[ . 1 . 2 . 3]" 1
572 1 23 SER H 1 28 LEU MD1 . . 4.470 3.776 3.645 3.954 . 0 0 "[ . 1 . 2 . 3]" 1
573 1 23 SER H 1 28 LEU MD2 . . 4.310 4.163 4.099 4.298 . 0 0 "[ . 1 . 2 . 3]" 1
574 1 23 SER H 1 28 LEU HG . . 4.520 3.973 3.834 4.134 . 0 0 "[ . 1 . 2 . 3]" 1
575 1 23 SER HA 1 24 ALA H . . 2.980 2.263 2.175 2.391 . 0 0 "[ . 1 . 2 . 3]" 1
576 1 23 SER HA 1 24 ALA MB . . 4.110 4.057 3.953 4.116 0.006 18 0 "[ . 1 . 2 . 3]" 1
577 1 23 SER HA 1 25 GLU H . . 4.200 3.994 3.827 4.205 0.005 24 0 "[ . 1 . 2 . 3]" 1
578 1 23 SER HA 1 26 LYS H . . 4.590 4.557 4.465 4.596 0.006 24 0 "[ . 1 . 2 . 3]" 1
579 1 23 SER HA 1 28 LEU MD2 . . 4.270 3.575 3.424 3.709 . 0 0 "[ . 1 . 2 . 3]" 1
580 1 23 SER HB2 1 24 ALA H . . 3.730 3.057 2.723 3.376 . 0 0 "[ . 1 . 2 . 3]" 1
581 1 23 SER HB2 1 25 GLU H . . 3.920 3.077 2.819 3.315 . 0 0 "[ . 1 . 2 . 3]" 1
582 1 23 SER HB2 1 26 LYS H . . 4.120 3.703 3.447 3.889 . 0 0 "[ . 1 . 2 . 3]" 1
583 1 23 SER HB2 1 27 ARG H . . 4.100 3.472 3.354 3.595 . 0 0 "[ . 1 . 2 . 3]" 1
584 1 23 SER HB2 1 28 LEU MD1 . . 4.000 4.047 4.022 4.072 0.072 29 0 "[ . 1 . 2 . 3]" 1
585 1 23 SER HB2 1 28 LEU MD2 . . 3.000 2.416 2.302 2.540 . 0 0 "[ . 1 . 2 . 3]" 1
586 1 23 SER HB2 1 28 LEU HG . . 4.670 3.397 3.239 3.532 . 0 0 "[ . 1 . 2 . 3]" 1
587 1 23 SER HB3 1 24 ALA H . . 4.550 4.228 4.050 4.412 . 0 0 "[ . 1 . 2 . 3]" 1
588 1 23 SER HB3 1 25 GLU H . . 4.890 4.594 4.359 4.821 . 0 0 "[ . 1 . 2 . 3]" 1
589 1 23 SER HB3 1 26 LYS H . . 4.410 4.379 4.207 4.429 0.019 29 0 "[ . 1 . 2 . 3]" 1
590 1 23 SER HB3 1 27 ARG H . . 3.900 3.910 3.898 3.924 0.024 14 0 "[ . 1 . 2 . 3]" 1
591 1 23 SER HB3 1 28 LEU MD1 . . 3.950 2.771 2.687 2.847 . 0 0 "[ . 1 . 2 . 3]" 1
592 1 23 SER HB3 1 28 LEU MD2 . . 3.160 2.214 2.130 2.285 . 0 0 "[ . 1 . 2 . 3]" 1
593 1 23 SER HB3 1 28 LEU HG . . 4.530 2.257 2.105 2.380 . 0 0 "[ . 1 . 2 . 3]" 1
594 1 23 SER HG 1 25 GLU H . . 4.890 4.209 3.906 4.409 . 0 0 "[ . 1 . 2 . 3]" 1
595 1 23 SER HG 1 26 LYS H . . 4.210 2.748 2.632 2.827 . 0 0 "[ . 1 . 2 . 3]" 1
596 1 23 SER HG 1 27 ARG H . . 4.230 2.802 2.665 2.984 . 0 0 "[ . 1 . 2 . 3]" 1
597 1 24 ALA H 1 24 ALA MB . . 2.900 2.233 2.182 2.266 . 0 0 "[ . 1 . 2 . 3]" 1
598 1 24 ALA H 1 25 GLU H . . 3.470 2.556 2.084 2.738 . 0 0 "[ . 1 . 2 . 3]" 1
599 1 24 ALA H 1 26 LYS H . . 4.460 4.048 3.762 4.157 . 0 0 "[ . 1 . 2 . 3]" 1
600 1 24 ALA MB 1 25 GLU H . . 3.170 2.691 2.530 2.897 . 0 0 "[ . 1 . 2 . 3]" 1
601 1 24 ALA MB 1 25 GLU HA . . 3.970 3.888 3.827 3.963 . 0 0 "[ . 1 . 2 . 3]" 1
602 1 24 ALA MB 1 25 GLU QG . . 3.180 2.953 2.701 3.127 . 0 0 "[ . 1 . 2 . 3]" 1
603 1 24 ALA MB 1 26 LYS H . . 4.340 4.330 4.242 4.435 0.095 28 0 "[ . 1 . 2 . 3]" 1
604 1 25 GLU H 1 25 GLU HB2 . . 3.830 2.466 2.289 2.717 . 0 0 "[ . 1 . 2 . 3]" 1
605 1 25 GLU H 1 25 GLU QB . . 3.120 2.425 2.262 2.636 . 0 0 "[ . 1 . 2 . 3]" 1
606 1 25 GLU H 1 25 GLU HB3 . . 3.830 3.593 3.534 3.668 . 0 0 "[ . 1 . 2 . 3]" 1
607 1 25 GLU H 1 25 GLU QG . . 3.180 2.348 2.142 2.727 . 0 0 "[ . 1 . 2 . 3]" 1
608 1 25 GLU H 1 26 LYS H . . 3.040 2.572 2.326 2.697 . 0 0 "[ . 1 . 2 . 3]" 1
609 1 25 GLU H 1 26 LYS HA . . 4.850 4.727 4.443 4.854 0.004 18 0 "[ . 1 . 2 . 3]" 1
610 1 25 GLU H 1 27 ARG H . . 4.160 3.815 3.415 4.015 . 0 0 "[ . 1 . 2 . 3]" 1
611 1 25 GLU H 1 27 ARG QG . . 5.030 4.410 4.232 4.571 . 0 0 "[ . 1 . 2 . 3]" 1
612 1 25 GLU HA 1 25 GLU QG . . 2.900 2.548 2.374 2.937 0.037 11 0 "[ . 1 . 2 . 3]" 1
613 1 25 GLU HA 1 27 ARG H . . 4.920 4.622 4.500 4.750 . 0 0 "[ . 1 . 2 . 3]" 1
614 1 25 GLU QB 1 27 ARG H . . 3.630 2.785 2.485 3.026 . 0 0 "[ . 1 . 2 . 3]" 1
615 1 25 GLU QB 1 27 ARG HE . . 3.970 2.748 2.323 3.600 . 0 0 "[ . 1 . 2 . 3]" 1
616 1 25 GLU QB 1 27 ARG QG . . 3.550 2.076 1.969 2.274 . 0 0 "[ . 1 . 2 . 3]" 1
617 1 25 GLU HB2 1 26 LYS H . . 4.460 3.439 3.257 3.623 . 0 0 "[ . 1 . 2 . 3]" 1
618 1 25 GLU HB2 1 27 ARG H . . 4.460 2.855 2.513 3.110 . 0 0 "[ . 1 . 2 . 3]" 1
619 1 25 GLU HB2 1 27 ARG HE . . 4.570 3.707 3.001 4.596 0.026 29 0 "[ . 1 . 2 . 3]" 1
620 1 25 GLU HB3 1 26 LYS H . . 4.460 4.253 4.158 4.363 . 0 0 "[ . 1 . 2 . 3]" 1
621 1 25 GLU HB3 1 27 ARG H . . 4.460 3.895 3.658 4.142 . 0 0 "[ . 1 . 2 . 3]" 1
622 1 25 GLU HB3 1 27 ARG HE . . 4.570 2.844 2.383 3.766 . 0 0 "[ . 1 . 2 . 3]" 1
623 1 25 GLU QG 1 26 LYS H . . 4.550 4.363 4.261 4.526 . 0 0 "[ . 1 . 2 . 3]" 1
624 1 25 GLU QG 1 27 ARG H . . 5.080 4.764 4.532 5.088 0.008 20 0 "[ . 1 . 2 . 3]" 1
625 1 25 GLU QG 1 27 ARG QG . . 4.490 3.881 3.527 4.176 . 0 0 "[ . 1 . 2 . 3]" 1
626 1 26 LYS H 1 26 LYS HA . . 2.910 2.258 2.248 2.266 . 0 0 "[ . 1 . 2 . 3]" 1
627 1 26 LYS H 1 26 LYS HB2 . . 4.060 3.655 3.583 3.719 . 0 0 "[ . 1 . 2 . 3]" 1
628 1 26 LYS H 1 26 LYS QB . . 3.500 3.396 3.357 3.431 . 0 0 "[ . 1 . 2 . 3]" 1
629 1 26 LYS H 1 26 LYS HB3 . . 4.060 4.036 3.986 4.070 0.010 4 0 "[ . 1 . 2 . 3]" 1
630 1 26 LYS H 1 26 LYS HD2 . . 4.000 4.023 4.003 4.047 0.047 28 0 "[ . 1 . 2 . 3]" 1
631 1 26 LYS H 1 26 LYS QD . . 3.320 2.600 2.383 3.042 . 0 0 "[ . 1 . 2 . 3]" 1
632 1 26 LYS H 1 26 LYS HD3 . . 4.000 2.637 2.400 3.153 . 0 0 "[ . 1 . 2 . 3]" 1
633 1 26 LYS H 1 26 LYS HG2 . . 3.790 2.971 2.892 3.065 . 0 0 "[ . 1 . 2 . 3]" 1
634 1 26 LYS H 1 27 ARG H . . 3.170 2.742 2.639 2.807 . 0 0 "[ . 1 . 2 . 3]" 1
635 1 26 LYS H 1 27 ARG QG . . 5.080 4.233 4.142 4.357 . 0 0 "[ . 1 . 2 . 3]" 1
636 1 26 LYS HA 1 26 LYS HD2 . . 3.740 2.635 2.316 2.981 . 0 0 "[ . 1 . 2 . 3]" 1
637 1 26 LYS HA 1 26 LYS QD . . 3.260 2.100 2.015 2.187 . 0 0 "[ . 1 . 2 . 3]" 1
638 1 26 LYS HA 1 26 LYS HD3 . . 3.740 2.228 2.096 2.534 . 0 0 "[ . 1 . 2 . 3]" 1
639 1 26 LYS HA 1 26 LYS HG3 . . 3.980 3.759 3.719 3.809 . 0 0 "[ . 1 . 2 . 3]" 1
640 1 26 LYS HA 1 27 ARG H . . 3.260 2.853 2.790 2.924 . 0 0 "[ . 1 . 2 . 3]" 1
641 1 26 LYS QB 1 26 LYS QD . . 3.190 2.370 2.237 2.472 . 0 0 "[ . 1 . 2 . 3]" 1
642 1 26 LYS QB 1 26 LYS QE . . 4.110 3.644 3.436 3.851 . 0 0 "[ . 1 . 2 . 3]" 1
643 1 26 LYS QB 1 27 ARG H . . 3.970 3.870 3.831 3.893 . 0 0 "[ . 1 . 2 . 3]" 1
644 1 26 LYS QB 1 27 ARG QG . . 5.000 4.292 3.991 4.480 . 0 0 "[ . 1 . 2 . 3]" 1
645 1 26 LYS QB 1 85 MET ME . . 3.870 3.194 3.039 3.285 . 0 0 "[ . 1 . 2 . 3]" 1
646 1 26 LYS HB2 1 27 ARG H . . 4.610 4.223 4.138 4.282 . 0 0 "[ . 1 . 2 . 3]" 1
647 1 26 LYS HB3 1 27 ARG H . . 4.610 4.496 4.459 4.537 . 0 0 "[ . 1 . 2 . 3]" 1
648 1 26 LYS QE 1 26 LYS HG3 . . 3.310 2.407 2.246 2.675 . 0 0 "[ . 1 . 2 . 3]" 1
649 1 26 LYS HE2 1 26 LYS HG3 . . 3.830 2.942 2.301 3.745 . 0 0 "[ . 1 . 2 . 3]" 1
650 1 26 LYS HE3 1 26 LYS HG3 . . 3.830 2.685 2.326 3.619 . 0 0 "[ . 1 . 2 . 3]" 1
651 1 26 LYS HG3 1 85 MET ME . . 4.980 5.009 4.806 5.046 0.066 10 0 "[ . 1 . 2 . 3]" 1
652 1 27 ARG H 1 27 ARG HB2 . . 4.070 3.980 3.925 3.997 . 0 0 "[ . 1 . 2 . 3]" 1
653 1 27 ARG H 1 27 ARG HD2 . . 5.270 5.226 4.627 5.305 0.035 29 0 "[ . 1 . 2 . 3]" 1
654 1 27 ARG H 1 27 ARG QD . . 4.630 4.514 4.346 4.610 . 0 0 "[ . 1 . 2 . 3]" 1
655 1 27 ARG H 1 27 ARG HD3 . . 5.270 4.955 4.707 5.273 0.003 18 0 "[ . 1 . 2 . 3]" 1
656 1 27 ARG H 1 27 ARG HG2 . . 4.070 2.738 2.543 3.545 . 0 0 "[ . 1 . 2 . 3]" 1
657 1 27 ARG H 1 27 ARG QG . . 3.270 2.555 2.441 2.644 . 0 0 "[ . 1 . 2 . 3]" 1
658 1 27 ARG H 1 27 ARG HG3 . . 4.070 3.220 2.487 3.465 . 0 0 "[ . 1 . 2 . 3]" 1
659 1 27 ARG H 1 28 LEU H . . 4.370 4.238 4.180 4.276 . 0 0 "[ . 1 . 2 . 3]" 1
660 1 27 ARG H 1 28 LEU MD2 . . 4.010 3.922 3.769 4.012 0.002 21 0 "[ . 1 . 2 . 3]" 1
661 1 27 ARG H 1 28 LEU HG . . 4.240 3.959 3.814 4.140 . 0 0 "[ . 1 . 2 . 3]" 1
662 1 27 ARG HA 1 27 ARG QD . . 4.590 4.294 4.117 4.342 . 0 0 "[ . 1 . 2 . 3]" 1
663 1 27 ARG HA 1 28 LEU H . . 3.250 2.260 2.187 2.306 . 0 0 "[ . 1 . 2 . 3]" 1
664 1 27 ARG HA 1 28 LEU MD2 . . 4.950 4.873 4.729 4.954 0.004 17 0 "[ . 1 . 2 . 3]" 1
665 1 27 ARG HA 1 84 TRP H . . 4.740 4.356 4.189 4.477 . 0 0 "[ . 1 . 2 . 3]" 1
666 1 27 ARG HA 1 85 MET HA . . 4.690 2.852 2.712 3.017 . 0 0 "[ . 1 . 2 . 3]" 1
667 1 27 ARG HA 1 85 MET HB2 . . 4.490 3.153 2.950 3.354 . 0 0 "[ . 1 . 2 . 3]" 1
668 1 27 ARG HA 1 85 MET ME . . 4.790 4.539 4.291 4.792 0.002 26 0 "[ . 1 . 2 . 3]" 1
669 1 27 ARG HA 1 85 MET HG2 . . 4.780 4.685 4.496 4.784 0.004 13 0 "[ . 1 . 2 . 3]" 1
670 1 27 ARG HA 1 85 MET HG3 . . 5.440 5.180 5.074 5.333 . 0 0 "[ . 1 . 2 . 3]" 1
671 1 27 ARG HB2 1 27 ARG HD2 . . 4.040 2.549 2.282 3.124 . 0 0 "[ . 1 . 2 . 3]" 1
672 1 27 ARG HB2 1 27 ARG QD . . 3.550 2.397 2.136 2.506 . 0 0 "[ . 1 . 2 . 3]" 1
673 1 27 ARG HB2 1 27 ARG HD3 . . 4.040 3.012 2.571 3.242 . 0 0 "[ . 1 . 2 . 3]" 1
674 1 27 ARG HB2 1 28 LEU H . . 4.310 3.020 2.907 3.254 . 0 0 "[ . 1 . 2 . 3]" 1
675 1 27 ARG HB2 1 83 TRP HB2 . . 5.120 4.076 3.726 4.724 . 0 0 "[ . 1 . 2 . 3]" 1
676 1 27 ARG HB2 1 83 TRP HB3 . . 4.090 2.459 2.189 3.014 . 0 0 "[ . 1 . 2 . 3]" 1
677 1 27 ARG HB2 1 83 TRP HE3 . . 5.210 2.989 2.747 3.490 . 0 0 "[ . 1 . 2 . 3]" 1
678 1 27 ARG HB2 1 85 MET ME . . 5.380 5.003 4.824 5.280 . 0 0 "[ . 1 . 2 . 3]" 1
679 1 27 ARG HB2 1 85 MET HG2 . . 4.660 4.401 4.051 4.664 0.004 11 0 "[ . 1 . 2 . 3]" 1
680 1 27 ARG HB3 1 28 LEU H . . 4.310 4.095 3.996 4.155 . 0 0 "[ . 1 . 2 . 3]" 1
681 1 27 ARG HB3 1 83 TRP HB3 . . 4.350 3.851 3.446 4.351 0.001 4 0 "[ . 1 . 2 . 3]" 1
682 1 27 ARG HB3 1 85 MET ME . . 4.960 3.699 3.494 3.951 . 0 0 "[ . 1 . 2 . 3]" 1
683 1 27 ARG HB3 1 85 MET HG2 . . 4.620 4.124 3.868 4.411 . 0 0 "[ . 1 . 2 . 3]" 1
684 1 27 ARG QD 1 83 TRP HB3 . . 4.490 3.054 2.797 3.398 . 0 0 "[ . 1 . 2 . 3]" 1
685 1 27 ARG QD 1 83 TRP HE1 . . 4.530 3.906 2.883 4.349 . 0 0 "[ . 1 . 2 . 3]" 1
686 1 27 ARG QD 1 83 TRP HE3 . . 4.670 3.628 2.973 4.256 . 0 0 "[ . 1 . 2 . 3]" 1
687 1 27 ARG HD2 1 83 TRP HE3 . . 5.320 3.719 3.015 4.536 . 0 0 "[ . 1 . 2 . 3]" 1
688 1 27 ARG HD3 1 83 TRP HE3 . . 5.320 5.092 4.517 5.326 0.006 15 0 "[ . 1 . 2 . 3]" 1
689 1 27 ARG HE 1 27 ARG HG2 . . 4.070 2.764 2.538 3.442 . 0 0 "[ . 1 . 2 . 3]" 1
690 1 27 ARG HE 1 27 ARG HG3 . . 4.070 2.811 2.343 3.809 . 0 0 "[ . 1 . 2 . 3]" 1
691 1 27 ARG HE 1 83 TRP HE1 . . 5.380 4.881 2.900 5.397 0.017 29 0 "[ . 1 . 2 . 3]" 1
692 1 27 ARG QG 1 83 TRP HB3 . . 5.340 4.094 3.630 4.561 . 0 0 "[ . 1 . 2 . 3]" 1
693 1 27 ARG QG 1 83 TRP HE3 . . 5.340 3.243 2.759 4.490 . 0 0 "[ . 1 . 2 . 3]" 1
694 1 28 LEU H 1 28 LEU HB2 . . 4.110 2.707 2.630 2.747 . 0 0 "[ . 1 . 2 . 3]" 1
695 1 28 LEU H 1 28 LEU MD1 . . 4.500 4.484 4.380 4.512 0.012 1 0 "[ . 1 . 2 . 3]" 1
696 1 28 LEU H 1 28 LEU MD2 . . 4.380 4.112 3.995 4.161 . 0 0 "[ . 1 . 2 . 3]" 1
697 1 28 LEU H 1 28 LEU HG . . 4.620 3.709 3.545 3.760 . 0 0 "[ . 1 . 2 . 3]" 1
698 1 28 LEU H 1 33 ILE MD . . 4.600 3.897 3.711 4.074 . 0 0 "[ . 1 . 2 . 3]" 1
699 1 28 LEU H 1 83 TRP HE3 . . 4.680 3.185 3.011 3.627 . 0 0 "[ . 1 . 2 . 3]" 1
700 1 28 LEU H 1 83 TRP HZ3 . . 5.390 4.574 4.205 5.325 . 0 0 "[ . 1 . 2 . 3]" 1
701 1 28 LEU H 1 84 TRP H . . 4.030 2.761 2.647 2.855 . 0 0 "[ . 1 . 2 . 3]" 1
702 1 28 LEU HA 1 28 LEU MD1 . . 4.070 3.805 3.784 3.827 . 0 0 "[ . 1 . 2 . 3]" 1
703 1 28 LEU HA 1 28 LEU MD2 . . 2.830 2.145 2.103 2.183 . 0 0 "[ . 1 . 2 . 3]" 1
704 1 28 LEU HA 1 29 THR MG . . 4.440 3.757 3.618 3.888 . 0 0 "[ . 1 . 2 . 3]" 1
705 1 28 LEU HA 1 32 GLN HB2 . . 4.600 3.729 3.576 3.854 . 0 0 "[ . 1 . 2 . 3]" 1
706 1 28 LEU HA 1 32 GLN HB3 . . 4.660 4.184 3.858 4.404 . 0 0 "[ . 1 . 2 . 3]" 1
707 1 28 LEU HA 1 33 ILE MD . . 5.020 4.805 4.658 4.987 . 0 0 "[ . 1 . 2 . 3]" 1
708 1 28 LEU HA 1 83 TRP HE3 . . 4.410 2.853 2.642 3.313 . 0 0 "[ . 1 . 2 . 3]" 1
709 1 28 LEU HA 1 83 TRP HZ3 . . 4.450 2.331 2.049 2.915 . 0 0 "[ . 1 . 2 . 3]" 1
710 1 28 LEU HB2 1 28 LEU MD1 . . 3.540 2.351 2.324 2.389 . 0 0 "[ . 1 . 2 . 3]" 1
711 1 28 LEU HB2 1 29 THR H . . 4.600 3.951 3.847 4.080 . 0 0 "[ . 1 . 2 . 3]" 1
712 1 28 LEU HB2 1 32 GLN HB2 . . 4.700 4.181 3.896 4.553 . 0 0 "[ . 1 . 2 . 3]" 1
713 1 28 LEU HB2 1 33 ILE H . . 4.590 4.516 4.409 4.592 0.002 24 0 "[ . 1 . 2 . 3]" 1
714 1 28 LEU HB2 1 33 ILE MD . . 3.580 2.756 2.548 2.927 . 0 0 "[ . 1 . 2 . 3]" 1
715 1 28 LEU HB2 1 33 ILE HG12 . . 4.280 3.045 2.921 3.210 . 0 0 "[ . 1 . 2 . 3]" 1
716 1 28 LEU HB2 1 33 ILE HG13 . . 4.220 2.642 2.539 2.706 . 0 0 "[ . 1 . 2 . 3]" 1
717 1 28 LEU HB2 1 33 ILE MG . . 5.390 4.805 4.705 4.926 . 0 0 "[ . 1 . 2 . 3]" 1
718 1 28 LEU HB3 1 28 LEU MD1 . . 3.390 2.239 2.207 2.293 . 0 0 "[ . 1 . 2 . 3]" 1
719 1 28 LEU HB3 1 28 LEU MD2 . . 3.270 2.456 2.407 2.505 . 0 0 "[ . 1 . 2 . 3]" 1
720 1 28 LEU HB3 1 29 THR H . . 4.470 2.691 2.527 2.882 . 0 0 "[ . 1 . 2 . 3]" 1
721 1 28 LEU HB3 1 29 THR MG . . 5.500 4.793 4.675 4.921 . 0 0 "[ . 1 . 2 . 3]" 1
722 1 28 LEU HB3 1 32 GLN H . . 5.080 4.242 4.125 4.397 . 0 0 "[ . 1 . 2 . 3]" 1
723 1 28 LEU HB3 1 32 GLN HB2 . . 4.430 2.443 2.162 2.807 . 0 0 "[ . 1 . 2 . 3]" 1
724 1 28 LEU HB3 1 32 GLN QG . . 4.920 4.001 3.500 4.521 . 0 0 "[ . 1 . 2 . 3]" 1
725 1 28 LEU HB3 1 33 ILE H . . 4.550 3.386 3.253 3.503 . 0 0 "[ . 1 . 2 . 3]" 1
726 1 28 LEU HB3 1 33 ILE MG . . 5.500 5.030 4.939 5.166 . 0 0 "[ . 1 . 2 . 3]" 1
727 1 28 LEU MD1 1 29 THR H . . 4.790 4.318 4.145 4.451 . 0 0 "[ . 1 . 2 . 3]" 1
728 1 28 LEU MD1 1 32 GLN HB2 . . 4.980 3.218 2.816 3.636 . 0 0 "[ . 1 . 2 . 3]" 1
729 1 28 LEU MD1 1 32 GLN HB3 . . 4.090 2.270 2.147 2.504 . 0 0 "[ . 1 . 2 . 3]" 1
730 1 28 LEU MD1 1 33 ILE H . . 4.260 3.524 3.410 3.676 . 0 0 "[ . 1 . 2 . 3]" 1
731 1 28 LEU MD1 1 33 ILE HA . . 3.460 2.728 2.607 2.871 . 0 0 "[ . 1 . 2 . 3]" 1
732 1 28 LEU MD1 1 33 ILE MG . . 5.070 3.770 3.657 3.889 . 0 0 "[ . 1 . 2 . 3]" 1
733 1 28 LEU MD1 1 36 TRP HD1 . . 4.570 4.032 3.764 4.205 . 0 0 "[ . 1 . 2 . 3]" 1
734 1 28 LEU MD2 1 29 THR H . . 3.510 3.162 3.032 3.274 . 0 0 "[ . 1 . 2 . 3]" 1
735 1 28 LEU MD2 1 32 GLN H . . 5.460 4.751 4.655 4.835 . 0 0 "[ . 1 . 2 . 3]" 1
736 1 28 LEU MD2 1 32 GLN HB2 . . 3.320 2.805 2.643 3.026 . 0 0 "[ . 1 . 2 . 3]" 1
737 1 28 LEU MD2 1 32 GLN HB3 . . 3.040 2.113 2.025 2.204 . 0 0 "[ . 1 . 2 . 3]" 1
738 1 28 LEU MD2 1 32 GLN HE21 . . 4.150 3.517 2.865 4.193 0.043 19 0 "[ . 1 . 2 . 3]" 1
739 1 28 LEU MD2 1 32 GLN HE22 . . 4.150 3.239 2.457 4.183 0.033 26 0 "[ . 1 . 2 . 3]" 1
740 1 28 LEU MD2 1 32 GLN QG . . 4.080 2.813 2.285 3.446 . 0 0 "[ . 1 . 2 . 3]" 1
741 1 28 LEU MD2 1 33 ILE H . . 4.900 4.666 4.552 4.773 . 0 0 "[ . 1 . 2 . 3]" 1
742 1 28 LEU MD2 1 33 ILE MD . . 4.920 4.856 4.660 4.999 0.079 26 0 "[ . 1 . 2 . 3]" 1
743 1 28 LEU MD2 1 33 ILE HG12 . . 5.430 5.036 4.892 5.162 . 0 0 "[ . 1 . 2 . 3]" 1
744 1 28 LEU MD2 1 83 TRP HE3 . . 5.500 4.472 4.243 4.876 . 0 0 "[ . 1 . 2 . 3]" 1
745 1 28 LEU MD2 1 83 TRP HZ3 . . 4.010 3.270 2.961 3.735 . 0 0 "[ . 1 . 2 . 3]" 1
746 1 29 THR H 1 29 THR MG . . 3.230 2.478 2.349 2.604 . 0 0 "[ . 1 . 2 . 3]" 1
747 1 29 THR H 1 32 GLN H . . 4.320 3.633 3.500 3.786 . 0 0 "[ . 1 . 2 . 3]" 1
748 1 29 THR H 1 32 GLN HB2 . . 4.080 2.361 2.216 2.620 . 0 0 "[ . 1 . 2 . 3]" 1
749 1 29 THR H 1 32 GLN HB3 . . 4.270 3.680 3.305 3.898 . 0 0 "[ . 1 . 2 . 3]" 1
750 1 29 THR H 1 32 GLN QG . . 4.330 3.085 2.503 3.769 . 0 0 "[ . 1 . 2 . 3]" 1
751 1 29 THR H 1 33 ILE MD . . 5.140 4.492 4.280 4.722 . 0 0 "[ . 1 . 2 . 3]" 1
752 1 29 THR H 1 83 TRP HZ3 . . 4.840 3.065 2.551 3.433 . 0 0 "[ . 1 . 2 . 3]" 1
753 1 29 THR HA 1 29 THR MG . . 3.100 2.354 2.284 2.412 . 0 0 "[ . 1 . 2 . 3]" 1
754 1 29 THR HA 1 31 SER H . . 4.810 4.550 4.462 4.642 . 0 0 "[ . 1 . 2 . 3]" 1
755 1 29 THR HA 1 84 TRP H . . 4.490 3.302 3.016 3.493 . 0 0 "[ . 1 . 2 . 3]" 1
756 1 29 THR HA 1 84 TRP HD1 . . 4.240 2.597 2.353 2.760 . 0 0 "[ . 1 . 2 . 3]" 1
757 1 29 THR HB 1 30 LEU H . . 4.230 2.431 2.318 2.493 . 0 0 "[ . 1 . 2 . 3]" 1
758 1 29 THR HB 1 31 SER H . . 4.030 3.065 2.875 3.280 . 0 0 "[ . 1 . 2 . 3]" 1
759 1 29 THR HB 1 32 GLN H . . 4.580 3.909 3.745 4.158 . 0 0 "[ . 1 . 2 . 3]" 1
760 1 29 THR MG 1 30 LEU H . . 3.880 3.742 3.591 3.806 . 0 0 "[ . 1 . 2 . 3]" 1
761 1 29 THR MG 1 31 SER H . . 4.710 4.535 4.383 4.659 . 0 0 "[ . 1 . 2 . 3]" 1
762 1 29 THR MG 1 32 GLN H . . 4.730 4.452 4.310 4.579 . 0 0 "[ . 1 . 2 . 3]" 1
763 1 29 THR MG 1 32 GLN HB2 . . 4.430 4.205 3.906 4.436 0.006 21 0 "[ . 1 . 2 . 3]" 1
764 1 29 THR MG 1 32 GLN QG . . 4.530 3.807 3.301 4.384 . 0 0 "[ . 1 . 2 . 3]" 1
765 1 29 THR MG 1 81 SER HB2 . . 3.860 2.923 2.191 3.884 0.024 6 0 "[ . 1 . 2 . 3]" 1
766 1 29 THR MG 1 81 SER QB . . 3.370 2.582 2.137 3.204 . 0 0 "[ . 1 . 2 . 3]" 1
767 1 29 THR MG 1 81 SER HB3 . . 3.860 3.185 2.330 3.898 0.038 10 0 "[ . 1 . 2 . 3]" 1
768 1 29 THR MG 1 83 TRP H . . 5.290 4.387 3.806 4.881 . 0 0 "[ . 1 . 2 . 3]" 1
769 1 29 THR MG 1 83 TRP HB3 . . 4.980 4.718 4.346 4.992 0.012 5 0 "[ . 1 . 2 . 3]" 1
770 1 29 THR MG 1 83 TRP HE3 . . 3.680 2.987 2.782 3.184 . 0 0 "[ . 1 . 2 . 3]" 1
771 1 29 THR MG 1 83 TRP HH2 . . 4.560 3.755 3.416 3.984 . 0 0 "[ . 1 . 2 . 3]" 1
772 1 29 THR MG 1 83 TRP HZ2 . . 4.560 4.444 4.100 4.590 0.030 28 0 "[ . 1 . 2 . 3]" 1
773 1 29 THR MG 1 83 TRP HZ3 . . 4.090 2.877 2.463 3.346 . 0 0 "[ . 1 . 2 . 3]" 1
774 1 29 THR MG 1 84 TRP H . . 4.480 4.331 4.195 4.471 . 0 0 "[ . 1 . 2 . 3]" 1
775 1 29 THR MG 1 84 TRP HD1 . . 4.410 4.401 4.182 4.457 0.047 10 0 "[ . 1 . 2 . 3]" 1
776 1 30 LEU H 1 30 LEU HB2 . . 3.930 2.231 2.115 2.436 . 0 0 "[ . 1 . 2 . 3]" 1
777 1 30 LEU H 1 30 LEU HB3 . . 3.930 3.279 2.544 3.565 . 0 0 "[ . 1 . 2 . 3]" 1
778 1 30 LEU H 1 30 LEU MD1 . . 4.450 3.853 3.612 4.121 . 0 0 "[ . 1 . 2 . 3]" 1
779 1 30 LEU H 1 30 LEU QD . . 3.870 3.510 3.311 3.704 . 0 0 "[ . 1 . 2 . 3]" 1
780 1 30 LEU H 1 30 LEU MD2 . . 4.450 4.050 3.786 4.262 . 0 0 "[ . 1 . 2 . 3]" 1
781 1 30 LEU H 1 31 SER H . . 4.060 2.851 2.797 2.895 . 0 0 "[ . 1 . 2 . 3]" 1
782 1 30 LEU H 1 33 ILE MD . . 4.810 3.899 3.781 4.087 . 0 0 "[ . 1 . 2 . 3]" 1
783 1 30 LEU H 1 84 TRP HD1 . . 4.450 2.867 2.571 3.102 . 0 0 "[ . 1 . 2 . 3]" 1
784 1 30 LEU HA 1 30 LEU MD1 . . 4.060 3.418 2.096 3.846 . 0 0 "[ . 1 . 2 . 3]" 1
785 1 30 LEU HA 1 30 LEU QD . . 3.050 2.083 2.012 2.148 . 0 0 "[ . 1 . 2 . 3]" 1
786 1 30 LEU HA 1 30 LEU MD2 . . 4.060 2.497 2.020 3.886 . 0 0 "[ . 1 . 2 . 3]" 1
787 1 30 LEU HA 1 33 ILE H . . 4.190 3.468 3.379 3.662 . 0 0 "[ . 1 . 2 . 3]" 1
788 1 30 LEU HA 1 33 ILE HB . . 3.850 2.932 2.764 3.252 . 0 0 "[ . 1 . 2 . 3]" 1
789 1 30 LEU HA 1 33 ILE MD . . 3.170 2.061 1.991 2.157 . 0 0 "[ . 1 . 2 . 3]" 1
790 1 30 LEU HA 1 33 ILE HG12 . . 5.020 4.853 4.755 4.980 . 0 0 "[ . 1 . 2 . 3]" 1
791 1 30 LEU HA 1 33 ILE MG . . 4.410 4.271 4.154 4.455 0.045 2 0 "[ . 1 . 2 . 3]" 1
792 1 30 LEU HA 1 60 ILE MG . . 5.030 4.194 3.970 4.537 . 0 0 "[ . 1 . 2 . 3]" 1
793 1 30 LEU HA 1 84 TRP HD1 . . 4.610 3.663 3.165 3.982 . 0 0 "[ . 1 . 2 . 3]" 1
794 1 30 LEU QB 1 30 LEU QD . . 2.700 1.943 1.924 1.970 . 0 0 "[ . 1 . 2 . 3]" 1
795 1 30 LEU QB 1 31 SER H . . 3.590 2.698 2.558 2.803 . 0 0 "[ . 1 . 2 . 3]" 1
796 1 30 LEU QB 1 84 TRP HD1 . . 4.580 3.974 3.020 4.466 . 0 0 "[ . 1 . 2 . 3]" 1
797 1 30 LEU QB 1 84 TRP HE1 . . 4.140 3.323 2.067 4.042 . 0 0 "[ . 1 . 2 . 3]" 1
798 1 30 LEU HB2 1 30 LEU MD1 . . 3.610 2.321 2.261 2.425 . 0 0 "[ . 1 . 2 . 3]" 1
799 1 30 LEU HB2 1 30 LEU MD2 . . 3.610 3.031 2.338 3.256 . 0 0 "[ . 1 . 2 . 3]" 1
800 1 30 LEU HB2 1 31 SER H . . 4.250 3.172 2.767 3.980 . 0 0 "[ . 1 . 2 . 3]" 1
801 1 30 LEU HB3 1 30 LEU MD1 . . 3.610 2.604 2.324 3.246 . 0 0 "[ . 1 . 2 . 3]" 1
802 1 30 LEU HB3 1 30 LEU MD2 . . 3.610 2.348 2.300 2.459 . 0 0 "[ . 1 . 2 . 3]" 1
803 1 30 LEU HB3 1 31 SER H . . 4.250 3.091 2.594 3.359 . 0 0 "[ . 1 . 2 . 3]" 1
804 1 30 LEU QD 1 31 SER H . . 4.390 4.141 3.961 4.221 . 0 0 "[ . 1 . 2 . 3]" 1
805 1 30 LEU QD 1 33 ILE H . . 5.440 4.555 4.211 4.779 . 0 0 "[ . 1 . 2 . 3]" 1
806 1 30 LEU QD 1 33 ILE HB . . 3.860 3.230 2.887 3.604 . 0 0 "[ . 1 . 2 . 3]" 1
807 1 30 LEU QD 1 34 TYR H . . 5.440 4.480 4.042 4.836 . 0 0 "[ . 1 . 2 . 3]" 1
808 1 30 LEU QD 1 34 TYR QD . . 4.350 3.789 3.469 4.169 . 0 0 "[ . 1 . 2 . 3]" 1
809 1 30 LEU QD 1 34 TYR QE . . 3.420 2.425 2.171 2.812 . 0 0 "[ . 1 . 2 . 3]" 1
810 1 30 LEU QD 1 57 LYS HA . . 4.640 4.257 3.752 4.673 0.033 10 0 "[ . 1 . 2 . 3]" 1
811 1 30 LEU QD 1 57 LYS QB . . 4.510 3.832 3.431 4.231 . 0 0 "[ . 1 . 2 . 3]" 1
812 1 30 LEU QD 1 60 ILE H . . 5.440 5.103 4.830 5.442 0.002 13 0 "[ . 1 . 2 . 3]" 1
813 1 30 LEU QD 1 60 ILE HB . . 4.680 3.389 3.178 3.788 . 0 0 "[ . 1 . 2 . 3]" 1
814 1 30 LEU QD 1 60 ILE MG . . 2.950 2.275 2.079 2.569 . 0 0 "[ . 1 . 2 . 3]" 1
815 1 30 LEU QD 1 61 ARG H . . 4.340 3.853 3.436 4.148 . 0 0 "[ . 1 . 2 . 3]" 1
816 1 30 LEU QD 1 61 ARG HA . . 3.910 3.153 2.596 3.507 . 0 0 "[ . 1 . 2 . 3]" 1
817 1 30 LEU QD 1 61 ARG QB . . 4.160 3.283 2.551 4.067 . 0 0 "[ . 1 . 2 . 3]" 1
818 1 30 LEU QD 1 61 ARG QD . . 3.310 2.964 2.363 3.435 0.125 7 0 "[ . 1 . 2 . 3]" 1
819 1 30 LEU QD 1 61 ARG QG . . 3.700 2.757 1.962 3.567 . 0 0 "[ . 1 . 2 . 3]" 1
820 1 30 LEU QD 1 64 LEU MD1 . . 3.210 2.050 1.945 2.196 . 0 0 "[ . 1 . 2 . 3]" 1
821 1 30 LEU QD 1 64 LEU MD2 . . 4.170 3.876 3.740 3.995 . 0 0 "[ . 1 . 2 . 3]" 1
822 1 30 LEU QD 1 84 TRP HD1 . . 4.200 3.851 3.575 4.079 . 0 0 "[ . 1 . 2 . 3]" 1
823 1 30 LEU QD 1 84 TRP HE1 . . 3.930 3.044 2.726 3.455 . 0 0 "[ . 1 . 2 . 3]" 1
824 1 30 LEU QD 1 84 TRP HZ2 . . 4.770 3.500 3.140 4.053 . 0 0 "[ . 1 . 2 . 3]" 1
825 1 30 LEU MD1 1 31 SER H . . 5.030 4.682 4.575 4.804 . 0 0 "[ . 1 . 2 . 3]" 1
826 1 30 LEU MD1 1 34 TYR QD . . 5.500 4.965 3.581 5.514 0.014 7 0 "[ . 1 . 2 . 3]" 1
827 1 30 LEU MD1 1 34 TYR QE . . 3.910 3.465 2.443 3.904 . 0 0 "[ . 1 . 2 . 3]" 1
828 1 30 LEU MD1 1 57 LYS HA . . 5.500 5.242 4.463 5.614 0.114 18 0 "[ . 1 . 2 . 3]" 1
829 1 30 LEU MD1 1 61 ARG H . . 5.390 4.740 3.634 5.396 0.006 6 0 "[ . 1 . 2 . 3]" 1
830 1 30 LEU MD1 1 61 ARG HA . . 4.990 3.825 2.957 4.481 . 0 0 "[ . 1 . 2 . 3]" 1
831 1 30 LEU MD1 1 61 ARG QB . . 5.000 3.668 2.742 4.507 . 0 0 "[ . 1 . 2 . 3]" 1
832 1 30 LEU MD1 1 61 ARG QD . . 4.270 3.302 2.504 4.099 . 0 0 "[ . 1 . 2 . 3]" 1
833 1 30 LEU MD1 1 61 ARG QG . . 4.670 3.004 2.015 4.031 . 0 0 "[ . 1 . 2 . 3]" 1
834 1 30 LEU MD1 1 64 LEU MD1 . . 4.090 2.976 2.033 3.567 . 0 0 "[ . 1 . 2 . 3]" 1
835 1 30 LEU MD1 1 84 TRP HD1 . . 5.500 4.433 3.824 4.836 . 0 0 "[ . 1 . 2 . 3]" 1
836 1 30 LEU MD1 1 84 TRP HE1 . . 4.470 3.215 2.758 3.881 . 0 0 "[ . 1 . 2 . 3]" 1
837 1 30 LEU MD1 1 84 TRP HZ2 . . 5.500 3.735 3.175 4.841 . 0 0 "[ . 1 . 2 . 3]" 1
838 1 30 LEU MD2 1 31 SER H . . 5.030 4.620 4.331 4.760 . 0 0 "[ . 1 . 2 . 3]" 1
839 1 30 LEU MD2 1 34 TYR QD . . 5.500 4.124 3.565 5.125 . 0 0 "[ . 1 . 2 . 3]" 1
840 1 30 LEU MD2 1 34 TYR QE . . 3.910 2.639 2.184 3.533 . 0 0 "[ . 1 . 2 . 3]" 1
841 1 30 LEU MD2 1 57 LYS HA . . 5.500 4.602 3.892 5.603 0.103 25 0 "[ . 1 . 2 . 3]" 1
842 1 30 LEU MD2 1 61 ARG H . . 5.390 4.239 3.600 5.366 . 0 0 "[ . 1 . 2 . 3]" 1
843 1 30 LEU MD2 1 61 ARG HA . . 4.990 3.518 2.717 4.662 . 0 0 "[ . 1 . 2 . 3]" 1
844 1 30 LEU MD2 1 61 ARG QB . . 5.000 3.719 2.907 4.630 . 0 0 "[ . 1 . 2 . 3]" 1
845 1 30 LEU MD2 1 61 ARG QD . . 4.270 3.823 2.390 4.365 0.095 18 0 "[ . 1 . 2 . 3]" 1
846 1 30 LEU MD2 1 61 ARG QG . . 4.670 3.324 2.365 3.986 . 0 0 "[ . 1 . 2 . 3]" 1
847 1 30 LEU MD2 1 64 LEU MD1 . . 4.090 2.430 1.956 3.767 . 0 0 "[ . 1 . 2 . 3]" 1
848 1 30 LEU MD2 1 84 TRP HD1 . . 5.500 4.361 3.743 5.245 . 0 0 "[ . 1 . 2 . 3]" 1
849 1 30 LEU MD2 1 84 TRP HE1 . . 4.470 3.972 3.249 4.476 0.006 17 0 "[ . 1 . 2 . 3]" 1
850 1 30 LEU MD2 1 84 TRP HZ2 . . 5.500 4.672 3.557 5.308 . 0 0 "[ . 1 . 2 . 3]" 1
851 1 31 SER H 1 31 SER QB . . 3.830 2.694 2.217 2.883 . 0 0 "[ . 1 . 2 . 3]" 1
852 1 31 SER H 1 32 GLN H . . 3.450 2.685 2.620 2.739 . 0 0 "[ . 1 . 2 . 3]" 1
853 1 31 SER H 1 33 ILE MD . . 5.440 4.904 4.826 5.004 . 0 0 "[ . 1 . 2 . 3]" 1
854 1 31 SER QB 1 32 GLN H . . 4.360 2.972 2.445 3.463 . 0 0 "[ . 1 . 2 . 3]" 1
855 1 32 GLN H 1 32 GLN HB2 . . 4.110 2.187 2.009 2.382 . 0 0 "[ . 1 . 2 . 3]" 1
856 1 32 GLN H 1 32 GLN HB3 . . 3.800 3.484 3.317 3.570 . 0 0 "[ . 1 . 2 . 3]" 1
857 1 32 GLN H 1 32 GLN QG . . 3.310 2.703 2.314 3.178 . 0 0 "[ . 1 . 2 . 3]" 1
858 1 32 GLN H 1 33 ILE H . . 3.630 2.622 2.517 2.747 . 0 0 "[ . 1 . 2 . 3]" 1
859 1 32 GLN H 1 33 ILE HB . . 5.370 4.790 4.612 4.955 . 0 0 "[ . 1 . 2 . 3]" 1
860 1 32 GLN H 1 33 ILE MD . . 4.720 4.645 4.444 4.741 0.021 17 0 "[ . 1 . 2 . 3]" 1
861 1 32 GLN H 1 33 ILE HG13 . . 5.500 4.361 4.225 4.490 . 0 0 "[ . 1 . 2 . 3]" 1
862 1 32 GLN HA 1 32 GLN QG . . 3.590 2.466 2.028 2.972 . 0 0 "[ . 1 . 2 . 3]" 1
863 1 32 GLN HA 1 33 ILE HA . . 5.130 4.788 4.767 4.809 . 0 0 "[ . 1 . 2 . 3]" 1
864 1 32 GLN HA 1 35 GLU H . . 4.140 3.303 3.080 3.518 . 0 0 "[ . 1 . 2 . 3]" 1
865 1 32 GLN HA 1 35 GLU QB . . 3.470 2.700 2.363 3.519 0.049 19 0 "[ . 1 . 2 . 3]" 1
866 1 32 GLN HA 1 35 GLU HG2 . . 5.500 4.113 1.963 5.051 . 0 0 "[ . 1 . 2 . 3]" 1
867 1 32 GLN HA 1 35 GLU QG . . 4.670 3.374 1.953 4.005 . 0 0 "[ . 1 . 2 . 3]" 1
868 1 32 GLN HA 1 35 GLU HG3 . . 5.500 3.816 3.142 4.644 . 0 0 "[ . 1 . 2 . 3]" 1
869 1 32 GLN HB2 1 33 ILE H . . 4.210 2.801 2.605 3.078 . 0 0 "[ . 1 . 2 . 3]" 1
870 1 32 GLN HB2 1 33 ILE MD . . 5.490 4.442 4.094 4.831 . 0 0 "[ . 1 . 2 . 3]" 1
871 1 32 GLN HB3 1 33 ILE H . . 4.390 3.418 3.138 3.581 . 0 0 "[ . 1 . 2 . 3]" 1
872 1 32 GLN HB3 1 33 ILE HA . . 4.600 4.154 4.002 4.279 . 0 0 "[ . 1 . 2 . 3]" 1
873 1 32 GLN HB3 1 33 ILE MD . . 5.070 5.149 4.907 5.268 0.198 29 0 "[ . 1 . 2 . 3]" 1
874 1 32 GLN QG 1 33 ILE H . . 4.710 4.342 4.141 4.536 . 0 0 "[ . 1 . 2 . 3]" 1
875 1 33 ILE H 1 33 ILE HB . . 3.380 2.443 2.375 2.489 . 0 0 "[ . 1 . 2 . 3]" 1
876 1 33 ILE H 1 33 ILE MD . . 3.340 3.126 3.027 3.229 . 0 0 "[ . 1 . 2 . 3]" 1
877 1 33 ILE H 1 33 ILE HG12 . . 3.670 3.680 3.673 3.693 0.023 29 0 "[ . 1 . 2 . 3]" 1
878 1 33 ILE H 1 33 ILE HG13 . . 3.940 2.223 2.200 2.246 . 0 0 "[ . 1 . 2 . 3]" 1
879 1 33 ILE H 1 33 ILE MG . . 3.930 3.794 3.757 3.822 . 0 0 "[ . 1 . 2 . 3]" 1
880 1 33 ILE H 1 34 TYR H . . 3.690 2.595 2.528 2.646 . 0 0 "[ . 1 . 2 . 3]" 1
881 1 33 ILE HA 1 33 ILE MD . . 3.990 3.867 3.825 3.898 . 0 0 "[ . 1 . 2 . 3]" 1
882 1 33 ILE HA 1 33 ILE HG12 . . 3.760 2.718 2.692 2.763 . 0 0 "[ . 1 . 2 . 3]" 1
883 1 33 ILE HA 1 33 ILE HG13 . . 3.790 2.678 2.602 2.739 . 0 0 "[ . 1 . 2 . 3]" 1
884 1 33 ILE HA 1 33 ILE MG . . 3.100 2.483 2.465 2.517 . 0 0 "[ . 1 . 2 . 3]" 1
885 1 33 ILE HA 1 37 MET ME . . 5.030 4.729 4.597 4.856 . 0 0 "[ . 1 . 2 . 3]" 1
886 1 33 ILE HB 1 33 ILE MD . . 3.000 2.295 2.257 2.316 . 0 0 "[ . 1 . 2 . 3]" 1
887 1 33 ILE HB 1 34 TYR H . . 3.590 2.738 2.690 2.792 . 0 0 "[ . 1 . 2 . 3]" 1
888 1 33 ILE HB 1 60 ILE MG . . 4.430 3.414 3.136 3.732 . 0 0 "[ . 1 . 2 . 3]" 1
889 1 33 ILE MD 1 33 ILE MG . . 2.720 2.269 2.220 2.332 . 0 0 "[ . 1 . 2 . 3]" 1
890 1 33 ILE MD 1 34 TYR H . . 4.400 4.431 4.405 4.474 0.074 28 0 "[ . 1 . 2 . 3]" 1
891 1 33 ILE MD 1 34 TYR QD . . 5.080 5.082 4.901 5.160 0.080 29 0 "[ . 1 . 2 . 3]" 1
892 1 33 ILE MD 1 64 LEU MD1 . . 3.500 2.826 2.449 3.430 . 0 0 "[ . 1 . 2 . 3]" 1
893 1 33 ILE MD 1 64 LEU MD2 . . 3.870 2.991 2.693 3.335 . 0 0 "[ . 1 . 2 . 3]" 1
894 1 33 ILE MD 1 84 TRP H . . 4.650 3.950 3.720 4.204 . 0 0 "[ . 1 . 2 . 3]" 1
895 1 33 ILE MD 1 84 TRP HA . . 5.500 4.977 4.812 5.158 . 0 0 "[ . 1 . 2 . 3]" 1
896 1 33 ILE MD 1 84 TRP HB2 . . 3.730 2.385 2.203 2.545 . 0 0 "[ . 1 . 2 . 3]" 1
897 1 33 ILE MD 1 84 TRP QB . . 3.250 2.345 2.173 2.494 . 0 0 "[ . 1 . 2 . 3]" 1
898 1 33 ILE MD 1 84 TRP HB3 . . 3.730 3.462 3.265 3.626 . 0 0 "[ . 1 . 2 . 3]" 1
899 1 33 ILE MD 1 84 TRP HD1 . . 4.040 3.262 3.063 3.403 . 0 0 "[ . 1 . 2 . 3]" 1
900 1 33 ILE MD 1 84 TRP HE1 . . 4.890 4.837 4.577 4.931 0.041 30 0 "[ . 1 . 2 . 3]" 1
901 1 33 ILE MD 1 84 TRP HE3 . . 5.500 5.345 5.054 5.532 0.032 23 0 "[ . 1 . 2 . 3]" 1
902 1 33 ILE HG12 1 33 ILE MG . . 2.920 2.255 2.232 2.283 . 0 0 "[ . 1 . 2 . 3]" 1
903 1 33 ILE MG 1 34 TYR H . . 3.600 3.546 3.504 3.602 0.002 19 0 "[ . 1 . 2 . 3]" 1
904 1 33 ILE MG 1 34 TYR HA . . 4.640 3.562 3.518 3.645 . 0 0 "[ . 1 . 2 . 3]" 1
905 1 33 ILE MG 1 34 TYR QB . . 5.340 4.882 4.828 4.960 . 0 0 "[ . 1 . 2 . 3]" 1
906 1 33 ILE MG 1 34 TYR QD . . 3.930 3.328 3.025 3.459 . 0 0 "[ . 1 . 2 . 3]" 1
907 1 33 ILE MG 1 36 TRP QB . . 5.340 3.673 3.578 3.778 . 0 0 "[ . 1 . 2 . 3]" 1
908 1 33 ILE MG 1 36 TRP HE3 . . 4.370 4.025 3.900 4.168 . 0 0 "[ . 1 . 2 . 3]" 1
909 1 33 ILE MG 1 37 MET H . . 4.510 4.204 4.125 4.341 . 0 0 "[ . 1 . 2 . 3]" 1
910 1 33 ILE MG 1 37 MET ME . . 3.240 2.216 2.098 2.411 . 0 0 "[ . 1 . 2 . 3]" 1
911 1 33 ILE MG 1 37 MET HG2 . . 4.590 4.247 4.155 4.442 . 0 0 "[ . 1 . 2 . 3]" 1
912 1 33 ILE MG 1 37 MET HG3 . . 3.870 3.027 2.915 3.219 . 0 0 "[ . 1 . 2 . 3]" 1
913 1 33 ILE MG 1 60 ILE MD . . 3.580 2.477 2.278 2.860 . 0 0 "[ . 1 . 2 . 3]" 1
914 1 33 ILE MG 1 64 LEU MD1 . . 4.690 3.934 3.530 4.398 . 0 0 "[ . 1 . 2 . 3]" 1
915 1 33 ILE MG 1 64 LEU MD2 . . 4.700 4.167 3.883 4.458 . 0 0 "[ . 1 . 2 . 3]" 1
916 1 34 TYR H 1 34 TYR QB . . 3.500 2.585 2.463 2.692 . 0 0 "[ . 1 . 2 . 3]" 1
917 1 34 TYR H 1 34 TYR QD . . 4.070 2.984 2.799 3.083 . 0 0 "[ . 1 . 2 . 3]" 1
918 1 34 TYR QB 1 35 GLU H . . 3.640 2.358 2.238 2.462 . 0 0 "[ . 1 . 2 . 3]" 1
919 1 34 TYR HB2 1 35 GLU H . . 4.180 2.393 2.271 2.512 . 0 0 "[ . 1 . 2 . 3]" 1
920 1 34 TYR HB3 1 35 GLU H . . 4.180 3.559 3.379 3.676 . 0 0 "[ . 1 . 2 . 3]" 1
921 1 34 TYR QD 1 57 LYS HA . . 4.560 4.122 3.371 4.566 0.006 4 0 "[ . 1 . 2 . 3]" 1
922 1 34 TYR QD 1 60 ILE MD . . 4.200 2.111 2.034 2.238 . 0 0 "[ . 1 . 2 . 3]" 1
923 1 34 TYR QD 1 60 ILE MG . . 4.470 3.474 3.064 3.808 . 0 0 "[ . 1 . 2 . 3]" 1
924 1 34 TYR QE 1 57 LYS HA . . 3.890 2.822 2.557 3.332 . 0 0 "[ . 1 . 2 . 3]" 1
925 1 34 TYR QE 1 57 LYS QB . . 5.030 3.135 2.573 3.558 . 0 0 "[ . 1 . 2 . 3]" 1
926 1 34 TYR QE 1 60 ILE HB . . 4.280 2.554 2.119 2.979 . 0 0 "[ . 1 . 2 . 3]" 1
927 1 34 TYR QE 1 60 ILE MD . . 4.370 2.363 2.244 2.599 . 0 0 "[ . 1 . 2 . 3]" 1
928 1 34 TYR QE 1 60 ILE MG . . 3.330 2.742 2.285 3.091 . 0 0 "[ . 1 . 2 . 3]" 1
929 1 35 GLU H 1 35 GLU HB2 . . 3.710 2.469 2.071 3.649 . 0 0 "[ . 1 . 2 . 3]" 1
930 1 35 GLU H 1 35 GLU QB . . 3.160 2.321 2.054 2.500 . 0 0 "[ . 1 . 2 . 3]" 1
931 1 35 GLU H 1 35 GLU HB3 . . 3.710 3.451 2.415 3.624 . 0 0 "[ . 1 . 2 . 3]" 1
932 1 35 GLU H 1 35 GLU HG2 . . 4.070 3.012 2.223 3.810 . 0 0 "[ . 1 . 2 . 3]" 1
933 1 35 GLU H 1 35 GLU QG . . 3.430 2.487 2.206 3.036 . 0 0 "[ . 1 . 2 . 3]" 1
934 1 35 GLU H 1 35 GLU HG3 . . 4.070 3.234 2.229 3.997 . 0 0 "[ . 1 . 2 . 3]" 1
935 1 35 GLU HA 1 35 GLU HG2 . . 4.080 2.861 2.326 4.041 . 0 0 "[ . 1 . 2 . 3]" 1
936 1 35 GLU HA 1 35 GLU QG . . 3.510 2.673 2.266 3.422 . 0 0 "[ . 1 . 2 . 3]" 1
937 1 35 GLU HA 1 35 GLU HG3 . . 4.080 3.382 2.623 3.762 . 0 0 "[ . 1 . 2 . 3]" 1
938 1 35 GLU HA 1 38 VAL H . . 4.390 3.337 2.932 3.492 . 0 0 "[ . 1 . 2 . 3]" 1
939 1 35 GLU HA 1 38 VAL HA . . 5.500 5.401 5.026 5.509 0.009 26 0 "[ . 1 . 2 . 3]" 1
940 1 35 GLU HA 1 38 VAL HB . . 4.290 2.707 2.463 2.834 . 0 0 "[ . 1 . 2 . 3]" 1
941 1 35 GLU HA 1 38 VAL MG1 . . 4.830 4.092 3.923 4.251 . 0 0 "[ . 1 . 2 . 3]" 1
942 1 35 GLU HA 1 38 VAL QG . . 3.660 2.950 2.645 3.121 . 0 0 "[ . 1 . 2 . 3]" 1
943 1 35 GLU HA 1 38 VAL MG2 . . 4.830 3.027 2.687 3.227 . 0 0 "[ . 1 . 2 . 3]" 1
944 1 35 GLU HB2 1 36 TRP H . . 3.960 2.900 2.583 3.990 0.030 19 0 "[ . 1 . 2 . 3]" 1
945 1 35 GLU HB3 1 36 TRP H . . 3.960 3.583 3.138 3.963 0.003 4 0 "[ . 1 . 2 . 3]" 1
946 1 35 GLU QG 1 36 TRP H . . 5.220 4.104 2.345 4.511 . 0 0 "[ . 1 . 2 . 3]" 1
947 1 36 TRP H 1 36 TRP HB2 . . 3.450 2.521 2.479 2.557 . 0 0 "[ . 1 . 2 . 3]" 1
948 1 36 TRP H 1 36 TRP HB3 . . 3.450 2.506 2.482 2.527 . 0 0 "[ . 1 . 2 . 3]" 1
949 1 36 TRP H 1 36 TRP HE3 . . 4.630 4.648 4.636 4.669 0.039 29 0 "[ . 1 . 2 . 3]" 1
950 1 36 TRP H 1 37 MET H . . 3.720 2.731 2.675 2.795 . 0 0 "[ . 1 . 2 . 3]" 1
951 1 36 TRP H 1 38 VAL H . . 4.810 4.202 4.113 4.277 . 0 0 "[ . 1 . 2 . 3]" 1
952 1 36 TRP HA 1 36 TRP HD1 . . 3.890 3.291 3.237 3.350 . 0 0 "[ . 1 . 2 . 3]" 1
953 1 36 TRP HA 1 39 LYS H . . 4.440 3.528 3.400 3.659 . 0 0 "[ . 1 . 2 . 3]" 1
954 1 36 TRP HA 1 39 LYS HB2 . . 4.510 3.167 2.527 4.120 . 0 0 "[ . 1 . 2 . 3]" 1
955 1 36 TRP HA 1 39 LYS QB . . 3.740 2.817 2.498 3.091 . 0 0 "[ . 1 . 2 . 3]" 1
956 1 36 TRP HA 1 39 LYS HB3 . . 4.510 3.670 2.725 4.449 . 0 0 "[ . 1 . 2 . 3]" 1
957 1 36 TRP QB 1 36 TRP HD1 . . 3.400 2.621 2.605 2.639 . 0 0 "[ . 1 . 2 . 3]" 1
958 1 36 TRP QB 1 36 TRP HE1 . . 4.520 4.466 4.450 4.482 . 0 0 "[ . 1 . 2 . 3]" 1
959 1 36 TRP QB 1 36 TRP HE3 . . 3.670 2.580 2.564 2.604 . 0 0 "[ . 1 . 2 . 3]" 1
960 1 36 TRP QB 1 37 MET H . . 3.680 2.613 2.553 2.676 . 0 0 "[ . 1 . 2 . 3]" 1
961 1 36 TRP HB2 1 37 MET H . . 4.280 3.952 3.893 4.006 . 0 0 "[ . 1 . 2 . 3]" 1
962 1 36 TRP HB3 1 37 MET H . . 4.280 2.651 2.587 2.718 . 0 0 "[ . 1 . 2 . 3]" 1
963 1 36 TRP HE1 1 40 SER QB . . 5.030 4.143 3.862 4.658 . 0 0 "[ . 1 . 2 . 3]" 1
964 1 36 TRP HE3 1 37 MET H . . 4.120 2.918 2.854 3.015 . 0 0 "[ . 1 . 2 . 3]" 1
965 1 36 TRP HE3 1 37 MET HA . . 3.700 2.564 2.451 2.698 . 0 0 "[ . 1 . 2 . 3]" 1
966 1 36 TRP HE3 1 37 MET ME . . 4.190 3.667 3.484 3.797 . 0 0 "[ . 1 . 2 . 3]" 1
967 1 36 TRP HE3 1 37 MET HG2 . . 4.360 2.375 2.138 2.805 . 0 0 "[ . 1 . 2 . 3]" 1
968 1 36 TRP HE3 1 37 MET HG3 . . 4.350 2.421 2.128 2.586 . 0 0 "[ . 1 . 2 . 3]" 1
969 1 36 TRP HE3 1 40 SER QB . . 4.970 3.823 3.469 4.626 . 0 0 "[ . 1 . 2 . 3]" 1
970 1 36 TRP HE3 1 41 VAL QG . . 4.510 4.107 3.799 4.422 . 0 0 "[ . 1 . 2 . 3]" 1
971 1 36 TRP HH2 1 40 SER HB2 . . 4.790 4.325 3.873 4.794 0.004 3 0 "[ . 1 . 2 . 3]" 1
972 1 36 TRP HH2 1 40 SER QB . . 4.140 3.721 3.521 3.900 . 0 0 "[ . 1 . 2 . 3]" 1
973 1 36 TRP HH2 1 40 SER HB3 . . 4.790 4.148 3.701 4.796 0.006 8 0 "[ . 1 . 2 . 3]" 1
974 1 36 TRP HH2 1 41 VAL QG . . 4.680 3.774 3.522 4.002 . 0 0 "[ . 1 . 2 . 3]" 1
975 1 36 TRP HZ2 1 40 SER QB . . 4.190 3.648 3.430 3.918 . 0 0 "[ . 1 . 2 . 3]" 1
976 1 36 TRP HZ3 1 37 MET HA . . 4.690 3.363 3.252 3.498 . 0 0 "[ . 1 . 2 . 3]" 1
977 1 36 TRP HZ3 1 37 MET ME . . 3.970 3.538 3.218 3.784 . 0 0 "[ . 1 . 2 . 3]" 1
978 1 36 TRP HZ3 1 40 SER QB . . 4.530 3.715 3.341 4.491 . 0 0 "[ . 1 . 2 . 3]" 1
979 1 36 TRP HZ3 1 41 VAL QG . . 3.330 3.064 2.781 3.315 . 0 0 "[ . 1 . 2 . 3]" 1
980 1 37 MET H 1 37 MET ME . . 5.180 4.520 4.409 4.738 . 0 0 "[ . 1 . 2 . 3]" 1
981 1 37 MET H 1 37 MET HG2 . . 4.120 3.554 3.395 3.857 . 0 0 "[ . 1 . 2 . 3]" 1
982 1 37 MET H 1 37 MET HG3 . . 3.920 2.535 2.402 2.677 . 0 0 "[ . 1 . 2 . 3]" 1
983 1 37 MET H 1 38 VAL H . . 3.840 2.659 2.612 2.745 . 0 0 "[ . 1 . 2 . 3]" 1
984 1 37 MET H 1 38 VAL HB . . 5.040 4.862 4.780 4.956 . 0 0 "[ . 1 . 2 . 3]" 1
985 1 37 MET H 1 38 VAL QG . . 4.800 4.105 4.015 4.193 . 0 0 "[ . 1 . 2 . 3]" 1
986 1 37 MET H 1 41 VAL QG . . 5.440 5.134 4.826 5.449 0.009 1 0 "[ . 1 . 2 . 3]" 1
987 1 37 MET HA 1 40 SER QB . . 4.720 3.030 2.526 4.093 . 0 0 "[ . 1 . 2 . 3]" 1
988 1 37 MET HA 1 41 VAL QG . . 3.380 2.694 2.373 3.052 . 0 0 "[ . 1 . 2 . 3]" 1
989 1 37 MET QB 1 38 VAL QG . . 4.760 3.341 3.225 3.492 . 0 0 "[ . 1 . 2 . 3]" 1
990 1 37 MET QB 1 41 VAL QG . . 4.310 3.371 3.084 3.644 . 0 0 "[ . 1 . 2 . 3]" 1
991 1 37 MET HB2 1 38 VAL H . . 4.320 2.814 2.698 2.961 . 0 0 "[ . 1 . 2 . 3]" 1
992 1 37 MET HB3 1 38 VAL H . . 4.320 3.672 3.440 3.746 . 0 0 "[ . 1 . 2 . 3]" 1
993 1 37 MET ME 1 37 MET HG3 . . 3.910 2.437 2.382 2.521 . 0 0 "[ . 1 . 2 . 3]" 1
994 1 37 MET ME 1 41 VAL QG . . 5.440 4.404 3.992 4.714 . 0 0 "[ . 1 . 2 . 3]" 1
995 1 37 MET ME 1 60 ILE HA . . 5.240 4.236 4.032 4.454 . 0 0 "[ . 1 . 2 . 3]" 1
996 1 37 MET ME 1 60 ILE MD . . 3.620 2.444 2.333 2.790 . 0 0 "[ . 1 . 2 . 3]" 1
997 1 37 MET ME 1 60 ILE MG . . 4.140 3.233 2.963 3.368 . 0 0 "[ . 1 . 2 . 3]" 1
998 1 37 MET HG2 1 41 VAL QG . . 3.830 3.333 2.950 3.679 . 0 0 "[ . 1 . 2 . 3]" 1
999 1 37 MET HG3 1 60 ILE MD . . 4.600 3.764 3.221 4.264 . 0 0 "[ . 1 . 2 . 3]" 1
1000 1 38 VAL H 1 38 VAL HB . . 3.310 2.487 2.447 2.559 . 0 0 "[ . 1 . 2 . 3]" 1
1001 1 38 VAL H 1 38 VAL MG1 . . 3.790 3.798 3.791 3.812 0.022 30 0 "[ . 1 . 2 . 3]" 1
1002 1 38 VAL H 1 38 VAL QG . . 3.160 2.196 2.121 2.273 . 0 0 "[ . 1 . 2 . 3]" 1
1003 1 38 VAL H 1 38 VAL MG2 . . 3.790 2.210 2.132 2.291 . 0 0 "[ . 1 . 2 . 3]" 1
1004 1 38 VAL H 1 39 LYS H . . 3.710 2.629 2.554 2.704 . 0 0 "[ . 1 . 2 . 3]" 1
1005 1 38 VAL HA 1 38 VAL MG1 . . 3.480 2.485 2.437 2.512 . 0 0 "[ . 1 . 2 . 3]" 1
1006 1 38 VAL HA 1 38 VAL QG . . 2.910 2.172 2.151 2.186 . 0 0 "[ . 1 . 2 . 3]" 1
1007 1 38 VAL HA 1 38 VAL MG2 . . 3.480 2.396 2.366 2.414 . 0 0 "[ . 1 . 2 . 3]" 1
1008 1 38 VAL HA 1 44 PHE HA . . 5.500 5.051 4.587 5.363 . 0 0 "[ . 1 . 2 . 3]" 1
1009 1 38 VAL HA 1 44 PHE HB2 . . 4.120 3.374 3.009 3.756 . 0 0 "[ . 1 . 2 . 3]" 1
1010 1 38 VAL HA 1 44 PHE QB . . 3.540 2.971 2.559 3.278 . 0 0 "[ . 1 . 2 . 3]" 1
1011 1 38 VAL HA 1 44 PHE HB3 . . 4.120 3.347 2.724 3.852 . 0 0 "[ . 1 . 2 . 3]" 1
1012 1 38 VAL HA 1 45 LYS HA . . 4.180 2.896 2.614 3.179 . 0 0 "[ . 1 . 2 . 3]" 1
1013 1 38 VAL HB 1 39 LYS H . . 4.030 2.715 2.601 2.830 . 0 0 "[ . 1 . 2 . 3]" 1
1014 1 38 VAL QG 1 39 LYS H . . 3.550 3.273 3.186 3.365 . 0 0 "[ . 1 . 2 . 3]" 1
1015 1 38 VAL QG 1 39 LYS HA . . 4.640 3.427 3.300 3.638 . 0 0 "[ . 1 . 2 . 3]" 1
1016 1 38 VAL QG 1 39 LYS QB . . 4.820 4.104 3.799 4.429 . 0 0 "[ . 1 . 2 . 3]" 1
1017 1 38 VAL QG 1 39 LYS QD . . 5.280 3.654 2.274 5.087 . 0 0 "[ . 1 . 2 . 3]" 1
1018 1 38 VAL QG 1 44 PHE HA . . 5.440 4.651 4.221 4.924 . 0 0 "[ . 1 . 2 . 3]" 1
1019 1 38 VAL QG 1 44 PHE QB . . 4.000 3.145 2.917 3.402 . 0 0 "[ . 1 . 2 . 3]" 1
1020 1 38 VAL QG 1 45 LYS H . . 5.440 3.926 3.684 4.104 . 0 0 "[ . 1 . 2 . 3]" 1
1021 1 38 VAL QG 1 45 LYS HA . . 3.280 2.087 1.959 2.257 . 0 0 "[ . 1 . 2 . 3]" 1
1022 1 38 VAL QG 1 45 LYS QG . . 4.120 2.471 2.123 3.821 . 0 0 "[ . 1 . 2 . 3]" 1
1023 1 38 VAL QG 1 46 ASP H . . 5.200 4.902 4.753 5.097 . 0 0 "[ . 1 . 2 . 3]" 1
1024 1 38 VAL QG 1 48 GLY H . . 4.850 4.485 3.911 4.725 . 0 0 "[ . 1 . 2 . 3]" 1
1025 1 38 VAL QG 1 48 GLY QA . . 3.940 3.321 2.447 3.806 . 0 0 "[ . 1 . 2 . 3]" 1
1026 1 38 VAL QG 1 56 TRP HH2 . . 3.910 2.317 2.033 2.527 . 0 0 "[ . 1 . 2 . 3]" 1
1027 1 38 VAL QG 1 56 TRP HZ2 . . 3.630 2.187 2.065 2.327 . 0 0 "[ . 1 . 2 . 3]" 1
1028 1 38 VAL MG1 1 39 LYS H . . 4.370 3.501 3.354 3.678 . 0 0 "[ . 1 . 2 . 3]" 1
1029 1 38 VAL MG1 1 44 PHE HB2 . . 5.500 5.204 4.856 5.527 0.027 28 0 "[ . 1 . 2 . 3]" 1
1030 1 38 VAL MG1 1 44 PHE HB3 . . 5.500 4.852 4.431 5.115 . 0 0 "[ . 1 . 2 . 3]" 1
1031 1 38 VAL MG1 1 45 LYS HA . . 4.400 2.133 1.973 2.327 . 0 0 "[ . 1 . 2 . 3]" 1
1032 1 38 VAL MG1 1 48 GLY H . . 5.500 5.126 4.323 5.518 0.018 14 0 "[ . 1 . 2 . 3]" 1
1033 1 38 VAL MG1 1 48 GLY HA2 . . 6.260 4.949 3.639 5.736 . 0 0 "[ . 1 . 2 . 3]" 1
1034 1 38 VAL MG1 1 48 GLY HA3 . . 6.260 4.276 3.017 5.002 . 0 0 "[ . 1 . 2 . 3]" 1
1035 1 38 VAL MG1 1 56 TRP HH2 . . 5.250 5.010 4.699 5.290 0.040 10 0 "[ . 1 . 2 . 3]" 1
1036 1 38 VAL MG1 1 56 TRP HZ2 . . 4.250 4.248 4.094 4.319 0.069 24 0 "[ . 1 . 2 . 3]" 1
1037 1 38 VAL MG2 1 39 LYS H . . 4.370 3.940 3.872 3.997 . 0 0 "[ . 1 . 2 . 3]" 1
1038 1 38 VAL MG2 1 44 PHE HB2 . . 5.500 4.246 3.766 4.557 . 0 0 "[ . 1 . 2 . 3]" 1
1039 1 38 VAL MG2 1 44 PHE HB3 . . 5.500 3.334 3.045 3.636 . 0 0 "[ . 1 . 2 . 3]" 1
1040 1 38 VAL MG2 1 45 LYS HA . . 4.400 3.027 2.550 3.505 . 0 0 "[ . 1 . 2 . 3]" 1
1041 1 38 VAL MG2 1 48 GLY H . . 5.500 4.966 4.466 5.196 . 0 0 "[ . 1 . 2 . 3]" 1
1042 1 38 VAL MG2 1 48 GLY HA2 . . 6.260 3.956 2.806 4.491 . 0 0 "[ . 1 . 2 . 3]" 1
1043 1 38 VAL MG2 1 48 GLY HA3 . . 6.260 4.034 3.246 4.583 . 0 0 "[ . 1 . 2 . 3]" 1
1044 1 38 VAL MG2 1 56 TRP HH2 . . 5.250 2.321 2.035 2.532 . 0 0 "[ . 1 . 2 . 3]" 1
1045 1 38 VAL MG2 1 56 TRP HZ2 . . 4.250 2.194 2.070 2.337 . 0 0 "[ . 1 . 2 . 3]" 1
1046 1 39 LYS H 1 39 LYS HB2 . . 3.440 2.224 2.040 2.509 . 0 0 "[ . 1 . 2 . 3]" 1
1047 1 39 LYS H 1 39 LYS HB3 . . 3.440 3.102 2.489 3.472 0.032 20 0 "[ . 1 . 2 . 3]" 1
1048 1 39 LYS H 1 39 LYS QD . . 4.670 3.587 2.529 4.521 . 0 0 "[ . 1 . 2 . 3]" 1
1049 1 39 LYS H 1 39 LYS HG2 . . 4.830 4.176 2.502 4.640 . 0 0 "[ . 1 . 2 . 3]" 1
1050 1 39 LYS H 1 39 LYS QG . . 4.200 3.710 2.458 4.068 . 0 0 "[ . 1 . 2 . 3]" 1
1051 1 39 LYS H 1 39 LYS HG3 . . 4.830 4.233 3.600 4.536 . 0 0 "[ . 1 . 2 . 3]" 1
1052 1 39 LYS HA 1 39 LYS QD . . 3.680 2.542 2.070 3.738 0.058 24 0 "[ . 1 . 2 . 3]" 1
1053 1 39 LYS QB 1 39 LYS QE . . 4.210 3.491 2.078 3.927 . 0 0 "[ . 1 . 2 . 3]" 1
1054 1 39 LYS QB 1 40 SER QB . . 5.180 3.810 3.415 4.268 . 0 0 "[ . 1 . 2 . 3]" 1
1055 1 39 LYS HB2 1 40 SER H . . 3.890 3.329 2.703 3.901 0.011 25 0 "[ . 1 . 2 . 3]" 1
1056 1 39 LYS HB3 1 40 SER H . . 3.890 3.052 2.564 3.659 . 0 0 "[ . 1 . 2 . 3]" 1
1057 1 39 LYS QD 1 39 LYS QG . . 2.290 2.103 2.031 2.127 . 0 0 "[ . 1 . 2 . 3]" 1
1058 1 39 LYS QE 1 39 LYS QG . . 3.230 2.248 2.060 2.762 . 0 0 "[ . 1 . 2 . 3]" 1
1059 1 39 LYS QG 1 40 SER H . . 5.160 4.332 3.745 4.807 . 0 0 "[ . 1 . 2 . 3]" 1
1060 1 40 SER H 1 40 SER HB2 . . 3.630 2.715 2.521 3.642 0.012 8 0 "[ . 1 . 2 . 3]" 1
1061 1 40 SER H 1 40 SER HB3 . . 3.630 2.945 2.456 3.656 0.026 29 0 "[ . 1 . 2 . 3]" 1
1062 1 40 SER H 1 41 VAL H . . 3.340 2.500 2.383 2.624 . 0 0 "[ . 1 . 2 . 3]" 1
1063 1 40 SER H 1 41 VAL QG . . 4.360 3.841 3.673 4.035 . 0 0 "[ . 1 . 2 . 3]" 1
1064 1 40 SER HA 1 41 VAL QG . . 4.570 4.222 4.140 4.303 . 0 0 "[ . 1 . 2 . 3]" 1
1065 1 40 SER QB 1 41 VAL H . . 3.840 3.066 2.750 3.802 . 0 0 "[ . 1 . 2 . 3]" 1
1066 1 40 SER QB 1 41 VAL QG . . 3.520 2.587 2.425 3.298 . 0 0 "[ . 1 . 2 . 3]" 1
1067 1 40 SER HB2 1 41 VAL H . . 4.550 3.785 2.993 4.279 . 0 0 "[ . 1 . 2 . 3]" 1
1068 1 40 SER HB3 1 41 VAL H . . 4.550 3.557 2.800 4.345 . 0 0 "[ . 1 . 2 . 3]" 1
1069 1 41 VAL H 1 41 VAL HB . . 3.820 2.763 2.670 2.878 . 0 0 "[ . 1 . 2 . 3]" 1
1070 1 41 VAL H 1 41 VAL MG1 . . 4.230 3.936 3.902 3.988 . 0 0 "[ . 1 . 2 . 3]" 1
1071 1 41 VAL H 1 41 VAL QG . . 3.080 2.631 2.397 2.794 . 0 0 "[ . 1 . 2 . 3]" 1
1072 1 41 VAL H 1 41 VAL MG2 . . 4.230 2.673 2.417 2.857 . 0 0 "[ . 1 . 2 . 3]" 1
1073 1 41 VAL HA 1 41 VAL MG1 . . 3.390 2.339 2.281 2.369 . 0 0 "[ . 1 . 2 . 3]" 1
1074 1 41 VAL HA 1 41 VAL QG . . 2.830 2.123 2.105 2.143 . 0 0 "[ . 1 . 2 . 3]" 1
1075 1 41 VAL HA 1 41 VAL MG2 . . 3.390 2.436 2.387 2.568 . 0 0 "[ . 1 . 2 . 3]" 1
1076 1 41 VAL HA 1 42 PRO HD2 . . 3.400 2.409 2.179 2.720 . 0 0 "[ . 1 . 2 . 3]" 1
1077 1 41 VAL HA 1 42 PRO HD3 . . 3.400 2.421 2.133 2.638 . 0 0 "[ . 1 . 2 . 3]" 1
1078 1 41 VAL HA 1 42 PRO QG . . 4.170 3.975 3.931 4.016 . 0 0 "[ . 1 . 2 . 3]" 1
1079 1 41 VAL HB 1 43 TYR H . . 4.770 3.993 3.660 4.212 . 0 0 "[ . 1 . 2 . 3]" 1
1080 1 41 VAL HB 1 44 PHE H . . 4.540 2.739 2.357 2.967 . 0 0 "[ . 1 . 2 . 3]" 1
1081 1 41 VAL HB 1 44 PHE QB . . 4.440 2.435 2.195 2.960 . 0 0 "[ . 1 . 2 . 3]" 1
1082 1 41 VAL HB 1 44 PHE QD . . 4.150 2.294 2.061 2.625 . 0 0 "[ . 1 . 2 . 3]" 1
1083 1 41 VAL HB 1 45 LYS H . . 4.770 4.158 3.910 4.593 . 0 0 "[ . 1 . 2 . 3]" 1
1084 1 41 VAL QG 1 42 PRO HA . . 5.180 4.264 4.175 4.367 . 0 0 "[ . 1 . 2 . 3]" 1
1085 1 41 VAL QG 1 42 PRO QD . . 3.410 2.520 2.290 2.812 . 0 0 "[ . 1 . 2 . 3]" 1
1086 1 41 VAL QG 1 42 PRO QG . . 4.520 3.756 3.327 4.304 . 0 0 "[ . 1 . 2 . 3]" 1
1087 1 41 VAL QG 1 43 TYR H . . 3.850 1.935 1.850 2.081 . 0 0 "[ . 1 . 2 . 3]" 1
1088 1 41 VAL QG 1 43 TYR HA . . 5.440 4.003 3.951 4.106 . 0 0 "[ . 1 . 2 . 3]" 1
1089 1 41 VAL QG 1 43 TYR HB2 . . 3.990 2.921 2.827 2.978 . 0 0 "[ . 1 . 2 . 3]" 1
1090 1 41 VAL QG 1 43 TYR HB3 . . 3.690 2.101 1.995 2.233 . 0 0 "[ . 1 . 2 . 3]" 1
1091 1 41 VAL QG 1 43 TYR QD . . 4.380 3.536 3.341 3.753 . 0 0 "[ . 1 . 2 . 3]" 1
1092 1 41 VAL QG 1 43 TYR QE . . 5.440 5.225 5.033 5.415 . 0 0 "[ . 1 . 2 . 3]" 1
1093 1 41 VAL QG 1 44 PHE H . . 4.070 2.375 2.139 2.709 . 0 0 "[ . 1 . 2 . 3]" 1
1094 1 41 VAL QG 1 44 PHE HA . . 5.440 4.558 4.303 4.779 . 0 0 "[ . 1 . 2 . 3]" 1
1095 1 41 VAL QG 1 44 PHE QB . . 4.170 3.180 2.932 3.546 . 0 0 "[ . 1 . 2 . 3]" 1
1096 1 41 VAL QG 1 44 PHE QD . . 3.610 2.238 2.048 2.510 . 0 0 "[ . 1 . 2 . 3]" 1
1097 1 41 VAL QG 1 44 PHE QE . . 4.550 3.076 2.718 3.431 . 0 0 "[ . 1 . 2 . 3]" 1
1098 1 41 VAL QG 1 45 LYS H . . 4.750 4.045 3.859 4.278 . 0 0 "[ . 1 . 2 . 3]" 1
1099 1 41 VAL MG1 1 42 PRO HD2 . . 4.550 2.621 2.339 3.010 . 0 0 "[ . 1 . 2 . 3]" 1
1100 1 41 VAL MG1 1 42 PRO HD3 . . 4.550 3.686 3.399 3.867 . 0 0 "[ . 1 . 2 . 3]" 1
1101 1 41 VAL MG1 1 43 TYR HB2 . . 5.500 2.932 2.836 2.990 . 0 0 "[ . 1 . 2 . 3]" 1
1102 1 41 VAL MG1 1 43 TYR HB3 . . 4.900 2.105 1.997 2.238 . 0 0 "[ . 1 . 2 . 3]" 1
1103 1 41 VAL MG1 1 43 TYR QD . . 5.500 3.588 3.383 3.819 . 0 0 "[ . 1 . 2 . 3]" 1
1104 1 41 VAL MG1 1 44 PHE H . . 5.500 2.388 2.145 2.755 . 0 0 "[ . 1 . 2 . 3]" 1
1105 1 41 VAL MG1 1 44 PHE QD . . 4.290 2.382 2.085 2.822 . 0 0 "[ . 1 . 2 . 3]" 1
1106 1 41 VAL MG2 1 42 PRO HD2 . . 4.550 4.133 3.836 4.549 . 0 0 "[ . 1 . 2 . 3]" 1
1107 1 41 VAL MG2 1 42 PRO HD3 . . 4.550 4.464 4.224 4.670 0.120 29 0 "[ . 1 . 2 . 3]" 1
1108 1 41 VAL MG2 1 43 TYR HB2 . . 5.500 5.544 5.492 5.594 0.094 28 0 "[ . 1 . 2 . 3]" 1
1109 1 41 VAL MG2 1 43 TYR HB3 . . 4.900 4.557 4.353 4.630 . 0 0 "[ . 1 . 2 . 3]" 1
1110 1 41 VAL MG2 1 43 TYR QD . . 5.500 5.349 4.814 5.561 0.061 27 0 "[ . 1 . 2 . 3]" 1
1111 1 41 VAL MG2 1 44 PHE H . . 5.500 4.254 4.010 4.494 . 0 0 "[ . 1 . 2 . 3]" 1
1112 1 41 VAL MG2 1 44 PHE QD . . 4.290 2.850 2.523 3.273 . 0 0 "[ . 1 . 2 . 3]" 1
1113 1 42 PRO HA 1 45 LYS H . . 3.870 3.227 3.030 3.397 . 0 0 "[ . 1 . 2 . 3]" 1
1114 1 42 PRO HA 1 45 LYS HB2 . . 4.010 2.948 2.641 3.286 . 0 0 "[ . 1 . 2 . 3]" 1
1115 1 42 PRO HA 1 45 LYS QB . . 3.510 2.371 2.213 2.604 . 0 0 "[ . 1 . 2 . 3]" 1
1116 1 42 PRO HA 1 45 LYS HB3 . . 4.010 2.505 2.322 2.776 . 0 0 "[ . 1 . 2 . 3]" 1
1117 1 42 PRO HA 1 45 LYS QG . . 4.710 4.298 3.809 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
1118 1 43 TYR H 1 43 TYR HB2 . . 4.040 2.489 2.396 2.566 . 0 0 "[ . 1 . 2 . 3]" 1
1119 1 43 TYR H 1 43 TYR HB3 . . 4.170 2.541 2.437 2.631 . 0 0 "[ . 1 . 2 . 3]" 1
1120 1 43 TYR H 1 43 TYR QD . . 5.020 4.218 4.189 4.233 . 0 0 "[ . 1 . 2 . 3]" 1
1121 1 43 TYR HA 1 43 TYR QD . . 3.580 2.845 2.589 3.056 . 0 0 "[ . 1 . 2 . 3]" 1
1122 1 43 TYR HA 1 43 TYR QE . . 5.120 4.675 4.550 4.790 . 0 0 "[ . 1 . 2 . 3]" 1
1123 1 43 TYR HB2 1 44 PHE H . . 4.960 3.822 3.710 3.927 . 0 0 "[ . 1 . 2 . 3]" 1
1124 1 43 TYR HB3 1 44 PHE H . . 4.540 2.468 2.271 2.678 . 0 0 "[ . 1 . 2 . 3]" 1
1125 1 43 TYR QD 1 44 PHE H . . 4.970 3.343 3.040 3.690 . 0 0 "[ . 1 . 2 . 3]" 1
1126 1 43 TYR QD 1 44 PHE QE . . 4.790 3.403 2.989 4.121 . 0 0 "[ . 1 . 2 . 3]" 1
1127 1 43 TYR QE 1 44 PHE HA . . 5.500 4.469 4.095 4.908 . 0 0 "[ . 1 . 2 . 3]" 1
1128 1 43 TYR QE 1 44 PHE QE . . 5.450 3.681 2.628 4.572 . 0 0 "[ . 1 . 2 . 3]" 1
1129 1 43 TYR QE 1 44 PHE HZ . . 5.500 4.272 3.635 5.061 . 0 0 "[ . 1 . 2 . 3]" 1
1130 1 43 TYR QE 1 47 LYS QD . . 5.140 3.319 2.956 4.483 . 0 0 "[ . 1 . 2 . 3]" 1
1131 1 43 TYR QE 1 47 LYS QE . . 4.360 3.421 2.707 4.352 . 0 0 "[ . 1 . 2 . 3]" 1
1132 1 44 PHE H 1 44 PHE QB . . 3.510 2.240 2.117 2.409 . 0 0 "[ . 1 . 2 . 3]" 1
1133 1 44 PHE H 1 44 PHE QD . . 4.550 2.890 2.537 3.276 . 0 0 "[ . 1 . 2 . 3]" 1
1134 1 44 PHE H 1 45 LYS H . . 3.460 2.476 2.265 2.632 . 0 0 "[ . 1 . 2 . 3]" 1
1135 1 44 PHE HA 1 44 PHE QD . . 4.170 2.573 2.146 3.001 . 0 0 "[ . 1 . 2 . 3]" 1
1136 1 44 PHE HA 1 46 ASP QB . . 5.340 4.670 4.201 5.126 . 0 0 "[ . 1 . 2 . 3]" 1
1137 1 44 PHE HA 1 47 LYS H . . 4.700 2.978 2.788 3.204 . 0 0 "[ . 1 . 2 . 3]" 1
1138 1 44 PHE HA 1 47 LYS QB . . 4.170 2.377 2.189 2.593 . 0 0 "[ . 1 . 2 . 3]" 1
1139 1 44 PHE HA 1 47 LYS HD2 . . 5.050 4.635 4.031 5.082 0.032 13 0 "[ . 1 . 2 . 3]" 1
1140 1 44 PHE HA 1 47 LYS QD . . 4.210 3.899 3.252 4.230 0.020 16 0 "[ . 1 . 2 . 3]" 1
1141 1 44 PHE HA 1 47 LYS HD3 . . 5.050 4.248 3.385 4.991 . 0 0 "[ . 1 . 2 . 3]" 1
1142 1 44 PHE HA 1 47 LYS HG2 . . 5.390 4.014 2.383 4.719 . 0 0 "[ . 1 . 2 . 3]" 1
1143 1 44 PHE HA 1 47 LYS QG . . 4.650 3.830 2.359 4.436 . 0 0 "[ . 1 . 2 . 3]" 1
1144 1 44 PHE HA 1 47 LYS HG3 . . 5.390 4.956 3.469 5.415 0.025 17 0 "[ . 1 . 2 . 3]" 1
1145 1 44 PHE QB 1 45 LYS H . . 4.230 2.980 2.781 3.236 . 0 0 "[ . 1 . 2 . 3]" 1
1146 1 44 PHE QB 1 56 TRP HZ2 . . 4.570 2.415 1.981 3.301 . 0 0 "[ . 1 . 2 . 3]" 1
1147 1 44 PHE QD 1 47 LYS QB . . 4.490 3.387 2.806 4.174 . 0 0 "[ . 1 . 2 . 3]" 1
1148 1 44 PHE QE 1 56 TRP HB2 . . 5.500 4.647 2.303 5.582 0.082 23 0 "[ . 1 . 2 . 3]" 1
1149 1 44 PHE QE 1 56 TRP HB3 . . 5.500 4.744 2.490 5.562 0.062 29 0 "[ . 1 . 2 . 3]" 1
1150 1 45 LYS H 1 45 LYS HB2 . . 3.360 2.494 2.295 2.657 . 0 0 "[ . 1 . 2 . 3]" 1
1151 1 45 LYS H 1 45 LYS HB3 . . 3.360 2.530 2.334 2.600 . 0 0 "[ . 1 . 2 . 3]" 1
1152 1 45 LYS H 1 45 LYS QG . . 4.150 3.990 3.951 4.058 . 0 0 "[ . 1 . 2 . 3]" 1
1153 1 45 LYS H 1 46 ASP H . . 3.740 2.565 2.340 2.695 . 0 0 "[ . 1 . 2 . 3]" 1
1154 1 45 LYS HA 1 45 LYS QG . . 3.300 2.474 2.346 2.982 . 0 0 "[ . 1 . 2 . 3]" 1
1155 1 45 LYS HA 1 47 LYS H . . 4.960 4.178 3.661 4.343 . 0 0 "[ . 1 . 2 . 3]" 1
1156 1 45 LYS HA 1 56 TRP HZ2 . . 5.390 4.430 3.772 5.345 . 0 0 "[ . 1 . 2 . 3]" 1
1157 1 45 LYS QB 1 46 ASP H . . 3.570 2.451 2.347 2.597 . 0 0 "[ . 1 . 2 . 3]" 1
1158 1 45 LYS HB2 1 46 ASP H . . 4.210 3.766 3.689 3.885 . 0 0 "[ . 1 . 2 . 3]" 1
1159 1 45 LYS HB3 1 46 ASP H . . 4.210 2.484 2.372 2.639 . 0 0 "[ . 1 . 2 . 3]" 1
1160 1 45 LYS QG 1 46 ASP H . . 4.240 3.740 3.270 4.151 . 0 0 "[ . 1 . 2 . 3]" 1
1161 1 45 LYS QG 1 48 GLY H . . 5.500 4.814 4.337 5.447 . 0 0 "[ . 1 . 2 . 3]" 1
1162 1 46 ASP H 1 46 ASP HB2 . . 3.730 2.435 2.101 2.640 . 0 0 "[ . 1 . 2 . 3]" 1
1163 1 46 ASP H 1 46 ASP HB3 . . 3.730 2.610 2.389 3.593 . 0 0 "[ . 1 . 2 . 3]" 1
1164 1 46 ASP H 1 47 LYS H . . 3.470 2.608 2.539 2.700 . 0 0 "[ . 1 . 2 . 3]" 1
1165 1 46 ASP H 1 47 LYS QD . . 4.860 4.150 3.963 4.691 . 0 0 "[ . 1 . 2 . 3]" 1
1166 1 46 ASP H 1 48 GLY H . . 4.510 4.252 3.996 4.426 . 0 0 "[ . 1 . 2 . 3]" 1
1167 1 46 ASP QB 1 47 LYS H . . 3.920 2.742 2.573 3.439 . 0 0 "[ . 1 . 2 . 3]" 1
1168 1 46 ASP QB 1 47 LYS QD . . 5.180 2.470 2.240 3.275 . 0 0 "[ . 1 . 2 . 3]" 1
1169 1 46 ASP QB 1 47 LYS QG . . 4.360 4.254 3.796 4.431 0.071 28 0 "[ . 1 . 2 . 3]" 1
1170 1 46 ASP HB2 1 47 LYS H . . 4.530 3.871 3.536 4.063 . 0 0 "[ . 1 . 2 . 3]" 1
1171 1 46 ASP HB3 1 47 LYS H . . 4.530 2.875 2.615 4.315 . 0 0 "[ . 1 . 2 . 3]" 1
1172 1 47 LYS H 1 47 LYS HB2 . . 4.000 2.333 2.165 2.628 . 0 0 "[ . 1 . 2 . 3]" 1
1173 1 47 LYS H 1 47 LYS QB . . 3.370 2.303 2.144 2.582 . 0 0 "[ . 1 . 2 . 3]" 1
1174 1 47 LYS H 1 47 LYS HB3 . . 4.000 3.568 3.457 3.776 . 0 0 "[ . 1 . 2 . 3]" 1
1175 1 47 LYS H 1 47 LYS QD . . 3.890 2.733 2.482 3.478 . 0 0 "[ . 1 . 2 . 3]" 1
1176 1 47 LYS H 1 47 LYS QG . . 3.980 3.542 2.709 3.837 . 0 0 "[ . 1 . 2 . 3]" 1
1177 1 47 LYS H 1 48 GLY H . . 3.570 2.754 2.305 2.912 . 0 0 "[ . 1 . 2 . 3]" 1
1178 1 47 LYS H 1 48 GLY QA . . 5.340 4.255 3.909 4.470 . 0 0 "[ . 1 . 2 . 3]" 1
1179 1 47 LYS HA 1 47 LYS HD2 . . 4.420 2.700 2.194 3.153 . 0 0 "[ . 1 . 2 . 3]" 1
1180 1 47 LYS HA 1 47 LYS HD3 . . 4.420 3.933 2.765 4.269 . 0 0 "[ . 1 . 2 . 3]" 1
1181 1 47 LYS HA 1 47 LYS HG2 . . 4.040 3.597 3.480 3.733 . 0 0 "[ . 1 . 2 . 3]" 1
1182 1 47 LYS HA 1 47 LYS QG . . 3.450 2.531 2.194 3.280 . 0 0 "[ . 1 . 2 . 3]" 1
1183 1 47 LYS HA 1 47 LYS HG3 . . 4.040 2.656 2.216 3.742 . 0 0 "[ . 1 . 2 . 3]" 1
1184 1 47 LYS HA 1 49 ASP H . . 4.200 3.122 2.892 3.390 . 0 0 "[ . 1 . 2 . 3]" 1
1185 1 47 LYS QB 1 47 LYS QD . . 3.290 2.561 2.308 3.046 . 0 0 "[ . 1 . 2 . 3]" 1
1186 1 47 LYS QB 1 48 GLY H . . 4.140 3.727 3.588 3.814 . 0 0 "[ . 1 . 2 . 3]" 1
1187 1 47 LYS QB 1 52 SER QB . . 4.140 3.121 2.303 3.780 . 0 0 "[ . 1 . 2 . 3]" 1
1188 1 47 LYS QB 1 56 TRP HD1 . . 4.410 2.617 1.953 3.904 . 0 0 "[ . 1 . 2 . 3]" 1
1189 1 47 LYS HB2 1 48 GLY H . . 4.720 4.056 3.794 4.211 . 0 0 "[ . 1 . 2 . 3]" 1
1190 1 47 LYS HB3 1 48 GLY H . . 4.720 4.357 4.206 4.450 . 0 0 "[ . 1 . 2 . 3]" 1
1191 1 47 LYS QD 1 48 GLY H . . 5.340 4.559 4.248 4.709 . 0 0 "[ . 1 . 2 . 3]" 1
1192 1 47 LYS QE 1 47 LYS QG . . 3.190 2.266 2.110 2.501 . 0 0 "[ . 1 . 2 . 3]" 1
1193 1 47 LYS QG 1 48 GLY H . . 4.900 4.902 4.827 4.982 0.082 13 0 "[ . 1 . 2 . 3]" 1
1194 1 48 GLY H 1 49 ASP H . . 3.880 2.806 2.489 3.208 . 0 0 "[ . 1 . 2 . 3]" 1
1195 1 48 GLY QA 1 56 TRP HZ2 . . 4.690 3.909 2.821 4.570 . 0 0 "[ . 1 . 2 . 3]" 1
1196 1 48 GLY HA2 1 56 TRP HZ2 . . 5.390 4.118 2.858 4.937 . 0 0 "[ . 1 . 2 . 3]" 1
1197 1 48 GLY HA3 1 56 TRP HZ2 . . 5.390 4.982 4.221 5.398 0.008 3 0 "[ . 1 . 2 . 3]" 1
1198 1 49 ASP H 1 49 ASP HB2 . . 3.840 2.801 2.028 3.148 . 0 0 "[ . 1 . 2 . 3]" 1
1199 1 49 ASP H 1 49 ASP QB . . 3.080 2.116 2.002 2.394 . 0 0 "[ . 1 . 2 . 3]" 1
1200 1 49 ASP H 1 49 ASP HB3 . . 3.840 2.303 2.065 3.605 . 0 0 "[ . 1 . 2 . 3]" 1
1201 1 49 ASP H 1 52 SER QB . . 3.360 2.950 2.484 3.308 . 0 0 "[ . 1 . 2 . 3]" 1
1202 1 49 ASP QB 1 52 SER H . . 4.340 3.060 2.219 3.520 . 0 0 "[ . 1 . 2 . 3]" 1
1203 1 49 ASP HB2 1 50 SER H . . 5.060 3.780 3.598 4.255 . 0 0 "[ . 1 . 2 . 3]" 1
1204 1 49 ASP HB2 1 52 SER QB . . 4.690 3.937 2.337 4.651 . 0 0 "[ . 1 . 2 . 3]" 1
1205 1 49 ASP HB3 1 50 SER H . . 5.060 4.026 2.727 4.337 . 0 0 "[ . 1 . 2 . 3]" 1
1206 1 49 ASP HB3 1 52 SER QB . . 4.690 2.576 2.212 3.783 . 0 0 "[ . 1 . 2 . 3]" 1
1207 1 50 SER QB 1 51 ASN H . . 4.000 2.862 2.362 3.523 . 0 0 "[ . 1 . 2 . 3]" 1
1208 1 51 ASN H 1 51 ASN QB . . 3.490 2.314 2.222 2.526 . 0 0 "[ . 1 . 2 . 3]" 1
1209 1 51 ASN H 1 52 SER H . . 4.560 2.511 2.355 2.663 . 0 0 "[ . 1 . 2 . 3]" 1
1210 1 51 ASN HA 1 54 ALA MB . . 4.400 3.697 2.960 4.046 . 0 0 "[ . 1 . 2 . 3]" 1
1211 1 51 ASN QB 1 52 SER H . . 4.620 2.646 2.285 3.561 . 0 0 "[ . 1 . 2 . 3]" 1
1212 1 51 ASN QB 1 54 ALA MB . . 4.880 4.712 4.192 4.997 0.117 29 0 "[ . 1 . 2 . 3]" 1
1213 1 51 ASN QD 1 54 ALA MB . . 4.980 4.827 4.535 5.082 0.102 1 0 "[ . 1 . 2 . 3]" 1
1214 1 52 SER H 1 52 SER QB . . 3.780 2.364 2.201 2.490 . 0 0 "[ . 1 . 2 . 3]" 1
1215 1 52 SER QB 1 53 SER H . . 4.450 2.817 2.598 3.090 . 0 0 "[ . 1 . 2 . 3]" 1
1216 1 53 SER H 1 54 ALA H . . 4.360 2.796 2.689 2.879 . 0 0 "[ . 1 . 2 . 3]" 1
1217 1 53 SER H 1 54 ALA MB . . 4.910 4.457 4.377 4.538 . 0 0 "[ . 1 . 2 . 3]" 1
1218 1 53 SER HA 1 54 ALA MB . . 5.250 5.008 4.962 5.041 . 0 0 "[ . 1 . 2 . 3]" 1
1219 1 53 SER HA 1 56 TRP H . . 4.780 3.369 3.200 3.843 . 0 0 "[ . 1 . 2 . 3]" 1
1220 1 53 SER HA 1 56 TRP HD1 . . 4.560 3.123 2.542 3.887 . 0 0 "[ . 1 . 2 . 3]" 1
1221 1 53 SER QB 1 54 ALA HA . . 5.080 4.135 3.705 4.646 . 0 0 "[ . 1 . 2 . 3]" 1
1222 1 53 SER HB2 1 54 ALA MB . . 5.500 4.898 4.135 5.500 . 0 0 "[ . 1 . 2 . 3]" 1
1223 1 53 SER HB3 1 54 ALA MB . . 5.500 4.850 4.054 5.501 0.001 9 0 "[ . 1 . 2 . 3]" 1
1224 1 54 ALA H 1 54 ALA MB . . 3.200 2.227 2.209 2.246 . 0 0 "[ . 1 . 2 . 3]" 1
1225 1 54 ALA H 1 55 GLY H . . 4.100 2.825 2.671 2.939 . 0 0 "[ . 1 . 2 . 3]" 1
1226 1 54 ALA HA 1 55 GLY QA . . 5.340 4.431 4.398 4.487 . 0 0 "[ . 1 . 2 . 3]" 1
1227 1 54 ALA MB 1 55 GLY H . . 3.700 2.503 2.413 2.753 . 0 0 "[ . 1 . 2 . 3]" 1
1228 1 54 ALA MB 1 55 GLY QA . . 3.780 3.546 3.500 3.646 . 0 0 "[ . 1 . 2 . 3]" 1
1229 1 54 ALA MB 1 56 TRP H . . 5.210 4.468 4.240 4.980 . 0 0 "[ . 1 . 2 . 3]" 1
1230 1 54 ALA MB 1 58 ASN H . . 5.180 5.004 4.502 5.211 0.031 5 0 "[ . 1 . 2 . 3]" 1
1231 1 54 ALA MB 1 58 ASN HB2 . . 5.500 4.618 4.270 4.878 . 0 0 "[ . 1 . 2 . 3]" 1
1232 1 54 ALA MB 1 58 ASN QB . . 4.810 4.347 4.091 4.528 . 0 0 "[ . 1 . 2 . 3]" 1
1233 1 54 ALA MB 1 58 ASN HB3 . . 5.500 5.316 5.106 5.524 0.024 21 0 "[ . 1 . 2 . 3]" 1
1234 1 55 GLY H 1 56 TRP H . . 3.760 2.506 2.300 2.979 . 0 0 "[ . 1 . 2 . 3]" 1
1235 1 55 GLY QA 1 58 ASN QB . . 3.520 2.685 2.272 3.203 . 0 0 "[ . 1 . 2 . 3]" 1
1236 1 55 GLY QA 1 59 SER H . . 5.170 3.794 3.479 4.420 . 0 0 "[ . 1 . 2 . 3]" 1
1237 1 56 TRP H 1 56 TRP QB . . 3.570 2.079 1.797 2.674 . 0 0 "[ . 1 . 2 . 3]" 1
1238 1 56 TRP H 1 56 TRP HD1 . . 4.240 3.563 2.522 4.262 0.022 10 0 "[ . 1 . 2 . 3]" 1
1239 1 56 TRP HA 1 56 TRP HD1 . . 4.650 4.047 3.755 4.527 . 0 0 "[ . 1 . 2 . 3]" 1
1240 1 56 TRP HH2 1 60 ILE MD . . 4.220 4.086 3.688 4.386 0.166 23 0 "[ . 1 . 2 . 3]" 1
1241 1 56 TRP HZ3 1 60 ILE MD . . 4.350 2.290 2.151 2.470 . 0 0 "[ . 1 . 2 . 3]" 1
1242 1 57 LYS HA 1 60 ILE H . . 4.440 3.632 3.234 4.060 . 0 0 "[ . 1 . 2 . 3]" 1
1243 1 57 LYS HA 1 60 ILE HB . . 4.290 3.111 2.800 3.488 . 0 0 "[ . 1 . 2 . 3]" 1
1244 1 57 LYS HA 1 60 ILE MD . . 4.510 2.803 2.204 3.469 . 0 0 "[ . 1 . 2 . 3]" 1
1245 1 57 LYS HA 1 60 ILE MG . . 4.840 4.405 4.196 4.640 . 0 0 "[ . 1 . 2 . 3]" 1
1246 1 57 LYS HA 1 61 ARG H . . 5.310 4.187 3.842 4.555 . 0 0 "[ . 1 . 2 . 3]" 1
1247 1 57 LYS QB 1 58 ASN H . . 4.600 3.395 2.613 3.645 . 0 0 "[ . 1 . 2 . 3]" 1
1248 1 57 LYS QB 1 60 ILE MD . . 4.730 4.223 3.396 4.806 0.076 2 0 "[ . 1 . 2 . 3]" 1
1249 1 57 LYS QB 1 60 ILE MG . . 5.490 5.183 4.808 5.510 0.020 25 0 "[ . 1 . 2 . 3]" 1
1250 1 58 ASN H 1 58 ASN HB2 . . 3.480 2.438 2.221 2.525 . 0 0 "[ . 1 . 2 . 3]" 1
1251 1 58 ASN H 1 58 ASN HB3 . . 3.480 2.672 2.495 3.498 0.018 21 0 "[ . 1 . 2 . 3]" 1
1252 1 58 ASN H 1 59 SER H . . 3.610 2.692 2.526 2.831 . 0 0 "[ . 1 . 2 . 3]" 1
1253 1 58 ASN HA 1 61 ARG H . . 4.030 3.444 3.028 3.685 . 0 0 "[ . 1 . 2 . 3]" 1
1254 1 58 ASN HA 1 61 ARG QB . . 3.450 2.608 2.245 2.784 . 0 0 "[ . 1 . 2 . 3]" 1
1255 1 58 ASN HA 1 61 ARG QD . . 4.130 3.341 2.093 4.119 . 0 0 "[ . 1 . 2 . 3]" 1
1256 1 58 ASN QB 1 59 SER H . . 3.390 2.597 2.371 2.866 . 0 0 "[ . 1 . 2 . 3]" 1
1257 1 58 ASN QB 1 61 ARG QB . . 4.500 4.433 4.009 4.582 0.082 23 0 "[ . 1 . 2 . 3]" 1
1258 1 58 ASN HB2 1 59 SER H . . 4.110 3.817 2.911 3.969 . 0 0 "[ . 1 . 2 . 3]" 1
1259 1 58 ASN HB2 1 61 ARG QB . . 5.380 4.882 4.501 5.114 . 0 0 "[ . 1 . 2 . 3]" 1
1260 1 58 ASN HB3 1 59 SER H . . 4.110 2.665 2.398 3.557 . 0 0 "[ . 1 . 2 . 3]" 1
1261 1 58 ASN HB3 1 61 ARG QB . . 5.380 5.103 4.196 5.318 . 0 0 "[ . 1 . 2 . 3]" 1
1262 1 59 SER H 1 60 ILE H . . 3.740 2.739 2.663 2.850 . 0 0 "[ . 1 . 2 . 3]" 1
1263 1 59 SER H 1 62 HIS QB . . 5.130 4.830 4.673 5.092 . 0 0 "[ . 1 . 2 . 3]" 1
1264 1 60 ILE H 1 60 ILE HB . . 3.860 2.430 2.374 2.484 . 0 0 "[ . 1 . 2 . 3]" 1
1265 1 60 ILE H 1 60 ILE MD . . 5.000 3.436 3.320 3.536 . 0 0 "[ . 1 . 2 . 3]" 1
1266 1 60 ILE H 1 60 ILE MG . . 3.830 3.795 3.765 3.821 . 0 0 "[ . 1 . 2 . 3]" 1
1267 1 60 ILE H 1 61 ARG H . . 4.010 2.614 2.573 2.660 . 0 0 "[ . 1 . 2 . 3]" 1
1268 1 60 ILE H 1 61 ARG QB . . 4.500 4.382 4.268 4.513 0.013 18 0 "[ . 1 . 2 . 3]" 1
1269 1 60 ILE H 1 62 HIS QB . . 4.990 4.881 4.771 4.998 0.008 8 0 "[ . 1 . 2 . 3]" 1
1270 1 60 ILE HA 1 60 ILE MD . . 3.830 3.849 3.833 3.868 0.038 28 0 "[ . 1 . 2 . 3]" 1
1271 1 60 ILE HA 1 60 ILE MG . . 3.260 2.521 2.468 2.554 . 0 0 "[ . 1 . 2 . 3]" 1
1272 1 60 ILE HA 1 63 ASN H . . 4.610 3.473 3.323 3.696 . 0 0 "[ . 1 . 2 . 3]" 1
1273 1 60 ILE HA 1 63 ASN QB . . 3.900 2.750 2.478 3.548 . 0 0 "[ . 1 . 2 . 3]" 1
1274 1 60 ILE MD 1 60 ILE MG . . 3.300 2.134 2.084 2.179 . 0 0 "[ . 1 . 2 . 3]" 1
1275 1 60 ILE MG 1 61 ARG H . . 3.670 3.290 3.156 3.406 . 0 0 "[ . 1 . 2 . 3]" 1
1276 1 60 ILE MG 1 61 ARG HA . . 4.030 3.275 3.146 3.440 . 0 0 "[ . 1 . 2 . 3]" 1
1277 1 60 ILE MG 1 61 ARG QD . . 5.400 5.325 4.617 5.509 0.109 3 0 "[ . 1 . 2 . 3]" 1
1278 1 60 ILE MG 1 61 ARG QG . . 5.500 4.359 3.287 4.879 . 0 0 "[ . 1 . 2 . 3]" 1
1279 1 60 ILE MG 1 62 HIS H . . 4.990 4.955 4.877 5.010 0.020 29 0 "[ . 1 . 2 . 3]" 1
1280 1 60 ILE MG 1 63 ASN QB . . 4.650 3.821 3.595 4.191 . 0 0 "[ . 1 . 2 . 3]" 1
1281 1 60 ILE MG 1 64 LEU HA . . 5.500 5.190 4.875 5.496 . 0 0 "[ . 1 . 2 . 3]" 1
1282 1 60 ILE MG 1 64 LEU MD1 . . 3.470 2.301 2.173 2.571 . 0 0 "[ . 1 . 2 . 3]" 1
1283 1 60 ILE MG 1 64 LEU HG . . 3.930 2.747 2.565 2.959 . 0 0 "[ . 1 . 2 . 3]" 1
1284 1 61 ARG H 1 61 ARG QB . . 3.210 2.219 2.133 2.321 . 0 0 "[ . 1 . 2 . 3]" 1
1285 1 61 ARG H 1 61 ARG QD . . 4.400 4.035 3.359 4.332 . 0 0 "[ . 1 . 2 . 3]" 1
1286 1 61 ARG H 1 61 ARG QG . . 4.170 3.516 2.427 3.990 . 0 0 "[ . 1 . 2 . 3]" 1
1287 1 61 ARG H 1 62 HIS H . . 4.240 2.718 2.673 2.769 . 0 0 "[ . 1 . 2 . 3]" 1
1288 1 61 ARG H 1 62 HIS QB . . 4.680 4.458 4.400 4.618 . 0 0 "[ . 1 . 2 . 3]" 1
1289 1 61 ARG H 1 64 LEU QB . . 5.310 5.005 4.846 5.284 . 0 0 "[ . 1 . 2 . 3]" 1
1290 1 61 ARG H 1 64 LEU HG . . 5.260 5.235 5.122 5.269 0.009 28 0 "[ . 1 . 2 . 3]" 1
1291 1 61 ARG HA 1 61 ARG QD . . 3.940 3.902 3.634 4.075 0.135 29 0 "[ . 1 . 2 . 3]" 1
1292 1 61 ARG HA 1 61 ARG QG . . 3.800 2.325 2.206 2.433 . 0 0 "[ . 1 . 2 . 3]" 1
1293 1 61 ARG HA 1 64 LEU QB . . 4.220 2.567 2.393 2.995 . 0 0 "[ . 1 . 2 . 3]" 1
1294 1 61 ARG HA 1 64 LEU MD1 . . 3.910 2.316 2.116 2.526 . 0 0 "[ . 1 . 2 . 3]" 1
1295 1 61 ARG HA 1 64 LEU MD2 . . 4.800 4.771 4.555 4.878 0.078 11 0 "[ . 1 . 2 . 3]" 1
1296 1 61 ARG HA 1 64 LEU HG . . 4.530 3.675 3.351 3.831 . 0 0 "[ . 1 . 2 . 3]" 1
1297 1 61 ARG QB 1 61 ARG QD . . 3.150 2.110 2.010 2.407 . 0 0 "[ . 1 . 2 . 3]" 1
1298 1 61 ARG QB 1 62 HIS H . . 3.870 2.664 2.551 2.853 . 0 0 "[ . 1 . 2 . 3]" 1
1299 1 61 ARG QB 1 62 HIS QB . . 4.640 4.052 3.767 4.457 . 0 0 "[ . 1 . 2 . 3]" 1
1300 1 61 ARG QB 1 64 LEU QB . . 5.500 4.395 4.073 4.578 . 0 0 "[ . 1 . 2 . 3]" 1
1301 1 62 HIS H 1 62 HIS QB . . 3.320 2.228 2.154 2.269 . 0 0 "[ . 1 . 2 . 3]" 1
1302 1 62 HIS H 1 63 ASN H . . 4.240 2.743 2.658 2.867 . 0 0 "[ . 1 . 2 . 3]" 1
1303 1 62 HIS QB 1 63 ASN H . . 3.520 2.462 2.334 2.599 . 0 0 "[ . 1 . 2 . 3]" 1
1304 1 62 HIS QB 1 63 ASN QB . . 4.780 4.231 4.121 4.553 . 0 0 "[ . 1 . 2 . 3]" 1
1305 1 62 HIS QB 1 63 ASN QD . . 4.290 3.124 2.769 4.307 0.017 23 0 "[ . 1 . 2 . 3]" 1
1306 1 62 HIS HD2 1 66 LEU MD1 . . 4.540 3.326 2.015 4.285 . 0 0 "[ . 1 . 2 . 3]" 1
1307 1 62 HIS HD2 1 66 LEU MD2 . . 4.540 3.706 2.900 4.548 0.008 8 0 "[ . 1 . 2 . 3]" 1
1308 1 63 ASN H 1 63 ASN HB2 . . 4.190 2.245 2.167 2.535 . 0 0 "[ . 1 . 2 . 3]" 1
1309 1 63 ASN H 1 63 ASN QB . . 3.470 2.221 2.148 2.490 . 0 0 "[ . 1 . 2 . 3]" 1
1310 1 63 ASN H 1 63 ASN HB3 . . 4.190 3.543 3.493 3.637 . 0 0 "[ . 1 . 2 . 3]" 1
1311 1 63 ASN H 1 63 ASN QD . . 3.790 2.411 2.173 3.791 0.001 23 0 "[ . 1 . 2 . 3]" 1
1312 1 63 ASN HA 1 66 LEU QD . . 3.150 2.463 2.252 2.873 . 0 0 "[ . 1 . 2 . 3]" 1
1313 1 63 ASN HA 1 66 LEU HG . . 4.170 2.843 2.318 4.091 . 0 0 "[ . 1 . 2 . 3]" 1
1314 1 63 ASN QB 1 70 PHE QD . . 5.340 4.056 3.540 4.767 . 0 0 "[ . 1 . 2 . 3]" 1
1315 1 64 LEU HA 1 64 LEU MD2 . . 3.690 2.191 2.161 2.229 . 0 0 "[ . 1 . 2 . 3]" 1
1316 1 64 LEU HA 1 70 PHE QB . . 4.400 2.789 2.556 3.353 . 0 0 "[ . 1 . 2 . 3]" 1
1317 1 64 LEU HA 1 70 PHE QD . . 3.550 2.448 2.041 2.860 . 0 0 "[ . 1 . 2 . 3]" 1
1318 1 64 LEU QB 1 84 TRP HE3 . . 4.840 3.134 2.685 3.552 . 0 0 "[ . 1 . 2 . 3]" 1
1319 1 64 LEU QB 1 84 TRP HZ3 . . 4.510 2.897 2.567 3.167 . 0 0 "[ . 1 . 2 . 3]" 1
1320 1 64 LEU MD1 1 84 TRP HE1 . . 5.160 3.970 3.589 4.562 . 0 0 "[ . 1 . 2 . 3]" 1
1321 1 64 LEU MD2 1 70 PHE QB . . 4.280 2.366 2.257 2.590 . 0 0 "[ . 1 . 2 . 3]" 1
1322 1 64 LEU MD2 1 70 PHE QD . . 4.290 2.913 2.833 3.007 . 0 0 "[ . 1 . 2 . 3]" 1
1323 1 64 LEU MD2 1 84 TRP HE3 . . 4.470 2.417 2.285 2.550 . 0 0 "[ . 1 . 2 . 3]" 1
1324 1 64 LEU HG 1 70 PHE QD . . 5.500 4.664 4.494 4.855 . 0 0 "[ . 1 . 2 . 3]" 1
1325 1 65 SER H 1 66 LEU H . . 3.930 2.624 2.261 2.771 . 0 0 "[ . 1 . 2 . 3]" 1
1326 1 65 SER QB 1 66 LEU H . . 4.120 3.115 2.631 3.788 . 0 0 "[ . 1 . 2 . 3]" 1
1327 1 65 SER QB 1 66 LEU QD . . 4.310 3.844 3.620 4.438 0.128 24 0 "[ . 1 . 2 . 3]" 1
1328 1 66 LEU H 1 66 LEU HB2 . . 3.910 2.484 2.330 2.536 . 0 0 "[ . 1 . 2 . 3]" 1
1329 1 66 LEU H 1 66 LEU HB3 . . 3.910 3.619 3.575 3.643 . 0 0 "[ . 1 . 2 . 3]" 1
1330 1 66 LEU H 1 66 LEU MD1 . . 4.110 3.615 3.532 3.794 . 0 0 "[ . 1 . 2 . 3]" 1
1331 1 66 LEU H 1 66 LEU QD . . 3.610 3.152 3.079 3.361 . 0 0 "[ . 1 . 2 . 3]" 1
1332 1 66 LEU H 1 66 LEU MD2 . . 4.110 3.480 3.318 3.774 . 0 0 "[ . 1 . 2 . 3]" 1
1333 1 66 LEU H 1 66 LEU HG . . 3.780 2.370 2.233 2.750 . 0 0 "[ . 1 . 2 . 3]" 1
1334 1 66 LEU HA 1 66 LEU QD . . 2.940 2.185 2.120 2.213 . 0 0 "[ . 1 . 2 . 3]" 1
1335 1 69 LYS H 1 69 LYS QG . . 4.080 3.745 2.372 4.124 0.044 13 0 "[ . 1 . 2 . 3]" 1
1336 1 69 LYS HA 1 71 ILE MG . . 4.710 4.428 3.758 4.794 0.084 29 0 "[ . 1 . 2 . 3]" 1
1337 1 69 LYS HA 1 87 ASN HB2 . . 4.330 3.497 3.046 3.997 . 0 0 "[ . 1 . 2 . 3]" 1
1338 1 69 LYS HA 1 87 ASN HB3 . . 4.330 3.473 2.725 4.034 . 0 0 "[ . 1 . 2 . 3]" 1
1339 1 69 LYS QB 1 69 LYS QD . . 3.300 2.486 2.071 2.974 . 0 0 "[ . 1 . 2 . 3]" 1
1340 1 69 LYS QB 1 69 LYS QE . . 4.320 2.879 1.917 3.900 . 0 0 "[ . 1 . 2 . 3]" 1
1341 1 69 LYS QB 1 70 PHE QD . . 4.770 3.935 3.510 4.808 0.038 11 0 "[ . 1 . 2 . 3]" 1
1342 1 69 LYS QB 1 87 ASN QB . . 5.180 4.505 3.556 5.043 . 0 0 "[ . 1 . 2 . 3]" 1
1343 1 69 LYS HB2 1 70 PHE QD . . 5.500 4.928 3.984 5.527 0.027 8 0 "[ . 1 . 2 . 3]" 1
1344 1 69 LYS HB3 1 70 PHE QD . . 5.500 4.206 3.608 5.512 0.012 27 0 "[ . 1 . 2 . 3]" 1
1345 1 69 LYS QE 1 71 ILE MG . . 5.040 5.030 4.463 5.391 0.351 27 0 "[ . 1 . 2 . 3]" 1
1346 1 69 LYS QE 1 86 LEU QB . . 4.050 2.402 1.878 3.578 . 0 0 "[ . 1 . 2 . 3]" 1
1347 1 69 LYS QE 1 86 LEU MD2 . . 4.210 2.781 1.960 4.229 0.019 22 0 "[ . 1 . 2 . 3]" 1
1348 1 69 LYS HE2 1 86 LEU MD1 . . 5.220 3.450 2.558 5.231 0.011 16 0 "[ . 1 . 2 . 3]" 1
1349 1 69 LYS HE3 1 86 LEU MD1 . . 5.220 4.142 3.060 5.231 0.011 4 0 "[ . 1 . 2 . 3]" 1
1350 1 70 PHE H 1 70 PHE QD . . 4.370 3.065 2.774 3.381 . 0 0 "[ . 1 . 2 . 3]" 1
1351 1 70 PHE HA 1 70 PHE QD . . 3.760 2.487 2.193 2.644 . 0 0 "[ . 1 . 2 . 3]" 1
1352 1 70 PHE HA 1 71 ILE QG . . 4.710 4.026 3.921 4.164 . 0 0 "[ . 1 . 2 . 3]" 1
1353 1 70 PHE HA 1 71 ILE MG . . 4.290 3.516 3.205 3.613 . 0 0 "[ . 1 . 2 . 3]" 1
1354 1 70 PHE HA 1 86 LEU HA . . 4.500 2.635 2.465 2.847 . 0 0 "[ . 1 . 2 . 3]" 1
1355 1 70 PHE HA 1 86 LEU MD2 . . 4.040 3.342 3.136 3.649 . 0 0 "[ . 1 . 2 . 3]" 1
1356 1 70 PHE QB 1 71 ILE H . . 4.330 2.985 2.816 3.131 . 0 0 "[ . 1 . 2 . 3]" 1
1357 1 70 PHE QB 1 84 TRP HE3 . . 4.120 3.208 2.937 3.571 . 0 0 "[ . 1 . 2 . 3]" 1
1358 1 70 PHE QD 1 71 ILE H . . 4.530 3.971 3.770 4.139 . 0 0 "[ . 1 . 2 . 3]" 1
1359 1 70 PHE QD 1 71 ILE MG . . 5.380 5.314 5.038 5.401 0.021 13 0 "[ . 1 . 2 . 3]" 1
1360 1 70 PHE QD 1 86 LEU HA . . 4.290 3.351 3.096 3.653 . 0 0 "[ . 1 . 2 . 3]" 1
1361 1 70 PHE QD 1 86 LEU QB . . 5.340 4.785 4.636 4.992 . 0 0 "[ . 1 . 2 . 3]" 1
1362 1 70 PHE QD 1 86 LEU MD1 . . 5.060 5.047 4.951 5.109 0.049 27 0 "[ . 1 . 2 . 3]" 1
1363 1 70 PHE QD 1 86 LEU MD2 . . 3.160 2.295 2.182 2.379 . 0 0 "[ . 1 . 2 . 3]" 1
1364 1 70 PHE QE 1 86 LEU MD1 . . 4.750 4.628 4.435 4.708 . 0 0 "[ . 1 . 2 . 3]" 1
1365 1 70 PHE QE 1 86 LEU MD2 . . 3.060 2.463 2.266 2.571 . 0 0 "[ . 1 . 2 . 3]" 1
1366 1 70 PHE HZ 1 86 LEU MD2 . . 4.280 4.250 4.074 4.296 0.016 14 0 "[ . 1 . 2 . 3]" 1
1367 1 71 ILE H 1 71 ILE HB . . 4.080 3.892 3.867 3.911 . 0 0 "[ . 1 . 2 . 3]" 1
1368 1 71 ILE H 1 71 ILE MD . . 4.390 4.092 4.040 4.157 . 0 0 "[ . 1 . 2 . 3]" 1
1369 1 71 ILE H 1 71 ILE HG12 . . 4.340 2.479 2.401 2.599 . 0 0 "[ . 1 . 2 . 3]" 1
1370 1 71 ILE H 1 71 ILE QG . . 3.750 2.394 2.333 2.513 . 0 0 "[ . 1 . 2 . 3]" 1
1371 1 71 ILE H 1 71 ILE HG13 . . 4.340 3.164 3.010 3.331 . 0 0 "[ . 1 . 2 . 3]" 1
1372 1 71 ILE H 1 71 ILE MG . . 3.410 2.761 2.558 2.849 . 0 0 "[ . 1 . 2 . 3]" 1
1373 1 71 ILE H 1 84 TRP HE3 . . 5.390 4.519 4.261 4.952 . 0 0 "[ . 1 . 2 . 3]" 1
1374 1 71 ILE HA 1 71 ILE QG . . 3.680 3.338 3.318 3.351 . 0 0 "[ . 1 . 2 . 3]" 1
1375 1 71 ILE HA 1 71 ILE MG . . 3.430 2.458 2.411 2.529 . 0 0 "[ . 1 . 2 . 3]" 1
1376 1 71 ILE HB 1 71 ILE MD . . 3.100 2.382 2.361 2.404 . 0 0 "[ . 1 . 2 . 3]" 1
1377 1 71 ILE HB 1 72 ARG H . . 3.760 2.564 2.458 2.704 . 0 0 "[ . 1 . 2 . 3]" 1
1378 1 71 ILE HB 1 85 MET HG2 . . 5.500 5.048 4.902 5.256 . 0 0 "[ . 1 . 2 . 3]" 1
1379 1 71 ILE HB 1 85 MET HG3 . . 5.040 4.830 4.667 4.964 . 0 0 "[ . 1 . 2 . 3]" 1
1380 1 71 ILE HB 1 87 ASN QB . . 4.910 4.936 4.890 4.970 0.060 29 0 "[ . 1 . 2 . 3]" 1
1381 1 71 ILE MD 1 72 ARG H . . 4.240 4.063 3.925 4.196 . 0 0 "[ . 1 . 2 . 3]" 1
1382 1 71 ILE MD 1 85 MET H . . 4.890 4.672 4.515 4.885 . 0 0 "[ . 1 . 2 . 3]" 1
1383 1 71 ILE MD 1 85 MET HB2 . . 4.550 4.504 4.386 4.582 0.032 29 0 "[ . 1 . 2 . 3]" 1
1384 1 71 ILE MD 1 85 MET ME . . 2.950 2.669 2.390 2.950 . 0 0 "[ . 1 . 2 . 3]" 1
1385 1 71 ILE MD 1 85 MET HG3 . . 3.540 2.512 2.449 2.667 . 0 0 "[ . 1 . 2 . 3]" 1
1386 1 71 ILE MD 1 87 ASN HA . . 3.400 2.386 2.266 2.521 . 0 0 "[ . 1 . 2 . 3]" 1
1387 1 71 ILE MD 1 87 ASN QB . . 3.980 3.902 3.735 4.035 0.055 29 0 "[ . 1 . 2 . 3]" 1
1388 1 71 ILE MD 1 87 ASN QD . . 4.720 4.235 3.680 4.664 . 0 0 "[ . 1 . 2 . 3]" 1
1389 1 71 ILE MD 1 88 PRO HD2 . . 3.430 2.602 2.206 3.040 . 0 0 "[ . 1 . 2 . 3]" 1
1390 1 71 ILE MD 1 88 PRO HD3 . . 3.520 2.361 2.025 2.560 . 0 0 "[ . 1 . 2 . 3]" 1
1391 1 71 ILE MD 1 88 PRO QG . . 4.180 3.457 3.036 3.796 . 0 0 "[ . 1 . 2 . 3]" 1
1392 1 71 ILE MD 1 89 GLU H . . 5.500 5.041 4.752 5.347 . 0 0 "[ . 1 . 2 . 3]" 1
1393 1 71 ILE QG 1 71 ILE MG . . 2.850 2.236 2.204 2.258 . 0 0 "[ . 1 . 2 . 3]" 1
1394 1 71 ILE QG 1 72 ARG H . . 4.000 3.307 3.196 3.393 . 0 0 "[ . 1 . 2 . 3]" 1
1395 1 71 ILE QG 1 85 MET H . . 4.600 3.126 2.972 3.321 . 0 0 "[ . 1 . 2 . 3]" 1
1396 1 71 ILE QG 1 85 MET ME . . 3.930 3.429 3.171 3.632 . 0 0 "[ . 1 . 2 . 3]" 1
1397 1 71 ILE QG 1 85 MET HG2 . . 4.660 2.435 2.327 2.652 . 0 0 "[ . 1 . 2 . 3]" 1
1398 1 71 ILE QG 1 85 MET HG3 . . 4.110 2.070 1.985 2.140 . 0 0 "[ . 1 . 2 . 3]" 1
1399 1 71 ILE QG 1 87 ASN HA . . 4.800 3.036 2.842 3.192 . 0 0 "[ . 1 . 2 . 3]" 1
1400 1 71 ILE HG12 1 71 ILE MG . . 3.340 2.281 2.245 2.307 . 0 0 "[ . 1 . 2 . 3]" 1
1401 1 71 ILE HG12 1 72 ARG H . . 4.620 4.596 4.502 4.634 0.014 17 0 "[ . 1 . 2 . 3]" 1
1402 1 71 ILE HG13 1 71 ILE MG . . 3.340 3.213 3.198 3.231 . 0 0 "[ . 1 . 2 . 3]" 1
1403 1 71 ILE HG13 1 72 ARG H . . 4.620 3.390 3.269 3.490 . 0 0 "[ . 1 . 2 . 3]" 1
1404 1 71 ILE MG 1 72 ARG H . . 4.010 3.940 3.869 4.045 0.035 27 0 "[ . 1 . 2 . 3]" 1
1405 1 71 ILE MG 1 85 MET ME . . 4.460 4.632 4.484 4.762 0.302 28 0 "[ . 1 . 2 . 3]" 1
1406 1 71 ILE MG 1 85 MET HG2 . . 5.500 4.970 4.736 5.203 . 0 0 "[ . 1 . 2 . 3]" 1
1407 1 71 ILE MG 1 85 MET HG3 . . 4.110 4.112 3.939 4.160 0.050 29 0 "[ . 1 . 2 . 3]" 1
1408 1 71 ILE MG 1 86 LEU HA . . 4.770 3.979 3.592 4.342 . 0 0 "[ . 1 . 2 . 3]" 1
1409 1 71 ILE MG 1 87 ASN H . . 4.350 2.967 2.696 3.216 . 0 0 "[ . 1 . 2 . 3]" 1
1410 1 71 ILE MG 1 87 ASN HA . . 3.610 2.321 2.224 2.492 . 0 0 "[ . 1 . 2 . 3]" 1
1411 1 71 ILE MG 1 87 ASN HB2 . . 3.790 2.196 2.093 2.309 . 0 0 "[ . 1 . 2 . 3]" 1
1412 1 71 ILE MG 1 87 ASN QB . . 3.240 2.177 2.078 2.284 . 0 0 "[ . 1 . 2 . 3]" 1
1413 1 71 ILE MG 1 87 ASN HB3 . . 3.790 3.578 3.516 3.627 . 0 0 "[ . 1 . 2 . 3]" 1
1414 1 71 ILE MG 1 87 ASN HD21 . . 4.060 3.636 3.388 4.067 0.007 9 0 "[ . 1 . 2 . 3]" 1
1415 1 71 ILE MG 1 87 ASN QD . . 3.560 2.743 2.448 3.583 0.023 10 0 "[ . 1 . 2 . 3]" 1
1416 1 71 ILE MG 1 87 ASN HD22 . . 4.060 2.853 2.499 4.083 0.023 10 0 "[ . 1 . 2 . 3]" 1
1417 1 71 ILE MG 1 88 PRO HD2 . . 3.880 3.493 3.129 3.941 0.061 6 0 "[ . 1 . 2 . 3]" 1
1418 1 71 ILE MG 1 88 PRO HD3 . . 3.940 3.890 3.438 3.998 0.058 10 0 "[ . 1 . 2 . 3]" 1
1419 1 71 ILE MG 1 89 GLU H . . 5.500 5.277 5.028 5.546 0.046 9 0 "[ . 1 . 2 . 3]" 1
1420 1 72 ARG HA 1 72 ARG QG . . 3.710 2.462 2.423 2.518 . 0 0 "[ . 1 . 2 . 3]" 1
1421 1 72 ARG HA 1 73 VAL H . . 3.350 2.177 2.098 2.242 . 0 0 "[ . 1 . 2 . 3]" 1
1422 1 72 ARG HA 1 73 VAL QG . . 4.060 3.443 3.073 3.839 . 0 0 "[ . 1 . 2 . 3]" 1
1423 1 72 ARG HA 1 85 MET H . . 4.770 3.610 3.477 3.773 . 0 0 "[ . 1 . 2 . 3]" 1
1424 1 72 ARG QD 1 84 TRP HH2 . . 4.470 2.769 2.526 3.202 . 0 0 "[ . 1 . 2 . 3]" 1
1425 1 72 ARG QD 1 84 TRP HZ2 . . 4.170 3.303 2.912 3.573 . 0 0 "[ . 1 . 2 . 3]" 1
1426 1 72 ARG HD2 1 84 TRP HZ2 . . 5.020 3.749 2.942 4.060 . 0 0 "[ . 1 . 2 . 3]" 1
1427 1 72 ARG HD3 1 84 TRP HZ2 . . 5.020 3.760 3.082 5.023 0.003 15 0 "[ . 1 . 2 . 3]" 1
1428 1 72 ARG QG 1 82 SER QB . . 3.760 2.414 2.118 2.702 . 0 0 "[ . 1 . 2 . 3]" 1
1429 1 72 ARG HG2 1 73 VAL H . . 4.360 2.981 2.710 3.413 . 0 0 "[ . 1 . 2 . 3]" 1
1430 1 72 ARG HG2 1 82 SER HB2 . . 5.070 3.522 2.529 4.618 . 0 0 "[ . 1 . 2 . 3]" 1
1431 1 72 ARG HG2 1 82 SER HB3 . . 5.070 3.193 2.383 4.572 . 0 0 "[ . 1 . 2 . 3]" 1
1432 1 72 ARG HG3 1 73 VAL H . . 4.360 3.352 2.955 3.793 . 0 0 "[ . 1 . 2 . 3]" 1
1433 1 72 ARG HG3 1 82 SER HB2 . . 5.070 3.131 2.672 3.693 . 0 0 "[ . 1 . 2 . 3]" 1
1434 1 72 ARG HG3 1 82 SER HB3 . . 5.070 3.360 2.524 4.587 . 0 0 "[ . 1 . 2 . 3]" 1
1435 1 73 VAL H 1 73 VAL HB . . 3.840 3.053 2.872 3.650 . 0 0 "[ . 1 . 2 . 3]" 1
1436 1 73 VAL H 1 73 VAL MG1 . . 3.890 3.152 1.765 3.973 0.083 29 0 "[ . 1 . 2 . 3]" 1
1437 1 73 VAL H 1 73 VAL QG . . 3.080 2.176 1.760 2.355 . 0 0 "[ . 1 . 2 . 3]" 1
1438 1 73 VAL H 1 73 VAL MG2 . . 3.890 2.897 2.007 3.946 0.056 22 0 "[ . 1 . 2 . 3]" 1
1439 1 73 VAL H 1 74 GLN H . . 4.670 4.476 4.376 4.576 . 0 0 "[ . 1 . 2 . 3]" 1
1440 1 73 VAL H 1 82 SER QB . . 5.040 3.943 3.530 4.773 . 0 0 "[ . 1 . 2 . 3]" 1
1441 1 73 VAL H 1 83 TRP H . . 4.270 3.367 3.109 3.788 . 0 0 "[ . 1 . 2 . 3]" 1
1442 1 73 VAL H 1 83 TRP HB2 . . 4.770 2.835 2.550 3.250 . 0 0 "[ . 1 . 2 . 3]" 1
1443 1 73 VAL H 1 83 TRP HB3 . . 5.060 3.716 3.243 4.249 . 0 0 "[ . 1 . 2 . 3]" 1
1444 1 73 VAL H 1 84 TRP H . . 5.500 4.748 4.642 4.881 . 0 0 "[ . 1 . 2 . 3]" 1
1445 1 73 VAL H 1 84 TRP HA . . 4.630 3.443 3.287 3.688 . 0 0 "[ . 1 . 2 . 3]" 1
1446 1 73 VAL H 1 85 MET H . . 5.500 4.560 4.135 4.894 . 0 0 "[ . 1 . 2 . 3]" 1
1447 1 73 VAL HA 1 73 VAL MG1 . . 3.250 2.633 2.213 3.221 . 0 0 "[ . 1 . 2 . 3]" 1
1448 1 73 VAL HA 1 73 VAL QG . . 2.810 2.230 2.112 2.630 . 0 0 "[ . 1 . 2 . 3]" 1
1449 1 73 VAL HA 1 73 VAL MG2 . . 3.250 2.597 2.219 2.864 . 0 0 "[ . 1 . 2 . 3]" 1
1450 1 73 VAL HA 1 74 GLN H . . 2.760 2.191 2.133 2.255 . 0 0 "[ . 1 . 2 . 3]" 1
1451 1 73 VAL HA 1 74 GLN QB . . 4.930 4.370 3.984 4.560 . 0 0 "[ . 1 . 2 . 3]" 1
1452 1 73 VAL HB 1 74 GLN H . . 4.450 3.778 3.564 4.200 . 0 0 "[ . 1 . 2 . 3]" 1
1453 1 73 VAL HB 1 83 TRP H . . 5.500 4.404 3.002 5.541 0.041 27 0 "[ . 1 . 2 . 3]" 1
1454 1 73 VAL HB 1 83 TRP HB2 . . 4.250 2.912 1.902 4.254 0.004 16 0 "[ . 1 . 2 . 3]" 1
1455 1 73 VAL HB 1 83 TRP HB3 . . 4.430 3.796 2.923 4.517 0.087 5 0 "[ . 1 . 2 . 3]" 1
1456 1 73 VAL QG 1 74 GLN H . . 3.190 2.386 2.296 2.608 . 0 0 "[ . 1 . 2 . 3]" 1
1457 1 73 VAL QG 1 75 ASN H . . 4.800 4.840 4.275 5.042 0.242 14 0 "[ . 1 . 2 . 3]" 1
1458 1 73 VAL QG 1 83 TRP H . . 4.500 3.663 3.060 4.331 . 0 0 "[ . 1 . 2 . 3]" 1
1459 1 73 VAL QG 1 83 TRP HB2 . . 3.450 2.187 1.835 2.715 . 0 0 "[ . 1 . 2 . 3]" 1
1460 1 73 VAL QG 1 83 TRP HB3 . . 3.610 2.435 1.968 2.989 . 0 0 "[ . 1 . 2 . 3]" 1
1461 1 73 VAL QG 1 83 TRP HD1 . . 3.640 2.793 2.012 3.314 . 0 0 "[ . 1 . 2 . 3]" 1
1462 1 73 VAL QG 1 83 TRP HE1 . . 4.600 4.376 3.922 4.654 0.054 29 0 "[ . 1 . 2 . 3]" 1
1463 1 73 VAL QG 1 83 TRP HE3 . . 5.090 4.758 4.145 5.189 0.099 18 0 "[ . 1 . 2 . 3]" 1
1464 1 73 VAL QG 1 84 TRP H . . 4.680 4.203 3.617 4.517 . 0 0 "[ . 1 . 2 . 3]" 1
1465 1 73 VAL QG 1 84 TRP HA . . 4.650 3.699 3.098 3.951 . 0 0 "[ . 1 . 2 . 3]" 1
1466 1 73 VAL QG 1 85 MET H . . 4.290 3.841 3.368 4.209 . 0 0 "[ . 1 . 2 . 3]" 1
1467 1 73 VAL QG 1 85 MET HB2 . . 4.970 4.269 4.051 4.515 . 0 0 "[ . 1 . 2 . 3]" 1
1468 1 73 VAL QG 1 85 MET HB3 . . 3.910 3.320 3.058 3.630 . 0 0 "[ . 1 . 2 . 3]" 1
1469 1 73 VAL QG 1 85 MET ME . . 4.550 3.756 3.621 4.074 . 0 0 "[ . 1 . 2 . 3]" 1
1470 1 73 VAL QG 1 85 MET HG2 . . 3.810 2.324 2.025 2.520 . 0 0 "[ . 1 . 2 . 3]" 1
1471 1 73 VAL QG 1 85 MET HG3 . . 3.650 3.579 3.411 3.744 0.094 21 0 "[ . 1 . 2 . 3]" 1
1472 1 73 VAL MG1 1 74 GLN H . . 4.170 3.042 2.314 4.302 0.132 13 0 "[ . 1 . 2 . 3]" 1
1473 1 73 VAL MG1 1 83 TRP HB2 . . 4.110 2.942 1.886 3.768 . 0 0 "[ . 1 . 2 . 3]" 1
1474 1 73 VAL MG1 1 83 TRP HB3 . . 4.490 3.450 1.997 4.615 0.125 29 0 "[ . 1 . 2 . 3]" 1
1475 1 73 VAL MG1 1 83 TRP HD1 . . 4.240 3.195 2.431 3.951 . 0 0 "[ . 1 . 2 . 3]" 1
1476 1 73 VAL MG1 1 83 TRP HE1 . . 5.500 4.842 4.485 5.617 0.117 13 0 "[ . 1 . 2 . 3]" 1
1477 1 73 VAL MG2 1 74 GLN H . . 4.170 3.446 2.320 4.231 0.061 30 0 "[ . 1 . 2 . 3]" 1
1478 1 73 VAL MG2 1 83 TRP HB2 . . 4.110 2.775 2.007 3.930 . 0 0 "[ . 1 . 2 . 3]" 1
1479 1 73 VAL MG2 1 83 TRP HB3 . . 4.490 3.267 2.452 4.522 0.032 22 0 "[ . 1 . 2 . 3]" 1
1480 1 73 VAL MG2 1 83 TRP HD1 . . 4.240 3.572 2.020 4.114 . 0 0 "[ . 1 . 2 . 3]" 1
1481 1 73 VAL MG2 1 83 TRP HE1 . . 5.500 5.315 4.006 5.639 0.139 29 0 "[ . 1 . 2 . 3]" 1
1482 1 74 GLN H 1 74 GLN HB2 . . 3.810 2.900 2.060 3.667 . 0 0 "[ . 1 . 2 . 3]" 1
1483 1 74 GLN H 1 74 GLN QB . . 2.990 2.429 2.036 2.668 . 0 0 "[ . 1 . 2 . 3]" 1
1484 1 74 GLN H 1 74 GLN HB3 . . 3.810 3.167 2.449 3.694 . 0 0 "[ . 1 . 2 . 3]" 1
1485 1 74 GLN H 1 74 GLN QG . . 3.670 2.487 1.916 3.535 . 0 0 "[ . 1 . 2 . 3]" 1
1486 1 74 GLN HA 1 74 GLN QG . . 3.740 2.862 2.317 3.547 . 0 0 "[ . 1 . 2 . 3]" 1
1487 1 74 GLN HA 1 75 ASN H . . 2.660 2.384 2.207 2.633 . 0 0 "[ . 1 . 2 . 3]" 1
1488 1 74 GLN QB 1 75 ASN H . . 3.910 2.574 2.144 3.118 . 0 0 "[ . 1 . 2 . 3]" 1
1489 1 74 GLN QG 1 75 ASN H . . 4.530 3.781 3.085 4.531 0.001 15 0 "[ . 1 . 2 . 3]" 1
1490 1 75 ASN H 1 75 ASN HB2 . . 3.730 2.759 2.193 3.780 0.050 3 0 "[ . 1 . 2 . 3]" 1
1491 1 75 ASN H 1 75 ASN QB . . 3.090 2.486 2.172 3.126 0.036 24 0 "[ . 1 . 2 . 3]" 1
1492 1 75 ASN H 1 75 ASN HB3 . . 3.730 3.054 2.428 3.729 . 0 0 "[ . 1 . 2 . 3]" 1
1493 1 75 ASN H 1 75 ASN QD . . 4.400 4.083 2.280 4.515 0.115 19 0 "[ . 1 . 2 . 3]" 1
1494 1 75 ASN H 1 76 GLU H . . 4.800 4.469 4.294 4.608 . 0 0 "[ . 1 . 2 . 3]" 1
1495 1 75 ASN HA 1 76 GLU H . . 2.910 2.476 2.122 2.812 . 0 0 "[ . 1 . 2 . 3]" 1
1496 1 75 ASN HA 1 83 TRP HD1 . . 4.480 2.819 2.154 3.907 . 0 0 "[ . 1 . 2 . 3]" 1
1497 1 75 ASN HA 1 83 TRP HE1 . . 3.940 2.808 2.321 3.944 0.004 9 0 "[ . 1 . 2 . 3]" 1
1498 1 75 ASN QB 1 75 ASN QD . . 3.080 2.133 2.015 2.461 . 0 0 "[ . 1 . 2 . 3]" 1
1499 1 75 ASN QB 1 77 GLY H . . 4.360 2.794 2.226 4.294 . 0 0 "[ . 1 . 2 . 3]" 1
1500 1 75 ASN QB 1 83 TRP HE1 . . 4.740 3.697 1.912 4.694 . 0 0 "[ . 1 . 2 . 3]" 1
1501 1 75 ASN HB2 1 76 GLU H . . 3.940 3.536 2.042 4.023 0.083 29 0 "[ . 1 . 2 . 3]" 1
1502 1 75 ASN HB2 1 83 TRP HE1 . . 5.500 4.283 2.338 5.503 0.003 17 0 "[ . 1 . 2 . 3]" 1
1503 1 75 ASN HB3 1 76 GLU H . . 3.940 3.090 2.215 3.953 0.013 15 0 "[ . 1 . 2 . 3]" 1
1504 1 75 ASN HB3 1 83 TRP HE1 . . 5.500 4.248 1.932 5.505 0.005 26 0 "[ . 1 . 2 . 3]" 1
1505 1 75 ASN QD 1 83 TRP HE1 . . 4.700 3.377 2.335 4.734 0.034 13 0 "[ . 1 . 2 . 3]" 1
1506 1 76 GLU H 1 76 GLU HB2 . . 3.750 2.583 2.308 3.505 . 0 0 "[ . 1 . 2 . 3]" 1
1507 1 76 GLU H 1 76 GLU QB . . 3.020 2.485 2.277 2.888 . 0 0 "[ . 1 . 2 . 3]" 1
1508 1 76 GLU H 1 76 GLU HB3 . . 3.750 3.516 2.323 3.636 . 0 0 "[ . 1 . 2 . 3]" 1
1509 1 76 GLU H 1 76 GLU HG2 . . 4.090 2.781 1.884 3.772 . 0 0 "[ . 1 . 2 . 3]" 1
1510 1 76 GLU H 1 76 GLU QG . . 3.480 2.150 1.875 3.081 . 0 0 "[ . 1 . 2 . 3]" 1
1511 1 76 GLU H 1 76 GLU HG3 . . 4.090 2.907 1.962 3.720 . 0 0 "[ . 1 . 2 . 3]" 1
1512 1 76 GLU H 1 77 GLY H . . 3.460 2.739 2.308 3.447 . 0 0 "[ . 1 . 2 . 3]" 1
1513 1 76 GLU H 1 83 TRP HE1 . . 5.240 3.747 2.888 5.100 . 0 0 "[ . 1 . 2 . 3]" 1
1514 1 76 GLU QB 1 77 GLY H . . 3.500 2.831 2.021 3.570 0.070 13 0 "[ . 1 . 2 . 3]" 1
1515 1 76 GLU HB2 1 77 GLY H . . 4.050 2.915 2.054 3.966 . 0 0 "[ . 1 . 2 . 3]" 1
1516 1 76 GLU HB3 1 77 GLY H . . 4.050 3.912 2.998 4.081 0.031 24 0 "[ . 1 . 2 . 3]" 1
1517 1 76 GLU QG 1 77 GLY H . . 4.790 4.061 2.402 4.735 . 0 0 "[ . 1 . 2 . 3]" 1
1518 1 76 GLU HG2 1 77 GLY H . . 5.500 4.630 2.614 5.503 0.003 22 0 "[ . 1 . 2 . 3]" 1
1519 1 76 GLU HG3 1 77 GLY H . . 5.500 4.714 2.801 5.362 . 0 0 "[ . 1 . 2 . 3]" 1
1520 1 77 GLY H 1 77 GLY QA . . 2.650 2.422 2.224 2.529 . 0 0 "[ . 1 . 2 . 3]" 1
1521 1 77 GLY H 1 78 THR H . . 3.600 2.981 1.828 3.729 0.129 28 0 "[ . 1 . 2 . 3]" 1
1522 1 77 GLY QA 1 78 THR H . . 2.900 2.500 2.013 2.903 0.003 5 0 "[ . 1 . 2 . 3]" 1
1523 1 77 GLY QA 1 78 THR MG . . 3.990 3.637 3.151 4.067 0.077 9 0 "[ . 1 . 2 . 3]" 1
1524 1 78 THR H 1 78 THR HB . . 3.560 3.181 2.458 3.773 0.213 29 0 "[ . 1 . 2 . 3]" 1
1525 1 78 THR H 1 78 THR MG . . 4.070 2.502 1.903 3.529 . 0 0 "[ . 1 . 2 . 3]" 1
1526 1 78 THR H 1 79 GLY H . . 3.700 2.985 2.184 3.752 0.052 24 0 "[ . 1 . 2 . 3]" 1
1527 1 78 THR HA 1 78 THR MG . . 3.310 2.812 2.132 3.268 . 0 0 "[ . 1 . 2 . 3]" 1
1528 1 78 THR HA 1 79 GLY H . . 3.070 2.837 1.985 3.139 0.069 13 0 "[ . 1 . 2 . 3]" 1
1529 1 78 THR MG 1 79 GLY H . . 4.040 3.864 3.107 4.253 0.213 17 0 "[ . 1 . 2 . 3]" 1
1530 1 79 GLY H 1 80 LYS H . . 3.910 3.290 2.195 4.047 0.137 29 0 "[ . 1 . 2 . 3]" 1
1531 1 79 GLY QA 1 80 LYS QG . . 5.180 3.793 3.213 4.485 . 0 0 "[ . 1 . 2 . 3]" 1
1532 1 79 GLY QA 1 81 SER H . . 4.860 3.587 3.009 4.897 0.037 3 0 "[ . 1 . 2 . 3]" 1
1533 1 80 LYS H 1 80 LYS HB2 . . 3.890 2.817 2.397 3.777 . 0 0 "[ . 1 . 2 . 3]" 1
1534 1 80 LYS H 1 80 LYS QB . . 3.400 2.712 2.365 3.424 0.024 12 0 "[ . 1 . 2 . 3]" 1
1535 1 80 LYS H 1 80 LYS HB3 . . 3.890 3.735 3.590 3.983 0.093 28 0 "[ . 1 . 2 . 3]" 1
1536 1 80 LYS H 1 80 LYS HG2 . . 4.090 3.364 2.209 4.104 0.014 6 0 "[ . 1 . 2 . 3]" 1
1537 1 80 LYS H 1 80 LYS QG . . 3.560 2.471 2.021 3.238 . 0 0 "[ . 1 . 2 . 3]" 1
1538 1 80 LYS H 1 80 LYS HG3 . . 4.090 2.683 2.047 3.767 . 0 0 "[ . 1 . 2 . 3]" 1
1539 1 80 LYS H 1 81 SER H . . 3.910 2.959 2.156 3.945 0.035 30 0 "[ . 1 . 2 . 3]" 1
1540 1 80 LYS HA 1 80 LYS HG2 . . 3.880 2.588 2.388 3.183 . 0 0 "[ . 1 . 2 . 3]" 1
1541 1 80 LYS HA 1 80 LYS QG . . 3.390 2.482 2.326 3.034 . 0 0 "[ . 1 . 2 . 3]" 1
1542 1 80 LYS HA 1 80 LYS HG3 . . 3.880 3.209 2.866 3.827 . 0 0 "[ . 1 . 2 . 3]" 1
1543 1 80 LYS QB 1 81 SER H . . 3.290 2.840 2.385 3.461 0.171 14 0 "[ . 1 . 2 . 3]" 1
1544 1 80 LYS HB2 1 81 SER H . . 4.070 2.969 2.440 4.173 0.103 14 0 "[ . 1 . 2 . 3]" 1
1545 1 80 LYS HB3 1 81 SER H . . 4.070 3.810 3.358 4.088 0.018 20 0 "[ . 1 . 2 . 3]" 1
1546 1 80 LYS QG 1 81 SER H . . 4.480 4.188 3.804 4.389 . 0 0 "[ . 1 . 2 . 3]" 1
1547 1 81 SER H 1 81 SER HB2 . . 3.990 2.674 2.412 3.612 . 0 0 "[ . 1 . 2 . 3]" 1
1548 1 81 SER H 1 81 SER QB . . 3.120 2.573 2.375 2.991 . 0 0 "[ . 1 . 2 . 3]" 1
1549 1 81 SER H 1 81 SER HB3 . . 3.990 3.632 2.806 3.976 . 0 0 "[ . 1 . 2 . 3]" 1
1550 1 82 SER HA 1 83 TRP H . . 3.280 2.337 2.193 2.477 . 0 0 "[ . 1 . 2 . 3]" 1
1551 1 82 SER HB2 1 83 TRP H . . 4.330 3.355 2.442 3.945 . 0 0 "[ . 1 . 2 . 3]" 1
1552 1 82 SER HB3 1 83 TRP H . . 4.330 3.072 2.321 4.276 . 0 0 "[ . 1 . 2 . 3]" 1
1553 1 83 TRP H 1 83 TRP HB2 . . 3.990 2.232 2.032 2.453 . 0 0 "[ . 1 . 2 . 3]" 1
1554 1 83 TRP H 1 83 TRP HB3 . . 4.080 3.526 3.412 3.623 . 0 0 "[ . 1 . 2 . 3]" 1
1555 1 83 TRP H 1 83 TRP HD1 . . 4.540 3.248 2.900 3.803 . 0 0 "[ . 1 . 2 . 3]" 1
1556 1 83 TRP H 1 83 TRP HE3 . . 5.210 5.062 4.914 5.205 . 0 0 "[ . 1 . 2 . 3]" 1
1557 1 83 TRP H 1 84 TRP H . . 5.160 4.568 4.459 4.618 . 0 0 "[ . 1 . 2 . 3]" 1
1558 1 83 TRP HA 1 83 TRP HE3 . . 4.440 2.543 2.211 2.735 . 0 0 "[ . 1 . 2 . 3]" 1
1559 1 83 TRP HB2 1 83 TRP HE1 . . 4.830 4.696 4.646 4.742 . 0 0 "[ . 1 . 2 . 3]" 1
1560 1 83 TRP HB2 1 84 TRP H . . 4.390 4.011 3.728 4.186 . 0 0 "[ . 1 . 2 . 3]" 1
1561 1 83 TRP HB3 1 83 TRP HE1 . . 5.260 5.158 5.084 5.220 . 0 0 "[ . 1 . 2 . 3]" 1
1562 1 83 TRP HB3 1 83 TRP HE3 . . 4.040 2.971 2.812 3.272 . 0 0 "[ . 1 . 2 . 3]" 1
1563 1 83 TRP HB3 1 84 TRP H . . 4.080 2.936 2.712 3.123 . 0 0 "[ . 1 . 2 . 3]" 1
1564 1 83 TRP HB3 1 85 MET H . . 5.060 5.051 4.874 5.087 0.027 23 0 "[ . 1 . 2 . 3]" 1
1565 1 83 TRP HE3 1 84 TRP H . . 4.850 3.135 2.869 3.459 . 0 0 "[ . 1 . 2 . 3]" 1
1566 1 84 TRP H 1 84 TRP HB2 . . 4.090 2.616 2.559 2.715 . 0 0 "[ . 1 . 2 . 3]" 1
1567 1 84 TRP H 1 84 TRP HB3 . . 4.090 3.772 3.738 3.825 . 0 0 "[ . 1 . 2 . 3]" 1
1568 1 84 TRP H 1 84 TRP HD1 . . 4.130 3.031 2.764 3.123 . 0 0 "[ . 1 . 2 . 3]" 1
1569 1 84 TRP H 1 85 MET HG2 . . 5.290 5.204 4.971 5.301 0.011 3 0 "[ . 1 . 2 . 3]" 1
1570 1 84 TRP HA 1 85 MET H . . 3.540 2.207 2.160 2.247 . 0 0 "[ . 1 . 2 . 3]" 1
1571 1 84 TRP QB 1 85 MET H . . 4.310 3.140 3.076 3.242 . 0 0 "[ . 1 . 2 . 3]" 1
1572 1 84 TRP HE3 1 85 MET H . . 4.720 4.039 3.878 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
1573 1 85 MET H 1 85 MET ME . . 5.110 5.001 4.897 5.077 . 0 0 "[ . 1 . 2 . 3]" 1
1574 1 85 MET H 1 85 MET HG2 . . 4.230 2.670 2.524 2.774 . 0 0 "[ . 1 . 2 . 3]" 1
1575 1 85 MET H 1 85 MET HG3 . . 4.110 3.252 3.060 3.369 . 0 0 "[ . 1 . 2 . 3]" 1
1576 1 85 MET HA 1 85 MET ME . . 4.630 4.283 4.242 4.348 . 0 0 "[ . 1 . 2 . 3]" 1
1577 1 85 MET HA 1 85 MET HG2 . . 3.970 3.804 3.769 3.835 . 0 0 "[ . 1 . 2 . 3]" 1
1578 1 85 MET HA 1 85 MET HG3 . . 3.750 3.731 3.700 3.755 0.005 16 0 "[ . 1 . 2 . 3]" 1
1579 1 85 MET HA 1 86 LEU H . . 3.530 2.547 2.484 2.603 . 0 0 "[ . 1 . 2 . 3]" 1
1580 1 85 MET HB2 1 85 MET ME . . 3.100 2.200 2.142 2.244 . 0 0 "[ . 1 . 2 . 3]" 1
1581 1 85 MET HB2 1 86 LEU H . . 3.650 2.154 2.082 2.237 . 0 0 "[ . 1 . 2 . 3]" 1
1582 1 85 MET HB3 1 86 LEU H . . 3.860 3.637 3.572 3.703 . 0 0 "[ . 1 . 2 . 3]" 1
1583 1 85 MET ME 1 85 MET HG2 . . 3.550 3.424 3.395 3.465 . 0 0 "[ . 1 . 2 . 3]" 1
1584 1 85 MET ME 1 85 MET HG3 . . 3.420 2.391 2.353 2.447 . 0 0 "[ . 1 . 2 . 3]" 1
1585 1 85 MET ME 1 86 LEU H . . 4.100 3.148 3.018 3.291 . 0 0 "[ . 1 . 2 . 3]" 1
1586 1 85 MET ME 1 86 LEU QB . . 5.340 3.864 3.682 4.049 . 0 0 "[ . 1 . 2 . 3]" 1
1587 1 85 MET ME 1 87 ASN HA . . 4.450 3.972 3.654 4.207 . 0 0 "[ . 1 . 2 . 3]" 1
1588 1 85 MET ME 1 88 PRO HA . . 5.040 4.125 3.544 4.766 . 0 0 "[ . 1 . 2 . 3]" 1
1589 1 85 MET ME 1 88 PRO HD2 . . 4.820 4.160 3.750 4.612 . 0 0 "[ . 1 . 2 . 3]" 1
1590 1 85 MET ME 1 88 PRO HD3 . . 3.850 2.594 2.217 3.126 . 0 0 "[ . 1 . 2 . 3]" 1
1591 1 85 MET HG2 1 86 LEU H . . 5.500 4.437 4.321 4.640 . 0 0 "[ . 1 . 2 . 3]" 1
1592 1 85 MET HG3 1 86 LEU H . . 3.970 3.290 3.106 3.598 . 0 0 "[ . 1 . 2 . 3]" 1
1593 1 86 LEU H 1 86 LEU HB2 . . 3.860 2.517 2.429 2.596 . 0 0 "[ . 1 . 2 . 3]" 1
1594 1 86 LEU H 1 86 LEU QB . . 3.260 2.473 2.392 2.542 . 0 0 "[ . 1 . 2 . 3]" 1
1595 1 86 LEU H 1 86 LEU HB3 . . 3.860 3.624 3.585 3.651 . 0 0 "[ . 1 . 2 . 3]" 1
1596 1 86 LEU H 1 86 LEU MD1 . . 3.680 3.638 3.590 3.695 0.015 24 0 "[ . 1 . 2 . 3]" 1
1597 1 86 LEU H 1 86 LEU MD2 . . 3.700 3.335 3.116 3.493 . 0 0 "[ . 1 . 2 . 3]" 1
1598 1 86 LEU H 1 86 LEU HG . . 3.570 2.274 2.130 2.408 . 0 0 "[ . 1 . 2 . 3]" 1
1599 1 86 LEU HA 1 86 LEU MD1 . . 4.180 3.924 3.853 4.001 . 0 0 "[ . 1 . 2 . 3]" 1
1600 1 86 LEU HA 1 86 LEU MD2 . . 3.030 2.205 2.110 2.297 . 0 0 "[ . 1 . 2 . 3]" 1
1601 1 86 LEU HA 1 86 LEU HG . . 4.200 3.254 3.150 3.340 . 0 0 "[ . 1 . 2 . 3]" 1
1602 1 86 LEU QB 1 87 ASN H . . 4.170 2.856 2.701 3.081 . 0 0 "[ . 1 . 2 . 3]" 1
1603 1 86 LEU QB 1 87 ASN QB . . 5.180 4.197 4.028 4.387 . 0 0 "[ . 1 . 2 . 3]" 1
1604 1 86 LEU HB2 1 86 LEU MD1 . . 3.040 2.295 2.246 2.365 . 0 0 "[ . 1 . 2 . 3]" 1
1605 1 86 LEU HB3 1 86 LEU MD1 . . 3.040 2.428 2.348 2.493 . 0 0 "[ . 1 . 2 . 3]" 1
1606 1 86 LEU MD2 1 87 ASN H . . 4.260 3.852 3.669 4.084 . 0 0 "[ . 1 . 2 . 3]" 1
1607 1 87 ASN H 1 87 ASN HB2 . . 3.910 2.489 2.313 2.776 . 0 0 "[ . 1 . 2 . 3]" 1
1608 1 87 ASN H 1 87 ASN HB3 . . 3.910 2.575 2.346 2.745 . 0 0 "[ . 1 . 2 . 3]" 1
1609 1 87 ASN HA 1 88 PRO HD2 . . 3.630 2.311 2.123 2.717 . 0 0 "[ . 1 . 2 . 3]" 1
1610 1 87 ASN HA 1 88 PRO HD3 . . 3.910 2.449 2.007 2.652 . 0 0 "[ . 1 . 2 . 3]" 1
1611 1 87 ASN HA 1 89 GLU H . . 4.600 4.118 3.810 4.377 . 0 0 "[ . 1 . 2 . 3]" 1
1612 1 87 ASN QB 1 89 GLU H . . 4.470 4.128 3.598 4.485 0.015 7 0 "[ . 1 . 2 . 3]" 1
1613 1 87 ASN QB 1 90 GLY QA . . 4.920 3.115 2.308 4.565 . 0 0 "[ . 1 . 2 . 3]" 1
1614 1 87 ASN HB2 1 88 PRO HD2 . . 4.540 4.252 3.872 4.549 0.009 22 0 "[ . 1 . 2 . 3]" 1
1615 1 87 ASN HB3 1 88 PRO HD2 . . 4.540 4.443 4.278 4.558 0.018 8 0 "[ . 1 . 2 . 3]" 1
1616 1 87 ASN QD 1 88 PRO HD2 . . 4.680 3.872 2.545 4.349 . 0 0 "[ . 1 . 2 . 3]" 1
1617 1 88 PRO HB2 1 89 GLU H . . 3.220 3.173 2.691 3.298 0.078 28 0 "[ . 1 . 2 . 3]" 1
1618 1 88 PRO HB3 1 89 GLU H . . 4.400 4.118 4.037 4.188 . 0 0 "[ . 1 . 2 . 3]" 1
1619 1 88 PRO HB3 1 90 GLY H . . 5.500 5.483 5.183 5.533 0.033 3 0 "[ . 1 . 2 . 3]" 1
1620 1 88 PRO HD2 1 89 GLU H . . 3.510 2.826 2.657 3.034 . 0 0 "[ . 1 . 2 . 3]" 1
1621 1 88 PRO HD3 1 89 GLU H . . 4.060 3.980 3.864 4.064 0.004 6 0 "[ . 1 . 2 . 3]" 1
1622 1 88 PRO QG 1 89 GLU H . . 3.850 2.507 2.100 3.896 0.046 17 0 "[ . 1 . 2 . 3]" 1
1623 1 89 GLU H 1 89 GLU QB . . 3.220 2.461 2.350 2.692 . 0 0 "[ . 1 . 2 . 3]" 1
1624 1 89 GLU H 1 89 GLU HG2 . . 4.050 3.229 1.962 3.903 . 0 0 "[ . 1 . 2 . 3]" 1
1625 1 89 GLU H 1 89 GLU QG . . 3.460 2.164 1.942 2.713 . 0 0 "[ . 1 . 2 . 3]" 1
1626 1 89 GLU H 1 89 GLU HG3 . . 4.050 2.450 1.979 3.637 . 0 0 "[ . 1 . 2 . 3]" 1
1627 1 89 GLU HB2 1 90 GLY H . . 4.470 3.197 2.747 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
1628 1 89 GLU HB3 1 90 GLY H . . 4.470 4.063 3.877 4.346 . 0 0 "[ . 1 . 2 . 3]" 1
1629 1 89 GLU QG 1 90 GLY H . . 4.730 3.934 2.625 4.371 . 0 0 "[ . 1 . 2 . 3]" 1
1630 1 89 GLU HG2 1 90 GLY H . . 5.500 4.834 2.837 5.337 . 0 0 "[ . 1 . 2 . 3]" 1
1631 1 89 GLU HG3 1 90 GLY H . . 5.500 4.252 2.750 5.507 0.007 6 0 "[ . 1 . 2 . 3]" 1
1632 1 90 GLY QA 1 91 GLY H . . 3.110 2.681 2.133 2.978 . 0 0 "[ . 1 . 2 . 3]" 1
1633 1 92 LYS H 1 92 LYS HB2 . . 4.180 2.732 2.349 3.996 . 0 0 "[ . 1 . 2 . 3]" 1
1634 1 92 LYS H 1 92 LYS QB . . 3.320 2.523 2.243 3.283 . 0 0 "[ . 1 . 2 . 3]" 1
1635 1 92 LYS H 1 92 LYS HB3 . . 4.180 3.389 2.416 3.883 . 0 0 "[ . 1 . 2 . 3]" 1
1636 1 93 SER HA 1 94 GLY H . . 3.570 2.635 2.134 3.571 0.001 26 0 "[ . 1 . 2 . 3]" 1
1637 1 94 GLY H 1 95 LYS H . . 4.970 3.828 2.194 4.661 . 0 0 "[ . 1 . 2 . 3]" 1
1638 1 94 GLY QA 1 95 LYS QB . . 4.980 4.055 3.604 4.783 . 0 0 "[ . 1 . 2 . 3]" 1
1639 1 95 LYS H 1 95 LYS QB . . 3.340 2.779 2.374 3.340 0.000 27 0 "[ . 1 . 2 . 3]" 1
1640 1 95 LYS H 1 96 SER H . . 4.350 3.865 2.149 4.409 0.059 8 0 "[ . 1 . 2 . 3]" 1
1641 1 95 LYS HA 1 96 SER H . . 3.250 2.411 2.062 3.214 . 0 0 "[ . 1 . 2 . 3]" 1
1642 1 96 SER H 1 96 SER QB . . 3.900 2.656 2.235 3.372 . 0 0 "[ . 1 . 2 . 3]" 1
1643 1 96 SER HA 1 97 PRO QD . . 3.260 2.290 2.133 2.553 . 0 0 "[ . 1 . 2 . 3]" 1
1644 1 97 PRO HA 1 98 ARG H . . 2.990 2.300 2.133 2.602 . 0 0 "[ . 1 . 2 . 3]" 1
1645 1 98 ARG H 1 98 ARG HB2 . . 3.970 2.871 2.251 3.958 . 0 0 "[ . 1 . 2 . 3]" 1
1646 1 98 ARG H 1 98 ARG QB . . 3.360 2.593 2.206 3.290 . 0 0 "[ . 1 . 2 . 3]" 1
1647 1 98 ARG H 1 98 ARG HB3 . . 3.970 3.353 2.554 3.848 . 0 0 "[ . 1 . 2 . 3]" 1
1648 1 98 ARG H 1 98 ARG QG . . 4.070 2.996 1.854 4.144 0.074 13 0 "[ . 1 . 2 . 3]" 1
1649 1 98 ARG HA 1 98 ARG QG . . 3.840 2.662 2.283 3.410 . 0 0 "[ . 1 . 2 . 3]" 1
1650 1 98 ARG HA 1 99 ARG H . . 3.040 2.399 2.077 3.040 . 0 0 "[ . 1 . 2 . 3]" 1
1651 1 98 ARG QB 1 98 ARG QD . . 3.140 2.189 2.096 2.508 . 0 0 "[ . 1 . 2 . 3]" 1
1652 1 98 ARG QB 1 99 ARG H . . 4.120 3.193 2.138 4.079 . 0 0 "[ . 1 . 2 . 3]" 1
1653 1 98 ARG HB2 1 98 ARG QD . . 3.630 2.464 2.307 3.474 . 0 0 "[ . 1 . 2 . 3]" 1
1654 1 98 ARG HB3 1 98 ARG QD . . 3.630 2.511 2.298 3.363 . 0 0 "[ . 1 . 2 . 3]" 1
1655 1 98 ARG QG 1 99 ARG H . . 4.120 3.808 2.300 4.174 0.054 25 0 "[ . 1 . 2 . 3]" 1
1656 1 99 ARG H 1 99 ARG QB . . 3.590 2.683 2.132 3.394 . 0 0 "[ . 1 . 2 . 3]" 1
1657 1 99 ARG HA 1 100 ARG H . . 3.080 2.445 2.176 2.962 . 0 0 "[ . 1 . 2 . 3]" 1
1658 1 99 ARG HB2 1 100 ARG H . . 4.330 3.674 2.406 4.378 0.048 28 0 "[ . 1 . 2 . 3]" 1
1659 1 99 ARG HB3 1 100 ARG H . . 4.330 3.386 1.825 4.345 0.015 15 0 "[ . 1 . 2 . 3]" 1
1660 1 100 ARG H 1 100 ARG QG . . 4.100 2.925 2.115 4.101 0.001 11 0 "[ . 1 . 2 . 3]" 1
1661 1 100 ARG HA 1 100 ARG QG . . 3.810 2.700 2.297 3.481 . 0 0 "[ . 1 . 2 . 3]" 1
1662 1 100 ARG HA 1 101 ALA H . . 3.100 2.347 2.132 2.818 . 0 0 "[ . 1 . 2 . 3]" 1
1663 1 100 ARG HB2 1 100 ARG QD . . 3.860 2.624 2.137 3.341 . 0 0 "[ . 1 . 2 . 3]" 1
1664 1 100 ARG HB3 1 100 ARG QD . . 3.860 2.503 2.216 3.279 . 0 0 "[ . 1 . 2 . 3]" 1
1665 1 101 ALA H 1 101 ALA MB . . 3.540 2.630 2.252 2.897 . 0 0 "[ . 1 . 2 . 3]" 1
1666 1 101 ALA HA 1 102 ALA H . . 3.150 2.525 2.216 2.956 . 0 0 "[ . 1 . 2 . 3]" 1
1667 1 102 ALA H 1 102 ALA MB . . 3.440 2.621 2.250 2.949 . 0 0 "[ . 1 . 2 . 3]" 1
1668 1 102 ALA HA 1 103 SER H . . 3.440 2.469 2.207 2.973 . 0 0 "[ . 1 . 2 . 3]" 1
1669 1 102 ALA MB 1 103 SER H . . 4.390 2.846 2.059 3.800 . 0 0 "[ . 1 . 2 . 3]" 1
1670 1 103 SER HA 1 104 MET H . . 3.490 2.591 2.150 3.512 0.022 12 0 "[ . 1 . 2 . 3]" 1
1671 1 103 SER QB 1 104 MET H . . 4.870 3.126 2.291 4.033 . 0 0 "[ . 1 . 2 . 3]" 1
1672 1 104 MET H 1 104 MET QB . . 3.670 2.867 2.426 3.407 . 0 0 "[ . 1 . 2 . 3]" 1
1673 1 104 MET HA 1 105 ASP H . . 3.350 2.454 2.107 2.872 . 0 0 "[ . 1 . 2 . 3]" 1
1674 1 105 ASP H 1 105 ASP HB2 . . 4.100 3.061 2.263 3.959 . 0 0 "[ . 1 . 2 . 3]" 1
1675 1 105 ASP H 1 105 ASP QB . . 3.510 2.640 2.170 3.382 . 0 0 "[ . 1 . 2 . 3]" 1
1676 1 105 ASP H 1 105 ASP HB3 . . 4.100 3.118 2.498 4.033 . 0 0 "[ . 1 . 2 . 3]" 1
1677 1 109 LYS H 1 109 LYS QB . . 3.570 2.690 2.108 3.430 . 0 0 "[ . 1 . 2 . 3]" 1
1678 1 109 LYS H 1 110 PHE H . . 3.870 3.154 1.911 3.880 0.010 15 0 "[ . 1 . 2 . 3]" 1
1679 1 109 LYS HA 1 110 PHE H . . 3.550 2.728 2.169 3.559 0.009 1 0 "[ . 1 . 2 . 3]" 1
1680 1 109 LYS QB 1 110 PHE H . . 4.290 3.645 1.867 4.078 . 0 0 "[ . 1 . 2 . 3]" 1
1681 1 110 PHE H 1 110 PHE HB2 . . 4.000 2.968 2.336 3.922 . 0 0 "[ . 1 . 2 . 3]" 1
1682 1 110 PHE H 1 110 PHE QB . . 3.300 2.569 2.202 3.100 . 0 0 "[ . 1 . 2 . 3]" 1
1683 1 110 PHE H 1 110 PHE HB3 . . 4.000 3.164 2.353 3.826 . 0 0 "[ . 1 . 2 . 3]" 1
1684 1 110 PHE HA 1 111 ALA H . . 3.410 2.318 2.116 2.995 . 0 0 "[ . 1 . 2 . 3]" 1
1685 1 110 PHE QB 1 111 ALA H . . 4.100 3.045 2.019 4.075 . 0 0 "[ . 1 . 2 . 3]" 1
1686 1 110 PHE HB2 1 111 ALA H . . 4.740 3.696 2.391 4.680 . 0 0 "[ . 1 . 2 . 3]" 1
1687 1 110 PHE HB3 1 111 ALA H . . 4.740 3.515 2.042 4.483 . 0 0 "[ . 1 . 2 . 3]" 1
1688 1 111 ALA H 1 111 ALA MB . . 3.420 2.543 2.228 2.859 . 0 0 "[ . 1 . 2 . 3]" 1
1689 1 111 ALA HA 1 112 LYS H . . 3.190 2.405 2.162 3.199 0.009 10 0 "[ . 1 . 2 . 3]" 1
1690 1 111 ALA MB 1 112 LYS H . . 4.240 2.843 2.307 3.681 . 0 0 "[ . 1 . 2 . 3]" 1
1691 1 112 LYS H 1 112 LYS QB . . 3.510 2.694 2.208 3.314 . 0 0 "[ . 1 . 2 . 3]" 1
1692 1 112 LYS H 1 112 LYS QG . . 4.760 3.081 1.999 4.406 . 0 0 "[ . 1 . 2 . 3]" 1
1693 1 112 LYS HA 1 113 SER H . . 3.550 2.351 2.128 3.342 . 0 0 "[ . 1 . 2 . 3]" 1
1694 1 112 LYS QB 1 112 LYS QD . . 3.430 2.175 2.106 2.349 . 0 0 "[ . 1 . 2 . 3]" 1
1695 1 113 SER H 1 113 SER QB . . 3.810 2.771 2.288 3.424 . 0 0 "[ . 1 . 2 . 3]" 1
1696 1 116 ARG H 1 117 ALA H . . 5.490 3.969 2.322 4.684 . 0 0 "[ . 1 . 2 . 3]" 1
1697 1 119 LYS H 1 119 LYS QG . . 4.380 3.632 2.141 4.272 . 0 0 "[ . 1 . 2 . 3]" 1
1698 1 119 LYS HA 1 119 LYS QE . . 5.230 4.463 3.586 5.103 . 0 0 "[ . 1 . 2 . 3]" 1
stop_
save_
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