NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
606247 |
5l3n   |
34002 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5l3n
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 1388
_Distance_constraint_stats_list.Viol_count 2113
_Distance_constraint_stats_list.Viol_total 1704.568
_Distance_constraint_stats_list.Viol_max 0.444
_Distance_constraint_stats_list.Viol_rms 0.0167
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0031
_Distance_constraint_stats_list.Viol_average_violations_only 0.0403
_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 1 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 TYR 0.019 0.010 8 0 "[ . 1 . 2]"
1 3 ARG 0.666 0.046 19 0 "[ . 1 . 2]"
1 4 PRO 0.476 0.025 6 0 "[ . 1 . 2]"
1 5 SER 0.785 0.063 11 0 "[ . 1 . 2]"
1 6 GLU 0.569 0.068 12 0 "[ . 1 . 2]"
1 7 THR 1.344 0.071 19 0 "[ . 1 . 2]"
1 8 LEU 17.343 0.276 11 0 "[ . 1 . 2]"
1 9 CYS 7.822 0.236 17 0 "[ . 1 . 2]"
1 10 GLY 0.202 0.057 15 0 "[ . 1 . 2]"
1 11 GLY 0.091 0.048 18 0 "[ . 1 . 2]"
1 12 GLU 0.569 0.072 4 0 "[ . 1 . 2]"
1 13 LEU 6.710 0.276 11 0 "[ . 1 . 2]"
1 14 VAL 3.471 0.189 18 0 "[ . 1 . 2]"
1 15 ASP 0.016 0.016 20 0 "[ . 1 . 2]"
1 16 THR 6.163 0.259 11 0 "[ . 1 . 2]"
1 17 LEU 8.367 0.444 18 0 "[ . 1 . 2]"
1 18 GLN 1.609 0.162 1 0 "[ . 1 . 2]"
1 19 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 VAL 8.357 0.195 13 0 "[ . 1 . 2]"
1 21 CYS 2.905 0.214 17 0 "[ . 1 . 2]"
1 22 GLY 0.012 0.005 15 0 "[ . 1 . 2]"
1 23 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 ARG 0.239 0.060 11 0 "[ . 1 . 2]"
1 25 GLY 0.053 0.013 17 0 "[ . 1 . 2]"
1 26 PHE 1.474 0.140 19 0 "[ . 1 . 2]"
1 27 TYR 2.624 0.120 16 0 "[ . 1 . 2]"
1 28 PHE 3.759 0.187 16 0 "[ . 1 . 2]"
1 29 ASN 2.594 0.073 11 0 "[ . 1 . 2]"
1 30 ARG 5.185 0.156 17 0 "[ . 1 . 2]"
1 31 PRO 5.978 0.170 7 0 "[ . 1 . 2]"
1 32 ALA 1.991 0.093 16 0 "[ . 1 . 2]"
1 33 SER 0.907 0.054 12 0 "[ . 1 . 2]"
1 34 ARG 1.631 0.109 18 0 "[ . 1 . 2]"
1 35 VAL 2.801 0.164 13 0 "[ . 1 . 2]"
1 36 SER 1.940 0.164 13 0 "[ . 1 . 2]"
1 37 ARG 0.648 0.098 19 0 "[ . 1 . 2]"
1 38 ARG 0.604 0.076 8 0 "[ . 1 . 2]"
1 39 SER 0.483 0.076 8 0 "[ . 1 . 2]"
1 40 PRO 0.268 0.044 10 0 "[ . 1 . 2]"
1 41 GLN 0.679 0.098 2 0 "[ . 1 . 2]"
1 42 ARG 1.506 0.128 9 0 "[ . 1 . 2]"
1 43 GLY 0.169 0.050 4 0 "[ . 1 . 2]"
1 44 ILE 4.343 0.196 17 0 "[ . 1 . 2]"
1 45 VAL 8.647 0.196 17 0 "[ . 1 . 2]"
1 46 GLU 1.732 0.128 9 0 "[ . 1 . 2]"
1 47 GLU 1.493 0.077 7 0 "[ . 1 . 2]"
1 48 CYS 0.188 0.059 14 0 "[ . 1 . 2]"
1 49 CYS 0.853 0.090 16 0 "[ . 1 . 2]"
1 50 PHE 2.234 0.174 4 0 "[ . 1 . 2]"
1 51 ARG 1.451 0.091 9 0 "[ . 1 . 2]"
1 52 SER 1.000 0.091 9 0 "[ . 1 . 2]"
1 53 CYS 0.271 0.023 14 0 "[ . 1 . 2]"
1 54 ASP 0.279 0.048 9 0 "[ . 1 . 2]"
1 55 LEU 4.002 0.269 11 0 "[ . 1 . 2]"
1 56 ALA 3.778 0.269 11 0 "[ . 1 . 2]"
1 57 LEU 1.638 0.076 14 0 "[ . 1 . 2]"
1 58 LEU 8.083 0.444 18 0 "[ . 1 . 2]"
1 59 GLU 3.393 0.129 19 0 "[ . 1 . 2]"
1 60 THR 4.093 0.195 13 0 "[ . 1 . 2]"
1 61 TYR 2.800 0.170 7 0 "[ . 1 . 2]"
1 62 CYS 0.233 0.229 16 0 "[ . 1 . 2]"
1 63 ALA 2.691 0.229 16 0 "[ . 1 . 2]"
1 64 THR 3.055 0.094 5 0 "[ . 1 . 2]"
1 65 PRO 1.761 0.087 16 0 "[ . 1 . 2]"
1 66 ALA 0.958 0.082 3 0 "[ . 1 . 2]"
1 67 LYS 0.208 0.075 3 0 "[ . 1 . 2]"
1 68 SER 0.604 0.082 3 0 "[ . 1 . 2]"
1 69 GLU 0.166 0.075 3 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 ALA HA 1 2 TYR H 2.840 . 2.840 2.359 2.224 2.577 . 0 0 "[ . 1 . 2]" 1
2 1 1 ALA MB 1 2 TYR H 3.850 . 3.850 2.624 2.199 2.984 . 0 0 "[ . 1 . 2]" 1
3 1 2 TYR H 1 2 TYR HB2 3.170 . 3.170 2.617 2.452 3.180 0.010 8 0 "[ . 1 . 2]" 1
4 1 2 TYR H 1 2 TYR HB3 3.170 . 3.170 2.427 2.354 2.647 . 0 0 "[ . 1 . 2]" 1
5 1 2 TYR H 1 2 TYR QD 4.300 . 4.300 4.201 4.153 4.309 0.009 8 0 "[ . 1 . 2]" 1
6 1 2 TYR HA 1 2 TYR QD 3.400 . 3.400 2.702 2.512 2.850 . 0 0 "[ . 1 . 2]" 1
7 1 2 TYR HA 1 3 ARG H 2.710 . 2.710 2.263 2.217 2.350 . 0 0 "[ . 1 . 2]" 1
8 1 2 TYR HB2 1 3 ARG H 4.160 . 4.160 4.026 3.983 4.076 . 0 0 "[ . 1 . 2]" 1
9 1 2 TYR HB3 1 3 ARG H 4.160 . 4.160 3.971 3.712 4.123 . 0 0 "[ . 1 . 2]" 1
10 1 2 TYR QD 1 3 ARG H 4.130 . 4.130 3.140 3.026 3.250 . 0 0 "[ . 1 . 2]" 1
11 1 2 TYR QE 1 3 ARG H 4.710 . 4.710 3.996 3.870 4.157 . 0 0 "[ . 1 . 2]" 1
12 1 2 TYR QE 1 4 PRO HB2 5.500 . 5.500 4.826 4.379 5.357 . 0 0 "[ . 1 . 2]" 1
13 1 2 TYR QE 1 4 PRO HB3 4.570 . 4.570 3.512 2.718 4.117 . 0 0 "[ . 1 . 2]" 1
14 1 3 ARG H 1 3 ARG HB2 3.870 . 3.870 2.725 2.585 3.888 0.018 19 0 "[ . 1 . 2]" 1
15 1 3 ARG H 1 3 ARG QB 3.200 . 3.200 2.636 2.538 3.092 . 0 0 "[ . 1 . 2]" 1
16 1 3 ARG H 1 3 ARG HB3 3.870 . 3.870 3.744 3.247 3.830 . 0 0 "[ . 1 . 2]" 1
17 1 3 ARG H 1 3 ARG QG 3.590 . 3.590 3.254 2.384 3.598 0.008 12 0 "[ . 1 . 2]" 1
18 1 3 ARG H 1 4 PRO HD2 4.900 . 4.900 4.910 4.900 4.918 0.018 16 0 "[ . 1 . 2]" 1
19 1 3 ARG H 1 4 PRO HD3 5.090 . 5.090 4.969 4.756 5.099 0.009 15 0 "[ . 1 . 2]" 1
20 1 3 ARG HA 1 3 ARG QD 4.200 . 4.200 4.064 3.930 4.246 0.046 19 0 "[ . 1 . 2]" 1
21 1 3 ARG HA 1 3 ARG QG 3.430 . 3.430 2.485 2.196 3.349 . 0 0 "[ . 1 . 2]" 1
22 1 3 ARG HA 1 4 PRO HD2 3.010 . 3.010 2.447 2.328 2.617 . 0 0 "[ . 1 . 2]" 1
23 1 3 ARG HA 1 4 PRO HD3 2.920 . 2.920 2.590 2.428 2.721 . 0 0 "[ . 1 . 2]" 1
24 1 3 ARG QB 1 4 PRO HD2 3.510 . 3.510 2.508 2.328 2.692 . 0 0 "[ . 1 . 2]" 1
25 1 3 ARG QB 1 4 PRO HD3 3.860 . 3.860 3.802 3.583 3.885 0.025 6 0 "[ . 1 . 2]" 1
26 1 3 ARG QB 1 5 SER H 4.430 . 4.430 2.506 2.047 3.431 . 0 0 "[ . 1 . 2]" 1
27 1 3 ARG HB2 1 4 PRO HD2 4.180 . 4.180 3.952 2.353 4.189 0.009 17 0 "[ . 1 . 2]" 1
28 1 3 ARG HB3 1 4 PRO HD2 4.180 . 4.180 2.609 2.346 3.856 . 0 0 "[ . 1 . 2]" 1
29 1 3 ARG QG 1 4 PRO HD2 4.100 . 4.100 3.465 3.037 3.982 . 0 0 "[ . 1 . 2]" 1
30 1 3 ARG QG 1 4 PRO HD3 4.780 . 4.780 4.388 3.882 4.785 0.005 6 0 "[ . 1 . 2]" 1
31 1 3 ARG QG 1 5 SER H 4.580 . 4.580 4.434 2.693 4.607 0.027 11 0 "[ . 1 . 2]" 1
32 1 4 PRO HB2 1 5 SER H 3.690 . 3.690 3.591 3.458 3.701 0.011 7 0 "[ . 1 . 2]" 1
33 1 4 PRO HB3 1 5 SER H 4.250 . 4.250 4.249 4.210 4.271 0.021 12 0 "[ . 1 . 2]" 1
34 1 4 PRO HD2 1 5 SER H 4.220 . 4.220 2.742 2.545 2.992 . 0 0 "[ . 1 . 2]" 1
35 1 4 PRO HD3 1 5 SER H 5.030 . 5.030 3.893 3.760 4.089 . 0 0 "[ . 1 . 2]" 1
36 1 5 SER H 1 5 SER QB 3.270 . 3.270 3.047 2.492 3.333 0.063 11 0 "[ . 1 . 2]" 1
37 1 5 SER H 1 6 GLU H 4.010 . 4.010 3.183 2.790 3.871 . 0 0 "[ . 1 . 2]" 1
38 1 5 SER HA 1 6 GLU H 2.880 . 2.880 2.561 2.251 2.900 0.020 4 0 "[ . 1 . 2]" 1
39 1 5 SER QB 1 6 GLU H 3.970 . 3.970 3.903 3.730 4.015 0.045 7 0 "[ . 1 . 2]" 1
40 1 6 GLU H 1 6 GLU HB2 3.700 . 3.700 3.398 2.348 3.715 0.015 17 0 "[ . 1 . 2]" 1
41 1 6 GLU H 1 6 GLU QB 2.960 . 2.960 2.578 2.319 2.957 . 0 0 "[ . 1 . 2]" 1
42 1 6 GLU H 1 6 GLU HB3 3.700 . 3.700 2.863 2.489 3.645 . 0 0 "[ . 1 . 2]" 1
43 1 6 GLU H 1 6 GLU QG 3.370 . 3.370 2.231 1.975 2.685 . 0 0 "[ . 1 . 2]" 1
44 1 6 GLU H 1 7 THR H 3.300 . 3.300 2.620 2.085 3.112 . 0 0 "[ . 1 . 2]" 1
45 1 6 GLU H 1 7 THR MG 4.180 . 4.180 4.028 3.374 4.248 0.068 12 0 "[ . 1 . 2]" 1
46 1 6 GLU HA 1 6 GLU QG 3.440 . 3.440 3.252 2.423 3.478 0.038 11 0 "[ . 1 . 2]" 1
47 1 6 GLU HA 1 7 THR H 3.410 . 3.410 3.208 2.984 3.363 . 0 0 "[ . 1 . 2]" 1
48 1 6 GLU QB 1 7 THR H 4.140 . 4.140 3.837 3.376 4.052 . 0 0 "[ . 1 . 2]" 1
49 1 6 GLU QB 1 7 THR MG 5.010 . 5.010 3.683 2.873 4.257 . 0 0 "[ . 1 . 2]" 1
50 1 6 GLU QB 1 52 SER QB 4.750 . 4.750 3.327 2.068 4.683 . 0 0 "[ . 1 . 2]" 1
51 1 6 GLU HB2 1 6 GLU QG 2.800 . 2.800 2.294 2.149 2.507 . 0 0 "[ . 1 . 2]" 1
52 1 6 GLU HB2 1 7 THR H 4.760 . 4.760 4.253 3.512 4.501 . 0 0 "[ . 1 . 2]" 1
53 1 6 GLU HB3 1 6 GLU QG 2.800 . 2.800 2.409 2.162 2.559 . 0 0 "[ . 1 . 2]" 1
54 1 6 GLU HB3 1 7 THR H 4.760 . 4.760 4.395 4.160 4.598 . 0 0 "[ . 1 . 2]" 1
55 1 6 GLU QG 1 7 THR H 4.530 . 4.530 3.405 2.690 4.565 0.035 8 0 "[ . 1 . 2]" 1
56 1 6 GLU QG 1 52 SER QB 4.520 . 4.520 3.170 2.321 4.285 . 0 0 "[ . 1 . 2]" 1
57 1 7 THR H 1 7 THR MG 3.500 . 3.500 3.105 2.867 3.253 . 0 0 "[ . 1 . 2]" 1
58 1 7 THR H 1 8 LEU H 4.780 . 4.780 4.370 4.299 4.483 . 0 0 "[ . 1 . 2]" 1
59 1 7 THR HA 1 7 THR MG 2.700 . 2.700 2.316 2.280 2.395 . 0 0 "[ . 1 . 2]" 1
60 1 7 THR HA 1 8 LEU HB2 4.930 . 4.930 4.445 4.155 4.546 . 0 0 "[ . 1 . 2]" 1
61 1 7 THR HA 1 8 LEU QD 4.620 . 4.620 4.058 2.768 4.385 . 0 0 "[ . 1 . 2]" 1
62 1 7 THR HA 1 8 LEU HG 5.500 . 5.500 4.062 3.644 5.569 0.069 16 0 "[ . 1 . 2]" 1
63 1 7 THR HA 1 13 LEU MD1 5.500 . 5.500 5.395 4.882 5.540 0.040 17 0 "[ . 1 . 2]" 1
64 1 7 THR HB 1 8 LEU H 3.920 . 3.920 2.803 2.608 2.978 . 0 0 "[ . 1 . 2]" 1
65 1 7 THR HB 1 8 LEU HB2 5.500 . 5.500 5.395 5.161 5.507 0.007 5 0 "[ . 1 . 2]" 1
66 1 7 THR MG 1 8 LEU H 3.620 . 3.620 3.654 3.607 3.691 0.071 19 0 "[ . 1 . 2]" 1
67 1 7 THR MG 1 49 CYS HA 6.000 . 6.000 3.819 3.499 4.281 . 0 0 "[ . 1 . 2]" 1
68 1 7 THR MG 1 51 ARG H 5.100 . 5.100 4.207 3.967 4.611 . 0 0 "[ . 1 . 2]" 1
69 1 7 THR MG 1 52 SER H 4.490 . 4.490 4.034 3.791 4.208 . 0 0 "[ . 1 . 2]" 1
70 1 7 THR MG 1 52 SER HA 3.510 . 3.510 2.193 1.917 2.430 . 0 0 "[ . 1 . 2]" 1
71 1 7 THR MG 1 52 SER QB 3.450 . 3.450 2.893 2.589 3.432 . 0 0 "[ . 1 . 2]" 1
72 1 7 THR MG 1 53 CYS H 4.340 . 4.340 3.727 2.775 4.179 . 0 0 "[ . 1 . 2]" 1
73 1 8 LEU H 1 8 LEU HB2 3.900 . 3.900 2.674 2.581 2.730 . 0 0 "[ . 1 . 2]" 1
74 1 8 LEU H 1 8 LEU HB3 3.970 . 3.970 3.809 3.711 3.851 . 0 0 "[ . 1 . 2]" 1
75 1 8 LEU H 1 8 LEU MD1 5.030 . 5.030 4.058 3.746 4.156 . 0 0 "[ . 1 . 2]" 1
76 1 8 LEU H 1 8 LEU QD 4.080 . 4.080 3.472 2.721 3.638 . 0 0 "[ . 1 . 2]" 1
77 1 8 LEU H 1 8 LEU MD2 5.030 . 5.030 3.810 2.794 4.046 . 0 0 "[ . 1 . 2]" 1
78 1 8 LEU H 1 8 LEU HG 4.530 . 4.530 3.354 3.070 4.551 0.021 10 0 "[ . 1 . 2]" 1
79 1 8 LEU H 1 9 CYS H 4.790 . 4.790 4.353 4.301 4.395 . 0 0 "[ . 1 . 2]" 1
80 1 8 LEU H 1 13 LEU MD1 4.510 . 4.510 4.015 3.776 4.119 . 0 0 "[ . 1 . 2]" 1
81 1 8 LEU H 1 13 LEU MD2 5.400 . 5.400 4.269 4.168 4.441 . 0 0 "[ . 1 . 2]" 1
82 1 8 LEU H 1 49 CYS HA 6.000 . 6.000 3.231 3.008 3.608 . 0 0 "[ . 1 . 2]" 1
83 1 8 LEU HA 1 8 LEU MD1 3.870 . 3.870 3.634 2.188 3.909 0.039 4 0 "[ . 1 . 2]" 1
84 1 8 LEU HA 1 8 LEU QD 3.040 . 3.040 2.103 2.031 2.193 . 0 0 "[ . 1 . 2]" 1
85 1 8 LEU HA 1 8 LEU MD2 3.870 . 3.870 2.295 2.038 3.413 . 0 0 "[ . 1 . 2]" 1
86 1 8 LEU HA 1 13 LEU MD1 5.180 . 5.180 4.602 4.513 4.725 . 0 0 "[ . 1 . 2]" 1
87 1 8 LEU HB2 1 8 LEU MD1 3.350 . 3.350 2.406 2.240 3.205 . 0 0 "[ . 1 . 2]" 1
88 1 8 LEU HB2 1 8 LEU QD 2.910 . 2.910 2.205 2.100 2.267 . 0 0 "[ . 1 . 2]" 1
89 1 8 LEU HB2 1 8 LEU MD2 3.350 . 3.350 3.044 2.129 3.216 . 0 0 "[ . 1 . 2]" 1
90 1 8 LEU HB2 1 9 CYS H 4.400 . 4.400 3.794 3.703 3.898 . 0 0 "[ . 1 . 2]" 1
91 1 8 LEU HB2 1 13 LEU HA 4.450 . 4.450 3.031 2.739 3.206 . 0 0 "[ . 1 . 2]" 1
92 1 8 LEU HB2 1 13 LEU MD1 3.690 . 3.690 1.913 1.860 2.029 . 0 0 "[ . 1 . 2]" 1
93 1 8 LEU HB2 1 16 THR HG1 5.500 . 5.500 5.239 4.690 5.501 0.001 17 0 "[ . 1 . 2]" 1
94 1 8 LEU HB2 1 17 LEU QD 5.440 . 5.440 5.463 4.910 5.550 0.110 7 0 "[ . 1 . 2]" 1
95 1 8 LEU HB2 1 48 CYS HA 5.500 . 5.500 4.993 4.704 5.307 . 0 0 "[ . 1 . 2]" 1
96 1 8 LEU HB2 1 48 CYS HB2 4.430 . 4.430 3.543 3.187 4.155 . 0 0 "[ . 1 . 2]" 1
97 1 8 LEU HB2 1 48 CYS QB 3.810 . 3.810 2.554 2.262 2.823 . 0 0 "[ . 1 . 2]" 1
98 1 8 LEU HB2 1 48 CYS HB3 4.430 . 4.430 2.625 2.309 2.966 . 0 0 "[ . 1 . 2]" 1
99 1 8 LEU HB3 1 8 LEU MD1 3.160 . 3.160 2.413 2.364 2.551 . 0 0 "[ . 1 . 2]" 1
100 1 8 LEU HB3 1 8 LEU MD2 3.160 . 3.160 2.488 2.364 3.063 . 0 0 "[ . 1 . 2]" 1
101 1 8 LEU HB3 1 9 CYS H 4.340 . 4.340 2.709 2.553 2.837 . 0 0 "[ . 1 . 2]" 1
102 1 8 LEU HB3 1 9 CYS QB 5.320 . 5.320 4.895 4.776 5.113 . 0 0 "[ . 1 . 2]" 1
103 1 8 LEU HB3 1 12 GLU QB 4.760 . 4.760 2.699 2.369 3.114 . 0 0 "[ . 1 . 2]" 1
104 1 8 LEU HB3 1 13 LEU HA 4.560 . 4.560 2.377 2.235 2.471 . 0 0 "[ . 1 . 2]" 1
105 1 8 LEU HB3 1 13 LEU MD1 3.960 . 3.960 2.868 2.639 3.141 . 0 0 "[ . 1 . 2]" 1
106 1 8 LEU HB3 1 16 THR HG1 5.130 . 5.130 4.362 4.156 4.594 . 0 0 "[ . 1 . 2]" 1
107 1 8 LEU HB3 1 48 CYS QB 4.570 . 4.570 4.112 3.843 4.319 . 0 0 "[ . 1 . 2]" 1
108 1 8 LEU QD 1 9 CYS H 3.200 . 3.200 3.352 3.248 3.429 0.229 4 0 "[ . 1 . 2]" 1
109 1 8 LEU QD 1 9 CYS HA 5.440 . 5.440 4.998 4.888 5.108 . 0 0 "[ . 1 . 2]" 1
110 1 8 LEU QD 1 9 CYS QB 4.850 . 4.850 4.988 4.897 5.086 0.236 17 0 "[ . 1 . 2]" 1
111 1 8 LEU QD 1 12 GLU H 4.720 . 4.720 4.657 4.518 4.724 0.004 12 0 "[ . 1 . 2]" 1
112 1 8 LEU QD 1 12 GLU HA 4.290 . 4.290 3.746 3.630 3.894 . 0 0 "[ . 1 . 2]" 1
113 1 8 LEU QD 1 12 GLU QB 2.840 . 2.840 2.078 1.933 2.178 . 0 0 "[ . 1 . 2]" 1
114 1 8 LEU QD 1 12 GLU QG 3.710 . 3.710 3.699 3.432 3.782 0.072 4 0 "[ . 1 . 2]" 1
115 1 8 LEU QD 1 13 LEU H 3.840 . 3.840 3.676 3.515 3.947 0.107 2 0 "[ . 1 . 2]" 1
116 1 8 LEU QD 1 13 LEU HA 3.060 . 3.060 2.063 1.882 2.926 . 0 0 "[ . 1 . 2]" 1
117 1 8 LEU QD 1 14 VAL H 5.220 . 5.220 4.753 4.598 5.245 0.025 10 0 "[ . 1 . 2]" 1
118 1 8 LEU QD 1 16 THR H 3.740 . 3.740 3.446 3.308 3.843 0.103 16 0 "[ . 1 . 2]" 1
119 1 8 LEU QD 1 16 THR HA 5.130 . 5.130 4.222 4.162 4.347 . 0 0 "[ . 1 . 2]" 1
120 1 8 LEU QD 1 16 THR HB 3.350 . 3.350 2.379 2.240 2.886 . 0 0 "[ . 1 . 2]" 1
121 1 8 LEU QD 1 16 THR HG1 3.150 . 3.150 2.295 2.051 2.539 . 0 0 "[ . 1 . 2]" 1
122 1 8 LEU QD 1 16 THR MG 2.790 . 2.790 2.255 2.181 2.334 . 0 0 "[ . 1 . 2]" 1
123 1 8 LEU QD 1 17 LEU H 4.590 . 4.590 4.309 4.167 4.814 0.224 16 0 "[ . 1 . 2]" 1
124 1 8 LEU QD 1 48 CYS QB 4.420 . 4.420 3.171 2.748 3.586 . 0 0 "[ . 1 . 2]" 1
125 1 8 LEU MD1 1 9 CYS H 4.600 . 4.600 4.458 3.305 4.703 0.103 11 0 "[ . 1 . 2]" 1
126 1 8 LEU MD1 1 13 LEU H 4.970 . 4.970 4.096 3.965 4.237 . 0 0 "[ . 1 . 2]" 1
127 1 8 LEU MD1 1 13 LEU HA 3.590 . 3.590 2.179 1.891 3.635 0.045 16 0 "[ . 1 . 2]" 1
128 1 8 LEU MD1 1 16 THR H 4.320 . 4.320 3.617 3.426 4.221 . 0 0 "[ . 1 . 2]" 1
129 1 8 LEU MD1 1 16 THR HB 4.110 . 4.110 2.565 2.251 4.105 . 0 0 "[ . 1 . 2]" 1
130 1 8 LEU MD1 1 16 THR HG1 3.610 . 3.610 2.401 2.107 2.701 . 0 0 "[ . 1 . 2]" 1
131 1 8 LEU MD2 1 9 CYS H 4.600 . 4.600 3.654 3.377 4.789 0.189 16 0 "[ . 1 . 2]" 1
132 1 8 LEU MD2 1 13 LEU H 4.970 . 4.970 4.205 3.890 5.045 0.075 16 0 "[ . 1 . 2]" 1
133 1 8 LEU MD2 1 13 LEU HA 3.590 . 3.590 3.305 3.054 3.458 . 0 0 "[ . 1 . 2]" 1
134 1 8 LEU MD2 1 16 THR H 4.320 . 4.320 4.377 4.338 4.423 0.103 16 0 "[ . 1 . 2]" 1
135 1 8 LEU MD2 1 16 THR HB 4.110 . 4.110 3.900 2.912 4.122 0.012 9 0 "[ . 1 . 2]" 1
136 1 8 LEU MD2 1 16 THR HG1 3.610 . 3.610 2.924 2.776 3.088 . 0 0 "[ . 1 . 2]" 1
137 1 8 LEU HG 1 9 CYS H 4.870 . 4.870 4.840 4.530 4.902 0.032 4 0 "[ . 1 . 2]" 1
138 1 8 LEU HG 1 13 LEU HA 4.290 . 4.290 3.978 2.079 4.319 0.029 9 0 "[ . 1 . 2]" 1
139 1 8 LEU HG 1 13 LEU QB 5.340 . 5.340 4.681 3.696 4.909 . 0 0 "[ . 1 . 2]" 1
140 1 8 LEU HG 1 13 LEU MD1 3.310 . 3.310 3.477 3.072 3.586 0.276 11 0 "[ . 1 . 2]" 1
141 1 9 CYS CB 1 49 CYS SG 3.100 . 3.100 3.061 3.039 3.087 . 0 0 "[ . 1 . 2]" 1
142 1 9 CYS H 1 9 CYS HB2 3.940 . 3.940 2.864 2.596 3.117 . 0 0 "[ . 1 . 2]" 1
143 1 9 CYS H 1 9 CYS QB 3.410 . 3.410 2.729 2.554 2.888 . 0 0 "[ . 1 . 2]" 1
144 1 9 CYS H 1 9 CYS HB3 3.940 . 3.940 3.564 3.170 3.875 . 0 0 "[ . 1 . 2]" 1
145 1 9 CYS H 1 10 GLY H 4.930 . 4.930 4.407 4.310 4.463 . 0 0 "[ . 1 . 2]" 1
146 1 9 CYS H 1 12 GLU H 5.360 . 5.360 3.904 3.602 4.079 . 0 0 "[ . 1 . 2]" 1
147 1 9 CYS H 1 12 GLU HB2 4.890 . 4.890 2.221 2.000 2.609 . 0 0 "[ . 1 . 2]" 1
148 1 9 CYS H 1 12 GLU QB 4.160 . 4.160 2.203 1.988 2.587 . 0 0 "[ . 1 . 2]" 1
149 1 9 CYS H 1 12 GLU HB3 4.890 . 4.890 3.685 3.429 4.266 . 0 0 "[ . 1 . 2]" 1
150 1 9 CYS H 1 12 GLU HG2 5.100 . 5.100 4.545 3.896 5.101 0.001 7 0 "[ . 1 . 2]" 1
151 1 9 CYS H 1 12 GLU HG3 5.100 . 5.100 3.918 3.657 4.404 . 0 0 "[ . 1 . 2]" 1
152 1 9 CYS H 1 13 LEU QB 4.980 . 4.980 3.432 3.172 3.646 . 0 0 "[ . 1 . 2]" 1
153 1 9 CYS H 1 13 LEU MD1 4.970 . 4.970 4.883 4.689 5.006 0.036 16 0 "[ . 1 . 2]" 1
154 1 9 CYS H 1 13 LEU MD2 4.940 . 4.940 4.557 4.340 4.776 . 0 0 "[ . 1 . 2]" 1
155 1 9 CYS HA 1 13 LEU QB 4.670 . 4.670 2.940 2.638 3.239 . 0 0 "[ . 1 . 2]" 1
156 1 9 CYS HA 1 13 LEU MD1 5.290 . 5.290 4.691 4.433 4.896 . 0 0 "[ . 1 . 2]" 1
157 1 9 CYS HA 1 13 LEU MD2 4.200 . 4.200 3.050 2.803 3.265 . 0 0 "[ . 1 . 2]" 1
158 1 9 CYS HA 1 45 VAL QG 4.750 . 4.750 3.614 3.197 4.281 . 0 0 "[ . 1 . 2]" 1
159 1 9 CYS HA 1 49 CYS HB2 4.480 . 4.480 2.715 2.272 3.365 . 0 0 "[ . 1 . 2]" 1
160 1 9 CYS HA 1 49 CYS HB3 4.970 . 4.970 4.274 3.838 4.922 . 0 0 "[ . 1 . 2]" 1
161 1 9 CYS QB 1 10 GLY H 3.960 . 3.960 2.690 1.844 3.190 . 0 0 "[ . 1 . 2]" 1
162 1 9 CYS HB2 1 10 GLY H 4.720 . 4.720 3.833 3.065 4.175 . 0 0 "[ . 1 . 2]" 1
163 1 9 CYS HB3 1 10 GLY H 4.720 . 4.720 2.756 1.858 3.310 . 0 0 "[ . 1 . 2]" 1
164 1 9 CYS SG 1 49 CYS CB 3.100 . 3.100 3.073 3.051 3.101 0.001 20 0 "[ . 1 . 2]" 1
165 1 9 CYS SG 1 49 CYS SG 2.100 . 2.100 2.036 2.033 2.041 . 0 0 "[ . 1 . 2]" 1
166 1 10 GLY H 1 13 LEU MD2 4.840 . 4.840 4.243 3.832 4.897 0.057 15 0 "[ . 1 . 2]" 1
167 1 10 GLY H 1 45 VAL QG 5.090 . 5.090 3.963 3.505 4.796 . 0 0 "[ . 1 . 2]" 1
168 1 10 GLY QA 1 12 GLU H 4.290 . 4.290 3.618 3.406 4.168 . 0 0 "[ . 1 . 2]" 1
169 1 10 GLY HA2 1 11 GLY H 3.400 . 3.400 2.885 2.119 3.448 0.048 18 0 "[ . 1 . 2]" 1
170 1 10 GLY HA3 1 11 GLY H 3.400 . 3.400 2.492 2.120 3.436 0.036 15 0 "[ . 1 . 2]" 1
171 1 11 GLY H 1 12 GLU H 3.740 . 3.740 2.927 1.640 3.689 . 0 0 "[ . 1 . 2]" 1
172 1 11 GLY H 1 14 VAL MG2 5.370 . 5.370 4.111 2.480 4.837 . 0 0 "[ . 1 . 2]" 1
173 1 11 GLY HA2 1 14 VAL HB 4.010 . 4.010 2.515 2.252 3.003 . 0 0 "[ . 1 . 2]" 1
174 1 11 GLY HA2 1 14 VAL MG1 4.870 . 4.870 3.892 3.702 4.388 . 0 0 "[ . 1 . 2]" 1
175 1 11 GLY HA2 1 14 VAL MG2 3.680 . 3.680 2.928 2.580 3.482 . 0 0 "[ . 1 . 2]" 1
176 1 11 GLY HA2 1 15 ASP H 4.820 . 4.820 3.998 3.760 4.369 . 0 0 "[ . 1 . 2]" 1
177 1 11 GLY HA3 1 14 VAL HB 5.430 . 5.430 3.949 3.692 4.409 . 0 0 "[ . 1 . 2]" 1
178 1 11 GLY HA3 1 14 VAL MG1 5.500 . 5.500 5.033 4.793 5.508 0.008 19 0 "[ . 1 . 2]" 1
179 1 11 GLY HA3 1 14 VAL MG2 4.940 . 4.940 4.344 4.030 4.727 . 0 0 "[ . 1 . 2]" 1
180 1 12 GLU H 1 12 GLU HB2 3.810 . 3.810 2.575 2.450 2.911 . 0 0 "[ . 1 . 2]" 1
181 1 12 GLU H 1 12 GLU QB 3.230 . 3.230 2.521 2.413 2.796 . 0 0 "[ . 1 . 2]" 1
182 1 12 GLU H 1 12 GLU HB3 3.810 . 3.810 3.611 3.566 3.642 . 0 0 "[ . 1 . 2]" 1
183 1 12 GLU H 1 12 GLU HG2 3.920 . 3.920 3.132 2.125 3.582 . 0 0 "[ . 1 . 2]" 1
184 1 12 GLU H 1 12 GLU QG 3.400 . 3.400 2.107 1.854 2.376 . 0 0 "[ . 1 . 2]" 1
185 1 12 GLU H 1 12 GLU HG3 3.920 . 3.920 2.472 1.865 3.681 . 0 0 "[ . 1 . 2]" 1
186 1 12 GLU H 1 13 LEU H 3.570 . 3.570 2.563 2.493 2.713 . 0 0 "[ . 1 . 2]" 1
187 1 12 GLU H 1 13 LEU QB 5.340 . 5.340 4.278 4.151 4.401 . 0 0 "[ . 1 . 2]" 1
188 1 12 GLU HA 1 12 GLU HG2 3.880 . 3.880 2.912 2.608 3.659 . 0 0 "[ . 1 . 2]" 1
189 1 12 GLU HA 1 12 GLU HG3 3.880 . 3.880 3.276 2.841 3.811 . 0 0 "[ . 1 . 2]" 1
190 1 12 GLU HA 1 15 ASP H 4.320 . 4.320 3.450 3.200 3.646 . 0 0 "[ . 1 . 2]" 1
191 1 12 GLU HA 1 15 ASP HB2 4.390 . 4.390 3.373 2.789 3.751 . 0 0 "[ . 1 . 2]" 1
192 1 12 GLU HA 1 15 ASP HB3 4.390 . 4.390 3.040 2.610 4.406 0.016 20 0 "[ . 1 . 2]" 1
193 1 12 GLU QB 1 13 LEU H 3.630 . 3.630 2.528 2.289 2.750 . 0 0 "[ . 1 . 2]" 1
194 1 12 GLU HB2 1 13 LEU H 4.220 . 4.220 2.572 2.316 2.807 . 0 0 "[ . 1 . 2]" 1
195 1 12 GLU HB3 1 13 LEU H 4.220 . 4.220 3.737 3.584 3.967 . 0 0 "[ . 1 . 2]" 1
196 1 12 GLU QG 1 13 LEU H 4.450 . 4.450 3.948 3.791 4.140 . 0 0 "[ . 1 . 2]" 1
197 1 13 LEU H 1 13 LEU HB2 3.740 . 3.740 2.421 2.309 2.500 . 0 0 "[ . 1 . 2]" 1
198 1 13 LEU H 1 13 LEU HB3 3.740 . 3.740 2.524 2.499 2.565 . 0 0 "[ . 1 . 2]" 1
199 1 13 LEU H 1 13 LEU MD1 4.230 . 4.230 4.133 4.072 4.186 . 0 0 "[ . 1 . 2]" 1
200 1 13 LEU H 1 13 LEU MD2 4.200 . 4.200 4.128 3.999 4.204 0.004 12 0 "[ . 1 . 2]" 1
201 1 13 LEU H 1 13 LEU HG 4.750 . 4.750 4.546 4.525 4.571 . 0 0 "[ . 1 . 2]" 1
202 1 13 LEU H 1 14 VAL H 3.680 . 3.680 2.550 2.444 2.690 . 0 0 "[ . 1 . 2]" 1
203 1 13 LEU H 1 14 VAL MG2 4.550 . 4.550 4.151 3.957 4.379 . 0 0 "[ . 1 . 2]" 1
204 1 13 LEU H 1 15 ASP H 4.850 . 4.850 4.077 3.957 4.179 . 0 0 "[ . 1 . 2]" 1
205 1 13 LEU HA 1 13 LEU MD1 3.010 . 3.010 2.124 2.103 2.162 . 0 0 "[ . 1 . 2]" 1
206 1 13 LEU HA 1 13 LEU MD2 3.960 . 3.960 3.745 3.724 3.770 . 0 0 "[ . 1 . 2]" 1
207 1 13 LEU HA 1 13 LEU HG 4.100 . 4.100 3.361 3.310 3.412 . 0 0 "[ . 1 . 2]" 1
208 1 13 LEU HA 1 16 THR H 4.930 . 4.930 3.464 3.283 3.555 . 0 0 "[ . 1 . 2]" 1
209 1 13 LEU HA 1 16 THR HB 4.840 . 4.840 3.007 2.894 3.143 . 0 0 "[ . 1 . 2]" 1
210 1 13 LEU HA 1 16 THR HG1 4.910 . 4.910 3.284 3.087 3.554 . 0 0 "[ . 1 . 2]" 1
211 1 13 LEU HA 1 16 THR MG 4.750 . 4.750 4.359 4.251 4.499 . 0 0 "[ . 1 . 2]" 1
212 1 13 LEU HA 1 17 LEU QD 4.490 . 4.490 3.980 3.451 4.060 . 0 0 "[ . 1 . 2]" 1
213 1 13 LEU HA 1 58 LEU QD 4.410 . 4.410 3.526 3.365 3.693 . 0 0 "[ . 1 . 2]" 1
214 1 13 LEU QB 1 14 VAL H 3.740 . 3.740 2.559 2.519 2.635 . 0 0 "[ . 1 . 2]" 1
215 1 13 LEU QB 1 14 VAL MG2 5.340 . 5.340 3.233 3.139 3.322 . 0 0 "[ . 1 . 2]" 1
216 1 13 LEU QB 1 15 ASP H 5.340 . 5.340 4.772 4.681 4.837 . 0 0 "[ . 1 . 2]" 1
217 1 13 LEU QB 1 44 ILE HG12 5.340 . 5.340 5.178 5.001 5.346 0.006 18 0 "[ . 1 . 2]" 1
218 1 13 LEU QB 1 44 ILE MG 4.750 . 4.750 4.171 4.005 4.384 . 0 0 "[ . 1 . 2]" 1
219 1 13 LEU HB2 1 13 LEU MD1 3.560 . 3.560 2.594 2.564 2.625 . 0 0 "[ . 1 . 2]" 1
220 1 13 LEU HB2 1 13 LEU MD2 3.190 . 3.190 2.181 2.132 2.233 . 0 0 "[ . 1 . 2]" 1
221 1 13 LEU HB2 1 14 VAL H 4.420 . 4.420 3.803 3.771 3.836 . 0 0 "[ . 1 . 2]" 1
222 1 13 LEU HB3 1 13 LEU MD1 3.560 . 3.560 3.248 3.230 3.268 . 0 0 "[ . 1 . 2]" 1
223 1 13 LEU HB3 1 13 LEU MD2 3.190 . 3.190 2.430 2.394 2.471 . 0 0 "[ . 1 . 2]" 1
224 1 13 LEU HB3 1 14 VAL H 4.420 . 4.420 2.601 2.557 2.684 . 0 0 "[ . 1 . 2]" 1
225 1 13 LEU MD1 1 14 VAL H 4.540 . 4.540 4.461 4.396 4.516 . 0 0 "[ . 1 . 2]" 1
226 1 13 LEU MD1 1 14 VAL HA 4.860 . 4.860 4.728 4.599 4.790 . 0 0 "[ . 1 . 2]" 1
227 1 13 LEU MD1 1 14 VAL MG2 5.120 . 5.120 5.004 4.862 5.067 . 0 0 "[ . 1 . 2]" 1
228 1 13 LEU MD1 1 16 THR H 4.640 . 4.640 4.423 4.288 4.558 . 0 0 "[ . 1 . 2]" 1
229 1 13 LEU MD1 1 16 THR HB 4.100 . 4.100 3.023 2.898 3.123 . 0 0 "[ . 1 . 2]" 1
230 1 13 LEU MD1 1 16 THR HG1 4.930 . 4.930 4.290 4.127 4.502 . 0 0 "[ . 1 . 2]" 1
231 1 13 LEU MD1 1 16 THR MG 4.040 . 4.040 3.773 3.676 3.893 . 0 0 "[ . 1 . 2]" 1
232 1 13 LEU MD1 1 17 LEU H 4.160 . 4.160 3.836 3.636 3.956 . 0 0 "[ . 1 . 2]" 1
233 1 13 LEU MD1 1 17 LEU HA 5.470 . 5.470 4.912 4.801 5.087 . 0 0 "[ . 1 . 2]" 1
234 1 13 LEU MD1 1 17 LEU QD 3.030 . 3.030 2.643 2.050 2.751 . 0 0 "[ . 1 . 2]" 1
235 1 13 LEU MD1 1 17 LEU HG 3.930 . 3.930 3.043 2.882 4.060 0.130 18 0 "[ . 1 . 2]" 1
236 1 13 LEU MD1 1 28 PHE QE 4.560 . 4.560 4.420 3.937 4.587 0.027 8 0 "[ . 1 . 2]" 1
237 1 13 LEU MD1 1 28 PHE HZ 4.930 . 4.930 4.486 4.208 4.809 . 0 0 "[ . 1 . 2]" 1
238 1 13 LEU MD1 1 44 ILE MD 3.080 . 3.080 3.035 2.936 3.172 0.092 18 0 "[ . 1 . 2]" 1
239 1 13 LEU MD1 1 44 ILE HG13 3.320 . 3.320 2.332 2.258 2.433 . 0 0 "[ . 1 . 2]" 1
240 1 13 LEU MD1 1 45 VAL HA 5.150 . 5.150 4.237 4.008 4.403 . 0 0 "[ . 1 . 2]" 1
241 1 13 LEU MD1 1 47 GLU HB2 5.500 . 5.500 5.187 4.947 5.522 0.022 3 0 "[ . 1 . 2]" 1
242 1 13 LEU MD1 1 48 CYS H 4.970 . 4.970 4.437 4.270 4.615 . 0 0 "[ . 1 . 2]" 1
243 1 13 LEU MD1 1 48 CYS HA 5.290 . 5.290 4.642 4.527 4.849 . 0 0 "[ . 1 . 2]" 1
244 1 13 LEU MD1 1 48 CYS HB2 3.690 . 3.690 2.577 2.354 3.003 . 0 0 "[ . 1 . 2]" 1
245 1 13 LEU MD1 1 48 CYS HB3 3.690 . 3.690 2.628 2.489 2.766 . 0 0 "[ . 1 . 2]" 1
246 1 13 LEU MD1 1 49 CYS HB2 5.500 . 5.500 4.995 4.763 5.271 . 0 0 "[ . 1 . 2]" 1
247 1 13 LEU MD1 1 58 LEU HG 4.630 . 4.630 3.219 3.009 3.557 . 0 0 "[ . 1 . 2]" 1
248 1 13 LEU MD2 1 14 VAL H 4.730 . 4.730 4.598 4.529 4.663 . 0 0 "[ . 1 . 2]" 1
249 1 13 LEU MD2 1 14 VAL MG2 4.420 . 4.420 4.441 4.358 4.504 0.084 13 0 "[ . 1 . 2]" 1
250 1 13 LEU MD2 1 17 LEU QD 3.580 . 3.580 3.340 3.250 3.432 . 0 0 "[ . 1 . 2]" 1
251 1 13 LEU MD2 1 28 PHE QD 4.410 . 4.410 4.301 4.031 4.497 0.087 4 0 "[ . 1 . 2]" 1
252 1 13 LEU MD2 1 28 PHE QE 3.670 . 3.670 2.896 2.444 3.299 . 0 0 "[ . 1 . 2]" 1
253 1 13 LEU MD2 1 28 PHE HZ 4.640 . 4.640 2.610 2.331 2.822 . 0 0 "[ . 1 . 2]" 1
254 1 13 LEU MD2 1 44 ILE H 5.050 . 5.050 4.970 4.798 5.091 0.041 18 0 "[ . 1 . 2]" 1
255 1 13 LEU MD2 1 44 ILE MD 4.030 . 4.030 3.904 3.756 4.082 0.052 15 0 "[ . 1 . 2]" 1
256 1 13 LEU MD2 1 44 ILE MG 3.050 . 3.050 2.121 2.025 2.214 . 0 0 "[ . 1 . 2]" 1
257 1 13 LEU MD2 1 45 VAL HA 3.240 . 3.240 2.215 2.099 2.305 . 0 0 "[ . 1 . 2]" 1
258 1 13 LEU MD2 1 45 VAL HB 4.410 . 4.410 3.049 2.592 4.433 0.023 1 0 "[ . 1 . 2]" 1
259 1 13 LEU MD2 1 45 VAL QG 3.580 . 3.580 2.907 2.304 3.099 . 0 0 "[ . 1 . 2]" 1
260 1 13 LEU MD2 1 46 GLU H 4.940 . 4.940 4.863 4.785 4.960 0.020 1 0 "[ . 1 . 2]" 1
261 1 13 LEU MD2 1 48 CYS HB2 4.180 . 4.180 2.479 2.201 3.307 . 0 0 "[ . 1 . 2]" 1
262 1 13 LEU MD2 1 48 CYS QB 3.560 . 3.560 2.312 2.166 2.530 . 0 0 "[ . 1 . 2]" 1
263 1 13 LEU MD2 1 48 CYS HB3 4.180 . 4.180 3.219 2.402 3.728 . 0 0 "[ . 1 . 2]" 1
264 1 13 LEU MD2 1 49 CYS H 5.010 . 5.010 3.865 3.722 3.983 . 0 0 "[ . 1 . 2]" 1
265 1 13 LEU MD2 1 49 CYS HB2 4.200 . 4.200 3.157 3.009 3.453 . 0 0 "[ . 1 . 2]" 1
266 1 13 LEU MD2 1 49 CYS HB3 4.880 . 4.880 4.268 4.085 4.558 . 0 0 "[ . 1 . 2]" 1
267 1 13 LEU MD2 1 50 PHE H 5.500 . 5.500 5.404 5.310 5.507 0.007 9 0 "[ . 1 . 2]" 1
268 1 13 LEU HG 1 14 VAL H 4.240 . 4.240 4.075 3.983 4.180 . 0 0 "[ . 1 . 2]" 1
269 1 13 LEU HG 1 14 VAL HA 4.550 . 4.550 4.205 4.090 4.289 . 0 0 "[ . 1 . 2]" 1
270 1 13 LEU HG 1 17 LEU QD 3.270 . 3.270 2.247 2.168 2.348 . 0 0 "[ . 1 . 2]" 1
271 1 13 LEU HG 1 44 ILE MD 4.980 . 4.980 4.756 4.579 4.946 . 0 0 "[ . 1 . 2]" 1
272 1 13 LEU HG 1 44 ILE MG 4.290 . 4.290 2.876 2.734 3.141 . 0 0 "[ . 1 . 2]" 1
273 1 14 VAL H 1 14 VAL HB 3.290 . 3.290 2.407 2.352 2.451 . 0 0 "[ . 1 . 2]" 1
274 1 14 VAL H 1 14 VAL MG1 3.830 . 3.830 3.773 3.747 3.804 . 0 0 "[ . 1 . 2]" 1
275 1 14 VAL H 1 14 VAL MG2 2.770 . 2.770 2.248 2.146 2.367 . 0 0 "[ . 1 . 2]" 1
276 1 14 VAL H 1 15 ASP H 3.550 . 3.550 2.694 2.598 2.801 . 0 0 "[ . 1 . 2]" 1
277 1 14 VAL H 1 17 LEU QD 4.320 . 4.320 3.971 3.867 4.285 . 0 0 "[ . 1 . 2]" 1
278 1 14 VAL HA 1 14 VAL MG1 2.930 . 2.930 2.514 2.462 2.565 . 0 0 "[ . 1 . 2]" 1
279 1 14 VAL HA 1 14 VAL MG2 2.870 . 2.870 2.339 2.298 2.361 . 0 0 "[ . 1 . 2]" 1
280 1 14 VAL HA 1 17 LEU H 3.790 . 3.790 3.403 3.309 3.504 . 0 0 "[ . 1 . 2]" 1
281 1 14 VAL HA 1 17 LEU HA 5.500 . 5.500 5.388 5.285 5.460 . 0 0 "[ . 1 . 2]" 1
282 1 14 VAL HA 1 17 LEU HB2 4.520 . 4.520 2.521 2.433 2.589 . 0 0 "[ . 1 . 2]" 1
283 1 14 VAL HA 1 17 LEU HB3 4.570 . 4.570 4.107 3.986 4.182 . 0 0 "[ . 1 . 2]" 1
284 1 14 VAL HA 1 17 LEU QD 3.140 . 3.140 2.505 2.335 3.150 0.010 18 0 "[ . 1 . 2]" 1
285 1 14 VAL HA 1 17 LEU HG 5.110 . 5.110 4.326 3.691 4.510 . 0 0 "[ . 1 . 2]" 1
286 1 14 VAL HA 1 18 GLN H 4.750 . 4.750 4.055 3.979 4.133 . 0 0 "[ . 1 . 2]" 1
287 1 14 VAL HA 1 26 PHE QE 4.500 . 4.500 3.580 3.303 3.722 . 0 0 "[ . 1 . 2]" 1
288 1 14 VAL HA 1 26 PHE HZ 4.840 . 4.840 3.283 2.905 3.506 . 0 0 "[ . 1 . 2]" 1
289 1 14 VAL HA 1 28 PHE QE 5.100 . 5.100 2.908 2.764 3.134 . 0 0 "[ . 1 . 2]" 1
290 1 14 VAL HA 1 28 PHE HZ 4.910 . 4.910 4.383 3.795 4.865 . 0 0 "[ . 1 . 2]" 1
291 1 14 VAL HB 1 15 ASP H 3.930 . 3.930 2.614 2.561 2.682 . 0 0 "[ . 1 . 2]" 1
292 1 14 VAL HB 1 17 LEU QD 5.370 . 5.370 4.971 4.803 5.431 0.061 18 0 "[ . 1 . 2]" 1
293 1 14 VAL MG1 1 15 ASP H 3.620 . 3.620 3.277 3.177 3.397 . 0 0 "[ . 1 . 2]" 1
294 1 14 VAL MG1 1 15 ASP HA 3.910 . 3.910 3.284 3.125 3.402 . 0 0 "[ . 1 . 2]" 1
295 1 14 VAL MG1 1 15 ASP HB2 5.500 . 5.500 4.284 3.990 4.793 . 0 0 "[ . 1 . 2]" 1
296 1 14 VAL MG1 1 15 ASP QB 4.670 . 4.670 4.079 3.835 4.429 . 0 0 "[ . 1 . 2]" 1
297 1 14 VAL MG1 1 15 ASP HB3 5.500 . 5.500 5.137 4.971 5.269 . 0 0 "[ . 1 . 2]" 1
298 1 14 VAL MG1 1 16 THR H 5.110 . 5.110 5.023 4.904 5.128 0.018 2 0 "[ . 1 . 2]" 1
299 1 14 VAL MG1 1 17 LEU HB3 4.940 . 4.940 4.863 4.607 4.952 0.012 2 0 "[ . 1 . 2]" 1
300 1 14 VAL MG1 1 17 LEU QD 4.440 . 4.440 4.078 3.974 4.538 0.098 18 0 "[ . 1 . 2]" 1
301 1 14 VAL MG1 1 18 GLN H 4.250 . 4.250 3.973 3.886 4.030 . 0 0 "[ . 1 . 2]" 1
302 1 14 VAL MG1 1 18 GLN HA 5.500 . 5.500 5.206 5.030 5.325 . 0 0 "[ . 1 . 2]" 1
303 1 14 VAL MG1 1 18 GLN QB 4.510 . 4.510 3.983 3.856 4.193 . 0 0 "[ . 1 . 2]" 1
304 1 14 VAL MG1 1 18 GLN HE21 3.760 . 3.760 3.349 3.074 3.526 . 0 0 "[ . 1 . 2]" 1
305 1 14 VAL MG1 1 18 GLN QE 3.000 . 3.000 3.002 1.968 3.162 0.162 1 0 "[ . 1 . 2]" 1
306 1 14 VAL MG1 1 18 GLN HE22 3.760 . 3.760 3.465 1.991 3.810 0.050 13 0 "[ . 1 . 2]" 1
307 1 14 VAL MG1 1 18 GLN HG2 3.930 . 3.930 3.865 3.686 3.957 0.027 17 0 "[ . 1 . 2]" 1
308 1 14 VAL MG1 1 18 GLN QG 3.170 . 3.170 2.716 2.558 2.812 . 0 0 "[ . 1 . 2]" 1
309 1 14 VAL MG1 1 18 GLN HG3 3.930 . 3.930 2.775 2.608 2.878 . 0 0 "[ . 1 . 2]" 1
310 1 14 VAL MG1 1 26 PHE QD 5.100 . 5.100 4.909 4.726 5.036 . 0 0 "[ . 1 . 2]" 1
311 1 14 VAL MG1 1 26 PHE QE 3.880 . 3.880 3.197 3.017 3.278 . 0 0 "[ . 1 . 2]" 1
312 1 14 VAL MG1 1 26 PHE HZ 3.180 . 3.180 1.974 1.904 2.025 . 0 0 "[ . 1 . 2]" 1
313 1 14 VAL MG2 1 15 ASP H 4.070 . 4.070 3.944 3.883 4.033 . 0 0 "[ . 1 . 2]" 1
314 1 14 VAL MG2 1 16 THR H 5.500 . 5.500 5.525 5.476 5.560 0.060 11 0 "[ . 1 . 2]" 1
315 1 14 VAL MG2 1 17 LEU QD 3.840 . 3.840 3.415 3.227 4.029 0.189 18 0 "[ . 1 . 2]" 1
316 1 14 VAL MG2 1 26 PHE QE 4.060 . 4.060 3.108 2.806 3.393 . 0 0 "[ . 1 . 2]" 1
317 1 14 VAL MG2 1 26 PHE HZ 3.200 . 3.200 3.189 2.828 3.237 0.037 11 0 "[ . 1 . 2]" 1
318 1 14 VAL MG2 1 28 PHE QD 4.430 . 4.430 3.887 3.681 4.248 . 0 0 "[ . 1 . 2]" 1
319 1 14 VAL MG2 1 28 PHE QE 3.980 . 3.980 2.359 2.173 2.627 . 0 0 "[ . 1 . 2]" 1
320 1 14 VAL MG2 1 28 PHE HZ 3.190 . 3.190 2.780 2.555 3.129 . 0 0 "[ . 1 . 2]" 1
321 1 15 ASP H 1 15 ASP HB2 3.970 . 3.970 2.397 2.286 2.694 . 0 0 "[ . 1 . 2]" 1
322 1 15 ASP H 1 15 ASP QB 3.470 . 3.470 2.217 2.170 2.272 . 0 0 "[ . 1 . 2]" 1
323 1 15 ASP H 1 15 ASP HB3 3.970 . 3.970 2.668 2.318 3.554 . 0 0 "[ . 1 . 2]" 1
324 1 15 ASP H 1 16 THR H 3.930 . 3.930 2.777 2.710 2.860 . 0 0 "[ . 1 . 2]" 1
325 1 15 ASP H 1 16 THR HB 5.230 . 5.230 5.070 4.986 5.172 . 0 0 "[ . 1 . 2]" 1
326 1 15 ASP H 1 16 THR HG1 4.920 . 4.920 4.332 4.240 4.436 . 0 0 "[ . 1 . 2]" 1
327 1 15 ASP HA 1 18 GLN QB 4.070 . 4.070 2.691 2.412 2.972 . 0 0 "[ . 1 . 2]" 1
328 1 15 ASP HA 1 18 GLN HG2 5.290 . 5.290 4.925 4.655 5.088 . 0 0 "[ . 1 . 2]" 1
329 1 15 ASP HA 1 18 GLN QG 4.500 . 4.500 3.591 3.409 3.786 . 0 0 "[ . 1 . 2]" 1
330 1 15 ASP HA 1 18 GLN HG3 5.290 . 5.290 3.691 3.496 3.915 . 0 0 "[ . 1 . 2]" 1
331 1 15 ASP QB 1 16 THR H 3.960 . 3.960 2.532 2.361 2.719 . 0 0 "[ . 1 . 2]" 1
332 1 15 ASP HB2 1 16 THR H 4.560 . 4.560 3.764 2.699 4.018 . 0 0 "[ . 1 . 2]" 1
333 1 15 ASP HB3 1 16 THR H 4.560 . 4.560 2.611 2.386 3.463 . 0 0 "[ . 1 . 2]" 1
334 1 16 THR H 1 16 THR HB 3.750 . 3.750 2.564 2.532 2.591 . 0 0 "[ . 1 . 2]" 1
335 1 16 THR H 1 16 THR HG1 3.490 . 3.490 1.986 1.895 2.134 . 0 0 "[ . 1 . 2]" 1
336 1 16 THR H 1 16 THR MG 3.850 . 3.850 3.753 3.737 3.767 . 0 0 "[ . 1 . 2]" 1
337 1 16 THR H 1 17 LEU H 3.720 . 3.720 2.685 2.619 2.764 . 0 0 "[ . 1 . 2]" 1
338 1 16 THR H 1 17 LEU HB2 4.690 . 4.690 4.676 4.611 4.694 0.004 7 0 "[ . 1 . 2]" 1
339 1 16 THR H 1 17 LEU QD 4.870 . 4.870 4.682 4.155 4.842 . 0 0 "[ . 1 . 2]" 1
340 1 16 THR H 1 20 VAL QG 5.440 . 5.440 5.422 5.351 5.490 0.050 2 0 "[ . 1 . 2]" 1
341 1 16 THR H 1 58 LEU MD1 5.460 . 5.460 4.634 4.496 4.841 . 0 0 "[ . 1 . 2]" 1
342 1 16 THR H 1 58 LEU QD 4.540 . 4.540 4.248 4.148 4.449 . 0 0 "[ . 1 . 2]" 1
343 1 16 THR H 1 58 LEU MD2 5.460 . 5.460 4.936 4.809 5.188 . 0 0 "[ . 1 . 2]" 1
344 1 16 THR HA 1 16 THR MG 3.150 . 3.150 2.318 2.305 2.335 . 0 0 "[ . 1 . 2]" 1
345 1 16 THR HA 1 19 PHE H 4.250 . 4.250 3.126 2.964 3.239 . 0 0 "[ . 1 . 2]" 1
346 1 16 THR HA 1 19 PHE QB 4.850 . 4.850 2.475 2.299 2.644 . 0 0 "[ . 1 . 2]" 1
347 1 16 THR HA 1 19 PHE QD 4.810 . 4.810 4.342 4.159 4.527 . 0 0 "[ . 1 . 2]" 1
348 1 16 THR HA 1 20 VAL H 4.800 . 4.800 4.115 4.020 4.262 . 0 0 "[ . 1 . 2]" 1
349 1 16 THR HA 1 20 VAL QG 4.340 . 4.340 3.827 3.762 3.891 . 0 0 "[ . 1 . 2]" 1
350 1 16 THR HB 1 17 LEU H 4.040 . 4.040 2.695 2.627 2.761 . 0 0 "[ . 1 . 2]" 1
351 1 16 THR HB 1 17 LEU MD1 5.500 . 5.500 4.495 4.381 5.097 . 0 0 "[ . 1 . 2]" 1
352 1 16 THR HB 1 17 LEU QD 4.350 . 4.350 4.127 2.933 4.267 . 0 0 "[ . 1 . 2]" 1
353 1 16 THR HB 1 17 LEU MD2 5.500 . 5.500 4.974 2.951 5.176 . 0 0 "[ . 1 . 2]" 1
354 1 16 THR HB 1 20 VAL QG 4.820 . 4.820 4.303 4.217 4.429 . 0 0 "[ . 1 . 2]" 1
355 1 16 THR HB 1 58 LEU MD1 4.190 . 4.190 2.475 2.396 2.760 . 0 0 "[ . 1 . 2]" 1
356 1 16 THR HB 1 58 LEU QD 3.650 . 3.650 2.393 2.323 2.654 . 0 0 "[ . 1 . 2]" 1
357 1 16 THR HB 1 58 LEU MD2 4.190 . 4.190 3.180 3.039 3.442 . 0 0 "[ . 1 . 2]" 1
358 1 16 THR HG1 1 16 THR MG 3.450 . 3.450 3.016 2.969 3.033 . 0 0 "[ . 1 . 2]" 1
359 1 16 THR HG1 1 17 LEU H 4.600 . 4.600 4.056 3.988 4.159 . 0 0 "[ . 1 . 2]" 1
360 1 16 THR HG1 1 58 LEU MD1 5.500 . 5.500 4.251 4.125 4.550 . 0 0 "[ . 1 . 2]" 1
361 1 16 THR HG1 1 58 LEU QD 4.330 . 4.330 4.049 3.940 4.308 . 0 0 "[ . 1 . 2]" 1
362 1 16 THR HG1 1 58 LEU MD2 5.500 . 5.500 5.094 4.960 5.328 . 0 0 "[ . 1 . 2]" 1
363 1 16 THR MG 1 17 LEU H 3.640 . 3.640 3.650 3.604 3.668 0.028 9 0 "[ . 1 . 2]" 1
364 1 16 THR MG 1 17 LEU HA 4.340 . 4.340 3.746 3.706 3.787 . 0 0 "[ . 1 . 2]" 1
365 1 16 THR MG 1 17 LEU MD1 4.800 . 4.800 4.974 4.530 5.059 0.259 11 0 "[ . 1 . 2]" 1
366 1 16 THR MG 1 17 LEU MD2 4.800 . 4.800 4.562 3.428 4.672 . 0 0 "[ . 1 . 2]" 1
367 1 16 THR MG 1 19 PHE QB 4.210 . 4.210 3.196 2.988 3.327 . 0 0 "[ . 1 . 2]" 1
368 1 16 THR MG 1 19 PHE QD 4.230 . 4.230 3.885 3.548 4.173 . 0 0 "[ . 1 . 2]" 1
369 1 16 THR MG 1 20 VAL H 4.220 . 4.220 3.831 3.690 4.045 . 0 0 "[ . 1 . 2]" 1
370 1 16 THR MG 1 20 VAL HA 5.500 . 5.500 5.325 5.190 5.500 0.000 2 0 "[ . 1 . 2]" 1
371 1 16 THR MG 1 20 VAL HB 5.310 . 5.310 5.120 4.971 5.311 0.001 2 0 "[ . 1 . 2]" 1
372 1 16 THR MG 1 20 VAL QG 2.620 . 2.620 2.482 2.360 2.634 0.014 2 0 "[ . 1 . 2]" 1
373 1 16 THR MG 1 55 LEU HA 4.450 . 4.450 3.578 3.330 3.774 . 0 0 "[ . 1 . 2]" 1
374 1 16 THR MG 1 58 LEU QB 4.870 . 4.870 3.560 3.470 3.647 . 0 0 "[ . 1 . 2]" 1
375 1 16 THR MG 1 58 LEU MD1 2.910 . 2.910 2.149 2.093 2.240 . 0 0 "[ . 1 . 2]" 1
376 1 16 THR MG 1 58 LEU QD 2.480 . 2.480 1.925 1.895 1.992 . 0 0 "[ . 1 . 2]" 1
377 1 16 THR MG 1 58 LEU MD2 2.910 . 2.910 2.173 2.129 2.236 . 0 0 "[ . 1 . 2]" 1
378 1 16 THR MG 1 58 LEU HG 4.330 . 4.330 4.172 4.106 4.347 0.017 18 0 "[ . 1 . 2]" 1
379 1 17 LEU H 1 17 LEU HB2 3.660 . 3.660 2.272 2.190 2.307 . 0 0 "[ . 1 . 2]" 1
380 1 17 LEU H 1 17 LEU HB3 3.870 . 3.870 3.556 3.493 3.578 . 0 0 "[ . 1 . 2]" 1
381 1 17 LEU H 1 17 LEU MD1 4.400 . 4.400 3.225 3.129 4.040 . 0 0 "[ . 1 . 2]" 1
382 1 17 LEU H 1 17 LEU QD 3.140 . 3.140 3.035 2.342 3.140 . 20 0 "[ . 1 . 2]" 1
383 1 17 LEU H 1 17 LEU MD2 4.400 . 4.400 3.961 2.357 4.086 . 0 0 "[ . 1 . 2]" 1
384 1 17 LEU H 1 17 LEU HG 3.940 . 3.940 2.794 2.658 3.955 0.015 18 0 "[ . 1 . 2]" 1
385 1 17 LEU H 1 20 VAL H 5.430 . 5.430 4.901 4.843 4.979 . 0 0 "[ . 1 . 2]" 1
386 1 17 LEU H 1 20 VAL MG1 5.290 . 5.290 4.915 4.847 4.966 . 0 0 "[ . 1 . 2]" 1
387 1 17 LEU H 1 20 VAL QG 4.350 . 4.350 4.184 4.119 4.266 . 0 0 "[ . 1 . 2]" 1
388 1 17 LEU H 1 20 VAL MG2 5.290 . 5.290 4.533 4.414 4.673 . 0 0 "[ . 1 . 2]" 1
389 1 17 LEU H 1 58 LEU MD1 3.780 . 3.780 3.768 3.600 3.811 0.031 20 0 "[ . 1 . 2]" 1
390 1 17 LEU H 1 58 LEU QD 3.290 . 3.290 3.071 3.005 3.181 . 0 0 "[ . 1 . 2]" 1
391 1 17 LEU H 1 58 LEU MD2 3.780 . 3.780 3.256 3.151 3.421 . 0 0 "[ . 1 . 2]" 1
392 1 17 LEU HA 1 17 LEU MD1 3.890 . 3.890 3.710 2.179 3.811 . 0 0 "[ . 1 . 2]" 1
393 1 17 LEU HA 1 17 LEU QD 2.770 . 2.770 2.291 2.078 2.346 . 0 0 "[ . 1 . 2]" 1
394 1 17 LEU HA 1 17 LEU MD2 3.890 . 3.890 2.337 2.270 2.624 . 0 0 "[ . 1 . 2]" 1
395 1 17 LEU HA 1 17 LEU HG 3.730 . 3.730 2.578 2.481 3.728 . 0 0 "[ . 1 . 2]" 1
396 1 17 LEU HA 1 20 VAL H 4.410 . 4.410 3.425 3.363 3.486 . 0 0 "[ . 1 . 2]" 1
397 1 17 LEU HA 1 20 VAL HB 5.310 . 5.310 5.205 5.136 5.320 0.010 18 0 "[ . 1 . 2]" 1
398 1 17 LEU HA 1 20 VAL MG1 4.110 . 4.110 3.560 3.465 3.659 . 0 0 "[ . 1 . 2]" 1
399 1 17 LEU HA 1 20 VAL QG 3.470 . 3.470 2.178 2.116 2.293 . 0 0 "[ . 1 . 2]" 1
400 1 17 LEU HA 1 20 VAL MG2 4.110 . 4.110 2.198 2.130 2.320 . 0 0 "[ . 1 . 2]" 1
401 1 17 LEU HA 1 21 CYS H 4.700 . 4.700 4.093 3.707 4.481 . 0 0 "[ . 1 . 2]" 1
402 1 17 LEU HA 1 26 PHE HB3 5.500 . 5.500 4.933 4.626 5.219 . 0 0 "[ . 1 . 2]" 1
403 1 17 LEU HA 1 58 LEU MD1 4.220 . 4.220 3.960 3.776 4.050 . 0 0 "[ . 1 . 2]" 1
404 1 17 LEU HA 1 58 LEU QD 3.090 . 3.090 2.060 1.964 2.142 . 0 0 "[ . 1 . 2]" 1
405 1 17 LEU HA 1 58 LEU MD2 4.220 . 4.220 2.067 1.970 2.151 . 0 0 "[ . 1 . 2]" 1
406 1 17 LEU HB2 1 17 LEU QD 2.800 . 2.800 2.169 2.146 2.390 . 0 0 "[ . 1 . 2]" 1
407 1 17 LEU HB2 1 18 GLN H 3.830 . 3.830 2.831 2.779 2.906 . 0 0 "[ . 1 . 2]" 1
408 1 17 LEU HB2 1 26 PHE QD 4.610 . 4.610 3.990 3.771 4.135 . 0 0 "[ . 1 . 2]" 1
409 1 17 LEU HB2 1 26 PHE QE 4.930 . 4.930 3.551 3.369 3.691 . 0 0 "[ . 1 . 2]" 1
410 1 17 LEU HB2 1 58 LEU QD 4.540 . 4.540 3.822 3.727 3.873 . 0 0 "[ . 1 . 2]" 1
411 1 17 LEU HB3 1 17 LEU MD1 3.220 . 3.220 2.656 2.333 2.703 . 0 0 "[ . 1 . 2]" 1
412 1 17 LEU HB3 1 17 LEU MD2 3.220 . 3.220 2.300 2.234 3.175 . 0 0 "[ . 1 . 2]" 1
413 1 17 LEU HB3 1 18 GLN H 4.090 . 4.090 3.532 3.373 3.582 . 0 0 "[ . 1 . 2]" 1
414 1 17 LEU HB3 1 26 PHE HB2 5.170 . 5.170 3.502 3.198 3.809 . 0 0 "[ . 1 . 2]" 1
415 1 17 LEU HB3 1 26 PHE HB3 5.500 . 5.500 3.391 3.005 3.675 . 0 0 "[ . 1 . 2]" 1
416 1 17 LEU HB3 1 26 PHE QD 4.490 . 4.490 3.014 2.903 3.118 . 0 0 "[ . 1 . 2]" 1
417 1 17 LEU HB3 1 26 PHE QE 4.970 . 4.970 3.465 3.148 3.692 . 0 0 "[ . 1 . 2]" 1
418 1 17 LEU HB3 1 58 LEU QD 4.230 . 4.230 3.792 3.743 3.823 . 0 0 "[ . 1 . 2]" 1
419 1 17 LEU QD 1 18 GLN H 4.250 . 4.250 4.171 4.032 4.233 . 0 0 "[ . 1 . 2]" 1
420 1 17 LEU QD 1 18 GLN HA 5.440 . 5.440 5.159 5.045 5.218 . 0 0 "[ . 1 . 2]" 1
421 1 17 LEU QD 1 20 VAL H 5.430 . 5.430 4.906 4.567 5.005 . 0 0 "[ . 1 . 2]" 1
422 1 17 LEU QD 1 20 VAL HB 5.440 . 5.440 5.396 5.244 5.474 0.034 12 0 "[ . 1 . 2]" 1
423 1 17 LEU QD 1 20 VAL QG 3.180 . 3.180 2.859 2.750 2.926 . 0 0 "[ . 1 . 2]" 1
424 1 17 LEU QD 1 21 CYS H 5.440 . 5.440 4.904 4.553 5.260 . 0 0 "[ . 1 . 2]" 1
425 1 17 LEU QD 1 26 PHE HB2 3.550 . 3.550 2.343 2.186 2.536 . 0 0 "[ . 1 . 2]" 1
426 1 17 LEU QD 1 26 PHE HB3 4.160 . 4.160 3.109 2.990 3.307 . 0 0 "[ . 1 . 2]" 1
427 1 17 LEU QD 1 26 PHE QD 3.370 . 3.370 2.502 2.393 2.733 . 0 0 "[ . 1 . 2]" 1
428 1 17 LEU QD 1 26 PHE QE 3.540 . 3.540 2.824 2.640 3.541 0.001 18 0 "[ . 1 . 2]" 1
429 1 17 LEU QD 1 26 PHE HZ 4.230 . 4.230 3.935 3.767 4.361 0.131 18 0 "[ . 1 . 2]" 1
430 1 17 LEU QD 1 27 TYR H 4.360 . 4.360 3.869 3.563 4.093 . 0 0 "[ . 1 . 2]" 1
431 1 17 LEU QD 1 28 PHE HA 4.810 . 4.810 3.495 3.295 3.940 . 0 0 "[ . 1 . 2]" 1
432 1 17 LEU QD 1 28 PHE QD 3.430 . 3.430 2.765 2.216 3.487 0.057 18 0 "[ . 1 . 2]" 1
433 1 17 LEU QD 1 28 PHE QE 4.080 . 4.080 2.286 2.174 2.626 . 0 0 "[ . 1 . 2]" 1
434 1 17 LEU QD 1 28 PHE HZ 4.630 . 4.630 3.617 3.080 4.080 . 0 0 "[ . 1 . 2]" 1
435 1 17 LEU QD 1 44 ILE HB 4.690 . 4.690 3.425 3.321 3.532 . 0 0 "[ . 1 . 2]" 1
436 1 17 LEU QD 1 44 ILE HG12 3.540 . 3.540 2.231 2.092 2.455 . 0 0 "[ . 1 . 2]" 1
437 1 17 LEU QD 1 44 ILE HG13 4.540 . 4.540 3.508 3.385 3.658 . 0 0 "[ . 1 . 2]" 1
438 1 17 LEU QD 1 44 ILE MG 3.090 . 3.090 2.205 2.038 2.671 . 0 0 "[ . 1 . 2]" 1
439 1 17 LEU QD 1 48 CYS QB 5.280 . 5.280 4.826 4.394 4.949 . 0 0 "[ . 1 . 2]" 1
440 1 17 LEU QD 1 58 LEU HA 3.860 . 3.860 3.647 3.526 3.724 . 0 0 "[ . 1 . 2]" 1
441 1 17 LEU QD 1 58 LEU QB 3.900 . 3.900 3.936 3.600 3.989 0.089 10 0 "[ . 1 . 2]" 1
442 1 17 LEU QD 1 58 LEU QD 2.570 . 2.570 2.121 1.616 2.194 . 0 0 "[ . 1 . 2]" 1
443 1 17 LEU QD 1 58 LEU HG 3.990 . 3.990 2.478 2.230 2.580 . 0 0 "[ . 1 . 2]" 1
444 1 17 LEU QD 1 59 GLU H 5.300 . 5.300 4.918 4.845 5.028 . 0 0 "[ . 1 . 2]" 1
445 1 17 LEU QD 1 59 GLU HA 4.510 . 4.510 3.883 3.775 4.047 . 0 0 "[ . 1 . 2]" 1
446 1 17 LEU QD 1 60 THR H 5.440 . 5.440 5.255 5.157 5.390 . 0 0 "[ . 1 . 2]" 1
447 1 17 LEU QD 1 61 TYR H 4.050 . 4.050 3.812 3.722 3.906 . 0 0 "[ . 1 . 2]" 1
448 1 17 LEU QD 1 61 TYR HA 5.030 . 5.030 4.650 4.531 4.776 . 0 0 "[ . 1 . 2]" 1
449 1 17 LEU QD 1 61 TYR QB 3.310 . 3.310 2.361 2.251 2.478 . 0 0 "[ . 1 . 2]" 1
450 1 17 LEU QD 1 61 TYR QD 4.670 . 4.670 3.751 3.636 3.870 . 0 0 "[ . 1 . 2]" 1
451 1 17 LEU QD 1 61 TYR QE 5.440 . 5.440 5.008 4.861 5.141 . 0 0 "[ . 1 . 2]" 1
452 1 17 LEU QD 1 62 CYS H 4.690 . 4.690 4.334 4.185 4.541 . 0 0 "[ . 1 . 2]" 1
453 1 17 LEU MD1 1 18 GLN H 4.920 . 4.920 4.554 4.479 4.812 . 0 0 "[ . 1 . 2]" 1
454 1 17 LEU MD1 1 26 PHE QD 4.370 . 4.370 2.690 2.558 2.805 . 0 0 "[ . 1 . 2]" 1
455 1 17 LEU MD1 1 26 PHE QE 4.300 . 4.300 2.882 2.677 3.879 . 0 0 "[ . 1 . 2]" 1
456 1 17 LEU MD1 1 28 PHE QD 4.490 . 4.490 2.820 2.227 3.991 . 0 0 "[ . 1 . 2]" 1
457 1 17 LEU MD1 1 58 LEU MD1 3.900 . 3.900 3.616 3.328 3.749 . 0 0 "[ . 1 . 2]" 1
458 1 17 LEU MD1 1 58 LEU MD2 3.900 . 3.900 3.530 2.009 3.755 . 0 0 "[ . 1 . 2]" 1
459 1 17 LEU MD1 1 58 LEU HG 4.870 . 4.870 3.587 2.637 3.759 . 0 0 "[ . 1 . 2]" 1
460 1 17 LEU MD1 1 61 TYR HB2 5.500 . 5.500 4.222 2.519 4.480 . 0 0 "[ . 1 . 2]" 1
461 1 17 LEU MD1 1 61 TYR HB3 5.500 . 5.500 4.193 2.878 4.448 . 0 0 "[ . 1 . 2]" 1
462 1 17 LEU MD2 1 18 GLN H 4.920 . 4.920 4.857 4.328 4.909 . 0 0 "[ . 1 . 2]" 1
463 1 17 LEU MD2 1 26 PHE QD 4.370 . 4.370 3.022 2.825 4.335 . 0 0 "[ . 1 . 2]" 1
464 1 17 LEU MD2 1 26 PHE QE 4.300 . 4.300 4.170 4.017 4.327 0.027 5 0 "[ . 1 . 2]" 1
465 1 17 LEU MD2 1 28 PHE QD 4.490 . 4.490 4.302 3.846 4.519 0.029 12 0 "[ . 1 . 2]" 1
466 1 17 LEU MD2 1 58 LEU MD1 3.900 . 3.900 3.483 1.852 3.715 . 0 0 "[ . 1 . 2]" 1
467 1 17 LEU MD2 1 58 LEU MD2 3.900 . 3.900 2.191 2.003 2.263 . 0 0 "[ . 1 . 2]" 1
468 1 17 LEU MD2 1 58 LEU HG 4.870 . 4.870 2.531 2.405 2.641 . 0 0 "[ . 1 . 2]" 1
469 1 17 LEU MD2 1 61 TYR HB2 5.500 . 5.500 2.618 2.398 4.313 . 0 0 "[ . 1 . 2]" 1
470 1 17 LEU MD2 1 61 TYR HB3 5.500 . 5.500 3.022 2.775 4.852 . 0 0 "[ . 1 . 2]" 1
471 1 17 LEU HG 1 26 PHE QD 5.100 . 5.100 4.944 3.137 5.103 0.003 16 0 "[ . 1 . 2]" 1
472 1 17 LEU HG 1 26 PHE QE 5.500 . 5.500 5.203 3.095 5.436 . 0 0 "[ . 1 . 2]" 1
473 1 17 LEU HG 1 58 LEU MD1 4.050 . 4.050 2.885 2.590 4.242 0.192 18 0 "[ . 1 . 2]" 1
474 1 17 LEU HG 1 58 LEU QD 3.130 . 3.130 2.184 2.069 3.574 0.444 18 0 "[ . 1 . 2]" 1
475 1 17 LEU HG 1 58 LEU MD2 4.050 . 4.050 2.268 2.115 3.848 . 0 0 "[ . 1 . 2]" 1
476 1 18 GLN H 1 18 GLN HB2 3.700 . 3.700 2.388 2.344 2.449 . 0 0 "[ . 1 . 2]" 1
477 1 18 GLN H 1 18 GLN QB 3.140 . 3.140 2.355 2.314 2.412 . 0 0 "[ . 1 . 2]" 1
478 1 18 GLN H 1 18 GLN HB3 3.700 . 3.700 3.602 3.581 3.631 . 0 0 "[ . 1 . 2]" 1
479 1 18 GLN H 1 18 GLN HG2 3.750 . 3.750 3.704 3.593 3.752 0.002 4 0 "[ . 1 . 2]" 1
480 1 18 GLN H 1 18 GLN QG 3.190 . 3.190 2.413 2.371 2.497 . 0 0 "[ . 1 . 2]" 1
481 1 18 GLN H 1 18 GLN HG3 3.750 . 3.750 2.446 2.404 2.538 . 0 0 "[ . 1 . 2]" 1
482 1 18 GLN H 1 19 PHE H 3.670 . 3.670 2.599 2.554 2.632 . 0 0 "[ . 1 . 2]" 1
483 1 18 GLN H 1 20 VAL H 5.500 . 5.500 4.456 4.347 4.563 . 0 0 "[ . 1 . 2]" 1
484 1 18 GLN H 1 20 VAL MG1 5.500 . 5.500 5.459 5.353 5.517 0.017 10 0 "[ . 1 . 2]" 1
485 1 18 GLN H 1 20 VAL QG 4.770 . 4.770 4.447 4.355 4.583 . 0 0 "[ . 1 . 2]" 1
486 1 18 GLN H 1 20 VAL MG2 5.500 . 5.500 4.712 4.599 4.901 . 0 0 "[ . 1 . 2]" 1
487 1 18 GLN H 1 26 PHE QD 5.190 . 5.190 4.707 4.479 4.912 . 0 0 "[ . 1 . 2]" 1
488 1 18 GLN H 1 26 PHE QE 4.680 . 4.680 3.786 3.475 4.105 . 0 0 "[ . 1 . 2]" 1
489 1 18 GLN HA 1 18 GLN HG2 3.900 . 3.900 2.567 2.488 2.659 . 0 0 "[ . 1 . 2]" 1
490 1 18 GLN HA 1 18 GLN QG 3.260 . 3.260 2.411 2.371 2.455 . 0 0 "[ . 1 . 2]" 1
491 1 18 GLN HA 1 18 GLN HG3 3.900 . 3.900 2.937 2.832 3.102 . 0 0 "[ . 1 . 2]" 1
492 1 18 GLN HA 1 21 CYS H 4.810 . 4.810 3.797 3.566 3.985 . 0 0 "[ . 1 . 2]" 1
493 1 18 GLN HA 1 21 CYS QB 4.750 . 4.750 3.773 3.279 4.400 . 0 0 "[ . 1 . 2]" 1
494 1 18 GLN HA 1 26 PHE QD 4.190 . 4.190 3.464 3.223 3.852 . 0 0 "[ . 1 . 2]" 1
495 1 18 GLN HA 1 26 PHE QE 3.900 . 3.900 3.139 2.737 3.430 . 0 0 "[ . 1 . 2]" 1
496 1 18 GLN HA 1 26 PHE HZ 5.500 . 5.500 5.302 4.916 5.506 0.006 5 0 "[ . 1 . 2]" 1
497 1 18 GLN HB2 1 19 PHE H 4.070 . 4.070 2.885 2.713 3.053 . 0 0 "[ . 1 . 2]" 1
498 1 18 GLN HB2 1 26 PHE QE 4.760 . 4.760 4.514 4.318 4.736 . 0 0 "[ . 1 . 2]" 1
499 1 18 GLN HB3 1 19 PHE H 4.070 . 4.070 3.787 3.656 3.898 . 0 0 "[ . 1 . 2]" 1
500 1 18 GLN HB3 1 26 PHE QE 4.760 . 4.760 4.433 4.254 4.620 . 0 0 "[ . 1 . 2]" 1
501 1 18 GLN QG 1 19 PHE H 4.580 . 4.580 4.282 4.177 4.348 . 0 0 "[ . 1 . 2]" 1
502 1 18 GLN QG 1 26 PHE QD 4.470 . 4.470 3.794 3.573 4.063 . 0 0 "[ . 1 . 2]" 1
503 1 18 GLN QG 1 26 PHE QE 3.220 . 3.220 2.089 1.986 2.241 . 0 0 "[ . 1 . 2]" 1
504 1 18 GLN QG 1 26 PHE HZ 3.770 . 3.770 3.126 2.720 3.405 . 0 0 "[ . 1 . 2]" 1
505 1 18 GLN HG2 1 19 PHE H 5.410 . 5.410 5.202 5.071 5.288 . 0 0 "[ . 1 . 2]" 1
506 1 18 GLN HG2 1 26 PHE QE 3.810 . 3.810 2.371 2.213 2.502 . 0 0 "[ . 1 . 2]" 1
507 1 18 GLN HG2 1 26 PHE HZ 4.300 . 4.300 4.124 3.781 4.303 0.003 14 0 "[ . 1 . 2]" 1
508 1 18 GLN HG3 1 19 PHE H 5.410 . 5.410 4.557 4.446 4.640 . 0 0 "[ . 1 . 2]" 1
509 1 18 GLN HG3 1 26 PHE QE 3.810 . 3.810 2.338 2.133 2.652 . 0 0 "[ . 1 . 2]" 1
510 1 18 GLN HG3 1 26 PHE HZ 4.300 . 4.300 3.242 2.789 3.570 . 0 0 "[ . 1 . 2]" 1
511 1 19 PHE H 1 19 PHE HB2 3.600 . 3.600 2.528 2.431 2.680 . 0 0 "[ . 1 . 2]" 1
512 1 19 PHE H 1 19 PHE HB3 3.600 . 3.600 2.532 2.455 2.608 . 0 0 "[ . 1 . 2]" 1
513 1 19 PHE H 1 19 PHE QD 4.420 . 4.420 4.213 4.192 4.234 . 0 0 "[ . 1 . 2]" 1
514 1 19 PHE H 1 20 VAL H 3.800 . 3.800 2.744 2.585 2.885 . 0 0 "[ . 1 . 2]" 1
515 1 19 PHE H 1 20 VAL MG1 5.010 . 5.010 4.156 3.969 4.305 . 0 0 "[ . 1 . 2]" 1
516 1 19 PHE H 1 20 VAL QG 3.920 . 3.920 3.715 3.515 3.847 . 0 0 "[ . 1 . 2]" 1
517 1 19 PHE H 1 20 VAL MG2 5.010 . 5.010 4.187 3.923 4.416 . 0 0 "[ . 1 . 2]" 1
518 1 19 PHE HA 1 19 PHE QD 3.820 . 3.820 2.815 2.703 2.885 . 0 0 "[ . 1 . 2]" 1
519 1 19 PHE HA 1 19 PHE QE 4.940 . 4.940 4.629 4.576 4.684 . 0 0 "[ . 1 . 2]" 1
520 1 19 PHE HA 1 20 VAL QG 4.900 . 4.900 4.508 4.465 4.552 . 0 0 "[ . 1 . 2]" 1
521 1 19 PHE QB 1 20 VAL H 3.610 . 3.610 2.504 2.370 2.596 . 0 0 "[ . 1 . 2]" 1
522 1 19 PHE QB 1 20 VAL QG 3.950 . 3.950 2.922 2.870 3.005 . 0 0 "[ . 1 . 2]" 1
523 1 19 PHE HB2 1 20 VAL H 4.110 . 4.110 3.875 3.758 3.956 . 0 0 "[ . 1 . 2]" 1
524 1 19 PHE HB3 1 20 VAL H 4.110 . 4.110 2.536 2.393 2.634 . 0 0 "[ . 1 . 2]" 1
525 1 19 PHE QD 1 20 VAL H 4.470 . 4.470 3.411 3.148 3.593 . 0 0 "[ . 1 . 2]" 1
526 1 19 PHE QD 1 20 VAL HA 4.590 . 4.590 3.213 3.096 3.318 . 0 0 "[ . 1 . 2]" 1
527 1 19 PHE QD 1 20 VAL QG 3.260 . 3.260 2.521 2.269 2.774 . 0 0 "[ . 1 . 2]" 1
528 1 19 PHE QE 1 20 VAL QG 4.790 . 4.790 3.968 3.606 4.343 . 0 0 "[ . 1 . 2]" 1
529 1 20 VAL H 1 20 VAL HB 3.700 . 3.700 3.696 3.672 3.706 0.006 18 0 "[ . 1 . 2]" 1
530 1 20 VAL H 1 20 VAL MG1 3.370 . 3.370 2.124 2.049 2.181 . 0 0 "[ . 1 . 2]" 1
531 1 20 VAL H 1 20 VAL QG 2.770 . 2.770 1.934 1.892 1.963 . 0 0 "[ . 1 . 2]" 1
532 1 20 VAL H 1 20 VAL MG2 3.370 . 3.370 2.232 2.143 2.365 . 0 0 "[ . 1 . 2]" 1
533 1 20 VAL H 1 22 GLY H 4.790 . 4.790 4.072 3.881 4.264 . 0 0 "[ . 1 . 2]" 1
534 1 20 VAL H 1 58 LEU QD 3.940 . 3.940 3.648 3.579 3.693 . 0 0 "[ . 1 . 2]" 1
535 1 20 VAL HA 1 20 VAL MG1 3.170 . 3.170 2.389 2.353 2.469 . 0 0 "[ . 1 . 2]" 1
536 1 20 VAL HA 1 20 VAL QG 2.670 . 2.670 2.328 2.299 2.391 . 0 0 "[ . 1 . 2]" 1
537 1 20 VAL HA 1 20 VAL MG2 3.170 . 3.170 3.213 3.199 3.232 0.062 16 0 "[ . 1 . 2]" 1
538 1 20 VAL HA 1 55 LEU HB2 5.500 . 5.500 5.515 5.452 5.538 0.038 11 0 "[ . 1 . 2]" 1
539 1 20 VAL HB 1 21 CYS H 4.530 . 4.530 4.103 4.042 4.159 . 0 0 "[ . 1 . 2]" 1
540 1 20 VAL HB 1 55 LEU HB2 4.770 . 4.770 4.724 4.569 4.792 0.022 9 0 "[ . 1 . 2]" 1
541 1 20 VAL HB 1 55 LEU HG 4.740 . 4.740 4.398 3.996 4.656 . 0 0 "[ . 1 . 2]" 1
542 1 20 VAL HB 1 58 LEU QD 3.630 . 3.630 3.719 3.694 3.748 0.118 1 0 "[ . 1 . 2]" 1
543 1 20 VAL QG 1 21 CYS H 3.330 . 3.330 2.460 2.352 2.565 . 0 0 "[ . 1 . 2]" 1
544 1 20 VAL QG 1 21 CYS HA 4.140 . 4.140 3.494 3.282 3.748 . 0 0 "[ . 1 . 2]" 1
545 1 20 VAL QG 1 21 CYS QB 4.600 . 4.600 3.142 2.309 3.494 . 0 0 "[ . 1 . 2]" 1
546 1 20 VAL QG 1 22 GLY H 5.440 . 5.440 4.151 4.011 4.248 . 0 0 "[ . 1 . 2]" 1
547 1 20 VAL QG 1 55 LEU HA 3.850 . 3.850 3.030 2.882 3.158 . 0 0 "[ . 1 . 2]" 1
548 1 20 VAL QG 1 55 LEU HB2 3.400 . 3.400 2.542 2.382 2.657 . 0 0 "[ . 1 . 2]" 1
549 1 20 VAL QG 1 55 LEU QD 2.990 . 2.990 2.294 2.121 2.455 . 0 0 "[ . 1 . 2]" 1
550 1 20 VAL QG 1 55 LEU HG 5.280 . 5.280 3.273 3.029 3.429 . 0 0 "[ . 1 . 2]" 1
551 1 20 VAL QG 1 58 LEU H 5.440 . 5.440 4.597 4.479 4.700 . 0 0 "[ . 1 . 2]" 1
552 1 20 VAL QG 1 58 LEU HA 4.840 . 4.840 4.571 4.464 4.694 . 0 0 "[ . 1 . 2]" 1
553 1 20 VAL QG 1 58 LEU QB 4.420 . 4.420 2.926 2.832 3.022 . 0 0 "[ . 1 . 2]" 1
554 1 20 VAL QG 1 58 LEU QD 2.680 . 2.680 1.781 1.756 1.810 . 0 0 "[ . 1 . 2]" 1
555 1 20 VAL QG 1 58 LEU HG 4.380 . 4.380 3.858 3.804 3.928 . 0 0 "[ . 1 . 2]" 1
556 1 20 VAL QG 1 59 GLU H 3.590 . 3.590 3.260 3.144 3.400 . 0 0 "[ . 1 . 2]" 1
557 1 20 VAL QG 1 59 GLU HA 2.950 . 2.950 2.128 2.038 2.242 . 0 0 "[ . 1 . 2]" 1
558 1 20 VAL QG 1 59 GLU HB2 3.120 . 3.120 2.779 2.664 2.868 . 0 0 "[ . 1 . 2]" 1
559 1 20 VAL QG 1 59 GLU HB3 3.990 . 3.990 3.950 3.835 4.046 0.056 17 0 "[ . 1 . 2]" 1
560 1 20 VAL QG 1 59 GLU QG 3.100 . 3.100 2.903 2.641 3.141 0.041 18 0 "[ . 1 . 2]" 1
561 1 20 VAL QG 1 60 THR MG 5.440 . 5.440 5.521 5.433 5.635 0.195 13 0 "[ . 1 . 2]" 1
562 1 20 VAL QG 1 62 CYS H 5.320 . 5.320 4.579 4.408 4.786 . 0 0 "[ . 1 . 2]" 1
563 1 20 VAL MG1 1 21 CYS H 3.880 . 3.880 3.971 3.919 4.023 0.143 17 0 "[ . 1 . 2]" 1
564 1 20 VAL MG1 1 58 LEU HA 5.500 . 5.500 5.553 5.523 5.606 0.106 4 0 "[ . 1 . 2]" 1
565 1 20 VAL MG1 1 59 GLU H 4.790 . 4.790 3.894 3.797 4.000 . 0 0 "[ . 1 . 2]" 1
566 1 20 VAL MG1 1 59 GLU HA 4.220 . 4.220 3.920 3.805 4.041 . 0 0 "[ . 1 . 2]" 1
567 1 20 VAL MG1 1 59 GLU HG2 5.500 . 5.500 5.082 4.432 5.529 0.029 9 0 "[ . 1 . 2]" 1
568 1 20 VAL MG1 1 59 GLU HG3 5.500 . 5.500 4.535 4.174 4.778 . 0 0 "[ . 1 . 2]" 1
569 1 20 VAL MG2 1 21 CYS H 3.880 . 3.880 2.484 2.370 2.595 . 0 0 "[ . 1 . 2]" 1
570 1 20 VAL MG2 1 58 LEU HA 5.500 . 5.500 4.867 4.711 5.059 . 0 0 "[ . 1 . 2]" 1
571 1 20 VAL MG2 1 59 GLU H 4.790 . 4.790 3.503 3.351 3.710 . 0 0 "[ . 1 . 2]" 1
572 1 20 VAL MG2 1 59 GLU HA 4.220 . 4.220 2.137 2.045 2.254 . 0 0 "[ . 1 . 2]" 1
573 1 20 VAL MG2 1 59 GLU HG2 5.500 . 5.500 3.606 2.907 4.241 . 0 0 "[ . 1 . 2]" 1
574 1 20 VAL MG2 1 59 GLU HG3 5.500 . 5.500 3.493 2.713 4.081 . 0 0 "[ . 1 . 2]" 1
575 1 21 CYS CB 1 62 CYS SG 3.100 . 3.100 3.040 3.012 3.082 . 0 0 "[ . 1 . 2]" 1
576 1 21 CYS H 1 21 CYS HB2 3.880 . 3.880 2.585 2.540 2.655 . 0 0 "[ . 1 . 2]" 1
577 1 21 CYS H 1 21 CYS QB 3.380 . 3.380 2.539 2.498 2.607 . 0 0 "[ . 1 . 2]" 1
578 1 21 CYS H 1 21 CYS HB3 3.880 . 3.880 3.720 3.443 3.810 . 0 0 "[ . 1 . 2]" 1
579 1 21 CYS H 1 22 GLY H 3.530 . 3.530 2.200 2.101 2.387 . 0 0 "[ . 1 . 2]" 1
580 1 21 CYS H 1 22 GLY QA 4.520 . 4.520 4.156 4.044 4.295 . 0 0 "[ . 1 . 2]" 1
581 1 21 CYS H 1 26 PHE QD 5.500 . 5.500 5.064 4.894 5.353 . 0 0 "[ . 1 . 2]" 1
582 1 21 CYS H 1 58 LEU QD 4.960 . 4.960 4.673 4.454 4.932 . 0 0 "[ . 1 . 2]" 1
583 1 21 CYS QB 1 25 GLY H 4.510 . 4.510 3.713 3.135 4.472 . 0 0 "[ . 1 . 2]" 1
584 1 21 CYS QB 1 26 PHE QD 3.930 . 3.930 3.248 2.845 3.936 0.006 16 0 "[ . 1 . 2]" 1
585 1 21 CYS QB 1 62 CYS QB 3.970 . 3.970 2.874 2.790 3.094 . 0 0 "[ . 1 . 2]" 1
586 1 21 CYS QB 1 63 ALA H 4.690 . 4.690 3.743 3.278 4.188 . 0 0 "[ . 1 . 2]" 1
587 1 21 CYS QB 1 63 ALA MB 4.800 . 4.800 4.694 4.296 5.014 0.214 17 0 "[ . 1 . 2]" 1
588 1 21 CYS QB 1 64 THR H 5.340 . 5.340 4.624 4.096 5.323 . 0 0 "[ . 1 . 2]" 1
589 1 21 CYS HB2 1 22 GLY H 4.260 . 4.260 3.399 2.893 4.072 . 0 0 "[ . 1 . 2]" 1
590 1 21 CYS HB2 1 25 GLY H 5.210 . 5.210 4.319 3.717 5.213 0.003 16 0 "[ . 1 . 2]" 1
591 1 21 CYS HB2 1 26 PHE QD 4.640 . 4.640 3.382 2.919 4.520 . 0 0 "[ . 1 . 2]" 1
592 1 21 CYS HB2 1 62 CYS HA 5.040 . 5.040 4.196 3.922 4.315 . 0 0 "[ . 1 . 2]" 1
593 1 21 CYS HB3 1 22 GLY H 4.260 . 4.260 4.138 3.932 4.265 0.005 15 0 "[ . 1 . 2]" 1
594 1 21 CYS HB3 1 25 GLY H 5.210 . 5.210 4.094 3.341 4.926 . 0 0 "[ . 1 . 2]" 1
595 1 21 CYS HB3 1 26 PHE QD 4.640 . 4.640 4.291 3.932 4.664 0.024 17 0 "[ . 1 . 2]" 1
596 1 21 CYS HB3 1 62 CYS HA 5.040 . 5.040 3.839 3.102 4.580 . 0 0 "[ . 1 . 2]" 1
597 1 21 CYS SG 1 62 CYS CB 3.100 . 3.100 3.038 2.998 3.072 . 0 0 "[ . 1 . 2]" 1
598 1 21 CYS SG 1 62 CYS SG 2.100 . 2.100 2.026 2.015 2.034 . 0 0 "[ . 1 . 2]" 1
599 1 22 GLY H 1 23 ASP H 4.730 . 4.730 4.551 4.253 4.651 . 0 0 "[ . 1 . 2]" 1
600 1 22 GLY QA 1 24 ARG H 4.210 . 4.210 2.981 2.747 3.299 . 0 0 "[ . 1 . 2]" 1
601 1 22 GLY HA2 1 23 ASP H 3.560 . 3.560 2.676 2.330 3.097 . 0 0 "[ . 1 . 2]" 1
602 1 22 GLY HA3 1 23 ASP H 3.560 . 3.560 2.448 2.120 2.894 . 0 0 "[ . 1 . 2]" 1
603 1 23 ASP H 1 23 ASP HB2 3.830 . 3.830 2.729 2.290 3.613 . 0 0 "[ . 1 . 2]" 1
604 1 23 ASP H 1 23 ASP QB 3.330 . 3.330 2.350 2.178 2.621 . 0 0 "[ . 1 . 2]" 1
605 1 23 ASP H 1 23 ASP HB3 3.830 . 3.830 2.903 2.425 3.611 . 0 0 "[ . 1 . 2]" 1
606 1 23 ASP H 1 24 ARG H 3.730 . 3.730 2.765 2.509 3.063 . 0 0 "[ . 1 . 2]" 1
607 1 23 ASP QB 1 24 ARG H 4.110 . 4.110 3.541 3.205 3.902 . 0 0 "[ . 1 . 2]" 1
608 1 23 ASP HB2 1 24 ARG H 4.700 . 4.700 4.087 3.440 4.440 . 0 0 "[ . 1 . 2]" 1
609 1 23 ASP HB3 1 24 ARG H 4.700 . 4.700 4.035 3.321 4.421 . 0 0 "[ . 1 . 2]" 1
610 1 24 ARG H 1 24 ARG HB2 3.810 . 3.810 2.661 2.388 3.645 . 0 0 "[ . 1 . 2]" 1
611 1 24 ARG H 1 24 ARG HB3 3.810 . 3.810 3.504 2.527 3.645 . 0 0 "[ . 1 . 2]" 1
612 1 24 ARG H 1 24 ARG QD 4.080 . 4.080 3.956 2.998 4.140 0.060 11 0 "[ . 1 . 2]" 1
613 1 24 ARG H 1 24 ARG HE 4.460 . 4.460 3.470 2.699 4.487 0.027 7 0 "[ . 1 . 2]" 1
614 1 24 ARG H 1 24 ARG HG2 4.060 . 4.060 2.452 2.089 3.964 . 0 0 "[ . 1 . 2]" 1
615 1 24 ARG H 1 24 ARG QG 3.410 . 3.410 2.170 1.976 2.585 . 0 0 "[ . 1 . 2]" 1
616 1 24 ARG H 1 24 ARG HG3 4.060 . 4.060 3.085 2.084 3.707 . 0 0 "[ . 1 . 2]" 1
617 1 24 ARG H 1 25 GLY H 3.590 . 3.590 2.614 2.432 2.815 . 0 0 "[ . 1 . 2]" 1
618 1 24 ARG HA 1 24 ARG QD 4.580 . 4.580 3.361 2.381 4.483 . 0 0 "[ . 1 . 2]" 1
619 1 24 ARG HA 1 24 ARG HE 4.620 . 4.620 3.119 1.953 4.652 0.032 20 0 "[ . 1 . 2]" 1
620 1 24 ARG HA 1 24 ARG HG2 3.880 . 3.880 3.047 2.521 3.824 . 0 0 "[ . 1 . 2]" 1
621 1 24 ARG HA 1 24 ARG QG 3.390 . 3.390 2.878 2.392 3.349 . 0 0 "[ . 1 . 2]" 1
622 1 24 ARG HA 1 24 ARG HG3 3.880 . 3.880 3.644 2.678 3.880 0.000 9 0 "[ . 1 . 2]" 1
623 1 24 ARG QB 1 24 ARG HE 3.720 . 3.720 2.917 1.880 3.712 . 0 0 "[ . 1 . 2]" 1
624 1 24 ARG HB2 1 24 ARG HE 4.360 . 4.360 3.657 2.007 4.206 . 0 0 "[ . 1 . 2]" 1
625 1 24 ARG HB3 1 24 ARG HE 4.360 . 4.360 3.286 1.889 4.327 . 0 0 "[ . 1 . 2]" 1
626 1 24 ARG HE 1 24 ARG HG2 4.070 . 4.070 2.624 2.061 3.619 . 0 0 "[ . 1 . 2]" 1
627 1 24 ARG HE 1 24 ARG QG 3.560 . 3.560 2.370 2.045 2.820 . 0 0 "[ . 1 . 2]" 1
628 1 24 ARG HE 1 24 ARG HG3 4.070 . 4.070 3.362 2.130 3.783 . 0 0 "[ . 1 . 2]" 1
629 1 25 GLY H 1 26 PHE H 4.480 . 4.480 4.385 4.162 4.493 0.013 17 0 "[ . 1 . 2]" 1
630 1 25 GLY H 1 26 PHE HB3 5.500 . 5.500 4.973 4.560 5.184 . 0 0 "[ . 1 . 2]" 1
631 1 25 GLY H 1 63 ALA MB 4.640 . 4.640 4.545 4.274 4.645 0.005 20 0 "[ . 1 . 2]" 1
632 1 25 GLY QA 1 26 PHE QD 4.050 . 4.050 3.056 2.706 3.466 . 0 0 "[ . 1 . 2]" 1
633 1 25 GLY QA 1 63 ALA MB 4.130 . 4.130 2.926 2.560 3.213 . 0 0 "[ . 1 . 2]" 1
634 1 25 GLY HA2 1 26 PHE H 3.400 . 3.400 2.367 2.177 2.505 . 0 0 "[ . 1 . 2]" 1
635 1 25 GLY HA3 1 26 PHE H 3.400 . 3.400 2.693 2.561 2.932 . 0 0 "[ . 1 . 2]" 1
636 1 26 PHE H 1 26 PHE QD 3.780 . 3.780 3.174 2.992 3.320 . 0 0 "[ . 1 . 2]" 1
637 1 26 PHE H 1 26 PHE QE 4.910 . 4.910 4.323 4.128 4.441 . 0 0 "[ . 1 . 2]" 1
638 1 26 PHE H 1 27 TYR H 4.600 . 4.600 4.354 4.309 4.397 . 0 0 "[ . 1 . 2]" 1
639 1 26 PHE H 1 63 ALA H 5.130 . 5.130 4.312 3.894 4.582 . 0 0 "[ . 1 . 2]" 1
640 1 26 PHE H 1 63 ALA MB 3.650 . 3.650 3.269 2.972 3.476 . 0 0 "[ . 1 . 2]" 1
641 1 26 PHE HA 1 26 PHE QD 3.930 . 3.930 3.740 3.719 3.758 . 0 0 "[ . 1 . 2]" 1
642 1 26 PHE HA 1 27 TYR QD 4.430 . 4.430 3.560 3.117 4.020 . 0 0 "[ . 1 . 2]" 1
643 1 26 PHE HA 1 63 ALA H 3.570 . 3.570 2.184 2.035 2.404 . 0 0 "[ . 1 . 2]" 1
644 1 26 PHE HA 1 63 ALA HA 5.130 . 5.130 3.546 3.248 3.902 . 0 0 "[ . 1 . 2]" 1
645 1 26 PHE HA 1 63 ALA MB 3.290 . 3.290 2.511 2.363 2.665 . 0 0 "[ . 1 . 2]" 1
646 1 26 PHE HA 1 64 THR H 5.420 . 5.420 4.677 4.275 4.940 . 0 0 "[ . 1 . 2]" 1
647 1 26 PHE HB2 1 27 TYR H 3.900 . 3.900 2.351 2.275 2.464 . 0 0 "[ . 1 . 2]" 1
648 1 26 PHE HB2 1 62 CYS H 5.500 . 5.500 4.757 4.536 5.151 . 0 0 "[ . 1 . 2]" 1
649 1 26 PHE HB2 1 62 CYS HA 4.390 . 4.390 2.951 2.520 3.252 . 0 0 "[ . 1 . 2]" 1
650 1 26 PHE HB2 1 63 ALA H 4.720 . 4.720 4.273 4.022 4.438 . 0 0 "[ . 1 . 2]" 1
651 1 26 PHE HB2 1 63 ALA MB 4.920 . 4.920 4.688 4.531 4.850 . 0 0 "[ . 1 . 2]" 1
652 1 26 PHE HB3 1 27 TYR H 4.090 . 4.090 3.636 3.511 3.747 . 0 0 "[ . 1 . 2]" 1
653 1 26 PHE HB3 1 63 ALA H 4.780 . 4.780 3.485 3.183 3.746 . 0 0 "[ . 1 . 2]" 1
654 1 26 PHE HB3 1 63 ALA MB 5.090 . 5.090 4.338 4.177 4.507 . 0 0 "[ . 1 . 2]" 1
655 1 26 PHE QD 1 27 TYR H 4.020 . 4.020 3.453 3.026 3.759 . 0 0 "[ . 1 . 2]" 1
656 1 26 PHE QD 1 27 TYR HA 4.380 . 4.380 3.900 3.237 4.191 . 0 0 "[ . 1 . 2]" 1
657 1 26 PHE QD 1 44 ILE MG 4.790 . 4.790 4.315 4.097 4.629 . 0 0 "[ . 1 . 2]" 1
658 1 26 PHE QD 1 58 LEU QD 5.440 . 5.440 5.259 5.067 5.321 . 0 0 "[ . 1 . 2]" 1
659 1 26 PHE QD 1 63 ALA H 5.340 . 5.340 4.855 4.600 5.061 . 0 0 "[ . 1 . 2]" 1
660 1 26 PHE QD 1 63 ALA MB 4.810 . 4.810 4.828 4.676 4.950 0.140 19 0 "[ . 1 . 2]" 1
661 1 26 PHE QE 1 44 ILE MG 5.040 . 5.040 4.743 4.367 5.007 . 0 0 "[ . 1 . 2]" 1
662 1 27 TYR H 1 27 TYR QB 3.620 . 3.620 2.399 2.266 3.239 . 0 0 "[ . 1 . 2]" 1
663 1 27 TYR H 1 27 TYR QD 3.850 . 3.850 2.717 2.371 3.177 . 0 0 "[ . 1 . 2]" 1
664 1 27 TYR H 1 61 TYR QB 4.660 . 4.660 2.930 2.764 3.211 . 0 0 "[ . 1 . 2]" 1
665 1 27 TYR H 1 61 TYR QD 4.840 . 4.840 3.897 3.673 4.251 . 0 0 "[ . 1 . 2]" 1
666 1 27 TYR H 1 62 CYS H 5.500 . 5.500 4.835 4.768 5.003 . 0 0 "[ . 1 . 2]" 1
667 1 27 TYR H 1 63 ALA H 4.470 . 4.470 4.215 3.942 4.433 . 0 0 "[ . 1 . 2]" 1
668 1 27 TYR H 1 63 ALA MB 4.300 . 4.300 3.954 3.563 4.217 . 0 0 "[ . 1 . 2]" 1
669 1 27 TYR HA 1 27 TYR QD 3.800 . 3.800 2.962 2.474 3.776 . 0 0 "[ . 1 . 2]" 1
670 1 27 TYR HA 1 28 PHE H 3.420 . 3.420 2.430 2.293 2.548 . 0 0 "[ . 1 . 2]" 1
671 1 27 TYR HA 1 28 PHE HB2 4.530 . 4.530 4.262 4.108 4.348 . 0 0 "[ . 1 . 2]" 1
672 1 27 TYR HA 1 28 PHE HB3 5.500 . 5.500 5.419 5.082 5.519 0.019 12 0 "[ . 1 . 2]" 1
673 1 27 TYR HA 1 29 ASN H 4.460 . 4.460 4.031 3.577 4.414 . 0 0 "[ . 1 . 2]" 1
674 1 27 TYR QB 1 28 PHE H 3.600 . 3.600 2.639 2.414 3.030 . 0 0 "[ . 1 . 2]" 1
675 1 27 TYR QB 1 29 ASN H 3.760 . 3.760 3.116 2.737 3.624 . 0 0 "[ . 1 . 2]" 1
676 1 27 TYR QB 1 30 ARG QG 4.720 . 4.720 2.569 2.143 4.260 . 0 0 "[ . 1 . 2]" 1
677 1 27 TYR QB 1 61 TYR QD 4.410 . 4.410 2.529 2.102 4.176 . 0 0 "[ . 1 . 2]" 1
678 1 27 TYR HB2 1 28 PHE H 4.100 . 4.100 3.765 2.542 4.112 0.012 5 0 "[ . 1 . 2]" 1
679 1 27 TYR HB2 1 30 ARG QG 5.500 . 5.500 2.961 2.294 4.419 . 0 0 "[ . 1 . 2]" 1
680 1 27 TYR HB3 1 28 PHE H 4.100 . 4.100 2.747 2.450 3.644 . 0 0 "[ . 1 . 2]" 1
681 1 27 TYR HB3 1 30 ARG QG 5.500 . 5.500 2.903 2.369 5.581 0.081 17 0 "[ . 1 . 2]" 1
682 1 27 TYR QD 1 28 PHE H 4.540 . 4.540 4.005 3.779 4.544 0.004 5 0 "[ . 1 . 2]" 1
683 1 27 TYR QD 1 29 ASN H 4.820 . 4.820 4.518 3.785 4.883 0.063 4 0 "[ . 1 . 2]" 1
684 1 27 TYR QD 1 30 ARG QB 4.420 . 4.420 4.011 3.238 4.310 . 0 0 "[ . 1 . 2]" 1
685 1 27 TYR QD 1 30 ARG QD 5.060 . 5.060 4.215 3.540 4.650 . 0 0 "[ . 1 . 2]" 1
686 1 27 TYR QD 1 30 ARG QG 4.270 . 4.270 3.550 2.575 3.952 . 0 0 "[ . 1 . 2]" 1
687 1 27 TYR QD 1 31 PRO QD 4.840 . 4.840 2.327 1.915 3.077 . 0 0 "[ . 1 . 2]" 1
688 1 27 TYR QD 1 32 ALA MB 5.050 . 5.050 4.835 3.921 5.112 0.062 17 0 "[ . 1 . 2]" 1
689 1 27 TYR QD 1 63 ALA HA 3.720 . 3.720 2.744 2.251 3.414 . 0 0 "[ . 1 . 2]" 1
690 1 27 TYR QD 1 63 ALA MB 3.570 . 3.570 3.402 2.132 3.682 0.112 11 0 "[ . 1 . 2]" 1
691 1 27 TYR QD 1 64 THR H 5.500 . 5.500 5.524 5.217 5.594 0.094 5 0 "[ . 1 . 2]" 1
692 1 27 TYR QE 1 30 ARG QB 4.980 . 4.980 4.665 3.757 4.997 0.017 13 0 "[ . 1 . 2]" 1
693 1 27 TYR QE 1 30 ARG QD 5.270 . 5.270 5.026 3.086 5.390 0.120 16 0 "[ . 1 . 2]" 1
694 1 27 TYR QE 1 30 ARG QG 5.500 . 5.500 4.930 2.135 5.376 . 0 0 "[ . 1 . 2]" 1
695 1 27 TYR QE 1 31 PRO QD 4.550 . 4.550 3.802 3.482 4.271 . 0 0 "[ . 1 . 2]" 1
696 1 27 TYR QE 1 31 PRO HG2 5.500 . 5.500 4.820 4.097 5.541 0.041 17 0 "[ . 1 . 2]" 1
697 1 27 TYR QE 1 32 ALA MB 4.380 . 4.380 3.738 2.340 4.461 0.081 17 0 "[ . 1 . 2]" 1
698 1 27 TYR QE 1 63 ALA H 5.320 . 5.320 4.819 4.681 4.986 . 0 0 "[ . 1 . 2]" 1
699 1 27 TYR QE 1 63 ALA HA 3.310 . 3.310 2.092 1.860 2.693 . 0 0 "[ . 1 . 2]" 1
700 1 27 TYR QE 1 63 ALA MB 3.790 . 3.790 3.175 2.140 3.803 0.013 17 0 "[ . 1 . 2]" 1
701 1 27 TYR QE 1 64 THR H 5.180 . 5.180 5.066 4.519 5.226 0.046 20 0 "[ . 1 . 2]" 1
702 1 28 PHE H 1 28 PHE HB2 3.590 . 3.590 2.480 2.193 2.780 . 0 0 "[ . 1 . 2]" 1
703 1 28 PHE H 1 28 PHE HB3 3.850 . 3.850 3.153 2.985 3.323 . 0 0 "[ . 1 . 2]" 1
704 1 28 PHE H 1 28 PHE QD 4.410 . 4.410 3.996 3.503 4.349 . 0 0 "[ . 1 . 2]" 1
705 1 28 PHE H 1 29 ASN H 3.340 . 3.340 1.864 1.722 1.985 . 0 0 "[ . 1 . 2]" 1
706 1 28 PHE H 1 29 ASN HA 4.790 . 4.790 4.554 4.311 4.794 0.004 5 0 "[ . 1 . 2]" 1
707 1 28 PHE H 1 29 ASN HB2 5.500 . 5.500 5.359 4.252 5.573 0.073 11 0 "[ . 1 . 2]" 1
708 1 28 PHE H 1 29 ASN HB3 5.500 . 5.500 5.070 4.568 5.556 0.056 1 0 "[ . 1 . 2]" 1
709 1 28 PHE H 1 44 ILE MG 5.180 . 5.180 4.686 4.552 4.799 . 0 0 "[ . 1 . 2]" 1
710 1 28 PHE H 1 61 TYR QD 4.920 . 4.920 4.214 3.858 4.678 . 0 0 "[ . 1 . 2]" 1
711 1 28 PHE HA 1 28 PHE QD 4.210 . 4.210 2.683 2.376 2.894 . 0 0 "[ . 1 . 2]" 1
712 1 28 PHE HA 1 44 ILE MD 5.500 . 5.500 5.183 4.870 5.514 0.014 19 0 "[ . 1 . 2]" 1
713 1 28 PHE HA 1 44 ILE MG 3.180 . 3.180 2.222 2.090 2.379 . 0 0 "[ . 1 . 2]" 1
714 1 28 PHE HB2 1 29 ASN H 3.980 . 3.980 3.242 2.897 3.625 . 0 0 "[ . 1 . 2]" 1
715 1 28 PHE HB2 1 29 ASN QD 5.220 . 5.220 4.788 3.284 5.293 0.073 11 0 "[ . 1 . 2]" 1
716 1 28 PHE HB2 1 44 ILE MG 4.360 . 4.360 4.092 3.985 4.215 . 0 0 "[ . 1 . 2]" 1
717 1 28 PHE HB2 1 45 VAL QG 5.440 . 5.440 5.543 5.443 5.627 0.187 16 0 "[ . 1 . 2]" 1
718 1 28 PHE HB3 1 29 ASN H 4.200 . 4.200 2.871 2.439 3.314 . 0 0 "[ . 1 . 2]" 1
719 1 28 PHE HB3 1 29 ASN QD 4.850 . 4.850 3.763 2.120 4.856 0.006 12 0 "[ . 1 . 2]" 1
720 1 28 PHE HB3 1 44 ILE MG 3.940 . 3.940 3.609 3.337 3.946 0.006 16 0 "[ . 1 . 2]" 1
721 1 28 PHE HB3 1 45 VAL QG 4.750 . 4.750 4.361 4.235 4.675 . 0 0 "[ . 1 . 2]" 1
722 1 28 PHE QD 1 29 ASN H 5.430 . 5.430 4.567 4.271 4.796 . 0 0 "[ . 1 . 2]" 1
723 1 28 PHE QD 1 44 ILE H 5.500 . 5.500 4.532 4.027 4.876 . 0 0 "[ . 1 . 2]" 1
724 1 28 PHE QD 1 44 ILE HG12 5.500 . 5.500 5.281 4.815 5.487 . 0 0 "[ . 1 . 2]" 1
725 1 28 PHE QD 1 44 ILE MG 3.150 . 3.150 2.833 2.617 2.995 . 0 0 "[ . 1 . 2]" 1
726 1 28 PHE QD 1 45 VAL QG 3.580 . 3.580 2.920 2.756 3.114 . 0 0 "[ . 1 . 2]" 1
727 1 28 PHE QE 1 44 ILE MG 4.040 . 4.040 3.106 2.896 3.251 . 0 0 "[ . 1 . 2]" 1
728 1 28 PHE QE 1 45 VAL MG1 4.310 . 4.310 3.429 2.861 4.082 . 0 0 "[ . 1 . 2]" 1
729 1 28 PHE QE 1 45 VAL QG 3.560 . 3.560 2.884 2.185 3.090 . 0 0 "[ . 1 . 2]" 1
730 1 28 PHE QE 1 45 VAL MG2 4.310 . 4.310 3.210 2.195 3.517 . 0 0 "[ . 1 . 2]" 1
731 1 28 PHE HZ 1 44 ILE MG 5.050 . 5.050 3.646 3.507 3.819 . 0 0 "[ . 1 . 2]" 1
732 1 28 PHE HZ 1 45 VAL HA 5.500 . 5.500 5.138 4.721 5.426 . 0 0 "[ . 1 . 2]" 1
733 1 28 PHE HZ 1 45 VAL QG 5.230 . 5.230 4.322 3.142 4.720 . 0 0 "[ . 1 . 2]" 1
734 1 29 ASN H 1 29 ASN HB2 3.860 . 3.860 3.563 2.528 3.867 0.007 9 0 "[ . 1 . 2]" 1
735 1 29 ASN H 1 29 ASN QB 3.360 . 3.360 3.026 2.484 3.319 . 0 0 "[ . 1 . 2]" 1
736 1 29 ASN H 1 29 ASN HB3 3.860 . 3.860 3.402 3.144 3.734 . 0 0 "[ . 1 . 2]" 1
737 1 29 ASN H 1 30 ARG H 4.100 . 4.100 2.175 1.879 2.603 . 0 0 "[ . 1 . 2]" 1
738 1 29 ASN H 1 30 ARG QG 4.850 . 4.850 4.055 3.735 4.416 . 0 0 "[ . 1 . 2]" 1
739 1 29 ASN H 1 61 TYR QD 5.500 . 5.500 4.347 3.899 4.731 . 0 0 "[ . 1 . 2]" 1
740 1 29 ASN H 1 61 TYR QE 5.220 . 5.220 4.385 4.059 4.830 . 0 0 "[ . 1 . 2]" 1
741 1 29 ASN HA 1 30 ARG H 3.460 . 3.460 2.960 2.834 3.042 . 0 0 "[ . 1 . 2]" 1
742 1 29 ASN HA 1 30 ARG HB2 5.500 . 5.500 4.350 4.181 4.469 . 0 0 "[ . 1 . 2]" 1
743 1 29 ASN HA 1 30 ARG HB3 5.500 . 5.500 5.536 5.517 5.568 0.068 1 0 "[ . 1 . 2]" 1
744 1 29 ASN HA 1 30 ARG QG 4.490 . 4.490 3.107 3.004 3.263 . 0 0 "[ . 1 . 2]" 1
745 1 29 ASN HA 1 43 GLY H 5.230 . 5.230 4.644 3.892 5.163 . 0 0 "[ . 1 . 2]" 1
746 1 29 ASN HA 1 44 ILE H 4.770 . 4.770 3.489 3.251 3.986 . 0 0 "[ . 1 . 2]" 1
747 1 29 ASN HA 1 44 ILE MG 5.030 . 5.030 4.587 4.352 4.799 . 0 0 "[ . 1 . 2]" 1
748 1 29 ASN HA 1 61 TYR QD 5.190 . 5.190 4.375 3.631 5.202 0.012 16 0 "[ . 1 . 2]" 1
749 1 29 ASN HA 1 61 TYR QE 3.980 . 3.980 2.763 2.052 3.761 . 0 0 "[ . 1 . 2]" 1
750 1 29 ASN QB 1 30 ARG H 4.000 . 4.000 3.907 3.620 3.992 . 0 0 "[ . 1 . 2]" 1
751 1 29 ASN QB 1 30 ARG QG 4.520 . 4.520 4.436 4.339 4.512 . 0 0 "[ . 1 . 2]" 1
752 1 29 ASN HB2 1 30 ARG H 4.800 . 4.800 4.287 3.867 4.428 . 0 0 "[ . 1 . 2]" 1
753 1 29 ASN HB2 1 30 ARG QG 5.160 . 5.160 4.869 4.652 5.219 0.059 16 0 "[ . 1 . 2]" 1
754 1 29 ASN HB3 1 30 ARG H 4.800 . 4.800 4.513 4.236 4.635 . 0 0 "[ . 1 . 2]" 1
755 1 29 ASN HB3 1 30 ARG QG 5.160 . 5.160 5.141 4.744 5.217 0.057 12 0 "[ . 1 . 2]" 1
756 1 30 ARG H 1 30 ARG HB2 4.000 . 4.000 3.576 3.506 3.654 . 0 0 "[ . 1 . 2]" 1
757 1 30 ARG H 1 30 ARG HB3 4.000 . 4.000 3.826 3.723 3.927 . 0 0 "[ . 1 . 2]" 1
758 1 30 ARG H 1 30 ARG QD 4.720 . 4.720 4.201 3.972 4.396 . 0 0 "[ . 1 . 2]" 1
759 1 30 ARG H 1 30 ARG QG 3.400 . 3.400 2.282 2.054 2.440 . 0 0 "[ . 1 . 2]" 1
760 1 30 ARG H 1 31 PRO QD 4.690 . 4.690 2.694 2.554 2.821 . 0 0 "[ . 1 . 2]" 1
761 1 30 ARG H 1 61 TYR QD 5.010 . 5.010 3.403 3.137 3.856 . 0 0 "[ . 1 . 2]" 1
762 1 30 ARG H 1 61 TYR QE 4.210 . 4.210 3.415 2.996 3.667 . 0 0 "[ . 1 . 2]" 1
763 1 30 ARG HA 1 30 ARG QD 4.510 . 4.510 3.733 3.550 3.869 . 0 0 "[ . 1 . 2]" 1
764 1 30 ARG HA 1 30 ARG HE 5.390 . 5.390 4.882 4.609 5.075 . 0 0 "[ . 1 . 2]" 1
765 1 30 ARG HA 1 30 ARG QG 3.360 . 3.360 2.461 2.230 2.593 . 0 0 "[ . 1 . 2]" 1
766 1 30 ARG HA 1 31 PRO QD 3.120 . 3.120 2.578 2.502 2.671 . 0 0 "[ . 1 . 2]" 1
767 1 30 ARG HA 1 32 ALA MB 4.770 . 4.770 4.596 4.269 4.807 0.037 18 0 "[ . 1 . 2]" 1
768 1 30 ARG QB 1 30 ARG HE 3.960 . 3.960 2.379 2.031 3.781 . 0 0 "[ . 1 . 2]" 1
769 1 30 ARG QB 1 61 TYR QD 5.340 . 5.340 4.910 4.521 5.379 0.039 16 0 "[ . 1 . 2]" 1
770 1 30 ARG QB 1 61 TYR QE 5.150 . 5.150 4.243 4.111 4.507 . 0 0 "[ . 1 . 2]" 1
771 1 30 ARG HB2 1 30 ARG QD 3.310 . 3.310 3.099 2.375 3.303 . 0 0 "[ . 1 . 2]" 1
772 1 30 ARG HB2 1 30 ARG HE 4.520 . 4.520 2.519 2.091 4.577 0.057 19 0 "[ . 1 . 2]" 1
773 1 30 ARG HB2 1 31 PRO QD 4.430 . 4.430 4.426 4.374 4.457 0.027 4 0 "[ . 1 . 2]" 1
774 1 30 ARG HB3 1 30 ARG QD 3.310 . 3.310 2.312 2.143 2.419 . 0 0 "[ . 1 . 2]" 1
775 1 30 ARG HB3 1 30 ARG HE 4.520 . 4.520 3.055 2.611 4.029 . 0 0 "[ . 1 . 2]" 1
776 1 30 ARG HB3 1 31 PRO QD 4.430 . 4.430 4.450 4.414 4.482 0.052 12 0 "[ . 1 . 2]" 1
777 1 30 ARG QD 1 31 PRO QD 5.500 . 5.500 5.532 5.466 5.598 0.098 8 0 "[ . 1 . 2]" 1
778 1 30 ARG QD 1 61 TYR QD 5.030 . 5.030 3.695 2.964 4.466 . 0 0 "[ . 1 . 2]" 1
779 1 30 ARG QD 1 61 TYR QE 3.890 . 3.890 3.361 2.891 3.905 0.015 13 0 "[ . 1 . 2]" 1
780 1 30 ARG HE 1 30 ARG QG 3.760 . 3.760 2.573 2.287 3.198 . 0 0 "[ . 1 . 2]" 1
781 1 30 ARG QG 1 31 PRO HA 5.500 . 5.500 5.594 5.552 5.656 0.156 17 0 "[ . 1 . 2]" 1
782 1 30 ARG QG 1 31 PRO QD 4.240 . 4.240 4.079 3.985 4.144 . 0 0 "[ . 1 . 2]" 1
783 1 30 ARG QG 1 61 TYR QD 4.720 . 4.720 2.846 2.494 3.396 . 0 0 "[ . 1 . 2]" 1
784 1 30 ARG QG 1 61 TYR QE 4.140 . 4.140 2.289 2.121 2.651 . 0 0 "[ . 1 . 2]" 1
785 1 31 PRO HA 1 32 ALA MB 4.880 . 4.880 4.237 4.145 4.312 . 0 0 "[ . 1 . 2]" 1
786 1 31 PRO HB2 1 32 ALA H 3.590 . 3.590 3.260 2.980 3.509 . 0 0 "[ . 1 . 2]" 1
787 1 31 PRO HB2 1 32 ALA MB 4.750 . 4.750 4.740 4.632 4.776 0.026 6 0 "[ . 1 . 2]" 1
788 1 31 PRO HB2 1 33 SER H 4.000 . 4.000 2.511 2.215 2.817 . 0 0 "[ . 1 . 2]" 1
789 1 31 PRO HB3 1 32 ALA H 3.900 . 3.900 3.956 3.936 3.993 0.093 16 0 "[ . 1 . 2]" 1
790 1 31 PRO HB3 1 33 SER H 4.580 . 4.580 4.176 3.960 4.472 . 0 0 "[ . 1 . 2]" 1
791 1 31 PRO QD 1 32 ALA H 5.000 . 5.000 2.522 2.249 2.918 . 0 0 "[ . 1 . 2]" 1
792 1 31 PRO QD 1 61 TYR QE 5.500 . 5.500 5.563 5.180 5.670 0.170 7 0 "[ . 1 . 2]" 1
793 1 31 PRO HG2 1 32 ALA H 4.370 . 4.370 2.144 2.030 2.363 . 0 0 "[ . 1 . 2]" 1
794 1 31 PRO HG2 1 32 ALA HA 4.530 . 4.530 3.763 3.606 3.874 . 0 0 "[ . 1 . 2]" 1
795 1 31 PRO HG3 1 32 ALA H 4.440 . 4.440 3.691 3.611 3.780 . 0 0 "[ . 1 . 2]" 1
796 1 32 ALA H 1 32 ALA HA 2.700 . 2.700 2.277 2.251 2.295 . 0 0 "[ . 1 . 2]" 1
797 1 32 ALA H 1 33 SER H 3.250 . 3.250 2.787 2.633 2.941 . 0 0 "[ . 1 . 2]" 1
798 1 32 ALA HA 1 33 SER H 2.910 . 2.910 2.935 2.903 2.959 0.049 18 0 "[ . 1 . 2]" 1
799 1 32 ALA MB 1 33 SER H 3.840 . 3.840 3.623 3.537 3.690 . 0 0 "[ . 1 . 2]" 1
800 1 33 SER H 1 33 SER HB2 4.140 . 4.140 3.385 2.428 3.966 . 0 0 "[ . 1 . 2]" 1
801 1 33 SER H 1 33 SER QB 3.530 . 3.530 2.952 2.393 3.271 . 0 0 "[ . 1 . 2]" 1
802 1 33 SER H 1 33 SER HB3 4.140 . 4.140 3.535 2.942 3.925 . 0 0 "[ . 1 . 2]" 1
803 1 33 SER H 1 34 ARG H 4.480 . 4.480 3.895 1.686 4.410 . 0 0 "[ . 1 . 2]" 1
804 1 33 SER HA 1 34 ARG H 2.990 . 2.990 2.516 2.259 3.044 0.054 13 0 "[ . 1 . 2]" 1
805 1 33 SER HA 1 35 VAL H 4.510 . 4.510 4.148 3.848 4.514 0.004 12 0 "[ . 1 . 2]" 1
806 1 33 SER HA 1 35 VAL QG 4.940 . 4.940 3.963 3.571 4.180 . 0 0 "[ . 1 . 2]" 1
807 1 33 SER QB 1 34 ARG H 3.550 . 3.550 2.794 2.151 3.449 . 0 0 "[ . 1 . 2]" 1
808 1 33 SER QB 1 35 VAL H 3.960 . 3.960 2.793 2.381 3.290 . 0 0 "[ . 1 . 2]" 1
809 1 33 SER QB 1 35 VAL QG 3.820 . 3.820 2.205 1.953 2.710 . 0 0 "[ . 1 . 2]" 1
810 1 33 SER HB2 1 34 ARG H 4.090 . 4.090 3.158 2.166 4.093 0.003 8 0 "[ . 1 . 2]" 1
811 1 33 SER HB2 1 35 VAL H 4.540 . 4.540 3.096 2.542 4.542 0.002 11 0 "[ . 1 . 2]" 1
812 1 33 SER HB2 1 35 VAL MG1 5.300 . 5.300 3.087 2.088 5.326 0.026 4 0 "[ . 1 . 2]" 1
813 1 33 SER HB2 1 35 VAL MG2 5.300 . 5.300 3.022 2.069 4.482 . 0 0 "[ . 1 . 2]" 1
814 1 33 SER HB3 1 34 ARG H 4.090 . 4.090 3.645 2.337 4.144 0.054 12 0 "[ . 1 . 2]" 1
815 1 33 SER HB3 1 35 VAL H 4.540 . 4.540 3.875 2.428 4.544 0.004 1 0 "[ . 1 . 2]" 1
816 1 33 SER HB3 1 35 VAL MG1 5.300 . 5.300 3.631 2.104 5.252 . 0 0 "[ . 1 . 2]" 1
817 1 33 SER HB3 1 35 VAL MG2 5.300 . 5.300 3.728 2.024 4.877 . 0 0 "[ . 1 . 2]" 1
818 1 34 ARG H 1 34 ARG HB2 3.870 . 3.870 3.181 2.361 3.896 0.026 12 0 "[ . 1 . 2]" 1
819 1 34 ARG H 1 34 ARG QB 3.120 . 3.120 2.754 2.331 3.126 0.006 15 0 "[ . 1 . 2]" 1
820 1 34 ARG H 1 34 ARG HB3 3.870 . 3.870 3.451 2.725 3.922 0.052 17 0 "[ . 1 . 2]" 1
821 1 34 ARG H 1 34 ARG QD 4.740 . 4.740 4.018 2.608 4.768 0.028 12 0 "[ . 1 . 2]" 1
822 1 34 ARG H 1 34 ARG QG 3.640 . 3.640 2.795 1.925 3.678 0.038 13 0 "[ . 1 . 2]" 1
823 1 34 ARG H 1 35 VAL H 3.230 . 3.230 2.503 2.083 3.266 0.036 9 0 "[ . 1 . 2]" 1
824 1 34 ARG H 1 35 VAL HA 5.160 . 5.160 4.631 3.895 5.241 0.081 17 0 "[ . 1 . 2]" 1
825 1 34 ARG H 1 35 VAL QG 4.070 . 4.070 3.089 2.592 3.827 . 0 0 "[ . 1 . 2]" 1
826 1 34 ARG HA 1 34 ARG HB2 3.020 . 3.020 2.721 2.397 3.030 0.010 11 0 "[ . 1 . 2]" 1
827 1 34 ARG HA 1 34 ARG HB3 3.020 . 3.020 2.542 2.396 2.965 . 0 0 "[ . 1 . 2]" 1
828 1 34 ARG HA 1 34 ARG QG 3.380 . 3.380 2.911 2.076 3.391 0.011 15 0 "[ . 1 . 2]" 1
829 1 34 ARG HA 1 35 VAL H 3.040 . 3.040 2.989 2.709 3.092 0.052 16 0 "[ . 1 . 2]" 1
830 1 34 ARG HA 1 35 VAL QG 4.760 . 4.760 4.039 3.784 4.216 . 0 0 "[ . 1 . 2]" 1
831 1 34 ARG HA 1 36 SER H 4.870 . 4.870 3.597 3.107 4.384 . 0 0 "[ . 1 . 2]" 1
832 1 34 ARG QB 1 34 ARG QD 3.000 . 3.000 2.229 1.974 2.702 . 0 0 "[ . 1 . 2]" 1
833 1 34 ARG QB 1 34 ARG QG 2.420 . 2.420 2.075 2.015 2.121 . 0 0 "[ . 1 . 2]" 1
834 1 34 ARG QB 1 35 VAL QG 5.100 . 5.100 4.108 3.442 4.577 . 0 0 "[ . 1 . 2]" 1
835 1 34 ARG HB2 1 34 ARG QD 3.590 . 3.590 2.676 2.076 3.553 . 0 0 "[ . 1 . 2]" 1
836 1 34 ARG HB2 1 35 VAL H 4.720 . 4.720 4.222 3.774 4.497 . 0 0 "[ . 1 . 2]" 1
837 1 34 ARG HB3 1 34 ARG QD 3.590 . 3.590 2.564 2.204 3.228 . 0 0 "[ . 1 . 2]" 1
838 1 34 ARG HB3 1 35 VAL H 4.720 . 4.720 4.408 3.914 4.623 . 0 0 "[ . 1 . 2]" 1
839 1 34 ARG QD 1 35 VAL H 5.500 . 5.500 5.190 4.536 5.609 0.109 18 0 "[ . 1 . 2]" 1
840 1 34 ARG QG 1 35 VAL H 4.750 . 4.750 4.177 3.358 4.801 0.051 17 0 "[ . 1 . 2]" 1
841 1 35 VAL H 1 35 VAL HB 3.790 . 3.790 3.677 3.625 3.796 0.006 4 0 "[ . 1 . 2]" 1
842 1 35 VAL H 1 35 VAL MG1 3.340 . 3.340 2.346 2.007 2.803 . 0 0 "[ . 1 . 2]" 1
843 1 35 VAL H 1 35 VAL QG 2.750 . 2.750 1.910 1.821 2.078 . 0 0 "[ . 1 . 2]" 1
844 1 35 VAL H 1 35 VAL MG2 3.340 . 3.340 2.047 1.910 2.295 . 0 0 "[ . 1 . 2]" 1
845 1 35 VAL H 1 36 SER H 3.280 . 3.280 2.513 1.872 3.294 0.014 19 0 "[ . 1 . 2]" 1
846 1 35 VAL HA 1 35 VAL MG1 3.370 . 3.370 2.326 2.261 2.356 . 0 0 "[ . 1 . 2]" 1
847 1 35 VAL HA 1 35 VAL MG2 3.370 . 3.370 3.265 3.250 3.278 . 0 0 "[ . 1 . 2]" 1
848 1 35 VAL HB 1 36 SER H 4.120 . 4.120 3.990 3.503 4.136 0.016 2 0 "[ . 1 . 2]" 1
849 1 35 VAL QG 1 36 SER H 3.370 . 3.370 2.482 1.968 2.754 . 0 0 "[ . 1 . 2]" 1
850 1 35 VAL QG 1 36 SER HA 3.950 . 3.950 3.843 3.213 4.114 0.164 13 0 "[ . 1 . 2]" 1
851 1 35 VAL QG 1 36 SER QB 4.380 . 4.380 3.532 2.558 4.441 0.061 8 0 "[ . 1 . 2]" 1
852 1 35 VAL QG 1 37 ARG H 5.390 . 5.390 4.339 1.648 5.462 0.072 16 0 "[ . 1 . 2]" 1
853 1 35 VAL MG1 1 36 SER H 4.030 . 4.030 4.066 3.939 4.159 0.129 17 0 "[ . 1 . 2]" 1
854 1 35 VAL MG2 1 36 SER H 4.030 . 4.030 2.508 1.973 2.795 . 0 0 "[ . 1 . 2]" 1
855 1 36 SER H 1 36 SER HB2 4.140 . 4.140 3.330 2.555 4.076 . 0 0 "[ . 1 . 2]" 1
856 1 36 SER H 1 36 SER QB 3.360 . 3.360 2.985 2.501 3.310 . 0 0 "[ . 1 . 2]" 1
857 1 36 SER H 1 36 SER HB3 4.140 . 4.140 3.574 2.736 4.018 . 0 0 "[ . 1 . 2]" 1
858 1 36 SER H 1 37 ARG H 4.530 . 4.530 3.842 2.108 4.573 0.043 9 0 "[ . 1 . 2]" 1
859 1 36 SER HA 1 37 ARG H 2.940 . 2.940 2.589 2.141 2.951 0.011 20 0 "[ . 1 . 2]" 1
860 1 36 SER HA 1 38 ARG H 4.520 . 4.520 3.923 2.952 4.486 . 0 0 "[ . 1 . 2]" 1
861 1 36 SER QB 1 37 ARG H 3.930 . 3.930 3.165 2.142 3.935 0.005 10 0 "[ . 1 . 2]" 1
862 1 36 SER QB 1 38 ARG H 3.890 . 3.890 3.038 2.374 3.934 0.044 2 0 "[ . 1 . 2]" 1
863 1 36 SER QB 1 38 ARG QG 4.360 . 4.360 3.313 1.971 4.406 0.046 2 0 "[ . 1 . 2]" 1
864 1 36 SER HB2 1 37 ARG H 4.660 . 4.660 3.655 2.245 4.591 . 0 0 "[ . 1 . 2]" 1
865 1 36 SER HB3 1 37 ARG H 4.660 . 4.660 3.729 2.538 4.622 . 0 0 "[ . 1 . 2]" 1
866 1 37 ARG H 1 37 ARG HB2 3.890 . 3.890 2.991 2.240 3.906 0.016 7 0 "[ . 1 . 2]" 1
867 1 37 ARG H 1 37 ARG QB 3.180 . 3.180 2.672 2.217 3.278 0.098 19 0 "[ . 1 . 2]" 1
868 1 37 ARG H 1 37 ARG HB3 3.890 . 3.890 3.501 2.842 3.922 0.032 17 0 "[ . 1 . 2]" 1
869 1 37 ARG H 1 37 ARG QG 3.640 . 3.640 2.721 2.122 3.726 0.086 11 0 "[ . 1 . 2]" 1
870 1 37 ARG H 1 38 ARG H 3.710 . 3.710 2.723 2.058 3.473 . 0 0 "[ . 1 . 2]" 1
871 1 37 ARG H 1 39 SER H 5.220 . 5.220 4.441 3.861 5.075 . 0 0 "[ . 1 . 2]" 1
872 1 37 ARG HA 1 38 ARG H 3.420 . 3.420 3.105 2.641 3.388 . 0 0 "[ . 1 . 2]" 1
873 1 37 ARG QB 1 38 ARG H 4.390 . 4.390 3.731 3.202 4.079 . 0 0 "[ . 1 . 2]" 1
874 1 38 ARG H 1 38 ARG QB 3.300 . 3.300 2.832 2.353 3.337 0.037 17 0 "[ . 1 . 2]" 1
875 1 38 ARG H 1 38 ARG QD 4.540 . 4.540 4.083 3.385 4.566 0.026 4 0 "[ . 1 . 2]" 1
876 1 38 ARG H 1 38 ARG QG 3.470 . 3.470 2.476 2.131 2.745 . 0 0 "[ . 1 . 2]" 1
877 1 38 ARG H 1 39 SER H 3.150 . 3.150 2.632 2.262 3.142 . 0 0 "[ . 1 . 2]" 1
878 1 38 ARG QB 1 38 ARG QD 3.240 . 3.240 2.222 2.078 2.341 . 0 0 "[ . 1 . 2]" 1
879 1 38 ARG HB2 1 38 ARG QD 3.870 . 3.870 2.642 2.307 3.338 . 0 0 "[ . 1 . 2]" 1
880 1 38 ARG HB2 1 39 SER H 4.640 . 4.640 3.985 2.688 4.518 . 0 0 "[ . 1 . 2]" 1
881 1 38 ARG HB3 1 38 ARG QD 3.870 . 3.870 2.628 2.202 3.407 . 0 0 "[ . 1 . 2]" 1
882 1 38 ARG HB3 1 39 SER H 4.640 . 4.640 4.330 3.679 4.648 0.008 13 0 "[ . 1 . 2]" 1
883 1 38 ARG QG 1 39 SER H 4.470 . 4.470 4.037 2.475 4.546 0.076 8 0 "[ . 1 . 2]" 1
884 1 39 SER H 1 39 SER HB2 3.960 . 3.960 2.917 2.471 3.882 . 0 0 "[ . 1 . 2]" 1
885 1 39 SER H 1 39 SER QB 3.410 . 3.410 2.652 2.252 3.243 . 0 0 "[ . 1 . 2]" 1
886 1 39 SER H 1 39 SER HB3 3.960 . 3.960 3.330 2.481 3.771 . 0 0 "[ . 1 . 2]" 1
887 1 39 SER H 1 40 PRO HD2 5.300 . 5.300 4.776 3.907 5.095 . 0 0 "[ . 1 . 2]" 1
888 1 39 SER H 1 40 PRO QD 4.480 . 4.480 4.084 3.124 4.524 0.044 10 0 "[ . 1 . 2]" 1
889 1 39 SER H 1 40 PRO HD3 5.300 . 5.300 4.485 3.226 5.299 . 0 0 "[ . 1 . 2]" 1
890 1 39 SER HA 1 40 PRO HD2 3.410 . 3.410 2.391 2.226 2.708 . 0 0 "[ . 1 . 2]" 1
891 1 39 SER HA 1 40 PRO HD3 3.410 . 3.410 2.596 2.327 3.080 . 0 0 "[ . 1 . 2]" 1
892 1 39 SER QB 1 41 GLN H 5.010 . 5.010 4.138 3.363 5.046 0.036 3 0 "[ . 1 . 2]" 1
893 1 40 PRO HA 1 41 GLN H 2.750 . 2.750 2.408 2.104 2.775 0.025 13 0 "[ . 1 . 2]" 1
894 1 40 PRO QB 1 41 GLN H 4.040 . 4.040 3.857 3.293 4.061 0.021 8 0 "[ . 1 . 2]" 1
895 1 40 PRO QD 1 41 GLN H 4.920 . 4.920 4.451 3.736 4.948 0.028 3 0 "[ . 1 . 2]" 1
896 1 41 GLN H 1 41 GLN HB2 3.640 . 3.640 2.628 2.224 3.686 0.046 2 0 "[ . 1 . 2]" 1
897 1 41 GLN H 1 41 GLN QB 2.900 . 2.900 2.454 2.166 2.906 0.006 2 0 "[ . 1 . 2]" 1
898 1 41 GLN H 1 41 GLN HB3 3.640 . 3.640 3.265 2.539 3.690 0.050 4 0 "[ . 1 . 2]" 1
899 1 41 GLN H 1 41 GLN QG 4.150 . 4.150 3.291 2.126 4.167 0.017 19 0 "[ . 1 . 2]" 1
900 1 41 GLN H 1 42 ARG H 4.660 . 4.660 4.199 2.631 4.661 0.001 1 0 "[ . 1 . 2]" 1
901 1 41 GLN HA 1 41 GLN QG 3.180 . 3.180 2.437 2.163 3.278 0.098 2 0 "[ . 1 . 2]" 1
902 1 41 GLN QB 1 42 ARG H 3.770 . 3.770 2.848 2.009 3.787 0.017 10 0 "[ . 1 . 2]" 1
903 1 41 GLN HB2 1 42 ARG H 4.510 . 4.510 3.757 2.039 4.401 . 0 0 "[ . 1 . 2]" 1
904 1 41 GLN HB3 1 42 ARG H 4.510 . 4.510 3.132 2.134 4.187 . 0 0 "[ . 1 . 2]" 1
905 1 41 GLN QE 1 41 GLN QG 3.070 . 3.070 2.230 2.080 2.813 . 0 0 "[ . 1 . 2]" 1
906 1 41 GLN HE22 1 41 GLN QG 3.670 . 3.670 2.273 2.105 2.951 . 0 0 "[ . 1 . 2]" 1
907 1 41 GLN QG 1 42 ARG H 4.080 . 4.080 3.407 2.219 4.137 0.057 11 0 "[ . 1 . 2]" 1
908 1 42 ARG H 1 42 ARG HB2 3.760 . 3.760 2.953 2.342 3.788 0.028 9 0 "[ . 1 . 2]" 1
909 1 42 ARG H 1 42 ARG QB 3.170 . 3.170 2.484 2.314 2.824 . 0 0 "[ . 1 . 2]" 1
910 1 42 ARG H 1 42 ARG HB3 3.760 . 3.760 3.211 2.431 3.762 0.002 12 0 "[ . 1 . 2]" 1
911 1 42 ARG H 1 42 ARG QD 4.260 . 4.260 4.070 3.563 4.353 0.093 12 0 "[ . 1 . 2]" 1
912 1 42 ARG H 1 42 ARG QG 3.430 . 3.430 2.504 2.013 3.247 . 0 0 "[ . 1 . 2]" 1
913 1 42 ARG HA 1 42 ARG QG 3.410 . 3.410 2.780 2.266 3.408 . 0 0 "[ . 1 . 2]" 1
914 1 42 ARG HA 1 46 GLU HG2 5.130 . 5.130 4.031 2.920 5.138 0.008 5 0 "[ . 1 . 2]" 1
915 1 42 ARG HA 1 46 GLU HG3 5.130 . 5.130 2.910 2.069 5.133 0.003 8 0 "[ . 1 . 2]" 1
916 1 42 ARG QB 1 43 GLY H 3.410 . 3.410 2.513 1.823 2.878 . 0 0 "[ . 1 . 2]" 1
917 1 42 ARG QB 1 46 GLU QG 3.740 . 3.740 3.074 2.225 3.789 0.049 19 0 "[ . 1 . 2]" 1
918 1 42 ARG HB2 1 42 ARG QD 3.330 . 3.330 2.487 2.123 3.367 0.037 4 0 "[ . 1 . 2]" 1
919 1 42 ARG HB2 1 43 GLY H 4.010 . 4.010 3.260 2.287 4.017 0.007 18 0 "[ . 1 . 2]" 1
920 1 42 ARG HB3 1 42 ARG QD 3.330 . 3.330 2.426 1.966 3.370 0.040 2 0 "[ . 1 . 2]" 1
921 1 42 ARG HB3 1 43 GLY H 4.010 . 4.010 3.093 1.836 3.996 . 0 0 "[ . 1 . 2]" 1
922 1 42 ARG QD 1 46 GLU QG 4.270 . 4.270 4.183 3.571 4.398 0.128 9 0 "[ . 1 . 2]" 1
923 1 42 ARG QG 1 43 GLY H 4.140 . 4.140 3.776 2.846 4.190 0.050 4 0 "[ . 1 . 2]" 1
924 1 42 ARG QG 1 46 GLU HB2 5.500 . 5.500 4.881 3.401 5.539 0.039 9 0 "[ . 1 . 2]" 1
925 1 42 ARG QG 1 46 GLU QG 4.550 . 4.550 3.950 2.971 4.636 0.086 2 0 "[ . 1 . 2]" 1
926 1 43 GLY H 1 44 ILE H 4.430 . 4.430 4.301 3.829 4.457 0.027 13 0 "[ . 1 . 2]" 1
927 1 43 GLY H 1 45 VAL H 5.190 . 5.190 4.229 3.515 4.688 . 0 0 "[ . 1 . 2]" 1
928 1 43 GLY H 1 46 GLU H 5.080 . 5.080 3.074 2.557 3.654 . 0 0 "[ . 1 . 2]" 1
929 1 43 GLY H 1 46 GLU HB2 4.190 . 4.190 3.070 2.583 3.911 . 0 0 "[ . 1 . 2]" 1
930 1 43 GLY H 1 46 GLU HB3 5.340 . 5.340 4.430 4.040 5.266 . 0 0 "[ . 1 . 2]" 1
931 1 43 GLY H 1 46 GLU HG2 4.770 . 4.770 3.786 3.372 4.198 . 0 0 "[ . 1 . 2]" 1
932 1 43 GLY H 1 46 GLU QG 4.160 . 4.160 2.155 1.609 3.330 . 0 0 "[ . 1 . 2]" 1
933 1 43 GLY H 1 46 GLU HG3 4.770 . 4.770 2.206 1.613 4.141 . 0 0 "[ . 1 . 2]" 1
934 1 43 GLY H 1 61 TYR QE 5.500 . 5.500 5.361 5.182 5.514 0.014 18 0 "[ . 1 . 2]" 1
935 1 43 GLY QA 1 44 ILE HB 4.830 . 4.830 4.287 4.161 4.413 . 0 0 "[ . 1 . 2]" 1
936 1 43 GLY QA 1 44 ILE MG 3.960 . 3.960 3.623 3.490 3.789 . 0 0 "[ . 1 . 2]" 1
937 1 43 GLY QA 1 45 VAL H 4.700 . 4.700 3.424 3.036 3.829 . 0 0 "[ . 1 . 2]" 1
938 1 43 GLY QA 1 46 GLU QG 5.180 . 5.180 3.963 3.395 4.683 . 0 0 "[ . 1 . 2]" 1
939 1 43 GLY QA 1 61 TYR QE 4.250 . 4.250 2.658 2.335 2.956 . 0 0 "[ . 1 . 2]" 1
940 1 44 ILE H 1 44 ILE HB 3.630 . 3.630 2.457 2.363 2.554 . 0 0 "[ . 1 . 2]" 1
941 1 44 ILE H 1 44 ILE MD 4.530 . 4.530 4.113 4.045 4.212 . 0 0 "[ . 1 . 2]" 1
942 1 44 ILE H 1 44 ILE HG12 4.790 . 4.790 4.632 4.571 4.685 . 0 0 "[ . 1 . 2]" 1
943 1 44 ILE H 1 44 ILE HG13 4.590 . 4.590 4.478 4.445 4.514 . 0 0 "[ . 1 . 2]" 1
944 1 44 ILE H 1 44 ILE MG 3.010 . 3.010 2.153 2.045 2.266 . 0 0 "[ . 1 . 2]" 1
945 1 44 ILE H 1 45 VAL H 4.160 . 4.160 2.768 2.571 2.918 . 0 0 "[ . 1 . 2]" 1
946 1 44 ILE H 1 45 VAL QG 5.170 . 5.170 3.810 3.454 3.986 . 0 0 "[ . 1 . 2]" 1
947 1 44 ILE H 1 61 TYR QD 4.840 . 4.840 3.898 3.633 4.036 . 0 0 "[ . 1 . 2]" 1
948 1 44 ILE H 1 61 TYR QE 4.020 . 4.020 2.850 2.489 3.032 . 0 0 "[ . 1 . 2]" 1
949 1 44 ILE HA 1 44 ILE MD 3.220 . 3.220 2.222 2.146 2.298 . 0 0 "[ . 1 . 2]" 1
950 1 44 ILE HA 1 44 ILE HG12 3.940 . 3.940 3.778 3.749 3.809 . 0 0 "[ . 1 . 2]" 1
951 1 44 ILE HA 1 44 ILE HG13 3.600 . 3.600 2.870 2.782 2.931 . 0 0 "[ . 1 . 2]" 1
952 1 44 ILE HA 1 44 ILE MG 3.520 . 3.520 3.264 3.251 3.280 . 0 0 "[ . 1 . 2]" 1
953 1 44 ILE HA 1 46 GLU H 5.090 . 5.090 4.031 3.935 4.154 . 0 0 "[ . 1 . 2]" 1
954 1 44 ILE HA 1 47 GLU H 4.280 . 4.280 3.075 2.960 3.256 . 0 0 "[ . 1 . 2]" 1
955 1 44 ILE HA 1 47 GLU HB2 4.070 . 4.070 2.564 2.182 2.917 . 0 0 "[ . 1 . 2]" 1
956 1 44 ILE HA 1 47 GLU HB3 4.980 . 4.980 4.170 3.840 4.536 . 0 0 "[ . 1 . 2]" 1
957 1 44 ILE HA 1 47 GLU HG2 4.780 . 4.780 3.138 2.391 4.794 0.014 1 0 "[ . 1 . 2]" 1
958 1 44 ILE HA 1 47 GLU QG 4.160 . 4.160 2.741 2.324 3.470 . 0 0 "[ . 1 . 2]" 1
959 1 44 ILE HA 1 47 GLU HG3 4.780 . 4.780 3.222 2.560 3.852 . 0 0 "[ . 1 . 2]" 1
960 1 44 ILE HA 1 48 CYS H 4.580 . 4.580 4.041 3.882 4.113 . 0 0 "[ . 1 . 2]" 1
961 1 44 ILE HA 1 57 LEU QD 4.260 . 4.260 3.916 3.583 4.199 . 0 0 "[ . 1 . 2]" 1
962 1 44 ILE HA 1 61 TYR QE 4.730 . 4.730 3.272 3.136 3.393 . 0 0 "[ . 1 . 2]" 1
963 1 44 ILE HB 1 44 ILE MD 3.550 . 3.550 2.374 2.338 2.404 . 0 0 "[ . 1 . 2]" 1
964 1 44 ILE HB 1 45 VAL H 4.620 . 4.620 4.048 4.009 4.133 . 0 0 "[ . 1 . 2]" 1
965 1 44 ILE HB 1 61 TYR QD 4.510 . 4.510 3.173 3.012 3.342 . 0 0 "[ . 1 . 2]" 1
966 1 44 ILE HB 1 61 TYR QE 4.470 . 4.470 3.379 3.212 3.489 . 0 0 "[ . 1 . 2]" 1
967 1 44 ILE MD 1 44 ILE MG 3.280 . 3.280 3.225 3.181 3.255 . 0 0 "[ . 1 . 2]" 1
968 1 44 ILE MD 1 45 VAL HA 5.500 . 5.500 5.234 5.128 5.325 . 0 0 "[ . 1 . 2]" 1
969 1 44 ILE MD 1 47 GLU H 4.850 . 4.850 4.319 4.156 4.623 . 0 0 "[ . 1 . 2]" 1
970 1 44 ILE MD 1 47 GLU HB2 3.720 . 3.720 2.642 2.312 3.170 . 0 0 "[ . 1 . 2]" 1
971 1 44 ILE MD 1 47 GLU HB3 4.540 . 4.540 3.683 3.175 4.144 . 0 0 "[ . 1 . 2]" 1
972 1 44 ILE MD 1 47 GLU QG 4.690 . 4.690 3.371 2.800 4.243 . 0 0 "[ . 1 . 2]" 1
973 1 44 ILE MD 1 48 CYS H 5.080 . 5.080 4.183 3.992 4.305 . 0 0 "[ . 1 . 2]" 1
974 1 44 ILE MD 1 48 CYS HB2 4.840 . 4.840 3.871 2.882 4.150 . 0 0 "[ . 1 . 2]" 1
975 1 44 ILE MD 1 48 CYS QB 4.000 . 4.000 3.673 2.830 3.904 . 0 0 "[ . 1 . 2]" 1
976 1 44 ILE MD 1 48 CYS HB3 4.840 . 4.840 4.615 4.137 4.805 . 0 0 "[ . 1 . 2]" 1
977 1 44 ILE MD 1 57 LEU QD 3.040 . 3.040 2.457 2.164 2.754 . 0 0 "[ . 1 . 2]" 1
978 1 44 ILE MD 1 57 LEU HG 5.240 . 5.240 4.823 4.503 5.221 . 0 0 "[ . 1 . 2]" 1
979 1 44 ILE MD 1 58 LEU H 4.410 . 4.410 3.975 3.747 4.130 . 0 0 "[ . 1 . 2]" 1
980 1 44 ILE MD 1 58 LEU HA 3.110 . 3.110 1.999 1.939 2.084 . 0 0 "[ . 1 . 2]" 1
981 1 44 ILE MD 1 58 LEU HB2 4.050 . 4.050 3.050 2.920 3.143 . 0 0 "[ . 1 . 2]" 1
982 1 44 ILE MD 1 58 LEU QB 3.520 . 3.520 2.969 2.859 3.049 . 0 0 "[ . 1 . 2]" 1
983 1 44 ILE MD 1 58 LEU HB3 4.050 . 4.050 4.076 4.047 4.113 0.063 4 0 "[ . 1 . 2]" 1
984 1 44 ILE MD 1 58 LEU QD 3.170 . 3.170 2.736 2.498 2.886 . 0 0 "[ . 1 . 2]" 1
985 1 44 ILE MD 1 58 LEU HG 3.070 . 3.070 2.425 2.200 2.684 . 0 0 "[ . 1 . 2]" 1
986 1 44 ILE MD 1 59 GLU H 5.220 . 5.220 4.905 4.853 4.975 . 0 0 "[ . 1 . 2]" 1
987 1 44 ILE MD 1 60 THR H 5.500 . 5.500 4.815 4.724 4.921 . 0 0 "[ . 1 . 2]" 1
988 1 44 ILE MD 1 61 TYR H 4.560 . 4.560 3.974 3.788 4.319 . 0 0 "[ . 1 . 2]" 1
989 1 44 ILE MD 1 61 TYR QB 3.710 . 3.710 2.869 2.562 3.462 . 0 0 "[ . 1 . 2]" 1
990 1 44 ILE MD 1 61 TYR QD 3.310 . 3.310 2.340 2.226 2.581 . 0 0 "[ . 1 . 2]" 1
991 1 44 ILE MD 1 61 TYR QE 3.680 . 3.680 2.847 2.731 2.929 . 0 0 "[ . 1 . 2]" 1
992 1 44 ILE HG12 1 44 ILE MG 3.250 . 3.250 2.216 2.162 2.260 . 0 0 "[ . 1 . 2]" 1
993 1 44 ILE HG12 1 45 VAL H 4.870 . 4.870 4.890 4.878 4.913 0.043 8 0 "[ . 1 . 2]" 1
994 1 44 ILE HG12 1 47 GLU HB2 5.500 . 5.500 5.065 4.869 5.443 . 0 0 "[ . 1 . 2]" 1
995 1 44 ILE HG12 1 48 CYS H 5.500 . 5.500 5.475 5.375 5.511 0.011 20 0 "[ . 1 . 2]" 1
996 1 44 ILE HG12 1 48 CYS QB 4.440 . 4.440 4.254 3.889 4.447 0.007 12 0 "[ . 1 . 2]" 1
997 1 44 ILE HG12 1 57 LEU QD 5.110 . 5.110 4.863 4.515 5.183 0.073 4 0 "[ . 1 . 2]" 1
998 1 44 ILE HG12 1 58 LEU HA 4.880 . 4.880 4.014 3.626 4.309 . 0 0 "[ . 1 . 2]" 1
999 1 44 ILE HG12 1 61 TYR QD 5.310 . 5.310 4.439 4.237 4.659 . 0 0 "[ . 1 . 2]" 1
1000 1 44 ILE HG12 1 61 TYR QE 5.500 . 5.500 5.162 4.904 5.265 . 0 0 "[ . 1 . 2]" 1
1001 1 44 ILE HG13 1 44 ILE MG 3.020 . 3.020 2.504 2.446 2.541 . 0 0 "[ . 1 . 2]" 1
1002 1 44 ILE HG13 1 45 VAL H 4.780 . 4.780 4.110 4.059 4.202 . 0 0 "[ . 1 . 2]" 1
1003 1 44 ILE HG13 1 47 GLU H 5.130 . 5.130 4.500 4.403 4.612 . 0 0 "[ . 1 . 2]" 1
1004 1 44 ILE HG13 1 47 GLU HB2 5.040 . 5.040 3.657 3.446 3.964 . 0 0 "[ . 1 . 2]" 1
1005 1 44 ILE HG13 1 48 CYS H 4.900 . 4.900 3.730 3.646 3.775 . 0 0 "[ . 1 . 2]" 1
1006 1 44 ILE HG13 1 48 CYS HB2 4.950 . 4.950 3.008 2.677 3.207 . 0 0 "[ . 1 . 2]" 1
1007 1 44 ILE HG13 1 48 CYS QB 4.300 . 4.300 2.949 2.590 3.147 . 0 0 "[ . 1 . 2]" 1
1008 1 44 ILE HG13 1 48 CYS HB3 4.950 . 4.950 4.264 3.446 4.561 . 0 0 "[ . 1 . 2]" 1
1009 1 44 ILE HG13 1 49 CYS H 5.500 . 5.500 5.468 5.335 5.510 0.010 9 0 "[ . 1 . 2]" 1
1010 1 44 ILE HG13 1 57 LEU QD 4.640 . 4.640 4.379 4.109 4.563 . 0 0 "[ . 1 . 2]" 1
1011 1 44 ILE HG13 1 61 TYR QD 5.320 . 5.320 5.041 4.924 5.177 . 0 0 "[ . 1 . 2]" 1
1012 1 44 ILE HG13 1 61 TYR QE 5.090 . 5.090 5.100 5.074 5.127 0.037 16 0 "[ . 1 . 2]" 1
1013 1 44 ILE MG 1 45 VAL H 3.090 . 3.090 2.281 2.218 2.360 . 0 0 "[ . 1 . 2]" 1
1014 1 44 ILE MG 1 45 VAL HA 3.930 . 3.930 3.296 3.153 3.419 . 0 0 "[ . 1 . 2]" 1
1015 1 44 ILE MG 1 45 VAL HB 4.140 . 4.140 3.441 3.093 4.258 0.118 4 0 "[ . 1 . 2]" 1
1016 1 44 ILE MG 1 45 VAL QG 3.240 . 3.240 3.215 2.467 3.436 0.196 17 0 "[ . 1 . 2]" 1
1017 1 44 ILE MG 1 46 GLU H 4.550 . 4.550 4.443 4.224 4.519 . 0 0 "[ . 1 . 2]" 1
1018 1 44 ILE MG 1 47 GLU H 4.760 . 4.760 4.808 4.778 4.837 0.077 7 0 "[ . 1 . 2]" 1
1019 1 44 ILE MG 1 48 CYS QB 4.560 . 4.560 4.187 3.990 4.374 . 0 0 "[ . 1 . 2]" 1
1020 1 44 ILE MG 1 61 TYR QB 4.740 . 4.740 3.798 3.628 4.249 . 0 0 "[ . 1 . 2]" 1
1021 1 44 ILE MG 1 61 TYR QD 4.230 . 4.230 3.864 3.637 4.080 . 0 0 "[ . 1 . 2]" 1
1022 1 44 ILE MG 1 61 TYR QE 4.310 . 4.310 4.066 3.868 4.234 . 0 0 "[ . 1 . 2]" 1
1023 1 45 VAL H 1 45 VAL HB 3.200 . 3.200 2.639 2.515 2.848 . 0 0 "[ . 1 . 2]" 1
1024 1 45 VAL H 1 45 VAL MG1 3.780 . 3.780 2.143 1.829 3.783 0.003 1 0 "[ . 1 . 2]" 1
1025 1 45 VAL H 1 45 VAL QG 2.700 . 2.700 1.948 1.825 2.085 . 0 0 "[ . 1 . 2]" 1
1026 1 45 VAL H 1 45 VAL MG2 3.780 . 3.780 3.602 1.887 3.823 0.043 8 0 "[ . 1 . 2]" 1
1027 1 45 VAL H 1 46 GLU H 3.560 . 3.560 2.726 2.304 2.826 . 0 0 "[ . 1 . 2]" 1
1028 1 45 VAL H 1 46 GLU HG2 5.500 . 5.500 5.421 4.826 5.564 0.064 8 0 "[ . 1 . 2]" 1
1029 1 45 VAL H 1 46 GLU HG3 5.500 . 5.500 4.537 4.062 4.892 . 0 0 "[ . 1 . 2]" 1
1030 1 45 VAL H 1 47 GLU H 4.970 . 4.970 3.984 3.827 4.068 . 0 0 "[ . 1 . 2]" 1
1031 1 45 VAL HA 1 45 VAL MG1 3.190 . 3.190 3.148 2.343 3.243 0.053 11 0 "[ . 1 . 2]" 1
1032 1 45 VAL HA 1 45 VAL QG 2.780 . 2.780 2.316 2.150 2.429 . 0 0 "[ . 1 . 2]" 1
1033 1 45 VAL HA 1 45 VAL MG2 3.190 . 3.190 2.404 2.323 2.511 . 0 0 "[ . 1 . 2]" 1
1034 1 45 VAL HA 1 49 CYS H 4.140 . 4.140 3.268 3.162 3.391 . 0 0 "[ . 1 . 2]" 1
1035 1 45 VAL HA 1 49 CYS HB2 4.410 . 4.410 3.367 3.275 3.477 . 0 0 "[ . 1 . 2]" 1
1036 1 45 VAL HA 1 49 CYS HB3 4.170 . 4.170 3.630 3.334 3.818 . 0 0 "[ . 1 . 2]" 1
1037 1 45 VAL HA 1 50 PHE H 4.720 . 4.720 4.619 4.326 4.725 0.005 5 0 "[ . 1 . 2]" 1
1038 1 45 VAL HB 1 46 GLU H 4.280 . 4.280 4.047 2.668 4.259 . 0 0 "[ . 1 . 2]" 1
1039 1 45 VAL HB 1 46 GLU QG 5.340 . 5.340 4.904 3.066 5.289 . 0 0 "[ . 1 . 2]" 1
1040 1 45 VAL HB 1 50 PHE QD 5.500 . 5.500 5.205 3.422 5.439 . 0 0 "[ . 1 . 2]" 1
1041 1 45 VAL HB 1 50 PHE QE 5.150 . 5.150 4.807 2.924 5.065 . 0 0 "[ . 1 . 2]" 1
1042 1 45 VAL QG 1 46 GLU H 3.440 . 3.440 2.451 2.265 3.355 . 0 0 "[ . 1 . 2]" 1
1043 1 45 VAL QG 1 46 GLU HA 3.890 . 3.890 3.323 3.241 3.712 . 0 0 "[ . 1 . 2]" 1
1044 1 45 VAL QG 1 46 GLU HB2 5.440 . 5.440 4.130 3.884 4.963 . 0 0 "[ . 1 . 2]" 1
1045 1 45 VAL QG 1 46 GLU QG 3.820 . 3.820 2.550 2.305 3.566 . 0 0 "[ . 1 . 2]" 1
1046 1 45 VAL QG 1 47 GLU H 4.480 . 4.480 4.116 4.010 4.501 0.021 4 0 "[ . 1 . 2]" 1
1047 1 45 VAL QG 1 49 CYS H 3.730 . 3.730 3.624 3.511 3.710 . 0 0 "[ . 1 . 2]" 1
1048 1 45 VAL QG 1 49 CYS HA 4.560 . 4.560 4.584 4.468 4.650 0.090 16 0 "[ . 1 . 2]" 1
1049 1 45 VAL QG 1 49 CYS HB2 3.430 . 3.430 2.609 2.460 2.705 . 0 0 "[ . 1 . 2]" 1
1050 1 45 VAL QG 1 49 CYS HB3 3.280 . 3.280 2.342 2.076 2.429 . 0 0 "[ . 1 . 2]" 1
1051 1 45 VAL QG 1 50 PHE H 3.820 . 3.820 3.731 3.270 3.858 0.038 19 0 "[ . 1 . 2]" 1
1052 1 45 VAL QG 1 50 PHE QD 3.540 . 3.540 2.608 2.403 2.708 . 0 0 "[ . 1 . 2]" 1
1053 1 45 VAL QG 1 50 PHE QE 3.290 . 3.290 2.126 2.056 2.193 . 0 0 "[ . 1 . 2]" 1
1054 1 45 VAL QG 1 50 PHE HZ 3.960 . 3.960 3.989 3.653 4.050 0.090 20 0 "[ . 1 . 2]" 1
1055 1 45 VAL QG 1 51 ARG H 5.440 . 5.440 5.448 5.178 5.506 0.066 5 0 "[ . 1 . 2]" 1
1056 1 45 VAL MG1 1 46 GLU H 4.010 . 4.010 2.521 2.295 3.824 . 0 0 "[ . 1 . 2]" 1
1057 1 45 VAL MG1 1 46 GLU HG2 5.500 . 5.500 3.095 2.616 3.963 . 0 0 "[ . 1 . 2]" 1
1058 1 45 VAL MG1 1 46 GLU HG3 5.500 . 5.500 2.901 2.395 4.973 . 0 0 "[ . 1 . 2]" 1
1059 1 45 VAL MG1 1 47 GLU H 5.340 . 5.340 4.386 4.260 4.974 . 0 0 "[ . 1 . 2]" 1
1060 1 45 VAL MG1 1 49 CYS HB3 4.750 . 4.750 4.333 2.080 4.758 0.008 16 0 "[ . 1 . 2]" 1
1061 1 45 VAL MG1 1 50 PHE QD 4.510 . 4.510 3.587 2.410 4.025 . 0 0 "[ . 1 . 2]" 1
1062 1 45 VAL MG1 1 50 PHE HZ 5.500 . 5.500 5.007 3.703 5.516 0.016 16 0 "[ . 1 . 2]" 1
1063 1 45 VAL MG2 1 46 GLU H 4.010 . 4.010 3.732 3.492 3.879 . 0 0 "[ . 1 . 2]" 1
1064 1 45 VAL MG2 1 46 GLU HG2 5.500 . 5.500 4.135 3.652 5.381 . 0 0 "[ . 1 . 2]" 1
1065 1 45 VAL MG2 1 46 GLU HG3 5.500 . 5.500 4.504 3.866 4.965 . 0 0 "[ . 1 . 2]" 1
1066 1 45 VAL MG2 1 47 GLU H 5.340 . 5.340 5.001 4.857 5.139 . 0 0 "[ . 1 . 2]" 1
1067 1 45 VAL MG2 1 49 CYS HB3 4.750 . 4.750 2.584 2.274 4.466 . 0 0 "[ . 1 . 2]" 1
1068 1 45 VAL MG2 1 50 PHE QD 4.510 . 4.510 2.891 2.543 4.684 0.174 4 0 "[ . 1 . 2]" 1
1069 1 45 VAL MG2 1 50 PHE HZ 5.500 . 5.500 4.348 4.128 5.593 0.093 1 0 "[ . 1 . 2]" 1
1070 1 46 GLU H 1 46 GLU HB2 3.410 . 3.410 2.546 2.427 2.690 . 0 0 "[ . 1 . 2]" 1
1071 1 46 GLU H 1 46 GLU HB3 3.660 . 3.660 3.631 3.538 3.661 0.001 7 0 "[ . 1 . 2]" 1
1072 1 46 GLU H 1 46 GLU HG2 3.680 . 3.680 3.138 2.720 3.673 . 0 0 "[ . 1 . 2]" 1
1073 1 46 GLU H 1 46 GLU QG 3.210 . 3.210 2.343 2.076 2.615 . 0 0 "[ . 1 . 2]" 1
1074 1 46 GLU H 1 46 GLU HG3 3.680 . 3.680 2.436 2.098 2.777 . 0 0 "[ . 1 . 2]" 1
1075 1 46 GLU H 1 47 GLU H 3.690 . 3.690 2.419 2.335 2.524 . 0 0 "[ . 1 . 2]" 1
1076 1 46 GLU HA 1 46 GLU HG2 3.790 . 3.790 2.494 2.301 3.371 . 0 0 "[ . 1 . 2]" 1
1077 1 46 GLU HA 1 46 GLU QG 3.240 . 3.240 2.390 2.267 2.493 . 0 0 "[ . 1 . 2]" 1
1078 1 46 GLU HA 1 46 GLU HG3 3.790 . 3.790 3.343 2.389 3.600 . 0 0 "[ . 1 . 2]" 1
1079 1 46 GLU HA 1 50 PHE H 4.230 . 4.230 2.862 2.701 3.008 . 0 0 "[ . 1 . 2]" 1
1080 1 46 GLU HA 1 50 PHE HB2 3.730 . 3.730 2.225 2.064 2.321 . 0 0 "[ . 1 . 2]" 1
1081 1 46 GLU HA 1 50 PHE HB3 3.930 . 3.930 3.871 3.680 3.935 0.005 13 0 "[ . 1 . 2]" 1
1082 1 46 GLU HA 1 50 PHE QD 3.470 . 3.470 1.912 1.841 2.020 . 0 0 "[ . 1 . 2]" 1
1083 1 46 GLU HA 1 50 PHE QE 4.430 . 4.430 3.905 3.840 3.990 . 0 0 "[ . 1 . 2]" 1
1084 1 46 GLU HA 1 51 ARG H 4.460 . 4.460 4.321 4.106 4.462 0.002 9 0 "[ . 1 . 2]" 1
1085 1 46 GLU HB2 1 47 GLU H 3.970 . 3.970 2.985 2.798 3.166 . 0 0 "[ . 1 . 2]" 1
1086 1 46 GLU HB2 1 48 CYS H 5.210 . 5.210 5.202 5.134 5.227 0.017 1 0 "[ . 1 . 2]" 1
1087 1 46 GLU HB3 1 50 PHE QD 4.490 . 4.490 4.063 3.925 4.191 . 0 0 "[ . 1 . 2]" 1
1088 1 46 GLU HB3 1 50 PHE QE 5.500 . 5.500 5.519 5.477 5.539 0.039 16 0 "[ . 1 . 2]" 1
1089 1 46 GLU QG 1 47 GLU H 4.560 . 4.560 4.078 3.842 4.316 . 0 0 "[ . 1 . 2]" 1
1090 1 46 GLU QG 1 50 PHE HB2 4.440 . 4.440 3.955 3.644 4.184 . 0 0 "[ . 1 . 2]" 1
1091 1 46 GLU QG 1 50 PHE HB3 5.240 . 5.240 5.050 4.713 5.259 0.019 7 0 "[ . 1 . 2]" 1
1092 1 46 GLU QG 1 50 PHE QD 3.740 . 3.740 3.084 2.548 3.321 . 0 0 "[ . 1 . 2]" 1
1093 1 46 GLU QG 1 50 PHE QE 4.090 . 4.090 3.508 3.069 3.735 . 0 0 "[ . 1 . 2]" 1
1094 1 46 GLU HG2 1 47 GLU H 5.170 . 5.170 4.862 4.647 5.193 0.023 8 0 "[ . 1 . 2]" 1
1095 1 46 GLU HG3 1 47 GLU H 5.170 . 5.170 4.391 4.083 4.731 . 0 0 "[ . 1 . 2]" 1
1096 1 47 GLU H 1 47 GLU HB2 3.790 . 3.790 2.506 2.379 2.664 . 0 0 "[ . 1 . 2]" 1
1097 1 47 GLU H 1 47 GLU HB3 3.960 . 3.960 3.633 3.599 3.671 . 0 0 "[ . 1 . 2]" 1
1098 1 47 GLU H 1 47 GLU HG2 4.320 . 4.320 2.541 2.160 3.728 . 0 0 "[ . 1 . 2]" 1
1099 1 47 GLU H 1 47 GLU QG 3.630 . 3.630 2.341 2.145 2.584 . 0 0 "[ . 1 . 2]" 1
1100 1 47 GLU H 1 47 GLU HG3 4.320 . 4.320 3.548 2.451 3.907 . 0 0 "[ . 1 . 2]" 1
1101 1 47 GLU H 1 48 CYS H 3.910 . 3.910 2.427 2.191 2.581 . 0 0 "[ . 1 . 2]" 1
1102 1 47 GLU HA 1 47 GLU HG2 3.910 . 3.910 3.088 2.467 3.400 . 0 0 "[ . 1 . 2]" 1
1103 1 47 GLU HA 1 47 GLU HG3 3.910 . 3.910 3.686 2.899 3.875 . 0 0 "[ . 1 . 2]" 1
1104 1 47 GLU HB2 1 48 CYS H 4.410 . 4.410 2.857 2.696 3.059 . 0 0 "[ . 1 . 2]" 1
1105 1 47 GLU HB2 1 53 CYS QB 4.560 . 4.560 3.581 3.346 3.835 . 0 0 "[ . 1 . 2]" 1
1106 1 47 GLU HB2 1 61 TYR QE 4.140 . 4.140 4.157 4.114 4.185 0.045 11 0 "[ . 1 . 2]" 1
1107 1 47 GLU HB3 1 48 CYS H 4.720 . 4.720 3.884 3.714 4.072 . 0 0 "[ . 1 . 2]" 1
1108 1 47 GLU HB3 1 57 LEU QD 3.030 . 3.030 2.201 2.100 2.322 . 0 0 "[ . 1 . 2]" 1
1109 1 47 GLU QG 1 48 CYS H 4.600 . 4.600 4.113 3.967 4.320 . 0 0 "[ . 1 . 2]" 1
1110 1 47 GLU QG 1 57 LEU QD 3.300 . 3.300 2.522 2.128 3.348 0.048 1 0 "[ . 1 . 2]" 1
1111 1 48 CYS CB 1 53 CYS SG 3.100 . 3.100 3.033 3.022 3.043 . 0 0 "[ . 1 . 2]" 1
1112 1 48 CYS H 1 48 CYS HB2 4.110 . 4.110 2.502 2.418 2.633 . 0 0 "[ . 1 . 2]" 1
1113 1 48 CYS H 1 48 CYS QB 3.560 . 3.560 2.451 2.385 2.493 . 0 0 "[ . 1 . 2]" 1
1114 1 48 CYS H 1 48 CYS HB3 4.110 . 4.110 3.597 3.041 3.716 . 0 0 "[ . 1 . 2]" 1
1115 1 48 CYS H 1 50 PHE H 4.600 . 4.600 3.930 3.664 4.106 . 0 0 "[ . 1 . 2]" 1
1116 1 48 CYS H 1 57 LEU QD 5.240 . 5.240 4.672 4.527 4.822 . 0 0 "[ . 1 . 2]" 1
1117 1 48 CYS HA 1 51 ARG H 4.760 . 4.760 3.960 3.618 4.171 . 0 0 "[ . 1 . 2]" 1
1118 1 48 CYS HA 1 53 CYS H 4.490 . 4.490 3.363 3.152 3.584 . 0 0 "[ . 1 . 2]" 1
1119 1 48 CYS HA 1 53 CYS QB 4.030 . 4.030 2.667 2.534 2.867 . 0 0 "[ . 1 . 2]" 1
1120 1 48 CYS HA 1 57 LEU QD 4.840 . 4.840 4.600 4.331 4.899 0.059 14 0 "[ . 1 . 2]" 1
1121 1 48 CYS QB 1 58 LEU QD 5.090 . 5.090 3.468 3.182 3.664 . 0 0 "[ . 1 . 2]" 1
1122 1 48 CYS HB2 1 49 CYS H 4.600 . 4.600 3.356 3.129 4.042 . 0 0 "[ . 1 . 2]" 1
1123 1 48 CYS HB3 1 49 CYS H 4.600 . 4.600 3.956 3.386 4.134 . 0 0 "[ . 1 . 2]" 1
1124 1 48 CYS SG 1 53 CYS CB 3.100 . 3.100 3.038 3.019 3.080 . 0 0 "[ . 1 . 2]" 1
1125 1 48 CYS SG 1 53 CYS SG 2.100 . 2.100 2.028 2.026 2.031 . 0 0 "[ . 1 . 2]" 1
1126 1 49 CYS H 1 49 CYS HB2 4.170 . 4.170 2.866 2.773 2.990 . 0 0 "[ . 1 . 2]" 1
1127 1 49 CYS H 1 50 PHE H 3.510 . 3.510 2.116 2.022 2.169 . 0 0 "[ . 1 . 2]" 1
1128 1 49 CYS H 1 50 PHE HB2 4.970 . 4.970 4.285 4.179 4.355 . 0 0 "[ . 1 . 2]" 1
1129 1 49 CYS H 1 51 ARG H 3.830 . 3.830 2.987 2.766 3.100 . 0 0 "[ . 1 . 2]" 1
1130 1 49 CYS HB2 1 50 PHE H 4.410 . 4.410 3.797 3.731 3.902 . 0 0 "[ . 1 . 2]" 1
1131 1 49 CYS HB2 1 50 PHE QD 5.060 . 5.060 4.500 4.254 4.970 . 0 0 "[ . 1 . 2]" 1
1132 1 49 CYS HB3 1 50 PHE H 4.270 . 4.270 2.560 2.416 2.755 . 0 0 "[ . 1 . 2]" 1
1133 1 49 CYS HB3 1 50 PHE QD 4.730 . 4.730 2.877 2.611 3.400 . 0 0 "[ . 1 . 2]" 1
1134 1 50 PHE H 1 50 PHE HB2 3.750 . 3.750 2.426 2.400 2.456 . 0 0 "[ . 1 . 2]" 1
1135 1 50 PHE H 1 50 PHE HB3 3.890 . 3.890 3.637 3.615 3.670 . 0 0 "[ . 1 . 2]" 1
1136 1 50 PHE H 1 50 PHE QD 3.870 . 3.870 2.343 2.161 2.571 . 0 0 "[ . 1 . 2]" 1
1137 1 50 PHE H 1 51 ARG H 3.290 . 3.290 2.327 2.210 2.435 . 0 0 "[ . 1 . 2]" 1
1138 1 50 PHE HA 1 50 PHE QD 3.280 . 3.280 3.014 2.799 3.136 . 0 0 "[ . 1 . 2]" 1
1139 1 50 PHE HA 1 50 PHE QE 4.920 . 4.920 4.708 4.657 4.756 . 0 0 "[ . 1 . 2]" 1
1140 1 50 PHE HB2 1 51 ARG H 3.670 . 3.670 3.275 3.149 3.368 . 0 0 "[ . 1 . 2]" 1
1141 1 50 PHE HB3 1 51 ARG H 4.420 . 4.420 4.099 3.996 4.164 . 0 0 "[ . 1 . 2]" 1
1142 1 51 ARG H 1 51 ARG HB2 3.750 . 3.750 2.806 2.738 2.861 . 0 0 "[ . 1 . 2]" 1
1143 1 51 ARG H 1 51 ARG HB3 3.910 . 3.910 3.873 3.800 3.908 . 0 0 "[ . 1 . 2]" 1
1144 1 51 ARG H 1 51 ARG QD 4.580 . 4.580 4.254 4.118 4.479 . 0 0 "[ . 1 . 2]" 1
1145 1 51 ARG H 1 51 ARG QG 3.650 . 3.650 3.344 3.126 3.538 . 0 0 "[ . 1 . 2]" 1
1146 1 51 ARG H 1 52 SER H 4.480 . 4.480 4.322 4.267 4.371 . 0 0 "[ . 1 . 2]" 1
1147 1 51 ARG HA 1 51 ARG HD2 4.260 . 4.260 3.165 3.016 3.734 . 0 0 "[ . 1 . 2]" 1
1148 1 51 ARG HA 1 51 ARG QD 3.710 . 3.710 2.092 1.974 2.170 . 0 0 "[ . 1 . 2]" 1
1149 1 51 ARG HA 1 51 ARG HD3 4.260 . 4.260 2.124 1.993 2.205 . 0 0 "[ . 1 . 2]" 1
1150 1 51 ARG HA 1 51 ARG HE 4.820 . 4.820 4.581 3.095 4.756 . 0 0 "[ . 1 . 2]" 1
1151 1 51 ARG HA 1 51 ARG QG 3.590 . 3.590 2.933 2.778 3.014 . 0 0 "[ . 1 . 2]" 1
1152 1 51 ARG HA 1 52 SER H 3.100 . 3.100 2.612 2.477 2.756 . 0 0 "[ . 1 . 2]" 1
1153 1 51 ARG HB2 1 51 ARG HD2 3.910 . 3.910 3.705 3.594 3.929 0.019 6 0 "[ . 1 . 2]" 1
1154 1 51 ARG HB2 1 51 ARG QD 3.380 . 3.380 3.314 3.266 3.333 . 0 0 "[ . 1 . 2]" 1
1155 1 51 ARG HB2 1 51 ARG HD3 3.910 . 3.910 3.743 3.491 3.779 . 0 0 "[ . 1 . 2]" 1
1156 1 51 ARG HB2 1 51 ARG HE 4.800 . 4.800 4.609 4.324 4.687 . 0 0 "[ . 1 . 2]" 1
1157 1 51 ARG HB2 1 52 SER H 3.410 . 3.410 3.302 3.081 3.415 0.005 18 0 "[ . 1 . 2]" 1
1158 1 51 ARG HB3 1 51 ARG HD2 3.520 . 3.520 2.499 2.328 3.009 . 0 0 "[ . 1 . 2]" 1
1159 1 51 ARG HB3 1 51 ARG HD3 3.520 . 3.520 2.980 2.337 3.068 . 0 0 "[ . 1 . 2]" 1
1160 1 51 ARG HB3 1 51 ARG HE 4.500 . 4.500 4.413 4.211 4.493 . 0 0 "[ . 1 . 2]" 1
1161 1 51 ARG HB3 1 52 SER H 3.210 . 3.210 2.076 1.954 2.168 . 0 0 "[ . 1 . 2]" 1
1162 1 51 ARG HB3 1 52 SER QB 4.440 . 4.440 4.280 4.018 4.531 0.091 9 0 "[ . 1 . 2]" 1
1163 1 51 ARG QD 1 52 SER H 3.880 . 3.880 3.366 2.989 3.686 . 0 0 "[ . 1 . 2]" 1
1164 1 51 ARG HD2 1 52 SER H 4.430 . 4.430 3.740 3.315 4.450 0.020 6 0 "[ . 1 . 2]" 1
1165 1 51 ARG HD3 1 52 SER H 4.430 . 4.430 3.877 3.105 4.196 . 0 0 "[ . 1 . 2]" 1
1166 1 51 ARG HE 1 51 ARG QG 3.630 . 3.630 2.255 2.117 2.317 . 0 0 "[ . 1 . 2]" 1
1167 1 51 ARG QG 1 52 SER H 4.110 . 4.110 4.096 3.961 4.136 0.026 15 0 "[ . 1 . 2]" 1
1168 1 51 ARG HG2 1 52 SER H 4.710 . 4.710 4.696 4.531 4.730 0.020 19 0 "[ . 1 . 2]" 1
1169 1 51 ARG HG3 1 52 SER H 4.710 . 4.710 4.512 4.372 4.571 . 0 0 "[ . 1 . 2]" 1
1170 1 52 SER H 1 52 SER HB2 3.550 . 3.550 3.029 2.398 3.569 0.019 20 0 "[ . 1 . 2]" 1
1171 1 52 SER H 1 52 SER QB 3.080 . 3.080 2.496 2.276 2.880 . 0 0 "[ . 1 . 2]" 1
1172 1 52 SER H 1 52 SER HB3 3.550 . 3.550 2.850 2.403 3.603 0.053 19 0 "[ . 1 . 2]" 1
1173 1 52 SER H 1 53 CYS H 4.590 . 4.590 4.562 4.481 4.599 0.009 1 0 "[ . 1 . 2]" 1
1174 1 52 SER QB 1 53 CYS H 3.780 . 3.780 3.161 2.697 3.583 . 0 0 "[ . 1 . 2]" 1
1175 1 52 SER HB2 1 53 CYS H 4.360 . 4.360 3.645 2.745 4.173 . 0 0 "[ . 1 . 2]" 1
1176 1 52 SER HB3 1 53 CYS H 4.360 . 4.360 3.724 2.827 4.109 . 0 0 "[ . 1 . 2]" 1
1177 1 53 CYS HA 1 54 ASP H 3.350 . 3.350 2.465 2.300 2.673 . 0 0 "[ . 1 . 2]" 1
1178 1 53 CYS HA 1 57 LEU QD 3.950 . 3.950 2.565 2.434 3.973 0.023 14 0 "[ . 1 . 2]" 1
1179 1 53 CYS HA 1 57 LEU HG 5.500 . 5.500 5.454 4.526 5.519 0.019 15 0 "[ . 1 . 2]" 1
1180 1 53 CYS QB 1 54 ASP H 3.350 . 3.350 2.342 2.105 2.524 . 0 0 "[ . 1 . 2]" 1
1181 1 53 CYS QB 1 57 LEU QB 3.960 . 3.960 2.451 2.284 2.734 . 0 0 "[ . 1 . 2]" 1
1182 1 53 CYS QB 1 57 LEU QD 2.850 . 2.850 1.980 1.891 2.218 . 0 0 "[ . 1 . 2]" 1
1183 1 53 CYS QB 1 57 LEU HG 4.410 . 4.410 4.285 3.582 4.410 . 0 0 "[ . 1 . 2]" 1
1184 1 53 CYS HB2 1 54 ASP H 3.860 . 3.860 2.365 2.118 2.558 . 0 0 "[ . 1 . 2]" 1
1185 1 53 CYS HB2 1 57 LEU QD 3.270 . 3.270 2.036 1.948 2.268 . 0 0 "[ . 1 . 2]" 1
1186 1 53 CYS HB3 1 54 ASP H 3.860 . 3.860 3.790 3.638 3.872 0.012 3 0 "[ . 1 . 2]" 1
1187 1 53 CYS HB3 1 57 LEU QD 3.270 . 3.270 2.709 2.560 3.134 . 0 0 "[ . 1 . 2]" 1
1188 1 54 ASP H 1 56 ALA MB 4.950 . 4.950 4.861 4.665 4.998 0.048 9 0 "[ . 1 . 2]" 1
1189 1 54 ASP H 1 57 LEU H 4.140 . 4.140 3.300 3.129 3.370 . 0 0 "[ . 1 . 2]" 1
1190 1 54 ASP H 1 57 LEU HB2 3.970 . 3.970 3.044 2.848 3.652 . 0 0 "[ . 1 . 2]" 1
1191 1 54 ASP H 1 57 LEU HB3 3.970 . 3.970 2.314 2.149 2.550 . 0 0 "[ . 1 . 2]" 1
1192 1 54 ASP H 1 57 LEU QD 3.600 . 3.600 2.892 2.755 3.554 . 0 0 "[ . 1 . 2]" 1
1193 1 54 ASP H 1 57 LEU HG 5.130 . 5.130 4.922 4.421 5.107 . 0 0 "[ . 1 . 2]" 1
1194 1 54 ASP H 1 58 LEU H 4.690 . 4.690 3.746 3.422 4.019 . 0 0 "[ . 1 . 2]" 1
1195 1 54 ASP HA 1 56 ALA H 4.810 . 4.810 4.168 3.860 4.410 . 0 0 "[ . 1 . 2]" 1
1196 1 54 ASP HA 1 58 LEU QD 5.400 . 5.400 4.976 4.662 5.248 . 0 0 "[ . 1 . 2]" 1
1197 1 54 ASP QB 1 56 ALA H 3.930 . 3.930 2.639 2.078 3.173 . 0 0 "[ . 1 . 2]" 1
1198 1 54 ASP QB 1 58 LEU H 5.340 . 5.340 4.318 3.912 4.628 . 0 0 "[ . 1 . 2]" 1
1199 1 54 ASP HB2 1 55 LEU H 4.100 . 4.100 3.848 3.635 4.099 . 0 0 "[ . 1 . 2]" 1
1200 1 54 ASP HB2 1 56 ALA H 4.590 . 4.590 3.778 2.857 4.440 . 0 0 "[ . 1 . 2]" 1
1201 1 54 ASP HB3 1 55 LEU H 4.100 . 4.100 3.046 2.423 3.754 . 0 0 "[ . 1 . 2]" 1
1202 1 54 ASP HB3 1 56 ALA H 4.590 . 4.590 2.708 2.107 3.254 . 0 0 "[ . 1 . 2]" 1
1203 1 55 LEU H 1 55 LEU MD1 4.340 . 4.340 4.196 4.109 4.242 . 0 0 "[ . 1 . 2]" 1
1204 1 55 LEU H 1 55 LEU QD 3.560 . 3.560 2.750 2.440 2.955 . 0 0 "[ . 1 . 2]" 1
1205 1 55 LEU H 1 55 LEU MD2 4.340 . 4.340 2.789 2.459 3.016 . 0 0 "[ . 1 . 2]" 1
1206 1 55 LEU H 1 55 LEU HG 4.580 . 4.580 4.147 3.960 4.277 . 0 0 "[ . 1 . 2]" 1
1207 1 55 LEU H 1 56 ALA H 3.860 . 3.860 2.680 2.527 2.849 . 0 0 "[ . 1 . 2]" 1
1208 1 55 LEU H 1 56 ALA MB 4.670 . 4.670 4.244 4.066 4.414 . 0 0 "[ . 1 . 2]" 1
1209 1 55 LEU H 1 58 LEU QD 5.440 . 5.440 4.642 4.455 4.888 . 0 0 "[ . 1 . 2]" 1
1210 1 55 LEU HA 1 55 LEU QD 3.860 . 3.860 3.469 3.445 3.482 . 0 0 "[ . 1 . 2]" 1
1211 1 55 LEU HA 1 56 ALA MB 5.220 . 5.220 4.915 4.880 4.954 . 0 0 "[ . 1 . 2]" 1
1212 1 55 LEU HA 1 58 LEU H 4.350 . 4.350 3.432 3.382 3.493 . 0 0 "[ . 1 . 2]" 1
1213 1 55 LEU HA 1 58 LEU HB2 4.710 . 4.710 3.120 2.999 3.251 . 0 0 "[ . 1 . 2]" 1
1214 1 55 LEU HA 1 58 LEU QB 4.070 . 4.070 2.230 2.081 2.350 . 0 0 "[ . 1 . 2]" 1
1215 1 55 LEU HA 1 58 LEU HB3 4.710 . 4.710 2.284 2.122 2.422 . 0 0 "[ . 1 . 2]" 1
1216 1 55 LEU HA 1 58 LEU MD1 4.110 . 4.110 3.117 2.889 3.537 . 0 0 "[ . 1 . 2]" 1
1217 1 55 LEU HA 1 58 LEU MD2 4.110 . 4.110 3.091 2.941 3.287 . 0 0 "[ . 1 . 2]" 1
1218 1 55 LEU HA 1 59 GLU H 5.170 . 5.170 3.978 3.858 4.053 . 0 0 "[ . 1 . 2]" 1
1219 1 55 LEU HA 1 59 GLU HB2 5.120 . 5.120 4.848 4.723 4.978 . 0 0 "[ . 1 . 2]" 1
1220 1 55 LEU HB2 1 56 ALA H 4.400 . 4.400 4.236 4.191 4.267 . 0 0 "[ . 1 . 2]" 1
1221 1 55 LEU HB2 1 56 ALA MB 5.500 . 5.500 5.308 5.204 5.405 . 0 0 "[ . 1 . 2]" 1
1222 1 55 LEU HB3 1 55 LEU MD1 3.450 . 3.450 2.540 2.481 2.593 . 0 0 "[ . 1 . 2]" 1
1223 1 55 LEU HB3 1 55 LEU MD2 3.450 . 3.450 2.242 2.211 2.276 . 0 0 "[ . 1 . 2]" 1
1224 1 55 LEU HB3 1 56 ALA H 3.980 . 3.980 3.501 3.366 3.637 . 0 0 "[ . 1 . 2]" 1
1225 1 55 LEU HB3 1 56 ALA MB 4.570 . 4.570 4.747 4.672 4.839 0.269 11 0 "[ . 1 . 2]" 1
1226 1 55 LEU QD 1 56 ALA H 3.920 . 3.920 2.128 2.079 2.217 . 0 0 "[ . 1 . 2]" 1
1227 1 55 LEU QD 1 56 ALA HA 3.500 . 3.500 3.318 3.163 3.467 . 0 0 "[ . 1 . 2]" 1
1228 1 55 LEU QD 1 56 ALA MB 4.230 . 4.230 2.447 2.398 2.487 . 0 0 "[ . 1 . 2]" 1
1229 1 55 LEU MD1 1 56 ALA H 4.930 . 4.930 4.469 4.406 4.563 . 0 0 "[ . 1 . 2]" 1
1230 1 55 LEU MD1 1 56 ALA HA 4.920 . 4.920 4.649 4.574 4.792 . 0 0 "[ . 1 . 2]" 1
1231 1 55 LEU MD2 1 56 ALA H 4.930 . 4.930 2.132 2.083 2.222 . 0 0 "[ . 1 . 2]" 1
1232 1 55 LEU MD2 1 56 ALA HA 4.920 . 4.920 3.399 3.208 3.578 . 0 0 "[ . 1 . 2]" 1
1233 1 56 ALA H 1 56 ALA MB 2.560 . 2.560 2.142 2.124 2.168 . 0 0 "[ . 1 . 2]" 1
1234 1 56 ALA H 1 57 LEU H 3.390 . 3.390 2.608 2.570 2.761 . 0 0 "[ . 1 . 2]" 1
1235 1 56 ALA H 1 57 LEU HA 5.500 . 5.500 5.288 5.256 5.408 . 0 0 "[ . 1 . 2]" 1
1236 1 56 ALA HA 1 59 GLU H 4.530 . 4.530 3.418 3.327 3.684 . 0 0 "[ . 1 . 2]" 1
1237 1 56 ALA HA 1 59 GLU HB2 4.260 . 4.260 3.351 3.106 3.681 . 0 0 "[ . 1 . 2]" 1
1238 1 56 ALA HA 1 59 GLU HB3 4.130 . 4.130 3.008 2.762 3.271 . 0 0 "[ . 1 . 2]" 1
1239 1 56 ALA HA 1 60 THR MG 4.760 . 4.760 4.629 4.521 4.765 0.005 4 0 "[ . 1 . 2]" 1
1240 1 56 ALA MB 1 57 LEU H 2.930 . 2.930 2.499 2.451 2.573 . 0 0 "[ . 1 . 2]" 1
1241 1 56 ALA MB 1 57 LEU HA 4.040 . 4.040 3.959 3.924 3.996 . 0 0 "[ . 1 . 2]" 1
1242 1 56 ALA MB 1 57 LEU QB 3.830 . 3.830 3.757 3.719 3.826 . 0 0 "[ . 1 . 2]" 1
1243 1 56 ALA MB 1 58 LEU H 5.060 . 5.060 4.405 4.357 4.440 . 0 0 "[ . 1 . 2]" 1
1244 1 56 ALA MB 1 59 GLU HB3 4.720 . 4.720 4.360 4.153 4.602 . 0 0 "[ . 1 . 2]" 1
1245 1 57 LEU H 1 57 LEU HB2 3.520 . 3.520 2.461 2.384 2.638 . 0 0 "[ . 1 . 2]" 1
1246 1 57 LEU H 1 57 LEU QB 3.050 . 3.050 2.199 2.180 2.220 . 0 0 "[ . 1 . 2]" 1
1247 1 57 LEU H 1 57 LEU HB3 3.520 . 3.520 2.480 2.388 2.523 . 0 0 "[ . 1 . 2]" 1
1248 1 57 LEU H 1 57 LEU QD 3.700 . 3.700 3.735 3.714 3.752 0.052 16 0 "[ . 1 . 2]" 1
1249 1 57 LEU H 1 58 LEU H 3.410 . 3.410 2.484 2.399 2.525 . 0 0 "[ . 1 . 2]" 1
1250 1 57 LEU H 1 60 THR MG 4.890 . 4.890 4.574 4.431 4.692 . 0 0 "[ . 1 . 2]" 1
1251 1 57 LEU HA 1 57 LEU QD 3.240 . 3.240 3.038 2.245 3.134 . 0 0 "[ . 1 . 2]" 1
1252 1 57 LEU HA 1 57 LEU HG 3.770 . 3.770 2.645 2.528 3.704 . 0 0 "[ . 1 . 2]" 1
1253 1 57 LEU HA 1 60 THR MG 2.660 . 2.660 2.537 2.233 2.662 0.002 18 0 "[ . 1 . 2]" 1
1254 1 57 LEU QB 1 57 LEU QD 2.610 . 2.610 1.913 1.892 2.070 . 0 0 "[ . 1 . 2]" 1
1255 1 57 LEU QB 1 58 LEU H 3.880 . 3.880 2.422 2.378 2.463 . 0 0 "[ . 1 . 2]" 1
1256 1 57 LEU QB 1 60 THR MG 4.890 . 4.890 4.288 3.933 4.381 . 0 0 "[ . 1 . 2]" 1
1257 1 57 LEU QD 1 58 LEU H 3.390 . 3.390 3.244 3.046 3.322 . 0 0 "[ . 1 . 2]" 1
1258 1 57 LEU QD 1 58 LEU HA 3.450 . 3.450 2.901 2.524 3.033 . 0 0 "[ . 1 . 2]" 1
1259 1 57 LEU QD 1 58 LEU QB 4.580 . 4.580 3.547 3.313 3.677 . 0 0 "[ . 1 . 2]" 1
1260 1 57 LEU QD 1 58 LEU QD 5.250 . 5.250 4.061 3.797 4.168 . 0 0 "[ . 1 . 2]" 1
1261 1 57 LEU QD 1 58 LEU HG 5.120 . 5.120 4.602 4.281 4.748 . 0 0 "[ . 1 . 2]" 1
1262 1 57 LEU QD 1 60 THR MG 3.950 . 3.950 3.807 2.443 3.980 0.030 18 0 "[ . 1 . 2]" 1
1263 1 57 LEU QD 1 61 TYR QD 3.820 . 3.820 3.291 2.701 3.466 . 0 0 "[ . 1 . 2]" 1
1264 1 57 LEU QD 1 61 TYR QE 3.250 . 3.250 2.886 2.526 3.114 . 0 0 "[ . 1 . 2]" 1
1265 1 57 LEU HG 1 58 LEU H 4.720 . 4.720 4.711 4.632 4.739 0.019 14 0 "[ . 1 . 2]" 1
1266 1 57 LEU HG 1 58 LEU HA 5.440 . 5.440 5.239 5.015 5.378 . 0 0 "[ . 1 . 2]" 1
1267 1 57 LEU HG 1 60 THR MG 4.720 . 4.720 4.071 3.883 4.796 0.076 14 0 "[ . 1 . 2]" 1
1268 1 57 LEU HG 1 61 TYR QD 5.500 . 5.500 5.452 5.325 5.544 0.044 14 0 "[ . 1 . 2]" 1
1269 1 57 LEU HG 1 61 TYR QE 4.860 . 4.860 4.839 4.658 4.897 0.037 11 0 "[ . 1 . 2]" 1
1270 1 58 LEU H 1 58 LEU HB2 3.730 . 3.730 2.184 2.158 2.248 . 0 0 "[ . 1 . 2]" 1
1271 1 58 LEU H 1 58 LEU QB 3.100 . 3.100 2.030 2.013 2.078 . 0 0 "[ . 1 . 2]" 1
1272 1 58 LEU H 1 58 LEU HB3 3.730 . 3.730 2.414 2.361 2.478 . 0 0 "[ . 1 . 2]" 1
1273 1 58 LEU H 1 58 LEU MD1 4.250 . 4.250 3.921 3.891 4.017 . 0 0 "[ . 1 . 2]" 1
1274 1 58 LEU H 1 58 LEU QD 3.710 . 3.710 3.557 3.532 3.616 . 0 0 "[ . 1 . 2]" 1
1275 1 58 LEU H 1 58 LEU MD2 4.250 . 4.250 4.075 4.041 4.105 . 0 0 "[ . 1 . 2]" 1
1276 1 58 LEU H 1 58 LEU HG 4.230 . 4.230 4.268 4.251 4.286 0.056 16 0 "[ . 1 . 2]" 1
1277 1 58 LEU H 1 59 GLU H 3.890 . 3.890 2.760 2.714 2.810 . 0 0 "[ . 1 . 2]" 1
1278 1 58 LEU HA 1 58 LEU MD1 4.150 . 4.150 3.454 3.330 3.524 . 0 0 "[ . 1 . 2]" 1
1279 1 58 LEU HA 1 58 LEU QD 3.490 . 3.490 3.055 2.990 3.081 . 0 0 "[ . 1 . 2]" 1
1280 1 58 LEU HA 1 58 LEU MD2 4.150 . 4.150 3.410 3.358 3.484 . 0 0 "[ . 1 . 2]" 1
1281 1 58 LEU HA 1 58 LEU HG 3.710 . 3.710 2.422 2.301 2.470 . 0 0 "[ . 1 . 2]" 1
1282 1 58 LEU HA 1 60 THR MG 4.810 . 4.810 4.840 4.819 4.864 0.054 4 0 "[ . 1 . 2]" 1
1283 1 58 LEU HA 1 61 TYR H 4.330 . 4.330 3.978 3.827 4.076 . 0 0 "[ . 1 . 2]" 1
1284 1 58 LEU HA 1 61 TYR QD 3.760 . 3.760 3.222 3.053 3.305 . 0 0 "[ . 1 . 2]" 1
1285 1 58 LEU HA 1 61 TYR QE 4.820 . 4.820 4.687 4.386 4.855 0.035 7 0 "[ . 1 . 2]" 1
1286 1 58 LEU QB 1 58 LEU QD 2.600 . 2.600 1.825 1.809 1.850 . 0 0 "[ . 1 . 2]" 1
1287 1 58 LEU QB 1 59 GLU H 3.950 . 3.950 2.597 2.555 2.652 . 0 0 "[ . 1 . 2]" 1
1288 1 58 LEU QB 1 61 TYR QD 5.190 . 5.190 5.159 5.008 5.227 0.037 16 0 "[ . 1 . 2]" 1
1289 1 58 LEU HB2 1 58 LEU MD1 3.500 . 3.500 2.126 2.107 2.158 . 0 0 "[ . 1 . 2]" 1
1290 1 58 LEU HB2 1 58 LEU MD2 3.500 . 3.500 3.064 3.011 3.088 . 0 0 "[ . 1 . 2]" 1
1291 1 58 LEU HB3 1 58 LEU MD1 3.500 . 3.500 2.645 2.577 2.762 . 0 0 "[ . 1 . 2]" 1
1292 1 58 LEU HB3 1 58 LEU MD2 3.500 . 3.500 2.087 2.060 2.106 . 0 0 "[ . 1 . 2]" 1
1293 1 58 LEU QD 1 59 GLU H 3.680 . 3.680 3.335 3.308 3.368 . 0 0 "[ . 1 . 2]" 1
1294 1 58 LEU QD 1 59 GLU HA 3.700 . 3.700 3.117 3.028 3.243 . 0 0 "[ . 1 . 2]" 1
1295 1 58 LEU QD 1 59 GLU HB2 3.890 . 3.890 3.947 3.875 4.007 0.117 18 0 "[ . 1 . 2]" 1
1296 1 58 LEU QD 1 59 GLU HB3 5.020 . 5.020 4.873 4.806 4.931 . 0 0 "[ . 1 . 2]" 1
1297 1 58 LEU QD 1 59 GLU QG 5.250 . 5.250 4.604 4.420 4.715 . 0 0 "[ . 1 . 2]" 1
1298 1 58 LEU QD 1 61 TYR QD 5.440 . 5.440 4.813 4.671 4.906 . 0 0 "[ . 1 . 2]" 1
1299 1 58 LEU MD1 1 59 GLU H 5.090 . 5.090 4.819 4.750 4.896 . 0 0 "[ . 1 . 2]" 1
1300 1 58 LEU MD2 1 59 GLU H 5.090 . 5.090 3.400 3.372 3.438 . 0 0 "[ . 1 . 2]" 1
1301 1 58 LEU HG 1 59 GLU H 4.610 . 4.610 4.592 4.485 4.628 0.018 11 0 "[ . 1 . 2]" 1
1302 1 58 LEU HG 1 61 TYR QD 5.500 . 5.500 4.759 4.508 4.881 . 0 0 "[ . 1 . 2]" 1
1303 1 59 GLU H 1 59 GLU HB2 3.320 . 3.320 2.390 2.314 2.442 . 0 0 "[ . 1 . 2]" 1
1304 1 59 GLU H 1 59 GLU HB3 3.210 . 3.210 2.484 2.374 2.583 . 0 0 "[ . 1 . 2]" 1
1305 1 59 GLU H 1 59 GLU HG2 4.880 . 4.880 4.443 4.378 4.524 . 0 0 "[ . 1 . 2]" 1
1306 1 59 GLU H 1 59 GLU HG3 4.880 . 4.880 4.451 4.325 4.548 . 0 0 "[ . 1 . 2]" 1
1307 1 59 GLU HA 1 59 GLU HG2 3.840 . 3.840 2.772 2.397 3.277 . 0 0 "[ . 1 . 2]" 1
1308 1 59 GLU HA 1 59 GLU QG 3.230 . 3.230 2.415 2.335 2.491 . 0 0 "[ . 1 . 2]" 1
1309 1 59 GLU HA 1 59 GLU HG3 3.840 . 3.840 3.119 2.402 3.657 . 0 0 "[ . 1 . 2]" 1
1310 1 59 GLU HB2 1 60 THR H 4.370 . 4.370 4.135 4.056 4.191 . 0 0 "[ . 1 . 2]" 1
1311 1 59 GLU HB2 1 60 THR MG 5.500 . 5.500 4.908 4.785 4.974 . 0 0 "[ . 1 . 2]" 1
1312 1 59 GLU HB3 1 60 THR H 4.620 . 4.620 3.054 2.977 3.156 . 0 0 "[ . 1 . 2]" 1
1313 1 59 GLU HB3 1 60 THR MG 4.040 . 4.040 3.562 3.466 3.635 . 0 0 "[ . 1 . 2]" 1
1314 1 59 GLU QG 1 60 THR MG 4.760 . 4.760 4.611 4.267 4.889 0.129 19 0 "[ . 1 . 2]" 1
1315 1 59 GLU HG2 1 60 THR H 5.500 . 5.500 4.564 4.231 4.909 . 0 0 "[ . 1 . 2]" 1
1316 1 59 GLU HG2 1 60 THR MG 5.500 . 5.500 4.986 4.430 5.519 0.019 19 0 "[ . 1 . 2]" 1
1317 1 59 GLU HG3 1 60 THR H 5.500 . 5.500 5.183 4.911 5.390 . 0 0 "[ . 1 . 2]" 1
1318 1 59 GLU HG3 1 60 THR MG 5.500 . 5.500 5.537 5.454 5.597 0.097 6 0 "[ . 1 . 2]" 1
1319 1 60 THR H 1 60 THR MG 2.790 . 2.790 1.984 1.890 2.027 . 0 0 "[ . 1 . 2]" 1
1320 1 60 THR H 1 61 TYR H 3.740 . 3.740 2.698 2.650 2.765 . 0 0 "[ . 1 . 2]" 1
1321 1 60 THR H 1 61 TYR QD 4.570 . 4.570 3.967 3.747 4.185 . 0 0 "[ . 1 . 2]" 1
1322 1 60 THR H 1 62 CYS H 4.580 . 4.580 4.388 4.282 4.584 0.004 5 0 "[ . 1 . 2]" 1
1323 1 60 THR HA 1 60 THR MG 2.970 . 2.970 2.400 2.369 2.539 . 0 0 "[ . 1 . 2]" 1
1324 1 60 THR HA 1 62 CYS H 4.000 . 4.000 3.599 3.461 3.707 . 0 0 "[ . 1 . 2]" 1
1325 1 60 THR MG 1 61 TYR H 4.040 . 4.040 3.983 3.931 4.022 . 0 0 "[ . 1 . 2]" 1
1326 1 60 THR MG 1 61 TYR QD 4.590 . 4.590 4.434 4.256 4.604 0.014 7 0 "[ . 1 . 2]" 1
1327 1 60 THR MG 1 61 TYR QE 5.500 . 5.500 5.227 5.007 5.463 . 0 0 "[ . 1 . 2]" 1
1328 1 61 TYR H 1 61 TYR QB 3.620 . 3.620 2.202 2.164 2.244 . 0 0 "[ . 1 . 2]" 1
1329 1 61 TYR H 1 61 TYR QD 3.640 . 3.640 2.711 2.542 2.907 . 0 0 "[ . 1 . 2]" 1
1330 1 61 TYR H 1 61 TYR QE 5.120 . 5.120 4.975 4.823 5.120 . 0 0 "[ . 1 . 2]" 1
1331 1 61 TYR H 1 62 CYS H 3.340 . 3.340 2.640 2.547 2.838 . 0 0 "[ . 1 . 2]" 1
1332 1 61 TYR HA 1 61 TYR QD 3.810 . 3.810 3.014 2.962 3.112 . 0 0 "[ . 1 . 2]" 1
1333 1 61 TYR HB2 1 62 CYS H 4.710 . 4.710 3.776 3.697 3.907 . 0 0 "[ . 1 . 2]" 1
1334 1 61 TYR HB3 1 62 CYS H 4.710 . 4.710 4.174 4.073 4.291 . 0 0 "[ . 1 . 2]" 1
1335 1 61 TYR QD 1 62 CYS H 5.220 . 5.220 4.912 4.853 5.004 . 0 0 "[ . 1 . 2]" 1
1336 1 62 CYS H 1 62 CYS HB2 3.940 . 3.940 2.478 2.430 2.518 . 0 0 "[ . 1 . 2]" 1
1337 1 62 CYS H 1 62 CYS QB 3.360 . 3.360 2.429 2.248 2.474 . 0 0 "[ . 1 . 2]" 1
1338 1 62 CYS H 1 62 CYS HB3 3.940 . 3.940 3.570 2.591 3.646 . 0 0 "[ . 1 . 2]" 1
1339 1 62 CYS H 1 63 ALA H 5.500 . 5.500 4.691 4.653 4.719 . 0 0 "[ . 1 . 2]" 1
1340 1 62 CYS HA 1 64 THR H 5.500 . 5.500 4.100 3.889 4.467 . 0 0 "[ . 1 . 2]" 1
1341 1 62 CYS QB 1 63 ALA MB 4.440 . 4.440 4.148 3.950 4.669 0.229 16 0 "[ . 1 . 2]" 1
1342 1 62 CYS QB 1 64 THR H 5.340 . 5.340 2.662 2.361 3.480 . 0 0 "[ . 1 . 2]" 1
1343 1 62 CYS HB2 1 63 ALA H 4.110 . 4.110 3.873 3.724 3.978 . 0 0 "[ . 1 . 2]" 1
1344 1 62 CYS HB3 1 63 ALA H 4.110 . 4.110 2.714 2.438 3.705 . 0 0 "[ . 1 . 2]" 1
1345 1 63 ALA H 1 63 ALA MB 2.800 . 2.800 2.238 2.181 2.321 . 0 0 "[ . 1 . 2]" 1
1346 1 63 ALA H 1 64 THR H 3.910 . 3.910 2.600 2.379 2.881 . 0 0 "[ . 1 . 2]" 1
1347 1 63 ALA H 1 64 THR MG 5.250 . 5.250 4.259 3.696 4.940 . 0 0 "[ . 1 . 2]" 1
1348 1 63 ALA MB 1 64 THR H 3.660 . 3.660 3.034 2.219 3.661 0.001 1 0 "[ . 1 . 2]" 1
1349 1 63 ALA MB 1 64 THR HA 4.520 . 4.520 4.356 4.134 4.442 . 0 0 "[ . 1 . 2]" 1
1350 1 64 THR H 1 64 THR HB 3.930 . 3.930 3.244 2.933 3.454 . 0 0 "[ . 1 . 2]" 1
1351 1 64 THR H 1 64 THR MG 3.370 . 3.370 2.679 2.530 3.194 . 0 0 "[ . 1 . 2]" 1
1352 1 64 THR H 1 65 PRO HD2 4.870 . 4.870 4.890 4.880 4.900 0.030 11 0 "[ . 1 . 2]" 1
1353 1 64 THR H 1 65 PRO HD3 4.940 . 4.940 4.819 4.718 4.930 . 0 0 "[ . 1 . 2]" 1
1354 1 64 THR HA 1 64 THR MG 3.170 . 3.170 3.203 3.112 3.217 0.047 4 0 "[ . 1 . 2]" 1
1355 1 64 THR HA 1 65 PRO HD2 3.370 . 3.370 2.570 2.451 2.710 . 0 0 "[ . 1 . 2]" 1
1356 1 64 THR HA 1 65 PRO HD3 3.340 . 3.340 2.439 2.366 2.563 . 0 0 "[ . 1 . 2]" 1
1357 1 64 THR HB 1 65 PRO HD2 3.910 . 3.910 3.916 3.901 3.933 0.023 17 0 "[ . 1 . 2]" 1
1358 1 64 THR HB 1 65 PRO HD3 4.750 . 4.750 4.754 4.728 4.770 0.020 19 0 "[ . 1 . 2]" 1
1359 1 64 THR MG 1 65 PRO HA 4.370 . 4.370 4.174 4.084 4.277 . 0 0 "[ . 1 . 2]" 1
1360 1 64 THR MG 1 65 PRO HD2 3.250 . 3.250 3.207 2.283 3.337 0.087 16 0 "[ . 1 . 2]" 1
1361 1 64 THR MG 1 65 PRO HD3 4.310 . 4.310 4.260 3.658 4.335 0.025 1 0 "[ . 1 . 2]" 1
1362 1 64 THR MG 1 66 ALA H 5.150 . 5.150 5.041 4.889 5.168 0.018 11 0 "[ . 1 . 2]" 1
1363 1 65 PRO HA 1 66 ALA H 2.600 . 2.600 2.370 2.289 2.435 . 0 0 "[ . 1 . 2]" 1
1364 1 65 PRO HA 1 66 ALA MB 4.080 . 4.080 4.075 3.923 4.115 0.035 1 0 "[ . 1 . 2]" 1
1365 1 65 PRO QB 1 66 ALA H 3.150 . 3.150 2.626 2.497 2.763 . 0 0 "[ . 1 . 2]" 1
1366 1 65 PRO QB 1 66 ALA MB 4.220 . 4.220 4.032 3.854 4.280 0.060 13 0 "[ . 1 . 2]" 1
1367 1 65 PRO HB2 1 66 ALA H 3.650 . 3.650 2.698 2.552 2.859 . 0 0 "[ . 1 . 2]" 1
1368 1 65 PRO HB3 1 66 ALA H 3.650 . 3.650 3.609 3.525 3.659 0.009 17 0 "[ . 1 . 2]" 1
1369 1 66 ALA H 1 66 ALA MB 2.400 . 2.400 2.256 2.215 2.409 0.009 4 0 "[ . 1 . 2]" 1
1370 1 66 ALA HA 1 67 LYS H 2.610 . 2.610 2.310 2.179 2.469 . 0 0 "[ . 1 . 2]" 1
1371 1 66 ALA MB 1 67 LYS H 3.100 . 3.100 2.670 2.395 2.898 . 0 0 "[ . 1 . 2]" 1
1372 1 66 ALA MB 1 67 LYS HA 5.010 . 5.010 4.049 3.814 4.330 . 0 0 "[ . 1 . 2]" 1
1373 1 66 ALA MB 1 68 SER H 4.150 . 4.150 3.600 2.622 4.232 0.082 3 0 "[ . 1 . 2]" 1
1374 1 67 LYS H 1 67 LYS HB2 3.730 . 3.730 3.160 2.583 3.756 0.026 5 0 "[ . 1 . 2]" 1
1375 1 67 LYS H 1 67 LYS QB 3.010 . 3.010 2.629 2.310 3.018 0.008 5 0 "[ . 1 . 2]" 1
1376 1 67 LYS H 1 67 LYS HB3 3.730 . 3.730 2.877 2.573 3.743 0.013 6 0 "[ . 1 . 2]" 1
1377 1 67 LYS H 1 67 LYS QG 4.230 . 4.230 3.687 2.021 4.263 0.033 19 0 "[ . 1 . 2]" 1
1378 1 67 LYS HA 1 68 SER H 3.140 . 3.140 2.417 2.086 3.164 0.024 16 0 "[ . 1 . 2]" 1
1379 1 67 LYS HB2 1 68 SER H 4.740 . 4.740 4.477 4.346 4.626 . 0 0 "[ . 1 . 2]" 1
1380 1 67 LYS HB3 1 68 SER H 4.740 . 4.740 4.376 3.779 4.677 . 0 0 "[ . 1 . 2]" 1
1381 1 67 LYS QG 1 68 SER H 4.820 . 4.820 3.714 2.977 4.661 . 0 0 "[ . 1 . 2]" 1
1382 1 67 LYS QG 1 69 GLU H 4.570 . 4.570 3.616 2.012 4.645 0.075 3 0 "[ . 1 . 2]" 1
1383 1 68 SER H 1 68 SER QB 3.520 . 3.520 2.674 2.291 3.433 . 0 0 "[ . 1 . 2]" 1
1384 1 68 SER H 1 69 GLU H 4.160 . 4.160 3.351 2.420 4.205 0.045 2 0 "[ . 1 . 2]" 1
1385 1 68 SER HA 1 69 GLU H 3.230 . 3.230 2.595 2.092 3.011 . 0 0 "[ . 1 . 2]" 1
1386 1 68 SER QB 1 69 GLU H 4.410 . 4.410 3.833 3.273 4.074 . 0 0 "[ . 1 . 2]" 1
1387 1 69 GLU H 1 69 GLU QB 3.680 . 3.680 2.888 2.533 3.450 . 0 0 "[ . 1 . 2]" 1
1388 1 69 GLU QB 1 69 GLU QG 2.310 . 2.310 2.097 2.023 2.118 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Saturday, June 1, 2024 6:07:24 PM GMT (wattos1)