NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
621406 |
5o1q   |
34139 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5o1q
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 2469
_Distance_constraint_stats_list.Viol_count 1463
_Distance_constraint_stats_list.Viol_total 493.055
_Distance_constraint_stats_list.Viol_max 0.244
_Distance_constraint_stats_list.Viol_rms 0.0114
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0020
_Distance_constraint_stats_list.Viol_average_violations_only 0.0337
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 THR 0.000 0.000 . 0 "[ . 1]"
1 3 PRO 0.000 0.000 . 0 "[ . 1]"
1 5 THR 0.000 0.000 . 0 "[ . 1]"
1 6 ARG 0.635 0.153 7 0 "[ . 1]"
1 7 PRO 0.589 0.153 7 0 "[ . 1]"
1 8 VAL 0.011 0.011 2 0 "[ . 1]"
1 9 THR 0.171 0.094 8 0 "[ . 1]"
1 10 GLY 0.000 0.000 . 0 "[ . 1]"
1 11 SER 0.307 0.058 2 0 "[ . 1]"
1 12 TRP 0.973 0.074 2 0 "[ . 1]"
1 13 LYS 0.187 0.031 9 0 "[ . 1]"
1 14 LYS 2.007 0.109 9 0 "[ . 1]"
1 15 ASN 0.334 0.092 2 0 "[ . 1]"
1 16 GLN 0.110 0.033 5 0 "[ . 1]"
1 17 TYR 0.276 0.034 3 0 "[ . 1]"
1 18 GLY 0.707 0.100 2 0 "[ . 1]"
1 19 THR 0.126 0.040 8 0 "[ . 1]"
1 20 TRP 1.214 0.098 8 0 "[ . 1]"
1 21 TYR 0.225 0.032 9 0 "[ . 1]"
1 22 LYS 1.225 0.122 1 0 "[ . 1]"
1 23 PRO 0.969 0.122 1 0 "[ . 1]"
1 24 GLU 1.250 0.129 1 0 "[ . 1]"
1 25 ASN 0.000 0.000 . 0 "[ . 1]"
1 26 ALA 1.629 0.143 8 0 "[ . 1]"
1 27 THR 1.586 0.095 4 0 "[ . 1]"
1 28 PHE 0.236 0.030 7 0 "[ . 1]"
1 29 VAL 0.715 0.077 2 0 "[ . 1]"
1 30 ASN 2.413 0.135 7 0 "[ . 1]"
1 31 GLY 0.126 0.032 6 0 "[ . 1]"
1 32 ASN 0.620 0.180 1 0 "[ . 1]"
1 33 GLN 1.765 0.180 1 0 "[ . 1]"
1 34 PRO 1.646 0.068 3 0 "[ . 1]"
1 35 ILE 3.169 0.135 7 0 "[ . 1]"
1 36 VAL 0.610 0.110 2 0 "[ . 1]"
1 37 THR 0.409 0.065 6 0 "[ . 1]"
1 38 ARG 1.368 0.093 5 0 "[ . 1]"
1 39 ILE 1.398 0.124 5 0 "[ . 1]"
1 40 GLY 0.150 0.032 7 0 "[ . 1]"
1 41 SER 2.207 0.244 4 0 "[ . 1]"
1 42 PRO 0.270 0.034 6 0 "[ . 1]"
1 43 PHE 0.599 0.073 5 0 "[ . 1]"
1 44 LEU 0.944 0.073 5 0 "[ . 1]"
1 45 ASN 0.000 0.000 . 0 "[ . 1]"
1 46 ALA 0.332 0.089 1 0 "[ . 1]"
1 47 PRO 0.010 0.005 1 0 "[ . 1]"
1 48 VAL 0.872 0.136 9 0 "[ . 1]"
1 49 GLY 0.305 0.053 9 0 "[ . 1]"
1 50 GLY 0.000 0.000 . 0 "[ . 1]"
1 51 ASN 0.710 0.136 9 0 "[ . 1]"
1 52 LEU 3.258 0.168 8 0 "[ . 1]"
1 53 PRO 2.677 0.168 8 0 "[ . 1]"
1 54 ALA 0.818 0.068 3 0 "[ . 1]"
1 55 GLY 0.093 0.031 5 0 "[ . 1]"
1 56 ALA 0.790 0.100 9 0 "[ . 1]"
1 57 THR 0.915 0.100 9 0 "[ . 1]"
1 58 ILE 1.973 0.116 8 0 "[ . 1]"
1 59 VAL 0.832 0.123 8 0 "[ . 1]"
1 60 TYR 0.914 0.088 6 0 "[ . 1]"
1 61 ASP 0.781 0.116 6 0 "[ . 1]"
1 62 GLU 2.169 0.129 1 0 "[ . 1]"
1 63 VAL 1.883 0.117 4 0 "[ . 1]"
1 64 CYS 0.241 0.039 5 0 "[ . 1]"
1 65 ILE 0.757 0.050 3 0 "[ . 1]"
1 66 GLN 0.342 0.053 4 0 "[ . 1]"
1 67 ALA 0.376 0.053 4 0 "[ . 1]"
1 68 GLY 0.000 0.000 . 0 "[ . 1]"
1 69 HIS 0.269 0.056 7 0 "[ . 1]"
1 70 ILE 0.562 0.048 9 0 "[ . 1]"
1 71 TRP 1.761 0.117 4 0 "[ . 1]"
1 72 ILE 3.401 0.144 4 0 "[ . 1]"
1 73 GLY 0.006 0.006 3 0 "[ . 1]"
1 74 TYR 1.456 0.123 8 0 "[ . 1]"
1 75 ASN 0.180 0.119 9 0 "[ . 1]"
1 76 ALA 0.792 0.119 9 0 "[ . 1]"
1 77 TYR 0.387 0.074 1 0 "[ . 1]"
1 78 ASN 0.000 0.000 . 0 "[ . 1]"
1 79 GLY 0.041 0.041 9 0 "[ . 1]"
1 80 ASN 0.372 0.108 5 0 "[ . 1]"
1 81 ARG 2.490 0.244 4 0 "[ . 1]"
1 82 VAL 2.775 0.108 5 0 "[ . 1]"
1 83 TYR 1.130 0.124 5 0 "[ . 1]"
1 84 CYS 0.240 0.046 5 0 "[ . 1]"
1 85 PRO 0.026 0.011 5 0 "[ . 1]"
1 86 VAL 0.602 0.049 8 0 "[ . 1]"
1 87 ARG 0.430 0.144 4 0 "[ . 1]"
1 88 THR 0.248 0.056 7 0 "[ . 1]"
1 89 CYS 0.459 0.080 9 0 "[ . 1]"
1 90 GLN 0.858 0.082 9 0 "[ . 1]"
1 91 GLY 0.185 0.042 2 0 "[ . 1]"
1 92 VAL 1.204 0.109 9 0 "[ . 1]"
1 93 PRO 2.705 0.081 9 0 "[ . 1]"
1 94 PRO 0.677 0.048 3 0 "[ . 1]"
1 95 ASN 0.988 0.069 8 0 "[ . 1]"
1 96 GLN 2.795 0.117 2 0 "[ . 1]"
1 97 ILE 2.090 0.117 2 0 "[ . 1]"
1 98 PRO 0.838 0.049 8 0 "[ . 1]"
1 99 GLY 0.000 0.000 . 0 "[ . 1]"
1 100 VAL 0.000 0.000 . 0 "[ . 1]"
1 101 ALA 0.625 0.086 3 0 "[ . 1]"
1 102 TRP 2.185 0.090 7 0 "[ . 1]"
1 103 GLY 0.629 0.098 9 0 "[ . 1]"
1 104 VAL 3.038 0.127 2 0 "[ . 1]"
1 105 PHE 2.132 0.143 8 0 "[ . 1]"
1 106 LYS 1.949 0.095 4 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 THR HA 1 3 PRO HD2 3.380 . 3.380 2.462 2.019 2.777 . 0 0 "[ . 1]" 1
2 1 2 THR HA 1 3 PRO QD 2.850 . 2.850 2.022 1.929 2.211 . 0 0 "[ . 1]" 1
3 1 2 THR HA 1 3 PRO HD3 3.380 . 3.380 2.224 1.987 2.584 . 0 0 "[ . 1]" 1
4 1 2 THR MG 1 3 PRO QB 5.220 . 5.220 4.609 4.150 5.122 . 0 0 "[ . 1]" 1
5 1 2 THR MG 1 3 PRO QD 4.170 . 4.170 2.836 2.280 3.667 . 0 0 "[ . 1]" 1
6 1 5 THR HA 1 5 THR MG 3.110 . 3.110 2.300 2.198 2.432 . 0 0 "[ . 1]" 1
7 1 6 ARG HA 1 6 ARG QD 4.080 . 4.080 3.684 2.206 4.126 0.046 8 0 "[ . 1]" 1
8 1 6 ARG HA 1 6 ARG QG 3.960 . 3.960 2.470 2.299 2.871 . 0 0 "[ . 1]" 1
9 1 6 ARG HA 1 7 PRO HD2 2.930 . 2.930 2.532 1.986 2.948 0.018 6 0 "[ . 1]" 1
10 1 6 ARG HA 1 7 PRO HD3 2.930 . 2.930 2.064 1.909 2.362 . 0 0 "[ . 1]" 1
11 1 6 ARG QB 1 6 ARG QD 3.460 . 3.460 2.258 2.054 2.820 . 0 0 "[ . 1]" 1
12 1 6 ARG QB 1 7 PRO QD 3.180 . 3.180 2.730 2.294 3.333 0.153 7 0 "[ . 1]" 1
13 1 6 ARG QG 1 7 PRO HD2 3.700 . 3.700 3.158 2.173 3.710 0.010 6 0 "[ . 1]" 1
14 1 6 ARG QG 1 7 PRO QD 3.230 . 3.230 2.906 2.157 3.264 0.034 8 0 "[ . 1]" 1
15 1 6 ARG QG 1 7 PRO HD3 3.700 . 3.700 3.662 3.544 3.732 0.032 2 0 "[ . 1]" 1
16 1 7 PRO HA 1 8 VAL QG 4.240 . 4.240 3.687 3.316 3.860 . 0 0 "[ . 1]" 1
17 1 7 PRO QB 1 8 VAL QG 4.880 . 4.880 4.534 4.031 4.773 . 0 0 "[ . 1]" 1
18 1 8 VAL HA 1 8 VAL QG 2.830 . 2.830 2.287 2.166 2.366 . 0 0 "[ . 1]" 1
19 1 8 VAL QG 1 20 TRP HH2 4.750 . 4.750 2.965 2.225 4.063 . 0 0 "[ . 1]" 1
20 1 8 VAL QG 1 20 TRP HZ3 4.560 . 4.560 3.207 2.179 4.571 0.011 2 0 "[ . 1]" 1
21 1 8 VAL QG 1 94 PRO QD 5.080 . 5.080 4.069 2.165 5.068 . 0 0 "[ . 1]" 1
22 1 9 THR H 1 9 THR MG 4.730 . 4.730 3.000 1.977 3.984 . 0 0 "[ . 1]" 1
23 1 9 THR HA 1 9 THR MG 3.210 . 3.210 2.354 2.171 3.225 0.015 7 0 "[ . 1]" 1
24 1 9 THR HA 1 94 PRO HG3 4.770 . 4.770 4.570 4.077 4.783 0.013 2 0 "[ . 1]" 1
25 1 9 THR MG 1 10 GLY H 4.470 . 4.470 4.024 3.129 4.443 . 0 0 "[ . 1]" 1
26 1 9 THR MG 1 20 TRP HH2 3.910 . 3.910 2.989 2.405 3.655 . 0 0 "[ . 1]" 1
27 1 9 THR MG 1 20 TRP HZ2 4.760 . 4.760 4.546 3.800 4.854 0.094 8 0 "[ . 1]" 1
28 1 9 THR MG 1 20 TRP HZ3 4.120 . 4.120 2.528 1.906 3.960 . 0 0 "[ . 1]" 1
29 1 9 THR MG 1 94 PRO HB2 5.270 . 5.270 4.205 3.621 5.294 0.024 2 0 "[ . 1]" 1
30 1 9 THR MG 1 94 PRO QB 4.630 . 4.630 2.780 2.101 3.815 . 0 0 "[ . 1]" 1
31 1 9 THR MG 1 94 PRO HB3 5.270 . 5.270 2.835 2.115 3.958 . 0 0 "[ . 1]" 1
32 1 9 THR MG 1 94 PRO QD 3.890 . 3.890 2.318 1.952 2.969 . 0 0 "[ . 1]" 1
33 1 9 THR MG 1 94 PRO HG3 4.460 . 4.460 3.226 2.491 3.812 . 0 0 "[ . 1]" 1
34 1 11 SER HA 1 12 TRP HD1 5.330 . 5.330 5.188 4.852 5.388 0.058 2 0 "[ . 1]" 1
35 1 11 SER HB2 1 12 TRP H 4.090 . 4.090 2.933 2.212 4.109 0.019 5 0 "[ . 1]" 1
36 1 11 SER HB3 1 12 TRP H 4.090 . 4.090 3.687 3.150 4.139 0.049 7 0 "[ . 1]" 1
37 1 12 TRP H 1 12 TRP HB2 3.870 . 3.870 2.450 2.404 2.592 . 0 0 "[ . 1]" 1
38 1 12 TRP H 1 12 TRP QB 3.360 . 3.360 2.413 2.372 2.547 . 0 0 "[ . 1]" 1
39 1 12 TRP H 1 12 TRP HB3 3.870 . 3.870 3.626 3.592 3.739 . 0 0 "[ . 1]" 1
40 1 12 TRP H 1 12 TRP HD1 3.620 . 3.620 2.674 2.428 3.033 . 0 0 "[ . 1]" 1
41 1 12 TRP HA 1 12 TRP HE3 4.010 . 4.010 3.326 3.119 3.623 . 0 0 "[ . 1]" 1
42 1 12 TRP HA 1 13 LYS H 2.900 . 2.900 2.173 2.029 2.336 . 0 0 "[ . 1]" 1
43 1 12 TRP HA 1 20 TRP HE3 4.420 . 4.420 4.178 3.872 4.435 0.015 4 0 "[ . 1]" 1
44 1 12 TRP HA 1 22 LYS HB2 4.060 . 4.060 3.715 3.533 4.011 . 0 0 "[ . 1]" 1
45 1 12 TRP HA 1 22 LYS HB3 3.900 . 3.900 2.401 2.112 2.544 . 0 0 "[ . 1]" 1
46 1 12 TRP HA 1 22 LYS QD 4.530 . 4.530 4.024 3.742 4.376 . 0 0 "[ . 1]" 1
47 1 12 TRP QB 1 12 TRP HE3 3.630 . 3.630 2.475 2.336 2.555 . 0 0 "[ . 1]" 1
48 1 12 TRP QB 1 13 LYS H 3.710 . 3.710 2.865 2.505 3.186 . 0 0 "[ . 1]" 1
49 1 12 TRP QB 1 13 LYS QG 5.340 . 5.340 4.551 4.429 4.713 . 0 0 "[ . 1]" 1
50 1 12 TRP QB 1 20 TRP HA 5.270 . 5.270 4.153 3.837 4.446 . 0 0 "[ . 1]" 1
51 1 12 TRP QB 1 20 TRP HE3 3.270 . 3.270 2.224 2.058 2.384 . 0 0 "[ . 1]" 1
52 1 12 TRP QB 1 20 TRP HZ3 3.850 . 3.850 3.535 3.299 3.837 . 0 0 "[ . 1]" 1
53 1 12 TRP QB 1 22 LYS HB3 5.000 . 5.000 3.959 3.729 4.208 . 0 0 "[ . 1]" 1
54 1 12 TRP QB 1 93 PRO QB 3.890 . 3.890 2.953 2.701 3.152 . 0 0 "[ . 1]" 1
55 1 12 TRP QB 1 93 PRO HG2 4.320 . 4.320 2.905 2.610 3.125 . 0 0 "[ . 1]" 1
56 1 12 TRP QB 1 93 PRO HG3 4.720 . 4.720 2.922 2.705 3.027 . 0 0 "[ . 1]" 1
57 1 12 TRP HB2 1 13 LYS H 4.370 . 4.370 3.989 3.765 4.204 . 0 0 "[ . 1]" 1
58 1 12 TRP HB2 1 20 TRP HE3 3.750 . 3.750 2.988 2.365 3.333 . 0 0 "[ . 1]" 1
59 1 12 TRP HB2 1 20 TRP HZ3 4.400 . 4.400 3.834 3.523 4.278 . 0 0 "[ . 1]" 1
60 1 12 TRP HB2 1 93 PRO HB2 5.290 . 5.290 3.176 2.842 3.439 . 0 0 "[ . 1]" 1
61 1 12 TRP HB2 1 93 PRO HB3 5.290 . 5.290 4.130 3.897 4.384 . 0 0 "[ . 1]" 1
62 1 12 TRP HB3 1 13 LYS H 4.370 . 4.370 2.939 2.543 3.300 . 0 0 "[ . 1]" 1
63 1 12 TRP HB3 1 20 TRP HE3 3.750 . 3.750 2.307 2.161 2.441 . 0 0 "[ . 1]" 1
64 1 12 TRP HB3 1 20 TRP HZ3 4.400 . 4.400 4.177 3.921 4.338 . 0 0 "[ . 1]" 1
65 1 12 TRP HB3 1 93 PRO HB2 5.290 . 5.290 4.091 3.430 4.453 . 0 0 "[ . 1]" 1
66 1 12 TRP HB3 1 93 PRO HB3 5.290 . 5.290 4.704 4.233 5.034 . 0 0 "[ . 1]" 1
67 1 12 TRP HD1 1 22 LYS QD 4.300 . 4.300 4.135 3.832 4.334 0.034 4 0 "[ . 1]" 1
68 1 12 TRP HD1 1 93 PRO HB2 4.380 . 4.380 3.858 3.231 4.223 . 0 0 "[ . 1]" 1
69 1 12 TRP HD1 1 93 PRO QB 3.760 . 3.760 3.497 3.001 3.782 0.022 1 0 "[ . 1]" 1
70 1 12 TRP HD1 1 93 PRO HB3 4.380 . 4.380 4.027 3.562 4.311 . 0 0 "[ . 1]" 1
71 1 12 TRP HE3 1 13 LYS H 4.310 . 4.310 3.694 3.368 3.982 . 0 0 "[ . 1]" 1
72 1 12 TRP HE3 1 20 TRP HA 4.780 . 4.780 4.081 3.941 4.236 . 0 0 "[ . 1]" 1
73 1 12 TRP HE3 1 20 TRP HB2 4.350 . 4.350 3.498 3.078 3.669 . 0 0 "[ . 1]" 1
74 1 12 TRP HE3 1 20 TRP HB3 3.800 . 3.800 2.573 2.367 2.694 . 0 0 "[ . 1]" 1
75 1 12 TRP HE3 1 20 TRP HE3 4.170 . 4.170 4.116 3.918 4.214 0.044 7 0 "[ . 1]" 1
76 1 12 TRP HE3 1 21 TYR H 4.150 . 4.150 3.170 2.911 3.397 . 0 0 "[ . 1]" 1
77 1 12 TRP HE3 1 21 TYR HA 3.980 . 3.980 2.918 2.707 3.035 . 0 0 "[ . 1]" 1
78 1 12 TRP HE3 1 22 LYS HB3 4.360 . 4.360 3.552 3.448 3.911 . 0 0 "[ . 1]" 1
79 1 12 TRP HE3 1 22 LYS QE 5.500 . 5.500 5.233 4.875 5.531 0.031 8 0 "[ . 1]" 1
80 1 12 TRP HE3 1 65 ILE HB 5.070 . 5.070 4.468 4.246 4.651 . 0 0 "[ . 1]" 1
81 1 12 TRP HE3 1 65 ILE MD 4.290 . 4.290 3.734 3.650 3.856 . 0 0 "[ . 1]" 1
82 1 12 TRP HE3 1 93 PRO HG2 4.680 . 4.680 4.555 3.938 4.692 0.012 8 0 "[ . 1]" 1
83 1 12 TRP HE3 1 93 PRO HG3 4.780 . 4.780 3.710 3.380 3.940 . 0 0 "[ . 1]" 1
84 1 12 TRP HH2 1 21 TYR HA 5.500 . 5.500 4.959 4.724 5.192 . 0 0 "[ . 1]" 1
85 1 12 TRP HH2 1 22 LYS QE 4.370 . 4.370 3.154 2.730 3.668 . 0 0 "[ . 1]" 1
86 1 12 TRP HH2 1 22 LYS HG3 5.360 . 5.360 5.018 4.833 5.304 . 0 0 "[ . 1]" 1
87 1 12 TRP HH2 1 63 VAL HB 4.560 . 4.560 2.745 2.539 2.925 . 0 0 "[ . 1]" 1
88 1 12 TRP HH2 1 63 VAL MG1 3.930 . 3.930 2.069 1.968 2.330 . 0 0 "[ . 1]" 1
89 1 12 TRP HH2 1 63 VAL QG 3.120 . 3.120 2.060 1.960 2.306 . 0 0 "[ . 1]" 1
90 1 12 TRP HH2 1 63 VAL MG2 3.930 . 3.930 3.845 3.675 3.955 0.025 6 0 "[ . 1]" 1
91 1 12 TRP HH2 1 64 CYS HA 5.500 . 5.500 4.545 4.292 4.881 . 0 0 "[ . 1]" 1
92 1 12 TRP HH2 1 65 ILE MD 3.840 . 3.840 3.159 3.063 3.278 . 0 0 "[ . 1]" 1
93 1 12 TRP HH2 1 65 ILE HG12 4.480 . 4.480 3.737 3.534 4.116 . 0 0 "[ . 1]" 1
94 1 12 TRP HH2 1 65 ILE HG13 4.070 . 4.070 2.976 2.727 3.383 . 0 0 "[ . 1]" 1
95 1 12 TRP HH2 1 70 ILE MD 4.690 . 4.690 3.713 3.423 3.945 . 0 0 "[ . 1]" 1
96 1 12 TRP HH2 1 70 ILE MG 3.940 . 3.940 2.851 2.584 3.360 . 0 0 "[ . 1]" 1
97 1 12 TRP HZ2 1 22 LYS QE 4.060 . 4.060 2.660 2.287 3.201 . 0 0 "[ . 1]" 1
98 1 12 TRP HZ2 1 63 VAL MG1 4.810 . 4.810 3.632 3.474 4.120 . 0 0 "[ . 1]" 1
99 1 12 TRP HZ2 1 63 VAL QG 3.960 . 3.960 3.505 3.373 3.900 . 0 0 "[ . 1]" 1
100 1 12 TRP HZ2 1 63 VAL MG2 4.810 . 4.810 4.628 4.426 4.827 0.017 5 0 "[ . 1]" 1
101 1 12 TRP HZ2 1 65 ILE MD 4.270 . 4.270 3.341 3.134 3.603 . 0 0 "[ . 1]" 1
102 1 12 TRP HZ2 1 96 GLN HG3 5.320 . 5.320 5.126 4.557 5.394 0.074 2 0 "[ . 1]" 1
103 1 12 TRP HZ3 1 20 TRP HB2 4.540 . 4.540 4.307 3.959 4.565 0.025 8 0 "[ . 1]" 1
104 1 12 TRP HZ3 1 20 TRP HB3 4.570 . 4.570 4.348 4.199 4.571 0.001 7 0 "[ . 1]" 1
105 1 12 TRP HZ3 1 21 TYR HA 3.590 . 3.590 2.695 2.409 2.862 . 0 0 "[ . 1]" 1
106 1 12 TRP HZ3 1 21 TYR HB2 5.500 . 5.500 4.950 4.634 5.170 . 0 0 "[ . 1]" 1
107 1 12 TRP HZ3 1 22 LYS H 4.570 . 4.570 3.611 3.443 3.865 . 0 0 "[ . 1]" 1
108 1 12 TRP HZ3 1 22 LYS HG2 5.000 . 5.000 3.427 3.262 3.800 . 0 0 "[ . 1]" 1
109 1 12 TRP HZ3 1 63 VAL HB 5.500 . 5.500 3.313 3.055 3.594 . 0 0 "[ . 1]" 1
110 1 12 TRP HZ3 1 63 VAL QG 3.720 . 3.720 3.068 2.976 3.273 . 0 0 "[ . 1]" 1
111 1 12 TRP HZ3 1 64 CYS HA 3.950 . 3.950 2.552 2.272 2.742 . 0 0 "[ . 1]" 1
112 1 12 TRP HZ3 1 64 CYS QB 5.340 . 5.340 4.499 4.249 4.697 . 0 0 "[ . 1]" 1
113 1 12 TRP HZ3 1 65 ILE H 4.170 . 4.170 3.295 3.038 3.530 . 0 0 "[ . 1]" 1
114 1 12 TRP HZ3 1 65 ILE HB 4.770 . 4.770 4.133 3.825 4.394 . 0 0 "[ . 1]" 1
115 1 12 TRP HZ3 1 65 ILE MD 4.110 . 4.110 3.488 3.338 3.689 . 0 0 "[ . 1]" 1
116 1 12 TRP HZ3 1 65 ILE HG12 4.990 . 4.990 3.982 3.840 4.158 . 0 0 "[ . 1]" 1
117 1 12 TRP HZ3 1 65 ILE HG13 4.180 . 4.180 2.384 2.249 2.548 . 0 0 "[ . 1]" 1
118 1 12 TRP HZ3 1 70 ILE MG 5.500 . 5.500 4.021 3.832 4.168 . 0 0 "[ . 1]" 1
119 1 13 LYS H 1 13 LYS HB2 3.800 . 3.800 2.606 2.493 2.741 . 0 0 "[ . 1]" 1
120 1 13 LYS H 1 13 LYS QB 3.220 . 3.220 2.559 2.454 2.682 . 0 0 "[ . 1]" 1
121 1 13 LYS H 1 13 LYS HB3 3.800 . 3.800 3.740 3.665 3.803 0.003 1 0 "[ . 1]" 1
122 1 13 LYS H 1 13 LYS QE 5.400 . 5.400 4.164 3.734 5.068 . 0 0 "[ . 1]" 1
123 1 13 LYS H 1 13 LYS QG 3.730 . 3.730 3.073 2.869 3.320 . 0 0 "[ . 1]" 1
124 1 13 LYS H 1 14 LYS H 4.570 . 4.570 4.350 4.307 4.422 . 0 0 "[ . 1]" 1
125 1 13 LYS H 1 20 TRP HA 4.780 . 4.780 4.137 4.010 4.371 . 0 0 "[ . 1]" 1
126 1 13 LYS H 1 20 TRP HB3 5.030 . 5.030 4.141 3.955 4.334 . 0 0 "[ . 1]" 1
127 1 13 LYS H 1 20 TRP HE3 4.600 . 4.600 3.464 3.234 3.716 . 0 0 "[ . 1]" 1
128 1 13 LYS H 1 21 TYR H 3.700 . 3.700 2.718 2.547 2.909 . 0 0 "[ . 1]" 1
129 1 13 LYS H 1 22 LYS HB3 4.130 . 4.130 3.847 3.641 4.140 0.010 3 0 "[ . 1]" 1
130 1 13 LYS HA 1 13 LYS QD 4.570 . 4.570 4.111 3.976 4.267 . 0 0 "[ . 1]" 1
131 1 13 LYS HA 1 13 LYS QG 3.290 . 3.290 2.432 2.317 2.509 . 0 0 "[ . 1]" 1
132 1 13 LYS HA 1 14 LYS H 2.890 . 2.890 2.306 2.137 2.397 . 0 0 "[ . 1]" 1
133 1 13 LYS HA 1 20 TRP HZ3 4.070 . 4.070 3.310 2.801 3.817 . 0 0 "[ . 1]" 1
134 1 13 LYS QB 1 13 LYS QD 3.450 . 3.450 2.327 2.299 2.367 . 0 0 "[ . 1]" 1
135 1 13 LYS QB 1 13 LYS QE 3.780 . 3.780 2.040 1.970 2.143 . 0 0 "[ . 1]" 1
136 1 13 LYS QB 1 14 LYS H 3.370 . 3.370 2.788 2.574 2.964 . 0 0 "[ . 1]" 1
137 1 13 LYS QB 1 21 TYR H 4.420 . 4.420 3.865 3.419 4.060 . 0 0 "[ . 1]" 1
138 1 13 LYS QB 1 21 TYR QE 3.390 . 3.390 3.212 2.865 3.421 0.031 9 0 "[ . 1]" 1
139 1 13 LYS HB2 1 13 LYS QE 4.510 . 4.510 2.187 2.010 2.816 . 0 0 "[ . 1]" 1
140 1 13 LYS HB2 1 21 TYR QE 3.880 . 3.880 3.495 2.954 3.795 . 0 0 "[ . 1]" 1
141 1 13 LYS HB3 1 13 LYS QE 4.510 . 4.510 2.900 2.085 3.327 . 0 0 "[ . 1]" 1
142 1 13 LYS HB3 1 21 TYR QE 3.880 . 3.880 3.786 3.407 3.908 0.028 4 0 "[ . 1]" 1
143 1 13 LYS QE 1 13 LYS QG 2.960 . 2.960 2.614 2.294 2.844 . 0 0 "[ . 1]" 1
144 1 13 LYS QE 1 21 TYR QE 4.660 . 4.660 3.134 2.256 3.863 . 0 0 "[ . 1]" 1
145 1 13 LYS QG 1 14 LYS H 4.050 . 4.050 3.948 3.758 4.079 0.029 5 0 "[ . 1]" 1
146 1 13 LYS QG 1 21 TYR QE 5.500 . 5.500 4.909 4.440 5.321 . 0 0 "[ . 1]" 1
147 1 14 LYS H 1 14 LYS HB2 3.210 . 3.210 2.863 2.716 3.081 . 0 0 "[ . 1]" 1
148 1 14 LYS H 1 14 LYS HB3 3.380 . 3.380 2.582 2.428 2.689 . 0 0 "[ . 1]" 1
149 1 14 LYS H 1 14 LYS QD 5.340 . 5.340 4.820 4.364 5.111 . 0 0 "[ . 1]" 1
150 1 14 LYS H 1 14 LYS HG2 5.020 . 5.020 4.472 4.351 4.550 . 0 0 "[ . 1]" 1
151 1 14 LYS H 1 14 LYS QG 4.320 . 4.320 4.041 3.988 4.075 . 0 0 "[ . 1]" 1
152 1 14 LYS H 1 14 LYS HG3 5.020 . 5.020 4.608 4.538 4.671 . 0 0 "[ . 1]" 1
153 1 14 LYS H 1 15 ASN H 4.690 . 4.690 4.397 4.316 4.438 . 0 0 "[ . 1]" 1
154 1 14 LYS H 1 20 TRP HZ3 4.380 . 4.380 3.986 3.597 4.289 . 0 0 "[ . 1]" 1
155 1 14 LYS H 1 21 TYR H 5.150 . 5.150 4.797 4.660 4.906 . 0 0 "[ . 1]" 1
156 1 14 LYS HA 1 14 LYS QG 3.720 . 3.720 2.424 2.358 2.548 . 0 0 "[ . 1]" 1
157 1 14 LYS HA 1 15 ASN H 3.440 . 3.440 2.103 1.988 2.205 . 0 0 "[ . 1]" 1
158 1 14 LYS HA 1 20 TRP HA 3.630 . 3.630 2.073 2.017 2.182 . 0 0 "[ . 1]" 1
159 1 14 LYS HA 1 21 TYR QD 4.540 . 4.540 3.275 2.989 3.573 . 0 0 "[ . 1]" 1
160 1 14 LYS HB2 1 14 LYS HD2 3.740 . 3.740 3.424 2.421 3.686 . 0 0 "[ . 1]" 1
161 1 14 LYS HB2 1 14 LYS QD 3.200 . 3.200 2.367 2.226 2.428 . 0 0 "[ . 1]" 1
162 1 14 LYS HB2 1 14 LYS HD3 3.740 . 3.740 2.466 2.368 2.692 . 0 0 "[ . 1]" 1
163 1 14 LYS HB2 1 14 LYS HE2 4.760 . 4.760 3.941 2.779 4.420 . 0 0 "[ . 1]" 1
164 1 14 LYS HB2 1 14 LYS QE 4.060 . 4.060 3.093 2.728 4.034 . 0 0 "[ . 1]" 1
165 1 14 LYS HB2 1 14 LYS HE3 4.760 . 4.760 3.485 2.852 4.659 . 0 0 "[ . 1]" 1
166 1 14 LYS HB2 1 20 TRP HA 4.470 . 4.470 3.443 3.247 3.698 . 0 0 "[ . 1]" 1
167 1 14 LYS HB2 1 20 TRP HZ2 4.060 . 4.060 3.861 3.629 3.997 . 0 0 "[ . 1]" 1
168 1 14 LYS HB2 1 21 TYR H 5.500 . 5.500 5.028 4.858 5.339 . 0 0 "[ . 1]" 1
169 1 14 LYS HB3 1 14 LYS HD2 4.140 . 4.140 3.684 3.252 3.816 . 0 0 "[ . 1]" 1
170 1 14 LYS HB3 1 14 LYS QD 3.430 . 3.430 2.842 2.313 3.026 . 0 0 "[ . 1]" 1
171 1 14 LYS HB3 1 14 LYS HD3 4.140 . 4.140 2.960 2.366 3.174 . 0 0 "[ . 1]" 1
172 1 14 LYS HB3 1 14 LYS HE2 4.570 . 4.570 3.621 2.120 4.593 0.023 2 0 "[ . 1]" 1
173 1 14 LYS HB3 1 14 LYS HE3 4.570 . 4.570 2.894 2.206 4.657 0.087 2 0 "[ . 1]" 1
174 1 14 LYS HB3 1 15 ASN H 3.940 . 3.940 3.966 3.888 4.032 0.092 2 0 "[ . 1]" 1
175 1 14 LYS HB3 1 20 TRP HA 5.230 . 5.230 4.665 4.544 4.847 . 0 0 "[ . 1]" 1
176 1 14 LYS QD 1 15 ASN H 5.340 . 5.340 4.518 4.394 4.692 . 0 0 "[ . 1]" 1
177 1 14 LYS QD 1 18 GLY H 5.300 . 5.300 4.289 3.969 5.205 . 0 0 "[ . 1]" 1
178 1 14 LYS QD 1 18 GLY HA2 3.680 . 3.680 2.279 1.905 3.415 . 0 0 "[ . 1]" 1
179 1 14 LYS QD 1 18 GLY HA3 4.280 . 4.280 3.333 2.899 4.380 0.100 2 0 "[ . 1]" 1
180 1 14 LYS QD 1 20 TRP H 5.340 . 5.340 4.797 4.474 5.384 0.044 7 0 "[ . 1]" 1
181 1 14 LYS QD 1 20 TRP HE1 3.840 . 3.840 2.592 2.212 2.773 . 0 0 "[ . 1]" 1
182 1 14 LYS QD 1 20 TRP HZ2 3.690 . 3.690 2.980 2.725 3.263 . 0 0 "[ . 1]" 1
183 1 14 LYS HD2 1 18 GLY HA2 4.370 . 4.370 2.331 1.913 3.680 . 0 0 "[ . 1]" 1
184 1 14 LYS HD3 1 18 GLY HA2 4.370 . 4.370 3.733 3.542 4.134 . 0 0 "[ . 1]" 1
185 1 14 LYS QE 1 14 LYS QG 3.150 . 3.150 2.633 2.308 2.831 . 0 0 "[ . 1]" 1
186 1 14 LYS QE 1 15 ASN H 5.340 . 5.340 5.169 4.886 5.346 0.006 5 0 "[ . 1]" 1
187 1 14 LYS QE 1 18 GLY HA2 3.750 . 3.750 3.101 1.891 3.645 . 0 0 "[ . 1]" 1
188 1 14 LYS QE 1 18 GLY HA3 4.460 . 4.460 4.112 2.456 4.555 0.095 6 0 "[ . 1]" 1
189 1 14 LYS QE 1 20 TRP HE1 4.270 . 4.270 4.048 3.655 4.282 0.012 9 0 "[ . 1]" 1
190 1 14 LYS QE 1 20 TRP HZ2 4.310 . 4.310 3.636 3.211 4.153 . 0 0 "[ . 1]" 1
191 1 14 LYS QE 1 92 VAL MG2 5.340 . 5.340 5.167 4.460 5.449 0.109 9 0 "[ . 1]" 1
192 1 14 LYS HE2 1 14 LYS HG2 4.140 . 4.140 3.379 2.920 3.672 . 0 0 "[ . 1]" 1
193 1 14 LYS HE2 1 14 LYS HG3 4.140 . 4.140 3.789 2.668 4.187 0.047 1 0 "[ . 1]" 1
194 1 14 LYS HE2 1 18 GLY HA2 4.390 . 4.390 3.507 1.898 4.438 0.048 8 0 "[ . 1]" 1
195 1 14 LYS HE2 1 20 TRP HE1 4.900 . 4.900 4.383 4.086 4.698 . 0 0 "[ . 1]" 1
196 1 14 LYS HE2 1 20 TRP HZ2 5.010 . 5.010 4.156 3.544 5.036 0.026 7 0 "[ . 1]" 1
197 1 14 LYS HE3 1 14 LYS HG2 4.140 . 4.140 3.102 2.462 3.716 . 0 0 "[ . 1]" 1
198 1 14 LYS HE3 1 14 LYS HG3 4.140 . 4.140 3.761 3.655 3.814 . 0 0 "[ . 1]" 1
199 1 14 LYS HE3 1 18 GLY HA2 4.390 . 4.390 3.909 3.082 4.421 0.031 6 0 "[ . 1]" 1
200 1 14 LYS HE3 1 20 TRP HE1 4.900 . 4.900 4.773 4.075 4.998 0.098 8 0 "[ . 1]" 1
201 1 14 LYS HE3 1 20 TRP HZ2 5.010 . 5.010 4.180 3.547 4.989 . 0 0 "[ . 1]" 1
202 1 14 LYS QG 1 18 GLY H 3.980 . 3.980 3.177 3.055 3.352 . 0 0 "[ . 1]" 1
203 1 14 LYS QG 1 18 GLY HA2 3.640 . 3.640 2.283 2.162 2.467 . 0 0 "[ . 1]" 1
204 1 14 LYS QG 1 18 GLY HA3 4.420 . 4.420 3.716 3.541 3.916 . 0 0 "[ . 1]" 1
205 1 14 LYS QG 1 19 THR H 4.310 . 4.310 3.179 2.895 3.445 . 0 0 "[ . 1]" 1
206 1 14 LYS QG 1 20 TRP HA 4.480 . 4.480 3.229 3.006 3.738 . 0 0 "[ . 1]" 1
207 1 14 LYS HG2 1 15 ASN H 3.670 . 3.670 2.925 2.643 3.269 . 0 0 "[ . 1]" 1
208 1 14 LYS HG2 1 18 GLY HA2 4.240 . 4.240 2.452 2.317 2.675 . 0 0 "[ . 1]" 1
209 1 14 LYS HG3 1 15 ASN H 3.670 . 3.670 2.855 2.719 2.935 . 0 0 "[ . 1]" 1
210 1 14 LYS HG3 1 18 GLY HA2 4.240 . 4.240 2.798 2.363 3.026 . 0 0 "[ . 1]" 1
211 1 15 ASN H 1 15 ASN HB2 4.120 . 4.120 3.611 2.514 3.771 . 0 0 "[ . 1]" 1
212 1 15 ASN H 1 15 ASN QB 3.480 . 3.480 2.772 2.151 2.909 . 0 0 "[ . 1]" 1
213 1 15 ASN H 1 15 ASN HB3 4.120 . 4.120 2.885 2.337 3.030 . 0 0 "[ . 1]" 1
214 1 15 ASN H 1 19 THR H 4.100 . 4.100 3.214 2.967 3.468 . 0 0 "[ . 1]" 1
215 1 15 ASN H 1 19 THR HB 4.480 . 4.480 3.690 3.549 3.815 . 0 0 "[ . 1]" 1
216 1 15 ASN H 1 19 THR MG 5.500 . 5.500 4.440 4.210 4.555 . 0 0 "[ . 1]" 1
217 1 15 ASN H 1 20 TRP HA 4.440 . 4.440 3.467 3.062 3.768 . 0 0 "[ . 1]" 1
218 1 15 ASN H 1 21 TYR QD 4.250 . 4.250 2.910 2.496 3.353 . 0 0 "[ . 1]" 1
219 1 15 ASN H 1 21 TYR QE 4.010 . 4.010 3.216 2.485 3.704 . 0 0 "[ . 1]" 1
220 1 15 ASN HA 1 16 GLN HA 4.660 . 4.660 4.295 4.264 4.331 . 0 0 "[ . 1]" 1
221 1 15 ASN HA 1 21 TYR QE 3.990 . 3.990 2.839 2.475 3.368 . 0 0 "[ . 1]" 1
222 1 15 ASN QB 1 16 GLN QG 4.880 . 4.880 3.037 2.678 4.383 . 0 0 "[ . 1]" 1
223 1 15 ASN QB 1 21 TYR QD 4.160 . 4.160 2.813 2.353 3.597 . 0 0 "[ . 1]" 1
224 1 15 ASN QB 1 21 TYR QE 3.360 . 3.360 2.160 1.917 2.685 . 0 0 "[ . 1]" 1
225 1 15 ASN HB2 1 21 TYR QE 4.160 . 4.160 3.544 2.725 3.742 . 0 0 "[ . 1]" 1
226 1 15 ASN HB3 1 21 TYR QE 4.160 . 4.160 2.310 1.925 4.064 . 0 0 "[ . 1]" 1
227 1 15 ASN QD 1 19 THR HB 3.920 . 3.920 2.083 1.750 3.303 . 0 0 "[ . 1]" 1
228 1 15 ASN QD 1 19 THR MG 3.920 . 3.920 2.955 2.719 3.613 . 0 0 "[ . 1]" 1
229 1 16 GLN HA 1 16 GLN HB2 2.990 . 2.990 2.455 2.422 2.509 . 0 0 "[ . 1]" 1
230 1 16 GLN HA 1 16 GLN HB3 2.990 . 2.990 2.409 2.334 2.464 . 0 0 "[ . 1]" 1
231 1 16 GLN HA 1 16 GLN QG 3.640 . 3.640 3.338 3.328 3.349 . 0 0 "[ . 1]" 1
232 1 16 GLN HA 1 17 TYR HA 4.960 . 4.960 4.678 4.557 4.763 . 0 0 "[ . 1]" 1
233 1 16 GLN HA 1 18 GLY H 4.150 . 4.150 3.671 3.418 3.797 . 0 0 "[ . 1]" 1
234 1 16 GLN QB 1 17 TYR QE 5.340 . 5.340 4.945 4.665 5.215 . 0 0 "[ . 1]" 1
235 1 16 GLN QB 1 18 GLY H 5.340 . 5.340 4.748 4.630 4.797 . 0 0 "[ . 1]" 1
236 1 16 GLN HB2 1 17 TYR H 4.260 . 4.260 4.033 3.932 4.166 . 0 0 "[ . 1]" 1
237 1 16 GLN HB3 1 17 TYR H 4.260 . 4.260 4.215 4.139 4.293 0.033 5 0 "[ . 1]" 1
238 1 16 GLN QG 1 17 TYR H 3.470 . 3.470 2.587 2.401 2.757 . 0 0 "[ . 1]" 1
239 1 16 GLN QG 1 17 TYR HA 4.850 . 4.850 3.561 3.320 3.903 . 0 0 "[ . 1]" 1
240 1 16 GLN QG 1 17 TYR QD 3.820 . 3.820 2.853 2.417 3.055 . 0 0 "[ . 1]" 1
241 1 16 GLN QG 1 17 TYR QE 3.810 . 3.810 3.114 2.852 3.317 . 0 0 "[ . 1]" 1
242 1 16 GLN QG 1 18 GLY H 4.650 . 4.650 4.432 4.328 4.559 . 0 0 "[ . 1]" 1
243 1 16 GLN QG 1 19 THR H 5.500 . 5.500 5.447 5.296 5.513 0.013 6 0 "[ . 1]" 1
244 1 17 TYR H 1 17 TYR HB2 3.600 . 3.600 2.479 2.416 2.559 . 0 0 "[ . 1]" 1
245 1 17 TYR H 1 17 TYR QB 3.050 . 3.050 2.438 2.383 2.509 . 0 0 "[ . 1]" 1
246 1 17 TYR H 1 17 TYR HB3 3.600 . 3.600 3.622 3.609 3.634 0.034 3 0 "[ . 1]" 1
247 1 17 TYR H 1 17 TYR QD 3.600 . 3.600 2.595 2.076 2.851 . 0 0 "[ . 1]" 1
248 1 17 TYR H 1 18 GLY H 3.040 . 3.040 2.361 2.215 2.546 . 0 0 "[ . 1]" 1
249 1 17 TYR H 1 18 GLY HA2 5.040 . 5.040 4.614 4.439 4.841 . 0 0 "[ . 1]" 1
250 1 17 TYR H 1 19 THR H 4.170 . 4.170 3.289 3.182 3.464 . 0 0 "[ . 1]" 1
251 1 17 TYR HA 1 17 TYR QD 3.710 . 3.710 2.802 2.536 3.129 . 0 0 "[ . 1]" 1
252 1 17 TYR QB 1 18 GLY H 3.950 . 3.950 3.273 3.045 3.486 . 0 0 "[ . 1]" 1
253 1 17 TYR QB 1 19 THR H 3.770 . 3.770 2.830 2.560 3.166 . 0 0 "[ . 1]" 1
254 1 17 TYR QB 1 19 THR HB 4.400 . 4.400 3.108 2.640 3.510 . 0 0 "[ . 1]" 1
255 1 17 TYR HB2 1 18 GLY H 4.490 . 4.490 3.417 3.145 3.692 . 0 0 "[ . 1]" 1
256 1 17 TYR HB2 1 19 THR H 4.370 . 4.370 2.894 2.606 3.281 . 0 0 "[ . 1]" 1
257 1 17 TYR HB2 1 19 THR HB 5.200 . 5.200 3.163 2.674 3.593 . 0 0 "[ . 1]" 1
258 1 17 TYR HB3 1 18 GLY H 4.490 . 4.490 4.204 4.065 4.281 . 0 0 "[ . 1]" 1
259 1 17 TYR HB3 1 19 THR H 4.370 . 4.370 4.034 3.748 4.192 . 0 0 "[ . 1]" 1
260 1 17 TYR HB3 1 19 THR HB 5.200 . 5.200 4.586 4.083 4.974 . 0 0 "[ . 1]" 1
261 1 17 TYR QD 1 18 GLY H 4.780 . 4.780 4.488 4.105 4.779 . 0 0 "[ . 1]" 1
262 1 17 TYR QD 1 19 THR H 5.270 . 5.270 4.417 4.072 4.895 . 0 0 "[ . 1]" 1
263 1 18 GLY H 1 19 THR H 3.230 . 3.230 2.294 2.210 2.401 . 0 0 "[ . 1]" 1
264 1 18 GLY HA2 1 20 TRP HE1 5.500 . 5.500 5.365 4.974 5.521 0.021 6 0 "[ . 1]" 1
265 1 19 THR H 1 19 THR HB 3.020 . 3.020 2.407 2.367 2.445 . 0 0 "[ . 1]" 1
266 1 19 THR H 1 19 THR MG 3.870 . 3.870 3.723 3.683 3.752 . 0 0 "[ . 1]" 1
267 1 19 THR H 1 20 TRP H 5.210 . 5.210 4.401 4.357 4.448 . 0 0 "[ . 1]" 1
268 1 19 THR H 1 21 TYR QD 5.500 . 5.500 5.110 4.945 5.258 . 0 0 "[ . 1]" 1
269 1 19 THR H 1 66 GLN QE 4.500 . 4.500 3.519 3.058 4.000 . 0 0 "[ . 1]" 1
270 1 19 THR HA 1 19 THR MG 3.070 . 3.070 2.394 2.345 2.422 . 0 0 "[ . 1]" 1
271 1 19 THR HA 1 20 TRP H 3.090 . 3.090 2.183 2.149 2.216 . 0 0 "[ . 1]" 1
272 1 19 THR HA 1 20 TRP HA 4.430 . 4.430 4.401 4.378 4.428 . 0 0 "[ . 1]" 1
273 1 19 THR HA 1 66 GLN HB2 4.110 . 4.110 2.970 2.525 3.374 . 0 0 "[ . 1]" 1
274 1 19 THR HA 1 66 GLN HE21 4.010 . 4.010 2.388 1.859 2.904 . 0 0 "[ . 1]" 1
275 1 19 THR HA 1 66 GLN QE 3.520 . 3.520 2.273 1.831 2.742 . 0 0 "[ . 1]" 1
276 1 19 THR HA 1 66 GLN HE22 4.010 . 4.010 2.879 2.375 3.365 . 0 0 "[ . 1]" 1
277 1 19 THR HA 1 66 GLN HG2 4.870 . 4.870 4.293 4.068 4.511 . 0 0 "[ . 1]" 1
278 1 19 THR MG 1 20 TRP H 3.280 . 3.280 2.751 2.534 3.016 . 0 0 "[ . 1]" 1
279 1 19 THR MG 1 20 TRP HA 4.910 . 4.910 3.969 3.910 4.016 . 0 0 "[ . 1]" 1
280 1 19 THR MG 1 21 TYR H 4.960 . 4.960 4.348 4.173 4.463 . 0 0 "[ . 1]" 1
281 1 19 THR MG 1 21 TYR HB3 3.950 . 3.950 3.011 2.737 3.278 . 0 0 "[ . 1]" 1
282 1 19 THR MG 1 21 TYR QD 4.300 . 4.300 3.740 2.936 3.997 . 0 0 "[ . 1]" 1
283 1 19 THR MG 1 42 PRO QB 4.380 . 4.380 3.317 3.134 3.426 . 0 0 "[ . 1]" 1
284 1 19 THR MG 1 42 PRO QD 4.590 . 4.590 3.275 3.099 3.389 . 0 0 "[ . 1]" 1
285 1 19 THR MG 1 42 PRO HG2 3.440 . 3.440 2.086 1.980 2.214 . 0 0 "[ . 1]" 1
286 1 19 THR MG 1 64 CYS HA 3.710 . 3.710 3.369 3.180 3.597 . 0 0 "[ . 1]" 1
287 1 19 THR MG 1 64 CYS QB 2.880 . 2.880 2.048 1.874 2.160 . 0 0 "[ . 1]" 1
288 1 19 THR MG 1 65 ILE H 3.710 . 3.710 2.798 2.608 3.033 . 0 0 "[ . 1]" 1
289 1 19 THR MG 1 65 ILE HB 5.070 . 5.070 4.478 4.265 4.845 . 0 0 "[ . 1]" 1
290 1 19 THR MG 1 66 GLN H 4.300 . 4.300 4.241 4.041 4.312 0.012 1 0 "[ . 1]" 1
291 1 19 THR MG 1 66 GLN HA 4.790 . 4.790 3.990 3.813 4.103 . 0 0 "[ . 1]" 1
292 1 19 THR MG 1 66 GLN HB2 3.360 . 3.360 1.959 1.891 2.092 . 0 0 "[ . 1]" 1
293 1 19 THR MG 1 66 GLN HB3 3.700 . 3.700 3.116 2.865 3.298 . 0 0 "[ . 1]" 1
294 1 19 THR MG 1 66 GLN HE21 4.540 . 4.540 2.971 2.368 3.499 . 0 0 "[ . 1]" 1
295 1 19 THR MG 1 66 GLN QE 3.920 . 3.920 2.910 2.345 3.395 . 0 0 "[ . 1]" 1
296 1 19 THR MG 1 66 GLN HE22 4.540 . 4.540 4.219 3.765 4.580 0.040 8 0 "[ . 1]" 1
297 1 20 TRP H 1 20 TRP HB2 3.600 . 3.600 2.394 2.374 2.413 . 0 0 "[ . 1]" 1
298 1 20 TRP H 1 20 TRP HB3 3.900 . 3.900 3.598 3.586 3.618 . 0 0 "[ . 1]" 1
299 1 20 TRP H 1 20 TRP HD1 3.830 . 3.830 2.550 2.383 2.798 . 0 0 "[ . 1]" 1
300 1 20 TRP H 1 65 ILE H 4.100 . 4.100 3.077 2.946 3.211 . 0 0 "[ . 1]" 1
301 1 20 TRP H 1 65 ILE HB 3.970 . 3.970 3.333 3.160 3.391 . 0 0 "[ . 1]" 1
302 1 20 TRP H 1 65 ILE MD 5.090 . 5.090 5.065 4.934 5.140 0.050 3 0 "[ . 1]" 1
303 1 20 TRP H 1 65 ILE MG 4.460 . 4.460 4.202 4.092 4.278 . 0 0 "[ . 1]" 1
304 1 20 TRP H 1 66 GLN HB2 4.800 . 4.800 3.992 3.734 4.169 . 0 0 "[ . 1]" 1
305 1 20 TRP H 1 66 GLN QE 5.340 . 5.340 3.885 3.122 4.617 . 0 0 "[ . 1]" 1
306 1 20 TRP H 1 92 VAL MG1 4.760 . 4.760 4.202 3.917 4.562 . 0 0 "[ . 1]" 1
307 1 20 TRP HA 1 20 TRP HE3 4.370 . 4.370 3.335 3.096 3.470 . 0 0 "[ . 1]" 1
308 1 20 TRP HA 1 21 TYR H 3.160 . 3.160 2.163 2.104 2.206 . 0 0 "[ . 1]" 1
309 1 20 TRP HA 1 21 TYR HA 5.400 . 5.400 4.376 4.349 4.421 . 0 0 "[ . 1]" 1
310 1 20 TRP HA 1 21 TYR QD 4.290 . 4.290 3.421 3.111 3.755 . 0 0 "[ . 1]" 1
311 1 20 TRP HA 1 65 ILE HB 5.500 . 5.500 4.993 4.859 5.224 . 0 0 "[ . 1]" 1
312 1 20 TRP HB2 1 20 TRP HE1 4.940 . 4.940 4.793 4.773 4.832 . 0 0 "[ . 1]" 1
313 1 20 TRP HB2 1 65 ILE H 4.660 . 4.660 3.179 2.950 3.283 . 0 0 "[ . 1]" 1
314 1 20 TRP HB2 1 65 ILE HB 3.530 . 3.530 2.137 1.964 2.417 . 0 0 "[ . 1]" 1
315 1 20 TRP HB2 1 65 ILE MD 4.140 . 4.140 3.253 3.107 3.408 . 0 0 "[ . 1]" 1
316 1 20 TRP HB2 1 65 ILE MG 4.200 . 4.200 3.626 3.497 3.857 . 0 0 "[ . 1]" 1
317 1 20 TRP HB2 1 93 PRO HD2 4.790 . 4.790 3.126 2.819 3.565 . 0 0 "[ . 1]" 1
318 1 20 TRP HB2 1 93 PRO HG2 4.720 . 4.720 3.600 2.947 4.149 . 0 0 "[ . 1]" 1
319 1 20 TRP HB2 1 93 PRO HG3 5.070 . 5.070 3.480 3.194 3.907 . 0 0 "[ . 1]" 1
320 1 20 TRP HB3 1 20 TRP HE3 4.050 . 4.050 2.478 2.437 2.557 . 0 0 "[ . 1]" 1
321 1 20 TRP HB3 1 21 TYR H 4.150 . 4.150 3.165 3.020 3.333 . 0 0 "[ . 1]" 1
322 1 20 TRP HB3 1 65 ILE H 4.900 . 4.900 4.316 4.082 4.535 . 0 0 "[ . 1]" 1
323 1 20 TRP HB3 1 65 ILE HB 4.200 . 4.200 3.672 3.428 4.025 . 0 0 "[ . 1]" 1
324 1 20 TRP HB3 1 65 ILE MD 4.180 . 4.180 3.733 3.500 4.104 . 0 0 "[ . 1]" 1
325 1 20 TRP HB3 1 93 PRO QB 5.340 . 5.340 4.511 4.170 4.926 . 0 0 "[ . 1]" 1
326 1 20 TRP HB3 1 93 PRO HD2 4.620 . 4.620 3.616 3.494 3.851 . 0 0 "[ . 1]" 1
327 1 20 TRP HB3 1 93 PRO HD3 4.860 . 4.860 4.309 4.156 4.485 . 0 0 "[ . 1]" 1
328 1 20 TRP HB3 1 93 PRO HG2 4.110 . 4.110 2.919 2.479 3.402 . 0 0 "[ . 1]" 1
329 1 20 TRP HB3 1 93 PRO HG3 4.270 . 4.270 3.028 2.868 3.339 . 0 0 "[ . 1]" 1
330 1 20 TRP HD1 1 65 ILE HB 4.230 . 4.230 3.623 3.335 3.788 . 0 0 "[ . 1]" 1
331 1 20 TRP HD1 1 65 ILE MG 4.010 . 4.010 3.787 3.405 3.979 . 0 0 "[ . 1]" 1
332 1 20 TRP HD1 1 92 VAL HA 4.600 . 4.600 4.401 4.182 4.506 . 0 0 "[ . 1]" 1
333 1 20 TRP HD1 1 92 VAL HB 3.850 . 3.850 2.934 2.542 3.201 . 0 0 "[ . 1]" 1
334 1 20 TRP HD1 1 92 VAL MG1 3.240 . 3.240 2.411 2.213 2.513 . 0 0 "[ . 1]" 1
335 1 20 TRP HD1 1 92 VAL MG2 4.160 . 4.160 3.980 3.671 4.188 0.028 3 0 "[ . 1]" 1
336 1 20 TRP HD1 1 93 PRO HD2 4.320 . 4.320 3.181 2.873 3.353 . 0 0 "[ . 1]" 1
337 1 20 TRP HD1 1 93 PRO HD3 4.650 . 4.650 4.545 4.332 4.654 0.004 5 0 "[ . 1]" 1
338 1 20 TRP HD1 1 93 PRO HG2 5.210 . 5.210 4.504 4.081 4.774 . 0 0 "[ . 1]" 1
339 1 20 TRP HE1 1 92 VAL HB 3.510 . 3.510 2.529 2.392 2.673 . 0 0 "[ . 1]" 1
340 1 20 TRP HE1 1 92 VAL MG1 3.190 . 3.190 2.600 2.351 2.833 . 0 0 "[ . 1]" 1
341 1 20 TRP HE1 1 92 VAL MG2 3.320 . 3.320 2.496 2.245 2.695 . 0 0 "[ . 1]" 1
342 1 20 TRP HE1 1 93 PRO HD2 4.580 . 4.580 3.834 3.784 3.871 . 0 0 "[ . 1]" 1
343 1 20 TRP HE1 1 93 PRO HD3 5.500 . 5.500 5.540 5.511 5.563 0.063 7 0 "[ . 1]" 1
344 1 20 TRP HE3 1 21 TYR H 4.570 . 4.570 3.904 3.513 4.227 . 0 0 "[ . 1]" 1
345 1 20 TRP HE3 1 93 PRO HG2 4.570 . 4.570 2.960 2.659 3.522 . 0 0 "[ . 1]" 1
346 1 20 TRP HH2 1 92 VAL MG2 5.500 . 5.500 5.292 4.936 5.474 . 0 0 "[ . 1]" 1
347 1 20 TRP HZ2 1 92 VAL HB 5.150 . 5.150 4.203 3.942 4.416 . 0 0 "[ . 1]" 1
348 1 20 TRP HZ2 1 92 VAL MG2 3.660 . 3.660 3.547 3.208 3.676 0.016 8 0 "[ . 1]" 1
349 1 21 TYR H 1 21 TYR HB2 4.150 . 4.150 3.873 3.813 3.941 . 0 0 "[ . 1]" 1
350 1 21 TYR H 1 21 TYR QD 3.470 . 3.470 2.706 2.375 3.074 . 0 0 "[ . 1]" 1
351 1 21 TYR H 1 22 LYS HB3 5.500 . 5.500 4.996 4.839 5.212 . 0 0 "[ . 1]" 1
352 1 21 TYR HA 1 21 TYR QD 4.020 . 4.020 3.759 3.744 3.771 . 0 0 "[ . 1]" 1
353 1 21 TYR HA 1 22 LYS H 3.060 . 3.060 2.260 2.188 2.311 . 0 0 "[ . 1]" 1
354 1 21 TYR HA 1 62 GLU HG2 4.910 . 4.910 4.102 3.855 4.298 . 0 0 "[ . 1]" 1
355 1 21 TYR HA 1 62 GLU HG3 4.840 . 4.840 4.746 4.503 4.872 0.032 9 0 "[ . 1]" 1
356 1 21 TYR HA 1 63 VAL QG 5.440 . 5.440 4.483 4.351 4.575 . 0 0 "[ . 1]" 1
357 1 21 TYR HA 1 65 ILE MD 5.500 . 5.500 5.393 5.181 5.509 0.009 2 0 "[ . 1]" 1
358 1 21 TYR HB2 1 22 LYS H 3.820 . 3.820 2.588 2.466 2.747 . 0 0 "[ . 1]" 1
359 1 21 TYR HB2 1 62 GLU HG2 4.660 . 4.660 2.768 2.623 3.008 . 0 0 "[ . 1]" 1
360 1 21 TYR HB2 1 62 GLU HG3 4.460 . 4.460 2.937 2.745 3.150 . 0 0 "[ . 1]" 1
361 1 21 TYR HB3 1 22 LYS H 4.120 . 4.120 3.860 3.786 3.964 . 0 0 "[ . 1]" 1
362 1 21 TYR HB3 1 62 GLU HG2 4.240 . 4.240 4.118 3.815 4.262 0.022 2 0 "[ . 1]" 1
363 1 21 TYR HB3 1 62 GLU HG3 5.000 . 5.000 4.586 4.420 4.756 . 0 0 "[ . 1]" 1
364 1 21 TYR QD 1 22 LYS H 4.340 . 4.340 3.403 3.123 3.808 . 0 0 "[ . 1]" 1
365 1 21 TYR QD 1 22 LYS HA 4.800 . 4.800 3.201 2.890 3.684 . 0 0 "[ . 1]" 1
366 1 21 TYR QD 1 62 GLU HG2 4.470 . 4.470 3.977 3.637 4.326 . 0 0 "[ . 1]" 1
367 1 21 TYR QD 1 62 GLU HG3 4.420 . 4.420 2.982 2.566 3.828 . 0 0 "[ . 1]" 1
368 1 22 LYS H 1 22 LYS HB2 4.060 . 4.060 3.945 3.885 3.992 . 0 0 "[ . 1]" 1
369 1 22 LYS H 1 22 LYS HB3 3.740 . 3.740 3.320 3.181 3.423 . 0 0 "[ . 1]" 1
370 1 22 LYS H 1 22 LYS QE 4.880 . 4.880 4.686 4.458 4.935 0.055 8 0 "[ . 1]" 1
371 1 22 LYS H 1 22 LYS HG2 3.840 . 3.840 2.705 2.531 2.860 . 0 0 "[ . 1]" 1
372 1 22 LYS H 1 22 LYS HG3 3.900 . 3.900 3.268 3.055 3.577 . 0 0 "[ . 1]" 1
373 1 22 LYS H 1 23 PRO HD2 4.860 . 4.860 4.738 4.640 4.864 0.004 3 0 "[ . 1]" 1
374 1 22 LYS H 1 24 GLU QB 5.440 . 5.440 5.085 4.978 5.240 . 0 0 "[ . 1]" 1
375 1 22 LYS H 1 62 GLU HG3 4.170 . 4.170 3.400 3.151 3.579 . 0 0 "[ . 1]" 1
376 1 22 LYS H 1 63 VAL HB 5.500 . 5.500 3.560 3.420 3.671 . 0 0 "[ . 1]" 1
377 1 22 LYS HA 1 23 PRO HD2 3.210 . 3.210 2.306 2.180 2.494 . 0 0 "[ . 1]" 1
378 1 22 LYS HA 1 23 PRO HD3 3.130 . 3.130 2.176 2.106 2.312 . 0 0 "[ . 1]" 1
379 1 22 LYS HA 1 23 PRO QG 4.480 . 4.480 3.927 3.857 4.043 . 0 0 "[ . 1]" 1
380 1 22 LYS HA 1 62 GLU HG2 5.500 . 5.500 5.428 5.113 5.530 0.030 5 0 "[ . 1]" 1
381 1 22 LYS HA 1 62 GLU HG3 5.340 . 5.340 4.574 4.333 4.757 . 0 0 "[ . 1]" 1
382 1 22 LYS HB2 1 22 LYS QD 3.590 . 3.590 2.312 2.263 2.360 . 0 0 "[ . 1]" 1
383 1 22 LYS HB2 1 22 LYS QE 4.540 . 4.540 3.925 3.858 4.073 . 0 0 "[ . 1]" 1
384 1 22 LYS HB2 1 23 PRO HD2 3.410 . 3.410 2.295 2.244 2.376 . 0 0 "[ . 1]" 1
385 1 22 LYS HB2 1 23 PRO HD3 3.840 . 3.840 3.635 3.478 3.725 . 0 0 "[ . 1]" 1
386 1 22 LYS HB2 1 23 PRO QG 4.570 . 4.570 4.048 3.925 4.198 . 0 0 "[ . 1]" 1
387 1 22 LYS HB3 1 22 LYS QD 3.560 . 3.560 2.469 2.426 2.515 . 0 0 "[ . 1]" 1
388 1 22 LYS HB3 1 22 LYS QE 4.250 . 4.250 3.973 3.913 4.034 . 0 0 "[ . 1]" 1
389 1 22 LYS HB3 1 23 PRO HD2 3.970 . 3.970 3.630 3.517 3.772 . 0 0 "[ . 1]" 1
390 1 22 LYS HB3 1 23 PRO HD3 4.580 . 4.580 4.463 4.380 4.599 0.019 8 0 "[ . 1]" 1
391 1 22 LYS HB3 1 24 GLU QB 5.500 . 5.500 5.229 5.006 5.538 0.038 8 0 "[ . 1]" 1
392 1 22 LYS HB3 1 63 VAL HB 5.500 . 5.500 4.780 4.625 5.058 . 0 0 "[ . 1]" 1
393 1 22 LYS QE 1 22 LYS HG2 3.660 . 3.660 2.449 2.376 2.485 . 0 0 "[ . 1]" 1
394 1 22 LYS QE 1 22 LYS HG3 3.670 . 3.670 2.358 2.248 2.616 . 0 0 "[ . 1]" 1
395 1 22 LYS QE 1 24 GLU QB 4.290 . 4.290 2.540 2.118 3.094 . 0 0 "[ . 1]" 1
396 1 22 LYS QE 1 63 VAL MG1 4.150 . 4.150 3.103 2.710 3.981 . 0 0 "[ . 1]" 1
397 1 22 LYS QE 1 63 VAL QG 3.080 . 3.080 2.265 1.918 2.911 . 0 0 "[ . 1]" 1
398 1 22 LYS QE 1 63 VAL MG2 4.150 . 4.150 2.330 1.962 2.993 . 0 0 "[ . 1]" 1
399 1 22 LYS HG2 1 23 PRO HD2 4.770 . 4.770 4.850 4.680 4.892 0.122 1 0 "[ . 1]" 1
400 1 22 LYS HG2 1 24 GLU QB 4.500 . 4.500 4.024 3.727 4.148 . 0 0 "[ . 1]" 1
401 1 22 LYS HG2 1 63 VAL HB 4.890 . 4.890 2.468 2.275 2.846 . 0 0 "[ . 1]" 1
402 1 22 LYS HG2 1 63 VAL QG 3.630 . 3.630 3.220 3.145 3.353 . 0 0 "[ . 1]" 1
403 1 22 LYS HG3 1 23 PRO HD2 4.070 . 4.070 3.948 3.554 4.097 0.027 1 0 "[ . 1]" 1
404 1 22 LYS HG3 1 23 PRO HD3 5.030 . 5.030 4.900 4.664 5.008 . 0 0 "[ . 1]" 1
405 1 22 LYS HG3 1 24 GLU QB 4.350 . 4.350 2.665 2.478 2.802 . 0 0 "[ . 1]" 1
406 1 22 LYS HG3 1 63 VAL H 4.540 . 4.540 3.314 2.991 3.880 . 0 0 "[ . 1]" 1
407 1 22 LYS HG3 1 63 VAL HB 4.800 . 4.800 3.135 2.811 3.979 . 0 0 "[ . 1]" 1
408 1 22 LYS HG3 1 63 VAL QG 3.890 . 3.890 2.977 2.740 3.578 . 0 0 "[ . 1]" 1
409 1 23 PRO HA 1 24 GLU H 3.210 . 3.210 2.184 2.155 2.225 . 0 0 "[ . 1]" 1
410 1 23 PRO HA 1 62 GLU HA 3.530 . 3.530 2.470 2.092 2.851 . 0 0 "[ . 1]" 1
411 1 23 PRO HA 1 62 GLU HB3 5.500 . 5.500 4.893 4.712 5.200 . 0 0 "[ . 1]" 1
412 1 23 PRO HA 1 62 GLU HG2 5.500 . 5.500 4.497 4.227 4.721 . 0 0 "[ . 1]" 1
413 1 23 PRO HA 1 62 GLU HG3 5.500 . 5.500 3.146 2.701 3.274 . 0 0 "[ . 1]" 1
414 1 23 PRO HA 1 63 VAL H 5.270 . 5.270 3.925 3.629 4.193 . 0 0 "[ . 1]" 1
415 1 23 PRO QB 1 24 GLU H 3.980 . 3.980 3.445 3.255 3.599 . 0 0 "[ . 1]" 1
416 1 23 PRO HB2 1 24 GLU H 4.630 . 4.630 3.677 3.445 3.860 . 0 0 "[ . 1]" 1
417 1 23 PRO HB3 1 24 GLU H 4.630 . 4.630 4.158 4.006 4.301 . 0 0 "[ . 1]" 1
418 1 23 PRO QG 1 24 GLU H 4.950 . 4.950 4.695 4.597 4.772 . 0 0 "[ . 1]" 1
419 1 23 PRO QG 1 24 GLU HA 4.910 . 4.910 4.762 4.690 4.839 . 0 0 "[ . 1]" 1
420 1 24 GLU H 1 24 GLU QB 3.290 . 3.290 2.668 2.574 2.750 . 0 0 "[ . 1]" 1
421 1 24 GLU H 1 24 GLU QG 4.970 . 4.970 4.125 4.070 4.163 . 0 0 "[ . 1]" 1
422 1 24 GLU H 1 25 ASN H 4.460 . 4.460 4.048 3.935 4.169 . 0 0 "[ . 1]" 1
423 1 24 GLU H 1 61 ASP HA 4.560 . 4.560 3.675 3.476 3.879 . 0 0 "[ . 1]" 1
424 1 24 GLU H 1 62 GLU H 4.940 . 4.940 3.884 3.595 4.147 . 0 0 "[ . 1]" 1
425 1 24 GLU H 1 62 GLU HA 3.200 . 3.200 2.245 2.129 2.365 . 0 0 "[ . 1]" 1
426 1 24 GLU H 1 62 GLU HB2 5.330 . 5.330 4.158 4.031 4.261 . 0 0 "[ . 1]" 1
427 1 24 GLU H 1 62 GLU HB3 5.480 . 5.480 5.035 4.933 5.167 . 0 0 "[ . 1]" 1
428 1 24 GLU H 1 62 GLU HG2 5.300 . 5.300 5.158 5.037 5.331 0.031 8 0 "[ . 1]" 1
429 1 24 GLU H 1 62 GLU HG3 4.710 . 4.710 4.406 4.066 4.711 0.001 2 0 "[ . 1]" 1
430 1 24 GLU H 1 63 VAL H 4.330 . 4.330 3.876 3.732 4.035 . 0 0 "[ . 1]" 1
431 1 24 GLU H 1 63 VAL QG 4.320 . 4.320 3.762 3.524 3.949 . 0 0 "[ . 1]" 1
432 1 24 GLU HA 1 24 GLU HG2 3.630 . 3.630 3.275 3.189 3.718 0.088 8 0 "[ . 1]" 1
433 1 24 GLU HA 1 24 GLU QG 3.080 . 3.080 2.477 2.383 2.847 . 0 0 "[ . 1]" 1
434 1 24 GLU HA 1 24 GLU HG3 3.630 . 3.630 2.565 2.444 2.955 . 0 0 "[ . 1]" 1
435 1 24 GLU HA 1 25 ASN H 2.800 . 2.800 2.152 2.104 2.206 . 0 0 "[ . 1]" 1
436 1 24 GLU HA 1 25 ASN HA 4.830 . 4.830 4.352 4.325 4.380 . 0 0 "[ . 1]" 1
437 1 24 GLU HA 1 25 ASN QB 4.230 . 4.230 4.074 4.003 4.178 . 0 0 "[ . 1]" 1
438 1 24 GLU HA 1 63 VAL QG 4.560 . 4.560 4.496 4.274 4.603 0.043 4 0 "[ . 1]" 1
439 1 24 GLU QB 1 25 ASN H 4.090 . 4.090 3.785 3.743 3.823 . 0 0 "[ . 1]" 1
440 1 24 GLU QB 1 26 ALA H 5.500 . 5.500 4.925 4.663 5.019 . 0 0 "[ . 1]" 1
441 1 24 GLU QB 1 26 ALA MB 4.670 . 4.670 4.216 4.130 4.363 . 0 0 "[ . 1]" 1
442 1 24 GLU QB 1 62 GLU H 5.170 . 5.170 4.455 4.056 4.766 . 0 0 "[ . 1]" 1
443 1 24 GLU QB 1 62 GLU HA 4.010 . 4.010 3.513 3.264 3.625 . 0 0 "[ . 1]" 1
444 1 24 GLU QB 1 62 GLU HG2 5.500 . 5.500 5.586 5.463 5.629 0.129 1 0 "[ . 1]" 1
445 1 24 GLU QB 1 63 VAL H 4.040 . 4.040 3.642 3.322 3.783 . 0 0 "[ . 1]" 1
446 1 24 GLU QB 1 63 VAL QG 2.920 . 2.920 1.947 1.852 2.022 . 0 0 "[ . 1]" 1
447 1 24 GLU QG 1 25 ASN H 3.680 . 3.680 2.928 2.803 3.061 . 0 0 "[ . 1]" 1
448 1 24 GLU QG 1 26 ALA H 4.630 . 4.630 3.964 3.682 4.057 . 0 0 "[ . 1]" 1
449 1 24 GLU QG 1 26 ALA MB 3.210 . 3.210 2.644 2.529 2.761 . 0 0 "[ . 1]" 1
450 1 24 GLU QG 1 63 VAL QG 3.900 . 3.900 3.226 2.366 3.410 . 0 0 "[ . 1]" 1
451 1 24 GLU HG2 1 26 ALA H 5.500 . 5.500 4.219 3.919 5.224 . 0 0 "[ . 1]" 1
452 1 24 GLU HG2 1 26 ALA MB 3.860 . 3.860 2.786 2.588 3.508 . 0 0 "[ . 1]" 1
453 1 24 GLU HG3 1 26 ALA H 5.500 . 5.500 5.302 3.763 5.515 0.015 2 0 "[ . 1]" 1
454 1 24 GLU HG3 1 26 ALA MB 3.860 . 3.860 3.650 2.694 3.861 0.001 1 0 "[ . 1]" 1
455 1 25 ASN H 1 25 ASN QB 3.060 . 3.060 2.402 2.336 2.484 . 0 0 "[ . 1]" 1
456 1 25 ASN H 1 26 ALA H 4.420 . 4.420 4.155 4.093 4.218 . 0 0 "[ . 1]" 1
457 1 25 ASN H 1 26 ALA MB 4.550 . 4.550 4.190 4.067 4.238 . 0 0 "[ . 1]" 1
458 1 25 ASN HA 1 26 ALA H 2.730 . 2.730 2.081 2.035 2.119 . 0 0 "[ . 1]" 1
459 1 25 ASN HA 1 26 ALA MB 4.170 . 4.170 4.052 3.970 4.088 . 0 0 "[ . 1]" 1
460 1 25 ASN HA 1 59 VAL QG 5.340 . 5.340 4.236 4.091 4.302 . 0 0 "[ . 1]" 1
461 1 25 ASN HA 1 60 TYR QD 5.390 . 5.390 4.137 3.868 4.333 . 0 0 "[ . 1]" 1
462 1 25 ASN HA 1 61 ASP H 5.500 . 5.500 4.744 4.530 4.959 . 0 0 "[ . 1]" 1
463 1 25 ASN HA 1 61 ASP HB2 4.750 . 4.750 4.444 4.347 4.569 . 0 0 "[ . 1]" 1
464 1 25 ASN HA 1 61 ASP QB 4.080 . 4.080 3.912 3.834 4.023 . 0 0 "[ . 1]" 1
465 1 25 ASN HA 1 61 ASP HB3 4.750 . 4.750 4.345 4.203 4.472 . 0 0 "[ . 1]" 1
466 1 25 ASN QB 1 26 ALA H 4.100 . 4.100 3.866 3.841 3.895 . 0 0 "[ . 1]" 1
467 1 25 ASN QB 1 26 ALA HA 4.860 . 4.860 4.516 4.374 4.586 . 0 0 "[ . 1]" 1
468 1 25 ASN QB 1 61 ASP QB 4.700 . 4.700 3.895 3.618 4.222 . 0 0 "[ . 1]" 1
469 1 25 ASN QD 1 59 VAL QG 4.040 . 4.040 2.683 1.920 3.700 . 0 0 "[ . 1]" 1
470 1 26 ALA H 1 26 ALA MB 3.350 . 3.350 2.749 2.696 2.804 . 0 0 "[ . 1]" 1
471 1 26 ALA H 1 59 VAL QG 4.340 . 4.340 3.741 3.588 3.892 . 0 0 "[ . 1]" 1
472 1 26 ALA H 1 60 TYR H 4.680 . 4.680 3.067 2.922 3.204 . 0 0 "[ . 1]" 1
473 1 26 ALA H 1 61 ASP H 5.500 . 5.500 5.149 5.040 5.274 . 0 0 "[ . 1]" 1
474 1 26 ALA H 1 61 ASP HA 4.170 . 4.170 3.799 3.715 3.884 . 0 0 "[ . 1]" 1
475 1 26 ALA H 1 61 ASP QB 5.120 . 5.120 5.198 5.161 5.236 0.116 6 0 "[ . 1]" 1
476 1 26 ALA HA 1 27 THR H 3.090 . 3.090 2.352 2.262 2.421 . 0 0 "[ . 1]" 1
477 1 26 ALA HA 1 27 THR HB 4.890 . 4.890 4.473 4.407 4.570 . 0 0 "[ . 1]" 1
478 1 26 ALA MB 1 27 THR H 2.670 . 2.670 2.274 2.221 2.367 . 0 0 "[ . 1]" 1
479 1 26 ALA MB 1 27 THR HA 4.200 . 4.200 4.051 4.006 4.097 . 0 0 "[ . 1]" 1
480 1 26 ALA MB 1 27 THR HB 4.430 . 4.430 4.334 4.270 4.432 0.002 4 0 "[ . 1]" 1
481 1 26 ALA MB 1 60 TYR H 5.370 . 5.370 4.279 4.196 4.433 . 0 0 "[ . 1]" 1
482 1 26 ALA MB 1 105 PHE H 5.500 . 5.500 5.579 5.531 5.643 0.143 8 0 "[ . 1]" 1
483 1 26 ALA MB 1 105 PHE HA 4.650 . 4.650 3.578 3.509 3.700 . 0 0 "[ . 1]" 1
484 1 26 ALA MB 1 105 PHE HB3 4.580 . 4.580 3.167 3.020 3.280 . 0 0 "[ . 1]" 1
485 1 26 ALA MB 1 105 PHE QD 4.340 . 4.340 3.528 3.382 3.623 . 0 0 "[ . 1]" 1
486 1 26 ALA MB 1 106 LYS H 4.190 . 4.190 3.280 3.168 3.538 . 0 0 "[ . 1]" 1
487 1 27 THR H 1 27 THR HB 3.050 . 3.050 2.409 2.362 2.488 . 0 0 "[ . 1]" 1
488 1 27 THR H 1 27 THR MG 3.760 . 3.760 3.731 3.709 3.762 0.002 4 0 "[ . 1]" 1
489 1 27 THR H 1 28 PHE H 4.720 . 4.720 4.268 4.249 4.304 . 0 0 "[ . 1]" 1
490 1 27 THR H 1 106 LYS H 3.940 . 3.940 2.939 2.907 2.996 . 0 0 "[ . 1]" 1
491 1 27 THR H 1 106 LYS HB2 5.300 . 5.300 2.702 2.535 2.841 . 0 0 "[ . 1]" 1
492 1 27 THR H 1 106 LYS HB3 5.300 . 5.300 4.107 3.922 4.241 . 0 0 "[ . 1]" 1
493 1 27 THR H 1 106 LYS QG 4.180 . 4.180 4.208 4.087 4.249 0.069 8 0 "[ . 1]" 1
494 1 27 THR HA 1 27 THR MG 3.020 . 3.020 2.469 2.361 2.513 . 0 0 "[ . 1]" 1
495 1 27 THR HA 1 28 PHE H 2.840 . 2.840 2.067 2.051 2.086 . 0 0 "[ . 1]" 1
496 1 27 THR HA 1 28 PHE HB3 4.660 . 4.660 4.372 4.333 4.419 . 0 0 "[ . 1]" 1
497 1 27 THR HA 1 58 ILE HB 5.250 . 5.250 4.859 4.765 4.962 . 0 0 "[ . 1]" 1
498 1 27 THR HA 1 58 ILE MG 4.220 . 4.220 4.224 4.182 4.248 0.028 7 0 "[ . 1]" 1
499 1 27 THR HA 1 59 VAL HA 3.440 . 3.440 2.275 2.212 2.326 . 0 0 "[ . 1]" 1
500 1 27 THR HA 1 59 VAL QG 4.040 . 4.040 3.198 2.883 3.553 . 0 0 "[ . 1]" 1
501 1 27 THR HA 1 60 TYR H 3.670 . 3.670 3.305 3.121 3.405 . 0 0 "[ . 1]" 1
502 1 27 THR HB 1 28 PHE H 4.580 . 4.580 4.265 4.157 4.290 . 0 0 "[ . 1]" 1
503 1 27 THR HB 1 29 VAL QG 4.770 . 4.770 3.914 3.684 4.082 . 0 0 "[ . 1]" 1
504 1 27 THR HB 1 59 VAL QG 5.440 . 5.440 4.418 3.997 5.054 . 0 0 "[ . 1]" 1
505 1 27 THR HB 1 106 LYS H 4.190 . 4.190 3.285 2.980 3.492 . 0 0 "[ . 1]" 1
506 1 27 THR HB 1 106 LYS HA 5.450 . 5.450 4.726 4.521 4.829 . 0 0 "[ . 1]" 1
507 1 27 THR HB 1 106 LYS HB2 3.760 . 3.760 1.838 1.787 1.891 . 0 0 "[ . 1]" 1
508 1 27 THR HB 1 106 LYS HB3 4.780 . 4.780 3.451 3.316 3.567 . 0 0 "[ . 1]" 1
509 1 27 THR HB 1 106 LYS QD 4.690 . 4.690 2.738 2.302 3.067 . 0 0 "[ . 1]" 1
510 1 27 THR HB 1 106 LYS QG 3.520 . 3.520 3.131 2.640 3.305 . 0 0 "[ . 1]" 1
511 1 27 THR MG 1 28 PHE H 3.140 . 3.140 2.861 2.795 2.915 . 0 0 "[ . 1]" 1
512 1 27 THR MG 1 28 PHE HA 4.180 . 4.180 3.838 3.764 3.892 . 0 0 "[ . 1]" 1
513 1 27 THR MG 1 28 PHE HB3 4.750 . 4.750 4.640 4.570 4.714 . 0 0 "[ . 1]" 1
514 1 27 THR MG 1 29 VAL H 4.430 . 4.430 3.807 3.574 4.083 . 0 0 "[ . 1]" 1
515 1 27 THR MG 1 29 VAL HA 4.130 . 4.130 3.922 3.811 4.110 . 0 0 "[ . 1]" 1
516 1 27 THR MG 1 29 VAL HB 4.750 . 4.750 4.627 4.379 4.779 0.029 8 0 "[ . 1]" 1
517 1 27 THR MG 1 29 VAL QG 2.780 . 2.780 2.291 2.103 2.435 . 0 0 "[ . 1]" 1
518 1 27 THR MG 1 57 THR H 5.500 . 5.500 5.439 5.175 5.574 0.074 7 0 "[ . 1]" 1
519 1 27 THR MG 1 58 ILE H 3.510 . 3.510 3.221 3.029 3.387 . 0 0 "[ . 1]" 1
520 1 27 THR MG 1 58 ILE HA 5.150 . 5.150 4.538 4.299 4.652 . 0 0 "[ . 1]" 1
521 1 27 THR MG 1 58 ILE HB 4.910 . 4.910 4.616 4.457 4.708 . 0 0 "[ . 1]" 1
522 1 27 THR MG 1 58 ILE MG 4.720 . 4.720 4.693 4.510 4.737 0.017 9 0 "[ . 1]" 1
523 1 27 THR MG 1 59 VAL HA 4.350 . 4.350 3.576 3.305 3.691 . 0 0 "[ . 1]" 1
524 1 27 THR MG 1 106 LYS H 4.410 . 4.410 3.821 3.747 3.912 . 0 0 "[ . 1]" 1
525 1 27 THR MG 1 106 LYS HA 5.500 . 5.500 5.547 5.528 5.595 0.095 4 0 "[ . 1]" 1
526 1 27 THR MG 1 106 LYS HB2 4.740 . 4.740 3.299 3.192 3.456 . 0 0 "[ . 1]" 1
527 1 27 THR MG 1 106 LYS HB3 5.100 . 5.100 4.520 4.380 4.612 . 0 0 "[ . 1]" 1
528 1 27 THR MG 1 106 LYS QD 3.730 . 3.730 2.643 2.374 2.877 . 0 0 "[ . 1]" 1
529 1 27 THR MG 1 106 LYS QE 3.720 . 3.720 3.497 3.159 3.724 0.004 1 0 "[ . 1]" 1
530 1 27 THR MG 1 106 LYS QG 3.160 . 3.160 3.197 3.172 3.240 0.080 5 0 "[ . 1]" 1
531 1 28 PHE H 1 28 PHE HB2 3.850 . 3.850 3.020 2.993 3.052 . 0 0 "[ . 1]" 1
532 1 28 PHE H 1 28 PHE HB3 3.600 . 3.600 2.393 2.368 2.418 . 0 0 "[ . 1]" 1
533 1 28 PHE H 1 29 VAL QG 4.670 . 4.670 4.322 4.251 4.386 . 0 0 "[ . 1]" 1
534 1 28 PHE H 1 58 ILE MG 4.070 . 4.070 3.313 3.194 3.393 . 0 0 "[ . 1]" 1
535 1 28 PHE H 1 72 ILE MD 4.720 . 4.720 4.125 3.979 4.206 . 0 0 "[ . 1]" 1
536 1 28 PHE HA 1 29 VAL H 3.090 . 3.090 2.048 2.027 2.079 . 0 0 "[ . 1]" 1
537 1 28 PHE HA 1 29 VAL HB 5.010 . 5.010 4.624 4.552 4.708 . 0 0 "[ . 1]" 1
538 1 28 PHE HA 1 29 VAL MG1 5.500 . 5.500 5.424 5.389 5.452 . 0 0 "[ . 1]" 1
539 1 28 PHE HA 1 29 VAL QG 4.020 . 4.020 3.596 3.481 3.720 . 0 0 "[ . 1]" 1
540 1 28 PHE HA 1 29 VAL MG2 5.500 . 5.500 3.650 3.524 3.789 . 0 0 "[ . 1]" 1
541 1 28 PHE HA 1 72 ILE MD 4.740 . 4.740 4.609 4.544 4.671 . 0 0 "[ . 1]" 1
542 1 28 PHE HA 1 104 VAL QG 5.410 . 5.410 4.198 3.083 4.471 . 0 0 "[ . 1]" 1
543 1 28 PHE HA 1 105 PHE HA 3.580 . 3.580 2.621 2.531 2.705 . 0 0 "[ . 1]" 1
544 1 28 PHE HA 1 106 LYS H 4.640 . 4.640 3.504 3.409 3.606 . 0 0 "[ . 1]" 1
545 1 28 PHE HB2 1 29 VAL H 4.920 . 4.920 4.180 4.101 4.258 . 0 0 "[ . 1]" 1
546 1 28 PHE HB2 1 58 ILE HB 4.310 . 4.310 3.895 3.817 4.093 . 0 0 "[ . 1]" 1
547 1 28 PHE HB2 1 58 ILE MG 4.450 . 4.450 3.965 3.821 4.173 . 0 0 "[ . 1]" 1
548 1 28 PHE HB2 1 60 TYR QE 4.380 . 4.380 2.100 2.000 2.148 . 0 0 "[ . 1]" 1
549 1 28 PHE HB2 1 72 ILE MD 3.400 . 3.400 2.646 2.558 2.690 . 0 0 "[ . 1]" 1
550 1 28 PHE HB2 1 72 ILE MG 4.390 . 4.390 3.085 2.999 3.244 . 0 0 "[ . 1]" 1
551 1 28 PHE HB3 1 29 VAL H 4.560 . 4.560 4.321 4.263 4.366 . 0 0 "[ . 1]" 1
552 1 28 PHE HB3 1 58 ILE H 4.570 . 4.570 3.575 3.488 3.743 . 0 0 "[ . 1]" 1
553 1 28 PHE HB3 1 58 ILE HB 3.940 . 3.940 2.141 2.063 2.337 . 0 0 "[ . 1]" 1
554 1 28 PHE HB3 1 58 ILE HG12 4.990 . 4.990 4.495 4.403 4.706 . 0 0 "[ . 1]" 1
555 1 28 PHE HB3 1 58 ILE MG 3.980 . 3.980 2.831 2.682 2.979 . 0 0 "[ . 1]" 1
556 1 28 PHE HB3 1 60 TYR QE 4.640 . 4.640 3.434 3.302 3.529 . 0 0 "[ . 1]" 1
557 1 28 PHE HB3 1 72 ILE MD 3.400 . 3.400 2.469 2.360 2.590 . 0 0 "[ . 1]" 1
558 1 28 PHE HB3 1 72 ILE MG 4.480 . 4.480 3.924 3.793 4.101 . 0 0 "[ . 1]" 1
559 1 28 PHE HB3 1 86 VAL QG 4.970 . 4.970 4.000 3.757 4.189 . 0 0 "[ . 1]" 1
560 1 28 PHE QD 1 86 VAL QG 4.630 . 4.630 3.023 2.946 3.074 . 0 0 "[ . 1]" 1
561 1 28 PHE QD 1 103 GLY HA3 3.940 . 3.940 3.643 3.453 3.725 . 0 0 "[ . 1]" 1
562 1 28 PHE QD 1 104 VAL QG 5.440 . 5.440 4.672 4.178 4.857 . 0 0 "[ . 1]" 1
563 1 28 PHE HZ 1 30 ASN HA 3.740 . 3.740 2.786 2.655 2.899 . 0 0 "[ . 1]" 1
564 1 28 PHE HZ 1 30 ASN HB2 4.940 . 4.940 3.721 3.615 3.798 . 0 0 "[ . 1]" 1
565 1 28 PHE HZ 1 30 ASN HD21 5.500 . 5.500 5.524 5.516 5.530 0.030 7 0 "[ . 1]" 1
566 1 28 PHE HZ 1 35 ILE MD 3.640 . 3.640 2.190 2.009 3.146 . 0 0 "[ . 1]" 1
567 1 28 PHE HZ 1 52 LEU QD 4.200 . 4.200 4.021 3.872 4.122 . 0 0 "[ . 1]" 1
568 1 28 PHE HZ 1 86 VAL HB 5.080 . 5.080 4.068 3.966 4.161 . 0 0 "[ . 1]" 1
569 1 28 PHE HZ 1 86 VAL QG 3.820 . 3.820 3.007 2.919 3.104 . 0 0 "[ . 1]" 1
570 1 28 PHE HZ 1 102 TRP HB2 5.090 . 5.090 3.059 2.955 3.253 . 0 0 "[ . 1]" 1
571 1 28 PHE HZ 1 102 TRP HB3 4.920 . 4.920 3.842 3.659 4.220 . 0 0 "[ . 1]" 1
572 1 28 PHE HZ 1 103 GLY HA3 4.340 . 4.340 3.139 2.918 3.285 . 0 0 "[ . 1]" 1
573 1 29 VAL H 1 29 VAL HB 3.410 . 3.410 2.613 2.532 2.683 . 0 0 "[ . 1]" 1
574 1 29 VAL H 1 29 VAL MG1 3.860 . 3.860 3.832 3.790 3.870 0.010 9 0 "[ . 1]" 1
575 1 29 VAL H 1 29 VAL QG 3.080 . 3.080 2.423 2.245 2.637 . 0 0 "[ . 1]" 1
576 1 29 VAL H 1 29 VAL MG2 3.860 . 3.860 2.451 2.260 2.689 . 0 0 "[ . 1]" 1
577 1 29 VAL H 1 104 VAL H 3.720 . 3.720 2.739 2.667 2.868 . 0 0 "[ . 1]" 1
578 1 29 VAL H 1 104 VAL HB 4.660 . 4.660 3.149 2.721 4.692 0.032 4 0 "[ . 1]" 1
579 1 29 VAL H 1 104 VAL MG1 4.590 . 4.590 4.061 3.429 4.246 . 0 0 "[ . 1]" 1
580 1 29 VAL H 1 104 VAL QG 3.620 . 3.620 3.123 1.849 3.510 . 0 0 "[ . 1]" 1
581 1 29 VAL H 1 104 VAL MG2 4.590 . 4.590 3.283 1.857 3.753 . 0 0 "[ . 1]" 1
582 1 29 VAL H 1 105 PHE HA 4.380 . 4.380 3.795 3.693 3.940 . 0 0 "[ . 1]" 1
583 1 29 VAL H 1 106 LYS QG 5.440 . 5.440 4.160 3.985 4.323 . 0 0 "[ . 1]" 1
584 1 29 VAL HA 1 29 VAL MG1 2.950 . 2.950 2.384 2.348 2.478 . 0 0 "[ . 1]" 1
585 1 29 VAL HA 1 29 VAL MG2 2.950 . 2.950 2.476 2.392 2.546 . 0 0 "[ . 1]" 1
586 1 29 VAL HA 1 30 ASN H 2.800 . 2.800 2.112 2.069 2.137 . 0 0 "[ . 1]" 1
587 1 29 VAL HA 1 30 ASN HA 4.700 . 4.700 4.367 4.319 4.379 . 0 0 "[ . 1]" 1
588 1 29 VAL HA 1 30 ASN HB2 4.620 . 4.620 4.593 4.477 4.637 0.017 1 0 "[ . 1]" 1
589 1 29 VAL HA 1 30 ASN HB3 5.480 . 5.480 4.692 4.583 4.734 . 0 0 "[ . 1]" 1
590 1 29 VAL HA 1 52 LEU QD 4.890 . 4.890 4.745 4.559 4.887 . 0 0 "[ . 1]" 1
591 1 29 VAL HA 1 57 THR HA 3.090 . 3.090 2.412 2.269 2.555 . 0 0 "[ . 1]" 1
592 1 29 VAL HA 1 57 THR MG 3.700 . 3.700 3.194 2.634 3.467 . 0 0 "[ . 1]" 1
593 1 29 VAL HA 1 58 ILE H 3.800 . 3.800 3.270 3.184 3.373 . 0 0 "[ . 1]" 1
594 1 29 VAL HA 1 106 LYS QE 5.500 . 5.500 5.342 5.186 5.505 0.005 6 0 "[ . 1]" 1
595 1 29 VAL HB 1 30 ASN H 4.620 . 4.620 4.252 4.198 4.349 . 0 0 "[ . 1]" 1
596 1 29 VAL HB 1 57 THR MG 5.350 . 5.350 4.487 4.076 4.812 . 0 0 "[ . 1]" 1
597 1 29 VAL HB 1 104 VAL H 3.620 . 3.620 2.862 2.636 3.190 . 0 0 "[ . 1]" 1
598 1 29 VAL HB 1 104 VAL HB 3.860 . 3.860 2.717 2.264 3.926 0.066 4 0 "[ . 1]" 1
599 1 29 VAL HB 1 104 VAL MG1 3.930 . 3.930 3.470 1.994 3.919 . 0 0 "[ . 1]" 1
600 1 29 VAL HB 1 104 VAL QG 2.820 . 2.820 2.049 1.719 2.313 . 0 0 "[ . 1]" 1
601 1 29 VAL HB 1 104 VAL MG2 3.930 . 3.930 2.087 1.845 2.330 . 0 0 "[ . 1]" 1
602 1 29 VAL HB 1 106 LYS QE 4.950 . 4.950 3.849 3.604 4.055 . 0 0 "[ . 1]" 1
603 1 29 VAL QG 1 30 ASN H 3.140 . 3.140 3.005 2.872 3.069 . 0 0 "[ . 1]" 1
604 1 29 VAL QG 1 30 ASN HA 4.590 . 4.590 4.220 4.128 4.311 . 0 0 "[ . 1]" 1
605 1 29 VAL QG 1 30 ASN HB3 4.610 . 4.610 4.418 4.290 4.487 . 0 0 "[ . 1]" 1
606 1 29 VAL QG 1 55 GLY H 4.640 . 4.640 4.291 4.173 4.406 . 0 0 "[ . 1]" 1
607 1 29 VAL QG 1 55 GLY QA 3.580 . 3.580 2.974 2.858 3.125 . 0 0 "[ . 1]" 1
608 1 29 VAL QG 1 56 ALA H 4.950 . 4.950 4.414 4.066 4.670 . 0 0 "[ . 1]" 1
609 1 29 VAL QG 1 57 THR HA 3.260 . 3.260 2.810 2.638 3.033 . 0 0 "[ . 1]" 1
610 1 29 VAL QG 1 57 THR HB 4.520 . 4.520 3.889 3.439 4.480 . 0 0 "[ . 1]" 1
611 1 29 VAL QG 1 57 THR MG 2.640 . 2.640 1.921 1.774 2.110 . 0 0 "[ . 1]" 1
612 1 29 VAL QG 1 58 ILE H 4.060 . 4.060 3.851 3.749 4.063 0.003 1 0 "[ . 1]" 1
613 1 29 VAL QG 1 104 VAL H 3.850 . 3.850 3.574 3.439 3.781 . 0 0 "[ . 1]" 1
614 1 29 VAL QG 1 104 VAL HB 4.080 . 4.080 2.939 2.332 4.157 0.077 2 0 "[ . 1]" 1
615 1 29 VAL QG 1 104 VAL QG 2.780 . 2.780 2.485 1.931 2.804 0.024 7 0 "[ . 1]" 1
616 1 29 VAL QG 1 105 PHE HA 5.220 . 5.220 4.573 4.344 4.828 . 0 0 "[ . 1]" 1
617 1 29 VAL QG 1 106 LYS H 4.870 . 4.870 3.919 3.723 4.197 . 0 0 "[ . 1]" 1
618 1 29 VAL QG 1 106 LYS HB2 4.890 . 4.890 4.216 4.070 4.473 . 0 0 "[ . 1]" 1
619 1 29 VAL QG 1 106 LYS QD 4.180 . 4.180 3.073 2.822 3.310 . 0 0 "[ . 1]" 1
620 1 29 VAL QG 1 106 LYS QE 3.390 . 3.390 1.936 1.840 2.028 . 0 0 "[ . 1]" 1
621 1 29 VAL QG 1 106 LYS QG 3.210 . 3.210 2.653 2.459 2.889 . 0 0 "[ . 1]" 1
622 1 29 VAL MG1 1 30 ASN H 4.280 . 4.280 3.078 2.927 3.156 . 0 0 "[ . 1]" 1
623 1 29 VAL MG1 1 57 THR HA 4.050 . 4.050 3.410 3.274 3.654 . 0 0 "[ . 1]" 1
624 1 29 VAL MG1 1 57 THR MG 3.210 . 3.210 2.748 2.155 3.251 0.041 4 0 "[ . 1]" 1
625 1 29 VAL MG1 1 58 ILE H 5.500 . 5.500 4.898 4.791 5.052 . 0 0 "[ . 1]" 1
626 1 29 VAL MG1 1 104 VAL H 4.380 . 4.380 3.968 3.774 4.173 . 0 0 "[ . 1]" 1
627 1 29 VAL MG1 1 104 VAL HB 4.860 . 4.860 4.183 3.844 4.935 0.075 2 0 "[ . 1]" 1
628 1 29 VAL MG1 1 106 LYS QE 4.880 . 4.880 3.751 3.676 3.865 . 0 0 "[ . 1]" 1
629 1 29 VAL MG2 1 30 ASN H 4.280 . 4.280 4.210 4.096 4.295 0.015 1 0 "[ . 1]" 1
630 1 29 VAL MG2 1 57 THR HA 4.050 . 4.050 3.008 2.706 3.354 . 0 0 "[ . 1]" 1
631 1 29 VAL MG2 1 57 THR MG 3.210 . 3.210 1.979 1.888 2.138 . 0 0 "[ . 1]" 1
632 1 29 VAL MG2 1 58 ILE H 5.500 . 5.500 4.032 3.896 4.307 . 0 0 "[ . 1]" 1
633 1 29 VAL MG2 1 104 VAL H 4.380 . 4.380 4.077 3.768 4.325 . 0 0 "[ . 1]" 1
634 1 29 VAL MG2 1 104 VAL HB 4.860 . 4.860 3.035 2.349 4.474 . 0 0 "[ . 1]" 1
635 1 29 VAL MG2 1 106 LYS QE 4.880 . 4.880 1.942 1.845 2.036 . 0 0 "[ . 1]" 1
636 1 30 ASN H 1 30 ASN HB2 3.210 . 3.210 2.593 2.500 2.635 . 0 0 "[ . 1]" 1
637 1 30 ASN H 1 30 ASN HB3 3.360 . 3.360 2.623 2.578 2.653 . 0 0 "[ . 1]" 1
638 1 30 ASN H 1 30 ASN HD21 5.010 . 5.010 4.739 4.712 4.758 . 0 0 "[ . 1]" 1
639 1 30 ASN H 1 52 LEU MD1 5.360 . 5.360 5.054 4.866 5.169 . 0 0 "[ . 1]" 1
640 1 30 ASN H 1 52 LEU QD 3.850 . 3.850 3.513 3.371 3.606 . 0 0 "[ . 1]" 1
641 1 30 ASN H 1 52 LEU MD2 5.360 . 5.360 3.583 3.438 3.685 . 0 0 "[ . 1]" 1
642 1 30 ASN H 1 55 GLY QA 5.040 . 5.040 4.065 3.833 4.168 . 0 0 "[ . 1]" 1
643 1 30 ASN H 1 56 ALA H 4.290 . 4.290 3.512 3.197 3.704 . 0 0 "[ . 1]" 1
644 1 30 ASN H 1 56 ALA MB 4.120 . 4.120 3.761 3.538 3.916 . 0 0 "[ . 1]" 1
645 1 30 ASN H 1 57 THR HA 4.280 . 4.280 3.613 3.333 3.851 . 0 0 "[ . 1]" 1
646 1 30 ASN H 1 57 THR MG 4.940 . 4.940 4.608 4.060 4.965 0.025 9 0 "[ . 1]" 1
647 1 30 ASN H 1 58 ILE HG12 5.460 . 5.460 4.692 4.604 4.889 . 0 0 "[ . 1]" 1
648 1 30 ASN H 1 58 ILE HG13 5.500 . 5.500 5.452 5.338 5.514 0.014 5 0 "[ . 1]" 1
649 1 30 ASN H 1 104 VAL QG 5.160 . 5.160 4.967 4.478 5.174 0.014 9 0 "[ . 1]" 1
650 1 30 ASN HA 1 30 ASN HD21 4.430 . 4.430 4.455 4.447 4.464 0.034 6 0 "[ . 1]" 1
651 1 30 ASN HA 1 31 GLY H 2.990 . 2.990 2.227 2.169 2.285 . 0 0 "[ . 1]" 1
652 1 30 ASN HA 1 35 ILE MD 4.350 . 4.350 3.678 3.539 4.410 0.060 2 0 "[ . 1]" 1
653 1 30 ASN HA 1 52 LEU QD 4.240 . 4.240 3.941 3.861 3.970 . 0 0 "[ . 1]" 1
654 1 30 ASN HA 1 103 GLY HA2 4.160 . 4.160 3.420 3.191 3.623 . 0 0 "[ . 1]" 1
655 1 30 ASN HA 1 103 GLY HA3 3.640 . 3.640 2.516 2.392 2.672 . 0 0 "[ . 1]" 1
656 1 30 ASN HA 1 104 VAL H 4.650 . 4.650 3.889 3.614 4.177 . 0 0 "[ . 1]" 1
657 1 30 ASN HB2 1 31 GLY H 4.390 . 4.390 4.005 3.950 4.068 . 0 0 "[ . 1]" 1
658 1 30 ASN HB2 1 35 ILE MD 4.910 . 4.910 3.676 3.451 4.591 . 0 0 "[ . 1]" 1
659 1 30 ASN HB2 1 52 LEU MD1 4.150 . 4.150 4.178 4.157 4.188 0.038 1 0 "[ . 1]" 1
660 1 30 ASN HB2 1 52 LEU QD 3.230 . 3.230 2.021 2.000 2.043 . 0 0 "[ . 1]" 1
661 1 30 ASN HB2 1 52 LEU MD2 4.150 . 4.150 2.026 2.004 2.048 . 0 0 "[ . 1]" 1
662 1 30 ASN HB2 1 52 LEU HG 4.330 . 4.330 3.669 3.409 3.760 . 0 0 "[ . 1]" 1
663 1 30 ASN HB2 1 54 ALA HA 4.310 . 4.310 4.291 4.216 4.351 0.041 9 0 "[ . 1]" 1
664 1 30 ASN HB2 1 55 GLY H 4.160 . 4.160 3.971 3.588 4.169 0.009 9 0 "[ . 1]" 1
665 1 30 ASN HB2 1 55 GLY QA 5.170 . 5.170 5.109 4.757 5.201 0.031 5 0 "[ . 1]" 1
666 1 30 ASN HB2 1 56 ALA H 3.750 . 3.750 3.639 3.361 3.767 0.017 8 0 "[ . 1]" 1
667 1 30 ASN HB2 1 56 ALA MB 3.830 . 3.830 3.442 3.073 3.667 . 0 0 "[ . 1]" 1
668 1 30 ASN HB3 1 30 ASN HD22 3.920 . 3.920 3.423 3.392 3.475 . 0 0 "[ . 1]" 1
669 1 30 ASN HB3 1 31 GLY H 4.620 . 4.620 3.851 3.775 3.943 . 0 0 "[ . 1]" 1
670 1 30 ASN HB3 1 35 ILE HG12 5.500 . 5.500 5.554 4.962 5.635 0.135 7 0 "[ . 1]" 1
671 1 30 ASN HB3 1 52 LEU QD 3.630 . 3.630 2.954 2.901 3.064 . 0 0 "[ . 1]" 1
672 1 30 ASN HB3 1 52 LEU HG 5.020 . 5.020 3.855 3.631 3.993 . 0 0 "[ . 1]" 1
673 1 30 ASN HB3 1 54 ALA HA 3.930 . 3.930 2.948 2.859 3.041 . 0 0 "[ . 1]" 1
674 1 30 ASN HB3 1 55 GLY H 3.700 . 3.700 2.282 1.877 2.479 . 0 0 "[ . 1]" 1
675 1 30 ASN HB3 1 55 GLY QA 4.370 . 4.370 3.676 3.300 3.786 . 0 0 "[ . 1]" 1
676 1 30 ASN HB3 1 56 ALA H 3.220 . 3.220 2.227 2.033 2.354 . 0 0 "[ . 1]" 1
677 1 30 ASN HB3 1 56 ALA MB 4.320 . 4.320 3.148 2.972 3.284 . 0 0 "[ . 1]" 1
678 1 30 ASN HD21 1 35 ILE H 4.680 . 4.680 3.590 3.450 3.737 . 0 0 "[ . 1]" 1
679 1 30 ASN HD21 1 35 ILE MD 4.890 . 4.890 4.198 4.084 4.470 . 0 0 "[ . 1]" 1
680 1 30 ASN HD21 1 52 LEU HB3 4.730 . 4.730 3.763 3.709 3.852 . 0 0 "[ . 1]" 1
681 1 30 ASN HD21 1 52 LEU MD1 4.920 . 4.920 4.501 4.424 4.607 . 0 0 "[ . 1]" 1
682 1 30 ASN HD21 1 52 LEU QD 3.590 . 3.590 2.699 2.570 2.998 . 0 0 "[ . 1]" 1
683 1 30 ASN HD21 1 52 LEU MD2 4.920 . 4.920 2.721 2.587 3.041 . 0 0 "[ . 1]" 1
684 1 30 ASN HD21 1 52 LEU HG 4.570 . 4.570 3.045 2.972 3.173 . 0 0 "[ . 1]" 1
685 1 30 ASN HD21 1 54 ALA HA 3.420 . 3.420 2.132 2.050 2.193 . 0 0 "[ . 1]" 1
686 1 30 ASN HD21 1 54 ALA MB 4.290 . 4.290 3.723 3.650 3.790 . 0 0 "[ . 1]" 1
687 1 30 ASN HD21 1 55 GLY H 4.140 . 4.140 3.272 2.854 3.464 . 0 0 "[ . 1]" 1
688 1 30 ASN HD21 1 56 ALA H 4.280 . 4.280 3.315 3.088 3.473 . 0 0 "[ . 1]" 1
689 1 30 ASN HD21 1 56 ALA MB 4.500 . 4.500 3.573 3.351 3.736 . 0 0 "[ . 1]" 1
690 1 30 ASN HD22 1 34 PRO HA 4.300 . 4.300 2.247 2.157 2.307 . 0 0 "[ . 1]" 1
691 1 30 ASN HD22 1 34 PRO HB2 4.900 . 4.900 4.885 4.771 4.945 0.045 6 0 "[ . 1]" 1
692 1 30 ASN HD22 1 34 PRO HB3 4.650 . 4.650 4.483 4.416 4.553 . 0 0 "[ . 1]" 1
693 1 30 ASN HD22 1 35 ILE H 4.140 . 4.140 3.095 3.030 3.186 . 0 0 "[ . 1]" 1
694 1 30 ASN HD22 1 35 ILE HB 4.690 . 4.690 4.484 4.259 4.598 . 0 0 "[ . 1]" 1
695 1 30 ASN HD22 1 35 ILE MD 3.810 . 3.810 3.433 3.308 3.514 . 0 0 "[ . 1]" 1
696 1 30 ASN HD22 1 35 ILE HG12 4.240 . 4.240 2.761 2.185 2.851 . 0 0 "[ . 1]" 1
697 1 30 ASN HD22 1 35 ILE HG13 3.780 . 3.780 2.479 2.352 3.224 . 0 0 "[ . 1]" 1
698 1 30 ASN HD22 1 52 LEU QD 3.760 . 3.760 3.465 3.345 3.726 . 0 0 "[ . 1]" 1
699 1 30 ASN HD22 1 52 LEU HG 4.760 . 4.760 4.456 4.353 4.571 . 0 0 "[ . 1]" 1
700 1 30 ASN HD22 1 54 ALA HA 3.690 . 3.690 2.527 2.410 2.612 . 0 0 "[ . 1]" 1
701 1 30 ASN HD22 1 54 ALA MB 4.260 . 4.260 3.444 3.346 3.584 . 0 0 "[ . 1]" 1
702 1 31 GLY H 1 32 ASN H 4.300 . 4.300 3.745 3.407 4.078 . 0 0 "[ . 1]" 1
703 1 31 GLY H 1 35 ILE MD 4.300 . 4.300 3.696 3.617 3.993 . 0 0 "[ . 1]" 1
704 1 31 GLY H 1 35 ILE HG12 5.350 . 5.350 5.134 4.956 5.285 . 0 0 "[ . 1]" 1
705 1 31 GLY H 1 52 LEU QD 5.440 . 5.440 5.063 4.996 5.134 . 0 0 "[ . 1]" 1
706 1 31 GLY H 1 54 ALA MB 5.500 . 5.500 4.900 4.716 5.114 . 0 0 "[ . 1]" 1
707 1 31 GLY H 1 103 GLY HA2 3.710 . 3.710 2.988 2.721 3.243 . 0 0 "[ . 1]" 1
708 1 31 GLY HA2 1 32 ASN H 3.520 . 3.520 3.171 2.962 3.350 . 0 0 "[ . 1]" 1
709 1 31 GLY HA2 1 32 ASN HA 4.630 . 4.630 4.329 4.285 4.399 . 0 0 "[ . 1]" 1
710 1 31 GLY HA2 1 32 ASN QB 4.980 . 4.980 4.671 4.420 5.012 0.032 6 0 "[ . 1]" 1
711 1 31 GLY HA2 1 33 GLN H 5.110 . 5.110 4.682 4.359 4.978 . 0 0 "[ . 1]" 1
712 1 31 GLY HA2 1 103 GLY HA2 4.550 . 4.550 3.485 3.324 3.857 . 0 0 "[ . 1]" 1
713 1 31 GLY HA3 1 32 ASN H 3.160 . 3.160 2.098 2.058 2.164 . 0 0 "[ . 1]" 1
714 1 31 GLY HA3 1 32 ASN HA 4.610 . 4.610 4.342 4.299 4.440 . 0 0 "[ . 1]" 1
715 1 31 GLY HA3 1 32 ASN QB 4.260 . 4.260 4.097 3.796 4.289 0.029 1 0 "[ . 1]" 1
716 1 31 GLY HA3 1 33 GLN H 3.850 . 3.850 3.633 3.293 3.870 0.020 5 0 "[ . 1]" 1
717 1 31 GLY HA3 1 54 ALA MB 5.500 . 5.500 4.973 4.888 5.066 . 0 0 "[ . 1]" 1
718 1 31 GLY HA3 1 103 GLY HA2 3.990 . 3.990 3.179 2.960 3.727 . 0 0 "[ . 1]" 1
719 1 32 ASN H 1 32 ASN QB 3.070 . 3.070 2.347 2.236 2.474 . 0 0 "[ . 1]" 1
720 1 32 ASN H 1 33 GLN H 3.480 . 3.480 2.388 2.127 2.593 . 0 0 "[ . 1]" 1
721 1 32 ASN H 1 54 ALA MB 4.500 . 4.500 4.219 4.034 4.376 . 0 0 "[ . 1]" 1
722 1 32 ASN HA 1 32 ASN QB 2.750 . 2.750 2.365 2.290 2.424 . 0 0 "[ . 1]" 1
723 1 32 ASN HA 1 33 GLN H 3.420 . 3.420 3.313 2.990 3.456 0.036 8 0 "[ . 1]" 1
724 1 32 ASN HA 1 54 ALA HA 4.800 . 4.800 4.739 4.593 4.829 0.029 8 0 "[ . 1]" 1
725 1 32 ASN HA 1 54 ALA MB 2.850 . 2.850 2.562 2.401 2.727 . 0 0 "[ . 1]" 1
726 1 32 ASN HA 1 55 GLY H 5.330 . 5.330 4.807 4.469 5.222 . 0 0 "[ . 1]" 1
727 1 32 ASN QB 1 33 GLN H 3.770 . 3.770 3.263 2.965 3.541 . 0 0 "[ . 1]" 1
728 1 32 ASN QB 1 33 GLN HA 4.490 . 4.490 4.308 4.009 4.496 0.006 3 0 "[ . 1]" 1
729 1 32 ASN QB 1 33 GLN QG 4.200 . 4.200 3.792 3.427 4.074 . 0 0 "[ . 1]" 1
730 1 32 ASN QB 1 54 ALA MB 4.370 . 4.370 4.145 3.965 4.299 . 0 0 "[ . 1]" 1
731 1 32 ASN QD 1 33 GLN H 4.830 . 4.830 4.313 3.605 5.010 0.180 1 0 "[ . 1]" 1
732 1 33 GLN H 1 33 GLN HB2 3.700 . 3.700 3.688 3.613 3.744 0.044 2 0 "[ . 1]" 1
733 1 33 GLN H 1 33 GLN HB3 3.470 . 3.470 3.206 3.100 3.389 . 0 0 "[ . 1]" 1
734 1 33 GLN H 1 33 GLN HE21 4.550 . 4.550 4.533 4.207 4.647 0.097 1 0 "[ . 1]" 1
735 1 33 GLN H 1 33 GLN QG 3.470 . 3.470 2.119 1.948 2.304 . 0 0 "[ . 1]" 1
736 1 33 GLN H 1 34 PRO HD2 5.110 . 5.110 4.810 4.766 4.850 . 0 0 "[ . 1]" 1
737 1 33 GLN H 1 34 PRO HD3 5.050 . 5.050 4.756 4.577 4.868 . 0 0 "[ . 1]" 1
738 1 33 GLN H 1 54 ALA MB 3.410 . 3.410 3.251 2.849 3.462 0.052 8 0 "[ . 1]" 1
739 1 33 GLN HA 1 33 GLN QG 3.390 . 3.390 3.321 3.293 3.367 . 0 0 "[ . 1]" 1
740 1 33 GLN HA 1 34 PRO HD2 2.810 . 2.810 2.135 2.106 2.164 . 0 0 "[ . 1]" 1
741 1 33 GLN HA 1 34 PRO HD3 2.810 . 2.810 2.337 2.282 2.393 . 0 0 "[ . 1]" 1
742 1 33 GLN HA 1 54 ALA MB 3.660 . 3.660 3.023 2.945 3.112 . 0 0 "[ . 1]" 1
743 1 33 GLN HB2 1 34 PRO HD2 3.560 . 3.560 2.700 2.552 2.825 . 0 0 "[ . 1]" 1
744 1 33 GLN HB2 1 34 PRO HD3 3.980 . 3.980 4.013 3.935 4.048 0.068 1 0 "[ . 1]" 1
745 1 33 GLN HB2 1 35 ILE MD 5.500 . 5.500 5.235 4.274 5.524 0.024 9 0 "[ . 1]" 1
746 1 33 GLN HB2 1 54 ALA MB 4.780 . 4.780 4.753 4.683 4.819 0.039 5 0 "[ . 1]" 1
747 1 33 GLN HB3 1 34 PRO HD2 3.520 . 3.520 3.536 3.502 3.551 0.031 9 0 "[ . 1]" 1
748 1 33 GLN HB3 1 54 ALA MB 5.000 . 5.000 4.851 4.740 4.921 . 0 0 "[ . 1]" 1
749 1 33 GLN HE21 1 35 ILE MD 4.920 . 4.920 3.717 3.080 4.924 0.004 5 0 "[ . 1]" 1
750 1 33 GLN QG 1 34 PRO HD2 4.740 . 4.740 4.368 4.259 4.478 . 0 0 "[ . 1]" 1
751 1 33 GLN QG 1 35 ILE MD 4.320 . 4.320 3.433 2.624 3.652 . 0 0 "[ . 1]" 1
752 1 33 GLN QG 1 35 ILE HG12 4.340 . 4.340 3.154 2.932 3.820 . 0 0 "[ . 1]" 1
753 1 33 GLN QG 1 54 ALA MB 5.490 . 5.490 4.367 4.175 4.517 . 0 0 "[ . 1]" 1
754 1 33 GLN QG 1 102 TRP HB3 5.290 . 5.290 3.021 2.694 3.281 . 0 0 "[ . 1]" 1
755 1 34 PRO HA 1 35 ILE H 3.010 . 3.010 2.252 2.199 2.341 . 0 0 "[ . 1]" 1
756 1 34 PRO HA 1 35 ILE HB 4.910 . 4.910 4.864 4.481 4.921 0.011 4 0 "[ . 1]" 1
757 1 34 PRO HA 1 35 ILE HG12 4.750 . 4.750 3.695 3.006 3.838 . 0 0 "[ . 1]" 1
758 1 34 PRO HA 1 35 ILE HG13 4.490 . 4.490 3.692 3.495 4.543 0.053 2 0 "[ . 1]" 1
759 1 34 PRO HA 1 51 ASN QB 5.320 . 5.320 4.583 4.277 5.048 . 0 0 "[ . 1]" 1
760 1 34 PRO HA 1 53 PRO HA 3.750 . 3.750 3.576 3.454 3.761 0.011 3 0 "[ . 1]" 1
761 1 34 PRO HA 1 54 ALA H 4.210 . 4.210 3.360 3.203 3.479 . 0 0 "[ . 1]" 1
762 1 34 PRO HA 1 54 ALA HA 4.130 . 4.130 3.291 3.117 3.433 . 0 0 "[ . 1]" 1
763 1 34 PRO HB2 1 35 ILE H 3.760 . 3.760 3.125 2.945 3.217 . 0 0 "[ . 1]" 1
764 1 34 PRO HB2 1 35 ILE HA 4.590 . 4.590 4.430 4.312 4.553 . 0 0 "[ . 1]" 1
765 1 34 PRO HB2 1 35 ILE HG12 5.380 . 5.380 5.340 4.862 5.423 0.043 8 0 "[ . 1]" 1
766 1 34 PRO HB2 1 51 ASN QB 3.710 . 3.710 2.630 2.305 3.064 . 0 0 "[ . 1]" 1
767 1 34 PRO HB2 1 52 LEU H 4.890 . 4.890 4.511 4.420 4.728 . 0 0 "[ . 1]" 1
768 1 34 PRO HB2 1 53 PRO HA 4.010 . 4.010 4.008 3.876 4.039 0.029 3 0 "[ . 1]" 1
769 1 34 PRO HB2 1 54 ALA H 5.130 . 5.130 4.669 4.383 4.880 . 0 0 "[ . 1]" 1
770 1 34 PRO HB2 1 54 ALA MB 5.210 . 5.210 4.771 4.493 4.938 . 0 0 "[ . 1]" 1
771 1 34 PRO HB3 1 35 ILE H 3.790 . 3.790 3.756 3.613 3.811 0.021 3 0 "[ . 1]" 1
772 1 34 PRO HB3 1 53 PRO HA 3.470 . 3.470 2.748 2.478 2.981 . 0 0 "[ . 1]" 1
773 1 34 PRO HB3 1 54 ALA H 3.950 . 3.950 3.000 2.777 3.203 . 0 0 "[ . 1]" 1
774 1 34 PRO HB3 1 54 ALA MB 5.500 . 5.500 3.527 3.195 3.747 . 0 0 "[ . 1]" 1
775 1 34 PRO HD2 1 54 ALA H 5.500 . 5.500 5.527 5.511 5.568 0.068 3 0 "[ . 1]" 1
776 1 34 PRO HD2 1 54 ALA MB 3.810 . 3.810 3.813 3.729 3.869 0.059 1 0 "[ . 1]" 1
777 1 34 PRO HD3 1 54 ALA H 4.650 . 4.650 4.002 3.952 4.099 . 0 0 "[ . 1]" 1
778 1 34 PRO HD3 1 54 ALA HA 4.990 . 4.990 4.771 4.652 4.866 . 0 0 "[ . 1]" 1
779 1 34 PRO HD3 1 54 ALA MB 3.670 . 3.670 2.538 2.411 2.623 . 0 0 "[ . 1]" 1
780 1 34 PRO QG 1 51 ASN QB 4.670 . 4.670 4.050 3.812 4.322 . 0 0 "[ . 1]" 1
781 1 34 PRO QG 1 54 ALA H 4.440 . 4.440 4.396 4.211 4.459 0.019 6 0 "[ . 1]" 1
782 1 34 PRO QG 1 54 ALA MB 4.320 . 4.320 3.916 3.775 4.028 . 0 0 "[ . 1]" 1
783 1 35 ILE H 1 35 ILE HB 3.630 . 3.630 2.876 2.597 2.942 . 0 0 "[ . 1]" 1
784 1 35 ILE H 1 35 ILE MD 4.570 . 4.570 4.082 3.755 4.243 . 0 0 "[ . 1]" 1
785 1 35 ILE H 1 35 ILE HG12 3.510 . 3.510 3.077 2.398 3.310 . 0 0 "[ . 1]" 1
786 1 35 ILE H 1 35 ILE HG13 3.630 . 3.630 2.717 2.494 3.636 0.006 2 0 "[ . 1]" 1
787 1 35 ILE H 1 35 ILE MG 3.990 . 3.990 3.909 3.809 3.946 . 0 0 "[ . 1]" 1
788 1 35 ILE H 1 36 VAL H 4.590 . 4.590 4.417 4.366 4.456 . 0 0 "[ . 1]" 1
789 1 35 ILE H 1 37 THR MG 4.960 . 4.960 4.489 4.421 4.656 . 0 0 "[ . 1]" 1
790 1 35 ILE H 1 51 ASN QB 4.440 . 4.440 3.828 3.669 4.251 . 0 0 "[ . 1]" 1
791 1 35 ILE H 1 52 LEU H 3.590 . 3.590 3.004 2.900 3.288 . 0 0 "[ . 1]" 1
792 1 35 ILE H 1 52 LEU HB2 4.510 . 4.510 4.111 3.970 4.159 . 0 0 "[ . 1]" 1
793 1 35 ILE H 1 52 LEU HB3 3.570 . 3.570 2.509 2.376 2.599 . 0 0 "[ . 1]" 1
794 1 35 ILE H 1 52 LEU QD 4.700 . 4.700 3.587 3.493 3.725 . 0 0 "[ . 1]" 1
795 1 35 ILE HA 1 35 ILE MD 3.720 . 3.720 3.621 2.338 3.776 0.056 5 0 "[ . 1]" 1
796 1 35 ILE HA 1 35 ILE HG12 3.430 . 3.430 2.771 2.696 2.816 . 0 0 "[ . 1]" 1
797 1 35 ILE HA 1 35 ILE HG13 3.680 . 3.680 3.570 3.500 3.801 0.121 2 0 "[ . 1]" 1
798 1 35 ILE HA 1 35 ILE MG 2.910 . 2.910 2.240 2.207 2.358 . 0 0 "[ . 1]" 1
799 1 35 ILE HA 1 36 VAL H 2.810 . 2.810 2.210 2.130 2.294 . 0 0 "[ . 1]" 1
800 1 35 ILE HA 1 36 VAL QG 4.410 . 4.410 3.517 3.448 3.645 . 0 0 "[ . 1]" 1
801 1 35 ILE HA 1 37 THR MG 5.450 . 5.450 5.104 4.952 5.302 . 0 0 "[ . 1]" 1
802 1 35 ILE HA 1 51 ASN QB 5.340 . 5.340 4.924 4.652 5.310 . 0 0 "[ . 1]" 1
803 1 35 ILE HA 1 52 LEU H 5.500 . 5.500 4.645 4.546 4.834 . 0 0 "[ . 1]" 1
804 1 35 ILE HA 1 52 LEU HB3 5.220 . 5.220 4.668 4.566 4.728 . 0 0 "[ . 1]" 1
805 1 35 ILE HB 1 35 ILE MD 3.080 . 3.080 2.702 2.616 3.204 0.124 2 0 "[ . 1]" 1
806 1 35 ILE HB 1 36 VAL H 4.420 . 4.420 3.807 3.687 3.929 . 0 0 "[ . 1]" 1
807 1 35 ILE HB 1 37 THR MG 4.360 . 4.360 3.326 3.108 3.544 . 0 0 "[ . 1]" 1
808 1 35 ILE HB 1 52 LEU H 4.370 . 4.370 3.694 3.199 3.916 . 0 0 "[ . 1]" 1
809 1 35 ILE HB 1 52 LEU HB2 4.750 . 4.750 3.698 3.061 3.879 . 0 0 "[ . 1]" 1
810 1 35 ILE HB 1 52 LEU HB3 3.290 . 3.290 2.615 2.005 2.737 . 0 0 "[ . 1]" 1
811 1 35 ILE HB 1 85 PRO HD2 4.550 . 4.550 3.674 3.485 4.190 . 0 0 "[ . 1]" 1
812 1 35 ILE MD 1 85 PRO HG2 4.040 . 4.040 3.989 3.807 4.042 0.002 9 0 "[ . 1]" 1
813 1 35 ILE MD 1 86 VAL HA 3.580 . 3.580 2.946 2.814 3.336 . 0 0 "[ . 1]" 1
814 1 35 ILE MD 1 86 VAL HB 5.500 . 5.500 4.574 4.415 5.180 . 0 0 "[ . 1]" 1
815 1 35 ILE MD 1 86 VAL QG 3.930 . 3.930 3.220 3.044 3.959 0.029 2 0 "[ . 1]" 1
816 1 35 ILE MD 1 102 TRP H 4.720 . 4.720 4.377 4.208 4.660 . 0 0 "[ . 1]" 1
817 1 35 ILE MD 1 102 TRP HA 4.430 . 4.430 4.460 4.438 4.515 0.085 2 0 "[ . 1]" 1
818 1 35 ILE MD 1 102 TRP HB2 3.730 . 3.730 2.455 2.293 2.660 . 0 0 "[ . 1]" 1
819 1 35 ILE MD 1 102 TRP HB3 3.740 . 3.740 2.524 2.379 2.679 . 0 0 "[ . 1]" 1
820 1 35 ILE MD 1 102 TRP HD1 5.160 . 5.160 5.199 5.085 5.250 0.090 7 0 "[ . 1]" 1
821 1 35 ILE MD 1 102 TRP HE3 3.240 . 3.240 1.929 1.876 2.018 . 0 0 "[ . 1]" 1
822 1 35 ILE MD 1 102 TRP HZ3 4.160 . 4.160 3.712 3.478 3.821 . 0 0 "[ . 1]" 1
823 1 35 ILE HG12 1 35 ILE MG 3.130 . 3.130 2.760 2.672 3.138 0.008 2 0 "[ . 1]" 1
824 1 35 ILE HG12 1 36 VAL H 4.820 . 4.820 4.806 4.721 4.882 0.062 2 0 "[ . 1]" 1
825 1 35 ILE HG12 1 52 LEU HB3 5.120 . 5.120 4.412 3.380 4.624 . 0 0 "[ . 1]" 1
826 1 35 ILE HG12 1 102 TRP HE3 4.920 . 4.920 4.092 3.692 4.926 0.006 2 0 "[ . 1]" 1
827 1 35 ILE HG13 1 35 ILE MG 3.450 . 3.450 3.099 2.585 3.171 . 0 0 "[ . 1]" 1
828 1 35 ILE HG13 1 52 LEU HB3 4.480 . 4.480 3.130 3.050 3.319 . 0 0 "[ . 1]" 1
829 1 35 ILE HG13 1 52 LEU QD 4.100 . 4.100 2.632 2.531 2.716 . 0 0 "[ . 1]" 1
830 1 35 ILE MG 1 36 VAL H 3.050 . 3.050 2.372 2.232 2.511 . 0 0 "[ . 1]" 1
831 1 35 ILE MG 1 36 VAL HA 4.610 . 4.610 4.201 3.920 4.281 . 0 0 "[ . 1]" 1
832 1 35 ILE MG 1 36 VAL HB 4.800 . 4.800 3.931 3.869 4.163 . 0 0 "[ . 1]" 1
833 1 35 ILE MG 1 37 THR H 5.410 . 5.410 4.743 4.236 4.916 . 0 0 "[ . 1]" 1
834 1 35 ILE MG 1 37 THR HA 4.790 . 4.790 4.180 3.622 4.382 . 0 0 "[ . 1]" 1
835 1 35 ILE MG 1 72 ILE MD 5.500 . 5.500 5.465 5.025 5.536 0.036 3 0 "[ . 1]" 1
836 1 35 ILE MG 1 84 CYS HA 4.430 . 4.430 3.821 3.307 3.948 . 0 0 "[ . 1]" 1
837 1 35 ILE MG 1 85 PRO HB2 3.900 . 3.900 3.594 3.506 3.779 . 0 0 "[ . 1]" 1
838 1 35 ILE MG 1 85 PRO HB3 5.000 . 5.000 4.393 4.338 4.512 . 0 0 "[ . 1]" 1
839 1 35 ILE MG 1 85 PRO HD2 3.170 . 3.170 2.146 1.999 2.301 . 0 0 "[ . 1]" 1
840 1 35 ILE MG 1 85 PRO HD3 4.160 . 4.160 3.520 3.440 3.669 . 0 0 "[ . 1]" 1
841 1 35 ILE MG 1 85 PRO HG2 3.150 . 3.150 2.113 2.048 2.278 . 0 0 "[ . 1]" 1
842 1 35 ILE MG 1 85 PRO HG3 3.490 . 3.490 3.333 3.266 3.489 . 0 0 "[ . 1]" 1
843 1 35 ILE MG 1 86 VAL HA 4.580 . 4.580 3.723 3.658 3.783 . 0 0 "[ . 1]" 1
844 1 35 ILE MG 1 86 VAL MG1 5.500 . 5.500 4.064 3.790 4.175 . 0 0 "[ . 1]" 1
845 1 35 ILE MG 1 86 VAL QG 4.260 . 4.260 3.959 3.717 4.056 . 0 0 "[ . 1]" 1
846 1 35 ILE MG 1 86 VAL MG2 5.500 . 5.500 5.461 5.376 5.510 0.010 5 0 "[ . 1]" 1
847 1 35 ILE MG 1 102 TRP HE3 4.010 . 4.010 2.517 2.263 3.058 . 0 0 "[ . 1]" 1
848 1 35 ILE MG 1 102 TRP HZ3 3.660 . 3.660 2.792 2.568 3.320 . 0 0 "[ . 1]" 1
849 1 36 VAL H 1 36 VAL HB 2.980 . 2.980 2.542 2.504 2.605 . 0 0 "[ . 1]" 1
850 1 36 VAL H 1 36 VAL MG1 3.860 . 3.860 3.793 3.776 3.850 . 0 0 "[ . 1]" 1
851 1 36 VAL H 1 36 VAL QG 2.670 . 2.670 2.186 2.107 2.370 . 0 0 "[ . 1]" 1
852 1 36 VAL H 1 36 VAL MG2 3.860 . 3.860 2.200 2.117 2.393 . 0 0 "[ . 1]" 1
853 1 36 VAL H 1 37 THR H 4.830 . 4.830 4.455 4.414 4.508 . 0 0 "[ . 1]" 1
854 1 36 VAL H 1 37 THR MG 5.150 . 5.150 4.645 4.436 4.818 . 0 0 "[ . 1]" 1
855 1 36 VAL H 1 52 LEU H 5.080 . 5.080 4.729 4.636 4.810 . 0 0 "[ . 1]" 1
856 1 36 VAL H 1 52 LEU HB3 5.500 . 5.500 5.524 5.485 5.539 0.039 1 0 "[ . 1]" 1
857 1 36 VAL HA 1 36 VAL MG1 2.920 . 2.920 2.414 2.401 2.435 . 0 0 "[ . 1]" 1
858 1 36 VAL HA 1 36 VAL MG2 2.920 . 2.920 2.424 2.404 2.448 . 0 0 "[ . 1]" 1
859 1 36 VAL HA 1 37 THR H 2.780 . 2.780 2.177 2.147 2.203 . 0 0 "[ . 1]" 1
860 1 36 VAL HA 1 37 THR HA 4.630 . 4.630 4.388 4.362 4.404 . 0 0 "[ . 1]" 1
861 1 36 VAL HA 1 37 THR MG 3.870 . 3.870 3.624 3.525 3.730 . 0 0 "[ . 1]" 1
862 1 36 VAL HA 1 51 ASN HA 3.210 . 3.210 2.310 2.164 2.391 . 0 0 "[ . 1]" 1
863 1 36 VAL HA 1 51 ASN HB2 4.710 . 4.710 4.548 3.612 4.820 0.110 2 0 "[ . 1]" 1
864 1 36 VAL HA 1 51 ASN QB 4.100 . 4.100 3.566 2.736 3.948 . 0 0 "[ . 1]" 1
865 1 36 VAL HA 1 51 ASN HB3 4.710 . 4.710 3.736 2.832 4.213 . 0 0 "[ . 1]" 1
866 1 36 VAL HA 1 52 LEU H 4.090 . 4.090 3.475 3.395 3.606 . 0 0 "[ . 1]" 1
867 1 36 VAL HB 1 37 THR H 4.350 . 4.350 4.277 4.221 4.327 . 0 0 "[ . 1]" 1
868 1 36 VAL QG 1 37 THR H 3.190 . 3.190 2.865 2.753 2.954 . 0 0 "[ . 1]" 1
869 1 36 VAL QG 1 37 THR HA 4.620 . 4.620 3.940 3.748 4.030 . 0 0 "[ . 1]" 1
870 1 36 VAL QG 1 38 ARG H 5.440 . 5.440 4.918 4.822 5.034 . 0 0 "[ . 1]" 1
871 1 36 VAL QG 1 38 ARG HG2 4.880 . 4.880 3.749 3.568 3.886 . 0 0 "[ . 1]" 1
872 1 36 VAL QG 1 38 ARG HG3 5.440 . 5.440 4.792 4.582 4.964 . 0 0 "[ . 1]" 1
873 1 36 VAL QG 1 51 ASN H 5.250 . 5.250 4.724 4.412 4.874 . 0 0 "[ . 1]" 1
874 1 36 VAL QG 1 51 ASN HA 3.560 . 3.560 3.438 3.274 3.566 0.006 9 0 "[ . 1]" 1
875 1 36 VAL QG 1 51 ASN QB 4.080 . 4.080 3.481 2.748 3.806 . 0 0 "[ . 1]" 1
876 1 36 VAL QG 1 51 ASN QD 4.170 . 4.170 2.354 1.871 3.779 . 0 0 "[ . 1]" 1
877 1 36 VAL QG 1 52 LEU H 5.130 . 5.130 4.497 4.424 4.600 . 0 0 "[ . 1]" 1
878 1 36 VAL MG1 1 37 THR H 4.160 . 4.160 2.920 2.798 3.022 . 0 0 "[ . 1]" 1
879 1 36 VAL MG1 1 51 ASN HA 4.090 . 4.090 3.920 3.814 4.091 0.001 8 0 "[ . 1]" 1
880 1 36 VAL MG2 1 37 THR H 4.160 . 4.160 4.156 4.102 4.171 0.011 2 0 "[ . 1]" 1
881 1 36 VAL MG2 1 51 ASN HA 4.090 . 4.090 3.815 3.532 4.057 . 0 0 "[ . 1]" 1
882 1 37 THR H 1 37 THR HB 4.140 . 4.140 3.664 3.582 3.732 . 0 0 "[ . 1]" 1
883 1 37 THR H 1 37 THR MG 3.120 . 3.120 2.450 2.283 2.621 . 0 0 "[ . 1]" 1
884 1 37 THR H 1 48 VAL QG 3.650 . 3.650 3.262 3.145 3.441 . 0 0 "[ . 1]" 1
885 1 37 THR H 1 49 GLY H 4.940 . 4.940 4.030 3.828 4.275 . 0 0 "[ . 1]" 1
886 1 37 THR H 1 50 GLY H 4.660 . 4.660 3.364 2.965 3.809 . 0 0 "[ . 1]" 1
887 1 37 THR H 1 51 ASN H 5.500 . 5.500 4.744 4.643 4.855 . 0 0 "[ . 1]" 1
888 1 37 THR H 1 51 ASN HA 3.650 . 3.650 2.744 2.501 3.007 . 0 0 "[ . 1]" 1
889 1 37 THR H 1 52 LEU H 4.500 . 4.500 3.577 3.448 3.706 . 0 0 "[ . 1]" 1
890 1 37 THR HA 1 37 THR MG 3.060 . 3.060 2.362 2.327 2.407 . 0 0 "[ . 1]" 1
891 1 37 THR HA 1 38 ARG H 3.210 . 3.210 2.388 2.333 2.454 . 0 0 "[ . 1]" 1
892 1 37 THR HA 1 38 ARG HD3 5.500 . 5.500 4.724 4.582 4.917 . 0 0 "[ . 1]" 1
893 1 37 THR HA 1 48 VAL QG 5.290 . 5.290 4.746 4.602 4.907 . 0 0 "[ . 1]" 1
894 1 37 THR HA 1 82 VAL QG 4.440 . 4.440 3.746 3.596 3.968 . 0 0 "[ . 1]" 1
895 1 37 THR HA 1 84 CYS HA 3.920 . 3.920 2.506 2.451 2.629 . 0 0 "[ . 1]" 1
896 1 37 THR HA 1 85 PRO HD2 3.640 . 3.640 3.154 2.947 3.334 . 0 0 "[ . 1]" 1
897 1 37 THR HA 1 85 PRO HD3 4.230 . 4.230 3.061 2.861 3.307 . 0 0 "[ . 1]" 1
898 1 37 THR HB 1 38 ARG H 3.160 . 3.160 2.597 2.458 2.697 . 0 0 "[ . 1]" 1
899 1 37 THR HB 1 52 LEU H 5.500 . 5.500 5.521 5.491 5.565 0.065 6 0 "[ . 1]" 1
900 1 37 THR HB 1 52 LEU HB2 5.320 . 5.320 4.842 4.677 4.996 . 0 0 "[ . 1]" 1
901 1 37 THR HB 1 82 VAL HB 5.400 . 5.400 4.465 4.338 4.693 . 0 0 "[ . 1]" 1
902 1 37 THR HB 1 82 VAL QG 2.850 . 2.850 1.980 1.882 2.186 . 0 0 "[ . 1]" 1
903 1 37 THR HB 1 83 TYR H 4.660 . 4.660 3.872 3.769 3.989 . 0 0 "[ . 1]" 1
904 1 37 THR MG 1 38 ARG H 3.980 . 3.980 3.782 3.743 3.844 . 0 0 "[ . 1]" 1
905 1 37 THR MG 1 49 GLY H 5.260 . 5.260 4.936 4.722 5.266 0.006 9 0 "[ . 1]" 1
906 1 37 THR MG 1 50 GLY H 4.860 . 4.860 4.615 4.126 4.852 . 0 0 "[ . 1]" 1
907 1 37 THR MG 1 50 GLY QA 5.340 . 5.340 4.665 4.404 4.903 . 0 0 "[ . 1]" 1
908 1 37 THR MG 1 51 ASN H 5.500 . 5.500 5.082 4.922 5.196 . 0 0 "[ . 1]" 1
909 1 37 THR MG 1 51 ASN HA 3.300 . 3.300 3.285 3.132 3.349 0.049 3 0 "[ . 1]" 1
910 1 37 THR MG 1 51 ASN QB 5.110 . 5.110 4.780 4.474 4.940 . 0 0 "[ . 1]" 1
911 1 37 THR MG 1 52 LEU H 3.220 . 3.220 2.530 2.457 2.606 . 0 0 "[ . 1]" 1
912 1 37 THR MG 1 52 LEU HB3 3.470 . 3.470 3.088 2.978 3.193 . 0 0 "[ . 1]" 1
913 1 37 THR MG 1 52 LEU QD 3.770 . 3.770 2.854 2.744 2.981 . 0 0 "[ . 1]" 1
914 1 37 THR MG 1 58 ILE MD 4.650 . 4.650 4.029 3.715 4.176 . 0 0 "[ . 1]" 1
915 1 37 THR MG 1 74 TYR QE 4.290 . 4.290 3.604 3.480 3.716 . 0 0 "[ . 1]" 1
916 1 37 THR MG 1 82 VAL HB 5.500 . 5.500 4.867 4.753 5.160 . 0 0 "[ . 1]" 1
917 1 37 THR MG 1 82 VAL QG 3.160 . 3.160 2.824 2.723 3.075 . 0 0 "[ . 1]" 1
918 1 37 THR MG 1 83 TYR H 5.500 . 5.500 5.009 4.933 5.089 . 0 0 "[ . 1]" 1
919 1 37 THR MG 1 84 CYS H 5.070 . 5.070 4.429 4.294 4.693 . 0 0 "[ . 1]" 1
920 1 37 THR MG 1 84 CYS HA 3.500 . 3.500 2.676 2.390 2.991 . 0 0 "[ . 1]" 1
921 1 37 THR MG 1 84 CYS HB2 3.270 . 3.270 2.155 2.015 2.267 . 0 0 "[ . 1]" 1
922 1 37 THR MG 1 84 CYS HB3 4.060 . 4.060 3.607 3.436 3.739 . 0 0 "[ . 1]" 1
923 1 37 THR MG 1 85 PRO HD3 5.500 . 5.500 4.192 3.947 4.505 . 0 0 "[ . 1]" 1
924 1 38 ARG H 1 38 ARG QB 3.560 . 3.560 2.640 2.593 2.704 . 0 0 "[ . 1]" 1
925 1 38 ARG H 1 38 ARG HG2 4.380 . 4.380 2.935 2.771 3.117 . 0 0 "[ . 1]" 1
926 1 38 ARG H 1 38 ARG HG3 4.370 . 4.370 4.211 4.106 4.339 . 0 0 "[ . 1]" 1
927 1 38 ARG H 1 39 ILE H 4.810 . 4.810 4.430 4.378 4.455 . 0 0 "[ . 1]" 1
928 1 38 ARG H 1 39 ILE HG12 5.290 . 5.290 5.140 5.006 5.190 . 0 0 "[ . 1]" 1
929 1 38 ARG H 1 39 ILE HG13 5.450 . 5.450 4.771 4.695 4.823 . 0 0 "[ . 1]" 1
930 1 38 ARG H 1 46 ALA MB 5.500 . 5.500 5.326 5.224 5.455 . 0 0 "[ . 1]" 1
931 1 38 ARG H 1 48 VAL QG 5.500 . 5.500 5.044 4.876 5.221 . 0 0 "[ . 1]" 1
932 1 38 ARG H 1 82 VAL HB 5.500 . 5.500 5.563 5.523 5.582 0.082 5 0 "[ . 1]" 1
933 1 38 ARG H 1 82 VAL QG 3.520 . 3.520 2.875 2.826 2.916 . 0 0 "[ . 1]" 1
934 1 38 ARG H 1 83 TYR H 3.740 . 3.740 2.738 2.670 2.805 . 0 0 "[ . 1]" 1
935 1 38 ARG H 1 84 CYS HA 4.580 . 4.580 3.546 3.445 3.664 . 0 0 "[ . 1]" 1
936 1 38 ARG HA 1 38 ARG HD2 3.750 . 3.750 3.156 3.090 3.255 . 0 0 "[ . 1]" 1
937 1 38 ARG HA 1 38 ARG HD3 3.490 . 3.490 2.127 2.097 2.194 . 0 0 "[ . 1]" 1
938 1 38 ARG HA 1 39 ILE H 3.040 . 3.040 2.353 2.282 2.413 . 0 0 "[ . 1]" 1
939 1 38 ARG HA 1 39 ILE HB 4.740 . 4.740 4.484 4.327 4.584 . 0 0 "[ . 1]" 1
940 1 38 ARG HA 1 39 ILE MD 5.420 . 5.420 4.845 4.789 4.940 . 0 0 "[ . 1]" 1
941 1 38 ARG HA 1 39 ILE HG12 4.920 . 4.920 4.688 4.613 4.735 . 0 0 "[ . 1]" 1
942 1 38 ARG HA 1 39 ILE HG13 4.340 . 4.340 3.444 3.371 3.523 . 0 0 "[ . 1]" 1
943 1 38 ARG HA 1 46 ALA MB 4.500 . 4.500 3.914 3.805 4.033 . 0 0 "[ . 1]" 1
944 1 38 ARG HA 1 48 VAL HA 3.380 . 3.380 2.480 2.210 2.667 . 0 0 "[ . 1]" 1
945 1 38 ARG HA 1 48 VAL HB 5.500 . 5.500 5.300 4.472 5.536 0.036 4 0 "[ . 1]" 1
946 1 38 ARG HA 1 48 VAL QG 4.100 . 4.100 3.735 3.569 3.942 . 0 0 "[ . 1]" 1
947 1 38 ARG HA 1 49 GLY H 3.610 . 3.610 2.563 2.240 2.799 . 0 0 "[ . 1]" 1
948 1 38 ARG HA 1 49 GLY QA 4.690 . 4.690 3.917 3.570 4.156 . 0 0 "[ . 1]" 1
949 1 38 ARG HA 1 82 VAL MG1 5.500 . 5.500 4.227 4.173 4.270 . 0 0 "[ . 1]" 1
950 1 38 ARG HA 1 82 VAL MG2 5.500 . 5.500 5.557 5.535 5.593 0.093 5 0 "[ . 1]" 1
951 1 38 ARG QB 1 38 ARG HD2 3.820 . 3.820 2.498 2.478 2.522 . 0 0 "[ . 1]" 1
952 1 38 ARG QB 1 38 ARG HD3 3.880 . 3.880 2.857 2.798 2.902 . 0 0 "[ . 1]" 1
953 1 38 ARG QB 1 39 ILE H 3.600 . 3.600 2.510 2.356 2.641 . 0 0 "[ . 1]" 1
954 1 38 ARG QB 1 42 PRO HA 4.110 . 4.110 3.294 2.974 3.545 . 0 0 "[ . 1]" 1
955 1 38 ARG QB 1 43 PHE H 4.350 . 4.350 3.246 2.931 3.474 . 0 0 "[ . 1]" 1
956 1 38 ARG QB 1 46 ALA MB 2.960 . 2.960 2.066 1.933 2.160 . 0 0 "[ . 1]" 1
957 1 38 ARG QB 1 71 TRP HZ3 4.000 . 4.000 2.982 2.717 3.156 . 0 0 "[ . 1]" 1
958 1 38 ARG QB 1 82 VAL QG 5.000 . 5.000 4.287 4.228 4.356 . 0 0 "[ . 1]" 1
959 1 38 ARG QB 1 83 TYR H 4.110 . 4.110 3.416 3.240 3.645 . 0 0 "[ . 1]" 1
960 1 38 ARG QB 1 83 TYR QD 4.960 . 4.960 3.859 3.441 4.133 . 0 0 "[ . 1]" 1
961 1 38 ARG HD2 1 39 ILE H 4.490 . 4.490 4.150 4.047 4.290 . 0 0 "[ . 1]" 1
962 1 38 ARG HD2 1 44 LEU HA 4.970 . 4.970 3.883 3.489 4.223 . 0 0 "[ . 1]" 1
963 1 38 ARG HD2 1 44 LEU QD 5.440 . 5.440 4.856 4.412 5.206 . 0 0 "[ . 1]" 1
964 1 38 ARG HD2 1 46 ALA H 3.930 . 3.930 3.271 3.003 3.532 . 0 0 "[ . 1]" 1
965 1 38 ARG HD2 1 46 ALA MB 3.520 . 3.520 2.622 2.372 2.825 . 0 0 "[ . 1]" 1
966 1 38 ARG HD2 1 48 VAL HA 4.010 . 4.010 3.567 3.224 3.908 . 0 0 "[ . 1]" 1
967 1 38 ARG HD2 1 48 VAL QG 4.030 . 4.030 3.683 3.465 4.055 0.025 1 0 "[ . 1]" 1
968 1 38 ARG HD3 1 39 ILE H 4.380 . 4.380 4.000 3.861 4.134 . 0 0 "[ . 1]" 1
969 1 38 ARG HD3 1 46 ALA H 5.270 . 5.270 5.025 4.756 5.273 0.003 7 0 "[ . 1]" 1
970 1 38 ARG HD3 1 46 ALA MB 4.050 . 4.050 3.876 3.639 4.040 . 0 0 "[ . 1]" 1
971 1 38 ARG HD3 1 48 VAL HA 3.600 . 3.600 2.264 2.127 2.500 . 0 0 "[ . 1]" 1
972 1 38 ARG HD3 1 48 VAL QG 3.670 . 3.670 2.872 2.806 2.996 . 0 0 "[ . 1]" 1
973 1 38 ARG HD3 1 49 GLY H 4.780 . 4.780 3.545 3.273 3.866 . 0 0 "[ . 1]" 1
974 1 38 ARG HG2 1 39 ILE H 5.050 . 5.050 4.923 4.860 4.969 . 0 0 "[ . 1]" 1
975 1 38 ARG HG2 1 43 PHE H 5.480 . 5.480 4.936 4.596 5.409 . 0 0 "[ . 1]" 1
976 1 38 ARG HG2 1 44 LEU QD 5.440 . 5.440 4.468 3.971 4.756 . 0 0 "[ . 1]" 1
977 1 38 ARG HG2 1 46 ALA MB 4.700 . 4.700 4.175 3.981 4.377 . 0 0 "[ . 1]" 1
978 1 38 ARG HG2 1 48 VAL HA 5.190 . 5.190 4.454 4.374 4.599 . 0 0 "[ . 1]" 1
979 1 38 ARG HG2 1 48 VAL QG 5.410 . 5.410 4.423 4.296 4.545 . 0 0 "[ . 1]" 1
980 1 38 ARG HG2 1 49 GLY H 5.500 . 5.500 4.896 4.659 5.056 . 0 0 "[ . 1]" 1
981 1 38 ARG HG2 1 71 TRP HH2 4.860 . 4.860 3.201 2.935 3.340 . 0 0 "[ . 1]" 1
982 1 38 ARG HG2 1 71 TRP HZ3 3.920 . 3.920 2.161 2.018 2.373 . 0 0 "[ . 1]" 1
983 1 38 ARG HG2 1 85 PRO HD3 4.810 . 4.810 3.581 3.423 3.906 . 0 0 "[ . 1]" 1
984 1 38 ARG HG3 1 43 PHE H 4.520 . 4.520 3.382 3.026 3.905 . 0 0 "[ . 1]" 1
985 1 38 ARG HG3 1 44 LEU HA 4.720 . 4.720 3.445 3.005 3.636 . 0 0 "[ . 1]" 1
986 1 38 ARG HG3 1 44 LEU QD 4.900 . 4.900 3.831 3.344 4.118 . 0 0 "[ . 1]" 1
987 1 38 ARG HG3 1 46 ALA H 5.190 . 5.190 4.068 3.854 4.473 . 0 0 "[ . 1]" 1
988 1 38 ARG HG3 1 46 ALA MB 4.690 . 4.690 2.958 2.659 3.190 . 0 0 "[ . 1]" 1
989 1 38 ARG HG3 1 48 VAL QG 5.500 . 5.500 5.065 4.936 5.252 . 0 0 "[ . 1]" 1
990 1 38 ARG HG3 1 71 TRP HH2 4.140 . 4.140 2.515 2.356 2.722 . 0 0 "[ . 1]" 1
991 1 38 ARG HG3 1 71 TRP HZ3 3.900 . 3.900 2.647 2.477 2.979 . 0 0 "[ . 1]" 1
992 1 39 ILE H 1 39 ILE HB 3.150 . 3.150 2.646 2.502 2.717 . 0 0 "[ . 1]" 1
993 1 39 ILE H 1 39 ILE MD 4.710 . 4.710 4.195 4.125 4.231 . 0 0 "[ . 1]" 1
994 1 39 ILE H 1 39 ILE HG12 4.150 . 4.150 3.922 3.863 3.982 . 0 0 "[ . 1]" 1
995 1 39 ILE H 1 39 ILE HG13 3.570 . 3.570 2.945 2.831 2.994 . 0 0 "[ . 1]" 1
996 1 39 ILE H 1 39 ILE MG 4.130 . 4.130 3.848 3.773 3.888 . 0 0 "[ . 1]" 1
997 1 39 ILE H 1 40 GLY H 5.090 . 5.090 4.371 4.301 4.422 . 0 0 "[ . 1]" 1
998 1 39 ILE H 1 46 ALA MB 3.860 . 3.860 3.108 2.956 3.288 . 0 0 "[ . 1]" 1
999 1 39 ILE H 1 47 PRO HB2 4.850 . 4.850 3.938 3.813 4.100 . 0 0 "[ . 1]" 1
1000 1 39 ILE H 1 47 PRO QD 4.720 . 4.720 3.731 3.564 3.910 . 0 0 "[ . 1]" 1
1001 1 39 ILE H 1 48 VAL HA 4.440 . 4.440 4.028 3.755 4.412 . 0 0 "[ . 1]" 1
1002 1 39 ILE HA 1 39 ILE MD 3.960 . 3.960 3.731 3.663 3.785 . 0 0 "[ . 1]" 1
1003 1 39 ILE HA 1 39 ILE HG12 3.950 . 3.950 2.367 2.257 2.460 . 0 0 "[ . 1]" 1
1004 1 39 ILE HA 1 39 ILE HG13 3.760 . 3.760 3.006 2.951 3.063 . 0 0 "[ . 1]" 1
1005 1 39 ILE HA 1 39 ILE MG 3.070 . 3.070 2.459 2.383 2.560 . 0 0 "[ . 1]" 1
1006 1 39 ILE HA 1 40 GLY H 2.900 . 2.900 2.078 2.056 2.097 . 0 0 "[ . 1]" 1
1007 1 39 ILE HB 1 39 ILE MD 3.200 . 3.200 2.510 2.479 2.551 . 0 0 "[ . 1]" 1
1008 1 39 ILE HB 1 40 GLY H 4.390 . 4.390 4.110 4.075 4.137 . 0 0 "[ . 1]" 1
1009 1 39 ILE HB 1 47 PRO HB2 3.950 . 3.950 3.152 2.870 3.717 . 0 0 "[ . 1]" 1
1010 1 39 ILE HB 1 47 PRO QD 4.650 . 4.650 4.373 3.996 4.655 0.005 1 0 "[ . 1]" 1
1011 1 39 ILE HB 1 47 PRO QG 3.550 . 3.550 2.457 2.106 2.734 . 0 0 "[ . 1]" 1
1012 1 39 ILE MD 1 40 GLY H 5.220 . 5.220 4.759 4.594 4.903 . 0 0 "[ . 1]" 1
1013 1 39 ILE MD 1 47 PRO HB2 4.800 . 4.800 3.871 3.597 4.358 . 0 0 "[ . 1]" 1
1014 1 39 ILE MD 1 47 PRO QG 4.860 . 4.860 4.176 3.913 4.446 . 0 0 "[ . 1]" 1
1015 1 39 ILE MD 1 49 GLY H 4.120 . 4.120 4.039 3.910 4.145 0.025 2 0 "[ . 1]" 1
1016 1 39 ILE MD 1 49 GLY HA2 3.500 . 3.500 2.161 2.028 2.261 . 0 0 "[ . 1]" 1
1017 1 39 ILE MD 1 49 GLY QA 2.980 . 2.980 2.032 1.952 2.092 . 0 0 "[ . 1]" 1
1018 1 39 ILE MD 1 49 GLY HA3 3.500 . 3.500 2.508 2.378 2.703 . 0 0 "[ . 1]" 1
1019 1 39 ILE MD 1 50 GLY H 5.270 . 5.270 4.825 4.724 4.889 . 0 0 "[ . 1]" 1
1020 1 39 ILE MD 1 76 ALA MB 4.170 . 4.170 3.944 3.620 4.081 . 0 0 "[ . 1]" 1
1021 1 39 ILE MD 1 80 ASN HB2 4.170 . 4.170 3.287 2.891 4.211 0.041 5 0 "[ . 1]" 1
1022 1 39 ILE MD 1 80 ASN HB3 3.920 . 3.920 2.618 2.168 3.466 . 0 0 "[ . 1]" 1
1023 1 39 ILE MD 1 80 ASN HD21 5.500 . 5.500 3.154 2.482 4.124 . 0 0 "[ . 1]" 1
1024 1 39 ILE MD 1 80 ASN HD22 5.500 . 5.500 3.704 3.323 4.370 . 0 0 "[ . 1]" 1
1025 1 39 ILE MD 1 82 VAL QG 3.650 . 3.650 2.712 2.591 2.821 . 0 0 "[ . 1]" 1
1026 1 39 ILE MD 1 83 TYR H 5.500 . 5.500 5.596 5.563 5.624 0.124 5 0 "[ . 1]" 1
1027 1 39 ILE HG12 1 39 ILE MG 3.070 . 3.070 2.457 2.411 2.529 . 0 0 "[ . 1]" 1
1028 1 39 ILE HG12 1 40 GLY H 4.440 . 4.440 4.014 3.824 4.205 . 0 0 "[ . 1]" 1
1029 1 39 ILE HG12 1 47 PRO QG 5.420 . 5.420 5.187 4.922 5.406 . 0 0 "[ . 1]" 1
1030 1 39 ILE HG12 1 49 GLY H 5.500 . 5.500 4.603 4.536 4.739 . 0 0 "[ . 1]" 1
1031 1 39 ILE HG12 1 49 GLY HA2 4.040 . 4.040 3.851 3.521 4.059 0.019 1 0 "[ . 1]" 1
1032 1 39 ILE HG12 1 49 GLY QA 3.450 . 3.450 3.053 2.894 3.209 . 0 0 "[ . 1]" 1
1033 1 39 ILE HG12 1 49 GLY HA3 4.040 . 4.040 3.206 3.052 3.389 . 0 0 "[ . 1]" 1
1034 1 39 ILE HG12 1 80 ASN HB3 4.950 . 4.950 3.432 2.755 4.334 . 0 0 "[ . 1]" 1
1035 1 39 ILE HG12 1 82 VAL QG 4.430 . 4.430 1.893 1.842 1.975 . 0 0 "[ . 1]" 1
1036 1 39 ILE HG13 1 40 GLY H 5.280 . 5.280 4.902 4.831 4.992 . 0 0 "[ . 1]" 1
1037 1 39 ILE HG13 1 47 PRO HB2 5.150 . 5.150 4.412 4.171 4.798 . 0 0 "[ . 1]" 1
1038 1 39 ILE HG13 1 49 GLY HA2 3.820 . 3.820 2.712 2.396 2.925 . 0 0 "[ . 1]" 1
1039 1 39 ILE HG13 1 49 GLY QA 3.310 . 3.310 2.234 1.928 2.488 . 0 0 "[ . 1]" 1
1040 1 39 ILE HG13 1 49 GLY HA3 3.820 . 3.820 2.389 1.990 2.693 . 0 0 "[ . 1]" 1
1041 1 39 ILE HG13 1 82 VAL QG 4.900 . 4.900 3.024 2.939 3.127 . 0 0 "[ . 1]" 1
1042 1 39 ILE MG 1 40 GLY H 3.250 . 3.250 2.457 2.360 2.525 . 0 0 "[ . 1]" 1
1043 1 39 ILE MG 1 40 GLY HA2 4.200 . 4.200 3.348 3.244 3.402 . 0 0 "[ . 1]" 1
1044 1 39 ILE MG 1 40 GLY HA3 3.540 . 3.540 3.121 3.073 3.156 . 0 0 "[ . 1]" 1
1045 1 39 ILE MG 1 41 SER H 5.170 . 5.170 4.219 4.145 4.279 . 0 0 "[ . 1]" 1
1046 1 39 ILE MG 1 47 PRO QD 5.180 . 5.180 4.771 4.302 5.054 . 0 0 "[ . 1]" 1
1047 1 39 ILE MG 1 47 PRO QG 4.300 . 4.300 3.359 2.924 3.733 . 0 0 "[ . 1]" 1
1048 1 39 ILE MG 1 80 ASN HB2 4.050 . 4.050 3.379 2.951 3.960 . 0 0 "[ . 1]" 1
1049 1 39 ILE MG 1 80 ASN HB3 3.450 . 3.450 2.122 1.824 3.114 . 0 0 "[ . 1]" 1
1050 1 39 ILE MG 1 80 ASN QD 4.640 . 4.640 3.027 2.270 3.792 . 0 0 "[ . 1]" 1
1051 1 39 ILE MG 1 81 ARG H 4.140 . 4.140 2.852 2.503 3.454 . 0 0 "[ . 1]" 1
1052 1 39 ILE MG 1 82 VAL HA 4.010 . 4.010 3.697 3.481 3.847 . 0 0 "[ . 1]" 1
1053 1 39 ILE MG 1 82 VAL QG 3.050 . 3.050 3.070 2.951 3.093 0.043 8 0 "[ . 1]" 1
1054 1 40 GLY H 1 41 SER H 4.040 . 4.040 3.024 2.886 3.172 . 0 0 "[ . 1]" 1
1055 1 40 GLY H 1 46 ALA MB 5.500 . 5.500 5.249 5.079 5.369 . 0 0 "[ . 1]" 1
1056 1 40 GLY H 1 47 PRO QG 5.500 . 5.500 5.027 4.851 5.346 . 0 0 "[ . 1]" 1
1057 1 40 GLY H 1 80 ASN HB3 5.500 . 5.500 4.530 3.907 4.959 . 0 0 "[ . 1]" 1
1058 1 40 GLY H 1 81 ARG H 5.130 . 5.130 3.382 3.202 3.584 . 0 0 "[ . 1]" 1
1059 1 40 GLY H 1 81 ARG HB2 4.670 . 4.670 3.905 3.783 4.075 . 0 0 "[ . 1]" 1
1060 1 40 GLY H 1 81 ARG HB3 4.900 . 4.900 2.287 2.141 2.502 . 0 0 "[ . 1]" 1
1061 1 40 GLY H 1 81 ARG HG2 4.880 . 4.880 4.545 4.398 4.754 . 0 0 "[ . 1]" 1
1062 1 40 GLY H 1 82 VAL H 5.500 . 5.500 4.619 4.480 4.726 . 0 0 "[ . 1]" 1
1063 1 40 GLY H 1 82 VAL QG 4.950 . 4.950 4.068 3.745 4.226 . 0 0 "[ . 1]" 1
1064 1 40 GLY H 1 83 TYR H 5.050 . 5.050 4.374 4.284 4.505 . 0 0 "[ . 1]" 1
1065 1 40 GLY HA2 1 81 ARG H 5.490 . 5.490 3.511 3.156 3.710 . 0 0 "[ . 1]" 1
1066 1 40 GLY HA2 1 81 ARG HB2 4.440 . 4.440 3.239 3.142 3.365 . 0 0 "[ . 1]" 1
1067 1 40 GLY HA2 1 81 ARG HB3 4.130 . 4.130 2.182 2.092 2.332 . 0 0 "[ . 1]" 1
1068 1 40 GLY HA2 1 81 ARG HG2 5.010 . 5.010 3.990 3.812 4.155 . 0 0 "[ . 1]" 1
1069 1 40 GLY HA2 1 81 ARG HG3 5.330 . 5.330 4.298 4.151 4.447 . 0 0 "[ . 1]" 1
1070 1 40 GLY HA3 1 46 ALA MB 4.790 . 4.790 4.774 4.675 4.822 0.032 7 0 "[ . 1]" 1
1071 1 40 GLY HA3 1 47 PRO QD 4.990 . 4.990 4.734 4.566 4.907 . 0 0 "[ . 1]" 1
1072 1 40 GLY HA3 1 81 ARG HB2 5.500 . 5.500 4.974 4.839 5.113 . 0 0 "[ . 1]" 1
1073 1 40 GLY HA3 1 81 ARG HB3 5.330 . 5.330 3.783 3.722 3.911 . 0 0 "[ . 1]" 1
1074 1 41 SER H 1 42 PRO HD2 5.500 . 5.500 5.264 5.129 5.384 . 0 0 "[ . 1]" 1
1075 1 41 SER H 1 42 PRO HD3 5.500 . 5.500 4.598 4.504 4.631 . 0 0 "[ . 1]" 1
1076 1 41 SER H 1 46 ALA MB 3.750 . 3.750 3.190 3.042 3.285 . 0 0 "[ . 1]" 1
1077 1 41 SER H 1 81 ARG HB3 4.160 . 4.160 4.369 4.340 4.404 0.244 4 0 "[ . 1]" 1
1078 1 41 SER H 1 83 TYR QD 4.540 . 4.540 3.296 3.086 3.520 . 0 0 "[ . 1]" 1
1079 1 41 SER HA 1 42 PRO QB 4.830 . 4.830 4.590 4.533 4.649 . 0 0 "[ . 1]" 1
1080 1 41 SER HA 1 42 PRO HD2 3.640 . 3.640 2.865 2.703 3.178 . 0 0 "[ . 1]" 1
1081 1 41 SER HA 1 42 PRO QD 3.030 . 3.030 1.938 1.889 1.988 . 0 0 "[ . 1]" 1
1082 1 41 SER HA 1 42 PRO HD3 3.640 . 3.640 1.974 1.908 2.046 . 0 0 "[ . 1]" 1
1083 1 41 SER HA 1 42 PRO HG2 4.600 . 4.600 4.609 4.578 4.630 0.030 9 0 "[ . 1]" 1
1084 1 41 SER HA 1 42 PRO HG3 4.520 . 4.520 4.116 3.882 4.275 . 0 0 "[ . 1]" 1
1085 1 41 SER HA 1 43 PHE QD 5.060 . 5.060 4.015 3.581 4.454 . 0 0 "[ . 1]" 1
1086 1 41 SER HA 1 43 PHE QE 5.500 . 5.500 4.310 3.970 4.697 . 0 0 "[ . 1]" 1
1087 1 41 SER HA 1 83 TYR QD 5.030 . 5.030 3.778 3.504 4.145 . 0 0 "[ . 1]" 1
1088 1 41 SER QB 1 42 PRO QD 3.900 . 3.900 2.507 2.367 2.716 . 0 0 "[ . 1]" 1
1089 1 41 SER QB 1 43 PHE QD 3.280 . 3.280 1.913 1.801 2.056 . 0 0 "[ . 1]" 1
1090 1 41 SER QB 1 43 PHE QE 4.130 . 4.130 2.452 2.093 3.197 . 0 0 "[ . 1]" 1
1091 1 41 SER QB 1 46 ALA MB 4.140 . 4.140 2.549 2.082 3.354 . 0 0 "[ . 1]" 1
1092 1 41 SER HB2 1 43 PHE QD 4.030 . 4.030 2.503 2.010 3.253 . 0 0 "[ . 1]" 1
1093 1 41 SER HB2 1 46 ALA MB 4.770 . 4.770 2.604 2.099 3.528 . 0 0 "[ . 1]" 1
1094 1 41 SER HB3 1 43 PHE QD 4.030 . 4.030 2.126 1.845 3.425 . 0 0 "[ . 1]" 1
1095 1 41 SER HB3 1 46 ALA MB 4.770 . 4.770 3.710 3.215 4.194 . 0 0 "[ . 1]" 1
1096 1 42 PRO HA 1 43 PHE H 3.230 . 3.230 2.492 2.340 2.750 . 0 0 "[ . 1]" 1
1097 1 42 PRO HA 1 43 PHE HA 4.990 . 4.990 4.406 4.371 4.459 . 0 0 "[ . 1]" 1
1098 1 42 PRO HA 1 46 ALA MB 4.560 . 4.560 4.105 3.964 4.475 . 0 0 "[ . 1]" 1
1099 1 42 PRO HA 1 71 TRP QB 4.890 . 4.890 3.961 3.828 4.183 . 0 0 "[ . 1]" 1
1100 1 42 PRO HA 1 71 TRP HE3 4.330 . 4.330 3.793 3.686 3.868 . 0 0 "[ . 1]" 1
1101 1 42 PRO HA 1 71 TRP HZ3 4.700 . 4.700 4.237 4.146 4.393 . 0 0 "[ . 1]" 1
1102 1 42 PRO HA 1 83 TYR QB 4.220 . 4.220 2.521 2.410 2.673 . 0 0 "[ . 1]" 1
1103 1 42 PRO HA 1 83 TYR QD 4.880 . 4.880 3.541 3.333 3.625 . 0 0 "[ . 1]" 1
1104 1 42 PRO QB 1 43 PHE H 4.210 . 4.210 3.916 3.851 3.979 . 0 0 "[ . 1]" 1
1105 1 42 PRO QB 1 64 CYS HB2 4.660 . 4.660 2.961 2.830 3.211 . 0 0 "[ . 1]" 1
1106 1 42 PRO QB 1 64 CYS HB3 4.660 . 4.660 3.504 3.193 3.803 . 0 0 "[ . 1]" 1
1107 1 42 PRO QB 1 66 GLN HB2 4.730 . 4.730 3.708 3.344 4.004 . 0 0 "[ . 1]" 1
1108 1 42 PRO QB 1 66 GLN HB3 4.240 . 4.240 2.650 2.236 2.921 . 0 0 "[ . 1]" 1
1109 1 42 PRO QB 1 66 GLN HG2 5.500 . 5.500 4.053 3.456 4.393 . 0 0 "[ . 1]" 1
1110 1 42 PRO QB 1 67 ALA MB 4.870 . 4.870 4.783 4.537 4.904 0.034 6 0 "[ . 1]" 1
1111 1 42 PRO QB 1 71 TRP HB2 4.870 . 4.870 2.778 2.605 2.946 . 0 0 "[ . 1]" 1
1112 1 42 PRO QB 1 71 TRP QB 4.170 . 4.170 2.578 2.466 2.752 . 0 0 "[ . 1]" 1
1113 1 42 PRO QB 1 71 TRP HB3 4.870 . 4.870 3.066 2.915 3.301 . 0 0 "[ . 1]" 1
1114 1 42 PRO QB 1 71 TRP HD1 4.700 . 4.700 3.129 2.979 3.310 . 0 0 "[ . 1]" 1
1115 1 42 PRO QB 1 71 TRP HE3 4.840 . 4.840 3.890 3.584 4.082 . 0 0 "[ . 1]" 1
1116 1 42 PRO QB 1 83 TYR HB2 4.430 . 4.430 3.520 3.088 3.869 . 0 0 "[ . 1]" 1
1117 1 42 PRO QB 1 83 TYR QB 3.630 . 3.630 2.735 2.400 3.020 . 0 0 "[ . 1]" 1
1118 1 42 PRO QB 1 83 TYR HB3 4.430 . 4.430 2.851 2.501 3.171 . 0 0 "[ . 1]" 1
1119 1 42 PRO QB 1 83 TYR QD 4.620 . 4.620 2.725 2.635 2.879 . 0 0 "[ . 1]" 1
1120 1 42 PRO HG2 1 64 CYS QB 4.690 . 4.690 3.235 2.964 3.564 . 0 0 "[ . 1]" 1
1121 1 42 PRO HG2 1 66 GLN HB2 4.550 . 4.550 3.201 2.907 3.519 . 0 0 "[ . 1]" 1
1122 1 42 PRO HG2 1 66 GLN HB3 4.320 . 4.320 3.085 2.942 3.212 . 0 0 "[ . 1]" 1
1123 1 42 PRO HG2 1 66 GLN HG2 4.420 . 4.420 3.363 2.839 3.528 . 0 0 "[ . 1]" 1
1124 1 42 PRO HG2 1 66 GLN HG3 5.500 . 5.500 4.662 4.265 4.822 . 0 0 "[ . 1]" 1
1125 1 42 PRO HG3 1 64 CYS HB2 4.450 . 4.450 3.217 2.969 3.662 . 0 0 "[ . 1]" 1
1126 1 42 PRO HG3 1 64 CYS QB 3.900 . 3.900 2.832 2.628 3.099 . 0 0 "[ . 1]" 1
1127 1 42 PRO HG3 1 64 CYS HB3 4.450 . 4.450 3.147 2.932 3.373 . 0 0 "[ . 1]" 1
1128 1 42 PRO HG3 1 66 GLN HB3 4.720 . 4.720 4.547 4.310 4.662 . 0 0 "[ . 1]" 1
1129 1 42 PRO HG3 1 83 TYR QB 4.560 . 4.560 4.520 4.277 4.581 0.021 2 0 "[ . 1]" 1
1130 1 43 PHE H 1 43 PHE HB2 3.360 . 3.360 2.735 2.567 2.820 . 0 0 "[ . 1]" 1
1131 1 43 PHE H 1 43 PHE HB3 4.070 . 4.070 3.821 3.724 3.871 . 0 0 "[ . 1]" 1
1132 1 43 PHE H 1 43 PHE QD 4.210 . 4.210 3.187 2.878 3.484 . 0 0 "[ . 1]" 1
1133 1 43 PHE H 1 44 LEU H 4.860 . 4.860 4.375 4.328 4.426 . 0 0 "[ . 1]" 1
1134 1 43 PHE H 1 44 LEU QD 5.030 . 5.030 5.013 4.916 5.075 0.045 7 0 "[ . 1]" 1
1135 1 43 PHE H 1 46 ALA H 4.680 . 4.680 3.935 3.735 4.124 . 0 0 "[ . 1]" 1
1136 1 43 PHE H 1 46 ALA MB 3.350 . 3.350 2.443 2.345 2.643 . 0 0 "[ . 1]" 1
1137 1 43 PHE H 1 67 ALA MB 5.500 . 5.500 5.098 4.812 5.224 . 0 0 "[ . 1]" 1
1138 1 43 PHE H 1 83 TYR QB 5.340 . 5.340 4.275 4.140 4.470 . 0 0 "[ . 1]" 1
1139 1 43 PHE HA 1 43 PHE QD 4.110 . 4.110 2.957 2.676 3.142 . 0 0 "[ . 1]" 1
1140 1 43 PHE HA 1 44 LEU H 3.050 . 3.050 2.309 2.276 2.333 . 0 0 "[ . 1]" 1
1141 1 43 PHE HA 1 44 LEU MD1 5.500 . 5.500 5.149 4.993 5.227 . 0 0 "[ . 1]" 1
1142 1 43 PHE HA 1 44 LEU QD 4.450 . 4.450 4.044 3.908 4.197 . 0 0 "[ . 1]" 1
1143 1 43 PHE HA 1 44 LEU MD2 5.500 . 5.500 4.231 4.046 4.452 . 0 0 "[ . 1]" 1
1144 1 43 PHE HA 1 44 LEU HG 4.910 . 4.910 3.796 3.638 3.868 . 0 0 "[ . 1]" 1
1145 1 43 PHE HA 1 45 ASN H 4.570 . 4.570 3.793 3.607 4.010 . 0 0 "[ . 1]" 1
1146 1 43 PHE HB2 1 44 LEU H 4.240 . 4.240 3.727 3.697 3.775 . 0 0 "[ . 1]" 1
1147 1 43 PHE HB2 1 44 LEU QD 5.440 . 5.440 5.490 5.478 5.513 0.073 5 0 "[ . 1]" 1
1148 1 43 PHE HB2 1 45 ASN H 3.970 . 3.970 3.111 2.893 3.291 . 0 0 "[ . 1]" 1
1149 1 43 PHE HB2 1 46 ALA H 4.150 . 4.150 2.900 2.460 3.281 . 0 0 "[ . 1]" 1
1150 1 43 PHE HB2 1 46 ALA MB 3.130 . 3.130 2.178 2.044 2.442 . 0 0 "[ . 1]" 1
1151 1 43 PHE HB2 1 67 ALA MB 5.150 . 5.150 5.023 4.736 5.163 0.013 2 0 "[ . 1]" 1
1152 1 43 PHE HB3 1 44 LEU H 3.610 . 3.610 2.550 2.491 2.630 . 0 0 "[ . 1]" 1
1153 1 43 PHE HB3 1 45 ASN H 3.750 . 3.750 2.207 2.075 2.415 . 0 0 "[ . 1]" 1
1154 1 43 PHE HB3 1 46 ALA H 4.390 . 4.390 3.412 3.077 3.725 . 0 0 "[ . 1]" 1
1155 1 43 PHE HB3 1 46 ALA MB 4.440 . 4.440 3.626 3.480 3.865 . 0 0 "[ . 1]" 1
1156 1 43 PHE HB3 1 67 ALA MB 4.340 . 4.340 3.949 3.707 4.145 . 0 0 "[ . 1]" 1
1157 1 43 PHE QD 1 46 ALA MB 4.330 . 4.330 3.000 2.565 3.538 . 0 0 "[ . 1]" 1
1158 1 43 PHE QD 1 66 GLN HG3 4.900 . 4.900 3.283 2.906 3.855 . 0 0 "[ . 1]" 1
1159 1 43 PHE QD 1 67 ALA MB 4.070 . 4.070 3.166 2.818 3.520 . 0 0 "[ . 1]" 1
1160 1 43 PHE QE 1 66 GLN HG2 4.210 . 4.210 3.014 2.680 3.384 . 0 0 "[ . 1]" 1
1161 1 43 PHE QE 1 66 GLN HG3 4.350 . 4.350 3.369 3.014 3.917 . 0 0 "[ . 1]" 1
1162 1 44 LEU H 1 44 LEU HB2 3.690 . 3.690 2.478 2.433 2.506 . 0 0 "[ . 1]" 1
1163 1 44 LEU H 1 44 LEU QB 3.120 . 3.120 2.436 2.395 2.461 . 0 0 "[ . 1]" 1
1164 1 44 LEU H 1 44 LEU HB3 3.690 . 3.690 3.588 3.577 3.607 . 0 0 "[ . 1]" 1
1165 1 44 LEU H 1 44 LEU MD1 4.130 . 4.130 3.651 3.608 3.731 . 0 0 "[ . 1]" 1
1166 1 44 LEU H 1 44 LEU QD 3.430 . 3.430 3.052 3.005 3.099 . 0 0 "[ . 1]" 1
1167 1 44 LEU H 1 44 LEU MD2 4.130 . 4.130 3.275 3.179 3.371 . 0 0 "[ . 1]" 1
1168 1 44 LEU H 1 44 LEU HG 2.790 . 2.790 2.322 2.247 2.391 . 0 0 "[ . 1]" 1
1169 1 44 LEU H 1 45 ASN H 3.570 . 3.570 2.318 2.231 2.500 . 0 0 "[ . 1]" 1
1170 1 44 LEU H 1 46 ALA H 4.640 . 4.640 3.940 3.751 4.088 . 0 0 "[ . 1]" 1
1171 1 44 LEU H 1 46 ALA MB 4.970 . 4.970 4.641 4.575 4.749 . 0 0 "[ . 1]" 1
1172 1 44 LEU H 1 67 ALA MB 3.920 . 3.920 2.841 2.688 3.079 . 0 0 "[ . 1]" 1
1173 1 44 LEU H 1 71 TRP HH2 5.470 . 5.470 4.298 3.921 4.641 . 0 0 "[ . 1]" 1
1174 1 44 LEU H 1 71 TRP HZ2 4.810 . 4.810 3.604 3.365 3.954 . 0 0 "[ . 1]" 1
1175 1 44 LEU HA 1 44 LEU MD1 3.810 . 3.810 3.848 3.833 3.858 0.048 3 0 "[ . 1]" 1
1176 1 44 LEU HA 1 44 LEU QD 2.670 . 2.670 2.051 2.010 2.073 . 0 0 "[ . 1]" 1
1177 1 44 LEU HA 1 44 LEU MD2 3.810 . 3.810 2.059 2.017 2.081 . 0 0 "[ . 1]" 1
1178 1 44 LEU HA 1 46 ALA H 4.440 . 4.440 3.543 3.498 3.631 . 0 0 "[ . 1]" 1
1179 1 44 LEU HA 1 46 ALA MB 5.270 . 5.270 4.358 4.313 4.432 . 0 0 "[ . 1]" 1
1180 1 44 LEU HA 1 71 TRP HH2 3.940 . 3.940 2.928 2.697 3.141 . 0 0 "[ . 1]" 1
1181 1 44 LEU HA 1 71 TRP HZ3 5.430 . 5.430 5.026 4.868 5.209 . 0 0 "[ . 1]" 1
1182 1 44 LEU QB 1 44 LEU QD 2.300 . 2.300 1.940 1.930 1.950 . 0 0 "[ . 1]" 1
1183 1 44 LEU QB 1 45 ASN H 4.330 . 4.330 2.955 2.838 3.226 . 0 0 "[ . 1]" 1
1184 1 44 LEU QB 1 46 ALA H 5.340 . 5.340 4.477 4.422 4.608 . 0 0 "[ . 1]" 1
1185 1 44 LEU HB2 1 44 LEU MD1 3.260 . 3.260 2.324 2.297 2.354 . 0 0 "[ . 1]" 1
1186 1 44 LEU HB2 1 44 LEU MD2 3.260 . 3.260 3.195 3.190 3.200 . 0 0 "[ . 1]" 1
1187 1 44 LEU HB3 1 44 LEU MD1 3.260 . 3.260 2.341 2.322 2.367 . 0 0 "[ . 1]" 1
1188 1 44 LEU HB3 1 44 LEU MD2 3.260 . 3.260 2.389 2.362 2.418 . 0 0 "[ . 1]" 1
1189 1 44 LEU QD 1 46 ALA H 5.440 . 5.440 4.855 4.819 4.885 . 0 0 "[ . 1]" 1
1190 1 44 LEU QD 1 67 ALA HA 5.440 . 5.440 4.418 4.201 4.717 . 0 0 "[ . 1]" 1
1191 1 44 LEU QD 1 67 ALA MB 4.090 . 4.090 2.568 2.394 2.732 . 0 0 "[ . 1]" 1
1192 1 44 LEU QD 1 69 HIS HE1 4.060 . 4.060 2.448 2.121 3.054 . 0 0 "[ . 1]" 1
1193 1 44 LEU QD 1 71 TRP HE1 5.440 . 5.440 4.427 4.215 4.705 . 0 0 "[ . 1]" 1
1194 1 44 LEU QD 1 71 TRP HH2 3.090 . 3.090 2.048 1.962 2.135 . 0 0 "[ . 1]" 1
1195 1 44 LEU QD 1 71 TRP HZ2 3.210 . 3.210 2.404 2.132 2.794 . 0 0 "[ . 1]" 1
1196 1 44 LEU QD 1 85 PRO HB3 4.830 . 4.830 4.012 3.880 4.193 . 0 0 "[ . 1]" 1
1197 1 44 LEU QD 1 85 PRO HD3 5.440 . 5.440 4.895 4.594 5.115 . 0 0 "[ . 1]" 1
1198 1 44 LEU QD 1 85 PRO HG3 4.580 . 4.580 3.735 3.380 4.020 . 0 0 "[ . 1]" 1
1199 1 44 LEU MD1 1 71 TRP HZ2 4.500 . 4.500 4.122 3.908 4.252 . 0 0 "[ . 1]" 1
1200 1 44 LEU MD2 1 71 TRP HZ2 4.500 . 4.500 2.423 2.139 2.855 . 0 0 "[ . 1]" 1
1201 1 44 LEU HG 1 71 TRP HH2 4.690 . 4.690 4.017 3.443 4.286 . 0 0 "[ . 1]" 1
1202 1 44 LEU HG 1 71 TRP HZ2 3.640 . 3.640 2.923 2.641 3.208 . 0 0 "[ . 1]" 1
1203 1 45 ASN H 1 45 ASN HB2 4.180 . 4.180 2.737 2.356 3.698 . 0 0 "[ . 1]" 1
1204 1 45 ASN H 1 45 ASN HB3 4.180 . 4.180 3.264 2.475 3.728 . 0 0 "[ . 1]" 1
1205 1 45 ASN H 1 46 ALA H 3.260 . 3.260 2.440 2.279 2.541 . 0 0 "[ . 1]" 1
1206 1 45 ASN H 1 46 ALA MB 4.550 . 4.550 3.920 3.771 4.058 . 0 0 "[ . 1]" 1
1207 1 46 ALA H 1 46 ALA MB 2.940 . 2.940 2.253 2.224 2.276 . 0 0 "[ . 1]" 1
1208 1 46 ALA H 1 47 PRO QD 4.830 . 4.830 4.434 4.419 4.458 . 0 0 "[ . 1]" 1
1209 1 46 ALA HA 1 47 PRO QD 2.810 . 2.810 2.181 2.143 2.268 . 0 0 "[ . 1]" 1
1210 1 46 ALA HA 1 47 PRO QG 4.190 . 4.190 4.061 4.026 4.145 . 0 0 "[ . 1]" 1
1211 1 46 ALA MB 1 47 PRO HA 5.150 . 5.150 4.508 4.448 4.550 . 0 0 "[ . 1]" 1
1212 1 46 ALA MB 1 47 PRO QD 2.820 . 2.820 2.058 1.992 2.148 . 0 0 "[ . 1]" 1
1213 1 46 ALA MB 1 48 VAL HA 5.500 . 5.500 5.039 4.732 5.172 . 0 0 "[ . 1]" 1
1214 1 46 ALA MB 1 48 VAL QG 5.120 . 5.120 5.003 4.760 5.209 0.089 1 0 "[ . 1]" 1
1215 1 46 ALA MB 1 71 TRP HZ3 5.500 . 5.500 5.086 4.917 5.337 . 0 0 "[ . 1]" 1
1216 1 47 PRO HA 1 48 VAL H 2.720 . 2.720 2.169 2.113 2.250 . 0 0 "[ . 1]" 1
1217 1 47 PRO HA 1 48 VAL QG 3.970 . 3.970 3.471 3.272 3.671 . 0 0 "[ . 1]" 1
1218 1 47 PRO HB2 1 48 VAL H 3.780 . 3.780 3.277 3.048 3.391 . 0 0 "[ . 1]" 1
1219 1 47 PRO HB2 1 48 VAL HA 5.500 . 5.500 4.702 4.622 4.781 . 0 0 "[ . 1]" 1
1220 1 47 PRO HB2 1 48 VAL QG 5.500 . 5.500 4.678 4.537 4.781 . 0 0 "[ . 1]" 1
1221 1 47 PRO HB3 1 48 VAL H 4.270 . 4.270 3.688 3.549 3.776 . 0 0 "[ . 1]" 1
1222 1 47 PRO QG 1 48 VAL H 4.700 . 4.700 4.594 4.486 4.642 . 0 0 "[ . 1]" 1
1223 1 48 VAL H 1 48 VAL HB 2.900 . 2.900 2.564 2.435 2.765 . 0 0 "[ . 1]" 1
1224 1 48 VAL H 1 48 VAL QG 2.740 . 2.740 2.131 1.999 2.238 . 0 0 "[ . 1]" 1
1225 1 48 VAL H 1 49 GLY H 4.740 . 4.740 4.452 4.355 4.538 . 0 0 "[ . 1]" 1
1226 1 48 VAL HA 1 48 VAL QG 2.680 . 2.680 2.190 2.141 2.307 . 0 0 "[ . 1]" 1
1227 1 48 VAL HA 1 49 GLY H 2.810 . 2.810 2.119 2.067 2.171 . 0 0 "[ . 1]" 1
1228 1 48 VAL HA 1 49 GLY QA 4.450 . 4.450 3.880 3.850 3.917 . 0 0 "[ . 1]" 1
1229 1 48 VAL HB 1 49 GLY H 4.100 . 4.100 4.114 4.031 4.153 0.053 9 0 "[ . 1]" 1
1230 1 48 VAL HB 1 50 GLY H 4.610 . 4.610 4.095 3.652 4.555 . 0 0 "[ . 1]" 1
1231 1 48 VAL QG 1 49 GLY H 3.180 . 3.180 2.651 2.500 2.878 . 0 0 "[ . 1]" 1
1232 1 48 VAL QG 1 49 GLY HA2 4.830 . 4.830 3.892 3.709 4.011 . 0 0 "[ . 1]" 1
1233 1 48 VAL QG 1 49 GLY QA 4.060 . 4.060 3.534 3.394 3.638 . 0 0 "[ . 1]" 1
1234 1 48 VAL QG 1 49 GLY HA3 4.830 . 4.830 4.055 3.933 4.213 . 0 0 "[ . 1]" 1
1235 1 48 VAL QG 1 50 GLY H 2.950 . 2.950 1.833 1.673 2.030 . 0 0 "[ . 1]" 1
1236 1 48 VAL QG 1 50 GLY HA2 4.370 . 4.370 2.622 2.423 2.836 . 0 0 "[ . 1]" 1
1237 1 48 VAL QG 1 50 GLY QA 3.660 . 3.660 2.572 2.389 2.768 . 0 0 "[ . 1]" 1
1238 1 48 VAL QG 1 50 GLY HA3 4.370 . 4.370 3.738 3.637 3.860 . 0 0 "[ . 1]" 1
1239 1 48 VAL QG 1 51 ASN HA 4.720 . 4.720 4.243 3.938 4.375 . 0 0 "[ . 1]" 1
1240 1 48 VAL QG 1 51 ASN QB 5.340 . 5.340 4.723 3.813 5.064 . 0 0 "[ . 1]" 1
1241 1 48 VAL QG 1 51 ASN HD21 4.630 . 4.630 3.506 3.155 4.733 0.103 5 0 "[ . 1]" 1
1242 1 48 VAL QG 1 51 ASN HD22 4.630 . 4.630 3.737 3.317 4.766 0.136 9 0 "[ . 1]" 1
1243 1 49 GLY H 1 50 GLY H 3.510 . 3.510 2.223 2.167 2.369 . 0 0 "[ . 1]" 1
1244 1 49 GLY QA 1 82 VAL QG 3.990 . 3.990 2.882 2.539 3.142 . 0 0 "[ . 1]" 1
1245 1 49 GLY HA2 1 82 VAL MG1 6.230 . 6.230 4.546 4.107 4.907 . 0 0 "[ . 1]" 1
1246 1 49 GLY HA2 1 82 VAL MG2 6.230 . 6.230 4.568 4.158 4.906 . 0 0 "[ . 1]" 1
1247 1 49 GLY HA3 1 82 VAL MG1 6.230 . 6.230 3.119 2.688 3.453 . 0 0 "[ . 1]" 1
1248 1 49 GLY HA3 1 82 VAL MG2 6.230 . 6.230 3.648 3.369 3.851 . 0 0 "[ . 1]" 1
1249 1 50 GLY H 1 82 VAL QG 5.440 . 5.440 4.691 4.538 4.911 . 0 0 "[ . 1]" 1
1250 1 51 ASN HA 1 52 LEU H 2.920 . 2.920 2.067 1.985 2.124 . 0 0 "[ . 1]" 1
1251 1 51 ASN HA 1 52 LEU HB2 4.910 . 4.910 4.401 4.272 4.503 . 0 0 "[ . 1]" 1
1252 1 51 ASN HA 1 52 LEU HB3 4.810 . 4.810 4.473 4.377 4.566 . 0 0 "[ . 1]" 1
1253 1 51 ASN QB 1 52 LEU H 3.600 . 3.600 3.081 2.811 3.350 . 0 0 "[ . 1]" 1
1254 1 51 ASN QB 1 53 PRO HA 5.340 . 5.340 4.594 4.286 4.964 . 0 0 "[ . 1]" 1
1255 1 51 ASN HB2 1 52 LEU H 4.390 . 4.390 3.984 2.901 4.316 . 0 0 "[ . 1]" 1
1256 1 51 ASN HB3 1 52 LEU H 4.390 . 4.390 3.324 2.931 4.060 . 0 0 "[ . 1]" 1
1257 1 52 LEU H 1 52 LEU HB2 3.600 . 3.600 2.577 2.452 2.648 . 0 0 "[ . 1]" 1
1258 1 52 LEU H 1 52 LEU HB3 3.370 . 3.370 2.434 2.408 2.497 . 0 0 "[ . 1]" 1
1259 1 52 LEU H 1 52 LEU MD1 4.440 . 4.440 4.141 4.023 4.207 . 0 0 "[ . 1]" 1
1260 1 52 LEU H 1 52 LEU QD 3.840 . 3.840 3.725 3.661 3.759 . 0 0 "[ . 1]" 1
1261 1 52 LEU H 1 52 LEU MD2 4.440 . 4.440 4.226 4.210 4.249 . 0 0 "[ . 1]" 1
1262 1 52 LEU H 1 53 PRO HD3 4.990 . 4.990 4.655 4.487 4.731 . 0 0 "[ . 1]" 1
1263 1 52 LEU HA 1 52 LEU MD1 4.390 . 4.390 2.190 2.078 2.245 . 0 0 "[ . 1]" 1
1264 1 52 LEU HA 1 52 LEU QD 3.000 . 3.000 2.178 2.070 2.232 . 0 0 "[ . 1]" 1
1265 1 52 LEU HA 1 52 LEU MD2 4.390 . 4.390 3.882 3.839 3.906 . 0 0 "[ . 1]" 1
1266 1 52 LEU HA 1 53 PRO HB2 5.500 . 5.500 5.232 5.017 5.317 . 0 0 "[ . 1]" 1
1267 1 52 LEU HA 1 53 PRO HB3 5.010 . 5.010 5.111 5.089 5.178 0.168 8 0 "[ . 1]" 1
1268 1 52 LEU HA 1 53 PRO HD2 3.300 . 3.300 2.076 1.958 2.346 . 0 0 "[ . 1]" 1
1269 1 52 LEU HA 1 53 PRO HD3 3.080 . 3.080 2.235 1.902 2.338 . 0 0 "[ . 1]" 1
1270 1 52 LEU HA 1 56 ALA MB 4.440 . 4.440 4.062 3.878 4.202 . 0 0 "[ . 1]" 1
1271 1 52 LEU HB2 1 52 LEU MD1 3.190 . 3.190 2.260 2.241 2.293 . 0 0 "[ . 1]" 1
1272 1 52 LEU HB2 1 52 LEU QD 2.670 . 2.670 2.125 2.110 2.150 . 0 0 "[ . 1]" 1
1273 1 52 LEU HB2 1 52 LEU MD2 3.190 . 3.190 2.583 2.520 2.609 . 0 0 "[ . 1]" 1
1274 1 52 LEU HB2 1 53 PRO HD2 4.810 . 4.810 3.984 3.940 4.160 . 0 0 "[ . 1]" 1
1275 1 52 LEU HB2 1 53 PRO HD3 5.500 . 5.500 4.694 4.360 4.831 . 0 0 "[ . 1]" 1
1276 1 52 LEU HB2 1 58 ILE MD 4.720 . 4.720 4.184 3.979 4.271 . 0 0 "[ . 1]" 1
1277 1 52 LEU HB2 1 58 ILE HG13 5.000 . 5.000 4.672 4.452 4.833 . 0 0 "[ . 1]" 1
1278 1 52 LEU HB3 1 52 LEU MD1 3.400 . 3.400 3.167 3.149 3.185 . 0 0 "[ . 1]" 1
1279 1 52 LEU HB3 1 52 LEU QD 2.910 . 2.910 2.180 2.163 2.193 . 0 0 "[ . 1]" 1
1280 1 52 LEU HB3 1 52 LEU MD2 3.400 . 3.400 2.222 2.203 2.236 . 0 0 "[ . 1]" 1
1281 1 52 LEU HB3 1 52 LEU HG 2.880 . 2.880 2.564 2.536 2.583 . 0 0 "[ . 1]" 1
1282 1 52 LEU HB3 1 53 PRO HD2 4.910 . 4.910 4.287 4.223 4.385 . 0 0 "[ . 1]" 1
1283 1 52 LEU HB3 1 53 PRO HD3 5.500 . 5.500 4.951 4.713 5.036 . 0 0 "[ . 1]" 1
1284 1 52 LEU QD 1 53 PRO HA 4.690 . 4.690 4.701 4.679 4.734 0.044 2 0 "[ . 1]" 1
1285 1 52 LEU QD 1 53 PRO HB3 5.440 . 5.440 5.115 5.088 5.164 . 0 0 "[ . 1]" 1
1286 1 52 LEU QD 1 53 PRO HD2 2.990 . 2.990 1.927 1.882 1.992 . 0 0 "[ . 1]" 1
1287 1 52 LEU QD 1 53 PRO HD3 3.470 . 3.470 3.219 2.748 3.362 . 0 0 "[ . 1]" 1
1288 1 52 LEU QD 1 53 PRO HG2 3.660 . 3.660 3.471 3.374 3.669 0.009 8 0 "[ . 1]" 1
1289 1 52 LEU QD 1 53 PRO HG3 4.230 . 4.230 4.244 4.225 4.279 0.049 8 0 "[ . 1]" 1
1290 1 52 LEU QD 1 55 GLY H 4.970 . 4.970 4.664 4.390 4.853 . 0 0 "[ . 1]" 1
1291 1 52 LEU QD 1 56 ALA H 3.910 . 3.910 3.659 3.551 3.814 . 0 0 "[ . 1]" 1
1292 1 52 LEU QD 1 56 ALA HA 5.030 . 5.030 4.214 4.088 4.328 . 0 0 "[ . 1]" 1
1293 1 52 LEU QD 1 56 ALA MB 2.510 . 2.510 1.985 1.882 2.090 . 0 0 "[ . 1]" 1
1294 1 52 LEU QD 1 57 THR H 4.600 . 4.600 4.339 4.129 4.580 . 0 0 "[ . 1]" 1
1295 1 52 LEU QD 1 57 THR HA 5.440 . 5.440 4.659 4.513 4.766 . 0 0 "[ . 1]" 1
1296 1 52 LEU QD 1 58 ILE H 4.940 . 4.940 4.176 4.082 4.357 . 0 0 "[ . 1]" 1
1297 1 52 LEU QD 1 58 ILE HB 5.150 . 5.150 3.649 3.511 3.749 . 0 0 "[ . 1]" 1
1298 1 52 LEU QD 1 58 ILE MD 3.020 . 3.020 1.920 1.890 1.970 . 0 0 "[ . 1]" 1
1299 1 52 LEU QD 1 58 ILE HG12 2.780 . 2.780 2.293 2.211 2.399 . 0 0 "[ . 1]" 1
1300 1 52 LEU QD 1 58 ILE HG13 2.930 . 2.930 2.280 2.173 2.351 . 0 0 "[ . 1]" 1
1301 1 52 LEU QD 1 58 ILE MG 4.180 . 4.180 3.626 3.523 3.691 . 0 0 "[ . 1]" 1
1302 1 52 LEU QD 1 74 TYR QE 4.510 . 4.510 3.786 3.650 4.129 . 0 0 "[ . 1]" 1
1303 1 52 LEU QD 1 84 CYS HB2 4.910 . 4.910 3.571 3.412 3.863 . 0 0 "[ . 1]" 1
1304 1 52 LEU MD1 1 53 PRO HB2 5.420 . 5.420 4.853 4.544 5.046 . 0 0 "[ . 1]" 1
1305 1 52 LEU MD1 1 53 PRO HD2 4.310 . 4.310 1.931 1.885 1.997 . 0 0 "[ . 1]" 1
1306 1 52 LEU MD1 1 56 ALA H 4.470 . 4.470 4.472 4.426 4.503 0.033 9 0 "[ . 1]" 1
1307 1 52 LEU MD1 1 56 ALA MB 3.080 . 3.080 2.099 2.028 2.165 . 0 0 "[ . 1]" 1
1308 1 52 LEU MD2 1 53 PRO HB2 5.420 . 5.420 5.531 5.503 5.546 0.126 2 0 "[ . 1]" 1
1309 1 52 LEU MD2 1 53 PRO HD2 4.310 . 4.310 4.060 3.995 4.187 . 0 0 "[ . 1]" 1
1310 1 52 LEU MD2 1 56 ALA H 4.470 . 4.470 3.886 3.723 4.135 . 0 0 "[ . 1]" 1
1311 1 52 LEU MD2 1 56 ALA MB 3.080 . 3.080 2.464 2.169 2.804 . 0 0 "[ . 1]" 1
1312 1 52 LEU HG 1 53 PRO HA 5.500 . 5.500 4.444 4.393 4.515 . 0 0 "[ . 1]" 1
1313 1 52 LEU HG 1 53 PRO HD2 4.180 . 4.180 2.587 2.502 2.761 . 0 0 "[ . 1]" 1
1314 1 52 LEU HG 1 53 PRO HD3 5.500 . 5.500 3.948 3.788 4.110 . 0 0 "[ . 1]" 1
1315 1 52 LEU HG 1 56 ALA H 5.080 . 5.080 3.962 3.817 4.054 . 0 0 "[ . 1]" 1
1316 1 52 LEU HG 1 56 ALA MB 3.500 . 3.500 2.280 2.128 2.396 . 0 0 "[ . 1]" 1
1317 1 53 PRO HA 1 54 ALA H 2.750 . 2.750 2.222 2.158 2.257 . 0 0 "[ . 1]" 1
1318 1 53 PRO HA 1 54 ALA MB 4.890 . 4.890 3.999 3.952 4.017 . 0 0 "[ . 1]" 1
1319 1 53 PRO HB2 1 54 ALA H 3.650 . 3.650 3.174 3.011 3.438 . 0 0 "[ . 1]" 1
1320 1 53 PRO HB2 1 54 ALA MB 5.410 . 5.410 4.458 4.371 4.700 . 0 0 "[ . 1]" 1
1321 1 53 PRO HB2 1 55 GLY QA 5.500 . 5.500 4.915 4.751 5.098 . 0 0 "[ . 1]" 1
1322 1 53 PRO HB2 1 56 ALA H 4.570 . 4.570 3.849 3.419 4.103 . 0 0 "[ . 1]" 1
1323 1 53 PRO HB2 1 56 ALA MB 3.610 . 3.610 2.753 2.181 2.978 . 0 0 "[ . 1]" 1
1324 1 53 PRO HB3 1 54 ALA H 4.140 . 4.140 3.407 3.254 3.492 . 0 0 "[ . 1]" 1
1325 1 53 PRO HB3 1 56 ALA MB 4.540 . 4.540 4.077 3.702 4.242 . 0 0 "[ . 1]" 1
1326 1 53 PRO HD2 1 56 ALA H 5.170 . 5.170 5.108 4.604 5.193 0.023 7 0 "[ . 1]" 1
1327 1 53 PRO HD2 1 56 ALA MB 2.980 . 2.980 2.712 2.306 2.903 . 0 0 "[ . 1]" 1
1328 1 53 PRO HD2 1 58 ILE MD 5.100 . 5.100 4.754 4.585 4.884 . 0 0 "[ . 1]" 1
1329 1 53 PRO HD3 1 56 ALA MB 4.140 . 4.140 3.986 3.685 4.148 0.008 1 0 "[ . 1]" 1
1330 1 53 PRO HG2 1 56 ALA H 5.010 . 5.010 4.428 4.106 4.870 . 0 0 "[ . 1]" 1
1331 1 53 PRO HG2 1 56 ALA MB 3.160 . 3.160 2.042 1.942 2.371 . 0 0 "[ . 1]" 1
1332 1 53 PRO HG3 1 56 ALA MB 3.710 . 3.710 3.594 3.517 3.731 0.021 8 0 "[ . 1]" 1
1333 1 54 ALA H 1 54 ALA MB 2.680 . 2.680 2.206 2.182 2.222 . 0 0 "[ . 1]" 1
1334 1 54 ALA H 1 56 ALA MB 5.100 . 5.100 4.748 4.547 4.900 . 0 0 "[ . 1]" 1
1335 1 54 ALA HA 1 55 GLY H 2.830 . 2.830 2.196 2.135 2.235 . 0 0 "[ . 1]" 1
1336 1 54 ALA HA 1 55 GLY QA 4.210 . 4.210 3.936 3.895 3.962 . 0 0 "[ . 1]" 1
1337 1 54 ALA MB 1 55 GLY H 3.530 . 3.530 3.070 2.895 3.275 . 0 0 "[ . 1]" 1
1338 1 54 ALA MB 1 55 GLY QA 3.870 . 3.870 3.725 3.665 3.787 . 0 0 "[ . 1]" 1
1339 1 54 ALA MB 1 56 ALA H 5.010 . 5.010 4.482 4.406 4.552 . 0 0 "[ . 1]" 1
1340 1 55 GLY H 1 56 ALA H 3.620 . 3.620 2.456 2.302 2.667 . 0 0 "[ . 1]" 1
1341 1 55 GLY H 1 56 ALA MB 4.510 . 4.510 4.213 3.995 4.416 . 0 0 "[ . 1]" 1
1342 1 55 GLY QA 1 56 ALA H 3.480 . 3.480 2.913 2.836 2.938 . 0 0 "[ . 1]" 1
1343 1 55 GLY QA 1 56 ALA HA 4.590 . 4.590 4.058 4.015 4.099 . 0 0 "[ . 1]" 1
1344 1 55 GLY QA 1 56 ALA MB 4.470 . 4.470 4.246 4.193 4.261 . 0 0 "[ . 1]" 1
1345 1 56 ALA H 1 56 ALA MB 2.740 . 2.740 2.263 2.205 2.304 . 0 0 "[ . 1]" 1
1346 1 56 ALA H 1 57 THR H 4.820 . 4.820 4.571 4.530 4.630 . 0 0 "[ . 1]" 1
1347 1 56 ALA HA 1 57 THR H 2.640 . 2.640 2.203 2.116 2.301 . 0 0 "[ . 1]" 1
1348 1 56 ALA HA 1 57 THR HA 4.690 . 4.690 4.303 4.238 4.359 . 0 0 "[ . 1]" 1
1349 1 56 ALA HA 1 57 THR MG 4.940 . 4.940 4.248 3.640 5.040 0.100 9 0 "[ . 1]" 1
1350 1 56 ALA MB 1 57 THR H 3.070 . 3.070 2.715 2.619 2.901 . 0 0 "[ . 1]" 1
1351 1 56 ALA MB 1 57 THR HA 4.340 . 4.340 4.187 4.125 4.263 . 0 0 "[ . 1]" 1
1352 1 56 ALA MB 1 57 THR HB 5.500 . 5.500 5.248 4.796 5.554 0.054 1 0 "[ . 1]" 1
1353 1 56 ALA MB 1 58 ILE H 4.800 . 4.800 4.566 4.412 4.767 . 0 0 "[ . 1]" 1
1354 1 56 ALA MB 1 58 ILE MD 4.210 . 4.210 3.615 3.450 3.941 . 0 0 "[ . 1]" 1
1355 1 56 ALA MB 1 58 ILE HG13 5.370 . 5.370 4.259 4.010 4.441 . 0 0 "[ . 1]" 1
1356 1 56 ALA MB 1 58 ILE MG 5.500 . 5.500 5.350 5.198 5.527 0.027 5 0 "[ . 1]" 1
1357 1 57 THR H 1 57 THR HB 3.710 . 3.710 3.186 2.569 3.622 . 0 0 "[ . 1]" 1
1358 1 57 THR H 1 57 THR MG 3.650 . 3.650 3.143 2.741 3.683 0.033 9 0 "[ . 1]" 1
1359 1 57 THR H 1 58 ILE MD 5.180 . 5.180 4.923 4.729 5.174 . 0 0 "[ . 1]" 1
1360 1 57 THR HA 1 57 THR MG 2.790 . 2.790 2.212 2.111 2.269 . 0 0 "[ . 1]" 1
1361 1 57 THR HA 1 58 ILE H 2.800 . 2.800 2.137 2.085 2.201 . 0 0 "[ . 1]" 1
1362 1 57 THR HA 1 58 ILE HB 4.630 . 4.630 4.408 4.345 4.490 . 0 0 "[ . 1]" 1
1363 1 57 THR HA 1 58 ILE HG12 5.020 . 5.020 4.146 4.004 4.270 . 0 0 "[ . 1]" 1
1364 1 57 THR HB 1 58 ILE H 4.200 . 4.200 3.829 3.494 4.226 0.026 4 0 "[ . 1]" 1
1365 1 57 THR MG 1 58 ILE H 3.980 . 3.980 3.579 3.005 3.993 0.013 6 0 "[ . 1]" 1
1366 1 57 THR MG 1 106 LYS QD 5.500 . 5.500 4.372 3.850 4.761 . 0 0 "[ . 1]" 1
1367 1 58 ILE H 1 58 ILE HB 3.480 . 3.480 2.377 2.314 2.435 . 0 0 "[ . 1]" 1
1368 1 58 ILE H 1 58 ILE MD 4.090 . 4.090 3.964 3.894 4.092 0.002 5 0 "[ . 1]" 1
1369 1 58 ILE H 1 58 ILE HG13 4.190 . 4.190 4.038 3.963 4.169 . 0 0 "[ . 1]" 1
1370 1 58 ILE H 1 58 ILE MG 3.790 . 3.790 3.700 3.681 3.729 . 0 0 "[ . 1]" 1
1371 1 58 ILE H 1 59 VAL H 4.700 . 4.700 4.381 4.288 4.468 . 0 0 "[ . 1]" 1
1372 1 58 ILE HA 1 58 ILE MD 3.050 . 3.050 2.040 2.013 2.072 . 0 0 "[ . 1]" 1
1373 1 58 ILE HA 1 58 ILE HG12 3.590 . 3.590 2.800 2.768 2.823 . 0 0 "[ . 1]" 1
1374 1 58 ILE HA 1 58 ILE HG13 3.810 . 3.810 3.707 3.698 3.714 . 0 0 "[ . 1]" 1
1375 1 58 ILE HA 1 58 ILE MG 3.260 . 3.260 2.555 2.523 2.597 . 0 0 "[ . 1]" 1
1376 1 58 ILE HA 1 59 VAL H 2.700 . 2.700 2.170 2.136 2.214 . 0 0 "[ . 1]" 1
1377 1 58 ILE HA 1 59 VAL HA 4.610 . 4.610 4.373 4.330 4.407 . 0 0 "[ . 1]" 1
1378 1 58 ILE HA 1 59 VAL HB 4.900 . 4.900 4.712 4.630 4.770 . 0 0 "[ . 1]" 1
1379 1 58 ILE HA 1 59 VAL QG 3.700 . 3.700 3.686 3.613 3.729 0.029 3 0 "[ . 1]" 1
1380 1 58 ILE HB 1 58 ILE MD 3.510 . 3.510 3.199 3.192 3.208 . 0 0 "[ . 1]" 1
1381 1 58 ILE HB 1 59 VAL H 4.280 . 4.280 4.253 4.168 4.286 0.006 8 0 "[ . 1]" 1
1382 1 58 ILE HB 1 60 TYR QE 5.500 . 5.500 5.329 5.207 5.433 . 0 0 "[ . 1]" 1
1383 1 58 ILE MD 1 58 ILE MG 2.760 . 2.760 1.908 1.874 1.935 . 0 0 "[ . 1]" 1
1384 1 58 ILE MD 1 59 VAL H 3.650 . 3.650 3.427 3.329 3.472 . 0 0 "[ . 1]" 1
1385 1 58 ILE MD 1 60 TYR HA 5.500 . 5.500 5.532 5.511 5.546 0.046 6 0 "[ . 1]" 1
1386 1 58 ILE MD 1 72 ILE MD 3.570 . 3.570 3.661 3.645 3.686 0.116 8 0 "[ . 1]" 1
1387 1 58 ILE MD 1 72 ILE HG13 5.500 . 5.500 5.222 5.128 5.268 . 0 0 "[ . 1]" 1
1388 1 58 ILE MD 1 74 TYR HB2 5.010 . 5.010 4.566 4.228 4.855 . 0 0 "[ . 1]" 1
1389 1 58 ILE MD 1 74 TYR QD 3.870 . 3.870 3.468 3.280 3.685 . 0 0 "[ . 1]" 1
1390 1 58 ILE MD 1 74 TYR QE 3.770 . 3.770 2.793 2.642 2.937 . 0 0 "[ . 1]" 1
1391 1 58 ILE MD 1 84 CYS HB2 4.480 . 4.480 4.487 4.387 4.515 0.035 9 0 "[ . 1]" 1
1392 1 58 ILE MD 1 84 CYS HB3 5.500 . 5.500 4.922 4.762 5.004 . 0 0 "[ . 1]" 1
1393 1 58 ILE HG12 1 58 ILE MG 3.280 . 3.280 3.200 3.194 3.205 . 0 0 "[ . 1]" 1
1394 1 58 ILE HG12 1 59 VAL H 4.850 . 4.850 4.861 4.845 4.877 0.027 2 0 "[ . 1]" 1
1395 1 58 ILE HG13 1 58 ILE MG 3.420 . 3.420 2.417 2.379 2.427 . 0 0 "[ . 1]" 1
1396 1 58 ILE HG13 1 59 VAL H 5.380 . 5.380 5.355 5.212 5.398 0.018 8 0 "[ . 1]" 1
1397 1 58 ILE HG13 1 72 ILE MD 4.450 . 4.450 3.068 2.960 3.154 . 0 0 "[ . 1]" 1
1398 1 58 ILE HG13 1 74 TYR QE 4.770 . 4.770 3.863 3.812 4.000 . 0 0 "[ . 1]" 1
1399 1 58 ILE MG 1 59 VAL H 3.440 . 3.440 2.699 2.524 2.792 . 0 0 "[ . 1]" 1
1400 1 58 ILE MG 1 59 VAL HA 4.790 . 4.790 3.359 3.192 3.464 . 0 0 "[ . 1]" 1
1401 1 58 ILE MG 1 59 VAL HB 4.750 . 4.750 4.512 4.373 4.788 0.038 7 0 "[ . 1]" 1
1402 1 58 ILE MG 1 59 VAL QG 4.070 . 4.070 3.823 3.631 3.926 . 0 0 "[ . 1]" 1
1403 1 58 ILE MG 1 60 TYR H 4.020 . 4.020 3.270 3.229 3.311 . 0 0 "[ . 1]" 1
1404 1 58 ILE MG 1 60 TYR HA 3.950 . 3.950 3.459 3.391 3.560 . 0 0 "[ . 1]" 1
1405 1 58 ILE MG 1 60 TYR HB2 4.470 . 4.470 3.932 3.818 4.055 . 0 0 "[ . 1]" 1
1406 1 58 ILE MG 1 60 TYR HB3 3.600 . 3.600 2.494 2.375 2.619 . 0 0 "[ . 1]" 1
1407 1 58 ILE MG 1 60 TYR QD 4.330 . 4.330 2.601 2.535 2.669 . 0 0 "[ . 1]" 1
1408 1 58 ILE MG 1 60 TYR QE 4.600 . 4.600 4.544 4.449 4.605 0.005 3 0 "[ . 1]" 1
1409 1 58 ILE MG 1 61 ASP H 5.500 . 5.500 5.230 5.154 5.333 . 0 0 "[ . 1]" 1
1410 1 58 ILE MG 1 72 ILE HB 4.770 . 4.770 3.893 3.817 3.962 . 0 0 "[ . 1]" 1
1411 1 58 ILE MG 1 72 ILE MG 4.560 . 4.560 4.173 4.121 4.253 . 0 0 "[ . 1]" 1
1412 1 58 ILE MG 1 74 TYR HB2 4.280 . 4.280 3.608 3.342 3.976 . 0 0 "[ . 1]" 1
1413 1 58 ILE MG 1 74 TYR HB3 4.180 . 4.180 3.188 2.938 3.474 . 0 0 "[ . 1]" 1
1414 1 58 ILE MG 1 74 TYR QD 3.570 . 3.570 2.795 2.705 2.914 . 0 0 "[ . 1]" 1
1415 1 58 ILE MG 1 74 TYR QE 3.930 . 3.930 2.899 2.799 3.023 . 0 0 "[ . 1]" 1
1416 1 58 ILE MG 1 86 VAL QG 4.980 . 4.980 4.472 4.362 4.570 . 0 0 "[ . 1]" 1
1417 1 59 VAL H 1 59 VAL HB 3.340 . 3.340 2.708 2.515 3.155 . 0 0 "[ . 1]" 1
1418 1 59 VAL H 1 59 VAL MG1 3.940 . 3.940 3.286 2.029 3.830 . 0 0 "[ . 1]" 1
1419 1 59 VAL H 1 59 VAL QG 2.860 . 2.860 2.321 2.022 2.533 . 0 0 "[ . 1]" 1
1420 1 59 VAL H 1 59 VAL MG2 3.940 . 3.940 2.881 2.360 3.877 . 0 0 "[ . 1]" 1
1421 1 59 VAL H 1 60 TYR H 4.510 . 4.510 4.279 4.209 4.326 . 0 0 "[ . 1]" 1
1422 1 59 VAL HA 1 59 VAL MG1 3.220 . 3.220 2.643 2.370 3.244 0.024 6 0 "[ . 1]" 1
1423 1 59 VAL HA 1 59 VAL MG2 3.220 . 3.220 2.444 2.392 2.496 . 0 0 "[ . 1]" 1
1424 1 59 VAL HA 1 60 TYR H 3.030 . 3.030 2.150 2.124 2.169 . 0 0 "[ . 1]" 1
1425 1 59 VAL HB 1 60 TYR H 4.730 . 4.730 4.261 4.217 4.306 . 0 0 "[ . 1]" 1
1426 1 59 VAL QG 1 60 TYR H 3.610 . 3.610 2.870 2.803 2.904 . 0 0 "[ . 1]" 1
1427 1 59 VAL QG 1 60 TYR HA 4.300 . 4.300 3.660 3.514 3.772 . 0 0 "[ . 1]" 1
1428 1 59 VAL QG 1 60 TYR QD 5.040 . 5.040 4.604 4.538 4.640 . 0 0 "[ . 1]" 1
1429 1 59 VAL QG 1 74 TYR QD 5.440 . 5.440 5.297 4.731 5.563 0.123 8 0 "[ . 1]" 1
1430 1 59 VAL MG1 1 60 TYR H 4.480 . 4.480 3.290 2.850 4.159 . 0 0 "[ . 1]" 1
1431 1 59 VAL MG1 1 60 TYR HA 5.500 . 5.500 3.868 3.672 4.145 . 0 0 "[ . 1]" 1
1432 1 59 VAL MG2 1 60 TYR H 4.480 . 4.480 3.802 2.920 4.233 . 0 0 "[ . 1]" 1
1433 1 59 VAL MG2 1 60 TYR HA 5.500 . 5.500 4.999 3.851 5.499 . 0 0 "[ . 1]" 1
1434 1 60 TYR H 1 60 TYR HB3 3.980 . 3.980 3.133 3.081 3.174 . 0 0 "[ . 1]" 1
1435 1 60 TYR H 1 60 TYR QD 4.100 . 4.100 2.775 2.741 2.816 . 0 0 "[ . 1]" 1
1436 1 60 TYR H 1 60 TYR QE 4.480 . 4.480 4.252 4.195 4.301 . 0 0 "[ . 1]" 1
1437 1 60 TYR H 1 74 TYR HB3 4.430 . 4.430 4.458 4.424 4.518 0.088 6 0 "[ . 1]" 1
1438 1 60 TYR HA 1 60 TYR QD 4.540 . 4.540 3.768 3.759 3.776 . 0 0 "[ . 1]" 1
1439 1 60 TYR HA 1 61 ASP H 3.280 . 3.280 2.417 2.366 2.489 . 0 0 "[ . 1]" 1
1440 1 60 TYR HA 1 62 GLU H 4.110 . 4.110 4.036 3.927 4.116 0.006 5 0 "[ . 1]" 1
1441 1 60 TYR HA 1 72 ILE HB 4.790 . 4.790 4.628 4.556 4.720 . 0 0 "[ . 1]" 1
1442 1 60 TYR HA 1 73 GLY H 5.500 . 5.500 5.300 5.168 5.500 0.000 4 0 "[ . 1]" 1
1443 1 60 TYR HA 1 74 TYR HA 4.540 . 4.540 3.247 3.130 3.496 . 0 0 "[ . 1]" 1
1444 1 60 TYR HA 1 74 TYR HB2 3.640 . 3.640 2.925 2.647 3.120 . 0 0 "[ . 1]" 1
1445 1 60 TYR HA 1 74 TYR HB3 3.410 . 3.410 1.890 1.799 2.024 . 0 0 "[ . 1]" 1
1446 1 60 TYR HA 1 74 TYR QD 4.180 . 4.180 3.789 3.612 3.940 . 0 0 "[ . 1]" 1
1447 1 60 TYR HB2 1 61 ASP H 3.590 . 3.590 2.353 2.174 2.437 . 0 0 "[ . 1]" 1
1448 1 60 TYR HB2 1 62 GLU H 3.890 . 3.890 2.527 2.478 2.554 . 0 0 "[ . 1]" 1
1449 1 60 TYR HB2 1 72 ILE HA 4.320 . 4.320 4.065 4.000 4.109 . 0 0 "[ . 1]" 1
1450 1 60 TYR HB2 1 72 ILE HB 3.800 . 3.800 2.509 2.439 2.589 . 0 0 "[ . 1]" 1
1451 1 60 TYR HB2 1 72 ILE MD 3.960 . 3.960 3.505 3.431 3.589 . 0 0 "[ . 1]" 1
1452 1 60 TYR HB2 1 72 ILE HG13 4.980 . 4.980 4.386 4.323 4.458 . 0 0 "[ . 1]" 1
1453 1 60 TYR HB2 1 72 ILE MG 4.380 . 4.380 3.859 3.765 3.981 . 0 0 "[ . 1]" 1
1454 1 60 TYR HB2 1 73 GLY H 4.350 . 4.350 3.115 2.995 3.282 . 0 0 "[ . 1]" 1
1455 1 60 TYR HB2 1 73 GLY HA3 5.090 . 5.090 4.531 4.436 4.622 . 0 0 "[ . 1]" 1
1456 1 60 TYR HB2 1 74 TYR HB2 4.990 . 4.990 4.584 4.269 4.767 . 0 0 "[ . 1]" 1
1457 1 60 TYR HB2 1 74 TYR HB3 4.500 . 4.500 2.889 2.628 3.068 . 0 0 "[ . 1]" 1
1458 1 60 TYR HB3 1 61 ASP H 4.170 . 4.170 3.716 3.603 3.761 . 0 0 "[ . 1]" 1
1459 1 60 TYR HB3 1 62 GLU H 4.640 . 4.640 4.252 4.205 4.284 . 0 0 "[ . 1]" 1
1460 1 60 TYR HB3 1 72 ILE HA 4.760 . 4.760 4.790 4.766 4.810 0.050 4 0 "[ . 1]" 1
1461 1 60 TYR HB3 1 72 ILE HB 3.970 . 3.970 2.492 2.450 2.549 . 0 0 "[ . 1]" 1
1462 1 60 TYR HB3 1 72 ILE MD 3.410 . 3.410 2.229 2.132 2.289 . 0 0 "[ . 1]" 1
1463 1 60 TYR HB3 1 72 ILE HG12 4.980 . 4.980 4.741 4.672 4.771 . 0 0 "[ . 1]" 1
1464 1 60 TYR HB3 1 72 ILE HG13 4.610 . 4.610 3.802 3.733 3.897 . 0 0 "[ . 1]" 1
1465 1 60 TYR HB3 1 72 ILE MG 4.290 . 4.290 3.731 3.651 3.846 . 0 0 "[ . 1]" 1
1466 1 60 TYR HB3 1 73 GLY H 5.250 . 5.250 4.371 4.279 4.513 . 0 0 "[ . 1]" 1
1467 1 60 TYR HB3 1 74 TYR HB2 4.740 . 4.740 4.265 3.944 4.500 . 0 0 "[ . 1]" 1
1468 1 60 TYR HB3 1 74 TYR HB3 4.650 . 4.650 2.658 2.423 2.864 . 0 0 "[ . 1]" 1
1469 1 60 TYR HB3 1 74 TYR QD 4.190 . 4.190 2.779 2.648 2.898 . 0 0 "[ . 1]" 1
1470 1 60 TYR QD 1 61 ASP H 4.310 . 4.310 3.204 3.014 3.278 . 0 0 "[ . 1]" 1
1471 1 60 TYR QD 1 61 ASP HA 4.700 . 4.700 3.677 3.535 3.789 . 0 0 "[ . 1]" 1
1472 1 60 TYR QD 1 62 GLU H 3.650 . 3.650 2.041 1.944 2.146 . 0 0 "[ . 1]" 1
1473 1 60 TYR QD 1 72 ILE HB 4.750 . 4.750 3.081 3.018 3.165 . 0 0 "[ . 1]" 1
1474 1 60 TYR QD 1 72 ILE MD 3.940 . 3.940 2.462 2.345 2.558 . 0 0 "[ . 1]" 1
1475 1 60 TYR QD 1 72 ILE MG 4.320 . 4.320 2.984 2.925 3.052 . 0 0 "[ . 1]" 1
1476 1 60 TYR QE 1 61 ASP H 5.500 . 5.500 5.434 5.273 5.491 . 0 0 "[ . 1]" 1
1477 1 60 TYR QE 1 62 GLU H 4.310 . 4.310 4.201 4.096 4.309 . 0 0 "[ . 1]" 1
1478 1 60 TYR QE 1 72 ILE HB 4.540 . 4.540 4.191 4.026 4.335 . 0 0 "[ . 1]" 1
1479 1 60 TYR QE 1 72 ILE MD 3.890 . 3.890 3.615 3.495 3.742 . 0 0 "[ . 1]" 1
1480 1 61 ASP H 1 61 ASP HB2 4.160 . 4.160 3.815 3.776 3.850 . 0 0 "[ . 1]" 1
1481 1 61 ASP H 1 61 ASP QB 3.560 . 3.560 2.950 2.907 3.034 . 0 0 "[ . 1]" 1
1482 1 61 ASP H 1 61 ASP HB3 4.160 . 4.160 3.071 3.016 3.184 . 0 0 "[ . 1]" 1
1483 1 61 ASP H 1 62 GLU H 3.040 . 3.040 2.043 1.979 2.098 . 0 0 "[ . 1]" 1
1484 1 61 ASP H 1 62 GLU HB2 4.740 . 4.740 4.207 4.070 4.280 . 0 0 "[ . 1]" 1
1485 1 61 ASP H 1 62 GLU HB3 4.560 . 4.560 4.013 3.867 4.195 . 0 0 "[ . 1]" 1
1486 1 61 ASP H 1 72 ILE HB 5.050 . 5.050 4.788 4.652 4.864 . 0 0 "[ . 1]" 1
1487 1 61 ASP H 1 74 TYR HA 4.590 . 4.590 3.019 2.911 3.182 . 0 0 "[ . 1]" 1
1488 1 61 ASP H 1 74 TYR HB3 4.340 . 4.340 3.272 3.100 3.538 . 0 0 "[ . 1]" 1
1489 1 61 ASP QB 1 62 GLU H 4.080 . 4.080 3.931 3.882 3.975 . 0 0 "[ . 1]" 1
1490 1 61 ASP QB 1 62 GLU HB2 4.340 . 4.340 4.145 4.037 4.214 . 0 0 "[ . 1]" 1
1491 1 61 ASP HB2 1 62 GLU H 4.760 . 4.760 4.406 4.367 4.454 . 0 0 "[ . 1]" 1
1492 1 61 ASP HB3 1 62 GLU H 4.760 . 4.760 4.420 4.344 4.505 . 0 0 "[ . 1]" 1
1493 1 62 GLU H 1 62 GLU HB2 3.640 . 3.640 3.241 3.181 3.292 . 0 0 "[ . 1]" 1
1494 1 62 GLU H 1 62 GLU HB3 3.870 . 3.870 2.869 2.825 2.937 . 0 0 "[ . 1]" 1
1495 1 62 GLU H 1 62 GLU HG2 4.940 . 4.940 4.522 4.482 4.622 . 0 0 "[ . 1]" 1
1496 1 62 GLU H 1 62 GLU HG3 4.870 . 4.870 4.799 4.738 4.862 . 0 0 "[ . 1]" 1
1497 1 62 GLU H 1 63 VAL QG 5.170 . 5.170 3.996 3.857 4.067 . 0 0 "[ . 1]" 1
1498 1 62 GLU H 1 72 ILE HB 4.590 . 4.590 4.240 4.174 4.287 . 0 0 "[ . 1]" 1
1499 1 62 GLU H 1 72 ILE MD 5.500 . 5.500 5.569 5.550 5.586 0.086 3 0 "[ . 1]" 1
1500 1 62 GLU H 1 72 ILE MG 4.780 . 4.780 4.751 4.662 4.816 0.036 4 0 "[ . 1]" 1
1501 1 62 GLU H 1 73 GLY H 4.120 . 4.120 3.018 2.915 3.120 . 0 0 "[ . 1]" 1
1502 1 62 GLU HA 1 62 GLU HG2 3.620 . 3.620 2.984 2.911 3.088 . 0 0 "[ . 1]" 1
1503 1 62 GLU HA 1 62 GLU HG3 3.590 . 3.590 2.587 2.462 2.686 . 0 0 "[ . 1]" 1
1504 1 62 GLU HA 1 63 VAL H 3.050 . 3.050 2.256 2.231 2.299 . 0 0 "[ . 1]" 1
1505 1 62 GLU HA 1 63 VAL HA 4.480 . 4.480 4.455 4.422 4.478 . 0 0 "[ . 1]" 1
1506 1 62 GLU HA 1 63 VAL HB 4.980 . 4.980 4.869 4.789 4.932 . 0 0 "[ . 1]" 1
1507 1 62 GLU HA 1 63 VAL QG 4.200 . 4.200 3.416 3.357 3.499 . 0 0 "[ . 1]" 1
1508 1 62 GLU HB2 1 63 VAL H 5.010 . 5.010 4.062 4.028 4.137 . 0 0 "[ . 1]" 1
1509 1 62 GLU HB2 1 73 GLY H 5.180 . 5.180 4.450 4.373 4.583 . 0 0 "[ . 1]" 1
1510 1 62 GLU HB3 1 63 VAL H 3.990 . 3.990 3.777 3.645 3.862 . 0 0 "[ . 1]" 1
1511 1 62 GLU HB3 1 64 CYS H 5.500 . 5.500 5.524 5.502 5.539 0.039 5 0 "[ . 1]" 1
1512 1 62 GLU HB3 1 73 GLY H 4.610 . 4.610 2.862 2.764 3.051 . 0 0 "[ . 1]" 1
1513 1 62 GLU HB3 1 73 GLY HA3 4.490 . 4.490 2.411 2.294 2.599 . 0 0 "[ . 1]" 1
1514 1 62 GLU HG2 1 63 VAL H 3.610 . 3.610 2.393 2.243 2.667 . 0 0 "[ . 1]" 1
1515 1 62 GLU HG2 1 63 VAL HB 5.500 . 5.500 4.800 4.718 4.993 . 0 0 "[ . 1]" 1
1516 1 62 GLU HG2 1 63 VAL QG 5.110 . 5.110 4.238 4.145 4.384 . 0 0 "[ . 1]" 1
1517 1 62 GLU HG2 1 64 CYS HA 5.500 . 5.500 4.341 4.081 4.470 . 0 0 "[ . 1]" 1
1518 1 62 GLU HG2 1 72 ILE HA 5.500 . 5.500 5.069 4.946 5.441 . 0 0 "[ . 1]" 1
1519 1 62 GLU HG2 1 73 GLY H 4.810 . 4.810 4.059 3.937 4.312 . 0 0 "[ . 1]" 1
1520 1 62 GLU HG2 1 73 GLY HA3 5.480 . 5.480 4.102 3.876 4.308 . 0 0 "[ . 1]" 1
1521 1 62 GLU HG3 1 63 VAL H 3.630 . 3.630 2.941 2.848 3.041 . 0 0 "[ . 1]" 1
1522 1 62 GLU HG3 1 63 VAL HA 5.490 . 5.490 5.207 5.159 5.304 . 0 0 "[ . 1]" 1
1523 1 62 GLU HG3 1 63 VAL QG 4.870 . 4.870 4.821 4.742 4.897 0.027 7 0 "[ . 1]" 1
1524 1 63 VAL H 1 63 VAL HB 3.860 . 3.860 2.838 2.803 2.908 . 0 0 "[ . 1]" 1
1525 1 63 VAL H 1 63 VAL MG1 4.010 . 4.010 3.918 3.901 3.940 . 0 0 "[ . 1]" 1
1526 1 63 VAL H 1 63 VAL QG 3.150 . 3.150 2.546 2.501 2.593 . 0 0 "[ . 1]" 1
1527 1 63 VAL H 1 63 VAL MG2 4.010 . 4.010 2.580 2.531 2.629 . 0 0 "[ . 1]" 1
1528 1 63 VAL HA 1 63 VAL MG1 3.490 . 3.490 2.330 2.314 2.354 . 0 0 "[ . 1]" 1
1529 1 63 VAL HA 1 63 VAL QG 2.990 . 2.990 2.172 2.166 2.181 . 0 0 "[ . 1]" 1
1530 1 63 VAL HA 1 63 VAL MG2 3.490 . 3.490 2.596 2.556 2.618 . 0 0 "[ . 1]" 1
1531 1 63 VAL HA 1 64 CYS H 2.950 . 2.950 2.168 2.145 2.188 . 0 0 "[ . 1]" 1
1532 1 63 VAL HA 1 64 CYS HA 4.590 . 4.590 4.408 4.384 4.418 . 0 0 "[ . 1]" 1
1533 1 63 VAL HA 1 64 CYS QB 4.880 . 4.880 4.312 4.206 4.413 . 0 0 "[ . 1]" 1
1534 1 63 VAL HA 1 70 ILE MG 4.830 . 4.830 4.146 4.084 4.214 . 0 0 "[ . 1]" 1
1535 1 63 VAL HA 1 71 TRP H 4.760 . 4.760 4.349 4.305 4.416 . 0 0 "[ . 1]" 1
1536 1 63 VAL HA 1 72 ILE HA 3.340 . 3.340 2.199 2.156 2.265 . 0 0 "[ . 1]" 1
1537 1 63 VAL HA 1 72 ILE HB 4.810 . 4.810 4.336 4.291 4.370 . 0 0 "[ . 1]" 1
1538 1 63 VAL HA 1 72 ILE MG 3.800 . 3.800 3.198 3.094 3.396 . 0 0 "[ . 1]" 1
1539 1 63 VAL HA 1 73 GLY H 4.200 . 4.200 3.075 2.873 3.255 . 0 0 "[ . 1]" 1
1540 1 63 VAL HB 1 64 CYS H 4.290 . 4.290 3.839 3.779 3.877 . 0 0 "[ . 1]" 1
1541 1 63 VAL HB 1 70 ILE MG 4.160 . 4.160 4.091 4.066 4.124 . 0 0 "[ . 1]" 1
1542 1 63 VAL HB 1 71 TRP H 5.500 . 5.500 5.594 5.580 5.617 0.117 4 0 "[ . 1]" 1
1543 1 63 VAL HB 1 72 ILE HA 5.500 . 5.500 5.074 4.933 5.184 . 0 0 "[ . 1]" 1
1544 1 63 VAL HB 1 72 ILE MG 4.760 . 4.760 4.789 4.762 4.821 0.061 8 0 "[ . 1]" 1
1545 1 63 VAL QG 1 64 CYS H 3.400 . 3.400 2.497 2.444 2.559 . 0 0 "[ . 1]" 1
1546 1 63 VAL QG 1 64 CYS HA 4.140 . 4.140 3.774 3.730 3.871 . 0 0 "[ . 1]" 1
1547 1 63 VAL QG 1 65 ILE MD 4.050 . 4.050 4.075 4.042 4.093 0.043 1 0 "[ . 1]" 1
1548 1 63 VAL QG 1 70 ILE MD 3.560 . 3.560 3.542 3.462 3.581 0.021 2 0 "[ . 1]" 1
1549 1 63 VAL QG 1 70 ILE MG 2.760 . 2.760 1.988 1.964 2.006 . 0 0 "[ . 1]" 1
1550 1 63 VAL QG 1 71 TRP H 4.020 . 4.020 3.126 3.072 3.163 . 0 0 "[ . 1]" 1
1551 1 63 VAL QG 1 72 ILE HA 3.590 . 3.590 2.997 2.781 3.129 . 0 0 "[ . 1]" 1
1552 1 63 VAL QG 1 72 ILE MG 2.860 . 2.860 2.325 2.279 2.391 . 0 0 "[ . 1]" 1
1553 1 63 VAL QG 1 73 GLY H 5.010 . 5.010 3.940 3.736 4.094 . 0 0 "[ . 1]" 1
1554 1 63 VAL MG1 1 64 CYS H 4.260 . 4.260 2.517 2.462 2.581 . 0 0 "[ . 1]" 1
1555 1 63 VAL MG1 1 64 CYS HA 5.500 . 5.500 3.848 3.798 3.956 . 0 0 "[ . 1]" 1
1556 1 63 VAL MG1 1 71 TRP H 5.500 . 5.500 3.144 3.089 3.182 . 0 0 "[ . 1]" 1
1557 1 63 VAL MG1 1 72 ILE HA 4.950 . 4.950 3.274 3.002 3.412 . 0 0 "[ . 1]" 1
1558 1 63 VAL MG1 1 72 ILE MG 3.590 . 3.590 2.708 2.641 2.813 . 0 0 "[ . 1]" 1
1559 1 63 VAL MG2 1 64 CYS H 4.260 . 4.260 4.169 4.124 4.207 . 0 0 "[ . 1]" 1
1560 1 63 VAL MG2 1 64 CYS HA 5.500 . 5.500 5.458 5.433 5.500 . 0 0 "[ . 1]" 1
1561 1 63 VAL MG2 1 71 TRP H 5.500 . 5.500 5.492 5.399 5.529 0.029 1 0 "[ . 1]" 1
1562 1 63 VAL MG2 1 72 ILE HA 4.950 . 4.950 3.476 3.287 3.636 . 0 0 "[ . 1]" 1
1563 1 63 VAL MG2 1 72 ILE MG 3.590 . 3.590 2.537 2.416 2.648 . 0 0 "[ . 1]" 1
1564 1 64 CYS H 1 64 CYS HB2 4.170 . 4.170 2.649 2.567 2.777 . 0 0 "[ . 1]" 1
1565 1 64 CYS H 1 64 CYS QB 3.600 . 3.600 2.598 2.522 2.708 . 0 0 "[ . 1]" 1
1566 1 64 CYS H 1 64 CYS HB3 4.170 . 4.170 3.761 3.704 3.784 . 0 0 "[ . 1]" 1
1567 1 64 CYS H 1 70 ILE HA 5.260 . 5.260 4.570 4.508 4.711 . 0 0 "[ . 1]" 1
1568 1 64 CYS H 1 70 ILE MG 4.020 . 4.020 3.521 3.455 3.683 . 0 0 "[ . 1]" 1
1569 1 64 CYS H 1 71 TRP H 3.730 . 3.730 2.695 2.654 2.845 . 0 0 "[ . 1]" 1
1570 1 64 CYS H 1 71 TRP HB2 4.930 . 4.930 3.003 2.906 3.103 . 0 0 "[ . 1]" 1
1571 1 64 CYS H 1 71 TRP QB 4.330 . 4.330 2.949 2.858 3.043 . 0 0 "[ . 1]" 1
1572 1 64 CYS H 1 71 TRP HB3 4.930 . 4.930 4.303 4.239 4.389 . 0 0 "[ . 1]" 1
1573 1 64 CYS H 1 72 ILE HA 4.210 . 4.210 3.333 3.261 3.388 . 0 0 "[ . 1]" 1
1574 1 64 CYS H 1 72 ILE MG 4.660 . 4.660 4.351 4.245 4.539 . 0 0 "[ . 1]" 1
1575 1 64 CYS HA 1 65 ILE H 3.090 . 3.090 2.254 2.197 2.294 . 0 0 "[ . 1]" 1
1576 1 64 CYS HA 1 65 ILE MD 5.500 . 5.500 5.024 4.963 5.154 . 0 0 "[ . 1]" 1
1577 1 64 CYS HA 1 65 ILE HG13 4.270 . 4.270 3.703 3.618 3.841 . 0 0 "[ . 1]" 1
1578 1 64 CYS HA 1 70 ILE MG 5.260 . 5.260 4.738 4.656 4.841 . 0 0 "[ . 1]" 1
1579 1 64 CYS QB 1 65 ILE H 3.480 . 3.480 2.644 2.514 2.870 . 0 0 "[ . 1]" 1
1580 1 64 CYS QB 1 71 TRP H 4.670 . 4.670 3.523 3.366 3.736 . 0 0 "[ . 1]" 1
1581 1 64 CYS QB 1 71 TRP QB 3.720 . 3.720 2.149 2.006 2.387 . 0 0 "[ . 1]" 1
1582 1 64 CYS HB2 1 65 ILE H 4.360 . 4.360 3.798 3.680 4.009 . 0 0 "[ . 1]" 1
1583 1 64 CYS HB2 1 71 TRP HD1 4.740 . 4.740 3.569 3.259 4.091 . 0 0 "[ . 1]" 1
1584 1 64 CYS HB3 1 65 ILE H 4.360 . 4.360 2.700 2.557 2.994 . 0 0 "[ . 1]" 1
1585 1 64 CYS HB3 1 71 TRP HD1 4.740 . 4.740 4.102 3.763 4.433 . 0 0 "[ . 1]" 1
1586 1 65 ILE H 1 65 ILE HB 3.480 . 3.480 2.670 2.615 2.741 . 0 0 "[ . 1]" 1
1587 1 65 ILE H 1 65 ILE MD 4.340 . 4.340 4.143 4.062 4.186 . 0 0 "[ . 1]" 1
1588 1 65 ILE H 1 65 ILE HG12 4.260 . 4.260 3.981 3.889 4.073 . 0 0 "[ . 1]" 1
1589 1 65 ILE H 1 65 ILE HG13 3.910 . 3.910 2.933 2.814 3.032 . 0 0 "[ . 1]" 1
1590 1 65 ILE H 1 65 ILE MG 3.960 . 3.960 3.863 3.839 3.899 . 0 0 "[ . 1]" 1
1591 1 65 ILE H 1 66 GLN H 4.570 . 4.570 4.172 4.030 4.277 . 0 0 "[ . 1]" 1
1592 1 65 ILE HA 1 65 ILE MD 4.010 . 4.010 3.832 3.811 3.849 . 0 0 "[ . 1]" 1
1593 1 65 ILE HA 1 65 ILE HG12 3.340 . 3.340 2.510 2.473 2.537 . 0 0 "[ . 1]" 1
1594 1 65 ILE HA 1 65 ILE HG13 3.880 . 3.880 3.052 3.009 3.095 . 0 0 "[ . 1]" 1
1595 1 65 ILE HA 1 65 ILE MG 3.160 . 3.160 2.455 2.432 2.483 . 0 0 "[ . 1]" 1
1596 1 65 ILE HA 1 66 GLN H 2.920 . 2.920 2.105 2.049 2.133 . 0 0 "[ . 1]" 1
1597 1 65 ILE HA 1 71 TRP H 4.610 . 4.610 3.431 3.315 3.498 . 0 0 "[ . 1]" 1
1598 1 65 ILE HA 1 71 TRP HD1 3.830 . 3.830 2.837 2.747 3.017 . 0 0 "[ . 1]" 1
1599 1 65 ILE HA 1 71 TRP HE1 5.140 . 5.140 4.487 4.296 4.620 . 0 0 "[ . 1]" 1
1600 1 65 ILE HA 1 92 VAL MG1 5.500 . 5.500 5.374 5.052 5.505 0.005 8 0 "[ . 1]" 1
1601 1 65 ILE HB 1 65 ILE MD 3.260 . 3.260 2.464 2.411 2.482 . 0 0 "[ . 1]" 1
1602 1 65 ILE HB 1 66 GLN H 4.580 . 4.580 4.286 4.243 4.335 . 0 0 "[ . 1]" 1
1603 1 65 ILE HB 1 92 VAL HA 4.890 . 4.890 4.306 4.076 4.504 . 0 0 "[ . 1]" 1
1604 1 65 ILE HB 1 93 PRO HD3 4.700 . 4.700 3.387 3.153 3.691 . 0 0 "[ . 1]" 1
1605 1 65 ILE HB 1 93 PRO HG2 4.870 . 4.870 4.777 4.377 4.893 0.023 3 0 "[ . 1]" 1
1606 1 65 ILE MD 1 65 ILE MG 2.800 . 2.800 1.937 1.902 1.964 . 0 0 "[ . 1]" 1
1607 1 65 ILE MD 1 66 GLN H 5.500 . 5.500 5.197 5.100 5.306 . 0 0 "[ . 1]" 1
1608 1 65 ILE MD 1 70 ILE MD 3.530 . 3.530 2.821 2.690 2.924 . 0 0 "[ . 1]" 1
1609 1 65 ILE MD 1 70 ILE HG12 4.100 . 4.100 2.994 2.854 3.103 . 0 0 "[ . 1]" 1
1610 1 65 ILE MD 1 70 ILE HG13 4.610 . 4.610 4.240 4.123 4.348 . 0 0 "[ . 1]" 1
1611 1 65 ILE MD 1 71 TRP H 5.500 . 5.500 5.455 5.335 5.527 0.027 9 0 "[ . 1]" 1
1612 1 65 ILE MD 1 92 VAL HA 3.780 . 3.780 3.491 3.396 3.576 . 0 0 "[ . 1]" 1
1613 1 65 ILE MD 1 92 VAL HB 5.200 . 5.200 4.681 4.526 4.835 . 0 0 "[ . 1]" 1
1614 1 65 ILE MD 1 92 VAL MG1 4.250 . 4.250 4.131 3.984 4.265 0.015 7 0 "[ . 1]" 1
1615 1 65 ILE MD 1 93 PRO QB 3.880 . 3.880 3.315 3.092 3.562 . 0 0 "[ . 1]" 1
1616 1 65 ILE MD 1 93 PRO HD2 3.760 . 3.760 3.174 3.076 3.316 . 0 0 "[ . 1]" 1
1617 1 65 ILE MD 1 93 PRO HD3 3.280 . 3.280 2.040 1.992 2.124 . 0 0 "[ . 1]" 1
1618 1 65 ILE MD 1 93 PRO HG2 4.460 . 4.460 3.653 3.572 3.805 . 0 0 "[ . 1]" 1
1619 1 65 ILE MD 1 96 GLN H 5.230 . 5.230 5.152 4.941 5.249 0.019 7 0 "[ . 1]" 1
1620 1 65 ILE MD 1 96 GLN HB2 3.900 . 3.900 2.603 2.350 2.712 . 0 0 "[ . 1]" 1
1621 1 65 ILE MD 1 96 GLN HB3 4.220 . 4.220 2.994 2.773 3.124 . 0 0 "[ . 1]" 1
1622 1 65 ILE MD 1 96 GLN QE 4.260 . 4.260 2.307 1.825 2.940 . 0 0 "[ . 1]" 1
1623 1 65 ILE MD 1 96 GLN HG2 4.770 . 4.770 4.297 3.941 4.564 . 0 0 "[ . 1]" 1
1624 1 65 ILE MD 1 96 GLN HG3 3.660 . 3.660 3.394 2.613 3.679 0.019 4 0 "[ . 1]" 1
1625 1 65 ILE MD 1 97 ILE H 5.500 . 5.500 4.768 4.467 4.989 . 0 0 "[ . 1]" 1
1626 1 65 ILE MD 1 98 PRO HB3 5.260 . 5.260 4.617 4.355 4.860 . 0 0 "[ . 1]" 1
1627 1 65 ILE HG12 1 65 ILE MG 2.710 . 2.710 2.437 2.416 2.461 . 0 0 "[ . 1]" 1
1628 1 65 ILE HG12 1 66 GLN H 4.750 . 4.750 4.422 4.318 4.516 . 0 0 "[ . 1]" 1
1629 1 65 ILE HG12 1 70 ILE HA 3.150 . 3.150 2.877 2.701 3.001 . 0 0 "[ . 1]" 1
1630 1 65 ILE HG12 1 70 ILE HG12 3.930 . 3.930 1.940 1.907 1.981 . 0 0 "[ . 1]" 1
1631 1 65 ILE HG12 1 71 TRP H 5.210 . 5.210 4.216 4.057 4.313 . 0 0 "[ . 1]" 1
1632 1 65 ILE HG12 1 89 CYS HB2 5.500 . 5.500 3.765 3.585 3.925 . 0 0 "[ . 1]" 1
1633 1 65 ILE HG13 1 65 ILE MG 3.720 . 3.720 3.215 3.209 3.224 . 0 0 "[ . 1]" 1
1634 1 65 ILE HG13 1 70 ILE HA 4.270 . 4.270 4.014 3.868 4.158 . 0 0 "[ . 1]" 1
1635 1 65 ILE HG13 1 70 ILE HG12 3.950 . 3.950 3.630 3.576 3.687 . 0 0 "[ . 1]" 1
1636 1 65 ILE HG13 1 70 ILE MG 4.070 . 4.070 3.237 3.176 3.386 . 0 0 "[ . 1]" 1
1637 1 65 ILE MG 1 66 GLN H 3.310 . 3.310 2.901 2.778 3.049 . 0 0 "[ . 1]" 1
1638 1 65 ILE MG 1 69 HIS H 4.300 . 4.300 3.957 3.740 4.076 . 0 0 "[ . 1]" 1
1639 1 65 ILE MG 1 71 TRP HD1 4.920 . 4.920 4.581 4.475 4.756 . 0 0 "[ . 1]" 1
1640 1 65 ILE MG 1 71 TRP HE1 5.500 . 5.500 5.188 5.088 5.390 . 0 0 "[ . 1]" 1
1641 1 65 ILE MG 1 89 CYS HB2 4.070 . 4.070 3.179 2.935 3.349 . 0 0 "[ . 1]" 1
1642 1 65 ILE MG 1 89 CYS HB3 4.000 . 4.000 2.374 2.270 2.491 . 0 0 "[ . 1]" 1
1643 1 65 ILE MG 1 92 VAL H 4.980 . 4.980 4.922 4.754 5.023 0.043 5 0 "[ . 1]" 1
1644 1 65 ILE MG 1 92 VAL HA 3.560 . 3.560 2.645 2.485 2.704 . 0 0 "[ . 1]" 1
1645 1 65 ILE MG 1 93 PRO HD2 3.820 . 3.820 3.382 3.200 3.532 . 0 0 "[ . 1]" 1
1646 1 65 ILE MG 1 93 PRO HD3 3.710 . 3.710 2.664 2.520 2.791 . 0 0 "[ . 1]" 1
1647 1 65 ILE MG 1 93 PRO HG2 5.050 . 5.050 4.954 4.774 5.067 0.017 6 0 "[ . 1]" 1
1648 1 65 ILE MG 1 96 GLN HA 4.930 . 4.930 4.812 4.474 4.949 0.019 3 0 "[ . 1]" 1
1649 1 66 GLN H 1 66 GLN HB2 4.140 . 4.140 3.399 3.359 3.488 . 0 0 "[ . 1]" 1
1650 1 66 GLN H 1 66 GLN HB3 4.140 . 4.140 3.054 2.934 3.171 . 0 0 "[ . 1]" 1
1651 1 66 GLN H 1 66 GLN HG3 4.820 . 4.820 4.591 4.497 4.672 . 0 0 "[ . 1]" 1
1652 1 66 GLN H 1 67 ALA MB 4.910 . 4.910 4.378 4.298 4.463 . 0 0 "[ . 1]" 1
1653 1 66 GLN H 1 69 HIS H 3.860 . 3.860 3.097 3.066 3.132 . 0 0 "[ . 1]" 1
1654 1 66 GLN H 1 71 TRP H 5.070 . 5.070 4.593 4.506 4.697 . 0 0 "[ . 1]" 1
1655 1 66 GLN H 1 71 TRP HD1 3.650 . 3.650 2.535 2.397 2.589 . 0 0 "[ . 1]" 1
1656 1 66 GLN H 1 71 TRP HE1 3.770 . 3.770 2.869 2.633 2.992 . 0 0 "[ . 1]" 1
1657 1 66 GLN HA 1 67 ALA H 3.390 . 3.390 2.260 2.200 2.299 . 0 0 "[ . 1]" 1
1658 1 66 GLN HB2 1 66 GLN QE 4.460 . 4.460 2.363 1.820 2.757 . 0 0 "[ . 1]" 1
1659 1 66 GLN HB2 1 67 ALA MB 5.500 . 5.500 4.818 4.761 4.864 . 0 0 "[ . 1]" 1
1660 1 66 GLN HB2 1 71 TRP HE1 5.320 . 5.320 4.482 4.354 4.702 . 0 0 "[ . 1]" 1
1661 1 66 GLN HB3 1 71 TRP HE1 4.310 . 4.310 2.972 2.799 3.226 . 0 0 "[ . 1]" 1
1662 1 66 GLN HG2 1 67 ALA H 4.250 . 4.250 3.990 3.900 4.096 . 0 0 "[ . 1]" 1
1663 1 66 GLN HG2 1 67 ALA HA 5.500 . 5.500 5.527 5.501 5.553 0.053 4 0 "[ . 1]" 1
1664 1 66 GLN HG2 1 67 ALA MB 4.740 . 4.740 4.087 3.929 4.191 . 0 0 "[ . 1]" 1
1665 1 66 GLN HG3 1 67 ALA H 3.920 . 3.920 2.478 2.297 2.649 . 0 0 "[ . 1]" 1
1666 1 66 GLN HG3 1 67 ALA HA 4.250 . 4.250 3.799 3.764 3.847 . 0 0 "[ . 1]" 1
1667 1 66 GLN HG3 1 67 ALA MB 3.590 . 3.590 2.719 2.493 2.927 . 0 0 "[ . 1]" 1
1668 1 67 ALA H 1 67 ALA MB 3.610 . 3.610 2.902 2.871 2.919 . 0 0 "[ . 1]" 1
1669 1 67 ALA H 1 68 GLY H 4.100 . 4.100 2.597 2.525 2.678 . 0 0 "[ . 1]" 1
1670 1 67 ALA HA 1 68 GLY QA 4.470 . 4.470 4.077 4.051 4.128 . 0 0 "[ . 1]" 1
1671 1 67 ALA MB 1 68 GLY H 4.240 . 4.240 3.631 3.598 3.647 . 0 0 "[ . 1]" 1
1672 1 67 ALA MB 1 69 HIS H 4.200 . 4.200 3.305 3.223 3.372 . 0 0 "[ . 1]" 1
1673 1 67 ALA MB 1 69 HIS HB3 4.790 . 4.790 4.726 4.551 4.801 0.011 7 0 "[ . 1]" 1
1674 1 67 ALA MB 1 69 HIS HE1 5.320 . 5.320 4.413 4.173 4.575 . 0 0 "[ . 1]" 1
1675 1 67 ALA MB 1 71 TRP HD1 5.340 . 5.340 5.005 4.887 5.136 . 0 0 "[ . 1]" 1
1676 1 67 ALA MB 1 71 TRP HE1 3.740 . 3.740 2.779 2.648 2.935 . 0 0 "[ . 1]" 1
1677 1 67 ALA MB 1 71 TRP HH2 5.500 . 5.500 4.577 4.334 4.778 . 0 0 "[ . 1]" 1
1678 1 67 ALA MB 1 71 TRP HZ2 3.310 . 3.310 2.598 2.378 2.798 . 0 0 "[ . 1]" 1
1679 1 68 GLY H 1 69 HIS H 3.360 . 3.360 2.598 2.499 2.654 . 0 0 "[ . 1]" 1
1680 1 68 GLY H 1 69 HIS HA 5.450 . 5.450 5.196 5.092 5.250 . 0 0 "[ . 1]" 1
1681 1 68 GLY QA 1 89 CYS H 4.560 . 4.560 3.459 3.325 3.613 . 0 0 "[ . 1]" 1
1682 1 69 HIS H 1 69 HIS HB2 3.490 . 3.490 2.550 2.495 2.576 . 0 0 "[ . 1]" 1
1683 1 69 HIS H 1 69 HIS HB3 4.020 . 4.020 3.709 3.680 3.730 . 0 0 "[ . 1]" 1
1684 1 69 HIS H 1 70 ILE H 4.500 . 4.500 4.410 4.386 4.433 . 0 0 "[ . 1]" 1
1685 1 69 HIS H 1 71 TRP HE1 4.120 . 4.120 3.191 3.094 3.272 . 0 0 "[ . 1]" 1
1686 1 69 HIS HA 1 69 HIS HD2 4.320 . 4.320 3.578 3.458 3.691 . 0 0 "[ . 1]" 1
1687 1 69 HIS HA 1 88 THR HA 3.320 . 3.320 2.026 1.954 2.107 . 0 0 "[ . 1]" 1
1688 1 69 HIS HA 1 88 THR HB 4.530 . 4.530 4.090 3.815 4.228 . 0 0 "[ . 1]" 1
1689 1 69 HIS HA 1 88 THR MG 4.560 . 4.560 3.361 3.059 3.564 . 0 0 "[ . 1]" 1
1690 1 69 HIS HA 1 89 CYS H 3.870 . 3.870 2.881 2.798 2.959 . 0 0 "[ . 1]" 1
1691 1 69 HIS HB2 1 70 ILE H 4.210 . 4.210 3.872 3.835 3.923 . 0 0 "[ . 1]" 1
1692 1 69 HIS HB2 1 71 TRP HE1 3.560 . 3.560 2.359 2.224 2.500 . 0 0 "[ . 1]" 1
1693 1 69 HIS HB2 1 71 TRP HZ2 4.730 . 4.730 3.134 3.027 3.316 . 0 0 "[ . 1]" 1
1694 1 69 HIS HB2 1 85 PRO HB3 4.950 . 4.950 3.697 3.450 3.995 . 0 0 "[ . 1]" 1
1695 1 69 HIS HB2 1 88 THR HA 4.800 . 4.800 4.824 4.805 4.856 0.056 7 0 "[ . 1]" 1
1696 1 69 HIS HB3 1 69 HIS HD2 3.820 . 3.820 2.728 2.712 2.742 . 0 0 "[ . 1]" 1
1697 1 69 HIS HB3 1 70 ILE H 3.550 . 3.550 2.658 2.593 2.719 . 0 0 "[ . 1]" 1
1698 1 69 HIS HB3 1 70 ILE HB 5.170 . 5.170 4.958 4.903 5.038 . 0 0 "[ . 1]" 1
1699 1 69 HIS HB3 1 71 TRP HE1 4.020 . 4.020 3.635 3.443 3.782 . 0 0 "[ . 1]" 1
1700 1 69 HIS HB3 1 71 TRP HZ2 4.620 . 4.620 4.318 4.126 4.534 . 0 0 "[ . 1]" 1
1701 1 69 HIS HB3 1 85 PRO HB2 4.730 . 4.730 3.351 3.162 3.523 . 0 0 "[ . 1]" 1
1702 1 69 HIS HB3 1 85 PRO HB3 4.660 . 4.660 2.799 2.654 3.004 . 0 0 "[ . 1]" 1
1703 1 69 HIS HB3 1 87 ARG H 5.180 . 5.180 4.174 3.985 4.366 . 0 0 "[ . 1]" 1
1704 1 69 HIS HB3 1 88 THR HA 4.680 . 4.680 3.908 3.829 4.015 . 0 0 "[ . 1]" 1
1705 1 69 HIS HB3 1 88 THR MG 4.770 . 4.770 4.420 4.249 4.625 . 0 0 "[ . 1]" 1
1706 1 69 HIS HB3 1 102 TRP HH2 5.500 . 5.500 4.888 4.632 5.117 . 0 0 "[ . 1]" 1
1707 1 69 HIS HD2 1 85 PRO HB2 4.460 . 4.460 2.908 2.651 3.242 . 0 0 "[ . 1]" 1
1708 1 69 HIS HD2 1 85 PRO HB3 4.930 . 4.930 3.553 3.216 3.775 . 0 0 "[ . 1]" 1
1709 1 69 HIS HD2 1 87 ARG H 5.500 . 5.500 4.343 4.042 4.593 . 0 0 "[ . 1]" 1
1710 1 69 HIS HD2 1 88 THR HA 3.970 . 3.970 3.670 3.465 3.955 . 0 0 "[ . 1]" 1
1711 1 69 HIS HD2 1 88 THR MG 3.640 . 3.640 2.952 2.676 3.281 . 0 0 "[ . 1]" 1
1712 1 69 HIS HD2 1 102 TRP HH2 3.500 . 3.500 2.334 2.132 2.596 . 0 0 "[ . 1]" 1
1713 1 69 HIS HD2 1 102 TRP HZ2 4.500 . 4.500 4.037 3.757 4.514 0.014 9 0 "[ . 1]" 1
1714 1 69 HIS HD2 1 102 TRP HZ3 4.960 . 4.960 3.509 3.012 3.912 . 0 0 "[ . 1]" 1
1715 1 69 HIS HE1 1 88 THR MG 4.550 . 4.550 4.105 3.911 4.262 . 0 0 "[ . 1]" 1
1716 1 70 ILE H 1 70 ILE HB 3.430 . 3.430 2.527 2.501 2.563 . 0 0 "[ . 1]" 1
1717 1 70 ILE H 1 70 ILE MD 4.250 . 4.250 4.041 3.986 4.076 . 0 0 "[ . 1]" 1
1718 1 70 ILE H 1 70 ILE HG12 3.740 . 3.740 3.608 3.544 3.695 . 0 0 "[ . 1]" 1
1719 1 70 ILE H 1 70 ILE HG13 4.230 . 4.230 2.637 2.580 2.713 . 0 0 "[ . 1]" 1
1720 1 70 ILE H 1 70 ILE MG 4.060 . 4.060 3.786 3.774 3.806 . 0 0 "[ . 1]" 1
1721 1 70 ILE H 1 71 TRP H 4.850 . 4.850 4.401 4.376 4.416 . 0 0 "[ . 1]" 1
1722 1 70 ILE H 1 86 VAL QG 4.960 . 4.960 4.114 4.042 4.208 . 0 0 "[ . 1]" 1
1723 1 70 ILE H 1 87 ARG H 4.230 . 4.230 3.136 3.070 3.253 . 0 0 "[ . 1]" 1
1724 1 70 ILE H 1 87 ARG HG2 5.160 . 5.160 3.873 3.702 4.092 . 0 0 "[ . 1]" 1
1725 1 70 ILE H 1 88 THR HA 4.060 . 4.060 2.950 2.771 3.059 . 0 0 "[ . 1]" 1
1726 1 70 ILE H 1 89 CYS H 4.270 . 4.270 4.281 4.236 4.318 0.048 9 0 "[ . 1]" 1
1727 1 70 ILE H 1 89 CYS HB2 4.660 . 4.660 4.234 3.951 4.323 . 0 0 "[ . 1]" 1
1728 1 70 ILE H 1 89 CYS HB3 4.670 . 4.670 4.510 4.405 4.665 . 0 0 "[ . 1]" 1
1729 1 70 ILE HA 1 70 ILE MD 4.010 . 4.010 3.787 3.766 3.799 . 0 0 "[ . 1]" 1
1730 1 70 ILE HA 1 70 ILE HG12 3.760 . 3.760 2.475 2.447 2.495 . 0 0 "[ . 1]" 1
1731 1 70 ILE HA 1 70 ILE HG13 3.760 . 3.760 3.195 3.159 3.212 . 0 0 "[ . 1]" 1
1732 1 70 ILE HA 1 70 ILE MG 3.010 . 3.010 2.411 2.383 2.450 . 0 0 "[ . 1]" 1
1733 1 70 ILE HA 1 71 TRP H 3.100 . 3.100 2.192 2.170 2.216 . 0 0 "[ . 1]" 1
1734 1 70 ILE HA 1 71 TRP HD1 3.960 . 3.960 2.955 2.902 3.022 . 0 0 "[ . 1]" 1
1735 1 70 ILE HA 1 71 TRP HE1 5.410 . 5.410 4.701 4.627 4.814 . 0 0 "[ . 1]" 1
1736 1 70 ILE HB 1 70 ILE MD 3.190 . 3.190 2.559 2.531 2.575 . 0 0 "[ . 1]" 1
1737 1 70 ILE HB 1 71 TRP H 4.760 . 4.760 3.996 3.961 4.037 . 0 0 "[ . 1]" 1
1738 1 70 ILE HB 1 86 VAL H 4.480 . 4.480 3.720 3.637 3.783 . 0 0 "[ . 1]" 1
1739 1 70 ILE HB 1 86 VAL HB 5.500 . 5.500 5.331 5.283 5.375 . 0 0 "[ . 1]" 1
1740 1 70 ILE HB 1 86 VAL QG 3.480 . 3.480 2.742 2.699 2.785 . 0 0 "[ . 1]" 1
1741 1 70 ILE HB 1 87 ARG H 4.050 . 4.050 3.184 3.071 3.297 . 0 0 "[ . 1]" 1
1742 1 70 ILE HB 1 87 ARG HB3 5.160 . 5.160 4.460 4.358 4.619 . 0 0 "[ . 1]" 1
1743 1 70 ILE HB 1 87 ARG QD 4.340 . 4.340 3.478 3.195 4.122 . 0 0 "[ . 1]" 1
1744 1 70 ILE HB 1 87 ARG HG2 2.880 . 2.880 2.015 1.914 2.150 . 0 0 "[ . 1]" 1
1745 1 70 ILE HB 1 87 ARG HG3 3.740 . 3.740 2.568 2.424 2.814 . 0 0 "[ . 1]" 1
1746 1 70 ILE MD 1 70 ILE MG 2.680 . 2.680 1.890 1.866 1.903 . 0 0 "[ . 1]" 1
1747 1 70 ILE MD 1 71 TRP H 5.030 . 5.030 4.841 4.800 4.888 . 0 0 "[ . 1]" 1
1748 1 70 ILE MD 1 86 VAL QG 3.830 . 3.830 3.824 3.757 3.856 0.026 5 0 "[ . 1]" 1
1749 1 70 ILE MD 1 87 ARG HB2 4.530 . 4.530 4.034 3.946 4.088 . 0 0 "[ . 1]" 1
1750 1 70 ILE MD 1 87 ARG QD 3.910 . 3.910 2.510 2.162 3.498 . 0 0 "[ . 1]" 1
1751 1 70 ILE MD 1 87 ARG HG2 3.040 . 3.040 2.904 2.816 3.035 . 0 0 "[ . 1]" 1
1752 1 70 ILE MD 1 87 ARG HG3 3.370 . 3.370 2.001 1.939 2.055 . 0 0 "[ . 1]" 1
1753 1 70 ILE MD 1 88 THR H 5.010 . 5.010 4.797 4.689 5.013 0.003 9 0 "[ . 1]" 1
1754 1 70 ILE MD 1 89 CYS HB2 3.740 . 3.740 2.209 2.099 2.370 . 0 0 "[ . 1]" 1
1755 1 70 ILE MD 1 89 CYS HB3 4.070 . 4.070 3.704 3.581 3.811 . 0 0 "[ . 1]" 1
1756 1 70 ILE MD 1 96 GLN QE 4.670 . 4.670 3.511 2.399 4.696 0.026 7 0 "[ . 1]" 1
1757 1 70 ILE MD 1 98 PRO HA 3.510 . 3.510 2.665 2.405 2.880 . 0 0 "[ . 1]" 1
1758 1 70 ILE MD 1 98 PRO HB2 3.220 . 3.220 2.983 2.870 3.056 . 0 0 "[ . 1]" 1
1759 1 70 ILE MD 1 98 PRO HB3 3.560 . 3.560 1.935 1.881 2.027 . 0 0 "[ . 1]" 1
1760 1 70 ILE MD 1 98 PRO HD3 4.790 . 4.790 3.906 3.437 4.167 . 0 0 "[ . 1]" 1
1761 1 70 ILE MD 1 98 PRO HG3 3.770 . 3.770 3.563 3.407 3.729 . 0 0 "[ . 1]" 1
1762 1 70 ILE MD 1 99 GLY H 4.230 . 4.230 3.826 3.480 4.093 . 0 0 "[ . 1]" 1
1763 1 70 ILE HG12 1 70 ILE MG 3.470 . 3.470 2.523 2.492 2.541 . 0 0 "[ . 1]" 1
1764 1 70 ILE HG12 1 71 TRP H 4.490 . 4.490 4.328 4.280 4.353 . 0 0 "[ . 1]" 1
1765 1 70 ILE HG12 1 89 CYS HA 5.410 . 5.410 4.753 4.667 4.867 . 0 0 "[ . 1]" 1
1766 1 70 ILE HG12 1 89 CYS HB2 3.680 . 3.680 2.356 2.277 2.455 . 0 0 "[ . 1]" 1
1767 1 70 ILE HG12 1 89 CYS HB3 3.750 . 3.750 3.182 3.096 3.258 . 0 0 "[ . 1]" 1
1768 1 70 ILE HG12 1 98 PRO HA 5.500 . 5.500 4.760 4.512 4.989 . 0 0 "[ . 1]" 1
1769 1 70 ILE HG13 1 70 ILE MG 3.300 . 3.300 3.177 3.172 3.181 . 0 0 "[ . 1]" 1
1770 1 70 ILE HG13 1 71 TRP H 5.090 . 5.090 5.091 5.066 5.104 0.014 2 0 "[ . 1]" 1
1771 1 70 ILE HG13 1 87 ARG HG2 4.210 . 4.210 3.694 3.573 3.832 . 0 0 "[ . 1]" 1
1772 1 70 ILE HG13 1 87 ARG HG3 3.890 . 3.890 2.917 2.766 3.273 . 0 0 "[ . 1]" 1
1773 1 70 ILE HG13 1 89 CYS HB2 4.140 . 4.140 1.987 1.904 2.085 . 0 0 "[ . 1]" 1
1774 1 70 ILE HG13 1 89 CYS HB3 4.330 . 4.330 3.127 2.982 3.226 . 0 0 "[ . 1]" 1
1775 1 70 ILE MG 1 71 TRP H 3.280 . 3.280 2.418 2.383 2.473 . 0 0 "[ . 1]" 1
1776 1 70 ILE MG 1 71 TRP HA 4.260 . 4.260 3.844 3.815 3.887 . 0 0 "[ . 1]" 1
1777 1 70 ILE MG 1 71 TRP HD1 4.450 . 4.450 4.467 4.455 4.484 0.034 9 0 "[ . 1]" 1
1778 1 70 ILE MG 1 72 ILE HA 5.440 . 5.440 4.645 4.503 4.748 . 0 0 "[ . 1]" 1
1779 1 70 ILE MG 1 72 ILE MG 3.860 . 3.860 3.579 3.494 3.690 . 0 0 "[ . 1]" 1
1780 1 70 ILE MG 1 86 VAL H 5.110 . 5.110 3.906 3.839 3.984 . 0 0 "[ . 1]" 1
1781 1 70 ILE MG 1 86 VAL QG 2.840 . 2.840 2.395 2.334 2.494 . 0 0 "[ . 1]" 1
1782 1 70 ILE MG 1 87 ARG H 4.450 . 4.450 4.297 4.184 4.395 . 0 0 "[ . 1]" 1
1783 1 70 ILE MG 1 87 ARG QD 4.370 . 4.370 3.149 2.840 4.069 . 0 0 "[ . 1]" 1
1784 1 70 ILE MG 1 87 ARG HG2 4.060 . 4.060 3.033 2.920 3.159 . 0 0 "[ . 1]" 1
1785 1 71 TRP H 1 71 TRP QB 3.660 . 3.660 2.595 2.565 2.622 . 0 0 "[ . 1]" 1
1786 1 71 TRP H 1 71 TRP HD1 3.460 . 3.460 2.793 2.738 2.841 . 0 0 "[ . 1]" 1
1787 1 71 TRP H 1 86 VAL QG 4.980 . 4.980 3.800 3.727 3.948 . 0 0 "[ . 1]" 1
1788 1 71 TRP HA 1 71 TRP HD1 4.940 . 4.940 4.091 4.021 4.148 . 0 0 "[ . 1]" 1
1789 1 71 TRP HA 1 71 TRP HE3 4.580 . 4.580 3.492 3.375 3.575 . 0 0 "[ . 1]" 1
1790 1 71 TRP HA 1 72 ILE H 3.300 . 3.300 2.200 2.153 2.233 . 0 0 "[ . 1]" 1
1791 1 71 TRP HA 1 72 ILE HG12 4.240 . 4.240 3.948 3.897 3.991 . 0 0 "[ . 1]" 1
1792 1 71 TRP HA 1 72 ILE MG 4.910 . 4.910 3.823 3.734 3.896 . 0 0 "[ . 1]" 1
1793 1 71 TRP HA 1 85 PRO HA 3.170 . 3.170 2.129 2.048 2.184 . 0 0 "[ . 1]" 1
1794 1 71 TRP HA 1 85 PRO HB2 5.500 . 5.500 4.840 4.730 4.908 . 0 0 "[ . 1]" 1
1795 1 71 TRP HA 1 85 PRO HB3 4.750 . 4.750 4.138 4.061 4.218 . 0 0 "[ . 1]" 1
1796 1 71 TRP HA 1 85 PRO HD3 5.090 . 5.090 4.958 4.856 5.060 . 0 0 "[ . 1]" 1
1797 1 71 TRP HA 1 86 VAL H 3.850 . 3.850 2.899 2.812 2.984 . 0 0 "[ . 1]" 1
1798 1 71 TRP HA 1 86 VAL MG1 4.400 . 4.400 3.534 3.468 3.641 . 0 0 "[ . 1]" 1
1799 1 71 TRP HA 1 86 VAL QG 3.690 . 3.690 2.906 2.822 3.001 . 0 0 "[ . 1]" 1
1800 1 71 TRP HA 1 86 VAL MG2 4.400 . 4.400 3.092 2.982 3.196 . 0 0 "[ . 1]" 1
1801 1 71 TRP HA 1 87 ARG H 5.180 . 5.180 4.709 4.592 4.770 . 0 0 "[ . 1]" 1
1802 1 71 TRP QB 1 71 TRP HE3 3.680 . 3.680 2.409 2.382 2.420 . 0 0 "[ . 1]" 1
1803 1 71 TRP QB 1 72 ILE H 3.770 . 3.770 2.716 2.610 2.922 . 0 0 "[ . 1]" 1
1804 1 71 TRP QB 1 72 ILE HG12 5.260 . 5.260 4.698 4.588 4.806 . 0 0 "[ . 1]" 1
1805 1 71 TRP QB 1 83 TYR QB 3.980 . 3.980 2.231 2.142 2.329 . 0 0 "[ . 1]" 1
1806 1 71 TRP QB 1 83 TYR QD 4.360 . 4.360 2.226 2.015 2.623 . 0 0 "[ . 1]" 1
1807 1 71 TRP QB 1 84 CYS H 5.340 . 5.340 3.405 2.975 3.607 . 0 0 "[ . 1]" 1
1808 1 71 TRP QB 1 85 PRO HA 5.340 . 5.340 3.701 3.611 3.765 . 0 0 "[ . 1]" 1
1809 1 71 TRP HB2 1 72 ILE H 4.350 . 4.350 3.765 3.695 3.939 . 0 0 "[ . 1]" 1
1810 1 71 TRP HB2 1 83 TYR QD 4.980 . 4.980 2.709 2.418 3.088 . 0 0 "[ . 1]" 1
1811 1 71 TRP HB3 1 72 ILE H 4.350 . 4.350 2.786 2.669 3.012 . 0 0 "[ . 1]" 1
1812 1 71 TRP HB3 1 83 TYR QD 4.980 . 4.980 2.371 2.157 2.837 . 0 0 "[ . 1]" 1
1813 1 71 TRP HE3 1 72 ILE H 4.330 . 4.330 3.997 3.891 4.230 . 0 0 "[ . 1]" 1
1814 1 71 TRP HE3 1 72 ILE HG13 5.500 . 5.500 5.545 5.530 5.563 0.063 2 0 "[ . 1]" 1
1815 1 71 TRP HE3 1 83 TYR HA 4.930 . 4.930 3.907 3.699 4.053 . 0 0 "[ . 1]" 1
1816 1 71 TRP HE3 1 83 TYR HB2 4.070 . 4.070 3.217 2.994 3.364 . 0 0 "[ . 1]" 1
1817 1 71 TRP HE3 1 83 TYR HB3 4.070 . 4.070 2.132 1.963 2.263 . 0 0 "[ . 1]" 1
1818 1 71 TRP HE3 1 84 CYS H 4.620 . 4.620 3.388 2.962 3.569 . 0 0 "[ . 1]" 1
1819 1 71 TRP HE3 1 84 CYS HA 4.480 . 4.480 3.288 3.088 3.379 . 0 0 "[ . 1]" 1
1820 1 71 TRP HE3 1 85 PRO HA 4.410 . 4.410 3.534 3.435 3.719 . 0 0 "[ . 1]" 1
1821 1 71 TRP HE3 1 85 PRO HD2 4.450 . 4.450 4.239 4.171 4.305 . 0 0 "[ . 1]" 1
1822 1 71 TRP HE3 1 85 PRO HD3 4.120 . 4.120 2.811 2.712 2.894 . 0 0 "[ . 1]" 1
1823 1 71 TRP HH2 1 85 PRO HG3 5.500 . 5.500 3.616 3.511 3.784 . 0 0 "[ . 1]" 1
1824 1 71 TRP HZ3 1 83 TYR QB 4.780 . 4.780 3.509 3.341 3.601 . 0 0 "[ . 1]" 1
1825 1 71 TRP HZ3 1 84 CYS HA 4.390 . 4.390 3.689 3.472 3.759 . 0 0 "[ . 1]" 1
1826 1 71 TRP HZ3 1 85 PRO HB3 4.400 . 4.400 3.931 3.788 4.122 . 0 0 "[ . 1]" 1
1827 1 71 TRP HZ3 1 85 PRO HD2 4.270 . 4.270 3.892 3.834 3.926 . 0 0 "[ . 1]" 1
1828 1 71 TRP HZ3 1 85 PRO HD3 3.840 . 3.840 2.161 2.096 2.185 . 0 0 "[ . 1]" 1
1829 1 71 TRP HZ3 1 85 PRO HG3 4.080 . 4.080 3.302 3.167 3.494 . 0 0 "[ . 1]" 1
1830 1 72 ILE H 1 72 ILE MD 3.820 . 3.820 3.804 3.767 3.820 . 0 0 "[ . 1]" 1
1831 1 72 ILE H 1 72 ILE HG12 3.370 . 3.370 2.207 2.146 2.235 . 0 0 "[ . 1]" 1
1832 1 72 ILE H 1 72 ILE HG13 3.730 . 3.730 2.675 2.651 2.703 . 0 0 "[ . 1]" 1
1833 1 72 ILE H 1 72 ILE MG 3.640 . 3.640 2.820 2.723 2.866 . 0 0 "[ . 1]" 1
1834 1 72 ILE H 1 73 GLY H 4.470 . 4.470 4.382 4.338 4.437 . 0 0 "[ . 1]" 1
1835 1 72 ILE H 1 84 CYS H 3.860 . 3.860 2.649 2.499 2.785 . 0 0 "[ . 1]" 1
1836 1 72 ILE H 1 84 CYS HB2 5.470 . 5.470 4.899 4.830 4.969 . 0 0 "[ . 1]" 1
1837 1 72 ILE H 1 84 CYS HB3 4.400 . 4.400 3.529 3.405 3.607 . 0 0 "[ . 1]" 1
1838 1 72 ILE H 1 85 PRO HA 4.790 . 4.790 3.731 3.668 3.814 . 0 0 "[ . 1]" 1
1839 1 72 ILE H 1 86 VAL MG1 4.840 . 4.840 3.052 2.890 3.201 . 0 0 "[ . 1]" 1
1840 1 72 ILE H 1 86 VAL QG 4.040 . 4.040 2.894 2.729 3.023 . 0 0 "[ . 1]" 1
1841 1 72 ILE H 1 86 VAL MG2 4.840 . 4.840 3.594 3.352 3.715 . 0 0 "[ . 1]" 1
1842 1 72 ILE HA 1 72 ILE MD 4.170 . 4.170 4.165 4.155 4.175 0.005 2 0 "[ . 1]" 1
1843 1 72 ILE HA 1 72 ILE MG 3.080 . 3.080 2.295 2.276 2.313 . 0 0 "[ . 1]" 1
1844 1 72 ILE HA 1 73 GLY H 3.070 . 3.070 2.107 2.074 2.135 . 0 0 "[ . 1]" 1
1845 1 72 ILE HA 1 73 GLY HA3 4.520 . 4.520 4.242 4.224 4.265 . 0 0 "[ . 1]" 1
1846 1 72 ILE HA 1 74 TYR QD 4.970 . 4.970 4.892 4.738 4.984 0.014 5 0 "[ . 1]" 1
1847 1 72 ILE HA 1 86 VAL QG 5.440 . 5.440 3.957 3.918 4.030 . 0 0 "[ . 1]" 1
1848 1 72 ILE HB 1 72 ILE MD 3.290 . 3.290 2.319 2.294 2.339 . 0 0 "[ . 1]" 1
1849 1 72 ILE HB 1 73 GLY H 3.730 . 3.730 2.987 2.915 3.108 . 0 0 "[ . 1]" 1
1850 1 72 ILE HB 1 73 GLY HA3 5.470 . 5.470 5.017 4.966 5.110 . 0 0 "[ . 1]" 1
1851 1 72 ILE HB 1 74 TYR QD 4.170 . 4.170 3.317 3.161 3.390 . 0 0 "[ . 1]" 1
1852 1 72 ILE HB 1 74 TYR QE 4.600 . 4.600 4.608 4.545 4.628 0.028 4 0 "[ . 1]" 1
1853 1 72 ILE HB 1 84 CYS HB3 5.370 . 5.370 4.696 4.552 4.793 . 0 0 "[ . 1]" 1
1854 1 72 ILE HB 1 86 VAL QG 4.730 . 4.730 3.825 3.785 3.851 . 0 0 "[ . 1]" 1
1855 1 72 ILE MD 1 72 ILE MG 2.770 . 2.770 2.092 2.052 2.134 . 0 0 "[ . 1]" 1
1856 1 72 ILE MD 1 73 GLY H 5.160 . 5.160 4.700 4.629 4.782 . 0 0 "[ . 1]" 1
1857 1 72 ILE MD 1 74 TYR QD 3.680 . 3.680 2.751 2.604 2.922 . 0 0 "[ . 1]" 1
1858 1 72 ILE MD 1 74 TYR QE 3.780 . 3.780 2.659 2.521 2.794 . 0 0 "[ . 1]" 1
1859 1 72 ILE MD 1 84 CYS H 4.330 . 4.330 3.885 3.775 4.131 . 0 0 "[ . 1]" 1
1860 1 72 ILE MD 1 84 CYS HB2 4.270 . 4.270 3.412 3.330 3.641 . 0 0 "[ . 1]" 1
1861 1 72 ILE MD 1 84 CYS HB3 3.690 . 3.690 2.307 2.253 2.414 . 0 0 "[ . 1]" 1
1862 1 72 ILE MD 1 86 VAL QG 3.010 . 3.010 2.351 2.304 2.453 . 0 0 "[ . 1]" 1
1863 1 72 ILE MD 1 105 PHE QD 5.500 . 5.500 4.565 4.465 4.668 . 0 0 "[ . 1]" 1
1864 1 72 ILE MD 1 105 PHE HZ 5.500 . 5.500 5.472 5.248 5.513 0.013 6 0 "[ . 1]" 1
1865 1 72 ILE HG12 1 72 ILE MG 3.350 . 3.350 2.321 2.305 2.349 . 0 0 "[ . 1]" 1
1866 1 72 ILE HG12 1 74 TYR QD 4.640 . 4.640 4.269 4.049 4.459 . 0 0 "[ . 1]" 1
1867 1 72 ILE HG12 1 74 TYR QE 4.230 . 4.230 3.791 3.698 3.958 . 0 0 "[ . 1]" 1
1868 1 72 ILE HG12 1 84 CYS H 4.140 . 4.140 3.226 3.134 3.380 . 0 0 "[ . 1]" 1
1869 1 72 ILE HG12 1 84 CYS HB2 5.500 . 5.500 4.071 3.994 4.233 . 0 0 "[ . 1]" 1
1870 1 72 ILE HG12 1 84 CYS HB3 3.690 . 3.690 2.346 2.270 2.508 . 0 0 "[ . 1]" 1
1871 1 72 ILE HG12 1 86 VAL H 4.920 . 4.920 4.658 4.462 4.736 . 0 0 "[ . 1]" 1
1872 1 72 ILE HG12 1 86 VAL MG1 4.150 . 4.150 2.083 2.002 2.122 . 0 0 "[ . 1]" 1
1873 1 72 ILE HG12 1 86 VAL QG 3.470 . 3.470 2.071 1.990 2.109 . 0 0 "[ . 1]" 1
1874 1 72 ILE HG12 1 86 VAL MG2 4.150 . 4.150 3.641 3.494 3.740 . 0 0 "[ . 1]" 1
1875 1 72 ILE HG13 1 72 ILE MG 3.610 . 3.610 3.217 3.208 3.231 . 0 0 "[ . 1]" 1
1876 1 72 ILE HG13 1 74 TYR QD 4.130 . 4.130 2.613 2.390 2.789 . 0 0 "[ . 1]" 1
1877 1 72 ILE HG13 1 74 TYR QE 4.030 . 4.030 2.492 2.432 2.584 . 0 0 "[ . 1]" 1
1878 1 72 ILE HG13 1 83 TYR HA 4.850 . 4.850 3.749 3.657 3.917 . 0 0 "[ . 1]" 1
1879 1 72 ILE HG13 1 84 CYS H 3.990 . 3.990 2.430 2.323 2.716 . 0 0 "[ . 1]" 1
1880 1 72 ILE HG13 1 84 CYS HB2 4.350 . 4.350 3.580 3.467 3.740 . 0 0 "[ . 1]" 1
1881 1 72 ILE HG13 1 84 CYS HB3 3.750 . 3.750 2.301 2.090 2.374 . 0 0 "[ . 1]" 1
1882 1 72 ILE HG13 1 86 VAL QG 3.890 . 3.890 3.482 3.390 3.528 . 0 0 "[ . 1]" 1
1883 1 72 ILE MG 1 73 GLY H 4.160 . 4.160 3.729 3.696 3.799 . 0 0 "[ . 1]" 1
1884 1 72 ILE MG 1 84 CYS HB3 5.130 . 5.130 4.276 4.204 4.440 . 0 0 "[ . 1]" 1
1885 1 72 ILE MG 1 86 VAL H 4.960 . 4.960 4.232 4.116 4.330 . 0 0 "[ . 1]" 1
1886 1 72 ILE MG 1 86 VAL HB 5.500 . 5.500 3.795 3.740 3.844 . 0 0 "[ . 1]" 1
1887 1 72 ILE MG 1 86 VAL MG1 3.040 . 3.040 2.014 1.945 2.092 . 0 0 "[ . 1]" 1
1888 1 72 ILE MG 1 86 VAL QG 2.640 . 2.640 1.863 1.816 1.895 . 0 0 "[ . 1]" 1
1889 1 72 ILE MG 1 86 VAL MG2 3.040 . 3.040 2.204 2.102 2.284 . 0 0 "[ . 1]" 1
1890 1 72 ILE MG 1 87 ARG QD 5.300 . 5.300 5.264 5.094 5.444 0.144 4 0 "[ . 1]" 1
1891 1 72 ILE MG 1 105 PHE QD 4.710 . 4.710 3.566 3.426 3.671 . 0 0 "[ . 1]" 1
1892 1 72 ILE MG 1 105 PHE QE 3.420 . 3.420 2.465 2.309 2.559 . 0 0 "[ . 1]" 1
1893 1 72 ILE MG 1 105 PHE HZ 4.430 . 4.430 4.020 3.776 4.119 . 0 0 "[ . 1]" 1
1894 1 73 GLY H 1 74 TYR H 4.810 . 4.810 4.325 4.293 4.374 . 0 0 "[ . 1]" 1
1895 1 73 GLY HA2 1 74 TYR H 3.120 . 3.120 2.101 2.079 2.126 . 0 0 "[ . 1]" 1
1896 1 73 GLY HA2 1 74 TYR QE 5.080 . 5.080 4.898 4.775 5.027 . 0 0 "[ . 1]" 1
1897 1 73 GLY HA2 1 83 TYR HA 3.740 . 3.740 2.693 2.583 2.815 . 0 0 "[ . 1]" 1
1898 1 73 GLY HA2 1 84 CYS H 4.810 . 4.810 4.067 3.924 4.174 . 0 0 "[ . 1]" 1
1899 1 73 GLY HA3 1 74 TYR H 3.250 . 3.250 3.207 3.138 3.256 0.006 3 0 "[ . 1]" 1
1900 1 73 GLY HA3 1 74 TYR QD 5.090 . 5.090 4.743 4.661 4.809 . 0 0 "[ . 1]" 1
1901 1 73 GLY HA3 1 83 TYR HA 4.670 . 4.670 4.324 4.203 4.458 . 0 0 "[ . 1]" 1
1902 1 73 GLY HA3 1 83 TYR QD 5.340 . 5.340 3.597 3.166 3.848 . 0 0 "[ . 1]" 1
1903 1 74 TYR H 1 74 TYR QD 3.590 . 3.590 2.922 2.765 3.059 . 0 0 "[ . 1]" 1
1904 1 74 TYR H 1 74 TYR QE 4.450 . 4.450 4.333 4.286 4.428 . 0 0 "[ . 1]" 1
1905 1 74 TYR H 1 75 ASN H 4.540 . 4.540 4.307 4.280 4.346 . 0 0 "[ . 1]" 1
1906 1 74 TYR H 1 81 ARG HA 5.160 . 5.160 4.468 4.326 4.635 . 0 0 "[ . 1]" 1
1907 1 74 TYR H 1 81 ARG HD2 5.500 . 5.500 3.461 3.329 3.608 . 0 0 "[ . 1]" 1
1908 1 74 TYR H 1 81 ARG HD3 5.500 . 5.500 5.163 5.009 5.295 . 0 0 "[ . 1]" 1
1909 1 74 TYR H 1 82 VAL H 3.730 . 3.730 3.157 2.941 3.303 . 0 0 "[ . 1]" 1
1910 1 74 TYR H 1 82 VAL HA 5.500 . 5.500 4.854 4.807 4.880 . 0 0 "[ . 1]" 1
1911 1 74 TYR H 1 82 VAL HB 4.440 . 4.440 3.929 3.893 4.012 . 0 0 "[ . 1]" 1
1912 1 74 TYR H 1 82 VAL MG1 4.850 . 4.850 4.627 4.605 4.669 . 0 0 "[ . 1]" 1
1913 1 74 TYR H 1 82 VAL QG 4.200 . 4.200 4.220 4.204 4.241 0.041 7 0 "[ . 1]" 1
1914 1 74 TYR H 1 82 VAL MG2 4.850 . 4.850 4.869 4.843 4.900 0.050 3 0 "[ . 1]" 1
1915 1 74 TYR H 1 83 TYR HA 4.200 . 4.200 3.572 3.449 3.675 . 0 0 "[ . 1]" 1
1916 1 74 TYR HA 1 75 ASN H 3.240 . 3.240 2.451 2.231 2.574 . 0 0 "[ . 1]" 1
1917 1 74 TYR HB2 1 75 ASN H 3.230 . 3.230 2.366 2.228 2.758 . 0 0 "[ . 1]" 1
1918 1 74 TYR HB2 1 75 ASN HA 5.330 . 5.330 4.609 4.521 4.762 . 0 0 "[ . 1]" 1
1919 1 74 TYR HB2 1 75 ASN QB 4.810 . 4.810 4.599 4.490 4.767 . 0 0 "[ . 1]" 1
1920 1 74 TYR HB3 1 75 ASN H 4.080 . 4.080 3.690 3.639 3.877 . 0 0 "[ . 1]" 1
1921 1 74 TYR QD 1 75 ASN H 4.000 . 4.000 3.362 3.089 3.831 . 0 0 "[ . 1]" 1
1922 1 74 TYR QD 1 76 ALA MB 4.440 . 4.440 4.109 3.592 4.449 0.009 5 0 "[ . 1]" 1
1923 1 74 TYR QD 1 82 VAL HB 4.140 . 4.140 3.366 3.283 3.430 . 0 0 "[ . 1]" 1
1924 1 74 TYR QD 1 82 VAL MG1 4.290 . 4.290 4.133 4.078 4.193 . 0 0 "[ . 1]" 1
1925 1 74 TYR QD 1 82 VAL QG 3.630 . 3.630 3.628 3.553 3.653 0.023 7 0 "[ . 1]" 1
1926 1 74 TYR QD 1 82 VAL MG2 4.290 . 4.290 4.020 3.881 4.083 . 0 0 "[ . 1]" 1
1927 1 74 TYR QD 1 84 CYS HB3 4.730 . 4.730 4.161 3.912 4.322 . 0 0 "[ . 1]" 1
1928 1 74 TYR QE 1 76 ALA MB 4.350 . 4.350 3.735 2.895 4.181 . 0 0 "[ . 1]" 1
1929 1 74 TYR QE 1 82 VAL HB 4.320 . 4.320 2.853 2.762 3.017 . 0 0 "[ . 1]" 1
1930 1 74 TYR QE 1 82 VAL MG1 3.740 . 3.740 2.913 2.854 2.963 . 0 0 "[ . 1]" 1
1931 1 74 TYR QE 1 82 VAL QG 3.140 . 3.140 2.743 2.673 2.768 . 0 0 "[ . 1]" 1
1932 1 74 TYR QE 1 82 VAL MG2 3.740 . 3.740 3.358 3.163 3.498 . 0 0 "[ . 1]" 1
1933 1 74 TYR QE 1 84 CYS H 4.240 . 4.240 2.984 2.748 3.507 . 0 0 "[ . 1]" 1
1934 1 74 TYR QE 1 84 CYS HB2 3.660 . 3.660 2.254 2.099 2.578 . 0 0 "[ . 1]" 1
1935 1 74 TYR QE 1 84 CYS HB3 3.770 . 3.770 2.392 2.146 2.511 . 0 0 "[ . 1]" 1
1936 1 74 TYR QE 1 86 VAL QG 5.290 . 5.290 4.793 4.658 5.012 . 0 0 "[ . 1]" 1
1937 1 75 ASN H 1 75 ASN HB2 3.760 . 3.760 2.700 2.466 3.770 0.010 7 0 "[ . 1]" 1
1938 1 75 ASN H 1 75 ASN QB 3.090 . 3.090 2.510 2.325 2.757 . 0 0 "[ . 1]" 1
1939 1 75 ASN H 1 75 ASN HB3 3.760 . 3.760 3.496 2.456 3.762 0.002 6 0 "[ . 1]" 1
1940 1 75 ASN H 1 75 ASN QD 4.670 . 4.670 3.677 2.482 4.666 . 0 0 "[ . 1]" 1
1941 1 75 ASN HA 1 76 ALA H 2.810 . 2.810 2.096 1.986 2.146 . 0 0 "[ . 1]" 1
1942 1 75 ASN HA 1 76 ALA MB 3.980 . 3.980 3.936 3.865 3.984 0.004 1 0 "[ . 1]" 1
1943 1 75 ASN HA 1 81 ARG HA 4.130 . 4.130 2.690 2.614 2.804 . 0 0 "[ . 1]" 1
1944 1 75 ASN HA 1 81 ARG HD2 5.270 . 5.270 3.398 3.209 3.544 . 0 0 "[ . 1]" 1
1945 1 75 ASN HA 1 81 ARG QD 4.460 . 4.460 3.260 3.110 3.391 . 0 0 "[ . 1]" 1
1946 1 75 ASN HA 1 81 ARG HD3 5.270 . 5.270 4.225 3.817 4.479 . 0 0 "[ . 1]" 1
1947 1 75 ASN HA 1 82 VAL H 4.700 . 4.700 2.882 2.503 3.111 . 0 0 "[ . 1]" 1
1948 1 75 ASN HA 1 82 VAL QG 4.280 . 4.280 3.565 3.178 3.929 . 0 0 "[ . 1]" 1
1949 1 75 ASN QB 1 76 ALA H 3.530 . 3.530 3.017 2.753 3.649 0.119 9 0 "[ . 1]" 1
1950 1 75 ASN QB 1 79 GLY QA 4.100 . 4.100 3.091 2.268 4.141 0.041 9 0 "[ . 1]" 1
1951 1 75 ASN HB2 1 76 ALA H 4.340 . 4.340 3.955 2.966 4.246 . 0 0 "[ . 1]" 1
1952 1 75 ASN HB3 1 76 ALA H 4.340 . 4.340 3.251 2.811 4.120 . 0 0 "[ . 1]" 1
1953 1 76 ALA H 1 76 ALA MB 2.840 . 2.840 2.270 2.235 2.320 . 0 0 "[ . 1]" 1
1954 1 76 ALA H 1 77 TYR H 5.070 . 5.070 4.526 4.486 4.561 . 0 0 "[ . 1]" 1
1955 1 76 ALA H 1 80 ASN H 4.550 . 4.550 3.343 3.051 3.904 . 0 0 "[ . 1]" 1
1956 1 76 ALA H 1 80 ASN HB3 5.500 . 5.500 4.489 3.662 4.907 . 0 0 "[ . 1]" 1
1957 1 76 ALA H 1 81 ARG HA 4.560 . 4.560 3.808 3.625 3.976 . 0 0 "[ . 1]" 1
1958 1 76 ALA H 1 81 ARG QD 5.340 . 5.340 4.863 4.576 5.051 . 0 0 "[ . 1]" 1
1959 1 76 ALA H 1 82 VAL H 4.970 . 4.970 3.631 3.226 3.931 . 0 0 "[ . 1]" 1
1960 1 76 ALA H 1 82 VAL HB 5.430 . 5.430 4.338 4.002 4.690 . 0 0 "[ . 1]" 1
1961 1 76 ALA H 1 82 VAL QG 3.460 . 3.460 2.739 2.458 2.980 . 0 0 "[ . 1]" 1
1962 1 76 ALA HA 1 77 TYR HB2 5.310 . 5.310 4.608 4.370 4.875 . 0 0 "[ . 1]" 1
1963 1 76 ALA HA 1 77 TYR QB 4.650 . 4.650 4.247 4.145 4.422 . 0 0 "[ . 1]" 1
1964 1 76 ALA HA 1 77 TYR HB3 5.310 . 5.310 4.989 4.739 5.148 . 0 0 "[ . 1]" 1
1965 1 76 ALA HA 1 82 VAL QG 4.190 . 4.190 3.605 3.438 3.770 . 0 0 "[ . 1]" 1
1966 1 76 ALA MB 1 77 TYR H 4.690 . 4.690 2.183 2.044 2.367 . 0 0 "[ . 1]" 1
1967 1 76 ALA MB 1 77 TYR HA 4.420 . 4.420 4.257 4.219 4.315 . 0 0 "[ . 1]" 1
1968 1 76 ALA MB 1 77 TYR HB2 4.990 . 4.990 4.283 3.956 4.489 . 0 0 "[ . 1]" 1
1969 1 76 ALA MB 1 77 TYR QB 4.130 . 4.130 3.582 3.499 3.692 . 0 0 "[ . 1]" 1
1970 1 76 ALA MB 1 77 TYR HB3 4.990 . 4.990 3.850 3.740 3.938 . 0 0 "[ . 1]" 1
1971 1 76 ALA MB 1 77 TYR QD 5.100 . 5.100 5.131 5.026 5.174 0.074 1 0 "[ . 1]" 1
1972 1 76 ALA MB 1 78 ASN H 4.480 . 4.480 2.535 2.179 2.969 . 0 0 "[ . 1]" 1
1973 1 76 ALA MB 1 79 GLY H 3.880 . 3.880 3.230 2.971 3.451 . 0 0 "[ . 1]" 1
1974 1 76 ALA MB 1 80 ASN H 3.240 . 3.240 2.664 2.196 3.193 . 0 0 "[ . 1]" 1
1975 1 76 ALA MB 1 80 ASN HB2 3.360 . 3.360 2.581 2.025 3.413 0.053 7 0 "[ . 1]" 1
1976 1 76 ALA MB 1 80 ASN HB3 4.010 . 4.010 3.574 2.736 4.090 0.080 3 0 "[ . 1]" 1
1977 1 76 ALA MB 1 82 VAL HB 4.420 . 4.420 3.546 3.024 3.779 . 0 0 "[ . 1]" 1
1978 1 76 ALA MB 1 82 VAL MG1 3.810 . 3.810 3.766 3.389 3.840 0.030 9 0 "[ . 1]" 1
1979 1 76 ALA MB 1 82 VAL QG 2.650 . 2.650 1.895 1.816 1.977 . 0 0 "[ . 1]" 1
1980 1 76 ALA MB 1 82 VAL MG2 3.810 . 3.810 1.900 1.823 1.984 . 0 0 "[ . 1]" 1
1981 1 77 TYR HA 1 77 TYR QD 3.630 . 3.630 2.740 2.300 2.905 . 0 0 "[ . 1]" 1
1982 1 77 TYR HB2 1 78 ASN H 5.300 . 5.300 3.992 3.720 4.133 . 0 0 "[ . 1]" 1
1983 1 77 TYR HB3 1 78 ASN H 5.300 . 5.300 2.879 2.689 3.103 . 0 0 "[ . 1]" 1
1984 1 78 ASN H 1 79 GLY H 3.870 . 3.870 2.568 2.456 2.701 . 0 0 "[ . 1]" 1
1985 1 78 ASN H 1 80 ASN H 4.220 . 4.220 3.539 3.219 3.842 . 0 0 "[ . 1]" 1
1986 1 78 ASN HA 1 78 ASN QB 2.640 . 2.640 2.370 2.329 2.423 . 0 0 "[ . 1]" 1
1987 1 78 ASN QB 1 79 GLY H 4.090 . 4.090 3.372 3.062 3.584 . 0 0 "[ . 1]" 1
1988 1 78 ASN QB 1 79 GLY QA 4.960 . 4.960 4.204 3.904 4.460 . 0 0 "[ . 1]" 1
1989 1 78 ASN QB 1 80 ASN H 4.420 . 4.420 2.862 2.300 3.263 . 0 0 "[ . 1]" 1
1990 1 78 ASN HB2 1 79 GLY H 4.750 . 4.750 3.863 3.195 4.402 . 0 0 "[ . 1]" 1
1991 1 78 ASN HB3 1 79 GLY H 4.750 . 4.750 3.960 3.386 4.353 . 0 0 "[ . 1]" 1
1992 1 79 GLY H 1 80 ASN H 3.230 . 3.230 2.428 2.214 2.722 . 0 0 "[ . 1]" 1
1993 1 79 GLY QA 1 80 ASN HA 4.680 . 4.680 4.103 3.995 4.176 . 0 0 "[ . 1]" 1
1994 1 80 ASN H 1 80 ASN HB2 2.970 . 2.970 2.509 2.276 2.745 . 0 0 "[ . 1]" 1
1995 1 80 ASN H 1 80 ASN HB3 3.750 . 3.750 3.471 2.894 3.667 . 0 0 "[ . 1]" 1
1996 1 80 ASN H 1 80 ASN QD 4.420 . 4.420 3.587 2.684 4.437 0.017 7 0 "[ . 1]" 1
1997 1 80 ASN H 1 81 ARG H 4.760 . 4.760 4.589 4.531 4.655 . 0 0 "[ . 1]" 1
1998 1 80 ASN H 1 82 VAL QG 4.660 . 4.660 4.258 3.795 4.542 . 0 0 "[ . 1]" 1
1999 1 80 ASN HA 1 80 ASN QD 4.220 . 4.220 3.440 1.985 4.105 . 0 0 "[ . 1]" 1
2000 1 80 ASN HA 1 81 ARG H 2.880 . 2.880 2.264 2.165 2.370 . 0 0 "[ . 1]" 1
2001 1 80 ASN HB2 1 81 ARG H 4.110 . 4.110 4.004 3.778 4.139 0.029 6 0 "[ . 1]" 1
2002 1 80 ASN HB2 1 82 VAL QG 4.190 . 4.190 3.025 2.212 4.298 0.108 5 0 "[ . 1]" 1
2003 1 80 ASN HB3 1 81 ARG H 3.420 . 3.420 3.025 2.539 3.305 . 0 0 "[ . 1]" 1
2004 1 80 ASN HB3 1 82 VAL QG 4.000 . 4.000 2.991 2.644 3.519 . 0 0 "[ . 1]" 1
2005 1 81 ARG H 1 81 ARG HB2 3.400 . 3.400 2.508 2.384 2.593 . 0 0 "[ . 1]" 1
2006 1 81 ARG H 1 81 ARG HB3 3.310 . 3.310 2.715 2.645 2.785 . 0 0 "[ . 1]" 1
2007 1 81 ARG H 1 81 ARG QD 4.390 . 4.390 4.085 3.955 4.168 . 0 0 "[ . 1]" 1
2008 1 81 ARG H 1 81 ARG HG2 5.100 . 5.100 4.678 4.607 4.736 . 0 0 "[ . 1]" 1
2009 1 81 ARG H 1 81 ARG HG3 4.710 . 4.710 4.564 4.527 4.607 . 0 0 "[ . 1]" 1
2010 1 81 ARG H 1 82 VAL QG 4.610 . 4.610 4.093 4.002 4.197 . 0 0 "[ . 1]" 1
2011 1 81 ARG HA 1 81 ARG HD2 3.440 . 3.440 2.022 1.892 2.069 . 0 0 "[ . 1]" 1
2012 1 81 ARG HA 1 81 ARG QD 3.010 . 3.010 1.962 1.862 2.008 . 0 0 "[ . 1]" 1
2013 1 81 ARG HA 1 81 ARG HD3 3.440 . 3.440 2.660 2.540 2.785 . 0 0 "[ . 1]" 1
2014 1 81 ARG HA 1 81 ARG HG2 3.850 . 3.850 3.691 3.648 3.719 . 0 0 "[ . 1]" 1
2015 1 81 ARG HA 1 81 ARG HG3 4.000 . 4.000 3.029 2.906 3.115 . 0 0 "[ . 1]" 1
2016 1 81 ARG HA 1 82 VAL H 2.960 . 2.960 2.176 2.148 2.242 . 0 0 "[ . 1]" 1
2017 1 81 ARG HB2 1 81 ARG HD2 4.090 . 4.090 3.309 3.226 3.369 . 0 0 "[ . 1]" 1
2018 1 81 ARG HB2 1 81 ARG QD 3.480 . 3.480 2.482 2.409 2.542 . 0 0 "[ . 1]" 1
2019 1 81 ARG HB2 1 81 ARG HD3 4.090 . 4.090 2.565 2.477 2.638 . 0 0 "[ . 1]" 1
2020 1 81 ARG HB2 1 82 VAL H 4.540 . 4.540 4.505 4.416 4.550 0.010 4 0 "[ . 1]" 1
2021 1 81 ARG HB3 1 81 ARG HD2 4.200 . 4.200 3.740 3.707 3.777 . 0 0 "[ . 1]" 1
2022 1 81 ARG HB3 1 81 ARG QD 3.570 . 3.570 3.318 3.305 3.333 . 0 0 "[ . 1]" 1
2023 1 81 ARG HB3 1 81 ARG HD3 4.200 . 4.200 3.710 3.665 3.753 . 0 0 "[ . 1]" 1
2024 1 81 ARG QD 1 82 VAL QG 5.280 . 5.280 4.546 4.515 4.599 . 0 0 "[ . 1]" 1
2025 1 81 ARG HD2 1 82 VAL H 4.330 . 4.330 2.927 2.784 3.082 . 0 0 "[ . 1]" 1
2026 1 81 ARG HD3 1 82 VAL H 4.330 . 4.330 4.365 4.333 4.388 0.058 1 0 "[ . 1]" 1
2027 1 81 ARG HG2 1 82 VAL H 5.450 . 5.450 4.946 4.594 5.156 . 0 0 "[ . 1]" 1
2028 1 81 ARG HG3 1 82 VAL H 4.060 . 4.060 3.553 3.065 3.878 . 0 0 "[ . 1]" 1
2029 1 81 ARG HG3 1 82 VAL QG 5.440 . 5.440 4.897 4.698 5.056 . 0 0 "[ . 1]" 1
2030 1 82 VAL H 1 82 VAL HB 3.540 . 3.540 2.723 2.672 2.798 . 0 0 "[ . 1]" 1
2031 1 82 VAL H 1 82 VAL MG1 4.050 . 4.050 3.871 3.843 3.912 . 0 0 "[ . 1]" 1
2032 1 82 VAL H 1 82 VAL QG 3.090 . 3.090 2.516 2.379 2.733 . 0 0 "[ . 1]" 1
2033 1 82 VAL H 1 82 VAL MG2 4.050 . 4.050 2.551 2.402 2.790 . 0 0 "[ . 1]" 1
2034 1 82 VAL HA 1 82 VAL MG1 3.270 . 3.270 2.359 2.342 2.393 . 0 0 "[ . 1]" 1
2035 1 82 VAL HA 1 82 VAL QG 2.780 . 2.780 2.128 2.100 2.150 . 0 0 "[ . 1]" 1
2036 1 82 VAL HA 1 82 VAL MG2 3.270 . 3.270 2.422 2.363 2.453 . 0 0 "[ . 1]" 1
2037 1 82 VAL HA 1 83 TYR H 2.910 . 2.910 1.998 1.963 2.034 . 0 0 "[ . 1]" 1
2038 1 82 VAL HA 1 83 TYR HB2 5.500 . 5.500 4.267 4.221 4.356 . 0 0 "[ . 1]" 1
2039 1 82 VAL HA 1 83 TYR HB3 5.500 . 5.500 5.508 5.494 5.513 0.013 9 0 "[ . 1]" 1
2040 1 82 VAL HB 1 83 TYR H 4.370 . 4.370 3.946 3.896 3.987 . 0 0 "[ . 1]" 1
2041 1 82 VAL QG 1 83 TYR H 2.970 . 2.970 2.447 2.362 2.523 . 0 0 "[ . 1]" 1
2042 1 82 VAL QG 1 83 TYR HA 4.070 . 4.070 3.647 3.609 3.678 . 0 0 "[ . 1]" 1
2043 1 82 VAL QG 1 83 TYR QB 5.280 . 5.280 4.073 4.013 4.133 . 0 0 "[ . 1]" 1
2044 1 82 VAL QG 1 84 CYS H 4.470 . 4.470 4.029 3.828 4.478 0.008 5 0 "[ . 1]" 1
2045 1 82 VAL QG 1 84 CYS HB2 4.270 . 4.270 3.491 3.337 3.717 . 0 0 "[ . 1]" 1
2046 1 82 VAL QG 1 84 CYS HB3 4.750 . 4.750 4.652 4.502 4.796 0.046 5 0 "[ . 1]" 1
2047 1 82 VAL MG1 1 83 TYR H 4.320 . 4.320 2.474 2.384 2.553 . 0 0 "[ . 1]" 1
2048 1 82 VAL MG1 1 83 TYR HA 5.500 . 5.500 3.702 3.661 3.737 . 0 0 "[ . 1]" 1
2049 1 82 VAL MG2 1 83 TYR H 4.320 . 4.320 3.895 3.839 3.947 . 0 0 "[ . 1]" 1
2050 1 82 VAL MG2 1 83 TYR HA 5.500 . 5.500 5.486 5.455 5.502 0.002 4 0 "[ . 1]" 1
2051 1 83 TYR H 1 83 TYR HB2 4.190 . 4.190 2.522 2.462 2.582 . 0 0 "[ . 1]" 1
2052 1 83 TYR H 1 83 TYR QB 3.640 . 3.640 2.482 2.425 2.538 . 0 0 "[ . 1]" 1
2053 1 83 TYR H 1 83 TYR HB3 4.190 . 4.190 3.691 3.644 3.734 . 0 0 "[ . 1]" 1
2054 1 83 TYR H 1 83 TYR QD 4.100 . 4.100 3.055 2.725 3.220 . 0 0 "[ . 1]" 1
2055 1 83 TYR HA 1 83 TYR QD 4.030 . 4.030 2.878 2.785 2.968 . 0 0 "[ . 1]" 1
2056 1 83 TYR HA 1 84 CYS H 3.070 . 3.070 2.072 2.038 2.179 . 0 0 "[ . 1]" 1
2057 1 83 TYR QB 1 84 CYS H 3.860 . 3.860 3.133 2.624 3.286 . 0 0 "[ . 1]" 1
2058 1 83 TYR HB2 1 84 CYS H 4.530 . 4.530 4.209 3.888 4.318 . 0 0 "[ . 1]" 1
2059 1 83 TYR HB3 1 84 CYS H 4.530 . 4.530 3.235 2.667 3.406 . 0 0 "[ . 1]" 1
2060 1 84 CYS H 1 84 CYS HB2 3.740 . 3.740 3.022 2.949 3.256 . 0 0 "[ . 1]" 1
2061 1 84 CYS H 1 84 CYS HB3 3.600 . 3.600 2.571 2.502 2.728 . 0 0 "[ . 1]" 1
2062 1 84 CYS H 1 85 PRO HA 5.350 . 5.350 4.888 4.575 4.967 . 0 0 "[ . 1]" 1
2063 1 84 CYS H 1 85 PRO HD2 5.500 . 5.500 4.908 4.853 4.949 . 0 0 "[ . 1]" 1
2064 1 84 CYS H 1 86 VAL QG 4.990 . 4.990 4.257 4.224 4.304 . 0 0 "[ . 1]" 1
2065 1 84 CYS HA 1 85 PRO HB3 5.500 . 5.500 5.005 4.929 5.033 . 0 0 "[ . 1]" 1
2066 1 84 CYS HA 1 85 PRO HD2 3.250 . 3.250 2.242 2.166 2.295 . 0 0 "[ . 1]" 1
2067 1 84 CYS HA 1 85 PRO HD3 3.350 . 3.350 2.275 2.234 2.332 . 0 0 "[ . 1]" 1
2068 1 84 CYS HA 1 85 PRO HG2 4.410 . 4.410 4.392 4.343 4.421 0.011 5 0 "[ . 1]" 1
2069 1 84 CYS HA 1 85 PRO HG3 4.450 . 4.450 4.405 4.389 4.435 . 0 0 "[ . 1]" 1
2070 1 84 CYS HB2 1 85 PRO HD3 4.890 . 4.890 4.721 4.641 4.800 . 0 0 "[ . 1]" 1
2071 1 84 CYS HB2 1 86 VAL QG 5.280 . 5.280 4.507 4.411 4.732 . 0 0 "[ . 1]" 1
2072 1 84 CYS HB3 1 86 VAL QG 4.100 . 4.100 3.207 3.122 3.453 . 0 0 "[ . 1]" 1
2073 1 85 PRO HA 1 86 VAL H 3.160 . 3.160 2.119 2.097 2.129 . 0 0 "[ . 1]" 1
2074 1 85 PRO HA 1 86 VAL MG1 4.150 . 4.150 3.629 3.585 3.697 . 0 0 "[ . 1]" 1
2075 1 85 PRO HA 1 86 VAL QG 3.580 . 3.580 3.194 3.157 3.243 . 0 0 "[ . 1]" 1
2076 1 85 PRO HA 1 86 VAL MG2 4.150 . 4.150 3.546 3.501 3.589 . 0 0 "[ . 1]" 1
2077 1 85 PRO HA 1 87 ARG H 4.120 . 4.120 3.655 3.576 3.702 . 0 0 "[ . 1]" 1
2078 1 85 PRO HB2 1 102 TRP HH2 4.380 . 4.380 3.388 3.134 3.709 . 0 0 "[ . 1]" 1
2079 1 85 PRO HB2 1 102 TRP HZ3 3.850 . 3.850 2.067 1.943 2.214 . 0 0 "[ . 1]" 1
2080 1 85 PRO HB3 1 86 VAL H 4.370 . 4.370 3.954 3.893 4.072 . 0 0 "[ . 1]" 1
2081 1 85 PRO HB3 1 102 TRP HZ3 4.750 . 4.750 3.707 3.594 3.934 . 0 0 "[ . 1]" 1
2082 1 85 PRO HG2 1 102 TRP HE3 4.810 . 4.810 3.780 3.585 4.085 . 0 0 "[ . 1]" 1
2083 1 85 PRO HG2 1 102 TRP HH2 5.420 . 5.420 4.377 4.136 4.866 . 0 0 "[ . 1]" 1
2084 1 85 PRO HG2 1 102 TRP HZ3 3.800 . 3.800 2.332 2.094 2.796 . 0 0 "[ . 1]" 1
2085 1 85 PRO HG3 1 102 TRP HZ3 4.540 . 4.540 3.575 3.332 3.987 . 0 0 "[ . 1]" 1
2086 1 86 VAL H 1 86 VAL MG1 3.680 . 3.680 2.807 2.710 2.851 . 0 0 "[ . 1]" 1
2087 1 86 VAL H 1 86 VAL QG 2.850 . 2.850 1.970 1.927 2.004 . 0 0 "[ . 1]" 1
2088 1 86 VAL H 1 86 VAL MG2 3.680 . 3.680 2.013 1.972 2.047 . 0 0 "[ . 1]" 1
2089 1 86 VAL H 1 87 ARG H 3.100 . 3.100 2.046 2.000 2.128 . 0 0 "[ . 1]" 1
2090 1 86 VAL H 1 87 ARG HG2 4.640 . 4.640 3.850 3.711 3.975 . 0 0 "[ . 1]" 1
2091 1 86 VAL HA 1 86 VAL MG1 3.470 . 3.470 2.254 2.247 2.269 . 0 0 "[ . 1]" 1
2092 1 86 VAL HA 1 86 VAL QG 2.780 . 2.780 2.212 2.206 2.225 . 0 0 "[ . 1]" 1
2093 1 86 VAL HA 1 86 VAL MG2 3.470 . 3.470 3.204 3.201 3.209 . 0 0 "[ . 1]" 1
2094 1 86 VAL HA 1 102 TRP HB2 4.510 . 4.510 2.900 2.785 2.996 . 0 0 "[ . 1]" 1
2095 1 86 VAL HA 1 102 TRP HB3 4.640 . 4.640 4.542 4.418 4.640 . 0 0 "[ . 1]" 1
2096 1 86 VAL HA 1 102 TRP HE3 3.360 . 3.360 2.898 2.664 3.152 . 0 0 "[ . 1]" 1
2097 1 86 VAL HB 1 87 ARG H 4.160 . 4.160 4.117 4.096 4.149 . 0 0 "[ . 1]" 1
2098 1 86 VAL HB 1 87 ARG HB3 4.370 . 4.370 4.119 4.006 4.316 . 0 0 "[ . 1]" 1
2099 1 86 VAL HB 1 87 ARG QD 4.830 . 4.830 3.830 3.519 4.026 . 0 0 "[ . 1]" 1
2100 1 86 VAL HB 1 102 TRP H 4.370 . 4.370 3.596 3.519 3.644 . 0 0 "[ . 1]" 1
2101 1 86 VAL HB 1 102 TRP HE3 5.500 . 5.500 5.239 4.964 5.519 0.019 7 0 "[ . 1]" 1
2102 1 86 VAL HB 1 105 PHE QE 4.220 . 4.220 2.960 2.806 3.195 . 0 0 "[ . 1]" 1
2103 1 86 VAL HB 1 105 PHE HZ 3.720 . 3.720 2.099 2.038 2.243 . 0 0 "[ . 1]" 1
2104 1 86 VAL QG 1 87 ARG H 3.310 . 3.310 2.746 2.698 2.805 . 0 0 "[ . 1]" 1
2105 1 86 VAL QG 1 87 ARG HA 4.750 . 4.750 4.257 4.224 4.289 . 0 0 "[ . 1]" 1
2106 1 86 VAL QG 1 87 ARG HB2 4.690 . 4.690 4.364 4.305 4.405 . 0 0 "[ . 1]" 1
2107 1 86 VAL QG 1 87 ARG HB3 4.490 . 4.490 3.389 3.264 3.595 . 0 0 "[ . 1]" 1
2108 1 86 VAL QG 1 87 ARG QD 3.750 . 3.750 2.694 2.542 2.798 . 0 0 "[ . 1]" 1
2109 1 86 VAL QG 1 87 ARG HG2 3.470 . 3.470 2.016 1.984 2.058 . 0 0 "[ . 1]" 1
2110 1 86 VAL QG 1 87 ARG HG3 3.910 . 3.910 3.605 3.547 3.662 . 0 0 "[ . 1]" 1
2111 1 86 VAL QG 1 101 ALA MB 3.930 . 3.930 3.926 3.860 3.965 0.035 6 0 "[ . 1]" 1
2112 1 86 VAL QG 1 102 TRP H 4.050 . 4.050 4.053 4.018 4.076 0.026 8 0 "[ . 1]" 1
2113 1 86 VAL QG 1 102 TRP HB2 4.830 . 4.830 4.036 3.956 4.109 . 0 0 "[ . 1]" 1
2114 1 86 VAL QG 1 102 TRP HB3 5.440 . 5.440 5.273 5.178 5.392 . 0 0 "[ . 1]" 1
2115 1 86 VAL QG 1 102 TRP HE3 4.790 . 4.790 4.263 4.112 4.418 . 0 0 "[ . 1]" 1
2116 1 86 VAL QG 1 105 PHE QD 5.210 . 5.210 3.813 3.762 3.942 . 0 0 "[ . 1]" 1
2117 1 86 VAL QG 1 105 PHE QE 3.180 . 3.180 2.094 2.043 2.216 . 0 0 "[ . 1]" 1
2118 1 86 VAL QG 1 105 PHE HZ 2.920 . 2.920 2.104 2.037 2.143 . 0 0 "[ . 1]" 1
2119 1 86 VAL MG1 1 87 ARG H 4.250 . 4.250 4.157 4.130 4.173 . 0 0 "[ . 1]" 1
2120 1 86 VAL MG1 1 101 ALA MB 5.070 . 5.070 4.854 4.710 4.988 . 0 0 "[ . 1]" 1
2121 1 86 VAL MG1 1 102 TRP H 4.610 . 4.610 4.635 4.608 4.659 0.049 8 0 "[ . 1]" 1
2122 1 86 VAL MG1 1 105 PHE QE 3.890 . 3.890 2.352 2.297 2.475 . 0 0 "[ . 1]" 1
2123 1 86 VAL MG1 1 105 PHE HZ 3.800 . 3.800 3.300 3.211 3.351 . 0 0 "[ . 1]" 1
2124 1 86 VAL MG2 1 87 ARG H 4.250 . 4.250 2.786 2.734 2.852 . 0 0 "[ . 1]" 1
2125 1 86 VAL MG2 1 101 ALA MB 5.070 . 5.070 4.147 4.092 4.188 . 0 0 "[ . 1]" 1
2126 1 86 VAL MG2 1 102 TRP H 4.610 . 4.610 4.475 4.414 4.518 . 0 0 "[ . 1]" 1
2127 1 86 VAL MG2 1 105 PHE QE 3.890 . 3.890 2.350 2.245 2.501 . 0 0 "[ . 1]" 1
2128 1 86 VAL MG2 1 105 PHE HZ 3.800 . 3.800 2.129 2.056 2.170 . 0 0 "[ . 1]" 1
2129 1 87 ARG H 1 87 ARG HG2 3.630 . 3.630 2.815 2.744 2.887 . 0 0 "[ . 1]" 1
2130 1 87 ARG H 1 87 ARG HG3 4.230 . 4.230 3.911 3.835 4.075 . 0 0 "[ . 1]" 1
2131 1 87 ARG H 1 88 THR MG 5.380 . 5.380 4.754 4.669 4.894 . 0 0 "[ . 1]" 1
2132 1 87 ARG HA 1 87 ARG QD 4.980 . 4.980 4.413 4.095 4.525 . 0 0 "[ . 1]" 1
2133 1 87 ARG HA 1 88 THR H 3.160 . 3.160 2.530 2.461 2.576 . 0 0 "[ . 1]" 1
2134 1 87 ARG HA 1 88 THR MG 4.280 . 4.280 3.619 3.454 3.808 . 0 0 "[ . 1]" 1
2135 1 87 ARG HA 1 101 ALA HA 4.490 . 4.490 3.562 3.273 3.845 . 0 0 "[ . 1]" 1
2136 1 87 ARG HA 1 101 ALA MB 5.330 . 5.330 4.956 4.697 5.206 . 0 0 "[ . 1]" 1
2137 1 87 ARG HA 1 102 TRP H 4.610 . 4.610 3.828 3.717 4.020 . 0 0 "[ . 1]" 1
2138 1 87 ARG HA 1 102 TRP HD1 5.080 . 5.080 4.520 4.135 4.869 . 0 0 "[ . 1]" 1
2139 1 87 ARG HA 1 102 TRP HE1 4.050 . 4.050 3.860 3.305 4.059 0.009 4 0 "[ . 1]" 1
2140 1 87 ARG HA 1 102 TRP HZ2 4.910 . 4.910 3.953 3.709 4.240 . 0 0 "[ . 1]" 1
2141 1 87 ARG HB2 1 88 THR H 3.400 . 3.400 2.342 2.186 2.468 . 0 0 "[ . 1]" 1
2142 1 87 ARG HB2 1 98 PRO HB2 5.130 . 5.130 4.378 3.942 4.883 . 0 0 "[ . 1]" 1
2143 1 87 ARG HB2 1 99 GLY H 4.090 . 4.090 3.342 3.154 3.613 . 0 0 "[ . 1]" 1
2144 1 87 ARG HB2 1 99 GLY QA 4.860 . 4.860 3.685 3.315 3.963 . 0 0 "[ . 1]" 1
2145 1 87 ARG HB2 1 101 ALA HA 3.970 . 3.970 3.115 2.808 3.415 . 0 0 "[ . 1]" 1
2146 1 87 ARG HB2 1 101 ALA MB 4.770 . 4.770 4.171 3.799 4.468 . 0 0 "[ . 1]" 1
2147 1 87 ARG HB3 1 88 THR H 3.860 . 3.860 3.729 3.586 3.806 . 0 0 "[ . 1]" 1
2148 1 87 ARG HB3 1 101 ALA HA 3.170 . 3.170 1.852 1.804 1.916 . 0 0 "[ . 1]" 1
2149 1 87 ARG HB3 1 101 ALA MB 3.630 . 3.630 3.174 2.942 3.395 . 0 0 "[ . 1]" 1
2150 1 87 ARG HB3 1 102 TRP H 3.720 . 3.720 3.115 3.013 3.235 . 0 0 "[ . 1]" 1
2151 1 87 ARG HB3 1 102 TRP HB2 5.500 . 5.500 4.974 4.794 5.207 . 0 0 "[ . 1]" 1
2152 1 87 ARG HB3 1 105 PHE QE 5.100 . 5.100 4.269 4.048 4.568 . 0 0 "[ . 1]" 1
2153 1 87 ARG QD 1 98 PRO HB2 4.810 . 4.810 3.319 3.082 3.464 . 0 0 "[ . 1]" 1
2154 1 87 ARG QD 1 99 GLY H 5.500 . 5.500 4.749 4.109 4.947 . 0 0 "[ . 1]" 1
2155 1 87 ARG QD 1 101 ALA HA 4.310 . 4.310 3.039 2.444 3.412 . 0 0 "[ . 1]" 1
2156 1 87 ARG QD 1 101 ALA MB 4.120 . 4.120 2.699 2.375 2.855 . 0 0 "[ . 1]" 1
2157 1 87 ARG QD 1 102 TRP H 5.500 . 5.500 4.352 3.864 4.609 . 0 0 "[ . 1]" 1
2158 1 87 ARG QD 1 105 PHE QE 4.310 . 4.310 2.614 2.532 2.699 . 0 0 "[ . 1]" 1
2159 1 87 ARG QD 1 105 PHE HZ 4.720 . 4.720 2.611 2.463 2.765 . 0 0 "[ . 1]" 1
2160 1 87 ARG HG2 1 98 PRO HB2 5.500 . 5.500 4.988 4.577 5.128 . 0 0 "[ . 1]" 1
2161 1 87 ARG HG3 1 88 THR H 4.730 . 4.730 3.484 3.320 3.681 . 0 0 "[ . 1]" 1
2162 1 87 ARG HG3 1 98 PRO HA 4.830 . 4.830 3.638 3.502 3.744 . 0 0 "[ . 1]" 1
2163 1 87 ARG HG3 1 98 PRO HB2 4.290 . 4.290 3.582 3.130 3.766 . 0 0 "[ . 1]" 1
2164 1 87 ARG HG3 1 99 GLY H 4.170 . 4.170 3.482 3.214 3.589 . 0 0 "[ . 1]" 1
2165 1 87 ARG HG3 1 101 ALA HA 5.450 . 5.450 4.642 4.506 4.754 . 0 0 "[ . 1]" 1
2166 1 87 ARG HG3 1 101 ALA MB 5.090 . 5.090 4.954 4.806 5.091 0.001 7 0 "[ . 1]" 1
2167 1 87 ARG HG3 1 105 PHE QE 5.500 . 5.500 5.450 5.231 5.551 0.051 9 0 "[ . 1]" 1
2168 1 88 THR H 1 88 THR HB 4.190 . 4.190 3.515 3.420 3.657 . 0 0 "[ . 1]" 1
2169 1 88 THR H 1 88 THR MG 3.020 . 3.020 2.694 2.558 2.886 . 0 0 "[ . 1]" 1
2170 1 88 THR H 1 99 GLY H 4.230 . 4.230 3.067 2.971 3.169 . 0 0 "[ . 1]" 1
2171 1 88 THR H 1 99 GLY QA 4.390 . 4.390 3.125 2.859 3.303 . 0 0 "[ . 1]" 1
2172 1 88 THR H 1 100 VAL QG 4.900 . 4.900 4.550 4.292 4.874 . 0 0 "[ . 1]" 1
2173 1 88 THR H 1 102 TRP HE1 5.140 . 5.140 4.781 4.263 5.032 . 0 0 "[ . 1]" 1
2174 1 88 THR HA 1 88 THR MG 3.010 . 3.010 2.268 2.192 2.346 . 0 0 "[ . 1]" 1
2175 1 88 THR HA 1 89 CYS H 2.990 . 2.990 2.455 2.400 2.527 . 0 0 "[ . 1]" 1
2176 1 88 THR HB 1 89 CYS H 2.920 . 2.920 2.475 2.364 2.565 . 0 0 "[ . 1]" 1
2177 1 88 THR MG 1 89 CYS H 3.760 . 3.760 3.534 3.331 3.683 . 0 0 "[ . 1]" 1
2178 1 88 THR MG 1 102 TRP HE1 4.640 . 4.640 4.150 3.934 4.336 . 0 0 "[ . 1]" 1
2179 1 88 THR MG 1 102 TRP HH2 3.860 . 3.860 3.328 2.994 3.754 . 0 0 "[ . 1]" 1
2180 1 88 THR MG 1 102 TRP HZ2 3.270 . 3.270 2.541 2.227 2.832 . 0 0 "[ . 1]" 1
2181 1 88 THR MG 1 102 TRP HZ3 5.500 . 5.500 5.046 4.757 5.359 . 0 0 "[ . 1]" 1
2182 1 89 CYS H 1 89 CYS HB2 3.770 . 3.770 3.343 3.302 3.399 . 0 0 "[ . 1]" 1
2183 1 89 CYS H 1 89 CYS HB3 3.600 . 3.600 2.841 2.750 2.921 . 0 0 "[ . 1]" 1
2184 1 89 CYS H 1 90 GLN HB2 5.470 . 5.470 5.435 5.338 5.550 0.080 9 0 "[ . 1]" 1
2185 1 89 CYS H 1 99 GLY H 5.500 . 5.500 4.525 4.364 4.723 . 0 0 "[ . 1]" 1
2186 1 89 CYS HA 1 90 GLN H 2.970 . 2.970 2.086 2.053 2.159 . 0 0 "[ . 1]" 1
2187 1 89 CYS HA 1 90 GLN HB2 4.560 . 4.560 4.328 4.043 4.475 . 0 0 "[ . 1]" 1
2188 1 89 CYS HB2 1 90 GLN H 4.750 . 4.750 4.224 4.166 4.260 . 0 0 "[ . 1]" 1
2189 1 89 CYS HB2 1 98 PRO HB2 5.210 . 5.210 5.226 5.212 5.242 0.032 2 0 "[ . 1]" 1
2190 1 89 CYS HB2 1 99 GLY H 5.320 . 5.320 4.400 4.205 4.766 . 0 0 "[ . 1]" 1
2191 1 89 CYS HB3 1 90 GLN H 4.990 . 4.990 4.235 4.105 4.308 . 0 0 "[ . 1]" 1
2192 1 90 GLN H 1 90 GLN HB2 3.440 . 3.440 2.430 2.077 2.580 . 0 0 "[ . 1]" 1
2193 1 90 GLN H 1 90 GLN HB3 3.590 . 3.590 2.777 2.574 3.442 . 0 0 "[ . 1]" 1
2194 1 90 GLN H 1 90 GLN HG2 4.670 . 4.670 4.463 4.058 4.558 . 0 0 "[ . 1]" 1
2195 1 90 GLN H 1 90 GLN HG3 4.670 . 4.670 4.311 3.165 4.651 . 0 0 "[ . 1]" 1
2196 1 90 GLN H 1 91 GLY H 4.450 . 4.450 4.177 4.006 4.296 . 0 0 "[ . 1]" 1
2197 1 90 GLN H 1 96 GLN HB2 5.500 . 5.500 5.195 4.907 5.480 . 0 0 "[ . 1]" 1
2198 1 90 GLN H 1 97 ILE H 3.840 . 3.840 2.978 2.789 3.215 . 0 0 "[ . 1]" 1
2199 1 90 GLN H 1 97 ILE HB 4.000 . 4.000 2.512 2.274 2.668 . 0 0 "[ . 1]" 1
2200 1 90 GLN H 1 97 ILE MD 4.850 . 4.850 4.356 4.188 4.525 . 0 0 "[ . 1]" 1
2201 1 90 GLN H 1 97 ILE HG13 4.990 . 4.990 4.586 4.376 4.756 . 0 0 "[ . 1]" 1
2202 1 90 GLN H 1 97 ILE MG 4.070 . 4.070 3.453 3.212 3.628 . 0 0 "[ . 1]" 1
2203 1 90 GLN H 1 99 GLY H 5.500 . 5.500 4.611 4.389 4.884 . 0 0 "[ . 1]" 1
2204 1 90 GLN HA 1 90 GLN HG2 3.910 . 3.910 2.798 2.327 3.107 . 0 0 "[ . 1]" 1
2205 1 90 GLN HA 1 90 GLN HG3 3.910 . 3.910 2.637 2.369 3.669 . 0 0 "[ . 1]" 1
2206 1 90 GLN HA 1 91 GLY H 3.090 . 3.090 2.152 2.063 2.282 . 0 0 "[ . 1]" 1
2207 1 90 GLN HA 1 91 GLY HA2 4.510 . 4.510 4.319 4.255 4.359 . 0 0 "[ . 1]" 1
2208 1 90 GLN HA 1 91 GLY HA3 4.540 . 4.540 4.332 4.282 4.356 . 0 0 "[ . 1]" 1
2209 1 90 GLN HA 1 97 ILE HB 4.710 . 4.710 4.303 4.165 4.386 . 0 0 "[ . 1]" 1
2210 1 90 GLN HB2 1 91 GLY H 4.730 . 4.730 4.548 4.386 4.649 . 0 0 "[ . 1]" 1
2211 1 90 GLN HB2 1 97 ILE H 4.940 . 4.940 4.663 3.600 4.962 0.022 6 0 "[ . 1]" 1
2212 1 90 GLN HB2 1 97 ILE HB 3.380 . 3.380 2.677 1.839 2.900 . 0 0 "[ . 1]" 1
2213 1 90 GLN HB2 1 97 ILE MD 3.880 . 3.880 3.560 3.029 3.690 . 0 0 "[ . 1]" 1
2214 1 90 GLN HB2 1 97 ILE HG12 5.500 . 5.500 5.474 4.770 5.569 0.069 7 0 "[ . 1]" 1
2215 1 90 GLN HB2 1 97 ILE MG 3.750 . 3.750 3.253 3.025 3.439 . 0 0 "[ . 1]" 1
2216 1 90 GLN HB3 1 91 GLY H 4.540 . 4.540 4.135 3.692 4.269 . 0 0 "[ . 1]" 1
2217 1 90 GLN HB3 1 91 GLY HA2 5.500 . 5.500 5.423 5.027 5.530 0.030 4 0 "[ . 1]" 1
2218 1 90 GLN HB3 1 91 GLY HA3 4.890 . 4.890 4.427 4.213 4.510 . 0 0 "[ . 1]" 1
2219 1 90 GLN HB3 1 97 ILE H 4.210 . 4.210 3.857 3.533 4.220 0.010 9 0 "[ . 1]" 1
2220 1 90 GLN HB3 1 97 ILE HB 3.410 . 3.410 1.981 1.799 2.853 . 0 0 "[ . 1]" 1
2221 1 90 GLN HB3 1 97 ILE MD 3.770 . 3.770 2.365 2.198 2.638 . 0 0 "[ . 1]" 1
2222 1 90 GLN HB3 1 97 ILE HG13 4.540 . 4.540 3.581 3.335 4.107 . 0 0 "[ . 1]" 1
2223 1 90 GLN HB3 1 97 ILE MG 3.990 . 3.990 3.228 2.798 4.002 0.012 9 0 "[ . 1]" 1
2224 1 90 GLN QE 1 97 ILE MD 4.260 . 4.260 2.541 1.638 3.902 . 0 0 "[ . 1]" 1
2225 1 90 GLN HE21 1 97 ILE MD 4.990 . 4.990 2.773 1.651 4.594 . 0 0 "[ . 1]" 1
2226 1 90 GLN HE22 1 97 ILE MD 4.990 . 4.990 3.198 2.614 4.220 . 0 0 "[ . 1]" 1
2227 1 90 GLN QG 1 91 GLY H 4.110 . 4.110 3.471 3.116 3.852 . 0 0 "[ . 1]" 1
2228 1 90 GLN QG 1 97 ILE HB 4.640 . 4.640 3.942 3.761 4.164 . 0 0 "[ . 1]" 1
2229 1 90 GLN QG 1 97 ILE MD 4.090 . 4.090 3.396 3.005 4.172 0.082 9 0 "[ . 1]" 1
2230 1 90 GLN QG 1 97 ILE MG 4.830 . 4.830 4.375 3.792 4.646 . 0 0 "[ . 1]" 1
2231 1 90 GLN HG2 1 91 GLY H 4.910 . 4.910 3.728 3.304 4.021 . 0 0 "[ . 1]" 1
2232 1 90 GLN HG2 1 97 ILE MG 5.500 . 5.500 4.981 4.707 5.237 . 0 0 "[ . 1]" 1
2233 1 90 GLN HG3 1 91 GLY H 4.910 . 4.910 4.210 3.784 4.934 0.024 5 0 "[ . 1]" 1
2234 1 90 GLN HG3 1 97 ILE MG 5.500 . 5.500 4.930 3.938 5.335 . 0 0 "[ . 1]" 1
2235 1 91 GLY H 1 92 VAL H 4.650 . 4.650 4.470 4.292 4.540 . 0 0 "[ . 1]" 1
2236 1 91 GLY H 1 92 VAL MG1 5.080 . 5.080 4.634 4.536 4.743 . 0 0 "[ . 1]" 1
2237 1 91 GLY H 1 97 ILE H 5.210 . 5.210 5.059 4.807 5.252 0.042 2 0 "[ . 1]" 1
2238 1 91 GLY HA2 1 92 VAL H 3.090 . 3.090 2.626 2.293 2.841 . 0 0 "[ . 1]" 1
2239 1 91 GLY HA2 1 92 VAL MG1 4.010 . 4.010 3.524 3.452 3.589 . 0 0 "[ . 1]" 1
2240 1 91 GLY HA2 1 92 VAL MG2 4.090 . 4.090 3.677 3.526 3.860 . 0 0 "[ . 1]" 1
2241 1 91 GLY HA3 1 92 VAL H 2.970 . 2.970 2.412 2.242 2.618 . 0 0 "[ . 1]" 1
2242 1 91 GLY HA3 1 92 VAL MG2 4.170 . 4.170 4.057 3.857 4.205 0.035 9 0 "[ . 1]" 1
2243 1 91 GLY HA3 1 97 ILE H 4.900 . 4.900 4.607 4.267 4.904 0.004 2 0 "[ . 1]" 1
2244 1 92 VAL H 1 92 VAL HB 4.200 . 4.200 3.746 3.664 3.788 . 0 0 "[ . 1]" 1
2245 1 92 VAL H 1 92 VAL MG1 3.420 . 3.420 2.994 2.691 3.204 . 0 0 "[ . 1]" 1
2246 1 92 VAL H 1 92 VAL MG2 2.880 . 2.880 2.103 1.950 2.211 . 0 0 "[ . 1]" 1
2247 1 92 VAL H 1 93 PRO HD2 4.830 . 4.830 4.819 4.795 4.834 0.004 6 0 "[ . 1]" 1
2248 1 92 VAL H 1 93 PRO HD3 5.270 . 5.270 5.007 4.896 5.097 . 0 0 "[ . 1]" 1
2249 1 92 VAL H 1 96 GLN HA 4.560 . 4.560 4.296 3.950 4.564 0.004 4 0 "[ . 1]" 1
2250 1 92 VAL HA 1 92 VAL MG1 2.810 . 2.810 2.276 2.244 2.293 . 0 0 "[ . 1]" 1
2251 1 92 VAL HA 1 92 VAL MG2 3.310 . 3.310 3.219 3.206 3.233 . 0 0 "[ . 1]" 1
2252 1 92 VAL HA 1 93 PRO HD2 3.100 . 3.100 2.522 2.483 2.611 . 0 0 "[ . 1]" 1
2253 1 92 VAL HA 1 93 PRO HD3 2.940 . 2.940 2.367 2.300 2.445 . 0 0 "[ . 1]" 1
2254 1 92 VAL HA 1 93 PRO HG2 4.680 . 4.680 4.571 4.517 4.651 . 0 0 "[ . 1]" 1
2255 1 92 VAL HB 1 93 PRO HD2 3.170 . 3.170 1.971 1.880 2.054 . 0 0 "[ . 1]" 1
2256 1 92 VAL HB 1 93 PRO HD3 3.470 . 3.470 3.394 3.284 3.455 . 0 0 "[ . 1]" 1
2257 1 92 VAL HB 1 93 PRO HG2 4.310 . 4.310 3.702 3.641 3.780 . 0 0 "[ . 1]" 1
2258 1 92 VAL HB 1 93 PRO HG3 5.500 . 5.500 4.622 4.543 4.704 . 0 0 "[ . 1]" 1
2259 1 92 VAL MG1 1 93 PRO HD2 3.640 . 3.640 2.935 2.904 2.983 . 0 0 "[ . 1]" 1
2260 1 92 VAL MG1 1 93 PRO HD3 3.600 . 3.600 3.622 3.590 3.637 0.037 6 0 "[ . 1]" 1
2261 1 92 VAL MG1 1 93 PRO HG2 4.710 . 4.710 4.765 4.749 4.779 0.069 9 0 "[ . 1]" 1
2262 1 92 VAL MG2 1 93 PRO HD2 3.720 . 3.720 3.610 3.507 3.690 . 0 0 "[ . 1]" 1
2263 1 92 VAL MG2 1 93 PRO HD3 4.610 . 4.610 4.538 4.434 4.577 . 0 0 "[ . 1]" 1
2264 1 92 VAL MG2 1 93 PRO HG2 5.100 . 5.100 4.735 4.620 4.853 . 0 0 "[ . 1]" 1
2265 1 92 VAL MG2 1 94 PRO QD 4.990 . 4.990 4.488 4.391 4.603 . 0 0 "[ . 1]" 1
2266 1 92 VAL MG2 1 95 ASN H 5.040 . 5.040 4.943 4.644 5.062 0.022 6 0 "[ . 1]" 1
2267 1 93 PRO HA 1 94 PRO HA 2.920 . 2.920 2.801 2.664 2.889 . 0 0 "[ . 1]" 1
2268 1 93 PRO HA 1 94 PRO HB2 4.870 . 4.870 4.700 4.616 4.779 . 0 0 "[ . 1]" 1
2269 1 93 PRO HA 1 94 PRO QB 4.270 . 4.270 4.244 4.185 4.288 0.018 9 0 "[ . 1]" 1
2270 1 93 PRO HA 1 94 PRO HB3 4.870 . 4.870 4.835 4.773 4.891 0.021 6 0 "[ . 1]" 1
2271 1 93 PRO HA 1 94 PRO QD 4.690 . 4.690 4.053 3.996 4.115 . 0 0 "[ . 1]" 1
2272 1 93 PRO HA 1 95 ASN H 3.360 . 3.360 2.681 2.273 2.807 . 0 0 "[ . 1]" 1
2273 1 93 PRO HA 1 96 GLN H 3.480 . 3.480 2.731 2.637 2.815 . 0 0 "[ . 1]" 1
2274 1 93 PRO HA 1 96 GLN HB3 4.360 . 4.360 2.492 2.407 2.767 . 0 0 "[ . 1]" 1
2275 1 93 PRO HA 1 96 GLN HG2 4.540 . 4.540 4.272 3.961 4.621 0.081 9 0 "[ . 1]" 1
2276 1 93 PRO QB 1 94 PRO HA 3.110 . 3.110 2.046 2.017 2.090 . 0 0 "[ . 1]" 1
2277 1 93 PRO QB 1 94 PRO QB 4.430 . 4.430 3.613 3.517 3.671 . 0 0 "[ . 1]" 1
2278 1 93 PRO QB 1 95 ASN H 4.160 . 4.160 4.115 3.891 4.186 0.026 3 0 "[ . 1]" 1
2279 1 93 PRO QB 1 96 GLN H 4.090 . 4.090 3.611 3.452 3.712 . 0 0 "[ . 1]" 1
2280 1 93 PRO HB2 1 94 PRO HA 3.600 . 3.600 2.099 2.074 2.164 . 0 0 "[ . 1]" 1
2281 1 93 PRO HB2 1 95 ASN H 4.780 . 4.780 4.527 4.342 4.622 . 0 0 "[ . 1]" 1
2282 1 93 PRO HB2 1 96 GLN H 4.780 . 4.780 4.842 4.816 4.858 0.078 5 0 "[ . 1]" 1
2283 1 93 PRO HB3 1 94 PRO HA 3.600 . 3.600 2.843 2.740 2.904 . 0 0 "[ . 1]" 1
2284 1 93 PRO HB3 1 95 ASN H 4.780 . 4.780 4.729 4.394 4.814 0.034 3 0 "[ . 1]" 1
2285 1 93 PRO HB3 1 96 GLN H 4.780 . 4.780 3.727 3.537 3.854 . 0 0 "[ . 1]" 1
2286 1 93 PRO HD3 1 96 GLN HB3 3.630 . 3.630 2.699 2.495 2.872 . 0 0 "[ . 1]" 1
2287 1 93 PRO HD3 1 96 GLN QE 5.120 . 5.120 3.930 2.829 4.483 . 0 0 "[ . 1]" 1
2288 1 93 PRO HG2 1 94 PRO HA 4.940 . 4.940 4.375 4.330 4.463 . 0 0 "[ . 1]" 1
2289 1 93 PRO HG3 1 94 PRO HA 4.610 . 4.610 4.646 4.619 4.658 0.048 3 0 "[ . 1]" 1
2290 1 93 PRO HG3 1 96 GLN QE 4.730 . 4.730 3.547 2.366 4.175 . 0 0 "[ . 1]" 1
2291 1 94 PRO HA 1 96 GLN H 4.290 . 4.290 4.162 3.984 4.295 0.005 2 0 "[ . 1]" 1
2292 1 94 PRO QB 1 95 ASN H 4.100 . 4.100 3.436 3.282 3.637 . 0 0 "[ . 1]" 1
2293 1 94 PRO QD 1 95 ASN H 3.810 . 3.810 2.713 2.555 3.050 . 0 0 "[ . 1]" 1
2294 1 94 PRO QD 1 95 ASN QB 4.800 . 4.800 4.371 4.031 4.822 0.022 6 0 "[ . 1]" 1
2295 1 94 PRO QD 1 95 ASN HD21 5.120 . 5.120 4.195 3.507 4.764 . 0 0 "[ . 1]" 1
2296 1 94 PRO QD 1 95 ASN QD 4.260 . 4.260 3.889 3.065 4.302 0.042 4 0 "[ . 1]" 1
2297 1 94 PRO QD 1 95 ASN HD22 5.120 . 5.120 4.748 3.382 5.126 0.006 9 0 "[ . 1]" 1
2298 1 94 PRO HG2 1 95 ASN H 4.370 . 4.370 2.827 2.579 3.200 . 0 0 "[ . 1]" 1
2299 1 94 PRO HG2 1 95 ASN QB 5.310 . 5.310 4.210 4.023 4.504 . 0 0 "[ . 1]" 1
2300 1 94 PRO HG3 1 95 ASN H 4.770 . 4.770 4.231 4.067 4.555 . 0 0 "[ . 1]" 1
2301 1 95 ASN H 1 95 ASN HB2 3.710 . 3.710 2.651 2.480 3.670 . 0 0 "[ . 1]" 1
2302 1 95 ASN H 1 95 ASN QB 3.090 . 3.090 2.543 2.441 2.965 . 0 0 "[ . 1]" 1
2303 1 95 ASN H 1 95 ASN HB3 3.710 . 3.710 3.632 3.131 3.734 0.024 2 0 "[ . 1]" 1
2304 1 95 ASN H 1 95 ASN QD 4.340 . 4.340 3.164 2.453 3.770 . 0 0 "[ . 1]" 1
2305 1 95 ASN H 1 96 GLN H 3.720 . 3.720 3.690 3.608 3.736 0.016 6 0 "[ . 1]" 1
2306 1 95 ASN H 1 96 GLN HB3 4.960 . 4.960 4.905 4.761 4.977 0.017 3 0 "[ . 1]" 1
2307 1 95 ASN HA 1 97 ILE MD 5.500 . 5.500 5.549 5.528 5.569 0.069 8 0 "[ . 1]" 1
2308 1 95 ASN QB 1 96 GLN H 4.190 . 4.190 3.795 3.750 3.825 . 0 0 "[ . 1]" 1
2309 1 95 ASN QB 1 97 ILE MD 4.940 . 4.940 4.110 3.927 4.344 . 0 0 "[ . 1]" 1
2310 1 95 ASN HB2 1 96 GLN H 4.840 . 4.840 4.418 4.125 4.508 . 0 0 "[ . 1]" 1
2311 1 95 ASN HB3 1 96 GLN H 4.840 . 4.840 4.148 4.038 4.434 . 0 0 "[ . 1]" 1
2312 1 96 GLN H 1 96 GLN HB2 3.760 . 3.760 3.670 3.604 3.719 . 0 0 "[ . 1]" 1
2313 1 96 GLN H 1 96 GLN HB3 3.470 . 3.470 2.703 2.599 2.811 . 0 0 "[ . 1]" 1
2314 1 96 GLN H 1 96 GLN HG2 4.040 . 4.040 2.387 2.158 2.869 . 0 0 "[ . 1]" 1
2315 1 96 GLN H 1 96 GLN HG3 4.220 . 4.220 3.706 3.566 3.952 . 0 0 "[ . 1]" 1
2316 1 96 GLN HA 1 96 GLN HG2 3.990 . 3.990 3.621 3.500 3.722 . 0 0 "[ . 1]" 1
2317 1 96 GLN HA 1 96 GLN HG3 4.150 . 4.150 3.929 3.734 4.219 0.069 8 0 "[ . 1]" 1
2318 1 96 GLN HA 1 97 ILE H 2.890 . 2.890 2.254 2.185 2.296 . 0 0 "[ . 1]" 1
2319 1 96 GLN HA 1 97 ILE HA 4.570 . 4.570 4.373 4.345 4.407 . 0 0 "[ . 1]" 1
2320 1 96 GLN HA 1 97 ILE HB 4.740 . 4.740 4.593 4.461 4.657 . 0 0 "[ . 1]" 1
2321 1 96 GLN HA 1 97 ILE HG13 3.980 . 3.980 3.472 3.334 3.626 . 0 0 "[ . 1]" 1
2322 1 96 GLN HA 1 98 PRO HD3 4.610 . 4.610 4.583 4.539 4.627 0.017 9 0 "[ . 1]" 1
2323 1 96 GLN HB2 1 97 ILE H 3.740 . 3.740 2.858 2.749 3.054 . 0 0 "[ . 1]" 1
2324 1 96 GLN HB3 1 97 ILE H 4.340 . 4.340 4.061 4.005 4.150 . 0 0 "[ . 1]" 1
2325 1 96 GLN HB3 1 98 PRO HD3 4.680 . 4.680 4.648 4.498 4.723 0.043 3 0 "[ . 1]" 1
2326 1 96 GLN HG2 1 97 ILE H 4.230 . 4.230 4.138 3.651 4.347 0.117 2 0 "[ . 1]" 1
2327 1 96 GLN HG2 1 98 PRO HD2 4.520 . 4.520 4.117 3.132 4.542 0.022 1 0 "[ . 1]" 1
2328 1 96 GLN HG2 1 98 PRO HD3 3.840 . 3.840 2.763 2.057 3.114 . 0 0 "[ . 1]" 1
2329 1 96 GLN HG2 1 98 PRO HG3 4.180 . 4.180 4.085 3.785 4.216 0.036 4 0 "[ . 1]" 1
2330 1 96 GLN HG3 1 97 ILE H 4.860 . 4.860 3.944 3.468 4.614 . 0 0 "[ . 1]" 1
2331 1 96 GLN HG3 1 97 ILE HA 4.950 . 4.950 4.225 3.822 4.979 0.029 9 0 "[ . 1]" 1
2332 1 96 GLN HG3 1 98 PRO HD2 4.250 . 4.250 3.948 3.673 4.299 0.049 8 0 "[ . 1]" 1
2333 1 96 GLN HG3 1 98 PRO HG3 4.090 . 4.090 3.273 2.962 3.986 . 0 0 "[ . 1]" 1
2334 1 97 ILE H 1 97 ILE HB 3.430 . 3.430 2.738 2.633 2.797 . 0 0 "[ . 1]" 1
2335 1 97 ILE H 1 97 ILE MD 4.070 . 4.070 4.052 3.898 4.092 0.022 1 0 "[ . 1]" 1
2336 1 97 ILE H 1 97 ILE HG12 4.240 . 4.240 4.022 3.943 4.109 . 0 0 "[ . 1]" 1
2337 1 97 ILE H 1 97 ILE HG13 3.560 . 3.560 2.861 2.732 2.924 . 0 0 "[ . 1]" 1
2338 1 97 ILE H 1 97 ILE MG 4.090 . 4.090 3.901 3.869 3.922 . 0 0 "[ . 1]" 1
2339 1 97 ILE H 1 98 PRO HD2 4.570 . 4.570 4.414 4.227 4.574 0.004 2 0 "[ . 1]" 1
2340 1 97 ILE H 1 98 PRO HD3 4.410 . 4.410 3.570 3.405 3.765 . 0 0 "[ . 1]" 1
2341 1 97 ILE HA 1 97 ILE MD 4.100 . 4.100 3.864 3.821 3.894 . 0 0 "[ . 1]" 1
2342 1 97 ILE HA 1 97 ILE HG12 3.240 . 3.240 2.576 2.507 2.628 . 0 0 "[ . 1]" 1
2343 1 97 ILE HA 1 97 ILE HG13 3.790 . 3.790 2.968 2.918 3.032 . 0 0 "[ . 1]" 1
2344 1 97 ILE HA 1 97 ILE MG 2.950 . 2.950 2.403 2.374 2.457 . 0 0 "[ . 1]" 1
2345 1 97 ILE HA 1 98 PRO HD2 2.910 . 2.910 2.087 1.962 2.161 . 0 0 "[ . 1]" 1
2346 1 97 ILE HA 1 98 PRO HD3 2.930 . 2.930 2.492 2.306 2.853 . 0 0 "[ . 1]" 1
2347 1 97 ILE HB 1 97 ILE MD 3.080 . 3.080 2.425 2.345 2.460 . 0 0 "[ . 1]" 1
2348 1 97 ILE HG12 1 97 ILE MG 2.940 . 2.940 2.313 2.266 2.358 . 0 0 "[ . 1]" 1
2349 1 97 ILE HG12 1 98 PRO HD2 4.700 . 4.700 4.409 4.271 4.564 . 0 0 "[ . 1]" 1
2350 1 97 ILE HG12 1 98 PRO HD3 5.500 . 5.500 4.939 4.674 5.378 . 0 0 "[ . 1]" 1
2351 1 97 ILE HG13 1 97 ILE MG 3.210 . 3.210 3.202 3.189 3.211 0.001 3 0 "[ . 1]" 1
2352 1 97 ILE HG13 1 98 PRO HD2 5.030 . 5.030 5.019 4.864 5.063 0.033 1 0 "[ . 1]" 1
2353 1 97 ILE HG13 1 98 PRO HD3 5.270 . 5.270 4.955 4.790 5.282 0.012 9 0 "[ . 1]" 1
2354 1 97 ILE MG 1 98 PRO HD2 3.810 . 3.810 3.374 3.193 3.490 . 0 0 "[ . 1]" 1
2355 1 97 ILE MG 1 98 PRO HD3 4.510 . 4.510 4.260 4.087 4.491 . 0 0 "[ . 1]" 1
2356 1 97 ILE MG 1 99 GLY H 5.500 . 5.500 4.696 4.600 4.853 . 0 0 "[ . 1]" 1
2357 1 98 PRO HA 1 99 GLY H 2.880 . 2.880 2.100 2.073 2.149 . 0 0 "[ . 1]" 1
2358 1 98 PRO HA 1 99 GLY HA2 4.580 . 4.580 4.375 4.356 4.390 . 0 0 "[ . 1]" 1
2359 1 98 PRO HA 1 99 GLY HA3 4.580 . 4.580 4.346 4.302 4.369 . 0 0 "[ . 1]" 1
2360 1 98 PRO HB2 1 99 GLY H 3.970 . 3.970 3.464 3.313 3.547 . 0 0 "[ . 1]" 1
2361 1 98 PRO HB3 1 99 GLY H 4.100 . 4.100 3.901 3.782 3.966 . 0 0 "[ . 1]" 1
2362 1 99 GLY QA 1 100 VAL HB 4.540 . 4.540 4.325 4.273 4.376 . 0 0 "[ . 1]" 1
2363 1 99 GLY QA 1 100 VAL QG 3.990 . 3.990 3.597 3.554 3.638 . 0 0 "[ . 1]" 1
2364 1 99 GLY HA2 1 100 VAL H 3.140 . 3.140 2.742 2.577 2.849 . 0 0 "[ . 1]" 1
2365 1 99 GLY HA2 1 100 VAL HB 5.210 . 5.210 4.793 4.640 4.911 . 0 0 "[ . 1]" 1
2366 1 99 GLY HA2 1 100 VAL QG 4.730 . 4.730 4.352 4.208 4.442 . 0 0 "[ . 1]" 1
2367 1 99 GLY HA3 1 100 VAL H 3.140 . 3.140 2.389 2.328 2.464 . 0 0 "[ . 1]" 1
2368 1 99 GLY HA3 1 100 VAL HB 5.210 . 5.210 4.928 4.850 5.002 . 0 0 "[ . 1]" 1
2369 1 99 GLY HA3 1 100 VAL QG 4.730 . 4.730 3.837 3.777 3.908 . 0 0 "[ . 1]" 1
2370 1 100 VAL H 1 100 VAL HB 2.920 . 2.920 2.566 2.516 2.611 . 0 0 "[ . 1]" 1
2371 1 100 VAL H 1 100 VAL QG 2.840 . 2.840 2.097 2.055 2.140 . 0 0 "[ . 1]" 1
2372 1 100 VAL H 1 101 ALA H 4.650 . 4.650 4.562 4.502 4.592 . 0 0 "[ . 1]" 1
2373 1 100 VAL HA 1 100 VAL QG 2.780 . 2.780 2.324 2.304 2.348 . 0 0 "[ . 1]" 1
2374 1 100 VAL HA 1 101 ALA H 2.670 . 2.670 2.164 2.091 2.201 . 0 0 "[ . 1]" 1
2375 1 100 VAL HA 1 101 ALA MB 4.110 . 4.110 3.969 3.936 4.021 . 0 0 "[ . 1]" 1
2376 1 100 VAL HB 1 101 ALA H 4.360 . 4.360 4.128 4.090 4.183 . 0 0 "[ . 1]" 1
2377 1 100 VAL QG 1 101 ALA H 3.200 . 3.200 2.461 2.361 2.564 . 0 0 "[ . 1]" 1
2378 1 100 VAL QG 1 101 ALA HA 4.620 . 4.620 3.770 3.675 3.885 . 0 0 "[ . 1]" 1
2379 1 100 VAL QG 1 101 ALA MB 3.700 . 3.700 3.498 3.406 3.626 . 0 0 "[ . 1]" 1
2380 1 100 VAL QG 1 102 TRP H 4.630 . 4.630 4.372 4.118 4.485 . 0 0 "[ . 1]" 1
2381 1 100 VAL QG 1 102 TRP HA 4.580 . 4.580 3.833 3.546 4.016 . 0 0 "[ . 1]" 1
2382 1 100 VAL QG 1 102 TRP HD1 3.760 . 3.760 2.808 2.432 3.027 . 0 0 "[ . 1]" 1
2383 1 100 VAL QG 1 102 TRP HE1 3.860 . 3.860 2.842 2.301 3.353 . 0 0 "[ . 1]" 1
2384 1 101 ALA H 1 101 ALA MB 2.820 . 2.820 2.256 2.208 2.295 . 0 0 "[ . 1]" 1
2385 1 101 ALA H 1 102 TRP HD1 5.500 . 5.500 5.210 5.011 5.508 0.008 2 0 "[ . 1]" 1
2386 1 101 ALA H 1 105 PHE QE 5.500 . 5.500 4.773 4.489 5.042 . 0 0 "[ . 1]" 1
2387 1 101 ALA HA 1 102 TRP H 2.900 . 2.900 2.143 2.105 2.185 . 0 0 "[ . 1]" 1
2388 1 101 ALA HA 1 102 TRP HA 4.580 . 4.580 4.280 4.236 4.345 . 0 0 "[ . 1]" 1
2389 1 101 ALA HA 1 103 GLY H 4.580 . 4.580 3.653 3.562 3.772 . 0 0 "[ . 1]" 1
2390 1 101 ALA MB 1 102 TRP H 3.290 . 3.290 2.748 2.631 2.850 . 0 0 "[ . 1]" 1
2391 1 101 ALA MB 1 102 TRP HA 4.530 . 4.530 4.213 4.184 4.255 . 0 0 "[ . 1]" 1
2392 1 101 ALA MB 1 102 TRP HB2 4.840 . 4.840 4.682 4.645 4.731 . 0 0 "[ . 1]" 1
2393 1 101 ALA MB 1 102 TRP HB3 5.500 . 5.500 5.551 5.525 5.586 0.086 3 0 "[ . 1]" 1
2394 1 101 ALA MB 1 103 GLY H 3.030 . 3.030 2.342 2.241 2.399 . 0 0 "[ . 1]" 1
2395 1 101 ALA MB 1 104 VAL HA 4.750 . 4.750 4.157 3.848 4.467 . 0 0 "[ . 1]" 1
2396 1 101 ALA MB 1 105 PHE QD 4.010 . 4.010 3.418 3.319 3.555 . 0 0 "[ . 1]" 1
2397 1 101 ALA MB 1 105 PHE QE 3.130 . 3.130 1.990 1.937 2.048 . 0 0 "[ . 1]" 1
2398 1 101 ALA MB 1 105 PHE HZ 4.210 . 4.210 3.143 3.049 3.247 . 0 0 "[ . 1]" 1
2399 1 102 TRP H 1 102 TRP HB2 3.390 . 3.390 2.419 2.388 2.480 . 0 0 "[ . 1]" 1
2400 1 102 TRP H 1 102 TRP HB3 3.890 . 3.890 3.604 3.582 3.626 . 0 0 "[ . 1]" 1
2401 1 102 TRP H 1 102 TRP HD1 4.010 . 4.010 3.514 3.265 3.654 . 0 0 "[ . 1]" 1
2402 1 102 TRP H 1 103 GLY H 3.660 . 3.660 2.578 2.451 2.654 . 0 0 "[ . 1]" 1
2403 1 102 TRP HA 1 102 TRP HD1 3.130 . 3.130 2.188 2.133 2.268 . 0 0 "[ . 1]" 1
2404 1 102 TRP HB2 1 102 TRP HE3 4.130 . 4.130 2.619 2.518 2.716 . 0 0 "[ . 1]" 1
2405 1 102 TRP HB2 1 103 GLY H 5.150 . 5.150 3.813 3.603 3.893 . 0 0 "[ . 1]" 1
2406 1 102 TRP HB3 1 102 TRP HZ3 5.500 . 5.500 5.543 5.524 5.564 0.064 9 0 "[ . 1]" 1
2407 1 102 TRP HB3 1 103 GLY H 4.920 . 4.920 4.408 4.331 4.445 . 0 0 "[ . 1]" 1
2408 1 102 TRP HD1 1 103 GLY H 4.870 . 4.870 4.824 4.689 4.899 0.029 5 0 "[ . 1]" 1
2409 1 103 GLY H 1 104 VAL H 4.640 . 4.640 4.223 4.169 4.291 . 0 0 "[ . 1]" 1
2410 1 103 GLY H 1 104 VAL QG 5.440 . 5.440 4.805 4.747 4.908 . 0 0 "[ . 1]" 1
2411 1 103 GLY HA2 1 104 VAL H 3.340 . 3.340 2.673 2.507 2.790 . 0 0 "[ . 1]" 1
2412 1 103 GLY HA2 1 104 VAL HB 5.500 . 5.500 5.263 5.123 5.511 0.011 2 0 "[ . 1]" 1
2413 1 103 GLY HA2 1 104 VAL QG 3.790 . 3.790 3.266 3.192 3.334 . 0 0 "[ . 1]" 1
2414 1 103 GLY HA3 1 104 VAL H 3.150 . 3.150 2.301 2.206 2.395 . 0 0 "[ . 1]" 1
2415 1 103 GLY HA3 1 104 VAL MG1 5.500 . 5.500 5.219 3.779 5.598 0.098 9 0 "[ . 1]" 1
2416 1 103 GLY HA3 1 104 VAL QG 4.190 . 4.190 3.736 3.656 3.866 . 0 0 "[ . 1]" 1
2417 1 103 GLY HA3 1 104 VAL MG2 5.500 . 5.500 4.010 3.761 4.867 . 0 0 "[ . 1]" 1
2418 1 104 VAL H 1 104 VAL HB 4.050 . 4.050 2.944 2.725 3.751 . 0 0 "[ . 1]" 1
2419 1 104 VAL H 1 104 VAL MG1 3.930 . 3.930 3.485 2.000 3.876 . 0 0 "[ . 1]" 1
2420 1 104 VAL H 1 104 VAL QG 2.990 . 2.990 2.074 1.934 2.217 . 0 0 "[ . 1]" 1
2421 1 104 VAL H 1 104 VAL MG2 3.930 . 3.930 2.245 1.939 2.902 . 0 0 "[ . 1]" 1
2422 1 104 VAL HA 1 104 VAL MG1 2.950 . 2.950 2.374 2.250 2.790 . 0 0 "[ . 1]" 1
2423 1 104 VAL HA 1 104 VAL MG2 2.950 . 2.950 2.756 2.661 3.077 0.127 2 0 "[ . 1]" 1
2424 1 104 VAL HA 1 105 PHE H 2.690 . 2.690 2.289 2.224 2.352 . 0 0 "[ . 1]" 1
2425 1 104 VAL HA 1 105 PHE HB2 4.370 . 4.370 4.366 4.323 4.413 0.043 2 0 "[ . 1]" 1
2426 1 104 VAL HA 1 105 PHE QD 4.630 . 4.630 4.004 3.885 4.115 . 0 0 "[ . 1]" 1
2427 1 104 VAL HB 1 105 PHE H 3.470 . 3.470 3.347 2.912 3.480 0.010 3 0 "[ . 1]" 1
2428 1 104 VAL HB 1 105 PHE HA 5.120 . 5.120 4.334 4.133 5.094 . 0 0 "[ . 1]" 1
2429 1 104 VAL HB 1 105 PHE HB2 5.500 . 5.500 5.586 5.484 5.622 0.122 8 0 "[ . 1]" 1
2430 1 104 VAL QG 1 105 PHE H 3.030 . 3.030 2.221 2.063 2.700 . 0 0 "[ . 1]" 1
2431 1 104 VAL QG 1 105 PHE HA 4.170 . 4.170 3.630 3.126 3.773 . 0 0 "[ . 1]" 1
2432 1 104 VAL QG 1 105 PHE HB2 4.760 . 4.760 4.094 3.943 4.517 . 0 0 "[ . 1]" 1
2433 1 104 VAL QG 1 105 PHE HB3 5.210 . 5.210 4.881 4.853 4.908 . 0 0 "[ . 1]" 1
2434 1 104 VAL QG 1 105 PHE QD 5.220 . 5.220 4.433 4.364 4.560 . 0 0 "[ . 1]" 1
2435 1 104 VAL QG 1 106 LYS H 4.510 . 4.510 3.499 2.843 3.686 . 0 0 "[ . 1]" 1
2436 1 104 VAL QG 1 106 LYS HB2 4.720 . 4.720 4.621 4.057 4.753 0.033 6 0 "[ . 1]" 1
2437 1 104 VAL QG 1 106 LYS QD 4.440 . 4.440 4.046 3.559 4.314 . 0 0 "[ . 1]" 1
2438 1 104 VAL QG 1 106 LYS QE 3.710 . 3.710 2.904 2.405 3.385 . 0 0 "[ . 1]" 1
2439 1 104 VAL QG 1 106 LYS QG 4.060 . 4.060 2.557 2.103 2.786 . 0 0 "[ . 1]" 1
2440 1 104 VAL MG1 1 105 PHE H 4.120 . 4.120 2.520 2.069 4.158 0.038 4 0 "[ . 1]" 1
2441 1 104 VAL MG1 1 105 PHE HA 5.500 . 5.500 4.124 3.756 5.345 . 0 0 "[ . 1]" 1
2442 1 104 VAL MG1 1 106 LYS H 5.500 . 5.500 4.072 3.572 5.559 0.059 4 0 "[ . 1]" 1
2443 1 104 VAL MG1 1 106 LYS QE 4.490 . 4.490 3.351 2.533 4.384 . 0 0 "[ . 1]" 1
2444 1 104 VAL MG2 1 105 PHE H 4.120 . 4.120 3.843 2.675 4.135 0.015 5 0 "[ . 1]" 1
2445 1 104 VAL MG2 1 105 PHE HA 5.500 . 5.500 4.920 3.147 5.366 . 0 0 "[ . 1]" 1
2446 1 104 VAL MG2 1 106 LYS H 5.500 . 5.500 5.021 2.852 5.589 0.089 3 0 "[ . 1]" 1
2447 1 104 VAL MG2 1 106 LYS QE 4.490 . 4.490 3.499 2.424 4.028 . 0 0 "[ . 1]" 1
2448 1 105 PHE H 1 105 PHE HB2 3.350 . 3.350 2.413 2.351 2.574 . 0 0 "[ . 1]" 1
2449 1 105 PHE H 1 105 PHE HB3 3.920 . 3.920 3.666 3.632 3.747 . 0 0 "[ . 1]" 1
2450 1 105 PHE H 1 105 PHE QD 3.950 . 3.950 3.196 3.037 3.365 . 0 0 "[ . 1]" 1
2451 1 105 PHE H 1 105 PHE QE 5.500 . 5.500 5.012 4.814 5.144 . 0 0 "[ . 1]" 1
2452 1 105 PHE HA 1 105 PHE QD 3.790 . 3.790 2.603 2.533 2.701 . 0 0 "[ . 1]" 1
2453 1 105 PHE HA 1 106 LYS H 3.190 . 3.190 2.170 2.156 2.184 . 0 0 "[ . 1]" 1
2454 1 105 PHE HA 1 106 LYS HA 4.510 . 4.510 4.416 4.391 4.442 . 0 0 "[ . 1]" 1
2455 1 105 PHE HA 1 106 LYS HB2 4.850 . 4.850 4.752 4.622 4.856 0.006 4 0 "[ . 1]" 1
2456 1 105 PHE HA 1 106 LYS QG 4.660 . 4.660 3.971 3.829 4.068 . 0 0 "[ . 1]" 1
2457 1 105 PHE HB2 1 106 LYS H 4.810 . 4.810 4.312 4.263 4.381 . 0 0 "[ . 1]" 1
2458 1 105 PHE HB3 1 106 LYS H 4.160 . 4.160 3.803 3.726 3.837 . 0 0 "[ . 1]" 1
2459 1 105 PHE QD 1 106 LYS H 4.430 . 4.430 4.397 4.348 4.450 0.020 9 0 "[ . 1]" 1
2460 1 106 LYS H 1 106 LYS HB2 3.940 . 3.940 2.596 2.461 2.726 . 0 0 "[ . 1]" 1
2461 1 106 LYS H 1 106 LYS HB3 4.130 . 4.130 3.671 3.641 3.703 . 0 0 "[ . 1]" 1
2462 1 106 LYS H 1 106 LYS QG 3.660 . 3.660 2.380 2.327 2.451 . 0 0 "[ . 1]" 1
2463 1 106 LYS HA 1 106 LYS HB3 2.980 . 2.980 2.417 2.370 2.484 . 0 0 "[ . 1]" 1
2464 1 106 LYS HA 1 106 LYS QD 4.450 . 4.450 3.984 3.919 4.030 . 0 0 "[ . 1]" 1
2465 1 106 LYS HA 1 106 LYS QG 3.470 . 3.470 2.541 2.482 2.625 . 0 0 "[ . 1]" 1
2466 1 106 LYS HB2 1 106 LYS QE 4.410 . 4.410 3.996 3.967 4.044 . 0 0 "[ . 1]" 1
2467 1 106 LYS HB3 1 106 LYS QD 3.410 . 3.410 2.303 2.256 2.352 . 0 0 "[ . 1]" 1
2468 1 106 LYS HB3 1 106 LYS QE 4.380 . 4.380 3.973 3.859 4.174 . 0 0 "[ . 1]" 1
2469 1 106 LYS QE 1 106 LYS QG 3.420 . 3.420 2.198 2.088 2.348 . 0 0 "[ . 1]" 1
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