NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
429413 |
2jgx   |
7421 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2jgx
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 1400
_Distance_constraint_stats_list.Viol_count 2301
_Distance_constraint_stats_list.Viol_total 5796.423
_Distance_constraint_stats_list.Viol_max 3.916
_Distance_constraint_stats_list.Viol_rms 0.0681
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0104
_Distance_constraint_stats_list.Viol_average_violations_only 0.1260
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 LEU 17.727 1.213 16 6 "[ *- * 1 * *.+ 2]"
1 2 ARG 23.237 1.093 6 4 "[ - .+ 1 *.* 2]"
1 3 LYS 19.041 0.717 12 3 "[ - * 1 + . 2]"
1 4 CYS 13.844 3.789 11 2 "[ . 1+ . - 2]"
1 5 TYR 7.307 0.988 18 3 "[ . 1 *-. + 2]"
1 6 PHE 2.792 0.189 3 0 "[ . 1 . 2]"
1 7 PRO 0.576 0.151 18 0 "[ . 1 . 2]"
1 8 TYR 2.701 0.735 18 1 "[ . 1 . + 2]"
1 9 LEU 6.975 0.967 3 3 "[ + . * 1 - . 2]"
1 10 GLU 6.058 0.797 5 2 "[ - + 1 . 2]"
1 11 ASN 4.164 0.797 5 2 "[ - + 1 . 2]"
1 12 GLY 5.258 0.967 3 3 "[ + . * 1 - . 2]"
1 13 TYR 1.852 0.102 20 0 "[ . 1 . 2]"
1 14 ASN 2.608 0.278 17 0 "[ . 1 . 2]"
1 15 GLN 2.260 0.297 13 0 "[ . 1 . 2]"
1 16 ASN 5.596 0.880 5 2 "[ + 1 - 2]"
1 17 TYR 6.220 0.988 18 1 "[ . 1 . + 2]"
1 18 GLY 4.930 0.988 18 1 "[ . 1 . + 2]"
1 19 ARG 10.044 0.880 5 4 "[ *+ 1* - 2]"
1 20 LYS 14.968 0.685 13 2 "[ . 1 +-. 2]"
1 21 PHE 8.880 0.674 13 5 "[ *. 1* + -* 2]"
1 22 VAL 2.475 0.210 5 0 "[ . 1 . 2]"
1 23 GLN 40.161 1.213 16 13 "[* * *** *1** -*+* *2]"
1 24 GLY 1.358 0.147 14 0 "[ . 1 . 2]"
1 25 LYS 20.464 3.916 20 2 "[ - . 1 . +]"
1 26 SER 6.739 0.261 3 0 "[ . 1 . 2]"
1 27 ILE 17.325 0.761 5 5 "[* + 1 * -* 2]"
1 28 ASP 15.525 1.250 3 5 "[* + . 1 * -* 2]"
1 29 VAL 10.479 3.417 3 1 "[ + . 1 . 2]"
1 30 ALA 0.507 0.187 3 0 "[ . 1 . 2]"
1 31 CYS 1.560 0.137 6 0 "[ . 1 . 2]"
1 32 HIS 11.294 0.839 11 3 "[ .- 1+ * . 2]"
1 33 PRO 13.553 0.839 11 4 "[ .- 1+ * . *]"
1 34 GLY 2.297 0.754 20 1 "[ . 1 . +]"
1 35 TYR 9.939 1.054 9 3 "[ . *+1- . 2]"
1 36 ALA 2.386 0.360 9 0 "[ . 1 . 2]"
1 37 LEU 6.600 0.395 9 0 "[ . 1 . 2]"
1 38 PRO 7.146 0.424 10 0 "[ . 1 . 2]"
1 39 LYS 4.915 0.321 12 0 "[ . 1 . 2]"
1 40 ALA 0.173 0.028 17 0 "[ . 1 . 2]"
1 41 GLN 3.077 0.625 16 1 "[ . 1 .+ 2]"
1 42 THR 0.940 0.110 7 0 "[ . 1 . 2]"
1 43 THR 10.514 1.250 3 1 "[ + . 1 . 2]"
1 44 VAL 15.226 0.611 3 1 "[ + . 1 . 2]"
1 45 THR 3.004 0.151 11 0 "[ . 1 . 2]"
1 46 CYS 4.626 0.271 8 0 "[ . 1 . 2]"
1 47 MET 28.213 3.916 20 10 "[* * .* *1* -* * *+]"
1 48 GLU 19.535 1.093 6 5 "[* .+- 1 *.* 2]"
1 49 ASN 13.486 3.789 11 1 "[ . 1+ . 2]"
1 50 GLY 4.381 0.440 16 0 "[ . 1 . 2]"
1 51 TRP 16.153 0.636 18 1 "[ . 1 . + 2]"
1 52 SER 5.669 0.379 10 0 "[ . 1 . 2]"
1 53 PRO 12.190 0.625 16 2 "[ - . 1 .+ 2]"
1 54 THR 8.060 0.611 3 1 "[ + . 1 . 2]"
1 55 PRO 10.811 3.417 3 1 "[ + . 1 . 2]"
1 56 ARG 9.261 0.502 20 1 "[ . 1 . +]"
1 57 CYS 1.223 0.139 8 0 "[ . 1 . 2]"
1 58 ILE 13.146 0.703 9 6 "[ * .* +** . -]"
1 59 ARG 25.706 1.054 9 7 "[ * .* *+*- . *]"
1 60 VAL 5.941 0.360 9 0 "[ . 1 . 2]"
1 61 LYS 2.050 0.453 15 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 LEU HA 1 1 LEU HB2 2.538 . 3.311 2.940 2.359 3.011 . 0 0 "[ . 1 . 2]" 1
2 1 1 LEU HA 1 1 LEU HB2 2.557 . 3.342 2.634 2.334 2.767 . 0 0 "[ . 1 . 2]" 1
3 1 1 LEU HA 1 1 LEU HB3 2.487 . 3.229 2.453 2.283 2.622 . 0 0 "[ . 1 . 2]" 1
4 1 1 LEU HA 1 2 ARG H 2.112 . 2.647 2.440 1.948 2.837 0.190 2 0 "[ . 1 . 2]" 1
5 1 1 LEU HA 1 23 GLN QB 2.929 . 3.958 3.288 2.016 5.171 1.213 16 1 "[ . 1 .+ 2]" 1
6 1 1 LEU HB2 1 1 LEU MD2 2.386 . 3.069 3.100 2.516 3.206 0.137 15 0 "[ . 1 . 2]" 1
7 1 1 LEU HB2 1 1 LEU MD2 2.397 . 3.086 2.088 2.019 2.101 . 0 0 "[ . 1 . 2]" 1
8 1 1 LEU HB2 1 23 GLN HE22 3.854 2.072 5.636 3.316 2.236 4.452 . 0 0 "[ . 1 . 2]" 1
9 1 1 LEU HB2 1 2 ARG H 2.543 . 3.319 2.653 1.719 3.223 0.048 12 0 "[ . 1 . 2]" 1
10 1 1 LEU HB2 1 23 GLN HE21 3.750 2.062 5.438 3.011 1.423 4.688 0.639 14 1 "[ . 1 +. 2]" 1
11 1 1 LEU HB3 1 1 LEU MD1 2.592 . 3.398 2.512 2.304 3.195 . 0 0 "[ . 1 . 2]" 1
12 1 1 LEU HB3 1 1 LEU MD2 2.388 . 3.072 2.349 2.202 2.499 . 0 0 "[ . 1 . 2]" 1
13 1 1 LEU HB3 1 2 ARG H 2.932 . 3.964 4.174 3.636 4.585 0.621 2 1 "[ + . 1 . 2]" 1
14 1 1 LEU HB3 1 2 ARG H 2.851 . 3.827 3.885 3.592 4.292 0.465 5 0 "[ . 1 . 2]" 1
15 1 1 LEU HB3 1 23 GLN H 3.122 . 4.292 4.041 3.238 4.520 0.228 10 0 "[ . 1 . 2]" 1
16 1 1 LEU HB3 1 23 GLN HE21 4.023 2.081 5.965 5.591 4.712 6.314 0.349 5 0 "[ . 1 . 2]" 1
17 1 1 LEU HB3 1 23 GLN HE22 4.160 2.083 6.237 6.124 4.308 6.954 0.717 12 3 "[ - * 1 + . 2]" 1
18 1 1 LEU MD1 1 1 LEU HG 2.646 . 3.486 2.126 2.123 2.130 . 0 0 "[ . 1 . 2]" 1
19 1 2 ARG H 1 2 ARG HA 2.619 . 3.442 2.795 2.204 2.941 . 0 0 "[ . 1 . 2]" 1
20 1 2 ARG H 1 2 ARG QB 2.155 . 2.712 2.471 2.085 3.167 0.455 14 0 "[ . 1 . 2]" 1
21 1 2 ARG H 1 2 ARG QD 3.486 2.028 4.944 3.803 1.909 4.895 0.119 16 0 "[ . 1 . 2]" 1
22 1 2 ARG H 1 2 ARG HE 3.405 2.014 4.796 3.293 2.582 3.989 . 0 0 "[ . 1 . 2]" 1
23 1 2 ARG H 1 2 ARG QG 2.721 . 3.609 2.693 1.721 3.371 0.129 12 0 "[ . 1 . 2]" 1
24 1 2 ARG H 1 23 GLN QB 2.601 . 3.209 2.235 1.952 2.788 . 0 0 "[ . 1 . 2]" 1
25 1 2 ARG H 1 22 VAL HB 3.638 2.050 5.226 4.056 3.246 4.736 . 0 0 "[ . 1 . 2]" 1
26 1 2 ARG H 1 23 GLN HA 4.236 2.082 6.390 5.212 4.552 6.338 . 0 0 "[ . 1 . 2]" 1
27 1 2 ARG H 1 23 GLN QB 2.859 . 3.840 2.604 2.052 3.576 . 0 0 "[ . 1 . 2]" 1
28 1 2 ARG H 1 23 GLN HE21 3.470 2.025 4.915 2.730 1.890 3.962 0.135 6 0 "[ . 1 . 2]" 1
29 1 2 ARG H 1 23 GLN HE22 3.539 2.036 5.042 3.453 2.739 4.673 . 0 0 "[ . 1 . 2]" 1
30 1 2 ARG H 1 23 GLN QG 3.555 2.039 5.071 4.164 3.259 4.988 . 0 0 "[ . 1 . 2]" 1
31 1 2 ARG H 1 48 GLU HA 3.977 2.079 5.875 3.761 1.924 5.000 0.155 14 0 "[ . 1 . 2]" 1
32 1 2 ARG HA 1 2 ARG QB 2.186 . 2.759 2.347 2.145 2.486 . 0 0 "[ . 1 . 2]" 1
33 1 2 ARG HA 1 2 ARG QD 2.981 . 4.048 3.358 2.232 4.164 0.116 12 0 "[ . 1 . 2]" 1
34 1 2 ARG HA 1 2 ARG HE 4.072 2.082 6.062 4.731 2.306 5.829 . 0 0 "[ . 1 . 2]" 1
35 1 2 ARG HA 1 2 ARG QG 2.535 . 3.306 2.490 2.088 3.354 0.048 11 0 "[ . 1 . 2]" 1
36 1 2 ARG HA 1 3 LYS H 2.007 . 2.491 2.428 2.177 2.652 0.161 12 0 "[ . 1 . 2]" 1
37 1 2 ARG HA 1 23 GLN H 4.068 2.082 6.054 4.712 2.372 6.129 0.075 12 0 "[ . 1 . 2]" 1
38 1 2 ARG HA 1 23 GLN HE21 4.347 2.080 6.614 4.697 2.415 6.616 0.002 13 0 "[ . 1 . 2]" 1
39 1 2 ARG HA 1 23 GLN HE22 4.510 2.070 6.950 5.519 3.894 6.819 . 0 0 "[ . 1 . 2]" 1
40 1 2 ARG HA 1 49 ASN HD21 4.302 2.081 6.523 5.332 3.872 6.228 . 0 0 "[ . 1 . 2]" 1
41 1 2 ARG QB 1 2 ARG QD 2.212 . 2.799 2.155 1.960 2.395 . 0 0 "[ . 1 . 2]" 1
42 1 2 ARG QB 1 2 ARG HE 3.305 . 4.616 3.656 2.558 4.104 . 0 0 "[ . 1 . 2]" 1
43 1 2 ARG QB 1 2 ARG HE 3.121 . 4.290 3.214 2.502 3.855 . 0 0 "[ . 1 . 2]" 1
44 1 2 ARG QB 1 3 LYS H 2.539 . 3.312 2.168 1.597 2.760 0.169 12 0 "[ . 1 . 2]" 1
45 1 2 ARG QB 1 50 GLY H 3.992 2.080 5.904 4.424 3.852 5.325 . 0 0 "[ . 1 . 2]" 1
46 1 2 ARG QB 1 23 GLN H 3.271 . 4.555 3.939 1.898 4.732 0.177 13 0 "[ . 1 . 2]" 1
47 1 2 ARG QB 1 23 GLN HE21 3.145 . 4.332 2.935 1.934 4.601 0.269 4 0 "[ . 1 . 2]" 1
48 1 2 ARG QB 1 23 GLN HE21 3.297 . 4.601 2.745 1.933 4.144 0.060 18 0 "[ . 1 . 2]" 1
49 1 2 ARG QB 1 23 GLN HE22 3.376 2.009 4.743 3.811 2.613 5.016 0.273 6 0 "[ . 1 . 2]" 1
50 1 2 ARG QB 1 48 GLU HA 2.794 . 3.731 2.891 1.788 4.824 1.093 6 3 "[ .+ 1 -.* 2]" 1
51 1 2 ARG QD 1 3 LYS H 3.108 . 4.267 3.723 1.756 4.528 0.261 14 0 "[ . 1 . 2]" 1
52 1 2 ARG QD 1 23 GLN HE21 4.307 2.081 6.533 4.201 2.015 6.578 0.066 16 0 "[ . 1 . 2]" 1
53 1 2 ARG QD 1 23 GLN HE22 4.342 2.080 6.604 4.519 2.840 6.292 . 0 0 "[ . 1 . 2]" 1
54 1 2 ARG QD 1 48 GLU HA 2.860 . 3.841 3.485 2.318 4.084 0.243 14 0 "[ . 1 . 2]" 1
55 1 2 ARG QD 1 49 ASN H 4.403 2.077 6.729 3.853 2.048 5.157 0.029 11 0 "[ . 1 . 2]" 1
56 1 2 ARG HE 1 2 ARG QG 3.178 2.008 4.390 2.359 2.118 3.227 . 0 0 "[ . 1 . 2]" 1
57 1 2 ARG HE 1 3 LYS H 3.943 2.077 5.809 5.103 3.327 5.946 0.137 8 0 "[ . 1 . 2]" 1
58 1 2 ARG HE 1 4 CYS H 4.329 2.080 6.578 6.003 3.630 6.568 . 0 0 "[ . 1 . 2]" 1
59 1 2 ARG HE 1 48 GLU HB3 3.053 . 4.171 3.930 2.920 4.577 0.406 12 0 "[ . 1 . 2]" 1
60 1 2 ARG HE 1 48 GLU QG 2.961 . 4.013 2.712 1.885 3.684 0.024 5 0 "[ . 1 . 2]" 1
61 1 2 ARG QG 1 3 LYS H 2.872 . 3.862 3.681 2.996 4.177 0.315 9 0 "[ . 1 . 2]" 1
62 1 2 ARG QG 1 49 ASN HD21 4.311 2.081 6.541 3.982 2.886 5.173 . 0 0 "[ . 1 . 2]" 1
63 1 2 ARG QG 1 24 GLY H 4.035 2.081 5.989 4.738 4.019 5.689 . 0 0 "[ . 1 . 2]" 1
64 1 2 ARG QG 1 48 GLU HA 2.967 . 4.023 2.617 1.448 4.161 0.463 9 0 "[ . 1 . 2]" 1
65 1 2 ARG QG 1 50 GLY H 3.746 2.062 5.430 5.281 3.226 5.870 0.440 16 0 "[ . 1 . 2]" 1
66 1 3 LYS H 1 3 LYS HB2 2.666 . 3.519 3.016 2.451 3.768 0.249 3 0 "[ . 1 . 2]" 1
67 1 3 LYS H 1 3 LYS HB2 2.398 . 3.088 2.400 1.848 3.139 0.051 16 0 "[ . 1 . 2]" 1
68 1 3 LYS H 1 3 LYS HB3 2.707 . 3.586 3.634 3.273 4.037 0.451 6 0 "[ . 1 . 2]" 1
69 1 3 LYS H 1 3 LYS QE 3.605 2.046 5.164 4.224 2.706 5.239 0.075 12 0 "[ . 1 . 2]" 1
70 1 3 LYS H 1 3 LYS QG 3.016 . 4.108 3.304 2.169 4.373 0.265 10 0 "[ . 1 . 2]" 1
71 1 3 LYS H 1 4 CYS H 3.366 2.007 4.725 3.662 2.483 4.162 . 0 0 "[ . 1 . 2]" 1
72 1 3 LYS H 1 49 ASN HA 2.884 . 3.882 3.791 2.808 4.262 0.380 11 0 "[ . 1 . 2]" 1
73 1 3 LYS HA 1 3 LYS HB2 2.592 . 3.398 2.855 2.483 3.026 . 0 0 "[ . 1 . 2]" 1
74 1 3 LYS HA 1 3 LYS HB3 2.658 . 3.506 2.519 2.259 2.956 . 0 0 "[ . 1 . 2]" 1
75 1 3 LYS HA 1 3 LYS QD 2.946 . 3.987 3.018 1.810 4.135 0.148 16 0 "[ . 1 . 2]" 1
76 1 3 LYS HA 1 22 VAL HA 2.837 . 3.803 2.731 2.147 3.619 . 0 0 "[ . 1 . 2]" 1
77 1 3 LYS QB 1 22 VAL H 3.719 2.059 5.379 4.809 4.095 5.508 0.129 11 0 "[ . 1 . 2]" 1
78 1 3 LYS QB 1 22 VAL HA 3.089 . 4.234 3.282 2.503 4.125 . 0 0 "[ . 1 . 2]" 1
79 1 3 LYS QB 1 21 PHE H 2.743 . 3.646 3.649 3.330 3.837 0.191 16 0 "[ . 1 . 2]" 1
80 1 3 LYS HB2 1 5 TYR H 3.863 2.072 5.654 5.086 4.263 5.463 . 0 0 "[ . 1 . 2]" 1
81 1 3 LYS HB3 1 4 CYS H 2.921 . 3.945 4.072 3.625 4.331 0.386 3 0 "[ . 1 . 2]" 1
82 1 3 LYS HB3 1 20 LYS HG3 2.478 . 3.215 2.960 2.591 2.999 . 0 0 "[ . 1 . 2]" 1
83 1 3 LYS HB3 1 49 ASN HD21 3.829 2.070 5.588 4.417 3.095 5.723 0.135 3 0 "[ . 1 . 2]" 1
84 1 3 LYS QD 1 3 LYS QE 2.273 . 2.893 2.032 1.988 2.090 . 0 0 "[ . 1 . 2]" 1
85 1 3 LYS QD 1 3 LYS QE 2.016 . 2.504 1.923 1.754 2.080 . 0 0 "[ . 1 . 2]" 1
86 1 3 LYS QD 1 3 LYS QG 2.266 . 2.882 2.061 2.004 2.097 . 0 0 "[ . 1 . 2]" 1
87 1 3 LYS QE 1 3 LYS QG 2.592 . 3.398 2.344 2.112 2.791 . 0 0 "[ . 1 . 2]" 1
88 1 3 LYS QE 1 4 CYS H 3.849 2.071 5.627 5.055 4.483 5.408 . 0 0 "[ . 1 . 2]" 1
89 1 3 LYS QE 1 21 PHE H 3.678 2.055 5.301 4.677 4.143 5.010 . 0 0 "[ . 1 . 2]" 1
90 1 3 LYS QE 1 23 GLN H 4.158 2.083 6.233 5.675 4.492 6.291 0.058 14 0 "[ . 1 . 2]" 1
91 1 4 CYS H 1 4 CYS HA 2.965 . 4.020 2.812 2.739 2.899 . 0 0 "[ . 1 . 2]" 1
92 1 4 CYS H 1 4 CYS QB 2.837 . 3.474 2.610 2.454 2.673 . 0 0 "[ . 1 . 2]" 1
93 1 4 CYS H 1 4 CYS HB3 2.766 . 3.684 3.364 2.687 3.631 . 0 0 "[ . 1 . 2]" 1
94 1 4 CYS H 1 5 TYR HA 4.209 2.083 6.335 5.487 5.256 5.597 . 0 0 "[ . 1 . 2]" 1
95 1 4 CYS H 1 5 TYR QE 4.410 2.077 6.743 6.702 5.967 6.829 0.086 18 0 "[ . 1 . 2]" 1
96 1 4 CYS H 1 21 PHE H 2.775 . 3.699 3.372 3.012 3.671 . 0 0 "[ . 1 . 2]" 1
97 1 4 CYS H 1 21 PHE HB2 3.422 2.017 4.827 4.093 3.679 4.536 . 0 0 "[ . 1 . 2]" 1
98 1 4 CYS H 1 21 PHE HB3 3.819 2.068 5.570 5.152 4.767 5.473 . 0 0 "[ . 1 . 2]" 1
99 1 4 CYS H 1 21 PHE QD 4.045 2.082 6.008 4.911 4.231 5.254 . 0 0 "[ . 1 . 2]" 1
100 1 4 CYS H 1 22 VAL H 4.233 2.083 6.383 4.821 4.666 5.070 . 0 0 "[ . 1 . 2]" 1
101 1 4 CYS H 1 22 VAL HA 3.090 . 4.236 3.760 3.364 4.213 . 0 0 "[ . 1 . 2]" 1
102 1 4 CYS H 1 22 VAL HB 4.049 2.082 6.016 5.165 4.007 5.781 . 0 0 "[ . 1 . 2]" 1
103 1 4 CYS H 1 23 GLN H 3.691 2.056 5.326 4.343 3.849 5.034 . 0 0 "[ . 1 . 2]" 1
104 1 4 CYS H 1 23 GLN QB 3.611 2.046 5.176 4.664 3.979 5.343 0.167 12 0 "[ . 1 . 2]" 1
105 1 4 CYS H 1 49 ASN HA 2.262 . 2.876 3.197 2.962 6.665 3.789 11 1 "[ . 1+ . 2]" 1
106 1 4 CYS H 1 51 TRP HZ2 4.080 2.083 6.077 5.793 5.660 6.092 0.015 6 0 "[ . 1 . 2]" 1
107 1 4 CYS HA 1 4 CYS QB 2.601 . 3.413 2.276 2.172 2.356 . 0 0 "[ . 1 . 2]" 1
108 1 4 CYS HA 1 5 TYR H 2.244 . 2.848 2.168 2.103 2.314 . 0 0 "[ . 1 . 2]" 1
109 1 4 CYS HA 1 5 TYR QB 3.061 . 4.186 3.883 3.840 3.958 . 0 0 "[ . 1 . 2]" 1
110 1 4 CYS HA 1 51 TRP HD1 3.100 . 4.253 4.017 3.740 4.195 . 0 0 "[ . 1 . 2]" 1
111 1 4 CYS QB 1 5 TYR H 2.849 . 3.823 3.115 2.712 3.537 . 0 0 "[ . 1 . 2]" 1
112 1 4 CYS QB 1 6 PHE H 4.321 2.080 6.562 4.826 4.517 5.117 . 0 0 "[ . 1 . 2]" 1
113 1 4 CYS QB 1 51 TRP HD1 3.098 . 4.249 3.316 3.116 3.523 . 0 0 "[ . 1 . 2]" 1
114 1 4 CYS QB 1 21 PHE H 3.432 2.018 4.846 3.384 2.570 4.138 . 0 0 "[ . 1 . 2]" 1
115 1 4 CYS QB 1 21 PHE HB2 2.924 . 3.950 3.159 2.022 4.092 0.142 4 0 "[ . 1 . 2]" 1
116 1 4 CYS QB 1 46 CYS H 4.110 2.083 6.137 5.248 4.979 5.691 . 0 0 "[ . 1 . 2]" 1
117 1 4 CYS QB 1 46 CYS HB2 2.861 . 3.843 3.195 2.734 3.959 0.116 2 0 "[ . 1 . 2]" 1
118 1 4 CYS QB 1 47 MET H 4.230 2.083 6.377 4.044 3.315 4.771 . 0 0 "[ . 1 . 2]" 1
119 1 4 CYS QB 1 51 TRP HE1 2.773 . 3.696 3.058 2.693 3.477 . 0 0 "[ . 1 . 2]" 1
120 1 4 CYS QB 1 51 TRP HZ2 2.761 . 3.676 3.163 2.769 3.683 0.007 18 0 "[ . 1 . 2]" 1
121 1 4 CYS HB3 1 54 THR H 4.454 2.074 6.834 6.365 5.666 7.155 0.321 12 0 "[ . 1 . 2]" 1
122 1 4 CYS HB3 1 51 TRP H 3.570 2.041 5.099 3.283 2.517 4.788 . 0 0 "[ . 1 . 2]" 1
123 1 4 CYS HB3 1 51 TRP HE1 3.097 . 4.248 3.562 2.868 4.884 0.636 18 1 "[ . 1 . + 2]" 1
124 1 5 TYR H 1 5 TYR HA 2.884 . 3.882 2.926 2.880 2.956 . 0 0 "[ . 1 . 2]" 1
125 1 5 TYR H 1 5 TYR QB 2.269 . 2.887 2.356 2.257 2.525 . 0 0 "[ . 1 . 2]" 1
126 1 5 TYR H 1 6 PHE H 3.652 2.052 5.252 4.419 4.225 4.515 . 0 0 "[ . 1 . 2]" 1
127 1 5 TYR H 1 6 PHE H 3.421 2.017 4.825 3.590 3.429 3.809 . 0 0 "[ . 1 . 2]" 1
128 1 5 TYR H 1 7 PRO HD3 4.115 2.083 6.147 4.495 3.754 5.088 . 0 0 "[ . 1 . 2]" 1
129 1 5 TYR H 1 20 LYS HG2 4.454 2.074 6.834 4.528 3.433 5.828 . 0 0 "[ . 1 . 2]" 1
130 1 5 TYR H 1 20 LYS HG3 4.273 2.082 6.464 5.763 4.717 6.522 0.058 11 0 "[ . 1 . 2]" 1
131 1 5 TYR H 1 51 TRP HD1 4.031 2.081 5.981 4.928 4.455 5.457 . 0 0 "[ . 1 . 2]" 1
132 1 5 TYR H 1 51 TRP HE1 3.091 . 4.238 3.731 3.326 4.240 0.002 13 0 "[ . 1 . 2]" 1
133 1 5 TYR H 1 51 TRP HZ2 3.901 2.075 5.727 4.951 4.417 5.389 . 0 0 "[ . 1 . 2]" 1
134 1 5 TYR HA 1 5 TYR QB 2.376 . 3.053 2.376 2.346 2.412 . 0 0 "[ . 1 . 2]" 1
135 1 5 TYR HA 1 5 TYR QD 2.910 . 3.926 2.746 2.371 2.960 . 0 0 "[ . 1 . 2]" 1
136 1 5 TYR HA 1 6 PHE H 2.291 . 2.921 2.181 2.141 2.240 . 0 0 "[ . 1 . 2]" 1
137 1 5 TYR HA 1 18 GLY H 4.322 2.080 6.564 5.459 5.061 6.087 . 0 0 "[ . 1 . 2]" 1
138 1 5 TYR HA 1 19 ARG H 4.048 2.082 6.014 5.103 4.663 5.428 . 0 0 "[ . 1 . 2]" 1
139 1 5 TYR HA 1 20 LYS H 3.881 2.073 5.689 4.894 4.565 5.056 . 0 0 "[ . 1 . 2]" 1
140 1 5 TYR HA 1 20 LYS HA 2.889 . 3.891 2.534 2.371 2.630 . 0 0 "[ . 1 . 2]" 1
141 1 5 TYR HA 1 20 LYS HG3 3.123 . 4.294 3.297 2.575 3.879 . 0 0 "[ . 1 . 2]" 1
142 1 5 TYR HA 1 21 PHE H 3.102 . 4.257 3.948 3.756 4.232 . 0 0 "[ . 1 . 2]" 1
143 1 5 TYR HA 1 51 TRP HE1 3.871 2.073 5.669 4.282 4.053 4.678 . 0 0 "[ . 1 . 2]" 1
144 1 5 TYR QB 1 5 TYR QD 2.088 . 2.611 2.139 2.135 2.153 . 0 0 "[ . 1 . 2]" 1
145 1 5 TYR QB 1 19 ARG H 4.101 2.083 6.119 5.660 4.910 6.125 0.006 1 0 "[ . 1 . 2]" 1
146 1 5 TYR QB 1 20 LYS H 3.520 2.033 5.007 4.292 3.464 5.051 0.044 20 0 "[ . 1 . 2]" 1
147 1 5 TYR QB 1 20 LYS HG3 2.780 . 3.708 2.646 2.219 3.281 . 0 0 "[ . 1 . 2]" 1
148 1 5 TYR QD 1 6 PHE H 3.499 2.030 4.968 3.612 3.012 3.986 . 0 0 "[ . 1 . 2]" 1
149 1 5 TYR QD 1 18 GLY H 3.308 . 4.621 4.005 3.688 4.236 . 0 0 "[ . 1 . 2]" 1
150 1 5 TYR QD 1 18 GLY HA2 3.265 . 4.544 4.608 4.206 5.532 0.988 18 1 "[ . 1 . + 2]" 1
151 1 5 TYR QD 1 19 ARG H 3.784 2.065 5.503 4.592 4.303 4.799 . 0 0 "[ . 1 . 2]" 1
152 1 5 TYR QD 1 20 LYS HG2 2.910 . 3.926 2.450 1.886 3.123 0.008 11 0 "[ . 1 . 2]" 1
153 1 5 TYR QD 1 20 LYS HG3 2.890 . 3.892 2.200 1.879 2.554 0.009 2 0 "[ . 1 . 2]" 1
154 1 5 TYR QD 1 21 PHE H 4.099 2.083 6.115 5.730 5.042 6.155 0.040 14 0 "[ . 1 . 2]" 1
155 1 5 TYR QE 1 18 GLY HA2 3.187 . 4.406 4.009 3.724 4.344 . 0 0 "[ . 1 . 2]" 1
156 1 5 TYR QE 1 20 LYS H 4.166 2.084 6.248 5.606 4.991 6.272 0.024 4 0 "[ . 1 . 2]" 1
157 1 5 TYR QE 1 20 LYS HG2 3.234 . 4.489 4.540 3.729 5.174 0.685 13 2 "[ . 1 +-. 2]" 1
158 1 6 PHE H 1 6 PHE HB2 2.510 . 3.266 2.457 2.370 2.587 . 0 0 "[ . 1 . 2]" 1
159 1 6 PHE H 1 6 PHE HB3 2.625 . 3.452 2.722 2.650 2.864 . 0 0 "[ . 1 . 2]" 1
160 1 6 PHE H 1 6 PHE QD 3.249 . 4.515 4.183 4.145 4.242 . 0 0 "[ . 1 . 2]" 1
161 1 6 PHE H 1 7 PRO HD2 3.632 2.049 5.215 4.771 4.464 4.982 . 0 0 "[ . 1 . 2]" 1
162 1 6 PHE H 1 7 PRO HD3 3.960 2.078 5.842 4.455 4.250 4.654 . 0 0 "[ . 1 . 2]" 1
163 1 6 PHE H 1 17 TYR HA 4.180 2.083 6.277 4.758 4.304 5.167 . 0 0 "[ . 1 . 2]" 1
164 1 6 PHE H 1 18 GLY H 3.601 2.045 5.157 3.806 3.568 4.146 . 0 0 "[ . 1 . 2]" 1
165 1 6 PHE H 1 18 GLY HA2 4.056 2.082 6.030 5.996 5.664 6.219 0.189 3 0 "[ . 1 . 2]" 1
166 1 6 PHE H 1 18 GLY HA3 4.299 2.081 6.517 4.957 4.451 5.379 . 0 0 "[ . 1 . 2]" 1
167 1 6 PHE H 1 19 ARG H 3.353 2.004 4.702 3.499 3.004 3.831 . 0 0 "[ . 1 . 2]" 1
168 1 6 PHE H 1 19 ARG HA 4.233 2.083 6.383 4.884 4.688 5.205 . 0 0 "[ . 1 . 2]" 1
169 1 6 PHE H 1 19 ARG HB2 3.908 2.076 5.740 4.140 3.762 4.371 . 0 0 "[ . 1 . 2]" 1
170 1 6 PHE H 1 19 ARG HG2 4.184 2.083 6.285 5.335 5.006 5.553 . 0 0 "[ . 1 . 2]" 1
171 1 6 PHE H 1 20 LYS H 4.474 2.072 6.876 4.977 4.711 5.240 . 0 0 "[ . 1 . 2]" 1
172 1 6 PHE H 1 20 LYS HG2 4.062 2.082 6.042 4.511 3.636 5.632 . 0 0 "[ . 1 . 2]" 1
173 1 6 PHE H 1 20 LYS HG3 3.907 2.075 5.739 4.382 3.705 4.886 . 0 0 "[ . 1 . 2]" 1
174 1 6 PHE H 1 21 PHE H 3.742 2.062 5.422 4.868 4.238 5.169 . 0 0 "[ . 1 . 2]" 1
175 1 6 PHE H 1 21 PHE QD 3.524 2.033 5.015 4.134 3.343 4.519 . 0 0 "[ . 1 . 2]" 1
176 1 6 PHE H 1 21 PHE QE 3.485 2.027 4.943 4.413 3.643 4.949 0.006 6 0 "[ . 1 . 2]" 1
177 1 6 PHE H 1 51 TRP HZ2 3.386 2.010 4.762 3.295 2.971 3.908 . 0 0 "[ . 1 . 2]" 1
178 1 6 PHE HA 1 6 PHE QD 3.168 . 4.372 2.877 1.876 3.047 0.088 18 0 "[ . 1 . 2]" 1
179 1 6 PHE HA 1 7 PRO HD2 2.351 . 3.014 2.364 2.109 2.509 . 0 0 "[ . 1 . 2]" 1
180 1 6 PHE HA 1 7 PRO HD3 2.290 . 2.919 2.005 1.865 2.265 . 0 0 "[ . 1 . 2]" 1
181 1 6 PHE HA 1 51 TRP HE1 2.492 . 3.237 2.068 1.777 2.372 . 0 0 "[ . 1 . 2]" 1
182 1 6 PHE HA 1 51 TRP HZ2 2.802 . 3.744 2.952 2.488 3.488 . 0 0 "[ . 1 . 2]" 1
183 1 6 PHE HB2 1 6 PHE QD 2.510 . 3.266 2.383 2.254 2.754 . 0 0 "[ . 1 . 2]" 1
184 1 6 PHE HB2 1 18 GLY H 3.221 . 4.466 4.436 4.189 4.528 0.062 14 0 "[ . 1 . 2]" 1
185 1 6 PHE HB2 1 19 ARG H 3.140 . 4.323 3.761 3.323 4.109 . 0 0 "[ . 1 . 2]" 1
186 1 6 PHE HB2 1 19 ARG HB2 3.193 . 4.416 3.338 2.730 3.794 . 0 0 "[ . 1 . 2]" 1
187 1 6 PHE HB2 1 21 PHE QE 2.619 . 3.442 2.759 2.038 3.415 . 0 0 "[ . 1 . 2]" 1
188 1 6 PHE HB2 1 51 TRP HE1 3.563 2.040 5.086 3.890 3.325 4.164 . 0 0 "[ . 1 . 2]" 1
189 1 6 PHE HB2 1 51 TRP HZ2 2.778 . 3.704 2.347 2.104 2.662 . 0 0 "[ . 1 . 2]" 1
190 1 6 PHE HB3 1 6 PHE QD 2.498 . 3.247 2.415 2.325 2.601 . 0 0 "[ . 1 . 2]" 1
191 1 6 PHE HB3 1 16 ASN HB2 3.166 . 4.369 3.091 2.773 3.366 . 0 0 "[ . 1 . 2]" 1
192 1 6 PHE HB3 1 17 TYR H 4.194 2.083 6.305 4.521 3.900 5.362 . 0 0 "[ . 1 . 2]" 1
193 1 6 PHE HB3 1 18 GLY H 3.133 . 4.311 2.868 2.624 3.050 . 0 0 "[ . 1 . 2]" 1
194 1 6 PHE HB3 1 19 ARG H 2.926 . 3.954 2.718 2.445 3.173 . 0 0 "[ . 1 . 2]" 1
195 1 6 PHE HB3 1 51 TRP HE1 3.844 2.071 5.617 4.847 4.464 5.109 . 0 0 "[ . 1 . 2]" 1
196 1 6 PHE HB3 1 51 TRP HZ2 3.148 . 4.337 4.012 3.853 4.359 0.022 5 0 "[ . 1 . 2]" 1
197 1 6 PHE QD 1 8 TYR H 3.793 2.066 5.520 5.436 5.082 5.577 0.057 7 0 "[ . 1 . 2]" 1
198 1 6 PHE QD 1 28 ASP H 4.567 2.064 7.070 6.424 5.304 7.110 0.040 8 0 "[ . 1 . 2]" 1
199 1 6 PHE QD 1 7 PRO HD2 3.021 . 4.116 3.257 2.369 3.692 . 0 0 "[ . 1 . 2]" 1
200 1 6 PHE QD 1 9 LEU QD 3.165 . 4.367 3.203 2.845 3.605 . 0 0 "[ . 1 . 2]" 1
201 1 6 PHE QD 1 16 ASN H 3.908 2.075 5.741 4.074 3.675 5.145 . 0 0 "[ . 1 . 2]" 1
202 1 6 PHE QD 1 17 TYR H 3.508 2.031 4.985 3.448 2.925 4.546 . 0 0 "[ . 1 . 2]" 1
203 1 6 PHE QD 1 17 TYR HA 3.135 . 4.314 2.103 1.875 2.854 0.081 15 0 "[ . 1 . 2]" 1
204 1 6 PHE QD 1 27 ILE MG 3.038 . 4.146 2.950 2.138 3.658 . 0 0 "[ . 1 . 2]" 1
205 1 6 PHE QD 1 51 TRP HE1 3.397 2.012 4.782 3.774 2.486 4.427 . 0 0 "[ . 1 . 2]" 1
206 1 6 PHE QD 1 51 TRP HZ2 2.699 . 3.573 2.566 2.135 3.268 . 0 0 "[ . 1 . 2]" 1
207 1 6 PHE QE 1 9 LEU H 3.962 2.078 5.846 4.430 3.861 6.021 0.175 18 0 "[ . 1 . 2]" 1
208 1 6 PHE QE 1 9 LEU QD 2.474 . 3.209 1.894 1.557 2.685 0.182 9 0 "[ . 1 . 2]" 1
209 1 6 PHE QE 1 27 ILE MG 2.728 . 3.621 2.657 1.829 3.197 0.006 4 0 "[ . 1 . 2]" 1
210 1 6 PHE QE 1 55 PRO HB3 3.287 . 4.584 3.465 2.316 4.157 . 0 0 "[ . 1 . 2]" 1
211 1 6 PHE HZ 1 9 LEU QD 2.344 . 3.004 1.801 1.636 2.307 0.048 4 0 "[ . 1 . 2]" 1
212 1 6 PHE HZ 1 55 PRO HB3 3.110 . 4.271 3.782 3.050 4.291 0.020 19 0 "[ . 1 . 2]" 1
213 1 7 PRO HA 1 8 TYR H 2.535 . 3.306 2.566 2.330 3.439 0.133 18 0 "[ . 1 . 2]" 1
214 1 7 PRO HA 1 17 TYR QB 3.273 . 4.559 4.277 4.192 4.366 . 0 0 "[ . 1 . 2]" 1
215 1 7 PRO HA 1 18 GLY H 4.030 2.081 5.979 4.268 3.738 4.791 . 0 0 "[ . 1 . 2]" 1
216 1 7 PRO HA 1 19 ARG H 3.864 2.072 5.656 4.488 4.076 5.183 . 0 0 "[ . 1 . 2]" 1
217 1 7 PRO HA 1 17 TYR QD 2.949 . 3.992 2.652 2.387 3.787 . 0 0 "[ . 1 . 2]" 1
218 1 7 PRO HA 1 17 TYR QE 2.796 . 3.734 2.990 2.561 3.885 0.151 18 0 "[ . 1 . 2]" 1
219 1 7 PRO QB 1 7 PRO HD3 2.791 . 3.726 3.052 2.819 3.206 . 0 0 "[ . 1 . 2]" 1
220 1 7 PRO QB 1 7 PRO HG3 2.338 . 2.994 2.186 2.181 2.202 . 0 0 "[ . 1 . 2]" 1
221 1 7 PRO QB 1 8 TYR H 2.499 . 3.248 2.161 1.831 2.523 . 0 0 "[ . 1 . 2]" 1
222 1 7 PRO QB 1 51 TRP HE1 3.873 2.073 5.673 4.819 4.276 5.271 . 0 0 "[ . 1 . 2]" 1
223 1 7 PRO HB2 1 7 PRO HD2 3.033 . 4.137 3.956 3.861 4.068 . 0 0 "[ . 1 . 2]" 1
224 1 7 PRO HB2 1 7 PRO HD3 3.155 . 4.349 4.009 3.903 4.080 . 0 0 "[ . 1 . 2]" 1
225 1 7 PRO HB2 1 8 TYR H 2.869 . 3.857 2.190 1.839 2.589 0.042 18 0 "[ . 1 . 2]" 1
226 1 7 PRO HB3 1 7 PRO HD3 3.156 . 4.351 3.165 2.891 3.352 . 0 0 "[ . 1 . 2]" 1
227 1 7 PRO HB3 1 7 PRO HG2 2.667 . 3.521 2.985 2.970 3.007 . 0 0 "[ . 1 . 2]" 1
228 1 7 PRO HB3 1 8 TYR H 2.792 . 3.728 3.359 3.222 3.521 . 0 0 "[ . 1 . 2]" 1
229 1 7 PRO HD2 1 7 PRO HG2 2.444 . 3.161 2.275 2.261 2.311 . 0 0 "[ . 1 . 2]" 1
230 1 7 PRO HD2 1 7 PRO HG3 2.446 . 3.164 2.787 2.712 2.851 . 0 0 "[ . 1 . 2]" 1
231 1 7 PRO HD2 1 8 TYR H 4.132 2.084 6.180 5.066 3.616 5.461 . 0 0 "[ . 1 . 2]" 1
232 1 7 PRO HD2 1 51 TRP HE1 2.855 . 3.833 3.498 3.205 3.850 0.017 14 0 "[ . 1 . 2]" 1
233 1 7 PRO HD2 1 55 PRO HG3 3.064 . 4.191 3.390 2.524 4.231 0.040 3 0 "[ . 1 . 2]" 1
234 1 7 PRO HD3 1 7 PRO HG2 2.509 . 3.264 2.939 2.896 2.992 . 0 0 "[ . 1 . 2]" 1
235 1 7 PRO HD3 1 7 PRO HG3 2.477 . 3.213 2.277 2.263 2.314 . 0 0 "[ . 1 . 2]" 1
236 1 7 PRO HD3 1 8 TYR H 4.227 2.083 6.371 5.448 4.365 5.606 . 0 0 "[ . 1 . 2]" 1
237 1 7 PRO HD3 1 44 VAL QG 3.273 . 4.559 3.613 3.334 4.164 . 0 0 "[ . 1 . 2]" 1
238 1 7 PRO HD3 1 51 TRP HD1 2.738 . 3.638 2.802 2.566 3.153 . 0 0 "[ . 1 . 2]" 1
239 1 7 PRO HD3 1 51 TRP HE1 2.618 . 3.441 2.356 1.925 2.958 . 0 0 "[ . 1 . 2]" 1
240 1 7 PRO HD3 1 55 PRO HG3 2.697 . 3.570 2.759 2.493 2.951 . 0 0 "[ . 1 . 2]" 1
241 1 7 PRO HG2 1 8 TYR H 3.593 2.044 5.142 3.871 2.009 4.350 0.035 18 0 "[ . 1 . 2]" 1
242 1 7 PRO HG2 1 8 TYR HA 3.159 . 4.356 4.246 3.729 4.404 0.048 5 0 "[ . 1 . 2]" 1
243 1 7 PRO HG2 1 9 LEU QD 3.019 . 4.113 3.132 2.371 3.768 . 0 0 "[ . 1 . 2]" 1
244 1 7 PRO HG3 1 8 TYR H 3.678 2.055 5.301 4.698 3.440 5.063 . 0 0 "[ . 1 . 2]" 1
245 1 7 PRO HG3 1 55 PRO HG2 3.005 . 4.089 3.126 2.317 3.986 . 0 0 "[ . 1 . 2]" 1
246 1 8 TYR H 1 8 TYR HA 2.723 . 3.613 2.892 2.722 2.938 . 0 0 "[ . 1 . 2]" 1
247 1 8 TYR H 1 8 TYR QB 2.454 . 3.011 2.294 2.202 3.006 . 0 0 "[ . 1 . 2]" 1
248 1 8 TYR H 1 8 TYR QD 2.773 . 3.696 3.314 2.877 3.558 . 0 0 "[ . 1 . 2]" 1
249 1 8 TYR H 1 9 LEU QD 4.454 2.074 6.834 4.280 3.615 5.320 . 0 0 "[ . 1 . 2]" 1
250 1 8 TYR H 1 17 TYR HA 4.231 2.083 6.379 5.649 5.192 6.451 0.072 18 0 "[ . 1 . 2]" 1
251 1 8 TYR H 1 17 TYR QB 4.496 2.071 6.921 4.784 4.428 5.542 . 0 0 "[ . 1 . 2]" 1
252 1 8 TYR H 1 17 TYR QD 2.801 . 3.743 3.221 2.748 3.844 0.101 18 0 "[ . 1 . 2]" 1
253 1 8 TYR H 1 17 TYR QE 2.577 . 3.374 3.147 2.419 3.409 0.035 8 0 "[ . 1 . 2]" 1
254 1 8 TYR HA 1 8 TYR QD 2.514 . 3.273 2.810 2.418 3.065 . 0 0 "[ . 1 . 2]" 1
255 1 8 TYR HA 1 9 LEU H 2.035 . 2.532 2.147 2.067 2.252 . 0 0 "[ . 1 . 2]" 1
256 1 8 TYR HA 1 9 LEU QD 3.261 . 4.537 3.216 2.604 4.207 . 0 0 "[ . 1 . 2]" 1
257 1 8 TYR HA 1 14 ASN HB3 2.977 . 4.041 2.459 1.666 2.770 0.247 17 0 "[ . 1 . 2]" 1
258 1 8 TYR HA 1 14 ASN HD21 3.853 2.071 5.635 4.086 3.365 4.415 . 0 0 "[ . 1 . 2]" 1
259 1 8 TYR HA 1 14 ASN HD22 4.536 2.067 7.005 4.614 3.428 5.254 . 0 0 "[ . 1 . 2]" 1
260 1 8 TYR HA 1 17 TYR QD 2.227 . 2.822 2.100 2.052 2.163 . 0 0 "[ . 1 . 2]" 1
261 1 8 TYR HA 1 18 GLY H 3.081 . 4.220 3.673 2.977 3.807 . 0 0 "[ . 1 . 2]" 1
262 1 8 TYR HA 1 17 TYR QD 2.563 . 3.351 3.038 2.666 3.331 . 0 0 "[ . 1 . 2]" 1
263 1 8 TYR QB 1 8 TYR QD 2.428 . 2.723 2.136 2.129 2.143 . 0 0 "[ . 1 . 2]" 1
264 1 8 TYR QB 1 9 LEU H 3.252 2.014 4.521 3.775 3.609 3.960 . 0 0 "[ . 1 . 2]" 1
265 1 8 TYR QB 1 11 ASN QD 4.461 2.073 6.849 3.777 2.344 4.679 . 0 0 "[ . 1 . 2]" 1
266 1 8 TYR QB 1 17 TYR QB 3.092 . 4.239 2.649 1.667 3.137 0.278 17 0 "[ . 1 . 2]" 1
267 1 8 TYR QB 1 17 TYR QD 2.755 . 3.666 3.092 2.724 3.313 . 0 0 "[ . 1 . 2]" 1
268 1 8 TYR QB 1 17 TYR QD 3.232 . 4.486 3.217 2.758 3.431 . 0 0 "[ . 1 . 2]" 1
269 1 8 TYR QB 1 17 TYR QE 2.844 . 3.198 3.011 2.537 3.933 0.735 18 1 "[ . 1 . + 2]" 1
270 1 8 TYR QD 1 9 LEU H 3.016 . 4.107 3.501 2.931 3.844 . 0 0 "[ . 1 . 2]" 1
271 1 8 TYR QD 1 10 GLU HA 3.260 . 4.535 3.646 2.209 4.562 0.027 5 0 "[ . 1 . 2]" 1
272 1 8 TYR QE 1 9 LEU H 3.571 2.041 5.101 4.639 4.137 5.118 0.017 12 0 "[ . 1 . 2]" 1
273 1 8 TYR QE 1 10 GLU H 3.328 . 4.657 4.195 3.185 4.708 0.051 18 0 "[ . 1 . 2]" 1
274 1 8 TYR QE 1 10 GLU HA 2.535 . 3.306 2.618 2.235 3.313 0.007 12 0 "[ . 1 . 2]" 1
275 1 8 TYR QE 1 14 ASN HD21 3.053 . 4.171 2.989 1.929 3.895 0.006 7 0 "[ . 1 . 2]" 1
276 1 9 LEU H 1 9 LEU HA 2.908 . 3.923 2.893 2.832 2.944 . 0 0 "[ . 1 . 2]" 1
277 1 9 LEU H 1 9 LEU HB2 2.701 . 3.576 2.477 1.930 2.706 . 0 0 "[ . 1 . 2]" 1
278 1 9 LEU H 1 9 LEU HB3 3.086 . 4.229 3.614 3.219 3.701 . 0 0 "[ . 1 . 2]" 1
279 1 9 LEU H 1 9 LEU QD 3.098 . 4.250 2.236 1.923 3.266 0.053 2 0 "[ . 1 . 2]" 1
280 1 9 LEU H 1 9 LEU HG 2.983 . 4.051 3.723 1.920 4.360 0.309 3 0 "[ . 1 . 2]" 1
281 1 9 LEU H 1 10 GLU H 3.979 2.079 5.879 3.963 2.552 4.530 . 0 0 "[ . 1 . 2]" 1
282 1 9 LEU H 1 10 GLU HA 4.239 2.082 6.396 5.080 4.712 5.354 . 0 0 "[ . 1 . 2]" 1
283 1 9 LEU H 1 12 GLY HA2 4.242 2.082 6.402 4.906 4.533 5.550 . 0 0 "[ . 1 . 2]" 1
284 1 9 LEU H 1 14 ASN HA 4.004 2.080 5.928 3.957 3.076 4.818 . 0 0 "[ . 1 . 2]" 1
285 1 9 LEU H 1 14 ASN HB2 4.076 2.083 6.069 4.212 3.243 5.690 . 0 0 "[ . 1 . 2]" 1
286 1 9 LEU H 1 14 ASN HD21 3.320 . 4.642 3.820 2.955 4.460 . 0 0 "[ . 1 . 2]" 1
287 1 9 LEU H 1 14 ASN HD22 4.067 2.082 6.052 4.940 2.446 6.112 0.060 20 0 "[ . 1 . 2]" 1
288 1 9 LEU H 1 17 TYR QB 4.303 2.081 6.525 4.104 3.310 5.134 . 0 0 "[ . 1 . 2]" 1
289 1 9 LEU HA 1 9 LEU HB2 2.927 . 3.955 3.017 2.877 3.039 . 0 0 "[ . 1 . 2]" 1
290 1 9 LEU HA 1 9 LEU HB3 2.889 . 3.890 2.484 2.352 2.768 . 0 0 "[ . 1 . 2]" 1
291 1 9 LEU HA 1 9 LEU QD 2.210 . 2.796 2.028 1.632 2.350 0.262 3 0 "[ . 1 . 2]" 1
292 1 9 LEU HA 1 10 GLU H 2.508 . 3.263 2.465 2.097 3.411 0.148 2 0 "[ . 1 . 2]" 1
293 1 9 LEU HA 1 10 GLU QB 3.193 . 4.416 4.183 3.896 4.476 0.060 9 0 "[ . 1 . 2]" 1
294 1 9 LEU HA 1 14 ASN HD21 4.488 2.071 6.905 6.023 4.962 6.978 0.073 7 0 "[ . 1 . 2]" 1
295 1 9 LEU HB2 1 9 LEU QD 2.783 . 3.713 2.190 2.078 2.266 . 0 0 "[ . 1 . 2]" 1
296 1 9 LEU HB2 1 9 LEU HG 2.625 . 3.452 2.586 2.498 2.978 . 0 0 "[ . 1 . 2]" 1
297 1 9 LEU HB2 1 12 GLY HA2 3.056 . 4.177 2.542 2.229 3.335 . 0 0 "[ . 1 . 2]" 1
298 1 9 LEU HB2 1 12 GLY HA3 2.912 . 3.929 4.122 3.941 4.896 0.967 3 3 "[ + . * 1 - . 2]" 1
299 1 9 LEU HB2 1 13 TYR H 3.828 2.070 5.586 4.233 3.505 5.293 . 0 0 "[ . 1 . 2]" 1
300 1 9 LEU HB2 1 14 ASN HD21 3.747 2.062 5.432 4.182 3.300 5.452 0.020 9 0 "[ . 1 . 2]" 1
301 1 9 LEU HB2 1 32 HIS H 4.468 2.072 6.864 6.328 5.970 6.937 0.073 8 0 "[ . 1 . 2]" 1
302 1 9 LEU HB3 1 12 GLY HA2 3.299 . 4.605 2.588 2.043 3.392 . 0 0 "[ . 1 . 2]" 1
303 1 9 LEU QD 1 9 LEU HG 2.179 . 2.749 1.890 1.888 1.892 . 0 0 "[ . 1 . 2]" 1
304 1 9 LEU QD 1 12 GLY HA2 3.203 . 4.434 3.213 2.153 3.688 . 0 0 "[ . 1 . 2]" 1
305 1 9 LEU QD 1 14 ASN HD21 4.397 2.077 6.717 4.327 3.488 5.219 . 0 0 "[ . 1 . 2]" 1
306 1 9 LEU QD 1 55 PRO HB2 2.662 . 3.512 2.161 1.752 2.674 0.060 3 0 "[ . 1 . 2]" 1
307 1 9 LEU QD 1 56 ARG H 3.801 2.067 5.535 4.030 3.240 4.678 . 0 0 "[ . 1 . 2]" 1
308 1 9 LEU HG 1 13 TYR H 3.157 . 4.353 3.559 2.487 4.202 . 0 0 "[ . 1 . 2]" 1
309 1 9 LEU HG 1 29 VAL H 4.228 2.083 6.373 4.947 4.406 5.327 . 0 0 "[ . 1 . 2]" 1
310 1 9 LEU HG 1 32 HIS H 4.353 2.079 6.627 6.171 5.784 6.699 0.072 10 0 "[ . 1 . 2]" 1
311 1 10 GLU H 1 10 GLU HA 2.959 . 4.010 2.720 2.262 2.920 . 0 0 "[ . 1 . 2]" 1
312 1 10 GLU H 1 10 GLU QB 3.471 2.026 4.916 2.602 2.190 3.443 . 0 0 "[ . 1 . 2]" 1
313 1 10 GLU H 1 10 GLU HG2 3.215 . 4.455 3.760 2.085 4.724 0.269 3 0 "[ . 1 . 2]" 1
314 1 10 GLU H 1 10 GLU QG 4.376 2.078 6.674 3.419 2.063 4.127 0.015 9 0 "[ . 1 . 2]" 1
315 1 10 GLU HA 1 10 GLU QB 2.422 . 3.126 2.331 2.173 2.436 . 0 0 "[ . 1 . 2]" 1
316 1 10 GLU HA 1 10 GLU QG 2.869 . 3.857 2.903 2.354 3.547 . 0 0 "[ . 1 . 2]" 1
317 1 10 GLU HA 1 14 ASN HD21 4.524 2.068 6.980 5.455 4.082 7.071 0.091 9 0 "[ . 1 . 2]" 1
318 1 10 GLU QB 1 10 GLU HG2 2.385 . 3.067 2.296 2.154 2.480 . 0 0 "[ . 1 . 2]" 1
319 1 10 GLU HB3 1 11 ASN QD 3.304 2.003 4.614 3.560 2.500 5.153 0.539 2 1 "[ + . 1 . 2]" 1
320 1 10 GLU HB3 1 11 ASN QD 3.155 . 4.350 2.199 1.784 3.016 0.176 16 0 "[ . 1 . 2]" 1
321 1 10 GLU QG 1 11 ASN QD 3.264 2.011 4.542 3.227 1.860 4.025 0.151 18 0 "[ . 1 . 2]" 1
322 1 10 GLU HG2 1 11 ASN QD 3.234 . 4.489 3.802 1.938 5.286 0.797 5 1 "[ + 1 . 2]" 1
323 1 11 ASN QD 1 57 CYS QB 4.296 2.083 6.379 3.784 2.344 4.697 . 0 0 "[ . 1 . 2]" 1
324 1 12 GLY HA2 1 13 TYR H 2.551 . 3.332 2.709 2.337 3.023 . 0 0 "[ . 1 . 2]" 1
325 1 12 GLY HA2 1 31 CYS HA 2.674 . 3.532 2.686 2.264 3.136 . 0 0 "[ . 1 . 2]" 1
326 1 12 GLY HA2 1 32 HIS H 2.885 . 3.884 3.915 3.556 4.034 0.150 15 0 "[ . 1 . 2]" 1
327 1 12 GLY HA2 1 32 HIS H 2.698 . 3.572 2.893 2.702 3.164 . 0 0 "[ . 1 . 2]" 1
328 1 12 GLY HA3 1 13 TYR H 2.638 . 3.473 2.451 2.225 2.791 . 0 0 "[ . 1 . 2]" 1
329 1 12 GLY HA3 1 31 CYS H 3.846 2.071 5.621 4.695 4.509 5.145 . 0 0 "[ . 1 . 2]" 1
330 1 12 GLY HA3 1 31 CYS HA 2.542 . 3.318 1.945 1.714 2.410 0.052 17 0 "[ . 1 . 2]" 1
331 1 12 GLY HA3 1 32 HIS H 2.625 . 3.452 2.433 2.020 2.838 . 0 0 "[ . 1 . 2]" 1
332 1 12 GLY HA3 1 32 HIS HB2 2.963 . 4.016 3.738 2.837 4.020 0.004 15 0 "[ . 1 . 2]" 1
333 1 13 TYR H 1 13 TYR HB2 2.539 . 3.313 2.396 2.295 2.489 . 0 0 "[ . 1 . 2]" 1
334 1 13 TYR H 1 13 TYR HB3 2.672 . 3.529 3.596 3.557 3.631 0.102 20 0 "[ . 1 . 2]" 1
335 1 13 TYR H 1 13 TYR QD 2.703 . 3.580 2.630 2.303 3.206 . 0 0 "[ . 1 . 2]" 1
336 1 13 TYR H 1 13 TYR QE 3.538 2.036 5.040 4.574 4.326 4.954 . 0 0 "[ . 1 . 2]" 1
337 1 13 TYR H 1 14 ASN H 3.635 2.050 5.220 3.932 2.289 4.568 . 0 0 "[ . 1 . 2]" 1
338 1 13 TYR H 1 14 ASN HB2 4.268 2.082 6.454 6.044 4.889 6.531 0.077 14 0 "[ . 1 . 2]" 1
339 1 13 TYR H 1 14 ASN HB3 4.319 2.080 6.558 5.283 4.861 5.842 . 0 0 "[ . 1 . 2]" 1
340 1 13 TYR H 1 30 ALA H 4.361 2.079 6.643 4.463 3.929 4.840 . 0 0 "[ . 1 . 2]" 1
341 1 13 TYR H 1 31 CYS HB3 4.069 2.082 6.056 4.957 4.402 5.710 . 0 0 "[ . 1 . 2]" 1
342 1 13 TYR H 1 32 HIS H 3.388 2.011 4.765 4.260 3.873 4.688 . 0 0 "[ . 1 . 2]" 1
343 1 13 TYR H 1 32 HIS HA 4.079 2.083 6.075 5.300 4.946 5.704 . 0 0 "[ . 1 . 2]" 1
344 1 13 TYR HA 1 13 TYR HB3 2.748 . 3.654 2.515 2.444 2.612 . 0 0 "[ . 1 . 2]" 1
345 1 13 TYR HA 1 13 TYR QD 2.729 . 3.623 2.782 2.304 3.129 . 0 0 "[ . 1 . 2]" 1
346 1 13 TYR HA 1 14 ASN H 2.935 . 3.969 2.386 2.101 3.462 . 0 0 "[ . 1 . 2]" 1
347 1 13 TYR HA 1 14 ASN HD21 4.035 2.081 5.989 3.769 3.425 5.319 . 0 0 "[ . 1 . 2]" 1
348 1 13 TYR HA 1 15 GLN H 3.626 2.049 5.203 4.433 3.897 5.084 . 0 0 "[ . 1 . 2]" 1
349 1 13 TYR HB2 1 13 TYR QD 2.337 . 2.993 2.364 2.281 2.489 . 0 0 "[ . 1 . 2]" 1
350 1 13 TYR HB2 1 14 ASN H 3.764 2.064 5.464 4.135 3.081 4.493 . 0 0 "[ . 1 . 2]" 1
351 1 13 TYR HB2 1 15 GLN H 3.339 2.001 4.677 3.905 3.140 4.602 . 0 0 "[ . 1 . 2]" 1
352 1 13 TYR HB2 1 15 GLN HE21 4.071 2.083 6.059 3.889 2.605 5.114 . 0 0 "[ . 1 . 2]" 1
353 1 13 TYR HB2 1 15 GLN HE22 3.745 2.062 5.428 4.451 2.161 5.324 . 0 0 "[ . 1 . 2]" 1
354 1 13 TYR HB2 1 30 ALA H 3.190 . 4.411 3.868 3.283 4.481 0.070 3 0 "[ . 1 . 2]" 1
355 1 13 TYR HB2 1 30 ALA MB 2.490 . 3.234 2.479 1.782 3.244 0.010 6 0 "[ . 1 . 2]" 1
356 1 13 TYR HB3 1 13 TYR QD 2.345 . 3.005 2.456 2.320 2.644 . 0 0 "[ . 1 . 2]" 1
357 1 13 TYR HB3 1 14 ASN H 3.541 2.036 5.046 3.658 2.484 4.156 . 0 0 "[ . 1 . 2]" 1
358 1 13 TYR HB3 1 15 GLN H 3.053 . 4.172 3.589 2.521 4.190 0.018 14 0 "[ . 1 . 2]" 1
359 1 13 TYR HB3 1 15 GLN H 2.903 . 3.914 3.519 2.519 3.977 0.063 11 0 "[ . 1 . 2]" 1
360 1 13 TYR HB3 1 15 GLN HE21 3.953 2.077 5.829 3.652 2.194 5.260 . 0 0 "[ . 1 . 2]" 1
361 1 13 TYR HB3 1 15 GLN HE22 3.659 2.053 5.265 4.502 2.049 5.309 0.044 9 0 "[ . 1 . 2]" 1
362 1 13 TYR QD 1 14 ASN H 3.798 2.067 5.529 4.264 3.667 4.668 . 0 0 "[ . 1 . 2]" 1
363 1 13 TYR QD 1 14 ASN H 3.138 . 4.319 3.922 3.483 4.328 0.009 11 0 "[ . 1 . 2]" 1
364 1 13 TYR QD 1 30 ALA H 4.409 2.076 6.742 4.639 4.168 5.282 . 0 0 "[ . 1 . 2]" 1
365 1 13 TYR QD 1 31 CYS H 3.716 2.059 5.373 4.100 2.710 4.725 . 0 0 "[ . 1 . 2]" 1
366 1 13 TYR QD 1 32 HIS H 4.186 2.083 6.289 4.355 3.519 5.187 . 0 0 "[ . 1 . 2]" 1
367 1 13 TYR QD 1 32 HIS HA 3.185 . 4.402 3.996 3.343 4.455 0.053 15 0 "[ . 1 . 2]" 1
368 1 13 TYR QE 1 31 CYS H 4.159 2.083 6.235 5.151 3.610 6.232 . 0 0 "[ . 1 . 2]" 1
369 1 13 TYR QE 1 32 HIS H 4.089 2.083 6.095 4.358 3.680 5.208 . 0 0 "[ . 1 . 2]" 1
370 1 13 TYR QE 1 32 HIS HA 2.534 . 3.305 2.512 1.846 3.293 . 0 0 "[ . 1 . 2]" 1
371 1 13 TYR QE 1 33 PRO HD3 2.759 . 3.673 3.104 2.112 3.676 0.003 6 0 "[ . 1 . 2]" 1
372 1 14 ASN H 1 14 ASN HB2 3.333 . 4.666 3.525 2.433 4.005 . 0 0 "[ . 1 . 2]" 1
373 1 14 ASN H 1 14 ASN HB3 3.147 . 4.335 3.105 2.874 4.004 . 0 0 "[ . 1 . 2]" 1
374 1 14 ASN H 1 14 ASN HD21 3.571 2.041 5.101 2.565 2.067 3.659 . 0 0 "[ . 1 . 2]" 1
375 1 14 ASN HA 1 14 ASN HB2 2.843 . 3.813 2.630 2.446 3.026 . 0 0 "[ . 1 . 2]" 1
376 1 14 ASN HA 1 14 ASN HB3 2.988 . 4.060 2.368 2.293 2.509 . 0 0 "[ . 1 . 2]" 1
377 1 14 ASN HA 1 14 ASN HD21 3.687 2.056 5.318 3.877 3.660 4.366 . 0 0 "[ . 1 . 2]" 1
378 1 14 ASN HA 1 15 GLN H 2.751 . 3.659 2.585 2.275 2.824 . 0 0 "[ . 1 . 2]" 1
379 1 14 ASN HA 1 16 ASN H 3.142 . 4.326 3.223 2.912 4.120 . 0 0 "[ . 1 . 2]" 1
380 1 14 ASN HA 1 17 TYR H 3.062 . 4.187 3.490 3.098 4.082 . 0 0 "[ . 1 . 2]" 1
381 1 14 ASN HB2 1 14 ASN HD21 2.762 . 3.677 3.256 2.228 3.492 . 0 0 "[ . 1 . 2]" 1
382 1 14 ASN HB2 1 15 GLN H 3.660 2.052 5.268 4.350 4.085 4.463 . 0 0 "[ . 1 . 2]" 1
383 1 14 ASN HB2 1 17 TYR H 3.179 . 4.392 3.384 2.770 4.442 0.050 5 0 "[ . 1 . 2]" 1
384 1 14 ASN HB2 1 17 TYR QB 2.693 . 3.563 2.007 1.699 3.338 0.124 6 0 "[ . 1 . 2]" 1
385 1 14 ASN HB3 1 14 ASN HD21 2.596 . 3.405 2.426 2.155 3.472 0.067 5 0 "[ . 1 . 2]" 1
386 1 14 ASN HB3 1 14 ASN HD22 3.082 . 4.222 3.572 3.450 4.059 . 0 0 "[ . 1 . 2]" 1
387 1 14 ASN HB3 1 17 TYR H 3.447 2.021 4.873 4.312 2.960 4.916 0.043 18 0 "[ . 1 . 2]" 1
388 1 14 ASN HB3 1 17 TYR QB 2.522 . 3.286 2.726 1.669 3.291 0.089 17 0 "[ . 1 . 2]" 1
389 1 15 GLN H 1 15 GLN HA 2.459 . 3.185 2.832 2.784 2.901 . 0 0 "[ . 1 . 2]" 1
390 1 15 GLN H 1 15 GLN HB2 2.519 . 3.280 2.559 2.320 3.577 0.297 13 0 "[ . 1 . 2]" 1
391 1 15 GLN H 1 15 GLN HB3 2.656 . 3.503 3.518 2.554 3.600 0.097 20 0 "[ . 1 . 2]" 1
392 1 15 GLN H 1 15 GLN HE21 3.871 2.073 5.669 4.363 3.142 5.171 . 0 0 "[ . 1 . 2]" 1
393 1 15 GLN H 1 15 GLN HE22 3.916 2.076 5.756 5.300 3.844 5.786 0.030 10 0 "[ . 1 . 2]" 1
394 1 15 GLN H 1 15 GLN HG2 3.030 . 4.132 3.388 2.035 4.129 . 0 0 "[ . 1 . 2]" 1
395 1 15 GLN H 1 15 GLN QG 2.500 . 3.250 2.154 1.888 3.089 . 0 0 "[ . 1 . 2]" 1
396 1 15 GLN H 1 15 GLN HG3 3.052 . 4.170 2.307 1.907 3.726 0.027 8 0 "[ . 1 . 2]" 1
397 1 15 GLN H 1 16 ASN HD21 4.265 2.082 6.448 4.434 3.541 5.703 . 0 0 "[ . 1 . 2]" 1
398 1 15 GLN H 1 16 ASN HD22 4.377 2.078 6.676 5.258 4.487 5.709 . 0 0 "[ . 1 . 2]" 1
399 1 15 GLN H 1 17 TYR H 3.348 2.003 4.693 4.001 3.509 4.408 . 0 0 "[ . 1 . 2]" 1
400 1 15 GLN HA 1 15 GLN HB2 2.345 . 3.005 2.989 2.439 3.024 0.019 16 0 "[ . 1 . 2]" 1
401 1 15 GLN HA 1 15 GLN QB 2.222 . 2.814 2.344 2.180 2.440 . 0 0 "[ . 1 . 2]" 1
402 1 15 GLN HA 1 15 GLN HB3 2.290 . 2.919 2.456 2.376 2.581 . 0 0 "[ . 1 . 2]" 1
403 1 15 GLN HA 1 15 GLN HG2 2.829 . 3.789 2.793 2.468 3.692 . 0 0 "[ . 1 . 2]" 1
404 1 15 GLN HA 1 15 GLN QG 3.026 . 4.125 2.524 2.305 3.342 . 0 0 "[ . 1 . 2]" 1
405 1 15 GLN HA 1 15 GLN HG3 3.034 . 4.139 3.041 2.333 3.819 . 0 0 "[ . 1 . 2]" 1
406 1 15 GLN HA 1 16 ASN H 3.218 . 4.461 3.452 3.331 3.565 . 0 0 "[ . 1 . 2]" 1
407 1 15 GLN HA 1 17 TYR H 3.304 . 4.614 4.049 3.868 4.380 . 0 0 "[ . 1 . 2]" 1
408 1 15 GLN QB 1 15 GLN HG2 2.307 . 2.946 2.300 2.140 2.399 . 0 0 "[ . 1 . 2]" 1
409 1 15 GLN QB 1 16 ASN H 3.309 . 4.623 2.885 2.009 3.708 . 0 0 "[ . 1 . 2]" 1
410 1 15 GLN HB2 1 15 GLN HE21 3.931 2.077 5.785 3.596 1.982 4.515 0.095 20 0 "[ . 1 . 2]" 1
411 1 15 GLN HB2 1 15 GLN HE22 4.534 2.067 7.001 4.194 3.615 4.822 . 0 0 "[ . 1 . 2]" 1
412 1 15 GLN HB2 1 15 GLN HG2 2.414 . 3.113 2.960 2.541 3.010 . 0 0 "[ . 1 . 2]" 1
413 1 15 GLN HB2 1 15 GLN QG 2.349 . 3.011 2.370 2.274 2.459 . 0 0 "[ . 1 . 2]" 1
414 1 15 GLN HB2 1 16 ASN HD21 3.943 2.078 5.808 3.754 2.582 5.147 . 0 0 "[ . 1 . 2]" 1
415 1 15 GLN HB2 1 16 ASN HD22 3.901 2.074 5.728 3.813 3.111 5.072 . 0 0 "[ . 1 . 2]" 1
416 1 15 GLN HB2 1 17 TYR H 4.121 2.083 6.159 4.989 4.561 5.547 . 0 0 "[ . 1 . 2]" 1
417 1 15 GLN HB3 1 15 GLN HE21 3.837 2.070 5.604 3.798 2.548 4.453 . 0 0 "[ . 1 . 2]" 1
418 1 15 GLN HB3 1 15 GLN HE22 4.361 2.079 6.643 4.426 3.688 4.972 . 0 0 "[ . 1 . 2]" 1
419 1 15 GLN HB3 1 15 GLN HG2 2.479 . 3.216 2.400 2.269 2.525 . 0 0 "[ . 1 . 2]" 1
420 1 15 GLN HB3 1 15 GLN QG 2.420 . 3.123 2.300 2.143 2.399 . 0 0 "[ . 1 . 2]" 1
421 1 15 GLN HE21 1 15 GLN HG2 2.724 . 3.614 2.713 2.224 3.512 . 0 0 "[ . 1 . 2]" 1
422 1 15 GLN HE21 1 15 GLN HG3 2.658 . 3.506 2.790 2.227 3.477 . 0 0 "[ . 1 . 2]" 1
423 1 15 GLN HE21 1 30 ALA MB 3.636 2.050 5.222 3.586 2.558 4.831 . 0 0 "[ . 1 . 2]" 1
424 1 15 GLN HE22 1 15 GLN HG3 3.125 . 4.297 3.732 3.481 4.054 . 0 0 "[ . 1 . 2]" 1
425 1 15 GLN HE22 1 30 ALA MB 3.237 . 4.495 3.326 2.211 4.495 0.000 3 0 "[ . 1 . 2]" 1
426 1 15 GLN QG 1 16 ASN H 2.834 . 3.797 3.370 2.607 3.606 . 0 0 "[ . 1 . 2]" 1
427 1 15 GLN HG2 1 16 ASN HD22 3.147 . 4.335 3.792 3.148 4.014 . 0 0 "[ . 1 . 2]" 1
428 1 15 GLN HG2 1 17 TYR H 3.480 2.026 4.934 4.277 4.142 4.573 . 0 0 "[ . 1 . 2]" 1
429 1 15 GLN HG2 1 31 CYS H 3.971 2.079 5.863 4.802 4.340 4.921 . 0 0 "[ . 1 . 2]" 1
430 1 16 ASN H 1 16 ASN HB2 2.656 . 3.502 2.707 2.444 3.794 0.292 15 0 "[ . 1 . 2]" 1
431 1 16 ASN H 1 16 ASN HD21 3.255 . 4.526 3.380 2.552 4.409 . 0 0 "[ . 1 . 2]" 1
432 1 16 ASN H 1 16 ASN HD22 3.556 2.039 5.073 4.214 3.431 4.849 . 0 0 "[ . 1 . 2]" 1
433 1 16 ASN H 1 17 TYR H 2.368 . 3.041 2.317 2.141 2.887 . 0 0 "[ . 1 . 2]" 1
434 1 16 ASN H 1 17 TYR HA 3.980 2.079 5.881 4.522 4.207 4.768 . 0 0 "[ . 1 . 2]" 1
435 1 16 ASN H 1 17 TYR QB 3.764 2.064 5.236 3.943 3.766 4.131 . 0 0 "[ . 1 . 2]" 1
436 1 16 ASN H 1 17 TYR QB 3.045 . 4.157 3.390 2.894 3.501 . 0 0 "[ . 1 . 2]" 1
437 1 16 ASN H 1 19 ARG HD2 4.235 2.083 6.387 5.206 4.729 6.248 . 0 0 "[ . 1 . 2]" 1
438 1 16 ASN HA 1 17 TYR H 3.191 . 4.413 3.167 2.726 3.355 . 0 0 "[ . 1 . 2]" 1
439 1 16 ASN HA 1 19 ARG HD2 2.863 . 3.847 2.399 1.973 3.530 . 0 0 "[ . 1 . 2]" 1
440 1 16 ASN HA 1 19 ARG HD3 2.957 . 4.006 3.475 2.142 3.983 . 0 0 "[ . 1 . 2]" 1
441 1 16 ASN HA 1 19 ARG HG3 3.169 . 4.374 3.213 2.948 3.793 . 0 0 "[ . 1 . 2]" 1
442 1 16 ASN HB2 1 16 ASN HD21 2.666 . 3.519 2.503 2.172 3.514 . 0 0 "[ . 1 . 2]" 1
443 1 16 ASN HB2 1 16 ASN HD22 2.914 . 3.933 3.604 3.461 4.046 0.113 8 0 "[ . 1 . 2]" 1
444 1 16 ASN HB2 1 17 TYR H 3.319 . 4.641 3.695 3.342 4.278 . 0 0 "[ . 1 . 2]" 1
445 1 16 ASN HB2 1 21 PHE HZ 3.076 . 4.211 3.391 2.378 3.952 . 0 0 "[ . 1 . 2]" 1
446 1 16 ASN HB2 1 51 TRP HE1 4.173 2.083 6.263 6.315 6.139 6.470 0.207 18 0 "[ . 1 . 2]" 1
447 1 16 ASN HB3 1 16 ASN HD21 2.864 . 3.848 3.042 2.231 3.475 . 0 0 "[ . 1 . 2]" 1
448 1 16 ASN HB3 1 19 ARG H 3.787 2.066 5.508 4.701 4.032 6.388 0.880 5 2 "[ + 1 - 2]" 1
449 1 16 ASN HB3 1 19 ARG HD2 3.185 . 4.402 3.001 2.284 4.022 . 0 0 "[ . 1 . 2]" 1
450 1 16 ASN HB3 1 19 ARG HD3 3.230 . 4.482 3.524 1.949 4.486 0.029 19 0 "[ . 1 . 2]" 1
451 1 16 ASN HB3 1 21 PHE HZ 3.183 . 4.399 3.449 2.224 4.402 0.003 6 0 "[ . 1 . 2]" 1
452 1 16 ASN HD21 1 27 ILE MD 3.497 2.029 4.965 3.461 2.379 4.685 . 0 0 "[ . 1 . 2]" 1
453 1 16 ASN HD21 1 27 ILE HG12 3.726 2.060 5.392 3.939 2.796 5.646 0.254 16 0 "[ . 1 . 2]" 1
454 1 16 ASN HD21 1 27 ILE HG13 3.962 2.078 5.846 3.716 2.267 5.225 . 0 0 "[ . 1 . 2]" 1
455 1 16 ASN HD21 1 27 ILE MG 3.462 2.024 4.900 3.992 2.448 4.813 . 0 0 "[ . 1 . 2]" 1
456 1 16 ASN HD21 1 28 ASP H 4.524 2.068 6.980 5.469 3.726 7.045 0.065 8 0 "[ . 1 . 2]" 1
457 1 16 ASN HD22 1 27 ILE HG12 3.087 . 4.230 3.166 2.369 4.291 0.061 16 0 "[ . 1 . 2]" 1
458 1 16 ASN HD22 1 28 ASP H 4.127 2.083 6.171 4.611 3.417 5.673 . 0 0 "[ . 1 . 2]" 1
459 1 16 ASN HD22 1 27 ILE MD 2.599 . 3.410 2.732 1.791 4.171 0.761 5 1 "[ + 1 . 2]" 1
460 1 16 ASN HD22 1 27 ILE HG12 3.686 2.055 5.317 3.747 2.381 5.094 . 0 0 "[ . 1 . 2]" 1
461 1 16 ASN HD22 1 27 ILE HG13 3.938 2.077 5.799 3.430 2.289 5.054 . 0 0 "[ . 1 . 2]" 1
462 1 17 TYR H 1 17 TYR HA 2.664 . 3.515 2.825 2.797 2.889 . 0 0 "[ . 1 . 2]" 1
463 1 17 TYR H 1 17 TYR QB 2.310 . 2.950 2.209 2.025 2.256 . 0 0 "[ . 1 . 2]" 1
464 1 17 TYR H 1 18 GLY H 3.378 2.008 4.748 4.504 4.417 4.561 . 0 0 "[ . 1 . 2]" 1
465 1 17 TYR HA 1 17 TYR QD 2.868 . 3.855 2.698 2.208 2.913 . 0 0 "[ . 1 . 2]" 1
466 1 17 TYR HA 1 18 GLY H 2.200 . 2.781 2.126 2.087 2.275 . 0 0 "[ . 1 . 2]" 1
467 1 17 TYR HA 1 18 GLY HA2 3.250 . 4.517 4.389 4.371 4.455 . 0 0 "[ . 1 . 2]" 1
468 1 17 TYR HA 1 19 ARG H 2.974 . 4.035 3.331 3.017 3.508 . 0 0 "[ . 1 . 2]" 1
469 1 17 TYR QB 1 17 TYR QD 2.549 . 3.008 2.143 2.133 2.195 . 0 0 "[ . 1 . 2]" 1
470 1 17 TYR QB 1 18 GLY H 3.089 . 4.234 3.707 2.991 3.827 . 0 0 "[ . 1 . 2]" 1
471 1 18 GLY H 1 18 GLY HA2 2.399 . 3.090 2.941 2.919 2.957 . 0 0 "[ . 1 . 2]" 1
472 1 18 GLY H 1 18 GLY HA3 2.434 . 3.145 2.400 2.348 2.468 . 0 0 "[ . 1 . 2]" 1
473 1 18 GLY H 1 19 ARG H 2.656 . 3.502 2.272 2.193 2.345 . 0 0 "[ . 1 . 2]" 1
474 1 18 GLY H 1 19 ARG HA 3.993 2.080 5.906 4.895 4.783 4.965 . 0 0 "[ . 1 . 2]" 1
475 1 18 GLY H 1 19 ARG HB2 3.836 2.070 5.602 4.513 4.395 4.604 . 0 0 "[ . 1 . 2]" 1
476 1 18 GLY H 1 19 ARG HB3 3.962 2.079 5.845 5.861 5.738 5.911 0.066 17 0 "[ . 1 . 2]" 1
477 1 18 GLY HA2 1 19 ARG H 2.965 . 4.020 3.251 3.065 3.400 . 0 0 "[ . 1 . 2]" 1
478 1 18 GLY HA2 1 20 LYS H 3.755 2.063 5.447 5.422 5.155 5.616 0.169 7 0 "[ . 1 . 2]" 1
479 1 18 GLY HA3 1 19 ARG H 3.085 . 4.227 3.259 3.097 3.416 . 0 0 "[ . 1 . 2]" 1
480 1 19 ARG H 1 19 ARG HA 2.605 . 3.419 2.921 2.887 2.939 . 0 0 "[ . 1 . 2]" 1
481 1 19 ARG H 1 19 ARG HB2 2.458 . 3.183 2.445 2.343 2.527 . 0 0 "[ . 1 . 2]" 1
482 1 19 ARG H 1 19 ARG HB3 2.901 . 3.911 3.643 3.593 3.694 . 0 0 "[ . 1 . 2]" 1
483 1 19 ARG H 1 19 ARG HG2 3.009 . 4.095 3.838 3.589 4.097 0.002 16 0 "[ . 1 . 2]" 1
484 1 19 ARG H 1 19 ARG HG3 2.847 . 3.820 2.730 2.445 3.061 . 0 0 "[ . 1 . 2]" 1
485 1 19 ARG H 1 21 PHE QE 3.457 2.023 4.891 4.445 3.942 4.844 . 0 0 "[ . 1 . 2]" 1
486 1 19 ARG HA 1 19 ARG HB2 2.582 . 3.382 3.016 3.005 3.022 . 0 0 "[ . 1 . 2]" 1
487 1 19 ARG HA 1 19 ARG HB3 2.611 . 3.429 2.501 2.442 2.563 . 0 0 "[ . 1 . 2]" 1
488 1 19 ARG HA 1 19 ARG HG2 2.523 . 3.287 2.507 2.331 2.630 . 0 0 "[ . 1 . 2]" 1
489 1 19 ARG HA 1 19 ARG HG3 2.481 . 3.219 3.025 2.899 3.181 . 0 0 "[ . 1 . 2]" 1
490 1 19 ARG HA 1 20 LYS H 2.079 . 2.598 2.248 2.190 2.391 . 0 0 "[ . 1 . 2]" 1
491 1 19 ARG HA 1 21 PHE H 4.412 2.076 6.748 6.182 5.995 6.354 . 0 0 "[ . 1 . 2]" 1
492 1 19 ARG HB2 1 19 ARG HD2 2.737 . 3.636 2.890 2.376 3.751 0.115 15 0 "[ . 1 . 2]" 1
493 1 19 ARG HB2 1 19 ARG HD3 2.797 . 3.736 2.841 2.312 3.214 . 0 0 "[ . 1 . 2]" 1
494 1 19 ARG HB2 1 19 ARG HE 4.011 2.081 5.941 4.054 3.168 4.543 . 0 0 "[ . 1 . 2]" 1
495 1 19 ARG HB2 1 19 ARG HG2 2.504 . 3.256 3.007 2.996 3.014 . 0 0 "[ . 1 . 2]" 1
496 1 19 ARG HB2 1 20 LYS H 2.911 . 3.928 3.869 3.575 3.990 0.062 16 0 "[ . 1 . 2]" 1
497 1 19 ARG HB2 1 21 PHE H 4.035 2.081 5.989 5.617 5.267 5.878 . 0 0 "[ . 1 . 2]" 1
498 1 19 ARG HB2 1 21 PHE QE 2.727 . 3.619 2.448 2.034 2.776 . 0 0 "[ . 1 . 2]" 1
499 1 19 ARG HB2 1 21 PHE HZ 3.053 . 4.172 3.536 2.842 4.016 . 0 0 "[ . 1 . 2]" 1
500 1 19 ARG HB3 1 19 ARG HD2 3.104 . 4.260 3.279 2.853 3.776 . 0 0 "[ . 1 . 2]" 1
501 1 19 ARG HB3 1 19 ARG HG2 2.322 . 2.969 2.437 2.373 2.536 . 0 0 "[ . 1 . 2]" 1
502 1 19 ARG HB3 1 20 LYS H 2.569 . 3.361 2.707 2.291 2.965 . 0 0 "[ . 1 . 2]" 1
503 1 19 ARG HB3 1 21 PHE QD 3.040 . 4.149 3.044 2.042 3.756 . 0 0 "[ . 1 . 2]" 1
504 1 19 ARG HB3 1 21 PHE QE 2.967 . 4.023 2.992 2.423 3.562 . 0 0 "[ . 1 . 2]" 1
505 1 19 ARG HB3 1 21 PHE HZ 3.076 . 4.211 3.411 2.870 4.143 . 0 0 "[ . 1 . 2]" 1
506 1 19 ARG HD2 1 19 ARG HG2 2.576 . 3.372 2.830 2.448 3.017 . 0 0 "[ . 1 . 2]" 1
507 1 19 ARG HD2 1 19 ARG HG3 2.424 . 3.129 2.430 2.334 2.540 . 0 0 "[ . 1 . 2]" 1
508 1 19 ARG HD2 1 21 PHE QE 3.127 . 4.301 3.910 3.012 4.840 0.539 4 3 "[ +. 1* - 2]" 1
509 1 19 ARG HD2 1 21 PHE HZ 2.981 . 4.047 3.391 2.725 4.080 0.033 7 0 "[ . 1 . 2]" 1
510 1 19 ARG HD3 1 19 ARG HG2 2.839 . 3.806 2.638 2.356 3.012 . 0 0 "[ . 1 . 2]" 1
511 1 19 ARG HD3 1 19 ARG HG2 2.115 . 2.652 1.938 1.903 1.994 . 0 0 "[ . 1 . 2]" 1
512 1 19 ARG HD3 1 19 ARG HG3 2.806 . 3.751 2.831 2.450 3.019 . 0 0 "[ . 1 . 2]" 1
513 1 19 ARG HD3 1 20 LYS H 3.890 2.074 5.706 5.221 4.915 5.687 . 0 0 "[ . 1 . 2]" 1
514 1 19 ARG HD3 1 21 PHE HZ 2.940 . 3.977 2.726 1.867 3.997 0.036 5 0 "[ . 1 . 2]" 1
515 1 19 ARG HE 1 19 ARG HG2 3.317 . 4.637 2.582 2.304 2.998 . 0 0 "[ . 1 . 2]" 1
516 1 19 ARG HG2 1 20 LYS H 3.084 . 4.225 3.993 3.774 4.272 0.047 13 0 "[ . 1 . 2]" 1
517 1 19 ARG HG2 1 20 LYS H 2.493 . 3.239 3.383 3.317 3.467 0.228 10 0 "[ . 1 . 2]" 1
518 1 20 LYS H 1 20 LYS HB2 2.452 . 3.173 2.496 2.334 2.640 . 0 0 "[ . 1 . 2]" 1
519 1 20 LYS H 1 20 LYS HB3 2.701 . 3.577 3.664 3.556 3.741 0.164 6 0 "[ . 1 . 2]" 1
520 1 20 LYS H 1 20 LYS HG2 3.024 . 4.121 4.219 3.945 4.490 0.369 4 0 "[ . 1 . 2]" 1
521 1 20 LYS H 1 20 LYS HG3 3.278 . 4.567 3.139 2.815 3.612 . 0 0 "[ . 1 . 2]" 1
522 1 20 LYS H 1 21 PHE H 3.589 2.043 5.135 4.380 4.290 4.458 . 0 0 "[ . 1 . 2]" 1
523 1 20 LYS H 1 21 PHE QD 3.917 2.076 5.758 4.641 4.316 4.894 . 0 0 "[ . 1 . 2]" 1
524 1 20 LYS H 1 21 PHE QE 3.985 2.080 5.890 4.752 4.273 5.106 . 0 0 "[ . 1 . 2]" 1
525 1 20 LYS HA 1 20 LYS HB2 2.722 . 3.611 3.009 2.984 3.021 . 0 0 "[ . 1 . 2]" 1
526 1 20 LYS HA 1 20 LYS HB3 2.748 . 3.654 2.531 2.428 2.628 . 0 0 "[ . 1 . 2]" 1
527 1 20 LYS HA 1 20 LYS HG2 2.913 . 3.931 2.637 2.400 3.653 . 0 0 "[ . 1 . 2]" 1
528 1 20 LYS HA 1 20 LYS HG3 2.871 . 3.860 2.804 2.514 3.063 . 0 0 "[ . 1 . 2]" 1
529 1 20 LYS HB2 1 20 LYS QE 3.165 . 4.367 2.786 1.930 4.081 0.033 15 0 "[ . 1 . 2]" 1
530 1 20 LYS HB2 1 20 LYS HG2 2.549 . 3.329 2.978 2.584 3.013 . 0 0 "[ . 1 . 2]" 1
531 1 20 LYS HB2 1 20 LYS HG3 2.801 . 3.742 2.532 2.379 2.987 . 0 0 "[ . 1 . 2]" 1
532 1 20 LYS HB2 1 21 PHE H 3.232 . 4.486 4.106 3.791 4.290 . 0 0 "[ . 1 . 2]" 1
533 1 20 LYS HB3 1 20 LYS QE 3.201 . 4.431 3.059 2.027 4.248 . 0 0 "[ . 1 . 2]" 1
534 1 20 LYS HB3 1 20 LYS HG2 2.382 . 3.063 2.376 2.260 2.501 . 0 0 "[ . 1 . 2]" 1
535 1 20 LYS HB3 1 20 LYS HG3 2.758 . 3.671 2.973 2.595 3.005 . 0 0 "[ . 1 . 2]" 1
536 1 20 LYS HB3 1 21 PHE H 2.888 . 3.889 3.045 2.662 3.334 . 0 0 "[ . 1 . 2]" 1
537 1 20 LYS QD 1 20 LYS HG2 2.352 . 3.016 2.268 2.154 2.399 . 0 0 "[ . 1 . 2]" 1
538 1 20 LYS QD 1 20 LYS HG3 2.382 . 3.063 2.308 2.167 2.456 . 0 0 "[ . 1 . 2]" 1
539 1 20 LYS QE 1 20 LYS HG2 2.890 . 3.892 2.844 2.286 3.439 . 0 0 "[ . 1 . 2]" 1
540 1 20 LYS HG2 1 21 PHE H 3.302 . 4.610 4.130 3.805 4.889 0.279 6 0 "[ . 1 . 2]" 1
541 1 20 LYS HG3 1 21 PHE H 3.133 . 4.311 4.388 4.102 4.521 0.210 5 0 "[ . 1 . 2]" 1
542 1 21 PHE H 1 21 PHE HB2 2.643 . 3.481 2.711 2.518 2.849 . 0 0 "[ . 1 . 2]" 1
543 1 21 PHE H 1 21 PHE HB3 2.882 . 3.879 3.815 3.702 3.893 0.014 15 0 "[ . 1 . 2]" 1
544 1 21 PHE H 1 21 PHE QD 2.688 . 3.555 2.966 2.439 3.304 . 0 0 "[ . 1 . 2]" 1
545 1 21 PHE H 1 22 VAL H 3.341 2.001 4.681 4.419 4.349 4.488 . 0 0 "[ . 1 . 2]" 1
546 1 21 PHE H 1 22 VAL HA 4.280 2.082 6.478 4.872 4.673 5.092 . 0 0 "[ . 1 . 2]" 1
547 1 21 PHE H 1 23 GLN QG 4.448 2.074 6.822 6.352 5.762 6.724 . 0 0 "[ . 1 . 2]" 1
548 1 21 PHE H 1 25 LYS HB2 4.398 2.077 6.719 6.261 5.647 6.794 0.075 12 0 "[ . 1 . 2]" 1
549 1 21 PHE H 1 51 TRP HZ2 3.613 2.047 5.179 4.318 3.961 4.804 . 0 0 "[ . 1 . 2]" 1
550 1 21 PHE HA 1 21 PHE HB2 2.823 . 3.780 3.031 3.022 3.041 . 0 0 "[ . 1 . 2]" 1
551 1 21 PHE HA 1 21 PHE HB3 2.530 . 3.298 2.483 2.412 2.514 . 0 0 "[ . 1 . 2]" 1
552 1 21 PHE HA 1 21 PHE QD 2.943 . 3.982 2.950 2.769 3.125 . 0 0 "[ . 1 . 2]" 1
553 1 21 PHE HA 1 22 VAL H 2.407 . 3.102 2.290 2.174 2.392 . 0 0 "[ . 1 . 2]" 1
554 1 21 PHE HA 1 22 VAL MG1 2.918 . 3.940 3.638 3.452 3.832 . 0 0 "[ . 1 . 2]" 1
555 1 21 PHE HA 1 51 TRP HE1 4.125 2.083 6.167 5.484 5.380 5.683 . 0 0 "[ . 1 . 2]" 1
556 1 21 PHE HB2 1 21 PHE QD 2.598 . 3.408 2.397 2.315 2.496 . 0 0 "[ . 1 . 2]" 1
557 1 21 PHE HB2 1 22 VAL H 3.007 . 4.092 3.829 3.634 4.084 . 0 0 "[ . 1 . 2]" 1
558 1 21 PHE HB2 1 25 LYS HB3 3.088 . 4.232 4.190 3.560 4.368 0.136 4 0 "[ . 1 . 2]" 1
559 1 21 PHE HB2 1 51 TRP HE1 4.439 2.075 6.803 6.119 5.627 6.615 . 0 0 "[ . 1 . 2]" 1
560 1 21 PHE HB2 1 51 TRP HZ2 3.108 . 4.267 3.916 3.444 4.309 0.042 16 0 "[ . 1 . 2]" 1
561 1 21 PHE HB3 1 21 PHE QD 2.502 . 3.253 2.381 2.298 2.469 . 0 0 "[ . 1 . 2]" 1
562 1 21 PHE HB3 1 22 VAL H 2.673 . 3.531 2.716 2.387 3.076 . 0 0 "[ . 1 . 2]" 1
563 1 21 PHE HB3 1 25 LYS HB2 2.750 . 3.657 2.964 2.181 3.729 0.072 13 0 "[ . 1 . 2]" 1
564 1 21 PHE HB3 1 25 LYS HB3 2.775 . 3.699 2.969 2.495 3.373 . 0 0 "[ . 1 . 2]" 1
565 1 21 PHE HB3 1 25 LYS QG 2.507 . 3.261 2.166 1.918 2.310 . 0 0 "[ . 1 . 2]" 1
566 1 21 PHE HB3 1 26 SER H 3.979 2.079 5.879 4.037 2.122 4.834 . 0 0 "[ . 1 . 2]" 1
567 1 21 PHE HB3 1 46 CYS H 4.372 2.078 6.666 5.310 4.841 5.944 . 0 0 "[ . 1 . 2]" 1
568 1 21 PHE QD 1 22 VAL H 3.143 . 4.329 3.852 3.554 4.259 . 0 0 "[ . 1 . 2]" 1
569 1 21 PHE QD 1 25 LYS HB3 3.141 . 4.325 3.626 2.841 4.333 0.008 5 0 "[ . 1 . 2]" 1
570 1 21 PHE QD 1 25 LYS QG 3.199 . 4.427 3.200 2.050 4.233 . 0 0 "[ . 1 . 2]" 1
571 1 21 PHE QD 1 51 TRP HZ2 2.556 . 3.340 2.434 2.044 2.692 . 0 0 "[ . 1 . 2]" 1
572 1 21 PHE QE 1 22 VAL H 4.405 2.077 6.733 6.001 5.748 6.358 . 0 0 "[ . 1 . 2]" 1
573 1 21 PHE HZ 1 27 ILE HG12 3.097 . 4.248 3.642 2.634 4.922 0.674 13 2 "[ . 1 + .- 2]" 1
574 1 22 VAL H 1 22 VAL HA 2.761 . 3.676 2.893 2.835 2.925 . 0 0 "[ . 1 . 2]" 1
575 1 22 VAL H 1 22 VAL MG1 2.165 . 2.728 2.423 2.207 2.608 . 0 0 "[ . 1 . 2]" 1
576 1 22 VAL H 1 22 VAL QG 2.307 . 2.945 1.866 1.800 1.897 . 0 0 "[ . 1 . 2]" 1
577 1 22 VAL H 1 22 VAL MG2 2.260 . 2.873 1.946 1.845 2.049 . 0 0 "[ . 1 . 2]" 1
578 1 22 VAL H 1 23 GLN QB 3.748 2.062 5.434 5.241 4.528 5.585 0.151 5 0 "[ . 1 . 2]" 1
579 1 22 VAL H 1 25 LYS QG 3.070 . 4.201 3.095 2.650 3.516 . 0 0 "[ . 1 . 2]" 1
580 1 22 VAL HA 1 22 VAL HB 2.259 . 2.871 2.470 2.439 2.513 . 0 0 "[ . 1 . 2]" 1
581 1 22 VAL HA 1 22 VAL MG1 2.478 . 3.215 2.336 2.278 2.393 . 0 0 "[ . 1 . 2]" 1
582 1 22 VAL HA 1 22 VAL QG 2.573 . 3.367 2.283 2.232 2.332 . 0 0 "[ . 1 . 2]" 1
583 1 22 VAL HA 1 23 GLN H 2.187 . 2.761 2.252 2.161 2.375 . 0 0 "[ . 1 . 2]" 1
584 1 22 VAL HB 1 22 VAL MG1 1.956 . 2.415 2.128 2.125 2.132 . 0 0 "[ . 1 . 2]" 1
585 1 22 VAL HB 1 22 VAL QG 1.935 . 2.385 1.897 1.895 1.901 . 0 0 "[ . 1 . 2]" 1
586 1 22 VAL HB 1 22 VAL MG2 1.976 . 2.445 2.131 2.129 2.135 . 0 0 "[ . 1 . 2]" 1
587 1 22 VAL HB 1 23 GLN H 2.291 . 2.921 2.801 2.613 3.003 0.082 13 0 "[ . 1 . 2]" 1
588 1 22 VAL MG2 1 23 GLN QB 3.014 . 4.104 3.637 2.857 4.023 . 0 0 "[ . 1 . 2]" 1
589 1 22 VAL MG2 1 25 LYS QG 2.571 . 3.364 2.389 1.880 3.419 0.055 12 0 "[ . 1 . 2]" 1
590 1 23 GLN H 1 23 GLN HA 2.349 . 3.011 2.804 2.762 2.887 . 0 0 "[ . 1 . 2]" 1
591 1 23 GLN H 1 23 GLN QB 2.412 . 3.023 2.192 2.053 2.301 . 0 0 "[ . 1 . 2]" 1
592 1 23 GLN H 1 24 GLY H 3.432 2.019 4.845 4.569 4.470 4.614 . 0 0 "[ . 1 . 2]" 1
593 1 23 GLN H 1 24 GLY H 3.308 . 4.621 4.196 4.121 4.251 . 0 0 "[ . 1 . 2]" 1
594 1 23 GLN H 1 46 CYS HB3 3.829 2.070 5.588 4.799 4.531 5.091 . 0 0 "[ . 1 . 2]" 1
595 1 23 GLN HA 1 23 GLN QB 2.155 . 2.712 2.372 2.215 2.525 . 0 0 "[ . 1 . 2]" 1
596 1 23 GLN HA 1 23 GLN HE21 3.833 2.070 5.596 4.461 4.097 5.236 . 0 0 "[ . 1 . 2]" 1
597 1 23 GLN HA 1 23 GLN HE22 4.253 2.082 6.424 5.735 5.577 5.889 . 0 0 "[ . 1 . 2]" 1
598 1 23 GLN HA 1 23 GLN QG 2.422 . 3.126 2.446 2.143 2.777 . 0 0 "[ . 1 . 2]" 1
599 1 23 GLN HA 1 24 GLY H 1.998 . 2.477 2.154 2.077 2.212 . 0 0 "[ . 1 . 2]" 1
600 1 23 GLN HA 1 25 LYS H 2.429 . 3.137 3.106 2.961 3.244 0.107 1 0 "[ . 1 . 2]" 1
601 1 23 GLN HA 1 46 CYS H 3.455 2.023 4.887 4.638 4.417 4.851 . 0 0 "[ . 1 . 2]" 1
602 1 23 GLN HA 1 46 CYS HB2 2.889 . 3.890 4.025 3.839 4.161 0.271 8 0 "[ . 1 . 2]" 1
603 1 23 GLN HA 1 46 CYS HB3 2.487 . 3.229 2.672 2.424 2.916 . 0 0 "[ . 1 . 2]" 1
604 1 23 GLN HA 1 47 MET HA 3.210 . 4.447 3.140 2.771 3.691 . 0 0 "[ . 1 . 2]" 1
605 1 23 GLN QB 1 23 GLN HE21 3.124 . 4.113 2.309 1.786 3.645 0.167 16 0 "[ . 1 . 2]" 1
606 1 23 GLN QB 1 23 GLN HE22 3.178 . 4.390 3.288 2.849 3.656 . 0 0 "[ . 1 . 2]" 1
607 1 23 GLN QB 1 23 GLN QG 2.162 . 2.723 2.075 2.036 2.093 . 0 0 "[ . 1 . 2]" 1
608 1 23 GLN QB 1 24 GLY H 3.085 . 3.788 3.562 3.262 3.726 . 0 0 "[ . 1 . 2]" 1
609 1 23 GLN QB 1 47 MET H 3.248 . 4.514 4.009 3.491 4.283 . 0 0 "[ . 1 . 2]" 1
610 1 23 GLN QB 1 48 GLU H 2.487 . 3.229 2.954 2.043 3.566 0.337 5 0 "[ . 1 . 2]" 1
611 1 23 GLN QB 1 49 ASN H 2.750 . 3.657 3.297 2.461 3.792 0.135 7 0 "[ . 1 . 2]" 1
612 1 23 GLN HE21 1 23 GLN QG 2.555 . 3.338 2.545 2.116 2.847 . 0 0 "[ . 1 . 2]" 1
613 1 23 GLN HE21 1 24 GLY H 4.221 2.083 6.359 5.497 4.559 6.003 . 0 0 "[ . 1 . 2]" 1
614 1 23 GLN HE21 1 47 MET HA 3.877 2.073 5.681 3.483 2.979 3.903 . 0 0 "[ . 1 . 2]" 1
615 1 23 GLN HE21 1 48 GLU H 3.619 2.047 5.191 2.409 1.968 3.561 0.079 10 0 "[ . 1 . 2]" 1
616 1 23 GLN HE21 1 48 GLU HA 3.262 . 4.539 2.459 1.836 3.935 0.149 14 0 "[ . 1 . 2]" 1
617 1 23 GLN HE21 1 48 GLU QG 3.033 . 4.137 3.709 2.838 4.296 0.159 9 0 "[ . 1 . 2]" 1
618 1 23 GLN HE22 1 47 MET HA 4.454 2.073 6.835 4.235 3.599 4.712 . 0 0 "[ . 1 . 2]" 1
619 1 23 GLN HE22 1 48 GLU H 3.724 2.060 5.388 2.672 2.057 3.457 0.003 4 0 "[ . 1 . 2]" 1
620 1 23 GLN HE22 1 48 GLU HA 2.805 . 3.749 2.485 2.017 3.405 . 0 0 "[ . 1 . 2]" 1
621 1 23 GLN HE22 1 48 GLU HB2 2.927 . 3.955 3.813 2.525 4.752 0.797 1 2 "[+ . - 1 . 2]" 1
622 1 23 GLN QG 1 24 GLY H 3.012 . 3.962 2.586 2.343 2.849 . 0 0 "[ . 1 . 2]" 1
623 1 23 GLN QG 1 52 SER H 3.256 . 4.528 4.621 3.408 4.907 0.379 10 0 "[ . 1 . 2]" 1
624 1 23 GLN QG 1 47 MET H 3.974 2.079 5.193 3.914 3.476 4.185 . 0 0 "[ . 1 . 2]" 1
625 1 23 GLN QG 1 47 MET HA 2.976 . 4.039 1.400 1.098 1.617 0.815 11 8 "[* .* *1+ -* * *2]" 1
626 1 23 GLN QG 1 47 MET QB 2.809 . 3.756 3.130 2.798 3.384 . 0 0 "[ . 1 . 2]" 1
627 1 24 GLY H 1 24 GLY HA2 2.996 . 4.073 2.950 2.937 2.966 . 0 0 "[ . 1 . 2]" 1
628 1 24 GLY H 1 24 GLY HA3 2.436 . 3.148 2.413 2.377 2.451 . 0 0 "[ . 1 . 2]" 1
629 1 24 GLY H 1 25 LYS H 2.544 . 3.321 2.053 1.862 2.459 . 0 0 "[ . 1 . 2]" 1
630 1 24 GLY H 1 25 LYS HA 4.073 2.082 6.064 4.774 4.648 4.890 . 0 0 "[ . 1 . 2]" 1
631 1 24 GLY H 1 45 THR HA 4.199 2.084 6.314 5.487 5.214 5.725 . 0 0 "[ . 1 . 2]" 1
632 1 24 GLY H 1 45 THR HB 3.832 2.070 5.594 4.592 4.473 4.689 . 0 0 "[ . 1 . 2]" 1
633 1 24 GLY H 1 45 THR MG 2.937 . 3.972 3.341 3.053 3.621 . 0 0 "[ . 1 . 2]" 1
634 1 24 GLY H 1 46 CYS H 3.425 2.017 4.833 3.979 3.649 4.223 . 0 0 "[ . 1 . 2]" 1
635 1 24 GLY H 1 46 CYS HB2 3.290 . 4.589 4.647 4.418 4.736 0.147 14 0 "[ . 1 . 2]" 1
636 1 24 GLY H 1 46 CYS HB3 2.896 . 3.902 2.970 2.710 3.083 . 0 0 "[ . 1 . 2]" 1
637 1 24 GLY H 1 47 MET HA 3.662 2.053 5.271 3.468 3.055 3.919 . 0 0 "[ . 1 . 2]" 1
638 1 24 GLY HA3 1 25 LYS H 2.916 . 3.937 3.137 2.946 3.454 . 0 0 "[ . 1 . 2]" 1
639 1 24 GLY HA3 1 46 CYS H 4.404 2.077 6.731 5.310 5.015 5.742 . 0 0 "[ . 1 . 2]" 1
640 1 25 LYS H 1 25 LYS HA 2.683 . 3.547 2.933 2.882 2.957 . 0 0 "[ . 1 . 2]" 1
641 1 25 LYS H 1 25 LYS HB2 2.387 . 3.071 2.427 2.232 2.941 . 0 0 "[ . 1 . 2]" 1
642 1 25 LYS H 1 25 LYS HB3 2.512 . 3.269 3.321 2.399 3.588 0.319 6 0 "[ . 1 . 2]" 1
643 1 25 LYS H 1 25 LYS QG 2.820 . 3.775 3.390 2.547 4.033 0.258 12 0 "[ . 1 . 2]" 1
644 1 25 LYS H 1 26 SER H 3.330 . 4.661 4.476 4.411 4.590 . 0 0 "[ . 1 . 2]" 1
645 1 25 LYS H 1 26 SER HA 4.179 2.083 6.275 4.940 4.772 5.226 . 0 0 "[ . 1 . 2]" 1
646 1 25 LYS H 1 45 THR HA 3.899 2.074 5.724 4.837 4.460 5.579 . 0 0 "[ . 1 . 2]" 1
647 1 25 LYS H 1 45 THR HB 3.851 2.072 5.630 4.764 4.543 5.484 . 0 0 "[ . 1 . 2]" 1
648 1 25 LYS H 1 45 THR MG 3.159 . 4.357 3.570 3.167 4.225 . 0 0 "[ . 1 . 2]" 1
649 1 25 LYS H 1 46 CYS H 3.243 . 4.505 3.279 2.955 4.006 . 0 0 "[ . 1 . 2]" 1
650 1 25 LYS H 1 46 CYS HB2 3.200 . 4.429 3.904 3.625 4.361 . 0 0 "[ . 1 . 2]" 1
651 1 25 LYS H 1 46 CYS HB3 2.860 . 3.842 2.280 2.018 2.774 . 0 0 "[ . 1 . 2]" 1
652 1 25 LYS H 1 47 MET QG 3.022 . 4.118 4.692 4.255 8.034 3.916 20 2 "[ - . 1 . +]" 1
653 1 25 LYS HA 1 25 LYS HB2 2.549 . 3.328 2.886 2.437 3.017 . 0 0 "[ . 1 . 2]" 1
654 1 25 LYS HA 1 25 LYS HB3 2.549 . 3.328 2.725 2.527 3.024 . 0 0 "[ . 1 . 2]" 1
655 1 25 LYS HA 1 25 LYS HD2 2.573 . 3.367 2.868 1.904 3.418 0.051 10 0 "[ . 1 . 2]" 1
656 1 25 LYS HA 1 25 LYS HD3 2.597 . 3.406 2.284 1.797 3.470 0.064 11 0 "[ . 1 . 2]" 1
657 1 25 LYS HA 1 25 LYS QG 2.838 . 3.804 2.707 2.363 3.025 . 0 0 "[ . 1 . 2]" 1
658 1 25 LYS HA 1 26 SER H 2.123 . 2.664 2.390 2.209 2.578 . 0 0 "[ . 1 . 2]" 1
659 1 25 LYS HA 1 26 SER HB2 3.262 . 4.539 4.366 4.190 4.484 . 0 0 "[ . 1 . 2]" 1
660 1 25 LYS HA 1 26 SER HB3 3.229 . 4.480 4.565 4.500 4.602 0.122 3 0 "[ . 1 . 2]" 1
661 1 25 LYS HA 1 27 ILE H 4.207 2.083 6.331 6.120 6.002 6.240 . 0 0 "[ . 1 . 2]" 1
662 1 25 LYS HA 1 46 CYS H 4.276 2.082 6.470 4.655 4.447 4.879 . 0 0 "[ . 1 . 2]" 1
663 1 25 LYS HB2 1 25 LYS QG 2.258 . 2.870 2.186 2.153 2.343 . 0 0 "[ . 1 . 2]" 1
664 1 25 LYS HB2 1 26 SER H 2.940 . 3.977 3.903 3.560 4.061 0.084 10 0 "[ . 1 . 2]" 1
665 1 25 LYS HB2 1 46 CYS H 3.788 2.066 5.510 4.122 3.544 5.221 . 0 0 "[ . 1 . 2]" 1
666 1 25 LYS HB3 1 25 LYS QG 2.273 . 2.893 2.320 2.142 2.379 . 0 0 "[ . 1 . 2]" 1
667 1 25 LYS HB3 1 26 SER H 2.805 . 3.749 2.776 2.171 3.907 0.158 14 0 "[ . 1 . 2]" 1
668 1 25 LYS HB3 1 46 CYS H 3.839 2.071 5.607 4.101 3.428 4.810 . 0 0 "[ . 1 . 2]" 1
669 1 25 LYS HD2 1 25 LYS QE 2.405 . 3.099 2.282 2.168 2.379 . 0 0 "[ . 1 . 2]" 1
670 1 25 LYS HD2 1 25 LYS QG 2.161 . 2.721 2.347 2.269 2.394 . 0 0 "[ . 1 . 2]" 1
671 1 25 LYS HD2 1 26 SER H 3.037 . 4.144 2.905 1.946 3.839 . 0 0 "[ . 1 . 2]" 1
672 1 25 LYS HD3 1 25 LYS HE2 2.391 . 3.077 2.664 2.393 3.017 . 0 0 "[ . 1 . 2]" 1
673 1 25 LYS HD3 1 25 LYS QE 2.397 . 3.086 2.336 2.172 2.393 . 0 0 "[ . 1 . 2]" 1
674 1 25 LYS HD3 1 25 LYS HE3 2.362 . 3.032 2.750 2.433 3.018 . 0 0 "[ . 1 . 2]" 1
675 1 25 LYS HD3 1 25 LYS QG 2.149 . 2.703 2.333 2.171 2.418 . 0 0 "[ . 1 . 2]" 1
676 1 25 LYS HD3 1 26 SER H 2.892 . 3.896 3.237 1.927 3.960 0.064 1 0 "[ . 1 . 2]" 1
677 1 25 LYS HE2 1 25 LYS QG 2.550 . 3.330 2.488 2.314 3.305 . 0 0 "[ . 1 . 2]" 1
678 1 25 LYS QG 1 26 SER H 3.168 . 4.373 3.745 2.323 4.397 0.024 3 0 "[ . 1 . 2]" 1
679 1 25 LYS QG 1 46 CYS H 4.423 2.076 6.770 5.239 4.128 5.653 . 0 0 "[ . 1 . 2]" 1
680 1 26 SER H 1 26 SER HA 2.668 . 3.522 2.919 2.893 2.939 . 0 0 "[ . 1 . 2]" 1
681 1 26 SER H 1 26 SER HB2 2.898 . 3.906 3.225 3.055 3.354 . 0 0 "[ . 1 . 2]" 1
682 1 26 SER H 1 26 SER QB 2.569 . 3.361 2.635 2.500 2.774 . 0 0 "[ . 1 . 2]" 1
683 1 26 SER H 1 26 SER HB3 2.538 . 3.311 2.796 2.653 2.958 . 0 0 "[ . 1 . 2]" 1
684 1 26 SER H 1 27 ILE H 3.566 2.040 5.092 4.377 4.257 4.444 . 0 0 "[ . 1 . 2]" 1
685 1 26 SER H 1 45 THR HA 3.753 2.063 5.443 4.622 4.409 4.852 . 0 0 "[ . 1 . 2]" 1
686 1 26 SER HA 1 26 SER HB2 2.523 . 3.287 2.456 2.432 2.491 . 0 0 "[ . 1 . 2]" 1
687 1 26 SER HA 1 26 SER HB3 2.443 . 3.159 3.025 3.012 3.034 . 0 0 "[ . 1 . 2]" 1
688 1 26 SER HA 1 27 ILE H 2.146 . 2.698 2.332 2.120 2.432 . 0 0 "[ . 1 . 2]" 1
689 1 26 SER HA 1 28 ASP H 4.409 2.077 6.741 6.272 5.953 6.404 . 0 0 "[ . 1 . 2]" 1
690 1 26 SER HA 1 44 VAL H 3.432 2.018 4.846 4.544 4.360 4.874 0.028 5 0 "[ . 1 . 2]" 1
691 1 26 SER HA 1 45 THR H 3.908 2.075 5.741 4.612 4.422 4.804 . 0 0 "[ . 1 . 2]" 1
692 1 26 SER HA 1 45 THR HA 2.188 . 2.762 2.184 1.964 2.481 . 0 0 "[ . 1 . 2]" 1
693 1 26 SER HA 1 46 CYS H 2.902 . 3.912 2.896 2.593 3.181 . 0 0 "[ . 1 . 2]" 1
694 1 26 SER HA 1 51 TRP HZ3 3.204 . 4.436 3.362 2.771 3.798 . 0 0 "[ . 1 . 2]" 1
695 1 26 SER QB 1 45 THR MG 2.961 . 4.013 2.790 2.502 2.959 . 0 0 "[ . 1 . 2]" 1
696 1 26 SER HB2 1 27 ILE H 2.712 . 3.595 3.792 3.748 3.856 0.261 3 0 "[ . 1 . 2]" 1
697 1 26 SER HB2 1 45 THR H 3.655 2.052 5.258 3.176 2.929 3.843 . 0 0 "[ . 1 . 2]" 1
698 1 26 SER HB2 1 45 THR HA 3.238 . 4.496 2.984 2.453 3.246 . 0 0 "[ . 1 . 2]" 1
699 1 26 SER HB2 1 46 CYS H 3.915 2.076 5.754 4.131 3.722 4.430 . 0 0 "[ . 1 . 2]" 1
700 1 26 SER HB3 1 27 ILE H 2.741 . 3.643 3.601 3.441 3.742 0.099 5 0 "[ . 1 . 2]" 1
701 1 26 SER HB3 1 45 THR HA 3.274 . 4.560 4.398 3.866 4.550 . 0 0 "[ . 1 . 2]" 1
702 1 27 ILE H 1 27 ILE HA 2.849 . 3.823 2.864 2.733 2.909 . 0 0 "[ . 1 . 2]" 1
703 1 27 ILE H 1 27 ILE HB 2.873 . 3.863 3.382 2.952 3.607 . 0 0 "[ . 1 . 2]" 1
704 1 27 ILE H 1 27 ILE MG 2.528 . 3.295 2.674 2.459 3.169 . 0 0 "[ . 1 . 2]" 1
705 1 27 ILE H 1 28 ASP H 3.426 2.017 4.835 4.170 3.908 4.281 . 0 0 "[ . 1 . 2]" 1
706 1 27 ILE H 1 29 VAL H 3.513 2.032 4.994 4.169 3.425 4.392 . 0 0 "[ . 1 . 2]" 1
707 1 27 ILE H 1 43 THR HA 3.379 2.009 4.749 4.064 3.880 4.586 . 0 0 "[ . 1 . 2]" 1
708 1 27 ILE H 1 43 THR HB 3.140 . 4.323 3.661 3.176 4.345 0.022 3 0 "[ . 1 . 2]" 1
709 1 27 ILE H 1 43 THR MG 2.912 . 3.929 3.332 2.746 4.074 0.145 13 0 "[ . 1 . 2]" 1
710 1 27 ILE H 1 44 VAL H 2.642 . 3.480 2.767 2.557 2.995 . 0 0 "[ . 1 . 2]" 1
711 1 27 ILE H 1 44 VAL HB 4.224 2.083 6.365 4.364 3.670 5.405 . 0 0 "[ . 1 . 2]" 1
712 1 27 ILE H 1 44 VAL QG 4.192 2.084 6.300 3.954 3.073 4.475 . 0 0 "[ . 1 . 2]" 1
713 1 27 ILE H 1 45 THR HA 2.955 . 4.003 3.812 3.380 4.032 0.029 8 0 "[ . 1 . 2]" 1
714 1 27 ILE H 1 51 TRP HE3 4.330 2.080 6.580 5.225 4.449 5.754 . 0 0 "[ . 1 . 2]" 1
715 1 27 ILE H 1 51 TRP HZ3 3.522 2.033 5.011 3.916 3.005 4.428 . 0 0 "[ . 1 . 2]" 1
716 1 27 ILE HA 1 27 ILE HB 2.460 . 3.186 2.513 2.429 2.786 . 0 0 "[ . 1 . 2]" 1
717 1 27 ILE HA 1 27 ILE MD 2.407 . 3.102 2.191 1.904 3.205 0.103 13 0 "[ . 1 . 2]" 1
718 1 27 ILE HA 1 27 ILE HG12 3.119 . 4.286 3.353 2.165 3.749 . 0 0 "[ . 1 . 2]" 1
719 1 27 ILE HA 1 27 ILE HG13 2.969 . 4.027 3.113 2.917 3.543 . 0 0 "[ . 1 . 2]" 1
720 1 27 ILE HA 1 27 ILE MG 3.121 . 4.290 3.202 3.055 3.222 . 0 0 "[ . 1 . 2]" 1
721 1 27 ILE HA 1 28 ASP H 2.059 . 2.568 2.150 2.061 2.245 . 0 0 "[ . 1 . 2]" 1
722 1 27 ILE HA 1 28 ASP HB2 3.209 . 4.445 4.370 4.169 4.583 0.138 3 0 "[ . 1 . 2]" 1
723 1 27 ILE HA 1 28 ASP HB3 3.160 . 4.358 4.529 4.385 4.666 0.308 10 0 "[ . 1 . 2]" 1
724 1 27 ILE HA 1 44 VAL H 3.929 2.076 5.782 4.651 3.378 4.978 . 0 0 "[ . 1 . 2]" 1
725 1 27 ILE HB 1 27 ILE MD 2.250 . 2.858 2.587 2.360 3.199 0.341 15 0 "[ . 1 . 2]" 1
726 1 27 ILE HB 1 27 ILE HG12 2.473 . 3.207 2.506 2.427 2.621 . 0 0 "[ . 1 . 2]" 1
727 1 27 ILE HB 1 27 ILE HG13 2.538 . 3.311 2.851 2.283 3.027 . 0 0 "[ . 1 . 2]" 1
728 1 27 ILE HB 1 27 ILE MG 2.069 . 2.583 2.120 2.110 2.127 . 0 0 "[ . 1 . 2]" 1
729 1 27 ILE HB 1 28 ASP H 2.975 . 4.037 4.080 4.000 4.185 0.148 1 0 "[ . 1 . 2]" 1
730 1 27 ILE HB 1 44 VAL H 3.836 2.070 5.602 5.269 4.782 5.583 . 0 0 "[ . 1 . 2]" 1
731 1 27 ILE MD 1 27 ILE HG12 2.397 . 3.087 2.114 2.100 2.121 . 0 0 "[ . 1 . 2]" 1
732 1 27 ILE MD 1 27 ILE HG13 2.475 . 3.210 2.116 2.103 2.123 . 0 0 "[ . 1 . 2]" 1
733 1 27 ILE MD 1 28 ASP H 2.611 . 3.429 2.107 1.692 2.654 0.101 1 0 "[ . 1 . 2]" 1
734 1 27 ILE HG12 1 27 ILE MG 2.690 . 3.558 2.515 2.266 3.192 . 0 0 "[ . 1 . 2]" 1
735 1 27 ILE HG12 1 27 ILE MG 2.167 . 2.730 2.276 2.013 2.693 . 0 0 "[ . 1 . 2]" 1
736 1 27 ILE HG12 1 28 ASP H 3.060 . 4.184 3.786 2.512 4.253 0.069 19 0 "[ . 1 . 2]" 1
737 1 27 ILE HG12 1 28 ASP H 3.043 . 4.154 3.446 1.901 3.923 0.031 3 0 "[ . 1 . 2]" 1
738 1 27 ILE HG13 1 27 ILE MG 2.404 . 3.098 2.464 2.338 2.608 . 0 0 "[ . 1 . 2]" 1
739 1 27 ILE HG13 1 28 ASP H 2.733 . 3.630 2.947 2.335 4.234 0.604 1 4 "[+ . 1 * -* 2]" 1
740 1 27 ILE MG 1 29 VAL H 3.751 2.063 5.439 3.867 3.634 4.152 . 0 0 "[ . 1 . 2]" 1
741 1 27 ILE MG 1 44 VAL H 3.158 . 4.355 3.229 2.762 4.284 . 0 0 "[ . 1 . 2]" 1
742 1 27 ILE MG 1 46 CYS H 4.052 2.082 6.022 4.125 3.909 4.518 . 0 0 "[ . 1 . 2]" 1
743 1 27 ILE MG 1 51 TRP HZ3 3.133 . 4.311 2.436 2.144 2.944 . 0 0 "[ . 1 . 2]" 1
744 1 28 ASP H 1 28 ASP HA 2.767 . 3.686 2.888 2.861 2.918 . 0 0 "[ . 1 . 2]" 1
745 1 28 ASP H 1 28 ASP HB2 2.416 . 3.117 2.723 2.464 3.186 0.069 5 0 "[ . 1 . 2]" 1
746 1 28 ASP H 1 28 ASP HB3 2.401 . 3.093 2.455 2.274 2.739 . 0 0 "[ . 1 . 2]" 1
747 1 28 ASP H 1 43 THR HA 3.666 2.053 5.279 4.305 2.130 4.767 . 0 0 "[ . 1 . 2]" 1
748 1 28 ASP H 1 43 THR HB 3.993 2.079 5.907 5.179 3.352 5.918 0.011 15 0 "[ . 1 . 2]" 1
749 1 28 ASP HA 1 28 ASP HB2 2.601 . 3.413 2.445 2.368 2.540 . 0 0 "[ . 1 . 2]" 1
750 1 28 ASP HA 1 28 ASP HB3 2.545 . 3.322 3.009 2.961 3.022 . 0 0 "[ . 1 . 2]" 1
751 1 28 ASP HA 1 29 VAL H 2.205 . 2.789 2.275 2.131 3.280 0.491 3 0 "[ . 1 . 2]" 1
752 1 28 ASP HA 1 29 VAL QG 2.858 . 3.838 3.305 2.201 3.874 0.036 3 0 "[ . 1 . 2]" 1
753 1 28 ASP HA 1 43 THR H 3.690 2.056 5.324 4.641 4.053 5.734 0.410 5 0 "[ . 1 . 2]" 1
754 1 28 ASP HA 1 43 THR MG 2.457 . 3.181 2.582 2.072 4.431 1.250 3 1 "[ + . 1 . 2]" 1
755 1 28 ASP HA 1 44 VAL H 2.864 . 3.848 3.584 2.762 3.894 0.046 6 0 "[ . 1 . 2]" 1
756 1 28 ASP QB 1 43 THR MG 3.053 . 4.172 2.767 2.272 3.603 . 0 0 "[ . 1 . 2]" 1
757 1 28 ASP HB2 1 29 VAL H 2.899 . 3.908 4.009 3.109 4.262 0.354 10 0 "[ . 1 . 2]" 1
758 1 28 ASP HB2 1 31 CYS H 4.009 2.080 5.938 5.178 3.920 5.703 . 0 0 "[ . 1 . 2]" 1
759 1 28 ASP HB2 1 37 LEU QD 3.267 . 4.548 3.592 2.293 4.111 . 0 0 "[ . 1 . 2]" 1
760 1 28 ASP HB2 1 43 THR H 3.145 . 4.332 4.110 3.298 4.368 0.036 7 0 "[ . 1 . 2]" 1
761 1 28 ASP HB3 1 44 VAL H 4.482 2.072 6.892 6.029 2.964 6.562 . 0 0 "[ . 1 . 2]" 1
762 1 29 VAL H 1 29 VAL HA 2.682 . 3.545 2.912 2.283 2.954 . 0 0 "[ . 1 . 2]" 1
763 1 29 VAL H 1 29 VAL HB 2.479 . 3.217 2.814 2.574 3.489 0.272 3 0 "[ . 1 . 2]" 1
764 1 29 VAL H 1 29 VAL QG 2.441 . 3.156 2.508 2.097 2.750 . 0 0 "[ . 1 . 2]" 1
765 1 29 VAL H 1 30 ALA H 3.910 2.076 5.744 4.245 3.439 4.526 . 0 0 "[ . 1 . 2]" 1
766 1 29 VAL H 1 37 LEU QD 3.268 . 4.549 3.567 3.085 4.227 . 0 0 "[ . 1 . 2]" 1
767 1 29 VAL H 1 42 THR HA 3.673 2.054 5.292 4.024 3.746 4.431 . 0 0 "[ . 1 . 2]" 1
768 1 29 VAL H 1 42 THR HB 3.577 2.042 5.112 3.869 3.106 5.190 0.078 1 0 "[ . 1 . 2]" 1
769 1 29 VAL H 1 43 THR H 4.014 2.081 5.947 4.719 4.310 5.006 . 0 0 "[ . 1 . 2]" 1
770 1 29 VAL H 1 43 THR HA 2.765 . 3.683 2.992 2.139 3.495 . 0 0 "[ . 1 . 2]" 1
771 1 29 VAL H 1 43 THR MG 3.300 . 4.607 3.924 3.536 4.499 . 0 0 "[ . 1 . 2]" 1
772 1 29 VAL H 1 44 VAL H 3.417 2.016 4.818 4.416 4.093 4.795 . 0 0 "[ . 1 . 2]" 1
773 1 29 VAL H 1 44 VAL QG 4.047 2.081 6.013 4.082 3.772 4.334 . 0 0 "[ . 1 . 2]" 1
774 1 29 VAL HA 1 29 VAL HB 2.713 . 3.596 2.958 2.407 3.028 . 0 0 "[ . 1 . 2]" 1
775 1 29 VAL HA 1 29 VAL QG 2.245 . 2.850 2.152 2.107 2.326 . 0 0 "[ . 1 . 2]" 1
776 1 29 VAL HA 1 30 ALA H 2.043 . 2.544 2.189 2.128 2.366 . 0 0 "[ . 1 . 2]" 1
777 1 29 VAL HA 1 30 ALA HA 3.244 . 4.507 4.394 4.341 4.439 . 0 0 "[ . 1 . 2]" 1
778 1 29 VAL HA 1 31 CYS H 4.123 2.084 6.162 5.561 4.094 6.107 . 0 0 "[ . 1 . 2]" 1
779 1 29 VAL HB 1 29 VAL QG 2.045 . 2.547 1.894 1.890 1.898 . 0 0 "[ . 1 . 2]" 1
780 1 29 VAL HB 1 30 ALA H 3.696 2.057 5.335 4.102 3.586 4.391 . 0 0 "[ . 1 . 2]" 1
781 1 29 VAL HB 1 31 CYS H 4.143 2.083 6.203 4.818 3.500 6.247 0.044 9 0 "[ . 1 . 2]" 1
782 1 29 VAL HB 1 37 LEU QD 2.151 . 2.706 1.779 1.574 1.895 0.022 17 0 "[ . 1 . 2]" 1
783 1 29 VAL HB 1 43 THR H 4.288 2.082 6.494 4.833 4.163 5.495 . 0 0 "[ . 1 . 2]" 1
784 1 29 VAL HB 1 44 VAL H 4.055 2.082 6.028 4.843 4.094 5.819 . 0 0 "[ . 1 . 2]" 1
785 1 29 VAL HB 1 44 VAL QG 2.912 . 3.929 3.075 1.985 3.809 . 0 0 "[ . 1 . 2]" 1
786 1 29 VAL QG 1 30 ALA H 2.482 2.021 3.221 2.659 1.927 3.408 0.187 3 0 "[ . 1 . 2]" 1
787 1 29 VAL QG 1 30 ALA HA 3.199 . 4.427 3.769 3.249 4.099 . 0 0 "[ . 1 . 2]" 1
788 1 29 VAL QG 1 43 THR H 4.043 2.081 6.005 4.967 3.741 5.831 . 0 0 "[ . 1 . 2]" 1
789 1 29 VAL QG 1 43 THR HA 2.876 . 3.869 3.196 2.469 4.228 0.359 5 0 "[ . 1 . 2]" 1
790 1 29 VAL QG 1 44 VAL H 2.912 . 3.929 3.163 2.702 4.304 0.375 3 0 "[ . 1 . 2]" 1
791 1 29 VAL QG 1 55 PRO HA 2.935 . 3.969 3.790 3.328 7.386 3.417 3 1 "[ + . 1 . 2]" 1
792 1 29 VAL QG 1 55 PRO HB3 2.705 . 3.583 2.211 2.106 2.303 . 0 0 "[ . 1 . 2]" 1
793 1 30 ALA H 1 30 ALA MB 2.233 . 2.831 2.396 2.259 2.883 0.052 3 0 "[ . 1 . 2]" 1
794 1 30 ALA HA 1 30 ALA MB 2.288 . 2.916 2.129 2.124 2.135 . 0 0 "[ . 1 . 2]" 1
795 1 30 ALA HA 1 31 CYS H 2.189 . 2.764 2.203 2.121 2.718 . 0 0 "[ . 1 . 2]" 1
796 1 31 CYS H 1 31 CYS HB2 2.465 . 3.194 2.513 2.255 2.789 . 0 0 "[ . 1 . 2]" 1
797 1 31 CYS H 1 31 CYS HB3 2.837 . 3.803 3.597 2.949 3.842 0.039 3 0 "[ . 1 . 2]" 1
798 1 31 CYS H 1 32 HIS H 3.820 2.069 5.571 4.519 4.342 4.649 . 0 0 "[ . 1 . 2]" 1
799 1 31 CYS H 1 32 HIS H 3.588 2.043 5.133 4.384 4.238 4.508 . 0 0 "[ . 1 . 2]" 1
800 1 31 CYS H 1 32 HIS HA 3.429 2.018 4.840 4.184 3.261 4.617 . 0 0 "[ . 1 . 2]" 1
801 1 31 CYS H 1 35 TYR QB 3.598 2.045 5.151 4.821 4.343 4.938 . 0 0 "[ . 1 . 2]" 1
802 1 31 CYS HA 1 31 CYS HB2 2.831 . 3.793 2.997 2.722 3.034 . 0 0 "[ . 1 . 2]" 1
803 1 31 CYS HA 1 31 CYS HB3 2.721 . 3.610 2.532 2.415 2.973 . 0 0 "[ . 1 . 2]" 1
804 1 31 CYS HB2 1 32 HIS H 3.047 . 4.161 3.595 3.169 4.053 . 0 0 "[ . 1 . 2]" 1
805 1 31 CYS HB2 1 32 HIS H 2.999 . 4.078 3.532 3.149 3.933 . 0 0 "[ . 1 . 2]" 1
806 1 31 CYS HB2 1 35 TYR H 3.453 2.022 4.884 4.300 3.751 5.021 0.137 6 0 "[ . 1 . 2]" 1
807 1 31 CYS HB2 1 35 TYR QB 2.630 . 3.460 2.805 2.555 3.093 . 0 0 "[ . 1 . 2]" 1
808 1 31 CYS HB2 1 36 ALA H 3.536 2.036 5.036 4.373 3.840 5.028 . 0 0 "[ . 1 . 2]" 1
809 1 31 CYS HB2 1 36 ALA HA 2.728 . 3.621 3.131 2.657 3.686 0.065 14 0 "[ . 1 . 2]" 1
810 1 31 CYS HB2 1 37 LEU H 3.772 2.064 5.480 5.246 4.881 5.476 . 0 0 "[ . 1 . 2]" 1
811 1 31 CYS HB3 1 32 HIS H 2.801 . 3.742 2.467 2.156 3.150 . 0 0 "[ . 1 . 2]" 1
812 1 31 CYS HB3 1 32 HIS HA 3.051 . 4.168 4.018 3.626 4.262 0.094 19 0 "[ . 1 . 2]" 1
813 1 31 CYS HB3 1 35 TYR H 3.270 . 4.553 4.310 3.430 4.578 0.025 15 0 "[ . 1 . 2]" 1
814 1 31 CYS HB3 1 35 TYR QB 2.519 . 3.280 2.098 1.676 2.425 0.082 6 0 "[ . 1 . 2]" 1
815 1 31 CYS HB3 1 35 TYR QD 3.061 . 4.186 3.878 3.502 4.201 0.015 15 0 "[ . 1 . 2]" 1
816 1 31 CYS HB3 1 36 ALA H 3.534 2.035 5.033 4.678 4.055 5.124 0.091 20 0 "[ . 1 . 2]" 1
817 1 31 CYS HB3 1 37 LEU H 4.321 2.081 6.561 6.396 6.070 6.670 0.109 5 0 "[ . 1 . 2]" 1
818 1 32 HIS H 1 32 HIS HB2 2.604 . 3.418 2.599 2.293 3.659 0.241 6 0 "[ . 1 . 2]" 1
819 1 32 HIS H 1 32 HIS HB3 2.780 . 3.707 3.446 2.255 3.654 . 0 0 "[ . 1 . 2]" 1
820 1 32 HIS H 1 33 PRO HD2 3.720 2.059 5.381 5.064 4.872 5.162 . 0 0 "[ . 1 . 2]" 1
821 1 32 HIS H 1 35 TYR QB 3.440 2.020 4.860 2.984 2.768 3.309 . 0 0 "[ . 1 . 2]" 1
822 1 32 HIS H 1 35 TYR QD 3.357 2.005 4.709 3.332 2.661 4.614 . 0 0 "[ . 1 . 2]" 1
823 1 32 HIS HA 1 32 HIS HB2 2.948 . 3.991 2.908 2.301 3.024 . 0 0 "[ . 1 . 2]" 1
824 1 32 HIS HA 1 32 HIS HB3 2.680 . 3.542 2.550 2.450 2.964 . 0 0 "[ . 1 . 2]" 1
825 1 32 HIS HA 1 33 PRO HG3 2.603 . 3.416 2.802 2.638 3.384 . 0 0 "[ . 1 . 2]" 1
826 1 32 HIS HA 1 33 PRO HD2 2.189 . 2.764 2.763 2.426 2.822 0.058 1 0 "[ . 1 . 2]" 1
827 1 32 HIS HA 1 33 PRO HG3 2.763 . 3.679 2.883 2.694 3.742 0.063 20 0 "[ . 1 . 2]" 1
828 1 32 HIS HA 1 33 PRO HD3 2.180 . 2.750 1.981 1.776 2.267 . 0 0 "[ . 1 . 2]" 1
829 1 32 HIS HB2 1 33 PRO HD2 2.688 . 3.555 3.502 1.887 3.799 0.244 15 0 "[ . 1 . 2]" 1
830 1 32 HIS HB2 1 33 PRO HD3 3.075 . 4.209 4.089 2.847 4.383 0.174 20 0 "[ . 1 . 2]" 1
831 1 32 HIS HB2 1 35 TYR QR 2.800 . 3.741 2.415 1.855 4.123 0.382 13 0 "[ . 1 . 2]" 1
832 1 32 HIS HB3 1 33 PRO HD2 2.381 . 3.061 2.322 1.915 3.884 0.823 11 3 "[ .- 1+ * . 2]" 1
833 1 32 HIS HB3 1 33 PRO HD3 2.706 . 3.585 3.176 2.949 4.424 0.839 11 2 "[ . 1+ - . 2]" 1
834 1 32 HIS HB3 1 35 TYR H 4.025 2.080 5.970 5.085 4.230 6.152 0.182 13 0 "[ . 1 . 2]" 1
835 1 32 HIS HB3 1 35 TYR QD 3.063 . 4.189 3.312 2.158 4.185 . 0 0 "[ . 1 . 2]" 1
836 1 32 HIS HB3 1 35 TYR QR 2.848 . 3.822 3.165 2.111 4.041 0.219 6 0 "[ . 1 . 2]" 1
837 1 33 PRO HA 1 33 PRO HB2 2.472 . 3.205 2.971 2.680 3.010 . 0 0 "[ . 1 . 2]" 1
838 1 33 PRO HA 1 33 PRO HB3 2.256 . 2.867 2.305 2.280 2.344 . 0 0 "[ . 1 . 2]" 1
839 1 33 PRO HA 1 34 GLY H 2.130 . 2.675 2.142 2.112 2.161 . 0 0 "[ . 1 . 2]" 1
840 1 33 PRO HA 1 35 TYR H 2.830 . 3.791 3.472 3.317 3.591 . 0 0 "[ . 1 . 2]" 1
841 1 33 PRO HB2 1 33 PRO HD2 2.518 . 3.279 2.945 2.848 3.910 0.631 20 1 "[ . 1 . +]" 1
842 1 33 PRO HB2 1 33 PRO HD2 2.257 . 2.868 2.615 2.583 2.815 . 0 0 "[ . 1 . 2]" 1
843 1 33 PRO HB2 1 33 PRO HD3 2.972 . 4.032 3.843 3.826 3.951 . 0 0 "[ . 1 . 2]" 1
844 1 33 PRO HB2 1 34 GLY H 3.218 . 4.461 4.161 3.911 4.276 . 0 0 "[ . 1 . 2]" 1
845 1 33 PRO HB2 1 35 TYR H 3.861 2.072 5.650 4.787 4.344 5.324 . 0 0 "[ . 1 . 2]" 1
846 1 33 PRO HB3 1 33 PRO HD2 2.787 . 3.719 3.862 3.782 3.930 0.211 13 0 "[ . 1 . 2]" 1
847 1 33 PRO HB3 1 33 PRO HD3 3.068 . 4.198 4.002 3.052 4.069 . 0 0 "[ . 1 . 2]" 1
848 1 33 PRO HB3 1 33 PRO QG 2.054 . 2.560 2.084 2.077 2.099 . 0 0 "[ . 1 . 2]" 1
849 1 33 PRO HB3 1 34 GLY H 2.877 . 3.870 3.873 3.652 4.261 0.391 20 0 "[ . 1 . 2]" 1
850 1 33 PRO HD2 1 33 PRO QG 2.178 . 2.747 2.237 2.128 2.265 . 0 0 "[ . 1 . 2]" 1
851 1 33 PRO HD3 1 33 PRO HG3 2.284 . 2.910 2.316 2.281 2.328 . 0 0 "[ . 1 . 2]" 1
852 1 33 PRO HD3 1 34 GLY H 4.291 2.081 6.501 5.334 5.100 5.445 . 0 0 "[ . 1 . 2]" 1
853 1 33 PRO HG2 1 35 TYR H 4.393 2.078 6.708 6.623 5.585 6.782 0.074 14 0 "[ . 1 . 2]" 1
854 1 33 PRO HG3 1 34 GLY H 3.512 2.032 4.992 5.046 4.804 5.746 0.754 20 1 "[ . 1 . +]" 1
855 1 34 GLY H 1 34 GLY HA2 2.367 . 3.039 2.955 2.937 2.963 . 0 0 "[ . 1 . 2]" 1
856 1 34 GLY H 1 34 GLY HA3 2.330 . 2.981 2.456 2.381 2.516 . 0 0 "[ . 1 . 2]" 1
857 1 34 GLY H 1 35 TYR H 2.400 . 3.091 2.239 2.103 2.614 . 0 0 "[ . 1 . 2]" 1
858 1 34 GLY H 1 35 TYR QB 3.759 2.064 5.454 4.559 4.357 4.934 . 0 0 "[ . 1 . 2]" 1
859 1 34 GLY H 1 35 TYR QR 3.533 2.035 5.031 4.608 4.259 4.927 . 0 0 "[ . 1 . 2]" 1
860 1 34 GLY H 1 60 VAL QG 3.774 2.065 5.483 3.885 3.311 4.536 . 0 0 "[ . 1 . 2]" 1
861 1 34 GLY HA2 1 35 TYR H 2.774 . 3.697 3.157 3.064 3.299 . 0 0 "[ . 1 . 2]" 1
862 1 34 GLY HA2 1 35 TYR QR 3.043 . 4.154 3.949 3.218 4.216 0.062 9 0 "[ . 1 . 2]" 1
863 1 34 GLY HA2 1 60 VAL H 3.941 2.077 5.805 4.496 4.234 4.960 . 0 0 "[ . 1 . 2]" 1
864 1 34 GLY HA3 1 35 TYR H 2.816 . 3.767 3.362 3.210 3.444 . 0 0 "[ . 1 . 2]" 1
865 1 34 GLY HA3 1 60 VAL QG 2.756 . 3.668 2.924 2.223 3.527 . 0 0 "[ . 1 . 2]" 1
866 1 35 TYR H 1 35 TYR HA 2.833 . 3.796 2.942 2.934 2.947 . 0 0 "[ . 1 . 2]" 1
867 1 35 TYR H 1 35 TYR QB 2.563 . 3.351 2.531 2.409 2.681 . 0 0 "[ . 1 . 2]" 1
868 1 35 TYR H 1 35 TYR QD 2.717 . 3.603 3.048 2.731 3.468 . 0 0 "[ . 1 . 2]" 1
869 1 35 TYR H 1 36 ALA H 3.423 2.017 4.829 4.446 4.364 4.519 . 0 0 "[ . 1 . 2]" 1
870 1 35 TYR H 1 36 ALA MB 3.807 2.068 5.546 4.545 4.224 4.823 . 0 0 "[ . 1 . 2]" 1
871 1 35 TYR H 1 57 CYS HA 4.329 2.080 6.578 6.576 6.250 6.714 0.136 5 0 "[ . 1 . 2]" 1
872 1 35 TYR H 1 60 VAL H 3.867 2.072 5.662 4.662 4.397 5.346 . 0 0 "[ . 1 . 2]" 1
873 1 35 TYR H 1 60 VAL QG 3.187 . 4.406 3.927 3.234 4.539 0.133 9 0 "[ . 1 . 2]" 1
874 1 35 TYR HA 1 35 TYR QB 2.808 . 3.467 2.373 2.307 2.444 . 0 0 "[ . 1 . 2]" 1
875 1 35 TYR HA 1 35 TYR QD 3.040 . 4.149 2.680 2.322 3.089 . 0 0 "[ . 1 . 2]" 1
876 1 35 TYR HA 1 36 ALA H 2.190 . 2.765 2.217 2.130 2.333 . 0 0 "[ . 1 . 2]" 1
877 1 35 TYR HA 1 59 ARG H 3.817 2.069 5.565 4.521 4.162 4.739 . 0 0 "[ . 1 . 2]" 1
878 1 35 TYR HA 1 59 ARG HA 2.314 . 2.957 2.485 2.110 3.788 0.831 9 1 "[ . +1 . 2]" 1
879 1 35 TYR HA 1 60 VAL H 2.494 . 3.241 2.772 2.450 3.184 . 0 0 "[ . 1 . 2]" 1
880 1 35 TYR HA 1 60 VAL QG 3.093 . 4.241 3.218 2.628 3.814 . 0 0 "[ . 1 . 2]" 1
881 1 35 TYR HA 1 61 LYS H 4.026 2.081 5.971 4.829 3.647 5.690 . 0 0 "[ . 1 . 2]" 1
882 1 35 TYR QB 1 35 TYR QD 2.401 . 3.093 2.141 2.126 2.159 . 0 0 "[ . 1 . 2]" 1
883 1 35 TYR QB 1 36 ALA H 2.959 . 3.524 2.801 2.247 3.076 . 0 0 "[ . 1 . 2]" 1
884 1 35 TYR QB 1 37 LEU H 4.266 2.082 6.450 5.249 4.800 5.452 . 0 0 "[ . 1 . 2]" 1
885 1 35 TYR QB 1 57 CYS QB 2.692 . 3.561 1.939 1.684 2.308 0.139 8 0 "[ . 1 . 2]" 1
886 1 35 TYR QB 1 58 ILE H 4.050 2.082 5.149 4.074 3.697 4.398 . 0 0 "[ . 1 . 2]" 1
887 1 35 TYR QB 1 59 ARG H 4.194 2.084 6.304 5.100 4.062 5.453 . 0 0 "[ . 1 . 2]" 1
888 1 35 TYR QB 1 59 ARG HA 3.210 . 4.446 4.038 3.792 4.761 0.315 9 0 "[ . 1 . 2]" 1
889 1 35 TYR QB 1 60 VAL H 4.054 2.082 5.277 4.798 4.526 4.959 . 0 0 "[ . 1 . 2]" 1
890 1 35 TYR QR 1 57 CYS QB 2.999 . 4.078 3.418 2.509 4.058 . 0 0 "[ . 1 . 2]" 1
891 1 35 TYR QR 1 58 ILE H 3.680 2.055 5.305 4.385 3.744 4.855 . 0 0 "[ . 1 . 2]" 1
892 1 35 TYR QR 1 59 ARG H 2.698 . 3.571 3.104 2.236 3.516 . 0 0 "[ . 1 . 2]" 1
893 1 35 TYR QR 1 59 ARG HA 2.577 . 3.374 2.622 2.074 3.427 0.053 9 0 "[ . 1 . 2]" 1
894 1 35 TYR QR 1 59 ARG HB2 2.848 . 3.821 2.379 1.787 2.869 0.088 9 0 "[ . 1 . 2]" 1
895 1 35 TYR QR 1 59 ARG QD 2.987 . 4.058 3.522 2.669 4.103 0.045 4 0 "[ . 1 . 2]" 1
896 1 35 TYR QR 1 59 ARG HG2 3.097 . 4.248 4.350 3.684 4.991 0.743 8 2 "[ . + 1- . 2]" 1
897 1 35 TYR QD 1 36 ALA H 3.051 . 4.168 3.793 3.437 4.127 . 0 0 "[ . 1 . 2]" 1
898 1 35 TYR QD 1 58 ILE HA 2.796 . 3.734 3.296 2.743 3.771 0.037 2 0 "[ . 1 . 2]" 1
899 1 35 TYR QD 1 59 ARG H 2.985 . 4.054 3.295 2.306 4.023 . 0 0 "[ . 1 . 2]" 1
900 1 35 TYR QD 1 59 ARG HA 2.704 . 3.581 2.689 2.093 3.498 . 0 0 "[ . 1 . 2]" 1
901 1 35 TYR QD 1 59 ARG HB2 2.965 . 4.020 3.189 1.789 3.839 0.121 9 0 "[ . 1 . 2]" 1
902 1 35 TYR QE 1 59 ARG HA 2.866 . 3.852 3.719 3.298 4.906 1.054 9 1 "[ . +1 . 2]" 1
903 1 35 TYR QE 1 59 ARG HB2 2.657 . 3.504 2.566 1.893 4.091 0.587 9 1 "[ . +1 . 2]" 1
904 1 36 ALA H 1 36 ALA HA 2.729 . 3.623 2.890 2.809 2.927 . 0 0 "[ . 1 . 2]" 1
905 1 36 ALA H 1 37 LEU H 3.424 2.017 4.831 4.348 4.268 4.395 . 0 0 "[ . 1 . 2]" 1
906 1 36 ALA H 1 38 PRO QD 4.314 2.081 6.547 5.593 5.234 5.769 . 0 0 "[ . 1 . 2]" 1
907 1 36 ALA H 1 40 ALA HA 3.986 2.079 5.893 5.098 4.376 5.605 . 0 0 "[ . 1 . 2]" 1
908 1 36 ALA H 1 57 CYS HA 3.062 . 4.187 3.295 2.970 3.517 . 0 0 "[ . 1 . 2]" 1
909 1 36 ALA H 1 57 CYS QB 3.739 2.061 5.417 3.772 2.967 4.112 . 0 0 "[ . 1 . 2]" 1
910 1 36 ALA H 1 58 ILE HB 3.497 2.029 4.965 4.508 3.871 5.247 0.282 9 0 "[ . 1 . 2]" 1
911 1 36 ALA H 1 58 ILE HG13 3.605 2.045 5.165 4.209 3.007 4.970 . 0 0 "[ . 1 . 2]" 1
912 1 36 ALA H 1 59 ARG H 3.924 2.076 5.772 4.903 4.357 5.060 . 0 0 "[ . 1 . 2]" 1
913 1 36 ALA H 1 59 ARG HA 2.929 . 3.958 3.878 3.619 4.006 0.048 20 0 "[ . 1 . 2]" 1
914 1 36 ALA H 1 59 ARG HB3 4.331 2.080 6.582 6.185 3.433 6.528 . 0 0 "[ . 1 . 2]" 1
915 1 36 ALA H 1 60 VAL H 3.193 . 4.416 3.914 3.524 4.663 0.247 9 0 "[ . 1 . 2]" 1
916 1 36 ALA HA 1 36 ALA MB 2.119 . 2.658 2.133 2.129 2.140 . 0 0 "[ . 1 . 2]" 1
917 1 36 ALA HA 1 37 LEU H 2.276 . 2.897 2.494 2.341 2.789 . 0 0 "[ . 1 . 2]" 1
918 1 36 ALA HA 1 58 ILE H 3.998 2.080 5.916 4.719 4.552 5.317 . 0 0 "[ . 1 . 2]" 1
919 1 36 ALA MB 1 37 LEU H 2.088 . 2.611 2.243 1.848 2.523 . 0 0 "[ . 1 . 2]" 1
920 1 36 ALA MB 1 41 GLN H 3.151 . 4.343 3.438 2.975 3.557 . 0 0 "[ . 1 . 2]" 1
921 1 36 ALA MB 1 42 THR H 4.325 2.080 6.570 5.197 4.672 5.610 . 0 0 "[ . 1 . 2]" 1
922 1 36 ALA MB 1 60 VAL QG 2.957 . 4.007 2.508 1.965 4.367 0.360 9 0 "[ . 1 . 2]" 1
923 1 37 LEU H 1 37 LEU HA 2.835 . 3.799 2.878 2.802 2.941 . 0 0 "[ . 1 . 2]" 1
924 1 37 LEU H 1 37 LEU HB2 2.390 . 3.075 2.358 2.299 2.491 . 0 0 "[ . 1 . 2]" 1
925 1 37 LEU H 1 37 LEU HB3 2.698 . 3.572 3.571 3.525 3.605 0.033 13 0 "[ . 1 . 2]" 1
926 1 37 LEU H 1 37 LEU HG 2.593 . 3.400 2.695 2.326 3.795 0.395 9 0 "[ . 1 . 2]" 1
927 1 37 LEU H 1 38 PRO QD 3.790 2.066 5.335 4.357 4.302 4.377 . 0 0 "[ . 1 . 2]" 1
928 1 37 LEU H 1 38 PRO HG2 4.268 2.082 6.454 5.370 4.818 5.793 . 0 0 "[ . 1 . 2]" 1
929 1 37 LEU H 1 40 ALA HA 3.703 2.057 5.349 4.597 3.946 5.304 . 0 0 "[ . 1 . 2]" 1
930 1 37 LEU H 1 41 GLN H 4.094 2.083 6.105 4.026 3.354 4.381 . 0 0 "[ . 1 . 2]" 1
931 1 37 LEU HA 1 37 LEU HB2 2.816 . 3.768 3.009 2.999 3.015 . 0 0 "[ . 1 . 2]" 1
932 1 37 LEU HA 1 37 LEU HB3 2.794 . 3.731 2.523 2.481 2.587 . 0 0 "[ . 1 . 2]" 1
933 1 37 LEU HA 1 37 LEU QD 2.286 . 2.913 1.985 1.885 2.085 . 0 0 "[ . 1 . 2]" 1
934 1 37 LEU HA 1 37 LEU HG 2.780 . 3.708 3.011 2.827 3.697 . 0 0 "[ . 1 . 2]" 1
935 1 37 LEU HA 1 38 PRO QD 2.335 . 2.949 1.934 1.835 2.025 . 0 0 "[ . 1 . 2]" 1
936 1 37 LEU HA 1 38 PRO HG2 3.189 . 4.409 4.501 4.413 4.559 0.150 9 0 "[ . 1 . 2]" 1
937 1 37 LEU HA 1 38 PRO HG3 3.323 . 4.648 4.152 4.003 4.282 . 0 0 "[ . 1 . 2]" 1
938 1 37 LEU HA 1 56 ARG H 3.904 2.075 5.733 3.642 3.186 4.374 . 0 0 "[ . 1 . 2]" 1
939 1 37 LEU HA 1 58 ILE H 3.501 2.030 4.972 3.437 3.104 3.858 . 0 0 "[ . 1 . 2]" 1
940 1 37 LEU HB2 1 37 LEU QD 2.451 . 3.172 2.249 2.198 2.304 . 0 0 "[ . 1 . 2]" 1
941 1 37 LEU HB2 1 38 PRO QD 2.763 . 3.679 2.752 2.719 2.797 . 0 0 "[ . 1 . 2]" 1
942 1 37 LEU HB2 1 38 PRO QD 3.206 . 4.177 3.628 3.492 3.821 . 0 0 "[ . 1 . 2]" 1
943 1 37 LEU HB2 1 41 GLN H 3.162 . 4.362 3.043 2.614 3.415 . 0 0 "[ . 1 . 2]" 1
944 1 37 LEU HB2 1 41 GLN HB3 3.214 . 4.453 3.559 3.021 4.142 . 0 0 "[ . 1 . 2]" 1
945 1 37 LEU HB3 1 37 LEU QD 2.414 . 2.798 2.129 2.108 2.382 . 0 0 "[ . 1 . 2]" 1
946 1 37 LEU HB3 1 38 PRO QD 3.011 . 3.185 2.194 1.989 2.527 . 0 0 "[ . 1 . 2]" 1
947 1 37 LEU HB3 1 39 LYS H 3.955 2.078 5.832 5.967 5.920 6.005 0.173 11 0 "[ . 1 . 2]" 1
948 1 37 LEU HB3 1 41 GLN H 3.518 2.033 5.003 3.791 3.461 4.153 . 0 0 "[ . 1 . 2]" 1
949 1 37 LEU HB3 1 41 GLN HB2 2.881 . 3.877 2.767 2.117 3.298 . 0 0 "[ . 1 . 2]" 1
950 1 37 LEU HB3 1 41 GLN HB3 3.162 . 4.362 4.119 3.410 4.408 0.046 18 0 "[ . 1 . 2]" 1
951 1 37 LEU HB3 1 41 GLN HE21 4.135 2.084 6.186 4.051 2.376 6.262 0.076 19 0 "[ . 1 . 2]" 1
952 1 37 LEU HB3 1 42 THR H 4.461 2.073 6.849 5.363 5.081 5.569 . 0 0 "[ . 1 . 2]" 1
953 1 37 LEU HB3 1 43 THR H 4.280 2.081 6.479 5.336 4.808 5.909 . 0 0 "[ . 1 . 2]" 1
954 1 37 LEU HB3 1 44 VAL H 4.451 2.074 6.828 6.398 6.076 6.831 0.003 3 0 "[ . 1 . 2]" 1
955 1 37 LEU HB3 1 56 ARG H 3.093 . 4.241 3.728 3.467 4.012 . 0 0 "[ . 1 . 2]" 1
956 1 37 LEU QD 1 37 LEU HG 2.160 . 2.720 1.892 1.882 1.896 . 0 0 "[ . 1 . 2]" 1
957 1 37 LEU QD 1 38 PRO QD 2.645 . 3.458 2.352 2.142 2.599 . 0 0 "[ . 1 . 2]" 1
958 1 37 LEU QD 1 41 GLN HB2 2.875 . 3.867 3.092 2.384 3.724 . 0 0 "[ . 1 . 2]" 1
959 1 37 LEU QD 1 41 GLN HB3 3.042 . 4.152 3.200 2.385 3.889 . 0 0 "[ . 1 . 2]" 1
960 1 37 LEU QD 1 41 GLN HE21 4.261 2.082 6.440 3.920 2.269 5.614 . 0 0 "[ . 1 . 2]" 1
961 1 37 LEU QD 1 42 THR H 3.562 2.039 5.085 3.582 3.137 3.889 . 0 0 "[ . 1 . 2]" 1
962 1 37 LEU QD 1 42 THR HA 2.671 . 3.527 2.547 1.789 3.264 0.026 9 0 "[ . 1 . 2]" 1
963 1 37 LEU QD 1 43 THR H 3.136 . 4.316 2.929 2.207 3.828 . 0 0 "[ . 1 . 2]" 1
964 1 37 LEU QD 1 44 VAL H 3.475 2.026 4.924 3.641 3.157 4.414 . 0 0 "[ . 1 . 2]" 1
965 1 37 LEU QD 1 54 THR H 4.011 2.080 5.942 4.934 4.473 5.496 . 0 0 "[ . 1 . 2]" 1
966 1 37 LEU QD 1 55 PRO HA 2.314 . 2.957 1.979 1.676 2.208 . 0 0 "[ . 1 . 2]" 1
967 1 37 LEU QD 1 56 ARG H 2.396 . 3.085 1.911 1.783 2.185 . 0 0 "[ . 1 . 2]" 1
968 1 37 LEU QD 1 58 ILE H 3.780 2.066 5.494 4.122 3.710 4.547 . 0 0 "[ . 1 . 2]" 1
969 1 37 LEU HG 1 56 ARG H 3.176 . 4.386 4.415 4.243 4.467 0.081 2 0 "[ . 1 . 2]" 1
970 1 38 PRO HA 1 38 PRO HB2 2.534 . 3.305 2.977 2.952 2.990 . 0 0 "[ . 1 . 2]" 1
971 1 38 PRO HA 1 38 PRO HB3 2.309 . 2.949 2.301 2.281 2.316 . 0 0 "[ . 1 . 2]" 1
972 1 38 PRO HA 1 38 PRO QD 2.960 . 4.011 3.367 3.292 3.422 . 0 0 "[ . 1 . 2]" 1
973 1 38 PRO HA 1 38 PRO HG2 2.895 . 3.901 3.914 3.877 3.973 0.072 5 0 "[ . 1 . 2]" 1
974 1 38 PRO HA 1 38 PRO HG3 2.765 . 3.683 2.971 2.894 3.095 . 0 0 "[ . 1 . 2]" 1
975 1 38 PRO HA 1 39 LYS H 2.286 . 2.913 2.190 2.114 2.291 . 0 0 "[ . 1 . 2]" 1
976 1 38 PRO HA 1 39 LYS HA 3.233 . 4.487 4.392 4.349 4.451 . 0 0 "[ . 1 . 2]" 1
977 1 38 PRO HA 1 40 ALA H 3.125 . 4.297 3.258 3.090 3.484 . 0 0 "[ . 1 . 2]" 1
978 1 38 PRO HA 1 58 ILE MD 2.531 . 3.300 2.571 1.909 3.329 0.029 8 0 "[ . 1 . 2]" 1
979 1 38 PRO HB2 1 38 PRO QD 2.879 . 3.873 2.853 2.808 2.906 . 0 0 "[ . 1 . 2]" 1
980 1 38 PRO HB2 1 38 PRO HG2 2.235 . 2.834 2.323 2.310 2.337 . 0 0 "[ . 1 . 2]" 1
981 1 38 PRO HB2 1 39 LYS H 2.829 . 3.789 3.602 3.271 3.807 0.018 16 0 "[ . 1 . 2]" 1
982 1 38 PRO HB2 1 39 LYS QG 2.325 . 2.974 2.239 2.081 2.315 . 0 0 "[ . 1 . 2]" 1
983 1 38 PRO HB2 1 41 GLN HE21 3.290 . 4.589 3.508 1.702 4.691 0.289 8 0 "[ . 1 . 2]" 1
984 1 38 PRO HB2 1 41 GLN HE22 3.371 2.007 4.735 3.814 2.854 4.552 . 0 0 "[ . 1 . 2]" 1
985 1 38 PRO HB3 1 38 PRO QD 3.237 . 4.066 3.526 3.518 3.531 . 0 0 "[ . 1 . 2]" 1
986 1 38 PRO HB3 1 38 PRO HG2 2.018 . 2.507 2.648 2.627 2.672 0.165 5 0 "[ . 1 . 2]" 1
987 1 38 PRO HB3 1 38 PRO HG3 2.351 . 3.015 2.317 2.306 2.327 . 0 0 "[ . 1 . 2]" 1
988 1 38 PRO HB3 1 39 LYS H 2.896 . 3.903 3.185 3.017 3.417 . 0 0 "[ . 1 . 2]" 1
989 1 38 PRO HB3 1 39 LYS QG 2.818 . 3.771 3.539 3.282 3.785 0.014 3 0 "[ . 1 . 2]" 1
990 1 38 PRO HB3 1 58 ILE MD 2.980 . 4.046 3.212 2.707 4.110 0.064 3 0 "[ . 1 . 2]" 1
991 1 38 PRO QD 1 38 PRO HG2 2.653 . 3.129 2.177 2.162 2.190 . 0 0 "[ . 1 . 2]" 1
992 1 38 PRO QD 1 38 PRO HG3 2.434 . 3.145 2.231 2.213 2.245 . 0 0 "[ . 1 . 2]" 1
993 1 38 PRO QD 1 39 LYS H 4.045 2.081 6.009 4.954 4.904 4.978 . 0 0 "[ . 1 . 2]" 1
994 1 38 PRO QD 1 56 ARG H 3.904 2.075 5.733 3.091 2.490 4.113 . 0 0 "[ . 1 . 2]" 1
995 1 38 PRO QD 1 56 ARG H 2.911 . 3.928 2.618 2.357 2.881 . 0 0 "[ . 1 . 2]" 1
996 1 38 PRO QD 1 58 ILE H 3.812 2.068 5.556 3.619 3.262 4.187 . 0 0 "[ . 1 . 2]" 1
997 1 38 PRO QD 1 58 ILE H 4.053 2.082 6.024 3.553 3.234 4.002 . 0 0 "[ . 1 . 2]" 1
998 1 38 PRO QD 1 58 ILE HG13 3.095 . 4.244 3.445 2.493 4.604 0.360 20 0 "[ . 1 . 2]" 1
999 1 38 PRO HG2 1 39 LYS H 3.772 2.064 5.480 5.406 5.235 5.550 0.070 16 0 "[ . 1 . 2]" 1
1000 1 38 PRO HG2 1 39 LYS QG 2.968 . 4.025 3.574 2.592 4.047 0.022 16 0 "[ . 1 . 2]" 1
1001 1 38 PRO HG2 1 40 ALA H 4.022 2.081 5.963 5.719 5.606 5.819 . 0 0 "[ . 1 . 2]" 1
1002 1 38 PRO HG3 1 56 ARG QG 2.963 . 4.017 3.269 2.164 3.953 . 0 0 "[ . 1 . 2]" 1
1003 1 38 PRO HG3 1 58 ILE MD 2.150 . 2.705 2.012 1.777 2.305 . 0 0 "[ . 1 . 2]" 1
1004 1 38 PRO HG3 1 58 ILE HG12 2.403 . 3.096 2.806 2.054 2.983 . 0 0 "[ . 1 . 2]" 1
1005 1 38 PRO HG3 1 58 ILE HG13 2.613 . 3.432 2.440 2.340 2.750 . 0 0 "[ . 1 . 2]" 1
1006 1 38 PRO HG3 1 58 ILE MD 2.782 . 3.711 2.233 1.826 3.147 0.027 4 0 "[ . 1 . 2]" 1
1007 1 38 PRO HG3 1 58 ILE HG13 3.243 . 4.505 3.756 2.851 4.929 0.424 10 0 "[ . 1 . 2]" 1
1008 1 39 LYS H 1 39 LYS HA 2.262 . 2.876 2.268 2.256 2.281 . 0 0 "[ . 1 . 2]" 1
1009 1 39 LYS H 1 39 LYS HB2 2.999 . 4.078 3.629 3.521 3.717 . 0 0 "[ . 1 . 2]" 1
1010 1 39 LYS H 1 39 LYS HB3 3.135 . 4.314 4.105 4.058 4.147 . 0 0 "[ . 1 . 2]" 1
1011 1 39 LYS H 1 39 LYS QD 3.734 2.061 5.407 4.499 2.824 4.901 . 0 0 "[ . 1 . 2]" 1
1012 1 39 LYS H 1 39 LYS QG 2.761 . 3.676 2.924 2.812 3.060 . 0 0 "[ . 1 . 2]" 1
1013 1 39 LYS H 1 40 ALA H 2.604 . 3.418 2.501 2.333 2.608 . 0 0 "[ . 1 . 2]" 1
1014 1 39 LYS H 1 41 GLN H 4.015 2.081 5.949 4.460 4.302 4.708 . 0 0 "[ . 1 . 2]" 1
1015 1 39 LYS H 1 58 ILE MD 3.861 2.072 5.650 4.201 3.471 5.016 . 0 0 "[ . 1 . 2]" 1
1016 1 39 LYS HA 1 39 LYS HB2 2.503 . 3.255 3.023 3.015 3.029 . 0 0 "[ . 1 . 2]" 1
1017 1 39 LYS HA 1 39 LYS HB3 2.317 . 2.961 2.468 2.426 2.519 . 0 0 "[ . 1 . 2]" 1
1018 1 39 LYS HA 1 39 LYS QG 2.363 . 3.033 2.532 2.325 3.002 . 0 0 "[ . 1 . 2]" 1
1019 1 39 LYS HA 1 40 ALA H 2.667 . 3.520 2.988 2.886 3.120 . 0 0 "[ . 1 . 2]" 1
1020 1 39 LYS HA 1 40 ALA H 2.040 . 2.539 2.199 2.185 2.210 . 0 0 "[ . 1 . 2]" 1
1021 1 39 LYS HA 1 42 THR H 4.505 2.069 6.941 6.062 5.934 6.145 . 0 0 "[ . 1 . 2]" 1
1022 1 39 LYS HA 1 41 GLN HE21 4.570 2.064 7.076 5.907 4.530 7.179 0.103 7 0 "[ . 1 . 2]" 1
1023 1 39 LYS HB2 1 39 LYS QG 2.457 . 3.181 2.314 2.164 2.394 . 0 0 "[ . 1 . 2]" 1
1024 1 39 LYS HB2 1 40 ALA H 3.284 . 4.578 3.986 3.779 4.119 . 0 0 "[ . 1 . 2]" 1
1025 1 39 LYS HB2 1 41 GLN QG 2.723 . 3.613 2.239 1.825 2.747 0.008 14 0 "[ . 1 . 2]" 1
1026 1 39 LYS HB3 1 39 LYS QD 2.627 . 3.455 2.566 2.299 3.026 . 0 0 "[ . 1 . 2]" 1
1027 1 39 LYS HB3 1 39 LYS QG 2.414 . 3.113 2.343 2.289 2.449 . 0 0 "[ . 1 . 2]" 1
1028 1 39 LYS HB3 1 40 ALA H 3.202 . 4.432 4.430 4.389 4.460 0.028 17 0 "[ . 1 . 2]" 1
1029 1 39 LYS HB3 1 41 GLN QG 2.731 . 3.626 3.074 2.661 3.476 . 0 0 "[ . 1 . 2]" 1
1030 1 39 LYS QD 1 39 LYS QE 2.181 . 2.752 2.048 1.999 2.091 . 0 0 "[ . 1 . 2]" 1
1031 1 39 LYS QD 1 39 LYS QG 2.164 . 2.726 2.057 1.997 2.092 . 0 0 "[ . 1 . 2]" 1
1032 1 39 LYS QD 1 41 GLN HE22 4.310 2.081 6.539 4.051 2.500 6.574 0.035 5 0 "[ . 1 . 2]" 1
1033 1 39 LYS QE 1 39 LYS QG 2.626 . 3.453 2.375 2.123 2.825 . 0 0 "[ . 1 . 2]" 1
1034 1 39 LYS QG 1 41 GLN HE22 3.947 2.077 5.817 4.824 4.074 5.815 . 0 0 "[ . 1 . 2]" 1
1035 1 40 ALA H 1 40 ALA HA 2.089 . 2.612 2.264 2.257 2.269 . 0 0 "[ . 1 . 2]" 1
1036 1 40 ALA H 1 41 GLN H 2.533 . 3.303 2.730 2.610 2.868 . 0 0 "[ . 1 . 2]" 1
1037 1 40 ALA H 1 41 GLN QG 3.557 2.039 5.075 4.116 3.806 4.319 . 0 0 "[ . 1 . 2]" 1
1038 1 40 ALA H 1 58 ILE MD 4.260 2.082 6.438 4.353 2.940 5.171 . 0 0 "[ . 1 . 2]" 1
1039 1 40 ALA HA 1 40 ALA MB 1.993 . 2.470 2.127 2.124 2.131 . 0 0 "[ . 1 . 2]" 1
1040 1 40 ALA HA 1 41 GLN H 2.548 . 3.327 2.794 2.607 2.965 . 0 0 "[ . 1 . 2]" 1
1041 1 41 GLN H 1 41 GLN HA 2.893 . 3.897 2.913 2.835 2.942 . 0 0 "[ . 1 . 2]" 1
1042 1 41 GLN H 1 41 GLN HB2 2.428 . 3.135 2.435 2.334 2.534 . 0 0 "[ . 1 . 2]" 1
1043 1 41 GLN H 1 41 GLN HB3 2.714 . 3.598 3.631 3.580 3.703 0.105 8 0 "[ . 1 . 2]" 1
1044 1 41 GLN H 1 41 GLN QG 2.510 . 3.266 2.638 2.327 2.944 . 0 0 "[ . 1 . 2]" 1
1045 1 41 GLN H 1 42 THR H 3.532 2.035 5.029 4.549 4.473 4.633 . 0 0 "[ . 1 . 2]" 1
1046 1 41 GLN HA 1 41 GLN HB2 2.554 . 3.337 3.020 3.014 3.026 . 0 0 "[ . 1 . 2]" 1
1047 1 41 GLN HA 1 41 GLN HB3 2.493 . 3.239 2.506 2.461 2.560 . 0 0 "[ . 1 . 2]" 1
1048 1 41 GLN HA 1 41 GLN HE21 3.827 2.069 5.585 4.528 4.174 5.038 . 0 0 "[ . 1 . 2]" 1
1049 1 41 GLN HA 1 41 GLN HE22 4.144 2.083 6.205 5.774 5.590 5.999 . 0 0 "[ . 1 . 2]" 1
1050 1 41 GLN HA 1 41 GLN QG 2.511 . 3.268 2.415 2.351 2.472 . 0 0 "[ . 1 . 2]" 1
1051 1 41 GLN HA 1 42 THR H 2.219 . 2.810 2.351 2.277 2.453 . 0 0 "[ . 1 . 2]" 1
1052 1 41 GLN HA 1 43 THR H 2.896 . 3.903 3.793 3.616 3.931 0.028 12 0 "[ . 1 . 2]" 1
1053 1 41 GLN HB2 1 41 GLN QG 2.261 . 2.875 2.354 2.293 2.415 . 0 0 "[ . 1 . 2]" 1
1054 1 41 GLN HB2 1 42 THR H 2.922 . 3.947 3.741 3.520 3.926 . 0 0 "[ . 1 . 2]" 1
1055 1 41 GLN HB2 1 43 THR H 3.159 . 4.356 3.903 3.506 4.398 0.042 7 0 "[ . 1 . 2]" 1
1056 1 41 GLN HB3 1 41 GLN QG 2.233 . 2.832 2.326 2.262 2.386 . 0 0 "[ . 1 . 2]" 1
1057 1 41 GLN HB3 1 42 THR H 2.761 . 3.676 2.538 2.362 2.738 . 0 0 "[ . 1 . 2]" 1
1058 1 41 GLN HB3 1 43 THR H 2.870 . 3.858 2.507 2.179 2.940 . 0 0 "[ . 1 . 2]" 1
1059 1 41 GLN HE21 1 41 GLN QG 2.621 . 3.437 2.616 2.175 2.823 . 0 0 "[ . 1 . 2]" 1
1060 1 41 GLN HE21 1 53 PRO HA 4.380 2.078 6.682 5.757 4.957 6.666 . 0 0 "[ . 1 . 2]" 1
1061 1 41 GLN HE21 1 53 PRO HB3 3.513 2.032 4.994 3.928 3.336 4.553 . 0 0 "[ . 1 . 2]" 1
1062 1 41 GLN HE21 1 53 PRO HD3 4.054 2.082 6.026 5.794 4.999 6.651 0.625 16 1 "[ . 1 .+ 2]" 1
1063 1 41 GLN HE22 1 41 GLN QG 3.041 . 4.103 3.416 3.216 3.492 . 0 0 "[ . 1 . 2]" 1
1064 1 41 GLN HE22 1 53 PRO HB3 3.903 2.075 5.731 2.584 2.017 3.286 0.058 8 0 "[ . 1 . 2]" 1
1065 1 41 GLN HE22 1 53 PRO HD2 4.311 2.081 6.541 5.349 4.707 6.020 . 0 0 "[ . 1 . 2]" 1
1066 1 41 GLN HE22 1 53 PRO HD3 3.845 2.071 5.619 4.580 3.749 5.500 . 0 0 "[ . 1 . 2]" 1
1067 1 41 GLN HE22 1 53 PRO HG3 4.183 2.083 6.283 2.919 2.073 4.180 0.010 18 0 "[ . 1 . 2]" 1
1068 1 41 GLN QG 1 42 THR H 3.183 . 4.360 3.803 3.586 3.934 . 0 0 "[ . 1 . 2]" 1
1069 1 42 THR H 1 42 THR HA 2.769 . 3.689 2.944 2.928 2.954 . 0 0 "[ . 1 . 2]" 1
1070 1 42 THR H 1 42 THR MG 2.698 . 3.571 2.938 2.134 3.391 . 0 0 "[ . 1 . 2]" 1
1071 1 42 THR H 1 43 THR H 2.116 . 2.653 1.865 1.722 2.138 . 0 0 "[ . 1 . 2]" 1
1072 1 42 THR H 1 43 THR HA 3.768 2.065 5.471 4.560 4.492 4.715 . 0 0 "[ . 1 . 2]" 1
1073 1 42 THR H 1 43 THR HB 3.529 2.035 5.023 5.002 4.544 5.133 0.110 7 0 "[ . 1 . 2]" 1
1074 1 42 THR HA 1 42 THR MG 3.231 . 4.483 2.391 2.225 3.221 . 0 0 "[ . 1 . 2]" 1
1075 1 42 THR HA 1 43 THR H 2.860 . 3.842 3.306 3.013 3.464 . 0 0 "[ . 1 . 2]" 1
1076 1 42 THR HB 1 42 THR MG 2.020 . 2.510 2.134 2.128 2.137 . 0 0 "[ . 1 . 2]" 1
1077 1 42 THR HB 1 43 THR H 3.227 . 4.476 4.136 3.902 4.336 . 0 0 "[ . 1 . 2]" 1
1078 1 43 THR H 1 43 THR HA 2.768 . 3.687 2.918 2.851 2.936 . 0 0 "[ . 1 . 2]" 1
1079 1 43 THR H 1 43 THR HB 2.524 . 3.288 3.450 3.305 3.623 0.335 5 0 "[ . 1 . 2]" 1
1080 1 43 THR H 1 44 VAL H 3.424 2.017 4.831 4.386 4.091 4.486 . 0 0 "[ . 1 . 2]" 1
1081 1 43 THR H 1 44 VAL QG 3.845 2.071 5.619 4.391 3.850 4.585 . 0 0 "[ . 1 . 2]" 1
1082 1 43 THR HA 1 43 THR HB 2.355 . 3.020 2.638 2.304 2.849 . 0 0 "[ . 1 . 2]" 1
1083 1 43 THR HA 1 43 THR MG 2.327 . 2.977 2.315 2.002 3.159 0.182 13 0 "[ . 1 . 2]" 1
1084 1 43 THR HA 1 44 VAL H 2.174 . 2.741 2.218 2.110 2.371 . 0 0 "[ . 1 . 2]" 1
1085 1 43 THR HB 1 43 THR MG 2.062 . 2.572 2.129 2.106 2.137 . 0 0 "[ . 1 . 2]" 1
1086 1 43 THR HB 1 44 VAL H 2.469 . 3.200 3.204 2.914 3.470 0.270 13 0 "[ . 1 . 2]" 1
1087 1 43 THR HB 1 44 VAL QG 3.214 . 4.454 3.789 3.499 4.124 . 0 0 "[ . 1 . 2]" 1
1088 1 43 THR MG 1 44 VAL H 2.578 . 3.375 3.299 2.641 3.651 0.276 8 0 "[ . 1 . 2]" 1
1089 1 44 VAL H 1 44 VAL HA 2.892 . 3.896 2.108 2.057 2.226 . 0 0 "[ . 1 . 2]" 1
1090 1 44 VAL H 1 44 VAL HB 3.431 2.018 4.844 3.037 2.610 3.800 . 0 0 "[ . 1 . 2]" 1
1091 1 44 VAL H 1 44 VAL HB 2.542 . 3.317 2.739 2.433 2.966 . 0 0 "[ . 1 . 2]" 1
1092 1 44 VAL H 1 44 VAL QG 2.928 . 3.957 2.266 1.856 2.621 0.043 6 0 "[ . 1 . 2]" 1
1093 1 44 VAL H 1 44 VAL QG 2.284 . 2.910 2.089 1.841 2.279 . 0 0 "[ . 1 . 2]" 1
1094 1 44 VAL H 1 46 CYS H 3.533 2.035 5.031 4.353 4.255 4.441 . 0 0 "[ . 1 . 2]" 1
1095 1 44 VAL H 1 45 THR HA 4.015 2.081 5.949 4.913 4.708 5.277 . 0 0 "[ . 1 . 2]" 1
1096 1 44 VAL H 1 51 TRP HE3 4.426 2.076 6.776 5.195 4.846 5.374 . 0 0 "[ . 1 . 2]" 1
1097 1 44 VAL H 1 53 PRO HD2 3.934 2.076 5.792 5.811 5.493 5.906 0.114 11 0 "[ . 1 . 2]" 1
1098 1 44 VAL H 1 53 PRO HD3 4.277 2.082 6.472 6.347 5.645 6.576 0.104 5 0 "[ . 1 . 2]" 1
1099 1 44 VAL HA 1 44 VAL QG 2.694 . 2.764 2.152 2.072 2.296 . 0 0 "[ . 1 . 2]" 1
1100 1 44 VAL HA 1 45 THR H 2.261 . 2.874 2.159 2.099 2.302 . 0 0 "[ . 1 . 2]" 1
1101 1 44 VAL HA 1 45 THR HB 3.225 . 4.473 4.580 4.550 4.624 0.151 11 0 "[ . 1 . 2]" 1
1102 1 44 VAL HA 1 46 CYS H 4.456 2.073 6.839 5.966 5.755 6.131 . 0 0 "[ . 1 . 2]" 1
1103 1 44 VAL HA 1 53 PRO HD2 2.624 . 3.450 3.168 2.962 3.321 . 0 0 "[ . 1 . 2]" 1
1104 1 44 VAL HA 1 53 PRO HD3 2.534 . 3.305 3.286 2.896 3.369 0.064 5 0 "[ . 1 . 2]" 1
1105 1 44 VAL HA 1 53 PRO HD2 3.039 . 4.147 3.312 3.051 3.590 . 0 0 "[ . 1 . 2]" 1
1106 1 44 VAL HA 1 53 PRO HG3 3.116 . 4.281 2.402 2.060 2.755 . 0 0 "[ . 1 . 2]" 1
1107 1 44 VAL HB 1 51 TRP HB3 2.993 . 4.068 3.575 2.069 4.106 0.038 14 0 "[ . 1 . 2]" 1
1108 1 44 VAL HB 1 51 TRP HE3 2.615 . 3.435 2.867 2.347 3.253 . 0 0 "[ . 1 . 2]" 1
1109 1 44 VAL HB 1 52 SER QB 3.036 . 4.142 3.838 3.722 4.192 0.050 3 0 "[ . 1 . 2]" 1
1110 1 44 VAL HB 1 53 PRO HD2 3.085 . 4.227 3.384 2.388 3.637 . 0 0 "[ . 1 . 2]" 1
1111 1 44 VAL HB 1 53 PRO HG2 2.437 . 3.150 2.914 2.701 2.967 . 0 0 "[ . 1 . 2]" 1
1112 1 44 VAL QG 1 45 THR H 3.253 . 4.523 2.687 2.255 3.401 . 0 0 "[ . 1 . 2]" 1
1113 1 44 VAL QG 1 51 TRP HB3 3.166 . 4.369 2.121 1.684 3.357 0.295 3 0 "[ . 1 . 2]" 1
1114 1 44 VAL QG 1 51 TRP HE3 2.469 . 3.200 2.143 1.730 2.756 0.008 3 0 "[ . 1 . 2]" 1
1115 1 44 VAL QG 1 52 SER H 3.846 2.071 5.621 3.596 2.885 5.068 . 0 0 "[ . 1 . 2]" 1
1116 1 44 VAL QG 1 53 PRO HD2 3.173 . 4.381 2.110 1.354 3.193 0.611 3 1 "[ + . 1 . 2]" 1
1117 1 44 VAL QG 1 53 PRO HG2 2.672 . 3.529 1.830 1.609 2.117 0.206 20 0 "[ . 1 . 2]" 1
1118 1 44 VAL QG 1 53 PRO HG3 2.851 . 3.827 2.753 2.479 2.955 . 0 0 "[ . 1 . 2]" 1
1119 1 44 VAL QG 1 54 THR H 3.910 2.076 5.744 2.947 2.314 3.918 . 0 0 "[ . 1 . 2]" 1
1120 1 44 VAL QG 1 55 PRO HA . . 3.090 2.440 1.986 2.908 . 0 0 "[ . 1 . 2]" 1
1121 1 44 VAL QG 1 55 PRO HD3 3.036 . 3.850 2.396 1.895 3.336 0.035 11 0 "[ . 1 . 2]" 1
1122 1 44 VAL QG 1 56 ARG H 3.615 2.047 5.183 3.983 3.504 4.514 . 0 0 "[ . 1 . 2]" 1
1123 1 45 THR H 1 45 THR HA 2.963 . 4.016 2.910 2.863 2.941 . 0 0 "[ . 1 . 2]" 1
1124 1 45 THR H 1 45 THR HB 2.348 . 3.009 2.508 2.450 2.549 . 0 0 "[ . 1 . 2]" 1
1125 1 45 THR H 1 46 CYS H 3.508 2.031 4.985 4.435 4.341 4.516 . 0 0 "[ . 1 . 2]" 1
1126 1 45 THR H 1 46 CYS HB3 4.212 2.083 6.341 5.459 5.046 5.630 . 0 0 "[ . 1 . 2]" 1
1127 1 45 THR H 1 51 TRP HA 3.591 2.044 5.138 4.509 4.163 4.928 . 0 0 "[ . 1 . 2]" 1
1128 1 45 THR H 1 51 TRP HB3 4.006 2.080 5.932 4.501 4.007 4.896 . 0 0 "[ . 1 . 2]" 1
1129 1 45 THR H 1 51 TRP HE3 3.124 . 4.295 3.699 3.375 3.955 . 0 0 "[ . 1 . 2]" 1
1130 1 45 THR H 1 51 TRP HZ3 4.216 2.083 6.349 5.008 4.721 5.503 . 0 0 "[ . 1 . 2]" 1
1131 1 45 THR H 1 52 SER H 2.762 . 3.677 3.668 3.175 3.778 0.101 5 0 "[ . 1 . 2]" 1
1132 1 45 THR H 1 52 SER QB 3.239 . 4.498 3.227 2.953 4.114 . 0 0 "[ . 1 . 2]" 1
1133 1 45 THR H 1 53 PRO HD2 3.010 . 4.097 2.574 2.177 3.499 . 0 0 "[ . 1 . 2]" 1
1134 1 45 THR H 1 53 PRO HD3 3.147 . 4.335 2.259 1.900 2.491 0.059 16 0 "[ . 1 . 2]" 1
1135 1 45 THR H 1 53 PRO HG2 4.196 2.084 6.308 3.370 2.833 4.361 . 0 0 "[ . 1 . 2]" 1
1136 1 45 THR H 1 53 PRO HG3 4.110 2.083 6.137 2.648 2.154 3.365 . 0 0 "[ . 1 . 2]" 1
1137 1 45 THR HA 1 45 THR HB 2.823 . 3.779 3.024 3.017 3.029 . 0 0 "[ . 1 . 2]" 1
1138 1 45 THR HA 1 45 THR MG 2.343 . 3.002 2.379 2.323 2.418 . 0 0 "[ . 1 . 2]" 1
1139 1 45 THR HA 1 46 CYS H 2.240 . 2.842 2.172 2.099 2.222 . 0 0 "[ . 1 . 2]" 1
1140 1 45 THR HA 1 51 TRP HE3 3.243 . 4.505 3.885 3.676 4.131 . 0 0 "[ . 1 . 2]" 1
1141 1 45 THR HA 1 52 SER H 4.192 2.083 6.301 4.826 4.672 5.008 . 0 0 "[ . 1 . 2]" 1
1142 1 45 THR HB 1 45 THR MG 2.067 . 2.580 2.139 2.136 2.142 . 0 0 "[ . 1 . 2]" 1
1143 1 45 THR HB 1 46 CYS H 3.178 . 4.390 4.163 4.024 4.272 . 0 0 "[ . 1 . 2]" 1
1144 1 45 THR HB 1 47 MET QB 3.238 . 4.496 4.241 3.853 4.444 . 0 0 "[ . 1 . 2]" 1
1145 1 45 THR HB 1 52 SER H 3.231 . 4.484 3.407 3.096 3.826 . 0 0 "[ . 1 . 2]" 1
1146 1 45 THR MG 1 46 CYS HB3 3.211 . 4.448 4.022 3.868 4.256 . 0 0 "[ . 1 . 2]" 1
1147 1 45 THR MG 1 47 MET H 3.681 2.055 5.307 4.288 4.086 4.464 . 0 0 "[ . 1 . 2]" 1
1148 1 45 THR MG 1 47 MET QB 3.149 . 4.339 3.604 3.191 3.946 . 0 0 "[ . 1 . 2]" 1
1149 1 45 THR MG 1 52 SER H 3.801 2.067 5.535 4.010 3.782 4.368 . 0 0 "[ . 1 . 2]" 1
1150 1 46 CYS H 1 46 CYS HA 2.833 . 3.796 2.859 2.825 2.890 . 0 0 "[ . 1 . 2]" 1
1151 1 46 CYS H 1 46 CYS HB2 2.555 . 3.339 2.671 2.519 2.781 . 0 0 "[ . 1 . 2]" 1
1152 1 46 CYS H 1 46 CYS HB3 2.548 . 3.327 2.443 2.342 2.526 . 0 0 "[ . 1 . 2]" 1
1153 1 46 CYS H 1 47 MET H 3.724 2.060 5.388 4.397 4.326 4.466 . 0 0 "[ . 1 . 2]" 1
1154 1 46 CYS H 1 51 TRP HA 4.023 2.081 5.965 4.749 4.353 4.941 . 0 0 "[ . 1 . 2]" 1
1155 1 46 CYS H 1 51 TRP HE3 3.425 2.017 4.833 3.527 3.075 3.858 . 0 0 "[ . 1 . 2]" 1
1156 1 46 CYS H 1 51 TRP HZ3 2.976 . 4.039 3.029 2.663 3.532 . 0 0 "[ . 1 . 2]" 1
1157 1 46 CYS HA 1 46 CYS HB2 2.562 . 3.349 2.439 2.401 2.479 . 0 0 "[ . 1 . 2]" 1
1158 1 46 CYS HA 1 46 CYS HB3 2.685 . 3.550 3.026 3.021 3.033 . 0 0 "[ . 1 . 2]" 1
1159 1 46 CYS HA 1 47 MET H 2.207 . 2.791 2.182 2.121 2.236 . 0 0 "[ . 1 . 2]" 1
1160 1 46 CYS HA 1 51 TRP H 3.528 2.034 5.022 3.814 3.383 5.137 0.115 3 0 "[ . 1 . 2]" 1
1161 1 46 CYS HA 1 51 TRP HA 2.573 . 3.367 2.524 2.300 2.850 . 0 0 "[ . 1 . 2]" 1
1162 1 46 CYS HA 1 51 TRP HE3 2.758 . 3.671 2.692 2.524 2.947 . 0 0 "[ . 1 . 2]" 1
1163 1 46 CYS HA 1 52 SER H 3.227 . 4.477 3.566 3.324 4.065 . 0 0 "[ . 1 . 2]" 1
1164 1 46 CYS HB2 1 51 TRP HE3 3.284 . 4.578 3.741 3.331 3.900 . 0 0 "[ . 1 . 2]" 1
1165 1 46 CYS HB2 1 51 TRP HZ3 3.039 . 4.147 2.792 2.248 3.139 . 0 0 "[ . 1 . 2]" 1
1166 1 46 CYS HB2 1 52 SER H 4.298 2.081 6.515 4.713 4.507 4.909 . 0 0 "[ . 1 . 2]" 1
1167 1 46 CYS HB3 1 47 MET H 2.834 . 3.798 2.707 2.601 2.870 . 0 0 "[ . 1 . 2]" 1
1168 1 46 CYS HB3 1 49 ASN H 3.773 2.065 5.481 4.550 4.347 4.840 . 0 0 "[ . 1 . 2]" 1
1169 1 46 CYS HB3 1 52 SER H 3.394 2.012 4.776 3.001 2.575 3.716 . 0 0 "[ . 1 . 2]" 1
1170 1 47 MET H 1 47 MET QB 2.896 . 3.837 2.733 2.622 2.913 . 0 0 "[ . 1 . 2]" 1
1171 1 47 MET H 1 47 MET QG 2.967 . 3.997 3.351 2.105 3.641 . 0 0 "[ . 1 . 2]" 1
1172 1 47 MET H 1 50 GLY H 3.053 . 4.172 3.886 2.665 4.200 0.028 7 0 "[ . 1 . 2]" 1
1173 1 47 MET H 1 50 GLY HA3 3.684 2.055 5.313 5.184 4.308 5.478 0.165 19 0 "[ . 1 . 2]" 1
1174 1 47 MET H 1 51 TRP HA 2.930 . 3.960 2.400 1.862 2.884 0.038 4 0 "[ . 1 . 2]" 1
1175 1 47 MET H 1 51 TRP HB2 4.281 2.082 6.480 5.202 4.754 5.751 . 0 0 "[ . 1 . 2]" 1
1176 1 47 MET H 1 51 TRP HB3 4.026 2.081 5.971 4.857 4.287 5.342 . 0 0 "[ . 1 . 2]" 1
1177 1 47 MET H 1 51 TRP HE3 3.527 2.034 5.020 4.224 4.017 4.564 . 0 0 "[ . 1 . 2]" 1
1178 1 47 MET H 1 52 SER H 3.328 . 4.657 2.893 2.569 3.674 . 0 0 "[ . 1 . 2]" 1
1179 1 47 MET HA 1 47 MET QB 2.810 . 3.727 2.404 2.147 2.469 . 0 0 "[ . 1 . 2]" 1
1180 1 47 MET HA 1 47 MET QG 2.667 . 3.521 2.198 1.982 3.318 . 0 0 "[ . 1 . 2]" 1
1181 1 47 MET HA 1 48 GLU H 2.648 . 3.489 2.163 1.888 3.161 . 0 0 "[ . 1 . 2]" 1
1182 1 47 MET QB 1 47 MET QG 2.371 . 2.650 2.040 2.010 2.072 . 0 0 "[ . 1 . 2]" 1
1183 1 47 MET QB 1 48 GLU H 2.973 . 4.028 2.675 1.774 3.183 0.139 6 0 "[ . 1 . 2]" 1
1184 1 47 MET QB 1 48 GLU HA 3.008 . 4.093 2.908 1.860 3.132 0.063 17 0 "[ . 1 . 2]" 1
1185 1 47 MET QB 1 49 ASN H 3.752 2.063 5.441 4.700 4.469 5.017 . 0 0 "[ . 1 . 2]" 1
1186 1 47 MET QB 1 50 GLY H 3.999 2.082 5.918 4.658 4.139 5.281 . 0 0 "[ . 1 . 2]" 1
1187 1 47 MET QB 1 52 SER H 3.356 2.005 4.707 3.010 2.577 3.749 . 0 0 "[ . 1 . 2]" 1
1188 1 47 MET QB 1 52 SER QB 2.685 . 3.303 2.957 1.861 3.204 . 0 0 "[ . 1 . 2]" 1
1189 1 47 MET QG 1 48 GLU H 2.568 . 3.359 3.427 2.291 3.577 0.218 6 0 "[ . 1 . 2]" 1
1190 1 47 MET QG 1 51 TRP H 3.984 2.079 5.889 5.852 3.986 6.304 0.415 6 0 "[ . 1 . 2]" 1
1191 1 47 MET QG 1 52 SER H 3.825 2.070 5.580 3.716 2.717 4.214 . 0 0 "[ . 1 . 2]" 1
1192 1 47 MET QG 1 52 SER QB 2.844 . 3.815 3.293 2.552 3.562 . 0 0 "[ . 1 . 2]" 1
1193 1 48 GLU H 1 48 GLU HA 2.303 . 2.940 2.327 2.231 2.825 . 0 0 "[ . 1 . 2]" 1
1194 1 48 GLU H 1 48 GLU HB2 2.436 . 3.148 2.915 2.419 3.566 0.418 1 0 "[ . 1 . 2]" 1
1195 1 48 GLU H 1 49 ASN H 2.689 . 3.557 3.103 2.785 3.869 0.312 11 0 "[ . 1 . 2]" 1
1196 1 48 GLU H 1 50 GLY H 3.504 2.031 4.977 4.393 3.745 4.596 . 0 0 "[ . 1 . 2]" 1
1197 1 48 GLU HA 1 48 GLU HB2 2.149 . 2.703 2.776 2.425 2.981 0.278 7 0 "[ . 1 . 2]" 1
1198 1 48 GLU HA 1 48 GLU HB3 2.247 . 2.853 2.733 2.240 3.006 0.153 16 0 "[ . 1 . 2]" 1
1199 1 48 GLU HA 1 48 GLU QG 2.270 . 2.888 2.478 2.118 2.852 . 0 0 "[ . 1 . 2]" 1
1200 1 48 GLU HA 1 49 ASN H 2.696 . 3.568 2.678 2.116 2.850 . 0 0 "[ . 1 . 2]" 1
1201 1 48 GLU HA 1 50 GLY H 3.211 . 4.448 4.116 3.904 4.213 . 0 0 "[ . 1 . 2]" 1
1202 1 48 GLU HB2 1 48 GLU QG 2.009 . 2.493 2.274 2.130 2.477 . 0 0 "[ . 1 . 2]" 1
1203 1 48 GLU HB2 1 50 GLY H 3.924 2.076 5.772 4.198 3.378 5.457 . 0 0 "[ . 1 . 2]" 1
1204 1 48 GLU HB3 1 48 GLU QG 2.055 . 2.562 2.308 2.110 2.442 . 0 0 "[ . 1 . 2]" 1
1205 1 48 GLU HB3 1 50 GLY H 3.739 2.061 5.417 3.802 3.056 5.290 . 0 0 "[ . 1 . 2]" 1
1206 1 49 ASN H 1 49 ASN HA 2.888 . 3.889 2.279 2.265 2.311 . 0 0 "[ . 1 . 2]" 1
1207 1 49 ASN H 1 49 ASN QB 2.679 . 3.541 3.047 2.991 3.122 . 0 0 "[ . 1 . 2]" 1
1208 1 49 ASN H 1 49 ASN HB3 2.582 . 3.382 3.586 3.165 3.861 0.479 3 0 "[ . 1 . 2]" 1
1209 1 49 ASN H 1 50 GLY H 2.354 . 3.019 2.836 2.390 3.021 0.002 8 0 "[ . 1 . 2]" 1
1210 1 49 ASN H 1 50 GLY HA2 3.948 2.078 5.818 5.245 4.917 5.395 . 0 0 "[ . 1 . 2]" 1
1211 1 49 ASN H 1 50 GLY HA3 3.737 2.061 5.413 5.265 4.979 5.411 . 0 0 "[ . 1 . 2]" 1
1212 1 49 ASN HA 1 49 ASN QB 2.574 . 3.369 2.339 2.181 2.467 . 0 0 "[ . 1 . 2]" 1
1213 1 49 ASN HA 1 49 ASN HB3 2.640 . 3.476 2.998 2.496 3.050 . 0 0 "[ . 1 . 2]" 1
1214 1 49 ASN HA 1 49 ASN HD21 4.497 2.071 6.923 3.602 2.512 4.490 . 0 0 "[ . 1 . 2]" 1
1215 1 49 ASN HA 1 50 GLY H 3.010 . 4.097 3.327 2.781 3.455 . 0 0 "[ . 1 . 2]" 1
1216 1 49 ASN QB 1 49 ASN HD21 2.828 . 3.788 2.235 2.129 2.763 . 0 0 "[ . 1 . 2]" 1
1217 1 49 ASN HB3 1 49 ASN HD21 2.629 . 3.458 2.854 2.183 3.496 0.038 6 0 "[ . 1 . 2]" 1
1218 1 49 ASN HB3 1 49 ASN HD22 2.980 . 4.045 3.767 3.463 4.064 0.019 6 0 "[ . 1 . 2]" 1
1219 1 49 ASN HB3 1 50 GLY H 3.339 2.001 4.677 3.421 3.081 4.557 . 0 0 "[ . 1 . 2]" 1
1220 1 50 GLY H 1 50 GLY HA2 2.337 . 2.993 2.489 2.373 2.805 . 0 0 "[ . 1 . 2]" 1
1221 1 50 GLY H 1 50 GLY HA3 2.366 . 3.038 2.931 2.801 2.956 . 0 0 "[ . 1 . 2]" 1
1222 1 50 GLY HA3 1 51 TRP H 2.362 . 3.032 2.695 2.092 3.042 0.010 10 0 "[ . 1 . 2]" 1
1223 1 50 GLY HA3 1 51 TRP HB3 2.737 . 3.636 3.621 3.375 3.706 0.070 4 0 "[ . 1 . 2]" 1
1224 1 50 GLY HA3 1 52 SER H 3.944 2.077 5.811 5.733 5.339 5.919 0.108 13 0 "[ . 1 . 2]" 1
1225 1 51 TRP H 1 51 TRP HA 2.971 . 4.030 2.396 2.211 2.908 . 0 0 "[ . 1 . 2]" 1
1226 1 51 TRP H 1 51 TRP HB2 2.400 . 3.091 3.088 2.370 3.396 0.305 15 0 "[ . 1 . 2]" 1
1227 1 51 TRP H 1 51 TRP HB3 2.747 . 3.653 3.795 3.531 3.919 0.266 15 0 "[ . 1 . 2]" 1
1228 1 51 TRP H 1 51 TRP HD1 2.679 . 3.540 3.385 2.729 3.628 0.088 16 0 "[ . 1 . 2]" 1
1229 1 51 TRP H 1 51 TRP HE1 4.012 2.080 5.944 4.809 4.140 5.610 . 0 0 "[ . 1 . 2]" 1
1230 1 51 TRP H 1 51 TRP HE3 3.694 2.057 5.331 4.572 4.178 5.267 . 0 0 "[ . 1 . 2]" 1
1231 1 51 TRP H 1 52 SER H 3.609 2.046 5.172 4.133 3.920 4.526 . 0 0 "[ . 1 . 2]" 1
1232 1 51 TRP H 1 55 PRO HG3 4.000 2.080 5.920 5.878 5.035 6.092 0.172 13 0 "[ . 1 . 2]" 1
1233 1 51 TRP HA 1 51 TRP HB2 2.875 . 3.867 3.002 2.978 3.027 . 0 0 "[ . 1 . 2]" 1
1234 1 51 TRP HA 1 51 TRP HB3 2.641 . 3.478 2.474 2.403 2.506 . 0 0 "[ . 1 . 2]" 1
1235 1 51 TRP HA 1 51 TRP HE3 2.528 . 3.295 2.689 2.416 2.956 . 0 0 "[ . 1 . 2]" 1
1236 1 51 TRP HA 1 52 SER H 2.363 . 3.033 2.071 2.019 2.198 . 0 0 "[ . 1 . 2]" 1
1237 1 51 TRP HB2 1 51 TRP HD1 2.636 . 3.470 2.576 2.555 2.614 . 0 0 "[ . 1 . 2]" 1
1238 1 51 TRP HB2 1 51 TRP HE3 3.117 . 4.283 4.194 4.154 4.222 . 0 0 "[ . 1 . 2]" 1
1239 1 51 TRP HB2 1 52 SER H 3.297 . 4.601 4.278 3.913 4.437 . 0 0 "[ . 1 . 2]" 1
1240 1 51 TRP HB2 1 54 THR H 4.221 2.083 6.359 3.547 3.213 3.884 . 0 0 "[ . 1 . 2]" 1
1241 1 51 TRP HB2 1 54 THR HA 2.690 . 3.558 2.748 2.295 3.314 . 0 0 "[ . 1 . 2]" 1
1242 1 51 TRP HB2 1 54 THR MG 3.291 . 4.591 3.568 3.211 3.853 . 0 0 "[ . 1 . 2]" 1
1243 1 51 TRP HB2 1 55 PRO HD2 2.746 . 3.651 2.809 2.196 3.192 . 0 0 "[ . 1 . 2]" 1
1244 1 51 TRP HB2 1 55 PRO HD3 2.544 . 3.320 2.010 1.689 2.576 0.079 13 0 "[ . 1 . 2]" 1
1245 1 51 TRP HB2 1 55 PRO HG3 3.190 . 4.411 3.494 3.285 3.828 . 0 0 "[ . 1 . 2]" 1
1246 1 51 TRP HB3 1 51 TRP HD1 3.014 . 4.104 3.713 3.654 3.774 . 0 0 "[ . 1 . 2]" 1
1247 1 51 TRP HB3 1 51 TRP HE3 2.758 . 3.671 2.777 2.663 2.903 . 0 0 "[ . 1 . 2]" 1
1248 1 51 TRP HB3 1 52 SER H 2.955 . 4.003 3.421 2.829 3.700 . 0 0 "[ . 1 . 2]" 1
1249 1 51 TRP HB3 1 53 PRO HD2 2.734 . 3.631 2.723 2.586 2.994 . 0 0 "[ . 1 . 2]" 1
1250 1 51 TRP HB3 1 54 THR H 4.258 2.083 6.433 3.141 2.902 3.419 . 0 0 "[ . 1 . 2]" 1
1251 1 51 TRP HB3 1 54 THR HA 2.979 . 4.044 3.279 2.740 3.763 . 0 0 "[ . 1 . 2]" 1
1252 1 51 TRP HB3 1 54 THR MG 3.303 . 4.612 4.124 3.447 4.723 0.111 20 0 "[ . 1 . 2]" 1
1253 1 51 TRP HB3 1 55 PRO HD2 2.789 . 3.723 3.671 3.402 3.762 0.039 4 0 "[ . 1 . 2]" 1
1254 1 51 TRP HB3 1 55 PRO HD3 2.533 . 3.303 2.120 1.955 2.372 . 0 0 "[ . 1 . 2]" 1
1255 1 51 TRP HD1 1 52 SER H 4.444 2.074 6.814 6.262 6.009 6.389 . 0 0 "[ . 1 . 2]" 1
1256 1 51 TRP HD1 1 55 PRO HD3 3.227 . 4.476 3.564 3.184 4.062 . 0 0 "[ . 1 . 2]" 1
1257 1 51 TRP HD1 1 55 PRO HG2 3.209 . 4.445 3.650 3.133 4.257 . 0 0 "[ . 1 . 2]" 1
1258 1 51 TRP HE1 1 55 PRO HD3 4.419 2.076 6.762 5.364 4.996 5.986 . 0 0 "[ . 1 . 2]" 1
1259 1 51 TRP HE1 1 55 PRO HG2 3.659 2.053 5.265 4.736 3.710 5.305 0.040 11 0 "[ . 1 . 2]" 1
1260 1 51 TRP HE1 1 55 PRO HG3 3.986 2.079 5.893 4.322 3.809 5.207 . 0 0 "[ . 1 . 2]" 1
1261 1 51 TRP HE3 1 52 SER H 2.942 . 3.980 3.629 3.364 4.041 0.061 6 0 "[ . 1 . 2]" 1
1262 1 51 TRP HZ3 1 52 SER H 4.269 2.082 6.456 5.747 5.422 6.223 . 0 0 "[ . 1 . 2]" 1
1263 1 52 SER H 1 52 SER QB 2.666 . 3.397 2.350 2.194 2.582 . 0 0 "[ . 1 . 2]" 1
1264 1 52 SER H 1 53 PRO HD2 3.865 2.073 5.657 2.728 2.380 3.325 . 0 0 "[ . 1 . 2]" 1
1265 1 52 SER HA 1 52 SER QB 2.428 . 2.879 2.372 2.155 2.436 . 0 0 "[ . 1 . 2]" 1
1266 1 52 SER HA 1 54 THR H 3.069 . 4.199 4.203 4.112 4.272 0.073 12 0 "[ . 1 . 2]" 1
1267 1 52 SER QB 1 53 PRO HB3 3.074 . 4.208 3.901 3.786 4.284 0.076 20 0 "[ . 1 . 2]" 1
1268 1 53 PRO HA 1 53 PRO HB2 2.370 . 3.044 2.626 2.594 2.645 . 0 0 "[ . 1 . 2]" 1
1269 1 53 PRO HA 1 53 PRO HG2 2.941 . 3.979 3.819 3.779 3.875 . 0 0 "[ . 1 . 2]" 1
1270 1 53 PRO HB2 1 53 PRO HD2 3.263 . 4.541 3.991 3.845 4.055 . 0 0 "[ . 1 . 2]" 1
1271 1 53 PRO HB2 1 53 PRO HD3 2.952 . 3.998 3.963 3.900 4.065 0.067 20 0 "[ . 1 . 2]" 1
1272 1 53 PRO HB2 1 53 PRO HG3 2.622 . 3.447 2.652 2.623 2.699 . 0 0 "[ . 1 . 2]" 1
1273 1 53 PRO HB2 1 54 THR H 2.806 . 3.751 3.902 3.854 4.000 0.249 20 0 "[ . 1 . 2]" 1
1274 1 53 PRO HB3 1 53 PRO HG3 2.455 . 3.178 2.329 2.295 2.353 . 0 0 "[ . 1 . 2]" 1
1275 1 53 PRO HD2 1 53 PRO HG2 2.475 . 3.210 2.283 2.254 2.302 . 0 0 "[ . 1 . 2]" 1
1276 1 53 PRO HD2 1 53 PRO HG3 2.530 . 3.298 2.766 2.723 2.867 . 0 0 "[ . 1 . 2]" 1
1277 1 53 PRO HD3 1 53 PRO HG2 2.320 . 2.966 2.951 2.886 2.977 0.011 11 0 "[ . 1 . 2]" 1
1278 1 53 PRO HD3 1 53 PRO HG3 2.410 . 3.107 2.279 2.261 2.294 . 0 0 "[ . 1 . 2]" 1
1279 1 53 PRO HG2 1 54 THR H 3.471 2.025 4.917 2.974 2.751 3.250 . 0 0 "[ . 1 . 2]" 1
1280 1 53 PRO HG3 1 54 THR H 3.394 2.012 4.776 4.198 4.081 4.334 . 0 0 "[ . 1 . 2]" 1
1281 1 54 THR H 1 54 THR HA 2.625 . 3.452 2.262 2.253 2.272 . 0 0 "[ . 1 . 2]" 1
1282 1 54 THR H 1 55 PRO HD2 3.580 2.042 5.118 4.245 3.671 4.699 . 0 0 "[ . 1 . 2]" 1
1283 1 54 THR H 1 55 PRO HD3 3.372 2.008 4.736 3.310 3.005 3.629 . 0 0 "[ . 1 . 2]" 1
1284 1 54 THR H 1 56 ARG QD 4.436 2.075 6.797 6.490 4.663 6.967 0.170 2 0 "[ . 1 . 2]" 1
1285 1 54 THR H 1 56 ARG QG 4.306 2.081 6.531 5.788 5.265 6.324 . 0 0 "[ . 1 . 2]" 1
1286 1 54 THR HA 1 54 THR HB 2.437 . 3.150 3.022 3.018 3.026 . 0 0 "[ . 1 . 2]" 1
1287 1 54 THR HA 1 54 THR MG 2.281 . 2.905 2.341 2.293 2.385 . 0 0 "[ . 1 . 2]" 1
1288 1 54 THR HA 1 55 PRO HD2 2.240 . 2.842 2.218 1.752 2.599 . 0 0 "[ . 1 . 2]" 1
1289 1 54 THR HA 1 55 PRO HD3 2.196 . 2.775 2.139 1.753 2.605 . 0 0 "[ . 1 . 2]" 1
1290 1 54 THR HA 1 55 PRO HG3 3.160 . 4.358 4.222 3.935 4.369 0.011 11 0 "[ . 1 . 2]" 1
1291 1 54 THR HB 1 54 THR MG 2.039 . 2.538 2.137 2.135 2.138 . 0 0 "[ . 1 . 2]" 1
1292 1 54 THR HB 1 56 ARG HE 4.393 2.078 6.708 5.224 2.267 6.717 0.009 16 0 "[ . 1 . 2]" 1
1293 1 54 THR MG 1 55 PRO HA 3.040 . 4.149 3.654 3.569 3.732 . 0 0 "[ . 1 . 2]" 1
1294 1 54 THR MG 1 55 PRO HD2 2.443 . 3.159 2.547 2.038 2.870 . 0 0 "[ . 1 . 2]" 1
1295 1 54 THR MG 1 56 ARG H 3.699 2.057 5.341 3.810 3.482 4.067 . 0 0 "[ . 1 . 2]" 1
1296 1 54 THR MG 1 56 ARG HB2 3.045 . 4.158 3.547 2.831 4.205 0.047 20 0 "[ . 1 . 2]" 1
1297 1 54 THR MG 1 56 ARG HB3 3.084 . 4.225 3.441 2.399 4.448 0.223 20 0 "[ . 1 . 2]" 1
1298 1 54 THR MG 1 56 ARG QD 2.684 . 3.548 2.401 2.168 2.719 . 0 0 "[ . 1 . 2]" 1
1299 1 54 THR MG 1 56 ARG QD 2.606 . 3.421 2.391 2.168 2.698 . 0 0 "[ . 1 . 2]" 1
1300 1 54 THR MG 1 56 ARG HE 4.032 2.081 5.983 3.859 2.847 4.536 . 0 0 "[ . 1 . 2]" 1
1301 1 55 PRO HA 1 55 PRO HB2 2.435 . 3.147 2.798 2.691 2.938 . 0 0 "[ . 1 . 2]" 1
1302 1 55 PRO HA 1 55 PRO HB3 2.344 . 3.003 2.276 2.252 2.307 . 0 0 "[ . 1 . 2]" 1
1303 1 55 PRO HA 1 55 PRO HG3 3.088 . 4.232 3.727 3.186 4.028 . 0 0 "[ . 1 . 2]" 1
1304 1 55 PRO HA 1 56 ARG H 2.062 . 2.572 2.239 2.144 2.395 . 0 0 "[ . 1 . 2]" 1
1305 1 55 PRO HB3 1 55 PRO HD2 3.118 . 4.285 3.654 3.424 3.889 . 0 0 "[ . 1 . 2]" 1
1306 1 55 PRO HB3 1 56 ARG H 3.020 . 4.114 4.272 3.930 4.526 0.412 14 0 "[ . 1 . 2]" 1
1307 1 55 PRO HD2 1 55 PRO HG2 2.799 . 3.739 2.286 2.246 2.320 . 0 0 "[ . 1 . 2]" 1
1308 1 55 PRO HD2 1 55 PRO HG3 2.628 . 3.457 2.838 2.667 2.991 . 0 0 "[ . 1 . 2]" 1
1309 1 55 PRO HD3 1 55 PRO HG2 2.459 . 3.185 2.853 2.683 2.990 . 0 0 "[ . 1 . 2]" 1
1310 1 55 PRO HD3 1 55 PRO HG3 2.586 . 3.389 2.283 2.243 2.315 . 0 0 "[ . 1 . 2]" 1
1311 1 56 ARG H 1 56 ARG HA 2.870 . 3.858 2.930 2.884 2.952 . 0 0 "[ . 1 . 2]" 1
1312 1 56 ARG H 1 56 ARG HB2 3.061 . 4.186 2.976 2.448 3.960 . 0 0 "[ . 1 . 2]" 1
1313 1 56 ARG H 1 56 ARG HB3 3.076 . 4.211 3.687 3.258 3.867 . 0 0 "[ . 1 . 2]" 1
1314 1 56 ARG H 1 56 ARG QD 4.238 2.083 6.393 4.355 3.708 4.914 . 0 0 "[ . 1 . 2]" 1
1315 1 56 ARG H 1 56 ARG QG 3.030 . 4.132 2.934 2.034 3.342 . 0 0 "[ . 1 . 2]" 1
1316 1 56 ARG HA 1 56 ARG HB2 2.556 . 3.340 2.888 2.450 3.030 . 0 0 "[ . 1 . 2]" 1
1317 1 56 ARG HA 1 56 ARG HB3 2.519 . 3.281 2.489 2.363 2.570 . 0 0 "[ . 1 . 2]" 1
1318 1 56 ARG HA 1 56 ARG HE 4.346 2.080 6.612 4.306 2.952 5.983 . 0 0 "[ . 1 . 2]" 1
1319 1 56 ARG HA 1 56 ARG QG 2.557 . 3.342 2.764 2.365 3.355 0.013 19 0 "[ . 1 . 2]" 1
1320 1 56 ARG HB2 1 56 ARG QD 2.344 . 3.003 2.879 2.372 3.505 0.502 20 1 "[ . 1 . +]" 1
1321 1 56 ARG HB2 1 56 ARG HE 3.962 2.078 5.846 3.219 2.059 4.451 0.019 19 0 "[ . 1 . 2]" 1
1322 1 56 ARG HB2 1 56 ARG QG 2.137 . 2.685 2.287 2.155 2.386 . 0 0 "[ . 1 . 2]" 1
1323 1 56 ARG HB2 1 58 ILE MG 2.977 . 4.041 3.459 2.741 4.054 0.013 9 0 "[ . 1 . 2]" 1
1324 1 56 ARG HB3 1 56 ARG QD 2.744 . 3.648 2.711 2.398 3.018 . 0 0 "[ . 1 . 2]" 1
1325 1 56 ARG HB3 1 56 ARG HE 3.884 2.074 5.694 2.796 2.034 4.389 0.040 20 0 "[ . 1 . 2]" 1
1326 1 56 ARG HB3 1 56 ARG QG 2.079 . 2.597 2.351 2.290 2.466 . 0 0 "[ . 1 . 2]" 1
1327 1 56 ARG QD 1 56 ARG QG 2.353 . 3.017 2.006 1.985 2.089 . 0 0 "[ . 1 . 2]" 1
1328 1 56 ARG HE 1 56 ARG QG 3.275 . 4.562 2.503 2.166 2.930 . 0 0 "[ . 1 . 2]" 1
1329 1 56 ARG HE 1 58 ILE MD 4.455 2.073 6.837 4.786 3.302 6.857 0.020 3 0 "[ . 1 . 2]" 1
1330 1 56 ARG HE 1 58 ILE MG 4.152 2.083 6.221 4.623 3.421 6.361 0.140 8 0 "[ . 1 . 2]" 1
1331 1 57 CYS HA 1 58 ILE H 2.474 . 3.209 2.254 2.141 2.404 . 0 0 "[ . 1 . 2]" 1
1332 1 57 CYS QB 1 58 ILE H 3.105 2.079 4.262 3.764 3.666 3.880 . 0 0 "[ . 1 . 2]" 1
1333 1 58 ILE H 1 58 ILE HB 2.614 . 3.434 3.145 2.692 3.619 0.185 3 0 "[ . 1 . 2]" 1
1334 1 58 ILE H 1 58 ILE MD 3.129 . 4.304 3.533 2.767 3.673 . 0 0 "[ . 1 . 2]" 1
1335 1 58 ILE H 1 58 ILE HG12 2.812 . 3.761 2.633 1.826 3.453 0.037 5 0 "[ . 1 . 2]" 1
1336 1 58 ILE H 1 58 ILE HG13 2.789 . 3.722 2.232 1.813 2.671 0.043 3 0 "[ . 1 . 2]" 1
1337 1 58 ILE H 1 58 ILE MG 3.238 . 4.496 3.325 2.596 3.848 . 0 0 "[ . 1 . 2]" 1
1338 1 58 ILE H 1 59 ARG H 3.816 2.069 5.563 4.538 4.461 4.582 . 0 0 "[ . 1 . 2]" 1
1339 1 58 ILE HA 1 58 ILE HB 2.363 . 3.033 2.787 2.520 3.011 . 0 0 "[ . 1 . 2]" 1
1340 1 58 ILE HA 1 58 ILE MG 2.315 . 2.958 2.233 2.169 2.287 . 0 0 "[ . 1 . 2]" 1
1341 1 58 ILE HA 1 59 ARG H 2.445 . 3.163 2.347 2.180 2.551 . 0 0 "[ . 1 . 2]" 1
1342 1 58 ILE HB 1 58 ILE MD 2.418 . 3.120 2.414 2.329 2.458 . 0 0 "[ . 1 . 2]" 1
1343 1 58 ILE HB 1 58 ILE HG12 2.348 . 3.010 2.994 2.558 3.022 0.012 18 0 "[ . 1 . 2]" 1
1344 1 58 ILE HB 1 58 ILE HG13 2.575 . 3.371 2.502 2.399 3.009 . 0 0 "[ . 1 . 2]" 1
1345 1 58 ILE HB 1 58 ILE MG 1.978 . 2.447 2.119 2.104 2.128 . 0 0 "[ . 1 . 2]" 1
1346 1 58 ILE HB 1 59 ARG H 2.511 . 3.268 2.970 1.992 3.448 0.180 17 0 "[ . 1 . 2]" 1
1347 1 58 ILE MD 1 58 ILE HG12 2.153 . 2.709 2.118 2.108 2.121 . 0 0 "[ . 1 . 2]" 1
1348 1 58 ILE MD 1 58 ILE HG13 2.179 . 2.749 2.119 2.115 2.124 . 0 0 "[ . 1 . 2]" 1
1349 1 58 ILE HG12 1 58 ILE MG 2.255 . 2.865 2.346 2.201 2.426 . 0 0 "[ . 1 . 2]" 1
1350 1 58 ILE HG12 1 59 ARG H 3.186 . 4.404 4.703 4.461 5.107 0.703 9 6 "[ * .* +** . -]" 1
1351 1 58 ILE HG13 1 59 ARG H 3.598 2.044 5.152 4.610 3.588 4.995 . 0 0 "[ . 1 . 2]" 1
1352 1 58 ILE MG 1 59 ARG H 2.477 . 3.213 2.598 1.810 3.381 0.168 2 0 "[ . 1 . 2]" 1
1353 1 59 ARG H 1 59 ARG HA 2.541 . 3.316 2.870 2.792 2.921 . 0 0 "[ . 1 . 2]" 1
1354 1 59 ARG H 1 59 ARG HB2 2.347 . 3.008 2.564 2.339 2.904 . 0 0 "[ . 1 . 2]" 1
1355 1 59 ARG H 1 59 ARG HB3 2.339 . 2.995 2.651 2.370 3.400 0.405 9 0 "[ . 1 . 2]" 1
1356 1 59 ARG H 1 59 ARG QD 3.416 2.016 4.816 4.603 4.316 4.845 0.029 4 0 "[ . 1 . 2]" 1
1357 1 59 ARG H 1 59 ARG HG2 3.095 . 4.244 4.466 4.314 4.580 0.336 18 0 "[ . 1 . 2]" 1
1358 1 59 ARG H 1 60 VAL H 3.402 2.013 4.791 4.352 4.128 4.487 . 0 0 "[ . 1 . 2]" 1
1359 1 59 ARG HA 1 59 ARG HB2 2.416 . 3.116 2.527 2.409 2.654 . 0 0 "[ . 1 . 2]" 1
1360 1 59 ARG HA 1 59 ARG HB3 2.548 . 3.327 3.002 2.791 3.027 . 0 0 "[ . 1 . 2]" 1
1361 1 59 ARG HA 1 59 ARG HE 4.445 2.074 6.816 4.793 3.898 5.264 . 0 0 "[ . 1 . 2]" 1
1362 1 59 ARG HA 1 59 ARG HG2 2.779 . 3.706 2.979 2.387 3.365 . 0 0 "[ . 1 . 2]" 1
1363 1 59 ARG HA 1 59 ARG HG3 2.496 . 3.243 2.537 2.324 3.437 0.194 9 0 "[ . 1 . 2]" 1
1364 1 59 ARG HA 1 60 VAL H 1.971 . 2.437 2.083 1.975 2.726 0.289 9 0 "[ . 1 . 2]" 1
1365 1 59 ARG HA 1 60 VAL HB 3.030 . 4.132 4.286 4.210 4.380 0.248 1 0 "[ . 1 . 2]" 1
1366 1 59 ARG HA 1 61 LYS H 3.211 . 4.448 3.635 3.168 4.356 . 0 0 "[ . 1 . 2]" 1
1367 1 59 ARG HB2 1 59 ARG QD 2.545 . 3.322 2.547 2.280 3.312 . 0 0 "[ . 1 . 2]" 1
1368 1 59 ARG HB2 1 59 ARG HE 3.848 2.072 5.624 3.667 1.993 4.612 0.079 3 0 "[ . 1 . 2]" 1
1369 1 59 ARG HB2 1 60 VAL H 3.107 . 4.265 4.252 3.117 4.409 0.144 5 0 "[ . 1 . 2]" 1
1370 1 59 ARG HB2 1 61 LYS H 3.840 2.071 5.609 4.824 3.845 5.367 . 0 0 "[ . 1 . 2]" 1
1371 1 59 ARG HB3 1 59 ARG QD 2.660 . 3.509 2.639 2.308 3.148 . 0 0 "[ . 1 . 2]" 1
1372 1 59 ARG HB3 1 59 ARG HE 3.636 2.049 5.223 3.384 1.976 4.584 0.073 16 0 "[ . 1 . 2]" 1
1373 1 59 ARG HB3 1 59 ARG HG2 2.318 . 2.963 2.456 2.284 2.989 0.026 9 0 "[ . 1 . 2]" 1
1374 1 59 ARG HB3 1 59 ARG HG3 2.479 . 3.217 2.962 2.361 3.010 . 0 0 "[ . 1 . 2]" 1
1375 1 59 ARG HB3 1 60 VAL H 3.235 . 4.491 4.046 1.634 4.382 0.345 9 0 "[ . 1 . 2]" 1
1376 1 59 ARG HB3 1 60 VAL H 3.101 . 4.255 3.867 1.634 4.278 0.313 9 0 "[ . 1 . 2]" 1
1377 1 59 ARG QD 1 59 ARG HG2 2.539 . 3.312 2.325 2.161 2.440 . 0 0 "[ . 1 . 2]" 1
1378 1 59 ARG QD 1 59 ARG HG3 2.502 . 3.253 2.270 2.159 2.409 . 0 0 "[ . 1 . 2]" 1
1379 1 59 ARG QD 1 61 LYS H 3.934 2.077 5.791 4.218 3.423 4.865 . 0 0 "[ . 1 . 2]" 1
1380 1 59 ARG HE 1 59 ARG HG2 3.403 2.013 4.793 2.768 2.320 3.794 . 0 0 "[ . 1 . 2]" 1
1381 1 59 ARG HE 1 59 ARG HG3 3.519 2.033 5.005 3.089 2.363 3.697 . 0 0 "[ . 1 . 2]" 1
1382 1 59 ARG HG2 1 60 VAL H 2.962 . 4.015 3.329 2.645 3.984 . 0 0 "[ . 1 . 2]" 1
1383 1 59 ARG HG2 1 61 LYS H 2.868 . 3.855 2.403 1.898 3.107 . 0 0 "[ . 1 . 2]" 1
1384 1 59 ARG HG3 1 60 VAL H 2.902 . 3.912 3.405 2.806 3.976 0.064 19 0 "[ . 1 . 2]" 1
1385 1 59 ARG HG3 1 61 LYS H 3.383 2.009 4.757 3.405 2.594 4.503 . 0 0 "[ . 1 . 2]" 1
1386 1 60 VAL H 1 60 VAL HA 2.556 . 3.340 2.884 2.732 2.947 . 0 0 "[ . 1 . 2]" 1
1387 1 60 VAL H 1 60 VAL HB 2.474 . 3.209 2.578 2.356 2.808 . 0 0 "[ . 1 . 2]" 1
1388 1 60 VAL H 1 60 VAL QG 2.214 . 2.802 2.080 1.757 2.203 . 0 0 "[ . 1 . 2]" 1
1389 1 60 VAL H 1 61 LYS H 2.607 . 3.423 2.411 1.922 3.001 . 0 0 "[ . 1 . 2]" 1
1390 1 60 VAL H 1 61 LYS HA 3.940 2.077 5.803 4.780 4.137 5.180 . 0 0 "[ . 1 . 2]" 1
1391 1 60 VAL HA 1 60 VAL QG 2.312 . 2.954 2.220 2.127 2.345 . 0 0 "[ . 1 . 2]" 1
1392 1 60 VAL HB 1 60 VAL QG 2.080 . 2.498 1.893 1.890 1.898 . 0 0 "[ . 1 . 2]" 1
1393 1 60 VAL QG 1 61 LYS H 2.782 . 3.711 2.854 2.213 3.522 . 0 0 "[ . 1 . 2]" 1
1394 1 61 LYS H 1 61 LYS HA 2.567 . 3.358 2.699 2.242 2.946 . 0 0 "[ . 1 . 2]" 1
1395 1 61 LYS H 1 61 LYS HB2 2.862 . 3.845 3.234 2.522 3.924 0.079 11 0 "[ . 1 . 2]" 1
1396 1 61 LYS H 1 61 LYS HB3 2.714 . 3.598 3.264 2.465 4.051 0.453 15 0 "[ . 1 . 2]" 1
1397 1 61 LYS HA 1 61 LYS HB2 2.613 . 3.432 2.656 2.438 3.027 . 0 0 "[ . 1 . 2]" 1
1398 1 61 LYS HA 1 61 LYS HB3 2.629 . 3.459 2.723 2.313 3.030 . 0 0 "[ . 1 . 2]" 1
1399 1 61 LYS HB2 1 61 LYS QG 2.568 . 3.359 2.341 2.161 2.451 . 0 0 "[ . 1 . 2]" 1
1400 1 61 LYS QD 1 61 LYS QG 2.264 . 2.879 2.054 1.996 2.095 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Sunday, May 19, 2024 1:44:29 AM GMT (wattos1)