NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
384338 |
1kft   |
5217 | cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1kft
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 941
_Distance_constraint_stats_list.Viol_count 1923
_Distance_constraint_stats_list.Viol_total 4551.974
_Distance_constraint_stats_list.Viol_max 1.398
_Distance_constraint_stats_list.Viol_rms 0.0509
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0100
_Distance_constraint_stats_list.Viol_average_violations_only 0.1076
_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 23 THR 0.128 0.049 2 0 "[ . 1 . 2 ]"
1 24 SER 4.734 0.702 1 3 "[+ . 1 *- 2 ]"
1 25 SER 4.921 0.702 1 3 "[+ . 1 *- 2 ]"
1 26 LEU 1.036 0.157 9 0 "[ . 1 . 2 ]"
1 27 GLU 3.887 0.503 21 1 "[ . 1 . 2+ ]"
1 28 THR 4.789 0.252 2 0 "[ . 1 . 2 ]"
1 29 ILE 10.355 1.398 4 3 "[ +. * 1 . - 2 ]"
1 30 GLU 7.218 0.578 20 3 "[ .- * 1 . + ]"
1 31 GLY 5.023 0.408 11 0 "[ . 1 . 2 ]"
1 32 VAL 9.646 1.398 4 2 "[ +. - 1 . 2 ]"
1 33 GLY 5.031 0.358 17 0 "[ . 1 . 2 ]"
1 34 PRO 4.293 0.233 22 0 "[ . 1 . 2 ]"
1 35 LYS 12.121 0.991 2 6 "[*+ *. * *. - 2 ]"
1 36 ARG 16.117 0.991 2 5 "[-+ *. * *. 2 ]"
1 37 ARG 7.569 0.730 17 4 "[ . ** * . + 2 ]"
1 38 GLN 13.486 0.735 7 11 "[** ***+ *1 ** .*- 2 ]"
1 39 MET 4.377 0.910 20 2 "[ . 1 -. + ]"
1 40 LEU 4.515 0.694 9 2 "[ . +1 . - 2 ]"
1 41 LEU 0.567 0.220 1 0 "[ . 1 . 2 ]"
1 42 LYS 7.806 0.904 14 1 "[ . 1 +. 2 ]"
1 43 TYR 3.406 0.358 14 0 "[ . 1 . 2 ]"
1 44 MET 3.539 0.358 14 0 "[ . 1 . 2 ]"
1 45 GLY 5.596 0.323 2 0 "[ . 1 . 2 ]"
1 46 GLY 9.365 0.359 2 0 "[ . 1 . 2 ]"
1 47 LEU 14.135 0.514 18 1 "[ . 1 . + 2 ]"
1 48 GLN 4.281 0.603 19 2 "[ . 1 . +2- ]"
1 49 GLY 5.259 0.489 18 0 "[ . 1 . 2 ]"
1 50 LEU 12.302 0.603 19 3 "[ . 1 . *+2- ]"
1 51 ARG 14.959 0.752 21 8 "[ * **- 1 * * * 2+ ]"
1 52 ASN 18.143 0.682 15 6 "[ * **- 1 * + 2 ]"
1 53 ALA 4.348 0.578 18 1 "[ . 1 . + 2 ]"
1 54 SER 12.369 0.626 3 5 "[ + . - 1 ** * 2 ]"
1 55 VAL 5.980 0.195 8 0 "[ . 1 . 2 ]"
1 56 GLU 11.094 0.591 13 2 "[ . - 1 + . 2 ]"
1 57 GLU 6.451 0.296 14 0 "[ . 1 . 2 ]"
1 58 ILE 3.276 0.114 4 0 "[ . 1 . 2 ]"
1 59 ALA 4.537 0.564 12 1 "[ . 1 + . 2 ]"
1 60 LYS 8.002 0.564 12 1 "[ . 1 + . 2 ]"
1 61 VAL 5.012 0.184 14 0 "[ . 1 . 2 ]"
1 62 PRO 7.871 0.404 19 0 "[ . 1 . 2 ]"
1 63 GLY 2.828 0.404 19 0 "[ . 1 . 2 ]"
1 64 ILE 4.366 0.213 22 0 "[ . 1 . 2 ]"
1 65 SER 8.519 0.905 15 1 "[ . 1 + 2 ]"
1 66 GLN 3.568 0.325 12 0 "[ . 1 . 2 ]"
1 67 GLY 3.545 0.905 15 1 "[ . 1 + 2 ]"
1 68 LEU 8.767 0.204 3 0 "[ . 1 . 2 ]"
1 69 ALA 7.199 0.213 22 0 "[ . 1 . 2 ]"
1 70 GLU 4.890 0.517 19 1 "[ . 1 . +2 ]"
1 71 LYS 6.561 0.204 3 0 "[ . 1 . 2 ]"
1 72 ILE 3.715 0.165 13 0 "[ . 1 . 2 ]"
1 73 PHE 3.436 0.160 18 0 "[ . 1 . 2 ]"
1 74 TRP 1.035 0.112 18 0 "[ . 1 . 2 ]"
1 75 SER 0.729 0.159 21 0 "[ . 1 . 2 ]"
1 76 LEU 5.990 0.752 21 1 "[ . 1 . 2+ ]"
1 77 LYS 4.583 0.255 2 0 "[ . 1 . 2 ]"
1 78 HIS 0.700 0.141 3 0 "[ . 1 . 2 ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 23 THR H 1 23 THR HB 3.700 . 5.400 3.107 2.455 3.895 . 0 0 "[ . 1 . 2 ]" 1
2 1 23 THR H 1 23 THR HB 2.800 . 3.800 2.553 2.315 3.565 . 0 0 "[ . 1 . 2 ]" 1
3 1 23 THR HA 1 24 SER H 2.900 . 4.000 3.111 2.231 3.574 . 0 0 "[ . 1 . 2 ]" 1
4 1 23 THR HB 1 23 THR HG1 2.200 . 2.800 2.557 2.106 2.849 0.049 2 0 "[ . 1 . 2 ]" 1
5 1 23 THR HB 1 24 SER H 3.700 . 5.400 3.678 2.055 4.394 . 0 0 "[ . 1 . 2 ]" 1
6 1 24 SER H 1 24 SER HB2 2.800 . 3.800 2.964 2.447 3.698 . 0 0 "[ . 1 . 2 ]" 1
7 1 24 SER H 1 24 SER QB 2.900 . 4.000 2.801 2.411 3.349 . 0 0 "[ . 1 . 2 ]" 1
8 1 24 SER H 1 24 SER HB3 2.800 . 3.800 3.639 2.757 3.932 0.132 20 0 "[ . 1 . 2 ]" 1
9 1 24 SER HA 1 24 SER HB2 2.700 . 3.600 2.966 2.622 3.030 . 0 0 "[ . 1 . 2 ]" 1
10 1 24 SER HA 1 24 SER HB3 2.700 . 3.600 2.343 2.227 2.486 . 0 0 "[ . 1 . 2 ]" 1
11 1 24 SER HB2 1 25 SER QB 3.500 . 5.100 5.161 4.023 5.802 0.702 1 3 "[+ . 1 *- 2 ]" 1
12 1 24 SER HB3 1 25 SER H 3.300 . 4.700 3.035 2.072 4.571 . 0 0 "[ . 1 . 2 ]" 1
13 1 25 SER H 1 25 SER HA 2.900 . 3.900 2.763 2.281 2.949 . 0 0 "[ . 1 . 2 ]" 1
14 1 25 SER H 1 25 SER QB 2.900 . 3.900 2.894 2.403 3.448 . 0 0 "[ . 1 . 2 ]" 1
15 1 25 SER H 1 26 LEU HA 2.600 . 3.400 3.320 3.147 3.506 0.106 15 0 "[ . 1 . 2 ]" 1
16 1 25 SER HA 1 25 SER QB 2.400 . 3.100 2.280 2.155 2.370 . 0 0 "[ . 1 . 2 ]" 1
17 1 25 SER HA 1 26 LEU H 2.800 . 3.800 2.887 2.221 3.453 . 0 0 "[ . 1 . 2 ]" 1
18 1 25 SER QB 1 26 LEU H 3.100 . 4.300 3.700 2.910 3.972 . 0 0 "[ . 1 . 2 ]" 1
19 1 25 SER QB 1 29 ILE HA 3.200 . 4.500 3.393 1.845 4.674 0.174 13 0 "[ . 1 . 2 ]" 1
20 1 26 LEU H 1 26 LEU HB2 2.400 . 3.100 2.315 1.923 2.628 . 0 0 "[ . 1 . 2 ]" 1
21 1 26 LEU H 1 26 LEU HA 3.000 . 4.200 2.773 2.699 2.928 . 0 0 "[ . 1 . 2 ]" 1
22 1 26 LEU H 1 26 LEU QB 2.600 . 3.400 2.361 2.172 2.655 . 0 0 "[ . 1 . 2 ]" 1
23 1 26 LEU H 1 26 LEU HG 3.100 . 4.300 3.478 1.900 4.291 0.000 1 0 "[ . 1 . 2 ]" 1
24 1 26 LEU H 1 27 GLU QB 3.600 . 5.300 4.959 4.444 5.329 0.029 21 0 "[ . 1 . 2 ]" 1
25 1 26 LEU HA 1 26 LEU QB 2.300 . 3.000 2.431 2.290 2.498 . 0 0 "[ . 1 . 2 ]" 1
26 1 26 LEU HA 1 27 GLU H 2.800 . 3.800 3.424 3.168 3.559 . 0 0 "[ . 1 . 2 ]" 1
27 1 26 LEU HA 1 28 THR H 3.000 . 4.200 3.973 3.268 4.304 0.104 10 0 "[ . 1 . 2 ]" 1
28 1 26 LEU HA 1 29 ILE H 3.300 . 4.600 3.703 2.797 4.547 . 0 0 "[ . 1 . 2 ]" 1
29 1 26 LEU QB 1 27 GLU H 2.900 . 4.000 2.862 1.813 3.525 . 0 0 "[ . 1 . 2 ]" 1
30 1 26 LEU QB 1 28 THR H 4.000 . 6.000 4.520 3.523 5.333 . 0 0 "[ . 1 . 2 ]" 1
31 1 26 LEU QB 1 29 ILE H 4.000 . 6.000 5.028 4.369 5.788 . 0 0 "[ . 1 . 2 ]" 1
32 1 26 LEU QB 1 29 ILE H 3.200 . 4.500 4.440 4.091 4.657 0.157 9 0 "[ . 1 . 2 ]" 1
33 1 27 GLU H 1 27 GLU HB2 3.100 . 4.300 3.516 2.878 3.686 . 0 0 "[ . 1 . 2 ]" 1
34 1 27 GLU H 1 27 GLU HB3 2.400 . 3.100 2.806 2.130 3.603 0.503 21 1 "[ . 1 . 2+ ]" 1
35 1 27 GLU H 1 27 GLU HG2 2.800 . 3.800 2.353 1.687 3.895 0.113 2 0 "[ . 1 . 2 ]" 1
36 1 27 GLU H 1 28 THR H 2.800 . 3.800 2.381 1.971 2.955 . 0 0 "[ . 1 . 2 ]" 1
37 1 27 GLU H 1 28 THR HA 2.600 . 6.000 5.020 4.722 5.360 . 0 0 "[ . 1 . 2 ]" 1
38 1 27 GLU HA 1 27 GLU HB3 2.100 . 2.600 2.076 1.869 2.222 . 0 0 "[ . 1 . 2 ]" 1
39 1 27 GLU HA 1 27 GLU HG2 2.900 . 4.000 3.671 3.040 3.999 . 0 0 "[ . 1 . 2 ]" 1
40 1 27 GLU HA 1 27 GLU HG3 3.000 . 4.100 3.858 3.015 4.223 0.123 16 0 "[ . 1 . 2 ]" 1
41 1 27 GLU HA 1 28 THR H 2.900 . 4.000 3.398 3.291 3.532 . 0 0 "[ . 1 . 2 ]" 1
42 1 27 GLU QB 1 28 THR H 3.200 . 4.500 3.511 2.055 3.833 . 0 0 "[ . 1 . 2 ]" 1
43 1 27 GLU HB2 1 27 GLU HG2 2.500 . 3.300 2.815 2.362 3.008 . 0 0 "[ . 1 . 2 ]" 1
44 1 27 GLU HB2 1 27 GLU HG3 2.200 . 2.800 2.411 2.201 2.729 . 0 0 "[ . 1 . 2 ]" 1
45 1 27 GLU HB3 1 27 GLU HG2 2.600 . 3.500 2.641 2.232 2.999 . 0 0 "[ . 1 . 2 ]" 1
46 1 27 GLU HB3 1 27 GLU HG3 2.600 . 3.400 2.810 2.366 3.009 . 0 0 "[ . 1 . 2 ]" 1
47 1 27 GLU HB3 1 29 ILE H 3.900 . 5.800 5.629 4.995 6.050 0.250 2 0 "[ . 1 . 2 ]" 1
48 1 27 GLU QG 1 28 THR H 3.800 . 5.600 2.658 2.022 3.543 . 0 0 "[ . 1 . 2 ]" 1
49 1 27 GLU HG2 1 29 ILE H 3.800 . 5.600 4.817 3.706 5.649 0.049 19 0 "[ . 1 . 2 ]" 1
50 1 27 GLU HG3 1 28 THR H 3.000 . 4.100 3.456 2.152 4.352 0.252 2 0 "[ . 1 . 2 ]" 1
51 1 28 THR H 1 28 THR HA 2.500 . 3.300 2.902 2.659 2.944 . 0 0 "[ . 1 . 2 ]" 1
52 1 28 THR H 1 28 THR HA 3.100 . 4.300 2.768 2.536 2.852 . 0 0 "[ . 1 . 2 ]" 1
53 1 28 THR H 1 28 THR HB 3.700 . 5.500 3.044 2.641 3.801 . 0 0 "[ . 1 . 2 ]" 1
54 1 28 THR H 1 28 THR HG1 2.900 . 6.000 3.127 1.961 4.515 . 0 0 "[ . 1 . 2 ]" 1
55 1 28 THR H 1 29 ILE HA 4.100 . 6.000 4.280 3.887 4.941 . 0 0 "[ . 1 . 2 ]" 1
56 1 28 THR H 1 29 ILE HB 3.500 . 5.100 4.924 3.555 5.311 0.211 21 0 "[ . 1 . 2 ]" 1
57 1 28 THR HA 1 28 THR HG1 2.200 . 2.800 2.612 2.207 2.900 0.100 5 0 "[ . 1 . 2 ]" 1
58 1 28 THR HA 1 29 ILE H 2.500 . 3.300 3.101 2.667 3.433 0.133 6 0 "[ . 1 . 2 ]" 1
59 1 28 THR HA 1 29 ILE HA 2.400 . 6.000 4.808 4.687 4.899 . 0 0 "[ . 1 . 2 ]" 1
60 1 28 THR HB 1 28 THR HG1 2.400 . 3.100 2.748 2.506 2.860 . 0 0 "[ . 1 . 2 ]" 1
61 1 28 THR HG1 1 29 ILE H 3.100 . 4.300 4.315 3.958 4.452 0.152 10 0 "[ . 1 . 2 ]" 1
62 1 29 ILE H 1 29 ILE HA 2.700 . 3.600 2.757 2.712 2.816 . 0 0 "[ . 1 . 2 ]" 1
63 1 29 ILE H 1 29 ILE HB 2.400 . 3.100 2.908 2.365 3.479 0.379 12 0 "[ . 1 . 2 ]" 1
64 1 29 ILE H 1 29 ILE HG13 2.200 . 2.800 2.233 1.672 3.349 0.549 18 1 "[ . 1 . + 2 ]" 1
65 1 29 ILE H 1 30 GLU H 3.700 . 5.400 4.411 3.867 4.634 . 0 0 "[ . 1 . 2 ]" 1
66 1 29 ILE HA 1 29 ILE HB 2.600 . 3.500 2.900 2.487 3.015 . 0 0 "[ . 1 . 2 ]" 1
67 1 29 ILE HA 1 29 ILE HG13 2.800 . 3.800 3.277 2.181 3.952 0.152 18 0 "[ . 1 . 2 ]" 1
68 1 29 ILE HA 1 30 GLU H 2.200 . 2.800 2.309 2.057 2.715 . 0 0 "[ . 1 . 2 ]" 1
69 1 29 ILE HA 1 30 GLU H 2.000 . 2.500 2.168 1.943 2.416 . 0 0 "[ . 1 . 2 ]" 1
70 1 29 ILE HB 1 29 ILE HG13 2.900 . 3.900 2.501 2.254 2.978 . 0 0 "[ . 1 . 2 ]" 1
71 1 29 ILE HB 1 30 GLU H 3.200 . 4.500 3.506 2.486 4.437 . 0 0 "[ . 1 . 2 ]" 1
72 1 29 ILE HB 1 30 GLU QG 2.900 . 4.000 3.822 3.104 4.148 0.148 18 0 "[ . 1 . 2 ]" 1
73 1 29 ILE HG13 1 32 VAL H 3.500 . 5.000 4.426 2.305 6.398 1.398 4 2 "[ +. - 1 . 2 ]" 1
74 1 30 GLU H 1 30 GLU HA 2.200 . 2.800 2.703 2.278 2.900 0.100 18 0 "[ . 1 . 2 ]" 1
75 1 30 GLU H 1 30 GLU QB 2.200 . 2.800 2.718 2.459 2.986 0.186 13 0 "[ . 1 . 2 ]" 1
76 1 30 GLU H 1 30 GLU HB3 2.600 . 3.400 3.084 2.503 3.978 0.578 20 3 "[ .- * 1 . + ]" 1
77 1 30 GLU H 1 30 GLU QG 2.800 . 3.800 2.450 1.780 3.286 0.120 17 0 "[ . 1 . 2 ]" 1
78 1 30 GLU HA 1 30 GLU QB 2.200 . 2.800 2.227 2.153 2.489 . 0 0 "[ . 1 . 2 ]" 1
79 1 30 GLU HA 1 30 GLU QG 2.800 . 3.800 3.148 2.369 3.480 . 0 0 "[ . 1 . 2 ]" 1
80 1 30 GLU HA 1 31 GLY H 2.300 . 2.900 2.729 2.156 3.308 0.408 11 0 "[ . 1 . 2 ]" 1
81 1 30 GLU HA 1 32 VAL H 3.400 . 4.800 4.225 3.464 4.947 0.147 16 0 "[ . 1 . 2 ]" 1
82 1 30 GLU QB 1 31 GLY H 3.100 . 4.300 3.841 3.562 4.053 . 0 0 "[ . 1 . 2 ]" 1
83 1 30 GLU QB 1 32 VAL H 3.900 . 5.800 4.965 3.777 5.605 . 0 0 "[ . 1 . 2 ]" 1
84 1 30 GLU QG 1 31 GLY H 3.800 . 4.800 3.983 2.379 4.820 0.020 20 0 "[ . 1 . 2 ]" 1
85 1 31 GLY H 1 31 GLY HA2 2.600 . 3.500 2.596 2.282 2.944 . 0 0 "[ . 1 . 2 ]" 1
86 1 31 GLY H 1 31 GLY QA 2.500 . 3.300 2.360 2.183 2.506 . 0 0 "[ . 1 . 2 ]" 1
87 1 31 GLY H 1 32 VAL H 3.300 . 4.600 2.243 1.879 2.796 0.121 9 0 "[ . 1 . 2 ]" 1
88 1 31 GLY QA 1 32 VAL H 3.000 . 4.200 2.729 2.511 2.956 . 0 0 "[ . 1 . 2 ]" 1
89 1 31 GLY HA2 1 32 VAL H 3.200 . 4.500 3.049 2.631 3.524 . 0 0 "[ . 1 . 2 ]" 1
90 1 31 GLY HA2 1 33 GLY H 4.100 . 6.000 5.950 4.596 6.289 0.289 13 0 "[ . 1 . 2 ]" 1
91 1 31 GLY HA3 1 32 VAL H 3.200 . 4.500 3.279 2.576 3.536 . 0 0 "[ . 1 . 2 ]" 1
92 1 32 VAL H 1 32 VAL HA 2.600 . 3.500 2.776 2.276 2.931 . 0 0 "[ . 1 . 2 ]" 1
93 1 32 VAL H 1 32 VAL HB 2.600 . 3.500 3.157 2.041 3.731 0.231 18 0 "[ . 1 . 2 ]" 1
94 1 32 VAL H 1 33 GLY H 3.000 . 6.000 4.235 2.242 4.568 . 0 0 "[ . 1 . 2 ]" 1
95 1 32 VAL H 1 36 ARG HB2 4.100 . 6.000 5.602 4.424 6.188 0.188 21 0 "[ . 1 . 2 ]" 1
96 1 32 VAL H 1 36 ARG QD 4.300 . 6.000 5.075 3.441 5.871 . 0 0 "[ . 1 . 2 ]" 1
97 1 32 VAL HA 1 33 GLY H 2.700 . 3.600 2.493 1.987 3.571 . 0 0 "[ . 1 . 2 ]" 1
98 1 32 VAL HA 1 34 PRO HB2 2.400 . 6.000 5.748 4.814 6.114 0.114 14 0 "[ . 1 . 2 ]" 1
99 1 32 VAL HA 1 34 PRO HB3 2.600 . 6.000 6.107 5.971 6.233 0.233 22 0 "[ . 1 . 2 ]" 1
100 1 32 VAL HA 1 36 ARG QG 2.100 . 2.600 2.014 1.607 2.255 . 0 0 "[ . 1 . 2 ]" 1
101 1 32 VAL HB 1 33 GLY H 2.800 . 3.800 3.068 1.678 4.025 0.225 4 0 "[ . 1 . 2 ]" 1
102 1 33 GLY H 1 33 GLY HA2 3.000 . 4.200 2.607 2.441 2.799 . 0 0 "[ . 1 . 2 ]" 1
103 1 33 GLY H 1 33 GLY QA 2.500 . 3.300 2.398 2.177 2.494 . 0 0 "[ . 1 . 2 ]" 1
104 1 33 GLY H 1 36 ARG HB2 3.600 . 5.200 4.142 2.336 5.306 0.106 22 0 "[ . 1 . 2 ]" 1
105 1 33 GLY H 1 36 ARG HB2 2.700 . 3.600 2.936 2.298 3.958 0.358 17 0 "[ . 1 . 2 ]" 1
106 1 33 GLY H 1 36 ARG HB3 3.400 . 4.900 3.117 1.930 4.541 . 0 0 "[ . 1 . 2 ]" 1
107 1 33 GLY H 1 36 ARG QD 3.800 . 5.600 4.941 4.038 5.224 . 0 0 "[ . 1 . 2 ]" 1
108 1 33 GLY HA2 1 34 PRO HD2 2.600 . 6.000 3.641 3.546 3.835 . 0 0 "[ . 1 . 2 ]" 1
109 1 33 GLY HA2 1 34 PRO HD3 2.700 . 6.000 4.304 3.907 4.555 . 0 0 "[ . 1 . 2 ]" 1
110 1 33 GLY HA3 1 34 PRO HD2 2.600 . 3.400 2.930 2.524 3.431 0.031 5 0 "[ . 1 . 2 ]" 1
111 1 33 GLY HA3 1 34 PRO HD3 2.600 . 3.400 3.034 2.492 3.396 . 0 0 "[ . 1 . 2 ]" 1
112 1 34 PRO HA 1 35 LYS H 3.800 . 5.600 3.530 3.408 3.576 . 0 0 "[ . 1 . 2 ]" 1
113 1 34 PRO HB2 1 34 PRO HG2 2.300 . 3.000 2.290 2.235 2.333 . 0 0 "[ . 1 . 2 ]" 1
114 1 34 PRO HB2 1 34 PRO HG3 2.200 . 2.800 2.737 2.644 2.938 0.138 22 0 "[ . 1 . 2 ]" 1
115 1 34 PRO HB2 1 35 LYS H 2.400 . 3.100 2.486 1.701 3.119 0.019 1 0 "[ . 1 . 2 ]" 1
116 1 34 PRO QD 1 35 LYS H 3.300 . 4.700 3.279 2.269 3.711 . 0 0 "[ . 1 . 2 ]" 1
117 1 34 PRO HD2 1 34 PRO HG2 2.400 . 3.100 2.302 2.251 2.359 . 0 0 "[ . 1 . 2 ]" 1
118 1 34 PRO HD2 1 34 PRO HG3 2.800 . 3.800 2.700 2.605 2.916 . 0 0 "[ . 1 . 2 ]" 1
119 1 34 PRO HD2 1 37 ARG HG2 3.000 . 6.000 5.157 4.304 6.152 0.152 13 0 "[ . 1 . 2 ]" 1
120 1 34 PRO HD2 1 37 ARG HG3 3.200 . 6.000 5.398 4.504 6.061 0.061 1 0 "[ . 1 . 2 ]" 1
121 1 34 PRO HD3 1 34 PRO HG2 2.900 . 3.900 2.972 2.787 3.025 . 0 0 "[ . 1 . 2 ]" 1
122 1 34 PRO HD3 1 34 PRO HG3 2.700 . 3.600 2.312 2.261 2.375 . 0 0 "[ . 1 . 2 ]" 1
123 1 34 PRO HG2 1 35 LYS H 3.100 . 4.300 2.549 1.841 3.750 0.059 6 0 "[ . 1 . 2 ]" 1
124 1 34 PRO HG2 1 36 ARG HA 2.800 . 6.000 5.444 4.065 6.136 0.136 20 0 "[ . 1 . 2 ]" 1
125 1 35 LYS H 1 35 LYS HA 3.000 . 4.100 2.868 2.704 2.948 . 0 0 "[ . 1 . 2 ]" 1
126 1 35 LYS H 1 35 LYS HB2 3.400 . 4.800 3.441 2.625 4.111 . 0 0 "[ . 1 . 2 ]" 1
127 1 35 LYS H 1 35 LYS QD 3.300 . 4.700 3.964 1.999 4.789 0.089 11 0 "[ . 1 . 2 ]" 1
128 1 35 LYS H 1 36 ARG HB3 2.800 . 3.800 3.752 2.999 4.543 0.743 10 3 "[- . + *. 2 ]" 1
129 1 35 LYS HA 1 35 LYS HB2 2.700 . 3.600 2.720 2.370 3.026 . 0 0 "[ . 1 . 2 ]" 1
130 1 35 LYS HA 1 35 LYS HB3 2.300 . 2.900 2.448 2.248 3.014 0.114 13 0 "[ . 1 . 2 ]" 1
131 1 35 LYS HA 1 35 LYS HD2 3.500 . 5.000 4.102 2.064 5.459 0.459 22 0 "[ . 1 . 2 ]" 1
132 1 35 LYS HA 1 36 ARG H 2.800 . 3.800 3.419 3.223 3.598 . 0 0 "[ . 1 . 2 ]" 1
133 1 35 LYS HA 1 38 GLN H 3.400 . 4.900 3.196 2.865 3.568 . 0 0 "[ . 1 . 2 ]" 1
134 1 35 LYS HA 1 38 GLN H 2.500 . 3.300 2.858 2.662 3.036 . 0 0 "[ . 1 . 2 ]" 1
135 1 35 LYS HA 1 38 GLN QB 2.900 . 3.900 2.164 1.844 2.804 0.056 13 0 "[ . 1 . 2 ]" 1
136 1 35 LYS QB 1 36 ARG H 2.600 . 3.400 3.249 2.499 3.629 0.229 9 0 "[ . 1 . 2 ]" 1
137 1 35 LYS HB2 1 35 LYS HD2 2.800 . 3.800 3.130 2.297 3.770 . 0 0 "[ . 1 . 2 ]" 1
138 1 35 LYS HB2 1 38 GLN QB 3.200 . 4.400 3.844 2.731 4.473 0.073 21 0 "[ . 1 . 2 ]" 1
139 1 35 LYS HB3 1 35 LYS HD2 2.800 . 3.800 3.185 2.348 4.173 0.373 21 0 "[ . 1 . 2 ]" 1
140 1 35 LYS HB3 1 38 GLN QB 2.900 . 3.900 3.710 2.847 4.409 0.509 17 1 "[ . 1 . + 2 ]" 1
141 1 35 LYS HD2 1 35 LYS QG 2.600 . 3.400 2.322 2.163 2.477 . 0 0 "[ . 1 . 2 ]" 1
142 1 35 LYS HD2 1 36 ARG H 3.500 . 5.100 4.552 1.500 6.091 0.991 2 2 "[ + -. 1 . 2 ]" 1
143 1 35 LYS HD3 1 35 LYS QG 2.000 . 2.500 2.308 2.146 2.412 . 0 0 "[ . 1 . 2 ]" 1
144 1 35 LYS QE 1 35 LYS QG 2.300 . 3.000 2.330 2.113 2.936 . 0 0 "[ . 1 . 2 ]" 1
145 1 35 LYS QG 1 36 ARG H 3.300 . 4.700 3.328 2.008 4.592 . 0 0 "[ . 1 . 2 ]" 1
146 1 36 ARG H 1 36 ARG HA 2.500 . 3.300 2.692 2.650 2.745 . 0 0 "[ . 1 . 2 ]" 1
147 1 36 ARG H 1 36 ARG HB2 2.400 . 3.100 2.523 2.013 3.264 0.164 22 0 "[ . 1 . 2 ]" 1
148 1 36 ARG H 1 36 ARG HB3 2.100 . 2.700 2.485 1.892 3.197 0.497 14 0 "[ . 1 . 2 ]" 1
149 1 36 ARG H 1 36 ARG QD 3.700 . 5.400 4.471 3.536 4.794 . 0 0 "[ . 1 . 2 ]" 1
150 1 36 ARG H 1 36 ARG QG 2.600 . 3.600 3.697 3.222 3.912 0.312 19 0 "[ . 1 . 2 ]" 1
151 1 36 ARG H 1 37 ARG H 2.700 . 3.600 3.007 2.840 3.185 . 0 0 "[ . 1 . 2 ]" 1
152 1 36 ARG H 1 37 ARG HA 3.900 . 5.800 5.507 5.410 5.624 . 0 0 "[ . 1 . 2 ]" 1
153 1 36 ARG H 1 38 GLN QB 3.600 . 5.200 4.550 3.868 5.214 0.014 22 0 "[ . 1 . 2 ]" 1
154 1 36 ARG H 1 38 GLN QB 3.000 . 4.200 3.832 3.531 4.083 . 0 0 "[ . 1 . 2 ]" 1
155 1 36 ARG HA 1 36 ARG HB2 2.300 . 3.000 2.429 2.208 2.759 . 0 0 "[ . 1 . 2 ]" 1
156 1 36 ARG HA 1 36 ARG HB3 2.300 . 3.000 2.936 2.716 3.013 0.013 15 0 "[ . 1 . 2 ]" 1
157 1 36 ARG HA 1 36 ARG QD 2.800 . 3.800 3.213 2.166 3.777 . 0 0 "[ . 1 . 2 ]" 1
158 1 36 ARG HA 1 36 ARG QG 3.100 . 3.800 2.645 1.980 3.297 . 0 0 "[ . 1 . 2 ]" 1
159 1 36 ARG HA 1 37 ARG H 2.900 . 4.000 3.548 3.486 3.594 . 0 0 "[ . 1 . 2 ]" 1
160 1 36 ARG HA 1 39 MET H 2.800 . 3.800 3.515 3.117 3.844 0.044 20 0 "[ . 1 . 2 ]" 1
161 1 36 ARG HA 1 39 MET HG2 3.400 . 4.800 3.911 3.330 4.833 0.033 6 0 "[ . 1 . 2 ]" 1
162 1 36 ARG HB2 1 36 ARG QD 3.200 . 4.500 2.678 2.092 3.210 . 0 0 "[ . 1 . 2 ]" 1
163 1 36 ARG HB3 1 36 ARG QD 2.500 . 3.300 2.860 1.965 3.562 0.262 19 0 "[ . 1 . 2 ]" 1
164 1 36 ARG HB3 1 39 MET H 3.100 . 6.000 5.321 4.950 5.635 . 0 0 "[ . 1 . 2 ]" 1
165 1 36 ARG QD 1 40 LEU H 4.300 . 6.000 5.586 4.841 5.925 . 0 0 "[ . 1 . 2 ]" 1
166 1 36 ARG QG 1 38 GLN H 2.300 . 6.000 4.955 4.105 5.904 . 0 0 "[ . 1 . 2 ]" 1
167 1 36 ARG QG 1 39 MET H 3.500 . 5.000 4.825 4.432 4.946 . 0 0 "[ . 1 . 2 ]" 1
168 1 37 ARG H 1 37 ARG HA 2.700 . 3.600 2.815 2.758 2.903 . 0 0 "[ . 1 . 2 ]" 1
169 1 37 ARG H 1 37 ARG HA 2.400 . 3.100 2.453 2.372 2.520 . 0 0 "[ . 1 . 2 ]" 1
170 1 37 ARG H 1 37 ARG QB 2.300 . 3.000 2.498 2.275 2.960 . 0 0 "[ . 1 . 2 ]" 1
171 1 37 ARG H 1 37 ARG QD 3.600 . 5.200 3.400 1.659 4.207 0.341 13 0 "[ . 1 . 2 ]" 1
172 1 37 ARG H 1 37 ARG HG2 2.600 . 3.500 2.478 1.896 3.300 . 0 0 "[ . 1 . 2 ]" 1
173 1 37 ARG H 1 37 ARG QG 2.900 . 4.000 2.183 1.732 2.523 0.068 17 0 "[ . 1 . 2 ]" 1
174 1 37 ARG H 1 37 ARG HG3 2.800 . 3.800 3.181 1.739 3.728 0.061 17 0 "[ . 1 . 2 ]" 1
175 1 37 ARG H 1 38 GLN H 2.700 . 3.600 2.557 2.132 2.755 . 0 0 "[ . 1 . 2 ]" 1
176 1 37 ARG H 1 38 GLN QB 3.300 . 4.700 4.243 3.739 4.596 . 0 0 "[ . 1 . 2 ]" 1
177 1 37 ARG HA 1 37 ARG QB 2.400 . 3.100 2.345 2.125 2.455 . 0 0 "[ . 1 . 2 ]" 1
178 1 37 ARG HA 1 37 ARG HB3 2.100 . 2.700 2.453 2.203 2.603 . 0 0 "[ . 1 . 2 ]" 1
179 1 37 ARG HA 1 37 ARG HG2 2.500 . 3.300 3.025 2.502 4.030 0.730 17 4 "[ . ** - . + 2 ]" 1
180 1 37 ARG HA 1 37 ARG HG2 2.400 . 3.100 2.860 2.454 3.794 0.694 9 2 "[ . +1 . - 2 ]" 1
181 1 37 ARG HA 1 37 ARG HG3 2.800 . 3.800 3.633 2.981 3.825 0.025 8 0 "[ . 1 . 2 ]" 1
182 1 37 ARG HA 1 38 GLN H 2.800 . 3.800 3.488 3.357 3.540 . 0 0 "[ . 1 . 2 ]" 1
183 1 37 ARG HA 1 39 MET H 3.900 . 5.800 4.087 3.427 4.487 . 0 0 "[ . 1 . 2 ]" 1
184 1 37 ARG HA 1 40 LEU H 2.800 . 3.800 3.670 3.299 3.883 0.083 9 0 "[ . 1 . 2 ]" 1
185 1 37 ARG QB 1 38 GLN H 2.600 . 3.500 2.638 2.391 3.073 . 0 0 "[ . 1 . 2 ]" 1
186 1 37 ARG HB2 1 37 ARG QD 2.700 . 3.600 3.260 2.439 3.494 . 0 0 "[ . 1 . 2 ]" 1
187 1 37 ARG HB2 1 37 ARG HG2 2.900 . 3.900 2.556 2.424 2.673 . 0 0 "[ . 1 . 2 ]" 1
188 1 37 ARG HB2 1 37 ARG HG3 3.000 . 4.100 2.444 2.231 3.005 . 0 0 "[ . 1 . 2 ]" 1
189 1 37 ARG HB2 1 38 GLN H 2.400 . 3.100 2.701 2.446 3.159 0.059 17 0 "[ . 1 . 2 ]" 1
190 1 37 ARG QD 1 37 ARG HG2 2.500 . 3.300 2.241 2.134 2.519 . 0 0 "[ . 1 . 2 ]" 1
191 1 37 ARG QD 1 38 GLN H 3.500 . 5.100 4.432 2.006 5.161 0.061 14 0 "[ . 1 . 2 ]" 1
192 1 37 ARG QD 1 40 LEU H 4.200 . 6.000 5.477 5.072 5.886 . 0 0 "[ . 1 . 2 ]" 1
193 1 37 ARG HG2 1 38 GLN H 3.200 . 4.500 4.344 3.781 4.693 0.193 13 0 "[ . 1 . 2 ]" 1
194 1 37 ARG HG3 1 38 GLN H 3.400 . 4.800 4.641 3.783 4.955 0.155 21 0 "[ . 1 . 2 ]" 1
195 1 38 GLN H 1 38 GLN HA 2.400 . 3.100 2.786 2.718 2.859 . 0 0 "[ . 1 . 2 ]" 1
196 1 38 GLN H 1 38 GLN QB 2.000 . 2.500 2.108 1.982 2.389 . 0 0 "[ . 1 . 2 ]" 1
197 1 38 GLN H 1 38 GLN HG2 2.700 . 3.600 3.783 3.002 4.335 0.735 7 10 "[** ***+ *1 ** .- 2 ]" 1
198 1 38 GLN H 1 38 GLN QG 2.800 . 3.800 3.109 2.298 3.439 . 0 0 "[ . 1 . 2 ]" 1
199 1 38 GLN H 1 38 GLN HG3 3.000 . 4.200 3.601 2.323 4.297 0.097 8 0 "[ . 1 . 2 ]" 1
200 1 38 GLN H 1 39 MET H 2.300 . 3.000 2.650 2.283 2.866 . 0 0 "[ . 1 . 2 ]" 1
201 1 38 GLN HA 1 38 GLN QB 2.100 . 2.700 2.409 2.151 2.538 . 0 0 "[ . 1 . 2 ]" 1
202 1 38 GLN HA 1 38 GLN HG3 2.700 . 3.600 2.888 2.313 3.566 . 0 0 "[ . 1 . 2 ]" 1
203 1 38 GLN HA 1 41 LEU H 3.300 . 4.700 3.243 2.692 3.869 . 0 0 "[ . 1 . 2 ]" 1
204 1 38 GLN HA 1 41 LEU HB2 2.500 . 3.300 2.474 2.075 3.032 . 0 0 "[ . 1 . 2 ]" 1
205 1 38 GLN HA 1 42 LYS H 3.000 . 4.100 3.956 3.350 4.242 0.142 21 0 "[ . 1 . 2 ]" 1
206 1 38 GLN QB 1 38 GLN HG2 2.300 . 2.900 2.313 2.115 2.414 . 0 0 "[ . 1 . 2 ]" 1
207 1 38 GLN QB 1 38 GLN HG3 2.400 . 3.100 2.322 2.139 2.453 . 0 0 "[ . 1 . 2 ]" 1
208 1 38 GLN QB 1 39 MET H 2.700 . 3.600 2.880 2.565 3.333 . 0 0 "[ . 1 . 2 ]" 1
209 1 38 GLN HE21 1 38 GLN HG2 4.400 . 6.000 2.862 2.190 3.492 . 0 0 "[ . 1 . 2 ]" 1
210 1 38 GLN QG 1 39 MET H 3.400 . 4.900 3.818 2.026 4.560 . 0 0 "[ . 1 . 2 ]" 1
211 1 38 GLN HG2 1 42 LYS H 4.300 . 6.000 5.142 4.401 6.221 0.221 3 0 "[ . 1 . 2 ]" 1
212 1 38 GLN HG3 1 39 MET H 3.500 . 5.100 4.522 3.056 5.261 0.161 11 0 "[ . 1 . 2 ]" 1
213 1 38 GLN HG3 1 42 LYS H 4.300 . 6.000 5.447 3.403 6.150 0.150 20 0 "[ . 1 . 2 ]" 1
214 1 39 MET H 1 39 MET HA 2.500 . 3.300 2.743 2.694 2.807 . 0 0 "[ . 1 . 2 ]" 1
215 1 39 MET H 1 39 MET HB2 3.000 . 4.100 2.570 2.295 2.749 . 0 0 "[ . 1 . 2 ]" 1
216 1 39 MET H 1 39 MET QB 2.300 . 2.900 2.516 2.268 2.666 . 0 0 "[ . 1 . 2 ]" 1
217 1 39 MET H 1 39 MET HB3 2.700 . 3.600 3.597 3.545 3.636 0.036 11 0 "[ . 1 . 2 ]" 1
218 1 39 MET H 1 39 MET HG2 2.600 . 3.400 3.278 2.542 3.530 0.130 9 0 "[ . 1 . 2 ]" 1
219 1 39 MET H 1 39 MET HG3 2.000 . 2.500 2.151 1.822 3.410 0.910 20 1 "[ . 1 . + ]" 1
220 1 39 MET H 1 40 LEU H 2.500 . 3.300 2.878 2.560 3.095 . 0 0 "[ . 1 . 2 ]" 1
221 1 39 MET HA 1 39 MET HB2 3.000 . 4.100 3.022 2.962 3.032 . 0 0 "[ . 1 . 2 ]" 1
222 1 39 MET HA 1 39 MET HB3 2.800 . 3.800 2.487 2.416 2.567 . 0 0 "[ . 1 . 2 ]" 1
223 1 39 MET HA 1 39 MET HG2 2.400 . 3.100 2.576 2.276 2.862 . 0 0 "[ . 1 . 2 ]" 1
224 1 39 MET HA 1 39 MET HG3 2.400 . 3.100 3.043 2.671 3.531 0.431 20 0 "[ . 1 . 2 ]" 1
225 1 39 MET HA 1 40 LEU H 3.200 . 4.500 3.543 3.482 3.576 . 0 0 "[ . 1 . 2 ]" 1
226 1 39 MET HA 1 40 LEU H 2.800 . 3.800 3.433 3.383 3.482 . 0 0 "[ . 1 . 2 ]" 1
227 1 39 MET HA 1 42 LYS H 2.700 . 3.600 3.331 2.969 3.703 0.103 18 0 "[ . 1 . 2 ]" 1
228 1 39 MET HA 1 42 LYS HB2 2.100 . 2.600 2.406 1.828 3.504 0.904 14 1 "[ . 1 +. 2 ]" 1
229 1 39 MET HA 1 43 TYR H 3.000 . 4.100 4.064 3.901 4.201 0.101 19 0 "[ . 1 . 2 ]" 1
230 1 39 MET HA 1 43 TYR QD 3.000 . 4.100 3.355 2.522 4.157 0.057 22 0 "[ . 1 . 2 ]" 1
231 1 39 MET QB 1 39 MET HG2 2.200 . 2.800 2.324 2.219 2.450 . 0 0 "[ . 1 . 2 ]" 1
232 1 39 MET QB 1 39 MET HG3 2.200 . 2.800 2.346 2.120 2.453 . 0 0 "[ . 1 . 2 ]" 1
233 1 39 MET HB2 1 39 MET HG2 2.200 . 6.000 2.981 2.613 3.009 . 0 0 "[ . 1 . 2 ]" 1
234 1 39 MET HB2 1 39 MET HG3 2.200 . 2.800 2.458 2.247 2.613 . 0 0 "[ . 1 . 2 ]" 1
235 1 39 MET HB2 1 40 LEU H 2.700 . 3.600 2.354 2.071 2.732 . 0 0 "[ . 1 . 2 ]" 1
236 1 39 MET HB2 1 42 LYS H 4.300 . 6.000 5.263 5.038 5.528 . 0 0 "[ . 1 . 2 ]" 1
237 1 39 MET HB3 1 39 MET HG2 2.300 . 2.900 2.439 2.291 2.961 0.061 20 0 "[ . 1 . 2 ]" 1
238 1 39 MET HB3 1 39 MET HG3 2.300 . 3.000 2.979 2.599 3.009 0.009 1 0 "[ . 1 . 2 ]" 1
239 1 39 MET HB3 1 40 LEU H 3.500 . 5.100 3.412 3.077 3.756 . 0 0 "[ . 1 . 2 ]" 1
240 1 39 MET HG2 1 40 LEU H 2.700 . 6.000 4.834 4.486 5.057 . 0 0 "[ . 1 . 2 ]" 1
241 1 39 MET HG3 1 40 LEU H 2.700 . 6.000 4.184 3.839 4.622 . 0 0 "[ . 1 . 2 ]" 1
242 1 40 LEU H 1 40 LEU HA 2.400 . 3.100 2.750 2.706 2.810 . 0 0 "[ . 1 . 2 ]" 1
243 1 40 LEU H 1 40 LEU HB2 2.400 . 3.100 2.534 2.383 2.812 . 0 0 "[ . 1 . 2 ]" 1
244 1 40 LEU H 1 40 LEU HB3 2.500 . 6.000 3.564 3.481 3.593 . 0 0 "[ . 1 . 2 ]" 1
245 1 40 LEU H 1 40 LEU HB3 2.100 . 2.700 2.461 2.299 2.619 . 0 0 "[ . 1 . 2 ]" 1
246 1 40 LEU H 1 40 LEU HG 2.700 . 3.600 3.346 1.762 3.726 0.126 10 0 "[ . 1 . 2 ]" 1
247 1 40 LEU H 1 41 LEU H 2.500 . 3.300 2.862 2.705 3.004 . 0 0 "[ . 1 . 2 ]" 1
248 1 40 LEU HA 1 40 LEU HB2 2.400 . 3.100 3.010 2.982 3.023 . 0 0 "[ . 1 . 2 ]" 1
249 1 40 LEU HA 1 40 LEU HB3 2.500 . 3.300 2.470 2.316 2.557 . 0 0 "[ . 1 . 2 ]" 1
250 1 40 LEU HA 1 40 LEU HG 2.700 . 3.600 3.573 2.983 3.748 0.148 19 0 "[ . 1 . 2 ]" 1
251 1 40 LEU HA 1 43 TYR H 4.100 . 6.000 3.283 3.049 3.607 . 0 0 "[ . 1 . 2 ]" 1
252 1 40 LEU HA 1 44 MET H 3.400 . 4.900 4.026 3.916 4.239 . 0 0 "[ . 1 . 2 ]" 1
253 1 40 LEU HB3 1 44 MET H 4.000 . 6.000 4.863 4.566 5.158 . 0 0 "[ . 1 . 2 ]" 1
254 1 41 LEU H 1 41 LEU HA 2.400 . 3.100 2.788 2.745 2.860 . 0 0 "[ . 1 . 2 ]" 1
255 1 41 LEU H 1 41 LEU HB2 2.200 . 2.800 2.206 2.068 2.437 . 0 0 "[ . 1 . 2 ]" 1
256 1 41 LEU H 1 41 LEU HG 2.600 . 6.000 3.726 3.492 4.286 . 0 0 "[ . 1 . 2 ]" 1
257 1 41 LEU H 1 42 LYS H 2.700 . 3.600 2.681 2.418 2.830 . 0 0 "[ . 1 . 2 ]" 1
258 1 41 LEU HA 1 41 LEU HB2 2.700 . 3.600 2.958 2.800 3.019 . 0 0 "[ . 1 . 2 ]" 1
259 1 41 LEU HA 1 41 LEU HB3 2.600 . 3.400 2.666 2.485 2.886 . 0 0 "[ . 1 . 2 ]" 1
260 1 41 LEU HA 1 41 LEU HG 2.900 . 3.900 3.501 2.186 3.735 . 0 0 "[ . 1 . 2 ]" 1
261 1 41 LEU HA 1 42 LYS H 2.800 . 3.800 3.498 3.439 3.558 . 0 0 "[ . 1 . 2 ]" 1
262 1 41 LEU HA 1 43 TYR H 4.400 . 6.000 3.910 3.341 4.180 . 0 0 "[ . 1 . 2 ]" 1
263 1 41 LEU HA 1 44 MET H 3.000 . 4.100 3.238 2.324 3.438 . 0 0 "[ . 1 . 2 ]" 1
264 1 41 LEU HA 1 46 GLY H 2.600 . 3.500 2.494 2.221 2.962 . 0 0 "[ . 1 . 2 ]" 1
265 1 41 LEU QB 1 42 LYS H 2.600 . 3.400 2.734 2.465 2.900 . 0 0 "[ . 1 . 2 ]" 1
266 1 41 LEU HB2 1 41 LEU HG 2.600 . 3.400 2.378 2.255 2.994 . 0 0 "[ . 1 . 2 ]" 1
267 1 41 LEU HB2 1 42 LYS H 2.300 . 3.000 2.920 2.743 3.081 0.081 14 0 "[ . 1 . 2 ]" 1
268 1 41 LEU HB2 1 42 LYS H 2.500 . 3.300 2.217 1.909 2.986 . 0 0 "[ . 1 . 2 ]" 1
269 1 41 LEU HB2 1 43 TYR H 3.100 . 4.300 4.108 3.961 4.287 . 0 0 "[ . 1 . 2 ]" 1
270 1 41 LEU HB2 1 47 LEU H 3.900 . 5.800 5.588 5.055 5.832 0.032 14 0 "[ . 1 . 2 ]" 1
271 1 41 LEU HB3 1 41 LEU HG 2.800 . 3.800 2.599 2.443 2.713 . 0 0 "[ . 1 . 2 ]" 1
272 1 41 LEU HB3 1 42 LYS QG 1.300 . 6.000 4.884 4.276 5.537 . 0 0 "[ . 1 . 2 ]" 1
273 1 41 LEU HB3 1 46 GLY H 3.300 . 4.700 3.820 3.002 4.279 . 0 0 "[ . 1 . 2 ]" 1
274 1 41 LEU HG 1 42 LYS H 3.600 . 5.200 5.094 4.952 5.199 . 0 0 "[ . 1 . 2 ]" 1
275 1 41 LEU HG 1 46 GLY H 4.000 . 6.000 4.702 1.780 5.244 0.220 1 0 "[ . 1 . 2 ]" 1
276 1 41 LEU HG 1 47 LEU H 2.800 . 6.000 3.979 2.953 4.282 . 0 0 "[ . 1 . 2 ]" 1
277 1 42 LYS H 1 42 LYS HA 2.400 . 3.100 2.868 2.788 2.899 . 0 0 "[ . 1 . 2 ]" 1
278 1 42 LYS H 1 42 LYS HB2 2.000 . 2.500 2.308 2.216 2.498 . 0 0 "[ . 1 . 2 ]" 1
279 1 42 LYS H 1 42 LYS HD2 3.500 . 5.000 2.861 2.351 4.705 . 0 0 "[ . 1 . 2 ]" 1
280 1 42 LYS H 1 42 LYS QD 3.200 . 4.500 2.220 1.901 3.797 . 0 0 "[ . 1 . 2 ]" 1
281 1 42 LYS H 1 42 LYS HD3 2.800 . 3.800 2.340 1.932 4.007 0.207 14 0 "[ . 1 . 2 ]" 1
282 1 42 LYS H 1 42 LYS QE 3.900 . 5.800 4.142 3.817 5.521 . 0 0 "[ . 1 . 2 ]" 1
283 1 42 LYS H 1 42 LYS QG 3.800 . 5.600 3.407 2.624 4.021 . 0 0 "[ . 1 . 2 ]" 1
284 1 42 LYS H 1 43 TYR H 2.300 . 3.000 2.328 2.165 2.490 . 0 0 "[ . 1 . 2 ]" 1
285 1 42 LYS H 1 43 TYR HB2 3.100 . 4.300 4.127 3.925 4.338 0.038 14 0 "[ . 1 . 2 ]" 1
286 1 42 LYS H 1 43 TYR QB 3.600 . 5.200 4.025 3.840 4.226 . 0 0 "[ . 1 . 2 ]" 1
287 1 42 LYS HA 1 42 LYS QB 2.400 . 3.100 2.436 2.352 2.477 . 0 0 "[ . 1 . 2 ]" 1
288 1 42 LYS HA 1 42 LYS QB 2.500 . 3.300 1.938 1.682 2.390 0.018 15 0 "[ . 1 . 2 ]" 1
289 1 42 LYS HA 1 42 LYS HD2 2.500 . 3.300 2.153 1.657 2.434 0.043 20 0 "[ . 1 . 2 ]" 1
290 1 42 LYS HA 1 42 LYS HD2 2.300 . 2.900 1.975 1.620 2.117 0.080 20 0 "[ . 1 . 2 ]" 1
291 1 42 LYS HA 1 43 TYR H 2.700 . 3.600 3.388 3.332 3.457 . 0 0 "[ . 1 . 2 ]" 1
292 1 42 LYS HA 1 43 TYR H 2.300 . 3.000 2.738 2.705 2.751 . 0 0 "[ . 1 . 2 ]" 1
293 1 42 LYS HA 1 44 MET HG3 2.800 . 3.800 3.796 3.347 3.931 0.131 15 0 "[ . 1 . 2 ]" 1
294 1 42 LYS HA 1 45 GLY H 3.500 . 5.000 3.831 3.536 4.191 . 0 0 "[ . 1 . 2 ]" 1
295 1 42 LYS QB 1 42 LYS HD2 2.700 . 3.600 3.042 2.820 3.213 . 0 0 "[ . 1 . 2 ]" 1
296 1 42 LYS QB 1 42 LYS HD3 2.600 . 3.500 2.697 2.505 3.189 . 0 0 "[ . 1 . 2 ]" 1
297 1 42 LYS QB 1 43 TYR H 2.500 . 3.300 2.965 2.768 3.049 . 0 0 "[ . 1 . 2 ]" 1
298 1 42 LYS QB 1 44 MET H 2.500 . 6.000 4.772 4.636 4.923 . 0 0 "[ . 1 . 2 ]" 1
299 1 42 LYS HB3 1 43 TYR H 2.400 . 6.000 3.795 2.991 4.049 . 0 0 "[ . 1 . 2 ]" 1
300 1 42 LYS QD 1 42 LYS QG 1.900 . 2.400 2.088 2.064 2.095 . 0 0 "[ . 1 . 2 ]" 1
301 1 42 LYS HD2 1 43 TYR H 3.500 . 5.000 4.523 4.193 4.784 . 0 0 "[ . 1 . 2 ]" 1
302 1 42 LYS HD2 1 44 MET H 3.800 . 5.600 5.515 5.252 5.739 0.139 20 0 "[ . 1 . 2 ]" 1
303 1 42 LYS HD2 1 45 GLY H 4.500 . 6.000 4.917 4.701 5.088 . 0 0 "[ . 1 . 2 ]" 1
304 1 42 LYS HD2 1 46 GLY H 4.200 . 6.000 5.772 5.366 6.164 0.164 20 0 "[ . 1 . 2 ]" 1
305 1 42 LYS HD3 1 42 LYS QG 2.300 . 3.000 2.344 2.252 2.449 . 0 0 "[ . 1 . 2 ]" 1
306 1 42 LYS HD3 1 43 TYR H 3.200 . 4.500 4.465 4.171 4.784 0.284 14 0 "[ . 1 . 2 ]" 1
307 1 42 LYS HD3 1 45 GLY H 4.700 . 6.000 5.719 4.896 6.069 0.069 16 0 "[ . 1 . 2 ]" 1
308 1 42 LYS QE 1 42 LYS QG 2.600 . 3.400 2.306 2.122 2.629 . 0 0 "[ . 1 . 2 ]" 1
309 1 42 LYS QG 1 43 TYR H 3.800 . 5.600 4.628 4.179 4.735 . 0 0 "[ . 1 . 2 ]" 1
310 1 42 LYS QG 1 45 GLY H 4.500 . 6.000 6.004 5.708 6.218 0.218 17 0 "[ . 1 . 2 ]" 1
311 1 43 TYR H 1 43 TYR HA 2.600 . 3.400 2.892 2.862 2.916 . 0 0 "[ . 1 . 2 ]" 1
312 1 43 TYR H 1 43 TYR HB2 2.200 . 2.800 2.149 2.088 2.268 . 0 0 "[ . 1 . 2 ]" 1
313 1 43 TYR H 1 43 TYR HB3 2.600 . 3.500 3.362 3.153 3.535 0.035 14 0 "[ . 1 . 2 ]" 1
314 1 43 TYR H 1 43 TYR QD 3.000 . 4.100 3.100 2.451 3.780 . 0 0 "[ . 1 . 2 ]" 1
315 1 43 TYR H 1 44 MET H 2.600 . 3.500 2.299 2.212 2.389 . 0 0 "[ . 1 . 2 ]" 1
316 1 43 TYR H 1 44 MET HB3 3.600 . 5.200 4.877 4.558 5.215 0.015 15 0 "[ . 1 . 2 ]" 1
317 1 43 TYR H 1 44 MET HG2 3.500 . 5.000 3.760 3.436 5.358 0.358 14 0 "[ . 1 . 2 ]" 1
318 1 43 TYR H 1 45 GLY H 3.900 . 5.800 3.656 3.438 3.817 . 0 0 "[ . 1 . 2 ]" 1
319 1 43 TYR HA 1 43 TYR HB2 2.400 . 3.100 2.924 2.822 2.999 . 0 0 "[ . 1 . 2 ]" 1
320 1 43 TYR HA 1 43 TYR HB3 2.400 . 3.100 2.753 2.563 2.883 . 0 0 "[ . 1 . 2 ]" 1
321 1 43 TYR HA 1 43 TYR QD 2.400 . 3.100 2.614 2.260 2.806 . 0 0 "[ . 1 . 2 ]" 1
322 1 43 TYR HA 1 44 MET H 3.000 . 4.100 3.476 3.398 3.532 . 0 0 "[ . 1 . 2 ]" 1
323 1 43 TYR QB 1 44 MET H 2.700 . 3.600 2.878 2.687 3.069 . 0 0 "[ . 1 . 2 ]" 1
324 1 43 TYR HB2 1 43 TYR QD 2.400 . 3.100 2.501 2.276 2.759 . 0 0 "[ . 1 . 2 ]" 1
325 1 43 TYR HB2 1 44 MET H 2.700 . 3.600 3.146 2.775 3.463 . 0 0 "[ . 1 . 2 ]" 1
326 1 43 TYR HB2 1 45 GLY H 4.200 . 6.000 5.086 4.755 5.341 . 0 0 "[ . 1 . 2 ]" 1
327 1 43 TYR HB3 1 43 TYR QD 2.400 . 3.100 2.371 2.281 2.624 . 0 0 "[ . 1 . 2 ]" 1
328 1 43 TYR HB3 1 44 MET H 2.600 . 3.500 3.380 3.123 3.590 0.090 14 0 "[ . 1 . 2 ]" 1
329 1 43 TYR HB3 1 45 GLY H 4.100 . 6.000 5.391 5.169 5.556 . 0 0 "[ . 1 . 2 ]" 1
330 1 43 TYR QD 1 61 VAL HA 3.100 . 4.300 3.866 3.105 4.352 0.052 16 0 "[ . 1 . 2 ]" 1
331 1 43 TYR QE 1 62 PRO HG3 2.900 . 4.000 3.754 2.481 4.055 0.055 19 0 "[ . 1 . 2 ]" 1
332 1 44 MET H 1 44 MET HA 2.800 . 3.800 2.942 2.916 2.959 . 0 0 "[ . 1 . 2 ]" 1
333 1 44 MET H 1 44 MET HB2 2.700 . 6.000 3.704 3.597 3.765 . 0 0 "[ . 1 . 2 ]" 1
334 1 44 MET H 1 44 MET HB3 2.300 . 2.900 2.917 2.393 3.092 0.192 19 0 "[ . 1 . 2 ]" 1
335 1 44 MET H 1 44 MET HG2 2.600 . 3.400 2.069 1.786 3.419 0.019 14 0 "[ . 1 . 2 ]" 1
336 1 44 MET H 1 44 MET HG3 2.600 . 3.400 3.255 2.591 3.448 0.048 5 0 "[ . 1 . 2 ]" 1
337 1 44 MET H 1 45 GLY H 2.600 . 3.400 2.045 1.939 2.183 . 0 0 "[ . 1 . 2 ]" 1
338 1 44 MET HA 1 45 GLY H 2.900 . 4.000 3.509 3.452 3.553 . 0 0 "[ . 1 . 2 ]" 1
339 1 44 MET HA 1 46 GLY H 3.800 . 5.600 5.033 4.752 5.305 . 0 0 "[ . 1 . 2 ]" 1
340 1 44 MET QB 1 45 GLY H 3.400 . 4.800 3.388 3.274 3.483 . 0 0 "[ . 1 . 2 ]" 1
341 1 44 MET QB 1 46 GLY H 3.500 . 5.000 3.819 3.453 4.132 . 0 0 "[ . 1 . 2 ]" 1
342 1 44 MET HB2 1 44 MET HG2 3.000 . 4.200 2.974 2.768 3.011 . 0 0 "[ . 1 . 2 ]" 1
343 1 44 MET HB2 1 44 MET HG3 3.000 . 4.200 2.390 2.203 2.881 . 0 0 "[ . 1 . 2 ]" 1
344 1 44 MET HB2 1 45 GLY H 3.300 . 4.700 3.753 3.535 4.043 . 0 0 "[ . 1 . 2 ]" 1
345 1 44 MET HB2 1 46 GLY H 3.300 . 4.700 4.060 3.557 4.814 0.114 14 0 "[ . 1 . 2 ]" 1
346 1 44 MET HB3 1 44 MET HG2 2.700 . 3.600 2.528 2.212 2.833 . 0 0 "[ . 1 . 2 ]" 1
347 1 44 MET HB3 1 44 MET HG3 3.000 . 4.100 2.977 2.773 3.028 . 0 0 "[ . 1 . 2 ]" 1
348 1 44 MET HB3 1 45 GLY H 3.300 . 4.600 3.877 3.460 4.135 . 0 0 "[ . 1 . 2 ]" 1
349 1 44 MET HB3 1 46 GLY H 3.400 . 4.900 4.704 4.379 4.928 0.028 22 0 "[ . 1 . 2 ]" 1
350 1 44 MET ME 1 44 MET HG2 3.000 . 4.100 2.655 2.530 3.404 . 0 0 "[ . 1 . 2 ]" 1
351 1 44 MET HG2 1 45 GLY H 3.100 . 4.300 2.289 1.871 3.311 0.029 16 0 "[ . 1 . 2 ]" 1
352 1 44 MET HG2 1 46 GLY H 4.100 . 6.000 2.823 2.490 3.701 . 0 0 "[ . 1 . 2 ]" 1
353 1 44 MET HG2 1 50 LEU H 3.600 . 5.200 4.716 2.836 5.148 . 0 0 "[ . 1 . 2 ]" 1
354 1 45 GLY H 1 45 GLY HA2 2.400 . 3.100 2.325 2.289 2.354 . 0 0 "[ . 1 . 2 ]" 1
355 1 45 GLY H 1 45 GLY QA 2.500 . 3.300 2.235 2.203 2.260 . 0 0 "[ . 1 . 2 ]" 1
356 1 45 GLY H 1 45 GLY HA3 2.400 . 3.100 2.897 2.864 2.920 . 0 0 "[ . 1 . 2 ]" 1
357 1 45 GLY H 1 45 GLY HA3 2.200 . 2.800 2.738 2.675 2.791 . 0 0 "[ . 1 . 2 ]" 1
358 1 45 GLY H 1 46 GLY H 2.500 . 3.300 2.351 2.248 2.492 . 0 0 "[ . 1 . 2 ]" 1
359 1 45 GLY H 1 46 GLY HA2 3.400 . 4.800 4.925 4.810 5.123 0.323 2 0 "[ . 1 . 2 ]" 1
360 1 45 GLY QA 1 46 GLY H 3.000 . 4.100 2.732 2.619 2.886 . 0 0 "[ . 1 . 2 ]" 1
361 1 45 GLY HA2 1 46 GLY H 2.700 . 3.600 2.851 2.700 3.098 . 0 0 "[ . 1 . 2 ]" 1
362 1 45 GLY HA2 1 47 LEU H 4.000 . 6.000 5.882 5.259 6.129 0.129 14 0 "[ . 1 . 2 ]" 1
363 1 46 GLY H 1 46 GLY HA2 2.500 . 3.300 2.704 2.555 2.840 . 0 0 "[ . 1 . 2 ]" 1
364 1 46 GLY H 1 46 GLY HA3 2.700 . 3.600 2.865 2.764 2.932 . 0 0 "[ . 1 . 2 ]" 1
365 1 46 GLY H 1 47 LEU H 3.400 . 4.800 3.651 3.341 3.859 . 0 0 "[ . 1 . 2 ]" 1
366 1 46 GLY H 1 47 LEU HA 3.100 . 4.300 4.349 4.174 4.459 0.159 14 0 "[ . 1 . 2 ]" 1
367 1 46 GLY H 1 47 LEU QB 3.800 . 5.600 5.161 4.867 5.320 . 0 0 "[ . 1 . 2 ]" 1
368 1 46 GLY QA 1 48 GLN H 3.600 . 5.200 3.348 2.993 3.957 . 0 0 "[ . 1 . 2 ]" 1
369 1 46 GLY HA2 1 47 LEU H 2.700 . 3.600 2.143 2.087 2.229 . 0 0 "[ . 1 . 2 ]" 1
370 1 46 GLY HA2 1 48 GLN H 3.900 . 5.800 3.831 3.588 4.493 . 0 0 "[ . 1 . 2 ]" 1
371 1 46 GLY HA2 1 49 GLY H 4.300 . 6.000 4.480 4.169 4.864 . 0 0 "[ . 1 . 2 ]" 1
372 1 46 GLY HA3 1 47 LEU H 2.400 . 3.100 3.291 3.154 3.459 0.359 2 0 "[ . 1 . 2 ]" 1
373 1 46 GLY HA3 1 49 GLY H 3.800 . 5.600 3.378 3.047 3.690 . 0 0 "[ . 1 . 2 ]" 1
374 1 47 LEU H 1 47 LEU HA 2.600 . 3.400 2.720 2.695 2.758 . 0 0 "[ . 1 . 2 ]" 1
375 1 47 LEU H 1 47 LEU HB2 2.300 . 2.900 2.416 2.065 2.716 . 0 0 "[ . 1 . 2 ]" 1
376 1 47 LEU H 1 47 LEU QB 2.200 . 2.800 2.215 2.044 2.276 . 0 0 "[ . 1 . 2 ]" 1
377 1 47 LEU H 1 47 LEU HB3 2.500 . 3.300 2.672 2.335 3.285 . 0 0 "[ . 1 . 2 ]" 1
378 1 47 LEU H 1 48 GLN HB2 3.800 . 5.600 5.044 4.457 5.506 . 0 0 "[ . 1 . 2 ]" 1
379 1 47 LEU H 1 48 GLN HB3 4.500 . 6.000 5.177 4.917 5.706 . 0 0 "[ . 1 . 2 ]" 1
380 1 47 LEU H 1 49 GLY H 4.500 . 6.000 4.442 4.100 4.679 . 0 0 "[ . 1 . 2 ]" 1
381 1 47 LEU HA 1 47 LEU HB2 2.400 . 3.100 2.477 2.321 2.815 . 0 0 "[ . 1 . 2 ]" 1
382 1 47 LEU HA 1 47 LEU HB2 2.500 . 3.300 2.439 2.285 2.745 . 0 0 "[ . 1 . 2 ]" 1
383 1 47 LEU HA 1 47 LEU HB3 2.600 . 3.500 2.998 2.878 3.020 . 0 0 "[ . 1 . 2 ]" 1
384 1 47 LEU HA 1 50 LEU H 3.000 . 4.100 3.111 2.816 3.443 . 0 0 "[ . 1 . 2 ]" 1
385 1 47 LEU HA 1 50 LEU HB3 2.700 . 3.600 2.285 1.891 2.707 . 0 0 "[ . 1 . 2 ]" 1
386 1 47 LEU HB2 1 48 GLN H 3.100 . 4.300 3.754 3.188 4.050 . 0 0 "[ . 1 . 2 ]" 1
387 1 47 LEU HB2 1 49 GLY H 3.800 . 5.600 5.801 5.612 6.089 0.489 18 0 "[ . 1 . 2 ]" 1
388 1 47 LEU HB3 1 48 GLN H 2.700 . 3.600 2.569 2.159 2.837 . 0 0 "[ . 1 . 2 ]" 1
389 1 47 LEU HB3 1 49 GLY H 4.100 . 6.000 5.090 4.966 5.241 . 0 0 "[ . 1 . 2 ]" 1
390 1 47 LEU HB3 1 50 LEU HG 2.300 . 6.000 6.143 5.746 6.514 0.514 18 1 "[ . 1 . + 2 ]" 1
391 1 48 GLN H 1 48 GLN HA 2.700 . 3.600 2.728 2.695 2.790 . 0 0 "[ . 1 . 2 ]" 1
392 1 48 GLN H 1 48 GLN HB2 2.400 . 3.100 2.355 2.065 2.562 . 0 0 "[ . 1 . 2 ]" 1
393 1 48 GLN H 1 48 GLN QB 2.400 . 3.100 2.213 2.043 2.299 . 0 0 "[ . 1 . 2 ]" 1
394 1 48 GLN H 1 48 GLN QG 3.100 . 4.300 4.016 3.648 4.084 . 0 0 "[ . 1 . 2 ]" 1
395 1 48 GLN H 1 49 GLY H 2.600 . 3.500 2.883 2.615 3.098 . 0 0 "[ . 1 . 2 ]" 1
396 1 48 GLN H 1 50 LEU H 3.900 . 5.800 3.951 3.635 4.103 . 0 0 "[ . 1 . 2 ]" 1
397 1 48 GLN H 1 51 ARG QD 4.300 . 6.000 5.163 4.044 5.866 . 0 0 "[ . 1 . 2 ]" 1
398 1 48 GLN HA 1 48 GLN QG 2.700 . 3.600 2.787 2.340 3.138 . 0 0 "[ . 1 . 2 ]" 1
399 1 48 GLN HA 1 49 GLY H 3.700 . 5.400 3.532 3.499 3.559 . 0 0 "[ . 1 . 2 ]" 1
400 1 48 GLN HA 1 51 ARG HB2 3.100 . 4.300 2.571 1.971 3.174 . 0 0 "[ . 1 . 2 ]" 1
401 1 48 GLN HA 1 52 ASN H 3.200 . 4.500 4.101 3.502 4.578 0.078 8 0 "[ . 1 . 2 ]" 1
402 1 48 GLN QB 1 48 GLN QG 2.300 . 3.000 1.997 1.954 2.076 . 0 0 "[ . 1 . 2 ]" 1
403 1 48 GLN HB2 1 49 GLY H 2.700 . 3.600 3.579 3.112 3.684 0.084 6 0 "[ . 1 . 2 ]" 1
404 1 48 GLN HB3 1 48 GLN QG 1.800 . 2.200 2.192 2.150 2.341 0.141 21 0 "[ . 1 . 2 ]" 1
405 1 48 GLN HB3 1 49 GLY H 2.600 . 3.400 2.329 2.099 2.736 . 0 0 "[ . 1 . 2 ]" 1
406 1 48 GLN HB3 1 50 LEU H 3.200 . 4.500 4.585 4.486 4.676 0.176 20 0 "[ . 1 . 2 ]" 1
407 1 48 GLN HE21 1 48 GLN QG 3.200 . 4.500 2.261 2.135 2.775 . 0 0 "[ . 1 . 2 ]" 1
408 1 48 GLN HE21 1 48 GLN HG3 3.600 . 5.200 2.786 2.200 3.508 . 0 0 "[ . 1 . 2 ]" 1
409 1 48 GLN QG 1 49 GLY H 3.400 . 4.900 3.625 2.936 4.487 . 0 0 "[ . 1 . 2 ]" 1
410 1 48 GLN QG 1 51 ARG H 4.100 . 6.000 4.975 4.436 5.756 . 0 0 "[ . 1 . 2 ]" 1
411 1 48 GLN QG 1 52 ASN HD21 3.900 . 5.800 3.492 2.207 4.967 . 0 0 "[ . 1 . 2 ]" 1
412 1 48 GLN HG3 1 50 LEU H 4.200 . 6.000 5.534 5.001 6.603 0.603 19 2 "[ . 1 . +2- ]" 1
413 1 49 GLY H 1 49 GLY HA2 2.200 . 2.800 2.797 2.746 2.869 0.069 15 0 "[ . 1 . 2 ]" 1
414 1 49 GLY H 1 49 GLY QA 2.200 . 2.800 2.199 2.189 2.216 . 0 0 "[ . 1 . 2 ]" 1
415 1 49 GLY H 1 49 GLY HA3 2.300 . 3.000 2.300 2.288 2.314 . 0 0 "[ . 1 . 2 ]" 1
416 1 49 GLY H 1 50 LEU H 2.500 . 3.300 2.604 2.289 2.780 . 0 0 "[ . 1 . 2 ]" 1
417 1 49 GLY H 1 50 LEU QB 3.400 . 4.800 4.304 3.992 4.471 . 0 0 "[ . 1 . 2 ]" 1
418 1 49 GLY H 1 50 LEU HB3 4.000 . 6.000 4.569 4.284 4.757 . 0 0 "[ . 1 . 2 ]" 1
419 1 49 GLY H 1 51 ARG H 3.700 . 5.400 4.114 3.723 4.460 . 0 0 "[ . 1 . 2 ]" 1
420 1 49 GLY H 1 51 ARG QG 4.000 . 6.000 4.763 4.055 5.777 . 0 0 "[ . 1 . 2 ]" 1
421 1 49 GLY QA 1 50 LEU H 2.700 . 3.600 2.748 2.672 2.836 . 0 0 "[ . 1 . 2 ]" 1
422 1 49 GLY QA 1 52 ASN H 3.500 . 5.000 3.505 3.093 4.175 . 0 0 "[ . 1 . 2 ]" 1
423 1 49 GLY HA2 1 50 LEU H 2.800 . 3.800 3.451 3.383 3.515 . 0 0 "[ . 1 . 2 ]" 1
424 1 49 GLY HA3 1 50 LEU H 2.300 . 3.000 2.888 2.781 3.041 0.041 15 0 "[ . 1 . 2 ]" 1
425 1 49 GLY HA3 1 50 LEU HB2 3.100 . 6.000 5.008 4.806 5.215 . 0 0 "[ . 1 . 2 ]" 1
426 1 49 GLY HA3 1 50 LEU HB3 2.700 . 6.000 5.010 4.816 5.176 . 0 0 "[ . 1 . 2 ]" 1
427 1 50 LEU H 1 50 LEU HA 2.500 . 3.300 2.864 2.804 2.896 . 0 0 "[ . 1 . 2 ]" 1
428 1 50 LEU H 1 50 LEU HB2 2.300 . 3.000 2.871 2.640 3.062 0.062 5 0 "[ . 1 . 2 ]" 1
429 1 50 LEU H 1 50 LEU QB 2.200 . 2.800 2.152 2.089 2.209 . 0 0 "[ . 1 . 2 ]" 1
430 1 50 LEU H 1 50 LEU HB3 2.100 . 2.700 2.227 2.130 2.331 . 0 0 "[ . 1 . 2 ]" 1
431 1 50 LEU H 1 50 LEU HG 3.000 . 4.100 4.158 3.963 4.306 0.206 1 0 "[ . 1 . 2 ]" 1
432 1 50 LEU H 1 51 ARG H 2.300 . 3.000 2.399 2.177 2.591 . 0 0 "[ . 1 . 2 ]" 1
433 1 50 LEU H 1 51 ARG QB 3.500 . 5.000 4.403 3.893 4.689 . 0 0 "[ . 1 . 2 ]" 1
434 1 50 LEU H 1 51 ARG QB 2.900 . 3.900 3.771 3.460 3.938 0.038 2 0 "[ . 1 . 2 ]" 1
435 1 50 LEU HA 1 50 LEU HB2 2.500 . 3.300 2.334 2.278 2.398 . 0 0 "[ . 1 . 2 ]" 1
436 1 50 LEU HA 1 50 LEU HB3 2.500 . 3.300 2.990 2.957 3.013 . 0 0 "[ . 1 . 2 ]" 1
437 1 50 LEU HA 1 50 LEU HG 2.600 . 3.400 3.446 3.307 3.524 0.124 12 0 "[ . 1 . 2 ]" 1
438 1 50 LEU HA 1 51 ARG H 3.400 . 4.900 3.494 3.394 3.552 . 0 0 "[ . 1 . 2 ]" 1
439 1 50 LEU HA 1 52 ASN H 3.600 . 5.200 4.117 3.712 4.849 . 0 0 "[ . 1 . 2 ]" 1
440 1 50 LEU HA 1 53 ALA H 3.100 . 4.300 3.075 2.791 3.529 . 0 0 "[ . 1 . 2 ]" 1
441 1 50 LEU HA 1 53 ALA MB 2.600 . 3.500 1.938 1.676 3.042 0.024 21 0 "[ . 1 . 2 ]" 1
442 1 50 LEU HB2 1 50 LEU HG 2.800 . 3.800 2.995 2.960 3.017 . 0 0 "[ . 1 . 2 ]" 1
443 1 50 LEU HB2 1 51 ARG H 2.900 . 3.900 3.948 3.820 4.089 0.189 10 0 "[ . 1 . 2 ]" 1
444 1 50 LEU HB3 1 50 LEU HG 2.600 . 3.500 2.389 2.308 2.514 . 0 0 "[ . 1 . 2 ]" 1
445 1 50 LEU HB3 1 51 ARG H 2.400 . 3.100 2.649 2.413 2.925 . 0 0 "[ . 1 . 2 ]" 1
446 1 50 LEU HB3 1 53 ALA H 4.100 . 6.000 5.128 4.915 5.387 . 0 0 "[ . 1 . 2 ]" 1
447 1 50 LEU HB3 1 53 ALA MB 2.400 . 6.000 4.504 4.233 5.093 . 0 0 "[ . 1 . 2 ]" 1
448 1 50 LEU HG 1 51 ARG HA 3.000 . 4.100 3.331 2.832 3.757 . 0 0 "[ . 1 . 2 ]" 1
449 1 50 LEU HG 1 51 ARG HA 2.100 . 2.700 2.424 2.215 2.734 0.034 18 0 "[ . 1 . 2 ]" 1
450 1 51 ARG H 1 51 ARG HA 2.400 . 3.100 2.781 2.705 2.850 . 0 0 "[ . 1 . 2 ]" 1
451 1 51 ARG H 1 51 ARG HB2 2.200 . 2.800 2.603 2.344 3.176 0.376 18 0 "[ . 1 . 2 ]" 1
452 1 51 ARG H 1 51 ARG QB 2.600 . 3.500 2.490 1.947 2.706 . 0 0 "[ . 1 . 2 ]" 1
453 1 51 ARG H 1 51 ARG HB2 2.000 . 2.500 2.266 1.942 3.089 0.589 18 1 "[ . 1 . + 2 ]" 1
454 1 51 ARG H 1 51 ARG HG2 2.500 . 3.300 2.547 2.161 3.436 0.136 15 0 "[ . 1 . 2 ]" 1
455 1 51 ARG H 1 51 ARG HG3 3.000 . 4.100 2.627 1.979 4.218 0.118 18 0 "[ . 1 . 2 ]" 1
456 1 51 ARG H 1 52 ASN H 2.500 . 3.300 2.612 2.290 3.037 . 0 0 "[ . 1 . 2 ]" 1
457 1 51 ARG H 1 52 ASN HB3 3.800 . 5.600 5.807 5.117 6.214 0.614 3 5 "[ + **- 1 * . 2 ]" 1
458 1 51 ARG H 1 53 ALA H 3.500 . 5.000 3.730 3.532 3.958 . 0 0 "[ . 1 . 2 ]" 1
459 1 51 ARG HA 1 51 ARG QB 2.000 . 2.500 2.329 2.099 2.403 . 0 0 "[ . 1 . 2 ]" 1
460 1 51 ARG HA 1 51 ARG HG2 2.500 . 3.300 2.528 2.279 3.606 0.306 18 0 "[ . 1 . 2 ]" 1
461 1 51 ARG HA 1 51 ARG HG3 2.600 . 6.000 3.555 2.999 3.730 . 0 0 "[ . 1 . 2 ]" 1
462 1 51 ARG HA 1 52 ASN H 2.700 . 3.600 3.463 3.363 3.555 . 0 0 "[ . 1 . 2 ]" 1
463 1 51 ARG HA 1 52 ASN HD21 4.600 . 6.000 4.889 4.243 5.447 . 0 0 "[ . 1 . 2 ]" 1
464 1 51 ARG HA 1 53 ALA H 3.400 . 4.800 4.033 3.517 4.608 . 0 0 "[ . 1 . 2 ]" 1
465 1 51 ARG HA 1 76 LEU HB3 2.400 . 3.100 2.916 1.833 3.852 0.752 21 1 "[ . 1 . 2+ ]" 1
466 1 51 ARG QB 1 51 ARG HD2 2.000 . 2.500 2.264 1.997 2.537 0.037 22 0 "[ . 1 . 2 ]" 1
467 1 51 ARG QB 1 51 ARG HG2 2.300 . 3.000 2.475 2.264 2.523 . 0 0 "[ . 1 . 2 ]" 1
468 1 51 ARG QB 1 53 ALA H 3.200 . 4.400 4.077 3.790 4.341 . 0 0 "[ . 1 . 2 ]" 1
469 1 51 ARG QB 1 52 ASN H 2.500 . 3.300 2.613 2.105 3.114 . 0 0 "[ . 1 . 2 ]" 1
470 1 51 ARG HB2 1 53 ALA H 3.300 . 4.700 4.706 4.269 5.278 0.578 18 1 "[ . 1 . + 2 ]" 1
471 1 51 ARG HB3 1 51 ARG HD2 2.100 . 2.600 2.123 2.003 2.259 . 0 0 "[ . 1 . 2 ]" 1
472 1 51 ARG QD 1 51 ARG HG2 2.400 . 3.100 2.223 2.138 2.452 . 0 0 "[ . 1 . 2 ]" 1
473 1 51 ARG QD 1 51 ARG QG 2.200 . 2.800 2.024 1.953 2.091 . 0 0 "[ . 1 . 2 ]" 1
474 1 51 ARG QG 1 52 ASN H 3.700 . 5.400 3.784 2.357 4.124 . 0 0 "[ . 1 . 2 ]" 1
475 1 51 ARG HG2 1 52 ASN H 3.100 . 4.300 4.366 2.398 4.982 0.682 15 1 "[ . 1 + 2 ]" 1
476 1 52 ASN H 1 52 ASN HA 2.700 . 3.600 2.885 2.792 2.932 . 0 0 "[ . 1 . 2 ]" 1
477 1 52 ASN H 1 52 ASN HB2 2.800 . 3.800 2.935 2.278 3.646 . 0 0 "[ . 1 . 2 ]" 1
478 1 52 ASN H 1 52 ASN QB 2.300 . 3.000 2.534 2.253 2.942 . 0 0 "[ . 1 . 2 ]" 1
479 1 52 ASN H 1 52 ASN HB3 2.500 . 3.300 3.272 2.359 3.645 0.345 1 0 "[ . 1 . 2 ]" 1
480 1 52 ASN H 1 53 ALA MB 3.400 . 4.800 3.930 3.690 4.241 . 0 0 "[ . 1 . 2 ]" 1
481 1 52 ASN HA 1 53 ALA H 2.900 . 4.000 3.393 3.201 3.497 . 0 0 "[ . 1 . 2 ]" 1
482 1 52 ASN QB 1 52 ASN HD21 2.700 . 3.600 2.528 2.198 2.827 . 0 0 "[ . 1 . 2 ]" 1
483 1 52 ASN QB 1 53 ALA H 3.000 . 4.200 3.186 2.444 3.827 . 0 0 "[ . 1 . 2 ]" 1
484 1 52 ASN HB2 1 52 ASN HD21 2.700 . 3.600 3.150 2.326 3.534 . 0 0 "[ . 1 . 2 ]" 1
485 1 52 ASN HB2 1 53 ALA H 3.200 . 4.500 3.389 2.499 4.228 . 0 0 "[ . 1 . 2 ]" 1
486 1 52 ASN HB2 1 54 SER H 4.600 . 6.000 6.200 5.186 6.626 0.626 3 3 "[ + . 1 - * 2 ]" 1
487 1 52 ASN HB3 1 52 ASN HD21 2.800 . 3.800 2.953 2.223 3.535 . 0 0 "[ . 1 . 2 ]" 1
488 1 52 ASN HB3 1 53 ALA H 3.200 . 4.500 3.969 3.459 4.493 . 0 0 "[ . 1 . 2 ]" 1
489 1 53 ALA H 1 53 ALA HA 2.600 . 3.500 2.868 2.798 2.943 . 0 0 "[ . 1 . 2 ]" 1
490 1 53 ALA H 1 53 ALA MB 2.100 . 2.700 2.196 2.013 2.359 . 0 0 "[ . 1 . 2 ]" 1
491 1 53 ALA H 1 54 SER H 3.300 . 4.700 4.455 4.123 4.618 . 0 0 "[ . 1 . 2 ]" 1
492 1 53 ALA H 1 57 GLU QB 3.900 . 5.800 4.551 4.300 5.457 . 0 0 "[ . 1 . 2 ]" 1
493 1 53 ALA H 1 57 GLU QG 3.900 . 5.800 4.999 4.474 5.422 . 0 0 "[ . 1 . 2 ]" 1
494 1 53 ALA H 1 58 ILE HG13 3.900 . 5.800 4.892 4.450 5.319 . 0 0 "[ . 1 . 2 ]" 1
495 1 53 ALA HA 1 54 SER H 2.300 . 2.900 2.180 2.131 2.248 . 0 0 "[ . 1 . 2 ]" 1
496 1 53 ALA MB 1 54 SER H 2.600 . 3.400 3.132 2.839 3.466 0.066 8 0 "[ . 1 . 2 ]" 1
497 1 53 ALA MB 1 56 GLU H 2.900 . 6.000 5.737 5.289 6.002 0.002 20 0 "[ . 1 . 2 ]" 1
498 1 53 ALA MB 1 57 GLU H 3.400 . 4.800 3.743 3.565 4.116 . 0 0 "[ . 1 . 2 ]" 1
499 1 53 ALA MB 1 57 GLU QB 2.800 . 3.800 1.797 1.675 2.450 0.225 7 0 "[ . 1 . 2 ]" 1
500 1 53 ALA MB 1 57 GLU QG 2.500 . 3.300 2.581 1.832 3.161 . 0 0 "[ . 1 . 2 ]" 1
501 1 53 ALA MB 1 58 ILE HG13 2.400 . 3.100 2.213 1.950 2.528 . 0 0 "[ . 1 . 2 ]" 1
502 1 54 SER H 1 54 SER HB2 2.800 . 3.800 2.704 2.489 3.021 . 0 0 "[ . 1 . 2 ]" 1
503 1 54 SER H 1 54 SER QB 2.800 . 3.800 2.587 2.325 2.882 . 0 0 "[ . 1 . 2 ]" 1
504 1 54 SER H 1 54 SER HB3 2.700 . 3.600 3.564 2.430 3.738 0.138 20 0 "[ . 1 . 2 ]" 1
505 1 54 SER H 1 55 VAL HB 4.100 . 6.000 6.105 6.004 6.195 0.195 8 0 "[ . 1 . 2 ]" 1
506 1 54 SER H 1 56 GLU HB2 3.600 . 5.300 5.143 4.907 5.557 0.257 21 0 "[ . 1 . 2 ]" 1
507 1 54 SER H 1 56 GLU HG2 2.500 . 3.300 3.002 2.274 3.891 0.591 13 1 "[ . 1 + . 2 ]" 1
508 1 54 SER H 1 56 GLU QG 3.100 . 4.300 2.600 2.179 3.234 . 0 0 "[ . 1 . 2 ]" 1
509 1 54 SER H 1 56 GLU HG3 2.300 . 2.900 2.323 1.992 2.818 . 0 0 "[ . 1 . 2 ]" 1
510 1 54 SER H 1 57 GLU H 3.400 . 4.800 2.877 2.560 3.329 . 0 0 "[ . 1 . 2 ]" 1
511 1 54 SER H 1 57 GLU QB 2.700 . 3.600 2.481 2.008 3.025 . 0 0 "[ . 1 . 2 ]" 1
512 1 54 SER H 1 73 PHE QE 4.300 . 6.000 5.608 4.708 6.056 0.056 19 0 "[ . 1 . 2 ]" 1
513 1 54 SER HA 1 55 VAL H 2.400 . 3.100 2.686 2.522 2.954 . 0 0 "[ . 1 . 2 ]" 1
514 1 54 SER HA 1 56 GLU H 3.300 . 4.700 4.362 4.217 4.529 . 0 0 "[ . 1 . 2 ]" 1
515 1 54 SER HA 1 57 GLU H 3.000 . 6.000 4.548 4.342 4.857 . 0 0 "[ . 1 . 2 ]" 1
516 1 54 SER HA 1 73 PHE QE 3.000 . 4.200 3.594 2.465 4.218 0.018 15 0 "[ . 1 . 2 ]" 1
517 1 54 SER QB 1 56 GLU H 3.200 . 4.500 2.631 2.409 2.901 . 0 0 "[ . 1 . 2 ]" 1
518 1 54 SER QB 1 58 ILE H 2.900 . 6.000 4.722 4.501 4.871 . 0 0 "[ . 1 . 2 ]" 1
519 1 54 SER HB2 1 55 VAL H 2.600 . 3.500 2.956 1.964 3.442 . 0 0 "[ . 1 . 2 ]" 1
520 1 54 SER HB2 1 56 GLU H 2.900 . 3.900 2.843 2.441 4.429 0.529 7 1 "[ . + 1 . 2 ]" 1
521 1 54 SER HB2 1 57 GLU H 3.600 . 5.200 3.769 3.262 5.069 . 0 0 "[ . 1 . 2 ]" 1
522 1 54 SER HB3 1 55 VAL H 2.600 . 3.400 2.336 2.014 3.157 . 0 0 "[ . 1 . 2 ]" 1
523 1 55 VAL H 1 55 VAL HA 2.400 . 3.100 2.731 2.686 2.809 . 0 0 "[ . 1 . 2 ]" 1
524 1 55 VAL H 1 55 VAL HB 2.400 . 3.100 2.257 2.118 2.457 . 0 0 "[ . 1 . 2 ]" 1
525 1 55 VAL H 1 56 GLU HA 3.200 . 4.500 4.339 4.040 4.656 0.156 18 0 "[ . 1 . 2 ]" 1
526 1 55 VAL H 1 56 GLU HB2 4.000 . 6.000 6.141 6.075 6.183 0.183 17 0 "[ . 1 . 2 ]" 1
527 1 55 VAL H 1 56 GLU HB3 3.900 . 5.800 5.255 4.812 5.729 . 0 0 "[ . 1 . 2 ]" 1
528 1 55 VAL H 1 56 GLU QG 4.100 . 6.000 3.676 3.433 5.009 . 0 0 "[ . 1 . 2 ]" 1
529 1 55 VAL H 1 73 PHE HB2 4.500 . 6.000 2.933 2.457 3.577 . 0 0 "[ . 1 . 2 ]" 1
530 1 55 VAL H 1 73 PHE HB3 4.400 . 6.000 4.355 3.690 5.007 . 0 0 "[ . 1 . 2 ]" 1
531 1 55 VAL H 1 73 PHE QD 3.500 . 5.100 2.327 1.845 3.201 0.055 13 0 "[ . 1 . 2 ]" 1
532 1 55 VAL H 1 73 PHE QE 3.400 . 4.900 3.784 3.043 4.327 . 0 0 "[ . 1 . 2 ]" 1
533 1 55 VAL H 1 73 PHE HZ 4.200 . 6.000 5.626 4.990 6.046 0.046 22 0 "[ . 1 . 2 ]" 1
534 1 55 VAL HA 1 55 VAL HB 3.000 . 4.100 2.966 2.914 3.006 . 0 0 "[ . 1 . 2 ]" 1
535 1 55 VAL HA 1 55 VAL HB 2.600 . 3.500 2.080 1.774 2.393 . 0 0 "[ . 1 . 2 ]" 1
536 1 55 VAL HA 1 56 GLU H 2.800 . 3.800 3.477 3.440 3.499 . 0 0 "[ . 1 . 2 ]" 1
537 1 55 VAL HA 1 58 ILE H 3.100 . 4.300 3.619 3.327 3.805 . 0 0 "[ . 1 . 2 ]" 1
538 1 55 VAL HA 1 58 ILE HB 2.400 . 3.100 2.208 1.979 2.402 . 0 0 "[ . 1 . 2 ]" 1
539 1 55 VAL HA 1 59 ALA H 3.400 . 4.800 3.457 3.197 3.664 . 0 0 "[ . 1 . 2 ]" 1
540 1 55 VAL HA 1 69 ALA MB 2.500 . 3.300 2.132 1.787 2.521 . 0 0 "[ . 1 . 2 ]" 1
541 1 55 VAL HA 1 73 PHE H 3.800 . 5.600 4.509 4.150 4.855 . 0 0 "[ . 1 . 2 ]" 1
542 1 55 VAL HB 1 56 GLU H 2.500 . 3.300 2.736 2.452 3.145 . 0 0 "[ . 1 . 2 ]" 1
543 1 55 VAL HB 1 57 GLU H 3.800 . 5.600 5.317 5.057 5.567 . 0 0 "[ . 1 . 2 ]" 1
544 1 56 GLU H 1 56 GLU HA 2.300 . 3.000 2.741 2.693 2.854 . 0 0 "[ . 1 . 2 ]" 1
545 1 56 GLU H 1 56 GLU HB2 4.500 . 6.000 3.517 3.436 3.586 . 0 0 "[ . 1 . 2 ]" 1
546 1 56 GLU H 1 56 GLU QB 2.300 . 3.000 2.588 2.418 2.798 . 0 0 "[ . 1 . 2 ]" 1
547 1 56 GLU H 1 56 GLU HB3 2.400 . 3.100 2.671 2.461 2.962 . 0 0 "[ . 1 . 2 ]" 1
548 1 56 GLU H 1 56 GLU HG2 2.800 . 6.000 1.981 1.732 3.135 . 0 0 "[ . 1 . 2 ]" 1
549 1 56 GLU H 1 56 GLU HG3 2.800 . 3.800 3.165 2.274 3.741 . 0 0 "[ . 1 . 2 ]" 1
550 1 56 GLU H 1 57 GLU H 2.500 . 3.300 2.877 2.519 3.089 . 0 0 "[ . 1 . 2 ]" 1
551 1 56 GLU H 1 57 GLU QG 2.800 . 6.000 5.801 4.571 6.191 0.191 8 0 "[ . 1 . 2 ]" 1
552 1 56 GLU H 1 59 ALA MB 3.600 . 5.200 4.394 4.130 4.557 . 0 0 "[ . 1 . 2 ]" 1
553 1 56 GLU HA 1 56 GLU HB2 2.500 . 3.300 2.555 2.396 2.710 . 0 0 "[ . 1 . 2 ]" 1
554 1 56 GLU HA 1 56 GLU HB3 2.600 . 3.400 2.349 2.258 2.483 . 0 0 "[ . 1 . 2 ]" 1
555 1 56 GLU HA 1 56 GLU HG3 2.700 . 6.000 3.902 3.706 4.214 . 0 0 "[ . 1 . 2 ]" 1
556 1 56 GLU HA 1 59 ALA H 2.500 . 6.000 4.066 3.572 4.254 . 0 0 "[ . 1 . 2 ]" 1
557 1 56 GLU HA 1 59 ALA MB 2.500 . 3.300 3.118 2.472 3.372 0.072 22 0 "[ . 1 . 2 ]" 1
558 1 56 GLU HB2 1 57 GLU H 4.200 . 6.000 3.269 2.816 3.554 . 0 0 "[ . 1 . 2 ]" 1
559 1 56 GLU HB3 1 58 ILE H 2.900 . 6.000 5.985 5.813 6.085 0.085 13 0 "[ . 1 . 2 ]" 1
560 1 56 GLU QG 1 57 GLU H 2.500 . 3.300 1.844 1.678 2.052 0.022 20 0 "[ . 1 . 2 ]" 1
561 1 56 GLU HG3 1 57 GLU H 3.600 . 5.200 2.231 1.704 3.327 0.296 14 0 "[ . 1 . 2 ]" 1
562 1 56 GLU HG3 1 57 GLU H 2.100 . 2.600 1.842 1.634 2.052 . 0 0 "[ . 1 . 2 ]" 1
563 1 56 GLU HG3 1 59 ALA H 3.400 . 6.000 5.629 5.138 6.499 0.499 16 0 "[ . 1 . 2 ]" 1
564 1 57 GLU H 1 57 GLU HA 2.400 . 3.100 2.876 2.837 2.904 . 0 0 "[ . 1 . 2 ]" 1
565 1 57 GLU H 1 57 GLU QB 2.400 . 3.100 2.090 2.006 2.306 . 0 0 "[ . 1 . 2 ]" 1
566 1 57 GLU H 1 58 ILE H 2.500 . 3.300 2.388 2.272 2.484 . 0 0 "[ . 1 . 2 ]" 1
567 1 57 GLU H 1 58 ILE HA 3.500 . 5.000 5.006 4.928 5.086 0.086 4 0 "[ . 1 . 2 ]" 1
568 1 57 GLU H 1 58 ILE HG13 3.900 . 5.800 4.226 3.976 4.555 . 0 0 "[ . 1 . 2 ]" 1
569 1 57 GLU H 1 59 ALA MB 3.900 . 5.800 4.518 4.352 4.648 . 0 0 "[ . 1 . 2 ]" 1
570 1 57 GLU HA 1 57 GLU QB 2.300 . 3.000 2.482 2.147 2.534 . 0 0 "[ . 1 . 2 ]" 1
571 1 57 GLU HA 1 57 GLU QB 2.900 . 3.900 2.293 2.086 2.379 . 0 0 "[ . 1 . 2 ]" 1
572 1 57 GLU HA 1 57 GLU QG 2.600 . 3.500 2.728 2.361 2.921 . 0 0 "[ . 1 . 2 ]" 1
573 1 57 GLU HA 1 58 ILE H 2.800 . 3.800 3.519 3.496 3.541 . 0 0 "[ . 1 . 2 ]" 1
574 1 57 GLU HA 1 60 LYS H 3.300 . 4.700 4.552 3.853 4.740 0.040 1 0 "[ . 1 . 2 ]" 1
575 1 57 GLU QB 1 57 GLU QG . . 2.300 1.952 1.900 2.064 . 0 0 "[ . 1 . 2 ]" 1
576 1 57 GLU QB 1 58 ILE H 2.800 . 3.100 2.427 1.950 2.735 . 0 0 "[ . 1 . 2 ]" 1
577 1 57 GLU QB 1 60 LYS H 3.600 . 5.300 5.063 4.606 5.169 . 0 0 "[ . 1 . 2 ]" 1
578 1 58 ILE H 1 58 ILE HA 2.400 . 3.100 2.753 2.716 2.778 . 0 0 "[ . 1 . 2 ]" 1
579 1 58 ILE H 1 58 ILE HB 2.100 . 2.600 2.427 2.342 2.510 . 0 0 "[ . 1 . 2 ]" 1
580 1 58 ILE H 1 58 ILE HG13 2.200 . 2.800 2.192 1.963 2.382 . 0 0 "[ . 1 . 2 ]" 1
581 1 58 ILE H 1 59 ALA MB 3.500 . 5.000 4.355 4.268 4.472 . 0 0 "[ . 1 . 2 ]" 1
582 1 58 ILE H 1 60 LYS H 3.800 . 5.600 4.512 4.135 4.626 . 0 0 "[ . 1 . 2 ]" 1
583 1 58 ILE H 1 69 ALA MB 3.100 . 4.300 4.306 3.979 4.392 0.092 2 0 "[ . 1 . 2 ]" 1
584 1 58 ILE HA 1 58 ILE HB 2.500 . 3.300 3.010 3.002 3.018 . 0 0 "[ . 1 . 2 ]" 1
585 1 58 ILE HA 1 58 ILE HG13 2.700 . 3.600 2.678 2.508 2.894 . 0 0 "[ . 1 . 2 ]" 1
586 1 58 ILE HA 1 59 ALA H 3.200 . 4.500 3.460 3.420 3.492 . 0 0 "[ . 1 . 2 ]" 1
587 1 58 ILE HA 1 60 LYS H 3.000 . 4.100 3.313 3.247 3.457 . 0 0 "[ . 1 . 2 ]" 1
588 1 58 ILE HB 1 58 ILE HG13 2.900 . 3.900 2.604 2.514 2.693 . 0 0 "[ . 1 . 2 ]" 1
589 1 58 ILE HB 1 59 ALA H 2.200 . 2.800 2.863 2.774 2.914 0.114 4 0 "[ . 1 . 2 ]" 1
590 1 58 ILE HB 1 69 ALA MB 2.400 . 3.100 2.668 2.234 2.872 . 0 0 "[ . 1 . 2 ]" 1
591 1 59 ALA H 1 59 ALA HA 2.400 . 3.100 2.868 2.845 2.893 . 0 0 "[ . 1 . 2 ]" 1
592 1 59 ALA H 1 59 ALA MB 2.200 . 2.800 2.244 2.192 2.297 . 0 0 "[ . 1 . 2 ]" 1
593 1 59 ALA H 1 60 LYS H 2.400 . 3.100 3.042 2.635 3.136 0.036 19 0 "[ . 1 . 2 ]" 1
594 1 59 ALA H 1 60 LYS HE2 4.200 . 6.000 5.947 4.883 6.564 0.564 12 1 "[ . 1 + . 2 ]" 1
595 1 59 ALA H 1 60 LYS QE 2.700 . 6.000 4.795 4.336 5.481 . 0 0 "[ . 1 . 2 ]" 1
596 1 59 ALA H 1 69 ALA MB 2.400 . 3.100 2.977 2.715 3.144 0.044 15 0 "[ . 1 . 2 ]" 1
597 1 59 ALA HA 1 59 ALA MB 1.900 . 2.300 2.123 2.111 2.129 . 0 0 "[ . 1 . 2 ]" 1
598 1 59 ALA HA 1 60 LYS H 2.500 . 3.300 2.942 2.866 3.119 . 0 0 "[ . 1 . 2 ]" 1
599 1 59 ALA HA 1 61 VAL H 3.100 . 4.300 3.379 3.206 3.560 . 0 0 "[ . 1 . 2 ]" 1
600 1 59 ALA HA 1 69 ALA MB 2.200 . 2.800 2.254 1.811 2.628 . 0 0 "[ . 1 . 2 ]" 1
601 1 59 ALA MB 1 60 LYS H 2.900 . 3.900 3.623 3.470 3.662 . 0 0 "[ . 1 . 2 ]" 1
602 1 59 ALA MB 1 60 LYS HD2 2.000 . 6.000 3.009 2.700 3.813 . 0 0 "[ . 1 . 2 ]" 1
603 1 59 ALA MB 1 60 LYS HD3 2.800 . 3.800 3.444 2.896 3.799 . 0 0 "[ . 1 . 2 ]" 1
604 1 59 ALA MB 1 61 VAL H 3.600 . 5.200 4.466 4.334 4.625 . 0 0 "[ . 1 . 2 ]" 1
605 1 59 ALA MB 1 69 ALA MB 2.100 . 2.700 2.116 1.894 2.434 . 0 0 "[ . 1 . 2 ]" 1
606 1 59 ALA MB 1 70 GLU H 3.600 . 5.200 5.030 4.661 5.292 0.092 8 0 "[ . 1 . 2 ]" 1
607 1 60 LYS H 1 60 LYS HA 2.500 . 3.300 2.948 2.941 2.953 . 0 0 "[ . 1 . 2 ]" 1
608 1 60 LYS H 1 60 LYS HB2 2.400 . 3.100 2.505 2.383 2.600 . 0 0 "[ . 1 . 2 ]" 1
609 1 60 LYS H 1 60 LYS QB 2.300 . 3.000 2.462 2.348 2.551 . 0 0 "[ . 1 . 2 ]" 1
610 1 60 LYS H 1 60 LYS HB3 2.800 . 3.800 3.620 3.437 3.698 . 0 0 "[ . 1 . 2 ]" 1
611 1 60 LYS H 1 60 LYS HD2 2.900 . 3.900 3.448 3.091 4.460 0.560 12 1 "[ . 1 + . 2 ]" 1
612 1 60 LYS H 1 60 LYS QD 2.700 . 3.600 2.960 2.764 3.120 . 0 0 "[ . 1 . 2 ]" 1
613 1 60 LYS H 1 60 LYS HE2 4.000 . 6.000 5.751 5.502 6.022 0.022 12 0 "[ . 1 . 2 ]" 1
614 1 60 LYS H 1 60 LYS QG 3.300 . 4.600 4.002 3.922 4.104 . 0 0 "[ . 1 . 2 ]" 1
615 1 60 LYS H 1 61 VAL H 2.200 . 2.800 2.348 2.112 2.666 . 0 0 "[ . 1 . 2 ]" 1
616 1 60 LYS H 1 62 PRO HD2 4.000 . 6.000 6.196 6.137 6.247 0.247 12 0 "[ . 1 . 2 ]" 1
617 1 60 LYS HA 1 60 LYS HB2 2.500 . 3.300 2.979 2.914 2.997 . 0 0 "[ . 1 . 2 ]" 1
618 1 60 LYS HA 1 60 LYS HB3 2.400 . 3.100 2.655 2.612 2.770 . 0 0 "[ . 1 . 2 ]" 1
619 1 60 LYS HA 1 60 LYS HD2 2.900 . 4.000 2.613 2.156 3.159 . 0 0 "[ . 1 . 2 ]" 1
620 1 60 LYS HA 1 60 LYS QD 2.500 . 3.300 2.541 2.133 3.025 . 0 0 "[ . 1 . 2 ]" 1
621 1 60 LYS HA 1 61 VAL H 3.000 . 4.100 2.912 2.699 3.089 . 0 0 "[ . 1 . 2 ]" 1
622 1 60 LYS QB 1 61 VAL H 3.600 . 5.200 3.706 3.560 3.804 . 0 0 "[ . 1 . 2 ]" 1
623 1 60 LYS HB2 1 60 LYS HD2 3.000 . 4.200 3.169 2.853 3.561 . 0 0 "[ . 1 . 2 ]" 1
624 1 60 LYS HB2 1 61 VAL H 3.000 . 4.100 4.071 3.847 4.237 0.137 17 0 "[ . 1 . 2 ]" 1
625 1 60 LYS HB3 1 60 LYS HD2 2.800 . 3.800 3.786 3.620 4.036 0.236 12 0 "[ . 1 . 2 ]" 1
626 1 60 LYS HB3 1 60 LYS QG 2.500 . 3.300 2.161 2.145 2.170 . 0 0 "[ . 1 . 2 ]" 1
627 1 60 LYS QD 1 61 VAL H 3.600 . 5.200 4.373 4.147 4.677 . 0 0 "[ . 1 . 2 ]" 1
628 1 60 LYS HD2 1 60 LYS QG 2.300 . 2.900 2.296 2.157 2.403 . 0 0 "[ . 1 . 2 ]" 1
629 1 60 LYS HD2 1 61 VAL H 3.600 . 5.200 4.735 4.453 5.319 0.119 12 0 "[ . 1 . 2 ]" 1
630 1 60 LYS QE 1 60 LYS QG 2.300 . 3.000 2.271 2.099 2.511 . 0 0 "[ . 1 . 2 ]" 1
631 1 61 VAL H 1 61 VAL HA 2.500 . 3.300 2.942 2.924 2.958 . 0 0 "[ . 1 . 2 ]" 1
632 1 61 VAL H 1 61 VAL HB 2.300 . 6.000 3.376 3.218 3.507 . 0 0 "[ . 1 . 2 ]" 1
633 1 61 VAL H 1 62 PRO HD2 3.600 . 5.200 4.472 4.407 4.549 . 0 0 "[ . 1 . 2 ]" 1
634 1 61 VAL H 1 62 PRO QD 3.900 . 5.800 4.254 4.211 4.304 . 0 0 "[ . 1 . 2 ]" 1
635 1 61 VAL H 1 62 PRO HD3 3.700 . 5.400 5.334 5.161 5.430 0.030 22 0 "[ . 1 . 2 ]" 1
636 1 61 VAL H 1 64 ILE HB 3.100 . 4.300 2.690 2.166 3.118 . 0 0 "[ . 1 . 2 ]" 1
637 1 61 VAL H 1 64 ILE HG13 3.400 . 4.800 4.530 3.758 4.984 0.184 14 0 "[ . 1 . 2 ]" 1
638 1 61 VAL H 1 65 SER QB 3.900 . 5.800 5.899 5.799 5.972 0.172 10 0 "[ . 1 . 2 ]" 1
639 1 61 VAL HA 1 61 VAL HB 2.500 . 3.300 2.827 2.791 2.889 . 0 0 "[ . 1 . 2 ]" 1
640 1 61 VAL HA 1 62 PRO HD2 2.400 . 3.100 2.629 2.372 3.033 . 0 0 "[ . 1 . 2 ]" 1
641 1 61 VAL HA 1 62 PRO HD3 2.300 . 2.900 2.921 2.746 3.000 0.100 22 0 "[ . 1 . 2 ]" 1
642 1 61 VAL HA 1 64 ILE H 3.900 . 5.800 5.287 4.836 5.758 . 0 0 "[ . 1 . 2 ]" 1
643 1 61 VAL HB 1 64 ILE H 3.300 . 4.600 3.652 2.972 3.867 . 0 0 "[ . 1 . 2 ]" 1
644 1 61 VAL HB 1 64 ILE HB 3.000 . 4.100 2.519 2.083 3.007 . 0 0 "[ . 1 . 2 ]" 1
645 1 61 VAL HB 1 64 ILE HG13 2.400 . 3.100 2.404 1.769 2.941 . 0 0 "[ . 1 . 2 ]" 1
646 1 62 PRO HA 1 63 GLY H 2.300 . 3.000 2.564 2.154 3.404 0.404 19 0 "[ . 1 . 2 ]" 1
647 1 62 PRO QB 1 63 GLY H 3.600 . 5.300 2.847 1.825 3.801 0.075 5 0 "[ . 1 . 2 ]" 1
648 1 62 PRO HB2 1 62 PRO HD2 3.000 . 4.100 4.032 3.913 4.090 . 0 0 "[ . 1 . 2 ]" 1
649 1 62 PRO HB2 1 62 PRO HD3 3.200 . 4.500 3.841 3.775 3.917 . 0 0 "[ . 1 . 2 ]" 1
650 1 62 PRO HB2 1 62 PRO HG2 2.500 . 3.300 2.305 2.251 2.352 . 0 0 "[ . 1 . 2 ]" 1
651 1 62 PRO HB2 1 62 PRO HG3 2.600 . 3.400 2.696 2.635 2.747 . 0 0 "[ . 1 . 2 ]" 1
652 1 62 PRO HB2 1 63 GLY H 3.600 . 5.200 3.043 1.843 4.183 0.157 5 0 "[ . 1 . 2 ]" 1
653 1 62 PRO HB2 1 63 GLY HA3 3.100 . 4.300 4.062 3.714 4.404 0.104 22 0 "[ . 1 . 2 ]" 1
654 1 62 PRO HB2 1 64 ILE H 4.100 . 6.000 3.624 2.869 4.332 . 0 0 "[ . 1 . 2 ]" 1
655 1 62 PRO HB3 1 62 PRO HD2 3.100 . 4.300 3.884 3.798 3.976 . 0 0 "[ . 1 . 2 ]" 1
656 1 62 PRO HB3 1 62 PRO HD3 3.300 . 4.600 2.932 2.772 3.192 . 0 0 "[ . 1 . 2 ]" 1
657 1 62 PRO HB3 1 62 PRO HG2 2.400 . 3.100 2.982 2.933 3.005 . 0 0 "[ . 1 . 2 ]" 1
658 1 62 PRO HB3 1 62 PRO HG3 2.400 . 3.100 2.316 2.265 2.348 . 0 0 "[ . 1 . 2 ]" 1
659 1 62 PRO HB3 1 63 GLY H 4.000 . 6.000 3.646 2.743 4.370 . 0 0 "[ . 1 . 2 ]" 1
660 1 62 PRO HB3 1 63 GLY HA3 2.500 . 6.000 5.343 5.023 5.594 . 0 0 "[ . 1 . 2 ]" 1
661 1 62 PRO HD2 1 62 PRO HG2 2.700 . 3.600 2.317 2.264 2.363 . 0 0 "[ . 1 . 2 ]" 1
662 1 62 PRO HD2 1 62 PRO HG3 2.900 . 4.000 2.636 2.601 2.686 . 0 0 "[ . 1 . 2 ]" 1
663 1 62 PRO HD3 1 62 PRO HG2 2.600 . 3.400 3.001 2.965 3.022 . 0 0 "[ . 1 . 2 ]" 1
664 1 62 PRO HD3 1 62 PRO HG3 2.600 . 3.500 2.337 2.284 2.385 . 0 0 "[ . 1 . 2 ]" 1
665 1 62 PRO HD3 1 64 ILE H 3.400 . 4.800 3.408 3.202 3.479 . 0 0 "[ . 1 . 2 ]" 1
666 1 62 PRO HG2 1 63 GLY H 4.800 . 6.000 4.515 1.986 5.212 0.014 19 0 "[ . 1 . 2 ]" 1
667 1 62 PRO HG2 1 64 ILE HB 3.000 . 6.000 4.511 4.046 5.163 . 0 0 "[ . 1 . 2 ]" 1
668 1 62 PRO HG2 1 64 ILE HG13 3.000 . 4.100 2.567 2.271 2.965 . 0 0 "[ . 1 . 2 ]" 1
669 1 63 GLY H 1 63 GLY HA2 2.500 . 3.300 2.462 2.290 2.889 . 0 0 "[ . 1 . 2 ]" 1
670 1 63 GLY H 1 63 GLY QA 2.500 . 3.300 2.202 2.190 2.237 . 0 0 "[ . 1 . 2 ]" 1
671 1 63 GLY H 1 63 GLY HA3 2.200 . 2.800 2.613 2.330 2.853 0.053 4 0 "[ . 1 . 2 ]" 1
672 1 63 GLY H 1 64 ILE H 2.800 . 3.800 3.016 2.399 3.225 . 0 0 "[ . 1 . 2 ]" 1
673 1 63 GLY H 1 64 ILE HB 4.500 . 6.000 5.322 4.900 5.711 . 0 0 "[ . 1 . 2 ]" 1
674 1 63 GLY QA 1 64 ILE H 3.100 . 4.300 2.802 2.684 2.871 . 0 0 "[ . 1 . 2 ]" 1
675 1 63 GLY HA2 1 64 ILE H 2.600 . 3.500 3.455 3.256 3.523 0.023 9 0 "[ . 1 . 2 ]" 1
676 1 63 GLY HA3 1 64 ILE H 3.100 . 4.300 2.968 2.784 3.190 . 0 0 "[ . 1 . 2 ]" 1
677 1 64 ILE H 1 64 ILE HA 2.300 . 2.900 2.756 2.693 2.871 . 0 0 "[ . 1 . 2 ]" 1
678 1 64 ILE H 1 64 ILE HB 2.300 . 2.900 2.744 2.557 2.947 0.047 3 0 "[ . 1 . 2 ]" 1
679 1 64 ILE H 1 64 ILE HG13 2.300 . 3.000 1.863 1.665 2.122 . 0 0 "[ . 1 . 2 ]" 1
680 1 64 ILE H 1 68 LEU HB2 2.700 . 6.000 4.300 4.004 4.509 . 0 0 "[ . 1 . 2 ]" 1
681 1 64 ILE H 1 68 LEU QB 2.700 . 3.600 3.646 3.511 3.778 0.178 13 0 "[ . 1 . 2 ]" 1
682 1 64 ILE H 1 68 LEU HB3 2.900 . 3.900 3.944 3.792 4.061 0.161 13 0 "[ . 1 . 2 ]" 1
683 1 64 ILE H 1 69 ALA H 3.800 . 5.600 5.603 5.432 5.813 0.213 22 0 "[ . 1 . 2 ]" 1
684 1 64 ILE HA 1 64 ILE HB 2.800 . 3.800 2.995 2.959 3.011 . 0 0 "[ . 1 . 2 ]" 1
685 1 64 ILE HA 1 65 SER H 3.400 . 4.800 2.209 2.048 2.329 . 0 0 "[ . 1 . 2 ]" 1
686 1 64 ILE HA 1 68 LEU HB3 2.200 . 2.800 1.645 1.585 1.767 0.015 14 0 "[ . 1 . 2 ]" 1
687 1 64 ILE HA 1 68 LEU HG 3.000 . 4.100 3.255 3.025 3.418 . 0 0 "[ . 1 . 2 ]" 1
688 1 64 ILE HA 1 69 ALA H 3.000 . 4.200 2.929 2.691 3.292 . 0 0 "[ . 1 . 2 ]" 1
689 1 64 ILE HB 1 64 ILE HG13 2.600 . 3.400 2.373 2.294 2.477 . 0 0 "[ . 1 . 2 ]" 1
690 1 64 ILE HG13 1 68 LEU HG 2.800 . 3.800 3.571 3.189 3.842 0.042 9 0 "[ . 1 . 2 ]" 1
691 1 65 SER H 1 65 SER HA 2.800 . 3.800 2.913 2.834 2.943 . 0 0 "[ . 1 . 2 ]" 1
692 1 65 SER H 1 65 SER HB2 2.500 . 3.300 2.589 2.189 3.577 0.277 15 0 "[ . 1 . 2 ]" 1
693 1 65 SER H 1 65 SER QB 2.700 . 3.600 2.505 2.162 2.920 . 0 0 "[ . 1 . 2 ]" 1
694 1 65 SER H 1 65 SER HB3 2.900 . 3.900 3.541 3.048 3.908 0.008 16 0 "[ . 1 . 2 ]" 1
695 1 65 SER H 1 66 GLN QB 3.300 . 4.700 4.686 4.309 5.025 0.325 12 0 "[ . 1 . 2 ]" 1
696 1 65 SER H 1 67 GLY QA 3.500 . 5.000 4.609 4.067 5.008 0.008 21 0 "[ . 1 . 2 ]" 1
697 1 65 SER H 1 68 LEU HG 3.800 . 5.600 5.250 4.762 5.623 0.023 9 0 "[ . 1 . 2 ]" 1
698 1 65 SER HA 1 66 GLN H 2.600 . 3.500 3.150 2.482 3.554 0.054 6 0 "[ . 1 . 2 ]" 1
699 1 65 SER HA 1 67 GLY H 3.500 . 6.000 5.230 4.496 5.721 . 0 0 "[ . 1 . 2 ]" 1
700 1 65 SER HA 1 69 ALA H 4.300 . 6.000 4.271 3.103 5.459 . 0 0 "[ . 1 . 2 ]" 1
701 1 65 SER QB 1 67 GLY H 3.100 . 4.300 3.674 2.946 4.201 . 0 0 "[ . 1 . 2 ]" 1
702 1 65 SER QB 1 68 LEU H 3.600 . 5.200 4.611 4.108 5.073 . 0 0 "[ . 1 . 2 ]" 1
703 1 65 SER HB2 1 66 GLN H 3.100 . 4.300 2.962 2.193 3.602 . 0 0 "[ . 1 . 2 ]" 1
704 1 65 SER HB2 1 67 GLY H 3.600 . 5.200 4.008 2.990 4.812 . 0 0 "[ . 1 . 2 ]" 1
705 1 65 SER HB2 1 68 LEU H 3.700 . 5.400 4.867 4.260 5.588 0.188 15 0 "[ . 1 . 2 ]" 1
706 1 65 SER HB2 1 69 ALA H 3.800 . 5.600 5.046 4.457 5.661 0.061 21 0 "[ . 1 . 2 ]" 1
707 1 65 SER HB3 1 66 GLN H 2.700 . 3.600 2.745 2.289 3.612 0.012 3 0 "[ . 1 . 2 ]" 1
708 1 65 SER HB3 1 67 GLY H 3.100 . 4.300 4.415 3.965 5.205 0.905 15 1 "[ . 1 + 2 ]" 1
709 1 66 GLN H 1 66 GLN HA 2.700 . 3.600 2.737 2.436 2.943 . 0 0 "[ . 1 . 2 ]" 1
710 1 66 GLN H 1 66 GLN HA 2.400 . 3.100 2.641 2.401 2.823 . 0 0 "[ . 1 . 2 ]" 1
711 1 66 GLN H 1 66 GLN HB2 2.900 . 4.000 2.862 2.353 3.492 . 0 0 "[ . 1 . 2 ]" 1
712 1 66 GLN H 1 66 GLN QB 2.300 . 2.900 2.596 2.313 2.990 0.090 3 0 "[ . 1 . 2 ]" 1
713 1 66 GLN H 1 66 GLN HG2 3.900 . 5.800 4.406 2.305 5.197 . 0 0 "[ . 1 . 2 ]" 1
714 1 66 GLN H 1 67 GLY H 3.500 . 6.000 2.659 1.985 3.600 . 0 0 "[ . 1 . 2 ]" 1
715 1 66 GLN HA 1 66 GLN QB 2.400 . 3.100 2.425 2.369 2.538 . 0 0 "[ . 1 . 2 ]" 1
716 1 66 GLN HA 1 66 GLN HE21 4.200 . 6.000 3.708 2.590 4.638 . 0 0 "[ . 1 . 2 ]" 1
717 1 66 GLN HA 1 67 GLY H 3.700 . 5.400 3.568 3.531 3.590 . 0 0 "[ . 1 . 2 ]" 1
718 1 66 GLN HA 1 71 LYS H 2.900 . 4.000 3.772 3.659 3.931 . 0 0 "[ . 1 . 2 ]" 1
719 1 66 GLN HA 1 69 ALA H 2.300 . 3.000 2.672 2.623 2.708 . 0 0 "[ . 1 . 2 ]" 1
720 1 66 GLN HA 1 69 ALA MB 2.000 . 2.500 1.926 1.737 2.052 . 0 0 "[ . 1 . 2 ]" 1
721 1 66 GLN QB 1 67 GLY HA2 2.700 . 3.600 3.592 3.412 3.679 0.079 19 0 "[ . 1 . 2 ]" 1
722 1 66 GLN QB 1 67 GLY H 2.600 . 3.400 2.213 2.086 2.450 . 0 0 "[ . 1 . 2 ]" 1
723 1 66 GLN QB 1 68 LEU H 3.700 . 5.500 4.830 4.581 4.965 . 0 0 "[ . 1 . 2 ]" 1
724 1 66 GLN QB 1 69 ALA H 3.500 . 5.000 4.924 4.769 5.044 0.044 16 0 "[ . 1 . 2 ]" 1
725 1 66 GLN HE21 1 66 GLN QG 2.200 . 2.800 2.225 2.128 2.804 0.004 18 0 "[ . 1 . 2 ]" 1
726 1 66 GLN HE21 1 69 ALA MB 4.300 . 6.000 4.881 3.500 5.914 . 0 0 "[ . 1 . 2 ]" 1
727 1 66 GLN HE21 1 70 GLU HG2 3.600 . 5.300 3.489 2.613 5.129 . 0 0 "[ . 1 . 2 ]" 1
728 1 66 GLN HE21 1 70 GLU HG3 3.200 . 4.500 3.140 1.865 4.416 0.035 22 0 "[ . 1 . 2 ]" 1
729 1 66 GLN QG 1 67 GLY H 3.900 . 5.800 3.806 3.314 4.324 . 0 0 "[ . 1 . 2 ]" 1
730 1 66 GLN QG 1 69 ALA H 4.000 . 6.000 5.752 5.378 6.167 0.167 20 0 "[ . 1 . 2 ]" 1
731 1 66 GLN HG2 1 70 GLU HG2 2.000 . 6.000 5.254 3.969 6.020 0.020 7 0 "[ . 1 . 2 ]" 1
732 1 67 GLY H 1 67 GLY QA 2.100 . 2.700 2.203 2.192 2.215 . 0 0 "[ . 1 . 2 ]" 1
733 1 67 GLY H 1 67 GLY HA3 2.300 . 2.900 2.306 2.295 2.319 . 0 0 "[ . 1 . 2 ]" 1
734 1 67 GLY H 1 68 LEU H 2.300 . 3.000 2.963 2.902 3.025 0.025 14 0 "[ . 1 . 2 ]" 1
735 1 67 GLY H 1 68 LEU HB2 4.200 . 6.000 5.026 4.852 5.246 . 0 0 "[ . 1 . 2 ]" 1
736 1 67 GLY H 1 68 LEU HB3 4.000 . 6.000 5.549 5.191 5.761 . 0 0 "[ . 1 . 2 ]" 1
737 1 67 GLY H 1 69 ALA H 3.500 . 5.000 3.925 3.775 4.234 . 0 0 "[ . 1 . 2 ]" 1
738 1 67 GLY QA 1 68 LEU H 2.500 . 3.300 2.481 2.447 2.635 . 0 0 "[ . 1 . 2 ]" 1
739 1 67 GLY QA 1 70 GLU H 3.600 . 5.200 3.873 3.130 4.405 . 0 0 "[ . 1 . 2 ]" 1
740 1 67 GLY HA3 1 68 LEU H 2.700 . 3.600 2.533 2.494 2.716 . 0 0 "[ . 1 . 2 ]" 1
741 1 68 LEU H 1 68 LEU HA 2.500 . 3.300 2.837 2.735 2.904 . 0 0 "[ . 1 . 2 ]" 1
742 1 68 LEU H 1 68 LEU HB2 2.300 . 3.000 2.193 2.075 2.316 . 0 0 "[ . 1 . 2 ]" 1
743 1 68 LEU H 1 68 LEU QB 2.300 . 3.000 2.134 2.042 2.228 . 0 0 "[ . 1 . 2 ]" 1
744 1 68 LEU H 1 68 LEU HB3 2.400 . 3.100 2.940 2.807 3.072 . 0 0 "[ . 1 . 2 ]" 1
745 1 68 LEU H 1 68 LEU HG 3.000 . 6.000 4.587 4.473 4.668 . 0 0 "[ . 1 . 2 ]" 1
746 1 68 LEU H 1 69 ALA H 2.400 . 3.100 2.497 2.282 2.693 . 0 0 "[ . 1 . 2 ]" 1
747 1 68 LEU H 1 69 ALA MB 3.300 . 4.700 4.145 3.933 4.327 . 0 0 "[ . 1 . 2 ]" 1
748 1 68 LEU H 1 71 LYS HB3 4.500 . 6.000 6.079 5.985 6.204 0.204 3 0 "[ . 1 . 2 ]" 1
749 1 68 LEU HA 1 68 LEU HB2 2.600 . 3.400 2.704 2.623 2.768 . 0 0 "[ . 1 . 2 ]" 1
750 1 68 LEU HA 1 68 LEU HB3 2.400 . 3.100 2.964 2.935 3.002 . 0 0 "[ . 1 . 2 ]" 1
751 1 68 LEU HA 1 68 LEU HG 2.300 . 6.000 3.675 3.639 3.755 . 0 0 "[ . 1 . 2 ]" 1
752 1 68 LEU HA 1 69 ALA H 2.900 . 3.900 3.503 3.472 3.531 . 0 0 "[ . 1 . 2 ]" 1
753 1 68 LEU HA 1 70 GLU H 3.400 . 4.900 4.475 4.091 4.819 . 0 0 "[ . 1 . 2 ]" 1
754 1 68 LEU HA 1 71 LYS H 3.000 . 4.100 3.204 2.919 3.447 . 0 0 "[ . 1 . 2 ]" 1
755 1 68 LEU HA 1 71 LYS H 2.200 . 2.800 2.583 2.500 2.648 . 0 0 "[ . 1 . 2 ]" 1
756 1 68 LEU HA 1 71 LYS HB2 2.000 . 2.500 1.906 1.746 2.290 . 0 0 "[ . 1 . 2 ]" 1
757 1 68 LEU HA 1 72 ILE H 2.800 . 3.800 3.262 3.224 3.285 . 0 0 "[ . 1 . 2 ]" 1
758 1 68 LEU HA 1 71 LYS HB2 2.500 . 3.300 1.931 1.759 2.372 . 0 0 "[ . 1 . 2 ]" 1
759 1 68 LEU HA 1 72 ILE H 3.100 . 4.300 3.888 3.731 4.002 . 0 0 "[ . 1 . 2 ]" 1
760 1 68 LEU HA 1 73 PHE H 3.800 . 6.000 6.097 6.023 6.160 0.160 18 0 "[ . 1 . 2 ]" 1
761 1 68 LEU QB 1 69 ALA H 2.700 . 3.600 2.483 2.318 2.613 . 0 0 "[ . 1 . 2 ]" 1
762 1 68 LEU HB2 1 68 LEU HG 2.400 . 3.100 2.523 2.466 2.570 . 0 0 "[ . 1 . 2 ]" 1
763 1 68 LEU HB2 1 69 ALA H 2.500 . 3.300 3.366 3.238 3.438 0.138 21 0 "[ . 1 . 2 ]" 1
764 1 68 LEU HB2 1 71 LYS H 3.300 . 6.000 5.544 5.371 5.697 . 0 0 "[ . 1 . 2 ]" 1
765 1 68 LEU HB3 1 68 LEU HG 2.100 . 2.700 2.354 2.313 2.408 . 0 0 "[ . 1 . 2 ]" 1
766 1 68 LEU HB3 1 69 ALA H 2.500 . 3.300 2.560 2.357 2.733 . 0 0 "[ . 1 . 2 ]" 1
767 1 68 LEU HB3 1 69 ALA MB 2.300 . 6.000 4.034 3.867 4.174 . 0 0 "[ . 1 . 2 ]" 1
768 1 68 LEU HB3 1 72 ILE H 3.600 . 5.200 4.929 4.630 5.119 . 0 0 "[ . 1 . 2 ]" 1
769 1 69 ALA H 1 69 ALA HA 2.500 . 3.300 2.719 2.685 2.763 . 0 0 "[ . 1 . 2 ]" 1
770 1 69 ALA H 1 69 ALA MB 2.300 . 3.000 2.245 2.209 2.272 . 0 0 "[ . 1 . 2 ]" 1
771 1 69 ALA H 1 70 GLU H 2.700 . 3.600 2.967 2.785 3.085 . 0 0 "[ . 1 . 2 ]" 1
772 1 69 ALA H 1 70 GLU HA 3.200 . 6.000 5.487 5.370 5.554 . 0 0 "[ . 1 . 2 ]" 1
773 1 69 ALA H 1 70 GLU QB 3.600 . 5.300 4.908 4.483 5.197 . 0 0 "[ . 1 . 2 ]" 1
774 1 69 ALA H 1 70 GLU HG2 3.900 . 5.800 5.752 5.055 5.947 0.147 13 0 "[ . 1 . 2 ]" 1
775 1 69 ALA H 1 71 LYS H 3.400 . 4.800 4.147 4.005 4.212 . 0 0 "[ . 1 . 2 ]" 1
776 1 69 ALA H 1 71 LYS QE 4.400 . 6.000 5.668 5.163 5.833 . 0 0 "[ . 1 . 2 ]" 1
777 1 69 ALA H 1 72 ILE H 3.200 . 4.500 4.594 4.544 4.665 0.165 13 0 "[ . 1 . 2 ]" 1
778 1 69 ALA H 1 72 ILE HB 3.800 . 5.600 5.315 4.990 5.510 . 0 0 "[ . 1 . 2 ]" 1
779 1 69 ALA HA 1 69 ALA MB 2.000 . 2.500 2.128 2.123 2.134 . 0 0 "[ . 1 . 2 ]" 1
780 1 69 ALA HA 1 70 GLU H 3.100 . 4.300 3.552 3.527 3.572 . 0 0 "[ . 1 . 2 ]" 1
781 1 69 ALA HA 1 71 LYS H 3.900 . 5.800 4.607 4.446 4.705 . 0 0 "[ . 1 . 2 ]" 1
782 1 69 ALA HA 1 72 ILE H 3.100 . 4.300 3.551 3.346 3.683 . 0 0 "[ . 1 . 2 ]" 1
783 1 69 ALA HA 1 72 ILE HB 2.900 . 3.900 3.037 2.585 3.274 . 0 0 "[ . 1 . 2 ]" 1
784 1 69 ALA HA 1 72 ILE HG13 2.600 . 3.500 3.378 2.778 3.576 0.076 3 0 "[ . 1 . 2 ]" 1
785 1 69 ALA HA 1 73 PHE H 3.700 . 5.400 3.970 3.757 4.121 . 0 0 "[ . 1 . 2 ]" 1
786 1 69 ALA MB 1 70 GLU H 2.300 . 2.900 2.281 2.107 2.550 . 0 0 "[ . 1 . 2 ]" 1
787 1 69 ALA MB 1 71 LYS H 3.900 . 5.800 4.394 4.273 4.550 . 0 0 "[ . 1 . 2 ]" 1
788 1 70 GLU H 1 70 GLU HA 2.300 . 3.000 2.806 2.750 2.849 . 0 0 "[ . 1 . 2 ]" 1
789 1 70 GLU H 1 70 GLU HB2 2.300 . 2.900 2.521 2.233 2.883 . 0 0 "[ . 1 . 2 ]" 1
790 1 70 GLU H 1 70 GLU HB3 3.000 . 4.100 3.584 3.513 3.607 . 0 0 "[ . 1 . 2 ]" 1
791 1 70 GLU H 1 70 GLU HG2 2.600 . 3.400 2.958 2.521 3.201 . 0 0 "[ . 1 . 2 ]" 1
792 1 70 GLU H 1 70 GLU QG 2.500 . 3.300 2.271 1.772 2.622 . 0 0 "[ . 1 . 2 ]" 1
793 1 70 GLU H 1 70 GLU HG3 2.300 . 2.900 2.407 1.801 3.417 0.517 19 1 "[ . 1 . +2 ]" 1
794 1 70 GLU H 1 71 LYS H 2.200 . 2.800 2.644 2.481 2.802 0.002 15 0 "[ . 1 . 2 ]" 1
795 1 70 GLU H 1 71 LYS QB 3.300 . 4.700 4.370 4.076 4.538 . 0 0 "[ . 1 . 2 ]" 1
796 1 70 GLU H 1 72 ILE H 3.800 . 5.600 4.054 3.896 4.319 . 0 0 "[ . 1 . 2 ]" 1
797 1 70 GLU H 1 73 PHE HB2 4.100 . 6.000 5.027 4.678 5.447 . 0 0 "[ . 1 . 2 ]" 1
798 1 70 GLU H 1 73 PHE HB3 4.100 . 6.000 4.647 4.364 4.917 . 0 0 "[ . 1 . 2 ]" 1
799 1 70 GLU HA 1 70 GLU HB2 2.400 . 3.100 3.017 2.970 3.029 . 0 0 "[ . 1 . 2 ]" 1
800 1 70 GLU HA 1 70 GLU HB3 2.300 . 3.000 2.476 2.338 2.587 . 0 0 "[ . 1 . 2 ]" 1
801 1 70 GLU HA 1 70 GLU HG2 2.500 . 3.300 2.452 2.260 2.813 . 0 0 "[ . 1 . 2 ]" 1
802 1 70 GLU HA 1 70 GLU HG3 2.600 . 3.400 3.404 3.226 3.623 0.223 19 0 "[ . 1 . 2 ]" 1
803 1 70 GLU HA 1 71 LYS H 3.100 . 4.300 3.520 3.497 3.534 . 0 0 "[ . 1 . 2 ]" 1
804 1 70 GLU HA 1 72 ILE H 3.900 . 5.800 4.173 3.903 4.567 . 0 0 "[ . 1 . 2 ]" 1
805 1 70 GLU HA 1 73 PHE HB2 2.700 . 3.600 2.917 2.354 3.534 . 0 0 "[ . 1 . 2 ]" 1
806 1 70 GLU HA 1 73 PHE HB3 2.900 . 3.900 2.056 1.880 2.319 0.020 22 0 "[ . 1 . 2 ]" 1
807 1 70 GLU HA 1 73 PHE QD 2.900 . 4.000 3.666 3.081 4.028 0.028 20 0 "[ . 1 . 2 ]" 1
808 1 70 GLU HA 1 74 TRP HE1 4.200 . 6.000 4.105 3.524 4.893 . 0 0 "[ . 1 . 2 ]" 1
809 1 70 GLU QB 1 70 GLU HG2 2.600 . 3.400 2.441 2.351 2.514 . 0 0 "[ . 1 . 2 ]" 1
810 1 70 GLU QB 1 71 LYS H 2.400 . 3.100 2.338 2.188 2.471 . 0 0 "[ . 1 . 2 ]" 1
811 1 70 GLU QB 1 72 ILE H 2.400 . 6.000 4.508 4.398 4.679 . 0 0 "[ . 1 . 2 ]" 1
812 1 70 GLU QB 1 73 PHE H 3.300 . 4.600 4.567 4.371 4.690 0.090 19 0 "[ . 1 . 2 ]" 1
813 1 70 GLU HB2 1 70 GLU HG2 2.700 . 3.600 2.939 2.533 2.993 . 0 0 "[ . 1 . 2 ]" 1
814 1 70 GLU HB2 1 70 GLU HG3 1.700 . 2.200 2.278 2.211 2.372 0.172 15 0 "[ . 1 . 2 ]" 1
815 1 70 GLU HB2 1 71 LYS H 2.500 . 3.300 2.378 2.248 2.522 . 0 0 "[ . 1 . 2 ]" 1
816 1 70 GLU HB3 1 71 LYS H 2.800 . 3.800 3.474 3.008 3.770 . 0 0 "[ . 1 . 2 ]" 1
817 1 70 GLU HB3 1 72 ILE H 4.300 . 6.000 5.375 5.195 5.663 . 0 0 "[ . 1 . 2 ]" 1
818 1 70 GLU HB3 1 74 TRP HE1 3.800 . 5.600 2.274 1.939 3.089 0.061 20 0 "[ . 1 . 2 ]" 1
819 1 70 GLU QG 1 71 LYS H 3.700 . 5.400 3.823 3.332 4.022 . 0 0 "[ . 1 . 2 ]" 1
820 1 70 GLU HG2 1 71 LYS H 3.600 . 5.200 4.635 4.310 4.746 . 0 0 "[ . 1 . 2 ]" 1
821 1 70 GLU HG2 1 74 TRP HE1 4.000 . 6.000 4.510 3.880 5.573 . 0 0 "[ . 1 . 2 ]" 1
822 1 70 GLU HG3 1 71 LYS H 4.100 . 6.000 4.088 3.437 4.446 . 0 0 "[ . 1 . 2 ]" 1
823 1 70 GLU HG3 1 74 TRP HE1 3.700 . 5.400 4.828 4.398 5.438 0.038 16 0 "[ . 1 . 2 ]" 1
824 1 71 LYS H 1 71 LYS HA 2.500 . 3.300 2.728 2.708 2.772 . 0 0 "[ . 1 . 2 ]" 1
825 1 71 LYS H 1 71 LYS HB2 2.000 . 2.500 2.353 2.113 2.603 0.103 3 0 "[ . 1 . 2 ]" 1
826 1 71 LYS H 1 71 LYS HB3 2.600 . 3.400 3.506 3.430 3.539 0.139 1 0 "[ . 1 . 2 ]" 1
827 1 71 LYS H 1 71 LYS HD2 2.800 . 3.800 3.406 3.156 3.811 0.011 3 0 "[ . 1 . 2 ]" 1
828 1 71 LYS H 1 71 LYS HD3 3.000 . 4.200 1.907 1.720 2.521 0.080 19 0 "[ . 1 . 2 ]" 1
829 1 71 LYS H 1 71 LYS QE 3.100 . 4.300 3.484 3.089 3.903 . 0 0 "[ . 1 . 2 ]" 1
830 1 71 LYS H 1 71 LYS HG2 2.800 . 3.800 3.016 1.875 3.872 0.072 14 0 "[ . 1 . 2 ]" 1
831 1 71 LYS H 1 72 ILE H 2.400 . 3.100 2.788 2.642 2.961 . 0 0 "[ . 1 . 2 ]" 1
832 1 71 LYS H 1 72 ILE HA 4.000 . 6.000 5.386 5.275 5.487 . 0 0 "[ . 1 . 2 ]" 1
833 1 71 LYS H 1 72 ILE HG13 3.400 . 4.800 4.375 4.172 4.536 . 0 0 "[ . 1 . 2 ]" 1
834 1 71 LYS H 1 73 PHE H 3.500 . 5.000 4.077 3.878 4.224 . 0 0 "[ . 1 . 2 ]" 1
835 1 71 LYS HA 1 71 LYS QB 2.300 . 3.000 2.427 2.331 2.514 . 0 0 "[ . 1 . 2 ]" 1
836 1 71 LYS HA 1 71 LYS HD2 3.500 . 5.100 2.259 2.038 2.699 . 0 0 "[ . 1 . 2 ]" 1
837 1 71 LYS HA 1 71 LYS HD3 2.800 . 3.800 2.365 2.008 2.728 . 0 0 "[ . 1 . 2 ]" 1
838 1 71 LYS HA 1 71 LYS HG3 2.800 . 3.800 3.113 2.531 3.736 . 0 0 "[ . 1 . 2 ]" 1
839 1 71 LYS HA 1 73 PHE H 3.700 . 5.400 4.617 4.289 4.835 . 0 0 "[ . 1 . 2 ]" 1
840 1 71 LYS HA 1 74 TRP HD1 3.400 . 4.800 2.496 1.888 4.063 0.112 18 0 "[ . 1 . 2 ]" 1
841 1 71 LYS QB 1 71 LYS HD3 2.900 . 3.900 2.852 2.378 3.078 . 0 0 "[ . 1 . 2 ]" 1
842 1 71 LYS QB 1 71 LYS HG3 2.600 . 3.400 2.165 2.113 2.305 . 0 0 "[ . 1 . 2 ]" 1
843 1 71 LYS HB2 1 72 ILE H 2.400 . 3.100 2.603 2.327 2.775 . 0 0 "[ . 1 . 2 ]" 1
844 1 71 LYS HB3 1 71 LYS HD2 2.800 . 3.800 3.408 2.661 3.937 0.137 14 0 "[ . 1 . 2 ]" 1
845 1 71 LYS HB3 1 72 ILE H 2.600 . 3.500 3.413 2.925 3.608 0.108 10 0 "[ . 1 . 2 ]" 1
846 1 71 LYS HD3 1 72 ILE H 3.600 . 5.200 4.331 4.172 4.702 . 0 0 "[ . 1 . 2 ]" 1
847 1 71 LYS HD3 1 73 PHE H 4.000 . 6.000 5.598 5.328 5.981 . 0 0 "[ . 1 . 2 ]" 1
848 1 71 LYS HG2 1 72 ILE H 3.400 . 4.800 4.612 3.854 4.899 0.099 15 0 "[ . 1 . 2 ]" 1
849 1 72 ILE H 1 72 ILE HA 2.600 . 3.400 2.872 2.808 2.908 . 0 0 "[ . 1 . 2 ]" 1
850 1 72 ILE H 1 72 ILE HB 2.100 . 2.600 2.536 2.396 2.643 0.043 20 0 "[ . 1 . 2 ]" 1
851 1 72 ILE H 1 72 ILE HG13 2.800 . 3.800 2.146 1.960 2.246 . 0 0 "[ . 1 . 2 ]" 1
852 1 72 ILE H 1 73 PHE H 2.700 . 3.600 2.406 2.248 2.597 . 0 0 "[ . 1 . 2 ]" 1
853 1 72 ILE H 1 73 PHE HB2 3.800 . 5.600 4.886 4.568 5.258 . 0 0 "[ . 1 . 2 ]" 1
854 1 72 ILE H 1 73 PHE HB3 4.200 . 6.000 4.402 4.166 4.653 . 0 0 "[ . 1 . 2 ]" 1
855 1 72 ILE HA 1 72 ILE HB 2.400 . 3.100 3.015 3.002 3.021 . 0 0 "[ . 1 . 2 ]" 1
856 1 72 ILE HA 1 72 ILE HG13 3.200 . 4.500 3.145 2.811 3.409 . 0 0 "[ . 1 . 2 ]" 1
857 1 72 ILE HA 1 73 PHE H 3.000 . 4.100 3.504 3.442 3.542 . 0 0 "[ . 1 . 2 ]" 1
858 1 72 ILE HA 1 74 TRP H 2.700 . 3.600 3.251 2.955 3.635 0.035 15 0 "[ . 1 . 2 ]" 1
859 1 72 ILE HA 1 76 LEU H 4.100 . 6.000 4.771 3.908 5.481 . 0 0 "[ . 1 . 2 ]" 1
860 1 72 ILE HB 1 73 PHE H 2.300 . 2.900 2.510 2.328 2.698 . 0 0 "[ . 1 . 2 ]" 1
861 1 72 ILE HG13 1 73 PHE H 3.000 . 4.100 3.979 3.822 4.145 0.045 3 0 "[ . 1 . 2 ]" 1
862 1 73 PHE H 1 73 PHE HA 2.600 . 3.500 2.760 2.712 2.802 . 0 0 "[ . 1 . 2 ]" 1
863 1 73 PHE H 1 73 PHE HB2 2.300 . 3.000 2.640 2.445 2.850 . 0 0 "[ . 1 . 2 ]" 1
864 1 73 PHE H 1 73 PHE QB 2.300 . 2.900 2.222 2.115 2.282 . 0 0 "[ . 1 . 2 ]" 1
865 1 73 PHE H 1 73 PHE HB3 2.300 . 3.000 2.413 2.195 2.604 . 0 0 "[ . 1 . 2 ]" 1
866 1 73 PHE H 1 73 PHE QD 3.100 . 4.300 4.126 3.971 4.189 . 0 0 "[ . 1 . 2 ]" 1
867 1 73 PHE H 1 74 TRP H 2.800 . 3.800 2.854 2.565 3.108 . 0 0 "[ . 1 . 2 ]" 1
868 1 73 PHE H 1 74 TRP HA 3.100 . 6.000 5.411 5.205 5.588 . 0 0 "[ . 1 . 2 ]" 1
869 1 73 PHE HA 1 73 PHE HB2 2.600 . 3.500 2.385 2.300 2.467 . 0 0 "[ . 1 . 2 ]" 1
870 1 73 PHE HA 1 73 PHE HB3 2.500 . 3.300 3.014 2.977 3.028 . 0 0 "[ . 1 . 2 ]" 1
871 1 73 PHE HA 1 73 PHE QD 2.600 . 3.400 2.983 2.309 3.242 . 0 0 "[ . 1 . 2 ]" 1
872 1 73 PHE HA 1 74 TRP H 2.700 . 3.600 3.535 3.479 3.562 . 0 0 "[ . 1 . 2 ]" 1
873 1 73 PHE HA 1 76 LEU H 3.600 . 5.300 3.933 3.270 5.072 . 0 0 "[ . 1 . 2 ]" 1
874 1 73 PHE HB2 1 73 PHE QD 2.400 . 3.100 2.385 2.266 2.631 . 0 0 "[ . 1 . 2 ]" 1
875 1 73 PHE HB2 1 74 TRP H 2.900 . 3.900 3.813 3.547 3.937 0.037 18 0 "[ . 1 . 2 ]" 1
876 1 73 PHE HB3 1 73 PHE QD 2.500 . 3.300 2.410 2.258 2.627 . 0 0 "[ . 1 . 2 ]" 1
877 1 73 PHE HB3 1 74 TRP H 2.600 . 3.500 2.427 2.063 2.706 . 0 0 "[ . 1 . 2 ]" 1
878 1 73 PHE QD 1 74 TRP H 3.100 . 4.300 2.764 2.264 3.786 . 0 0 "[ . 1 . 2 ]" 1
879 1 73 PHE QD 1 74 TRP HA 2.900 . 3.900 2.950 2.419 3.928 0.028 9 0 "[ . 1 . 2 ]" 1
880 1 73 PHE HZ 1 78 HIS QB 3.100 . 4.300 3.907 1.982 4.293 . 0 0 "[ . 1 . 2 ]" 1
881 1 74 TRP H 1 74 TRP HA 2.700 . 3.600 2.804 2.755 2.878 . 0 0 "[ . 1 . 2 ]" 1
882 1 74 TRP H 1 74 TRP HB2 2.600 . 3.500 2.601 2.214 2.875 . 0 0 "[ . 1 . 2 ]" 1
883 1 74 TRP H 1 74 TRP HB3 2.700 . 3.600 3.575 3.501 3.615 0.015 18 0 "[ . 1 . 2 ]" 1
884 1 74 TRP H 1 74 TRP HB3 3.100 . 4.300 3.144 2.628 3.233 . 0 0 "[ . 1 . 2 ]" 1
885 1 74 TRP H 1 74 TRP HD1 3.400 . 4.900 3.062 2.304 3.947 . 0 0 "[ . 1 . 2 ]" 1
886 1 74 TRP HA 1 74 TRP HB2 2.600 . 3.400 3.016 2.992 3.035 . 0 0 "[ . 1 . 2 ]" 1
887 1 74 TRP HA 1 74 TRP HB3 2.500 . 3.300 2.434 2.319 2.630 . 0 0 "[ . 1 . 2 ]" 1
888 1 74 TRP HA 1 74 TRP HB3 2.400 . 3.100 2.162 2.071 2.376 . 0 0 "[ . 1 . 2 ]" 1
889 1 74 TRP HA 1 74 TRP HE3 2.400 . 3.100 2.465 1.723 3.158 0.058 6 0 "[ . 1 . 2 ]" 1
890 1 74 TRP HA 1 74 TRP HZ3 2.800 . 6.000 4.715 4.163 5.283 . 0 0 "[ . 1 . 2 ]" 1
891 1 74 TRP HA 1 74 TRP HZ3 3.000 . 4.100 3.739 3.126 4.115 0.015 4 0 "[ . 1 . 2 ]" 1
892 1 74 TRP HA 1 77 LYS H 3.700 . 5.400 4.646 3.319 5.474 0.074 9 0 "[ . 1 . 2 ]" 1
893 1 74 TRP HB2 1 74 TRP HD1 3.300 . 4.600 2.578 2.532 2.674 . 0 0 "[ . 1 . 2 ]" 1
894 1 74 TRP HB2 1 74 TRP HE3 3.200 . 4.500 4.184 4.095 4.227 . 0 0 "[ . 1 . 2 ]" 1
895 1 74 TRP HB2 1 75 SER H 3.200 . 4.500 3.080 2.288 3.368 . 0 0 "[ . 1 . 2 ]" 1
896 1 74 TRP HB3 1 74 TRP HE3 2.700 . 3.600 2.911 2.550 3.476 . 0 0 "[ . 1 . 2 ]" 1
897 1 75 SER H 1 75 SER HA 2.700 . 3.600 2.837 2.627 2.934 . 0 0 "[ . 1 . 2 ]" 1
898 1 75 SER H 1 75 SER HB2 3.000 . 4.100 2.634 2.288 3.073 . 0 0 "[ . 1 . 2 ]" 1
899 1 75 SER H 1 75 SER QB 2.600 . 3.400 2.557 2.189 2.864 . 0 0 "[ . 1 . 2 ]" 1
900 1 75 SER H 1 76 LEU H 2.500 . 3.300 2.733 2.083 3.236 . 0 0 "[ . 1 . 2 ]" 1
901 1 75 SER H 1 77 LYS H 4.000 . 6.000 4.472 3.646 5.512 . 0 0 "[ . 1 . 2 ]" 1
902 1 75 SER HA 1 76 LEU H 3.400 . 4.900 3.486 3.012 3.587 . 0 0 "[ . 1 . 2 ]" 1
903 1 75 SER HA 1 77 LYS H 3.800 . 5.600 5.479 4.778 5.759 0.159 21 0 "[ . 1 . 2 ]" 1
904 1 76 LEU H 1 76 LEU HA 2.700 . 3.600 2.882 2.724 2.957 . 0 0 "[ . 1 . 2 ]" 1
905 1 76 LEU H 1 76 LEU HB2 3.000 . 4.100 3.272 2.017 3.680 . 0 0 "[ . 1 . 2 ]" 1
906 1 76 LEU H 1 76 LEU QB 2.400 . 3.100 2.939 2.002 3.237 0.137 6 0 "[ . 1 . 2 ]" 1
907 1 76 LEU H 1 76 LEU HB3 2.600 . 3.400 3.475 3.084 3.826 0.426 19 0 "[ . 1 . 2 ]" 1
908 1 76 LEU H 1 77 LYS H 2.600 . 3.400 2.498 1.884 3.368 . 0 0 "[ . 1 . 2 ]" 1
909 1 76 LEU H 1 77 LYS QD 3.800 . 5.600 4.743 3.879 5.528 . 0 0 "[ . 1 . 2 ]" 1
910 1 76 LEU HA 1 76 LEU HB2 2.700 . 3.600 2.761 2.642 2.957 . 0 0 "[ . 1 . 2 ]" 1
911 1 76 LEU HA 1 76 LEU HB3 2.500 . 3.300 2.284 2.186 2.706 . 0 0 "[ . 1 . 2 ]" 1
912 1 76 LEU HA 1 77 LYS H 2.800 . 3.800 3.499 3.402 3.596 . 0 0 "[ . 1 . 2 ]" 1
913 1 76 LEU HB2 1 77 LYS H 2.500 . 3.300 2.624 1.804 3.410 0.110 3 0 "[ . 1 . 2 ]" 1
914 1 76 LEU HB2 1 77 LYS QD 2.500 . 3.300 2.739 1.700 3.402 0.102 9 0 "[ . 1 . 2 ]" 1
915 1 76 LEU HB2 1 77 LYS HG3 2.900 . 6.000 5.375 3.679 6.149 0.149 9 0 "[ . 1 . 2 ]" 1
916 1 77 LYS H 1 77 LYS HA 2.600 . 3.500 2.809 2.255 2.938 . 0 0 "[ . 1 . 2 ]" 1
917 1 77 LYS H 1 77 LYS HB2 2.700 . 3.600 2.527 2.015 3.750 0.150 10 0 "[ . 1 . 2 ]" 1
918 1 77 LYS H 1 77 LYS QB 2.400 . 3.100 2.349 1.996 2.945 . 0 0 "[ . 1 . 2 ]" 1
919 1 77 LYS H 1 77 LYS HB3 2.800 . 3.800 3.382 2.430 3.824 0.024 21 0 "[ . 1 . 2 ]" 1
920 1 77 LYS H 1 77 LYS QD 2.500 . 3.300 2.937 1.937 3.534 0.234 2 0 "[ . 1 . 2 ]" 1
921 1 77 LYS H 1 77 LYS QG 3.200 . 4.400 3.423 1.745 4.296 0.255 2 0 "[ . 1 . 2 ]" 1
922 1 77 LYS H 1 78 HIS H 2.500 . 3.300 2.894 1.793 3.441 0.141 3 0 "[ . 1 . 2 ]" 1
923 1 77 LYS HA 1 77 LYS HB2 2.700 . 3.600 2.829 2.235 3.017 . 0 0 "[ . 1 . 2 ]" 1
924 1 77 LYS HA 1 77 LYS HB3 2.500 . 3.300 2.687 2.326 2.944 . 0 0 "[ . 1 . 2 ]" 1
925 1 77 LYS HA 1 77 LYS QD 2.700 . 3.600 2.545 1.797 3.822 0.222 2 0 "[ . 1 . 2 ]" 1
926 1 77 LYS HA 1 77 LYS QG 2.400 . 3.100 2.593 2.045 3.308 0.208 2 0 "[ . 1 . 2 ]" 1
927 1 77 LYS HA 1 77 LYS HG3 3.000 . 4.100 2.854 2.062 4.119 0.019 10 0 "[ . 1 . 2 ]" 1
928 1 77 LYS HA 1 78 HIS H 2.500 . 6.000 3.215 2.161 3.593 . 0 0 "[ . 1 . 2 ]" 1
929 1 77 LYS QB 1 78 HIS H 3.100 . 4.300 3.030 1.852 3.954 0.048 22 0 "[ . 1 . 2 ]" 1
930 1 77 LYS HB2 1 77 LYS QD 2.700 . 3.600 2.671 1.963 3.464 . 0 0 "[ . 1 . 2 ]" 1
931 1 77 LYS HB2 1 77 LYS QG 2.900 . 3.900 2.325 2.145 2.502 . 0 0 "[ . 1 . 2 ]" 1
932 1 77 LYS HB2 1 78 HIS H 3.300 . 4.600 3.503 1.961 4.566 0.039 4 0 "[ . 1 . 2 ]" 1
933 1 77 LYS HB3 1 77 LYS QD 2.600 . 3.500 3.119 2.276 3.481 . 0 0 "[ . 1 . 2 ]" 1
934 1 77 LYS HB3 1 78 HIS H 3.200 . 4.500 3.451 1.884 4.582 0.082 2 0 "[ . 1 . 2 ]" 1
935 1 77 LYS QD 1 77 LYS QG 1.900 . 2.400 2.050 2.001 2.089 . 0 0 "[ . 1 . 2 ]" 1
936 1 77 LYS QD 1 78 HIS H 3.500 . 5.000 4.315 2.042 5.033 0.033 19 0 "[ . 1 . 2 ]" 1
937 1 77 LYS HE2 1 77 LYS QG 2.600 . 3.500 2.874 2.367 3.455 . 0 0 "[ . 1 . 2 ]" 1
938 1 77 LYS QG 1 78 HIS H 3.800 . 5.600 4.211 2.971 4.936 . 0 0 "[ . 1 . 2 ]" 1
939 1 78 HIS H 1 78 HIS HA 2.800 . 3.800 2.780 2.270 2.936 . 0 0 "[ . 1 . 2 ]" 1
940 1 78 HIS H 1 78 HIS QB 2.800 . 3.600 2.891 2.245 3.446 . 0 0 "[ . 1 . 2 ]" 1
941 1 78 HIS HA 1 78 HIS QB 2.600 . 3.400 2.335 2.164 2.540 . 0 0 "[ . 1 . 2 ]" 1
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