NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
369698 |
1beg   |
cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1beg
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 964
_Distance_constraint_stats_list.Viol_count 1699
_Distance_constraint_stats_list.Viol_total 3200.567
_Distance_constraint_stats_list.Viol_max 2.375
_Distance_constraint_stats_list.Viol_rms 0.0915
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0102
_Distance_constraint_stats_list.Viol_average_violations_only 0.1047
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 3 CYS 1.207 0.105 14 0 "[ . 1 . ]"
1 4 THR 0.838 0.105 14 0 "[ . 1 . ]"
1 5 ALA 0.273 0.039 4 0 "[ . 1 . ]"
1 6 THR 0.094 0.036 7 0 "[ . 1 . ]"
1 7 GLN 1.307 0.052 18 0 "[ . 1 . ]"
1 8 GLN 2.493 0.089 10 0 "[ . 1 . ]"
1 9 THR 3.058 0.107 6 0 "[ . 1 . ]"
1 10 ALA 1.509 0.067 10 0 "[ . 1 . ]"
1 11 ALA 16.842 1.347 5 13 "[* **+*** ** -** * ]"
1 12 TYR 1.833 0.101 11 0 "[ . 1 . ]"
1 13 LYS 1.083 0.107 6 0 "[ . 1 . ]"
1 14 THR 1.743 0.115 6 0 "[ . 1 . ]"
1 15 LEU 0.421 0.058 17 0 "[ . 1 . ]"
1 16 VAL 1.687 0.101 11 0 "[ . 1 . ]"
1 17 SER 0.751 0.092 14 0 "[ . 1 . ]"
1 18 ILE 2.011 0.354 8 0 "[ . 1 . ]"
1 19 LEU 1.787 0.354 8 0 "[ . 1 . ]"
1 20 SER 0.680 0.127 2 0 "[ . 1 . ]"
1 21 ASP 0.723 0.065 14 0 "[ . 1 . ]"
1 22 ALA 0.309 0.041 16 0 "[ . 1 . ]"
1 23 SER 0.476 0.046 16 0 "[ . 1 . ]"
1 24 PHE 1.986 0.546 18 1 "[ . 1 . +]"
1 25 ASN 16.280 1.281 3 17 "[*-+***** *********]"
1 26 GLN 17.589 1.281 3 17 "[*-+***** *********]"
1 27 CYS 3.752 0.546 18 1 "[ . 1 . +]"
1 28 SER 0.727 0.071 2 0 "[ . 1 . ]"
1 29 THR 0.780 0.053 7 0 "[ . 1 . ]"
1 30 ASP 1.600 0.098 7 0 "[ . 1 . ]"
1 31 SER 1.120 0.068 12 0 "[ . 1 . ]"
1 32 GLY 1.057 0.087 5 0 "[ . 1 . ]"
1 33 TYR 1.193 0.087 5 0 "[ . 1 . ]"
1 34 SER 19.025 2.375 14 10 "[ * ** -** *+. **]"
1 35 MET 0.418 0.047 14 0 "[ . 1 . ]"
1 36 LEU 19.409 2.375 14 10 "[ * ** -** *+. **]"
1 37 THR 0.168 0.055 18 0 "[ . 1 . ]"
1 38 ALA 0.073 0.036 8 0 "[ . 1 . ]"
1 39 LYS 4.000 0.784 8 5 "[ *.* + 1 * - ]"
1 40 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 41 LEU 0.007 0.007 13 0 "[ . 1 . ]"
1 42 PRO 17.440 1.292 9 18 [********+*****-***]
1 43 THR 0.578 0.067 3 0 "[ . 1 . ]"
1 44 THR 0.530 0.042 8 0 "[ . 1 . ]"
1 45 ALA 0.823 0.061 10 0 "[ . 1 . ]"
1 46 GLN 18.271 1.292 9 18 [********+*****-***]
1 47 TYR 0.455 0.032 12 0 "[ . 1 . ]"
1 48 LYS 1.090 0.093 15 0 "[ . 1 . ]"
1 49 LEU 2.661 0.199 10 0 "[ . 1 . ]"
1 50 MET 10.202 1.142 3 10 "[ *+*. *1 ***-**]"
1 51 CYS 1.359 0.356 12 0 "[ . 1 . ]"
1 52 ALA 0.610 0.046 16 0 "[ . 1 . ]"
1 53 SER 0.617 0.089 5 0 "[ . 1 . ]"
1 54 THR 0.028 0.024 5 0 "[ . 1 . ]"
1 55 ALA 1.391 0.137 2 0 "[ . 1 . ]"
1 56 CYS 18.293 1.955 9 11 "[ -**.* +1 ******]"
1 57 ASN 3.286 0.356 12 0 "[ . 1 . ]"
1 58 THR 5.385 0.615 3 1 "[ + . 1 . ]"
1 59 MET 12.954 0.779 1 7 "[+ * . 1** -. **]"
1 60 ILE 37.818 1.955 9 14 "[****.* +1***-****]"
1 61 LYS 2.596 0.064 16 0 "[ . 1 . ]"
1 62 LYS 1.681 0.070 3 0 "[ . 1 . ]"
1 63 ILE 0.980 0.073 3 0 "[ . 1 . ]"
1 64 VAL 1.909 0.064 2 0 "[ . 1 . ]"
1 65 THR 2.368 0.098 2 0 "[ . 1 . ]"
1 66 LEU 1.392 0.090 5 0 "[ . 1 . ]"
1 67 ASN 4.514 1.113 2 4 "[ + . *1 * .- ]"
1 68 PRO 14.441 1.347 5 13 "[* **+*** ** -** * ]"
1 69 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 70 ASN 0.025 0.018 15 0 "[ . 1 . ]"
1 71 CYS 0.437 0.105 2 0 "[ . 1 . ]"
1 72 ASP 0.542 0.105 2 0 "[ . 1 . ]"
1 73 LEU 0.760 0.089 2 0 "[ . 1 . ]"
1 74 THR 0.732 0.075 18 0 "[ . 1 . ]"
1 75 VAL 0.973 0.240 3 0 "[ . 1 . ]"
1 76 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 77 THR 1.237 0.581 1 1 "[+ . 1 . ]"
1 78 SER 5.027 0.784 8 5 "[ *.* + 1 * - ]"
1 79 GLY 1.432 0.581 1 1 "[+ . 1 . ]"
1 80 LEU 0.329 0.048 8 0 "[ . 1 . ]"
1 81 VAL 0.317 0.044 14 0 "[ . 1 . ]"
1 82 LEU 0.853 0.096 6 0 "[ . 1 . ]"
1 83 ASN 0.523 0.155 1 0 "[ . 1 . ]"
1 84 VAL 1.384 0.155 1 0 "[ . 1 . ]"
1 85 TYR 1.352 0.062 7 0 "[ . 1 . ]"
1 86 SER 1.090 0.062 7 0 "[ . 1 . ]"
1 87 TYR 13.249 1.911 13 9 "[ * ** * 1* + -* *]"
1 88 ALA 13.447 1.911 13 9 "[ * ** * 1* + -* *]"
1 89 ASN 4.219 1.113 2 4 "[ + . *1 * .- ]"
1 90 GLY 0.278 0.044 6 0 "[ . 1 . ]"
1 91 PHE 1.374 0.068 10 0 "[ . 1 . ]"
1 92 SER 1.015 0.064 3 0 "[ . 1 . ]"
1 93 ASN 0.194 0.058 3 0 "[ . 1 . ]"
1 94 LYS 0.712 0.045 5 0 "[ . 1 . ]"
1 95 CYS 1.248 0.064 3 0 "[ . 1 . ]"
1 96 SER 0.731 0.049 8 0 "[ . 1 . ]"
1 97 SER 0.733 0.058 3 0 "[ . 1 . ]"
1 98 LEU 0.304 0.038 9 0 "[ . 1 . ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 ALA MB 1 3 CYS H 1.800 . 4.500 2.564 2.050 3.657 . 0 0 "[ . 1 . ]" 1
2 1 3 CYS H 1 3 CYS HB2 1.800 . 3.500 3.043 2.647 3.548 0.048 9 0 "[ . 1 . ]" 1
3 1 3 CYS H 1 4 THR H 1.800 . 6.000 4.662 4.514 4.762 . 0 0 "[ . 1 . ]" 1
4 1 3 CYS H 1 71 CYS QB 1.800 . 6.000 2.641 2.187 3.371 . 0 0 "[ . 1 . ]" 1
5 1 3 CYS H 1 72 ASP HA 1.800 . 5.000 4.904 4.675 5.059 0.059 5 0 "[ . 1 . ]" 1
6 1 3 CYS H 1 72 ASP QB 1.800 . 4.500 3.810 3.423 4.100 . 0 0 "[ . 1 . ]" 1
7 1 3 CYS HA 1 4 THR H 1.800 . 3.500 2.356 2.084 3.077 . 0 0 "[ . 1 . ]" 1
8 1 3 CYS HA 1 7 GLN HB2 1.800 . 3.500 3.175 2.462 3.548 0.048 10 0 "[ . 1 . ]" 1
9 1 3 CYS HA 1 71 CYS QB 1.800 . 4.500 2.424 1.848 2.933 . 0 0 "[ . 1 . ]" 1
10 1 3 CYS HB2 1 4 THR H 1.800 . 3.500 3.422 2.749 3.605 0.105 14 0 "[ . 1 . ]" 1
11 1 3 CYS HB2 1 7 GLN HB3 1.800 . 3.500 3.500 3.371 3.546 0.046 3 0 "[ . 1 . ]" 1
12 1 3 CYS HB2 1 8 GLN H 1.800 . 5.000 3.547 2.926 3.958 . 0 0 "[ . 1 . ]" 1
13 1 3 CYS HB2 1 8 GLN HA 1.800 . 3.500 3.029 2.392 3.434 . 0 0 "[ . 1 . ]" 1
14 1 3 CYS HB3 1 4 THR H 1.800 . 5.000 2.669 1.906 3.114 . 0 0 "[ . 1 . ]" 1
15 1 3 CYS HB3 1 8 GLN HA 1.800 . 3.500 3.292 2.480 3.516 0.016 3 0 "[ . 1 . ]" 1
16 1 3 CYS SG 1 71 CYS SG 1.800 . 2.100 2.020 2.018 2.022 . 0 0 "[ . 1 . ]" 1
17 1 4 THR H 1 4 THR MG 1.800 . 4.500 3.567 2.593 3.871 . 0 0 "[ . 1 . ]" 1
18 1 4 THR H 1 7 GLN H 1.800 . 5.000 3.638 3.409 4.087 . 0 0 "[ . 1 . ]" 1
19 1 4 THR H 1 7 GLN HA 1.800 . 5.000 4.935 4.638 5.040 0.040 11 0 "[ . 1 . ]" 1
20 1 4 THR H 1 7 GLN HB2 1.800 . 3.500 2.061 1.795 2.415 0.005 10 0 "[ . 1 . ]" 1
21 1 4 THR H 1 7 GLN HB3 1.800 . 5.000 3.102 2.113 3.519 . 0 0 "[ . 1 . ]" 1
22 1 4 THR H 1 7 GLN QG 1.800 . 6.000 3.808 3.287 4.207 . 0 0 "[ . 1 . ]" 1
23 1 4 THR H 1 8 GLN H 1.800 . 6.000 3.380 2.811 3.861 . 0 0 "[ . 1 . ]" 1
24 1 4 THR H 1 71 CYS QB 1.800 . 6.000 4.439 4.047 4.840 . 0 0 "[ . 1 . ]" 1
25 1 4 THR HA 1 4 THR MG 1.800 . 3.500 2.407 2.116 2.807 . 0 0 "[ . 1 . ]" 1
26 1 4 THR HA 1 5 ALA H 1.800 . 3.500 2.719 2.094 3.525 0.025 3 0 "[ . 1 . ]" 1
27 1 4 THR MG 1 5 ALA H 1.800 . 4.500 2.842 2.054 3.720 . 0 0 "[ . 1 . ]" 1
28 1 5 ALA H 1 5 ALA MB 1.800 . 4.500 2.565 2.164 2.766 . 0 0 "[ . 1 . ]" 1
29 1 5 ALA MB 1 6 THR H 1.800 . 4.500 2.103 1.990 2.285 . 0 0 "[ . 1 . ]" 1
30 1 5 ALA O 1 9 THR H 2.000 . 2.300 2.056 1.961 2.236 0.039 4 0 "[ . 1 . ]" 1
31 1 5 ALA O 1 9 THR N 2.000 . 3.300 2.990 2.826 3.203 . 0 0 "[ . 1 . ]" 1
32 1 6 THR H 1 6 THR MG 1.800 . 4.500 2.625 2.118 3.776 . 0 0 "[ . 1 . ]" 1
33 1 6 THR H 1 7 GLN H 1.800 . 3.500 2.812 2.681 2.973 . 0 0 "[ . 1 . ]" 1
34 1 6 THR HA 1 6 THR MG 1.800 . 4.500 2.605 2.138 3.283 . 0 0 "[ . 1 . ]" 1
35 1 6 THR MG 1 7 GLN H 1.800 . 6.000 3.316 1.994 4.160 . 0 0 "[ . 1 . ]" 1
36 1 6 THR O 1 10 ALA H 2.000 . 2.300 2.184 1.989 2.336 0.036 7 0 "[ . 1 . ]" 1
37 1 6 THR O 1 10 ALA N 2.000 . 3.300 2.995 2.838 3.207 . 0 0 "[ . 1 . ]" 1
38 1 7 GLN H 1 7 GLN HB2 1.800 . 3.500 2.282 2.050 2.504 . 0 0 "[ . 1 . ]" 1
39 1 7 GLN H 1 7 GLN QG 1.800 . 4.500 2.842 2.224 3.929 . 0 0 "[ . 1 . ]" 1
40 1 7 GLN H 1 8 GLN H 1.800 . 3.500 2.728 2.588 2.881 . 0 0 "[ . 1 . ]" 1
41 1 7 GLN HA 1 7 GLN QG 1.800 . 3.500 2.245 2.047 2.388 . 0 0 "[ . 1 . ]" 1
42 1 7 GLN HA 1 8 GLN H 1.800 . 3.500 3.529 3.514 3.550 0.050 11 0 "[ . 1 . ]" 1
43 1 7 GLN HB2 1 7 GLN QE 1.800 . 4.500 3.041 2.062 3.722 . 0 0 "[ . 1 . ]" 1
44 1 7 GLN HB2 1 8 GLN H 1.800 . 3.500 2.676 2.333 3.186 . 0 0 "[ . 1 . ]" 1
45 1 7 GLN QE 1 71 CYS QB 1.800 . 7.000 3.654 2.227 5.295 . 0 0 "[ . 1 . ]" 1
46 1 7 GLN O 1 11 ALA H 2.000 . 2.300 2.199 1.948 2.328 0.052 18 0 "[ . 1 . ]" 1
47 1 7 GLN O 1 11 ALA N 2.000 . 3.300 3.153 2.887 3.275 . 0 0 "[ . 1 . ]" 1
48 1 8 GLN H 1 8 GLN QG 1.800 . 4.500 3.810 2.473 4.040 . 0 0 "[ . 1 . ]" 1
49 1 8 GLN H 1 9 THR H 1.800 . 3.500 2.771 2.574 2.878 . 0 0 "[ . 1 . ]" 1
50 1 8 GLN H 1 10 ALA MB 1.800 . 6.000 4.710 4.391 4.884 . 0 0 "[ . 1 . ]" 1
51 1 8 GLN HA 1 8 GLN QG 1.800 . 4.500 2.332 2.039 2.662 . 0 0 "[ . 1 . ]" 1
52 1 8 GLN HA 1 9 THR H 1.800 . 3.500 3.547 3.527 3.561 0.061 14 0 "[ . 1 . ]" 1
53 1 8 GLN HA 1 11 ALA H 1.800 . 3.500 3.532 3.412 3.589 0.089 10 0 "[ . 1 . ]" 1
54 1 8 GLN HA 1 11 ALA MB 1.800 . 4.500 2.780 2.512 3.025 . 0 0 "[ . 1 . ]" 1
55 1 8 GLN HA 1 12 TYR QE 1.800 . 7.000 4.996 4.038 5.499 . 0 0 "[ . 1 . ]" 1
56 1 8 GLN HA 1 73 LEU QD 1.800 . 5.900 3.154 1.992 4.329 . 0 0 "[ . 1 . ]" 1
57 1 8 GLN QB 1 8 GLN QE 1.800 . 7.000 2.843 2.195 3.512 . 0 0 "[ . 1 . ]" 1
58 1 8 GLN QB 1 8 GLN QG 1.800 . 7.500 2.090 2.036 2.118 . 0 0 "[ . 1 . ]" 1
59 1 8 GLN QB 1 9 THR H 1.800 . 4.500 2.595 2.196 2.850 . 0 0 "[ . 1 . ]" 1
60 1 8 GLN QB 1 12 TYR QE 1.800 . 6.500 4.384 3.341 5.174 . 0 0 "[ . 1 . ]" 1
61 1 8 GLN QG 1 9 THR H 1.800 . 4.500 3.816 3.254 4.097 . 0 0 "[ . 1 . ]" 1
62 1 8 GLN QG 1 12 TYR QD 1.800 . 8.000 3.190 2.039 5.741 . 0 0 "[ . 1 . ]" 1
63 1 8 GLN QG 1 12 TYR QE 1.800 . 6.500 2.937 2.209 4.993 . 0 0 "[ . 1 . ]" 1
64 1 8 GLN O 1 12 TYR H 2.000 . 2.300 1.985 1.945 2.072 0.055 17 0 "[ . 1 . ]" 1
65 1 8 GLN O 1 12 TYR N 2.000 . 3.300 2.875 2.775 2.997 . 0 0 "[ . 1 . ]" 1
66 1 9 THR H 1 9 THR HB 1.800 . 3.500 3.218 2.242 3.586 0.086 11 0 "[ . 1 . ]" 1
67 1 9 THR H 1 10 ALA H 1.800 . 3.500 2.664 2.503 2.816 . 0 0 "[ . 1 . ]" 1
68 1 9 THR H 1 10 ALA MB 1.800 . 6.000 4.354 4.213 4.497 . 0 0 "[ . 1 . ]" 1
69 1 9 THR HA 1 9 THR HB 1.800 . 2.500 2.526 2.397 2.591 0.091 5 0 "[ . 1 . ]" 1
70 1 9 THR HA 1 9 THR MG 1.800 . 4.500 2.548 2.132 3.214 . 0 0 "[ . 1 . ]" 1
71 1 9 THR HA 1 10 ALA H 1.800 . 5.000 3.507 3.452 3.566 . 0 0 "[ . 1 . ]" 1
72 1 9 THR HA 1 12 TYR QD 1.800 . 5.500 3.182 1.986 4.157 . 0 0 "[ . 1 . ]" 1
73 1 9 THR HA 1 12 TYR QE 1.800 . 7.000 4.890 3.834 5.787 . 0 0 "[ . 1 . ]" 1
74 1 9 THR HB 1 10 ALA H 1.800 . 6.000 3.878 3.515 4.412 . 0 0 "[ . 1 . ]" 1
75 1 9 THR MG 1 10 ALA H 1.800 . 6.000 3.675 2.360 4.328 . 0 0 "[ . 1 . ]" 1
76 1 9 THR MG 1 12 TYR QD 1.800 . 6.500 4.234 3.047 5.172 . 0 0 "[ . 1 . ]" 1
77 1 9 THR MG 1 12 TYR QE 1.800 . 8.000 5.346 3.720 6.160 . 0 0 "[ . 1 . ]" 1
78 1 9 THR MG 1 13 LYS QB 1.800 . 7.000 4.871 4.072 5.128 . 0 0 "[ . 1 . ]" 1
79 1 9 THR O 1 13 LYS H 2.000 . 2.300 1.983 1.893 2.279 0.107 6 0 "[ . 1 . ]" 1
80 1 9 THR O 1 13 LYS N 2.000 . 3.300 2.889 2.760 3.246 . 0 0 "[ . 1 . ]" 1
81 1 10 ALA H 1 10 ALA MB 1.800 . 4.500 2.235 2.101 2.307 . 0 0 "[ . 1 . ]" 1
82 1 10 ALA H 1 11 ALA H 1.800 . 3.500 2.528 2.422 2.682 . 0 0 "[ . 1 . ]" 1
83 1 10 ALA HA 1 11 ALA H 1.800 . 3.500 3.543 3.521 3.558 0.058 17 0 "[ . 1 . ]" 1
84 1 10 ALA MB 1 11 ALA H 1.800 . 4.500 2.358 2.215 2.490 . 0 0 "[ . 1 . ]" 1
85 1 10 ALA MB 1 69 PRO QD 1.800 . 4.500 2.758 2.437 3.133 . 0 0 "[ . 1 . ]" 1
86 1 10 ALA O 1 14 THR H 2.000 . 2.300 2.324 2.193 2.367 0.067 10 0 "[ . 1 . ]" 1
87 1 10 ALA O 1 14 THR N 2.000 . 3.300 3.286 3.168 3.321 0.021 16 0 "[ . 1 . ]" 1
88 1 11 ALA H 1 11 ALA MB 1.800 . 4.500 2.248 2.136 2.323 . 0 0 "[ . 1 . ]" 1
89 1 11 ALA H 1 12 TYR H 1.800 . 3.500 2.652 2.568 2.724 . 0 0 "[ . 1 . ]" 1
90 1 11 ALA HA 1 12 TYR H 1.800 . 3.500 3.527 3.517 3.538 0.038 14 0 "[ . 1 . ]" 1
91 1 11 ALA HA 1 14 THR MG 1.800 . 6.000 4.342 2.647 4.930 . 0 0 "[ . 1 . ]" 1
92 1 11 ALA HA 1 73 LEU QD 1.800 . 7.400 4.039 3.412 4.716 . 0 0 "[ . 1 . ]" 1
93 1 11 ALA MB 1 12 TYR H 1.800 . 4.500 2.533 2.398 2.879 . 0 0 "[ . 1 . ]" 1
94 1 11 ALA MB 1 12 TYR QD 1.800 . 8.000 3.455 2.570 4.485 . 0 0 "[ . 1 . ]" 1
95 1 11 ALA MB 1 12 TYR QE 1.800 . 8.000 4.637 3.725 5.463 . 0 0 "[ . 1 . ]" 1
96 1 11 ALA MB 1 68 PRO QB 5.000 5.000 45.000 4.198 3.653 4.888 1.347 5 13 "[* **+*** ** -** * ]" 1
97 1 11 ALA MB 1 69 PRO QD 1.800 . 7.000 4.018 3.393 4.622 . 0 0 "[ . 1 . ]" 1
98 1 11 ALA MB 1 73 LEU QD 1.800 . 6.900 1.963 1.755 2.309 0.045 15 0 "[ . 1 . ]" 1
99 1 11 ALA O 1 15 LEU H 2.000 . 2.300 2.095 1.952 2.315 0.048 10 0 "[ . 1 . ]" 1
100 1 11 ALA O 1 15 LEU N 2.000 . 3.300 3.019 2.836 3.219 . 0 0 "[ . 1 . ]" 1
101 1 12 TYR H 1 12 TYR HB2 1.800 . 3.500 2.286 2.076 2.534 . 0 0 "[ . 1 . ]" 1
102 1 12 TYR H 1 12 TYR QD 1.800 . 7.000 2.945 2.120 3.608 . 0 0 "[ . 1 . ]" 1
103 1 12 TYR H 1 13 LYS H 1.800 . 3.500 2.887 2.663 3.110 . 0 0 "[ . 1 . ]" 1
104 1 12 TYR HA 1 12 TYR QD 1.800 . 5.500 2.354 1.849 2.861 . 0 0 "[ . 1 . ]" 1
105 1 12 TYR HA 1 12 TYR QE 1.800 . 5.500 4.316 4.088 4.484 . 0 0 "[ . 1 . ]" 1
106 1 12 TYR HB2 1 13 LYS H 1.800 . 3.500 2.632 2.128 3.060 . 0 0 "[ . 1 . ]" 1
107 1 12 TYR HB3 1 13 LYS H 1.800 . 3.500 2.949 2.500 3.396 . 0 0 "[ . 1 . ]" 1
108 1 12 TYR QD 1 13 LYS H 1.800 . 7.000 4.422 4.205 4.707 . 0 0 "[ . 1 . ]" 1
109 1 12 TYR QD 1 15 LEU MD2 1.800 . 8.000 3.602 2.453 4.480 . 0 0 "[ . 1 . ]" 1
110 1 12 TYR QD 1 16 VAL MG1 1.800 . 6.500 4.244 2.590 4.982 . 0 0 "[ . 1 . ]" 1
111 1 12 TYR QD 1 16 VAL MG2 1.800 . 6.500 3.111 1.848 4.405 . 0 0 "[ . 1 . ]" 1
112 1 12 TYR QD 1 73 LEU QD 1.800 . 7.900 3.530 2.092 5.211 . 0 0 "[ . 1 . ]" 1
113 1 12 TYR QE 1 15 LEU MD2 1.800 . 6.500 4.154 3.213 5.000 . 0 0 "[ . 1 . ]" 1
114 1 12 TYR QE 1 16 VAL MG1 1.800 . 8.000 5.420 3.856 6.067 . 0 0 "[ . 1 . ]" 1
115 1 12 TYR QE 1 16 VAL MG2 1.800 . 8.000 4.360 3.379 5.995 . 0 0 "[ . 1 . ]" 1
116 1 12 TYR QE 1 73 LEU QD 1.800 . 7.900 3.406 1.895 5.145 . 0 0 "[ . 1 . ]" 1
117 1 12 TYR QE 1 76 PRO QD 1.800 . 8.000 5.391 3.867 6.376 . 0 0 "[ . 1 . ]" 1
118 1 12 TYR O 1 16 VAL H 2.000 . 2.300 1.949 1.899 2.002 0.101 11 0 "[ . 1 . ]" 1
119 1 12 TYR O 1 16 VAL N 2.000 . 3.300 2.789 2.681 2.887 . 0 0 "[ . 1 . ]" 1
120 1 13 LYS H 1 13 LYS QB 1.800 . 3.500 2.201 2.065 2.261 . 0 0 "[ . 1 . ]" 1
121 1 13 LYS H 1 13 LYS QD 1.800 . 6.000 4.501 4.303 4.839 . 0 0 "[ . 1 . ]" 1
122 1 13 LYS H 1 13 LYS QG 1.800 . 6.000 3.911 3.660 4.006 . 0 0 "[ . 1 . ]" 1
123 1 13 LYS H 1 14 THR H 1.800 . 3.500 3.039 2.781 3.423 . 0 0 "[ . 1 . ]" 1
124 1 13 LYS HA 1 13 LYS QD 1.800 . 6.000 3.991 3.299 4.238 . 0 0 "[ . 1 . ]" 1
125 1 13 LYS HA 1 13 LYS QG 1.800 . 3.500 2.405 2.082 2.698 . 0 0 "[ . 1 . ]" 1
126 1 13 LYS QB 1 13 LYS QD 1.800 . 4.500 2.144 1.979 2.319 . 0 0 "[ . 1 . ]" 1
127 1 13 LYS QB 1 13 LYS QG 1.800 . 4.500 2.085 2.041 2.111 . 0 0 "[ . 1 . ]" 1
128 1 13 LYS QB 1 14 THR H 1.800 . 6.000 2.447 2.249 2.695 . 0 0 "[ . 1 . ]" 1
129 1 13 LYS QD 1 13 LYS QE 1.800 . 7.000 2.043 2.016 2.105 . 0 0 "[ . 1 . ]" 1
130 1 13 LYS QD 1 13 LYS QG 1.800 . 4.500 2.060 2.022 2.112 . 0 0 "[ . 1 . ]" 1
131 1 13 LYS QE 1 13 LYS QG 1.800 . 7.000 2.260 2.052 2.801 . 0 0 "[ . 1 . ]" 1
132 1 13 LYS O 1 17 SER H 2.000 . 2.300 2.282 2.040 2.390 0.090 16 0 "[ . 1 . ]" 1
133 1 13 LYS O 1 17 SER N 2.000 . 3.300 3.146 2.974 3.274 . 0 0 "[ . 1 . ]" 1
134 1 14 THR H 1 14 THR HB 1.800 . 3.500 2.685 2.373 2.920 . 0 0 "[ . 1 . ]" 1
135 1 14 THR H 1 14 THR MG 1.800 . 4.500 3.595 2.088 3.824 . 0 0 "[ . 1 . ]" 1
136 1 14 THR H 1 15 LEU H 1.800 . 3.500 2.920 2.668 3.114 . 0 0 "[ . 1 . ]" 1
137 1 14 THR HA 1 14 THR MG 1.800 . 4.500 2.416 2.113 3.273 . 0 0 "[ . 1 . ]" 1
138 1 14 THR MG 1 63 ILE HA 1.800 . 4.500 3.066 2.486 3.704 . 0 0 "[ . 1 . ]" 1
139 1 14 THR MG 1 63 ILE MG 1.800 . 5.500 2.714 2.054 3.614 . 0 0 "[ . 1 . ]" 1
140 1 14 THR MG 1 66 LEU QB 1.800 . 7.000 3.537 2.395 4.233 . 0 0 "[ . 1 . ]" 1
141 1 14 THR MG 1 66 LEU QD 1.800 . 6.900 2.589 1.710 3.721 0.090 5 0 "[ . 1 . ]" 1
142 1 14 THR MG 1 66 LEU HG 1.800 . 4.500 3.306 2.094 3.747 . 0 0 "[ . 1 . ]" 1
143 1 14 THR MG 1 84 VAL QG 1.800 . 6.900 3.610 2.413 4.069 . 0 0 "[ . 1 . ]" 1
144 1 14 THR O 1 18 ILE H 2.000 . 2.300 2.352 2.291 2.415 0.115 6 0 "[ . 1 . ]" 1
145 1 14 THR O 1 18 ILE N 2.000 . 3.300 3.186 3.006 3.307 0.007 6 0 "[ . 1 . ]" 1
146 1 15 LEU H 1 15 LEU QB 1.800 . 4.500 2.183 2.088 2.333 . 0 0 "[ . 1 . ]" 1
147 1 15 LEU H 1 15 LEU MD1 1.800 . 6.000 3.982 2.133 4.341 . 0 0 "[ . 1 . ]" 1
148 1 15 LEU HA 1 15 LEU MD1 1.800 . 6.000 2.923 2.066 3.615 . 0 0 "[ . 1 . ]" 1
149 1 15 LEU HA 1 18 ILE HB 1.800 . 3.500 3.318 2.817 3.558 0.058 17 0 "[ . 1 . ]" 1
150 1 15 LEU QB 1 15 LEU MD1 1.800 . 6.000 2.112 1.975 2.541 . 0 0 "[ . 1 . ]" 1
151 1 16 VAL H 1 16 VAL HB 1.800 . 3.500 2.668 2.023 3.591 0.091 7 0 "[ . 1 . ]" 1
152 1 16 VAL H 1 16 VAL MG1 1.800 . 6.000 3.406 1.989 3.884 . 0 0 "[ . 1 . ]" 1
153 1 16 VAL H 1 16 VAL MG2 1.800 . 4.500 2.328 1.971 3.483 . 0 0 "[ . 1 . ]" 1
154 1 16 VAL H 1 17 SER H 1.800 . 3.500 2.788 2.311 3.104 . 0 0 "[ . 1 . ]" 1
155 1 16 VAL HA 1 16 VAL MG1 1.800 . 4.500 2.487 2.073 3.247 . 0 0 "[ . 1 . ]" 1
156 1 16 VAL HA 1 16 VAL MG2 1.800 . 4.500 2.533 2.044 3.305 . 0 0 "[ . 1 . ]" 1
157 1 16 VAL HA 1 19 LEU HG 1.800 . 3.500 3.091 2.154 3.548 0.048 9 0 "[ . 1 . ]" 1
158 1 16 VAL HB 1 17 SER H 1.800 . 3.500 2.953 2.352 3.592 0.092 14 0 "[ . 1 . ]" 1
159 1 16 VAL MG1 1 17 SER H 1.800 . 4.500 3.406 2.203 3.845 . 0 0 "[ . 1 . ]" 1
160 1 16 VAL MG1 1 18 ILE H 1.800 . 6.000 4.924 4.544 5.069 . 0 0 "[ . 1 . ]" 1
161 1 16 VAL MG2 1 17 SER H 1.800 . 6.000 3.663 2.009 4.218 . 0 0 "[ . 1 . ]" 1
162 1 17 SER H 1 18 ILE H 1.800 . 3.500 2.734 2.587 2.843 . 0 0 "[ . 1 . ]" 1
163 1 18 ILE H 1 18 ILE HB 1.800 . 3.500 2.361 1.964 2.876 . 0 0 "[ . 1 . ]" 1
164 1 18 ILE H 1 18 ILE MD 1.800 . 6.000 4.186 3.835 4.579 . 0 0 "[ . 1 . ]" 1
165 1 18 ILE HA 1 18 ILE MD 1.800 . 4.500 2.732 1.935 3.837 . 0 0 "[ . 1 . ]" 1
166 1 18 ILE HB 1 18 ILE MD 1.800 . 4.500 2.907 2.276 3.244 . 0 0 "[ . 1 . ]" 1
167 1 18 ILE HB 1 19 LEU QB 5.000 5.000 45.000 5.599 4.646 6.362 0.354 8 0 "[ . 1 . ]" 1
168 1 18 ILE HB 1 24 PHE QD 1.800 . 7.000 5.474 3.980 6.509 . 0 0 "[ . 1 . ]" 1
169 1 18 ILE MD 1 19 LEU QD 1.800 . 8.400 4.539 3.678 5.071 . 0 0 "[ . 1 . ]" 1
170 1 18 ILE MD 1 24 PHE HB3 1.800 . 4.500 3.599 3.391 3.751 . 0 0 "[ . 1 . ]" 1
171 1 18 ILE MD 1 24 PHE QD 1.800 . 8.000 3.328 1.848 4.610 . 0 0 "[ . 1 . ]" 1
172 1 18 ILE MD 1 59 MET QG 1.800 . 5.500 2.582 1.854 3.532 . 0 0 "[ . 1 . ]" 1
173 1 18 ILE MD 1 62 LYS QD 1.800 . 5.500 3.758 3.170 3.982 . 0 0 "[ . 1 . ]" 1
174 1 19 LEU H 1 19 LEU QB 1.800 . 4.500 3.049 2.422 3.576 . 0 0 "[ . 1 . ]" 1
175 1 19 LEU H 1 20 SER H 1.800 . 3.500 3.146 2.376 3.627 0.127 2 0 "[ . 1 . ]" 1
176 1 19 LEU HA 1 19 LEU QD 1.800 . 7.400 2.341 1.950 3.465 . 0 0 "[ . 1 . ]" 1
177 1 19 LEU HA 1 19 LEU HG 1.800 . 3.500 3.206 2.747 3.567 0.067 14 0 "[ . 1 . ]" 1
178 1 19 LEU HA 1 20 SER H 1.800 . 5.000 3.537 3.336 3.616 . 0 0 "[ . 1 . ]" 1
179 1 19 LEU QB 1 19 LEU QD 1.800 . 8.400 1.918 1.791 1.992 0.009 5 0 "[ . 1 . ]" 1
180 1 19 LEU QB 1 20 SER H 1.800 . 6.000 2.511 2.089 3.712 . 0 0 "[ . 1 . ]" 1
181 1 19 LEU QB 1 21 ASP H 1.800 . 6.000 4.501 3.728 4.865 . 0 0 "[ . 1 . ]" 1
182 1 19 LEU QB 1 36 LEU QD 1.800 . 6.900 3.498 1.996 4.354 . 0 0 "[ . 1 . ]" 1
183 1 19 LEU QD 1 19 LEU HG 1.800 . 5.900 1.904 1.892 1.914 . 0 0 "[ . 1 . ]" 1
184 1 19 LEU QD 1 20 SER QB 1.800 . 8.400 4.399 2.797 5.261 . 0 0 "[ . 1 . ]" 1
185 1 19 LEU QD 1 22 ALA H 5.000 5.000 45.000 8.102 5.983 8.723 . 0 0 "[ . 1 . ]" 1
186 1 19 LEU QD 1 23 SER H 5.000 5.000 45.000 7.976 6.990 8.919 . 0 0 "[ . 1 . ]" 1
187 1 19 LEU QD 1 24 PHE QD 1.800 . 9.400 3.712 2.324 4.533 . 0 0 "[ . 1 . ]" 1
188 1 19 LEU QD 1 24 PHE QE 1.800 . 9.400 3.532 2.138 4.546 . 0 0 "[ . 1 . ]" 1
189 1 19 LEU QD 1 25 ASN H 5.000 5.000 45.000 6.538 5.294 7.615 . 0 0 "[ . 1 . ]" 1
190 1 19 LEU QD 1 36 LEU QB 1.800 . 8.400 2.814 1.767 4.211 0.033 15 0 "[ . 1 . ]" 1
191 1 19 LEU QD 1 36 LEU QD 1.800 . 8.300 2.221 1.715 3.043 0.085 4 0 "[ . 1 . ]" 1
192 1 19 LEU HG 1 20 SER H 1.800 . 5.000 3.951 2.310 4.473 . 0 0 "[ . 1 . ]" 1
193 1 20 SER H 1 21 ASP H 1.800 . 3.500 2.883 2.563 3.313 . 0 0 "[ . 1 . ]" 1
194 1 20 SER H 1 21 ASP HB3 1.800 . 5.000 4.933 4.676 5.058 0.058 14 0 "[ . 1 . ]" 1
195 1 20 SER HA 1 21 ASP H 1.800 . 3.500 2.985 2.574 3.454 . 0 0 "[ . 1 . ]" 1
196 1 20 SER QB 1 21 ASP H 1.800 . 6.000 3.842 3.174 4.128 . 0 0 "[ . 1 . ]" 1
197 1 21 ASP H 1 21 ASP HB2 1.800 . 3.500 2.692 2.266 3.357 . 0 0 "[ . 1 . ]" 1
198 1 21 ASP H 1 21 ASP HB3 1.800 . 3.500 2.679 2.454 2.934 . 0 0 "[ . 1 . ]" 1
199 1 21 ASP H 1 22 ALA H 1.800 . 5.000 4.260 2.338 4.622 . 0 0 "[ . 1 . ]" 1
200 1 21 ASP H 1 24 PHE HB2 1.800 . 5.000 4.815 3.991 5.065 0.065 14 0 "[ . 1 . ]" 1
201 1 21 ASP H 1 24 PHE HB3 1.800 . 5.000 3.947 2.884 5.032 0.032 18 0 "[ . 1 . ]" 1
202 1 21 ASP HA 1 22 ALA H 1.800 . 3.500 2.440 2.147 3.507 0.007 14 0 "[ . 1 . ]" 1
203 1 21 ASP HB2 1 22 ALA H 1.800 . 5.000 4.033 3.536 4.228 . 0 0 "[ . 1 . ]" 1
204 1 21 ASP HB2 1 24 PHE H 1.800 . 5.000 4.792 4.232 5.058 0.058 14 0 "[ . 1 . ]" 1
205 1 21 ASP HB3 1 22 ALA H 1.800 . 5.000 3.468 2.051 3.979 . 0 0 "[ . 1 . ]" 1
206 1 21 ASP HB3 1 23 SER H 1.800 . 5.000 3.095 2.400 3.633 . 0 0 "[ . 1 . ]" 1
207 1 21 ASP HB3 1 24 PHE H 1.800 . 3.500 3.123 2.629 3.496 . 0 0 "[ . 1 . ]" 1
208 1 22 ALA H 1 22 ALA MB 1.800 . 4.500 2.359 2.135 3.212 . 0 0 "[ . 1 . ]" 1
209 1 22 ALA HA 1 23 SER H 1.800 . 3.500 3.436 3.026 3.541 0.041 16 0 "[ . 1 . ]" 1
210 1 22 ALA MB 1 23 SER H 1.800 . 4.500 2.997 2.405 3.669 . 0 0 "[ . 1 . ]" 1
211 1 22 ALA MB 1 25 ASN QB 1.800 . 5.500 3.859 3.372 4.106 . 0 0 "[ . 1 . ]" 1
212 1 23 SER H 1 23 SER QB 1.800 . 2.500 2.253 2.119 2.405 . 0 0 "[ . 1 . ]" 1
213 1 23 SER H 1 24 PHE H 1.800 . 3.500 2.792 2.281 3.164 . 0 0 "[ . 1 . ]" 1
214 1 23 SER QB 1 24 PHE H 1.800 . 4.500 2.353 2.237 2.561 . 0 0 "[ . 1 . ]" 1
215 1 23 SER O 1 27 CYS H 2.000 . 2.300 2.152 1.954 2.328 0.046 16 0 "[ . 1 . ]" 1
216 1 23 SER O 1 27 CYS N 2.000 . 3.300 3.098 2.874 3.297 . 0 0 "[ . 1 . ]" 1
217 1 24 PHE H 1 24 PHE HB2 1.800 . 3.500 2.515 2.164 2.989 . 0 0 "[ . 1 . ]" 1
218 1 24 PHE H 1 24 PHE HB3 1.800 . 3.500 2.546 2.213 2.965 . 0 0 "[ . 1 . ]" 1
219 1 24 PHE H 1 24 PHE QD 1.800 . 5.500 4.152 3.962 4.236 . 0 0 "[ . 1 . ]" 1
220 1 24 PHE H 1 25 ASN H 1.800 . 3.500 2.751 2.500 2.935 . 0 0 "[ . 1 . ]" 1
221 1 24 PHE HA 1 24 PHE QD 1.800 . 5.500 2.781 2.093 3.113 . 0 0 "[ . 1 . ]" 1
222 1 24 PHE HA 1 27 CYS H 1.800 . 3.500 3.540 3.483 3.572 0.072 16 0 "[ . 1 . ]" 1
223 1 24 PHE HB2 1 25 ASN H 1.800 . 5.000 3.935 3.461 4.353 . 0 0 "[ . 1 . ]" 1
224 1 24 PHE HB3 1 25 ASN H 1.800 . 3.500 2.758 2.255 3.284 . 0 0 "[ . 1 . ]" 1
225 1 24 PHE QD 1 25 ASN H 1.800 . 7.000 3.773 3.292 4.423 . 0 0 "[ . 1 . ]" 1
226 1 24 PHE QD 1 25 ASN HA 1.800 . 5.500 3.951 3.397 4.816 . 0 0 "[ . 1 . ]" 1
227 1 24 PHE QD 1 25 ASN QB 1.800 . 8.000 4.770 4.095 5.606 . 0 0 "[ . 1 . ]" 1
228 1 24 PHE QD 1 28 SER QB 1.800 . 8.000 4.286 3.235 5.375 . 0 0 "[ . 1 . ]" 1
229 1 24 PHE QD 1 35 MET H 1.800 . 7.000 5.094 4.409 6.311 . 0 0 "[ . 1 . ]" 1
230 1 24 PHE QD 1 35 MET QB 1.800 . 8.000 4.637 3.283 5.957 . 0 0 "[ . 1 . ]" 1
231 1 24 PHE QD 1 35 MET QG 1.800 . 8.000 5.176 3.315 6.322 . 0 0 "[ . 1 . ]" 1
232 1 24 PHE QD 1 36 LEU QB 1.800 . 6.500 5.080 4.349 5.440 . 0 0 "[ . 1 . ]" 1
233 1 24 PHE QD 1 36 LEU QD 1.800 . 7.900 3.755 2.599 4.907 . 0 0 "[ . 1 . ]" 1
234 1 24 PHE QD 1 59 MET QB 1.800 . 8.000 4.425 3.179 5.839 . 0 0 "[ . 1 . ]" 1
235 1 24 PHE QD 1 59 MET ME 1.800 . 6.500 3.593 2.901 4.100 . 0 0 "[ . 1 . ]" 1
236 1 24 PHE QD 1 59 MET QG 1.800 . 6.500 3.864 2.162 4.975 . 0 0 "[ . 1 . ]" 1
237 1 24 PHE QE 1 27 CYS HB3 5.000 5.000 45.000 5.482 4.454 6.232 0.546 18 1 "[ . 1 . +]" 1
238 1 24 PHE QE 1 35 MET QG 1.800 . 8.000 3.680 1.972 4.710 . 0 0 "[ . 1 . ]" 1
239 1 24 PHE QE 1 36 LEU H 1.800 . 7.000 3.444 2.630 4.296 . 0 0 "[ . 1 . ]" 1
240 1 24 PHE QE 1 36 LEU QB 1.800 . 6.500 3.639 2.484 4.692 . 0 0 "[ . 1 . ]" 1
241 1 24 PHE QE 1 36 LEU QD 1.800 . 9.400 2.627 2.129 3.299 . 0 0 "[ . 1 . ]" 1
242 1 24 PHE O 1 28 SER H 2.000 . 2.300 2.103 1.980 2.315 0.020 12 0 "[ . 1 . ]" 1
243 1 24 PHE O 1 28 SER N 2.000 . 3.300 3.060 2.875 3.256 . 0 0 "[ . 1 . ]" 1
244 1 25 ASN H 1 26 GLN H 1.800 . 3.500 2.718 2.507 2.909 . 0 0 "[ . 1 . ]" 1
245 1 25 ASN HA 1 25 ASN QD 1.800 . 6.000 3.314 2.278 4.002 . 0 0 "[ . 1 . ]" 1
246 1 25 ASN HA 1 26 GLN H 1.800 . 3.500 3.533 3.515 3.550 0.050 4 0 "[ . 1 . ]" 1
247 1 25 ASN QB 1 26 GLN H 1.800 . 4.500 2.558 2.350 2.721 . 0 0 "[ . 1 . ]" 1
248 1 25 ASN QB 1 26 GLN HA 1.800 . 4.500 3.797 3.672 4.006 . 0 0 "[ . 1 . ]" 1
249 1 25 ASN QB 1 26 GLN QB 5.000 5.000 45.000 4.135 3.719 4.569 1.281 3 17 "[*-+***** *********]" 1
250 1 25 ASN O 1 29 THR H 2.000 . 2.300 2.153 1.971 2.327 0.029 14 0 "[ . 1 . ]" 1
251 1 25 ASN O 1 29 THR N 2.000 . 3.300 3.038 2.797 3.247 . 0 0 "[ . 1 . ]" 1
252 1 26 GLN H 1 26 GLN QG 1.800 . 6.000 3.220 2.231 4.112 . 0 0 "[ . 1 . ]" 1
253 1 26 GLN H 1 27 CYS H 1.800 . 3.500 2.787 2.649 3.019 . 0 0 "[ . 1 . ]" 1
254 1 26 GLN H 1 55 ALA MB 1.800 . 6.000 3.854 3.502 4.536 . 0 0 "[ . 1 . ]" 1
255 1 26 GLN HA 1 26 GLN QE 1.800 . 6.000 3.278 1.873 4.341 . 0 0 "[ . 1 . ]" 1
256 1 26 GLN HA 1 26 GLN QG 1.800 . 6.000 2.699 2.428 3.040 . 0 0 "[ . 1 . ]" 1
257 1 26 GLN HA 1 27 CYS H 1.800 . 3.500 3.547 3.525 3.565 0.065 7 0 "[ . 1 . ]" 1
258 1 26 GLN QB 1 26 GLN QE 1.800 . 7.000 3.043 2.261 3.636 . 0 0 "[ . 1 . ]" 1
259 1 26 GLN QB 1 26 GLN QG 1.800 . 4.500 2.023 1.916 2.099 . 0 0 "[ . 1 . ]" 1
260 1 26 GLN QB 1 27 CYS H 1.800 . 4.500 2.479 2.187 2.742 . 0 0 "[ . 1 . ]" 1
261 1 26 GLN QB 1 55 ALA H 1.800 . 7.000 4.358 3.757 5.766 . 0 0 "[ . 1 . ]" 1
262 1 26 GLN QB 1 55 ALA MB 1.800 . 5.500 1.948 1.663 2.631 0.137 2 0 "[ . 1 . ]" 1
263 1 26 GLN QG 1 27 CYS H 1.800 . 4.500 3.934 3.593 4.106 . 0 0 "[ . 1 . ]" 1
264 1 26 GLN QG 1 55 ALA H 1.800 . 6.000 4.609 3.563 5.233 . 0 0 "[ . 1 . ]" 1
265 1 26 GLN QG 1 55 ALA MB 1.800 . 5.500 2.675 2.156 3.121 . 0 0 "[ . 1 . ]" 1
266 1 27 CYS H 1 27 CYS HB2 1.800 . 3.500 2.431 2.196 2.623 . 0 0 "[ . 1 . ]" 1
267 1 27 CYS H 1 27 CYS HB3 1.800 . 3.500 2.932 2.452 3.557 0.057 3 0 "[ . 1 . ]" 1
268 1 27 CYS H 1 28 SER H 1.800 . 3.500 2.805 2.565 2.947 . 0 0 "[ . 1 . ]" 1
269 1 27 CYS H 1 55 ALA MB 1.800 . 4.500 2.596 2.083 3.389 . 0 0 "[ . 1 . ]" 1
270 1 27 CYS HB2 1 28 SER H 1.800 . 3.500 3.379 2.522 3.571 0.071 2 0 "[ . 1 . ]" 1
271 1 27 CYS HB2 1 56 CYS QB 1.800 . 6.000 4.126 2.969 5.200 . 0 0 "[ . 1 . ]" 1
272 1 27 CYS HB3 1 28 SER H 1.800 . 5.000 2.489 2.081 3.409 . 0 0 "[ . 1 . ]" 1
273 1 27 CYS HB3 1 56 CYS H 1.800 . 5.000 4.930 4.670 5.085 0.085 3 0 "[ . 1 . ]" 1
274 1 27 CYS O 1 31 SER H 2.000 . 2.300 2.224 1.975 2.365 0.065 6 0 "[ . 1 . ]" 1
275 1 27 CYS O 1 31 SER N 2.000 . 3.300 3.155 2.914 3.333 0.033 7 0 "[ . 1 . ]" 1
276 1 27 CYS SG 1 56 CYS SG 1.800 . 2.100 2.020 2.018 2.024 . 0 0 "[ . 1 . ]" 1
277 1 28 SER QB 1 29 THR H 1.800 . 6.000 2.797 2.277 3.620 . 0 0 "[ . 1 . ]" 1
278 1 29 THR H 1 29 THR HB 1.800 . 2.500 2.354 2.133 2.526 0.026 17 0 "[ . 1 . ]" 1
279 1 29 THR H 1 29 THR MG 1.800 . 4.500 3.705 3.304 3.792 . 0 0 "[ . 1 . ]" 1
280 1 29 THR H 1 30 ASP H 1.800 . 3.500 2.769 2.539 3.011 . 0 0 "[ . 1 . ]" 1
281 1 29 THR HA 1 29 THR MG 1.800 . 4.500 2.568 2.340 3.080 . 0 0 "[ . 1 . ]" 1
282 1 29 THR HA 1 30 ASP H 1.800 . 3.500 3.535 3.518 3.553 0.053 7 0 "[ . 1 . ]" 1
283 1 29 THR HB 1 30 ASP H 1.800 . 3.500 2.731 2.405 3.430 . 0 0 "[ . 1 . ]" 1
284 1 29 THR MG 1 30 ASP H 1.800 . 6.000 3.165 2.317 3.499 . 0 0 "[ . 1 . ]" 1
285 1 29 THR MG 1 30 ASP HB2 1.800 . 6.000 4.743 4.364 4.926 . 0 0 "[ . 1 . ]" 1
286 1 30 ASP H 1 30 ASP HB2 1.800 . 3.500 2.428 2.163 3.598 0.098 7 0 "[ . 1 . ]" 1
287 1 30 ASP H 1 31 SER H 1.800 . 3.500 2.813 2.370 3.053 . 0 0 "[ . 1 . ]" 1
288 1 30 ASP H 1 32 GLY H 1.800 . 5.000 4.828 4.345 5.076 0.076 12 0 "[ . 1 . ]" 1
289 1 30 ASP HA 1 31 SER H 1.800 . 3.500 3.535 3.516 3.568 0.068 4 0 "[ . 1 . ]" 1
290 1 30 ASP HB2 1 31 SER H 1.800 . 3.500 2.775 2.066 3.506 0.006 3 0 "[ . 1 . ]" 1
291 1 30 ASP HB2 1 31 SER QB 1.800 . 6.000 4.247 3.630 5.025 . 0 0 "[ . 1 . ]" 1
292 1 30 ASP HB2 1 53 SER QB 1.800 . 4.500 3.988 3.712 4.122 . 0 0 "[ . 1 . ]" 1
293 1 30 ASP HB3 1 31 SER H 1.800 . 5.000 3.210 2.162 4.087 . 0 0 "[ . 1 . ]" 1
294 1 31 SER H 1 32 GLY H 1.800 . 3.500 2.690 2.315 3.481 . 0 0 "[ . 1 . ]" 1
295 1 31 SER H 1 32 GLY QA 1.800 . 6.000 4.110 3.623 4.480 . 0 0 "[ . 1 . ]" 1
296 1 31 SER H 1 33 TYR H 1.800 . 5.000 4.788 4.210 5.068 0.068 12 0 "[ . 1 . ]" 1
297 1 31 SER QB 1 32 GLY H 1.800 . 4.500 2.878 2.112 3.993 . 0 0 "[ . 1 . ]" 1
298 1 31 SER QB 1 50 MET QG 1.800 . 7.000 3.338 1.909 5.262 . 0 0 "[ . 1 . ]" 1
299 1 32 GLY H 1 33 TYR HB2 1.800 . 5.000 4.979 4.619 5.087 0.087 5 0 "[ . 1 . ]" 1
300 1 32 GLY HA2 1 33 TYR H 1.800 . 5.000 3.358 2.659 3.610 . 0 0 "[ . 1 . ]" 1
301 1 32 GLY HA3 1 33 TYR H 1.800 . 3.500 3.129 2.162 3.556 0.056 15 0 "[ . 1 . ]" 1
302 1 33 TYR H 1 33 TYR HB2 1.800 . 3.500 2.988 2.429 3.504 0.004 13 0 "[ . 1 . ]" 1
303 1 33 TYR H 1 33 TYR HB3 1.800 . 3.500 2.712 2.241 3.330 . 0 0 "[ . 1 . ]" 1
304 1 33 TYR H 1 33 TYR QD 1.800 . 7.000 4.334 4.161 4.609 . 0 0 "[ . 1 . ]" 1
305 1 33 TYR H 1 34 SER H 1.800 . 5.000 4.068 2.345 4.588 . 0 0 "[ . 1 . ]" 1
306 1 33 TYR HA 1 33 TYR QD 1.800 . 5.500 2.715 2.387 3.318 . 0 0 "[ . 1 . ]" 1
307 1 33 TYR HA 1 33 TYR QE 1.800 . 5.500 4.755 4.481 5.230 . 0 0 "[ . 1 . ]" 1
308 1 33 TYR HA 1 34 SER H 1.800 . 3.500 2.457 2.093 3.549 0.049 12 0 "[ . 1 . ]" 1
309 1 33 TYR HA 1 42 PRO QG 1.800 . 6.000 5.047 4.651 5.256 . 0 0 "[ . 1 . ]" 1
310 1 33 TYR HB3 1 34 SER H 1.800 . 5.000 3.886 2.181 4.455 . 0 0 "[ . 1 . ]" 1
311 1 33 TYR QD 1 35 MET H 1.800 . 7.000 4.045 2.980 5.163 . 0 0 "[ . 1 . ]" 1
312 1 33 TYR QD 1 35 MET HA 1.800 . 7.000 4.312 3.575 5.004 . 0 0 "[ . 1 . ]" 1
313 1 33 TYR QD 1 38 ALA MB 1.800 . 6.500 3.484 2.075 4.378 . 0 0 "[ . 1 . ]" 1
314 1 33 TYR QD 1 40 ALA MB 1.800 . 8.000 5.482 4.806 6.135 . 0 0 "[ . 1 . ]" 1
315 1 33 TYR QD 1 42 PRO HA 1.800 . 7.000 4.066 3.257 4.976 . 0 0 "[ . 1 . ]" 1
316 1 33 TYR QD 1 42 PRO QG 1.800 . 8.000 2.941 2.391 3.372 . 0 0 "[ . 1 . ]" 1
317 1 33 TYR QD 1 46 GLN QE 1.800 . 6.500 4.657 4.138 5.100 . 0 0 "[ . 1 . ]" 1
318 1 33 TYR QE 1 35 MET H 1.800 . 5.500 4.169 3.322 4.978 . 0 0 "[ . 1 . ]" 1
319 1 33 TYR QE 1 35 MET HA 1.800 . 5.500 3.067 2.078 3.730 . 0 0 "[ . 1 . ]" 1
320 1 33 TYR QE 1 35 MET QB 1.800 . 6.500 2.831 1.936 3.411 . 0 0 "[ . 1 . ]" 1
321 1 33 TYR QE 1 35 MET QG 1.800 . 8.000 3.719 1.897 5.457 . 0 0 "[ . 1 . ]" 1
322 1 33 TYR QE 1 38 ALA MB 1.800 . 6.500 2.720 2.054 3.818 . 0 0 "[ . 1 . ]" 1
323 1 33 TYR QE 1 40 ALA H 1.800 . 7.000 3.766 2.617 5.045 . 0 0 "[ . 1 . ]" 1
324 1 33 TYR QE 1 40 ALA MB 1.800 . 8.000 4.106 3.787 4.490 . 0 0 "[ . 1 . ]" 1
325 1 33 TYR QE 1 42 PRO HA 1.800 . 5.500 4.509 3.643 4.988 . 0 0 "[ . 1 . ]" 1
326 1 33 TYR QE 1 42 PRO QB 1.800 . 8.500 4.145 3.150 4.700 . 0 0 "[ . 1 . ]" 1
327 1 33 TYR QE 1 47 TYR QE 1.800 . 9.000 6.420 5.598 7.101 . 0 0 "[ . 1 . ]" 1
328 1 34 SER QB 1 36 LEU QD 5.000 5.000 45.000 3.977 2.625 5.482 2.375 14 10 "[ * ** -** *+. **]" 1
329 1 34 SER QB 1 37 THR H 1.800 . 6.000 3.058 2.553 3.655 . 0 0 "[ . 1 . ]" 1
330 1 34 SER QB 1 37 THR MG 1.800 . 7.000 3.469 1.870 4.951 . 0 0 "[ . 1 . ]" 1
331 1 35 MET H 1 35 MET QG 1.800 . 6.000 3.586 2.425 4.093 . 0 0 "[ . 1 . ]" 1
332 1 35 MET H 1 36 LEU H 1.800 . 5.000 2.726 2.279 3.275 . 0 0 "[ . 1 . ]" 1
333 1 35 MET H 1 36 LEU QD 1.800 . 9.400 4.173 2.864 5.211 . 0 0 "[ . 1 . ]" 1
334 1 35 MET HA 1 35 MET QG 1.800 . 6.000 2.780 2.135 3.421 . 0 0 "[ . 1 . ]" 1
335 1 35 MET HA 1 36 LEU H 1.800 . 3.500 3.518 3.483 3.547 0.047 14 0 "[ . 1 . ]" 1
336 1 35 MET HA 1 38 ALA H 1.800 . 5.000 4.125 3.148 5.036 0.036 8 0 "[ . 1 . ]" 1
337 1 35 MET HA 1 38 ALA MB 1.800 . 6.000 3.333 2.464 4.213 . 0 0 "[ . 1 . ]" 1
338 1 35 MET QB 1 35 MET QG 1.800 . 5.500 2.066 1.981 2.108 . 0 0 "[ . 1 . ]" 1
339 1 35 MET ME 1 35 MET QG 1.800 . 7.000 2.213 2.081 2.525 . 0 0 "[ . 1 . ]" 1
340 1 35 MET ME 1 82 LEU QD 1.800 . 8.400 2.643 1.766 4.423 0.034 15 0 "[ . 1 . ]" 1
341 1 35 MET ME 1 84 VAL QG 1.800 . 6.900 3.686 2.880 4.059 . 0 0 "[ . 1 . ]" 1
342 1 35 MET ME 1 87 TYR QD 1.800 . 8.000 4.011 2.732 5.210 . 0 0 "[ . 1 . ]" 1
343 1 35 MET ME 1 87 TYR QE 1.800 . 6.500 3.259 2.487 4.645 . 0 0 "[ . 1 . ]" 1
344 1 35 MET QG 1 75 VAL QG 1.800 . 8.400 4.423 2.281 5.413 . 0 0 "[ . 1 . ]" 1
345 1 35 MET QG 1 82 LEU QD 1.800 . 8.400 3.556 2.595 4.463 . 0 0 "[ . 1 . ]" 1
346 1 36 LEU H 1 36 LEU QB 1.800 . 3.500 2.407 2.064 2.748 . 0 0 "[ . 1 . ]" 1
347 1 36 LEU H 1 36 LEU QD 1.800 . 5.900 2.655 2.005 3.412 . 0 0 "[ . 1 . ]" 1
348 1 36 LEU H 1 37 THR H 1.800 . 3.500 2.775 2.462 3.158 . 0 0 "[ . 1 . ]" 1
349 1 36 LEU HA 1 36 LEU QD 1.800 . 7.400 2.838 1.962 3.469 . 0 0 "[ . 1 . ]" 1
350 1 36 LEU QB 1 36 LEU QD 1.800 . 5.900 1.916 1.770 2.044 0.030 16 0 "[ . 1 . ]" 1
351 1 36 LEU QB 1 37 THR H 1.800 . 4.500 3.496 2.591 4.026 . 0 0 "[ . 1 . ]" 1
352 1 36 LEU QD 1 75 VAL QG 1.800 . 8.300 3.989 2.805 4.418 . 0 0 "[ . 1 . ]" 1
353 1 37 THR H 1 37 THR HB 1.800 . 3.500 2.961 2.428 3.555 0.055 18 0 "[ . 1 . ]" 1
354 1 37 THR H 1 37 THR MG 1.800 . 4.500 3.164 2.067 3.859 . 0 0 "[ . 1 . ]" 1
355 1 37 THR H 1 38 ALA H 1.800 . 3.500 2.503 1.962 3.430 . 0 0 "[ . 1 . ]" 1
356 1 37 THR H 1 38 ALA HA 1.800 . 5.000 4.853 4.559 5.022 0.022 5 0 "[ . 1 . ]" 1
357 1 37 THR H 1 38 ALA MB 1.800 . 4.500 3.612 3.235 3.743 . 0 0 "[ . 1 . ]" 1
358 1 37 THR HA 1 37 THR MG 1.800 . 4.500 2.697 2.181 3.276 . 0 0 "[ . 1 . ]" 1
359 1 37 THR HA 1 38 ALA H 1.800 . 5.000 3.031 2.253 3.563 . 0 0 "[ . 1 . ]" 1
360 1 37 THR MG 1 38 ALA H 1.800 . 6.000 3.838 2.448 4.497 . 0 0 "[ . 1 . ]" 1
361 1 38 ALA H 1 38 ALA MB 1.800 . 4.500 2.490 2.108 2.823 . 0 0 "[ . 1 . ]" 1
362 1 38 ALA H 1 39 LYS H 1.800 . 5.000 4.263 3.248 4.662 . 0 0 "[ . 1 . ]" 1
363 1 38 ALA HA 1 39 LYS H 1.800 . 2.500 2.255 2.101 2.490 . 0 0 "[ . 1 . ]" 1
364 1 39 LYS H 1 39 LYS QD 1.800 . 4.500 2.535 1.906 3.367 . 0 0 "[ . 1 . ]" 1
365 1 39 LYS H 1 39 LYS QE 1.800 . 6.000 4.506 3.855 5.421 . 0 0 "[ . 1 . ]" 1
366 1 39 LYS H 1 39 LYS QG 1.800 . 4.500 3.343 2.333 4.148 . 0 0 "[ . 1 . ]" 1
367 1 39 LYS H 1 40 ALA H 1.800 . 3.500 2.857 2.238 3.379 . 0 0 "[ . 1 . ]" 1
368 1 39 LYS HA 1 39 LYS QD 1.800 . 6.000 3.401 1.824 4.093 . 0 0 "[ . 1 . ]" 1
369 1 39 LYS HA 1 78 SER QB 1.800 . 3.500 2.846 2.294 3.446 . 0 0 "[ . 1 . ]" 1
370 1 39 LYS QB 1 40 ALA H 1.800 . 6.000 3.492 2.280 4.078 . 0 0 "[ . 1 . ]" 1
371 1 39 LYS QD 1 39 LYS QE 1.800 . 7.000 2.056 2.015 2.106 . 0 0 "[ . 1 . ]" 1
372 1 39 LYS QD 1 39 LYS QG 1.800 . 5.500 2.088 2.040 2.117 . 0 0 "[ . 1 . ]" 1
373 1 39 LYS QD 1 40 ALA H 1.800 . 6.000 3.798 1.912 4.880 . 0 0 "[ . 1 . ]" 1
374 1 39 LYS QG 1 40 ALA H 1.800 . 6.000 3.837 2.346 4.841 . 0 0 "[ . 1 . ]" 1
375 1 39 LYS QG 1 78 SER HG 5.000 5.000 45.000 5.023 4.216 6.057 0.784 8 5 "[ *.* + 1 * - ]" 1
376 1 39 LYS QG 1 80 LEU HA 1.800 . 6.000 5.147 4.401 5.408 . 0 0 "[ . 1 . ]" 1
377 1 40 ALA H 1 40 ALA MB 1.800 . 3.500 2.539 2.093 2.936 . 0 0 "[ . 1 . ]" 1
378 1 40 ALA H 1 41 LEU H 1.800 . 5.000 4.305 3.706 4.624 . 0 0 "[ . 1 . ]" 1
379 1 41 LEU H 1 41 LEU QB 1.800 . 4.500 2.422 2.319 2.689 . 0 0 "[ . 1 . ]" 1
380 1 41 LEU H 1 41 LEU MD1 1.800 . 4.500 3.458 2.976 3.742 . 0 0 "[ . 1 . ]" 1
381 1 41 LEU H 1 41 LEU MD2 1.800 . 4.500 3.644 3.421 3.778 . 0 0 "[ . 1 . ]" 1
382 1 41 LEU H 1 41 LEU HG 1.800 . 3.500 2.360 1.998 2.648 . 0 0 "[ . 1 . ]" 1
383 1 41 LEU H 1 42 PRO HD3 1.800 . 5.000 4.731 4.105 5.007 0.007 13 0 "[ . 1 . ]" 1
384 1 41 LEU HA 1 41 LEU MD2 1.800 . 4.500 2.145 1.954 2.366 . 0 0 "[ . 1 . ]" 1
385 1 41 LEU HA 1 41 LEU HG 1.800 . 3.500 2.771 2.538 3.018 . 0 0 "[ . 1 . ]" 1
386 1 41 LEU HA 1 42 PRO QD 1.800 . 4.500 2.021 1.929 2.179 . 0 0 "[ . 1 . ]" 1
387 1 41 LEU QB 1 41 LEU MD1 1.800 . 4.500 2.107 2.064 2.166 . 0 0 "[ . 1 . ]" 1
388 1 41 LEU QB 1 42 PRO QD 1.800 . 7.000 2.483 1.867 3.530 . 0 0 "[ . 1 . ]" 1
389 1 41 LEU QB 1 42 PRO HD3 1.800 . 6.000 3.492 2.896 4.172 . 0 0 "[ . 1 . ]" 1
390 1 41 LEU MD1 1 80 LEU QD 1.800 . 9.400 4.839 3.468 5.479 . 0 0 "[ . 1 . ]" 1
391 1 41 LEU MD1 1 82 LEU QD 1.800 . 9.400 3.340 2.331 4.291 . 0 0 "[ . 1 . ]" 1
392 1 41 LEU MD1 1 87 TYR QD 1.800 . 8.000 4.593 2.951 5.162 . 0 0 "[ . 1 . ]" 1
393 1 41 LEU MD2 1 42 PRO QD 1.800 . 4.500 2.341 1.973 2.860 . 0 0 "[ . 1 . ]" 1
394 1 41 LEU HG 1 42 PRO QD 1.800 . 6.000 4.093 3.858 4.306 . 0 0 "[ . 1 . ]" 1
395 1 41 LEU HG 1 42 PRO HD3 1.800 . 5.000 4.674 4.341 4.901 . 0 0 "[ . 1 . ]" 1
396 1 42 PRO QB 1 46 GLN QE 5.000 5.000 45.000 4.031 3.708 4.427 1.292 9 18 [********+*****-***] 1
397 1 42 PRO QB 1 47 TYR QD 1.800 . 8.000 4.064 3.180 4.841 . 0 0 "[ . 1 . ]" 1
398 1 42 PRO QB 1 47 TYR QE 1.800 . 6.500 4.528 4.009 5.259 . 0 0 "[ . 1 . ]" 1
399 1 42 PRO QD 1 42 PRO QG 1.800 . 5.500 1.962 1.952 1.974 . 0 0 "[ . 1 . ]" 1
400 1 42 PRO QD 1 47 TYR QE 1.800 . 8.000 3.273 2.216 4.021 . 0 0 "[ . 1 . ]" 1
401 1 42 PRO HD3 1 47 TYR QE 1.800 . 7.000 4.830 3.742 5.606 . 0 0 "[ . 1 . ]" 1
402 1 42 PRO QG 1 47 TYR QD 1.800 . 8.000 3.583 2.279 4.499 . 0 0 "[ . 1 . ]" 1
403 1 42 PRO QG 1 47 TYR QE 1.800 . 8.000 3.471 2.973 4.405 . 0 0 "[ . 1 . ]" 1
404 1 43 THR H 1 43 THR HB 1.800 . 3.500 3.316 2.801 3.567 0.067 3 0 "[ . 1 . ]" 1
405 1 43 THR H 1 43 THR MG 1.800 . 4.500 2.927 2.201 3.833 . 0 0 "[ . 1 . ]" 1
406 1 43 THR H 1 46 GLN QB 1.800 . 6.000 3.192 2.478 3.939 . 0 0 "[ . 1 . ]" 1
407 1 43 THR HA 1 43 THR MG 1.800 . 6.000 2.239 2.116 2.432 . 0 0 "[ . 1 . ]" 1
408 1 43 THR HA 1 44 THR H 1.800 . 3.500 2.320 2.206 2.536 . 0 0 "[ . 1 . ]" 1
409 1 43 THR HA 1 45 ALA H 1.800 . 5.000 4.483 4.320 4.728 . 0 0 "[ . 1 . ]" 1
410 1 43 THR HA 1 47 TYR QE 1.800 . 7.000 4.708 4.189 5.306 . 0 0 "[ . 1 . ]" 1
411 1 43 THR HB 1 44 THR H 1.800 . 3.500 2.843 2.244 3.523 0.023 7 0 "[ . 1 . ]" 1
412 1 43 THR HB 1 45 ALA H 1.800 . 3.500 3.046 2.795 3.399 . 0 0 "[ . 1 . ]" 1
413 1 43 THR HG1 1 43 THR MG 1.800 . 4.500 2.574 2.206 2.985 . 0 0 "[ . 1 . ]" 1
414 1 43 THR HG1 1 45 ALA MB 1.800 . 6.000 3.697 2.513 4.741 . 0 0 "[ . 1 . ]" 1
415 1 43 THR HG1 1 46 GLN QG 1.800 . 7.000 3.683 2.950 5.238 . 0 0 "[ . 1 . ]" 1
416 1 43 THR MG 1 44 THR H 1.800 . 4.500 3.026 1.993 3.697 . 0 0 "[ . 1 . ]" 1
417 1 44 THR H 1 44 THR HB 1.800 . 2.500 2.427 2.256 2.513 0.013 16 0 "[ . 1 . ]" 1
418 1 44 THR H 1 44 THR MG 1.800 . 4.500 2.255 2.043 2.816 . 0 0 "[ . 1 . ]" 1
419 1 44 THR H 1 45 ALA H 1.800 . 3.500 3.029 2.888 3.361 . 0 0 "[ . 1 . ]" 1
420 1 44 THR HA 1 44 THR HB 1.800 . 2.500 2.400 2.313 2.511 0.011 17 0 "[ . 1 . ]" 1
421 1 44 THR HA 1 44 THR MG 1.800 . 6.000 3.254 3.219 3.269 . 0 0 "[ . 1 . ]" 1
422 1 44 THR HA 1 45 ALA H 1.800 . 3.500 3.517 3.501 3.542 0.042 8 0 "[ . 1 . ]" 1
423 1 44 THR HB 1 47 TYR QD 1.800 . 7.000 4.364 3.807 5.485 . 0 0 "[ . 1 . ]" 1
424 1 44 THR HB 1 47 TYR QE 1.800 . 7.000 5.849 5.437 6.547 . 0 0 "[ . 1 . ]" 1
425 1 44 THR MG 1 45 ALA H 1.800 . 6.000 2.287 2.059 2.472 . 0 0 "[ . 1 . ]" 1
426 1 44 THR MG 1 48 LYS QD 1.800 . 7.000 4.608 3.816 5.061 . 0 0 "[ . 1 . ]" 1
427 1 44 THR O 1 48 LYS H 2.000 . 2.300 2.094 1.963 2.265 0.037 14 0 "[ . 1 . ]" 1
428 1 44 THR O 1 48 LYS N 2.000 . 3.300 3.018 2.872 3.146 . 0 0 "[ . 1 . ]" 1
429 1 45 ALA H 1 45 ALA MB 1.800 . 4.500 2.239 2.108 2.290 . 0 0 "[ . 1 . ]" 1
430 1 45 ALA H 1 46 GLN H 1.800 . 3.500 2.829 2.645 3.138 . 0 0 "[ . 1 . ]" 1
431 1 45 ALA H 1 47 TYR H 1.800 . 5.000 3.900 3.790 3.985 . 0 0 "[ . 1 . ]" 1
432 1 45 ALA HA 1 48 LYS H 1.800 . 5.000 3.724 3.488 4.035 . 0 0 "[ . 1 . ]" 1
433 1 45 ALA MB 1 46 GLN H 1.800 . 4.500 2.300 2.156 2.430 . 0 0 "[ . 1 . ]" 1
434 1 45 ALA O 1 49 LEU H 2.000 . 2.300 2.312 2.159 2.361 0.061 10 0 "[ . 1 . ]" 1
435 1 45 ALA O 1 49 LEU N 2.000 . 3.300 3.272 3.135 3.325 0.025 10 0 "[ . 1 . ]" 1
436 1 46 GLN H 1 46 GLN QG 1.800 . 4.500 2.477 2.029 3.716 . 0 0 "[ . 1 . ]" 1
437 1 46 GLN H 1 47 TYR H 1.800 . 3.500 2.675 2.591 2.846 . 0 0 "[ . 1 . ]" 1
438 1 46 GLN H 1 48 LYS H 1.800 . 5.000 4.481 4.220 4.759 . 0 0 "[ . 1 . ]" 1
439 1 46 GLN HA 1 46 GLN QE 1.800 . 6.000 4.445 3.984 4.905 . 0 0 "[ . 1 . ]" 1
440 1 46 GLN HA 1 46 GLN QG 1.800 . 4.500 2.386 2.085 2.801 . 0 0 "[ . 1 . ]" 1
441 1 46 GLN HA 1 47 TYR H 1.800 . 3.500 3.520 3.503 3.532 0.032 17 0 "[ . 1 . ]" 1
442 1 46 GLN QB 1 46 GLN QE 1.800 . 7.000 3.264 2.673 3.640 . 0 0 "[ . 1 . ]" 1
443 1 46 GLN QB 1 46 GLN QG 1.800 . 7.000 2.076 2.031 2.113 . 0 0 "[ . 1 . ]" 1
444 1 46 GLN QB 1 47 TYR H 1.800 . 4.500 2.751 2.567 3.030 . 0 0 "[ . 1 . ]" 1
445 1 46 GLN QG 1 47 TYR H 1.800 . 6.000 4.170 3.877 4.408 . 0 0 "[ . 1 . ]" 1
446 1 46 GLN O 1 50 MET H 2.000 . 2.300 1.988 1.920 2.197 0.080 11 0 "[ . 1 . ]" 1
447 1 46 GLN O 1 50 MET N 2.000 . 3.300 2.899 2.798 3.081 . 0 0 "[ . 1 . ]" 1
448 1 47 TYR H 1 47 TYR HB2 1.800 . 3.500 2.157 2.042 2.248 . 0 0 "[ . 1 . ]" 1
449 1 47 TYR H 1 47 TYR QD 1.800 . 5.500 3.295 2.732 3.709 . 0 0 "[ . 1 . ]" 1
450 1 47 TYR H 1 48 LYS H 1.800 . 3.500 2.871 2.757 3.098 . 0 0 "[ . 1 . ]" 1
451 1 47 TYR H 1 49 LEU H 1.800 . 5.000 4.362 4.107 4.720 . 0 0 "[ . 1 . ]" 1
452 1 47 TYR H 1 98 LEU QD 1.800 . 7.400 4.295 3.844 4.904 . 0 0 "[ . 1 . ]" 1
453 1 47 TYR HA 1 47 TYR QD 1.800 . 5.500 2.510 1.825 3.003 . 0 0 "[ . 1 . ]" 1
454 1 47 TYR HA 1 48 LYS H 1.800 . 5.000 3.595 3.551 3.637 . 0 0 "[ . 1 . ]" 1
455 1 47 TYR HA 1 91 PHE QE 1.800 . 5.500 4.465 3.211 5.131 . 0 0 "[ . 1 . ]" 1
456 1 47 TYR HB2 1 48 LYS H 1.800 . 3.500 2.847 2.714 3.031 . 0 0 "[ . 1 . ]" 1
457 1 47 TYR HB2 1 98 LEU QD 1.800 . 7.400 2.952 2.437 3.625 . 0 0 "[ . 1 . ]" 1
458 1 47 TYR HB3 1 48 LYS H 1.800 . 5.000 2.851 2.556 3.175 . 0 0 "[ . 1 . ]" 1
459 1 47 TYR HB3 1 98 LEU QD 1.800 . 5.900 2.310 1.801 3.047 . 0 0 "[ . 1 . ]" 1
460 1 47 TYR QD 1 48 LYS H 1.800 . 7.000 4.510 4.413 4.695 . 0 0 "[ . 1 . ]" 1
461 1 47 TYR QD 1 48 LYS HA 1.800 . 7.000 5.261 4.843 5.706 . 0 0 "[ . 1 . ]" 1
462 1 47 TYR QD 1 50 MET QB 1.800 . 5.500 3.886 3.061 4.828 . 0 0 "[ . 1 . ]" 1
463 1 47 TYR QD 1 50 MET QG 1.800 . 8.000 5.247 4.138 5.958 . 0 0 "[ . 1 . ]" 1
464 1 47 TYR QD 1 91 PHE QE 1.800 . 7.500 3.663 2.959 4.694 . 0 0 "[ . 1 . ]" 1
465 1 47 TYR QD 1 98 LEU QB 1.800 . 6.500 4.732 3.343 5.392 . 0 0 "[ . 1 . ]" 1
466 1 47 TYR QD 1 98 LEU QD 1.800 . 9.400 3.216 2.275 4.298 . 0 0 "[ . 1 . ]" 1
467 1 47 TYR QE 1 50 MET QB 1.800 . 7.000 5.179 4.687 5.927 . 0 0 "[ . 1 . ]" 1
468 1 47 TYR QE 1 91 PHE HA 1.800 . 7.000 3.864 3.067 5.500 . 0 0 "[ . 1 . ]" 1
469 1 47 TYR QE 1 91 PHE HB2 1.800 . 7.000 5.176 4.298 5.837 . 0 0 "[ . 1 . ]" 1
470 1 47 TYR QE 1 91 PHE QD 1.800 . 7.500 3.427 2.448 4.101 . 0 0 "[ . 1 . ]" 1
471 1 47 TYR QE 1 91 PHE QE 1.800 . 5.500 3.051 1.989 4.100 . 0 0 "[ . 1 . ]" 1
472 1 47 TYR QE 1 98 LEU QD 1.800 . 9.400 4.494 3.386 5.793 . 0 0 "[ . 1 . ]" 1
473 1 47 TYR O 1 51 CYS H 2.000 . 2.300 2.057 1.968 2.267 0.032 12 0 "[ . 1 . ]" 1
474 1 47 TYR O 1 51 CYS N 2.000 . 3.300 2.966 2.802 3.164 . 0 0 "[ . 1 . ]" 1
475 1 48 LYS H 1 48 LYS QB 1.800 . 3.500 2.533 1.984 3.041 . 0 0 "[ . 1 . ]" 1
476 1 48 LYS H 1 48 LYS QD 1.800 . 4.500 3.621 2.675 4.045 . 0 0 "[ . 1 . ]" 1
477 1 48 LYS H 1 48 LYS QE 1.800 . 6.000 4.762 4.004 5.349 . 0 0 "[ . 1 . ]" 1
478 1 48 LYS H 1 48 LYS QG 1.800 . 6.000 2.680 1.995 4.075 . 0 0 "[ . 1 . ]" 1
479 1 48 LYS H 1 49 LEU H 1.800 . 3.500 2.818 2.635 3.076 . 0 0 "[ . 1 . ]" 1
480 1 48 LYS H 1 50 MET H 1.800 . 5.000 4.181 4.028 4.367 . 0 0 "[ . 1 . ]" 1
481 1 48 LYS H 1 98 LEU QD 1.800 . 7.400 2.925 2.393 3.391 . 0 0 "[ . 1 . ]" 1
482 1 48 LYS HA 1 48 LYS QD 1.800 . 4.500 3.635 2.312 4.164 . 0 0 "[ . 1 . ]" 1
483 1 48 LYS HA 1 48 LYS QG 1.800 . 4.500 2.914 2.125 3.414 . 0 0 "[ . 1 . ]" 1
484 1 48 LYS HA 1 49 LEU H 1.800 . 3.500 3.544 3.504 3.593 0.093 15 0 "[ . 1 . ]" 1
485 1 48 LYS HA 1 51 CYS H 1.800 . 3.500 3.438 2.984 3.533 0.033 2 0 "[ . 1 . ]" 1
486 1 48 LYS HA 1 51 CYS QB 1.800 . 4.500 2.804 2.411 3.551 . 0 0 "[ . 1 . ]" 1
487 1 48 LYS HA 1 52 ALA H 1.800 . 5.000 4.781 4.307 5.017 0.017 1 0 "[ . 1 . ]" 1
488 1 48 LYS HA 1 98 LEU QD 1.800 . 5.900 2.817 2.051 3.872 . 0 0 "[ . 1 . ]" 1
489 1 48 LYS QB 1 48 LYS QD 1.800 . 4.500 2.136 1.940 2.788 . 0 0 "[ . 1 . ]" 1
490 1 48 LYS QB 1 48 LYS QG 1.800 . 5.500 2.067 2.007 2.108 . 0 0 "[ . 1 . ]" 1
491 1 48 LYS QD 1 48 LYS QE 1.800 . 5.500 2.069 2.010 2.115 . 0 0 "[ . 1 . ]" 1
492 1 48 LYS QD 1 48 LYS QG 1.800 . 4.500 2.065 1.990 2.108 . 0 0 "[ . 1 . ]" 1
493 1 48 LYS QD 1 49 LEU H 1.800 . 6.000 4.490 3.530 5.214 . 0 0 "[ . 1 . ]" 1
494 1 48 LYS QE 1 48 LYS QG 1.800 . 5.500 2.166 1.979 2.407 . 0 0 "[ . 1 . ]" 1
495 1 49 LEU H 1 49 LEU HB2 1.800 . 3.500 2.347 2.162 2.721 . 0 0 "[ . 1 . ]" 1
496 1 49 LEU H 1 49 LEU QD 1.800 . 7.400 2.911 1.854 3.494 . 0 0 "[ . 1 . ]" 1
497 1 49 LEU H 1 49 LEU HG 1.800 . 3.500 2.933 2.138 3.699 0.199 10 0 "[ . 1 . ]" 1
498 1 49 LEU H 1 50 MET H 1.800 . 3.500 2.778 2.694 2.885 . 0 0 "[ . 1 . ]" 1
499 1 49 LEU H 1 51 CYS H 1.800 . 5.000 4.311 4.036 4.501 . 0 0 "[ . 1 . ]" 1
500 1 49 LEU HA 1 49 LEU QD 1.800 . 5.900 2.134 2.011 2.307 . 0 0 "[ . 1 . ]" 1
501 1 49 LEU HA 1 49 LEU HG 1.800 . 3.500 2.902 2.465 3.584 0.084 1 0 "[ . 1 . ]" 1
502 1 49 LEU HB2 1 49 LEU QD 1.800 . 7.400 2.181 2.013 2.510 . 0 0 "[ . 1 . ]" 1
503 1 49 LEU HB2 1 49 LEU HG 1.800 . 2.500 2.500 2.246 2.566 0.066 2 0 "[ . 1 . ]" 1
504 1 49 LEU HB2 1 50 MET H 1.800 . 5.000 2.682 2.467 2.891 . 0 0 "[ . 1 . ]" 1
505 1 49 LEU HB3 1 49 LEU QD 1.800 . 4.900 2.218 2.050 2.623 . 0 0 "[ . 1 . ]" 1
506 1 49 LEU QD 1 49 LEU HG 1.800 . 4.900 1.899 1.860 1.921 . 0 0 "[ . 1 . ]" 1
507 1 49 LEU QD 1 50 MET H 1.800 . 7.400 3.952 3.161 4.197 . 0 0 "[ . 1 . ]" 1
508 1 49 LEU HG 1 50 MET H 1.800 . 5.000 4.703 4.245 5.011 0.011 15 0 "[ . 1 . ]" 1
509 1 50 MET H 1 50 MET QB 1.800 . 3.500 2.228 2.068 2.373 . 0 0 "[ . 1 . ]" 1
510 1 50 MET H 1 50 MET QG 1.800 . 6.000 2.929 2.474 3.887 . 0 0 "[ . 1 . ]" 1
511 1 50 MET H 1 51 CYS H 1.800 . 3.500 2.751 2.584 2.840 . 0 0 "[ . 1 . ]" 1
512 1 50 MET HA 1 50 MET QG 1.800 . 4.500 2.226 2.041 2.901 . 0 0 "[ . 1 . ]" 1
513 1 50 MET QB 1 50 MET QG 1.800 . 4.500 2.085 1.997 2.112 . 0 0 "[ . 1 . ]" 1
514 1 50 MET QB 1 51 CYS H 1.800 . 3.500 2.642 2.347 2.957 . 0 0 "[ . 1 . ]" 1
515 1 50 MET QB 1 60 ILE MD 5.000 5.000 45.000 4.789 3.858 6.475 1.142 3 10 "[ *+*. *1 ***-**]" 1
516 1 50 MET QB 1 91 PHE QD 1.800 . 7.000 5.257 4.810 5.999 . 0 0 "[ . 1 . ]" 1
517 1 50 MET QB 1 91 PHE QE 1.800 . 5.500 3.410 2.933 4.200 . 0 0 "[ . 1 . ]" 1
518 1 51 CYS H 1 52 ALA H 1.800 . 3.500 2.830 2.709 3.013 . 0 0 "[ . 1 . ]" 1
519 1 51 CYS H 1 52 ALA MB 1.800 . 6.000 4.523 4.058 4.769 . 0 0 "[ . 1 . ]" 1
520 1 51 CYS H 1 57 ASN QD . 5.000 7.000 5.381 4.644 6.025 0.356 12 0 "[ . 1 . ]" 1
521 1 51 CYS HA 1 52 ALA H 1.800 . 3.500 3.495 3.166 3.531 0.031 14 0 "[ . 1 . ]" 1
522 1 51 CYS HA 1 91 PHE QE 1.800 . 5.500 3.144 2.687 3.595 . 0 0 "[ . 1 . ]" 1
523 1 51 CYS QB 1 52 ALA H 1.800 . 4.500 3.021 2.696 3.684 . 0 0 "[ . 1 . ]" 1
524 1 51 CYS QB 1 95 CYS QB 1.800 . 5.500 3.865 2.661 4.224 . 0 0 "[ . 1 . ]" 1
525 1 51 CYS SG 1 95 CYS SG 1.800 . 2.100 2.020 2.017 2.024 . 0 0 "[ . 1 . ]" 1
526 1 52 ALA H 1 52 ALA MB 1.800 . 4.500 2.333 2.183 2.579 . 0 0 "[ . 1 . ]" 1
527 1 52 ALA H 1 53 SER H 1.800 . 3.500 2.780 1.978 3.509 0.009 5 0 "[ . 1 . ]" 1
528 1 52 ALA HA 1 53 SER H 1.800 . 3.500 3.234 2.366 3.546 0.046 16 0 "[ . 1 . ]" 1
529 1 52 ALA MB 1 53 SER H 1.800 . 4.500 3.120 2.054 3.754 . 0 0 "[ . 1 . ]" 1
530 1 53 SER H 1 56 CYS QB 1.800 . 6.000 3.989 3.303 5.252 . 0 0 "[ . 1 . ]" 1
531 1 53 SER HA 1 54 THR H 1.800 . 3.500 2.328 2.031 3.391 . 0 0 "[ . 1 . ]" 1
532 1 53 SER HA 1 55 ALA H 1.800 . 5.000 4.304 3.882 4.867 . 0 0 "[ . 1 . ]" 1
533 1 53 SER HA 1 56 CYS H 1.800 . 5.000 4.948 4.806 5.089 0.089 5 0 "[ . 1 . ]" 1
534 1 54 THR H 1 54 THR MG 1.800 . 6.000 2.949 2.146 4.027 . 0 0 "[ . 1 . ]" 1
535 1 54 THR H 1 55 ALA H 1.800 . 5.000 3.023 2.204 4.042 . 0 0 "[ . 1 . ]" 1
536 1 54 THR HA 1 54 THR MG 1.800 . 6.000 2.658 2.151 3.291 . 0 0 "[ . 1 . ]" 1
537 1 54 THR HB 1 55 ALA H 1.800 . 5.000 3.109 2.015 4.164 . 0 0 "[ . 1 . ]" 1
538 1 54 THR MG 1 55 ALA H 1.800 . 4.500 3.030 2.109 3.830 . 0 0 "[ . 1 . ]" 1
539 1 54 THR O 1 58 THR H 2.000 . 2.300 2.156 1.996 2.324 0.024 5 0 "[ . 1 . ]" 1
540 1 54 THR O 1 58 THR N 2.000 . 3.300 3.068 2.881 3.231 . 0 0 "[ . 1 . ]" 1
541 1 55 ALA H 1 55 ALA MB 1.800 . 3.500 2.242 2.127 2.318 . 0 0 "[ . 1 . ]" 1
542 1 55 ALA H 1 56 CYS H 1.800 . 3.500 2.888 2.667 3.122 . 0 0 "[ . 1 . ]" 1
543 1 55 ALA HA 1 56 CYS H 1.800 . 3.500 3.537 3.521 3.557 0.057 3 0 "[ . 1 . ]" 1
544 1 55 ALA MB 1 56 CYS H 1.800 . 4.500 2.237 2.029 2.714 . 0 0 "[ . 1 . ]" 1
545 1 55 ALA MB 1 56 CYS HA 1.800 . 4.500 3.639 3.533 3.685 . 0 0 "[ . 1 . ]" 1
546 1 55 ALA O 1 59 MET H 2.000 . 2.300 2.196 1.969 2.373 0.073 10 0 "[ . 1 . ]" 1
547 1 55 ALA O 1 59 MET N 2.000 . 3.300 3.131 2.925 3.313 0.013 9 0 "[ . 1 . ]" 1
548 1 56 CYS H 1 57 ASN H 1.800 . 3.500 2.801 2.632 2.904 . 0 0 "[ . 1 . ]" 1
549 1 56 CYS H 1 59 MET QG 1.800 . 6.000 4.528 4.211 5.189 . 0 0 "[ . 1 . ]" 1
550 1 56 CYS HA 1 57 ASN H 1.800 . 3.500 3.519 3.486 3.534 0.034 8 0 "[ . 1 . ]" 1
551 1 56 CYS HA 1 59 MET ME 1.800 . 4.500 2.438 2.014 3.323 . 0 0 "[ . 1 . ]" 1
552 1 56 CYS QB 1 57 ASN H 1.800 . 6.000 2.619 2.396 2.973 . 0 0 "[ . 1 . ]" 1
553 1 56 CYS QB 1 60 ILE MD 5.000 5.000 45.000 4.172 3.045 5.769 1.955 9 11 "[ -**.* +1 ******]" 1
554 1 56 CYS O 1 60 ILE H 2.000 . 2.300 2.188 1.986 2.334 0.034 14 0 "[ . 1 . ]" 1
555 1 56 CYS O 1 60 ILE N 2.000 . 3.300 3.163 2.957 3.310 0.010 14 0 "[ . 1 . ]" 1
556 1 57 ASN H 1 57 ASN QD 1.800 . 6.000 3.371 2.431 4.267 . 0 0 "[ . 1 . ]" 1
557 1 57 ASN H 1 58 THR H 1.800 . 3.500 2.723 2.571 2.852 . 0 0 "[ . 1 . ]" 1
558 1 57 ASN H 1 60 ILE MD 5.000 5.000 45.000 5.834 4.766 7.226 0.234 16 0 "[ . 1 . ]" 1
559 1 57 ASN HA 1 57 ASN QD 1.800 . 6.000 2.916 2.227 4.011 . 0 0 "[ . 1 . ]" 1
560 1 57 ASN HA 1 58 THR H 1.800 . 3.500 3.539 3.519 3.554 0.054 10 0 "[ . 1 . ]" 1
561 1 57 ASN HA 1 60 ILE H 1.800 . 5.000 3.759 3.546 4.138 . 0 0 "[ . 1 . ]" 1
562 1 57 ASN HA 1 60 ILE HB 1.800 . 5.000 3.267 2.760 3.866 . 0 0 "[ . 1 . ]" 1
563 1 57 ASN HA 1 61 LYS H 1.800 . 3.500 3.538 3.492 3.564 0.064 16 0 "[ . 1 . ]" 1
564 1 57 ASN QB 1 58 THR H 1.800 . 4.500 2.633 2.378 2.833 . 0 0 "[ . 1 . ]" 1
565 1 57 ASN O 1 61 LYS H 2.000 . 2.300 2.030 1.950 2.253 0.050 10 0 "[ . 1 . ]" 1
566 1 57 ASN O 1 61 LYS N 2.000 . 3.300 2.926 2.826 3.090 . 0 0 "[ . 1 . ]" 1
567 1 58 THR H 1 58 THR HB 1.800 . 2.500 2.517 2.468 2.560 0.060 18 0 "[ . 1 . ]" 1
568 1 58 THR H 1 58 THR MG 1.800 . 4.500 3.789 3.761 3.812 . 0 0 "[ . 1 . ]" 1
569 1 58 THR HA 1 58 THR MG 1.800 . 3.500 2.458 2.358 2.569 . 0 0 "[ . 1 . ]" 1
570 1 58 THR HA 1 59 MET H 1.800 . 3.500 3.533 3.507 3.549 0.049 2 0 "[ . 1 . ]" 1
571 1 58 THR HA 1 60 ILE H 1.800 . 5.000 4.998 4.926 5.056 0.056 3 0 "[ . 1 . ]" 1
572 1 58 THR MG 1 59 MET H 1.800 . 4.500 3.381 3.038 3.571 . 0 0 "[ . 1 . ]" 1
573 1 58 THR MG 1 59 MET QB 5.000 5.000 45.000 4.810 4.385 4.971 0.615 3 1 "[ + . 1 . ]" 1
574 1 58 THR O 1 62 LYS H 2.000 . 2.300 2.155 1.987 2.322 0.022 1 0 "[ . 1 . ]" 1
575 1 58 THR O 1 62 LYS N 2.000 . 3.300 3.014 2.857 3.178 . 0 0 "[ . 1 . ]" 1
576 1 59 MET H 1 59 MET QG 1.800 . 4.500 2.390 1.947 3.333 . 0 0 "[ . 1 . ]" 1
577 1 59 MET H 1 60 ILE H 1.800 . 3.500 3.013 2.822 3.260 . 0 0 "[ . 1 . ]" 1
578 1 59 MET HA 1 59 MET QG 1.800 . 6.000 2.544 2.002 3.019 . 0 0 "[ . 1 . ]" 1
579 1 59 MET HA 1 60 ILE H 1.800 . 3.500 3.539 3.524 3.549 0.049 10 0 "[ . 1 . ]" 1
580 1 59 MET QB 1 59 MET QG 1.800 . 7.000 2.090 2.029 2.111 . 0 0 "[ . 1 . ]" 1
581 1 59 MET QB 1 60 ILE H 1.800 . 6.000 2.107 1.975 2.473 . 0 0 "[ . 1 . ]" 1
582 1 59 MET QB 1 60 ILE HG12 1.800 . 4.500 3.447 2.637 3.988 . 0 0 "[ . 1 . ]" 1
583 1 59 MET ME 1 60 ILE H 1.800 . 6.000 3.273 3.042 3.567 . 0 0 "[ . 1 . ]" 1
584 1 59 MET ME 1 60 ILE HB 1.800 . 6.000 4.594 4.308 4.875 . 0 0 "[ . 1 . ]" 1
585 1 59 MET ME 1 60 ILE MD 1.800 . 5.500 3.091 2.167 3.576 . 0 0 "[ . 1 . ]" 1
586 1 59 MET ME 1 60 ILE HG12 1.800 . 6.000 3.151 2.578 3.743 . 0 0 "[ . 1 . ]" 1
587 1 59 MET ME 1 60 ILE HG13 1.800 . 4.500 3.094 2.475 3.812 . 0 0 "[ . 1 . ]" 1
588 1 59 MET ME 1 60 ILE MG 1.800 . 7.000 4.777 4.573 4.871 . 0 0 "[ . 1 . ]" 1
589 1 59 MET ME 1 87 TYR QE 1.800 . 8.000 4.034 3.383 4.811 . 0 0 "[ . 1 . ]" 1
590 1 59 MET QG 1 60 ILE H 1.800 . 6.000 3.766 3.186 4.170 . 0 0 "[ . 1 . ]" 1
591 1 59 MET QG 1 60 ILE MD 5.000 5.000 45.000 5.259 4.300 5.622 0.700 11 1 "[ . 1+ . ]" 1
592 1 59 MET QG 1 60 ILE HG12 5.000 5.000 45.000 5.354 4.221 6.153 0.779 1 2 "[+ . 1 - . ]" 1
593 1 59 MET QG 1 60 ILE HG13 5.000 5.000 45.000 5.182 4.347 6.270 0.653 18 3 "[ . 1 -. *+]" 1
594 1 59 MET O 1 63 ILE H 2.000 . 2.300 2.261 2.045 2.373 0.073 3 0 "[ . 1 . ]" 1
595 1 59 MET O 1 63 ILE N 2.000 . 3.300 3.204 3.012 3.324 0.024 3 0 "[ . 1 . ]" 1
596 1 60 ILE H 1 60 ILE HB 1.800 . 3.500 2.534 2.313 2.712 . 0 0 "[ . 1 . ]" 1
597 1 60 ILE H 1 60 ILE MD 1.800 . 4.500 3.449 2.694 3.759 . 0 0 "[ . 1 . ]" 1
598 1 60 ILE H 1 60 ILE HG12 1.800 . 3.500 2.994 2.099 3.516 0.016 15 0 "[ . 1 . ]" 1
599 1 60 ILE H 1 60 ILE HG13 1.800 . 5.000 2.716 1.999 3.858 . 0 0 "[ . 1 . ]" 1
600 1 60 ILE H 1 60 ILE MG 1.800 . 6.000 3.802 3.738 3.879 . 0 0 "[ . 1 . ]" 1
601 1 60 ILE H 1 61 LYS H 1.800 . 3.500 2.872 2.792 2.963 . 0 0 "[ . 1 . ]" 1
602 1 60 ILE HA 1 60 ILE MD 1.800 . 4.500 3.111 1.874 3.855 . 0 0 "[ . 1 . ]" 1
603 1 60 ILE HA 1 60 ILE HG12 1.800 . 3.500 2.696 2.356 3.428 . 0 0 "[ . 1 . ]" 1
604 1 60 ILE HA 1 60 ILE MG 1.800 . 4.500 2.432 2.254 2.604 . 0 0 "[ . 1 . ]" 1
605 1 60 ILE HA 1 61 LYS H 1.800 . 3.500 3.544 3.525 3.563 0.063 7 0 "[ . 1 . ]" 1
606 1 60 ILE HA 1 63 ILE H 1.800 . 3.500 3.428 3.293 3.510 0.010 7 0 "[ . 1 . ]" 1
607 1 60 ILE HA 1 63 ILE QG 1.800 . 4.500 3.204 2.793 3.782 . 0 0 "[ . 1 . ]" 1
608 1 60 ILE HB 1 60 ILE MD 1.800 . 4.500 2.667 2.210 3.255 . 0 0 "[ . 1 . ]" 1
609 1 60 ILE HB 1 61 LYS H 1.800 . 5.000 2.524 2.370 2.647 . 0 0 "[ . 1 . ]" 1
610 1 60 ILE HB 1 62 LYS H 1.800 . 5.000 5.018 4.942 5.058 0.058 4 0 "[ . 1 . ]" 1
611 1 60 ILE HB 1 91 PHE QE 1.800 . 5.500 4.860 4.590 5.236 . 0 0 "[ . 1 . ]" 1
612 1 60 ILE MD 1 60 ILE MG 1.800 . 5.500 2.016 1.658 2.257 0.142 12 0 "[ . 1 . ]" 1
613 1 60 ILE MD 1 91 PHE QD 1.800 . 8.000 2.729 2.425 3.958 . 0 0 "[ . 1 . ]" 1
614 1 60 ILE MD 1 91 PHE QE 1.800 . 8.000 3.054 2.609 4.151 . 0 0 "[ . 1 . ]" 1
615 1 60 ILE MD 1 91 PHE HZ 1.800 . 6.000 3.752 2.886 4.829 . 0 0 "[ . 1 . ]" 1
616 1 60 ILE HG12 1 60 ILE MG 1.800 . 4.500 2.671 2.229 3.202 . 0 0 "[ . 1 . ]" 1
617 1 60 ILE HG12 1 61 LYS H 1.800 . 5.000 4.728 4.243 5.004 0.004 4 0 "[ . 1 . ]" 1
618 1 60 ILE HG12 1 87 TYR QD 1.800 . 7.000 5.200 3.763 6.450 . 0 0 "[ . 1 . ]" 1
619 1 60 ILE HG12 1 87 TYR QE 1.800 . 7.000 3.519 2.039 4.728 . 0 0 "[ . 1 . ]" 1
620 1 60 ILE HG12 1 91 PHE HB2 1.800 . 5.000 4.862 4.512 5.068 0.068 10 0 "[ . 1 . ]" 1
621 1 60 ILE HG12 1 91 PHE HB3 1.800 . 5.000 4.879 4.574 5.035 0.035 1 0 "[ . 1 . ]" 1
622 1 60 ILE HG12 1 91 PHE QD 1.800 . 5.500 4.456 4.046 4.869 . 0 0 "[ . 1 . ]" 1
623 1 60 ILE HG12 1 91 PHE QE 1.800 . 7.000 4.769 3.961 5.454 . 0 0 "[ . 1 . ]" 1
624 1 60 ILE HG13 1 60 ILE MG 1.800 . 6.000 2.875 2.139 3.213 . 0 0 "[ . 1 . ]" 1
625 1 60 ILE HG13 1 61 LYS H 1.800 . 5.000 4.527 4.173 5.040 0.040 11 0 "[ . 1 . ]" 1
626 1 60 ILE MG 1 63 ILE H 1.800 . 6.000 4.701 4.524 4.915 . 0 0 "[ . 1 . ]" 1
627 1 60 ILE MG 1 64 VAL MG2 1.800 . 5.500 2.318 1.966 2.637 . 0 0 "[ . 1 . ]" 1
628 1 60 ILE MG 1 87 TYR QD 1.800 . 8.000 4.450 3.632 5.715 . 0 0 "[ . 1 . ]" 1
629 1 60 ILE MG 1 87 TYR QE 1.800 . 8.000 4.002 3.163 5.170 . 0 0 "[ . 1 . ]" 1
630 1 60 ILE MG 1 88 ALA HA 1.800 . 4.500 2.548 2.043 3.070 . 0 0 "[ . 1 . ]" 1
631 1 60 ILE MG 1 88 ALA MB 1.800 . 5.500 3.247 2.182 3.669 . 0 0 "[ . 1 . ]" 1
632 1 60 ILE MG 1 91 PHE HB2 1.800 . 6.000 2.961 2.262 3.462 . 0 0 "[ . 1 . ]" 1
633 1 60 ILE MG 1 91 PHE HB3 1.800 . 4.500 2.262 1.922 2.695 . 0 0 "[ . 1 . ]" 1
634 1 60 ILE MG 1 91 PHE QD 1.800 . 6.500 2.953 2.539 3.308 . 0 0 "[ . 1 . ]" 1
635 1 60 ILE MG 1 91 PHE QE 1.800 . 8.000 4.225 3.965 4.532 . 0 0 "[ . 1 . ]" 1
636 1 60 ILE O 1 64 VAL H 2.000 . 2.300 1.999 1.945 2.114 0.055 18 0 "[ . 1 . ]" 1
637 1 60 ILE O 1 64 VAL N 2.000 . 3.300 2.921 2.808 3.028 . 0 0 "[ . 1 . ]" 1
638 1 61 LYS H 1 61 LYS QE 1.800 . 4.500 3.951 3.585 4.144 . 0 0 "[ . 1 . ]" 1
639 1 61 LYS H 1 62 LYS H 1.800 . 3.500 2.839 2.741 2.977 . 0 0 "[ . 1 . ]" 1
640 1 61 LYS H 1 63 ILE H 1.800 . 5.000 4.452 4.312 4.602 . 0 0 "[ . 1 . ]" 1
641 1 61 LYS HA 1 61 LYS QD 1.800 . 4.500 3.646 2.152 4.090 . 0 0 "[ . 1 . ]" 1
642 1 61 LYS HA 1 61 LYS QG 1.800 . 6.000 2.493 2.125 2.836 . 0 0 "[ . 1 . ]" 1
643 1 61 LYS HA 1 62 LYS H 1.800 . 3.500 3.525 3.508 3.539 0.039 18 0 "[ . 1 . ]" 1
644 1 61 LYS HA 1 63 ILE H 1.800 . 5.000 4.649 4.535 4.729 . 0 0 "[ . 1 . ]" 1
645 1 61 LYS HA 1 64 VAL H 1.800 . 3.500 3.476 3.394 3.543 0.043 18 0 "[ . 1 . ]" 1
646 1 61 LYS HA 1 64 VAL HB 1.800 . 3.500 2.615 2.432 2.870 . 0 0 "[ . 1 . ]" 1
647 1 61 LYS QB 1 61 LYS QD 1.800 . 4.500 2.265 2.015 2.737 . 0 0 "[ . 1 . ]" 1
648 1 61 LYS QB 1 61 LYS QE 1.800 . 7.000 2.370 1.998 3.139 . 0 0 "[ . 1 . ]" 1
649 1 61 LYS QB 1 61 LYS QG 1.800 . 5.500 2.058 2.024 2.113 . 0 0 "[ . 1 . ]" 1
650 1 61 LYS QD 1 61 LYS QE 1.800 . 5.500 2.087 2.032 2.115 . 0 0 "[ . 1 . ]" 1
651 1 61 LYS QD 1 61 LYS QG 1.800 . 4.500 2.025 2.000 2.053 . 0 0 "[ . 1 . ]" 1
652 1 61 LYS QE 1 61 LYS QG 1.800 . 7.000 2.268 2.039 2.483 . 0 0 "[ . 1 . ]" 1
653 1 61 LYS QG 1 62 LYS H 1.800 . 4.500 3.929 3.631 4.103 . 0 0 "[ . 1 . ]" 1
654 1 61 LYS O 1 65 THR H 2.000 . 2.300 1.994 1.959 2.148 0.041 9 0 "[ . 1 . ]" 1
655 1 61 LYS O 1 65 THR N 2.000 . 3.300 2.953 2.873 3.108 . 0 0 "[ . 1 . ]" 1
656 1 62 LYS H 1 62 LYS QD 1.800 . 6.000 4.295 3.841 4.474 . 0 0 "[ . 1 . ]" 1
657 1 62 LYS H 1 62 LYS QG 1.800 . 6.000 3.803 2.901 4.100 . 0 0 "[ . 1 . ]" 1
658 1 62 LYS H 1 63 ILE H 1.800 . 3.500 2.719 2.602 2.802 . 0 0 "[ . 1 . ]" 1
659 1 62 LYS HA 1 62 LYS QD 1.800 . 4.500 4.044 3.843 4.100 . 0 0 "[ . 1 . ]" 1
660 1 62 LYS HA 1 62 LYS QG 1.800 . 6.000 2.437 2.153 2.599 . 0 0 "[ . 1 . ]" 1
661 1 62 LYS HA 1 63 ILE H 1.800 . 3.500 3.541 3.530 3.570 0.070 3 0 "[ . 1 . ]" 1
662 1 62 LYS HA 1 66 LEU QD 1.800 . 7.400 4.176 3.448 5.214 . 0 0 "[ . 1 . ]" 1
663 1 62 LYS QB 1 62 LYS QD 1.800 . 5.500 2.066 1.934 2.142 . 0 0 "[ . 1 . ]" 1
664 1 62 LYS QB 1 62 LYS QG 1.800 . 5.500 2.089 2.050 2.110 . 0 0 "[ . 1 . ]" 1
665 1 62 LYS QD 1 62 LYS QE 1.800 . 5.500 2.055 2.011 2.109 . 0 0 "[ . 1 . ]" 1
666 1 62 LYS QD 1 62 LYS QG 1.800 . 4.500 2.091 2.037 2.111 . 0 0 "[ . 1 . ]" 1
667 1 62 LYS QE 1 62 LYS QG 1.800 . 5.500 2.211 2.070 2.375 . 0 0 "[ . 1 . ]" 1
668 1 62 LYS O 1 66 LEU H 2.000 . 2.300 2.182 1.994 2.326 0.026 11 0 "[ . 1 . ]" 1
669 1 62 LYS O 1 66 LEU N 2.000 . 3.300 3.079 2.816 3.232 . 0 0 "[ . 1 . ]" 1
670 1 63 ILE H 1 63 ILE HB 1.800 . 3.500 2.587 2.428 2.778 . 0 0 "[ . 1 . ]" 1
671 1 63 ILE H 1 63 ILE MD 1.800 . 4.500 3.381 2.746 3.773 . 0 0 "[ . 1 . ]" 1
672 1 63 ILE H 1 63 ILE QG 1.800 . 4.500 2.149 2.016 2.256 . 0 0 "[ . 1 . ]" 1
673 1 63 ILE H 1 63 ILE MG 1.800 . 4.500 3.815 3.769 3.843 . 0 0 "[ . 1 . ]" 1
674 1 63 ILE HA 1 63 ILE MD 1.800 . 4.500 2.751 1.932 3.881 . 0 0 "[ . 1 . ]" 1
675 1 63 ILE HA 1 63 ILE QG 1.800 . 6.000 2.758 2.402 3.213 . 0 0 "[ . 1 . ]" 1
676 1 63 ILE HA 1 63 ILE MG 1.800 . 3.500 2.432 2.298 2.567 . 0 0 "[ . 1 . ]" 1
677 1 63 ILE HA 1 66 LEU QB 1.800 . 4.500 2.847 2.193 3.887 . 0 0 "[ . 1 . ]" 1
678 1 63 ILE HA 1 66 LEU HG 1.800 . 3.500 3.085 2.032 3.511 0.011 12 0 "[ . 1 . ]" 1
679 1 63 ILE HB 1 64 VAL H 1.800 . 3.500 2.767 2.632 2.896 . 0 0 "[ . 1 . ]" 1
680 1 63 ILE MD 1 63 ILE QG 1.800 . 4.500 1.881 1.859 1.904 . 0 0 "[ . 1 . ]" 1
681 1 63 ILE QG 1 63 ILE MG 1.800 . 4.500 2.273 2.095 2.484 . 0 0 "[ . 1 . ]" 1
682 1 63 ILE MG 1 64 VAL H 1.800 . 4.500 3.592 3.446 3.754 . 0 0 "[ . 1 . ]" 1
683 1 63 ILE MG 1 68 PRO QD 1.800 . 7.000 3.027 2.592 3.347 . 0 0 "[ . 1 . ]" 1
684 1 63 ILE MG 1 84 VAL QG 1.800 . 6.900 2.582 1.822 3.487 . 0 0 "[ . 1 . ]" 1
685 1 63 ILE MG 1 88 ALA HA 1.800 . 6.000 4.032 3.237 4.637 . 0 0 "[ . 1 . ]" 1
686 1 64 VAL H 1 64 VAL HB 1.800 . 2.500 2.509 2.389 2.547 0.047 3 0 "[ . 1 . ]" 1
687 1 64 VAL H 1 64 VAL MG1 1.800 . 5.000 3.776 3.752 3.797 . 0 0 "[ . 1 . ]" 1
688 1 64 VAL H 1 64 VAL MG2 1.800 . 3.500 2.178 2.022 2.345 . 0 0 "[ . 1 . ]" 1
689 1 64 VAL H 1 65 THR H 1.800 . 3.500 2.738 2.579 2.840 . 0 0 "[ . 1 . ]" 1
690 1 64 VAL HA 1 64 VAL MG1 1.800 . 3.500 2.412 2.254 2.545 . 0 0 "[ . 1 . ]" 1
691 1 64 VAL HA 1 64 VAL MG2 1.800 . 3.500 2.443 2.216 2.527 . 0 0 "[ . 1 . ]" 1
692 1 64 VAL HA 1 65 THR H 1.800 . 3.500 3.544 3.520 3.564 0.064 2 0 "[ . 1 . ]" 1
693 1 64 VAL HA 1 66 LEU H 1.800 . 5.000 4.316 4.113 4.516 . 0 0 "[ . 1 . ]" 1
694 1 64 VAL HA 1 67 ASN H 1.800 . 3.500 3.487 3.301 3.554 0.054 16 0 "[ . 1 . ]" 1
695 1 64 VAL HA 1 88 ALA MB 1.800 . 4.500 2.681 1.982 3.547 . 0 0 "[ . 1 . ]" 1
696 1 64 VAL HA 1 89 ASN QD 1.800 . 6.000 4.302 2.984 5.044 . 0 0 "[ . 1 . ]" 1
697 1 64 VAL HB 1 65 THR H 1.800 . 3.500 2.408 2.269 2.571 . 0 0 "[ . 1 . ]" 1
698 1 64 VAL MG1 1 65 THR H 1.800 . 4.500 3.335 3.078 3.571 . 0 0 "[ . 1 . ]" 1
699 1 64 VAL MG1 1 89 ASN QD 1.800 . 7.000 3.636 2.221 4.919 . 0 0 "[ . 1 . ]" 1
700 1 64 VAL MG2 1 65 THR H 1.800 . 4.500 3.793 3.768 3.827 . 0 0 "[ . 1 . ]" 1
701 1 64 VAL MG2 1 87 TYR QD 1.800 . 8.000 5.370 4.870 6.069 . 0 0 "[ . 1 . ]" 1
702 1 64 VAL MG2 1 87 TYR QE 1.800 . 8.000 5.658 5.067 6.068 . 0 0 "[ . 1 . ]" 1
703 1 64 VAL MG2 1 88 ALA MB 1.800 . 5.500 2.024 1.850 2.216 . 0 0 "[ . 1 . ]" 1
704 1 64 VAL MG2 1 89 ASN QD 1.800 . 7.000 4.128 2.117 4.973 . 0 0 "[ . 1 . ]" 1
705 1 65 THR H 1 65 THR HB 1.800 . 3.500 3.242 2.722 3.598 0.098 2 0 "[ . 1 . ]" 1
706 1 65 THR H 1 65 THR MG 1.800 . 4.500 3.140 2.268 3.829 . 0 0 "[ . 1 . ]" 1
707 1 65 THR HA 1 65 THR MG 1.800 . 3.500 2.288 2.171 2.444 . 0 0 "[ . 1 . ]" 1
708 1 65 THR HA 1 66 LEU H 1.800 . 3.500 3.522 3.506 3.538 0.038 5 0 "[ . 1 . ]" 1
709 1 65 THR HA 1 67 ASN H 1.800 . 5.000 4.382 4.182 4.538 . 0 0 "[ . 1 . ]" 1
710 1 65 THR HB 1 66 LEU H 1.800 . 3.500 3.170 2.631 3.543 0.043 1 0 "[ . 1 . ]" 1
711 1 66 LEU H 1 66 LEU QB 1.800 . 6.000 2.312 2.050 2.650 . 0 0 "[ . 1 . ]" 1
712 1 66 LEU H 1 66 LEU QD 1.800 . 5.900 2.919 2.349 3.733 . 0 0 "[ . 1 . ]" 1
713 1 66 LEU H 1 66 LEU HG 1.800 . 5.000 3.379 2.256 4.488 . 0 0 "[ . 1 . ]" 1
714 1 66 LEU H 1 67 ASN H 1.800 . 3.500 2.692 2.505 2.799 . 0 0 "[ . 1 . ]" 1
715 1 66 LEU H 1 67 ASN HA 1.800 . 5.000 4.915 4.711 5.013 0.013 2 0 "[ . 1 . ]" 1
716 1 66 LEU HA 1 66 LEU QD 1.800 . 7.400 2.244 1.959 3.347 . 0 0 "[ . 1 . ]" 1
717 1 66 LEU HA 1 67 ASN H 1.800 . 3.500 3.527 3.498 3.552 0.052 14 0 "[ . 1 . ]" 1
718 1 66 LEU QB 1 66 LEU QD 1.800 . 8.400 1.989 1.824 2.098 . 0 0 "[ . 1 . ]" 1
719 1 66 LEU QB 1 67 ASN H 1.800 . 6.000 2.799 2.386 3.686 . 0 0 "[ . 1 . ]" 1
720 1 66 LEU QD 1 66 LEU HG 1.800 . 4.900 1.900 1.880 1.926 . 0 0 "[ . 1 . ]" 1
721 1 66 LEU QD 1 67 ASN H 1.800 . 7.400 3.844 3.114 4.271 . 0 0 "[ . 1 . ]" 1
722 1 66 LEU HG 1 67 ASN H 1.800 . 5.000 4.304 2.425 5.036 0.036 10 0 "[ . 1 . ]" 1
723 1 67 ASN H 1 68 PRO QD 1.800 . 4.500 2.542 2.347 2.889 . 0 0 "[ . 1 . ]" 1
724 1 67 ASN HA 1 68 PRO QD 1.800 . 4.500 2.032 1.904 2.166 . 0 0 "[ . 1 . ]" 1
725 1 67 ASN HA 1 85 TYR QD 1.800 . 7.000 4.822 3.556 5.724 . 0 0 "[ . 1 . ]" 1
726 1 67 ASN HA 1 85 TYR QE 1.800 . 7.000 4.540 3.126 5.445 . 0 0 "[ . 1 . ]" 1
727 1 67 ASN QD 1 89 ASN QD 5.000 5.000 45.000 5.378 3.887 6.733 1.113 2 4 "[ + . *1 * .- ]" 1
728 1 68 PRO QB 1 85 TYR QD 1.800 . 6.500 3.803 3.403 4.056 . 0 0 "[ . 1 . ]" 1
729 1 68 PRO QB 1 85 TYR QE 1.800 . 8.000 5.477 5.100 5.815 . 0 0 "[ . 1 . ]" 1
730 1 68 PRO QD 1 68 PRO QG 1.800 . 5.500 1.959 1.948 1.973 . 0 0 "[ . 1 . ]" 1
731 1 68 PRO QG 1 69 PRO HD3 1.800 . 6.000 4.829 4.701 5.103 . 0 0 "[ . 1 . ]" 1
732 1 68 PRO QG 1 84 VAL HA 1.800 . 6.000 5.017 4.585 5.383 . 0 0 "[ . 1 . ]" 1
733 1 69 PRO HA 1 70 ASN H 1.800 . 2.500 2.273 2.198 2.372 . 0 0 "[ . 1 . ]" 1
734 1 69 PRO QB 1 70 ASN H 1.800 . 6.000 3.007 2.690 3.411 . 0 0 "[ . 1 . ]" 1
735 1 70 ASN H 1 71 CYS H 1.800 . 5.000 4.360 4.157 4.503 . 0 0 "[ . 1 . ]" 1
736 1 70 ASN HA 1 71 CYS H 1.800 . 2.500 2.091 2.003 2.254 . 0 0 "[ . 1 . ]" 1
737 1 70 ASN HA 1 83 ASN QD 1.800 . 6.500 4.240 2.843 5.384 . 0 0 "[ . 1 . ]" 1
738 1 70 ASN HA 1 85 TYR H 1.800 . 5.000 4.270 3.724 4.690 . 0 0 "[ . 1 . ]" 1
739 1 70 ASN HA 1 85 TYR HB2 1.800 . 3.500 2.275 1.910 2.795 . 0 0 "[ . 1 . ]" 1
740 1 70 ASN HA 1 85 TYR HB3 1.800 . 3.500 2.752 2.429 2.922 . 0 0 "[ . 1 . ]" 1
741 1 70 ASN HA 1 85 TYR QD 1.800 . 5.500 3.145 2.772 3.600 . 0 0 "[ . 1 . ]" 1
742 1 70 ASN HA 1 85 TYR QE 1.800 . 7.000 4.603 3.926 5.175 . 0 0 "[ . 1 . ]" 1
743 1 70 ASN HA 1 86 SER H 1.800 . 5.000 4.791 4.350 5.018 0.018 15 0 "[ . 1 . ]" 1
744 1 70 ASN QB 1 85 TYR QD 1.800 . 8.000 3.190 2.339 4.107 . 0 0 "[ . 1 . ]" 1
745 1 70 ASN QB 1 85 TYR QE 1.800 . 8.000 3.547 3.040 4.451 . 0 0 "[ . 1 . ]" 1
746 1 71 CYS H 1 72 ASP H 1.800 . 5.000 4.291 4.100 4.416 . 0 0 "[ . 1 . ]" 1
747 1 71 CYS H 1 83 ASN QD 1.800 . 6.000 3.436 2.255 4.894 . 0 0 "[ . 1 . ]" 1
748 1 71 CYS H 1 85 TYR HB3 1.800 . 3.500 3.441 2.788 3.558 0.058 10 0 "[ . 1 . ]" 1
749 1 71 CYS HA 1 72 ASP H 1.800 . 2.500 2.335 2.146 2.605 0.105 2 0 "[ . 1 . ]" 1
750 1 71 CYS HA 1 72 ASP QB 1.800 . 6.000 4.286 3.943 4.577 . 0 0 "[ . 1 . ]" 1
751 1 71 CYS HA 1 83 ASN QD 1.800 . 6.500 3.937 2.950 5.676 . 0 0 "[ . 1 . ]" 1
752 1 71 CYS QB 1 72 ASP H 1.800 . 4.500 2.578 2.197 2.873 . 0 0 "[ . 1 . ]" 1
753 1 72 ASP H 1 73 LEU H 1.800 . 5.000 4.527 4.241 4.680 . 0 0 "[ . 1 . ]" 1
754 1 72 ASP HA 1 83 ASN HA 1.800 . 3.500 2.480 1.774 3.519 0.026 10 0 "[ . 1 . ]" 1
755 1 72 ASP HA 1 84 VAL H 1.800 . 5.000 4.381 3.612 5.049 0.049 1 0 "[ . 1 . ]" 1
756 1 72 ASP QB 1 73 LEU H 1.800 . 4.500 3.113 2.539 3.520 . 0 0 "[ . 1 . ]" 1
757 1 72 ASP QB 1 81 VAL QG 1.800 . 6.900 2.334 1.957 2.800 . 0 0 "[ . 1 . ]" 1
758 1 73 LEU H 1 73 LEU QB 1.800 . 4.500 2.600 2.263 3.365 . 0 0 "[ . 1 . ]" 1
759 1 73 LEU H 1 73 LEU QD 1.800 . 5.900 3.334 1.976 3.931 . 0 0 "[ . 1 . ]" 1
760 1 73 LEU H 1 74 THR H 1.800 . 5.000 4.247 3.685 4.540 . 0 0 "[ . 1 . ]" 1
761 1 73 LEU H 1 82 LEU H 1.800 . 3.500 3.369 3.016 3.521 0.021 1 0 "[ . 1 . ]" 1
762 1 73 LEU H 1 82 LEU O 2.000 . 2.300 2.157 1.950 2.389 0.089 2 0 "[ . 1 . ]" 1
763 1 73 LEU H 1 83 ASN HA 1.800 . 3.500 2.904 2.169 3.537 0.037 16 0 "[ . 1 . ]" 1
764 1 73 LEU HA 1 73 LEU QD 1.800 . 5.900 2.533 1.813 3.327 . 0 0 "[ . 1 . ]" 1
765 1 73 LEU HA 1 74 THR H 1.800 . 2.500 2.194 2.030 2.496 . 0 0 "[ . 1 . ]" 1
766 1 73 LEU HA 1 82 LEU H 1.800 . 5.000 4.889 4.707 5.012 0.012 4 0 "[ . 1 . ]" 1
767 1 73 LEU QB 1 73 LEU QD 1.800 . 8.400 1.958 1.813 2.100 . 0 0 "[ . 1 . ]" 1
768 1 73 LEU QB 1 74 THR H 1.800 . 6.000 3.494 2.282 3.966 . 0 0 "[ . 1 . ]" 1
769 1 73 LEU QD 1 74 THR H 1.800 . 5.900 3.163 2.628 4.112 . 0 0 "[ . 1 . ]" 1
770 1 73 LEU QD 1 84 VAL QG 1.800 . 7.300 2.466 1.787 3.293 0.013 14 0 "[ . 1 . ]" 1
771 1 73 LEU N 1 82 LEU O 2.000 . 3.300 3.017 2.858 3.263 . 0 0 "[ . 1 . ]" 1
772 1 73 LEU O 1 82 LEU H 2.000 . 2.300 2.028 1.966 2.248 0.034 14 0 "[ . 1 . ]" 1
773 1 73 LEU O 1 82 LEU N 2.000 . 3.300 2.968 2.862 3.172 . 0 0 "[ . 1 . ]" 1
774 1 74 THR H 1 74 THR HB 1.800 . 3.500 3.296 2.859 3.575 0.075 18 0 "[ . 1 . ]" 1
775 1 74 THR H 1 74 THR MG 1.800 . 6.000 3.116 2.000 3.852 . 0 0 "[ . 1 . ]" 1
776 1 74 THR H 1 75 VAL H 1.800 . 5.000 4.564 4.460 4.660 . 0 0 "[ . 1 . ]" 1
777 1 74 THR HA 1 75 VAL H 1.800 . 2.500 2.206 2.125 2.279 . 0 0 "[ . 1 . ]" 1
778 1 74 THR HA 1 81 VAL QG 1.800 . 5.900 2.725 2.119 3.251 . 0 0 "[ . 1 . ]" 1
779 1 74 THR HA 1 82 LEU H 1.800 . 3.500 3.171 2.892 3.503 0.003 2 0 "[ . 1 . ]" 1
780 1 74 THR HB 1 75 VAL H 1.800 . 3.500 3.320 2.748 3.568 0.068 7 0 "[ . 1 . ]" 1
781 1 75 VAL CG1 1 78 SER HG 1.800 . 5.000 3.618 2.764 5.062 0.062 6 0 "[ . 1 . ]" 1
782 1 75 VAL H 1 75 VAL HB 1.800 . 3.500 2.578 2.233 2.817 . 0 0 "[ . 1 . ]" 1
783 1 75 VAL H 1 75 VAL QG 1.800 . 5.900 2.544 2.144 3.104 . 0 0 "[ . 1 . ]" 1
784 1 75 VAL H 1 80 LEU QB 1.800 . 6.000 4.749 4.433 4.994 . 0 0 "[ . 1 . ]" 1
785 1 75 VAL H 1 80 LEU O 2.000 . 2.300 2.097 1.952 2.269 0.048 8 0 "[ . 1 . ]" 1
786 1 75 VAL H 1 81 VAL HA 1.800 . 3.500 3.158 2.816 3.544 0.044 14 0 "[ . 1 . ]" 1
787 1 75 VAL H 1 82 LEU H 1.800 . 6.000 4.290 3.844 4.957 . 0 0 "[ . 1 . ]" 1
788 1 75 VAL HA 1 75 VAL QG 1.800 . 5.900 2.136 1.995 2.222 . 0 0 "[ . 1 . ]" 1
789 1 75 VAL HA 1 76 PRO QD 1.800 . 4.500 1.963 1.893 2.027 . 0 0 "[ . 1 . ]" 1
790 1 75 VAL HB 1 75 VAL QG 1.800 . 4.900 1.906 1.866 1.927 . 0 0 "[ . 1 . ]" 1
791 1 75 VAL HB 1 78 SER HG 1.800 . 5.000 3.004 2.194 5.061 0.061 14 0 "[ . 1 . ]" 1
792 1 75 VAL HB 1 80 LEU H 1.800 . 3.500 3.276 2.832 3.535 0.035 14 0 "[ . 1 . ]" 1
793 1 75 VAL QG 1 76 PRO QD 1.800 . 6.900 2.422 1.822 2.898 . 0 0 "[ . 1 . ]" 1
794 1 75 VAL QG 1 77 THR H 1.800 . 5.900 2.405 2.006 3.686 . 0 0 "[ . 1 . ]" 1
795 1 75 VAL QG 1 78 SER H 1.800 . 5.900 2.123 1.812 2.721 . 0 0 "[ . 1 . ]" 1
796 1 75 VAL QG 1 78 SER QB 1.800 . 6.900 2.715 1.560 3.295 0.240 3 0 "[ . 1 . ]" 1
797 1 75 VAL QG 1 79 GLY H 1.800 . 7.400 3.200 2.042 3.807 . 0 0 "[ . 1 . ]" 1
798 1 75 VAL N 1 80 LEU O 2.000 . 3.300 3.043 2.877 3.236 . 0 0 "[ . 1 . ]" 1
799 1 76 PRO HA 1 76 PRO QD 1.800 . 4.500 3.453 3.349 3.518 . 0 0 "[ . 1 . ]" 1
800 1 76 PRO QB 1 77 THR MG 1.800 . 7.000 4.387 3.640 4.914 . 0 0 "[ . 1 . ]" 1
801 1 77 THR H 1 77 THR HB 1.800 . 3.500 3.006 2.398 3.565 0.065 4 0 "[ . 1 . ]" 1
802 1 77 THR H 1 77 THR MG 1.800 . 4.500 2.467 1.963 3.730 . 0 0 "[ . 1 . ]" 1
803 1 77 THR H 1 78 SER H 1.800 . 3.000 2.673 2.082 3.036 0.036 3 0 "[ . 1 . ]" 1
804 1 77 THR H 1 78 SER QB 1.800 . 6.000 4.889 4.365 5.287 . 0 0 "[ . 1 . ]" 1
805 1 77 THR H 1 79 GLY QA 5.000 5.000 45.000 5.317 4.419 6.025 0.581 1 1 "[+ . 1 . ]" 1
806 1 77 THR H 1 80 LEU H 5.000 5.000 45.000 5.907 4.997 6.643 0.003 1 0 "[ . 1 . ]" 1
807 1 77 THR HA 1 77 THR MG 1.800 . 4.500 2.906 2.091 3.272 . 0 0 "[ . 1 . ]" 1
808 1 77 THR HA 1 78 SER H 1.800 . 5.000 3.492 3.109 3.614 . 0 0 "[ . 1 . ]" 1
809 1 77 THR HA 1 79 GLY H 1.800 . 5.000 4.812 4.200 5.024 0.024 13 0 "[ . 1 . ]" 1
810 1 77 THR HB 1 78 SER H 1.800 . 5.000 3.817 2.536 4.547 . 0 0 "[ . 1 . ]" 1
811 1 77 THR MG 1 78 SER H 1.800 . 4.500 2.958 1.919 3.868 . 0 0 "[ . 1 . ]" 1
812 1 78 SER H 1 79 GLY H 1.800 . 3.000 2.473 2.052 2.963 . 0 0 "[ . 1 . ]" 1
813 1 78 SER H 1 80 LEU H 1.800 . 5.000 4.340 3.989 4.855 . 0 0 "[ . 1 . ]" 1
814 1 78 SER HA 1 79 GLY H 1.800 . 3.500 3.527 3.506 3.539 0.039 16 0 "[ . 1 . ]" 1
815 1 78 SER QB 1 80 LEU H 1.800 . 6.000 3.632 2.826 4.525 . 0 0 "[ . 1 . ]" 1
816 1 78 SER QB 1 80 LEU QB 1.800 . 5.500 3.441 2.443 4.056 . 0 0 "[ . 1 . ]" 1
817 1 78 SER HG 1 80 LEU H 1.800 . 5.000 3.436 2.633 5.032 0.032 3 0 "[ . 1 . ]" 1
818 1 78 SER HG 1 80 LEU QB 1.800 . 4.500 3.365 1.958 4.008 . 0 0 "[ . 1 . ]" 1
819 1 79 GLY H 1 80 LEU H 1.800 . 3.500 2.369 2.161 2.732 . 0 0 "[ . 1 . ]" 1
820 1 79 GLY H 1 80 LEU QB 1.800 . 5.000 4.228 3.867 4.515 . 0 0 "[ . 1 . ]" 1
821 1 79 GLY HA3 1 80 LEU H 1.800 . 5.000 3.483 3.139 3.607 . 0 0 "[ . 1 . ]" 1
822 1 80 LEU H 1 80 LEU QB 1.800 . 4.500 2.605 2.146 2.999 . 0 0 "[ . 1 . ]" 1
823 1 80 LEU H 1 80 LEU QD 1.800 . 7.400 3.809 3.445 4.192 . 0 0 "[ . 1 . ]" 1
824 1 80 LEU HA 1 80 LEU QD 1.800 . 7.400 2.509 1.942 2.932 . 0 0 "[ . 1 . ]" 1
825 1 80 LEU HA 1 81 VAL H 1.800 . 2.500 2.356 2.178 2.510 0.010 7 0 "[ . 1 . ]" 1
826 1 80 LEU QB 1 80 LEU QD 1.800 . 5.900 1.898 1.760 2.066 0.040 9 0 "[ . 1 . ]" 1
827 1 80 LEU QB 1 81 VAL H 1.800 . 3.500 2.973 2.791 3.096 . 0 0 "[ . 1 . ]" 1
828 1 81 VAL H 1 81 VAL HB 1.800 . 2.500 2.494 2.374 2.543 0.043 5 0 "[ . 1 . ]" 1
829 1 81 VAL H 1 81 VAL QG 1.800 . 5.900 2.451 2.060 2.773 . 0 0 "[ . 1 . ]" 1
830 1 81 VAL H 1 82 LEU H 1.800 . 5.000 4.501 4.285 4.604 . 0 0 "[ . 1 . ]" 1
831 1 81 VAL HA 1 81 VAL QG 1.800 . 5.900 2.171 2.113 2.228 . 0 0 "[ . 1 . ]" 1
832 1 81 VAL HA 1 82 LEU H 1.800 . 2.500 2.228 2.157 2.350 . 0 0 "[ . 1 . ]" 1
833 1 81 VAL HB 1 81 VAL QG 1.800 . 4.900 1.903 1.887 1.913 . 0 0 "[ . 1 . ]" 1
834 1 81 VAL QG 1 82 LEU H 1.800 . 5.900 2.486 2.052 3.051 . 0 0 "[ . 1 . ]" 1
835 1 81 VAL QG 1 83 ASN HA 1.800 . 8.800 4.446 4.058 5.201 . 0 0 "[ . 1 . ]" 1
836 1 82 LEU H 1 82 LEU QB 1.800 . 4.500 2.622 2.497 2.717 . 0 0 "[ . 1 . ]" 1
837 1 82 LEU H 1 82 LEU QD 1.800 . 5.900 4.016 3.851 4.074 . 0 0 "[ . 1 . ]" 1
838 1 82 LEU H 1 82 LEU HG 1.800 . 5.000 4.521 4.431 4.682 . 0 0 "[ . 1 . ]" 1
839 1 82 LEU HA 1 83 ASN H 1.800 . 2.500 2.180 2.090 2.275 . 0 0 "[ . 1 . ]" 1
840 1 82 LEU QB 1 82 LEU QD 1.800 . 8.400 1.928 1.879 1.951 . 0 0 "[ . 1 . ]" 1
841 1 82 LEU QB 1 83 ASN H 1.800 . 6.000 3.737 3.381 4.012 . 0 0 "[ . 1 . ]" 1
842 1 82 LEU QD 1 82 LEU HG 1.800 . 4.900 1.909 1.894 1.916 . 0 0 "[ . 1 . ]" 1
843 1 82 LEU QD 1 83 ASN H 1.800 . 5.900 2.551 2.024 3.279 . 0 0 "[ . 1 . ]" 1
844 1 82 LEU QD 1 83 ASN HA 1.800 . 7.400 4.536 4.295 5.172 . 0 0 "[ . 1 . ]" 1
845 1 82 LEU QD 1 84 VAL HA 1.800 . 5.900 3.583 3.352 3.808 . 0 0 "[ . 1 . ]" 1
846 1 82 LEU QD 1 84 VAL HB 1.800 . 7.400 5.104 4.511 5.446 . 0 0 "[ . 1 . ]" 1
847 1 82 LEU QD 1 84 VAL QG 1.800 . 7.300 2.838 2.218 3.454 . 0 0 "[ . 1 . ]" 1
848 1 82 LEU QD 1 87 TYR H 1.800 . 7.400 4.496 3.195 5.028 . 0 0 "[ . 1 . ]" 1
849 1 82 LEU QD 1 87 TYR HB2 1.800 . 5.900 2.935 2.346 3.459 . 0 0 "[ . 1 . ]" 1
850 1 82 LEU QD 1 87 TYR HB3 1.800 . 5.900 3.976 3.526 4.354 . 0 0 "[ . 1 . ]" 1
851 1 82 LEU QD 1 87 TYR QD 1.800 . 7.900 3.089 2.471 3.679 . 0 0 "[ . 1 . ]" 1
852 1 82 LEU QD 1 87 TYR QE 1.800 . 9.400 3.827 3.217 4.349 . 0 0 "[ . 1 . ]" 1
853 1 82 LEU HG 1 83 ASN H 1.800 . 5.000 2.974 2.369 3.539 . 0 0 "[ . 1 . ]" 1
854 1 82 LEU HG 1 84 VAL HA 1.800 . 3.500 3.468 3.021 3.596 0.096 6 0 "[ . 1 . ]" 1
855 1 83 ASN H 1 83 ASN HB2 1.800 . 3.500 2.705 2.303 3.573 0.073 10 0 "[ . 1 . ]" 1
856 1 83 ASN H 1 83 ASN HB3 1.800 . 3.500 2.745 2.385 3.511 0.011 12 0 "[ . 1 . ]" 1
857 1 83 ASN HA 1 83 ASN QD 1.800 . 6.000 3.393 2.629 4.485 . 0 0 "[ . 1 . ]" 1
858 1 83 ASN HA 1 84 VAL H 1.800 . 3.500 2.514 2.099 3.498 . 0 0 "[ . 1 . ]" 1
859 1 83 ASN HA 1 84 VAL HA 1.800 . 5.000 4.634 4.383 5.155 0.155 1 0 "[ . 1 . ]" 1
860 1 83 ASN HA 1 84 VAL HB 1.800 . 5.000 4.521 4.075 4.895 . 0 0 "[ . 1 . ]" 1
861 1 83 ASN HA 1 84 VAL QG 1.800 . 5.900 3.881 3.508 4.347 . 0 0 "[ . 1 . ]" 1
862 1 83 ASN HA 1 85 TYR H 1.800 . 5.000 3.953 3.622 4.926 . 0 0 "[ . 1 . ]" 1
863 1 83 ASN HB2 1 84 VAL H 1.800 . 5.000 4.316 3.507 4.727 . 0 0 "[ . 1 . ]" 1
864 1 83 ASN HB3 1 84 VAL H 1.800 . 5.000 3.843 1.999 4.421 . 0 0 "[ . 1 . ]" 1
865 1 84 VAL H 1 84 VAL HB 1.800 . 3.500 2.799 2.152 3.556 0.056 8 0 "[ . 1 . ]" 1
866 1 84 VAL H 1 84 VAL QG 1.800 . 5.900 2.438 1.950 3.429 . 0 0 "[ . 1 . ]" 1
867 1 84 VAL H 1 85 TYR H 1.800 . 3.500 2.810 2.216 3.459 . 0 0 "[ . 1 . ]" 1
868 1 84 VAL H 1 86 SER H 1.800 . 5.000 4.477 2.661 5.022 0.022 16 0 "[ . 1 . ]" 1
869 1 84 VAL HA 1 84 VAL QG 1.800 . 4.900 2.111 2.060 2.165 . 0 0 "[ . 1 . ]" 1
870 1 84 VAL HA 1 85 TYR H 1.800 . 3.500 3.513 3.469 3.534 0.034 13 0 "[ . 1 . ]" 1
871 1 84 VAL HA 1 87 TYR H 1.800 . 3.500 3.396 3.117 3.551 0.051 16 0 "[ . 1 . ]" 1
872 1 84 VAL HA 1 87 TYR HB2 1.800 . 3.500 2.741 2.287 3.328 . 0 0 "[ . 1 . ]" 1
873 1 84 VAL HA 1 87 TYR HB3 1.800 . 2.500 2.364 2.058 2.532 0.032 9 0 "[ . 1 . ]" 1
874 1 84 VAL HA 1 87 TYR QD 1.800 . 5.500 3.327 2.398 3.748 . 0 0 "[ . 1 . ]" 1
875 1 84 VAL HA 1 87 TYR QE 1.800 . 7.000 5.303 4.633 5.665 . 0 0 "[ . 1 . ]" 1
876 1 84 VAL HB 1 84 VAL QG 1.800 . 7.400 1.908 1.867 1.922 . 0 0 "[ . 1 . ]" 1
877 1 84 VAL HB 1 85 TYR H 1.800 . 3.500 3.076 2.860 3.457 . 0 0 "[ . 1 . ]" 1
878 1 84 VAL QG 1 85 TYR H 1.800 . 5.900 3.296 2.437 3.586 . 0 0 "[ . 1 . ]" 1
879 1 84 VAL QG 1 87 TYR H 1.800 . 7.400 4.354 4.112 4.572 . 0 0 "[ . 1 . ]" 1
880 1 84 VAL QG 1 87 TYR QD 1.800 . 7.900 2.970 2.154 3.478 . 0 0 "[ . 1 . ]" 1
881 1 84 VAL QG 1 87 TYR QE 1.800 . 7.900 4.179 3.198 4.703 . 0 0 "[ . 1 . ]" 1
882 1 85 TYR H 1 85 TYR HB2 1.800 . 3.500 2.516 2.370 2.693 . 0 0 "[ . 1 . ]" 1
883 1 85 TYR H 1 85 TYR HB3 1.800 . 3.500 2.620 2.430 2.779 . 0 0 "[ . 1 . ]" 1
884 1 85 TYR H 1 85 TYR QD 1.800 . 7.000 4.217 4.144 4.282 . 0 0 "[ . 1 . ]" 1
885 1 85 TYR H 1 86 SER H 1.800 . 3.500 2.818 2.563 3.071 . 0 0 "[ . 1 . ]" 1
886 1 85 TYR H 1 87 TYR H 1.800 . 5.000 3.862 3.591 4.147 . 0 0 "[ . 1 . ]" 1
887 1 85 TYR HA 1 85 TYR QD 1.800 . 5.500 2.611 2.110 3.098 . 0 0 "[ . 1 . ]" 1
888 1 85 TYR HA 1 89 ASN QD 1.800 . 6.000 4.300 3.462 5.271 . 0 0 "[ . 1 . ]" 1
889 1 85 TYR HB2 1 86 SER H 1.800 . 3.500 3.545 3.523 3.562 0.062 7 0 "[ . 1 . ]" 1
890 1 85 TYR HB3 1 86 SER H 1.800 . 2.500 2.126 2.043 2.251 . 0 0 "[ . 1 . ]" 1
891 1 85 TYR QD 1 86 SER H 1.800 . 5.500 3.191 2.740 3.613 . 0 0 "[ . 1 . ]" 1
892 1 86 SER H 1 86 SER QB 1.800 . 3.500 2.402 2.186 2.709 . 0 0 "[ . 1 . ]" 1
893 1 86 SER H 1 87 TYR H 1.800 . 3.500 2.754 2.659 2.814 . 0 0 "[ . 1 . ]" 1
894 1 86 SER HA 1 87 TYR H 1.800 . 3.500 3.471 3.414 3.510 0.010 16 0 "[ . 1 . ]" 1
895 1 86 SER HA 1 87 TYR QD 1.800 . 7.000 6.534 6.435 6.583 . 0 0 "[ . 1 . ]" 1
896 1 86 SER QB 1 87 TYR H 1.800 . 4.500 3.101 2.795 3.724 . 0 0 "[ . 1 . ]" 1
897 1 86 SER O 1 90 GLY H 2.000 . 2.300 2.044 1.956 2.284 0.044 6 0 "[ . 1 . ]" 1
898 1 86 SER O 1 90 GLY N 2.000 . 3.300 2.892 2.720 3.229 . 0 0 "[ . 1 . ]" 1
899 1 87 TYR H 1 87 TYR HB2 1.800 . 3.500 2.546 2.320 2.988 . 0 0 "[ . 1 . ]" 1
900 1 87 TYR H 1 87 TYR HB3 1.800 . 3.500 2.375 2.051 2.645 . 0 0 "[ . 1 . ]" 1
901 1 87 TYR H 1 87 TYR QD 1.800 . 7.000 4.081 3.886 4.186 . 0 0 "[ . 1 . ]" 1
902 1 87 TYR H 1 88 ALA H 1.800 . 3.500 2.936 2.689 3.198 . 0 0 "[ . 1 . ]" 1
903 1 87 TYR HA 1 87 TYR QD 1.800 . 5.500 2.476 1.987 2.959 . 0 0 "[ . 1 . ]" 1
904 1 87 TYR HB2 1 88 ALA H 1.800 . 5.000 3.568 3.468 3.714 . 0 0 "[ . 1 . ]" 1
905 1 87 TYR HB2 1 88 ALA MB 1.800 . 6.000 4.954 4.887 5.017 . 0 0 "[ . 1 . ]" 1
906 1 87 TYR QD 1 88 ALA MB 1.800 . 8.000 3.313 2.388 4.321 . 0 0 "[ . 1 . ]" 1
907 1 87 TYR QE 1 88 ALA MB 5.000 5.000 45.000 4.361 3.089 5.761 1.911 13 9 "[ * ** * 1* + -* *]" 1
908 1 87 TYR O 1 91 PHE H 2.000 . 2.300 2.102 1.950 2.300 0.050 7 0 "[ . 1 . ]" 1
909 1 87 TYR O 1 91 PHE N 2.000 . 3.300 3.008 2.876 3.264 . 0 0 "[ . 1 . ]" 1
910 1 88 ALA H 1 88 ALA MB 1.800 . 4.500 2.066 1.933 2.164 . 0 0 "[ . 1 . ]" 1
911 1 88 ALA H 1 89 ASN H 1.800 . 3.500 2.941 2.693 3.354 . 0 0 "[ . 1 . ]" 1
912 1 88 ALA HA 1 89 ASN H 1.800 . 3.500 3.535 3.522 3.554 0.054 3 0 "[ . 1 . ]" 1
913 1 88 ALA MB 1 89 ASN H 1.800 . 3.500 2.410 2.108 2.614 . 0 0 "[ . 1 . ]" 1
914 1 89 ASN H 1 89 ASN QD 1.800 . 6.000 2.869 2.184 4.170 . 0 0 "[ . 1 . ]" 1
915 1 89 ASN H 1 90 GLY H 1.800 . 3.500 2.765 2.594 3.059 . 0 0 "[ . 1 . ]" 1
916 1 89 ASN HA 1 89 ASN QD 1.800 . 4.500 3.185 2.153 3.883 . 0 0 "[ . 1 . ]" 1
917 1 89 ASN QB 1 90 GLY H 1.800 . 6.000 2.970 2.402 3.630 . 0 0 "[ . 1 . ]" 1
918 1 90 GLY H 1 91 PHE H 1.800 . 3.500 2.697 2.309 2.945 . 0 0 "[ . 1 . ]" 1
919 1 90 GLY QA 1 91 PHE H 1.800 . 6.000 2.757 2.582 3.011 . 0 0 "[ . 1 . ]" 1
920 1 90 GLY O 1 94 LYS H 2.000 . 2.300 2.097 1.977 2.317 0.023 3 0 "[ . 1 . ]" 1
921 1 90 GLY O 1 94 LYS N 2.000 . 3.300 3.050 2.904 3.278 . 0 0 "[ . 1 . ]" 1
922 1 91 PHE H 1 91 PHE HB2 1.800 . 3.500 2.296 2.145 2.472 . 0 0 "[ . 1 . ]" 1
923 1 91 PHE H 1 91 PHE HB3 1.800 . 3.500 2.911 2.644 3.100 . 0 0 "[ . 1 . ]" 1
924 1 91 PHE H 1 92 SER H 1.800 . 3.500 3.088 2.752 3.350 . 0 0 "[ . 1 . ]" 1
925 1 91 PHE HA 1 91 PHE QD 1.800 . 5.500 2.950 2.592 3.144 . 0 0 "[ . 1 . ]" 1
926 1 91 PHE HB2 1 92 SER H 1.800 . 3.500 3.527 3.483 3.553 0.053 5 0 "[ . 1 . ]" 1
927 1 91 PHE HB3 1 92 SER H 1.800 . 3.500 2.282 2.053 2.617 . 0 0 "[ . 1 . ]" 1
928 1 91 PHE QD 1 92 SER H 1.800 . 7.000 3.491 2.755 4.159 . 0 0 "[ . 1 . ]" 1
929 1 91 PHE O 1 95 CYS H 2.000 . 2.300 2.040 1.939 2.248 0.061 14 0 "[ . 1 . ]" 1
930 1 91 PHE O 1 95 CYS N 2.000 . 3.300 2.892 2.808 3.094 . 0 0 "[ . 1 . ]" 1
931 1 92 SER H 1 93 ASN H 1.800 . 3.500 2.959 2.776 3.188 . 0 0 "[ . 1 . ]" 1
932 1 92 SER HA 1 95 CYS H 1.800 . 3.500 3.443 3.195 3.564 0.064 3 0 "[ . 1 . ]" 1
933 1 92 SER QB 1 95 CYS QB 1.800 . 5.500 4.183 3.920 4.405 . 0 0 "[ . 1 . ]" 1
934 1 92 SER O 1 96 SER H 2.000 . 2.300 2.088 1.951 2.333 0.049 8 0 "[ . 1 . ]" 1
935 1 92 SER O 1 96 SER N 2.000 . 3.300 2.996 2.767 3.275 . 0 0 "[ . 1 . ]" 1
936 1 93 ASN H 1 94 LYS H 1.800 . 3.500 2.820 2.679 2.954 . 0 0 "[ . 1 . ]" 1
937 1 93 ASN QB 1 94 LYS H 1.800 . 6.000 2.702 2.291 3.642 . 0 0 "[ . 1 . ]" 1
938 1 93 ASN O 1 97 SER H 2.000 . 2.300 2.231 1.999 2.358 0.058 3 0 "[ . 1 . ]" 1
939 1 93 ASN O 1 97 SER N 2.000 . 3.300 3.154 2.936 3.300 0.000 12 0 "[ . 1 . ]" 1
940 1 94 LYS H 1 94 LYS QD 1.800 . 4.500 3.694 2.526 4.154 . 0 0 "[ . 1 . ]" 1
941 1 94 LYS H 1 95 CYS H 1.800 . 3.500 2.667 2.477 2.728 . 0 0 "[ . 1 . ]" 1
942 1 94 LYS HA 1 94 LYS QD 1.800 . 4.500 3.069 2.136 4.106 . 0 0 "[ . 1 . ]" 1
943 1 94 LYS HA 1 94 LYS QG 1.800 . 4.500 2.695 1.943 3.515 . 0 0 "[ . 1 . ]" 1
944 1 94 LYS HA 1 95 CYS H 1.800 . 3.500 3.521 3.434 3.545 0.045 5 0 "[ . 1 . ]" 1
945 1 94 LYS QB 1 94 LYS QD 1.800 . 4.500 2.201 1.924 2.585 . 0 0 "[ . 1 . ]" 1
946 1 94 LYS QB 1 94 LYS QG 1.800 . 7.000 2.044 2.010 2.111 . 0 0 "[ . 1 . ]" 1
947 1 94 LYS QB 1 95 CYS H 1.800 . 6.000 3.051 2.589 3.801 . 0 0 "[ . 1 . ]" 1
948 1 94 LYS O 1 98 LEU H 2.000 . 2.300 2.146 1.970 2.338 0.038 9 0 "[ . 1 . ]" 1
949 1 94 LYS O 1 98 LEU N 2.000 . 3.300 2.798 2.670 2.998 . 0 0 "[ . 1 . ]" 1
950 1 95 CYS H 1 96 SER H 1.800 . 3.500 2.684 2.535 2.816 . 0 0 "[ . 1 . ]" 1
951 1 95 CYS HA 1 98 LEU H 1.800 . 3.500 3.395 3.163 3.535 0.035 11 0 "[ . 1 . ]" 1
952 1 95 CYS HA 1 98 LEU QB 1.800 . 4.500 2.471 2.182 3.052 . 0 0 "[ . 1 . ]" 1
953 1 95 CYS HA 1 98 LEU QD 1.800 . 5.900 3.085 2.098 4.364 . 0 0 "[ . 1 . ]" 1
954 1 95 CYS QB 1 96 SER H 1.800 . 6.000 2.682 2.454 2.988 . 0 0 "[ . 1 . ]" 1
955 1 96 SER H 1 96 SER QB 1.800 . 3.500 2.395 2.150 2.772 . 0 0 "[ . 1 . ]" 1
956 1 96 SER H 1 97 SER H 1.800 . 3.500 2.641 2.509 2.793 . 0 0 "[ . 1 . ]" 1
957 1 96 SER HA 1 97 SER H 1.800 . 3.500 3.530 3.517 3.542 0.042 11 0 "[ . 1 . ]" 1
958 1 97 SER H 1 98 LEU H 1.800 . 3.500 2.618 2.499 2.712 . 0 0 "[ . 1 . ]" 1
959 1 97 SER QB 1 98 LEU H 1.800 . 4.500 3.222 2.691 3.954 . 0 0 "[ . 1 . ]" 1
960 1 98 LEU H 1 98 LEU QB 1.800 . 4.500 2.190 2.045 2.478 . 0 0 "[ . 1 . ]" 1
961 1 98 LEU H 1 98 LEU QD 1.800 . 7.400 3.616 3.382 3.836 . 0 0 "[ . 1 . ]" 1
962 1 98 LEU H 1 98 LEU HG 1.800 . 5.000 4.391 3.035 4.781 . 0 0 "[ . 1 . ]" 1
963 1 98 LEU HA 1 98 LEU QD 1.800 . 5.900 2.383 2.042 3.062 . 0 0 "[ . 1 . ]" 1
964 1 98 LEU QB 1 98 LEU QD 1.800 . 8.400 1.923 1.809 2.053 . 0 0 "[ . 1 . ]" 1
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