NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
403870 |
1wpk   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1wpk
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 1171
_Distance_constraint_stats_list.Viol_count 424
_Distance_constraint_stats_list.Viol_total 190.771
_Distance_constraint_stats_list.Viol_max 0.129
_Distance_constraint_stats_list.Viol_rms 0.0054
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0006
_Distance_constraint_stats_list.Viol_average_violations_only 0.0265
_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 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 3 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 4 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 5 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 6 CYS 0.000 0.000 . 0 "[ . 1 . ]"
1 7 LEU 0.704 0.079 17 0 "[ . 1 . ]"
1 8 THR 0.016 0.012 11 0 "[ . 1 . ]"
1 9 ASP 0.001 0.001 6 0 "[ . 1 . ]"
1 10 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 11 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 12 ARG 0.297 0.045 17 0 "[ . 1 . ]"
1 13 TRP 0.024 0.024 11 0 "[ . 1 . ]"
1 14 GLN 0.008 0.008 8 0 "[ . 1 . ]"
1 15 SER 0.376 0.045 17 0 "[ . 1 . ]"
1 16 VAL 0.050 0.022 13 0 "[ . 1 . ]"
1 17 LEU 0.008 0.008 8 0 "[ . 1 . ]"
1 18 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 19 ARG 0.372 0.040 5 0 "[ . 1 . ]"
1 20 ASP 0.028 0.013 15 0 "[ . 1 . ]"
1 21 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 22 ASN 0.099 0.014 15 0 "[ . 1 . ]"
1 23 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 24 ASP 0.099 0.014 15 0 "[ . 1 . ]"
1 25 GLY 0.000 0.000 . 0 "[ . 1 . ]"
1 26 GLU 1.220 0.057 5 0 "[ . 1 . ]"
1 27 PHE 1.804 0.057 5 0 "[ . 1 . ]"
1 28 VAL 0.877 0.111 1 0 "[ . 1 . ]"
1 29 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 30 ALA 0.906 0.120 4 0 "[ . 1 . ]"
1 31 VAL 0.343 0.045 11 0 "[ . 1 . ]"
1 32 ARG 0.399 0.045 11 0 "[ . 1 . ]"
1 33 THR 0.003 0.003 6 0 "[ . 1 . ]"
1 34 THR 0.279 0.030 5 0 "[ . 1 . ]"
1 35 GLY 0.016 0.006 3 0 "[ . 1 . ]"
1 36 ILE 0.296 0.030 5 0 "[ . 1 . ]"
1 37 PHE 0.082 0.026 11 0 "[ . 1 . ]"
1 39 ARG 1.718 0.129 8 0 "[ . 1 . ]"
1 40 PRO 1.409 0.129 8 0 "[ . 1 . ]"
1 41 SER 0.372 0.040 5 0 "[ . 1 . ]"
1 42 CYS 0.335 0.067 8 0 "[ . 1 . ]"
1 43 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 44 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 45 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 46 HIS 0.204 0.058 10 0 "[ . 1 . ]"
1 47 ALA 0.438 0.119 17 0 "[ . 1 . ]"
1 48 LEU 0.049 0.026 13 0 "[ . 1 . ]"
1 49 ARG 0.260 0.036 14 0 "[ . 1 . ]"
1 50 GLU 0.254 0.036 14 0 "[ . 1 . ]"
1 51 ASN 0.125 0.026 13 0 "[ . 1 . ]"
1 52 VAL 0.346 0.119 17 0 "[ . 1 . ]"
1 53 SER 0.906 0.120 4 0 "[ . 1 . ]"
1 54 PHE 0.077 0.016 11 0 "[ . 1 . ]"
1 55 TYR 0.733 0.111 1 0 "[ . 1 . ]"
1 56 ALA 0.542 0.049 1 0 "[ . 1 . ]"
1 57 ASN 0.243 0.034 1 0 "[ . 1 . ]"
1 58 ALA 0.243 0.034 1 0 "[ . 1 . ]"
1 59 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 60 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 61 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 62 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 63 ALA 0.229 0.021 14 0 "[ . 1 . ]"
1 64 ALA 0.229 0.021 14 0 "[ . 1 . ]"
1 65 GLY 0.000 0.000 . 0 "[ . 1 . ]"
1 66 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 67 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 68 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 69 CYS 0.000 0.000 . 0 "[ . 1 . ]"
1 70 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 71 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 72 CYS 0.026 0.026 15 0 "[ . 1 . ]"
1 73 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 74 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 75 GLU 0.207 0.049 16 0 "[ . 1 . ]"
1 76 LYS 0.207 0.049 16 0 "[ . 1 . ]"
1 77 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 78 ASN 0.000 0.000 . 0 "[ . 1 . ]"
1 79 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 80 GLN 0.051 0.051 1 0 "[ . 1 . ]"
1 81 GLN 0.051 0.051 1 0 "[ . 1 . ]"
1 82 HIS 0.000 0.000 . 0 "[ . 1 . ]"
1 84 LEU 0.071 0.026 1 0 "[ . 1 . ]"
1 85 ASP 0.061 0.026 1 0 "[ . 1 . ]"
1 86 LYS 0.179 0.039 4 0 "[ . 1 . ]"
1 87 ILE 0.152 0.069 3 0 "[ . 1 . ]"
1 88 THR 0.019 0.019 4 0 "[ . 1 . ]"
1 89 HIS 0.179 0.039 4 0 "[ . 1 . ]"
1 90 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 91 CYS 0.000 0.000 . 0 "[ . 1 . ]"
1 92 ARG 0.027 0.012 1 0 "[ . 1 . ]"
1 93 LEU 0.157 0.081 3 0 "[ . 1 . ]"
1 94 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 95 GLU 0.029 0.012 1 0 "[ . 1 . ]"
1 96 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 97 GLU 0.094 0.036 15 0 "[ . 1 . ]"
1 98 THR 0.094 0.036 15 0 "[ . 1 . ]"
1 99 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 100 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 101 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 102 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 103 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 104 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 105 LEU 0.418 0.098 14 0 "[ . 1 . ]"
1 106 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 107 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 108 GLN 0.081 0.081 3 0 "[ . 1 . ]"
1 109 VAL 0.292 0.096 14 0 "[ . 1 . ]"
1 110 ALA 0.059 0.053 15 0 "[ . 1 . ]"
1 111 MET 0.350 0.096 14 0 "[ . 1 . ]"
1 112 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 113 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 114 PHE 0.322 0.037 4 0 "[ . 1 . ]"
1 115 HIS 0.322 0.037 4 0 "[ . 1 . ]"
1 116 LEU 0.343 0.098 14 0 "[ . 1 . ]"
1 117 HIS 0.000 0.000 . 0 "[ . 1 . ]"
1 118 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 119 LEU 0.054 0.032 14 0 "[ . 1 . ]"
1 120 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 121 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 122 ALA 0.051 0.010 9 0 "[ . 1 . ]"
1 123 THR 0.069 0.069 3 0 "[ . 1 . ]"
1 124 THR 0.002 0.002 9 0 "[ . 1 . ]"
1 125 GLY 0.051 0.010 9 0 "[ . 1 . ]"
1 126 MET 0.023 0.023 16 0 "[ . 1 . ]"
1 127 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 128 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 129 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 130 ALA 0.023 0.023 16 0 "[ . 1 . ]"
1 131 TRP 0.002 0.002 9 0 "[ . 1 . ]"
1 132 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 133 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 134 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 135 TRP 0.009 0.006 2 0 "[ . 1 . ]"
1 136 ARG 0.009 0.006 2 0 "[ . 1 . ]"
1 137 ALA 0.155 0.045 4 0 "[ . 1 . ]"
1 138 ARG 0.193 0.045 4 0 "[ . 1 . ]"
1 139 ARG 0.043 0.011 12 0 "[ . 1 . ]"
1 140 LEU 0.013 0.006 8 0 "[ . 1 . ]"
1 141 ARG 0.008 0.004 2 0 "[ . 1 . ]"
1 142 GLU 0.068 0.048 13 0 "[ . 1 . ]"
1 143 SER 0.068 0.048 13 0 "[ . 1 . ]"
1 144 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 145 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 146 LYS 0.000 0.000 . 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 LYS HA 1 2 LYS QG 3.500 . 4.500 2.261 2.036 2.848 . 0 0 "[ . 1 . ]" 1
2 1 3 LYS QB 1 4 ALA H 6.000 . 7.000 3.305 2.342 3.996 . 0 0 "[ . 1 . ]" 1
3 1 4 ALA MB 1 5 THR H 6.000 . 6.500 2.899 2.433 3.502 . 0 0 "[ . 1 . ]" 1
4 1 5 THR HA 1 5 THR MG 3.500 . 4.000 2.552 2.064 3.225 . 0 0 "[ . 1 . ]" 1
5 1 5 THR HA 1 6 CYS H 5.000 . 5.000 2.847 2.172 3.586 . 0 0 "[ . 1 . ]" 1
6 1 5 THR HB 1 6 CYS H 6.000 . 6.000 3.318 2.083 4.649 . 0 0 "[ . 1 . ]" 1
7 1 6 CYS HA 1 11 GLN QB 5.000 . 6.000 4.147 1.894 5.221 . 0 0 "[ . 1 . ]" 1
8 1 6 CYS HA 1 11 GLN QG 5.000 . 6.000 4.195 1.966 5.312 . 0 0 "[ . 1 . ]" 1
9 1 6 CYS QB 1 7 LEU H 5.000 . 6.000 2.333 1.899 3.522 . 0 0 "[ . 1 . ]" 1
10 1 6 CYS QB 1 8 THR MG 3.500 . 5.000 3.223 2.531 3.578 . 0 0 "[ . 1 . ]" 1
11 1 6 CYS QB 1 12 ARG QD 3.500 . 5.500 3.629 2.024 4.459 . 0 0 "[ . 1 . ]" 1
12 1 7 LEU H 1 7 LEU QB 3.500 . 4.500 3.109 2.529 3.463 . 0 0 "[ . 1 . ]" 1
13 1 7 LEU H 1 8 THR H 5.000 . 5.000 2.399 1.788 2.917 0.012 11 0 "[ . 1 . ]" 1
14 1 7 LEU H 1 8 THR MG 6.000 . 6.500 3.766 3.260 4.531 . 0 0 "[ . 1 . ]" 1
15 1 7 LEU HA 1 7 LEU HG 3.500 . 3.500 3.439 2.910 3.579 0.079 17 0 "[ . 1 . ]" 1
16 1 7 LEU HA 1 8 THR MG 5.000 . 5.500 4.334 4.101 4.453 . 0 0 "[ . 1 . ]" 1
17 1 7 LEU QB 1 8 THR H 5.000 . 6.000 3.330 3.050 3.770 . 0 0 "[ . 1 . ]" 1
18 1 7 LEU QB 1 8 THR HA 6.000 . 7.000 4.402 4.233 4.497 . 0 0 "[ . 1 . ]" 1
19 1 7 LEU QB 1 8 THR MG 2.800 . 4.300 2.809 2.628 3.095 . 0 0 "[ . 1 . ]" 1
20 1 7 LEU QB 1 11 GLN H 6.000 . 7.000 5.914 5.413 6.292 . 0 0 "[ . 1 . ]" 1
21 1 7 LEU QD 1 8 THR H 6.000 . 8.000 3.266 1.880 3.974 . 0 0 "[ . 1 . ]" 1
22 1 7 LEU QD 1 11 GLN QB 5.000 . 8.000 3.147 2.100 4.113 . 0 0 "[ . 1 . ]" 1
23 1 7 LEU QD 1 11 GLN QE 6.000 . 9.000 3.010 1.815 4.854 . 0 0 "[ . 1 . ]" 1
24 1 7 LEU QD 1 11 GLN QG 5.000 . 8.000 2.933 1.851 4.380 . 0 0 "[ . 1 . ]" 1
25 1 7 LEU QD 1 12 ARG H 6.000 . 8.000 5.306 4.377 5.878 . 0 0 "[ . 1 . ]" 1
26 1 7 LEU QD 1 12 ARG HA 6.000 . 8.000 5.723 5.312 5.927 . 0 0 "[ . 1 . ]" 1
27 1 8 THR H 1 10 ASP QB 6.000 . 7.000 5.612 4.411 6.142 . 0 0 "[ . 1 . ]" 1
28 1 8 THR H 1 11 GLN H 6.000 . 6.000 3.811 2.857 4.273 . 0 0 "[ . 1 . ]" 1
29 1 8 THR H 1 11 GLN QB 5.000 . 6.000 2.676 2.203 3.219 . 0 0 "[ . 1 . ]" 1
30 1 8 THR H 1 11 GLN QG 6.000 . 7.000 4.144 3.714 5.009 . 0 0 "[ . 1 . ]" 1
31 1 8 THR HA 1 8 THR MG 3.500 . 4.000 3.054 2.530 3.181 . 0 0 "[ . 1 . ]" 1
32 1 8 THR HA 1 9 ASP H 5.000 . 5.000 2.454 2.305 2.570 . 0 0 "[ . 1 . ]" 1
33 1 8 THR MG 1 9 ASP H 6.000 . 6.500 3.846 3.667 4.083 . 0 0 "[ . 1 . ]" 1
34 1 8 THR MG 1 10 ASP H 6.000 . 6.500 3.495 3.079 4.165 . 0 0 "[ . 1 . ]" 1
35 1 8 THR MG 1 11 GLN H 6.000 . 6.500 2.569 1.910 4.276 . 0 0 "[ . 1 . ]" 1
36 1 8 THR MG 1 11 GLN QE 6.000 . 7.500 3.965 2.350 5.308 . 0 0 "[ . 1 . ]" 1
37 1 9 ASP H 1 10 ASP H 6.000 . 6.000 2.596 2.494 2.802 . 0 0 "[ . 1 . ]" 1
38 1 9 ASP HA 1 10 ASP H 5.000 . 5.000 3.500 3.464 3.545 . 0 0 "[ . 1 . ]" 1
39 1 9 ASP HA 1 11 GLN H 6.000 . 6.000 4.526 4.400 4.660 . 0 0 "[ . 1 . ]" 1
40 1 9 ASP HA 1 12 ARG H 5.000 . 5.000 3.647 3.491 3.841 . 0 0 "[ . 1 . ]" 1
41 1 9 ASP HA 1 12 ARG QB 5.000 . 6.000 3.201 2.500 4.223 . 0 0 "[ . 1 . ]" 1
42 1 9 ASP HA 1 12 ARG QD 3.500 . 4.500 2.709 1.963 3.917 . 0 0 "[ . 1 . ]" 1
43 1 9 ASP HA 1 12 ARG QG 5.000 . 6.000 3.267 1.954 4.655 . 0 0 "[ . 1 . ]" 1
44 1 9 ASP HA 1 13 TRP H 5.000 . 5.000 4.159 3.399 4.907 . 0 0 "[ . 1 . ]" 1
45 1 9 ASP HA 1 54 PHE QD 5.000 . 7.200 5.086 4.422 6.193 . 0 0 "[ . 1 . ]" 1
46 1 9 ASP HA 1 54 PHE QE 5.000 . 7.200 4.403 3.108 5.549 . 0 0 "[ . 1 . ]" 1
47 1 9 ASP HA 1 54 PHE HZ 6.000 . 6.000 4.930 2.722 6.001 0.001 6 0 "[ . 1 . ]" 1
48 1 9 ASP QB 1 12 ARG H 6.000 . 7.000 5.082 4.904 5.342 . 0 0 "[ . 1 . ]" 1
49 1 10 ASP H 1 10 ASP QB 3.500 . 4.500 2.212 2.111 2.499 . 0 0 "[ . 1 . ]" 1
50 1 10 ASP H 1 11 GLN H 5.000 . 5.000 2.599 2.559 2.682 . 0 0 "[ . 1 . ]" 1
51 1 10 ASP HA 1 11 GLN H 5.000 . 5.000 3.545 3.536 3.556 . 0 0 "[ . 1 . ]" 1
52 1 10 ASP HA 1 13 TRP H 5.000 . 5.000 3.709 3.429 4.159 . 0 0 "[ . 1 . ]" 1
53 1 10 ASP HA 1 13 TRP QB 5.000 . 6.000 3.082 2.741 3.586 . 0 0 "[ . 1 . ]" 1
54 1 10 ASP HA 1 14 GLN H 5.000 . 5.000 4.573 4.346 4.846 . 0 0 "[ . 1 . ]" 1
55 1 10 ASP QB 1 11 GLN H 5.000 . 6.000 2.567 2.498 2.659 . 0 0 "[ . 1 . ]" 1
56 1 11 GLN H 1 11 GLN QB 3.500 . 4.500 2.191 2.052 2.323 . 0 0 "[ . 1 . ]" 1
57 1 11 GLN H 1 11 GLN QG 3.500 . 4.500 3.853 2.633 4.064 . 0 0 "[ . 1 . ]" 1
58 1 11 GLN H 1 12 ARG H 3.500 . 3.500 2.659 2.538 2.828 . 0 0 "[ . 1 . ]" 1
59 1 11 GLN H 1 13 TRP H 6.000 . 6.000 4.419 4.183 4.636 . 0 0 "[ . 1 . ]" 1
60 1 11 GLN HA 1 11 GLN QG 3.500 . 4.500 2.410 2.055 2.990 . 0 0 "[ . 1 . ]" 1
61 1 11 GLN HA 1 13 TRP H 6.000 . 6.000 4.744 4.549 4.963 . 0 0 "[ . 1 . ]" 1
62 1 11 GLN HA 1 14 GLN H 5.000 . 5.000 3.582 3.368 3.802 . 0 0 "[ . 1 . ]" 1
63 1 11 GLN HA 1 14 GLN QB 3.500 . 4.500 2.655 2.128 3.304 . 0 0 "[ . 1 . ]" 1
64 1 11 GLN HA 1 14 GLN QG 3.500 . 4.500 3.214 1.932 4.007 . 0 0 "[ . 1 . ]" 1
65 1 11 GLN QB 1 12 ARG H 5.000 . 6.000 2.657 2.411 2.912 . 0 0 "[ . 1 . ]" 1
66 1 11 GLN QG 1 12 ARG H 5.000 . 6.000 4.097 3.490 4.572 . 0 0 "[ . 1 . ]" 1
67 1 12 ARG H 1 13 TRP H 5.000 . 5.000 2.742 2.559 2.929 . 0 0 "[ . 1 . ]" 1
68 1 12 ARG HA 1 12 ARG HE 6.000 . 6.000 4.563 3.386 5.891 . 0 0 "[ . 1 . ]" 1
69 1 12 ARG HA 1 13 TRP H 5.000 . 5.000 3.560 3.538 3.572 . 0 0 "[ . 1 . ]" 1
70 1 12 ARG HA 1 15 SER H 5.000 . 5.000 3.619 3.561 3.696 . 0 0 "[ . 1 . ]" 1
71 1 12 ARG HA 1 15 SER HA 6.000 . 6.000 6.005 5.831 6.045 0.045 17 0 "[ . 1 . ]" 1
72 1 12 ARG HA 1 15 SER QB 6.000 . 7.000 4.072 3.882 4.223 . 0 0 "[ . 1 . ]" 1
73 1 12 ARG HA 1 27 PHE QD 5.000 . 7.200 4.161 3.570 4.862 . 0 0 "[ . 1 . ]" 1
74 1 12 ARG HA 1 27 PHE QE 5.000 . 7.200 2.547 1.979 3.137 . 0 0 "[ . 1 . ]" 1
75 1 12 ARG HA 1 27 PHE HZ 6.000 . 6.000 2.215 1.980 2.746 . 0 0 "[ . 1 . ]" 1
76 1 12 ARG QB 1 13 TRP H 5.000 . 6.000 2.563 2.217 3.353 . 0 0 "[ . 1 . ]" 1
77 1 12 ARG QG 1 13 TRP H 6.000 . 7.000 3.512 1.958 4.376 . 0 0 "[ . 1 . ]" 1
78 1 13 TRP H 1 13 TRP QB 3.500 . 4.500 2.107 2.048 2.235 . 0 0 "[ . 1 . ]" 1
79 1 13 TRP H 1 14 GLN H 3.500 . 3.500 2.709 2.568 2.791 . 0 0 "[ . 1 . ]" 1
80 1 13 TRP H 1 15 SER H 6.000 . 6.000 4.722 4.332 4.819 . 0 0 "[ . 1 . ]" 1
81 1 13 TRP H 1 16 VAL H 6.000 . 6.000 5.079 4.894 5.257 . 0 0 "[ . 1 . ]" 1
82 1 13 TRP HA 1 13 TRP HE3 3.500 . 3.500 2.045 1.947 2.249 . 0 0 "[ . 1 . ]" 1
83 1 13 TRP HA 1 13 TRP HZ3 6.000 . 6.000 4.245 4.180 4.397 . 0 0 "[ . 1 . ]" 1
84 1 13 TRP HA 1 14 GLN H 5.000 . 5.000 3.462 3.431 3.508 . 0 0 "[ . 1 . ]" 1
85 1 13 TRP HA 1 16 VAL H 5.000 . 5.000 3.478 3.214 3.781 . 0 0 "[ . 1 . ]" 1
86 1 13 TRP HA 1 16 VAL HB 5.000 . 5.000 3.066 2.540 4.467 . 0 0 "[ . 1 . ]" 1
87 1 13 TRP HA 1 16 VAL QG 6.000 . 8.000 2.079 1.879 2.554 . 0 0 "[ . 1 . ]" 1
88 1 13 TRP QB 1 14 GLN H 5.000 . 6.000 2.955 2.788 3.040 . 0 0 "[ . 1 . ]" 1
89 1 13 TRP QB 1 15 SER H 6.000 . 7.000 5.143 4.784 5.255 . 0 0 "[ . 1 . ]" 1
90 1 13 TRP HD1 1 17 LEU QD 6.000 . 8.000 2.824 2.033 4.227 . 0 0 "[ . 1 . ]" 1
91 1 13 TRP HD1 1 49 ARG QD 5.000 . 6.000 4.704 2.740 5.339 . 0 0 "[ . 1 . ]" 1
92 1 13 TRP HE1 1 17 LEU QD 5.000 . 7.000 3.194 2.718 4.755 . 0 0 "[ . 1 . ]" 1
93 1 13 TRP HE1 1 49 ARG QB 3.500 . 4.500 3.683 3.567 3.977 . 0 0 "[ . 1 . ]" 1
94 1 13 TRP HE1 1 49 ARG QD 5.000 . 6.000 4.131 2.447 4.947 . 0 0 "[ . 1 . ]" 1
95 1 13 TRP HE3 1 16 VAL HB 6.000 . 6.000 3.893 1.955 5.052 . 0 0 "[ . 1 . ]" 1
96 1 13 TRP HE3 1 16 VAL QG 6.000 . 8.000 2.639 2.403 2.890 . 0 0 "[ . 1 . ]" 1
97 1 13 TRP HE3 1 52 VAL QG 6.000 . 8.000 4.028 3.764 4.736 . 0 0 "[ . 1 . ]" 1
98 1 13 TRP HH2 1 16 VAL QG 6.000 . 8.000 3.911 3.484 4.221 . 0 0 "[ . 1 . ]" 1
99 1 13 TRP HH2 1 17 LEU QD 6.000 . 8.000 5.304 4.311 5.904 . 0 0 "[ . 1 . ]" 1
100 1 13 TRP HH2 1 47 ALA MB 6.000 . 6.500 3.874 3.675 3.983 . 0 0 "[ . 1 . ]" 1
101 1 13 TRP HH2 1 48 LEU HA 6.000 . 6.000 5.063 4.669 5.548 . 0 0 "[ . 1 . ]" 1
102 1 13 TRP HH2 1 49 ARG HA 6.000 . 6.000 4.092 3.612 4.600 . 0 0 "[ . 1 . ]" 1
103 1 13 TRP HH2 1 52 VAL QG 6.000 . 8.000 2.086 1.776 2.450 0.024 11 0 "[ . 1 . ]" 1
104 1 13 TRP HZ2 1 17 LEU QD 6.000 . 8.000 4.275 3.658 4.857 . 0 0 "[ . 1 . ]" 1
105 1 13 TRP HZ2 1 47 ALA MB 6.000 . 6.500 5.204 4.867 5.322 . 0 0 "[ . 1 . ]" 1
106 1 13 TRP HZ2 1 48 LEU HA 6.000 . 6.000 4.128 3.660 4.796 . 0 0 "[ . 1 . ]" 1
107 1 13 TRP HZ2 1 49 ARG HA 6.000 . 6.000 3.441 2.409 4.031 . 0 0 "[ . 1 . ]" 1
108 1 13 TRP HZ3 1 16 VAL QG 6.000 . 8.000 2.969 2.335 3.289 . 0 0 "[ . 1 . ]" 1
109 1 13 TRP HZ3 1 47 ALA MB 6.000 . 6.500 5.264 5.201 5.310 . 0 0 "[ . 1 . ]" 1
110 1 13 TRP HZ3 1 52 VAL HB 6.000 . 6.000 4.518 3.152 5.455 . 0 0 "[ . 1 . ]" 1
111 1 13 TRP HZ3 1 52 VAL QG 6.000 . 8.000 2.442 2.087 3.468 . 0 0 "[ . 1 . ]" 1
112 1 14 GLN H 1 14 GLN QB 2.800 . 3.800 2.144 2.034 2.561 . 0 0 "[ . 1 . ]" 1
113 1 14 GLN H 1 14 GLN QG 3.500 . 4.500 3.181 1.966 4.057 . 0 0 "[ . 1 . ]" 1
114 1 14 GLN H 1 17 LEU H 6.000 . 6.000 4.733 4.499 4.909 . 0 0 "[ . 1 . ]" 1
115 1 14 GLN H 1 17 LEU QD 6.000 . 8.000 4.588 3.933 5.556 . 0 0 "[ . 1 . ]" 1
116 1 14 GLN HA 1 14 GLN QG 3.500 . 4.500 2.276 2.003 2.760 . 0 0 "[ . 1 . ]" 1
117 1 14 GLN HA 1 15 SER H 5.000 . 5.000 3.572 3.522 3.583 . 0 0 "[ . 1 . ]" 1
118 1 14 GLN HA 1 17 LEU HA 6.000 . 6.000 5.676 5.241 5.926 . 0 0 "[ . 1 . ]" 1
119 1 14 GLN HA 1 17 LEU QB 3.500 . 4.500 2.909 2.307 3.228 . 0 0 "[ . 1 . ]" 1
120 1 14 GLN HA 1 17 LEU QD 6.000 . 8.000 3.441 2.199 4.413 . 0 0 "[ . 1 . ]" 1
121 1 14 GLN HA 1 17 LEU HG 5.000 . 5.000 4.415 3.802 5.008 0.008 8 0 "[ . 1 . ]" 1
122 1 14 GLN HA 1 18 ALA H 5.000 . 5.000 4.040 3.678 4.386 . 0 0 "[ . 1 . ]" 1
123 1 14 GLN QB 1 15 SER H 3.500 . 4.500 2.457 2.247 2.874 . 0 0 "[ . 1 . ]" 1
124 1 14 GLN QG 1 15 SER H 5.000 . 6.000 4.223 3.744 4.606 . 0 0 "[ . 1 . ]" 1
125 1 14 GLN QG 1 17 LEU QD 6.000 . 9.000 4.436 3.225 5.467 . 0 0 "[ . 1 . ]" 1
126 1 15 SER H 1 16 VAL H 3.500 . 3.500 2.690 2.519 2.840 . 0 0 "[ . 1 . ]" 1
127 1 15 SER H 1 16 VAL HB 6.000 . 6.000 5.238 4.947 6.022 0.022 13 0 "[ . 1 . ]" 1
128 1 15 SER H 1 16 VAL QG 6.000 . 8.000 3.805 3.399 3.963 . 0 0 "[ . 1 . ]" 1
129 1 15 SER HA 1 16 VAL H 5.000 . 5.000 3.510 3.491 3.548 . 0 0 "[ . 1 . ]" 1
130 1 15 SER HA 1 17 LEU H 5.000 . 5.000 4.552 4.288 4.861 . 0 0 "[ . 1 . ]" 1
131 1 15 SER HA 1 18 ALA H 5.000 . 5.000 3.459 3.286 3.748 . 0 0 "[ . 1 . ]" 1
132 1 15 SER HA 1 18 ALA MB 3.500 . 4.000 2.487 2.095 2.969 . 0 0 "[ . 1 . ]" 1
133 1 15 SER HA 1 20 ASP QB 5.000 . 6.000 3.680 3.380 3.975 . 0 0 "[ . 1 . ]" 1
134 1 15 SER HA 1 27 PHE QE 5.000 . 7.200 5.008 4.485 5.679 . 0 0 "[ . 1 . ]" 1
135 1 15 SER HA 1 27 PHE HZ 5.000 . 5.000 4.620 4.306 5.039 0.039 3 0 "[ . 1 . ]" 1
136 1 15 SER QB 1 20 ASP QB 3.500 . 5.500 3.571 3.053 4.076 . 0 0 "[ . 1 . ]" 1
137 1 15 SER QB 1 23 ALA MB 2.800 . 4.300 3.067 2.937 3.182 . 0 0 "[ . 1 . ]" 1
138 1 15 SER QB 1 27 PHE HZ 5.000 . 6.000 2.328 1.960 3.412 . 0 0 "[ . 1 . ]" 1
139 1 16 VAL H 1 17 LEU H 3.500 . 3.500 2.651 2.569 2.758 . 0 0 "[ . 1 . ]" 1
140 1 16 VAL H 1 17 LEU QB 6.000 . 7.000 4.505 4.274 4.803 . 0 0 "[ . 1 . ]" 1
141 1 16 VAL H 1 18 ALA H 5.000 . 5.000 3.893 3.757 4.261 . 0 0 "[ . 1 . ]" 1
142 1 16 VAL HA 1 17 LEU H 5.000 . 5.000 3.547 3.504 3.561 . 0 0 "[ . 1 . ]" 1
143 1 16 VAL HA 1 19 ARG H 5.000 . 5.000 3.572 3.236 3.817 . 0 0 "[ . 1 . ]" 1
144 1 16 VAL HA 1 19 ARG HA 5.000 . 5.000 3.975 3.258 4.313 . 0 0 "[ . 1 . ]" 1
145 1 16 VAL HA 1 20 ASP H 5.000 . 5.000 4.928 4.570 5.013 0.013 15 0 "[ . 1 . ]" 1
146 1 16 VAL HB 1 17 LEU H 5.000 . 5.000 2.608 2.374 3.950 . 0 0 "[ . 1 . ]" 1
147 1 16 VAL HB 1 18 ALA H 6.000 . 6.000 4.867 4.687 5.805 . 0 0 "[ . 1 . ]" 1
148 1 16 VAL QG 1 17 LEU H 6.000 . 8.000 3.063 2.120 3.260 . 0 0 "[ . 1 . ]" 1
149 1 16 VAL QG 1 17 LEU HA 6.000 . 8.000 3.710 3.021 3.943 . 0 0 "[ . 1 . ]" 1
150 1 16 VAL QG 1 17 LEU QD 6.000 . 10.000 3.142 2.289 3.748 . 0 0 "[ . 1 . ]" 1
151 1 16 VAL QG 1 29 PHE QB 5.000 . 8.000 3.584 3.178 4.137 . 0 0 "[ . 1 . ]" 1
152 1 16 VAL QG 1 29 PHE QD 6.000 . 10.200 2.853 2.528 3.283 . 0 0 "[ . 1 . ]" 1
153 1 16 VAL QG 1 29 PHE QE 6.000 . 10.200 1.950 1.866 2.200 . 0 0 "[ . 1 . ]" 1
154 1 16 VAL QG 1 40 PRO HA 6.000 . 8.000 5.811 5.597 5.920 . 0 0 "[ . 1 . ]" 1
155 1 16 VAL QG 1 52 VAL QG 6.000 . 10.000 3.799 3.454 4.224 . 0 0 "[ . 1 . ]" 1
156 1 17 LEU H 1 17 LEU QB 3.500 . 4.500 2.246 2.037 2.534 . 0 0 "[ . 1 . ]" 1
157 1 17 LEU H 1 17 LEU HG 5.000 . 5.000 3.310 2.130 4.310 . 0 0 "[ . 1 . ]" 1
158 1 17 LEU H 1 18 ALA H 3.500 . 3.500 2.534 2.481 2.642 . 0 0 "[ . 1 . ]" 1
159 1 17 LEU HA 1 18 ALA H 5.000 . 5.000 3.500 3.477 3.542 . 0 0 "[ . 1 . ]" 1
160 1 17 LEU HA 1 19 ARG H 5.000 . 5.000 3.930 3.642 4.198 . 0 0 "[ . 1 . ]" 1
161 1 17 LEU QB 1 18 ALA H 5.000 . 6.000 2.767 2.551 2.902 . 0 0 "[ . 1 . ]" 1
162 1 17 LEU QD 1 18 ALA H 6.000 . 8.000 4.004 3.841 4.184 . 0 0 "[ . 1 . ]" 1
163 1 17 LEU HG 1 18 ALA H 6.000 . 6.000 4.882 4.247 5.367 . 0 0 "[ . 1 . ]" 1
164 1 18 ALA H 1 19 ARG H 3.500 . 3.500 2.528 2.422 2.629 . 0 0 "[ . 1 . ]" 1
165 1 18 ALA H 1 20 ASP H 5.000 . 5.000 4.251 4.081 4.483 . 0 0 "[ . 1 . ]" 1
166 1 18 ALA MB 1 19 ARG H 6.000 . 6.500 2.945 2.750 3.230 . 0 0 "[ . 1 . ]" 1
167 1 18 ALA MB 1 20 ASP H 6.000 . 6.500 2.647 2.450 2.962 . 0 0 "[ . 1 . ]" 1
168 1 18 ALA MB 1 20 ASP HA 5.000 . 5.500 4.039 3.882 4.187 . 0 0 "[ . 1 . ]" 1
169 1 18 ALA MB 1 20 ASP QB 2.800 . 4.300 2.709 2.511 2.854 . 0 0 "[ . 1 . ]" 1
170 1 19 ARG H 1 20 ASP H 3.500 . 3.500 2.704 2.558 2.908 . 0 0 "[ . 1 . ]" 1
171 1 19 ARG H 1 20 ASP QB 6.000 . 7.000 4.416 4.290 4.603 . 0 0 "[ . 1 . ]" 1
172 1 19 ARG HA 1 20 ASP H 3.500 . 3.500 2.913 2.800 3.016 . 0 0 "[ . 1 . ]" 1
173 1 19 ARG HA 1 41 SER HA 5.000 . 5.000 5.002 4.787 5.040 0.040 5 0 "[ . 1 . ]" 1
174 1 20 ASP H 1 20 ASP QB 3.500 . 4.500 2.197 2.100 2.256 . 0 0 "[ . 1 . ]" 1
175 1 20 ASP H 1 21 PRO QD 6.000 . 7.000 4.093 4.000 4.162 . 0 0 "[ . 1 . ]" 1
176 1 20 ASP H 1 22 ASN H 6.000 . 6.000 5.394 5.310 5.483 . 0 0 "[ . 1 . ]" 1
177 1 20 ASP HA 1 21 PRO QD 2.800 . 3.800 1.915 1.898 1.938 . 0 0 "[ . 1 . ]" 1
178 1 20 ASP HA 1 21 PRO QG 5.000 . 6.000 3.824 3.808 3.847 . 0 0 "[ . 1 . ]" 1
179 1 20 ASP QB 1 22 ASN H 6.000 . 7.000 3.565 3.292 3.772 . 0 0 "[ . 1 . ]" 1
180 1 20 ASP QB 1 23 ALA MB 2.800 . 4.300 2.557 2.282 2.776 . 0 0 "[ . 1 . ]" 1
181 1 21 PRO HA 1 41 SER HA 6.000 . 6.000 5.269 5.058 5.400 . 0 0 "[ . 1 . ]" 1
182 1 21 PRO HA 1 41 SER QB 3.500 . 4.500 2.896 2.732 3.037 . 0 0 "[ . 1 . ]" 1
183 1 21 PRO QB 1 21 PRO QD 2.800 . 4.800 2.754 2.744 2.764 . 0 0 "[ . 1 . ]" 1
184 1 21 PRO QB 1 22 ASN H 3.500 . 4.500 3.435 3.031 3.577 . 0 0 "[ . 1 . ]" 1
185 1 21 PRO QB 1 23 ALA H 5.000 . 6.000 4.620 4.547 4.721 . 0 0 "[ . 1 . ]" 1
186 1 21 PRO QB 1 41 SER QB 3.500 . 5.500 4.409 4.357 4.469 . 0 0 "[ . 1 . ]" 1
187 1 21 PRO QD 1 22 ASN H 3.500 . 4.500 2.780 2.613 2.861 . 0 0 "[ . 1 . ]" 1
188 1 22 ASN H 1 22 ASN QB 3.500 . 4.500 2.279 2.187 2.557 . 0 0 "[ . 1 . ]" 1
189 1 22 ASN H 1 23 ALA H 3.500 . 3.500 2.860 2.783 2.958 . 0 0 "[ . 1 . ]" 1
190 1 22 ASN H 1 23 ALA MB 6.000 . 6.500 3.961 3.881 4.075 . 0 0 "[ . 1 . ]" 1
191 1 22 ASN H 1 24 ASP H 5.000 . 5.000 4.999 4.955 5.014 0.014 15 0 "[ . 1 . ]" 1
192 1 22 ASN HA 1 23 ALA H 3.500 . 3.500 2.909 2.851 2.975 . 0 0 "[ . 1 . ]" 1
193 1 22 ASN QB 1 23 ALA H 5.000 . 6.000 3.801 3.749 3.844 . 0 0 "[ . 1 . ]" 1
194 1 23 ALA H 1 24 ASP H 3.500 . 3.500 2.800 2.751 2.843 . 0 0 "[ . 1 . ]" 1
195 1 23 ALA H 1 24 ASP QB 5.000 . 6.000 4.812 4.358 5.115 . 0 0 "[ . 1 . ]" 1
196 1 23 ALA HA 1 26 GLU QG 3.500 . 4.500 3.025 2.363 3.720 . 0 0 "[ . 1 . ]" 1
197 1 23 ALA MB 1 24 ASP H 6.000 . 6.500 3.615 3.591 3.636 . 0 0 "[ . 1 . ]" 1
198 1 23 ALA MB 1 26 GLU QB 2.800 . 4.300 1.943 1.811 2.102 . 0 0 "[ . 1 . ]" 1
199 1 23 ALA MB 1 40 PRO QB 2.800 . 4.300 2.926 2.855 2.976 . 0 0 "[ . 1 . ]" 1
200 1 24 ASP H 1 24 ASP QB 3.500 . 4.500 2.486 2.104 2.642 . 0 0 "[ . 1 . ]" 1
201 1 24 ASP H 1 25 GLY H 6.000 . 6.000 4.088 2.878 4.195 . 0 0 "[ . 1 . ]" 1
202 1 24 ASP HA 1 40 PRO QD 3.500 . 4.500 3.865 3.841 3.892 . 0 0 "[ . 1 . ]" 1
203 1 24 ASP QB 1 25 GLY H 6.000 . 7.000 3.742 3.558 3.946 . 0 0 "[ . 1 . ]" 1
204 1 24 ASP QB 1 26 GLU H 6.000 . 7.000 5.013 4.953 5.114 . 0 0 "[ . 1 . ]" 1
205 1 25 GLY H 1 26 GLU H 5.000 . 5.000 2.021 1.944 2.675 . 0 0 "[ . 1 . ]" 1
206 1 25 GLY H 1 27 PHE H 6.000 . 6.000 4.555 4.399 5.766 . 0 0 "[ . 1 . ]" 1
207 1 25 GLY QA 1 26 GLU H 5.000 . 6.000 2.921 2.797 2.933 . 0 0 "[ . 1 . ]" 1
208 1 25 GLY QA 1 27 PHE H 6.000 . 7.000 5.026 4.860 5.120 . 0 0 "[ . 1 . ]" 1
209 1 26 GLU H 1 26 GLU QB 3.500 . 4.500 2.116 2.055 2.200 . 0 0 "[ . 1 . ]" 1
210 1 26 GLU H 1 27 PHE H 3.500 . 3.500 3.244 3.111 3.312 . 0 0 "[ . 1 . ]" 1
211 1 26 GLU H 1 27 PHE HA 5.000 . 5.000 5.019 4.813 5.057 0.057 5 0 "[ . 1 . ]" 1
212 1 26 GLU HA 1 26 GLU QG 3.500 . 4.500 2.538 2.352 2.771 . 0 0 "[ . 1 . ]" 1
213 1 26 GLU HA 1 27 PHE H 3.500 . 3.500 3.542 3.533 3.557 0.057 6 0 "[ . 1 . ]" 1
214 1 26 GLU QB 1 27 PHE H 3.500 . 4.500 1.942 1.865 2.019 . 0 0 "[ . 1 . ]" 1
215 1 26 GLU QB 1 27 PHE QD 3.500 . 6.700 2.978 2.671 3.290 . 0 0 "[ . 1 . ]" 1
216 1 26 GLU QG 1 27 PHE QD 3.500 . 6.700 4.059 3.191 4.705 . 0 0 "[ . 1 . ]" 1
217 1 27 PHE H 1 28 VAL H 5.000 . 5.000 4.200 4.147 4.277 . 0 0 "[ . 1 . ]" 1
218 1 27 PHE H 1 28 VAL QG 6.000 . 8.000 4.326 4.206 4.522 . 0 0 "[ . 1 . ]" 1
219 1 27 PHE HA 1 28 VAL QG 6.000 . 8.000 3.432 3.303 3.733 . 0 0 "[ . 1 . ]" 1
220 1 27 PHE HA 1 56 ALA H 5.000 . 5.000 5.031 5.020 5.049 0.049 1 0 "[ . 1 . ]" 1
221 1 27 PHE HA 1 56 ALA HA 5.000 . 5.000 2.942 2.748 3.160 . 0 0 "[ . 1 . ]" 1
222 1 27 PHE HA 1 56 ALA MB 5.000 . 5.500 4.450 4.314 4.575 . 0 0 "[ . 1 . ]" 1
223 1 27 PHE HA 1 57 ASN HA 6.000 . 6.000 4.748 4.079 5.292 . 0 0 "[ . 1 . ]" 1
224 1 27 PHE QB 1 28 VAL H 3.500 . 4.500 2.893 2.712 2.993 . 0 0 "[ . 1 . ]" 1
225 1 27 PHE QB 1 55 TYR H 6.000 . 7.000 3.040 2.750 3.429 . 0 0 "[ . 1 . ]" 1
226 1 27 PHE QB 1 56 ALA HA 5.000 . 6.000 3.213 2.696 3.644 . 0 0 "[ . 1 . ]" 1
227 1 27 PHE QD 1 28 VAL H 5.000 . 7.200 4.476 4.223 4.692 . 0 0 "[ . 1 . ]" 1
228 1 27 PHE QD 1 28 VAL HA 5.000 . 7.200 4.687 4.478 4.994 . 0 0 "[ . 1 . ]" 1
229 1 28 VAL H 1 29 PHE QB 6.000 . 7.000 6.288 6.217 6.329 . 0 0 "[ . 1 . ]" 1
230 1 28 VAL H 1 54 PHE HA 5.000 . 5.000 4.962 4.833 5.016 0.016 11 0 "[ . 1 . ]" 1
231 1 28 VAL H 1 54 PHE QB 6.000 . 7.000 5.313 5.117 5.668 . 0 0 "[ . 1 . ]" 1
232 1 28 VAL H 1 55 TYR H 5.000 . 5.000 3.087 2.902 3.238 . 0 0 "[ . 1 . ]" 1
233 1 28 VAL H 1 55 TYR HA 6.000 . 6.000 4.564 4.305 4.803 . 0 0 "[ . 1 . ]" 1
234 1 28 VAL H 1 55 TYR QB 6.000 . 7.000 3.235 3.027 3.469 . 0 0 "[ . 1 . ]" 1
235 1 28 VAL H 1 56 ALA HA 5.000 . 5.000 3.749 3.243 4.336 . 0 0 "[ . 1 . ]" 1
236 1 28 VAL H 1 56 ALA MB 6.000 . 6.500 4.914 4.597 5.288 . 0 0 "[ . 1 . ]" 1
237 1 28 VAL HA 1 29 PHE H 3.500 . 3.500 2.175 2.156 2.205 . 0 0 "[ . 1 . ]" 1
238 1 28 VAL HA 1 29 PHE QD 6.000 . 8.200 3.844 3.136 4.348 . 0 0 "[ . 1 . ]" 1
239 1 28 VAL HA 1 37 PHE QD 6.000 . 8.200 4.644 4.223 5.100 . 0 0 "[ . 1 . ]" 1
240 1 28 VAL HA 1 39 ARG HA 5.000 . 5.000 4.084 4.013 4.146 . 0 0 "[ . 1 . ]" 1
241 1 28 VAL HA 1 40 PRO QD 5.000 . 6.000 4.422 4.332 4.529 . 0 0 "[ . 1 . ]" 1
242 1 28 VAL HA 1 55 TYR H 5.000 . 5.000 4.728 4.609 4.980 . 0 0 "[ . 1 . ]" 1
243 1 28 VAL HB 1 29 PHE H 5.000 . 5.000 3.581 2.979 4.222 . 0 0 "[ . 1 . ]" 1
244 1 28 VAL HB 1 37 PHE QD 6.000 . 8.200 3.249 1.962 4.620 . 0 0 "[ . 1 . ]" 1
245 1 28 VAL HB 1 37 PHE QE 6.000 . 8.200 5.062 3.954 6.073 . 0 0 "[ . 1 . ]" 1
246 1 28 VAL HB 1 58 ALA HA 5.000 . 5.000 4.237 3.595 4.484 . 0 0 "[ . 1 . ]" 1
247 1 28 VAL QG 1 29 PHE H 6.000 . 8.000 2.933 2.160 3.507 . 0 0 "[ . 1 . ]" 1
248 1 28 VAL QG 1 29 PHE HA 6.000 . 8.000 4.011 3.717 4.282 . 0 0 "[ . 1 . ]" 1
249 1 28 VAL QG 1 37 PHE HA 6.000 . 8.000 3.787 3.108 4.449 . 0 0 "[ . 1 . ]" 1
250 1 28 VAL QG 1 37 PHE QB 5.000 . 8.000 2.222 1.774 2.770 0.026 11 0 "[ . 1 . ]" 1
251 1 28 VAL QG 1 37 PHE QD 6.000 . 10.200 2.056 1.823 2.474 . 0 0 "[ . 1 . ]" 1
252 1 28 VAL QG 1 37 PHE QE 6.000 . 10.200 3.122 2.681 3.583 . 0 0 "[ . 1 . ]" 1
253 1 28 VAL QG 1 39 ARG HA 6.000 . 8.000 2.354 1.904 2.795 . 0 0 "[ . 1 . ]" 1
254 1 28 VAL QG 1 40 PRO QD 5.000 . 8.000 2.525 2.267 2.831 . 0 0 "[ . 1 . ]" 1
255 1 28 VAL QG 1 55 TYR H 6.000 . 8.000 3.339 2.509 4.187 . 0 0 "[ . 1 . ]" 1
256 1 28 VAL QG 1 55 TYR HA 6.000 . 8.000 4.120 3.583 4.654 . 0 0 "[ . 1 . ]" 1
257 1 28 VAL QG 1 55 TYR QB 3.500 . 6.500 2.104 1.689 2.625 0.111 1 0 "[ . 1 . ]" 1
258 1 28 VAL QG 1 55 TYR QE 6.000 . 10.200 4.887 4.533 5.075 . 0 0 "[ . 1 . ]" 1
259 1 28 VAL QG 1 56 ALA H 6.000 . 8.000 4.078 3.916 4.331 . 0 0 "[ . 1 . ]" 1
260 1 28 VAL QG 1 57 ASN H 6.000 . 8.000 3.303 3.110 3.614 . 0 0 "[ . 1 . ]" 1
261 1 28 VAL QG 1 57 ASN HA 6.000 . 8.000 2.637 2.137 3.153 . 0 0 "[ . 1 . ]" 1
262 1 28 VAL QG 1 58 ALA H 6.000 . 8.000 3.108 2.574 3.330 . 0 0 "[ . 1 . ]" 1
263 1 28 VAL QG 1 58 ALA HA 6.000 . 8.000 2.458 2.100 2.751 . 0 0 "[ . 1 . ]" 1
264 1 28 VAL QG 1 58 ALA MB 6.000 . 8.500 2.805 2.278 3.187 . 0 0 "[ . 1 . ]" 1
265 1 28 VAL QG 1 59 SER H 6.000 . 8.000 4.592 4.119 4.855 . 0 0 "[ . 1 . ]" 1
266 1 28 VAL QG 1 60 GLU H 6.000 . 8.000 4.522 4.083 4.788 . 0 0 "[ . 1 . ]" 1
267 1 28 VAL QG 1 61 ALA H 6.000 . 8.000 3.517 3.104 3.902 . 0 0 "[ . 1 . ]" 1
268 1 28 VAL QG 1 61 ALA HA 6.000 . 8.000 4.464 4.061 4.866 . 0 0 "[ . 1 . ]" 1
269 1 28 VAL QG 1 61 ALA MB 6.000 . 8.500 2.129 1.884 2.454 . 0 0 "[ . 1 . ]" 1
270 1 29 PHE H 1 29 PHE QD 5.000 . 7.200 2.827 1.935 3.227 . 0 0 "[ . 1 . ]" 1
271 1 29 PHE H 1 30 ALA H 6.000 . 6.000 4.373 4.289 4.424 . 0 0 "[ . 1 . ]" 1
272 1 29 PHE H 1 37 PHE HA 5.000 . 5.000 4.417 4.188 4.532 . 0 0 "[ . 1 . ]" 1
273 1 29 PHE H 1 37 PHE QB 6.000 . 7.000 4.299 4.157 4.438 . 0 0 "[ . 1 . ]" 1
274 1 29 PHE HA 1 30 ALA H 3.500 . 3.500 2.140 2.123 2.153 . 0 0 "[ . 1 . ]" 1
275 1 29 PHE HA 1 30 ALA MB 5.000 . 5.500 3.947 3.913 4.035 . 0 0 "[ . 1 . ]" 1
276 1 29 PHE HA 1 52 VAL QG 6.000 . 8.000 3.426 3.020 5.227 . 0 0 "[ . 1 . ]" 1
277 1 29 PHE HA 1 53 SER H 5.000 . 5.000 4.390 4.204 4.782 . 0 0 "[ . 1 . ]" 1
278 1 29 PHE HA 1 54 PHE HA 5.000 . 5.000 2.931 2.642 3.406 . 0 0 "[ . 1 . ]" 1
279 1 29 PHE HA 1 54 PHE QD 5.000 . 7.200 4.147 3.187 6.375 . 0 0 "[ . 1 . ]" 1
280 1 29 PHE HA 1 55 TYR H 5.000 . 5.000 3.822 3.536 4.071 . 0 0 "[ . 1 . ]" 1
281 1 29 PHE QB 1 30 ALA H 5.000 . 6.000 3.388 3.323 3.447 . 0 0 "[ . 1 . ]" 1
282 1 29 PHE QB 1 52 VAL QG 3.500 . 6.500 2.456 1.992 3.805 . 0 0 "[ . 1 . ]" 1
283 1 29 PHE QB 1 53 SER H 6.000 . 7.000 4.371 3.981 4.964 . 0 0 "[ . 1 . ]" 1
284 1 29 PHE QB 1 54 PHE HA 5.000 . 6.000 4.605 4.279 5.089 . 0 0 "[ . 1 . ]" 1
285 1 29 PHE QB 1 55 TYR H 6.000 . 7.000 5.593 5.340 5.865 . 0 0 "[ . 1 . ]" 1
286 1 29 PHE QD 1 31 VAL QG 6.000 . 10.200 4.848 4.631 5.157 . 0 0 "[ . 1 . ]" 1
287 1 29 PHE QD 1 40 PRO HA 5.000 . 7.200 5.427 4.702 5.820 . 0 0 "[ . 1 . ]" 1
288 1 29 PHE QD 1 52 VAL QG 6.000 . 10.200 3.635 2.389 4.946 . 0 0 "[ . 1 . ]" 1
289 1 29 PHE QE 1 31 VAL QG 6.000 . 10.200 6.481 6.282 6.710 . 0 0 "[ . 1 . ]" 1
290 1 29 PHE QE 1 40 PRO HA 3.500 . 5.700 4.698 3.737 5.257 . 0 0 "[ . 1 . ]" 1
291 1 29 PHE QE 1 42 CYS H 6.000 . 8.200 4.793 4.371 5.510 . 0 0 "[ . 1 . ]" 1
292 1 29 PHE QE 1 42 CYS QB 5.000 . 8.200 2.478 1.975 3.828 . 0 0 "[ . 1 . ]" 1
293 1 29 PHE QE 1 52 VAL QG 6.000 . 10.200 4.989 3.936 5.936 . 0 0 "[ . 1 . ]" 1
294 1 30 ALA H 1 31 VAL H 6.000 . 6.000 4.486 4.444 4.516 . 0 0 "[ . 1 . ]" 1
295 1 30 ALA H 1 31 VAL QG 6.000 . 8.000 4.546 4.467 4.702 . 0 0 "[ . 1 . ]" 1
296 1 30 ALA H 1 52 VAL QG 6.000 . 8.000 3.390 2.712 5.280 . 0 0 "[ . 1 . ]" 1
297 1 30 ALA H 1 53 SER H 3.500 . 3.500 3.010 2.672 3.248 . 0 0 "[ . 1 . ]" 1
298 1 30 ALA H 1 53 SER HA 5.000 . 5.000 4.457 4.283 4.705 . 0 0 "[ . 1 . ]" 1
299 1 30 ALA H 1 53 SER QB 6.000 . 7.000 3.009 2.610 3.537 . 0 0 "[ . 1 . ]" 1
300 1 30 ALA H 1 54 PHE HA 5.000 . 5.000 3.409 3.177 3.683 . 0 0 "[ . 1 . ]" 1
301 1 30 ALA H 1 55 TYR H 6.000 . 6.000 4.384 4.009 4.735 . 0 0 "[ . 1 . ]" 1
302 1 30 ALA HA 1 31 VAL H 3.500 . 3.500 2.141 2.122 2.154 . 0 0 "[ . 1 . ]" 1
303 1 30 ALA HA 1 31 VAL QG 6.000 . 8.000 3.309 3.211 3.385 . 0 0 "[ . 1 . ]" 1
304 1 30 ALA HA 1 37 PHE H 5.000 . 5.000 4.499 4.293 4.707 . 0 0 "[ . 1 . ]" 1
305 1 30 ALA HA 1 37 PHE HA 5.000 . 5.000 2.176 2.002 2.351 . 0 0 "[ . 1 . ]" 1
306 1 30 ALA HA 1 37 PHE QB 5.000 . 6.000 2.666 2.452 2.869 . 0 0 "[ . 1 . ]" 1
307 1 30 ALA HA 1 53 SER H 5.000 . 5.000 4.505 4.170 4.853 . 0 0 "[ . 1 . ]" 1
308 1 30 ALA MB 1 31 VAL H 5.000 . 5.500 3.135 3.072 3.212 . 0 0 "[ . 1 . ]" 1
309 1 30 ALA MB 1 31 VAL HA 5.000 . 5.500 4.205 4.159 4.274 . 0 0 "[ . 1 . ]" 1
310 1 30 ALA MB 1 37 PHE HA 5.000 . 5.500 3.676 3.530 3.860 . 0 0 "[ . 1 . ]" 1
311 1 30 ALA MB 1 37 PHE QB 2.800 . 4.300 2.815 2.599 3.005 . 0 0 "[ . 1 . ]" 1
312 1 30 ALA MB 1 53 SER H 6.000 . 6.500 3.061 2.421 3.583 . 0 0 "[ . 1 . ]" 1
313 1 30 ALA MB 1 53 SER QB 2.800 . 4.300 1.754 1.680 1.872 0.120 4 0 "[ . 1 . ]" 1
314 1 30 ALA MB 1 54 PHE HA 5.000 . 5.500 4.265 3.998 4.414 . 0 0 "[ . 1 . ]" 1
315 1 30 ALA MB 1 55 TYR H 6.000 . 6.500 4.720 4.299 5.116 . 0 0 "[ . 1 . ]" 1
316 1 30 ALA MB 1 55 TYR QD 6.000 . 8.700 2.201 1.873 2.675 . 0 0 "[ . 1 . ]" 1
317 1 30 ALA MB 1 55 TYR QE 6.000 . 8.700 2.610 1.921 3.555 . 0 0 "[ . 1 . ]" 1
318 1 30 ALA MB 1 64 ALA MB 6.000 . 7.000 4.546 4.350 4.833 . 0 0 "[ . 1 . ]" 1
319 1 30 ALA MB 1 66 PHE QB 3.500 . 5.000 3.522 3.437 3.641 . 0 0 "[ . 1 . ]" 1
320 1 30 ALA MB 1 66 PHE QD 6.000 . 8.700 2.927 2.447 3.369 . 0 0 "[ . 1 . ]" 1
321 1 30 ALA MB 1 66 PHE QE 6.000 . 8.700 2.794 2.284 3.185 . 0 0 "[ . 1 . ]" 1
322 1 30 ALA MB 1 66 PHE HZ 6.000 . 6.500 3.582 3.223 3.896 . 0 0 "[ . 1 . ]" 1
323 1 31 VAL H 1 32 ARG H 5.000 . 5.000 4.338 4.193 4.422 . 0 0 "[ . 1 . ]" 1
324 1 31 VAL H 1 32 ARG HA 5.000 . 5.000 5.019 4.994 5.045 0.045 11 0 "[ . 1 . ]" 1
325 1 31 VAL H 1 36 ILE H 5.000 . 5.000 2.972 2.836 3.103 . 0 0 "[ . 1 . ]" 1
326 1 31 VAL H 1 37 PHE HA 3.500 . 3.500 3.113 3.007 3.262 . 0 0 "[ . 1 . ]" 1
327 1 31 VAL H 1 37 PHE QB 6.000 . 7.000 3.948 3.787 4.159 . 0 0 "[ . 1 . ]" 1
328 1 31 VAL H 1 52 VAL HA 6.000 . 6.000 5.461 5.029 5.892 . 0 0 "[ . 1 . ]" 1
329 1 31 VAL HA 1 32 ARG H 3.500 . 3.500 2.155 2.147 2.184 . 0 0 "[ . 1 . ]" 1
330 1 31 VAL HA 1 33 THR H 5.000 . 5.000 3.659 3.463 3.945 . 0 0 "[ . 1 . ]" 1
331 1 31 VAL HA 1 47 ALA MB 5.000 . 5.500 2.793 2.474 3.431 . 0 0 "[ . 1 . ]" 1
332 1 31 VAL HA 1 52 VAL HA 5.000 . 5.000 3.252 2.972 3.566 . 0 0 "[ . 1 . ]" 1
333 1 31 VAL HA 1 52 VAL QG 6.000 . 8.000 3.756 3.205 4.303 . 0 0 "[ . 1 . ]" 1
334 1 31 VAL HB 1 32 ARG H 6.000 . 6.000 4.108 3.943 4.275 . 0 0 "[ . 1 . ]" 1
335 1 31 VAL HB 1 33 THR H 6.000 . 6.000 4.128 3.794 4.385 . 0 0 "[ . 1 . ]" 1
336 1 31 VAL HB 1 34 THR H 6.000 . 6.000 3.096 2.814 4.098 . 0 0 "[ . 1 . ]" 1
337 1 31 VAL HB 1 35 GLY H 6.000 . 6.000 2.710 2.557 3.110 . 0 0 "[ . 1 . ]" 1
338 1 31 VAL HB 1 36 ILE H 6.000 . 6.000 2.150 1.991 2.576 . 0 0 "[ . 1 . ]" 1
339 1 31 VAL HB 1 36 ILE HB 5.000 . 5.000 4.666 4.557 4.761 . 0 0 "[ . 1 . ]" 1
340 1 31 VAL HB 1 36 ILE QG 3.500 . 4.500 2.025 1.945 2.142 . 0 0 "[ . 1 . ]" 1
341 1 31 VAL HB 1 36 ILE MG 5.000 . 5.500 4.540 4.446 4.597 . 0 0 "[ . 1 . ]" 1
342 1 31 VAL HB 1 47 ALA MB 5.000 . 5.500 4.416 4.271 4.502 . 0 0 "[ . 1 . ]" 1
343 1 31 VAL QG 1 32 ARG H 6.000 . 8.000 2.849 2.576 3.040 . 0 0 "[ . 1 . ]" 1
344 1 31 VAL QG 1 33 THR H 5.000 . 7.000 2.314 2.078 2.548 . 0 0 "[ . 1 . ]" 1
345 1 31 VAL QG 1 34 THR HB 3.500 . 5.500 3.541 3.083 3.762 . 0 0 "[ . 1 . ]" 1
346 1 31 VAL QG 1 36 ILE HB 3.500 . 5.500 3.486 3.413 3.605 . 0 0 "[ . 1 . ]" 1
347 1 31 VAL QG 1 37 PHE HA 6.000 . 8.000 3.233 2.974 3.458 . 0 0 "[ . 1 . ]" 1
348 1 31 VAL QG 1 47 ALA MB 6.000 . 8.500 1.949 1.783 2.183 0.017 5 0 "[ . 1 . ]" 1
349 1 31 VAL QG 1 51 ASN QB 5.000 . 8.000 4.125 3.892 4.415 . 0 0 "[ . 1 . ]" 1
350 1 31 VAL QG 1 52 VAL HA 6.000 . 8.000 3.953 3.719 4.232 . 0 0 "[ . 1 . ]" 1
351 1 31 VAL QG 1 52 VAL QG 6.000 . 10.000 3.455 3.037 3.928 . 0 0 "[ . 1 . ]" 1
352 1 31 VAL QG 1 53 SER H 6.000 . 8.000 4.453 4.185 4.772 . 0 0 "[ . 1 . ]" 1
353 1 32 ARG H 1 32 ARG QB 3.500 . 4.500 2.345 2.193 2.677 . 0 0 "[ . 1 . ]" 1
354 1 32 ARG H 1 32 ARG QG 3.500 . 4.500 3.629 2.414 4.058 . 0 0 "[ . 1 . ]" 1
355 1 32 ARG H 1 33 THR H 5.000 . 5.000 2.450 2.316 2.677 . 0 0 "[ . 1 . ]" 1
356 1 32 ARG H 1 34 THR H 6.000 . 6.000 4.373 3.905 5.176 . 0 0 "[ . 1 . ]" 1
357 1 32 ARG H 1 51 ASN HA 5.000 . 5.000 4.838 4.374 5.023 0.023 5 0 "[ . 1 . ]" 1
358 1 32 ARG H 1 51 ASN QB 5.000 . 6.000 3.928 3.420 4.290 . 0 0 "[ . 1 . ]" 1
359 1 32 ARG H 1 52 VAL HA 5.000 . 5.000 3.602 3.170 4.232 . 0 0 "[ . 1 . ]" 1
360 1 32 ARG H 1 52 VAL QG 6.000 . 8.000 4.713 4.340 5.306 . 0 0 "[ . 1 . ]" 1
361 1 32 ARG H 1 53 SER H 6.000 . 6.000 4.485 3.917 4.950 . 0 0 "[ . 1 . ]" 1
362 1 32 ARG H 1 66 PHE QE 6.000 . 8.200 4.095 3.531 5.223 . 0 0 "[ . 1 . ]" 1
363 1 32 ARG HA 1 32 ARG QG 3.500 . 4.500 2.332 2.170 2.612 . 0 0 "[ . 1 . ]" 1
364 1 32 ARG HA 1 66 PHE QD 6.000 . 8.200 4.769 4.381 5.154 . 0 0 "[ . 1 . ]" 1
365 1 32 ARG HA 1 66 PHE QE 3.500 . 5.700 2.734 2.213 3.239 . 0 0 "[ . 1 . ]" 1
366 1 32 ARG QB 1 32 ARG QD 2.800 . 4.800 2.076 1.957 2.166 . 0 0 "[ . 1 . ]" 1
367 1 32 ARG QB 1 33 THR H 5.000 . 6.000 2.822 2.609 3.057 . 0 0 "[ . 1 . ]" 1
368 1 32 ARG QB 1 33 THR MG 3.500 . 5.000 3.184 2.975 3.311 . 0 0 "[ . 1 . ]" 1
369 1 32 ARG QB 1 51 ASN HA 5.000 . 6.000 3.711 2.926 4.423 . 0 0 "[ . 1 . ]" 1
370 1 32 ARG QD 1 33 THR MG 3.500 . 5.000 3.486 3.217 3.639 . 0 0 "[ . 1 . ]" 1
371 1 32 ARG QD 1 51 ASN HA 5.000 . 6.000 4.096 2.159 5.154 . 0 0 "[ . 1 . ]" 1
372 1 32 ARG QD 1 66 PHE HZ 5.000 . 6.000 5.343 5.151 5.393 . 0 0 "[ . 1 . ]" 1
373 1 32 ARG QG 1 33 THR H 6.000 . 7.000 4.381 4.145 4.644 . 0 0 "[ . 1 . ]" 1
374 1 32 ARG QG 1 66 PHE HZ 5.000 . 6.000 3.403 3.229 3.572 . 0 0 "[ . 1 . ]" 1
375 1 33 THR H 1 34 THR H 5.000 . 5.000 2.762 2.501 3.143 . 0 0 "[ . 1 . ]" 1
376 1 33 THR H 1 35 GLY H 6.000 . 6.000 3.713 3.506 3.947 . 0 0 "[ . 1 . ]" 1
377 1 33 THR H 1 51 ASN HA 6.000 . 6.000 5.661 5.343 6.003 0.003 6 0 "[ . 1 . ]" 1
378 1 33 THR H 1 51 ASN QB 5.000 . 6.000 3.786 3.456 4.172 . 0 0 "[ . 1 . ]" 1
379 1 33 THR HA 1 33 THR MG 3.500 . 4.000 2.496 2.408 2.555 . 0 0 "[ . 1 . ]" 1
380 1 33 THR HA 1 34 THR H 5.000 . 5.000 3.452 2.766 3.576 . 0 0 "[ . 1 . ]" 1
381 1 33 THR MG 1 51 ASN HA 5.000 . 5.500 4.537 4.400 4.581 . 0 0 "[ . 1 . ]" 1
382 1 33 THR MG 1 51 ASN QB 2.800 . 4.300 2.485 2.335 2.750 . 0 0 "[ . 1 . ]" 1
383 1 33 THR MG 1 51 ASN QD 6.000 . 7.500 3.337 1.939 4.266 . 0 0 "[ . 1 . ]" 1
384 1 34 THR H 1 35 GLY H 3.500 . 3.500 2.137 1.924 2.566 . 0 0 "[ . 1 . ]" 1
385 1 34 THR H 1 35 GLY QA 6.000 . 7.000 4.038 3.515 4.465 . 0 0 "[ . 1 . ]" 1
386 1 34 THR H 1 36 ILE H 5.000 . 5.000 3.949 3.802 4.215 . 0 0 "[ . 1 . ]" 1
387 1 34 THR HA 1 34 THR MG 3.500 . 4.000 2.136 2.031 2.249 . 0 0 "[ . 1 . ]" 1
388 1 34 THR HA 1 35 GLY H 5.000 . 5.000 3.477 3.441 3.522 . 0 0 "[ . 1 . ]" 1
389 1 34 THR HA 1 36 ILE H 5.000 . 5.000 5.016 5.005 5.030 0.030 5 0 "[ . 1 . ]" 1
390 1 34 THR HB 1 36 ILE MD 3.500 . 4.000 3.265 3.222 3.313 . 0 0 "[ . 1 . ]" 1
391 1 34 THR HB 1 36 ILE MG 3.500 . 4.000 3.142 3.030 3.204 . 0 0 "[ . 1 . ]" 1
392 1 34 THR MG 1 35 GLY H 6.000 . 6.500 4.282 4.181 4.356 . 0 0 "[ . 1 . ]" 1
393 1 35 GLY H 1 36 ILE H 3.500 . 3.500 2.396 2.274 2.486 . 0 0 "[ . 1 . ]" 1
394 1 35 GLY H 1 36 ILE HB 6.000 . 6.000 5.941 5.830 6.006 0.006 3 0 "[ . 1 . ]" 1
395 1 35 GLY H 1 36 ILE MG 6.000 . 6.500 4.623 4.516 4.713 . 0 0 "[ . 1 . ]" 1
396 1 35 GLY QA 1 36 ILE H 5.000 . 6.000 2.754 2.718 2.787 . 0 0 "[ . 1 . ]" 1
397 1 35 GLY QA 1 66 PHE QD 3.500 . 6.700 2.830 2.131 3.531 . 0 0 "[ . 1 . ]" 1
398 1 35 GLY QA 1 66 PHE QE 5.000 . 8.200 2.618 1.981 3.235 . 0 0 "[ . 1 . ]" 1
399 1 36 ILE H 1 67 ARG H 6.000 . 6.000 4.379 4.254 4.608 . 0 0 "[ . 1 . ]" 1
400 1 36 ILE HA 1 36 ILE MG 3.500 . 4.000 2.181 2.096 2.250 . 0 0 "[ . 1 . ]" 1
401 1 36 ILE HA 1 37 PHE H 3.500 . 3.500 2.405 2.241 2.574 . 0 0 "[ . 1 . ]" 1
402 1 36 ILE HA 1 37 PHE QD 6.000 . 8.200 3.643 2.707 4.047 . 0 0 "[ . 1 . ]" 1
403 1 36 ILE HA 1 37 PHE QE 5.000 . 7.200 5.188 4.345 5.578 . 0 0 "[ . 1 . ]" 1
404 1 36 ILE HA 1 66 PHE QB 5.000 . 6.000 2.819 2.584 3.080 . 0 0 "[ . 1 . ]" 1
405 1 36 ILE HA 1 67 ARG H 3.500 . 3.500 2.105 1.924 2.411 . 0 0 "[ . 1 . ]" 1
406 1 36 ILE HA 1 67 ARG QG 5.000 . 6.000 4.688 4.366 5.045 . 0 0 "[ . 1 . ]" 1
407 1 36 ILE HB 1 36 ILE MD 3.500 . 4.000 2.156 2.000 2.284 . 0 0 "[ . 1 . ]" 1
408 1 36 ILE HB 1 37 PHE H 5.000 . 5.000 2.363 1.928 2.844 . 0 0 "[ . 1 . ]" 1
409 1 36 ILE HB 1 69 CYS QB 3.500 . 4.500 2.924 2.666 3.149 . 0 0 "[ . 1 . ]" 1
410 1 36 ILE MD 1 37 PHE H 5.000 . 5.500 3.909 3.509 4.336 . 0 0 "[ . 1 . ]" 1
411 1 36 ILE MD 1 37 PHE HA 5.000 . 5.500 4.306 4.130 4.460 . 0 0 "[ . 1 . ]" 1
412 1 36 ILE MD 1 44 ALA MB 6.000 . 7.000 4.765 4.535 4.858 . 0 0 "[ . 1 . ]" 1
413 1 36 ILE MD 1 69 CYS H 6.000 . 6.500 4.860 4.623 5.025 . 0 0 "[ . 1 . ]" 1
414 1 36 ILE MD 1 69 CYS HA 5.000 . 5.500 4.395 4.316 4.466 . 0 0 "[ . 1 . ]" 1
415 1 36 ILE MD 1 69 CYS QB 2.800 . 4.300 2.454 2.223 2.674 . 0 0 "[ . 1 . ]" 1
416 1 36 ILE QG 1 36 ILE MG 2.800 . 4.300 2.042 1.921 2.173 . 0 0 "[ . 1 . ]" 1
417 1 36 ILE QG 1 37 PHE H 6.000 . 7.000 4.029 3.715 4.319 . 0 0 "[ . 1 . ]" 1
418 1 36 ILE MG 1 67 ARG H 6.000 . 6.500 2.770 2.515 2.989 . 0 0 "[ . 1 . ]" 1
419 1 36 ILE MG 1 68 PRO HA 5.000 . 5.500 4.387 4.341 4.447 . 0 0 "[ . 1 . ]" 1
420 1 37 PHE H 1 37 PHE QD 5.000 . 7.200 2.859 1.899 3.399 . 0 0 "[ . 1 . ]" 1
421 1 37 PHE H 1 67 ARG H 5.000 . 5.000 3.979 3.601 4.335 . 0 0 "[ . 1 . ]" 1
422 1 37 PHE H 1 69 CYS H 5.000 . 5.000 3.804 3.438 4.026 . 0 0 "[ . 1 . ]" 1
423 1 37 PHE H 1 69 CYS QB 5.000 . 6.000 3.861 3.331 4.373 . 0 0 "[ . 1 . ]" 1
424 1 37 PHE QB 1 61 ALA MB 3.500 . 5.000 2.227 2.122 2.476 . 0 0 "[ . 1 . ]" 1
425 1 37 PHE QD 1 58 ALA HA 6.000 . 8.200 3.170 2.234 3.442 . 0 0 "[ . 1 . ]" 1
426 1 37 PHE QD 1 58 ALA MB 6.000 . 8.700 3.453 2.907 3.745 . 0 0 "[ . 1 . ]" 1
427 1 37 PHE QD 1 62 LEU QD 6.000 . 10.200 4.258 4.026 4.510 . 0 0 "[ . 1 . ]" 1
428 1 37 PHE QD 1 66 PHE H 6.000 . 8.200 4.011 3.656 4.762 . 0 0 "[ . 1 . ]" 1
429 1 37 PHE QD 1 66 PHE HA 5.000 . 7.200 4.049 3.913 4.218 . 0 0 "[ . 1 . ]" 1
430 1 37 PHE QD 1 66 PHE QB 3.500 . 6.700 1.929 1.874 2.109 . 0 0 "[ . 1 . ]" 1
431 1 37 PHE QD 1 67 ARG H 6.000 . 8.200 3.870 3.073 4.242 . 0 0 "[ . 1 . ]" 1
432 1 37 PHE QD 1 68 PRO HA 5.000 . 7.200 3.299 3.042 3.465 . 0 0 "[ . 1 . ]" 1
433 1 37 PHE QE 1 58 ALA HA 3.500 . 5.700 2.635 1.953 3.153 . 0 0 "[ . 1 . ]" 1
434 1 37 PHE QE 1 58 ALA MB 6.000 . 8.700 1.872 1.824 1.974 . 0 0 "[ . 1 . ]" 1
435 1 37 PHE QE 1 61 ALA HA 5.000 . 7.200 5.908 5.625 6.328 . 0 0 "[ . 1 . ]" 1
436 1 37 PHE QE 1 61 ALA MB 6.000 . 8.700 3.698 3.242 4.121 . 0 0 "[ . 1 . ]" 1
437 1 37 PHE QE 1 62 LEU HA 5.000 . 7.200 2.385 1.990 3.072 . 0 0 "[ . 1 . ]" 1
438 1 37 PHE QE 1 62 LEU QD 5.000 . 9.200 2.542 2.147 3.014 . 0 0 "[ . 1 . ]" 1
439 1 37 PHE QE 1 62 LEU HG 6.000 . 8.200 2.251 1.986 2.857 . 0 0 "[ . 1 . ]" 1
440 1 37 PHE QE 1 67 ARG HA 5.000 . 7.200 3.516 2.487 4.068 . 0 0 "[ . 1 . ]" 1
441 1 37 PHE QE 1 68 PRO HA 5.000 . 7.200 3.182 2.981 3.473 . 0 0 "[ . 1 . ]" 1
442 1 37 PHE QE 1 68 PRO QB 5.000 . 8.200 2.815 2.600 2.884 . 0 0 "[ . 1 . ]" 1
443 1 37 PHE QE 1 68 PRO QD 3.500 . 6.700 2.826 1.962 3.560 . 0 0 "[ . 1 . ]" 1
444 1 37 PHE QE 1 68 PRO QG 3.500 . 6.700 3.895 3.498 4.181 . 0 0 "[ . 1 . ]" 1
445 1 37 PHE HZ 1 62 LEU HA 6.000 . 6.000 4.114 3.446 4.530 . 0 0 "[ . 1 . ]" 1
446 1 37 PHE HZ 1 62 LEU QD 6.000 . 8.000 2.047 1.898 2.251 . 0 0 "[ . 1 . ]" 1
447 1 37 PHE HZ 1 62 LEU HG 6.000 . 6.000 3.481 2.143 3.901 . 0 0 "[ . 1 . ]" 1
448 1 37 PHE HZ 1 68 PRO QB 5.000 . 6.000 2.207 2.033 2.339 . 0 0 "[ . 1 . ]" 1
449 1 37 PHE HZ 1 68 PRO QG 5.000 . 6.000 3.571 3.198 3.886 . 0 0 "[ . 1 . ]" 1
450 1 39 ARG H 1 39 ARG QG 3.500 . 4.500 2.124 1.884 3.369 . 0 0 "[ . 1 . ]" 1
451 1 39 ARG H 1 42 CYS HA 6.000 . 6.000 5.986 5.873 6.067 0.067 8 0 "[ . 1 . ]" 1
452 1 39 ARG H 1 42 CYS QB 5.000 . 6.000 3.565 3.431 3.778 . 0 0 "[ . 1 . ]" 1
453 1 39 ARG HA 1 40 PRO HA 6.000 . 6.000 4.413 4.399 4.435 . 0 0 "[ . 1 . ]" 1
454 1 39 ARG HA 1 40 PRO QD 3.500 . 4.500 2.267 2.226 2.332 . 0 0 "[ . 1 . ]" 1
455 1 39 ARG HA 1 40 PRO QG 5.000 . 6.000 4.138 4.095 4.195 . 0 0 "[ . 1 . ]" 1
456 1 39 ARG HA 1 41 SER H 5.000 . 5.000 4.703 4.584 4.881 . 0 0 "[ . 1 . ]" 1
457 1 39 ARG QB 1 39 ARG QD 2.800 . 4.800 2.471 2.304 2.928 . 0 0 "[ . 1 . ]" 1
458 1 39 ARG QB 1 40 PRO QD 3.500 . 5.500 1.717 1.671 1.789 0.129 8 0 "[ . 1 . ]" 1
459 1 39 ARG QB 1 42 CYS H 5.000 . 6.000 4.414 4.037 4.863 . 0 0 "[ . 1 . ]" 1
460 1 39 ARG QD 1 74 PRO HA 5.000 . 6.000 2.801 1.937 3.886 . 0 0 "[ . 1 . ]" 1
461 1 39 ARG HE 1 39 ARG QG 3.500 . 4.500 2.321 2.168 2.763 . 0 0 "[ . 1 . ]" 1
462 1 39 ARG HE 1 74 PRO HA 6.000 . 6.000 3.567 1.948 4.691 . 0 0 "[ . 1 . ]" 1
463 1 39 ARG QG 1 42 CYS H 6.000 . 7.000 5.886 5.501 6.287 . 0 0 "[ . 1 . ]" 1
464 1 39 ARG QG 1 72 CYS HA 5.000 . 6.000 5.080 4.907 5.395 . 0 0 "[ . 1 . ]" 1
465 1 39 ARG QG 1 72 CYS QB 3.500 . 5.500 3.855 3.667 4.089 . 0 0 "[ . 1 . ]" 1
466 1 39 ARG QG 1 74 PRO HA 3.500 . 4.500 2.334 1.811 3.794 . 0 0 "[ . 1 . ]" 1
467 1 40 PRO HA 1 40 PRO QD 3.500 . 4.500 3.272 3.201 3.311 . 0 0 "[ . 1 . ]" 1
468 1 40 PRO HA 1 40 PRO QG 3.500 . 4.500 2.791 2.761 2.816 . 0 0 "[ . 1 . ]" 1
469 1 40 PRO HA 1 41 SER H 5.000 . 5.000 3.563 3.549 3.571 . 0 0 "[ . 1 . ]" 1
470 1 40 PRO HA 1 41 SER HA 5.000 . 5.000 4.687 4.667 4.698 . 0 0 "[ . 1 . ]" 1
471 1 40 PRO QB 1 41 SER H 3.500 . 4.500 2.285 2.129 2.388 . 0 0 "[ . 1 . ]" 1
472 1 40 PRO QD 1 41 SER H 5.000 . 6.000 3.046 2.939 3.225 . 0 0 "[ . 1 . ]" 1
473 1 40 PRO QG 1 41 SER H 5.000 . 6.000 3.769 3.711 3.811 . 0 0 "[ . 1 . ]" 1
474 1 41 SER H 1 42 CYS H 5.000 . 5.000 3.750 3.470 4.081 . 0 0 "[ . 1 . ]" 1
475 1 41 SER H 1 42 CYS QB 5.000 . 6.000 4.312 4.248 4.369 . 0 0 "[ . 1 . ]" 1
476 1 41 SER HA 1 42 CYS H 5.000 . 5.000 3.322 3.116 3.445 . 0 0 "[ . 1 . ]" 1
477 1 42 CYS H 1 42 CYS QB 3.500 . 4.500 3.033 2.915 3.155 . 0 0 "[ . 1 . ]" 1
478 1 42 CYS H 1 43 ARG H 6.000 . 6.000 4.326 4.201 4.456 . 0 0 "[ . 1 . ]" 1
479 1 42 CYS HA 1 72 CYS HA 6.000 . 6.000 3.405 2.983 4.099 . 0 0 "[ . 1 . ]" 1
480 1 42 CYS HA 1 72 CYS QB 3.500 . 4.500 1.947 1.774 2.194 0.026 15 0 "[ . 1 . ]" 1
481 1 42 CYS QB 1 43 ARG H 5.000 . 6.000 3.234 3.077 3.414 . 0 0 "[ . 1 . ]" 1
482 1 42 CYS QB 1 72 CYS HA 6.000 . 7.000 4.348 4.141 4.852 . 0 0 "[ . 1 . ]" 1
483 1 42 CYS QB 1 72 CYS QB 3.500 . 5.500 2.045 1.884 2.554 . 0 0 "[ . 1 . ]" 1
484 1 43 ARG H 1 43 ARG QG 3.500 . 4.500 2.911 2.103 4.131 . 0 0 "[ . 1 . ]" 1
485 1 43 ARG H 1 44 ALA MB 6.000 . 6.500 3.395 3.208 3.651 . 0 0 "[ . 1 . ]" 1
486 1 43 ARG HA 1 43 ARG QD 3.500 . 4.500 3.854 3.283 4.094 . 0 0 "[ . 1 . ]" 1
487 1 43 ARG HA 1 43 ARG QG 2.800 . 3.800 3.173 2.448 3.432 . 0 0 "[ . 1 . ]" 1
488 1 43 ARG HA 1 44 ALA H 5.000 . 5.000 2.831 2.381 3.034 . 0 0 "[ . 1 . ]" 1
489 1 43 ARG QB 1 43 ARG QD 2.800 . 4.800 2.073 1.928 2.157 . 0 0 "[ . 1 . ]" 1
490 1 43 ARG QB 1 44 ALA H 5.000 . 6.000 4.033 4.003 4.061 . 0 0 "[ . 1 . ]" 1
491 1 43 ARG QG 1 44 ALA H 3.500 . 4.500 3.673 3.417 4.015 . 0 0 "[ . 1 . ]" 1
492 1 44 ALA H 1 46 HIS QB 5.000 . 6.000 5.201 4.479 5.410 . 0 0 "[ . 1 . ]" 1
493 1 44 ALA HA 1 45 ARG H 3.500 . 3.500 2.202 2.141 2.759 . 0 0 "[ . 1 . ]" 1
494 1 45 ARG H 1 45 ARG QB 3.500 . 4.500 2.186 2.045 2.619 . 0 0 "[ . 1 . ]" 1
495 1 45 ARG HA 1 45 ARG QD 3.500 . 4.500 3.702 2.352 4.076 . 0 0 "[ . 1 . ]" 1
496 1 46 HIS H 1 47 ALA H 6.000 . 6.000 3.449 2.044 4.330 . 0 0 "[ . 1 . ]" 1
497 1 46 HIS HA 1 47 ALA H 2.800 . 2.800 2.467 2.162 2.858 0.058 10 0 "[ . 1 . ]" 1
498 1 46 HIS QB 1 47 ALA H 5.000 . 6.000 3.519 2.966 4.022 . 0 0 "[ . 1 . ]" 1
499 1 47 ALA HA 1 48 LEU H 2.800 . 2.800 2.147 2.137 2.216 . 0 0 "[ . 1 . ]" 1
500 1 47 ALA HA 1 48 LEU QD 6.000 . 8.000 4.086 3.129 4.787 . 0 0 "[ . 1 . ]" 1
501 1 47 ALA HA 1 48 LEU HG 5.000 . 5.000 4.135 3.707 4.736 . 0 0 "[ . 1 . ]" 1
502 1 47 ALA MB 1 48 LEU H 3.500 . 4.000 3.285 2.889 3.384 . 0 0 "[ . 1 . ]" 1
503 1 47 ALA MB 1 51 ASN QB 2.800 . 4.300 3.038 2.842 3.134 . 0 0 "[ . 1 . ]" 1
504 1 47 ALA MB 1 52 VAL QG 6.000 . 8.500 2.347 1.681 2.660 0.119 17 0 "[ . 1 . ]" 1
505 1 48 LEU H 1 48 LEU HG 3.500 . 3.500 2.454 1.989 3.114 . 0 0 "[ . 1 . ]" 1
506 1 48 LEU H 1 49 ARG H 6.000 . 6.000 4.537 4.477 4.624 . 0 0 "[ . 1 . ]" 1
507 1 48 LEU H 1 51 ASN QB 5.000 . 6.000 2.553 1.961 3.256 . 0 0 "[ . 1 . ]" 1
508 1 48 LEU H 1 51 ASN QD 6.000 . 7.000 3.470 2.844 4.510 . 0 0 "[ . 1 . ]" 1
509 1 48 LEU HA 1 48 LEU QD 3.500 . 5.500 2.552 1.967 3.170 . 0 0 "[ . 1 . ]" 1
510 1 48 LEU HA 1 48 LEU HG 3.500 . 3.500 2.756 2.408 3.136 . 0 0 "[ . 1 . ]" 1
511 1 48 LEU HA 1 49 ARG H 2.800 . 2.800 2.622 2.427 2.700 . 0 0 "[ . 1 . ]" 1
512 1 48 LEU HA 1 50 GLU H 5.000 . 5.000 4.376 4.090 4.550 . 0 0 "[ . 1 . ]" 1
513 1 48 LEU HA 1 51 ASN H 5.000 . 5.000 4.721 4.227 5.026 0.026 13 0 "[ . 1 . ]" 1
514 1 48 LEU QB 1 50 GLU H 3.500 . 4.500 3.107 2.423 3.576 . 0 0 "[ . 1 . ]" 1
515 1 48 LEU QB 1 50 GLU QG 2.800 . 4.800 2.630 2.156 3.661 . 0 0 "[ . 1 . ]" 1
516 1 48 LEU QB 1 51 ASN H 5.000 . 6.000 2.944 2.287 3.496 . 0 0 "[ . 1 . ]" 1
517 1 48 LEU QB 1 51 ASN QD 5.000 . 7.000 3.199 2.003 4.988 . 0 0 "[ . 1 . ]" 1
518 1 48 LEU QD 1 50 GLU H 6.000 . 8.000 4.389 3.789 4.891 . 0 0 "[ . 1 . ]" 1
519 1 48 LEU QD 1 50 GLU QG 3.500 . 6.500 3.364 2.801 4.109 . 0 0 "[ . 1 . ]" 1
520 1 48 LEU QD 1 51 ASN QD 6.000 . 9.000 2.673 2.052 3.867 . 0 0 "[ . 1 . ]" 1
521 1 48 LEU HG 1 51 ASN QD 5.000 . 6.000 4.297 2.983 5.271 . 0 0 "[ . 1 . ]" 1
522 1 49 ARG H 1 49 ARG QB 3.500 . 4.500 2.289 2.113 2.765 . 0 0 "[ . 1 . ]" 1
523 1 49 ARG H 1 50 GLU H 3.500 . 3.500 3.214 2.593 3.536 0.036 14 0 "[ . 1 . ]" 1
524 1 49 ARG H 1 51 ASN H 6.000 . 6.000 4.404 3.865 4.716 . 0 0 "[ . 1 . ]" 1
525 1 49 ARG HA 1 49 ARG QD 3.500 . 4.500 3.827 3.116 4.084 . 0 0 "[ . 1 . ]" 1
526 1 49 ARG HA 1 50 GLU H 5.000 . 5.000 2.892 2.559 3.486 . 0 0 "[ . 1 . ]" 1
527 1 49 ARG HA 1 51 ASN H 5.000 . 5.000 4.413 3.765 4.509 . 0 0 "[ . 1 . ]" 1
528 1 49 ARG HA 1 52 VAL H 5.000 . 5.000 4.640 4.361 4.997 . 0 0 "[ . 1 . ]" 1
529 1 49 ARG HA 1 52 VAL HB 5.000 . 5.000 4.530 3.950 5.006 0.006 17 0 "[ . 1 . ]" 1
530 1 49 ARG HA 1 52 VAL QG 6.000 . 8.000 2.533 1.974 3.085 . 0 0 "[ . 1 . ]" 1
531 1 49 ARG QB 1 50 GLU H 3.500 . 4.500 3.657 2.892 4.020 . 0 0 "[ . 1 . ]" 1
532 1 49 ARG QB 1 51 ASN H 6.000 . 7.000 5.195 4.629 5.643 . 0 0 "[ . 1 . ]" 1
533 1 49 ARG HE 1 49 ARG QG 3.500 . 4.500 2.557 2.097 2.913 . 0 0 "[ . 1 . ]" 1
534 1 49 ARG QG 1 50 GLU H 5.000 . 6.000 4.065 2.331 4.494 . 0 0 "[ . 1 . ]" 1
535 1 50 GLU H 1 50 GLU QB 3.500 . 4.500 3.097 2.546 3.391 . 0 0 "[ . 1 . ]" 1
536 1 50 GLU H 1 50 GLU QG 3.500 . 4.500 2.515 1.977 3.253 . 0 0 "[ . 1 . ]" 1
537 1 50 GLU H 1 51 ASN H 3.500 . 3.500 2.047 1.862 2.648 . 0 0 "[ . 1 . ]" 1
538 1 50 GLU H 1 51 ASN QB 6.000 . 7.000 4.046 3.810 4.194 . 0 0 "[ . 1 . ]" 1
539 1 50 GLU H 1 52 VAL H 6.000 . 6.000 3.346 2.692 4.499 . 0 0 "[ . 1 . ]" 1
540 1 50 GLU HA 1 50 GLU QG 3.500 . 4.500 3.193 2.383 3.375 . 0 0 "[ . 1 . ]" 1
541 1 50 GLU HA 1 51 ASN H 5.000 . 5.000 3.480 2.955 3.538 . 0 0 "[ . 1 . ]" 1
542 1 50 GLU HA 1 52 VAL H 5.000 . 5.000 3.703 3.558 3.783 . 0 0 "[ . 1 . ]" 1
543 1 50 GLU QG 1 51 ASN H 3.500 . 4.500 2.611 1.976 3.991 . 0 0 "[ . 1 . ]" 1
544 1 50 GLU QG 1 51 ASN HA 6.000 . 7.000 4.278 3.512 5.787 . 0 0 "[ . 1 . ]" 1
545 1 50 GLU QG 1 51 ASN QD 5.000 . 7.000 3.425 1.894 5.566 . 0 0 "[ . 1 . ]" 1
546 1 51 ASN H 1 51 ASN QB 3.500 . 4.500 2.368 2.236 2.665 . 0 0 "[ . 1 . ]" 1
547 1 51 ASN H 1 52 VAL H 3.500 . 3.500 2.803 1.990 3.139 . 0 0 "[ . 1 . ]" 1
548 1 51 ASN H 1 52 VAL QG 6.000 . 8.000 3.473 2.875 3.672 . 0 0 "[ . 1 . ]" 1
549 1 51 ASN HA 1 52 VAL H 5.000 . 5.000 2.933 2.767 3.056 . 0 0 "[ . 1 . ]" 1
550 1 51 ASN QB 1 52 VAL H 5.000 . 6.000 3.775 3.681 3.874 . 0 0 "[ . 1 . ]" 1
551 1 51 ASN QB 1 52 VAL QG 5.000 . 8.000 4.202 3.314 4.437 . 0 0 "[ . 1 . ]" 1
552 1 52 VAL H 1 52 VAL HB 3.500 . 3.500 3.170 2.798 3.599 0.099 17 0 "[ . 1 . ]" 1
553 1 52 VAL H 1 53 SER H 5.000 . 5.000 4.381 4.189 4.513 . 0 0 "[ . 1 . ]" 1
554 1 52 VAL HA 1 53 SER H 2.800 . 2.800 2.207 2.143 2.332 . 0 0 "[ . 1 . ]" 1
555 1 52 VAL HB 1 53 SER H 5.000 . 5.000 4.010 2.956 4.277 . 0 0 "[ . 1 . ]" 1
556 1 52 VAL QG 1 53 SER H 5.000 . 7.000 2.300 1.942 3.361 . 0 0 "[ . 1 . ]" 1
557 1 52 VAL QG 1 53 SER HA 6.000 . 8.000 3.500 3.249 4.105 . 0 0 "[ . 1 . ]" 1
558 1 53 SER HA 1 54 PHE H 3.500 . 3.500 2.357 2.155 2.494 . 0 0 "[ . 1 . ]" 1
559 1 53 SER QB 1 54 PHE H 3.500 . 4.500 2.856 2.351 3.609 . 0 0 "[ . 1 . ]" 1
560 1 53 SER QB 1 55 TYR QE 3.500 . 6.700 3.124 2.488 3.791 . 0 0 "[ . 1 . ]" 1
561 1 54 PHE H 1 54 PHE QB 3.500 . 4.500 2.552 2.293 2.764 . 0 0 "[ . 1 . ]" 1
562 1 54 PHE H 1 54 PHE QD 5.000 . 7.200 3.045 2.092 4.107 . 0 0 "[ . 1 . ]" 1
563 1 54 PHE HA 1 54 PHE QD 3.500 . 5.700 2.719 1.990 3.729 . 0 0 "[ . 1 . ]" 1
564 1 54 PHE HA 1 55 TYR H 3.500 . 3.500 2.196 2.135 2.309 . 0 0 "[ . 1 . ]" 1
565 1 54 PHE QB 1 55 TYR H 5.000 . 6.000 2.996 2.613 3.250 . 0 0 "[ . 1 . ]" 1
566 1 54 PHE QD 1 55 TYR H 6.000 . 8.200 3.792 2.630 4.452 . 0 0 "[ . 1 . ]" 1
567 1 55 TYR H 1 55 TYR QD 5.000 . 7.200 3.827 3.470 4.013 . 0 0 "[ . 1 . ]" 1
568 1 55 TYR H 1 55 TYR QE 6.000 . 8.200 5.788 5.577 5.955 . 0 0 "[ . 1 . ]" 1
569 1 55 TYR H 1 56 ALA H 6.000 . 6.000 4.382 4.316 4.415 . 0 0 "[ . 1 . ]" 1
570 1 55 TYR H 1 56 ALA HA 5.000 . 5.000 4.851 4.668 5.009 0.009 16 0 "[ . 1 . ]" 1
571 1 55 TYR H 1 61 ALA MB 6.000 . 6.500 4.706 4.282 5.118 . 0 0 "[ . 1 . ]" 1
572 1 55 TYR HA 1 55 TYR QD 3.500 . 5.700 2.684 2.486 2.954 . 0 0 "[ . 1 . ]" 1
573 1 55 TYR HA 1 55 TYR QE 5.000 . 7.200 4.383 4.316 4.489 . 0 0 "[ . 1 . ]" 1
574 1 55 TYR HA 1 56 ALA H 2.800 . 2.800 2.287 2.191 2.417 . 0 0 "[ . 1 . ]" 1
575 1 55 TYR HA 1 56 ALA MB 5.000 . 5.500 3.975 3.913 4.017 . 0 0 "[ . 1 . ]" 1
576 1 55 TYR HA 1 60 GLU QB 5.000 . 6.000 4.113 3.828 4.389 . 0 0 "[ . 1 . ]" 1
577 1 55 TYR HA 1 61 ALA MB 5.000 . 5.500 4.387 4.330 4.430 . 0 0 "[ . 1 . ]" 1
578 1 55 TYR QB 1 55 TYR QD 2.800 . 6.000 2.137 2.135 2.140 . 0 0 "[ . 1 . ]" 1
579 1 55 TYR QB 1 56 ALA H 3.500 . 4.500 2.822 2.477 3.122 . 0 0 "[ . 1 . ]" 1
580 1 55 TYR QB 1 57 ASN H 3.500 . 4.500 2.958 2.864 3.011 . 0 0 "[ . 1 . ]" 1
581 1 55 TYR QB 1 60 GLU QB 3.500 . 5.500 2.903 2.432 3.295 . 0 0 "[ . 1 . ]" 1
582 1 55 TYR QB 1 61 ALA MB 2.800 . 4.300 2.185 1.940 2.360 . 0 0 "[ . 1 . ]" 1
583 1 55 TYR QD 1 56 ALA H 6.000 . 8.200 2.948 2.764 3.442 . 0 0 "[ . 1 . ]" 1
584 1 55 TYR QD 1 57 ASN H 6.000 . 8.200 3.765 3.472 4.044 . 0 0 "[ . 1 . ]" 1
585 1 55 TYR QD 1 60 GLU QB 3.500 . 6.700 2.015 1.824 2.463 . 0 0 "[ . 1 . ]" 1
586 1 55 TYR QD 1 60 GLU QG 3.500 . 6.700 3.472 3.068 3.998 . 0 0 "[ . 1 . ]" 1
587 1 55 TYR QD 1 61 ALA HA 5.000 . 7.200 3.246 2.831 3.472 . 0 0 "[ . 1 . ]" 1
588 1 55 TYR QD 1 61 ALA MB 6.000 . 8.700 2.333 2.044 2.516 . 0 0 "[ . 1 . ]" 1
589 1 55 TYR QD 1 64 ALA MB 6.000 . 8.700 4.533 4.146 4.822 . 0 0 "[ . 1 . ]" 1
590 1 55 TYR QE 1 56 ALA H 6.000 . 8.200 5.130 4.959 5.434 . 0 0 "[ . 1 . ]" 1
591 1 55 TYR QE 1 61 ALA HA 5.000 . 7.200 2.883 2.762 3.175 . 0 0 "[ . 1 . ]" 1
592 1 55 TYR QE 1 61 ALA MB 6.000 . 8.700 3.082 2.791 3.508 . 0 0 "[ . 1 . ]" 1
593 1 55 TYR QE 1 64 ALA MB 6.000 . 8.700 3.086 2.745 3.313 . 0 0 "[ . 1 . ]" 1
594 1 56 ALA H 1 57 ASN H 3.500 . 3.500 2.543 2.283 2.819 . 0 0 "[ . 1 . ]" 1
595 1 56 ALA HA 1 57 ASN H 5.000 . 5.000 3.548 3.543 3.558 . 0 0 "[ . 1 . ]" 1
596 1 56 ALA MB 1 57 ASN H 5.000 . 5.500 2.566 2.478 2.656 . 0 0 "[ . 1 . ]" 1
597 1 56 ALA MB 1 60 GLU QG 2.800 . 4.300 2.818 2.703 2.906 . 0 0 "[ . 1 . ]" 1
598 1 57 ASN H 1 57 ASN QB 3.500 . 4.500 2.730 2.545 3.225 . 0 0 "[ . 1 . ]" 1
599 1 57 ASN H 1 58 ALA H 6.000 . 6.000 4.403 4.377 4.433 . 0 0 "[ . 1 . ]" 1
600 1 57 ASN H 1 58 ALA HA 5.000 . 5.000 5.013 4.983 5.034 0.034 1 0 "[ . 1 . ]" 1
601 1 57 ASN H 1 60 GLU H 5.000 . 5.000 3.765 3.636 3.872 . 0 0 "[ . 1 . ]" 1
602 1 57 ASN H 1 60 GLU QB 3.500 . 4.500 2.681 2.333 2.921 . 0 0 "[ . 1 . ]" 1
603 1 57 ASN H 1 60 GLU QG 5.000 . 6.000 2.647 2.348 3.176 . 0 0 "[ . 1 . ]" 1
604 1 57 ASN H 1 61 ALA H 5.000 . 5.000 4.115 3.959 4.303 . 0 0 "[ . 1 . ]" 1
605 1 57 ASN H 1 61 ALA MB 6.000 . 6.500 4.579 4.378 4.809 . 0 0 "[ . 1 . ]" 1
606 1 57 ASN HA 1 58 ALA HA 6.000 . 6.000 4.308 4.285 4.324 . 0 0 "[ . 1 . ]" 1
607 1 57 ASN HA 1 59 SER H 5.000 . 5.000 4.515 4.090 4.703 . 0 0 "[ . 1 . ]" 1
608 1 57 ASN QB 1 58 ALA H 5.000 . 6.000 2.491 1.965 3.095 . 0 0 "[ . 1 . ]" 1
609 1 57 ASN QB 1 59 SER H 5.000 . 6.000 2.661 2.446 2.933 . 0 0 "[ . 1 . ]" 1
610 1 57 ASN QB 1 60 GLU H 5.000 . 6.000 2.953 2.600 3.722 . 0 0 "[ . 1 . ]" 1
611 1 57 ASN QB 1 61 ALA H 5.000 . 6.000 4.719 4.519 5.249 . 0 0 "[ . 1 . ]" 1
612 1 57 ASN QD 1 58 ALA MB 6.000 . 7.500 4.257 2.875 5.345 . 0 0 "[ . 1 . ]" 1
613 1 57 ASN QD 1 59 SER H 6.000 . 7.000 3.612 1.977 5.369 . 0 0 "[ . 1 . ]" 1
614 1 57 ASN QD 1 60 GLU QG 5.000 . 7.000 4.035 1.964 4.952 . 0 0 "[ . 1 . ]" 1
615 1 58 ALA H 1 59 SER H 5.000 . 5.000 2.524 2.443 2.677 . 0 0 "[ . 1 . ]" 1
616 1 58 ALA HA 1 59 SER H 5.000 . 5.000 3.526 3.492 3.547 . 0 0 "[ . 1 . ]" 1
617 1 58 ALA HA 1 60 GLU H 5.000 . 5.000 4.041 3.952 4.337 . 0 0 "[ . 1 . ]" 1
618 1 58 ALA HA 1 61 ALA H 5.000 . 5.000 3.457 3.399 3.569 . 0 0 "[ . 1 . ]" 1
619 1 58 ALA HA 1 61 ALA MB 3.500 . 4.000 3.116 2.872 3.196 . 0 0 "[ . 1 . ]" 1
620 1 58 ALA HA 1 62 LEU H 5.000 . 5.000 3.544 3.316 3.898 . 0 0 "[ . 1 . ]" 1
621 1 58 ALA MB 1 59 SER H 5.000 . 5.500 2.639 2.510 2.879 . 0 0 "[ . 1 . ]" 1
622 1 58 ALA MB 1 60 GLU H 6.000 . 6.500 4.421 4.334 4.635 . 0 0 "[ . 1 . ]" 1
623 1 58 ALA MB 1 61 ALA MB 6.000 . 7.000 4.218 4.139 4.254 . 0 0 "[ . 1 . ]" 1
624 1 58 ALA MB 1 62 LEU QD 6.000 . 8.500 3.175 2.866 3.829 . 0 0 "[ . 1 . ]" 1
625 1 59 SER H 1 59 SER QB 2.800 . 3.800 2.555 2.058 2.862 . 0 0 "[ . 1 . ]" 1
626 1 59 SER H 1 60 GLU H 3.500 . 3.500 2.680 2.546 2.829 . 0 0 "[ . 1 . ]" 1
627 1 59 SER H 1 60 GLU QB 6.000 . 7.000 4.829 4.556 4.976 . 0 0 "[ . 1 . ]" 1
628 1 59 SER H 1 60 GLU QG 6.000 . 7.000 4.072 3.846 4.725 . 0 0 "[ . 1 . ]" 1
629 1 59 SER H 1 61 ALA H 5.000 . 5.000 4.501 4.395 4.546 . 0 0 "[ . 1 . ]" 1
630 1 59 SER HA 1 62 LEU QB 3.500 . 4.500 2.659 2.528 2.825 . 0 0 "[ . 1 . ]" 1
631 1 59 SER HA 1 62 LEU QD 5.000 . 7.000 3.385 3.237 3.670 . 0 0 "[ . 1 . ]" 1
632 1 59 SER QB 1 62 LEU QB 3.500 . 5.500 4.292 4.174 4.425 . 0 0 "[ . 1 . ]" 1
633 1 59 SER QB 1 62 LEU QD 5.000 . 8.000 4.431 4.240 4.761 . 0 0 "[ . 1 . ]" 1
634 1 60 GLU H 1 60 GLU QB 3.500 . 4.500 2.511 2.221 2.645 . 0 0 "[ . 1 . ]" 1
635 1 60 GLU H 1 60 GLU QG 3.500 . 4.500 2.168 1.978 2.764 . 0 0 "[ . 1 . ]" 1
636 1 60 GLU H 1 61 ALA H 3.500 . 3.500 2.646 2.619 2.778 . 0 0 "[ . 1 . ]" 1
637 1 60 GLU H 1 61 ALA MB 6.000 . 6.500 4.318 4.222 4.450 . 0 0 "[ . 1 . ]" 1
638 1 60 GLU H 1 63 ALA H 6.000 . 6.000 4.584 4.455 4.779 . 0 0 "[ . 1 . ]" 1
639 1 60 GLU HA 1 60 GLU QG 2.800 . 3.800 3.059 2.819 3.185 . 0 0 "[ . 1 . ]" 1
640 1 60 GLU HA 1 61 ALA H 5.000 . 5.000 3.565 3.561 3.569 . 0 0 "[ . 1 . ]" 1
641 1 60 GLU HA 1 63 ALA MB 3.500 . 4.000 3.052 2.897 3.203 . 0 0 "[ . 1 . ]" 1
642 1 60 GLU QB 1 61 ALA H 3.500 . 4.500 2.322 2.296 2.428 . 0 0 "[ . 1 . ]" 1
643 1 60 GLU QB 1 63 ALA H 6.000 . 7.000 5.099 5.042 5.155 . 0 0 "[ . 1 . ]" 1
644 1 61 ALA H 1 62 LEU H 3.500 . 3.500 2.579 2.519 2.663 . 0 0 "[ . 1 . ]" 1
645 1 61 ALA H 1 62 LEU QB 5.000 . 6.000 4.307 4.277 4.361 . 0 0 "[ . 1 . ]" 1
646 1 61 ALA H 1 63 ALA H 5.000 . 5.000 4.230 4.161 4.326 . 0 0 "[ . 1 . ]" 1
647 1 61 ALA HA 1 62 LEU H 5.000 . 5.000 3.528 3.498 3.549 . 0 0 "[ . 1 . ]" 1
648 1 61 ALA HA 1 63 ALA H 5.000 . 5.000 4.531 4.478 4.654 . 0 0 "[ . 1 . ]" 1
649 1 61 ALA HA 1 64 ALA H 5.000 . 5.000 3.511 3.463 3.586 . 0 0 "[ . 1 . ]" 1
650 1 61 ALA HA 1 64 ALA MB 3.500 . 4.000 2.722 2.590 2.838 . 0 0 "[ . 1 . ]" 1
651 1 61 ALA HA 1 65 GLY H 6.000 . 6.000 5.075 4.880 5.688 . 0 0 "[ . 1 . ]" 1
652 1 61 ALA MB 1 62 LEU H 5.000 . 5.500 2.634 2.474 2.781 . 0 0 "[ . 1 . ]" 1
653 1 61 ALA MB 1 62 LEU HA 5.000 . 5.500 3.749 3.678 3.803 . 0 0 "[ . 1 . ]" 1
654 1 61 ALA MB 1 62 LEU QD 6.000 . 8.500 4.740 4.636 4.825 . 0 0 "[ . 1 . ]" 1
655 1 61 ALA MB 1 63 ALA H 6.000 . 6.500 4.646 4.569 4.726 . 0 0 "[ . 1 . ]" 1
656 1 61 ALA MB 1 64 ALA H 6.000 . 6.500 4.589 4.482 4.684 . 0 0 "[ . 1 . ]" 1
657 1 61 ALA MB 1 64 ALA MB 6.000 . 7.000 3.834 3.766 3.938 . 0 0 "[ . 1 . ]" 1
658 1 61 ALA MB 1 66 PHE H 6.000 . 6.500 4.957 4.680 5.321 . 0 0 "[ . 1 . ]" 1
659 1 61 ALA MB 1 66 PHE QB 2.800 . 4.300 3.018 2.891 3.070 . 0 0 "[ . 1 . ]" 1
660 1 62 LEU H 1 62 LEU QB 3.500 . 4.500 2.198 2.098 2.242 . 0 0 "[ . 1 . ]" 1
661 1 62 LEU H 1 63 ALA H 3.500 . 3.500 2.710 2.615 2.784 . 0 0 "[ . 1 . ]" 1
662 1 62 LEU H 1 64 ALA H 5.000 . 5.000 4.062 3.871 4.173 . 0 0 "[ . 1 . ]" 1
663 1 62 LEU HA 1 62 LEU HG 3.500 . 3.500 2.375 2.294 2.478 . 0 0 "[ . 1 . ]" 1
664 1 62 LEU HA 1 65 GLY H 5.000 . 5.000 3.603 3.487 4.077 . 0 0 "[ . 1 . ]" 1
665 1 62 LEU QB 1 63 ALA H 3.500 . 4.500 2.432 2.335 2.497 . 0 0 "[ . 1 . ]" 1
666 1 62 LEU QD 1 63 ALA H 6.000 . 8.000 3.222 2.954 3.606 . 0 0 "[ . 1 . ]" 1
667 1 62 LEU QD 1 67 ARG HA 6.000 . 8.000 3.997 3.755 4.421 . 0 0 "[ . 1 . ]" 1
668 1 62 LEU QD 1 68 PRO HA 6.000 . 8.000 4.429 4.043 4.853 . 0 0 "[ . 1 . ]" 1
669 1 62 LEU QD 1 68 PRO QD 3.500 . 6.500 2.666 2.271 3.190 . 0 0 "[ . 1 . ]" 1
670 1 62 LEU QD 1 68 PRO QG 5.000 . 8.000 2.754 2.255 3.187 . 0 0 "[ . 1 . ]" 1
671 1 63 ALA H 1 64 ALA H 3.500 . 3.500 2.695 2.651 2.709 . 0 0 "[ . 1 . ]" 1
672 1 63 ALA HA 1 64 ALA H 3.500 . 3.500 3.507 3.458 3.521 0.021 14 0 "[ . 1 . ]" 1
673 1 64 ALA H 1 65 GLY H 3.500 . 3.500 2.643 2.618 2.744 . 0 0 "[ . 1 . ]" 1
674 1 64 ALA H 1 65 GLY QA 6.000 . 7.000 4.563 4.515 4.599 . 0 0 "[ . 1 . ]" 1
675 1 64 ALA HA 1 65 GLY H 3.500 . 3.500 3.406 3.117 3.477 . 0 0 "[ . 1 . ]" 1
676 1 64 ALA MB 1 65 GLY H 6.000 . 6.500 3.040 2.890 3.517 . 0 0 "[ . 1 . ]" 1
677 1 64 ALA MB 1 66 PHE QD 6.000 . 8.700 2.842 2.323 3.261 . 0 0 "[ . 1 . ]" 1
678 1 64 ALA MB 1 66 PHE QE 6.000 . 8.700 3.324 2.611 4.108 . 0 0 "[ . 1 . ]" 1
679 1 65 GLY QA 1 66 PHE H 5.000 . 6.000 2.562 2.439 2.698 . 0 0 "[ . 1 . ]" 1
680 1 66 PHE H 1 66 PHE QB 3.500 . 4.500 2.604 2.415 2.745 . 0 0 "[ . 1 . ]" 1
681 1 66 PHE H 1 66 PHE QD 5.000 . 7.200 3.392 3.013 4.026 . 0 0 "[ . 1 . ]" 1
682 1 66 PHE H 1 67 ARG H 5.000 . 5.000 4.352 4.231 4.435 . 0 0 "[ . 1 . ]" 1
683 1 66 PHE HA 1 66 PHE QD 3.500 . 5.700 2.735 1.895 3.090 . 0 0 "[ . 1 . ]" 1
684 1 66 PHE HA 1 66 PHE QE 6.000 . 8.200 4.445 4.155 4.588 . 0 0 "[ . 1 . ]" 1
685 1 66 PHE HA 1 67 ARG H 3.500 . 3.500 2.222 2.177 2.335 . 0 0 "[ . 1 . ]" 1
686 1 66 PHE QB 1 67 ARG H 5.000 . 6.000 2.973 2.643 3.133 . 0 0 "[ . 1 . ]" 1
687 1 67 ARG H 1 67 ARG QG 3.500 . 4.500 3.392 2.940 3.929 . 0 0 "[ . 1 . ]" 1
688 1 67 ARG H 1 68 PRO QD 6.000 . 7.000 4.388 4.287 4.424 . 0 0 "[ . 1 . ]" 1
689 1 67 ARG HA 1 68 PRO HA 6.000 . 6.000 4.427 4.405 4.467 . 0 0 "[ . 1 . ]" 1
690 1 67 ARG HA 1 68 PRO QD 2.800 . 3.800 2.024 1.939 2.059 . 0 0 "[ . 1 . ]" 1
691 1 67 ARG HA 1 68 PRO QG 5.000 . 6.000 3.949 3.842 3.995 . 0 0 "[ . 1 . ]" 1
692 1 67 ARG QB 1 68 PRO QD 2.800 . 4.800 2.876 2.372 3.444 . 0 0 "[ . 1 . ]" 1
693 1 68 PRO HA 1 68 PRO QD 3.500 . 4.500 3.437 3.329 3.517 . 0 0 "[ . 1 . ]" 1
694 1 68 PRO HA 1 69 CYS H 3.500 . 3.500 2.196 2.161 2.260 . 0 0 "[ . 1 . ]" 1
695 1 68 PRO QB 1 68 PRO QD 2.800 . 4.800 2.800 2.749 2.880 . 0 0 "[ . 1 . ]" 1
696 1 68 PRO QB 1 69 CYS H 5.000 . 6.000 2.966 2.745 3.095 . 0 0 "[ . 1 . ]" 1
697 1 68 PRO QD 1 69 CYS H 5.000 . 6.000 4.978 4.923 4.997 . 0 0 "[ . 1 . ]" 1
698 1 68 PRO QG 1 69 CYS H 6.000 . 7.000 4.442 4.293 4.542 . 0 0 "[ . 1 . ]" 1
699 1 69 CYS H 1 69 CYS QB 3.500 . 4.500 2.474 2.356 2.592 . 0 0 "[ . 1 . ]" 1
700 1 69 CYS QB 1 70 LYS H 6.000 . 7.000 3.903 3.796 3.976 . 0 0 "[ . 1 . ]" 1
701 1 69 CYS QB 1 72 CYS H 6.000 . 7.000 5.762 4.631 6.151 . 0 0 "[ . 1 . ]" 1
702 1 70 LYS H 1 70 LYS QD 5.000 . 6.000 3.452 1.988 4.568 . 0 0 "[ . 1 . ]" 1
703 1 70 LYS HA 1 70 LYS QE 6.000 . 7.000 4.613 4.172 5.548 . 0 0 "[ . 1 . ]" 1
704 1 70 LYS HA 1 71 ARG H 3.500 . 3.500 2.913 2.726 3.309 . 0 0 "[ . 1 . ]" 1
705 1 70 LYS HA 1 72 CYS H 5.000 . 5.000 3.058 2.976 3.296 . 0 0 "[ . 1 . ]" 1
706 1 71 ARG H 1 71 ARG QB 2.800 . 3.800 2.905 2.088 3.458 . 0 0 "[ . 1 . ]" 1
707 1 71 ARG H 1 72 CYS H 3.500 . 3.500 2.596 2.495 2.724 . 0 0 "[ . 1 . ]" 1
708 1 71 ARG H 1 72 CYS QB 5.000 . 6.000 5.218 4.740 5.362 . 0 0 "[ . 1 . ]" 1
709 1 71 ARG H 1 73 GLN H 5.000 . 5.000 4.007 3.684 4.383 . 0 0 "[ . 1 . ]" 1
710 1 71 ARG H 1 73 GLN QG 6.000 . 7.000 6.102 5.952 6.275 . 0 0 "[ . 1 . ]" 1
711 1 71 ARG HA 1 71 ARG QG 3.500 . 4.500 2.320 2.027 2.727 . 0 0 "[ . 1 . ]" 1
712 1 71 ARG HA 1 72 CYS H 5.000 . 5.000 3.209 3.138 3.447 . 0 0 "[ . 1 . ]" 1
713 1 71 ARG QB 1 72 CYS H 3.500 . 4.500 3.474 2.974 3.618 . 0 0 "[ . 1 . ]" 1
714 1 72 CYS H 1 73 GLN HA 5.000 . 5.000 4.465 4.291 4.765 . 0 0 "[ . 1 . ]" 1
715 1 72 CYS H 1 73 GLN QG 6.000 . 7.000 4.722 4.007 5.143 . 0 0 "[ . 1 . ]" 1
716 1 72 CYS HA 1 73 GLN H 5.000 . 5.000 2.980 2.787 3.534 . 0 0 "[ . 1 . ]" 1
717 1 72 CYS QB 1 73 GLN H 5.000 . 6.000 3.899 3.149 4.027 . 0 0 "[ . 1 . ]" 1
718 1 73 GLN H 1 73 GLN QB 3.500 . 4.500 3.349 3.146 3.416 . 0 0 "[ . 1 . ]" 1
719 1 73 GLN HA 1 73 GLN QG 3.500 . 4.500 2.557 2.224 3.325 . 0 0 "[ . 1 . ]" 1
720 1 75 GLU HA 1 76 LYS H 3.500 . 3.500 2.990 2.145 3.549 0.049 16 0 "[ . 1 . ]" 1
721 1 75 GLU QB 1 76 LYS H 5.000 . 6.000 3.129 1.972 4.020 . 0 0 "[ . 1 . ]" 1
722 1 75 GLU QB 1 76 LYS QG 3.500 . 5.500 3.768 2.956 4.397 . 0 0 "[ . 1 . ]" 1
723 1 75 GLU QG 1 76 LYS H 6.000 . 7.000 3.117 1.946 4.399 . 0 0 "[ . 1 . ]" 1
724 1 75 GLU QG 1 76 LYS QG 3.500 . 5.500 3.477 2.155 4.325 . 0 0 "[ . 1 . ]" 1
725 1 76 LYS H 1 76 LYS QB 3.500 . 4.500 2.809 2.201 3.392 . 0 0 "[ . 1 . ]" 1
726 1 76 LYS H 1 77 ALA H 5.000 . 5.000 3.429 1.991 4.544 . 0 0 "[ . 1 . ]" 1
727 1 76 LYS HA 1 76 LYS QD 3.500 . 4.500 3.260 1.974 3.961 . 0 0 "[ . 1 . ]" 1
728 1 76 LYS HA 1 76 LYS QE 5.000 . 6.000 3.906 2.014 5.084 . 0 0 "[ . 1 . ]" 1
729 1 76 LYS HA 1 76 LYS QG 3.500 . 4.500 2.356 2.028 2.845 . 0 0 "[ . 1 . ]" 1
730 1 76 LYS QB 1 76 LYS QE 3.500 . 5.500 3.240 2.391 3.646 . 0 0 "[ . 1 . ]" 1
731 1 76 LYS QB 1 77 ALA H 5.000 . 6.000 3.054 1.949 3.842 . 0 0 "[ . 1 . ]" 1
732 1 76 LYS QE 1 76 LYS QG 2.800 . 4.800 2.125 1.980 2.314 . 0 0 "[ . 1 . ]" 1
733 1 77 ALA H 1 78 ASN H 6.000 . 6.000 3.549 2.060 4.612 . 0 0 "[ . 1 . ]" 1
734 1 77 ALA MB 1 78 ASN H 6.000 . 6.500 2.546 1.943 3.649 . 0 0 "[ . 1 . ]" 1
735 1 78 ASN HA 1 81 GLN QB 5.000 . 6.000 4.635 2.331 5.198 . 0 0 "[ . 1 . ]" 1
736 1 78 ASN HA 1 81 GLN QG 5.000 . 6.000 4.386 3.689 5.326 . 0 0 "[ . 1 . ]" 1
737 1 78 ASN QB 1 79 ALA H 6.000 . 7.000 3.364 2.333 3.925 . 0 0 "[ . 1 . ]" 1
738 1 78 ASN QB 1 81 GLN QB 3.500 . 5.500 3.264 1.943 4.155 . 0 0 "[ . 1 . ]" 1
739 1 79 ALA MB 1 80 GLN H 6.000 . 6.500 2.682 1.978 3.605 . 0 0 "[ . 1 . ]" 1
740 1 80 GLN H 1 80 GLN QB 3.500 . 4.500 2.710 2.043 3.325 . 0 0 "[ . 1 . ]" 1
741 1 80 GLN HA 1 80 GLN QG 3.500 . 4.500 2.369 2.015 3.340 . 0 0 "[ . 1 . ]" 1
742 1 80 GLN HA 1 81 GLN H 3.500 . 3.500 2.359 2.141 3.551 0.051 1 0 "[ . 1 . ]" 1
743 1 81 GLN H 1 81 GLN QB 3.500 . 4.500 2.681 2.083 3.324 . 0 0 "[ . 1 . ]" 1
744 1 81 GLN HA 1 81 GLN QG 3.500 . 4.500 2.401 2.025 3.401 . 0 0 "[ . 1 . ]" 1
745 1 81 GLN HA 1 82 HIS HA 6.000 . 6.000 4.459 4.309 4.722 . 0 0 "[ . 1 . ]" 1
746 1 82 HIS HA 1 85 ASP QB 5.000 . 6.000 3.223 2.269 4.456 . 0 0 "[ . 1 . ]" 1
747 1 84 LEU H 1 84 LEU QB 3.500 . 4.500 2.217 2.161 2.259 . 0 0 "[ . 1 . ]" 1
748 1 84 LEU H 1 85 ASP H 5.000 . 5.000 2.479 2.354 2.580 . 0 0 "[ . 1 . ]" 1
749 1 84 LEU HA 1 85 ASP H 3.500 . 3.500 3.491 3.474 3.526 0.026 1 0 "[ . 1 . ]" 1
750 1 84 LEU HA 1 87 ILE HB 5.000 . 5.000 4.915 4.727 5.010 0.010 9 0 "[ . 1 . ]" 1
751 1 84 LEU HA 1 123 THR MG 5.000 . 5.500 2.999 1.938 4.159 . 0 0 "[ . 1 . ]" 1
752 1 84 LEU QB 1 85 ASP H 5.000 . 6.000 2.780 2.573 2.874 . 0 0 "[ . 1 . ]" 1
753 1 84 LEU QD 1 85 ASP H 6.000 . 8.000 3.530 3.228 3.734 . 0 0 "[ . 1 . ]" 1
754 1 84 LEU QD 1 87 ILE H 6.000 . 8.000 4.709 4.403 5.087 . 0 0 "[ . 1 . ]" 1
755 1 84 LEU QD 1 88 THR H 6.000 . 8.000 3.628 3.390 3.898 . 0 0 "[ . 1 . ]" 1
756 1 84 LEU QD 1 89 HIS H 6.000 . 8.000 5.378 5.255 5.632 . 0 0 "[ . 1 . ]" 1
757 1 85 ASP H 1 86 LYS H 5.000 . 5.000 2.525 2.444 2.606 . 0 0 "[ . 1 . ]" 1
758 1 85 ASP H 1 87 ILE H 6.000 . 6.000 4.467 4.361 4.561 . 0 0 "[ . 1 . ]" 1
759 1 85 ASP HA 1 86 LYS H 5.000 . 5.000 3.500 3.497 3.507 . 0 0 "[ . 1 . ]" 1
760 1 85 ASP HA 1 88 THR HB 3.500 . 3.500 2.821 2.636 3.519 0.019 4 0 "[ . 1 . ]" 1
761 1 85 ASP QB 1 86 LYS H 5.000 . 6.000 2.798 2.710 2.871 . 0 0 "[ . 1 . ]" 1
762 1 86 LYS H 1 86 LYS QB 3.500 . 4.500 2.166 2.060 2.295 . 0 0 "[ . 1 . ]" 1
763 1 86 LYS H 1 87 ILE H 5.000 . 5.000 2.728 2.673 2.770 . 0 0 "[ . 1 . ]" 1
764 1 86 LYS HA 1 86 LYS QE 5.000 . 6.000 4.060 1.981 4.713 . 0 0 "[ . 1 . ]" 1
765 1 86 LYS HA 1 86 LYS QG 3.500 . 4.500 2.261 2.051 2.662 . 0 0 "[ . 1 . ]" 1
766 1 86 LYS HA 1 89 HIS H 3.500 . 3.500 3.511 3.503 3.539 0.039 4 0 "[ . 1 . ]" 1
767 1 86 LYS HA 1 89 HIS QB 5.000 . 6.000 2.980 2.834 3.123 . 0 0 "[ . 1 . ]" 1
768 1 86 LYS HA 1 109 VAL QG 6.000 . 8.000 4.512 3.749 5.293 . 0 0 "[ . 1 . ]" 1
769 1 86 LYS QB 1 89 HIS H 6.000 . 7.000 4.813 4.762 4.937 . 0 0 "[ . 1 . ]" 1
770 1 86 LYS QB 1 109 VAL QG 5.000 . 8.000 3.282 2.564 4.225 . 0 0 "[ . 1 . ]" 1
771 1 87 ILE H 1 88 THR H 3.500 . 3.500 2.729 2.696 2.761 . 0 0 "[ . 1 . ]" 1
772 1 87 ILE HA 1 87 ILE MG 3.500 . 4.000 2.322 2.208 2.394 . 0 0 "[ . 1 . ]" 1
773 1 87 ILE HA 1 88 THR H 5.000 . 5.000 3.519 3.499 3.544 . 0 0 "[ . 1 . ]" 1
774 1 87 ILE HB 1 87 ILE MD 3.500 . 4.000 2.149 2.095 2.234 . 0 0 "[ . 1 . ]" 1
775 1 87 ILE HB 1 88 THR H 5.000 . 5.000 3.774 3.705 3.841 . 0 0 "[ . 1 . ]" 1
776 1 87 ILE MD 1 88 THR H 6.000 . 6.500 2.262 2.157 2.551 . 0 0 "[ . 1 . ]" 1
777 1 87 ILE MD 1 90 ALA H 6.000 . 6.500 4.773 4.725 4.872 . 0 0 "[ . 1 . ]" 1
778 1 87 ILE MD 1 90 ALA MB 6.000 . 7.000 4.556 4.501 4.619 . 0 0 "[ . 1 . ]" 1
779 1 87 ILE MD 1 91 CYS H 6.000 . 6.500 4.261 4.201 4.356 . 0 0 "[ . 1 . ]" 1
780 1 87 ILE MD 1 119 LEU QD 6.000 . 8.500 4.713 3.784 5.002 . 0 0 "[ . 1 . ]" 1
781 1 87 ILE MD 1 120 PHE HA 5.000 . 5.500 4.009 3.071 4.222 . 0 0 "[ . 1 . ]" 1
782 1 87 ILE MD 1 120 PHE QD 6.000 . 8.700 4.010 2.472 4.669 . 0 0 "[ . 1 . ]" 1
783 1 87 ILE MD 1 120 PHE QE 6.000 . 8.700 3.907 3.014 4.784 . 0 0 "[ . 1 . ]" 1
784 1 87 ILE MD 1 123 THR HB 5.000 . 5.500 2.793 1.981 3.353 . 0 0 "[ . 1 . ]" 1
785 1 87 ILE MD 1 123 THR MG 6.000 . 7.000 2.028 1.731 2.552 0.069 3 0 "[ . 1 . ]" 1
786 1 87 ILE MD 1 124 THR HA 6.000 . 6.500 4.941 4.040 5.320 . 0 0 "[ . 1 . ]" 1
787 1 87 ILE MD 1 124 THR MG 6.000 . 7.000 3.504 2.660 4.475 . 0 0 "[ . 1 . ]" 1
788 1 87 ILE QG 1 87 ILE MG 2.800 . 4.300 2.040 1.942 2.112 . 0 0 "[ . 1 . ]" 1
789 1 87 ILE MG 1 88 THR H 6.000 . 6.500 3.938 3.905 3.990 . 0 0 "[ . 1 . ]" 1
790 1 87 ILE MG 1 89 HIS H 6.000 . 6.500 5.398 5.376 5.415 . 0 0 "[ . 1 . ]" 1
791 1 87 ILE MG 1 91 CYS H 6.000 . 6.500 5.408 5.367 5.426 . 0 0 "[ . 1 . ]" 1
792 1 87 ILE MG 1 111 MET ME 6.000 . 7.500 4.853 4.488 5.175 . 0 0 "[ . 1 . ]" 1
793 1 87 ILE MG 1 116 LEU HA 5.000 . 5.500 4.046 2.880 4.509 . 0 0 "[ . 1 . ]" 1
794 1 87 ILE MG 1 116 LEU QD 6.000 . 8.500 3.663 2.974 4.404 . 0 0 "[ . 1 . ]" 1
795 1 87 ILE MG 1 119 LEU QB 2.800 . 4.300 2.184 1.768 2.809 0.032 14 0 "[ . 1 . ]" 1
796 1 87 ILE MG 1 119 LEU QD 6.000 . 8.500 1.974 1.779 2.420 0.021 8 0 "[ . 1 . ]" 1
797 1 87 ILE MG 1 119 LEU HG 3.500 . 4.000 2.684 1.939 3.411 . 0 0 "[ . 1 . ]" 1
798 1 87 ILE MG 1 120 PHE H 6.000 . 6.500 3.120 2.400 3.382 . 0 0 "[ . 1 . ]" 1
799 1 87 ILE MG 1 120 PHE HA 5.000 . 5.500 2.337 1.978 3.021 . 0 0 "[ . 1 . ]" 1
800 1 87 ILE MG 1 120 PHE QB 3.500 . 5.000 3.249 2.642 3.586 . 0 0 "[ . 1 . ]" 1
801 1 87 ILE MG 1 120 PHE QD 6.000 . 8.700 2.886 1.970 3.701 . 0 0 "[ . 1 . ]" 1
802 1 87 ILE MG 1 121 LYS H 6.000 . 6.500 4.767 4.590 4.970 . 0 0 "[ . 1 . ]" 1
803 1 87 ILE MG 1 123 THR HB 5.000 . 5.500 3.382 2.965 4.473 . 0 0 "[ . 1 . ]" 1
804 1 87 ILE MG 1 123 THR MG 6.000 . 7.000 3.541 1.918 4.731 . 0 0 "[ . 1 . ]" 1
805 1 88 THR H 1 89 HIS H 3.500 . 3.500 2.643 2.624 2.652 . 0 0 "[ . 1 . ]" 1
806 1 88 THR HA 1 88 THR MG 3.500 . 4.000 2.475 2.357 3.209 . 0 0 "[ . 1 . ]" 1
807 1 88 THR HA 1 89 HIS H 5.000 . 5.000 3.526 3.521 3.529 . 0 0 "[ . 1 . ]" 1
808 1 88 THR MG 1 89 HIS H 6.000 . 6.500 3.459 2.176 3.624 . 0 0 "[ . 1 . ]" 1
809 1 89 HIS H 1 89 HIS QB 3.500 . 4.500 2.161 2.062 2.265 . 0 0 "[ . 1 . ]" 1
810 1 89 HIS H 1 90 ALA H 5.000 . 5.000 2.509 2.486 2.521 . 0 0 "[ . 1 . ]" 1
811 1 89 HIS H 1 90 ALA MB 6.000 . 6.500 4.152 4.112 4.210 . 0 0 "[ . 1 . ]" 1
812 1 89 HIS HA 1 89 HIS HD2 5.000 . 5.000 3.869 2.317 4.694 . 0 0 "[ . 1 . ]" 1
813 1 89 HIS HA 1 90 ALA H 5.000 . 5.000 3.493 3.479 3.509 . 0 0 "[ . 1 . ]" 1
814 1 89 HIS QB 1 90 ALA H 5.000 . 6.000 2.800 2.701 2.903 . 0 0 "[ . 1 . ]" 1
815 1 89 HIS QB 1 109 VAL QG 6.000 . 9.000 4.696 3.833 5.410 . 0 0 "[ . 1 . ]" 1
816 1 89 HIS HD2 1 93 LEU QD 6.000 . 8.000 4.171 2.551 5.517 . 0 0 "[ . 1 . ]" 1
817 1 90 ALA H 1 109 VAL QG 6.000 . 8.000 5.064 4.256 5.828 . 0 0 "[ . 1 . ]" 1
818 1 90 ALA HA 1 93 LEU QB 5.000 . 6.000 2.330 2.055 2.483 . 0 0 "[ . 1 . ]" 1
819 1 90 ALA HA 1 93 LEU QD 6.000 . 8.000 3.232 2.117 4.096 . 0 0 "[ . 1 . ]" 1
820 1 90 ALA HA 1 94 LEU H 6.000 . 6.000 4.203 3.845 4.617 . 0 0 "[ . 1 . ]" 1
821 1 90 ALA HA 1 108 GLN QE 6.000 . 7.000 4.908 2.086 6.228 . 0 0 "[ . 1 . ]" 1
822 1 90 ALA MB 1 93 LEU QB 3.500 . 5.000 3.699 3.579 3.775 . 0 0 "[ . 1 . ]" 1
823 1 90 ALA MB 1 93 LEU QD 6.000 . 8.500 4.085 3.289 4.817 . 0 0 "[ . 1 . ]" 1
824 1 90 ALA MB 1 109 VAL QG 6.000 . 8.500 3.365 2.713 4.071 . 0 0 "[ . 1 . ]" 1
825 1 90 ALA MB 1 120 PHE QD 6.000 . 8.700 3.549 2.559 4.740 . 0 0 "[ . 1 . ]" 1
826 1 90 ALA MB 1 120 PHE QE 6.000 . 8.700 3.164 1.853 5.001 . 0 0 "[ . 1 . ]" 1
827 1 91 CYS H 1 92 ARG H 5.000 . 5.000 2.774 2.644 2.883 . 0 0 "[ . 1 . ]" 1
828 1 91 CYS QB 1 92 ARG H 6.000 . 7.000 2.596 2.309 3.464 . 0 0 "[ . 1 . ]" 1
829 1 92 ARG H 1 93 LEU H 5.000 . 5.000 2.475 2.439 2.591 . 0 0 "[ . 1 . ]" 1
830 1 92 ARG H 1 95 GLU H 6.000 . 6.000 5.496 4.683 6.012 0.012 1 0 "[ . 1 . ]" 1
831 1 92 ARG QB 1 94 LEU H 5.000 . 6.000 4.818 4.485 5.345 . 0 0 "[ . 1 . ]" 1
832 1 92 ARG QB 1 95 GLU H 6.000 . 7.000 5.152 4.862 5.428 . 0 0 "[ . 1 . ]" 1
833 1 93 LEU H 1 94 LEU H 5.000 . 5.000 2.626 2.534 2.773 . 0 0 "[ . 1 . ]" 1
834 1 93 LEU HA 1 94 LEU H 5.000 . 5.000 3.513 3.417 3.556 . 0 0 "[ . 1 . ]" 1
835 1 93 LEU HA 1 95 GLU H 5.000 . 5.000 4.126 3.490 5.001 0.001 4 0 "[ . 1 . ]" 1
836 1 93 LEU QD 1 94 LEU H 6.000 . 8.000 3.899 3.317 4.390 . 0 0 "[ . 1 . ]" 1
837 1 93 LEU QD 1 105 LEU QD 6.000 . 10.000 2.659 1.725 4.009 0.075 7 0 "[ . 1 . ]" 1
838 1 93 LEU QD 1 108 GLN QB 5.000 . 8.000 3.305 2.200 4.378 . 0 0 "[ . 1 . ]" 1
839 1 93 LEU QD 1 108 GLN QE 6.000 . 9.000 2.312 1.719 3.668 0.081 3 0 "[ . 1 . ]" 1
840 1 93 LEU QD 1 108 GLN QG 6.000 . 9.000 3.300 1.855 4.595 . 0 0 "[ . 1 . ]" 1
841 1 94 LEU H 1 95 GLU H 5.000 . 5.000 2.864 2.507 3.140 . 0 0 "[ . 1 . ]" 1
842 1 94 LEU HA 1 100 VAL QG 6.000 . 8.000 2.803 1.886 3.946 . 0 0 "[ . 1 . ]" 1
843 1 94 LEU QD 1 95 GLU H 6.000 . 8.000 4.025 3.379 4.604 . 0 0 "[ . 1 . ]" 1
844 1 94 LEU QD 1 100 VAL HB 2.800 . 4.800 2.872 2.102 3.536 . 0 0 "[ . 1 . ]" 1
845 1 94 LEU QD 1 120 PHE QE 6.000 . 10.200 4.450 2.530 5.758 . 0 0 "[ . 1 . ]" 1
846 1 94 LEU QD 1 128 PRO HA 6.000 . 8.000 4.182 2.946 5.907 . 0 0 "[ . 1 . ]" 1
847 1 94 LEU QD 1 131 TRP HD1 6.000 . 8.000 5.220 4.594 5.878 . 0 0 "[ . 1 . ]" 1
848 1 94 LEU QD 1 132 GLN QE 6.000 . 9.000 3.511 1.949 5.472 . 0 0 "[ . 1 . ]" 1
849 1 95 GLU H 1 100 VAL QG 6.000 . 8.000 4.795 3.409 5.665 . 0 0 "[ . 1 . ]" 1
850 1 96 GLN HA 1 96 GLN QG 3.500 . 4.500 2.498 2.097 3.336 . 0 0 "[ . 1 . ]" 1
851 1 96 GLN QB 1 97 GLU H 5.000 . 6.000 2.733 1.981 4.041 . 0 0 "[ . 1 . ]" 1
852 1 96 GLN QB 1 98 THR H 5.000 . 6.000 2.956 2.425 5.340 . 0 0 "[ . 1 . ]" 1
853 1 96 GLN QE 1 100 VAL H 6.000 . 7.000 5.729 4.819 6.256 . 0 0 "[ . 1 . ]" 1
854 1 96 GLN QE 1 100 VAL QG 6.000 . 9.000 2.869 2.065 3.949 . 0 0 "[ . 1 . ]" 1
855 1 97 GLU H 1 97 GLU QB 3.500 . 4.500 2.479 2.117 3.166 . 0 0 "[ . 1 . ]" 1
856 1 97 GLU H 1 98 THR H 5.000 . 5.000 2.462 1.977 3.996 . 0 0 "[ . 1 . ]" 1
857 1 97 GLU HA 1 97 GLU QG 3.500 . 4.500 2.240 2.036 2.435 . 0 0 "[ . 1 . ]" 1
858 1 97 GLU HA 1 98 THR H 3.500 . 3.500 3.404 2.888 3.536 0.036 15 0 "[ . 1 . ]" 1
859 1 97 GLU HA 1 135 TRP HZ3 6.000 . 6.000 4.559 2.426 5.805 . 0 0 "[ . 1 . ]" 1
860 1 97 GLU QB 1 98 THR H 3.500 . 4.500 2.920 2.057 3.805 . 0 0 "[ . 1 . ]" 1
861 1 97 GLU QG 1 98 THR H 5.000 . 6.000 4.404 4.008 4.799 . 0 0 "[ . 1 . ]" 1
862 1 97 GLU QG 1 135 TRP HH2 5.000 . 6.000 4.417 2.996 5.372 . 0 0 "[ . 1 . ]" 1
863 1 97 GLU QG 1 135 TRP HZ3 5.000 . 6.000 3.992 2.038 5.396 . 0 0 "[ . 1 . ]" 1
864 1 98 THR H 1 99 PRO QD 6.000 . 7.000 4.377 4.322 4.393 . 0 0 "[ . 1 . ]" 1
865 1 98 THR HA 1 98 THR MG 3.500 . 4.000 2.217 2.017 2.454 . 0 0 "[ . 1 . ]" 1
866 1 98 THR HA 1 99 PRO QD 3.500 . 4.500 2.041 1.929 2.281 . 0 0 "[ . 1 . ]" 1
867 1 98 THR HA 1 99 PRO QG 5.000 . 6.000 3.946 3.836 4.191 . 0 0 "[ . 1 . ]" 1
868 1 98 THR HB 1 99 PRO QD 3.500 . 4.500 3.296 2.028 3.799 . 0 0 "[ . 1 . ]" 1
869 1 98 THR MG 1 99 PRO QD 2.800 . 4.300 1.881 1.821 2.006 . 0 0 "[ . 1 . ]" 1
870 1 98 THR MG 1 99 PRO QG 3.500 . 5.000 3.333 2.961 3.603 . 0 0 "[ . 1 . ]" 1
871 1 99 PRO QB 1 99 PRO QD 2.800 . 4.800 2.759 2.752 2.762 . 0 0 "[ . 1 . ]" 1
872 1 99 PRO QB 1 100 VAL H 5.000 . 6.000 3.415 2.812 3.699 . 0 0 "[ . 1 . ]" 1
873 1 100 VAL HA 1 101 THR H 2.800 . 2.800 2.277 2.141 2.386 . 0 0 "[ . 1 . ]" 1
874 1 100 VAL HB 1 101 THR H 6.000 . 6.000 3.613 2.418 4.232 . 0 0 "[ . 1 . ]" 1
875 1 100 VAL QG 1 101 THR H 5.000 . 7.000 2.287 1.908 3.373 . 0 0 "[ . 1 . ]" 1
876 1 100 VAL QG 1 104 ALA MB 6.000 . 8.500 2.687 1.888 3.654 . 0 0 "[ . 1 . ]" 1
877 1 100 VAL QG 1 132 GLN QE 6.000 . 9.000 4.597 2.929 5.739 . 0 0 "[ . 1 . ]" 1
878 1 101 THR H 1 102 LEU H 6.000 . 6.000 4.586 4.528 4.628 . 0 0 "[ . 1 . ]" 1
879 1 101 THR H 1 104 ALA H 6.000 . 6.000 4.564 3.997 5.037 . 0 0 "[ . 1 . ]" 1
880 1 101 THR HA 1 101 THR MG 3.500 . 4.000 2.382 2.067 3.220 . 0 0 "[ . 1 . ]" 1
881 1 101 THR HA 1 102 LEU H 3.500 . 3.500 2.285 2.146 2.507 . 0 0 "[ . 1 . ]" 1
882 1 101 THR HA 1 103 GLU H 5.000 . 5.000 4.386 4.002 4.777 . 0 0 "[ . 1 . ]" 1
883 1 101 THR MG 1 102 LEU H 6.000 . 6.500 3.199 1.950 3.955 . 0 0 "[ . 1 . ]" 1
884 1 102 LEU H 1 103 GLU H 5.000 . 5.000 2.658 2.540 2.742 . 0 0 "[ . 1 . ]" 1
885 1 102 LEU H 1 104 ALA H 6.000 . 6.000 3.910 3.771 4.054 . 0 0 "[ . 1 . ]" 1
886 1 102 LEU H 1 105 LEU H 6.000 . 6.000 5.308 5.160 5.482 . 0 0 "[ . 1 . ]" 1
887 1 102 LEU HA 1 103 GLU H 5.000 . 5.000 3.555 3.529 3.567 . 0 0 "[ . 1 . ]" 1
888 1 102 LEU HA 1 105 LEU H 5.000 . 5.000 3.706 3.622 3.811 . 0 0 "[ . 1 . ]" 1
889 1 102 LEU HA 1 105 LEU QB 5.000 . 6.000 3.561 3.459 3.900 . 0 0 "[ . 1 . ]" 1
890 1 102 LEU HA 1 105 LEU QD 6.000 . 8.000 3.710 2.367 4.983 . 0 0 "[ . 1 . ]" 1
891 1 102 LEU HA 1 116 LEU QD 6.000 . 8.000 4.499 3.317 5.885 . 0 0 "[ . 1 . ]" 1
892 1 102 LEU QB 1 103 GLU H 3.500 . 4.500 2.513 2.286 3.346 . 0 0 "[ . 1 . ]" 1
893 1 102 LEU QD 1 103 GLU H 6.000 . 8.000 3.723 2.894 4.095 . 0 0 "[ . 1 . ]" 1
894 1 102 LEU QD 1 105 LEU QD 6.000 . 10.000 4.122 2.796 5.047 . 0 0 "[ . 1 . ]" 1
895 1 102 LEU QD 1 106 ALA H 6.000 . 8.000 4.965 3.943 5.839 . 0 0 "[ . 1 . ]" 1
896 1 102 LEU QD 1 116 LEU QD 6.000 . 10.000 3.390 2.558 5.206 . 0 0 "[ . 1 . ]" 1
897 1 102 LEU QD 1 117 HIS HA 6.000 . 8.000 4.812 3.145 5.635 . 0 0 "[ . 1 . ]" 1
898 1 102 LEU QD 1 117 HIS QB 5.000 . 8.000 4.147 2.491 4.844 . 0 0 "[ . 1 . ]" 1
899 1 102 LEU QD 1 117 HIS HD2 6.000 . 8.000 4.228 2.564 5.851 . 0 0 "[ . 1 . ]" 1
900 1 103 GLU H 1 103 GLU QB 3.500 . 4.500 2.640 2.561 2.698 . 0 0 "[ . 1 . ]" 1
901 1 103 GLU H 1 104 ALA H 3.500 . 3.500 2.691 2.646 2.728 . 0 0 "[ . 1 . ]" 1
902 1 103 GLU H 1 104 ALA MB 6.000 . 6.500 4.331 4.266 4.389 . 0 0 "[ . 1 . ]" 1
903 1 103 GLU H 1 105 LEU H 6.000 . 6.000 4.562 4.490 4.618 . 0 0 "[ . 1 . ]" 1
904 1 103 GLU HA 1 104 ALA H 5.000 . 5.000 3.485 3.484 3.488 . 0 0 "[ . 1 . ]" 1
905 1 103 GLU HA 1 106 ALA MB 5.000 . 5.500 2.044 1.905 2.158 . 0 0 "[ . 1 . ]" 1
906 1 103 GLU QB 1 104 ALA H 5.000 . 6.000 3.543 3.518 3.577 . 0 0 "[ . 1 . ]" 1
907 1 103 GLU QB 1 106 ALA H 6.000 . 7.000 4.376 4.353 4.403 . 0 0 "[ . 1 . ]" 1
908 1 103 GLU QB 1 106 ALA MB 2.800 . 4.300 3.136 3.063 3.188 . 0 0 "[ . 1 . ]" 1
909 1 103 GLU QG 1 104 ALA H 6.000 . 7.000 2.303 2.153 2.451 . 0 0 "[ . 1 . ]" 1
910 1 104 ALA H 1 105 LEU H 3.500 . 3.500 2.787 2.754 2.809 . 0 0 "[ . 1 . ]" 1
911 1 104 ALA H 1 106 ALA H 6.000 . 6.000 3.812 3.793 3.854 . 0 0 "[ . 1 . ]" 1
912 1 104 ALA HA 1 107 ASP H 3.500 . 3.500 3.225 3.207 3.253 . 0 0 "[ . 1 . ]" 1
913 1 104 ALA HA 1 107 ASP QB 3.500 . 4.500 2.576 2.543 2.612 . 0 0 "[ . 1 . ]" 1
914 1 104 ALA MB 1 107 ASP QB 3.500 . 5.000 3.778 3.764 3.789 . 0 0 "[ . 1 . ]" 1
915 1 105 LEU H 1 105 LEU QB 2.800 . 3.800 2.158 2.044 2.545 . 0 0 "[ . 1 . ]" 1
916 1 105 LEU H 1 106 ALA H 3.500 . 3.500 2.505 2.476 2.527 . 0 0 "[ . 1 . ]" 1
917 1 105 LEU QB 1 106 ALA H 3.500 . 4.500 2.812 2.751 2.871 . 0 0 "[ . 1 . ]" 1
918 1 105 LEU QD 1 106 ALA H 6.000 . 8.000 3.996 3.741 4.216 . 0 0 "[ . 1 . ]" 1
919 1 105 LEU QD 1 116 LEU QD 6.000 . 10.000 2.127 1.702 3.029 0.098 14 0 "[ . 1 . ]" 1
920 1 105 LEU HG 1 116 LEU QD 2.800 . 4.800 3.053 2.401 3.585 . 0 0 "[ . 1 . ]" 1
921 1 106 ALA H 1 107 ASP H 3.500 . 3.500 2.466 2.447 2.487 . 0 0 "[ . 1 . ]" 1
922 1 106 ALA HA 1 107 ASP H 5.000 . 5.000 3.469 3.457 3.485 . 0 0 "[ . 1 . ]" 1
923 1 106 ALA HA 1 109 VAL H 5.000 . 5.000 3.421 3.323 3.560 . 0 0 "[ . 1 . ]" 1
924 1 106 ALA HA 1 109 VAL QG 5.000 . 7.000 2.263 1.840 3.258 . 0 0 "[ . 1 . ]" 1
925 1 106 ALA HA 1 111 MET H 5.000 . 5.000 3.444 2.984 4.906 . 0 0 "[ . 1 . ]" 1
926 1 106 ALA HA 1 116 LEU QD 5.000 . 7.000 2.699 1.959 4.176 . 0 0 "[ . 1 . ]" 1
927 1 106 ALA MB 1 107 ASP H 6.000 . 6.500 2.853 2.789 2.920 . 0 0 "[ . 1 . ]" 1
928 1 106 ALA MB 1 109 VAL H 6.000 . 6.500 4.622 4.497 4.715 . 0 0 "[ . 1 . ]" 1
929 1 106 ALA MB 1 112 SER HA 5.000 . 5.500 3.218 2.841 3.566 . 0 0 "[ . 1 . ]" 1
930 1 106 ALA MB 1 113 PRO HA 5.000 . 5.500 3.306 2.873 3.841 . 0 0 "[ . 1 . ]" 1
931 1 106 ALA MB 1 113 PRO QD 3.500 . 5.000 3.278 2.727 3.592 . 0 0 "[ . 1 . ]" 1
932 1 106 ALA MB 1 116 LEU QD 6.000 . 8.500 3.219 2.396 4.581 . 0 0 "[ . 1 . ]" 1
933 1 107 ASP H 1 107 ASP QB 3.500 . 4.500 2.221 2.201 2.238 . 0 0 "[ . 1 . ]" 1
934 1 107 ASP HA 1 108 GLN H 5.000 . 5.000 3.540 3.519 3.558 . 0 0 "[ . 1 . ]" 1
935 1 107 ASP QB 1 108 GLN H 5.000 . 6.000 2.520 2.386 2.670 . 0 0 "[ . 1 . ]" 1
936 1 108 GLN H 1 108 GLN QB 3.500 . 4.500 2.304 2.071 2.642 . 0 0 "[ . 1 . ]" 1
937 1 108 GLN H 1 108 GLN QG 3.500 . 4.500 3.113 1.962 4.017 . 0 0 "[ . 1 . ]" 1
938 1 108 GLN HA 1 108 GLN QG 3.500 . 4.500 2.517 2.034 3.339 . 0 0 "[ . 1 . ]" 1
939 1 108 GLN HA 1 109 VAL H 5.000 . 5.000 3.517 3.495 3.527 . 0 0 "[ . 1 . ]" 1
940 1 108 GLN QB 1 109 VAL H 5.000 . 6.000 2.893 2.631 3.515 . 0 0 "[ . 1 . ]" 1
941 1 108 GLN QG 1 109 VAL H 6.000 . 7.000 3.747 1.979 4.587 . 0 0 "[ . 1 . ]" 1
942 1 109 VAL H 1 110 ALA H 2.800 . 2.800 2.391 2.344 2.423 . 0 0 "[ . 1 . ]" 1
943 1 109 VAL H 1 111 MET H 5.000 . 5.000 4.115 3.926 5.010 0.010 15 0 "[ . 1 . ]" 1
944 1 109 VAL HA 1 110 ALA H 3.500 . 3.500 3.425 3.367 3.449 . 0 0 "[ . 1 . ]" 1
945 1 109 VAL HA 1 110 ALA MB 5.000 . 5.500 3.873 3.786 3.943 . 0 0 "[ . 1 . ]" 1
946 1 109 VAL HA 1 111 MET H 5.000 . 5.000 4.793 4.242 5.004 0.004 5 0 "[ . 1 . ]" 1
947 1 109 VAL HB 1 110 ALA H 6.000 . 6.000 3.749 3.081 4.160 . 0 0 "[ . 1 . ]" 1
948 1 109 VAL QG 1 110 ALA H 6.000 . 8.000 2.767 2.217 3.508 . 0 0 "[ . 1 . ]" 1
949 1 109 VAL QG 1 111 MET H 5.000 . 7.000 2.479 1.919 3.627 . 0 0 "[ . 1 . ]" 1
950 1 109 VAL QG 1 111 MET HA 6.000 . 8.000 4.158 3.792 4.695 . 0 0 "[ . 1 . ]" 1
951 1 109 VAL QG 1 111 MET QB 5.000 . 8.000 2.271 1.996 2.851 . 0 0 "[ . 1 . ]" 1
952 1 109 VAL QG 1 111 MET ME 6.000 . 9.000 2.073 1.704 3.079 0.096 14 0 "[ . 1 . ]" 1
953 1 109 VAL QG 1 111 MET QG 3.500 . 6.500 2.330 1.909 3.580 . 0 0 "[ . 1 . ]" 1
954 1 110 ALA H 1 110 ALA HA 2.800 . 2.800 2.275 2.273 2.285 . 0 0 "[ . 1 . ]" 1
955 1 110 ALA H 1 111 MET H 3.500 . 3.500 2.672 2.568 3.506 0.006 15 0 "[ . 1 . ]" 1
956 1 110 ALA HA 1 111 MET H 3.500 . 3.500 2.879 2.746 3.553 0.053 15 0 "[ . 1 . ]" 1
957 1 110 ALA HA 1 111 MET HA 6.000 . 6.000 4.416 4.360 4.780 . 0 0 "[ . 1 . ]" 1
958 1 110 ALA MB 1 111 MET H 6.000 . 6.500 3.587 2.311 3.701 . 0 0 "[ . 1 . ]" 1
959 1 110 ALA MB 1 111 MET HA 6.000 . 6.500 4.198 3.654 4.298 . 0 0 "[ . 1 . ]" 1
960 1 110 ALA MB 1 111 MET QG 3.500 . 5.000 3.253 2.791 3.480 . 0 0 "[ . 1 . ]" 1
961 1 111 MET H 1 112 SER H 6.000 . 6.000 4.415 4.353 4.637 . 0 0 "[ . 1 . ]" 1
962 1 111 MET HA 1 111 MET ME 5.000 . 6.000 4.486 4.352 4.663 . 0 0 "[ . 1 . ]" 1
963 1 111 MET HA 1 111 MET QG 3.500 . 4.500 2.484 2.360 2.575 . 0 0 "[ . 1 . ]" 1
964 1 111 MET HA 1 112 SER H 2.800 . 2.800 2.501 2.306 2.676 . 0 0 "[ . 1 . ]" 1
965 1 111 MET QB 1 111 MET ME 2.800 . 4.800 2.062 1.910 2.350 . 0 0 "[ . 1 . ]" 1
966 1 111 MET QB 1 112 SER H 5.000 . 6.000 2.248 1.955 2.626 . 0 0 "[ . 1 . ]" 1
967 1 111 MET QB 1 114 PHE H 5.000 . 6.000 5.394 5.354 5.418 . 0 0 "[ . 1 . ]" 1
968 1 111 MET QB 1 115 HIS QB 3.500 . 5.500 2.228 1.912 2.619 . 0 0 "[ . 1 . ]" 1
969 1 111 MET QB 1 116 LEU QD 5.000 . 8.000 3.958 2.494 4.651 . 0 0 "[ . 1 . ]" 1
970 1 111 MET ME 1 111 MET QG 2.800 . 4.800 2.409 2.270 2.520 . 0 0 "[ . 1 . ]" 1
971 1 111 MET ME 1 112 SER H 6.000 . 7.000 4.647 4.298 5.150 . 0 0 "[ . 1 . ]" 1
972 1 111 MET ME 1 115 HIS HA 5.000 . 6.000 4.235 3.866 4.677 . 0 0 "[ . 1 . ]" 1
973 1 111 MET ME 1 115 HIS QB 2.800 . 4.800 2.062 1.812 2.604 . 0 0 "[ . 1 . ]" 1
974 1 111 MET ME 1 115 HIS HD2 6.000 . 7.000 3.534 2.128 4.757 . 0 0 "[ . 1 . ]" 1
975 1 111 MET ME 1 116 LEU HA 3.500 . 4.500 3.581 3.395 3.775 . 0 0 "[ . 1 . ]" 1
976 1 111 MET ME 1 119 LEU QD 6.000 . 9.000 2.882 2.140 3.999 . 0 0 "[ . 1 . ]" 1
977 1 111 MET QG 1 112 SER H 5.000 . 6.000 3.978 3.711 4.139 . 0 0 "[ . 1 . ]" 1
978 1 111 MET QG 1 115 HIS QB 3.500 . 5.500 3.742 3.280 4.126 . 0 0 "[ . 1 . ]" 1
979 1 111 MET QG 1 116 LEU QD 6.000 . 9.000 4.965 3.637 5.800 . 0 0 "[ . 1 . ]" 1
980 1 112 SER H 1 112 SER QB 3.500 . 4.500 2.187 2.056 2.505 . 0 0 "[ . 1 . ]" 1
981 1 112 SER H 1 114 PHE QB 5.000 . 6.000 4.951 4.840 5.065 . 0 0 "[ . 1 . ]" 1
982 1 112 SER HA 1 113 PRO QD 3.500 . 4.500 2.137 1.974 2.283 . 0 0 "[ . 1 . ]" 1
983 1 112 SER QB 1 113 PRO QD 3.500 . 5.500 2.129 1.967 2.641 . 0 0 "[ . 1 . ]" 1
984 1 112 SER QB 1 115 HIS QB 3.500 . 5.500 3.716 3.421 3.976 . 0 0 "[ . 1 . ]" 1
985 1 113 PRO HA 1 113 PRO QG 3.500 . 4.500 3.193 2.893 3.498 . 0 0 "[ . 1 . ]" 1
986 1 113 PRO HA 1 114 PHE H 3.500 . 3.500 3.451 3.429 3.486 . 0 0 "[ . 1 . ]" 1
987 1 113 PRO HA 1 115 HIS H 5.000 . 5.000 4.326 4.193 4.512 . 0 0 "[ . 1 . ]" 1
988 1 113 PRO HA 1 117 HIS H 5.000 . 5.000 3.914 3.553 4.303 . 0 0 "[ . 1 . ]" 1
989 1 113 PRO QB 1 114 PHE H 3.500 . 4.500 3.255 2.943 3.504 . 0 0 "[ . 1 . ]" 1
990 1 114 PHE H 1 114 PHE QB 3.500 . 4.500 2.223 2.070 2.411 . 0 0 "[ . 1 . ]" 1
991 1 114 PHE H 1 115 HIS H 5.000 . 5.000 2.513 2.487 2.559 . 0 0 "[ . 1 . ]" 1
992 1 114 PHE HA 1 115 HIS H 3.500 . 3.500 3.519 3.505 3.537 0.037 4 0 "[ . 1 . ]" 1
993 1 114 PHE HA 1 117 HIS H 5.000 . 5.000 3.736 3.513 3.922 . 0 0 "[ . 1 . ]" 1
994 1 114 PHE QB 1 115 HIS H 5.000 . 6.000 2.673 2.565 2.801 . 0 0 "[ . 1 . ]" 1
995 1 115 HIS H 1 115 HIS QB 3.500 . 4.500 2.115 2.044 2.237 . 0 0 "[ . 1 . ]" 1
996 1 115 HIS H 1 116 LEU H 3.500 . 3.500 2.640 2.547 2.796 . 0 0 "[ . 1 . ]" 1
997 1 115 HIS H 1 117 HIS H 6.000 . 6.000 4.119 3.959 4.338 . 0 0 "[ . 1 . ]" 1
998 1 115 HIS HA 1 115 HIS HD2 5.000 . 5.000 3.340 2.180 4.240 . 0 0 "[ . 1 . ]" 1
999 1 115 HIS HA 1 118 ARG H 5.000 . 5.000 3.717 3.397 3.901 . 0 0 "[ . 1 . ]" 1
1000 1 115 HIS HA 1 118 ARG QB 3.500 . 4.500 2.997 2.570 3.887 . 0 0 "[ . 1 . ]" 1
1001 1 115 HIS QB 1 116 LEU H 3.500 . 4.500 2.573 2.328 2.800 . 0 0 "[ . 1 . ]" 1
1002 1 115 HIS HD2 1 119 LEU QD 6.000 . 8.000 4.038 2.218 5.879 . 0 0 "[ . 1 . ]" 1
1003 1 116 LEU H 1 116 LEU QB 3.500 . 4.500 2.154 2.054 2.306 . 0 0 "[ . 1 . ]" 1
1004 1 116 LEU H 1 117 HIS H 3.500 . 3.500 2.707 2.541 2.798 . 0 0 "[ . 1 . ]" 1
1005 1 116 LEU HA 1 117 HIS H 5.000 . 5.000 3.543 3.514 3.561 . 0 0 "[ . 1 . ]" 1
1006 1 116 LEU HA 1 119 LEU H 5.000 . 5.000 3.654 3.415 3.912 . 0 0 "[ . 1 . ]" 1
1007 1 116 LEU HA 1 120 PHE H 5.000 . 5.000 3.776 3.298 4.133 . 0 0 "[ . 1 . ]" 1
1008 1 116 LEU QB 1 117 HIS H 5.000 . 6.000 2.510 2.331 2.677 . 0 0 "[ . 1 . ]" 1
1009 1 116 LEU QD 1 117 HIS H 6.000 . 8.000 3.740 3.470 4.025 . 0 0 "[ . 1 . ]" 1
1010 1 116 LEU QD 1 120 PHE HA 6.000 . 8.000 4.995 4.177 5.687 . 0 0 "[ . 1 . ]" 1
1011 1 116 LEU QD 1 120 PHE QB 5.000 . 8.000 3.221 2.254 4.545 . 0 0 "[ . 1 . ]" 1
1012 1 116 LEU QD 1 120 PHE QD 6.000 . 10.200 3.358 2.021 4.314 . 0 0 "[ . 1 . ]" 1
1013 1 116 LEU QD 1 120 PHE QE 6.000 . 10.200 4.129 2.166 5.139 . 0 0 "[ . 1 . ]" 1
1014 1 117 HIS H 1 117 HIS QB 3.500 . 4.500 2.116 2.043 2.214 . 0 0 "[ . 1 . ]" 1
1015 1 117 HIS H 1 118 ARG H 5.000 . 5.000 2.749 2.488 2.845 . 0 0 "[ . 1 . ]" 1
1016 1 117 HIS HA 1 118 ARG H 5.000 . 5.000 3.551 3.520 3.569 . 0 0 "[ . 1 . ]" 1
1017 1 117 HIS HA 1 119 LEU H 5.000 . 5.000 4.573 4.331 4.796 . 0 0 "[ . 1 . ]" 1
1018 1 117 HIS QB 1 120 PHE H 6.000 . 7.000 5.043 4.828 5.294 . 0 0 "[ . 1 . ]" 1
1019 1 117 HIS HD2 1 127 THR MG 6.000 . 6.500 3.993 2.794 5.057 . 0 0 "[ . 1 . ]" 1
1020 1 117 HIS HE1 1 127 THR MG 6.000 . 6.500 3.569 2.099 5.287 . 0 0 "[ . 1 . ]" 1
1021 1 118 ARG H 1 118 ARG QB 3.500 . 4.500 2.197 2.037 2.531 . 0 0 "[ . 1 . ]" 1
1022 1 118 ARG H 1 118 ARG QD 3.500 . 4.500 3.692 3.131 4.093 . 0 0 "[ . 1 . ]" 1
1023 1 118 ARG H 1 118 ARG QG 3.500 . 4.500 3.154 1.981 4.045 . 0 0 "[ . 1 . ]" 1
1024 1 118 ARG H 1 119 LEU H 3.500 . 3.500 2.690 2.484 2.825 . 0 0 "[ . 1 . ]" 1
1025 1 118 ARG HA 1 119 LEU H 5.000 . 5.000 3.543 3.516 3.559 . 0 0 "[ . 1 . ]" 1
1026 1 118 ARG HA 1 121 LYS H 5.000 . 5.000 3.659 3.448 3.915 . 0 0 "[ . 1 . ]" 1
1027 1 118 ARG HA 1 121 LYS QB 3.500 . 4.500 2.890 2.528 4.034 . 0 0 "[ . 1 . ]" 1
1028 1 118 ARG QB 1 119 LEU H 3.500 . 4.500 2.641 2.442 3.468 . 0 0 "[ . 1 . ]" 1
1029 1 119 LEU H 1 119 LEU QB 3.500 . 4.500 2.126 2.032 2.638 . 0 0 "[ . 1 . ]" 1
1030 1 119 LEU H 1 119 LEU HG 5.000 . 5.000 4.293 2.052 4.544 . 0 0 "[ . 1 . ]" 1
1031 1 119 LEU H 1 120 PHE H 5.000 . 5.000 2.645 2.520 2.725 . 0 0 "[ . 1 . ]" 1
1032 1 119 LEU H 1 120 PHE QB 5.000 . 6.000 4.383 4.282 4.472 . 0 0 "[ . 1 . ]" 1
1033 1 119 LEU H 1 121 LYS H 5.000 . 5.000 4.100 3.965 4.299 . 0 0 "[ . 1 . ]" 1
1034 1 119 LEU HA 1 120 PHE H 6.000 . 6.000 3.541 3.512 3.561 . 0 0 "[ . 1 . ]" 1
1035 1 119 LEU HA 1 121 LYS H 6.000 . 6.000 4.494 4.108 4.821 . 0 0 "[ . 1 . ]" 1
1036 1 119 LEU HA 1 122 ALA H 5.000 . 5.000 3.523 3.243 3.789 . 0 0 "[ . 1 . ]" 1
1037 1 119 LEU HA 1 123 THR H 5.000 . 5.000 4.363 4.110 4.620 . 0 0 "[ . 1 . ]" 1
1038 1 119 LEU QB 1 120 PHE H 5.000 . 6.000 2.571 2.399 2.741 . 0 0 "[ . 1 . ]" 1
1039 1 119 LEU QD 1 120 PHE H 6.000 . 8.000 4.011 3.703 4.178 . 0 0 "[ . 1 . ]" 1
1040 1 119 LEU QD 1 122 ALA H 6.000 . 8.000 4.922 3.805 5.278 . 0 0 "[ . 1 . ]" 1
1041 1 119 LEU QD 1 123 THR H 6.000 . 8.000 5.099 3.594 5.508 . 0 0 "[ . 1 . ]" 1
1042 1 119 LEU HG 1 120 PHE H 6.000 . 6.000 4.605 3.856 4.958 . 0 0 "[ . 1 . ]" 1
1043 1 120 PHE H 1 121 LYS H 3.500 . 3.500 2.633 2.491 2.779 . 0 0 "[ . 1 . ]" 1
1044 1 120 PHE H 1 122 ALA H 6.000 . 6.000 3.976 3.794 4.208 . 0 0 "[ . 1 . ]" 1
1045 1 120 PHE HA 1 121 LYS H 5.000 . 5.000 3.532 3.493 3.560 . 0 0 "[ . 1 . ]" 1
1046 1 120 PHE HA 1 123 THR H 5.000 . 5.000 3.550 3.363 3.767 . 0 0 "[ . 1 . ]" 1
1047 1 120 PHE QB 1 121 LYS H 5.000 . 6.000 2.616 2.374 2.846 . 0 0 "[ . 1 . ]" 1
1048 1 120 PHE QD 1 121 LYS H 6.000 . 8.200 4.206 3.668 4.675 . 0 0 "[ . 1 . ]" 1
1049 1 120 PHE QE 1 128 PRO HA 6.000 . 8.200 4.580 2.550 6.035 . 0 0 "[ . 1 . ]" 1
1050 1 121 LYS H 1 121 LYS QB 3.500 . 4.500 2.159 2.050 2.515 . 0 0 "[ . 1 . ]" 1
1051 1 121 LYS H 1 122 ALA H 3.500 . 3.500 2.530 2.392 2.783 . 0 0 "[ . 1 . ]" 1
1052 1 121 LYS HA 1 121 LYS QE 5.000 . 6.000 4.037 2.780 4.655 . 0 0 "[ . 1 . ]" 1
1053 1 121 LYS QB 1 121 LYS QE 3.500 . 5.500 3.268 2.034 3.644 . 0 0 "[ . 1 . ]" 1
1054 1 121 LYS QB 1 122 ALA H 3.500 . 4.500 2.873 2.621 3.539 . 0 0 "[ . 1 . ]" 1
1055 1 121 LYS QE 1 121 LYS QG 2.800 . 4.800 2.100 1.943 2.251 . 0 0 "[ . 1 . ]" 1
1056 1 121 LYS QE 1 126 MET HA 5.000 . 6.000 4.066 3.233 5.023 . 0 0 "[ . 1 . ]" 1
1057 1 122 ALA H 1 123 THR H 3.500 . 3.500 2.524 2.462 2.729 . 0 0 "[ . 1 . ]" 1
1058 1 122 ALA HA 1 125 GLY H 5.000 . 5.000 4.934 4.313 5.010 0.010 9 0 "[ . 1 . ]" 1
1059 1 122 ALA MB 1 123 THR H 6.000 . 6.500 2.835 2.566 2.970 . 0 0 "[ . 1 . ]" 1
1060 1 123 THR H 1 124 THR H 3.500 . 3.500 2.515 2.155 2.692 . 0 0 "[ . 1 . ]" 1
1061 1 123 THR HA 1 123 THR MG 3.500 . 4.000 2.424 2.121 3.227 . 0 0 "[ . 1 . ]" 1
1062 1 123 THR HA 1 124 THR H 5.000 . 5.000 3.564 3.500 3.573 . 0 0 "[ . 1 . ]" 1
1063 1 123 THR HB 1 124 THR H 5.000 . 5.000 2.386 1.984 4.007 . 0 0 "[ . 1 . ]" 1
1064 1 123 THR HB 1 124 THR MG 5.000 . 5.500 3.893 2.710 4.583 . 0 0 "[ . 1 . ]" 1
1065 1 123 THR MG 1 124 THR H 6.000 . 6.500 3.092 1.916 3.679 . 0 0 "[ . 1 . ]" 1
1066 1 123 THR MG 1 124 THR HA 5.000 . 5.500 3.824 3.402 4.206 . 0 0 "[ . 1 . ]" 1
1067 1 123 THR MG 1 124 THR MG 6.000 . 7.000 3.564 1.801 4.703 . 0 0 "[ . 1 . ]" 1
1068 1 124 THR H 1 125 GLY H 3.500 . 3.500 2.515 2.107 2.896 . 0 0 "[ . 1 . ]" 1
1069 1 124 THR H 1 126 MET H 6.000 . 6.000 4.633 4.080 5.224 . 0 0 "[ . 1 . ]" 1
1070 1 124 THR HB 1 131 TRP HD1 6.000 . 6.000 5.017 3.986 6.002 0.002 9 0 "[ . 1 . ]" 1
1071 1 124 THR MG 1 125 GLY H 6.000 . 6.500 3.616 1.958 4.117 . 0 0 "[ . 1 . ]" 1
1072 1 125 GLY H 1 126 MET H 5.000 . 5.000 2.653 2.379 3.465 . 0 0 "[ . 1 . ]" 1
1073 1 125 GLY QA 1 126 MET H 5.000 . 6.000 2.753 2.581 2.822 . 0 0 "[ . 1 . ]" 1
1074 1 126 MET HA 1 126 MET ME 5.000 . 6.000 4.334 3.950 4.833 . 0 0 "[ . 1 . ]" 1
1075 1 126 MET HA 1 127 THR H 3.500 . 3.500 2.371 2.152 2.723 . 0 0 "[ . 1 . ]" 1
1076 1 126 MET HA 1 127 THR MG 5.000 . 5.500 4.108 3.714 4.446 . 0 0 "[ . 1 . ]" 1
1077 1 126 MET HA 1 130 ALA MB 5.000 . 5.500 3.701 3.188 4.326 . 0 0 "[ . 1 . ]" 1
1078 1 126 MET QB 1 127 THR H 5.000 . 6.000 2.628 1.986 3.237 . 0 0 "[ . 1 . ]" 1
1079 1 126 MET QB 1 130 ALA H 6.000 . 7.000 4.519 4.181 4.856 . 0 0 "[ . 1 . ]" 1
1080 1 126 MET QB 1 130 ALA MB 2.800 . 4.300 2.387 1.961 2.686 . 0 0 "[ . 1 . ]" 1
1081 1 126 MET ME 1 126 MET QG 2.800 . 4.800 2.239 2.030 2.569 . 0 0 "[ . 1 . ]" 1
1082 1 126 MET ME 1 127 THR H 6.000 . 7.000 4.430 3.921 5.266 . 0 0 "[ . 1 . ]" 1
1083 1 126 MET ME 1 130 ALA MB 6.000 . 7.500 2.218 1.777 2.698 0.023 16 0 "[ . 1 . ]" 1
1084 1 126 MET ME 1 131 TRP HA 3.500 . 4.500 2.957 2.186 3.539 . 0 0 "[ . 1 . ]" 1
1085 1 126 MET ME 1 131 TRP HD1 6.000 . 7.000 4.574 3.548 5.336 . 0 0 "[ . 1 . ]" 1
1086 1 126 MET ME 1 134 ALA HA 5.000 . 6.000 4.809 4.535 5.037 . 0 0 "[ . 1 . ]" 1
1087 1 126 MET ME 1 134 ALA MB 6.000 . 7.500 2.682 2.306 2.951 . 0 0 "[ . 1 . ]" 1
1088 1 126 MET QG 1 127 THR H 6.000 . 7.000 3.453 2.261 4.160 . 0 0 "[ . 1 . ]" 1
1089 1 126 MET QG 1 130 ALA H 6.000 . 7.000 5.354 4.395 6.256 . 0 0 "[ . 1 . ]" 1
1090 1 126 MET QG 1 130 ALA MB 3.500 . 5.000 2.770 1.920 3.624 . 0 0 "[ . 1 . ]" 1
1091 1 127 THR HA 1 127 THR MG 3.500 . 4.000 2.256 2.029 3.209 . 0 0 "[ . 1 . ]" 1
1092 1 127 THR HA 1 128 PRO QD 5.000 . 6.000 2.143 1.984 2.269 . 0 0 "[ . 1 . ]" 1
1093 1 127 THR HB 1 128 PRO QD 3.500 . 4.500 2.085 1.961 3.589 . 0 0 "[ . 1 . ]" 1
1094 1 127 THR MG 1 128 PRO QD 2.800 . 4.300 2.544 1.968 3.062 . 0 0 "[ . 1 . ]" 1
1095 1 128 PRO HA 1 129 LYS H 5.000 . 5.000 3.532 3.500 3.570 . 0 0 "[ . 1 . ]" 1
1096 1 128 PRO HA 1 130 ALA H 5.000 . 5.000 4.308 3.989 4.733 . 0 0 "[ . 1 . ]" 1
1097 1 128 PRO QD 1 129 LYS H 5.000 . 6.000 2.811 2.668 2.934 . 0 0 "[ . 1 . ]" 1
1098 1 129 LYS H 1 129 LYS QB 3.500 . 4.500 2.259 2.045 2.624 . 0 0 "[ . 1 . ]" 1
1099 1 129 LYS H 1 129 LYS QD 5.000 . 6.000 3.926 2.098 4.543 . 0 0 "[ . 1 . ]" 1
1100 1 129 LYS H 1 129 LYS QE 6.000 . 7.000 4.997 3.996 5.728 . 0 0 "[ . 1 . ]" 1
1101 1 129 LYS H 1 129 LYS QG 3.500 . 4.500 3.256 1.967 4.008 . 0 0 "[ . 1 . ]" 1
1102 1 129 LYS H 1 130 ALA H 3.500 . 3.500 2.566 2.441 2.711 . 0 0 "[ . 1 . ]" 1
1103 1 129 LYS HA 1 129 LYS QD 3.500 . 4.500 3.743 2.444 4.081 . 0 0 "[ . 1 . ]" 1
1104 1 129 LYS HA 1 129 LYS QE 6.000 . 7.000 4.556 3.145 5.448 . 0 0 "[ . 1 . ]" 1
1105 1 129 LYS QB 1 129 LYS QE 2.800 . 4.800 2.965 1.954 3.563 . 0 0 "[ . 1 . ]" 1
1106 1 129 LYS QB 1 130 ALA H 5.000 . 6.000 2.921 2.549 3.512 . 0 0 "[ . 1 . ]" 1
1107 1 129 LYS QE 1 129 LYS QG 2.800 . 4.800 2.100 1.979 2.364 . 0 0 "[ . 1 . ]" 1
1108 1 129 LYS QE 1 133 GLN QE 5.000 . 7.000 4.366 3.232 5.301 . 0 0 "[ . 1 . ]" 1
1109 1 129 LYS QG 1 130 ALA H 5.000 . 6.000 3.767 1.985 4.567 . 0 0 "[ . 1 . ]" 1
1110 1 130 ALA HA 1 133 GLN QB 3.500 . 4.500 2.810 2.294 3.968 . 0 0 "[ . 1 . ]" 1
1111 1 130 ALA HA 1 133 GLN QG 5.000 . 6.000 4.354 1.949 5.057 . 0 0 "[ . 1 . ]" 1
1112 1 130 ALA HA 1 134 ALA H 5.000 . 5.000 3.999 3.567 4.460 . 0 0 "[ . 1 . ]" 1
1113 1 131 TRP HA 1 134 ALA H 5.000 . 5.000 3.481 3.346 3.803 . 0 0 "[ . 1 . ]" 1
1114 1 131 TRP HA 1 134 ALA MB 3.500 . 4.000 2.559 2.172 3.052 . 0 0 "[ . 1 . ]" 1
1115 1 133 GLN HA 1 133 GLN QG 3.500 . 4.500 2.271 2.018 3.337 . 0 0 "[ . 1 . ]" 1
1116 1 133 GLN HA 1 136 ARG H 5.000 . 5.000 3.512 3.208 3.753 . 0 0 "[ . 1 . ]" 1
1117 1 133 GLN QB 1 134 ALA H 5.000 . 6.000 2.850 2.569 3.588 . 0 0 "[ . 1 . ]" 1
1118 1 133 GLN QG 1 134 ALA H 6.000 . 7.000 4.259 2.183 4.589 . 0 0 "[ . 1 . ]" 1
1119 1 134 ALA H 1 135 TRP H 5.000 . 5.000 2.639 2.506 2.764 . 0 0 "[ . 1 . ]" 1
1120 1 134 ALA MB 1 135 TRP H 6.000 . 6.500 2.594 2.384 2.720 . 0 0 "[ . 1 . ]" 1
1121 1 135 TRP H 1 136 ARG H 3.500 . 3.500 2.627 2.491 2.712 . 0 0 "[ . 1 . ]" 1
1122 1 135 TRP HA 1 136 ARG H 5.000 . 5.000 3.539 3.511 3.556 . 0 0 "[ . 1 . ]" 1
1123 1 135 TRP QB 1 136 ARG H 5.000 . 6.000 2.596 2.406 3.467 . 0 0 "[ . 1 . ]" 1
1124 1 135 TRP HE3 1 136 ARG HA 6.000 . 6.000 4.644 2.435 6.006 0.006 2 0 "[ . 1 . ]" 1
1125 1 136 ARG H 1 136 ARG QB 3.500 . 4.500 2.211 2.045 2.600 . 0 0 "[ . 1 . ]" 1
1126 1 136 ARG H 1 137 ALA H 3.500 . 3.500 2.605 2.464 2.757 . 0 0 "[ . 1 . ]" 1
1127 1 136 ARG H 1 139 ARG H 6.000 . 6.000 4.743 4.550 4.936 . 0 0 "[ . 1 . ]" 1
1128 1 136 ARG HA 1 136 ARG QG 3.500 . 4.500 2.346 2.040 3.345 . 0 0 "[ . 1 . ]" 1
1129 1 136 ARG HA 1 137 ALA H 5.000 . 5.000 3.523 3.488 3.565 . 0 0 "[ . 1 . ]" 1
1130 1 136 ARG HA 1 139 ARG H 5.000 . 5.000 3.476 3.310 3.638 . 0 0 "[ . 1 . ]" 1
1131 1 136 ARG HA 1 139 ARG QB 5.000 . 6.000 2.761 2.553 3.099 . 0 0 "[ . 1 . ]" 1
1132 1 136 ARG HA 1 140 LEU H 6.000 . 6.000 4.411 4.116 4.607 . 0 0 "[ . 1 . ]" 1
1133 1 136 ARG QB 1 139 ARG H 6.000 . 7.000 4.928 4.746 5.048 . 0 0 "[ . 1 . ]" 1
1134 1 137 ALA H 1 138 ARG H 3.500 . 3.500 2.559 2.458 2.693 . 0 0 "[ . 1 . ]" 1
1135 1 137 ALA HA 1 138 ARG H 3.500 . 3.500 3.509 3.496 3.545 0.045 4 0 "[ . 1 . ]" 1
1136 1 137 ALA MB 1 138 ARG H 5.000 . 5.500 2.712 2.320 2.813 . 0 0 "[ . 1 . ]" 1
1137 1 138 ARG H 1 138 ARG QB 3.500 . 4.500 2.171 2.096 2.256 . 0 0 "[ . 1 . ]" 1
1138 1 138 ARG H 1 138 ARG QD 5.000 . 6.000 4.198 3.280 4.737 . 0 0 "[ . 1 . ]" 1
1139 1 138 ARG HA 1 138 ARG QD 3.500 . 4.500 3.457 2.021 4.016 . 0 0 "[ . 1 . ]" 1
1140 1 138 ARG HA 1 138 ARG QG 3.500 . 4.500 2.220 2.055 2.685 . 0 0 "[ . 1 . ]" 1
1141 1 138 ARG HA 1 139 ARG H 3.500 . 3.500 3.498 3.484 3.511 0.011 12 0 "[ . 1 . ]" 1
1142 1 138 ARG HA 1 141 ARG H 3.500 . 3.500 3.399 3.281 3.504 0.004 2 0 "[ . 1 . ]" 1
1143 1 139 ARG H 1 139 ARG QB 3.500 . 4.500 2.144 2.057 2.271 . 0 0 "[ . 1 . ]" 1
1144 1 139 ARG HA 1 140 LEU H 3.500 . 3.500 3.493 3.474 3.506 0.006 8 0 "[ . 1 . ]" 1
1145 1 139 ARG HA 1 142 GLU H 5.000 . 5.000 3.787 3.528 4.253 . 0 0 "[ . 1 . ]" 1
1146 1 139 ARG HA 1 142 GLU QB 5.000 . 6.000 3.497 2.628 5.084 . 0 0 "[ . 1 . ]" 1
1147 1 139 ARG QB 1 140 LEU H 2.800 . 3.800 2.832 2.722 2.942 . 0 0 "[ . 1 . ]" 1
1148 1 140 LEU H 1 140 LEU QB 2.800 . 3.800 2.172 2.067 2.307 . 0 0 "[ . 1 . ]" 1
1149 1 140 LEU QB 1 143 SER H 6.000 . 7.000 5.155 4.708 5.551 . 0 0 "[ . 1 . ]" 1
1150 1 140 LEU QD 1 141 ARG H 6.000 . 8.000 3.995 3.623 4.219 . 0 0 "[ . 1 . ]" 1
1151 1 140 LEU QD 1 143 SER H 6.000 . 8.000 5.079 4.588 5.760 . 0 0 "[ . 1 . ]" 1
1152 1 141 ARG H 1 141 ARG QB 2.800 . 3.800 2.177 2.048 2.595 . 0 0 "[ . 1 . ]" 1
1153 1 141 ARG H 1 141 ARG QG 3.500 . 4.500 3.427 2.161 4.067 . 0 0 "[ . 1 . ]" 1
1154 1 141 ARG H 1 142 GLU H 3.500 . 3.500 2.560 2.430 2.796 . 0 0 "[ . 1 . ]" 1
1155 1 141 ARG HA 1 141 ARG QG 3.500 . 4.500 2.265 2.014 3.350 . 0 0 "[ . 1 . ]" 1
1156 1 141 ARG QB 1 141 ARG QD 2.800 . 4.800 2.120 1.925 2.415 . 0 0 "[ . 1 . ]" 1
1157 1 141 ARG QG 1 142 GLU H 5.000 . 6.000 4.170 1.991 4.534 . 0 0 "[ . 1 . ]" 1
1158 1 142 GLU H 1 142 GLU QB 3.500 . 4.500 2.290 2.089 2.616 . 0 0 "[ . 1 . ]" 1
1159 1 142 GLU H 1 142 GLU QG 3.500 . 4.500 3.259 2.040 4.078 . 0 0 "[ . 1 . ]" 1
1160 1 142 GLU H 1 143 SER H 3.500 . 3.500 2.611 1.924 3.178 . 0 0 "[ . 1 . ]" 1
1161 1 142 GLU HA 1 142 GLU QG 3.500 . 4.500 2.396 2.053 3.387 . 0 0 "[ . 1 . ]" 1
1162 1 142 GLU HA 1 143 SER H 3.500 . 3.500 3.254 2.736 3.548 0.048 13 0 "[ . 1 . ]" 1
1163 1 142 GLU QB 1 143 SER H 5.000 . 6.000 3.261 2.428 3.897 . 0 0 "[ . 1 . ]" 1
1164 1 142 GLU QG 1 143 SER H 6.000 . 7.000 4.161 2.034 4.646 . 0 0 "[ . 1 . ]" 1
1165 1 143 SER H 1 143 SER QB 3.500 . 4.500 2.625 2.157 3.442 . 0 0 "[ . 1 . ]" 1
1166 1 143 SER H 1 144 LEU H 5.000 . 5.000 3.753 2.381 4.601 . 0 0 "[ . 1 . ]" 1
1167 1 144 LEU H 1 144 LEU QB 2.800 . 3.800 2.662 2.136 3.185 . 0 0 "[ . 1 . ]" 1
1168 1 144 LEU QB 1 145 ALA H 5.000 . 6.000 3.522 2.219 4.012 . 0 0 "[ . 1 . ]" 1
1169 1 144 LEU QD 1 145 ALA H 6.000 . 8.000 3.774 2.757 4.548 . 0 0 "[ . 1 . ]" 1
1170 1 145 ALA HA 1 146 LYS H 3.500 . 3.500 2.222 2.140 2.369 . 0 0 "[ . 1 . ]" 1
1171 1 145 ALA MB 1 146 LYS H 6.000 . 6.500 2.946 2.566 3.504 . 0 0 "[ . 1 . ]" 1
stop_
save_
Contact the webmaster for help, if required. Thursday, July 4, 2024 4:24:29 PM GMT (wattos1)