NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
375263 |
1ezy   |
4386 | cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1ezy
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 1354
_Distance_constraint_stats_list.Viol_count 482
_Distance_constraint_stats_list.Viol_total 1010.608
_Distance_constraint_stats_list.Viol_max 0.943
_Distance_constraint_stats_list.Viol_rms 0.0122
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0008
_Distance_constraint_stats_list.Viol_average_violations_only 0.0699
_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 5 VAL 0.673 0.169 28 0 "[ . 1 . 2 . 3]"
1 6 SER 0.174 0.090 16 0 "[ . 1 . 2 . 3]"
1 7 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 8 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 9 GLU 0.174 0.090 16 0 "[ . 1 . 2 . 3]"
1 10 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 11 LYS 0.127 0.069 27 0 "[ . 1 . 2 . 3]"
1 12 LYS 0.127 0.069 27 0 "[ . 1 . 2 . 3]"
1 13 TRP 0.243 0.060 15 0 "[ . 1 . 2 . 3]"
1 14 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 15 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 16 SER 0.962 0.126 28 0 "[ . 1 . 2 . 3]"
1 17 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 18 GLU 7.344 0.280 14 0 "[ . 1 . 2 . 3]"
1 19 ASN 0.391 0.070 5 0 "[ . 1 . 2 . 3]"
1 20 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 21 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 22 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 23 HIS 0.180 0.112 13 0 "[ . 1 . 2 . 3]"
1 24 GLU 0.176 0.045 8 0 "[ . 1 . 2 . 3]"
1 25 CYS 0.239 0.112 13 0 "[ . 1 . 2 . 3]"
1 26 GLY 0.047 0.029 20 0 "[ . 1 . 2 . 3]"
1 27 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 28 ALA 0.176 0.045 8 0 "[ . 1 . 2 . 3]"
1 29 ALA 0.912 0.172 13 0 "[ . 1 . 2 . 3]"
1 30 PHE 1.348 0.350 8 0 "[ . 1 . 2 . 3]"
1 31 LYS 0.350 0.350 8 0 "[ . 1 . 2 . 3]"
1 32 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 33 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 34 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 35 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 36 SER 0.019 0.019 28 0 "[ . 1 . 2 . 3]"
1 37 GLU 0.019 0.019 28 0 "[ . 1 . 2 . 3]"
1 38 TYR 3.423 0.565 26 1 "[ . 1 . 2 .+ 3]"
1 39 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 40 GLU 1.389 0.176 29 0 "[ . 1 . 2 . 3]"
1 41 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 42 ASN 0.384 0.103 15 0 "[ . 1 . 2 . 3]"
1 43 ILE 1.686 0.176 29 0 "[ . 1 . 2 . 3]"
1 44 ASP 0.117 0.043 15 0 "[ . 1 . 2 . 3]"
1 45 PHE 0.356 0.070 30 0 "[ . 1 . 2 . 3]"
1 46 TRP 0.117 0.054 27 0 "[ . 1 . 2 . 3]"
1 47 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 48 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 49 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 50 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 51 GLU 0.101 0.036 2 0 "[ . 1 . 2 . 3]"
1 52 TYR 0.291 0.069 5 0 "[ . 1 . 2 . 3]"
1 53 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 54 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 55 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 56 LYS 1.130 0.136 2 0 "[ . 1 . 2 . 3]"
1 57 SER 2.044 0.136 2 0 "[ . 1 . 2 . 3]"
1 58 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 59 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 60 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 61 LEU 0.915 0.081 14 0 "[ . 1 . 2 . 3]"
1 62 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 63 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 64 LYS 0.187 0.069 5 0 "[ . 1 . 2 . 3]"
1 65 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 66 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 67 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 68 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 69 TYR 1.847 0.640 11 1 "[ . 1+ . 2 . 3]"
1 70 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 71 GLU 0.620 0.109 25 0 "[ . 1 . 2 . 3]"
1 72 PHE 0.400 0.093 8 0 "[ . 1 . 2 . 3]"
1 73 ILE 3.154 0.943 11 2 "[ . 1+ . - 2 . 3]"
1 74 SER 0.092 0.042 12 0 "[ . 1 . 2 . 3]"
1 75 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 76 GLN 0.617 0.072 25 0 "[ . 1 . 2 . 3]"
1 77 ALA 0.617 0.072 25 0 "[ . 1 . 2 . 3]"
1 78 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 79 LYS 0.011 0.011 7 0 "[ . 1 . 2 . 3]"
1 80 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 81 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 82 ASN 0.026 0.012 13 0 "[ . 1 . 2 . 3]"
1 83 LEU 0.355 0.105 3 0 "[ . 1 . 2 . 3]"
1 84 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 85 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 86 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 87 THR 0.321 0.105 3 0 "[ . 1 . 2 . 3]"
1 88 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 89 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 90 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 91 THR 0.049 0.049 10 0 "[ . 1 . 2 . 3]"
1 92 SER 0.065 0.065 15 0 "[ . 1 . 2 . 3]"
1 93 ARG 0.072 0.065 15 0 "[ . 1 . 2 . 3]"
1 94 ASN 0.007 0.007 6 0 "[ . 1 . 2 . 3]"
1 95 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 96 LEU 0.120 0.120 11 0 "[ . 1 . 2 . 3]"
1 97 GLU 0.120 0.120 11 0 "[ . 1 . 2 . 3]"
1 98 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 99 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 100 ILE 0.003 0.003 10 0 "[ . 1 . 2 . 3]"
1 101 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 102 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 103 PHE 2.496 0.943 11 2 "[ . 1+ . * 2 . 3]"
1 104 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 105 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 106 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 107 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 108 LYS 0.656 0.122 24 0 "[ . 1 . 2 . 3]"
1 109 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 110 ILE 0.356 0.070 30 0 "[ . 1 . 2 . 3]"
1 111 PHE 9.003 0.280 14 0 "[ . 1 . 2 . 3]"
1 112 ASN 0.007 0.007 2 0 "[ . 1 . 2 . 3]"
1 113 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 114 MET 0.005 0.005 19 0 "[ . 1 . 2 . 3]"
1 115 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 116 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 117 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 118 SER 0.820 0.170 10 0 "[ . 1 . 2 . 3]"
1 119 TYR 3.255 0.431 28 0 "[ . 1 . 2 . 3]"
1 120 ARG 3.255 0.431 28 0 "[ . 1 . 2 . 3]"
1 121 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 122 PHE 3.426 0.264 18 0 "[ . 1 . 2 . 3]"
1 123 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 124 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 125 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 126 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 127 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 128 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 129 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 130 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 131 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 132 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 133 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
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 5 VAL HA 1 5 VAL MG1 3.000 . 4.600 2.496 2.225 3.219 . 0 0 "[ . 1 . 2 . 3]" 1
2 1 5 VAL HA 1 5 VAL MG2 3.000 . 4.600 2.391 2.236 2.658 . 0 0 "[ . 1 . 2 . 3]" 1
3 1 5 VAL H 1 5 VAL QG 3.000 . 5.200 2.427 1.858 2.794 . 0 0 "[ . 1 . 2 . 3]" 1
4 1 5 VAL H 1 5 VAL HB 2.500 . 2.900 2.728 2.431 3.069 0.169 28 0 "[ . 1 . 2 . 3]" 1
5 1 5 VAL HB 1 6 SER H 4.000 . 5.000 4.132 3.934 4.319 . 0 0 "[ . 1 . 2 . 3]" 1
6 1 5 VAL QG 1 6 SER H 3.000 . 5.900 2.554 2.063 2.924 . 0 0 "[ . 1 . 2 . 3]" 1
7 1 5 VAL MG1 1 10 VAL MG1 3.000 . 6.300 2.001 1.861 2.329 . 0 0 "[ . 1 . 2 . 3]" 1
8 1 5 VAL MG2 1 10 VAL MG1 4.000 . 8.000 3.349 1.931 3.936 . 0 0 "[ . 1 . 2 . 3]" 1
9 1 5 VAL QG 1 25 CYS QB 3.000 . 6.700 2.381 1.986 2.840 . 0 0 "[ . 1 . 2 . 3]" 1
10 1 5 VAL H 1 10 VAL MG1 4.000 . 6.500 5.177 4.595 5.573 . 0 0 "[ . 1 . 2 . 3]" 1
11 1 5 VAL QG 1 10 VAL HA 4.000 . 7.400 3.765 3.326 4.148 . 0 0 "[ . 1 . 2 . 3]" 1
12 1 5 VAL MG1 1 13 TRP HH2 4.000 . 6.500 2.885 2.221 3.810 . 0 0 "[ . 1 . 2 . 3]" 1
13 1 5 VAL MG2 1 13 TRP HH2 4.000 . 6.500 2.782 2.201 3.975 . 0 0 "[ . 1 . 2 . 3]" 1
14 1 5 VAL MG1 1 13 TRP HZ2 4.000 . 6.500 3.278 2.390 4.784 . 0 0 "[ . 1 . 2 . 3]" 1
15 1 5 VAL MG2 1 13 TRP HZ2 4.000 . 6.500 3.519 2.333 4.568 . 0 0 "[ . 1 . 2 . 3]" 1
16 1 5 VAL MG1 1 23 HIS HE1 4.000 . 6.500 3.872 2.271 5.448 . 0 0 "[ . 1 . 2 . 3]" 1
17 1 5 VAL MG2 1 23 HIS HE1 4.000 . 6.500 3.816 2.314 5.314 . 0 0 "[ . 1 . 2 . 3]" 1
18 1 5 VAL QG 1 131 LEU MD1 4.000 . 8.900 2.316 1.987 2.960 . 0 0 "[ . 1 . 2 . 3]" 1
19 1 5 VAL HB 1 131 LEU MD2 4.000 . 6.500 2.621 2.064 4.197 . 0 0 "[ . 1 . 2 . 3]" 1
20 1 5 VAL HA 1 131 LEU MD2 4.000 . 6.500 4.663 4.026 5.347 . 0 0 "[ . 1 . 2 . 3]" 1
21 1 5 VAL QG 1 9 GLU HB3 3.000 . 5.700 3.101 2.737 3.805 . 0 0 "[ . 1 . 2 . 3]" 1
22 1 5 VAL QG 1 10 VAL HB 4.000 . 7.400 4.248 3.751 4.713 . 0 0 "[ . 1 . 2 . 3]" 1
23 1 5 VAL QG 1 25 CYS H 4.000 . 7.400 4.377 3.898 5.020 . 0 0 "[ . 1 . 2 . 3]" 1
24 1 5 VAL QG 1 26 GLY H 4.000 . 7.400 4.354 3.425 4.765 . 0 0 "[ . 1 . 2 . 3]" 1
25 1 5 VAL QG 1 10 VAL H 4.000 . 7.400 3.031 2.723 3.352 . 0 0 "[ . 1 . 2 . 3]" 1
26 1 6 SER H 1 6 SER HB3 3.000 . 3.500 2.558 2.452 2.717 . 0 0 "[ . 1 . 2 . 3]" 1
27 1 6 SER HB3 1 7 GLN H 4.000 . 5.000 3.973 3.828 4.093 . 0 0 "[ . 1 . 2 . 3]" 1
28 1 6 SER HB2 1 7 GLN H 3.000 . 3.500 2.677 2.414 3.051 . 0 0 "[ . 1 . 2 . 3]" 1
29 1 6 SER H 1 9 GLU HB3 4.000 . 5.000 4.812 4.324 5.090 0.090 16 0 "[ . 1 . 2 . 3]" 1
30 1 6 SER H 1 9 GLU HB2 4.000 . 5.000 3.353 2.930 3.614 . 0 0 "[ . 1 . 2 . 3]" 1
31 1 6 SER HB3 1 8 GLU H 4.000 . 5.000 4.299 4.064 4.645 . 0 0 "[ . 1 . 2 . 3]" 1
32 1 6 SER HB2 1 8 GLU H 3.000 . 3.500 2.796 2.536 3.130 . 0 0 "[ . 1 . 2 . 3]" 1
33 1 6 SER HB2 1 9 GLU H 4.000 . 5.000 3.837 3.154 4.205 . 0 0 "[ . 1 . 2 . 3]" 1
34 1 7 GLN H 1 7 GLN HB2 2.500 . 2.900 2.407 2.312 2.511 . 0 0 "[ . 1 . 2 . 3]" 1
35 1 7 GLN H 1 7 GLN QG 3.000 . 4.500 2.458 2.083 3.289 . 0 0 "[ . 1 . 2 . 3]" 1
36 1 7 GLN HA 1 7 GLN QG 3.000 . 4.100 2.458 2.272 2.917 . 0 0 "[ . 1 . 2 . 3]" 1
37 1 7 GLN HA 1 10 VAL MG1 4.000 . 6.500 3.247 2.368 3.850 . 0 0 "[ . 1 . 2 . 3]" 1
38 1 7 GLN HA 1 10 VAL MG2 4.000 . 6.500 2.192 2.025 2.712 . 0 0 "[ . 1 . 2 . 3]" 1
39 1 7 GLN HB2 1 8 GLU H 3.000 . 3.500 2.969 2.627 3.216 . 0 0 "[ . 1 . 2 . 3]" 1
40 1 7 GLN HB3 1 8 GLU H 4.000 . 5.000 3.854 3.597 4.025 . 0 0 "[ . 1 . 2 . 3]" 1
41 1 7 GLN QG 1 10 VAL MG1 4.000 . 7.500 4.568 3.612 5.240 . 0 0 "[ . 1 . 2 . 3]" 1
42 1 7 GLN QG 1 10 VAL MG2 4.000 . 7.500 3.612 3.143 4.422 . 0 0 "[ . 1 . 2 . 3]" 1
43 1 7 GLN HB3 1 10 VAL MG2 4.000 . 6.500 3.508 3.285 3.708 . 0 0 "[ . 1 . 2 . 3]" 1
44 1 8 GLU H 1 8 GLU QG 3.000 . 4.500 2.321 2.138 3.172 . 0 0 "[ . 1 . 2 . 3]" 1
45 1 8 GLU H 1 8 GLU HB2 2.500 . 2.900 2.420 2.383 2.504 . 0 0 "[ . 1 . 2 . 3]" 1
46 1 8 GLU H 1 8 GLU HB3 4.000 . 5.000 3.606 3.585 3.625 . 0 0 "[ . 1 . 2 . 3]" 1
47 1 8 GLU HB3 1 9 GLU H 4.000 . 5.000 3.617 3.556 3.716 . 0 0 "[ . 1 . 2 . 3]" 1
48 1 8 GLU H 1 9 GLU HB2 4.000 . 5.000 4.784 4.626 4.947 . 0 0 "[ . 1 . 2 . 3]" 1
49 1 9 GLU H 1 9 GLU HB2 2.500 . 2.900 2.367 2.258 2.451 . 0 0 "[ . 1 . 2 . 3]" 1
50 1 9 GLU H 1 9 GLU HB3 4.000 . 5.000 3.595 3.562 3.620 . 0 0 "[ . 1 . 2 . 3]" 1
51 1 9 GLU H 1 9 GLU QG 4.000 . 6.000 2.474 2.210 3.474 . 0 0 "[ . 1 . 2 . 3]" 1
52 1 9 GLU HB3 1 10 VAL H 4.000 . 5.000 3.506 3.274 3.594 . 0 0 "[ . 1 . 2 . 3]" 1
53 1 9 GLU HB2 1 10 VAL H 3.000 . 3.500 2.648 2.341 2.878 . 0 0 "[ . 1 . 2 . 3]" 1
54 1 9 GLU QG 1 10 VAL H 4.000 . 6.000 4.223 3.997 4.633 . 0 0 "[ . 1 . 2 . 3]" 1
55 1 9 GLU HA 1 12 LYS QD 3.000 . 4.300 2.754 2.286 4.110 . 0 0 "[ . 1 . 2 . 3]" 1
56 1 9 GLU HB3 1 10 VAL MG1 4.000 . 6.500 4.090 3.878 4.249 . 0 0 "[ . 1 . 2 . 3]" 1
57 1 9 GLU HB3 1 13 TRP HE1 4.000 . 5.000 3.237 2.243 3.894 . 0 0 "[ . 1 . 2 . 3]" 1
58 1 9 GLU QG 1 13 TRP HE1 4.000 . 6.000 4.799 3.406 5.447 . 0 0 "[ . 1 . 2 . 3]" 1
59 1 9 GLU HA 1 12 LYS QG 4.000 . 6.000 3.091 2.058 4.170 . 0 0 "[ . 1 . 2 . 3]" 1
60 1 10 VAL H 1 10 VAL MG1 2.500 . 4.400 2.103 1.784 2.491 . 0 0 "[ . 1 . 2 . 3]" 1
61 1 10 VAL H 1 10 VAL MG2 2.500 . 4.400 2.034 1.705 2.578 . 0 0 "[ . 1 . 2 . 3]" 1
62 1 10 VAL H 1 10 VAL HB 4.000 . 5.000 3.641 3.617 3.669 . 0 0 "[ . 1 . 2 . 3]" 1
63 1 10 VAL HA 1 10 VAL MG1 3.000 . 4.400 2.354 2.211 2.516 . 0 0 "[ . 1 . 2 . 3]" 1
64 1 10 VAL HB 1 11 LYS H 4.000 . 5.000 3.800 3.564 4.115 . 0 0 "[ . 1 . 2 . 3]" 1
65 1 10 VAL MG2 1 11 LYS H 3.000 . 5.000 2.036 1.829 2.220 . 0 0 "[ . 1 . 2 . 3]" 1
66 1 10 VAL MG2 1 12 LYS H 4.000 . 6.500 4.225 4.061 4.408 . 0 0 "[ . 1 . 2 . 3]" 1
67 1 10 VAL MG2 1 13 TRP H 4.000 . 6.500 4.772 4.599 4.977 . 0 0 "[ . 1 . 2 . 3]" 1
68 1 10 VAL MG1 1 128 TYR QD 4.000 . 6.500 4.071 2.753 5.115 . 0 0 "[ . 1 . 2 . 3]" 1
69 1 10 VAL MG2 1 128 TYR QD 4.000 . 6.500 4.756 4.407 5.056 . 0 0 "[ . 1 . 2 . 3]" 1
70 1 10 VAL MG1 1 128 TYR QE 4.000 . 6.500 4.132 3.394 5.062 . 0 0 "[ . 1 . 2 . 3]" 1
71 1 10 VAL MG2 1 128 TYR QE 3.000 . 4.800 3.761 3.343 3.990 . 0 0 "[ . 1 . 2 . 3]" 1
72 1 10 VAL MG1 1 13 TRP HZ3 4.000 . 6.500 3.211 2.627 4.511 . 0 0 "[ . 1 . 2 . 3]" 1
73 1 10 VAL MG2 1 132 THR HA 4.000 . 6.500 3.293 2.275 4.105 . 0 0 "[ . 1 . 2 . 3]" 1
74 1 10 VAL MG2 1 132 THR HB 4.000 . 6.500 3.514 2.639 4.346 . 0 0 "[ . 1 . 2 . 3]" 1
75 1 10 VAL MG1 1 132 THR MG 4.000 . 8.000 2.501 2.137 3.121 . 0 0 "[ . 1 . 2 . 3]" 1
76 1 10 VAL MG2 1 132 THR MG 3.000 . 6.300 1.972 1.811 2.131 . 0 0 "[ . 1 . 2 . 3]" 1
77 1 10 VAL MG2 1 11 LYS HA 4.000 . 6.500 3.284 2.980 3.609 . 0 0 "[ . 1 . 2 . 3]" 1
78 1 10 VAL MG1 1 131 LEU HB3 4.000 . 6.500 2.380 2.157 3.144 . 0 0 "[ . 1 . 2 . 3]" 1
79 1 10 VAL MG1 1 131 LEU HA 4.000 . 6.500 4.374 4.011 5.041 . 0 0 "[ . 1 . 2 . 3]" 1
80 1 10 VAL MG1 1 131 LEU MD1 3.000 . 6.300 2.800 2.000 3.810 . 0 0 "[ . 1 . 2 . 3]" 1
81 1 10 VAL MG2 1 11 LYS QE 4.000 . 7.500 4.069 3.054 5.386 . 0 0 "[ . 1 . 2 . 3]" 1
82 1 10 VAL QG 1 132 THR H 4.000 . 7.400 3.919 3.656 4.332 . 0 0 "[ . 1 . 2 . 3]" 1
83 1 10 VAL QG 1 133 ASN H 4.000 . 7.400 4.961 4.034 5.579 . 0 0 "[ . 1 . 2 . 3]" 1
84 1 10 VAL HB 1 128 TYR QE 4.000 . 5.000 2.808 2.341 3.716 . 0 0 "[ . 1 . 2 . 3]" 1
85 1 10 VAL HB 1 13 TRP HE3 4.000 . 5.000 3.830 3.336 4.245 . 0 0 "[ . 1 . 2 . 3]" 1
86 1 10 VAL MG2 1 11 LYS QG 4.000 . 7.500 2.453 2.231 3.621 . 0 0 "[ . 1 . 2 . 3]" 1
87 1 11 LYS HA 1 11 LYS QD 3.000 . 4.300 3.334 2.188 4.106 . 0 0 "[ . 1 . 2 . 3]" 1
88 1 11 LYS H 1 11 LYS QE 4.000 . 6.000 4.536 3.581 5.045 . 0 0 "[ . 1 . 2 . 3]" 1
89 1 11 LYS H 1 11 LYS QG 4.000 . 6.000 2.331 2.046 3.402 . 0 0 "[ . 1 . 2 . 3]" 1
90 1 11 LYS QB 1 11 LYS QE 4.000 . 7.000 3.208 2.070 3.784 . 0 0 "[ . 1 . 2 . 3]" 1
91 1 11 LYS QB 1 12 LYS H 4.000 . 6.000 2.669 2.543 2.805 . 0 0 "[ . 1 . 2 . 3]" 1
92 1 11 LYS H 1 12 LYS HB2 4.000 . 5.000 4.838 4.683 5.069 0.069 27 0 "[ . 1 . 2 . 3]" 1
93 1 11 LYS QG 1 12 LYS H 4.000 . 6.000 4.163 3.951 4.537 . 0 0 "[ . 1 . 2 . 3]" 1
94 1 11 LYS HA 1 128 TYR QE 4.000 . 5.000 4.282 3.153 4.901 . 0 0 "[ . 1 . 2 . 3]" 1
95 1 11 LYS HA 1 14 ALA MB 4.000 . 6.500 2.950 2.486 3.460 . 0 0 "[ . 1 . 2 . 3]" 1
96 1 12 LYS H 1 12 LYS QD 4.000 . 6.000 3.633 1.858 4.397 . 0 0 "[ . 1 . 2 . 3]" 1
97 1 12 LYS H 1 12 LYS QG 4.000 . 6.000 2.318 1.791 3.395 . 0 0 "[ . 1 . 2 . 3]" 1
98 1 12 LYS H 1 12 LYS HB3 4.000 . 5.000 3.619 3.586 3.649 . 0 0 "[ . 1 . 2 . 3]" 1
99 1 12 LYS H 1 12 LYS HB2 3.000 . 3.500 2.460 2.313 2.704 . 0 0 "[ . 1 . 2 . 3]" 1
100 1 12 LYS HB2 1 13 TRP H 3.000 . 3.500 2.728 2.516 3.050 . 0 0 "[ . 1 . 2 . 3]" 1
101 1 12 LYS H 1 13 TRP HD1 4.000 . 5.000 4.445 4.276 4.632 . 0 0 "[ . 1 . 2 . 3]" 1
102 1 12 LYS QG 1 13 TRP H 4.000 . 6.000 4.124 3.697 4.619 . 0 0 "[ . 1 . 2 . 3]" 1
103 1 12 LYS QD 1 13 TRP H 4.000 . 6.000 4.820 3.909 5.485 . 0 0 "[ . 1 . 2 . 3]" 1
104 1 12 LYS HA 1 15 GLU QG 4.000 . 6.000 2.670 2.181 3.544 . 0 0 "[ . 1 . 2 . 3]" 1
105 1 13 TRP HA 1 13 TRP HD1 4.000 . 5.000 2.326 2.302 2.398 . 0 0 "[ . 1 . 2 . 3]" 1
106 1 13 TRP H 1 13 TRP HB2 3.000 . 3.500 2.608 2.535 2.682 . 0 0 "[ . 1 . 2 . 3]" 1
107 1 13 TRP H 1 13 TRP HD1 3.000 . 3.500 2.466 2.355 2.594 . 0 0 "[ . 1 . 2 . 3]" 1
108 1 13 TRP HB2 1 14 ALA H 4.000 . 5.000 2.810 2.594 3.093 . 0 0 "[ . 1 . 2 . 3]" 1
109 1 13 TRP HA 1 20 LEU H 4.000 . 5.000 3.093 2.778 3.418 . 0 0 "[ . 1 . 2 . 3]" 1
110 1 13 TRP HB3 1 119 TYR QE 4.000 . 5.000 4.090 3.758 4.363 . 0 0 "[ . 1 . 2 . 3]" 1
111 1 13 TRP HB2 1 123 LEU MD2 4.000 . 6.500 4.230 3.806 4.533 . 0 0 "[ . 1 . 2 . 3]" 1
112 1 13 TRP HH2 1 25 CYS HB3 5.000 3.000 6.000 3.594 2.940 5.236 0.060 15 0 "[ . 1 . 2 . 3]" 1
113 1 13 TRP HZ2 1 25 CYS HB3 4.000 . 5.000 2.791 2.322 4.238 . 0 0 "[ . 1 . 2 . 3]" 1
114 1 13 TRP HE1 1 23 HIS HB3 4.000 . 5.000 2.735 2.135 3.142 . 0 0 "[ . 1 . 2 . 3]" 1
115 1 13 TRP HE1 1 23 HIS HB2 4.000 . 5.000 2.465 1.933 3.144 . 0 0 "[ . 1 . 2 . 3]" 1
116 1 13 TRP HH2 1 29 ALA MB 4.000 . 6.500 2.975 2.445 3.612 . 0 0 "[ . 1 . 2 . 3]" 1
117 1 13 TRP HZ3 1 131 LEU MD1 3.000 . 4.800 2.830 2.123 3.578 . 0 0 "[ . 1 . 2 . 3]" 1
118 1 13 TRP HH2 1 131 LEU MD1 4.000 . 6.500 3.119 2.418 3.964 . 0 0 "[ . 1 . 2 . 3]" 1
119 1 13 TRP HE1 1 23 HIS HD2 4.000 . 5.000 3.506 1.777 5.045 0.045 8 0 "[ . 1 . 2 . 3]" 1
120 1 13 TRP HE1 1 26 GLY H 4.000 . 5.000 4.060 3.453 4.819 . 0 0 "[ . 1 . 2 . 3]" 1
121 1 13 TRP HD1 1 20 LEU H 4.000 . 5.000 3.737 3.326 4.108 . 0 0 "[ . 1 . 2 . 3]" 1
122 1 13 TRP QB 1 128 TYR QE 4.000 . 6.000 2.775 2.407 3.272 . 0 0 "[ . 1 . 2 . 3]" 1
123 1 13 TRP HE3 1 123 LEU MD2 4.000 . 6.500 4.915 4.330 5.332 . 0 0 "[ . 1 . 2 . 3]" 1
124 1 13 TRP HA 1 19 ASN HB2 4.000 . 5.000 2.873 2.369 3.403 . 0 0 "[ . 1 . 2 . 3]" 1
125 1 13 TRP HA 1 20 LEU HA 4.000 . 5.000 3.618 3.264 4.000 . 0 0 "[ . 1 . 2 . 3]" 1
126 1 13 TRP HZ2 1 26 GLY H 4.000 . 5.000 2.854 2.369 3.350 . 0 0 "[ . 1 . 2 . 3]" 1
127 1 13 TRP HH2 1 26 GLY H 4.000 . 5.000 4.458 3.933 5.029 0.029 20 0 "[ . 1 . 2 . 3]" 1
128 1 13 TRP HD1 1 20 LEU HA 4.000 . 5.000 2.973 2.657 3.219 . 0 0 "[ . 1 . 2 . 3]" 1
129 1 14 ALA H 1 14 ALA MB 2.500 . 4.000 2.269 2.174 2.302 . 0 0 "[ . 1 . 2 . 3]" 1
130 1 14 ALA MB 1 15 GLU H 3.000 . 5.000 3.146 3.068 3.232 . 0 0 "[ . 1 . 2 . 3]" 1
131 1 14 ALA H 1 123 LEU MD2 4.000 . 6.500 4.274 4.000 4.583 . 0 0 "[ . 1 . 2 . 3]" 1
132 1 14 ALA H 1 15 GLU HB2 4.000 . 5.000 4.561 4.349 4.765 . 0 0 "[ . 1 . 2 . 3]" 1
133 1 14 ALA H 1 15 GLU QG 4.000 . 6.000 3.930 3.551 5.174 . 0 0 "[ . 1 . 2 . 3]" 1
134 1 14 ALA H 1 19 ASN HB2 5.000 3.000 6.000 5.509 4.860 5.901 . 0 0 "[ . 1 . 2 . 3]" 1
135 1 14 ALA H 1 128 TYR QE 4.000 . 5.000 4.075 3.365 4.707 . 0 0 "[ . 1 . 2 . 3]" 1
136 1 14 ALA MB 1 16 SER H 4.000 . 6.500 4.841 4.691 4.929 . 0 0 "[ . 1 . 2 . 3]" 1
137 1 14 ALA MB 1 128 TYR QE 4.000 . 6.500 3.521 2.542 4.246 . 0 0 "[ . 1 . 2 . 3]" 1
138 1 14 ALA HA 1 123 LEU MD2 3.000 . 4.800 2.949 2.518 3.559 . 0 0 "[ . 1 . 2 . 3]" 1
139 1 14 ALA HA 1 123 LEU MD1 3.000 . 4.800 3.601 3.146 3.919 . 0 0 "[ . 1 . 2 . 3]" 1
140 1 14 ALA MB 1 123 LEU MD2 3.000 . 6.300 2.390 2.074 2.907 . 0 0 "[ . 1 . 2 . 3]" 1
141 1 14 ALA MB 1 123 LEU MD1 3.000 . 6.300 3.344 2.931 3.908 . 0 0 "[ . 1 . 2 . 3]" 1
142 1 15 GLU H 1 15 GLU QG 3.000 . 4.500 2.647 2.339 3.624 . 0 0 "[ . 1 . 2 . 3]" 1
143 1 15 GLU H 1 15 GLU HB2 2.500 . 2.900 2.410 2.292 2.498 . 0 0 "[ . 1 . 2 . 3]" 1
144 1 15 GLU HB2 1 16 SER H 3.000 . 3.500 2.910 2.671 3.148 . 0 0 "[ . 1 . 2 . 3]" 1
145 1 15 GLU QG 1 16 SER H 4.000 . 6.000 4.266 4.051 4.754 . 0 0 "[ . 1 . 2 . 3]" 1
146 1 15 GLU H 1 19 ASN HB2 4.000 . 5.000 4.455 3.858 4.792 . 0 0 "[ . 1 . 2 . 3]" 1
147 1 15 GLU QB 1 16 SER HB2 4.000 . 6.000 4.896 4.855 4.949 . 0 0 "[ . 1 . 2 . 3]" 1
148 1 16 SER H 1 16 SER HB3 4.000 . 5.000 3.575 3.418 3.706 . 0 0 "[ . 1 . 2 . 3]" 1
149 1 16 SER HB3 1 17 LEU H 4.000 . 5.000 3.975 3.741 4.165 . 0 0 "[ . 1 . 2 . 3]" 1
150 1 16 SER HB2 1 17 LEU H 3.000 . 3.500 2.892 2.559 3.065 . 0 0 "[ . 1 . 2 . 3]" 1
151 1 16 SER H 1 119 TYR QE 4.000 . 5.000 3.481 3.115 4.392 . 0 0 "[ . 1 . 2 . 3]" 1
152 1 16 SER H 1 19 ASN HB2 4.000 . 5.000 3.275 2.772 3.692 . 0 0 "[ . 1 . 2 . 3]" 1
153 1 16 SER HB3 1 18 GLU H 4.000 . 5.000 4.592 4.457 4.754 . 0 0 "[ . 1 . 2 . 3]" 1
154 1 16 SER HB2 1 18 GLU H 4.000 . 5.000 2.884 2.760 3.060 . 0 0 "[ . 1 . 2 . 3]" 1
155 1 16 SER HB3 1 19 ASN H 4.000 . 5.000 4.566 4.319 4.852 . 0 0 "[ . 1 . 2 . 3]" 1
156 1 16 SER HB2 1 19 ASN H 4.000 . 5.000 3.506 3.197 3.851 . 0 0 "[ . 1 . 2 . 3]" 1
157 1 16 SER HA 1 119 TYR QE 4.000 . 5.000 3.728 3.381 4.113 . 0 0 "[ . 1 . 2 . 3]" 1
158 1 16 SER HB2 1 18 GLU QG 4.000 . 6.000 3.869 3.521 4.695 . 0 0 "[ . 1 . 2 . 3]" 1
159 1 16 SER HB2 1 18 GLU HB3 4.000 . 5.000 5.014 4.889 5.126 0.126 28 0 "[ . 1 . 2 . 3]" 1
160 1 17 LEU HA 1 17 LEU MD2 4.000 . 6.500 3.824 3.773 3.869 . 0 0 "[ . 1 . 2 . 3]" 1
161 1 17 LEU HA 1 17 LEU MD1 3.000 . 5.000 2.136 2.096 2.311 . 0 0 "[ . 1 . 2 . 3]" 1
162 1 17 LEU H 1 17 LEU MD1 4.000 . 6.500 4.031 3.792 4.121 . 0 0 "[ . 1 . 2 . 3]" 1
163 1 17 LEU H 1 17 LEU MD2 4.000 . 6.500 4.254 4.210 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
164 1 17 LEU H 1 17 LEU HG 4.000 . 5.000 4.450 4.389 4.494 . 0 0 "[ . 1 . 2 . 3]" 1
165 1 17 LEU H 1 17 LEU HB3 3.000 . 3.500 2.510 2.392 2.719 . 0 0 "[ . 1 . 2 . 3]" 1
166 1 17 LEU H 1 17 LEU HB2 3.000 . 3.500 2.530 2.339 2.648 . 0 0 "[ . 1 . 2 . 3]" 1
167 1 17 LEU H 1 119 TYR QE 4.000 . 5.000 3.961 2.433 4.301 . 0 0 "[ . 1 . 2 . 3]" 1
168 1 17 LEU H 1 115 GLU QG 4.000 . 6.000 4.251 3.697 4.787 . 0 0 "[ . 1 . 2 . 3]" 1
169 1 17 LEU MD1 1 18 GLU H 4.000 . 6.500 4.421 4.097 4.762 . 0 0 "[ . 1 . 2 . 3]" 1
170 1 17 LEU MD2 1 18 GLU H 4.000 . 6.500 4.320 4.173 4.425 . 0 0 "[ . 1 . 2 . 3]" 1
171 1 17 LEU HG 1 18 GLU H 4.000 . 5.000 3.698 3.328 4.077 . 0 0 "[ . 1 . 2 . 3]" 1
172 1 17 LEU HB3 1 18 GLU H 4.000 . 5.000 2.593 2.494 2.657 . 0 0 "[ . 1 . 2 . 3]" 1
173 1 111 PHE HA 1 115 GLU H 4.000 . 5.000 3.636 3.429 3.925 . 0 0 "[ . 1 . 2 . 3]" 1
174 1 17 LEU MD2 1 114 MET H 4.000 . 6.500 4.585 4.144 5.004 . 0 0 "[ . 1 . 2 . 3]" 1
175 1 17 LEU MD2 1 115 GLU H 3.000 . 5.000 3.258 2.775 3.845 . 0 0 "[ . 1 . 2 . 3]" 1
176 1 17 LEU MD1 1 119 TYR H 4.000 . 6.500 4.596 3.734 5.262 . 0 0 "[ . 1 . 2 . 3]" 1
177 1 17 LEU HA 1 119 TYR QE 4.000 . 5.000 2.443 2.323 2.704 . 0 0 "[ . 1 . 2 . 3]" 1
178 1 17 LEU MD1 1 21 ILE MD 4.000 . 8.000 3.143 2.221 4.517 . 0 0 "[ . 1 . 2 . 3]" 1
179 1 17 LEU HA 1 20 LEU MD2 4.000 . 6.500 3.807 3.553 4.100 . 0 0 "[ . 1 . 2 . 3]" 1
180 1 17 LEU MD2 1 111 PHE HE2 4.000 . 6.500 3.278 2.815 3.556 . 0 0 "[ . 1 . 2 . 3]" 1
181 1 17 LEU MD2 1 111 PHE HD2 4.000 . 6.500 2.613 2.259 3.023 . 0 0 "[ . 1 . 2 . 3]" 1
182 1 17 LEU MD2 1 111 PHE HA 4.000 . 6.500 2.317 2.107 2.906 . 0 0 "[ . 1 . 2 . 3]" 1
183 1 17 LEU MD1 1 115 GLU HA 4.000 . 6.500 3.288 2.228 4.154 . 0 0 "[ . 1 . 2 . 3]" 1
184 1 17 LEU MD2 1 115 GLU HA 4.000 . 6.500 3.516 2.918 4.423 . 0 0 "[ . 1 . 2 . 3]" 1
185 1 17 LEU MD1 1 115 GLU QG 4.000 . 7.500 3.458 2.245 4.076 . 0 0 "[ . 1 . 2 . 3]" 1
186 1 17 LEU MD2 1 115 GLU QG 4.000 . 7.500 3.314 1.967 4.244 . 0 0 "[ . 1 . 2 . 3]" 1
187 1 17 LEU MD2 1 115 GLU QB 4.000 . 7.500 2.666 2.107 4.184 . 0 0 "[ . 1 . 2 . 3]" 1
188 1 17 LEU MD2 1 114 MET QG 4.000 . 7.500 2.170 1.970 2.806 . 0 0 "[ . 1 . 2 . 3]" 1
189 1 17 LEU MD1 1 114 MET HB2 4.000 . 6.500 3.913 2.630 4.557 . 0 0 "[ . 1 . 2 . 3]" 1
190 1 17 LEU MD2 1 114 MET HB2 4.000 . 6.500 4.192 3.715 4.618 . 0 0 "[ . 1 . 2 . 3]" 1
191 1 17 LEU MD1 1 21 ILE QG 4.000 . 7.500 3.211 2.198 5.392 . 0 0 "[ . 1 . 2 . 3]" 1
192 1 17 LEU MD2 1 21 ILE QG 4.000 . 7.500 4.138 3.438 5.549 . 0 0 "[ . 1 . 2 . 3]" 1
193 1 17 LEU MD1 1 119 TYR HD1 4.000 . 6.500 2.930 2.375 5.623 . 0 0 "[ . 1 . 2 . 3]" 1
194 1 17 LEU MD1 1 119 TYR HA 4.000 . 6.500 4.801 4.468 5.477 . 0 0 "[ . 1 . 2 . 3]" 1
195 1 17 LEU MD1 1 119 TYR QB 4.000 . 7.500 4.178 3.297 5.056 . 0 0 "[ . 1 . 2 . 3]" 1
196 1 17 LEU MD1 1 20 LEU HB3 4.000 . 6.500 2.459 2.213 3.743 . 0 0 "[ . 1 . 2 . 3]" 1
197 1 17 LEU MD1 1 20 LEU HB2 4.000 . 6.500 3.660 3.363 4.681 . 0 0 "[ . 1 . 2 . 3]" 1
198 1 17 LEU MD1 1 21 ILE MG 4.000 . 8.000 3.820 2.078 5.381 . 0 0 "[ . 1 . 2 . 3]" 1
199 1 17 LEU MD2 1 21 ILE MG 4.000 . 8.000 4.179 2.742 5.136 . 0 0 "[ . 1 . 2 . 3]" 1
200 1 17 LEU HG 1 21 ILE MG 4.000 . 6.500 3.812 2.266 4.910 . 0 0 "[ . 1 . 2 . 3]" 1
201 1 17 LEU HA 1 115 GLU QG 4.000 . 6.000 4.569 3.669 5.041 . 0 0 "[ . 1 . 2 . 3]" 1
202 1 17 LEU MD2 1 114 MET ME 3.000 . 6.300 2.494 2.035 3.234 . 0 0 "[ . 1 . 2 . 3]" 1
203 1 17 LEU HG 1 20 LEU MD2 4.000 . 6.500 4.621 3.938 5.160 . 0 0 "[ . 1 . 2 . 3]" 1
204 1 17 LEU HG 1 21 ILE MD 4.000 . 6.500 2.564 2.058 4.061 . 0 0 "[ . 1 . 2 . 3]" 1
205 1 18 GLU H 1 18 GLU HB2 2.500 . 2.900 2.472 2.427 2.570 . 0 0 "[ . 1 . 2 . 3]" 1
206 1 18 GLU H 1 18 GLU HB3 4.000 . 5.000 3.603 3.581 3.623 . 0 0 "[ . 1 . 2 . 3]" 1
207 1 18 GLU H 1 18 GLU QG 3.000 . 4.500 2.153 1.898 2.993 . 0 0 "[ . 1 . 2 . 3]" 1
208 1 18 GLU HB2 1 19 ASN H 2.500 . 2.900 2.617 2.440 2.715 . 0 0 "[ . 1 . 2 . 3]" 1
209 1 18 GLU HB3 1 19 ASN H 4.000 . 5.000 3.562 3.342 3.732 . 0 0 "[ . 1 . 2 . 3]" 1
210 1 18 GLU QG 1 19 ASN H 4.000 . 6.000 4.127 4.019 4.438 . 0 0 "[ . 1 . 2 . 3]" 1
211 1 18 GLU H 1 111 PHE HZ 4.000 . 5.000 5.166 5.054 5.280 0.280 14 0 "[ . 1 . 2 . 3]" 1
212 1 18 GLU H 1 111 PHE HE2 4.000 . 5.000 3.646 3.444 3.829 . 0 0 "[ . 1 . 2 . 3]" 1
213 1 18 GLU H 1 111 PHE HD2 4.000 . 5.000 4.985 4.688 5.133 0.133 30 0 "[ . 1 . 2 . 3]" 1
214 1 18 GLU H 1 19 ASN HB2 4.000 . 5.000 4.969 4.854 5.070 0.070 5 0 "[ . 1 . 2 . 3]" 1
215 1 18 GLU HA 1 21 ILE QG 4.000 . 6.000 3.483 2.194 5.387 . 0 0 "[ . 1 . 2 . 3]" 1
216 1 18 GLU HB2 1 111 PHE HE2 4.000 . 5.000 4.781 4.570 5.033 0.033 5 0 "[ . 1 . 2 . 3]" 1
217 1 18 GLU HA 1 111 PHE HE2 4.000 . 5.000 3.567 3.227 3.977 . 0 0 "[ . 1 . 2 . 3]" 1
218 1 18 GLU QG 1 111 PHE HE2 4.000 . 6.000 2.250 2.092 2.528 . 0 0 "[ . 1 . 2 . 3]" 1
219 1 18 GLU HA 1 21 ILE MD 4.000 . 6.500 3.020 2.339 4.723 . 0 0 "[ . 1 . 2 . 3]" 1
220 1 19 ASN H 1 19 ASN HB2 2.500 . 2.900 2.407 2.330 2.455 . 0 0 "[ . 1 . 2 . 3]" 1
221 1 19 ASN H 1 19 ASN HB3 4.000 . 5.000 3.606 3.587 3.624 . 0 0 "[ . 1 . 2 . 3]" 1
222 1 19 ASN HB2 1 20 LEU H 3.000 . 3.500 2.551 2.446 2.680 . 0 0 "[ . 1 . 2 . 3]" 1
223 1 19 ASN HB3 1 20 LEU H 4.000 . 5.000 3.448 3.332 3.566 . 0 0 "[ . 1 . 2 . 3]" 1
224 1 20 LEU H 1 20 LEU MD1 4.000 . 6.500 4.090 4.044 4.146 . 0 0 "[ . 1 . 2 . 3]" 1
225 1 20 LEU H 1 20 LEU MD2 4.000 . 6.500 4.273 4.203 4.311 . 0 0 "[ . 1 . 2 . 3]" 1
226 1 20 LEU H 1 20 LEU HB3 3.000 . 3.500 2.517 2.398 2.559 . 0 0 "[ . 1 . 2 . 3]" 1
227 1 20 LEU H 1 20 LEU HB2 3.000 . 3.500 2.558 2.520 2.657 . 0 0 "[ . 1 . 2 . 3]" 1
228 1 20 LEU H 1 20 LEU HG 4.000 . 5.000 4.478 4.420 4.498 . 0 0 "[ . 1 . 2 . 3]" 1
229 1 20 LEU HA 1 20 LEU MD1 3.000 . 4.800 2.166 2.109 2.206 . 0 0 "[ . 1 . 2 . 3]" 1
230 1 20 LEU HA 1 20 LEU HG 4.000 . 5.000 3.082 2.971 3.268 . 0 0 "[ . 1 . 2 . 3]" 1
231 1 20 LEU MD2 1 21 ILE H 4.000 . 6.500 4.133 3.866 4.367 . 0 0 "[ . 1 . 2 . 3]" 1
232 1 20 LEU HG 1 21 ILE H 4.000 . 5.000 3.601 3.293 3.801 . 0 0 "[ . 1 . 2 . 3]" 1
233 1 20 LEU QB 1 21 ILE H 4.000 . 6.000 2.451 2.338 2.607 . 0 0 "[ . 1 . 2 . 3]" 1
234 1 20 LEU QB 1 22 ASN H 4.000 . 6.000 4.501 4.388 4.668 . 0 0 "[ . 1 . 2 . 3]" 1
235 1 20 LEU H 1 119 TYR QE 5.000 3.000 6.000 4.197 3.824 5.241 . 0 0 "[ . 1 . 2 . 3]" 1
236 1 20 LEU MD2 1 30 PHE H 4.000 . 6.500 4.768 4.289 5.291 . 0 0 "[ . 1 . 2 . 3]" 1
237 1 20 LEU HG 1 30 PHE H 5.000 3.000 6.000 4.685 4.201 5.135 . 0 0 "[ . 1 . 2 . 3]" 1
238 1 20 LEU MD2 1 119 TYR QE 4.000 . 6.500 2.223 2.042 4.351 . 0 0 "[ . 1 . 2 . 3]" 1
239 1 20 LEU MD2 1 119 TYR HD1 4.000 . 6.500 3.126 2.541 5.335 . 0 0 "[ . 1 . 2 . 3]" 1
240 1 20 LEU HB2 1 119 TYR QE 4.000 . 5.000 2.875 2.297 4.574 . 0 0 "[ . 1 . 2 . 3]" 1
241 1 20 LEU MD1 1 122 PHE QD 4.000 . 6.500 3.656 3.186 4.183 . 0 0 "[ . 1 . 2 . 3]" 1
242 1 20 LEU MD2 1 122 PHE QD 4.000 . 6.500 3.301 2.946 3.599 . 0 0 "[ . 1 . 2 . 3]" 1
243 1 20 LEU MD1 1 122 PHE QE 4.000 . 6.500 2.886 2.173 3.911 . 0 0 "[ . 1 . 2 . 3]" 1
244 1 20 LEU MD2 1 122 PHE QE 4.000 . 6.500 3.182 2.763 3.424 . 0 0 "[ . 1 . 2 . 3]" 1
245 1 20 LEU MD2 1 21 ILE HA 4.000 . 6.500 4.740 4.541 4.993 . 0 0 "[ . 1 . 2 . 3]" 1
246 1 20 LEU HG 1 26 GLY QA 4.000 . 6.000 3.527 2.958 4.121 . 0 0 "[ . 1 . 2 . 3]" 1
247 1 20 LEU QB 1 21 ILE MG 4.000 . 7.500 4.242 2.699 5.199 . 0 0 "[ . 1 . 2 . 3]" 1
248 1 20 LEU MD2 1 21 ILE MG 4.000 . 8.000 4.645 3.052 5.501 . 0 0 "[ . 1 . 2 . 3]" 1
249 1 20 LEU HG 1 21 ILE MG 4.000 . 6.500 4.500 2.986 5.385 . 0 0 "[ . 1 . 2 . 3]" 1
250 1 20 LEU MD1 1 30 PHE HA 4.000 . 6.500 4.115 3.814 4.438 . 0 0 "[ . 1 . 2 . 3]" 1
251 1 20 LEU MD2 1 119 TYR H 4.000 . 6.500 5.119 4.520 5.479 . 0 0 "[ . 1 . 2 . 3]" 1
252 1 20 LEU HG 1 29 ALA MB 4.000 . 6.500 5.173 4.619 5.323 . 0 0 "[ . 1 . 2 . 3]" 1
253 1 20 LEU HG 1 27 LEU MD2 4.000 . 6.500 4.862 4.381 5.220 . 0 0 "[ . 1 . 2 . 3]" 1
254 1 20 LEU MD1 1 29 ALA MB 4.000 . 8.000 3.401 2.947 3.688 . 0 0 "[ . 1 . 2 . 3]" 1
255 1 20 LEU MD2 1 30 PHE HB2 4.000 . 6.500 2.951 2.451 3.558 . 0 0 "[ . 1 . 2 . 3]" 1
256 1 21 ILE H 1 21 ILE QG 3.000 . 4.500 2.291 1.872 3.981 . 0 0 "[ . 1 . 2 . 3]" 1
257 1 21 ILE H 1 21 ILE MG 4.000 . 6.500 3.057 1.964 3.785 . 0 0 "[ . 1 . 2 . 3]" 1
258 1 21 ILE H 1 21 ILE MD 4.000 . 6.500 3.619 3.382 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
259 1 21 ILE HB 1 21 ILE MD 3.000 . 4.800 2.272 2.224 2.407 . 0 0 "[ . 1 . 2 . 3]" 1
260 1 21 ILE HA 1 21 ILE MG 3.000 . 4.400 2.439 2.274 3.184 . 0 0 "[ . 1 . 2 . 3]" 1
261 1 21 ILE HB 1 22 ASN H 4.000 . 5.000 3.482 2.749 4.252 . 0 0 "[ . 1 . 2 . 3]" 1
262 1 21 ILE MD 1 22 ASN H 4.000 . 6.500 4.574 4.064 5.157 . 0 0 "[ . 1 . 2 . 3]" 1
263 1 21 ILE MG 1 22 ASN H 4.000 . 6.500 3.677 2.372 4.093 . 0 0 "[ . 1 . 2 . 3]" 1
264 1 21 ILE HG13 1 22 ASN H 4.000 . 6.000 3.836 2.475 5.239 . 0 0 "[ . 1 . 2 . 3]" 1
265 1 21 ILE HG12 1 22 ASN H 4.000 . 6.000 4.312 2.649 5.215 . 0 0 "[ . 1 . 2 . 3]" 1
266 1 21 ILE MG 1 43 ILE MD 3.000 . 6.300 3.260 2.629 4.421 . 0 0 "[ . 1 . 2 . 3]" 1
267 1 21 ILE MD 1 46 TRP HZ2 4.000 . 6.500 3.627 2.461 4.864 . 0 0 "[ . 1 . 2 . 3]" 1
268 1 21 ILE MD 1 111 PHE HD1 4.000 . 6.500 4.290 3.712 5.077 . 0 0 "[ . 1 . 2 . 3]" 1
269 1 21 ILE MD 1 111 PHE HE1 4.000 . 6.500 2.821 2.349 3.441 . 0 0 "[ . 1 . 2 . 3]" 1
270 1 21 ILE MD 1 43 ILE MD 4.000 . 8.000 3.775 2.121 5.136 . 0 0 "[ . 1 . 2 . 3]" 1
271 1 21 ILE HB 1 27 LEU MD2 4.000 . 6.500 3.636 2.389 4.587 . 0 0 "[ . 1 . 2 . 3]" 1
272 1 21 ILE MG 1 27 LEU MD2 3.000 . 6.300 2.616 2.000 3.579 . 0 0 "[ . 1 . 2 . 3]" 1
273 1 21 ILE HA 1 27 LEU MD2 3.000 . 4.800 2.291 2.092 2.489 . 0 0 "[ . 1 . 2 . 3]" 1
274 1 21 ILE MG 1 30 PHE HD2 4.000 . 6.500 4.195 2.957 5.528 . 0 0 "[ . 1 . 2 . 3]" 1
275 1 21 ILE HB 1 43 ILE MD 4.000 . 6.500 4.792 3.376 5.561 . 0 0 "[ . 1 . 2 . 3]" 1
276 1 21 ILE HB 1 114 MET ME 4.000 . 6.500 4.725 3.219 5.259 . 0 0 "[ . 1 . 2 . 3]" 1
277 1 21 ILE QG 1 114 MET ME 4.000 . 7.500 3.576 2.689 4.840 . 0 0 "[ . 1 . 2 . 3]" 1
278 1 21 ILE MD 1 114 MET ME 4.000 . 8.000 2.646 2.029 3.766 . 0 0 "[ . 1 . 2 . 3]" 1
279 1 21 ILE MG 1 114 MET ME 4.000 . 8.000 3.436 2.051 4.369 . 0 0 "[ . 1 . 2 . 3]" 1
280 1 21 ILE HA 1 114 MET ME 4.000 . 6.500 5.177 4.775 5.544 . 0 0 "[ . 1 . 2 . 3]" 1
281 1 21 ILE MG 1 111 PHE HE2 4.000 . 6.500 5.198 3.835 5.437 . 0 0 "[ . 1 . 2 . 3]" 1
282 1 21 ILE MD 1 46 TRP HE1 4.000 . 6.500 3.759 2.701 4.778 . 0 0 "[ . 1 . 2 . 3]" 1
283 1 21 ILE MG 1 27 LEU HA 4.000 . 6.500 4.585 4.082 5.572 . 0 0 "[ . 1 . 2 . 3]" 1
284 1 21 ILE HA 1 27 LEU HG 4.000 . 5.000 3.023 2.474 3.582 . 0 0 "[ . 1 . 2 . 3]" 1
285 1 22 ASN H 1 22 ASN HB2 2.500 . 2.900 2.424 2.370 2.530 . 0 0 "[ . 1 . 2 . 3]" 1
286 1 22 ASN HB3 1 23 HIS H 4.000 . 5.000 4.197 4.025 4.357 . 0 0 "[ . 1 . 2 . 3]" 1
287 1 22 ASN HB2 1 23 HIS H 4.000 . 5.000 3.484 3.249 3.670 . 0 0 "[ . 1 . 2 . 3]" 1
288 1 22 ASN H 1 23 HIS HB2 4.000 . 5.000 4.531 4.348 4.782 . 0 0 "[ . 1 . 2 . 3]" 1
289 1 23 HIS H 1 23 HIS HB3 3.000 . 3.500 2.628 2.485 2.728 . 0 0 "[ . 1 . 2 . 3]" 1
290 1 23 HIS H 1 23 HIS HB2 3.000 . 3.500 2.705 2.587 2.847 . 0 0 "[ . 1 . 2 . 3]" 1
291 1 23 HIS HB3 1 23 HIS HD2 4.000 . 5.000 3.712 2.874 3.990 . 0 0 "[ . 1 . 2 . 3]" 1
292 1 23 HIS HB2 1 23 HIS HD2 4.000 . 5.000 3.026 2.756 3.562 . 0 0 "[ . 1 . 2 . 3]" 1
293 1 23 HIS HB2 1 24 GLU H 4.000 . 5.000 4.237 4.139 4.320 . 0 0 "[ . 1 . 2 . 3]" 1
294 1 23 HIS H 1 27 LEU H 4.000 . 5.000 3.977 3.795 4.252 . 0 0 "[ . 1 . 2 . 3]" 1
295 1 23 HIS H 1 27 LEU MD2 4.000 . 6.500 4.501 4.181 4.737 . 0 0 "[ . 1 . 2 . 3]" 1
296 1 23 HIS H 1 27 LEU HG 4.000 . 5.000 3.498 3.105 3.722 . 0 0 "[ . 1 . 2 . 3]" 1
297 1 23 HIS H 1 26 GLY QA 4.000 . 6.000 3.727 3.518 4.290 . 0 0 "[ . 1 . 2 . 3]" 1
298 1 23 HIS HE1 1 25 CYS H 4.000 . 5.000 2.892 2.492 3.905 . 0 0 "[ . 1 . 2 . 3]" 1
299 1 23 HIS HB3 1 25 CYS H 4.000 . 5.000 3.779 3.498 4.483 . 0 0 "[ . 1 . 2 . 3]" 1
300 1 23 HIS HB2 1 25 CYS H 4.000 . 5.000 4.802 4.670 5.112 0.112 13 0 "[ . 1 . 2 . 3]" 1
301 1 23 HIS HB3 1 26 GLY H 4.000 . 5.000 2.189 1.967 2.808 . 0 0 "[ . 1 . 2 . 3]" 1
302 1 23 HIS HB2 1 26 GLY H 4.000 . 5.000 3.780 3.638 3.986 . 0 0 "[ . 1 . 2 . 3]" 1
303 1 23 HIS HE1 1 25 CYS HB3 4.000 . 5.000 2.767 2.314 4.585 . 0 0 "[ . 1 . 2 . 3]" 1
304 1 23 HIS HE1 1 25 CYS HB2 4.000 . 5.000 2.892 2.331 4.266 . 0 0 "[ . 1 . 2 . 3]" 1
305 1 23 HIS HE1 1 26 GLY H 4.000 . 5.000 4.138 3.300 4.925 . 0 0 "[ . 1 . 2 . 3]" 1
306 1 24 GLU H 1 24 GLU HB2 2.500 . 2.900 2.510 2.439 2.596 . 0 0 "[ . 1 . 2 . 3]" 1
307 1 24 GLU H 1 24 GLU HG3 4.000 . 6.000 4.454 4.409 4.503 . 0 0 "[ . 1 . 2 . 3]" 1
308 1 24 GLU H 1 24 GLU HG2 4.000 . 6.000 4.532 4.470 4.670 . 0 0 "[ . 1 . 2 . 3]" 1
309 1 24 GLU HB3 1 25 CYS H 3.000 . 3.500 2.615 2.463 2.697 . 0 0 "[ . 1 . 2 . 3]" 1
310 1 24 GLU H 1 27 LEU H 4.000 . 5.000 4.762 4.482 4.903 . 0 0 "[ . 1 . 2 . 3]" 1
311 1 24 GLU HB3 1 28 ALA H 5.000 3.000 6.000 5.977 5.873 6.045 0.045 8 0 "[ . 1 . 2 . 3]" 1
312 1 24 GLU HA 1 27 LEU MD1 3.000 . 4.800 2.585 2.282 2.948 . 0 0 "[ . 1 . 2 . 3]" 1
313 1 24 GLU HB3 1 25 CYS HA 4.000 . 5.000 4.371 4.295 4.429 . 0 0 "[ . 1 . 2 . 3]" 1
314 1 25 CYS HB3 1 26 GLY H 3.000 . 3.500 2.845 2.670 3.023 . 0 0 "[ . 1 . 2 . 3]" 1
315 1 25 CYS HB2 1 28 ALA MB 4.000 . 6.500 4.457 4.182 4.747 . 0 0 "[ . 1 . 2 . 3]" 1
316 1 26 GLY HA3 1 29 ALA MB 4.000 . 7.500 4.090 3.701 4.491 . 0 0 "[ . 1 . 2 . 3]" 1
317 1 26 GLY HA2 1 29 ALA MB 4.000 . 7.500 2.582 2.276 3.015 . 0 0 "[ . 1 . 2 . 3]" 1
318 1 26 GLY H 1 27 LEU HB2 4.000 . 5.000 4.670 4.486 4.759 . 0 0 "[ . 1 . 2 . 3]" 1
319 1 27 LEU HB2 1 27 LEU MD1 3.000 . 4.800 2.277 2.224 2.355 . 0 0 "[ . 1 . 2 . 3]" 1
320 1 27 LEU HB2 1 27 LEU MD2 3.000 . 4.800 3.202 3.182 3.219 . 0 0 "[ . 1 . 2 . 3]" 1
321 1 27 LEU H 1 27 LEU MD2 3.000 . 5.000 3.709 3.549 3.884 . 0 0 "[ . 1 . 2 . 3]" 1
322 1 27 LEU H 1 27 LEU HB2 2.500 . 2.900 2.391 2.313 2.448 . 0 0 "[ . 1 . 2 . 3]" 1
323 1 27 LEU H 1 27 LEU HB3 4.000 . 5.000 3.602 3.584 3.627 . 0 0 "[ . 1 . 2 . 3]" 1
324 1 27 LEU H 1 27 LEU HG 3.000 . 3.300 2.383 2.248 2.582 . 0 0 "[ . 1 . 2 . 3]" 1
325 1 27 LEU HA 1 27 LEU MD2 3.000 . 4.800 2.195 2.144 2.235 . 0 0 "[ . 1 . 2 . 3]" 1
326 1 27 LEU HB2 1 28 ALA H 3.000 . 3.500 2.497 2.346 2.687 . 0 0 "[ . 1 . 2 . 3]" 1
327 1 27 LEU MD1 1 28 ALA H 4.000 . 6.500 4.347 4.215 4.539 . 0 0 "[ . 1 . 2 . 3]" 1
328 1 27 LEU MD2 1 28 ALA H 4.000 . 6.500 4.706 4.589 4.803 . 0 0 "[ . 1 . 2 . 3]" 1
329 1 27 LEU MD2 1 30 PHE H 4.000 . 6.500 5.124 4.778 5.319 . 0 0 "[ . 1 . 2 . 3]" 1
330 1 27 LEU MD1 1 46 TRP HZ3 4.000 . 6.500 4.413 3.246 5.299 . 0 0 "[ . 1 . 2 . 3]" 1
331 1 27 LEU MD2 1 46 TRP HZ3 4.000 . 6.500 3.595 2.684 4.493 . 0 0 "[ . 1 . 2 . 3]" 1
332 1 27 LEU MD2 1 46 TRP HE3 4.000 . 6.500 4.544 3.869 5.185 . 0 0 "[ . 1 . 2 . 3]" 1
333 1 27 LEU MD2 1 30 PHE HD2 4.000 . 6.500 3.512 2.314 5.305 . 0 0 "[ . 1 . 2 . 3]" 1
334 1 27 LEU MD2 1 30 PHE HB3 4.000 . 6.500 3.552 3.316 3.822 . 0 0 "[ . 1 . 2 . 3]" 1
335 1 27 LEU MD2 1 31 LYS H 4.000 . 6.500 4.590 4.161 4.857 . 0 0 "[ . 1 . 2 . 3]" 1
336 1 28 ALA H 1 28 ALA MB 2.500 . 4.000 2.239 2.199 2.263 . 0 0 "[ . 1 . 2 . 3]" 1
337 1 28 ALA MB 1 29 ALA H 2.500 . 4.400 2.339 2.183 2.513 . 0 0 "[ . 1 . 2 . 3]" 1
338 1 28 ALA MB 1 29 ALA HA 4.000 . 6.500 3.818 3.787 3.857 . 0 0 "[ . 1 . 2 . 3]" 1
339 1 28 ALA MB 1 30 PHE H 4.000 . 6.500 4.437 4.263 4.535 . 0 0 "[ . 1 . 2 . 3]" 1
340 1 28 ALA HA 1 31 LYS QD 4.000 . 6.000 3.448 2.590 5.344 . 0 0 "[ . 1 . 2 . 3]" 1
341 1 29 ALA H 1 30 PHE HB2 4.000 . 5.000 4.994 4.803 5.172 0.172 13 0 "[ . 1 . 2 . 3]" 1
342 1 29 ALA MB 1 30 PHE H 2.500 . 4.400 2.442 2.302 2.566 . 0 0 "[ . 1 . 2 . 3]" 1
343 1 29 ALA MB 1 32 ALA MB 4.000 . 8.000 3.948 3.611 4.383 . 0 0 "[ . 1 . 2 . 3]" 1
344 1 29 ALA MB 1 122 PHE HZ 4.000 . 6.500 2.569 2.153 5.210 . 0 0 "[ . 1 . 2 . 3]" 1
345 1 29 ALA MB 1 122 PHE QE 4.000 . 6.500 3.114 2.256 3.871 . 0 0 "[ . 1 . 2 . 3]" 1
346 1 29 ALA MB 1 131 LEU MD1 3.000 . 6.300 3.371 2.426 4.112 . 0 0 "[ . 1 . 2 . 3]" 1
347 1 30 PHE H 1 30 PHE HB3 3.000 . 3.500 2.590 2.274 2.770 . 0 0 "[ . 1 . 2 . 3]" 1
348 1 30 PHE H 1 30 PHE HB2 3.000 . 3.500 2.529 2.388 2.701 . 0 0 "[ . 1 . 2 . 3]" 1
349 1 30 PHE H 1 30 PHE HD1 4.000 . 5.000 4.547 4.317 4.853 . 0 0 "[ . 1 . 2 . 3]" 1
350 1 30 PHE H 1 30 PHE HD2 4.000 . 5.000 4.876 4.447 5.070 0.070 3 0 "[ . 1 . 2 . 3]" 1
351 1 30 PHE HA 1 30 PHE HD1 4.000 . 5.000 2.413 2.250 4.104 . 0 0 "[ . 1 . 2 . 3]" 1
352 1 30 PHE HB3 1 31 LYS H 3.000 . 3.500 2.507 2.325 2.672 . 0 0 "[ . 1 . 2 . 3]" 1
353 1 30 PHE HB2 1 31 LYS H 4.000 . 5.000 3.832 3.738 3.960 . 0 0 "[ . 1 . 2 . 3]" 1
354 1 30 PHE H 1 31 LYS HB2 4.000 . 5.000 4.858 4.661 4.998 . 0 0 "[ . 1 . 2 . 3]" 1
355 1 30 PHE HD2 1 31 LYS H 4.000 . 5.000 3.806 2.690 5.350 0.350 8 0 "[ . 1 . 2 . 3]" 1
356 1 30 PHE HD2 1 43 ILE MD 4.000 . 6.500 2.829 2.174 5.649 . 0 0 "[ . 1 . 2 . 3]" 1
357 1 30 PHE HB2 1 114 MET ME 4.000 . 6.500 5.447 5.195 5.713 . 0 0 "[ . 1 . 2 . 3]" 1
358 1 30 PHE HD2 1 34 LEU QD 4.000 . 6.500 2.787 2.193 3.885 . 0 0 "[ . 1 . 2 . 3]" 1
359 1 30 PHE HA 1 122 PHE QE 4.000 . 5.000 2.390 2.259 2.794 . 0 0 "[ . 1 . 2 . 3]" 1
360 1 31 LYS HB3 1 31 LYS QE 3.000 . 4.500 3.510 2.213 4.186 . 0 0 "[ . 1 . 2 . 3]" 1
361 1 31 LYS H 1 31 LYS QD 3.000 . 4.500 3.771 3.370 4.260 . 0 0 "[ . 1 . 2 . 3]" 1
362 1 31 LYS H 1 31 LYS QG 3.000 . 4.500 2.299 2.210 2.420 . 0 0 "[ . 1 . 2 . 3]" 1
363 1 31 LYS H 1 31 LYS HB2 2.500 . 2.900 2.420 2.371 2.461 . 0 0 "[ . 1 . 2 . 3]" 1
364 1 31 LYS HB3 1 32 ALA H 4.000 . 5.000 3.546 3.365 3.614 . 0 0 "[ . 1 . 2 . 3]" 1
365 1 31 LYS HB2 1 32 ALA H 3.000 . 3.500 2.642 2.453 2.724 . 0 0 "[ . 1 . 2 . 3]" 1
366 1 31 LYS H 1 43 ILE MD 4.000 . 6.500 5.214 4.659 5.371 . 0 0 "[ . 1 . 2 . 3]" 1
367 1 31 LYS HA 1 43 ILE MG 3.000 . 4.800 3.591 3.168 3.836 . 0 0 "[ . 1 . 2 . 3]" 1
368 1 31 LYS HA 1 34 LEU QD 4.000 . 6.500 2.527 2.148 3.583 . 0 0 "[ . 1 . 2 . 3]" 1
369 1 31 LYS QG 1 43 ILE MG 3.000 . 5.800 2.791 2.269 4.099 . 0 0 "[ . 1 . 2 . 3]" 1
370 1 31 LYS HA 1 43 ILE HB 4.000 . 5.000 4.283 3.879 4.811 . 0 0 "[ . 1 . 2 . 3]" 1
371 1 31 LYS HA 1 34 LEU HG 4.000 . 5.000 3.488 2.965 4.435 . 0 0 "[ . 1 . 2 . 3]" 1
372 1 32 ALA H 1 33 PHE H 4.000 . 5.000 2.592 2.478 2.814 . 0 0 "[ . 1 . 2 . 3]" 1
373 1 32 ALA MB 1 127 PHE HZ 4.000 . 6.500 4.451 2.800 5.308 . 0 0 "[ . 1 . 2 . 3]" 1
374 1 33 PHE H 1 33 PHE QD 4.000 . 5.000 4.175 4.052 4.211 . 0 0 "[ . 1 . 2 . 3]" 1
375 1 33 PHE H 1 33 PHE QB 3.000 . 4.100 2.270 2.222 2.313 . 0 0 "[ . 1 . 2 . 3]" 1
376 1 33 PHE QB 1 34 LEU H 3.000 . 4.500 2.540 2.400 2.695 . 0 0 "[ . 1 . 2 . 3]" 1
377 1 33 PHE QD 1 34 LEU H 4.000 . 5.000 3.462 3.194 4.043 . 0 0 "[ . 1 . 2 . 3]" 1
378 1 33 PHE H 1 34 LEU HG 4.000 . 5.000 4.615 4.439 4.863 . 0 0 "[ . 1 . 2 . 3]" 1
379 1 33 PHE QD 1 34 LEU QD 3.000 . 4.800 2.845 2.297 3.551 . 0 0 "[ . 1 . 2 . 3]" 1
380 1 34 LEU HA 1 34 LEU QD 3.000 . 4.800 2.129 2.041 2.227 . 0 0 "[ . 1 . 2 . 3]" 1
381 1 34 LEU H 1 34 LEU QD 4.000 . 6.500 3.127 3.000 3.245 . 0 0 "[ . 1 . 2 . 3]" 1
382 1 34 LEU H 1 34 LEU HB2 3.000 . 3.500 2.474 2.365 2.570 . 0 0 "[ . 1 . 2 . 3]" 1
383 1 34 LEU H 1 34 LEU HB3 4.000 . 5.000 3.631 3.596 3.659 . 0 0 "[ . 1 . 2 . 3]" 1
384 1 34 LEU H 1 34 LEU HG 3.000 . 3.500 2.295 2.133 2.544 . 0 0 "[ . 1 . 2 . 3]" 1
385 1 34 LEU QD 1 35 LYS H 4.000 . 6.500 4.102 4.017 4.224 . 0 0 "[ . 1 . 2 . 3]" 1
386 1 34 LEU HB3 1 35 LYS H 4.000 . 5.000 3.596 3.506 3.732 . 0 0 "[ . 1 . 2 . 3]" 1
387 1 34 LEU HB2 1 35 LYS H 4.000 . 5.000 2.629 2.491 2.830 . 0 0 "[ . 1 . 2 . 3]" 1
388 1 34 LEU HG 1 35 LYS H 4.000 . 5.000 4.364 4.166 4.597 . 0 0 "[ . 1 . 2 . 3]" 1
389 1 34 LEU HB3 1 39 SER H 4.000 . 5.000 3.136 2.632 3.489 . 0 0 "[ . 1 . 2 . 3]" 1
390 1 34 LEU HB3 1 40 GLU H 4.000 . 5.000 3.436 2.823 3.955 . 0 0 "[ . 1 . 2 . 3]" 1
391 1 34 LEU QD 1 42 ASN H 4.000 . 6.500 3.900 3.413 4.686 . 0 0 "[ . 1 . 2 . 3]" 1
392 1 34 LEU QD 1 43 ILE H 4.000 . 6.500 2.807 2.364 3.929 . 0 0 "[ . 1 . 2 . 3]" 1
393 1 34 LEU HB3 1 40 GLU HA 4.000 . 5.000 2.698 2.294 3.778 . 0 0 "[ . 1 . 2 . 3]" 1
394 1 34 LEU QD 1 43 ILE MD 4.000 . 8.000 3.017 2.351 4.304 . 0 0 "[ . 1 . 2 . 3]" 1
395 1 34 LEU QD 1 40 GLU HB3 4.000 . 6.500 4.305 3.561 5.061 . 0 0 "[ . 1 . 2 . 3]" 1
396 1 34 LEU QD 1 43 ILE HB 4.000 . 6.500 2.206 2.006 3.541 . 0 0 "[ . 1 . 2 . 3]" 1
397 1 34 LEU QD 1 37 GLU HB2 4.000 . 6.500 3.536 2.635 3.979 . 0 0 "[ . 1 . 2 . 3]" 1
398 1 34 LEU QD 1 37 GLU QG 4.000 . 7.500 4.586 3.186 5.181 . 0 0 "[ . 1 . 2 . 3]" 1
399 1 34 LEU QD 1 43 ILE MG 3.000 . 6.300 2.610 2.014 3.812 . 0 0 "[ . 1 . 2 . 3]" 1
400 1 34 LEU QD 1 39 SER HB3 4.000 . 6.500 2.734 2.201 3.479 . 0 0 "[ . 1 . 2 . 3]" 1
401 1 34 LEU QD 1 39 SER HB2 4.000 . 6.500 2.602 2.081 3.565 . 0 0 "[ . 1 . 2 . 3]" 1
402 1 34 LEU QD 1 40 GLU HA 4.000 . 6.500 2.650 2.132 3.749 . 0 0 "[ . 1 . 2 . 3]" 1
403 1 35 LYS H 1 35 LYS QB 2.500 . 3.500 2.319 2.194 2.467 . 0 0 "[ . 1 . 2 . 3]" 1
404 1 35 LYS H 1 35 LYS QG 3.000 . 4.500 3.203 2.080 4.092 . 0 0 "[ . 1 . 2 . 3]" 1
405 1 35 LYS HA 1 35 LYS QG 3.000 . 3.900 2.337 2.255 2.766 . 0 0 "[ . 1 . 2 . 3]" 1
406 1 35 LYS QB 1 36 SER H 2.500 . 3.900 2.599 2.509 2.739 . 0 0 "[ . 1 . 2 . 3]" 1
407 1 35 LYS QG 1 36 SER H 4.000 . 6.000 3.925 3.632 4.226 . 0 0 "[ . 1 . 2 . 3]" 1
408 1 35 LYS HA 1 38 TYR HA 4.000 . 5.000 2.978 2.704 3.556 . 0 0 "[ . 1 . 2 . 3]" 1
409 1 36 SER H 1 37 GLU QG 4.000 . 6.000 4.524 4.012 5.517 . 0 0 "[ . 1 . 2 . 3]" 1
410 1 36 SER H 1 37 GLU HB2 4.000 . 5.000 4.863 4.729 5.019 0.019 28 0 "[ . 1 . 2 . 3]" 1
411 1 37 GLU HA 1 37 GLU QG 3.000 . 3.900 2.359 2.294 2.918 . 0 0 "[ . 1 . 2 . 3]" 1
412 1 37 GLU H 1 37 GLU QG 3.000 . 4.500 2.698 2.550 3.425 . 0 0 "[ . 1 . 2 . 3]" 1
413 1 37 GLU H 1 37 GLU HB2 3.000 . 3.500 2.444 2.377 2.540 . 0 0 "[ . 1 . 2 . 3]" 1
414 1 37 GLU HB3 1 39 SER H 4.000 . 5.000 3.968 3.442 4.418 . 0 0 "[ . 1 . 2 . 3]" 1
415 1 37 GLU HB2 1 39 SER H 4.000 . 5.000 3.128 2.695 3.418 . 0 0 "[ . 1 . 2 . 3]" 1
416 1 37 GLU QG 1 39 SER H 4.000 . 6.000 4.931 4.603 5.170 . 0 0 "[ . 1 . 2 . 3]" 1
417 1 37 GLU HB3 1 38 TYR H 4.000 . 5.000 4.287 4.192 4.386 . 0 0 "[ . 1 . 2 . 3]" 1
418 1 37 GLU HB2 1 38 TYR H 4.000 . 5.000 3.634 3.466 3.738 . 0 0 "[ . 1 . 2 . 3]" 1
419 1 37 GLU QG 1 38 TYR H 4.000 . 6.000 4.366 4.273 4.740 . 0 0 "[ . 1 . 2 . 3]" 1
420 1 37 GLU QG 1 39 SER QB 4.000 . 7.000 4.778 4.209 5.336 . 0 0 "[ . 1 . 2 . 3]" 1
421 1 38 TYR H 1 38 TYR HB2 3.000 . 3.500 3.565 3.508 3.642 0.142 10 0 "[ . 1 . 2 . 3]" 1
422 1 38 TYR H 1 38 TYR HD1 4.000 . 5.000 4.154 3.210 4.454 . 0 0 "[ . 1 . 2 . 3]" 1
423 1 38 TYR HA 1 38 TYR HE1 4.000 . 5.000 4.792 4.512 5.565 0.565 26 1 "[ . 1 . 2 .+ 3]" 1
424 1 38 TYR HB3 1 38 TYR HE1 4.000 . 5.000 4.772 4.705 5.455 0.455 26 0 "[ . 1 . 2 . 3]" 1
425 1 38 TYR HB2 1 38 TYR HE2 4.000 . 5.000 4.712 4.665 5.452 0.452 26 0 "[ . 1 . 2 . 3]" 1
426 1 38 TYR HA 1 38 TYR HD2 4.000 . 5.000 4.137 2.912 4.431 . 0 0 "[ . 1 . 2 . 3]" 1
427 1 38 TYR HB3 1 39 SER H 4.000 . 5.000 4.485 4.459 4.513 . 0 0 "[ . 1 . 2 . 3]" 1
428 1 38 TYR HB2 1 39 SER H 4.000 . 5.000 4.104 3.892 4.219 . 0 0 "[ . 1 . 2 . 3]" 1
429 1 39 SER H 1 39 SER QB 3.000 . 4.100 2.581 2.199 3.062 . 0 0 "[ . 1 . 2 . 3]" 1
430 1 39 SER QB 1 40 GLU H 4.000 . 6.000 3.891 3.647 4.040 . 0 0 "[ . 1 . 2 . 3]" 1
431 1 39 SER H 1 40 GLU HB3 4.000 . 5.000 4.514 4.266 4.735 . 0 0 "[ . 1 . 2 . 3]" 1
432 1 40 GLU H 1 40 GLU HB2 4.000 . 5.000 3.625 3.608 3.640 . 0 0 "[ . 1 . 2 . 3]" 1
433 1 40 GLU H 1 40 GLU HB3 3.000 . 3.500 2.593 2.496 2.656 . 0 0 "[ . 1 . 2 . 3]" 1
434 1 40 GLU H 1 40 GLU QG 3.000 . 4.500 2.233 1.844 3.191 . 0 0 "[ . 1 . 2 . 3]" 1
435 1 40 GLU HB2 1 41 GLU H 4.000 . 5.000 4.013 3.793 4.154 . 0 0 "[ . 1 . 2 . 3]" 1
436 1 40 GLU HB3 1 41 GLU H 4.000 . 5.000 4.129 3.992 4.297 . 0 0 "[ . 1 . 2 . 3]" 1
437 1 40 GLU HB2 1 43 ILE H 4.000 . 5.000 5.021 4.767 5.176 0.176 29 0 "[ . 1 . 2 . 3]" 1
438 1 40 GLU HB2 1 44 ASP H 4.000 . 5.000 4.738 4.246 5.043 0.043 15 0 "[ . 1 . 2 . 3]" 1
439 1 40 GLU HA 1 43 ILE MG 3.000 . 4.800 2.634 2.246 3.371 . 0 0 "[ . 1 . 2 . 3]" 1
440 1 40 GLU HB2 1 43 ILE MG 3.000 . 4.800 3.299 2.855 3.621 . 0 0 "[ . 1 . 2 . 3]" 1
441 1 40 GLU HB3 1 43 ILE MG 4.000 . 6.500 4.200 3.799 4.697 . 0 0 "[ . 1 . 2 . 3]" 1
442 1 40 GLU QG 1 43 ILE MG 4.000 . 7.500 4.359 3.994 4.634 . 0 0 "[ . 1 . 2 . 3]" 1
443 1 41 GLU H 1 41 GLU HB3 2.500 . 2.900 2.613 2.433 2.841 . 0 0 "[ . 1 . 2 . 3]" 1
444 1 41 GLU H 1 41 GLU QG 2.500 . 3.900 2.132 1.785 2.673 . 0 0 "[ . 1 . 2 . 3]" 1
445 1 41 GLU QG 1 42 ASN H 2.500 . 4.000 2.065 1.850 2.285 . 0 0 "[ . 1 . 2 . 3]" 1
446 1 41 GLU H 1 42 ASN HB2 4.000 . 5.000 4.723 4.642 4.814 . 0 0 "[ . 1 . 2 . 3]" 1
447 1 41 GLU HB3 1 42 ASN H 4.000 . 5.000 4.002 3.788 4.210 . 0 0 "[ . 1 . 2 . 3]" 1
448 1 41 GLU HB2 1 42 ASN H 4.000 . 5.000 3.817 3.689 3.908 . 0 0 "[ . 1 . 2 . 3]" 1
449 1 41 GLU HA 1 81 VAL QG 4.000 . 6.500 4.064 3.552 4.407 . 0 0 "[ . 1 . 2 . 3]" 1
450 1 41 GLU QG 1 81 VAL QG 3.000 . 5.800 2.468 1.997 3.139 . 0 0 "[ . 1 . 2 . 3]" 1
451 1 41 GLU QG 1 81 VAL HA 4.000 . 6.000 2.761 2.251 3.282 . 0 0 "[ . 1 . 2 . 3]" 1
452 1 41 GLU HB2 1 81 VAL QG 4.000 . 6.500 2.397 2.111 2.769 . 0 0 "[ . 1 . 2 . 3]" 1
453 1 41 GLU HB2 1 42 ASN HA 4.000 . 5.000 4.549 4.352 4.674 . 0 0 "[ . 1 . 2 . 3]" 1
454 1 41 GLU HB3 1 79 LYS QD 4.000 . 6.000 3.792 2.402 5.074 . 0 0 "[ . 1 . 2 . 3]" 1
455 1 42 ASN H 1 42 ASN HB2 2.500 . 2.900 2.416 2.377 2.451 . 0 0 "[ . 1 . 2 . 3]" 1
456 1 42 ASN HB3 1 43 ILE H 3.000 . 3.500 3.468 3.275 3.603 0.103 15 0 "[ . 1 . 2 . 3]" 1
457 1 42 ASN HB2 1 43 ILE H 3.000 . 3.500 2.592 2.425 2.734 . 0 0 "[ . 1 . 2 . 3]" 1
458 1 42 ASN H 1 43 ILE MG 4.000 . 6.500 4.259 3.838 4.532 . 0 0 "[ . 1 . 2 . 3]" 1
459 1 42 ASN HA 1 110 ILE MD 4.000 . 6.500 3.256 2.659 3.684 . 0 0 "[ . 1 . 2 . 3]" 1
460 1 42 ASN HA 1 110 ILE MG 4.000 . 6.500 3.309 2.698 4.001 . 0 0 "[ . 1 . 2 . 3]" 1
461 1 42 ASN HB3 1 110 ILE MG 4.000 . 6.500 2.322 2.115 2.734 . 0 0 "[ . 1 . 2 . 3]" 1
462 1 42 ASN HB3 1 114 MET ME 4.000 . 6.500 4.080 3.192 4.846 . 0 0 "[ . 1 . 2 . 3]" 1
463 1 42 ASN HB2 1 114 MET ME 4.000 . 6.500 4.644 3.812 5.347 . 0 0 "[ . 1 . 2 . 3]" 1
464 1 42 ASN HA 1 81 VAL QG 4.000 . 6.500 3.239 2.591 3.779 . 0 0 "[ . 1 . 2 . 3]" 1
465 1 42 ASN QB 1 81 VAL QG 4.000 . 7.500 4.668 4.022 5.218 . 0 0 "[ . 1 . 2 . 3]" 1
466 1 43 ILE H 1 43 ILE MG 2.500 . 4.400 2.259 1.847 2.500 . 0 0 "[ . 1 . 2 . 3]" 1
467 1 43 ILE H 1 43 ILE MD 4.000 . 6.500 4.011 3.819 4.242 . 0 0 "[ . 1 . 2 . 3]" 1
468 1 43 ILE H 1 43 ILE HB 3.000 . 3.500 2.547 2.427 2.766 . 0 0 "[ . 1 . 2 . 3]" 1
469 1 43 ILE HB 1 43 ILE MD 3.000 . 4.800 2.237 2.198 2.313 . 0 0 "[ . 1 . 2 . 3]" 1
470 1 43 ILE HA 1 43 ILE MD 3.000 . 4.800 2.188 2.119 2.246 . 0 0 "[ . 1 . 2 . 3]" 1
471 1 43 ILE HB 1 44 ASP H 4.000 . 5.000 3.885 3.753 4.051 . 0 0 "[ . 1 . 2 . 3]" 1
472 1 43 ILE H 1 44 ASP HB2 4.000 . 5.000 4.729 4.663 4.803 . 0 0 "[ . 1 . 2 . 3]" 1
473 1 43 ILE MG 1 44 ASP H 2.500 . 4.400 1.974 1.822 2.124 . 0 0 "[ . 1 . 2 . 3]" 1
474 1 43 ILE MD 1 44 ASP H 4.000 . 6.500 4.718 4.493 4.822 . 0 0 "[ . 1 . 2 . 3]" 1
475 1 43 ILE MG 1 45 PHE H 4.000 . 6.500 4.178 4.062 4.300 . 0 0 "[ . 1 . 2 . 3]" 1
476 1 43 ILE MD 1 47 ILE H 4.000 . 6.500 4.192 3.699 4.658 . 0 0 "[ . 1 . 2 . 3]" 1
477 1 43 ILE MG 1 47 ILE H 4.000 . 6.500 4.754 4.404 5.142 . 0 0 "[ . 1 . 2 . 3]" 1
478 1 43 ILE MD 1 46 TRP HE3 4.000 . 6.500 2.488 2.151 3.376 . 0 0 "[ . 1 . 2 . 3]" 1
479 1 43 ILE MD 1 46 TRP HZ3 4.000 . 6.500 3.690 2.914 4.703 . 0 0 "[ . 1 . 2 . 3]" 1
480 1 43 ILE MG 1 44 ASP HA 4.000 . 6.500 3.202 3.045 3.508 . 0 0 "[ . 1 . 2 . 3]" 1
481 1 43 ILE MG 1 44 ASP HB2 4.000 . 6.500 3.802 3.713 3.898 . 0 0 "[ . 1 . 2 . 3]" 1
482 1 43 ILE HA 1 46 TRP HE3 4.000 . 5.000 3.993 3.531 4.458 . 0 0 "[ . 1 . 2 . 3]" 1
483 1 43 ILE HA 1 114 MET ME 4.000 . 6.500 4.659 4.183 5.193 . 0 0 "[ . 1 . 2 . 3]" 1
484 1 43 ILE MD 1 114 MET ME 3.000 . 6.300 3.563 2.938 4.246 . 0 0 "[ . 1 . 2 . 3]" 1
485 1 43 ILE MD 1 46 TRP HB3 4.000 . 6.500 2.635 2.281 3.166 . 0 0 "[ . 1 . 2 . 3]" 1
486 1 43 ILE MD 1 46 TRP HB2 4.000 . 6.500 3.523 3.111 4.089 . 0 0 "[ . 1 . 2 . 3]" 1
487 1 43 ILE QG 1 47 ILE MD 3.000 . 5.800 2.746 2.273 3.158 . 0 0 "[ . 1 . 2 . 3]" 1
488 1 43 ILE HA 1 46 TRP QB 4.000 . 6.000 2.230 2.161 2.360 . 0 0 "[ . 1 . 2 . 3]" 1
489 1 44 ASP H 1 44 ASP HB2 2.500 . 2.900 2.432 2.403 2.453 . 0 0 "[ . 1 . 2 . 3]" 1
490 1 44 ASP HB2 1 45 PHE H 2.500 . 2.900 2.554 2.470 2.602 . 0 0 "[ . 1 . 2 . 3]" 1
491 1 44 ASP HB3 1 47 ILE MD 4.000 . 6.500 4.406 4.183 4.589 . 0 0 "[ . 1 . 2 . 3]" 1
492 1 44 ASP HA 1 47 ILE MD 3.000 . 4.800 2.351 2.280 2.504 . 0 0 "[ . 1 . 2 . 3]" 1
493 1 44 ASP HB2 1 81 VAL QG 4.000 . 6.500 4.852 4.357 5.048 . 0 0 "[ . 1 . 2 . 3]" 1
494 1 44 ASP HA 1 47 ILE MG 4.000 . 6.500 4.254 4.024 4.447 . 0 0 "[ . 1 . 2 . 3]" 1
495 1 44 ASP HB2 1 46 TRP H 4.000 . 5.000 4.932 4.843 5.015 0.015 16 0 "[ . 1 . 2 . 3]" 1
496 1 44 ASP QB 1 72 PHE QE 4.000 . 8.000 2.632 2.220 3.093 . 0 0 "[ . 1 . 2 . 3]" 1
497 1 44 ASP QB 1 47 ILE MG 4.000 . 7.500 5.316 5.114 5.485 . 0 0 "[ . 1 . 2 . 3]" 1
498 1 45 PHE H 1 45 PHE HB3 2.500 . 2.900 2.467 2.375 2.596 . 0 0 "[ . 1 . 2 . 3]" 1
499 1 45 PHE H 1 45 PHE HB2 2.500 . 2.900 2.592 2.440 2.701 . 0 0 "[ . 1 . 2 . 3]" 1
500 1 45 PHE H 1 45 PHE QD 4.000 . 5.000 4.178 4.151 4.198 . 0 0 "[ . 1 . 2 . 3]" 1
501 1 45 PHE HB3 1 46 TRP H 4.000 . 5.000 2.550 2.448 2.641 . 0 0 "[ . 1 . 2 . 3]" 1
502 1 45 PHE HB2 1 46 TRP H 4.000 . 5.000 3.863 3.760 3.957 . 0 0 "[ . 1 . 2 . 3]" 1
503 1 45 PHE H 1 81 VAL QG 4.000 . 6.500 4.030 3.801 4.305 . 0 0 "[ . 1 . 2 . 3]" 1
504 1 45 PHE H 1 72 PHE QD 5.000 3.000 6.000 4.637 4.272 5.167 . 0 0 "[ . 1 . 2 . 3]" 1
505 1 45 PHE H 1 72 PHE QE 4.000 . 5.000 3.663 3.038 4.533 . 0 0 "[ . 1 . 2 . 3]" 1
506 1 45 PHE H 1 72 PHE HZ 5.000 3.000 6.000 4.845 4.413 5.373 . 0 0 "[ . 1 . 2 . 3]" 1
507 1 45 PHE QD 1 46 TRP H 4.000 . 5.000 3.312 3.035 3.683 . 0 0 "[ . 1 . 2 . 3]" 1
508 1 45 PHE QB 1 48 SER H 4.000 . 6.000 5.023 4.883 5.190 . 0 0 "[ . 1 . 2 . 3]" 1
509 1 45 PHE QE 1 107 GLN H 5.000 3.000 6.000 3.490 3.020 4.113 . 0 0 "[ . 1 . 2 . 3]" 1
510 1 45 PHE QE 1 110 ILE H 4.000 . 5.000 4.972 4.816 5.070 0.070 30 0 "[ . 1 . 2 . 3]" 1
511 1 45 PHE QD 1 73 ILE MD 4.000 . 6.500 4.107 3.685 4.479 . 0 0 "[ . 1 . 2 . 3]" 1
512 1 45 PHE QD 1 110 ILE MD 4.000 . 6.500 3.685 3.315 4.145 . 0 0 "[ . 1 . 2 . 3]" 1
513 1 45 PHE QD 1 81 VAL QG 3.000 . 4.800 2.639 2.285 3.065 . 0 0 "[ . 1 . 2 . 3]" 1
514 1 45 PHE QB 1 81 VAL QG 4.000 . 7.500 2.263 2.053 2.551 . 0 0 "[ . 1 . 2 . 3]" 1
515 1 45 PHE QD 1 110 ILE MG 3.000 . 4.800 3.601 3.282 3.743 . 0 0 "[ . 1 . 2 . 3]" 1
516 1 45 PHE QB 1 110 ILE MG 4.000 . 7.500 4.001 3.505 4.467 . 0 0 "[ . 1 . 2 . 3]" 1
517 1 45 PHE QD 1 107 GLN HA 4.000 . 5.000 3.944 3.174 4.795 . 0 0 "[ . 1 . 2 . 3]" 1
518 1 45 PHE QD 1 106 ALA MB 4.000 . 6.500 4.285 4.034 4.857 . 0 0 "[ . 1 . 2 . 3]" 1
519 1 45 PHE QD 1 110 ILE HB 4.000 . 5.000 4.312 3.941 4.644 . 0 0 "[ . 1 . 2 . 3]" 1
520 1 45 PHE QD 1 68 ILE MG 3.000 . 4.800 3.456 3.000 4.042 . 0 0 "[ . 1 . 2 . 3]" 1
521 1 45 PHE HA 1 81 VAL QG 4.000 . 6.500 4.146 3.915 4.409 . 0 0 "[ . 1 . 2 . 3]" 1
522 1 45 PHE QD 1 83 LEU MD1 4.000 . 6.500 4.288 3.998 4.542 . 0 0 "[ . 1 . 2 . 3]" 1
523 1 45 PHE QD 1 110 ILE QG 4.000 . 6.000 2.463 2.287 2.779 . 0 0 "[ . 1 . 2 . 3]" 1
524 1 46 TRP HB3 1 47 ILE H 4.000 . 5.000 2.522 2.386 2.605 . 0 0 "[ . 1 . 2 . 3]" 1
525 1 46 TRP HB2 1 47 ILE H 4.000 . 5.000 3.839 3.719 3.915 . 0 0 "[ . 1 . 2 . 3]" 1
526 1 46 TRP HE3 1 47 ILE HA 4.000 . 5.000 3.297 2.819 4.055 . 0 0 "[ . 1 . 2 . 3]" 1
527 1 46 TRP HE3 1 47 ILE H 4.000 . 5.000 3.350 3.098 3.791 . 0 0 "[ . 1 . 2 . 3]" 1
528 1 46 TRP HE3 1 47 ILE MD 4.000 . 6.500 3.959 3.730 4.263 . 0 0 "[ . 1 . 2 . 3]" 1
529 1 46 TRP HE3 1 47 ILE MG 4.000 . 6.500 4.596 4.229 5.176 . 0 0 "[ . 1 . 2 . 3]" 1
530 1 46 TRP HZ3 1 47 ILE MD 4.000 . 6.500 4.641 4.327 5.083 . 0 0 "[ . 1 . 2 . 3]" 1
531 1 46 TRP H 1 110 ILE MG 4.000 . 6.500 4.307 3.912 4.730 . 0 0 "[ . 1 . 2 . 3]" 1
532 1 46 TRP HE1 1 111 PHE HE1 4.000 . 5.000 2.497 1.785 3.271 0.015 19 0 "[ . 1 . 2 . 3]" 1
533 1 46 TRP HE1 1 111 PHE HD1 4.000 . 5.000 4.478 3.458 5.054 0.054 27 0 "[ . 1 . 2 . 3]" 1
534 1 46 TRP HE1 1 111 PHE HZ 4.000 . 5.000 3.354 2.579 4.170 . 0 0 "[ . 1 . 2 . 3]" 1
535 1 46 TRP HE1 1 107 GLN QG 4.000 . 6.000 3.421 2.384 3.889 . 0 0 "[ . 1 . 2 . 3]" 1
536 1 46 TRP HE1 1 107 GLN QB 4.000 . 6.000 4.963 3.451 5.429 . 0 0 "[ . 1 . 2 . 3]" 1
537 1 46 TRP QB 1 110 ILE MG 4.000 . 7.500 3.255 2.494 3.844 . 0 0 "[ . 1 . 2 . 3]" 1
538 1 47 ILE HB 1 47 ILE MD 3.000 . 4.800 2.290 2.236 2.360 . 0 0 "[ . 1 . 2 . 3]" 1
539 1 47 ILE H 1 47 ILE HG13 4.000 . 6.000 2.222 2.111 2.328 . 0 0 "[ . 1 . 2 . 3]" 1
540 1 47 ILE H 1 47 ILE HG12 4.000 . 6.000 3.590 3.494 3.701 . 0 0 "[ . 1 . 2 . 3]" 1
541 1 47 ILE H 1 47 ILE MD 3.000 . 5.000 3.437 3.350 3.492 . 0 0 "[ . 1 . 2 . 3]" 1
542 1 47 ILE H 1 47 ILE HB 3.000 . 3.500 2.456 2.416 2.512 . 0 0 "[ . 1 . 2 . 3]" 1
543 1 47 ILE HA 1 47 ILE MD 4.000 . 6.500 3.822 3.804 3.847 . 0 0 "[ . 1 . 2 . 3]" 1
544 1 47 ILE HA 1 47 ILE MG 3.000 . 4.400 2.391 2.321 2.431 . 0 0 "[ . 1 . 2 . 3]" 1
545 1 47 ILE HB 1 48 SER H 2.500 . 2.900 2.591 2.436 2.692 . 0 0 "[ . 1 . 2 . 3]" 1
546 1 47 ILE MG 1 48 SER H 3.000 . 5.000 3.310 3.157 3.489 . 0 0 "[ . 1 . 2 . 3]" 1
547 1 47 ILE MD 1 48 SER H 4.000 . 6.500 4.448 4.343 4.559 . 0 0 "[ . 1 . 2 . 3]" 1
548 1 47 ILE HG13 1 48 SER H 4.000 . 6.000 4.336 4.205 4.420 . 0 0 "[ . 1 . 2 . 3]" 1
549 1 47 ILE HG12 1 48 SER H 4.000 . 6.000 5.035 4.955 5.097 . 0 0 "[ . 1 . 2 . 3]" 1
550 1 47 ILE MG 1 48 SER HA 4.000 . 6.500 3.373 3.273 3.528 . 0 0 "[ . 1 . 2 . 3]" 1
551 1 47 ILE MG 1 50 GLU QB 4.000 . 7.500 3.667 3.358 5.023 . 0 0 "[ . 1 . 2 . 3]" 1
552 1 47 ILE MG 1 48 SER HB3 4.000 . 6.500 4.264 4.037 4.566 . 0 0 "[ . 1 . 2 . 3]" 1
553 1 48 SER H 1 48 SER HB3 2.500 . 2.900 2.506 2.462 2.659 . 0 0 "[ . 1 . 2 . 3]" 1
554 1 48 SER H 1 48 SER HB2 4.000 . 5.000 3.618 3.599 3.632 . 0 0 "[ . 1 . 2 . 3]" 1
555 1 48 SER HB2 1 68 ILE MD 4.000 . 6.500 2.460 2.077 3.270 . 0 0 "[ . 1 . 2 . 3]" 1
556 1 48 SER HB2 1 68 ILE MG 4.000 . 6.500 3.110 2.700 3.523 . 0 0 "[ . 1 . 2 . 3]" 1
557 1 49 CYS H 1 49 CYS QB 3.000 . 4.100 2.346 2.207 2.606 . 0 0 "[ . 1 . 2 . 3]" 1
558 1 49 CYS HA 1 103 PHE QD 4.000 . 5.000 4.480 3.756 4.802 . 0 0 "[ . 1 . 2 . 3]" 1
559 1 49 CYS QB 1 50 GLU H 4.000 . 6.000 2.736 2.451 3.501 . 0 0 "[ . 1 . 2 . 3]" 1
560 1 50 GLU H 1 50 GLU QB 3.000 . 4.100 2.351 2.268 2.414 . 0 0 "[ . 1 . 2 . 3]" 1
561 1 50 GLU QB 1 51 GLU H 3.000 . 4.500 2.517 2.329 3.429 . 0 0 "[ . 1 . 2 . 3]" 1
562 1 51 GLU H 1 51 GLU HB2 2.500 . 2.900 2.431 2.348 2.452 . 0 0 "[ . 1 . 2 . 3]" 1
563 1 51 GLU H 1 51 GLU HB3 4.000 . 5.000 3.613 3.590 3.625 . 0 0 "[ . 1 . 2 . 3]" 1
564 1 51 GLU H 1 51 GLU QG 2.500 . 3.900 2.318 2.176 3.326 . 0 0 "[ . 1 . 2 . 3]" 1
565 1 51 GLU HB3 1 52 TYR H 4.000 . 5.000 3.573 3.473 3.636 . 0 0 "[ . 1 . 2 . 3]" 1
566 1 51 GLU HB2 1 52 TYR H 3.000 . 3.500 2.608 2.550 2.652 . 0 0 "[ . 1 . 2 . 3]" 1
567 1 51 GLU QG 1 52 TYR H 4.000 . 6.000 4.091 4.008 4.468 . 0 0 "[ . 1 . 2 . 3]" 1
568 1 51 GLU H 1 52 TYR HB3 4.000 . 5.000 4.950 4.863 5.036 0.036 2 0 "[ . 1 . 2 . 3]" 1
569 1 51 GLU H 1 52 TYR HB2 4.000 . 5.000 4.811 4.589 4.992 . 0 0 "[ . 1 . 2 . 3]" 1
570 1 51 GLU HA 1 54 LYS QD 4.000 . 6.000 2.738 2.318 4.304 . 0 0 "[ . 1 . 2 . 3]" 1
571 1 52 TYR HB2 1 52 TYR QE 4.000 . 5.000 4.426 4.415 4.436 . 0 0 "[ . 1 . 2 . 3]" 1
572 1 52 TYR HB3 1 52 TYR QE 4.000 . 5.000 4.455 4.431 4.475 . 0 0 "[ . 1 . 2 . 3]" 1
573 1 52 TYR HA 1 52 TYR QD 4.000 . 5.000 2.998 2.898 3.091 . 0 0 "[ . 1 . 2 . 3]" 1
574 1 52 TYR H 1 52 TYR HB3 2.500 . 2.900 2.675 2.565 2.771 . 0 0 "[ . 1 . 2 . 3]" 1
575 1 52 TYR H 1 52 TYR HB2 2.500 . 2.900 2.376 2.249 2.508 . 0 0 "[ . 1 . 2 . 3]" 1
576 1 52 TYR HB3 1 53 LYS H 3.000 . 3.500 2.561 2.462 2.693 . 0 0 "[ . 1 . 2 . 3]" 1
577 1 52 TYR HB2 1 53 LYS H 4.000 . 5.000 3.746 3.660 3.831 . 0 0 "[ . 1 . 2 . 3]" 1
578 1 52 TYR H 1 53 LYS HB2 4.000 . 5.000 4.796 4.687 4.924 . 0 0 "[ . 1 . 2 . 3]" 1
579 1 52 TYR QD 1 53 LYS H 4.000 . 5.000 3.615 3.281 3.922 . 0 0 "[ . 1 . 2 . 3]" 1
580 1 52 TYR QE 1 100 ILE H 4.000 . 5.000 4.639 4.516 4.791 . 0 0 "[ . 1 . 2 . 3]" 1
581 1 52 TYR QE 1 101 THR H 4.000 . 5.000 4.409 4.027 4.700 . 0 0 "[ . 1 . 2 . 3]" 1
582 1 52 TYR QE 1 102 CYS H 3.000 . 3.500 3.019 2.559 3.448 . 0 0 "[ . 1 . 2 . 3]" 1
583 1 52 TYR QE 1 103 PHE H 4.000 . 5.000 2.982 2.653 3.181 . 0 0 "[ . 1 . 2 . 3]" 1
584 1 52 TYR QE 1 102 CYS HB3 4.000 . 5.000 2.701 2.501 2.991 . 0 0 "[ . 1 . 2 . 3]" 1
585 1 52 TYR QE 1 100 ILE HB 4.000 . 5.000 4.865 4.788 5.003 0.003 10 0 "[ . 1 . 2 . 3]" 1
586 1 52 TYR QE 1 65 ALA MB 4.000 . 6.500 2.360 2.269 3.116 . 0 0 "[ . 1 . 2 . 3]" 1
587 1 52 TYR QD 1 65 ALA MB 4.000 . 6.500 4.048 3.743 4.926 . 0 0 "[ . 1 . 2 . 3]" 1
588 1 52 TYR QE 1 61 LEU MD2 4.000 . 6.500 2.787 2.640 2.869 . 0 0 "[ . 1 . 2 . 3]" 1
589 1 52 TYR QD 1 61 LEU MD2 4.000 . 6.500 2.981 2.858 3.279 . 0 0 "[ . 1 . 2 . 3]" 1
590 1 52 TYR QE 1 100 ILE HA 4.000 . 5.000 2.373 2.311 2.543 . 0 0 "[ . 1 . 2 . 3]" 1
591 1 52 TYR QD 1 100 ILE HA 4.000 . 5.000 3.726 3.401 3.920 . 0 0 "[ . 1 . 2 . 3]" 1
592 1 52 TYR QD 1 64 LYS HB2 4.000 . 5.000 4.584 4.167 5.069 0.069 5 0 "[ . 1 . 2 . 3]" 1
593 1 52 TYR QE 1 65 ALA HA 4.000 . 5.000 3.419 2.989 3.780 . 0 0 "[ . 1 . 2 . 3]" 1
594 1 52 TYR QD 1 100 ILE MD 4.000 . 6.500 2.964 2.517 3.231 . 0 0 "[ . 1 . 2 . 3]" 1
595 1 52 TYR QE 1 100 ILE MD 4.000 . 6.500 3.278 3.168 3.399 . 0 0 "[ . 1 . 2 . 3]" 1
596 1 52 TYR H 1 68 ILE MD 4.000 . 6.500 4.264 3.881 4.777 . 0 0 "[ . 1 . 2 . 3]" 1
597 1 52 TYR QD 1 68 ILE MD 4.000 . 6.500 2.768 2.321 3.057 . 0 0 "[ . 1 . 2 . 3]" 1
598 1 52 TYR HB2 1 68 ILE MD 3.000 . 4.800 3.145 2.675 3.565 . 0 0 "[ . 1 . 2 . 3]" 1
599 1 52 TYR HB3 1 68 ILE MD 4.000 . 6.500 4.443 3.960 4.942 . 0 0 "[ . 1 . 2 . 3]" 1
600 1 52 TYR QE 1 68 ILE MD 4.000 . 6.500 4.097 3.435 4.491 . 0 0 "[ . 1 . 2 . 3]" 1
601 1 52 TYR HA 1 68 ILE MD 4.000 . 6.500 4.547 4.080 4.795 . 0 0 "[ . 1 . 2 . 3]" 1
602 1 52 TYR HA 1 55 ILE MD 2.500 . 4.200 2.604 2.304 2.960 . 0 0 "[ . 1 . 2 . 3]" 1
603 1 52 TYR QD 1 55 ILE MD 4.000 . 6.500 4.147 4.016 4.308 . 0 0 "[ . 1 . 2 . 3]" 1
604 1 52 TYR QE 1 55 ILE MD 4.000 . 6.500 5.080 4.962 5.193 . 0 0 "[ . 1 . 2 . 3]" 1
605 1 52 TYR HA 1 64 LYS QD 4.000 . 6.000 3.085 2.469 4.292 . 0 0 "[ . 1 . 2 . 3]" 1
606 1 53 LYS H 1 53 LYS HB2 2.500 . 2.900 2.394 2.333 2.478 . 0 0 "[ . 1 . 2 . 3]" 1
607 1 53 LYS H 1 53 LYS HB3 4.000 . 5.000 3.609 3.586 3.629 . 0 0 "[ . 1 . 2 . 3]" 1
608 1 53 LYS HA 1 100 ILE MD 2.500 . 4.200 2.313 2.028 2.725 . 0 0 "[ . 1 . 2 . 3]" 1
609 1 53 LYS HB3 1 100 ILE MD 4.000 . 6.500 4.045 2.916 4.662 . 0 0 "[ . 1 . 2 . 3]" 1
610 1 53 LYS QB 1 54 LYS H 4.000 . 6.000 3.022 2.641 3.195 . 0 0 "[ . 1 . 2 . 3]" 1
611 1 53 LYS H 1 100 ILE MD 4.000 . 6.500 4.392 4.006 4.707 . 0 0 "[ . 1 . 2 . 3]" 1
612 1 54 LYS HA 1 54 LYS QD 4.000 . 6.000 3.954 3.946 3.967 . 0 0 "[ . 1 . 2 . 3]" 1
613 1 54 LYS H 1 54 LYS HB2 2.500 . 2.900 2.395 2.368 2.422 . 0 0 "[ . 1 . 2 . 3]" 1
614 1 54 LYS H 1 54 LYS HB3 4.000 . 5.000 3.635 3.590 3.655 . 0 0 "[ . 1 . 2 . 3]" 1
615 1 54 LYS H 1 54 LYS QD 3.000 . 4.500 3.942 3.878 4.272 . 0 0 "[ . 1 . 2 . 3]" 1
616 1 54 LYS HB3 1 55 ILE H 4.000 . 5.000 3.779 3.572 4.051 . 0 0 "[ . 1 . 2 . 3]" 1
617 1 54 LYS HA 1 56 LYS QG 4.000 . 6.000 4.068 3.602 4.433 . 0 0 "[ . 1 . 2 . 3]" 1
618 1 55 ILE H 1 55 ILE HB 2.500 . 2.900 2.434 2.377 2.535 . 0 0 "[ . 1 . 2 . 3]" 1
619 1 55 ILE H 1 55 ILE MG 3.000 . 5.000 3.765 3.750 3.786 . 0 0 "[ . 1 . 2 . 3]" 1
620 1 55 ILE HA 1 55 ILE MG 3.000 . 4.400 2.372 2.292 2.440 . 0 0 "[ . 1 . 2 . 3]" 1
621 1 55 ILE H 1 55 ILE MD 3.000 . 4.800 3.445 3.281 3.578 . 0 0 "[ . 1 . 2 . 3]" 1
622 1 55 ILE H 1 61 LEU MD2 4.000 . 6.500 3.926 3.764 4.674 . 0 0 "[ . 1 . 2 . 3]" 1
623 1 55 ILE MG 1 56 LYS H 3.000 . 5.000 2.929 2.771 3.279 . 0 0 "[ . 1 . 2 . 3]" 1
624 1 55 ILE MD 1 56 LYS H 4.000 . 6.500 5.303 5.193 5.481 . 0 0 "[ . 1 . 2 . 3]" 1
625 1 55 ILE MG 1 57 SER H 2.500 . 4.400 2.074 1.884 2.397 . 0 0 "[ . 1 . 2 . 3]" 1
626 1 55 ILE MG 1 60 LYS H 3.000 . 5.000 3.638 3.513 4.063 . 0 0 "[ . 1 . 2 . 3]" 1
627 1 55 ILE MG 1 61 LEU H 4.000 . 6.500 3.496 3.302 4.005 . 0 0 "[ . 1 . 2 . 3]" 1
628 1 55 ILE HA 1 61 LEU MD2 4.000 . 6.500 4.422 4.218 4.705 . 0 0 "[ . 1 . 2 . 3]" 1
629 1 55 ILE MG 1 61 LEU MD2 3.000 . 6.300 2.095 1.970 2.296 . 0 0 "[ . 1 . 2 . 3]" 1
630 1 55 ILE HB 1 61 LEU MD2 3.000 . 4.800 2.154 2.067 2.887 . 0 0 "[ . 1 . 2 . 3]" 1
631 1 55 ILE MG 1 57 SER HB2 4.000 . 6.500 2.563 2.410 2.745 . 0 0 "[ . 1 . 2 . 3]" 1
632 1 55 ILE MG 1 56 LYS HA 4.000 . 6.500 3.942 3.876 4.059 . 0 0 "[ . 1 . 2 . 3]" 1
633 1 55 ILE MG 1 58 PRO HA 4.000 . 6.500 4.261 4.005 4.730 . 0 0 "[ . 1 . 2 . 3]" 1
634 1 55 ILE MG 1 61 LEU HA 4.000 . 6.500 3.704 3.520 3.911 . 0 0 "[ . 1 . 2 . 3]" 1
635 1 55 ILE MG 1 60 LYS HG3 4.000 . 7.500 4.008 3.565 4.265 . 0 0 "[ . 1 . 2 . 3]" 1
636 1 55 ILE MG 1 60 LYS HG2 4.000 . 7.500 4.593 4.121 4.978 . 0 0 "[ . 1 . 2 . 3]" 1
637 1 55 ILE MG 1 60 LYS QE 4.000 . 7.500 4.239 2.301 5.243 . 0 0 "[ . 1 . 2 . 3]" 1
638 1 55 ILE MG 1 60 LYS HB3 3.000 . 4.800 3.159 2.700 3.503 . 0 0 "[ . 1 . 2 . 3]" 1
639 1 55 ILE MG 1 60 LYS HB2 3.000 . 4.800 2.283 2.187 2.641 . 0 0 "[ . 1 . 2 . 3]" 1
640 1 55 ILE HB 1 100 ILE MD 4.000 . 6.500 4.029 3.614 4.806 . 0 0 "[ . 1 . 2 . 3]" 1
641 1 55 ILE MD 1 64 LYS QE 4.000 . 7.500 2.231 1.949 2.975 . 0 0 "[ . 1 . 2 . 3]" 1
642 1 55 ILE MD 1 64 LYS HB3 4.000 . 6.500 4.233 3.816 4.758 . 0 0 "[ . 1 . 2 . 3]" 1
643 1 55 ILE MD 1 64 LYS HB2 4.000 . 6.500 4.703 4.409 5.307 . 0 0 "[ . 1 . 2 . 3]" 1
644 1 55 ILE MD 1 61 LEU MD2 2.500 . 5.700 2.444 2.233 3.150 . 0 0 "[ . 1 . 2 . 3]" 1
645 1 56 LYS H 1 56 LYS HB2 3.000 . 3.500 2.442 2.369 2.546 . 0 0 "[ . 1 . 2 . 3]" 1
646 1 56 LYS H 1 56 LYS HB3 4.000 . 5.000 3.667 3.631 3.696 . 0 0 "[ . 1 . 2 . 3]" 1
647 1 56 LYS H 1 56 LYS QG 3.000 . 4.500 2.581 2.377 2.703 . 0 0 "[ . 1 . 2 . 3]" 1
648 1 56 LYS HA 1 56 LYS QD 3.000 . 4.500 3.729 2.153 4.166 . 0 0 "[ . 1 . 2 . 3]" 1
649 1 56 LYS HB2 1 57 SER H 3.000 . 3.500 3.538 3.500 3.636 0.136 2 0 "[ . 1 . 2 . 3]" 1
650 1 56 LYS HB3 1 57 SER H 4.000 . 5.000 4.253 4.213 4.330 . 0 0 "[ . 1 . 2 . 3]" 1
651 1 56 LYS QG 1 57 SER H 4.000 . 6.000 4.318 4.243 4.401 . 0 0 "[ . 1 . 2 . 3]" 1
652 1 56 LYS HA 1 100 ILE MD 4.000 . 6.500 2.894 2.189 4.046 . 0 0 "[ . 1 . 2 . 3]" 1
653 1 57 SER H 1 57 SER HB2 2.500 . 2.900 2.402 2.317 2.485 . 0 0 "[ . 1 . 2 . 3]" 1
654 1 57 SER HB3 1 60 LYS H 3.000 . 3.500 3.061 2.937 3.198 . 0 0 "[ . 1 . 2 . 3]" 1
655 1 57 SER HB2 1 60 LYS H 3.000 . 3.500 3.206 2.972 3.437 . 0 0 "[ . 1 . 2 . 3]" 1
656 1 57 SER QB 1 59 SER H 4.000 . 6.000 2.684 2.514 2.885 . 0 0 "[ . 1 . 2 . 3]" 1
657 1 57 SER HB3 1 61 LEU H 4.000 . 5.000 5.028 4.966 5.081 0.081 14 0 "[ . 1 . 2 . 3]" 1
658 1 57 SER HB2 1 61 LEU H 4.000 . 5.000 4.703 4.464 4.890 . 0 0 "[ . 1 . 2 . 3]" 1
659 1 57 SER HA 1 58 PRO QB 4.000 . 6.000 4.840 4.810 4.865 . 0 0 "[ . 1 . 2 . 3]" 1
660 1 57 SER HB2 1 60 LYS HB3 4.000 . 5.000 4.504 3.977 4.953 . 0 0 "[ . 1 . 2 . 3]" 1
661 1 57 SER HB2 1 60 LYS HB2 4.000 . 5.000 2.885 2.412 3.287 . 0 0 "[ . 1 . 2 . 3]" 1
662 1 57 SER HA 1 58 PRO HD3 4.000 . 6.000 2.322 2.296 2.355 . 0 0 "[ . 1 . 2 . 3]" 1
663 1 57 SER HA 1 58 PRO HD2 4.000 . 6.000 2.297 2.273 2.317 . 0 0 "[ . 1 . 2 . 3]" 1
664 1 57 SER HB3 1 58 PRO HD3 4.000 . 6.000 4.455 4.420 4.481 . 0 0 "[ . 1 . 2 . 3]" 1
665 1 57 SER HB3 1 58 PRO HD2 4.000 . 6.000 3.618 3.531 3.692 . 0 0 "[ . 1 . 2 . 3]" 1
666 1 57 SER HB3 1 60 LYS QD 4.000 . 6.000 4.243 3.239 5.320 . 0 0 "[ . 1 . 2 . 3]" 1
667 1 57 SER HB2 1 60 LYS QD 4.000 . 6.000 3.568 2.316 5.224 . 0 0 "[ . 1 . 2 . 3]" 1
668 1 57 SER HB3 1 60 LYS HG3 4.000 . 6.000 3.399 2.828 3.953 . 0 0 "[ . 1 . 2 . 3]" 1
669 1 57 SER HB2 1 60 LYS HG3 4.000 . 6.000 3.242 2.725 3.735 . 0 0 "[ . 1 . 2 . 3]" 1
670 1 57 SER HB3 1 60 LYS HG2 4.000 . 6.000 4.491 2.611 5.409 . 0 0 "[ . 1 . 2 . 3]" 1
671 1 57 SER HB2 1 60 LYS HG2 4.000 . 6.000 4.378 2.814 5.237 . 0 0 "[ . 1 . 2 . 3]" 1
672 1 58 PRO HB3 1 61 LEU MD1 4.000 . 6.500 3.076 2.966 3.286 . 0 0 "[ . 1 . 2 . 3]" 1
673 1 58 PRO HB2 1 61 LEU MD1 4.000 . 6.500 4.034 3.891 4.308 . 0 0 "[ . 1 . 2 . 3]" 1
674 1 58 PRO HA 1 61 LEU HG 4.000 . 5.000 2.380 2.302 2.634 . 0 0 "[ . 1 . 2 . 3]" 1
675 1 58 PRO HA 1 61 LEU HB2 4.000 . 5.000 3.118 2.811 3.434 . 0 0 "[ . 1 . 2 . 3]" 1
676 1 58 PRO HA 1 61 LEU MD1 3.000 . 4.800 2.128 2.076 2.249 . 0 0 "[ . 1 . 2 . 3]" 1
677 1 58 PRO QG 1 59 SER HA 4.000 . 6.000 5.003 4.802 5.211 . 0 0 "[ . 1 . 2 . 3]" 1
678 1 58 PRO QB 1 59 SER HA 4.000 . 6.000 4.148 4.068 4.207 . 0 0 "[ . 1 . 2 . 3]" 1
679 1 59 SER QB 1 60 LYS H 3.000 . 4.500 3.354 2.730 3.674 . 0 0 "[ . 1 . 2 . 3]" 1
680 1 60 LYS HA 1 60 LYS HG3 4.000 . 5.600 3.187 2.805 3.781 . 0 0 "[ . 1 . 2 . 3]" 1
681 1 60 LYS HA 1 60 LYS HG2 4.000 . 5.600 2.540 2.341 2.976 . 0 0 "[ . 1 . 2 . 3]" 1
682 1 60 LYS HA 1 60 LYS QD 4.000 . 6.000 3.454 2.191 4.163 . 0 0 "[ . 1 . 2 . 3]" 1
683 1 60 LYS H 1 60 LYS QG 4.000 . 6.000 2.551 2.348 2.658 . 0 0 "[ . 1 . 2 . 3]" 1
684 1 60 LYS H 1 60 LYS QD 4.000 . 6.000 4.012 3.726 4.501 . 0 0 "[ . 1 . 2 . 3]" 1
685 1 60 LYS H 1 60 LYS HB3 4.000 . 5.000 3.648 3.629 3.671 . 0 0 "[ . 1 . 2 . 3]" 1
686 1 60 LYS H 1 60 LYS HB2 2.500 . 2.900 2.418 2.376 2.504 . 0 0 "[ . 1 . 2 . 3]" 1
687 1 60 LYS HB2 1 61 LEU H 3.000 . 3.500 3.167 3.048 3.271 . 0 0 "[ . 1 . 2 . 3]" 1
688 1 60 LYS HB3 1 61 LEU H 4.000 . 5.000 4.015 3.915 4.158 . 0 0 "[ . 1 . 2 . 3]" 1
689 1 61 LEU H 1 61 LEU MD2 3.000 . 5.000 3.139 2.947 3.231 . 0 0 "[ . 1 . 2 . 3]" 1
690 1 61 LEU H 1 61 LEU MD1 3.000 . 5.000 3.612 3.544 3.651 . 0 0 "[ . 1 . 2 . 3]" 1
691 1 61 LEU H 1 61 LEU HB3 4.000 . 5.000 3.629 3.605 3.644 . 0 0 "[ . 1 . 2 . 3]" 1
692 1 61 LEU H 1 61 LEU HB2 3.000 . 3.500 2.555 2.510 2.600 . 0 0 "[ . 1 . 2 . 3]" 1
693 1 61 LEU H 1 61 LEU HG 4.000 . 5.000 2.089 1.977 2.150 . 0 0 "[ . 1 . 2 . 3]" 1
694 1 61 LEU HA 1 61 LEU MD2 3.000 . 4.800 2.098 2.079 2.115 . 0 0 "[ . 1 . 2 . 3]" 1
695 1 61 LEU HB3 1 61 LEU MD2 3.000 . 4.800 2.331 2.295 2.366 . 0 0 "[ . 1 . 2 . 3]" 1
696 1 61 LEU HB3 1 61 LEU MD1 3.000 . 4.800 2.422 2.374 2.443 . 0 0 "[ . 1 . 2 . 3]" 1
697 1 61 LEU HB2 1 62 SER H 3.000 . 3.500 2.610 2.571 2.654 . 0 0 "[ . 1 . 2 . 3]" 1
698 1 61 LEU HB3 1 62 SER H 4.000 . 5.000 3.698 3.654 3.734 . 0 0 "[ . 1 . 2 . 3]" 1
699 1 61 LEU MD1 1 62 SER H 4.000 . 6.500 4.530 4.484 4.576 . 0 0 "[ . 1 . 2 . 3]" 1
700 1 61 LEU HB3 1 65 ALA H 4.000 . 5.000 4.631 4.411 4.879 . 0 0 "[ . 1 . 2 . 3]" 1
701 1 61 LEU MD1 1 100 ILE H 4.000 . 6.500 3.624 3.258 3.848 . 0 0 "[ . 1 . 2 . 3]" 1
702 1 61 LEU MD1 1 99 THR HB 4.000 . 6.500 4.838 4.548 5.120 . 0 0 "[ . 1 . 2 . 3]" 1
703 1 61 LEU MD1 1 99 THR HA 3.000 . 4.800 3.130 2.755 3.464 . 0 0 "[ . 1 . 2 . 3]" 1
704 1 61 LEU MD1 1 100 ILE HA 3.000 . 4.800 2.725 2.311 3.144 . 0 0 "[ . 1 . 2 . 3]" 1
705 1 61 LEU MD2 1 100 ILE HA 4.000 . 6.500 3.925 3.516 4.348 . 0 0 "[ . 1 . 2 . 3]" 1
706 1 61 LEU MD2 1 100 ILE HB 4.000 . 6.500 5.030 4.426 5.266 . 0 0 "[ . 1 . 2 . 3]" 1
707 1 61 LEU MD1 1 100 ILE MD 3.000 . 6.300 2.997 2.572 3.706 . 0 0 "[ . 1 . 2 . 3]" 1
708 1 61 LEU MD2 1 100 ILE MD 3.000 . 6.300 3.159 2.618 3.982 . 0 0 "[ . 1 . 2 . 3]" 1
709 1 61 LEU MD1 1 99 THR MG 4.000 . 8.000 4.495 4.185 4.762 . 0 0 "[ . 1 . 2 . 3]" 1
710 1 62 SER H 1 62 SER QB 2.500 . 3.500 2.209 2.116 2.888 . 0 0 "[ . 1 . 2 . 3]" 1
711 1 62 SER QB 1 64 LYS H 4.000 . 6.000 5.005 4.847 5.287 . 0 0 "[ . 1 . 2 . 3]" 1
712 1 62 SER H 1 65 ALA H 4.000 . 5.000 4.602 4.501 4.716 . 0 0 "[ . 1 . 2 . 3]" 1
713 1 62 SER QB 1 98 PRO QD 4.000 . 7.000 4.617 3.514 4.943 . 0 0 "[ . 1 . 2 . 3]" 1
714 1 62 SER HA 1 98 PRO QD 4.000 . 6.000 4.812 4.460 5.043 . 0 0 "[ . 1 . 2 . 3]" 1
715 1 62 SER QB 1 98 PRO HB3 4.000 . 6.000 4.678 3.285 5.311 . 0 0 "[ . 1 . 2 . 3]" 1
716 1 62 SER QB 1 98 PRO HB2 4.000 . 6.000 4.575 3.579 4.996 . 0 0 "[ . 1 . 2 . 3]" 1
717 1 62 SER HA 1 98 PRO QG 4.000 . 6.000 2.842 2.513 3.080 . 0 0 "[ . 1 . 2 . 3]" 1
718 1 63 PRO QB 1 64 LYS H 3.000 . 4.500 2.217 2.004 2.484 . 0 0 "[ . 1 . 2 . 3]" 1
719 1 63 PRO HA 1 66 LYS QD 4.000 . 6.000 3.700 3.138 5.142 . 0 0 "[ . 1 . 2 . 3]" 1
720 1 64 LYS H 1 64 LYS HB3 4.000 . 5.000 2.618 2.498 2.765 . 0 0 "[ . 1 . 2 . 3]" 1
721 1 64 LYS HB3 1 65 ALA H 4.000 . 5.000 4.100 3.974 4.281 . 0 0 "[ . 1 . 2 . 3]" 1
722 1 64 LYS HB2 1 65 ALA H 4.000 . 5.000 3.988 3.839 4.245 . 0 0 "[ . 1 . 2 . 3]" 1
723 1 64 LYS H 1 65 ALA MB 4.000 . 6.500 4.323 4.286 4.374 . 0 0 "[ . 1 . 2 . 3]" 1
724 1 65 ALA H 1 65 ALA MB 2.500 . 4.000 2.258 2.212 2.274 . 0 0 "[ . 1 . 2 . 3]" 1
725 1 65 ALA MB 1 66 LYS H 2.500 . 4.400 2.362 2.240 2.466 . 0 0 "[ . 1 . 2 . 3]" 1
726 1 65 ALA H 1 66 LYS HB2 4.000 . 5.000 4.850 4.735 4.934 . 0 0 "[ . 1 . 2 . 3]" 1
727 1 65 ALA H 1 98 PRO QB 4.000 . 6.000 5.324 5.177 5.434 . 0 0 "[ . 1 . 2 . 3]" 1
728 1 65 ALA MB 1 103 PHE QD 4.000 . 6.500 4.412 4.083 4.733 . 0 0 "[ . 1 . 2 . 3]" 1
729 1 65 ALA HA 1 68 ILE MD 4.000 . 6.500 2.950 2.723 3.231 . 0 0 "[ . 1 . 2 . 3]" 1
730 1 65 ALA MB 1 68 ILE MD 4.000 . 8.000 4.140 3.871 4.399 . 0 0 "[ . 1 . 2 . 3]" 1
731 1 65 ALA HA 1 68 ILE MG 4.000 . 6.500 4.115 3.887 4.407 . 0 0 "[ . 1 . 2 . 3]" 1
732 1 65 ALA MB 1 98 PRO QB 4.000 . 7.500 3.203 3.035 3.381 . 0 0 "[ . 1 . 2 . 3]" 1
733 1 65 ALA MB 1 98 PRO QG 4.000 . 7.500 3.672 3.380 4.012 . 0 0 "[ . 1 . 2 . 3]" 1
734 1 65 ALA HA 1 103 PHE HE1 4.000 . 5.000 3.320 2.442 4.840 . 0 0 "[ . 1 . 2 . 3]" 1
735 1 65 ALA MB 1 103 PHE HE1 4.000 . 6.500 2.798 2.227 5.241 . 0 0 "[ . 1 . 2 . 3]" 1
736 1 65 ALA HA 1 103 PHE HZ 4.000 . 5.000 2.962 2.493 3.539 . 0 0 "[ . 1 . 2 . 3]" 1
737 1 65 ALA MB 1 103 PHE HZ 4.000 . 6.500 3.166 2.566 3.794 . 0 0 "[ . 1 . 2 . 3]" 1
738 1 66 LYS H 1 66 LYS QE 4.000 . 6.000 4.559 3.322 4.973 . 0 0 "[ . 1 . 2 . 3]" 1
739 1 66 LYS H 1 66 LYS QG 3.000 . 4.500 2.220 2.056 2.291 . 0 0 "[ . 1 . 2 . 3]" 1
740 1 66 LYS H 1 66 LYS QD 3.000 . 4.500 3.771 3.605 4.187 . 0 0 "[ . 1 . 2 . 3]" 1
741 1 66 LYS H 1 66 LYS HB2 2.500 . 2.900 2.432 2.395 2.491 . 0 0 "[ . 1 . 2 . 3]" 1
742 1 66 LYS HB2 1 67 LYS H 2.500 . 2.900 2.548 2.430 2.630 . 0 0 "[ . 1 . 2 . 3]" 1
743 1 66 LYS HB3 1 70 ASN H 4.000 . 5.000 4.597 4.356 4.795 . 0 0 "[ . 1 . 2 . 3]" 1
744 1 66 LYS HA 1 95 MET ME 3.000 . 4.800 2.175 2.061 2.439 . 0 0 "[ . 1 . 2 . 3]" 1
745 1 66 LYS QG 1 95 MET ME 4.000 . 7.500 2.436 2.175 2.837 . 0 0 "[ . 1 . 2 . 3]" 1
746 1 66 LYS HB3 1 95 MET ME 3.000 . 4.800 3.936 3.669 4.130 . 0 0 "[ . 1 . 2 . 3]" 1
747 1 66 LYS QE 1 95 MET ME 4.000 . 7.500 3.985 3.580 4.745 . 0 0 "[ . 1 . 2 . 3]" 1
748 1 66 LYS QB 1 69 TYR H 4.000 . 6.000 4.999 4.850 5.107 . 0 0 "[ . 1 . 2 . 3]" 1
749 1 67 LYS H 1 67 LYS QG 4.000 . 6.000 2.201 1.961 2.316 . 0 0 "[ . 1 . 2 . 3]" 1
750 1 67 LYS H 1 67 LYS QD 4.000 . 6.000 3.751 3.359 4.278 . 0 0 "[ . 1 . 2 . 3]" 1
751 1 67 LYS H 1 67 LYS HB2 2.500 . 2.900 2.453 2.384 2.592 . 0 0 "[ . 1 . 2 . 3]" 1
752 1 67 LYS HB3 1 68 ILE H 4.000 . 5.000 3.444 3.293 3.598 . 0 0 "[ . 1 . 2 . 3]" 1
753 1 67 LYS HB2 1 68 ILE H 4.000 . 5.000 2.445 2.353 2.652 . 0 0 "[ . 1 . 2 . 3]" 1
754 1 68 ILE HA 1 68 ILE MG 3.000 . 4.400 2.378 2.301 2.443 . 0 0 "[ . 1 . 2 . 3]" 1
755 1 68 ILE H 1 68 ILE MG 4.000 . 6.500 3.766 3.753 3.778 . 0 0 "[ . 1 . 2 . 3]" 1
756 1 68 ILE H 1 68 ILE MD 4.000 . 6.500 3.427 3.340 3.493 . 0 0 "[ . 1 . 2 . 3]" 1
757 1 68 ILE H 1 68 ILE HB 4.000 . 5.000 2.461 2.403 2.547 . 0 0 "[ . 1 . 2 . 3]" 1
758 1 68 ILE MD 1 69 TYR H 4.000 . 6.500 4.326 4.214 4.461 . 0 0 "[ . 1 . 2 . 3]" 1
759 1 68 ILE MG 1 72 PHE H 4.000 . 6.500 3.610 3.302 4.116 . 0 0 "[ . 1 . 2 . 3]" 1
760 1 68 ILE MG 1 73 ILE H 5.000 . 7.500 4.259 4.005 4.632 . 0 0 "[ . 1 . 2 . 3]" 1
761 1 68 ILE HA 1 72 PHE QD 4.000 . 5.000 2.404 2.275 2.807 . 0 0 "[ . 1 . 2 . 3]" 1
762 1 68 ILE MG 1 72 PHE QD 4.000 . 6.500 2.372 2.267 2.604 . 0 0 "[ . 1 . 2 . 3]" 1
763 1 68 ILE MG 1 72 PHE QE 4.000 . 6.500 3.666 3.343 3.962 . 0 0 "[ . 1 . 2 . 3]" 1
764 1 68 ILE MD 1 103 PHE HZ 4.000 . 6.500 4.154 3.485 4.861 . 0 0 "[ . 1 . 2 . 3]" 1
765 1 68 ILE MG 1 103 PHE QD 4.000 . 6.500 3.517 3.220 3.835 . 0 0 "[ . 1 . 2 . 3]" 1
766 1 68 ILE MG 1 72 PHE HB2 4.000 . 6.500 2.760 2.377 3.251 . 0 0 "[ . 1 . 2 . 3]" 1
767 1 69 TYR HA 1 69 TYR QD 4.000 . 5.000 2.939 2.889 3.032 . 0 0 "[ . 1 . 2 . 3]" 1
768 1 69 TYR HA 1 69 TYR QE 4.000 . 5.000 4.646 4.608 4.686 . 0 0 "[ . 1 . 2 . 3]" 1
769 1 69 TYR H 1 69 TYR QD 4.000 . 5.000 4.193 4.179 4.217 . 0 0 "[ . 1 . 2 . 3]" 1
770 1 69 TYR H 1 69 TYR HB3 3.000 . 3.500 2.514 2.469 2.562 . 0 0 "[ . 1 . 2 . 3]" 1
771 1 69 TYR H 1 69 TYR HB2 3.000 . 3.500 2.569 2.509 2.618 . 0 0 "[ . 1 . 2 . 3]" 1
772 1 69 TYR HB3 1 70 ASN H 3.000 . 3.500 2.381 2.320 2.500 . 0 0 "[ . 1 . 2 . 3]" 1
773 1 69 TYR HB2 1 70 ASN H 4.000 . 5.000 3.779 3.723 3.863 . 0 0 "[ . 1 . 2 . 3]" 1
774 1 69 TYR HB3 1 71 GLU H 4.000 . 5.000 4.852 4.707 5.019 0.019 28 0 "[ . 1 . 2 . 3]" 1
775 1 69 TYR QD 1 70 ASN H 3.000 . 3.500 2.978 2.848 3.173 . 0 0 "[ . 1 . 2 . 3]" 1
776 1 69 TYR QD 1 74 SER H 4.000 . 5.000 4.489 3.487 4.822 . 0 0 "[ . 1 . 2 . 3]" 1
777 1 69 TYR QE 1 91 THR H 4.000 . 5.000 4.510 4.268 4.917 . 0 0 "[ . 1 . 2 . 3]" 1
778 1 69 TYR QE 1 73 ILE QG 4.000 . 6.000 3.803 3.610 4.005 . 0 0 "[ . 1 . 2 . 3]" 1
779 1 69 TYR QE 1 73 ILE MG 3.000 . 4.800 2.192 2.152 2.281 . 0 0 "[ . 1 . 2 . 3]" 1
780 1 69 TYR QD 1 73 ILE MG 4.000 . 6.500 2.796 2.576 2.922 . 0 0 "[ . 1 . 2 . 3]" 1
781 1 69 TYR QD 1 95 MET ME 3.000 . 4.800 2.789 2.427 3.152 . 0 0 "[ . 1 . 2 . 3]" 1
782 1 69 TYR QE 1 95 MET ME 4.000 . 6.500 3.855 3.035 4.470 . 0 0 "[ . 1 . 2 . 3]" 1
783 1 69 TYR HB3 1 95 MET ME 4.000 . 6.500 2.172 2.047 2.353 . 0 0 "[ . 1 . 2 . 3]" 1
784 1 69 TYR HB2 1 95 MET ME 4.000 . 6.500 2.409 2.148 3.040 . 0 0 "[ . 1 . 2 . 3]" 1
785 1 69 TYR QE 1 92 SER HA 4.000 . 5.000 3.024 2.571 3.571 . 0 0 "[ . 1 . 2 . 3]" 1
786 1 69 TYR QD 1 73 ILE MD 4.000 . 6.500 4.138 3.630 4.369 . 0 0 "[ . 1 . 2 . 3]" 1
787 1 69 TYR QE 1 74 SER QB 4.000 . 6.000 4.244 2.403 5.278 . 0 0 "[ . 1 . 2 . 3]" 1
788 1 69 TYR QD 1 74 SER QB 4.000 . 6.000 4.294 2.811 5.347 . 0 0 "[ . 1 . 2 . 3]" 1
789 1 69 TYR QD 1 91 THR MG 4.000 . 6.500 2.175 2.049 2.504 . 0 0 "[ . 1 . 2 . 3]" 1
790 1 69 TYR QE 1 91 THR MG 3.000 . 4.800 3.450 3.154 3.720 . 0 0 "[ . 1 . 2 . 3]" 1
791 1 69 TYR HA 1 73 ILE MD 4.000 . 6.500 3.936 3.829 4.072 . 0 0 "[ . 1 . 2 . 3]" 1
792 1 69 TYR QE 1 73 ILE MD 4.000 . 6.500 4.470 3.897 4.676 . 0 0 "[ . 1 . 2 . 3]" 1
793 1 69 TYR HA 1 73 ILE HB 4.000 . 5.000 2.304 2.238 2.339 . 0 0 "[ . 1 . 2 . 3]" 1
794 1 69 TYR QE 1 74 SER HA 4.000 . 5.000 3.714 2.804 4.098 . 0 0 "[ . 1 . 2 . 3]" 1
795 1 69 TYR QD 1 70 ASN HA 4.000 . 5.000 2.801 2.651 2.952 . 0 0 "[ . 1 . 2 . 3]" 1
796 1 69 TYR QE 1 70 ASN HA 4.000 . 5.000 4.070 3.887 4.322 . 0 0 "[ . 1 . 2 . 3]" 1
797 1 69 TYR QE 1 92 SER HB3 4.000 . 5.000 2.582 2.314 2.981 . 0 0 "[ . 1 . 2 . 3]" 1
798 1 69 TYR HB2 1 73 ILE MD 4.000 . 6.500 5.349 4.994 5.493 . 0 0 "[ . 1 . 2 . 3]" 1
799 1 69 TYR HA 1 73 ILE QG 4.000 . 6.000 2.206 2.106 2.354 . 0 0 "[ . 1 . 2 . 3]" 1
800 1 69 TYR H 1 73 ILE HB 4.000 . 5.000 5.032 4.970 5.079 0.079 7 0 "[ . 1 . 2 . 3]" 1
801 1 69 TYR H 1 95 MET ME 4.000 . 6.500 3.676 3.341 4.425 . 0 0 "[ . 1 . 2 . 3]" 1
802 1 69 TYR H 1 103 PHE HE2 4.000 . 5.000 4.469 3.934 5.640 0.640 11 1 "[ . 1+ . 2 . 3]" 1
803 1 69 TYR H 1 103 PHE HZ 4.000 . 5.000 3.466 2.924 4.065 . 0 0 "[ . 1 . 2 . 3]" 1
804 1 69 TYR QD 1 73 ILE QG 4.000 . 6.000 2.615 2.357 2.876 . 0 0 "[ . 1 . 2 . 3]" 1
805 1 69 TYR QD 1 74 SER HA 4.000 . 5.000 4.666 4.226 4.903 . 0 0 "[ . 1 . 2 . 3]" 1
806 1 69 TYR QE 1 91 THR HB 4.000 . 5.000 2.532 2.309 2.968 . 0 0 "[ . 1 . 2 . 3]" 1
807 1 69 TYR QE 1 92 SER H 4.000 . 5.000 2.732 2.449 2.987 . 0 0 "[ . 1 . 2 . 3]" 1
808 1 70 ASN H 1 70 ASN HB3 4.000 . 5.000 3.604 3.592 3.625 . 0 0 "[ . 1 . 2 . 3]" 1
809 1 70 ASN H 1 70 ASN HB2 3.000 . 3.500 2.426 2.387 2.553 . 0 0 "[ . 1 . 2 . 3]" 1
810 1 70 ASN H 1 70 ASN QD 4.000 . 6.000 3.512 3.023 3.781 . 0 0 "[ . 1 . 2 . 3]" 1
811 1 70 ASN HB3 1 71 GLU H 4.000 . 5.000 3.606 3.554 3.827 . 0 0 "[ . 1 . 2 . 3]" 1
812 1 70 ASN HB2 1 71 GLU H 3.000 . 3.500 2.677 2.615 2.770 . 0 0 "[ . 1 . 2 . 3]" 1
813 1 70 ASN HA 1 74 SER H 4.000 . 5.000 3.397 2.839 3.758 . 0 0 "[ . 1 . 2 . 3]" 1
814 1 70 ASN HA 1 74 SER QB 4.000 . 6.000 2.535 2.053 3.645 . 0 0 "[ . 1 . 2 . 3]" 1
815 1 70 ASN HA 1 74 SER HA 4.000 . 5.000 4.110 3.794 4.491 . 0 0 "[ . 1 . 2 . 3]" 1
816 1 71 GLU H 1 71 GLU QG 4.000 . 6.000 3.693 2.452 4.074 . 0 0 "[ . 1 . 2 . 3]" 1
817 1 71 GLU H 1 71 GLU HB3 3.000 . 3.500 2.728 2.470 3.609 0.109 25 0 "[ . 1 . 2 . 3]" 1
818 1 71 GLU H 1 71 GLU HB2 3.000 . 3.500 2.558 2.330 2.656 . 0 0 "[ . 1 . 2 . 3]" 1
819 1 71 GLU QB 1 72 PHE H 3.000 . 4.500 2.357 1.991 3.178 . 0 0 "[ . 1 . 2 . 3]" 1
820 1 71 GLU QG 1 72 PHE H 4.000 . 6.000 3.457 2.894 4.401 . 0 0 "[ . 1 . 2 . 3]" 1
821 1 71 GLU QG 1 78 THR H 4.000 . 6.000 4.818 3.812 5.253 . 0 0 "[ . 1 . 2 . 3]" 1
822 1 71 GLU HA 1 77 ALA MB 4.000 . 6.500 3.572 2.852 3.946 . 0 0 "[ . 1 . 2 . 3]" 1
823 1 72 PHE HA 1 72 PHE QD 4.000 . 5.000 2.864 2.756 2.950 . 0 0 "[ . 1 . 2 . 3]" 1
824 1 72 PHE H 1 72 PHE HB3 4.000 . 5.000 3.652 3.597 3.835 . 0 0 "[ . 1 . 2 . 3]" 1
825 1 72 PHE H 1 72 PHE HB2 3.000 . 3.500 2.428 2.325 2.689 . 0 0 "[ . 1 . 2 . 3]" 1
826 1 72 PHE HB2 1 73 ILE H 4.000 . 5.000 2.961 2.637 3.302 . 0 0 "[ . 1 . 2 . 3]" 1
827 1 72 PHE H 1 73 ILE MD 4.000 . 6.500 4.947 4.505 5.436 . 0 0 "[ . 1 . 2 . 3]" 1
828 1 72 PHE H 1 73 ILE HB 4.000 . 5.000 4.868 4.305 5.093 0.093 8 0 "[ . 1 . 2 . 3]" 1
829 1 72 PHE H 1 73 ILE QG 4.000 . 6.000 4.006 3.517 4.248 . 0 0 "[ . 1 . 2 . 3]" 1
830 1 72 PHE QD 1 81 VAL QG 4.000 . 4.700 2.136 2.020 2.596 . 0 0 "[ . 1 . 2 . 3]" 1
831 1 72 PHE HA 1 81 VAL QG 4.000 . 6.500 3.244 3.027 3.684 . 0 0 "[ . 1 . 2 . 3]" 1
832 1 72 PHE HA 1 77 ALA MB 4.000 . 6.500 2.997 2.533 3.477 . 0 0 "[ . 1 . 2 . 3]" 1
833 1 72 PHE HA 1 80 GLU HA 4.000 . 5.000 3.921 2.784 4.307 . 0 0 "[ . 1 . 2 . 3]" 1
834 1 72 PHE HB2 1 73 ILE MD 4.000 . 6.500 3.549 3.184 4.079 . 0 0 "[ . 1 . 2 . 3]" 1
835 1 73 ILE HA 1 73 ILE MG 3.000 . 4.400 2.284 2.253 2.347 . 0 0 "[ . 1 . 2 . 3]" 1
836 1 73 ILE HA 1 73 ILE MD 3.000 . 4.800 2.117 2.082 2.225 . 0 0 "[ . 1 . 2 . 3]" 1
837 1 73 ILE H 1 73 ILE MD 4.000 . 6.500 3.446 3.309 3.789 . 0 0 "[ . 1 . 2 . 3]" 1
838 1 73 ILE H 1 73 ILE HG13 4.000 . 6.000 3.809 3.539 3.946 . 0 0 "[ . 1 . 2 . 3]" 1
839 1 73 ILE H 1 73 ILE HG12 4.000 . 6.000 2.411 2.293 2.552 . 0 0 "[ . 1 . 2 . 3]" 1
840 1 73 ILE HB 1 74 SER H 3.000 . 3.500 3.141 2.578 3.382 . 0 0 "[ . 1 . 2 . 3]" 1
841 1 73 ILE H 1 74 SER QB 4.000 . 6.000 4.421 4.063 4.724 . 0 0 "[ . 1 . 2 . 3]" 1
842 1 73 ILE H 1 74 SER HA 4.000 . 5.000 4.958 4.869 5.042 0.042 12 0 "[ . 1 . 2 . 3]" 1
843 1 73 ILE MD 1 74 SER H 4.000 . 6.500 4.704 4.633 4.965 . 0 0 "[ . 1 . 2 . 3]" 1
844 1 73 ILE QG 1 74 SER H 4.000 . 6.000 4.225 4.015 4.365 . 0 0 "[ . 1 . 2 . 3]" 1
845 1 73 ILE QG 1 81 VAL H 5.000 . 7.000 6.005 5.628 6.248 . 0 0 "[ . 1 . 2 . 3]" 1
846 1 73 ILE MD 1 103 PHE QD 4.000 . 6.500 4.229 3.366 5.145 . 0 0 "[ . 1 . 2 . 3]" 1
847 1 73 ILE MD 1 91 THR HB 4.000 . 6.500 3.868 3.013 4.122 . 0 0 "[ . 1 . 2 . 3]" 1
848 1 73 ILE MD 1 88 ARG HA 4.000 . 6.500 3.040 2.393 3.604 . 0 0 "[ . 1 . 2 . 3]" 1
849 1 73 ILE MD 1 106 ALA MB 3.000 . 6.300 3.516 3.066 4.011 . 0 0 "[ . 1 . 2 . 3]" 1
850 1 73 ILE MD 1 81 VAL QG 3.000 . 6.300 2.389 2.059 2.727 . 0 0 "[ . 1 . 2 . 3]" 1
851 1 73 ILE QG 1 91 THR HB 4.000 . 6.000 3.297 3.043 3.746 . 0 0 "[ . 1 . 2 . 3]" 1
852 1 73 ILE MD 1 91 THR MG 4.000 . 8.000 3.356 2.717 3.647 . 0 0 "[ . 1 . 2 . 3]" 1
853 1 73 ILE MG 1 91 THR MG 4.000 . 8.000 3.298 2.775 3.686 . 0 0 "[ . 1 . 2 . 3]" 1
854 1 73 ILE QG 1 91 THR MG 4.000 . 7.500 2.382 2.259 2.787 . 0 0 "[ . 1 . 2 . 3]" 1
855 1 73 ILE QG 1 81 VAL QG 3.000 . 5.800 3.841 3.483 4.196 . 0 0 "[ . 1 . 2 . 3]" 1
856 1 73 ILE MG 1 88 ARG HA 4.000 . 6.500 2.673 2.249 3.159 . 0 0 "[ . 1 . 2 . 3]" 1
857 1 73 ILE HA 1 81 VAL QG 4.000 . 6.500 3.306 2.979 3.602 . 0 0 "[ . 1 . 2 . 3]" 1
858 1 73 ILE MG 1 91 THR HB 4.000 . 6.500 2.635 2.309 3.192 . 0 0 "[ . 1 . 2 . 3]" 1
859 1 73 ILE MG 1 74 SER HA 4.000 . 6.500 3.689 3.414 3.841 . 0 0 "[ . 1 . 2 . 3]" 1
860 1 73 ILE MG 1 88 ARG HB3 4.000 . 6.500 2.481 2.199 3.273 . 0 0 "[ . 1 . 2 . 3]" 1
861 1 73 ILE MG 1 88 ARG HB2 4.000 . 6.500 3.874 3.546 4.385 . 0 0 "[ . 1 . 2 . 3]" 1
862 1 73 ILE MD 1 91 THR H 4.000 . 6.500 5.238 4.502 5.429 . 0 0 "[ . 1 . 2 . 3]" 1
863 1 73 ILE MD 1 103 PHE HE2 4.000 . 6.500 3.963 2.886 7.443 0.943 11 2 "[ . 1+ . - 2 . 3]" 1
864 1 73 ILE HA 1 83 LEU MD1 4.000 . 6.500 4.315 3.687 5.404 . 0 0 "[ . 1 . 2 . 3]" 1
865 1 73 ILE QG 1 83 LEU MD1 4.000 . 7.500 4.186 3.630 5.339 . 0 0 "[ . 1 . 2 . 3]" 1
866 1 73 ILE MG 1 88 ARG QD 4.000 . 7.500 3.074 2.264 4.242 . 0 0 "[ . 1 . 2 . 3]" 1
867 1 73 ILE MG 1 81 VAL QG 4.000 . 8.000 4.198 3.819 4.534 . 0 0 "[ . 1 . 2 . 3]" 1
868 1 73 ILE MG 1 88 ARG QG 4.000 . 7.500 2.563 2.217 3.949 . 0 0 "[ . 1 . 2 . 3]" 1
869 1 73 ILE MD 1 88 ARG QG 4.000 . 7.500 2.501 2.211 4.083 . 0 0 "[ . 1 . 2 . 3]" 1
870 1 74 SER H 1 74 SER QB 3.000 . 4.100 2.424 2.240 2.718 . 0 0 "[ . 1 . 2 . 3]" 1
871 1 74 SER QB 1 75 VAL H 3.000 . 4.500 3.379 2.937 3.814 . 0 0 "[ . 1 . 2 . 3]" 1
872 1 74 SER H 1 77 ALA MB 4.000 . 6.500 2.966 2.630 3.422 . 0 0 "[ . 1 . 2 . 3]" 1
873 1 74 SER QB 1 76 GLN H 4.000 . 6.000 2.677 2.216 3.378 . 0 0 "[ . 1 . 2 . 3]" 1
874 1 74 SER QB 1 77 ALA H 4.000 . 6.000 2.894 2.524 3.454 . 0 0 "[ . 1 . 2 . 3]" 1
875 1 74 SER QB 1 77 ALA MB 4.000 . 7.500 2.872 2.224 3.956 . 0 0 "[ . 1 . 2 . 3]" 1
876 1 75 VAL HA 1 75 VAL MG1 3.000 . 4.400 2.354 2.246 2.417 . 0 0 "[ . 1 . 2 . 3]" 1
877 1 75 VAL H 1 75 VAL MG1 2.500 . 4.400 2.085 1.870 2.488 . 0 0 "[ . 1 . 2 . 3]" 1
878 1 75 VAL H 1 75 VAL MG2 2.500 . 4.400 1.971 1.754 2.153 . 0 0 "[ . 1 . 2 . 3]" 1
879 1 75 VAL H 1 75 VAL HB 4.000 . 5.000 3.616 3.577 3.636 . 0 0 "[ . 1 . 2 . 3]" 1
880 1 75 VAL MG1 1 76 GLN QG 4.000 . 7.500 4.618 4.446 4.822 . 0 0 "[ . 1 . 2 . 3]" 1
881 1 75 VAL MG2 1 76 GLN QG 3.000 . 5.800 2.191 2.094 2.302 . 0 0 "[ . 1 . 2 . 3]" 1
882 1 75 VAL MG2 1 76 GLN H 3.000 . 5.000 2.487 2.303 2.722 . 0 0 "[ . 1 . 2 . 3]" 1
883 1 75 VAL MG2 1 76 GLN HA 4.000 . 6.500 3.644 3.460 3.979 . 0 0 "[ . 1 . 2 . 3]" 1
884 1 75 VAL MG1 1 88 ARG HD3 4.000 . 7.500 4.588 3.235 5.888 . 0 0 "[ . 1 . 2 . 3]" 1
885 1 75 VAL MG1 1 88 ARG HD2 4.000 . 7.500 4.646 3.684 6.153 . 0 0 "[ . 1 . 2 . 3]" 1
886 1 75 VAL MG1 1 88 ARG HB2 4.000 . 6.500 5.195 4.657 5.513 . 0 0 "[ . 1 . 2 . 3]" 1
887 1 76 GLN HA 1 76 GLN QG 3.000 . 4.100 2.404 2.307 2.911 . 0 0 "[ . 1 . 2 . 3]" 1
888 1 76 GLN H 1 76 GLN HB2 3.000 . 3.500 2.424 2.387 2.490 . 0 0 "[ . 1 . 2 . 3]" 1
889 1 76 GLN H 1 76 GLN HB3 4.000 . 5.000 3.660 3.639 3.688 . 0 0 "[ . 1 . 2 . 3]" 1
890 1 76 GLN HB2 1 77 ALA H 3.000 . 3.500 3.498 3.182 3.572 0.072 25 0 "[ . 1 . 2 . 3]" 1
891 1 76 GLN HB3 1 77 ALA H 4.000 . 5.000 4.218 4.097 4.267 . 0 0 "[ . 1 . 2 . 3]" 1
892 1 76 GLN HB3 1 77 ALA MB 4.000 . 6.500 5.435 5.334 5.481 . 0 0 "[ . 1 . 2 . 3]" 1
893 1 76 GLN HB2 1 77 ALA MB 4.000 . 6.500 4.892 4.598 4.986 . 0 0 "[ . 1 . 2 . 3]" 1
894 1 77 ALA H 1 77 ALA MB 2.500 . 4.000 2.239 2.157 2.271 . 0 0 "[ . 1 . 2 . 3]" 1
895 1 77 ALA MB 1 78 THR H 3.000 . 5.000 2.940 2.763 3.164 . 0 0 "[ . 1 . 2 . 3]" 1
896 1 77 ALA MB 1 79 LYS H 2.500 . 4.400 2.460 2.332 2.826 . 0 0 "[ . 1 . 2 . 3]" 1
897 1 77 ALA MB 1 80 GLU H 3.000 . 5.000 3.522 3.224 3.954 . 0 0 "[ . 1 . 2 . 3]" 1
898 1 77 ALA MB 1 79 LYS HA 4.000 . 6.500 4.488 4.330 4.770 . 0 0 "[ . 1 . 2 . 3]" 1
899 1 77 ALA MB 1 80 GLU HA 4.000 . 6.500 2.697 2.522 3.464 . 0 0 "[ . 1 . 2 . 3]" 1
900 1 77 ALA MB 1 80 GLU QB 4.000 . 7.500 3.862 3.695 4.159 . 0 0 "[ . 1 . 2 . 3]" 1
901 1 77 ALA MB 1 80 GLU QG 4.000 . 7.500 2.290 2.061 2.886 . 0 0 "[ . 1 . 2 . 3]" 1
902 1 77 ALA MB 1 79 LYS QE 4.000 . 7.500 4.666 4.057 5.472 . 0 0 "[ . 1 . 2 . 3]" 1
903 1 78 THR HA 1 78 THR MG 3.000 . 4.600 2.381 2.279 2.483 . 0 0 "[ . 1 . 2 . 3]" 1
904 1 78 THR H 1 78 THR MG 3.000 . 5.000 2.058 1.854 2.230 . 0 0 "[ . 1 . 2 . 3]" 1
905 1 78 THR HA 1 79 LYS H 4.000 . 5.000 3.445 3.403 3.541 . 0 0 "[ . 1 . 2 . 3]" 1
906 1 78 THR HB 1 79 LYS H 4.000 . 5.000 4.059 3.769 4.161 . 0 0 "[ . 1 . 2 . 3]" 1
907 1 79 LYS H 1 79 LYS QE 4.000 . 6.000 4.264 3.924 4.782 . 0 0 "[ . 1 . 2 . 3]" 1
908 1 79 LYS H 1 79 LYS HB3 3.000 . 3.500 3.390 3.098 3.511 0.011 7 0 "[ . 1 . 2 . 3]" 1
909 1 79 LYS H 1 79 LYS QG 3.000 . 4.500 2.051 1.775 2.208 . 0 0 "[ . 1 . 2 . 3]" 1
910 1 79 LYS HB2 1 80 GLU H 4.000 . 5.000 4.228 4.089 4.358 . 0 0 "[ . 1 . 2 . 3]" 1
911 1 79 LYS QG 1 80 GLU H 4.000 . 6.000 4.269 4.093 4.386 . 0 0 "[ . 1 . 2 . 3]" 1
912 1 80 GLU HB3 1 81 VAL H 3.000 . 3.500 2.970 2.586 3.104 . 0 0 "[ . 1 . 2 . 3]" 1
913 1 80 GLU HA 1 81 VAL QG 4.000 . 6.500 3.210 3.095 3.289 . 0 0 "[ . 1 . 2 . 3]" 1
914 1 80 GLU QG 1 81 VAL QG 4.000 . 7.500 4.490 4.343 4.784 . 0 0 "[ . 1 . 2 . 3]" 1
915 1 80 GLU QG 1 81 VAL H 3.000 . 4.500 3.974 3.822 4.318 . 0 0 "[ . 1 . 2 . 3]" 1
916 1 81 VAL H 1 81 VAL HB 4.000 . 5.000 3.630 3.581 3.728 . 0 0 "[ . 1 . 2 . 3]" 1
917 1 81 VAL H 1 81 VAL QG 2.500 . 4.400 1.775 1.709 1.874 . 0 0 "[ . 1 . 2 . 3]" 1
918 1 81 VAL HA 1 81 VAL QG 3.000 . 4.400 2.244 2.178 2.308 . 0 0 "[ . 1 . 2 . 3]" 1
919 1 81 VAL HB 1 82 ASN H 3.000 . 3.500 2.909 2.617 3.190 . 0 0 "[ . 1 . 2 . 3]" 1
920 1 81 VAL QG 1 82 ASN H 4.000 . 6.500 3.373 3.257 3.450 . 0 0 "[ . 1 . 2 . 3]" 1
921 1 81 VAL QG 1 83 LEU H 4.000 . 6.500 4.060 3.827 4.292 . 0 0 "[ . 1 . 2 . 3]" 1
922 1 81 VAL QG 1 110 ILE MD 3.000 . 6.300 3.322 3.002 3.678 . 0 0 "[ . 1 . 2 . 3]" 1
923 1 81 VAL QG 1 83 LEU MD1 2.500 . 5.700 1.976 1.914 2.059 . 0 0 "[ . 1 . 2 . 3]" 1
924 1 81 VAL QG 1 83 LEU MD2 4.000 . 8.000 3.646 3.378 4.117 . 0 0 "[ . 1 . 2 . 3]" 1
925 1 81 VAL QG 1 106 ALA MB 4.000 . 8.000 4.218 3.643 4.730 . 0 0 "[ . 1 . 2 . 3]" 1
926 1 81 VAL QG 1 83 LEU HG 3.000 . 4.800 2.720 2.276 3.428 . 0 0 "[ . 1 . 2 . 3]" 1
927 1 82 ASN H 1 82 ASN HB3 2.500 . 2.900 2.857 2.633 2.912 0.012 13 0 "[ . 1 . 2 . 3]" 1
928 1 82 ASN H 1 82 ASN HB2 4.000 . 5.000 3.580 3.553 3.630 . 0 0 "[ . 1 . 2 . 3]" 1
929 1 82 ASN HB2 1 83 LEU H 4.000 . 5.000 3.816 3.667 3.960 . 0 0 "[ . 1 . 2 . 3]" 1
930 1 82 ASN HB3 1 83 LEU H 4.000 . 5.000 4.373 4.257 4.492 . 0 0 "[ . 1 . 2 . 3]" 1
931 1 82 ASN H 1 110 ILE MD 4.000 . 6.500 3.874 3.154 4.499 . 0 0 "[ . 1 . 2 . 3]" 1
932 1 82 ASN H 1 113 LEU QD 4.000 . 7.400 4.102 3.800 5.070 . 0 0 "[ . 1 . 2 . 3]" 1
933 1 82 ASN HA 1 113 LEU QD 4.000 . 7.400 4.274 4.015 5.084 . 0 0 "[ . 1 . 2 . 3]" 1
934 1 82 ASN HB2 1 110 ILE MD 4.000 . 6.500 4.809 4.027 5.410 . 0 0 "[ . 1 . 2 . 3]" 1
935 1 82 ASN HB3 1 113 LEU QD 4.000 . 7.400 3.344 2.910 4.384 . 0 0 "[ . 1 . 2 . 3]" 1
936 1 82 ASN HB2 1 113 LEU QD 3.000 . 5.700 2.404 2.038 3.495 . 0 0 "[ . 1 . 2 . 3]" 1
937 1 83 LEU H 1 83 LEU HG 3.000 . 3.500 3.335 3.207 3.534 0.034 10 0 "[ . 1 . 2 . 3]" 1
938 1 83 LEU H 1 83 LEU HB2 3.000 . 3.500 2.773 2.715 2.812 . 0 0 "[ . 1 . 2 . 3]" 1
939 1 83 LEU H 1 83 LEU HB3 4.000 . 5.000 3.868 3.813 3.895 . 0 0 "[ . 1 . 2 . 3]" 1
940 1 83 LEU HA 1 83 LEU MD2 2.500 . 4.200 2.158 2.131 2.198 . 0 0 "[ . 1 . 2 . 3]" 1
941 1 83 LEU HB3 1 83 LEU MD1 3.000 . 4.800 2.447 2.378 2.542 . 0 0 "[ . 1 . 2 . 3]" 1
942 1 83 LEU HB3 1 83 LEU MD2 3.000 . 4.800 2.250 2.210 2.264 . 0 0 "[ . 1 . 2 . 3]" 1
943 1 83 LEU MD1 1 84 ASP H 4.000 . 6.500 4.488 4.260 4.710 . 0 0 "[ . 1 . 2 . 3]" 1
944 1 83 LEU MD2 1 84 ASP H 4.000 . 6.500 3.174 2.973 3.401 . 0 0 "[ . 1 . 2 . 3]" 1
945 1 83 LEU HB3 1 84 ASP H 3.000 . 3.500 2.494 2.247 2.736 . 0 0 "[ . 1 . 2 . 3]" 1
946 1 83 LEU HB2 1 84 ASP H 4.000 . 5.000 3.718 3.568 3.855 . 0 0 "[ . 1 . 2 . 3]" 1
947 1 83 LEU HB3 1 87 THR H 4.000 . 5.000 4.740 4.474 5.105 0.105 9 0 "[ . 1 . 2 . 3]" 1
948 1 83 LEU MD2 1 109 LYS H 4.000 . 6.500 4.134 3.701 4.709 . 0 0 "[ . 1 . 2 . 3]" 1
949 1 83 LEU MD2 1 110 ILE H 4.000 . 6.500 3.448 3.028 3.842 . 0 0 "[ . 1 . 2 . 3]" 1
950 1 83 LEU HA 1 110 ILE MD 4.000 . 6.500 4.144 3.726 4.543 . 0 0 "[ . 1 . 2 . 3]" 1
951 1 83 LEU HG 1 110 ILE MD 3.000 . 4.800 3.066 2.529 3.456 . 0 0 "[ . 1 . 2 . 3]" 1
952 1 83 LEU MD2 1 110 ILE MD 2.500 . 5.700 2.142 1.974 2.356 . 0 0 "[ . 1 . 2 . 3]" 1
953 1 83 LEU HA 1 87 THR HB 4.000 . 5.000 4.581 4.197 5.105 0.105 3 0 "[ . 1 . 2 . 3]" 1
954 1 83 LEU MD1 1 87 THR HB 4.000 . 6.500 3.691 3.229 4.170 . 0 0 "[ . 1 . 2 . 3]" 1
955 1 83 LEU MD2 1 110 ILE HA 4.000 . 6.500 3.762 3.180 4.031 . 0 0 "[ . 1 . 2 . 3]" 1
956 1 83 LEU MD2 1 106 ALA HA 3.000 . 4.800 2.929 2.301 3.460 . 0 0 "[ . 1 . 2 . 3]" 1
957 1 83 LEU MD1 1 88 ARG HA 4.000 . 6.500 4.009 3.525 4.860 . 0 0 "[ . 1 . 2 . 3]" 1
958 1 83 LEU MD2 1 109 LYS QB 3.000 . 5.800 2.110 1.862 2.592 . 0 0 "[ . 1 . 2 . 3]" 1
959 1 83 LEU MD1 1 106 ALA MB 4.000 . 8.000 2.552 2.126 3.139 . 0 0 "[ . 1 . 2 . 3]" 1
960 1 83 LEU MD2 1 106 ALA MB 4.000 . 8.000 2.946 2.309 3.649 . 0 0 "[ . 1 . 2 . 3]" 1
961 1 83 LEU MD2 1 88 ARG QG 4.000 . 7.500 4.530 4.025 5.713 . 0 0 "[ . 1 . 2 . 3]" 1
962 1 83 LEU MD2 1 87 THR MG 3.000 . 6.300 2.746 2.235 3.453 . 0 0 "[ . 1 . 2 . 3]" 1
963 1 83 LEU MD1 1 87 THR MG 4.000 . 8.000 2.697 2.322 3.403 . 0 0 "[ . 1 . 2 . 3]" 1
964 1 83 LEU HA 1 87 THR MG 4.000 . 6.500 4.724 4.138 5.349 . 0 0 "[ . 1 . 2 . 3]" 1
965 1 83 LEU MD1 1 91 THR MG 4.000 . 8.000 5.069 4.701 5.434 . 0 0 "[ . 1 . 2 . 3]" 1
966 1 83 LEU HA 1 113 LEU QD 4.000 . 7.400 3.974 3.062 5.038 . 0 0 "[ . 1 . 2 . 3]" 1
967 1 83 LEU MD2 1 109 LYS QD 4.000 . 7.500 3.859 3.394 4.174 . 0 0 "[ . 1 . 2 . 3]" 1
968 1 83 LEU MD2 1 110 ILE QG 4.000 . 7.500 2.606 2.213 3.069 . 0 0 "[ . 1 . 2 . 3]" 1
969 1 83 LEU MD1 1 88 ARG H 4.000 . 6.500 4.520 4.166 5.268 . 0 0 "[ . 1 . 2 . 3]" 1
970 1 84 ASP QB 1 85 SER H 3.000 . 4.500 2.655 2.371 3.492 . 0 0 "[ . 1 . 2 . 3]" 1
971 1 84 ASP QB 1 86 CYS H 4.000 . 6.000 2.579 2.337 3.081 . 0 0 "[ . 1 . 2 . 3]" 1
972 1 84 ASP QB 1 87 THR H 4.000 . 6.000 2.762 1.992 3.712 . 0 0 "[ . 1 . 2 . 3]" 1
973 1 84 ASP H 1 87 THR HB 4.000 . 5.000 3.004 2.491 3.457 . 0 0 "[ . 1 . 2 . 3]" 1
974 1 85 SER H 1 85 SER QB 3.000 . 4.100 2.400 2.269 2.519 . 0 0 "[ . 1 . 2 . 3]" 1
975 1 85 SER QB 1 86 CYS H 4.000 . 6.000 3.135 2.612 3.690 . 0 0 "[ . 1 . 2 . 3]" 1
976 1 86 CYS H 1 86 CYS QB 2.500 . 3.500 2.430 2.251 2.730 . 0 0 "[ . 1 . 2 . 3]" 1
977 1 86 CYS QB 1 87 THR H 3.000 . 4.500 2.775 2.413 3.530 . 0 0 "[ . 1 . 2 . 3]" 1
978 1 87 THR H 1 87 THR MG 4.000 . 6.500 3.778 3.761 3.789 . 0 0 "[ . 1 . 2 . 3]" 1
979 1 87 THR HB 1 88 ARG H 4.000 . 5.000 2.535 2.406 2.677 . 0 0 "[ . 1 . 2 . 3]" 1
980 1 87 THR MG 1 88 ARG H 4.000 . 6.500 3.416 3.198 3.620 . 0 0 "[ . 1 . 2 . 3]" 1
981 1 87 THR MG 1 90 GLU H 4.000 . 6.500 4.601 4.364 4.752 . 0 0 "[ . 1 . 2 . 3]" 1
982 1 87 THR MG 1 91 THR H 4.000 . 6.500 4.024 3.712 4.299 . 0 0 "[ . 1 . 2 . 3]" 1
983 1 87 THR MG 1 105 GLU H 4.000 . 6.500 5.158 4.619 5.427 . 0 0 "[ . 1 . 2 . 3]" 1
984 1 87 THR MG 1 106 ALA H 4.000 . 6.500 3.614 3.159 3.869 . 0 0 "[ . 1 . 2 . 3]" 1
985 1 87 THR MG 1 109 LYS H 4.000 . 6.500 4.568 4.192 4.987 . 0 0 "[ . 1 . 2 . 3]" 1
986 1 87 THR MG 1 105 GLU QB 3.000 . 5.800 3.153 2.455 3.697 . 0 0 "[ . 1 . 2 . 3]" 1
987 1 87 THR MG 1 105 GLU QG 3.000 . 5.800 3.235 2.128 4.322 . 0 0 "[ . 1 . 2 . 3]" 1
988 1 87 THR MG 1 109 LYS QB 4.000 . 7.500 3.347 2.572 4.013 . 0 0 "[ . 1 . 2 . 3]" 1
989 1 87 THR HB 1 106 ALA MB 4.000 . 6.500 4.821 4.461 5.262 . 0 0 "[ . 1 . 2 . 3]" 1
990 1 87 THR MG 1 106 ALA MB 3.000 . 6.300 2.617 2.247 2.925 . 0 0 "[ . 1 . 2 . 3]" 1
991 1 87 THR HA 1 90 GLU QG 4.000 . 6.000 4.085 2.676 4.622 . 0 0 "[ . 1 . 2 . 3]" 1
992 1 87 THR MG 1 109 LYS QD 4.000 . 7.500 4.364 3.729 4.792 . 0 0 "[ . 1 . 2 . 3]" 1
993 1 87 THR MG 1 106 ALA HA 3.000 . 4.800 2.301 2.114 2.614 . 0 0 "[ . 1 . 2 . 3]" 1
994 1 88 ARG H 1 88 ARG HB3 4.000 . 5.000 3.616 3.575 3.642 . 0 0 "[ . 1 . 2 . 3]" 1
995 1 88 ARG H 1 88 ARG HB2 3.000 . 3.500 2.459 2.286 2.634 . 0 0 "[ . 1 . 2 . 3]" 1
996 1 88 ARG H 1 88 ARG HG3 3.000 . 4.500 2.440 2.048 4.090 . 0 0 "[ . 1 . 2 . 3]" 1
997 1 88 ARG H 1 88 ARG HG2 3.000 . 4.500 3.355 1.842 3.875 . 0 0 "[ . 1 . 2 . 3]" 1
998 1 88 ARG HA 1 88 ARG HG3 4.000 . 5.600 3.023 2.374 3.801 . 0 0 "[ . 1 . 2 . 3]" 1
999 1 88 ARG HA 1 88 ARG HG2 4.000 . 5.600 2.538 2.325 3.679 . 0 0 "[ . 1 . 2 . 3]" 1
1000 1 88 ARG H 1 88 ARG QD 4.000 . 6.000 3.796 1.774 4.347 . 0 0 "[ . 1 . 2 . 3]" 1
1001 1 88 ARG HB2 1 89 GLU H 3.000 . 3.500 2.451 2.263 2.671 . 0 0 "[ . 1 . 2 . 3]" 1
1002 1 88 ARG HB3 1 89 GLU H 4.000 . 5.000 3.427 3.206 3.672 . 0 0 "[ . 1 . 2 . 3]" 1
1003 1 88 ARG QD 1 89 GLU H 4.000 . 6.000 4.747 4.044 5.314 . 0 0 "[ . 1 . 2 . 3]" 1
1004 1 88 ARG QG 1 89 GLU H 4.000 . 6.000 4.039 3.762 4.485 . 0 0 "[ . 1 . 2 . 3]" 1
1005 1 88 ARG QG 1 91 THR H 4.000 . 6.000 5.348 5.235 5.536 . 0 0 "[ . 1 . 2 . 3]" 1
1006 1 88 ARG QB 1 91 THR H 4.000 . 6.000 4.793 4.615 4.954 . 0 0 "[ . 1 . 2 . 3]" 1
1007 1 89 GLU HA 1 89 GLU QG 3.000 . 3.900 2.347 2.296 2.760 . 0 0 "[ . 1 . 2 . 3]" 1
1008 1 89 GLU H 1 89 GLU HB2 2.500 . 2.900 2.426 2.396 2.463 . 0 0 "[ . 1 . 2 . 3]" 1
1009 1 89 GLU H 1 89 GLU HB3 4.000 . 5.000 3.608 3.597 3.621 . 0 0 "[ . 1 . 2 . 3]" 1
1010 1 89 GLU H 1 89 GLU QG 2.500 . 3.900 2.286 2.162 3.109 . 0 0 "[ . 1 . 2 . 3]" 1
1011 1 90 GLU H 1 90 GLU QG 3.000 . 4.500 3.651 2.213 4.074 . 0 0 "[ . 1 . 2 . 3]" 1
1012 1 90 GLU H 1 90 GLU QB 3.000 . 4.100 2.297 2.256 2.418 . 0 0 "[ . 1 . 2 . 3]" 1
1013 1 90 GLU QB 1 91 THR H 3.000 . 4.500 2.577 2.456 2.655 . 0 0 "[ . 1 . 2 . 3]" 1
1014 1 90 GLU QG 1 91 THR H 4.000 . 6.000 3.761 3.415 4.245 . 0 0 "[ . 1 . 2 . 3]" 1
1015 1 90 GLU QG 1 105 GLU QB 4.000 . 7.000 4.496 3.384 5.460 . 0 0 "[ . 1 . 2 . 3]" 1
1016 1 90 GLU H 1 91 THR HG1 4.000 . 6.000 5.086 3.982 5.959 . 0 0 "[ . 1 . 2 . 3]" 1
1017 1 91 THR HA 1 91 THR MG 3.000 . 4.400 2.294 2.233 2.402 . 0 0 "[ . 1 . 2 . 3]" 1
1018 1 91 THR H 1 91 THR HG1 3.000 . 4.500 2.693 1.652 3.443 . 0 0 "[ . 1 . 2 . 3]" 1
1019 1 91 THR H 1 91 THR MG 4.000 . 6.500 3.757 3.700 3.785 . 0 0 "[ . 1 . 2 . 3]" 1
1020 1 91 THR H 1 91 THR HB 2.500 . 2.900 2.749 2.565 2.949 0.049 10 0 "[ . 1 . 2 . 3]" 1
1021 1 91 THR HB 1 92 SER H 2.500 . 2.900 2.578 2.441 2.669 . 0 0 "[ . 1 . 2 . 3]" 1
1022 1 91 THR HG1 1 92 SER H 4.000 . 6.000 4.322 3.577 4.886 . 0 0 "[ . 1 . 2 . 3]" 1
1023 1 91 THR MG 1 102 CYS HB3 4.000 . 6.500 4.771 4.300 5.164 . 0 0 "[ . 1 . 2 . 3]" 1
1024 1 91 THR MG 1 94 ASN H 4.000 . 6.500 4.462 4.226 4.675 . 0 0 "[ . 1 . 2 . 3]" 1
1025 1 91 THR MG 1 95 MET H 4.000 . 6.500 4.358 3.551 4.968 . 0 0 "[ . 1 . 2 . 3]" 1
1026 1 91 THR MG 1 103 PHE HE2 4.000 . 6.500 2.868 2.266 4.276 . 0 0 "[ . 1 . 2 . 3]" 1
1027 1 91 THR MG 1 103 PHE HA 4.000 . 6.500 3.690 3.164 4.463 . 0 0 "[ . 1 . 2 . 3]" 1
1028 1 91 THR MG 1 94 ASN HB2 4.000 . 6.500 3.347 2.975 3.598 . 0 0 "[ . 1 . 2 . 3]" 1
1029 1 91 THR MG 1 92 SER HB3 4.000 . 6.500 5.027 4.700 5.344 . 0 0 "[ . 1 . 2 . 3]" 1
1030 1 91 THR HB 1 95 MET ME 4.000 . 6.500 5.365 4.620 5.624 . 0 0 "[ . 1 . 2 . 3]" 1
1031 1 91 THR MG 1 95 MET ME 4.000 . 8.000 3.818 2.679 4.368 . 0 0 "[ . 1 . 2 . 3]" 1
1032 1 92 SER H 1 92 SER HB3 2.500 . 2.900 2.432 2.306 2.602 . 0 0 "[ . 1 . 2 . 3]" 1
1033 1 92 SER H 1 92 SER HB2 4.000 . 5.000 3.608 3.572 3.633 . 0 0 "[ . 1 . 2 . 3]" 1
1034 1 92 SER QB 1 93 ARG H 4.000 . 6.000 3.383 3.261 3.438 . 0 0 "[ . 1 . 2 . 3]" 1
1035 1 92 SER H 1 93 ARG HB2 4.000 . 5.000 4.846 4.743 5.065 0.065 15 0 "[ . 1 . 2 . 3]" 1
1036 1 92 SER HA 1 95 MET QG 4.000 . 6.000 2.490 2.098 3.522 . 0 0 "[ . 1 . 2 . 3]" 1
1037 1 93 ARG HA 1 93 ARG HG3 4.000 . 5.600 3.105 2.746 3.793 . 0 0 "[ . 1 . 2 . 3]" 1
1038 1 93 ARG HA 1 93 ARG HG2 4.000 . 5.600 2.504 2.310 2.943 . 0 0 "[ . 1 . 2 . 3]" 1
1039 1 93 ARG H 1 93 ARG QD 4.000 . 6.000 3.928 3.498 4.403 . 0 0 "[ . 1 . 2 . 3]" 1
1040 1 93 ARG H 1 93 ARG QG 2.500 . 3.900 2.279 2.047 2.486 . 0 0 "[ . 1 . 2 . 3]" 1
1041 1 93 ARG H 1 93 ARG HB2 2.500 . 2.900 2.420 2.377 2.528 . 0 0 "[ . 1 . 2 . 3]" 1
1042 1 93 ARG HB2 1 94 ASN H 2.500 . 2.900 2.677 2.461 2.907 0.007 6 0 "[ . 1 . 2 . 3]" 1
1043 1 93 ARG QG 1 94 ASN H 4.000 . 6.000 4.096 3.839 4.249 . 0 0 "[ . 1 . 2 . 3]" 1
1044 1 93 ARG H 1 96 LEU QD 4.000 . 7.400 4.954 4.462 5.472 . 0 0 "[ . 1 . 2 . 3]" 1
1045 1 93 ARG HA 1 96 LEU QD 3.000 . 5.700 2.755 2.242 3.373 . 0 0 "[ . 1 . 2 . 3]" 1
1046 1 94 ASN H 1 94 ASN HB2 2.500 . 2.900 2.424 2.388 2.540 . 0 0 "[ . 1 . 2 . 3]" 1
1047 1 94 ASN HB2 1 95 MET H 3.000 . 3.500 3.003 2.652 3.242 . 0 0 "[ . 1 . 2 . 3]" 1
1048 1 94 ASN H 1 96 LEU QD 4.000 . 7.400 5.056 4.392 5.592 . 0 0 "[ . 1 . 2 . 3]" 1
1049 1 94 ASN HB3 1 99 THR H 4.000 . 5.000 3.348 2.893 3.934 . 0 0 "[ . 1 . 2 . 3]" 1
1050 1 94 ASN HB3 1 102 CYS HA 4.000 . 5.000 3.255 2.320 4.224 . 0 0 "[ . 1 . 2 . 3]" 1
1051 1 94 ASN HB2 1 102 CYS HA 4.000 . 5.000 3.869 3.189 4.860 . 0 0 "[ . 1 . 2 . 3]" 1
1052 1 94 ASN HB3 1 102 CYS HB3 4.000 . 5.000 3.918 3.697 4.422 . 0 0 "[ . 1 . 2 . 3]" 1
1053 1 94 ASN HB3 1 98 PRO HA 4.000 . 5.000 3.155 2.329 4.396 . 0 0 "[ . 1 . 2 . 3]" 1
1054 1 95 MET QB 1 95 MET ME 3.000 . 5.800 2.583 2.050 3.668 . 0 0 "[ . 1 . 2 . 3]" 1
1055 1 95 MET H 1 95 MET HB2 3.000 . 3.500 2.561 2.355 2.734 . 0 0 "[ . 1 . 2 . 3]" 1
1056 1 95 MET H 1 95 MET HB3 4.000 . 5.000 3.618 3.593 3.645 . 0 0 "[ . 1 . 2 . 3]" 1
1057 1 95 MET H 1 95 MET QG 3.000 . 4.500 2.088 1.781 3.343 . 0 0 "[ . 1 . 2 . 3]" 1
1058 1 95 MET HB3 1 96 LEU H 4.000 . 5.000 3.782 3.460 3.968 . 0 0 "[ . 1 . 2 . 3]" 1
1059 1 95 MET HB2 1 96 LEU H 4.000 . 5.000 2.742 2.564 2.974 . 0 0 "[ . 1 . 2 . 3]" 1
1060 1 95 MET QG 1 96 LEU H 4.000 . 6.000 4.004 3.740 4.472 . 0 0 "[ . 1 . 2 . 3]" 1
1061 1 95 MET HA 1 98 PRO QD 4.000 . 6.000 3.683 3.481 3.969 . 0 0 "[ . 1 . 2 . 3]" 1
1062 1 95 MET HA 1 98 PRO QB 4.000 . 6.000 3.937 3.593 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
1063 1 95 MET ME 1 103 PHE HZ 4.000 . 6.500 3.963 2.725 4.862 . 0 0 "[ . 1 . 2 . 3]" 1
1064 1 95 MET ME 1 103 PHE HE1 4.000 . 6.500 4.899 3.749 5.506 . 0 0 "[ . 1 . 2 . 3]" 1
1065 1 95 MET HB3 1 96 LEU QD 4.000 . 7.400 4.047 3.250 5.195 . 0 0 "[ . 1 . 2 . 3]" 1
1066 1 95 MET HA 1 98 PRO HA 4.000 . 5.000 3.942 3.290 4.526 . 0 0 "[ . 1 . 2 . 3]" 1
1067 1 95 MET HA 1 98 PRO QG 4.000 . 6.000 3.180 2.718 3.879 . 0 0 "[ . 1 . 2 . 3]" 1
1068 1 96 LEU HA 1 96 LEU QD 3.000 . 5.000 2.267 2.094 2.733 . 0 0 "[ . 1 . 2 . 3]" 1
1069 1 96 LEU H 1 96 LEU QD 3.000 . 5.200 2.717 1.728 3.525 . 0 0 "[ . 1 . 2 . 3]" 1
1070 1 96 LEU H 1 96 LEU HB2 2.500 . 2.900 2.494 2.253 2.643 . 0 0 "[ . 1 . 2 . 3]" 1
1071 1 96 LEU H 1 96 LEU HB3 4.000 . 5.000 3.587 2.793 3.633 . 0 0 "[ . 1 . 2 . 3]" 1
1072 1 96 LEU HB2 1 97 GLU H 3.000 . 3.500 2.830 2.557 3.620 0.120 11 0 "[ . 1 . 2 . 3]" 1
1073 1 96 LEU H 1 98 PRO QD 4.000 . 6.000 4.354 4.115 4.596 . 0 0 "[ . 1 . 2 . 3]" 1
1074 1 96 LEU MD1 1 97 GLU H 4.000 . 6.500 4.405 3.646 4.868 . 0 0 "[ . 1 . 2 . 3]" 1
1075 1 96 LEU MD2 1 97 GLU H 4.000 . 6.500 4.644 4.478 4.824 . 0 0 "[ . 1 . 2 . 3]" 1
1076 1 97 GLU H 1 97 GLU QB 3.000 . 4.100 2.766 2.629 3.258 . 0 0 "[ . 1 . 2 . 3]" 1
1077 1 97 GLU H 1 97 GLU QG 4.000 . 6.000 3.145 2.135 4.334 . 0 0 "[ . 1 . 2 . 3]" 1
1078 1 97 GLU H 1 98 PRO QD 2.500 . 3.900 2.970 2.825 3.066 . 0 0 "[ . 1 . 2 . 3]" 1
1079 1 97 GLU QB 1 99 THR H 4.000 . 6.000 5.095 4.650 5.456 . 0 0 "[ . 1 . 2 . 3]" 1
1080 1 97 GLU HA 1 98 PRO QD 3.000 . 4.300 2.140 2.117 2.162 . 0 0 "[ . 1 . 2 . 3]" 1
1081 1 97 GLU QB 1 98 PRO QD 4.000 . 7.000 3.726 3.661 3.812 . 0 0 "[ . 1 . 2 . 3]" 1
1082 1 97 GLU QG 1 99 THR MG 4.000 . 7.500 4.238 2.298 5.229 . 0 0 "[ . 1 . 2 . 3]" 1
1083 1 97 GLU HB3 1 99 THR MG 4.000 . 6.500 3.472 2.877 4.490 . 0 0 "[ . 1 . 2 . 3]" 1
1084 1 97 GLU HB2 1 99 THR MG 4.000 . 6.500 3.835 2.812 4.769 . 0 0 "[ . 1 . 2 . 3]" 1
1085 1 98 PRO QB 1 99 THR H 3.000 . 4.500 3.496 3.236 3.670 . 0 0 "[ . 1 . 2 . 3]" 1
1086 1 98 PRO HA 1 99 THR MG 4.000 . 6.500 3.809 3.466 4.027 . 0 0 "[ . 1 . 2 . 3]" 1
1087 1 99 THR HA 1 99 THR MG 2.500 . 3.800 2.369 2.292 2.451 . 0 0 "[ . 1 . 2 . 3]" 1
1088 1 99 THR H 1 99 THR MG 3.000 . 5.000 2.848 2.606 3.045 . 0 0 "[ . 1 . 2 . 3]" 1
1089 1 99 THR HB 1 100 ILE H 3.000 . 3.500 2.363 2.189 2.522 . 0 0 "[ . 1 . 2 . 3]" 1
1090 1 99 THR H 1 102 CYS H 4.000 . 5.000 3.568 3.347 3.790 . 0 0 "[ . 1 . 2 . 3]" 1
1091 1 99 THR H 1 102 CYS HB2 4.000 . 5.000 2.138 1.853 2.310 . 0 0 "[ . 1 . 2 . 3]" 1
1092 1 99 THR H 1 102 CYS HA 4.000 . 5.000 4.192 3.999 4.484 . 0 0 "[ . 1 . 2 . 3]" 1
1093 1 99 THR MG 1 100 ILE H 4.000 . 6.500 3.693 3.547 3.926 . 0 0 "[ . 1 . 2 . 3]" 1
1094 1 99 THR MG 1 101 THR H 4.000 . 6.500 4.131 4.042 4.206 . 0 0 "[ . 1 . 2 . 3]" 1
1095 1 99 THR HB 1 100 ILE MG 4.000 . 6.500 3.304 3.060 3.497 . 0 0 "[ . 1 . 2 . 3]" 1
1096 1 99 THR HB 1 101 THR MG 4.000 . 6.500 3.778 3.448 4.053 . 0 0 "[ . 1 . 2 . 3]" 1
1097 1 99 THR MG 1 100 ILE MG 4.000 . 8.000 4.527 4.176 4.754 . 0 0 "[ . 1 . 2 . 3]" 1
1098 1 100 ILE H 1 100 ILE QG 4.000 . 6.000 4.082 4.028 4.098 . 0 0 "[ . 1 . 2 . 3]" 1
1099 1 100 ILE H 1 100 ILE MD 4.000 . 6.500 3.994 3.941 4.100 . 0 0 "[ . 1 . 2 . 3]" 1
1100 1 100 ILE H 1 100 ILE MG 3.000 . 5.000 2.116 1.789 2.239 . 0 0 "[ . 1 . 2 . 3]" 1
1101 1 100 ILE HA 1 100 ILE MD 3.000 . 4.800 2.156 2.096 2.180 . 0 0 "[ . 1 . 2 . 3]" 1
1102 1 100 ILE HA 1 100 ILE MG 3.000 . 4.400 3.198 3.193 3.206 . 0 0 "[ . 1 . 2 . 3]" 1
1103 1 100 ILE HB 1 100 ILE MD 2.500 . 4.200 2.249 2.231 2.350 . 0 0 "[ . 1 . 2 . 3]" 1
1104 1 100 ILE HB 1 101 THR H 4.000 . 5.000 4.076 4.024 4.255 . 0 0 "[ . 1 . 2 . 3]" 1
1105 1 100 ILE MG 1 101 THR H 3.000 . 5.000 2.381 2.259 2.620 . 0 0 "[ . 1 . 2 . 3]" 1
1106 1 100 ILE QG 1 101 THR H 4.000 . 6.000 4.143 4.077 4.251 . 0 0 "[ . 1 . 2 . 3]" 1
1107 1 100 ILE MG 1 102 CYS H 4.000 . 6.500 4.236 4.181 4.369 . 0 0 "[ . 1 . 2 . 3]" 1
1108 1 100 ILE HB 1 102 CYS H 5.000 3.000 6.000 5.454 5.402 5.532 . 0 0 "[ . 1 . 2 . 3]" 1
1109 1 100 ILE MG 1 101 THR MG 3.000 . 6.300 2.091 2.013 2.223 . 0 0 "[ . 1 . 2 . 3]" 1
1110 1 101 THR HA 1 101 THR MG 3.000 . 4.400 2.341 2.297 2.405 . 0 0 "[ . 1 . 2 . 3]" 1
1111 1 101 THR H 1 101 THR MG 3.000 . 5.000 2.384 2.263 2.480 . 0 0 "[ . 1 . 2 . 3]" 1
1112 1 101 THR H 1 102 CYS HA 4.000 . 5.000 4.725 4.640 4.802 . 0 0 "[ . 1 . 2 . 3]" 1
1113 1 101 THR HB 1 104 ASP HB3 4.000 . 5.000 4.702 4.152 4.977 . 0 0 "[ . 1 . 2 . 3]" 1
1114 1 101 THR HB 1 104 ASP HB2 4.000 . 5.000 3.316 2.837 3.579 . 0 0 "[ . 1 . 2 . 3]" 1
1115 1 102 CYS H 1 102 CYS HB3 2.500 . 2.900 2.423 2.327 2.679 . 0 0 "[ . 1 . 2 . 3]" 1
1116 1 102 CYS H 1 102 CYS HB2 2.500 . 2.900 2.670 2.419 2.766 . 0 0 "[ . 1 . 2 . 3]" 1
1117 1 102 CYS HB3 1 103 PHE H 4.000 . 5.000 2.326 2.034 2.655 . 0 0 "[ . 1 . 2 . 3]" 1
1118 1 102 CYS HB2 1 103 PHE H 4.000 . 5.000 3.786 3.531 4.004 . 0 0 "[ . 1 . 2 . 3]" 1
1119 1 102 CYS HB3 1 104 ASP H 4.000 . 5.000 4.440 4.226 4.717 . 0 0 "[ . 1 . 2 . 3]" 1
1120 1 103 PHE H 1 103 PHE HB3 4.000 . 5.000 3.633 3.598 3.658 . 0 0 "[ . 1 . 2 . 3]" 1
1121 1 103 PHE H 1 103 PHE HB2 3.000 . 3.500 2.371 2.305 2.423 . 0 0 "[ . 1 . 2 . 3]" 1
1122 1 103 PHE H 1 103 PHE QD 3.000 . 3.500 2.321 2.099 2.479 . 0 0 "[ . 1 . 2 . 3]" 1
1123 1 103 PHE HA 1 103 PHE QD 4.000 . 5.000 2.968 2.849 3.082 . 0 0 "[ . 1 . 2 . 3]" 1
1124 1 103 PHE HB3 1 104 ASP H 4.000 . 5.000 4.165 4.042 4.254 . 0 0 "[ . 1 . 2 . 3]" 1
1125 1 103 PHE H 1 104 ASP HA 4.000 . 5.000 4.865 4.792 4.929 . 0 0 "[ . 1 . 2 . 3]" 1
1126 1 103 PHE QD 1 104 ASP H 4.000 . 5.000 4.507 4.293 4.628 . 0 0 "[ . 1 . 2 . 3]" 1
1127 1 103 PHE HB2 1 107 GLN H 5.000 3.000 6.000 5.233 4.461 5.614 . 0 0 "[ . 1 . 2 . 3]" 1
1128 1 103 PHE HA 1 106 ALA MB 4.000 . 6.500 2.733 2.392 2.942 . 0 0 "[ . 1 . 2 . 3]" 1
1129 1 103 PHE QD 1 106 ALA MB 4.000 . 6.500 3.091 2.658 3.476 . 0 0 "[ . 1 . 2 . 3]" 1
1130 1 104 ASP H 1 104 ASP HB3 4.000 . 5.000 3.633 3.618 3.645 . 0 0 "[ . 1 . 2 . 3]" 1
1131 1 104 ASP H 1 104 ASP HB2 2.500 . 2.900 2.455 2.374 2.512 . 0 0 "[ . 1 . 2 . 3]" 1
1132 1 104 ASP HB3 1 105 GLU H 4.000 . 5.000 3.585 3.508 3.640 . 0 0 "[ . 1 . 2 . 3]" 1
1133 1 104 ASP HB2 1 105 GLU H 3.000 . 3.500 2.645 2.603 2.735 . 0 0 "[ . 1 . 2 . 3]" 1
1134 1 104 ASP H 1 105 GLU QB 4.000 . 6.000 4.511 4.365 4.779 . 0 0 "[ . 1 . 2 . 3]" 1
1135 1 104 ASP HB2 1 105 GLU HA 4.000 . 5.000 4.406 4.337 4.592 . 0 0 "[ . 1 . 2 . 3]" 1
1136 1 105 GLU QB 1 106 ALA H 3.000 . 4.500 2.640 2.536 3.451 . 0 0 "[ . 1 . 2 . 3]" 1
1137 1 105 GLU H 1 106 ALA MB 4.000 . 6.500 4.356 4.249 4.451 . 0 0 "[ . 1 . 2 . 3]" 1
1138 1 106 ALA H 1 106 ALA MB 2.500 . 4.000 2.239 2.143 2.272 . 0 0 "[ . 1 . 2 . 3]" 1
1139 1 106 ALA MB 1 107 GLN H 3.000 . 5.000 2.451 2.166 2.623 . 0 0 "[ . 1 . 2 . 3]" 1
1140 1 106 ALA MB 1 107 GLN HA 4.000 . 6.500 3.826 3.770 3.868 . 0 0 "[ . 1 . 2 . 3]" 1
1141 1 106 ALA MB 1 108 LYS H 4.000 . 6.500 4.447 4.284 4.564 . 0 0 "[ . 1 . 2 . 3]" 1
1142 1 106 ALA HA 1 109 LYS QD 4.000 . 6.000 5.007 4.760 5.332 . 0 0 "[ . 1 . 2 . 3]" 1
1143 1 107 GLN H 1 107 GLN QB 2.500 . 3.400 2.300 2.262 2.420 . 0 0 "[ . 1 . 2 . 3]" 1
1144 1 107 GLN H 1 107 GLN QG 4.000 . 6.000 3.932 2.282 4.011 . 0 0 "[ . 1 . 2 . 3]" 1
1145 1 107 GLN QB 1 108 LYS H 4.000 . 6.000 2.556 2.442 2.646 . 0 0 "[ . 1 . 2 . 3]" 1
1146 1 107 GLN QG 1 108 LYS H 4.000 . 6.000 3.626 3.497 4.122 . 0 0 "[ . 1 . 2 . 3]" 1
1147 1 107 GLN HA 1 110 ILE QG 4.000 . 6.000 2.795 2.374 3.294 . 0 0 "[ . 1 . 2 . 3]" 1
1148 1 107 GLN QG 1 111 PHE H 4.000 . 6.000 3.784 3.439 5.362 . 0 0 "[ . 1 . 2 . 3]" 1
1149 1 108 LYS H 1 108 LYS QB 2.500 . 3.500 2.267 2.243 2.297 . 0 0 "[ . 1 . 2 . 3]" 1
1150 1 108 LYS H 1 108 LYS QD 4.000 . 6.000 4.475 4.367 4.794 . 0 0 "[ . 1 . 2 . 3]" 1
1151 1 108 LYS H 1 108 LYS QG 4.000 . 6.000 3.979 3.964 3.993 . 0 0 "[ . 1 . 2 . 3]" 1
1152 1 108 LYS HA 1 108 LYS QD 4.000 . 6.000 3.970 3.858 4.179 . 0 0 "[ . 1 . 2 . 3]" 1
1153 1 108 LYS QB 1 109 LYS H 4.000 . 6.000 2.533 2.434 2.602 . 0 0 "[ . 1 . 2 . 3]" 1
1154 1 108 LYS QD 1 109 LYS H 4.000 . 6.000 4.624 4.371 5.208 . 0 0 "[ . 1 . 2 . 3]" 1
1155 1 108 LYS H 1 111 PHE HD1 5.000 3.000 6.000 5.893 5.323 6.122 0.122 24 0 "[ . 1 . 2 . 3]" 1
1156 1 108 LYS QE 1 109 LYS QD 4.000 . 7.000 4.909 3.678 5.668 . 0 0 "[ . 1 . 2 . 3]" 1
1157 1 108 LYS HA 1 111 PHE HD1 4.000 . 5.000 4.633 3.870 5.063 0.063 26 0 "[ . 1 . 2 . 3]" 1
1158 1 109 LYS HA 1 109 LYS QD 3.000 . 4.300 2.195 2.143 2.245 . 0 0 "[ . 1 . 2 . 3]" 1
1159 1 109 LYS H 1 109 LYS QD 3.000 . 4.500 3.760 3.426 4.119 . 0 0 "[ . 1 . 2 . 3]" 1
1160 1 109 LYS H 1 109 LYS QB 3.000 . 4.100 2.405 2.248 2.484 . 0 0 "[ . 1 . 2 . 3]" 1
1161 1 109 LYS QB 1 110 ILE H 2.500 . 3.900 2.613 2.531 2.771 . 0 0 "[ . 1 . 2 . 3]" 1
1162 1 109 LYS H 1 112 ASN HB2 5.000 3.000 6.000 5.100 4.857 5.826 . 0 0 "[ . 1 . 2 . 3]" 1
1163 1 109 LYS QB 1 112 ASN H 4.000 . 6.000 5.002 4.820 5.189 . 0 0 "[ . 1 . 2 . 3]" 1
1164 1 109 LYS QD 1 112 ASN H 4.000 . 6.000 5.169 4.568 5.353 . 0 0 "[ . 1 . 2 . 3]" 1
1165 1 109 LYS QB 1 110 ILE MD 4.000 . 7.500 3.437 3.178 4.094 . 0 0 "[ . 1 . 2 . 3]" 1
1166 1 110 ILE H 1 110 ILE MG 3.000 . 5.000 3.780 3.766 3.800 . 0 0 "[ . 1 . 2 . 3]" 1
1167 1 110 ILE H 1 110 ILE MD 4.000 . 6.500 3.229 3.035 3.704 . 0 0 "[ . 1 . 2 . 3]" 1
1168 1 110 ILE H 1 110 ILE HB 2.500 . 2.900 2.498 2.417 2.590 . 0 0 "[ . 1 . 2 . 3]" 1
1169 1 110 ILE HA 1 110 ILE MD 2.500 . 4.400 2.089 2.062 2.190 . 0 0 "[ . 1 . 2 . 3]" 1
1170 1 110 ILE HB 1 110 ILE MD 3.000 . 4.800 3.229 3.220 3.243 . 0 0 "[ . 1 . 2 . 3]" 1
1171 1 110 ILE HB 1 111 PHE H 4.000 . 5.000 2.541 2.395 2.643 . 0 0 "[ . 1 . 2 . 3]" 1
1172 1 110 ILE QG 1 111 PHE H 4.000 . 6.000 4.011 3.882 4.154 . 0 0 "[ . 1 . 2 . 3]" 1
1173 1 110 ILE MG 1 111 PHE H 4.000 . 6.500 3.366 3.200 3.515 . 0 0 "[ . 1 . 2 . 3]" 1
1174 1 110 ILE MD 1 113 LEU H 4.000 . 6.500 4.790 4.556 4.971 . 0 0 "[ . 1 . 2 . 3]" 1
1175 1 110 ILE MG 1 113 LEU H 4.000 . 6.500 4.680 4.331 4.805 . 0 0 "[ . 1 . 2 . 3]" 1
1176 1 110 ILE MD 1 114 MET H 4.000 . 6.500 4.665 4.161 5.031 . 0 0 "[ . 1 . 2 . 3]" 1
1177 1 110 ILE MG 1 114 MET H 4.000 . 6.500 3.635 3.270 3.891 . 0 0 "[ . 1 . 2 . 3]" 1
1178 1 110 ILE MD 1 113 LEU HG 4.000 . 6.500 4.912 3.544 5.451 . 0 0 "[ . 1 . 2 . 3]" 1
1179 1 110 ILE MD 1 113 LEU MD1 4.000 . 8.000 4.351 2.160 5.295 . 0 0 "[ . 1 . 2 . 3]" 1
1180 1 110 ILE MD 1 113 LEU MD2 3.000 . 6.300 3.208 2.666 4.298 . 0 0 "[ . 1 . 2 . 3]" 1
1181 1 110 ILE HA 1 113 LEU QD 3.000 . 5.700 3.277 2.178 3.941 . 0 0 "[ . 1 . 2 . 3]" 1
1182 1 110 ILE MG 1 114 MET QG 4.000 . 7.500 3.476 2.531 3.730 . 0 0 "[ . 1 . 2 . 3]" 1
1183 1 110 ILE MG 1 114 MET HB3 3.000 . 4.800 3.348 2.634 4.046 . 0 0 "[ . 1 . 2 . 3]" 1
1184 1 110 ILE MG 1 113 LEU HB3 3.000 . 4.800 3.673 3.137 3.955 . 0 0 "[ . 1 . 2 . 3]" 1
1185 1 110 ILE MG 1 114 MET ME 2.500 . 5.700 3.198 2.350 3.637 . 0 0 "[ . 1 . 2 . 3]" 1
1186 1 110 ILE MG 1 111 PHE HE1 4.000 . 6.500 4.364 4.032 5.166 . 0 0 "[ . 1 . 2 . 3]" 1
1187 1 110 ILE MG 1 111 PHE HD1 4.000 . 6.500 3.173 2.773 3.874 . 0 0 "[ . 1 . 2 . 3]" 1
1188 1 111 PHE H 1 111 PHE HB3 3.000 . 3.500 3.477 3.437 3.511 0.011 13 0 "[ . 1 . 2 . 3]" 1
1189 1 111 PHE H 1 111 PHE HB2 3.000 . 3.500 2.150 2.109 2.191 . 0 0 "[ . 1 . 2 . 3]" 1
1190 1 111 PHE H 1 111 PHE HD1 4.000 . 5.000 2.621 2.502 2.699 . 0 0 "[ . 1 . 2 . 3]" 1
1191 1 111 PHE H 1 111 PHE HE1 4.000 . 5.000 5.073 4.964 5.166 0.166 6 0 "[ . 1 . 2 . 3]" 1
1192 1 111 PHE HA 1 111 PHE HD2 4.000 . 5.000 4.020 3.761 4.183 . 0 0 "[ . 1 . 2 . 3]" 1
1193 1 111 PHE QB 1 112 ASN H 3.000 . 4.500 2.541 2.392 2.646 . 0 0 "[ . 1 . 2 . 3]" 1
1194 1 111 PHE H 1 112 ASN HB2 4.000 . 5.000 4.822 4.706 5.007 0.007 2 0 "[ . 1 . 2 . 3]" 1
1195 1 111 PHE HD1 1 112 ASN H 4.000 . 5.000 4.833 4.758 4.931 . 0 0 "[ . 1 . 2 . 3]" 1
1196 1 111 PHE QB 1 113 LEU H 4.000 . 6.000 4.622 4.492 4.729 . 0 0 "[ . 1 . 2 . 3]" 1
1197 1 111 PHE HD1 1 114 MET ME 4.000 . 6.500 4.192 3.144 5.039 . 0 0 "[ . 1 . 2 . 3]" 1
1198 1 111 PHE HA 1 114 MET ME 3.000 . 4.800 3.718 2.849 4.106 . 0 0 "[ . 1 . 2 . 3]" 1
1199 1 111 PHE QB 1 114 MET ME 4.000 . 7.500 5.235 4.448 5.614 . 0 0 "[ . 1 . 2 . 3]" 1
1200 1 112 ASN H 1 112 ASN HB3 4.000 . 5.000 3.601 3.584 3.617 . 0 0 "[ . 1 . 2 . 3]" 1
1201 1 112 ASN H 1 112 ASN HB2 2.500 . 2.900 2.410 2.364 2.471 . 0 0 "[ . 1 . 2 . 3]" 1
1202 1 112 ASN HB3 1 113 LEU H 4.000 . 5.000 3.553 3.453 3.614 . 0 0 "[ . 1 . 2 . 3]" 1
1203 1 112 ASN HB2 1 113 LEU H 3.000 . 3.500 2.626 2.431 2.702 . 0 0 "[ . 1 . 2 . 3]" 1
1204 1 112 ASN HA 1 115 GLU QG 4.000 . 6.000 4.274 3.778 4.813 . 0 0 "[ . 1 . 2 . 3]" 1
1205 1 112 ASN HB3 1 113 LEU HA 4.000 . 5.000 4.318 4.248 4.388 . 0 0 "[ . 1 . 2 . 3]" 1
1206 1 113 LEU HA 1 113 LEU QD 3.000 . 5.000 2.385 1.998 3.099 . 0 0 "[ . 1 . 2 . 3]" 1
1207 1 113 LEU H 1 113 LEU QD 3.000 . 5.200 3.692 3.093 3.776 . 0 0 "[ . 1 . 2 . 3]" 1
1208 1 113 LEU H 1 113 LEU HB2 2.500 . 2.900 2.544 2.245 2.688 . 0 0 "[ . 1 . 2 . 3]" 1
1209 1 113 LEU HB3 1 114 MET H 2.500 . 2.900 2.268 2.089 2.898 . 0 0 "[ . 1 . 2 . 3]" 1
1210 1 113 LEU QD 1 117 ASP H 4.000 . 7.400 4.138 3.517 4.989 . 0 0 "[ . 1 . 2 . 3]" 1
1211 1 113 LEU QD 1 117 ASP QB 4.000 . 8.400 3.174 2.346 3.863 . 0 0 "[ . 1 . 2 . 3]" 1
1212 1 113 LEU HB3 1 114 MET HA 4.000 . 5.000 4.325 4.045 4.465 . 0 0 "[ . 1 . 2 . 3]" 1
1213 1 114 MET HB3 1 114 MET ME 4.000 . 6.500 2.991 2.538 3.730 . 0 0 "[ . 1 . 2 . 3]" 1
1214 1 114 MET HA 1 114 MET ME 4.000 . 6.500 4.585 4.211 5.229 . 0 0 "[ . 1 . 2 . 3]" 1
1215 1 114 MET H 1 114 MET HG3 3.000 . 4.500 3.540 2.188 3.900 . 0 0 "[ . 1 . 2 . 3]" 1
1216 1 114 MET H 1 114 MET HG2 3.000 . 4.500 2.273 1.946 2.819 . 0 0 "[ . 1 . 2 . 3]" 1
1217 1 114 MET H 1 114 MET HB3 2.500 . 2.900 2.521 2.366 2.905 0.005 19 0 "[ . 1 . 2 . 3]" 1
1218 1 114 MET HB2 1 115 GLU H 4.000 . 5.000 3.829 3.500 4.105 . 0 0 "[ . 1 . 2 . 3]" 1
1219 1 114 MET QG 1 115 GLU H 4.000 . 6.000 1.851 1.755 2.025 . 0 0 "[ . 1 . 2 . 3]" 1
1220 1 114 MET HB2 1 118 SER H 4.000 . 5.000 3.920 3.593 4.349 . 0 0 "[ . 1 . 2 . 3]" 1
1221 1 115 GLU H 1 115 GLU QB 3.000 . 4.100 2.296 2.248 2.386 . 0 0 "[ . 1 . 2 . 3]" 1
1222 1 115 GLU H 1 115 GLU QG 3.000 . 4.500 3.638 2.345 4.005 . 0 0 "[ . 1 . 2 . 3]" 1
1223 1 115 GLU QB 1 116 LYS H 2.500 . 3.900 2.535 2.193 2.656 . 0 0 "[ . 1 . 2 . 3]" 1
1224 1 116 LYS H 1 116 LYS QE 4.000 . 6.000 4.636 3.502 5.102 . 0 0 "[ . 1 . 2 . 3]" 1
1225 1 116 LYS H 1 116 LYS HB2 2.500 . 2.900 2.405 2.290 2.554 . 0 0 "[ . 1 . 2 . 3]" 1
1226 1 116 LYS H 1 116 LYS QG 3.000 . 4.500 2.397 2.115 3.559 . 0 0 "[ . 1 . 2 . 3]" 1
1227 1 116 LYS HB2 1 117 ASP H 3.000 . 4.000 2.941 2.675 3.425 . 0 0 "[ . 1 . 2 . 3]" 1
1228 1 116 LYS H 1 117 ASP QB 4.000 . 6.000 4.602 4.184 5.115 . 0 0 "[ . 1 . 2 . 3]" 1
1229 1 116 LYS QG 1 117 ASP H 4.000 . 6.000 4.244 4.058 4.871 . 0 0 "[ . 1 . 2 . 3]" 1
1230 1 117 ASP H 1 117 ASP QB 2.500 . 3.500 2.453 2.297 2.818 . 0 0 "[ . 1 . 2 . 3]" 1
1231 1 117 ASP QB 1 118 SER H 2.500 . 3.900 2.454 1.813 3.556 . 0 0 "[ . 1 . 2 . 3]" 1
1232 1 118 SER H 1 118 SER HB3 3.000 . 3.500 2.404 2.326 2.509 . 0 0 "[ . 1 . 2 . 3]" 1
1233 1 118 SER H 1 118 SER HB2 4.000 . 5.000 3.620 3.588 3.680 . 0 0 "[ . 1 . 2 . 3]" 1
1234 1 118 SER HB2 1 119 TYR H 4.000 . 5.000 3.760 3.406 3.888 . 0 0 "[ . 1 . 2 . 3]" 1
1235 1 118 SER HB2 1 122 PHE QE 4.000 . 5.000 4.452 2.338 5.170 0.170 10 0 "[ . 1 . 2 . 3]" 1
1236 1 119 TYR H 1 119 TYR QB 3.000 . 4.100 2.089 2.001 2.348 . 0 0 "[ . 1 . 2 . 3]" 1
1237 1 119 TYR H 1 119 TYR HD1 4.000 . 5.000 3.088 2.178 4.940 . 0 0 "[ . 1 . 2 . 3]" 1
1238 1 119 TYR HA 1 119 TYR HD1 4.000 . 5.000 2.429 2.311 2.728 . 0 0 "[ . 1 . 2 . 3]" 1
1239 1 119 TYR QB 1 120 ARG H 4.000 . 6.000 2.569 2.396 2.705 . 0 0 "[ . 1 . 2 . 3]" 1
1240 1 119 TYR H 1 120 ARG QG 4.000 . 6.000 4.550 4.166 4.858 . 0 0 "[ . 1 . 2 . 3]" 1
1241 1 119 TYR HD2 1 120 ARG H 4.000 . 5.000 5.096 4.871 5.431 0.431 28 0 "[ . 1 . 2 . 3]" 1
1242 1 119 TYR QE 1 123 LEU MD2 4.000 . 6.500 4.665 3.303 5.125 . 0 0 "[ . 1 . 2 . 3]" 1
1243 1 119 TYR QE 1 123 LEU MD1 4.000 . 6.500 4.584 3.363 5.030 . 0 0 "[ . 1 . 2 . 3]" 1
1244 1 119 TYR HA 1 122 PHE QD 4.000 . 5.000 3.954 2.292 4.411 . 0 0 "[ . 1 . 2 . 3]" 1
1245 1 120 ARG H 1 120 ARG QD 4.000 . 6.000 3.635 2.941 4.225 . 0 0 "[ . 1 . 2 . 3]" 1
1246 1 120 ARG H 1 120 ARG QG 3.000 . 4.500 2.104 1.871 2.289 . 0 0 "[ . 1 . 2 . 3]" 1
1247 1 120 ARG H 1 120 ARG HB2 3.000 . 3.500 2.511 2.421 2.642 . 0 0 "[ . 1 . 2 . 3]" 1
1248 1 120 ARG HB2 1 121 ARG H 3.000 . 3.500 2.575 2.370 2.710 . 0 0 "[ . 1 . 2 . 3]" 1
1249 1 120 ARG HB3 1 121 ARG H 4.000 . 5.000 3.624 3.482 3.754 . 0 0 "[ . 1 . 2 . 3]" 1
1250 1 120 ARG QD 1 123 LEU MD1 4.000 . 7.500 4.372 2.754 5.509 . 0 0 "[ . 1 . 2 . 3]" 1
1251 1 120 ARG QG 1 123 LEU MD1 4.000 . 7.500 4.175 3.499 5.096 . 0 0 "[ . 1 . 2 . 3]" 1
1252 1 120 ARG HA 1 124 LYS QD 4.000 . 6.000 4.921 4.044 5.459 . 0 0 "[ . 1 . 2 . 3]" 1
1253 1 121 ARG H 1 121 ARG HB2 3.000 . 3.500 2.397 2.269 2.502 . 0 0 "[ . 1 . 2 . 3]" 1
1254 1 121 ARG HB2 1 122 PHE H 3.000 . 3.500 2.707 2.610 3.018 . 0 0 "[ . 1 . 2 . 3]" 1
1255 1 121 ARG H 1 122 PHE QB 4.000 . 6.000 4.286 4.168 4.428 . 0 0 "[ . 1 . 2 . 3]" 1
1256 1 122 PHE H 1 122 PHE QB 3.000 . 4.100 2.111 2.073 2.244 . 0 0 "[ . 1 . 2 . 3]" 1
1257 1 122 PHE H 1 122 PHE QD 3.000 . 3.500 3.501 2.948 3.764 0.264 18 0 "[ . 1 . 2 . 3]" 1
1258 1 122 PHE HB3 1 123 LEU H 4.000 . 5.000 2.606 2.174 3.194 . 0 0 "[ . 1 . 2 . 3]" 1
1259 1 122 PHE HB2 1 123 LEU H 4.000 . 5.000 3.202 2.614 3.448 . 0 0 "[ . 1 . 2 . 3]" 1
1260 1 122 PHE QD 1 123 LEU H 4.000 . 5.000 4.285 3.735 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
1261 1 122 PHE QB 1 124 LYS H 4.000 . 6.000 4.501 4.254 4.636 . 0 0 "[ . 1 . 2 . 3]" 1
1262 1 122 PHE QB 1 125 SER H 4.000 . 6.000 4.554 4.343 4.628 . 0 0 "[ . 1 . 2 . 3]" 1
1263 1 123 LEU QB 1 123 LEU MD2 3.000 . 5.800 2.221 2.191 2.249 . 0 0 "[ . 1 . 2 . 3]" 1
1264 1 123 LEU QB 1 123 LEU MD1 3.000 . 5.800 2.101 2.084 2.115 . 0 0 "[ . 1 . 2 . 3]" 1
1265 1 123 LEU HA 1 123 LEU MD2 3.000 . 4.800 2.143 2.105 2.180 . 0 0 "[ . 1 . 2 . 3]" 1
1266 1 123 LEU H 1 123 LEU MD1 4.000 . 6.500 3.474 3.392 3.595 . 0 0 "[ . 1 . 2 . 3]" 1
1267 1 123 LEU H 1 123 LEU MD2 4.000 . 6.500 3.294 3.085 3.502 . 0 0 "[ . 1 . 2 . 3]" 1
1268 1 123 LEU H 1 123 LEU HG 3.000 . 3.500 2.070 1.932 2.230 . 0 0 "[ . 1 . 2 . 3]" 1
1269 1 123 LEU H 1 123 LEU HB2 3.000 . 3.500 2.528 2.433 2.600 . 0 0 "[ . 1 . 2 . 3]" 1
1270 1 123 LEU HB2 1 124 LYS H 4.000 . 5.000 2.684 2.568 3.032 . 0 0 "[ . 1 . 2 . 3]" 1
1271 1 123 LEU H 1 124 LYS QG 4.000 . 6.000 4.322 4.027 4.585 . 0 0 "[ . 1 . 2 . 3]" 1
1272 1 123 LEU MD2 1 124 LYS H 4.000 . 6.500 4.669 4.604 4.727 . 0 0 "[ . 1 . 2 . 3]" 1
1273 1 123 LEU MD1 1 124 LYS H 4.000 . 6.500 4.528 4.397 4.837 . 0 0 "[ . 1 . 2 . 3]" 1
1274 1 123 LEU MD2 1 128 TYR QE 4.000 . 6.500 2.680 2.483 3.200 . 0 0 "[ . 1 . 2 . 3]" 1
1275 1 123 LEU HA 1 128 TYR QD 4.000 . 5.000 2.895 2.543 3.375 . 0 0 "[ . 1 . 2 . 3]" 1
1276 1 123 LEU MD2 1 128 TYR QD 4.000 . 6.500 3.288 2.779 3.954 . 0 0 "[ . 1 . 2 . 3]" 1
1277 1 123 LEU HA 1 124 LYS QG 4.000 . 6.000 4.761 4.556 4.954 . 0 0 "[ . 1 . 2 . 3]" 1
1278 1 123 LEU HA 1 129 LEU QD 4.000 . 6.500 4.492 3.903 4.852 . 0 0 "[ . 1 . 2 . 3]" 1
1279 1 124 LYS H 1 124 LYS HB3 4.000 . 5.000 3.657 3.611 3.721 . 0 0 "[ . 1 . 2 . 3]" 1
1280 1 124 LYS H 1 124 LYS HB2 3.000 . 3.500 2.478 2.359 2.673 . 0 0 "[ . 1 . 2 . 3]" 1
1281 1 124 LYS HA 1 124 LYS QD 4.000 . 6.000 3.677 2.124 4.143 . 0 0 "[ . 1 . 2 . 3]" 1
1282 1 124 LYS HB3 1 125 SER H 4.000 . 5.000 4.309 4.093 4.454 . 0 0 "[ . 1 . 2 . 3]" 1
1283 1 124 LYS HB2 1 125 SER H 4.000 . 5.000 3.559 3.240 3.965 . 0 0 "[ . 1 . 2 . 3]" 1
1284 1 124 LYS QG 1 125 SER H 4.000 . 6.000 4.290 4.155 4.467 . 0 0 "[ . 1 . 2 . 3]" 1
1285 1 124 LYS HA 1 129 LEU QD 3.000 . 4.800 2.702 2.150 3.201 . 0 0 "[ . 1 . 2 . 3]" 1
1286 1 125 SER QB 1 127 PHE H 4.000 . 6.000 2.956 2.526 3.797 . 0 0 "[ . 1 . 2 . 3]" 1
1287 1 125 SER QB 1 126 ARG H 3.000 . 4.500 2.745 2.309 3.524 . 0 0 "[ . 1 . 2 . 3]" 1
1288 1 125 SER QB 1 126 ARG HA 4.000 . 6.000 4.711 4.391 5.111 . 0 0 "[ . 1 . 2 . 3]" 1
1289 1 125 SER H 1 129 LEU QD 4.000 . 6.500 4.064 3.709 4.437 . 0 0 "[ . 1 . 2 . 3]" 1
1290 1 126 ARG H 1 126 ARG HG3 4.000 . 6.000 3.201 2.050 4.486 . 0 0 "[ . 1 . 2 . 3]" 1
1291 1 126 ARG H 1 126 ARG HG2 4.000 . 6.000 3.126 1.841 4.659 . 0 0 "[ . 1 . 2 . 3]" 1
1292 1 126 ARG H 1 126 ARG QB 3.000 . 4.100 2.432 2.250 2.763 . 0 0 "[ . 1 . 2 . 3]" 1
1293 1 126 ARG QB 1 126 ARG QD 3.000 . 5.300 2.362 2.094 2.924 . 0 0 "[ . 1 . 2 . 3]" 1
1294 1 126 ARG QB 1 127 PHE H 4.000 . 6.000 2.726 2.447 3.573 . 0 0 "[ . 1 . 2 . 3]" 1
1295 1 126 ARG HG3 1 127 PHE H 4.000 . 6.000 4.320 2.134 5.105 . 0 0 "[ . 1 . 2 . 3]" 1
1296 1 126 ARG HG2 1 127 PHE H 4.000 . 6.000 4.196 1.991 5.123 . 0 0 "[ . 1 . 2 . 3]" 1
1297 1 126 ARG HA 1 129 LEU QD 3.000 . 4.800 2.590 2.319 3.064 . 0 0 "[ . 1 . 2 . 3]" 1
1298 1 126 ARG QB 1 129 LEU QD 4.000 . 7.500 4.191 3.645 4.621 . 0 0 "[ . 1 . 2 . 3]" 1
1299 1 126 ARG QD 1 129 LEU QD 4.000 . 7.500 4.414 2.478 5.378 . 0 0 "[ . 1 . 2 . 3]" 1
1300 1 127 PHE H 1 127 PHE QD 3.000 . 3.500 2.209 2.019 2.839 . 0 0 "[ . 1 . 2 . 3]" 1
1301 1 127 PHE HA 1 127 PHE QD 4.000 . 5.000 2.797 2.354 2.917 . 0 0 "[ . 1 . 2 . 3]" 1
1302 1 127 PHE HA 1 127 PHE QE 4.000 . 5.000 4.530 4.394 4.643 . 0 0 "[ . 1 . 2 . 3]" 1
1303 1 127 PHE H 1 127 PHE HB2 3.000 . 3.500 2.488 2.354 2.594 . 0 0 "[ . 1 . 2 . 3]" 1
1304 1 127 PHE H 1 127 PHE HB3 4.000 . 5.000 3.620 3.590 3.639 . 0 0 "[ . 1 . 2 . 3]" 1
1305 1 127 PHE HB3 1 128 TYR H 4.000 . 5.000 3.396 3.096 3.636 . 0 0 "[ . 1 . 2 . 3]" 1
1306 1 127 PHE HB2 1 128 TYR H 4.000 . 5.000 2.393 2.232 2.534 . 0 0 "[ . 1 . 2 . 3]" 1
1307 1 128 TYR H 1 128 TYR HB3 3.000 . 3.500 2.601 2.515 2.703 . 0 0 "[ . 1 . 2 . 3]" 1
1308 1 128 TYR H 1 128 TYR HB2 3.000 . 3.500 2.488 2.400 2.562 . 0 0 "[ . 1 . 2 . 3]" 1
1309 1 128 TYR H 1 128 TYR QD 4.000 . 5.000 4.189 4.153 4.219 . 0 0 "[ . 1 . 2 . 3]" 1
1310 1 128 TYR HA 1 128 TYR QD 4.000 . 5.000 2.817 2.547 2.910 . 0 0 "[ . 1 . 2 . 3]" 1
1311 1 128 TYR HB3 1 130 ASP H 5.000 3.000 6.000 5.021 4.841 5.239 . 0 0 "[ . 1 . 2 . 3]" 1
1312 1 128 TYR HB3 1 129 LEU H 4.000 . 5.000 2.394 2.303 2.563 . 0 0 "[ . 1 . 2 . 3]" 1
1313 1 128 TYR QD 1 129 LEU H 4.000 . 5.000 3.293 3.061 3.726 . 0 0 "[ . 1 . 2 . 3]" 1
1314 1 128 TYR QD 1 129 LEU QD 3.000 . 4.800 2.694 2.373 3.225 . 0 0 "[ . 1 . 2 . 3]" 1
1315 1 128 TYR QE 1 129 LEU QD 4.000 . 6.500 3.747 3.318 4.503 . 0 0 "[ . 1 . 2 . 3]" 1
1316 1 128 TYR QE 1 132 THR MG 4.000 . 6.500 2.702 2.411 2.930 . 0 0 "[ . 1 . 2 . 3]" 1
1317 1 128 TYR QD 1 129 LEU HG 4.000 . 5.000 3.174 2.655 3.651 . 0 0 "[ . 1 . 2 . 3]" 1
1318 1 128 TYR QD 1 132 THR MG 4.000 . 6.500 3.013 2.585 3.661 . 0 0 "[ . 1 . 2 . 3]" 1
1319 1 128 TYR HA 1 131 LEU HB2 4.000 . 5.000 2.670 2.389 2.930 . 0 0 "[ . 1 . 2 . 3]" 1
1320 1 128 TYR HA 1 131 LEU MD1 4.000 . 6.500 2.957 2.383 3.613 . 0 0 "[ . 1 . 2 . 3]" 1
1321 1 129 LEU H 1 129 LEU HB2 3.000 . 3.500 2.456 2.397 2.555 . 0 0 "[ . 1 . 2 . 3]" 1
1322 1 129 LEU H 1 129 LEU QD 4.000 . 6.500 3.080 2.969 3.136 . 0 0 "[ . 1 . 2 . 3]" 1
1323 1 129 LEU H 1 129 LEU HG 3.000 . 3.300 2.196 1.995 2.301 . 0 0 "[ . 1 . 2 . 3]" 1
1324 1 129 LEU HA 1 129 LEU QD 2.500 . 4.200 2.158 2.106 2.273 . 0 0 "[ . 1 . 2 . 3]" 1
1325 1 129 LEU HB3 1 130 ASP H 4.000 . 5.000 3.459 3.336 3.598 . 0 0 "[ . 1 . 2 . 3]" 1
1326 1 129 LEU HB2 1 130 ASP H 4.000 . 5.000 2.481 2.301 2.664 . 0 0 "[ . 1 . 2 . 3]" 1
1327 1 129 LEU QD 1 130 ASP H 4.000 . 6.500 4.010 3.849 4.125 . 0 0 "[ . 1 . 2 . 3]" 1
1328 1 129 LEU HG 1 130 ASP H 4.000 . 5.000 4.332 4.135 4.448 . 0 0 "[ . 1 . 2 . 3]" 1
1329 1 129 LEU HA 1 132 THR MG 4.000 . 6.500 4.189 3.630 4.935 . 0 0 "[ . 1 . 2 . 3]" 1
1330 1 129 LEU QD 1 132 THR H 4.000 . 6.500 4.782 4.586 5.093 . 0 0 "[ . 1 . 2 . 3]" 1
1331 1 130 ASP H 1 130 ASP HB2 2.500 . 2.900 2.428 2.363 2.465 . 0 0 "[ . 1 . 2 . 3]" 1
1332 1 130 ASP HB2 1 131 LEU H 4.000 . 5.000 2.519 2.367 2.655 . 0 0 "[ . 1 . 2 . 3]" 1
1333 1 130 ASP HB2 1 132 THR H 4.000 . 5.000 4.821 4.666 4.995 . 0 0 "[ . 1 . 2 . 3]" 1
1334 1 131 LEU HA 1 131 LEU MD2 2.500 . 4.200 2.166 2.097 2.253 . 0 0 "[ . 1 . 2 . 3]" 1
1335 1 131 LEU H 1 131 LEU HB2 2.500 . 2.900 2.451 2.379 2.514 . 0 0 "[ . 1 . 2 . 3]" 1
1336 1 131 LEU H 1 131 LEU HG 3.000 . 3.500 2.261 2.105 2.431 . 0 0 "[ . 1 . 2 . 3]" 1
1337 1 131 LEU H 1 131 LEU MD1 4.000 . 6.500 3.475 3.301 3.595 . 0 0 "[ . 1 . 2 . 3]" 1
1338 1 131 LEU H 1 131 LEU MD2 4.000 . 6.500 3.518 3.325 3.776 . 0 0 "[ . 1 . 2 . 3]" 1
1339 1 131 LEU HB3 1 131 LEU MD2 3.000 . 4.800 2.247 2.203 2.287 . 0 0 "[ . 1 . 2 . 3]" 1
1340 1 131 LEU HB2 1 131 LEU MD2 3.000 . 4.800 3.209 3.187 3.221 . 0 0 "[ . 1 . 2 . 3]" 1
1341 1 131 LEU HB2 1 131 LEU MD1 3.000 . 4.800 2.306 2.219 2.370 . 0 0 "[ . 1 . 2 . 3]" 1
1342 1 131 LEU HA 1 131 LEU HG 4.000 . 5.000 2.916 2.734 3.051 . 0 0 "[ . 1 . 2 . 3]" 1
1343 1 131 LEU HB3 1 132 THR H 4.000 . 5.000 3.692 3.556 3.915 . 0 0 "[ . 1 . 2 . 3]" 1
1344 1 131 LEU HB2 1 132 THR H 4.000 . 5.000 2.675 2.517 2.961 . 0 0 "[ . 1 . 2 . 3]" 1
1345 1 131 LEU MD2 1 132 THR H 4.000 . 6.500 4.704 4.606 4.819 . 0 0 "[ . 1 . 2 . 3]" 1
1346 1 131 LEU H 1 132 THR MG 4.000 . 6.500 4.184 3.982 4.730 . 0 0 "[ . 1 . 2 . 3]" 1
1347 1 131 LEU HB3 1 132 THR MG 4.000 . 6.500 3.255 3.020 3.595 . 0 0 "[ . 1 . 2 . 3]" 1
1348 1 132 THR HA 1 132 THR MG 3.000 . 4.400 2.459 2.217 2.576 . 0 0 "[ . 1 . 2 . 3]" 1
1349 1 132 THR H 1 132 THR MG 2.500 . 4.400 2.539 2.363 2.900 . 0 0 "[ . 1 . 2 . 3]" 1
1350 1 132 THR H 1 132 THR HB 4.000 . 5.000 3.740 3.638 3.830 . 0 0 "[ . 1 . 2 . 3]" 1
1351 1 132 THR HB 1 133 ASN H 4.000 . 5.000 4.266 3.970 4.457 . 0 0 "[ . 1 . 2 . 3]" 1
1352 1 132 THR MG 1 133 ASN H 4.000 . 6.500 4.361 4.233 4.428 . 0 0 "[ . 1 . 2 . 3]" 1
1353 1 133 ASN H 1 133 ASN HB3 4.000 . 5.000 3.595 3.520 3.663 . 0 0 "[ . 1 . 2 . 3]" 1
1354 1 133 ASN H 1 133 ASN HB2 2.500 . 2.900 2.394 2.192 2.779 . 0 0 "[ . 1 . 2 . 3]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 455
_Distance_constraint_stats_list.Viol_count 505
_Distance_constraint_stats_list.Viol_total 861.434
_Distance_constraint_stats_list.Viol_max 0.347
_Distance_constraint_stats_list.Viol_rms 0.0137
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0021
_Distance_constraint_stats_list.Viol_average_violations_only 0.0569
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 5 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 6 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 7 GLN 0.290 0.049 22 0 "[ . 1 . 2 . 3]"
1 8 GLU 1.704 0.082 20 0 "[ . 1 . 2 . 3]"
1 9 GLU 1.833 0.082 20 0 "[ . 1 . 2 . 3]"
1 10 VAL 0.114 0.049 22 0 "[ . 1 . 2 . 3]"
1 11 LYS 2.478 0.157 28 0 "[ . 1 . 2 . 3]"
1 12 LYS 1.007 0.058 1 0 "[ . 1 . 2 . 3]"
1 13 TRP 0.279 0.079 7 0 "[ . 1 . 2 . 3]"
1 14 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 15 GLU 1.498 0.157 28 0 "[ . 1 . 2 . 3]"
1 16 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 17 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 18 GLU 1.908 0.085 21 0 "[ . 1 . 2 . 3]"
1 19 ASN 1.908 0.085 21 0 "[ . 1 . 2 . 3]"
1 20 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 21 ILE 0.237 0.047 8 0 "[ . 1 . 2 . 3]"
1 22 ASN 0.237 0.047 8 0 "[ . 1 . 2 . 3]"
1 23 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 24 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 25 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 26 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 27 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 28 ALA 1.851 0.079 17 0 "[ . 1 . 2 . 3]"
1 29 ALA 1.851 0.079 17 0 "[ . 1 . 2 . 3]"
1 30 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 31 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 32 ALA 0.151 0.090 28 0 "[ . 1 . 2 . 3]"
1 33 PHE 1.841 0.090 12 0 "[ . 1 . 2 . 3]"
1 34 LEU 1.841 0.090 12 0 "[ . 1 . 2 . 3]"
1 35 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 36 SER 0.793 0.090 28 0 "[ . 1 . 2 . 3]"
1 37 GLU 0.642 0.055 28 0 "[ . 1 . 2 . 3]"
1 38 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 39 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 40 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 41 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 42 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 43 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 44 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 45 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 46 TRP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 47 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 48 SER 0.036 0.036 29 0 "[ . 1 . 2 . 3]"
1 49 CYS 1.580 0.096 10 0 "[ . 1 . 2 . 3]"
1 50 GLU 1.580 0.096 10 0 "[ . 1 . 2 . 3]"
1 51 GLU 0.036 0.036 29 0 "[ . 1 . 2 . 3]"
1 52 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 53 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 54 LYS 0.612 0.066 20 0 "[ . 1 . 2 . 3]"
1 55 ILE 0.612 0.066 20 0 "[ . 1 . 2 . 3]"
1 56 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 57 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 58 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 59 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 60 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 61 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 62 SER 0.189 0.120 24 0 "[ . 1 . 2 . 3]"
1 63 PRO 0.205 0.122 5 0 "[ . 1 . 2 . 3]"
1 64 LYS 0.189 0.120 24 0 "[ . 1 . 2 . 3]"
1 65 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 66 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 67 LYS 0.205 0.122 5 0 "[ . 1 . 2 . 3]"
1 68 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 69 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 70 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 71 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 72 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 73 ILE 0.501 0.079 6 0 "[ . 1 . 2 . 3]"
1 74 SER 0.501 0.079 6 0 "[ . 1 . 2 . 3]"
1 75 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 76 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 77 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 78 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 79 LYS 0.631 0.124 26 0 "[ . 1 . 2 . 3]"
1 80 GLU 0.631 0.124 26 0 "[ . 1 . 2 . 3]"
1 81 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 82 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 83 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 84 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 85 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 86 CYS 1.614 0.084 7 0 "[ . 1 . 2 . 3]"
1 87 THR 1.614 0.084 7 0 "[ . 1 . 2 . 3]"
1 88 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 89 GLU 1.244 0.058 6 0 "[ . 1 . 2 . 3]"
1 90 GLU 1.244 0.058 6 0 "[ . 1 . 2 . 3]"
1 91 THR 0.191 0.079 25 0 "[ . 1 . 2 . 3]"
1 92 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 93 ARG 0.968 0.045 4 0 "[ . 1 . 2 . 3]"
1 94 ASN 1.286 0.054 18 0 "[ . 1 . 2 . 3]"
1 95 MET 0.510 0.079 25 0 "[ . 1 . 2 . 3]"
1 96 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 97 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 98 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 99 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 100 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 101 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 102 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 103 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 104 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 105 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 106 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 107 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 108 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 109 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 110 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 111 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 112 ASN 0.214 0.068 2 0 "[ . 1 . 2 . 3]"
1 113 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 114 MET 0.214 0.068 2 0 "[ . 1 . 2 . 3]"
1 115 GLU 0.179 0.124 15 0 "[ . 1 . 2 . 3]"
1 116 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 117 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 118 SER 0.179 0.124 15 0 "[ . 1 . 2 . 3]"
1 119 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 120 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 121 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 122 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 123 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 124 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 125 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 126 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 127 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 128 TYR 1.996 0.078 29 0 "[ . 1 . 2 . 3]"
1 129 LEU 1.996 0.078 29 0 "[ . 1 . 2 . 3]"
1 130 ASP 2.494 0.250 19 0 "[ . 1 . 2 . 3]"
1 131 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 132 THR 4.511 0.347 26 0 "[ . 1 . 2 . 3]"
1 133 ASN 7.004 0.347 26 0 "[ . 1 . 2 . 3]"
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 6 SER H 1 7 GLN H 4.000 . 5.000 4.655 4.616 4.681 . 0 0 "[ . 1 . 2 . 3]" 2
2 1 7 GLN H 1 8 GLU H 3.000 . 3.500 2.555 2.485 2.721 . 0 0 "[ . 1 . 2 . 3]" 2
3 1 8 GLU H 1 9 GLU H 3.000 . 3.500 2.671 2.551 2.836 . 0 0 "[ . 1 . 2 . 3]" 2
4 1 9 GLU H 1 10 VAL H 3.000 . 3.500 2.736 2.665 2.809 . 0 0 "[ . 1 . 2 . 3]" 2
5 1 10 VAL H 1 11 LYS H 3.000 . 3.500 2.724 2.645 2.846 . 0 0 "[ . 1 . 2 . 3]" 2
6 1 11 LYS H 1 12 LYS H 2.500 . 2.900 2.682 2.610 2.729 . 0 0 "[ . 1 . 2 . 3]" 2
7 1 12 LYS H 1 13 TRP H 2.500 . 2.900 2.621 2.542 2.676 . 0 0 "[ . 1 . 2 . 3]" 2
8 1 13 TRP H 1 14 ALA H 2.500 . 2.900 2.670 2.600 2.774 . 0 0 "[ . 1 . 2 . 3]" 2
9 1 14 ALA H 1 15 GLU H 2.500 . 2.900 2.447 2.290 2.602 . 0 0 "[ . 1 . 2 . 3]" 2
10 1 15 GLU H 1 16 SER H 2.500 . 2.900 2.372 2.296 2.465 . 0 0 "[ . 1 . 2 . 3]" 2
11 1 16 SER H 1 17 LEU H 4.000 . 5.000 4.275 4.220 4.356 . 0 0 "[ . 1 . 2 . 3]" 2
12 1 17 LEU H 1 18 GLU H 3.000 . 3.500 2.745 2.688 2.811 . 0 0 "[ . 1 . 2 . 3]" 2
13 1 18 GLU H 1 19 ASN H 3.000 . 3.500 2.865 2.761 3.006 . 0 0 "[ . 1 . 2 . 3]" 2
14 1 19 ASN H 1 20 LEU H 3.000 . 3.500 2.775 2.702 2.840 . 0 0 "[ . 1 . 2 . 3]" 2
15 1 20 LEU H 1 21 ILE H 3.000 . 3.500 2.770 2.650 2.879 . 0 0 "[ . 1 . 2 . 3]" 2
16 1 21 ILE H 1 22 ASN H 3.000 . 3.500 2.517 2.353 2.604 . 0 0 "[ . 1 . 2 . 3]" 2
17 1 22 ASN H 1 23 HIS H 2.500 . 2.900 2.477 2.391 2.606 . 0 0 "[ . 1 . 2 . 3]" 2
18 1 23 HIS H 1 24 GLU H 4.000 . 5.000 4.572 4.504 4.611 . 0 0 "[ . 1 . 2 . 3]" 2
19 1 24 GLU H 1 25 CYS H 3.000 . 3.500 2.779 2.717 2.897 . 0 0 "[ . 1 . 2 . 3]" 2
20 1 25 CYS H 1 26 GLY H 3.000 . 3.500 2.354 2.318 2.416 . 0 0 "[ . 1 . 2 . 3]" 2
21 1 26 GLY H 1 27 LEU H 3.000 . 3.500 2.665 2.548 2.762 . 0 0 "[ . 1 . 2 . 3]" 2
22 1 27 LEU H 1 28 ALA H 3.000 . 3.500 2.752 2.660 2.820 . 0 0 "[ . 1 . 2 . 3]" 2
23 1 28 ALA H 1 29 ALA H 3.000 . 3.500 2.766 2.663 2.874 . 0 0 "[ . 1 . 2 . 3]" 2
24 1 29 ALA H 1 30 PHE H 3.000 . 3.500 2.607 2.535 2.664 . 0 0 "[ . 1 . 2 . 3]" 2
25 1 30 PHE H 1 31 LYS H 3.000 . 3.500 2.790 2.626 2.912 . 0 0 "[ . 1 . 2 . 3]" 2
26 1 31 LYS H 1 32 ALA H 3.000 . 3.500 2.732 2.655 2.810 . 0 0 "[ . 1 . 2 . 3]" 2
27 1 33 PHE H 1 34 LEU H 3.000 . 3.500 2.752 2.673 2.890 . 0 0 "[ . 1 . 2 . 3]" 2
28 1 35 LYS H 1 36 SER H 3.000 . 3.500 2.692 2.632 2.755 . 0 0 "[ . 1 . 2 . 3]" 2
29 1 36 SER H 1 37 GLU H 3.000 . 3.500 2.621 2.508 2.722 . 0 0 "[ . 1 . 2 . 3]" 2
30 1 37 GLU H 1 38 TYR H 3.000 . 3.500 2.317 2.208 2.405 . 0 0 "[ . 1 . 2 . 3]" 2
31 1 38 TYR H 1 39 SER H 3.000 . 3.500 2.746 2.667 2.823 . 0 0 "[ . 1 . 2 . 3]" 2
32 1 39 SER H 1 40 GLU H 3.000 . 3.500 2.705 2.474 2.998 . 0 0 "[ . 1 . 2 . 3]" 2
33 1 40 GLU H 1 41 GLU H 3.000 . 3.500 2.619 2.556 2.704 . 0 0 "[ . 1 . 2 . 3]" 2
34 1 41 GLU H 1 42 ASN H 3.000 . 3.500 2.603 2.541 2.663 . 0 0 "[ . 1 . 2 . 3]" 2
35 1 42 ASN H 1 43 ILE H 3.000 . 3.500 2.871 2.814 2.925 . 0 0 "[ . 1 . 2 . 3]" 2
36 1 43 ILE H 1 44 ASP H 3.000 . 3.500 2.625 2.582 2.676 . 0 0 "[ . 1 . 2 . 3]" 2
37 1 45 PHE H 1 46 TRP H 3.000 . 3.500 2.601 2.554 2.714 . 0 0 "[ . 1 . 2 . 3]" 2
38 1 46 TRP H 1 47 ILE H 4.000 . 5.000 2.748 2.703 2.791 . 0 0 "[ . 1 . 2 . 3]" 2
39 1 47 ILE H 1 48 SER H 3.000 . 3.500 2.705 2.581 2.786 . 0 0 "[ . 1 . 2 . 3]" 2
40 1 48 SER H 1 49 CYS H 3.000 . 3.500 2.582 2.510 2.694 . 0 0 "[ . 1 . 2 . 3]" 2
41 1 49 CYS H 1 50 GLU H 3.000 . 3.500 2.638 2.513 2.738 . 0 0 "[ . 1 . 2 . 3]" 2
42 1 50 GLU H 1 51 GLU H 2.500 . 2.900 2.762 2.665 2.880 . 0 0 "[ . 1 . 2 . 3]" 2
43 1 51 GLU H 1 52 TYR H 3.000 . 3.500 2.616 2.552 2.671 . 0 0 "[ . 1 . 2 . 3]" 2
44 1 52 TYR H 1 53 LYS H 3.000 . 3.500 2.675 2.579 2.745 . 0 0 "[ . 1 . 2 . 3]" 2
45 1 53 LYS H 1 54 LYS H 2.500 . 2.900 2.613 2.533 2.769 . 0 0 "[ . 1 . 2 . 3]" 2
46 1 54 LYS H 1 55 ILE H 2.500 . 2.900 2.345 2.203 2.586 . 0 0 "[ . 1 . 2 . 3]" 2
47 1 56 LYS H 1 57 SER H 2.500 . 2.900 2.322 2.260 2.487 . 0 0 "[ . 1 . 2 . 3]" 2
48 1 59 SER H 1 60 LYS H 4.000 . 5.000 2.351 2.272 2.406 . 0 0 "[ . 1 . 2 . 3]" 2
49 1 60 LYS H 1 61 LEU H 2.500 . 2.900 2.292 2.211 2.360 . 0 0 "[ . 1 . 2 . 3]" 2
50 1 61 LEU H 1 62 SER H 3.000 . 3.500 2.699 2.628 2.762 . 0 0 "[ . 1 . 2 . 3]" 2
51 1 64 LYS H 1 65 ALA H 2.500 . 2.900 2.600 2.569 2.632 . 0 0 "[ . 1 . 2 . 3]" 2
52 1 65 ALA H 1 66 LYS H 3.000 . 3.500 2.797 2.713 2.908 . 0 0 "[ . 1 . 2 . 3]" 2
53 1 66 LYS H 1 67 LYS H 2.500 . 2.900 2.738 2.676 2.806 . 0 0 "[ . 1 . 2 . 3]" 2
54 1 67 LYS H 1 68 ILE H 3.000 . 3.500 2.744 2.658 2.804 . 0 0 "[ . 1 . 2 . 3]" 2
55 1 68 ILE H 1 69 TYR H 3.000 . 3.500 2.669 2.579 2.776 . 0 0 "[ . 1 . 2 . 3]" 2
56 1 69 TYR H 1 70 ASN H 3.000 . 3.500 2.778 2.715 2.828 . 0 0 "[ . 1 . 2 . 3]" 2
57 1 70 ASN H 1 71 GLU H 3.000 . 3.500 2.698 2.617 2.768 . 0 0 "[ . 1 . 2 . 3]" 2
58 1 71 GLU H 1 72 PHE H 3.000 . 3.500 2.758 2.551 2.941 . 0 0 "[ . 1 . 2 . 3]" 2
59 1 72 PHE H 1 73 ILE H 3.000 . 3.500 2.506 1.991 2.702 . 0 0 "[ . 1 . 2 . 3]" 2
60 1 73 ILE H 1 74 SER H 2.500 . 2.900 2.384 2.214 2.487 . 0 0 "[ . 1 . 2 . 3]" 2
61 1 74 SER H 1 75 VAL H 4.000 . 5.000 4.617 4.559 4.654 . 0 0 "[ . 1 . 2 . 3]" 2
62 1 76 GLN H 1 77 ALA H 2.500 . 2.900 2.280 2.204 2.330 . 0 0 "[ . 1 . 2 . 3]" 2
63 1 77 ALA H 1 78 THR H 4.000 . 5.000 4.654 4.611 4.683 . 0 0 "[ . 1 . 2 . 3]" 2
64 1 79 LYS H 1 80 GLU H 3.000 . 3.500 3.440 3.197 3.624 0.124 26 0 "[ . 1 . 2 . 3]" 2
65 1 80 GLU H 1 81 VAL H 4.000 . 5.000 4.653 4.629 4.679 . 0 0 "[ . 1 . 2 . 3]" 2
66 1 82 ASN H 1 83 LEU H 4.000 . 5.000 4.341 4.238 4.438 . 0 0 "[ . 1 . 2 . 3]" 2
67 1 83 LEU H 1 84 ASP H 4.000 . 5.000 4.425 4.403 4.436 . 0 0 "[ . 1 . 2 . 3]" 2
68 1 84 ASP H 1 85 SER H 4.000 . 5.000 4.659 4.623 4.675 . 0 0 "[ . 1 . 2 . 3]" 2
69 1 85 SER H 1 86 CYS H 4.000 . 5.000 2.583 2.527 2.702 . 0 0 "[ . 1 . 2 . 3]" 2
70 1 87 THR H 1 88 ARG H 2.500 . 2.900 2.782 2.659 2.876 . 0 0 "[ . 1 . 2 . 3]" 2
71 1 90 GLU H 1 91 THR H 3.000 . 3.500 2.754 2.686 2.837 . 0 0 "[ . 1 . 2 . 3]" 2
72 1 91 THR H 1 92 SER H 3.000 . 3.500 2.677 2.612 2.768 . 0 0 "[ . 1 . 2 . 3]" 2
73 1 92 SER H 1 93 ARG H 3.000 . 3.500 2.722 2.635 2.842 . 0 0 "[ . 1 . 2 . 3]" 2
74 1 93 ARG H 1 94 ASN H 2.500 . 2.900 2.596 2.537 2.663 . 0 0 "[ . 1 . 2 . 3]" 2
75 1 94 ASN H 1 95 MET H 2.500 . 2.900 2.652 2.534 2.717 . 0 0 "[ . 1 . 2 . 3]" 2
76 1 95 MET H 1 96 LEU H 2.500 . 2.900 2.685 2.618 2.733 . 0 0 "[ . 1 . 2 . 3]" 2
77 1 100 ILE H 1 101 THR H 4.000 . 5.000 2.522 2.477 2.573 . 0 0 "[ . 1 . 2 . 3]" 2
78 1 101 THR H 1 102 CYS H 2.500 . 2.900 2.460 2.359 2.548 . 0 0 "[ . 1 . 2 . 3]" 2
79 1 102 CYS H 1 103 PHE H 4.000 . 5.000 2.945 2.780 3.061 . 0 0 "[ . 1 . 2 . 3]" 2
80 1 103 PHE H 1 104 ASP H 2.500 . 2.900 2.430 2.305 2.513 . 0 0 "[ . 1 . 2 . 3]" 2
81 1 104 ASP H 1 105 GLU H 3.000 . 3.500 2.675 2.574 2.746 . 0 0 "[ . 1 . 2 . 3]" 2
82 1 106 ALA H 1 107 GLN H 3.000 . 3.500 2.680 2.562 2.797 . 0 0 "[ . 1 . 2 . 3]" 2
83 1 107 GLN H 1 108 LYS H 3.000 . 3.500 2.697 2.643 2.757 . 0 0 "[ . 1 . 2 . 3]" 2
84 1 109 LYS H 1 110 ILE H 3.000 . 3.500 2.641 2.567 2.696 . 0 0 "[ . 1 . 2 . 3]" 2
85 1 110 ILE H 1 111 PHE H 3.000 . 3.500 2.654 2.555 2.772 . 0 0 "[ . 1 . 2 . 3]" 2
86 1 111 PHE H 1 112 ASN H 3.000 . 3.500 2.780 2.681 2.977 . 0 0 "[ . 1 . 2 . 3]" 2
87 1 112 ASN H 1 113 LEU H 3.000 . 3.500 2.715 2.630 2.803 . 0 0 "[ . 1 . 2 . 3]" 2
88 1 113 LEU H 1 114 MET H 3.000 . 3.500 2.915 2.836 3.067 . 0 0 "[ . 1 . 2 . 3]" 2
89 1 114 MET H 1 115 GLU H 2.500 . 2.900 2.681 2.622 2.781 . 0 0 "[ . 1 . 2 . 3]" 2
90 1 115 GLU H 1 116 LYS H 3.000 . 3.500 2.767 2.654 3.001 . 0 0 "[ . 1 . 2 . 3]" 2
91 1 117 ASP H 1 118 SER H 3.000 . 3.500 2.447 2.198 3.000 . 0 0 "[ . 1 . 2 . 3]" 2
92 1 118 SER H 1 119 TYR H 3.000 . 3.500 2.810 2.587 2.964 . 0 0 "[ . 1 . 2 . 3]" 2
93 1 119 TYR H 1 120 ARG H 3.000 . 3.500 2.942 2.784 3.095 . 0 0 "[ . 1 . 2 . 3]" 2
94 1 120 ARG H 1 121 ARG H 3.000 . 3.500 2.689 2.626 2.831 . 0 0 "[ . 1 . 2 . 3]" 2
95 1 121 ARG H 1 122 PHE H 3.000 . 3.500 2.572 2.515 2.640 . 0 0 "[ . 1 . 2 . 3]" 2
96 1 122 PHE H 1 123 LEU H 3.000 . 3.500 2.838 2.735 2.992 . 0 0 "[ . 1 . 2 . 3]" 2
97 1 123 LEU H 1 124 LYS H 3.000 . 3.500 2.673 2.621 2.744 . 0 0 "[ . 1 . 2 . 3]" 2
98 1 124 LYS H 1 125 SER H 2.500 . 2.900 2.453 2.195 2.571 . 0 0 "[ . 1 . 2 . 3]" 2
99 1 126 ARG H 1 127 PHE H 4.000 . 5.000 2.672 2.533 2.781 . 0 0 "[ . 1 . 2 . 3]" 2
100 1 127 PHE H 1 128 TYR H 3.000 . 3.500 2.827 2.615 3.037 . 0 0 "[ . 1 . 2 . 3]" 2
101 1 128 TYR H 1 129 LEU H 3.000 . 3.500 2.770 2.611 2.860 . 0 0 "[ . 1 . 2 . 3]" 2
102 1 129 LEU H 1 130 ASP H 3.000 . 3.500 2.810 2.729 2.921 . 0 0 "[ . 1 . 2 . 3]" 2
103 1 130 ASP H 1 131 LEU H 3.000 . 3.500 2.738 2.665 2.835 . 0 0 "[ . 1 . 2 . 3]" 2
104 1 131 LEU H 1 132 THR H 2.500 . 2.900 2.525 2.440 2.661 . 0 0 "[ . 1 . 2 . 3]" 2
105 1 132 THR H 1 133 ASN H 3.000 . 3.500 3.647 3.414 3.847 0.347 26 0 "[ . 1 . 2 . 3]" 2
106 1 8 GLU H 1 10 VAL H 4.000 . 5.000 4.384 4.227 4.603 . 0 0 "[ . 1 . 2 . 3]" 2
107 1 10 VAL H 1 12 LYS H 4.000 . 5.000 4.191 4.035 4.469 . 0 0 "[ . 1 . 2 . 3]" 2
108 1 14 ALA H 1 16 SER H 4.000 . 5.000 4.333 4.101 4.530 . 0 0 "[ . 1 . 2 . 3]" 2
109 1 17 LEU H 1 19 ASN H 4.000 . 5.000 4.369 4.259 4.619 . 0 0 "[ . 1 . 2 . 3]" 2
110 1 19 ASN H 1 21 ILE H 4.000 . 5.000 4.287 4.065 4.458 . 0 0 "[ . 1 . 2 . 3]" 2
111 1 25 CYS H 1 27 LEU H 4.000 . 5.000 4.070 3.890 4.245 . 0 0 "[ . 1 . 2 . 3]" 2
112 1 28 ALA H 1 30 PHE H 4.000 . 5.000 4.074 3.958 4.171 . 0 0 "[ . 1 . 2 . 3]" 2
113 1 30 PHE H 1 32 ALA H 4.000 . 5.000 4.157 3.979 4.356 . 0 0 "[ . 1 . 2 . 3]" 2
114 1 31 LYS H 1 33 PHE H 4.000 . 5.000 4.127 3.924 4.576 . 0 0 "[ . 1 . 2 . 3]" 2
115 1 34 LEU H 1 36 SER H 4.000 . 5.000 4.125 4.027 4.293 . 0 0 "[ . 1 . 2 . 3]" 2
116 1 36 SER H 1 38 TYR H 4.000 . 5.000 3.776 3.612 4.022 . 0 0 "[ . 1 . 2 . 3]" 2
117 1 37 GLU H 1 39 SER H 4.000 . 5.000 3.479 3.283 3.710 . 0 0 "[ . 1 . 2 . 3]" 2
118 1 38 TYR H 1 40 GLU H 4.000 . 5.000 4.573 4.189 4.927 . 0 0 "[ . 1 . 2 . 3]" 2
119 1 42 ASN H 1 44 ASP H 4.000 . 5.000 4.206 4.120 4.321 . 0 0 "[ . 1 . 2 . 3]" 2
120 1 48 SER H 1 50 GLU H 4.000 . 5.000 4.045 3.826 4.213 . 0 0 "[ . 1 . 2 . 3]" 2
121 1 49 CYS H 1 51 GLU H 4.000 . 5.000 4.288 4.159 4.426 . 0 0 "[ . 1 . 2 . 3]" 2
122 1 50 GLU H 1 52 TYR H 4.000 . 5.000 3.995 3.867 4.094 . 0 0 "[ . 1 . 2 . 3]" 2
123 1 51 GLU H 1 53 LYS H 4.000 . 5.000 4.093 3.985 4.205 . 0 0 "[ . 1 . 2 . 3]" 2
124 1 62 SER H 1 64 LYS H 4.000 . 5.000 4.882 4.700 5.120 0.120 24 0 "[ . 1 . 2 . 3]" 2
125 1 64 LYS H 1 66 LYS H 4.000 . 5.000 4.532 4.371 4.730 . 0 0 "[ . 1 . 2 . 3]" 2
126 1 65 ALA H 1 67 LYS H 4.000 . 5.000 4.156 4.052 4.281 . 0 0 "[ . 1 . 2 . 3]" 2
127 1 71 GLU H 1 73 ILE H 4.000 . 5.000 4.013 3.796 4.186 . 0 0 "[ . 1 . 2 . 3]" 2
128 1 72 PHE H 1 74 SER H 4.000 . 5.000 4.016 3.542 4.315 . 0 0 "[ . 1 . 2 . 3]" 2
129 1 89 GLU H 1 91 THR H 4.000 . 5.000 4.217 4.067 4.379 . 0 0 "[ . 1 . 2 . 3]" 2
130 1 91 THR H 1 93 ARG H 4.000 . 5.000 4.147 4.047 4.288 . 0 0 "[ . 1 . 2 . 3]" 2
131 1 92 SER H 1 94 ASN H 4.000 . 5.000 4.106 3.987 4.233 . 0 0 "[ . 1 . 2 . 3]" 2
132 1 93 ARG H 1 95 MET H 4.000 . 5.000 4.016 3.713 4.170 . 0 0 "[ . 1 . 2 . 3]" 2
133 1 94 ASN H 1 96 LEU H 4.000 . 5.000 4.372 3.871 4.603 . 0 0 "[ . 1 . 2 . 3]" 2
134 1 100 ILE H 1 102 CYS H 4.000 . 5.000 4.087 3.983 4.199 . 0 0 "[ . 1 . 2 . 3]" 2
135 1 106 ALA H 1 108 LYS H 4.000 . 5.000 4.050 3.816 4.226 . 0 0 "[ . 1 . 2 . 3]" 2
136 1 108 LYS H 1 110 ILE H 4.000 . 5.000 4.090 3.914 4.177 . 0 0 "[ . 1 . 2 . 3]" 2
137 1 109 LYS H 1 111 PHE H 4.000 . 5.000 4.167 4.008 4.307 . 0 0 "[ . 1 . 2 . 3]" 2
138 1 112 ASN H 1 114 MET H 4.000 . 5.000 4.625 4.442 4.859 . 0 0 "[ . 1 . 2 . 3]" 2
139 1 114 MET H 1 116 LYS H 4.000 . 5.000 4.326 4.149 4.669 . 0 0 "[ . 1 . 2 . 3]" 2
140 1 117 ASP H 1 119 TYR H 4.000 . 5.000 3.916 3.313 4.673 . 0 0 "[ . 1 . 2 . 3]" 2
141 1 118 SER H 1 120 ARG H 4.000 . 5.000 4.492 4.241 4.749 . 0 0 "[ . 1 . 2 . 3]" 2
142 1 119 TYR H 1 121 ARG H 4.000 . 5.000 4.183 4.025 4.501 . 0 0 "[ . 1 . 2 . 3]" 2
143 1 127 PHE H 1 129 LEU H 4.000 . 5.000 4.263 4.113 4.390 . 0 0 "[ . 1 . 2 . 3]" 2
144 1 128 TYR H 1 130 ASP H 4.000 . 5.000 4.288 4.038 4.525 . 0 0 "[ . 1 . 2 . 3]" 2
145 1 130 ASP H 1 132 THR H 4.000 . 5.000 3.944 3.771 4.170 . 0 0 "[ . 1 . 2 . 3]" 2
146 1 5 VAL HA 1 6 SER H 3.000 . 3.500 2.216 2.138 2.332 . 0 0 "[ . 1 . 2 . 3]" 2
147 1 6 SER HA 1 7 GLN H 2.500 . 2.900 2.378 2.243 2.484 . 0 0 "[ . 1 . 2 . 3]" 2
148 1 7 GLN HA 1 8 GLU H 3.000 . 3.500 3.479 3.401 3.544 0.044 15 0 "[ . 1 . 2 . 3]" 2
149 1 8 GLU HA 1 9 GLU H 3.000 . 3.500 3.551 3.518 3.582 0.082 20 0 "[ . 1 . 2 . 3]" 2
150 1 9 GLU HA 1 10 VAL H 4.000 . 5.000 3.594 3.572 3.618 . 0 0 "[ . 1 . 2 . 3]" 2
151 1 10 VAL HA 1 11 LYS H 4.000 . 5.000 3.548 3.504 3.594 . 0 0 "[ . 1 . 2 . 3]" 2
152 1 11 LYS HA 1 12 LYS H 3.000 . 3.500 3.533 3.502 3.558 0.058 1 0 "[ . 1 . 2 . 3]" 2
153 1 12 LYS HA 1 13 TRP H 4.000 . 5.000 3.533 3.503 3.563 . 0 0 "[ . 1 . 2 . 3]" 2
154 1 13 TRP HA 1 14 ALA H 4.000 . 5.000 3.519 3.442 3.570 . 0 0 "[ . 1 . 2 . 3]" 2
155 1 14 ALA HA 1 15 GLU H 4.000 . 5.000 3.372 3.341 3.405 . 0 0 "[ . 1 . 2 . 3]" 2
156 1 15 GLU HA 1 16 SER H 4.000 . 5.000 3.554 3.488 3.586 . 0 0 "[ . 1 . 2 . 3]" 2
157 1 16 SER HA 1 17 LEU H 2.500 . 2.900 2.247 2.198 2.368 . 0 0 "[ . 1 . 2 . 3]" 2
158 1 17 LEU HA 1 18 GLU H 4.000 . 5.000 3.548 3.528 3.568 . 0 0 "[ . 1 . 2 . 3]" 2
159 1 18 GLU HA 1 19 ASN H 3.000 . 3.500 3.564 3.548 3.585 0.085 21 0 "[ . 1 . 2 . 3]" 2
160 1 19 ASN HA 1 20 LEU H 4.000 . 5.000 3.575 3.553 3.596 . 0 0 "[ . 1 . 2 . 3]" 2
161 1 20 LEU HA 1 21 ILE H 4.000 . 5.000 3.563 3.529 3.597 . 0 0 "[ . 1 . 2 . 3]" 2
162 1 21 ILE HA 1 22 ASN H 3.000 . 3.500 3.491 3.434 3.547 0.047 8 0 "[ . 1 . 2 . 3]" 2
163 1 22 ASN HA 1 23 HIS H 4.000 . 5.000 3.354 3.265 3.442 . 0 0 "[ . 1 . 2 . 3]" 2
164 1 23 HIS HA 1 24 GLU H 2.500 . 2.900 2.221 2.168 2.254 . 0 0 "[ . 1 . 2 . 3]" 2
165 1 24 GLU HA 1 25 CYS H 4.000 . 5.000 3.567 3.543 3.603 . 0 0 "[ . 1 . 2 . 3]" 2
166 1 25 CYS HA 1 26 GLY H 4.000 . 5.000 3.519 3.473 3.553 . 0 0 "[ . 1 . 2 . 3]" 2
167 1 26 GLY QA 1 27 LEU H 3.000 . 4.500 2.681 2.628 2.736 . 0 0 "[ . 1 . 2 . 3]" 2
168 1 27 LEU HA 1 28 ALA H 4.000 . 5.000 3.575 3.554 3.593 . 0 0 "[ . 1 . 2 . 3]" 2
169 1 28 ALA HA 1 29 ALA H 3.000 . 3.500 3.562 3.536 3.579 0.079 17 0 "[ . 1 . 2 . 3]" 2
170 1 29 ALA HA 1 30 PHE H 4.000 . 5.000 3.555 3.519 3.573 . 0 0 "[ . 1 . 2 . 3]" 2
171 1 30 PHE HA 1 31 LYS H 4.000 . 5.000 3.581 3.555 3.607 . 0 0 "[ . 1 . 2 . 3]" 2
172 1 31 LYS HA 1 32 ALA H 4.000 . 5.000 3.559 3.539 3.583 . 0 0 "[ . 1 . 2 . 3]" 2
173 1 33 PHE HA 1 34 LEU H 3.000 . 3.500 3.561 3.544 3.590 0.090 12 0 "[ . 1 . 2 . 3]" 2
174 1 34 LEU HA 1 35 LYS H 4.000 . 5.000 3.538 3.509 3.559 . 0 0 "[ . 1 . 2 . 3]" 2
175 1 35 LYS HA 1 36 SER H 4.000 . 5.000 3.543 3.530 3.557 . 0 0 "[ . 1 . 2 . 3]" 2
176 1 36 SER HA 1 37 GLU H 3.000 . 3.500 3.513 3.446 3.555 0.055 28 0 "[ . 1 . 2 . 3]" 2
177 1 37 GLU HA 1 38 TYR H 3.000 . 3.500 3.230 3.169 3.310 . 0 0 "[ . 1 . 2 . 3]" 2
178 1 38 TYR HA 1 39 SER H 3.000 . 3.500 2.914 2.817 3.089 . 0 0 "[ . 1 . 2 . 3]" 2
179 1 39 SER HA 1 40 GLU H 3.000 . 3.500 2.973 2.805 3.104 . 0 0 "[ . 1 . 2 . 3]" 2
180 1 40 GLU HA 1 41 GLU H 4.000 . 5.000 3.467 3.373 3.540 . 0 0 "[ . 1 . 2 . 3]" 2
181 1 41 GLU HA 1 42 ASN H 4.000 . 5.000 3.517 3.487 3.547 . 0 0 "[ . 1 . 2 . 3]" 2
182 1 42 ASN HA 1 43 ILE H 4.000 . 5.000 3.612 3.598 3.629 . 0 0 "[ . 1 . 2 . 3]" 2
183 1 43 ILE HA 1 44 ASP H 4.000 . 5.000 3.560 3.547 3.573 . 0 0 "[ . 1 . 2 . 3]" 2
184 1 44 ASP HA 1 45 PHE H 4.000 . 5.000 3.534 3.518 3.559 . 0 0 "[ . 1 . 2 . 3]" 2
185 1 47 ILE HA 1 48 SER H 4.000 . 5.000 3.562 3.548 3.581 . 0 0 "[ . 1 . 2 . 3]" 2
186 1 48 SER HA 1 49 CYS H 4.000 . 5.000 3.548 3.527 3.578 . 0 0 "[ . 1 . 2 . 3]" 2
187 1 49 CYS HA 1 50 GLU H 3.000 . 3.500 3.553 3.511 3.596 0.096 10 0 "[ . 1 . 2 . 3]" 2
188 1 50 GLU HA 1 51 GLU H 4.000 . 5.000 3.572 3.542 3.592 . 0 0 "[ . 1 . 2 . 3]" 2
189 1 51 GLU HA 1 52 TYR H 4.000 . 5.000 3.526 3.508 3.541 . 0 0 "[ . 1 . 2 . 3]" 2
190 1 53 LYS HA 1 54 LYS H 4.000 . 5.000 3.473 3.403 3.568 . 0 0 "[ . 1 . 2 . 3]" 2
191 1 54 LYS HA 1 55 ILE H 3.000 . 3.500 3.513 3.447 3.566 0.066 20 0 "[ . 1 . 2 . 3]" 2
192 1 55 ILE HA 1 56 LYS H 2.500 . 2.900 2.198 2.164 2.242 . 0 0 "[ . 1 . 2 . 3]" 2
193 1 56 LYS HA 1 57 SER H 3.000 . 3.500 3.290 3.256 3.306 . 0 0 "[ . 1 . 2 . 3]" 2
194 1 58 PRO HA 1 59 SER H 4.000 . 5.000 3.355 3.281 3.417 . 0 0 "[ . 1 . 2 . 3]" 2
195 1 60 LYS HA 1 61 LEU H 3.000 . 3.500 3.446 3.413 3.478 . 0 0 "[ . 1 . 2 . 3]" 2
196 1 63 PRO HA 1 64 LYS H 4.000 . 5.000 3.606 3.591 3.619 . 0 0 "[ . 1 . 2 . 3]" 2
197 1 64 LYS HA 1 65 ALA H 4.000 . 5.000 3.521 3.461 3.555 . 0 0 "[ . 1 . 2 . 3]" 2
198 1 65 ALA HA 1 66 LYS H 4.000 . 5.000 3.573 3.554 3.593 . 0 0 "[ . 1 . 2 . 3]" 2
199 1 66 LYS HA 1 67 LYS H 4.000 . 5.000 3.569 3.556 3.587 . 0 0 "[ . 1 . 2 . 3]" 2
200 1 67 LYS HA 1 68 ILE H 4.000 . 5.000 3.576 3.559 3.584 . 0 0 "[ . 1 . 2 . 3]" 2
201 1 68 ILE HA 1 69 TYR H 4.000 . 5.000 3.562 3.530 3.582 . 0 0 "[ . 1 . 2 . 3]" 2
202 1 69 TYR HA 1 70 ASN H 4.000 . 5.000 3.562 3.541 3.580 . 0 0 "[ . 1 . 2 . 3]" 2
203 1 70 ASN HA 1 71 GLU H 4.000 . 5.000 3.542 3.513 3.569 . 0 0 "[ . 1 . 2 . 3]" 2
204 1 71 GLU HA 1 72 PHE H 4.000 . 5.000 3.587 3.469 3.614 . 0 0 "[ . 1 . 2 . 3]" 2
205 1 72 PHE HA 1 73 ILE H 4.000 . 5.000 3.565 3.498 3.608 . 0 0 "[ . 1 . 2 . 3]" 2
206 1 73 ILE HA 1 74 SER H 3.000 . 3.500 3.487 3.438 3.579 0.079 6 0 "[ . 1 . 2 . 3]" 2
207 1 75 VAL HA 1 76 GLN H 3.000 . 3.500 3.408 3.353 3.468 . 0 0 "[ . 1 . 2 . 3]" 2
208 1 76 GLN HA 1 77 ALA H 3.000 . 3.500 3.296 3.240 3.436 . 0 0 "[ . 1 . 2 . 3]" 2
209 1 79 LYS HA 1 80 GLU H 2.500 . 2.900 2.426 2.282 2.590 . 0 0 "[ . 1 . 2 . 3]" 2
210 1 80 GLU HA 1 81 VAL H 2.500 . 2.900 2.258 2.194 2.372 . 0 0 "[ . 1 . 2 . 3]" 2
211 1 81 VAL HA 1 82 ASN H 2.500 . 2.900 2.296 2.230 2.395 . 0 0 "[ . 1 . 2 . 3]" 2
212 1 82 ASN HA 1 83 LEU H 2.500 . 2.900 2.198 2.156 2.241 . 0 0 "[ . 1 . 2 . 3]" 2
213 1 83 LEU HA 1 84 ASP H 2.500 . 2.900 2.436 2.362 2.538 . 0 0 "[ . 1 . 2 . 3]" 2
214 1 84 ASP HA 1 85 SER H 2.500 . 2.900 2.397 2.293 2.491 . 0 0 "[ . 1 . 2 . 3]" 2
215 1 85 SER HA 1 86 CYS H 4.000 . 5.000 3.470 3.435 3.545 . 0 0 "[ . 1 . 2 . 3]" 2
216 1 86 CYS HA 1 87 THR H 3.000 . 3.500 3.554 3.521 3.584 0.084 7 0 "[ . 1 . 2 . 3]" 2
217 1 87 THR HA 1 88 ARG H 4.000 . 5.000 3.575 3.541 3.606 . 0 0 "[ . 1 . 2 . 3]" 2
218 1 88 ARG HA 1 89 GLU H 4.000 . 5.000 3.568 3.548 3.584 . 0 0 "[ . 1 . 2 . 3]" 2
219 1 89 GLU HA 1 90 GLU H 3.000 . 3.500 3.541 3.524 3.558 0.058 6 0 "[ . 1 . 2 . 3]" 2
220 1 90 GLU HA 1 91 THR H 4.000 . 5.000 3.572 3.547 3.605 . 0 0 "[ . 1 . 2 . 3]" 2
221 1 91 THR HA 1 92 SER H 4.000 . 5.000 3.558 3.542 3.588 . 0 0 "[ . 1 . 2 . 3]" 2
222 1 92 SER HA 1 93 ARG H 4.000 . 5.000 3.550 3.532 3.582 . 0 0 "[ . 1 . 2 . 3]" 2
223 1 93 ARG HA 1 94 ASN H 3.000 . 3.500 3.532 3.515 3.545 0.045 4 0 "[ . 1 . 2 . 3]" 2
224 1 94 ASN HA 1 95 MET H 3.000 . 3.500 3.486 3.419 3.554 0.054 18 0 "[ . 1 . 2 . 3]" 2
225 1 95 MET HA 1 96 LEU H 4.000 . 5.000 3.527 3.478 3.547 . 0 0 "[ . 1 . 2 . 3]" 2
226 1 96 LEU HA 1 97 GLU H 4.000 . 5.000 3.484 3.414 3.546 . 0 0 "[ . 1 . 2 . 3]" 2
227 1 98 PRO HA 1 99 THR H 2.500 . 2.900 2.188 2.137 2.207 . 0 0 "[ . 1 . 2 . 3]" 2
228 1 99 THR HA 1 100 ILE H 2.500 . 2.900 2.496 2.452 2.574 . 0 0 "[ . 1 . 2 . 3]" 2
229 1 100 ILE HA 1 101 THR H 4.000 . 5.000 3.441 3.394 3.466 . 0 0 "[ . 1 . 2 . 3]" 2
230 1 101 THR HA 1 102 CYS H 3.000 . 3.500 3.229 3.117 3.290 . 0 0 "[ . 1 . 2 . 3]" 2
231 1 102 CYS HA 1 103 PHE H 4.000 . 5.000 3.595 3.578 3.605 . 0 0 "[ . 1 . 2 . 3]" 2
232 1 103 PHE HA 1 104 ASP H 3.000 . 3.500 3.365 3.327 3.432 . 0 0 "[ . 1 . 2 . 3]" 2
233 1 104 ASP HA 1 105 GLU H 4.000 . 5.000 3.542 3.532 3.555 . 0 0 "[ . 1 . 2 . 3]" 2
234 1 105 GLU HA 1 106 ALA H 4.000 . 5.000 3.545 3.507 3.576 . 0 0 "[ . 1 . 2 . 3]" 2
235 1 106 ALA HA 1 107 GLN H 4.000 . 5.000 3.579 3.549 3.608 . 0 0 "[ . 1 . 2 . 3]" 2
236 1 107 GLN HA 1 108 LYS H 4.000 . 5.000 3.548 3.534 3.569 . 0 0 "[ . 1 . 2 . 3]" 2
237 1 108 LYS HA 1 109 LYS H 4.000 . 5.000 3.553 3.539 3.564 . 0 0 "[ . 1 . 2 . 3]" 2
238 1 110 ILE HA 1 111 PHE H 4.000 . 5.000 3.572 3.547 3.596 . 0 0 "[ . 1 . 2 . 3]" 2
239 1 111 PHE HA 1 112 ASN H 4.000 . 5.000 3.574 3.545 3.596 . 0 0 "[ . 1 . 2 . 3]" 2
240 1 112 ASN HA 1 113 LEU H 4.000 . 5.000 3.561 3.545 3.577 . 0 0 "[ . 1 . 2 . 3]" 2
241 1 113 LEU HA 1 114 MET H 4.000 . 5.000 3.591 3.566 3.607 . 0 0 "[ . 1 . 2 . 3]" 2
242 1 114 MET HA 1 115 GLU H 4.000 . 5.000 3.557 3.534 3.587 . 0 0 "[ . 1 . 2 . 3]" 2
243 1 115 GLU HA 1 116 LYS H 4.000 . 5.000 3.567 3.544 3.591 . 0 0 "[ . 1 . 2 . 3]" 2
244 1 116 LYS HA 1 117 ASP H 4.000 . 5.000 3.518 3.399 3.584 . 0 0 "[ . 1 . 2 . 3]" 2
245 1 117 ASP HA 1 118 SER H 4.000 . 5.000 3.595 3.557 3.619 . 0 0 "[ . 1 . 2 . 3]" 2
246 1 118 SER HA 1 119 TYR H 4.000 . 5.000 3.591 3.542 3.630 . 0 0 "[ . 1 . 2 . 3]" 2
247 1 119 TYR HA 1 120 ARG H 4.000 . 5.000 3.584 3.550 3.609 . 0 0 "[ . 1 . 2 . 3]" 2
248 1 120 ARG HA 1 121 ARG H 4.000 . 5.000 3.545 3.526 3.587 . 0 0 "[ . 1 . 2 . 3]" 2
249 1 121 ARG HA 1 122 PHE H 4.000 . 5.000 3.560 3.529 3.588 . 0 0 "[ . 1 . 2 . 3]" 2
250 1 122 PHE HA 1 123 LEU H 4.000 . 5.000 3.575 3.553 3.591 . 0 0 "[ . 1 . 2 . 3]" 2
251 1 123 LEU HA 1 124 LYS H 4.000 . 5.000 3.527 3.462 3.554 . 0 0 "[ . 1 . 2 . 3]" 2
252 1 124 LYS HA 1 125 SER H 3.000 . 3.500 3.304 3.118 3.413 . 0 0 "[ . 1 . 2 . 3]" 2
253 1 125 SER HA 1 126 ARG H 2.500 . 2.900 2.346 2.235 2.450 . 0 0 "[ . 1 . 2 . 3]" 2
254 1 126 ARG HA 1 127 PHE H 4.000 . 5.000 3.557 3.513 3.577 . 0 0 "[ . 1 . 2 . 3]" 2
255 1 127 PHE HA 1 128 TYR H 4.000 . 5.000 3.575 3.542 3.608 . 0 0 "[ . 1 . 2 . 3]" 2
256 1 128 TYR HA 1 129 LEU H 3.000 . 3.500 3.567 3.547 3.578 0.078 29 0 "[ . 1 . 2 . 3]" 2
257 1 129 LEU HA 1 130 ASP H 4.000 . 5.000 3.581 3.558 3.600 . 0 0 "[ . 1 . 2 . 3]" 2
258 1 130 ASP HA 1 131 LEU H 4.000 . 5.000 3.560 3.540 3.581 . 0 0 "[ . 1 . 2 . 3]" 2
259 1 131 LEU HA 1 132 THR H 4.000 . 5.000 3.524 3.466 3.569 . 0 0 "[ . 1 . 2 . 3]" 2
260 1 132 THR HA 1 133 ASN H 2.500 . 2.900 2.444 2.223 2.715 . 0 0 "[ . 1 . 2 . 3]" 2
261 1 6 SER HA 1 8 GLU H 4.000 . 5.000 4.083 3.832 4.373 . 0 0 "[ . 1 . 2 . 3]" 2
262 1 8 GLU HA 1 10 VAL H 4.000 . 5.000 4.752 4.612 4.990 . 0 0 "[ . 1 . 2 . 3]" 2
263 1 9 GLU HA 1 11 LYS H 4.000 . 5.000 4.326 4.033 4.552 . 0 0 "[ . 1 . 2 . 3]" 2
264 1 11 LYS HA 1 13 TRP H 4.000 . 5.000 4.123 3.906 4.303 . 0 0 "[ . 1 . 2 . 3]" 2
265 1 12 LYS HA 1 14 ALA H 4.000 . 5.000 3.936 3.530 4.265 . 0 0 "[ . 1 . 2 . 3]" 2
266 1 16 SER HA 1 18 GLU H 4.000 . 5.000 4.220 4.075 4.391 . 0 0 "[ . 1 . 2 . 3]" 2
267 1 18 GLU HA 1 20 LEU H 4.000 . 5.000 4.579 4.417 4.693 . 0 0 "[ . 1 . 2 . 3]" 2
268 1 20 LEU HA 1 22 ASN H 4.000 . 5.000 4.279 4.042 4.514 . 0 0 "[ . 1 . 2 . 3]" 2
269 1 21 ILE HA 1 23 HIS H 4.000 . 5.000 3.822 3.693 4.009 . 0 0 "[ . 1 . 2 . 3]" 2
270 1 23 HIS HA 1 25 CYS H 4.000 . 5.000 4.161 3.987 4.322 . 0 0 "[ . 1 . 2 . 3]" 2
271 1 24 GLU HA 1 26 GLY H 4.000 . 5.000 4.466 4.206 4.661 . 0 0 "[ . 1 . 2 . 3]" 2
272 1 25 CYS HA 1 27 LEU H 4.000 . 5.000 4.297 4.080 4.496 . 0 0 "[ . 1 . 2 . 3]" 2
273 1 27 LEU HA 1 29 ALA H 4.000 . 5.000 4.631 4.317 4.905 . 0 0 "[ . 1 . 2 . 3]" 2
274 1 29 ALA HA 1 31 LYS H 4.000 . 5.000 4.652 4.448 4.788 . 0 0 "[ . 1 . 2 . 3]" 2
275 1 32 ALA HA 1 34 LEU H 4.000 . 5.000 4.420 4.298 4.774 . 0 0 "[ . 1 . 2 . 3]" 2
276 1 33 PHE HA 1 35 LYS H 4.000 . 5.000 4.293 4.089 4.519 . 0 0 "[ . 1 . 2 . 3]" 2
277 1 34 LEU HA 1 36 SER H 4.000 . 5.000 4.167 3.989 4.277 . 0 0 "[ . 1 . 2 . 3]" 2
278 1 35 LYS HA 1 37 GLU H 4.000 . 5.000 4.053 3.724 4.347 . 0 0 "[ . 1 . 2 . 3]" 2
279 1 36 SER HA 1 38 TYR H 4.000 . 5.000 3.871 3.777 4.022 . 0 0 "[ . 1 . 2 . 3]" 2
280 1 37 GLU HA 1 39 SER H 4.000 . 5.000 4.580 4.231 4.777 . 0 0 "[ . 1 . 2 . 3]" 2
281 1 38 TYR HA 1 40 GLU H 4.000 . 5.000 3.215 3.084 3.416 . 0 0 "[ . 1 . 2 . 3]" 2
282 1 39 SER HA 1 41 GLU H 4.000 . 5.000 3.237 2.952 3.579 . 0 0 "[ . 1 . 2 . 3]" 2
283 1 40 GLU HA 1 42 ASN H 4.000 . 5.000 3.889 3.737 4.023 . 0 0 "[ . 1 . 2 . 3]" 2
284 1 42 ASN HA 1 44 ASP H 4.000 . 5.000 4.605 4.456 4.717 . 0 0 "[ . 1 . 2 . 3]" 2
285 1 43 ILE HA 1 45 PHE H 4.000 . 5.000 4.295 4.151 4.446 . 0 0 "[ . 1 . 2 . 3]" 2
286 1 44 ASP HA 1 46 TRP H 4.000 . 5.000 4.395 4.289 4.596 . 0 0 "[ . 1 . 2 . 3]" 2
287 1 47 ILE HA 1 49 CYS H 4.000 . 5.000 4.432 4.283 4.611 . 0 0 "[ . 1 . 2 . 3]" 2
288 1 50 GLU HA 1 52 TYR H 4.000 . 5.000 4.294 4.228 4.365 . 0 0 "[ . 1 . 2 . 3]" 2
289 1 52 TYR HA 1 54 LYS H 4.000 . 5.000 4.033 3.907 4.404 . 0 0 "[ . 1 . 2 . 3]" 2
290 1 53 LYS HA 1 55 ILE H 4.000 . 5.000 4.319 4.040 4.594 . 0 0 "[ . 1 . 2 . 3]" 2
291 1 55 ILE HA 1 57 SER H 4.000 . 5.000 3.419 3.240 3.519 . 0 0 "[ . 1 . 2 . 3]" 2
292 1 58 PRO HA 1 60 LYS H 4.000 . 5.000 4.036 3.868 4.146 . 0 0 "[ . 1 . 2 . 3]" 2
293 1 63 PRO HA 1 65 ALA H 4.000 . 5.000 4.511 4.361 4.674 . 0 0 "[ . 1 . 2 . 3]" 2
294 1 64 LYS HA 1 66 LYS H 4.000 . 5.000 4.396 4.176 4.525 . 0 0 "[ . 1 . 2 . 3]" 2
295 1 67 LYS HA 1 69 TYR H 4.000 . 5.000 4.726 4.464 4.812 . 0 0 "[ . 1 . 2 . 3]" 2
296 1 75 VAL HA 1 77 ALA H 4.000 . 5.000 3.677 3.487 4.008 . 0 0 "[ . 1 . 2 . 3]" 2
297 1 77 ALA HA 1 79 LYS H 4.000 . 5.000 3.741 3.535 4.088 . 0 0 "[ . 1 . 2 . 3]" 2
298 1 85 SER HA 1 87 THR H 4.000 . 5.000 4.549 4.319 4.770 . 0 0 "[ . 1 . 2 . 3]" 2
299 1 88 ARG HA 1 90 GLU H 4.000 . 5.000 4.380 4.283 4.502 . 0 0 "[ . 1 . 2 . 3]" 2
300 1 89 GLU HA 1 92 SER H 4.000 . 5.000 3.353 3.248 3.569 . 0 0 "[ . 1 . 2 . 3]" 2
301 1 91 THR HA 1 93 ARG H 4.000 . 5.000 4.312 4.089 4.560 . 0 0 "[ . 1 . 2 . 3]" 2
302 1 92 SER HA 1 94 ASN H 4.000 . 5.000 4.354 4.129 4.530 . 0 0 "[ . 1 . 2 . 3]" 2
303 1 94 ASN HA 1 96 LEU H 4.000 . 5.000 3.970 3.768 4.178 . 0 0 "[ . 1 . 2 . 3]" 2
304 1 100 ILE HA 1 102 CYS H 4.000 . 5.000 3.583 3.506 3.731 . 0 0 "[ . 1 . 2 . 3]" 2
305 1 102 CYS HA 1 104 ASP H 4.000 . 5.000 4.316 4.227 4.376 . 0 0 "[ . 1 . 2 . 3]" 2
306 1 103 PHE HA 1 105 GLU H 4.000 . 5.000 3.916 3.825 4.061 . 0 0 "[ . 1 . 2 . 3]" 2
307 1 106 ALA HA 1 108 LYS H 4.000 . 5.000 4.365 4.243 4.616 . 0 0 "[ . 1 . 2 . 3]" 2
308 1 112 ASN HA 1 114 MET H 4.000 . 5.000 4.975 4.871 5.068 0.068 2 0 "[ . 1 . 2 . 3]" 2
309 1 113 LEU HA 1 115 GLU H 4.000 . 5.000 4.611 4.381 4.758 . 0 0 "[ . 1 . 2 . 3]" 2
310 1 119 TYR HA 1 121 ARG H 4.000 . 5.000 4.415 4.238 4.630 . 0 0 "[ . 1 . 2 . 3]" 2
311 1 123 LEU HA 1 125 SER H 4.000 . 5.000 3.903 3.779 4.005 . 0 0 "[ . 1 . 2 . 3]" 2
312 1 126 ARG HA 1 128 TYR H 4.000 . 5.000 4.650 4.503 4.880 . 0 0 "[ . 1 . 2 . 3]" 2
313 1 127 PHE HA 1 129 LEU H 4.000 . 5.000 4.701 4.556 4.871 . 0 0 "[ . 1 . 2 . 3]" 2
314 1 129 LEU HA 1 131 LEU H 4.000 . 5.000 4.568 4.348 4.846 . 0 0 "[ . 1 . 2 . 3]" 2
315 1 130 ASP HA 1 132 THR H 4.000 . 5.000 4.431 4.079 4.645 . 0 0 "[ . 1 . 2 . 3]" 2
316 1 7 GLN HA 1 10 VAL H 4.000 . 5.000 3.531 3.220 3.742 . 0 0 "[ . 1 . 2 . 3]" 2
317 1 8 GLU HA 1 11 LYS H 4.000 . 5.000 3.864 3.520 4.174 . 0 0 "[ . 1 . 2 . 3]" 2
318 1 9 GLU HA 1 12 LYS H 4.000 . 5.000 3.411 3.129 3.648 . 0 0 "[ . 1 . 2 . 3]" 2
319 1 10 VAL HA 1 13 TRP H 3.000 . 3.500 3.170 2.964 3.342 . 0 0 "[ . 1 . 2 . 3]" 2
320 1 11 LYS HA 1 14 ALA H 4.000 . 5.000 3.295 3.060 3.522 . 0 0 "[ . 1 . 2 . 3]" 2
321 1 12 LYS HA 1 15 GLU H 4.000 . 5.000 3.164 2.959 3.436 . 0 0 "[ . 1 . 2 . 3]" 2
322 1 18 GLU HA 1 21 ILE H 4.000 . 5.000 3.606 3.314 3.838 . 0 0 "[ . 1 . 2 . 3]" 2
323 1 19 ASN HA 1 22 ASN H 4.000 . 5.000 3.318 3.176 3.437 . 0 0 "[ . 1 . 2 . 3]" 2
324 1 20 LEU HA 1 23 HIS H 4.000 . 5.000 3.840 3.598 4.024 . 0 0 "[ . 1 . 2 . 3]" 2
325 1 23 HIS HA 1 26 GLY H 4.000 . 5.000 4.216 4.106 4.362 . 0 0 "[ . 1 . 2 . 3]" 2
326 1 24 GLU HA 1 27 LEU H 4.000 . 5.000 3.804 3.679 3.921 . 0 0 "[ . 1 . 2 . 3]" 2
327 1 25 CYS HA 1 28 ALA H 4.000 . 5.000 3.112 2.927 3.349 . 0 0 "[ . 1 . 2 . 3]" 2
328 1 26 GLY HA3 1 29 ALA H 4.000 . 6.000 4.676 4.400 4.954 . 0 0 "[ . 1 . 2 . 3]" 2
329 1 26 GLY HA2 1 29 ALA H 4.000 . 6.000 3.473 3.084 3.659 . 0 0 "[ . 1 . 2 . 3]" 2
330 1 27 LEU HA 1 30 PHE H 4.000 . 5.000 3.495 3.166 3.716 . 0 0 "[ . 1 . 2 . 3]" 2
331 1 28 ALA HA 1 31 LYS H 4.000 . 5.000 3.776 3.454 4.023 . 0 0 "[ . 1 . 2 . 3]" 2
332 1 29 ALA HA 1 32 ALA H 4.000 . 5.000 3.583 3.258 3.830 . 0 0 "[ . 1 . 2 . 3]" 2
333 1 31 LYS HA 1 34 LEU H 4.000 . 5.000 3.506 3.255 4.104 . 0 0 "[ . 1 . 2 . 3]" 2
334 1 32 ALA HA 1 35 LYS H 4.000 . 5.000 3.436 3.187 3.763 . 0 0 "[ . 1 . 2 . 3]" 2
335 1 33 PHE HA 1 36 SER H 4.000 . 5.000 3.318 3.152 3.573 . 0 0 "[ . 1 . 2 . 3]" 2
336 1 34 LEU HA 1 37 GLU H 4.000 . 5.000 3.189 2.886 3.418 . 0 0 "[ . 1 . 2 . 3]" 2
337 1 35 LYS HA 1 38 TYR H 4.000 . 5.000 3.084 2.892 3.296 . 0 0 "[ . 1 . 2 . 3]" 2
338 1 40 GLU HA 1 43 ILE H 4.000 . 5.000 3.316 3.164 3.446 . 0 0 "[ . 1 . 2 . 3]" 2
339 1 41 GLU HA 1 44 ASP H 4.000 . 5.000 3.473 3.233 3.676 . 0 0 "[ . 1 . 2 . 3]" 2
340 1 42 ASN HA 1 45 PHE H 4.000 . 5.000 3.577 3.421 3.838 . 0 0 "[ . 1 . 2 . 3]" 2
341 1 43 ILE HA 1 46 TRP H 4.000 . 5.000 3.067 2.920 3.191 . 0 0 "[ . 1 . 2 . 3]" 2
342 1 44 ASP HA 1 47 ILE H 4.000 . 5.000 3.432 3.323 3.610 . 0 0 "[ . 1 . 2 . 3]" 2
343 1 47 ILE HA 1 50 GLU H 4.000 . 5.000 3.409 3.205 3.655 . 0 0 "[ . 1 . 2 . 3]" 2
344 1 48 SER HA 1 51 GLU H 4.000 . 5.000 3.597 3.441 3.847 . 0 0 "[ . 1 . 2 . 3]" 2
345 1 50 GLU HA 1 53 LYS H 4.000 . 5.000 3.232 3.085 3.426 . 0 0 "[ . 1 . 2 . 3]" 2
346 1 51 GLU HA 1 54 LYS H 4.000 . 5.000 3.336 3.135 3.543 . 0 0 "[ . 1 . 2 . 3]" 2
347 1 52 TYR HA 1 55 ILE H 4.000 . 5.000 3.537 3.352 3.725 . 0 0 "[ . 1 . 2 . 3]" 2
348 1 61 LEU HA 1 64 LYS H 4.000 . 5.000 4.007 3.811 4.137 . 0 0 "[ . 1 . 2 . 3]" 2
349 1 62 SER HA 1 65 ALA H 4.000 . 5.000 3.582 3.489 3.715 . 0 0 "[ . 1 . 2 . 3]" 2
350 1 64 LYS HA 1 67 LYS H 4.000 . 5.000 3.178 2.969 3.301 . 0 0 "[ . 1 . 2 . 3]" 2
351 1 66 LYS HA 1 69 TYR H 4.000 . 5.000 3.638 3.531 3.736 . 0 0 "[ . 1 . 2 . 3]" 2
352 1 67 LYS HA 1 70 ASN H 4.000 . 5.000 3.753 3.396 3.935 . 0 0 "[ . 1 . 2 . 3]" 2
353 1 68 ILE HA 1 71 GLU H 4.000 . 5.000 3.539 3.371 3.668 . 0 0 "[ . 1 . 2 . 3]" 2
354 1 86 CYS HA 1 89 GLU H 4.000 . 5.000 3.490 3.257 3.652 . 0 0 "[ . 1 . 2 . 3]" 2
355 1 88 ARG HA 1 91 THR H 4.000 . 5.000 3.432 3.135 3.567 . 0 0 "[ . 1 . 2 . 3]" 2
356 1 91 THR HA 1 94 ASN H 4.000 . 5.000 3.274 3.057 3.427 . 0 0 "[ . 1 . 2 . 3]" 2
357 1 92 SER HA 1 95 MET H 4.000 . 5.000 3.507 3.039 3.704 . 0 0 "[ . 1 . 2 . 3]" 2
358 1 94 ASN HA 1 97 GLU H 4.000 . 5.000 3.122 2.959 3.371 . 0 0 "[ . 1 . 2 . 3]" 2
359 1 101 THR HA 1 104 ASP H 4.000 . 5.000 3.086 2.842 3.219 . 0 0 "[ . 1 . 2 . 3]" 2
360 1 103 PHE HA 1 106 ALA H 4.000 . 5.000 3.022 2.777 3.159 . 0 0 "[ . 1 . 2 . 3]" 2
361 1 104 ASP HA 1 107 GLN H 4.000 . 5.000 3.423 3.190 3.579 . 0 0 "[ . 1 . 2 . 3]" 2
362 1 106 ALA HA 1 109 LYS H 4.000 . 5.000 3.336 3.214 3.605 . 0 0 "[ . 1 . 2 . 3]" 2
363 1 107 GLN HA 1 110 ILE H 4.000 . 5.000 3.210 3.036 3.352 . 0 0 "[ . 1 . 2 . 3]" 2
364 1 108 LYS HA 1 111 PHE H 4.000 . 5.000 3.409 3.284 3.610 . 0 0 "[ . 1 . 2 . 3]" 2
365 1 111 PHE HA 1 114 MET H 4.000 . 5.000 3.925 3.741 4.124 . 0 0 "[ . 1 . 2 . 3]" 2
366 1 112 ASN HA 1 115 GLU H 4.000 . 5.000 3.733 3.591 3.875 . 0 0 "[ . 1 . 2 . 3]" 2
367 1 114 MET HA 1 117 ASP H 4.000 . 5.000 3.393 3.165 3.645 . 0 0 "[ . 1 . 2 . 3]" 2
368 1 115 GLU HA 1 118 SER H 4.000 . 5.000 4.422 3.848 5.124 0.124 15 0 "[ . 1 . 2 . 3]" 2
369 1 119 TYR HA 1 122 PHE H 4.000 . 5.000 3.224 3.095 3.356 . 0 0 "[ . 1 . 2 . 3]" 2
370 1 120 ARG HA 1 123 LEU H 4.000 . 5.000 3.743 3.548 4.191 . 0 0 "[ . 1 . 2 . 3]" 2
371 1 121 ARG HA 1 124 LYS H 4.000 . 5.000 3.340 3.147 3.587 . 0 0 "[ . 1 . 2 . 3]" 2
372 1 126 ARG HA 1 129 LEU H 4.000 . 5.000 3.575 3.369 3.794 . 0 0 "[ . 1 . 2 . 3]" 2
373 1 127 PHE HA 1 130 ASP H 4.000 . 5.000 3.711 3.470 4.088 . 0 0 "[ . 1 . 2 . 3]" 2
374 1 129 LEU HA 1 132 THR H 4.000 . 5.000 3.363 3.104 3.692 . 0 0 "[ . 1 . 2 . 3]" 2
375 1 130 ASP HA 1 133 ASN H 4.000 . 5.000 5.044 4.733 5.250 0.250 19 0 "[ . 1 . 2 . 3]" 2
376 1 9 GLU HA 1 13 TRP H 4.000 . 5.000 4.708 4.121 5.079 0.079 7 0 "[ . 1 . 2 . 3]" 2
377 1 11 LYS HA 1 15 GLU H 4.000 . 5.000 5.032 4.807 5.157 0.157 28 0 "[ . 1 . 2 . 3]" 2
378 1 17 LEU HA 1 21 ILE H 4.000 . 5.000 4.209 3.895 4.518 . 0 0 "[ . 1 . 2 . 3]" 2
379 1 27 LEU HA 1 31 LYS H 4.000 . 5.000 3.408 3.072 3.727 . 0 0 "[ . 1 . 2 . 3]" 2
380 1 31 LYS HA 1 35 LYS H 4.000 . 5.000 4.366 3.816 4.623 . 0 0 "[ . 1 . 2 . 3]" 2
381 1 32 ALA HA 1 36 SER H 4.000 . 5.000 4.605 4.076 5.090 0.090 28 0 "[ . 1 . 2 . 3]" 2
382 1 40 GLU HA 1 44 ASP H 4.000 . 5.000 4.352 3.879 4.690 . 0 0 "[ . 1 . 2 . 3]" 2
383 1 42 ASN HA 1 46 TRP H 4.000 . 5.000 3.939 3.639 4.229 . 0 0 "[ . 1 . 2 . 3]" 2
384 1 43 ILE HA 1 47 ILE H 4.000 . 5.000 3.908 3.713 4.118 . 0 0 "[ . 1 . 2 . 3]" 2
385 1 44 ASP HA 1 48 SER H 4.000 . 5.000 4.281 4.015 4.576 . 0 0 "[ . 1 . 2 . 3]" 2
386 1 47 ILE HA 1 51 GLU H 4.000 . 5.000 4.233 3.857 4.486 . 0 0 "[ . 1 . 2 . 3]" 2
387 1 48 SER HA 1 52 TYR H 4.000 . 5.000 4.350 3.997 4.599 . 0 0 "[ . 1 . 2 . 3]" 2
388 1 50 GLU HA 1 54 LYS H 4.000 . 5.000 4.477 4.175 4.807 . 0 0 "[ . 1 . 2 . 3]" 2
389 1 63 PRO HA 1 67 LYS H 4.000 . 5.000 4.776 4.448 5.122 0.122 5 0 "[ . 1 . 2 . 3]" 2
390 1 66 LYS HA 1 70 ASN H 4.000 . 5.000 3.376 3.144 3.769 . 0 0 "[ . 1 . 2 . 3]" 2
391 1 67 LYS HA 1 71 GLU H 4.000 . 5.000 3.842 3.565 4.152 . 0 0 "[ . 1 . 2 . 3]" 2
392 1 68 ILE HA 1 72 PHE H 4.000 . 5.000 3.388 3.114 4.046 . 0 0 "[ . 1 . 2 . 3]" 2
393 1 86 CYS HA 1 90 GLU H 4.000 . 5.000 3.924 3.530 4.601 . 0 0 "[ . 1 . 2 . 3]" 2
394 1 88 ARG HA 1 92 SER H 4.000 . 5.000 4.446 4.143 4.631 . 0 0 "[ . 1 . 2 . 3]" 2
395 1 90 GLU HA 1 94 ASN H 4.000 . 5.000 4.256 3.922 4.530 . 0 0 "[ . 1 . 2 . 3]" 2
396 1 91 THR HA 1 95 MET H 4.000 . 5.000 4.535 3.909 5.079 0.079 25 0 "[ . 1 . 2 . 3]" 2
397 1 98 PRO HA 1 102 CYS H 5.000 3.000 6.000 5.466 5.288 5.696 . 0 0 "[ . 1 . 2 . 3]" 2
398 1 106 ALA HA 1 110 ILE H 4.000 . 5.000 4.276 3.948 4.595 . 0 0 "[ . 1 . 2 . 3]" 2
399 1 108 LYS HA 1 112 ASN H 4.000 . 5.000 3.899 3.542 4.442 . 0 0 "[ . 1 . 2 . 3]" 2
400 1 112 ASN HA 1 116 LYS H 4.000 . 5.000 3.653 3.142 4.062 . 0 0 "[ . 1 . 2 . 3]" 2
401 1 113 LEU HA 1 117 ASP H 4.000 . 5.000 4.291 3.816 4.626 . 0 0 "[ . 1 . 2 . 3]" 2
402 1 115 GLU HA 1 119 TYR H 4.000 . 5.000 2.955 2.476 3.481 . 0 0 "[ . 1 . 2 . 3]" 2
403 1 126 ARG HA 1 130 ASP H 4.000 . 5.000 3.673 3.124 4.220 . 0 0 "[ . 1 . 2 . 3]" 2
404 1 7 GLN HA 1 10 VAL HB 4.000 . 5.000 4.853 4.671 5.049 0.049 22 0 "[ . 1 . 2 . 3]" 2
405 1 8 GLU HA 1 11 LYS QB 4.000 . 6.000 3.135 2.432 3.689 . 0 0 "[ . 1 . 2 . 3]" 2
406 1 9 GLU HA 1 12 LYS HB3 4.000 . 5.000 4.560 4.092 5.026 0.026 7 0 "[ . 1 . 2 . 3]" 2
407 1 12 LYS HA 1 15 GLU QB 4.000 . 6.000 2.505 2.286 3.037 . 0 0 "[ . 1 . 2 . 3]" 2
408 1 17 LEU HA 1 20 LEU QB 4.000 . 6.000 2.858 2.604 3.098 . 0 0 "[ . 1 . 2 . 3]" 2
409 1 19 ASN HA 1 22 ASN QB 4.000 . 6.000 2.401 2.258 2.661 . 0 0 "[ . 1 . 2 . 3]" 2
410 1 24 GLU HA 1 27 LEU HB2 4.000 . 5.000 3.175 2.851 3.428 . 0 0 "[ . 1 . 2 . 3]" 2
411 1 25 CYS HA 1 28 ALA MB 4.000 . 6.500 2.423 2.228 2.680 . 0 0 "[ . 1 . 2 . 3]" 2
412 1 26 GLY QA 1 28 ALA MB 4.000 . 7.500 4.639 4.312 4.827 . 0 0 "[ . 1 . 2 . 3]" 2
413 1 29 ALA HA 1 32 ALA MB 4.000 . 6.500 2.700 2.351 3.235 . 0 0 "[ . 1 . 2 . 3]" 2
414 1 30 PHE HA 1 33 PHE QB 4.000 . 6.000 2.416 2.162 3.299 . 0 0 "[ . 1 . 2 . 3]" 2
415 1 32 ALA HA 1 35 LYS QB 4.000 . 6.000 2.818 2.268 3.349 . 0 0 "[ . 1 . 2 . 3]" 2
416 1 34 LEU HA 1 37 GLU HB2 4.000 . 5.000 2.795 2.320 3.256 . 0 0 "[ . 1 . 2 . 3]" 2
417 1 40 GLU HA 1 43 ILE HB 4.000 . 5.000 4.091 3.678 4.478 . 0 0 "[ . 1 . 2 . 3]" 2
418 1 41 GLU HA 1 44 ASP QB 4.000 . 6.000 2.514 2.328 2.767 . 0 0 "[ . 1 . 2 . 3]" 2
419 1 44 ASP HA 1 47 ILE HB 4.000 . 5.000 2.899 2.634 3.146 . 0 0 "[ . 1 . 2 . 3]" 2
420 1 47 ILE HA 1 50 GLU QB 4.000 . 6.000 2.668 2.263 3.557 . 0 0 "[ . 1 . 2 . 3]" 2
421 1 48 SER HA 1 51 GLU HB3 4.000 . 5.000 4.693 4.350 5.036 0.036 29 0 "[ . 1 . 2 . 3]" 2
422 1 48 SER HA 1 51 GLU HB2 4.000 . 5.000 3.074 2.725 3.368 . 0 0 "[ . 1 . 2 . 3]" 2
423 1 50 GLU HA 1 53 LYS HB2 4.000 . 5.000 2.599 2.331 2.959 . 0 0 "[ . 1 . 2 . 3]" 2
424 1 51 GLU HA 1 54 LYS HB3 4.000 . 5.000 4.338 4.043 4.783 . 0 0 "[ . 1 . 2 . 3]" 2
425 1 51 GLU HA 1 54 LYS HB2 4.000 . 5.000 2.724 2.371 3.121 . 0 0 "[ . 1 . 2 . 3]" 2
426 1 62 SER HA 1 65 ALA MB 4.000 . 6.500 2.280 2.227 2.525 . 0 0 "[ . 1 . 2 . 3]" 2
427 1 63 PRO HA 1 66 LYS HB2 4.000 . 5.000 3.855 3.433 4.462 . 0 0 "[ . 1 . 2 . 3]" 2
428 1 64 LYS HA 1 67 LYS QB 4.000 . 6.000 2.364 2.295 2.530 . 0 0 "[ . 1 . 2 . 3]" 2
429 1 66 LYS HA 1 69 TYR HB3 4.000 . 5.000 2.460 2.302 2.709 . 0 0 "[ . 1 . 2 . 3]" 2
430 1 66 LYS HA 1 69 TYR HB2 4.000 . 5.000 3.711 3.218 3.952 . 0 0 "[ . 1 . 2 . 3]" 2
431 1 67 LYS HA 1 70 ASN HB3 4.000 . 5.000 4.371 3.946 4.706 . 0 0 "[ . 1 . 2 . 3]" 2
432 1 67 LYS HA 1 70 ASN HB2 4.000 . 5.000 2.765 2.349 3.083 . 0 0 "[ . 1 . 2 . 3]" 2
433 1 68 ILE HA 1 71 GLU QB 4.000 . 6.000 2.699 2.436 3.058 . 0 0 "[ . 1 . 2 . 3]" 2
434 1 86 CYS HA 1 89 GLU HB3 4.000 . 5.000 4.298 3.937 4.766 . 0 0 "[ . 1 . 2 . 3]" 2
435 1 86 CYS HA 1 89 GLU HB2 4.000 . 5.000 2.669 2.327 3.184 . 0 0 "[ . 1 . 2 . 3]" 2
436 1 87 THR HA 1 90 GLU QB 4.000 . 6.000 2.425 2.247 2.813 . 0 0 "[ . 1 . 2 . 3]" 2
437 1 88 ARG HA 1 91 THR HB 4.000 . 5.000 3.353 2.810 3.594 . 0 0 "[ . 1 . 2 . 3]" 2
438 1 90 GLU HA 1 93 ARG HB2 4.000 . 5.000 2.777 2.505 3.206 . 0 0 "[ . 1 . 2 . 3]" 2
439 1 91 THR HA 1 94 ASN HB2 4.000 . 5.000 2.576 2.333 3.000 . 0 0 "[ . 1 . 2 . 3]" 2
440 1 92 SER HA 1 95 MET HB2 4.000 . 5.000 3.523 2.364 4.158 . 0 0 "[ . 1 . 2 . 3]" 2
441 1 104 ASP HA 1 107 GLN HB3 4.000 . 5.000 2.958 2.496 4.333 . 0 0 "[ . 1 . 2 . 3]" 2
442 1 104 ASP HA 1 107 GLN HB2 4.000 . 5.000 3.612 2.747 4.118 . 0 0 "[ . 1 . 2 . 3]" 2
443 1 105 GLU HA 1 108 LYS QB 4.000 . 6.000 2.679 2.331 2.878 . 0 0 "[ . 1 . 2 . 3]" 2
444 1 106 ALA HA 1 109 LYS QB 4.000 . 6.000 2.761 2.613 3.159 . 0 0 "[ . 1 . 2 . 3]" 2
445 1 107 GLN HA 1 110 ILE HB 4.000 . 5.000 2.643 2.348 2.952 . 0 0 "[ . 1 . 2 . 3]" 2
446 1 108 LYS HA 1 111 PHE QB 4.000 . 6.000 2.498 2.334 2.853 . 0 0 "[ . 1 . 2 . 3]" 2
447 1 109 LYS HA 1 112 ASN HB3 4.000 . 5.000 4.276 4.015 4.942 . 0 0 "[ . 1 . 2 . 3]" 2
448 1 110 ILE HA 1 113 LEU HB3 4.000 . 5.000 2.498 2.294 3.766 . 0 0 "[ . 1 . 2 . 3]" 2
449 1 110 ILE HA 1 113 LEU HB2 4.000 . 5.000 3.335 2.247 3.759 . 0 0 "[ . 1 . 2 . 3]" 2
450 1 112 ASN HA 1 115 GLU QB 4.000 . 6.000 2.464 2.298 2.868 . 0 0 "[ . 1 . 2 . 3]" 2
451 1 113 LEU HA 1 116 LYS HB2 4.000 . 5.000 3.310 2.957 4.026 . 0 0 "[ . 1 . 2 . 3]" 2
452 1 114 MET HA 1 117 ASP QB 4.000 . 6.000 3.144 2.325 4.774 . 0 0 "[ . 1 . 2 . 3]" 2
453 1 117 ASP HA 1 120 ARG HB2 4.000 . 5.000 3.526 2.796 4.237 . 0 0 "[ . 1 . 2 . 3]" 2
454 1 119 TYR HA 1 122 PHE QB 4.000 . 6.000 2.253 2.094 2.487 . 0 0 "[ . 1 . 2 . 3]" 2
455 1 121 ARG HA 1 124 LYS HB2 4.000 . 5.000 2.623 2.411 2.945 . 0 0 "[ . 1 . 2 . 3]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 78
_Distance_constraint_stats_list.Viol_count 296
_Distance_constraint_stats_list.Viol_total 417.637
_Distance_constraint_stats_list.Viol_max 0.349
_Distance_constraint_stats_list.Viol_rms 0.0219
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0059
_Distance_constraint_stats_list.Viol_average_violations_only 0.0470
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 17 LEU 0.038 0.037 27 0 "[ . 1 . 2 . 3]"
1 18 GLU 0.004 0.004 18 0 "[ . 1 . 2 . 3]"
1 19 ASN 2.211 0.220 9 0 "[ . 1 . 2 . 3]"
1 21 ILE 0.038 0.037 27 0 "[ . 1 . 2 . 3]"
1 22 ASN 0.004 0.004 18 0 "[ . 1 . 2 . 3]"
1 23 HIS 2.211 0.220 9 0 "[ . 1 . 2 . 3]"
1 24 GLU 3.358 0.172 13 0 "[ . 1 . 2 . 3]"
1 25 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 26 GLY 1.052 0.071 13 0 "[ . 1 . 2 . 3]"
1 27 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 28 ALA 3.724 0.172 13 0 "[ . 1 . 2 . 3]"
1 29 ALA 0.036 0.035 29 0 "[ . 1 . 2 . 3]"
1 30 PHE 1.052 0.071 13 0 "[ . 1 . 2 . 3]"
1 31 LYS 1.571 0.130 28 0 "[ . 1 . 2 . 3]"
1 32 ALA 0.366 0.067 18 0 "[ . 1 . 2 . 3]"
1 33 PHE 0.036 0.035 29 0 "[ . 1 . 2 . 3]"
1 34 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 35 LYS 1.571 0.130 28 0 "[ . 1 . 2 . 3]"
1 40 GLU 0.558 0.089 9 0 "[ . 1 . 2 . 3]"
1 41 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 42 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 43 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 44 ASP 0.660 0.089 9 0 "[ . 1 . 2 . 3]"
1 45 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 46 TRP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 47 ILE 0.493 0.085 29 0 "[ . 1 . 2 . 3]"
1 48 SER 0.217 0.050 7 0 "[ . 1 . 2 . 3]"
1 49 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 51 GLU 0.493 0.085 29 0 "[ . 1 . 2 . 3]"
1 52 TYR 0.114 0.046 29 0 "[ . 1 . 2 . 3]"
1 53 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 62 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 64 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 66 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 67 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 68 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 71 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 86 CYS 0.011 0.011 1 0 "[ . 1 . 2 . 3]"
1 88 ARG 0.179 0.062 4 0 "[ . 1 . 2 . 3]"
1 89 GLU 0.063 0.052 15 0 "[ . 1 . 2 . 3]"
1 90 GLU 0.011 0.011 1 0 "[ . 1 . 2 . 3]"
1 92 SER 0.179 0.062 4 0 "[ . 1 . 2 . 3]"
1 93 ARG 0.063 0.052 15 0 "[ . 1 . 2 . 3]"
1 105 GLU 0.069 0.028 11 0 "[ . 1 . 2 . 3]"
1 106 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 107 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 109 LYS 0.084 0.028 11 0 "[ . 1 . 2 . 3]"
1 110 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 111 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 113 LEU 0.269 0.084 12 0 "[ . 1 . 2 . 3]"
1 114 MET 1.463 0.349 2 0 "[ . 1 . 2 . 3]"
1 115 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 117 ASP 0.255 0.084 12 0 "[ . 1 . 2 . 3]"
1 118 SER 0.772 0.085 18 0 "[ . 1 . 2 . 3]"
1 119 TYR 1.463 0.349 2 0 "[ . 1 . 2 . 3]"
1 120 ARG 1.193 0.119 23 0 "[ . 1 . 2 . 3]"
1 122 PHE 0.772 0.085 18 0 "[ . 1 . 2 . 3]"
1 123 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 124 LYS 1.193 0.119 23 0 "[ . 1 . 2 . 3]"
1 125 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
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 17 LEU O 1 21 ILE H 1.800 . 2.300 2.059 1.883 2.337 0.037 27 0 "[ . 1 . 2 . 3]" 3
2 1 17 LEU O 1 21 ILE N 2.800 2.400 3.300 3.026 2.851 3.301 0.001 27 0 "[ . 1 . 2 . 3]" 3
3 1 18 GLU O 1 22 ASN H 1.800 . 2.300 1.819 1.536 2.268 . 0 0 "[ . 1 . 2 . 3]" 3
4 1 18 GLU O 1 22 ASN N 2.800 2.400 3.300 2.592 2.396 2.926 0.004 18 0 "[ . 1 . 2 . 3]" 3
5 1 19 ASN O 1 23 HIS H 1.800 . 2.300 2.369 2.204 2.520 0.220 9 0 "[ . 1 . 2 . 3]" 3
6 1 19 ASN O 1 23 HIS N 2.800 2.400 3.300 2.917 2.658 3.196 . 0 0 "[ . 1 . 2 . 3]" 3
7 1 23 HIS O 1 27 LEU H 1.800 . 2.300 1.892 1.699 2.021 . 0 0 "[ . 1 . 2 . 3]" 3
8 1 23 HIS O 1 27 LEU N 2.800 2.400 3.300 2.848 2.606 2.991 . 0 0 "[ . 1 . 2 . 3]" 3
9 1 24 GLU O 1 28 ALA H 1.800 . 2.300 2.383 2.323 2.472 0.172 13 0 "[ . 1 . 2 . 3]" 3
10 1 24 GLU O 1 28 ALA N 2.800 2.400 3.300 3.324 3.255 3.379 0.079 17 0 "[ . 1 . 2 . 3]" 3
11 1 25 CYS O 1 29 ALA H 1.800 . 2.300 1.704 1.546 2.018 . 0 0 "[ . 1 . 2 . 3]" 3
12 1 25 CYS O 1 29 ALA N 2.800 2.400 3.300 2.666 2.514 2.970 . 0 0 "[ . 1 . 2 . 3]" 3
13 1 26 GLY O 1 30 PHE H 1.800 . 2.300 1.487 1.429 1.702 0.071 13 0 "[ . 1 . 2 . 3]" 3
14 1 26 GLY O 1 30 PHE N 2.800 2.400 3.300 2.408 2.357 2.653 0.043 14 0 "[ . 1 . 2 . 3]" 3
15 1 27 LEU O 1 31 LYS H 1.800 . 2.300 1.679 1.523 1.986 . 0 0 "[ . 1 . 2 . 3]" 3
16 1 27 LEU O 1 31 LYS N 2.800 2.400 3.300 2.634 2.471 2.960 . 0 0 "[ . 1 . 2 . 3]" 3
17 1 28 ALA O 1 32 ALA H 1.800 . 2.300 2.195 1.701 2.367 0.067 18 0 "[ . 1 . 2 . 3]" 3
18 1 28 ALA O 1 32 ALA N 2.800 2.400 3.300 3.117 2.608 3.312 0.012 10 0 "[ . 1 . 2 . 3]" 3
19 1 29 ALA O 1 33 PHE H 1.800 . 2.300 1.803 1.465 2.134 0.035 29 0 "[ . 1 . 2 . 3]" 3
20 1 29 ALA O 1 33 PHE N 2.800 2.400 3.300 2.729 2.399 3.083 0.001 29 0 "[ . 1 . 2 . 3]" 3
21 1 30 PHE O 1 34 LEU H 1.800 . 2.300 1.859 1.668 2.194 . 0 0 "[ . 1 . 2 . 3]" 3
22 1 30 PHE O 1 34 LEU N 2.800 2.400 3.300 2.800 2.591 3.155 . 0 0 "[ . 1 . 2 . 3]" 3
23 1 31 LYS O 1 35 LYS H 1.800 . 2.300 2.299 1.815 2.430 0.130 28 0 "[ . 1 . 2 . 3]" 3
24 1 31 LYS O 1 35 LYS N 2.800 2.400 3.300 3.208 2.713 3.331 0.031 16 0 "[ . 1 . 2 . 3]" 3
25 1 40 GLU O 1 44 ASP H 1.800 . 2.300 2.193 1.894 2.389 0.089 9 0 "[ . 1 . 2 . 3]" 3
26 1 40 GLU O 1 44 ASP N 2.800 2.400 3.300 3.162 2.854 3.364 0.064 9 0 "[ . 1 . 2 . 3]" 3
27 1 41 GLU O 1 45 PHE H 1.800 . 2.300 1.803 1.613 2.034 . 0 0 "[ . 1 . 2 . 3]" 3
28 1 41 GLU O 1 45 PHE N 2.800 2.400 3.300 2.720 2.523 2.956 . 0 0 "[ . 1 . 2 . 3]" 3
29 1 42 ASN O 1 46 TRP H 1.800 . 2.300 1.830 1.626 2.072 . 0 0 "[ . 1 . 2 . 3]" 3
30 1 42 ASN O 1 46 TRP N 2.800 2.400 3.300 2.721 2.504 2.987 . 0 0 "[ . 1 . 2 . 3]" 3
31 1 43 ILE O 1 47 ILE H 1.800 . 2.300 1.867 1.677 2.080 . 0 0 "[ . 1 . 2 . 3]" 3
32 1 43 ILE O 1 47 ILE N 2.800 2.400 3.300 2.806 2.644 2.989 . 0 0 "[ . 1 . 2 . 3]" 3
33 1 44 ASP O 1 48 SER H 1.800 . 2.300 2.142 1.924 2.350 0.050 7 0 "[ . 1 . 2 . 3]" 3
34 1 44 ASP O 1 48 SER N 2.800 2.400 3.300 3.084 2.872 3.297 . 0 0 "[ . 1 . 2 . 3]" 3
35 1 45 PHE O 1 49 CYS H 1.800 . 2.300 1.804 1.560 2.025 . 0 0 "[ . 1 . 2 . 3]" 3
36 1 45 PHE O 1 49 CYS N 2.800 2.400 3.300 2.731 2.482 2.936 . 0 0 "[ . 1 . 2 . 3]" 3
37 1 47 ILE O 1 51 GLU H 1.800 . 2.300 2.245 2.014 2.385 0.085 29 0 "[ . 1 . 2 . 3]" 3
38 1 47 ILE O 1 51 GLU N 2.800 2.400 3.300 3.197 2.985 3.342 0.042 12 0 "[ . 1 . 2 . 3]" 3
39 1 48 SER O 1 52 TYR H 1.800 . 2.300 2.163 1.868 2.346 0.046 29 0 "[ . 1 . 2 . 3]" 3
40 1 48 SER O 1 52 TYR N 2.800 2.400 3.300 3.072 2.762 3.279 . 0 0 "[ . 1 . 2 . 3]" 3
41 1 49 CYS O 1 53 LYS H 1.800 . 2.300 1.866 1.624 2.090 . 0 0 "[ . 1 . 2 . 3]" 3
42 1 49 CYS O 1 53 LYS N 2.800 2.400 3.300 2.763 2.540 2.984 . 0 0 "[ . 1 . 2 . 3]" 3
43 1 62 SER O 1 66 LYS H 1.800 . 2.300 2.048 1.815 2.255 . 0 0 "[ . 1 . 2 . 3]" 3
44 1 62 SER O 1 66 LYS N 2.800 2.400 3.300 3.010 2.787 3.199 . 0 0 "[ . 1 . 2 . 3]" 3
45 1 64 LYS O 1 68 ILE H 1.800 . 2.300 1.681 1.508 1.827 . 0 0 "[ . 1 . 2 . 3]" 3
46 1 64 LYS O 1 68 ILE N 2.800 2.400 3.300 2.651 2.487 2.803 . 0 0 "[ . 1 . 2 . 3]" 3
47 1 67 LYS O 1 71 GLU H 1.800 . 2.300 1.927 1.633 2.136 . 0 0 "[ . 1 . 2 . 3]" 3
48 1 67 LYS O 1 71 GLU N 2.800 2.400 3.300 2.817 2.540 3.043 . 0 0 "[ . 1 . 2 . 3]" 3
49 1 86 CYS O 1 90 GLU H 1.800 . 2.300 1.815 1.540 2.311 0.011 1 0 "[ . 1 . 2 . 3]" 3
50 1 86 CYS O 1 90 GLU N 2.800 2.400 3.300 2.734 2.425 3.229 . 0 0 "[ . 1 . 2 . 3]" 3
51 1 88 ARG O 1 92 SER H 1.800 . 2.300 2.208 1.978 2.362 0.062 4 0 "[ . 1 . 2 . 3]" 3
52 1 88 ARG O 1 92 SER N 2.800 2.400 3.300 3.145 2.922 3.296 . 0 0 "[ . 1 . 2 . 3]" 3
53 1 89 GLU O 1 93 ARG H 1.800 . 2.300 2.120 1.785 2.352 0.052 15 0 "[ . 1 . 2 . 3]" 3
54 1 89 GLU O 1 93 ARG N 2.800 2.400 3.300 3.035 2.707 3.223 . 0 0 "[ . 1 . 2 . 3]" 3
55 1 105 GLU O 1 109 LYS H 1.800 . 2.300 2.197 1.993 2.328 0.028 11 0 "[ . 1 . 2 . 3]" 3
56 1 105 GLU O 1 109 LYS N 2.800 2.400 3.300 3.092 2.869 3.224 . 0 0 "[ . 1 . 2 . 3]" 3
57 1 106 ALA O 1 110 ILE H 1.800 . 2.300 2.026 1.792 2.297 . 0 0 "[ . 1 . 2 . 3]" 3
58 1 106 ALA O 1 110 ILE N 2.800 2.400 3.300 2.942 2.738 3.183 . 0 0 "[ . 1 . 2 . 3]" 3
59 1 107 GLN O 1 111 PHE H 1.800 . 2.300 1.835 1.622 2.093 . 0 0 "[ . 1 . 2 . 3]" 3
60 1 107 GLN O 1 111 PHE N 2.800 2.400 3.300 2.792 2.592 3.050 . 0 0 "[ . 1 . 2 . 3]" 3
61 1 109 LYS O 1 113 LEU H 1.800 . 2.300 1.781 1.485 2.172 0.015 4 0 "[ . 1 . 2 . 3]" 3
62 1 109 LYS O 1 113 LEU N 2.800 2.400 3.300 2.696 2.433 3.109 . 0 0 "[ . 1 . 2 . 3]" 3
63 1 110 ILE O 1 114 MET H 1.800 . 2.300 1.891 1.653 2.135 . 0 0 "[ . 1 . 2 . 3]" 3
64 1 110 ILE O 1 114 MET N 2.800 2.400 3.300 2.847 2.583 3.098 . 0 0 "[ . 1 . 2 . 3]" 3
65 1 111 PHE O 1 115 GLU H 1.800 . 2.300 1.834 1.664 2.034 . 0 0 "[ . 1 . 2 . 3]" 3
66 1 111 PHE O 1 115 GLU N 2.800 2.400 3.300 2.722 2.551 2.950 . 0 0 "[ . 1 . 2 . 3]" 3
67 1 113 LEU O 1 117 ASP H 1.800 . 2.300 2.156 1.858 2.384 0.084 12 0 "[ . 1 . 2 . 3]" 3
68 1 113 LEU O 1 117 ASP N 2.800 2.400 3.300 2.997 2.725 3.319 0.019 9 0 "[ . 1 . 2 . 3]" 3
69 1 114 MET O 1 119 TYR H 1.800 . 2.300 2.186 1.820 2.649 0.349 2 0 "[ . 1 . 2 . 3]" 3
70 1 114 MET O 1 119 TYR N 2.800 2.400 3.300 3.075 2.742 3.443 0.143 2 0 "[ . 1 . 2 . 3]" 3
71 1 118 SER O 1 122 PHE H 1.800 . 2.300 1.523 1.415 1.742 0.085 18 0 "[ . 1 . 2 . 3]" 3
72 1 118 SER O 1 122 PHE N 2.800 2.400 3.300 2.441 2.369 2.620 0.031 22 0 "[ . 1 . 2 . 3]" 3
73 1 119 TYR O 1 123 LEU H 1.800 . 2.300 1.947 1.665 2.125 . 0 0 "[ . 1 . 2 . 3]" 3
74 1 119 TYR O 1 123 LEU N 2.800 2.400 3.300 2.917 2.615 3.100 . 0 0 "[ . 1 . 2 . 3]" 3
75 1 120 ARG O 1 124 LYS H 1.800 . 2.300 2.318 2.140 2.419 0.119 23 0 "[ . 1 . 2 . 3]" 3
76 1 120 ARG O 1 124 LYS N 2.800 2.400 3.300 3.201 3.007 3.325 0.025 4 0 "[ . 1 . 2 . 3]" 3
77 1 122 PHE O 1 125 SER H 1.800 . 2.300 2.038 1.766 2.183 . 0 0 "[ . 1 . 2 . 3]" 3
78 1 122 PHE O 1 125 SER N 2.800 2.400 3.300 2.910 2.641 3.083 . 0 0 "[ . 1 . 2 . 3]" 3
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