NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
636519 |
5zor   |
36179 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5zor
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 1669
_Distance_constraint_stats_list.Viol_count 28
_Distance_constraint_stats_list.Viol_total 10.140
_Distance_constraint_stats_list.Viol_max 0.026
_Distance_constraint_stats_list.Viol_rms 0.0006
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_Distance_constraint_stats_list.Viol_average_violations_only 0.0181
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 PHE 0.003 0.002 20 0 "[ . 1 . 2]"
1 14 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 ASP 0.000 0.000 20 0 "[ . 1 . 2]"
1 18 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 ILE 0.000 0.000 20 0 "[ . 1 . 2]"
1 25 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 GLU 0.000 0.000 20 0 "[ . 1 . 2]"
1 48 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 ASN 0.000 0.000 10 0 "[ . 1 . 2]"
1 55 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 ASN 0.000 0.000 10 0 "[ . 1 . 2]"
1 59 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 GLU 0.002 0.002 20 0 "[ . 1 . 2]"
1 63 TYR 0.001 0.001 20 0 "[ . 1 . 2]"
1 64 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 PHE 0.003 0.002 20 0 "[ . 1 . 2]"
1 67 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 PHE 0.001 0.001 2 0 "[ . 1 . 2]"
1 88 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 ILE 0.000 0.000 4 0 "[ . 1 . 2]"
1 99 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 114 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 116 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 118 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 120 GLN 0.501 0.026 1 0 "[ . 1 . 2]"
1 121 GLU 0.501 0.026 1 0 "[ . 1 . 2]"
1 122 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 123 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 124 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 127 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 128 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 129 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 130 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 131 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 132 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 133 GLU 0.000 0.000 4 0 "[ . 1 . 2]"
1 134 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 135 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 136 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 137 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 138 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 139 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 140 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 141 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 142 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 143 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 144 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 145 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 146 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 147 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 148 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 149 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 MET HA 1 2 ALA H . . 4.400 3.567 3.561 3.571 . 0 0 "[ . 1 . 2]" 1
2 1 1 MET HB3 1 2 ALA H . . 3.800 2.527 1.958 2.999 . 0 0 "[ . 1 . 2]" 1
3 1 1 MET HG2 1 2 ALA H . . 5.500 4.467 3.623 4.750 . 0 0 "[ . 1 . 2]" 1
4 1 1 MET ME 1 2 ALA H . . 5.200 4.177 3.323 4.767 . 0 0 "[ . 1 . 2]" 1
5 1 2 ALA H 1 2 ALA MB . . 3.600 2.515 2.428 2.592 . 0 0 "[ . 1 . 2]" 1
6 1 2 ALA HA 1 3 ALA H . . 3.400 2.216 2.186 2.245 . 0 0 "[ . 1 . 2]" 1
7 1 2 ALA MB 1 3 ALA H . . 4.200 2.876 2.749 3.011 . 0 0 "[ . 1 . 2]" 1
8 1 3 ALA H 1 3 ALA MB . . 3.600 2.329 2.209 2.419 . 0 0 "[ . 1 . 2]" 1
9 1 3 ALA H 1 4 LEU H . . 5.300 4.539 4.528 4.559 . 0 0 "[ . 1 . 2]" 1
10 1 3 ALA H 1 6 ASP HB2 . . 3.800 3.036 2.637 3.629 . 0 0 "[ . 1 . 2]" 1
11 1 3 ALA MB 1 79 SER HG . . 6.000 4.980 4.173 5.601 . 0 0 "[ . 1 . 2]" 1
12 1 3 ALA HA 1 4 LEU H . . 3.500 2.310 2.266 2.350 . 0 0 "[ . 1 . 2]" 1
13 1 3 ALA MB 1 4 LEU H . . 4.000 2.645 2.503 2.784 . 0 0 "[ . 1 . 2]" 1
14 1 4 LEU H 1 4 LEU HB3 . . 3.700 2.602 2.499 2.731 . 0 0 "[ . 1 . 2]" 1
15 1 4 LEU H 1 4 LEU HG . . 3.200 2.174 2.005 2.343 . 0 0 "[ . 1 . 2]" 1
16 1 4 LEU H 1 4 LEU MD2 . . 4.200 2.744 2.150 2.953 . 0 0 "[ . 1 . 2]" 1
17 1 4 LEU H 1 4 LEU MD1 . . 5.400 3.734 3.588 3.842 . 0 0 "[ . 1 . 2]" 1
18 1 4 LEU HA 1 7 GLU HB3 . . 4.200 3.303 2.925 3.718 . 0 0 "[ . 1 . 2]" 1
19 1 4 LEU MD2 1 79 SER HB3 . . 5.300 3.745 2.480 4.728 . 0 0 "[ . 1 . 2]" 1
20 1 3 ALA HA 1 5 THR H . . 5.400 4.289 4.188 4.500 . 0 0 "[ . 1 . 2]" 1
21 1 3 ALA MB 1 5 THR H . . 4.600 2.710 2.456 2.899 . 0 0 "[ . 1 . 2]" 1
22 1 3 ALA H 1 5 THR H . . 6.400 5.219 5.039 5.567 . 0 0 "[ . 1 . 2]" 1
23 1 4 LEU HA 1 5 THR H . . 4.500 3.533 3.526 3.556 . 0 0 "[ . 1 . 2]" 1
24 1 4 LEU HB2 1 5 THR H . . 4.600 3.615 3.437 3.753 . 0 0 "[ . 1 . 2]" 1
25 1 4 LEU HG 1 5 THR H . . 3.100 2.022 1.950 2.197 . 0 0 "[ . 1 . 2]" 1
26 1 4 LEU MD1 1 5 THR H . . 4.400 2.574 2.324 3.076 . 0 0 "[ . 1 . 2]" 1
27 1 4 LEU H 1 5 THR H . . 3.800 2.755 2.676 2.821 . 0 0 "[ . 1 . 2]" 1
28 1 5 THR H 1 5 THR MG . . 3.500 2.437 1.983 3.246 . 0 0 "[ . 1 . 2]" 1
29 1 5 THR H 1 6 ASP H . . 3.800 2.845 2.818 2.847 . 0 0 "[ . 1 . 2]" 1
30 1 5 THR HB 1 74 MET HG3 . . 4.600 4.129 3.697 4.552 . 0 0 "[ . 1 . 2]" 1
31 1 3 ALA HA 1 6 ASP H . . 5.500 4.776 4.715 4.841 . 0 0 "[ . 1 . 2]" 1
32 1 3 ALA MB 1 6 ASP H . . 3.900 2.800 2.598 3.084 . 0 0 "[ . 1 . 2]" 1
33 1 4 LEU HA 1 6 ASP H . . 5.200 4.294 4.262 4.333 . 0 0 "[ . 1 . 2]" 1
34 1 4 LEU H 1 6 ASP H . . 5.200 4.387 4.163 4.450 . 0 0 "[ . 1 . 2]" 1
35 1 5 THR HA 1 6 ASP H . . 4.500 3.546 3.533 3.547 . 0 0 "[ . 1 . 2]" 1
36 1 5 THR HB 1 6 ASP H . . 4.800 3.431 2.874 3.711 . 0 0 "[ . 1 . 2]" 1
37 1 5 THR MG 1 6 ASP H . . 5.200 3.962 3.754 4.176 . 0 0 "[ . 1 . 2]" 1
38 1 6 ASP H 1 6 ASP HB2 . . 3.100 2.289 2.066 2.677 . 0 0 "[ . 1 . 2]" 1
39 1 6 ASP H 1 6 ASP HB3 . . 4.200 3.090 2.391 3.590 . 0 0 "[ . 1 . 2]" 1
40 1 6 ASP H 1 7 GLU H . . 3.800 2.781 2.738 2.784 . 0 0 "[ . 1 . 2]" 1
41 1 3 ALA MB 1 7 GLU H . . 6.000 4.699 4.405 4.898 . 0 0 "[ . 1 . 2]" 1
42 1 4 LEU HA 1 7 GLU H . . 4.400 3.401 3.384 3.430 . 0 0 "[ . 1 . 2]" 1
43 1 4 LEU H 1 7 GLU H . . 6.000 5.115 4.970 5.153 . 0 0 "[ . 1 . 2]" 1
44 1 5 THR HA 1 7 GLU H . . 5.500 4.526 4.524 4.545 . 0 0 "[ . 1 . 2]" 1
45 1 5 THR H 1 7 GLU H . . 5.400 4.390 4.388 4.412 . 0 0 "[ . 1 . 2]" 1
46 1 6 ASP HA 1 7 GLU H . . 4.600 3.552 3.552 3.553 . 0 0 "[ . 1 . 2]" 1
47 1 6 ASP HB3 1 7 GLU H . . 3.800 2.800 2.467 3.681 . 0 0 "[ . 1 . 2]" 1
48 1 7 GLU H 1 7 GLU HB2 . . 3.500 2.330 2.099 2.633 . 0 0 "[ . 1 . 2]" 1
49 1 7 GLU H 1 7 GLU HB3 . . 3.600 2.762 2.421 3.101 . 0 0 "[ . 1 . 2]" 1
50 1 7 GLU H 1 7 GLU HG3 . . 5.500 4.278 3.891 4.615 . 0 0 "[ . 1 . 2]" 1
51 1 7 GLU H 1 8 GLN H . . 3.800 2.631 2.620 2.633 . 0 0 "[ . 1 . 2]" 1
52 1 7 GLU H 1 9 ILE H . . 5.600 4.558 4.515 4.560 . 0 0 "[ . 1 . 2]" 1
53 1 7 GLU HA 1 10 ARG HB3 . . 3.500 2.466 2.420 2.553 . 0 0 "[ . 1 . 2]" 1
54 1 7 GLU HG2 1 11 GLU HG3 . . 4.300 3.608 2.506 4.290 . 0 0 "[ . 1 . 2]" 1
55 1 4 LEU HA 1 8 GLN H . . 5.400 4.364 4.345 4.368 . 0 0 "[ . 1 . 2]" 1
56 1 4 LEU HB2 1 8 GLN H . . 5.900 4.870 4.814 4.977 . 0 0 "[ . 1 . 2]" 1
57 1 5 THR HA 1 8 GLN H . . 4.400 3.418 3.416 3.439 . 0 0 "[ . 1 . 2]" 1
58 1 5 THR H 1 8 GLN H . . 5.800 4.784 4.782 4.800 . 0 0 "[ . 1 . 2]" 1
59 1 6 ASP HA 1 8 GLN H . . 5.200 4.269 4.243 4.271 . 0 0 "[ . 1 . 2]" 1
60 1 6 ASP HB3 1 8 GLN H . . 5.900 5.009 4.820 5.536 . 0 0 "[ . 1 . 2]" 1
61 1 6 ASP H 1 8 GLN H . . 5.000 4.048 3.997 4.052 . 0 0 "[ . 1 . 2]" 1
62 1 7 GLU HA 1 8 GLN H . . 4.500 3.507 3.502 3.508 . 0 0 "[ . 1 . 2]" 1
63 1 7 GLU HB3 1 8 GLN H . . 3.800 2.805 2.756 2.932 . 0 0 "[ . 1 . 2]" 1
64 1 7 GLU HG2 1 8 GLN H . . 5.400 4.407 3.863 4.786 . 0 0 "[ . 1 . 2]" 1
65 1 8 GLN H 1 8 GLN HB2 . . 3.300 2.213 2.066 2.500 . 0 0 "[ . 1 . 2]" 1
66 1 8 GLN H 1 8 GLN HG3 . . 5.200 4.099 3.277 4.569 . 0 0 "[ . 1 . 2]" 1
67 1 8 GLN H 1 9 ILE H . . 3.800 2.794 2.749 2.797 . 0 0 "[ . 1 . 2]" 1
68 1 8 GLN H 1 10 ARG H . . 4.800 3.876 3.856 3.877 . 0 0 "[ . 1 . 2]" 1
69 1 4 LEU HB2 1 8 GLN HB2 . . 5.400 4.622 4.418 5.012 . 0 0 "[ . 1 . 2]" 1
70 1 5 THR HA 1 9 ILE H . . 5.000 4.120 4.100 4.121 . 0 0 "[ . 1 . 2]" 1
71 1 5 THR HB 1 9 ILE H . . 5.800 4.840 4.795 5.006 . 0 0 "[ . 1 . 2]" 1
72 1 6 ASP HA 1 9 ILE H . . 4.800 3.746 3.707 3.750 . 0 0 "[ . 1 . 2]" 1
73 1 6 ASP H 1 9 ILE H . . 6.000 4.985 4.936 4.988 . 0 0 "[ . 1 . 2]" 1
74 1 7 GLU HA 1 9 ILE H . . 5.800 4.823 4.786 4.825 . 0 0 "[ . 1 . 2]" 1
75 1 8 GLN HA 1 9 ILE H . . 4.600 3.567 3.566 3.568 . 0 0 "[ . 1 . 2]" 1
76 1 8 GLN HB2 1 9 ILE H . . 4.400 3.271 2.745 3.677 . 0 0 "[ . 1 . 2]" 1
77 1 8 GLN HB3 1 9 ILE H . . 3.200 2.378 2.235 2.740 . 0 0 "[ . 1 . 2]" 1
78 1 8 GLN HG2 1 9 ILE H . . 5.200 4.389 3.564 4.852 . 0 0 "[ . 1 . 2]" 1
79 1 9 ILE H 1 9 ILE HG12 . . 3.100 1.951 1.949 1.979 . 0 0 "[ . 1 . 2]" 1
80 1 9 ILE H 1 9 ILE MG . . 3.800 2.345 2.209 2.461 . 0 0 "[ . 1 . 2]" 1
81 1 9 ILE H 1 9 ILE MD . . 5.200 3.555 3.552 3.565 . 0 0 "[ . 1 . 2]" 1
82 1 9 ILE H 1 12 ALA H . . 5.700 4.798 4.760 4.819 . 0 0 "[ . 1 . 2]" 1
83 1 9 ILE HB 1 67 GLU HA . . 5.900 4.697 4.115 5.793 . 0 0 "[ . 1 . 2]" 1
84 1 9 ILE MG 1 70 VAL MG1 . . 3.200 1.809 1.745 1.950 . 0 0 "[ . 1 . 2]" 1
85 1 6 ASP HA 1 10 ARG H . . 5.100 4.139 4.137 4.140 . 0 0 "[ . 1 . 2]" 1
86 1 6 ASP HB3 1 10 ARG H . . 6.300 5.408 5.112 5.920 . 0 0 "[ . 1 . 2]" 1
87 1 7 GLU HA 1 10 ARG H . . 4.800 3.540 3.536 3.541 . 0 0 "[ . 1 . 2]" 1
88 1 7 GLU H 1 10 ARG H . . 5.700 4.746 4.745 4.747 . 0 0 "[ . 1 . 2]" 1
89 1 8 GLN HA 1 10 ARG H . . 5.300 4.309 4.293 4.311 . 0 0 "[ . 1 . 2]" 1
90 1 9 ILE HA 1 10 ARG H . . 4.500 3.505 3.501 3.506 . 0 0 "[ . 1 . 2]" 1
91 1 9 ILE HB 1 10 ARG H . . 4.900 3.766 3.763 3.801 . 0 0 "[ . 1 . 2]" 1
92 1 9 ILE HG12 1 10 ARG H . . 3.500 2.712 2.688 2.714 . 0 0 "[ . 1 . 2]" 1
93 1 9 ILE MG 1 10 ARG H . . 5.300 4.008 3.982 4.019 . 0 0 "[ . 1 . 2]" 1
94 1 9 ILE H 1 10 ARG H . . 3.800 2.651 2.631 2.653 . 0 0 "[ . 1 . 2]" 1
95 1 10 ARG H 1 10 ARG HB2 . . 3.700 2.594 2.481 2.660 . 0 0 "[ . 1 . 2]" 1
96 1 10 ARG H 1 10 ARG HB3 . . 3.400 2.461 2.400 2.571 . 0 0 "[ . 1 . 2]" 1
97 1 10 ARG H 1 10 ARG HG3 . . 5.400 4.411 4.371 4.480 . 0 0 "[ . 1 . 2]" 1
98 1 10 ARG H 1 10 ARG HD2 . . 5.600 4.626 4.381 4.897 . 0 0 "[ . 1 . 2]" 1
99 1 10 ARG H 1 12 ALA H . . 4.800 3.988 3.914 4.026 . 0 0 "[ . 1 . 2]" 1
100 1 10 ARG HA 1 13 PHE HB3 . . 4.400 3.239 3.161 3.317 . 0 0 "[ . 1 . 2]" 1
101 1 10 ARG HD2 1 14 ASN HB2 . . 4.500 4.032 3.394 4.493 . 0 0 "[ . 1 . 2]" 1
102 1 7 GLU HA 1 11 GLU H . . 4.800 3.948 3.878 3.979 . 0 0 "[ . 1 . 2]" 1
103 1 7 GLU HG2 1 11 GLU H . . 5.100 4.412 3.909 4.914 . 0 0 "[ . 1 . 2]" 1
104 1 8 GLN HA 1 11 GLU H . . 4.800 3.717 3.680 3.794 . 0 0 "[ . 1 . 2]" 1
105 1 8 GLN H 1 11 GLU H . . 5.800 4.772 4.738 4.817 . 0 0 "[ . 1 . 2]" 1
106 1 9 ILE HA 1 11 GLU H . . 5.700 4.617 4.564 4.749 . 0 0 "[ . 1 . 2]" 1
107 1 9 ILE H 1 11 GLU H . . 5.500 4.450 4.395 4.551 . 0 0 "[ . 1 . 2]" 1
108 1 10 ARG HA 1 11 GLU H . . 4.500 3.559 3.555 3.567 . 0 0 "[ . 1 . 2]" 1
109 1 10 ARG HB3 1 11 GLU H . . 3.400 2.439 2.332 2.489 . 0 0 "[ . 1 . 2]" 1
110 1 10 ARG HD2 1 11 GLU H . . 5.600 4.796 4.638 5.023 . 0 0 "[ . 1 . 2]" 1
111 1 10 ARG HG3 1 11 GLU H . . 4.200 3.477 3.253 3.742 . 0 0 "[ . 1 . 2]" 1
112 1 10 ARG H 1 11 GLU H . . 3.800 2.719 2.674 2.776 . 0 0 "[ . 1 . 2]" 1
113 1 11 GLU H 1 11 GLU HB2 . . 3.100 2.158 2.064 2.363 . 0 0 "[ . 1 . 2]" 1
114 1 11 GLU H 1 11 GLU HG2 . . 4.600 3.747 3.050 4.489 . 0 0 "[ . 1 . 2]" 1
115 1 11 GLU H 1 11 GLU HG3 . . 4.600 3.379 2.508 4.059 . 0 0 "[ . 1 . 2]" 1
116 1 11 GLU H 1 12 ALA H . . 3.800 2.623 2.574 2.681 . 0 0 "[ . 1 . 2]" 1
117 1 11 GLU HA 1 14 ASN HB3 . . 3.600 2.705 2.424 3.577 . 0 0 "[ . 1 . 2]" 1
118 1 8 GLN HA 1 12 ALA H . . 5.200 4.209 4.155 4.235 . 0 0 "[ . 1 . 2]" 1
119 1 8 GLN HG2 1 12 ALA H . . 6.000 5.335 4.495 5.997 . 0 0 "[ . 1 . 2]" 1
120 1 9 ILE HA 1 12 ALA H . . 4.500 3.491 3.453 3.566 . 0 0 "[ . 1 . 2]" 1
121 1 10 ARG HA 1 12 ALA H . . 5.300 4.442 4.353 4.486 . 0 0 "[ . 1 . 2]" 1
122 1 10 ARG HB3 1 12 ALA H . . 5.700 4.840 4.760 4.893 . 0 0 "[ . 1 . 2]" 1
123 1 11 GLU HA 1 12 ALA H . . 4.500 3.522 3.507 3.529 . 0 0 "[ . 1 . 2]" 1
124 1 11 GLU HB2 1 12 ALA H . . 4.200 3.013 2.730 3.300 . 0 0 "[ . 1 . 2]" 1
125 1 11 GLU HG3 1 12 ALA H . . 6.200 4.961 4.502 5.228 . 0 0 "[ . 1 . 2]" 1
126 1 12 ALA H 1 12 ALA MB . . 3.200 2.154 2.025 2.235 . 0 0 "[ . 1 . 2]" 1
127 1 12 ALA HA 1 15 LEU HB2 . . 4.600 3.145 2.941 3.448 . 0 0 "[ . 1 . 2]" 1
128 1 9 ILE HA 1 13 PHE H . . 4.800 3.824 3.773 3.885 . 0 0 "[ . 1 . 2]" 1
129 1 9 ILE HB 1 13 PHE H . . 5.600 4.666 4.624 4.729 . 0 0 "[ . 1 . 2]" 1
130 1 10 ARG HA 1 13 PHE H . . 4.900 3.857 3.804 3.879 . 0 0 "[ . 1 . 2]" 1
131 1 10 ARG HD2 1 13 PHE H . . 6.200 5.299 5.138 5.622 . 0 0 "[ . 1 . 2]" 1
132 1 10 ARG H 1 13 PHE H . . 5.800 4.849 4.789 4.887 . 0 0 "[ . 1 . 2]" 1
133 1 11 GLU HA 1 13 PHE H . . 5.800 4.810 4.735 4.877 . 0 0 "[ . 1 . 2]" 1
134 1 11 GLU H 1 13 PHE H . . 5.600 4.497 4.442 4.538 . 0 0 "[ . 1 . 2]" 1
135 1 12 ALA HA 1 13 PHE H . . 4.500 3.569 3.566 3.570 . 0 0 "[ . 1 . 2]" 1
136 1 12 ALA MB 1 13 PHE H . . 3.800 2.292 2.207 2.445 . 0 0 "[ . 1 . 2]" 1
137 1 12 ALA H 1 13 PHE H . . 3.800 2.820 2.780 2.841 . 0 0 "[ . 1 . 2]" 1
138 1 13 PHE H 1 13 PHE HB2 . . 3.700 2.612 2.542 2.661 . 0 0 "[ . 1 . 2]" 1
139 1 13 PHE H 1 13 PHE HB3 . . 3.400 2.452 2.408 2.518 . 0 0 "[ . 1 . 2]" 1
140 1 13 PHE H 1 15 LEU H . . 5.300 4.377 4.298 4.479 . 0 0 "[ . 1 . 2]" 1
141 1 13 PHE HA 1 16 PHE HB2 . . 3.600 2.692 2.575 2.796 . 0 0 "[ . 1 . 2]" 1
142 1 13 PHE HD2 1 17 ASP HB2 . . 5.000 4.113 3.602 4.858 . 0 0 "[ . 1 . 2]" 1
143 1 13 PHE HD2 1 24 ILE MD . . 4.600 3.851 3.451 4.311 . 0 0 "[ . 1 . 2]" 1
144 1 13 PHE HB2 1 66 PHE HE1 . . 4.000 3.771 3.442 4.002 0.002 20 0 "[ . 1 . 2]" 1
145 1 13 PHE HB2 1 66 PHE HB3 . . 6.000 5.898 5.451 5.999 . 0 0 "[ . 1 . 2]" 1
146 1 10 ARG HA 1 14 ASN H . . 5.100 4.188 4.087 4.246 . 0 0 "[ . 1 . 2]" 1
147 1 10 ARG HD2 1 14 ASN H . . 5.300 4.555 4.184 5.072 . 0 0 "[ . 1 . 2]" 1
148 1 10 ARG HE 1 14 ASN H . . 5.900 5.558 4.481 5.887 . 0 0 "[ . 1 . 2]" 1
149 1 11 GLU HA 1 14 ASN H . . 4.600 3.539 3.512 3.576 . 0 0 "[ . 1 . 2]" 1
150 1 11 GLU H 1 14 ASN H . . 5.800 4.733 4.689 4.784 . 0 0 "[ . 1 . 2]" 1
151 1 12 ALA HA 1 14 ASN H . . 5.400 4.291 4.209 4.377 . 0 0 "[ . 1 . 2]" 1
152 1 12 ALA H 1 14 ASN H . . 4.900 3.918 3.807 3.993 . 0 0 "[ . 1 . 2]" 1
153 1 13 PHE HA 1 14 ASN H . . 4.500 3.503 3.489 3.518 . 0 0 "[ . 1 . 2]" 1
154 1 13 PHE HB3 1 14 ASN H . . 3.800 2.811 2.740 2.885 . 0 0 "[ . 1 . 2]" 1
155 1 13 PHE H 1 14 ASN H . . 3.800 2.663 2.627 2.697 . 0 0 "[ . 1 . 2]" 1
156 1 14 ASN H 1 14 ASN HB2 . . 3.500 2.455 2.080 2.701 . 0 0 "[ . 1 . 2]" 1
157 1 14 ASN H 1 16 PHE H . . 5.300 4.235 4.150 4.350 . 0 0 "[ . 1 . 2]" 1
158 1 14 ASN HA 1 17 ASP HB3 . . 4.200 3.103 2.871 3.489 . 0 0 "[ . 1 . 2]" 1
159 1 11 GLU HA 1 15 LEU H . . 4.900 4.057 3.961 4.144 . 0 0 "[ . 1 . 2]" 1
160 1 11 GLU HG2 1 15 LEU H . . 6.500 5.705 4.919 6.466 . 0 0 "[ . 1 . 2]" 1
161 1 12 ALA HA 1 15 LEU H . . 4.700 3.630 3.559 3.684 . 0 0 "[ . 1 . 2]" 1
162 1 12 ALA H 1 15 LEU H . . 5.700 4.763 4.663 4.816 . 0 0 "[ . 1 . 2]" 1
163 1 13 PHE HA 1 15 LEU H . . 5.500 4.517 4.421 4.620 . 0 0 "[ . 1 . 2]" 1
164 1 13 PHE HB3 1 15 LEU H . . 6.000 5.285 5.190 5.396 . 0 0 "[ . 1 . 2]" 1
165 1 14 ASN HA 1 15 LEU H . . 4.500 3.549 3.540 3.557 . 0 0 "[ . 1 . 2]" 1
166 1 14 ASN HB2 1 15 LEU H . . 4.600 3.697 2.853 3.930 . 0 0 "[ . 1 . 2]" 1
167 1 14 ASN HB3 1 15 LEU H . . 3.500 2.552 2.395 2.940 . 0 0 "[ . 1 . 2]" 1
168 1 14 ASN H 1 15 LEU H . . 3.800 2.676 2.602 2.708 . 0 0 "[ . 1 . 2]" 1
169 1 15 LEU H 1 15 LEU HB2 . . 3.200 2.067 2.041 2.108 . 0 0 "[ . 1 . 2]" 1
170 1 15 LEU H 1 15 LEU HG . . 5.500 4.340 4.061 4.504 . 0 0 "[ . 1 . 2]" 1
171 1 15 LEU H 1 15 LEU MD1 . . 5.800 4.102 2.711 4.297 . 0 0 "[ . 1 . 2]" 1
172 1 15 LEU H 1 15 LEU MD2 . . 4.500 2.965 2.359 3.925 . 0 0 "[ . 1 . 2]" 1
173 1 15 LEU H 1 16 PHE H . . 3.800 2.715 2.668 2.760 . 0 0 "[ . 1 . 2]" 1
174 1 15 LEU H 1 17 ASP H . . 5.000 4.145 4.081 4.210 . 0 0 "[ . 1 . 2]" 1
175 1 12 ALA HA 1 16 PHE H . . 5.000 4.136 4.048 4.187 . 0 0 "[ . 1 . 2]" 1
176 1 12 ALA MB 1 16 PHE H . . 6.000 4.661 4.609 4.727 . 0 0 "[ . 1 . 2]" 1
177 1 13 PHE HA 1 16 PHE H . . 4.600 3.627 3.562 3.691 . 0 0 "[ . 1 . 2]" 1
178 1 13 PHE H 1 16 PHE H . . 5.800 4.925 4.889 4.960 . 0 0 "[ . 1 . 2]" 1
179 1 14 ASN HA 1 16 PHE H . . 5.900 4.743 4.662 4.846 . 0 0 "[ . 1 . 2]" 1
180 1 15 LEU HA 1 16 PHE H . . 4.600 3.557 3.552 3.564 . 0 0 "[ . 1 . 2]" 1
181 1 15 LEU HB2 1 16 PHE H . . 4.300 3.050 2.733 3.304 . 0 0 "[ . 1 . 2]" 1
182 1 15 LEU HB3 1 16 PHE H . . 3.400 2.692 2.480 2.894 . 0 0 "[ . 1 . 2]" 1
183 1 15 LEU HG 1 16 PHE H . . 5.600 4.938 4.849 5.016 . 0 0 "[ . 1 . 2]" 1
184 1 16 PHE H 1 16 PHE HB2 . . 3.400 2.419 2.286 2.486 . 0 0 "[ . 1 . 2]" 1
185 1 16 PHE H 1 18 ALA H . . 5.000 3.921 3.867 3.958 . 0 0 "[ . 1 . 2]" 1
186 1 16 PHE HA 1 32 ALA MB . . 5.000 4.210 3.890 4.404 . 0 0 "[ . 1 . 2]" 1
187 1 13 PHE HA 1 17 ASP H . . 4.900 3.887 3.776 3.976 . 0 0 "[ . 1 . 2]" 1
188 1 14 ASN HA 1 17 ASP H . . 4.800 3.732 3.657 3.794 . 0 0 "[ . 1 . 2]" 1
189 1 14 ASN H 1 17 ASP H . . 5.800 4.719 4.654 4.764 . 0 0 "[ . 1 . 2]" 1
190 1 15 LEU HA 1 17 ASP H . . 5.300 4.476 4.425 4.540 . 0 0 "[ . 1 . 2]" 1
191 1 16 PHE HA 1 17 ASP H . . 4.500 3.542 3.536 3.549 . 0 0 "[ . 1 . 2]" 1
192 1 16 PHE HB2 1 17 ASP H . . 3.700 2.602 2.519 2.664 . 0 0 "[ . 1 . 2]" 1
193 1 16 PHE HB3 1 17 ASP H . . 4.600 3.502 3.310 3.611 . 0 0 "[ . 1 . 2]" 1
194 1 16 PHE H 1 17 ASP H . . 3.800 2.764 2.683 2.811 . 0 0 "[ . 1 . 2]" 1
195 1 17 ASP H 1 17 ASP HB2 . . 3.400 2.457 2.183 2.819 . 0 0 "[ . 1 . 2]" 1
196 1 17 ASP H 1 17 ASP HB3 . . 3.700 2.658 2.300 2.988 . 0 0 "[ . 1 . 2]" 1
197 1 17 ASP H 1 18 ALA H . . 3.500 2.498 2.431 2.533 . 0 0 "[ . 1 . 2]" 1
198 1 17 ASP HA 1 24 ILE HG12 . . 4.600 4.335 3.967 4.600 0.000 20 0 "[ . 1 . 2]" 1
199 1 17 ASP HB2 1 24 ILE MD . . 4.600 3.983 3.360 4.304 . 0 0 "[ . 1 . 2]" 1
200 1 14 ASN HA 1 18 ALA H . . 5.400 4.221 4.050 4.330 . 0 0 "[ . 1 . 2]" 1
201 1 15 LEU HA 1 18 ALA H . . 4.300 3.343 3.303 3.392 . 0 0 "[ . 1 . 2]" 1
202 1 15 LEU MD1 1 18 ALA H . . 5.600 4.439 4.165 4.925 . 0 0 "[ . 1 . 2]" 1
203 1 15 LEU H 1 18 ALA H . . 5.600 4.557 4.480 4.616 . 0 0 "[ . 1 . 2]" 1
204 1 16 PHE HA 1 18 ALA H . . 5.100 4.145 4.111 4.218 . 0 0 "[ . 1 . 2]" 1
205 1 16 PHE HB2 1 18 ALA H . . 5.800 4.794 4.736 4.827 . 0 0 "[ . 1 . 2]" 1
206 1 17 ASP HA 1 18 ALA H . . 4.400 3.463 3.458 3.465 . 0 0 "[ . 1 . 2]" 1
207 1 17 ASP HB2 1 18 ALA H . . 5.000 3.953 3.686 4.208 . 0 0 "[ . 1 . 2]" 1
208 1 17 ASP HB3 1 18 ALA H . . 4.000 2.999 2.965 3.083 . 0 0 "[ . 1 . 2]" 1
209 1 18 ALA H 1 18 ALA MB . . 3.000 2.135 2.024 2.228 . 0 0 "[ . 1 . 2]" 1
210 1 18 ALA H 1 20 GLY H . . 5.400 4.378 4.311 4.434 . 0 0 "[ . 1 . 2]" 1
211 1 17 ASP HA 1 19 ASP H . . 4.600 3.677 3.635 3.720 . 0 0 "[ . 1 . 2]" 1
212 1 18 ALA HA 1 19 ASP H . . 4.500 3.476 3.462 3.488 . 0 0 "[ . 1 . 2]" 1
213 1 18 ALA MB 1 19 ASP H . . 4.100 2.841 2.773 2.951 . 0 0 "[ . 1 . 2]" 1
214 1 18 ALA H 1 19 ASP H . . 3.700 2.733 2.707 2.767 . 0 0 "[ . 1 . 2]" 1
215 1 19 ASP H 1 19 ASP HB2 . . 3.600 2.243 2.078 2.528 . 0 0 "[ . 1 . 2]" 1
216 1 19 ASP H 1 19 ASP HB3 . . 3.800 3.095 2.537 3.572 . 0 0 "[ . 1 . 2]" 1
217 1 19 ASP H 1 21 SER H . . 5.300 4.341 4.271 4.398 . 0 0 "[ . 1 . 2]" 1
218 1 19 ASP HB3 1 21 SER HB2 . . 3.800 2.959 2.558 3.592 . 0 0 "[ . 1 . 2]" 1
219 1 19 ASP HB2 1 28 GLU HG2 . . 4.600 4.148 3.407 4.569 . 0 0 "[ . 1 . 2]" 1
220 1 17 ASP HA 1 20 GLY H . . 4.800 3.727 3.660 3.809 . 0 0 "[ . 1 . 2]" 1
221 1 18 ALA HA 1 20 GLY H . . 4.700 3.737 3.693 3.777 . 0 0 "[ . 1 . 2]" 1
222 1 19 ASP HA 1 20 GLY H . . 4.500 3.489 3.471 3.501 . 0 0 "[ . 1 . 2]" 1
223 1 19 ASP HB2 1 20 GLY H . . 4.200 3.548 2.960 4.075 . 0 0 "[ . 1 . 2]" 1
224 1 19 ASP H 1 20 GLY H . . 3.800 2.749 2.720 2.767 . 0 0 "[ . 1 . 2]" 1
225 1 20 GLY H 1 21 SER H . . 3.300 2.364 2.325 2.403 . 0 0 "[ . 1 . 2]" 1
226 1 17 ASP HA 1 21 SER H . . 5.100 4.137 3.761 4.356 . 0 0 "[ . 1 . 2]" 1
227 1 19 ASP HB3 1 21 SER H . . 4.000 2.920 2.528 3.610 . 0 0 "[ . 1 . 2]" 1
228 1 20 GLY HA2 1 21 SER H . . 4.000 3.004 2.965 3.070 . 0 0 "[ . 1 . 2]" 1
229 1 21 SER H 1 21 SER HB2 . . 3.400 2.458 2.299 2.852 . 0 0 "[ . 1 . 2]" 1
230 1 21 SER H 1 22 GLY H . . 5.500 4.534 4.519 4.554 . 0 0 "[ . 1 . 2]" 1
231 1 21 SER HA 1 22 GLY H . . 3.300 2.329 2.306 2.365 . 0 0 "[ . 1 . 2]" 1
232 1 21 SER HB3 1 22 GLY H . . 3.800 2.933 2.566 3.489 . 0 0 "[ . 1 . 2]" 1
233 1 22 GLY H 1 23 ALA H . . 3.600 2.581 2.511 2.646 . 0 0 "[ . 1 . 2]" 1
234 1 21 SER HA 1 23 ALA H . . 5.000 4.051 3.958 4.166 . 0 0 "[ . 1 . 2]" 1
235 1 21 SER HB3 1 23 ALA H . . 3.300 2.485 2.229 3.154 . 0 0 "[ . 1 . 2]" 1
236 1 21 SER H 1 23 ALA H . . 5.800 4.940 4.792 5.109 . 0 0 "[ . 1 . 2]" 1
237 1 22 GLY HA2 1 23 ALA H . . 4.500 3.457 3.426 3.485 . 0 0 "[ . 1 . 2]" 1
238 1 22 GLY HA3 1 23 ALA H . . 4.000 3.031 2.974 3.088 . 0 0 "[ . 1 . 2]" 1
239 1 23 ALA HA 1 62 GLU HA . . 5.800 5.202 4.266 5.779 . 0 0 "[ . 1 . 2]" 1
240 1 23 ALA MB 1 62 GLU HG2 . . 5.700 4.960 4.090 5.277 . 0 0 "[ . 1 . 2]" 1
241 1 23 ALA HA 1 24 ILE H . . 3.400 2.402 2.338 2.445 . 0 0 "[ . 1 . 2]" 1
242 1 23 ALA MB 1 24 ILE H . . 3.600 2.504 2.297 2.642 . 0 0 "[ . 1 . 2]" 1
243 1 23 ALA H 1 24 ILE H . . 5.400 4.390 4.356 4.406 . 0 0 "[ . 1 . 2]" 1
244 1 24 ILE H 1 24 ILE HB . . 3.700 2.691 2.644 2.717 . 0 0 "[ . 1 . 2]" 1
245 1 24 ILE H 1 24 ILE HG13 . . 4.100 3.179 2.945 3.965 . 0 0 "[ . 1 . 2]" 1
246 1 24 ILE H 1 24 ILE MD . . 4.000 2.610 2.317 3.411 . 0 0 "[ . 1 . 2]" 1
247 1 24 ILE H 1 25 ASP H . . 5.400 4.365 4.343 4.405 . 0 0 "[ . 1 . 2]" 1
248 1 24 ILE H 1 61 ILE H . . 4.800 3.386 2.073 3.983 . 0 0 "[ . 1 . 2]" 1
249 1 24 ILE H 1 61 ILE HB . . 4.500 3.148 2.349 3.585 . 0 0 "[ . 1 . 2]" 1
250 1 24 ILE MD 1 61 ILE HB . . 5.700 3.969 2.717 4.689 . 0 0 "[ . 1 . 2]" 1
251 1 24 ILE HA 1 25 ASP H . . 3.100 2.149 2.145 2.172 . 0 0 "[ . 1 . 2]" 1
252 1 24 ILE HB 1 25 ASP H . . 5.100 4.122 4.046 4.178 . 0 0 "[ . 1 . 2]" 1
253 1 24 ILE MG 1 25 ASP H . . 3.800 2.556 2.224 2.702 . 0 0 "[ . 1 . 2]" 1
254 1 25 ASP H 1 25 ASP HB2 . . 3.500 2.493 2.223 2.777 . 0 0 "[ . 1 . 2]" 1
255 1 25 ASP H 1 28 GLU HB2 . . 3.600 2.729 2.365 3.359 . 0 0 "[ . 1 . 2]" 1
256 1 25 ASP H 1 28 GLU H . . 4.600 3.737 3.617 3.942 . 0 0 "[ . 1 . 2]" 1
257 1 25 ASP HA 1 60 LEU HA . . 4.600 4.188 3.710 4.579 . 0 0 "[ . 1 . 2]" 1
258 1 25 ASP HA 1 26 ALA H . . 3.500 2.584 2.534 2.634 . 0 0 "[ . 1 . 2]" 1
259 1 25 ASP HB2 1 26 ALA H . . 4.200 3.262 2.907 3.662 . 0 0 "[ . 1 . 2]" 1
260 1 25 ASP HB3 1 26 ALA H . . 3.200 2.128 1.986 2.361 . 0 0 "[ . 1 . 2]" 1
261 1 26 ALA H 1 26 ALA MB . . 3.500 2.144 2.035 2.246 . 0 0 "[ . 1 . 2]" 1
262 1 26 ALA H 1 50 VAL MG2 . . 5.200 4.416 4.026 4.837 . 0 0 "[ . 1 . 2]" 1
263 1 26 ALA MB 1 50 VAL MG2 . . 3.600 2.705 2.485 2.943 . 0 0 "[ . 1 . 2]" 1
264 1 25 ASP HB2 1 27 GLU H . . 4.000 3.291 2.824 3.997 . 0 0 "[ . 1 . 2]" 1
265 1 25 ASP H 1 27 GLU H . . 6.200 5.118 4.966 5.255 . 0 0 "[ . 1 . 2]" 1
266 1 26 ALA HA 1 27 GLU H . . 4.500 3.540 3.528 3.555 . 0 0 "[ . 1 . 2]" 1
267 1 26 ALA MB 1 27 GLU H . . 4.000 2.613 2.427 2.713 . 0 0 "[ . 1 . 2]" 1
268 1 26 ALA H 1 27 GLU H . . 3.500 2.611 2.550 2.727 . 0 0 "[ . 1 . 2]" 1
269 1 27 GLU H 1 27 GLU HB3 . . 3.600 2.597 2.573 2.617 . 0 0 "[ . 1 . 2]" 1
270 1 27 GLU H 1 27 GLU HG2 . . 2.900 1.996 1.959 2.063 . 0 0 "[ . 1 . 2]" 1
271 1 27 GLU H 1 28 GLU H . . 3.800 2.741 2.693 2.771 . 0 0 "[ . 1 . 2]" 1
272 1 27 GLU H 1 29 MET H . . 5.200 4.289 4.185 4.362 . 0 0 "[ . 1 . 2]" 1
273 1 27 GLU HA 1 30 ALA MB . . 4.200 2.922 2.691 3.034 . 0 0 "[ . 1 . 2]" 1
274 1 27 GLU HB2 1 31 LEU MD2 . . 5.200 3.911 3.320 4.321 . 0 0 "[ . 1 . 2]" 1
275 1 25 ASP HA 1 28 GLU H . . 5.700 4.858 4.752 4.917 . 0 0 "[ . 1 . 2]" 1
276 1 25 ASP HB2 1 28 GLU H . . 4.000 2.938 2.692 3.369 . 0 0 "[ . 1 . 2]" 1
277 1 26 ALA HA 1 28 GLU H . . 5.500 4.371 4.301 4.460 . 0 0 "[ . 1 . 2]" 1
278 1 26 ALA H 1 28 GLU H . . 5.200 4.184 4.114 4.299 . 0 0 "[ . 1 . 2]" 1
279 1 27 GLU HA 1 28 GLU H . . 4.500 3.539 3.532 3.544 . 0 0 "[ . 1 . 2]" 1
280 1 27 GLU HB2 1 28 GLU H . . 4.500 3.621 3.572 3.678 . 0 0 "[ . 1 . 2]" 1
281 1 27 GLU HG2 1 28 GLU H . . 3.500 2.303 1.974 2.497 . 0 0 "[ . 1 . 2]" 1
282 1 27 GLU HG3 1 28 GLU H . . 3.200 2.363 2.134 2.709 . 0 0 "[ . 1 . 2]" 1
283 1 28 GLU H 1 28 GLU HB2 . . 3.200 2.183 2.065 2.583 . 0 0 "[ . 1 . 2]" 1
284 1 28 GLU H 1 28 GLU HG3 . . 5.300 4.241 3.492 4.542 . 0 0 "[ . 1 . 2]" 1
285 1 28 GLU H 1 29 MET H . . 3.700 2.691 2.630 2.739 . 0 0 "[ . 1 . 2]" 1
286 1 24 ILE MG 1 28 GLU HB3 . . 3.300 2.101 1.903 2.583 . 0 0 "[ . 1 . 2]" 1
287 1 28 GLU HA 1 31 LEU HB2 . . 3.800 2.743 2.563 2.931 . 0 0 "[ . 1 . 2]" 1
288 1 25 ASP HA 1 29 MET H . . 5.500 5.322 5.130 5.500 . 0 0 "[ . 1 . 2]" 1
289 1 25 ASP HB2 1 29 MET H . . 5.800 4.835 4.579 5.180 . 0 0 "[ . 1 . 2]" 1
290 1 26 ALA HA 1 29 MET H . . 4.800 3.470 3.349 3.574 . 0 0 "[ . 1 . 2]" 1
291 1 26 ALA H 1 29 MET H . . 5.200 4.875 4.802 4.937 . 0 0 "[ . 1 . 2]" 1
292 1 27 GLU HA 1 29 MET H . . 5.200 4.594 4.420 4.717 . 0 0 "[ . 1 . 2]" 1
293 1 27 GLU HG2 1 29 MET H . . 5.600 4.805 4.558 5.012 . 0 0 "[ . 1 . 2]" 1
294 1 28 GLU HA 1 29 MET H . . 4.500 3.549 3.531 3.557 . 0 0 "[ . 1 . 2]" 1
295 1 28 GLU HB2 1 29 MET H . . 4.500 3.310 2.870 3.837 . 0 0 "[ . 1 . 2]" 1
296 1 28 GLU HB3 1 29 MET H . . 3.500 2.694 2.427 3.053 . 0 0 "[ . 1 . 2]" 1
297 1 29 MET H 1 29 MET HB2 . . 3.300 2.236 2.060 2.603 . 0 0 "[ . 1 . 2]" 1
298 1 29 MET H 1 29 MET HB3 . . 3.800 2.926 2.446 3.383 . 0 0 "[ . 1 . 2]" 1
299 1 29 MET H 1 29 MET HG3 . . 5.200 4.038 3.255 4.443 . 0 0 "[ . 1 . 2]" 1
300 1 29 MET H 1 30 ALA H . . 3.700 2.773 2.727 2.826 . 0 0 "[ . 1 . 2]" 1
301 1 16 PHE HB3 1 29 MET HA . . 5.800 5.716 5.357 5.794 . 0 0 "[ . 1 . 2]" 1
302 1 26 ALA HA 1 30 ALA H . . 5.200 4.111 4.025 4.181 . 0 0 "[ . 1 . 2]" 1
303 1 26 ALA MB 1 30 ALA H . . 5.800 4.504 4.424 4.599 . 0 0 "[ . 1 . 2]" 1
304 1 27 GLU HA 1 30 ALA H . . 4.600 3.675 3.610 3.767 . 0 0 "[ . 1 . 2]" 1
305 1 27 GLU HB2 1 30 ALA H . . 6.500 5.573 5.479 5.669 . 0 0 "[ . 1 . 2]" 1
306 1 28 GLU HA 1 30 ALA H . . 5.400 4.533 4.433 4.610 . 0 0 "[ . 1 . 2]" 1
307 1 28 GLU H 1 30 ALA H . . 5.000 4.233 4.146 4.310 . 0 0 "[ . 1 . 2]" 1
308 1 29 MET HA 1 30 ALA H . . 4.500 3.551 3.540 3.556 . 0 0 "[ . 1 . 2]" 1
309 1 29 MET HB3 1 30 ALA H . . 3.600 2.596 2.434 3.039 . 0 0 "[ . 1 . 2]" 1
310 1 29 MET HG2 1 30 ALA H . . 5.200 4.352 3.443 4.954 . 0 0 "[ . 1 . 2]" 1
311 1 30 ALA H 1 30 ALA MB . . 3.300 2.048 2.026 2.112 . 0 0 "[ . 1 . 2]" 1
312 1 30 ALA H 1 31 LEU H . . 3.800 2.699 2.636 2.747 . 0 0 "[ . 1 . 2]" 1
313 1 30 ALA H 1 33 MET H . . 5.800 4.817 4.748 4.861 . 0 0 "[ . 1 . 2]" 1
314 1 30 ALA MB 1 46 VAL MG2 . . 5.000 3.398 2.912 4.001 . 0 0 "[ . 1 . 2]" 1
315 1 30 ALA MB 1 46 VAL MG1 . . 4.500 3.625 3.396 3.910 . 0 0 "[ . 1 . 2]" 1
316 1 30 ALA HA 1 33 MET HB2 . . 3.800 2.578 2.393 2.732 . 0 0 "[ . 1 . 2]" 1
317 1 27 GLU HA 1 31 LEU H . . 5.100 4.093 4.053 4.150 . 0 0 "[ . 1 . 2]" 1
318 1 27 GLU HB2 1 31 LEU H . . 5.900 5.022 4.967 5.072 . 0 0 "[ . 1 . 2]" 1
319 1 28 GLU HA 1 31 LEU H . . 4.600 3.534 3.440 3.581 . 0 0 "[ . 1 . 2]" 1
320 1 28 GLU H 1 31 LEU H . . 5.800 4.746 4.691 4.796 . 0 0 "[ . 1 . 2]" 1
321 1 29 MET HA 1 31 LEU H . . 5.500 4.578 4.496 4.665 . 0 0 "[ . 1 . 2]" 1
322 1 29 MET HB3 1 31 LEU H . . 6.000 5.060 4.941 5.323 . 0 0 "[ . 1 . 2]" 1
323 1 29 MET H 1 31 LEU H . . 5.300 4.227 4.087 4.300 . 0 0 "[ . 1 . 2]" 1
324 1 30 ALA HA 1 31 LEU H . . 4.500 3.548 3.536 3.554 . 0 0 "[ . 1 . 2]" 1
325 1 30 ALA MB 1 31 LEU H . . 3.600 2.596 2.506 2.674 . 0 0 "[ . 1 . 2]" 1
326 1 31 LEU H 1 31 LEU HB2 . . 3.200 2.058 2.040 2.105 . 0 0 "[ . 1 . 2]" 1
327 1 31 LEU H 1 31 LEU MD1 . . 5.700 4.202 4.110 4.266 . 0 0 "[ . 1 . 2]" 1
328 1 31 LEU H 1 31 LEU MD2 . . 5.000 3.041 2.702 3.374 . 0 0 "[ . 1 . 2]" 1
329 1 31 LEU H 1 31 LEU HG . . 5.500 4.385 4.195 4.509 . 0 0 "[ . 1 . 2]" 1
330 1 31 LEU H 1 32 ALA H . . 3.900 2.812 2.768 2.871 . 0 0 "[ . 1 . 2]" 1
331 1 31 LEU H 1 33 MET H . . 5.300 4.312 4.161 4.409 . 0 0 "[ . 1 . 2]" 1
332 1 31 LEU HA 1 34 LYS HB3 . . 3.900 3.128 2.938 3.313 . 0 0 "[ . 1 . 2]" 1
333 1 31 LEU MD1 1 34 LYS HD2 . . 4.000 3.459 3.069 3.768 . 0 0 "[ . 1 . 2]" 1
334 1 28 GLU HA 1 32 ALA H . . 5.000 4.073 3.950 4.149 . 0 0 "[ . 1 . 2]" 1
335 1 28 GLU HG3 1 32 ALA H . . 5.900 4.867 4.117 5.823 . 0 0 "[ . 1 . 2]" 1
336 1 29 MET HA 1 32 ALA H . . 4.800 3.743 3.673 3.866 . 0 0 "[ . 1 . 2]" 1
337 1 29 MET H 1 32 ALA H . . 5.900 4.896 4.820 4.958 . 0 0 "[ . 1 . 2]" 1
338 1 30 ALA HA 1 32 ALA H . . 5.600 4.578 4.448 4.819 . 0 0 "[ . 1 . 2]" 1
339 1 30 ALA H 1 32 ALA H . . 5.400 4.328 4.209 4.494 . 0 0 "[ . 1 . 2]" 1
340 1 31 LEU HA 1 32 ALA H . . 4.500 3.556 3.544 3.569 . 0 0 "[ . 1 . 2]" 1
341 1 31 LEU HB2 1 32 ALA H . . 4.200 3.172 2.976 3.379 . 0 0 "[ . 1 . 2]" 1
342 1 31 LEU HB3 1 32 ALA H . . 3.500 2.612 2.354 2.821 . 0 0 "[ . 1 . 2]" 1
343 1 31 LEU HG 1 32 ALA H . . 5.800 4.932 4.713 5.043 . 0 0 "[ . 1 . 2]" 1
344 1 31 LEU MD1 1 32 ALA H . . 4.600 4.016 3.799 4.272 . 0 0 "[ . 1 . 2]" 1
345 1 32 ALA H 1 32 ALA MB . . 3.200 2.112 2.026 2.237 . 0 0 "[ . 1 . 2]" 1
346 1 32 ALA H 1 34 LYS H . . 5.200 4.182 4.068 4.272 . 0 0 "[ . 1 . 2]" 1
347 1 32 ALA H 1 35 GLY H . . 5.800 4.788 4.717 4.896 . 0 0 "[ . 1 . 2]" 1
348 1 32 ALA HA 1 36 LEU HG . . 4.800 4.097 3.820 4.599 . 0 0 "[ . 1 . 2]" 1
349 1 32 ALA MB 1 36 LEU MD1 . . 3.800 2.699 2.348 3.016 . 0 0 "[ . 1 . 2]" 1
350 1 29 MET HA 1 33 MET H . . 5.300 4.091 3.927 4.182 . 0 0 "[ . 1 . 2]" 1
351 1 29 MET HB3 1 33 MET H . . 6.300 5.442 5.008 5.879 . 0 0 "[ . 1 . 2]" 1
352 1 30 ALA HA 1 33 MET H . . 4.700 3.593 3.508 3.739 . 0 0 "[ . 1 . 2]" 1
353 1 31 LEU HA 1 33 MET H . . 5.700 4.720 4.624 4.820 . 0 0 "[ . 1 . 2]" 1
354 1 31 LEU HB3 1 33 MET H . . 6.000 5.130 4.946 5.319 . 0 0 "[ . 1 . 2]" 1
355 1 32 ALA HA 1 33 MET H . . 4.600 3.560 3.547 3.567 . 0 0 "[ . 1 . 2]" 1
356 1 32 ALA MB 1 33 MET H . . 3.800 2.481 2.347 2.605 . 0 0 "[ . 1 . 2]" 1
357 1 32 ALA H 1 33 MET H . . 3.900 2.756 2.677 2.820 . 0 0 "[ . 1 . 2]" 1
358 1 33 MET H 1 33 MET HB2 . . 3.300 2.284 2.085 2.457 . 0 0 "[ . 1 . 2]" 1
359 1 33 MET H 1 33 MET HG3 . . 3.800 2.890 2.363 3.638 . 0 0 "[ . 1 . 2]" 1
360 1 33 MET H 1 34 LYS H . . 3.800 2.802 2.763 2.836 . 0 0 "[ . 1 . 2]" 1
361 1 33 MET H 1 36 LEU H . . 5.900 4.887 4.849 4.919 . 0 0 "[ . 1 . 2]" 1
362 1 33 MET HA 1 38 PHE HB2 . . 6.500 5.801 5.111 6.387 . 0 0 "[ . 1 . 2]" 1
363 1 29 MET HG2 1 33 MET HG3 . . 4.600 3.724 3.087 4.465 . 0 0 "[ . 1 . 2]" 1
364 1 33 MET HA 1 36 LEU HB2 . . 3.900 3.107 2.893 3.352 . 0 0 "[ . 1 . 2]" 1
365 1 30 ALA HA 1 34 LYS H . . 5.200 4.102 4.042 4.185 . 0 0 "[ . 1 . 2]" 1
366 1 30 ALA MB 1 34 LYS H . . 6.300 4.614 4.575 4.652 . 0 0 "[ . 1 . 2]" 1
367 1 31 LEU HA 1 34 LYS H . . 4.600 3.713 3.650 3.778 . 0 0 "[ . 1 . 2]" 1
368 1 31 LEU MD1 1 34 LYS H . . 6.000 4.702 4.525 4.944 . 0 0 "[ . 1 . 2]" 1
369 1 31 LEU H 1 34 LYS H . . 5.800 4.831 4.772 4.884 . 0 0 "[ . 1 . 2]" 1
370 1 32 ALA HA 1 34 LYS H . . 5.200 4.354 4.224 4.448 . 0 0 "[ . 1 . 2]" 1
371 1 33 MET HA 1 34 LYS H . . 4.500 3.538 3.525 3.547 . 0 0 "[ . 1 . 2]" 1
372 1 33 MET HB2 1 34 LYS H . . 3.800 2.761 2.614 3.034 . 0 0 "[ . 1 . 2]" 1
373 1 33 MET ME 1 34 LYS H . . 5.500 4.711 4.269 5.016 . 0 0 "[ . 1 . 2]" 1
374 1 34 LYS H 1 34 LYS HB2 . . 3.600 2.494 2.322 2.669 . 0 0 "[ . 1 . 2]" 1
375 1 34 LYS H 1 34 LYS HB3 . . 3.500 2.568 2.398 2.752 . 0 0 "[ . 1 . 2]" 1
376 1 34 LYS H 1 34 LYS HG3 . . 5.500 4.466 4.314 4.629 . 0 0 "[ . 1 . 2]" 1
377 1 34 LYS H 1 34 LYS HD2 . . 5.700 4.805 4.580 5.436 . 0 0 "[ . 1 . 2]" 1
378 1 34 LYS H 1 34 LYS HE2 . . 5.600 5.060 4.563 5.587 . 0 0 "[ . 1 . 2]" 1
379 1 34 LYS H 1 36 LEU H . . 4.900 4.083 4.005 4.138 . 0 0 "[ . 1 . 2]" 1
380 1 34 LYS H 1 37 GLY H . . 5.600 4.594 4.512 4.670 . 0 0 "[ . 1 . 2]" 1
381 1 34 LYS HA 1 40 ASP HB2 . . 5.000 4.521 3.928 4.955 . 0 0 "[ . 1 . 2]" 1
382 1 31 LEU HA 1 35 GLY H . . 5.100 4.174 4.098 4.215 . 0 0 "[ . 1 . 2]" 1
383 1 31 LEU MD1 1 35 GLY H . . 5.000 3.837 3.585 4.166 . 0 0 "[ . 1 . 2]" 1
384 1 32 ALA HA 1 35 GLY H . . 4.600 3.473 3.353 3.579 . 0 0 "[ . 1 . 2]" 1
385 1 33 MET HA 1 35 GLY H . . 5.800 4.739 4.624 4.868 . 0 0 "[ . 1 . 2]" 1
386 1 33 MET HB2 1 35 GLY H . . 6.500 5.267 5.165 5.437 . 0 0 "[ . 1 . 2]" 1
387 1 33 MET H 1 35 GLY H . . 5.600 4.391 4.304 4.526 . 0 0 "[ . 1 . 2]" 1
388 1 34 LYS HA 1 35 GLY H . . 4.500 3.562 3.553 3.571 . 0 0 "[ . 1 . 2]" 1
389 1 34 LYS HB3 1 35 GLY H . . 3.400 2.420 2.316 2.508 . 0 0 "[ . 1 . 2]" 1
390 1 34 LYS HD2 1 35 GLY H . . 4.800 4.200 3.498 4.709 . 0 0 "[ . 1 . 2]" 1
391 1 34 LYS HG2 1 35 GLY H . . 4.300 3.852 3.349 4.146 . 0 0 "[ . 1 . 2]" 1
392 1 34 LYS H 1 35 GLY H . . 3.800 2.694 2.595 2.763 . 0 0 "[ . 1 . 2]" 1
393 1 35 GLY H 1 36 LEU H . . 3.800 2.786 2.737 2.827 . 0 0 "[ . 1 . 2]" 1
394 1 32 ALA HA 1 36 LEU H . . 5.200 4.164 4.082 4.213 . 0 0 "[ . 1 . 2]" 1
395 1 33 MET HA 1 36 LEU H . . 4.700 3.714 3.656 3.824 . 0 0 "[ . 1 . 2]" 1
396 1 34 LYS HA 1 36 LEU H . . 5.200 4.267 4.172 4.367 . 0 0 "[ . 1 . 2]" 1
397 1 34 LYS HB3 1 36 LEU H . . 5.600 4.895 4.789 4.973 . 0 0 "[ . 1 . 2]" 1
398 1 35 GLY HA2 1 36 LEU H . . 4.500 3.527 3.517 3.539 . 0 0 "[ . 1 . 2]" 1
399 1 35 GLY HA3 1 36 LEU H . . 3.900 2.861 2.822 2.893 . 0 0 "[ . 1 . 2]" 1
400 1 36 LEU H 1 36 LEU HB2 . . 3.500 2.460 2.322 2.577 . 0 0 "[ . 1 . 2]" 1
401 1 36 LEU H 1 36 LEU HG . . 3.400 2.461 2.218 2.830 . 0 0 "[ . 1 . 2]" 1
402 1 36 LEU H 1 36 LEU MD1 . . 4.400 3.262 2.984 3.615 . 0 0 "[ . 1 . 2]" 1
403 1 36 LEU H 1 36 LEU MD2 . . 5.300 3.794 3.423 4.122 . 0 0 "[ . 1 . 2]" 1
404 1 36 LEU H 1 37 GLY H . . 3.500 2.393 2.366 2.405 . 0 0 "[ . 1 . 2]" 1
405 1 36 LEU HB3 1 38 PHE HB2 . . 4.100 3.151 2.902 3.588 . 0 0 "[ . 1 . 2]" 1
406 1 36 LEU H 1 38 PHE H . . 5.100 4.090 4.054 4.128 . 0 0 "[ . 1 . 2]" 1
407 1 15 LEU HG 1 36 LEU MD2 . . 3.600 3.192 2.828 3.459 . 0 0 "[ . 1 . 2]" 1
408 1 33 MET HA 1 37 GLY H . . 5.400 4.336 4.173 4.509 . 0 0 "[ . 1 . 2]" 1
409 1 33 MET HB3 1 37 GLY H . . 6.200 5.210 5.079 5.415 . 0 0 "[ . 1 . 2]" 1
410 1 34 LYS HA 1 37 GLY H . . 4.300 3.259 3.199 3.305 . 0 0 "[ . 1 . 2]" 1
411 1 34 LYS HG2 1 37 GLY H . . 6.500 4.820 4.579 5.036 . 0 0 "[ . 1 . 2]" 1
412 1 35 GLY HA2 1 37 GLY H . . 5.200 4.230 4.195 4.277 . 0 0 "[ . 1 . 2]" 1
413 1 35 GLY H 1 37 GLY H . . 5.200 4.010 3.972 4.058 . 0 0 "[ . 1 . 2]" 1
414 1 36 LEU HA 1 37 GLY H . . 4.500 3.465 3.464 3.466 . 0 0 "[ . 1 . 2]" 1
415 1 36 LEU HB2 1 37 GLY H . . 4.000 2.966 2.954 2.999 . 0 0 "[ . 1 . 2]" 1
416 1 36 LEU HG 1 37 GLY H . . 5.500 4.461 4.290 4.694 . 0 0 "[ . 1 . 2]" 1
417 1 36 LEU MD1 1 37 GLY H . . 5.800 4.485 4.240 4.720 . 0 0 "[ . 1 . 2]" 1
418 1 37 GLY H 1 38 PHE H . . 3.600 2.607 2.592 2.650 . 0 0 "[ . 1 . 2]" 1
419 1 34 LYS HA 1 37 GLY HA2 . . 4.600 3.496 3.390 3.607 . 0 0 "[ . 1 . 2]" 1
420 1 33 MET HA 1 38 PHE H . . 5.100 4.103 3.872 4.313 . 0 0 "[ . 1 . 2]" 1
421 1 33 MET HB3 1 38 PHE H . . 5.800 4.908 4.578 5.266 . 0 0 "[ . 1 . 2]" 1
422 1 34 LYS HA 1 38 PHE H . . 5.800 4.846 4.752 4.935 . 0 0 "[ . 1 . 2]" 1
423 1 36 LEU HA 1 38 PHE H . . 5.400 4.430 4.373 4.481 . 0 0 "[ . 1 . 2]" 1
424 1 36 LEU HB2 1 38 PHE H . . 3.600 2.681 2.546 2.856 . 0 0 "[ . 1 . 2]" 1
425 1 37 GLY HA2 1 38 PHE H . . 4.100 3.049 3.022 3.070 . 0 0 "[ . 1 . 2]" 1
426 1 37 GLY HA3 1 38 PHE H . . 4.300 3.448 3.436 3.462 . 0 0 "[ . 1 . 2]" 1
427 1 38 PHE H 1 38 PHE HB2 . . 3.700 2.674 2.554 2.970 . 0 0 "[ . 1 . 2]" 1
428 1 38 PHE H 1 40 ASP H . . 6.000 4.909 4.700 5.199 . 0 0 "[ . 1 . 2]" 1
429 1 38 PHE HA 1 39 GLY H . . 3.200 2.235 2.217 2.286 . 0 0 "[ . 1 . 2]" 1
430 1 38 PHE HB2 1 39 GLY H . . 4.800 4.208 3.931 4.331 . 0 0 "[ . 1 . 2]" 1
431 1 38 PHE HB3 1 39 GLY H . . 4.000 3.204 2.846 3.745 . 0 0 "[ . 1 . 2]" 1
432 1 39 GLY H 1 40 ASP H . . 3.700 2.737 2.660 2.810 . 0 0 "[ . 1 . 2]" 1
433 1 39 GLY HA2 1 41 LEU MD2 . . 4.700 3.110 3.027 3.234 . 0 0 "[ . 1 . 2]" 1
434 1 38 PHE HA 1 40 ASP H . . 4.800 3.756 3.672 3.819 . 0 0 "[ . 1 . 2]" 1
435 1 39 GLY HA2 1 40 ASP H . . 3.800 2.783 2.754 2.836 . 0 0 "[ . 1 . 2]" 1
436 1 39 GLY HA3 1 40 ASP H . . 4.600 3.547 3.534 3.553 . 0 0 "[ . 1 . 2]" 1
437 1 40 ASP H 1 40 ASP HB2 . . 4.000 2.621 2.132 3.618 . 0 0 "[ . 1 . 2]" 1
438 1 40 ASP H 1 40 ASP HB3 . . 3.300 2.624 2.309 3.264 . 0 0 "[ . 1 . 2]" 1
439 1 40 ASP H 1 41 LEU H . . 5.300 4.354 4.297 4.411 . 0 0 "[ . 1 . 2]" 1
440 1 37 GLY HA2 1 40 ASP HB2 . . 5.500 4.375 3.939 5.394 . 0 0 "[ . 1 . 2]" 1
441 1 40 ASP HA 1 41 LEU H . . 3.200 2.152 2.142 2.165 . 0 0 "[ . 1 . 2]" 1
442 1 40 ASP HB2 1 41 LEU H . . 5.200 4.412 3.575 4.600 . 0 0 "[ . 1 . 2]" 1
443 1 41 LEU H 1 41 LEU HB2 . . 3.300 2.328 2.310 2.396 . 0 0 "[ . 1 . 2]" 1
444 1 41 LEU H 1 41 LEU MD1 . . 5.200 4.067 4.052 4.117 . 0 0 "[ . 1 . 2]" 1
445 1 41 LEU H 1 41 LEU MD2 . . 4.200 2.547 2.383 2.697 . 0 0 "[ . 1 . 2]" 1
446 1 41 LEU H 1 41 LEU HG . . 5.300 4.289 4.260 4.389 . 0 0 "[ . 1 . 2]" 1
447 1 41 LEU HB3 1 45 GLU HB3 . . 3.500 2.087 2.008 2.266 . 0 0 "[ . 1 . 2]" 1
448 1 41 LEU HG 1 45 GLU HG3 . . 3.400 2.848 2.343 3.391 . 0 0 "[ . 1 . 2]" 1
449 1 41 LEU HB2 1 46 VAL MG2 . . 5.200 3.621 3.280 3.792 . 0 0 "[ . 1 . 2]" 1
450 1 42 PRO HA 1 43 ARG H . . 3.500 2.386 2.339 2.402 . 0 0 "[ . 1 . 2]" 1
451 1 42 PRO HB2 1 43 ARG H . . 3.600 2.651 2.610 2.777 . 0 0 "[ . 1 . 2]" 1
452 1 42 PRO HB3 1 43 ARG H . . 4.500 3.473 3.452 3.541 . 0 0 "[ . 1 . 2]" 1
453 1 43 ARG H 1 43 ARG HB3 . . 3.600 2.587 2.536 2.679 . 0 0 "[ . 1 . 2]" 1
454 1 43 ARG H 1 43 ARG HD2 . . 5.200 4.270 4.169 4.370 . 0 0 "[ . 1 . 2]" 1
455 1 43 ARG H 1 43 ARG HG3 . . 3.200 2.112 2.043 2.190 . 0 0 "[ . 1 . 2]" 1
456 1 43 ARG H 1 44 ASP H . . 3.700 2.687 2.652 2.736 . 0 0 "[ . 1 . 2]" 1
457 1 43 ARG H 1 45 GLU H . . 5.300 4.234 4.195 4.342 . 0 0 "[ . 1 . 2]" 1
458 1 43 ARG HA 1 46 VAL HB . . 4.200 2.936 2.800 3.100 . 0 0 "[ . 1 . 2]" 1
459 1 43 ARG HA 1 46 VAL MG2 . . 3.600 2.295 1.982 2.608 . 0 0 "[ . 1 . 2]" 1
460 1 42 PRO HA 1 44 ASP H . . 5.300 4.337 4.306 4.372 . 0 0 "[ . 1 . 2]" 1
461 1 42 PRO HB2 1 44 ASP H . . 3.500 2.543 2.487 2.611 . 0 0 "[ . 1 . 2]" 1
462 1 42 PRO HG2 1 44 ASP H . . 4.700 3.775 3.666 3.925 . 0 0 "[ . 1 . 2]" 1
463 1 43 ARG HA 1 44 ASP H . . 4.500 3.527 3.517 3.535 . 0 0 "[ . 1 . 2]" 1
464 1 43 ARG HD2 1 44 ASP H . . 4.100 2.913 2.663 3.188 . 0 0 "[ . 1 . 2]" 1
465 1 43 ARG HG3 1 44 ASP H . . 3.200 1.975 1.952 2.046 . 0 0 "[ . 1 . 2]" 1
466 1 43 ARG HE 1 44 ASP H . . 4.000 2.971 2.320 3.724 . 0 0 "[ . 1 . 2]" 1
467 1 44 ASP H 1 44 ASP HB3 . . 3.400 2.467 2.345 2.754 . 0 0 "[ . 1 . 2]" 1
468 1 44 ASP H 1 45 GLU H . . 3.700 2.725 2.700 2.774 . 0 0 "[ . 1 . 2]" 1
469 1 44 ASP HA 1 47 GLU HB3 . . 6.200 4.299 4.130 4.468 . 0 0 "[ . 1 . 2]" 1
470 1 44 ASP HA 1 47 GLU HG2 . . 3.400 2.254 2.000 2.614 . 0 0 "[ . 1 . 2]" 1
471 1 42 PRO HA 1 45 GLU H . . 5.700 4.701 4.665 4.742 . 0 0 "[ . 1 . 2]" 1
472 1 42 PRO HB2 1 45 GLU H . . 4.300 3.190 3.026 3.311 . 0 0 "[ . 1 . 2]" 1
473 1 42 PRO HG2 1 45 GLU H . . 3.500 2.362 2.237 2.438 . 0 0 "[ . 1 . 2]" 1
474 1 42 PRO HD2 1 45 GLU H . . 4.800 3.943 3.860 4.053 . 0 0 "[ . 1 . 2]" 1
475 1 43 ARG HA 1 45 GLU H . . 5.200 4.210 4.130 4.441 . 0 0 "[ . 1 . 2]" 1
476 1 43 ARG HG3 1 45 GLU H . . 5.600 4.578 4.543 4.627 . 0 0 "[ . 1 . 2]" 1
477 1 44 ASP HA 1 45 GLU H . . 4.500 3.526 3.516 3.548 . 0 0 "[ . 1 . 2]" 1
478 1 44 ASP HB2 1 45 GLU H . . 4.800 3.796 3.399 3.942 . 0 0 "[ . 1 . 2]" 1
479 1 45 GLU H 1 45 GLU HB2 . . 3.700 2.328 2.095 2.538 . 0 0 "[ . 1 . 2]" 1
480 1 45 GLU H 1 45 GLU HB3 . . 3.400 2.768 2.530 3.153 . 0 0 "[ . 1 . 2]" 1
481 1 45 GLU H 1 46 VAL H . . 3.800 2.565 2.541 2.622 . 0 0 "[ . 1 . 2]" 1
482 1 45 GLU H 1 48 ARG H . . 5.700 4.745 4.723 4.814 . 0 0 "[ . 1 . 2]" 1
483 1 45 GLU HA 1 48 ARG HB3 . . 3.700 2.743 2.538 3.022 . 0 0 "[ . 1 . 2]" 1
484 1 41 LEU HB2 1 46 VAL H . . 5.600 5.206 5.114 5.301 . 0 0 "[ . 1 . 2]" 1
485 1 42 PRO HB2 1 46 VAL H . . 6.200 5.135 4.899 5.285 . 0 0 "[ . 1 . 2]" 1
486 1 42 PRO HG2 1 46 VAL H . . 5.700 4.542 4.273 4.721 . 0 0 "[ . 1 . 2]" 1
487 1 43 ARG HA 1 46 VAL H . . 4.300 3.288 3.250 3.352 . 0 0 "[ . 1 . 2]" 1
488 1 43 ARG H 1 46 VAL H . . 5.800 4.916 4.821 4.974 . 0 0 "[ . 1 . 2]" 1
489 1 44 ASP HA 1 46 VAL H . . 5.200 4.232 4.157 4.266 . 0 0 "[ . 1 . 2]" 1
490 1 44 ASP H 1 46 VAL H . . 5.000 4.107 3.997 4.168 . 0 0 "[ . 1 . 2]" 1
491 1 45 GLU HA 1 46 VAL H . . 4.500 3.502 3.486 3.514 . 0 0 "[ . 1 . 2]" 1
492 1 45 GLU HB3 1 46 VAL H . . 3.800 2.821 2.723 3.053 . 0 0 "[ . 1 . 2]" 1
493 1 45 GLU HG2 1 46 VAL H . . 5.200 4.801 4.644 4.960 . 0 0 "[ . 1 . 2]" 1
494 1 46 VAL H 1 46 VAL HB . . 3.600 2.577 2.519 2.632 . 0 0 "[ . 1 . 2]" 1
495 1 46 VAL H 1 46 VAL MG2 . . 3.500 2.181 2.002 2.318 . 0 0 "[ . 1 . 2]" 1
496 1 46 VAL H 1 47 GLU H . . 3.800 2.696 2.640 2.734 . 0 0 "[ . 1 . 2]" 1
497 1 46 VAL H 1 48 ARG H . . 4.800 3.950 3.919 3.987 . 0 0 "[ . 1 . 2]" 1
498 1 43 ARG HA 1 47 GLU H . . 5.100 4.165 4.058 4.229 . 0 0 "[ . 1 . 2]" 1
499 1 43 ARG HB2 1 47 GLU H . . 5.500 4.703 4.619 4.787 . 0 0 "[ . 1 . 2]" 1
500 1 44 ASP HA 1 47 GLU H . . 4.700 3.669 3.575 3.755 . 0 0 "[ . 1 . 2]" 1
501 1 44 ASP H 1 47 GLU H . . 5.800 4.970 4.924 5.017 . 0 0 "[ . 1 . 2]" 1
502 1 45 GLU HA 1 47 GLU H . . 5.800 4.793 4.671 4.865 . 0 0 "[ . 1 . 2]" 1
503 1 45 GLU H 1 47 GLU H . . 5.400 4.417 4.302 4.495 . 0 0 "[ . 1 . 2]" 1
504 1 46 VAL HA 1 47 GLU H . . 4.500 3.565 3.557 3.570 . 0 0 "[ . 1 . 2]" 1
505 1 46 VAL HB 1 47 GLU H . . 3.300 2.337 2.265 2.432 . 0 0 "[ . 1 . 2]" 1
506 1 46 VAL MG1 1 47 GLU H . . 4.500 3.330 3.154 3.488 . 0 0 "[ . 1 . 2]" 1
507 1 47 GLU H 1 47 GLU HB3 . . 3.600 2.622 2.606 2.641 . 0 0 "[ . 1 . 2]" 1
508 1 47 GLU H 1 47 GLU HG2 . . 4.200 2.456 1.949 3.193 . 0 0 "[ . 1 . 2]" 1
509 1 47 GLU H 1 47 GLU HG3 . . 3.200 2.706 1.986 3.200 . 20 0 "[ . 1 . 2]" 1
510 1 47 GLU H 1 48 ARG H . . 3.800 2.666 2.634 2.716 . 0 0 "[ . 1 . 2]" 1
511 1 47 GLU H 1 50 VAL H . . 5.800 4.833 4.804 4.899 . 0 0 "[ . 1 . 2]" 1
512 1 47 GLU HA 1 50 VAL HB . . 4.100 2.884 2.808 3.008 . 0 0 "[ . 1 . 2]" 1
513 1 43 ARG HD2 1 47 GLU HG2 . . 4.200 3.540 3.155 3.798 . 0 0 "[ . 1 . 2]" 1
514 1 44 ASP HA 1 48 ARG H . . 5.200 3.927 3.870 4.036 . 0 0 "[ . 1 . 2]" 1
515 1 44 ASP HB2 1 48 ARG H . . 5.400 5.021 4.971 5.042 . 0 0 "[ . 1 . 2]" 1
516 1 45 GLU HA 1 48 ARG H . . 4.800 3.674 3.625 3.707 . 0 0 "[ . 1 . 2]" 1
517 1 46 VAL HA 1 48 ARG H . . 5.800 4.486 4.400 4.523 . 0 0 "[ . 1 . 2]" 1
518 1 47 GLU HA 1 48 ARG H . . 4.500 3.530 3.527 3.533 . 0 0 "[ . 1 . 2]" 1
519 1 47 GLU HG3 1 48 ARG H . . 3.400 2.168 2.106 2.249 . 0 0 "[ . 1 . 2]" 1
520 1 47 GLU HB2 1 48 ARG H . . 4.800 3.670 3.647 3.684 . 0 0 "[ . 1 . 2]" 1
521 1 48 ARG H 1 48 ARG HB2 . . 3.600 2.447 2.260 2.630 . 0 0 "[ . 1 . 2]" 1
522 1 48 ARG H 1 48 ARG HB3 . . 3.500 2.613 2.421 2.831 . 0 0 "[ . 1 . 2]" 1
523 1 48 ARG H 1 48 ARG HD2 . . 5.500 4.702 4.508 5.430 . 0 0 "[ . 1 . 2]" 1
524 1 48 ARG H 1 48 ARG HG2 . . 5.400 4.471 4.400 4.557 . 0 0 "[ . 1 . 2]" 1
525 1 48 ARG H 1 50 VAL H . . 4.800 4.172 4.125 4.254 . 0 0 "[ . 1 . 2]" 1
526 1 48 ARG H 1 51 ARG H . . 5.700 4.708 4.681 4.729 . 0 0 "[ . 1 . 2]" 1
527 1 48 ARG HA 1 51 ARG HB3 . . 3.500 2.944 2.627 3.292 . 0 0 "[ . 1 . 2]" 1
528 1 45 GLU HA 1 49 THR H . . 5.200 3.806 3.730 3.952 . 0 0 "[ . 1 . 2]" 1
529 1 45 GLU HG2 1 49 THR H . . 5.200 4.668 4.297 5.043 . 0 0 "[ . 1 . 2]" 1
530 1 46 VAL H 1 49 THR H . . 5.800 4.636 4.615 4.667 . 0 0 "[ . 1 . 2]" 1
531 1 46 VAL HA 1 49 THR H . . 4.800 3.698 3.581 3.763 . 0 0 "[ . 1 . 2]" 1
532 1 47 GLU HA 1 49 THR H . . 5.800 4.606 4.550 4.667 . 0 0 "[ . 1 . 2]" 1
533 1 47 GLU H 1 49 THR H . . 5.200 4.298 4.212 4.347 . 0 0 "[ . 1 . 2]" 1
534 1 48 ARG HA 1 49 THR H . . 4.500 3.552 3.544 3.557 . 0 0 "[ . 1 . 2]" 1
535 1 48 ARG HB3 1 49 THR H . . 3.400 2.468 2.408 2.524 . 0 0 "[ . 1 . 2]" 1
536 1 48 ARG HG2 1 49 THR H . . 4.600 3.938 3.413 4.270 . 0 0 "[ . 1 . 2]" 1
537 1 48 ARG HD2 1 49 THR H . . 5.200 4.685 3.362 5.182 . 0 0 "[ . 1 . 2]" 1
538 1 48 ARG H 1 49 THR H . . 3.800 2.696 2.637 2.735 . 0 0 "[ . 1 . 2]" 1
539 1 49 THR H 1 52 SER H . . 5.800 4.808 4.768 4.850 . 0 0 "[ . 1 . 2]" 1
540 1 49 THR HA 1 52 SER HB2 . . 4.400 3.011 2.725 3.280 . 0 0 "[ . 1 . 2]" 1
541 1 49 THR HB 1 53 MET HG3 . . 5.200 4.367 3.668 5.129 . 0 0 "[ . 1 . 2]" 1
542 1 46 VAL HA 1 50 VAL H . . 5.200 4.103 4.010 4.171 . 0 0 "[ . 1 . 2]" 1
543 1 46 VAL MG1 1 50 VAL H . . 5.700 4.167 4.085 4.255 . 0 0 "[ . 1 . 2]" 1
544 1 47 GLU HA 1 50 VAL H . . 4.800 3.634 3.588 3.722 . 0 0 "[ . 1 . 2]" 1
545 1 48 ARG HA 1 50 VAL H . . 5.400 4.544 4.468 4.660 . 0 0 "[ . 1 . 2]" 1
546 1 49 THR HA 1 50 VAL H . . 4.500 3.547 3.540 3.558 . 0 0 "[ . 1 . 2]" 1
547 1 49 THR HB 1 50 VAL H . . 4.500 3.226 2.475 3.478 . 0 0 "[ . 1 . 2]" 1
548 1 49 THR H 1 50 VAL H . . 3.800 2.730 2.688 2.779 . 0 0 "[ . 1 . 2]" 1
549 1 50 VAL H 1 50 VAL HB . . 3.500 2.540 2.527 2.545 . 0 0 "[ . 1 . 2]" 1
550 1 50 VAL H 1 50 VAL MG2 . . 3.400 2.185 2.028 2.248 . 0 0 "[ . 1 . 2]" 1
551 1 50 VAL H 1 51 ARG H . . 3.800 2.659 2.619 2.675 . 0 0 "[ . 1 . 2]" 1
552 1 50 VAL H 1 52 SER H . . 5.200 4.206 4.180 4.239 . 0 0 "[ . 1 . 2]" 1
553 1 50 VAL HA 1 53 MET HB2 . . 3.500 2.847 2.617 2.997 . 0 0 "[ . 1 . 2]" 1
554 1 46 VAL MG1 1 50 VAL MG2 . . 4.800 2.511 2.407 2.663 . 0 0 "[ . 1 . 2]" 1
555 1 47 GLU HA 1 51 ARG H . . 5.200 4.069 3.989 4.100 . 0 0 "[ . 1 . 2]" 1
556 1 47 GLU HB2 1 51 ARG H . . 6.000 5.028 5.014 5.044 . 0 0 "[ . 1 . 2]" 1
557 1 48 ARG HA 1 51 ARG H . . 4.800 3.557 3.500 3.591 . 0 0 "[ . 1 . 2]" 1
558 1 49 THR HA 1 51 ARG H . . 5.400 4.441 4.396 4.495 . 0 0 "[ . 1 . 2]" 1
559 1 49 THR H 1 51 ARG H . . 5.100 4.148 4.107 4.174 . 0 0 "[ . 1 . 2]" 1
560 1 50 VAL HA 1 51 ARG H . . 4.500 3.534 3.532 3.536 . 0 0 "[ . 1 . 2]" 1
561 1 50 VAL HB 1 51 ARG H . . 3.700 2.635 2.623 2.649 . 0 0 "[ . 1 . 2]" 1
562 1 50 VAL MG1 1 51 ARG H . . 5.000 3.493 3.459 3.530 . 0 0 "[ . 1 . 2]" 1
563 1 50 VAL MG2 1 51 ARG H . . 5.200 3.845 3.822 3.855 . 0 0 "[ . 1 . 2]" 1
564 1 51 ARG H 1 51 ARG HB2 . . 3.600 2.439 2.194 2.668 . 0 0 "[ . 1 . 2]" 1
565 1 51 ARG H 1 51 ARG HB3 . . 3.400 2.626 2.391 2.926 . 0 0 "[ . 1 . 2]" 1
566 1 51 ARG H 1 51 ARG HD2 . . 5.200 4.590 4.223 4.841 . 0 0 "[ . 1 . 2]" 1
567 1 51 ARG H 1 51 ARG HG2 . . 5.400 4.361 4.132 4.436 . 0 0 "[ . 1 . 2]" 1
568 1 51 ARG H 1 54 ASN H . . 5.800 4.948 4.818 5.091 . 0 0 "[ . 1 . 2]" 1
569 1 48 ARG HA 1 52 SER H . . 5.200 4.148 4.044 4.206 . 0 0 "[ . 1 . 2]" 1
570 1 48 ARG HG3 1 52 SER H . . 6.200 5.440 4.655 6.121 . 0 0 "[ . 1 . 2]" 1
571 1 49 THR HA 1 52 SER H . . 4.800 3.583 3.524 3.680 . 0 0 "[ . 1 . 2]" 1
572 1 50 VAL HA 1 52 SER H . . 5.200 4.472 4.411 4.497 . 0 0 "[ . 1 . 2]" 1
573 1 51 ARG HA 1 52 SER H . . 4.500 3.540 3.537 3.545 . 0 0 "[ . 1 . 2]" 1
574 1 51 ARG HB3 1 52 SER H . . 3.500 2.579 2.527 2.624 . 0 0 "[ . 1 . 2]" 1
575 1 51 ARG HD2 1 52 SER H . . 4.000 3.490 2.818 3.938 . 0 0 "[ . 1 . 2]" 1
576 1 51 ARG HG2 1 52 SER H . . 5.000 4.445 4.055 4.907 . 0 0 "[ . 1 . 2]" 1
577 1 51 ARG H 1 52 SER H . . 3.800 2.665 2.634 2.716 . 0 0 "[ . 1 . 2]" 1
578 1 52 SER H 1 52 SER HB2 . . 3.300 2.469 2.081 2.796 . 0 0 "[ . 1 . 2]" 1
579 1 52 SER H 1 53 MET H . . 3.800 2.706 2.651 2.742 . 0 0 "[ . 1 . 2]" 1
580 1 52 SER H 1 54 ASN H . . 5.400 4.604 4.454 4.720 . 0 0 "[ . 1 . 2]" 1
581 1 48 ARG HG2 1 52 SER HG . . 4.200 3.484 2.850 4.192 . 0 0 "[ . 1 . 2]" 1
582 1 49 THR HA 1 53 MET H . . 5.000 4.014 3.918 4.143 . 0 0 "[ . 1 . 2]" 1
583 1 49 THR HB 1 53 MET H . . 5.800 5.088 4.801 5.739 . 0 0 "[ . 1 . 2]" 1
584 1 50 VAL HA 1 53 MET H . . 4.800 3.651 3.542 3.735 . 0 0 "[ . 1 . 2]" 1
585 1 50 VAL H 1 53 MET H . . 5.700 4.838 4.769 4.881 . 0 0 "[ . 1 . 2]" 1
586 1 51 ARG HA 1 53 MET H . . 5.200 4.736 4.585 4.844 . 0 0 "[ . 1 . 2]" 1
587 1 51 ARG HB3 1 53 MET H . . 6.100 5.144 5.055 5.209 . 0 0 "[ . 1 . 2]" 1
588 1 51 ARG H 1 53 MET H . . 5.600 4.291 4.192 4.357 . 0 0 "[ . 1 . 2]" 1
589 1 52 SER HA 1 53 MET H . . 4.500 3.558 3.548 3.565 . 0 0 "[ . 1 . 2]" 1
590 1 52 SER HB2 1 53 MET H . . 3.500 2.559 2.334 3.278 . 0 0 "[ . 1 . 2]" 1
591 1 53 MET H 1 53 MET HB2 . . 3.400 2.425 2.202 2.573 . 0 0 "[ . 1 . 2]" 1
592 1 53 MET H 1 53 MET ME . . 5.200 3.996 3.301 4.644 . 0 0 "[ . 1 . 2]" 1
593 1 53 MET H 1 53 MET HG3 . . 3.500 2.376 2.040 3.057 . 0 0 "[ . 1 . 2]" 1
594 1 53 MET H 1 54 ASN H . . 3.800 2.934 2.835 3.020 . 0 0 "[ . 1 . 2]" 1
595 1 53 MET HG2 1 69 MET HB3 . . 3.500 2.507 2.016 3.193 . 0 0 "[ . 1 . 2]" 1
596 1 53 MET HG3 1 69 MET HG2 . . 3.400 2.345 2.000 2.779 . 0 0 "[ . 1 . 2]" 1
597 1 53 MET HA 1 69 MET HB2 . . 4.200 3.291 2.227 4.119 . 0 0 "[ . 1 . 2]" 1
598 1 50 VAL HA 1 54 ASN H . . 5.200 3.421 3.305 3.569 . 0 0 "[ . 1 . 2]" 1
599 1 50 VAL MG2 1 54 ASN H . . 6.000 5.136 5.063 5.251 . 0 0 "[ . 1 . 2]" 1
600 1 51 ARG HA 1 54 ASN H . . 5.400 4.227 4.101 4.318 . 0 0 "[ . 1 . 2]" 1
601 1 52 SER HA 1 54 ASN H . . 5.800 5.273 5.163 5.391 . 0 0 "[ . 1 . 2]" 1
602 1 53 MET HA 1 54 ASN H . . 4.600 3.570 3.566 3.572 . 0 0 "[ . 1 . 2]" 1
603 1 53 MET HB2 1 54 ASN H . . 3.200 2.148 1.979 2.381 . 0 0 "[ . 1 . 2]" 1
604 1 53 MET HB3 1 54 ASN H . . 3.900 3.034 2.728 3.251 . 0 0 "[ . 1 . 2]" 1
605 1 54 ASN H 1 54 ASN HB2 . . 3.500 2.475 2.246 2.731 . 0 0 "[ . 1 . 2]" 1
606 1 54 ASN H 1 54 ASN HB3 . . 3.600 2.743 2.464 3.040 . 0 0 "[ . 1 . 2]" 1
607 1 54 ASN H 1 55 THR H . . 5.000 4.212 4.112 4.259 . 0 0 "[ . 1 . 2]" 1
608 1 54 ASN HA 1 61 ILE HA . . 5.500 5.119 4.199 5.488 . 0 0 "[ . 1 . 2]" 1
609 1 54 ASN HB2 1 61 ILE HG12 . . 3.800 3.461 2.549 3.792 . 0 0 "[ . 1 . 2]" 1
610 1 54 ASN HA 1 65 GLU HG3 . . 4.600 3.923 2.590 4.541 . 0 0 "[ . 1 . 2]" 1
611 1 53 MET HA 1 55 THR H . . 5.800 5.133 4.861 5.270 . 0 0 "[ . 1 . 2]" 1
612 1 54 ASN HA 1 55 THR H . . 3.300 2.193 2.177 2.242 . 0 0 "[ . 1 . 2]" 1
613 1 54 ASN HB3 1 55 THR H . . 5.200 4.304 4.126 4.479 . 0 0 "[ . 1 . 2]" 1
614 1 55 THR H 1 55 THR HB . . 3.600 2.556 2.471 2.617 . 0 0 "[ . 1 . 2]" 1
615 1 55 THR H 1 55 THR MG . . 4.000 2.060 1.933 2.217 . 0 0 "[ . 1 . 2]" 1
616 1 55 THR H 1 56 ASN H . . 3.600 2.752 2.668 2.801 . 0 0 "[ . 1 . 2]" 1
617 1 55 THR H 1 65 GLU HG3 . . 5.200 4.633 3.496 5.171 . 0 0 "[ . 1 . 2]" 1
618 1 52 SER HA 1 55 THR HA . . 5.500 4.921 4.840 5.050 . 0 0 "[ . 1 . 2]" 1
619 1 54 ASN HA 1 56 ASN H . . 4.400 3.554 3.507 3.656 . 0 0 "[ . 1 . 2]" 1
620 1 54 ASN HB3 1 56 ASN H . . 5.400 4.094 3.718 4.885 . 0 0 "[ . 1 . 2]" 1
621 1 55 THR HA 1 56 ASN H . . 4.400 3.505 3.486 3.524 . 0 0 "[ . 1 . 2]" 1
622 1 55 THR HB 1 56 ASN H . . 5.000 4.022 3.985 4.069 . 0 0 "[ . 1 . 2]" 1
623 1 55 THR MG 1 56 ASN H . . 3.500 2.157 1.929 2.292 . 0 0 "[ . 1 . 2]" 1
624 1 56 ASN H 1 56 ASN HB2 . . 3.800 2.558 2.296 3.639 . 0 0 "[ . 1 . 2]" 1
625 1 56 ASN H 1 57 ALA H . . 5.000 4.095 4.028 4.212 . 0 0 "[ . 1 . 2]" 1
626 1 54 ASN HB3 1 57 ALA HA . . 5.100 3.511 3.063 4.338 . 0 0 "[ . 1 . 2]" 1
627 1 55 THR HA 1 57 ALA H . . 6.000 5.307 5.175 5.405 . 0 0 "[ . 1 . 2]" 1
628 1 56 ASN HA 1 57 ALA H . . 3.200 2.178 2.157 2.189 . 0 0 "[ . 1 . 2]" 1
629 1 56 ASN HB2 1 57 ALA H . . 5.200 4.452 3.860 4.590 . 0 0 "[ . 1 . 2]" 1
630 1 56 ASN HB3 1 57 ALA H . . 5.000 3.853 3.722 4.336 . 0 0 "[ . 1 . 2]" 1
631 1 57 ALA H 1 57 ALA MB . . 3.400 2.130 2.026 2.239 . 0 0 "[ . 1 . 2]" 1
632 1 56 ASN HA 1 58 ASN H . . 6.000 5.312 5.146 5.390 . 0 0 "[ . 1 . 2]" 1
633 1 56 ASN HB2 1 58 ASN H . . 5.400 5.050 4.775 5.353 . 0 0 "[ . 1 . 2]" 1
634 1 56 ASN H 1 58 ASN H . . 6.000 5.365 5.282 5.514 . 0 0 "[ . 1 . 2]" 1
635 1 57 ALA HA 1 58 ASN H . . 3.300 2.207 2.189 2.250 . 0 0 "[ . 1 . 2]" 1
636 1 57 ALA MB 1 58 ASN H . . 4.800 3.516 3.477 3.579 . 0 0 "[ . 1 . 2]" 1
637 1 57 ALA H 1 58 ASN H . . 5.200 4.253 4.161 4.293 . 0 0 "[ . 1 . 2]" 1
638 1 58 ASN H 1 58 ASN HB2 . . 3.600 2.588 2.466 2.903 . 0 0 "[ . 1 . 2]" 1
639 1 58 ASN H 1 58 ASN HB3 . . 4.200 3.210 2.851 3.666 . 0 0 "[ . 1 . 2]" 1
640 1 58 ASN H 1 59 GLY H . . 3.100 2.166 2.107 2.223 . 0 0 "[ . 1 . 2]" 1
641 1 58 ASN H 1 60 LEU H . . 4.000 2.944 2.916 2.973 . 0 0 "[ . 1 . 2]" 1
642 1 54 ASN HD22 1 58 ASN H . . 3.200 3.010 2.522 3.200 0.000 10 0 "[ . 1 . 2]" 1
643 1 56 ASN HB2 1 58 ASN HB2 . . 4.500 4.212 3.913 4.478 . 0 0 "[ . 1 . 2]" 1
644 1 57 ALA HA 1 59 GLY H . . 4.200 3.247 3.211 3.271 . 0 0 "[ . 1 . 2]" 1
645 1 57 ALA MB 1 59 GLY H . . 5.000 3.614 3.441 3.809 . 0 0 "[ . 1 . 2]" 1
646 1 58 ASN HA 1 59 GLY H . . 4.100 3.135 3.134 3.135 . 0 0 "[ . 1 . 2]" 1
647 1 58 ASN HB2 1 59 GLY H . . 5.100 4.129 3.847 4.363 . 0 0 "[ . 1 . 2]" 1
648 1 58 ASN HB3 1 59 GLY H . . 5.000 3.958 3.813 4.273 . 0 0 "[ . 1 . 2]" 1
649 1 59 GLY H 1 60 LEU H . . 3.500 2.496 2.465 2.509 . 0 0 "[ . 1 . 2]" 1
650 1 57 ALA HA 1 60 LEU H . . 5.700 4.559 4.486 4.608 . 0 0 "[ . 1 . 2]" 1
651 1 58 ASN HA 1 60 LEU H . . 5.300 4.569 4.529 4.610 . 0 0 "[ . 1 . 2]" 1
652 1 58 ASN HB2 1 60 LEU H . . 4.800 4.165 3.563 4.586 . 0 0 "[ . 1 . 2]" 1
653 1 58 ASN HB3 1 60 LEU H . . 4.800 3.555 3.242 4.278 . 0 0 "[ . 1 . 2]" 1
654 1 59 GLY HA2 1 60 LEU H . . 4.000 3.061 3.044 3.081 . 0 0 "[ . 1 . 2]" 1
655 1 59 GLY HA3 1 60 LEU H . . 4.300 3.441 3.430 3.450 . 0 0 "[ . 1 . 2]" 1
656 1 60 LEU H 1 60 LEU HB2 . . 3.500 2.757 2.595 2.996 . 0 0 "[ . 1 . 2]" 1
657 1 60 LEU H 1 60 LEU MD1 . . 5.000 3.779 3.019 4.510 . 0 0 "[ . 1 . 2]" 1
658 1 60 LEU H 1 60 LEU HG . . 5.500 4.472 3.872 4.805 . 0 0 "[ . 1 . 2]" 1
659 1 60 LEU H 1 61 ILE H . . 5.400 4.342 4.295 4.374 . 0 0 "[ . 1 . 2]" 1
660 1 23 ALA MB 1 61 ILE H . . 3.600 2.649 1.861 3.065 . 0 0 "[ . 1 . 2]" 1
661 1 25 ASP HA 1 61 ILE H . . 5.400 4.445 3.937 5.384 . 0 0 "[ . 1 . 2]" 1
662 1 60 LEU HA 1 61 ILE H . . 3.200 2.215 2.180 2.250 . 0 0 "[ . 1 . 2]" 1
663 1 60 LEU HB3 1 61 ILE H . . 4.000 3.343 2.848 3.847 . 0 0 "[ . 1 . 2]" 1
664 1 60 LEU HG 1 61 ILE H . . 4.300 3.151 2.358 4.217 . 0 0 "[ . 1 . 2]" 1
665 1 60 LEU MD1 1 61 ILE H . . 5.800 4.321 3.405 5.066 . 0 0 "[ . 1 . 2]" 1
666 1 60 LEU MD2 1 61 ILE H . . 5.500 3.761 3.067 4.289 . 0 0 "[ . 1 . 2]" 1
667 1 61 ILE H 1 61 ILE HB . . 3.700 2.659 2.624 2.728 . 0 0 "[ . 1 . 2]" 1
668 1 61 ILE H 1 61 ILE MD . . 5.200 3.925 3.791 4.021 . 0 0 "[ . 1 . 2]" 1
669 1 61 ILE H 1 61 ILE HG13 . . 3.800 2.725 2.617 2.810 . 0 0 "[ . 1 . 2]" 1
670 1 61 ILE HA 1 62 GLU H . . 3.200 2.163 2.153 2.168 . 0 0 "[ . 1 . 2]" 1
671 1 61 ILE HG12 1 62 GLU H . . 5.200 4.416 4.365 4.502 . 0 0 "[ . 1 . 2]" 1
672 1 61 ILE MG 1 62 GLU H . . 4.000 2.376 2.215 2.644 . 0 0 "[ . 1 . 2]" 1
673 1 61 ILE H 1 62 GLU H . . 4.500 4.394 4.357 4.418 . 0 0 "[ . 1 . 2]" 1
674 1 62 GLU H 1 62 GLU HB2 . . 3.500 2.389 2.178 2.630 . 0 0 "[ . 1 . 2]" 1
675 1 62 GLU H 1 62 GLU HG3 . . 4.000 3.127 2.406 3.913 . 0 0 "[ . 1 . 2]" 1
676 1 62 GLU H 1 65 GLU H . . 5.400 4.564 4.121 4.784 . 0 0 "[ . 1 . 2]" 1
677 1 62 GLU H 1 65 GLU HB2 . . 4.600 3.430 3.021 3.698 . 0 0 "[ . 1 . 2]" 1
678 1 60 LEU HB3 1 62 GLU HG2 . . 5.100 4.720 4.346 5.097 . 0 0 "[ . 1 . 2]" 1
679 1 62 GLU HB2 1 65 GLU HG2 . . 3.200 2.815 2.159 3.170 . 0 0 "[ . 1 . 2]" 1
680 1 62 GLU HA 1 63 TYR H . . 3.200 2.212 2.205 2.263 . 0 0 "[ . 1 . 2]" 1
681 1 62 GLU HB3 1 63 TYR H . . 4.000 3.006 2.824 3.130 . 0 0 "[ . 1 . 2]" 1
682 1 62 GLU H 1 63 TYR H . . 5.500 4.567 4.548 4.573 . 0 0 "[ . 1 . 2]" 1
683 1 63 TYR H 1 63 TYR HB3 . . 3.500 2.539 2.522 2.569 . 0 0 "[ . 1 . 2]" 1
684 1 63 TYR H 1 64 GLY H . . 3.600 2.655 2.570 2.750 . 0 0 "[ . 1 . 2]" 1
685 1 63 TYR HA 1 66 PHE HB3 . . 3.500 2.511 2.360 2.714 . 0 0 "[ . 1 . 2]" 1
686 1 13 PHE HE2 1 63 TYR HB3 . . 3.600 3.010 2.453 3.601 0.001 20 0 "[ . 1 . 2]" 1
687 1 62 GLU HA 1 64 GLY H . . 5.000 4.081 4.049 4.170 . 0 0 "[ . 1 . 2]" 1
688 1 62 GLU HB2 1 64 GLY H . . 4.600 3.979 3.554 4.378 . 0 0 "[ . 1 . 2]" 1
689 1 62 GLU HB3 1 64 GLY H . . 4.000 2.819 2.620 3.049 . 0 0 "[ . 1 . 2]" 1
690 1 62 GLU H 1 64 GLY H . . 6.200 5.506 5.247 5.633 . 0 0 "[ . 1 . 2]" 1
691 1 63 TYR HA 1 64 GLY H . . 4.500 3.525 3.521 3.533 . 0 0 "[ . 1 . 2]" 1
692 1 63 TYR HB2 1 64 GLY H . . 4.800 3.780 3.726 3.826 . 0 0 "[ . 1 . 2]" 1
693 1 64 GLY H 1 65 GLU H . . 3.800 2.810 2.769 2.848 . 0 0 "[ . 1 . 2]" 1
694 1 64 GLY H 1 67 GLU H . . 5.800 4.939 4.886 4.995 . 0 0 "[ . 1 . 2]" 1
695 1 64 GLY HA2 1 67 GLU HG2 . . 3.600 2.511 2.354 2.610 . 0 0 "[ . 1 . 2]" 1
696 1 62 GLU HB2 1 65 GLU H . . 3.800 2.840 2.472 3.251 . 0 0 "[ . 1 . 2]" 1
697 1 63 TYR HA 1 65 GLU H . . 5.500 4.737 4.686 4.783 . 0 0 "[ . 1 . 2]" 1
698 1 63 TYR H 1 65 GLU H . . 5.500 4.496 4.394 4.582 . 0 0 "[ . 1 . 2]" 1
699 1 64 GLY HA2 1 65 GLU H . . 4.500 3.565 3.563 3.566 . 0 0 "[ . 1 . 2]" 1
700 1 64 GLY HA3 1 65 GLU H . . 3.800 2.678 2.670 2.694 . 0 0 "[ . 1 . 2]" 1
701 1 65 GLU H 1 65 GLU HB2 . . 3.700 2.459 2.366 2.659 . 0 0 "[ . 1 . 2]" 1
702 1 65 GLU H 1 65 GLU HG2 . . 3.200 2.307 1.987 2.449 . 0 0 "[ . 1 . 2]" 1
703 1 65 GLU H 1 68 ARG H . . 5.700 4.758 4.739 4.772 . 0 0 "[ . 1 . 2]" 1
704 1 65 GLU HA 1 68 ARG HB3 . . 3.500 2.410 2.322 2.509 . 0 0 "[ . 1 . 2]" 1
705 1 62 GLU HA 1 66 PHE H . . 5.200 5.194 5.165 5.202 0.002 20 0 "[ . 1 . 2]" 1
706 1 62 GLU HB2 1 66 PHE H . . 5.300 4.128 3.765 4.602 . 0 0 "[ . 1 . 2]" 1
707 1 63 TYR HA 1 66 PHE H . . 4.400 3.518 3.462 3.571 . 0 0 "[ . 1 . 2]" 1
708 1 63 TYR H 1 66 PHE H . . 5.800 4.726 4.696 4.751 . 0 0 "[ . 1 . 2]" 1
709 1 64 GLY HA2 1 66 PHE H . . 5.400 4.300 4.265 4.388 . 0 0 "[ . 1 . 2]" 1
710 1 64 GLY H 1 66 PHE H . . 5.000 3.910 3.884 3.986 . 0 0 "[ . 1 . 2]" 1
711 1 65 GLU HA 1 66 PHE H . . 4.500 3.490 3.485 3.506 . 0 0 "[ . 1 . 2]" 1
712 1 65 GLU HB2 1 66 PHE H . . 3.700 2.865 2.774 2.899 . 0 0 "[ . 1 . 2]" 1
713 1 65 GLU HG2 1 66 PHE H . . 5.000 4.402 4.076 4.535 . 0 0 "[ . 1 . 2]" 1
714 1 65 GLU H 1 66 PHE H . . 3.600 2.574 2.548 2.599 . 0 0 "[ . 1 . 2]" 1
715 1 66 PHE H 1 66 PHE HB2 . . 3.600 2.549 2.357 2.665 . 0 0 "[ . 1 . 2]" 1
716 1 66 PHE H 1 66 PHE HB3 . . 3.400 2.519 2.404 2.722 . 0 0 "[ . 1 . 2]" 1
717 1 66 PHE H 1 67 GLU H . . 3.800 2.817 2.771 2.876 . 0 0 "[ . 1 . 2]" 1
718 1 66 PHE H 1 68 ARG H . . 5.000 3.903 3.868 3.960 . 0 0 "[ . 1 . 2]" 1
719 1 66 PHE HA 1 69 MET HB3 . . 3.400 3.294 3.194 3.390 . 0 0 "[ . 1 . 2]" 1
720 1 63 TYR HA 1 67 GLU H . . 5.000 3.869 3.763 3.928 . 0 0 "[ . 1 . 2]" 1
721 1 63 TYR HB2 1 67 GLU H . . 5.700 4.806 4.689 4.862 . 0 0 "[ . 1 . 2]" 1
722 1 64 GLY HA2 1 67 GLU H . . 5.000 3.941 3.871 3.986 . 0 0 "[ . 1 . 2]" 1
723 1 65 GLU HA 1 67 GLU H . . 5.800 4.837 4.775 4.869 . 0 0 "[ . 1 . 2]" 1
724 1 65 GLU H 1 67 GLU H . . 5.600 4.615 4.558 4.653 . 0 0 "[ . 1 . 2]" 1
725 1 66 PHE HA 1 67 GLU H . . 4.500 3.569 3.567 3.570 . 0 0 "[ . 1 . 2]" 1
726 1 66 PHE HB3 1 67 GLU H . . 3.400 2.247 2.191 2.300 . 0 0 "[ . 1 . 2]" 1
727 1 67 GLU H 1 67 GLU HB3 . . 3.500 2.538 2.505 2.571 . 0 0 "[ . 1 . 2]" 1
728 1 67 GLU H 1 69 MET H . . 5.300 4.322 4.283 4.406 . 0 0 "[ . 1 . 2]" 1
729 1 67 GLU H 1 70 VAL H . . 5.800 4.873 4.797 4.922 . 0 0 "[ . 1 . 2]" 1
730 1 64 GLY HA2 1 68 ARG H . . 5.100 4.073 3.999 4.107 . 0 0 "[ . 1 . 2]" 1
731 1 65 GLU HA 1 68 ARG H . . 4.600 3.569 3.523 3.631 . 0 0 "[ . 1 . 2]" 1
732 1 66 PHE HA 1 68 ARG H . . 5.500 4.485 4.395 4.554 . 0 0 "[ . 1 . 2]" 1
733 1 67 GLU HA 1 68 ARG H . . 4.500 3.521 3.513 3.529 . 0 0 "[ . 1 . 2]" 1
734 1 67 GLU HB3 1 68 ARG H . . 4.800 3.933 3.928 3.960 . 0 0 "[ . 1 . 2]" 1
735 1 67 GLU HG2 1 68 ARG H . . 3.400 2.346 2.110 2.529 . 0 0 "[ . 1 . 2]" 1
736 1 67 GLU HG3 1 68 ARG H . . 3.500 2.492 2.382 2.645 . 0 0 "[ . 1 . 2]" 1
737 1 67 GLU H 1 68 ARG H . . 3.700 2.638 2.601 2.657 . 0 0 "[ . 1 . 2]" 1
738 1 68 ARG H 1 68 ARG HB2 . . 3.400 2.489 2.360 2.604 . 0 0 "[ . 1 . 2]" 1
739 1 68 ARG H 1 68 ARG HB3 . . 3.600 2.559 2.444 2.697 . 0 0 "[ . 1 . 2]" 1
740 1 68 ARG H 1 68 ARG HD2 . . 5.500 4.635 4.276 5.440 . 0 0 "[ . 1 . 2]" 1
741 1 68 ARG H 1 68 ARG HG3 . . 5.400 4.476 4.350 4.606 . 0 0 "[ . 1 . 2]" 1
742 1 68 ARG H 1 69 MET H . . 3.800 2.740 2.720 2.770 . 0 0 "[ . 1 . 2]" 1
743 1 68 ARG H 1 70 VAL H . . 5.200 4.305 4.237 4.364 . 0 0 "[ . 1 . 2]" 1
744 1 68 ARG HA 1 71 LYS HB3 . . 4.300 3.200 2.973 3.441 . 0 0 "[ . 1 . 2]" 1
745 1 68 ARG HG2 1 71 LYS HE3 . . 5.200 4.334 3.094 5.165 . 0 0 "[ . 1 . 2]" 1
746 1 65 GLU HA 1 69 MET H . . 5.000 3.839 3.758 3.937 . 0 0 "[ . 1 . 2]" 1
747 1 65 GLU HB3 1 69 MET H . . 6.000 4.821 4.777 4.896 . 0 0 "[ . 1 . 2]" 1
748 1 66 PHE HA 1 69 MET H . . 4.800 3.784 3.745 3.821 . 0 0 "[ . 1 . 2]" 1
749 1 66 PHE H 1 69 MET H . . 5.800 4.692 4.646 4.748 . 0 0 "[ . 1 . 2]" 1
750 1 67 GLU HA 1 69 MET H . . 5.500 4.451 4.328 4.600 . 0 0 "[ . 1 . 2]" 1
751 1 68 ARG HA 1 69 MET H . . 4.500 3.549 3.542 3.559 . 0 0 "[ . 1 . 2]" 1
752 1 68 ARG HB3 1 69 MET H . . 3.400 2.511 2.420 2.558 . 0 0 "[ . 1 . 2]" 1
753 1 68 ARG HG2 1 69 MET H . . 4.800 3.966 3.491 4.413 . 0 0 "[ . 1 . 2]" 1
754 1 68 ARG HD2 1 69 MET H . . 5.400 4.471 2.784 5.371 . 0 0 "[ . 1 . 2]" 1
755 1 69 MET H 1 69 MET HB2 . . 3.700 2.594 2.495 2.701 . 0 0 "[ . 1 . 2]" 1
756 1 69 MET H 1 69 MET HB3 . . 3.400 2.471 2.372 2.565 . 0 0 "[ . 1 . 2]" 1
757 1 69 MET H 1 69 MET HG3 . . 5.200 4.404 4.336 4.462 . 0 0 "[ . 1 . 2]" 1
758 1 69 MET H 1 69 MET ME . . 5.600 4.509 4.004 5.032 . 0 0 "[ . 1 . 2]" 1
759 1 69 MET H 1 71 LYS H . . 5.200 4.135 4.005 4.226 . 0 0 "[ . 1 . 2]" 1
760 1 69 MET H 1 72 SER H . . 5.800 4.759 4.608 4.849 . 0 0 "[ . 1 . 2]" 1
761 1 66 PHE HA 1 70 VAL H . . 5.200 4.142 4.061 4.257 . 0 0 "[ . 1 . 2]" 1
762 1 67 GLU HA 1 70 VAL H . . 4.500 3.562 3.382 3.684 . 0 0 "[ . 1 . 2]" 1
763 1 68 ARG HA 1 70 VAL H . . 5.700 4.819 4.723 4.892 . 0 0 "[ . 1 . 2]" 1
764 1 69 MET HA 1 70 VAL H . . 4.500 3.560 3.550 3.565 . 0 0 "[ . 1 . 2]" 1
765 1 69 MET HB3 1 70 VAL H . . 3.500 2.415 2.329 2.508 . 0 0 "[ . 1 . 2]" 1
766 1 69 MET HG3 1 70 VAL H . . 4.400 3.515 3.283 3.790 . 0 0 "[ . 1 . 2]" 1
767 1 69 MET H 1 70 VAL H . . 3.800 2.691 2.587 2.770 . 0 0 "[ . 1 . 2]" 1
768 1 70 VAL H 1 70 VAL HB . . 3.600 2.608 2.589 2.646 . 0 0 "[ . 1 . 2]" 1
769 1 70 VAL H 1 70 VAL MG2 . . 3.400 2.111 2.065 2.163 . 0 0 "[ . 1 . 2]" 1
770 1 70 VAL H 1 71 LYS H . . 3.800 2.826 2.798 2.854 . 0 0 "[ . 1 . 2]" 1
771 1 70 VAL H 1 73 ARG H . . 5.800 4.968 4.927 5.025 . 0 0 "[ . 1 . 2]" 1
772 1 9 ILE HB 1 70 VAL HB . . 5.600 4.332 4.049 4.896 . 0 0 "[ . 1 . 2]" 1
773 1 70 VAL HA 1 73 ARG HG2 . . 3.500 2.146 2.004 2.927 . 0 0 "[ . 1 . 2]" 1
774 1 67 GLU HA 1 71 LYS H . . 5.000 3.933 3.870 3.991 . 0 0 "[ . 1 . 2]" 1
775 1 67 GLU HB2 1 71 LYS H . . 5.800 4.908 4.856 4.970 . 0 0 "[ . 1 . 2]" 1
776 1 68 ARG HA 1 71 LYS H . . 4.800 3.825 3.767 3.905 . 0 0 "[ . 1 . 2]" 1
777 1 68 ARG H 1 71 LYS H . . 5.800 4.812 4.747 4.933 . 0 0 "[ . 1 . 2]" 1
778 1 69 MET HA 1 71 LYS H . . 5.200 4.378 4.216 4.463 . 0 0 "[ . 1 . 2]" 1
779 1 70 VAL HA 1 71 LYS H . . 4.500 3.542 3.525 3.550 . 0 0 "[ . 1 . 2]" 1
780 1 70 VAL HB 1 71 LYS H . . 3.600 2.566 2.504 2.684 . 0 0 "[ . 1 . 2]" 1
781 1 70 VAL MG1 1 71 LYS H . . 4.800 3.434 3.360 3.567 . 0 0 "[ . 1 . 2]" 1
782 1 71 LYS H 1 71 LYS HB2 . . 4.000 2.478 2.281 2.647 . 0 0 "[ . 1 . 2]" 1
783 1 71 LYS H 1 71 LYS HB3 . . 3.500 2.581 2.402 2.802 . 0 0 "[ . 1 . 2]" 1
784 1 71 LYS H 1 71 LYS HD2 . . 5.500 4.644 4.390 4.858 . 0 0 "[ . 1 . 2]" 1
785 1 71 LYS H 1 71 LYS HG3 . . 5.500 4.550 4.452 4.624 . 0 0 "[ . 1 . 2]" 1
786 1 71 LYS H 1 71 LYS HE2 . . 5.800 5.274 4.772 5.666 . 0 0 "[ . 1 . 2]" 1
787 1 71 LYS H 1 72 SER H . . 3.800 2.598 2.519 2.644 . 0 0 "[ . 1 . 2]" 1
788 1 71 LYS HA 1 74 MET HB2 . . 3.600 2.600 2.239 2.839 . 0 0 "[ . 1 . 2]" 1
789 1 68 ARG HA 1 72 SER H . . 5.200 4.602 4.352 4.847 . 0 0 "[ . 1 . 2]" 1
790 1 68 ARG HG2 1 72 SER H . . 5.800 5.090 4.752 5.680 . 0 0 "[ . 1 . 2]" 1
791 1 69 MET HA 1 72 SER H . . 4.300 3.345 3.284 3.398 . 0 0 "[ . 1 . 2]" 1
792 1 70 VAL HA 1 72 SER H . . 5.100 4.156 4.033 4.320 . 0 0 "[ . 1 . 2]" 1
793 1 70 VAL H 1 72 SER H . . 5.100 4.084 3.992 4.163 . 0 0 "[ . 1 . 2]" 1
794 1 71 LYS HA 1 72 SER H . . 4.500 3.491 3.476 3.518 . 0 0 "[ . 1 . 2]" 1
795 1 71 LYS HB3 1 72 SER H . . 3.900 2.858 2.729 2.927 . 0 0 "[ . 1 . 2]" 1
796 1 71 LYS HG2 1 72 SER H . . 5.400 4.534 4.176 4.862 . 0 0 "[ . 1 . 2]" 1
797 1 71 LYS HD2 1 72 SER H . . 4.200 3.694 3.241 4.079 . 0 0 "[ . 1 . 2]" 1
798 1 71 LYS HE3 1 72 SER H . . 4.600 4.405 3.991 4.597 . 0 0 "[ . 1 . 2]" 1
799 1 72 SER H 1 72 SER HB2 . . 3.100 2.297 2.081 2.610 . 0 0 "[ . 1 . 2]" 1
800 1 72 SER H 1 72 SER HB3 . . 4.200 3.180 2.566 3.608 . 0 0 "[ . 1 . 2]" 1
801 1 72 SER H 1 75 ALA H . . 5.700 4.503 4.384 4.676 . 0 0 "[ . 1 . 2]" 1
802 1 72 SER HA 1 75 ALA MB . . 4.000 2.611 2.279 2.906 . 0 0 "[ . 1 . 2]" 1
803 1 69 MET HA 1 73 ARG H . . 5.100 4.151 4.060 4.238 . 0 0 "[ . 1 . 2]" 1
804 1 69 MET HG3 1 73 ARG H . . 4.900 4.018 3.658 4.182 . 0 0 "[ . 1 . 2]" 1
805 1 70 VAL HA 1 73 ARG H . . 4.700 3.675 3.575 3.833 . 0 0 "[ . 1 . 2]" 1
806 1 71 LYS HA 1 73 ARG H . . 5.900 4.852 4.692 4.992 . 0 0 "[ . 1 . 2]" 1
807 1 71 LYS H 1 73 ARG H . . 5.600 4.517 4.430 4.577 . 0 0 "[ . 1 . 2]" 1
808 1 72 SER HA 1 73 ARG H . . 4.500 3.566 3.561 3.569 . 0 0 "[ . 1 . 2]" 1
809 1 72 SER HB3 1 73 ARG H . . 3.700 2.722 2.235 3.506 . 0 0 "[ . 1 . 2]" 1
810 1 72 SER HB2 1 73 ARG H . . 3.700 2.978 2.207 3.679 . 0 0 "[ . 1 . 2]" 1
811 1 72 SER H 1 73 ARG H . . 3.800 2.697 2.647 2.782 . 0 0 "[ . 1 . 2]" 1
812 1 73 ARG H 1 73 ARG HB3 . . 3.800 2.635 2.590 2.688 . 0 0 "[ . 1 . 2]" 1
813 1 73 ARG H 1 73 ARG HD2 . . 5.400 4.341 3.991 4.604 . 0 0 "[ . 1 . 2]" 1
814 1 73 ARG H 1 73 ARG HG2 . . 3.300 2.025 1.948 3.122 . 0 0 "[ . 1 . 2]" 1
815 1 73 ARG H 1 73 ARG HG3 . . 3.600 3.092 1.952 3.311 . 0 0 "[ . 1 . 2]" 1
816 1 73 ARG H 1 73 ARG HE . . 5.600 4.358 3.330 5.403 . 0 0 "[ . 1 . 2]" 1
817 1 73 ARG H 1 75 ALA H . . 5.200 4.053 3.984 4.125 . 0 0 "[ . 1 . 2]" 1
818 1 69 MET HG3 1 73 ARG HG2 . . 3.600 3.525 3.243 3.599 . 0 0 "[ . 1 . 2]" 1
819 1 70 VAL HA 1 74 MET H . . 4.800 3.915 3.641 4.059 . 0 0 "[ . 1 . 2]" 1
820 1 71 LYS HA 1 74 MET H . . 4.800 3.698 3.500 3.912 . 0 0 "[ . 1 . 2]" 1
821 1 71 LYS H 1 74 MET H . . 5.700 4.771 4.659 4.876 . 0 0 "[ . 1 . 2]" 1
822 1 72 SER HA 1 74 MET H . . 5.200 4.480 4.354 4.609 . 0 0 "[ . 1 . 2]" 1
823 1 72 SER H 1 74 MET H . . 4.800 3.906 3.791 3.966 . 0 0 "[ . 1 . 2]" 1
824 1 73 ARG HA 1 74 MET H . . 4.500 3.529 3.512 3.547 . 0 0 "[ . 1 . 2]" 1
825 1 73 ARG HB2 1 74 MET H . . 4.700 3.654 3.543 3.756 . 0 0 "[ . 1 . 2]" 1
826 1 73 ARG HG3 1 74 MET H . . 3.200 2.178 2.099 2.329 . 0 0 "[ . 1 . 2]" 1
827 1 73 ARG HD3 1 74 MET H . . 5.400 4.518 2.816 4.793 . 0 0 "[ . 1 . 2]" 1
828 1 73 ARG H 1 74 MET H . . 3.800 2.680 2.553 2.759 . 0 0 "[ . 1 . 2]" 1
829 1 74 MET H 1 74 MET HB2 . . 3.200 2.337 2.231 2.455 . 0 0 "[ . 1 . 2]" 1
830 1 74 MET H 1 74 MET HG2 . . 3.800 2.584 2.295 2.904 . 0 0 "[ . 1 . 2]" 1
831 1 74 MET H 1 74 MET ME . . 5.000 4.202 3.501 4.614 . 0 0 "[ . 1 . 2]" 1
832 1 74 MET H 1 75 ALA H . . 3.800 2.557 2.503 2.649 . 0 0 "[ . 1 . 2]" 1
833 1 74 MET H 1 76 GLN H . . 5.300 4.237 4.122 4.333 . 0 0 "[ . 1 . 2]" 1
834 1 70 VAL MG1 1 74 MET HG2 . . 3.500 2.736 2.113 3.185 . 0 0 "[ . 1 . 2]" 1
835 1 70 VAL MG1 1 74 MET HG3 . . 3.800 2.387 1.979 2.647 . 0 0 "[ . 1 . 2]" 1
836 1 74 MET HA 1 77 LYS HB2 . . 4.000 2.874 2.601 3.477 . 0 0 "[ . 1 . 2]" 1
837 1 5 THR MG 1 75 ALA HA . . 7.000 5.101 4.152 6.468 . 0 0 "[ . 1 . 2]" 1
838 1 71 LYS HA 1 75 ALA H . . 5.200 3.954 3.790 4.301 . 0 0 "[ . 1 . 2]" 1
839 1 71 LYS HG2 1 75 ALA H . . 5.800 4.532 4.074 5.240 . 0 0 "[ . 1 . 2]" 1
840 1 72 SER HA 1 75 ALA H . . 4.600 3.539 3.444 3.781 . 0 0 "[ . 1 . 2]" 1
841 1 73 ARG HA 1 75 ALA H . . 5.000 4.249 4.097 4.395 . 0 0 "[ . 1 . 2]" 1
842 1 74 MET HA 1 75 ALA H . . 4.500 3.502 3.490 3.522 . 0 0 "[ . 1 . 2]" 1
843 1 74 MET HB2 1 75 ALA H . . 3.800 2.864 2.736 2.961 . 0 0 "[ . 1 . 2]" 1
844 1 74 MET HG2 1 75 ALA H . . 5.600 4.569 4.361 4.744 . 0 0 "[ . 1 . 2]" 1
845 1 75 ALA H 1 75 ALA MB . . 3.300 2.138 2.045 2.225 . 0 0 "[ . 1 . 2]" 1
846 1 75 ALA H 1 77 LYS H . . 5.400 4.334 4.235 4.444 . 0 0 "[ . 1 . 2]" 1
847 1 73 ARG HA 1 76 GLN H . . 4.700 3.807 3.652 3.922 . 0 0 "[ . 1 . 2]" 1
848 1 74 MET HA 1 76 GLN H . . 4.800 3.899 3.764 4.045 . 0 0 "[ . 1 . 2]" 1
849 1 74 MET HB2 1 76 GLN H . . 6.000 5.117 4.976 5.203 . 0 0 "[ . 1 . 2]" 1
850 1 75 ALA HA 1 76 GLN H . . 4.500 3.505 3.485 3.520 . 0 0 "[ . 1 . 2]" 1
851 1 75 ALA MB 1 76 GLN H . . 4.000 2.765 2.651 2.896 . 0 0 "[ . 1 . 2]" 1
852 1 75 ALA H 1 76 GLN H . . 3.800 2.765 2.731 2.790 . 0 0 "[ . 1 . 2]" 1
853 1 76 GLN H 1 76 GLN HB3 . . 3.400 2.438 2.379 2.561 . 0 0 "[ . 1 . 2]" 1
854 1 76 GLN H 1 76 GLN HG3 . . 5.400 4.386 4.352 4.420 . 0 0 "[ . 1 . 2]" 1
855 1 76 GLN H 1 77 LYS H . . 3.500 2.574 2.496 2.670 . 0 0 "[ . 1 . 2]" 1
856 1 76 GLN HB3 1 114 PRO HB3 . . 3.800 3.677 3.389 3.777 . 0 0 "[ . 1 . 2]" 1
857 1 76 GLN HE21 1 112 GLU HG2 . . 4.200 3.174 2.432 3.889 . 0 0 "[ . 1 . 2]" 1
858 1 76 GLN HE22 1 112 GLU HG3 . . 5.200 4.583 3.869 5.097 . 0 0 "[ . 1 . 2]" 1
859 1 74 MET HA 1 77 LYS H . . 4.100 3.181 3.114 3.273 . 0 0 "[ . 1 . 2]" 1
860 1 74 MET HB3 1 77 LYS H . . 5.800 4.883 4.754 5.017 . 0 0 "[ . 1 . 2]" 1
861 1 75 ALA HA 1 77 LYS H . . 5.500 4.470 4.311 4.591 . 0 0 "[ . 1 . 2]" 1
862 1 76 GLN HA 1 77 LYS H . . 4.400 3.535 3.526 3.546 . 0 0 "[ . 1 . 2]" 1
863 1 76 GLN HB2 1 77 LYS H . . 4.800 3.922 3.826 3.968 . 0 0 "[ . 1 . 2]" 1
864 1 76 GLN HB3 1 77 LYS H . . 3.600 2.622 2.547 2.673 . 0 0 "[ . 1 . 2]" 1
865 1 76 GLN HG2 1 77 LYS H . . 4.800 4.551 4.178 4.778 . 0 0 "[ . 1 . 2]" 1
866 1 77 LYS H 1 77 LYS HB2 . . 3.100 2.154 2.116 2.331 . 0 0 "[ . 1 . 2]" 1
867 1 77 LYS H 1 77 LYS HD2 . . 4.200 3.221 2.531 4.100 . 0 0 "[ . 1 . 2]" 1
868 1 77 LYS H 1 77 LYS HG2 . . 5.500 4.399 4.146 4.669 . 0 0 "[ . 1 . 2]" 1
869 1 77 LYS H 1 77 LYS HE2 . . 5.600 4.974 3.946 5.504 . 0 0 "[ . 1 . 2]" 1
870 1 77 LYS HG2 1 143 MET ME . . 4.900 2.889 2.283 3.985 . 0 0 "[ . 1 . 2]" 1
871 1 77 LYS HG3 1 143 MET ME . . 4.600 3.016 2.124 3.798 . 0 0 "[ . 1 . 2]" 1
872 1 77 LYS HA 1 78 ASP H . . 3.200 2.279 2.230 2.318 . 0 0 "[ . 1 . 2]" 1
873 1 77 LYS HB3 1 78 ASP H . . 4.400 3.000 2.768 3.459 . 0 0 "[ . 1 . 2]" 1
874 1 77 LYS HG3 1 78 ASP H . . 3.600 3.126 1.991 3.524 . 0 0 "[ . 1 . 2]" 1
875 1 77 LYS HD2 1 78 ASP H . . 5.300 5.009 4.425 5.264 . 0 0 "[ . 1 . 2]" 1
876 1 77 LYS H 1 78 ASP H . . 5.600 4.609 4.591 4.620 . 0 0 "[ . 1 . 2]" 1
877 1 78 ASP HB3 1 79 SER H . . 3.800 2.307 2.059 2.877 . 0 0 "[ . 1 . 2]" 1
878 1 78 ASP H 1 79 SER H . . 5.400 4.403 4.387 4.428 . 0 0 "[ . 1 . 2]" 1
879 1 79 SER H 1 79 SER HB2 . . 3.200 2.537 2.073 3.164 . 0 0 "[ . 1 . 2]" 1
880 1 79 SER H 1 82 GLU H . . 5.400 4.547 4.371 4.626 . 0 0 "[ . 1 . 2]" 1
881 1 79 SER H 1 82 GLU HB2 . . 4.200 3.255 2.970 3.553 . 0 0 "[ . 1 . 2]" 1
882 1 4 LEU MD2 1 79 SER HA . . 3.800 3.299 2.813 3.663 . 0 0 "[ . 1 . 2]" 1
883 1 79 SER HB2 1 82 GLU HG3 . . 4.300 3.744 2.620 4.273 . 0 0 "[ . 1 . 2]" 1
884 1 79 SER HA 1 81 GLU H . . 5.400 4.384 4.301 4.479 . 0 0 "[ . 1 . 2]" 1
885 1 79 SER HB2 1 81 GLU H . . 5.200 3.690 2.733 4.520 . 0 0 "[ . 1 . 2]" 1
886 1 80 PRO HA 1 81 GLU H . . 4.500 3.549 3.536 3.561 . 0 0 "[ . 1 . 2]" 1
887 1 80 PRO HB2 1 81 GLU H . . 4.200 3.173 3.059 3.275 . 0 0 "[ . 1 . 2]" 1
888 1 80 PRO HG2 1 81 GLU H . . 3.200 2.184 2.064 2.296 . 0 0 "[ . 1 . 2]" 1
889 1 80 PRO HD2 1 81 GLU H . . 3.700 2.664 2.648 2.691 . 0 0 "[ . 1 . 2]" 1
890 1 81 GLU H 1 81 GLU HB2 . . 3.600 2.249 2.090 2.503 . 0 0 "[ . 1 . 2]" 1
891 1 81 GLU H 1 81 GLU HG3 . . 3.500 3.107 2.348 3.411 . 0 0 "[ . 1 . 2]" 1
892 1 81 GLU H 1 84 LEU H . . 5.800 4.734 4.639 4.831 . 0 0 "[ . 1 . 2]" 1
893 1 81 GLU HA 1 84 LEU HB2 . . 3.500 2.482 2.321 2.802 . 0 0 "[ . 1 . 2]" 1
894 1 79 SER HA 1 82 GLU H . . 5.600 4.740 4.675 4.844 . 0 0 "[ . 1 . 2]" 1
895 1 79 SER HB2 1 82 GLU H . . 4.100 2.850 2.199 3.427 . 0 0 "[ . 1 . 2]" 1
896 1 80 PRO HA 1 82 GLU H . . 5.600 4.586 4.505 4.760 . 0 0 "[ . 1 . 2]" 1
897 1 80 PRO HD2 1 82 GLU H . . 5.200 4.192 4.076 4.353 . 0 0 "[ . 1 . 2]" 1
898 1 81 GLU HA 1 82 GLU H . . 4.500 3.532 3.524 3.548 . 0 0 "[ . 1 . 2]" 1
899 1 81 GLU HB2 1 82 GLU H . . 3.600 2.791 2.600 2.979 . 0 0 "[ . 1 . 2]" 1
900 1 81 GLU HG3 1 82 GLU H . . 5.400 4.757 4.353 4.949 . 0 0 "[ . 1 . 2]" 1
901 1 81 GLU H 1 82 GLU H . . 3.800 2.551 2.469 2.624 . 0 0 "[ . 1 . 2]" 1
902 1 82 GLU H 1 82 GLU HB2 . . 3.100 2.102 2.062 2.203 . 0 0 "[ . 1 . 2]" 1
903 1 82 GLU H 1 82 GLU HG3 . . 4.400 3.657 3.018 4.379 . 0 0 "[ . 1 . 2]" 1
904 1 82 GLU H 1 83 VAL H . . 3.800 2.777 2.676 2.866 . 0 0 "[ . 1 . 2]" 1
905 1 82 GLU H 1 85 LYS H . . 5.800 4.871 4.762 4.951 . 0 0 "[ . 1 . 2]" 1
906 1 78 ASP HB3 1 82 GLU HB3 . . 4.600 3.011 2.609 3.452 . 0 0 "[ . 1 . 2]" 1
907 1 82 GLU HA 1 85 LYS HB3 . . 4.200 3.211 2.953 3.398 . 0 0 "[ . 1 . 2]" 1
908 1 79 SER HA 1 83 VAL H . . 6.200 5.311 5.115 5.507 . 0 0 "[ . 1 . 2]" 1
909 1 80 PRO HA 1 83 VAL H . . 4.800 3.893 3.698 4.152 . 0 0 "[ . 1 . 2]" 1
910 1 81 GLU HA 1 83 VAL H . . 5.300 4.620 4.456 4.768 . 0 0 "[ . 1 . 2]" 1
911 1 81 GLU H 1 83 VAL H . . 5.200 4.278 4.164 4.401 . 0 0 "[ . 1 . 2]" 1
912 1 82 GLU HA 1 83 VAL H . . 4.500 3.557 3.548 3.565 . 0 0 "[ . 1 . 2]" 1
913 1 82 GLU HB2 1 83 VAL H . . 4.000 3.021 2.593 3.438 . 0 0 "[ . 1 . 2]" 1
914 1 82 GLU HB3 1 83 VAL H . . 3.800 2.745 2.420 3.035 . 0 0 "[ . 1 . 2]" 1
915 1 83 VAL H 1 83 VAL HB . . 3.600 2.556 2.538 2.587 . 0 0 "[ . 1 . 2]" 1
916 1 83 VAL H 1 83 VAL MG2 . . 3.400 2.169 1.975 2.295 . 0 0 "[ . 1 . 2]" 1
917 1 83 VAL H 1 84 LEU H . . 3.600 2.665 2.616 2.745 . 0 0 "[ . 1 . 2]" 1
918 1 83 VAL H 1 86 ALA H . . 5.800 4.780 4.716 4.859 . 0 0 "[ . 1 . 2]" 1
919 1 83 VAL HA 1 86 ALA MB . . 3.600 2.529 2.298 2.905 . 0 0 "[ . 1 . 2]" 1
920 1 83 VAL HB 1 140 LYS HD2 . . 4.100 3.599 2.995 3.995 . 0 0 "[ . 1 . 2]" 1
921 1 80 PRO HA 1 84 LEU H . . 5.500 4.278 3.982 4.578 . 0 0 "[ . 1 . 2]" 1
922 1 81 GLU HA 1 84 LEU H . . 5.300 3.491 3.347 3.617 . 0 0 "[ . 1 . 2]" 1
923 1 82 GLU HA 1 84 LEU H . . 5.200 4.398 4.254 4.594 . 0 0 "[ . 1 . 2]" 1
924 1 82 GLU H 1 84 LEU H . . 5.000 4.057 3.973 4.143 . 0 0 "[ . 1 . 2]" 1
925 1 83 VAL HA 1 84 LEU H . . 4.500 3.524 3.508 3.546 . 0 0 "[ . 1 . 2]" 1
926 1 83 VAL HB 1 84 LEU H . . 3.800 2.688 2.540 2.788 . 0 0 "[ . 1 . 2]" 1
927 1 83 VAL MG1 1 84 LEU H . . 4.800 3.537 3.422 3.625 . 0 0 "[ . 1 . 2]" 1
928 1 84 LEU H 1 84 LEU HB2 . . 3.200 2.150 2.047 2.288 . 0 0 "[ . 1 . 2]" 1
929 1 84 LEU H 1 84 LEU HG . . 3.900 3.089 2.635 3.889 . 0 0 "[ . 1 . 2]" 1
930 1 84 LEU H 1 84 LEU MD1 . . 5.000 3.688 3.458 4.077 . 0 0 "[ . 1 . 2]" 1
931 1 84 LEU H 1 84 LEU MD2 . . 5.400 4.026 3.701 4.354 . 0 0 "[ . 1 . 2]" 1
932 1 84 LEU H 1 85 LYS H . . 3.800 2.770 2.652 2.849 . 0 0 "[ . 1 . 2]" 1
933 1 84 LEU H 1 86 ALA H . . 5.000 4.058 3.941 4.137 . 0 0 "[ . 1 . 2]" 1
934 1 84 LEU HA 1 87 PHE HB3 . . 4.000 3.383 3.016 3.918 . 0 0 "[ . 1 . 2]" 1
935 1 84 LEU HG 1 140 LYS HD3 . . 3.200 2.410 2.022 2.961 . 0 0 "[ . 1 . 2]" 1
936 1 84 LEU MD2 1 140 LYS HG2 . . 4.200 3.040 2.315 3.836 . 0 0 "[ . 1 . 2]" 1
937 1 81 GLU HA 1 85 LYS H . . 5.100 4.024 3.881 4.138 . 0 0 "[ . 1 . 2]" 1
938 1 81 GLU HB3 1 85 LYS H . . 5.800 4.862 4.691 5.020 . 0 0 "[ . 1 . 2]" 1
939 1 82 GLU HA 1 85 LYS H . . 4.700 3.732 3.542 3.833 . 0 0 "[ . 1 . 2]" 1
940 1 83 VAL HA 1 85 LYS H . . 5.800 4.685 4.590 4.814 . 0 0 "[ . 1 . 2]" 1
941 1 83 VAL H 1 85 LYS H . . 5.400 4.438 4.307 4.595 . 0 0 "[ . 1 . 2]" 1
942 1 84 LEU HA 1 85 LYS H . . 4.500 3.560 3.551 3.566 . 0 0 "[ . 1 . 2]" 1
943 1 84 LEU HB2 1 85 LYS H . . 3.500 2.700 2.490 3.208 . 0 0 "[ . 1 . 2]" 1
944 1 84 LEU MD1 1 85 LYS H . . 5.600 4.419 4.280 4.613 . 0 0 "[ . 1 . 2]" 1
945 1 84 LEU MD2 1 85 LYS H . . 5.800 4.459 4.003 4.641 . 0 0 "[ . 1 . 2]" 1
946 1 84 LEU HG 1 85 LYS H . . 5.700 4.768 4.554 4.981 . 0 0 "[ . 1 . 2]" 1
947 1 85 LYS H 1 85 LYS HB2 . . 3.600 2.516 2.330 2.645 . 0 0 "[ . 1 . 2]" 1
948 1 85 LYS H 1 85 LYS HB3 . . 3.500 2.532 2.405 2.731 . 0 0 "[ . 1 . 2]" 1
949 1 85 LYS H 1 85 LYS HE2 . . 5.700 4.846 4.390 5.340 . 0 0 "[ . 1 . 2]" 1
950 1 85 LYS H 1 85 LYS HD2 . . 5.500 4.520 4.264 4.717 . 0 0 "[ . 1 . 2]" 1
951 1 85 LYS H 1 85 LYS HG3 . . 5.600 4.567 4.473 4.622 . 0 0 "[ . 1 . 2]" 1
952 1 85 LYS H 1 88 GLN H . . 5.800 4.841 4.790 4.900 . 0 0 "[ . 1 . 2]" 1
953 1 82 GLU HG2 1 85 LYS HE2 . . 5.000 4.384 3.784 4.838 . 0 0 "[ . 1 . 2]" 1
954 1 82 GLU HA 1 86 ALA H . . 5.100 4.136 4.064 4.219 . 0 0 "[ . 1 . 2]" 1
955 1 82 GLU HG2 1 86 ALA H . . 6.200 5.527 4.897 6.025 . 0 0 "[ . 1 . 2]" 1
956 1 83 VAL HA 1 86 ALA H . . 4.600 3.549 3.488 3.651 . 0 0 "[ . 1 . 2]" 1
957 1 84 LEU HA 1 86 ALA H . . 5.200 4.484 4.389 4.569 . 0 0 "[ . 1 . 2]" 1
958 1 85 LYS HA 1 86 ALA H . . 4.500 3.534 3.517 3.543 . 0 0 "[ . 1 . 2]" 1
959 1 85 LYS HB3 1 86 ALA H . . 3.600 2.620 2.535 2.716 . 0 0 "[ . 1 . 2]" 1
960 1 85 LYS HG2 1 86 ALA H . . 5.300 4.311 3.981 4.637 . 0 0 "[ . 1 . 2]" 1
961 1 85 LYS HE2 1 86 ALA H . . 5.500 4.746 4.167 5.217 . 0 0 "[ . 1 . 2]" 1
962 1 85 LYS HD2 1 86 ALA H . . 4.100 3.269 2.877 3.571 . 0 0 "[ . 1 . 2]" 1
963 1 85 LYS H 1 86 ALA H . . 3.800 2.685 2.623 2.755 . 0 0 "[ . 1 . 2]" 1
964 1 86 ALA H 1 86 ALA MB . . 3.600 2.092 2.025 2.233 . 0 0 "[ . 1 . 2]" 1
965 1 86 ALA H 1 89 LEU H . . 5.800 4.811 4.709 4.878 . 0 0 "[ . 1 . 2]" 1
966 1 86 ALA HA 1 89 LEU HB3 . . 3.200 3.056 2.691 3.197 . 0 0 "[ . 1 . 2]" 1
967 1 83 VAL HA 1 87 PHE H . . 5.000 3.984 3.842 4.128 . 0 0 "[ . 1 . 2]" 1
968 1 83 VAL MG1 1 87 PHE H . . 5.500 3.848 3.702 3.966 . 0 0 "[ . 1 . 2]" 1
969 1 84 LEU HA 1 87 PHE H . . 4.800 3.724 3.570 3.872 . 0 0 "[ . 1 . 2]" 1
970 1 84 LEU H 1 87 PHE H . . 5.700 4.808 4.680 4.909 . 0 0 "[ . 1 . 2]" 1
971 1 85 LYS HA 1 87 PHE H . . 5.500 4.601 4.474 4.738 . 0 0 "[ . 1 . 2]" 1
972 1 85 LYS H 1 87 PHE H . . 5.300 4.378 4.210 4.533 . 0 0 "[ . 1 . 2]" 1
973 1 86 ALA HA 1 87 PHE H . . 4.500 3.559 3.547 3.569 . 0 0 "[ . 1 . 2]" 1
974 1 86 ALA MB 1 87 PHE H . . 3.600 2.474 2.293 2.628 . 0 0 "[ . 1 . 2]" 1
975 1 86 ALA H 1 87 PHE H . . 3.800 2.786 2.673 2.890 . 0 0 "[ . 1 . 2]" 1
976 1 87 PHE H 1 87 PHE HB2 . . 3.600 2.380 2.099 2.650 . 0 0 "[ . 1 . 2]" 1
977 1 87 PHE H 1 87 PHE HB3 . . 3.400 2.722 2.417 3.401 0.001 2 0 "[ . 1 . 2]" 1
978 1 87 PHE H 1 88 GLN H . . 3.800 2.733 2.662 2.804 . 0 0 "[ . 1 . 2]" 1
979 1 87 PHE H 1 89 LEU H . . 5.200 4.241 4.095 4.367 . 0 0 "[ . 1 . 2]" 1
980 1 87 PHE HA 1 90 PHE HB2 . . 4.100 2.702 2.458 3.250 . 0 0 "[ . 1 . 2]" 1
981 1 87 PHE HB2 1 136 PHE HB3 . . 5.100 4.528 3.915 5.096 . 0 0 "[ . 1 . 2]" 1
982 1 84 LEU HA 1 88 GLN H . . 5.200 4.111 3.964 4.226 . 0 0 "[ . 1 . 2]" 1
983 1 84 LEU HB3 1 88 GLN H . . 6.000 5.091 4.984 5.227 . 0 0 "[ . 1 . 2]" 1
984 1 84 LEU MD2 1 88 GLN H . . 6.000 4.609 3.786 5.064 . 0 0 "[ . 1 . 2]" 1
985 1 85 LYS HA 1 88 GLN H . . 4.500 3.600 3.469 3.743 . 0 0 "[ . 1 . 2]" 1
986 1 86 ALA HA 1 88 GLN H . . 5.600 4.674 4.520 4.846 . 0 0 "[ . 1 . 2]" 1
987 1 86 ALA H 1 88 GLN H . . 5.200 4.246 4.111 4.368 . 0 0 "[ . 1 . 2]" 1
988 1 87 PHE HA 1 88 GLN H . . 4.500 3.552 3.538 3.562 . 0 0 "[ . 1 . 2]" 1
989 1 87 PHE HB3 1 88 GLN H . . 3.500 2.495 2.348 2.889 . 0 0 "[ . 1 . 2]" 1
990 1 88 GLN H 1 88 GLN HB2 . . 3.500 2.241 2.062 2.519 . 0 0 "[ . 1 . 2]" 1
991 1 88 GLN H 1 88 GLN HB3 . . 3.500 2.900 2.525 3.314 . 0 0 "[ . 1 . 2]" 1
992 1 88 GLN H 1 88 GLN HG3 . . 5.500 4.149 3.623 4.526 . 0 0 "[ . 1 . 2]" 1
993 1 88 GLN H 1 89 LEU H . . 3.800 2.801 2.687 2.869 . 0 0 "[ . 1 . 2]" 1
994 1 85 LYS HA 1 89 LEU H . . 5.000 4.026 3.857 4.151 . 0 0 "[ . 1 . 2]" 1
995 1 85 LYS HG2 1 89 LEU H . . 5.200 4.240 3.999 4.684 . 0 0 "[ . 1 . 2]" 1
996 1 86 ALA HA 1 89 LEU H . . 4.800 3.730 3.563 3.866 . 0 0 "[ . 1 . 2]" 1
997 1 87 PHE HA 1 89 LEU H . . 5.500 4.460 4.357 4.553 . 0 0 "[ . 1 . 2]" 1
998 1 88 GLN HA 1 89 LEU H . . 4.500 3.546 3.531 3.557 . 0 0 "[ . 1 . 2]" 1
999 1 88 GLN HB3 1 89 LEU H . . 3.500 2.587 2.480 2.767 . 0 0 "[ . 1 . 2]" 1
1000 1 88 GLN HG2 1 89 LEU H . . 5.000 4.365 3.803 4.811 . 0 0 "[ . 1 . 2]" 1
1001 1 89 LEU H 1 89 LEU HB2 . . 3.400 2.549 2.357 2.714 . 0 0 "[ . 1 . 2]" 1
1002 1 89 LEU H 1 89 LEU HB3 . . 3.600 2.469 2.311 2.659 . 0 0 "[ . 1 . 2]" 1
1003 1 89 LEU H 1 89 LEU HG . . 5.400 4.443 4.338 4.483 . 0 0 "[ . 1 . 2]" 1
1004 1 89 LEU H 1 89 LEU MD1 . . 5.500 4.149 4.017 4.279 . 0 0 "[ . 1 . 2]" 1
1005 1 89 LEU H 1 89 LEU MD2 . . 5.500 4.160 3.917 4.253 . 0 0 "[ . 1 . 2]" 1
1006 1 89 LEU H 1 90 PHE H . . 3.800 2.674 2.580 2.740 . 0 0 "[ . 1 . 2]" 1
1007 1 85 LYS HG2 1 89 LEU HB2 . . 4.800 3.807 3.398 4.442 . 0 0 "[ . 1 . 2]" 1
1008 1 85 LYS HD3 1 89 LEU HB3 . . 5.000 4.632 3.781 4.994 . 0 0 "[ . 1 . 2]" 1
1009 1 86 ALA HA 1 90 PHE H . . 5.200 4.173 4.079 4.241 . 0 0 "[ . 1 . 2]" 1
1010 1 86 ALA MB 1 90 PHE H . . 6.000 4.659 4.604 4.714 . 0 0 "[ . 1 . 2]" 1
1011 1 87 PHE HA 1 90 PHE H . . 4.500 3.472 3.364 3.572 . 0 0 "[ . 1 . 2]" 1
1012 1 87 PHE H 1 90 PHE H . . 5.700 4.756 4.672 4.804 . 0 0 "[ . 1 . 2]" 1
1013 1 88 GLN HA 1 90 PHE H . . 5.400 4.591 4.364 4.706 . 0 0 "[ . 1 . 2]" 1
1014 1 88 GLN H 1 90 PHE H . . 5.200 4.257 4.179 4.321 . 0 0 "[ . 1 . 2]" 1
1015 1 89 LEU HA 1 90 PHE H . . 4.500 3.545 3.531 3.552 . 0 0 "[ . 1 . 2]" 1
1016 1 89 LEU HB3 1 90 PHE H . . 3.500 2.522 2.458 2.632 . 0 0 "[ . 1 . 2]" 1
1017 1 89 LEU MD2 1 90 PHE H . . 5.400 3.607 2.686 4.303 . 0 0 "[ . 1 . 2]" 1
1018 1 89 LEU HG 1 90 PHE H . . 5.100 3.964 3.297 4.622 . 0 0 "[ . 1 . 2]" 1
1019 1 90 PHE H 1 90 PHE HB2 . . 3.300 2.103 2.066 2.374 . 0 0 "[ . 1 . 2]" 1
1020 1 90 PHE HZ 1 106 VAL MG1 . . 3.500 2.613 2.122 3.249 . 0 0 "[ . 1 . 2]" 1
1021 1 87 PHE HA 1 91 ASP H . . 5.500 4.241 4.032 4.969 . 0 0 "[ . 1 . 2]" 1
1022 1 88 GLN HA 1 91 ASP H . . 4.600 3.598 3.476 3.719 . 0 0 "[ . 1 . 2]" 1
1023 1 88 GLN H 1 91 ASP H . . 5.800 4.808 4.683 5.145 . 0 0 "[ . 1 . 2]" 1
1024 1 89 LEU HA 1 91 ASP H . . 5.000 4.135 3.927 4.183 . 0 0 "[ . 1 . 2]" 1
1025 1 89 LEU HB3 1 91 ASP H . . 5.800 4.855 4.803 4.912 . 0 0 "[ . 1 . 2]" 1
1026 1 89 LEU H 1 91 ASP H . . 5.100 4.018 3.939 4.126 . 0 0 "[ . 1 . 2]" 1
1027 1 90 PHE HA 1 91 ASP H . . 4.500 3.499 3.490 3.506 . 0 0 "[ . 1 . 2]" 1
1028 1 90 PHE HB2 1 91 ASP H . . 4.800 3.355 3.103 3.922 . 0 0 "[ . 1 . 2]" 1
1029 1 90 PHE HB3 1 91 ASP H . . 4.000 3.099 2.843 3.314 . 0 0 "[ . 1 . 2]" 1
1030 1 90 PHE H 1 91 ASP H . . 3.800 2.671 2.607 2.735 . 0 0 "[ . 1 . 2]" 1
1031 1 91 ASP HA 1 92 LEU H . . 3.100 2.140 2.139 2.148 . 0 0 "[ . 1 . 2]" 1
1032 1 91 ASP HB2 1 92 LEU H . . 4.600 3.754 3.484 4.170 . 0 0 "[ . 1 . 2]" 1
1033 1 91 ASP HB3 1 92 LEU H . . 5.000 3.962 3.508 4.349 . 0 0 "[ . 1 . 2]" 1
1034 1 91 ASP H 1 92 LEU H . . 5.000 4.014 3.926 4.078 . 0 0 "[ . 1 . 2]" 1
1035 1 92 LEU H 1 92 LEU HB3 . . 3.300 2.653 2.545 2.730 . 0 0 "[ . 1 . 2]" 1
1036 1 92 LEU H 1 92 LEU HG . . 4.500 2.285 2.080 2.503 . 0 0 "[ . 1 . 2]" 1
1037 1 92 LEU H 1 92 LEU MD1 . . 5.600 3.796 3.630 3.904 . 0 0 "[ . 1 . 2]" 1
1038 1 92 LEU H 1 92 LEU MD2 . . 3.200 2.309 1.950 2.930 . 0 0 "[ . 1 . 2]" 1
1039 1 92 LEU H 1 93 ASP H . . 3.800 2.684 2.618 2.758 . 0 0 "[ . 1 . 2]" 1
1040 1 88 GLN HG2 1 92 LEU HA . . 4.400 3.656 3.078 4.358 . 0 0 "[ . 1 . 2]" 1
1041 1 91 ASP HA 1 93 ASP H . . 4.700 3.743 3.680 3.841 . 0 0 "[ . 1 . 2]" 1
1042 1 91 ASP HB2 1 93 ASP H . . 3.800 3.288 2.818 3.798 . 0 0 "[ . 1 . 2]" 1
1043 1 92 LEU HA 1 93 ASP H . . 4.500 3.506 3.498 3.526 . 0 0 "[ . 1 . 2]" 1
1044 1 92 LEU HB2 1 93 ASP H . . 5.000 3.712 3.568 3.835 . 0 0 "[ . 1 . 2]" 1
1045 1 92 LEU HG 1 93 ASP H . . 3.600 2.068 1.955 2.302 . 0 0 "[ . 1 . 2]" 1
1046 1 92 LEU MD1 1 93 ASP H . . 5.700 3.164 2.481 3.495 . 0 0 "[ . 1 . 2]" 1
1047 1 93 ASP H 1 93 ASP HB2 . . 3.500 2.316 2.225 2.684 . 0 0 "[ . 1 . 2]" 1
1048 1 93 ASP H 1 94 LYS H . . 5.500 4.512 4.482 4.543 . 0 0 "[ . 1 . 2]" 1
1049 1 93 ASP HB2 1 95 LYS HD2 . . 4.700 4.281 3.572 4.686 . 0 0 "[ . 1 . 2]" 1
1050 1 93 ASP HA 1 94 LYS H . . 3.500 2.530 2.476 2.574 . 0 0 "[ . 1 . 2]" 1
1051 1 93 ASP HB2 1 94 LYS H . . 4.200 3.644 3.204 3.838 . 0 0 "[ . 1 . 2]" 1
1052 1 93 ASP HB3 1 94 LYS H . . 3.200 2.265 2.139 2.537 . 0 0 "[ . 1 . 2]" 1
1053 1 94 LYS H 1 94 LYS HB3 . . 4.200 3.269 3.220 3.324 . 0 0 "[ . 1 . 2]" 1
1054 1 94 LYS H 1 94 LYS HG2 . . 3.200 2.135 1.982 2.314 . 0 0 "[ . 1 . 2]" 1
1055 1 94 LYS H 1 94 LYS HD3 . . 3.800 2.793 2.259 3.799 . 0 0 "[ . 1 . 2]" 1
1056 1 94 LYS H 1 94 LYS HE2 . . 3.600 2.969 2.118 3.569 . 0 0 "[ . 1 . 2]" 1
1057 1 94 LYS HB2 1 137 GLU HG3 . . 5.700 5.087 4.356 5.619 . 0 0 "[ . 1 . 2]" 1
1058 1 93 ASP HA 1 95 LYS H . . 6.200 5.216 5.153 5.369 . 0 0 "[ . 1 . 2]" 1
1059 1 93 ASP HB2 1 95 LYS H . . 5.000 4.456 3.668 4.985 . 0 0 "[ . 1 . 2]" 1
1060 1 93 ASP H 1 95 LYS H . . 6.200 5.294 5.136 5.469 . 0 0 "[ . 1 . 2]" 1
1061 1 94 LYS HA 1 95 LYS H . . 3.400 2.387 2.331 2.413 . 0 0 "[ . 1 . 2]" 1
1062 1 94 LYS HB2 1 95 LYS H . . 5.200 4.206 4.141 4.231 . 0 0 "[ . 1 . 2]" 1
1063 1 94 LYS HG2 1 95 LYS H . . 5.400 4.503 4.455 4.564 . 0 0 "[ . 1 . 2]" 1
1064 1 94 LYS H 1 95 LYS H . . 4.500 3.514 3.430 3.628 . 0 0 "[ . 1 . 2]" 1
1065 1 95 LYS H 1 95 LYS HB3 . . 3.700 2.716 2.658 2.760 . 0 0 "[ . 1 . 2]" 1
1066 1 95 LYS H 1 95 LYS HG2 . . 3.000 2.052 1.966 2.165 . 0 0 "[ . 1 . 2]" 1
1067 1 95 LYS H 1 95 LYS HD2 . . 3.700 3.071 2.452 3.670 . 0 0 "[ . 1 . 2]" 1
1068 1 95 LYS H 1 95 LYS HE3 . . 5.500 4.807 4.292 5.240 . 0 0 "[ . 1 . 2]" 1
1069 1 95 LYS HB2 1 97 LYS HB2 . . 3.800 3.015 2.749 3.301 . 0 0 "[ . 1 . 2]" 1
1070 1 91 ASP HB2 1 95 LYS HD3 . . 5.100 3.873 3.287 4.527 . 0 0 "[ . 1 . 2]" 1
1071 1 94 LYS HA 1 96 GLY H . . 4.500 3.420 3.368 3.496 . 0 0 "[ . 1 . 2]" 1
1072 1 94 LYS HB2 1 96 GLY H . . 5.400 4.362 4.141 4.576 . 0 0 "[ . 1 . 2]" 1
1073 1 95 LYS HA 1 96 GLY H . . 4.500 3.508 3.498 3.524 . 0 0 "[ . 1 . 2]" 1
1074 1 95 LYS HB2 1 96 GLY H . . 4.700 3.777 3.707 3.849 . 0 0 "[ . 1 . 2]" 1
1075 1 95 LYS HD3 1 96 GLY H . . 5.200 4.169 3.936 4.345 . 0 0 "[ . 1 . 2]" 1
1076 1 95 LYS HG2 1 96 GLY H . . 3.200 2.001 1.952 2.089 . 0 0 "[ . 1 . 2]" 1
1077 1 95 LYS H 1 96 GLY H . . 3.500 2.482 2.408 2.540 . 0 0 "[ . 1 . 2]" 1
1078 1 96 GLY HA2 1 98 ILE MD . . 4.100 2.783 2.603 2.957 . 0 0 "[ . 1 . 2]" 1
1079 1 96 GLY HA2 1 135 SER HB2 . . 4.300 3.941 3.324 4.300 . 0 0 "[ . 1 . 2]" 1
1080 1 95 LYS HA 1 97 LYS H . . 5.300 4.321 4.259 4.408 . 0 0 "[ . 1 . 2]" 1
1081 1 95 LYS HB2 1 97 LYS H . . 4.000 3.065 2.989 3.221 . 0 0 "[ . 1 . 2]" 1
1082 1 95 LYS HG3 1 97 LYS H . . 3.200 2.056 1.950 2.256 . 0 0 "[ . 1 . 2]" 1
1083 1 95 LYS HD3 1 97 LYS H . . 5.200 4.400 4.075 4.668 . 0 0 "[ . 1 . 2]" 1
1084 1 95 LYS H 1 97 LYS H . . 5.300 4.223 4.159 4.283 . 0 0 "[ . 1 . 2]" 1
1085 1 96 GLY HA2 1 97 LYS H . . 4.100 3.117 3.116 3.117 . 0 0 "[ . 1 . 2]" 1
1086 1 96 GLY HA3 1 97 LYS H . . 4.400 3.407 3.406 3.407 . 0 0 "[ . 1 . 2]" 1
1087 1 96 GLY H 1 97 LYS H . . 3.500 2.560 2.500 2.604 . 0 0 "[ . 1 . 2]" 1
1088 1 97 LYS H 1 97 LYS HB2 . . 3.400 2.552 2.350 2.738 . 0 0 "[ . 1 . 2]" 1
1089 1 97 LYS H 1 97 LYS HG3 . . 4.400 3.217 2.573 4.317 . 0 0 "[ . 1 . 2]" 1
1090 1 97 LYS H 1 97 LYS HD2 . . 5.600 4.816 3.280 5.373 . 0 0 "[ . 1 . 2]" 1
1091 1 97 LYS H 1 97 LYS HE2 . . 5.200 4.707 3.742 5.175 . 0 0 "[ . 1 . 2]" 1
1092 1 97 LYS H 1 98 ILE H . . 5.000 4.042 3.922 4.151 . 0 0 "[ . 1 . 2]" 1
1093 1 97 LYS HA 1 133 GLU HB3 . . 4.000 3.346 2.733 3.677 . 0 0 "[ . 1 . 2]" 1
1094 1 97 LYS HA 1 98 ILE H . . 3.200 2.190 2.156 2.215 . 0 0 "[ . 1 . 2]" 1
1095 1 97 LYS HB3 1 98 ILE H . . 4.800 3.884 3.704 4.080 . 0 0 "[ . 1 . 2]" 1
1096 1 97 LYS HG2 1 98 ILE H . . 5.400 4.666 4.030 5.211 . 0 0 "[ . 1 . 2]" 1
1097 1 98 ILE H 1 98 ILE HB . . 3.800 2.814 2.750 2.884 . 0 0 "[ . 1 . 2]" 1
1098 1 98 ILE H 1 98 ILE HG13 . . 4.200 3.439 3.282 3.610 . 0 0 "[ . 1 . 2]" 1
1099 1 98 ILE H 1 98 ILE MD . . 3.800 2.687 2.463 2.926 . 0 0 "[ . 1 . 2]" 1
1100 1 98 ILE H 1 99 SER H . . 5.200 4.276 4.211 4.345 . 0 0 "[ . 1 . 2]" 1
1101 1 98 ILE H 1 133 GLU HB3 . . 3.800 3.717 3.518 3.800 0.000 4 0 "[ . 1 . 2]" 1
1102 1 98 ILE HB 1 134 VAL HB . . 3.800 2.962 2.032 3.210 . 0 0 "[ . 1 . 2]" 1
1103 1 98 ILE H 1 134 VAL H . . 3.800 3.070 2.396 3.419 . 0 0 "[ . 1 . 2]" 1
1104 1 95 LYS HG3 1 98 ILE HG13 . . 4.800 4.011 3.724 4.225 . 0 0 "[ . 1 . 2]" 1
1105 1 98 ILE HA 1 99 SER H . . 3.200 2.157 2.145 2.178 . 0 0 "[ . 1 . 2]" 1
1106 1 98 ILE HB 1 99 SER H . . 5.000 4.108 4.026 4.184 . 0 0 "[ . 1 . 2]" 1
1107 1 98 ILE HG13 1 99 SER H . . 5.500 4.452 4.351 4.518 . 0 0 "[ . 1 . 2]" 1
1108 1 98 ILE MG 1 99 SER H . . 3.300 2.491 2.216 2.686 . 0 0 "[ . 1 . 2]" 1
1109 1 99 SER H 1 99 SER HB2 . . 3.600 2.529 2.096 3.430 . 0 0 "[ . 1 . 2]" 1
1110 1 99 SER H 1 100 PHE H . . 5.600 4.569 4.547 4.583 . 0 0 "[ . 1 . 2]" 1
1111 1 99 SER HA 1 133 GLU HA . . 4.500 4.351 4.093 4.500 . 0 0 "[ . 1 . 2]" 1
1112 1 99 SER HA 1 133 GLU HG2 . . 5.400 5.196 4.442 5.396 . 0 0 "[ . 1 . 2]" 1
1113 1 99 SER HA 1 100 PHE H . . 3.200 2.166 2.155 2.173 . 0 0 "[ . 1 . 2]" 1
1114 1 99 SER HB2 1 100 PHE H . . 4.800 4.107 3.350 4.391 . 0 0 "[ . 1 . 2]" 1
1115 1 99 SER HB3 1 100 PHE H . . 4.200 3.280 3.148 3.781 . 0 0 "[ . 1 . 2]" 1
1116 1 100 PHE H 1 100 PHE HB3 . . 3.500 2.493 2.455 2.557 . 0 0 "[ . 1 . 2]" 1
1117 1 100 PHE H 1 103 LEU H . . 5.800 4.986 4.871 5.070 . 0 0 "[ . 1 . 2]" 1
1118 1 100 PHE H 1 133 GLU HA . . 5.000 4.603 4.320 4.921 . 0 0 "[ . 1 . 2]" 1
1119 1 100 PHE HB3 1 134 VAL MG2 . . 3.800 2.343 1.949 2.793 . 0 0 "[ . 1 . 2]" 1
1120 1 100 PHE HB3 1 123 ILE MG . . 3.700 3.004 2.597 3.223 . 0 0 "[ . 1 . 2]" 1
1121 1 99 SER HA 1 101 ALA H . . 5.000 3.947 3.901 3.993 . 0 0 "[ . 1 . 2]" 1
1122 1 99 SER HB2 1 101 ALA H . . 4.600 3.801 2.709 4.405 . 0 0 "[ . 1 . 2]" 1
1123 1 99 SER HB3 1 101 ALA H . . 4.200 2.979 2.679 4.137 . 0 0 "[ . 1 . 2]" 1
1124 1 100 PHE HA 1 101 ALA H . . 4.500 3.514 3.510 3.522 . 0 0 "[ . 1 . 2]" 1
1125 1 100 PHE HB2 1 101 ALA H . . 4.700 3.808 3.757 3.854 . 0 0 "[ . 1 . 2]" 1
1126 1 100 PHE HB3 1 101 ALA H . . 4.900 3.949 3.928 3.996 . 0 0 "[ . 1 . 2]" 1
1127 1 100 PHE H 1 101 ALA H . . 3.800 2.742 2.685 2.787 . 0 0 "[ . 1 . 2]" 1
1128 1 101 ALA H 1 101 ALA MB . . 3.300 2.127 2.025 2.233 . 0 0 "[ . 1 . 2]" 1
1129 1 101 ALA H 1 102 ASN H . . 3.800 2.799 2.714 2.872 . 0 0 "[ . 1 . 2]" 1
1130 1 101 ALA H 1 103 LEU H . . 5.000 4.232 4.098 4.314 . 0 0 "[ . 1 . 2]" 1
1131 1 101 ALA HA 1 104 LYS HB3 . . 4.200 3.239 2.969 3.529 . 0 0 "[ . 1 . 2]" 1
1132 1 99 SER HA 1 102 ASN H . . 5.700 4.673 4.549 4.750 . 0 0 "[ . 1 . 2]" 1
1133 1 99 SER HB2 1 102 ASN H . . 3.400 2.757 2.254 3.340 . 0 0 "[ . 1 . 2]" 1
1134 1 99 SER H 1 102 ASN H . . 5.500 4.615 4.481 4.869 . 0 0 "[ . 1 . 2]" 1
1135 1 100 PHE HA 1 102 ASN H . . 5.800 4.645 4.446 4.790 . 0 0 "[ . 1 . 2]" 1
1136 1 100 PHE H 1 102 ASN H . . 5.600 4.543 4.433 4.642 . 0 0 "[ . 1 . 2]" 1
1137 1 101 ALA HA 1 102 ASN H . . 4.500 3.564 3.556 3.570 . 0 0 "[ . 1 . 2]" 1
1138 1 101 ALA MB 1 102 ASN H . . 3.400 2.446 2.280 2.569 . 0 0 "[ . 1 . 2]" 1
1139 1 102 ASN H 1 102 ASN HB2 . . 3.300 2.217 2.068 2.480 . 0 0 "[ . 1 . 2]" 1
1140 1 102 ASN H 1 103 LEU H . . 3.800 2.792 2.721 2.855 . 0 0 "[ . 1 . 2]" 1
1141 1 102 ASN H 1 105 GLU H . . 5.800 4.890 4.854 4.934 . 0 0 "[ . 1 . 2]" 1
1142 1 98 ILE MG 1 102 ASN HB2 . . 4.000 3.164 2.663 3.610 . 0 0 "[ . 1 . 2]" 1
1143 1 99 SER HB2 1 103 LEU H . . 5.000 4.407 3.948 4.863 . 0 0 "[ . 1 . 2]" 1
1144 1 100 PHE HA 1 103 LEU H . . 4.800 3.603 3.461 3.713 . 0 0 "[ . 1 . 2]" 1
1145 1 101 ALA HA 1 103 LEU H . . 5.500 4.604 4.497 4.680 . 0 0 "[ . 1 . 2]" 1
1146 1 102 ASN HA 1 103 LEU H . . 4.500 3.552 3.541 3.559 . 0 0 "[ . 1 . 2]" 1
1147 1 102 ASN HB2 1 103 LEU H . . 3.700 2.752 2.463 3.047 . 0 0 "[ . 1 . 2]" 1
1148 1 102 ASN HB3 1 103 LEU H . . 4.200 3.147 2.725 3.437 . 0 0 "[ . 1 . 2]" 1
1149 1 103 LEU H 1 103 LEU HB2 . . 3.500 2.417 2.068 2.705 . 0 0 "[ . 1 . 2]" 1
1150 1 103 LEU H 1 103 LEU HG . . 5.500 4.468 4.344 4.559 . 0 0 "[ . 1 . 2]" 1
1151 1 103 LEU H 1 103 LEU MD1 . . 5.200 3.929 3.276 4.302 . 0 0 "[ . 1 . 2]" 1
1152 1 103 LEU H 1 103 LEU MD2 . . 5.500 4.190 3.940 4.291 . 0 0 "[ . 1 . 2]" 1
1153 1 103 LEU H 1 105 GLU H . . 5.400 4.386 4.299 4.518 . 0 0 "[ . 1 . 2]" 1
1154 1 103 LEU MD2 1 134 VAL MG2 . . 3.500 2.990 2.698 3.201 . 0 0 "[ . 1 . 2]" 1
1155 1 100 PHE HA 1 104 LYS H . . 5.100 4.069 3.921 4.216 . 0 0 "[ . 1 . 2]" 1
1156 1 100 PHE HB2 1 104 LYS H . . 6.000 4.907 4.816 4.976 . 0 0 "[ . 1 . 2]" 1
1157 1 101 ALA HA 1 104 LYS H . . 4.600 3.654 3.584 3.728 . 0 0 "[ . 1 . 2]" 1
1158 1 101 ALA H 1 104 LYS H . . 5.800 4.792 4.748 4.862 . 0 0 "[ . 1 . 2]" 1
1159 1 102 ASN HA 1 104 LYS H . . 5.600 4.555 4.477 4.626 . 0 0 "[ . 1 . 2]" 1
1160 1 102 ASN H 1 104 LYS H . . 5.400 4.313 4.207 4.363 . 0 0 "[ . 1 . 2]" 1
1161 1 103 LEU HA 1 104 LYS H . . 4.500 3.552 3.543 3.557 . 0 0 "[ . 1 . 2]" 1
1162 1 103 LEU HB3 1 104 LYS H . . 3.400 2.476 2.378 2.605 . 0 0 "[ . 1 . 2]" 1
1163 1 103 LEU HG 1 104 LYS H . . 4.600 3.902 3.249 4.597 . 0 0 "[ . 1 . 2]" 1
1164 1 103 LEU MD2 1 104 LYS H . . 5.500 3.983 2.643 4.431 . 0 0 "[ . 1 . 2]" 1
1165 1 103 LEU H 1 104 LYS H . . 3.800 2.792 2.747 2.836 . 0 0 "[ . 1 . 2]" 1
1166 1 104 LYS H 1 104 LYS HB2 . . 3.400 2.287 2.145 2.564 . 0 0 "[ . 1 . 2]" 1
1167 1 104 LYS H 1 104 LYS HB3 . . 3.700 2.792 2.478 2.990 . 0 0 "[ . 1 . 2]" 1
1168 1 104 LYS H 1 104 LYS HE2 . . 5.600 4.914 4.537 5.595 . 0 0 "[ . 1 . 2]" 1
1169 1 104 LYS H 1 104 LYS HG2 . . 5.200 4.300 4.085 4.407 . 0 0 "[ . 1 . 2]" 1
1170 1 104 LYS H 1 104 LYS HD2 . . 5.800 4.829 4.375 5.024 . 0 0 "[ . 1 . 2]" 1
1171 1 104 LYS H 1 107 ALA H . . 5.800 4.774 4.720 4.810 . 0 0 "[ . 1 . 2]" 1
1172 1 104 LYS HA 1 119 LEU MD2 . . 4.600 3.680 3.321 4.151 . 0 0 "[ . 1 . 2]" 1
1173 1 104 LYS HG2 1 119 LEU HG . . 4.800 3.934 3.286 4.511 . 0 0 "[ . 1 . 2]" 1
1174 1 104 LYS HG3 1 119 LEU MD1 . . 4.200 2.709 2.237 3.239 . 0 0 "[ . 1 . 2]" 1
1175 1 101 ALA HA 1 105 GLU H . . 5.200 4.144 4.072 4.216 . 0 0 "[ . 1 . 2]" 1
1176 1 101 ALA MB 1 105 GLU H . . 6.000 4.608 4.559 4.655 . 0 0 "[ . 1 . 2]" 1
1177 1 102 ASN HA 1 105 GLU H . . 4.800 3.643 3.578 3.722 . 0 0 "[ . 1 . 2]" 1
1178 1 103 LEU HA 1 105 GLU H . . 5.700 4.695 4.608 4.849 . 0 0 "[ . 1 . 2]" 1
1179 1 104 LYS HA 1 105 GLU H . . 4.600 3.562 3.557 3.569 . 0 0 "[ . 1 . 2]" 1
1180 1 104 LYS HB3 1 105 GLU H . . 3.300 2.374 2.236 2.443 . 0 0 "[ . 1 . 2]" 1
1181 1 104 LYS HD2 1 105 GLU H . . 4.300 3.616 2.937 3.978 . 0 0 "[ . 1 . 2]" 1
1182 1 104 LYS HE2 1 105 GLU H . . 5.200 4.712 4.230 5.154 . 0 0 "[ . 1 . 2]" 1
1183 1 104 LYS H 1 105 GLU H . . 3.800 2.820 2.781 2.873 . 0 0 "[ . 1 . 2]" 1
1184 1 105 GLU H 1 105 GLU HB2 . . 3.600 2.406 2.204 2.570 . 0 0 "[ . 1 . 2]" 1
1185 1 105 GLU H 1 105 GLU HB3 . . 3.400 2.657 2.477 2.903 . 0 0 "[ . 1 . 2]" 1
1186 1 105 GLU H 1 105 GLU HG2 . . 5.400 4.542 4.424 4.647 . 0 0 "[ . 1 . 2]" 1
1187 1 105 GLU H 1 106 VAL H . . 3.800 2.861 2.796 2.912 . 0 0 "[ . 1 . 2]" 1
1188 1 105 GLU H 1 107 ALA H . . 5.200 4.221 4.144 4.285 . 0 0 "[ . 1 . 2]" 1
1189 1 102 ASN HA 1 106 VAL H . . 5.000 4.100 4.008 4.193 . 0 0 "[ . 1 . 2]" 1
1190 1 102 ASN HB3 1 106 VAL H . . 5.600 4.991 4.885 5.133 . 0 0 "[ . 1 . 2]" 1
1191 1 103 LEU HA 1 106 VAL H . . 4.800 3.709 3.600 3.805 . 0 0 "[ . 1 . 2]" 1
1192 1 103 LEU H 1 106 VAL H . . 5.800 4.889 4.838 4.935 . 0 0 "[ . 1 . 2]" 1
1193 1 104 LYS HA 1 106 VAL H . . 5.800 4.630 4.495 4.746 . 0 0 "[ . 1 . 2]" 1
1194 1 104 LYS H 1 106 VAL H . . 5.400 4.341 4.231 4.429 . 0 0 "[ . 1 . 2]" 1
1195 1 105 GLU HA 1 106 VAL H . . 4.500 3.558 3.547 3.565 . 0 0 "[ . 1 . 2]" 1
1196 1 105 GLU HB3 1 106 VAL H . . 3.400 2.399 2.322 2.526 . 0 0 "[ . 1 . 2]" 1
1197 1 105 GLU HG2 1 106 VAL H . . 4.200 3.817 3.426 4.135 . 0 0 "[ . 1 . 2]" 1
1198 1 106 VAL H 1 106 VAL HB . . 3.600 2.598 2.556 2.638 . 0 0 "[ . 1 . 2]" 1
1199 1 106 VAL H 1 106 VAL MG2 . . 3.400 2.158 2.088 2.242 . 0 0 "[ . 1 . 2]" 1
1200 1 106 VAL H 1 107 ALA H . . 3.800 2.757 2.683 2.805 . 0 0 "[ . 1 . 2]" 1
1201 1 106 VAL H 1 108 LYS H . . 5.600 4.455 4.347 4.577 . 0 0 "[ . 1 . 2]" 1
1202 1 106 VAL HA 1 109 LEU HB3 . . 3.600 2.746 2.480 3.026 . 0 0 "[ . 1 . 2]" 1
1203 1 106 VAL MG1 1 110 LEU HG . . 4.500 3.194 2.612 3.548 . 0 0 "[ . 1 . 2]" 1
1204 1 106 VAL MG1 1 110 LEU MD1 . . 5.200 3.052 1.988 3.431 . 0 0 "[ . 1 . 2]" 1
1205 1 103 LEU HA 1 107 ALA H . . 5.200 4.195 4.111 4.244 . 0 0 "[ . 1 . 2]" 1
1206 1 103 LEU HG 1 107 ALA H . . 5.600 4.540 4.229 5.087 . 0 0 "[ . 1 . 2]" 1
1207 1 104 LYS HA 1 107 ALA H . . 4.600 3.538 3.435 3.605 . 0 0 "[ . 1 . 2]" 1
1208 1 104 LYS HG2 1 107 ALA H . . 6.000 5.186 4.972 5.415 . 0 0 "[ . 1 . 2]" 1
1209 1 105 GLU HA 1 107 ALA H . . 5.200 4.445 4.348 4.574 . 0 0 "[ . 1 . 2]" 1
1210 1 106 VAL HA 1 107 ALA H . . 4.500 3.540 3.532 3.550 . 0 0 "[ . 1 . 2]" 1
1211 1 106 VAL HB 1 107 ALA H . . 3.600 2.580 2.507 2.636 . 0 0 "[ . 1 . 2]" 1
1212 1 106 VAL MG1 1 107 ALA H . . 4.800 3.483 3.382 3.547 . 0 0 "[ . 1 . 2]" 1
1213 1 107 ALA H 1 107 ALA MB . . 3.500 2.099 2.025 2.195 . 0 0 "[ . 1 . 2]" 1
1214 1 107 ALA H 1 110 LEU H . . 5.800 4.967 4.701 5.088 . 0 0 "[ . 1 . 2]" 1
1215 1 107 ALA HA 1 110 LEU HB2 . . 4.600 3.449 2.827 3.875 . 0 0 "[ . 1 . 2]" 1
1216 1 107 ALA HA 1 112 GLU HB3 . . 5.800 4.892 4.489 5.293 . 0 0 "[ . 1 . 2]" 1
1217 1 104 LYS HA 1 108 LYS H . . 5.200 4.155 4.040 4.249 . 0 0 "[ . 1 . 2]" 1
1218 1 104 LYS HG2 1 108 LYS H . . 5.300 4.525 4.055 5.162 . 0 0 "[ . 1 . 2]" 1
1219 1 105 GLU HA 1 108 LYS H . . 4.800 3.665 3.510 3.789 . 0 0 "[ . 1 . 2]" 1
1220 1 105 GLU H 1 108 LYS H . . 5.800 4.914 4.825 4.981 . 0 0 "[ . 1 . 2]" 1
1221 1 106 VAL HA 1 108 LYS H . . 5.800 4.699 4.587 4.853 . 0 0 "[ . 1 . 2]" 1
1222 1 107 ALA HA 1 108 LYS H . . 4.500 3.563 3.555 3.569 . 0 0 "[ . 1 . 2]" 1
1223 1 107 ALA MB 1 108 LYS H . . 3.300 2.466 2.226 2.575 . 0 0 "[ . 1 . 2]" 1
1224 1 107 ALA H 1 108 LYS H . . 3.800 2.808 2.690 2.889 . 0 0 "[ . 1 . 2]" 1
1225 1 108 LYS H 1 108 LYS HB2 . . 3.600 2.477 2.321 2.577 . 0 0 "[ . 1 . 2]" 1
1226 1 108 LYS H 1 108 LYS HG2 . . 3.100 2.222 2.026 2.538 . 0 0 "[ . 1 . 2]" 1
1227 1 108 LYS H 1 108 LYS HD3 . . 4.200 3.774 3.312 4.179 . 0 0 "[ . 1 . 2]" 1
1228 1 108 LYS H 1 108 LYS HE2 . . 5.600 5.196 4.612 5.567 . 0 0 "[ . 1 . 2]" 1
1229 1 108 LYS H 1 109 LEU H . . 3.800 2.635 2.599 2.702 . 0 0 "[ . 1 . 2]" 1
1230 1 104 LYS HD3 1 108 LYS HG3 . . 4.400 3.290 2.627 3.899 . 0 0 "[ . 1 . 2]" 1
1231 1 105 GLU HA 1 109 LEU H . . 5.200 4.191 4.118 4.294 . 0 0 "[ . 1 . 2]" 1
1232 1 105 GLU HG3 1 109 LEU H . . 5.800 4.902 4.195 5.793 . 0 0 "[ . 1 . 2]" 1
1233 1 106 VAL HA 1 109 LEU H . . 4.600 3.486 3.426 3.586 . 0 0 "[ . 1 . 2]" 1
1234 1 106 VAL H 1 109 LEU H . . 5.800 4.720 4.636 4.785 . 0 0 "[ . 1 . 2]" 1
1235 1 107 ALA HA 1 109 LEU H . . 5.200 4.276 4.178 4.464 . 0 0 "[ . 1 . 2]" 1
1236 1 108 LYS HA 1 109 LEU H . . 4.500 3.502 3.487 3.528 . 0 0 "[ . 1 . 2]" 1
1237 1 108 LYS HB2 1 109 LEU H . . 3.700 2.811 2.653 2.915 . 0 0 "[ . 1 . 2]" 1
1238 1 108 LYS HG2 1 109 LEU H . . 5.200 4.376 4.232 4.620 . 0 0 "[ . 1 . 2]" 1
1239 1 108 LYS HD2 1 109 LEU H . . 5.900 5.518 5.194 5.753 . 0 0 "[ . 1 . 2]" 1
1240 1 109 LEU H 1 109 LEU HB2 . . 3.600 2.411 2.229 2.671 . 0 0 "[ . 1 . 2]" 1
1241 1 109 LEU H 1 109 LEU HB3 . . 3.400 2.610 2.352 2.814 . 0 0 "[ . 1 . 2]" 1
1242 1 109 LEU H 1 109 LEU HG . . 5.400 4.476 4.427 4.544 . 0 0 "[ . 1 . 2]" 1
1243 1 109 LEU H 1 109 LEU MD1 . . 5.400 3.990 3.715 4.284 . 0 0 "[ . 1 . 2]" 1
1244 1 109 LEU H 1 109 LEU MD2 . . 5.600 4.209 3.971 4.309 . 0 0 "[ . 1 . 2]" 1
1245 1 109 LEU H 1 111 GLY H . . 5.100 4.042 4.003 4.086 . 0 0 "[ . 1 . 2]" 1
1246 1 105 GLU HG2 1 109 LEU HB2 . . 4.700 3.950 3.525 4.676 . 0 0 "[ . 1 . 2]" 1
1247 1 106 VAL HA 1 110 LEU H . . 5.200 4.594 4.114 4.832 . 0 0 "[ . 1 . 2]" 1
1248 1 106 VAL MG1 1 110 LEU H . . 5.700 4.402 4.025 4.637 . 0 0 "[ . 1 . 2]" 1
1249 1 107 ALA HA 1 110 LEU H . . 4.600 3.640 3.528 3.782 . 0 0 "[ . 1 . 2]" 1
1250 1 108 LYS HA 1 110 LEU H . . 5.000 3.989 3.871 4.186 . 0 0 "[ . 1 . 2]" 1
1251 1 108 LYS H 1 110 LEU H . . 5.200 4.177 4.048 4.245 . 0 0 "[ . 1 . 2]" 1
1252 1 109 LEU HA 1 110 LEU H . . 4.500 3.492 3.476 3.504 . 0 0 "[ . 1 . 2]" 1
1253 1 109 LEU HB3 1 110 LEU H . . 3.800 2.828 2.762 2.911 . 0 0 "[ . 1 . 2]" 1
1254 1 109 LEU HG 1 110 LEU H . . 4.600 4.336 3.895 4.539 . 0 0 "[ . 1 . 2]" 1
1255 1 109 LEU MD2 1 110 LEU H . . 5.800 4.130 3.374 4.583 . 0 0 "[ . 1 . 2]" 1
1256 1 109 LEU H 1 110 LEU H . . 3.800 2.643 2.577 2.696 . 0 0 "[ . 1 . 2]" 1
1257 1 110 LEU H 1 110 LEU HB2 . . 3.500 2.402 2.231 2.575 . 0 0 "[ . 1 . 2]" 1
1258 1 110 LEU H 1 110 LEU MD1 . . 5.200 3.527 3.210 3.728 . 0 0 "[ . 1 . 2]" 1
1259 1 110 LEU H 1 110 LEU MD2 . . 4.300 3.590 3.031 3.877 . 0 0 "[ . 1 . 2]" 1
1260 1 110 LEU H 1 110 LEU HG . . 3.400 2.440 2.126 2.828 . 0 0 "[ . 1 . 2]" 1
1261 1 110 LEU H 1 112 GLU H . . 5.000 3.833 3.782 3.896 . 0 0 "[ . 1 . 2]" 1
1262 1 108 LYS HA 1 111 GLY H . . 4.500 3.512 3.397 3.643 . 0 0 "[ . 1 . 2]" 1
1263 1 108 LYS HB3 1 111 GLY H . . 5.800 4.871 4.711 5.123 . 0 0 "[ . 1 . 2]" 1
1264 1 109 LEU HA 1 111 GLY H . . 4.600 3.656 3.612 3.702 . 0 0 "[ . 1 . 2]" 1
1265 1 109 LEU HG 1 111 GLY H . . 5.900 5.199 4.952 5.386 . 0 0 "[ . 1 . 2]" 1
1266 1 110 LEU HA 1 111 GLY H . . 4.400 3.394 3.394 3.395 . 0 0 "[ . 1 . 2]" 1
1267 1 110 LEU HB2 1 111 GLY H . . 4.200 3.221 3.199 3.277 . 0 0 "[ . 1 . 2]" 1
1268 1 110 LEU MD2 1 111 GLY H . . 5.800 4.826 4.598 4.945 . 0 0 "[ . 1 . 2]" 1
1269 1 110 LEU HG 1 111 GLY H . . 5.500 4.631 4.377 4.865 . 0 0 "[ . 1 . 2]" 1
1270 1 110 LEU H 1 111 GLY H . . 4.000 2.564 2.531 2.598 . 0 0 "[ . 1 . 2]" 1
1271 1 111 GLY H 1 112 GLU H . . 3.300 2.325 2.295 2.370 . 0 0 "[ . 1 . 2]" 1
1272 1 110 LEU HA 1 112 GLU H . . 5.800 4.725 4.688 4.755 . 0 0 "[ . 1 . 2]" 1
1273 1 110 LEU HB2 1 112 GLU H . . 4.000 3.040 2.876 3.237 . 0 0 "[ . 1 . 2]" 1
1274 1 111 GLY HA2 1 112 GLU H . . 4.100 3.070 3.068 3.074 . 0 0 "[ . 1 . 2]" 1
1275 1 111 GLY HA3 1 112 GLU H . . 4.400 3.437 3.435 3.439 . 0 0 "[ . 1 . 2]" 1
1276 1 112 GLU H 1 112 GLU HB2 . . 3.900 2.530 2.378 2.765 . 0 0 "[ . 1 . 2]" 1
1277 1 112 GLU H 1 112 GLU HB3 . . 3.500 2.803 2.576 3.033 . 0 0 "[ . 1 . 2]" 1
1278 1 110 LEU HB3 1 112 GLU HB2 . . 5.000 3.687 3.282 3.948 . 0 0 "[ . 1 . 2]" 1
1279 1 110 LEU HB2 1 112 GLU HB3 . . 4.500 3.942 3.552 4.270 . 0 0 "[ . 1 . 2]" 1
1280 1 112 GLU HG3 1 114 PRO HD3 . . 3.200 2.648 2.027 3.168 . 0 0 "[ . 1 . 2]" 1
1281 1 112 GLU HA 1 113 ASN H . . 3.200 2.173 2.163 2.180 . 0 0 "[ . 1 . 2]" 1
1282 1 112 GLU HB2 1 113 ASN H . . 5.000 4.322 4.212 4.406 . 0 0 "[ . 1 . 2]" 1
1283 1 112 GLU HG3 1 113 ASN H . . 3.600 2.614 2.378 2.825 . 0 0 "[ . 1 . 2]" 1
1284 1 113 ASN H 1 113 ASN HB2 . . 3.400 2.691 2.378 3.075 . 0 0 "[ . 1 . 2]" 1
1285 1 113 ASN H 1 113 ASN HB3 . . 3.600 3.079 2.632 3.596 . 0 0 "[ . 1 . 2]" 1
1286 1 108 LYS HD2 1 113 ASN HA . . 4.900 4.423 4.012 4.881 . 0 0 "[ . 1 . 2]" 1
1287 1 114 PRO HA 1 115 GLY H . . 3.500 2.459 2.440 2.468 . 0 0 "[ . 1 . 2]" 1
1288 1 114 PRO HB2 1 115 GLY H . . 3.500 2.481 2.459 2.527 . 0 0 "[ . 1 . 2]" 1
1289 1 114 PRO HG2 1 115 GLY H . . 5.200 4.321 4.303 4.358 . 0 0 "[ . 1 . 2]" 1
1290 1 115 GLY H 1 116 ASP H . . 5.600 4.594 4.582 4.604 . 0 0 "[ . 1 . 2]" 1
1291 1 115 GLY H 1 118 VAL HB . . 4.100 3.433 3.286 3.591 . 0 0 "[ . 1 . 2]" 1
1292 1 115 GLY HA2 1 116 ASP H . . 3.200 2.187 2.170 2.198 . 0 0 "[ . 1 . 2]" 1
1293 1 115 GLY HA3 1 116 ASP H . . 4.000 3.059 3.035 3.100 . 0 0 "[ . 1 . 2]" 1
1294 1 116 ASP H 1 116 ASP HB2 . . 3.400 2.329 2.067 2.733 . 0 0 "[ . 1 . 2]" 1
1295 1 116 ASP H 1 116 ASP HB3 . . 3.800 3.261 2.344 3.593 . 0 0 "[ . 1 . 2]" 1
1296 1 116 ASP H 1 118 VAL H . . 5.400 4.286 4.266 4.314 . 0 0 "[ . 1 . 2]" 1
1297 1 116 ASP H 1 119 LEU H . . 5.900 4.953 4.933 4.988 . 0 0 "[ . 1 . 2]" 1
1298 1 114 PRO HG2 1 116 ASP HA . . 6.200 5.244 5.166 5.310 . 0 0 "[ . 1 . 2]" 1
1299 1 116 ASP HA 1 119 LEU HB3 . . 4.100 3.478 3.337 3.693 . 0 0 "[ . 1 . 2]" 1
1300 1 115 GLY HA3 1 117 ASP H . . 4.300 3.491 3.432 3.545 . 0 0 "[ . 1 . 2]" 1
1301 1 116 ASP HA 1 117 ASP H . . 4.500 3.519 3.509 3.524 . 0 0 "[ . 1 . 2]" 1
1302 1 116 ASP HB3 1 117 ASP H . . 3.900 3.223 2.680 3.823 . 0 0 "[ . 1 . 2]" 1
1303 1 116 ASP H 1 117 ASP H . . 3.800 2.769 2.719 2.792 . 0 0 "[ . 1 . 2]" 1
1304 1 117 ASP H 1 117 ASP HB3 . . 3.800 2.731 2.395 3.591 . 0 0 "[ . 1 . 2]" 1
1305 1 117 ASP H 1 118 VAL H . . 3.800 2.707 2.706 2.707 . 0 0 "[ . 1 . 2]" 1
1306 1 117 ASP H 1 119 LEU H . . 4.800 4.080 4.079 4.081 . 0 0 "[ . 1 . 2]" 1
1307 1 115 GLY HA3 1 118 VAL H . . 4.300 3.392 3.350 3.445 . 0 0 "[ . 1 . 2]" 1
1308 1 115 GLY H 1 118 VAL H . . 5.000 4.259 4.147 4.348 . 0 0 "[ . 1 . 2]" 1
1309 1 116 ASP HA 1 118 VAL H . . 5.500 4.151 4.125 4.165 . 0 0 "[ . 1 . 2]" 1
1310 1 116 ASP HB3 1 118 VAL H . . 6.300 5.253 5.027 5.563 . 0 0 "[ . 1 . 2]" 1
1311 1 117 ASP HA 1 118 VAL H . . 4.500 3.519 3.518 3.520 . 0 0 "[ . 1 . 2]" 1
1312 1 117 ASP HB2 1 118 VAL H . . 4.400 3.570 2.701 3.891 . 0 0 "[ . 1 . 2]" 1
1313 1 118 VAL H 1 118 VAL HB . . 3.700 2.574 2.525 2.629 . 0 0 "[ . 1 . 2]" 1
1314 1 118 VAL H 1 118 VAL MG2 . . 3.200 2.177 1.992 2.314 . 0 0 "[ . 1 . 2]" 1
1315 1 118 VAL H 1 120 GLN H . . 5.500 4.506 4.506 4.507 . 0 0 "[ . 1 . 2]" 1
1316 1 76 GLN HG2 1 118 VAL MG1 . . 3.300 2.476 1.988 3.047 . 0 0 "[ . 1 . 2]" 1
1317 1 76 GLN HB3 1 118 VAL MG1 . . 3.700 3.128 2.598 3.555 . 0 0 "[ . 1 . 2]" 1
1318 1 118 VAL HA 1 121 GLU HB2 . . 3.800 2.642 2.638 2.643 . 0 0 "[ . 1 . 2]" 1
1319 1 115 GLY HA3 1 119 LEU H . . 5.600 5.137 5.077 5.212 . 0 0 "[ . 1 . 2]" 1
1320 1 115 GLY H 1 119 LEU H . . 5.800 5.362 5.254 5.484 . 0 0 "[ . 1 . 2]" 1
1321 1 116 ASP HA 1 119 LEU H . . 4.500 3.261 3.241 3.271 . 0 0 "[ . 1 . 2]" 1
1322 1 117 ASP HA 1 119 LEU H . . 5.200 4.172 4.171 4.174 . 0 0 "[ . 1 . 2]" 1
1323 1 118 VAL HA 1 119 LEU H . . 4.500 3.491 3.491 3.492 . 0 0 "[ . 1 . 2]" 1
1324 1 118 VAL HB 1 119 LEU H . . 3.800 2.859 2.856 2.865 . 0 0 "[ . 1 . 2]" 1
1325 1 118 VAL MG1 1 119 LEU H . . 5.000 3.723 3.658 3.779 . 0 0 "[ . 1 . 2]" 1
1326 1 118 VAL MG2 1 119 LEU H . . 5.100 3.855 3.784 3.912 . 0 0 "[ . 1 . 2]" 1
1327 1 118 VAL H 1 119 LEU H . . 3.800 2.537 2.536 2.538 . 0 0 "[ . 1 . 2]" 1
1328 1 119 LEU H 1 119 LEU HB2 . . 3.400 2.157 2.076 2.222 . 0 0 "[ . 1 . 2]" 1
1329 1 119 LEU H 1 119 LEU HG . . 5.500 4.526 4.392 4.577 . 0 0 "[ . 1 . 2]" 1
1330 1 119 LEU H 1 119 LEU MD1 . . 5.600 4.248 4.225 4.291 . 0 0 "[ . 1 . 2]" 1
1331 1 119 LEU H 1 119 LEU MD2 . . 4.800 3.453 3.117 3.682 . 0 0 "[ . 1 . 2]" 1
1332 1 119 LEU H 1 120 GLN H . . 3.800 2.710 2.709 2.711 . 0 0 "[ . 1 . 2]" 1
1333 1 116 ASP HA 1 120 GLN H . . 5.000 4.158 4.152 4.168 . 0 0 "[ . 1 . 2]" 1
1334 1 117 ASP HA 1 120 GLN H . . 4.600 3.751 3.750 3.753 . 0 0 "[ . 1 . 2]" 1
1335 1 117 ASP H 1 120 GLN H . . 5.800 5.043 5.043 5.044 . 0 0 "[ . 1 . 2]" 1
1336 1 118 VAL HA 1 120 GLN H . . 5.800 4.921 4.919 4.921 . 0 0 "[ . 1 . 2]" 1
1337 1 119 LEU HA 1 120 GLN H . . 4.500 3.569 3.568 3.569 . 0 0 "[ . 1 . 2]" 1
1338 1 119 LEU HB3 1 120 GLN H . . 3.300 2.301 2.240 2.425 . 0 0 "[ . 1 . 2]" 1
1339 1 119 LEU MD1 1 120 GLN H . . 4.300 3.647 3.432 3.938 . 0 0 "[ . 1 . 2]" 1
1340 1 119 LEU HG 1 120 GLN H . . 5.600 4.679 4.602 4.799 . 0 0 "[ . 1 . 2]" 1
1341 1 120 GLN H 1 120 GLN HB2 . . 3.400 2.706 2.705 2.707 . 0 0 "[ . 1 . 2]" 1
1342 1 120 GLN H 1 120 GLN HG2 . . 3.300 2.064 2.064 2.065 . 0 0 "[ . 1 . 2]" 1
1343 1 120 GLN H 1 123 ILE H . . 5.800 4.955 4.954 4.956 . 0 0 "[ . 1 . 2]" 1
1344 1 117 ASP HA 1 121 GLU H . . 5.000 3.782 3.782 3.783 . 0 0 "[ . 1 . 2]" 1
1345 1 118 VAL HA 1 121 GLU H . . 4.800 3.817 3.815 3.818 . 0 0 "[ . 1 . 2]" 1
1346 1 118 VAL H 1 121 GLU H . . 5.800 4.778 4.777 4.780 . 0 0 "[ . 1 . 2]" 1
1347 1 119 LEU HA 1 121 GLU H . . 5.400 4.630 4.629 4.631 . 0 0 "[ . 1 . 2]" 1
1348 1 119 LEU H 1 121 GLU H . . 5.000 3.971 3.970 3.972 . 0 0 "[ . 1 . 2]" 1
1349 1 120 GLN HA 1 121 GLU H . . 4.500 3.546 3.545 3.546 . 0 0 "[ . 1 . 2]" 1
1350 1 120 GLN HB2 1 121 GLU H . . 3.300 2.515 2.514 2.516 . 0 0 "[ . 1 . 2]" 1
1351 1 120 GLN HG2 1 121 GLU H . . 3.900 3.925 3.924 3.926 0.026 1 0 "[ . 1 . 2]" 1
1352 1 120 GLN H 1 121 GLU H . . 3.800 2.726 2.724 2.727 . 0 0 "[ . 1 . 2]" 1
1353 1 121 GLU H 1 121 GLU HB2 . . 3.300 2.337 2.334 2.341 . 0 0 "[ . 1 . 2]" 1
1354 1 121 GLU H 1 121 GLU HG3 . . 4.100 3.250 2.504 3.761 . 0 0 "[ . 1 . 2]" 1
1355 1 121 GLU H 1 123 ILE H . . 5.200 4.440 4.439 4.441 . 0 0 "[ . 1 . 2]" 1
1356 1 117 ASP HB2 1 121 GLU HG3 . . 4.600 3.642 3.102 4.590 . 0 0 "[ . 1 . 2]" 1
1357 1 121 GLU HA 1 124 ALA MB . . 3.400 2.469 2.371 2.595 . 0 0 "[ . 1 . 2]" 1
1358 1 118 VAL HA 1 122 MET H . . 4.800 3.650 3.649 3.653 . 0 0 "[ . 1 . 2]" 1
1359 1 118 VAL MG1 1 122 MET H . . 5.800 3.905 3.783 3.953 . 0 0 "[ . 1 . 2]" 1
1360 1 119 LEU HA 1 122 MET H . . 4.500 3.724 3.722 3.725 . 0 0 "[ . 1 . 2]" 1
1361 1 119 LEU H 1 122 MET H . . 5.600 4.501 4.500 4.502 . 0 0 "[ . 1 . 2]" 1
1362 1 120 GLN HA 1 122 MET H . . 5.700 4.578 4.569 4.581 . 0 0 "[ . 1 . 2]" 1
1363 1 120 GLN H 1 122 MET H . . 5.300 4.244 4.238 4.245 . 0 0 "[ . 1 . 2]" 1
1364 1 121 GLU HA 1 122 MET H . . 4.600 3.549 3.548 3.550 . 0 0 "[ . 1 . 2]" 1
1365 1 121 GLU HB2 1 122 MET H . . 3.600 2.594 2.591 2.600 . 0 0 "[ . 1 . 2]" 1
1366 1 121 GLU HG3 1 122 MET H . . 5.600 4.738 4.502 4.938 . 0 0 "[ . 1 . 2]" 1
1367 1 121 GLU H 1 122 MET H . . 3.800 2.709 2.707 2.710 . 0 0 "[ . 1 . 2]" 1
1368 1 122 MET H 1 122 MET HB2 . . 3.400 2.579 2.533 2.628 . 0 0 "[ . 1 . 2]" 1
1369 1 122 MET H 1 122 MET HB3 . . 3.800 2.467 2.421 2.511 . 0 0 "[ . 1 . 2]" 1
1370 1 122 MET H 1 122 MET HG3 . . 5.400 4.443 4.401 4.578 . 0 0 "[ . 1 . 2]" 1
1371 1 122 MET H 1 123 ILE H . . 3.800 2.875 2.870 2.876 . 0 0 "[ . 1 . 2]" 1
1372 1 122 MET H 1 125 GLU H . . 5.800 4.840 4.820 4.871 . 0 0 "[ . 1 . 2]" 1
1373 1 122 MET HA 1 139 PHE HE1 . . 4.200 2.778 2.023 4.134 . 0 0 "[ . 1 . 2]" 1
1374 1 119 LEU HA 1 123 ILE H . . 5.000 4.056 4.055 4.058 . 0 0 "[ . 1 . 2]" 1
1375 1 120 GLN HA 1 123 ILE H . . 4.800 3.798 3.794 3.800 . 0 0 "[ . 1 . 2]" 1
1376 1 121 GLU HA 1 123 ILE H . . 5.500 4.769 4.768 4.771 . 0 0 "[ . 1 . 2]" 1
1377 1 122 MET HA 1 123 ILE H . . 4.500 3.567 3.566 3.568 . 0 0 "[ . 1 . 2]" 1
1378 1 122 MET HB3 1 123 ILE H . . 3.500 2.343 2.319 2.370 . 0 0 "[ . 1 . 2]" 1
1379 1 122 MET HG2 1 123 ILE H . . 4.800 3.402 3.197 3.797 . 0 0 "[ . 1 . 2]" 1
1380 1 123 ILE H 1 123 ILE HB . . 3.500 2.558 2.557 2.559 . 0 0 "[ . 1 . 2]" 1
1381 1 123 ILE H 1 123 ILE HG12 . . 3.200 2.055 2.054 2.056 . 0 0 "[ . 1 . 2]" 1
1382 1 123 ILE H 1 123 ILE MD . . 4.700 3.233 3.206 3.266 . 0 0 "[ . 1 . 2]" 1
1383 1 123 ILE H 1 125 GLU H . . 5.300 4.376 4.330 4.437 . 0 0 "[ . 1 . 2]" 1
1384 1 119 LEU MD1 1 123 ILE HG12 . . 3.300 2.519 2.322 2.829 . 0 0 "[ . 1 . 2]" 1
1385 1 120 GLN HA 1 123 ILE HB . . 4.200 3.136 3.134 3.137 . 0 0 "[ . 1 . 2]" 1
1386 1 120 GLN HA 1 124 ALA H . . 5.200 4.121 4.120 4.123 . 0 0 "[ . 1 . 2]" 1
1387 1 120 GLN HB3 1 124 ALA H . . 6.000 5.202 5.201 5.204 . 0 0 "[ . 1 . 2]" 1
1388 1 121 GLU HA 1 124 ALA H . . 4.500 3.534 3.532 3.536 . 0 0 "[ . 1 . 2]" 1
1389 1 121 GLU H 1 124 ALA H . . 5.600 4.709 4.708 4.710 . 0 0 "[ . 1 . 2]" 1
1390 1 122 MET HA 1 124 ALA H . . 5.600 4.388 4.385 4.391 . 0 0 "[ . 1 . 2]" 1
1391 1 122 MET H 1 124 ALA H . . 5.200 4.064 4.059 4.066 . 0 0 "[ . 1 . 2]" 1
1392 1 123 ILE HA 1 124 ALA H . . 4.500 3.526 3.525 3.526 . 0 0 "[ . 1 . 2]" 1
1393 1 123 ILE HB 1 124 ALA H . . 3.600 2.684 2.682 2.687 . 0 0 "[ . 1 . 2]" 1
1394 1 123 ILE MG 1 124 ALA H . . 4.600 3.526 3.490 3.557 . 0 0 "[ . 1 . 2]" 1
1395 1 123 ILE H 1 124 ALA H . . 3.800 2.714 2.713 2.715 . 0 0 "[ . 1 . 2]" 1
1396 1 124 ALA H 1 124 ALA MB . . 3.400 2.151 2.025 2.233 . 0 0 "[ . 1 . 2]" 1
1397 1 124 ALA H 1 125 GLU H . . 3.800 2.747 2.721 2.779 . 0 0 "[ . 1 . 2]" 1
1398 1 124 ALA HA 1 127 ASP HB3 . . 4.000 2.920 2.561 3.849 . 0 0 "[ . 1 . 2]" 1
1399 1 121 GLU HA 1 125 GLU H . . 5.200 4.155 4.114 4.176 . 0 0 "[ . 1 . 2]" 1
1400 1 121 GLU HB3 1 125 GLU H . . 5.800 4.974 4.936 4.996 . 0 0 "[ . 1 . 2]" 1
1401 1 122 MET HA 1 125 GLU H . . 4.800 3.639 3.609 3.675 . 0 0 "[ . 1 . 2]" 1
1402 1 123 ILE HA 1 125 GLU H . . 5.400 4.489 4.429 4.577 . 0 0 "[ . 1 . 2]" 1
1403 1 124 ALA HA 1 125 GLU H . . 4.500 3.553 3.547 3.559 . 0 0 "[ . 1 . 2]" 1
1404 1 124 ALA MB 1 125 GLU H . . 4.000 2.509 2.382 2.653 . 0 0 "[ . 1 . 2]" 1
1405 1 125 GLU H 1 125 GLU HB2 . . 3.400 2.247 2.095 2.486 . 0 0 "[ . 1 . 2]" 1
1406 1 125 GLU H 1 125 GLU HG2 . . 3.600 3.003 2.246 3.516 . 0 0 "[ . 1 . 2]" 1
1407 1 125 GLU H 1 126 ALA H . . 3.800 2.743 2.703 2.788 . 0 0 "[ . 1 . 2]" 1
1408 1 125 GLU H 1 127 ASP H . . 5.000 3.853 3.800 3.953 . 0 0 "[ . 1 . 2]" 1
1409 1 125 GLU HB3 1 142 VAL MG2 . . 5.800 4.320 2.981 5.227 . 0 0 "[ . 1 . 2]" 1
1410 1 121 GLU HB3 1 125 GLU HG3 . . 5.000 4.376 3.745 4.939 . 0 0 "[ . 1 . 2]" 1
1411 1 122 MET HA 1 126 ALA H . . 5.200 4.123 4.045 4.213 . 0 0 "[ . 1 . 2]" 1
1412 1 122 MET HG2 1 126 ALA H . . 5.800 4.927 4.083 5.437 . 0 0 "[ . 1 . 2]" 1
1413 1 123 ILE HA 1 126 ALA H . . 4.600 3.641 3.566 3.717 . 0 0 "[ . 1 . 2]" 1
1414 1 123 ILE H 1 126 ALA H . . 5.800 4.934 4.878 4.971 . 0 0 "[ . 1 . 2]" 1
1415 1 124 ALA HA 1 126 ALA H . . 5.800 4.860 4.751 4.979 . 0 0 "[ . 1 . 2]" 1
1416 1 124 ALA H 1 126 ALA H . . 5.400 4.367 4.285 4.454 . 0 0 "[ . 1 . 2]" 1
1417 1 125 GLU HA 1 126 ALA H . . 4.500 3.562 3.557 3.568 . 0 0 "[ . 1 . 2]" 1
1418 1 125 GLU HB2 1 126 ALA H . . 3.500 2.558 2.343 2.851 . 0 0 "[ . 1 . 2]" 1
1419 1 126 ALA H 1 126 ALA MB . . 3.500 2.101 2.026 2.234 . 0 0 "[ . 1 . 2]" 1
1420 1 126 ALA H 1 127 ASP H . . 3.800 2.654 2.592 2.701 . 0 0 "[ . 1 . 2]" 1
1421 1 126 ALA MB 1 134 VAL MG1 . . 3.400 2.015 1.859 2.186 . 0 0 "[ . 1 . 2]" 1
1422 1 126 ALA HA 1 138 GLU HB3 . . 4.200 2.917 2.362 3.631 . 0 0 "[ . 1 . 2]" 1
1423 1 123 ILE HA 1 127 ASP H . . 5.200 3.971 3.893 4.039 . 0 0 "[ . 1 . 2]" 1
1424 1 123 ILE MG 1 127 ASP H . . 5.200 3.931 3.853 4.007 . 0 0 "[ . 1 . 2]" 1
1425 1 124 ALA HA 1 127 ASP H . . 4.800 3.642 3.562 3.717 . 0 0 "[ . 1 . 2]" 1
1426 1 124 ALA H 1 127 ASP H . . 5.600 4.626 4.608 4.702 . 0 0 "[ . 1 . 2]" 1
1427 1 125 GLU HA 1 127 ASP H . . 5.000 4.098 4.025 4.219 . 0 0 "[ . 1 . 2]" 1
1428 1 126 ALA HA 1 127 ASP H . . 4.500 3.479 3.463 3.508 . 0 0 "[ . 1 . 2]" 1
1429 1 126 ALA MB 1 127 ASP H . . 3.800 2.866 2.768 2.957 . 0 0 "[ . 1 . 2]" 1
1430 1 127 ASP H 1 127 ASP HB2 . . 3.600 2.554 2.093 2.810 . 0 0 "[ . 1 . 2]" 1
1431 1 127 ASP H 1 127 ASP HB3 . . 3.500 2.615 2.292 3.424 . 0 0 "[ . 1 . 2]" 1
1432 1 127 ASP H 1 128 GLU H . . 3.600 2.573 2.535 2.659 . 0 0 "[ . 1 . 2]" 1
1433 1 127 ASP HB2 1 134 VAL MG2 . . 5.500 4.494 4.118 5.082 . 0 0 "[ . 1 . 2]" 1
1434 1 124 ALA HA 1 128 GLU H . . 5.800 4.838 4.591 4.989 . 0 0 "[ . 1 . 2]" 1
1435 1 125 GLU HA 1 128 GLU H . . 4.500 3.584 3.428 3.683 . 0 0 "[ . 1 . 2]" 1
1436 1 125 GLU H 1 128 GLU H . . 6.000 5.007 4.810 5.094 . 0 0 "[ . 1 . 2]" 1
1437 1 126 ALA HA 1 128 GLU H . . 4.900 3.910 3.828 4.055 . 0 0 "[ . 1 . 2]" 1
1438 1 126 ALA H 1 128 GLU H . . 5.200 4.195 4.111 4.231 . 0 0 "[ . 1 . 2]" 1
1439 1 127 ASP HA 1 128 GLU H . . 4.400 3.472 3.465 3.479 . 0 0 "[ . 1 . 2]" 1
1440 1 127 ASP HB3 1 128 GLU H . . 4.000 3.061 2.914 3.486 . 0 0 "[ . 1 . 2]" 1
1441 1 128 GLU H 1 128 GLU HB2 . . 3.600 2.294 2.110 2.562 . 0 0 "[ . 1 . 2]" 1
1442 1 128 GLU H 1 128 GLU HG2 . . 5.400 4.283 2.420 4.665 . 0 0 "[ . 1 . 2]" 1
1443 1 128 GLU H 1 130 GLY H . . 5.200 4.305 4.230 4.394 . 0 0 "[ . 1 . 2]" 1
1444 1 126 ALA HA 1 129 ASP H . . 4.600 3.616 3.469 3.755 . 0 0 "[ . 1 . 2]" 1
1445 1 127 ASP HA 1 129 ASP H . . 4.800 3.795 3.704 3.877 . 0 0 "[ . 1 . 2]" 1
1446 1 127 ASP HB3 1 129 ASP H . . 6.000 5.071 5.004 5.116 . 0 0 "[ . 1 . 2]" 1
1447 1 128 GLU HA 1 129 ASP H . . 4.400 3.466 3.463 3.471 . 0 0 "[ . 1 . 2]" 1
1448 1 128 GLU HB3 1 129 ASP H . . 4.000 3.196 2.949 3.959 . 0 0 "[ . 1 . 2]" 1
1449 1 128 GLU HG3 1 129 ASP H . . 5.200 4.780 4.303 5.057 . 0 0 "[ . 1 . 2]" 1
1450 1 128 GLU H 1 129 ASP H . . 3.800 2.627 2.580 2.696 . 0 0 "[ . 1 . 2]" 1
1451 1 129 ASP H 1 129 ASP HB2 . . 3.400 2.388 2.127 2.724 . 0 0 "[ . 1 . 2]" 1
1452 1 129 ASP H 1 129 ASP HB3 . . 3.600 2.698 2.356 3.050 . 0 0 "[ . 1 . 2]" 1
1453 1 129 ASP H 1 130 GLY H . . 3.700 2.639 2.607 2.669 . 0 0 "[ . 1 . 2]" 1
1454 1 127 ASP HA 1 130 GLY H . . 4.500 3.490 3.428 3.559 . 0 0 "[ . 1 . 2]" 1
1455 1 128 GLU HA 1 130 GLY H . . 5.000 3.998 3.844 4.126 . 0 0 "[ . 1 . 2]" 1
1456 1 129 ASP HA 1 130 GLY H . . 4.500 3.506 3.476 3.525 . 0 0 "[ . 1 . 2]" 1
1457 1 129 ASP HB3 1 130 GLY H . . 3.800 2.818 2.701 2.948 . 0 0 "[ . 1 . 2]" 1
1458 1 130 GLY H 1 131 ASP H . . 5.000 3.991 3.976 4.014 . 0 0 "[ . 1 . 2]" 1
1459 1 130 GLY H 1 132 GLY H . . 5.800 4.779 4.715 4.932 . 0 0 "[ . 1 . 2]" 1
1460 1 130 GLY HA3 1 133 GLU HB2 . . 4.300 3.282 3.219 3.392 . 0 0 "[ . 1 . 2]" 1
1461 1 130 GLY HA2 1 131 ASP H . . 4.000 3.087 3.069 3.095 . 0 0 "[ . 1 . 2]" 1
1462 1 130 GLY HA3 1 131 ASP H . . 3.200 2.173 2.169 2.182 . 0 0 "[ . 1 . 2]" 1
1463 1 131 ASP H 1 131 ASP HB2 . . 3.800 2.839 2.541 3.795 . 0 0 "[ . 1 . 2]" 1
1464 1 131 ASP H 1 132 GLY H . . 4.600 3.753 3.705 3.821 . 0 0 "[ . 1 . 2]" 1
1465 1 131 ASP H 1 133 GLU H . . 4.500 3.445 3.355 3.535 . 0 0 "[ . 1 . 2]" 1
1466 1 131 ASP HA 1 132 GLY H . . 3.800 2.249 2.215 2.262 . 0 0 "[ . 1 . 2]" 1
1467 1 131 ASP HB3 1 132 GLY H . . 5.000 4.213 4.013 4.501 . 0 0 "[ . 1 . 2]" 1
1468 1 127 ASP HB2 1 132 GLY HA2 . . 5.500 4.569 3.995 5.488 . 0 0 "[ . 1 . 2]" 1
1469 1 132 GLY H 1 133 GLU H . . 3.400 2.414 2.362 2.451 . 0 0 "[ . 1 . 2]" 1
1470 1 127 ASP HA 1 133 GLU H . . 4.300 3.245 3.065 3.447 . 0 0 "[ . 1 . 2]" 1
1471 1 131 ASP HA 1 133 GLU H . . 4.800 3.922 3.852 3.961 . 0 0 "[ . 1 . 2]" 1
1472 1 132 GLY HA2 1 133 GLU H . . 4.100 3.054 3.037 3.073 . 0 0 "[ . 1 . 2]" 1
1473 1 132 GLY HA3 1 133 GLU H . . 4.400 3.446 3.436 3.456 . 0 0 "[ . 1 . 2]" 1
1474 1 133 GLU H 1 133 GLU HB2 . . 3.700 2.572 2.477 2.687 . 0 0 "[ . 1 . 2]" 1
1475 1 133 GLU H 1 133 GLU HG3 . . 4.000 3.276 2.836 3.831 . 0 0 "[ . 1 . 2]" 1
1476 1 100 PHE HB3 1 133 GLU HA . . 5.800 5.150 4.801 5.685 . 0 0 "[ . 1 . 2]" 1
1477 1 133 GLU HA 1 134 VAL H . . 3.300 2.261 2.217 2.290 . 0 0 "[ . 1 . 2]" 1
1478 1 133 GLU HB3 1 134 VAL H . . 3.800 2.833 2.734 3.000 . 0 0 "[ . 1 . 2]" 1
1479 1 133 GLU H 1 134 VAL H . . 5.500 4.456 4.429 4.469 . 0 0 "[ . 1 . 2]" 1
1480 1 134 VAL H 1 134 VAL HB . . 3.600 2.607 2.555 2.674 . 0 0 "[ . 1 . 2]" 1
1481 1 134 VAL H 1 134 VAL MG2 . . 3.800 2.528 2.369 2.713 . 0 0 "[ . 1 . 2]" 1
1482 1 126 ALA MB 1 135 SER H . . 3.400 2.290 1.984 2.602 . 0 0 "[ . 1 . 2]" 1
1483 1 134 VAL HA 1 135 SER H . . 3.200 2.149 2.141 2.163 . 0 0 "[ . 1 . 2]" 1
1484 1 134 VAL HB 1 135 SER H . . 5.200 4.321 4.253 4.383 . 0 0 "[ . 1 . 2]" 1
1485 1 134 VAL MG1 1 135 SER H . . 4.000 2.866 2.696 3.076 . 0 0 "[ . 1 . 2]" 1
1486 1 134 VAL H 1 135 SER H . . 5.200 4.259 4.175 4.318 . 0 0 "[ . 1 . 2]" 1
1487 1 135 SER H 1 135 SER HB3 . . 3.400 2.503 2.369 2.749 . 0 0 "[ . 1 . 2]" 1
1488 1 135 SER H 1 136 PHE H . . 5.100 4.136 4.050 4.197 . 0 0 "[ . 1 . 2]" 1
1489 1 129 ASP HB3 1 135 SER HB3 . . 3.400 2.635 2.233 3.164 . 0 0 "[ . 1 . 2]" 1
1490 1 133 GLU HB2 1 135 SER HB2 . . 5.800 5.162 4.726 5.487 . 0 0 "[ . 1 . 2]" 1
1491 1 134 VAL HA 1 136 PHE H . . 6.400 5.434 5.321 5.542 . 0 0 "[ . 1 . 2]" 1
1492 1 134 VAL HB 1 136 PHE H . . 6.000 5.258 5.088 5.445 . 0 0 "[ . 1 . 2]" 1
1493 1 134 VAL MG1 1 136 PHE H . . 5.200 3.699 3.382 3.877 . 0 0 "[ . 1 . 2]" 1
1494 1 135 SER HA 1 136 PHE H . . 3.200 2.167 2.149 2.183 . 0 0 "[ . 1 . 2]" 1
1495 1 135 SER HB2 1 136 PHE H . . 5.200 4.388 4.168 4.505 . 0 0 "[ . 1 . 2]" 1
1496 1 136 PHE H 1 136 PHE HB2 . . 3.100 2.076 2.066 2.147 . 0 0 "[ . 1 . 2]" 1
1497 1 136 PHE H 1 137 GLU H . . 3.800 2.718 2.687 2.757 . 0 0 "[ . 1 . 2]" 1
1498 1 134 VAL MG1 1 136 PHE HA . . 5.200 3.899 3.797 4.055 . 0 0 "[ . 1 . 2]" 1
1499 1 136 PHE HA 1 139 PHE HB2 . . 4.000 3.030 2.786 3.502 . 0 0 "[ . 1 . 2]" 1
1500 1 135 SER HA 1 137 GLU H . . 4.400 3.537 3.441 3.639 . 0 0 "[ . 1 . 2]" 1
1501 1 135 SER HB2 1 137 GLU H . . 5.300 4.601 4.354 4.763 . 0 0 "[ . 1 . 2]" 1
1502 1 136 PHE HA 1 137 GLU H . . 4.500 3.487 3.468 3.514 . 0 0 "[ . 1 . 2]" 1
1503 1 136 PHE HB2 1 137 GLU H . . 3.400 3.326 3.029 3.399 . 0 0 "[ . 1 . 2]" 1
1504 1 136 PHE HB3 1 137 GLU H . . 3.300 3.215 3.100 3.300 . 0 0 "[ . 1 . 2]" 1
1505 1 137 GLU H 1 137 GLU HB2 . . 3.300 2.358 2.230 2.566 . 0 0 "[ . 1 . 2]" 1
1506 1 137 GLU H 1 137 GLU HB3 . . 3.800 2.709 2.485 2.867 . 0 0 "[ . 1 . 2]" 1
1507 1 137 GLU H 1 137 GLU HG3 . . 5.200 4.334 4.173 4.559 . 0 0 "[ . 1 . 2]" 1
1508 1 137 GLU H 1 139 PHE H . . 5.500 4.466 4.348 4.561 . 0 0 "[ . 1 . 2]" 1
1509 1 135 SER HB2 1 137 GLU HB2 . . 5.800 5.471 4.937 5.741 . 0 0 "[ . 1 . 2]" 1
1510 1 135 SER HB3 1 137 GLU HB3 . . 5.600 4.363 3.746 4.831 . 0 0 "[ . 1 . 2]" 1
1511 1 137 GLU HA 1 140 LYS HB3 . . 3.900 3.079 2.887 3.554 . 0 0 "[ . 1 . 2]" 1
1512 1 135 SER HA 1 138 GLU H . . 5.300 4.552 4.371 4.646 . 0 0 "[ . 1 . 2]" 1
1513 1 135 SER HB3 1 138 GLU H . . 4.800 3.396 2.954 3.709 . 0 0 "[ . 1 . 2]" 1
1514 1 135 SER H 1 138 GLU H . . 5.300 4.808 4.682 4.948 . 0 0 "[ . 1 . 2]" 1
1515 1 136 PHE HA 1 138 GLU H . . 5.000 4.021 3.904 4.270 . 0 0 "[ . 1 . 2]" 1
1516 1 136 PHE H 1 138 GLU H . . 5.200 4.434 4.332 4.494 . 0 0 "[ . 1 . 2]" 1
1517 1 137 GLU HA 1 138 GLU H . . 4.500 3.524 3.508 3.540 . 0 0 "[ . 1 . 2]" 1
1518 1 137 GLU HB3 1 138 GLU H . . 3.800 2.676 2.566 2.755 . 0 0 "[ . 1 . 2]" 1
1519 1 137 GLU HG2 1 138 GLU H . . 4.400 4.153 3.686 4.348 . 0 0 "[ . 1 . 2]" 1
1520 1 137 GLU H 1 138 GLU H . . 3.800 2.775 2.744 2.801 . 0 0 "[ . 1 . 2]" 1
1521 1 138 GLU H 1 138 GLU HB2 . . 3.700 2.145 2.098 2.241 . 0 0 "[ . 1 . 2]" 1
1522 1 138 GLU H 1 138 GLU HG2 . . 4.200 4.050 3.901 4.188 . 0 0 "[ . 1 . 2]" 1
1523 1 138 GLU H 1 140 LYS H . . 5.000 4.304 4.205 4.500 . 0 0 "[ . 1 . 2]" 1
1524 1 138 GLU H 1 141 SER H . . 5.200 4.747 4.671 4.806 . 0 0 "[ . 1 . 2]" 1
1525 1 138 GLU HA 1 141 SER HB3 . . 4.500 2.762 2.516 3.925 . 0 0 "[ . 1 . 2]" 1
1526 1 129 ASP HB2 1 138 GLU HG3 . . 4.000 2.136 2.000 2.548 . 0 0 "[ . 1 . 2]" 1
1527 1 136 PHE HA 1 139 PHE H . . 4.300 3.303 3.252 3.380 . 0 0 "[ . 1 . 2]" 1
1528 1 137 GLU HA 1 139 PHE H . . 5.700 4.665 4.496 4.759 . 0 0 "[ . 1 . 2]" 1
1529 1 138 GLU HA 1 139 PHE H . . 4.500 3.558 3.545 3.563 . 0 0 "[ . 1 . 2]" 1
1530 1 138 GLU HB3 1 139 PHE H . . 3.500 2.487 2.365 2.612 . 0 0 "[ . 1 . 2]" 1
1531 1 138 GLU H 1 139 PHE H . . 3.800 2.730 2.691 2.767 . 0 0 "[ . 1 . 2]" 1
1532 1 139 PHE H 1 139 PHE HB2 . . 3.100 2.164 2.066 2.550 . 0 0 "[ . 1 . 2]" 1
1533 1 139 PHE H 1 139 PHE HB3 . . 4.000 3.050 2.510 3.422 . 0 0 "[ . 1 . 2]" 1
1534 1 139 PHE H 1 140 LYS H . . 3.800 2.834 2.745 2.945 . 0 0 "[ . 1 . 2]" 1
1535 1 139 PHE HA 1 142 VAL HB . . 4.200 3.078 2.940 3.287 . 0 0 "[ . 1 . 2]" 1
1536 1 136 PHE HA 1 140 LYS H . . 5.200 4.166 3.979 4.263 . 0 0 "[ . 1 . 2]" 1
1537 1 136 PHE HB3 1 140 LYS H . . 5.600 4.630 4.521 4.753 . 0 0 "[ . 1 . 2]" 1
1538 1 137 GLU HA 1 140 LYS H . . 4.800 3.747 3.611 3.941 . 0 0 "[ . 1 . 2]" 1
1539 1 137 GLU H 1 140 LYS H . . 5.800 4.970 4.920 5.028 . 0 0 "[ . 1 . 2]" 1
1540 1 138 GLU HA 1 140 LYS H . . 5.600 4.718 4.608 4.887 . 0 0 "[ . 1 . 2]" 1
1541 1 139 PHE HA 1 140 LYS H . . 4.500 3.559 3.552 3.569 . 0 0 "[ . 1 . 2]" 1
1542 1 139 PHE HB2 1 140 LYS H . . 4.200 3.297 2.833 3.709 . 0 0 "[ . 1 . 2]" 1
1543 1 139 PHE HB3 1 140 LYS H . . 3.500 2.504 2.245 2.940 . 0 0 "[ . 1 . 2]" 1
1544 1 140 LYS H 1 140 LYS HB2 . . 3.600 2.362 2.112 2.529 . 0 0 "[ . 1 . 2]" 1
1545 1 140 LYS H 1 140 LYS HB3 . . 3.500 2.706 2.513 3.052 . 0 0 "[ . 1 . 2]" 1
1546 1 140 LYS H 1 140 LYS HG3 . . 5.400 4.448 4.314 4.530 . 0 0 "[ . 1 . 2]" 1
1547 1 140 LYS H 1 140 LYS HD2 . . 5.600 4.082 3.714 4.360 . 0 0 "[ . 1 . 2]" 1
1548 1 140 LYS H 1 140 LYS HE2 . . 5.600 5.219 4.739 5.547 . 0 0 "[ . 1 . 2]" 1
1549 1 140 LYS H 1 141 SER H . . 3.800 2.799 2.727 2.859 . 0 0 "[ . 1 . 2]" 1
1550 1 140 LYS H 1 142 VAL H . . 5.200 4.368 4.240 4.444 . 0 0 "[ . 1 . 2]" 1
1551 1 140 LYS H 1 143 MET H . . 5.800 4.839 4.781 4.893 . 0 0 "[ . 1 . 2]" 1
1552 1 140 LYS HA 1 143 MET HB2 . . 4.000 3.247 2.736 3.712 . 0 0 "[ . 1 . 2]" 1
1553 1 80 PRO HA 1 140 LYS HE3 . . 3.200 2.594 2.095 3.187 . 0 0 "[ . 1 . 2]" 1
1554 1 137 GLU HA 1 141 SER H . . 5.000 3.983 3.896 4.061 . 0 0 "[ . 1 . 2]" 1
1555 1 137 GLU HG2 1 141 SER H . . 5.200 4.415 4.156 5.050 . 0 0 "[ . 1 . 2]" 1
1556 1 138 GLU HA 1 141 SER H . . 4.800 3.668 3.562 3.752 . 0 0 "[ . 1 . 2]" 1
1557 1 139 PHE HA 1 141 SER H . . 5.700 4.582 4.478 4.683 . 0 0 "[ . 1 . 2]" 1
1558 1 139 PHE H 1 141 SER H . . 5.200 4.263 4.192 4.337 . 0 0 "[ . 1 . 2]" 1
1559 1 140 LYS HA 1 141 SER H . . 4.500 3.552 3.543 3.560 . 0 0 "[ . 1 . 2]" 1
1560 1 140 LYS HB3 1 141 SER H . . 3.400 2.479 2.374 2.634 . 0 0 "[ . 1 . 2]" 1
1561 1 140 LYS HG2 1 141 SER H . . 5.000 4.533 4.221 4.845 . 0 0 "[ . 1 . 2]" 1
1562 1 141 SER H 1 141 SER HB2 . . 4.400 2.809 2.097 3.522 . 0 0 "[ . 1 . 2]" 1
1563 1 141 SER H 1 141 SER HB3 . . 3.400 2.352 2.154 3.393 . 0 0 "[ . 1 . 2]" 1
1564 1 141 SER H 1 143 MET H . . 5.300 4.290 4.168 4.373 . 0 0 "[ . 1 . 2]" 1
1565 1 141 SER HA 1 144 MET HB3 . . 4.400 3.422 3.046 3.737 . 0 0 "[ . 1 . 2]" 1
1566 1 138 GLU HA 1 142 VAL H . . 5.200 4.129 4.058 4.185 . 0 0 "[ . 1 . 2]" 1
1567 1 138 GLU HG2 1 142 VAL H . . 6.000 5.466 4.967 5.979 . 0 0 "[ . 1 . 2]" 1
1568 1 139 PHE HA 1 142 VAL H . . 4.800 3.670 3.542 3.749 . 0 0 "[ . 1 . 2]" 1
1569 1 139 PHE H 1 142 VAL H . . 5.800 4.861 4.792 4.900 . 0 0 "[ . 1 . 2]" 1
1570 1 140 LYS HA 1 142 VAL H . . 5.500 4.586 4.472 4.680 . 0 0 "[ . 1 . 2]" 1
1571 1 141 SER HA 1 142 VAL H . . 4.500 3.556 3.541 3.562 . 0 0 "[ . 1 . 2]" 1
1572 1 141 SER HB3 1 142 VAL H . . 4.700 2.668 2.437 3.574 . 0 0 "[ . 1 . 2]" 1
1573 1 141 SER H 1 142 VAL H . . 3.800 2.827 2.703 2.887 . 0 0 "[ . 1 . 2]" 1
1574 1 142 VAL H 1 142 VAL HB . . 3.600 2.586 2.550 2.650 . 0 0 "[ . 1 . 2]" 1
1575 1 142 VAL H 1 142 VAL MG2 . . 3.400 2.137 1.960 2.208 . 0 0 "[ . 1 . 2]" 1
1576 1 142 VAL H 1 143 MET H . . 3.800 2.773 2.717 2.839 . 0 0 "[ . 1 . 2]" 1
1577 1 142 VAL H 1 144 MET H . . 5.200 4.360 4.212 4.449 . 0 0 "[ . 1 . 2]" 1
1578 1 139 PHE HA 1 143 MET H . . 5.200 4.188 4.083 4.284 . 0 0 "[ . 1 . 2]" 1
1579 1 140 LYS HA 1 143 MET H . . 4.500 3.566 3.455 3.662 . 0 0 "[ . 1 . 2]" 1
1580 1 141 SER HA 1 143 MET H . . 5.600 4.593 4.404 4.698 . 0 0 "[ . 1 . 2]" 1
1581 1 142 VAL HA 1 143 MET H . . 4.500 3.553 3.534 3.561 . 0 0 "[ . 1 . 2]" 1
1582 1 142 VAL HB 1 143 MET H . . 3.500 2.482 2.404 2.638 . 0 0 "[ . 1 . 2]" 1
1583 1 142 VAL MG2 1 143 MET H . . 5.200 3.770 3.718 3.828 . 0 0 "[ . 1 . 2]" 1
1584 1 142 VAL MG1 1 143 MET H . . 4.600 3.410 3.312 3.555 . 0 0 "[ . 1 . 2]" 1
1585 1 143 MET H 1 143 MET HB2 . . 3.300 2.312 2.087 2.568 . 0 0 "[ . 1 . 2]" 1
1586 1 143 MET H 1 143 MET HB3 . . 3.800 2.780 2.477 3.126 . 0 0 "[ . 1 . 2]" 1
1587 1 143 MET H 1 143 MET HG2 . . 5.500 4.573 4.426 4.652 . 0 0 "[ . 1 . 2]" 1
1588 1 143 MET H 1 144 MET H . . 3.800 2.828 2.764 2.880 . 0 0 "[ . 1 . 2]" 1
1589 1 143 MET HA 1 146 MET HB2 . . 4.300 2.969 2.768 3.246 . 0 0 "[ . 1 . 2]" 1
1590 1 140 LYS HA 1 144 MET H . . 5.200 4.115 4.043 4.199 . 0 0 "[ . 1 . 2]" 1
1591 1 140 LYS HG3 1 144 MET H . . 5.000 4.287 4.023 4.602 . 0 0 "[ . 1 . 2]" 1
1592 1 141 SER HA 1 144 MET H . . 4.800 3.698 3.618 3.806 . 0 0 "[ . 1 . 2]" 1
1593 1 141 SER H 1 144 MET H . . 5.800 4.888 4.818 4.924 . 0 0 "[ . 1 . 2]" 1
1594 1 142 VAL HA 1 144 MET H . . 5.800 4.603 4.481 4.698 . 0 0 "[ . 1 . 2]" 1
1595 1 143 MET HA 1 144 MET H . . 4.500 3.559 3.549 3.564 . 0 0 "[ . 1 . 2]" 1
1596 1 143 MET HB3 1 144 MET H . . 3.400 2.440 2.341 2.587 . 0 0 "[ . 1 . 2]" 1
1597 1 143 MET HG3 1 144 MET H . . 5.200 4.354 3.901 4.735 . 0 0 "[ . 1 . 2]" 1
1598 1 144 MET H 1 144 MET HB2 . . 3.300 2.234 2.074 2.436 . 0 0 "[ . 1 . 2]" 1
1599 1 144 MET H 1 144 MET HB3 . . 3.800 2.876 2.611 3.167 . 0 0 "[ . 1 . 2]" 1
1600 1 144 MET H 1 144 MET HG3 . . 5.200 4.219 3.768 4.400 . 0 0 "[ . 1 . 2]" 1
1601 1 144 MET H 1 145 GLN H . . 3.800 2.737 2.663 2.800 . 0 0 "[ . 1 . 2]" 1
1602 1 144 MET H 1 147 ARG H . . 5.700 4.818 4.759 4.885 . 0 0 "[ . 1 . 2]" 1
1603 1 144 MET HA 1 147 ARG HB2 . . 3.400 2.609 2.442 2.814 . 0 0 "[ . 1 . 2]" 1
1604 1 140 LYS HG3 1 144 MET HB2 . . 4.500 3.791 3.492 4.440 . 0 0 "[ . 1 . 2]" 1
1605 1 80 PRO HB3 1 144 MET HA . . 6.200 5.260 3.643 5.792 . 0 0 "[ . 1 . 2]" 1
1606 1 141 SER HA 1 145 GLN H . . 5.200 4.184 4.083 4.249 . 0 0 "[ . 1 . 2]" 1
1607 1 141 SER HB2 1 145 GLN H . . 6.200 6.003 5.242 6.196 . 0 0 "[ . 1 . 2]" 1
1608 1 142 VAL HA 1 145 GLN H . . 4.500 3.534 3.424 3.646 . 0 0 "[ . 1 . 2]" 1
1609 1 142 VAL H 1 145 GLN H . . 5.700 4.793 4.718 4.845 . 0 0 "[ . 1 . 2]" 1
1610 1 143 MET HA 1 145 GLN H . . 5.500 4.529 4.439 4.621 . 0 0 "[ . 1 . 2]" 1
1611 1 143 MET H 1 145 GLN H . . 5.000 4.223 4.109 4.281 . 0 0 "[ . 1 . 2]" 1
1612 1 144 MET HA 1 145 GLN H . . 4.500 3.545 3.534 3.553 . 0 0 "[ . 1 . 2]" 1
1613 1 144 MET HB3 1 145 GLN H . . 3.600 2.581 2.468 2.758 . 0 0 "[ . 1 . 2]" 1
1614 1 144 MET HG2 1 145 GLN H . . 5.000 4.408 3.832 4.931 . 0 0 "[ . 1 . 2]" 1
1615 1 144 MET ME 1 145 GLN H . . 5.600 4.315 3.421 5.146 . 0 0 "[ . 1 . 2]" 1
1616 1 145 GLN H 1 145 GLN HB2 . . 3.600 2.327 2.153 2.515 . 0 0 "[ . 1 . 2]" 1
1617 1 145 GLN H 1 145 GLN HB3 . . 3.600 2.748 2.531 2.981 . 0 0 "[ . 1 . 2]" 1
1618 1 145 GLN H 1 145 GLN HG2 . . 5.000 4.518 4.417 4.663 . 0 0 "[ . 1 . 2]" 1
1619 1 145 GLN H 1 146 MET H . . 3.800 2.784 2.726 2.824 . 0 0 "[ . 1 . 2]" 1
1620 1 145 GLN HA 1 148 GLY HA3 . . 5.500 4.157 4.013 4.421 . 0 0 "[ . 1 . 2]" 1
1621 1 142 VAL HA 1 146 MET H . . 5.200 4.150 4.052 4.212 . 0 0 "[ . 1 . 2]" 1
1622 1 142 VAL MG1 1 146 MET H . . 5.800 3.915 3.770 4.036 . 0 0 "[ . 1 . 2]" 1
1623 1 143 MET HA 1 146 MET H . . 4.800 3.645 3.581 3.765 . 0 0 "[ . 1 . 2]" 1
1624 1 143 MET H 1 146 MET H . . 5.800 4.858 4.808 4.907 . 0 0 "[ . 1 . 2]" 1
1625 1 144 MET HA 1 146 MET H . . 5.500 4.508 4.383 4.595 . 0 0 "[ . 1 . 2]" 1
1626 1 144 MET H 1 146 MET H . . 5.400 4.312 4.230 4.403 . 0 0 "[ . 1 . 2]" 1
1627 1 145 GLN HA 1 146 MET H . . 4.500 3.551 3.540 3.558 . 0 0 "[ . 1 . 2]" 1
1628 1 145 GLN HB3 1 146 MET H . . 3.400 2.490 2.418 2.614 . 0 0 "[ . 1 . 2]" 1
1629 1 145 GLN HG2 1 146 MET H . . 4.600 4.077 3.655 4.597 . 0 0 "[ . 1 . 2]" 1
1630 1 146 MET H 1 146 MET HB2 . . 3.400 2.339 2.069 2.627 . 0 0 "[ . 1 . 2]" 1
1631 1 146 MET H 1 146 MET HB3 . . 4.400 3.538 3.327 3.591 . 0 0 "[ . 1 . 2]" 1
1632 1 146 MET H 1 146 MET HG2 . . 3.500 2.908 2.220 3.485 . 0 0 "[ . 1 . 2]" 1
1633 1 146 MET H 1 147 ARG H . . 3.800 2.714 2.633 2.784 . 0 0 "[ . 1 . 2]" 1
1634 1 146 MET H 1 148 GLY H . . 5.200 4.230 4.165 4.321 . 0 0 "[ . 1 . 2]" 1
1635 1 142 VAL MG1 1 146 MET HB2 . . 5.400 4.165 3.707 4.561 . 0 0 "[ . 1 . 2]" 1
1636 1 146 MET HA 1 149 LYS HG3 . . 3.400 2.744 2.105 3.387 . 0 0 "[ . 1 . 2]" 1
1637 1 143 MET HA 1 147 ARG H . . 5.200 4.179 4.104 4.259 . 0 0 "[ . 1 . 2]" 1
1638 1 143 MET HG3 1 147 ARG H . . 5.800 4.634 4.221 5.103 . 0 0 "[ . 1 . 2]" 1
1639 1 144 MET HA 1 147 ARG H . . 4.500 3.521 3.417 3.610 . 0 0 "[ . 1 . 2]" 1
1640 1 145 GLN HA 1 147 ARG H . . 5.600 4.611 4.505 4.714 . 0 0 "[ . 1 . 2]" 1
1641 1 145 GLN H 1 147 ARG H . . 5.100 4.260 4.133 4.365 . 0 0 "[ . 1 . 2]" 1
1642 1 146 MET HA 1 147 ARG H . . 4.500 3.550 3.539 3.560 . 0 0 "[ . 1 . 2]" 1
1643 1 146 MET HB2 1 147 ARG H . . 3.800 2.627 2.452 3.011 . 0 0 "[ . 1 . 2]" 1
1644 1 146 MET HG2 1 147 ARG H . . 5.400 4.678 4.322 4.959 . 0 0 "[ . 1 . 2]" 1
1645 1 147 ARG H 1 147 ARG HB2 . . 3.300 2.321 2.103 2.552 . 0 0 "[ . 1 . 2]" 1
1646 1 147 ARG H 1 147 ARG HD2 . . 4.800 4.556 4.114 4.792 . 0 0 "[ . 1 . 2]" 1
1647 1 147 ARG H 1 147 ARG HG2 . . 3.600 2.611 2.201 3.203 . 0 0 "[ . 1 . 2]" 1
1648 1 147 ARG H 1 148 GLY H . . 3.800 2.784 2.704 2.841 . 0 0 "[ . 1 . 2]" 1
1649 1 143 MET HG3 1 147 ARG HG2 . . 4.200 3.597 2.809 4.105 . 0 0 "[ . 1 . 2]" 1
1650 1 144 MET HA 1 148 GLY H . . 5.200 4.113 4.031 4.179 . 0 0 "[ . 1 . 2]" 1
1651 1 144 MET HG2 1 148 GLY H . . 5.400 4.759 4.115 5.341 . 0 0 "[ . 1 . 2]" 1
1652 1 145 GLN HA 1 148 GLY H . . 4.800 3.675 3.583 3.816 . 0 0 "[ . 1 . 2]" 1
1653 1 145 GLN H 1 148 GLY H . . 5.800 4.849 4.789 4.895 . 0 0 "[ . 1 . 2]" 1
1654 1 146 MET HA 1 148 GLY H . . 5.400 4.449 4.365 4.554 . 0 0 "[ . 1 . 2]" 1
1655 1 147 ARG HA 1 148 GLY H . . 4.500 3.549 3.540 3.559 . 0 0 "[ . 1 . 2]" 1
1656 1 147 ARG HB2 1 148 GLY H . . 3.600 2.677 2.482 2.923 . 0 0 "[ . 1 . 2]" 1
1657 1 147 ARG HG2 1 148 GLY H . . 5.600 4.609 4.379 4.887 . 0 0 "[ . 1 . 2]" 1
1658 1 145 GLN HA 1 149 LYS H . . 5.300 3.993 3.651 4.169 . 0 0 "[ . 1 . 2]" 1
1659 1 146 MET HA 1 149 LYS H . . 4.800 3.783 3.648 3.949 . 0 0 "[ . 1 . 2]" 1
1660 1 146 MET H 1 149 LYS H . . 6.200 4.960 4.833 5.070 . 0 0 "[ . 1 . 2]" 1
1661 1 147 ARG HA 1 149 LYS H . . 6.000 5.055 4.857 5.251 . 0 0 "[ . 1 . 2]" 1
1662 1 147 ARG H 1 149 LYS H . . 5.600 4.606 4.466 4.726 . 0 0 "[ . 1 . 2]" 1
1663 1 148 GLY HA3 1 149 LYS H . . 3.500 2.601 2.552 2.668 . 0 0 "[ . 1 . 2]" 1
1664 1 148 GLY H 1 149 LYS H . . 3.800 2.840 2.755 2.923 . 0 0 "[ . 1 . 2]" 1
1665 1 149 LYS H 1 149 LYS HB3 . . 3.700 2.948 2.350 3.590 . 0 0 "[ . 1 . 2]" 1
1666 1 149 LYS H 1 149 LYS HD2 . . 5.400 4.687 4.423 4.974 . 0 0 "[ . 1 . 2]" 1
1667 1 149 LYS H 1 149 LYS HE2 . . 5.600 5.013 4.190 5.565 . 0 0 "[ . 1 . 2]" 1
1668 1 149 LYS H 1 149 LYS HG3 . . 3.500 2.656 2.324 2.879 . 0 0 "[ . 1 . 2]" 1
1669 1 145 GLN HG2 1 149 LYS HG2 . . 4.000 3.503 2.861 3.968 . 0 0 "[ . 1 . 2]" 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 117
_Distance_constraint_stats_list.Viol_count 2223
_Distance_constraint_stats_list.Viol_total 2610.017
_Distance_constraint_stats_list.Viol_max 0.249
_Distance_constraint_stats_list.Viol_rms 0.0378
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0558
_Distance_constraint_stats_list.Viol_average_violations_only 0.0587
_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 4 LEU 2.097 0.106 18 0 "[ . 1 . 2]"
1 5 THR 3.522 0.102 17 0 "[ . 1 . 2]"
1 6 ASP 2.219 0.113 20 0 "[ . 1 . 2]"
1 7 GLU 2.404 0.100 20 0 "[ . 1 . 2]"
1 8 GLN 4.342 0.106 18 0 "[ . 1 . 2]"
1 9 ILE 5.255 0.102 17 0 "[ . 1 . 2]"
1 10 ARG 6.771 0.249 11 0 "[ . 1 . 2]"
1 11 GLU 4.197 0.100 20 0 "[ . 1 . 2]"
1 12 ALA 4.942 0.102 20 0 "[ . 1 . 2]"
1 13 PHE 3.740 0.101 20 0 "[ . 1 . 2]"
1 14 ASN 4.552 0.249 11 0 "[ . 1 . 2]"
1 15 LEU 1.792 0.100 20 0 "[ . 1 . 2]"
1 16 PHE 2.697 0.102 20 0 "[ . 1 . 2]"
1 17 ASP 2.006 0.101 20 0 "[ . 1 . 2]"
1 26 ALA 2.125 0.100 9 0 "[ . 1 . 2]"
1 27 GLU 1.916 0.100 15 0 "[ . 1 . 2]"
1 28 GLU 2.536 0.100 11 0 "[ . 1 . 2]"
1 29 MET 2.246 0.100 20 0 "[ . 1 . 2]"
1 30 ALA 4.212 0.100 7 0 "[ . 1 . 2]"
1 31 LEU 3.789 0.100 15 0 "[ . 1 . 2]"
1 32 ALA 4.490 0.100 11 0 "[ . 1 . 2]"
1 33 MET 2.246 0.100 20 0 "[ . 1 . 2]"
1 34 LYS 2.087 0.100 7 0 "[ . 1 . 2]"
1 35 GLY 1.873 0.092 9 0 "[ . 1 . 2]"
1 36 LEU 1.955 0.100 20 0 "[ . 1 . 2]"
1 43 ARG 2.878 0.100 7 0 "[ . 1 . 2]"
1 44 ASP 2.045 0.104 14 0 "[ . 1 . 2]"
1 45 GLU 2.079 0.101 7 0 "[ . 1 . 2]"
1 46 VAL 2.766 0.101 8 0 "[ . 1 . 2]"
1 47 GLU 4.893 0.101 20 0 "[ . 1 . 2]"
1 48 ARG 4.313 0.104 14 0 "[ . 1 . 2]"
1 49 THR 3.179 0.101 7 0 "[ . 1 . 2]"
1 50 VAL 2.766 0.101 8 0 "[ . 1 . 2]"
1 51 ARG 2.015 0.101 20 0 "[ . 1 . 2]"
1 52 SER 2.269 0.100 16 0 "[ . 1 . 2]"
1 53 MET 1.101 0.090 20 0 "[ . 1 . 2]"
1 63 TYR 3.202 0.101 20 0 "[ . 1 . 2]"
1 64 GLY 2.014 0.105 20 0 "[ . 1 . 2]"
1 65 GLU 2.029 0.098 7 0 "[ . 1 . 2]"
1 66 PHE 2.669 0.100 6 0 "[ . 1 . 2]"
1 67 GLU 4.988 0.101 20 0 "[ . 1 . 2]"
1 68 ARG 2.014 0.105 20 0 "[ . 1 . 2]"
1 69 MET 4.119 0.099 13 0 "[ . 1 . 2]"
1 70 VAL 3.500 0.100 6 0 "[ . 1 . 2]"
1 71 LYS 1.787 0.101 20 0 "[ . 1 . 2]"
1 73 ARG 2.090 0.099 13 0 "[ . 1 . 2]"
1 74 MET 0.831 0.097 10 0 "[ . 1 . 2]"
1 81 GLU 1.915 0.099 7 0 "[ . 1 . 2]"
1 82 GLU 1.885 0.098 19 0 "[ . 1 . 2]"
1 83 VAL 1.975 0.098 13 0 "[ . 1 . 2]"
1 84 LEU 2.106 0.099 9 0 "[ . 1 . 2]"
1 85 LYS 3.801 0.100 1 0 "[ . 1 . 2]"
1 86 ALA 3.706 0.100 2 0 "[ . 1 . 2]"
1 87 PHE 1.975 0.098 13 0 "[ . 1 . 2]"
1 88 GLN 2.106 0.099 9 0 "[ . 1 . 2]"
1 89 LEU 1.887 0.100 1 0 "[ . 1 . 2]"
1 90 PHE 1.821 0.100 2 0 "[ . 1 . 2]"
1 100 PHE 1.961 0.097 17 0 "[ . 1 . 2]"
1 101 ALA 2.323 0.097 1 0 "[ . 1 . 2]"
1 102 ASN 2.183 0.099 16 0 "[ . 1 . 2]"
1 103 LEU 2.027 0.100 8 0 "[ . 1 . 2]"
1 104 LYS 3.979 0.098 7 0 "[ . 1 . 2]"
1 105 GLU 3.370 0.098 10 0 "[ . 1 . 2]"
1 106 VAL 2.183 0.099 16 0 "[ . 1 . 2]"
1 107 ALA 2.027 0.100 8 0 "[ . 1 . 2]"
1 108 LYS 2.017 0.098 7 0 "[ . 1 . 2]"
1 109 LEU 1.046 0.098 10 0 "[ . 1 . 2]"
1 116 ASP 4.174 0.121 11 0 "[ . 1 . 2]"
1 117 ASP 2.193 0.102 7 0 "[ . 1 . 2]"
1 118 VAL 2.333 0.118 5 0 "[ . 1 . 2]"
1 119 LEU 3.939 0.109 8 0 "[ . 1 . 2]"
1 120 GLN 6.235 0.121 11 0 "[ . 1 . 2]"
1 121 GLU 4.177 0.102 7 0 "[ . 1 . 2]"
1 122 MET 4.414 0.118 5 0 "[ . 1 . 2]"
1 123 ILE 5.080 0.109 8 0 "[ . 1 . 2]"
1 124 ALA 2.061 0.104 2 0 "[ . 1 . 2]"
1 125 GLU 1.984 0.091 13 0 "[ . 1 . 2]"
1 126 ALA 2.081 0.098 18 0 "[ . 1 . 2]"
1 127 ASP 1.141 0.080 5 0 "[ . 1 . 2]"
1 136 PHE 2.054 0.096 16 0 "[ . 1 . 2]"
1 137 GLU 2.006 0.099 13 0 "[ . 1 . 2]"
1 138 GLU 2.194 0.098 17 0 "[ . 1 . 2]"
1 139 PHE 1.844 0.095 3 0 "[ . 1 . 2]"
1 140 LYS 3.961 0.096 16 0 "[ . 1 . 2]"
1 141 SER 3.792 0.099 13 0 "[ . 1 . 2]"
1 142 VAL 4.098 0.099 1 0 "[ . 1 . 2]"
1 143 MET 3.826 0.098 3 0 "[ . 1 . 2]"
1 144 MET 3.900 0.097 18 0 "[ . 1 . 2]"
1 145 GLN 1.786 0.098 8 0 "[ . 1 . 2]"
1 146 MET 1.904 0.099 1 0 "[ . 1 . 2]"
1 147 ARG 1.982 0.098 3 0 "[ . 1 . 2]"
1 148 GLY 1.993 0.097 18 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 9 ILE O 1 13 PHE H . . 1.950 2.007 1.983 2.039 0.089 3 0 "[ . 1 . 2]" 2
2 1 9 ILE O 1 13 PHE N . . 2.950 2.980 2.953 3.012 0.062 5 0 "[ . 1 . 2]" 2
3 1 10 ARG O 1 14 ASN H . . 1.950 2.135 2.083 2.199 0.249 11 0 "[ . 1 . 2]" 2
4 1 10 ARG O 1 14 ASN N . . 2.950 2.993 2.948 3.032 0.082 19 0 "[ . 1 . 2]" 2
5 1 11 GLU O 1 15 LEU H . . 1.950 2.030 2.004 2.050 0.100 20 0 "[ . 1 . 2]" 2
6 1 11 GLU O 1 15 LEU N . . 2.950 2.960 2.949 2.984 0.034 11 0 "[ . 1 . 2]" 2
7 1 12 ALA O 1 16 PHE H . . 1.950 2.028 1.987 2.052 0.102 20 0 "[ . 1 . 2]" 2
8 1 12 ALA O 1 16 PHE N . . 2.950 3.006 2.963 3.028 0.078 9 0 "[ . 1 . 2]" 2
9 1 26 ALA O 1 30 ALA H . . 1.950 2.023 1.993 2.050 0.100 9 0 "[ . 1 . 2]" 2
10 1 26 ALA O 1 30 ALA N . . 2.950 2.983 2.952 3.012 0.062 9 0 "[ . 1 . 2]" 2
11 1 27 GLU O 1 31 LEU H . . 1.950 2.030 1.999 2.050 0.100 15 0 "[ . 1 . 2]" 2
12 1 27 GLU O 1 31 LEU N . . 2.950 2.966 2.953 2.986 0.036 1 0 "[ . 1 . 2]" 2
13 1 28 GLU O 1 32 ALA H . . 1.950 2.032 1.987 2.050 0.100 11 0 "[ . 1 . 2]" 2
14 1 28 GLU O 1 32 ALA N . . 2.950 2.995 2.958 3.021 0.071 14 0 "[ . 1 . 2]" 2
15 1 29 MET O 1 33 MET H . . 1.950 2.025 1.984 2.050 0.100 20 0 "[ . 1 . 2]" 2
16 1 29 MET O 1 33 MET N . . 2.950 2.987 2.951 3.019 0.069 1 0 "[ . 1 . 2]" 2
17 1 66 PHE O 1 70 VAL H . . 1.950 2.030 1.979 2.050 0.100 6 0 "[ . 1 . 2]" 2
18 1 66 PHE O 1 70 VAL N . . 2.950 3.004 2.952 3.025 0.075 6 0 "[ . 1 . 2]" 2
19 1 67 GLU O 1 71 LYS H . . 1.950 2.030 2.006 2.051 0.101 20 0 "[ . 1 . 2]" 2
20 1 67 GLU O 1 71 LYS N . . 2.950 2.959 2.947 3.007 0.057 13 0 "[ . 1 . 2]" 2
21 1 4 LEU O 1 8 GLN H . . 1.950 2.055 2.054 2.056 0.106 18 0 "[ . 1 . 2]" 2
22 1 4 LEU O 1 8 GLN N . . 2.950 2.945 2.945 2.946 . 0 0 "[ . 1 . 2]" 2
23 1 5 THR O 1 9 ILE H . . 1.950 2.051 2.050 2.052 0.102 17 0 "[ . 1 . 2]" 2
24 1 5 THR O 1 9 ILE N . . 2.950 3.025 3.024 3.027 0.077 20 0 "[ . 1 . 2]" 2
25 1 6 ASP O 1 10 ARG H . . 1.950 2.061 2.060 2.063 0.113 20 0 "[ . 1 . 2]" 2
26 1 6 ASP O 1 10 ARG N . . 2.950 2.939 2.935 2.939 . 0 0 "[ . 1 . 2]" 2
27 1 7 GLU O 1 11 GLU H . . 1.950 2.035 2.010 2.050 0.100 20 0 "[ . 1 . 2]" 2
28 1 7 GLU O 1 11 GLU N . . 2.950 2.985 2.970 3.001 0.051 13 0 "[ . 1 . 2]" 2
29 1 8 GLN O 1 12 ALA H . . 1.950 2.042 2.032 2.050 0.100 20 0 "[ . 1 . 2]" 2
30 1 8 GLN O 1 12 ALA N . . 2.950 2.970 2.947 2.986 0.036 16 0 "[ . 1 . 2]" 2
31 1 13 PHE O 1 17 ASP H . . 1.950 2.042 2.024 2.051 0.101 20 0 "[ . 1 . 2]" 2
32 1 13 PHE O 1 17 ASP N . . 2.950 2.958 2.948 2.981 0.031 13 0 "[ . 1 . 2]" 2
33 1 30 ALA O 1 34 LYS H . . 1.950 2.039 2.013 2.050 0.100 7 0 "[ . 1 . 2]" 2
34 1 30 ALA O 1 34 LYS N . . 2.950 2.966 2.952 2.995 0.045 15 0 "[ . 1 . 2]" 2
35 1 31 LEU O 1 35 GLY H . . 1.950 2.015 1.981 2.042 0.092 9 0 "[ . 1 . 2]" 2
36 1 31 LEU O 1 35 GLY N . . 2.950 2.978 2.953 3.014 0.064 8 0 "[ . 1 . 2]" 2
37 1 32 ALA O 1 36 LEU H . . 1.950 2.040 2.012 2.050 0.100 20 0 "[ . 1 . 2]" 2
38 1 32 ALA O 1 36 LEU N . . 2.950 2.957 2.951 2.972 0.022 11 0 "[ . 1 . 2]" 2
39 1 43 ARG O 1 47 GLU H . . 1.950 2.036 1.997 2.050 0.100 7 0 "[ . 1 . 2]" 2
40 1 43 ARG O 1 47 GLU N . . 2.950 3.008 2.970 3.022 0.072 7 0 "[ . 1 . 2]" 2
41 1 44 ASP O 1 48 ARG H . . 1.950 2.048 2.038 2.054 0.104 14 0 "[ . 1 . 2]" 2
42 1 44 ASP O 1 48 ARG N . . 2.950 2.953 2.946 2.968 0.018 10 0 "[ . 1 . 2]" 2
43 1 45 GLU O 1 49 THR H . . 1.950 2.043 2.025 2.051 0.101 7 0 "[ . 1 . 2]" 2
44 1 45 GLU O 1 49 THR N . . 2.950 2.961 2.950 2.971 0.021 14 0 "[ . 1 . 2]" 2
45 1 46 VAL O 1 50 VAL H . . 1.950 2.044 2.014 2.051 0.101 8 0 "[ . 1 . 2]" 2
46 1 46 VAL O 1 50 VAL N . . 2.950 2.994 2.966 3.015 0.065 20 0 "[ . 1 . 2]" 2
47 1 47 GLU O 1 51 ARG H . . 1.950 2.050 2.048 2.051 0.101 20 0 "[ . 1 . 2]" 2
48 1 47 GLU O 1 51 ARG N . . 2.950 2.951 2.949 2.957 0.007 9 0 "[ . 1 . 2]" 2
49 1 48 ARG O 1 52 SER H . . 1.950 2.040 2.006 2.050 0.100 16 0 "[ . 1 . 2]" 2
50 1 48 ARG O 1 52 SER N . . 2.950 2.974 2.952 2.985 0.035 19 0 "[ . 1 . 2]" 2
51 1 49 THR O 1 53 MET H . . 1.950 1.993 1.973 2.040 0.090 20 0 "[ . 1 . 2]" 2
52 1 49 THR O 1 53 MET N . . 2.950 2.962 2.949 3.011 0.061 20 0 "[ . 1 . 2]" 2
53 1 63 TYR O 1 67 GLU H . . 1.950 2.041 1.984 2.051 0.101 20 0 "[ . 1 . 2]" 2
54 1 63 TYR O 1 67 GLU N . . 2.950 3.019 2.961 3.030 0.080 13 0 "[ . 1 . 2]" 2
55 1 64 GLY O 1 68 ARG H . . 1.950 2.049 2.047 2.055 0.105 20 0 "[ . 1 . 2]" 2
56 1 64 GLY O 1 68 ARG N . . 2.950 2.951 2.946 2.960 0.010 3 0 "[ . 1 . 2]" 2
57 1 65 GLU O 1 69 MET H . . 1.950 2.043 2.021 2.048 0.098 7 0 "[ . 1 . 2]" 2
58 1 65 GLU O 1 69 MET N . . 2.950 2.958 2.948 2.983 0.033 14 0 "[ . 1 . 2]" 2
59 1 69 MET O 1 73 ARG H . . 1.950 2.023 1.991 2.049 0.099 13 0 "[ . 1 . 2]" 2
60 1 69 MET O 1 73 ARG N . . 2.950 2.981 2.954 3.011 0.061 3 0 "[ . 1 . 2]" 2
61 1 70 VAL O 1 74 MET H . . 1.950 1.991 1.949 2.047 0.097 10 0 "[ . 1 . 2]" 2
62 1 81 GLU O 1 85 LYS H . . 1.950 2.014 1.973 2.049 0.099 7 0 "[ . 1 . 2]" 2
63 1 81 GLU O 1 85 LYS N . . 2.950 2.982 2.951 3.020 0.070 20 0 "[ . 1 . 2]" 2
64 1 82 GLU O 1 86 ALA H . . 1.950 2.032 1.989 2.048 0.098 19 0 "[ . 1 . 2]" 2
65 1 82 GLU O 1 86 ALA N . . 2.950 2.963 2.950 2.981 0.031 1 0 "[ . 1 . 2]" 2
66 1 83 VAL O 1 87 PHE H . . 1.950 2.022 1.991 2.048 0.098 13 0 "[ . 1 . 2]" 2
67 1 83 VAL O 1 87 PHE N . . 2.950 2.977 2.950 3.006 0.056 18 0 "[ . 1 . 2]" 2
68 1 84 LEU O 1 88 GLN H . . 1.950 2.021 1.973 2.049 0.099 9 0 "[ . 1 . 2]" 2
69 1 84 LEU O 1 88 GLN N . . 2.950 2.984 2.950 3.023 0.073 10 0 "[ . 1 . 2]" 2
70 1 85 LYS O 1 89 LEU H . . 1.950 2.028 2.000 2.050 0.100 1 0 "[ . 1 . 2]" 2
71 1 85 LYS O 1 89 LEU N . . 2.950 2.966 2.951 2.985 0.035 1 0 "[ . 1 . 2]" 2
72 1 86 ALA O 1 90 PHE H . . 1.950 2.025 1.981 2.050 0.100 2 0 "[ . 1 . 2]" 2
73 1 86 ALA O 1 90 PHE N . . 2.950 2.966 2.951 2.992 0.042 16 0 "[ . 1 . 2]" 2
74 1 100 PHE O 1 104 LYS H . . 1.950 2.025 1.992 2.047 0.097 17 0 "[ . 1 . 2]" 2
75 1 100 PHE O 1 104 LYS N . . 2.950 2.973 2.951 2.999 0.049 20 0 "[ . 1 . 2]" 2
76 1 101 ALA O 1 105 GLU H . . 1.950 2.021 1.982 2.047 0.097 1 0 "[ . 1 . 2]" 2
77 1 101 ALA O 1 105 GLU N . . 2.950 2.995 2.957 3.020 0.070 18 0 "[ . 1 . 2]" 2
78 1 102 ASN O 1 106 VAL H . . 1.950 2.020 1.993 2.049 0.099 16 0 "[ . 1 . 2]" 2
79 1 102 ASN O 1 106 VAL N . . 2.950 2.990 2.953 3.023 0.073 16 0 "[ . 1 . 2]" 2
80 1 103 LEU O 1 107 ALA H . . 1.950 2.039 2.022 2.050 0.100 8 0 "[ . 1 . 2]" 2
81 1 103 LEU O 1 107 ALA N . . 2.950 2.962 2.951 2.984 0.034 1 0 "[ . 1 . 2]" 2
82 1 104 LYS O 1 108 LYS H . . 1.950 2.016 1.978 2.048 0.098 7 0 "[ . 1 . 2]" 2
83 1 104 LYS O 1 108 LYS N . . 2.950 2.985 2.950 3.020 0.070 7 0 "[ . 1 . 2]" 2
84 1 105 GLU O 1 109 LEU H . . 1.950 2.002 1.964 2.048 0.098 10 0 "[ . 1 . 2]" 2
85 1 116 ASP O 1 120 GLN H . . 1.950 2.070 2.069 2.071 0.121 11 0 "[ . 1 . 2]" 2
86 1 116 ASP O 1 120 GLN N . . 2.950 3.039 3.038 3.039 0.089 6 0 "[ . 1 . 2]" 2
87 1 117 ASP O 1 121 GLU H . . 1.950 2.052 2.051 2.052 0.102 7 0 "[ . 1 . 2]" 2
88 1 117 ASP O 1 121 GLU N . . 2.950 2.958 2.957 2.959 0.009 11 0 "[ . 1 . 2]" 2
89 1 118 VAL O 1 122 MET H . . 1.950 2.067 2.066 2.068 0.118 5 0 "[ . 1 . 2]" 2
90 1 118 VAL O 1 122 MET N . . 2.950 2.936 2.935 2.937 . 0 0 "[ . 1 . 2]" 2
91 1 119 LEU O 1 123 ILE H . . 1.950 2.059 2.058 2.059 0.109 8 0 "[ . 1 . 2]" 2
92 1 119 LEU O 1 123 ILE N . . 2.950 3.038 3.037 3.039 0.089 7 0 "[ . 1 . 2]" 2
93 1 120 GLN O 1 124 ALA H . . 1.950 2.053 2.052 2.054 0.104 2 0 "[ . 1 . 2]" 2
94 1 120 GLN O 1 124 ALA N . . 2.950 2.943 2.942 2.944 . 0 0 "[ . 1 . 2]" 2
95 1 121 GLU O 1 125 GLU H . . 1.950 2.031 2.015 2.041 0.091 13 0 "[ . 1 . 2]" 2
96 1 121 GLU O 1 125 GLU N . . 2.950 2.968 2.958 2.990 0.040 13 0 "[ . 1 . 2]" 2
97 1 122 MET O 1 126 ALA H . . 1.950 2.013 1.973 2.048 0.098 18 0 "[ . 1 . 2]" 2
98 1 122 MET O 1 126 ALA N . . 2.950 2.991 2.953 3.026 0.076 2 0 "[ . 1 . 2]" 2
99 1 123 ILE O 1 127 ASP H . . 1.950 2.007 1.977 2.030 0.080 5 0 "[ . 1 . 2]" 2
100 1 136 PHE O 1 140 LYS H . . 1.950 2.013 1.976 2.046 0.096 16 0 "[ . 1 . 2]" 2
101 1 136 PHE O 1 140 LYS N . . 2.950 2.990 2.955 3.025 0.075 16 0 "[ . 1 . 2]" 2
102 1 137 GLU O 1 141 SER H . . 1.950 2.033 1.998 2.049 0.099 13 0 "[ . 1 . 2]" 2
103 1 137 GLU O 1 141 SER N . . 2.950 2.967 2.952 3.004 0.054 8 0 "[ . 1 . 2]" 2
104 1 138 GLU O 1 142 VAL H . . 1.950 2.025 1.977 2.048 0.098 17 0 "[ . 1 . 2]" 2
105 1 138 GLU O 1 142 VAL N . . 2.950 2.985 2.952 3.016 0.066 17 0 "[ . 1 . 2]" 2
106 1 139 PHE O 1 143 MET H . . 1.950 2.016 1.986 2.045 0.095 3 0 "[ . 1 . 2]" 2
107 1 139 PHE O 1 143 MET N . . 2.950 2.976 2.952 3.012 0.062 3 0 "[ . 1 . 2]" 2
108 1 140 LYS O 1 144 MET H . . 1.950 2.014 1.978 2.046 0.096 15 0 "[ . 1 . 2]" 2
109 1 140 LYS O 1 144 MET N . . 2.950 2.981 2.950 3.013 0.063 15 0 "[ . 1 . 2]" 2
110 1 141 SER O 1 145 GLN H . . 1.950 2.023 1.997 2.048 0.098 8 0 "[ . 1 . 2]" 2
111 1 141 SER O 1 145 GLN N . . 2.950 2.967 2.951 2.993 0.043 10 0 "[ . 1 . 2]" 2
112 1 142 VAL O 1 146 MET H . . 1.950 2.022 1.989 2.049 0.099 1 0 "[ . 1 . 2]" 2
113 1 142 VAL O 1 146 MET N . . 2.950 2.973 2.953 2.999 0.049 17 0 "[ . 1 . 2]" 2
114 1 143 MET O 1 147 ARG H . . 1.950 2.021 1.994 2.048 0.098 3 0 "[ . 1 . 2]" 2
115 1 143 MET O 1 147 ARG N . . 2.950 2.978 2.953 3.003 0.053 9 0 "[ . 1 . 2]" 2
116 1 144 MET O 1 148 GLY H . . 1.950 2.027 1.998 2.047 0.097 18 0 "[ . 1 . 2]" 2
117 1 144 MET O 1 148 GLY N . . 2.950 2.972 2.950 3.009 0.059 10 0 "[ . 1 . 2]" 2
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