Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
596855 | 2mpx RC | 25005 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mpx
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 1025
_Distance_constraint_stats_list.Viol_count 2092
_Distance_constraint_stats_list.Viol_total 34268.516
_Distance_constraint_stats_list.Viol_max 8.517
_Distance_constraint_stats_list.Viol_rms 0.9976
_Distance_constraint_stats_list.Viol_average_all_restraints 0.3343
_Distance_constraint_stats_list.Viol_average_violations_only 1.6381
_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 PRO 111.536 4.186 6 10 [-****+****]
1 2 LEU 64.017 2.822 6 10 [*****+*-**]
1 3 ARG 37.747 2.316 7 10 [****-*+***]
1 4 VAL 88.748 2.963 9 10 [*-******+*]
1 5 GLY 7.895 1.146 1 7 "[+***- ** 1]"
1 6 SER 124.779 4.186 6 10 [**-**+****]
1 7 ARG 173.795 7.599 5 10 [****+****-]
1 8 VAL 184.116 5.661 6 10 [*****+***-]
1 9 GLU 46.478 1.673 9 10 [*****-**+*]
1 10 VAL 50.094 5.786 3 10 [*-+*******]
1 11 ILE 157.599 4.258 4 10 [***+****-*]
1 12 GLY 4.771 0.941 4 4 "[ **+- 1]"
1 13 LYS 80.917 5.210 9 10 [********+-]
1 14 GLY 0.000 0.000 . 0 "[ . 1]"
1 15 HIS 163.212 4.258 4 10 [***+*****-]
1 16 ARG 156.279 4.591 10 10 [********-+]
1 17 GLY 20.908 1.564 6 10 [*****+**-*]
1 18 THR 122.205 4.311 6 10 [*****+***-]
1 19 VAL 4.731 0.749 9 4 "[* - * +1]"
1 20 ALA 30.025 2.316 7 10 [******+*-*]
1 21 TYR 128.132 4.143 9 10 [***-****+*]
1 22 VAL 59.010 4.101 7 10 [******+-**]
1 23 GLY 30.853 3.159 9 10 [**-*****+*]
1 24 ALA 5.086 0.553 8 1 "[ . + 1]"
1 25 THR 0.675 0.173 8 0 "[ . 1]"
1 26 LEU 395.543 6.235 4 10 [***+******]
1 27 PHE 132.554 6.465 3 10 [**+*-*****]
1 28 ALA 103.261 4.038 10 10 [***-*****+]
1 29 THR 17.706 1.549 9 10 [********+-]
1 30 GLY 0.675 0.173 8 0 "[ . 1]"
1 31 LYS 183.607 6.465 3 10 [**+-******]
1 32 TRP 76.290 4.770 2 10 [*+*****-**]
1 33 VAL 65.957 2.821 8 10 [*******+*-]
1 34 GLY 25.693 2.843 7 10 [*-****+***]
1 35 VAL 177.803 3.532 4 10 [***+****-*]
1 36 ILE 249.536 4.132 5 10 [****+****-]
1 37 LEU 120.493 4.311 6 10 [*-***+****]
1 38 ASP 153.105 8.517 7 10 [*-****+***]
1 39 GLU 33.446 2.190 10 10 [******-**+]
1 40 ALA 81.534 6.412 3 10 [**+*-*****]
1 41 LYS 327.565 7.388 4 10 [***+***-**]
1 42 GLY 5.438 0.715 8 6 "[ - ** +**]"
1 43 LYS 182.236 3.327 3 10 [-*+*******]
1 44 ASN 118.127 8.517 7 10 [******+-**]
1 45 ASP 183.670 7.388 4 10 [-**+******]
1 46 GLY 152.584 6.936 4 10 [***+-*****]
1 47 THR 36.337 1.419 10 10 [****-****+]
1 48 VAL 193.849 5.464 1 10 [+*-*******]
1 49 GLN 115.732 3.676 7 10 [***-**+***]
1 50 GLY 0.000 0.000 . 0 "[ . 1]"
1 51 ARG 194.398 5.173 1 10 [+***-*****]
1 52 LYS 235.364 6.235 4 10 [*-*+******]
1 53 TYR 156.108 4.661 2 10 [*+********]
1 54 PHE 128.478 6.412 3 10 [**+*-*****]
1 55 THR 146.830 5.464 1 10 [+*-*******]
1 56 CYS 52.196 1.875 4 10 [***+*****-]
1 57 ASP 144.347 4.661 2 10 [*+****-***]
1 58 GLU 253.294 4.658 2 10 [*+*-******]
1 59 GLY 38.536 1.875 4 10 [***+******]
1 60 HIS 101.527 3.014 6 10 [*****+-***]
1 61 GLY 17.726 1.085 2 10 [*+*-******]
1 62 ILE 80.910 4.591 10 10 [*******-*+]
1 63 PHE 70.028 3.360 2 10 [*+*******-]
1 64 VAL 72.253 3.499 7 10 [******+*-*]
1 65 ARG 99.752 5.661 6 10 [*****+****]
1 66 GLN 154.409 5.439 6 10 [*****+****]
1 67 SER 39.675 1.696 7 10 [******+-**]
1 68 GLN 101.178 7.599 5 10 [*-**+*****]
1 69 ILE 99.374 5.210 9 10 [********+*]
1 70 GLN 23.557 2.357 5 10 [****+-****]
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 PRO CG 1 3 ARG C 4.600 . 8.200 8.097 7.650 8.372 0.172 9 0 "[ . 1]" 1
2 1 4 VAL CA 1 5 GLY CA 4.600 . 8.200 3.817 3.797 3.831 . 0 0 "[ . 1]" 1
3 1 5 GLY CA 1 6 SER CA 3.825 . 6.650 3.813 3.800 3.829 . 0 0 "[ . 1]" 1
4 1 17 GLY CA 1 36 ILE CA 4.600 . 8.200 6.044 5.437 6.311 . 0 0 "[ . 1]" 1
5 1 18 THR CA 1 19 VAL CA 3.825 . 6.650 3.791 3.780 3.814 . 0 0 "[ . 1]" 1
6 1 19 VAL CA 1 20 ALA CA 3.825 . 6.650 3.799 3.789 3.808 . 0 0 "[ . 1]" 1
7 1 19 VAL CA 1 35 VAL CA 3.825 . 6.650 4.974 4.800 5.280 . 0 0 "[ . 1]" 1
8 1 19 VAL CB 1 20 ALA CA 3.825 . 6.650 4.629 4.556 4.728 . 0 0 "[ . 1]" 1
9 1 20 ALA CA 1 21 TYR CA 3.825 . 6.650 3.790 3.776 3.805 . 0 0 "[ . 1]" 1
10 1 21 TYR CB 1 22 VAL CA 4.600 . 6.650 4.581 4.554 4.604 . 0 0 "[ . 1]" 1
11 1 21 TYR CB 1 52 LYS CB 4.600 . 8.200 8.380 8.241 8.538 0.338 7 0 "[ . 1]" 1
12 1 22 VAL CA 1 23 GLY CA 3.825 . 6.650 3.813 3.805 3.823 . 0 0 "[ . 1]" 1
13 1 23 GLY CA 1 24 ALA CA 3.825 . 6.650 3.810 3.801 3.816 . 0 0 "[ . 1]" 1
14 1 23 GLY CA 1 32 TRP CA 3.825 . 6.650 5.262 5.163 5.370 . 0 0 "[ . 1]" 1
15 1 26 LEU CG 1 28 ALA C 3.825 . 6.650 7.672 7.511 7.844 1.194 8 10 [****-**+**] 1
16 1 25 THR CB 1 27 PHE CA 3.825 . 6.650 4.997 4.908 5.096 . 0 0 "[ . 1]" 1
17 1 27 PHE CA 1 28 ALA CA 3.825 . 6.650 3.810 3.805 3.816 . 0 0 "[ . 1]" 1
18 1 31 LYS CA 1 63 PHE CB 3.825 . 6.650 9.606 9.159 9.843 3.193 4 10 [**-+******] 1
19 1 32 TRP CA 1 33 VAL CA 3.825 . 6.650 3.789 3.782 3.804 . 0 0 "[ . 1]" 1
20 1 33 VAL CA 1 34 GLY CA 3.825 . 6.650 3.804 3.799 3.812 . 0 0 "[ . 1]" 1
21 1 39 GLU CB 1 40 ALA CA 4.600 . 8.200 4.539 4.512 4.575 . 0 0 "[ . 1]" 1
22 1 40 ALA CA 1 60 HIS CA 4.600 . 8.200 5.366 5.281 5.519 . 0 0 "[ . 1]" 1
23 1 46 GLY CA 1 54 PHE CA 3.825 . 6.650 5.137 5.056 5.194 . 0 0 "[ . 1]" 1
24 1 46 GLY CA 1 56 CYS CA 3.825 . 6.650 4.362 4.200 4.529 . 0 0 "[ . 1]" 1
25 1 46 GLY CA 1 47 THR CA 3.825 . 6.650 3.792 3.780 3.799 . 0 0 "[ . 1]" 1
26 1 46 GLY CA 1 48 VAL CA 3.825 . 6.650 6.857 6.785 6.916 0.266 1 0 "[ . 1]" 1
27 1 58 GLU CA 1 59 GLY CA 3.825 . 6.650 3.799 3.789 3.812 . 0 0 "[ . 1]" 1
28 1 59 GLY CA 1 60 HIS CA 3.825 . 6.650 3.807 3.800 3.813 . 0 0 "[ . 1]" 1
29 1 31 LYS CA 1 63 PHE CB 3.825 . 6.650 6.112 5.796 6.334 . 0 0 "[ . 1]" 1
30 1 41 LYS CG 1 60 HIS CA 4.000 . 7.000 6.976 6.847 7.093 0.093 4 0 "[ . 1]" 1
31 1 9 GLU CB 1 15 HIS CA 3.350 . 5.700 6.680 6.514 6.802 1.102 5 10 [****+****-] 1
32 1 22 VAL CB 1 32 TRP CA 3.350 . 5.700 6.311 6.048 6.699 0.999 5 5 "[** +* - 1]" 1
33 1 35 VAL CB 1 37 LEU CA 3.350 . 5.700 5.899 5.694 6.290 0.590 4 1 "[ +. 1]" 1
34 1 48 VAL CB 1 58 GLU CA 3.350 . 5.700 9.503 9.249 9.748 4.048 2 10 [*+*****-**] 1
35 1 35 VAL CB 1 63 PHE CA 3.350 . 5.700 6.369 6.274 6.526 0.826 1 10 [+********-] 1
36 1 27 PHE CA 1 48 VAL CB 4.000 . 7.000 6.863 6.573 7.020 0.020 9 0 "[ . 1]" 1
37 1 38 ASP CA 1 39 GLU CG 3.350 . 5.700 5.119 5.060 5.154 . 0 0 "[ . 1]" 1
38 1 65 ARG CB 1 68 GLN CA 4.000 . 6.650 4.969 4.704 5.181 . 0 0 "[ . 1]" 1
39 1 51 ARG CB 1 52 LYS CA 3.350 . 5.700 4.697 4.662 4.735 . 0 0 "[ . 1]" 1
40 1 4 VAL CG1 1 18 THR CB 4.000 . 7.000 9.367 7.878 9.963 2.963 9 10 [******-*+*] 1
41 1 24 ALA CB 1 25 THR CA 3.350 . 5.700 4.558 4.502 4.605 . 0 0 "[ . 1]" 1
42 1 65 ARG CG 1 66 GLN CG 4.000 . 7.000 6.734 6.176 7.225 0.225 9 0 "[ . 1]" 1
43 1 9 GLU CB 1 70 GLN CB 4.000 . 7.000 4.539 3.844 5.139 . 0 0 "[ . 1]" 1
44 1 49 GLN CG 1 51 ARG CG 3.350 . 5.700 7.037 5.564 7.295 1.595 5 9 "[-***+*** *]" 1
45 1 26 LEU CG 1 49 GLN CG 3.350 . 5.700 5.093 4.079 6.218 0.518 4 1 "[ +. 1]" 1
46 1 7 ARG CG 1 16 ARG CB 3.350 . 5.700 6.762 5.657 7.389 1.689 1 7 "[+** * * *-]" 1
47 1 7 ARG CB 1 9 GLU CB 4.000 . 5.700 6.965 6.709 7.343 1.643 2 10 [*+***-****] 1
48 1 7 ARG CB 1 16 ARG CB 4.000 . 7.000 6.817 6.293 7.227 0.227 6 0 "[ . 1]" 1
49 1 7 ARG CB 1 9 GLU CB 4.000 . 7.000 5.918 5.814 6.058 . 0 0 "[ . 1]" 1
50 1 51 ARG CG 1 52 LYS CB 4.000 . 7.000 5.743 5.638 5.842 . 0 0 "[ . 1]" 1
51 1 36 ILE CG1 1 41 LYS CB 3.350 . 5.700 6.995 5.557 7.248 1.548 5 9 "[-***+*** *]" 1
52 1 26 LEU CG 1 52 LYS CB 3.350 . 5.700 11.140 10.202 11.577 5.877 10 10 [**-******+] 1
53 1 43 LYS CG 1 58 GLU CB 4.000 . 7.000 6.942 6.554 7.261 0.261 1 0 "[ . 1]" 1
54 1 66 GLN CB 1 69 ILE CG1 4.000 . 7.000 4.923 4.689 5.475 . 0 0 "[ . 1]" 1
55 1 22 VAL CB 1 33 VAL CB 3.350 . 5.700 4.881 4.655 5.268 . 0 0 "[ . 1]" 1
56 1 52 LYS CB 1 54 PHE CB 4.000 . 6.650 6.825 6.744 6.883 0.233 8 0 "[ . 1]" 1
57 1 48 VAL CB 1 51 ARG CB 4.000 . 7.000 5.311 5.201 5.512 . 0 0 "[ . 1]" 1
58 1 35 VAL CB 1 36 ILE CG1 3.350 . 5.700 5.780 5.652 5.939 0.239 7 0 "[ . 1]" 1
59 1 35 VAL CB 1 37 LEU CG 4.000 . 7.000 6.167 5.893 6.934 . 0 0 "[ . 1]" 1
60 1 10 VAL CB 1 69 ILE CG1 4.000 . 7.000 5.118 5.027 5.226 . 0 0 "[ . 1]" 1
61 1 33 VAL CB 1 69 ILE CG1 4.000 . 7.000 5.056 4.778 5.563 . 0 0 "[ . 1]" 1
62 1 19 VAL CB 1 33 VAL CG2 4.000 . 7.000 6.363 5.974 6.900 . 0 0 "[ . 1]" 1
63 1 35 VAL CB 1 60 HIS CB 3.350 . 5.700 8.060 7.916 8.463 2.763 4 10 [***+****-*] 1
64 1 31 LYS CB 1 65 ARG CB 3.350 . 5.700 5.787 5.728 5.860 0.160 1 0 "[ . 1]" 1
65 1 41 LYS CB 1 43 LYS CD 3.350 . 5.700 7.966 7.865 8.077 2.377 4 10 [**-+******] 1
66 1 9 GLU CB 1 15 HIS C 3.350 . 5.700 5.600 5.333 5.853 0.153 4 0 "[ . 1]" 1
67 1 16 ARG CB 1 18 THR C 3.350 . 5.700 3.500 3.445 3.554 . 0 0 "[ . 1]" 1
68 1 3 ARG C 1 19 VAL CB 4.000 . 7.000 5.061 4.554 5.488 . 0 0 "[ . 1]" 1
69 1 66 GLN CG 1 67 SER C 4.000 . 7.000 5.619 5.175 6.427 . 0 0 "[ . 1]" 1
70 1 54 PHE C 1 55 THR CA 3.350 . 5.700 2.419 2.413 2.423 . 0 0 "[ . 1]" 1
71 1 17 GLY C 1 18 THR CA 3.350 . 5.700 2.444 2.433 2.453 . 0 0 "[ . 1]" 1
72 1 34 GLY C 1 35 VAL CA 4.000 . 7.000 2.440 2.433 2.451 . 0 0 "[ . 1]" 1
73 1 6 SER CB 1 19 VAL C 4.000 . 7.000 4.612 4.519 4.746 . 0 0 "[ . 1]" 1
74 1 25 THR CA 1 30 GLY C 4.000 . 7.000 7.065 6.981 7.173 0.173 8 0 "[ . 1]" 1
75 1 62 ILE C 1 64 VAL CA 4.000 . 7.000 4.934 4.852 4.996 . 0 0 "[ . 1]" 1
76 1 15 HIS C 1 16 ARG CA 4.000 . 7.000 2.446 2.433 2.460 . 0 0 "[ . 1]" 1
77 1 8 VAL C 1 15 HIS CA 3.350 . 5.700 6.595 6.349 6.824 1.124 2 10 [*+***-****] 1
78 1 24 ALA C 1 25 THR CA 4.000 . 7.000 2.424 2.419 2.429 . 0 0 "[ . 1]" 1
79 1 57 ASP C 1 58 GLU CA 4.000 . 7.000 2.419 2.411 2.428 . 0 0 "[ . 1]" 1
80 1 26 LEU CA 1 27 PHE C 3.350 . 5.700 4.361 4.339 4.372 . 0 0 "[ . 1]" 1
81 1 46 GLY C 1 51 ARG CA 3.350 . 5.700 5.252 5.183 5.334 . 0 0 "[ . 1]" 1
82 1 5 GLY C 1 7 ARG CA 3.350 . 5.700 4.464 4.413 4.506 . 0 0 "[ . 1]" 1
83 1 25 THR C 1 26 LEU CA 4.000 . 7.000 2.425 2.413 2.434 . 0 0 "[ . 1]" 1
84 1 41 LYS CA 1 42 GLY C 4.000 . 7.000 4.542 4.499 4.569 . 0 0 "[ . 1]" 1
85 1 42 GLY C 1 44 ASN CA 4.000 . 7.000 4.607 4.475 4.738 . 0 0 "[ . 1]" 1
86 1 44 ASN CB 1 57 ASP C 4.000 . 7.000 3.883 3.605 4.352 . 0 0 "[ . 1]" 1
87 1 44 ASN CB 1 58 GLU C 4.000 . 7.000 5.016 4.839 5.443 . 0 0 "[ . 1]" 1
88 1 37 LEU C 1 38 ASP CB 3.350 . 5.700 3.646 3.635 3.654 . 0 0 "[ . 1]" 1
89 1 43 LYS C 1 44 ASN CB 4.000 . 7.000 3.554 3.519 3.603 . 0 0 "[ . 1]" 1
90 1 19 VAL C 1 35 VAL CB 3.350 . 5.700 6.151 5.930 6.449 0.749 9 4 "[* - * +1]" 1
91 1 8 VAL CB 1 15 HIS C 3.350 . 5.700 6.294 5.810 6.763 1.063 2 5 "[ + -* **]" 1
92 1 2 LEU CG 1 3 ARG C 3.350 . 5.700 5.327 4.688 5.705 0.005 7 0 "[ . 1]" 1
93 1 25 THR CB 1 26 LEU CA 3.350 . 5.700 4.385 4.336 4.432 . 0 0 "[ . 1]" 1
94 1 15 HIS CB 1 39 GLU CA 3.350 . 5.700 7.519 7.004 7.890 2.190 10 10 [****-****+] 1
95 1 43 LYS CG 1 45 ASP CA 4.000 . 7.000 6.730 5.657 7.210 0.210 8 0 "[ . 1]" 1
96 1 66 GLN CB 1 67 SER CB 3.350 . 5.700 5.321 5.252 5.425 . 0 0 "[ . 1]" 1
97 1 56 CYS C 1 59 GLY CA 3.350 . 5.700 7.504 7.417 7.575 1.875 4 10 [***+**-***] 1
98 1 43 LYS C 1 44 ASN CB 3.350 . 5.700 3.525 3.495 3.565 . 0 0 "[ . 1]" 1
99 1 1 PRO CG 1 2 LEU CA 3.350 . 5.700 4.970 4.567 5.309 . 0 0 "[ . 1]" 1
100 1 65 ARG CB 1 68 GLN CG 3.350 . 5.700 5.533 4.874 5.800 0.100 9 0 "[ . 1]" 1
101 1 23 GLY CA 1 32 TRP C 3.350 . 5.700 4.334 4.285 4.385 . 0 0 "[ . 1]" 1
102 1 7 ARG CA 1 9 GLU C 3.350 . 5.700 2.170 2.165 2.173 . 0 0 "[ . 1]" 1
103 1 8 VAL CG1 1 10 VAL CB 4.000 . 7.000 7.193 6.549 7.929 0.929 10 4 "[ - ** +]" 1
104 1 46 GLY CA 1 47 THR CB 4.000 . 5.700 4.468 4.454 4.474 . 0 0 "[ . 1]" 1
105 1 28 ALA CB 1 48 VAL CG1 3.350 . 5.700 9.414 9.050 9.738 4.038 10 10 [******-**+] 1
106 1 35 VAL CG1 1 36 ILE CB 4.000 . 7.000 5.328 5.232 5.396 . 0 0 "[ . 1]" 1
107 1 57 ASP C 1 58 GLU CA 3.350 . 5.700 2.428 2.421 2.438 . 0 0 "[ . 1]" 1
108 1 3 ARG CA 1 4 VAL C 3.350 . 5.700 3.871 3.860 3.888 . 0 0 "[ . 1]" 1
109 1 20 ALA CB 1 21 TYR C 4.000 . 7.000 4.695 4.677 4.717 . 0 0 "[ . 1]" 1
110 1 44 ASN CB 1 58 GLU C 4.000 . 7.000 4.963 4.802 5.322 . 0 0 "[ . 1]" 1
111 1 65 ARG CA 1 66 GLN CB 3.350 . 5.700 4.845 4.832 4.864 . 0 0 "[ . 1]" 1
112 1 49 GLN CB 1 51 ARG CA 4.000 . 5.700 5.499 5.397 5.754 0.054 9 0 "[ . 1]" 1
113 1 26 LEU CA 1 49 GLN CB 4.000 . 7.000 5.971 5.197 6.527 . 0 0 "[ . 1]" 1
114 1 43 LYS CD 1 45 ASP CA 3.350 . 5.700 6.852 5.770 7.132 1.432 2 9 [-+*******1] 1
115 1 11 ILE CG1 1 15 HIS CA 4.000 . 5.700 9.677 9.272 9.958 4.258 4 10 [***+****-*] 1
116 1 3 ARG CA 1 4 VAL CB 3.350 . 5.700 4.840 4.813 4.854 . 0 0 "[ . 1]" 1
117 1 44 ASN CA 1 58 GLU CB 4.000 . 7.000 4.607 4.530 4.742 . 0 0 "[ . 1]" 1
118 1 7 ARG CB 1 9 GLU CA 4.000 . 7.000 6.995 6.912 7.109 0.109 2 0 "[ . 1]" 1
119 1 45 ASP CA 1 56 CYS CB 4.000 . 7.000 4.678 4.402 4.970 . 0 0 "[ . 1]" 1
120 1 6 SER CB 1 7 ARG CG 3.350 . 5.700 5.787 5.046 6.675 0.975 8 3 "[ *.- + 1]" 1
121 1 36 ILE CB 1 37 LEU CA 3.350 . 5.700 4.801 4.688 4.854 . 0 0 "[ . 1]" 1
122 1 26 LEU CA 1 27 PHE CB 4.000 . 7.000 4.843 4.835 4.858 . 0 0 "[ . 1]" 1
123 1 3 ARG CA 1 22 VAL CB 3.350 . 5.700 6.653 6.150 7.065 1.365 7 9 "[****- +***]" 1
124 1 26 LEU CA 1 48 VAL CB 3.350 . 5.700 8.332 7.496 8.556 2.856 7 10 [**-***+***] 1
125 1 56 CYS CA 1 58 GLU CB 3.350 . 5.700 6.497 6.454 6.558 0.858 3 10 [**+******-] 1
126 1 4 VAL CA 1 21 TYR CB 4.000 . 5.700 6.952 6.822 7.084 1.384 4 10 [***+***-**] 1
127 1 7 ARG CG 1 8 VAL C 4.000 . 7.000 5.237 4.230 6.300 . 0 0 "[ . 1]" 1
128 1 14 GLY C 1 15 HIS CA 4.000 . 7.000 2.436 2.420 2.446 . 0 0 "[ . 1]" 1
129 1 17 GLY C 1 18 THR CA 3.350 . 5.700 2.445 2.433 2.453 . 0 0 "[ . 1]" 1
130 1 36 ILE CA 1 37 LEU CA 3.350 . 5.700 3.789 3.774 3.798 . 0 0 "[ . 1]" 1
131 1 20 ALA CB 1 36 ILE CB 3.350 . 5.700 6.473 6.256 6.652 0.952 4 10 [***+****-*] 1
132 1 36 ILE CG2 1 37 LEU CA 4.000 . 5.700 5.499 4.879 6.067 0.367 10 0 "[ . 1]" 1
133 1 17 GLY C 1 37 LEU CD1 4.000 . 7.000 7.999 7.512 8.510 1.510 6 10 [*****+**-*] 1
134 1 46 GLY CA 1 47 THR CG2 3.350 . 5.700 4.369 4.309 4.391 . 0 0 "[ . 1]" 1
135 1 54 PHE CB 1 55 THR CG2 3.350 . 5.700 5.678 5.258 5.781 0.081 5 0 "[ . 1]" 1
136 1 4 VAL CG1 1 6 SER CB 3.825 . 6.650 7.710 7.540 7.817 1.167 10 10 [**-******+] 1
137 1 66 GLN C 1 69 ILE CD1 3.825 . 6.650 4.776 4.540 5.417 . 0 0 "[ . 1]" 1
138 1 64 VAL C 1 69 ILE CD1 4.600 . 8.200 5.353 5.157 5.537 . 0 0 "[ . 1]" 1
139 1 62 ILE C 1 63 PHE CB 4.600 . 8.200 3.671 3.657 3.689 . 0 0 "[ . 1]" 1
140 1 37 LEU CB 1 41 LYS C 4.600 . 8.200 5.423 4.941 5.590 . 0 0 "[ . 1]" 1
141 1 54 PHE C 1 57 ASP CB 4.600 . 8.200 3.655 3.640 3.665 . 0 0 "[ . 1]" 1
142 1 47 THR C 1 57 ASP CB 4.600 . 8.200 9.153 8.935 9.285 1.085 2 10 [*+*****-**] 1
143 1 57 ASP CB 1 60 HIS C 4.600 . 8.200 7.907 7.703 8.054 . 0 0 "[ . 1]" 1
144 1 44 ASN C 1 45 ASP CB 3.825 . 6.650 3.688 3.674 3.704 . 0 0 "[ . 1]" 1
145 1 43 LYS C 1 44 ASN CB 3.825 . 6.650 3.494 3.459 3.549 . 0 0 "[ . 1]" 1
146 1 41 LYS C 1 44 ASN CB 3.825 . 6.650 3.880 3.602 4.345 . 0 0 "[ . 1]" 1
147 1 44 ASN CB 1 46 GLY C 4.600 . 8.200 4.065 3.732 4.178 . 0 0 "[ . 1]" 1
148 1 18 THR C 1 36 ILE CB 4.600 . 8.200 4.996 4.668 5.176 . 0 0 "[ . 1]" 1
149 1 36 ILE CB 1 55 THR C 4.600 . 8.200 6.544 6.152 6.760 . 0 0 "[ . 1]" 1
150 1 9 GLU C 1 11 ILE CB 4.600 . 8.200 3.346 3.313 3.382 . 0 0 "[ . 1]" 1
151 1 8 VAL CB 1 66 GLN C 4.600 . 8.200 9.465 8.721 10.023 1.823 6 10 [*****+***-] 1
152 1 43 LYS CB 1 46 GLY C 4.600 . 8.200 6.227 6.134 6.328 . 0 0 "[ . 1]" 1
153 1 39 GLU C 1 39 GLU CG 3.825 . 6.650 3.851 3.825 3.865 . 0 0 "[ . 1]" 1
154 1 19 VAL C 1 35 VAL CB 3.825 . 6.650 5.270 5.107 5.416 . 0 0 "[ . 1]" 1
155 1 28 ALA C 1 32 TRP CB 3.825 . 6.650 5.796 5.382 6.060 . 0 0 "[ . 1]" 1
156 1 36 ILE C 1 41 LYS CB 4.600 . 8.200 3.285 3.220 3.343 . 0 0 "[ . 1]" 1
157 1 30 GLY C 1 31 LYS CB 4.600 . 8.200 3.399 3.311 3.488 . 0 0 "[ . 1]" 1
158 1 26 LEU C 1 52 LYS CB 4.600 . 8.200 3.458 3.445 3.474 . 0 0 "[ . 1]" 1
159 1 39 GLU CB 1 41 LYS C 3.825 . 6.650 6.050 5.960 6.182 . 0 0 "[ . 1]" 1
160 1 1 PRO CB 1 3 ARG C 3.825 . 6.650 7.379 7.076 7.623 0.973 10 8 "[-***.* **+]" 1
161 1 39 GLU CB 1 59 GLY C 4.600 . 8.200 3.468 3.417 3.517 . 0 0 "[ . 1]" 1
162 1 25 THR C 1 52 LYS CB 3.825 . 6.650 3.058 3.028 3.111 . 0 0 "[ . 1]" 1
163 1 14 GLY C 1 15 HIS CB 4.600 . 8.200 3.611 3.548 3.637 . 0 0 "[ . 1]" 1
164 1 3 ARG C 1 4 VAL CB 3.825 . 6.650 3.264 3.244 3.294 . 0 0 "[ . 1]" 1
165 1 25 THR C 1 51 ARG CB 4.600 . 8.200 5.618 5.474 5.718 . 0 0 "[ . 1]" 1
166 1 44 ASN CG 1 58 GLU CB 4.600 . 8.200 4.877 3.462 5.269 . 0 0 "[ . 1]" 1
167 1 5 GLY C 1 7 ARG CB 4.600 . 8.200 4.860 4.819 4.914 . 0 0 "[ . 1]" 1
168 1 36 ILE C 1 60 HIS CB 4.600 . 8.200 3.678 3.527 3.778 . 0 0 "[ . 1]" 1
169 1 36 ILE C 1 60 HIS CB 4.600 . 8.200 3.676 3.525 3.774 . 0 0 "[ . 1]" 1
170 1 51 ARG CG 1 52 LYS C 3.825 . 6.650 4.489 4.365 4.654 . 0 0 "[ . 1]" 1
171 1 25 THR C 1 51 ARG CG 4.600 . 8.200 6.184 5.710 6.462 . 0 0 "[ . 1]" 1
172 1 36 ILE CG1 1 57 ASP C 3.825 . 6.650 5.440 5.352 5.673 . 0 0 "[ . 1]" 1
173 1 15 HIS C 1 36 ILE CG1 3.825 . 6.650 9.816 8.571 10.679 4.029 9 10 [*****-**+*] 1
174 1 5 GLY C 1 7 ARG CG 3.825 . 6.650 4.714 4.128 5.298 . 0 0 "[ . 1]" 1
175 1 2 LEU CG 1 67 SER C 3.825 . 6.650 7.240 7.064 7.488 0.838 6 6 "[ - *.+* **]" 1
176 1 16 ARG C 1 37 LEU CG 4.600 . 8.200 5.395 5.183 5.560 . 0 0 "[ . 1]" 1
177 1 15 HIS C 1 37 LEU CG 4.600 . 8.200 6.467 5.972 7.233 . 0 0 "[ . 1]" 1
178 1 46 GLY C 1 49 GLN CB 3.825 . 6.650 10.000 9.896 10.091 3.441 9 10 [****-***+*] 1
179 1 41 LYS CG 1 42 GLY C 4.600 . 8.200 6.640 6.296 6.859 . 0 0 "[ . 1]" 1
180 1 41 LYS CG 1 59 GLY C 4.600 . 8.200 5.397 5.352 5.463 . 0 0 "[ . 1]" 1
181 1 43 LYS C 1 43 LYS CG 3.825 . 6.650 3.478 3.038 3.733 . 0 0 "[ . 1]" 1
182 1 43 LYS CG 1 46 GLY C 4.600 . 8.200 5.431 3.745 5.969 . 0 0 "[ . 1]" 1
183 1 9 GLU C 1 69 ILE CG1 4.600 . 8.200 3.798 3.745 3.846 . 0 0 "[ . 1]" 1
184 1 8 VAL C 1 69 ILE CG1 4.600 . 8.200 6.105 5.833 6.405 . 0 0 "[ . 1]" 1
185 1 22 VAL C 1 33 VAL CG2 3.825 . 6.650 5.182 5.053 5.288 . 0 0 "[ . 1]" 1
186 1 33 VAL C 1 33 VAL CG2 3.825 . 6.650 3.842 3.833 3.853 . 0 0 "[ . 1]" 1
187 1 33 VAL CG2 1 34 GLY C 4.600 . 8.200 5.203 4.888 6.082 . 0 0 "[ . 1]" 1
188 1 4 VAL CG2 1 22 VAL C 3.825 . 6.650 7.177 5.351 7.478 0.828 4 9 "[-**+** ***]" 1
189 1 18 THR C 1 35 VAL CG2 4.600 . 8.200 3.221 3.056 3.296 . 0 0 "[ . 1]" 1
190 1 28 ALA CB 1 30 GLY C 4.600 . 8.200 4.954 4.589 5.254 . 0 0 "[ . 1]" 1
191 1 37 LEU C 1 37 LEU CD1 3.825 . 6.650 4.282 3.407 4.568 . 0 0 "[ . 1]" 1
192 1 14 GLY C 1 37 LEU CD1 4.600 . 8.200 4.160 4.021 4.347 . 0 0 "[ . 1]" 1
193 1 20 ALA CB 1 34 GLY C 4.600 . 8.200 3.489 3.250 3.714 . 0 0 "[ . 1]" 1
194 1 4 VAL CG1 1 5 GLY C 3.825 . 6.650 4.589 4.361 4.725 . 0 0 "[ . 1]" 1
195 1 20 ALA CB 1 53 TYR C 3.825 . 6.650 4.053 3.661 4.476 . 0 0 "[ . 1]" 1
196 1 55 THR C 1 55 THR CG2 3.825 . 6.650 3.773 3.197 3.847 . 0 0 "[ . 1]" 1
197 1 27 PHE C 1 48 VAL CG1 3.825 . 6.650 4.585 4.500 4.627 . 0 0 "[ . 1]" 1
198 1 47 THR CG2 1 53 TYR C 4.600 . 8.200 8.558 8.506 8.600 0.400 8 0 "[ . 1]" 1
199 1 8 VAL CG1 1 18 THR C 4.600 . 8.200 3.586 3.093 4.086 . 0 0 "[ . 1]" 1
200 1 36 ILE C 1 36 ILE CG2 3.825 . 6.650 3.450 3.038 3.817 . 0 0 "[ . 1]" 1
201 1 8 VAL C 1 8 VAL CG1 3.825 . 6.650 3.283 2.827 3.803 . 0 0 "[ . 1]" 1
202 1 38 ASP CG 1 44 ASN CB 3.825 . 6.650 14.651 14.194 15.167 8.517 7 10 [-*****+***] 1
203 1 23 GLY CA 1 34 GLY C 4.600 . 8.200 4.115 4.048 4.243 . 0 0 "[ . 1]" 1
204 1 5 GLY CA 1 6 SER C 4.600 . 8.200 4.524 4.440 4.571 . 0 0 "[ . 1]" 1
205 1 14 GLY C 1 16 ARG CD 3.825 . 6.650 3.938 3.878 3.990 . 0 0 "[ . 1]" 1
206 1 38 ASP CG 1 39 GLU CA 3.825 . 6.650 5.514 4.454 6.088 . 0 0 "[ . 1]" 1
207 1 45 ASP CA 1 58 GLU C 3.825 . 6.650 7.652 7.385 7.755 1.105 4 10 [*-*+******] 1
208 1 37 LEU C 1 39 GLU CA 3.400 . 5.800 2.390 2.382 2.396 . 0 0 "[ . 1]" 1
209 1 5 GLY C 1 7 ARG CA 3.400 . 5.800 3.452 3.412 3.495 . 0 0 "[ . 1]" 1
210 1 7 ARG CA 1 18 THR C 4.600 . 8.200 3.795 3.740 3.856 . 0 0 "[ . 1]" 1
211 1 6 SER C 1 7 ARG CA 3.825 . 6.650 2.425 2.414 2.438 . 0 0 "[ . 1]" 1
212 1 26 LEU CA 1 50 GLY C 4.600 . 8.200 7.183 6.894 7.326 . 0 0 "[ . 1]" 1
213 1 54 PHE C 1 57 ASP CA 4.600 . 8.200 2.428 2.421 2.436 . 0 0 "[ . 1]" 1
214 1 2 LEU CA 1 5 GLY C 4.600 . 8.200 5.075 4.856 5.245 . 0 0 "[ . 1]" 1
215 1 16 ARG CA 1 18 THR C 3.825 . 6.650 7.661 7.248 8.152 1.502 4 10 [***+**-***] 1
216 1 27 PHE C 1 32 TRP CA 4.600 . 8.200 4.065 4.043 4.083 . 0 0 "[ . 1]" 1
217 1 46 GLY C 1 49 GLN CA 4.600 . 8.200 2.405 2.396 2.412 . 0 0 "[ . 1]" 1
218 1 57 ASP C 1 58 GLU CA 3.825 . 6.650 2.419 2.411 2.428 . 0 0 "[ . 1]" 1
219 1 32 TRP CA 1 62 ILE C 4.600 . 8.200 4.155 4.137 4.188 . 0 0 "[ . 1]" 1
220 1 65 ARG C 1 66 GLN CA 3.825 . 6.650 2.427 2.419 2.437 . 0 0 "[ . 1]" 1
221 1 25 THR CA 1 28 ALA C 4.600 . 8.200 3.988 3.942 4.024 . 0 0 "[ . 1]" 1
222 1 5 GLY C 1 6 SER CA 4.600 . 8.200 2.439 2.430 2.448 . 0 0 "[ . 1]" 1
223 1 5 GLY C 1 6 SER CB 3.825 . 6.650 3.634 3.614 3.664 . 0 0 "[ . 1]" 1
224 1 6 SER CB 1 18 THR C 3.825 . 6.650 6.855 6.727 6.941 0.291 8 0 "[ . 1]" 1
225 1 6 SER CA 1 7 ARG C 4.600 . 8.200 4.077 4.038 4.115 . 0 0 "[ . 1]" 1
226 1 4 VAL C 1 19 VAL CA 3.825 . 6.650 5.255 4.955 5.479 . 0 0 "[ . 1]" 1
227 1 25 THR CB 1 29 THR CA 3.825 . 6.650 6.508 6.280 6.602 . 0 0 "[ . 1]" 1
228 1 6 SER CA 1 18 THR CB 3.825 . 6.650 5.706 5.381 6.235 . 0 0 "[ . 1]" 1
229 1 24 ALA CA 1 25 THR CB 4.600 . 8.200 4.600 4.532 4.660 . 0 0 "[ . 1]" 1
230 1 45 ASP CA 1 55 THR CB 3.825 . 6.650 7.715 7.615 7.977 1.327 5 10 [**-*+*****] 1
231 1 6 SER CB 1 7 ARG CA 3.825 . 6.650 4.402 4.372 4.474 . 0 0 "[ . 1]" 1
232 1 3 ARG CA 1 6 SER CA 4.600 . 8.200 5.423 5.275 5.529 . 0 0 "[ . 1]" 1
233 1 6 SER CA 1 68 GLN CA 4.600 . 8.200 5.636 5.479 5.905 . 0 0 "[ . 1]" 1
234 1 1 PRO CA 1 2 LEU CA 4.600 . 8.200 3.708 3.675 3.726 . 0 0 "[ . 1]" 1
235 1 15 HIS CA 1 35 VAL CA 3.825 . 6.650 3.722 3.703 3.735 . 0 0 "[ . 1]" 1
236 1 7 ARG CA 1 18 THR CA 4.600 . 8.200 4.100 3.869 4.253 . 0 0 "[ . 1]" 1
237 1 65 ARG CA 1 66 GLN CA 4.600 . 8.200 3.801 3.786 3.815 . 0 0 "[ . 1]" 1
238 1 65 ARG CA 1 67 SER CA 4.600 . 8.200 5.328 5.243 5.437 . 0 0 "[ . 1]" 1
239 1 64 VAL CA 1 65 ARG CA 4.600 . 8.200 3.799 3.787 3.805 . 0 0 "[ . 1]" 1
240 1 45 ASP CA 1 58 GLU CA 4.600 . 8.200 7.029 6.881 7.108 . 0 0 "[ . 1]" 1
241 1 57 ASP CA 1 58 GLU CA 4.600 . 6.650 3.803 3.797 3.813 . 0 0 "[ . 1]" 1
242 1 15 HIS CA 1 38 ASP CA 4.600 . 8.200 3.791 3.781 3.801 . 0 0 "[ . 1]" 1
243 1 26 LEU CA 1 31 LYS CA 4.600 . 8.200 9.693 9.489 9.946 1.746 8 10 [**-****+**] 1
244 1 44 ASN CA 1 52 LYS CA 4.600 . 8.200 3.602 3.577 3.631 . 0 0 "[ . 1]" 1
245 1 66 GLN CA 1 67 SER CB 3.825 . 6.650 4.850 4.842 4.859 . 0 0 "[ . 1]" 1
246 1 6 SER CB 1 7 ARG CA 3.825 . 6.650 4.397 4.367 4.469 . 0 0 "[ . 1]" 1
247 1 10 VAL CA 1 68 GLN CA 4.600 . 8.200 3.152 3.146 3.157 . 0 0 "[ . 1]" 1
248 1 6 SER CB 1 8 VAL CA 4.600 . 8.200 6.556 6.493 6.597 . 0 0 "[ . 1]" 1
249 1 38 ASP CA 1 39 GLU CA 4.600 . 8.200 3.794 3.782 3.800 . 0 0 "[ . 1]" 1
250 1 3 ARG CA 1 8 VAL CA 4.600 . 8.200 3.790 3.777 3.800 . 0 0 "[ . 1]" 1
251 1 33 VAL CA 1 65 ARG CA 4.600 . 8.200 5.236 5.144 5.307 . 0 0 "[ . 1]" 1
252 1 22 VAL CA 1 31 LYS CA 4.600 . 8.200 3.437 3.422 3.463 . 0 0 "[ . 1]" 1
253 1 29 THR CA 1 32 TRP CA 4.600 . 8.200 8.052 7.745 8.279 0.079 9 0 "[ . 1]" 1
254 1 26 LEU CA 1 29 THR CA 3.825 . 6.650 6.674 6.537 6.734 0.084 6 0 "[ . 1]" 1
255 1 5 GLY CA 1 6 SER CA 3.825 . 6.650 3.806 3.793 3.822 . 0 0 "[ . 1]" 1
256 1 17 GLY CA 1 18 THR CA 3.825 . 6.650 3.757 3.726 3.780 . 0 0 "[ . 1]" 1
257 1 15 HIS CA 1 17 GLY CA 4.600 . 8.200 6.041 5.616 6.327 . 0 0 "[ . 1]" 1
258 1 23 GLY CA 1 31 LYS CA 3.825 . 6.650 3.198 3.155 3.224 . 0 0 "[ . 1]" 1
259 1 6 SER CB 1 21 TYR CB 4.600 . 8.200 12.246 12.041 12.343 4.143 9 10 [**-*****+*] 1
260 1 35 VAL CB 1 38 ASP CA 4.600 . 8.200 9.284 9.019 9.605 1.405 4 10 [**-+******] 1
261 1 38 ASP CA 1 41 LYS CG 4.600 . 8.200 7.547 7.336 7.804 . 0 0 "[ . 1]" 1
262 1 2 LEU CG 1 68 GLN CA 3.825 . 6.650 9.163 8.855 9.472 2.822 6 10 [****-+****] 1
263 1 48 VAL CB 1 49 GLN CA 3.825 . 6.650 4.417 4.365 4.454 . 0 0 "[ . 1]" 1
264 1 7 ARG CG 1 68 GLN CA 4.600 . 8.200 14.318 13.411 15.799 7.599 5 10 [-***+*****] 1
265 1 65 ARG CG 1 68 GLN CA 3.825 . 6.650 5.758 5.679 5.879 . 0 0 "[ . 1]" 1
266 1 36 ILE CB 1 60 HIS CA 3.825 . 6.650 5.062 4.646 5.372 . 0 0 "[ . 1]" 1
267 1 27 PHE CA 1 51 ARG CB 3.825 . 6.650 6.998 6.104 7.850 1.200 3 3 "[ + - *1]" 1
268 1 22 VAL CB 1 54 PHE CA 4.600 . 8.200 11.881 11.617 12.301 4.101 7 10 [**-***+***] 1
269 1 54 PHE CA 1 57 ASP CB 3.825 . 6.650 4.761 4.745 4.773 . 0 0 "[ . 1]" 1
270 1 15 HIS CA 1 36 ILE CB 4.600 . 8.200 4.792 4.683 4.844 . 0 0 "[ . 1]" 1
271 1 15 HIS CA 1 38 ASP CB 3.825 . 6.650 4.776 4.742 4.798 . 0 0 "[ . 1]" 1
272 1 7 ARG CG 1 16 ARG CA 3.825 . 6.650 7.119 5.848 7.846 1.196 9 7 "[*** * * +-]" 1
273 1 37 LEU CA 1 63 PHE CB 4.600 . 8.200 11.411 11.168 11.560 3.360 2 10 [*+*******-] 1
274 1 16 ARG CA 1 35 VAL CA 4.600 . 8.200 5.910 5.766 6.197 . 0 0 "[ . 1]" 1
275 1 11 ILE CG1 1 15 HIS CA 3.825 . 6.650 4.642 4.446 4.916 . 0 0 "[ . 1]" 1
276 1 16 ARG CA 1 35 VAL CB 3.825 . 6.650 7.908 7.156 8.352 1.702 4 10 [***+****-*] 1
277 1 39 GLU CA 1 60 HIS CB 3.825 . 6.650 7.445 7.264 7.587 0.937 2 10 [*+****-***] 1
278 1 26 LEU CA 1 51 ARG CG 3.825 . 6.650 6.011 5.453 6.493 . 0 0 "[ . 1]" 1
279 1 26 LEU CA 1 27 PHE CB 4.600 . 6.650 4.828 4.821 4.845 . 0 0 "[ . 1]" 1
280 1 26 LEU CA 1 52 LYS CB 3.400 . 5.800 11.525 11.159 12.035 6.235 4 10 [***+**-***] 1
281 1 38 ASP CB 1 39 GLU CA 4.600 . 8.200 4.656 4.622 4.673 . 0 0 "[ . 1]" 1
282 1 44 ASN CB 1 57 ASP CA 4.600 . 8.200 4.428 4.116 4.850 . 0 0 "[ . 1]" 1
283 1 57 ASP CA 1 58 GLU CB 4.600 . 8.200 4.840 4.831 4.849 . 0 0 "[ . 1]" 1
284 1 26 LEU CA 1 32 TRP CB 3.400 . 5.800 10.327 9.884 10.570 4.770 2 10 [*+*******-] 1
285 1 26 LEU CA 1 49 GLN CB 3.825 . 6.650 5.067 4.754 5.396 . 0 0 "[ . 1]" 1
286 1 26 LEU CB 1 51 ARG CA 4.600 . 8.200 6.290 5.793 6.798 . 0 0 "[ . 1]" 1
287 1 7 ARG CA 1 16 ARG CD 4.600 . 8.200 6.080 5.872 6.165 . 0 0 "[ . 1]" 1
288 1 65 ARG CA 1 66 GLN CG 4.600 . 8.200 5.053 4.781 5.135 . 0 0 "[ . 1]" 1
289 1 5 GLY CA 1 7 ARG CA 4.600 . 8.200 5.677 5.610 5.743 . 0 0 "[ . 1]" 1
290 1 63 PHE CB 1 65 ARG CA 4.600 . 8.200 7.545 7.329 7.633 . 0 0 "[ . 1]" 1
291 1 41 LYS CG 1 45 ASP CA 3.400 . 5.800 12.808 12.316 13.188 7.388 4 10 [*-*+******] 1
292 1 45 ASP CA 1 51 ARG CG 4.600 . 8.200 8.662 8.298 9.252 1.052 3 3 "[ *+ . - 1]" 1
293 1 45 ASP CA 1 58 GLU CB 4.600 . 8.200 8.207 8.129 8.253 0.053 4 0 "[ . 1]" 1
294 1 21 TYR CA 1 35 VAL CB 4.600 . 8.200 6.281 6.031 6.430 . 0 0 "[ . 1]" 1
295 1 8 VAL CB 1 69 ILE CA 4.600 . 8.200 6.367 5.745 6.861 . 0 0 "[ . 1]" 1
296 1 64 VAL CB 1 69 ILE CA 4.600 . 8.200 4.546 4.128 5.180 . 0 0 "[ . 1]" 1
297 1 21 TYR CA 1 22 VAL CB 4.600 . 8.200 4.707 4.668 4.736 . 0 0 "[ . 1]" 1
298 1 66 GLN CG 1 69 ILE CA 4.600 . 8.200 7.429 7.337 7.596 . 0 0 "[ . 1]" 1
299 1 7 ARG CB 1 69 ILE CA 3.825 . 6.650 5.826 5.764 5.900 . 0 0 "[ . 1]" 1
300 1 8 VAL CA 1 10 VAL CB 4.600 . 8.200 4.226 4.111 4.365 . 0 0 "[ . 1]" 1
301 1 4 VAL CB 1 21 TYR CA 4.600 . 8.200 4.351 4.203 4.590 . 0 0 "[ . 1]" 1
302 1 45 ASP CB 1 47 THR CA 4.600 . 8.200 6.339 6.243 6.425 . 0 0 "[ . 1]" 1
303 1 64 VAL CB 1 66 GLN CA 4.600 . 8.200 6.732 6.677 6.811 . 0 0 "[ . 1]" 1
304 1 10 VAL CA 1 11 ILE CB 4.600 . 8.200 4.799 4.777 4.828 . 0 0 "[ . 1]" 1
305 1 51 ARG CB 1 55 THR CB 4.600 . 8.200 13.186 13.009 13.373 5.173 1 10 [+-********] 1
306 1 15 HIS CB 1 36 ILE CA 3.825 . 6.650 6.807 6.530 7.161 0.511 10 1 "[ . +]" 1
307 1 35 VAL CB 1 62 ILE CA 4.600 . 8.200 5.148 4.775 5.481 . 0 0 "[ . 1]" 1
308 1 9 GLU CB 1 66 GLN CA 3.825 . 6.650 7.434 6.498 8.323 1.673 9 7 "[** *-* +*]" 1
309 1 32 TRP CB 1 66 GLN CA 3.825 . 6.650 8.097 7.843 8.254 1.604 7 10 [******+**-] 1
310 1 65 ARG CB 1 66 GLN CA 3.825 . 6.650 4.467 4.421 4.512 . 0 0 "[ . 1]" 1
311 1 1 PRO CB 1 67 SER CB 3.825 . 6.650 8.213 7.896 8.346 1.696 7 10 [*-****+***] 1
312 1 29 THR CA 1 31 LYS CB 3.825 . 6.650 7.997 7.814 8.199 1.549 9 10 [********+-] 1
313 1 6 SER CB 1 19 VAL CB 4.600 . 8.200 5.490 4.934 5.817 . 0 0 "[ . 1]" 1
314 1 10 VAL CB 1 15 HIS CB 4.600 . 8.200 4.076 4.018 4.170 . 0 0 "[ . 1]" 1
315 1 7 ARG CG 1 10 VAL CB 3.825 . 6.650 11.286 10.133 12.436 5.786 3 10 [**+-******] 1
316 1 2 LEU CG 1 67 SER CB 4.600 . 8.200 9.134 8.714 9.534 1.334 6 10 [*****+*-**] 1
317 1 11 ILE CA 1 64 VAL CG2 4.600 . 8.200 8.344 7.492 8.556 0.356 2 0 "[ . 1]" 1
318 1 11 ILE CA 1 69 ILE CG1 4.600 . 8.200 7.855 7.627 8.091 . 0 0 "[ . 1]" 1
319 1 4 VAL CG2 1 6 SER CA 4.600 . 8.200 4.564 3.660 5.545 . 0 0 "[ . 1]" 1
320 1 33 VAL CA 1 64 VAL CG2 4.600 . 8.200 5.127 4.752 6.816 . 0 0 "[ . 1]" 1
321 1 43 LYS CG 1 62 ILE CA 4.600 . 8.200 7.174 5.210 8.271 0.071 5 0 "[ . 1]" 1
322 1 65 ARG CG 1 66 GLN CA 3.825 . 6.650 5.969 5.935 6.011 . 0 0 "[ . 1]" 1
323 1 33 VAL CG1 1 66 GLN CA 4.600 . 8.200 5.524 5.126 5.851 . 0 0 "[ . 1]" 1
324 1 33 VAL CG1 1 67 SER CA 4.600 . 8.200 9.039 8.765 9.225 1.025 7 10 [******+**-] 1
325 1 64 VAL CA 1 69 ILE CG2 3.825 . 6.650 5.453 5.239 5.623 . 0 0 "[ . 1]" 1
326 1 62 ILE CA 1 69 ILE CD1 4.600 . 8.200 9.810 9.188 10.208 2.008 7 10 [****-*+***] 1
327 1 8 VAL CG1 1 15 HIS CA 3.825 . 6.650 5.292 4.723 5.971 . 0 0 "[ . 1]" 1
328 1 48 VAL CG1 1 49 GLN CA 4.600 . 8.200 4.488 4.388 4.609 . 0 0 "[ . 1]" 1
329 1 37 LEU CA 1 37 LEU CD1 3.400 . 5.800 2.956 2.663 3.052 . 0 0 "[ . 1]" 1
330 1 3 ARG CA 1 20 ALA CB 3.825 . 6.650 4.719 4.055 5.058 . 0 0 "[ . 1]" 1
331 1 51 ARG CA 1 52 LYS CG 4.600 . 8.200 5.074 5.038 5.106 . 0 0 "[ . 1]" 1
332 1 3 ARG CA 1 4 VAL CG2 4.600 . 8.200 4.923 4.606 5.329 . 0 0 "[ . 1]" 1
333 1 7 ARG CA 1 8 VAL CG2 4.600 . 8.200 4.852 4.360 5.385 . 0 0 "[ . 1]" 1
334 1 45 ASP CA 1 47 THR CG2 3.825 . 6.650 7.214 7.187 7.245 0.595 1 10 [+***-*****] 1
335 1 9 GLU CA 1 69 ILE CD1 4.600 . 8.200 6.838 6.516 7.028 . 0 0 "[ . 1]" 1
336 1 34 GLY CA 1 35 VAL CB 3.825 . 6.650 4.681 4.640 4.703 . 0 0 "[ . 1]" 1
337 1 46 GLY CA 1 57 ASP CB 3.825 . 6.650 6.888 6.693 7.132 0.482 10 0 "[ . 1]" 1
338 1 8 VAL CA 1 65 ARG CD 4.600 . 8.200 13.582 13.341 13.861 5.661 6 10 [*****+***-] 1
339 1 62 ILE CB 1 63 PHE CB 4.600 . 8.200 5.674 5.652 5.711 . 0 0 "[ . 1]" 1
340 1 65 ARG CD 1 69 ILE CB 4.600 . 8.200 8.339 8.288 8.403 0.203 1 0 "[ . 1]" 1
341 1 23 GLY CA 1 25 THR CG2 4.600 . 8.200 5.861 5.246 6.953 . 0 0 "[ . 1]" 1
342 1 17 GLY CA 1 35 VAL CG2 4.600 . 8.200 7.481 6.562 8.068 . 0 0 "[ . 1]" 1
343 1 4 VAL CG1 1 21 TYR CB 4.600 . 8.200 4.449 4.271 4.529 . 0 0 "[ . 1]" 1
344 1 20 ALA CB 1 21 TYR CB 4.600 . 8.200 4.824 4.778 4.850 . 0 0 "[ . 1]" 1
345 1 11 ILE CG1 1 65 ARG CD 4.600 . 8.200 9.434 9.057 9.610 1.410 2 10 [*+*-******] 1
346 1 26 LEU CB 1 49 GLN CB 4.600 . 8.200 4.895 3.941 5.423 . 0 0 "[ . 1]" 1
347 1 65 ARG CD 1 68 GLN CB 4.600 . 8.200 4.038 3.969 4.313 . 0 0 "[ . 1]" 1
348 1 26 LEU CB 1 31 LYS CB 3.825 . 6.650 4.751 3.778 5.501 . 0 0 "[ . 1]" 1
349 1 37 LEU CB 1 60 HIS CB 4.600 . 8.200 5.181 4.890 5.462 . 0 0 "[ . 1]" 1
350 1 57 ASP CB 1 60 HIS CB 4.600 . 8.200 6.811 6.587 6.976 . 0 0 "[ . 1]" 1
351 1 44 ASN CB 1 58 GLU CB 4.600 . 8.200 4.199 4.078 4.603 . 0 0 "[ . 1]" 1
352 1 44 ASN CB 1 52 LYS CB 4.600 . 8.200 8.426 8.361 8.496 0.296 5 0 "[ . 1]" 1
353 1 45 ASP CB 1 52 LYS CB 4.600 . 8.200 6.615 6.431 7.094 . 0 0 "[ . 1]" 1
354 1 36 ILE CB 1 58 GLU CB 4.600 . 8.200 11.337 10.806 11.711 3.511 3 10 [**+**-****] 1
355 1 9 GLU CB 1 11 ILE CB 4.600 . 8.200 5.651 5.040 6.323 . 0 0 "[ . 1]" 1
356 1 8 VAL CB 1 66 GLN CG 3.825 . 6.650 11.149 10.046 12.089 5.439 6 10 [*****+**-*] 1
357 1 7 ARG CB 1 8 VAL CB 3.825 . 6.650 5.586 5.544 5.657 . 0 0 "[ . 1]" 1
358 1 8 VAL CB 1 10 VAL CB 4.600 . 8.200 5.518 5.338 5.751 . 0 0 "[ . 1]" 1
359 1 33 VAL CB 1 64 VAL CB 3.825 . 6.650 5.087 4.898 5.270 . 0 0 "[ . 1]" 1
360 1 10 VAL CB 1 70 GLN CG 4.600 . 8.200 4.061 3.974 4.437 . 0 0 "[ . 1]" 1
361 1 20 ALA CB 1 36 ILE CB 3.825 . 6.650 4.927 4.870 5.002 . 0 0 "[ . 1]" 1
362 1 11 ILE CB 1 64 VAL CG1 4.600 . 8.200 8.549 8.197 9.046 0.846 10 2 "[ . -+]" 1
363 1 4 VAL CG1 1 22 VAL CB 3.825 . 6.650 5.481 3.813 6.077 . 0 0 "[ . 1]" 1
364 1 20 ALA CB 1 35 VAL CB 4.600 . 8.200 4.981 4.464 5.932 . 0 0 "[ . 1]" 1
365 1 25 THR CG2 1 32 TRP CB 4.600 . 8.200 6.344 5.793 7.465 . 0 0 "[ . 1]" 1
366 1 32 TRP CB 1 65 ARG CG 4.600 . 8.200 5.693 5.377 5.886 . 0 0 "[ . 1]" 1
367 1 48 VAL CG1 1 52 LYS CB 3.825 . 6.650 5.921 5.700 6.016 . 0 0 "[ . 1]" 1
368 1 1 PRO CB 1 2 LEU CD1 4.600 . 8.200 4.360 4.069 4.670 . 0 0 "[ . 1]" 1
369 1 15 HIS CB 1 37 LEU CD1 3.825 . 6.650 3.433 3.051 3.783 . 0 0 "[ . 1]" 1
370 1 68 GLN CB 1 69 ILE CG1 4.600 . 8.200 5.269 5.176 5.348 . 0 0 "[ . 1]" 1
371 1 19 VAL CB 1 33 VAL CG2 4.600 . 8.200 4.986 4.676 5.091 . 0 0 "[ . 1]" 1
372 1 65 ARG CB 1 69 ILE CG1 4.600 . 8.200 6.570 6.477 6.641 . 0 0 "[ . 1]" 1
373 1 2 LEU CG 1 4 VAL CB 4.600 . 8.200 7.878 7.319 8.300 0.100 7 0 "[ . 1]" 1
374 1 41 LYS CG 1 58 GLU CB 4.600 . 8.200 6.801 6.459 7.076 . 0 0 "[ . 1]" 1
375 1 2 LEU CD1 1 7 ARG CB 4.600 . 8.200 8.305 7.952 8.423 0.223 4 0 "[ . 1]" 1
376 1 19 VAL CB 1 22 VAL CB 4.600 . 8.200 6.918 6.731 7.200 . 0 0 "[ . 1]" 1
377 1 48 VAL CB 1 58 GLU CB 3.825 . 6.650 9.905 9.638 10.308 3.658 2 10 [*+***-****] 1
378 1 64 VAL CB 1 65 ARG CB 3.825 . 6.650 4.894 4.606 5.001 . 0 0 "[ . 1]" 1
379 1 11 ILE CG1 1 66 GLN CG 4.600 . 8.200 10.543 9.929 11.360 3.160 9 10 [***-****+*] 1
380 1 9 GLU CB 1 11 ILE CG1 4.600 . 8.200 5.567 5.046 5.845 . 0 0 "[ . 1]" 1
381 1 36 ILE CG1 1 56 CYS CB 4.600 . 8.200 5.026 4.751 5.399 . 0 0 "[ . 1]" 1
382 1 8 VAL CG1 1 10 VAL CB 3.825 . 6.650 5.512 4.677 6.670 0.020 10 0 "[ . 1]" 1
383 1 8 VAL CG1 1 10 VAL CB 4.600 . 8.200 5.604 4.695 6.820 . 0 0 "[ . 1]" 1
384 1 40 ALA CA 1 41 LYS CB 4.600 . 8.200 4.583 4.540 4.621 . 0 0 "[ . 1]" 1
385 1 20 ALA CB 1 33 VAL CG2 4.600 . 8.200 5.473 5.027 6.566 . 0 0 "[ . 1]" 1
386 1 35 VAL CG2 1 36 ILE CG2 3.825 . 6.650 7.888 7.380 8.393 1.743 1 10 [+-********] 1
387 1 2 LEU CD1 1 69 ILE CG2 4.600 . 8.200 5.937 5.635 6.242 . 0 0 "[ . 1]" 1
388 1 2 LEU CD1 1 69 ILE CD1 4.600 . 8.200 3.276 3.094 3.389 . 0 0 "[ . 1]" 1
389 1 36 ILE CD1 1 36 ILE CG2 3.825 . 6.650 3.020 2.919 3.095 . 0 0 "[ . 1]" 1
390 1 43 LYS CG 1 60 HIS CB 4.600 . 8.200 8.841 7.312 9.348 1.148 3 8 "[ -+******1]" 1
391 1 43 LYS CD 1 52 LYS CG 4.600 . 8.200 11.047 10.487 11.214 3.014 6 10 [*****+***-] 1
392 1 11 ILE CG1 1 13 LYS CG 4.600 . 8.200 9.992 9.391 10.405 2.205 5 10 [****+****-] 1
393 1 49 GLN CB 1 51 ARG CG 3.825 . 6.650 6.401 6.211 6.892 0.242 9 0 "[ . 1]" 1
394 1 43 LYS CG 1 51 ARG CG 4.600 . 8.200 11.050 10.271 11.527 3.327 3 10 [**+******-] 1
395 1 1 PRO CG 1 2 LEU CD1 4.600 . 8.200 7.054 6.194 7.694 . 0 0 "[ . 1]" 1
396 1 13 LYS CG 1 37 LEU CG 4.600 . 8.200 8.146 7.900 8.299 0.099 1 0 "[ . 1]" 1
397 1 36 ILE CG2 1 62 ILE CD1 4.600 . 8.200 9.160 8.838 9.486 1.286 3 10 [**+****-**] 1
398 1 28 ALA CB 1 49 GLN CB 3.400 . 5.800 5.988 5.929 6.133 0.333 4 0 "[ . 1]" 1
399 1 25 THR CG2 1 51 ARG CG 3.825 . 6.650 5.397 4.903 5.942 . 0 0 "[ . 1]" 1
400 1 20 ALA CB 1 36 ILE CG1 4.600 . 8.200 5.542 4.878 6.154 . 0 0 "[ . 1]" 1
401 1 39 GLU CB 1 40 ALA CB 4.600 . 8.200 5.259 5.244 5.272 . 0 0 "[ . 1]" 1
402 1 8 VAL CG1 1 9 GLU CB 4.600 . 8.200 6.363 5.842 6.871 . 0 0 "[ . 1]" 1
403 1 8 VAL CG1 1 10 VAL CB 3.825 . 6.650 5.482 4.673 6.592 . 0 0 "[ . 1]" 1
404 1 8 VAL CG2 1 10 VAL CB 4.600 . 8.200 4.939 4.615 5.082 . 0 0 "[ . 1]" 1
405 1 15 HIS CB 1 37 LEU CD1 4.600 . 8.200 3.418 3.044 3.753 . 0 0 "[ . 1]" 1
406 1 25 THR CG2 1 52 LYS CB 4.600 . 8.200 5.091 3.535 5.654 . 0 0 "[ . 1]" 1
407 1 25 THR CG2 1 32 TRP CB 3.825 . 6.650 5.305 4.753 5.938 . 0 0 "[ . 1]" 1
408 1 31 LYS CB 1 33 VAL CG2 3.825 . 6.650 5.236 5.158 5.395 . 0 0 "[ . 1]" 1
409 1 37 LEU CG 1 60 HIS CB 3.825 . 6.650 6.696 6.430 6.984 0.334 10 0 "[ . 1]" 1
410 1 11 ILE CG1 1 13 LYS CG 4.600 . 8.200 7.669 7.564 7.756 . 0 0 "[ . 1]" 1
411 1 7 ARG CG 1 69 ILE CG1 4.600 . 8.200 10.360 9.499 11.473 3.273 3 10 [**+***-***] 1
412 1 51 ARG CG 1 52 LYS CG 4.600 . 8.200 5.864 5.743 5.970 . 0 0 "[ . 1]" 1
413 1 7 ARG CG 1 16 ARG CB 3.400 . 5.800 5.367 5.068 5.600 . 0 0 "[ . 1]" 1
414 1 7 ARG CG 1 9 GLU CB 3.825 . 6.650 6.568 5.703 8.090 1.440 5 3 "[ - + *]" 1
415 1 2 LEU CG 1 4 VAL CB 4.600 . 8.200 5.213 4.347 5.627 . 0 0 "[ . 1]" 1
416 1 2 LEU CG 1 70 GLN CB 3.825 . 6.650 5.511 4.759 6.317 . 0 0 "[ . 1]" 1
417 1 1 PRO CB 1 2 LEU CG 3.400 . 5.800 3.754 3.541 4.158 . 0 0 "[ . 1]" 1
418 1 37 LEU CG 1 41 LYS CB 3.825 . 6.650 6.501 6.006 6.777 0.127 8 0 "[ . 1]" 1
419 1 33 VAL CB 1 65 ARG CG 3.825 . 6.650 6.970 6.770 7.222 0.572 6 1 "[ .+ 1]" 1
420 1 13 LYS CG 1 15 HIS CB 4.600 . 6.650 5.760 4.575 6.894 0.244 5 0 "[ . 1]" 1
421 1 66 GLN CG 1 69 ILE CG1 4.600 . 8.200 5.928 5.347 6.649 . 0 0 "[ . 1]" 1
422 1 27 PHE CB 1 31 LYS CB 3.825 . 6.650 12.811 12.436 13.115 6.465 3 10 [**+******-] 1
423 1 8 VAL CB 1 9 GLU CB 4.600 . 8.200 5.347 5.259 5.400 . 0 0 "[ . 1]" 1
424 1 39 GLU CB 1 41 LYS CB 4.600 . 8.200 4.860 4.768 4.922 . 0 0 "[ . 1]" 1
425 1 15 HIS CB 1 39 GLU CG 4.600 . 8.200 5.716 5.321 5.960 . 0 0 "[ . 1]" 1
426 1 43 LYS CB 1 58 GLU CB 3.825 . 6.650 6.445 6.082 6.699 0.049 3 0 "[ . 1]" 1
427 1 11 ILE CG1 1 70 GLN CG 3.825 . 6.650 6.923 4.880 8.009 1.359 4 6 "[* *+.*-* 1]" 1
428 1 27 PHE CB 1 51 ARG CG 3.825 . 6.650 6.946 6.140 8.281 1.631 3 2 "[ + . -1]" 1
429 1 7 ARG CB 1 9 GLU CB 3.825 . 6.650 5.815 5.753 5.921 . 0 0 "[ . 1]" 1
430 1 11 ILE CG1 1 70 GLN CB 4.600 . 8.200 6.331 5.395 7.079 . 0 0 "[ . 1]" 1
431 1 11 ILE CG1 1 68 GLN CB 4.600 . 8.200 5.580 5.280 5.734 . 0 0 "[ . 1]" 1
432 1 26 LEU CB 1 51 ARG CG 4.600 . 8.200 5.424 4.860 6.124 . 0 0 "[ . 1]" 1
433 1 38 ASP CB 1 39 GLU CB 4.600 . 8.200 5.329 5.284 5.384 . 0 0 "[ . 1]" 1
434 1 44 ASN CB 1 56 CYS CB 4.600 . 8.200 4.307 3.799 4.889 . 0 0 "[ . 1]" 1
435 1 65 ARG CD 1 66 GLN CG 4.600 . 8.200 7.757 7.437 8.272 0.072 1 0 "[ . 1]" 1
436 1 31 LYS CB 1 63 PHE CB 3.825 . 6.650 4.959 4.580 5.192 . 0 0 "[ . 1]" 1
437 1 9 GLU CB 1 16 ARG CD 4.600 . 8.200 4.723 4.496 5.058 . 0 0 "[ . 1]" 1
438 1 9 GLU CB 1 69 ILE CB 4.600 . 8.200 5.890 5.751 6.086 . 0 0 "[ . 1]" 1
439 1 16 ARG CD 1 38 ASP CB 3.825 . 6.650 7.749 6.938 8.336 1.686 4 9 "[*-*+*** **]" 1
440 1 21 TYR CB 1 22 VAL CB 4.600 . 8.200 5.723 5.693 5.747 . 0 0 "[ . 1]" 1
441 1 8 VAL CG1 1 16 ARG CD 3.825 . 6.650 8.053 7.203 9.362 2.712 5 10 [****+-****] 1
442 1 21 TYR CB 1 36 ILE CG2 4.600 . 8.200 11.120 10.045 12.332 4.132 5 10 [****+****-] 1
443 1 5 GLY CA 1 20 ALA CB 4.600 . 8.200 5.726 5.170 6.725 . 0 0 "[ . 1]" 1
444 1 44 ASN CB 1 48 VAL CG2 3.825 . 6.650 4.664 4.609 4.776 . 0 0 "[ . 1]" 1
445 1 20 ALA CB 1 34 GLY CA 4.600 . 8.200 3.796 3.603 4.050 . 0 0 "[ . 1]" 1
446 1 5 GLY CA 1 20 ALA CB 4.600 . 8.200 5.766 5.184 6.812 . 0 0 "[ . 1]" 1
447 1 20 ALA CB 1 36 ILE CB 3.400 . 5.800 5.977 5.785 6.113 0.313 4 0 "[ . 1]" 1
448 1 20 ALA CB 1 34 GLY CA 4.600 . 8.200 3.759 3.584 3.991 . 0 0 "[ . 1]" 1
449 1 4 VAL CG1 1 21 TYR CB 4.600 . 8.200 4.605 4.386 4.679 . 0 0 "[ . 1]" 1
450 1 16 ARG CD 1 35 VAL CG1 3.825 . 6.650 5.872 5.726 6.268 . 0 0 "[ . 1]" 1
451 1 4 VAL CG1 1 5 GLY CA 4.600 . 8.200 5.132 4.244 5.769 . 0 0 "[ . 1]" 1
452 1 37 LEU CD1 1 38 ASP CB 4.600 . 8.200 6.780 5.281 7.295 . 0 0 "[ . 1]" 1
453 1 21 TYR CB 1 33 VAL CG1 4.600 . 8.200 7.493 7.273 7.702 . 0 0 "[ . 1]" 1
454 1 4 VAL CG2 1 21 TYR CB 3.825 . 6.650 4.367 3.978 5.258 . 0 0 "[ . 1]" 1
455 1 18 THR CG2 1 37 LEU CB 3.825 . 6.650 7.451 7.176 7.856 1.206 4 10 [**-+******] 1
456 1 33 VAL CG1 1 35 VAL CB 4.600 . 8.200 5.744 5.563 5.971 . 0 0 "[ . 1]" 1
457 1 33 VAL CG1 1 36 ILE CB 4.600 . 8.200 9.872 9.708 10.017 1.817 2 10 [*+******-*] 1
458 1 23 GLY CA 1 33 VAL CG2 4.600 . 8.200 4.943 4.727 5.300 . 0 0 "[ . 1]" 1
459 1 36 ILE CG1 1 62 ILE CB 4.600 . 8.200 8.804 8.603 9.000 0.800 1 8 "[+***.**- *]" 1
460 1 8 VAL CG1 1 18 THR CB 3.825 . 6.650 4.955 4.501 5.194 . 0 0 "[ . 1]" 1
461 1 27 PHE CB 1 31 LYS CA 3.825 . 6.650 11.296 10.925 11.588 4.938 3 10 [**+******-] 1
462 1 43 LYS CB 1 57 ASP CA 4.600 . 8.200 8.702 8.537 8.837 0.637 2 5 "[ +*** - 1]" 1
463 1 7 ARG CA 1 70 GLN CG 4.600 . 8.200 3.999 3.940 4.060 . 0 0 "[ . 1]" 1
464 1 3 ARG CA 1 70 GLN CG 4.600 . 8.200 4.898 4.819 4.980 . 0 0 "[ . 1]" 1
465 1 27 PHE CA 1 48 VAL CB 4.600 . 8.200 6.090 5.955 6.199 . 0 0 "[ . 1]" 1
466 1 44 ASN CA 1 48 VAL CB 4.600 . 8.200 5.161 5.050 5.254 . 0 0 "[ . 1]" 1
467 1 35 VAL CB 1 41 LYS CA 4.600 . 8.200 11.209 10.865 11.732 3.532 4 10 [-**+******] 1
468 1 9 GLU CB 1 15 HIS CA 3.825 . 6.650 6.206 6.039 6.306 . 0 0 "[ . 1]" 1
469 1 45 ASP CA 1 52 LYS CB 4.600 . 8.200 5.896 5.742 6.295 . 0 0 "[ . 1]" 1
470 1 1 PRO CB 1 3 ARG CA 3.825 . 6.650 4.391 4.360 4.423 . 0 0 "[ . 1]" 1
471 1 1 PRO CB 1 2 LEU CA 3.825 . 6.650 3.817 3.765 3.850 . 0 0 "[ . 1]" 1
472 1 7 ARG CA 1 19 VAL CB 3.825 . 6.650 6.059 5.398 6.540 . 0 0 "[ . 1]" 1
473 1 2 LEU CA 1 4 VAL CB 4.600 . 8.200 5.788 5.549 6.158 . 0 0 "[ . 1]" 1
474 1 28 ALA CA 1 51 ARG CB 4.600 . 8.200 9.999 9.251 10.617 2.417 3 10 [**+***-***] 1
475 1 11 ILE CG1 1 68 GLN CA 4.600 . 8.200 4.492 4.180 4.661 . 0 0 "[ . 1]" 1
476 1 39 GLU CA 1 43 LYS CD 4.600 . 8.200 7.423 7.246 7.569 . 0 0 "[ . 1]" 1
477 1 9 GLU CA 1 11 ILE CG1 4.600 . 8.200 6.590 6.359 6.736 . 0 0 "[ . 1]" 1
478 1 15 HIS CA 1 36 ILE CG1 3.825 . 6.650 5.795 5.377 6.174 . 0 0 "[ . 1]" 1
479 1 7 ARG CG 1 9 GLU CA 3.825 . 6.650 5.664 5.238 6.150 . 0 0 "[ . 1]" 1
480 1 36 ILE CG1 1 41 LYS CA 4.600 . 8.200 11.483 11.229 11.677 3.477 1 10 [+-********] 1
481 1 37 LEU CG 1 39 GLU CA 4.600 . 8.200 5.148 4.791 5.340 . 0 0 "[ . 1]" 1
482 1 49 GLN CB 1 52 LYS CA 4.600 . 8.200 8.290 8.221 8.457 0.257 9 0 "[ . 1]" 1
483 1 41 LYS CG 1 43 LYS CA 4.600 . 8.200 6.734 6.588 6.858 . 0 0 "[ . 1]" 1
484 1 26 LEU CA 1 52 LYS CG 4.600 . 8.200 10.355 10.195 10.547 2.347 4 10 [***+**-***] 1
485 1 33 VAL CG2 1 65 ARG CA 3.400 . 5.800 4.082 3.961 4.202 . 0 0 "[ . 1]" 1
486 1 8 VAL CG2 1 9 GLU CA 4.600 . 8.200 4.269 3.881 4.657 . 0 0 "[ . 1]" 1
487 1 26 LEU CA 1 28 ALA CB 4.600 . 8.200 6.161 5.839 6.499 . 0 0 "[ . 1]" 1
488 1 25 THR CG2 1 26 LEU CA 4.600 . 8.200 4.934 4.095 5.272 . 0 0 "[ . 1]" 1
489 1 37 LEU CD1 1 41 LYS CA 4.600 . 8.200 5.809 5.399 6.230 . 0 0 "[ . 1]" 1
490 1 27 PHE CA 1 48 VAL CG1 4.600 . 8.200 4.299 4.216 4.406 . 0 0 "[ . 1]" 1
491 1 7 ARG CA 1 69 ILE CG2 4.600 . 8.200 5.817 5.672 6.003 . 0 0 "[ . 1]" 1
492 1 8 VAL CG1 1 15 HIS CA 3.825 . 6.650 5.302 4.731 5.984 . 0 0 "[ . 1]" 1
493 1 64 VAL CA 1 69 ILE CD1 4.600 . 8.200 6.303 5.952 6.610 . 0 0 "[ . 1]" 1
494 1 24 ALA CB 1 25 THR CA 4.600 . 8.200 4.351 4.287 4.433 . 0 0 "[ . 1]" 1
495 1 47 THR CG2 1 53 TYR CA 4.600 . 8.200 8.350 8.315 8.398 0.198 5 0 "[ . 1]" 1
496 1 64 VAL CG1 1 66 GLN CA 4.600 . 8.200 8.056 6.521 8.303 0.103 7 0 "[ . 1]" 1
497 1 11 ILE CG2 1 67 SER CA 4.600 . 8.200 8.215 8.112 8.322 0.122 9 0 "[ . 1]" 1
498 1 43 LYS CA 1 47 THR CG2 4.600 . 8.200 7.360 7.263 7.403 . 0 0 "[ . 1]" 1
499 1 6 SER CB 1 7 ARG CB 4.600 . 8.200 5.264 5.200 5.325 . 0 0 "[ . 1]" 1
500 1 2 LEU CG 1 67 SER CB 3.825 . 6.650 5.287 5.222 5.394 . 0 0 "[ . 1]" 1
501 1 1 PRO CG 1 6 SER CA 4.600 . 8.200 8.555 8.362 8.689 0.489 6 0 "[ . 1]" 1
502 1 2 LEU CD1 1 4 VAL CA 4.600 . 8.200 6.654 6.334 7.170 . 0 0 "[ . 1]" 1
503 1 4 VAL CG2 1 6 SER CB 3.825 . 6.650 5.030 3.978 5.736 . 0 0 "[ . 1]" 1
504 1 19 VAL CA 1 35 VAL CG2 4.600 . 8.200 4.890 4.301 5.480 . 0 0 "[ . 1]" 1
505 1 25 THR CA 1 52 LYS CG 4.600 . 8.200 6.894 6.430 7.069 . 0 0 "[ . 1]" 1
506 1 20 ALA CB 1 33 VAL CA 3.825 . 6.650 4.041 3.972 4.215 . 0 0 "[ . 1]" 1
507 1 2 LEU CD1 1 69 ILE CA 3.825 . 6.650 5.706 5.422 6.092 . 0 0 "[ . 1]" 1
508 1 8 VAL CA 1 19 VAL CG1 4.600 . 8.200 4.605 3.808 5.112 . 0 0 "[ . 1]" 1
509 1 37 LEU CD1 1 38 ASP CA 3.825 . 6.650 6.071 4.612 6.555 . 0 0 "[ . 1]" 1
510 1 31 LYS CA 1 33 VAL CG1 4.600 . 8.200 5.950 5.896 5.991 . 0 0 "[ . 1]" 1
511 1 18 THR CA 1 36 ILE CG1 3.825 . 6.650 4.128 3.969 4.401 . 0 0 "[ . 1]" 1
512 1 35 VAL CA 1 37 LEU CG 4.600 . 8.200 5.164 5.057 5.403 . 0 0 "[ . 1]" 1
513 1 25 THR CB 1 28 ALA CB 4.600 . 8.200 5.657 5.326 5.897 . 0 0 "[ . 1]" 1
514 1 18 THR CA 1 33 VAL CB 4.600 . 8.200 6.252 6.123 6.343 . 0 0 "[ . 1]" 1
515 1 66 GLN CA 1 68 GLN CB 4.600 . 8.200 5.679 5.591 5.814 . 0 0 "[ . 1]" 1
516 1 11 ILE CB 1 66 GLN CA 4.600 . 8.200 9.459 9.346 9.600 1.400 9 10 [***-****+*] 1
517 1 45 ASP CB 1 58 GLU CA 3.825 . 6.650 4.340 4.323 4.353 . 0 0 "[ . 1]" 1
518 1 15 HIS CB 1 38 ASP CA 4.600 . 8.200 4.745 4.700 4.779 . 0 0 "[ . 1]" 1
519 1 38 ASP CA 1 58 GLU CB 4.600 . 8.200 11.704 11.531 11.918 3.718 9 10 [*****-**+*] 1
520 1 7 ARG CB 1 8 VAL CA 4.600 . 8.200 4.469 4.434 4.524 . 0 0 "[ . 1]" 1
521 1 26 LEU CB 1 49 GLN CA 4.600 . 8.200 5.386 4.880 5.532 . 0 0 "[ . 1]" 1
522 1 43 LYS CA 1 57 ASP CB 4.600 . 8.200 4.745 4.731 4.756 . 0 0 "[ . 1]" 1
523 1 12 GLY CA 1 68 GLN CA 3.825 . 6.650 3.366 3.362 3.372 . 0 0 "[ . 1]" 1
524 1 23 GLY CA 1 31 LYS CA 4.600 . 8.200 4.128 3.905 4.293 . 0 0 "[ . 1]" 1
525 1 23 GLY CA 1 33 VAL CA 4.600 . 8.200 6.586 6.406 6.748 . 0 0 "[ . 1]" 1
526 1 23 GLY CA 1 29 THR CA 4.600 . 8.200 8.175 8.056 8.227 0.027 10 0 "[ . 1]" 1
527 1 37 LEU CA 1 59 GLY CA 4.600 . 8.200 5.734 5.561 5.893 . 0 0 "[ . 1]" 1
528 1 21 TYR CB 1 34 GLY C 4.600 . 8.200 7.022 6.853 7.152 . 0 0 "[ . 1]" 1
529 1 4 VAL CB 1 22 VAL CB 3.825 . 6.650 5.220 5.000 5.482 . 0 0 "[ . 1]" 1
530 1 27 PHE C 1 49 GLN CG 3.400 . 5.800 6.903 6.435 7.622 1.822 8 10 [*-*****+**] 1
531 1 11 ILE CA 1 15 HIS C 3.825 . 6.650 7.657 7.163 7.885 1.235 6 10 [*****+**-*] 1
532 1 54 PHE CA 1 58 GLU CB 3.825 . 6.650 8.038 7.986 8.085 1.435 3 10 [**+******-] 1
533 1 26 LEU CA 1 51 ARG CG 3.400 . 5.800 6.070 5.489 6.570 0.770 4 3 "[ -+. *1]" 1
534 1 9 GLU CA 1 11 ILE CG1 3.400 . 5.800 4.687 4.328 4.965 . 0 0 "[ . 1]" 1
535 1 37 LEU CG 1 41 LYS CA 3.400 . 5.800 6.527 6.038 6.815 1.015 8 7 "[ -***+**]" 1
536 1 11 ILE CG1 1 69 ILE CA 3.825 . 6.650 4.276 3.984 4.521 . 0 0 "[ . 1]" 1
537 1 33 VAL C 1 61 GLY CA 4.600 . 8.200 6.779 6.643 6.899 . 0 0 "[ . 1]" 1
538 1 37 LEU C 1 59 GLY CA 4.600 . 8.200 2.345 2.335 2.363 . 0 0 "[ . 1]" 1
539 1 23 GLY CA 1 34 GLY C 4.600 . 8.200 7.324 7.258 7.397 . 0 0 "[ . 1]" 1
540 1 5 GLY CA 1 7 ARG C 4.600 . 8.200 4.806 4.771 4.877 . 0 0 "[ . 1]" 1
541 1 5 GLY CA 1 18 THR C 4.600 . 8.200 2.451 2.443 2.459 . 0 0 "[ . 1]" 1
542 1 43 LYS C 1 62 ILE CB 4.600 . 8.200 8.079 7.600 8.271 0.071 8 0 "[ . 1]" 1
543 1 46 GLY CA 1 47 THR C 4.600 . 8.200 4.814 4.796 4.832 . 0 0 "[ . 1]" 1
544 1 35 VAL C 1 46 GLY CA 4.600 . 8.200 4.128 4.103 4.150 . 0 0 "[ . 1]" 1
545 1 46 GLY CA 1 55 THR C 4.600 . 8.200 4.380 4.240 4.495 . 0 0 "[ . 1]" 1
546 1 41 LYS C 1 46 GLY CA 4.600 . 8.200 12.796 12.540 13.020 4.820 4 10 [**-+******] 1
547 1 32 TRP C 1 65 ARG CD 4.600 . 8.200 7.491 6.730 7.757 . 0 0 "[ . 1]" 1
548 1 34 GLY C 1 65 ARG CD 4.600 . 8.200 10.769 10.035 11.043 2.843 7 10 [*-****+***] 1
549 1 26 LEU CB 1 53 TYR C 4.600 . 8.200 12.153 11.879 12.653 4.453 4 10 [***+*-****] 1
550 1 26 LEU CB 1 28 ALA C 4.600 . 8.200 5.299 4.877 5.591 . 0 0 "[ . 1]" 1
551 1 25 THR C 1 26 LEU CB 4.600 . 8.200 3.700 3.688 3.705 . 0 0 "[ . 1]" 1
552 1 37 LEU CB 1 59 GLY C 4.600 . 8.200 5.108 4.757 5.325 . 0 0 "[ . 1]" 1
553 1 44 ASN C 1 57 ASP CB 4.600 . 8.200 6.946 6.718 7.131 . 0 0 "[ . 1]" 1
554 1 46 GLY C 1 57 ASP CB 4.600 . 8.200 6.525 6.449 6.641 . 0 0 "[ . 1]" 1
555 1 54 PHE C 1 57 ASP CB 4.600 . 8.200 9.090 8.988 9.251 1.051 3 10 [**+*****-*] 1
556 1 44 ASN C 1 45 ASP CB 4.600 . 8.200 3.702 3.686 3.717 . 0 0 "[ . 1]" 1
557 1 26 LEU C 1 45 ASP CB 4.600 . 8.200 13.345 12.684 13.829 5.629 2 10 [*+**-*****] 1
558 1 44 ASN CB 1 60 HIS C 4.600 . 8.200 4.476 3.928 4.703 . 0 0 "[ . 1]" 1
559 1 44 ASN CB 1 55 THR C 4.600 . 8.200 8.024 7.743 8.281 0.081 2 0 "[ . 1]" 1
560 1 16 ARG C 1 38 ASP CB 4.600 . 8.200 5.046 4.970 5.074 . 0 0 "[ . 1]" 1
561 1 35 VAL C 1 36 ILE CB 4.600 . 8.200 3.653 3.628 3.672 . 0 0 "[ . 1]" 1
562 1 11 ILE CB 1 14 GLY C 4.600 . 8.200 5.747 5.609 5.931 . 0 0 "[ . 1]" 1
563 1 27 PHE CB 1 28 ALA C 4.600 . 8.200 5.005 4.957 5.036 . 0 0 "[ . 1]" 1
564 1 8 VAL CB 1 9 GLU C 4.600 . 8.200 4.725 4.650 4.783 . 0 0 "[ . 1]" 1
565 1 8 VAL CB 1 18 THR C 4.600 . 8.200 4.075 3.652 4.554 . 0 0 "[ . 1]" 1
566 1 33 VAL C 1 64 VAL CB 4.600 . 8.200 5.213 5.077 5.398 . 0 0 "[ . 1]" 1
567 1 32 TRP C 1 64 VAL CB 4.600 . 8.200 5.159 5.088 5.470 . 0 0 "[ . 1]" 1
568 1 27 PHE C 1 48 VAL CB 4.600 . 8.200 8.237 7.901 8.390 0.190 9 0 "[ . 1]" 1
569 1 20 ALA C 1 22 VAL CB 4.600 . 8.200 5.465 5.394 5.515 . 0 0 "[ . 1]" 1
570 1 21 TYR C 1 22 VAL CB 4.600 . 8.200 3.517 3.474 3.557 . 0 0 "[ . 1]" 1
571 1 35 VAL CB 1 59 GLY C 4.600 . 8.200 9.625 9.358 10.059 1.859 4 10 [-**+******] 1
572 1 33 VAL C 1 35 VAL CB 4.600 . 8.200 5.500 5.417 5.616 . 0 0 "[ . 1]" 1
573 1 22 VAL C 1 35 VAL CB 4.600 . 8.200 5.625 5.370 5.908 . 0 0 "[ . 1]" 1
574 1 28 ALA C 1 31 LYS CB 4.600 . 8.200 8.836 8.458 9.039 0.839 2 8 "[ +*-*****1]" 1
575 1 22 VAL C 1 31 LYS CB 4.600 . 8.200 6.291 5.873 6.669 . 0 0 "[ . 1]" 1
576 1 33 VAL CB 1 62 ILE C 4.600 . 8.200 7.347 7.118 7.674 . 0 0 "[ . 1]" 1
577 1 16 ARG C 1 39 GLU CB 4.600 . 8.200 4.801 4.759 4.857 . 0 0 "[ . 1]" 1
578 1 16 ARG CB 1 18 THR C 4.600 . 8.200 7.402 7.190 7.626 . 0 0 "[ . 1]" 1
579 1 18 THR C 1 19 VAL CB 4.600 . 8.200 3.687 3.640 3.727 . 0 0 "[ . 1]" 1
580 1 4 VAL C 1 19 VAL CB 4.600 . 8.200 4.891 4.406 5.220 . 0 0 "[ . 1]" 1
581 1 65 ARG CB 1 66 GLN C 4.600 . 8.200 4.717 4.691 4.741 . 0 0 "[ . 1]" 1
582 1 4 VAL CB 1 6 SER C 4.600 . 8.200 4.793 4.680 5.080 . 0 0 "[ . 1]" 1
583 1 27 PHE C 1 51 ARG CB 4.600 . 8.200 8.492 7.560 9.382 1.182 3 2 "[ + . -1]" 1
584 1 36 ILE C 1 60 HIS CB 4.600 . 8.200 3.779 3.603 3.907 . 0 0 "[ . 1]" 1
585 1 43 LYS C 1 43 LYS CD 4.600 . 8.200 4.255 3.801 4.718 . 0 0 "[ . 1]" 1
586 1 42 GLY C 1 43 LYS CD 4.600 . 8.200 4.734 4.606 4.936 . 0 0 "[ . 1]" 1
587 1 43 LYS CD 1 59 GLY C 4.600 . 8.200 8.794 8.219 9.388 1.188 2 3 "[ + -* 1]" 1
588 1 35 VAL C 1 36 ILE CG1 4.600 . 8.200 3.935 3.786 4.099 . 0 0 "[ . 1]" 1
589 1 2 LEU CG 1 67 SER C 4.600 . 8.200 7.412 7.234 7.661 . 0 0 "[ . 1]" 1
590 1 37 LEU CG 1 60 HIS C 4.600 . 8.200 6.734 6.346 6.941 . 0 0 "[ . 1]" 1
591 1 37 LEU CG 1 42 GLY C 4.600 . 8.200 8.660 7.945 8.915 0.715 8 6 "[ - ** +**]" 1
592 1 16 ARG C 1 37 LEU CG 4.600 . 8.200 6.202 5.823 6.384 . 0 0 "[ . 1]" 1
593 1 2 LEU CD1 1 3 ARG C 4.600 . 8.200 5.633 5.301 6.038 . 0 0 "[ . 1]" 1
594 1 2 LEU CD1 1 6 SER C 4.600 . 8.200 6.599 6.270 6.851 . 0 0 "[ . 1]" 1
595 1 52 LYS CG 1 55 THR C 4.600 . 8.200 8.145 7.980 8.236 0.036 1 0 "[ . 1]" 1
596 1 47 THR C 1 52 LYS CG 4.600 . 8.200 6.401 6.334 6.451 . 0 0 "[ . 1]" 1
597 1 20 ALA CB 1 34 GLY C 4.600 . 8.200 3.514 3.263 3.757 . 0 0 "[ . 1]" 1
598 1 4 VAL CG1 1 18 THR C 4.600 . 8.200 6.507 5.355 6.772 . 0 0 "[ . 1]" 1
599 1 24 ALA CB 1 32 TRP C 4.600 . 8.200 4.674 4.603 4.725 . 0 0 "[ . 1]" 1
600 1 24 ALA CB 1 25 THR C 4.600 . 8.200 5.185 5.092 5.254 . 0 0 "[ . 1]" 1
601 1 9 GLU C 1 69 ILE CG2 4.600 . 8.200 3.378 3.179 3.508 . 0 0 "[ . 1]" 1
602 1 22 VAL C 1 24 ALA CB 4.600 . 8.200 6.735 6.620 6.815 . 0 0 "[ . 1]" 1
603 1 15 HIS C 1 69 ILE CG2 4.600 . 8.200 7.967 7.660 8.305 0.105 4 0 "[ . 1]" 1
604 1 34 GLY C 1 36 ILE CG2 4.600 . 8.200 6.887 6.069 7.752 . 0 0 "[ . 1]" 1
605 1 18 THR C 1 36 ILE CG2 4.600 . 8.200 6.235 5.910 6.852 . 0 0 "[ . 1]" 1
606 1 40 ALA CB 1 59 GLY C 4.600 . 8.200 4.815 4.719 5.007 . 0 0 "[ . 1]" 1
607 1 40 ALA CB 1 41 LYS C 4.600 . 8.200 4.604 4.424 5.060 . 0 0 "[ . 1]" 1
608 1 69 ILE C 1 69 ILE CD1 4.600 . 8.200 4.320 4.287 4.361 . 0 0 "[ . 1]" 1
609 1 9 GLU C 1 69 ILE CD1 4.600 . 8.200 4.946 4.884 5.013 . 0 0 "[ . 1]" 1
610 1 62 ILE C 1 69 ILE CD1 4.600 . 8.200 8.767 8.225 9.180 0.980 7 6 "[* **. +*-1]" 1
611 1 40 ALA C 1 62 ILE CD1 4.600 . 8.200 7.426 7.285 7.559 . 0 0 "[ . 1]" 1
612 1 59 GLY C 1 62 ILE CD1 4.600 . 8.200 6.149 5.753 6.629 . 0 0 "[ . 1]" 1
613 1 34 GLY C 1 36 ILE CD1 4.600 . 8.200 6.796 5.084 7.822 . 0 0 "[ . 1]" 1
614 1 9 GLU C 1 11 ILE CD1 4.600 . 8.200 3.926 3.477 4.295 . 0 0 "[ . 1]" 1
615 1 8 VAL CG2 1 17 GLY C 4.600 . 8.200 3.807 3.098 4.415 . 0 0 "[ . 1]" 1
616 1 44 ASN CG 1 48 VAL CG2 4.600 . 8.200 3.930 3.767 4.439 . 0 0 "[ . 1]" 1
617 1 37 LEU CD1 1 38 ASP CG 4.600 . 8.200 7.039 5.052 8.300 0.100 4 0 "[ . 1]" 1
618 1 34 GLY C 1 64 VAL CA 4.600 . 8.200 6.500 6.327 6.786 . 0 0 "[ . 1]" 1
619 1 9 GLU C 1 69 ILE CA 4.600 . 8.200 2.404 2.397 2.410 . 0 0 "[ . 1]" 1
620 1 58 GLU CA 1 61 GLY C 4.600 . 8.200 8.343 8.242 8.423 0.223 5 0 "[ . 1]" 1
621 1 8 VAL CA 1 15 HIS C 4.600 . 8.200 6.391 6.088 6.656 . 0 0 "[ . 1]" 1
622 1 38 ASP CG 1 60 HIS CA 4.600 . 8.200 8.267 7.986 8.523 0.323 7 0 "[ . 1]" 1
623 1 65 ARG C 1 68 GLN CA 4.600 . 8.200 4.310 4.142 4.512 . 0 0 "[ . 1]" 1
624 1 29 THR C 1 32 TRP CA 4.600 . 8.200 2.433 2.428 2.439 . 0 0 "[ . 1]" 1
625 1 25 THR C 1 27 PHE CA 4.600 . 8.200 4.345 4.306 4.376 . 0 0 "[ . 1]" 1
626 1 39 GLU CA 1 42 GLY C 4.600 . 8.200 2.430 2.423 2.437 . 0 0 "[ . 1]" 1
627 1 57 ASP CA 1 59 GLY C 4.600 . 8.200 6.597 6.525 6.660 . 0 0 "[ . 1]" 1
628 1 45 ASP C 1 51 ARG CA 4.600 . 8.200 7.813 7.665 8.048 . 0 0 "[ . 1]" 1
629 1 3 ARG CA 1 22 VAL C 4.600 . 8.200 5.301 5.220 5.360 . 0 0 "[ . 1]" 1
630 1 41 LYS C 1 44 ASN CA 4.600 . 8.200 4.357 4.314 4.400 . 0 0 "[ . 1]" 1
631 1 45 ASP CA 1 60 HIS C 4.600 . 8.200 5.098 4.603 5.303 . 0 0 "[ . 1]" 1
632 1 43 LYS C 1 45 ASP CA 4.600 . 8.200 5.171 5.013 5.270 . 0 0 "[ . 1]" 1
633 1 45 ASP CA 1 46 GLY C 4.600 . 8.200 4.336 4.327 4.348 . 0 0 "[ . 1]" 1
634 1 45 ASP CA 1 57 ASP C 4.600 . 8.200 6.260 6.114 6.450 . 0 0 "[ . 1]" 1
635 1 4 VAL C 1 20 ALA CA 4.600 . 8.200 5.705 5.561 5.848 . 0 0 "[ . 1]" 1
636 1 24 ALA CA 1 26 LEU C 4.600 . 8.200 7.544 7.494 7.603 . 0 0 "[ . 1]" 1
637 1 3 ARG C 1 20 ALA CA 4.600 . 8.200 7.447 7.225 7.635 . 0 0 "[ . 1]" 1
638 1 20 ALA CA 1 22 VAL C 4.600 . 8.200 7.743 7.681 7.781 . 0 0 "[ . 1]" 1
639 1 20 ALA CA 1 33 VAL C 4.600 . 8.200 5.905 5.741 6.099 . 0 0 "[ . 1]" 1
640 1 45 ASP C 1 48 VAL CB 4.600 . 8.200 4.945 4.849 5.043 . 0 0 "[ . 1]" 1
641 1 37 LEU CG 1 38 ASP CG 4.600 . 8.200 6.657 5.843 7.459 . 0 0 "[ . 1]" 1
642 1 9 GLU C 1 10 VAL CA 4.600 . 8.200 2.421 2.416 2.429 . 0 0 "[ . 1]" 1
643 1 10 VAL CA 1 14 GLY C 4.600 . 8.200 5.597 5.455 5.898 . 0 0 "[ . 1]" 1
644 1 55 THR CA 1 56 CYS C 4.600 . 8.200 4.846 4.839 4.856 . 0 0 "[ . 1]" 1
645 1 21 TYR C 1 22 VAL CA 4.600 . 8.200 2.448 2.441 2.455 . 0 0 "[ . 1]" 1
646 1 33 VAL CA 1 66 GLN C 4.600 . 8.200 7.464 7.095 7.713 . 0 0 "[ . 1]" 1
647 1 35 VAL CA 1 60 HIS C 4.600 . 8.200 6.333 6.108 6.517 . 0 0 "[ . 1]" 1
648 1 53 TYR CA 1 54 PHE C 4.600 . 8.200 4.849 4.841 4.854 . 0 0 "[ . 1]" 1
649 1 7 ARG C 1 18 THR CA 4.600 . 8.200 2.404 2.394 2.412 . 0 0 "[ . 1]" 1
650 1 17 GLY C 1 18 THR CA 4.600 . 8.200 2.443 2.432 2.452 . 0 0 "[ . 1]" 1
651 1 26 LEU C 1 29 THR CA 4.600 . 8.200 6.418 6.307 6.479 . 0 0 "[ . 1]" 1
652 1 18 THR CB 1 35 VAL CG2 4.600 . 8.200 7.888 7.226 8.263 0.063 1 0 "[ . 1]" 1
653 1 48 VAL CG1 1 55 THR CB 4.600 . 8.200 13.530 13.411 13.664 5.464 1 10 [+-********] 1
654 1 24 ALA CB 1 25 THR CB 4.600 . 8.200 5.668 5.581 5.714 . 0 0 "[ . 1]" 1
655 1 39 GLU CA 1 40 ALA CB 4.600 . 8.200 4.322 4.305 4.337 . 0 0 "[ . 1]" 1
656 1 68 GLN CA 1 69 ILE CD1 4.600 . 8.200 6.279 6.224 6.369 . 0 0 "[ . 1]" 1
657 1 60 HIS CA 1 62 ILE CD1 4.600 . 8.200 5.990 5.522 6.507 . 0 0 "[ . 1]" 1
658 1 17 GLY CA 1 18 THR CA 4.600 . 8.200 3.772 3.745 3.790 . 0 0 "[ . 1]" 1
659 1 8 VAL CA 1 17 GLY CA 4.600 . 8.200 5.204 5.056 5.333 . 0 0 "[ . 1]" 1
660 1 22 VAL CA 1 34 GLY CA 4.600 . 8.200 6.528 6.364 6.705 . 0 0 "[ . 1]" 1
661 1 34 GLY CA 1 63 PHE CA 4.600 . 8.200 4.515 4.326 4.855 . 0 0 "[ . 1]" 1
662 1 12 GLY CA 1 68 GLN CA 4.600 . 8.200 8.661 8.373 9.141 0.941 4 4 "[ **+- 1]" 1
663 1 36 ILE CA 1 59 GLY CA 4.600 . 8.200 8.112 7.816 8.269 0.069 7 0 "[ . 1]" 1
664 1 43 LYS CA 1 59 GLY CA 4.600 . 8.200 3.727 3.721 3.733 . 0 0 "[ . 1]" 1
665 1 60 HIS CA 1 62 ILE CB 4.600 . 8.200 6.586 6.466 6.675 . 0 0 "[ . 1]" 1
666 1 64 VAL CA 1 69 ILE CB 4.600 . 8.200 6.535 6.337 6.624 . 0 0 "[ . 1]" 1
667 1 20 ALA CA 1 21 TYR CB 4.600 . 8.200 4.833 4.818 4.843 . 0 0 "[ . 1]" 1
668 1 25 THR CA 1 26 LEU CB 4.600 . 8.200 4.711 4.697 4.756 . 0 0 "[ . 1]" 1
669 1 45 ASP CB 1 58 GLU CA 4.600 . 8.200 7.628 7.302 7.734 . 0 0 "[ . 1]" 1
670 1 54 PHE CA 1 57 ASP CB 4.600 . 8.200 4.819 4.808 4.826 . 0 0 "[ . 1]" 1
671 1 44 ASN CB 1 49 GLN CA 4.600 . 8.200 9.170 8.905 9.415 1.215 1 10 [+*-*******] 1
672 1 38 ASP CB 1 60 HIS CA 4.600 . 8.200 7.849 7.544 8.087 . 0 0 "[ . 1]" 1
673 1 9 GLU CA 1 11 ILE CB 4.600 . 8.200 6.680 6.385 6.995 . 0 0 "[ . 1]" 1
674 1 11 ILE CB 1 68 GLN CA 4.600 . 8.200 4.692 4.614 4.864 . 0 0 "[ . 1]" 1
675 1 36 ILE CA 1 54 PHE CB 4.600 . 8.200 6.718 6.462 7.104 . 0 0 "[ . 1]" 1
676 1 7 ARG CA 1 8 VAL CB 4.600 . 8.200 3.930 3.906 3.943 . 0 0 "[ . 1]" 1
677 1 32 TRP CA 1 64 VAL CB 4.600 . 8.200 5.254 5.172 5.602 . 0 0 "[ . 1]" 1
678 1 21 TYR CA 1 35 VAL CB 4.600 . 8.200 9.604 9.298 9.853 1.653 5 10 [****+**-**] 1
679 1 22 VAL CA 1 32 TRP CB 4.600 . 8.200 6.782 6.595 7.026 . 0 0 "[ . 1]" 1
680 1 8 VAL CA 1 10 VAL CB 4.600 . 8.200 5.430 5.050 5.650 . 0 0 "[ . 1]" 1
681 1 56 CYS CB 1 57 ASP CA 4.600 . 8.200 4.555 4.528 4.572 . 0 0 "[ . 1]" 1
682 1 31 LYS CA 1 65 ARG CB 4.600 . 8.200 7.301 6.988 7.522 . 0 0 "[ . 1]" 1
683 1 4 VAL CB 1 6 SER CA 4.600 . 8.200 5.387 5.230 5.590 . 0 0 "[ . 1]" 1
684 1 25 THR CA 1 51 ARG CB 4.600 . 8.200 6.632 6.392 6.866 . 0 0 "[ . 1]" 1
685 1 7 ARG CB 1 8 VAL CA 4.600 . 8.200 4.337 4.306 4.380 . 0 0 "[ . 1]" 1
686 1 11 ILE CG1 1 69 ILE CA 4.600 . 8.200 4.317 3.994 4.594 . 0 0 "[ . 1]" 1
687 1 36 ILE CG1 1 37 LEU CA 4.600 . 8.200 5.823 5.394 6.198 . 0 0 "[ . 1]" 1
688 1 36 ILE CG1 1 57 ASP CA 4.600 . 8.200 9.800 9.315 10.572 2.372 10 10 [****-****+] 1
689 1 25 THR CA 1 26 LEU CG 4.600 . 8.200 4.281 4.180 4.426 . 0 0 "[ . 1]" 1
690 1 26 LEU CG 1 28 ALA CA 4.600 . 8.200 7.674 7.256 7.953 . 0 0 "[ . 1]" 1
691 1 18 THR CA 1 37 LEU CG 4.600 . 8.200 5.482 5.360 5.677 . 0 0 "[ . 1]" 1
692 1 65 ARG CG 1 67 SER CA 4.600 . 8.200 6.314 6.231 6.409 . 0 0 "[ . 1]" 1
693 1 64 VAL CA 1 65 ARG CG 4.600 . 8.200 4.639 4.562 4.761 . 0 0 "[ . 1]" 1
694 1 9 GLU CA 1 69 ILE CG1 4.600 . 8.200 6.489 6.334 6.625 . 0 0 "[ . 1]" 1
695 1 48 VAL CA 1 52 LYS CG 4.600 . 8.200 7.463 7.385 7.537 . 0 0 "[ . 1]" 1
696 1 45 ASP CA 1 52 LYS CG 4.600 . 8.200 7.206 7.026 7.680 . 0 0 "[ . 1]" 1
697 1 44 ASN CA 1 52 LYS CG 4.600 . 8.200 9.870 9.776 10.048 1.848 2 10 [*+******-*] 1
698 1 18 THR CA 1 33 VAL CG2 4.600 . 8.200 6.297 6.113 7.196 . 0 0 "[ . 1]" 1
699 1 32 TRP CA 1 33 VAL CG2 4.600 . 8.200 4.209 3.941 4.322 . 0 0 "[ . 1]" 1
700 1 22 VAL CA 1 33 VAL CG2 4.600 . 8.200 4.517 4.310 4.785 . 0 0 "[ . 1]" 1
701 1 63 PHE CA 1 64 VAL CG2 4.600 . 8.200 5.148 4.960 6.032 . 0 0 "[ . 1]" 1
702 1 3 ARG CA 1 4 VAL CG2 4.600 . 8.200 4.078 3.806 4.409 . 0 0 "[ . 1]" 1
703 1 4 VAL CG2 1 21 TYR CA 4.600 . 8.200 4.034 3.862 5.045 . 0 0 "[ . 1]" 1
704 1 48 VAL CG2 1 53 TYR CA 4.600 . 8.200 6.411 5.952 6.751 . 0 0 "[ . 1]" 1
705 1 48 VAL CG2 1 49 GLN CA 4.600 . 8.200 5.033 4.791 5.190 . 0 0 "[ . 1]" 1
706 1 25 THR CG2 1 26 LEU CA 4.600 . 8.200 4.934 3.788 5.522 . 0 0 "[ . 1]" 1
707 1 3 ARG CA 1 20 ALA CB 4.600 . 8.200 10.251 9.976 10.516 2.316 7 10 [******+*-*] 1
708 1 4 VAL CG1 1 21 TYR CA 4.600 . 8.200 4.760 3.926 5.066 . 0 0 "[ . 1]" 1
709 1 35 VAL CG1 1 63 PHE CA 4.600 . 8.200 7.703 7.608 7.894 . 0 0 "[ . 1]" 1
710 1 20 ALA CA 1 33 VAL CG1 4.600 . 8.200 5.443 5.264 5.764 . 0 0 "[ . 1]" 1
711 1 32 TRP CA 1 33 VAL CG1 4.600 . 8.200 6.043 5.981 6.077 . 0 0 "[ . 1]" 1
712 1 47 THR CG2 1 52 LYS CA 4.600 . 8.200 4.346 4.167 4.468 . 0 0 "[ . 1]" 1
713 1 47 THR CG2 1 51 ARG CA 4.600 . 8.200 6.584 6.480 6.693 . 0 0 "[ . 1]" 1
714 1 9 GLU CA 1 64 VAL CG1 4.600 . 8.200 9.351 8.651 9.736 1.536 2 9 [*+****-**1] 1
715 1 7 ARG CA 1 8 VAL CG1 4.600 . 8.200 4.677 4.187 5.155 . 0 0 "[ . 1]" 1
716 1 15 HIS CA 1 36 ILE CG2 4.600 . 8.200 5.486 4.869 6.053 . 0 0 "[ . 1]" 1
717 1 11 ILE CG2 1 69 ILE CA 4.600 . 8.200 6.712 6.399 6.998 . 0 0 "[ . 1]" 1
718 1 20 ALA CB 1 22 VAL CA 4.600 . 8.200 6.132 5.718 6.645 . 0 0 "[ . 1]" 1
719 1 55 THR CA 1 58 GLU CB 4.600 . 8.200 11.407 11.308 11.462 3.262 8 10 [*******+*-] 1
720 1 1 PRO CA 1 2 LEU CG 4.600 . 8.200 5.034 4.580 6.011 . 0 0 "[ . 1]" 1
721 1 4 VAL CG1 1 19 VAL CA 4.600 . 8.200 5.345 4.937 5.728 . 0 0 "[ . 1]" 1
722 1 6 SER CA 1 19 VAL CB 4.600 . 8.200 5.236 4.567 5.576 . 0 0 "[ . 1]" 1
723 1 5 GLY CA 1 6 SER CB 4.600 . 8.200 4.824 4.805 4.862 . 0 0 "[ . 1]" 1
724 1 10 VAL CA 1 12 GLY CA 4.600 . 8.200 5.571 5.477 5.803 . 0 0 "[ . 1]" 1
725 1 36 ILE CB 1 55 THR CA 4.600 . 8.200 8.180 7.821 8.372 0.172 9 0 "[ . 1]" 1
726 1 11 ILE CG1 1 67 SER CB 4.600 . 8.200 7.445 7.184 7.642 . 0 0 "[ . 1]" 1
727 1 24 ALA CB 1 29 THR CA 4.600 . 8.200 4.271 4.066 4.473 . 0 0 "[ . 1]" 1
728 1 22 VAL CA 1 33 VAL CB 4.600 . 8.200 5.010 4.822 5.228 . 0 0 "[ . 1]" 1
729 1 1 PRO CG 1 6 SER CA 4.600 . 8.200 11.942 11.253 12.386 4.186 6 10 [*-***+****] 1
730 1 4 VAL CG1 1 6 SER CA 4.600 . 8.200 5.409 4.278 5.638 . 0 0 "[ . 1]" 1
731 1 46 GLY CA 1 47 THR CA 4.600 . 8.200 3.774 3.762 3.781 . 0 0 "[ . 1]" 1
732 1 44 ASN CB 1 47 THR CA 4.600 . 8.200 5.105 4.859 5.239 . 0 0 "[ . 1]" 1
733 1 2 LEU CD1 1 22 VAL CA 4.600 . 8.200 7.737 7.126 8.118 . 0 0 "[ . 1]" 1
734 1 22 VAL CA 1 31 LYS CB 4.600 . 8.200 7.078 6.686 7.478 . 0 0 "[ . 1]" 1
735 1 47 THR CA 1 49 GLN CB 4.600 . 8.200 4.432 4.387 4.478 . 0 0 "[ . 1]" 1
736 1 43 LYS CG 1 47 THR CA 4.600 . 8.200 6.413 5.859 7.105 . 0 0 "[ . 1]" 1
737 1 26 LEU CB 1 47 THR CA 4.600 . 8.200 7.763 6.993 8.028 . 0 0 "[ . 1]" 1
738 1 33 VAL CA 1 69 ILE CG2 4.600 . 8.200 7.080 6.729 7.540 . 0 0 "[ . 1]" 1
739 1 34 GLY CA 1 35 VAL CA 4.600 . 8.200 3.672 3.623 3.710 . 0 0 "[ . 1]" 1
740 1 53 TYR CA 1 57 ASP CB 4.600 . 8.200 12.431 12.119 12.861 4.661 2 10 [-+********] 1
741 1 23 GLY CA 1 53 TYR CA 4.600 . 8.200 8.139 7.929 8.247 0.047 7 0 "[ . 1]" 1
742 1 35 VAL CA 1 63 PHE CB 4.600 . 8.200 7.775 7.531 7.997 . 0 0 "[ . 1]" 1
743 1 49 GLN CG 1 53 TYR CA 4.600 . 8.200 11.331 9.529 11.876 3.676 7 10 [******+*-*] 1
744 1 21 TYR CB 1 35 VAL CA 4.600 . 8.200 6.272 6.166 6.423 . 0 0 "[ . 1]" 1
745 1 32 TRP CB 1 62 ILE CA 4.600 . 8.200 9.137 8.910 9.428 1.228 4 10 [**-+******] 1
746 1 18 THR CA 1 38 ASP CB 4.600 . 8.200 6.842 6.519 7.119 . 0 0 "[ . 1]" 1
747 1 62 ILE CA 1 64 VAL CB 4.600 . 8.200 6.119 6.043 6.232 . 0 0 "[ . 1]" 1
748 1 18 THR CA 1 35 VAL CB 4.600 . 8.200 4.237 4.134 4.294 . 0 0 "[ . 1]" 1
749 1 4 VAL CB 1 18 THR CA 4.600 . 8.200 8.478 8.073 8.865 0.665 7 1 "[ . + 1]" 1
750 1 18 THR CA 1 37 LEU CG 4.600 . 8.200 5.352 5.224 5.558 . 0 0 "[ . 1]" 1
751 1 18 THR CA 1 69 ILE CG2 4.600 . 8.200 9.165 8.942 9.588 1.388 5 10 [**-*+*****] 1
752 1 35 VAL CG1 1 64 VAL CA 4.600 . 8.200 7.569 7.321 7.748 . 0 0 "[ . 1]" 1
753 1 33 VAL CG1 1 64 VAL CA 4.600 . 8.200 6.037 5.907 6.196 . 0 0 "[ . 1]" 1
754 1 64 VAL CA 1 66 GLN CB 4.600 . 8.200 7.987 7.782 8.137 . 0 0 "[ . 1]" 1
755 1 21 TYR CA 1 33 VAL CG1 4.600 . 8.200 5.878 5.690 6.083 . 0 0 "[ . 1]" 1
756 1 8 VAL CA 1 16 ARG CD 4.600 . 8.200 4.384 4.296 4.428 . 0 0 "[ . 1]" 1
757 1 38 ASP CA 1 40 ALA CB 4.600 . 8.200 5.866 5.833 5.963 . 0 0 "[ . 1]" 1
758 1 31 LYS CA 1 32 TRP CB 4.600 . 8.200 4.660 4.623 4.744 . 0 0 "[ . 1]" 1
759 1 31 LYS CA 1 33 VAL CG2 4.600 . 8.200 5.213 5.135 5.386 . 0 0 "[ . 1]" 1
760 1 68 GLN CA 1 69 ILE CG1 4.600 . 8.200 4.935 4.863 5.001 . 0 0 "[ . 1]" 1
761 1 65 ARG CD 1 68 GLN CA 4.600 . 8.200 5.137 5.055 5.550 . 0 0 "[ . 1]" 1
762 1 52 LYS CA 1 58 GLU CB 4.600 . 8.200 12.457 12.277 12.858 4.658 2 10 [*+******-*] 1
763 1 2 LEU CD1 1 68 GLN CA 4.600 . 8.200 8.372 8.157 8.514 0.314 4 0 "[ . 1]" 1
764 1 28 ALA CB 1 32 TRP CA 4.600 . 8.200 4.914 4.713 5.086 . 0 0 "[ . 1]" 1
765 1 37 LEU CB 1 60 HIS CA 4.600 . 8.200 4.608 4.225 4.817 . 0 0 "[ . 1]" 1
766 1 27 PHE CA 1 50 GLY CA 4.600 . 8.200 3.744 3.722 3.770 . 0 0 "[ . 1]" 1
767 1 26 LEU CG 1 27 PHE CA 4.600 . 8.200 5.485 4.783 5.964 . 0 0 "[ . 1]" 1
768 1 25 THR CG2 1 27 PHE CA 4.600 . 8.200 5.248 4.219 5.920 . 0 0 "[ . 1]" 1
769 1 44 ASN CB 1 54 PHE CA 4.600 . 8.200 3.939 3.804 4.280 . 0 0 "[ . 1]" 1
770 1 25 THR CG2 1 27 PHE CA 4.600 . 8.200 5.608 4.271 6.394 . 0 0 "[ . 1]" 1
771 1 47 THR CG2 1 54 PHE CA 4.600 . 8.200 7.470 7.380 7.517 . 0 0 "[ . 1]" 1
772 1 2 LEU CA 1 66 GLN CG 4.600 . 8.200 7.021 6.150 8.040 . 0 0 "[ . 1]" 1
773 1 15 HIS CA 1 39 GLU CB 4.600 . 8.200 7.489 7.232 7.842 . 0 0 "[ . 1]" 1
774 1 13 LYS CB 1 16 ARG CA 4.600 . 8.200 9.729 9.430 10.146 1.946 9 10 [-*******+*] 1
775 1 9 GLU CB 1 16 ARG CA 4.600 . 8.200 5.817 5.155 6.433 . 0 0 "[ . 1]" 1
776 1 11 ILE CG1 1 16 ARG CA 4.600 . 8.200 10.963 10.164 11.493 3.293 4 10 [***+****-*] 1
777 1 16 ARG CA 1 62 ILE CD1 4.600 . 8.200 11.576 10.212 12.791 4.591 10 10 [-********+] 1
778 1 39 GLU CA 1 59 GLY CA 4.600 . 8.200 6.989 6.896 7.044 . 0 0 "[ . 1]" 1
779 1 39 GLU CA 1 40 ALA CB 4.600 . 8.200 4.311 4.294 4.327 . 0 0 "[ . 1]" 1
780 1 45 ASP CB 1 57 ASP CA 4.600 . 8.200 6.982 6.699 7.333 . 0 0 "[ . 1]" 1
781 1 9 GLU CA 1 16 ARG CD 4.600 . 8.200 7.476 6.341 8.142 . 0 0 "[ . 1]" 1
782 1 25 THR CG2 1 26 LEU CA 4.600 . 8.200 5.327 4.199 5.808 . 0 0 "[ . 1]" 1
783 1 9 GLU CA 1 70 GLN CB 4.600 . 8.200 5.176 4.537 5.642 . 0 0 "[ . 1]" 1
784 1 21 TYR CB 1 51 ARG CA 4.600 . 8.200 9.149 8.838 9.511 1.311 3 10 [**+-******] 1
785 1 49 GLN CG 1 51 ARG CA 4.600 . 8.200 6.292 4.829 6.667 . 0 0 "[ . 1]" 1
786 1 9 GLU CA 1 10 VAL CB 4.600 . 8.200 4.423 3.998 4.617 . 0 0 "[ . 1]" 1
787 1 2 LEU CD1 1 3 ARG CA 4.600 . 8.200 5.834 5.461 6.304 . 0 0 "[ . 1]" 1
788 1 41 LYS CA 1 44 ASN CB 4.600 . 8.200 8.964 8.871 9.041 0.841 4 10 [***+***-**] 1
789 1 48 VAL CG2 1 51 ARG CA 4.600 . 8.200 6.194 5.918 6.417 . 0 0 "[ . 1]" 1
790 1 65 ARG CA 1 69 ILE CB 4.600 . 8.200 6.344 6.243 6.514 . 0 0 "[ . 1]" 1
791 1 41 LYS CA 1 59 GLY CA 4.600 . 8.200 3.467 3.444 3.540 . 0 0 "[ . 1]" 1
792 1 44 ASN CA 1 48 VAL CG1 4.600 . 8.200 6.583 6.506 6.691 . 0 0 "[ . 1]" 1
793 1 44 ASN CA 1 52 LYS CB 4.600 . 8.200 8.373 8.281 8.522 0.322 2 0 "[ . 1]" 1
794 1 41 LYS CA 1 58 GLU CB 4.600 . 8.200 4.561 4.490 4.687 . 0 0 "[ . 1]" 1
795 1 43 LYS CG 1 44 ASN CA 4.600 . 8.200 4.907 4.526 5.267 . 0 0 "[ . 1]" 1
796 1 64 VAL CG1 1 65 ARG CA 4.600 . 8.200 5.839 5.214 5.931 . 0 0 "[ . 1]" 1
797 1 7 ARG CA 1 70 GLN CG 4.600 . 8.200 8.249 5.966 10.557 2.357 5 3 "[ * + -1]" 1
798 1 45 ASP CA 1 61 GLY CA 4.600 . 8.200 4.890 4.412 5.173 . 0 0 "[ . 1]" 1
799 1 45 ASP CA 1 51 ARG CB 4.600 . 8.200 8.899 8.692 9.306 1.106 3 9 [**+*-****1] 1
800 1 45 ASP CA 1 60 HIS CB 4.600 . 8.200 6.327 5.812 6.566 . 0 0 "[ . 1]" 1
801 1 28 ALA CA 1 30 GLY CA 4.600 . 8.200 6.776 6.581 6.841 . 0 0 "[ . 1]" 1
802 1 4 VAL CG2 1 20 ALA CA 4.600 . 8.200 3.955 3.636 5.225 . 0 0 "[ . 1]" 1
803 1 5 GLY CA 1 20 ALA CA 4.600 . 8.200 3.773 3.765 3.781 . 0 0 "[ . 1]" 1
804 1 20 ALA CA 1 35 VAL CG2 4.600 . 8.200 6.539 6.148 6.882 . 0 0 "[ . 1]" 1
805 1 38 ASP CB 1 40 ALA CA 4.600 . 8.200 6.699 6.658 6.739 . 0 0 "[ . 1]" 1
806 1 15 HIS CB 1 40 ALA CA 4.600 . 8.200 10.460 9.987 11.005 2.805 10 10 [****-****+] 1
807 1 44 ASN CA 1 55 THR CA 4.600 . 8.200 5.271 5.196 5.371 . 0 0 "[ . 1]" 1
808 1 1 PRO CA 1 66 GLN CA 4.600 . 8.200 7.024 6.244 7.458 . 0 0 "[ . 1]" 1
809 1 27 PHE CA 1 29 THR CA 4.600 . 8.200 7.041 6.990 7.092 . 0 0 "[ . 1]" 1
810 1 24 ALA CA 1 29 THR CA 4.600 . 8.200 4.707 4.628 4.799 . 0 0 "[ . 1]" 1
811 1 6 SER CA 1 7 ARG CA 4.600 . 8.200 3.801 3.787 3.818 . 0 0 "[ . 1]" 1
812 1 6 SER CA 1 8 VAL CA 4.600 . 8.200 6.480 6.409 6.572 . 0 0 "[ . 1]" 1
813 1 29 THR CA 1 31 LYS CA 4.600 . 8.200 6.752 6.527 7.012 . 0 0 "[ . 1]" 1
814 1 1 PRO CA 1 6 SER CA 4.600 . 8.200 10.937 10.526 11.430 3.230 10 10 [****-****+] 1
815 1 3 ARG CA 1 6 SER CA 4.600 . 8.200 4.356 4.328 4.394 . 0 0 "[ . 1]" 1
816 1 20 ALA CA 1 22 VAL CA 4.600 . 8.200 6.412 6.375 6.454 . 0 0 "[ . 1]" 1
817 1 21 TYR CA 1 22 VAL CA 4.600 . 8.200 3.810 3.797 3.823 . 0 0 "[ . 1]" 1
818 1 19 VAL CA 1 33 VAL CA 4.600 . 8.200 6.943 6.530 7.195 . 0 0 "[ . 1]" 1
819 1 26 LEU CA 1 53 TYR CA 4.600 . 8.200 10.876 10.624 11.284 3.084 4 10 [***+*-****] 1
820 1 6 SER CA 1 18 THR CA 4.600 . 8.200 5.574 5.352 5.858 . 0 0 "[ . 1]" 1
821 1 35 VAL CA 1 64 VAL CA 4.600 . 8.200 5.857 5.740 5.907 . 0 0 "[ . 1]" 1
822 1 8 VAL CA 1 18 THR CA 4.600 . 8.200 3.658 3.622 3.696 . 0 0 "[ . 1]" 1
823 1 45 ASP CA 1 53 TYR CA 4.600 . 8.200 4.814 4.489 5.578 . 0 0 "[ . 1]" 1
824 1 18 THR CA 1 19 VAL CA 4.600 . 8.200 3.774 3.764 3.800 . 0 0 "[ . 1]" 1
825 1 7 ARG CA 1 18 THR CA 4.600 . 8.200 4.494 4.199 5.121 . 0 0 "[ . 1]" 1
826 1 67 SER CA 1 68 GLN CA 4.600 . 8.200 3.800 3.790 3.809 . 0 0 "[ . 1]" 1
827 1 28 ALA CA 1 64 VAL CA 4.600 . 8.200 11.168 10.684 11.699 3.499 7 10 [******+**-] 1
828 1 21 TYR CA 1 33 VAL CA 4.600 . 8.200 4.862 4.766 4.982 . 0 0 "[ . 1]" 1
829 1 43 LYS CA 1 58 GLU CA 4.600 . 8.200 4.672 4.512 4.846 . 0 0 "[ . 1]" 1
830 1 8 VAL CA 1 18 THR CA 4.600 . 8.200 3.683 3.645 3.729 . 0 0 "[ . 1]" 1
831 1 31 LYS CA 1 33 VAL CA 4.600 . 8.200 7.047 6.975 7.123 . 0 0 "[ . 1]" 1
832 1 22 VAL CA 1 31 LYS CA 4.600 . 8.200 3.725 3.710 3.741 . 0 0 "[ . 1]" 1
833 1 41 LYS CA 1 43 LYS CA 4.600 . 8.200 3.710 3.687 3.733 . 0 0 "[ . 1]" 1
834 1 35 VAL CA 1 60 HIS CA 4.600 . 8.200 3.555 3.465 3.600 . 0 0 "[ . 1]" 1
835 1 39 GLU CA 1 60 HIS CA 4.600 . 8.200 3.757 3.753 3.762 . 0 0 "[ . 1]" 1
836 1 24 ALA CA 1 27 PHE CA 4.600 . 8.200 8.325 8.205 8.423 0.223 3 0 "[ . 1]" 1
837 1 40 ALA CA 1 54 PHE CA 4.600 . 8.200 14.093 13.740 14.612 6.412 3 10 [**+******-] 1
838 1 26 LEU CA 1 27 PHE CA 4.600 . 8.200 3.361 3.357 3.365 . 0 0 "[ . 1]" 1
839 1 36 ILE CA 1 41 LYS CA 4.600 . 8.200 9.353 9.109 9.618 1.418 7 10 [*-****+***] 1
840 1 44 ASN CA 1 47 THR CA 4.600 . 8.200 5.436 5.231 5.568 . 0 0 "[ . 1]" 1
841 1 65 ARG CA 1 69 ILE CA 4.600 . 8.200 6.591 6.488 6.813 . 0 0 "[ . 1]" 1
842 1 41 LYS CA 1 43 LYS CA 4.600 . 8.200 3.667 3.644 3.692 . 0 0 "[ . 1]" 1
843 1 6 SER CA 1 7 ARG CA 4.600 . 8.200 3.731 3.713 3.753 . 0 0 "[ . 1]" 1
844 1 45 ASP CA 1 47 THR CA 4.600 . 8.200 5.088 5.014 5.174 . 0 0 "[ . 1]" 1
845 1 45 ASP CA 1 52 LYS CA 4.600 . 8.200 5.491 5.291 5.947 . 0 0 "[ . 1]" 1
846 1 20 ALA CA 1 22 VAL CA 4.600 . 8.200 5.965 5.908 5.994 . 0 0 "[ . 1]" 1
847 1 18 THR CA 1 20 ALA CA 4.600 . 8.200 4.745 4.625 4.821 . 0 0 "[ . 1]" 1
848 1 40 ALA CA 1 43 LYS CA 4.600 . 8.200 5.323 5.241 5.470 . 0 0 "[ . 1]" 1
849 1 25 THR CB 1 28 ALA CA 4.600 . 8.200 5.340 5.061 5.556 . 0 0 "[ . 1]" 1
850 1 8 VAL CG2 1 17 GLY CA 4.600 . 8.200 4.233 3.173 4.961 . 0 0 "[ . 1]" 1
851 1 33 VAL CB 1 34 GLY CA 4.600 . 8.200 4.399 4.291 4.527 . 0 0 "[ . 1]" 1
852 1 14 GLY CA 1 15 HIS CB 4.600 . 8.200 4.726 4.679 4.753 . 0 0 "[ . 1]" 1
853 1 34 GLY CA 1 36 ILE CB 4.600 . 8.200 5.269 4.833 5.577 . 0 0 "[ . 1]" 1
854 1 58 GLU CB 1 61 GLY CA 4.600 . 8.200 8.877 8.781 8.957 0.757 2 10 [*+*-******] 1
855 1 37 LEU CG 1 61 GLY CA 4.600 . 8.200 7.115 6.799 7.529 . 0 0 "[ . 1]" 1
856 1 11 ILE CG1 1 12 GLY CA 4.600 . 8.200 4.476 4.459 4.488 . 0 0 "[ . 1]" 1
857 1 42 GLY CA 1 59 GLY CA 4.600 . 8.200 4.219 4.124 4.396 . 0 0 "[ . 1]" 1
858 1 12 GLY CA 1 68 GLN CG 4.600 . 8.200 7.491 6.961 8.366 0.166 10 0 "[ . 1]" 1
859 1 23 GLY CA 1 26 LEU CB 4.600 . 8.200 11.266 11.132 11.359 3.159 9 10 [**-*****+*] 1
860 1 44 ASN CB 1 59 GLY CA 4.600 . 8.200 6.646 6.580 6.782 . 0 0 "[ . 1]" 1
861 1 22 VAL CB 1 23 GLY CA 4.600 . 8.200 4.592 4.491 4.670 . 0 0 "[ . 1]" 1
862 1 43 LYS CG 1 59 GLY CA 4.600 . 8.200 7.709 7.040 7.915 . 0 0 "[ . 1]" 1
863 1 23 GLY CA 1 32 TRP CB 4.600 . 8.200 6.133 5.973 6.291 . 0 0 "[ . 1]" 1
864 1 2 LEU CG 1 5 GLY CA 4.600 . 8.200 8.990 8.375 9.346 1.146 1 7 "[+***- ** 1]" 1
865 1 41 LYS CG 1 42 GLY CA 4.600 . 8.200 5.318 4.956 5.542 . 0 0 "[ . 1]" 1
866 1 13 LYS CB 1 69 ILE CB 4.600 . 8.200 12.679 12.212 13.410 5.210 9 10 [****-***+*] 1
867 1 8 VAL CG2 1 16 ARG CD 4.600 . 8.200 8.094 7.120 8.778 0.578 8 2 "[- . + 1]" 1
868 1 46 GLY CA 1 52 LYS CB 4.600 . 8.200 4.604 4.518 4.698 . 0 0 "[ . 1]" 1
869 1 21 TYR CB 1 35 VAL CG2 4.600 . 8.200 10.237 9.860 10.563 2.363 5 10 [****+**-**] 1
870 1 4 VAL CG1 1 21 TYR CB 4.600 . 8.200 4.602 4.384 4.676 . 0 0 "[ . 1]" 1
871 1 4 VAL CG2 1 19 VAL CG1 4.600 . 8.200 5.686 4.811 7.701 . 0 0 "[ . 1]" 1
872 1 65 ARG CD 1 69 ILE CG2 4.600 . 8.200 7.795 7.567 7.967 . 0 0 "[ . 1]" 1
873 1 26 LEU CB 1 32 TRP CB 4.600 . 8.200 4.961 4.583 5.193 . 0 0 "[ . 1]" 1
874 1 63 PHE CB 1 65 ARG CB 4.600 . 8.200 8.366 8.256 8.458 0.259 9 0 "[ . 1]" 1
875 1 26 LEU CB 1 27 PHE CB 4.600 . 8.200 5.361 5.340 5.376 . 0 0 "[ . 1]" 1
876 1 63 PHE CB 1 65 ARG CG 4.600 . 8.200 7.667 7.539 7.821 . 0 0 "[ . 1]" 1
877 1 33 VAL CG1 1 63 PHE CB 4.600 . 8.200 8.100 7.903 8.187 . 0 0 "[ . 1]" 1
878 1 63 PHE CB 1 64 VAL CB 4.600 . 8.200 5.776 5.757 5.809 . 0 0 "[ . 1]" 1
879 1 33 VAL CG2 1 63 PHE CB 4.600 . 8.200 6.230 6.107 6.734 . 0 0 "[ . 1]" 1
880 1 37 LEU CB 1 61 GLY CA 4.600 . 8.200 6.033 5.742 6.266 . 0 0 "[ . 1]" 1
881 1 43 LYS CG 1 57 ASP CB 4.600 . 8.200 10.573 10.192 10.943 2.743 7 10 [-*****+***] 1
882 1 57 ASP CB 1 59 GLY CA 4.600 . 8.200 6.774 6.706 6.808 . 0 0 "[ . 1]" 1
883 1 43 LYS CD 1 45 ASP CB 4.600 . 8.200 5.476 4.855 5.763 . 0 0 "[ . 1]" 1
884 1 44 ASN CB 1 61 GLY CA 4.600 . 8.200 4.196 3.736 4.504 . 0 0 "[ . 1]" 1
885 1 11 ILE CB 1 14 GLY CA 4.600 . 8.200 6.572 6.358 6.698 . 0 0 "[ . 1]" 1
886 1 27 PHE CB 1 28 ALA CB 4.600 . 8.200 4.711 4.687 4.736 . 0 0 "[ . 1]" 1
887 1 64 VAL CB 1 65 ARG CB 4.600 . 8.200 5.496 5.454 5.674 . 0 0 "[ . 1]" 1
888 1 65 ARG CD 1 68 GLN CG 4.600 . 8.200 4.669 3.603 4.972 . 0 0 "[ . 1]" 1
889 1 64 VAL CG2 1 68 GLN CG 4.600 . 8.200 4.837 3.996 5.294 . 0 0 "[ . 1]" 1
890 1 20 ALA CB 1 22 VAL CB 4.600 . 8.200 4.820 4.608 5.178 . 0 0 "[ . 1]" 1
891 1 18 THR CG2 1 35 VAL CB 4.600 . 8.200 8.050 7.422 8.448 0.248 1 0 "[ . 1]" 1
892 1 34 GLY CA 1 35 VAL CB 4.600 . 8.200 4.479 4.431 4.528 . 0 0 "[ . 1]" 1
893 1 35 VAL CB 1 64 VAL CB 4.600 . 8.200 5.511 5.267 5.750 . 0 0 "[ . 1]" 1
894 1 66 GLN CG 1 69 ILE CB 4.600 . 8.200 7.299 6.865 7.780 . 0 0 "[ . 1]" 1
895 1 2 LEU CD1 1 66 GLN CG 4.600 . 8.200 5.684 5.295 5.983 . 0 0 "[ . 1]" 1
896 1 22 VAL CB 1 32 TRP CB 4.600 . 8.200 7.509 7.277 7.903 . 0 0 "[ . 1]" 1
897 1 23 GLY CA 1 31 LYS CB 4.600 . 8.200 4.259 4.041 4.420 . 0 0 "[ . 1]" 1
898 1 41 LYS CB 1 46 GLY CA 4.600 . 8.200 14.990 14.831 15.136 6.936 4 10 [**-+******] 1
899 1 9 GLU CB 1 14 GLY CA 4.600 . 8.200 4.570 4.511 4.643 . 0 0 "[ . 1]" 1
900 1 26 LEU CB 1 49 GLN CG 4.600 . 8.200 4.834 3.792 5.709 . 0 0 "[ . 1]" 1
901 1 31 LYS CB 1 33 VAL CG1 4.600 . 8.200 9.236 9.077 9.386 1.186 3 10 [**+-******] 1
902 1 20 ALA CB 1 33 VAL CB 4.600 . 8.200 5.855 5.776 5.931 . 0 0 "[ . 1]" 1
903 1 33 VAL CB 1 64 VAL CB 4.600 . 8.200 5.480 5.166 5.852 . 0 0 "[ . 1]" 1
904 1 9 GLU CB 1 11 ILE CG1 4.600 . 8.200 6.520 6.285 6.703 . 0 0 "[ . 1]" 1
905 1 33 VAL CB 1 64 VAL CG2 4.600 . 8.200 4.629 4.080 6.361 . 0 0 "[ . 1]" 1
906 1 50 GLY CA 1 52 LYS CB 4.600 . 8.200 7.045 6.858 7.185 . 0 0 "[ . 1]" 1
907 1 45 ASP CB 1 52 LYS CB 4.600 . 8.200 4.299 3.804 4.852 . 0 0 "[ . 1]" 1
908 1 1 PRO CB 1 66 GLN CB 4.600 . 8.200 4.542 3.861 4.956 . 0 0 "[ . 1]" 1
909 1 15 HIS CB 1 36 ILE CG1 4.600 . 8.200 8.694 7.669 9.430 1.230 9 5 "[- * * * +1]" 1
910 1 16 ARG CB 1 37 LEU CG 4.600 . 8.200 4.434 4.078 4.632 . 0 0 "[ . 1]" 1
911 1 33 VAL CG1 1 68 GLN CB 4.600 . 8.200 8.302 8.015 8.587 0.387 4 0 "[ . 1]" 1
912 1 8 VAL CB 1 10 VAL CB 4.600 . 8.200 5.764 5.486 6.036 . 0 0 "[ . 1]" 1
913 1 66 GLN CG 1 68 GLN CB 4.600 . 8.200 7.576 7.252 8.041 . 0 0 "[ . 1]" 1
914 1 10 VAL CB 1 11 ILE CG1 4.600 . 8.200 5.189 5.035 5.284 . 0 0 "[ . 1]" 1
915 1 4 VAL CG1 1 19 VAL CB 4.600 . 8.200 5.341 4.862 5.468 . 0 0 "[ . 1]" 1
916 1 2 LEU CG 1 19 VAL CB 4.600 . 8.200 5.462 4.738 5.998 . 0 0 "[ . 1]" 1
917 1 65 ARG CB 1 69 ILE CB 4.600 . 8.200 7.360 7.228 7.467 . 0 0 "[ . 1]" 1
918 1 33 VAL CG2 1 65 ARG CB 4.600 . 8.200 5.223 4.843 5.371 . 0 0 "[ . 1]" 1
919 1 9 GLU CB 1 13 LYS CB 4.600 . 8.200 7.224 6.795 7.502 . 0 0 "[ . 1]" 1
920 1 1 PRO CG 1 4 VAL CB 4.600 . 8.200 10.186 9.492 10.752 2.552 9 10 [********+-] 1
921 1 26 LEU CB 1 51 ARG CB 4.600 . 8.200 4.939 4.471 5.517 . 0 0 "[ . 1]" 1
922 1 43 LYS CB 1 51 ARG CB 4.600 . 8.200 10.988 10.715 11.320 3.120 5 10 [****+**-**] 1
923 1 43 LYS CD 1 58 GLU CB 4.600 . 8.200 7.434 6.292 8.632 0.432 1 0 "[ . 1]" 1
924 1 46 GLY CA 1 60 HIS CB 4.600 . 8.200 8.222 7.925 8.368 0.168 4 0 "[ . 1]" 1
925 1 44 ASN CB 1 60 HIS CB 4.600 . 8.200 7.279 7.072 7.513 . 0 0 "[ . 1]" 1
926 1 43 LYS CD 1 59 GLY CA 4.600 . 8.200 4.588 4.566 4.603 . 0 0 "[ . 1]" 1
927 1 11 ILE CG1 1 69 ILE CG2 4.600 . 8.200 6.161 5.454 6.543 . 0 0 "[ . 1]" 1
928 1 11 ILE CG1 1 14 GLY CA 4.600 . 8.200 6.632 4.895 7.162 . 0 0 "[ . 1]" 1
929 1 43 LYS CD 1 44 ASN CB 4.600 . 8.200 5.734 4.756 6.986 . 0 0 "[ . 1]" 1
930 1 11 ILE CG1 1 15 HIS CB 4.600 . 8.200 5.549 5.262 5.697 . 0 0 "[ . 1]" 1
931 1 36 ILE CG1 1 37 LEU CG 4.600 . 8.200 7.970 7.476 8.302 0.102 3 0 "[ . 1]" 1
932 1 7 ARG CG 1 9 GLU CB 4.600 . 8.200 6.935 5.864 8.387 0.187 5 0 "[ . 1]" 1
933 1 65 ARG CD 1 66 GLN CB 4.600 . 8.200 7.746 7.637 7.803 . 0 0 "[ . 1]" 1
934 1 66 GLN CB 1 69 ILE CB 4.600 . 8.200 6.339 6.143 6.754 . 0 0 "[ . 1]" 1
935 1 18 THR CG2 1 37 LEU CG 4.600 . 8.200 11.697 10.405 12.511 4.311 6 10 [*****+-***] 1
936 1 49 GLN CB 1 50 GLY CA 4.600 . 8.200 4.901 4.865 4.924 . 0 0 "[ . 1]" 1
937 1 49 GLN CB 1 51 ARG CB 4.600 . 8.200 5.116 4.971 5.525 . 0 0 "[ . 1]" 1
938 1 65 ARG CG 1 66 GLN CB 4.600 . 8.200 6.828 6.741 6.964 . 0 0 "[ . 1]" 1
939 1 37 LEU CG 1 41 LYS CG 4.600 . 8.200 5.208 4.681 5.537 . 0 0 "[ . 1]" 1
940 1 2 LEU CD1 1 66 GLN CG 4.600 . 8.200 6.238 5.451 6.952 . 0 0 "[ . 1]" 1
941 1 9 GLU CB 1 69 ILE CG1 4.600 . 8.200 7.191 6.951 7.494 . 0 0 "[ . 1]" 1
942 1 11 ILE CG1 1 69 ILE CG1 4.600 . 8.200 6.889 6.559 7.237 . 0 0 "[ . 1]" 1
943 1 21 TYR CB 1 52 LYS CG 4.600 . 8.200 8.117 7.831 8.228 0.028 6 0 "[ . 1]" 1
944 1 33 VAL CG2 1 35 VAL CB 4.600 . 8.200 4.628 4.052 6.207 . 0 0 "[ . 1]" 1
945 1 31 LYS CB 1 33 VAL CG2 4.600 . 8.200 6.889 6.737 7.072 . 0 0 "[ . 1]" 1
946 1 37 LEU CB 1 64 VAL CG2 4.600 . 8.200 9.527 9.161 10.179 1.979 10 10 [***-*****+] 1
947 1 33 VAL CG2 1 65 ARG CG 4.600 . 8.200 5.758 5.083 5.921 . 0 0 "[ . 1]" 1
948 1 33 VAL CG2 1 65 ARG CD 4.600 . 8.200 5.851 4.535 6.176 . 0 0 "[ . 1]" 1
949 1 64 VAL CG2 1 69 ILE CG1 4.600 . 8.200 4.496 4.138 5.100 . 0 0 "[ . 1]" 1
950 1 19 VAL CG1 1 33 VAL CB 4.600 . 8.200 5.619 4.702 7.043 . 0 0 "[ . 1]" 1
951 1 2 LEU CD1 1 4 VAL CG2 4.600 . 8.200 8.462 7.881 8.620 0.420 1 0 "[ . 1]" 1
952 1 8 VAL CG2 1 70 GLN CB 4.600 . 8.200 7.232 6.525 8.621 0.421 5 0 "[ . 1]" 1
953 1 8 VAL CG2 1 69 ILE CB 4.600 . 8.200 4.830 4.171 5.999 . 0 0 "[ . 1]" 1
954 1 18 THR CG2 1 36 ILE CB 4.600 . 8.200 5.964 4.365 7.129 . 0 0 "[ . 1]" 1
955 1 2 LEU CD1 1 8 VAL CG2 4.600 . 8.200 6.414 5.933 7.446 . 0 0 "[ . 1]" 1
956 1 7 ARG CG 1 8 VAL CG2 4.600 . 8.200 6.401 5.502 7.232 . 0 0 "[ . 1]" 1
957 1 35 VAL CG2 1 69 ILE CB 4.600 . 8.200 5.130 4.986 5.304 . 0 0 "[ . 1]" 1
958 1 35 VAL CG2 1 64 VAL CB 4.600 . 8.200 4.811 4.636 5.017 . 0 0 "[ . 1]" 1
959 1 35 VAL CG2 1 36 ILE CB 4.600 . 8.200 6.946 6.835 7.008 . 0 0 "[ . 1]" 1
960 1 25 THR CG2 1 27 PHE CB 4.600 . 8.200 4.251 3.754 4.521 . 0 0 "[ . 1]" 1
961 1 43 LYS CB 1 48 VAL CG2 4.600 . 8.200 4.911 4.645 5.138 . 0 0 "[ . 1]" 1
962 1 19 VAL CB 1 20 ALA CB 4.600 . 8.200 5.778 5.670 5.892 . 0 0 "[ . 1]" 1
963 1 48 VAL CG2 1 51 ARG CG 4.600 . 8.200 6.800 6.516 7.058 . 0 0 "[ . 1]" 1
964 1 20 ALA CB 1 33 VAL CB 4.600 . 8.200 6.804 6.568 7.090 . 0 0 "[ . 1]" 1
965 1 37 LEU CD1 1 39 GLU CB 4.600 . 8.200 5.444 3.552 6.180 . 0 0 "[ . 1]" 1
966 1 37 LEU CD1 1 60 HIS CB 4.600 . 8.200 7.265 7.023 7.574 . 0 0 "[ . 1]" 1
967 1 20 ALA CB 1 33 VAL CG1 4.600 . 8.200 5.192 5.015 5.670 . 0 0 "[ . 1]" 1
968 1 23 GLY CA 1 25 THR CG2 4.600 . 8.200 6.091 5.298 7.873 . 0 0 "[ . 1]" 1
969 1 37 LEU CD1 1 42 GLY CA 4.600 . 8.200 8.202 7.962 8.432 0.232 1 0 "[ . 1]" 1
970 1 25 THR CG2 1 26 LEU CB 4.600 . 8.200 6.172 4.692 6.639 . 0 0 "[ . 1]" 1
971 1 2 LEU CD1 1 4 VAL CG1 4.600 . 8.200 8.577 7.088 9.000 0.800 7 5 "[- **+ *]" 1
972 1 20 ALA CB 1 33 VAL CG2 4.600 . 8.200 7.831 7.628 8.139 . 0 0 "[ . 1]" 1
973 1 35 VAL CG1 1 37 LEU CB 4.600 . 8.200 5.559 5.271 5.890 . 0 0 "[ . 1]" 1
974 1 4 VAL CG1 1 22 VAL CB 4.600 . 8.200 5.494 3.813 6.103 . 0 0 "[ . 1]" 1
975 1 4 VAL CG1 1 21 TYR CB 4.600 . 8.200 5.776 4.963 6.084 . 0 0 "[ . 1]" 1
976 1 2 LEU CG 1 4 VAL CG1 4.600 . 8.200 8.599 7.571 9.255 1.055 7 6 "[*-* * +* 1]" 1
977 1 45 ASP CB 1 48 VAL CG1 4.600 . 8.200 7.917 7.602 8.111 . 0 0 "[ . 1]" 1
978 1 24 ALA CB 1 32 TRP CB 4.600 . 8.200 6.313 6.217 6.377 . 0 0 "[ . 1]" 1
979 1 24 ALA CB 1 28 ALA CB 4.600 . 8.200 4.314 4.160 4.590 . 0 0 "[ . 1]" 1
980 1 24 ALA CB 1 26 LEU CB 4.600 . 8.200 8.584 8.350 8.753 0.553 8 1 "[ . + 1]" 1
981 1 45 ASP CB 1 47 THR CG2 4.600 . 8.200 8.391 8.364 8.419 0.219 9 0 "[ . 1]" 1
982 1 47 THR CG2 1 48 VAL CG2 4.600 . 8.200 6.850 6.696 6.924 . 0 0 "[ . 1]" 1
983 1 47 THR CG2 1 48 VAL CB 4.600 . 8.200 7.034 6.983 7.069 . 0 0 "[ . 1]" 1
984 1 10 VAL CB 1 69 ILE CG2 4.600 . 8.200 4.606 4.422 5.114 . 0 0 "[ . 1]" 1
985 1 47 THR CG2 1 48 VAL CG1 4.600 . 8.200 8.386 8.318 8.428 0.228 5 0 "[ . 1]" 1
986 1 47 THR CG2 1 56 CYS CB 4.600 . 8.200 9.431 9.170 9.619 1.419 10 10 [**-******+] 1
987 1 35 VAL CG1 1 64 VAL CG1 4.600 . 8.200 5.998 5.134 6.426 . 0 0 "[ . 1]" 1
988 1 8 VAL CG1 1 66 GLN CG 4.600 . 8.200 11.937 10.613 13.501 5.301 6 10 [*****+***-] 1
989 1 40 ALA CB 1 59 GLY CA 4.600 . 8.200 4.609 4.482 4.806 . 0 0 "[ . 1]" 1
990 1 68 GLN CB 1 69 ILE CD1 4.600 . 8.200 6.375 6.248 6.477 . 0 0 "[ . 1]" 1
991 1 36 ILE CD1 1 37 LEU CG 4.600 . 8.200 4.636 3.499 5.360 . 0 0 "[ . 1]" 1
992 1 35 VAL CG1 1 36 ILE CD1 4.600 . 8.200 6.044 5.616 6.528 . 0 0 "[ . 1]" 1
993 1 10 VAL CB 1 11 ILE CD1 4.600 . 8.200 5.824 5.180 6.339 . 0 0 "[ . 1]" 1
994 1 36 ILE CD1 1 60 HIS CB 4.600 . 8.200 5.452 4.676 5.822 . 0 0 "[ . 1]" 1
995 1 36 ILE CG2 1 37 LEU CG 4.600 . 8.200 7.839 7.334 8.269 0.069 6 0 "[ . 1]" 1
996 1 20 ALA CB 1 36 ILE CG2 4.600 . 8.200 6.133 5.409 6.772 . 0 0 "[ . 1]" 1
997 1 64 VAL CG1 1 65 ARG CD 4.600 . 8.200 6.208 5.889 6.541 . 0 0 "[ . 1]" 1
998 1 64 VAL CB 1 68 GLN CB 4.600 . 8.200 4.170 4.058 4.597 . 0 0 "[ . 1]" 1
999 1 65 ARG CG 1 68 GLN CG 4.600 . 8.200 5.729 4.866 5.938 . 0 0 "[ . 1]" 1
1000 1 11 ILE CG2 1 12 GLY CA 4.600 . 8.200 4.960 4.826 5.061 . 0 0 "[ . 1]" 1
1001 1 16 ARG CA 1 36 ILE CB 4.600 . 8.200 8.599 8.139 9.361 1.161 10 3 "[ * -. +]" 1
1002 1 68 GLN CG 1 69 ILE CA 4.600 . 8.200 4.706 4.211 5.472 . 0 0 "[ . 1]" 1
1003 1 67 SER CA 1 68 GLN CB 4.600 . 8.200 4.847 4.836 4.859 . 0 0 "[ . 1]" 1
1004 1 11 ILE CA 1 64 VAL CG1 4.600 . 8.200 8.361 8.167 8.828 0.628 10 1 "[ . +]" 1
1005 1 19 VAL CA 1 33 VAL CG2 4.600 . 8.200 7.154 6.758 7.345 . 0 0 "[ . 1]" 1
1006 1 42 GLY CA 1 62 ILE CA 4.600 . 8.200 5.940 5.646 6.225 . 0 0 "[ . 1]" 1
1007 1 19 VAL CA 1 21 TYR CB 4.600 . 8.200 8.206 8.133 8.274 0.074 9 0 "[ . 1]" 1
1008 1 18 THR CB 1 33 VAL CB 4.600 . 8.200 10.792 10.421 11.021 2.821 8 10 [***-***+**] 1
1009 1 27 PHE CA 1 29 THR CB 4.600 . 8.200 4.285 4.264 4.297 . 0 0 "[ . 1]" 1
1010 1 39 GLU CA 1 40 ALA C 4.600 . 8.200 4.551 4.523 4.587 . 0 0 "[ . 1]" 1
1011 1 23 GLY CA 1 30 GLY C 4.600 . 8.200 5.108 4.975 5.235 . 0 0 "[ . 1]" 1
1012 1 7 ARG CA 1 9 GLU CB 4.600 . 8.200 7.254 7.039 7.570 . 0 0 "[ . 1]" 1
1013 1 48 VAL CG1 1 51 ARG CB 4.600 . 8.200 6.024 5.888 6.153 . 0 0 "[ . 1]" 1
1014 1 31 LYS CA 1 33 VAL CB 4.600 . 8.200 7.606 7.519 7.723 . 0 0 "[ . 1]" 1
1015 1 19 VAL CA 1 34 GLY N 4.000 . 6.500 6.055 5.771 6.330 . 0 0 "[ . 1]" 1
1016 1 23 GLY N 1 33 VAL CA 4.000 . 6.500 5.345 5.233 5.503 . 0 0 "[ . 1]" 1
1017 1 67 SER CA 1 69 ILE N 4.000 . 6.500 4.218 4.116 4.313 . 0 0 "[ . 1]" 1
1018 1 2 LEU CA 1 4 VAL N 4.000 . 6.500 5.601 5.289 5.798 . 0 0 "[ . 1]" 1
1019 1 26 LEU CA 1 28 ALA N 4.000 . 6.500 4.361 4.328 4.388 . 0 0 "[ . 1]" 1
1020 1 17 GLY CA 1 38 ASP N 4.000 . 6.500 6.310 5.722 6.595 0.095 8 0 "[ . 1]" 1
1021 1 8 VAL CB 1 18 THR N 4.000 . 6.500 4.247 3.912 4.651 . 0 0 "[ . 1]" 1
1022 1 35 VAL CB 1 63 PHE N 4.000 . 6.500 6.020 5.815 6.183 . 0 0 "[ . 1]" 1
1023 1 19 VAL CB 1 21 TYR N 4.000 . 6.500 6.204 6.106 6.335 . 0 0 "[ . 1]" 1
1024 1 48 VAL N 1 51 ARG CG 4.000 . 6.500 5.931 5.812 6.066 . 0 0 "[ . 1]" 1
1025 1 17 GLY N 1 35 VAL CG2 4.000 . 6.500 7.572 7.001 8.064 1.564 6 10 [*****+**-*] 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 76
_Distance_constraint_stats_list.Viol_count 93
_Distance_constraint_stats_list.Viol_total 157.120
_Distance_constraint_stats_list.Viol_max 0.372
_Distance_constraint_stats_list.Viol_rms 0.0656
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0207
_Distance_constraint_stats_list.Viol_average_violations_only 0.1689
_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 3 ARG 0.000 0.000 . 0 "[ . 1]"
1 5 GLY 0.000 0.000 . 0 "[ . 1]"
1 6 SER 0.000 0.000 . 0 "[ . 1]"
1 8 VAL 0.189 0.189 7 0 "[ . 1]"
1 9 GLU 0.000 0.000 . 0 "[ . 1]"
1 10 VAL 0.000 0.000 . 0 "[ . 1]"
1 11 ILE 0.000 0.000 . 0 "[ . 1]"
1 12 GLY 0.000 0.000 . 0 "[ . 1]"
1 15 HIS 0.000 0.000 . 0 "[ . 1]"
1 17 GLY 0.189 0.189 7 0 "[ . 1]"
1 18 THR 2.404 0.239 7 0 "[ . 1]"
1 19 VAL 0.000 0.000 . 0 "[ . 1]"
1 20 ALA 0.000 0.000 . 0 "[ . 1]"
1 21 TYR 0.756 0.135 5 0 "[ . 1]"
1 23 GLY 0.531 0.115 8 0 "[ . 1]"
1 24 ALA 3.037 0.334 9 0 "[ . 1]"
1 25 THR 1.105 0.172 8 0 "[ . 1]"
1 28 ALA 1.105 0.172 8 0 "[ . 1]"
1 30 GLY 3.037 0.334 9 0 "[ . 1]"
1 32 TRP 0.531 0.115 8 0 "[ . 1]"
1 33 VAL 0.000 0.000 . 0 "[ . 1]"
1 34 GLY 0.756 0.135 5 0 "[ . 1]"
1 35 VAL 0.221 0.221 4 0 "[ . 1]"
1 36 ILE 2.404 0.239 7 0 "[ . 1]"
1 37 LEU 0.000 0.000 . 0 "[ . 1]"
1 40 ALA 2.760 0.372 2 0 "[ . 1]"
1 41 LYS 0.000 0.000 . 0 "[ . 1]"
1 42 GLY 1.900 0.266 3 0 "[ . 1]"
1 43 LYS 0.000 0.000 . 0 "[ . 1]"
1 44 ASN 0.000 0.000 . 0 "[ . 1]"
1 45 ASP 0.000 0.000 . 0 "[ . 1]"
1 46 GLY 0.000 0.000 . 0 "[ . 1]"
1 47 THR 0.000 0.000 . 0 "[ . 1]"
1 48 VAL 0.000 0.000 . 0 "[ . 1]"
1 51 ARG 0.000 0.000 . 0 "[ . 1]"
1 53 TYR 0.000 0.000 . 0 "[ . 1]"
1 54 PHE 0.000 0.000 . 0 "[ . 1]"
1 56 CYS 0.000 0.000 . 0 "[ . 1]"
1 57 ASP 2.654 0.333 10 0 "[ . 1]"
1 59 GLY 4.660 0.372 2 0 "[ . 1]"
1 60 HIS 2.654 0.333 10 0 "[ . 1]"
1 61 GLY 0.221 0.221 4 0 "[ . 1]"
1 62 ILE 0.000 0.000 . 0 "[ . 1]"
1 64 VAL 0.000 0.000 . 0 "[ . 1]"
1 65 ARG 0.156 0.156 10 0 "[ . 1]"
1 66 GLN 0.000 0.000 . 0 "[ . 1]"
1 68 GLN 0.000 0.000 . 0 "[ . 1]"
1 69 ILE 0.156 0.156 10 0 "[ . 1]"
1 70 GLN 0.000 0.000 . 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 ARG O 1 6 SER N 3.000 2.300 3.500 3.217 3.057 3.401 . 0 0 "[ . 1]" 2
2 1 3 ARG O 1 6 SER H 2.000 . 2.500 2.325 2.245 2.476 . 0 0 "[ . 1]" 2
3 1 6 SER O 1 19 VAL N 3.000 2.300 3.500 2.938 2.663 3.232 . 0 0 "[ . 1]" 2
4 1 6 SER O 1 19 VAL H 2.000 . 2.500 1.997 1.715 2.265 . 0 0 "[ . 1]" 2
5 1 9 GLU O 1 70 GLN N 3.000 2.300 3.500 2.938 2.641 3.239 . 0 0 "[ . 1]" 2
6 1 9 GLU O 1 70 GLN H 2.000 . 2.500 1.999 1.670 2.322 . 0 0 "[ . 1]" 2
7 1 10 VAL O 1 12 GLY N 3.000 2.300 3.500 2.732 2.514 2.930 . 0 0 "[ . 1]" 2
8 1 10 VAL O 1 12 GLY H 2.000 . 2.500 2.007 1.817 2.325 . 0 0 "[ . 1]" 2
9 1 10 VAL N 1 15 HIS O 3.000 2.300 3.500 3.083 2.730 3.267 . 0 0 "[ . 1]" 2
10 1 10 VAL H 1 15 HIS O 2.000 . 2.500 2.211 2.005 2.337 . 0 0 "[ . 1]" 2
11 1 8 VAL N 1 17 GLY O 3.000 2.300 3.500 3.024 2.439 3.486 . 0 0 "[ . 1]" 2
12 1 8 VAL H 1 17 GLY O 2.000 . 2.500 2.216 1.663 2.689 0.189 7 0 "[ . 1]" 2
13 1 18 THR O 1 36 ILE N 3.000 2.300 3.500 3.577 3.328 3.720 0.220 6 0 "[ . 1]" 2
14 1 18 THR O 1 36 ILE H 2.000 . 2.500 2.601 2.371 2.739 0.239 7 0 "[ . 1]" 2
15 1 5 GLY N 1 19 VAL O 3.000 2.300 3.500 2.870 2.538 3.160 . 0 0 "[ . 1]" 2
16 1 5 GLY H 1 19 VAL O 2.000 . 2.500 1.958 1.624 2.246 . 0 0 "[ . 1]" 2
17 1 21 TYR O 1 34 GLY N 3.000 2.300 3.500 3.454 3.271 3.578 0.078 5 0 "[ . 1]" 2
18 1 21 TYR O 1 34 GLY H 2.000 . 2.500 2.491 2.301 2.635 0.135 5 0 "[ . 1]" 2
19 1 23 GLY O 1 32 TRP N 3.000 2.300 3.500 3.450 3.352 3.571 0.071 5 0 "[ . 1]" 2
20 1 23 GLY O 1 32 TRP H 2.000 . 2.500 2.489 2.381 2.615 0.115 8 0 "[ . 1]" 2
21 1 25 THR O 1 28 ALA N 3.000 2.300 3.500 3.128 3.043 3.193 . 0 0 "[ . 1]" 2
22 1 25 THR O 1 28 ALA H 2.000 . 2.500 2.610 2.503 2.672 0.172 8 0 "[ . 1]" 2
23 1 25 THR N 1 28 ALA O 3.000 2.300 3.500 2.814 2.768 2.857 . 0 0 "[ . 1]" 2
24 1 25 THR H 1 28 ALA O 2.000 . 2.500 1.893 1.851 1.935 . 0 0 "[ . 1]" 2
25 1 23 GLY N 1 32 TRP O 3.000 2.300 3.500 2.976 2.817 3.114 . 0 0 "[ . 1]" 2
26 1 23 GLY H 1 32 TRP O 2.000 . 2.500 2.047 1.853 2.252 . 0 0 "[ . 1]" 2
27 1 24 ALA N 1 30 GLY O 3.000 2.300 3.500 2.671 2.626 2.719 . 0 0 "[ . 1]" 2
28 1 24 ALA H 1 30 GLY O 2.000 . 2.500 2.804 2.761 2.834 0.334 9 0 "[ . 1]" 2
29 1 33 VAL O 1 64 VAL N 3.000 2.300 3.500 2.715 2.604 2.887 . 0 0 "[ . 1]" 2
30 1 33 VAL O 1 64 VAL H 2.000 . 2.500 1.743 1.636 1.920 . 0 0 "[ . 1]" 2
31 1 20 ALA N 1 34 GLY O 3.000 2.300 3.500 2.568 2.458 2.687 . 0 0 "[ . 1]" 2
32 1 20 ALA H 1 34 GLY O 2.000 . 2.500 1.662 1.551 1.827 . 0 0 "[ . 1]" 2
33 1 35 VAL O 1 61 GLY N 3.000 2.300 3.500 2.919 2.795 3.178 . 0 0 "[ . 1]" 2
34 1 35 VAL O 1 61 GLY H 2.000 . 2.500 2.378 2.258 2.721 0.221 4 0 "[ . 1]" 2
35 1 35 VAL O 1 62 ILE N 3.000 2.300 3.500 2.747 2.587 2.963 . 0 0 "[ . 1]" 2
36 1 35 VAL O 1 62 ILE H 2.000 . 2.500 1.884 1.686 2.145 . 0 0 "[ . 1]" 2
37 1 37 LEU O 1 40 ALA N 3.000 2.300 3.500 3.172 3.020 3.219 . 0 0 "[ . 1]" 2
38 1 37 LEU O 1 40 ALA H 2.000 . 2.500 2.253 2.082 2.305 . 0 0 "[ . 1]" 2
39 1 42 GLY O 1 59 GLY N 3.000 2.300 3.500 3.506 3.449 3.563 0.063 8 0 "[ . 1]" 2
40 1 42 GLY O 1 59 GLY H 2.000 . 2.500 2.673 2.621 2.766 0.266 3 0 "[ . 1]" 2
41 1 43 LYS O 1 60 HIS N 3.000 2.300 3.500 3.024 2.962 3.070 . 0 0 "[ . 1]" 2
42 1 43 LYS O 1 60 HIS H 2.000 . 2.500 2.284 2.243 2.317 . 0 0 "[ . 1]" 2
43 1 43 LYS O 1 59 GLY N 3.000 2.300 3.500 2.969 2.927 3.029 . 0 0 "[ . 1]" 2
44 1 43 LYS O 1 59 GLY H 2.000 . 2.500 2.324 2.299 2.400 . 0 0 "[ . 1]" 2
45 1 44 ASN O 1 47 THR N 3.000 2.300 3.500 3.095 3.016 3.181 . 0 0 "[ . 1]" 2
46 1 44 ASN O 1 47 THR H 2.000 . 2.500 2.276 2.206 2.376 . 0 0 "[ . 1]" 2
47 1 45 ASP O 1 53 TYR N 3.000 2.300 3.500 2.856 2.677 3.171 . 0 0 "[ . 1]" 2
48 1 45 ASP O 1 53 TYR H 2.000 . 2.500 2.104 1.939 2.295 . 0 0 "[ . 1]" 2
49 1 45 ASP O 1 54 PHE N 3.000 2.300 3.500 2.849 2.742 3.101 . 0 0 "[ . 1]" 2
50 1 45 ASP O 1 54 PHE H 2.000 . 2.500 1.884 1.782 2.144 . 0 0 "[ . 1]" 2
51 1 48 VAL O 1 51 ARG N 3.000 2.300 3.500 2.445 2.319 2.500 . 0 0 "[ . 1]" 2
52 1 48 VAL O 1 51 ARG H 2.000 . 2.500 1.612 1.526 1.666 . 0 0 "[ . 1]" 2
53 1 48 VAL N 1 51 ARG O 3.000 2.300 3.500 2.470 2.413 2.593 . 0 0 "[ . 1]" 2
54 1 48 VAL H 1 51 ARG O 2.000 . 2.500 1.625 1.564 1.764 . 0 0 "[ . 1]" 2
55 1 46 GLY N 1 56 CYS O 3.000 2.300 3.500 2.681 2.530 2.925 . 0 0 "[ . 1]" 2
56 1 46 GLY H 1 56 CYS O 2.000 . 2.500 1.989 1.809 2.259 . 0 0 "[ . 1]" 2
57 1 57 ASP O 1 60 HIS N 3.000 2.300 3.500 3.469 3.402 3.544 0.044 10 0 "[ . 1]" 2
58 1 57 ASP O 1 60 HIS H 2.000 . 2.500 2.759 2.693 2.833 0.333 10 0 "[ . 1]" 2
59 1 41 LYS N 1 59 GLY O 3.000 2.300 3.500 2.400 2.374 2.424 . 0 0 "[ . 1]" 2
60 1 41 LYS H 1 59 GLY O 2.000 . 2.500 1.874 1.753 2.015 . 0 0 "[ . 1]" 2
61 1 40 ALA N 1 59 GLY O 3.000 2.300 3.500 3.197 3.135 3.296 . 0 0 "[ . 1]" 2
62 1 40 ALA H 1 59 GLY O 2.000 . 2.500 2.776 2.691 2.872 0.372 2 0 "[ . 1]" 2
63 1 45 ASP N 1 60 HIS O 3.000 2.300 3.500 3.195 2.941 3.309 . 0 0 "[ . 1]" 2
64 1 45 ASP H 1 60 HIS O 2.000 . 2.500 2.324 2.146 2.404 . 0 0 "[ . 1]" 2
65 1 35 VAL N 1 62 ILE O 3.000 2.300 3.500 2.966 2.841 3.131 . 0 0 "[ . 1]" 2
66 1 35 VAL H 1 62 ILE O 2.000 . 2.500 2.098 1.958 2.273 . 0 0 "[ . 1]" 2
67 1 33 VAL N 1 64 VAL O 3.000 2.300 3.500 2.550 2.419 2.980 . 0 0 "[ . 1]" 2
68 1 33 VAL H 1 64 VAL O 2.000 . 2.500 1.718 1.581 2.220 . 0 0 "[ . 1]" 2
69 1 65 ARG O 1 68 GLN N 3.000 2.300 3.500 2.843 2.616 3.033 . 0 0 "[ . 1]" 2
70 1 65 ARG O 1 68 GLN H 2.000 . 2.500 2.228 1.957 2.452 . 0 0 "[ . 1]" 2
71 1 65 ARG O 1 69 ILE N 3.000 2.300 3.500 3.162 3.057 3.383 . 0 0 "[ . 1]" 2
72 1 65 ARG O 1 69 ILE H 2.000 . 2.500 2.377 2.300 2.656 0.156 10 0 "[ . 1]" 2
73 1 66 GLN O 1 69 ILE N 3.000 2.300 3.500 3.148 3.096 3.271 . 0 0 "[ . 1]" 2
74 1 66 GLN O 1 69 ILE H 2.000 . 2.500 2.400 2.259 2.494 . 0 0 "[ . 1]" 2
75 1 11 ILE N 1 68 GLN O 3.000 2.300 3.500 2.963 2.754 3.265 . 0 0 "[ . 1]" 2
76 1 11 ILE H 1 68 GLN O 2.000 . 2.500 2.097 1.843 2.452 . 0 0 "[ . 1]" 2
stop_
save_