NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
632710 |
6ewu   |
34195 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6ewu
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 1537
_Distance_constraint_stats_list.Viol_count 3891
_Distance_constraint_stats_list.Viol_total 4188.134
_Distance_constraint_stats_list.Viol_max 0.193
_Distance_constraint_stats_list.Viol_rms 0.0200
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0068
_Distance_constraint_stats_list.Viol_average_violations_only 0.0538
_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 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 ILE 17.512 0.101 6 0 "[ . 1 . 2]"
1 3 ASP 7.852 0.093 1 0 "[ . 1 . 2]"
1 4 ALA 6.642 0.104 5 0 "[ . 1 . 2]"
1 5 ALA 5.187 0.082 16 0 "[ . 1 . 2]"
1 6 GLN 7.477 0.082 7 0 "[ . 1 . 2]"
1 7 ILE 15.506 0.108 7 0 "[ . 1 . 2]"
1 8 VAL 8.350 0.092 8 0 "[ . 1 . 2]"
1 9 ASP 3.958 0.084 7 0 "[ . 1 . 2]"
1 10 GLU 6.108 0.096 16 0 "[ . 1 . 2]"
1 11 ALA 7.659 0.097 5 0 "[ . 1 . 2]"
1 12 LEU 8.340 0.106 1 0 "[ . 1 . 2]"
1 13 GLU 4.106 0.099 6 0 "[ . 1 . 2]"
1 14 GLN 6.950 0.116 4 0 "[ . 1 . 2]"
1 15 GLY 3.278 0.093 8 0 "[ . 1 . 2]"
1 16 ILE 14.945 0.193 1 0 "[ . 1 . 2]"
1 17 THR 10.211 0.139 3 0 "[ . 1 . 2]"
1 18 LEU 15.532 0.165 1 0 "[ . 1 . 2]"
1 19 PHE 11.993 0.137 1 0 "[ . 1 . 2]"
1 20 VAL 7.023 0.132 1 0 "[ . 1 . 2]"
1 21 VAL 6.002 0.114 1 0 "[ . 1 . 2]"
1 22 ASN 2.575 0.105 20 0 "[ . 1 . 2]"
1 23 ASN 5.195 0.132 1 0 "[ . 1 . 2]"
1 24 ARG 3.788 0.091 11 0 "[ . 1 . 2]"
1 25 LEU 7.154 0.139 19 0 "[ . 1 . 2]"
1 26 GLN 4.435 0.114 1 0 "[ . 1 . 2]"
1 27 TYR 9.458 0.139 19 0 "[ . 1 . 2]"
1 28 GLU 5.171 0.129 1 0 "[ . 1 . 2]"
1 29 THR 5.318 0.099 16 0 "[ . 1 . 2]"
1 30 SER 1.420 0.101 4 0 "[ . 1 . 2]"
1 31 ARG 2.227 0.103 20 0 "[ . 1 . 2]"
1 32 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 SER 1.167 0.096 15 0 "[ . 1 . 2]"
1 34 ILE 12.316 0.123 15 0 "[ . 1 . 2]"
1 35 PRO 6.291 0.105 6 0 "[ . 1 . 2]"
1 36 THR 2.373 0.160 1 0 "[ . 1 . 2]"
1 37 GLU 0.687 0.095 13 0 "[ . 1 . 2]"
1 38 LEU 6.396 0.193 1 0 "[ . 1 . 2]"
1 39 LEU 5.531 0.111 11 0 "[ . 1 . 2]"
1 40 ASN 3.843 0.160 1 0 "[ . 1 . 2]"
1 41 LYS 8.581 0.126 4 0 "[ . 1 . 2]"
1 42 TRP 12.543 0.165 1 0 "[ . 1 . 2]"
1 43 LYS 3.216 0.073 4 0 "[ . 1 . 2]"
1 44 GLN 5.559 0.078 20 0 "[ . 1 . 2]"
1 45 HIS 4.653 0.079 15 0 "[ . 1 . 2]"
1 46 LYS 5.667 0.091 16 0 "[ . 1 . 2]"
1 47 GLN 4.704 0.085 3 0 "[ . 1 . 2]"
1 48 GLU 4.824 0.101 6 0 "[ . 1 . 2]"
1 49 LEU 10.506 0.103 10 0 "[ . 1 . 2]"
1 50 ILE 16.573 0.117 3 0 "[ . 1 . 2]"
1 51 ASP 3.572 0.092 9 0 "[ . 1 . 2]"
1 52 PHE 10.664 0.092 8 0 "[ . 1 . 2]"
1 53 LEU 13.642 0.104 5 0 "[ . 1 . 2]"
1 54 ASN 10.196 0.111 3 0 "[ . 1 . 2]"
1 55 GLN 6.423 0.090 4 0 "[ . 1 . 2]"
1 56 LEU 4.952 0.103 16 0 "[ . 1 . 2]"
1 57 ASP 3.293 0.101 8 0 "[ . 1 . 2]"
1 58 SER 0.894 0.077 9 0 "[ . 1 . 2]"
1 59 GLU 2.555 0.081 18 0 "[ . 1 . 2]"
1 60 GLU 0.823 0.098 13 0 "[ . 1 . 2]"
1 61 GLN 3.331 0.117 3 0 "[ . 1 . 2]"
1 62 THR 0.389 0.069 15 0 "[ . 1 . 2]"
1 63 LYS 0.111 0.064 11 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 GLY QA 1 2 ILE HA . . 4.300 4.050 3.944 4.148 . 0 0 "[ . 1 . 2]" 1
2 1 1 GLY QA 1 2 ILE HB . . 4.860 4.129 3.837 4.449 . 0 0 "[ . 1 . 2]" 1
3 1 1 GLY QA 1 2 ILE MG . . 3.920 3.578 3.433 3.769 . 0 0 "[ . 1 . 2]" 1
4 1 2 ILE H 1 2 ILE MD . . 5.500 4.367 4.083 4.451 . 0 0 "[ . 1 . 2]" 1
5 1 2 ILE H 1 3 ASP H . . 4.970 4.418 4.199 4.694 . 0 0 "[ . 1 . 2]" 1
6 1 2 ILE HA 1 2 ILE HB . . 2.840 2.521 2.419 2.601 . 0 0 "[ . 1 . 2]" 1
7 1 2 ILE HA 1 2 ILE MD . . 2.670 2.152 1.960 2.234 . 0 0 "[ . 1 . 2]" 1
8 1 2 ILE HA 1 2 ILE HG12 . . 3.840 3.747 3.684 3.816 . 0 0 "[ . 1 . 2]" 1
9 1 2 ILE HA 1 2 ILE HG13 . . 3.380 3.273 3.095 3.354 . 0 0 "[ . 1 . 2]" 1
10 1 2 ILE HA 1 2 ILE MG . . 3.210 3.266 3.184 3.284 0.074 2 0 "[ . 1 . 2]" 1
11 1 2 ILE HA 1 3 ASP H . . 2.730 2.404 2.199 2.592 . 0 0 "[ . 1 . 2]" 1
12 1 2 ILE HA 1 3 ASP HA . . 5.210 4.465 4.379 4.528 . 0 0 "[ . 1 . 2]" 1
13 1 2 ILE HA 1 3 ASP HB2 . . 5.500 4.626 4.308 4.905 . 0 0 "[ . 1 . 2]" 1
14 1 2 ILE HA 1 3 ASP HB3 . . 5.500 5.570 5.553 5.593 0.093 1 0 "[ . 1 . 2]" 1
15 1 2 ILE HA 1 7 ILE MD . . 4.800 4.794 4.599 4.874 0.074 18 0 "[ . 1 . 2]" 1
16 1 2 ILE HB 1 2 ILE MD . . 3.190 2.514 2.417 2.581 . 0 0 "[ . 1 . 2]" 1
17 1 2 ILE HB 1 7 ILE MD . . 4.110 4.167 4.080 4.204 0.094 16 0 "[ . 1 . 2]" 1
18 1 2 ILE HB 1 41 LYS QD . . 4.840 4.779 4.429 4.912 0.072 3 0 "[ . 1 . 2]" 1
19 1 2 ILE HB 1 45 HIS HB2 . . 5.500 5.507 5.065 5.571 0.071 6 0 "[ . 1 . 2]" 1
20 1 2 ILE HB 1 45 HIS HE1 . . 3.770 3.373 3.046 3.630 . 0 0 "[ . 1 . 2]" 1
21 1 2 ILE MD 1 3 ASP H . . 3.320 1.820 1.748 1.914 . 0 0 "[ . 1 . 2]" 1
22 1 2 ILE MD 1 3 ASP HB2 . . 3.920 3.854 3.588 4.007 0.087 1 0 "[ . 1 . 2]" 1
23 1 2 ILE MD 1 3 ASP HB3 . . 5.100 5.046 4.864 5.146 0.046 15 0 "[ . 1 . 2]" 1
24 1 2 ILE MD 1 4 ALA H . . 5.500 5.081 4.946 5.162 . 0 0 "[ . 1 . 2]" 1
25 1 2 ILE MD 1 4 ALA HA . . 4.500 4.539 4.389 4.586 0.086 19 0 "[ . 1 . 2]" 1
26 1 2 ILE MD 1 6 GLN HB2 . . 3.590 3.438 3.287 3.608 0.018 11 0 "[ . 1 . 2]" 1
27 1 2 ILE MD 1 6 GLN HB3 . . 5.500 4.110 3.975 4.273 . 0 0 "[ . 1 . 2]" 1
28 1 2 ILE MD 1 6 GLN HG3 . . 4.620 4.545 4.317 4.691 0.071 4 0 "[ . 1 . 2]" 1
29 1 2 ILE MD 1 7 ILE H . . 5.500 4.008 3.839 4.131 . 0 0 "[ . 1 . 2]" 1
30 1 2 ILE MD 1 7 ILE HA . . 4.400 4.392 4.248 4.463 0.063 11 0 "[ . 1 . 2]" 1
31 1 2 ILE MD 1 7 ILE HB . . 4.420 4.493 4.475 4.511 0.091 18 0 "[ . 1 . 2]" 1
32 1 2 ILE MD 1 7 ILE MD . . 3.700 2.332 2.156 2.539 . 0 0 "[ . 1 . 2]" 1
33 1 2 ILE MD 1 7 ILE HG13 . . 5.340 2.363 2.299 2.448 . 0 0 "[ . 1 . 2]" 1
34 1 2 ILE MD 1 7 ILE MG . . 4.020 4.041 3.838 4.119 0.099 14 0 "[ . 1 . 2]" 1
35 1 2 ILE MD 1 41 LYS QD . . 5.500 2.257 2.073 2.614 . 0 0 "[ . 1 . 2]" 1
36 1 2 ILE MD 1 41 LYS QE . . 5.480 3.302 2.711 3.506 . 0 0 "[ . 1 . 2]" 1
37 1 2 ILE MD 1 41 LYS HG2 . . 4.920 3.688 3.326 4.008 . 0 0 "[ . 1 . 2]" 1
38 1 2 ILE HG12 1 2 ILE MG . . 2.880 2.310 2.250 2.372 . 0 0 "[ . 1 . 2]" 1
39 1 2 ILE HG12 1 3 ASP H . . 4.220 3.848 3.687 4.028 . 0 0 "[ . 1 . 2]" 1
40 1 2 ILE HG12 1 44 GLN HG2 . . 5.500 5.561 5.492 5.578 0.078 20 0 "[ . 1 . 2]" 1
41 1 2 ILE HG12 1 45 HIS HB3 . . 4.880 3.883 3.745 4.026 . 0 0 "[ . 1 . 2]" 1
42 1 2 ILE HG12 1 45 HIS HE1 . . 4.640 4.078 3.826 4.238 . 0 0 "[ . 1 . 2]" 1
43 1 2 ILE HG13 1 2 ILE MG . . 3.270 2.361 2.296 2.414 . 0 0 "[ . 1 . 2]" 1
44 1 2 ILE HG13 1 3 ASP H . . 3.900 2.442 2.245 2.644 . 0 0 "[ . 1 . 2]" 1
45 1 2 ILE HG13 1 3 ASP HA . . 5.090 4.181 3.839 4.336 . 0 0 "[ . 1 . 2]" 1
46 1 2 ILE HG13 1 4 ALA H . . 4.320 4.310 4.013 4.376 0.056 10 0 "[ . 1 . 2]" 1
47 1 2 ILE HG13 1 4 ALA HA . . 4.000 3.771 3.607 3.920 . 0 0 "[ . 1 . 2]" 1
48 1 2 ILE HG13 1 6 GLN HB2 . . 4.950 4.875 4.683 4.999 0.049 20 0 "[ . 1 . 2]" 1
49 1 2 ILE HG13 1 7 ILE MD . . 4.560 2.162 1.979 2.269 . 0 0 "[ . 1 . 2]" 1
50 1 2 ILE HG13 1 41 LYS QE . . 5.460 5.431 4.972 5.539 0.079 10 0 "[ . 1 . 2]" 1
51 1 2 ILE HG13 1 45 HIS HE1 . . 5.500 5.482 5.323 5.555 0.055 5 0 "[ . 1 . 2]" 1
52 1 2 ILE MG 1 3 ASP HA . . 4.290 3.908 3.612 4.219 . 0 0 "[ . 1 . 2]" 1
53 1 2 ILE MG 1 7 ILE HG13 . . 5.070 4.921 4.633 5.146 0.076 16 0 "[ . 1 . 2]" 1
54 1 2 ILE MG 1 41 LYS HG3 . . 5.240 5.290 5.159 5.325 0.085 11 0 "[ . 1 . 2]" 1
55 1 2 ILE MG 1 45 HIS H . . 5.470 5.284 5.034 5.453 . 0 0 "[ . 1 . 2]" 1
56 1 2 ILE MG 1 45 HIS HB2 . . 4.150 3.516 3.059 3.717 . 0 0 "[ . 1 . 2]" 1
57 1 2 ILE MG 1 45 HIS HB3 . . 4.260 2.666 2.426 2.910 . 0 0 "[ . 1 . 2]" 1
58 1 2 ILE MG 1 45 HIS HD2 . . 4.040 3.940 3.808 4.104 0.064 6 0 "[ . 1 . 2]" 1
59 1 2 ILE MG 1 45 HIS HE1 . . 3.130 3.060 2.613 3.209 0.079 15 0 "[ . 1 . 2]" 1
60 1 2 ILE MG 1 48 GLU QB . . 5.500 3.141 2.782 3.430 . 0 0 "[ . 1 . 2]" 1
61 1 2 ILE MG 1 48 GLU HG2 . . 4.630 4.391 4.204 4.556 . 0 0 "[ . 1 . 2]" 1
62 1 2 ILE MG 1 48 GLU HG3 . . 3.870 3.941 3.749 3.971 0.101 6 0 "[ . 1 . 2]" 1
63 1 3 ASP H 1 3 ASP HB2 . . 3.200 2.687 2.382 2.859 . 0 0 "[ . 1 . 2]" 1
64 1 3 ASP H 1 3 ASP HB3 . . 3.700 3.732 3.579 3.768 0.068 8 0 "[ . 1 . 2]" 1
65 1 3 ASP H 1 4 ALA H . . 5.310 4.042 3.923 4.312 . 0 0 "[ . 1 . 2]" 1
66 1 3 ASP H 1 6 GLN HB2 . . 5.500 3.243 3.206 3.335 . 0 0 "[ . 1 . 2]" 1
67 1 3 ASP H 1 6 GLN HB3 . . 4.600 4.654 4.511 4.681 0.081 14 0 "[ . 1 . 2]" 1
68 1 3 ASP H 1 7 ILE MD . . 4.300 3.778 3.209 4.148 . 0 0 "[ . 1 . 2]" 1
69 1 3 ASP H 1 7 ILE HG13 . . 5.500 3.602 3.373 4.016 . 0 0 "[ . 1 . 2]" 1
70 1 3 ASP HA 1 3 ASP HB3 . . 2.820 2.380 2.298 2.494 . 0 0 "[ . 1 . 2]" 1
71 1 3 ASP HA 1 4 ALA H . . 2.600 2.119 2.013 2.199 . 0 0 "[ . 1 . 2]" 1
72 1 3 ASP HA 1 4 ALA HA . . 5.500 4.418 4.367 4.479 . 0 0 "[ . 1 . 2]" 1
73 1 3 ASP HA 1 4 ALA MB . . 4.110 3.986 3.893 4.077 . 0 0 "[ . 1 . 2]" 1
74 1 3 ASP HA 1 5 ALA MB . . 5.330 4.815 4.556 5.125 . 0 0 "[ . 1 . 2]" 1
75 1 3 ASP HA 1 6 GLN HB2 . . 4.690 4.732 4.488 4.761 0.071 17 0 "[ . 1 . 2]" 1
76 1 3 ASP HA 1 7 ILE MD . . 5.500 4.963 4.437 5.249 . 0 0 "[ . 1 . 2]" 1
77 1 3 ASP HB2 1 4 ALA H . . 4.070 4.137 4.101 4.152 0.082 2 0 "[ . 1 . 2]" 1
78 1 3 ASP HB2 1 4 ALA MB . . 5.500 5.327 5.247 5.422 . 0 0 "[ . 1 . 2]" 1
79 1 3 ASP HB2 1 5 ALA H . . 4.080 4.096 3.917 4.151 0.071 14 0 "[ . 1 . 2]" 1
80 1 3 ASP HB2 1 6 GLN H . . 3.640 2.589 2.394 2.699 . 0 0 "[ . 1 . 2]" 1
81 1 3 ASP HB2 1 6 GLN HB2 . . 4.010 2.196 1.995 2.346 . 0 0 "[ . 1 . 2]" 1
82 1 3 ASP HB2 1 6 GLN HB3 . . 3.990 3.688 3.469 3.839 . 0 0 "[ . 1 . 2]" 1
83 1 3 ASP HB2 1 7 ILE H . . 4.220 4.216 4.024 4.286 0.066 17 0 "[ . 1 . 2]" 1
84 1 3 ASP HB3 1 4 ALA H . . 3.710 3.489 3.290 3.740 0.030 4 0 "[ . 1 . 2]" 1
85 1 3 ASP HB3 1 4 ALA MB . . 5.090 4.798 4.571 5.070 . 0 0 "[ . 1 . 2]" 1
86 1 3 ASP HB3 1 5 ALA H . . 4.400 3.343 2.878 3.851 . 0 0 "[ . 1 . 2]" 1
87 1 3 ASP HB3 1 5 ALA MB . . 4.580 3.347 2.751 3.912 . 0 0 "[ . 1 . 2]" 1
88 1 3 ASP HB3 1 6 GLN H . . 3.950 3.002 2.467 3.494 . 0 0 "[ . 1 . 2]" 1
89 1 4 ALA H 1 4 ALA MB . . 2.660 2.226 2.190 2.266 . 0 0 "[ . 1 . 2]" 1
90 1 4 ALA H 1 5 ALA H . . 3.080 2.735 2.599 2.880 . 0 0 "[ . 1 . 2]" 1
91 1 4 ALA H 1 5 ALA HA . . 5.500 5.364 5.246 5.468 . 0 0 "[ . 1 . 2]" 1
92 1 4 ALA H 1 5 ALA MB . . 4.610 4.374 4.200 4.583 . 0 0 "[ . 1 . 2]" 1
93 1 4 ALA H 1 6 GLN H . . 4.250 4.244 4.135 4.311 0.061 3 0 "[ . 1 . 2]" 1
94 1 4 ALA H 1 6 GLN HB2 . . 5.370 5.267 5.126 5.350 . 0 0 "[ . 1 . 2]" 1
95 1 4 ALA H 1 7 ILE H . . 5.360 4.974 4.843 5.086 . 0 0 "[ . 1 . 2]" 1
96 1 4 ALA H 1 7 ILE MD . . 4.390 4.242 3.787 4.439 0.049 2 0 "[ . 1 . 2]" 1
97 1 4 ALA H 1 49 LEU MD2 . . 5.010 4.878 4.663 5.078 0.068 7 0 "[ . 1 . 2]" 1
98 1 4 ALA HA 1 5 ALA HA . . 5.290 4.859 4.787 4.925 . 0 0 "[ . 1 . 2]" 1
99 1 4 ALA HA 1 6 GLN H . . 4.500 4.296 4.144 4.443 . 0 0 "[ . 1 . 2]" 1
100 1 4 ALA HA 1 7 ILE H . . 3.680 3.397 3.217 3.571 . 0 0 "[ . 1 . 2]" 1
101 1 4 ALA HA 1 7 ILE HB . . 3.370 3.014 2.789 3.222 . 0 0 "[ . 1 . 2]" 1
102 1 4 ALA HA 1 7 ILE MD . . 3.110 2.268 2.115 2.678 . 0 0 "[ . 1 . 2]" 1
103 1 4 ALA HA 1 7 ILE HG13 . . 3.790 3.349 3.043 3.605 . 0 0 "[ . 1 . 2]" 1
104 1 4 ALA HA 1 8 VAL H . . 4.490 4.352 4.038 4.548 0.058 5 0 "[ . 1 . 2]" 1
105 1 4 ALA HA 1 49 LEU HA . . 4.240 3.724 3.530 3.905 . 0 0 "[ . 1 . 2]" 1
106 1 4 ALA HA 1 49 LEU MD2 . . 3.180 2.527 2.374 2.743 . 0 0 "[ . 1 . 2]" 1
107 1 4 ALA HA 1 49 LEU HG . . 4.190 3.560 3.367 3.725 . 0 0 "[ . 1 . 2]" 1
108 1 4 ALA HA 1 52 PHE HB3 . . 5.500 4.830 4.758 4.908 . 0 0 "[ . 1 . 2]" 1
109 1 4 ALA MB 1 5 ALA H . . 2.910 2.597 2.489 2.685 . 0 0 "[ . 1 . 2]" 1
110 1 4 ALA MB 1 5 ALA MB . . 3.900 3.826 3.675 3.917 0.017 2 0 "[ . 1 . 2]" 1
111 1 4 ALA MB 1 6 GLN H . . 4.530 4.554 4.440 4.609 0.079 15 0 "[ . 1 . 2]" 1
112 1 4 ALA MB 1 7 ILE MD . . 3.950 3.540 3.428 3.781 . 0 0 "[ . 1 . 2]" 1
113 1 4 ALA MB 1 45 HIS HB2 . . 5.500 5.205 5.015 5.425 . 0 0 "[ . 1 . 2]" 1
114 1 4 ALA MB 1 48 GLU H . . 5.420 5.322 5.047 5.496 0.076 15 0 "[ . 1 . 2]" 1
115 1 4 ALA MB 1 48 GLU QB . . 3.790 2.954 2.676 3.363 . 0 0 "[ . 1 . 2]" 1
116 1 4 ALA MB 1 49 LEU HA . . 3.000 2.093 1.956 2.180 . 0 0 "[ . 1 . 2]" 1
117 1 4 ALA MB 1 49 LEU MD2 . . 3.040 2.498 2.236 2.771 . 0 0 "[ . 1 . 2]" 1
118 1 4 ALA MB 1 49 LEU HG . . 3.730 3.428 3.144 3.757 0.027 16 0 "[ . 1 . 2]" 1
119 1 4 ALA MB 1 51 ASP H . . 5.500 5.133 4.925 5.244 . 0 0 "[ . 1 . 2]" 1
120 1 4 ALA MB 1 51 ASP HB3 . . 4.530 4.567 4.386 4.622 0.092 9 0 "[ . 1 . 2]" 1
121 1 4 ALA MB 1 52 PHE H . . 3.770 3.546 3.437 3.740 . 0 0 "[ . 1 . 2]" 1
122 1 4 ALA MB 1 52 PHE HA . . 4.010 4.026 3.870 4.089 0.079 19 0 "[ . 1 . 2]" 1
123 1 4 ALA MB 1 52 PHE HB2 . . 3.430 2.068 1.893 2.121 . 0 0 "[ . 1 . 2]" 1
124 1 4 ALA MB 1 52 PHE HB3 . . 3.220 2.250 2.170 2.408 . 0 0 "[ . 1 . 2]" 1
125 1 4 ALA MB 1 52 PHE QD . . 3.580 2.739 2.294 3.013 . 0 0 "[ . 1 . 2]" 1
126 1 4 ALA MB 1 53 LEU MD2 . . 3.780 3.623 3.398 3.884 0.104 5 0 "[ . 1 . 2]" 1
127 1 5 ALA H 1 5 ALA MB . . 2.430 2.220 2.092 2.271 . 0 0 "[ . 1 . 2]" 1
128 1 5 ALA H 1 6 GLN H . . 2.790 2.743 2.648 2.825 0.035 16 0 "[ . 1 . 2]" 1
129 1 5 ALA H 1 6 GLN HB2 . . 4.870 4.794 4.652 4.883 0.013 19 0 "[ . 1 . 2]" 1
130 1 5 ALA H 1 7 ILE H . . 4.400 4.217 4.091 4.355 . 0 0 "[ . 1 . 2]" 1
131 1 5 ALA H 1 7 ILE HG13 . . 5.470 5.487 5.225 5.530 0.060 3 0 "[ . 1 . 2]" 1
132 1 5 ALA H 1 8 VAL H . . 4.990 4.809 4.723 4.916 . 0 0 "[ . 1 . 2]" 1
133 1 5 ALA H 1 8 VAL HB . . 5.500 5.286 4.999 5.519 0.019 14 0 "[ . 1 . 2]" 1
134 1 5 ALA HA 1 6 GLN HA . . 4.800 4.811 4.774 4.844 0.044 16 0 "[ . 1 . 2]" 1
135 1 5 ALA HA 1 8 VAL H . . 3.600 3.354 3.161 3.568 . 0 0 "[ . 1 . 2]" 1
136 1 5 ALA HA 1 8 VAL HA . . 5.500 5.456 5.331 5.565 0.065 14 0 "[ . 1 . 2]" 1
137 1 5 ALA HA 1 8 VAL HB . . 3.160 2.720 2.475 2.913 . 0 0 "[ . 1 . 2]" 1
138 1 5 ALA HA 1 8 VAL MG1 . . 4.290 4.093 3.813 4.286 . 0 0 "[ . 1 . 2]" 1
139 1 5 ALA HA 1 8 VAL MG2 . . 3.180 3.193 2.979 3.262 0.082 16 0 "[ . 1 . 2]" 1
140 1 5 ALA HA 1 9 ASP H . . 4.230 4.099 3.832 4.277 0.047 10 0 "[ . 1 . 2]" 1
141 1 5 ALA HA 1 52 PHE QE . . 5.500 2.750 2.276 3.375 . 0 0 "[ . 1 . 2]" 1
142 1 5 ALA MB 1 6 GLN H . . 2.750 2.589 2.412 2.725 . 0 0 "[ . 1 . 2]" 1
143 1 5 ALA MB 1 6 GLN HA . . 3.780 3.838 3.747 3.862 0.082 7 0 "[ . 1 . 2]" 1
144 1 5 ALA MB 1 6 GLN HB2 . . 4.500 4.496 4.283 4.576 0.076 4 0 "[ . 1 . 2]" 1
145 1 5 ALA MB 1 7 ILE H . . 4.560 4.531 4.391 4.625 0.065 18 0 "[ . 1 . 2]" 1
146 1 5 ALA MB 1 8 VAL H . . 4.640 4.557 4.437 4.658 0.018 17 0 "[ . 1 . 2]" 1
147 1 5 ALA MB 1 8 VAL HB . . 4.280 4.131 3.977 4.318 0.038 16 0 "[ . 1 . 2]" 1
148 1 5 ALA MB 1 9 ASP H . . 5.500 4.567 4.407 4.750 . 0 0 "[ . 1 . 2]" 1
149 1 5 ALA MB 1 52 PHE QD . . 4.250 3.694 3.298 3.971 . 0 0 "[ . 1 . 2]" 1
150 1 5 ALA MB 1 52 PHE QE . . 4.370 2.687 2.181 3.047 . 0 0 "[ . 1 . 2]" 1
151 1 5 ALA MB 1 52 PHE HZ . . 3.730 2.828 2.574 3.142 . 0 0 "[ . 1 . 2]" 1
152 1 6 GLN H 1 6 GLN HB2 . . 3.390 2.333 2.267 2.401 . 0 0 "[ . 1 . 2]" 1
153 1 6 GLN H 1 6 GLN HB3 . . 3.570 3.565 3.534 3.604 0.034 9 0 "[ . 1 . 2]" 1
154 1 6 GLN H 1 6 GLN HG2 . . 3.500 2.596 2.378 2.790 . 0 0 "[ . 1 . 2]" 1
155 1 6 GLN H 1 6 GLN HG3 . . 3.690 3.635 3.309 3.754 0.064 7 0 "[ . 1 . 2]" 1
156 1 6 GLN H 1 7 ILE HA . . 5.470 5.258 5.116 5.347 . 0 0 "[ . 1 . 2]" 1
157 1 6 GLN H 1 7 ILE MD . . 5.190 5.026 4.525 5.210 0.020 4 0 "[ . 1 . 2]" 1
158 1 6 GLN H 1 7 ILE HG13 . . 5.500 4.220 4.024 4.342 . 0 0 "[ . 1 . 2]" 1
159 1 6 GLN H 1 8 VAL H . . 4.290 4.124 3.989 4.229 . 0 0 "[ . 1 . 2]" 1
160 1 6 GLN HA 1 6 GLN HB3 . . 2.800 2.621 2.590 2.680 . 0 0 "[ . 1 . 2]" 1
161 1 6 GLN HA 1 6 GLN HG2 . . 3.100 2.807 2.503 3.034 . 0 0 "[ . 1 . 2]" 1
162 1 6 GLN HA 1 6 GLN HG3 . . 3.750 3.750 3.675 3.806 0.056 8 0 "[ . 1 . 2]" 1
163 1 6 GLN HA 1 7 ILE HA . . 4.900 4.757 4.698 4.807 . 0 0 "[ . 1 . 2]" 1
164 1 6 GLN HA 1 8 VAL H . . 4.590 4.430 4.302 4.573 . 0 0 "[ . 1 . 2]" 1
165 1 6 GLN HA 1 9 ASP H . . 4.070 3.557 3.285 3.729 . 0 0 "[ . 1 . 2]" 1
166 1 6 GLN HA 1 9 ASP HB2 . . 3.710 3.467 3.161 3.769 0.059 9 0 "[ . 1 . 2]" 1
167 1 6 GLN HA 1 9 ASP HB3 . . 3.290 2.997 2.363 3.356 0.066 17 0 "[ . 1 . 2]" 1
168 1 6 GLN HB3 1 7 ILE H . . 3.710 3.589 3.419 3.749 0.039 15 0 "[ . 1 . 2]" 1
169 1 6 GLN HB3 1 7 ILE HG12 . . 5.500 5.081 4.787 5.224 . 0 0 "[ . 1 . 2]" 1
170 1 6 GLN QE 1 6 GLN HG2 . . 3.300 2.532 2.260 3.369 0.069 7 0 "[ . 1 . 2]" 1
171 1 6 GLN QE 1 9 ASP HB2 . . 5.340 4.236 3.484 5.337 . 0 0 "[ . 1 . 2]" 1
172 1 6 GLN HE22 1 6 GLN HG2 . . 4.020 3.671 3.503 4.080 0.060 13 0 "[ . 1 . 2]" 1
173 1 6 GLN HG2 1 7 ILE H . . 4.820 4.650 4.520 4.821 0.001 4 0 "[ . 1 . 2]" 1
174 1 7 ILE H 1 7 ILE HB . . 2.890 2.514 2.453 2.571 . 0 0 "[ . 1 . 2]" 1
175 1 7 ILE H 1 7 ILE MD . . 3.570 3.454 3.198 3.611 0.041 4 0 "[ . 1 . 2]" 1
176 1 7 ILE H 1 7 ILE HG12 . . 3.550 3.500 3.352 3.604 0.054 15 0 "[ . 1 . 2]" 1
177 1 7 ILE H 1 7 ILE HG13 . . 3.040 2.162 2.069 2.290 . 0 0 "[ . 1 . 2]" 1
178 1 7 ILE H 1 7 ILE MG . . 3.850 3.771 3.711 3.800 . 0 0 "[ . 1 . 2]" 1
179 1 7 ILE H 1 8 VAL H . . 3.160 2.639 2.502 2.757 . 0 0 "[ . 1 . 2]" 1
180 1 7 ILE H 1 8 VAL HA . . 5.420 5.276 5.165 5.383 . 0 0 "[ . 1 . 2]" 1
181 1 7 ILE H 1 8 VAL HB . . 5.500 4.790 4.501 4.992 . 0 0 "[ . 1 . 2]" 1
182 1 7 ILE H 1 8 VAL MG2 . . 4.140 4.207 4.121 4.225 0.085 10 0 "[ . 1 . 2]" 1
183 1 7 ILE H 1 9 ASP H . . 5.500 4.176 3.974 4.316 . 0 0 "[ . 1 . 2]" 1
184 1 7 ILE H 1 10 GLU H . . 5.500 4.980 4.828 5.143 . 0 0 "[ . 1 . 2]" 1
185 1 7 ILE H 1 49 LEU MD2 . . 3.900 3.954 3.810 3.981 0.081 16 0 "[ . 1 . 2]" 1
186 1 7 ILE HA 1 7 ILE MD . . 4.020 3.967 3.858 4.010 . 0 0 "[ . 1 . 2]" 1
187 1 7 ILE HA 1 7 ILE HG12 . . 3.390 2.745 2.587 2.877 . 0 0 "[ . 1 . 2]" 1
188 1 7 ILE HA 1 7 ILE HG13 . . 3.310 3.040 2.971 3.153 . 0 0 "[ . 1 . 2]" 1
189 1 7 ILE HA 1 7 ILE MG . . 3.160 2.301 2.257 2.398 . 0 0 "[ . 1 . 2]" 1
190 1 7 ILE HA 1 8 VAL HA . . 5.410 4.796 4.740 4.859 . 0 0 "[ . 1 . 2]" 1
191 1 7 ILE HA 1 9 ASP H . . 4.540 4.451 4.245 4.579 0.039 8 0 "[ . 1 . 2]" 1
192 1 7 ILE HA 1 10 GLU H . . 3.830 3.676 3.515 3.788 . 0 0 "[ . 1 . 2]" 1
193 1 7 ILE HA 1 10 GLU HB2 . . 5.310 4.974 4.861 5.050 . 0 0 "[ . 1 . 2]" 1
194 1 7 ILE HA 1 10 GLU HB3 . . 5.500 4.343 4.125 4.440 . 0 0 "[ . 1 . 2]" 1
195 1 7 ILE HA 1 10 GLU HG2 . . 3.900 2.162 2.051 2.262 . 0 0 "[ . 1 . 2]" 1
196 1 7 ILE HA 1 10 GLU HG3 . . 4.030 3.241 3.086 3.590 . 0 0 "[ . 1 . 2]" 1
197 1 7 ILE HA 1 11 ALA H . . 4.380 4.118 3.918 4.329 . 0 0 "[ . 1 . 2]" 1
198 1 7 ILE HB 1 7 ILE MD . . 3.060 2.373 2.183 2.470 . 0 0 "[ . 1 . 2]" 1
199 1 7 ILE HB 1 8 VAL H . . 3.180 2.771 2.672 2.940 . 0 0 "[ . 1 . 2]" 1
200 1 7 ILE HB 1 8 VAL HA . . 4.480 4.353 4.247 4.441 . 0 0 "[ . 1 . 2]" 1
201 1 7 ILE HB 1 8 VAL HB . . 5.100 4.970 4.816 5.132 0.032 7 0 "[ . 1 . 2]" 1
202 1 7 ILE HB 1 10 GLU HG2 . . 4.930 4.930 4.850 4.991 0.061 4 0 "[ . 1 . 2]" 1
203 1 7 ILE HB 1 49 LEU MD1 . . 4.060 3.904 3.666 4.046 . 0 0 "[ . 1 . 2]" 1
204 1 7 ILE HB 1 49 LEU MD2 . . 3.090 2.034 1.916 2.123 . 0 0 "[ . 1 . 2]" 1
205 1 7 ILE MD 1 7 ILE MG . . 2.780 2.043 1.988 2.264 . 0 0 "[ . 1 . 2]" 1
206 1 7 ILE MD 1 8 VAL H . . 4.650 4.600 4.401 4.711 0.061 6 0 "[ . 1 . 2]" 1
207 1 7 ILE MD 1 41 LYS HA . . 5.070 4.775 4.543 5.153 0.083 10 0 "[ . 1 . 2]" 1
208 1 7 ILE MD 1 41 LYS QD . . 3.700 3.038 2.691 3.531 . 0 0 "[ . 1 . 2]" 1
209 1 7 ILE MD 1 41 LYS QE . . 3.860 3.501 3.248 3.723 . 0 0 "[ . 1 . 2]" 1
210 1 7 ILE MD 1 41 LYS HG2 . . 3.280 2.514 2.328 2.947 . 0 0 "[ . 1 . 2]" 1
211 1 7 ILE MD 1 41 LYS HG3 . . 3.530 3.120 2.622 3.455 . 0 0 "[ . 1 . 2]" 1
212 1 7 ILE MD 1 42 TRP HA . . 4.320 3.650 3.423 4.030 . 0 0 "[ . 1 . 2]" 1
213 1 7 ILE MD 1 42 TRP HD1 . . 4.130 3.750 3.543 4.094 . 0 0 "[ . 1 . 2]" 1
214 1 7 ILE MD 1 45 HIS H . . 4.380 4.167 3.952 4.455 0.075 20 0 "[ . 1 . 2]" 1
215 1 7 ILE MD 1 45 HIS HA . . 5.500 4.999 4.748 5.236 . 0 0 "[ . 1 . 2]" 1
216 1 7 ILE MD 1 45 HIS HB2 . . 3.530 2.563 2.306 2.761 . 0 0 "[ . 1 . 2]" 1
217 1 7 ILE MD 1 45 HIS HB3 . . 4.260 3.415 3.139 3.785 . 0 0 "[ . 1 . 2]" 1
218 1 7 ILE MD 1 45 HIS HD2 . . 3.610 2.714 2.370 3.063 . 0 0 "[ . 1 . 2]" 1
219 1 7 ILE MD 1 48 GLU QB . . 4.220 3.840 3.621 4.021 . 0 0 "[ . 1 . 2]" 1
220 1 7 ILE MD 1 48 GLU HG3 . . 5.500 5.376 5.014 5.562 0.062 10 0 "[ . 1 . 2]" 1
221 1 7 ILE MD 1 49 LEU H . . 5.500 4.552 4.330 4.873 . 0 0 "[ . 1 . 2]" 1
222 1 7 ILE MD 1 49 LEU HA . . 4.670 4.407 4.162 4.566 . 0 0 "[ . 1 . 2]" 1
223 1 7 ILE MD 1 49 LEU MD1 . . 3.080 2.564 2.325 3.152 0.072 16 0 "[ . 1 . 2]" 1
224 1 7 ILE MD 1 49 LEU MD2 . . 3.030 2.232 1.920 2.634 . 0 0 "[ . 1 . 2]" 1
225 1 7 ILE HG12 1 8 VAL H . . 5.190 5.172 4.993 5.240 0.050 7 0 "[ . 1 . 2]" 1
226 1 7 ILE HG12 1 41 LYS QB . . 5.000 4.214 3.901 4.507 . 0 0 "[ . 1 . 2]" 1
227 1 7 ILE HG12 1 41 LYS QE . . 4.040 2.140 1.977 2.488 . 0 0 "[ . 1 . 2]" 1
228 1 7 ILE HG12 1 41 LYS HG2 . . 3.860 2.609 2.347 2.877 . 0 0 "[ . 1 . 2]" 1
229 1 7 ILE HG12 1 49 LEU MD1 . . 5.500 4.799 4.610 5.019 . 0 0 "[ . 1 . 2]" 1
230 1 7 ILE HG13 1 7 ILE MG . . 3.230 3.195 3.158 3.228 . 0 0 "[ . 1 . 2]" 1
231 1 7 ILE HG13 1 8 VAL H . . 4.370 4.354 4.151 4.411 0.041 7 0 "[ . 1 . 2]" 1
232 1 7 ILE HG13 1 49 LEU MD2 . . 4.130 3.824 3.438 4.193 0.063 20 0 "[ . 1 . 2]" 1
233 1 7 ILE MG 1 8 VAL H . . 3.800 3.667 3.542 3.808 0.008 7 0 "[ . 1 . 2]" 1
234 1 7 ILE MG 1 8 VAL HA . . 3.820 3.672 3.492 3.844 0.024 10 0 "[ . 1 . 2]" 1
235 1 7 ILE MG 1 9 ASP H . . 5.150 5.158 5.022 5.234 0.084 7 0 "[ . 1 . 2]" 1
236 1 7 ILE MG 1 10 GLU H . . 5.500 4.931 4.795 5.066 . 0 0 "[ . 1 . 2]" 1
237 1 7 ILE MG 1 10 GLU HB2 . . 5.500 5.542 5.362 5.596 0.096 16 0 "[ . 1 . 2]" 1
238 1 7 ILE MG 1 10 GLU HG3 . . 5.500 3.551 3.397 3.765 . 0 0 "[ . 1 . 2]" 1
239 1 7 ILE MG 1 11 ALA H . . 4.200 4.137 4.015 4.288 0.088 4 0 "[ . 1 . 2]" 1
240 1 7 ILE MG 1 11 ALA MB . . 3.560 3.221 3.067 3.556 . 0 0 "[ . 1 . 2]" 1
241 1 7 ILE MG 1 18 LEU MD1 . . 3.670 2.810 2.483 3.101 . 0 0 "[ . 1 . 2]" 1
242 1 7 ILE MG 1 18 LEU MD2 . . 5.500 4.274 4.003 4.459 . 0 0 "[ . 1 . 2]" 1
243 1 7 ILE MG 1 41 LYS QB . . 4.610 3.265 2.981 3.624 . 0 0 "[ . 1 . 2]" 1
244 1 7 ILE MG 1 41 LYS QD . . 3.710 3.708 3.589 3.818 0.108 7 0 "[ . 1 . 2]" 1
245 1 7 ILE MG 1 41 LYS QE . . 3.990 2.383 2.101 2.605 . 0 0 "[ . 1 . 2]" 1
246 1 7 ILE MG 1 41 LYS HG2 . . 3.810 2.469 1.968 2.637 . 0 0 "[ . 1 . 2]" 1
247 1 7 ILE MG 1 41 LYS HG3 . . 3.990 3.951 3.463 4.062 0.072 6 0 "[ . 1 . 2]" 1
248 1 7 ILE MG 1 42 TRP HA . . 5.470 3.112 2.724 3.281 . 0 0 "[ . 1 . 2]" 1
249 1 7 ILE MG 1 42 TRP HB2 . . 5.030 5.033 4.781 5.091 0.061 12 0 "[ . 1 . 2]" 1
250 1 7 ILE MG 1 42 TRP HD1 . . 2.870 1.978 1.935 2.027 . 0 0 "[ . 1 . 2]" 1
251 1 7 ILE MG 1 42 TRP HE1 . . 3.670 2.608 2.324 2.920 . 0 0 "[ . 1 . 2]" 1
252 1 7 ILE MG 1 49 LEU HA . . 5.500 5.530 5.386 5.588 0.088 11 0 "[ . 1 . 2]" 1
253 1 7 ILE MG 1 49 LEU MD1 . . 4.180 2.726 2.473 2.904 . 0 0 "[ . 1 . 2]" 1
254 1 7 ILE MG 1 49 LEU MD2 . . 4.120 2.196 1.962 2.331 . 0 0 "[ . 1 . 2]" 1
255 1 8 VAL H 1 8 VAL HB . . 2.830 2.404 2.317 2.480 . 0 0 "[ . 1 . 2]" 1
256 1 8 VAL H 1 8 VAL MG1 . . 3.890 3.778 3.733 3.811 . 0 0 "[ . 1 . 2]" 1
257 1 8 VAL H 1 8 VAL MG2 . . 2.770 2.294 2.190 2.415 . 0 0 "[ . 1 . 2]" 1
258 1 8 VAL H 1 9 ASP H . . 4.460 2.623 2.483 2.721 . 0 0 "[ . 1 . 2]" 1
259 1 8 VAL H 1 9 ASP HB2 . . 5.500 4.800 4.451 5.124 . 0 0 "[ . 1 . 2]" 1
260 1 8 VAL H 1 18 LEU MD1 . . 4.560 4.318 3.921 4.609 0.049 10 0 "[ . 1 . 2]" 1
261 1 8 VAL H 1 49 LEU MD2 . . 3.610 3.535 3.309 3.676 0.066 5 0 "[ . 1 . 2]" 1
262 1 8 VAL HA 1 8 VAL MG1 . . 3.010 2.516 2.410 2.573 . 0 0 "[ . 1 . 2]" 1
263 1 8 VAL HA 1 8 VAL MG2 . . 2.910 2.310 2.231 2.383 . 0 0 "[ . 1 . 2]" 1
264 1 8 VAL HA 1 11 ALA H . . 4.170 3.579 3.423 3.797 . 0 0 "[ . 1 . 2]" 1
265 1 8 VAL HA 1 11 ALA MB . . 3.390 2.684 2.566 2.925 . 0 0 "[ . 1 . 2]" 1
266 1 8 VAL HA 1 12 LEU H . . 4.440 4.114 3.901 4.392 . 0 0 "[ . 1 . 2]" 1
267 1 8 VAL HA 1 12 LEU HG . . 4.460 4.191 3.894 4.342 . 0 0 "[ . 1 . 2]" 1
268 1 8 VAL HA 1 18 LEU MD1 . . 3.610 3.019 2.634 3.434 . 0 0 "[ . 1 . 2]" 1
269 1 8 VAL HA 1 18 LEU MD2 . . 4.560 4.322 4.146 4.512 . 0 0 "[ . 1 . 2]" 1
270 1 8 VAL HA 1 18 LEU HG . . 3.350 2.781 2.510 3.011 . 0 0 "[ . 1 . 2]" 1
271 1 8 VAL HA 1 49 LEU MD2 . . 4.100 3.996 3.658 4.174 0.074 2 0 "[ . 1 . 2]" 1
272 1 8 VAL HB 1 9 ASP H . . 2.910 2.740 2.603 2.861 . 0 0 "[ . 1 . 2]" 1
273 1 8 VAL HB 1 9 ASP HA . . 4.640 4.478 4.372 4.597 . 0 0 "[ . 1 . 2]" 1
274 1 8 VAL HB 1 9 ASP HB2 . . 4.800 4.345 4.149 4.678 . 0 0 "[ . 1 . 2]" 1
275 1 8 VAL HB 1 11 ALA MB . . 5.480 5.207 5.061 5.413 . 0 0 "[ . 1 . 2]" 1
276 1 8 VAL HB 1 18 LEU MD1 . . 5.160 4.771 4.449 5.165 0.005 10 0 "[ . 1 . 2]" 1
277 1 8 VAL HB 1 49 LEU MD2 . . 5.040 4.589 4.327 4.745 . 0 0 "[ . 1 . 2]" 1
278 1 8 VAL HB 1 52 PHE HZ . . 4.140 4.166 3.952 4.206 0.066 10 0 "[ . 1 . 2]" 1
279 1 8 VAL MG1 1 9 ASP H . . 3.600 3.442 3.214 3.606 0.006 14 0 "[ . 1 . 2]" 1
280 1 8 VAL MG1 1 9 ASP HA . . 3.960 3.484 3.304 3.630 . 0 0 "[ . 1 . 2]" 1
281 1 8 VAL MG1 1 9 ASP HB2 . . 4.880 4.439 4.170 4.663 . 0 0 "[ . 1 . 2]" 1
282 1 8 VAL MG1 1 12 LEU H . . 5.500 4.151 3.967 4.320 . 0 0 "[ . 1 . 2]" 1
283 1 8 VAL MG1 1 12 LEU HB2 . . 4.420 4.234 3.955 4.475 0.055 4 0 "[ . 1 . 2]" 1
284 1 8 VAL MG1 1 12 LEU HB3 . . 5.150 5.079 4.870 5.235 0.085 10 0 "[ . 1 . 2]" 1
285 1 8 VAL MG1 1 12 LEU MD1 . . 3.830 2.290 1.949 2.554 . 0 0 "[ . 1 . 2]" 1
286 1 8 VAL MG1 1 12 LEU HG . . 3.650 2.968 2.735 3.242 . 0 0 "[ . 1 . 2]" 1
287 1 8 VAL MG1 1 18 LEU H . . 3.820 3.443 3.053 3.750 . 0 0 "[ . 1 . 2]" 1
288 1 8 VAL MG1 1 18 LEU HB2 . . 3.470 2.637 2.233 3.081 . 0 0 "[ . 1 . 2]" 1
289 1 8 VAL MG1 1 18 LEU MD1 . . 5.500 3.745 3.544 4.072 . 0 0 "[ . 1 . 2]" 1
290 1 8 VAL MG1 1 18 LEU MD2 . . 5.500 4.531 4.214 4.754 . 0 0 "[ . 1 . 2]" 1
291 1 8 VAL MG1 1 18 LEU HG . . 3.830 3.430 3.178 3.713 . 0 0 "[ . 1 . 2]" 1
292 1 8 VAL MG1 1 52 PHE QD . . 4.630 4.013 3.742 4.238 . 0 0 "[ . 1 . 2]" 1
293 1 8 VAL MG1 1 52 PHE QE . . 4.190 2.586 2.372 2.797 . 0 0 "[ . 1 . 2]" 1
294 1 8 VAL MG1 1 52 PHE HZ . . 4.140 4.128 3.964 4.211 0.071 14 0 "[ . 1 . 2]" 1
295 1 8 VAL MG1 1 53 LEU MD1 . . 4.080 2.843 2.504 3.030 . 0 0 "[ . 1 . 2]" 1
296 1 8 VAL MG1 1 53 LEU MD2 . . 3.730 3.532 3.167 3.747 0.017 2 0 "[ . 1 . 2]" 1
297 1 8 VAL MG1 1 53 LEU HG . . 5.140 5.001 4.640 5.215 0.075 5 0 "[ . 1 . 2]" 1
298 1 8 VAL MG1 1 56 LEU QD . . 3.520 3.215 2.937 3.600 0.080 13 0 "[ . 1 . 2]" 1
299 1 8 VAL MG2 1 9 ASP H . . 4.080 3.987 3.917 4.059 . 0 0 "[ . 1 . 2]" 1
300 1 8 VAL MG2 1 11 ALA H . . 5.500 5.269 5.173 5.451 . 0 0 "[ . 1 . 2]" 1
301 1 8 VAL MG2 1 11 ALA MB . . 4.330 4.102 3.956 4.314 . 0 0 "[ . 1 . 2]" 1
302 1 8 VAL MG2 1 18 LEU HA . . 5.500 5.097 4.874 5.348 . 0 0 "[ . 1 . 2]" 1
303 1 8 VAL MG2 1 18 LEU MD1 . . 3.130 2.198 2.022 2.550 . 0 0 "[ . 1 . 2]" 1
304 1 8 VAL MG2 1 18 LEU MD2 . . 5.500 4.239 4.056 4.427 . 0 0 "[ . 1 . 2]" 1
305 1 8 VAL MG2 1 49 LEU MD2 . . 2.930 2.439 2.170 2.589 . 0 0 "[ . 1 . 2]" 1
306 1 8 VAL MG2 1 52 PHE QD . . 3.540 2.258 2.104 2.493 . 0 0 "[ . 1 . 2]" 1
307 1 8 VAL MG2 1 52 PHE QE . . 3.870 2.174 2.020 2.475 . 0 0 "[ . 1 . 2]" 1
308 1 8 VAL MG2 1 52 PHE HZ . . 4.120 4.193 4.078 4.212 0.092 8 0 "[ . 1 . 2]" 1
309 1 8 VAL MG2 1 53 LEU MD2 . . 3.460 2.117 1.924 2.328 . 0 0 "[ . 1 . 2]" 1
310 1 8 VAL MG2 1 53 LEU HG . . 4.340 4.084 3.845 4.366 0.026 20 0 "[ . 1 . 2]" 1
311 1 9 ASP H 1 9 ASP HB2 . . 2.800 2.364 2.097 2.658 . 0 0 "[ . 1 . 2]" 1
312 1 9 ASP H 1 9 ASP HB3 . . 3.200 2.615 2.278 2.971 . 0 0 "[ . 1 . 2]" 1
313 1 9 ASP H 1 10 GLU HG3 . . 5.500 5.531 5.296 5.569 0.069 2 0 "[ . 1 . 2]" 1
314 1 9 ASP HA 1 10 GLU HA . . 5.500 4.740 4.682 4.808 . 0 0 "[ . 1 . 2]" 1
315 1 9 ASP HA 1 12 LEU HB2 . . 3.710 2.844 2.508 3.036 . 0 0 "[ . 1 . 2]" 1
316 1 9 ASP HA 1 12 LEU HB3 . . 4.870 4.452 4.124 4.635 . 0 0 "[ . 1 . 2]" 1
317 1 9 ASP HA 1 12 LEU MD1 . . 3.240 2.665 2.372 3.067 . 0 0 "[ . 1 . 2]" 1
318 1 9 ASP HA 1 12 LEU HG . . 4.260 4.046 3.466 4.320 0.060 16 0 "[ . 1 . 2]" 1
319 1 9 ASP HB2 1 10 GLU H . . 3.950 3.719 3.474 3.928 . 0 0 "[ . 1 . 2]" 1
320 1 9 ASP HB2 1 12 LEU HB2 . . 5.500 5.355 5.030 5.556 0.056 12 0 "[ . 1 . 2]" 1
321 1 9 ASP HB3 1 10 GLU H . . 3.400 2.417 2.255 2.695 . 0 0 "[ . 1 . 2]" 1
322 1 9 ASP HB3 1 10 GLU HB3 . . 4.320 4.170 3.920 4.372 0.052 5 0 "[ . 1 . 2]" 1
323 1 9 ASP HB3 1 10 GLU HG2 . . 4.440 4.304 4.035 4.505 0.065 17 0 "[ . 1 . 2]" 1
324 1 9 ASP HB3 1 12 LEU H . . 5.500 5.539 5.391 5.567 0.067 14 0 "[ . 1 . 2]" 1
325 1 10 GLU H 1 10 GLU HG2 . . 3.530 2.091 1.991 2.219 . 0 0 "[ . 1 . 2]" 1
326 1 10 GLU H 1 10 GLU HG3 . . 4.920 3.349 3.150 3.480 . 0 0 "[ . 1 . 2]" 1
327 1 10 GLU H 1 11 ALA H . . 3.060 2.748 2.561 2.877 . 0 0 "[ . 1 . 2]" 1
328 1 10 GLU H 1 11 ALA MB . . 4.860 4.461 4.299 4.565 . 0 0 "[ . 1 . 2]" 1
329 1 10 GLU H 1 13 GLU HG3 . . 5.500 5.013 4.463 5.569 0.069 12 0 "[ . 1 . 2]" 1
330 1 10 GLU HA 1 10 GLU HB2 . . 2.910 2.439 2.395 2.498 . 0 0 "[ . 1 . 2]" 1
331 1 10 GLU HA 1 10 GLU HG2 . . 3.760 3.715 3.667 3.794 0.034 16 0 "[ . 1 . 2]" 1
332 1 10 GLU HA 1 12 LEU HB2 . . 5.270 5.127 4.868 5.290 0.020 1 0 "[ . 1 . 2]" 1
333 1 10 GLU HA 1 13 GLU QB . . 3.270 2.469 2.112 2.964 . 0 0 "[ . 1 . 2]" 1
334 1 10 GLU HA 1 13 GLU HG3 . . 3.660 2.878 2.442 3.341 . 0 0 "[ . 1 . 2]" 1
335 1 10 GLU HB2 1 11 ALA MB . . 5.100 5.063 4.916 5.172 0.072 14 0 "[ . 1 . 2]" 1
336 1 10 GLU HB2 1 14 GLN QE . . 3.780 3.050 2.030 3.452 . 0 0 "[ . 1 . 2]" 1
337 1 10 GLU HB3 1 11 ALA H . . 4.310 4.142 3.898 4.225 . 0 0 "[ . 1 . 2]" 1
338 1 10 GLU HB3 1 11 ALA MB . . 5.500 5.539 5.306 5.580 0.080 14 0 "[ . 1 . 2]" 1
339 1 10 GLU HB3 1 38 LEU HG . . 5.500 5.354 4.843 5.573 0.073 5 0 "[ . 1 . 2]" 1
340 1 10 GLU HG2 1 11 ALA H . . 3.690 2.727 2.383 2.924 . 0 0 "[ . 1 . 2]" 1
341 1 10 GLU HG2 1 14 GLN QE . . 5.340 5.201 4.556 5.408 0.068 4 0 "[ . 1 . 2]" 1
342 1 10 GLU HG2 1 38 LEU QD . . 4.880 3.213 2.899 3.570 . 0 0 "[ . 1 . 2]" 1
343 1 10 GLU HG3 1 11 ALA H . . 5.500 2.592 2.226 2.830 . 0 0 "[ . 1 . 2]" 1
344 1 10 GLU HG3 1 11 ALA HA . . 3.480 3.511 3.239 3.553 0.073 12 0 "[ . 1 . 2]" 1
345 1 10 GLU HG3 1 14 GLN QE . . 4.310 3.939 3.401 4.355 0.045 17 0 "[ . 1 . 2]" 1
346 1 10 GLU HG3 1 38 LEU QD . . 5.440 2.023 1.833 2.348 . 0 0 "[ . 1 . 2]" 1
347 1 11 ALA H 1 11 ALA MB . . 2.750 2.256 2.220 2.285 . 0 0 "[ . 1 . 2]" 1
348 1 11 ALA H 1 12 LEU H . . 3.180 2.577 2.424 2.723 . 0 0 "[ . 1 . 2]" 1
349 1 11 ALA H 1 12 LEU HB2 . . 5.150 4.615 4.341 4.898 . 0 0 "[ . 1 . 2]" 1
350 1 11 ALA H 1 12 LEU MD1 . . 5.500 5.188 4.871 5.458 . 0 0 "[ . 1 . 2]" 1
351 1 11 ALA H 1 12 LEU HG . . 5.070 4.691 4.448 4.945 . 0 0 "[ . 1 . 2]" 1
352 1 11 ALA H 1 14 GLN H . . 5.500 5.036 4.772 5.222 . 0 0 "[ . 1 . 2]" 1
353 1 11 ALA H 1 14 GLN QE . . 5.340 4.945 4.365 5.402 0.062 15 0 "[ . 1 . 2]" 1
354 1 11 ALA H 1 16 ILE HB . . 5.500 5.429 5.282 5.552 0.052 6 0 "[ . 1 . 2]" 1
355 1 11 ALA H 1 16 ILE MD . . 5.500 5.357 5.167 5.574 0.074 18 0 "[ . 1 . 2]" 1
356 1 11 ALA H 1 18 LEU HG . . 5.150 4.981 4.696 5.185 0.035 10 0 "[ . 1 . 2]" 1
357 1 11 ALA H 1 38 LEU QD . . 4.190 3.127 2.895 3.493 . 0 0 "[ . 1 . 2]" 1
358 1 11 ALA HA 1 14 GLN QB . . 3.940 3.422 2.309 4.022 0.082 10 0 "[ . 1 . 2]" 1
359 1 11 ALA HA 1 14 GLN QE . . 4.380 3.712 3.085 4.233 . 0 0 "[ . 1 . 2]" 1
360 1 11 ALA HA 1 14 GLN HG2 . . 4.910 3.817 2.454 4.981 0.071 2 0 "[ . 1 . 2]" 1
361 1 11 ALA HA 1 14 GLN QG . . 4.250 3.136 2.400 4.345 0.095 11 0 "[ . 1 . 2]" 1
362 1 11 ALA HA 1 14 GLN HG3 . . 4.910 3.721 2.585 4.987 0.077 20 0 "[ . 1 . 2]" 1
363 1 11 ALA HA 1 15 GLY H . . 5.380 5.031 4.564 5.230 . 0 0 "[ . 1 . 2]" 1
364 1 11 ALA HA 1 16 ILE HB . . 3.510 3.314 3.111 3.521 0.011 9 0 "[ . 1 . 2]" 1
365 1 11 ALA HA 1 16 ILE MD . . 3.430 2.907 2.674 3.206 . 0 0 "[ . 1 . 2]" 1
366 1 11 ALA HA 1 16 ILE MG . . 4.780 4.570 4.296 4.799 0.019 9 0 "[ . 1 . 2]" 1
367 1 11 ALA HA 1 38 LEU MD1 . . 4.170 2.959 2.086 4.267 0.097 5 0 "[ . 1 . 2]" 1
368 1 11 ALA HA 1 38 LEU QD . . 3.230 2.203 1.928 2.553 . 0 0 "[ . 1 . 2]" 1
369 1 11 ALA HA 1 38 LEU MD2 . . 4.170 2.912 1.930 4.252 0.082 2 0 "[ . 1 . 2]" 1
370 1 11 ALA HA 1 42 TRP HZ2 . . 4.240 3.330 3.032 3.486 . 0 0 "[ . 1 . 2]" 1
371 1 11 ALA MB 1 12 LEU H . . 3.240 2.552 2.423 2.654 . 0 0 "[ . 1 . 2]" 1
372 1 11 ALA MB 1 12 LEU HA . . 3.890 3.888 3.815 3.943 0.053 9 0 "[ . 1 . 2]" 1
373 1 11 ALA MB 1 12 LEU HB2 . . 4.680 4.510 4.359 4.696 0.016 15 0 "[ . 1 . 2]" 1
374 1 11 ALA MB 1 12 LEU HB3 . . 5.380 5.348 5.247 5.437 0.057 11 0 "[ . 1 . 2]" 1
375 1 11 ALA MB 1 12 LEU MD2 . . 4.200 4.119 3.956 4.260 0.060 2 0 "[ . 1 . 2]" 1
376 1 11 ALA MB 1 13 GLU H . . 5.300 4.454 4.371 4.549 . 0 0 "[ . 1 . 2]" 1
377 1 11 ALA MB 1 14 GLN H . . 4.700 4.562 4.381 4.689 . 0 0 "[ . 1 . 2]" 1
378 1 11 ALA MB 1 16 ILE H . . 4.390 3.817 3.586 4.090 . 0 0 "[ . 1 . 2]" 1
379 1 11 ALA MB 1 16 ILE HB . . 4.380 2.241 2.060 2.362 . 0 0 "[ . 1 . 2]" 1
380 1 11 ALA MB 1 16 ILE MD . . 3.850 3.172 2.934 3.361 . 0 0 "[ . 1 . 2]" 1
381 1 11 ALA MB 1 16 ILE MG . . 3.020 2.868 2.683 3.023 0.003 3 0 "[ . 1 . 2]" 1
382 1 11 ALA MB 1 18 LEU H . . 4.370 4.418 4.256 4.463 0.093 10 0 "[ . 1 . 2]" 1
383 1 11 ALA MB 1 18 LEU MD2 . . 3.630 2.706 2.480 2.895 . 0 0 "[ . 1 . 2]" 1
384 1 11 ALA MB 1 18 LEU HG . . 3.110 2.570 2.356 2.829 . 0 0 "[ . 1 . 2]" 1
385 1 11 ALA MB 1 38 LEU MD1 . . 4.940 3.427 2.130 4.522 . 0 0 "[ . 1 . 2]" 1
386 1 11 ALA MB 1 38 LEU QD . . 3.530 2.328 2.101 3.025 . 0 0 "[ . 1 . 2]" 1
387 1 11 ALA MB 1 38 LEU MD2 . . 4.940 2.619 2.124 3.447 . 0 0 "[ . 1 . 2]" 1
388 1 11 ALA MB 1 42 TRP HD1 . . 4.520 4.206 4.045 4.493 . 0 0 "[ . 1 . 2]" 1
389 1 11 ALA MB 1 42 TRP HE1 . . 4.270 2.173 1.999 2.381 . 0 0 "[ . 1 . 2]" 1
390 1 11 ALA MB 1 42 TRP HH2 . . 4.390 4.386 4.049 4.470 0.080 17 0 "[ . 1 . 2]" 1
391 1 11 ALA MB 1 42 TRP HZ2 . . 3.210 2.567 2.247 2.772 . 0 0 "[ . 1 . 2]" 1
392 1 12 LEU H 1 12 LEU HB2 . . 2.880 2.362 2.266 2.490 . 0 0 "[ . 1 . 2]" 1
393 1 12 LEU H 1 12 LEU HB3 . . 3.760 3.591 3.539 3.642 . 0 0 "[ . 1 . 2]" 1
394 1 12 LEU H 1 12 LEU MD1 . . 3.570 3.536 3.386 3.634 0.064 15 0 "[ . 1 . 2]" 1
395 1 12 LEU H 1 12 LEU MD2 . . 4.500 3.738 3.602 3.846 . 0 0 "[ . 1 . 2]" 1
396 1 12 LEU H 1 12 LEU HG . . 3.520 2.535 2.385 2.710 . 0 0 "[ . 1 . 2]" 1
397 1 12 LEU H 1 13 GLU H . . 4.420 2.673 2.598 2.771 . 0 0 "[ . 1 . 2]" 1
398 1 12 LEU H 1 13 GLU QB . . 4.530 4.541 4.106 4.611 0.081 11 0 "[ . 1 . 2]" 1
399 1 12 LEU H 1 16 ILE H . . 4.870 4.507 4.380 4.662 . 0 0 "[ . 1 . 2]" 1
400 1 12 LEU H 1 18 LEU MD2 . . 5.500 5.497 5.273 5.606 0.106 1 0 "[ . 1 . 2]" 1
401 1 12 LEU H 1 18 LEU HG . . 5.500 5.027 4.697 5.398 . 0 0 "[ . 1 . 2]" 1
402 1 12 LEU HA 1 12 LEU HB3 . . 2.990 2.593 2.552 2.634 . 0 0 "[ . 1 . 2]" 1
403 1 12 LEU HA 1 12 LEU MD2 . . 2.710 2.115 2.022 2.276 . 0 0 "[ . 1 . 2]" 1
404 1 12 LEU HA 1 12 LEU HG . . 3.570 2.855 2.727 3.025 . 0 0 "[ . 1 . 2]" 1
405 1 12 LEU HA 1 14 GLN H . . 5.500 3.904 3.718 4.067 . 0 0 "[ . 1 . 2]" 1
406 1 12 LEU HA 1 15 GLY H . . 3.370 3.146 2.915 3.387 0.017 20 0 "[ . 1 . 2]" 1
407 1 12 LEU HA 1 16 ILE H . . 3.320 2.749 2.455 3.058 . 0 0 "[ . 1 . 2]" 1
408 1 12 LEU HA 1 16 ILE HB . . 4.400 4.383 3.847 4.464 0.064 18 0 "[ . 1 . 2]" 1
409 1 12 LEU HA 1 16 ILE MD . . 5.210 5.049 4.828 5.250 0.040 17 0 "[ . 1 . 2]" 1
410 1 12 LEU HB2 1 12 LEU MD1 . . 2.960 2.283 2.245 2.326 . 0 0 "[ . 1 . 2]" 1
411 1 12 LEU HB2 1 13 GLU H . . 3.330 2.907 2.769 3.045 . 0 0 "[ . 1 . 2]" 1
412 1 12 LEU HB2 1 13 GLU QB . . 4.800 4.819 4.366 4.886 0.086 10 0 "[ . 1 . 2]" 1
413 1 12 LEU HB2 1 14 GLN H . . 5.480 5.063 4.892 5.215 . 0 0 "[ . 1 . 2]" 1
414 1 12 LEU HB2 1 15 GLY H . . 5.360 5.286 5.081 5.413 0.053 20 0 "[ . 1 . 2]" 1
415 1 12 LEU HB3 1 12 LEU MD1 . . 3.290 2.472 2.390 2.572 . 0 0 "[ . 1 . 2]" 1
416 1 12 LEU HB3 1 12 LEU MD2 . . 3.430 2.351 2.177 2.412 . 0 0 "[ . 1 . 2]" 1
417 1 12 LEU HB3 1 13 GLU H . . 3.830 3.721 3.523 3.832 0.002 14 0 "[ . 1 . 2]" 1
418 1 12 LEU HB3 1 13 GLU HA . . 5.500 4.405 4.201 4.564 . 0 0 "[ . 1 . 2]" 1
419 1 12 LEU HB3 1 14 GLN H . . 5.400 5.297 5.117 5.444 0.044 14 0 "[ . 1 . 2]" 1
420 1 12 LEU MD2 1 14 GLN H . . 5.500 5.525 5.384 5.584 0.084 11 0 "[ . 1 . 2]" 1
421 1 12 LEU MD2 1 15 GLY HA2 . . 5.410 4.292 3.874 4.808 . 0 0 "[ . 1 . 2]" 1
422 1 12 LEU MD2 1 16 ILE H . . 4.610 3.947 3.630 4.224 . 0 0 "[ . 1 . 2]" 1
423 1 12 LEU MD2 1 17 THR H . . 4.360 3.952 3.791 4.167 . 0 0 "[ . 1 . 2]" 1
424 1 12 LEU MD2 1 17 THR HA . . 3.230 2.179 1.955 2.389 . 0 0 "[ . 1 . 2]" 1
425 1 12 LEU MD2 1 17 THR HB . . 4.270 4.219 4.004 4.357 0.087 10 0 "[ . 1 . 2]" 1
426 1 12 LEU HG 1 13 GLU H . . 4.780 4.664 4.488 4.788 0.008 2 0 "[ . 1 . 2]" 1
427 1 12 LEU HG 1 16 ILE H . . 5.500 5.158 4.865 5.463 . 0 0 "[ . 1 . 2]" 1
428 1 12 LEU HG 1 17 THR HA . . 5.400 3.606 3.222 4.008 . 0 0 "[ . 1 . 2]" 1
429 1 12 LEU HG 1 18 LEU H . . 4.270 4.061 3.612 4.322 0.052 10 0 "[ . 1 . 2]" 1
430 1 13 GLU H 1 13 GLU QB . . 2.550 2.258 1.935 2.356 . 0 0 "[ . 1 . 2]" 1
431 1 13 GLU H 1 13 GLU HG2 . . 3.510 3.239 2.565 3.579 0.069 6 0 "[ . 1 . 2]" 1
432 1 13 GLU H 1 14 GLN H . . 3.090 2.640 2.414 2.841 . 0 0 "[ . 1 . 2]" 1
433 1 13 GLU H 1 14 GLN QG . . 5.340 4.204 3.870 5.291 . 0 0 "[ . 1 . 2]" 1
434 1 13 GLU H 1 15 GLY H . . 5.500 3.903 3.685 4.076 . 0 0 "[ . 1 . 2]" 1
435 1 13 GLU H 1 16 ILE MD . . 5.500 5.551 5.436 5.599 0.099 6 0 "[ . 1 . 2]" 1
436 1 13 GLU HA 1 13 GLU HG2 . . 2.990 2.504 2.187 2.942 . 0 0 "[ . 1 . 2]" 1
437 1 13 GLU HA 1 13 GLU HG3 . . 4.070 3.382 2.975 3.773 . 0 0 "[ . 1 . 2]" 1
438 1 13 GLU HA 1 14 GLN H . . 3.520 3.497 3.378 3.569 0.049 11 0 "[ . 1 . 2]" 1
439 1 13 GLU QB 1 14 GLN H . . 3.100 2.866 2.549 3.160 0.060 15 0 "[ . 1 . 2]" 1
440 1 13 GLU QB 1 14 GLN HA . . 4.860 4.040 3.834 4.237 . 0 0 "[ . 1 . 2]" 1
441 1 13 GLU QB 1 15 GLY H . . 4.770 4.468 4.325 4.666 . 0 0 "[ . 1 . 2]" 1
442 1 13 GLU HG2 1 14 GLN H . . 5.500 4.965 4.636 5.225 . 0 0 "[ . 1 . 2]" 1
443 1 13 GLU HG3 1 14 GLN H . . 5.360 4.950 4.527 5.420 0.060 7 0 "[ . 1 . 2]" 1
444 1 14 GLN H 1 14 GLN QB . . 3.050 2.597 2.161 2.966 . 0 0 "[ . 1 . 2]" 1
445 1 14 GLN H 1 14 GLN QG . . 3.110 2.421 2.025 3.198 0.088 20 0 "[ . 1 . 2]" 1
446 1 14 GLN H 1 15 GLY H . . 3.120 2.323 2.115 2.512 . 0 0 "[ . 1 . 2]" 1
447 1 14 GLN H 1 15 GLY HA3 . . 5.140 5.046 4.843 5.184 0.044 6 0 "[ . 1 . 2]" 1
448 1 14 GLN H 1 16 ILE H . . 3.950 3.402 3.068 3.696 . 0 0 "[ . 1 . 2]" 1
449 1 14 GLN H 1 16 ILE MD . . 4.290 3.778 3.628 3.997 . 0 0 "[ . 1 . 2]" 1
450 1 14 GLN H 1 38 LEU QD . . 4.400 4.286 3.909 4.493 0.093 2 0 "[ . 1 . 2]" 1
451 1 14 GLN HA 1 14 GLN HG2 . . 4.160 3.177 2.463 3.700 . 0 0 "[ . 1 . 2]" 1
452 1 14 GLN HA 1 14 GLN QG . . 3.600 2.883 2.043 3.438 . 0 0 "[ . 1 . 2]" 1
453 1 14 GLN HA 1 14 GLN HG3 . . 4.160 3.467 2.065 4.098 . 0 0 "[ . 1 . 2]" 1
454 1 14 GLN HA 1 16 ILE MD . . 4.860 4.342 3.944 4.554 . 0 0 "[ . 1 . 2]" 1
455 1 14 GLN QB 1 15 GLY H . . 4.000 3.333 2.757 3.666 . 0 0 "[ . 1 . 2]" 1
456 1 14 GLN QB 1 16 ILE HB . . 4.950 3.798 3.484 4.222 . 0 0 "[ . 1 . 2]" 1
457 1 14 GLN QB 1 16 ILE MD . . 3.430 1.948 1.868 2.122 . 0 0 "[ . 1 . 2]" 1
458 1 14 GLN QB 1 35 PRO HG3 . . 3.710 3.505 2.695 3.806 0.096 5 0 "[ . 1 . 2]" 1
459 1 14 GLN QB 1 38 LEU QD . . 4.600 3.480 2.666 3.935 . 0 0 "[ . 1 . 2]" 1
460 1 14 GLN QB 1 42 TRP HH2 . . 5.480 5.364 5.043 5.497 0.017 2 0 "[ . 1 . 2]" 1
461 1 14 GLN QE 1 35 PRO HG2 . . 4.790 3.916 2.789 4.874 0.084 12 0 "[ . 1 . 2]" 1
462 1 14 GLN QE 1 38 LEU QB . . 5.180 3.593 2.210 5.110 . 0 0 "[ . 1 . 2]" 1
463 1 14 GLN QE 1 38 LEU QD . . 3.720 2.128 1.642 2.685 . 0 0 "[ . 1 . 2]" 1
464 1 14 GLN HE21 1 16 ILE MD . . 5.500 4.697 4.015 5.158 . 0 0 "[ . 1 . 2]" 1
465 1 14 GLN HE21 1 38 LEU MD1 . . 5.500 2.725 1.698 3.927 . 0 0 "[ . 1 . 2]" 1
466 1 14 GLN HE21 1 38 LEU MD2 . . 5.500 4.077 1.805 5.552 0.052 19 0 "[ . 1 . 2]" 1
467 1 14 GLN HE22 1 16 ILE MD . . 5.500 5.079 4.106 5.587 0.087 9 0 "[ . 1 . 2]" 1
468 1 14 GLN HE22 1 38 LEU MD1 . . 5.500 2.683 1.778 4.340 . 0 0 "[ . 1 . 2]" 1
469 1 14 GLN HE22 1 38 LEU MD2 . . 5.500 4.239 1.905 5.593 0.093 14 0 "[ . 1 . 2]" 1
470 1 14 GLN QG 1 15 GLY H . . 4.410 4.176 3.872 4.480 0.070 5 0 "[ . 1 . 2]" 1
471 1 14 GLN QG 1 16 ILE MD . . 4.050 2.973 2.161 3.793 . 0 0 "[ . 1 . 2]" 1
472 1 14 GLN QG 1 35 PRO HG3 . . 3.340 2.817 2.140 3.431 0.091 1 0 "[ . 1 . 2]" 1
473 1 14 GLN QG 1 38 LEU QB . . 4.760 4.317 3.473 4.876 0.116 4 0 "[ . 1 . 2]" 1
474 1 14 GLN QG 1 38 LEU QD . . 3.550 2.748 1.996 3.607 0.057 2 0 "[ . 1 . 2]" 1
475 1 14 GLN HG2 1 16 ILE MD . . 4.800 3.435 2.578 4.725 . 0 0 "[ . 1 . 2]" 1
476 1 14 GLN HG3 1 16 ILE MD . . 4.800 3.325 2.321 4.380 . 0 0 "[ . 1 . 2]" 1
477 1 15 GLY H 1 16 ILE H . . 3.130 2.362 1.978 2.695 . 0 0 "[ . 1 . 2]" 1
478 1 15 GLY H 1 16 ILE HB . . 4.950 4.771 4.350 5.014 0.064 20 0 "[ . 1 . 2]" 1
479 1 15 GLY H 1 16 ILE MD . . 4.140 4.157 3.819 4.233 0.093 8 0 "[ . 1 . 2]" 1
480 1 15 GLY HA2 1 16 ILE HA . . 4.520 4.553 4.482 4.588 0.068 17 0 "[ . 1 . 2]" 1
481 1 15 GLY HA3 1 29 THR HB . . 5.340 5.267 4.764 5.411 0.071 2 0 "[ . 1 . 2]" 1
482 1 16 ILE H 1 16 ILE HB . . 3.580 2.621 2.500 2.718 . 0 0 "[ . 1 . 2]" 1
483 1 16 ILE H 1 16 ILE MD . . 3.650 3.033 2.711 3.353 . 0 0 "[ . 1 . 2]" 1
484 1 16 ILE H 1 16 ILE HG12 . . 4.530 4.232 3.938 4.511 . 0 0 "[ . 1 . 2]" 1
485 1 16 ILE H 1 16 ILE HG13 . . 4.000 2.919 2.537 3.460 . 0 0 "[ . 1 . 2]" 1
486 1 16 ILE H 1 16 ILE MG . . 4.720 3.850 3.791 3.887 . 0 0 "[ . 1 . 2]" 1
487 1 16 ILE HA 1 16 ILE MD . . 3.990 3.891 3.681 3.965 . 0 0 "[ . 1 . 2]" 1
488 1 16 ILE HA 1 16 ILE HG13 . . 3.950 2.712 2.441 2.840 . 0 0 "[ . 1 . 2]" 1
489 1 16 ILE HA 1 17 THR H . . 3.090 2.073 2.017 2.140 . 0 0 "[ . 1 . 2]" 1
490 1 16 ILE HA 1 17 THR HB . . 5.500 4.121 4.013 4.338 . 0 0 "[ . 1 . 2]" 1
491 1 16 ILE HA 1 29 THR HB . . 3.210 2.011 1.947 2.116 . 0 0 "[ . 1 . 2]" 1
492 1 16 ILE HA 1 29 THR MG . . 4.570 3.622 3.495 3.737 . 0 0 "[ . 1 . 2]" 1
493 1 16 ILE HB 1 16 ILE MD . . 3.020 2.169 2.118 2.260 . 0 0 "[ . 1 . 2]" 1
494 1 16 ILE HB 1 17 THR H . . 4.340 4.250 4.170 4.348 0.008 5 0 "[ . 1 . 2]" 1
495 1 16 ILE HB 1 18 LEU MD2 . . 3.820 3.722 3.575 3.883 0.063 2 0 "[ . 1 . 2]" 1
496 1 16 ILE HB 1 18 LEU HG . . 5.100 5.032 4.717 5.159 0.059 11 0 "[ . 1 . 2]" 1
497 1 16 ILE HB 1 29 THR HB . . 4.830 4.232 4.075 4.375 . 0 0 "[ . 1 . 2]" 1
498 1 16 ILE HB 1 34 ILE MD . . 5.320 5.086 4.948 5.270 . 0 0 "[ . 1 . 2]" 1
499 1 16 ILE HB 1 38 LEU QD . . 5.440 4.023 3.794 4.304 . 0 0 "[ . 1 . 2]" 1
500 1 16 ILE HB 1 42 TRP HH2 . . 4.360 3.836 3.347 3.968 . 0 0 "[ . 1 . 2]" 1
501 1 16 ILE HB 1 42 TRP HZ2 . . 4.720 3.039 2.856 3.272 . 0 0 "[ . 1 . 2]" 1
502 1 16 ILE MD 1 16 ILE MG . . 2.890 2.652 2.462 2.959 0.069 15 0 "[ . 1 . 2]" 1
503 1 16 ILE MD 1 18 LEU MD2 . . 4.510 4.468 4.330 4.578 0.068 4 0 "[ . 1 . 2]" 1
504 1 16 ILE MD 1 27 TYR HB2 . . 5.500 5.361 5.118 5.557 0.057 15 0 "[ . 1 . 2]" 1
505 1 16 ILE MD 1 29 THR HB . . 5.200 4.157 3.835 4.370 . 0 0 "[ . 1 . 2]" 1
506 1 16 ILE MD 1 29 THR MG . . 3.640 3.555 3.196 3.715 0.075 9 0 "[ . 1 . 2]" 1
507 1 16 ILE MD 1 31 ARG QD . . 4.440 2.979 2.209 3.999 . 0 0 "[ . 1 . 2]" 1
508 1 16 ILE MD 1 34 ILE HA . . 4.390 3.863 3.409 4.446 0.056 19 0 "[ . 1 . 2]" 1
509 1 16 ILE MD 1 34 ILE MD . . 3.020 3.083 2.917 3.143 0.123 15 0 "[ . 1 . 2]" 1
510 1 16 ILE MD 1 34 ILE HG12 . . 3.540 2.452 2.313 2.701 . 0 0 "[ . 1 . 2]" 1
511 1 16 ILE MD 1 34 ILE HG13 . . 3.890 3.863 3.292 3.972 0.082 9 0 "[ . 1 . 2]" 1
512 1 16 ILE MD 1 34 ILE MG . . 3.710 2.914 2.128 3.607 . 0 0 "[ . 1 . 2]" 1
513 1 16 ILE MD 1 35 PRO HD2 . . 3.950 2.768 2.516 3.249 . 0 0 "[ . 1 . 2]" 1
514 1 16 ILE MD 1 35 PRO HD3 . . 3.950 3.874 3.334 4.051 0.101 19 0 "[ . 1 . 2]" 1
515 1 16 ILE MD 1 35 PRO HG3 . . 3.890 3.844 3.289 3.995 0.105 6 0 "[ . 1 . 2]" 1
516 1 16 ILE MD 1 38 LEU QD . . 2.880 2.861 2.460 3.073 0.193 1 0 "[ . 1 . 2]" 1
517 1 16 ILE MD 1 42 TRP HH2 . . 3.540 2.177 1.985 2.327 . 0 0 "[ . 1 . 2]" 1
518 1 16 ILE MD 1 42 TRP HZ2 . . 3.650 2.247 2.084 2.422 . 0 0 "[ . 1 . 2]" 1
519 1 16 ILE MD 1 42 TRP HZ3 . . 4.360 4.393 4.216 4.438 0.078 19 0 "[ . 1 . 2]" 1
520 1 16 ILE HG12 1 29 THR HA . . 5.500 5.079 4.721 5.551 0.051 18 0 "[ . 1 . 2]" 1
521 1 16 ILE HG12 1 29 THR HB . . 5.500 2.731 2.434 3.202 . 0 0 "[ . 1 . 2]" 1
522 1 16 ILE HG12 1 29 THR MG . . 3.100 2.252 2.119 2.694 . 0 0 "[ . 1 . 2]" 1
523 1 16 ILE HG12 1 31 ARG QD . . 5.340 3.838 2.587 5.097 . 0 0 "[ . 1 . 2]" 1
524 1 16 ILE HG12 1 34 ILE MD . . 2.880 2.706 2.345 2.829 . 0 0 "[ . 1 . 2]" 1
525 1 16 ILE HG12 1 34 ILE HG12 . . 3.840 3.312 2.827 3.873 0.033 19 0 "[ . 1 . 2]" 1
526 1 16 ILE HG12 1 34 ILE MG . . 5.120 4.108 3.395 4.882 . 0 0 "[ . 1 . 2]" 1
527 1 16 ILE HG13 1 17 THR H . . 4.790 4.759 4.426 4.849 0.059 2 0 "[ . 1 . 2]" 1
528 1 16 ILE HG13 1 29 THR HB . . 4.210 2.879 2.087 3.192 . 0 0 "[ . 1 . 2]" 1
529 1 16 ILE HG13 1 29 THR MG . . 3.590 3.128 2.323 3.427 . 0 0 "[ . 1 . 2]" 1
530 1 16 ILE HG13 1 31 ARG QD . . 4.840 3.092 2.267 4.398 . 0 0 "[ . 1 . 2]" 1
531 1 16 ILE HG13 1 34 ILE MD . . 3.830 3.832 3.563 3.909 0.079 14 0 "[ . 1 . 2]" 1
532 1 16 ILE MG 1 17 THR H . . 3.130 2.829 2.637 3.114 . 0 0 "[ . 1 . 2]" 1
533 1 16 ILE MG 1 17 THR HA . . 4.100 4.097 3.858 4.167 0.067 17 0 "[ . 1 . 2]" 1
534 1 16 ILE MG 1 17 THR HB . . 5.150 4.318 4.054 4.668 . 0 0 "[ . 1 . 2]" 1
535 1 16 ILE MG 1 18 LEU H . . 4.560 4.516 4.142 4.631 0.071 2 0 "[ . 1 . 2]" 1
536 1 16 ILE MG 1 18 LEU HA . . 5.500 4.083 3.883 4.204 . 0 0 "[ . 1 . 2]" 1
537 1 16 ILE MG 1 18 LEU HB2 . . 5.330 5.290 4.986 5.399 0.069 19 0 "[ . 1 . 2]" 1
538 1 16 ILE MG 1 18 LEU MD1 . . 4.750 4.372 4.074 4.514 . 0 0 "[ . 1 . 2]" 1
539 1 16 ILE MG 1 18 LEU MD2 . . 2.840 2.180 1.961 2.317 . 0 0 "[ . 1 . 2]" 1
540 1 16 ILE MG 1 18 LEU HG . . 4.320 4.013 3.600 4.262 . 0 0 "[ . 1 . 2]" 1
541 1 16 ILE MG 1 27 TYR HA . . 3.950 3.940 3.805 4.059 0.109 1 0 "[ . 1 . 2]" 1
542 1 16 ILE MG 1 27 TYR HB2 . . 3.160 2.204 2.027 2.326 . 0 0 "[ . 1 . 2]" 1
543 1 16 ILE MG 1 27 TYR HB3 . . 3.470 3.311 3.014 3.539 0.069 16 0 "[ . 1 . 2]" 1
544 1 16 ILE MG 1 27 TYR QD . . 3.380 2.369 2.161 2.622 . 0 0 "[ . 1 . 2]" 1
545 1 16 ILE MG 1 27 TYR QE . . 4.210 3.807 3.505 4.030 . 0 0 "[ . 1 . 2]" 1
546 1 16 ILE MG 1 28 GLU H . . 3.700 3.089 2.807 3.538 . 0 0 "[ . 1 . 2]" 1
547 1 16 ILE MG 1 28 GLU QB . . 5.500 4.725 4.574 5.121 . 0 0 "[ . 1 . 2]" 1
548 1 16 ILE MG 1 29 THR H . . 4.730 4.453 4.321 4.619 . 0 0 "[ . 1 . 2]" 1
549 1 16 ILE MG 1 29 THR HB . . 3.400 2.338 2.139 2.993 . 0 0 "[ . 1 . 2]" 1
550 1 16 ILE MG 1 29 THR MG . . 3.290 2.781 2.503 3.109 . 0 0 "[ . 1 . 2]" 1
551 1 16 ILE MG 1 42 TRP HH2 . . 3.000 2.265 2.137 2.557 . 0 0 "[ . 1 . 2]" 1
552 1 16 ILE MG 1 42 TRP HZ2 . . 3.710 2.890 2.645 3.159 . 0 0 "[ . 1 . 2]" 1
553 1 16 ILE MG 1 42 TRP HZ3 . . 3.790 3.502 3.221 3.694 . 0 0 "[ . 1 . 2]" 1
554 1 17 THR H 1 17 THR HB . . 3.320 2.118 2.022 2.294 . 0 0 "[ . 1 . 2]" 1
555 1 17 THR H 1 17 THR MG . . 3.650 3.537 3.406 3.619 . 0 0 "[ . 1 . 2]" 1
556 1 17 THR H 1 18 LEU H . . 4.650 4.542 4.435 4.593 . 0 0 "[ . 1 . 2]" 1
557 1 17 THR H 1 27 TYR HA . . 4.880 4.884 4.737 4.936 0.056 5 0 "[ . 1 . 2]" 1
558 1 17 THR H 1 27 TYR HB2 . . 4.600 4.214 3.943 4.463 . 0 0 "[ . 1 . 2]" 1
559 1 17 THR H 1 28 GLU H . . 3.360 2.992 2.807 3.087 . 0 0 "[ . 1 . 2]" 1
560 1 17 THR H 1 28 GLU QB . . 4.640 3.905 3.398 4.238 . 0 0 "[ . 1 . 2]" 1
561 1 17 THR H 1 28 GLU QG . . 4.580 4.469 4.182 4.648 0.068 10 0 "[ . 1 . 2]" 1
562 1 17 THR H 1 29 THR HB . . 5.130 3.337 3.158 3.631 . 0 0 "[ . 1 . 2]" 1
563 1 17 THR H 1 29 THR MG . . 4.690 4.664 4.523 4.780 0.090 7 0 "[ . 1 . 2]" 1
564 1 17 THR HA 1 17 THR MG . . 2.970 2.643 2.528 2.772 . 0 0 "[ . 1 . 2]" 1
565 1 17 THR HA 1 18 LEU H . . 2.970 2.217 2.131 2.341 . 0 0 "[ . 1 . 2]" 1
566 1 17 THR HA 1 18 LEU HB2 . . 4.990 4.520 4.374 4.733 . 0 0 "[ . 1 . 2]" 1
567 1 17 THR HA 1 18 LEU MD2 . . 4.060 3.938 3.718 4.127 0.067 2 0 "[ . 1 . 2]" 1
568 1 17 THR HA 1 27 TYR HA . . 5.500 5.547 5.432 5.573 0.073 3 0 "[ . 1 . 2]" 1
569 1 17 THR HB 1 18 LEU H . . 4.630 4.375 4.214 4.490 . 0 0 "[ . 1 . 2]" 1
570 1 17 THR HB 1 28 GLU H . . 3.680 3.062 2.716 3.410 . 0 0 "[ . 1 . 2]" 1
571 1 17 THR HB 1 28 GLU HA . . 5.500 4.945 4.626 5.270 . 0 0 "[ . 1 . 2]" 1
572 1 17 THR HB 1 28 GLU QB . . 3.890 2.733 2.283 3.341 . 0 0 "[ . 1 . 2]" 1
573 1 17 THR HB 1 28 GLU QG . . 3.710 3.683 3.492 3.787 0.077 14 0 "[ . 1 . 2]" 1
574 1 17 THR HB 1 29 THR HA . . 5.500 4.729 4.425 5.182 . 0 0 "[ . 1 . 2]" 1
575 1 17 THR MG 1 18 LEU H . . 2.940 2.748 2.472 2.893 . 0 0 "[ . 1 . 2]" 1
576 1 17 THR MG 1 18 LEU HA . . 4.410 3.663 3.554 3.734 . 0 0 "[ . 1 . 2]" 1
577 1 17 THR MG 1 18 LEU MD2 . . 4.130 4.256 4.151 4.269 0.139 3 0 "[ . 1 . 2]" 1
578 1 17 THR MG 1 19 PHE H . . 4.660 4.423 4.321 4.514 . 0 0 "[ . 1 . 2]" 1
579 1 17 THR MG 1 19 PHE HB2 . . 4.620 4.662 4.490 4.704 0.084 19 0 "[ . 1 . 2]" 1
580 1 17 THR MG 1 19 PHE HB3 . . 3.990 3.321 3.112 3.421 . 0 0 "[ . 1 . 2]" 1
581 1 17 THR MG 1 19 PHE QD . . 3.420 2.156 1.966 2.432 . 0 0 "[ . 1 . 2]" 1
582 1 17 THR MG 1 27 TYR HB3 . . 5.500 5.449 5.237 5.581 0.081 16 0 "[ . 1 . 2]" 1
583 1 17 THR MG 1 28 GLU H . . 4.110 3.352 3.106 3.692 . 0 0 "[ . 1 . 2]" 1
584 1 17 THR MG 1 28 GLU HA . . 5.430 5.275 5.069 5.490 0.060 5 0 "[ . 1 . 2]" 1
585 1 17 THR MG 1 28 GLU QB . . 3.570 2.934 2.727 3.074 . 0 0 "[ . 1 . 2]" 1
586 1 17 THR MG 1 28 GLU QG . . 4.040 4.122 4.000 4.169 0.129 1 0 "[ . 1 . 2]" 1
587 1 18 LEU H 1 18 LEU HB2 . . 3.140 2.455 2.333 2.541 . 0 0 "[ . 1 . 2]" 1
588 1 18 LEU H 1 18 LEU HB3 . . 3.610 3.628 3.551 3.674 0.064 18 0 "[ . 1 . 2]" 1
589 1 18 LEU H 1 18 LEU MD1 . . 4.530 4.428 4.302 4.503 . 0 0 "[ . 1 . 2]" 1
590 1 18 LEU H 1 18 LEU MD2 . . 4.380 3.215 3.020 3.420 . 0 0 "[ . 1 . 2]" 1
591 1 18 LEU H 1 18 LEU HG . . 4.070 3.399 3.135 3.533 . 0 0 "[ . 1 . 2]" 1
592 1 18 LEU H 1 19 PHE H . . 4.780 4.506 4.462 4.567 . 0 0 "[ . 1 . 2]" 1
593 1 18 LEU H 1 27 TYR HA . . 5.340 4.948 4.696 5.098 . 0 0 "[ . 1 . 2]" 1
594 1 18 LEU H 1 53 LEU HG . . 5.500 5.467 5.313 5.563 0.063 3 0 "[ . 1 . 2]" 1
595 1 18 LEU HA 1 18 LEU MD2 . . 3.020 2.032 1.861 2.084 . 0 0 "[ . 1 . 2]" 1
596 1 18 LEU HA 1 27 TYR HA . . 3.290 2.683 2.428 2.908 . 0 0 "[ . 1 . 2]" 1
597 1 18 LEU HA 1 27 TYR HB2 . . 4.610 3.552 3.333 3.900 . 0 0 "[ . 1 . 2]" 1
598 1 18 LEU HB2 1 18 LEU MD2 . . 3.200 3.154 3.100 3.214 0.014 19 0 "[ . 1 . 2]" 1
599 1 18 LEU HB2 1 19 PHE H . . 4.070 4.014 3.810 4.124 0.054 8 0 "[ . 1 . 2]" 1
600 1 18 LEU HB2 1 25 LEU QD . . 4.820 4.666 4.295 4.920 0.100 13 0 "[ . 1 . 2]" 1
601 1 18 LEU HB2 1 53 LEU MD1 . . 3.550 2.614 2.309 2.971 . 0 0 "[ . 1 . 2]" 1
602 1 18 LEU HB2 1 53 LEU HG . . 4.090 3.889 3.643 4.120 0.030 3 0 "[ . 1 . 2]" 1
603 1 18 LEU HB3 1 18 LEU MD1 . . 2.770 2.106 2.006 2.139 . 0 0 "[ . 1 . 2]" 1
604 1 18 LEU HB3 1 18 LEU MD2 . . 2.840 2.818 2.712 2.912 0.072 3 0 "[ . 1 . 2]" 1
605 1 18 LEU HB3 1 19 PHE H . . 3.280 2.820 2.578 2.949 . 0 0 "[ . 1 . 2]" 1
606 1 18 LEU HB3 1 20 VAL QG . . 5.440 4.788 4.594 4.941 . 0 0 "[ . 1 . 2]" 1
607 1 18 LEU HB3 1 25 LEU MD1 . . 5.270 4.508 2.935 5.041 . 0 0 "[ . 1 . 2]" 1
608 1 18 LEU HB3 1 25 LEU QD . . 3.930 3.359 2.909 3.721 . 0 0 "[ . 1 . 2]" 1
609 1 18 LEU HB3 1 25 LEU MD2 . . 5.270 3.710 3.113 4.803 . 0 0 "[ . 1 . 2]" 1
610 1 18 LEU HB3 1 25 LEU HG . . 5.500 4.979 4.427 5.566 0.066 18 0 "[ . 1 . 2]" 1
611 1 18 LEU HB3 1 27 TYR HB3 . . 5.170 4.793 4.620 4.993 . 0 0 "[ . 1 . 2]" 1
612 1 18 LEU HB3 1 53 LEU HB2 . . 5.500 5.205 4.967 5.312 . 0 0 "[ . 1 . 2]" 1
613 1 18 LEU HB3 1 53 LEU HG . . 4.090 2.979 2.778 3.071 . 0 0 "[ . 1 . 2]" 1
614 1 18 LEU MD1 1 19 PHE H . . 3.920 3.971 3.812 4.013 0.093 19 0 "[ . 1 . 2]" 1
615 1 18 LEU MD1 1 25 LEU MD1 . . 4.210 3.065 2.282 3.453 . 0 0 "[ . 1 . 2]" 1
616 1 18 LEU MD1 1 25 LEU QD . . 3.390 2.348 2.029 2.692 . 0 0 "[ . 1 . 2]" 1
617 1 18 LEU MD1 1 25 LEU MD2 . . 4.210 2.546 2.078 3.347 . 0 0 "[ . 1 . 2]" 1
618 1 18 LEU MD1 1 42 TRP HA . . 5.500 4.080 3.837 4.294 . 0 0 "[ . 1 . 2]" 1
619 1 18 LEU MD1 1 42 TRP HD1 . . 4.300 3.079 2.886 3.607 . 0 0 "[ . 1 . 2]" 1
620 1 18 LEU MD1 1 42 TRP HZ2 . . 5.500 4.857 4.501 5.147 . 0 0 "[ . 1 . 2]" 1
621 1 18 LEU MD1 1 49 LEU HB2 . . 4.290 4.291 4.113 4.380 0.090 2 0 "[ . 1 . 2]" 1
622 1 18 LEU MD1 1 49 LEU MD1 . . 3.040 2.717 2.133 2.935 . 0 0 "[ . 1 . 2]" 1
623 1 18 LEU MD1 1 49 LEU MD2 . . 3.100 2.128 2.029 2.390 . 0 0 "[ . 1 . 2]" 1
624 1 18 LEU MD1 1 53 LEU MD2 . . 4.250 2.570 2.368 2.879 . 0 0 "[ . 1 . 2]" 1
625 1 18 LEU MD1 1 53 LEU HG . . 4.040 4.090 3.912 4.129 0.089 13 0 "[ . 1 . 2]" 1
626 1 18 LEU MD2 1 19 PHE H . . 3.490 3.508 3.259 3.572 0.082 11 0 "[ . 1 . 2]" 1
627 1 18 LEU MD2 1 25 LEU MD1 . . 4.490 4.267 3.012 4.580 0.090 11 0 "[ . 1 . 2]" 1
628 1 18 LEU MD2 1 25 LEU QD . . 3.130 2.960 2.738 3.233 0.103 18 0 "[ . 1 . 2]" 1
629 1 18 LEU MD2 1 25 LEU MD2 . . 4.490 3.178 2.769 4.456 . 0 0 "[ . 1 . 2]" 1
630 1 18 LEU MD2 1 26 GLN H . . 5.490 5.223 4.929 5.543 0.053 17 0 "[ . 1 . 2]" 1
631 1 18 LEU MD2 1 27 TYR HA . . 3.470 3.174 3.023 3.303 . 0 0 "[ . 1 . 2]" 1
632 1 18 LEU MD2 1 27 TYR HB2 . . 3.320 2.505 2.318 2.734 . 0 0 "[ . 1 . 2]" 1
633 1 18 LEU MD2 1 27 TYR HB3 . . 3.120 2.045 1.934 2.152 . 0 0 "[ . 1 . 2]" 1
634 1 18 LEU MD2 1 27 TYR QD . . 3.710 3.506 3.251 3.645 . 0 0 "[ . 1 . 2]" 1
635 1 18 LEU MD2 1 27 TYR QE . . 5.140 5.018 4.852 5.176 0.036 14 0 "[ . 1 . 2]" 1
636 1 18 LEU MD2 1 42 TRP HB3 . . 4.200 4.244 4.055 4.365 0.165 1 0 "[ . 1 . 2]" 1
637 1 18 LEU MD2 1 42 TRP HE1 . . 5.340 3.500 3.004 4.014 . 0 0 "[ . 1 . 2]" 1
638 1 18 LEU MD2 1 42 TRP HZ2 . . 4.120 3.605 3.129 3.881 . 0 0 "[ . 1 . 2]" 1
639 1 18 LEU MD2 1 42 TRP HZ3 . . 4.580 4.630 4.433 4.673 0.093 18 0 "[ . 1 . 2]" 1
640 1 18 LEU MD2 1 49 LEU MD1 . . 5.500 4.373 3.903 4.613 . 0 0 "[ . 1 . 2]" 1
641 1 18 LEU MD2 1 53 LEU HG . . 5.260 5.178 4.951 5.294 0.034 3 0 "[ . 1 . 2]" 1
642 1 18 LEU HG 1 42 TRP HE1 . . 5.170 4.346 3.909 4.996 . 0 0 "[ . 1 . 2]" 1
643 1 18 LEU HG 1 42 TRP HZ2 . . 5.500 5.262 4.900 5.547 0.047 20 0 "[ . 1 . 2]" 1
644 1 18 LEU HG 1 49 LEU MD1 . . 5.500 5.277 4.523 5.584 0.084 19 0 "[ . 1 . 2]" 1
645 1 19 PHE H 1 19 PHE HB2 . . 4.080 4.036 3.988 4.091 0.011 19 0 "[ . 1 . 2]" 1
646 1 19 PHE H 1 19 PHE HB3 . . 4.060 3.586 3.517 3.669 . 0 0 "[ . 1 . 2]" 1
647 1 19 PHE H 1 19 PHE QD . . 3.320 2.971 2.603 3.328 0.008 19 0 "[ . 1 . 2]" 1
648 1 19 PHE H 1 19 PHE QE . . 4.730 4.605 4.474 4.778 0.048 19 0 "[ . 1 . 2]" 1
649 1 19 PHE H 1 20 VAL QG . . 4.360 4.033 3.929 4.151 . 0 0 "[ . 1 . 2]" 1
650 1 19 PHE H 1 25 LEU QD . . 3.620 3.016 2.659 3.665 0.045 13 0 "[ . 1 . 2]" 1
651 1 19 PHE H 1 25 LEU HG . . 5.500 4.665 4.333 5.166 . 0 0 "[ . 1 . 2]" 1
652 1 19 PHE H 1 26 GLN H . . 3.490 3.394 3.158 3.563 0.073 9 0 "[ . 1 . 2]" 1
653 1 19 PHE H 1 26 GLN QB . . 5.080 4.446 3.888 5.067 . 0 0 "[ . 1 . 2]" 1
654 1 19 PHE H 1 27 TYR HA . . 3.810 3.546 3.347 3.719 . 0 0 "[ . 1 . 2]" 1
655 1 19 PHE H 1 27 TYR HB2 . . 5.500 5.226 5.012 5.516 0.016 8 0 "[ . 1 . 2]" 1
656 1 19 PHE H 1 27 TYR QD . . 5.500 5.560 5.330 5.637 0.137 1 0 "[ . 1 . 2]" 1
657 1 19 PHE H 1 53 LEU HB2 . . 5.500 5.455 5.276 5.546 0.046 12 0 "[ . 1 . 2]" 1
658 1 19 PHE H 1 53 LEU HB3 . . 5.070 5.062 4.758 5.133 0.063 3 0 "[ . 1 . 2]" 1
659 1 19 PHE H 1 53 LEU MD1 . . 3.940 3.980 3.751 4.026 0.086 9 0 "[ . 1 . 2]" 1
660 1 19 PHE H 1 53 LEU MD2 . . 4.670 4.150 3.967 4.287 . 0 0 "[ . 1 . 2]" 1
661 1 19 PHE H 1 53 LEU HG . . 3.890 3.316 3.064 3.420 . 0 0 "[ . 1 . 2]" 1
662 1 19 PHE HA 1 19 PHE QD . . 4.360 3.770 3.697 3.791 . 0 0 "[ . 1 . 2]" 1
663 1 19 PHE HA 1 20 VAL MG1 . . 5.500 5.483 5.412 5.551 0.051 4 0 "[ . 1 . 2]" 1
664 1 19 PHE HA 1 20 VAL QG . . 4.380 3.271 3.164 3.345 . 0 0 "[ . 1 . 2]" 1
665 1 19 PHE HA 1 20 VAL MG2 . . 5.500 3.297 3.186 3.374 . 0 0 "[ . 1 . 2]" 1
666 1 19 PHE HA 1 53 LEU HG . . 3.490 2.340 2.193 2.407 . 0 0 "[ . 1 . 2]" 1
667 1 19 PHE HB2 1 20 VAL H . . 3.060 2.249 2.116 2.372 . 0 0 "[ . 1 . 2]" 1
668 1 19 PHE HB2 1 21 VAL QG . . 4.960 4.090 3.592 5.034 0.074 9 0 "[ . 1 . 2]" 1
669 1 19 PHE HB2 1 53 LEU MD1 . . 5.280 4.395 4.267 4.513 . 0 0 "[ . 1 . 2]" 1
670 1 19 PHE HB2 1 53 LEU HG . . 4.810 4.758 4.652 4.830 0.020 18 0 "[ . 1 . 2]" 1
671 1 19 PHE HB3 1 20 VAL H . . 3.850 3.662 3.577 3.744 . 0 0 "[ . 1 . 2]" 1
672 1 19 PHE HB3 1 53 LEU MD1 . . 3.840 3.872 3.748 3.921 0.081 14 0 "[ . 1 . 2]" 1
673 1 19 PHE HB3 1 53 LEU HG . . 5.500 4.583 4.417 4.659 . 0 0 "[ . 1 . 2]" 1
674 1 19 PHE QD 1 20 VAL H . . 3.460 3.297 2.924 3.517 0.057 13 0 "[ . 1 . 2]" 1
675 1 19 PHE QD 1 20 VAL MG1 . . 5.500 5.422 5.075 5.597 0.097 17 0 "[ . 1 . 2]" 1
676 1 19 PHE QD 1 20 VAL QG . . 4.800 4.641 4.416 4.768 . 0 0 "[ . 1 . 2]" 1
677 1 19 PHE QD 1 20 VAL MG2 . . 5.500 5.045 4.856 5.176 . 0 0 "[ . 1 . 2]" 1
678 1 19 PHE QD 1 21 VAL HB . . 4.450 3.984 2.594 4.528 0.078 2 0 "[ . 1 . 2]" 1
679 1 19 PHE QD 1 21 VAL QG . . 3.330 2.309 1.942 3.280 . 0 0 "[ . 1 . 2]" 1
680 1 19 PHE QD 1 25 LEU QD . . 4.940 4.922 4.693 5.069 0.129 13 0 "[ . 1 . 2]" 1
681 1 19 PHE QD 1 26 GLN HG3 . . 4.890 4.679 4.088 4.972 0.082 8 0 "[ . 1 . 2]" 1
682 1 19 PHE QD 1 27 TYR HA . . 3.790 2.890 2.619 3.140 . 0 0 "[ . 1 . 2]" 1
683 1 19 PHE QD 1 28 GLU H . . 4.010 3.846 3.547 4.080 0.070 19 0 "[ . 1 . 2]" 1
684 1 19 PHE QD 1 28 GLU QB . . 4.450 3.894 3.631 4.198 . 0 0 "[ . 1 . 2]" 1
685 1 19 PHE QE 1 21 VAL QG . . 3.180 2.216 2.053 2.644 . 0 0 "[ . 1 . 2]" 1
686 1 19 PHE QE 1 26 GLN QB . . 4.740 2.908 2.457 3.654 . 0 0 "[ . 1 . 2]" 1
687 1 19 PHE QE 1 27 TYR HA . . 3.850 2.552 2.337 2.858 . 0 0 "[ . 1 . 2]" 1
688 1 19 PHE QE 1 28 GLU H . . 3.850 2.741 2.132 3.010 . 0 0 "[ . 1 . 2]" 1
689 1 19 PHE QE 1 28 GLU QB . . 3.830 2.188 2.073 2.309 . 0 0 "[ . 1 . 2]" 1
690 1 19 PHE HZ 1 21 VAL QG . . 4.730 4.067 3.724 4.261 . 0 0 "[ . 1 . 2]" 1
691 1 19 PHE HZ 1 28 GLU H . . 5.500 4.879 4.063 5.235 . 0 0 "[ . 1 . 2]" 1
692 1 19 PHE HZ 1 28 GLU HA . . 4.780 4.779 4.327 4.851 0.071 14 0 "[ . 1 . 2]" 1
693 1 19 PHE HZ 1 28 GLU QB . . 4.310 2.893 2.628 3.135 . 0 0 "[ . 1 . 2]" 1
694 1 20 VAL H 1 20 VAL HB . . 3.880 2.791 2.603 3.095 . 0 0 "[ . 1 . 2]" 1
695 1 20 VAL H 1 20 VAL MG1 . . 4.410 3.929 3.845 4.027 . 0 0 "[ . 1 . 2]" 1
696 1 20 VAL H 1 20 VAL QG . . 2.970 2.815 2.640 2.943 . 0 0 "[ . 1 . 2]" 1
697 1 20 VAL H 1 20 VAL MG2 . . 4.410 2.887 2.683 3.039 . 0 0 "[ . 1 . 2]" 1
698 1 20 VAL H 1 21 VAL H . . 4.390 4.239 4.069 4.407 0.017 2 0 "[ . 1 . 2]" 1
699 1 20 VAL H 1 21 VAL QG . . 4.840 4.073 3.588 4.695 . 0 0 "[ . 1 . 2]" 1
700 1 20 VAL H 1 26 GLN H . . 5.030 4.760 4.567 5.077 0.047 13 0 "[ . 1 . 2]" 1
701 1 20 VAL H 1 53 LEU HB2 . . 4.800 4.571 4.046 4.757 . 0 0 "[ . 1 . 2]" 1
702 1 20 VAL H 1 53 LEU HB3 . . 4.060 3.455 2.994 3.652 . 0 0 "[ . 1 . 2]" 1
703 1 20 VAL H 1 53 LEU MD1 . . 5.160 4.396 4.256 4.574 . 0 0 "[ . 1 . 2]" 1
704 1 20 VAL H 1 53 LEU HG . . 4.080 4.117 3.884 4.152 0.072 11 0 "[ . 1 . 2]" 1
705 1 20 VAL HA 1 21 VAL HA . . 5.400 4.471 4.395 4.527 . 0 0 "[ . 1 . 2]" 1
706 1 20 VAL HA 1 25 LEU HA . . 3.510 2.558 2.372 2.750 . 0 0 "[ . 1 . 2]" 1
707 1 20 VAL HB 1 23 ASN HA . . 4.780 4.448 4.224 4.633 . 0 0 "[ . 1 . 2]" 1
708 1 20 VAL HB 1 23 ASN HD21 . . 5.500 5.545 5.388 5.632 0.132 1 0 "[ . 1 . 2]" 1
709 1 20 VAL HB 1 24 ARG H . . 5.500 5.231 4.609 5.565 0.065 16 0 "[ . 1 . 2]" 1
710 1 20 VAL HB 1 25 LEU HA . . 5.210 4.861 4.589 5.174 . 0 0 "[ . 1 . 2]" 1
711 1 20 VAL HB 1 50 ILE HG12 . . 5.080 4.877 4.646 5.085 0.005 9 0 "[ . 1 . 2]" 1
712 1 20 VAL QG 1 21 VAL H . . 3.040 2.712 2.368 3.131 0.091 19 0 "[ . 1 . 2]" 1
713 1 20 VAL QG 1 21 VAL HA . . 5.440 3.767 3.536 4.036 . 0 0 "[ . 1 . 2]" 1
714 1 20 VAL QG 1 23 ASN H . . 3.020 2.500 2.303 2.960 . 0 0 "[ . 1 . 2]" 1
715 1 20 VAL QG 1 23 ASN HA . . 2.860 2.143 2.059 2.460 . 0 0 "[ . 1 . 2]" 1
716 1 20 VAL QG 1 23 ASN HB2 . . 4.660 4.076 3.931 4.355 . 0 0 "[ . 1 . 2]" 1
717 1 20 VAL QG 1 23 ASN HB3 . . 5.440 4.426 4.290 4.809 . 0 0 "[ . 1 . 2]" 1
718 1 20 VAL QG 1 23 ASN HD21 . . 5.440 3.243 2.988 3.470 . 0 0 "[ . 1 . 2]" 1
719 1 20 VAL QG 1 24 ARG H . . 3.000 2.594 2.066 2.858 . 0 0 "[ . 1 . 2]" 1
720 1 20 VAL QG 1 24 ARG HA . . 4.040 3.586 3.282 3.857 . 0 0 "[ . 1 . 2]" 1
721 1 20 VAL QG 1 24 ARG QG . . 5.280 4.431 3.975 4.614 . 0 0 "[ . 1 . 2]" 1
722 1 20 VAL QG 1 25 LEU H . . 4.610 3.470 3.193 3.737 . 0 0 "[ . 1 . 2]" 1
723 1 20 VAL QG 1 25 LEU HA . . 3.250 2.379 2.170 2.638 . 0 0 "[ . 1 . 2]" 1
724 1 20 VAL QG 1 25 LEU QB . . 4.050 3.190 2.647 3.442 . 0 0 "[ . 1 . 2]" 1
725 1 20 VAL QG 1 25 LEU HG . . 5.230 3.060 2.422 4.754 . 0 0 "[ . 1 . 2]" 1
726 1 20 VAL QG 1 50 ILE H . . 4.660 4.136 3.943 4.312 . 0 0 "[ . 1 . 2]" 1
727 1 20 VAL QG 1 50 ILE HA . . 2.680 2.030 1.894 2.199 . 0 0 "[ . 1 . 2]" 1
728 1 20 VAL QG 1 50 ILE HG12 . . 4.840 2.243 2.113 2.412 . 0 0 "[ . 1 . 2]" 1
729 1 20 VAL QG 1 52 PHE HB3 . . 5.440 5.494 5.273 5.532 0.092 20 0 "[ . 1 . 2]" 1
730 1 20 VAL QG 1 53 LEU H . . 3.700 3.730 3.508 3.783 0.083 19 0 "[ . 1 . 2]" 1
731 1 20 VAL QG 1 53 LEU HA . . 4.820 4.330 4.168 4.409 . 0 0 "[ . 1 . 2]" 1
732 1 20 VAL QG 1 53 LEU HB2 . . 3.460 2.057 1.888 2.118 . 0 0 "[ . 1 . 2]" 1
733 1 20 VAL QG 1 53 LEU HB3 . . 3.660 2.355 2.157 2.523 . 0 0 "[ . 1 . 2]" 1
734 1 20 VAL QG 1 53 LEU MD1 . . 3.990 3.814 3.742 3.902 . 0 0 "[ . 1 . 2]" 1
735 1 20 VAL QG 1 53 LEU MD2 . . 3.400 3.156 2.949 3.426 0.026 13 0 "[ . 1 . 2]" 1
736 1 20 VAL QG 1 53 LEU HG . . 3.120 2.762 2.581 2.964 . 0 0 "[ . 1 . 2]" 1
737 1 20 VAL QG 1 54 ASN H . . 3.400 3.382 3.052 3.486 0.086 7 0 "[ . 1 . 2]" 1
738 1 20 VAL QG 1 54 ASN HB2 . . 3.940 3.252 3.051 3.440 . 0 0 "[ . 1 . 2]" 1
739 1 20 VAL QG 1 54 ASN HB3 . . 4.610 4.569 4.401 4.721 0.111 3 0 "[ . 1 . 2]" 1
740 1 20 VAL QG 1 54 ASN HD21 . . 3.210 2.577 2.059 3.052 . 0 0 "[ . 1 . 2]" 1
741 1 20 VAL MG1 1 25 LEU HA . . 3.910 2.994 2.430 3.306 . 0 0 "[ . 1 . 2]" 1
742 1 20 VAL MG1 1 50 ILE HA . . 4.030 3.684 3.469 3.867 . 0 0 "[ . 1 . 2]" 1
743 1 20 VAL MG1 1 54 ASN HB3 . . 5.500 5.386 5.091 5.576 0.076 9 0 "[ . 1 . 2]" 1
744 1 20 VAL MG2 1 25 LEU HA . . 3.910 2.539 2.258 3.124 . 0 0 "[ . 1 . 2]" 1
745 1 20 VAL MG2 1 50 ILE HA . . 4.030 2.040 1.901 2.223 . 0 0 "[ . 1 . 2]" 1
746 1 20 VAL MG2 1 54 ASN HB3 . . 5.500 4.947 4.609 5.189 . 0 0 "[ . 1 . 2]" 1
747 1 21 VAL H 1 21 VAL HB . . 3.280 2.839 2.234 3.344 0.064 9 0 "[ . 1 . 2]" 1
748 1 21 VAL H 1 21 VAL QG . . 3.330 2.590 1.975 2.944 . 0 0 "[ . 1 . 2]" 1
749 1 21 VAL H 1 23 ASN H . . 4.640 4.228 3.791 4.703 0.063 13 0 "[ . 1 . 2]" 1
750 1 21 VAL H 1 24 ARG H . . 3.370 2.944 2.630 3.428 0.058 11 0 "[ . 1 . 2]" 1
751 1 21 VAL H 1 25 LEU HA . . 3.990 3.965 3.834 4.059 0.069 4 0 "[ . 1 . 2]" 1
752 1 21 VAL H 1 26 GLN H . . 4.070 3.943 3.625 4.133 0.063 5 0 "[ . 1 . 2]" 1
753 1 21 VAL H 1 26 GLN HG3 . . 3.600 3.290 2.591 3.674 0.074 11 0 "[ . 1 . 2]" 1
754 1 21 VAL HA 1 21 VAL MG1 . . 3.330 2.664 2.298 3.267 . 0 0 "[ . 1 . 2]" 1
755 1 21 VAL HA 1 21 VAL QG . . 2.740 2.209 2.092 2.484 . 0 0 "[ . 1 . 2]" 1
756 1 21 VAL HA 1 21 VAL MG2 . . 3.330 2.417 2.257 2.585 . 0 0 "[ . 1 . 2]" 1
757 1 21 VAL HA 1 22 ASN H . . 3.540 2.182 2.093 2.270 . 0 0 "[ . 1 . 2]" 1
758 1 21 VAL HA 1 22 ASN QD . . 5.340 4.566 3.461 5.044 . 0 0 "[ . 1 . 2]" 1
759 1 21 VAL HA 1 26 GLN HG3 . . 5.500 5.347 4.846 5.574 0.074 9 0 "[ . 1 . 2]" 1
760 1 21 VAL HB 1 22 ASN H . . 4.680 4.257 4.038 4.440 . 0 0 "[ . 1 . 2]" 1
761 1 21 VAL HB 1 24 ARG H . . 5.500 4.740 4.211 5.563 0.063 14 0 "[ . 1 . 2]" 1
762 1 21 VAL QG 1 22 ASN H . . 3.670 2.803 2.569 2.985 . 0 0 "[ . 1 . 2]" 1
763 1 21 VAL QG 1 22 ASN HA . . 4.140 4.140 3.943 4.243 0.103 2 0 "[ . 1 . 2]" 1
764 1 21 VAL QG 1 22 ASN QB . . 3.260 3.031 2.783 3.365 0.105 20 0 "[ . 1 . 2]" 1
765 1 21 VAL QG 1 22 ASN QD . . 3.440 2.230 1.704 2.553 . 0 0 "[ . 1 . 2]" 1
766 1 21 VAL QG 1 24 ARG H . . 5.010 4.129 3.598 4.495 . 0 0 "[ . 1 . 2]" 1
767 1 21 VAL QG 1 26 GLN H . . 4.300 4.184 3.627 4.414 0.114 1 0 "[ . 1 . 2]" 1
768 1 21 VAL QG 1 26 GLN QB . . 4.710 2.836 2.217 3.676 . 0 0 "[ . 1 . 2]" 1
769 1 21 VAL QG 1 26 GLN HG2 . . 5.320 3.759 3.234 4.680 . 0 0 "[ . 1 . 2]" 1
770 1 21 VAL QG 1 26 GLN HG3 . . 3.640 2.635 1.985 3.589 . 0 0 "[ . 1 . 2]" 1
771 1 21 VAL MG1 1 22 ASN H . . 4.240 3.296 2.672 4.300 0.060 19 0 "[ . 1 . 2]" 1
772 1 21 VAL MG1 1 26 GLN HG3 . . 4.560 3.525 1.988 4.645 0.085 17 0 "[ . 1 . 2]" 1
773 1 21 VAL MG2 1 22 ASN H . . 4.240 3.727 2.594 4.283 0.043 16 0 "[ . 1 . 2]" 1
774 1 21 VAL MG2 1 26 GLN HG3 . . 4.560 3.431 2.292 4.640 0.080 15 0 "[ . 1 . 2]" 1
775 1 22 ASN H 1 23 ASN H . . 3.870 2.905 2.694 3.158 . 0 0 "[ . 1 . 2]" 1
776 1 22 ASN HA 1 22 ASN QB . . 2.620 2.377 2.288 2.437 . 0 0 "[ . 1 . 2]" 1
777 1 22 ASN HA 1 23 ASN H . . 3.040 2.739 2.540 2.902 . 0 0 "[ . 1 . 2]" 1
778 1 22 ASN HA 1 23 ASN HA . . 4.950 4.703 4.613 4.832 . 0 0 "[ . 1 . 2]" 1
779 1 22 ASN HA 1 23 ASN HB2 . . 4.700 4.215 4.022 4.363 . 0 0 "[ . 1 . 2]" 1
780 1 22 ASN HA 1 24 ARG H . . 5.470 4.436 4.257 4.667 . 0 0 "[ . 1 . 2]" 1
781 1 22 ASN QB 1 22 ASN QD . . 3.040 2.214 2.065 2.446 . 0 0 "[ . 1 . 2]" 1
782 1 22 ASN QB 1 23 ASN H . . 4.060 3.949 3.856 4.041 . 0 0 "[ . 1 . 2]" 1
783 1 22 ASN QB 1 24 ARG H . . 4.360 3.821 3.475 4.398 0.038 19 0 "[ . 1 . 2]" 1
784 1 22 ASN QB 1 24 ARG HB2 . . 4.300 3.991 3.597 4.367 0.067 13 0 "[ . 1 . 2]" 1
785 1 22 ASN QB 1 24 ARG QD . . 4.760 4.115 2.713 4.848 0.088 5 0 "[ . 1 . 2]" 1
786 1 22 ASN HB2 1 23 ASN H . . 4.680 4.394 4.192 4.519 . 0 0 "[ . 1 . 2]" 1
787 1 22 ASN HB3 1 23 ASN H . . 4.680 4.477 4.374 4.553 . 0 0 "[ . 1 . 2]" 1
788 1 22 ASN QD 1 24 ARG HB2 . . 5.320 5.309 4.698 5.394 0.074 8 0 "[ . 1 . 2]" 1
789 1 23 ASN H 1 23 ASN HA . . 2.790 2.191 2.074 2.280 . 0 0 "[ . 1 . 2]" 1
790 1 23 ASN H 1 23 ASN HB2 . . 3.650 3.041 2.870 3.196 . 0 0 "[ . 1 . 2]" 1
791 1 23 ASN H 1 23 ASN HB3 . . 3.780 3.675 3.456 3.829 0.049 2 0 "[ . 1 . 2]" 1
792 1 23 ASN H 1 23 ASN HD21 . . 5.500 4.018 3.705 4.201 . 0 0 "[ . 1 . 2]" 1
793 1 23 ASN H 1 23 ASN HD22 . . 5.500 5.525 5.284 5.582 0.082 6 0 "[ . 1 . 2]" 1
794 1 23 ASN H 1 24 ARG H . . 3.290 2.832 2.513 3.003 . 0 0 "[ . 1 . 2]" 1
795 1 23 ASN H 1 54 ASN HD22 . . 5.500 4.514 3.337 5.385 . 0 0 "[ . 1 . 2]" 1
796 1 23 ASN HA 1 23 ASN HB2 . . 3.010 2.489 2.372 2.594 . 0 0 "[ . 1 . 2]" 1
797 1 23 ASN HA 1 24 ARG H . . 3.420 3.095 2.829 3.294 . 0 0 "[ . 1 . 2]" 1
798 1 23 ASN HA 1 50 ILE MG . . 3.650 3.356 3.032 3.716 0.066 19 0 "[ . 1 . 2]" 1
799 1 23 ASN HA 1 54 ASN HD21 . . 4.210 3.970 3.290 4.264 0.054 19 0 "[ . 1 . 2]" 1
800 1 23 ASN HA 1 54 ASN HD22 . . 4.280 4.044 3.081 4.359 0.079 17 0 "[ . 1 . 2]" 1
801 1 23 ASN HB2 1 23 ASN HD22 . . 3.870 3.615 3.514 3.678 . 0 0 "[ . 1 . 2]" 1
802 1 23 ASN HB2 1 24 ARG H . . 4.720 4.592 4.445 4.709 . 0 0 "[ . 1 . 2]" 1
803 1 23 ASN HB2 1 24 ARG QG . . 5.340 5.101 4.435 5.408 0.068 6 0 "[ . 1 . 2]" 1
804 1 23 ASN HB2 1 54 ASN HD21 . . 5.500 5.367 4.745 5.571 0.071 8 0 "[ . 1 . 2]" 1
805 1 23 ASN HB2 1 61 GLN QE . . 5.340 5.030 3.966 5.410 0.070 14 0 "[ . 1 . 2]" 1
806 1 23 ASN HB3 1 24 ARG H . . 4.230 4.088 3.827 4.298 0.068 19 0 "[ . 1 . 2]" 1
807 1 23 ASN HD21 1 50 ILE MG . . 5.500 2.978 2.286 3.609 . 0 0 "[ . 1 . 2]" 1
808 1 23 ASN HD21 1 61 GLN QG . . 5.500 5.411 4.050 5.586 0.086 9 0 "[ . 1 . 2]" 1
809 1 23 ASN HD22 1 50 ILE HB . . 5.500 5.033 4.446 5.539 0.039 19 0 "[ . 1 . 2]" 1
810 1 23 ASN HD22 1 50 ILE MG . . 5.500 2.708 2.308 3.164 . 0 0 "[ . 1 . 2]" 1
811 1 24 ARG H 1 24 ARG HB2 . . 3.690 2.608 2.434 2.914 . 0 0 "[ . 1 . 2]" 1
812 1 24 ARG H 1 24 ARG HG2 . . 4.060 3.426 2.507 4.120 0.060 8 0 "[ . 1 . 2]" 1
813 1 24 ARG H 1 24 ARG HG3 . . 4.060 3.217 2.490 4.100 0.040 5 0 "[ . 1 . 2]" 1
814 1 24 ARG HA 1 24 ARG HD2 . . 5.190 4.224 2.787 4.750 . 0 0 "[ . 1 . 2]" 1
815 1 24 ARG HA 1 24 ARG QD . . 4.490 3.426 2.095 4.102 . 0 0 "[ . 1 . 2]" 1
816 1 24 ARG HA 1 24 ARG HD3 . . 5.190 3.709 2.107 4.664 . 0 0 "[ . 1 . 2]" 1
817 1 24 ARG HA 1 24 ARG HG2 . . 3.860 2.704 2.203 3.351 . 0 0 "[ . 1 . 2]" 1
818 1 24 ARG HA 1 24 ARG HG3 . . 3.860 3.379 2.794 3.868 0.008 6 0 "[ . 1 . 2]" 1
819 1 24 ARG HA 1 50 ILE MD . . 4.080 3.757 3.346 4.159 0.079 9 0 "[ . 1 . 2]" 1
820 1 24 ARG HB3 1 24 ARG HD2 . . 3.230 2.931 2.086 3.321 0.091 11 0 "[ . 1 . 2]" 1
821 1 24 ARG HB3 1 24 ARG QD . . 2.820 2.365 2.035 2.704 . 0 0 "[ . 1 . 2]" 1
822 1 24 ARG HB3 1 24 ARG HD3 . . 3.230 2.675 2.084 3.309 0.079 2 0 "[ . 1 . 2]" 1
823 1 24 ARG HG2 1 25 LEU H . . 5.500 4.679 3.838 5.316 . 0 0 "[ . 1 . 2]" 1
824 1 24 ARG HG3 1 25 LEU H . . 5.500 5.306 4.820 5.576 0.076 1 0 "[ . 1 . 2]" 1
825 1 25 LEU H 1 25 LEU HB2 . . 4.110 2.404 2.123 2.771 . 0 0 "[ . 1 . 2]" 1
826 1 25 LEU H 1 25 LEU QB . . 3.590 2.199 2.076 2.357 . 0 0 "[ . 1 . 2]" 1
827 1 25 LEU H 1 25 LEU HB3 . . 4.110 2.640 2.243 2.938 . 0 0 "[ . 1 . 2]" 1
828 1 25 LEU H 1 25 LEU MD1 . . 5.030 4.250 4.088 4.436 . 0 0 "[ . 1 . 2]" 1
829 1 25 LEU H 1 25 LEU QD . . 4.060 3.814 3.709 3.933 . 0 0 "[ . 1 . 2]" 1
830 1 25 LEU H 1 25 LEU MD2 . . 5.030 4.317 4.204 4.395 . 0 0 "[ . 1 . 2]" 1
831 1 25 LEU H 1 46 LYS HD2 . . 5.130 4.119 3.012 5.196 0.066 2 0 "[ . 1 . 2]" 1
832 1 25 LEU H 1 46 LYS QD . . 4.380 3.656 2.974 4.465 0.085 16 0 "[ . 1 . 2]" 1
833 1 25 LEU H 1 46 LYS HD3 . . 5.130 4.703 3.065 5.200 0.070 4 0 "[ . 1 . 2]" 1
834 1 25 LEU H 1 46 LYS QG . . 5.340 3.812 3.553 4.132 . 0 0 "[ . 1 . 2]" 1
835 1 25 LEU H 1 50 ILE MD . . 3.730 2.982 2.709 3.358 . 0 0 "[ . 1 . 2]" 1
836 1 25 LEU H 1 50 ILE MG . . 5.380 4.864 4.321 5.243 . 0 0 "[ . 1 . 2]" 1
837 1 25 LEU HA 1 25 LEU MD1 . . 3.910 3.587 2.257 3.874 . 0 0 "[ . 1 . 2]" 1
838 1 25 LEU HA 1 25 LEU QD . . 2.890 2.636 2.241 2.943 0.053 13 0 "[ . 1 . 2]" 1
839 1 25 LEU HA 1 25 LEU MD2 . . 3.910 2.925 2.390 3.948 0.038 18 0 "[ . 1 . 2]" 1
840 1 25 LEU HA 1 26 GLN H . . 2.970 2.226 2.126 2.326 . 0 0 "[ . 1 . 2]" 1
841 1 25 LEU HA 1 50 ILE MD . . 4.710 4.235 4.016 4.435 . 0 0 "[ . 1 . 2]" 1
842 1 25 LEU QB 1 25 LEU QD . . 2.720 1.980 1.908 2.008 . 0 0 "[ . 1 . 2]" 1
843 1 25 LEU QB 1 26 GLN H . . 4.120 3.885 3.751 4.011 . 0 0 "[ . 1 . 2]" 1
844 1 25 LEU QB 1 46 LYS HA . . 4.540 3.959 3.703 4.205 . 0 0 "[ . 1 . 2]" 1
845 1 25 LEU QB 1 46 LYS QE . . 4.340 3.277 1.906 4.378 0.038 13 0 "[ . 1 . 2]" 1
846 1 25 LEU QB 1 50 ILE HA . . 4.790 4.379 3.825 4.699 . 0 0 "[ . 1 . 2]" 1
847 1 25 LEU QB 1 50 ILE MD . . 3.320 2.400 2.228 2.594 . 0 0 "[ . 1 . 2]" 1
848 1 25 LEU QB 1 50 ILE HG12 . . 4.430 2.544 2.284 2.826 . 0 0 "[ . 1 . 2]" 1
849 1 25 LEU QB 1 50 ILE HG13 . . 3.930 2.406 2.150 2.745 . 0 0 "[ . 1 . 2]" 1
850 1 25 LEU HB2 1 26 GLN H . . 4.740 4.497 4.186 4.624 . 0 0 "[ . 1 . 2]" 1
851 1 25 LEU HB2 1 46 LYS HE2 . . 5.500 4.432 2.761 5.570 0.070 12 0 "[ . 1 . 2]" 1
852 1 25 LEU HB2 1 46 LYS HE3 . . 5.500 4.419 2.231 5.564 0.064 5 0 "[ . 1 . 2]" 1
853 1 25 LEU HB3 1 26 GLN H . . 4.740 4.260 4.001 4.494 . 0 0 "[ . 1 . 2]" 1
854 1 25 LEU HB3 1 46 LYS HE2 . . 5.500 4.421 2.356 5.562 0.062 7 0 "[ . 1 . 2]" 1
855 1 25 LEU HB3 1 46 LYS HE3 . . 5.500 4.251 1.931 5.566 0.066 5 0 "[ . 1 . 2]" 1
856 1 25 LEU QD 1 26 GLN H . . 3.170 2.404 2.090 2.767 . 0 0 "[ . 1 . 2]" 1
857 1 25 LEU QD 1 26 GLN HA . . 3.610 3.341 2.968 3.715 0.105 18 0 "[ . 1 . 2]" 1
858 1 25 LEU QD 1 27 TYR HB2 . . 5.010 4.824 4.526 5.109 0.099 19 0 "[ . 1 . 2]" 1
859 1 25 LEU QD 1 27 TYR QD . . 3.900 3.269 2.774 4.039 0.139 19 0 "[ . 1 . 2]" 1
860 1 25 LEU QD 1 42 TRP HA . . 4.710 3.731 3.509 4.078 . 0 0 "[ . 1 . 2]" 1
861 1 25 LEU QD 1 42 TRP HB2 . . 4.710 4.004 3.636 4.245 . 0 0 "[ . 1 . 2]" 1
862 1 25 LEU QD 1 42 TRP HB3 . . 4.040 2.849 2.460 3.111 . 0 0 "[ . 1 . 2]" 1
863 1 25 LEU QD 1 42 TRP HD1 . . 5.440 4.581 4.286 4.994 . 0 0 "[ . 1 . 2]" 1
864 1 25 LEU QD 1 46 LYS H . . 5.440 4.295 4.098 4.557 . 0 0 "[ . 1 . 2]" 1
865 1 25 LEU QD 1 46 LYS HA . . 3.240 2.155 1.971 2.301 . 0 0 "[ . 1 . 2]" 1
866 1 25 LEU QD 1 46 LYS HB2 . . 4.480 3.400 2.853 3.695 . 0 0 "[ . 1 . 2]" 1
867 1 25 LEU QD 1 46 LYS QD . . 3.910 3.388 2.792 3.891 . 0 0 "[ . 1 . 2]" 1
868 1 25 LEU QD 1 46 LYS QG . . 3.670 2.039 1.900 2.285 . 0 0 "[ . 1 . 2]" 1
869 1 25 LEU QD 1 47 GLN H . . 5.440 4.743 4.472 4.927 . 0 0 "[ . 1 . 2]" 1
870 1 25 LEU QD 1 49 LEU HB2 . . 3.650 2.158 1.876 2.280 . 0 0 "[ . 1 . 2]" 1
871 1 25 LEU QD 1 49 LEU MD1 . . 3.640 2.053 1.858 2.326 . 0 0 "[ . 1 . 2]" 1
872 1 25 LEU QD 1 50 ILE H . . 3.470 3.151 2.809 3.488 0.018 6 0 "[ . 1 . 2]" 1
873 1 25 LEU QD 1 50 ILE HA . . 5.070 3.829 3.472 4.118 . 0 0 "[ . 1 . 2]" 1
874 1 25 LEU QD 1 50 ILE HG13 . . 3.730 2.338 2.120 2.824 . 0 0 "[ . 1 . 2]" 1
875 1 25 LEU QD 1 53 LEU MD2 . . 3.920 3.276 2.673 3.741 . 0 0 "[ . 1 . 2]" 1
876 1 25 LEU MD1 1 42 TRP HB3 . . 5.170 3.293 2.990 4.222 . 0 0 "[ . 1 . 2]" 1
877 1 25 LEU MD1 1 46 LYS HA . . 4.590 2.516 1.974 4.669 0.079 19 0 "[ . 1 . 2]" 1
878 1 25 LEU MD1 1 49 LEU HB2 . . 4.180 2.364 1.879 3.661 . 0 0 "[ . 1 . 2]" 1
879 1 25 LEU MD2 1 42 TRP HB3 . . 5.170 3.249 2.482 3.855 . 0 0 "[ . 1 . 2]" 1
880 1 25 LEU MD2 1 46 LYS HA . . 4.590 4.202 2.184 4.675 0.085 2 0 "[ . 1 . 2]" 1
881 1 25 LEU MD2 1 49 LEU HB2 . . 4.180 3.877 2.240 4.265 0.085 13 0 "[ . 1 . 2]" 1
882 1 25 LEU HG 1 26 GLN H . . 3.970 3.753 3.502 4.023 0.053 17 0 "[ . 1 . 2]" 1
883 1 26 GLN H 1 26 GLN QB . . 3.730 2.697 2.363 3.047 . 0 0 "[ . 1 . 2]" 1
884 1 26 GLN H 1 26 GLN HG2 . . 3.830 3.350 2.762 3.888 0.058 5 0 "[ . 1 . 2]" 1
885 1 26 GLN H 1 26 GLN HG3 . . 4.070 3.547 2.717 4.132 0.062 12 0 "[ . 1 . 2]" 1
886 1 26 GLN HA 1 26 GLN HG3 . . 3.860 3.685 3.315 3.930 0.070 11 0 "[ . 1 . 2]" 1
887 1 26 GLN QB 1 27 TYR H . . 3.310 2.403 2.141 2.673 . 0 0 "[ . 1 . 2]" 1
888 1 26 GLN QB 1 27 TYR HA . . 4.340 3.998 3.866 4.217 . 0 0 "[ . 1 . 2]" 1
889 1 26 GLN HG2 1 27 TYR H . . 4.910 4.643 4.061 4.942 0.032 8 0 "[ . 1 . 2]" 1
890 1 26 GLN HG3 1 27 TYR H . . 5.500 5.010 4.782 5.255 . 0 0 "[ . 1 . 2]" 1
891 1 27 TYR H 1 27 TYR QD . . 3.930 3.104 2.594 3.467 . 0 0 "[ . 1 . 2]" 1
892 1 27 TYR HA 1 27 TYR QD . . 3.760 3.760 3.709 3.808 0.048 2 0 "[ . 1 . 2]" 1
893 1 27 TYR HA 1 28 GLU H . . 2.970 2.363 2.281 2.463 . 0 0 "[ . 1 . 2]" 1
894 1 27 TYR HA 1 28 GLU HA . . 4.660 4.496 4.435 4.570 . 0 0 "[ . 1 . 2]" 1
895 1 27 TYR HA 1 28 GLU QB . . 4.010 3.804 3.678 3.938 . 0 0 "[ . 1 . 2]" 1
896 1 27 TYR HB2 1 28 GLU H . . 3.510 2.569 2.387 2.767 . 0 0 "[ . 1 . 2]" 1
897 1 27 TYR HB2 1 29 THR MG . . 4.550 4.493 3.994 4.627 0.077 12 0 "[ . 1 . 2]" 1
898 1 27 TYR HB3 1 28 GLU H . . 4.230 3.839 3.650 4.035 . 0 0 "[ . 1 . 2]" 1
899 1 27 TYR QD 1 28 GLU H . . 4.220 3.513 3.258 3.831 . 0 0 "[ . 1 . 2]" 1
900 1 27 TYR QD 1 29 THR H . . 4.260 4.277 3.728 4.339 0.079 8 0 "[ . 1 . 2]" 1
901 1 27 TYR QD 1 29 THR MG . . 4.120 2.749 2.446 3.068 . 0 0 "[ . 1 . 2]" 1
902 1 27 TYR QD 1 34 ILE MD . . 4.340 3.865 3.420 4.192 . 0 0 "[ . 1 . 2]" 1
903 1 27 TYR QD 1 39 LEU QD . . 4.460 4.466 4.205 4.571 0.111 11 0 "[ . 1 . 2]" 1
904 1 27 TYR QD 1 42 TRP HE3 . . 4.030 3.742 3.060 4.111 0.081 2 0 "[ . 1 . 2]" 1
905 1 27 TYR QE 1 29 THR HB . . 5.500 5.138 4.561 5.573 0.073 7 0 "[ . 1 . 2]" 1
906 1 27 TYR QE 1 29 THR MG . . 3.700 3.065 2.469 3.710 0.010 7 0 "[ . 1 . 2]" 1
907 1 27 TYR QE 1 34 ILE MD . . 3.440 2.887 2.458 3.122 . 0 0 "[ . 1 . 2]" 1
908 1 27 TYR QE 1 34 ILE HG12 . . 5.500 5.463 4.916 5.579 0.079 15 0 "[ . 1 . 2]" 1
909 1 27 TYR QE 1 34 ILE MG . . 4.540 4.301 4.000 4.555 0.015 1 0 "[ . 1 . 2]" 1
910 1 27 TYR QE 1 39 LEU MD1 . . 4.900 4.439 4.045 4.999 0.099 19 0 "[ . 1 . 2]" 1
911 1 27 TYR QE 1 39 LEU QD . . 3.690 3.164 2.792 3.472 . 0 0 "[ . 1 . 2]" 1
912 1 27 TYR QE 1 39 LEU MD2 . . 4.900 3.256 2.836 3.633 . 0 0 "[ . 1 . 2]" 1
913 1 28 GLU H 1 28 GLU QB . . 3.230 2.542 2.375 2.670 . 0 0 "[ . 1 . 2]" 1
914 1 28 GLU H 1 28 GLU QG . . 3.900 3.958 3.877 3.991 0.091 2 0 "[ . 1 . 2]" 1
915 1 28 GLU HA 1 28 GLU QG . . 3.450 2.609 2.386 3.082 . 0 0 "[ . 1 . 2]" 1
916 1 28 GLU HA 1 29 THR MG . . 3.960 3.625 3.299 3.826 . 0 0 "[ . 1 . 2]" 1
917 1 28 GLU QB 1 28 GLU QG . . 2.500 2.053 1.984 2.096 . 0 0 "[ . 1 . 2]" 1
918 1 28 GLU QB 1 29 THR H . . 3.790 3.757 3.583 3.870 0.080 5 0 "[ . 1 . 2]" 1
919 1 28 GLU QG 1 29 THR H . . 3.310 2.631 2.200 3.179 . 0 0 "[ . 1 . 2]" 1
920 1 28 GLU QG 1 29 THR HA . . 3.950 3.499 3.244 3.725 . 0 0 "[ . 1 . 2]" 1
921 1 28 GLU QG 1 29 THR MG . . 4.770 4.532 4.288 4.852 0.082 5 0 "[ . 1 . 2]" 1
922 1 29 THR H 1 29 THR MG . . 2.860 2.532 2.239 2.719 . 0 0 "[ . 1 . 2]" 1
923 1 29 THR H 1 34 ILE MD . . 5.180 5.208 4.997 5.274 0.094 5 0 "[ . 1 . 2]" 1
924 1 29 THR HA 1 29 THR MG . . 3.640 3.271 3.197 3.300 . 0 0 "[ . 1 . 2]" 1
925 1 29 THR HB 1 34 ILE MD . . 5.500 3.964 3.570 4.167 . 0 0 "[ . 1 . 2]" 1
926 1 29 THR MG 1 30 SER H . . 5.500 3.403 2.998 3.869 . 0 0 "[ . 1 . 2]" 1
927 1 29 THR MG 1 31 ARG H . . 3.840 3.081 2.677 3.623 . 0 0 "[ . 1 . 2]" 1
928 1 29 THR MG 1 31 ARG HA . . 5.500 5.375 5.008 5.571 0.071 9 0 "[ . 1 . 2]" 1
929 1 29 THR MG 1 31 ARG QB . . 4.750 4.597 4.154 4.849 0.099 16 0 "[ . 1 . 2]" 1
930 1 29 THR MG 1 31 ARG QD . . 4.410 3.626 2.505 4.278 . 0 0 "[ . 1 . 2]" 1
931 1 29 THR MG 1 31 ARG QG . . 3.900 2.853 2.352 3.150 . 0 0 "[ . 1 . 2]" 1
932 1 29 THR MG 1 34 ILE MD . . 2.910 1.952 1.882 2.035 . 0 0 "[ . 1 . 2]" 1
933 1 29 THR MG 1 34 ILE HG12 . . 4.530 3.512 2.937 3.951 . 0 0 "[ . 1 . 2]" 1
934 1 30 SER H 1 31 ARG H . . 4.230 3.269 2.193 4.008 . 0 0 "[ . 1 . 2]" 1
935 1 30 SER H 1 31 ARG HG2 . . 5.500 3.256 2.497 3.889 . 0 0 "[ . 1 . 2]" 1
936 1 30 SER H 1 31 ARG QG . . 4.810 3.047 2.452 3.373 . 0 0 "[ . 1 . 2]" 1
937 1 30 SER H 1 31 ARG HG3 . . 5.500 4.303 2.485 5.073 . 0 0 "[ . 1 . 2]" 1
938 1 30 SER HA 1 31 ARG HG2 . . 5.500 4.770 4.263 5.578 0.078 8 0 "[ . 1 . 2]" 1
939 1 30 SER HA 1 31 ARG HG3 . . 5.500 5.155 4.015 5.561 0.061 19 0 "[ . 1 . 2]" 1
940 1 30 SER QB 1 31 ARG QG . . 4.760 4.653 4.123 4.861 0.101 4 0 "[ . 1 . 2]" 1
941 1 30 SER HB2 1 31 ARG H . . 5.250 4.499 3.825 4.692 . 0 0 "[ . 1 . 2]" 1
942 1 30 SER HB3 1 31 ARG H . . 5.250 4.372 3.863 4.567 . 0 0 "[ . 1 . 2]" 1
943 1 31 ARG H 1 31 ARG QD . . 5.340 4.343 3.355 4.680 . 0 0 "[ . 1 . 2]" 1
944 1 31 ARG H 1 31 ARG QG . . 3.090 2.578 1.984 2.977 . 0 0 "[ . 1 . 2]" 1
945 1 31 ARG HA 1 31 ARG QD . . 4.880 4.457 4.139 4.759 . 0 0 "[ . 1 . 2]" 1
946 1 31 ARG HA 1 31 ARG QG . . 3.730 3.376 3.311 3.443 . 0 0 "[ . 1 . 2]" 1
947 1 31 ARG QB 1 32 ASP H . . 4.190 2.258 1.886 2.765 . 0 0 "[ . 1 . 2]" 1
948 1 31 ARG QD 1 34 ILE MD . . 4.860 3.609 2.643 4.963 0.103 20 0 "[ . 1 . 2]" 1
949 1 32 ASP HA 1 32 ASP QB . . 2.580 2.301 2.159 2.532 . 0 0 "[ . 1 . 2]" 1
950 1 33 SER H 1 34 ILE MD . . 5.500 5.546 5.379 5.596 0.096 15 0 "[ . 1 . 2]" 1
951 1 33 SER HA 1 34 ILE HB . . 4.970 4.700 4.405 4.894 . 0 0 "[ . 1 . 2]" 1
952 1 34 ILE HA 1 34 ILE MD . . 3.750 3.746 3.640 3.826 0.076 13 0 "[ . 1 . 2]" 1
953 1 34 ILE HA 1 34 ILE MG . . 3.680 2.845 2.649 3.048 . 0 0 "[ . 1 . 2]" 1
954 1 34 ILE HA 1 35 PRO HB3 . . 4.940 4.979 4.837 5.004 0.064 8 0 "[ . 1 . 2]" 1
955 1 34 ILE HA 1 35 PRO HD2 . . 3.770 2.241 2.113 2.387 . 0 0 "[ . 1 . 2]" 1
956 1 34 ILE HA 1 35 PRO QD . . 3.210 2.053 1.991 2.107 . 0 0 "[ . 1 . 2]" 1
957 1 34 ILE HA 1 35 PRO HD3 . . 3.770 2.402 2.249 2.539 . 0 0 "[ . 1 . 2]" 1
958 1 34 ILE HA 1 35 PRO HG2 . . 5.500 4.418 4.267 4.555 . 0 0 "[ . 1 . 2]" 1
959 1 34 ILE HA 1 35 PRO HG3 . . 4.590 4.481 4.370 4.581 . 0 0 "[ . 1 . 2]" 1
960 1 34 ILE MD 1 39 LEU HA . . 5.410 5.427 5.224 5.498 0.088 9 0 "[ . 1 . 2]" 1
961 1 34 ILE MD 1 42 TRP HH2 . . 3.310 2.879 2.664 3.278 . 0 0 "[ . 1 . 2]" 1
962 1 34 ILE MD 1 42 TRP HZ2 . . 5.500 4.952 4.677 5.382 . 0 0 "[ . 1 . 2]" 1
963 1 34 ILE MD 1 42 TRP HZ3 . . 3.800 3.547 3.220 3.850 0.050 10 0 "[ . 1 . 2]" 1
964 1 34 ILE HG12 1 34 ILE MG . . 3.460 2.394 2.312 2.462 . 0 0 "[ . 1 . 2]" 1
965 1 34 ILE HG12 1 35 PRO QD . . 5.350 2.633 1.924 3.244 . 0 0 "[ . 1 . 2]" 1
966 1 34 ILE MG 1 35 PRO HA . . 4.400 4.016 3.717 4.114 . 0 0 "[ . 1 . 2]" 1
967 1 34 ILE MG 1 35 PRO HB2 . . 4.260 4.338 4.128 4.360 0.100 6 0 "[ . 1 . 2]" 1
968 1 34 ILE MG 1 35 PRO HB3 . . 5.410 4.746 4.451 4.828 . 0 0 "[ . 1 . 2]" 1
969 1 34 ILE MG 1 35 PRO HD2 . . 3.770 2.132 1.924 2.394 . 0 0 "[ . 1 . 2]" 1
970 1 34 ILE MG 1 35 PRO QD . . 3.280 2.116 1.912 2.366 . 0 0 "[ . 1 . 2]" 1
971 1 34 ILE MG 1 35 PRO HD3 . . 3.770 3.554 3.305 3.711 . 0 0 "[ . 1 . 2]" 1
972 1 34 ILE MG 1 35 PRO HG2 . . 4.180 3.085 2.870 3.273 . 0 0 "[ . 1 . 2]" 1
973 1 34 ILE MG 1 35 PRO HG3 . . 4.260 4.187 3.976 4.348 0.088 7 0 "[ . 1 . 2]" 1
974 1 34 ILE MG 1 36 THR HA . . 3.500 3.305 3.020 3.570 0.070 14 0 "[ . 1 . 2]" 1
975 1 34 ILE MG 1 36 THR MG . . 5.170 4.750 4.014 5.274 0.104 8 0 "[ . 1 . 2]" 1
976 1 34 ILE MG 1 37 GLU QG . . 5.340 5.316 5.123 5.435 0.095 13 0 "[ . 1 . 2]" 1
977 1 34 ILE MG 1 39 LEU H . . 3.640 3.459 3.259 3.707 0.067 9 0 "[ . 1 . 2]" 1
978 1 34 ILE MG 1 39 LEU HA . . 5.500 3.832 3.610 4.207 . 0 0 "[ . 1 . 2]" 1
979 1 34 ILE MG 1 39 LEU QB . . 3.950 2.386 2.199 2.783 . 0 0 "[ . 1 . 2]" 1
980 1 34 ILE MG 1 39 LEU HG . . 3.240 2.684 2.305 3.304 0.064 15 0 "[ . 1 . 2]" 1
981 1 34 ILE MG 1 42 TRP HH2 . . 4.070 2.940 2.357 3.587 . 0 0 "[ . 1 . 2]" 1
982 1 34 ILE MG 1 42 TRP HZ2 . . 5.380 4.305 3.709 5.080 . 0 0 "[ . 1 . 2]" 1
983 1 34 ILE MG 1 42 TRP HZ3 . . 4.090 3.481 3.064 3.813 . 0 0 "[ . 1 . 2]" 1
984 1 35 PRO HB2 1 37 GLU QG . . 4.210 2.287 2.080 2.570 . 0 0 "[ . 1 . 2]" 1
985 1 35 PRO HB2 1 38 LEU QB . . 5.340 2.540 2.153 2.967 . 0 0 "[ . 1 . 2]" 1
986 1 35 PRO HB2 1 38 LEU QD . . 5.440 3.543 2.545 4.542 . 0 0 "[ . 1 . 2]" 1
987 1 35 PRO HB2 1 38 LEU HG . . 5.500 5.061 4.582 5.561 0.061 4 0 "[ . 1 . 2]" 1
988 1 35 PRO HB3 1 38 LEU QD . . 5.440 4.326 3.373 5.410 . 0 0 "[ . 1 . 2]" 1
989 1 35 PRO QD 1 36 THR H . . 4.960 4.784 4.709 4.848 . 0 0 "[ . 1 . 2]" 1
990 1 35 PRO QD 1 38 LEU QD . . 4.180 3.887 3.465 4.284 0.104 18 0 "[ . 1 . 2]" 1
991 1 35 PRO HG2 1 38 LEU H . . 5.130 3.611 3.343 3.884 . 0 0 "[ . 1 . 2]" 1
992 1 35 PRO HG2 1 38 LEU QD . . 3.910 2.758 2.246 3.364 . 0 0 "[ . 1 . 2]" 1
993 1 35 PRO HG3 1 38 LEU H . . 4.940 4.793 4.470 4.979 0.039 9 0 "[ . 1 . 2]" 1
994 1 35 PRO HG3 1 38 LEU QD . . 3.870 3.091 2.274 3.966 0.096 2 0 "[ . 1 . 2]" 1
995 1 36 THR H 1 36 THR HB . . 3.610 2.558 2.185 2.957 . 0 0 "[ . 1 . 2]" 1
996 1 36 THR H 1 36 THR MG . . 3.950 3.075 1.899 3.768 . 0 0 "[ . 1 . 2]" 1
997 1 36 THR H 1 37 GLU HA . . 5.500 5.376 5.258 5.518 0.018 3 0 "[ . 1 . 2]" 1
998 1 36 THR H 1 39 LEU H . . 4.770 4.768 4.649 4.836 0.066 15 0 "[ . 1 . 2]" 1
999 1 36 THR HA 1 36 THR MG . . 3.300 2.702 2.202 3.262 . 0 0 "[ . 1 . 2]" 1
1000 1 36 THR HA 1 39 LEU H . . 3.920 3.256 3.037 3.524 . 0 0 "[ . 1 . 2]" 1
1001 1 36 THR HA 1 39 LEU HA . . 5.500 4.905 4.662 5.169 . 0 0 "[ . 1 . 2]" 1
1002 1 36 THR HA 1 39 LEU HB2 . . 3.810 2.577 2.239 3.318 . 0 0 "[ . 1 . 2]" 1
1003 1 36 THR HA 1 39 LEU QB . . 3.320 2.178 2.020 2.363 . 0 0 "[ . 1 . 2]" 1
1004 1 36 THR HA 1 39 LEU HB3 . . 3.810 2.461 2.069 2.991 . 0 0 "[ . 1 . 2]" 1
1005 1 36 THR HA 1 39 LEU QD . . 3.230 3.031 2.660 3.331 0.101 19 0 "[ . 1 . 2]" 1
1006 1 36 THR HA 1 39 LEU HG . . 5.500 4.313 3.335 4.894 . 0 0 "[ . 1 . 2]" 1
1007 1 36 THR HA 1 40 ASN H . . 3.700 3.687 3.541 3.860 0.160 1 0 "[ . 1 . 2]" 1
1008 1 36 THR HA 1 40 ASN HD21 . . 5.500 4.311 3.292 5.482 . 0 0 "[ . 1 . 2]" 1
1009 1 36 THR HA 1 40 ASN HD22 . . 5.500 4.843 4.197 5.550 0.050 2 0 "[ . 1 . 2]" 1
1010 1 36 THR HB 1 40 ASN QD . . 5.340 4.143 3.352 4.937 . 0 0 "[ . 1 . 2]" 1
1011 1 36 THR MG 1 37 GLU HA . . 4.500 3.934 3.335 4.500 . 0 0 "[ . 1 . 2]" 1
1012 1 36 THR MG 1 37 GLU QB . . 5.500 4.404 3.303 5.314 . 0 0 "[ . 1 . 2]" 1
1013 1 36 THR MG 1 40 ASN H . . 5.120 4.258 3.290 5.204 0.084 12 0 "[ . 1 . 2]" 1
1014 1 36 THR MG 1 40 ASN HD21 . . 5.430 3.013 2.199 4.567 . 0 0 "[ . 1 . 2]" 1
1015 1 36 THR MG 1 40 ASN QD . . 4.790 2.689 1.929 3.998 . 0 0 "[ . 1 . 2]" 1
1016 1 36 THR MG 1 40 ASN HD22 . . 5.430 3.120 2.129 4.452 . 0 0 "[ . 1 . 2]" 1
1017 1 37 GLU HA 1 37 GLU QG . . 3.490 3.397 3.339 3.439 . 0 0 "[ . 1 . 2]" 1
1018 1 37 GLU HA 1 38 LEU HA . . 5.500 4.786 4.657 4.885 . 0 0 "[ . 1 . 2]" 1
1019 1 37 GLU HA 1 40 ASN H . . 4.340 3.835 3.644 4.076 . 0 0 "[ . 1 . 2]" 1
1020 1 37 GLU HA 1 40 ASN QB . . 3.540 3.016 2.664 3.500 . 0 0 "[ . 1 . 2]" 1
1021 1 37 GLU HA 1 40 ASN HD21 . . 5.500 3.478 2.860 4.066 . 0 0 "[ . 1 . 2]" 1
1022 1 37 GLU HA 1 40 ASN HD22 . . 5.500 5.039 4.398 5.561 0.061 16 0 "[ . 1 . 2]" 1
1023 1 37 GLU QG 1 38 LEU HA . . 4.540 3.715 3.438 3.923 . 0 0 "[ . 1 . 2]" 1
1024 1 37 GLU QG 1 38 LEU HG . . 5.340 4.482 3.803 5.256 . 0 0 "[ . 1 . 2]" 1
1025 1 38 LEU H 1 38 LEU MD1 . . 5.500 3.817 2.647 4.517 . 0 0 "[ . 1 . 2]" 1
1026 1 38 LEU H 1 38 LEU QD . . 4.140 3.500 2.607 3.892 . 0 0 "[ . 1 . 2]" 1
1027 1 38 LEU H 1 38 LEU MD2 . . 5.500 4.239 3.905 4.369 . 0 0 "[ . 1 . 2]" 1
1028 1 38 LEU H 1 38 LEU HG . . 4.830 4.198 3.748 4.453 . 0 0 "[ . 1 . 2]" 1
1029 1 38 LEU HA 1 38 LEU MD1 . . 3.830 3.349 2.201 3.868 0.038 8 0 "[ . 1 . 2]" 1
1030 1 38 LEU HA 1 38 LEU QD . . 2.710 2.360 1.958 2.803 0.093 11 0 "[ . 1 . 2]" 1
1031 1 38 LEU HA 1 38 LEU MD2 . . 3.830 2.805 1.964 3.848 0.018 7 0 "[ . 1 . 2]" 1
1032 1 38 LEU HA 1 38 LEU HG . . 3.660 2.543 2.193 3.258 . 0 0 "[ . 1 . 2]" 1
1033 1 38 LEU HA 1 40 ASN H . . 5.100 4.530 4.215 4.824 . 0 0 "[ . 1 . 2]" 1
1034 1 38 LEU HA 1 41 LYS H . . 3.830 3.219 2.951 3.477 . 0 0 "[ . 1 . 2]" 1
1035 1 38 LEU HA 1 41 LYS HB2 . . 3.620 3.085 2.852 3.346 . 0 0 "[ . 1 . 2]" 1
1036 1 38 LEU HA 1 41 LYS QB . . 3.140 2.378 2.144 2.692 . 0 0 "[ . 1 . 2]" 1
1037 1 38 LEU HA 1 41 LYS HB3 . . 3.620 2.487 2.208 2.838 . 0 0 "[ . 1 . 2]" 1
1038 1 38 LEU HA 1 41 LYS QD . . 5.500 4.327 3.873 4.722 . 0 0 "[ . 1 . 2]" 1
1039 1 38 LEU HA 1 41 LYS QE . . 3.860 2.822 2.087 3.900 0.040 7 0 "[ . 1 . 2]" 1
1040 1 38 LEU HA 1 42 TRP H . . 5.500 4.295 3.944 4.651 . 0 0 "[ . 1 . 2]" 1
1041 1 38 LEU HA 1 42 TRP HD1 . . 5.500 5.126 4.512 5.533 0.033 1 0 "[ . 1 . 2]" 1
1042 1 38 LEU HA 1 42 TRP HE1 . . 5.170 4.821 4.035 5.238 0.068 19 0 "[ . 1 . 2]" 1
1043 1 38 LEU QB 1 42 TRP HZ2 . . 4.680 3.479 2.581 4.107 . 0 0 "[ . 1 . 2]" 1
1044 1 38 LEU HB2 1 39 LEU H . . 4.380 3.399 2.771 3.811 . 0 0 "[ . 1 . 2]" 1
1045 1 38 LEU HB2 1 42 TRP HZ2 . . 5.500 5.050 3.973 5.571 0.071 19 0 "[ . 1 . 2]" 1
1046 1 38 LEU HB3 1 39 LEU H . . 4.380 2.750 2.369 3.004 . 0 0 "[ . 1 . 2]" 1
1047 1 38 LEU HB3 1 42 TRP HZ2 . . 5.500 3.548 2.615 4.229 . 0 0 "[ . 1 . 2]" 1
1048 1 38 LEU QD 1 39 LEU H . . 4.680 3.859 3.648 4.061 . 0 0 "[ . 1 . 2]" 1
1049 1 38 LEU QD 1 41 LYS QB . . 3.470 2.936 2.071 3.596 0.126 4 0 "[ . 1 . 2]" 1
1050 1 38 LEU QD 1 41 LYS QE . . 3.560 2.553 1.755 3.364 . 0 0 "[ . 1 . 2]" 1
1051 1 38 LEU QD 1 42 TRP HE1 . . 4.230 2.166 1.823 3.234 . 0 0 "[ . 1 . 2]" 1
1052 1 38 LEU QD 1 42 TRP HH2 . . 5.440 4.063 3.838 4.252 . 0 0 "[ . 1 . 2]" 1
1053 1 38 LEU QD 1 42 TRP HZ2 . . 4.460 2.298 2.076 2.470 . 0 0 "[ . 1 . 2]" 1
1054 1 38 LEU MD1 1 42 TRP HZ2 . . 5.500 3.646 2.131 4.943 . 0 0 "[ . 1 . 2]" 1
1055 1 38 LEU MD2 1 42 TRP HZ2 . . 5.500 2.685 2.079 4.161 . 0 0 "[ . 1 . 2]" 1
1056 1 38 LEU HG 1 41 LYS HG2 . . 5.500 5.326 4.662 5.568 0.068 18 0 "[ . 1 . 2]" 1
1057 1 39 LEU H 1 39 LEU HB2 . . 4.150 2.202 2.064 2.464 . 0 0 "[ . 1 . 2]" 1
1058 1 39 LEU H 1 39 LEU QB . . 3.520 2.107 2.017 2.177 . 0 0 "[ . 1 . 2]" 1
1059 1 39 LEU H 1 39 LEU HB3 . . 4.150 2.822 2.411 3.065 . 0 0 "[ . 1 . 2]" 1
1060 1 39 LEU H 1 39 LEU QD . . 4.950 3.749 3.653 3.813 . 0 0 "[ . 1 . 2]" 1
1061 1 39 LEU H 1 39 LEU HG . . 5.500 4.147 3.893 4.496 . 0 0 "[ . 1 . 2]" 1
1062 1 39 LEU H 1 40 ASN H . . 3.380 2.803 2.658 2.922 . 0 0 "[ . 1 . 2]" 1
1063 1 39 LEU HA 1 39 LEU MD1 . . 4.180 3.682 3.241 3.845 . 0 0 "[ . 1 . 2]" 1
1064 1 39 LEU HA 1 39 LEU QD . . 2.760 2.369 2.138 2.532 . 0 0 "[ . 1 . 2]" 1
1065 1 39 LEU HA 1 39 LEU MD2 . . 4.180 2.399 2.169 2.571 . 0 0 "[ . 1 . 2]" 1
1066 1 39 LEU HA 1 39 LEU HG . . 3.840 2.815 2.382 3.829 . 0 0 "[ . 1 . 2]" 1
1067 1 39 LEU HA 1 42 TRP H . . 4.140 3.693 3.526 4.008 . 0 0 "[ . 1 . 2]" 1
1068 1 39 LEU HA 1 42 TRP HB2 . . 4.890 3.639 3.365 3.878 . 0 0 "[ . 1 . 2]" 1
1069 1 39 LEU HA 1 42 TRP HB3 . . 5.470 5.040 4.798 5.280 . 0 0 "[ . 1 . 2]" 1
1070 1 39 LEU HA 1 42 TRP HH2 . . 4.180 4.082 3.770 4.252 0.072 19 0 "[ . 1 . 2]" 1
1071 1 39 LEU HA 1 42 TRP HZ3 . . 4.350 3.391 3.167 3.687 . 0 0 "[ . 1 . 2]" 1
1072 1 39 LEU HA 1 43 LYS H . . 5.500 4.901 4.514 5.220 . 0 0 "[ . 1 . 2]" 1
1073 1 39 LEU QB 1 40 ASN H . . 3.180 2.367 2.274 2.451 . 0 0 "[ . 1 . 2]" 1
1074 1 39 LEU QB 1 40 ASN QD . . 5.180 3.818 3.032 4.673 . 0 0 "[ . 1 . 2]" 1
1075 1 39 LEU QD 1 42 TRP HB2 . . 5.440 3.360 2.985 3.835 . 0 0 "[ . 1 . 2]" 1
1076 1 39 LEU QD 1 42 TRP HE3 . . 3.720 2.331 1.944 2.591 . 0 0 "[ . 1 . 2]" 1
1077 1 39 LEU QD 1 42 TRP HH2 . . 4.760 4.061 3.609 4.336 . 0 0 "[ . 1 . 2]" 1
1078 1 39 LEU QD 1 42 TRP HZ3 . . 4.050 2.670 2.170 3.006 . 0 0 "[ . 1 . 2]" 1
1079 1 39 LEU QD 1 43 LYS QB . . 5.230 4.111 3.687 4.427 . 0 0 "[ . 1 . 2]" 1
1080 1 39 LEU QD 1 43 LYS HG3 . . 5.440 4.895 4.134 5.364 . 0 0 "[ . 1 . 2]" 1
1081 1 39 LEU MD1 1 40 ASN H . . 4.340 4.035 2.810 4.421 0.081 17 0 "[ . 1 . 2]" 1
1082 1 39 LEU MD2 1 40 ASN H . . 4.340 3.933 3.647 4.416 0.076 5 0 "[ . 1 . 2]" 1
1083 1 39 LEU HG 1 40 ASN H . . 4.870 4.851 4.537 4.968 0.098 1 0 "[ . 1 . 2]" 1
1084 1 40 ASN H 1 40 ASN QB . . 3.620 2.345 2.236 2.424 . 0 0 "[ . 1 . 2]" 1
1085 1 40 ASN H 1 40 ASN HD21 . . 5.500 3.202 2.412 4.227 . 0 0 "[ . 1 . 2]" 1
1086 1 40 ASN H 1 40 ASN HD22 . . 5.500 4.238 3.805 4.710 . 0 0 "[ . 1 . 2]" 1
1087 1 40 ASN H 1 41 LYS H . . 3.310 2.726 2.607 2.825 . 0 0 "[ . 1 . 2]" 1
1088 1 40 ASN H 1 41 LYS QB . . 5.340 4.470 4.310 4.646 . 0 0 "[ . 1 . 2]" 1
1089 1 40 ASN H 1 42 TRP HB2 . . 5.500 5.556 5.529 5.568 0.068 10 0 "[ . 1 . 2]" 1
1090 1 40 ASN H 1 43 LYS QD . . 5.270 4.988 4.547 5.343 0.073 4 0 "[ . 1 . 2]" 1
1091 1 40 ASN HA 1 43 LYS QD . . 3.930 2.593 2.136 3.326 . 0 0 "[ . 1 . 2]" 1
1092 1 40 ASN HA 1 43 LYS HG2 . . 5.470 2.215 2.056 2.493 . 0 0 "[ . 1 . 2]" 1
1093 1 40 ASN HA 1 43 LYS HG3 . . 5.150 2.920 2.433 3.312 . 0 0 "[ . 1 . 2]" 1
1094 1 40 ASN QB 1 41 LYS H . . 3.830 2.826 2.561 3.186 . 0 0 "[ . 1 . 2]" 1
1095 1 40 ASN QB 1 41 LYS QB . . 4.530 4.093 3.870 4.373 . 0 0 "[ . 1 . 2]" 1
1096 1 41 LYS H 1 41 LYS HB2 . . 3.740 2.503 2.308 2.692 . 0 0 "[ . 1 . 2]" 1
1097 1 41 LYS H 1 41 LYS HB3 . . 3.740 2.536 2.362 2.653 . 0 0 "[ . 1 . 2]" 1
1098 1 41 LYS H 1 42 TRP H . . 4.080 2.750 2.604 2.899 . 0 0 "[ . 1 . 2]" 1
1099 1 41 LYS H 1 44 GLN H . . 5.340 4.760 4.644 4.839 . 0 0 "[ . 1 . 2]" 1
1100 1 41 LYS HA 1 41 LYS QE . . 5.500 4.544 4.327 4.868 . 0 0 "[ . 1 . 2]" 1
1101 1 41 LYS HA 1 41 LYS HG2 . . 3.810 3.391 3.266 3.540 . 0 0 "[ . 1 . 2]" 1
1102 1 41 LYS HA 1 41 LYS HG3 . . 3.480 2.375 2.225 2.571 . 0 0 "[ . 1 . 2]" 1
1103 1 41 LYS HA 1 44 GLN H . . 3.660 3.401 3.259 3.498 . 0 0 "[ . 1 . 2]" 1
1104 1 41 LYS HA 1 44 GLN HB2 . . 2.990 2.911 2.500 3.048 0.058 12 0 "[ . 1 . 2]" 1
1105 1 41 LYS HA 1 44 GLN HB3 . . 3.030 2.435 2.273 2.806 . 0 0 "[ . 1 . 2]" 1
1106 1 41 LYS HA 1 45 HIS H . . 5.500 4.093 3.831 4.380 . 0 0 "[ . 1 . 2]" 1
1107 1 41 LYS HA 1 45 HIS HD2 . . 3.520 3.272 3.040 3.478 . 0 0 "[ . 1 . 2]" 1
1108 1 41 LYS QB 1 42 TRP HD1 . . 5.340 3.729 3.321 4.185 . 0 0 "[ . 1 . 2]" 1
1109 1 41 LYS QB 1 45 HIS HD2 . . 5.080 4.117 3.926 4.298 . 0 0 "[ . 1 . 2]" 1
1110 1 41 LYS HB2 1 41 LYS QE . . 3.340 2.755 2.368 3.398 0.058 16 0 "[ . 1 . 2]" 1
1111 1 41 LYS HB2 1 42 TRP H . . 4.200 4.027 3.875 4.210 0.010 6 0 "[ . 1 . 2]" 1
1112 1 41 LYS HB3 1 41 LYS QE . . 3.340 2.369 2.115 2.719 . 0 0 "[ . 1 . 2]" 1
1113 1 41 LYS HB3 1 42 TRP H . . 4.200 2.835 2.570 3.017 . 0 0 "[ . 1 . 2]" 1
1114 1 41 LYS QD 1 42 TRP HD1 . . 5.500 5.568 5.489 5.581 0.081 14 0 "[ . 1 . 2]" 1
1115 1 41 LYS QD 1 45 HIS HB2 . . 5.500 5.321 4.932 5.550 0.050 10 0 "[ . 1 . 2]" 1
1116 1 41 LYS QD 1 45 HIS HD2 . . 4.190 3.537 3.101 3.803 . 0 0 "[ . 1 . 2]" 1
1117 1 41 LYS QE 1 41 LYS HG2 . . 3.660 2.410 2.206 2.561 . 0 0 "[ . 1 . 2]" 1
1118 1 41 LYS QE 1 41 LYS HG3 . . 3.670 3.319 3.187 3.420 . 0 0 "[ . 1 . 2]" 1
1119 1 41 LYS QE 1 42 TRP HA . . 5.500 5.482 5.234 5.577 0.077 4 0 "[ . 1 . 2]" 1
1120 1 41 LYS QE 1 45 HIS HD2 . . 5.350 4.823 4.587 5.080 . 0 0 "[ . 1 . 2]" 1
1121 1 41 LYS HG2 1 45 HIS HD2 . . 3.570 3.014 2.544 3.340 . 0 0 "[ . 1 . 2]" 1
1122 1 41 LYS HG3 1 42 TRP H . . 4.580 4.595 4.410 4.648 0.068 13 0 "[ . 1 . 2]" 1
1123 1 41 LYS HG3 1 45 HIS HD2 . . 5.190 2.080 1.951 2.295 . 0 0 "[ . 1 . 2]" 1
1124 1 41 LYS HG3 1 49 LEU MD1 . . 5.500 4.994 4.576 5.559 0.059 20 0 "[ . 1 . 2]" 1
1125 1 42 TRP H 1 42 TRP HD1 . . 4.280 3.113 2.828 3.312 . 0 0 "[ . 1 . 2]" 1
1126 1 42 TRP H 1 43 LYS H . . 5.500 2.905 2.799 3.041 . 0 0 "[ . 1 . 2]" 1
1127 1 42 TRP H 1 44 GLN H . . 4.040 4.048 3.867 4.110 0.070 10 0 "[ . 1 . 2]" 1
1128 1 42 TRP HA 1 42 TRP HD1 . . 3.110 2.396 2.222 2.586 . 0 0 "[ . 1 . 2]" 1
1129 1 42 TRP HA 1 45 HIS HD2 . . 4.960 4.747 4.469 5.005 0.045 5 0 "[ . 1 . 2]" 1
1130 1 42 TRP HA 1 49 LEU MD1 . . 3.370 1.963 1.900 2.039 . 0 0 "[ . 1 . 2]" 1
1131 1 42 TRP HA 1 49 LEU MD2 . . 5.430 3.704 3.506 4.064 . 0 0 "[ . 1 . 2]" 1
1132 1 42 TRP HB2 1 43 LYS H . . 3.960 2.422 2.266 2.723 . 0 0 "[ . 1 . 2]" 1
1133 1 42 TRP HB2 1 49 LEU MD1 . . 4.080 4.049 3.878 4.143 0.063 2 0 "[ . 1 . 2]" 1
1134 1 42 TRP HB3 1 43 LYS H . . 4.190 3.569 3.415 3.820 . 0 0 "[ . 1 . 2]" 1
1135 1 42 TRP HB3 1 43 LYS HA . . 5.500 4.393 4.279 4.541 . 0 0 "[ . 1 . 2]" 1
1136 1 42 TRP HB3 1 49 LEU MD1 . . 3.960 2.843 2.593 2.970 . 0 0 "[ . 1 . 2]" 1
1137 1 42 TRP HB3 1 49 LEU MD2 . . 4.580 4.626 4.467 4.670 0.090 10 0 "[ . 1 . 2]" 1
1138 1 42 TRP HD1 1 49 LEU MD1 . . 3.400 2.940 2.501 3.391 . 0 0 "[ . 1 . 2]" 1
1139 1 42 TRP HE3 1 43 LYS H . . 4.810 4.611 4.386 4.875 0.065 5 0 "[ . 1 . 2]" 1
1140 1 42 TRP HE3 1 43 LYS HG2 . . 5.430 5.442 5.067 5.499 0.069 2 0 "[ . 1 . 2]" 1
1141 1 43 LYS H 1 43 LYS QB . . 3.070 2.742 2.542 2.890 . 0 0 "[ . 1 . 2]" 1
1142 1 43 LYS H 1 43 LYS HD2 . . 5.500 4.362 4.001 4.723 . 0 0 "[ . 1 . 2]" 1
1143 1 43 LYS H 1 43 LYS HD3 . . 5.500 4.350 4.116 4.630 . 0 0 "[ . 1 . 2]" 1
1144 1 43 LYS H 1 43 LYS HG2 . . 5.500 2.020 1.890 2.135 . 0 0 "[ . 1 . 2]" 1
1145 1 43 LYS H 1 44 GLN H . . 3.440 2.615 2.408 2.691 . 0 0 "[ . 1 . 2]" 1
1146 1 43 LYS H 1 44 GLN HA . . 5.200 5.223 5.086 5.266 0.066 7 0 "[ . 1 . 2]" 1
1147 1 43 LYS HA 1 43 LYS QB . . 2.560 2.161 2.136 2.181 . 0 0 "[ . 1 . 2]" 1
1148 1 43 LYS HA 1 43 LYS HG2 . . 3.800 3.743 3.696 3.810 0.010 14 0 "[ . 1 . 2]" 1
1149 1 43 LYS HA 1 43 LYS HG3 . . 3.910 3.783 3.727 3.858 . 0 0 "[ . 1 . 2]" 1
1150 1 43 LYS HA 1 45 HIS H . . 4.500 4.425 4.114 4.565 0.065 15 0 "[ . 1 . 2]" 1
1151 1 43 LYS HA 1 46 LYS H . . 3.810 3.608 3.342 3.837 0.027 20 0 "[ . 1 . 2]" 1
1152 1 43 LYS HA 1 46 LYS QG . . 4.450 3.726 3.076 4.511 0.061 4 0 "[ . 1 . 2]" 1
1153 1 43 LYS QB 1 43 LYS QD . . 3.100 2.328 2.142 2.429 . 0 0 "[ . 1 . 2]" 1
1154 1 43 LYS QB 1 43 LYS QE . . 4.200 2.301 1.966 3.555 . 0 0 "[ . 1 . 2]" 1
1155 1 43 LYS QB 1 44 GLN H . . 3.670 3.597 3.481 3.726 0.056 4 0 "[ . 1 . 2]" 1
1156 1 43 LYS HB2 1 44 GLN H . . 4.260 3.891 3.709 4.078 . 0 0 "[ . 1 . 2]" 1
1157 1 43 LYS HB3 1 44 GLN H . . 4.260 4.240 4.118 4.319 0.059 2 0 "[ . 1 . 2]" 1
1158 1 43 LYS QE 1 43 LYS HG3 . . 3.540 2.301 2.058 3.267 . 0 0 "[ . 1 . 2]" 1
1159 1 43 LYS HE2 1 44 GLN H . . 5.500 4.601 3.904 5.563 0.063 10 0 "[ . 1 . 2]" 1
1160 1 43 LYS HE3 1 44 GLN H . . 5.500 5.132 4.554 5.567 0.067 7 0 "[ . 1 . 2]" 1
1161 1 43 LYS HG3 1 44 GLN H . . 4.530 2.511 2.180 2.858 . 0 0 "[ . 1 . 2]" 1
1162 1 43 LYS HG3 1 44 GLN HA . . 4.090 3.782 3.431 4.134 0.044 7 0 "[ . 1 . 2]" 1
1163 1 43 LYS HG3 1 44 GLN HB2 . . 4.340 3.709 3.475 3.872 . 0 0 "[ . 1 . 2]" 1
1164 1 44 GLN H 1 44 GLN HB2 . . 2.800 2.436 2.278 2.589 . 0 0 "[ . 1 . 2]" 1
1165 1 44 GLN H 1 44 GLN HB3 . . 3.440 2.549 2.393 2.688 . 0 0 "[ . 1 . 2]" 1
1166 1 44 GLN H 1 44 GLN HG3 . . 4.590 4.473 4.408 4.520 . 0 0 "[ . 1 . 2]" 1
1167 1 44 GLN H 1 45 HIS H . . 3.310 2.812 2.617 2.985 . 0 0 "[ . 1 . 2]" 1
1168 1 44 GLN H 1 45 HIS HD2 . . 5.500 4.637 4.396 4.834 . 0 0 "[ . 1 . 2]" 1
1169 1 44 GLN H 1 46 LYS H . . 4.420 4.327 4.053 4.481 0.061 20 0 "[ . 1 . 2]" 1
1170 1 44 GLN HA 1 44 GLN QE . . 4.850 4.041 3.180 4.615 . 0 0 "[ . 1 . 2]" 1
1171 1 44 GLN HA 1 44 GLN HG2 . . 3.910 3.839 3.723 3.930 0.020 2 0 "[ . 1 . 2]" 1
1172 1 44 GLN HA 1 44 GLN HG3 . . 3.170 2.943 2.563 3.125 . 0 0 "[ . 1 . 2]" 1
1173 1 44 GLN HA 1 46 LYS H . . 5.420 4.217 4.118 4.371 . 0 0 "[ . 1 . 2]" 1
1174 1 44 GLN HB2 1 45 HIS H . . 3.970 3.802 3.600 3.963 . 0 0 "[ . 1 . 2]" 1
1175 1 44 GLN HB2 1 45 HIS HD2 . . 5.500 4.373 4.116 4.782 . 0 0 "[ . 1 . 2]" 1
1176 1 44 GLN HB3 1 45 HIS H . . 3.780 2.470 2.282 2.675 . 0 0 "[ . 1 . 2]" 1
1177 1 44 GLN HB3 1 45 HIS HD2 . . 3.440 2.683 2.460 3.113 . 0 0 "[ . 1 . 2]" 1
1178 1 44 GLN HB3 1 45 HIS HE1 . . 5.080 4.958 4.811 5.135 0.055 5 0 "[ . 1 . 2]" 1
1179 1 44 GLN QE 1 45 HIS HE1 . . 4.560 3.956 3.354 4.632 0.072 14 0 "[ . 1 . 2]" 1
1180 1 44 GLN HE22 1 44 GLN HG3 . . 3.990 3.695 3.504 4.035 0.045 13 0 "[ . 1 . 2]" 1
1181 1 44 GLN HG2 1 45 HIS HD2 . . 3.610 3.604 3.398 3.669 0.059 13 0 "[ . 1 . 2]" 1
1182 1 44 GLN HG2 1 45 HIS HE1 . . 3.590 3.599 3.362 3.654 0.064 17 0 "[ . 1 . 2]" 1
1183 1 44 GLN HG3 1 45 HIS H . . 4.030 3.795 3.472 4.080 0.050 14 0 "[ . 1 . 2]" 1
1184 1 44 GLN HG3 1 45 HIS HD2 . . 4.570 3.956 3.666 4.471 . 0 0 "[ . 1 . 2]" 1
1185 1 45 HIS H 1 45 HIS HB2 . . 3.430 2.619 2.503 2.801 . 0 0 "[ . 1 . 2]" 1
1186 1 45 HIS H 1 45 HIS HB3 . . 4.040 3.714 3.646 3.803 . 0 0 "[ . 1 . 2]" 1
1187 1 45 HIS H 1 45 HIS HD2 . . 3.910 2.961 2.738 3.203 . 0 0 "[ . 1 . 2]" 1
1188 1 45 HIS H 1 46 LYS H . . 3.240 2.887 2.667 3.053 . 0 0 "[ . 1 . 2]" 1
1189 1 45 HIS HA 1 45 HIS HB3 . . 2.980 2.402 2.324 2.432 . 0 0 "[ . 1 . 2]" 1
1190 1 45 HIS HA 1 48 GLU HG2 . . 5.000 4.336 4.039 4.625 . 0 0 "[ . 1 . 2]" 1
1191 1 45 HIS HB2 1 45 HIS HD2 . . 3.470 2.603 2.502 2.740 . 0 0 "[ . 1 . 2]" 1
1192 1 45 HIS HB2 1 46 LYS H . . 4.380 4.268 4.195 4.379 . 0 0 "[ . 1 . 2]" 1
1193 1 45 HIS HB2 1 48 GLU H . . 5.500 4.885 4.407 5.125 . 0 0 "[ . 1 . 2]" 1
1194 1 45 HIS HB2 1 48 GLU QB . . 4.500 3.443 2.933 3.683 . 0 0 "[ . 1 . 2]" 1
1195 1 45 HIS HB2 1 49 LEU H . . 4.320 4.147 3.969 4.361 0.041 7 0 "[ . 1 . 2]" 1
1196 1 45 HIS HB2 1 49 LEU MD1 . . 4.150 2.967 2.628 3.975 . 0 0 "[ . 1 . 2]" 1
1197 1 45 HIS HB2 1 49 LEU MD2 . . 5.500 4.133 3.878 4.761 . 0 0 "[ . 1 . 2]" 1
1198 1 45 HIS HB2 1 49 LEU HG . . 4.990 3.151 2.939 3.484 . 0 0 "[ . 1 . 2]" 1
1199 1 45 HIS HB3 1 45 HIS HD2 . . 3.930 3.747 3.643 3.837 . 0 0 "[ . 1 . 2]" 1
1200 1 45 HIS HB3 1 48 GLU H . . 5.500 3.810 3.498 3.989 . 0 0 "[ . 1 . 2]" 1
1201 1 45 HIS HB3 1 48 GLU QB . . 4.770 2.276 1.965 2.446 . 0 0 "[ . 1 . 2]" 1
1202 1 45 HIS HB3 1 48 GLU HG2 . . 4.610 4.052 3.616 4.389 . 0 0 "[ . 1 . 2]" 1
1203 1 45 HIS HB3 1 48 GLU HG3 . . 5.500 2.577 2.111 3.070 . 0 0 "[ . 1 . 2]" 1
1204 1 45 HIS HB3 1 49 LEU H . . 4.490 3.845 3.708 4.120 . 0 0 "[ . 1 . 2]" 1
1205 1 45 HIS HB3 1 49 LEU MD1 . . 5.270 4.102 3.784 5.088 . 0 0 "[ . 1 . 2]" 1
1206 1 45 HIS HB3 1 49 LEU HG . . 4.760 3.755 3.454 4.503 . 0 0 "[ . 1 . 2]" 1
1207 1 46 LYS H 1 46 LYS HB2 . . 2.920 2.402 2.278 2.606 . 0 0 "[ . 1 . 2]" 1
1208 1 46 LYS H 1 46 LYS HB3 . . 3.000 2.722 2.469 3.024 0.024 3 0 "[ . 1 . 2]" 1
1209 1 46 LYS H 1 46 LYS HG2 . . 5.330 4.510 4.429 4.633 . 0 0 "[ . 1 . 2]" 1
1210 1 46 LYS H 1 46 LYS QG . . 4.590 3.933 3.838 4.006 . 0 0 "[ . 1 . 2]" 1
1211 1 46 LYS H 1 46 LYS HG3 . . 5.330 4.338 4.107 4.492 . 0 0 "[ . 1 . 2]" 1
1212 1 46 LYS H 1 47 GLN H . . 3.580 3.143 2.810 3.308 . 0 0 "[ . 1 . 2]" 1
1213 1 46 LYS H 1 49 LEU MD1 . . 4.470 3.802 3.557 4.518 0.048 20 0 "[ . 1 . 2]" 1
1214 1 46 LYS HA 1 46 LYS HG2 . . 3.730 2.913 2.453 3.459 . 0 0 "[ . 1 . 2]" 1
1215 1 46 LYS HA 1 46 LYS QG . . 3.240 2.366 2.173 2.483 . 0 0 "[ . 1 . 2]" 1
1216 1 46 LYS HA 1 46 LYS HG3 . . 3.730 2.586 2.251 3.034 . 0 0 "[ . 1 . 2]" 1
1217 1 46 LYS HA 1 49 LEU H . . 3.840 3.687 3.413 3.813 . 0 0 "[ . 1 . 2]" 1
1218 1 46 LYS HA 1 49 LEU HB2 . . 3.460 2.878 2.677 3.018 . 0 0 "[ . 1 . 2]" 1
1219 1 46 LYS HA 1 49 LEU HB3 . . 5.120 4.465 4.255 4.650 . 0 0 "[ . 1 . 2]" 1
1220 1 46 LYS HA 1 49 LEU MD1 . . 3.330 2.339 2.081 2.728 . 0 0 "[ . 1 . 2]" 1
1221 1 46 LYS HA 1 50 ILE H . . 4.060 3.958 3.775 4.086 0.026 11 0 "[ . 1 . 2]" 1
1222 1 46 LYS HA 1 50 ILE MD . . 3.920 3.888 3.795 3.981 0.061 1 0 "[ . 1 . 2]" 1
1223 1 46 LYS HA 1 50 ILE HG13 . . 3.890 3.940 3.793 3.958 0.068 11 0 "[ . 1 . 2]" 1
1224 1 46 LYS HB2 1 46 LYS HE2 . . 5.460 4.222 2.293 5.087 . 0 0 "[ . 1 . 2]" 1
1225 1 46 LYS HB2 1 46 LYS QE . . 4.600 3.602 2.263 4.371 . 0 0 "[ . 1 . 2]" 1
1226 1 46 LYS HB2 1 46 LYS HE3 . . 5.460 4.151 2.285 4.880 . 0 0 "[ . 1 . 2]" 1
1227 1 46 LYS HB2 1 47 GLN H . . 4.200 3.812 3.645 4.094 . 0 0 "[ . 1 . 2]" 1
1228 1 46 LYS HB2 1 50 ILE MD . . 4.340 4.401 4.287 4.431 0.091 16 0 "[ . 1 . 2]" 1
1229 1 46 LYS HB3 1 46 LYS HE2 . . 5.290 3.830 1.950 4.785 . 0 0 "[ . 1 . 2]" 1
1230 1 46 LYS HB3 1 46 LYS QE . . 4.470 3.284 1.937 4.340 . 0 0 "[ . 1 . 2]" 1
1231 1 46 LYS HB3 1 46 LYS HE3 . . 5.290 3.882 2.110 5.032 . 0 0 "[ . 1 . 2]" 1
1232 1 46 LYS HB3 1 47 GLN H . . 3.200 2.458 2.255 2.757 . 0 0 "[ . 1 . 2]" 1
1233 1 46 LYS HB3 1 47 GLN HG2 . . 4.960 4.878 4.012 5.031 0.071 12 0 "[ . 1 . 2]" 1
1234 1 46 LYS HB3 1 48 GLU H . . 5.500 4.931 4.706 5.125 . 0 0 "[ . 1 . 2]" 1
1235 1 46 LYS QE 1 46 LYS QG . . 3.320 2.394 1.985 2.889 . 0 0 "[ . 1 . 2]" 1
1236 1 46 LYS HE2 1 50 ILE MD . . 5.040 3.145 1.863 4.532 . 0 0 "[ . 1 . 2]" 1
1237 1 46 LYS HE3 1 50 ILE MD . . 5.040 3.424 1.909 4.558 . 0 0 "[ . 1 . 2]" 1
1238 1 46 LYS QG 1 47 GLN H . . 4.330 3.622 3.132 3.969 . 0 0 "[ . 1 . 2]" 1
1239 1 46 LYS QG 1 47 GLN HA . . 4.470 3.746 3.196 4.123 . 0 0 "[ . 1 . 2]" 1
1240 1 46 LYS QG 1 50 ILE MD . . 3.190 2.043 1.821 2.216 . 0 0 "[ . 1 . 2]" 1
1241 1 47 GLN H 1 47 GLN HB2 . . 2.790 2.106 1.995 2.204 . 0 0 "[ . 1 . 2]" 1
1242 1 47 GLN H 1 47 GLN HB3 . . 3.490 3.220 3.009 3.494 0.004 9 0 "[ . 1 . 2]" 1
1243 1 47 GLN H 1 47 GLN HG2 . . 3.830 3.709 3.149 3.886 0.056 3 0 "[ . 1 . 2]" 1
1244 1 47 GLN H 1 47 GLN HG3 . . 5.440 4.218 3.841 4.432 . 0 0 "[ . 1 . 2]" 1
1245 1 47 GLN H 1 48 GLU H . . 3.470 2.722 2.596 2.882 . 0 0 "[ . 1 . 2]" 1
1246 1 47 GLN H 1 50 ILE MD . . 4.060 3.647 3.526 3.775 . 0 0 "[ . 1 . 2]" 1
1247 1 47 GLN HA 1 47 GLN HE21 . . 4.130 2.341 1.927 2.889 . 0 0 "[ . 1 . 2]" 1
1248 1 47 GLN HA 1 47 GLN HE22 . . 4.120 3.743 3.434 3.965 . 0 0 "[ . 1 . 2]" 1
1249 1 47 GLN HA 1 47 GLN HG2 . . 3.160 2.270 2.145 2.450 . 0 0 "[ . 1 . 2]" 1
1250 1 47 GLN HA 1 49 LEU H . . 4.750 4.492 4.256 4.777 0.027 14 0 "[ . 1 . 2]" 1
1251 1 47 GLN HA 1 50 ILE H . . 3.820 3.422 3.256 3.726 . 0 0 "[ . 1 . 2]" 1
1252 1 47 GLN HA 1 50 ILE HB . . 2.980 2.573 2.201 2.887 . 0 0 "[ . 1 . 2]" 1
1253 1 47 GLN HA 1 50 ILE MD . . 2.970 2.074 1.978 2.186 . 0 0 "[ . 1 . 2]" 1
1254 1 47 GLN HA 1 50 ILE HG12 . . 5.370 4.700 4.492 4.946 . 0 0 "[ . 1 . 2]" 1
1255 1 47 GLN HA 1 50 ILE MG . . 4.320 3.929 3.673 4.099 . 0 0 "[ . 1 . 2]" 1
1256 1 47 GLN HA 1 51 ASP H . . 4.440 3.873 3.682 4.184 . 0 0 "[ . 1 . 2]" 1
1257 1 47 GLN HB2 1 47 GLN HE21 . . 4.290 4.042 3.641 4.359 0.069 19 0 "[ . 1 . 2]" 1
1258 1 47 GLN HB2 1 47 GLN HE22 . . 5.140 5.093 4.947 5.208 0.068 7 0 "[ . 1 . 2]" 1
1259 1 47 GLN HB2 1 48 GLU H . . 3.420 3.346 3.118 3.480 0.060 19 0 "[ . 1 . 2]" 1
1260 1 47 GLN HB3 1 47 GLN HE21 . . 4.290 3.391 2.503 4.306 0.016 19 0 "[ . 1 . 2]" 1
1261 1 47 GLN HB3 1 47 GLN HE22 . . 4.470 4.079 3.654 4.529 0.059 11 0 "[ . 1 . 2]" 1
1262 1 47 GLN HB3 1 47 GLN HG3 . . 2.850 2.567 2.454 2.655 . 0 0 "[ . 1 . 2]" 1
1263 1 47 GLN HB3 1 48 GLU H . . 3.290 2.943 2.529 3.287 . 0 0 "[ . 1 . 2]" 1
1264 1 47 GLN HB3 1 48 GLU HG2 . . 3.910 3.683 3.184 3.973 0.063 6 0 "[ . 1 . 2]" 1
1265 1 47 GLN HB3 1 50 ILE MD . . 4.770 4.639 4.455 4.845 0.075 14 0 "[ . 1 . 2]" 1
1266 1 47 GLN HB3 1 51 ASP H . . 5.500 5.116 4.851 5.458 . 0 0 "[ . 1 . 2]" 1
1267 1 47 GLN HE21 1 47 GLN HG2 . . 2.860 2.636 2.242 2.937 0.077 9 0 "[ . 1 . 2]" 1
1268 1 47 GLN HE21 1 50 ILE HB . . 4.080 2.781 2.497 3.255 . 0 0 "[ . 1 . 2]" 1
1269 1 47 GLN HE21 1 50 ILE MG . . 3.560 3.328 2.502 3.629 0.069 9 0 "[ . 1 . 2]" 1
1270 1 47 GLN HE21 1 51 ASP H . . 4.390 3.497 2.688 4.450 0.060 11 0 "[ . 1 . 2]" 1
1271 1 47 GLN HE22 1 47 GLN HG2 . . 3.710 3.669 3.515 3.777 0.067 6 0 "[ . 1 . 2]" 1
1272 1 47 GLN HE22 1 50 ILE HB . . 4.190 3.703 2.993 4.056 . 0 0 "[ . 1 . 2]" 1
1273 1 47 GLN HE22 1 50 ILE MD . . 4.520 4.327 3.669 4.605 0.085 3 0 "[ . 1 . 2]" 1
1274 1 47 GLN HE22 1 50 ILE MG . . 3.870 3.563 2.488 3.947 0.077 4 0 "[ . 1 . 2]" 1
1275 1 47 GLN HE22 1 51 ASP H . . 4.590 3.810 3.381 4.309 . 0 0 "[ . 1 . 2]" 1
1276 1 47 GLN HE22 1 51 ASP HB2 . . 5.500 3.177 2.335 3.936 . 0 0 "[ . 1 . 2]" 1
1277 1 47 GLN HG2 1 48 GLU H . . 5.060 5.011 4.809 5.110 0.050 20 0 "[ . 1 . 2]" 1
1278 1 47 GLN HG2 1 50 ILE MD . . 3.670 3.080 2.714 3.667 . 0 0 "[ . 1 . 2]" 1
1279 1 48 GLU H 1 48 GLU QB . . 2.950 2.750 2.622 2.829 . 0 0 "[ . 1 . 2]" 1
1280 1 48 GLU H 1 48 GLU HG2 . . 3.000 2.611 2.348 2.884 . 0 0 "[ . 1 . 2]" 1
1281 1 48 GLU H 1 48 GLU HG3 . . 3.470 2.012 1.838 2.225 . 0 0 "[ . 1 . 2]" 1
1282 1 48 GLU H 1 49 LEU H . . 2.870 2.713 2.546 2.893 0.023 3 0 "[ . 1 . 2]" 1
1283 1 48 GLU H 1 50 ILE MD . . 4.720 4.802 4.702 4.818 0.098 4 0 "[ . 1 . 2]" 1
1284 1 48 GLU HA 1 48 GLU HG2 . . 2.860 2.711 2.590 2.813 . 0 0 "[ . 1 . 2]" 1
1285 1 48 GLU HA 1 48 GLU HG3 . . 3.570 3.531 3.374 3.631 0.061 11 0 "[ . 1 . 2]" 1
1286 1 48 GLU HA 1 49 LEU H . . 3.560 3.558 3.520 3.598 0.038 20 0 "[ . 1 . 2]" 1
1287 1 48 GLU HA 1 51 ASP H . . 3.940 3.748 3.570 3.951 0.011 1 0 "[ . 1 . 2]" 1
1288 1 48 GLU HA 1 51 ASP HB2 . . 4.250 3.463 2.786 3.911 . 0 0 "[ . 1 . 2]" 1
1289 1 48 GLU HA 1 51 ASP HB3 . . 3.730 3.209 2.701 3.653 . 0 0 "[ . 1 . 2]" 1
1290 1 48 GLU QB 1 49 LEU H . . 3.330 2.565 2.381 2.824 . 0 0 "[ . 1 . 2]" 1
1291 1 48 GLU HG2 1 49 LEU H . . 4.800 4.608 4.439 4.776 . 0 0 "[ . 1 . 2]" 1
1292 1 48 GLU HG3 1 49 LEU H . . 4.260 3.787 3.559 3.998 . 0 0 "[ . 1 . 2]" 1
1293 1 49 LEU H 1 49 LEU HB2 . . 3.050 2.379 2.244 2.469 . 0 0 "[ . 1 . 2]" 1
1294 1 49 LEU H 1 49 LEU HB3 . . 3.660 3.591 3.539 3.636 . 0 0 "[ . 1 . 2]" 1
1295 1 49 LEU H 1 49 LEU MD1 . . 3.400 3.172 3.032 3.472 0.072 16 0 "[ . 1 . 2]" 1
1296 1 49 LEU H 1 49 LEU MD2 . . 3.900 3.850 3.740 3.955 0.055 11 0 "[ . 1 . 2]" 1
1297 1 49 LEU H 1 49 LEU HG . . 3.200 2.472 2.291 2.715 . 0 0 "[ . 1 . 2]" 1
1298 1 49 LEU H 1 50 ILE H . . 4.350 2.648 2.411 2.743 . 0 0 "[ . 1 . 2]" 1
1299 1 49 LEU H 1 50 ILE HB . . 5.070 4.820 4.606 4.993 . 0 0 "[ . 1 . 2]" 1
1300 1 49 LEU HA 1 49 LEU MD2 . . 2.920 2.371 2.267 2.586 . 0 0 "[ . 1 . 2]" 1
1301 1 49 LEU HA 1 52 PHE H . . 5.210 3.447 3.379 3.564 . 0 0 "[ . 1 . 2]" 1
1302 1 49 LEU HA 1 52 PHE HA . . 5.500 5.424 5.272 5.520 0.020 18 0 "[ . 1 . 2]" 1
1303 1 49 LEU HA 1 52 PHE HB2 . . 3.650 3.665 3.472 3.712 0.062 4 0 "[ . 1 . 2]" 1
1304 1 49 LEU HA 1 52 PHE HB3 . . 3.570 2.647 2.446 2.796 . 0 0 "[ . 1 . 2]" 1
1305 1 49 LEU HB2 1 49 LEU MD1 . . 3.490 2.106 2.004 2.151 . 0 0 "[ . 1 . 2]" 1
1306 1 49 LEU HB2 1 49 LEU MD2 . . 3.220 3.187 3.110 3.245 0.025 16 0 "[ . 1 . 2]" 1
1307 1 49 LEU HB2 1 50 ILE H . . 4.260 2.439 2.352 2.592 . 0 0 "[ . 1 . 2]" 1
1308 1 49 LEU HB2 1 50 ILE HA . . 4.360 4.270 4.182 4.363 0.003 20 0 "[ . 1 . 2]" 1
1309 1 49 LEU HB2 1 51 ASP H . . 5.500 5.102 5.001 5.189 . 0 0 "[ . 1 . 2]" 1
1310 1 49 LEU HB3 1 49 LEU MD1 . . 3.240 2.571 2.286 2.719 . 0 0 "[ . 1 . 2]" 1
1311 1 49 LEU HB3 1 49 LEU MD2 . . 2.840 2.205 2.044 2.292 . 0 0 "[ . 1 . 2]" 1
1312 1 49 LEU HB3 1 50 ILE H . . 3.760 3.392 3.115 3.617 . 0 0 "[ . 1 . 2]" 1
1313 1 49 LEU HB3 1 50 ILE HA . . 5.360 4.144 3.922 4.348 . 0 0 "[ . 1 . 2]" 1
1314 1 49 LEU HB3 1 53 LEU HG . . 5.500 4.692 4.547 4.851 . 0 0 "[ . 1 . 2]" 1
1315 1 49 LEU MD1 1 50 ILE H . . 4.020 4.104 4.056 4.123 0.103 10 0 "[ . 1 . 2]" 1
1316 1 49 LEU MD1 1 50 ILE HG13 . . 4.570 4.638 4.482 4.658 0.088 15 0 "[ . 1 . 2]" 1
1317 1 49 LEU MD2 1 52 PHE HB2 . . 5.500 4.819 4.594 4.984 . 0 0 "[ . 1 . 2]" 1
1318 1 50 ILE H 1 50 ILE HB . . 3.210 2.525 2.445 2.594 . 0 0 "[ . 1 . 2]" 1
1319 1 50 ILE H 1 50 ILE MD . . 3.370 3.269 3.157 3.378 0.008 20 0 "[ . 1 . 2]" 1
1320 1 50 ILE H 1 50 ILE HG12 . . 4.140 3.801 3.547 3.862 . 0 0 "[ . 1 . 2]" 1
1321 1 50 ILE H 1 50 ILE HG13 . . 3.310 2.366 2.079 2.439 . 0 0 "[ . 1 . 2]" 1
1322 1 50 ILE HA 1 50 ILE MD . . 3.900 3.912 3.862 3.950 0.050 3 0 "[ . 1 . 2]" 1
1323 1 50 ILE HA 1 50 ILE HG12 . . 3.260 2.789 2.662 2.912 . 0 0 "[ . 1 . 2]" 1
1324 1 50 ILE HA 1 50 ILE HG13 . . 3.460 2.727 2.652 2.788 . 0 0 "[ . 1 . 2]" 1
1325 1 50 ILE HA 1 50 ILE MG . . 3.090 2.541 2.372 2.641 . 0 0 "[ . 1 . 2]" 1
1326 1 50 ILE HA 1 52 PHE H . . 4.120 4.158 3.720 4.197 0.077 4 0 "[ . 1 . 2]" 1
1327 1 50 ILE HA 1 52 PHE HB3 . . 5.500 5.129 5.062 5.204 . 0 0 "[ . 1 . 2]" 1
1328 1 50 ILE HA 1 53 LEU H . . 3.700 3.481 3.378 3.606 . 0 0 "[ . 1 . 2]" 1
1329 1 50 ILE HA 1 53 LEU HB2 . . 3.940 2.785 2.680 2.981 . 0 0 "[ . 1 . 2]" 1
1330 1 50 ILE HA 1 53 LEU HB3 . . 4.620 4.368 4.207 4.604 . 0 0 "[ . 1 . 2]" 1
1331 1 50 ILE HA 1 53 LEU HG . . 4.770 4.599 4.426 4.807 0.037 11 0 "[ . 1 . 2]" 1
1332 1 50 ILE HA 1 54 ASN H . . 3.830 3.873 3.788 3.898 0.068 5 0 "[ . 1 . 2]" 1
1333 1 50 ILE HA 1 54 ASN HB2 . . 5.500 4.217 4.052 4.322 . 0 0 "[ . 1 . 2]" 1
1334 1 50 ILE HA 1 54 ASN HD21 . . 5.140 4.739 4.138 5.071 . 0 0 "[ . 1 . 2]" 1
1335 1 50 ILE HB 1 50 ILE MD . . 2.930 2.315 2.245 2.374 . 0 0 "[ . 1 . 2]" 1
1336 1 50 ILE HB 1 51 ASP H . . 2.940 2.434 2.208 2.555 . 0 0 "[ . 1 . 2]" 1
1337 1 50 ILE HB 1 51 ASP HA . . 4.850 4.327 4.195 4.478 . 0 0 "[ . 1 . 2]" 1
1338 1 50 ILE HB 1 51 ASP HB2 . . 4.510 4.089 3.777 4.493 . 0 0 "[ . 1 . 2]" 1
1339 1 50 ILE HB 1 51 ASP HB3 . . 5.120 5.095 4.772 5.200 0.080 5 0 "[ . 1 . 2]" 1
1340 1 50 ILE HB 1 54 ASN HD21 . . 5.500 5.532 5.246 5.579 0.079 4 0 "[ . 1 . 2]" 1
1341 1 50 ILE HG12 1 50 ILE MG . . 3.550 2.316 2.172 2.355 . 0 0 "[ . 1 . 2]" 1
1342 1 50 ILE HG12 1 51 ASP H . . 5.080 5.057 4.916 5.124 0.044 20 0 "[ . 1 . 2]" 1
1343 1 50 ILE MG 1 51 ASP H . . 3.230 3.100 2.983 3.239 0.009 1 0 "[ . 1 . 2]" 1
1344 1 50 ILE MG 1 51 ASP HA . . 3.690 3.194 3.086 3.427 . 0 0 "[ . 1 . 2]" 1
1345 1 50 ILE MG 1 51 ASP HB3 . . 5.500 5.067 4.883 5.208 . 0 0 "[ . 1 . 2]" 1
1346 1 50 ILE MG 1 52 PHE H . . 4.710 4.735 4.462 4.782 0.072 3 0 "[ . 1 . 2]" 1
1347 1 50 ILE MG 1 53 LEU H . . 5.500 4.878 4.660 5.017 . 0 0 "[ . 1 . 2]" 1
1348 1 50 ILE MG 1 54 ASN HA . . 5.270 4.837 4.679 4.984 . 0 0 "[ . 1 . 2]" 1
1349 1 50 ILE MG 1 54 ASN HB2 . . 3.760 2.907 2.702 2.991 . 0 0 "[ . 1 . 2]" 1
1350 1 50 ILE MG 1 54 ASN HB3 . . 4.000 4.069 4.006 4.088 0.088 12 0 "[ . 1 . 2]" 1
1351 1 50 ILE MG 1 54 ASN HD21 . . 3.310 2.667 2.518 2.807 . 0 0 "[ . 1 . 2]" 1
1352 1 50 ILE MG 1 54 ASN HD22 . . 4.080 3.950 3.616 4.099 0.019 14 0 "[ . 1 . 2]" 1
1353 1 50 ILE MG 1 61 GLN QE . . 5.090 4.737 3.599 5.207 0.117 3 0 "[ . 1 . 2]" 1
1354 1 51 ASP H 1 51 ASP HB2 . . 2.880 2.185 1.905 2.556 . 0 0 "[ . 1 . 2]" 1
1355 1 51 ASP H 1 51 ASP HB3 . . 3.470 2.720 2.411 3.063 . 0 0 "[ . 1 . 2]" 1
1356 1 51 ASP H 1 52 PHE H . . 3.220 2.803 2.681 2.942 . 0 0 "[ . 1 . 2]" 1
1357 1 51 ASP H 1 52 PHE HB3 . . 5.500 4.937 4.797 5.064 . 0 0 "[ . 1 . 2]" 1
1358 1 51 ASP HA 1 51 ASP HB2 . . 2.870 2.595 2.412 2.870 0.000 5 0 "[ . 1 . 2]" 1
1359 1 51 ASP HA 1 54 ASN HB2 . . 4.130 3.300 2.914 3.766 . 0 0 "[ . 1 . 2]" 1
1360 1 51 ASP HA 1 54 ASN HB3 . . 5.370 3.245 2.704 3.856 . 0 0 "[ . 1 . 2]" 1
1361 1 51 ASP HA 1 55 GLN H . . 4.410 3.953 3.777 4.251 . 0 0 "[ . 1 . 2]" 1
1362 1 51 ASP HA 1 55 GLN QB . . 4.670 4.712 4.288 4.751 0.081 5 0 "[ . 1 . 2]" 1
1363 1 51 ASP HB2 1 52 PHE H . . 4.030 3.759 3.318 4.096 0.066 18 0 "[ . 1 . 2]" 1
1364 1 51 ASP HB3 1 52 PHE H . . 3.720 2.748 2.595 3.402 . 0 0 "[ . 1 . 2]" 1
1365 1 52 PHE H 1 52 PHE HB2 . . 3.010 2.663 2.577 2.963 . 0 0 "[ . 1 . 2]" 1
1366 1 52 PHE H 1 52 PHE HB3 . . 2.980 2.379 2.268 2.492 . 0 0 "[ . 1 . 2]" 1
1367 1 52 PHE H 1 52 PHE QD . . 4.760 4.194 4.149 4.245 . 0 0 "[ . 1 . 2]" 1
1368 1 52 PHE H 1 53 LEU H . . 3.240 2.729 2.314 2.808 . 0 0 "[ . 1 . 2]" 1
1369 1 52 PHE H 1 53 LEU HB2 . . 5.500 4.638 4.157 4.828 . 0 0 "[ . 1 . 2]" 1
1370 1 52 PHE H 1 53 LEU MD2 . . 4.060 4.064 3.666 4.136 0.076 19 0 "[ . 1 . 2]" 1
1371 1 52 PHE H 1 54 ASN H . . 5.500 3.805 3.372 3.923 . 0 0 "[ . 1 . 2]" 1
1372 1 52 PHE H 1 55 GLN H . . 4.780 4.740 4.580 4.834 0.054 12 0 "[ . 1 . 2]" 1
1373 1 52 PHE HA 1 52 PHE QD . . 3.220 2.602 2.383 2.971 . 0 0 "[ . 1 . 2]" 1
1374 1 52 PHE HA 1 55 GLN H . . 5.150 3.655 3.544 3.839 . 0 0 "[ . 1 . 2]" 1
1375 1 52 PHE HA 1 55 GLN QB . . 4.140 4.164 4.052 4.224 0.084 18 0 "[ . 1 . 2]" 1
1376 1 52 PHE HA 1 55 GLN HG2 . . 5.500 2.967 2.761 3.084 . 0 0 "[ . 1 . 2]" 1
1377 1 52 PHE HA 1 55 GLN HG3 . . 4.280 2.169 2.083 2.270 . 0 0 "[ . 1 . 2]" 1
1378 1 52 PHE HB2 1 53 LEU H . . 3.900 3.872 3.808 3.935 0.035 12 0 "[ . 1 . 2]" 1
1379 1 52 PHE HB3 1 53 LEU H . . 3.580 2.460 2.371 2.539 . 0 0 "[ . 1 . 2]" 1
1380 1 52 PHE HB3 1 53 LEU MD2 . . 4.430 2.841 2.451 2.940 . 0 0 "[ . 1 . 2]" 1
1381 1 52 PHE HB3 1 54 ASN H . . 4.920 4.729 4.644 4.807 . 0 0 "[ . 1 . 2]" 1
1382 1 52 PHE QD 1 53 LEU H . . 3.370 3.227 2.885 3.430 0.060 13 0 "[ . 1 . 2]" 1
1383 1 52 PHE QD 1 53 LEU HA . . 4.030 3.667 3.002 4.113 0.083 3 0 "[ . 1 . 2]" 1
1384 1 52 PHE QD 1 53 LEU MD1 . . 3.540 3.120 2.563 3.629 0.089 13 0 "[ . 1 . 2]" 1
1385 1 52 PHE QD 1 53 LEU MD2 . . 3.970 2.121 1.906 2.231 . 0 0 "[ . 1 . 2]" 1
1386 1 52 PHE QD 1 53 LEU HG . . 5.000 4.918 4.626 5.079 0.079 16 0 "[ . 1 . 2]" 1
1387 1 52 PHE QE 1 53 LEU MD1 . . 4.020 3.366 3.032 3.847 . 0 0 "[ . 1 . 2]" 1
1388 1 52 PHE QE 1 56 LEU MD1 . . 5.500 3.306 2.474 4.151 . 0 0 "[ . 1 . 2]" 1
1389 1 52 PHE QE 1 56 LEU QD . . 4.350 2.750 2.280 3.771 . 0 0 "[ . 1 . 2]" 1
1390 1 52 PHE QE 1 56 LEU MD2 . . 5.500 3.252 2.323 4.624 . 0 0 "[ . 1 . 2]" 1
1391 1 52 PHE HZ 1 53 LEU MD1 . . 5.340 5.063 4.680 5.389 0.049 10 0 "[ . 1 . 2]" 1
1392 1 52 PHE HZ 1 56 LEU QD . . 3.950 3.021 2.470 3.899 . 0 0 "[ . 1 . 2]" 1
1393 1 53 LEU H 1 53 LEU HB2 . . 3.340 2.286 2.217 2.385 . 0 0 "[ . 1 . 2]" 1
1394 1 53 LEU H 1 53 LEU MD1 . . 3.600 3.637 3.532 3.689 0.089 13 0 "[ . 1 . 2]" 1
1395 1 53 LEU H 1 53 LEU MD2 . . 2.930 2.256 2.007 2.355 . 0 0 "[ . 1 . 2]" 1
1396 1 53 LEU H 1 53 LEU HG . . 4.020 4.065 3.991 4.082 0.062 2 0 "[ . 1 . 2]" 1
1397 1 53 LEU H 1 54 ASN H . . 5.190 2.666 2.594 2.770 . 0 0 "[ . 1 . 2]" 1
1398 1 53 LEU H 1 54 ASN HB3 . . 5.500 5.458 5.178 5.576 0.076 12 0 "[ . 1 . 2]" 1
1399 1 53 LEU H 1 55 GLN H . . 4.680 4.595 4.328 4.728 0.048 18 0 "[ . 1 . 2]" 1
1400 1 53 LEU H 1 56 LEU QD . . 4.910 4.667 4.411 5.013 0.103 16 0 "[ . 1 . 2]" 1
1401 1 53 LEU HA 1 53 LEU MD1 . . 2.810 2.089 1.925 2.148 . 0 0 "[ . 1 . 2]" 1
1402 1 53 LEU HA 1 53 LEU MD2 . . 3.360 3.003 2.819 3.127 . 0 0 "[ . 1 . 2]" 1
1403 1 53 LEU HA 1 53 LEU HG . . 3.840 3.726 3.668 3.763 . 0 0 "[ . 1 . 2]" 1
1404 1 53 LEU HA 1 55 GLN H . . 5.500 4.911 4.677 5.028 . 0 0 "[ . 1 . 2]" 1
1405 1 53 LEU HA 1 56 LEU H . . 3.830 3.501 3.384 3.640 . 0 0 "[ . 1 . 2]" 1
1406 1 53 LEU HA 1 56 LEU HB2 . . 3.990 2.854 2.193 3.390 . 0 0 "[ . 1 . 2]" 1
1407 1 53 LEU HA 1 56 LEU QB . . 3.250 2.318 2.154 2.487 . 0 0 "[ . 1 . 2]" 1
1408 1 53 LEU HA 1 56 LEU HB3 . . 3.990 2.695 2.278 3.593 . 0 0 "[ . 1 . 2]" 1
1409 1 53 LEU HA 1 56 LEU QD . . 3.450 2.600 2.220 2.973 . 0 0 "[ . 1 . 2]" 1
1410 1 53 LEU HA 1 56 LEU HG . . 4.580 4.381 3.899 4.640 0.060 3 0 "[ . 1 . 2]" 1
1411 1 53 LEU HB2 1 53 LEU MD1 . . 3.260 3.262 3.176 3.293 0.033 5 0 "[ . 1 . 2]" 1
1412 1 53 LEU HB2 1 54 ASN H . . 3.610 2.980 2.862 3.095 . 0 0 "[ . 1 . 2]" 1
1413 1 53 LEU HB2 1 54 ASN HD21 . . 5.500 5.231 4.263 5.573 0.073 5 0 "[ . 1 . 2]" 1
1414 1 53 LEU HB3 1 53 LEU MD1 . . 3.150 2.472 2.395 2.521 . 0 0 "[ . 1 . 2]" 1
1415 1 53 LEU HB3 1 54 ASN H . . 4.450 3.651 3.490 3.730 . 0 0 "[ . 1 . 2]" 1
1416 1 53 LEU HB3 1 56 LEU H . . 5.500 5.290 5.128 5.493 . 0 0 "[ . 1 . 2]" 1
1417 1 53 LEU HB3 1 56 LEU QB . . 4.640 4.285 4.137 4.509 . 0 0 "[ . 1 . 2]" 1
1418 1 53 LEU MD1 1 54 ASN H . . 4.870 4.801 4.633 4.861 . 0 0 "[ . 1 . 2]" 1
1419 1 53 LEU MD1 1 55 GLN HE21 . . 5.500 5.447 5.262 5.567 0.067 19 0 "[ . 1 . 2]" 1
1420 1 53 LEU MD1 1 56 LEU HB2 . . 4.000 3.828 3.408 4.091 0.091 3 0 "[ . 1 . 2]" 1
1421 1 53 LEU MD1 1 56 LEU HB3 . . 4.000 3.617 3.306 4.078 0.078 16 0 "[ . 1 . 2]" 1
1422 1 53 LEU MD1 1 56 LEU QD . . 4.420 2.213 2.017 2.604 . 0 0 "[ . 1 . 2]" 1
1423 1 53 LEU MD1 1 56 LEU HG . . 5.500 4.394 4.184 4.853 . 0 0 "[ . 1 . 2]" 1
1424 1 54 ASN H 1 54 ASN HB2 . . 2.840 2.275 2.148 2.351 . 0 0 "[ . 1 . 2]" 1
1425 1 54 ASN H 1 54 ASN HB3 . . 3.120 2.940 2.706 3.100 . 0 0 "[ . 1 . 2]" 1
1426 1 54 ASN H 1 54 ASN HD21 . . 4.440 4.033 3.427 4.255 . 0 0 "[ . 1 . 2]" 1
1427 1 54 ASN H 1 54 ASN HD22 . . 5.500 5.401 4.992 5.557 0.057 2 0 "[ . 1 . 2]" 1
1428 1 54 ASN H 1 55 GLN H . . 3.050 2.683 2.586 2.803 . 0 0 "[ . 1 . 2]" 1
1429 1 54 ASN H 1 55 GLN HA . . 5.500 5.231 5.137 5.299 . 0 0 "[ . 1 . 2]" 1
1430 1 54 ASN H 1 55 GLN QB . . 4.880 4.867 4.759 4.936 0.056 20 0 "[ . 1 . 2]" 1
1431 1 54 ASN H 1 55 GLN HG2 . . 5.500 5.542 5.431 5.573 0.073 8 0 "[ . 1 . 2]" 1
1432 1 54 ASN H 1 56 LEU H . . 4.140 3.702 3.605 3.825 . 0 0 "[ . 1 . 2]" 1
1433 1 54 ASN HA 1 54 ASN HB3 . . 3.000 3.005 2.954 3.043 0.043 5 0 "[ . 1 . 2]" 1
1434 1 54 ASN HA 1 55 GLN HA . . 5.280 4.703 4.617 4.756 . 0 0 "[ . 1 . 2]" 1
1435 1 54 ASN HA 1 55 GLN QB . . 5.400 5.428 5.374 5.458 0.058 17 0 "[ . 1 . 2]" 1
1436 1 54 ASN HB2 1 54 ASN HD21 . . 3.240 2.110 1.974 2.232 . 0 0 "[ . 1 . 2]" 1
1437 1 54 ASN HB2 1 54 ASN HD22 . . 3.470 3.440 3.379 3.506 0.036 12 0 "[ . 1 . 2]" 1
1438 1 54 ASN HB2 1 55 GLN HA . . 5.500 5.482 5.375 5.560 0.060 14 0 "[ . 1 . 2]" 1
1439 1 54 ASN HB3 1 54 ASN HD21 . . 3.420 3.317 3.114 3.479 0.059 8 0 "[ . 1 . 2]" 1
1440 1 54 ASN HB3 1 55 GLN H . . 3.600 2.452 2.216 2.633 . 0 0 "[ . 1 . 2]" 1
1441 1 54 ASN HB3 1 55 GLN HA . . 5.410 4.046 3.953 4.166 . 0 0 "[ . 1 . 2]" 1
1442 1 54 ASN HB3 1 55 GLN HG3 . . 4.890 4.583 4.214 4.866 . 0 0 "[ . 1 . 2]" 1
1443 1 54 ASN HB3 1 56 LEU H . . 5.500 4.769 4.540 4.914 . 0 0 "[ . 1 . 2]" 1
1444 1 55 GLN H 1 55 GLN QB . . 2.660 2.426 2.369 2.509 . 0 0 "[ . 1 . 2]" 1
1445 1 55 GLN H 1 55 GLN HG2 . . 3.660 3.449 3.368 3.506 . 0 0 "[ . 1 . 2]" 1
1446 1 55 GLN H 1 55 GLN HG3 . . 3.460 2.252 2.165 2.324 . 0 0 "[ . 1 . 2]" 1
1447 1 55 GLN H 1 56 LEU QB . . 4.600 4.373 4.175 4.506 . 0 0 "[ . 1 . 2]" 1
1448 1 55 GLN H 1 57 ASP H . . 5.500 4.545 4.320 5.177 . 0 0 "[ . 1 . 2]" 1
1449 1 55 GLN HA 1 55 GLN QB . . 2.600 2.152 2.130 2.176 . 0 0 "[ . 1 . 2]" 1
1450 1 55 GLN HA 1 55 GLN HG3 . . 3.670 3.713 3.658 3.730 0.060 19 0 "[ . 1 . 2]" 1
1451 1 55 GLN HA 1 57 ASP H . . 5.130 3.974 3.624 4.529 . 0 0 "[ . 1 . 2]" 1
1452 1 55 GLN HA 1 58 SER QB . . 3.940 3.617 3.013 4.017 0.077 9 0 "[ . 1 . 2]" 1
1453 1 55 GLN QB 1 55 GLN HG3 . . 2.650 2.418 2.376 2.452 . 0 0 "[ . 1 . 2]" 1
1454 1 55 GLN QB 1 56 LEU H . . 3.900 3.801 3.697 3.958 0.058 3 0 "[ . 1 . 2]" 1
1455 1 55 GLN QB 1 57 ASP H . . 5.500 5.127 4.844 5.566 0.066 3 0 "[ . 1 . 2]" 1
1456 1 55 GLN HE21 1 56 LEU HA . . 4.170 3.021 2.708 3.450 . 0 0 "[ . 1 . 2]" 1
1457 1 55 GLN HE21 1 56 LEU QB . . 5.340 2.575 2.194 3.044 . 0 0 "[ . 1 . 2]" 1
1458 1 55 GLN HE21 1 56 LEU MD1 . . 5.500 3.871 3.363 4.584 . 0 0 "[ . 1 . 2]" 1
1459 1 55 GLN HE21 1 56 LEU MD2 . . 5.500 4.313 3.897 4.549 . 0 0 "[ . 1 . 2]" 1
1460 1 55 GLN HE21 1 56 LEU HG . . 5.500 4.628 2.638 5.494 . 0 0 "[ . 1 . 2]" 1
1461 1 55 GLN HE22 1 56 LEU QD . . 3.600 3.421 2.990 3.690 0.090 4 0 "[ . 1 . 2]" 1
1462 1 55 GLN HG2 1 56 LEU H . . 5.500 4.531 4.264 4.972 . 0 0 "[ . 1 . 2]" 1
1463 1 55 GLN HG3 1 56 LEU H . . 3.970 2.955 2.668 3.405 . 0 0 "[ . 1 . 2]" 1
1464 1 56 LEU H 1 56 LEU HB2 . . 3.320 2.437 2.021 2.902 . 0 0 "[ . 1 . 2]" 1
1465 1 56 LEU H 1 56 LEU QB . . 2.540 2.123 1.995 2.238 . 0 0 "[ . 1 . 2]" 1
1466 1 56 LEU H 1 56 LEU HB3 . . 3.320 2.534 2.237 3.200 . 0 0 "[ . 1 . 2]" 1
1467 1 56 LEU H 1 56 LEU MD1 . . 4.370 4.161 3.951 4.366 . 0 0 "[ . 1 . 2]" 1
1468 1 56 LEU H 1 56 LEU QD . . 3.830 3.708 3.616 3.833 0.003 3 0 "[ . 1 . 2]" 1
1469 1 56 LEU H 1 56 LEU MD2 . . 4.370 4.170 4.060 4.336 . 0 0 "[ . 1 . 2]" 1
1470 1 56 LEU H 1 56 LEU HG . . 4.350 4.224 3.602 4.406 0.056 7 0 "[ . 1 . 2]" 1
1471 1 56 LEU H 1 57 ASP H . . 3.060 2.631 2.229 2.845 . 0 0 "[ . 1 . 2]" 1
1472 1 56 LEU H 1 57 ASP HB2 . . 5.160 4.789 4.310 5.209 0.049 16 0 "[ . 1 . 2]" 1
1473 1 56 LEU H 1 57 ASP HB3 . . 5.500 5.295 4.777 5.560 0.060 14 0 "[ . 1 . 2]" 1
1474 1 56 LEU HA 1 56 LEU MD1 . . 3.880 2.719 2.113 3.829 . 0 0 "[ . 1 . 2]" 1
1475 1 56 LEU HA 1 56 LEU QD . . 2.730 2.243 2.083 2.341 . 0 0 "[ . 1 . 2]" 1
1476 1 56 LEU HA 1 56 LEU MD2 . . 3.880 3.439 2.092 3.966 0.086 13 0 "[ . 1 . 2]" 1
1477 1 56 LEU HA 1 56 LEU HG . . 3.790 3.061 2.511 3.358 . 0 0 "[ . 1 . 2]" 1
1478 1 56 LEU HA 1 57 ASP HA . . 4.750 4.601 4.452 4.695 . 0 0 "[ . 1 . 2]" 1
1479 1 56 LEU QB 1 56 LEU QD . . 2.550 1.937 1.902 1.989 . 0 0 "[ . 1 . 2]" 1
1480 1 56 LEU QB 1 57 ASP H . . 3.320 2.787 2.267 3.010 . 0 0 "[ . 1 . 2]" 1
1481 1 56 LEU QB 1 58 SER H . . 5.160 4.660 4.255 4.935 . 0 0 "[ . 1 . 2]" 1
1482 1 56 LEU HB2 1 57 ASP H . . 4.140 3.908 3.343 4.193 0.053 17 0 "[ . 1 . 2]" 1
1483 1 56 LEU HB3 1 57 ASP H . . 4.140 2.866 2.306 3.257 . 0 0 "[ . 1 . 2]" 1
1484 1 56 LEU QD 1 57 ASP H . . 4.030 3.989 3.493 4.120 0.090 14 0 "[ . 1 . 2]" 1
1485 1 56 LEU QD 1 57 ASP HA . . 4.500 4.230 3.633 4.513 0.013 10 0 "[ . 1 . 2]" 1
1486 1 56 LEU QD 1 57 ASP HB2 . . 4.740 3.868 3.298 4.316 . 0 0 "[ . 1 . 2]" 1
1487 1 56 LEU MD1 1 57 ASP H . . 4.880 4.616 4.205 4.914 0.034 6 0 "[ . 1 . 2]" 1
1488 1 56 LEU MD1 1 57 ASP HA . . 5.500 4.934 4.337 5.601 0.101 8 0 "[ . 1 . 2]" 1
1489 1 56 LEU MD2 1 57 ASP H . . 4.880 4.377 3.733 4.650 . 0 0 "[ . 1 . 2]" 1
1490 1 56 LEU MD2 1 57 ASP HA . . 5.500 4.839 3.700 5.426 . 0 0 "[ . 1 . 2]" 1
1491 1 56 LEU HG 1 57 ASP H . . 5.410 4.270 3.354 5.300 . 0 0 "[ . 1 . 2]" 1
1492 1 57 ASP H 1 57 ASP HB2 . . 2.910 2.658 2.253 2.960 0.050 10 0 "[ . 1 . 2]" 1
1493 1 57 ASP H 1 57 ASP HB3 . . 3.180 2.872 2.517 3.201 0.021 14 0 "[ . 1 . 2]" 1
1494 1 57 ASP H 1 59 GLU H . . 3.740 3.285 2.949 3.687 . 0 0 "[ . 1 . 2]" 1
1495 1 57 ASP H 1 59 GLU HA . . 5.500 5.041 4.658 5.385 . 0 0 "[ . 1 . 2]" 1
1496 1 57 ASP HA 1 57 ASP HB2 . . 2.810 2.644 2.457 2.771 . 0 0 "[ . 1 . 2]" 1
1497 1 57 ASP HB2 1 58 SER H . . 3.800 3.723 3.425 3.866 0.066 19 0 "[ . 1 . 2]" 1
1498 1 57 ASP HB2 1 59 GLU H . . 5.500 5.528 5.370 5.577 0.077 19 0 "[ . 1 . 2]" 1
1499 1 57 ASP HB3 1 58 SER H . . 3.480 2.828 2.234 3.399 . 0 0 "[ . 1 . 2]" 1
1500 1 58 SER H 1 58 SER QB . . 3.030 2.479 2.087 2.753 . 0 0 "[ . 1 . 2]" 1
1501 1 58 SER H 1 59 GLU H . . 2.970 2.267 1.838 2.664 . 0 0 "[ . 1 . 2]" 1
1502 1 58 SER HA 1 58 SER QB . . 2.560 2.352 2.288 2.520 . 0 0 "[ . 1 . 2]" 1
1503 1 58 SER HA 1 59 GLU H . . 3.520 3.469 3.227 3.562 0.042 2 0 "[ . 1 . 2]" 1
1504 1 58 SER HA 1 59 GLU HA . . 5.370 5.314 5.115 5.379 0.009 14 0 "[ . 1 . 2]" 1
1505 1 58 SER QB 1 59 GLU H . . 3.710 2.954 2.530 3.582 . 0 0 "[ . 1 . 2]" 1
1506 1 58 SER QB 1 60 GLU H . . 4.930 2.950 2.477 3.763 . 0 0 "[ . 1 . 2]" 1
1507 1 58 SER HB2 1 59 GLU H . . 4.320 3.187 2.578 4.026 . 0 0 "[ . 1 . 2]" 1
1508 1 58 SER HB3 1 59 GLU H . . 4.320 3.893 2.776 4.370 0.050 12 0 "[ . 1 . 2]" 1
1509 1 59 GLU H 1 59 GLU HA . . 2.850 2.237 2.139 2.331 . 0 0 "[ . 1 . 2]" 1
1510 1 59 GLU H 1 59 GLU QB . . 2.900 2.722 2.364 2.906 0.006 14 0 "[ . 1 . 2]" 1
1511 1 59 GLU H 1 59 GLU HG2 . . 4.280 3.712 3.220 4.351 0.071 7 0 "[ . 1 . 2]" 1
1512 1 59 GLU H 1 59 GLU QG . . 3.480 3.374 3.113 3.561 0.081 18 0 "[ . 1 . 2]" 1
1513 1 59 GLU H 1 59 GLU HG3 . . 4.280 4.130 3.486 4.344 0.064 13 0 "[ . 1 . 2]" 1
1514 1 59 GLU HA 1 60 GLU H . . 3.230 2.995 2.668 3.299 0.069 13 0 "[ . 1 . 2]" 1
1515 1 59 GLU QB 1 59 GLU QG . . 2.340 2.110 2.082 2.127 . 0 0 "[ . 1 . 2]" 1
1516 1 59 GLU QG 1 60 GLU H . . 5.220 3.982 3.325 4.527 . 0 0 "[ . 1 . 2]" 1
1517 1 59 GLU QG 1 60 GLU HA . . 5.060 4.494 3.929 5.131 0.071 7 0 "[ . 1 . 2]" 1
1518 1 60 GLU H 1 60 GLU QB . . 3.200 2.613 1.932 3.158 . 0 0 "[ . 1 . 2]" 1
1519 1 60 GLU H 1 60 GLU QG . . 3.600 2.873 1.921 3.698 0.098 13 0 "[ . 1 . 2]" 1
1520 1 60 GLU H 1 61 GLN QG . . 5.180 4.233 3.482 5.262 0.082 15 0 "[ . 1 . 2]" 1
1521 1 60 GLU HA 1 60 GLU QG . . 3.470 2.894 2.256 3.504 0.034 12 0 "[ . 1 . 2]" 1
1522 1 61 GLN H 1 61 GLN HB2 . . 3.760 2.832 2.153 3.833 0.073 16 0 "[ . 1 . 2]" 1
1523 1 61 GLN H 1 61 GLN QB . . 3.000 2.580 1.889 3.080 0.080 3 0 "[ . 1 . 2]" 1
1524 1 61 GLN H 1 61 GLN HB3 . . 3.760 3.423 2.092 3.846 0.086 18 0 "[ . 1 . 2]" 1
1525 1 61 GLN H 1 61 GLN QG . . 3.540 2.893 2.176 3.643 0.103 17 0 "[ . 1 . 2]" 1
1526 1 61 GLN HB2 1 62 THR H . . 4.400 3.957 2.617 4.469 0.069 15 0 "[ . 1 . 2]" 1
1527 1 61 GLN HB3 1 62 THR H . . 4.400 3.744 2.578 4.462 0.062 5 0 "[ . 1 . 2]" 1
1528 1 61 GLN QG 1 62 THR H . . 5.500 4.306 2.968 4.920 . 0 0 "[ . 1 . 2]" 1
1529 1 62 THR H 1 62 THR MG . . 4.210 3.291 2.276 4.049 . 0 0 "[ . 1 . 2]" 1
1530 1 62 THR H 1 63 LYS H . . 4.820 3.930 2.124 4.639 . 0 0 "[ . 1 . 2]" 1
1531 1 62 THR H 1 63 LYS QG . . 5.340 4.331 2.817 5.404 0.064 11 0 "[ . 1 . 2]" 1
1532 1 62 THR HA 1 62 THR MG . . 3.630 2.633 2.102 3.273 . 0 0 "[ . 1 . 2]" 1
1533 1 62 THR MG 1 63 LYS H . . 4.610 3.395 1.883 4.600 . 0 0 "[ . 1 . 2]" 1
1534 1 63 LYS H 1 63 LYS QB . . 3.540 2.809 2.305 3.394 . 0 0 "[ . 1 . 2]" 1
1535 1 63 LYS H 1 63 LYS HG2 . . 5.110 3.415 2.004 4.531 . 0 0 "[ . 1 . 2]" 1
1536 1 63 LYS H 1 63 LYS QG . . 4.460 2.802 1.919 3.551 . 0 0 "[ . 1 . 2]" 1
1537 1 63 LYS H 1 63 LYS HG3 . . 5.110 3.193 2.450 4.092 . 0 0 "[ . 1 . 2]" 1
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