NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
617827 |
5utv   |
30247 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5utv
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 1797
_Distance_constraint_stats_list.Viol_count 4519
_Distance_constraint_stats_list.Viol_total 5355.385
_Distance_constraint_stats_list.Viol_max 0.925
_Distance_constraint_stats_list.Viol_rms 0.0303
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0075
_Distance_constraint_stats_list.Viol_average_violations_only 0.0593
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 HIS 1.604 0.141 11 0 "[ . 1 . 2]"
1 3 MET 1.854 0.109 16 0 "[ . 1 . 2]"
1 4 THR 5.127 0.140 9 0 "[ . 1 . 2]"
1 5 ALA 0.917 0.114 16 0 "[ . 1 . 2]"
1 6 VAL 4.501 0.758 19 2 "[ . 1- . +2]"
1 7 GLN 13.640 0.925 16 3 "[ . 1- .+ *2]"
1 8 ASP 5.855 0.925 16 1 "[ . 1 .+ 2]"
1 9 PHE 4.321 0.608 19 1 "[ . 1 . +2]"
1 10 VAL 4.733 0.374 19 0 "[ . 1 . 2]"
1 11 VAL 3.957 0.256 13 0 "[ . 1 . 2]"
1 12 ASP 3.021 0.159 11 0 "[ . 1 . 2]"
1 13 ILE 5.111 0.142 4 0 "[ . 1 . 2]"
1 14 LEU 8.481 0.256 13 0 "[ . 1 . 2]"
1 15 LEU 2.016 0.241 7 0 "[ . 1 . 2]"
1 16 ASN 1.645 0.241 7 0 "[ . 1 . 2]"
1 17 GLY 4.117 0.191 9 0 "[ . 1 . 2]"
1 18 ALA 0.184 0.087 8 0 "[ . 1 . 2]"
1 19 ARG 9.817 0.871 5 5 "[ - + *** . 2]"
1 20 ASP 3.864 0.208 1 0 "[ . 1 . 2]"
1 21 TRP 7.813 0.186 19 0 "[ . 1 . 2]"
1 22 ASP 4.159 0.228 10 0 "[ . 1 . 2]"
1 23 VAL 7.334 0.272 7 0 "[ . 1 . 2]"
1 24 LEU 15.971 0.291 9 0 "[ . 1 . 2]"
1 25 GLN 8.721 0.291 9 0 "[ . 1 . 2]"
1 26 THR 6.001 0.277 5 0 "[ . 1 . 2]"
1 27 THR 6.523 0.240 10 0 "[ . 1 . 2]"
1 28 CYS 13.121 0.325 12 0 "[ . 1 . 2]"
1 29 THR 10.717 0.325 12 0 "[ . 1 . 2]"
1 30 VAL 6.712 0.314 12 0 "[ . 1 . 2]"
1 31 ASP 3.910 0.357 5 0 "[ . 1 . 2]"
1 32 ARG 2.963 0.348 5 0 "[ . 1 . 2]"
1 33 LYS 10.334 0.386 17 0 "[ . 1 . 2]"
1 34 VAL 5.922 0.314 12 0 "[ . 1 . 2]"
1 35 TYR 7.873 0.124 5 0 "[ . 1 . 2]"
1 36 LYS 10.320 0.190 18 0 "[ . 1 . 2]"
1 37 THR 3.841 0.135 10 0 "[ . 1 . 2]"
1 38 ILE 6.584 0.202 6 0 "[ . 1 . 2]"
1 39 CYS 3.933 0.187 4 0 "[ . 1 . 2]"
1 40 LYS 10.754 0.453 11 0 "[ . 1 . 2]"
1 41 ARG 10.082 0.228 10 0 "[ . 1 . 2]"
1 42 GLY 8.442 0.222 1 0 "[ . 1 . 2]"
1 43 ASN 3.387 0.125 19 0 "[ . 1 . 2]"
1 44 THR 8.456 0.222 1 0 "[ . 1 . 2]"
1 45 TYR 14.638 0.399 11 0 "[ . 1 . 2]"
1 46 LEU 17.696 0.615 19 1 "[ . 1 . +2]"
1 47 CYS 3.149 0.119 14 0 "[ . 1 . 2]"
1 48 PHE 5.413 0.258 18 0 "[ . 1 . 2]"
1 49 ASP 10.239 0.519 9 1 "[ . +1 . 2]"
1 50 ASP 7.848 0.519 9 1 "[ . +1 . 2]"
1 51 THR 2.253 0.108 15 0 "[ . 1 . 2]"
1 52 ASN 11.437 0.194 10 0 "[ . 1 . 2]"
1 53 LEU 5.107 0.200 11 0 "[ . 1 . 2]"
1 54 TYR 7.882 0.140 18 0 "[ . 1 . 2]"
1 55 ALA 8.357 0.424 9 0 "[ . 1 . 2]"
1 56 ILE 5.858 0.127 14 0 "[ . 1 . 2]"
1 57 THR 1.182 0.112 19 0 "[ . 1 . 2]"
1 58 GLY 1.735 0.150 2 0 "[ . 1 . 2]"
1 59 ASP 1.857 0.150 2 0 "[ . 1 . 2]"
1 60 VAL 4.873 0.140 7 0 "[ . 1 . 2]"
1 61 VAL 4.727 0.140 7 0 "[ . 1 . 2]"
1 62 LEU 5.414 0.146 18 0 "[ . 1 . 2]"
1 63 LYS 5.089 0.143 10 0 "[ . 1 . 2]"
1 64 PHE 17.258 0.424 9 0 "[ . 1 . 2]"
1 65 ALA 2.366 0.118 2 0 "[ . 1 . 2]"
1 66 THR 9.030 0.221 19 0 "[ . 1 . 2]"
1 67 VAL 4.831 0.608 19 1 "[ . 1 . +2]"
1 68 SER 0.955 0.185 5 0 "[ . 1 . 2]"
1 69 LYS 12.499 0.238 18 0 "[ . 1 . 2]"
1 70 ALA 4.642 0.143 5 0 "[ . 1 . 2]"
1 71 ARG 8.202 0.254 5 0 "[ . 1 . 2]"
1 72 ALA 2.552 0.299 13 0 "[ . 1 . 2]"
1 73 TYR 9.802 0.615 19 1 "[ . 1 . +2]"
1 74 LEU 16.989 0.871 5 5 "[ - + *** . 2]"
1 75 GLU 7.828 0.329 16 0 "[ . 1 . 2]"
1 76 THR 6.098 0.329 16 0 "[ . 1 . 2]"
1 77 LYS 4.243 0.267 15 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 2 HIS H 1 2 HIS HD2 . . 4.780 3.588 2.194 4.797 0.017 9 0 "[ . 1 . 2]" 1
2 1 2 HIS H 1 3 MET QG . . 5.500 4.652 3.534 5.546 0.046 13 0 "[ . 1 . 2]" 1
3 1 2 HIS H 1 4 THR HA . . 5.170 5.064 4.227 5.296 0.126 2 0 "[ . 1 . 2]" 1
4 1 2 HIS H 1 4 THR MG . . 5.130 3.955 1.781 5.129 . 0 0 "[ . 1 . 2]" 1
5 1 2 HIS HB3 1 2 HIS HE1 . . 4.900 4.899 4.782 5.041 0.141 11 0 "[ . 1 . 2]" 1
6 1 2 HIS HD2 1 3 MET H . . 5.200 3.308 1.707 5.189 . 0 0 "[ . 1 . 2]" 1
7 1 3 MET HA 1 6 VAL H . . 4.380 4.330 3.889 4.435 0.055 1 0 "[ . 1 . 2]" 1
8 1 3 MET HA 1 7 GLN H . . 5.500 3.440 2.891 3.955 . 0 0 "[ . 1 . 2]" 1
9 1 3 MET HA 1 7 GLN HB2 . . 3.230 2.867 2.191 3.339 0.109 16 0 "[ . 1 . 2]" 1
10 1 3 MET HA 1 7 GLN HB3 . . 5.440 4.118 3.372 5.032 . 0 0 "[ . 1 . 2]" 1
11 1 3 MET HA 1 7 GLN HE21 . . 5.500 5.066 3.821 5.590 0.090 15 0 "[ . 1 . 2]" 1
12 1 3 MET HA 1 7 GLN HE22 . . 5.500 5.402 4.469 5.570 0.070 5 0 "[ . 1 . 2]" 1
13 1 3 MET HB3 1 6 VAL QG . . 5.500 4.272 3.741 5.252 . 0 0 "[ . 1 . 2]" 1
14 1 4 THR H 1 4 THR HB . . 3.450 2.782 2.409 3.448 . 0 0 "[ . 1 . 2]" 1
15 1 4 THR H 1 4 THR MG . . 3.810 3.491 2.208 3.872 0.062 2 0 "[ . 1 . 2]" 1
16 1 4 THR H 1 5 ALA H . . 4.710 2.488 2.081 2.743 . 0 0 "[ . 1 . 2]" 1
17 1 4 THR H 1 5 ALA MB . . 5.500 4.063 3.549 4.413 . 0 0 "[ . 1 . 2]" 1
18 1 4 THR HA 1 4 THR HB . . 2.930 2.824 2.191 3.006 0.076 17 0 "[ . 1 . 2]" 1
19 1 4 THR HA 1 4 THR MG . . 3.280 2.535 2.215 3.294 0.014 20 0 "[ . 1 . 2]" 1
20 1 4 THR HA 1 6 VAL H . . 4.910 4.987 4.913 5.050 0.140 9 0 "[ . 1 . 2]" 1
21 1 4 THR HA 1 7 GLN H . . 5.010 3.960 3.365 4.348 . 0 0 "[ . 1 . 2]" 1
22 1 4 THR HA 1 7 GLN HB2 . . 4.520 3.875 2.623 4.525 0.005 5 0 "[ . 1 . 2]" 1
23 1 4 THR HB 1 5 ALA H . . 3.940 2.468 1.925 3.894 . 0 0 "[ . 1 . 2]" 1
24 1 4 THR HB 1 5 ALA MB . . 4.810 3.852 3.284 4.924 0.114 16 0 "[ . 1 . 2]" 1
25 1 4 THR HB 1 7 GLN H . . 5.310 5.334 5.213 5.434 0.124 20 0 "[ . 1 . 2]" 1
26 1 4 THR MG 1 5 ALA H . . 5.040 2.877 1.832 3.358 . 0 0 "[ . 1 . 2]" 1
27 1 4 THR MG 1 5 ALA HA . . 5.500 3.694 3.344 4.218 . 0 0 "[ . 1 . 2]" 1
28 1 4 THR MG 1 5 ALA MB . . 3.810 3.431 2.480 3.820 0.010 1 0 "[ . 1 . 2]" 1
29 1 4 THR MG 1 6 VAL H . . 5.500 4.941 3.958 5.304 . 0 0 "[ . 1 . 2]" 1
30 1 4 THR MG 1 7 GLN H . . 5.500 5.120 4.711 5.401 . 0 0 "[ . 1 . 2]" 1
31 1 5 ALA H 1 5 ALA MB . . 3.560 2.157 1.974 2.284 . 0 0 "[ . 1 . 2]" 1
32 1 5 ALA H 1 6 VAL H . . 4.360 2.640 2.468 2.913 . 0 0 "[ . 1 . 2]" 1
33 1 5 ALA H 1 6 VAL HB . . 5.500 4.579 4.243 4.899 . 0 0 "[ . 1 . 2]" 1
34 1 5 ALA H 1 8 ASP QB . . 5.500 4.830 4.508 5.356 . 0 0 "[ . 1 . 2]" 1
35 1 5 ALA H 1 67 VAL QG . . 5.500 4.035 3.851 4.453 . 0 0 "[ . 1 . 2]" 1
36 1 5 ALA HA 1 7 GLN H . . 5.300 4.138 3.936 4.401 . 0 0 "[ . 1 . 2]" 1
37 1 5 ALA HA 1 8 ASP QB . . 3.250 2.746 2.300 3.086 . 0 0 "[ . 1 . 2]" 1
38 1 5 ALA HA 1 9 PHE H . . 5.110 3.933 3.687 4.503 . 0 0 "[ . 1 . 2]" 1
39 1 5 ALA HA 1 67 VAL QG . . 4.710 3.473 3.326 3.603 . 0 0 "[ . 1 . 2]" 1
40 1 5 ALA MB 1 6 VAL H . . 3.800 2.400 2.035 2.593 . 0 0 "[ . 1 . 2]" 1
41 1 5 ALA MB 1 6 VAL HA . . 4.830 3.949 3.714 4.145 . 0 0 "[ . 1 . 2]" 1
42 1 5 ALA MB 1 6 VAL HB . . 4.040 3.984 3.826 4.087 0.047 12 0 "[ . 1 . 2]" 1
43 1 5 ALA MB 1 6 VAL QG . . 4.750 3.660 2.659 4.134 . 0 0 "[ . 1 . 2]" 1
44 1 5 ALA MB 1 8 ASP QB . . 4.390 4.152 3.728 4.405 0.015 12 0 "[ . 1 . 2]" 1
45 1 5 ALA MB 1 9 PHE H . . 5.500 4.633 4.338 5.063 . 0 0 "[ . 1 . 2]" 1
46 1 5 ALA MB 1 53 LEU MD1 . . 5.500 5.271 4.739 5.553 0.053 10 0 "[ . 1 . 2]" 1
47 1 5 ALA MB 1 67 VAL H . . 5.500 4.207 3.703 4.656 . 0 0 "[ . 1 . 2]" 1
48 1 5 ALA MB 1 67 VAL HB . . 4.890 3.381 2.758 4.112 . 0 0 "[ . 1 . 2]" 1
49 1 5 ALA MB 1 67 VAL QG . . 3.620 2.007 1.889 2.192 . 0 0 "[ . 1 . 2]" 1
50 1 6 VAL H 1 6 VAL HB . . 3.370 2.234 2.099 2.344 . 0 0 "[ . 1 . 2]" 1
51 1 6 VAL H 1 7 GLN H . . 4.270 2.710 2.483 2.874 . 0 0 "[ . 1 . 2]" 1
52 1 6 VAL H 1 7 GLN HA . . 5.500 5.303 5.176 5.419 . 0 0 "[ . 1 . 2]" 1
53 1 6 VAL H 1 7 GLN HB2 . . 5.400 4.890 4.493 5.157 . 0 0 "[ . 1 . 2]" 1
54 1 6 VAL H 1 8 ASP QB . . 5.500 4.970 4.635 5.470 . 0 0 "[ . 1 . 2]" 1
55 1 6 VAL H 1 67 VAL QG . . 3.530 2.740 2.492 3.370 . 0 0 "[ . 1 . 2]" 1
56 1 6 VAL HA 1 8 ASP H . . 5.500 5.031 4.741 5.298 . 0 0 "[ . 1 . 2]" 1
57 1 6 VAL HA 1 9 PHE H . . 4.420 3.874 3.455 4.216 . 0 0 "[ . 1 . 2]" 1
58 1 6 VAL HA 1 9 PHE HB2 . . 4.610 3.856 3.580 4.528 . 0 0 "[ . 1 . 2]" 1
59 1 6 VAL HA 1 9 PHE QD . . 5.150 3.926 3.641 4.388 . 0 0 "[ . 1 . 2]" 1
60 1 6 VAL HA 1 53 LEU MD1 . . 4.400 3.219 2.628 3.969 . 0 0 "[ . 1 . 2]" 1
61 1 6 VAL HA 1 67 VAL QG . . 3.030 1.896 1.782 2.659 . 0 0 "[ . 1 . 2]" 1
62 1 6 VAL HB 1 7 GLN H . . 3.810 3.517 2.580 3.860 0.050 7 0 "[ . 1 . 2]" 1
63 1 6 VAL QG 1 7 GLN HA . . 3.990 3.188 2.929 3.618 . 0 0 "[ . 1 . 2]" 1
64 1 6 VAL QG 1 7 GLN HB3 . . 5.370 4.182 3.678 5.164 . 0 0 "[ . 1 . 2]" 1
65 1 6 VAL QG 1 7 GLN QG . . 4.720 4.605 3.144 5.478 0.758 19 2 "[ . 1- . +2]" 1
66 1 6 VAL QG 1 9 PHE HB3 . . 5.340 3.858 3.499 4.156 . 0 0 "[ . 1 . 2]" 1
67 1 6 VAL QG 1 10 VAL MG2 . . 3.480 2.601 2.259 2.776 . 0 0 "[ . 1 . 2]" 1
68 1 6 VAL QG 1 48 PHE QD . . 3.370 2.477 2.084 3.250 . 0 0 "[ . 1 . 2]" 1
69 1 7 GLN H 1 7 GLN HB3 . . 4.020 2.471 2.147 3.537 . 0 0 "[ . 1 . 2]" 1
70 1 7 GLN H 1 7 GLN QG . . 4.050 3.908 2.777 4.099 0.049 15 0 "[ . 1 . 2]" 1
71 1 7 GLN H 1 10 VAL H . . 4.660 4.523 4.351 4.704 0.044 19 0 "[ . 1 . 2]" 1
72 1 7 GLN HA 1 7 GLN HE21 . . 5.500 2.044 1.708 2.808 . 0 0 "[ . 1 . 2]" 1
73 1 7 GLN HA 1 7 GLN QG . . 3.340 3.019 2.454 3.181 . 0 0 "[ . 1 . 2]" 1
74 1 7 GLN HA 1 9 PHE H . . 5.500 4.657 4.418 4.975 . 0 0 "[ . 1 . 2]" 1
75 1 7 GLN HA 1 10 VAL H . . 3.700 3.549 3.299 3.708 0.008 1 0 "[ . 1 . 2]" 1
76 1 7 GLN HA 1 10 VAL HB . . 3.220 2.617 2.260 2.954 . 0 0 "[ . 1 . 2]" 1
77 1 7 GLN HA 1 10 VAL MG2 . . 3.930 3.462 3.143 3.821 . 0 0 "[ . 1 . 2]" 1
78 1 7 GLN HA 1 11 VAL H . . 5.140 4.094 3.556 4.532 . 0 0 "[ . 1 . 2]" 1
79 1 7 GLN HB2 1 7 GLN HE22 . . 5.500 3.679 3.242 4.628 . 0 0 "[ . 1 . 2]" 1
80 1 7 GLN HB2 1 8 ASP H . . 4.690 3.428 2.308 3.638 . 0 0 "[ . 1 . 2]" 1
81 1 7 GLN HB3 1 7 GLN HE22 . . 5.500 4.672 3.528 4.858 . 0 0 "[ . 1 . 2]" 1
82 1 7 GLN HB3 1 8 ASP H . . 4.140 2.187 1.871 2.977 . 0 0 "[ . 1 . 2]" 1
83 1 7 GLN HB3 1 8 ASP HA . . 5.330 4.372 4.254 4.463 . 0 0 "[ . 1 . 2]" 1
84 1 7 GLN HB3 1 11 VAL MG2 . . 5.500 4.719 3.607 5.418 . 0 0 "[ . 1 . 2]" 1
85 1 7 GLN HE21 1 11 VAL MG2 . . 5.500 3.885 2.063 5.397 . 0 0 "[ . 1 . 2]" 1
86 1 7 GLN HE21 1 48 PHE QE . . 5.260 5.186 4.524 5.332 0.072 6 0 "[ . 1 . 2]" 1
87 1 7 GLN HE21 1 48 PHE HZ . . 5.500 5.505 5.383 5.534 0.034 20 0 "[ . 1 . 2]" 1
88 1 7 GLN HE22 1 8 ASP H . . 5.500 5.690 5.633 5.758 0.258 19 0 "[ . 1 . 2]" 1
89 1 7 GLN HE22 1 10 VAL MG1 . . 5.500 3.585 2.671 4.477 . 0 0 "[ . 1 . 2]" 1
90 1 7 GLN HE22 1 11 VAL H . . 5.500 5.215 4.619 5.586 0.086 4 0 "[ . 1 . 2]" 1
91 1 7 GLN HE22 1 11 VAL MG2 . . 5.500 4.502 3.332 5.526 0.026 14 0 "[ . 1 . 2]" 1
92 1 7 GLN HE22 1 48 PHE QE . . 5.500 4.673 4.067 5.192 . 0 0 "[ . 1 . 2]" 1
93 1 7 GLN HE22 1 48 PHE HZ . . 5.500 4.713 4.033 5.519 0.019 12 0 "[ . 1 . 2]" 1
94 1 7 GLN QG 1 8 ASP H . . 4.860 3.254 2.693 4.490 . 0 0 "[ . 1 . 2]" 1
95 1 7 GLN QG 1 8 ASP QB . . 4.850 4.323 3.670 5.775 0.925 16 1 "[ . 1 .+ 2]" 1
96 1 7 GLN QG 1 10 VAL H . . 5.500 5.430 5.105 5.532 0.032 12 0 "[ . 1 . 2]" 1
97 1 7 GLN QG 1 10 VAL MG1 . . 5.500 5.088 4.475 5.590 0.090 17 0 "[ . 1 . 2]" 1
98 1 7 GLN QG 1 10 VAL MG2 . . 5.500 5.490 4.880 5.874 0.374 19 0 "[ . 1 . 2]" 1
99 1 8 ASP H 1 8 ASP QB . . 3.560 2.195 2.094 2.317 . 0 0 "[ . 1 . 2]" 1
100 1 8 ASP H 1 9 PHE HB2 . . 5.500 5.513 5.296 5.577 0.077 19 0 "[ . 1 . 2]" 1
101 1 8 ASP HA 1 11 VAL MG2 . . 3.710 2.734 2.096 3.746 0.036 9 0 "[ . 1 . 2]" 1
102 1 8 ASP QB 1 9 PHE H . . 4.410 2.449 2.180 2.651 . 0 0 "[ . 1 . 2]" 1
103 1 8 ASP QB 1 9 PHE HB2 . . 4.780 4.399 4.119 4.582 . 0 0 "[ . 1 . 2]" 1
104 1 9 PHE H 1 9 PHE HB2 . . 3.860 2.591 2.477 2.715 . 0 0 "[ . 1 . 2]" 1
105 1 9 PHE H 1 9 PHE HB3 . . 3.540 2.436 2.316 2.576 . 0 0 "[ . 1 . 2]" 1
106 1 9 PHE H 1 9 PHE QD . . 4.140 4.153 4.083 4.186 0.046 10 0 "[ . 1 . 2]" 1
107 1 9 PHE H 1 10 VAL H . . 3.670 2.825 2.618 2.998 . 0 0 "[ . 1 . 2]" 1
108 1 9 PHE H 1 10 VAL HB . . 5.350 4.898 4.646 5.134 . 0 0 "[ . 1 . 2]" 1
109 1 9 PHE H 1 10 VAL MG2 . . 5.500 4.738 4.488 5.004 . 0 0 "[ . 1 . 2]" 1
110 1 9 PHE H 1 67 VAL QG . . 4.660 3.350 3.068 3.615 . 0 0 "[ . 1 . 2]" 1
111 1 9 PHE HA 1 9 PHE QD . . 3.050 2.691 2.355 3.082 0.032 11 0 "[ . 1 . 2]" 1
112 1 9 PHE HA 1 12 ASP QB . . 3.280 3.011 2.505 3.319 0.039 14 0 "[ . 1 . 2]" 1
113 1 9 PHE HB2 1 67 VAL QG . . 3.470 2.177 2.019 2.442 . 0 0 "[ . 1 . 2]" 1
114 1 9 PHE HB2 1 68 SER HA . . 5.130 4.620 3.926 5.158 0.028 11 0 "[ . 1 . 2]" 1
115 1 9 PHE HB2 1 71 ARG HD3 . . 4.800 4.875 4.821 4.917 0.117 10 0 "[ . 1 . 2]" 1
116 1 9 PHE HB3 1 10 VAL H . . 3.690 2.338 2.190 2.846 . 0 0 "[ . 1 . 2]" 1
117 1 9 PHE HB3 1 10 VAL HA . . 4.520 4.234 4.110 4.361 . 0 0 "[ . 1 . 2]" 1
118 1 9 PHE HB3 1 53 LEU MD1 . . 5.350 3.371 2.861 3.837 . 0 0 "[ . 1 . 2]" 1
119 1 9 PHE QD 1 10 VAL H . . 3.410 2.906 2.602 3.414 0.004 19 0 "[ . 1 . 2]" 1
120 1 9 PHE QD 1 10 VAL HA . . 5.000 2.955 2.537 3.366 . 0 0 "[ . 1 . 2]" 1
121 1 9 PHE QD 1 10 VAL HB . . 5.500 4.424 4.177 4.755 . 0 0 "[ . 1 . 2]" 1
122 1 9 PHE QD 1 10 VAL MG2 . . 4.440 2.336 2.108 2.681 . 0 0 "[ . 1 . 2]" 1
123 1 9 PHE QD 1 12 ASP H . . 5.500 5.206 4.982 5.426 . 0 0 "[ . 1 . 2]" 1
124 1 9 PHE QD 1 12 ASP QB . . 4.400 4.092 3.637 4.559 0.159 11 0 "[ . 1 . 2]" 1
125 1 9 PHE QD 1 13 ILE H . . 5.500 5.354 4.977 5.521 0.021 14 0 "[ . 1 . 2]" 1
126 1 9 PHE QD 1 13 ILE MD . . 3.930 3.523 3.084 3.805 . 0 0 "[ . 1 . 2]" 1
127 1 9 PHE QD 1 53 LEU MD1 . . 2.940 2.545 2.254 2.803 . 0 0 "[ . 1 . 2]" 1
128 1 9 PHE QD 1 53 LEU MD2 . . 2.920 2.506 2.147 3.120 0.200 11 0 "[ . 1 . 2]" 1
129 1 9 PHE QD 1 67 VAL QG . . 2.970 2.818 2.535 3.578 0.608 19 1 "[ . 1 . +2]" 1
130 1 9 PHE QD 1 71 ARG H . . 4.610 4.337 3.902 4.626 0.016 17 0 "[ . 1 . 2]" 1
131 1 9 PHE QD 1 71 ARG HB2 . . 3.550 2.913 2.612 3.112 . 0 0 "[ . 1 . 2]" 1
132 1 9 PHE QD 1 71 ARG HB3 . . 4.880 4.547 4.223 4.739 . 0 0 "[ . 1 . 2]" 1
133 1 9 PHE QE 1 10 VAL H . . 5.500 4.927 4.715 5.294 . 0 0 "[ . 1 . 2]" 1
134 1 9 PHE QE 1 12 ASP QB . . 5.500 4.399 3.791 5.003 . 0 0 "[ . 1 . 2]" 1
135 1 9 PHE QE 1 13 ILE H . . 5.500 5.186 5.020 5.399 . 0 0 "[ . 1 . 2]" 1
136 1 9 PHE QE 1 13 ILE MD . . 3.900 2.678 2.469 2.823 . 0 0 "[ . 1 . 2]" 1
137 1 9 PHE QE 1 13 ILE HG12 . . 5.500 3.875 3.488 4.170 . 0 0 "[ . 1 . 2]" 1
138 1 9 PHE QE 1 53 LEU MD1 . . 3.520 3.183 2.395 3.604 0.084 16 0 "[ . 1 . 2]" 1
139 1 9 PHE QE 1 53 LEU MD2 . . 3.390 2.385 1.927 3.396 0.006 11 0 "[ . 1 . 2]" 1
140 1 9 PHE QE 1 71 ARG H . . 3.970 3.149 2.483 3.753 . 0 0 "[ . 1 . 2]" 1
141 1 9 PHE QE 1 71 ARG HA . . 3.360 2.368 2.184 2.726 . 0 0 "[ . 1 . 2]" 1
142 1 9 PHE QE 1 71 ARG HB2 . . 3.400 2.195 2.057 2.299 . 0 0 "[ . 1 . 2]" 1
143 1 9 PHE QE 1 71 ARG HB3 . . 3.710 3.679 3.566 3.740 0.030 11 0 "[ . 1 . 2]" 1
144 1 9 PHE QE 1 72 ALA H . . 5.500 4.930 4.603 5.176 . 0 0 "[ . 1 . 2]" 1
145 1 9 PHE QE 1 74 LEU H . . 5.500 5.415 5.102 5.553 0.053 5 0 "[ . 1 . 2]" 1
146 1 9 PHE QE 1 74 LEU MD2 . . 4.810 3.605 3.101 4.388 . 0 0 "[ . 1 . 2]" 1
147 1 9 PHE HZ 1 13 ILE MD . . 3.950 2.416 2.173 2.966 . 0 0 "[ . 1 . 2]" 1
148 1 9 PHE HZ 1 13 ILE HG13 . . 5.500 4.593 4.283 5.261 . 0 0 "[ . 1 . 2]" 1
149 1 9 PHE HZ 1 70 ALA HA . . 5.450 4.714 4.380 5.023 . 0 0 "[ . 1 . 2]" 1
150 1 9 PHE HZ 1 70 ALA MB . . 4.000 2.680 2.204 3.152 . 0 0 "[ . 1 . 2]" 1
151 1 9 PHE HZ 1 71 ARG H . . 5.140 4.168 3.745 4.585 . 0 0 "[ . 1 . 2]" 1
152 1 9 PHE HZ 1 71 ARG HA . . 3.830 3.308 2.847 3.792 . 0 0 "[ . 1 . 2]" 1
153 1 9 PHE HZ 1 71 ARG HB2 . . 4.670 4.362 4.048 4.693 0.023 11 0 "[ . 1 . 2]" 1
154 1 9 PHE HZ 1 71 ARG HD3 . . 5.500 4.717 4.428 5.355 . 0 0 "[ . 1 . 2]" 1
155 1 9 PHE HZ 1 74 LEU H . . 5.450 5.119 4.691 5.473 0.023 2 0 "[ . 1 . 2]" 1
156 1 9 PHE HZ 1 74 LEU MD1 . . 4.260 3.502 3.110 3.803 . 0 0 "[ . 1 . 2]" 1
157 1 9 PHE HZ 1 74 LEU MD2 . . 3.530 2.794 2.223 3.509 . 0 0 "[ . 1 . 2]" 1
158 1 10 VAL H 1 10 VAL HB . . 3.260 2.428 2.325 2.491 . 0 0 "[ . 1 . 2]" 1
159 1 10 VAL H 1 10 VAL MG1 . . 4.120 3.834 3.776 3.869 . 0 0 "[ . 1 . 2]" 1
160 1 10 VAL H 1 10 VAL MG2 . . 3.410 2.490 2.380 2.630 . 0 0 "[ . 1 . 2]" 1
161 1 10 VAL H 1 11 VAL MG2 . . 4.840 4.185 3.677 4.837 . 0 0 "[ . 1 . 2]" 1
162 1 10 VAL H 1 12 ASP QB . . 5.100 4.981 4.798 5.145 0.045 17 0 "[ . 1 . 2]" 1
163 1 10 VAL H 1 13 ILE MD . . 5.500 4.749 4.529 5.031 . 0 0 "[ . 1 . 2]" 1
164 1 10 VAL H 1 67 VAL QG . . 5.340 3.881 3.640 4.943 . 0 0 "[ . 1 . 2]" 1
165 1 10 VAL HA 1 10 VAL MG1 . . 3.590 2.663 2.633 2.707 . 0 0 "[ . 1 . 2]" 1
166 1 10 VAL HA 1 10 VAL MG2 . . 3.380 2.264 2.114 2.329 . 0 0 "[ . 1 . 2]" 1
167 1 10 VAL HA 1 11 VAL HA . . 4.880 4.758 4.635 4.912 0.032 14 0 "[ . 1 . 2]" 1
168 1 10 VAL HA 1 12 ASP H . . 5.500 4.087 3.904 4.241 . 0 0 "[ . 1 . 2]" 1
169 1 10 VAL HA 1 13 ILE H . . 4.210 3.774 3.498 4.104 . 0 0 "[ . 1 . 2]" 1
170 1 10 VAL HA 1 13 ILE HB . . 3.960 3.517 3.126 3.956 . 0 0 "[ . 1 . 2]" 1
171 1 10 VAL HA 1 13 ILE MD . . 4.780 3.073 2.613 3.495 . 0 0 "[ . 1 . 2]" 1
172 1 10 VAL HA 1 13 ILE HG12 . . 5.500 4.716 4.439 5.205 . 0 0 "[ . 1 . 2]" 1
173 1 10 VAL HA 1 14 LEU H . . 4.990 4.313 4.094 4.470 . 0 0 "[ . 1 . 2]" 1
174 1 10 VAL HA 1 14 LEU HB2 . . 5.090 4.475 4.270 4.671 . 0 0 "[ . 1 . 2]" 1
175 1 10 VAL HA 1 38 ILE MD . . 3.890 2.125 1.925 2.405 . 0 0 "[ . 1 . 2]" 1
176 1 10 VAL HB 1 11 VAL MG2 . . 4.370 3.703 3.370 4.287 . 0 0 "[ . 1 . 2]" 1
177 1 10 VAL HB 1 12 ASP H . . 5.100 5.129 5.095 5.161 0.061 5 0 "[ . 1 . 2]" 1
178 1 10 VAL MG1 1 11 VAL H . . 4.940 3.076 2.956 3.181 . 0 0 "[ . 1 . 2]" 1
179 1 10 VAL MG1 1 11 VAL HA . . 4.540 3.234 3.072 3.421 . 0 0 "[ . 1 . 2]" 1
180 1 10 VAL MG1 1 11 VAL MG2 . . 4.730 3.497 2.872 4.306 . 0 0 "[ . 1 . 2]" 1
181 1 10 VAL MG1 1 12 ASP H . . 5.500 4.728 4.533 4.853 . 0 0 "[ . 1 . 2]" 1
182 1 10 VAL MG1 1 13 ILE MD . . 5.280 4.613 4.132 5.138 . 0 0 "[ . 1 . 2]" 1
183 1 10 VAL MG1 1 14 LEU H . . 5.300 3.861 3.619 4.310 . 0 0 "[ . 1 . 2]" 1
184 1 10 VAL MG1 1 14 LEU HB2 . . 4.660 2.757 2.325 3.440 . 0 0 "[ . 1 . 2]" 1
185 1 10 VAL MG1 1 14 LEU MD1 . . 3.770 2.357 2.011 3.852 0.082 9 0 "[ . 1 . 2]" 1
186 1 10 VAL MG1 1 14 LEU HG . . 5.500 3.007 2.515 3.878 . 0 0 "[ . 1 . 2]" 1
187 1 10 VAL MG1 1 38 ILE MD . . 3.940 2.618 2.293 3.001 . 0 0 "[ . 1 . 2]" 1
188 1 10 VAL MG1 1 48 PHE QD . . 4.140 3.913 3.473 4.398 0.258 18 0 "[ . 1 . 2]" 1
189 1 10 VAL MG1 1 48 PHE QE . . 4.450 3.051 2.575 3.663 . 0 0 "[ . 1 . 2]" 1
190 1 10 VAL MG1 1 48 PHE HZ . . 4.870 3.346 2.755 4.262 . 0 0 "[ . 1 . 2]" 1
191 1 10 VAL MG2 1 11 VAL H . . 5.100 4.147 4.037 4.223 . 0 0 "[ . 1 . 2]" 1
192 1 10 VAL MG2 1 12 ASP H . . 5.500 5.390 5.282 5.505 0.005 15 0 "[ . 1 . 2]" 1
193 1 10 VAL MG2 1 13 ILE HB . . 5.500 4.761 4.342 5.044 . 0 0 "[ . 1 . 2]" 1
194 1 10 VAL MG2 1 13 ILE MD . . 4.330 4.317 4.022 4.369 0.039 5 0 "[ . 1 . 2]" 1
195 1 10 VAL MG2 1 14 LEU H . . 5.500 5.493 5.293 5.589 0.089 19 0 "[ . 1 . 2]" 1
196 1 10 VAL MG2 1 38 ILE MD . . 4.110 2.018 1.964 2.083 . 0 0 "[ . 1 . 2]" 1
197 1 10 VAL MG2 1 38 ILE MG . . 5.380 3.259 3.008 3.589 . 0 0 "[ . 1 . 2]" 1
198 1 10 VAL MG2 1 48 PHE H . . 5.500 4.939 4.625 5.396 . 0 0 "[ . 1 . 2]" 1
199 1 10 VAL MG2 1 48 PHE HB2 . . 4.670 3.501 3.097 3.984 . 0 0 "[ . 1 . 2]" 1
200 1 10 VAL MG2 1 48 PHE HB3 . . 4.910 3.008 2.640 3.453 . 0 0 "[ . 1 . 2]" 1
201 1 10 VAL MG2 1 48 PHE QD . . 3.670 2.798 2.512 3.105 . 0 0 "[ . 1 . 2]" 1
202 1 10 VAL MG2 1 48 PHE QE . . 4.670 3.093 2.837 3.501 . 0 0 "[ . 1 . 2]" 1
203 1 10 VAL MG2 1 48 PHE HZ . . 5.440 3.772 3.281 4.460 . 0 0 "[ . 1 . 2]" 1
204 1 10 VAL MG2 1 53 LEU MD2 . . 3.660 2.855 2.387 3.236 . 0 0 "[ . 1 . 2]" 1
205 1 11 VAL H 1 11 VAL HB . . 3.650 3.332 2.284 3.671 0.021 6 0 "[ . 1 . 2]" 1
206 1 11 VAL H 1 11 VAL MG2 . . 3.320 1.975 1.824 2.384 . 0 0 "[ . 1 . 2]" 1
207 1 11 VAL H 1 12 ASP H . . 3.950 2.845 2.757 2.984 . 0 0 "[ . 1 . 2]" 1
208 1 11 VAL H 1 12 ASP QB . . 4.960 4.507 4.321 4.772 . 0 0 "[ . 1 . 2]" 1
209 1 11 VAL HA 1 11 VAL MG2 . . 3.330 2.835 2.145 3.074 . 0 0 "[ . 1 . 2]" 1
210 1 11 VAL HA 1 12 ASP HA . . 5.190 4.809 4.648 4.973 . 0 0 "[ . 1 . 2]" 1
211 1 11 VAL HA 1 14 LEU H . . 3.760 2.805 2.271 3.432 . 0 0 "[ . 1 . 2]" 1
212 1 11 VAL HA 1 14 LEU HB2 . . 3.860 2.051 1.845 2.851 . 0 0 "[ . 1 . 2]" 1
213 1 11 VAL HA 1 14 LEU HB3 . . 4.080 2.332 2.092 2.637 . 0 0 "[ . 1 . 2]" 1
214 1 11 VAL HA 1 14 LEU MD1 . . 4.070 3.170 2.087 4.164 0.094 9 0 "[ . 1 . 2]" 1
215 1 11 VAL HA 1 14 LEU HG . . 4.560 4.184 3.024 4.641 0.081 4 0 "[ . 1 . 2]" 1
216 1 11 VAL HA 1 15 LEU H . . 4.090 2.976 2.556 3.699 . 0 0 "[ . 1 . 2]" 1
217 1 11 VAL HB 1 12 ASP H . . 3.750 3.687 3.165 3.858 0.108 13 0 "[ . 1 . 2]" 1
218 1 11 VAL HB 1 14 LEU H . . 5.500 5.050 4.703 5.479 . 0 0 "[ . 1 . 2]" 1
219 1 11 VAL MG2 1 12 ASP H . . 4.220 3.320 2.295 4.246 0.026 16 0 "[ . 1 . 2]" 1
220 1 11 VAL MG2 1 14 LEU H . . 5.110 4.827 4.649 5.034 . 0 0 "[ . 1 . 2]" 1
221 1 11 VAL MG2 1 14 LEU HB2 . . 4.090 4.144 3.478 4.346 0.256 13 0 "[ . 1 . 2]" 1
222 1 11 VAL MG2 1 14 LEU MD1 . . 4.140 3.918 3.222 4.205 0.065 19 0 "[ . 1 . 2]" 1
223 1 11 VAL MG2 1 15 LEU HB2 . . 5.500 4.676 4.125 5.358 . 0 0 "[ . 1 . 2]" 1
224 1 12 ASP H 1 12 ASP QB . . 3.180 2.149 1.989 2.290 . 0 0 "[ . 1 . 2]" 1
225 1 12 ASP H 1 13 ILE H . . 3.900 2.713 2.569 2.953 . 0 0 "[ . 1 . 2]" 1
226 1 12 ASP H 1 13 ILE HB . . 5.200 4.743 4.567 4.998 . 0 0 "[ . 1 . 2]" 1
227 1 12 ASP H 1 13 ILE MD . . 5.500 3.726 3.535 3.983 . 0 0 "[ . 1 . 2]" 1
228 1 12 ASP H 1 14 LEU H . . 4.980 3.733 3.464 3.880 . 0 0 "[ . 1 . 2]" 1
229 1 12 ASP HA 1 13 ILE HA . . 5.030 5.040 4.956 5.102 0.072 6 0 "[ . 1 . 2]" 1
230 1 12 ASP HA 1 14 LEU H . . 4.730 4.467 4.176 4.746 0.016 1 0 "[ . 1 . 2]" 1
231 1 12 ASP HA 1 16 ASN H . . 3.980 3.452 3.106 4.006 0.026 4 0 "[ . 1 . 2]" 1
232 1 12 ASP HA 1 16 ASN QB . . 3.430 2.450 2.057 3.238 . 0 0 "[ . 1 . 2]" 1
233 1 12 ASP HA 1 16 ASN HD21 . . 4.460 2.490 1.717 4.485 0.025 7 0 "[ . 1 . 2]" 1
234 1 12 ASP HA 1 16 ASN HD22 . . 3.960 3.761 3.261 4.010 0.050 12 0 "[ . 1 . 2]" 1
235 1 12 ASP QB 1 13 ILE H . . 3.740 2.556 2.298 2.824 . 0 0 "[ . 1 . 2]" 1
236 1 12 ASP QB 1 13 ILE HA . . 4.480 4.467 4.099 4.535 0.055 2 0 "[ . 1 . 2]" 1
237 1 12 ASP QB 1 13 ILE HB . . 4.920 4.519 4.307 4.681 . 0 0 "[ . 1 . 2]" 1
238 1 12 ASP QB 1 13 ILE MD . . 5.240 2.303 2.138 2.507 . 0 0 "[ . 1 . 2]" 1
239 1 12 ASP QB 1 13 ILE HG12 . . 5.180 5.091 4.880 5.213 0.033 16 0 "[ . 1 . 2]" 1
240 1 12 ASP QB 1 13 ILE HG13 . . 5.210 4.597 4.338 4.899 . 0 0 "[ . 1 . 2]" 1
241 1 12 ASP QB 1 14 LEU H . . 4.960 4.504 4.231 4.758 . 0 0 "[ . 1 . 2]" 1
242 1 13 ILE H 1 13 ILE HB . . 3.400 2.392 2.293 2.445 . 0 0 "[ . 1 . 2]" 1
243 1 13 ILE H 1 13 ILE MD . . 4.590 2.157 1.901 2.383 . 0 0 "[ . 1 . 2]" 1
244 1 13 ILE H 1 13 ILE HG12 . . 4.150 3.943 3.752 4.155 0.005 2 0 "[ . 1 . 2]" 1
245 1 13 ILE H 1 13 ILE HG13 . . 3.850 3.710 3.410 3.867 0.017 9 0 "[ . 1 . 2]" 1
246 1 13 ILE H 1 13 ILE MG . . 4.470 3.758 3.691 3.784 . 0 0 "[ . 1 . 2]" 1
247 1 13 ILE H 1 14 LEU H . . 3.590 2.384 2.276 2.659 . 0 0 "[ . 1 . 2]" 1
248 1 13 ILE H 1 14 LEU HA . . 5.500 4.928 4.749 5.156 . 0 0 "[ . 1 . 2]" 1
249 1 13 ILE H 1 14 LEU HB2 . . 5.500 4.133 3.719 4.528 . 0 0 "[ . 1 . 2]" 1
250 1 13 ILE H 1 14 LEU HB3 . . 5.240 5.252 4.767 5.330 0.090 10 0 "[ . 1 . 2]" 1
251 1 13 ILE H 1 15 LEU H . . 4.960 4.656 4.457 4.969 0.009 15 0 "[ . 1 . 2]" 1
252 1 13 ILE H 1 16 ASN H . . 5.500 4.965 4.646 5.195 . 0 0 "[ . 1 . 2]" 1
253 1 13 ILE H 1 17 GLY H . . 5.500 4.766 4.461 4.934 . 0 0 "[ . 1 . 2]" 1
254 1 13 ILE H 1 38 ILE MG . . 5.500 3.869 3.619 4.121 . 0 0 "[ . 1 . 2]" 1
255 1 13 ILE HA 1 13 ILE MD . . 3.890 3.075 2.925 3.235 . 0 0 "[ . 1 . 2]" 1
256 1 13 ILE HA 1 13 ILE HG12 . . 3.640 3.629 3.527 3.675 0.035 4 0 "[ . 1 . 2]" 1
257 1 13 ILE HA 1 13 ILE MG . . 3.560 2.241 2.213 2.305 . 0 0 "[ . 1 . 2]" 1
258 1 13 ILE HA 1 14 LEU HA . . 4.710 4.615 4.513 4.730 0.020 13 0 "[ . 1 . 2]" 1
259 1 13 ILE HA 1 16 ASN H . . 5.390 5.196 4.991 5.457 0.067 9 0 "[ . 1 . 2]" 1
260 1 13 ILE HA 1 17 GLY H . . 3.710 3.537 3.386 3.680 . 0 0 "[ . 1 . 2]" 1
261 1 13 ILE HA 1 17 GLY HA2 . . 5.200 3.196 3.014 3.588 . 0 0 "[ . 1 . 2]" 1
262 1 13 ILE HA 1 17 GLY HA3 . . 4.360 4.427 4.332 4.502 0.142 4 0 "[ . 1 . 2]" 1
263 1 13 ILE HA 1 18 ALA H . . 5.500 3.071 2.651 4.559 . 0 0 "[ . 1 . 2]" 1
264 1 13 ILE HA 1 23 VAL MG2 . . 5.390 3.629 3.343 4.273 . 0 0 "[ . 1 . 2]" 1
265 1 13 ILE HA 1 38 ILE MG . . 5.500 4.320 4.164 4.412 . 0 0 "[ . 1 . 2]" 1
266 1 13 ILE HA 1 39 CYS HB3 . . 5.300 4.835 4.649 5.138 . 0 0 "[ . 1 . 2]" 1
267 1 13 ILE HB 1 14 LEU H . . 3.630 2.654 2.252 3.186 . 0 0 "[ . 1 . 2]" 1
268 1 13 ILE HB 1 14 LEU HA . . 5.500 4.052 3.533 4.712 . 0 0 "[ . 1 . 2]" 1
269 1 13 ILE HB 1 38 ILE MG . . 4.140 2.076 1.963 2.317 . 0 0 "[ . 1 . 2]" 1
270 1 13 ILE MD 1 13 ILE MG . . 3.850 3.276 3.211 3.311 . 0 0 "[ . 1 . 2]" 1
271 1 13 ILE MD 1 14 LEU H . . 5.500 3.898 3.567 4.170 . 0 0 "[ . 1 . 2]" 1
272 1 13 ILE MD 1 17 GLY H . . 5.500 5.516 5.309 5.548 0.048 7 0 "[ . 1 . 2]" 1
273 1 13 ILE MD 1 19 ARG H . . 5.500 4.957 4.580 5.429 . 0 0 "[ . 1 . 2]" 1
274 1 13 ILE MD 1 38 ILE MG . . 5.300 3.567 3.074 4.086 . 0 0 "[ . 1 . 2]" 1
275 1 13 ILE HG12 1 13 ILE MG . . 3.730 2.225 2.111 2.338 . 0 0 "[ . 1 . 2]" 1
276 1 13 ILE HG12 1 14 LEU H . . 5.500 5.044 4.619 5.512 0.012 10 0 "[ . 1 . 2]" 1
277 1 13 ILE HG12 1 74 LEU MD2 . . 3.890 2.964 2.362 3.835 . 0 0 "[ . 1 . 2]" 1
278 1 13 ILE HG13 1 14 LEU H . . 5.500 5.032 4.822 5.215 . 0 0 "[ . 1 . 2]" 1
279 1 13 ILE HG13 1 74 LEU MD2 . . 5.500 2.834 2.018 4.677 . 0 0 "[ . 1 . 2]" 1
280 1 13 ILE MG 1 14 LEU H . . 4.320 3.384 3.184 3.705 . 0 0 "[ . 1 . 2]" 1
281 1 13 ILE MG 1 14 LEU HA . . 5.500 2.998 2.591 3.684 . 0 0 "[ . 1 . 2]" 1
282 1 13 ILE MG 1 17 GLY H . . 4.920 4.539 4.292 4.863 . 0 0 "[ . 1 . 2]" 1
283 1 13 ILE MG 1 17 GLY HA2 . . 4.740 3.723 3.605 3.938 . 0 0 "[ . 1 . 2]" 1
284 1 13 ILE MG 1 17 GLY HA3 . . 5.010 5.046 5.005 5.080 0.070 9 0 "[ . 1 . 2]" 1
285 1 13 ILE MG 1 18 ALA H . . 4.970 3.228 2.702 4.893 . 0 0 "[ . 1 . 2]" 1
286 1 13 ILE MG 1 18 ALA HA . . 5.500 3.717 2.847 4.324 . 0 0 "[ . 1 . 2]" 1
287 1 13 ILE MG 1 18 ALA MB . . 4.750 2.154 2.030 2.679 . 0 0 "[ . 1 . 2]" 1
288 1 13 ILE MG 1 19 ARG H . . 5.500 5.173 4.605 5.503 0.003 13 0 "[ . 1 . 2]" 1
289 1 13 ILE MG 1 23 VAL MG2 . . 3.420 2.344 1.996 3.045 . 0 0 "[ . 1 . 2]" 1
290 1 13 ILE MG 1 38 ILE H . . 5.500 4.613 4.468 4.723 . 0 0 "[ . 1 . 2]" 1
291 1 13 ILE MG 1 38 ILE HB . . 5.110 2.145 1.994 2.324 . 0 0 "[ . 1 . 2]" 1
292 1 13 ILE MG 1 38 ILE MG . . 3.710 2.055 1.969 2.137 . 0 0 "[ . 1 . 2]" 1
293 1 13 ILE MG 1 39 CYS H . . 5.500 3.720 3.548 3.955 . 0 0 "[ . 1 . 2]" 1
294 1 13 ILE MG 1 39 CYS HB2 . . 5.500 3.045 2.862 3.289 . 0 0 "[ . 1 . 2]" 1
295 1 13 ILE MG 1 39 CYS HB3 . . 5.110 2.177 1.989 2.415 . 0 0 "[ . 1 . 2]" 1
296 1 13 ILE MG 1 74 LEU MD2 . . 4.240 3.782 3.286 4.313 0.073 10 0 "[ . 1 . 2]" 1
297 1 14 LEU H 1 14 LEU HB2 . . 3.760 2.065 1.820 2.239 . 0 0 "[ . 1 . 2]" 1
298 1 14 LEU H 1 14 LEU HB3 . . 3.040 3.034 2.729 3.096 0.056 10 0 "[ . 1 . 2]" 1
299 1 14 LEU H 1 14 LEU MD1 . . 4.730 4.166 3.755 4.446 . 0 0 "[ . 1 . 2]" 1
300 1 14 LEU H 1 15 LEU H . . 3.690 2.938 2.708 3.140 . 0 0 "[ . 1 . 2]" 1
301 1 14 LEU H 1 17 GLY H . . 5.500 4.138 3.366 4.366 . 0 0 "[ . 1 . 2]" 1
302 1 14 LEU H 1 38 ILE MG . . 4.610 3.186 2.811 3.569 . 0 0 "[ . 1 . 2]" 1
303 1 14 LEU HA 1 14 LEU MD1 . . 4.540 3.724 2.108 3.878 . 0 0 "[ . 1 . 2]" 1
304 1 14 LEU HA 1 14 LEU MD2 . . 3.080 2.087 1.937 2.819 . 0 0 "[ . 1 . 2]" 1
305 1 14 LEU HA 1 16 ASN H . . 5.500 5.189 4.916 5.375 . 0 0 "[ . 1 . 2]" 1
306 1 14 LEU HA 1 17 GLY H . . 5.370 4.544 4.197 4.788 . 0 0 "[ . 1 . 2]" 1
307 1 14 LEU HA 1 17 GLY HA2 . . 5.500 4.832 4.284 5.184 . 0 0 "[ . 1 . 2]" 1
308 1 14 LEU HA 1 23 VAL MG2 . . 4.220 3.919 3.042 4.268 0.048 14 0 "[ . 1 . 2]" 1
309 1 14 LEU HA 1 25 GLN HE21 . . 5.500 4.165 3.211 5.017 . 0 0 "[ . 1 . 2]" 1
310 1 14 LEU HA 1 25 GLN HE22 . . 5.500 3.582 3.119 4.565 . 0 0 "[ . 1 . 2]" 1
311 1 14 LEU HA 1 38 ILE MD . . 5.500 5.515 5.283 5.554 0.054 15 0 "[ . 1 . 2]" 1
312 1 14 LEU HA 1 38 ILE MG . . 3.610 2.994 2.773 3.261 . 0 0 "[ . 1 . 2]" 1
313 1 14 LEU HB2 1 14 LEU MD1 . . 3.580 2.479 2.244 3.174 . 0 0 "[ . 1 . 2]" 1
314 1 14 LEU HB2 1 14 LEU MD2 . . 3.530 3.127 1.890 3.259 . 0 0 "[ . 1 . 2]" 1
315 1 14 LEU HB2 1 15 LEU H . . 4.520 3.203 2.678 3.372 . 0 0 "[ . 1 . 2]" 1
316 1 14 LEU HB2 1 15 LEU HA . . 5.500 5.506 5.184 5.575 0.075 1 0 "[ . 1 . 2]" 1
317 1 14 LEU HB2 1 16 ASN H . . 5.370 5.166 4.557 5.440 0.070 15 0 "[ . 1 . 2]" 1
318 1 14 LEU HB2 1 38 ILE MG . . 3.470 3.242 2.975 3.495 0.025 10 0 "[ . 1 . 2]" 1
319 1 14 LEU HB3 1 14 LEU MD1 . . 3.270 2.325 2.203 2.889 . 0 0 "[ . 1 . 2]" 1
320 1 14 LEU HB3 1 15 LEU H . . 3.800 2.358 1.755 2.712 . 0 0 "[ . 1 . 2]" 1
321 1 14 LEU HB3 1 25 GLN HE22 . . 5.500 5.413 4.881 5.596 0.096 15 0 "[ . 1 . 2]" 1
322 1 14 LEU MD1 1 15 LEU H . . 5.500 4.207 3.357 4.712 . 0 0 "[ . 1 . 2]" 1
323 1 14 LEU MD1 1 25 GLN HG2 . . 5.500 4.754 3.508 5.537 0.037 5 0 "[ . 1 . 2]" 1
324 1 14 LEU MD1 1 38 ILE MG . . 5.190 3.580 3.147 4.598 . 0 0 "[ . 1 . 2]" 1
325 1 14 LEU MD2 1 15 LEU H . . 4.140 3.923 3.713 4.175 0.035 15 0 "[ . 1 . 2]" 1
326 1 14 LEU MD2 1 17 GLY H . . 5.500 5.563 5.457 5.691 0.191 9 0 "[ . 1 . 2]" 1
327 1 14 LEU MD2 1 25 GLN HB2 . . 5.500 4.881 4.430 5.490 . 0 0 "[ . 1 . 2]" 1
328 1 14 LEU MD2 1 25 GLN HE21 . . 4.780 3.104 2.638 4.666 . 0 0 "[ . 1 . 2]" 1
329 1 14 LEU MD2 1 25 GLN HE22 . . 4.340 2.493 2.006 3.554 . 0 0 "[ . 1 . 2]" 1
330 1 14 LEU MD2 1 25 GLN HG2 . . 4.690 3.454 2.913 4.287 . 0 0 "[ . 1 . 2]" 1
331 1 14 LEU MD2 1 25 GLN HG3 . . 5.050 3.453 2.434 4.368 . 0 0 "[ . 1 . 2]" 1
332 1 14 LEU MD2 1 38 ILE MG . . 3.370 3.284 2.257 3.426 0.056 17 0 "[ . 1 . 2]" 1
333 1 15 LEU H 1 15 LEU HB2 . . 3.400 2.410 2.283 2.542 . 0 0 "[ . 1 . 2]" 1
334 1 15 LEU H 1 15 LEU HB3 . . 3.930 3.565 2.635 3.719 . 0 0 "[ . 1 . 2]" 1
335 1 15 LEU H 1 16 ASN H . . 3.630 2.226 2.073 2.466 . 0 0 "[ . 1 . 2]" 1
336 1 15 LEU H 1 16 ASN HA . . 5.430 4.915 4.658 5.120 . 0 0 "[ . 1 . 2]" 1
337 1 15 LEU H 1 16 ASN HD21 . . 5.500 4.018 3.302 4.848 . 0 0 "[ . 1 . 2]" 1
338 1 15 LEU H 1 16 ASN HD22 . . 5.500 5.041 4.340 5.520 0.020 2 0 "[ . 1 . 2]" 1
339 1 15 LEU H 1 17 GLY H . . 5.060 3.442 2.928 3.738 . 0 0 "[ . 1 . 2]" 1
340 1 15 LEU HB2 1 16 ASN H . . 3.730 2.706 2.346 3.322 . 0 0 "[ . 1 . 2]" 1
341 1 15 LEU HB2 1 16 ASN HA . . 4.500 4.529 4.245 4.741 0.241 7 0 "[ . 1 . 2]" 1
342 1 15 LEU HB2 1 16 ASN HD21 . . 5.110 3.568 2.569 4.555 . 0 0 "[ . 1 . 2]" 1
343 1 15 LEU HB2 1 16 ASN HD22 . . 5.000 3.835 3.234 4.698 . 0 0 "[ . 1 . 2]" 1
344 1 15 LEU HB2 1 17 GLY H . . 5.080 4.856 4.591 5.222 0.142 7 0 "[ . 1 . 2]" 1
345 1 15 LEU HB3 1 16 ASN H . . 4.000 3.415 2.160 3.976 . 0 0 "[ . 1 . 2]" 1
346 1 15 LEU HB3 1 16 ASN HD21 . . 5.440 4.491 1.892 5.499 0.059 19 0 "[ . 1 . 2]" 1
347 1 15 LEU HB3 1 16 ASN HD22 . . 5.270 4.500 2.727 5.289 0.019 9 0 "[ . 1 . 2]" 1
348 1 15 LEU HB3 1 17 GLY H . . 5.500 5.261 4.408 5.526 0.026 17 0 "[ . 1 . 2]" 1
349 1 16 ASN H 1 16 ASN QB . . 3.350 2.512 2.294 2.779 . 0 0 "[ . 1 . 2]" 1
350 1 16 ASN H 1 16 ASN HD21 . . 4.570 2.606 2.161 3.332 . 0 0 "[ . 1 . 2]" 1
351 1 16 ASN H 1 16 ASN HD22 . . 4.630 3.716 3.198 4.107 . 0 0 "[ . 1 . 2]" 1
352 1 16 ASN H 1 17 GLY H . . 3.240 2.455 2.235 2.679 . 0 0 "[ . 1 . 2]" 1
353 1 16 ASN HA 1 16 ASN HD21 . . 4.810 3.916 2.268 4.470 . 0 0 "[ . 1 . 2]" 1
354 1 16 ASN HA 1 16 ASN HD22 . . 4.850 4.419 3.894 4.719 . 0 0 "[ . 1 . 2]" 1
355 1 16 ASN QB 1 17 GLY H . . 4.260 3.138 2.869 3.414 . 0 0 "[ . 1 . 2]" 1
356 1 16 ASN QB 1 17 GLY HA2 . . 5.500 4.841 4.589 5.026 . 0 0 "[ . 1 . 2]" 1
357 1 16 ASN QB 1 17 GLY HA3 . . 5.500 4.578 4.307 4.747 . 0 0 "[ . 1 . 2]" 1
358 1 16 ASN HD21 1 17 GLY H . . 5.500 4.588 4.136 5.149 . 0 0 "[ . 1 . 2]" 1
359 1 17 GLY H 1 18 ALA HA . . 5.500 5.257 5.057 5.476 . 0 0 "[ . 1 . 2]" 1
360 1 17 GLY H 1 23 VAL MG2 . . 4.660 4.076 3.767 4.702 0.042 2 0 "[ . 1 . 2]" 1
361 1 17 GLY HA2 1 18 ALA H . . 3.210 2.202 2.028 2.874 . 0 0 "[ . 1 . 2]" 1
362 1 17 GLY HA2 1 23 VAL MG2 . . 4.500 2.413 1.998 3.029 . 0 0 "[ . 1 . 2]" 1
363 1 17 GLY HA3 1 18 ALA H . . 3.310 2.757 2.250 3.012 . 0 0 "[ . 1 . 2]" 1
364 1 17 GLY HA3 1 23 VAL MG2 . . 3.950 3.453 2.857 3.947 . 0 0 "[ . 1 . 2]" 1
365 1 18 ALA H 1 18 ALA MB . . 3.450 2.200 2.101 2.362 . 0 0 "[ . 1 . 2]" 1
366 1 18 ALA HA 1 19 ARG H . . 2.820 2.438 2.054 2.575 . 0 0 "[ . 1 . 2]" 1
367 1 18 ALA HA 1 19 ARG QD . . 5.500 4.654 4.102 5.370 . 0 0 "[ . 1 . 2]" 1
368 1 18 ALA MB 1 19 ARG H . . 4.230 2.108 1.936 2.465 . 0 0 "[ . 1 . 2]" 1
369 1 18 ALA MB 1 19 ARG HA . . 5.330 4.071 3.908 4.213 . 0 0 "[ . 1 . 2]" 1
370 1 18 ALA MB 1 19 ARG HB3 . . 4.870 4.310 3.467 4.957 0.087 8 0 "[ . 1 . 2]" 1
371 1 18 ALA MB 1 20 ASP H . . 5.500 4.594 4.362 4.796 . 0 0 "[ . 1 . 2]" 1
372 1 18 ALA MB 1 21 TRP HB2 . . 4.200 2.154 1.942 2.549 . 0 0 "[ . 1 . 2]" 1
373 1 18 ALA MB 1 21 TRP HD1 . . 4.780 3.516 2.895 3.943 . 0 0 "[ . 1 . 2]" 1
374 1 18 ALA MB 1 74 LEU MD1 . . 5.050 3.393 2.116 4.630 . 0 0 "[ . 1 . 2]" 1
375 1 18 ALA MB 1 74 LEU MD2 . . 4.400 2.989 2.186 4.219 . 0 0 "[ . 1 . 2]" 1
376 1 19 ARG H 1 19 ARG HB2 . . 3.520 2.282 1.892 2.850 . 0 0 "[ . 1 . 2]" 1
377 1 19 ARG H 1 19 ARG HB3 . . 3.840 3.397 3.014 3.776 . 0 0 "[ . 1 . 2]" 1
378 1 19 ARG H 1 19 ARG QD . . 5.170 3.142 2.483 4.081 . 0 0 "[ . 1 . 2]" 1
379 1 19 ARG H 1 19 ARG HG2 . . 4.270 3.269 2.022 4.306 0.036 20 0 "[ . 1 . 2]" 1
380 1 19 ARG H 1 20 ASP H . . 4.740 4.217 4.032 4.429 . 0 0 "[ . 1 . 2]" 1
381 1 19 ARG H 1 21 TRP HD1 . . 5.500 4.097 3.395 4.741 . 0 0 "[ . 1 . 2]" 1
382 1 19 ARG H 1 74 LEU MD1 . . 5.500 4.346 2.652 5.518 0.018 13 0 "[ . 1 . 2]" 1
383 1 19 ARG H 1 74 LEU MD2 . . 5.500 3.516 2.439 5.517 0.017 5 0 "[ . 1 . 2]" 1
384 1 19 ARG HA 1 19 ARG HB2 . . 2.980 2.980 2.896 3.056 0.076 3 0 "[ . 1 . 2]" 1
385 1 19 ARG HA 1 19 ARG QD . . 4.410 2.866 2.389 3.390 . 0 0 "[ . 1 . 2]" 1
386 1 19 ARG HA 1 19 ARG HG2 . . 3.990 3.536 3.377 3.690 . 0 0 "[ . 1 . 2]" 1
387 1 19 ARG HA 1 20 ASP H . . 2.820 2.618 2.399 2.868 0.048 18 0 "[ . 1 . 2]" 1
388 1 19 ARG HA 1 20 ASP HB3 . . 5.500 5.590 5.366 5.708 0.208 1 0 "[ . 1 . 2]" 1
389 1 19 ARG HA 1 21 TRP H . . 4.320 4.201 4.001 4.365 0.045 10 0 "[ . 1 . 2]" 1
390 1 19 ARG HB2 1 20 ASP H . . 4.130 2.932 2.162 3.593 . 0 0 "[ . 1 . 2]" 1
391 1 19 ARG HB3 1 19 ARG QD . . 3.710 3.224 2.607 3.549 . 0 0 "[ . 1 . 2]" 1
392 1 19 ARG HB3 1 20 ASP H . . 4.080 1.911 1.516 2.208 . 0 0 "[ . 1 . 2]" 1
393 1 19 ARG HB3 1 20 ASP HA . . 5.270 4.499 4.348 4.634 . 0 0 "[ . 1 . 2]" 1
394 1 19 ARG HB3 1 20 ASP HB2 . . 5.440 3.275 2.804 4.038 . 0 0 "[ . 1 . 2]" 1
395 1 19 ARG HB3 1 20 ASP HB3 . . 5.010 4.407 3.478 5.018 0.008 13 0 "[ . 1 . 2]" 1
396 1 19 ARG HB3 1 21 TRP HD1 . . 4.610 3.175 2.263 4.190 . 0 0 "[ . 1 . 2]" 1
397 1 19 ARG HB3 1 21 TRP HE1 . . 4.870 4.280 3.492 4.982 0.112 8 0 "[ . 1 . 2]" 1
398 1 19 ARG QD 1 20 ASP H . . 5.140 4.379 3.965 4.654 . 0 0 "[ . 1 . 2]" 1
399 1 19 ARG QD 1 74 LEU HB2 . . 4.670 4.604 4.091 4.858 0.188 6 0 "[ . 1 . 2]" 1
400 1 19 ARG QD 1 74 LEU MD2 . . 5.330 4.487 3.005 6.201 0.871 5 5 "[ - + *** . 2]" 1
401 1 19 ARG QD 1 75 GLU H . . 5.500 4.571 4.151 5.003 . 0 0 "[ . 1 . 2]" 1
402 1 19 ARG QD 1 75 GLU HB3 . . 3.630 2.847 2.083 3.637 0.007 16 0 "[ . 1 . 2]" 1
403 1 19 ARG QD 1 75 GLU HG2 . . 5.500 3.644 2.898 4.117 . 0 0 "[ . 1 . 2]" 1
404 1 19 ARG QD 1 75 GLU HG3 . . 5.500 4.935 4.376 5.633 0.133 16 0 "[ . 1 . 2]" 1
405 1 19 ARG HG2 1 20 ASP H . . 4.230 3.876 2.989 4.343 0.113 8 0 "[ . 1 . 2]" 1
406 1 19 ARG HG2 1 21 TRP H . . 5.450 5.322 4.936 5.528 0.078 2 0 "[ . 1 . 2]" 1
407 1 19 ARG HG2 1 75 GLU HA . . 3.950 3.476 2.306 4.223 0.273 4 0 "[ . 1 . 2]" 1
408 1 19 ARG HG2 1 75 GLU HG2 . . 4.930 4.177 3.297 4.942 0.012 4 0 "[ . 1 . 2]" 1
409 1 20 ASP H 1 21 TRP H . . 3.430 3.179 3.042 3.266 . 0 0 "[ . 1 . 2]" 1
410 1 20 ASP H 1 21 TRP HA . . 5.500 5.512 5.429 5.555 0.055 2 0 "[ . 1 . 2]" 1
411 1 20 ASP H 1 21 TRP HD1 . . 3.770 3.260 2.907 3.641 . 0 0 "[ . 1 . 2]" 1
412 1 20 ASP HA 1 21 TRP HD1 . . 5.060 4.466 4.118 4.702 . 0 0 "[ . 1 . 2]" 1
413 1 20 ASP HB2 1 21 TRP H . . 5.500 3.953 3.401 4.499 . 0 0 "[ . 1 . 2]" 1
414 1 20 ASP HB3 1 21 TRP H . . 4.710 3.938 3.214 4.369 . 0 0 "[ . 1 . 2]" 1
415 1 20 ASP HB3 1 21 TRP HD1 . . 4.100 3.763 2.515 4.168 0.068 5 0 "[ . 1 . 2]" 1
416 1 20 ASP HB3 1 21 TRP HE1 . . 5.500 4.960 3.800 5.552 0.052 2 0 "[ . 1 . 2]" 1
417 1 20 ASP HB3 1 41 ARG HG2 . . 5.500 5.280 4.621 5.579 0.079 4 0 "[ . 1 . 2]" 1
418 1 20 ASP HB3 1 41 ARG HG3 . . 5.500 3.980 3.383 4.472 . 0 0 "[ . 1 . 2]" 1
419 1 21 TRP H 1 21 TRP HB2 . . 3.500 2.654 2.500 2.783 . 0 0 "[ . 1 . 2]" 1
420 1 21 TRP H 1 21 TRP HB3 . . 3.790 3.593 3.464 3.752 . 0 0 "[ . 1 . 2]" 1
421 1 21 TRP H 1 21 TRP HD1 . . 3.010 2.067 1.645 2.411 . 0 0 "[ . 1 . 2]" 1
422 1 21 TRP H 1 21 TRP HE1 . . 5.170 4.541 4.096 4.940 . 0 0 "[ . 1 . 2]" 1
423 1 21 TRP H 1 21 TRP HE3 . . 5.500 5.532 5.407 5.686 0.186 19 0 "[ . 1 . 2]" 1
424 1 21 TRP H 1 22 ASP H . . 4.690 4.478 4.388 4.600 . 0 0 "[ . 1 . 2]" 1
425 1 21 TRP H 1 41 ARG HB2 . . 5.500 4.387 4.095 4.799 . 0 0 "[ . 1 . 2]" 1
426 1 21 TRP H 1 41 ARG HG3 . . 5.480 4.830 4.422 5.161 . 0 0 "[ . 1 . 2]" 1
427 1 21 TRP H 1 74 LEU MD1 . . 5.500 5.052 3.909 5.581 0.081 19 0 "[ . 1 . 2]" 1
428 1 21 TRP H 1 74 LEU MD2 . . 5.500 5.219 4.669 5.675 0.175 8 0 "[ . 1 . 2]" 1
429 1 21 TRP HA 1 21 TRP HD1 . . 4.400 3.477 3.195 3.648 . 0 0 "[ . 1 . 2]" 1
430 1 21 TRP HA 1 21 TRP HE3 . . 4.550 4.331 4.127 4.568 0.018 3 0 "[ . 1 . 2]" 1
431 1 21 TRP HA 1 22 ASP H . . 3.260 2.273 2.153 2.413 . 0 0 "[ . 1 . 2]" 1
432 1 21 TRP HA 1 40 LYS H . . 5.420 4.829 4.491 5.200 . 0 0 "[ . 1 . 2]" 1
433 1 21 TRP HA 1 41 ARG H . . 5.500 4.999 4.763 5.364 . 0 0 "[ . 1 . 2]" 1
434 1 21 TRP HA 1 41 ARG HB2 . . 4.510 2.424 1.998 2.632 . 0 0 "[ . 1 . 2]" 1
435 1 21 TRP HA 1 41 ARG HB3 . . 5.100 4.160 3.662 4.367 . 0 0 "[ . 1 . 2]" 1
436 1 21 TRP HA 1 41 ARG HG3 . . 4.640 2.914 2.532 3.533 . 0 0 "[ . 1 . 2]" 1
437 1 21 TRP HB2 1 21 TRP HD1 . . 3.420 3.340 3.202 3.479 0.059 17 0 "[ . 1 . 2]" 1
438 1 21 TRP HB2 1 21 TRP HE3 . . 3.940 3.519 3.331 3.700 . 0 0 "[ . 1 . 2]" 1
439 1 21 TRP HB2 1 22 ASP H . . 4.940 3.437 3.090 3.665 . 0 0 "[ . 1 . 2]" 1
440 1 21 TRP HB2 1 39 CYS HB2 . . 3.290 2.418 2.245 2.676 . 0 0 "[ . 1 . 2]" 1
441 1 21 TRP HB2 1 39 CYS HB3 . . 4.320 3.404 3.305 3.487 . 0 0 "[ . 1 . 2]" 1
442 1 21 TRP HB3 1 21 TRP HE3 . . 3.530 2.384 2.253 2.501 . 0 0 "[ . 1 . 2]" 1
443 1 21 TRP HB3 1 22 ASP H . . 4.030 2.326 2.000 2.558 . 0 0 "[ . 1 . 2]" 1
444 1 21 TRP HD1 1 22 ASP H . . 5.500 5.392 5.100 5.525 0.025 14 0 "[ . 1 . 2]" 1
445 1 21 TRP HD1 1 41 ARG HB2 . . 4.640 3.717 2.973 3.909 . 0 0 "[ . 1 . 2]" 1
446 1 21 TRP HD1 1 41 ARG HD3 . . 5.270 5.168 4.531 5.368 0.098 18 0 "[ . 1 . 2]" 1
447 1 21 TRP HE1 1 41 ARG HB2 . . 5.500 4.089 3.638 4.474 . 0 0 "[ . 1 . 2]" 1
448 1 21 TRP HE1 1 41 ARG HD2 . . 5.500 2.997 2.620 3.418 . 0 0 "[ . 1 . 2]" 1
449 1 21 TRP HE1 1 41 ARG HD3 . . 5.280 4.218 3.732 4.560 . 0 0 "[ . 1 . 2]" 1
450 1 21 TRP HE1 1 41 ARG HG3 . . 5.500 5.020 3.968 5.536 0.036 13 0 "[ . 1 . 2]" 1
451 1 21 TRP HE1 1 73 TYR QE . . 5.370 5.078 4.584 5.520 0.150 16 0 "[ . 1 . 2]" 1
452 1 21 TRP HE1 1 74 LEU H . . 5.500 5.145 4.798 5.325 . 0 0 "[ . 1 . 2]" 1
453 1 21 TRP HE1 1 74 LEU HA . . 3.490 2.497 2.109 2.723 . 0 0 "[ . 1 . 2]" 1
454 1 21 TRP HE1 1 74 LEU HB2 . . 5.160 4.948 4.694 5.201 0.041 6 0 "[ . 1 . 2]" 1
455 1 21 TRP HE1 1 74 LEU HB3 . . 5.500 4.000 3.458 4.447 . 0 0 "[ . 1 . 2]" 1
456 1 21 TRP HE1 1 74 LEU MD1 . . 4.900 3.310 2.925 3.625 . 0 0 "[ . 1 . 2]" 1
457 1 21 TRP HE1 1 74 LEU MD2 . . 5.450 4.499 3.200 5.118 . 0 0 "[ . 1 . 2]" 1
458 1 21 TRP HE1 1 75 GLU H . . 5.500 4.847 4.496 5.077 . 0 0 "[ . 1 . 2]" 1
459 1 21 TRP HE1 1 75 GLU HA . . 5.500 4.337 4.078 4.667 . 0 0 "[ . 1 . 2]" 1
460 1 21 TRP HE1 1 76 THR H . . 5.500 4.838 4.073 5.501 0.001 4 0 "[ . 1 . 2]" 1
461 1 21 TRP HE3 1 22 ASP H . . 4.830 4.149 3.812 4.353 . 0 0 "[ . 1 . 2]" 1
462 1 21 TRP HE3 1 39 CYS H . . 4.940 4.410 4.126 4.592 . 0 0 "[ . 1 . 2]" 1
463 1 21 TRP HE3 1 39 CYS HB2 . . 4.100 2.794 2.280 3.543 . 0 0 "[ . 1 . 2]" 1
464 1 21 TRP HE3 1 40 LYS H . . 4.330 3.402 3.093 3.680 . 0 0 "[ . 1 . 2]" 1
465 1 21 TRP HE3 1 40 LYS HA . . 3.930 2.675 2.433 2.981 . 0 0 "[ . 1 . 2]" 1
466 1 21 TRP HE3 1 41 ARG H . . 4.270 3.376 3.203 3.670 . 0 0 "[ . 1 . 2]" 1
467 1 21 TRP HE3 1 41 ARG HA . . 4.940 4.777 4.452 4.942 0.002 18 0 "[ . 1 . 2]" 1
468 1 21 TRP HE3 1 41 ARG HB2 . . 4.830 3.525 3.134 3.836 . 0 0 "[ . 1 . 2]" 1
469 1 21 TRP HE3 1 41 ARG HB3 . . 4.790 4.118 3.393 4.675 . 0 0 "[ . 1 . 2]" 1
470 1 21 TRP HE3 1 45 TYR HA . . 5.310 4.062 3.852 4.378 . 0 0 "[ . 1 . 2]" 1
471 1 21 TRP HE3 1 46 LEU HB2 . . 5.440 3.306 3.086 3.751 . 0 0 "[ . 1 . 2]" 1
472 1 21 TRP HE3 1 46 LEU HB3 . . 4.690 4.641 4.320 4.769 0.079 3 0 "[ . 1 . 2]" 1
473 1 21 TRP HH2 1 41 ARG HB2 . . 5.500 5.076 4.584 5.556 0.056 19 0 "[ . 1 . 2]" 1
474 1 21 TRP HH2 1 44 THR HB . . 4.760 3.966 2.642 4.336 . 0 0 "[ . 1 . 2]" 1
475 1 21 TRP HH2 1 44 THR MG . . 3.750 2.122 1.871 2.284 . 0 0 "[ . 1 . 2]" 1
476 1 21 TRP HH2 1 46 LEU HB3 . . 5.500 5.425 5.039 5.578 0.078 7 0 "[ . 1 . 2]" 1
477 1 21 TRP HH2 1 46 LEU QD . . 5.460 2.424 2.088 3.234 . 0 0 "[ . 1 . 2]" 1
478 1 21 TRP HH2 1 73 TYR QE . . 3.510 2.332 1.975 3.033 . 0 0 "[ . 1 . 2]" 1
479 1 21 TRP HH2 1 74 LEU HA . . 5.130 4.834 4.439 5.271 0.141 6 0 "[ . 1 . 2]" 1
480 1 21 TRP HH2 1 74 LEU MD1 . . 5.130 4.014 3.351 5.168 0.038 10 0 "[ . 1 . 2]" 1
481 1 21 TRP HZ2 1 41 ARG H . . 5.500 5.535 5.325 5.607 0.107 16 0 "[ . 1 . 2]" 1
482 1 21 TRP HZ2 1 41 ARG HD3 . . 5.100 4.166 3.496 5.047 . 0 0 "[ . 1 . 2]" 1
483 1 21 TRP HZ2 1 44 THR MG . . 3.970 3.081 2.734 3.415 . 0 0 "[ . 1 . 2]" 1
484 1 21 TRP HZ2 1 46 LEU QD . . 4.320 3.463 3.039 3.812 . 0 0 "[ . 1 . 2]" 1
485 1 21 TRP HZ2 1 73 TYR QD . . 3.510 3.036 2.328 3.581 0.071 2 0 "[ . 1 . 2]" 1
486 1 21 TRP HZ2 1 73 TYR QE . . 3.310 2.376 2.078 2.708 . 0 0 "[ . 1 . 2]" 1
487 1 21 TRP HZ2 1 74 LEU H . . 5.500 5.152 4.897 5.470 . 0 0 "[ . 1 . 2]" 1
488 1 21 TRP HZ2 1 74 LEU HA . . 3.260 2.965 2.521 3.336 0.076 6 0 "[ . 1 . 2]" 1
489 1 21 TRP HZ2 1 74 LEU MD1 . . 4.060 3.346 2.940 4.125 0.065 8 0 "[ . 1 . 2]" 1
490 1 21 TRP HZ3 1 39 CYS H . . 5.500 5.115 4.600 5.359 . 0 0 "[ . 1 . 2]" 1
491 1 21 TRP HZ3 1 40 LYS H . . 5.390 5.131 4.860 5.365 . 0 0 "[ . 1 . 2]" 1
492 1 21 TRP HZ3 1 40 LYS HA . . 3.880 2.864 2.622 3.236 . 0 0 "[ . 1 . 2]" 1
493 1 21 TRP HZ3 1 41 ARG H . . 4.210 3.069 2.798 3.407 . 0 0 "[ . 1 . 2]" 1
494 1 21 TRP HZ3 1 41 ARG HB3 . . 5.500 4.170 3.787 4.631 . 0 0 "[ . 1 . 2]" 1
495 1 21 TRP HZ3 1 44 THR HB . . 4.960 4.832 3.580 5.098 0.138 14 0 "[ . 1 . 2]" 1
496 1 21 TRP HZ3 1 44 THR MG . . 3.710 2.946 2.701 3.296 . 0 0 "[ . 1 . 2]" 1
497 1 21 TRP HZ3 1 45 TYR H . . 5.500 3.216 2.921 3.481 . 0 0 "[ . 1 . 2]" 1
498 1 21 TRP HZ3 1 45 TYR HA . . 5.330 2.860 2.676 3.021 . 0 0 "[ . 1 . 2]" 1
499 1 21 TRP HZ3 1 46 LEU H . . 4.380 2.515 2.180 2.926 . 0 0 "[ . 1 . 2]" 1
500 1 21 TRP HZ3 1 46 LEU HB3 . . 5.260 4.298 3.695 4.566 . 0 0 "[ . 1 . 2]" 1
501 1 21 TRP HZ3 1 46 LEU QD . . 5.500 2.889 2.205 3.856 . 0 0 "[ . 1 . 2]" 1
502 1 22 ASP H 1 22 ASP QB . . 3.670 2.404 2.204 2.631 . 0 0 "[ . 1 . 2]" 1
503 1 22 ASP H 1 23 VAL H . . 4.820 4.483 4.309 4.590 . 0 0 "[ . 1 . 2]" 1
504 1 22 ASP H 1 39 CYS HA . . 5.030 4.532 4.224 4.800 . 0 0 "[ . 1 . 2]" 1
505 1 22 ASP H 1 39 CYS HB2 . . 4.630 3.869 3.592 4.244 . 0 0 "[ . 1 . 2]" 1
506 1 22 ASP H 1 40 LYS H . . 3.960 2.992 2.660 3.350 . 0 0 "[ . 1 . 2]" 1
507 1 22 ASP H 1 40 LYS HB2 . . 5.500 5.208 4.903 5.517 0.017 11 0 "[ . 1 . 2]" 1
508 1 22 ASP H 1 40 LYS HB3 . . 5.500 4.277 3.522 5.524 0.024 7 0 "[ . 1 . 2]" 1
509 1 22 ASP H 1 41 ARG H . . 5.500 4.787 4.595 4.899 . 0 0 "[ . 1 . 2]" 1
510 1 22 ASP H 1 41 ARG HA . . 4.700 3.594 3.370 3.800 . 0 0 "[ . 1 . 2]" 1
511 1 22 ASP H 1 41 ARG HB2 . . 5.070 3.756 3.218 4.009 . 0 0 "[ . 1 . 2]" 1
512 1 22 ASP H 1 41 ARG HB3 . . 5.500 5.302 4.612 5.583 0.083 10 0 "[ . 1 . 2]" 1
513 1 22 ASP H 1 41 ARG HG2 . . 5.500 5.626 5.529 5.728 0.228 10 0 "[ . 1 . 2]" 1
514 1 22 ASP HA 1 23 VAL H . . 2.780 2.593 2.403 2.780 . 0 0 "[ . 1 . 2]" 1
515 1 22 ASP HA 1 23 VAL HA . . 4.610 4.323 4.031 4.598 . 0 0 "[ . 1 . 2]" 1
516 1 22 ASP HA 1 23 VAL HB . . 4.650 4.364 3.259 4.734 0.084 4 0 "[ . 1 . 2]" 1
517 1 22 ASP HA 1 23 VAL MG2 . . 4.080 3.444 2.886 4.125 0.045 7 0 "[ . 1 . 2]" 1
518 1 22 ASP HA 1 24 LEU H . . 5.500 5.533 5.425 5.642 0.142 19 0 "[ . 1 . 2]" 1
519 1 22 ASP HA 1 39 CYS HA . . 5.500 5.360 5.137 5.491 . 0 0 "[ . 1 . 2]" 1
520 1 22 ASP HA 1 39 CYS HB2 . . 5.500 5.257 4.682 5.687 0.187 4 0 "[ . 1 . 2]" 1
521 1 22 ASP HA 1 40 LYS H . . 5.500 4.650 4.406 4.815 . 0 0 "[ . 1 . 2]" 1
522 1 22 ASP QB 1 23 VAL H . . 4.460 3.127 2.097 3.832 . 0 0 "[ . 1 . 2]" 1
523 1 22 ASP QB 1 40 LYS H . . 4.700 3.279 2.451 3.740 . 0 0 "[ . 1 . 2]" 1
524 1 23 VAL H 1 23 VAL HB . . 3.230 2.795 2.476 2.929 . 0 0 "[ . 1 . 2]" 1
525 1 23 VAL H 1 23 VAL MG2 . . 3.380 3.245 3.060 3.582 0.202 7 0 "[ . 1 . 2]" 1
526 1 23 VAL H 1 24 LEU H . . 4.880 3.747 3.565 3.865 . 0 0 "[ . 1 . 2]" 1
527 1 23 VAL H 1 24 LEU HA . . 5.500 4.318 3.983 4.529 . 0 0 "[ . 1 . 2]" 1
528 1 23 VAL H 1 24 LEU HB3 . . 5.500 5.679 5.613 5.772 0.272 7 0 "[ . 1 . 2]" 1
529 1 23 VAL H 1 39 CYS HA . . 5.360 4.423 4.092 4.632 . 0 0 "[ . 1 . 2]" 1
530 1 23 VAL H 1 39 CYS HB2 . . 5.500 5.474 4.960 5.588 0.088 17 0 "[ . 1 . 2]" 1
531 1 23 VAL H 1 39 CYS HB3 . . 5.500 5.148 4.739 5.554 0.054 5 0 "[ . 1 . 2]" 1
532 1 23 VAL H 1 40 LYS H . . 5.500 4.430 4.100 4.727 . 0 0 "[ . 1 . 2]" 1
533 1 23 VAL HA 1 23 VAL MG2 . . 3.330 2.363 2.057 2.454 . 0 0 "[ . 1 . 2]" 1
534 1 23 VAL HA 1 24 LEU H . . 2.990 1.907 1.756 2.107 . 0 0 "[ . 1 . 2]" 1
535 1 23 VAL HA 1 24 LEU HB3 . . 5.010 5.119 5.057 5.200 0.190 15 0 "[ . 1 . 2]" 1
536 1 23 VAL HA 1 38 ILE MG . . 5.500 4.499 4.189 4.686 . 0 0 "[ . 1 . 2]" 1
537 1 23 VAL HA 1 39 CYS H . . 5.090 4.864 4.705 5.117 0.027 20 0 "[ . 1 . 2]" 1
538 1 23 VAL HA 1 39 CYS HA . . 3.210 2.334 2.042 2.661 . 0 0 "[ . 1 . 2]" 1
539 1 23 VAL HA 1 39 CYS HB2 . . 3.870 3.512 3.108 3.665 . 0 0 "[ . 1 . 2]" 1
540 1 23 VAL HA 1 39 CYS HB3 . . 3.610 2.637 2.406 2.904 . 0 0 "[ . 1 . 2]" 1
541 1 23 VAL HA 1 40 LYS H . . 4.320 3.663 3.344 3.870 . 0 0 "[ . 1 . 2]" 1
542 1 23 VAL HB 1 24 LEU H . . 4.530 4.392 4.273 4.547 0.017 20 0 "[ . 1 . 2]" 1
543 1 23 VAL HB 1 39 CYS HA . . 5.500 5.339 5.101 5.509 0.009 1 0 "[ . 1 . 2]" 1
544 1 23 VAL MG1 1 24 LEU H . . 5.500 3.253 3.090 4.095 . 0 0 "[ . 1 . 2]" 1
545 1 23 VAL MG1 1 25 GLN HE21 . . 5.500 2.824 2.348 4.815 . 0 0 "[ . 1 . 2]" 1
546 1 23 VAL MG1 1 25 GLN HE22 . . 5.500 2.917 1.785 5.534 0.034 20 0 "[ . 1 . 2]" 1
547 1 23 VAL MG2 1 24 LEU H . . 4.350 3.908 3.335 4.153 . 0 0 "[ . 1 . 2]" 1
548 1 23 VAL MG2 1 25 GLN HE21 . . 5.500 4.867 3.571 5.500 . 0 0 "[ . 1 . 2]" 1
549 1 23 VAL MG2 1 25 GLN HE22 . . 5.500 4.966 4.169 5.616 0.116 10 0 "[ . 1 . 2]" 1
550 1 23 VAL MG2 1 39 CYS HA . . 4.500 3.990 3.466 4.297 . 0 0 "[ . 1 . 2]" 1
551 1 23 VAL MG2 1 39 CYS HB2 . . 4.480 3.732 2.524 4.078 . 0 0 "[ . 1 . 2]" 1
552 1 23 VAL MG2 1 39 CYS HB3 . . 4.300 2.961 2.341 3.186 . 0 0 "[ . 1 . 2]" 1
553 1 23 VAL MG2 1 40 LYS H . . 5.500 4.900 4.506 5.126 . 0 0 "[ . 1 . 2]" 1
554 1 24 LEU H 1 24 LEU HB2 . . 3.330 2.463 2.297 2.645 . 0 0 "[ . 1 . 2]" 1
555 1 24 LEU H 1 24 LEU MD1 . . 4.620 4.313 3.839 4.648 0.028 9 0 "[ . 1 . 2]" 1
556 1 24 LEU H 1 25 GLN H . . 4.560 4.184 3.817 4.528 . 0 0 "[ . 1 . 2]" 1
557 1 24 LEU H 1 26 THR H . . 5.500 5.417 5.168 5.604 0.104 9 0 "[ . 1 . 2]" 1
558 1 24 LEU H 1 38 ILE H . . 5.500 5.340 5.028 5.528 0.028 6 0 "[ . 1 . 2]" 1
559 1 24 LEU H 1 38 ILE HA . . 5.500 4.305 4.018 4.565 . 0 0 "[ . 1 . 2]" 1
560 1 24 LEU H 1 39 CYS H . . 5.500 4.013 3.809 4.353 . 0 0 "[ . 1 . 2]" 1
561 1 24 LEU H 1 39 CYS HA . . 3.200 1.865 1.681 2.267 . 0 0 "[ . 1 . 2]" 1
562 1 24 LEU H 1 39 CYS HB2 . . 4.320 4.242 4.169 4.404 0.084 19 0 "[ . 1 . 2]" 1
563 1 24 LEU H 1 39 CYS HB3 . . 4.130 3.461 3.302 3.743 . 0 0 "[ . 1 . 2]" 1
564 1 24 LEU H 1 40 LYS H . . 4.350 3.398 3.169 3.904 . 0 0 "[ . 1 . 2]" 1
565 1 24 LEU HA 1 24 LEU HB3 . . 2.930 2.681 2.394 2.918 . 0 0 "[ . 1 . 2]" 1
566 1 24 LEU HA 1 24 LEU MD1 . . 3.370 2.588 2.069 3.530 0.160 20 0 "[ . 1 . 2]" 1
567 1 24 LEU HA 1 25 GLN H . . 2.820 2.041 1.913 2.187 . 0 0 "[ . 1 . 2]" 1
568 1 24 LEU HA 1 25 GLN HA . . 4.340 4.383 4.286 4.559 0.219 4 0 "[ . 1 . 2]" 1
569 1 24 LEU HA 1 25 GLN HB2 . . 5.500 4.582 4.176 5.341 . 0 0 "[ . 1 . 2]" 1
570 1 24 LEU HA 1 25 GLN HG3 . . 5.500 5.347 4.965 5.624 0.124 19 0 "[ . 1 . 2]" 1
571 1 24 LEU HA 1 39 CYS HA . . 5.070 4.671 4.510 5.011 . 0 0 "[ . 1 . 2]" 1
572 1 24 LEU HB2 1 24 LEU MD1 . . 3.100 2.866 2.183 3.187 0.087 14 0 "[ . 1 . 2]" 1
573 1 24 LEU HB2 1 25 GLN H . . 4.240 4.319 4.190 4.531 0.291 9 0 "[ . 1 . 2]" 1
574 1 24 LEU HB2 1 25 GLN HA . . 5.210 5.256 5.030 5.474 0.264 4 0 "[ . 1 . 2]" 1
575 1 24 LEU HB2 1 26 THR H . . 4.780 4.810 4.659 4.922 0.142 9 0 "[ . 1 . 2]" 1
576 1 24 LEU HB2 1 26 THR MG . . 3.600 3.654 3.620 3.700 0.100 8 0 "[ . 1 . 2]" 1
577 1 24 LEU HB2 1 39 CYS HA . . 3.890 2.915 2.657 3.249 . 0 0 "[ . 1 . 2]" 1
578 1 24 LEU HB2 1 40 LYS H . . 5.080 3.000 2.521 3.398 . 0 0 "[ . 1 . 2]" 1
579 1 24 LEU HB2 1 40 LYS HB3 . . 5.500 3.279 2.545 4.552 . 0 0 "[ . 1 . 2]" 1
580 1 24 LEU HB2 1 40 LYS HG2 . . 5.500 4.926 2.561 5.581 0.081 1 0 "[ . 1 . 2]" 1
581 1 24 LEU HB2 1 45 TYR QE . . 5.500 4.430 3.822 4.917 . 0 0 "[ . 1 . 2]" 1
582 1 24 LEU MD1 1 25 GLN H . . 4.190 3.469 2.031 4.346 0.156 9 0 "[ . 1 . 2]" 1
583 1 24 LEU MD1 1 26 THR H . . 5.500 4.417 2.829 5.468 . 0 0 "[ . 1 . 2]" 1
584 1 24 LEU MD1 1 26 THR HB . . 4.870 3.475 2.237 4.929 0.059 19 0 "[ . 1 . 2]" 1
585 1 24 LEU MD1 1 39 CYS HA . . 5.500 5.103 4.363 5.515 0.015 5 0 "[ . 1 . 2]" 1
586 1 24 LEU MD1 1 45 TYR QD . . 5.190 4.617 3.610 5.252 0.062 13 0 "[ . 1 . 2]" 1
587 1 24 LEU MD1 1 45 TYR QE . . 3.990 3.448 2.475 4.081 0.091 19 0 "[ . 1 . 2]" 1
588 1 24 LEU HG 1 25 GLN H . . 5.500 4.774 2.722 5.640 0.140 9 0 "[ . 1 . 2]" 1
589 1 25 GLN H 1 25 GLN HB2 . . 3.610 2.672 2.185 3.534 . 0 0 "[ . 1 . 2]" 1
590 1 25 GLN H 1 25 GLN HE21 . . 5.500 3.703 2.099 4.217 . 0 0 "[ . 1 . 2]" 1
591 1 25 GLN H 1 25 GLN HE22 . . 5.500 4.831 3.633 5.557 0.057 3 0 "[ . 1 . 2]" 1
592 1 25 GLN H 1 25 GLN HG2 . . 4.550 3.675 2.184 4.640 0.090 16 0 "[ . 1 . 2]" 1
593 1 25 GLN H 1 25 GLN HG3 . . 4.600 3.951 3.594 4.361 . 0 0 "[ . 1 . 2]" 1
594 1 25 GLN H 1 26 THR H . . 4.920 3.735 3.510 4.056 . 0 0 "[ . 1 . 2]" 1
595 1 25 GLN H 1 26 THR HB . . 5.230 4.603 4.238 4.974 . 0 0 "[ . 1 . 2]" 1
596 1 25 GLN HA 1 25 GLN HE21 . . 5.500 3.377 2.332 3.761 . 0 0 "[ . 1 . 2]" 1
597 1 25 GLN HA 1 25 GLN HE22 . . 5.500 4.387 3.536 5.186 . 0 0 "[ . 1 . 2]" 1
598 1 25 GLN HA 1 25 GLN HG2 . . 3.830 3.198 3.069 3.726 . 0 0 "[ . 1 . 2]" 1
599 1 25 GLN HA 1 25 GLN HG3 . . 4.140 2.954 1.920 4.202 0.062 5 0 "[ . 1 . 2]" 1
600 1 25 GLN HA 1 26 THR H . . 3.200 2.120 1.925 2.332 . 0 0 "[ . 1 . 2]" 1
601 1 25 GLN HB2 1 26 THR H . . 4.650 4.474 3.982 4.589 . 0 0 "[ . 1 . 2]" 1
602 1 25 GLN HB3 1 26 THR HA . . 4.580 4.565 4.258 4.857 0.277 5 0 "[ . 1 . 2]" 1
603 1 25 GLN HE21 1 26 THR H . . 5.500 5.142 4.185 5.577 0.077 9 0 "[ . 1 . 2]" 1
604 1 25 GLN HG2 1 26 THR H . . 5.020 5.104 5.026 5.223 0.203 10 0 "[ . 1 . 2]" 1
605 1 26 THR H 1 26 THR HB . . 3.830 3.301 3.152 3.421 . 0 0 "[ . 1 . 2]" 1
606 1 26 THR H 1 26 THR MG . . 3.320 2.463 2.282 2.638 . 0 0 "[ . 1 . 2]" 1
607 1 26 THR H 1 37 THR H . . 3.950 3.521 3.242 3.908 . 0 0 "[ . 1 . 2]" 1
608 1 26 THR H 1 37 THR HA . . 5.280 5.025 4.806 5.301 0.021 6 0 "[ . 1 . 2]" 1
609 1 26 THR H 1 37 THR MG . . 4.430 3.360 1.864 4.455 0.025 11 0 "[ . 1 . 2]" 1
610 1 26 THR H 1 38 ILE H . . 5.500 5.294 4.984 5.538 0.038 10 0 "[ . 1 . 2]" 1
611 1 26 THR H 1 38 ILE HA . . 4.810 4.729 4.236 4.945 0.135 10 0 "[ . 1 . 2]" 1
612 1 26 THR H 1 45 TYR QD . . 5.500 4.916 4.719 5.310 . 0 0 "[ . 1 . 2]" 1
613 1 26 THR H 1 45 TYR QE . . 5.500 5.528 5.465 5.730 0.230 9 0 "[ . 1 . 2]" 1
614 1 26 THR HA 1 26 THR MG . . 3.710 3.286 3.253 3.316 . 0 0 "[ . 1 . 2]" 1
615 1 26 THR HA 1 27 THR H . . 3.350 2.818 2.716 3.029 . 0 0 "[ . 1 . 2]" 1
616 1 26 THR HB 1 27 THR H . . 3.750 3.707 3.580 3.791 0.041 4 0 "[ . 1 . 2]" 1
617 1 26 THR HB 1 45 TYR QE . . 5.310 4.712 4.506 5.127 . 0 0 "[ . 1 . 2]" 1
618 1 26 THR MG 1 27 THR H . . 3.540 2.962 2.633 3.283 . 0 0 "[ . 1 . 2]" 1
619 1 26 THR MG 1 28 CYS H . . 5.070 4.965 4.742 5.108 0.038 8 0 "[ . 1 . 2]" 1
620 1 26 THR MG 1 28 CYS HB3 . . 5.500 5.148 3.771 5.503 0.003 16 0 "[ . 1 . 2]" 1
621 1 26 THR MG 1 37 THR H . . 4.720 4.068 3.969 4.299 . 0 0 "[ . 1 . 2]" 1
622 1 26 THR MG 1 37 THR MG . . 3.410 2.190 1.834 3.052 . 0 0 "[ . 1 . 2]" 1
623 1 26 THR MG 1 45 TYR HB3 . . 5.500 4.272 4.005 4.746 . 0 0 "[ . 1 . 2]" 1
624 1 26 THR MG 1 45 TYR QD . . 3.740 2.690 2.423 3.098 . 0 0 "[ . 1 . 2]" 1
625 1 26 THR MG 1 45 TYR QE . . 3.380 2.282 2.084 2.596 . 0 0 "[ . 1 . 2]" 1
626 1 27 THR H 1 27 THR MG . . 4.420 3.328 3.157 3.717 . 0 0 "[ . 1 . 2]" 1
627 1 27 THR H 1 28 CYS H . . 4.450 4.181 4.085 4.402 . 0 0 "[ . 1 . 2]" 1
628 1 27 THR H 1 28 CYS HB3 . . 5.500 5.579 4.945 5.703 0.203 11 0 "[ . 1 . 2]" 1
629 1 27 THR H 1 34 VAL MG1 . . 5.500 5.145 4.655 5.534 0.034 18 0 "[ . 1 . 2]" 1
630 1 27 THR H 1 37 THR H . . 4.790 4.401 4.233 4.640 . 0 0 "[ . 1 . 2]" 1
631 1 27 THR H 1 37 THR MG . . 4.920 3.372 3.090 4.085 . 0 0 "[ . 1 . 2]" 1
632 1 27 THR HA 1 27 THR MG . . 3.400 2.398 2.189 2.555 . 0 0 "[ . 1 . 2]" 1
633 1 27 THR HA 1 28 CYS H . . 2.910 2.216 2.069 2.357 . 0 0 "[ . 1 . 2]" 1
634 1 27 THR HA 1 28 CYS HA . . 4.420 4.455 4.317 4.660 0.240 10 0 "[ . 1 . 2]" 1
635 1 27 THR HA 1 28 CYS HB3 . . 5.130 4.138 3.868 4.469 . 0 0 "[ . 1 . 2]" 1
636 1 27 THR HA 1 35 TYR HB2 . . 5.500 4.984 4.650 5.249 . 0 0 "[ . 1 . 2]" 1
637 1 27 THR HA 1 36 LYS H . . 5.500 4.752 4.645 4.923 . 0 0 "[ . 1 . 2]" 1
638 1 27 THR HA 1 36 LYS HA . . 3.310 2.135 2.027 2.277 . 0 0 "[ . 1 . 2]" 1
639 1 27 THR HA 1 36 LYS HB2 . . 4.940 5.039 4.932 5.098 0.158 19 0 "[ . 1 . 2]" 1
640 1 27 THR HA 1 37 THR H . . 3.720 2.501 2.279 2.748 . 0 0 "[ . 1 . 2]" 1
641 1 27 THR HB 1 28 CYS H . . 3.360 2.940 2.433 3.156 . 0 0 "[ . 1 . 2]" 1
642 1 27 THR HB 1 28 CYS HB3 . . 5.500 5.269 4.861 5.549 0.049 2 0 "[ . 1 . 2]" 1
643 1 27 THR HB 1 34 VAL HB . . 5.260 4.921 4.508 5.260 0.000 18 0 "[ . 1 . 2]" 1
644 1 27 THR HB 1 34 VAL MG1 . . 3.470 2.165 1.935 2.493 . 0 0 "[ . 1 . 2]" 1
645 1 27 THR HB 1 35 TYR H . . 4.760 4.096 3.714 4.547 . 0 0 "[ . 1 . 2]" 1
646 1 27 THR HB 1 36 LYS HA . . 5.030 3.346 2.887 4.031 . 0 0 "[ . 1 . 2]" 1
647 1 27 THR HB 1 37 THR H . . 5.400 4.729 4.356 5.298 . 0 0 "[ . 1 . 2]" 1
648 1 27 THR MG 1 28 CYS H . . 4.150 3.847 3.188 4.139 . 0 0 "[ . 1 . 2]" 1
649 1 27 THR MG 1 34 VAL HB . . 5.500 5.391 4.776 5.538 0.038 11 0 "[ . 1 . 2]" 1
650 1 27 THR MG 1 34 VAL MG1 . . 3.870 3.008 2.407 3.404 . 0 0 "[ . 1 . 2]" 1
651 1 27 THR MG 1 35 TYR H . . 5.500 4.950 3.899 5.192 . 0 0 "[ . 1 . 2]" 1
652 1 27 THR MG 1 36 LYS H . . 5.500 4.207 3.561 4.353 . 0 0 "[ . 1 . 2]" 1
653 1 27 THR MG 1 36 LYS HA . . 3.710 2.071 2.015 2.186 . 0 0 "[ . 1 . 2]" 1
654 1 27 THR MG 1 36 LYS HB2 . . 3.690 3.748 3.698 3.780 0.090 10 0 "[ . 1 . 2]" 1
655 1 27 THR MG 1 36 LYS HE3 . . 5.340 3.386 2.366 5.136 . 0 0 "[ . 1 . 2]" 1
656 1 27 THR MG 1 36 LYS HG2 . . 3.010 2.350 2.084 2.854 . 0 0 "[ . 1 . 2]" 1
657 1 27 THR MG 1 37 THR H . . 4.550 3.234 3.011 3.431 . 0 0 "[ . 1 . 2]" 1
658 1 28 CYS H 1 28 CYS HB3 . . 3.980 2.374 2.054 2.968 . 0 0 "[ . 1 . 2]" 1
659 1 28 CYS H 1 29 THR H . . 4.410 4.426 4.163 4.509 0.099 11 0 "[ . 1 . 2]" 1
660 1 28 CYS H 1 34 VAL HA . . 4.690 4.476 4.056 4.755 0.065 18 0 "[ . 1 . 2]" 1
661 1 28 CYS H 1 34 VAL MG1 . . 4.530 3.213 2.840 3.734 . 0 0 "[ . 1 . 2]" 1
662 1 28 CYS H 1 35 TYR H . . 4.190 2.917 2.483 3.166 . 0 0 "[ . 1 . 2]" 1
663 1 28 CYS H 1 35 TYR HB2 . . 4.660 3.454 3.192 3.878 . 0 0 "[ . 1 . 2]" 1
664 1 28 CYS H 1 35 TYR HB3 . . 5.500 4.730 4.481 5.106 . 0 0 "[ . 1 . 2]" 1
665 1 28 CYS H 1 35 TYR QD . . 5.240 4.538 4.150 4.838 . 0 0 "[ . 1 . 2]" 1
666 1 28 CYS H 1 36 LYS H . . 5.500 4.874 4.768 4.983 . 0 0 "[ . 1 . 2]" 1
667 1 28 CYS H 1 36 LYS HA . . 4.750 3.441 3.285 3.591 . 0 0 "[ . 1 . 2]" 1
668 1 28 CYS H 1 37 THR H . . 5.100 4.112 3.749 4.306 . 0 0 "[ . 1 . 2]" 1
669 1 28 CYS H 1 37 THR HA . . 5.500 5.532 5.408 5.576 0.076 12 0 "[ . 1 . 2]" 1
670 1 28 CYS H 1 37 THR MG . . 4.540 2.993 2.565 3.997 . 0 0 "[ . 1 . 2]" 1
671 1 28 CYS H 1 56 ILE MD . . 5.500 4.582 3.737 5.036 . 0 0 "[ . 1 . 2]" 1
672 1 28 CYS HA 1 29 THR H . . 2.860 2.238 1.827 2.390 . 0 0 "[ . 1 . 2]" 1
673 1 28 CYS HA 1 35 TYR H . . 5.500 4.689 4.294 4.860 . 0 0 "[ . 1 . 2]" 1
674 1 28 CYS HA 1 37 THR MG . . 4.740 4.147 3.864 4.799 0.059 1 0 "[ . 1 . 2]" 1
675 1 28 CYS HB2 1 29 THR H . . 3.960 3.709 2.595 4.037 0.077 10 0 "[ . 1 . 2]" 1
676 1 28 CYS HB2 1 29 THR HA . . 5.400 5.602 5.050 5.725 0.325 12 0 "[ . 1 . 2]" 1
677 1 28 CYS HB2 1 35 TYR H . . 5.150 5.077 4.592 5.234 0.084 11 0 "[ . 1 . 2]" 1
678 1 28 CYS HB2 1 35 TYR QD . . 5.300 5.320 4.835 5.401 0.101 10 0 "[ . 1 . 2]" 1
679 1 28 CYS HB2 1 37 THR MG . . 5.460 2.856 2.185 3.830 . 0 0 "[ . 1 . 2]" 1
680 1 28 CYS HB2 1 56 ILE HB . . 5.500 4.361 4.028 4.772 . 0 0 "[ . 1 . 2]" 1
681 1 28 CYS HB2 1 56 ILE MD . . 5.030 4.145 3.292 4.579 . 0 0 "[ . 1 . 2]" 1
682 1 28 CYS HB2 1 56 ILE HG12 . . 5.420 5.202 4.625 5.547 0.127 14 0 "[ . 1 . 2]" 1
683 1 28 CYS HB3 1 29 THR H . . 3.940 3.947 3.797 4.045 0.105 5 0 "[ . 1 . 2]" 1
684 1 28 CYS HB3 1 35 TYR H . . 5.470 3.807 3.430 5.397 . 0 0 "[ . 1 . 2]" 1
685 1 28 CYS HB3 1 35 TYR QD . . 5.500 3.957 3.635 5.511 0.011 13 0 "[ . 1 . 2]" 1
686 1 28 CYS HB3 1 37 THR H . . 5.500 5.229 4.587 5.591 0.091 11 0 "[ . 1 . 2]" 1
687 1 28 CYS HB3 1 37 THR MG . . 5.360 2.943 2.435 4.118 . 0 0 "[ . 1 . 2]" 1
688 1 28 CYS HB3 1 45 TYR HB2 . . 4.680 4.693 4.377 4.898 0.218 11 0 "[ . 1 . 2]" 1
689 1 28 CYS HB3 1 45 TYR QD . . 5.500 5.326 4.182 5.575 0.075 14 0 "[ . 1 . 2]" 1
690 1 28 CYS HB3 1 56 ILE MD . . 4.950 3.047 2.116 4.854 . 0 0 "[ . 1 . 2]" 1
691 1 29 THR H 1 29 THR HB . . 3.240 2.834 2.548 3.156 . 0 0 "[ . 1 . 2]" 1
692 1 29 THR H 1 29 THR MG . . 4.240 3.900 3.073 4.077 . 0 0 "[ . 1 . 2]" 1
693 1 29 THR H 1 30 VAL H . . 4.290 4.225 4.027 4.360 0.070 13 0 "[ . 1 . 2]" 1
694 1 29 THR H 1 30 VAL HA . . 5.500 5.294 4.869 5.620 0.120 10 0 "[ . 1 . 2]" 1
695 1 29 THR H 1 30 VAL HB . . 5.500 5.379 4.643 5.599 0.099 17 0 "[ . 1 . 2]" 1
696 1 29 THR H 1 34 VAL HA . . 4.910 4.595 3.990 4.785 . 0 0 "[ . 1 . 2]" 1
697 1 29 THR H 1 34 VAL MG1 . . 4.870 4.758 4.002 5.052 0.182 10 0 "[ . 1 . 2]" 1
698 1 29 THR H 1 35 TYR H . . 5.500 4.803 4.467 5.009 . 0 0 "[ . 1 . 2]" 1
699 1 29 THR H 1 35 TYR QD . . 5.500 4.989 4.724 5.145 . 0 0 "[ . 1 . 2]" 1
700 1 29 THR H 1 56 ILE MD . . 5.500 5.309 4.325 5.552 0.052 13 0 "[ . 1 . 2]" 1
701 1 29 THR H 1 56 ILE MG . . 5.500 4.653 4.350 5.307 . 0 0 "[ . 1 . 2]" 1
702 1 29 THR HA 1 29 THR MG . . 3.400 2.435 2.156 3.152 . 0 0 "[ . 1 . 2]" 1
703 1 29 THR HA 1 30 VAL H . . 2.910 2.002 1.908 2.105 . 0 0 "[ . 1 . 2]" 1
704 1 29 THR HA 1 30 VAL HA . . 4.600 4.390 4.291 4.469 . 0 0 "[ . 1 . 2]" 1
705 1 29 THR HA 1 30 VAL HB . . 4.940 4.579 4.344 4.858 . 0 0 "[ . 1 . 2]" 1
706 1 29 THR HA 1 33 LYS H . . 4.490 4.567 4.398 4.629 0.139 7 0 "[ . 1 . 2]" 1
707 1 29 THR HA 1 34 VAL H . . 5.080 4.703 4.316 4.910 . 0 0 "[ . 1 . 2]" 1
708 1 29 THR HA 1 34 VAL HA . . 3.300 2.142 1.880 2.346 . 0 0 "[ . 1 . 2]" 1
709 1 29 THR HA 1 34 VAL HB . . 5.280 4.655 3.591 4.815 . 0 0 "[ . 1 . 2]" 1
710 1 29 THR HA 1 34 VAL MG1 . . 4.220 3.748 3.052 4.311 0.091 10 0 "[ . 1 . 2]" 1
711 1 29 THR HA 1 35 TYR H . . 3.940 3.403 3.067 3.634 . 0 0 "[ . 1 . 2]" 1
712 1 29 THR HA 1 35 TYR QD . . 3.650 3.666 3.412 3.767 0.117 12 0 "[ . 1 . 2]" 1
713 1 29 THR HA 1 35 TYR QE . . 4.580 4.600 4.350 4.676 0.096 12 0 "[ . 1 . 2]" 1
714 1 29 THR HB 1 30 VAL H . . 4.470 4.127 3.955 4.309 . 0 0 "[ . 1 . 2]" 1
715 1 29 THR MG 1 30 VAL H . . 3.720 2.920 2.733 3.219 . 0 0 "[ . 1 . 2]" 1
716 1 29 THR MG 1 32 ARG H . . 4.140 3.930 3.480 4.207 0.067 15 0 "[ . 1 . 2]" 1
717 1 29 THR MG 1 32 ARG HA . . 3.720 3.651 3.157 3.753 0.033 19 0 "[ . 1 . 2]" 1
718 1 29 THR MG 1 33 LYS H . . 3.980 3.634 3.357 4.036 0.056 17 0 "[ . 1 . 2]" 1
719 1 29 THR MG 1 34 VAL HA . . 4.670 3.323 2.855 4.322 . 0 0 "[ . 1 . 2]" 1
720 1 30 VAL H 1 30 VAL HB . . 3.790 3.122 2.888 3.316 . 0 0 "[ . 1 . 2]" 1
721 1 30 VAL H 1 30 VAL MG1 . . 4.130 4.087 3.935 4.175 0.045 6 0 "[ . 1 . 2]" 1
722 1 30 VAL H 1 31 ASP H . . 4.840 4.417 4.249 4.515 . 0 0 "[ . 1 . 2]" 1
723 1 30 VAL H 1 31 ASP HB2 . . 5.500 4.878 4.506 5.121 . 0 0 "[ . 1 . 2]" 1
724 1 30 VAL H 1 32 ARG H . . 5.460 4.131 3.951 4.358 . 0 0 "[ . 1 . 2]" 1
725 1 30 VAL H 1 32 ARG HA . . 5.500 5.153 4.855 5.373 . 0 0 "[ . 1 . 2]" 1
726 1 30 VAL H 1 33 LYS H . . 3.680 3.141 2.881 3.239 . 0 0 "[ . 1 . 2]" 1
727 1 30 VAL H 1 33 LYS HB3 . . 4.640 4.133 3.907 4.305 . 0 0 "[ . 1 . 2]" 1
728 1 30 VAL H 1 34 VAL H . . 5.500 4.795 4.639 4.916 . 0 0 "[ . 1 . 2]" 1
729 1 30 VAL H 1 34 VAL HA . . 3.990 3.100 3.014 3.266 . 0 0 "[ . 1 . 2]" 1
730 1 30 VAL H 1 34 VAL HB . . 5.500 5.678 5.156 5.814 0.314 12 0 "[ . 1 . 2]" 1
731 1 30 VAL H 1 35 TYR H . . 4.810 4.271 4.006 4.496 . 0 0 "[ . 1 . 2]" 1
732 1 30 VAL H 1 35 TYR HB2 . . 5.500 5.473 5.287 5.590 0.090 15 0 "[ . 1 . 2]" 1
733 1 30 VAL H 1 35 TYR QD . . 3.490 3.268 3.107 3.407 . 0 0 "[ . 1 . 2]" 1
734 1 30 VAL H 1 35 TYR QE . . 3.510 3.091 2.829 3.231 . 0 0 "[ . 1 . 2]" 1
735 1 30 VAL H 1 56 ILE MD . . 5.500 4.888 4.181 5.187 . 0 0 "[ . 1 . 2]" 1
736 1 30 VAL H 1 56 ILE HG12 . . 5.500 5.085 4.806 5.535 0.035 16 0 "[ . 1 . 2]" 1
737 1 30 VAL H 1 56 ILE MG . . 5.500 5.516 5.336 5.577 0.077 15 0 "[ . 1 . 2]" 1
738 1 30 VAL HA 1 30 VAL MG1 . . 3.650 2.448 2.309 2.610 . 0 0 "[ . 1 . 2]" 1
739 1 30 VAL HA 1 30 VAL MG2 . . 3.200 2.435 2.304 2.600 . 0 0 "[ . 1 . 2]" 1
740 1 30 VAL HA 1 31 ASP H . . 3.130 2.361 2.230 2.524 . 0 0 "[ . 1 . 2]" 1
741 1 30 VAL HA 1 33 LYS H . . 5.500 4.200 3.920 4.451 . 0 0 "[ . 1 . 2]" 1
742 1 30 VAL HA 1 35 TYR QE . . 4.780 4.483 4.143 4.777 . 0 0 "[ . 1 . 2]" 1
743 1 30 VAL HB 1 31 ASP H . . 5.220 3.892 3.653 4.194 . 0 0 "[ . 1 . 2]" 1
744 1 30 VAL HB 1 31 ASP HB2 . . 5.020 4.067 3.660 4.601 . 0 0 "[ . 1 . 2]" 1
745 1 30 VAL HB 1 33 LYS H . . 5.500 5.138 4.994 5.307 . 0 0 "[ . 1 . 2]" 1
746 1 30 VAL HB 1 35 TYR QD . . 4.230 3.281 2.988 3.534 . 0 0 "[ . 1 . 2]" 1
747 1 30 VAL HB 1 35 TYR QE . . 2.920 2.552 2.112 2.945 0.025 18 0 "[ . 1 . 2]" 1
748 1 30 VAL HB 1 56 ILE HB . . 5.490 5.386 5.127 5.558 0.068 14 0 "[ . 1 . 2]" 1
749 1 30 VAL HB 1 56 ILE MD . . 5.320 3.371 2.937 3.631 . 0 0 "[ . 1 . 2]" 1
750 1 30 VAL HB 1 56 ILE MG . . 5.410 3.690 3.391 3.910 . 0 0 "[ . 1 . 2]" 1
751 1 30 VAL MG1 1 31 ASP H . . 5.450 2.137 1.925 2.603 . 0 0 "[ . 1 . 2]" 1
752 1 30 VAL MG1 1 31 ASP HB2 . . 3.890 2.846 2.311 3.881 . 0 0 "[ . 1 . 2]" 1
753 1 30 VAL MG1 1 35 TYR QE . . 4.470 3.465 3.229 3.703 . 0 0 "[ . 1 . 2]" 1
754 1 30 VAL MG1 1 56 ILE MD . . 4.090 4.111 4.005 4.147 0.057 2 0 "[ . 1 . 2]" 1
755 1 30 VAL MG1 1 59 ASP HA . . 3.580 3.522 3.082 3.660 0.080 15 0 "[ . 1 . 2]" 1
756 1 30 VAL MG2 1 31 ASP H . . 4.150 3.859 3.618 4.114 . 0 0 "[ . 1 . 2]" 1
757 1 30 VAL MG2 1 35 TYR QE . . 4.890 4.106 3.682 4.516 . 0 0 "[ . 1 . 2]" 1
758 1 30 VAL MG2 1 56 ILE HB . . 5.500 4.086 3.900 4.343 . 0 0 "[ . 1 . 2]" 1
759 1 30 VAL MG2 1 56 ILE MD . . 5.500 3.495 2.609 4.047 . 0 0 "[ . 1 . 2]" 1
760 1 30 VAL MG2 1 56 ILE MG . . 3.460 2.027 1.896 2.123 . 0 0 "[ . 1 . 2]" 1
761 1 30 VAL MG2 1 59 ASP HA . . 3.440 2.498 2.147 2.988 . 0 0 "[ . 1 . 2]" 1
762 1 30 VAL MG2 1 59 ASP QB . . 4.610 3.614 2.690 4.614 0.004 15 0 "[ . 1 . 2]" 1
763 1 31 ASP H 1 32 ARG H . . 4.050 2.675 2.507 2.956 . 0 0 "[ . 1 . 2]" 1
764 1 31 ASP H 1 32 ARG HA . . 5.290 4.943 4.763 5.110 . 0 0 "[ . 1 . 2]" 1
765 1 31 ASP H 1 32 ARG HG3 . . 5.500 4.761 4.406 5.209 . 0 0 "[ . 1 . 2]" 1
766 1 31 ASP H 1 33 LYS H . . 4.910 4.161 4.008 4.385 . 0 0 "[ . 1 . 2]" 1
767 1 31 ASP H 1 35 TYR QE . . 5.500 4.697 4.338 5.122 . 0 0 "[ . 1 . 2]" 1
768 1 31 ASP HA 1 32 ARG H . . 3.290 2.981 2.804 3.197 . 0 0 "[ . 1 . 2]" 1
769 1 31 ASP HA 1 32 ARG HA . . 5.010 4.959 4.755 5.151 0.141 3 0 "[ . 1 . 2]" 1
770 1 31 ASP HA 1 32 ARG HG2 . . 5.500 5.255 4.587 5.539 0.039 3 0 "[ . 1 . 2]" 1
771 1 31 ASP HA 1 32 ARG HG3 . . 4.830 3.669 3.045 3.997 . 0 0 "[ . 1 . 2]" 1
772 1 31 ASP HA 1 33 LYS H . . 4.490 4.412 4.263 4.622 0.132 5 0 "[ . 1 . 2]" 1
773 1 31 ASP HB2 1 32 ARG H . . 4.070 4.156 4.031 4.418 0.348 5 0 "[ . 1 . 2]" 1
774 1 31 ASP HB2 1 33 LYS H . . 4.270 4.010 3.441 4.364 0.094 5 0 "[ . 1 . 2]" 1
775 1 31 ASP HB2 1 33 LYS HG2 . . 5.480 5.501 5.120 5.837 0.357 5 0 "[ . 1 . 2]" 1
776 1 31 ASP HB2 1 35 TYR QE . . 5.070 3.213 2.666 3.702 . 0 0 "[ . 1 . 2]" 1
777 1 31 ASP HB3 1 32 ARG H . . 4.490 4.070 3.696 4.397 . 0 0 "[ . 1 . 2]" 1
778 1 31 ASP HB3 1 33 LYS H . . 4.880 3.763 3.015 4.715 . 0 0 "[ . 1 . 2]" 1
779 1 31 ASP HB3 1 33 LYS HB3 . . 5.110 3.414 2.307 4.695 . 0 0 "[ . 1 . 2]" 1
780 1 32 ARG H 1 32 ARG HG2 . . 4.360 3.812 3.427 4.065 . 0 0 "[ . 1 . 2]" 1
781 1 32 ARG H 1 32 ARG HG3 . . 3.700 3.077 2.746 3.467 . 0 0 "[ . 1 . 2]" 1
782 1 32 ARG H 1 33 LYS H . . 3.380 2.409 2.283 2.573 . 0 0 "[ . 1 . 2]" 1
783 1 32 ARG H 1 35 TYR QE . . 5.500 5.259 5.020 5.608 0.108 5 0 "[ . 1 . 2]" 1
784 1 32 ARG HA 1 32 ARG HG2 . . 3.320 2.755 2.549 2.960 . 0 0 "[ . 1 . 2]" 1
785 1 32 ARG HA 1 32 ARG HG3 . . 3.220 3.102 2.800 3.315 0.095 15 0 "[ . 1 . 2]" 1
786 1 32 ARG HA 1 33 LYS HA . . 5.500 4.604 4.460 4.732 . 0 0 "[ . 1 . 2]" 1
787 1 32 ARG QB 1 33 LYS H . . 4.580 3.823 3.695 3.952 . 0 0 "[ . 1 . 2]" 1
788 1 32 ARG HG2 1 33 LYS H . . 5.390 5.344 5.193 5.472 0.082 2 0 "[ . 1 . 2]" 1
789 1 32 ARG HG3 1 33 LYS H . . 5.500 4.806 4.644 4.987 . 0 0 "[ . 1 . 2]" 1
790 1 33 LYS H 1 33 LYS HB3 . . 3.100 2.723 2.259 3.191 0.091 3 0 "[ . 1 . 2]" 1
791 1 33 LYS H 1 33 LYS HG3 . . 4.550 4.490 4.135 4.597 0.047 3 0 "[ . 1 . 2]" 1
792 1 33 LYS H 1 34 VAL H . . 4.590 4.367 4.233 4.497 . 0 0 "[ . 1 . 2]" 1
793 1 33 LYS H 1 35 TYR QD . . 5.500 5.423 5.242 5.530 0.030 20 0 "[ . 1 . 2]" 1
794 1 33 LYS H 1 35 TYR QE . . 4.070 4.051 3.856 4.136 0.066 2 0 "[ . 1 . 2]" 1
795 1 33 LYS HA 1 33 LYS HE3 . . 5.500 5.433 4.879 5.696 0.196 2 0 "[ . 1 . 2]" 1
796 1 33 LYS HA 1 33 LYS HG3 . . 3.610 2.770 2.262 3.588 . 0 0 "[ . 1 . 2]" 1
797 1 33 LYS HA 1 34 VAL H . . 2.730 2.367 2.066 2.501 . 0 0 "[ . 1 . 2]" 1
798 1 33 LYS HA 1 35 TYR QE . . 5.500 5.352 5.162 5.507 0.007 19 0 "[ . 1 . 2]" 1
799 1 33 LYS HB2 1 33 LYS HE2 . . 3.500 3.613 3.512 3.886 0.386 17 0 "[ . 1 . 2]" 1
800 1 33 LYS HB3 1 34 VAL H . . 3.930 3.632 2.670 4.027 0.097 17 0 "[ . 1 . 2]" 1
801 1 33 LYS HB3 1 35 TYR QE . . 3.330 3.063 2.717 3.248 . 0 0 "[ . 1 . 2]" 1
802 1 33 LYS HE2 1 34 VAL H . . 5.500 4.659 2.885 5.519 0.019 17 0 "[ . 1 . 2]" 1
803 1 33 LYS HE2 1 35 TYR QE . . 3.620 2.787 2.162 3.721 0.101 2 0 "[ . 1 . 2]" 1
804 1 33 LYS HE3 1 34 VAL H . . 5.500 4.560 3.460 5.312 . 0 0 "[ . 1 . 2]" 1
805 1 33 LYS HE3 1 35 TYR QE . . 3.450 2.924 2.077 3.512 0.062 4 0 "[ . 1 . 2]" 1
806 1 33 LYS HE3 1 49 ASP HA . . 5.340 4.907 4.399 5.363 0.023 2 0 "[ . 1 . 2]" 1
807 1 33 LYS HE3 1 49 ASP HB2 . . 5.500 4.733 3.542 5.377 . 0 0 "[ . 1 . 2]" 1
808 1 33 LYS HE3 1 50 ASP H . . 5.500 5.573 5.265 5.661 0.161 12 0 "[ . 1 . 2]" 1
809 1 33 LYS HG3 1 34 VAL H . . 4.000 2.557 1.904 4.137 0.137 4 0 "[ . 1 . 2]" 1
810 1 33 LYS HG3 1 35 TYR QE . . 4.970 4.418 3.083 5.005 0.035 6 0 "[ . 1 . 2]" 1
811 1 34 VAL H 1 34 VAL HB . . 3.210 2.468 2.228 2.751 . 0 0 "[ . 1 . 2]" 1
812 1 34 VAL H 1 34 VAL MG1 . . 4.310 3.732 2.756 3.934 . 0 0 "[ . 1 . 2]" 1
813 1 34 VAL H 1 34 VAL MG2 . . 3.550 3.102 2.710 3.741 0.191 10 0 "[ . 1 . 2]" 1
814 1 34 VAL H 1 35 TYR H . . 4.820 4.328 4.221 4.508 . 0 0 "[ . 1 . 2]" 1
815 1 34 VAL H 1 35 TYR QD . . 5.500 4.969 4.667 5.351 . 0 0 "[ . 1 . 2]" 1
816 1 34 VAL H 1 35 TYR QE . . 5.500 5.083 4.625 5.433 . 0 0 "[ . 1 . 2]" 1
817 1 34 VAL HA 1 34 VAL MG1 . . 3.530 2.663 2.420 3.094 . 0 0 "[ . 1 . 2]" 1
818 1 34 VAL HA 1 34 VAL MG2 . . 3.310 2.360 2.051 2.632 . 0 0 "[ . 1 . 2]" 1
819 1 34 VAL HA 1 35 TYR H . . 3.060 2.131 2.022 2.254 . 0 0 "[ . 1 . 2]" 1
820 1 34 VAL HA 1 35 TYR HB2 . . 4.690 4.477 4.259 4.694 0.004 8 0 "[ . 1 . 2]" 1
821 1 34 VAL HA 1 35 TYR QD . . 4.220 3.400 3.215 3.770 . 0 0 "[ . 1 . 2]" 1
822 1 34 VAL HA 1 35 TYR QE . . 5.070 4.516 4.251 4.817 . 0 0 "[ . 1 . 2]" 1
823 1 34 VAL HB 1 35 TYR H . . 4.650 4.103 3.825 4.303 . 0 0 "[ . 1 . 2]" 1
824 1 34 VAL MG1 1 35 TYR H . . 3.910 2.636 2.435 2.985 . 0 0 "[ . 1 . 2]" 1
825 1 34 VAL MG1 1 35 TYR HA . . 4.400 3.709 3.321 4.104 . 0 0 "[ . 1 . 2]" 1
826 1 34 VAL MG1 1 35 TYR HB2 . . 4.630 4.584 4.476 4.713 0.083 10 0 "[ . 1 . 2]" 1
827 1 34 VAL MG1 1 35 TYR HB3 . . 5.500 5.209 4.982 5.398 . 0 0 "[ . 1 . 2]" 1
828 1 34 VAL MG1 1 35 TYR QD . . 4.850 4.607 4.429 4.801 . 0 0 "[ . 1 . 2]" 1
829 1 34 VAL MG2 1 35 TYR H . . 4.490 3.702 2.317 4.223 . 0 0 "[ . 1 . 2]" 1
830 1 35 TYR H 1 35 TYR HB2 . . 3.940 2.574 2.371 2.786 . 0 0 "[ . 1 . 2]" 1
831 1 35 TYR H 1 35 TYR HB3 . . 4.120 3.715 3.570 3.848 . 0 0 "[ . 1 . 2]" 1
832 1 35 TYR H 1 35 TYR QD . . 3.110 2.651 2.222 2.903 . 0 0 "[ . 1 . 2]" 1
833 1 35 TYR H 1 35 TYR QE . . 5.000 4.613 4.281 4.851 . 0 0 "[ . 1 . 2]" 1
834 1 35 TYR H 1 36 LYS H . . 4.790 4.468 4.369 4.628 . 0 0 "[ . 1 . 2]" 1
835 1 35 TYR H 1 47 CYS HB2 . . 5.500 5.467 5.215 5.570 0.070 12 0 "[ . 1 . 2]" 1
836 1 35 TYR H 1 56 ILE MD . . 5.500 4.228 3.607 4.589 . 0 0 "[ . 1 . 2]" 1
837 1 35 TYR HA 1 35 TYR QD . . 3.330 2.745 2.567 2.877 . 0 0 "[ . 1 . 2]" 1
838 1 35 TYR HA 1 36 LYS H . . 2.990 2.299 2.119 2.470 . 0 0 "[ . 1 . 2]" 1
839 1 35 TYR HA 1 47 CYS HB2 . . 5.500 4.573 3.754 4.904 . 0 0 "[ . 1 . 2]" 1
840 1 35 TYR HA 1 48 PHE H . . 5.320 4.500 4.162 4.913 . 0 0 "[ . 1 . 2]" 1
841 1 35 TYR HA 1 56 ILE MD . . 5.280 4.867 4.436 5.210 . 0 0 "[ . 1 . 2]" 1
842 1 35 TYR HB2 1 36 LYS H . . 4.390 3.885 3.624 4.198 . 0 0 "[ . 1 . 2]" 1
843 1 35 TYR HB2 1 47 CYS HB2 . . 4.340 3.006 2.664 3.285 . 0 0 "[ . 1 . 2]" 1
844 1 35 TYR HB2 1 47 CYS HB3 . . 4.680 2.899 2.587 3.555 . 0 0 "[ . 1 . 2]" 1
845 1 35 TYR HB2 1 48 PHE H . . 5.500 4.820 4.412 5.256 . 0 0 "[ . 1 . 2]" 1
846 1 35 TYR HB2 1 56 ILE MD . . 4.870 2.500 2.095 2.849 . 0 0 "[ . 1 . 2]" 1
847 1 35 TYR HB2 1 56 ILE HG12 . . 5.500 4.564 4.201 4.872 . 0 0 "[ . 1 . 2]" 1
848 1 35 TYR HB3 1 36 LYS H . . 4.050 2.911 2.549 3.280 . 0 0 "[ . 1 . 2]" 1
849 1 35 TYR HB3 1 47 CYS HA . . 5.500 4.418 4.229 4.726 . 0 0 "[ . 1 . 2]" 1
850 1 35 TYR HB3 1 47 CYS HB2 . . 4.250 2.269 1.978 2.492 . 0 0 "[ . 1 . 2]" 1
851 1 35 TYR HB3 1 48 PHE H . . 4.810 3.408 2.983 3.850 . 0 0 "[ . 1 . 2]" 1
852 1 35 TYR HB3 1 56 ILE MD . . 5.050 3.255 2.804 3.656 . 0 0 "[ . 1 . 2]" 1
853 1 35 TYR QD 1 36 LYS H . . 3.920 3.996 3.924 4.044 0.124 5 0 "[ . 1 . 2]" 1
854 1 35 TYR QD 1 36 LYS HG3 . . 5.500 5.492 5.284 5.600 0.100 13 0 "[ . 1 . 2]" 1
855 1 35 TYR QD 1 47 CYS HB2 . . 3.790 3.797 3.719 3.856 0.066 2 0 "[ . 1 . 2]" 1
856 1 35 TYR QD 1 48 PHE HA . . 4.980 4.501 4.068 4.952 . 0 0 "[ . 1 . 2]" 1
857 1 35 TYR QD 1 49 ASP HA . . 4.480 4.356 3.767 4.582 0.102 16 0 "[ . 1 . 2]" 1
858 1 35 TYR QD 1 49 ASP HB2 . . 4.650 4.588 2.831 4.759 0.109 15 0 "[ . 1 . 2]" 1
859 1 35 TYR QD 1 49 ASP HB3 . . 5.090 4.898 4.298 5.105 0.015 10 0 "[ . 1 . 2]" 1
860 1 35 TYR QD 1 56 ILE MD . . 3.480 2.579 2.199 2.898 . 0 0 "[ . 1 . 2]" 1
861 1 35 TYR QD 1 56 ILE HG12 . . 5.060 3.599 3.372 4.025 . 0 0 "[ . 1 . 2]" 1
862 1 35 TYR QE 1 49 ASP HB2 . . 4.990 4.746 3.671 4.934 . 0 0 "[ . 1 . 2]" 1
863 1 35 TYR QE 1 54 TYR QD . . 4.040 3.597 3.433 3.784 . 0 0 "[ . 1 . 2]" 1
864 1 35 TYR QE 1 54 TYR QE . . 3.470 3.212 3.039 3.444 . 0 0 "[ . 1 . 2]" 1
865 1 35 TYR QE 1 56 ILE MD . . 4.820 3.428 3.221 3.675 . 0 0 "[ . 1 . 2]" 1
866 1 36 LYS H 1 36 LYS HB2 . . 3.700 2.750 2.517 3.146 . 0 0 "[ . 1 . 2]" 1
867 1 36 LYS H 1 36 LYS HB3 . . 3.500 3.641 3.602 3.690 0.190 18 0 "[ . 1 . 2]" 1
868 1 36 LYS H 1 36 LYS HG2 . . 3.950 3.438 2.967 3.909 . 0 0 "[ . 1 . 2]" 1
869 1 36 LYS H 1 36 LYS HG3 . . 4.360 2.294 2.016 2.759 . 0 0 "[ . 1 . 2]" 1
870 1 36 LYS H 1 37 THR H . . 4.860 4.521 4.426 4.609 . 0 0 "[ . 1 . 2]" 1
871 1 36 LYS H 1 37 THR HA . . 5.500 5.094 4.831 5.269 . 0 0 "[ . 1 . 2]" 1
872 1 36 LYS H 1 47 CYS HA . . 5.500 4.597 4.376 4.822 . 0 0 "[ . 1 . 2]" 1
873 1 36 LYS H 1 47 CYS HB2 . . 4.970 4.250 3.325 4.672 . 0 0 "[ . 1 . 2]" 1
874 1 36 LYS H 1 48 PHE H . . 4.160 2.892 2.656 3.124 . 0 0 "[ . 1 . 2]" 1
875 1 36 LYS H 1 48 PHE HA . . 5.500 5.090 4.896 5.331 . 0 0 "[ . 1 . 2]" 1
876 1 36 LYS H 1 48 PHE QD . . 5.190 4.471 4.227 4.697 . 0 0 "[ . 1 . 2]" 1
877 1 36 LYS H 1 49 ASP HA . . 5.500 4.524 4.038 5.023 . 0 0 "[ . 1 . 2]" 1
878 1 36 LYS H 1 56 ILE MD . . 5.500 5.503 5.277 5.583 0.083 6 0 "[ . 1 . 2]" 1
879 1 36 LYS HA 1 36 LYS HE3 . . 5.110 4.381 3.815 5.160 0.050 7 0 "[ . 1 . 2]" 1
880 1 36 LYS HA 1 37 THR H . . 3.090 2.153 2.049 2.228 . 0 0 "[ . 1 . 2]" 1
881 1 36 LYS HA 1 37 THR HA . . 5.340 4.305 4.226 4.412 . 0 0 "[ . 1 . 2]" 1
882 1 36 LYS HA 1 47 CYS HB3 . . 3.970 4.018 3.985 4.082 0.112 15 0 "[ . 1 . 2]" 1
883 1 36 LYS HA 1 48 PHE QE . . 5.500 5.392 5.040 5.512 0.012 14 0 "[ . 1 . 2]" 1
884 1 36 LYS HB2 1 36 LYS HD2 . . 3.970 3.632 2.691 3.819 . 0 0 "[ . 1 . 2]" 1
885 1 36 LYS HB2 1 36 LYS HE3 . . 3.420 3.142 2.060 3.445 0.025 5 0 "[ . 1 . 2]" 1
886 1 36 LYS HB2 1 37 THR H . . 4.040 3.916 3.579 4.062 0.022 2 0 "[ . 1 . 2]" 1
887 1 36 LYS HB2 1 48 PHE H . . 5.340 3.671 3.382 3.972 . 0 0 "[ . 1 . 2]" 1
888 1 36 LYS HB2 1 48 PHE QD . . 4.200 3.609 3.229 3.929 . 0 0 "[ . 1 . 2]" 1
889 1 36 LYS HB2 1 48 PHE QE . . 4.450 3.119 2.743 3.496 . 0 0 "[ . 1 . 2]" 1
890 1 36 LYS HB2 1 48 PHE HZ . . 4.330 3.959 3.163 4.371 0.041 1 0 "[ . 1 . 2]" 1
891 1 36 LYS HB3 1 36 LYS HD3 . . 4.180 3.337 2.861 3.963 . 0 0 "[ . 1 . 2]" 1
892 1 36 LYS HB3 1 36 LYS HE3 . . 4.090 2.483 2.038 3.539 . 0 0 "[ . 1 . 2]" 1
893 1 36 LYS HB3 1 37 THR H . . 4.470 3.257 3.099 3.408 . 0 0 "[ . 1 . 2]" 1
894 1 36 LYS HB3 1 48 PHE H . . 5.490 5.042 4.807 5.308 . 0 0 "[ . 1 . 2]" 1
895 1 36 LYS HB3 1 48 PHE QE . . 4.680 3.983 3.638 4.412 . 0 0 "[ . 1 . 2]" 1
896 1 36 LYS HE3 1 48 PHE QE . . 4.780 4.546 3.163 4.837 0.057 10 0 "[ . 1 . 2]" 1
897 1 36 LYS HE3 1 48 PHE HZ . . 5.500 4.476 2.779 5.011 . 0 0 "[ . 1 . 2]" 1
898 1 36 LYS HG2 1 37 THR H . . 4.970 4.906 4.660 5.088 0.118 13 0 "[ . 1 . 2]" 1
899 1 37 THR H 1 37 THR MG . . 3.590 2.278 2.124 2.560 . 0 0 "[ . 1 . 2]" 1
900 1 37 THR H 1 38 ILE H . . 4.950 4.493 4.412 4.576 . 0 0 "[ . 1 . 2]" 1
901 1 37 THR H 1 38 ILE HA . . 5.290 5.201 5.065 5.380 0.090 10 0 "[ . 1 . 2]" 1
902 1 37 THR H 1 38 ILE HG12 . . 5.500 5.570 5.525 5.635 0.135 10 0 "[ . 1 . 2]" 1
903 1 37 THR H 1 45 TYR QD . . 5.500 5.452 5.053 5.533 0.033 13 0 "[ . 1 . 2]" 1
904 1 37 THR H 1 47 CYS HA . . 5.220 4.478 4.354 4.607 . 0 0 "[ . 1 . 2]" 1
905 1 37 THR H 1 48 PHE QD . . 5.500 5.360 5.113 5.509 0.009 16 0 "[ . 1 . 2]" 1
906 1 37 THR H 1 48 PHE QE . . 5.500 5.255 4.935 5.483 . 0 0 "[ . 1 . 2]" 1
907 1 37 THR HA 1 37 THR MG . . 3.620 2.703 2.495 3.222 . 0 0 "[ . 1 . 2]" 1
908 1 37 THR HA 1 38 ILE H . . 3.160 2.207 2.106 2.304 . 0 0 "[ . 1 . 2]" 1
909 1 37 THR HA 1 38 ILE HB . . 5.500 5.089 4.878 5.205 . 0 0 "[ . 1 . 2]" 1
910 1 37 THR HA 1 38 ILE MD . . 5.500 4.876 4.572 5.038 . 0 0 "[ . 1 . 2]" 1
911 1 37 THR HA 1 39 CYS H . . 3.930 3.912 3.655 4.019 0.089 10 0 "[ . 1 . 2]" 1
912 1 37 THR HA 1 45 TYR HB3 . . 4.740 4.180 3.766 4.489 . 0 0 "[ . 1 . 2]" 1
913 1 37 THR HA 1 46 LEU H . . 5.500 4.662 4.383 4.930 . 0 0 "[ . 1 . 2]" 1
914 1 37 THR HA 1 47 CYS H . . 5.500 4.366 4.209 4.498 . 0 0 "[ . 1 . 2]" 1
915 1 37 THR HA 1 47 CYS HA . . 3.210 2.117 1.989 2.306 . 0 0 "[ . 1 . 2]" 1
916 1 37 THR HA 1 47 CYS HB2 . . 4.340 4.204 3.725 4.357 0.017 8 0 "[ . 1 . 2]" 1
917 1 37 THR HA 1 48 PHE QD . . 4.620 4.267 3.948 4.460 . 0 0 "[ . 1 . 2]" 1
918 1 37 THR HB 1 38 ILE H . . 4.050 2.914 2.561 3.651 . 0 0 "[ . 1 . 2]" 1
919 1 37 THR HB 1 39 CYS H . . 4.150 3.514 3.144 4.280 0.130 6 0 "[ . 1 . 2]" 1
920 1 37 THR HB 1 45 TYR QD . . 3.330 2.787 2.315 3.300 . 0 0 "[ . 1 . 2]" 1
921 1 37 THR HB 1 46 LEU H . . 5.500 3.882 3.404 4.611 . 0 0 "[ . 1 . 2]" 1
922 1 37 THR MG 1 45 TYR HB2 . . 5.220 3.566 3.164 4.777 . 0 0 "[ . 1 . 2]" 1
923 1 37 THR MG 1 45 TYR HB3 . . 4.060 2.423 2.018 3.450 . 0 0 "[ . 1 . 2]" 1
924 1 37 THR MG 1 45 TYR QD . . 3.030 2.275 2.002 2.731 . 0 0 "[ . 1 . 2]" 1
925 1 38 ILE H 1 38 ILE HB . . 4.000 2.958 2.809 3.031 . 0 0 "[ . 1 . 2]" 1
926 1 38 ILE H 1 38 ILE MD . . 4.600 3.772 3.579 3.924 . 0 0 "[ . 1 . 2]" 1
927 1 38 ILE H 1 38 ILE HG12 . . 4.760 3.039 2.858 3.219 . 0 0 "[ . 1 . 2]" 1
928 1 38 ILE H 1 38 ILE HG13 . . 5.320 2.147 1.990 2.331 . 0 0 "[ . 1 . 2]" 1
929 1 38 ILE H 1 38 ILE MG . . 3.890 3.830 3.747 3.899 0.009 10 0 "[ . 1 . 2]" 1
930 1 38 ILE H 1 39 CYS H . . 3.190 1.967 1.818 2.145 . 0 0 "[ . 1 . 2]" 1
931 1 38 ILE H 1 45 TYR HB3 . . 5.500 4.911 4.517 5.216 . 0 0 "[ . 1 . 2]" 1
932 1 38 ILE H 1 45 TYR QD . . 5.500 5.277 4.797 5.517 0.017 18 0 "[ . 1 . 2]" 1
933 1 38 ILE H 1 46 LEU H . . 5.500 3.877 3.659 4.115 . 0 0 "[ . 1 . 2]" 1
934 1 38 ILE H 1 46 LEU HB2 . . 5.480 4.476 4.171 4.742 . 0 0 "[ . 1 . 2]" 1
935 1 38 ILE H 1 46 LEU HB3 . . 5.500 3.740 3.141 4.496 . 0 0 "[ . 1 . 2]" 1
936 1 38 ILE HA 1 47 CYS HA . . 5.500 5.476 5.316 5.562 0.062 1 0 "[ . 1 . 2]" 1
937 1 38 ILE HB 1 39 CYS H . . 3.750 2.595 2.348 2.866 . 0 0 "[ . 1 . 2]" 1
938 1 38 ILE HB 1 39 CYS HB3 . . 4.080 3.509 2.986 3.905 . 0 0 "[ . 1 . 2]" 1
939 1 38 ILE HB 1 46 LEU HB2 . . 4.390 4.511 4.437 4.592 0.202 6 0 "[ . 1 . 2]" 1
940 1 38 ILE MD 1 39 CYS H . . 5.500 4.250 4.013 4.481 . 0 0 "[ . 1 . 2]" 1
941 1 38 ILE MD 1 46 LEU HB2 . . 4.770 4.586 4.227 4.788 0.018 15 0 "[ . 1 . 2]" 1
942 1 38 ILE MD 1 47 CYS HA . . 4.240 4.036 3.682 4.220 . 0 0 "[ . 1 . 2]" 1
943 1 38 ILE MD 1 48 PHE HB2 . . 5.230 4.553 4.282 4.999 . 0 0 "[ . 1 . 2]" 1
944 1 38 ILE MD 1 48 PHE HB3 . . 3.980 3.132 2.885 3.607 . 0 0 "[ . 1 . 2]" 1
945 1 38 ILE MD 1 48 PHE QD . . 3.230 3.091 2.870 3.334 0.104 5 0 "[ . 1 . 2]" 1
946 1 38 ILE MD 1 48 PHE QE . . 4.310 4.141 3.916 4.324 0.014 5 0 "[ . 1 . 2]" 1
947 1 38 ILE HG12 1 39 CYS H . . 5.080 4.396 4.274 4.528 . 0 0 "[ . 1 . 2]" 1
948 1 38 ILE HG12 1 47 CYS HA . . 4.190 3.747 3.555 3.878 . 0 0 "[ . 1 . 2]" 1
949 1 38 ILE HG12 1 48 PHE QD . . 3.600 2.506 2.347 2.817 . 0 0 "[ . 1 . 2]" 1
950 1 38 ILE HG13 1 47 CYS HA . . 5.110 3.009 2.672 3.205 . 0 0 "[ . 1 . 2]" 1
951 1 38 ILE HG13 1 48 PHE QD . . 3.800 3.336 3.215 3.574 . 0 0 "[ . 1 . 2]" 1
952 1 38 ILE HG13 1 48 PHE QE . . 4.660 4.673 4.649 4.693 0.033 16 0 "[ . 1 . 2]" 1
953 1 38 ILE MG 1 39 CYS H . . 3.990 3.950 3.770 4.060 0.070 1 0 "[ . 1 . 2]" 1
954 1 38 ILE MG 1 47 CYS HA . . 5.500 5.450 5.235 5.538 0.038 5 0 "[ . 1 . 2]" 1
955 1 39 CYS H 1 40 LYS H . . 5.220 4.256 4.201 4.334 . 0 0 "[ . 1 . 2]" 1
956 1 39 CYS H 1 45 TYR HA . . 4.790 4.295 4.145 4.449 . 0 0 "[ . 1 . 2]" 1
957 1 39 CYS H 1 45 TYR HB3 . . 5.500 5.040 4.788 5.412 . 0 0 "[ . 1 . 2]" 1
958 1 39 CYS H 1 45 TYR QD . . 5.300 5.030 4.701 5.319 0.019 2 0 "[ . 1 . 2]" 1
959 1 39 CYS H 1 46 LEU H . . 3.930 3.174 2.983 3.375 . 0 0 "[ . 1 . 2]" 1
960 1 39 CYS H 1 46 LEU HB2 . . 4.110 3.698 3.368 4.109 . 0 0 "[ . 1 . 2]" 1
961 1 39 CYS H 1 46 LEU HB3 . . 4.680 3.557 2.925 4.276 . 0 0 "[ . 1 . 2]" 1
962 1 39 CYS H 1 46 LEU HG . . 5.500 5.545 5.482 5.603 0.103 9 0 "[ . 1 . 2]" 1
963 1 39 CYS H 1 47 CYS HA . . 5.500 4.907 4.778 5.069 . 0 0 "[ . 1 . 2]" 1
964 1 39 CYS HA 1 40 LYS H . . 3.170 2.140 2.052 2.241 . 0 0 "[ . 1 . 2]" 1
965 1 39 CYS HB2 1 40 LYS H . . 3.730 3.074 2.825 3.304 . 0 0 "[ . 1 . 2]" 1
966 1 39 CYS HB2 1 40 LYS HA . . 5.030 4.489 4.190 4.869 . 0 0 "[ . 1 . 2]" 1
967 1 39 CYS HB3 1 40 LYS H . . 4.040 3.572 3.351 3.792 . 0 0 "[ . 1 . 2]" 1
968 1 39 CYS HB3 1 46 LEU H . . 5.500 5.545 5.292 5.658 0.158 1 0 "[ . 1 . 2]" 1
969 1 40 LYS H 1 40 LYS HB2 . . 3.860 3.118 2.665 3.912 0.052 10 0 "[ . 1 . 2]" 1
970 1 40 LYS H 1 40 LYS HB3 . . 4.080 2.646 2.281 3.502 . 0 0 "[ . 1 . 2]" 1
971 1 40 LYS H 1 40 LYS HG2 . . 5.270 4.089 2.540 4.550 . 0 0 "[ . 1 . 2]" 1
972 1 40 LYS H 1 40 LYS HG3 . . 4.450 4.136 2.566 4.609 0.159 19 0 "[ . 1 . 2]" 1
973 1 40 LYS H 1 41 ARG H . . 4.720 4.406 4.290 4.481 . 0 0 "[ . 1 . 2]" 1
974 1 40 LYS H 1 41 ARG HB2 . . 5.500 5.226 5.002 5.511 0.011 5 0 "[ . 1 . 2]" 1
975 1 40 LYS H 1 45 TYR HA . . 5.500 4.684 4.410 4.883 . 0 0 "[ . 1 . 2]" 1
976 1 40 LYS HA 1 40 LYS HE3 . . 5.220 5.221 4.961 5.347 0.127 14 0 "[ . 1 . 2]" 1
977 1 40 LYS HA 1 40 LYS HG3 . . 3.980 3.254 2.759 3.837 . 0 0 "[ . 1 . 2]" 1
978 1 40 LYS HA 1 41 ARG H . . 3.130 2.202 2.064 2.310 . 0 0 "[ . 1 . 2]" 1
979 1 40 LYS HA 1 41 ARG HA . . 4.670 4.394 4.317 4.462 . 0 0 "[ . 1 . 2]" 1
980 1 40 LYS HA 1 42 GLY H . . 5.500 5.579 5.524 5.639 0.139 3 0 "[ . 1 . 2]" 1
981 1 40 LYS HA 1 44 THR H . . 4.990 5.008 4.808 5.085 0.095 12 0 "[ . 1 . 2]" 1
982 1 40 LYS HA 1 45 TYR H . . 5.500 4.484 4.231 4.700 . 0 0 "[ . 1 . 2]" 1
983 1 40 LYS HA 1 45 TYR HA . . 3.400 2.364 2.097 2.567 . 0 0 "[ . 1 . 2]" 1
984 1 40 LYS HA 1 45 TYR QE . . 5.220 5.035 4.779 5.271 0.051 3 0 "[ . 1 . 2]" 1
985 1 40 LYS HA 1 46 LEU H . . 4.320 3.349 3.027 3.645 . 0 0 "[ . 1 . 2]" 1
986 1 40 LYS HB2 1 41 ARG H . . 4.990 3.786 2.352 4.319 . 0 0 "[ . 1 . 2]" 1
987 1 40 LYS HB2 1 45 TYR QD . . 3.570 3.320 2.684 3.667 0.097 5 0 "[ . 1 . 2]" 1
988 1 40 LYS HB2 1 45 TYR QE . . 5.500 3.445 3.228 3.877 . 0 0 "[ . 1 . 2]" 1
989 1 40 LYS HB3 1 40 LYS HD3 . . 2.520 2.568 2.254 2.973 0.453 11 0 "[ . 1 . 2]" 1
990 1 40 LYS HB3 1 41 ARG H . . 4.060 4.032 3.645 4.194 0.134 3 0 "[ . 1 . 2]" 1
991 1 40 LYS HB3 1 41 ARG HA . . 5.500 4.758 4.352 5.551 0.051 11 0 "[ . 1 . 2]" 1
992 1 40 LYS HB3 1 45 TYR QD . . 4.990 4.339 2.685 4.991 0.001 9 0 "[ . 1 . 2]" 1
993 1 40 LYS HB3 1 45 TYR QE . . 4.510 4.163 3.059 4.580 0.070 13 0 "[ . 1 . 2]" 1
994 1 40 LYS HD3 1 45 TYR QD . . 5.500 4.847 3.982 5.642 0.142 9 0 "[ . 1 . 2]" 1
995 1 40 LYS HD3 1 45 TYR QE . . 4.980 3.767 2.720 4.998 0.018 12 0 "[ . 1 . 2]" 1
996 1 40 LYS HE3 1 44 THR H . . 5.500 5.207 4.204 5.611 0.111 14 0 "[ . 1 . 2]" 1
997 1 40 LYS HG2 1 41 ARG H . . 4.870 3.184 2.443 4.939 0.069 10 0 "[ . 1 . 2]" 1
998 1 40 LYS HG2 1 45 TYR HA . . 5.110 4.485 3.805 5.150 0.040 7 0 "[ . 1 . 2]" 1
999 1 40 LYS HG2 1 45 TYR QD . . 4.270 4.185 3.568 4.347 0.077 7 0 "[ . 1 . 2]" 1
1000 1 40 LYS HG2 1 45 TYR QE . . 4.000 3.818 3.182 4.043 0.043 17 0 "[ . 1 . 2]" 1
1001 1 40 LYS HG3 1 41 ARG H . . 4.350 3.814 3.359 4.419 0.069 9 0 "[ . 1 . 2]" 1
1002 1 40 LYS HG3 1 42 GLY H . . 5.500 5.177 3.856 5.647 0.147 9 0 "[ . 1 . 2]" 1
1003 1 41 ARG H 1 41 ARG HB3 . . 4.090 2.984 2.784 3.102 . 0 0 "[ . 1 . 2]" 1
1004 1 41 ARG H 1 41 ARG HD2 . . 5.500 5.383 4.886 5.591 0.091 9 0 "[ . 1 . 2]" 1
1005 1 41 ARG H 1 41 ARG HD3 . . 5.500 5.127 4.026 5.555 0.055 15 0 "[ . 1 . 2]" 1
1006 1 41 ARG H 1 42 GLY H . . 5.200 3.882 3.757 4.036 . 0 0 "[ . 1 . 2]" 1
1007 1 41 ARG H 1 42 GLY HA2 . . 5.500 5.411 5.297 5.613 0.113 19 0 "[ . 1 . 2]" 1
1008 1 41 ARG H 1 42 GLY HA3 . . 5.500 4.991 4.711 5.130 . 0 0 "[ . 1 . 2]" 1
1009 1 41 ARG H 1 43 ASN H . . 5.430 5.469 5.400 5.555 0.125 19 0 "[ . 1 . 2]" 1
1010 1 41 ARG H 1 44 THR H . . 4.090 3.299 3.115 3.489 . 0 0 "[ . 1 . 2]" 1
1011 1 41 ARG H 1 44 THR HA . . 5.500 4.652 4.477 4.785 . 0 0 "[ . 1 . 2]" 1
1012 1 41 ARG H 1 44 THR MG . . 4.510 2.948 2.417 4.367 . 0 0 "[ . 1 . 2]" 1
1013 1 41 ARG H 1 45 TYR H . . 5.500 4.555 4.381 4.732 . 0 0 "[ . 1 . 2]" 1
1014 1 41 ARG H 1 45 TYR HA . . 4.300 3.762 3.605 3.905 . 0 0 "[ . 1 . 2]" 1
1015 1 41 ARG H 1 45 TYR QD . . 5.430 4.722 4.502 4.863 . 0 0 "[ . 1 . 2]" 1
1016 1 41 ARG H 1 45 TYR QE . . 5.500 5.437 5.161 5.532 0.032 1 0 "[ . 1 . 2]" 1
1017 1 41 ARG H 1 46 LEU H . . 5.150 4.805 4.560 5.146 . 0 0 "[ . 1 . 2]" 1
1018 1 41 ARG HA 1 41 ARG HD2 . . 5.050 4.418 4.113 4.807 . 0 0 "[ . 1 . 2]" 1
1019 1 41 ARG HA 1 41 ARG HD3 . . 4.750 4.394 4.017 4.575 . 0 0 "[ . 1 . 2]" 1
1020 1 41 ARG HA 1 41 ARG HG2 . . 3.790 2.594 2.410 2.722 . 0 0 "[ . 1 . 2]" 1
1021 1 41 ARG HA 1 41 ARG HG3 . . 3.710 2.680 2.243 3.436 . 0 0 "[ . 1 . 2]" 1
1022 1 41 ARG HA 1 42 GLY H . . 3.480 2.006 1.955 2.177 . 0 0 "[ . 1 . 2]" 1
1023 1 41 ARG HA 1 42 GLY HA3 . . 4.750 4.376 4.275 4.447 . 0 0 "[ . 1 . 2]" 1
1024 1 41 ARG HB2 1 42 GLY H . . 5.180 4.277 4.126 4.341 . 0 0 "[ . 1 . 2]" 1
1025 1 41 ARG HB3 1 42 GLY H . . 5.310 4.186 4.059 4.365 . 0 0 "[ . 1 . 2]" 1
1026 1 41 ARG HB3 1 44 THR H . . 5.370 4.528 4.325 4.962 . 0 0 "[ . 1 . 2]" 1
1027 1 41 ARG HB3 1 44 THR HB . . 5.440 5.111 2.990 5.523 0.083 10 0 "[ . 1 . 2]" 1
1028 1 41 ARG HD2 1 42 GLY H . . 5.500 5.561 5.494 5.596 0.096 7 0 "[ . 1 . 2]" 1
1029 1 41 ARG HD2 1 44 THR MG . . 4.470 4.447 4.066 4.568 0.098 17 0 "[ . 1 . 2]" 1
1030 1 41 ARG HD3 1 42 GLY H . . 5.500 4.994 4.395 5.461 . 0 0 "[ . 1 . 2]" 1
1031 1 41 ARG HG2 1 42 GLY H . . 5.500 2.858 2.714 3.158 . 0 0 "[ . 1 . 2]" 1
1032 1 41 ARG HG3 1 42 GLY H . . 4.970 3.768 3.455 4.399 . 0 0 "[ . 1 . 2]" 1
1033 1 41 ARG HG3 1 42 GLY HA2 . . 5.500 5.574 5.521 5.649 0.149 17 0 "[ . 1 . 2]" 1
1034 1 42 GLY H 1 43 ASN H . . 4.960 4.528 4.477 4.614 . 0 0 "[ . 1 . 2]" 1
1035 1 42 GLY H 1 44 THR H . . 5.500 4.307 4.055 4.443 . 0 0 "[ . 1 . 2]" 1
1036 1 42 GLY HA2 1 43 ASN H . . 3.560 3.155 3.029 3.278 . 0 0 "[ . 1 . 2]" 1
1037 1 42 GLY HA2 1 43 ASN HA . . 4.790 4.529 4.435 4.706 . 0 0 "[ . 1 . 2]" 1
1038 1 42 GLY HA2 1 43 ASN HB3 . . 5.410 4.927 4.682 5.142 . 0 0 "[ . 1 . 2]" 1
1039 1 42 GLY HA2 1 43 ASN HD21 . . 5.500 5.376 4.836 5.585 0.085 19 0 "[ . 1 . 2]" 1
1040 1 42 GLY HA2 1 44 THR H . . 4.070 4.236 4.119 4.292 0.222 1 0 "[ . 1 . 2]" 1
1041 1 42 GLY HA3 1 43 ASN HA . . 5.170 4.445 4.414 4.488 . 0 0 "[ . 1 . 2]" 1
1042 1 42 GLY HA3 1 44 THR H . . 5.330 3.322 2.952 3.628 . 0 0 "[ . 1 . 2]" 1
1043 1 43 ASN H 1 43 ASN HB3 . . 4.130 2.687 2.432 3.014 . 0 0 "[ . 1 . 2]" 1
1044 1 43 ASN H 1 43 ASN HD21 . . 5.500 2.379 1.826 2.862 . 0 0 "[ . 1 . 2]" 1
1045 1 43 ASN H 1 43 ASN HD22 . . 5.500 3.606 3.296 4.026 . 0 0 "[ . 1 . 2]" 1
1046 1 43 ASN H 1 44 THR H . . 3.570 2.590 2.389 2.836 . 0 0 "[ . 1 . 2]" 1
1047 1 43 ASN H 1 44 THR HA . . 5.500 5.031 4.698 5.288 . 0 0 "[ . 1 . 2]" 1
1048 1 43 ASN H 1 44 THR HB . . 5.180 4.596 4.237 4.834 . 0 0 "[ . 1 . 2]" 1
1049 1 43 ASN H 1 44 THR MG . . 5.500 3.971 3.521 5.398 . 0 0 "[ . 1 . 2]" 1
1050 1 43 ASN H 1 57 THR MG . . 5.500 4.653 4.061 4.975 . 0 0 "[ . 1 . 2]" 1
1051 1 43 ASN HA 1 45 TYR QE . . 4.630 3.227 2.713 3.830 . 0 0 "[ . 1 . 2]" 1
1052 1 43 ASN HB2 1 43 ASN HD21 . . 3.510 3.431 3.072 3.593 0.083 11 0 "[ . 1 . 2]" 1
1053 1 43 ASN HB2 1 44 THR H . . 4.620 4.519 4.324 4.670 0.050 14 0 "[ . 1 . 2]" 1
1054 1 43 ASN HB2 1 45 TYR QE . . 5.430 4.775 4.068 5.540 0.110 9 0 "[ . 1 . 2]" 1
1055 1 43 ASN HB2 1 57 THR MG . . 4.760 4.482 4.178 4.783 0.023 5 0 "[ . 1 . 2]" 1
1056 1 43 ASN HB2 1 58 GLY H . . 5.500 3.652 3.039 4.300 . 0 0 "[ . 1 . 2]" 1
1057 1 43 ASN HB3 1 44 THR H . . 4.410 4.447 4.412 4.480 0.070 5 0 "[ . 1 . 2]" 1
1058 1 43 ASN HD21 1 44 THR H . . 5.500 3.190 2.455 4.804 . 0 0 "[ . 1 . 2]" 1
1059 1 43 ASN HD21 1 57 THR MG . . 5.500 2.964 1.989 4.096 . 0 0 "[ . 1 . 2]" 1
1060 1 43 ASN HD22 1 57 THR HB . . 5.500 5.043 4.442 5.591 0.091 6 0 "[ . 1 . 2]" 1
1061 1 43 ASN HD22 1 57 THR MG . . 5.440 2.267 1.838 2.751 . 0 0 "[ . 1 . 2]" 1
1062 1 43 ASN HD22 1 58 GLY H . . 5.500 4.628 3.507 5.083 . 0 0 "[ . 1 . 2]" 1
1063 1 43 ASN HD22 1 58 GLY HA3 . . 5.500 5.471 4.793 5.589 0.089 6 0 "[ . 1 . 2]" 1
1064 1 44 THR H 1 44 THR HB . . 3.090 3.088 2.718 3.210 0.120 5 0 "[ . 1 . 2]" 1
1065 1 44 THR H 1 44 THR MG . . 4.200 2.734 2.426 3.930 . 0 0 "[ . 1 . 2]" 1
1066 1 44 THR H 1 45 TYR H . . 4.630 4.595 4.506 4.654 0.024 19 0 "[ . 1 . 2]" 1
1067 1 44 THR H 1 45 TYR QD . . 5.080 4.043 3.698 4.292 . 0 0 "[ . 1 . 2]" 1
1068 1 44 THR H 1 45 TYR QE . . 5.500 4.546 4.301 4.871 . 0 0 "[ . 1 . 2]" 1
1069 1 44 THR H 1 57 THR MG . . 4.960 4.396 3.962 4.691 . 0 0 "[ . 1 . 2]" 1
1070 1 44 THR HA 1 44 THR MG . . 3.660 3.139 2.338 3.314 . 0 0 "[ . 1 . 2]" 1
1071 1 44 THR HA 1 45 TYR H . . 3.010 2.354 2.235 2.428 . 0 0 "[ . 1 . 2]" 1
1072 1 44 THR HA 1 45 TYR HA . . 5.500 4.441 4.370 4.550 . 0 0 "[ . 1 . 2]" 1
1073 1 44 THR HA 1 45 TYR HB2 . . 4.270 3.923 3.708 4.128 . 0 0 "[ . 1 . 2]" 1
1074 1 44 THR HA 1 45 TYR QD . . 3.620 2.751 2.470 2.992 . 0 0 "[ . 1 . 2]" 1
1075 1 44 THR HA 1 45 TYR QE . . 5.480 4.631 4.363 4.875 . 0 0 "[ . 1 . 2]" 1
1076 1 44 THR HA 1 57 THR H . . 5.500 4.809 4.461 4.998 . 0 0 "[ . 1 . 2]" 1
1077 1 44 THR HA 1 57 THR HA . . 3.600 2.384 2.155 2.616 . 0 0 "[ . 1 . 2]" 1
1078 1 44 THR HA 1 57 THR HB . . 5.500 5.267 4.932 5.533 0.033 3 0 "[ . 1 . 2]" 1
1079 1 44 THR HA 1 57 THR MG . . 4.200 3.566 3.244 3.885 . 0 0 "[ . 1 . 2]" 1
1080 1 44 THR HA 1 58 GLY H . . 4.930 3.200 2.434 3.683 . 0 0 "[ . 1 . 2]" 1
1081 1 44 THR HB 1 45 TYR H . . 4.810 3.738 3.557 3.904 . 0 0 "[ . 1 . 2]" 1
1082 1 44 THR MG 1 45 TYR H . . 4.010 3.388 2.042 3.779 . 0 0 "[ . 1 . 2]" 1
1083 1 44 THR MG 1 57 THR HA . . 4.690 4.003 2.672 4.403 . 0 0 "[ . 1 . 2]" 1
1084 1 44 THR MG 1 57 THR MG . . 3.560 3.219 2.439 3.528 . 0 0 "[ . 1 . 2]" 1
1085 1 44 THR MG 1 58 GLY H . . 5.500 5.239 4.386 5.543 0.043 14 0 "[ . 1 . 2]" 1
1086 1 45 TYR H 1 45 TYR HB2 . . 3.930 2.837 2.742 2.917 . 0 0 "[ . 1 . 2]" 1
1087 1 45 TYR H 1 45 TYR HB3 . . 3.770 3.792 3.708 4.021 0.251 11 0 "[ . 1 . 2]" 1
1088 1 45 TYR H 1 45 TYR QD . . 3.150 3.271 3.200 3.544 0.394 11 0 "[ . 1 . 2]" 1
1089 1 45 TYR H 1 45 TYR QE . . 5.500 5.494 5.416 5.567 0.067 11 0 "[ . 1 . 2]" 1
1090 1 45 TYR H 1 46 LEU HA . . 5.050 4.042 3.943 4.212 . 0 0 "[ . 1 . 2]" 1
1091 1 45 TYR H 1 46 LEU HB3 . . 5.500 5.829 5.753 5.899 0.399 11 0 "[ . 1 . 2]" 1
1092 1 45 TYR H 1 56 ILE MD . . 5.500 5.317 5.015 5.529 0.029 15 0 "[ . 1 . 2]" 1
1093 1 45 TYR H 1 56 ILE MG . . 5.500 4.703 4.348 5.013 . 0 0 "[ . 1 . 2]" 1
1094 1 45 TYR H 1 57 THR HA . . 4.510 3.989 3.569 4.313 . 0 0 "[ . 1 . 2]" 1
1095 1 45 TYR H 1 57 THR MG . . 5.080 5.080 4.962 5.117 0.037 7 0 "[ . 1 . 2]" 1
1096 1 45 TYR HA 1 45 TYR QD . . 3.390 3.099 3.022 3.180 . 0 0 "[ . 1 . 2]" 1
1097 1 45 TYR HA 1 45 TYR QE . . 4.790 4.715 4.617 4.792 0.002 19 0 "[ . 1 . 2]" 1
1098 1 45 TYR HA 1 46 LEU H . . 3.060 2.109 2.067 2.170 . 0 0 "[ . 1 . 2]" 1
1099 1 45 TYR HA 1 46 LEU HB2 . . 4.970 4.090 3.810 4.367 . 0 0 "[ . 1 . 2]" 1
1100 1 45 TYR HB2 1 56 ILE HB . . 3.780 2.962 2.626 3.256 . 0 0 "[ . 1 . 2]" 1
1101 1 45 TYR HB3 1 46 LEU H . . 4.180 3.570 3.304 3.742 . 0 0 "[ . 1 . 2]" 1
1102 1 45 TYR HB3 1 56 ILE H . . 4.690 4.549 4.344 4.712 0.022 5 0 "[ . 1 . 2]" 1
1103 1 45 TYR QD 1 56 ILE HB . . 5.120 4.681 4.478 4.922 . 0 0 "[ . 1 . 2]" 1
1104 1 45 TYR QD 1 56 ILE MG . . 5.500 4.180 3.877 4.511 . 0 0 "[ . 1 . 2]" 1
1105 1 45 TYR QD 1 57 THR HA . . 4.970 4.497 4.132 4.896 . 0 0 "[ . 1 . 2]" 1
1106 1 45 TYR QD 1 58 GLY H . . 5.500 4.059 3.373 4.941 . 0 0 "[ . 1 . 2]" 1
1107 1 46 LEU H 1 46 LEU HB2 . . 3.970 2.131 1.969 2.395 . 0 0 "[ . 1 . 2]" 1
1108 1 46 LEU H 1 46 LEU HB3 . . 3.880 2.871 2.427 3.309 . 0 0 "[ . 1 . 2]" 1
1109 1 46 LEU H 1 46 LEU MD1 . . 5.300 4.332 3.808 4.566 . 0 0 "[ . 1 . 2]" 1
1110 1 46 LEU H 1 46 LEU MD2 . . 5.500 3.531 2.921 4.338 . 0 0 "[ . 1 . 2]" 1
1111 1 46 LEU H 1 46 LEU HG . . 5.500 4.203 3.623 4.503 . 0 0 "[ . 1 . 2]" 1
1112 1 46 LEU H 1 47 CYS H . . 5.460 4.460 4.379 4.587 . 0 0 "[ . 1 . 2]" 1
1113 1 46 LEU H 1 74 LEU MD1 . . 5.500 4.771 4.297 5.575 0.075 2 0 "[ . 1 . 2]" 1
1114 1 46 LEU HA 1 46 LEU MD1 . . 4.080 2.501 2.184 2.994 . 0 0 "[ . 1 . 2]" 1
1115 1 46 LEU HA 1 46 LEU MD2 . . 3.640 2.468 1.950 3.694 0.054 8 0 "[ . 1 . 2]" 1
1116 1 46 LEU HA 1 46 LEU HG . . 4.100 3.407 2.323 3.730 . 0 0 "[ . 1 . 2]" 1
1117 1 46 LEU HA 1 47 CYS H . . 2.980 2.163 1.974 2.276 . 0 0 "[ . 1 . 2]" 1
1118 1 46 LEU HA 1 54 TYR H . . 4.880 4.571 4.319 4.888 0.008 8 0 "[ . 1 . 2]" 1
1119 1 46 LEU HB2 1 47 CYS H . . 4.790 4.554 4.373 4.669 . 0 0 "[ . 1 . 2]" 1
1120 1 46 LEU HB3 1 46 LEU MD1 . . 3.630 2.665 2.135 3.216 . 0 0 "[ . 1 . 2]" 1
1121 1 46 LEU HB3 1 47 CYS H . . 4.860 3.731 3.291 4.003 . 0 0 "[ . 1 . 2]" 1
1122 1 46 LEU QD 1 64 PHE QD . . 4.130 3.516 3.188 3.935 . 0 0 "[ . 1 . 2]" 1
1123 1 46 LEU QD 1 64 PHE QE . . 3.140 2.117 1.980 2.465 . 0 0 "[ . 1 . 2]" 1
1124 1 46 LEU QD 1 64 PHE HZ . . 3.790 2.910 2.536 3.168 . 0 0 "[ . 1 . 2]" 1
1125 1 46 LEU QD 1 73 TYR QD . . 3.880 2.220 1.914 2.839 . 0 0 "[ . 1 . 2]" 1
1126 1 46 LEU QD 1 73 TYR QE . . 3.480 2.857 2.057 4.095 0.615 19 1 "[ . 1 . +2]" 1
1127 1 46 LEU MD1 1 47 CYS H . . 5.180 3.197 2.680 3.756 . 0 0 "[ . 1 . 2]" 1
1128 1 46 LEU MD1 1 55 ALA HA . . 4.170 3.318 2.797 3.993 . 0 0 "[ . 1 . 2]" 1
1129 1 46 LEU MD1 1 56 ILE H . . 5.420 4.970 4.520 5.467 0.047 13 0 "[ . 1 . 2]" 1
1130 1 46 LEU MD1 1 64 PHE QE . . 3.990 2.177 2.007 2.775 . 0 0 "[ . 1 . 2]" 1
1131 1 46 LEU MD1 1 64 PHE HZ . . 5.400 3.221 2.610 3.697 . 0 0 "[ . 1 . 2]" 1
1132 1 46 LEU MD1 1 70 ALA HA . . 5.050 2.821 2.472 3.402 . 0 0 "[ . 1 . 2]" 1
1133 1 46 LEU MD1 1 73 TYR H . . 5.500 4.857 4.689 5.045 . 0 0 "[ . 1 . 2]" 1
1134 1 46 LEU MD1 1 73 TYR HA . . 5.460 5.577 5.338 5.679 0.219 7 0 "[ . 1 . 2]" 1
1135 1 46 LEU MD1 1 73 TYR HB3 . . 5.500 3.134 2.953 3.533 . 0 0 "[ . 1 . 2]" 1
1136 1 46 LEU MD1 1 74 LEU H . . 4.520 4.220 3.802 4.539 0.019 15 0 "[ . 1 . 2]" 1
1137 1 46 LEU MD1 1 74 LEU MD1 . . 4.180 2.904 1.996 3.714 . 0 0 "[ . 1 . 2]" 1
1138 1 46 LEU MD1 1 74 LEU MD2 . . 4.230 3.403 1.890 4.254 0.024 20 0 "[ . 1 . 2]" 1
1139 1 46 LEU MD2 1 47 CYS H . . 4.260 3.828 3.438 4.068 . 0 0 "[ . 1 . 2]" 1
1140 1 46 LEU MD2 1 54 TYR H . . 4.970 5.024 4.949 5.100 0.130 4 0 "[ . 1 . 2]" 1
1141 1 46 LEU MD2 1 64 PHE QE . . 3.850 3.146 2.709 3.893 0.043 6 0 "[ . 1 . 2]" 1
1142 1 46 LEU MD2 1 64 PHE HZ . . 5.500 3.677 3.054 5.461 . 0 0 "[ . 1 . 2]" 1
1143 1 46 LEU MD2 1 74 LEU MD1 . . 5.320 2.717 1.961 4.735 . 0 0 "[ . 1 . 2]" 1
1144 1 46 LEU MD2 1 74 LEU MD2 . . 4.120 3.679 2.052 4.267 0.147 13 0 "[ . 1 . 2]" 1
1145 1 46 LEU HG 1 64 PHE QE . . 5.430 4.468 3.165 5.225 . 0 0 "[ . 1 . 2]" 1
1146 1 46 LEU HG 1 74 LEU MD1 . . 5.500 2.697 1.852 5.142 . 0 0 "[ . 1 . 2]" 1
1147 1 46 LEU HG 1 74 LEU MD2 . . 5.500 3.494 1.989 5.540 0.040 6 0 "[ . 1 . 2]" 1
1148 1 47 CYS H 1 47 CYS HB3 . . 4.190 3.798 3.561 3.937 . 0 0 "[ . 1 . 2]" 1
1149 1 47 CYS H 1 48 PHE H . . 5.400 4.459 4.389 4.503 . 0 0 "[ . 1 . 2]" 1
1150 1 47 CYS H 1 53 LEU HA . . 5.500 4.826 4.687 5.055 . 0 0 "[ . 1 . 2]" 1
1151 1 47 CYS H 1 53 LEU MD2 . . 5.500 4.167 3.499 4.731 . 0 0 "[ . 1 . 2]" 1
1152 1 47 CYS H 1 54 TYR H . . 4.180 2.918 2.762 3.112 . 0 0 "[ . 1 . 2]" 1
1153 1 47 CYS H 1 54 TYR HB2 . . 5.180 4.091 3.942 4.299 . 0 0 "[ . 1 . 2]" 1
1154 1 47 CYS H 1 54 TYR HB3 . . 5.500 5.279 5.092 5.491 . 0 0 "[ . 1 . 2]" 1
1155 1 47 CYS H 1 54 TYR QD . . 5.500 4.835 4.598 4.985 . 0 0 "[ . 1 . 2]" 1
1156 1 47 CYS H 1 55 ALA H . . 5.500 4.903 4.779 5.043 . 0 0 "[ . 1 . 2]" 1
1157 1 47 CYS H 1 55 ALA HA . . 4.030 3.239 3.048 3.481 . 0 0 "[ . 1 . 2]" 1
1158 1 47 CYS H 1 55 ALA MB . . 5.500 4.539 4.269 4.791 . 0 0 "[ . 1 . 2]" 1
1159 1 47 CYS H 1 56 ILE H . . 5.430 4.001 3.765 4.311 . 0 0 "[ . 1 . 2]" 1
1160 1 47 CYS H 1 56 ILE MD . . 5.500 3.922 3.449 4.803 . 0 0 "[ . 1 . 2]" 1
1161 1 47 CYS H 1 64 PHE QE . . 5.500 4.460 4.276 4.741 . 0 0 "[ . 1 . 2]" 1
1162 1 47 CYS HA 1 48 PHE H . . 3.140 2.428 2.303 2.606 . 0 0 "[ . 1 . 2]" 1
1163 1 47 CYS HA 1 48 PHE HA . . 5.170 4.486 4.433 4.602 . 0 0 "[ . 1 . 2]" 1
1164 1 47 CYS HA 1 48 PHE HB2 . . 5.500 5.489 5.406 5.529 0.029 3 0 "[ . 1 . 2]" 1
1165 1 47 CYS HA 1 48 PHE QD . . 3.970 3.191 2.941 3.331 . 0 0 "[ . 1 . 2]" 1
1166 1 47 CYS HA 1 48 PHE QE . . 5.500 5.043 4.752 5.245 . 0 0 "[ . 1 . 2]" 1
1167 1 47 CYS HB2 1 48 PHE H . . 3.860 3.122 2.187 3.540 . 0 0 "[ . 1 . 2]" 1
1168 1 47 CYS HB2 1 48 PHE QD . . 5.500 5.309 4.558 5.511 0.011 7 0 "[ . 1 . 2]" 1
1169 1 47 CYS HB2 1 54 TYR H . . 5.500 3.817 3.372 4.173 . 0 0 "[ . 1 . 2]" 1
1170 1 47 CYS HB2 1 54 TYR HB3 . . 5.500 4.953 4.657 5.528 0.028 14 0 "[ . 1 . 2]" 1
1171 1 47 CYS HB2 1 54 TYR QD . . 5.180 3.805 3.619 4.135 . 0 0 "[ . 1 . 2]" 1
1172 1 47 CYS HB2 1 56 ILE MD . . 5.280 2.816 2.454 3.695 . 0 0 "[ . 1 . 2]" 1
1173 1 47 CYS HB3 1 48 PHE H . . 4.200 2.562 2.297 3.149 . 0 0 "[ . 1 . 2]" 1
1174 1 47 CYS HB3 1 54 TYR H . . 5.080 5.109 4.777 5.199 0.119 14 0 "[ . 1 . 2]" 1
1175 1 47 CYS HB3 1 56 ILE MD . . 4.960 3.597 3.464 3.750 . 0 0 "[ . 1 . 2]" 1
1176 1 48 PHE H 1 48 PHE QD . . 3.250 2.629 2.290 2.927 . 0 0 "[ . 1 . 2]" 1
1177 1 48 PHE H 1 48 PHE QE . . 4.510 4.428 4.213 4.529 0.019 15 0 "[ . 1 . 2]" 1
1178 1 48 PHE H 1 49 ASP H . . 5.500 4.448 4.359 4.518 . 0 0 "[ . 1 . 2]" 1
1179 1 48 PHE H 1 54 TYR H . . 5.500 4.774 4.525 4.931 . 0 0 "[ . 1 . 2]" 1
1180 1 48 PHE H 1 54 TYR QD . . 4.740 4.539 4.160 4.746 0.006 10 0 "[ . 1 . 2]" 1
1181 1 48 PHE H 1 56 ILE MD . . 5.500 5.337 5.029 5.528 0.028 14 0 "[ . 1 . 2]" 1
1182 1 48 PHE HA 1 48 PHE QD . . 3.760 3.737 3.691 3.765 0.005 19 0 "[ . 1 . 2]" 1
1183 1 48 PHE HA 1 49 ASP H . . 3.100 2.226 2.160 2.328 . 0 0 "[ . 1 . 2]" 1
1184 1 48 PHE HA 1 49 ASP HA . . 5.200 4.473 4.401 4.546 . 0 0 "[ . 1 . 2]" 1
1185 1 48 PHE HA 1 52 ASN H . . 5.500 4.797 4.614 4.952 . 0 0 "[ . 1 . 2]" 1
1186 1 48 PHE HA 1 53 LEU H . . 5.500 4.688 4.600 4.784 . 0 0 "[ . 1 . 2]" 1
1187 1 48 PHE HA 1 53 LEU HA . . 3.450 1.956 1.863 2.064 . 0 0 "[ . 1 . 2]" 1
1188 1 48 PHE HA 1 53 LEU HB2 . . 5.500 4.808 4.574 5.040 . 0 0 "[ . 1 . 2]" 1
1189 1 48 PHE HA 1 53 LEU MD1 . . 5.500 3.971 3.057 4.777 . 0 0 "[ . 1 . 2]" 1
1190 1 48 PHE HA 1 53 LEU MD2 . . 3.970 3.299 2.103 4.036 0.066 13 0 "[ . 1 . 2]" 1
1191 1 48 PHE HA 1 53 LEU HG . . 5.500 3.133 2.262 4.501 . 0 0 "[ . 1 . 2]" 1
1192 1 48 PHE HA 1 54 TYR H . . 4.490 3.390 3.128 3.544 . 0 0 "[ . 1 . 2]" 1
1193 1 48 PHE HA 1 54 TYR QD . . 3.410 2.853 2.420 3.194 . 0 0 "[ . 1 . 2]" 1
1194 1 48 PHE HB2 1 49 ASP H . . 3.500 2.564 2.352 2.811 . 0 0 "[ . 1 . 2]" 1
1195 1 48 PHE HB2 1 53 LEU HA . . 4.280 3.512 3.137 3.674 . 0 0 "[ . 1 . 2]" 1
1196 1 48 PHE HB2 1 53 LEU MD1 . . 5.120 3.430 2.235 4.662 . 0 0 "[ . 1 . 2]" 1
1197 1 48 PHE HB2 1 53 LEU MD2 . . 3.760 3.093 1.984 3.799 0.039 16 0 "[ . 1 . 2]" 1
1198 1 48 PHE HB2 1 54 TYR H . . 5.480 5.374 4.952 5.549 0.069 11 0 "[ . 1 . 2]" 1
1199 1 48 PHE HB3 1 49 ASP H . . 4.290 3.884 3.707 4.097 . 0 0 "[ . 1 . 2]" 1
1200 1 48 PHE HB3 1 53 LEU HA . . 4.340 3.577 3.069 3.727 . 0 0 "[ . 1 . 2]" 1
1201 1 48 PHE HB3 1 53 LEU MD2 . . 3.670 2.422 1.948 2.884 . 0 0 "[ . 1 . 2]" 1
1202 1 48 PHE HB3 1 54 TYR H . . 5.470 4.756 4.219 4.953 . 0 0 "[ . 1 . 2]" 1
1203 1 48 PHE QD 1 49 ASP H . . 3.810 3.387 3.265 3.533 . 0 0 "[ . 1 . 2]" 1
1204 1 48 PHE QD 1 49 ASP HA . . 3.940 3.629 2.785 3.990 0.050 10 0 "[ . 1 . 2]" 1
1205 1 48 PHE QD 1 50 ASP H . . 5.390 5.023 4.431 5.433 0.043 9 0 "[ . 1 . 2]" 1
1206 1 48 PHE QD 1 50 ASP HA . . 5.260 4.262 3.592 4.686 . 0 0 "[ . 1 . 2]" 1
1207 1 48 PHE QD 1 53 LEU HA . . 5.010 5.050 4.810 5.112 0.102 6 0 "[ . 1 . 2]" 1
1208 1 48 PHE QE 1 49 ASP H . . 5.500 5.559 5.527 5.607 0.107 6 0 "[ . 1 . 2]" 1
1209 1 49 ASP H 1 50 ASP H . . 4.550 4.179 4.096 4.252 . 0 0 "[ . 1 . 2]" 1
1210 1 49 ASP H 1 51 THR H . . 4.680 3.711 3.416 4.145 . 0 0 "[ . 1 . 2]" 1
1211 1 49 ASP H 1 52 ASN H . . 4.410 3.142 2.949 3.256 . 0 0 "[ . 1 . 2]" 1
1212 1 49 ASP H 1 52 ASN HA . . 5.500 4.747 4.585 4.883 . 0 0 "[ . 1 . 2]" 1
1213 1 49 ASP H 1 52 ASN HB2 . . 5.460 5.592 5.420 5.654 0.194 10 0 "[ . 1 . 2]" 1
1214 1 49 ASP H 1 53 LEU HA . . 4.480 3.258 3.080 3.484 . 0 0 "[ . 1 . 2]" 1
1215 1 49 ASP H 1 53 LEU MD1 . . 5.500 4.537 3.434 5.585 0.085 7 0 "[ . 1 . 2]" 1
1216 1 49 ASP H 1 54 TYR QE . . 3.420 3.008 2.701 3.405 . 0 0 "[ . 1 . 2]" 1
1217 1 49 ASP HA 1 51 THR H . . 4.770 4.343 3.869 4.832 0.062 5 0 "[ . 1 . 2]" 1
1218 1 49 ASP HA 1 52 ASN H . . 5.300 5.212 4.980 5.327 0.027 11 0 "[ . 1 . 2]" 1
1219 1 49 ASP HA 1 54 TYR QD . . 5.500 5.412 5.242 5.546 0.046 12 0 "[ . 1 . 2]" 1
1220 1 49 ASP HB2 1 50 ASP H . . 3.150 2.594 2.211 3.191 0.041 9 0 "[ . 1 . 2]" 1
1221 1 49 ASP HB2 1 50 ASP HA . . 4.430 4.627 4.474 4.949 0.519 9 1 "[ . +1 . 2]" 1
1222 1 49 ASP HB2 1 50 ASP HB2 . . 5.350 4.499 4.043 5.383 0.033 9 0 "[ . 1 . 2]" 1
1223 1 49 ASP HB2 1 51 THR H . . 4.600 2.546 1.865 4.608 0.008 9 0 "[ . 1 . 2]" 1
1224 1 49 ASP HB2 1 52 ASN H . . 5.070 3.498 2.656 5.094 0.024 9 0 "[ . 1 . 2]" 1
1225 1 49 ASP HB2 1 54 TYR QD . . 4.650 4.610 3.940 4.700 0.050 1 0 "[ . 1 . 2]" 1
1226 1 49 ASP HB2 1 54 TYR QE . . 4.160 2.637 2.476 2.808 . 0 0 "[ . 1 . 2]" 1
1227 1 49 ASP HB3 1 50 ASP H . . 3.930 1.699 1.588 2.326 . 0 0 "[ . 1 . 2]" 1
1228 1 49 ASP HB3 1 51 THR H . . 5.150 3.172 1.807 3.799 . 0 0 "[ . 1 . 2]" 1
1229 1 50 ASP H 1 50 ASP HB2 . . 3.220 2.389 2.101 2.774 . 0 0 "[ . 1 . 2]" 1
1230 1 50 ASP H 1 51 THR H . . 3.650 2.639 2.399 2.815 . 0 0 "[ . 1 . 2]" 1
1231 1 50 ASP H 1 51 THR MG . . 5.350 3.959 3.178 5.116 . 0 0 "[ . 1 . 2]" 1
1232 1 50 ASP H 1 52 ASN H . . 4.520 4.530 4.345 4.608 0.088 16 0 "[ . 1 . 2]" 1
1233 1 50 ASP H 1 54 TYR QE . . 5.500 5.079 4.518 5.508 0.008 6 0 "[ . 1 . 2]" 1
1234 1 50 ASP HA 1 51 THR MG . . 5.460 4.782 4.150 5.487 0.027 8 0 "[ . 1 . 2]" 1
1235 1 50 ASP HA 1 52 ASN H . . 5.500 4.531 4.116 4.695 . 0 0 "[ . 1 . 2]" 1
1236 1 50 ASP HB2 1 51 THR H . . 3.920 3.361 3.090 3.573 . 0 0 "[ . 1 . 2]" 1
1237 1 50 ASP HB2 1 51 THR HA . . 4.580 4.480 4.159 4.677 0.097 15 0 "[ . 1 . 2]" 1
1238 1 50 ASP HB2 1 51 THR MG . . 4.000 3.176 2.216 4.086 0.086 1 0 "[ . 1 . 2]" 1
1239 1 50 ASP HB2 1 52 ASN H . . 5.500 5.511 5.340 5.589 0.089 6 0 "[ . 1 . 2]" 1
1240 1 51 THR H 1 51 THR HB . . 4.110 3.418 2.937 3.689 . 0 0 "[ . 1 . 2]" 1
1241 1 51 THR H 1 51 THR MG . . 4.290 2.905 2.381 3.823 . 0 0 "[ . 1 . 2]" 1
1242 1 51 THR H 1 52 ASN H . . 3.060 2.256 1.975 2.572 . 0 0 "[ . 1 . 2]" 1
1243 1 51 THR H 1 52 ASN HA . . 4.980 4.814 4.568 4.988 0.008 10 0 "[ . 1 . 2]" 1
1244 1 51 THR H 1 52 ASN HD21 . . 5.500 5.398 5.018 5.582 0.082 2 0 "[ . 1 . 2]" 1
1245 1 51 THR H 1 52 ASN HD22 . . 5.500 5.239 4.824 5.501 0.001 4 0 "[ . 1 . 2]" 1
1246 1 51 THR H 1 54 TYR QE . . 5.480 4.380 4.112 4.581 . 0 0 "[ . 1 . 2]" 1
1247 1 51 THR HA 1 51 THR MG . . 3.290 2.346 2.148 2.476 . 0 0 "[ . 1 . 2]" 1
1248 1 51 THR HB 1 52 ASN H . . 4.440 3.759 3.049 4.322 . 0 0 "[ . 1 . 2]" 1
1249 1 51 THR HB 1 52 ASN HB3 . . 4.340 4.018 3.746 4.368 0.028 10 0 "[ . 1 . 2]" 1
1250 1 51 THR HB 1 52 ASN HD21 . . 5.500 4.904 4.231 5.520 0.020 5 0 "[ . 1 . 2]" 1
1251 1 51 THR HB 1 52 ASN HD22 . . 5.500 4.116 3.478 4.773 . 0 0 "[ . 1 . 2]" 1
1252 1 51 THR MG 1 52 ASN H . . 4.980 4.200 4.093 4.347 . 0 0 "[ . 1 . 2]" 1
1253 1 51 THR MG 1 52 ASN HD21 . . 5.500 5.554 5.500 5.608 0.108 15 0 "[ . 1 . 2]" 1
1254 1 51 THR MG 1 52 ASN HD22 . . 5.500 4.680 4.545 4.797 . 0 0 "[ . 1 . 2]" 1
1255 1 52 ASN H 1 52 ASN HB2 . . 3.930 4.010 3.950 4.045 0.115 17 0 "[ . 1 . 2]" 1
1256 1 52 ASN H 1 52 ASN HD21 . . 5.290 4.191 3.928 4.375 . 0 0 "[ . 1 . 2]" 1
1257 1 52 ASN H 1 52 ASN HD22 . . 5.500 4.700 4.355 4.908 . 0 0 "[ . 1 . 2]" 1
1258 1 52 ASN H 1 53 LEU H . . 5.120 4.202 4.084 4.273 . 0 0 "[ . 1 . 2]" 1
1259 1 52 ASN H 1 53 LEU HA . . 5.500 4.649 4.540 4.793 . 0 0 "[ . 1 . 2]" 1
1260 1 52 ASN H 1 53 LEU MD1 . . 5.500 4.459 3.522 5.648 0.148 10 0 "[ . 1 . 2]" 1
1261 1 52 ASN H 1 54 TYR QE . . 4.250 4.078 3.497 4.265 0.015 20 0 "[ . 1 . 2]" 1
1262 1 52 ASN H 1 67 VAL QG . . 4.800 4.232 3.980 4.776 . 0 0 "[ . 1 . 2]" 1
1263 1 52 ASN HA 1 52 ASN HD21 . . 4.330 3.998 3.894 4.196 . 0 0 "[ . 1 . 2]" 1
1264 1 52 ASN HA 1 52 ASN HD22 . . 5.130 5.094 5.016 5.150 0.020 19 0 "[ . 1 . 2]" 1
1265 1 52 ASN HA 1 53 LEU H . . 3.000 2.561 2.437 2.755 . 0 0 "[ . 1 . 2]" 1
1266 1 52 ASN HA 1 53 LEU HA . . 4.420 4.397 4.303 4.450 0.030 10 0 "[ . 1 . 2]" 1
1267 1 52 ASN HA 1 53 LEU HB2 . . 5.500 4.215 3.952 4.430 . 0 0 "[ . 1 . 2]" 1
1268 1 52 ASN HA 1 53 LEU MD1 . . 5.360 3.199 2.340 4.243 . 0 0 "[ . 1 . 2]" 1
1269 1 52 ASN HA 1 54 TYR QE . . 5.210 5.269 5.224 5.301 0.091 8 0 "[ . 1 . 2]" 1
1270 1 52 ASN HA 1 67 VAL QG . . 3.700 2.788 2.483 3.116 . 0 0 "[ . 1 . 2]" 1
1271 1 52 ASN HB2 1 53 LEU H . . 3.960 1.757 1.584 1.971 . 0 0 "[ . 1 . 2]" 1
1272 1 52 ASN HB2 1 54 TYR QE . . 4.830 4.718 4.589 4.843 0.013 9 0 "[ . 1 . 2]" 1
1273 1 52 ASN HB2 1 65 ALA HA . . 5.500 4.626 3.960 4.836 . 0 0 "[ . 1 . 2]" 1
1274 1 52 ASN HB3 1 53 LEU H . . 4.050 3.280 3.132 3.438 . 0 0 "[ . 1 . 2]" 1
1275 1 52 ASN HB3 1 64 PHE H . . 5.330 5.382 5.335 5.441 0.111 9 0 "[ . 1 . 2]" 1
1276 1 52 ASN HB3 1 65 ALA HA . . 5.500 4.420 3.638 4.679 . 0 0 "[ . 1 . 2]" 1
1277 1 52 ASN HD21 1 53 LEU H . . 4.050 2.757 2.321 3.517 . 0 0 "[ . 1 . 2]" 1
1278 1 52 ASN HD21 1 54 TYR QE . . 4.820 2.828 2.558 3.179 . 0 0 "[ . 1 . 2]" 1
1279 1 52 ASN HD21 1 63 LYS HA . . 4.070 3.900 3.414 4.130 0.060 20 0 "[ . 1 . 2]" 1
1280 1 52 ASN HD21 1 63 LYS HB3 . . 5.300 4.867 3.648 5.323 0.023 10 0 "[ . 1 . 2]" 1
1281 1 52 ASN HD21 1 63 LYS HE2 . . 5.500 5.225 4.063 5.577 0.077 19 0 "[ . 1 . 2]" 1
1282 1 52 ASN HD21 1 64 PHE H . . 5.500 3.310 3.167 3.483 . 0 0 "[ . 1 . 2]" 1
1283 1 52 ASN HD21 1 64 PHE HB3 . . 5.500 5.552 5.505 5.633 0.133 5 0 "[ . 1 . 2]" 1
1284 1 52 ASN HD22 1 53 LEU H . . 5.500 4.409 3.972 5.069 . 0 0 "[ . 1 . 2]" 1
1285 1 52 ASN HD22 1 63 LYS HA . . 4.810 4.435 3.828 4.799 . 0 0 "[ . 1 . 2]" 1
1286 1 52 ASN HD22 1 63 LYS HB3 . . 5.110 4.478 3.445 4.862 . 0 0 "[ . 1 . 2]" 1
1287 1 52 ASN HD22 1 63 LYS HE2 . . 5.500 4.434 3.008 5.296 . 0 0 "[ . 1 . 2]" 1
1288 1 53 LEU H 1 53 LEU HB2 . . 3.500 2.325 2.165 2.427 . 0 0 "[ . 1 . 2]" 1
1289 1 53 LEU H 1 53 LEU MD1 . . 4.880 3.075 2.569 3.855 . 0 0 "[ . 1 . 2]" 1
1290 1 53 LEU H 1 53 LEU MD2 . . 4.850 4.064 3.558 4.424 . 0 0 "[ . 1 . 2]" 1
1291 1 53 LEU H 1 53 LEU HG . . 4.280 3.505 2.646 4.181 . 0 0 "[ . 1 . 2]" 1
1292 1 53 LEU H 1 54 TYR H . . 5.220 4.473 4.402 4.534 . 0 0 "[ . 1 . 2]" 1
1293 1 53 LEU H 1 64 PHE QD . . 5.500 3.662 3.439 3.892 . 0 0 "[ . 1 . 2]" 1
1294 1 53 LEU H 1 66 THR HA . . 5.500 5.396 5.146 5.547 0.047 5 0 "[ . 1 . 2]" 1
1295 1 53 LEU H 1 67 VAL QG . . 4.420 3.941 3.194 4.185 . 0 0 "[ . 1 . 2]" 1
1296 1 53 LEU HA 1 53 LEU MD1 . . 4.640 3.249 2.599 3.783 . 0 0 "[ . 1 . 2]" 1
1297 1 53 LEU HA 1 53 LEU MD2 . . 3.630 2.983 2.006 3.597 . 0 0 "[ . 1 . 2]" 1
1298 1 53 LEU HA 1 53 LEU HG . . 3.840 2.476 2.045 3.188 . 0 0 "[ . 1 . 2]" 1
1299 1 53 LEU HA 1 54 TYR H . . 3.160 2.393 2.266 2.525 . 0 0 "[ . 1 . 2]" 1
1300 1 53 LEU HA 1 54 TYR QD . . 4.640 2.695 2.502 2.907 . 0 0 "[ . 1 . 2]" 1
1301 1 53 LEU HA 1 70 ALA MB . . 5.500 4.622 4.410 4.804 . 0 0 "[ . 1 . 2]" 1
1302 1 53 LEU HB2 1 53 LEU MD1 . . 3.350 2.254 2.133 2.403 . 0 0 "[ . 1 . 2]" 1
1303 1 53 LEU HB2 1 53 LEU MD2 . . 3.320 2.849 2.493 3.257 . 0 0 "[ . 1 . 2]" 1
1304 1 53 LEU HB2 1 54 TYR H . . 4.340 3.741 3.545 3.895 . 0 0 "[ . 1 . 2]" 1
1305 1 53 LEU HB2 1 64 PHE HB2 . . 5.000 2.696 2.317 3.165 . 0 0 "[ . 1 . 2]" 1
1306 1 53 LEU HB2 1 64 PHE HB3 . . 4.640 3.840 3.525 4.225 . 0 0 "[ . 1 . 2]" 1
1307 1 53 LEU HB2 1 64 PHE QD . . 4.030 2.405 2.218 2.666 . 0 0 "[ . 1 . 2]" 1
1308 1 53 LEU HB2 1 67 VAL HA . . 5.110 3.281 2.703 3.693 . 0 0 "[ . 1 . 2]" 1
1309 1 53 LEU HB2 1 70 ALA H . . 5.500 3.852 3.681 4.014 . 0 0 "[ . 1 . 2]" 1
1310 1 53 LEU HB3 1 54 TYR H . . 4.310 2.436 2.199 2.645 . 0 0 "[ . 1 . 2]" 1
1311 1 53 LEU HB3 1 64 PHE HB3 . . 5.030 5.090 5.050 5.151 0.121 20 0 "[ . 1 . 2]" 1
1312 1 53 LEU HB3 1 64 PHE QD . . 4.260 2.328 2.137 2.625 . 0 0 "[ . 1 . 2]" 1
1313 1 53 LEU HB3 1 70 ALA MB . . 4.850 2.529 2.281 2.729 . 0 0 "[ . 1 . 2]" 1
1314 1 53 LEU MD1 1 54 TYR H . . 5.500 4.484 4.305 4.733 . 0 0 "[ . 1 . 2]" 1
1315 1 53 LEU MD1 1 64 PHE HB3 . . 5.500 4.829 4.171 5.347 . 0 0 "[ . 1 . 2]" 1
1316 1 53 LEU MD1 1 64 PHE QD . . 5.400 4.096 3.687 4.501 . 0 0 "[ . 1 . 2]" 1
1317 1 53 LEU MD1 1 67 VAL H . . 5.500 4.504 4.235 4.644 . 0 0 "[ . 1 . 2]" 1
1318 1 53 LEU MD1 1 67 VAL HA . . 3.830 2.083 1.974 2.333 . 0 0 "[ . 1 . 2]" 1
1319 1 53 LEU MD1 1 67 VAL HB . . 5.500 3.863 1.970 4.071 . 0 0 "[ . 1 . 2]" 1
1320 1 53 LEU MD1 1 67 VAL QG . . 3.590 1.822 1.728 2.540 . 0 0 "[ . 1 . 2]" 1
1321 1 53 LEU MD1 1 68 SER H . . 5.500 4.916 4.630 5.234 . 0 0 "[ . 1 . 2]" 1
1322 1 53 LEU MD1 1 69 LYS H . . 5.340 5.071 4.374 5.407 0.067 8 0 "[ . 1 . 2]" 1
1323 1 53 LEU MD1 1 70 ALA H . . 5.060 3.854 2.912 4.590 . 0 0 "[ . 1 . 2]" 1
1324 1 53 LEU MD1 1 70 ALA MB . . 3.760 2.534 1.828 3.372 . 0 0 "[ . 1 . 2]" 1
1325 1 53 LEU MD2 1 54 TYR H . . 4.210 3.585 3.327 3.819 . 0 0 "[ . 1 . 2]" 1
1326 1 53 LEU MD2 1 67 VAL QG . . 4.630 2.901 2.604 4.276 . 0 0 "[ . 1 . 2]" 1
1327 1 54 TYR H 1 54 TYR QD . . 3.260 2.772 2.530 2.965 . 0 0 "[ . 1 . 2]" 1
1328 1 54 TYR H 1 56 ILE MD . . 5.500 4.610 4.267 5.436 . 0 0 "[ . 1 . 2]" 1
1329 1 54 TYR H 1 63 LYS HA . . 5.500 4.917 4.761 5.066 . 0 0 "[ . 1 . 2]" 1
1330 1 54 TYR H 1 64 PHE H . . 5.500 4.678 4.516 4.769 . 0 0 "[ . 1 . 2]" 1
1331 1 54 TYR H 1 70 ALA MB . . 5.370 4.403 4.144 4.689 . 0 0 "[ . 1 . 2]" 1
1332 1 54 TYR HA 1 54 TYR QD . . 3.410 3.347 3.267 3.389 . 0 0 "[ . 1 . 2]" 1
1333 1 54 TYR HA 1 54 TYR QE . . 4.910 4.938 4.910 4.961 0.051 20 0 "[ . 1 . 2]" 1
1334 1 54 TYR HA 1 55 ALA H . . 3.020 2.323 2.230 2.423 . 0 0 "[ . 1 . 2]" 1
1335 1 54 TYR HA 1 55 ALA HA . . 4.910 4.537 4.465 4.615 . 0 0 "[ . 1 . 2]" 1
1336 1 54 TYR HA 1 55 ALA MB . . 4.810 4.202 4.114 4.284 . 0 0 "[ . 1 . 2]" 1
1337 1 54 TYR HA 1 56 ILE MD . . 5.500 4.696 4.273 5.564 0.064 11 0 "[ . 1 . 2]" 1
1338 1 54 TYR HA 1 61 VAL MG2 . . 4.950 4.201 4.003 4.575 . 0 0 "[ . 1 . 2]" 1
1339 1 54 TYR HA 1 62 LEU H . . 5.500 4.401 3.945 4.900 . 0 0 "[ . 1 . 2]" 1
1340 1 54 TYR HA 1 63 LYS H . . 5.500 4.309 4.167 4.448 . 0 0 "[ . 1 . 2]" 1
1341 1 54 TYR HA 1 63 LYS HA . . 3.510 2.499 2.273 2.701 . 0 0 "[ . 1 . 2]" 1
1342 1 54 TYR HA 1 64 PHE H . . 3.860 2.905 2.748 3.142 . 0 0 "[ . 1 . 2]" 1
1343 1 54 TYR HA 1 64 PHE QD . . 4.230 2.987 2.691 3.288 . 0 0 "[ . 1 . 2]" 1
1344 1 54 TYR HA 1 64 PHE QE . . 5.020 3.669 3.382 4.073 . 0 0 "[ . 1 . 2]" 1
1345 1 54 TYR HB2 1 55 ALA H . . 3.930 3.868 3.578 4.028 0.098 18 0 "[ . 1 . 2]" 1
1346 1 54 TYR HB2 1 55 ALA HA . . 5.090 4.551 4.275 4.739 . 0 0 "[ . 1 . 2]" 1
1347 1 54 TYR HB2 1 56 ILE H . . 5.500 4.693 4.441 5.049 . 0 0 "[ . 1 . 2]" 1
1348 1 54 TYR HB2 1 56 ILE MD . . 4.480 2.481 2.147 3.154 . 0 0 "[ . 1 . 2]" 1
1349 1 54 TYR HB2 1 56 ILE HG12 . . 5.210 5.030 4.777 5.246 0.036 19 0 "[ . 1 . 2]" 1
1350 1 54 TYR HB2 1 56 ILE HG13 . . 5.430 4.131 3.395 4.448 . 0 0 "[ . 1 . 2]" 1
1351 1 54 TYR HB2 1 61 VAL HA . . 4.540 4.568 4.517 4.612 0.072 9 0 "[ . 1 . 2]" 1
1352 1 54 TYR HB2 1 61 VAL MG2 . . 4.040 2.888 2.601 3.219 . 0 0 "[ . 1 . 2]" 1
1353 1 54 TYR HB2 1 62 LEU H . . 5.400 4.650 3.998 5.203 . 0 0 "[ . 1 . 2]" 1
1354 1 54 TYR HB2 1 63 LYS H . . 5.500 5.573 5.549 5.640 0.140 18 0 "[ . 1 . 2]" 1
1355 1 54 TYR HB2 1 63 LYS HA . . 5.500 4.379 4.221 4.588 . 0 0 "[ . 1 . 2]" 1
1356 1 54 TYR HB3 1 55 ALA H . . 4.320 3.059 2.734 3.233 . 0 0 "[ . 1 . 2]" 1
1357 1 54 TYR HB3 1 55 ALA HA . . 5.500 4.803 4.601 4.952 . 0 0 "[ . 1 . 2]" 1
1358 1 54 TYR HB3 1 55 ALA MB . . 5.500 4.835 4.604 5.001 . 0 0 "[ . 1 . 2]" 1
1359 1 54 TYR HB3 1 56 ILE MD . . 5.460 3.245 2.778 3.934 . 0 0 "[ . 1 . 2]" 1
1360 1 54 TYR HB3 1 61 VAL MG2 . . 4.690 2.310 2.130 2.710 . 0 0 "[ . 1 . 2]" 1
1361 1 54 TYR HB3 1 62 LEU H . . 5.500 3.396 2.726 3.945 . 0 0 "[ . 1 . 2]" 1
1362 1 54 TYR QD 1 55 ALA H . . 4.710 4.652 4.408 4.823 0.113 18 0 "[ . 1 . 2]" 1
1363 1 54 TYR QD 1 56 ILE MD . . 4.690 4.013 3.694 4.520 . 0 0 "[ . 1 . 2]" 1
1364 1 54 TYR QD 1 61 VAL HB . . 5.500 4.977 4.793 5.185 . 0 0 "[ . 1 . 2]" 1
1365 1 54 TYR QD 1 61 VAL MG2 . . 3.030 2.050 1.941 2.182 . 0 0 "[ . 1 . 2]" 1
1366 1 54 TYR QD 1 62 LEU H . . 5.500 4.561 3.821 5.060 . 0 0 "[ . 1 . 2]" 1
1367 1 54 TYR QD 1 62 LEU HA . . 5.500 4.844 4.244 5.106 . 0 0 "[ . 1 . 2]" 1
1368 1 54 TYR QD 1 63 LYS H . . 4.920 3.110 2.811 3.349 . 0 0 "[ . 1 . 2]" 1
1369 1 54 TYR QD 1 63 LYS HA . . 3.440 2.564 2.390 2.713 . 0 0 "[ . 1 . 2]" 1
1370 1 54 TYR QD 1 63 LYS HB3 . . 3.610 2.410 2.188 3.239 . 0 0 "[ . 1 . 2]" 1
1371 1 54 TYR QD 1 64 PHE H . . 4.260 4.239 4.155 4.314 0.054 9 0 "[ . 1 . 2]" 1
1372 1 54 TYR QE 1 61 VAL MG2 . . 3.530 3.541 3.424 3.586 0.056 15 0 "[ . 1 . 2]" 1
1373 1 54 TYR QE 1 63 LYS HA . . 4.020 3.717 3.557 3.878 . 0 0 "[ . 1 . 2]" 1
1374 1 54 TYR QE 1 63 LYS HB3 . . 3.060 2.463 2.289 3.089 0.029 10 0 "[ . 1 . 2]" 1
1375 1 54 TYR QE 1 64 PHE H . . 5.290 4.831 4.718 5.036 . 0 0 "[ . 1 . 2]" 1
1376 1 55 ALA H 1 55 ALA MB . . 3.630 2.409 2.338 2.505 . 0 0 "[ . 1 . 2]" 1
1377 1 55 ALA H 1 56 ILE H . . 4.950 4.340 4.126 4.502 . 0 0 "[ . 1 . 2]" 1
1378 1 55 ALA H 1 56 ILE HA . . 5.500 4.918 4.658 5.110 . 0 0 "[ . 1 . 2]" 1
1379 1 55 ALA H 1 56 ILE MD . . 5.500 4.463 4.128 5.487 . 0 0 "[ . 1 . 2]" 1
1380 1 55 ALA H 1 61 VAL HA . . 5.050 4.555 4.232 4.785 . 0 0 "[ . 1 . 2]" 1
1381 1 55 ALA H 1 61 VAL MG2 . . 4.870 4.389 4.100 4.730 . 0 0 "[ . 1 . 2]" 1
1382 1 55 ALA H 1 62 LEU HA . . 5.500 4.445 4.314 4.600 . 0 0 "[ . 1 . 2]" 1
1383 1 55 ALA H 1 62 LEU HB2 . . 4.350 4.393 4.260 4.466 0.116 7 0 "[ . 1 . 2]" 1
1384 1 55 ALA H 1 63 LYS H . . 5.500 4.632 4.379 4.787 . 0 0 "[ . 1 . 2]" 1
1385 1 55 ALA H 1 63 LYS HA . . 4.270 4.169 3.846 4.356 0.086 18 0 "[ . 1 . 2]" 1
1386 1 55 ALA H 1 64 PHE H . . 4.770 4.739 4.504 5.049 0.279 18 0 "[ . 1 . 2]" 1
1387 1 55 ALA H 1 64 PHE QD . . 4.480 4.055 3.759 4.459 . 0 0 "[ . 1 . 2]" 1
1388 1 55 ALA H 1 64 PHE QE . . 4.660 3.269 2.954 3.960 . 0 0 "[ . 1 . 2]" 1
1389 1 55 ALA H 1 64 PHE HZ . . 5.390 4.219 3.731 4.583 . 0 0 "[ . 1 . 2]" 1
1390 1 55 ALA HA 1 56 ILE H . . 3.000 2.124 2.072 2.170 . 0 0 "[ . 1 . 2]" 1
1391 1 55 ALA HA 1 56 ILE HA . . 4.990 4.377 4.268 4.451 . 0 0 "[ . 1 . 2]" 1
1392 1 55 ALA HA 1 56 ILE HB . . 4.510 4.591 4.541 4.626 0.116 10 0 "[ . 1 . 2]" 1
1393 1 55 ALA HA 1 56 ILE MD . . 5.500 3.843 3.456 4.911 . 0 0 "[ . 1 . 2]" 1
1394 1 55 ALA HA 1 57 THR H . . 5.500 5.220 4.923 5.515 0.015 6 0 "[ . 1 . 2]" 1
1395 1 55 ALA HA 1 62 LEU H . . 5.500 4.724 4.569 4.900 . 0 0 "[ . 1 . 2]" 1
1396 1 55 ALA HA 1 64 PHE QD . . 5.500 5.443 5.166 5.531 0.031 6 0 "[ . 1 . 2]" 1
1397 1 55 ALA HA 1 64 PHE QE . . 5.220 3.737 3.535 4.025 . 0 0 "[ . 1 . 2]" 1
1398 1 55 ALA HA 1 64 PHE HZ . . 4.910 4.884 4.646 5.007 0.097 16 0 "[ . 1 . 2]" 1
1399 1 55 ALA MB 1 56 ILE H . . 3.830 3.315 3.034 3.498 . 0 0 "[ . 1 . 2]" 1
1400 1 55 ALA MB 1 62 LEU HG . . 3.910 3.160 2.808 3.685 . 0 0 "[ . 1 . 2]" 1
1401 1 55 ALA MB 1 64 PHE QD . . 4.200 4.392 4.177 4.624 0.424 9 0 "[ . 1 . 2]" 1
1402 1 55 ALA MB 1 64 PHE QE . . 3.730 2.599 2.356 2.942 . 0 0 "[ . 1 . 2]" 1
1403 1 55 ALA MB 1 64 PHE HZ . . 3.140 2.490 2.242 2.739 . 0 0 "[ . 1 . 2]" 1
1404 1 55 ALA MB 1 73 TYR QE . . 3.300 3.103 2.562 3.341 0.041 14 0 "[ . 1 . 2]" 1
1405 1 56 ILE H 1 56 ILE HB . . 3.600 2.522 2.451 2.618 . 0 0 "[ . 1 . 2]" 1
1406 1 56 ILE H 1 56 ILE MD . . 5.140 2.834 2.540 3.554 . 0 0 "[ . 1 . 2]" 1
1407 1 56 ILE H 1 56 ILE HG12 . . 4.650 4.529 4.303 4.672 0.022 2 0 "[ . 1 . 2]" 1
1408 1 56 ILE H 1 56 ILE HG13 . . 4.070 3.746 2.978 4.068 . 0 0 "[ . 1 . 2]" 1
1409 1 56 ILE H 1 57 THR H . . 4.380 4.134 3.925 4.316 . 0 0 "[ . 1 . 2]" 1
1410 1 56 ILE H 1 61 VAL HA . . 5.500 4.783 4.345 5.039 . 0 0 "[ . 1 . 2]" 1
1411 1 56 ILE H 1 62 LEU H . . 5.500 4.789 4.552 5.003 . 0 0 "[ . 1 . 2]" 1
1412 1 56 ILE HA 1 56 ILE MD . . 4.570 3.343 3.135 3.793 . 0 0 "[ . 1 . 2]" 1
1413 1 56 ILE HA 1 56 ILE HG12 . . 3.810 3.328 2.808 3.515 . 0 0 "[ . 1 . 2]" 1
1414 1 56 ILE HA 1 56 ILE HG13 . . 3.100 2.232 2.153 2.435 . 0 0 "[ . 1 . 2]" 1
1415 1 56 ILE HA 1 56 ILE MG . . 3.690 2.387 2.314 2.488 . 0 0 "[ . 1 . 2]" 1
1416 1 56 ILE HA 1 57 THR H . . 3.040 2.082 2.037 2.188 . 0 0 "[ . 1 . 2]" 1
1417 1 56 ILE HA 1 59 ASP HA . . 5.500 5.144 4.225 5.613 0.113 19 0 "[ . 1 . 2]" 1
1418 1 56 ILE HA 1 60 VAL H . . 4.790 3.890 3.546 4.296 . 0 0 "[ . 1 . 2]" 1
1419 1 56 ILE HA 1 60 VAL HB . . 4.870 4.400 4.244 4.633 . 0 0 "[ . 1 . 2]" 1
1420 1 56 ILE HA 1 61 VAL H . . 5.500 4.453 4.142 4.763 . 0 0 "[ . 1 . 2]" 1
1421 1 56 ILE HA 1 61 VAL HA . . 3.620 2.630 2.282 2.822 . 0 0 "[ . 1 . 2]" 1
1422 1 56 ILE HA 1 61 VAL MG2 . . 4.150 4.046 3.702 4.168 0.018 14 0 "[ . 1 . 2]" 1
1423 1 56 ILE HA 1 62 LEU H . . 4.450 3.375 3.063 3.808 . 0 0 "[ . 1 . 2]" 1
1424 1 56 ILE HB 1 57 THR H . . 4.880 4.483 4.339 4.545 . 0 0 "[ . 1 . 2]" 1
1425 1 56 ILE HB 1 61 VAL HA . . 5.500 4.866 4.497 5.024 . 0 0 "[ . 1 . 2]" 1
1426 1 56 ILE MD 1 56 ILE MG . . 3.590 3.092 2.568 3.252 . 0 0 "[ . 1 . 2]" 1
1427 1 56 ILE MD 1 57 THR H . . 5.450 5.040 4.870 5.460 0.010 14 0 "[ . 1 . 2]" 1
1428 1 56 ILE MD 1 61 VAL H . . 5.500 5.409 5.142 5.542 0.042 14 0 "[ . 1 . 2]" 1
1429 1 56 ILE MD 1 61 VAL HA . . 4.690 3.453 3.121 3.879 . 0 0 "[ . 1 . 2]" 1
1430 1 56 ILE MD 1 61 VAL HB . . 5.500 3.625 3.445 3.985 . 0 0 "[ . 1 . 2]" 1
1431 1 56 ILE MD 1 61 VAL MG2 . . 4.230 2.358 2.185 2.912 . 0 0 "[ . 1 . 2]" 1
1432 1 56 ILE MD 1 62 LEU H . . 5.500 4.305 3.783 5.287 . 0 0 "[ . 1 . 2]" 1
1433 1 56 ILE HG12 1 57 THR H . . 5.300 5.175 4.744 5.333 0.033 9 0 "[ . 1 . 2]" 1
1434 1 56 ILE HG12 1 61 VAL H . . 5.500 5.075 4.262 5.516 0.016 17 0 "[ . 1 . 2]" 1
1435 1 56 ILE HG12 1 61 VAL HA . . 3.880 3.682 2.877 3.906 0.026 8 0 "[ . 1 . 2]" 1
1436 1 56 ILE HG12 1 61 VAL MG2 . . 4.670 3.415 2.873 3.669 . 0 0 "[ . 1 . 2]" 1
1437 1 56 ILE HG12 1 62 LEU H . . 5.500 5.423 4.754 5.544 0.044 7 0 "[ . 1 . 2]" 1
1438 1 56 ILE HG13 1 57 THR H . . 5.500 4.224 4.102 4.561 . 0 0 "[ . 1 . 2]" 1
1439 1 56 ILE HG13 1 61 VAL HA . . 2.970 2.211 2.062 2.509 . 0 0 "[ . 1 . 2]" 1
1440 1 56 ILE HG13 1 62 LEU H . . 5.380 3.801 3.757 3.875 . 0 0 "[ . 1 . 2]" 1
1441 1 56 ILE MG 1 57 THR H . . 3.720 3.085 2.811 3.334 . 0 0 "[ . 1 . 2]" 1
1442 1 56 ILE MG 1 58 GLY H . . 4.170 3.479 2.973 4.100 . 0 0 "[ . 1 . 2]" 1
1443 1 56 ILE MG 1 58 GLY HA2 . . 5.500 4.137 3.649 4.851 . 0 0 "[ . 1 . 2]" 1
1444 1 56 ILE MG 1 58 GLY HA3 . . 5.500 4.562 4.280 5.350 . 0 0 "[ . 1 . 2]" 1
1445 1 56 ILE MG 1 59 ASP H . . 5.500 3.642 2.594 4.119 . 0 0 "[ . 1 . 2]" 1
1446 1 56 ILE MG 1 60 VAL H . . 4.580 3.002 2.561 3.422 . 0 0 "[ . 1 . 2]" 1
1447 1 56 ILE MG 1 60 VAL HA . . 4.650 4.643 4.533 4.725 0.075 7 0 "[ . 1 . 2]" 1
1448 1 56 ILE MG 1 60 VAL HB . . 5.360 4.607 4.228 4.970 . 0 0 "[ . 1 . 2]" 1
1449 1 56 ILE MG 1 61 VAL HA . . 4.580 3.810 3.513 4.062 . 0 0 "[ . 1 . 2]" 1
1450 1 56 ILE MG 1 62 LEU H . . 5.500 5.074 4.831 5.349 . 0 0 "[ . 1 . 2]" 1
1451 1 57 THR H 1 57 THR HB . . 3.740 2.639 2.429 2.883 . 0 0 "[ . 1 . 2]" 1
1452 1 57 THR H 1 57 THR MG . . 4.290 3.851 3.775 3.938 . 0 0 "[ . 1 . 2]" 1
1453 1 57 THR H 1 58 GLY H . . 4.980 4.089 3.817 4.292 . 0 0 "[ . 1 . 2]" 1
1454 1 57 THR H 1 58 GLY HA3 . . 5.500 5.344 5.185 5.487 . 0 0 "[ . 1 . 2]" 1
1455 1 57 THR H 1 59 ASP H . . 4.800 4.305 3.361 4.838 0.038 11 0 "[ . 1 . 2]" 1
1456 1 57 THR H 1 59 ASP HA . . 5.500 5.260 4.543 5.612 0.112 19 0 "[ . 1 . 2]" 1
1457 1 57 THR H 1 60 VAL H . . 4.130 2.930 2.713 3.137 . 0 0 "[ . 1 . 2]" 1
1458 1 57 THR H 1 60 VAL HA . . 4.620 4.602 4.510 4.663 0.043 9 0 "[ . 1 . 2]" 1
1459 1 57 THR H 1 60 VAL HB . . 4.180 2.803 2.633 3.049 . 0 0 "[ . 1 . 2]" 1
1460 1 57 THR H 1 60 VAL MG1 . . 4.970 3.546 2.264 3.766 . 0 0 "[ . 1 . 2]" 1
1461 1 57 THR H 1 60 VAL MG2 . . 5.330 4.282 4.124 4.499 . 0 0 "[ . 1 . 2]" 1
1462 1 57 THR H 1 61 VAL HA . . 4.320 4.003 3.748 4.213 . 0 0 "[ . 1 . 2]" 1
1463 1 57 THR H 1 62 LEU H . . 5.110 4.151 3.570 4.710 . 0 0 "[ . 1 . 2]" 1
1464 1 57 THR HA 1 57 THR MG . . 3.470 2.313 2.190 2.459 . 0 0 "[ . 1 . 2]" 1
1465 1 57 THR HA 1 58 GLY H . . 3.170 2.151 1.992 2.262 . 0 0 "[ . 1 . 2]" 1
1466 1 57 THR HA 1 58 GLY HA2 . . 5.500 4.421 4.298 4.490 . 0 0 "[ . 1 . 2]" 1
1467 1 57 THR HA 1 58 GLY HA3 . . 4.600 4.463 4.401 4.541 . 0 0 "[ . 1 . 2]" 1
1468 1 57 THR HA 1 59 ASP H . . 5.500 4.804 3.706 5.269 . 0 0 "[ . 1 . 2]" 1
1469 1 57 THR HA 1 60 VAL H . . 5.500 4.563 4.461 4.706 . 0 0 "[ . 1 . 2]" 1
1470 1 57 THR HB 1 58 GLY H . . 5.240 4.418 4.244 4.533 . 0 0 "[ . 1 . 2]" 1
1471 1 57 THR HB 1 60 VAL H . . 4.640 3.851 3.608 4.308 . 0 0 "[ . 1 . 2]" 1
1472 1 57 THR HB 1 60 VAL HB . . 3.930 2.383 2.105 3.068 . 0 0 "[ . 1 . 2]" 1
1473 1 57 THR MG 1 58 GLY H . . 4.340 3.364 2.927 3.778 . 0 0 "[ . 1 . 2]" 1
1474 1 57 THR MG 1 58 GLY HA3 . . 5.500 4.089 3.594 4.576 . 0 0 "[ . 1 . 2]" 1
1475 1 57 THR MG 1 59 ASP H . . 5.500 4.670 4.379 4.931 . 0 0 "[ . 1 . 2]" 1
1476 1 57 THR MG 1 60 VAL H . . 5.120 4.632 4.285 4.966 . 0 0 "[ . 1 . 2]" 1
1477 1 58 GLY H 1 59 ASP H . . 4.170 3.842 2.928 4.212 0.042 7 0 "[ . 1 . 2]" 1
1478 1 58 GLY H 1 60 VAL H . . 4.960 4.365 4.052 4.558 . 0 0 "[ . 1 . 2]" 1
1479 1 58 GLY H 1 60 VAL MG2 . . 5.500 5.520 5.451 5.601 0.101 14 0 "[ . 1 . 2]" 1
1480 1 58 GLY HA2 1 59 ASP H . . 3.520 3.445 3.184 3.522 0.002 10 0 "[ . 1 . 2]" 1
1481 1 58 GLY HA2 1 59 ASP HA . . 5.300 4.842 4.723 5.024 . 0 0 "[ . 1 . 2]" 1
1482 1 58 GLY HA2 1 59 ASP QB . . 4.870 4.747 3.993 5.020 0.150 2 0 "[ . 1 . 2]" 1
1483 1 58 GLY HA3 1 59 ASP H . . 3.340 2.320 2.130 3.348 0.008 9 0 "[ . 1 . 2]" 1
1484 1 58 GLY HA3 1 59 ASP HA . . 5.500 4.638 4.497 5.293 . 0 0 "[ . 1 . 2]" 1
1485 1 58 GLY HA3 1 59 ASP QB . . 5.150 4.121 3.589 4.641 . 0 0 "[ . 1 . 2]" 1
1486 1 58 GLY HA3 1 60 VAL H . . 4.450 3.865 3.529 3.984 . 0 0 "[ . 1 . 2]" 1
1487 1 59 ASP H 1 59 ASP QB . . 3.420 2.877 2.339 3.439 0.019 12 0 "[ . 1 . 2]" 1
1488 1 59 ASP H 1 60 VAL H . . 3.300 1.946 1.581 2.171 . 0 0 "[ . 1 . 2]" 1
1489 1 59 ASP H 1 60 VAL HB . . 4.650 3.844 3.008 4.188 . 0 0 "[ . 1 . 2]" 1
1490 1 59 ASP H 1 60 VAL MG1 . . 5.130 5.088 4.462 5.264 0.134 9 0 "[ . 1 . 2]" 1
1491 1 59 ASP H 1 60 VAL MG2 . . 4.450 3.053 2.836 4.253 . 0 0 "[ . 1 . 2]" 1
1492 1 59 ASP HA 1 59 ASP QB . . 2.780 2.355 2.115 2.601 . 0 0 "[ . 1 . 2]" 1
1493 1 59 ASP HA 1 60 VAL MG2 . . 5.110 4.822 4.631 4.978 . 0 0 "[ . 1 . 2]" 1
1494 1 59 ASP HA 1 61 VAL H . . 5.500 5.075 4.732 5.458 . 0 0 "[ . 1 . 2]" 1
1495 1 59 ASP QB 1 60 VAL H . . 4.170 3.722 3.358 4.056 . 0 0 "[ . 1 . 2]" 1
1496 1 59 ASP QB 1 60 VAL HA . . 5.390 4.432 3.848 4.845 . 0 0 "[ . 1 . 2]" 1
1497 1 59 ASP QB 1 60 VAL MG2 . . 4.720 3.940 3.033 4.733 0.013 6 0 "[ . 1 . 2]" 1
1498 1 59 ASP QB 1 61 VAL H . . 5.500 5.309 4.910 5.550 0.050 19 0 "[ . 1 . 2]" 1
1499 1 60 VAL H 1 60 VAL HB . . 3.210 2.458 2.084 2.573 . 0 0 "[ . 1 . 2]" 1
1500 1 60 VAL H 1 60 VAL MG1 . . 4.050 3.797 3.334 3.862 . 0 0 "[ . 1 . 2]" 1
1501 1 60 VAL H 1 60 VAL MG2 . . 3.490 2.649 2.430 3.105 . 0 0 "[ . 1 . 2]" 1
1502 1 60 VAL H 1 61 VAL H . . 4.640 4.128 4.003 4.318 . 0 0 "[ . 1 . 2]" 1
1503 1 60 VAL H 1 61 VAL HA . . 5.500 4.968 4.775 5.096 . 0 0 "[ . 1 . 2]" 1
1504 1 60 VAL H 1 61 VAL HB . . 5.500 5.582 5.508 5.629 0.129 7 0 "[ . 1 . 2]" 1
1505 1 60 VAL HA 1 60 VAL MG1 . . 3.420 2.532 2.419 3.094 . 0 0 "[ . 1 . 2]" 1
1506 1 60 VAL HA 1 60 VAL MG2 . . 3.290 2.409 2.360 2.446 . 0 0 "[ . 1 . 2]" 1
1507 1 60 VAL HA 1 61 VAL H . . 2.840 2.164 2.083 2.222 . 0 0 "[ . 1 . 2]" 1
1508 1 60 VAL HA 1 61 VAL HA . . 4.440 4.455 4.394 4.541 0.101 7 0 "[ . 1 . 2]" 1
1509 1 60 VAL HA 1 61 VAL HB . . 4.650 4.633 4.444 4.790 0.140 7 0 "[ . 1 . 2]" 1
1510 1 60 VAL HB 1 61 VAL H . . 4.670 4.465 4.320 4.542 . 0 0 "[ . 1 . 2]" 1
1511 1 60 VAL MG1 1 61 VAL H . . 3.780 3.390 3.183 3.805 0.025 14 0 "[ . 1 . 2]" 1
1512 1 60 VAL MG1 1 61 VAL MG1 . . 5.500 4.270 3.898 4.764 . 0 0 "[ . 1 . 2]" 1
1513 1 60 VAL MG1 1 62 LEU HB3 . . 3.580 3.638 3.593 3.712 0.132 18 0 "[ . 1 . 2]" 1
1514 1 60 VAL MG2 1 61 VAL H . . 4.330 4.211 4.109 4.286 . 0 0 "[ . 1 . 2]" 1
1515 1 61 VAL H 1 61 VAL HB . . 3.400 2.607 2.445 2.793 . 0 0 "[ . 1 . 2]" 1
1516 1 61 VAL H 1 61 VAL MG2 . . 4.500 3.833 3.770 3.885 . 0 0 "[ . 1 . 2]" 1
1517 1 61 VAL H 1 62 LEU H . . 4.980 4.284 4.084 4.528 . 0 0 "[ . 1 . 2]" 1
1518 1 61 VAL H 1 62 LEU HA . . 5.500 5.370 5.152 5.532 0.032 1 0 "[ . 1 . 2]" 1
1519 1 61 VAL HA 1 61 VAL MG2 . . 3.690 2.270 2.208 2.339 . 0 0 "[ . 1 . 2]" 1
1520 1 61 VAL HA 1 62 LEU H . . 3.030 2.097 1.983 2.281 . 0 0 "[ . 1 . 2]" 1
1521 1 61 VAL HA 1 62 LEU HA . . 4.870 4.423 4.381 4.485 . 0 0 "[ . 1 . 2]" 1
1522 1 61 VAL HA 1 62 LEU HB3 . . 5.500 4.401 4.071 4.690 . 0 0 "[ . 1 . 2]" 1
1523 1 61 VAL HB 1 62 LEU H . . 4.710 4.322 4.130 4.533 . 0 0 "[ . 1 . 2]" 1
1524 1 61 VAL MG1 1 62 LEU HA . . 4.360 4.281 3.957 4.423 0.063 16 0 "[ . 1 . 2]" 1
1525 1 61 VAL MG1 1 63 LYS H . . 3.830 3.862 3.827 3.879 0.049 5 0 "[ . 1 . 2]" 1
1526 1 61 VAL MG2 1 62 LEU H . . 3.800 3.171 2.689 3.687 . 0 0 "[ . 1 . 2]" 1
1527 1 61 VAL MG2 1 62 LEU HA . . 5.500 4.150 3.861 4.480 . 0 0 "[ . 1 . 2]" 1
1528 1 61 VAL MG2 1 63 LYS H . . 4.870 3.245 2.944 3.513 . 0 0 "[ . 1 . 2]" 1
1529 1 62 LEU H 1 62 LEU HB2 . . 3.900 2.916 2.555 3.259 . 0 0 "[ . 1 . 2]" 1
1530 1 62 LEU H 1 62 LEU HB3 . . 3.890 2.437 2.296 2.613 . 0 0 "[ . 1 . 2]" 1
1531 1 62 LEU H 1 62 LEU MD1 . . 5.500 4.296 4.189 4.403 . 0 0 "[ . 1 . 2]" 1
1532 1 62 LEU H 1 62 LEU MD2 . . 4.970 4.391 4.217 4.653 . 0 0 "[ . 1 . 2]" 1
1533 1 62 LEU H 1 62 LEU HG . . 5.220 4.454 4.274 4.683 . 0 0 "[ . 1 . 2]" 1
1534 1 62 LEU H 1 63 LYS H . . 5.230 3.792 3.516 3.963 . 0 0 "[ . 1 . 2]" 1
1535 1 62 LEU HA 1 62 LEU MD1 . . 3.630 2.474 2.247 3.014 . 0 0 "[ . 1 . 2]" 1
1536 1 62 LEU HA 1 62 LEU MD2 . . 4.650 3.083 2.243 3.729 . 0 0 "[ . 1 . 2]" 1
1537 1 62 LEU HA 1 63 LYS H . . 2.890 2.164 2.077 2.307 . 0 0 "[ . 1 . 2]" 1
1538 1 62 LEU HB3 1 63 LYS H . . 5.500 4.519 4.464 4.592 . 0 0 "[ . 1 . 2]" 1
1539 1 62 LEU MD1 1 63 LYS H . . 4.020 3.202 2.672 3.596 . 0 0 "[ . 1 . 2]" 1
1540 1 62 LEU MD1 1 63 LYS HA . . 5.420 4.001 3.841 4.105 . 0 0 "[ . 1 . 2]" 1
1541 1 62 LEU MD1 1 63 LYS HG3 . . 4.110 3.937 3.177 4.222 0.112 10 0 "[ . 1 . 2]" 1
1542 1 62 LEU MD1 1 64 PHE H . . 4.210 4.225 4.104 4.356 0.146 18 0 "[ . 1 . 2]" 1
1543 1 62 LEU MD1 1 64 PHE HB3 . . 5.500 5.258 4.901 5.545 0.045 10 0 "[ . 1 . 2]" 1
1544 1 62 LEU MD2 1 63 LYS H . . 4.960 4.679 3.677 5.077 0.117 13 0 "[ . 1 . 2]" 1
1545 1 62 LEU MD2 1 64 PHE QE . . 5.500 4.369 3.142 5.098 . 0 0 "[ . 1 . 2]" 1
1546 1 62 LEU HG 1 63 LYS H . . 5.500 5.122 4.401 5.579 0.079 11 0 "[ . 1 . 2]" 1
1547 1 62 LEU HG 1 64 PHE QE . . 4.220 3.811 3.218 4.255 0.035 5 0 "[ . 1 . 2]" 1
1548 1 62 LEU HG 1 64 PHE HZ . . 4.450 4.114 3.394 4.543 0.093 20 0 "[ . 1 . 2]" 1
1549 1 63 LYS H 1 63 LYS HB3 . . 3.490 2.561 1.985 3.524 0.034 12 0 "[ . 1 . 2]" 1
1550 1 63 LYS H 1 63 LYS HE2 . . 5.500 5.255 4.781 5.609 0.109 10 0 "[ . 1 . 2]" 1
1551 1 63 LYS H 1 64 PHE H . . 4.930 4.600 4.459 4.758 . 0 0 "[ . 1 . 2]" 1
1552 1 63 LYS HA 1 63 LYS HE2 . . 4.750 4.640 4.280 4.893 0.143 10 0 "[ . 1 . 2]" 1
1553 1 63 LYS HA 1 64 PHE H . . 3.240 2.118 1.968 2.233 . 0 0 "[ . 1 . 2]" 1
1554 1 63 LYS HB3 1 63 LYS HE2 . . 5.420 3.529 2.076 4.131 . 0 0 "[ . 1 . 2]" 1
1555 1 63 LYS HE2 1 65 ALA MB . . 5.500 5.022 3.665 5.531 0.031 11 0 "[ . 1 . 2]" 1
1556 1 64 PHE H 1 64 PHE HB2 . . 3.880 2.396 2.226 2.487 . 0 0 "[ . 1 . 2]" 1
1557 1 64 PHE H 1 64 PHE HB3 . . 3.630 3.553 3.402 3.604 . 0 0 "[ . 1 . 2]" 1
1558 1 64 PHE H 1 64 PHE QD . . 3.940 3.062 2.816 3.394 . 0 0 "[ . 1 . 2]" 1
1559 1 64 PHE H 1 65 ALA H . . 5.500 4.537 4.433 4.660 . 0 0 "[ . 1 . 2]" 1
1560 1 64 PHE H 1 66 THR H . . 5.500 4.701 4.509 4.880 . 0 0 "[ . 1 . 2]" 1
1561 1 64 PHE H 1 69 LYS QB . . 5.500 5.123 4.902 5.293 . 0 0 "[ . 1 . 2]" 1
1562 1 64 PHE HA 1 64 PHE QD . . 3.420 2.315 2.127 2.471 . 0 0 "[ . 1 . 2]" 1
1563 1 64 PHE HA 1 64 PHE QE . . 4.320 4.350 4.287 4.381 0.061 8 0 "[ . 1 . 2]" 1
1564 1 64 PHE HA 1 65 ALA HA . . 4.690 4.537 4.460 4.602 . 0 0 "[ . 1 . 2]" 1
1565 1 64 PHE HA 1 65 ALA MB . . 4.650 4.088 3.980 4.256 . 0 0 "[ . 1 . 2]" 1
1566 1 64 PHE HA 1 66 THR H . . 3.910 3.792 3.627 3.945 0.035 16 0 "[ . 1 . 2]" 1
1567 1 64 PHE HA 1 69 LYS QB . . 4.430 3.518 3.400 3.647 . 0 0 "[ . 1 . 2]" 1
1568 1 64 PHE HA 1 70 ALA H . . 5.500 5.567 5.526 5.643 0.143 5 0 "[ . 1 . 2]" 1
1569 1 64 PHE HA 1 70 ALA MB . . 5.500 5.522 5.441 5.564 0.064 13 0 "[ . 1 . 2]" 1
1570 1 64 PHE HB2 1 66 THR H . . 3.870 3.158 2.960 3.316 . 0 0 "[ . 1 . 2]" 1
1571 1 64 PHE HB2 1 69 LYS QB . . 4.260 3.330 3.202 3.466 . 0 0 "[ . 1 . 2]" 1
1572 1 64 PHE HB2 1 69 LYS HD3 . . 4.660 4.823 4.751 4.898 0.238 18 0 "[ . 1 . 2]" 1
1573 1 64 PHE HB2 1 70 ALA H . . 4.040 4.051 3.922 4.167 0.127 5 0 "[ . 1 . 2]" 1
1574 1 64 PHE HB3 1 66 THR H . . 4.280 2.413 2.275 2.653 . 0 0 "[ . 1 . 2]" 1
1575 1 64 PHE HB3 1 69 LYS H . . 5.500 4.027 3.917 4.218 . 0 0 "[ . 1 . 2]" 1
1576 1 64 PHE HB3 1 69 LYS QB . . 4.720 2.015 1.930 2.103 . 0 0 "[ . 1 . 2]" 1
1577 1 64 PHE HB3 1 70 ALA H . . 4.520 3.438 3.332 3.527 . 0 0 "[ . 1 . 2]" 1
1578 1 64 PHE HB3 1 70 ALA MB . . 4.950 3.918 3.724 4.109 . 0 0 "[ . 1 . 2]" 1
1579 1 64 PHE QD 1 66 THR H . . 4.840 4.520 4.404 4.760 . 0 0 "[ . 1 . 2]" 1
1580 1 64 PHE QD 1 69 LYS H . . 5.220 5.130 5.006 5.355 0.135 5 0 "[ . 1 . 2]" 1
1581 1 64 PHE QD 1 69 LYS HA . . 5.320 4.685 4.560 4.879 . 0 0 "[ . 1 . 2]" 1
1582 1 64 PHE QD 1 69 LYS QB . . 3.680 2.266 2.146 2.461 . 0 0 "[ . 1 . 2]" 1
1583 1 64 PHE QD 1 69 LYS HG2 . . 5.500 4.742 4.590 4.908 . 0 0 "[ . 1 . 2]" 1
1584 1 64 PHE QD 1 70 ALA H . . 4.890 3.844 3.652 3.988 . 0 0 "[ . 1 . 2]" 1
1585 1 64 PHE QD 1 70 ALA HA . . 4.380 3.816 3.518 4.035 . 0 0 "[ . 1 . 2]" 1
1586 1 64 PHE QD 1 70 ALA MB . . 4.320 2.660 2.369 2.914 . 0 0 "[ . 1 . 2]" 1
1587 1 64 PHE QE 1 69 LYS QB . . 4.640 3.518 3.261 3.731 . 0 0 "[ . 1 . 2]" 1
1588 1 64 PHE QE 1 70 ALA H . . 5.170 4.609 4.355 4.795 . 0 0 "[ . 1 . 2]" 1
1589 1 64 PHE QE 1 70 ALA HA . . 4.770 3.213 2.873 3.421 . 0 0 "[ . 1 . 2]" 1
1590 1 64 PHE QE 1 73 TYR QB . . 3.660 2.657 2.224 2.907 . 0 0 "[ . 1 . 2]" 1
1591 1 64 PHE HZ 1 69 LYS QB . . 5.500 4.978 4.651 5.355 . 0 0 "[ . 1 . 2]" 1
1592 1 64 PHE HZ 1 70 ALA HA . . 4.270 3.331 2.957 3.592 . 0 0 "[ . 1 . 2]" 1
1593 1 64 PHE HZ 1 73 TYR H . . 5.220 5.064 4.729 5.268 0.048 10 0 "[ . 1 . 2]" 1
1594 1 64 PHE HZ 1 73 TYR HA . . 5.050 4.722 4.285 5.129 0.079 10 0 "[ . 1 . 2]" 1
1595 1 64 PHE HZ 1 73 TYR HB2 . . 5.500 2.801 2.276 3.456 . 0 0 "[ . 1 . 2]" 1
1596 1 64 PHE HZ 1 73 TYR QB . . 3.580 2.551 2.198 2.860 . 0 0 "[ . 1 . 2]" 1
1597 1 64 PHE HZ 1 73 TYR HB3 . . 4.940 3.018 2.835 3.197 . 0 0 "[ . 1 . 2]" 1
1598 1 64 PHE HZ 1 73 TYR QD . . 3.470 2.761 2.279 3.053 . 0 0 "[ . 1 . 2]" 1
1599 1 64 PHE HZ 1 73 TYR QE . . 4.030 3.836 3.481 4.055 0.025 17 0 "[ . 1 . 2]" 1
1600 1 64 PHE HZ 1 74 LEU H . . 5.500 5.536 5.397 5.667 0.167 4 0 "[ . 1 . 2]" 1
1601 1 65 ALA H 1 66 THR H . . 4.870 3.041 2.848 3.219 . 0 0 "[ . 1 . 2]" 1
1602 1 65 ALA HA 1 66 THR MG . . 5.500 5.503 5.267 5.554 0.054 16 0 "[ . 1 . 2]" 1
1603 1 65 ALA MB 1 66 THR H . . 3.700 3.425 3.239 3.575 . 0 0 "[ . 1 . 2]" 1
1604 1 65 ALA MB 1 66 THR HA . . 4.290 4.370 4.306 4.408 0.118 2 0 "[ . 1 . 2]" 1
1605 1 65 ALA MB 1 69 LYS HD2 . . 4.880 2.252 2.077 2.591 . 0 0 "[ . 1 . 2]" 1
1606 1 65 ALA MB 1 69 LYS HE2 . . 5.500 4.833 4.214 5.132 . 0 0 "[ . 1 . 2]" 1
1607 1 65 ALA MB 1 69 LYS HG3 . . 3.720 3.608 3.157 3.769 0.049 17 0 "[ . 1 . 2]" 1
1608 1 66 THR H 1 66 THR MG . . 4.040 4.028 3.965 4.103 0.063 5 0 "[ . 1 . 2]" 1
1609 1 66 THR H 1 67 VAL H . . 4.590 4.126 4.051 4.210 . 0 0 "[ . 1 . 2]" 1
1610 1 66 THR H 1 67 VAL HA . . 5.480 4.387 4.307 4.466 . 0 0 "[ . 1 . 2]" 1
1611 1 66 THR H 1 67 VAL QG . . 5.500 4.803 4.480 4.929 . 0 0 "[ . 1 . 2]" 1
1612 1 66 THR H 1 68 SER H . . 5.430 5.404 5.160 5.615 0.185 5 0 "[ . 1 . 2]" 1
1613 1 66 THR H 1 69 LYS H . . 4.090 4.092 3.912 4.236 0.146 5 0 "[ . 1 . 2]" 1
1614 1 66 THR H 1 69 LYS QB . . 3.350 3.412 3.308 3.556 0.206 5 0 "[ . 1 . 2]" 1
1615 1 66 THR H 1 69 LYS HG2 . . 4.370 3.776 3.496 3.952 . 0 0 "[ . 1 . 2]" 1
1616 1 66 THR H 1 70 ALA MB . . 5.500 5.404 5.136 5.547 0.047 5 0 "[ . 1 . 2]" 1
1617 1 66 THR HA 1 66 THR MG . . 3.690 2.288 2.205 2.352 . 0 0 "[ . 1 . 2]" 1
1618 1 66 THR HA 1 67 VAL H . . 3.170 2.308 2.099 2.424 . 0 0 "[ . 1 . 2]" 1
1619 1 66 THR HA 1 67 VAL HA . . 5.090 4.326 4.005 4.432 . 0 0 "[ . 1 . 2]" 1
1620 1 66 THR HA 1 67 VAL HB . . 4.950 5.076 5.018 5.171 0.221 19 0 "[ . 1 . 2]" 1
1621 1 66 THR HA 1 67 VAL QG . . 5.250 3.564 2.911 3.855 . 0 0 "[ . 1 . 2]" 1
1622 1 66 THR HA 1 69 LYS H . . 4.730 4.719 4.476 4.803 0.073 7 0 "[ . 1 . 2]" 1
1623 1 66 THR HA 1 69 LYS HG2 . . 5.500 4.838 4.646 5.104 . 0 0 "[ . 1 . 2]" 1
1624 1 66 THR HB 1 67 VAL H . . 3.480 2.690 2.352 3.485 0.005 19 0 "[ . 1 . 2]" 1
1625 1 66 THR HB 1 67 VAL HA . . 4.900 4.074 3.944 4.812 . 0 0 "[ . 1 . 2]" 1
1626 1 66 THR HB 1 67 VAL QG . . 4.770 4.132 3.934 4.333 . 0 0 "[ . 1 . 2]" 1
1627 1 66 THR HB 1 68 SER H . . 3.800 2.640 2.047 3.519 . 0 0 "[ . 1 . 2]" 1
1628 1 66 THR HB 1 69 LYS H . . 4.490 2.056 1.764 2.396 . 0 0 "[ . 1 . 2]" 1
1629 1 66 THR HB 1 69 LYS HA . . 4.930 4.549 4.258 4.936 0.006 17 0 "[ . 1 . 2]" 1
1630 1 66 THR MG 1 67 VAL H . . 4.280 2.046 1.907 2.402 . 0 0 "[ . 1 . 2]" 1
1631 1 66 THR MG 1 67 VAL QG . . 4.880 3.169 2.881 3.480 . 0 0 "[ . 1 . 2]" 1
1632 1 66 THR MG 1 68 SER H . . 5.020 2.518 2.004 3.010 . 0 0 "[ . 1 . 2]" 1
1633 1 66 THR MG 1 69 LYS H . . 5.060 3.555 3.190 3.935 . 0 0 "[ . 1 . 2]" 1
1634 1 66 THR MG 1 69 LYS HE2 . . 5.200 5.266 5.236 5.299 0.099 4 0 "[ . 1 . 2]" 1
1635 1 66 THR MG 1 69 LYS HG2 . . 4.170 3.573 3.366 4.095 . 0 0 "[ . 1 . 2]" 1
1636 1 67 VAL H 1 67 VAL HB . . 3.500 2.798 2.628 3.439 . 0 0 "[ . 1 . 2]" 1
1637 1 67 VAL H 1 67 VAL QG . . 3.560 2.118 1.743 2.270 . 0 0 "[ . 1 . 2]" 1
1638 1 67 VAL H 1 68 SER H . . 3.990 2.487 2.359 2.673 . 0 0 "[ . 1 . 2]" 1
1639 1 67 VAL H 1 68 SER HA . . 5.260 5.084 4.958 5.254 . 0 0 "[ . 1 . 2]" 1
1640 1 67 VAL H 1 69 LYS H . . 5.030 4.008 3.791 4.316 . 0 0 "[ . 1 . 2]" 1
1641 1 67 VAL H 1 70 ALA H . . 5.470 5.517 5.407 5.561 0.091 6 0 "[ . 1 . 2]" 1
1642 1 67 VAL HA 1 69 LYS H . . 4.730 4.064 3.882 4.340 . 0 0 "[ . 1 . 2]" 1
1643 1 67 VAL HA 1 70 ALA H . . 3.830 3.842 3.665 3.936 0.106 2 0 "[ . 1 . 2]" 1
1644 1 67 VAL HA 1 70 ALA MB . . 3.970 3.563 3.229 3.830 . 0 0 "[ . 1 . 2]" 1
1645 1 67 VAL HB 1 68 SER H . . 3.940 2.457 2.117 3.971 0.031 19 0 "[ . 1 . 2]" 1
1646 1 67 VAL QG 1 68 SER H . . 4.660 3.112 2.165 3.293 . 0 0 "[ . 1 . 2]" 1
1647 1 67 VAL QG 1 69 LYS H . . 5.000 4.462 4.228 4.642 . 0 0 "[ . 1 . 2]" 1
1648 1 67 VAL QG 1 70 ALA H . . 5.500 4.354 4.113 4.726 . 0 0 "[ . 1 . 2]" 1
1649 1 68 SER H 1 69 LYS H . . 3.910 2.935 2.817 3.099 . 0 0 "[ . 1 . 2]" 1
1650 1 68 SER H 1 69 LYS QB . . 5.160 5.050 4.815 5.198 0.038 11 0 "[ . 1 . 2]" 1
1651 1 68 SER H 1 69 LYS HG2 . . 5.500 4.583 4.280 4.832 . 0 0 "[ . 1 . 2]" 1
1652 1 68 SER H 1 70 ALA H . . 4.880 4.793 4.507 4.911 0.031 13 0 "[ . 1 . 2]" 1
1653 1 68 SER HA 1 69 LYS HG2 . . 5.500 5.460 5.322 5.577 0.077 19 0 "[ . 1 . 2]" 1
1654 1 68 SER HA 1 70 ALA H . . 4.520 4.401 4.054 4.551 0.031 13 0 "[ . 1 . 2]" 1
1655 1 68 SER HA 1 71 ARG HB2 . . 4.960 2.935 2.211 3.498 . 0 0 "[ . 1 . 2]" 1
1656 1 68 SER HA 1 71 ARG HB3 . . 4.170 3.583 2.796 4.163 . 0 0 "[ . 1 . 2]" 1
1657 1 69 LYS H 1 69 LYS QB . . 3.110 2.529 2.240 2.722 . 0 0 "[ . 1 . 2]" 1
1658 1 69 LYS H 1 69 LYS HE3 . . 4.390 4.458 4.397 4.626 0.236 5 0 "[ . 1 . 2]" 1
1659 1 69 LYS H 1 69 LYS HG2 . . 4.310 2.203 2.017 2.326 . 0 0 "[ . 1 . 2]" 1
1660 1 69 LYS H 1 69 LYS HG3 . . 4.260 2.649 2.252 2.929 . 0 0 "[ . 1 . 2]" 1
1661 1 69 LYS H 1 70 ALA H . . 3.230 2.800 2.655 2.964 . 0 0 "[ . 1 . 2]" 1
1662 1 69 LYS H 1 70 ALA HA . . 5.420 5.408 5.314 5.550 0.130 5 0 "[ . 1 . 2]" 1
1663 1 69 LYS H 1 70 ALA MB . . 4.720 4.298 4.103 4.520 . 0 0 "[ . 1 . 2]" 1
1664 1 69 LYS HA 1 69 LYS HD3 . . 4.090 4.087 3.890 4.187 0.097 10 0 "[ . 1 . 2]" 1
1665 1 69 LYS HA 1 69 LYS HE3 . . 5.480 3.900 3.310 4.667 . 0 0 "[ . 1 . 2]" 1
1666 1 69 LYS HA 1 69 LYS HG2 . . 4.110 2.810 2.669 2.924 . 0 0 "[ . 1 . 2]" 1
1667 1 69 LYS HA 1 70 ALA MB . . 5.280 4.956 4.909 5.014 . 0 0 "[ . 1 . 2]" 1
1668 1 69 LYS HA 1 71 ARG H . . 3.920 3.998 3.910 4.092 0.172 9 0 "[ . 1 . 2]" 1
1669 1 69 LYS HA 1 72 ALA MB . . 3.400 2.996 2.645 3.170 . 0 0 "[ . 1 . 2]" 1
1670 1 69 LYS QB 1 70 ALA H . . 3.450 2.132 1.952 2.365 . 0 0 "[ . 1 . 2]" 1
1671 1 69 LYS QB 1 70 ALA HA . . 4.630 3.699 3.434 3.855 . 0 0 "[ . 1 . 2]" 1
1672 1 69 LYS QB 1 71 ARG H . . 4.620 4.357 4.147 4.494 . 0 0 "[ . 1 . 2]" 1
1673 1 69 LYS QB 1 72 ALA H . . 4.830 4.799 4.578 4.883 0.053 7 0 "[ . 1 . 2]" 1
1674 1 69 LYS QB 1 72 ALA MB . . 4.320 4.275 3.988 4.399 0.079 6 0 "[ . 1 . 2]" 1
1675 1 69 LYS QB 1 73 TYR H . . 5.310 4.781 4.641 4.995 . 0 0 "[ . 1 . 2]" 1
1676 1 69 LYS HG3 1 70 ALA H . . 4.710 3.902 3.699 4.094 . 0 0 "[ . 1 . 2]" 1
1677 1 70 ALA H 1 70 ALA MB . . 3.330 2.133 2.067 2.189 . 0 0 "[ . 1 . 2]" 1
1678 1 70 ALA H 1 71 ARG H . . 3.290 2.912 2.755 3.027 . 0 0 "[ . 1 . 2]" 1
1679 1 70 ALA H 1 72 ALA H . . 4.770 4.561 4.426 4.661 . 0 0 "[ . 1 . 2]" 1
1680 1 70 ALA H 1 72 ALA MB . . 5.370 5.200 5.034 5.382 0.012 2 0 "[ . 1 . 2]" 1
1681 1 70 ALA HA 1 71 ARG HA . . 5.500 4.830 4.729 4.953 . 0 0 "[ . 1 . 2]" 1
1682 1 70 ALA HA 1 72 ALA H . . 5.000 4.459 4.165 4.676 . 0 0 "[ . 1 . 2]" 1
1683 1 70 ALA HA 1 72 ALA MB . . 5.280 5.096 4.930 5.214 . 0 0 "[ . 1 . 2]" 1
1684 1 70 ALA HA 1 73 TYR H . . 3.970 3.238 2.954 3.491 . 0 0 "[ . 1 . 2]" 1
1685 1 70 ALA HA 1 73 TYR HB2 . . 4.470 2.937 2.342 3.579 . 0 0 "[ . 1 . 2]" 1
1686 1 70 ALA HA 1 73 TYR HB3 . . 3.370 2.399 2.176 2.766 . 0 0 "[ . 1 . 2]" 1
1687 1 70 ALA HA 1 74 LEU H . . 5.270 4.081 3.832 4.372 . 0 0 "[ . 1 . 2]" 1
1688 1 70 ALA MB 1 71 ARG H . . 3.720 2.875 2.683 3.027 . 0 0 "[ . 1 . 2]" 1
1689 1 70 ALA MB 1 71 ARG HA . . 5.410 4.042 3.865 4.158 . 0 0 "[ . 1 . 2]" 1
1690 1 70 ALA MB 1 71 ARG HB3 . . 5.500 5.123 4.876 5.279 . 0 0 "[ . 1 . 2]" 1
1691 1 70 ALA MB 1 72 ALA H . . 5.130 4.736 4.599 4.879 . 0 0 "[ . 1 . 2]" 1
1692 1 70 ALA MB 1 73 TYR H . . 5.250 4.433 4.206 4.737 . 0 0 "[ . 1 . 2]" 1
1693 1 70 ALA MB 1 73 TYR HB3 . . 4.630 3.788 3.540 4.054 . 0 0 "[ . 1 . 2]" 1
1694 1 70 ALA MB 1 74 LEU H . . 5.500 4.615 4.365 4.967 . 0 0 "[ . 1 . 2]" 1
1695 1 70 ALA MB 1 74 LEU MD1 . . 5.500 3.901 3.505 4.573 . 0 0 "[ . 1 . 2]" 1
1696 1 71 ARG H 1 71 ARG HB2 . . 3.480 2.321 2.121 2.532 . 0 0 "[ . 1 . 2]" 1
1697 1 71 ARG H 1 71 ARG HB3 . . 2.990 2.774 2.562 2.973 . 0 0 "[ . 1 . 2]" 1
1698 1 71 ARG H 1 71 ARG HD3 . . 5.040 4.594 4.232 5.147 0.107 11 0 "[ . 1 . 2]" 1
1699 1 71 ARG H 1 72 ALA H . . 3.490 2.531 2.321 2.773 . 0 0 "[ . 1 . 2]" 1
1700 1 71 ARG H 1 72 ALA MB . . 4.670 4.118 3.874 4.390 . 0 0 "[ . 1 . 2]" 1
1701 1 71 ARG H 1 73 TYR H . . 4.870 3.659 3.458 3.952 . 0 0 "[ . 1 . 2]" 1
1702 1 71 ARG H 1 73 TYR HB3 . . 5.170 4.909 4.689 5.178 0.008 14 0 "[ . 1 . 2]" 1
1703 1 71 ARG H 1 74 LEU H . . 5.200 4.758 4.590 5.059 . 0 0 "[ . 1 . 2]" 1
1704 1 71 ARG H 1 74 LEU MD1 . . 5.500 5.491 5.101 5.754 0.254 5 0 "[ . 1 . 2]" 1
1705 1 71 ARG HA 1 71 ARG HB3 . . 3.010 3.025 2.985 3.072 0.062 6 0 "[ . 1 . 2]" 1
1706 1 71 ARG HA 1 71 ARG HD3 . . 3.710 3.699 3.590 3.801 0.091 17 0 "[ . 1 . 2]" 1
1707 1 71 ARG HA 1 73 TYR H . . 4.850 4.057 3.837 4.425 . 0 0 "[ . 1 . 2]" 1
1708 1 71 ARG HA 1 74 LEU H . . 3.920 3.557 3.363 3.724 . 0 0 "[ . 1 . 2]" 1
1709 1 71 ARG HA 1 74 LEU MD1 . . 5.500 3.972 3.674 4.289 . 0 0 "[ . 1 . 2]" 1
1710 1 71 ARG HA 1 74 LEU MD2 . . 4.190 3.208 2.602 3.992 . 0 0 "[ . 1 . 2]" 1
1711 1 71 ARG HA 1 75 GLU H . . 5.030 5.067 4.873 5.212 0.182 13 0 "[ . 1 . 2]" 1
1712 1 71 ARG HB2 1 72 ALA H . . 3.960 3.619 3.488 3.741 . 0 0 "[ . 1 . 2]" 1
1713 1 71 ARG HB3 1 72 ALA H . . 3.270 2.604 2.387 2.832 . 0 0 "[ . 1 . 2]" 1
1714 1 71 ARG HB3 1 72 ALA MB . . 3.970 3.617 3.448 3.824 . 0 0 "[ . 1 . 2]" 1
1715 1 71 ARG HB3 1 73 TYR H . . 4.710 4.765 4.719 4.867 0.157 13 0 "[ . 1 . 2]" 1
1716 1 71 ARG HE 1 72 ALA MB . . 5.500 5.535 5.357 5.602 0.102 11 0 "[ . 1 . 2]" 1
1717 1 72 ALA H 1 72 ALA MB . . 3.040 2.148 2.094 2.187 . 0 0 "[ . 1 . 2]" 1
1718 1 72 ALA H 1 73 TYR H . . 3.360 2.487 2.241 2.795 . 0 0 "[ . 1 . 2]" 1
1719 1 72 ALA H 1 73 TYR HB2 . . 5.110 4.865 4.664 5.114 0.004 9 0 "[ . 1 . 2]" 1
1720 1 72 ALA H 1 74 LEU H . . 4.760 4.237 3.786 4.600 . 0 0 "[ . 1 . 2]" 1
1721 1 72 ALA H 1 75 GLU HG3 . . 5.500 5.489 5.197 5.799 0.299 13 0 "[ . 1 . 2]" 1
1722 1 72 ALA HA 1 75 GLU H . . 3.840 3.565 3.285 3.860 0.020 10 0 "[ . 1 . 2]" 1
1723 1 72 ALA HA 1 75 GLU HG2 . . 3.870 2.775 2.327 3.129 . 0 0 "[ . 1 . 2]" 1
1724 1 72 ALA HA 1 75 GLU HG3 . . 4.370 2.715 2.382 2.940 . 0 0 "[ . 1 . 2]" 1
1725 1 72 ALA MB 1 73 TYR H . . 3.610 2.960 2.632 3.098 . 0 0 "[ . 1 . 2]" 1
1726 1 72 ALA MB 1 73 TYR HA . . 4.500 4.183 4.038 4.347 . 0 0 "[ . 1 . 2]" 1
1727 1 72 ALA MB 1 73 TYR HB2 . . 4.490 4.422 4.160 4.513 0.023 18 0 "[ . 1 . 2]" 1
1728 1 73 TYR H 1 73 TYR HB3 . . 3.110 2.534 2.199 2.787 . 0 0 "[ . 1 . 2]" 1
1729 1 73 TYR H 1 73 TYR QD . . 4.530 4.152 3.828 4.311 . 0 0 "[ . 1 . 2]" 1
1730 1 73 TYR H 1 74 LEU H . . 3.110 2.509 2.208 2.719 . 0 0 "[ . 1 . 2]" 1
1731 1 73 TYR H 1 74 LEU HA . . 5.080 5.079 4.865 5.212 0.132 3 0 "[ . 1 . 2]" 1
1732 1 73 TYR H 1 74 LEU MD1 . . 5.500 4.849 4.338 5.579 0.079 2 0 "[ . 1 . 2]" 1
1733 1 73 TYR H 1 74 LEU MD2 . . 5.500 4.974 3.698 5.536 0.036 19 0 "[ . 1 . 2]" 1
1734 1 73 TYR H 1 75 GLU HG3 . . 5.500 5.255 4.805 5.529 0.029 20 0 "[ . 1 . 2]" 1
1735 1 73 TYR HA 1 73 TYR HB2 . . 3.020 2.409 2.320 2.511 . 0 0 "[ . 1 . 2]" 1
1736 1 73 TYR HA 1 73 TYR QD . . 3.080 2.896 2.490 3.139 0.059 10 0 "[ . 1 . 2]" 1
1737 1 73 TYR HA 1 76 THR HB . . 4.780 3.014 1.978 4.853 0.073 10 0 "[ . 1 . 2]" 1
1738 1 73 TYR HA 1 76 THR MG . . 4.260 3.929 2.264 4.353 0.093 3 0 "[ . 1 . 2]" 1
1739 1 73 TYR HB3 1 74 LEU H . . 3.630 2.629 2.377 3.018 . 0 0 "[ . 1 . 2]" 1
1740 1 73 TYR HB3 1 74 LEU MD2 . . 5.500 4.531 2.939 5.498 . 0 0 "[ . 1 . 2]" 1
1741 1 73 TYR HB3 1 75 GLU H . . 5.160 5.108 4.995 5.221 0.061 9 0 "[ . 1 . 2]" 1
1742 1 73 TYR QD 1 74 LEU H . . 3.800 3.286 2.742 3.560 . 0 0 "[ . 1 . 2]" 1
1743 1 73 TYR QD 1 74 LEU HA . . 3.800 3.027 2.747 3.737 . 0 0 "[ . 1 . 2]" 1
1744 1 73 TYR QD 1 74 LEU MD1 . . 4.160 3.147 2.521 4.366 0.206 2 0 "[ . 1 . 2]" 1
1745 1 73 TYR QE 1 74 LEU HA . . 4.480 4.337 3.358 4.666 0.186 13 0 "[ . 1 . 2]" 1
1746 1 73 TYR QE 1 74 LEU MD1 . . 4.640 4.330 3.635 4.781 0.141 9 0 "[ . 1 . 2]" 1
1747 1 74 LEU H 1 74 LEU HB2 . . 3.660 1.961 1.794 2.075 . 0 0 "[ . 1 . 2]" 1
1748 1 74 LEU H 1 74 LEU HB3 . . 3.190 3.253 3.139 3.394 0.204 20 0 "[ . 1 . 2]" 1
1749 1 74 LEU H 1 74 LEU MD1 . . 4.820 3.002 2.533 3.894 . 0 0 "[ . 1 . 2]" 1
1750 1 74 LEU H 1 74 LEU MD2 . . 4.770 3.330 2.328 3.813 . 0 0 "[ . 1 . 2]" 1
1751 1 74 LEU H 1 75 GLU H . . 3.490 2.911 2.697 3.046 . 0 0 "[ . 1 . 2]" 1
1752 1 74 LEU H 1 76 THR H . . 4.400 4.131 3.826 4.394 . 0 0 "[ . 1 . 2]" 1
1753 1 74 LEU HA 1 74 LEU MD1 . . 3.610 2.178 1.919 2.755 . 0 0 "[ . 1 . 2]" 1
1754 1 74 LEU HA 1 74 LEU MD2 . . 4.210 3.348 1.964 3.858 . 0 0 "[ . 1 . 2]" 1
1755 1 74 LEU HA 1 76 THR H . . 4.750 3.948 3.567 4.251 . 0 0 "[ . 1 . 2]" 1
1756 1 74 LEU HB2 1 75 GLU H . . 3.820 3.155 2.551 3.541 . 0 0 "[ . 1 . 2]" 1
1757 1 74 LEU HB2 1 75 GLU HG3 . . 5.500 5.369 4.617 5.788 0.288 16 0 "[ . 1 . 2]" 1
1758 1 74 LEU HB2 1 76 THR H . . 5.230 5.101 4.603 5.294 0.064 16 0 "[ . 1 . 2]" 1
1759 1 74 LEU HB3 1 74 LEU MD1 . . 3.660 2.946 1.994 3.326 . 0 0 "[ . 1 . 2]" 1
1760 1 74 LEU HB3 1 74 LEU MD2 . . 3.620 2.640 2.328 3.173 . 0 0 "[ . 1 . 2]" 1
1761 1 74 LEU HB3 1 75 GLU H . . 3.660 3.150 2.841 3.456 . 0 0 "[ . 1 . 2]" 1
1762 1 74 LEU HB3 1 75 GLU HG3 . . 5.500 5.374 4.938 5.581 0.081 8 0 "[ . 1 . 2]" 1
1763 1 74 LEU HB3 1 76 THR H . . 5.320 5.056 4.785 5.309 . 0 0 "[ . 1 . 2]" 1
1764 1 74 LEU MD1 1 75 GLU H . . 5.490 4.597 4.443 4.771 . 0 0 "[ . 1 . 2]" 1
1765 1 74 LEU MD1 1 76 THR H . . 5.500 5.445 5.094 5.656 0.156 2 0 "[ . 1 . 2]" 1
1766 1 74 LEU MD2 1 75 GLU H . . 5.350 4.753 4.256 5.070 . 0 0 "[ . 1 . 2]" 1
1767 1 74 LEU MD2 1 75 GLU HG2 . . 5.500 5.359 4.818 5.580 0.080 9 0 "[ . 1 . 2]" 1
1768 1 75 GLU H 1 75 GLU HB2 . . 3.960 3.681 3.538 3.798 . 0 0 "[ . 1 . 2]" 1
1769 1 75 GLU H 1 75 GLU HB3 . . 3.260 3.182 2.871 3.272 0.012 19 0 "[ . 1 . 2]" 1
1770 1 75 GLU H 1 75 GLU HG2 . . 3.390 2.091 1.720 2.423 . 0 0 "[ . 1 . 2]" 1
1771 1 75 GLU H 1 75 GLU HG3 . . 3.630 2.704 2.357 3.144 . 0 0 "[ . 1 . 2]" 1
1772 1 75 GLU H 1 76 THR H . . 3.160 2.453 2.267 2.729 . 0 0 "[ . 1 . 2]" 1
1773 1 75 GLU H 1 76 THR MG . . 5.500 5.319 3.624 5.626 0.126 4 0 "[ . 1 . 2]" 1
1774 1 75 GLU HA 1 75 GLU HB2 . . 2.810 2.554 2.400 2.651 . 0 0 "[ . 1 . 2]" 1
1775 1 75 GLU HA 1 75 GLU HG2 . . 3.830 3.698 3.555 3.963 0.133 13 0 "[ . 1 . 2]" 1
1776 1 75 GLU HA 1 75 GLU HG3 . . 4.000 3.885 3.743 4.004 0.004 20 0 "[ . 1 . 2]" 1
1777 1 75 GLU HB3 1 76 THR H . . 4.570 4.585 4.417 4.675 0.105 20 0 "[ . 1 . 2]" 1
1778 1 75 GLU HG2 1 76 THR H . . 4.120 4.157 3.800 4.449 0.329 16 0 "[ . 1 . 2]" 1
1779 1 75 GLU HG3 1 76 THR H . . 4.880 3.725 3.048 4.456 . 0 0 "[ . 1 . 2]" 1
1780 1 76 THR H 1 76 THR HB . . 3.450 2.807 2.167 3.356 . 0 0 "[ . 1 . 2]" 1
1781 1 76 THR H 1 76 THR MG . . 3.900 3.670 2.225 3.981 0.081 5 0 "[ . 1 . 2]" 1
1782 1 76 THR H 1 77 LYS H . . 3.720 3.572 3.048 3.981 0.261 3 0 "[ . 1 . 2]" 1
1783 1 76 THR HA 1 76 THR MG . . 3.260 2.434 2.138 3.259 . 0 0 "[ . 1 . 2]" 1
1784 1 76 THR HA 1 77 LYS H . . 2.740 2.170 1.795 2.858 0.118 20 0 "[ . 1 . 2]" 1
1785 1 76 THR HA 1 77 LYS HE2 . . 5.500 4.828 2.746 5.613 0.113 11 0 "[ . 1 . 2]" 1
1786 1 76 THR MG 1 77 LYS H . . 3.950 3.394 2.444 4.035 0.085 10 0 "[ . 1 . 2]" 1
1787 1 76 THR MG 1 77 LYS HB2 . . 4.020 3.509 2.472 4.169 0.149 8 0 "[ . 1 . 2]" 1
1788 1 76 THR MG 1 77 LYS HB3 . . 5.500 4.592 2.895 5.479 . 0 0 "[ . 1 . 2]" 1
1789 1 76 THR MG 1 77 LYS HD2 . . 5.240 3.983 2.067 5.249 0.009 4 0 "[ . 1 . 2]" 1
1790 1 76 THR MG 1 77 LYS HD3 . . 3.920 3.298 2.506 3.954 0.034 1 0 "[ . 1 . 2]" 1
1791 1 76 THR MG 1 77 LYS HE2 . . 5.500 4.174 2.031 5.566 0.066 3 0 "[ . 1 . 2]" 1
1792 1 77 LYS H 1 77 LYS HB2 . . 3.230 3.157 2.387 3.497 0.267 15 0 "[ . 1 . 2]" 1
1793 1 77 LYS H 1 77 LYS HD3 . . 3.890 2.964 1.587 3.946 0.056 20 0 "[ . 1 . 2]" 1
1794 1 77 LYS HA 1 77 LYS HD3 . . 3.910 3.592 2.392 4.086 0.176 17 0 "[ . 1 . 2]" 1
1795 1 77 LYS HB2 1 77 LYS HE2 . . 5.500 4.011 2.093 4.830 . 0 0 "[ . 1 . 2]" 1
1796 1 77 LYS HB2 1 77 LYS HE3 . . 5.500 4.100 1.937 4.879 . 0 0 "[ . 1 . 2]" 1
1797 1 77 LYS HB3 1 77 LYS HD3 . . 3.860 3.582 1.959 3.909 0.049 4 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Friday, May 10, 2024 10:57:43 AM GMT (wattos1)