NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
597229 |
2mzq   |
25496 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mzq
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 2343
_Distance_constraint_stats_list.Viol_count 3506
_Distance_constraint_stats_list.Viol_total 2422.968
_Distance_constraint_stats_list.Viol_max 0.192
_Distance_constraint_stats_list.Viol_rms 0.0121
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0026
_Distance_constraint_stats_list.Viol_average_violations_only 0.0346
_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 3 HIS 0.531 0.057 7 0 "[ . 1 . 2]"
1 4 ILE 0.295 0.056 16 0 "[ . 1 . 2]"
1 5 ASP 1.510 0.095 10 0 "[ . 1 . 2]"
1 6 GLU 1.067 0.095 10 0 "[ . 1 . 2]"
1 7 THR 2.647 0.097 11 0 "[ . 1 . 2]"
1 8 ALA 2.105 0.097 11 0 "[ . 1 . 2]"
1 9 ALA 1.629 0.078 5 0 "[ . 1 . 2]"
1 10 LYS 1.146 0.051 1 0 "[ . 1 . 2]"
1 11 PHE 6.553 0.098 7 0 "[ . 1 . 2]"
1 12 THR 3.968 0.106 6 0 "[ . 1 . 2]"
1 13 GLU 3.107 0.112 4 0 "[ . 1 . 2]"
1 14 GLY 3.140 0.122 10 0 "[ . 1 . 2]"
1 15 VAL 8.978 0.122 10 0 "[ . 1 . 2]"
1 16 ASN 4.870 0.098 12 0 "[ . 1 . 2]"
1 17 PRO 0.761 0.045 6 0 "[ . 1 . 2]"
1 18 GLY 0.051 0.021 1 0 "[ . 1 . 2]"
1 19 GLY 2.265 0.140 18 0 "[ . 1 . 2]"
1 20 ASP 0.852 0.107 8 0 "[ . 1 . 2]"
1 21 ARG 3.132 0.156 18 0 "[ . 1 . 2]"
1 22 ASN 4.469 0.140 18 0 "[ . 1 . 2]"
1 23 CYS 3.277 0.112 18 0 "[ . 1 . 2]"
1 24 PHE 6.830 0.131 17 0 "[ . 1 . 2]"
1 25 ILE 2.952 0.069 5 0 "[ . 1 . 2]"
1 26 TYR 2.919 0.091 14 0 "[ . 1 . 2]"
1 27 CYS 1.290 0.058 2 0 "[ . 1 . 2]"
1 28 SER 0.244 0.039 11 0 "[ . 1 . 2]"
1 29 ASN 0.880 0.058 15 0 "[ . 1 . 2]"
1 30 LEU 4.452 0.082 11 0 "[ . 1 . 2]"
1 31 PRO 0.415 0.049 5 0 "[ . 1 . 2]"
1 32 PHE 0.417 0.034 14 0 "[ . 1 . 2]"
1 33 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 THR 2.278 0.088 12 0 "[ . 1 . 2]"
1 35 ALA 0.488 0.047 20 0 "[ . 1 . 2]"
1 36 ARG 0.792 0.057 18 0 "[ . 1 . 2]"
1 37 SER 0.207 0.033 18 0 "[ . 1 . 2]"
1 38 ASP 1.929 0.088 12 0 "[ . 1 . 2]"
1 39 LEU 1.878 0.047 20 0 "[ . 1 . 2]"
1 40 PHE 0.927 0.039 10 0 "[ . 1 . 2]"
1 41 ASP 2.461 0.111 5 0 "[ . 1 . 2]"
1 42 LEU 2.547 0.055 4 0 "[ . 1 . 2]"
1 43 PHE 6.846 0.111 5 0 "[ . 1 . 2]"
1 44 GLY 0.218 0.032 10 0 "[ . 1 . 2]"
1 45 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 ILE 1.887 0.098 20 0 "[ . 1 . 2]"
1 47 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 LYS 1.055 0.162 3 0 "[ . 1 . 2]"
1 49 ILE 3.876 0.162 3 0 "[ . 1 . 2]"
1 50 ASN 2.289 0.132 17 0 "[ . 1 . 2]"
1 51 ASN 3.126 0.082 17 0 "[ . 1 . 2]"
1 52 ALA 1.980 0.082 17 0 "[ . 1 . 2]"
1 53 GLU 1.836 0.048 12 0 "[ . 1 . 2]"
1 54 LEU 3.390 0.106 6 0 "[ . 1 . 2]"
1 55 LYS 2.999 0.068 18 0 "[ . 1 . 2]"
1 56 PRO 0.685 0.034 10 0 "[ . 1 . 2]"
1 57 GLN 3.153 0.140 20 0 "[ . 1 . 2]"
1 58 GLU 0.326 0.041 12 0 "[ . 1 . 2]"
1 59 ASN 0.469 0.075 13 0 "[ . 1 . 2]"
1 60 GLY 0.085 0.054 2 0 "[ . 1 . 2]"
1 61 GLN 0.739 0.075 13 0 "[ . 1 . 2]"
1 62 PRO 0.046 0.009 2 0 "[ . 1 . 2]"
1 63 THR 0.497 0.030 6 0 "[ . 1 . 2]"
1 64 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 VAL 2.329 0.068 18 0 "[ . 1 . 2]"
1 66 ALA 1.374 0.082 11 0 "[ . 1 . 2]"
1 67 VAL 2.573 0.080 1 0 "[ . 1 . 2]"
1 68 VAL 3.673 0.085 18 0 "[ . 1 . 2]"
1 69 GLU 2.260 0.084 4 0 "[ . 1 . 2]"
1 70 TYR 4.376 0.118 16 0 "[ . 1 . 2]"
1 71 GLU 4.150 0.132 17 0 "[ . 1 . 2]"
1 72 ASN 2.287 0.088 18 0 "[ . 1 . 2]"
1 73 LEU 2.805 0.092 14 0 "[ . 1 . 2]"
1 74 VAL 1.748 0.082 5 0 "[ . 1 . 2]"
1 75 ASP 0.583 0.054 11 0 "[ . 1 . 2]"
1 76 ALA 6.988 0.156 18 0 "[ . 1 . 2]"
1 77 ASP 2.329 0.192 14 0 "[ . 1 . 2]"
1 78 PHE 1.770 0.091 20 0 "[ . 1 . 2]"
1 79 CYS 1.660 0.113 20 0 "[ . 1 . 2]"
1 80 ILE 1.630 0.101 14 0 "[ . 1 . 2]"
1 81 GLN 1.881 0.060 20 0 "[ . 1 . 2]"
1 82 LYS 3.579 0.182 1 0 "[ . 1 . 2]"
1 83 LEU 5.153 0.124 20 0 "[ . 1 . 2]"
1 84 ASN 0.322 0.031 11 0 "[ . 1 . 2]"
1 85 ASN 0.779 0.037 20 0 "[ . 1 . 2]"
1 86 TYR 3.225 0.081 10 0 "[ . 1 . 2]"
1 87 ASN 0.305 0.037 20 0 "[ . 1 . 2]"
1 88 TYR 1.127 0.042 20 0 "[ . 1 . 2]"
1 89 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 GLY 0.071 0.013 8 0 "[ . 1 . 2]"
1 91 CYS 0.033 0.007 5 0 "[ . 1 . 2]"
1 92 SER 0.008 0.005 9 0 "[ . 1 . 2]"
1 93 LEU 1.588 0.049 5 0 "[ . 1 . 2]"
1 94 GLN 0.914 0.079 2 0 "[ . 1 . 2]"
1 95 ILE 4.561 0.066 19 0 "[ . 1 . 2]"
1 96 SER 1.389 0.060 13 0 "[ . 1 . 2]"
1 97 TYR 2.264 0.192 14 0 "[ . 1 . 2]"
1 98 ALA 3.590 0.091 14 0 "[ . 1 . 2]"
1 99 ARG 5.761 0.117 6 0 "[ . 1 . 2]"
1 100 ARG 10.698 0.185 8 0 "[ . 1 . 2]"
1 101 ASP 4.504 0.098 12 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 3 HIS QB 1 4 ILE MG . . 5.050 4.777 4.039 5.083 0.033 6 0 "[ . 1 . 2]" 1
2 1 3 HIS QB 1 5 ASP H . . 5.810 4.799 2.740 5.843 0.033 8 0 "[ . 1 . 2]" 1
3 1 3 HIS HD2 1 4 ILE H . . 6.000 4.900 3.989 6.000 0.000 14 0 "[ . 1 . 2]" 1
4 1 3 HIS HE1 1 5 ASP QB . . 5.810 4.516 2.198 5.850 0.040 8 0 "[ . 1 . 2]" 1
5 1 3 HIS HE1 1 6 GLU HA . . 5.010 4.420 2.303 5.049 0.039 16 0 "[ . 1 . 2]" 1
6 1 3 HIS HE1 1 7 THR MG . . 5.220 4.660 3.360 5.277 0.057 7 0 "[ . 1 . 2]" 1
7 1 4 ILE H 1 4 ILE HB . . 4.210 3.376 2.389 4.030 . 0 0 "[ . 1 . 2]" 1
8 1 4 ILE H 1 4 ILE MD . . 5.330 3.997 1.920 5.141 . 0 0 "[ . 1 . 2]" 1
9 1 4 ILE H 1 4 ILE HG12 . . 4.980 4.229 2.319 5.000 0.020 12 0 "[ . 1 . 2]" 1
10 1 4 ILE H 1 4 ILE HG13 . . 4.980 4.288 2.285 4.834 . 0 0 "[ . 1 . 2]" 1
11 1 4 ILE H 1 5 ASP H . . 5.480 2.660 1.867 4.566 . 0 0 "[ . 1 . 2]" 1
12 1 4 ILE HA 1 4 ILE MD . . 3.780 3.409 2.121 3.761 . 0 0 "[ . 1 . 2]" 1
13 1 4 ILE HA 1 4 ILE QG . . 3.610 2.813 2.249 3.583 . 0 0 "[ . 1 . 2]" 1
14 1 4 ILE HB 1 4 ILE MD . . 3.370 2.616 2.327 3.303 . 0 0 "[ . 1 . 2]" 1
15 1 4 ILE QG 1 4 ILE MG . . 2.950 2.281 2.077 2.426 . 0 0 "[ . 1 . 2]" 1
16 1 4 ILE QG 1 5 ASP H . . 4.840 3.809 1.844 4.793 . 0 0 "[ . 1 . 2]" 1
17 1 4 ILE HG12 1 4 ILE MG . . 3.500 2.597 2.288 3.256 . 0 0 "[ . 1 . 2]" 1
18 1 4 ILE HG13 1 4 ILE MG . . 3.500 2.825 2.301 3.271 . 0 0 "[ . 1 . 2]" 1
19 1 4 ILE MG 1 5 ASP H . . 4.520 3.167 2.038 4.377 . 0 0 "[ . 1 . 2]" 1
20 1 4 ILE MG 1 5 ASP HB2 . . 6.000 4.356 2.729 6.056 0.056 16 0 "[ . 1 . 2]" 1
21 1 4 ILE MG 1 5 ASP HB3 . . 6.000 4.866 2.748 6.055 0.055 10 0 "[ . 1 . 2]" 1
22 1 5 ASP H 1 5 ASP HB2 . . 4.150 2.963 2.403 3.978 . 0 0 "[ . 1 . 2]" 1
23 1 5 ASP H 1 5 ASP QB . . 3.620 2.726 2.274 3.423 . 0 0 "[ . 1 . 2]" 1
24 1 5 ASP H 1 5 ASP HB3 . . 4.150 3.515 2.390 4.074 . 0 0 "[ . 1 . 2]" 1
25 1 5 ASP H 1 6 GLU H . . 4.270 2.968 2.001 4.365 0.095 10 0 "[ . 1 . 2]" 1
26 1 5 ASP HA 1 6 GLU QB . . 5.620 5.058 4.250 5.556 . 0 0 "[ . 1 . 2]" 1
27 1 5 ASP HA 1 7 THR H . . 3.930 3.741 3.252 3.981 0.051 1 0 "[ . 1 . 2]" 1
28 1 5 ASP QB 1 6 GLU HA . . 5.810 4.272 3.689 5.082 . 0 0 "[ . 1 . 2]" 1
29 1 5 ASP QB 1 6 GLU QG . . 5.070 4.868 3.440 5.107 0.037 9 0 "[ . 1 . 2]" 1
30 1 5 ASP QB 1 8 ALA H . . 4.690 4.338 3.500 4.737 0.047 19 0 "[ . 1 . 2]" 1
31 1 5 ASP QB 1 8 ALA MB . . 5.100 3.992 3.100 4.783 . 0 0 "[ . 1 . 2]" 1
32 1 5 ASP HB2 1 8 ALA H . . 5.520 5.182 3.992 5.578 0.058 17 0 "[ . 1 . 2]" 1
33 1 5 ASP HB3 1 8 ALA H . . 5.520 4.724 3.827 5.583 0.063 16 0 "[ . 1 . 2]" 1
34 1 6 GLU H 1 6 GLU HB2 . . 3.830 3.147 2.248 3.627 . 0 0 "[ . 1 . 2]" 1
35 1 6 GLU H 1 6 GLU HB3 . . 3.830 2.705 2.390 3.641 . 0 0 "[ . 1 . 2]" 1
36 1 6 GLU H 1 6 GLU HG2 . . 5.140 3.074 2.066 4.550 . 0 0 "[ . 1 . 2]" 1
37 1 6 GLU H 1 6 GLU QG . . 4.310 2.608 1.964 3.954 . 0 0 "[ . 1 . 2]" 1
38 1 6 GLU H 1 6 GLU HG3 . . 5.140 3.326 1.976 4.415 . 0 0 "[ . 1 . 2]" 1
39 1 6 GLU H 1 7 THR H . . 4.610 2.836 2.575 3.104 . 0 0 "[ . 1 . 2]" 1
40 1 6 GLU HA 1 9 ALA MB . . 3.640 3.551 2.885 3.672 0.032 7 0 "[ . 1 . 2]" 1
41 1 6 GLU QB 1 7 THR H . . 4.000 3.480 2.588 3.928 . 0 0 "[ . 1 . 2]" 1
42 1 6 GLU QB 1 9 ALA MB . . 5.140 3.837 3.146 4.550 . 0 0 "[ . 1 . 2]" 1
43 1 6 GLU HB2 1 7 THR H . . 4.810 3.998 2.648 4.380 . 0 0 "[ . 1 . 2]" 1
44 1 6 GLU HB2 1 9 ALA H . . 6.000 5.036 4.253 5.942 . 0 0 "[ . 1 . 2]" 1
45 1 6 GLU HB2 1 9 ALA MB . . 5.840 4.232 3.208 5.669 . 0 0 "[ . 1 . 2]" 1
46 1 6 GLU HB3 1 7 THR H . . 4.810 3.982 2.852 4.473 . 0 0 "[ . 1 . 2]" 1
47 1 6 GLU HB3 1 9 ALA H . . 6.000 5.471 4.681 5.874 . 0 0 "[ . 1 . 2]" 1
48 1 6 GLU HB3 1 9 ALA MB . . 5.840 4.744 3.815 5.226 . 0 0 "[ . 1 . 2]" 1
49 1 6 GLU QG 1 7 THR H . . 4.110 3.405 2.655 4.144 0.034 3 0 "[ . 1 . 2]" 1
50 1 6 GLU QG 1 10 LYS QE . . 5.400 4.865 3.239 5.408 0.008 8 0 "[ . 1 . 2]" 1
51 1 6 GLU HG2 1 7 THR H . . 4.920 4.039 2.848 4.940 0.020 12 0 "[ . 1 . 2]" 1
52 1 6 GLU HG3 1 7 THR H . . 4.920 3.840 2.838 5.015 0.095 13 0 "[ . 1 . 2]" 1
53 1 7 THR H 1 7 THR HB . . 3.450 2.361 2.097 2.578 . 0 0 "[ . 1 . 2]" 1
54 1 7 THR H 1 7 THR MG . . 4.350 2.914 2.157 3.810 . 0 0 "[ . 1 . 2]" 1
55 1 7 THR H 1 10 LYS QB . . 5.030 4.908 4.512 5.046 0.016 6 0 "[ . 1 . 2]" 1
56 1 7 THR HA 1 7 THR MG . . 3.350 2.964 2.390 3.279 . 0 0 "[ . 1 . 2]" 1
57 1 7 THR HA 1 9 ALA H . . 4.110 3.714 3.627 3.808 . 0 0 "[ . 1 . 2]" 1
58 1 7 THR HA 1 9 ALA MB . . 4.260 4.301 4.281 4.338 0.078 5 0 "[ . 1 . 2]" 1
59 1 7 THR HA 1 10 LYS H . . 4.730 2.961 2.760 3.099 . 0 0 "[ . 1 . 2]" 1
60 1 7 THR HA 1 10 LYS QB . . 4.200 2.374 2.112 2.578 . 0 0 "[ . 1 . 2]" 1
61 1 7 THR HA 1 10 LYS QE . . 5.170 3.544 2.056 5.104 . 0 0 "[ . 1 . 2]" 1
62 1 7 THR HB 1 8 ALA H . . 3.900 3.677 3.006 3.997 0.097 11 0 "[ . 1 . 2]" 1
63 1 7 THR MG 1 8 ALA H . . 4.220 2.998 2.331 3.972 . 0 0 "[ . 1 . 2]" 1
64 1 7 THR MG 1 8 ALA MB . . 4.480 3.756 3.200 4.499 0.019 19 0 "[ . 1 . 2]" 1
65 1 7 THR MG 1 10 LYS H . . 5.220 4.790 4.261 5.192 . 0 0 "[ . 1 . 2]" 1
66 1 7 THR MG 1 11 PHE H . . 5.220 4.296 3.536 4.824 . 0 0 "[ . 1 . 2]" 1
67 1 7 THR MG 1 11 PHE QB . . 4.940 3.663 2.981 4.158 . 0 0 "[ . 1 . 2]" 1
68 1 7 THR MG 1 51 ASN QD . . 4.510 4.118 3.747 4.502 . 0 0 "[ . 1 . 2]" 1
69 1 8 ALA H 1 8 ALA MB . . 3.440 2.218 2.200 2.254 . 0 0 "[ . 1 . 2]" 1
70 1 8 ALA H 1 9 ALA H . . 4.890 2.742 2.588 2.846 . 0 0 "[ . 1 . 2]" 1
71 1 8 ALA HA 1 11 PHE H . . 4.280 3.304 3.227 3.451 . 0 0 "[ . 1 . 2]" 1
72 1 8 ALA HA 1 11 PHE QB . . 4.330 2.384 2.215 2.527 . 0 0 "[ . 1 . 2]" 1
73 1 8 ALA HA 1 11 PHE QD . . 5.920 4.246 4.049 4.405 . 0 0 "[ . 1 . 2]" 1
74 1 8 ALA HA 1 53 GLU QB . . 4.550 4.279 3.884 4.456 . 0 0 "[ . 1 . 2]" 1
75 1 8 ALA HA 1 53 GLU QG . . 3.860 2.600 2.325 2.769 . 0 0 "[ . 1 . 2]" 1
76 1 8 ALA MB 1 9 ALA H . . 3.910 2.990 2.924 3.094 . 0 0 "[ . 1 . 2]" 1
77 1 8 ALA MB 1 9 ALA HA . . 5.990 4.199 4.105 4.292 . 0 0 "[ . 1 . 2]" 1
78 1 8 ALA MB 1 11 PHE H . . 5.130 4.606 4.535 4.724 . 0 0 "[ . 1 . 2]" 1
79 1 8 ALA MB 1 11 PHE HB2 . . 4.440 4.464 4.451 4.479 0.039 12 0 "[ . 1 . 2]" 1
80 1 8 ALA MB 1 11 PHE QB . . 3.880 3.671 3.581 3.767 . 0 0 "[ . 1 . 2]" 1
81 1 8 ALA MB 1 11 PHE HB3 . . 4.440 3.906 3.771 4.064 . 0 0 "[ . 1 . 2]" 1
82 1 8 ALA MB 1 53 GLU QB . . 3.710 3.560 2.970 3.728 0.018 14 0 "[ . 1 . 2]" 1
83 1 9 ALA H 1 9 ALA MB . . 3.430 2.232 2.175 2.262 . 0 0 "[ . 1 . 2]" 1
84 1 9 ALA H 1 10 LYS H . . 4.170 2.474 2.443 2.514 . 0 0 "[ . 1 . 2]" 1
85 1 9 ALA H 1 10 LYS HA . . 5.100 5.125 5.106 5.151 0.051 1 0 "[ . 1 . 2]" 1
86 1 9 ALA H 1 10 LYS QB . . 4.560 4.102 4.003 4.192 . 0 0 "[ . 1 . 2]" 1
87 1 9 ALA H 1 11 PHE H . . 6.000 3.820 3.676 3.960 . 0 0 "[ . 1 . 2]" 1
88 1 9 ALA HA 1 12 THR H . . 4.750 3.624 3.396 3.855 . 0 0 "[ . 1 . 2]" 1
89 1 9 ALA HA 1 12 THR MG . . 6.000 4.809 4.526 5.052 . 0 0 "[ . 1 . 2]" 1
90 1 9 ALA HA 1 56 PRO QG . . 4.190 3.257 2.843 3.793 . 0 0 "[ . 1 . 2]" 1
91 1 9 ALA MB 1 10 LYS H . . 3.740 2.361 2.268 2.498 . 0 0 "[ . 1 . 2]" 1
92 1 9 ALA MB 1 10 LYS QB . . 3.840 3.739 3.556 3.884 0.044 9 0 "[ . 1 . 2]" 1
93 1 9 ALA MB 1 11 PHE H . . 5.130 4.419 4.346 4.528 . 0 0 "[ . 1 . 2]" 1
94 1 9 ALA MB 1 12 THR H . . 5.170 4.588 4.488 4.677 . 0 0 "[ . 1 . 2]" 1
95 1 9 ALA MB 1 56 PRO QD . . 5.060 4.583 4.065 4.973 . 0 0 "[ . 1 . 2]" 1
96 1 9 ALA MB 1 56 PRO QG . . 3.840 3.416 2.786 3.852 0.012 7 0 "[ . 1 . 2]" 1
97 1 10 LYS H 1 10 LYS QB . . 3.190 2.112 1.988 2.165 . 0 0 "[ . 1 . 2]" 1
98 1 10 LYS H 1 10 LYS QD . . 4.880 3.971 2.366 4.817 . 0 0 "[ . 1 . 2]" 1
99 1 10 LYS H 1 10 LYS QE . . 3.790 3.316 2.253 3.836 0.046 15 0 "[ . 1 . 2]" 1
100 1 10 LYS H 1 10 LYS HG2 . . 4.660 4.372 3.967 4.568 . 0 0 "[ . 1 . 2]" 1
101 1 10 LYS H 1 10 LYS QG . . 4.010 3.837 3.537 4.037 0.027 8 0 "[ . 1 . 2]" 1
102 1 10 LYS H 1 10 LYS HG3 . . 4.660 4.257 3.928 4.527 . 0 0 "[ . 1 . 2]" 1
103 1 10 LYS H 1 11 PHE H . . 4.470 2.791 2.730 2.889 . 0 0 "[ . 1 . 2]" 1
104 1 10 LYS H 1 11 PHE HB2 . . 6.000 4.981 4.889 5.104 . 0 0 "[ . 1 . 2]" 1
105 1 10 LYS H 1 11 PHE HB3 . . 6.000 4.908 4.838 5.010 . 0 0 "[ . 1 . 2]" 1
106 1 10 LYS H 1 12 THR H . . 6.000 4.294 4.221 4.360 . 0 0 "[ . 1 . 2]" 1
107 1 10 LYS HA 1 10 LYS QD . . 4.300 3.257 2.158 4.233 . 0 0 "[ . 1 . 2]" 1
108 1 10 LYS HA 1 10 LYS QE . . 5.810 3.384 1.938 4.454 . 0 0 "[ . 1 . 2]" 1
109 1 10 LYS HA 1 15 VAL QG . . 5.920 5.347 5.090 5.666 . 0 0 "[ . 1 . 2]" 1
110 1 10 LYS QB 1 10 LYS QD . . 3.200 2.599 2.353 2.941 . 0 0 "[ . 1 . 2]" 1
111 1 10 LYS QB 1 11 PHE H . . 3.820 2.812 2.567 3.111 . 0 0 "[ . 1 . 2]" 1
112 1 10 LYS QD 1 10 LYS QG . . 2.360 2.012 1.994 2.029 . 0 0 "[ . 1 . 2]" 1
113 1 10 LYS QG 1 11 PHE H . . 4.970 4.234 3.681 4.823 . 0 0 "[ . 1 . 2]" 1
114 1 11 PHE H 1 11 PHE HB2 . . 3.750 2.391 2.337 2.443 . 0 0 "[ . 1 . 2]" 1
115 1 11 PHE H 1 11 PHE HB3 . . 3.750 2.470 2.437 2.501 . 0 0 "[ . 1 . 2]" 1
116 1 11 PHE H 1 11 PHE QD . . 4.670 4.170 4.155 4.188 . 0 0 "[ . 1 . 2]" 1
117 1 11 PHE H 1 12 THR H . . 4.090 2.846 2.744 2.905 . 0 0 "[ . 1 . 2]" 1
118 1 11 PHE H 1 12 THR MG . . 5.220 5.211 5.099 5.239 0.019 14 0 "[ . 1 . 2]" 1
119 1 11 PHE HA 1 11 PHE QD . . 3.640 3.141 3.087 3.210 . 0 0 "[ . 1 . 2]" 1
120 1 11 PHE HA 1 11 PHE QE . . 5.650 4.729 4.668 4.808 . 0 0 "[ . 1 . 2]" 1
121 1 11 PHE QB 1 12 THR H . . 3.910 3.049 2.864 3.143 . 0 0 "[ . 1 . 2]" 1
122 1 11 PHE QB 1 12 THR MG . . 4.150 3.745 3.658 3.859 . 0 0 "[ . 1 . 2]" 1
123 1 11 PHE QB 1 24 PHE QE . . 5.810 4.642 4.487 4.787 . 0 0 "[ . 1 . 2]" 1
124 1 11 PHE QB 1 53 GLU QB . . 5.020 3.340 3.210 3.461 . 0 0 "[ . 1 . 2]" 1
125 1 11 PHE QB 1 53 GLU QG . . 3.400 2.377 2.299 2.474 . 0 0 "[ . 1 . 2]" 1
126 1 11 PHE HB2 1 53 GLU HG2 . . 4.420 4.368 4.195 4.444 0.024 7 0 "[ . 1 . 2]" 1
127 1 11 PHE HB2 1 53 GLU HG3 . . 4.420 3.737 3.493 3.882 . 0 0 "[ . 1 . 2]" 1
128 1 11 PHE HB3 1 53 GLU HG2 . . 4.420 3.472 3.344 3.577 . 0 0 "[ . 1 . 2]" 1
129 1 11 PHE HB3 1 53 GLU HG3 . . 4.420 2.465 2.376 2.579 . 0 0 "[ . 1 . 2]" 1
130 1 11 PHE QD 1 12 THR HA . . 4.950 3.675 3.577 3.800 . 0 0 "[ . 1 . 2]" 1
131 1 11 PHE QD 1 12 THR MG . . 3.490 2.278 2.221 2.338 . 0 0 "[ . 1 . 2]" 1
132 1 11 PHE QD 1 15 VAL QG . . 4.490 4.464 4.371 4.502 0.012 3 0 "[ . 1 . 2]" 1
133 1 11 PHE QD 1 51 ASN HA . . 5.760 5.812 5.794 5.833 0.073 13 0 "[ . 1 . 2]" 1
134 1 11 PHE QD 1 52 ALA HA . . 4.630 4.306 4.181 4.401 . 0 0 "[ . 1 . 2]" 1
135 1 11 PHE QD 1 53 GLU H . . 4.600 3.881 3.618 4.034 . 0 0 "[ . 1 . 2]" 1
136 1 11 PHE QD 1 53 GLU HA . . 5.110 4.892 4.821 4.970 . 0 0 "[ . 1 . 2]" 1
137 1 11 PHE QD 1 53 GLU HB2 . . 3.830 2.121 2.063 2.223 . 0 0 "[ . 1 . 2]" 1
138 1 11 PHE QD 1 53 GLU QB . . 3.160 2.109 2.052 2.209 . 0 0 "[ . 1 . 2]" 1
139 1 11 PHE QD 1 53 GLU HB3 . . 3.830 3.676 3.541 3.851 0.021 4 0 "[ . 1 . 2]" 1
140 1 11 PHE QD 1 53 GLU HG2 . . 3.660 2.961 2.758 3.223 . 0 0 "[ . 1 . 2]" 1
141 1 11 PHE QD 1 53 GLU HG3 . . 3.660 2.921 2.778 3.120 . 0 0 "[ . 1 . 2]" 1
142 1 11 PHE QD 1 54 LEU H . . 6.000 5.553 5.345 5.702 . 0 0 "[ . 1 . 2]" 1
143 1 11 PHE QD 1 67 VAL HB . . 4.040 2.943 2.866 3.059 . 0 0 "[ . 1 . 2]" 1
144 1 11 PHE QD 1 67 VAL QG . . 3.530 3.263 3.181 3.331 . 0 0 "[ . 1 . 2]" 1
145 1 11 PHE QD 1 69 GLU QG . . 4.420 4.333 4.189 4.427 0.007 14 0 "[ . 1 . 2]" 1
146 1 11 PHE QE 1 12 THR HA . . 4.910 4.979 4.948 5.008 0.098 7 0 "[ . 1 . 2]" 1
147 1 11 PHE QE 1 12 THR MG . . 4.150 3.421 3.384 3.476 . 0 0 "[ . 1 . 2]" 1
148 1 11 PHE QE 1 15 VAL MG1 . . 6.000 5.767 5.637 5.921 . 0 0 "[ . 1 . 2]" 1
149 1 11 PHE QE 1 15 VAL QG . . 5.200 4.847 4.782 4.920 . 0 0 "[ . 1 . 2]" 1
150 1 11 PHE QE 1 15 VAL MG2 . . 6.000 5.213 5.147 5.292 . 0 0 "[ . 1 . 2]" 1
151 1 11 PHE QE 1 49 ILE MG . . 5.780 4.880 4.837 4.927 . 0 0 "[ . 1 . 2]" 1
152 1 11 PHE QE 1 51 ASN HA . . 5.640 4.635 4.571 4.714 . 0 0 "[ . 1 . 2]" 1
153 1 11 PHE QE 1 51 ASN HB2 . . 4.230 2.303 2.227 2.393 . 0 0 "[ . 1 . 2]" 1
154 1 11 PHE QE 1 51 ASN QB . . 3.600 2.130 2.089 2.196 . 0 0 "[ . 1 . 2]" 1
155 1 11 PHE QE 1 51 ASN HB3 . . 4.230 2.513 2.405 2.626 . 0 0 "[ . 1 . 2]" 1
156 1 11 PHE QE 1 52 ALA H . . 5.050 4.094 4.054 4.149 . 0 0 "[ . 1 . 2]" 1
157 1 11 PHE QE 1 52 ALA HA . . 4.160 2.464 2.385 2.530 . 0 0 "[ . 1 . 2]" 1
158 1 11 PHE QE 1 53 GLU H . . 4.220 2.529 2.404 2.641 . 0 0 "[ . 1 . 2]" 1
159 1 11 PHE QE 1 53 GLU HA . . 6.000 4.841 4.792 4.899 . 0 0 "[ . 1 . 2]" 1
160 1 11 PHE QE 1 53 GLU QB . . 4.700 3.127 2.879 3.457 . 0 0 "[ . 1 . 2]" 1
161 1 11 PHE QE 1 53 GLU HG2 . . 4.640 3.491 3.305 3.638 . 0 0 "[ . 1 . 2]" 1
162 1 11 PHE QE 1 53 GLU QG . . 3.920 3.365 3.213 3.488 . 0 0 "[ . 1 . 2]" 1
163 1 11 PHE QE 1 53 GLU HG3 . . 4.640 4.418 4.315 4.523 . 0 0 "[ . 1 . 2]" 1
164 1 11 PHE QE 1 67 VAL HB . . 3.590 2.300 2.230 2.382 . 0 0 "[ . 1 . 2]" 1
165 1 11 PHE QE 1 67 VAL MG1 . . 4.250 2.388 2.340 2.443 . 0 0 "[ . 1 . 2]" 1
166 1 11 PHE QE 1 67 VAL QG . . 3.500 2.369 2.325 2.420 . 0 0 "[ . 1 . 2]" 1
167 1 11 PHE QE 1 67 VAL MG2 . . 4.250 3.946 3.896 4.005 . 0 0 "[ . 1 . 2]" 1
168 1 11 PHE QE 1 68 VAL H . . 6.000 4.061 3.939 4.159 . 0 0 "[ . 1 . 2]" 1
169 1 11 PHE QE 1 68 VAL HA . . 4.310 3.368 3.251 3.452 . 0 0 "[ . 1 . 2]" 1
170 1 11 PHE QE 1 68 VAL MG1 . . 6.000 4.940 4.845 5.035 . 0 0 "[ . 1 . 2]" 1
171 1 11 PHE QE 1 68 VAL QG . . 5.270 4.196 4.090 4.265 . 0 0 "[ . 1 . 2]" 1
172 1 11 PHE QE 1 68 VAL MG2 . . 6.000 4.539 4.407 4.627 . 0 0 "[ . 1 . 2]" 1
173 1 11 PHE QE 1 69 GLU H . . 5.240 4.141 3.948 4.258 . 0 0 "[ . 1 . 2]" 1
174 1 11 PHE QE 1 69 GLU HB2 . . 4.650 2.425 2.304 2.540 . 0 0 "[ . 1 . 2]" 1
175 1 11 PHE QE 1 69 GLU QB . . 3.890 2.152 2.097 2.211 . 0 0 "[ . 1 . 2]" 1
176 1 11 PHE QE 1 69 GLU HB3 . . 4.650 2.419 2.277 2.630 . 0 0 "[ . 1 . 2]" 1
177 1 11 PHE QE 1 69 GLU QG . . 4.120 2.822 2.652 3.024 . 0 0 "[ . 1 . 2]" 1
178 1 11 PHE HZ 1 49 ILE MG . . 4.270 4.341 4.322 4.364 0.094 6 0 "[ . 1 . 2]" 1
179 1 11 PHE HZ 1 51 ASN HA . . 5.290 4.862 4.783 4.941 . 0 0 "[ . 1 . 2]" 1
180 1 11 PHE HZ 1 51 ASN HB2 . . 4.180 3.809 3.727 3.904 . 0 0 "[ . 1 . 2]" 1
181 1 11 PHE HZ 1 51 ASN QB . . 3.650 3.141 3.067 3.194 . 0 0 "[ . 1 . 2]" 1
182 1 11 PHE HZ 1 51 ASN HB3 . . 4.180 3.346 3.263 3.419 . 0 0 "[ . 1 . 2]" 1
183 1 11 PHE HZ 1 52 ALA H . . 4.380 3.959 3.876 4.071 . 0 0 "[ . 1 . 2]" 1
184 1 11 PHE HZ 1 52 ALA HA . . 4.580 2.468 2.409 2.533 . 0 0 "[ . 1 . 2]" 1
185 1 11 PHE HZ 1 52 ALA MB . . 3.710 3.740 3.731 3.749 0.039 8 0 "[ . 1 . 2]" 1
186 1 11 PHE HZ 1 53 GLU QG . . 4.480 4.462 4.241 4.506 0.026 12 0 "[ . 1 . 2]" 1
187 1 11 PHE HZ 1 67 VAL QG . . 3.360 2.945 2.832 3.107 . 0 0 "[ . 1 . 2]" 1
188 1 11 PHE HZ 1 68 VAL H . . 5.960 4.320 4.194 4.438 . 0 0 "[ . 1 . 2]" 1
189 1 11 PHE HZ 1 68 VAL HA . . 4.640 2.759 2.613 2.929 . 0 0 "[ . 1 . 2]" 1
190 1 11 PHE HZ 1 68 VAL QG . . 5.450 3.988 3.871 4.117 . 0 0 "[ . 1 . 2]" 1
191 1 11 PHE HZ 1 69 GLU H . . 4.530 2.903 2.684 3.044 . 0 0 "[ . 1 . 2]" 1
192 1 11 PHE HZ 1 69 GLU HB2 . . 4.120 2.281 2.213 2.374 . 0 0 "[ . 1 . 2]" 1
193 1 11 PHE HZ 1 69 GLU QB . . 3.290 2.194 2.124 2.325 . 0 0 "[ . 1 . 2]" 1
194 1 11 PHE HZ 1 69 GLU HB3 . . 4.120 2.882 2.591 3.320 . 0 0 "[ . 1 . 2]" 1
195 1 11 PHE HZ 1 69 GLU HG2 . . 4.730 4.786 4.749 4.814 0.084 4 0 "[ . 1 . 2]" 1
196 1 11 PHE HZ 1 69 GLU HG3 . . 4.730 4.242 4.128 4.421 . 0 0 "[ . 1 . 2]" 1
197 1 12 THR H 1 12 THR MG . . 3.850 3.397 3.244 3.471 . 0 0 "[ . 1 . 2]" 1
198 1 12 THR H 1 53 GLU QG . . 5.220 4.630 4.395 4.835 . 0 0 "[ . 1 . 2]" 1
199 1 12 THR H 1 55 LYS HA . . 6.000 5.485 5.397 5.638 . 0 0 "[ . 1 . 2]" 1
200 1 12 THR H 1 56 PRO QD . . 5.810 4.482 4.378 4.616 . 0 0 "[ . 1 . 2]" 1
201 1 12 THR H 1 67 VAL QG . . 5.200 4.544 4.487 4.601 . 0 0 "[ . 1 . 2]" 1
202 1 12 THR HA 1 12 THR MG . . 3.370 2.237 2.206 2.269 . 0 0 "[ . 1 . 2]" 1
203 1 12 THR HA 1 15 VAL H . . 6.000 4.314 4.221 4.377 . 0 0 "[ . 1 . 2]" 1
204 1 12 THR HA 1 15 VAL HB . . 4.340 3.504 3.288 3.666 . 0 0 "[ . 1 . 2]" 1
205 1 12 THR HA 1 15 VAL QG . . 3.810 2.420 2.367 2.463 . 0 0 "[ . 1 . 2]" 1
206 1 12 THR HA 1 55 LYS QB . . 5.670 4.846 4.682 5.020 . 0 0 "[ . 1 . 2]" 1
207 1 12 THR HA 1 55 LYS QG . . 3.850 3.709 3.425 3.863 0.013 12 0 "[ . 1 . 2]" 1
208 1 12 THR HA 1 67 VAL HB . . 4.690 3.428 3.314 3.507 . 0 0 "[ . 1 . 2]" 1
209 1 12 THR HA 1 67 VAL QG . . 3.680 2.312 2.244 2.400 . 0 0 "[ . 1 . 2]" 1
210 1 12 THR HB 1 15 VAL QG . . 4.480 4.211 4.109 4.269 . 0 0 "[ . 1 . 2]" 1
211 1 12 THR HB 1 55 LYS H . . 5.560 4.593 4.437 4.735 . 0 0 "[ . 1 . 2]" 1
212 1 12 THR HB 1 55 LYS QB . . 5.090 3.587 3.392 3.826 . 0 0 "[ . 1 . 2]" 1
213 1 12 THR HB 1 55 LYS QD . . 5.340 4.238 3.468 4.501 . 0 0 "[ . 1 . 2]" 1
214 1 12 THR HB 1 55 LYS HG2 . . 4.400 3.184 2.278 3.759 . 0 0 "[ . 1 . 2]" 1
215 1 12 THR HB 1 55 LYS QG . . 3.640 2.258 2.178 2.365 . 0 0 "[ . 1 . 2]" 1
216 1 12 THR HB 1 55 LYS HG3 . . 4.400 2.634 2.213 4.106 . 0 0 "[ . 1 . 2]" 1
217 1 12 THR HB 1 67 VAL HB . . 6.000 4.967 4.831 5.087 . 0 0 "[ . 1 . 2]" 1
218 1 12 THR HB 1 67 VAL QG . . 4.100 3.749 3.699 3.846 . 0 0 "[ . 1 . 2]" 1
219 1 12 THR MG 1 15 VAL QG . . 4.560 3.639 3.587 3.692 . 0 0 "[ . 1 . 2]" 1
220 1 12 THR MG 1 52 ALA HA . . 5.330 5.199 5.130 5.287 . 0 0 "[ . 1 . 2]" 1
221 1 12 THR MG 1 53 GLU HA . . 4.570 4.214 4.142 4.295 . 0 0 "[ . 1 . 2]" 1
222 1 12 THR MG 1 53 GLU QB . . 3.370 2.123 2.018 2.250 . 0 0 "[ . 1 . 2]" 1
223 1 12 THR MG 1 53 GLU QG . . 4.270 3.541 3.370 3.663 . 0 0 "[ . 1 . 2]" 1
224 1 12 THR MG 1 54 LEU H . . 5.970 3.382 3.225 3.550 . 0 0 "[ . 1 . 2]" 1
225 1 12 THR MG 1 54 LEU HA . . 5.120 3.336 3.251 3.487 . 0 0 "[ . 1 . 2]" 1
226 1 12 THR MG 1 54 LEU HB2 . . 4.750 4.490 4.450 4.537 . 0 0 "[ . 1 . 2]" 1
227 1 12 THR MG 1 54 LEU QB . . 4.000 4.087 4.070 4.106 0.106 6 0 "[ . 1 . 2]" 1
228 1 12 THR MG 1 54 LEU HB3 . . 4.750 4.702 4.665 4.747 . 0 0 "[ . 1 . 2]" 1
229 1 12 THR MG 1 55 LYS H . . 5.050 3.209 3.079 3.298 . 0 0 "[ . 1 . 2]" 1
230 1 12 THR MG 1 55 LYS HA . . 3.890 2.344 2.272 2.409 . 0 0 "[ . 1 . 2]" 1
231 1 12 THR MG 1 55 LYS QB . . 3.710 2.928 2.772 3.141 . 0 0 "[ . 1 . 2]" 1
232 1 12 THR MG 1 55 LYS QE . . 4.350 4.385 4.368 4.399 0.049 9 0 "[ . 1 . 2]" 1
233 1 12 THR MG 1 55 LYS QG . . 4.490 2.935 2.652 3.099 . 0 0 "[ . 1 . 2]" 1
234 1 12 THR MG 1 56 PRO QD . . 4.720 3.029 2.865 3.139 . 0 0 "[ . 1 . 2]" 1
235 1 12 THR MG 1 65 VAL QG . . 5.920 3.760 3.603 3.963 . 0 0 "[ . 1 . 2]" 1
236 1 12 THR MG 1 66 ALA HA . . 5.650 3.792 3.622 3.953 . 0 0 "[ . 1 . 2]" 1
237 1 12 THR MG 1 67 VAL H . . 4.160 3.172 3.089 3.304 . 0 0 "[ . 1 . 2]" 1
238 1 12 THR MG 1 67 VAL HA . . 5.580 4.482 4.412 4.617 . 0 0 "[ . 1 . 2]" 1
239 1 12 THR MG 1 67 VAL HB . . 3.660 2.356 2.276 2.496 . 0 0 "[ . 1 . 2]" 1
240 1 12 THR MG 1 67 VAL QG . . 3.460 2.234 2.169 2.315 . 0 0 "[ . 1 . 2]" 1
241 1 13 GLU H 1 13 GLU HB2 . . 3.610 2.500 2.437 2.565 . 0 0 "[ . 1 . 2]" 1
242 1 13 GLU H 1 13 GLU HB3 . . 3.610 2.551 2.406 2.637 . 0 0 "[ . 1 . 2]" 1
243 1 13 GLU H 1 13 GLU QG . . 4.070 4.005 3.973 4.065 . 0 0 "[ . 1 . 2]" 1
244 1 13 GLU H 1 14 GLY H . . 5.920 4.552 4.502 4.578 . 0 0 "[ . 1 . 2]" 1
245 1 13 GLU H 1 15 VAL H . . 4.220 4.312 4.277 4.332 0.112 4 0 "[ . 1 . 2]" 1
246 1 13 GLU H 1 15 VAL QG . . 4.870 3.547 3.224 3.694 . 0 0 "[ . 1 . 2]" 1
247 1 13 GLU HA 1 13 GLU QG . . 3.340 2.482 2.308 2.974 . 0 0 "[ . 1 . 2]" 1
248 1 13 GLU HA 1 14 GLY H . . 3.560 2.213 2.179 2.240 . 0 0 "[ . 1 . 2]" 1
249 1 13 GLU HA 1 15 VAL H . . 4.770 3.523 3.389 3.634 . 0 0 "[ . 1 . 2]" 1
250 1 13 GLU HA 1 15 VAL QG . . 5.920 4.084 3.943 4.267 . 0 0 "[ . 1 . 2]" 1
251 1 13 GLU HA 1 55 LYS QG . . 5.080 3.966 3.676 4.658 . 0 0 "[ . 1 . 2]" 1
252 1 13 GLU HA 1 56 PRO QG . . 4.110 4.109 3.951 4.129 0.019 11 0 "[ . 1 . 2]" 1
253 1 13 GLU QB 1 13 GLU QG . . 2.340 2.071 2.006 2.118 . 0 0 "[ . 1 . 2]" 1
254 1 13 GLU QB 1 14 GLY QA . . 4.120 4.171 4.155 4.192 0.072 19 0 "[ . 1 . 2]" 1
255 1 13 GLU QG 1 14 GLY H . . 4.600 2.960 2.820 3.211 . 0 0 "[ . 1 . 2]" 1
256 1 13 GLU QG 1 14 GLY QA . . 4.190 3.536 3.260 4.209 0.019 5 0 "[ . 1 . 2]" 1
257 1 14 GLY H 1 15 VAL H . . 4.320 2.661 2.578 2.726 . 0 0 "[ . 1 . 2]" 1
258 1 14 GLY H 1 15 VAL HA . . 4.980 5.077 5.060 5.102 0.122 10 0 "[ . 1 . 2]" 1
259 1 14 GLY H 1 15 VAL HB . . 6.000 4.934 4.805 5.064 . 0 0 "[ . 1 . 2]" 1
260 1 14 GLY H 1 15 VAL QG . . 5.920 4.039 3.843 4.151 . 0 0 "[ . 1 . 2]" 1
261 1 14 GLY H 1 55 LYS QE . . 5.810 3.243 3.068 3.419 . 0 0 "[ . 1 . 2]" 1
262 1 14 GLY QA 1 15 VAL HA . . 4.920 4.054 4.011 4.094 . 0 0 "[ . 1 . 2]" 1
263 1 14 GLY QA 1 15 VAL QG . . 4.890 3.807 3.691 3.957 . 0 0 "[ . 1 . 2]" 1
264 1 14 GLY QA 1 16 ASN QD . . 5.090 4.075 3.795 4.299 . 0 0 "[ . 1 . 2]" 1
265 1 14 GLY QA 1 100 ARG QB . . 4.080 4.055 3.949 4.123 0.043 6 0 "[ . 1 . 2]" 1
266 1 14 GLY QA 1 100 ARG HE . . 5.640 4.774 3.580 5.097 . 0 0 "[ . 1 . 2]" 1
267 1 15 VAL H 1 15 VAL HB . . 3.600 2.740 2.662 2.781 . 0 0 "[ . 1 . 2]" 1
268 1 15 VAL H 1 15 VAL MG1 . . 4.500 3.789 3.763 3.817 . 0 0 "[ . 1 . 2]" 1
269 1 15 VAL H 1 15 VAL QG . . 3.490 1.940 1.864 2.062 . 0 0 "[ . 1 . 2]" 1
270 1 15 VAL H 1 15 VAL MG2 . . 4.500 1.946 1.869 2.071 . 0 0 "[ . 1 . 2]" 1
271 1 15 VAL H 1 16 ASN H . . 5.290 4.630 4.594 4.652 . 0 0 "[ . 1 . 2]" 1
272 1 15 VAL H 1 55 LYS QE . . 5.010 3.362 3.135 3.658 . 0 0 "[ . 1 . 2]" 1
273 1 15 VAL H 1 67 VAL QG . . 4.430 4.462 4.445 4.476 0.046 18 0 "[ . 1 . 2]" 1
274 1 15 VAL H 1 101 ASP QB . . 4.930 4.939 4.809 4.980 0.050 5 0 "[ . 1 . 2]" 1
275 1 15 VAL HA 1 16 ASN H . . 3.210 2.191 2.148 2.230 . 0 0 "[ . 1 . 2]" 1
276 1 15 VAL HA 1 16 ASN QB . . 4.980 4.567 4.509 4.626 . 0 0 "[ . 1 . 2]" 1
277 1 15 VAL HA 1 26 TYR QE . . 6.000 5.653 5.484 5.869 . 0 0 "[ . 1 . 2]" 1
278 1 15 VAL HA 1 67 VAL QG . . 4.930 4.594 4.521 4.642 . 0 0 "[ . 1 . 2]" 1
279 1 15 VAL HA 1 100 ARG QG . . 4.850 4.803 4.122 4.924 0.074 4 0 "[ . 1 . 2]" 1
280 1 15 VAL HA 1 101 ASP H . . 5.290 4.758 4.491 5.009 . 0 0 "[ . 1 . 2]" 1
281 1 15 VAL HB 1 16 ASN H . . 4.590 3.846 3.746 3.972 . 0 0 "[ . 1 . 2]" 1
282 1 15 VAL HB 1 16 ASN HA . . 4.700 4.721 4.704 4.737 0.037 6 0 "[ . 1 . 2]" 1
283 1 15 VAL HB 1 26 TYR QD . . 4.300 3.704 3.420 3.906 . 0 0 "[ . 1 . 2]" 1
284 1 15 VAL HB 1 26 TYR QE . . 4.270 3.859 3.640 4.006 . 0 0 "[ . 1 . 2]" 1
285 1 15 VAL HB 1 67 VAL QG . . 3.630 2.654 2.526 2.750 . 0 0 "[ . 1 . 2]" 1
286 1 15 VAL HB 1 99 ARG H . . 6.000 5.954 5.398 6.018 0.018 4 0 "[ . 1 . 2]" 1
287 1 15 VAL QG 1 16 ASN H . . 3.520 2.280 2.146 2.330 . 0 0 "[ . 1 . 2]" 1
288 1 15 VAL QG 1 16 ASN HA . . 5.550 3.710 3.515 3.790 . 0 0 "[ . 1 . 2]" 1
289 1 15 VAL QG 1 24 PHE QB . . 4.390 3.460 3.373 3.531 . 0 0 "[ . 1 . 2]" 1
290 1 15 VAL QG 1 24 PHE QD . . 4.990 3.937 3.879 4.010 . 0 0 "[ . 1 . 2]" 1
291 1 15 VAL QG 1 26 TYR QB . . 5.730 3.232 2.913 3.424 . 0 0 "[ . 1 . 2]" 1
292 1 15 VAL QG 1 26 TYR QD . . 3.240 2.309 2.203 2.424 . 0 0 "[ . 1 . 2]" 1
293 1 15 VAL QG 1 26 TYR QE . . 3.810 3.449 3.275 3.608 . 0 0 "[ . 1 . 2]" 1
294 1 15 VAL QG 1 27 CYS H . . 5.600 5.420 5.300 5.564 . 0 0 "[ . 1 . 2]" 1
295 1 15 VAL QG 1 55 LYS QE . . 5.730 3.653 3.501 3.804 . 0 0 "[ . 1 . 2]" 1
296 1 15 VAL QG 1 67 VAL HA . . 5.920 4.229 4.170 4.290 . 0 0 "[ . 1 . 2]" 1
297 1 15 VAL QG 1 67 VAL QG . . 4.230 1.890 1.863 1.937 . 0 0 "[ . 1 . 2]" 1
298 1 15 VAL QG 1 98 ALA HA . . 4.280 2.925 2.842 3.065 . 0 0 "[ . 1 . 2]" 1
299 1 15 VAL QG 1 98 ALA MB . . 3.100 1.926 1.877 2.002 . 0 0 "[ . 1 . 2]" 1
300 1 15 VAL QG 1 99 ARG H . . 4.230 3.170 2.484 3.266 . 0 0 "[ . 1 . 2]" 1
301 1 15 VAL QG 1 100 ARG H . . 5.230 2.949 2.616 3.527 . 0 0 "[ . 1 . 2]" 1
302 1 15 VAL QG 1 100 ARG QB . . 4.850 3.751 3.659 3.911 . 0 0 "[ . 1 . 2]" 1
303 1 15 VAL QG 1 100 ARG QD . . 4.130 3.998 3.796 4.226 0.096 1 0 "[ . 1 . 2]" 1
304 1 15 VAL QG 1 100 ARG HE . . 5.660 5.450 3.298 5.704 0.044 5 0 "[ . 1 . 2]" 1
305 1 15 VAL QG 1 101 ASP H . . 5.870 3.532 3.161 3.780 . 0 0 "[ . 1 . 2]" 1
306 1 15 VAL QG 1 101 ASP HA . . 3.800 3.819 3.658 3.873 0.073 16 0 "[ . 1 . 2]" 1
307 1 15 VAL QG 1 101 ASP QB . . 4.720 2.956 2.659 3.095 . 0 0 "[ . 1 . 2]" 1
308 1 15 VAL MG1 1 16 ASN H . . 4.190 2.293 2.156 2.344 . 0 0 "[ . 1 . 2]" 1
309 1 15 VAL MG1 1 24 PHE QE . . 6.000 5.342 5.158 5.558 . 0 0 "[ . 1 . 2]" 1
310 1 15 VAL MG1 1 26 TYR QE . . 5.260 3.499 3.311 3.675 . 0 0 "[ . 1 . 2]" 1
311 1 15 VAL MG1 1 98 ALA HA . . 5.330 2.938 2.852 3.083 . 0 0 "[ . 1 . 2]" 1
312 1 15 VAL MG1 1 98 ALA MB . . 4.290 1.935 1.885 2.012 . 0 0 "[ . 1 . 2]" 1
313 1 15 VAL MG1 1 100 ARG H . . 6.000 3.000 2.647 3.641 . 0 0 "[ . 1 . 2]" 1
314 1 15 VAL MG2 1 16 ASN H . . 4.190 4.027 3.914 4.078 . 0 0 "[ . 1 . 2]" 1
315 1 15 VAL MG2 1 24 PHE QE . . 6.000 4.709 4.608 4.771 . 0 0 "[ . 1 . 2]" 1
316 1 15 VAL MG2 1 26 TYR QE . . 5.260 5.227 5.052 5.273 0.013 2 0 "[ . 1 . 2]" 1
317 1 15 VAL MG2 1 98 ALA HA . . 5.330 5.375 5.364 5.390 0.060 16 0 "[ . 1 . 2]" 1
318 1 15 VAL MG2 1 98 ALA MB . . 4.290 3.500 3.421 3.571 . 0 0 "[ . 1 . 2]" 1
319 1 15 VAL MG2 1 100 ARG H . . 6.000 4.365 4.042 4.723 . 0 0 "[ . 1 . 2]" 1
320 1 16 ASN H 1 16 ASN QB . . 3.590 2.985 2.935 3.049 . 0 0 "[ . 1 . 2]" 1
321 1 16 ASN H 1 16 ASN HD21 . . 5.250 2.615 2.483 2.752 . 0 0 "[ . 1 . 2]" 1
322 1 16 ASN H 1 16 ASN QD . . 4.610 2.513 2.404 2.625 . 0 0 "[ . 1 . 2]" 1
323 1 16 ASN H 1 16 ASN HD22 . . 5.250 3.260 3.209 3.337 . 0 0 "[ . 1 . 2]" 1
324 1 16 ASN H 1 17 PRO HA . . 6.000 5.016 4.917 5.086 . 0 0 "[ . 1 . 2]" 1
325 1 16 ASN H 1 17 PRO QD . . 5.810 4.445 4.414 4.486 . 0 0 "[ . 1 . 2]" 1
326 1 16 ASN H 1 26 TYR QE . . 5.460 4.801 4.658 5.128 . 0 0 "[ . 1 . 2]" 1
327 1 16 ASN H 1 98 ALA HA . . 4.880 4.001 3.807 4.433 . 0 0 "[ . 1 . 2]" 1
328 1 16 ASN H 1 99 ARG H . . 4.270 2.951 2.736 3.061 . 0 0 "[ . 1 . 2]" 1
329 1 16 ASN H 1 99 ARG QG . . 4.070 4.137 4.113 4.154 0.084 16 0 "[ . 1 . 2]" 1
330 1 16 ASN H 1 100 ARG QB . . 4.030 3.791 3.645 4.047 0.017 9 0 "[ . 1 . 2]" 1
331 1 16 ASN H 1 101 ASP H . . 5.680 5.453 5.293 5.652 . 0 0 "[ . 1 . 2]" 1
332 1 16 ASN HA 1 17 PRO HD2 . . 3.990 2.656 2.529 2.792 . 0 0 "[ . 1 . 2]" 1
333 1 16 ASN HA 1 17 PRO QD . . 3.370 2.306 2.230 2.399 . 0 0 "[ . 1 . 2]" 1
334 1 16 ASN HA 1 17 PRO HD3 . . 3.990 2.533 2.413 2.614 . 0 0 "[ . 1 . 2]" 1
335 1 16 ASN HA 1 17 PRO QG . . 5.240 4.258 4.185 4.348 . 0 0 "[ . 1 . 2]" 1
336 1 16 ASN HA 1 26 TYR QD . . 4.550 4.314 4.033 4.572 0.022 16 0 "[ . 1 . 2]" 1
337 1 16 ASN HA 1 26 TYR QE . . 4.140 3.361 3.070 3.630 . 0 0 "[ . 1 . 2]" 1
338 1 16 ASN HA 1 65 VAL QG . . 5.920 5.066 4.758 5.365 . 0 0 "[ . 1 . 2]" 1
339 1 16 ASN QB 1 17 PRO QD . . 3.090 2.210 2.150 2.285 . 0 0 "[ . 1 . 2]" 1
340 1 16 ASN QB 1 99 ARG H . . 4.480 3.836 3.615 4.235 . 0 0 "[ . 1 . 2]" 1
341 1 16 ASN QB 1 99 ARG QB . . 5.120 2.535 2.303 2.781 . 0 0 "[ . 1 . 2]" 1
342 1 16 ASN QB 1 100 ARG H . . 5.810 3.998 3.659 4.291 . 0 0 "[ . 1 . 2]" 1
343 1 16 ASN QD 1 17 PRO QD . . 4.740 4.754 4.726 4.768 0.028 14 0 "[ . 1 . 2]" 1
344 1 16 ASN QD 1 99 ARG H . . 5.810 3.782 3.418 4.186 . 0 0 "[ . 1 . 2]" 1
345 1 16 ASN QD 1 99 ARG QB . . 3.840 2.627 2.169 3.018 . 0 0 "[ . 1 . 2]" 1
346 1 16 ASN QD 1 99 ARG QG . . 4.860 2.124 1.975 2.328 . 0 0 "[ . 1 . 2]" 1
347 1 16 ASN QD 1 100 ARG QG . . 3.930 3.536 3.420 3.676 . 0 0 "[ . 1 . 2]" 1
348 1 16 ASN QD 1 101 ASP H . . 5.240 5.289 5.273 5.307 0.067 9 0 "[ . 1 . 2]" 1
349 1 16 ASN QD 1 101 ASP QB . . 5.610 5.573 5.384 5.644 0.034 7 0 "[ . 1 . 2]" 1
350 1 16 ASN HD21 1 101 ASP H . . 6.000 5.814 5.781 5.860 . 0 0 "[ . 1 . 2]" 1
351 1 16 ASN HD22 1 101 ASP H . . 6.000 6.082 6.065 6.098 0.098 12 0 "[ . 1 . 2]" 1
352 1 17 PRO HA 1 19 GLY H . . 4.950 4.374 4.006 4.961 0.011 13 0 "[ . 1 . 2]" 1
353 1 17 PRO HA 1 26 TYR HB2 . . 4.860 3.302 3.030 3.657 . 0 0 "[ . 1 . 2]" 1
354 1 17 PRO HA 1 26 TYR QB . . 4.180 2.748 2.558 3.082 . 0 0 "[ . 1 . 2]" 1
355 1 17 PRO HA 1 26 TYR HB3 . . 4.860 2.950 2.718 3.318 . 0 0 "[ . 1 . 2]" 1
356 1 17 PRO HA 1 26 TYR QD . . 3.960 3.288 2.989 3.494 . 0 0 "[ . 1 . 2]" 1
357 1 17 PRO HA 1 99 ARG H . . 5.550 3.727 3.575 4.134 . 0 0 "[ . 1 . 2]" 1
358 1 17 PRO QB 1 18 GLY H . . 3.830 2.701 2.462 3.234 . 0 0 "[ . 1 . 2]" 1
359 1 17 PRO QB 1 18 GLY QA . . 5.610 3.428 3.316 3.733 . 0 0 "[ . 1 . 2]" 1
360 1 17 PRO QB 1 19 GLY H . . 5.810 5.175 4.867 5.746 . 0 0 "[ . 1 . 2]" 1
361 1 17 PRO QB 1 26 TYR QB . . 5.000 3.591 3.385 3.922 . 0 0 "[ . 1 . 2]" 1
362 1 17 PRO QB 1 26 TYR QD . . 3.420 2.664 2.411 3.098 . 0 0 "[ . 1 . 2]" 1
363 1 17 PRO QB 1 26 TYR QE . . 4.570 2.699 2.496 2.826 . 0 0 "[ . 1 . 2]" 1
364 1 17 PRO QB 1 96 SER HG . . 4.850 3.233 2.642 4.058 . 0 0 "[ . 1 . 2]" 1
365 1 17 PRO QB 1 98 ALA HA . . 4.990 4.989 4.587 5.035 0.045 6 0 "[ . 1 . 2]" 1
366 1 17 PRO QB 1 99 ARG H . . 5.810 5.346 5.218 5.755 . 0 0 "[ . 1 . 2]" 1
367 1 17 PRO HB2 1 18 GLY H . . 4.460 2.792 2.519 3.426 . 0 0 "[ . 1 . 2]" 1
368 1 17 PRO HB3 1 18 GLY H . . 4.460 3.630 3.461 3.968 . 0 0 "[ . 1 . 2]" 1
369 1 17 PRO QD 1 26 TYR QE . . 4.260 3.200 2.944 3.485 . 0 0 "[ . 1 . 2]" 1
370 1 17 PRO QG 1 18 GLY H . . 4.890 4.238 4.064 4.612 . 0 0 "[ . 1 . 2]" 1
371 1 17 PRO QG 1 26 TYR QD . . 4.920 4.471 4.177 4.855 . 0 0 "[ . 1 . 2]" 1
372 1 17 PRO QG 1 26 TYR QE . . 4.190 3.523 3.198 3.828 . 0 0 "[ . 1 . 2]" 1
373 1 18 GLY H 1 19 GLY H . . 4.270 2.846 2.565 3.413 . 0 0 "[ . 1 . 2]" 1
374 1 18 GLY H 1 19 GLY QA . . 5.810 4.635 4.382 5.005 . 0 0 "[ . 1 . 2]" 1
375 1 18 GLY H 1 26 TYR H . . 6.000 5.652 5.377 5.845 . 0 0 "[ . 1 . 2]" 1
376 1 18 GLY H 1 26 TYR QB . . 4.990 3.766 3.520 4.040 . 0 0 "[ . 1 . 2]" 1
377 1 18 GLY H 1 26 TYR QD . . 6.000 4.595 4.287 4.819 . 0 0 "[ . 1 . 2]" 1
378 1 18 GLY H 1 26 TYR QE . . 6.000 5.854 5.635 6.021 0.021 1 0 "[ . 1 . 2]" 1
379 1 18 GLY H 1 96 SER H . . 6.000 5.571 5.266 6.009 0.009 16 0 "[ . 1 . 2]" 1
380 1 18 GLY H 1 96 SER QB . . 4.060 2.833 2.524 3.497 . 0 0 "[ . 1 . 2]" 1
381 1 18 GLY H 1 96 SER HG . . 4.950 3.014 2.234 3.936 . 0 0 "[ . 1 . 2]" 1
382 1 18 GLY H 1 97 TYR QB . . 5.810 4.329 3.957 4.501 . 0 0 "[ . 1 . 2]" 1
383 1 18 GLY H 1 98 ALA HA . . 5.130 4.283 3.496 4.737 . 0 0 "[ . 1 . 2]" 1
384 1 18 GLY H 1 98 ALA MB . . 6.000 5.519 4.939 5.859 . 0 0 "[ . 1 . 2]" 1
385 1 18 GLY H 1 99 ARG H . . 6.000 4.522 3.996 4.845 . 0 0 "[ . 1 . 2]" 1
386 1 18 GLY H 1 99 ARG HB2 . . 6.000 4.662 4.133 4.977 . 0 0 "[ . 1 . 2]" 1
387 1 18 GLY H 1 99 ARG HB3 . . 6.000 4.990 4.405 5.515 . 0 0 "[ . 1 . 2]" 1
388 1 18 GLY QA 1 97 TYR QB . . 4.590 3.975 3.538 4.211 . 0 0 "[ . 1 . 2]" 1
389 1 18 GLY QA 1 99 ARG QB . . 4.810 3.852 3.545 4.110 . 0 0 "[ . 1 . 2]" 1
390 1 19 GLY H 1 20 ASP H . . 5.120 4.044 2.450 4.631 . 0 0 "[ . 1 . 2]" 1
391 1 19 GLY H 1 22 ASN H . . 5.930 6.005 5.953 6.070 0.140 18 0 "[ . 1 . 2]" 1
392 1 19 GLY H 1 96 SER QB . . 5.220 4.290 3.891 5.050 . 0 0 "[ . 1 . 2]" 1
393 1 19 GLY H 1 96 SER HG . . 6.000 5.151 4.095 6.017 0.017 13 0 "[ . 1 . 2]" 1
394 1 19 GLY H 1 97 TYR H . . 5.230 3.448 3.111 4.573 . 0 0 "[ . 1 . 2]" 1
395 1 19 GLY H 1 97 TYR HB2 . . 5.310 2.903 2.343 3.354 . 0 0 "[ . 1 . 2]" 1
396 1 19 GLY H 1 97 TYR QB . . 4.600 2.587 2.233 2.812 . 0 0 "[ . 1 . 2]" 1
397 1 19 GLY H 1 97 TYR HB3 . . 5.310 2.938 2.514 3.239 . 0 0 "[ . 1 . 2]" 1
398 1 19 GLY H 1 97 TYR QD . . 6.000 4.730 4.403 4.942 . 0 0 "[ . 1 . 2]" 1
399 1 19 GLY H 1 98 ALA HA . . 5.070 4.314 3.995 4.635 . 0 0 "[ . 1 . 2]" 1
400 1 19 GLY H 1 99 ARG H . . 5.430 4.014 3.702 4.474 . 0 0 "[ . 1 . 2]" 1
401 1 19 GLY H 1 99 ARG HB2 . . 5.380 3.360 2.928 3.942 . 0 0 "[ . 1 . 2]" 1
402 1 19 GLY H 1 99 ARG QB . . 4.540 3.259 2.887 3.736 . 0 0 "[ . 1 . 2]" 1
403 1 19 GLY H 1 99 ARG HB3 . . 5.380 4.446 4.183 4.805 . 0 0 "[ . 1 . 2]" 1
404 1 19 GLY H 1 99 ARG QG . . 5.810 5.242 4.575 5.731 . 0 0 "[ . 1 . 2]" 1
405 1 19 GLY QA 1 97 TYR QB . . 4.730 2.639 2.331 3.723 . 0 0 "[ . 1 . 2]" 1
406 1 19 GLY QA 1 97 TYR QD . . 5.810 4.421 4.130 5.456 . 0 0 "[ . 1 . 2]" 1
407 1 19 GLY QA 1 99 ARG H . . 5.080 3.961 3.396 4.390 . 0 0 "[ . 1 . 2]" 1
408 1 19 GLY QA 1 99 ARG QB . . 3.310 2.428 2.216 2.613 . 0 0 "[ . 1 . 2]" 1
409 1 19 GLY QA 1 99 ARG QG . . 3.620 3.421 2.793 3.644 0.024 17 0 "[ . 1 . 2]" 1
410 1 19 GLY QA 1 100 ARG H . . 5.810 5.178 4.772 5.605 . 0 0 "[ . 1 . 2]" 1
411 1 19 GLY HA2 1 99 ARG HB2 . . 4.470 2.574 2.273 2.895 . 0 0 "[ . 1 . 2]" 1
412 1 19 GLY HA2 1 99 ARG HB3 . . 4.470 4.248 3.860 4.519 0.049 16 0 "[ . 1 . 2]" 1
413 1 19 GLY HA3 1 99 ARG HB2 . . 4.470 3.159 2.953 3.386 . 0 0 "[ . 1 . 2]" 1
414 1 19 GLY HA3 1 99 ARG HB3 . . 4.470 4.493 4.391 4.527 0.057 9 0 "[ . 1 . 2]" 1
415 1 20 ASP H 1 20 ASP HB2 . . 4.080 3.131 2.418 4.025 . 0 0 "[ . 1 . 2]" 1
416 1 20 ASP H 1 20 ASP QB . . 3.300 2.704 2.266 3.309 0.009 13 0 "[ . 1 . 2]" 1
417 1 20 ASP H 1 20 ASP HB3 . . 4.080 3.204 2.428 3.894 . 0 0 "[ . 1 . 2]" 1
418 1 20 ASP H 1 21 ARG H . . 5.590 3.623 2.471 4.658 . 0 0 "[ . 1 . 2]" 1
419 1 20 ASP H 1 99 ARG HA . . 4.840 4.220 3.738 4.947 0.107 8 0 "[ . 1 . 2]" 1
420 1 20 ASP HA 1 21 ARG H . . 3.540 2.357 2.100 2.946 . 0 0 "[ . 1 . 2]" 1
421 1 20 ASP QB 1 21 ARG H . . 3.920 3.792 2.384 4.004 0.084 14 0 "[ . 1 . 2]" 1
422 1 20 ASP HB2 1 21 ARG H . . 4.630 4.343 2.408 4.603 . 0 0 "[ . 1 . 2]" 1
423 1 20 ASP HB3 1 21 ARG H . . 4.630 4.261 2.784 4.598 . 0 0 "[ . 1 . 2]" 1
424 1 21 ARG H 1 21 ARG HB2 . . 4.000 3.084 2.066 3.610 . 0 0 "[ . 1 . 2]" 1
425 1 21 ARG H 1 21 ARG QB . . 3.370 2.946 1.983 3.379 0.009 14 0 "[ . 1 . 2]" 1
426 1 21 ARG H 1 21 ARG HB3 . . 4.000 3.809 2.557 4.093 0.093 14 0 "[ . 1 . 2]" 1
427 1 21 ARG H 1 21 ARG QD . . 5.750 3.730 2.509 4.591 . 0 0 "[ . 1 . 2]" 1
428 1 21 ARG H 1 21 ARG HE . . 6.000 5.344 3.978 6.089 0.089 20 0 "[ . 1 . 2]" 1
429 1 21 ARG H 1 21 ARG QG . . 3.860 3.293 2.081 3.939 0.079 18 0 "[ . 1 . 2]" 1
430 1 21 ARG H 1 22 ASN H . . 5.560 3.087 2.880 4.026 . 0 0 "[ . 1 . 2]" 1
431 1 21 ARG H 1 97 TYR HE2 . . 5.480 4.310 3.252 5.504 0.024 13 0 "[ . 1 . 2]" 1
432 1 21 ARG HA 1 21 ARG HD2 . . 4.300 3.117 2.161 4.026 . 0 0 "[ . 1 . 2]" 1
433 1 21 ARG HA 1 21 ARG QD . . 3.550 2.501 2.142 3.515 . 0 0 "[ . 1 . 2]" 1
434 1 21 ARG HA 1 21 ARG HD3 . . 4.300 3.298 2.485 3.946 . 0 0 "[ . 1 . 2]" 1
435 1 21 ARG HA 1 22 ASN H . . 3.320 2.490 2.307 2.760 . 0 0 "[ . 1 . 2]" 1
436 1 21 ARG HA 1 97 TYR QD . . 5.600 3.499 3.093 3.917 . 0 0 "[ . 1 . 2]" 1
437 1 21 ARG HA 1 97 TYR HE1 . . 5.110 3.828 3.310 4.381 . 0 0 "[ . 1 . 2]" 1
438 1 21 ARG HA 1 97 TYR HE2 . . 4.660 3.313 2.882 3.556 . 0 0 "[ . 1 . 2]" 1
439 1 21 ARG QB 1 21 ARG QD . . 3.210 2.643 2.298 2.982 . 0 0 "[ . 1 . 2]" 1
440 1 21 ARG QB 1 21 ARG QG . . 2.180 2.006 1.979 2.048 . 0 0 "[ . 1 . 2]" 1
441 1 21 ARG QD 1 73 LEU QD . . 5.130 3.000 2.016 4.662 . 0 0 "[ . 1 . 2]" 1
442 1 21 ARG HE 1 21 ARG QG . . 3.600 3.021 2.584 3.487 . 0 0 "[ . 1 . 2]" 1
443 1 21 ARG HE 1 22 ASN H . . 5.360 5.346 5.122 5.466 0.106 18 0 "[ . 1 . 2]" 1
444 1 21 ARG HE 1 73 LEU QD . . 4.710 3.150 2.035 4.422 . 0 0 "[ . 1 . 2]" 1
445 1 21 ARG HE 1 73 LEU HG . . 4.740 3.953 3.015 4.754 0.014 2 0 "[ . 1 . 2]" 1
446 1 21 ARG HE 1 76 ALA H . . 6.000 5.947 5.647 6.156 0.156 18 0 "[ . 1 . 2]" 1
447 1 21 ARG HE 1 97 TYR HE1 . . 5.670 4.512 2.925 5.199 . 0 0 "[ . 1 . 2]" 1
448 1 21 ARG HE 1 97 TYR HE2 . . 5.730 3.288 2.526 4.366 . 0 0 "[ . 1 . 2]" 1
449 1 21 ARG QG 1 22 ASN H . . 4.810 4.608 4.108 4.866 0.056 16 0 "[ . 1 . 2]" 1
450 1 22 ASN H 1 22 ASN HD21 . . 5.250 3.676 2.247 4.396 . 0 0 "[ . 1 . 2]" 1
451 1 22 ASN H 1 22 ASN QD . . 4.410 3.385 2.222 3.906 . 0 0 "[ . 1 . 2]" 1
452 1 22 ASN H 1 22 ASN HD22 . . 5.250 4.066 3.277 5.332 0.082 19 0 "[ . 1 . 2]" 1
453 1 22 ASN H 1 23 CYS H . . 5.240 3.330 2.371 4.566 . 0 0 "[ . 1 . 2]" 1
454 1 22 ASN H 1 73 LEU QD . . 4.390 4.106 3.429 4.431 0.041 18 0 "[ . 1 . 2]" 1
455 1 22 ASN H 1 97 TYR QB . . 4.570 3.294 2.907 3.670 . 0 0 "[ . 1 . 2]" 1
456 1 22 ASN H 1 97 TYR QD . . 4.430 2.652 2.405 2.934 . 0 0 "[ . 1 . 2]" 1
457 1 22 ASN H 1 98 ALA H . . 6.000 5.595 5.114 5.933 . 0 0 "[ . 1 . 2]" 1
458 1 22 ASN HA 1 22 ASN QD . . 4.540 4.130 3.929 4.249 . 0 0 "[ . 1 . 2]" 1
459 1 22 ASN HA 1 73 LEU MD1 . . 4.160 3.972 3.004 4.234 0.074 12 0 "[ . 1 . 2]" 1
460 1 22 ASN HA 1 73 LEU QD . . 3.600 3.214 2.831 3.632 0.032 19 0 "[ . 1 . 2]" 1
461 1 22 ASN HA 1 73 LEU MD2 . . 4.160 3.528 2.879 4.188 0.028 19 0 "[ . 1 . 2]" 1
462 1 22 ASN QB 1 23 CYS H . . 3.360 2.396 1.948 3.472 0.112 18 0 "[ . 1 . 2]" 1
463 1 22 ASN QB 1 24 PHE H . . 5.560 2.975 2.299 3.836 . 0 0 "[ . 1 . 2]" 1
464 1 22 ASN QB 1 97 TYR QD . . 5.810 3.198 2.257 4.345 . 0 0 "[ . 1 . 2]" 1
465 1 22 ASN QB 1 98 ALA MB . . 5.170 4.817 4.297 5.239 0.069 9 0 "[ . 1 . 2]" 1
466 1 22 ASN HB2 1 23 CYS H . . 4.170 2.653 1.973 4.247 0.077 19 0 "[ . 1 . 2]" 1
467 1 22 ASN HB3 1 23 CYS H . . 4.170 3.230 2.064 4.161 . 0 0 "[ . 1 . 2]" 1
468 1 22 ASN QD 1 24 PHE H . . 5.160 3.664 2.360 4.070 . 0 0 "[ . 1 . 2]" 1
469 1 22 ASN QD 1 24 PHE QD . . 5.810 3.810 2.204 4.790 . 0 0 "[ . 1 . 2]" 1
470 1 22 ASN QD 1 97 TYR HA . . 5.440 4.600 3.879 5.038 . 0 0 "[ . 1 . 2]" 1
471 1 22 ASN QD 1 97 TYR QB . . 3.670 2.978 2.177 3.689 0.019 19 0 "[ . 1 . 2]" 1
472 1 22 ASN QD 1 98 ALA H . . 4.370 3.744 3.233 4.047 . 0 0 "[ . 1 . 2]" 1
473 1 22 ASN QD 1 98 ALA HA . . 5.640 4.564 4.403 4.765 . 0 0 "[ . 1 . 2]" 1
474 1 22 ASN QD 1 98 ALA MB . . 4.380 3.632 2.660 4.091 . 0 0 "[ . 1 . 2]" 1
475 1 22 ASN QD 1 100 ARG H . . 5.810 4.872 4.391 5.781 . 0 0 "[ . 1 . 2]" 1
476 1 22 ASN HD21 1 98 ALA H . . 5.200 4.474 3.847 5.288 0.088 14 0 "[ . 1 . 2]" 1
477 1 22 ASN HD22 1 98 ALA H . . 5.200 4.589 3.288 5.290 0.090 8 0 "[ . 1 . 2]" 1
478 1 23 CYS H 1 23 CYS QB . . 3.410 3.173 2.567 3.510 0.100 3 0 "[ . 1 . 2]" 1
479 1 23 CYS H 1 24 PHE H . . 4.370 2.180 1.789 2.637 . 0 0 "[ . 1 . 2]" 1
480 1 23 CYS H 1 24 PHE HA . . 6.000 4.720 4.469 5.122 . 0 0 "[ . 1 . 2]" 1
481 1 23 CYS H 1 24 PHE QD . . 4.820 4.021 3.131 4.871 0.051 19 0 "[ . 1 . 2]" 1
482 1 23 CYS H 1 25 ILE MD . . 5.690 4.923 4.299 5.721 0.031 8 0 "[ . 1 . 2]" 1
483 1 23 CYS H 1 73 LEU MD1 . . 4.590 4.186 3.455 4.617 0.027 14 0 "[ . 1 . 2]" 1
484 1 23 CYS H 1 73 LEU QD . . 4.020 3.770 3.362 4.034 0.014 17 0 "[ . 1 . 2]" 1
485 1 23 CYS H 1 73 LEU MD2 . . 4.590 4.440 3.750 4.623 0.033 18 0 "[ . 1 . 2]" 1
486 1 23 CYS HA 1 70 TYR H . . 5.260 4.233 3.977 4.639 . 0 0 "[ . 1 . 2]" 1
487 1 23 CYS HA 1 70 TYR QB . . 5.720 4.054 3.838 4.293 . 0 0 "[ . 1 . 2]" 1
488 1 23 CYS HA 1 73 LEU MD1 . . 4.790 3.135 2.381 4.172 . 0 0 "[ . 1 . 2]" 1
489 1 23 CYS HA 1 73 LEU QD . . 4.170 2.938 2.370 3.681 . 0 0 "[ . 1 . 2]" 1
490 1 23 CYS HA 1 73 LEU MD2 . . 4.790 4.176 3.442 4.814 0.024 19 0 "[ . 1 . 2]" 1
491 1 23 CYS HA 1 76 ALA H . . 5.180 5.205 5.044 5.249 0.069 6 0 "[ . 1 . 2]" 1
492 1 23 CYS HA 1 76 ALA MB . . 3.530 2.732 2.491 2.850 . 0 0 "[ . 1 . 2]" 1
493 1 23 CYS QB 1 24 PHE H . . 3.950 3.551 2.657 3.875 . 0 0 "[ . 1 . 2]" 1
494 1 23 CYS QB 1 24 PHE QD . . 4.460 4.373 3.662 4.517 0.057 8 0 "[ . 1 . 2]" 1
495 1 23 CYS QB 1 24 PHE QE . . 5.110 5.079 4.780 5.147 0.037 17 0 "[ . 1 . 2]" 1
496 1 23 CYS QB 1 70 TYR H . . 3.950 3.542 3.135 4.036 0.086 4 0 "[ . 1 . 2]" 1
497 1 23 CYS QB 1 70 TYR QB . . 5.610 4.370 4.067 4.637 . 0 0 "[ . 1 . 2]" 1
498 1 23 CYS QB 1 73 LEU QB . . 4.990 4.998 4.839 5.041 0.051 10 0 "[ . 1 . 2]" 1
499 1 23 CYS QB 1 73 LEU HG . . 4.610 3.753 3.309 4.280 . 0 0 "[ . 1 . 2]" 1
500 1 23 CYS HB2 1 24 PHE H . . 4.820 4.034 3.364 4.404 . 0 0 "[ . 1 . 2]" 1
501 1 23 CYS HB3 1 24 PHE H . . 4.820 4.046 2.695 4.478 . 0 0 "[ . 1 . 2]" 1
502 1 24 PHE H 1 24 PHE QB . . 3.280 2.463 2.339 2.537 . 0 0 "[ . 1 . 2]" 1
503 1 24 PHE H 1 24 PHE QD . . 3.710 2.691 2.510 2.899 . 0 0 "[ . 1 . 2]" 1
504 1 24 PHE H 1 24 PHE QE . . 5.030 4.833 4.629 5.040 0.010 13 0 "[ . 1 . 2]" 1
505 1 24 PHE H 1 25 ILE H . . 5.710 4.514 4.409 4.588 . 0 0 "[ . 1 . 2]" 1
506 1 24 PHE H 1 25 ILE HA . . 5.650 5.357 5.231 5.586 . 0 0 "[ . 1 . 2]" 1
507 1 24 PHE H 1 25 ILE MD . . 6.000 4.409 4.271 4.549 . 0 0 "[ . 1 . 2]" 1
508 1 24 PHE H 1 76 ALA MB . . 4.540 4.566 4.479 4.618 0.078 4 0 "[ . 1 . 2]" 1
509 1 24 PHE H 1 98 ALA H . . 6.000 4.403 4.209 4.755 . 0 0 "[ . 1 . 2]" 1
510 1 24 PHE H 1 98 ALA MB . . 4.470 4.016 3.602 4.250 . 0 0 "[ . 1 . 2]" 1
511 1 24 PHE HA 1 24 PHE QE . . 6.000 4.871 4.801 4.958 . 0 0 "[ . 1 . 2]" 1
512 1 24 PHE HA 1 25 ILE H . . 3.450 2.156 2.065 2.205 . 0 0 "[ . 1 . 2]" 1
513 1 24 PHE HA 1 25 ILE HB . . 5.640 4.976 4.887 5.063 . 0 0 "[ . 1 . 2]" 1
514 1 24 PHE HA 1 25 ILE MD . . 6.000 3.586 3.491 3.716 . 0 0 "[ . 1 . 2]" 1
515 1 24 PHE HA 1 25 ILE QG . . 5.240 3.467 3.368 3.532 . 0 0 "[ . 1 . 2]" 1
516 1 24 PHE HA 1 68 VAL H . . 6.000 4.428 4.295 4.548 . 0 0 "[ . 1 . 2]" 1
517 1 24 PHE HA 1 69 GLU H . . 6.000 4.756 4.691 4.870 . 0 0 "[ . 1 . 2]" 1
518 1 24 PHE HA 1 69 GLU HA . . 5.520 2.267 2.171 2.419 . 0 0 "[ . 1 . 2]" 1
519 1 24 PHE HA 1 70 TYR H . . 4.470 3.739 3.518 3.937 . 0 0 "[ . 1 . 2]" 1
520 1 24 PHE HA 1 70 TYR QD . . 6.000 4.695 4.550 4.838 . 0 0 "[ . 1 . 2]" 1
521 1 24 PHE HA 1 76 ALA MB . . 5.390 4.565 4.409 4.661 . 0 0 "[ . 1 . 2]" 1
522 1 24 PHE HA 1 98 ALA MB . . 4.800 3.867 3.738 4.158 . 0 0 "[ . 1 . 2]" 1
523 1 24 PHE QB 1 25 ILE H . . 4.360 2.788 2.639 3.028 . 0 0 "[ . 1 . 2]" 1
524 1 24 PHE QB 1 25 ILE MD . . 4.580 4.461 4.388 4.571 . 0 0 "[ . 1 . 2]" 1
525 1 24 PHE QB 1 25 ILE QG . . 5.200 4.619 4.520 4.755 . 0 0 "[ . 1 . 2]" 1
526 1 24 PHE QB 1 67 VAL QG . . 3.780 2.524 2.414 2.643 . 0 0 "[ . 1 . 2]" 1
527 1 24 PHE QB 1 68 VAL H . . 3.860 3.913 3.891 3.929 0.069 18 0 "[ . 1 . 2]" 1
528 1 24 PHE QB 1 98 ALA H . . 4.440 3.173 2.931 3.531 . 0 0 "[ . 1 . 2]" 1
529 1 24 PHE QB 1 98 ALA MB . . 3.220 1.906 1.840 1.957 . 0 0 "[ . 1 . 2]" 1
530 1 24 PHE HB2 1 98 ALA H . . 5.300 3.391 3.102 3.874 . 0 0 "[ . 1 . 2]" 1
531 1 24 PHE HB2 1 98 ALA MB . . 3.740 2.138 1.946 2.306 . 0 0 "[ . 1 . 2]" 1
532 1 24 PHE HB3 1 98 ALA H . . 5.300 3.836 3.609 4.069 . 0 0 "[ . 1 . 2]" 1
533 1 24 PHE HB3 1 98 ALA MB . . 3.740 2.180 2.056 2.375 . 0 0 "[ . 1 . 2]" 1
534 1 24 PHE QD 1 25 ILE H . . 5.470 3.954 3.821 4.105 . 0 0 "[ . 1 . 2]" 1
535 1 24 PHE QD 1 67 VAL MG1 . . 4.420 2.271 2.213 2.302 . 0 0 "[ . 1 . 2]" 1
536 1 24 PHE QD 1 67 VAL QG . . 3.400 2.265 2.208 2.295 . 0 0 "[ . 1 . 2]" 1
537 1 24 PHE QD 1 67 VAL MG2 . . 4.420 4.491 4.483 4.500 0.080 1 0 "[ . 1 . 2]" 1
538 1 24 PHE QD 1 68 VAL H . . 5.770 4.232 3.999 4.394 . 0 0 "[ . 1 . 2]" 1
539 1 24 PHE QD 1 69 GLU H . . 5.310 4.966 4.845 5.074 . 0 0 "[ . 1 . 2]" 1
540 1 24 PHE QD 1 69 GLU HA . . 4.870 3.771 3.648 3.845 . 0 0 "[ . 1 . 2]" 1
541 1 24 PHE QD 1 69 GLU QB . . 4.040 2.591 2.446 2.793 . 0 0 "[ . 1 . 2]" 1
542 1 24 PHE QD 1 69 GLU QG . . 4.330 3.025 2.864 3.183 . 0 0 "[ . 1 . 2]" 1
543 1 24 PHE QD 1 98 ALA MB . . 4.490 3.505 3.415 3.596 . 0 0 "[ . 1 . 2]" 1
544 1 24 PHE QD 1 100 ARG QD . . 5.810 5.838 5.812 5.860 0.050 7 0 "[ . 1 . 2]" 1
545 1 24 PHE QE 1 51 ASN QB . . 5.810 4.612 4.457 4.857 . 0 0 "[ . 1 . 2]" 1
546 1 24 PHE QE 1 67 VAL HB . . 6.000 5.786 5.561 5.913 . 0 0 "[ . 1 . 2]" 1
547 1 24 PHE QE 1 67 VAL QG . . 4.330 3.558 3.413 3.654 . 0 0 "[ . 1 . 2]" 1
548 1 24 PHE QE 1 69 GLU HB2 . . 4.220 3.120 3.015 3.228 . 0 0 "[ . 1 . 2]" 1
549 1 24 PHE QE 1 69 GLU QB . . 3.660 3.044 2.954 3.134 . 0 0 "[ . 1 . 2]" 1
550 1 24 PHE QE 1 69 GLU HB3 . . 4.220 4.241 4.229 4.256 0.036 2 0 "[ . 1 . 2]" 1
551 1 24 PHE QE 1 69 GLU HG2 . . 4.330 3.718 3.403 4.065 . 0 0 "[ . 1 . 2]" 1
552 1 24 PHE QE 1 69 GLU QG . . 3.520 2.619 2.531 2.763 . 0 0 "[ . 1 . 2]" 1
553 1 24 PHE QE 1 69 GLU HG3 . . 4.330 2.680 2.581 2.811 . 0 0 "[ . 1 . 2]" 1
554 1 24 PHE QE 1 98 ALA MB . . 5.670 4.953 4.858 5.073 . 0 0 "[ . 1 . 2]" 1
555 1 24 PHE QE 1 100 ARG QD . . 5.090 5.188 5.152 5.221 0.131 17 0 "[ . 1 . 2]" 1
556 1 24 PHE QE 1 101 ASP HA . . 4.040 2.373 2.252 2.701 . 0 0 "[ . 1 . 2]" 1
557 1 24 PHE QE 1 101 ASP QB . . 5.810 3.998 3.615 4.383 . 0 0 "[ . 1 . 2]" 1
558 1 25 ILE H 1 25 ILE HB . . 3.870 2.888 2.818 2.959 . 0 0 "[ . 1 . 2]" 1
559 1 25 ILE H 1 25 ILE MD . . 5.130 2.989 2.816 3.114 . 0 0 "[ . 1 . 2]" 1
560 1 25 ILE H 1 25 ILE HG12 . . 4.570 2.223 2.082 2.338 . 0 0 "[ . 1 . 2]" 1
561 1 25 ILE H 1 25 ILE HG13 . . 4.570 3.766 3.639 3.865 . 0 0 "[ . 1 . 2]" 1
562 1 25 ILE H 1 25 ILE MG . . 4.560 3.875 3.814 3.914 . 0 0 "[ . 1 . 2]" 1
563 1 25 ILE H 1 26 TYR H . . 6.000 4.433 4.379 4.489 . 0 0 "[ . 1 . 2]" 1
564 1 25 ILE H 1 67 VAL HA . . 6.000 4.659 4.529 4.884 . 0 0 "[ . 1 . 2]" 1
565 1 25 ILE H 1 67 VAL QG . . 4.700 3.396 3.213 3.633 . 0 0 "[ . 1 . 2]" 1
566 1 25 ILE H 1 68 VAL H . . 4.470 2.815 2.697 3.003 . 0 0 "[ . 1 . 2]" 1
567 1 25 ILE H 1 68 VAL HA . . 6.000 4.591 4.546 4.693 . 0 0 "[ . 1 . 2]" 1
568 1 25 ILE H 1 68 VAL HB . . 4.800 3.495 3.345 3.577 . 0 0 "[ . 1 . 2]" 1
569 1 25 ILE H 1 68 VAL MG1 . . 6.000 4.236 4.141 4.316 . 0 0 "[ . 1 . 2]" 1
570 1 25 ILE H 1 68 VAL QG . . 5.250 3.928 3.846 3.974 . 0 0 "[ . 1 . 2]" 1
571 1 25 ILE H 1 68 VAL MG2 . . 6.000 4.649 4.564 4.737 . 0 0 "[ . 1 . 2]" 1
572 1 25 ILE H 1 69 GLU H . . 6.000 4.626 4.569 4.738 . 0 0 "[ . 1 . 2]" 1
573 1 25 ILE H 1 69 GLU HA . . 4.890 3.335 3.231 3.491 . 0 0 "[ . 1 . 2]" 1
574 1 25 ILE H 1 70 TYR H . . 5.780 4.990 4.695 5.188 . 0 0 "[ . 1 . 2]" 1
575 1 25 ILE H 1 70 TYR QD . . 6.000 4.302 4.088 4.430 . 0 0 "[ . 1 . 2]" 1
576 1 25 ILE H 1 70 TYR QE . . 6.000 5.525 5.227 5.661 . 0 0 "[ . 1 . 2]" 1
577 1 25 ILE H 1 98 ALA H . . 6.000 4.225 4.007 4.548 . 0 0 "[ . 1 . 2]" 1
578 1 25 ILE H 1 98 ALA MB . . 4.980 3.493 3.111 4.264 . 0 0 "[ . 1 . 2]" 1
579 1 25 ILE HA 1 25 ILE MD . . 3.550 2.477 2.393 2.540 . 0 0 "[ . 1 . 2]" 1
580 1 25 ILE HA 1 26 TYR H . . 3.430 2.161 2.138 2.187 . 0 0 "[ . 1 . 2]" 1
581 1 25 ILE HA 1 26 TYR QB . . 5.570 4.042 3.959 4.103 . 0 0 "[ . 1 . 2]" 1
582 1 25 ILE HA 1 95 ILE MG . . 5.570 4.366 4.220 4.699 . 0 0 "[ . 1 . 2]" 1
583 1 25 ILE HA 1 96 SER H . . 5.500 4.604 4.483 4.734 . 0 0 "[ . 1 . 2]" 1
584 1 25 ILE HA 1 98 ALA H . . 3.490 2.852 2.585 3.276 . 0 0 "[ . 1 . 2]" 1
585 1 25 ILE HA 1 98 ALA MB . . 4.910 3.558 3.209 4.209 . 0 0 "[ . 1 . 2]" 1
586 1 25 ILE HB 1 26 TYR H . . 4.430 3.754 3.600 3.880 . 0 0 "[ . 1 . 2]" 1
587 1 25 ILE HB 1 68 VAL H . . 4.310 3.039 2.988 3.096 . 0 0 "[ . 1 . 2]" 1
588 1 25 ILE HB 1 68 VAL HB . . 3.830 2.137 2.101 2.170 . 0 0 "[ . 1 . 2]" 1
589 1 25 ILE HB 1 68 VAL MG1 . . 5.120 3.734 3.692 3.770 . 0 0 "[ . 1 . 2]" 1
590 1 25 ILE HB 1 68 VAL QG . . 4.440 2.993 2.923 3.069 . 0 0 "[ . 1 . 2]" 1
591 1 25 ILE HB 1 68 VAL MG2 . . 5.120 3.152 3.054 3.257 . 0 0 "[ . 1 . 2]" 1
592 1 25 ILE HB 1 70 TYR QE . . 4.590 4.377 4.087 4.531 . 0 0 "[ . 1 . 2]" 1
593 1 25 ILE HB 1 98 ALA H . . 6.000 5.466 5.313 5.798 . 0 0 "[ . 1 . 2]" 1
594 1 25 ILE MD 1 25 ILE MG . . 3.310 2.199 2.154 2.254 . 0 0 "[ . 1 . 2]" 1
595 1 25 ILE MD 1 26 TYR H . . 4.810 4.317 4.224 4.368 . 0 0 "[ . 1 . 2]" 1
596 1 25 ILE MD 1 43 PHE QD . . 4.810 4.777 4.651 4.827 0.017 8 0 "[ . 1 . 2]" 1
597 1 25 ILE MD 1 43 PHE QE . . 4.650 4.021 3.967 4.090 . 0 0 "[ . 1 . 2]" 1
598 1 25 ILE MD 1 68 VAL H . . 5.020 4.993 4.924 5.037 0.017 13 0 "[ . 1 . 2]" 1
599 1 25 ILE MD 1 70 TYR QD . . 4.300 2.340 2.254 2.451 . 0 0 "[ . 1 . 2]" 1
600 1 25 ILE MD 1 70 TYR QE . . 4.540 3.527 3.231 3.662 . 0 0 "[ . 1 . 2]" 1
601 1 25 ILE MD 1 76 ALA HA . . 4.530 1.983 1.933 2.035 . 0 0 "[ . 1 . 2]" 1
602 1 25 ILE MD 1 77 ASP H . . 6.000 4.325 4.234 4.405 . 0 0 "[ . 1 . 2]" 1
603 1 25 ILE MD 1 79 CYS QB . . 4.370 2.633 2.440 2.879 . 0 0 "[ . 1 . 2]" 1
604 1 25 ILE MD 1 80 ILE MD . . 3.450 2.676 2.096 3.104 . 0 0 "[ . 1 . 2]" 1
605 1 25 ILE MD 1 80 ILE QG . . 3.820 3.021 2.561 3.729 . 0 0 "[ . 1 . 2]" 1
606 1 25 ILE MD 1 95 ILE MG . . 5.030 4.287 4.025 4.493 . 0 0 "[ . 1 . 2]" 1
607 1 25 ILE MD 1 96 SER H . . 5.790 5.750 5.474 5.814 0.024 16 0 "[ . 1 . 2]" 1
608 1 25 ILE MD 1 97 TYR H . . 5.940 5.889 5.751 5.956 0.016 9 0 "[ . 1 . 2]" 1
609 1 25 ILE MD 1 97 TYR QB . . 5.810 5.067 4.854 5.196 . 0 0 "[ . 1 . 2]" 1
610 1 25 ILE MD 1 97 TYR QD . . 6.000 3.824 3.653 4.062 . 0 0 "[ . 1 . 2]" 1
611 1 25 ILE MD 1 98 ALA H . . 5.360 4.311 4.050 4.729 . 0 0 "[ . 1 . 2]" 1
612 1 25 ILE QG 1 25 ILE MG . . 2.990 2.237 2.194 2.273 . 0 0 "[ . 1 . 2]" 1
613 1 25 ILE QG 1 26 TYR H . . 4.990 4.813 4.745 4.886 . 0 0 "[ . 1 . 2]" 1
614 1 25 ILE QG 1 43 PHE QD . . 5.810 3.523 3.413 3.589 . 0 0 "[ . 1 . 2]" 1
615 1 25 ILE QG 1 43 PHE QE . . 4.330 2.826 2.565 2.967 . 0 0 "[ . 1 . 2]" 1
616 1 25 ILE QG 1 68 VAL H . . 5.190 3.736 3.635 3.817 . 0 0 "[ . 1 . 2]" 1
617 1 25 ILE QG 1 68 VAL QG . . 3.970 2.655 2.588 2.714 . 0 0 "[ . 1 . 2]" 1
618 1 25 ILE QG 1 70 TYR H . . 4.460 4.374 4.024 4.499 0.039 4 0 "[ . 1 . 2]" 1
619 1 25 ILE QG 1 70 TYR QD . . 3.430 2.214 2.165 2.280 . 0 0 "[ . 1 . 2]" 1
620 1 25 ILE QG 1 70 TYR QE . . 3.360 2.390 2.065 2.523 . 0 0 "[ . 1 . 2]" 1
621 1 25 ILE QG 1 76 ALA HA . . 3.400 3.393 3.302 3.443 0.043 14 0 "[ . 1 . 2]" 1
622 1 25 ILE QG 1 79 CYS H . . 5.810 5.103 4.960 5.247 . 0 0 "[ . 1 . 2]" 1
623 1 25 ILE QG 1 80 ILE MD . . 5.510 4.324 3.599 4.771 . 0 0 "[ . 1 . 2]" 1
624 1 25 ILE HG12 1 68 VAL MG1 . . 5.730 2.997 2.903 3.082 . 0 0 "[ . 1 . 2]" 1
625 1 25 ILE HG12 1 68 VAL MG2 . . 5.730 4.177 4.094 4.242 . 0 0 "[ . 1 . 2]" 1
626 1 25 ILE HG12 1 70 TYR QE . . 3.860 3.414 3.094 3.549 . 0 0 "[ . 1 . 2]" 1
627 1 25 ILE HG13 1 68 VAL MG1 . . 5.730 3.140 3.036 3.235 . 0 0 "[ . 1 . 2]" 1
628 1 25 ILE HG13 1 68 VAL MG2 . . 5.730 4.015 3.878 4.126 . 0 0 "[ . 1 . 2]" 1
629 1 25 ILE HG13 1 70 TYR QE . . 3.860 2.441 2.097 2.586 . 0 0 "[ . 1 . 2]" 1
630 1 25 ILE MG 1 26 TYR H . . 3.960 2.607 2.489 2.790 . 0 0 "[ . 1 . 2]" 1
631 1 25 ILE MG 1 26 TYR HA . . 4.800 4.216 4.066 4.345 . 0 0 "[ . 1 . 2]" 1
632 1 25 ILE MG 1 26 TYR QB . . 5.360 4.233 4.106 4.323 . 0 0 "[ . 1 . 2]" 1
633 1 25 ILE MG 1 27 CYS H . . 5.680 4.707 4.463 4.891 . 0 0 "[ . 1 . 2]" 1
634 1 25 ILE MG 1 43 PHE QB . . 5.660 5.614 5.536 5.702 0.042 19 0 "[ . 1 . 2]" 1
635 1 25 ILE MG 1 43 PHE QD . . 6.000 4.046 3.989 4.124 . 0 0 "[ . 1 . 2]" 1
636 1 25 ILE MG 1 43 PHE HZ . . 4.450 3.214 3.100 3.334 . 0 0 "[ . 1 . 2]" 1
637 1 25 ILE MG 1 68 VAL H . . 5.290 4.470 4.406 4.541 . 0 0 "[ . 1 . 2]" 1
638 1 25 ILE MG 1 68 VAL HB . . 3.490 3.517 3.496 3.534 0.044 12 0 "[ . 1 . 2]" 1
639 1 25 ILE MG 1 68 VAL MG1 . . 4.200 4.232 4.215 4.241 0.041 6 0 "[ . 1 . 2]" 1
640 1 25 ILE MG 1 68 VAL MG2 . . 4.200 3.871 3.752 3.967 . 0 0 "[ . 1 . 2]" 1
641 1 25 ILE MG 1 70 TYR QD . . 4.460 4.479 4.463 4.498 0.038 9 0 "[ . 1 . 2]" 1
642 1 25 ILE MG 1 70 TYR QE . . 4.170 4.010 3.681 4.143 . 0 0 "[ . 1 . 2]" 1
643 1 25 ILE MG 1 76 ALA HA . . 5.000 4.341 4.189 4.555 . 0 0 "[ . 1 . 2]" 1
644 1 25 ILE MG 1 79 CYS H . . 5.430 4.792 4.635 5.165 . 0 0 "[ . 1 . 2]" 1
645 1 25 ILE MG 1 80 ILE MD . . 4.090 2.421 2.058 2.774 . 0 0 "[ . 1 . 2]" 1
646 1 25 ILE MG 1 80 ILE QG . . 3.760 2.245 2.141 2.596 . 0 0 "[ . 1 . 2]" 1
647 1 25 ILE MG 1 80 ILE MG . . 4.180 4.211 4.190 4.249 0.069 5 0 "[ . 1 . 2]" 1
648 1 25 ILE MG 1 97 TYR QD . . 6.000 4.884 4.730 5.063 . 0 0 "[ . 1 . 2]" 1
649 1 26 TYR H 1 26 TYR HB2 . . 4.090 2.930 2.831 3.074 . 0 0 "[ . 1 . 2]" 1
650 1 26 TYR H 1 26 TYR HB3 . . 4.090 2.514 2.466 2.545 . 0 0 "[ . 1 . 2]" 1
651 1 26 TYR H 1 26 TYR QD . . 5.340 4.222 4.141 4.260 . 0 0 "[ . 1 . 2]" 1
652 1 26 TYR H 1 27 CYS H . . 5.770 4.435 4.367 4.482 . 0 0 "[ . 1 . 2]" 1
653 1 26 TYR H 1 27 CYS HA . . 5.710 5.020 4.916 5.122 . 0 0 "[ . 1 . 2]" 1
654 1 26 TYR H 1 67 VAL QG . . 5.920 4.628 4.519 4.724 . 0 0 "[ . 1 . 2]" 1
655 1 26 TYR H 1 80 ILE MD . . 6.000 3.990 3.741 4.197 . 0 0 "[ . 1 . 2]" 1
656 1 26 TYR H 1 80 ILE MG . . 6.000 5.711 5.623 5.864 . 0 0 "[ . 1 . 2]" 1
657 1 26 TYR H 1 95 ILE HA . . 5.980 4.791 4.720 4.850 . 0 0 "[ . 1 . 2]" 1
658 1 26 TYR H 1 96 SER H . . 4.610 3.073 3.017 3.155 . 0 0 "[ . 1 . 2]" 1
659 1 26 TYR H 1 96 SER QB . . 5.810 4.574 3.789 4.946 . 0 0 "[ . 1 . 2]" 1
660 1 26 TYR H 1 98 ALA H . . 5.510 3.145 2.833 3.380 . 0 0 "[ . 1 . 2]" 1
661 1 26 TYR H 1 98 ALA HA . . 5.480 4.251 4.076 4.595 . 0 0 "[ . 1 . 2]" 1
662 1 26 TYR H 1 98 ALA MB . . 4.870 3.460 3.220 3.961 . 0 0 "[ . 1 . 2]" 1
663 1 26 TYR HA 1 26 TYR QD . . 4.270 2.916 2.761 3.082 . 0 0 "[ . 1 . 2]" 1
664 1 26 TYR HA 1 26 TYR QE . . 5.220 4.727 4.636 4.805 . 0 0 "[ . 1 . 2]" 1
665 1 26 TYR HA 1 27 CYS H . . 3.490 2.252 2.207 2.299 . 0 0 "[ . 1 . 2]" 1
666 1 26 TYR HA 1 65 VAL QG . . 5.620 4.009 3.889 4.092 . 0 0 "[ . 1 . 2]" 1
667 1 26 TYR HA 1 68 VAL H . . 4.130 3.958 3.885 4.041 . 0 0 "[ . 1 . 2]" 1
668 1 26 TYR HA 1 98 ALA H . . 4.770 4.819 4.767 4.861 0.091 14 0 "[ . 1 . 2]" 1
669 1 26 TYR HA 1 98 ALA MB . . 4.580 3.183 2.896 3.637 . 0 0 "[ . 1 . 2]" 1
670 1 26 TYR QB 1 96 SER H . . 4.730 3.303 3.068 3.536 . 0 0 "[ . 1 . 2]" 1
671 1 26 TYR QB 1 96 SER HG . . 5.360 3.406 2.314 4.964 . 0 0 "[ . 1 . 2]" 1
672 1 26 TYR QB 1 98 ALA H . . 4.740 3.296 3.080 3.437 . 0 0 "[ . 1 . 2]" 1
673 1 26 TYR QB 1 98 ALA MB . . 3.890 2.245 2.160 2.367 . 0 0 "[ . 1 . 2]" 1
674 1 26 TYR QB 1 99 ARG H . . 4.670 3.978 3.777 4.335 . 0 0 "[ . 1 . 2]" 1
675 1 26 TYR HB2 1 96 SER H . . 5.570 4.894 4.668 5.117 . 0 0 "[ . 1 . 2]" 1
676 1 26 TYR HB2 1 98 ALA H . . 5.570 3.488 3.255 3.617 . 0 0 "[ . 1 . 2]" 1
677 1 26 TYR HB2 1 98 ALA HA . . 4.350 2.174 2.083 2.364 . 0 0 "[ . 1 . 2]" 1
678 1 26 TYR HB3 1 96 SER H . . 5.570 3.359 3.112 3.604 . 0 0 "[ . 1 . 2]" 1
679 1 26 TYR HB3 1 98 ALA H . . 5.570 4.074 3.615 4.318 . 0 0 "[ . 1 . 2]" 1
680 1 26 TYR HB3 1 98 ALA HA . . 4.350 3.298 2.931 3.563 . 0 0 "[ . 1 . 2]" 1
681 1 26 TYR QD 1 27 CYS H . . 4.780 3.621 3.575 3.666 . 0 0 "[ . 1 . 2]" 1
682 1 26 TYR QD 1 27 CYS HA . . 5.180 4.082 3.930 4.214 . 0 0 "[ . 1 . 2]" 1
683 1 26 TYR QD 1 28 SER H . . 5.530 4.668 4.435 4.911 . 0 0 "[ . 1 . 2]" 1
684 1 26 TYR QD 1 28 SER HA . . 6.000 5.522 5.395 5.705 . 0 0 "[ . 1 . 2]" 1
685 1 26 TYR QD 1 28 SER QB . . 4.160 3.451 3.240 3.786 . 0 0 "[ . 1 . 2]" 1
686 1 26 TYR QD 1 55 LYS QE . . 5.260 5.183 4.756 5.275 0.015 19 0 "[ . 1 . 2]" 1
687 1 26 TYR QD 1 65 VAL MG1 . . 4.750 3.414 3.391 3.436 . 0 0 "[ . 1 . 2]" 1
688 1 26 TYR QD 1 65 VAL QG . . 3.310 3.325 3.312 3.338 0.028 6 0 "[ . 1 . 2]" 1
689 1 26 TYR QD 1 65 VAL MG2 . . 4.750 4.579 4.532 4.653 . 0 0 "[ . 1 . 2]" 1
690 1 26 TYR QD 1 67 VAL HA . . 5.720 4.420 4.329 4.570 . 0 0 "[ . 1 . 2]" 1
691 1 26 TYR QD 1 67 VAL QG . . 3.710 2.659 2.489 2.783 . 0 0 "[ . 1 . 2]" 1
692 1 26 TYR QD 1 95 ILE HA . . 6.000 4.251 4.114 4.410 . 0 0 "[ . 1 . 2]" 1
693 1 26 TYR QD 1 96 SER H . . 5.360 3.815 3.748 3.865 . 0 0 "[ . 1 . 2]" 1
694 1 26 TYR QD 1 96 SER QB . . 4.760 3.882 2.779 4.435 . 0 0 "[ . 1 . 2]" 1
695 1 26 TYR QD 1 96 SER HG . . 5.340 3.428 2.294 5.350 0.010 5 0 "[ . 1 . 2]" 1
696 1 26 TYR QD 1 97 TYR H . . 5.930 5.957 5.898 5.988 0.058 13 0 "[ . 1 . 2]" 1
697 1 26 TYR QD 1 98 ALA HA . . 4.800 3.523 3.446 3.696 . 0 0 "[ . 1 . 2]" 1
698 1 26 TYR QD 1 98 ALA MB . . 4.280 2.989 2.673 3.550 . 0 0 "[ . 1 . 2]" 1
699 1 26 TYR QD 1 99 ARG H . . 5.690 4.772 4.684 4.951 . 0 0 "[ . 1 . 2]" 1
700 1 26 TYR QE 1 27 CYS H . . 6.000 4.620 4.538 4.697 . 0 0 "[ . 1 . 2]" 1
701 1 26 TYR QE 1 27 CYS HA . . 5.970 5.312 5.141 5.438 . 0 0 "[ . 1 . 2]" 1
702 1 26 TYR QE 1 28 SER H . . 5.960 4.976 4.821 5.188 . 0 0 "[ . 1 . 2]" 1
703 1 26 TYR QE 1 28 SER HA . . 5.340 4.745 4.633 4.911 . 0 0 "[ . 1 . 2]" 1
704 1 26 TYR QE 1 28 SER QB . . 3.460 2.376 2.242 2.550 . 0 0 "[ . 1 . 2]" 1
705 1 26 TYR QE 1 29 ASN H . . 6.000 5.862 5.702 6.001 0.001 3 0 "[ . 1 . 2]" 1
706 1 26 TYR QE 1 55 LYS QD . . 4.520 3.292 2.697 4.533 0.013 17 0 "[ . 1 . 2]" 1
707 1 26 TYR QE 1 55 LYS HE2 . . 5.290 5.220 4.395 5.319 0.029 10 0 "[ . 1 . 2]" 1
708 1 26 TYR QE 1 55 LYS QE . . 4.530 3.772 3.083 3.926 . 0 0 "[ . 1 . 2]" 1
709 1 26 TYR QE 1 55 LYS HE3 . . 5.290 3.870 3.149 4.046 . 0 0 "[ . 1 . 2]" 1
710 1 26 TYR QE 1 55 LYS QG . . 4.780 4.460 3.069 4.793 0.013 16 0 "[ . 1 . 2]" 1
711 1 26 TYR QE 1 65 VAL HA . . 6.000 5.351 5.273 5.434 . 0 0 "[ . 1 . 2]" 1
712 1 26 TYR QE 1 65 VAL MG1 . . 3.840 2.502 2.420 2.641 . 0 0 "[ . 1 . 2]" 1
713 1 26 TYR QE 1 65 VAL MG2 . . 3.840 3.309 3.267 3.387 . 0 0 "[ . 1 . 2]" 1
714 1 26 TYR QE 1 66 ALA H . . 6.000 5.649 5.566 5.742 . 0 0 "[ . 1 . 2]" 1
715 1 26 TYR QE 1 67 VAL QG . . 4.380 3.793 3.671 3.891 . 0 0 "[ . 1 . 2]" 1
716 1 26 TYR QE 1 94 GLN QB . . 5.810 4.792 4.343 5.271 . 0 0 "[ . 1 . 2]" 1
717 1 26 TYR QE 1 95 ILE HA . . 6.000 5.949 5.823 6.016 0.016 11 0 "[ . 1 . 2]" 1
718 1 26 TYR QE 1 96 SER H . . 6.000 6.010 5.925 6.030 0.030 19 0 "[ . 1 . 2]" 1
719 1 26 TYR QE 1 98 ALA HA . . 6.000 5.325 5.157 5.468 . 0 0 "[ . 1 . 2]" 1
720 1 26 TYR QE 1 98 ALA MB . . 5.610 4.945 4.704 5.395 . 0 0 "[ . 1 . 2]" 1
721 1 26 TYR QE 1 99 ARG H . . 6.000 6.009 5.955 6.030 0.030 13 0 "[ . 1 . 2]" 1
722 1 27 CYS H 1 27 CYS HB2 . . 4.020 3.229 3.092 3.334 . 0 0 "[ . 1 . 2]" 1
723 1 27 CYS H 1 27 CYS HB3 . . 4.020 2.562 2.492 2.651 . 0 0 "[ . 1 . 2]" 1
724 1 27 CYS H 1 27 CYS HG . . 5.340 4.705 4.474 4.843 . 0 0 "[ . 1 . 2]" 1
725 1 27 CYS H 1 28 SER H . . 5.690 4.314 4.272 4.361 . 0 0 "[ . 1 . 2]" 1
726 1 27 CYS H 1 30 LEU QD . . 5.570 4.154 4.087 4.226 . 0 0 "[ . 1 . 2]" 1
727 1 27 CYS H 1 65 VAL HA . . 4.680 4.608 4.538 4.658 . 0 0 "[ . 1 . 2]" 1
728 1 27 CYS H 1 65 VAL MG1 . . 4.630 3.057 2.985 3.112 . 0 0 "[ . 1 . 2]" 1
729 1 27 CYS H 1 65 VAL MG2 . . 4.630 4.672 4.662 4.688 0.058 2 0 "[ . 1 . 2]" 1
730 1 27 CYS H 1 66 ALA H . . 4.330 3.232 3.162 3.300 . 0 0 "[ . 1 . 2]" 1
731 1 27 CYS H 1 66 ALA HA . . 6.000 4.974 4.929 5.021 . 0 0 "[ . 1 . 2]" 1
732 1 27 CYS H 1 66 ALA MB . . 4.570 3.759 3.635 3.878 . 0 0 "[ . 1 . 2]" 1
733 1 27 CYS H 1 67 VAL QG . . 4.580 3.929 3.825 4.067 . 0 0 "[ . 1 . 2]" 1
734 1 27 CYS HA 1 27 CYS HG . . 4.530 2.764 2.454 3.105 . 0 0 "[ . 1 . 2]" 1
735 1 27 CYS HA 1 28 SER H . . 3.380 2.216 2.186 2.237 . 0 0 "[ . 1 . 2]" 1
736 1 27 CYS HA 1 30 LEU QD . . 5.920 4.059 3.945 4.169 . 0 0 "[ . 1 . 2]" 1
737 1 27 CYS HA 1 43 PHE HZ . . 6.000 4.552 4.281 4.778 . 0 0 "[ . 1 . 2]" 1
738 1 27 CYS HA 1 65 VAL QG . . 5.920 4.606 4.533 4.640 . 0 0 "[ . 1 . 2]" 1
739 1 27 CYS HA 1 68 VAL QG . . 5.920 5.616 5.519 5.708 . 0 0 "[ . 1 . 2]" 1
740 1 27 CYS HA 1 93 LEU QB . . 5.810 4.467 4.328 4.580 . 0 0 "[ . 1 . 2]" 1
741 1 27 CYS HA 1 93 LEU QD . . 4.690 4.656 4.566 4.709 0.019 10 0 "[ . 1 . 2]" 1
742 1 27 CYS HA 1 94 GLN H . . 6.000 4.820 4.711 4.920 . 0 0 "[ . 1 . 2]" 1
743 1 27 CYS HA 1 94 GLN QB . . 5.810 4.781 4.472 5.192 . 0 0 "[ . 1 . 2]" 1
744 1 27 CYS HA 1 95 ILE HA . . 4.240 2.435 2.324 2.535 . 0 0 "[ . 1 . 2]" 1
745 1 27 CYS HA 1 95 ILE MD . . 4.540 2.590 2.393 2.742 . 0 0 "[ . 1 . 2]" 1
746 1 27 CYS HA 1 95 ILE QG . . 4.420 4.276 4.158 4.357 . 0 0 "[ . 1 . 2]" 1
747 1 27 CYS HA 1 95 ILE MG . . 4.770 3.171 2.877 3.684 . 0 0 "[ . 1 . 2]" 1
748 1 27 CYS HA 1 96 SER H . . 5.070 3.759 3.677 3.868 . 0 0 "[ . 1 . 2]" 1
749 1 27 CYS QB 1 30 LEU QD . . 4.210 2.895 2.606 3.209 . 0 0 "[ . 1 . 2]" 1
750 1 27 CYS QB 1 43 PHE QE . . 5.050 3.388 3.180 3.681 . 0 0 "[ . 1 . 2]" 1
751 1 27 CYS QB 1 43 PHE HZ . . 3.860 2.521 2.190 2.941 . 0 0 "[ . 1 . 2]" 1
752 1 27 CYS QB 1 65 VAL HA . . 5.740 4.714 4.490 4.941 . 0 0 "[ . 1 . 2]" 1
753 1 27 CYS QB 1 65 VAL QG . . 4.220 4.132 4.011 4.227 0.007 13 0 "[ . 1 . 2]" 1
754 1 27 CYS QB 1 66 ALA H . . 4.320 3.010 2.753 3.243 . 0 0 "[ . 1 . 2]" 1
755 1 27 CYS QB 1 66 ALA MB . . 3.780 2.095 2.052 2.147 . 0 0 "[ . 1 . 2]" 1
756 1 27 CYS QB 1 68 VAL QG . . 4.920 3.259 3.115 3.390 . 0 0 "[ . 1 . 2]" 1
757 1 27 CYS QB 1 95 ILE HA . . 5.540 3.878 3.664 4.110 . 0 0 "[ . 1 . 2]" 1
758 1 27 CYS QB 1 95 ILE MD . . 4.730 2.772 2.489 3.007 . 0 0 "[ . 1 . 2]" 1
759 1 27 CYS HB2 1 28 SER H . . 5.580 4.274 4.172 4.399 . 0 0 "[ . 1 . 2]" 1
760 1 27 CYS HB2 1 28 SER HA . . 6.000 5.984 5.925 6.010 0.010 15 0 "[ . 1 . 2]" 1
761 1 27 CYS HB2 1 43 PHE HZ . . 4.460 2.554 2.214 2.989 . 0 0 "[ . 1 . 2]" 1
762 1 27 CYS HB3 1 28 SER H . . 5.580 4.334 4.237 4.462 . 0 0 "[ . 1 . 2]" 1
763 1 27 CYS HB3 1 28 SER HA . . 6.000 5.104 4.904 5.289 . 0 0 "[ . 1 . 2]" 1
764 1 27 CYS HB3 1 43 PHE HZ . . 4.460 3.895 3.482 4.376 . 0 0 "[ . 1 . 2]" 1
765 1 27 CYS HG 1 28 SER H . . 4.640 2.801 2.633 3.004 . 0 0 "[ . 1 . 2]" 1
766 1 27 CYS HG 1 28 SER HA . . 5.960 4.502 3.726 4.907 . 0 0 "[ . 1 . 2]" 1
767 1 27 CYS HG 1 30 LEU QD . . 3.400 2.830 1.894 3.362 . 0 0 "[ . 1 . 2]" 1
768 1 27 CYS HG 1 42 LEU QD . . 5.920 4.482 4.030 5.043 . 0 0 "[ . 1 . 2]" 1
769 1 27 CYS HG 1 65 VAL HA . . 5.860 5.414 4.489 5.889 0.029 7 0 "[ . 1 . 2]" 1
770 1 27 CYS HG 1 66 ALA H . . 5.150 4.619 3.776 5.116 . 0 0 "[ . 1 . 2]" 1
771 1 27 CYS HG 1 66 ALA MB . . 5.370 4.148 3.609 4.599 . 0 0 "[ . 1 . 2]" 1
772 1 27 CYS HG 1 68 VAL QG . . 5.880 5.628 5.400 5.890 0.010 5 0 "[ . 1 . 2]" 1
773 1 27 CYS HG 1 93 LEU QB . . 3.060 2.784 2.469 3.082 0.022 5 0 "[ . 1 . 2]" 1
774 1 27 CYS HG 1 95 ILE HA . . 5.920 4.412 3.939 5.212 . 0 0 "[ . 1 . 2]" 1
775 1 28 SER H 1 29 ASN H . . 6.000 4.456 4.432 4.485 . 0 0 "[ . 1 . 2]" 1
776 1 28 SER H 1 30 LEU QD . . 5.920 3.456 3.299 3.642 . 0 0 "[ . 1 . 2]" 1
777 1 28 SER H 1 65 VAL HA . . 6.000 4.764 4.693 4.820 . 0 0 "[ . 1 . 2]" 1
778 1 28 SER H 1 65 VAL MG1 . . 6.000 4.959 4.864 5.029 . 0 0 "[ . 1 . 2]" 1
779 1 28 SER H 1 65 VAL QG . . 5.120 4.282 4.231 4.328 . 0 0 "[ . 1 . 2]" 1
780 1 28 SER H 1 65 VAL MG2 . . 6.000 4.682 4.624 4.773 . 0 0 "[ . 1 . 2]" 1
781 1 28 SER H 1 66 ALA H . . 6.000 4.762 4.685 4.823 . 0 0 "[ . 1 . 2]" 1
782 1 28 SER H 1 93 LEU MD1 . . 5.410 4.559 4.233 4.715 . 0 0 "[ . 1 . 2]" 1
783 1 28 SER H 1 93 LEU QD . . 4.740 4.028 3.820 4.165 . 0 0 "[ . 1 . 2]" 1
784 1 28 SER H 1 93 LEU MD2 . . 5.410 4.486 4.305 4.653 . 0 0 "[ . 1 . 2]" 1
785 1 28 SER H 1 94 GLN H . . 4.510 3.007 2.887 3.116 . 0 0 "[ . 1 . 2]" 1
786 1 28 SER H 1 94 GLN HA . . 6.000 4.757 4.656 4.853 . 0 0 "[ . 1 . 2]" 1
787 1 28 SER H 1 94 GLN QB . . 4.310 3.370 3.025 3.913 . 0 0 "[ . 1 . 2]" 1
788 1 28 SER H 1 94 GLN QG . . 5.520 4.774 4.380 5.188 . 0 0 "[ . 1 . 2]" 1
789 1 28 SER H 1 95 ILE HA . . 5.020 3.616 3.512 3.762 . 0 0 "[ . 1 . 2]" 1
790 1 28 SER H 1 95 ILE MD . . 5.280 3.205 2.919 3.470 . 0 0 "[ . 1 . 2]" 1
791 1 28 SER H 1 95 ILE HG12 . . 6.000 4.728 4.585 4.838 . 0 0 "[ . 1 . 2]" 1
792 1 28 SER H 1 95 ILE QG . . 5.270 4.558 4.450 4.647 . 0 0 "[ . 1 . 2]" 1
793 1 28 SER H 1 95 ILE HG13 . . 6.000 5.973 5.798 6.039 0.039 11 0 "[ . 1 . 2]" 1
794 1 28 SER H 1 96 SER H . . 6.000 5.361 5.254 5.472 . 0 0 "[ . 1 . 2]" 1
795 1 28 SER HA 1 29 ASN QB . . 5.810 4.446 4.420 4.471 . 0 0 "[ . 1 . 2]" 1
796 1 28 SER HA 1 30 LEU H . . 4.890 3.190 3.073 3.285 . 0 0 "[ . 1 . 2]" 1
797 1 28 SER HA 1 30 LEU QB . . 5.810 4.769 4.634 4.887 . 0 0 "[ . 1 . 2]" 1
798 1 28 SER HA 1 30 LEU MD1 . . 6.000 2.412 2.273 2.577 . 0 0 "[ . 1 . 2]" 1
799 1 28 SER HA 1 30 LEU QD . . 5.280 2.407 2.269 2.571 . 0 0 "[ . 1 . 2]" 1
800 1 28 SER HA 1 30 LEU MD2 . . 6.000 5.116 4.910 5.242 . 0 0 "[ . 1 . 2]" 1
801 1 28 SER HA 1 30 LEU HG . . 5.810 4.840 4.634 5.102 . 0 0 "[ . 1 . 2]" 1
802 1 28 SER HA 1 65 VAL H . . 6.000 4.862 4.760 4.903 . 0 0 "[ . 1 . 2]" 1
803 1 28 SER HA 1 65 VAL HA . . 4.010 2.291 2.216 2.345 . 0 0 "[ . 1 . 2]" 1
804 1 28 SER HA 1 65 VAL HB . . 6.000 4.829 4.766 4.941 . 0 0 "[ . 1 . 2]" 1
805 1 28 SER HA 1 65 VAL MG1 . . 4.980 3.583 3.491 3.690 . 0 0 "[ . 1 . 2]" 1
806 1 28 SER HA 1 65 VAL QG . . 3.850 2.433 2.321 2.600 . 0 0 "[ . 1 . 2]" 1
807 1 28 SER HA 1 65 VAL MG2 . . 4.980 2.475 2.356 2.665 . 0 0 "[ . 1 . 2]" 1
808 1 28 SER HA 1 66 ALA H . . 4.790 3.536 3.453 3.625 . 0 0 "[ . 1 . 2]" 1
809 1 28 SER HA 1 93 LEU QD . . 5.920 4.564 4.432 4.663 . 0 0 "[ . 1 . 2]" 1
810 1 28 SER HA 1 94 GLN QB . . 5.810 4.811 4.420 5.237 . 0 0 "[ . 1 . 2]" 1
811 1 28 SER QB 1 29 ASN H . . 4.260 3.010 2.328 3.372 . 0 0 "[ . 1 . 2]" 1
812 1 28 SER QB 1 65 VAL HA . . 5.600 3.724 3.400 3.954 . 0 0 "[ . 1 . 2]" 1
813 1 28 SER QB 1 65 VAL QG . . 3.670 2.302 2.033 2.558 . 0 0 "[ . 1 . 2]" 1
814 1 28 SER QB 1 66 ALA H . . 5.810 4.542 4.332 4.710 . 0 0 "[ . 1 . 2]" 1
815 1 29 ASN H 1 30 LEU H . . 4.100 2.619 2.551 2.665 . 0 0 "[ . 1 . 2]" 1
816 1 29 ASN H 1 65 VAL HA . . 5.190 3.835 3.679 3.956 . 0 0 "[ . 1 . 2]" 1
817 1 29 ASN H 1 65 VAL QG . . 4.760 3.211 3.100 3.314 . 0 0 "[ . 1 . 2]" 1
818 1 29 ASN QB 1 29 ASN QD . . 3.080 2.134 2.121 2.147 . 0 0 "[ . 1 . 2]" 1
819 1 29 ASN QB 1 94 GLN H . . 4.200 2.907 2.796 3.056 . 0 0 "[ . 1 . 2]" 1
820 1 29 ASN QB 1 94 GLN QB . . 4.850 3.672 3.521 3.861 . 0 0 "[ . 1 . 2]" 1
821 1 29 ASN QB 1 94 GLN QE . . 5.180 3.672 3.103 4.308 . 0 0 "[ . 1 . 2]" 1
822 1 29 ASN QB 1 94 GLN QG . . 4.750 2.702 2.256 3.147 . 0 0 "[ . 1 . 2]" 1
823 1 29 ASN HB2 1 30 LEU H . . 5.880 4.669 4.653 4.680 . 0 0 "[ . 1 . 2]" 1
824 1 29 ASN HB2 1 94 GLN H . . 4.810 3.933 3.791 4.072 . 0 0 "[ . 1 . 2]" 1
825 1 29 ASN HB3 1 30 LEU H . . 5.880 4.292 4.249 4.324 . 0 0 "[ . 1 . 2]" 1
826 1 29 ASN HB3 1 94 GLN H . . 4.810 2.995 2.879 3.158 . 0 0 "[ . 1 . 2]" 1
827 1 29 ASN QD 1 30 LEU HA . . 5.080 5.124 5.111 5.138 0.058 15 0 "[ . 1 . 2]" 1
828 1 29 ASN QD 1 91 CYS QB . . 4.450 2.388 2.289 2.517 . 0 0 "[ . 1 . 2]" 1
829 1 29 ASN QD 1 92 SER H . . 3.800 2.790 2.412 3.020 . 0 0 "[ . 1 . 2]" 1
830 1 29 ASN QD 1 92 SER QB . . 4.790 3.554 3.307 3.982 . 0 0 "[ . 1 . 2]" 1
831 1 29 ASN QD 1 94 GLN QE . . 5.450 4.257 3.026 5.059 . 0 0 "[ . 1 . 2]" 1
832 1 29 ASN QD 1 94 GLN QG . . 4.680 3.903 3.540 4.134 . 0 0 "[ . 1 . 2]" 1
833 1 29 ASN HD21 1 92 SER H . . 4.320 3.067 2.593 3.303 . 0 0 "[ . 1 . 2]" 1
834 1 29 ASN HD22 1 92 SER H . . 4.320 3.213 2.789 3.506 . 0 0 "[ . 1 . 2]" 1
835 1 30 LEU H 1 30 LEU HB2 . . 4.110 2.601 2.570 2.652 . 0 0 "[ . 1 . 2]" 1
836 1 30 LEU H 1 30 LEU QB . . 3.320 2.549 2.521 2.594 . 0 0 "[ . 1 . 2]" 1
837 1 30 LEU H 1 30 LEU HB3 . . 4.110 3.666 3.644 3.681 . 0 0 "[ . 1 . 2]" 1
838 1 30 LEU H 1 30 LEU MD1 . . 4.190 2.058 2.012 2.114 . 0 0 "[ . 1 . 2]" 1
839 1 30 LEU H 1 30 LEU QD . . 3.640 2.053 2.008 2.108 . 0 0 "[ . 1 . 2]" 1
840 1 30 LEU H 1 30 LEU MD2 . . 4.190 4.149 4.102 4.186 . 0 0 "[ . 1 . 2]" 1
841 1 30 LEU H 1 30 LEU HG . . 3.750 3.339 3.199 3.456 . 0 0 "[ . 1 . 2]" 1
842 1 30 LEU H 1 31 PRO QD . . 5.490 4.494 4.454 4.505 . 0 0 "[ . 1 . 2]" 1
843 1 30 LEU H 1 34 THR HG1 . . 6.000 6.003 5.912 6.028 0.028 17 0 "[ . 1 . 2]" 1
844 1 30 LEU H 1 64 GLY QA . . 4.560 3.070 2.978 3.185 . 0 0 "[ . 1 . 2]" 1
845 1 30 LEU H 1 65 VAL H . . 6.000 4.865 4.787 4.921 . 0 0 "[ . 1 . 2]" 1
846 1 30 LEU H 1 65 VAL HA . . 6.000 3.806 3.740 3.868 . 0 0 "[ . 1 . 2]" 1
847 1 30 LEU H 1 65 VAL QG . . 5.920 4.284 4.191 4.397 . 0 0 "[ . 1 . 2]" 1
848 1 30 LEU HA 1 30 LEU MD1 . . 4.510 3.496 3.417 3.572 . 0 0 "[ . 1 . 2]" 1
849 1 30 LEU HA 1 30 LEU QD . . 3.260 3.177 3.163 3.197 . 0 0 "[ . 1 . 2]" 1
850 1 30 LEU HA 1 30 LEU MD2 . . 4.510 3.654 3.542 3.736 . 0 0 "[ . 1 . 2]" 1
851 1 30 LEU HA 1 30 LEU HG . . 3.950 2.657 2.615 2.701 . 0 0 "[ . 1 . 2]" 1
852 1 30 LEU HA 1 31 PRO QD . . 3.530 2.163 2.106 2.185 . 0 0 "[ . 1 . 2]" 1
853 1 30 LEU HA 1 34 THR HG1 . . 5.740 4.614 4.456 4.709 . 0 0 "[ . 1 . 2]" 1
854 1 30 LEU HA 1 88 TYR QD . . 4.700 3.613 3.427 3.832 . 0 0 "[ . 1 . 2]" 1
855 1 30 LEU HA 1 93 LEU QD . . 3.850 2.042 2.000 2.089 . 0 0 "[ . 1 . 2]" 1
856 1 30 LEU QB 1 30 LEU QD . . 2.570 1.900 1.888 1.914 . 0 0 "[ . 1 . 2]" 1
857 1 30 LEU QB 1 31 PRO QD . . 4.180 2.264 2.165 2.476 . 0 0 "[ . 1 . 2]" 1
858 1 30 LEU QB 1 34 THR HB . . 5.730 3.352 3.233 3.483 . 0 0 "[ . 1 . 2]" 1
859 1 30 LEU QB 1 34 THR HG1 . . 3.900 2.724 2.644 2.816 . 0 0 "[ . 1 . 2]" 1
860 1 30 LEU QB 1 64 GLY H . . 5.480 4.570 4.429 4.828 . 0 0 "[ . 1 . 2]" 1
861 1 30 LEU QB 1 64 GLY QA . . 3.800 2.589 2.460 2.784 . 0 0 "[ . 1 . 2]" 1
862 1 30 LEU QB 1 65 VAL H . . 4.940 4.306 4.119 4.553 . 0 0 "[ . 1 . 2]" 1
863 1 30 LEU QB 1 66 ALA MB . . 5.810 4.208 4.082 4.339 . 0 0 "[ . 1 . 2]" 1
864 1 30 LEU QD 1 31 PRO QD . . 3.590 3.362 3.256 3.514 . 0 0 "[ . 1 . 2]" 1
865 1 30 LEU QD 1 31 PRO QG . . 4.840 4.537 4.433 4.729 . 0 0 "[ . 1 . 2]" 1
866 1 30 LEU QD 1 34 THR H . . 5.920 5.126 4.985 5.346 . 0 0 "[ . 1 . 2]" 1
867 1 30 LEU QD 1 34 THR HG1 . . 4.680 3.663 3.518 3.839 . 0 0 "[ . 1 . 2]" 1
868 1 30 LEU QD 1 34 THR MG . . 3.310 2.040 1.921 2.155 . 0 0 "[ . 1 . 2]" 1
869 1 30 LEU QD 1 38 ASP QB . . 4.260 4.092 3.790 4.312 0.052 19 0 "[ . 1 . 2]" 1
870 1 30 LEU QD 1 43 PHE QE . . 4.740 3.929 3.560 4.314 . 0 0 "[ . 1 . 2]" 1
871 1 30 LEU QD 1 43 PHE HZ . . 5.520 5.047 4.804 5.330 . 0 0 "[ . 1 . 2]" 1
872 1 30 LEU QD 1 55 LYS H . . 4.770 4.799 4.784 4.814 0.044 9 0 "[ . 1 . 2]" 1
873 1 30 LEU QD 1 64 GLY QA . . 4.140 3.301 3.206 3.411 . 0 0 "[ . 1 . 2]" 1
874 1 30 LEU QD 1 65 VAL H . . 5.430 3.491 3.389 3.645 . 0 0 "[ . 1 . 2]" 1
875 1 30 LEU QD 1 65 VAL HA . . 4.610 2.266 2.172 2.358 . 0 0 "[ . 1 . 2]" 1
876 1 30 LEU QD 1 66 ALA H . . 4.000 2.211 2.181 2.234 . 0 0 "[ . 1 . 2]" 1
877 1 30 LEU QD 1 66 ALA HA . . 5.080 3.661 3.588 3.717 . 0 0 "[ . 1 . 2]" 1
878 1 30 LEU QD 1 66 ALA MB . . 3.010 2.068 1.979 2.151 . 0 0 "[ . 1 . 2]" 1
879 1 30 LEU QD 1 88 TYR QD . . 5.740 3.924 3.695 4.303 . 0 0 "[ . 1 . 2]" 1
880 1 30 LEU QD 1 88 TYR QE . . 3.850 3.830 3.693 3.870 0.020 5 0 "[ . 1 . 2]" 1
881 1 30 LEU MD1 1 31 PRO HD2 . . 6.000 4.817 4.730 4.966 . 0 0 "[ . 1 . 2]" 1
882 1 30 LEU MD1 1 31 PRO HD3 . . 6.000 5.513 5.430 5.589 . 0 0 "[ . 1 . 2]" 1
883 1 30 LEU MD1 1 34 THR HG1 . . 5.550 5.227 5.114 5.425 . 0 0 "[ . 1 . 2]" 1
884 1 30 LEU MD1 1 55 LYS H . . 6.000 5.100 5.023 5.217 . 0 0 "[ . 1 . 2]" 1
885 1 30 LEU MD1 1 65 VAL HA . . 6.000 2.272 2.179 2.366 . 0 0 "[ . 1 . 2]" 1
886 1 30 LEU MD1 1 66 ALA H . . 4.620 2.226 2.196 2.248 . 0 0 "[ . 1 . 2]" 1
887 1 30 LEU MD2 1 31 PRO HD2 . . 6.000 3.548 3.410 3.735 . 0 0 "[ . 1 . 2]" 1
888 1 30 LEU MD2 1 31 PRO HD3 . . 6.000 4.875 4.734 5.015 . 0 0 "[ . 1 . 2]" 1
889 1 30 LEU MD2 1 34 THR HG1 . . 5.550 3.741 3.585 3.935 . 0 0 "[ . 1 . 2]" 1
890 1 30 LEU MD2 1 55 LYS H . . 6.000 5.862 5.581 6.015 0.015 10 0 "[ . 1 . 2]" 1
891 1 30 LEU MD2 1 65 VAL HA . . 6.000 4.436 4.192 4.540 . 0 0 "[ . 1 . 2]" 1
892 1 30 LEU MD2 1 66 ALA H . . 4.620 3.803 3.588 3.963 . 0 0 "[ . 1 . 2]" 1
893 1 30 LEU HG 1 34 THR HG1 . . 6.000 5.402 5.332 5.516 . 0 0 "[ . 1 . 2]" 1
894 1 30 LEU HG 1 66 ALA H . . 4.850 4.918 4.903 4.932 0.082 11 0 "[ . 1 . 2]" 1
895 1 30 LEU HG 1 66 ALA MB . . 4.260 4.157 4.043 4.254 . 0 0 "[ . 1 . 2]" 1
896 1 30 LEU HG 1 86 TYR QE . . 6.000 6.042 6.024 6.062 0.062 15 0 "[ . 1 . 2]" 1
897 1 30 LEU HG 1 88 TYR QD . . 6.000 4.446 4.202 4.785 . 0 0 "[ . 1 . 2]" 1
898 1 31 PRO HA 1 93 LEU QD . . 5.240 5.248 5.192 5.289 0.049 5 0 "[ . 1 . 2]" 1
899 1 31 PRO QB 1 34 THR H . . 4.500 4.271 4.204 4.339 . 0 0 "[ . 1 . 2]" 1
900 1 31 PRO QB 1 34 THR HG1 . . 4.300 3.964 3.830 4.177 . 0 0 "[ . 1 . 2]" 1
901 1 31 PRO QB 1 88 TYR QE . . 5.810 4.816 4.309 5.527 . 0 0 "[ . 1 . 2]" 1
902 1 31 PRO QB 1 91 CYS QB . . 5.620 3.420 3.168 4.022 . 0 0 "[ . 1 . 2]" 1
903 1 31 PRO QD 1 34 THR H . . 5.200 4.750 4.617 4.823 . 0 0 "[ . 1 . 2]" 1
904 1 31 PRO QD 1 34 THR HG1 . . 4.230 2.903 2.754 3.016 . 0 0 "[ . 1 . 2]" 1
905 1 31 PRO QD 1 88 TYR QD . . 3.450 2.134 2.060 2.211 . 0 0 "[ . 1 . 2]" 1
906 1 31 PRO QD 1 88 TYR QE . . 3.800 2.924 2.227 3.598 . 0 0 "[ . 1 . 2]" 1
907 1 31 PRO QD 1 91 CYS QB . . 4.250 2.596 2.362 3.327 . 0 0 "[ . 1 . 2]" 1
908 1 31 PRO QD 1 93 LEU QD . . 3.610 2.648 2.591 2.692 . 0 0 "[ . 1 . 2]" 1
909 1 31 PRO HD2 1 88 TYR QD . . 4.040 2.262 2.173 2.381 . 0 0 "[ . 1 . 2]" 1
910 1 31 PRO HD3 1 88 TYR QD . . 4.040 2.662 2.367 2.968 . 0 0 "[ . 1 . 2]" 1
911 1 31 PRO QG 1 34 THR HG1 . . 4.760 2.568 2.434 2.822 . 0 0 "[ . 1 . 2]" 1
912 1 31 PRO QG 1 88 TYR QD . . 4.320 2.839 2.596 2.942 . 0 0 "[ . 1 . 2]" 1
913 1 31 PRO QG 1 88 TYR QE . . 4.490 2.815 2.265 3.540 . 0 0 "[ . 1 . 2]" 1
914 1 31 PRO QG 1 91 CYS QB . . 4.080 3.862 3.587 4.087 0.007 5 0 "[ . 1 . 2]" 1
915 1 31 PRO HG2 1 34 THR H . . 5.450 3.678 3.607 3.707 . 0 0 "[ . 1 . 2]" 1
916 1 31 PRO HG2 1 88 TYR QD . . 5.100 3.497 3.352 3.735 . 0 0 "[ . 1 . 2]" 1
917 1 31 PRO HG3 1 34 THR H . . 5.450 5.441 5.373 5.466 0.016 1 0 "[ . 1 . 2]" 1
918 1 31 PRO HG3 1 88 TYR QD . . 5.100 3.008 2.702 3.185 . 0 0 "[ . 1 . 2]" 1
919 1 32 PHE HA 1 32 PHE QD . . 3.950 2.201 2.150 2.254 . 0 0 "[ . 1 . 2]" 1
920 1 32 PHE HA 1 32 PHE QE . . 4.590 4.455 4.414 4.514 . 0 0 "[ . 1 . 2]" 1
921 1 32 PHE HA 1 34 THR H . . 4.360 3.315 3.259 3.394 . 0 0 "[ . 1 . 2]" 1
922 1 32 PHE HA 1 34 THR HG1 . . 5.840 4.084 4.005 4.169 . 0 0 "[ . 1 . 2]" 1
923 1 32 PHE QB 1 33 SER QB . . 5.610 4.562 4.321 5.053 . 0 0 "[ . 1 . 2]" 1
924 1 32 PHE QB 1 34 THR H . . 5.810 4.624 4.584 4.700 . 0 0 "[ . 1 . 2]" 1
925 1 32 PHE QB 1 62 PRO QB . . 5.400 3.361 2.747 3.850 . 0 0 "[ . 1 . 2]" 1
926 1 32 PHE QB 1 62 PRO QG . . 4.350 2.236 2.157 2.407 . 0 0 "[ . 1 . 2]" 1
927 1 32 PHE QD 1 34 THR H . . 5.240 5.260 5.237 5.274 0.034 14 0 "[ . 1 . 2]" 1
928 1 32 PHE QD 1 62 PRO QB . . 5.240 2.502 2.327 3.102 . 0 0 "[ . 1 . 2]" 1
929 1 32 PHE QD 1 62 PRO QD . . 4.660 4.543 4.346 4.666 0.006 1 0 "[ . 1 . 2]" 1
930 1 32 PHE QD 1 62 PRO QG . . 4.490 2.732 2.486 3.088 . 0 0 "[ . 1 . 2]" 1
931 1 32 PHE QD 1 64 GLY H . . 5.320 3.236 3.080 3.429 . 0 0 "[ . 1 . 2]" 1
932 1 32 PHE QD 1 64 GLY QA . . 4.730 3.158 2.906 3.393 . 0 0 "[ . 1 . 2]" 1
933 1 32 PHE QE 1 62 PRO QB . . 5.810 4.083 3.693 4.337 . 0 0 "[ . 1 . 2]" 1
934 1 32 PHE QE 1 62 PRO QG . . 4.610 3.945 3.635 4.247 . 0 0 "[ . 1 . 2]" 1
935 1 32 PHE QE 1 63 THR HA . . 4.440 3.997 3.803 4.390 . 0 0 "[ . 1 . 2]" 1
936 1 32 PHE QE 1 64 GLY H . . 5.700 3.404 3.151 3.547 . 0 0 "[ . 1 . 2]" 1
937 1 32 PHE QE 1 64 GLY HA2 . . 4.830 3.595 3.298 3.770 . 0 0 "[ . 1 . 2]" 1
938 1 32 PHE QE 1 64 GLY QA . . 4.010 2.692 2.553 2.877 . 0 0 "[ . 1 . 2]" 1
939 1 32 PHE QE 1 64 GLY HA3 . . 4.830 2.782 2.651 2.990 . 0 0 "[ . 1 . 2]" 1
940 1 33 SER H 1 34 THR H . . 5.080 2.643 2.563 2.741 . 0 0 "[ . 1 . 2]" 1
941 1 33 SER H 1 34 THR HG1 . . 6.000 3.820 3.738 3.918 . 0 0 "[ . 1 . 2]" 1
942 1 33 SER HB2 1 34 THR H . . 6.000 4.167 3.586 4.438 . 0 0 "[ . 1 . 2]" 1
943 1 33 SER HB3 1 34 THR H . . 6.000 3.957 3.480 4.495 . 0 0 "[ . 1 . 2]" 1
944 1 34 THR H 1 34 THR HB . . 3.370 2.646 2.482 2.749 . 0 0 "[ . 1 . 2]" 1
945 1 34 THR H 1 34 THR HG1 . . 3.530 2.178 2.127 2.271 . 0 0 "[ . 1 . 2]" 1
946 1 34 THR H 1 34 THR MG . . 4.570 3.798 3.731 3.829 . 0 0 "[ . 1 . 2]" 1
947 1 34 THR H 1 35 ALA H . . 5.520 4.639 4.622 4.659 . 0 0 "[ . 1 . 2]" 1
948 1 34 THR H 1 38 ASP QB . . 5.810 5.606 5.165 5.857 0.047 11 0 "[ . 1 . 2]" 1
949 1 34 THR H 1 54 LEU QD . . 5.920 4.613 4.296 5.045 . 0 0 "[ . 1 . 2]" 1
950 1 34 THR HA 1 34 THR HG1 . . 3.630 3.255 3.143 3.357 . 0 0 "[ . 1 . 2]" 1
951 1 34 THR HA 1 34 THR MG . . 3.250 2.333 2.222 2.443 . 0 0 "[ . 1 . 2]" 1
952 1 34 THR HA 1 35 ALA H . . 3.190 2.209 2.181 2.242 . 0 0 "[ . 1 . 2]" 1
953 1 34 THR HA 1 35 ALA HA . . 5.670 4.531 4.505 4.554 . 0 0 "[ . 1 . 2]" 1
954 1 34 THR HA 1 35 ALA MB . . 5.230 3.930 3.903 3.996 . 0 0 "[ . 1 . 2]" 1
955 1 34 THR HA 1 38 ASP QB . . 5.160 3.233 2.695 3.582 . 0 0 "[ . 1 . 2]" 1
956 1 34 THR HA 1 54 LEU QD . . 5.170 4.343 4.043 4.804 . 0 0 "[ . 1 . 2]" 1
957 1 34 THR HB 1 54 LEU QD . . 4.370 2.942 2.615 3.361 . 0 0 "[ . 1 . 2]" 1
958 1 34 THR HB 1 88 TYR QE . . 5.270 4.905 4.632 5.286 0.016 9 0 "[ . 1 . 2]" 1
959 1 34 THR HG1 1 35 ALA H . . 6.000 4.974 4.921 5.032 . 0 0 "[ . 1 . 2]" 1
960 1 34 THR HG1 1 54 LEU QD . . 5.920 4.437 4.126 4.780 . 0 0 "[ . 1 . 2]" 1
961 1 34 THR HG1 1 88 TYR QD . . 6.000 4.671 4.286 4.959 . 0 0 "[ . 1 . 2]" 1
962 1 34 THR HG1 1 88 TYR QE . . 5.890 3.638 3.082 4.179 . 0 0 "[ . 1 . 2]" 1
963 1 34 THR MG 1 35 ALA H . . 3.850 2.246 2.157 2.324 . 0 0 "[ . 1 . 2]" 1
964 1 34 THR MG 1 35 ALA HA . . 5.570 3.699 3.499 3.778 . 0 0 "[ . 1 . 2]" 1
965 1 34 THR MG 1 38 ASP H . . 4.130 3.777 3.588 3.956 . 0 0 "[ . 1 . 2]" 1
966 1 34 THR MG 1 38 ASP HA . . 4.290 4.349 4.330 4.378 0.088 12 0 "[ . 1 . 2]" 1
967 1 34 THR MG 1 38 ASP HB2 . . 3.670 2.856 2.510 3.279 . 0 0 "[ . 1 . 2]" 1
968 1 34 THR MG 1 38 ASP HB3 . . 3.670 2.042 1.959 2.147 . 0 0 "[ . 1 . 2]" 1
969 1 34 THR MG 1 39 LEU H . . 4.990 4.241 3.972 4.580 . 0 0 "[ . 1 . 2]" 1
970 1 34 THR MG 1 39 LEU QD . . 4.750 2.956 2.414 3.682 . 0 0 "[ . 1 . 2]" 1
971 1 34 THR MG 1 54 LEU QD . . 3.130 2.295 2.008 2.740 . 0 0 "[ . 1 . 2]" 1
972 1 34 THR MG 1 88 TYR QD . . 5.120 4.517 4.107 4.848 . 0 0 "[ . 1 . 2]" 1
973 1 34 THR MG 1 88 TYR QE . . 4.220 3.100 2.650 3.355 . 0 0 "[ . 1 . 2]" 1
974 1 35 ALA H 1 35 ALA MB . . 3.600 2.554 2.488 2.602 . 0 0 "[ . 1 . 2]" 1
975 1 35 ALA H 1 36 ARG H . . 6.000 4.458 4.439 4.489 . 0 0 "[ . 1 . 2]" 1
976 1 35 ALA H 1 37 SER H . . 6.000 4.874 4.630 4.976 . 0 0 "[ . 1 . 2]" 1
977 1 35 ALA H 1 38 ASP H . . 4.820 3.452 3.194 3.678 . 0 0 "[ . 1 . 2]" 1
978 1 35 ALA H 1 38 ASP HA . . 6.000 4.876 4.406 5.171 . 0 0 "[ . 1 . 2]" 1
979 1 35 ALA H 1 38 ASP HB2 . . 4.560 2.688 1.939 4.432 . 0 0 "[ . 1 . 2]" 1
980 1 35 ALA H 1 38 ASP QB . . 3.740 2.306 1.737 2.805 . 0 0 "[ . 1 . 2]" 1
981 1 35 ALA H 1 38 ASP HB3 . . 4.560 2.695 1.950 3.309 . 0 0 "[ . 1 . 2]" 1
982 1 35 ALA H 1 39 LEU H . . 6.000 5.313 4.771 5.795 . 0 0 "[ . 1 . 2]" 1
983 1 35 ALA H 1 39 LEU QD . . 5.920 5.029 4.476 5.733 . 0 0 "[ . 1 . 2]" 1
984 1 35 ALA H 1 54 LEU MD1 . . 5.720 3.695 3.408 4.215 . 0 0 "[ . 1 . 2]" 1
985 1 35 ALA H 1 54 LEU QD . . 4.740 3.561 3.303 3.994 . 0 0 "[ . 1 . 2]" 1
986 1 35 ALA H 1 54 LEU MD2 . . 5.720 4.674 4.350 5.030 . 0 0 "[ . 1 . 2]" 1
987 1 35 ALA HA 1 37 SER H . . 4.670 4.652 4.498 4.703 0.033 18 0 "[ . 1 . 2]" 1
988 1 35 ALA HA 1 38 ASP H . . 6.000 4.807 4.560 4.995 . 0 0 "[ . 1 . 2]" 1
989 1 35 ALA HA 1 38 ASP QB . . 5.810 4.563 4.040 5.137 . 0 0 "[ . 1 . 2]" 1
990 1 35 ALA HA 1 54 LEU MD1 . . 4.880 2.444 2.206 2.842 . 0 0 "[ . 1 . 2]" 1
991 1 35 ALA HA 1 54 LEU QD . . 3.770 2.434 2.199 2.823 . 0 0 "[ . 1 . 2]" 1
992 1 35 ALA HA 1 54 LEU MD2 . . 4.880 4.502 4.231 4.887 0.007 14 0 "[ . 1 . 2]" 1
993 1 35 ALA MB 1 36 ARG H . . 3.740 2.396 2.331 2.479 . 0 0 "[ . 1 . 2]" 1
994 1 35 ALA MB 1 36 ARG HA . . 5.280 4.462 4.426 4.500 . 0 0 "[ . 1 . 2]" 1
995 1 35 ALA MB 1 36 ARG QB . . 4.940 3.763 3.707 3.901 . 0 0 "[ . 1 . 2]" 1
996 1 35 ALA MB 1 36 ARG QD . . 5.810 5.776 5.585 5.823 0.013 3 0 "[ . 1 . 2]" 1
997 1 35 ALA MB 1 37 SER H . . 3.920 3.051 2.889 3.175 . 0 0 "[ . 1 . 2]" 1
998 1 35 ALA MB 1 37 SER QB . . 5.230 3.714 3.259 4.428 . 0 0 "[ . 1 . 2]" 1
999 1 35 ALA MB 1 38 ASP H . . 3.910 3.430 2.909 3.822 . 0 0 "[ . 1 . 2]" 1
1000 1 35 ALA MB 1 38 ASP QB . . 5.030 3.376 2.523 4.222 . 0 0 "[ . 1 . 2]" 1
1001 1 35 ALA MB 1 39 LEU H . . 5.800 5.559 5.137 5.847 0.047 20 0 "[ . 1 . 2]" 1
1002 1 36 ARG H 1 36 ARG HB2 . . 3.990 2.350 2.160 2.456 . 0 0 "[ . 1 . 2]" 1
1003 1 36 ARG H 1 36 ARG HB3 . . 3.990 2.647 2.560 2.819 . 0 0 "[ . 1 . 2]" 1
1004 1 36 ARG H 1 36 ARG HD2 . . 6.000 5.092 4.723 5.675 . 0 0 "[ . 1 . 2]" 1
1005 1 36 ARG H 1 36 ARG QD . . 5.210 4.571 4.230 4.748 . 0 0 "[ . 1 . 2]" 1
1006 1 36 ARG H 1 36 ARG HD3 . . 6.000 5.453 4.364 5.979 . 0 0 "[ . 1 . 2]" 1
1007 1 36 ARG H 1 36 ARG HG2 . . 5.200 4.542 4.514 4.641 . 0 0 "[ . 1 . 2]" 1
1008 1 36 ARG H 1 36 ARG QG . . 4.580 4.002 3.955 4.105 . 0 0 "[ . 1 . 2]" 1
1009 1 36 ARG H 1 36 ARG HG3 . . 5.200 4.448 4.349 4.577 . 0 0 "[ . 1 . 2]" 1
1010 1 36 ARG H 1 37 SER H . . 4.540 2.981 2.906 3.052 . 0 0 "[ . 1 . 2]" 1
1011 1 36 ARG H 1 38 ASP H . . 6.000 4.329 4.083 4.539 . 0 0 "[ . 1 . 2]" 1
1012 1 36 ARG H 1 39 LEU H . . 6.000 5.801 5.620 6.040 0.040 11 0 "[ . 1 . 2]" 1
1013 1 36 ARG H 1 39 LEU QD . . 5.730 4.903 4.652 5.363 . 0 0 "[ . 1 . 2]" 1
1014 1 36 ARG H 1 54 LEU QD . . 4.290 3.168 2.875 3.539 . 0 0 "[ . 1 . 2]" 1
1015 1 36 ARG HA 1 36 ARG HG2 . . 4.130 3.242 3.038 3.779 . 0 0 "[ . 1 . 2]" 1
1016 1 36 ARG HA 1 36 ARG QG . . 3.610 2.557 2.399 2.905 . 0 0 "[ . 1 . 2]" 1
1017 1 36 ARG HA 1 36 ARG HG3 . . 4.130 2.679 2.509 3.019 . 0 0 "[ . 1 . 2]" 1
1018 1 36 ARG HA 1 39 LEU H . . 4.530 4.028 3.807 4.186 . 0 0 "[ . 1 . 2]" 1
1019 1 36 ARG HA 1 39 LEU QB . . 5.480 4.400 4.092 4.837 . 0 0 "[ . 1 . 2]" 1
1020 1 36 ARG HA 1 39 LEU MD1 . . 4.580 2.912 2.587 3.463 . 0 0 "[ . 1 . 2]" 1
1021 1 36 ARG HA 1 39 LEU QD . . 3.700 2.854 2.558 3.342 . 0 0 "[ . 1 . 2]" 1
1022 1 36 ARG HA 1 39 LEU MD2 . . 4.580 4.160 3.921 4.549 . 0 0 "[ . 1 . 2]" 1
1023 1 36 ARG HA 1 39 LEU HG . . 3.930 2.996 2.690 3.432 . 0 0 "[ . 1 . 2]" 1
1024 1 36 ARG HA 1 40 PHE QE . . 6.000 4.858 4.414 5.451 . 0 0 "[ . 1 . 2]" 1
1025 1 36 ARG HA 1 54 LEU H . . 6.000 4.687 4.202 5.278 . 0 0 "[ . 1 . 2]" 1
1026 1 36 ARG HA 1 54 LEU QD . . 4.130 3.164 2.642 3.581 . 0 0 "[ . 1 . 2]" 1
1027 1 36 ARG HA 1 54 LEU HG . . 4.990 3.063 2.828 3.288 . 0 0 "[ . 1 . 2]" 1
1028 1 36 ARG QB 1 36 ARG QD . . 3.230 2.450 2.124 2.927 . 0 0 "[ . 1 . 2]" 1
1029 1 36 ARG QB 1 36 ARG HE . . 4.070 3.179 2.567 4.016 . 0 0 "[ . 1 . 2]" 1
1030 1 36 ARG QB 1 37 SER H . . 3.920 2.667 2.549 2.802 . 0 0 "[ . 1 . 2]" 1
1031 1 36 ARG QB 1 54 LEU H . . 5.560 4.682 4.273 5.534 . 0 0 "[ . 1 . 2]" 1
1032 1 36 ARG HB2 1 36 ARG HE . . 4.710 3.303 2.592 4.344 . 0 0 "[ . 1 . 2]" 1
1033 1 36 ARG HB3 1 36 ARG HE . . 4.710 4.266 4.042 4.749 0.039 14 0 "[ . 1 . 2]" 1
1034 1 36 ARG QD 1 53 GLU HA . . 5.810 3.750 2.052 4.463 . 0 0 "[ . 1 . 2]" 1
1035 1 36 ARG QD 1 54 LEU H . . 5.810 5.041 3.039 5.867 0.057 18 0 "[ . 1 . 2]" 1
1036 1 36 ARG HE 1 36 ARG HG2 . . 4.120 3.630 2.775 3.808 . 0 0 "[ . 1 . 2]" 1
1037 1 36 ARG HE 1 36 ARG QG . . 3.610 2.767 2.483 3.324 . 0 0 "[ . 1 . 2]" 1
1038 1 36 ARG HE 1 36 ARG HG3 . . 4.120 2.994 2.523 3.967 . 0 0 "[ . 1 . 2]" 1
1039 1 36 ARG HE 1 53 GLU QB . . 4.460 4.150 3.289 4.488 0.028 11 0 "[ . 1 . 2]" 1
1040 1 36 ARG HE 1 54 LEU H . . 6.000 4.313 2.981 5.481 . 0 0 "[ . 1 . 2]" 1
1041 1 36 ARG QG 1 37 SER H . . 4.950 3.807 3.596 4.082 . 0 0 "[ . 1 . 2]" 1
1042 1 36 ARG QG 1 39 LEU H . . 5.790 4.796 4.366 5.144 . 0 0 "[ . 1 . 2]" 1
1043 1 36 ARG QG 1 39 LEU QD . . 4.520 3.034 2.283 3.654 . 0 0 "[ . 1 . 2]" 1
1044 1 36 ARG QG 1 40 PHE QD . . 4.100 4.015 3.649 4.139 0.039 10 0 "[ . 1 . 2]" 1
1045 1 36 ARG QG 1 40 PHE QE . . 4.490 2.858 2.468 3.284 . 0 0 "[ . 1 . 2]" 1
1046 1 36 ARG QG 1 53 GLU HA . . 4.090 3.093 2.672 4.104 0.014 14 0 "[ . 1 . 2]" 1
1047 1 37 SER H 1 37 SER QB . . 3.670 2.478 2.194 2.639 . 0 0 "[ . 1 . 2]" 1
1048 1 37 SER H 1 38 ASP H . . 3.840 2.764 2.606 2.949 . 0 0 "[ . 1 . 2]" 1
1049 1 37 SER H 1 39 LEU H . . 5.530 4.492 4.356 4.657 . 0 0 "[ . 1 . 2]" 1
1050 1 37 SER H 1 39 LEU QD . . 5.920 5.134 4.990 5.380 . 0 0 "[ . 1 . 2]" 1
1051 1 37 SER HA 1 39 LEU H . . 5.400 3.795 3.603 3.915 . 0 0 "[ . 1 . 2]" 1
1052 1 37 SER HA 1 40 PHE QB . . 5.810 3.741 3.384 4.146 . 0 0 "[ . 1 . 2]" 1
1053 1 37 SER HA 1 40 PHE QD . . 3.670 2.738 2.388 3.422 . 0 0 "[ . 1 . 2]" 1
1054 1 37 SER QB 1 38 ASP H . . 4.120 3.225 2.957 3.810 . 0 0 "[ . 1 . 2]" 1
1055 1 37 SER QB 1 38 ASP HA . . 4.640 4.198 4.004 4.481 . 0 0 "[ . 1 . 2]" 1
1056 1 37 SER QB 1 40 PHE QD . . 5.810 4.590 4.146 5.235 . 0 0 "[ . 1 . 2]" 1
1057 1 38 ASP H 1 38 ASP HB2 . . 3.820 2.519 2.137 3.540 . 0 0 "[ . 1 . 2]" 1
1058 1 38 ASP H 1 38 ASP QB . . 3.210 2.191 2.078 2.262 . 0 0 "[ . 1 . 2]" 1
1059 1 38 ASP H 1 38 ASP HB3 . . 3.820 2.611 2.244 2.838 . 0 0 "[ . 1 . 2]" 1
1060 1 38 ASP H 1 39 LEU H . . 3.460 2.643 2.561 2.692 . 0 0 "[ . 1 . 2]" 1
1061 1 38 ASP H 1 39 LEU MD1 . . 6.000 5.056 4.792 5.174 . 0 0 "[ . 1 . 2]" 1
1062 1 38 ASP H 1 39 LEU QD . . 4.480 4.316 4.229 4.404 . 0 0 "[ . 1 . 2]" 1
1063 1 38 ASP H 1 39 LEU MD2 . . 6.000 4.691 4.545 4.912 . 0 0 "[ . 1 . 2]" 1
1064 1 38 ASP H 1 39 LEU HG . . 3.880 3.850 3.677 3.896 0.016 14 0 "[ . 1 . 2]" 1
1065 1 38 ASP HA 1 41 ASP QB . . 3.860 2.424 2.169 2.662 . 0 0 "[ . 1 . 2]" 1
1066 1 38 ASP QB 1 39 LEU H . . 3.950 3.204 2.942 3.558 . 0 0 "[ . 1 . 2]" 1
1067 1 38 ASP QB 1 39 LEU HA . . 5.150 4.313 4.105 4.634 . 0 0 "[ . 1 . 2]" 1
1068 1 38 ASP QB 1 39 LEU QD . . 5.490 3.543 3.239 4.136 . 0 0 "[ . 1 . 2]" 1
1069 1 38 ASP QB 1 88 TYR QE . . 5.810 4.046 2.589 4.489 . 0 0 "[ . 1 . 2]" 1
1070 1 38 ASP HB2 1 39 LEU H . . 4.700 4.136 4.058 4.254 . 0 0 "[ . 1 . 2]" 1
1071 1 38 ASP HB2 1 41 ASP H . . 6.000 5.792 5.412 6.014 0.014 6 0 "[ . 1 . 2]" 1
1072 1 38 ASP HB3 1 39 LEU H . . 4.700 3.352 3.017 3.832 . 0 0 "[ . 1 . 2]" 1
1073 1 38 ASP HB3 1 41 ASP H . . 6.000 5.550 5.306 6.018 0.018 11 0 "[ . 1 . 2]" 1
1074 1 39 LEU H 1 39 LEU QB . . 3.560 2.515 2.427 2.602 . 0 0 "[ . 1 . 2]" 1
1075 1 39 LEU H 1 39 LEU MD1 . . 4.510 3.612 3.470 3.675 . 0 0 "[ . 1 . 2]" 1
1076 1 39 LEU H 1 39 LEU QD . . 3.930 2.979 2.837 3.127 . 0 0 "[ . 1 . 2]" 1
1077 1 39 LEU H 1 39 LEU MD2 . . 4.510 3.180 2.961 3.417 . 0 0 "[ . 1 . 2]" 1
1078 1 39 LEU H 1 39 LEU HG . . 3.430 2.141 1.978 2.304 . 0 0 "[ . 1 . 2]" 1
1079 1 39 LEU H 1 40 PHE H . . 3.460 2.649 2.418 2.969 . 0 0 "[ . 1 . 2]" 1
1080 1 39 LEU H 1 40 PHE HA . . 6.000 5.307 5.133 5.526 . 0 0 "[ . 1 . 2]" 1
1081 1 39 LEU H 1 40 PHE QB . . 5.810 4.591 4.357 4.937 . 0 0 "[ . 1 . 2]" 1
1082 1 39 LEU H 1 41 ASP H . . 5.500 3.853 3.717 3.955 . 0 0 "[ . 1 . 2]" 1
1083 1 39 LEU H 1 42 LEU QD . . 5.920 4.646 4.526 4.732 . 0 0 "[ . 1 . 2]" 1
1084 1 39 LEU H 1 52 ALA MB . . 5.830 5.068 4.939 5.255 . 0 0 "[ . 1 . 2]" 1
1085 1 39 LEU H 1 66 ALA MB . . 5.940 5.559 5.373 5.716 . 0 0 "[ . 1 . 2]" 1
1086 1 39 LEU HA 1 39 LEU MD1 . . 4.670 3.920 3.888 3.969 . 0 0 "[ . 1 . 2]" 1
1087 1 39 LEU HA 1 39 LEU QD . . 3.340 2.148 2.084 2.200 . 0 0 "[ . 1 . 2]" 1
1088 1 39 LEU HA 1 39 LEU MD2 . . 4.670 2.158 2.091 2.211 . 0 0 "[ . 1 . 2]" 1
1089 1 39 LEU HA 1 39 LEU HG . . 3.980 3.242 3.118 3.328 . 0 0 "[ . 1 . 2]" 1
1090 1 39 LEU HA 1 40 PHE QD . . 5.940 5.053 4.916 5.207 . 0 0 "[ . 1 . 2]" 1
1091 1 39 LEU HA 1 42 LEU QB . . 5.690 5.376 5.247 5.550 . 0 0 "[ . 1 . 2]" 1
1092 1 39 LEU HA 1 42 LEU QD . . 4.600 3.101 2.804 3.398 . 0 0 "[ . 1 . 2]" 1
1093 1 39 LEU HA 1 43 PHE H . . 4.110 4.074 3.844 4.143 0.033 15 0 "[ . 1 . 2]" 1
1094 1 39 LEU HA 1 43 PHE HB2 . . 6.000 4.201 3.921 4.371 . 0 0 "[ . 1 . 2]" 1
1095 1 39 LEU HA 1 43 PHE HB3 . . 6.000 5.798 5.479 6.005 0.005 6 0 "[ . 1 . 2]" 1
1096 1 39 LEU HA 1 43 PHE QD . . 3.720 2.978 2.750 3.164 . 0 0 "[ . 1 . 2]" 1
1097 1 39 LEU HA 1 68 VAL MG1 . . 6.000 5.662 5.327 6.016 0.016 19 0 "[ . 1 . 2]" 1
1098 1 39 LEU HA 1 68 VAL QG . . 4.950 4.188 3.900 4.526 . 0 0 "[ . 1 . 2]" 1
1099 1 39 LEU HA 1 68 VAL MG2 . . 6.000 4.315 4.011 4.679 . 0 0 "[ . 1 . 2]" 1
1100 1 39 LEU QB 1 39 LEU QD . . 2.860 1.989 1.974 2.001 . 0 0 "[ . 1 . 2]" 1
1101 1 39 LEU QB 1 40 PHE H . . 3.610 2.396 2.238 2.541 . 0 0 "[ . 1 . 2]" 1
1102 1 39 LEU QB 1 40 PHE HA . . 5.810 3.978 3.940 4.053 . 0 0 "[ . 1 . 2]" 1
1103 1 39 LEU QB 1 40 PHE QD . . 4.010 2.828 2.710 2.933 . 0 0 "[ . 1 . 2]" 1
1104 1 39 LEU QB 1 41 ASP H . . 5.610 4.373 4.286 4.494 . 0 0 "[ . 1 . 2]" 1
1105 1 39 LEU QB 1 43 PHE H . . 5.110 4.719 4.551 4.884 . 0 0 "[ . 1 . 2]" 1
1106 1 39 LEU QB 1 43 PHE QB . . 5.430 3.619 3.472 3.827 . 0 0 "[ . 1 . 2]" 1
1107 1 39 LEU QB 1 43 PHE QD . . 3.780 3.678 3.394 3.812 0.032 17 0 "[ . 1 . 2]" 1
1108 1 39 LEU QB 1 49 ILE MD . . 5.380 4.974 4.887 5.144 . 0 0 "[ . 1 . 2]" 1
1109 1 39 LEU QB 1 52 ALA MB . . 3.990 2.593 2.435 2.769 . 0 0 "[ . 1 . 2]" 1
1110 1 39 LEU QB 1 66 ALA MB . . 5.120 3.947 3.755 4.256 . 0 0 "[ . 1 . 2]" 1
1111 1 39 LEU QB 1 68 VAL QG . . 3.410 2.750 2.622 2.902 . 0 0 "[ . 1 . 2]" 1
1112 1 39 LEU HB2 1 40 PHE QD . . 4.780 2.863 2.741 2.973 . 0 0 "[ . 1 . 2]" 1
1113 1 39 LEU HB2 1 49 ILE MG . . 5.540 4.917 4.735 5.072 . 0 0 "[ . 1 . 2]" 1
1114 1 39 LEU HB3 1 40 PHE QD . . 4.780 4.394 4.270 4.518 . 0 0 "[ . 1 . 2]" 1
1115 1 39 LEU HB3 1 49 ILE MG . . 5.540 4.782 4.515 5.102 . 0 0 "[ . 1 . 2]" 1
1116 1 39 LEU QD 1 40 PHE H . . 4.820 3.994 3.897 4.068 . 0 0 "[ . 1 . 2]" 1
1117 1 39 LEU QD 1 40 PHE QD . . 4.830 4.022 3.855 4.154 . 0 0 "[ . 1 . 2]" 1
1118 1 39 LEU QD 1 40 PHE QE . . 4.310 3.246 3.166 3.331 . 0 0 "[ . 1 . 2]" 1
1119 1 39 LEU QD 1 42 LEU H . . 5.920 5.261 5.183 5.358 . 0 0 "[ . 1 . 2]" 1
1120 1 39 LEU QD 1 43 PHE H . . 5.540 5.208 5.045 5.305 . 0 0 "[ . 1 . 2]" 1
1121 1 39 LEU QD 1 43 PHE QD . . 3.900 3.742 3.605 3.836 . 0 0 "[ . 1 . 2]" 1
1122 1 39 LEU QD 1 43 PHE QE . . 3.660 3.668 3.586 3.689 0.029 19 0 "[ . 1 . 2]" 1
1123 1 39 LEU QD 1 43 PHE HZ . . 5.920 5.082 4.902 5.239 . 0 0 "[ . 1 . 2]" 1
1124 1 39 LEU QD 1 49 ILE QG . . 5.430 5.000 4.816 5.197 . 0 0 "[ . 1 . 2]" 1
1125 1 39 LEU QD 1 49 ILE MG . . 5.920 4.496 4.378 4.601 . 0 0 "[ . 1 . 2]" 1
1126 1 39 LEU QD 1 52 ALA HA . . 5.350 3.564 3.455 3.616 . 0 0 "[ . 1 . 2]" 1
1127 1 39 LEU QD 1 52 ALA MB . . 3.830 2.022 1.990 2.072 . 0 0 "[ . 1 . 2]" 1
1128 1 39 LEU QD 1 53 GLU HA . . 4.630 2.846 2.683 2.970 . 0 0 "[ . 1 . 2]" 1
1129 1 39 LEU QD 1 54 LEU H . . 4.770 3.663 3.542 3.836 . 0 0 "[ . 1 . 2]" 1
1130 1 39 LEU QD 1 54 LEU QB . . 4.070 4.040 3.956 4.091 0.021 17 0 "[ . 1 . 2]" 1
1131 1 39 LEU QD 1 54 LEU QD . . 3.930 2.093 2.005 2.246 . 0 0 "[ . 1 . 2]" 1
1132 1 39 LEU QD 1 54 LEU HG . . 3.890 2.692 2.613 2.771 . 0 0 "[ . 1 . 2]" 1
1133 1 39 LEU QD 1 55 LYS H . . 5.920 5.160 5.011 5.333 . 0 0 "[ . 1 . 2]" 1
1134 1 39 LEU QD 1 66 ALA HA . . 5.360 3.426 3.296 3.621 . 0 0 "[ . 1 . 2]" 1
1135 1 39 LEU QD 1 66 ALA MB . . 2.880 1.867 1.834 1.917 . 0 0 "[ . 1 . 2]" 1
1136 1 39 LEU QD 1 67 VAL H . . 4.280 3.412 3.290 3.502 . 0 0 "[ . 1 . 2]" 1
1137 1 39 LEU QD 1 68 VAL QG . . 3.480 2.522 2.346 2.666 . 0 0 "[ . 1 . 2]" 1
1138 1 39 LEU MD1 1 40 PHE H . . 5.900 4.389 4.195 4.522 . 0 0 "[ . 1 . 2]" 1
1139 1 39 LEU MD1 1 40 PHE QD . . 5.540 4.167 3.953 4.332 . 0 0 "[ . 1 . 2]" 1
1140 1 39 LEU MD1 1 40 PHE QE . . 5.430 3.271 3.187 3.361 . 0 0 "[ . 1 . 2]" 1
1141 1 39 LEU MD1 1 53 GLU H . . 4.530 2.647 2.574 2.791 . 0 0 "[ . 1 . 2]" 1
1142 1 39 LEU MD1 1 66 ALA MB . . 3.500 2.583 2.411 3.227 . 0 0 "[ . 1 . 2]" 1
1143 1 39 LEU MD1 1 67 VAL H . . 4.990 3.609 3.449 3.909 . 0 0 "[ . 1 . 2]" 1
1144 1 39 LEU MD1 1 68 VAL MG1 . . 5.960 4.322 4.160 4.501 . 0 0 "[ . 1 . 2]" 1
1145 1 39 LEU MD1 1 68 VAL MG2 . . 5.960 2.807 2.581 3.177 . 0 0 "[ . 1 . 2]" 1
1146 1 39 LEU MD2 1 40 PHE H . . 5.900 4.599 4.515 4.647 . 0 0 "[ . 1 . 2]" 1
1147 1 39 LEU MD2 1 40 PHE QD . . 5.540 5.306 5.205 5.422 . 0 0 "[ . 1 . 2]" 1
1148 1 39 LEU MD2 1 40 PHE QE . . 5.430 5.453 5.437 5.465 0.035 13 0 "[ . 1 . 2]" 1
1149 1 39 LEU MD2 1 53 GLU H . . 4.530 4.500 3.984 4.572 0.042 18 0 "[ . 1 . 2]" 1
1150 1 39 LEU MD2 1 66 ALA MB . . 3.500 1.920 1.892 1.961 . 0 0 "[ . 1 . 2]" 1
1151 1 39 LEU MD2 1 67 VAL H . . 4.990 4.242 3.774 4.409 . 0 0 "[ . 1 . 2]" 1
1152 1 39 LEU MD2 1 68 VAL MG1 . . 5.960 4.824 4.310 5.016 . 0 0 "[ . 1 . 2]" 1
1153 1 39 LEU MD2 1 68 VAL MG2 . . 5.960 2.998 2.453 3.212 . 0 0 "[ . 1 . 2]" 1
1154 1 39 LEU HG 1 40 PHE QD . . 4.770 4.499 4.329 4.767 . 0 0 "[ . 1 . 2]" 1
1155 1 39 LEU HG 1 54 LEU QD . . 3.630 3.373 3.087 3.626 . 0 0 "[ . 1 . 2]" 1
1156 1 40 PHE H 1 40 PHE HB2 . . 3.960 2.456 2.403 2.508 . 0 0 "[ . 1 . 2]" 1
1157 1 40 PHE H 1 40 PHE QB . . 3.300 2.413 2.365 2.460 . 0 0 "[ . 1 . 2]" 1
1158 1 40 PHE H 1 40 PHE HB3 . . 3.960 3.543 3.523 3.559 . 0 0 "[ . 1 . 2]" 1
1159 1 40 PHE H 1 41 ASP QB . . 5.730 4.281 4.156 4.381 . 0 0 "[ . 1 . 2]" 1
1160 1 40 PHE H 1 43 PHE H . . 6.000 4.908 4.779 5.038 . 0 0 "[ . 1 . 2]" 1
1161 1 40 PHE H 1 68 VAL QG . . 5.640 5.239 5.168 5.364 . 0 0 "[ . 1 . 2]" 1
1162 1 40 PHE HA 1 40 PHE QD . . 3.780 3.003 2.813 3.172 . 0 0 "[ . 1 . 2]" 1
1163 1 40 PHE HA 1 40 PHE QE . . 6.000 4.694 4.570 4.812 . 0 0 "[ . 1 . 2]" 1
1164 1 40 PHE HA 1 42 LEU H . . 6.000 4.287 3.958 4.624 . 0 0 "[ . 1 . 2]" 1
1165 1 40 PHE HA 1 43 PHE H . . 4.450 3.514 3.277 3.758 . 0 0 "[ . 1 . 2]" 1
1166 1 40 PHE HA 1 43 PHE QB . . 5.810 3.013 2.697 3.302 . 0 0 "[ . 1 . 2]" 1
1167 1 40 PHE HA 1 43 PHE QD . . 5.470 4.794 4.626 5.044 . 0 0 "[ . 1 . 2]" 1
1168 1 40 PHE HA 1 44 GLY H . . 4.490 2.564 2.353 2.800 . 0 0 "[ . 1 . 2]" 1
1169 1 40 PHE HA 1 44 GLY QA . . 5.810 3.182 3.045 3.316 . 0 0 "[ . 1 . 2]" 1
1170 1 40 PHE HA 1 49 ILE MD . . 4.070 3.321 3.159 3.420 . 0 0 "[ . 1 . 2]" 1
1171 1 40 PHE HA 1 49 ILE QG . . 5.810 4.033 3.775 4.581 . 0 0 "[ . 1 . 2]" 1
1172 1 40 PHE HA 1 52 ALA MB . . 6.000 5.134 4.969 5.312 . 0 0 "[ . 1 . 2]" 1
1173 1 40 PHE QB 1 41 ASP H . . 4.050 3.321 3.272 3.383 . 0 0 "[ . 1 . 2]" 1
1174 1 40 PHE QB 1 49 ILE MG . . 5.790 5.265 5.126 5.410 . 0 0 "[ . 1 . 2]" 1
1175 1 40 PHE HB2 1 41 ASP H . . 4.640 3.464 3.409 3.540 . 0 0 "[ . 1 . 2]" 1
1176 1 40 PHE HB3 1 41 ASP H . . 4.640 4.263 4.212 4.300 . 0 0 "[ . 1 . 2]" 1
1177 1 40 PHE QD 1 43 PHE QB . . 5.810 4.664 4.476 4.796 . 0 0 "[ . 1 . 2]" 1
1178 1 40 PHE QD 1 44 GLY H . . 6.000 4.818 4.651 4.990 . 0 0 "[ . 1 . 2]" 1
1179 1 40 PHE QD 1 44 GLY QA . . 3.810 3.766 3.545 3.842 0.032 10 0 "[ . 1 . 2]" 1
1180 1 40 PHE QD 1 49 ILE HB . . 4.370 3.186 2.976 3.430 . 0 0 "[ . 1 . 2]" 1
1181 1 40 PHE QD 1 49 ILE MD . . 3.940 3.007 2.750 3.283 . 0 0 "[ . 1 . 2]" 1
1182 1 40 PHE QD 1 49 ILE QG . . 5.810 3.818 3.554 4.367 . 0 0 "[ . 1 . 2]" 1
1183 1 40 PHE QD 1 49 ILE MG . . 3.940 3.791 3.648 3.943 0.003 18 0 "[ . 1 . 2]" 1
1184 1 40 PHE QD 1 52 ALA MB . . 4.080 4.013 3.869 4.087 0.007 20 0 "[ . 1 . 2]" 1
1185 1 40 PHE QD 1 68 VAL MG1 . . 6.000 5.300 5.228 5.408 . 0 0 "[ . 1 . 2]" 1
1186 1 40 PHE QD 1 68 VAL MG2 . . 6.000 5.773 5.649 5.961 . 0 0 "[ . 1 . 2]" 1
1187 1 40 PHE QE 1 49 ILE HB . . 4.250 2.422 2.300 2.635 . 0 0 "[ . 1 . 2]" 1
1188 1 40 PHE QE 1 49 ILE QG . . 5.670 3.715 3.426 4.140 . 0 0 "[ . 1 . 2]" 1
1189 1 40 PHE QE 1 49 ILE MG . . 3.810 2.447 2.342 2.589 . 0 0 "[ . 1 . 2]" 1
1190 1 40 PHE QE 1 51 ASN HA . . 4.970 4.254 3.984 4.579 . 0 0 "[ . 1 . 2]" 1
1191 1 40 PHE QE 1 52 ALA H . . 4.640 4.416 4.196 4.607 . 0 0 "[ . 1 . 2]" 1
1192 1 40 PHE QE 1 52 ALA MB . . 3.830 2.741 2.463 2.922 . 0 0 "[ . 1 . 2]" 1
1193 1 40 PHE QE 1 68 VAL QG . . 5.610 4.455 4.360 4.635 . 0 0 "[ . 1 . 2]" 1
1194 1 41 ASP H 1 41 ASP HB2 . . 4.160 2.044 1.978 2.100 . 0 0 "[ . 1 . 2]" 1
1195 1 41 ASP H 1 41 ASP QB . . 3.430 2.017 1.956 2.061 . 0 0 "[ . 1 . 2]" 1
1196 1 41 ASP H 1 41 ASP HB3 . . 4.160 3.107 2.994 3.188 . 0 0 "[ . 1 . 2]" 1
1197 1 41 ASP H 1 42 LEU H . . 4.180 2.573 2.472 2.645 . 0 0 "[ . 1 . 2]" 1
1198 1 41 ASP H 1 42 LEU QB . . 5.810 5.136 4.975 5.251 . 0 0 "[ . 1 . 2]" 1
1199 1 41 ASP H 1 43 PHE H . . 5.280 3.781 3.654 3.849 . 0 0 "[ . 1 . 2]" 1
1200 1 41 ASP H 1 44 GLY H . . 5.710 4.161 4.089 4.246 . 0 0 "[ . 1 . 2]" 1
1201 1 41 ASP H 1 49 ILE MD . . 6.000 6.022 5.999 6.035 0.035 7 0 "[ . 1 . 2]" 1
1202 1 41 ASP HA 1 43 PHE H . . 5.070 4.987 4.867 5.082 0.012 18 0 "[ . 1 . 2]" 1
1203 1 41 ASP QB 1 42 LEU H . . 4.110 2.519 2.324 2.702 . 0 0 "[ . 1 . 2]" 1
1204 1 41 ASP QB 1 42 LEU QB . . 5.610 3.434 3.260 3.622 . 0 0 "[ . 1 . 2]" 1
1205 1 41 ASP QB 1 42 LEU QD . . 4.570 2.328 2.187 2.537 . 0 0 "[ . 1 . 2]" 1
1206 1 41 ASP HB2 1 43 PHE H . . 6.000 5.094 5.030 5.189 . 0 0 "[ . 1 . 2]" 1
1207 1 41 ASP HB2 1 43 PHE QD . . 6.000 6.087 6.069 6.111 0.111 5 0 "[ . 1 . 2]" 1
1208 1 41 ASP HB3 1 43 PHE H . . 6.000 4.844 4.705 4.924 . 0 0 "[ . 1 . 2]" 1
1209 1 41 ASP HB3 1 43 PHE QD . . 6.000 5.973 5.761 6.021 0.021 9 0 "[ . 1 . 2]" 1
1210 1 42 LEU H 1 42 LEU HB2 . . 3.790 3.692 3.631 3.764 . 0 0 "[ . 1 . 2]" 1
1211 1 42 LEU H 1 42 LEU QB . . 3.310 2.958 2.825 3.052 . 0 0 "[ . 1 . 2]" 1
1212 1 42 LEU H 1 42 LEU HB3 . . 3.790 3.115 2.945 3.240 . 0 0 "[ . 1 . 2]" 1
1213 1 42 LEU H 1 42 LEU MD1 . . 5.260 3.767 3.709 3.841 . 0 0 "[ . 1 . 2]" 1
1214 1 42 LEU H 1 42 LEU QD . . 4.620 2.458 2.213 2.761 . 0 0 "[ . 1 . 2]" 1
1215 1 42 LEU H 1 42 LEU MD2 . . 5.260 2.494 2.229 2.843 . 0 0 "[ . 1 . 2]" 1
1216 1 42 LEU H 1 42 LEU HG . . 5.370 2.102 2.028 2.180 . 0 0 "[ . 1 . 2]" 1
1217 1 42 LEU H 1 43 PHE H . . 3.940 2.208 2.013 2.431 . 0 0 "[ . 1 . 2]" 1
1218 1 42 LEU H 1 43 PHE HB2 . . 5.970 4.296 4.025 4.575 . 0 0 "[ . 1 . 2]" 1
1219 1 42 LEU H 1 43 PHE HB3 . . 5.970 5.732 5.491 5.980 0.010 12 0 "[ . 1 . 2]" 1
1220 1 42 LEU H 1 44 GLY H . . 5.290 3.630 3.426 3.880 . 0 0 "[ . 1 . 2]" 1
1221 1 42 LEU H 1 45 PRO QD . . 5.810 4.247 3.935 4.661 . 0 0 "[ . 1 . 2]" 1
1222 1 42 LEU HA 1 42 LEU MD1 . . 4.610 3.999 3.899 4.055 . 0 0 "[ . 1 . 2]" 1
1223 1 42 LEU HA 1 42 LEU QD . . 3.400 3.432 3.414 3.450 0.050 13 0 "[ . 1 . 2]" 1
1224 1 42 LEU HA 1 42 LEU MD2 . . 4.610 3.738 3.677 3.848 . 0 0 "[ . 1 . 2]" 1
1225 1 42 LEU QB 1 43 PHE H . . 3.660 3.627 3.567 3.695 0.035 13 0 "[ . 1 . 2]" 1
1226 1 42 LEU QB 1 43 PHE QB . . 5.610 5.125 5.036 5.274 . 0 0 "[ . 1 . 2]" 1
1227 1 42 LEU QB 1 43 PHE QD . . 3.970 4.013 3.992 4.025 0.055 4 0 "[ . 1 . 2]" 1
1228 1 42 LEU QB 1 43 PHE QE . . 5.810 4.720 4.612 4.771 . 0 0 "[ . 1 . 2]" 1
1229 1 42 LEU QB 1 86 TYR QD . . 5.810 4.028 3.709 4.376 . 0 0 "[ . 1 . 2]" 1
1230 1 42 LEU QB 1 86 TYR QE . . 5.040 2.986 2.582 3.414 . 0 0 "[ . 1 . 2]" 1
1231 1 42 LEU QB 1 88 TYR QD . . 5.810 4.543 4.085 5.000 . 0 0 "[ . 1 . 2]" 1
1232 1 42 LEU QB 1 88 TYR QE . . 5.170 4.804 3.985 5.211 0.041 14 0 "[ . 1 . 2]" 1
1233 1 42 LEU HB2 1 43 PHE H . . 4.500 3.907 3.827 4.037 . 0 0 "[ . 1 . 2]" 1
1234 1 42 LEU HB3 1 43 PHE H . . 4.500 4.302 4.224 4.346 . 0 0 "[ . 1 . 2]" 1
1235 1 42 LEU QD 1 43 PHE H . . 4.700 3.313 3.224 3.375 . 0 0 "[ . 1 . 2]" 1
1236 1 42 LEU QD 1 43 PHE HA . . 5.920 4.080 4.015 4.167 . 0 0 "[ . 1 . 2]" 1
1237 1 42 LEU QD 1 43 PHE QB . . 4.940 4.082 3.972 4.230 . 0 0 "[ . 1 . 2]" 1
1238 1 42 LEU QD 1 43 PHE QD . . 4.280 2.446 2.361 2.611 . 0 0 "[ . 1 . 2]" 1
1239 1 42 LEU QD 1 43 PHE QE . . 3.680 2.142 2.096 2.175 . 0 0 "[ . 1 . 2]" 1
1240 1 42 LEU QD 1 44 GLY H . . 5.920 4.969 4.872 5.042 . 0 0 "[ . 1 . 2]" 1
1241 1 42 LEU QD 1 46 ILE QG . . 5.040 4.806 4.684 4.908 . 0 0 "[ . 1 . 2]" 1
1242 1 42 LEU QD 1 70 TYR HH . . 5.920 5.937 5.885 5.954 0.034 4 0 "[ . 1 . 2]" 1
1243 1 42 LEU QD 1 79 CYS HG . . 5.820 5.650 4.581 5.835 0.015 14 0 "[ . 1 . 2]" 1
1244 1 42 LEU QD 1 83 LEU QD . . 3.660 2.119 2.012 2.516 . 0 0 "[ . 1 . 2]" 1
1245 1 42 LEU QD 1 86 TYR QB . . 5.410 3.883 3.649 4.029 . 0 0 "[ . 1 . 2]" 1
1246 1 42 LEU QD 1 86 TYR QD . . 4.100 2.822 2.624 3.055 . 0 0 "[ . 1 . 2]" 1
1247 1 42 LEU QD 1 86 TYR QE . . 3.540 2.076 2.011 2.215 . 0 0 "[ . 1 . 2]" 1
1248 1 42 LEU QD 1 88 TYR QB . . 4.500 3.470 3.309 3.785 . 0 0 "[ . 1 . 2]" 1
1249 1 42 LEU QD 1 88 TYR QD . . 3.990 3.261 3.111 3.440 . 0 0 "[ . 1 . 2]" 1
1250 1 42 LEU QD 1 93 LEU QD . . 4.440 2.323 2.064 2.645 . 0 0 "[ . 1 . 2]" 1
1251 1 42 LEU QD 1 93 LEU HG . . 5.920 4.154 3.904 4.537 . 0 0 "[ . 1 . 2]" 1
1252 1 42 LEU QD 1 95 ILE MD . . 4.160 3.521 3.377 3.756 . 0 0 "[ . 1 . 2]" 1
1253 1 42 LEU MD1 1 43 PHE H . . 5.720 3.576 3.491 3.668 . 0 0 "[ . 1 . 2]" 1
1254 1 42 LEU MD1 1 86 TYR QD . . 4.930 2.878 2.659 3.138 . 0 0 "[ . 1 . 2]" 1
1255 1 42 LEU MD1 1 86 TYR QE . . 4.300 2.429 2.295 2.729 . 0 0 "[ . 1 . 2]" 1
1256 1 42 LEU MD1 1 88 TYR QD . . 4.620 4.509 4.254 4.650 0.030 3 0 "[ . 1 . 2]" 1
1257 1 42 LEU MD2 1 43 PHE H . . 5.720 3.928 3.740 4.165 . 0 0 "[ . 1 . 2]" 1
1258 1 42 LEU MD2 1 86 TYR QD . . 4.930 4.095 3.971 4.193 . 0 0 "[ . 1 . 2]" 1
1259 1 42 LEU MD2 1 86 TYR QE . . 4.300 2.262 2.121 2.390 . 0 0 "[ . 1 . 2]" 1
1260 1 42 LEU MD2 1 88 TYR QD . . 4.620 3.348 3.190 3.546 . 0 0 "[ . 1 . 2]" 1
1261 1 42 LEU HG 1 43 PHE H . . 5.050 2.442 2.280 2.637 . 0 0 "[ . 1 . 2]" 1
1262 1 42 LEU HG 1 43 PHE HA . . 5.660 4.599 4.435 4.843 . 0 0 "[ . 1 . 2]" 1
1263 1 42 LEU HG 1 43 PHE QD . . 5.010 2.216 2.129 2.372 . 0 0 "[ . 1 . 2]" 1
1264 1 42 LEU HG 1 43 PHE QE . . 5.080 3.712 3.553 3.801 . 0 0 "[ . 1 . 2]" 1
1265 1 42 LEU HG 1 43 PHE HZ . . 6.000 5.878 5.692 6.023 0.023 13 0 "[ . 1 . 2]" 1
1266 1 42 LEU HG 1 83 LEU QD . . 4.160 3.967 3.853 4.166 0.006 20 0 "[ . 1 . 2]" 1
1267 1 42 LEU HG 1 86 TYR QE . . 6.000 4.633 4.488 4.849 . 0 0 "[ . 1 . 2]" 1
1268 1 43 PHE H 1 43 PHE QB . . 3.540 2.311 2.251 2.361 . 0 0 "[ . 1 . 2]" 1
1269 1 43 PHE H 1 43 PHE QD . . 4.000 2.490 2.367 2.544 . 0 0 "[ . 1 . 2]" 1
1270 1 43 PHE H 1 43 PHE QE . . 5.940 4.754 4.641 4.815 . 0 0 "[ . 1 . 2]" 1
1271 1 43 PHE H 1 44 GLY H . . 3.820 2.420 2.350 2.503 . 0 0 "[ . 1 . 2]" 1
1272 1 43 PHE H 1 44 GLY QA . . 5.030 4.317 4.254 4.374 . 0 0 "[ . 1 . 2]" 1
1273 1 43 PHE H 1 45 PRO QD . . 4.600 3.597 3.430 3.806 . 0 0 "[ . 1 . 2]" 1
1274 1 43 PHE H 1 45 PRO QG . . 5.810 5.113 4.873 5.384 . 0 0 "[ . 1 . 2]" 1
1275 1 43 PHE H 1 46 ILE MD . . 5.810 5.755 5.524 5.835 0.025 18 0 "[ . 1 . 2]" 1
1276 1 43 PHE H 1 49 ILE MD . . 5.010 4.314 4.208 4.384 . 0 0 "[ . 1 . 2]" 1
1277 1 43 PHE H 1 68 VAL QG . . 5.920 4.772 4.665 4.955 . 0 0 "[ . 1 . 2]" 1
1278 1 43 PHE H 1 70 TYR HH . . 6.000 5.437 5.270 5.815 . 0 0 "[ . 1 . 2]" 1
1279 1 43 PHE H 1 83 LEU QD . . 5.750 4.385 4.234 4.512 . 0 0 "[ . 1 . 2]" 1
1280 1 43 PHE HA 1 43 PHE QD . . 3.900 2.990 2.912 3.101 . 0 0 "[ . 1 . 2]" 1
1281 1 43 PHE HA 1 45 PRO QD . . 3.790 3.577 3.448 3.701 . 0 0 "[ . 1 . 2]" 1
1282 1 43 PHE HA 1 46 ILE H . . 4.500 3.692 3.554 3.821 . 0 0 "[ . 1 . 2]" 1
1283 1 43 PHE HA 1 46 ILE HB . . 6.000 3.563 3.494 3.720 . 0 0 "[ . 1 . 2]" 1
1284 1 43 PHE HA 1 46 ILE MD . . 4.960 3.783 3.593 3.868 . 0 0 "[ . 1 . 2]" 1
1285 1 43 PHE HA 1 70 TYR HH . . 4.280 3.147 2.959 3.341 . 0 0 "[ . 1 . 2]" 1
1286 1 43 PHE HA 1 83 LEU QD . . 4.430 3.330 2.984 3.510 . 0 0 "[ . 1 . 2]" 1
1287 1 43 PHE QB 1 44 GLY H . . 4.170 2.925 2.838 3.007 . 0 0 "[ . 1 . 2]" 1
1288 1 43 PHE QB 1 46 ILE HB . . 5.740 4.214 4.093 4.343 . 0 0 "[ . 1 . 2]" 1
1289 1 43 PHE QB 1 49 ILE QG . . 4.940 2.605 2.422 2.734 . 0 0 "[ . 1 . 2]" 1
1290 1 43 PHE QB 1 68 VAL QG . . 3.740 2.657 2.549 2.789 . 0 0 "[ . 1 . 2]" 1
1291 1 43 PHE QB 1 70 TYR QE . . 4.590 3.360 3.175 3.729 . 0 0 "[ . 1 . 2]" 1
1292 1 43 PHE QB 1 70 TYR HH . . 3.570 2.287 2.024 2.898 . 0 0 "[ . 1 . 2]" 1
1293 1 43 PHE QB 1 79 CYS HG . . 5.740 4.276 3.992 4.840 . 0 0 "[ . 1 . 2]" 1
1294 1 43 PHE QB 1 83 LEU QD . . 5.280 4.527 4.215 4.708 . 0 0 "[ . 1 . 2]" 1
1295 1 43 PHE HB2 1 49 ILE MD . . 4.020 2.813 2.662 2.955 . 0 0 "[ . 1 . 2]" 1
1296 1 43 PHE HB2 1 68 VAL MG1 . . 5.040 3.568 3.419 3.816 . 0 0 "[ . 1 . 2]" 1
1297 1 43 PHE HB2 1 68 VAL MG2 . . 5.040 3.739 3.601 3.907 . 0 0 "[ . 1 . 2]" 1
1298 1 43 PHE HB3 1 49 ILE MD . . 4.020 2.083 2.049 2.107 . 0 0 "[ . 1 . 2]" 1
1299 1 43 PHE HB3 1 68 VAL MG1 . . 5.040 2.907 2.760 3.057 . 0 0 "[ . 1 . 2]" 1
1300 1 43 PHE HB3 1 68 VAL MG2 . . 5.040 3.819 3.672 3.982 . 0 0 "[ . 1 . 2]" 1
1301 1 43 PHE QD 1 44 GLY H . . 5.710 4.512 4.421 4.592 . 0 0 "[ . 1 . 2]" 1
1302 1 43 PHE QD 1 44 GLY QA . . 5.810 5.502 5.477 5.539 . 0 0 "[ . 1 . 2]" 1
1303 1 43 PHE QD 1 46 ILE HB . . 6.000 4.293 4.121 4.661 . 0 0 "[ . 1 . 2]" 1
1304 1 43 PHE QD 1 46 ILE MD . . 5.120 5.040 4.862 5.167 0.047 19 0 "[ . 1 . 2]" 1
1305 1 43 PHE QD 1 46 ILE QG . . 5.350 3.664 3.547 3.905 . 0 0 "[ . 1 . 2]" 1
1306 1 43 PHE QD 1 46 ILE MG . . 6.000 4.496 4.288 4.685 . 0 0 "[ . 1 . 2]" 1
1307 1 43 PHE QD 1 49 ILE MD . . 4.910 3.683 3.281 3.772 . 0 0 "[ . 1 . 2]" 1
1308 1 43 PHE QD 1 68 VAL HB . . 5.770 3.968 3.608 4.180 . 0 0 "[ . 1 . 2]" 1
1309 1 43 PHE QD 1 68 VAL MG1 . . 4.640 2.678 2.197 2.932 . 0 0 "[ . 1 . 2]" 1
1310 1 43 PHE QD 1 68 VAL QG . . 3.770 2.530 2.141 2.725 . 0 0 "[ . 1 . 2]" 1
1311 1 43 PHE QD 1 68 VAL MG2 . . 4.640 3.129 2.955 3.256 . 0 0 "[ . 1 . 2]" 1
1312 1 43 PHE QD 1 70 TYR QD . . 6.000 4.490 4.371 4.575 . 0 0 "[ . 1 . 2]" 1
1313 1 43 PHE QD 1 70 TYR QE . . 4.520 2.211 2.143 2.287 . 0 0 "[ . 1 . 2]" 1
1314 1 43 PHE QD 1 70 TYR HH . . 4.610 1.763 1.661 1.873 . 0 0 "[ . 1 . 2]" 1
1315 1 43 PHE QD 1 79 CYS HA . . 6.000 4.831 4.538 5.409 . 0 0 "[ . 1 . 2]" 1
1316 1 43 PHE QD 1 79 CYS HB2 . . 6.000 4.243 3.571 4.391 . 0 0 "[ . 1 . 2]" 1
1317 1 43 PHE QD 1 79 CYS QB . . 5.150 3.360 3.235 3.625 . 0 0 "[ . 1 . 2]" 1
1318 1 43 PHE QD 1 79 CYS HB3 . . 6.000 3.596 3.345 4.694 . 0 0 "[ . 1 . 2]" 1
1319 1 43 PHE QD 1 79 CYS HG . . 4.240 2.932 2.496 3.821 . 0 0 "[ . 1 . 2]" 1
1320 1 43 PHE QD 1 83 LEU QD . . 3.910 3.767 3.424 3.914 0.004 11 0 "[ . 1 . 2]" 1
1321 1 43 PHE QE 1 46 ILE QG . . 4.730 4.739 4.682 4.782 0.052 11 0 "[ . 1 . 2]" 1
1322 1 43 PHE QE 1 66 ALA MB . . 5.030 4.094 3.806 4.521 . 0 0 "[ . 1 . 2]" 1
1323 1 43 PHE QE 1 68 VAL HB . . 4.900 3.586 3.237 3.818 . 0 0 "[ . 1 . 2]" 1
1324 1 43 PHE QE 1 68 VAL MG1 . . 4.530 3.652 3.342 3.813 . 0 0 "[ . 1 . 2]" 1
1325 1 43 PHE QE 1 68 VAL QG . . 3.670 2.941 2.770 3.017 . 0 0 "[ . 1 . 2]" 1
1326 1 43 PHE QE 1 68 VAL MG2 . . 4.530 3.103 2.956 3.167 . 0 0 "[ . 1 . 2]" 1
1327 1 43 PHE QE 1 76 ALA HA . . 5.570 5.626 5.604 5.646 0.076 17 0 "[ . 1 . 2]" 1
1328 1 43 PHE QE 1 79 CYS HG . . 4.700 3.630 3.110 4.010 . 0 0 "[ . 1 . 2]" 1
1329 1 43 PHE QE 1 83 LEU QB . . 4.220 4.083 3.959 4.228 0.008 19 0 "[ . 1 . 2]" 1
1330 1 43 PHE QE 1 83 LEU QD . . 3.950 3.593 3.083 3.725 . 0 0 "[ . 1 . 2]" 1
1331 1 43 PHE QE 1 83 LEU HG . . 4.870 3.655 3.542 3.795 . 0 0 "[ . 1 . 2]" 1
1332 1 43 PHE QE 1 95 ILE HA . . 6.000 5.998 5.926 6.050 0.050 19 0 "[ . 1 . 2]" 1
1333 1 43 PHE QE 1 95 ILE MD . . 3.390 3.401 3.356 3.419 0.029 19 0 "[ . 1 . 2]" 1
1334 1 43 PHE QE 1 95 ILE QG . . 5.640 5.021 4.892 5.122 . 0 0 "[ . 1 . 2]" 1
1335 1 43 PHE HZ 1 66 ALA MB . . 6.000 4.806 4.556 5.079 . 0 0 "[ . 1 . 2]" 1
1336 1 43 PHE HZ 1 68 VAL QG . . 4.200 3.436 3.328 3.591 . 0 0 "[ . 1 . 2]" 1
1337 1 43 PHE HZ 1 79 CYS HA . . 6.000 6.053 6.022 6.109 0.109 13 0 "[ . 1 . 2]" 1
1338 1 43 PHE HZ 1 83 LEU QD . . 4.790 4.093 3.617 4.237 . 0 0 "[ . 1 . 2]" 1
1339 1 43 PHE HZ 1 95 ILE MD . . 3.460 2.459 2.338 2.614 . 0 0 "[ . 1 . 2]" 1
1340 1 44 GLY H 1 45 PRO QD . . 4.080 2.565 2.447 2.631 . 0 0 "[ . 1 . 2]" 1
1341 1 44 GLY H 1 46 ILE H . . 4.910 4.364 4.243 4.445 . 0 0 "[ . 1 . 2]" 1
1342 1 44 GLY H 1 49 ILE MD . . 4.460 3.326 3.176 3.497 . 0 0 "[ . 1 . 2]" 1
1343 1 44 GLY H 1 49 ILE QG . . 5.810 4.842 4.602 5.118 . 0 0 "[ . 1 . 2]" 1
1344 1 44 GLY QA 1 45 PRO QD . . 3.180 2.677 2.614 2.732 . 0 0 "[ . 1 . 2]" 1
1345 1 44 GLY QA 1 49 ILE MD . . 3.710 2.359 2.238 2.487 . 0 0 "[ . 1 . 2]" 1
1346 1 44 GLY QA 1 49 ILE QG . . 4.470 4.262 4.121 4.470 0.000 11 0 "[ . 1 . 2]" 1
1347 1 44 GLY HA2 1 49 ILE MD . . 4.460 2.389 2.264 2.525 . 0 0 "[ . 1 . 2]" 1
1348 1 44 GLY HA3 1 49 ILE MD . . 4.460 3.666 3.510 3.825 . 0 0 "[ . 1 . 2]" 1
1349 1 45 PRO QB 1 46 ILE HA . . 5.140 4.423 4.368 4.477 . 0 0 "[ . 1 . 2]" 1
1350 1 45 PRO QD 1 46 ILE H . . 4.470 3.022 2.952 3.113 . 0 0 "[ . 1 . 2]" 1
1351 1 46 ILE H 1 46 ILE HB . . 3.660 2.589 2.476 2.680 . 0 0 "[ . 1 . 2]" 1
1352 1 46 ILE H 1 46 ILE MD . . 4.350 3.410 3.280 3.635 . 0 0 "[ . 1 . 2]" 1
1353 1 46 ILE H 1 46 ILE QG . . 3.700 2.186 2.147 2.283 . 0 0 "[ . 1 . 2]" 1
1354 1 46 ILE H 1 46 ILE MG . . 4.410 3.820 3.783 3.850 . 0 0 "[ . 1 . 2]" 1
1355 1 46 ILE H 1 47 GLY H . . 3.800 2.406 2.319 2.464 . 0 0 "[ . 1 . 2]" 1
1356 1 46 ILE H 1 49 ILE MD . . 4.610 4.103 3.867 4.229 . 0 0 "[ . 1 . 2]" 1
1357 1 46 ILE HA 1 46 ILE MD . . 3.860 2.326 2.185 2.552 . 0 0 "[ . 1 . 2]" 1
1358 1 46 ILE HA 1 46 ILE QG . . 3.620 3.116 3.064 3.171 . 0 0 "[ . 1 . 2]" 1
1359 1 46 ILE HA 1 70 TYR QE . . 5.820 5.573 5.258 5.739 . 0 0 "[ . 1 . 2]" 1
1360 1 46 ILE HA 1 70 TYR HH . . 5.970 5.964 5.896 5.986 0.016 17 0 "[ . 1 . 2]" 1
1361 1 46 ILE HA 1 78 PHE QD . . 4.360 4.345 4.078 4.387 0.027 14 0 "[ . 1 . 2]" 1
1362 1 46 ILE HB 1 47 GLY H . . 4.230 2.674 2.443 2.835 . 0 0 "[ . 1 . 2]" 1
1363 1 46 ILE HB 1 70 TYR QE . . 3.960 3.404 2.906 3.560 . 0 0 "[ . 1 . 2]" 1
1364 1 46 ILE HB 1 70 TYR HH . . 3.630 2.973 2.887 3.137 . 0 0 "[ . 1 . 2]" 1
1365 1 46 ILE HB 1 78 PHE QD . . 6.000 5.727 5.124 6.001 0.001 19 0 "[ . 1 . 2]" 1
1366 1 46 ILE HB 1 83 LEU QD . . 5.920 4.391 4.135 4.600 . 0 0 "[ . 1 . 2]" 1
1367 1 46 ILE MD 1 70 TYR HH . . 4.970 4.889 4.511 4.986 0.016 8 0 "[ . 1 . 2]" 1
1368 1 46 ILE MD 1 78 PHE HA . . 5.800 5.456 5.195 5.608 . 0 0 "[ . 1 . 2]" 1
1369 1 46 ILE MD 1 78 PHE QB . . 5.040 3.930 3.575 4.163 . 0 0 "[ . 1 . 2]" 1
1370 1 46 ILE MD 1 78 PHE QD . . 3.880 3.694 2.750 3.886 0.006 13 0 "[ . 1 . 2]" 1
1371 1 46 ILE MD 1 79 CYS H . . 4.900 4.771 4.363 4.900 0.000 3 0 "[ . 1 . 2]" 1
1372 1 46 ILE MD 1 79 CYS HA . . 3.830 2.997 2.605 3.132 . 0 0 "[ . 1 . 2]" 1
1373 1 46 ILE MD 1 79 CYS QB . . 4.550 4.461 3.941 4.569 0.019 7 0 "[ . 1 . 2]" 1
1374 1 46 ILE MD 1 82 LYS H . . 5.480 4.244 3.868 4.439 . 0 0 "[ . 1 . 2]" 1
1375 1 46 ILE MD 1 82 LYS QB . . 3.320 2.411 2.186 2.726 . 0 0 "[ . 1 . 2]" 1
1376 1 46 ILE MD 1 82 LYS QD . . 3.250 2.752 2.205 3.348 0.098 20 0 "[ . 1 . 2]" 1
1377 1 46 ILE MD 1 82 LYS QE . . 5.080 3.440 2.081 4.875 . 0 0 "[ . 1 . 2]" 1
1378 1 46 ILE MD 1 82 LYS HG2 . . 5.240 3.875 2.105 4.621 . 0 0 "[ . 1 . 2]" 1
1379 1 46 ILE MD 1 82 LYS QG . . 4.380 3.497 1.889 4.108 . 0 0 "[ . 1 . 2]" 1
1380 1 46 ILE MD 1 82 LYS HG3 . . 5.240 4.175 2.137 4.884 . 0 0 "[ . 1 . 2]" 1
1381 1 46 ILE MD 1 83 LEU QB . . 4.920 4.674 4.549 4.784 . 0 0 "[ . 1 . 2]" 1
1382 1 46 ILE MD 1 83 LEU MD1 . . 4.460 3.395 2.701 3.588 . 0 0 "[ . 1 . 2]" 1
1383 1 46 ILE MD 1 83 LEU QD . . 3.640 1.971 1.931 2.020 . 0 0 "[ . 1 . 2]" 1
1384 1 46 ILE MD 1 83 LEU MD2 . . 4.460 1.987 1.940 2.083 . 0 0 "[ . 1 . 2]" 1
1385 1 46 ILE MD 1 83 LEU HG . . 4.030 4.066 4.040 4.115 0.085 20 0 "[ . 1 . 2]" 1
1386 1 46 ILE QG 1 46 ILE MG . . 3.060 2.328 2.268 2.378 . 0 0 "[ . 1 . 2]" 1
1387 1 46 ILE QG 1 70 TYR HH . . 4.460 3.279 2.939 3.378 . 0 0 "[ . 1 . 2]" 1
1388 1 46 ILE QG 1 83 LEU QD . . 4.060 2.350 2.137 2.555 . 0 0 "[ . 1 . 2]" 1
1389 1 46 ILE MG 1 48 LYS H . . 5.920 5.529 4.860 5.812 . 0 0 "[ . 1 . 2]" 1
1390 1 46 ILE MG 1 70 TYR QD . . 5.200 4.871 4.572 5.042 . 0 0 "[ . 1 . 2]" 1
1391 1 46 ILE MG 1 70 TYR QE . . 4.130 3.617 3.078 3.883 . 0 0 "[ . 1 . 2]" 1
1392 1 46 ILE MG 1 70 TYR HH . . 4.560 3.678 3.121 3.909 . 0 0 "[ . 1 . 2]" 1
1393 1 46 ILE MG 1 75 ASP HA . . 4.580 3.427 3.053 3.745 . 0 0 "[ . 1 . 2]" 1
1394 1 46 ILE MG 1 75 ASP QB . . 3.900 3.485 3.208 3.905 0.005 16 0 "[ . 1 . 2]" 1
1395 1 46 ILE MG 1 78 PHE H . . 5.470 4.331 4.206 4.496 . 0 0 "[ . 1 . 2]" 1
1396 1 46 ILE MG 1 78 PHE QB . . 3.870 2.140 2.028 2.238 . 0 0 "[ . 1 . 2]" 1
1397 1 46 ILE MG 1 79 CYS H . . 4.040 2.936 2.748 3.136 . 0 0 "[ . 1 . 2]" 1
1398 1 46 ILE MG 1 79 CYS HA . . 3.890 2.631 2.417 2.946 . 0 0 "[ . 1 . 2]" 1
1399 1 47 GLY H 1 48 LYS H . . 5.310 4.336 4.149 4.394 . 0 0 "[ . 1 . 2]" 1
1400 1 47 GLY H 1 70 TYR QE . . 4.120 3.241 2.932 3.854 . 0 0 "[ . 1 . 2]" 1
1401 1 47 GLY H 1 70 TYR HH . . 5.390 4.642 4.387 5.207 . 0 0 "[ . 1 . 2]" 1
1402 1 47 GLY QA 1 48 LYS QB . . 4.940 3.812 3.710 4.012 . 0 0 "[ . 1 . 2]" 1
1403 1 47 GLY QA 1 70 TYR QD . . 5.160 3.966 3.584 5.039 . 0 0 "[ . 1 . 2]" 1
1404 1 47 GLY QA 1 70 TYR QE . . 4.480 2.810 2.541 3.581 . 0 0 "[ . 1 . 2]" 1
1405 1 48 LYS H 1 48 LYS QB . . 3.160 2.393 2.239 3.028 . 0 0 "[ . 1 . 2]" 1
1406 1 48 LYS H 1 48 LYS QD . . 4.720 4.217 2.100 4.751 0.031 1 0 "[ . 1 . 2]" 1
1407 1 48 LYS H 1 48 LYS QE . . 4.610 4.204 3.500 4.578 . 0 0 "[ . 1 . 2]" 1
1408 1 48 LYS H 1 48 LYS HG2 . . 5.220 4.018 1.995 4.622 . 0 0 "[ . 1 . 2]" 1
1409 1 48 LYS H 1 48 LYS QG . . 4.560 3.615 1.983 4.051 . 0 0 "[ . 1 . 2]" 1
1410 1 48 LYS H 1 48 LYS HG3 . . 5.220 4.298 3.432 4.546 . 0 0 "[ . 1 . 2]" 1
1411 1 48 LYS H 1 49 ILE H . . 5.570 4.183 3.625 4.374 . 0 0 "[ . 1 . 2]" 1
1412 1 48 LYS H 1 70 TYR QD . . 5.230 3.423 3.033 3.762 . 0 0 "[ . 1 . 2]" 1
1413 1 48 LYS H 1 70 TYR QE . . 6.000 3.281 2.745 3.811 . 0 0 "[ . 1 . 2]" 1
1414 1 48 LYS H 1 72 ASN H . . 6.000 5.324 4.612 6.012 0.012 16 0 "[ . 1 . 2]" 1
1415 1 48 LYS H 1 72 ASN HD21 . . 6.000 4.595 3.264 5.521 . 0 0 "[ . 1 . 2]" 1
1416 1 48 LYS H 1 72 ASN HD22 . . 6.000 5.174 3.555 6.028 0.028 18 0 "[ . 1 . 2]" 1
1417 1 48 LYS H 1 75 ASP HB2 . . 6.000 4.372 3.629 4.923 . 0 0 "[ . 1 . 2]" 1
1418 1 48 LYS H 1 75 ASP QB . . 5.130 3.520 2.990 3.875 . 0 0 "[ . 1 . 2]" 1
1419 1 48 LYS H 1 75 ASP HB3 . . 6.000 3.717 3.184 4.055 . 0 0 "[ . 1 . 2]" 1
1420 1 48 LYS HA 1 48 LYS HD2 . . 4.960 4.299 3.819 4.668 . 0 0 "[ . 1 . 2]" 1
1421 1 48 LYS HA 1 48 LYS QD . . 4.160 3.832 2.301 4.177 0.017 13 0 "[ . 1 . 2]" 1
1422 1 48 LYS HA 1 48 LYS HD3 . . 4.960 4.444 2.319 5.028 0.068 9 0 "[ . 1 . 2]" 1
1423 1 48 LYS HA 1 48 LYS QE . . 5.730 3.859 2.121 5.423 . 0 0 "[ . 1 . 2]" 1
1424 1 48 LYS HA 1 48 LYS HG2 . . 4.250 3.299 2.878 3.805 . 0 0 "[ . 1 . 2]" 1
1425 1 48 LYS HA 1 48 LYS QG . . 3.730 2.630 2.277 3.398 . 0 0 "[ . 1 . 2]" 1
1426 1 48 LYS HA 1 48 LYS HG3 . . 4.250 2.871 2.335 4.209 . 0 0 "[ . 1 . 2]" 1
1427 1 48 LYS HA 1 49 ILE H . . 3.130 2.195 2.124 2.336 . 0 0 "[ . 1 . 2]" 1
1428 1 48 LYS HA 1 49 ILE HB . . 6.000 4.506 4.311 4.720 . 0 0 "[ . 1 . 2]" 1
1429 1 48 LYS HA 1 49 ILE QG . . 5.600 5.118 4.945 5.245 . 0 0 "[ . 1 . 2]" 1
1430 1 48 LYS QB 1 48 LYS QD . . 3.170 2.354 2.156 2.910 . 0 0 "[ . 1 . 2]" 1
1431 1 48 LYS QB 1 48 LYS QE . . 4.410 2.362 2.036 3.806 . 0 0 "[ . 1 . 2]" 1
1432 1 48 LYS QB 1 49 ILE H . . 4.290 3.968 3.765 4.085 . 0 0 "[ . 1 . 2]" 1
1433 1 48 LYS QB 1 71 GLU H . . 4.230 3.668 3.266 4.039 . 0 0 "[ . 1 . 2]" 1
1434 1 48 LYS QB 1 72 ASN H . . 5.460 4.875 3.736 5.491 0.031 3 0 "[ . 1 . 2]" 1
1435 1 48 LYS QE 1 48 LYS QG . . 3.340 2.423 2.201 2.866 . 0 0 "[ . 1 . 2]" 1
1436 1 48 LYS QG 1 49 ILE H . . 4.190 3.578 3.224 4.352 0.162 3 0 "[ . 1 . 2]" 1
1437 1 48 LYS QG 1 70 TYR QD . . 5.560 4.695 2.771 5.287 . 0 0 "[ . 1 . 2]" 1
1438 1 48 LYS QG 1 71 GLU H . . 5.100 3.930 3.158 4.431 . 0 0 "[ . 1 . 2]" 1
1439 1 48 LYS QG 1 71 GLU QB . . 4.570 2.823 1.972 4.093 . 0 0 "[ . 1 . 2]" 1
1440 1 48 LYS HG2 1 71 GLU H . . 5.870 4.192 3.356 4.890 . 0 0 "[ . 1 . 2]" 1
1441 1 48 LYS HG3 1 71 GLU H . . 5.870 5.055 3.750 5.888 0.018 8 0 "[ . 1 . 2]" 1
1442 1 49 ILE H 1 49 ILE HB . . 3.330 2.511 2.423 2.657 . 0 0 "[ . 1 . 2]" 1
1443 1 49 ILE H 1 49 ILE MD . . 4.260 2.051 1.901 2.141 . 0 0 "[ . 1 . 2]" 1
1444 1 49 ILE H 1 49 ILE HG12 . . 4.830 4.014 3.940 4.212 . 0 0 "[ . 1 . 2]" 1
1445 1 49 ILE H 1 49 ILE QG . . 3.960 3.278 3.129 3.384 . 0 0 "[ . 1 . 2]" 1
1446 1 49 ILE H 1 49 ILE HG13 . . 4.830 3.481 3.251 3.609 . 0 0 "[ . 1 . 2]" 1
1447 1 49 ILE H 1 49 ILE MG . . 4.350 3.823 3.783 3.883 . 0 0 "[ . 1 . 2]" 1
1448 1 49 ILE H 1 50 ASN H . . 5.800 4.564 4.514 4.673 . 0 0 "[ . 1 . 2]" 1
1449 1 49 ILE H 1 70 TYR QD . . 6.000 4.466 3.948 4.752 . 0 0 "[ . 1 . 2]" 1
1450 1 49 ILE H 1 70 TYR QE . . 6.000 3.813 3.243 4.398 . 0 0 "[ . 1 . 2]" 1
1451 1 49 ILE HA 1 49 ILE MD . . 3.640 3.238 3.083 3.442 . 0 0 "[ . 1 . 2]" 1
1452 1 49 ILE HA 1 49 ILE HG12 . . 4.110 3.680 3.520 3.747 . 0 0 "[ . 1 . 2]" 1
1453 1 49 ILE HA 1 49 ILE QG . . 3.490 2.446 2.280 2.508 . 0 0 "[ . 1 . 2]" 1
1454 1 49 ILE HA 1 49 ILE HG13 . . 4.110 2.483 2.310 2.550 . 0 0 "[ . 1 . 2]" 1
1455 1 49 ILE HA 1 50 ASN H . . 3.380 2.158 2.134 2.224 . 0 0 "[ . 1 . 2]" 1
1456 1 49 ILE HA 1 68 VAL QG . . 5.430 3.486 3.365 3.664 . 0 0 "[ . 1 . 2]" 1
1457 1 49 ILE HA 1 70 TYR H . . 5.910 4.972 4.709 5.163 . 0 0 "[ . 1 . 2]" 1
1458 1 49 ILE HA 1 70 TYR HA . . 3.890 2.495 2.209 2.818 . 0 0 "[ . 1 . 2]" 1
1459 1 49 ILE HA 1 70 TYR QD . . 4.640 3.516 3.398 3.645 . 0 0 "[ . 1 . 2]" 1
1460 1 49 ILE HA 1 70 TYR QE . . 5.330 3.940 3.791 4.203 . 0 0 "[ . 1 . 2]" 1
1461 1 49 ILE HA 1 71 GLU H . . 4.180 3.735 3.255 4.209 0.029 16 0 "[ . 1 . 2]" 1
1462 1 49 ILE HB 1 49 ILE MD . . 3.330 2.322 2.258 2.386 . 0 0 "[ . 1 . 2]" 1
1463 1 49 ILE HB 1 50 ASN H . . 5.330 4.263 4.052 4.332 . 0 0 "[ . 1 . 2]" 1
1464 1 49 ILE HB 1 68 VAL QG . . 5.920 4.050 3.897 4.131 . 0 0 "[ . 1 . 2]" 1
1465 1 49 ILE MD 1 68 VAL HB . . 5.640 5.706 5.681 5.725 0.085 18 0 "[ . 1 . 2]" 1
1466 1 49 ILE MD 1 70 TYR QD . . 4.360 4.111 3.905 4.269 . 0 0 "[ . 1 . 2]" 1
1467 1 49 ILE MD 1 70 TYR QE . . 4.260 2.767 2.508 3.069 . 0 0 "[ . 1 . 2]" 1
1468 1 49 ILE MD 1 70 TYR HH . . 4.710 2.947 2.794 3.245 . 0 0 "[ . 1 . 2]" 1
1469 1 49 ILE QG 1 49 ILE MG . . 3.260 2.018 2.002 2.052 . 0 0 "[ . 1 . 2]" 1
1470 1 49 ILE QG 1 50 ASN H . . 5.050 4.176 4.063 4.245 . 0 0 "[ . 1 . 2]" 1
1471 1 49 ILE QG 1 52 ALA MB . . 5.730 3.258 3.129 3.571 . 0 0 "[ . 1 . 2]" 1
1472 1 49 ILE QG 1 68 VAL QG . . 3.880 2.101 2.063 2.136 . 0 0 "[ . 1 . 2]" 1
1473 1 49 ILE QG 1 70 TYR HA . . 5.810 4.301 3.587 4.728 . 0 0 "[ . 1 . 2]" 1
1474 1 49 ILE QG 1 70 TYR QD . . 4.810 3.741 3.385 3.865 . 0 0 "[ . 1 . 2]" 1
1475 1 49 ILE QG 1 70 TYR QE . . 4.550 2.964 2.904 3.029 . 0 0 "[ . 1 . 2]" 1
1476 1 49 ILE QG 1 70 TYR HH . . 5.180 3.320 3.150 3.613 . 0 0 "[ . 1 . 2]" 1
1477 1 49 ILE HG12 1 50 ASN H . . 5.890 5.276 5.094 5.390 . 0 0 "[ . 1 . 2]" 1
1478 1 49 ILE HG12 1 70 TYR HH . . 6.000 4.308 4.162 4.453 . 0 0 "[ . 1 . 2]" 1
1479 1 49 ILE HG13 1 50 ASN H . . 5.890 4.377 4.251 4.469 . 0 0 "[ . 1 . 2]" 1
1480 1 49 ILE HG13 1 70 TYR HH . . 6.000 3.460 3.240 3.905 . 0 0 "[ . 1 . 2]" 1
1481 1 49 ILE MG 1 50 ASN H . . 3.880 2.737 2.446 2.846 . 0 0 "[ . 1 . 2]" 1
1482 1 49 ILE MG 1 50 ASN HA . . 6.000 3.936 3.569 4.088 . 0 0 "[ . 1 . 2]" 1
1483 1 49 ILE MG 1 50 ASN QB . . 5.320 4.017 3.825 4.210 . 0 0 "[ . 1 . 2]" 1
1484 1 49 ILE MG 1 51 ASN H . . 3.490 2.177 2.072 2.246 . 0 0 "[ . 1 . 2]" 1
1485 1 49 ILE MG 1 51 ASN HA . . 4.920 2.929 2.821 3.165 . 0 0 "[ . 1 . 2]" 1
1486 1 49 ILE MG 1 51 ASN HB2 . . 6.000 4.402 4.340 4.482 . 0 0 "[ . 1 . 2]" 1
1487 1 49 ILE MG 1 51 ASN HB3 . . 6.000 4.527 4.475 4.654 . 0 0 "[ . 1 . 2]" 1
1488 1 49 ILE MG 1 52 ALA HA . . 5.430 3.930 3.863 3.983 . 0 0 "[ . 1 . 2]" 1
1489 1 49 ILE MG 1 52 ALA MB . . 3.490 2.110 2.041 2.179 . 0 0 "[ . 1 . 2]" 1
1490 1 49 ILE MG 1 53 GLU H . . 6.000 5.546 5.430 5.609 . 0 0 "[ . 1 . 2]" 1
1491 1 49 ILE MG 1 68 VAL HA . . 4.650 3.615 3.532 3.699 . 0 0 "[ . 1 . 2]" 1
1492 1 49 ILE MG 1 68 VAL HB . . 5.640 4.646 4.416 4.758 . 0 0 "[ . 1 . 2]" 1
1493 1 49 ILE MG 1 68 VAL MG1 . . 4.710 2.154 1.958 2.241 . 0 0 "[ . 1 . 2]" 1
1494 1 49 ILE MG 1 68 VAL QG . . 3.380 2.143 1.951 2.229 . 0 0 "[ . 1 . 2]" 1
1495 1 49 ILE MG 1 68 VAL MG2 . . 4.710 3.832 3.641 3.950 . 0 0 "[ . 1 . 2]" 1
1496 1 49 ILE MG 1 69 GLU H . . 3.880 2.474 2.360 2.564 . 0 0 "[ . 1 . 2]" 1
1497 1 49 ILE MG 1 69 GLU QB . . 5.140 3.808 3.725 3.947 . 0 0 "[ . 1 . 2]" 1
1498 1 49 ILE MG 1 70 TYR H . . 6.000 5.164 4.816 5.296 . 0 0 "[ . 1 . 2]" 1
1499 1 49 ILE MG 1 70 TYR HA . . 5.190 3.990 3.497 4.210 . 0 0 "[ . 1 . 2]" 1
1500 1 49 ILE MG 1 70 TYR QD . . 4.570 4.363 4.223 4.445 . 0 0 "[ . 1 . 2]" 1
1501 1 49 ILE MG 1 70 TYR QE . . 4.380 4.384 4.340 4.413 0.033 11 0 "[ . 1 . 2]" 1
1502 1 50 ASN H 1 50 ASN QB . . 3.610 2.249 2.067 2.444 . 0 0 "[ . 1 . 2]" 1
1503 1 50 ASN H 1 50 ASN HD21 . . 5.140 3.721 2.821 4.236 . 0 0 "[ . 1 . 2]" 1
1504 1 50 ASN H 1 50 ASN QD . . 4.400 3.582 2.791 3.995 . 0 0 "[ . 1 . 2]" 1
1505 1 50 ASN H 1 50 ASN HD22 . . 5.140 4.847 4.450 5.223 0.083 13 0 "[ . 1 . 2]" 1
1506 1 50 ASN H 1 51 ASN H . . 3.590 2.298 2.008 2.452 . 0 0 "[ . 1 . 2]" 1
1507 1 50 ASN H 1 70 TYR HA . . 4.160 2.362 2.249 2.600 . 0 0 "[ . 1 . 2]" 1
1508 1 50 ASN H 1 70 TYR QD . . 5.180 4.494 4.361 4.647 . 0 0 "[ . 1 . 2]" 1
1509 1 50 ASN H 1 70 TYR QE . . 6.000 5.534 5.334 5.891 . 0 0 "[ . 1 . 2]" 1
1510 1 50 ASN H 1 71 GLU H . . 5.360 3.504 3.277 3.801 . 0 0 "[ . 1 . 2]" 1
1511 1 50 ASN HA 1 71 GLU H . . 4.710 4.815 4.792 4.842 0.132 17 0 "[ . 1 . 2]" 1
1512 1 50 ASN QB 1 51 ASN H . . 4.470 2.847 2.485 3.281 . 0 0 "[ . 1 . 2]" 1
1513 1 50 ASN QB 1 69 GLU QG . . 4.960 3.968 3.667 4.399 . 0 0 "[ . 1 . 2]" 1
1514 1 50 ASN QD 1 71 GLU HA . . 3.620 2.632 1.838 3.570 . 0 0 "[ . 1 . 2]" 1
1515 1 50 ASN QD 1 71 GLU QB . . 4.750 2.884 1.888 4.012 . 0 0 "[ . 1 . 2]" 1
1516 1 50 ASN QD 1 71 GLU QG . . 4.210 3.170 2.421 4.233 0.023 17 0 "[ . 1 . 2]" 1
1517 1 50 ASN HD21 1 71 GLU HA . . 4.270 3.642 2.629 4.284 0.014 7 0 "[ . 1 . 2]" 1
1518 1 50 ASN HD22 1 71 GLU HA . . 4.270 2.814 1.845 4.088 . 0 0 "[ . 1 . 2]" 1
1519 1 51 ASN H 1 68 VAL QG . . 5.920 4.080 3.965 4.163 . 0 0 "[ . 1 . 2]" 1
1520 1 51 ASN H 1 69 GLU H . . 3.680 3.104 3.012 3.212 . 0 0 "[ . 1 . 2]" 1
1521 1 51 ASN H 1 69 GLU QB . . 3.840 2.723 2.603 2.909 . 0 0 "[ . 1 . 2]" 1
1522 1 51 ASN HA 1 52 ALA H . . 3.410 2.403 2.368 2.440 . 0 0 "[ . 1 . 2]" 1
1523 1 51 ASN HA 1 52 ALA MB . . 5.890 3.855 3.825 3.886 . 0 0 "[ . 1 . 2]" 1
1524 1 51 ASN HA 1 69 GLU H . . 6.000 5.000 4.929 5.041 . 0 0 "[ . 1 . 2]" 1
1525 1 51 ASN QB 1 52 ALA H . . 4.000 2.468 2.425 2.521 . 0 0 "[ . 1 . 2]" 1
1526 1 51 ASN QB 1 53 GLU H . . 5.490 5.451 5.372 5.500 0.010 18 0 "[ . 1 . 2]" 1
1527 1 51 ASN QB 1 68 VAL QG . . 5.730 5.043 4.932 5.116 . 0 0 "[ . 1 . 2]" 1
1528 1 51 ASN QB 1 69 GLU H . . 4.650 4.301 4.152 4.398 . 0 0 "[ . 1 . 2]" 1
1529 1 51 ASN QB 1 69 GLU QB . . 4.030 2.587 2.512 2.719 . 0 0 "[ . 1 . 2]" 1
1530 1 51 ASN QD 1 52 ALA H . . 4.530 4.597 4.586 4.612 0.082 17 0 "[ . 1 . 2]" 1
1531 1 51 ASN QD 1 53 GLU QG . . 5.460 5.034 4.768 5.178 . 0 0 "[ . 1 . 2]" 1
1532 1 51 ASN QD 1 69 GLU QB . . 4.280 4.315 4.302 4.324 0.044 17 0 "[ . 1 . 2]" 1
1533 1 52 ALA H 1 53 GLU H . . 5.310 4.327 4.276 4.358 . 0 0 "[ . 1 . 2]" 1
1534 1 52 ALA H 1 53 GLU QG . . 5.210 3.296 3.156 3.378 . 0 0 "[ . 1 . 2]" 1
1535 1 52 ALA H 1 68 VAL MG1 . . 6.000 5.193 5.088 5.285 . 0 0 "[ . 1 . 2]" 1
1536 1 52 ALA H 1 68 VAL MG2 . . 6.000 5.677 5.573 5.760 . 0 0 "[ . 1 . 2]" 1
1537 1 52 ALA HA 1 53 GLU H . . 3.250 2.293 2.266 2.316 . 0 0 "[ . 1 . 2]" 1
1538 1 52 ALA HA 1 68 VAL HA . . 4.510 2.319 2.278 2.371 . 0 0 "[ . 1 . 2]" 1
1539 1 52 ALA HA 1 68 VAL HB . . 5.370 5.332 5.275 5.382 0.012 8 0 "[ . 1 . 2]" 1
1540 1 52 ALA HA 1 68 VAL MG1 . . 4.680 3.810 3.723 3.903 . 0 0 "[ . 1 . 2]" 1
1541 1 52 ALA HA 1 68 VAL QG . . 3.990 3.298 3.204 3.372 . 0 0 "[ . 1 . 2]" 1
1542 1 52 ALA HA 1 68 VAL MG2 . . 4.680 3.612 3.493 3.706 . 0 0 "[ . 1 . 2]" 1
1543 1 52 ALA HA 1 69 GLU H . . 4.570 3.696 3.596 3.827 . 0 0 "[ . 1 . 2]" 1
1544 1 52 ALA HA 1 69 GLU QB . . 5.510 4.220 4.111 4.383 . 0 0 "[ . 1 . 2]" 1
1545 1 52 ALA MB 1 53 GLU H . . 3.970 2.770 2.689 2.885 . 0 0 "[ . 1 . 2]" 1
1546 1 52 ALA MB 1 53 GLU HA . . 5.260 4.167 4.118 4.211 . 0 0 "[ . 1 . 2]" 1
1547 1 52 ALA MB 1 68 VAL H . . 4.880 4.741 4.646 4.828 . 0 0 "[ . 1 . 2]" 1
1548 1 52 ALA MB 1 68 VAL HA . . 4.080 2.423 2.314 2.537 . 0 0 "[ . 1 . 2]" 1
1549 1 52 ALA MB 1 68 VAL MG1 . . 3.550 2.139 2.077 2.194 . 0 0 "[ . 1 . 2]" 1
1550 1 52 ALA MB 1 68 VAL MG2 . . 3.550 2.197 2.126 2.263 . 0 0 "[ . 1 . 2]" 1
1551 1 52 ALA MB 1 69 GLU H . . 4.790 3.188 3.049 3.319 . 0 0 "[ . 1 . 2]" 1
1552 1 53 GLU H 1 53 GLU QG . . 3.410 3.373 3.221 3.440 0.030 19 0 "[ . 1 . 2]" 1
1553 1 53 GLU H 1 54 LEU H . . 5.300 4.358 4.331 4.386 . 0 0 "[ . 1 . 2]" 1
1554 1 53 GLU H 1 54 LEU HA . . 4.700 4.736 4.724 4.748 0.048 12 0 "[ . 1 . 2]" 1
1555 1 53 GLU H 1 67 VAL QG . . 4.510 4.032 3.956 4.091 . 0 0 "[ . 1 . 2]" 1
1556 1 53 GLU H 1 68 VAL H . . 5.290 5.069 5.016 5.125 . 0 0 "[ . 1 . 2]" 1
1557 1 53 GLU H 1 68 VAL HA . . 4.500 3.730 3.642 3.817 . 0 0 "[ . 1 . 2]" 1
1558 1 53 GLU H 1 68 VAL MG1 . . 6.000 5.118 5.039 5.205 . 0 0 "[ . 1 . 2]" 1
1559 1 53 GLU H 1 68 VAL QG . . 4.620 3.738 3.616 3.856 . 0 0 "[ . 1 . 2]" 1
1560 1 53 GLU H 1 68 VAL MG2 . . 6.000 3.842 3.705 3.977 . 0 0 "[ . 1 . 2]" 1
1561 1 53 GLU H 1 69 GLU H . . 6.000 5.753 5.658 5.886 . 0 0 "[ . 1 . 2]" 1
1562 1 53 GLU HA 1 53 GLU QG . . 3.590 3.130 3.069 3.230 . 0 0 "[ . 1 . 2]" 1
1563 1 53 GLU HA 1 54 LEU H . . 3.460 2.400 2.325 2.502 . 0 0 "[ . 1 . 2]" 1
1564 1 53 GLU QB 1 53 GLU QG . . 2.360 2.003 1.995 2.013 . 0 0 "[ . 1 . 2]" 1
1565 1 53 GLU QB 1 54 LEU H . . 4.110 2.387 2.284 2.511 . 0 0 "[ . 1 . 2]" 1
1566 1 53 GLU QG 1 54 LEU H . . 5.510 4.350 4.261 4.412 . 0 0 "[ . 1 . 2]" 1
1567 1 54 LEU H 1 54 LEU HB2 . . 4.020 2.368 2.299 2.439 . 0 0 "[ . 1 . 2]" 1
1568 1 54 LEU H 1 54 LEU QB . . 3.380 2.338 2.273 2.405 . 0 0 "[ . 1 . 2]" 1
1569 1 54 LEU H 1 54 LEU HB3 . . 4.020 3.620 3.579 3.659 . 0 0 "[ . 1 . 2]" 1
1570 1 54 LEU H 1 54 LEU MD1 . . 4.890 3.822 3.694 3.956 . 0 0 "[ . 1 . 2]" 1
1571 1 54 LEU H 1 54 LEU QD . . 4.290 3.393 3.330 3.451 . 0 0 "[ . 1 . 2]" 1
1572 1 54 LEU H 1 54 LEU MD2 . . 4.890 3.805 3.615 3.965 . 0 0 "[ . 1 . 2]" 1
1573 1 54 LEU H 1 54 LEU HG . . 3.980 2.826 2.741 2.905 . 0 0 "[ . 1 . 2]" 1
1574 1 54 LEU H 1 55 LYS H . . 6.000 4.607 4.573 4.641 . 0 0 "[ . 1 . 2]" 1
1575 1 54 LEU H 1 66 ALA HA . . 6.000 4.766 4.712 4.821 . 0 0 "[ . 1 . 2]" 1
1576 1 54 LEU H 1 66 ALA MB . . 5.780 5.068 4.871 5.304 . 0 0 "[ . 1 . 2]" 1
1577 1 54 LEU HA 1 54 LEU MD1 . . 4.670 3.908 3.881 3.932 . 0 0 "[ . 1 . 2]" 1
1578 1 54 LEU HA 1 54 LEU QD . . 3.530 2.144 2.105 2.191 . 0 0 "[ . 1 . 2]" 1
1579 1 54 LEU HA 1 54 LEU MD2 . . 4.670 2.153 2.114 2.202 . 0 0 "[ . 1 . 2]" 1
1580 1 54 LEU HA 1 55 LYS H . . 3.560 2.280 2.242 2.314 . 0 0 "[ . 1 . 2]" 1
1581 1 54 LEU HA 1 65 VAL QG . . 5.790 4.350 4.258 4.457 . 0 0 "[ . 1 . 2]" 1
1582 1 54 LEU HA 1 66 ALA H . . 5.250 4.777 4.734 4.825 . 0 0 "[ . 1 . 2]" 1
1583 1 54 LEU HA 1 66 ALA MB . . 4.160 3.271 3.145 3.442 . 0 0 "[ . 1 . 2]" 1
1584 1 54 LEU HA 1 67 VAL H . . 4.320 3.334 3.250 3.401 . 0 0 "[ . 1 . 2]" 1
1585 1 54 LEU QB 1 54 LEU QD . . 2.780 1.975 1.966 1.986 . 0 0 "[ . 1 . 2]" 1
1586 1 54 LEU QB 1 55 LYS H . . 4.080 2.954 2.857 3.031 . 0 0 "[ . 1 . 2]" 1
1587 1 54 LEU QB 1 56 PRO QD . . 4.620 4.642 4.632 4.654 0.034 10 0 "[ . 1 . 2]" 1
1588 1 54 LEU QB 1 63 THR HG1 . . 5.810 4.246 4.026 4.546 . 0 0 "[ . 1 . 2]" 1
1589 1 54 LEU QB 1 65 VAL H . . 5.810 4.637 4.447 4.773 . 0 0 "[ . 1 . 2]" 1
1590 1 54 LEU QB 1 66 ALA HA . . 5.040 4.047 3.922 4.144 . 0 0 "[ . 1 . 2]" 1
1591 1 54 LEU HB2 1 54 LEU MD1 . . 3.640 2.357 2.328 2.388 . 0 0 "[ . 1 . 2]" 1
1592 1 54 LEU HB2 1 54 LEU MD2 . . 3.640 3.256 3.245 3.266 . 0 0 "[ . 1 . 2]" 1
1593 1 54 LEU HB2 1 66 ALA HA . . 5.710 5.065 4.983 5.129 . 0 0 "[ . 1 . 2]" 1
1594 1 54 LEU HB3 1 54 LEU MD1 . . 3.640 2.420 2.359 2.476 . 0 0 "[ . 1 . 2]" 1
1595 1 54 LEU HB3 1 54 LEU MD2 . . 3.640 2.405 2.357 2.447 . 0 0 "[ . 1 . 2]" 1
1596 1 54 LEU HB3 1 66 ALA HA . . 5.710 4.256 4.103 4.375 . 0 0 "[ . 1 . 2]" 1
1597 1 54 LEU QD 1 65 VAL H . . 4.690 4.026 3.753 4.356 . 0 0 "[ . 1 . 2]" 1
1598 1 54 LEU QD 1 66 ALA H . . 5.210 4.037 3.933 4.200 . 0 0 "[ . 1 . 2]" 1
1599 1 54 LEU QD 1 66 ALA HA . . 4.380 2.536 2.347 2.671 . 0 0 "[ . 1 . 2]" 1
1600 1 54 LEU QD 1 66 ALA MB . . 3.660 2.104 2.019 2.200 . 0 0 "[ . 1 . 2]" 1
1601 1 54 LEU MD1 1 66 ALA HA . . 5.860 5.118 4.921 5.252 . 0 0 "[ . 1 . 2]" 1
1602 1 54 LEU MD2 1 66 ALA HA . . 5.860 2.542 2.351 2.678 . 0 0 "[ . 1 . 2]" 1
1603 1 54 LEU HG 1 66 ALA MB . . 4.260 4.083 3.825 4.268 0.008 20 0 "[ . 1 . 2]" 1
1604 1 54 LEU HG 1 67 VAL H . . 5.450 5.454 5.355 5.479 0.029 5 0 "[ . 1 . 2]" 1
1605 1 55 LYS H 1 55 LYS HB2 . . 3.970 2.279 2.110 2.354 . 0 0 "[ . 1 . 2]" 1
1606 1 55 LYS H 1 55 LYS QB . . 3.460 2.179 2.052 2.222 . 0 0 "[ . 1 . 2]" 1
1607 1 55 LYS H 1 55 LYS HB3 . . 3.970 2.786 2.653 2.881 . 0 0 "[ . 1 . 2]" 1
1608 1 55 LYS H 1 55 LYS QD . . 5.160 4.467 4.347 4.551 . 0 0 "[ . 1 . 2]" 1
1609 1 55 LYS H 1 55 LYS QG . . 3.940 3.879 3.782 3.941 0.001 12 0 "[ . 1 . 2]" 1
1610 1 55 LYS H 1 56 PRO QD . . 5.810 4.346 4.323 4.372 . 0 0 "[ . 1 . 2]" 1
1611 1 55 LYS H 1 63 THR HB . . 5.560 5.311 5.223 5.552 . 0 0 "[ . 1 . 2]" 1
1612 1 55 LYS H 1 63 THR HG1 . . 5.590 3.442 3.335 3.589 . 0 0 "[ . 1 . 2]" 1
1613 1 55 LYS H 1 65 VAL H . . 5.720 3.904 3.801 3.987 . 0 0 "[ . 1 . 2]" 1
1614 1 55 LYS H 1 65 VAL MG1 . . 4.880 3.229 3.121 3.372 . 0 0 "[ . 1 . 2]" 1
1615 1 55 LYS H 1 65 VAL MG2 . . 4.880 4.928 4.901 4.948 0.068 18 0 "[ . 1 . 2]" 1
1616 1 55 LYS H 1 66 ALA HA . . 3.940 2.953 2.825 3.132 . 0 0 "[ . 1 . 2]" 1
1617 1 55 LYS H 1 66 ALA MB . . 4.830 4.396 4.279 4.557 . 0 0 "[ . 1 . 2]" 1
1618 1 55 LYS H 1 67 VAL H . . 5.610 4.387 4.251 4.533 . 0 0 "[ . 1 . 2]" 1
1619 1 55 LYS H 1 67 VAL QG . . 4.370 4.385 4.373 4.400 0.030 9 0 "[ . 1 . 2]" 1
1620 1 55 LYS HA 1 55 LYS QD . . 4.860 3.801 2.967 4.019 . 0 0 "[ . 1 . 2]" 1
1621 1 55 LYS HA 1 55 LYS QE . . 4.370 4.249 4.029 4.404 0.034 12 0 "[ . 1 . 2]" 1
1622 1 55 LYS HA 1 55 LYS HG2 . . 4.160 2.671 2.289 2.992 . 0 0 "[ . 1 . 2]" 1
1623 1 55 LYS HA 1 55 LYS HG3 . . 4.160 2.637 2.318 3.610 . 0 0 "[ . 1 . 2]" 1
1624 1 55 LYS HA 1 56 PRO QD . . 3.340 2.051 2.030 2.095 . 0 0 "[ . 1 . 2]" 1
1625 1 55 LYS HA 1 63 THR MG . . 4.710 4.563 4.359 4.734 0.024 17 0 "[ . 1 . 2]" 1
1626 1 55 LYS HA 1 65 VAL QG . . 5.920 4.309 4.252 4.370 . 0 0 "[ . 1 . 2]" 1
1627 1 55 LYS QB 1 55 LYS QD . . 3.040 2.221 2.143 2.361 . 0 0 "[ . 1 . 2]" 1
1628 1 55 LYS QB 1 55 LYS QE . . 4.270 3.531 3.473 3.645 . 0 0 "[ . 1 . 2]" 1
1629 1 55 LYS QB 1 56 PRO QD . . 4.160 3.650 3.601 3.750 . 0 0 "[ . 1 . 2]" 1
1630 1 55 LYS QB 1 63 THR HB . . 5.810 3.338 3.153 3.771 . 0 0 "[ . 1 . 2]" 1
1631 1 55 LYS QB 1 63 THR HG1 . . 4.770 2.455 2.330 2.726 . 0 0 "[ . 1 . 2]" 1
1632 1 55 LYS QB 1 65 VAL QG . . 4.050 2.137 2.040 2.189 . 0 0 "[ . 1 . 2]" 1
1633 1 55 LYS QB 1 67 VAL H . . 5.640 4.784 4.305 5.039 . 0 0 "[ . 1 . 2]" 1
1634 1 55 LYS QD 1 63 THR HG1 . . 5.810 4.231 3.826 4.495 . 0 0 "[ . 1 . 2]" 1
1635 1 55 LYS QD 1 65 VAL QG . . 4.170 2.448 2.175 3.418 . 0 0 "[ . 1 . 2]" 1
1636 1 55 LYS QE 1 55 LYS QG . . 3.300 2.067 2.036 2.159 . 0 0 "[ . 1 . 2]" 1
1637 1 55 LYS QE 1 65 VAL QG . . 5.040 3.834 3.616 3.993 . 0 0 "[ . 1 . 2]" 1
1638 1 55 LYS QE 1 67 VAL QG . . 4.980 4.097 3.941 4.218 . 0 0 "[ . 1 . 2]" 1
1639 1 55 LYS QG 1 56 PRO QD . . 3.960 2.471 2.290 3.054 . 0 0 "[ . 1 . 2]" 1
1640 1 55 LYS QG 1 65 VAL QG . . 3.650 3.301 2.378 3.555 . 0 0 "[ . 1 . 2]" 1
1641 1 55 LYS HG2 1 63 THR HG1 . . 6.000 4.526 4.085 5.586 . 0 0 "[ . 1 . 2]" 1
1642 1 55 LYS HG2 1 65 VAL MG1 . . 6.030 4.293 3.646 4.488 . 0 0 "[ . 1 . 2]" 1
1643 1 55 LYS HG2 1 65 VAL MG2 . . 6.030 5.444 5.152 5.642 . 0 0 "[ . 1 . 2]" 1
1644 1 55 LYS HG3 1 63 THR HG1 . . 6.000 5.234 5.117 5.305 . 0 0 "[ . 1 . 2]" 1
1645 1 55 LYS HG3 1 65 VAL MG1 . . 6.030 3.558 2.429 4.013 . 0 0 "[ . 1 . 2]" 1
1646 1 55 LYS HG3 1 65 VAL MG2 . . 6.030 5.215 4.157 5.632 . 0 0 "[ . 1 . 2]" 1
1647 1 56 PRO HA 1 57 GLN H . . 3.330 2.444 2.298 2.614 . 0 0 "[ . 1 . 2]" 1
1648 1 56 PRO HA 1 57 GLN QB . . 5.810 3.722 3.549 3.945 . 0 0 "[ . 1 . 2]" 1
1649 1 56 PRO HA 1 57 GLN QG . . 5.810 5.425 4.698 5.680 . 0 0 "[ . 1 . 2]" 1
1650 1 56 PRO HA 1 63 THR H . . 6.000 4.880 4.393 5.209 . 0 0 "[ . 1 . 2]" 1
1651 1 56 PRO HA 1 63 THR MG . . 4.910 3.588 3.309 3.773 . 0 0 "[ . 1 . 2]" 1
1652 1 56 PRO QB 1 57 GLN H . . 3.850 2.576 2.243 2.945 . 0 0 "[ . 1 . 2]" 1
1653 1 56 PRO QB 1 57 GLN HA . . 4.340 4.194 4.064 4.340 0.000 1 0 "[ . 1 . 2]" 1
1654 1 57 GLN H 1 57 GLN QE . . 5.810 5.085 3.661 5.871 0.061 2 0 "[ . 1 . 2]" 1
1655 1 57 GLN H 1 57 GLN HG2 . . 4.350 4.142 3.365 4.469 0.119 1 0 "[ . 1 . 2]" 1
1656 1 57 GLN H 1 57 GLN QG . . 3.820 3.798 3.229 3.907 0.087 18 0 "[ . 1 . 2]" 1
1657 1 57 GLN H 1 57 GLN HG3 . . 4.350 4.436 4.157 4.490 0.140 20 0 "[ . 1 . 2]" 1
1658 1 57 GLN H 1 60 GLY H . . 5.620 4.199 3.841 4.736 . 0 0 "[ . 1 . 2]" 1
1659 1 57 GLN H 1 61 GLN H . . 6.000 5.179 4.324 6.020 0.020 17 0 "[ . 1 . 2]" 1
1660 1 57 GLN HA 1 63 THR MG . . 4.310 3.732 3.287 3.890 . 0 0 "[ . 1 . 2]" 1
1661 1 57 GLN QB 1 58 GLU H . . 4.180 3.622 2.456 3.831 . 0 0 "[ . 1 . 2]" 1
1662 1 57 GLN QB 1 59 ASN H . . 5.810 3.864 2.807 4.309 . 0 0 "[ . 1 . 2]" 1
1663 1 57 GLN QB 1 60 GLY H . . 5.460 3.858 2.586 4.584 . 0 0 "[ . 1 . 2]" 1
1664 1 57 GLN QB 1 61 GLN H . . 5.470 3.641 2.698 4.313 . 0 0 "[ . 1 . 2]" 1
1665 1 57 GLN QB 1 63 THR HA . . 4.420 4.110 3.695 4.443 0.023 6 0 "[ . 1 . 2]" 1
1666 1 57 GLN QB 1 63 THR HG1 . . 4.450 4.335 4.193 4.478 0.028 2 0 "[ . 1 . 2]" 1
1667 1 57 GLN QB 1 63 THR MG . . 3.540 2.108 2.014 2.493 . 0 0 "[ . 1 . 2]" 1
1668 1 57 GLN HB2 1 58 GLU H . . 4.820 4.057 2.484 4.394 . 0 0 "[ . 1 . 2]" 1
1669 1 57 GLN HB3 1 58 GLU H . . 4.820 4.195 3.175 4.482 . 0 0 "[ . 1 . 2]" 1
1670 1 57 GLN QE 1 58 GLU H . . 5.810 5.318 3.964 5.830 0.020 17 0 "[ . 1 . 2]" 1
1671 1 57 GLN QE 1 61 GLN QB . . 3.950 3.124 2.530 3.990 0.040 1 0 "[ . 1 . 2]" 1
1672 1 57 GLN QE 1 63 THR H . . 5.810 4.451 2.969 5.816 0.006 6 0 "[ . 1 . 2]" 1
1673 1 57 GLN QE 1 63 THR HA . . 4.380 3.287 2.790 4.215 . 0 0 "[ . 1 . 2]" 1
1674 1 57 GLN QE 1 63 THR MG . . 3.970 2.934 2.522 3.537 . 0 0 "[ . 1 . 2]" 1
1675 1 57 GLN HE21 1 63 THR MG . . 4.700 3.146 2.606 3.652 . 0 0 "[ . 1 . 2]" 1
1676 1 57 GLN HE22 1 63 THR MG . . 4.700 3.569 3.214 4.730 0.030 6 0 "[ . 1 . 2]" 1
1677 1 57 GLN QG 1 58 GLU H . . 5.050 2.749 2.450 3.575 . 0 0 "[ . 1 . 2]" 1
1678 1 57 GLN QG 1 59 ASN H . . 4.860 2.476 2.016 4.535 . 0 0 "[ . 1 . 2]" 1
1679 1 57 GLN QG 1 60 GLY H . . 4.700 3.327 1.894 4.754 0.054 2 0 "[ . 1 . 2]" 1
1680 1 57 GLN QG 1 61 GLN H . . 4.700 3.159 2.354 4.575 . 0 0 "[ . 1 . 2]" 1
1681 1 57 GLN QG 1 63 THR MG . . 4.020 3.449 1.916 3.813 . 0 0 "[ . 1 . 2]" 1
1682 1 58 GLU H 1 58 GLU QG . . 3.830 2.552 2.152 3.871 0.041 12 0 "[ . 1 . 2]" 1
1683 1 58 GLU H 1 61 GLN H . . 6.000 5.940 5.639 6.039 0.039 19 0 "[ . 1 . 2]" 1
1684 1 59 ASN H 1 60 GLY H . . 5.420 2.692 2.433 2.811 . 0 0 "[ . 1 . 2]" 1
1685 1 59 ASN QB 1 61 GLN H . . 5.810 3.026 1.946 4.139 . 0 0 "[ . 1 . 2]" 1
1686 1 59 ASN QB 1 61 GLN QG . . 5.010 3.348 2.319 4.763 . 0 0 "[ . 1 . 2]" 1
1687 1 59 ASN QD 1 61 GLN H . . 5.810 3.807 3.579 4.040 . 0 0 "[ . 1 . 2]" 1
1688 1 59 ASN QD 1 61 GLN HA . . 5.160 5.183 5.161 5.235 0.075 13 0 "[ . 1 . 2]" 1
1689 1 59 ASN QD 1 61 GLN QB . . 4.790 3.044 2.429 3.892 . 0 0 "[ . 1 . 2]" 1
1690 1 59 ASN QD 1 61 GLN QG . . 4.330 2.722 2.225 3.382 . 0 0 "[ . 1 . 2]" 1
1691 1 60 GLY H 1 61 GLN H . . 4.450 2.699 2.470 2.894 . 0 0 "[ . 1 . 2]" 1
1692 1 61 GLN H 1 61 GLN QB . . 3.450 2.427 2.321 2.658 . 0 0 "[ . 1 . 2]" 1
1693 1 61 GLN H 1 61 GLN HG2 . . 4.260 3.599 2.540 4.100 . 0 0 "[ . 1 . 2]" 1
1694 1 61 GLN H 1 61 GLN QG . . 3.680 2.691 2.355 3.062 . 0 0 "[ . 1 . 2]" 1
1695 1 61 GLN H 1 61 GLN HG3 . . 4.260 3.007 2.392 3.990 . 0 0 "[ . 1 . 2]" 1
1696 1 61 GLN H 1 62 PRO QD . . 5.810 4.486 4.392 4.536 . 0 0 "[ . 1 . 2]" 1
1697 1 61 GLN HA 1 61 GLN QE . . 5.810 4.430 3.477 4.964 . 0 0 "[ . 1 . 2]" 1
1698 1 61 GLN HA 1 61 GLN QG . . 3.740 2.527 2.252 3.365 . 0 0 "[ . 1 . 2]" 1
1699 1 61 GLN HA 1 62 PRO HD2 . . 3.740 2.415 2.289 2.543 . 0 0 "[ . 1 . 2]" 1
1700 1 61 GLN HA 1 62 PRO QD . . 3.220 2.165 2.121 2.227 . 0 0 "[ . 1 . 2]" 1
1701 1 61 GLN HA 1 62 PRO HD3 . . 3.740 2.451 2.367 2.546 . 0 0 "[ . 1 . 2]" 1
1702 1 61 GLN HA 1 62 PRO QG . . 4.970 4.098 4.045 4.161 . 0 0 "[ . 1 . 2]" 1
1703 1 61 GLN QB 1 61 GLN QE . . 4.010 3.142 2.062 3.716 . 0 0 "[ . 1 . 2]" 1
1704 1 61 GLN QB 1 62 PRO QD . . 3.690 2.395 2.197 2.682 . 0 0 "[ . 1 . 2]" 1
1705 1 61 GLN QE 1 61 GLN QG . . 3.090 2.285 2.170 2.725 . 0 0 "[ . 1 . 2]" 1
1706 1 61 GLN QG 1 62 PRO QD . . 4.510 3.382 3.086 4.088 . 0 0 "[ . 1 . 2]" 1
1707 1 62 PRO HA 1 63 THR H . . 3.300 2.198 2.160 2.244 . 0 0 "[ . 1 . 2]" 1
1708 1 62 PRO HA 1 63 THR HB . . 5.700 5.692 5.669 5.709 0.009 2 0 "[ . 1 . 2]" 1
1709 1 63 THR H 1 63 THR HB . . 3.580 3.591 3.585 3.597 0.017 17 0 "[ . 1 . 2]" 1
1710 1 63 THR H 1 63 THR HG1 . . 4.530 2.435 2.258 2.796 . 0 0 "[ . 1 . 2]" 1
1711 1 63 THR H 1 63 THR MG . . 3.810 2.452 2.353 2.520 . 0 0 "[ . 1 . 2]" 1
1712 1 63 THR H 1 64 GLY H . . 3.680 2.533 2.437 2.656 . 0 0 "[ . 1 . 2]" 1
1713 1 63 THR H 1 65 VAL H . . 5.100 3.792 3.651 4.094 . 0 0 "[ . 1 . 2]" 1
1714 1 63 THR HA 1 63 THR MG . . 2.930 2.335 2.300 2.356 . 0 0 "[ . 1 . 2]" 1
1715 1 63 THR HB 1 65 VAL H . . 4.200 3.216 3.053 3.445 . 0 0 "[ . 1 . 2]" 1
1716 1 63 THR HB 1 65 VAL HB . . 4.040 2.958 2.733 3.237 . 0 0 "[ . 1 . 2]" 1
1717 1 63 THR HB 1 65 VAL QG . . 3.720 2.939 2.573 3.303 . 0 0 "[ . 1 . 2]" 1
1718 1 63 THR HG1 1 65 VAL H . . 4.690 3.054 2.871 3.272 . 0 0 "[ . 1 . 2]" 1
1719 1 63 THR HG1 1 65 VAL QG . . 5.920 4.024 3.809 4.206 . 0 0 "[ . 1 . 2]" 1
1720 1 63 THR MG 1 64 GLY H . . 4.860 4.157 4.073 4.212 . 0 0 "[ . 1 . 2]" 1
1721 1 63 THR MG 1 65 VAL H . . 4.690 4.141 3.994 4.333 . 0 0 "[ . 1 . 2]" 1
1722 1 64 GLY H 1 65 VAL H . . 3.970 2.562 2.503 2.620 . 0 0 "[ . 1 . 2]" 1
1723 1 64 GLY H 1 65 VAL HB . . 5.510 4.905 4.795 5.000 . 0 0 "[ . 1 . 2]" 1
1724 1 65 VAL H 1 65 VAL HB . . 3.620 2.608 2.553 2.643 . 0 0 "[ . 1 . 2]" 1
1725 1 65 VAL H 1 65 VAL QG . . 3.850 2.928 2.835 2.984 . 0 0 "[ . 1 . 2]" 1
1726 1 65 VAL H 1 66 ALA H . . 5.590 4.412 4.381 4.441 . 0 0 "[ . 1 . 2]" 1
1727 1 65 VAL HA 1 66 ALA H . . 3.320 2.132 2.097 2.163 . 0 0 "[ . 1 . 2]" 1
1728 1 65 VAL HB 1 66 ALA H . . 4.330 4.168 4.148 4.189 . 0 0 "[ . 1 . 2]" 1
1729 1 65 VAL QG 1 66 ALA H . . 3.450 2.557 2.523 2.609 . 0 0 "[ . 1 . 2]" 1
1730 1 65 VAL QG 1 66 ALA HA . . 3.490 3.316 3.236 3.384 . 0 0 "[ . 1 . 2]" 1
1731 1 65 VAL QG 1 67 VAL H . . 5.920 4.147 4.049 4.217 . 0 0 "[ . 1 . 2]" 1
1732 1 65 VAL QG 1 67 VAL HA . . 5.920 4.328 4.253 4.402 . 0 0 "[ . 1 . 2]" 1
1733 1 65 VAL QG 1 67 VAL QG . . 4.390 2.959 2.867 3.070 . 0 0 "[ . 1 . 2]" 1
1734 1 65 VAL MG1 1 66 ALA H . . 4.020 2.604 2.566 2.658 . 0 0 "[ . 1 . 2]" 1
1735 1 65 VAL MG2 1 66 ALA H . . 4.020 3.729 3.673 3.796 . 0 0 "[ . 1 . 2]" 1
1736 1 66 ALA H 1 67 VAL H . . 5.940 4.489 4.467 4.511 . 0 0 "[ . 1 . 2]" 1
1737 1 66 ALA H 1 67 VAL QG . . 5.210 4.735 4.624 4.861 . 0 0 "[ . 1 . 2]" 1
1738 1 66 ALA H 1 68 VAL QG . . 5.920 5.415 5.255 5.566 . 0 0 "[ . 1 . 2]" 1
1739 1 66 ALA H 1 93 LEU QD . . 5.420 5.296 5.205 5.425 0.005 10 0 "[ . 1 . 2]" 1
1740 1 66 ALA HA 1 67 VAL H . . 3.350 2.250 2.222 2.277 . 0 0 "[ . 1 . 2]" 1
1741 1 66 ALA HA 1 67 VAL HB . . 5.490 4.737 4.639 4.795 . 0 0 "[ . 1 . 2]" 1
1742 1 66 ALA HA 1 67 VAL QG . . 4.490 3.903 3.791 4.005 . 0 0 "[ . 1 . 2]" 1
1743 1 66 ALA HA 1 68 VAL QG . . 5.920 4.890 4.732 5.073 . 0 0 "[ . 1 . 2]" 1
1744 1 66 ALA MB 1 67 VAL H . . 3.650 2.638 2.525 2.725 . 0 0 "[ . 1 . 2]" 1
1745 1 66 ALA MB 1 67 VAL HA . . 5.110 3.954 3.903 4.024 . 0 0 "[ . 1 . 2]" 1
1746 1 66 ALA MB 1 68 VAL QG . . 3.950 2.979 2.815 3.186 . 0 0 "[ . 1 . 2]" 1
1747 1 67 VAL H 1 67 VAL HB . . 3.820 2.750 2.722 2.793 . 0 0 "[ . 1 . 2]" 1
1748 1 67 VAL H 1 67 VAL MG1 . . 4.630 3.946 3.931 3.965 . 0 0 "[ . 1 . 2]" 1
1749 1 67 VAL H 1 67 VAL QG . . 3.720 2.965 2.939 3.021 . 0 0 "[ . 1 . 2]" 1
1750 1 67 VAL H 1 67 VAL MG2 . . 4.630 3.065 3.034 3.133 . 0 0 "[ . 1 . 2]" 1
1751 1 67 VAL H 1 68 VAL H . . 5.670 4.380 4.347 4.410 . 0 0 "[ . 1 . 2]" 1
1752 1 67 VAL H 1 68 VAL QG . . 4.810 3.908 3.796 3.979 . 0 0 "[ . 1 . 2]" 1
1753 1 67 VAL HA 1 68 VAL H . . 3.230 2.226 2.193 2.262 . 0 0 "[ . 1 . 2]" 1
1754 1 67 VAL HB 1 68 VAL H . . 5.150 3.973 3.920 4.002 . 0 0 "[ . 1 . 2]" 1
1755 1 67 VAL QG 1 68 VAL H . . 3.550 2.298 2.247 2.331 . 0 0 "[ . 1 . 2]" 1
1756 1 67 VAL QG 1 68 VAL QG . . 5.670 3.810 3.785 3.830 . 0 0 "[ . 1 . 2]" 1
1757 1 67 VAL QG 1 69 GLU H . . 5.260 4.465 4.388 4.513 . 0 0 "[ . 1 . 2]" 1
1758 1 67 VAL QG 1 69 GLU HA . . 5.070 4.466 4.334 4.548 . 0 0 "[ . 1 . 2]" 1
1759 1 67 VAL QG 1 98 ALA H . . 4.950 4.591 4.483 4.754 . 0 0 "[ . 1 . 2]" 1
1760 1 67 VAL QG 1 98 ALA MB . . 3.690 2.479 2.266 2.783 . 0 0 "[ . 1 . 2]" 1
1761 1 67 VAL MG1 1 68 VAL H . . 4.460 2.316 2.263 2.351 . 0 0 "[ . 1 . 2]" 1
1762 1 67 VAL MG1 1 98 ALA MB . . 4.420 2.654 2.429 2.990 . 0 0 "[ . 1 . 2]" 1
1763 1 67 VAL MG2 1 68 VAL H . . 4.460 3.841 3.809 3.875 . 0 0 "[ . 1 . 2]" 1
1764 1 67 VAL MG2 1 98 ALA MB . . 4.420 2.977 2.712 3.335 . 0 0 "[ . 1 . 2]" 1
1765 1 68 VAL H 1 68 VAL HB . . 3.540 2.955 2.902 3.015 . 0 0 "[ . 1 . 2]" 1
1766 1 68 VAL H 1 68 VAL QG . . 4.080 2.904 2.853 2.940 . 0 0 "[ . 1 . 2]" 1
1767 1 68 VAL HA 1 69 GLU H . . 3.400 2.398 2.355 2.438 . 0 0 "[ . 1 . 2]" 1
1768 1 68 VAL HB 1 70 TYR QD . . 5.510 3.763 3.584 3.932 . 0 0 "[ . 1 . 2]" 1
1769 1 68 VAL HB 1 70 TYR QE . . 4.270 3.352 3.278 3.417 . 0 0 "[ . 1 . 2]" 1
1770 1 68 VAL QG 1 69 GLU H . . 3.940 2.227 2.167 2.309 . 0 0 "[ . 1 . 2]" 1
1771 1 68 VAL QG 1 70 TYR H . . 5.330 4.542 4.189 4.687 . 0 0 "[ . 1 . 2]" 1
1772 1 68 VAL QG 1 70 TYR HA . . 5.920 4.269 3.944 4.514 . 0 0 "[ . 1 . 2]" 1
1773 1 68 VAL QG 1 70 TYR QD . . 4.420 2.613 2.447 2.777 . 0 0 "[ . 1 . 2]" 1
1774 1 68 VAL QG 1 70 TYR QE . . 3.990 2.204 2.116 2.490 . 0 0 "[ . 1 . 2]" 1
1775 1 68 VAL QG 1 70 TYR HH . . 5.100 3.230 3.137 3.436 . 0 0 "[ . 1 . 2]" 1
1776 1 68 VAL QG 1 79 CYS QB . . 5.140 4.359 4.313 4.439 . 0 0 "[ . 1 . 2]" 1
1777 1 68 VAL QG 1 79 CYS HG . . 5.470 4.819 4.639 5.222 . 0 0 "[ . 1 . 2]" 1
1778 1 68 VAL MG1 1 69 GLU H . . 5.120 2.238 2.176 2.322 . 0 0 "[ . 1 . 2]" 1
1779 1 68 VAL MG1 1 70 TYR QE . . 5.410 2.217 2.128 2.515 . 0 0 "[ . 1 . 2]" 1
1780 1 68 VAL MG2 1 69 GLU H . . 5.120 4.047 4.011 4.085 . 0 0 "[ . 1 . 2]" 1
1781 1 68 VAL MG2 1 70 TYR QE . . 5.410 3.905 3.766 4.022 . 0 0 "[ . 1 . 2]" 1
1782 1 69 GLU H 1 69 GLU QB . . 3.680 2.608 2.563 2.654 . 0 0 "[ . 1 . 2]" 1
1783 1 69 GLU H 1 69 GLU HG2 . . 5.340 4.658 4.629 4.693 . 0 0 "[ . 1 . 2]" 1
1784 1 69 GLU H 1 69 GLU QG . . 4.470 4.275 4.249 4.306 . 0 0 "[ . 1 . 2]" 1
1785 1 69 GLU H 1 69 GLU HG3 . . 5.340 4.977 4.936 5.009 . 0 0 "[ . 1 . 2]" 1
1786 1 69 GLU H 1 70 TYR H . . 5.730 4.315 4.202 4.383 . 0 0 "[ . 1 . 2]" 1
1787 1 69 GLU HA 1 70 TYR H . . 3.360 2.230 2.140 2.307 . 0 0 "[ . 1 . 2]" 1
1788 1 69 GLU HA 1 70 TYR QE . . 5.910 5.639 5.498 5.788 . 0 0 "[ . 1 . 2]" 1
1789 1 69 GLU QB 1 70 TYR H . . 4.310 3.737 3.621 3.854 . 0 0 "[ . 1 . 2]" 1
1790 1 69 GLU QG 1 70 TYR H . . 4.510 3.041 2.766 3.510 . 0 0 "[ . 1 . 2]" 1
1791 1 70 TYR H 1 70 TYR QB . . 3.570 2.324 2.176 2.417 . 0 0 "[ . 1 . 2]" 1
1792 1 70 TYR H 1 70 TYR QD . . 4.210 3.508 3.068 3.694 . 0 0 "[ . 1 . 2]" 1
1793 1 70 TYR H 1 70 TYR QE . . 6.000 5.628 5.273 5.789 . 0 0 "[ . 1 . 2]" 1
1794 1 70 TYR H 1 72 ASN H . . 6.000 5.512 5.355 5.680 . 0 0 "[ . 1 . 2]" 1
1795 1 70 TYR H 1 76 ALA MB . . 4.590 3.719 3.545 3.841 . 0 0 "[ . 1 . 2]" 1
1796 1 70 TYR HA 1 70 TYR QD . . 3.900 2.919 2.826 3.021 . 0 0 "[ . 1 . 2]" 1
1797 1 70 TYR HA 1 70 TYR QE . . 5.110 4.488 4.409 4.635 . 0 0 "[ . 1 . 2]" 1
1798 1 70 TYR HA 1 71 GLU QB . . 4.780 4.118 3.881 4.652 . 0 0 "[ . 1 . 2]" 1
1799 1 70 TYR HA 1 72 ASN H . . 5.140 4.366 4.158 4.473 . 0 0 "[ . 1 . 2]" 1
1800 1 70 TYR QB 1 71 GLU QB . . 5.230 4.300 3.960 4.971 . 0 0 "[ . 1 . 2]" 1
1801 1 70 TYR QB 1 72 ASN H . . 4.250 2.767 2.437 3.016 . 0 0 "[ . 1 . 2]" 1
1802 1 70 TYR QB 1 75 ASP H . . 5.510 4.231 4.021 4.325 . 0 0 "[ . 1 . 2]" 1
1803 1 70 TYR QB 1 75 ASP QB . . 4.260 2.649 2.444 2.854 . 0 0 "[ . 1 . 2]" 1
1804 1 70 TYR QB 1 76 ALA H . . 4.710 2.929 2.705 3.464 . 0 0 "[ . 1 . 2]" 1
1805 1 70 TYR QB 1 76 ALA MB . . 4.160 2.096 2.057 2.142 . 0 0 "[ . 1 . 2]" 1
1806 1 70 TYR HB2 1 76 ALA H . . 5.480 3.595 3.153 4.097 . 0 0 "[ . 1 . 2]" 1
1807 1 70 TYR HB3 1 76 ALA H . . 5.480 3.108 2.887 3.737 . 0 0 "[ . 1 . 2]" 1
1808 1 70 TYR QD 1 70 TYR HH . . 4.100 4.211 4.200 4.218 0.118 16 0 "[ . 1 . 2]" 1
1809 1 70 TYR QD 1 71 GLU H . . 4.740 2.943 2.725 3.281 . 0 0 "[ . 1 . 2]" 1
1810 1 70 TYR QD 1 71 GLU QB . . 5.810 4.077 3.609 5.330 . 0 0 "[ . 1 . 2]" 1
1811 1 70 TYR QD 1 72 ASN H . . 5.500 3.600 3.397 3.826 . 0 0 "[ . 1 . 2]" 1
1812 1 70 TYR QD 1 75 ASP QB . . 4.280 2.222 2.132 2.309 . 0 0 "[ . 1 . 2]" 1
1813 1 70 TYR QD 1 76 ALA HA . . 3.920 3.130 2.841 3.366 . 0 0 "[ . 1 . 2]" 1
1814 1 70 TYR QD 1 76 ALA MB . . 3.540 3.433 3.216 3.549 0.009 6 0 "[ . 1 . 2]" 1
1815 1 70 TYR QD 1 79 CYS QB . . 5.570 4.613 4.158 4.758 . 0 0 "[ . 1 . 2]" 1
1816 1 70 TYR QE 1 72 ASN H . . 6.000 5.815 5.604 6.014 0.014 16 0 "[ . 1 . 2]" 1
1817 1 70 TYR QE 1 75 ASP QB . . 5.740 2.754 2.567 2.905 . 0 0 "[ . 1 . 2]" 1
1818 1 70 TYR QE 1 76 ALA HA . . 4.430 4.000 3.505 4.244 . 0 0 "[ . 1 . 2]" 1
1819 1 70 TYR QE 1 79 CYS H . . 5.460 5.090 4.805 5.199 . 0 0 "[ . 1 . 2]" 1
1820 1 70 TYR QE 1 79 CYS HB2 . . 4.530 4.104 3.109 4.425 . 0 0 "[ . 1 . 2]" 1
1821 1 70 TYR QE 1 79 CYS QB . . 3.880 3.689 2.880 3.894 0.014 14 0 "[ . 1 . 2]" 1
1822 1 70 TYR QE 1 79 CYS HB3 . . 4.530 4.201 3.403 4.351 . 0 0 "[ . 1 . 2]" 1
1823 1 70 TYR QE 1 83 LEU QD . . 5.600 5.413 4.870 5.603 0.003 2 0 "[ . 1 . 2]" 1
1824 1 70 TYR HH 1 79 CYS QB . . 5.810 3.877 2.431 4.211 . 0 0 "[ . 1 . 2]" 1
1825 1 70 TYR HH 1 79 CYS HG . . 5.210 2.755 2.530 3.483 . 0 0 "[ . 1 . 2]" 1
1826 1 70 TYR HH 1 83 LEU MD1 . . 6.000 6.038 6.016 6.075 0.075 16 0 "[ . 1 . 2]" 1
1827 1 70 TYR HH 1 83 LEU QD . . 4.960 4.675 4.158 4.945 . 0 0 "[ . 1 . 2]" 1
1828 1 70 TYR HH 1 83 LEU MD2 . . 6.000 4.879 4.235 5.253 . 0 0 "[ . 1 . 2]" 1
1829 1 71 GLU H 1 71 GLU QB . . 3.340 2.298 2.094 2.869 . 0 0 "[ . 1 . 2]" 1
1830 1 71 GLU H 1 71 GLU QG . . 4.900 3.800 2.170 4.024 . 0 0 "[ . 1 . 2]" 1
1831 1 71 GLU H 1 72 ASN H . . 4.170 2.998 2.756 3.082 . 0 0 "[ . 1 . 2]" 1
1832 1 71 GLU H 1 72 ASN QD . . 4.980 4.473 4.262 4.723 . 0 0 "[ . 1 . 2]" 1
1833 1 71 GLU H 1 75 ASP QB . . 4.090 4.116 4.040 4.144 0.054 11 0 "[ . 1 . 2]" 1
1834 1 71 GLU H 1 76 ALA MB . . 5.440 5.508 5.489 5.527 0.087 7 0 "[ . 1 . 2]" 1
1835 1 71 GLU HA 1 71 GLU QG . . 3.390 2.451 2.198 3.368 . 0 0 "[ . 1 . 2]" 1
1836 1 71 GLU QB 1 71 GLU QG . . 2.340 2.115 2.017 2.130 . 0 0 "[ . 1 . 2]" 1
1837 1 71 GLU QB 1 72 ASN H . . 3.960 2.759 2.432 3.735 . 0 0 "[ . 1 . 2]" 1
1838 1 71 GLU QB 1 72 ASN HA . . 5.810 4.547 4.426 4.730 . 0 0 "[ . 1 . 2]" 1
1839 1 71 GLU QB 1 72 ASN QD . . 4.220 2.562 2.337 3.354 . 0 0 "[ . 1 . 2]" 1
1840 1 71 GLU QG 1 72 ASN HA . . 5.510 4.301 3.928 5.244 . 0 0 "[ . 1 . 2]" 1
1841 1 71 GLU QG 1 72 ASN QB . . 5.610 4.373 3.761 5.499 . 0 0 "[ . 1 . 2]" 1
1842 1 71 GLU QG 1 72 ASN QD . . 4.420 2.859 2.285 3.748 . 0 0 "[ . 1 . 2]" 1
1843 1 72 ASN H 1 72 ASN QB . . 3.680 2.781 2.668 3.031 . 0 0 "[ . 1 . 2]" 1
1844 1 72 ASN H 1 72 ASN QD . . 4.730 2.792 2.658 2.960 . 0 0 "[ . 1 . 2]" 1
1845 1 72 ASN H 1 73 LEU H . . 5.970 4.440 4.396 4.481 . 0 0 "[ . 1 . 2]" 1
1846 1 72 ASN H 1 74 VAL QG . . 4.360 4.411 4.396 4.442 0.082 5 0 "[ . 1 . 2]" 1
1847 1 72 ASN H 1 75 ASP H . . 5.670 3.822 3.756 4.013 . 0 0 "[ . 1 . 2]" 1
1848 1 72 ASN H 1 75 ASP QB . . 4.700 2.832 2.678 3.178 . 0 0 "[ . 1 . 2]" 1
1849 1 72 ASN H 1 76 ALA H . . 6.000 4.162 4.027 4.517 . 0 0 "[ . 1 . 2]" 1
1850 1 72 ASN HA 1 73 LEU H . . 3.430 2.253 2.206 2.320 . 0 0 "[ . 1 . 2]" 1
1851 1 72 ASN HA 1 73 LEU HA . . 6.000 4.374 4.321 4.422 . 0 0 "[ . 1 . 2]" 1
1852 1 72 ASN HA 1 73 LEU QB . . 4.720 4.194 3.897 4.391 . 0 0 "[ . 1 . 2]" 1
1853 1 72 ASN HA 1 74 VAL H . . 5.270 4.158 4.032 4.322 . 0 0 "[ . 1 . 2]" 1
1854 1 72 ASN QB 1 73 LEU H . . 4.420 2.850 2.682 3.138 . 0 0 "[ . 1 . 2]" 1
1855 1 72 ASN QB 1 73 LEU HA . . 5.240 4.551 4.478 4.720 . 0 0 "[ . 1 . 2]" 1
1856 1 72 ASN QB 1 74 VAL H . . 3.920 2.814 2.680 2.989 . 0 0 "[ . 1 . 2]" 1
1857 1 72 ASN QB 1 74 VAL HB . . 5.170 4.604 4.473 5.205 0.035 5 0 "[ . 1 . 2]" 1
1858 1 72 ASN QB 1 74 VAL QG . . 3.530 2.059 1.969 2.310 . 0 0 "[ . 1 . 2]" 1
1859 1 72 ASN QB 1 75 ASP H . . 4.020 2.645 2.451 3.687 . 0 0 "[ . 1 . 2]" 1
1860 1 72 ASN HB2 1 73 LEU H . . 5.230 3.720 2.765 4.005 . 0 0 "[ . 1 . 2]" 1
1861 1 72 ASN HB2 1 74 VAL MG1 . . 5.160 4.464 3.722 4.711 . 0 0 "[ . 1 . 2]" 1
1862 1 72 ASN HB2 1 74 VAL MG2 . . 5.160 2.247 2.184 2.364 . 0 0 "[ . 1 . 2]" 1
1863 1 72 ASN HB3 1 73 LEU H . . 5.230 3.005 2.773 3.880 . 0 0 "[ . 1 . 2]" 1
1864 1 72 ASN HB3 1 74 VAL MG1 . . 5.160 4.230 4.039 5.192 0.032 5 0 "[ . 1 . 2]" 1
1865 1 72 ASN HB3 1 74 VAL MG2 . . 5.160 2.461 2.169 3.644 . 0 0 "[ . 1 . 2]" 1
1866 1 72 ASN QD 1 73 LEU H . . 5.810 5.350 5.220 5.542 . 0 0 "[ . 1 . 2]" 1
1867 1 72 ASN QD 1 74 VAL QG . . 5.100 3.362 3.120 3.552 . 0 0 "[ . 1 . 2]" 1
1868 1 72 ASN QD 1 76 ALA H . . 5.430 5.484 5.436 5.518 0.088 18 0 "[ . 1 . 2]" 1
1869 1 73 LEU H 1 73 LEU QB . . 3.260 2.125 1.994 2.266 . 0 0 "[ . 1 . 2]" 1
1870 1 73 LEU H 1 73 LEU MD1 . . 4.830 2.757 2.241 3.920 . 0 0 "[ . 1 . 2]" 1
1871 1 73 LEU H 1 73 LEU QD . . 4.090 2.682 2.227 3.671 . 0 0 "[ . 1 . 2]" 1
1872 1 73 LEU H 1 73 LEU MD2 . . 4.830 4.028 3.787 4.427 . 0 0 "[ . 1 . 2]" 1
1873 1 73 LEU H 1 74 VAL H . . 4.450 2.791 2.660 2.884 . 0 0 "[ . 1 . 2]" 1
1874 1 73 LEU H 1 74 VAL MG1 . . 5.100 4.558 4.104 4.692 . 0 0 "[ . 1 . 2]" 1
1875 1 73 LEU H 1 74 VAL MG2 . . 5.100 3.911 3.758 4.011 . 0 0 "[ . 1 . 2]" 1
1876 1 73 LEU H 1 75 ASP H . . 6.000 4.365 4.224 4.657 . 0 0 "[ . 1 . 2]" 1
1877 1 73 LEU H 1 76 ALA H . . 6.000 4.914 4.830 5.016 . 0 0 "[ . 1 . 2]" 1
1878 1 73 LEU HA 1 73 LEU MD1 . . 3.720 2.778 2.239 3.668 . 0 0 "[ . 1 . 2]" 1
1879 1 73 LEU HA 1 73 LEU MD2 . . 3.720 3.432 2.383 3.741 0.021 3 0 "[ . 1 . 2]" 1
1880 1 73 LEU HA 1 73 LEU HG . . 3.690 2.308 2.184 2.409 . 0 0 "[ . 1 . 2]" 1
1881 1 73 LEU HA 1 75 ASP H . . 5.480 4.043 3.762 4.443 . 0 0 "[ . 1 . 2]" 1
1882 1 73 LEU HA 1 76 ALA H . . 4.480 3.197 3.002 3.380 . 0 0 "[ . 1 . 2]" 1
1883 1 73 LEU HA 1 76 ALA MB . . 3.690 2.233 2.145 2.348 . 0 0 "[ . 1 . 2]" 1
1884 1 73 LEU QB 1 73 LEU QD . . 2.640 1.948 1.922 1.980 . 0 0 "[ . 1 . 2]" 1
1885 1 73 LEU QB 1 74 VAL H . . 3.820 3.032 2.853 3.203 . 0 0 "[ . 1 . 2]" 1
1886 1 73 LEU QD 1 74 VAL H . . 5.730 4.178 4.079 4.267 . 0 0 "[ . 1 . 2]" 1
1887 1 73 LEU QD 1 76 ALA H . . 4.910 4.662 4.185 4.935 0.025 17 0 "[ . 1 . 2]" 1
1888 1 73 LEU QD 1 76 ALA MB . . 3.850 3.253 2.419 3.672 . 0 0 "[ . 1 . 2]" 1
1889 1 73 LEU QD 1 77 ASP H . . 5.090 4.611 3.166 5.113 0.023 9 0 "[ . 1 . 2]" 1
1890 1 73 LEU MD1 1 77 ASP H . . 5.790 5.672 5.419 5.882 0.092 14 0 "[ . 1 . 2]" 1
1891 1 73 LEU MD2 1 77 ASP H . . 5.790 5.153 3.180 5.839 0.049 12 0 "[ . 1 . 2]" 1
1892 1 73 LEU HG 1 77 ASP H . . 5.090 5.075 4.868 5.165 0.075 7 0 "[ . 1 . 2]" 1
1893 1 74 VAL H 1 74 VAL HB . . 3.760 3.700 3.681 3.719 . 0 0 "[ . 1 . 2]" 1
1894 1 74 VAL H 1 74 VAL MG1 . . 3.350 2.430 2.347 2.486 . 0 0 "[ . 1 . 2]" 1
1895 1 74 VAL H 1 74 VAL MG2 . . 3.350 2.077 2.030 2.144 . 0 0 "[ . 1 . 2]" 1
1896 1 74 VAL H 1 75 ASP H . . 4.050 2.843 2.789 2.935 . 0 0 "[ . 1 . 2]" 1
1897 1 74 VAL H 1 76 ALA H . . 5.500 4.294 3.945 4.450 . 0 0 "[ . 1 . 2]" 1
1898 1 74 VAL H 1 77 ASP QB . . 5.230 4.834 4.716 4.960 . 0 0 "[ . 1 . 2]" 1
1899 1 74 VAL HA 1 74 VAL MG1 . . 3.730 2.237 2.221 2.256 . 0 0 "[ . 1 . 2]" 1
1900 1 74 VAL HA 1 74 VAL MG2 . . 3.730 3.277 3.272 3.283 . 0 0 "[ . 1 . 2]" 1
1901 1 74 VAL HA 1 75 ASP HA . . 6.000 4.751 4.724 4.796 . 0 0 "[ . 1 . 2]" 1
1902 1 74 VAL HA 1 76 ALA H . . 5.260 4.638 4.260 4.803 . 0 0 "[ . 1 . 2]" 1
1903 1 74 VAL HA 1 77 ASP H . . 4.130 3.671 3.497 3.816 . 0 0 "[ . 1 . 2]" 1
1904 1 74 VAL HA 1 77 ASP QB . . 3.950 2.750 2.607 2.939 . 0 0 "[ . 1 . 2]" 1
1905 1 74 VAL HA 1 78 PHE H . . 4.990 4.050 3.973 4.118 . 0 0 "[ . 1 . 2]" 1
1906 1 74 VAL HB 1 77 ASP H . . 6.000 5.669 5.575 5.766 . 0 0 "[ . 1 . 2]" 1
1907 1 74 VAL HB 1 78 PHE H . . 6.000 5.003 4.957 5.042 . 0 0 "[ . 1 . 2]" 1
1908 1 74 VAL HB 1 78 PHE QD . . 4.110 3.991 3.478 4.135 0.025 20 0 "[ . 1 . 2]" 1
1909 1 74 VAL QG 1 75 ASP H . . 3.380 2.288 2.197 2.371 . 0 0 "[ . 1 . 2]" 1
1910 1 74 VAL QG 1 76 ALA H . . 5.920 4.256 4.147 4.333 . 0 0 "[ . 1 . 2]" 1
1911 1 74 VAL QG 1 77 ASP H . . 5.380 4.731 4.670 4.797 . 0 0 "[ . 1 . 2]" 1
1912 1 74 VAL QG 1 77 ASP QB . . 4.600 3.985 3.893 4.154 . 0 0 "[ . 1 . 2]" 1
1913 1 74 VAL QG 1 78 PHE H . . 4.830 4.807 4.768 4.839 0.009 6 0 "[ . 1 . 2]" 1
1914 1 74 VAL QG 1 78 PHE QB . . 4.520 4.521 4.456 4.539 0.019 8 0 "[ . 1 . 2]" 1
1915 1 74 VAL QG 1 78 PHE QD . . 4.560 4.373 4.078 4.538 . 0 0 "[ . 1 . 2]" 1
1916 1 74 VAL MG1 1 78 PHE H . . 5.480 5.501 5.488 5.509 0.029 5 0 "[ . 1 . 2]" 1
1917 1 74 VAL MG1 1 78 PHE QD . . 6.000 4.797 4.587 5.128 . 0 0 "[ . 1 . 2]" 1
1918 1 74 VAL MG2 1 78 PHE H . . 5.480 5.303 5.230 5.365 . 0 0 "[ . 1 . 2]" 1
1919 1 74 VAL MG2 1 78 PHE QD . . 6.000 5.051 4.568 5.211 . 0 0 "[ . 1 . 2]" 1
1920 1 75 ASP H 1 75 ASP HB2 . . 3.940 2.494 2.456 2.533 . 0 0 "[ . 1 . 2]" 1
1921 1 75 ASP H 1 75 ASP QB . . 3.250 2.453 2.418 2.488 . 0 0 "[ . 1 . 2]" 1
1922 1 75 ASP H 1 75 ASP HB3 . . 3.940 3.633 3.603 3.653 . 0 0 "[ . 1 . 2]" 1
1923 1 75 ASP H 1 76 ALA H . . 5.120 2.440 2.369 2.597 . 0 0 "[ . 1 . 2]" 1
1924 1 75 ASP H 1 77 ASP H . . 4.780 4.166 4.037 4.482 . 0 0 "[ . 1 . 2]" 1
1925 1 75 ASP H 1 78 PHE H . . 6.000 4.604 4.465 4.779 . 0 0 "[ . 1 . 2]" 1
1926 1 75 ASP HA 1 77 ASP H . . 5.250 4.695 4.583 4.817 . 0 0 "[ . 1 . 2]" 1
1927 1 75 ASP HA 1 78 PHE H . . 4.390 3.317 3.082 3.511 . 0 0 "[ . 1 . 2]" 1
1928 1 75 ASP HA 1 78 PHE QB . . 4.410 2.349 2.119 2.625 . 0 0 "[ . 1 . 2]" 1
1929 1 75 ASP HA 1 78 PHE QD . . 5.200 4.200 3.738 4.498 . 0 0 "[ . 1 . 2]" 1
1930 1 75 ASP HA 1 79 CYS H . . 5.980 4.432 4.274 4.673 . 0 0 "[ . 1 . 2]" 1
1931 1 75 ASP QB 1 76 ALA H . . 4.210 2.623 2.512 2.901 . 0 0 "[ . 1 . 2]" 1
1932 1 75 ASP HB2 1 76 ALA H . . 4.860 2.683 2.562 2.986 . 0 0 "[ . 1 . 2]" 1
1933 1 75 ASP HB3 1 76 ALA H . . 4.860 3.702 3.608 3.936 . 0 0 "[ . 1 . 2]" 1
1934 1 76 ALA H 1 76 ALA MB . . 3.490 2.181 2.131 2.223 . 0 0 "[ . 1 . 2]" 1
1935 1 76 ALA H 1 77 ASP H . . 3.980 2.919 2.576 3.039 . 0 0 "[ . 1 . 2]" 1
1936 1 76 ALA H 1 78 PHE H . . 5.810 4.176 3.806 4.365 . 0 0 "[ . 1 . 2]" 1
1937 1 76 ALA H 1 79 CYS H . . 6.000 5.070 4.891 5.234 . 0 0 "[ . 1 . 2]" 1
1938 1 76 ALA HA 1 78 PHE H . . 6.000 4.515 4.428 4.705 . 0 0 "[ . 1 . 2]" 1
1939 1 76 ALA MB 1 77 ASP H . . 3.550 2.365 2.275 2.527 . 0 0 "[ . 1 . 2]" 1
1940 1 76 ALA MB 1 78 PHE H . . 5.750 4.522 4.432 4.632 . 0 0 "[ . 1 . 2]" 1
1941 1 76 ALA MB 1 97 TYR QD . . 6.000 4.167 3.910 4.386 . 0 0 "[ . 1 . 2]" 1
1942 1 76 ALA MB 1 97 TYR HE1 . . 4.620 2.553 2.259 4.335 . 0 0 "[ . 1 . 2]" 1
1943 1 76 ALA MB 1 97 TYR HE2 . . 4.300 4.281 2.634 4.409 0.109 1 0 "[ . 1 . 2]" 1
1944 1 77 ASP H 1 77 ASP QB . . 3.600 2.197 2.173 2.250 . 0 0 "[ . 1 . 2]" 1
1945 1 77 ASP H 1 78 PHE H . . 4.430 2.896 2.809 2.973 . 0 0 "[ . 1 . 2]" 1
1946 1 77 ASP H 1 78 PHE QB . . 5.810 4.575 4.452 4.670 . 0 0 "[ . 1 . 2]" 1
1947 1 77 ASP H 1 79 CYS H . . 6.000 4.526 4.334 4.667 . 0 0 "[ . 1 . 2]" 1
1948 1 77 ASP H 1 80 ILE MD . . 6.000 4.414 4.133 5.109 . 0 0 "[ . 1 . 2]" 1
1949 1 77 ASP H 1 81 GLN QE . . 5.580 5.622 5.597 5.635 0.055 18 0 "[ . 1 . 2]" 1
1950 1 77 ASP H 1 97 TYR HE1 . . 6.000 4.922 4.525 5.184 . 0 0 "[ . 1 . 2]" 1
1951 1 77 ASP HA 1 80 ILE HB . . 4.720 2.993 2.701 3.566 . 0 0 "[ . 1 . 2]" 1
1952 1 77 ASP HA 1 80 ILE MD . . 4.720 2.616 2.335 3.228 . 0 0 "[ . 1 . 2]" 1
1953 1 77 ASP HA 1 80 ILE MG . . 5.480 4.365 4.107 4.946 . 0 0 "[ . 1 . 2]" 1
1954 1 77 ASP HA 1 97 TYR HE1 . . 5.810 5.291 2.930 5.749 . 0 0 "[ . 1 . 2]" 1
1955 1 77 ASP HA 1 97 TYR HE2 . . 5.580 2.972 2.409 5.772 0.192 14 0 "[ . 1 . 2]" 1
1956 1 77 ASP QB 1 78 PHE H . . 4.220 2.609 2.423 2.772 . 0 0 "[ . 1 . 2]" 1
1957 1 77 ASP QB 1 80 ILE H . . 5.730 5.155 5.029 5.313 . 0 0 "[ . 1 . 2]" 1
1958 1 78 PHE H 1 78 PHE HB2 . . 3.690 2.104 2.085 2.140 . 0 0 "[ . 1 . 2]" 1
1959 1 78 PHE H 1 78 PHE QB . . 3.190 2.080 2.058 2.116 . 0 0 "[ . 1 . 2]" 1
1960 1 78 PHE H 1 78 PHE HB3 . . 3.690 3.273 3.020 3.365 . 0 0 "[ . 1 . 2]" 1
1961 1 78 PHE H 1 78 PHE QD . . 5.520 3.215 2.835 3.741 . 0 0 "[ . 1 . 2]" 1
1962 1 78 PHE H 1 79 CYS H . . 4.110 2.962 2.864 3.028 . 0 0 "[ . 1 . 2]" 1
1963 1 78 PHE H 1 79 CYS QB . . 5.760 4.918 4.602 5.034 . 0 0 "[ . 1 . 2]" 1
1964 1 78 PHE H 1 80 ILE H . . 5.520 4.474 4.323 4.671 . 0 0 "[ . 1 . 2]" 1
1965 1 78 PHE H 1 80 ILE MD . . 6.000 5.375 4.737 5.963 . 0 0 "[ . 1 . 2]" 1
1966 1 78 PHE H 1 81 GLN QB . . 5.810 5.111 4.218 5.368 . 0 0 "[ . 1 . 2]" 1
1967 1 78 PHE HA 1 78 PHE QD . . 3.760 2.851 2.695 3.049 . 0 0 "[ . 1 . 2]" 1
1968 1 78 PHE HA 1 81 GLN QB . . 3.740 2.592 2.095 2.904 . 0 0 "[ . 1 . 2]" 1
1969 1 78 PHE HA 1 81 GLN QG . . 4.050 2.416 2.216 3.671 . 0 0 "[ . 1 . 2]" 1
1970 1 78 PHE QB 1 79 CYS H . . 4.260 2.940 2.631 3.091 . 0 0 "[ . 1 . 2]" 1
1971 1 78 PHE QB 1 82 LYS H . . 5.810 4.929 4.682 5.406 . 0 0 "[ . 1 . 2]" 1
1972 1 78 PHE QD 1 79 CYS HA . . 5.400 5.117 4.224 5.410 0.010 5 0 "[ . 1 . 2]" 1
1973 1 78 PHE QD 1 81 GLN QB . . 4.040 4.052 3.858 4.083 0.043 18 0 "[ . 1 . 2]" 1
1974 1 78 PHE QD 1 81 GLN QG . . 4.220 3.888 3.550 4.280 0.060 20 0 "[ . 1 . 2]" 1
1975 1 78 PHE QD 1 82 LYS QB . . 4.210 4.171 3.881 4.301 0.091 20 0 "[ . 1 . 2]" 1
1976 1 78 PHE QD 1 82 LYS HD2 . . 4.440 3.043 2.499 3.880 . 0 0 "[ . 1 . 2]" 1
1977 1 78 PHE QD 1 82 LYS QD . . 3.620 2.314 2.169 2.522 . 0 0 "[ . 1 . 2]" 1
1978 1 78 PHE QD 1 82 LYS HD3 . . 4.440 2.761 2.224 4.099 . 0 0 "[ . 1 . 2]" 1
1979 1 78 PHE QD 1 82 LYS QE . . 4.760 3.166 2.353 4.273 . 0 0 "[ . 1 . 2]" 1
1980 1 78 PHE QD 1 82 LYS HG2 . . 5.270 4.594 2.502 5.049 . 0 0 "[ . 1 . 2]" 1
1981 1 78 PHE QD 1 82 LYS HG3 . . 5.270 4.208 3.067 5.291 0.021 2 0 "[ . 1 . 2]" 1
1982 1 78 PHE QD 1 83 LEU QD . . 5.920 5.248 4.582 5.493 . 0 0 "[ . 1 . 2]" 1
1983 1 78 PHE QE 1 82 LYS QG . . 5.050 4.233 3.355 4.687 . 0 0 "[ . 1 . 2]" 1
1984 1 79 CYS H 1 79 CYS HB2 . . 3.770 2.481 2.261 2.608 . 0 0 "[ . 1 . 2]" 1
1985 1 79 CYS H 1 79 CYS HB3 . . 3.770 3.468 2.527 3.614 . 0 0 "[ . 1 . 2]" 1
1986 1 79 CYS H 1 79 CYS HG . . 4.690 3.611 3.331 4.632 . 0 0 "[ . 1 . 2]" 1
1987 1 79 CYS H 1 80 ILE H . . 4.110 2.739 2.665 2.861 . 0 0 "[ . 1 . 2]" 1
1988 1 79 CYS H 1 80 ILE HB . . 5.250 4.908 4.691 5.227 . 0 0 "[ . 1 . 2]" 1
1989 1 79 CYS H 1 81 GLN QB . . 5.180 5.085 4.256 5.188 0.008 16 0 "[ . 1 . 2]" 1
1990 1 79 CYS HA 1 79 CYS HG . . 3.630 2.364 2.072 2.460 . 0 0 "[ . 1 . 2]" 1
1991 1 79 CYS HA 1 82 LYS QD . . 4.400 4.377 4.079 4.513 0.113 20 0 "[ . 1 . 2]" 1
1992 1 79 CYS HA 1 83 LEU QD . . 5.150 2.188 2.057 2.346 . 0 0 "[ . 1 . 2]" 1
1993 1 79 CYS HA 1 83 LEU HG . . 5.190 3.901 3.628 4.734 . 0 0 "[ . 1 . 2]" 1
1994 1 79 CYS QB 1 80 ILE H . . 3.540 2.465 2.318 2.653 . 0 0 "[ . 1 . 2]" 1
1995 1 79 CYS QB 1 81 GLN H . . 5.170 4.538 4.416 4.631 . 0 0 "[ . 1 . 2]" 1
1996 1 79 CYS QB 1 83 LEU QB . . 4.530 3.643 3.414 4.503 . 0 0 "[ . 1 . 2]" 1
1997 1 79 CYS QB 1 83 LEU QD . . 5.130 3.237 2.130 3.747 . 0 0 "[ . 1 . 2]" 1
1998 1 79 CYS QB 1 95 ILE MG . . 3.840 3.119 2.930 3.708 . 0 0 "[ . 1 . 2]" 1
1999 1 79 CYS HG 1 83 LEU QD . . 4.290 2.984 2.129 3.439 . 0 0 "[ . 1 . 2]" 1
2000 1 80 ILE H 1 80 ILE HB . . 3.590 2.443 2.354 2.659 . 0 0 "[ . 1 . 2]" 1
2001 1 80 ILE H 1 80 ILE MD . . 4.510 3.178 1.931 3.537 . 0 0 "[ . 1 . 2]" 1
2002 1 80 ILE H 1 80 ILE HG12 . . 4.090 3.569 3.093 3.863 . 0 0 "[ . 1 . 2]" 1
2003 1 80 ILE H 1 80 ILE QG . . 3.400 2.196 1.915 3.125 . 0 0 "[ . 1 . 2]" 1
2004 1 80 ILE H 1 80 ILE HG13 . . 4.090 2.222 1.934 3.302 . 0 0 "[ . 1 . 2]" 1
2005 1 80 ILE H 1 80 ILE MG . . 3.710 3.744 3.735 3.776 0.066 5 0 "[ . 1 . 2]" 1
2006 1 80 ILE H 1 95 ILE MG . . 4.000 3.995 3.903 4.016 0.016 13 0 "[ . 1 . 2]" 1
2007 1 80 ILE HA 1 80 ILE MD . . 4.650 3.895 3.363 3.955 . 0 0 "[ . 1 . 2]" 1
2008 1 80 ILE HA 1 80 ILE HG12 . . 4.080 2.784 2.640 3.774 . 0 0 "[ . 1 . 2]" 1
2009 1 80 ILE HA 1 80 ILE HG13 . . 4.080 2.901 2.652 3.254 . 0 0 "[ . 1 . 2]" 1
2010 1 80 ILE HA 1 80 ILE MG . . 3.510 2.388 2.227 2.479 . 0 0 "[ . 1 . 2]" 1
2011 1 80 ILE HA 1 83 LEU QB . . 5.590 3.861 3.521 4.252 . 0 0 "[ . 1 . 2]" 1
2012 1 80 ILE HA 1 84 ASN H . . 4.580 3.924 3.666 4.120 . 0 0 "[ . 1 . 2]" 1
2013 1 80 ILE HA 1 95 ILE HB . . 4.360 2.991 2.721 3.575 . 0 0 "[ . 1 . 2]" 1
2014 1 80 ILE HA 1 95 ILE MG . . 3.590 2.630 2.380 2.773 . 0 0 "[ . 1 . 2]" 1
2015 1 80 ILE HB 1 81 GLN H . . 3.600 3.136 2.925 3.216 . 0 0 "[ . 1 . 2]" 1
2016 1 80 ILE HB 1 81 GLN HA . . 5.320 4.859 4.604 4.969 . 0 0 "[ . 1 . 2]" 1
2017 1 80 ILE HB 1 82 LYS H . . 5.660 5.546 5.375 5.662 0.002 10 0 "[ . 1 . 2]" 1
2018 1 80 ILE MD 1 80 ILE MG . . 3.360 2.180 2.061 3.203 . 0 0 "[ . 1 . 2]" 1
2019 1 80 ILE MD 1 81 GLN H . . 5.150 4.757 3.935 4.917 . 0 0 "[ . 1 . 2]" 1
2020 1 80 ILE MD 1 95 ILE HB . . 6.000 5.250 4.721 5.754 . 0 0 "[ . 1 . 2]" 1
2021 1 80 ILE MD 1 95 ILE MG . . 4.210 3.558 3.298 3.694 . 0 0 "[ . 1 . 2]" 1
2022 1 80 ILE MD 1 96 SER H . . 5.850 4.250 3.973 4.635 . 0 0 "[ . 1 . 2]" 1
2023 1 80 ILE MD 1 96 SER HA . . 4.050 3.094 2.607 4.076 0.026 5 0 "[ . 1 . 2]" 1
2024 1 80 ILE MD 1 96 SER QB . . 5.810 4.296 3.952 5.308 . 0 0 "[ . 1 . 2]" 1
2025 1 80 ILE MD 1 97 TYR H . . 4.320 3.130 2.795 4.172 . 0 0 "[ . 1 . 2]" 1
2026 1 80 ILE MD 1 97 TYR HA . . 4.520 2.664 2.334 3.003 . 0 0 "[ . 1 . 2]" 1
2027 1 80 ILE MD 1 97 TYR QB . . 5.400 3.395 3.082 4.042 . 0 0 "[ . 1 . 2]" 1
2028 1 80 ILE MD 1 97 TYR QD . . 6.000 2.436 2.241 3.011 . 0 0 "[ . 1 . 2]" 1
2029 1 80 ILE MD 1 97 TYR HE1 . . 4.560 3.915 2.326 4.417 . 0 0 "[ . 1 . 2]" 1
2030 1 80 ILE MD 1 97 TYR HE2 . . 4.200 2.690 2.357 4.301 0.101 14 0 "[ . 1 . 2]" 1
2031 1 80 ILE MD 1 98 ALA H . . 6.000 4.387 3.943 4.721 . 0 0 "[ . 1 . 2]" 1
2032 1 80 ILE QG 1 80 ILE MG . . 3.180 2.222 1.959 2.343 . 0 0 "[ . 1 . 2]" 1
2033 1 80 ILE QG 1 96 SER H . . 4.810 3.430 3.190 3.835 . 0 0 "[ . 1 . 2]" 1
2034 1 80 ILE QG 1 96 SER HA . . 4.920 2.886 2.483 3.760 . 0 0 "[ . 1 . 2]" 1
2035 1 80 ILE HG12 1 96 SER H . . 5.530 3.552 3.254 4.582 . 0 0 "[ . 1 . 2]" 1
2036 1 80 ILE HG13 1 96 SER H . . 5.530 4.870 3.565 5.544 0.014 2 0 "[ . 1 . 2]" 1
2037 1 80 ILE MG 1 81 GLN H . . 3.890 3.856 3.748 3.918 0.028 2 0 "[ . 1 . 2]" 1
2038 1 80 ILE MG 1 81 GLN HA . . 5.100 4.113 3.963 4.205 . 0 0 "[ . 1 . 2]" 1
2039 1 80 ILE MG 1 84 ASN QB . . 3.500 3.230 2.789 3.504 0.004 9 0 "[ . 1 . 2]" 1
2040 1 80 ILE MG 1 84 ASN QD . . 4.750 3.567 3.036 3.928 . 0 0 "[ . 1 . 2]" 1
2041 1 80 ILE MG 1 96 SER H . . 5.510 4.182 4.054 4.387 . 0 0 "[ . 1 . 2]" 1
2042 1 80 ILE MG 1 96 SER HA . . 4.870 2.476 2.244 2.970 . 0 0 "[ . 1 . 2]" 1
2043 1 80 ILE MG 1 97 TYR H . . 5.790 3.870 3.540 4.375 . 0 0 "[ . 1 . 2]" 1
2044 1 80 ILE MG 1 97 TYR QB . . 5.810 4.695 4.149 5.177 . 0 0 "[ . 1 . 2]" 1
2045 1 81 GLN H 1 81 GLN QB . . 3.260 2.553 2.015 2.667 . 0 0 "[ . 1 . 2]" 1
2046 1 81 GLN H 1 81 GLN HG2 . . 4.650 2.676 2.361 4.233 . 0 0 "[ . 1 . 2]" 1
2047 1 81 GLN H 1 81 GLN QG . . 3.780 2.578 2.322 3.830 0.050 14 0 "[ . 1 . 2]" 1
2048 1 81 GLN H 1 81 GLN HG3 . . 4.650 3.895 2.369 4.372 . 0 0 "[ . 1 . 2]" 1
2049 1 81 GLN H 1 82 LYS H . . 3.860 2.687 2.611 2.811 . 0 0 "[ . 1 . 2]" 1
2050 1 81 GLN H 1 84 ASN QB . . 5.170 5.169 4.945 5.201 0.031 11 0 "[ . 1 . 2]" 1
2051 1 81 GLN HA 1 83 LEU H . . 5.920 5.175 5.067 5.491 . 0 0 "[ . 1 . 2]" 1
2052 1 81 GLN HA 1 84 ASN H . . 5.870 4.937 4.782 5.155 . 0 0 "[ . 1 . 2]" 1
2053 1 81 GLN HA 1 84 ASN QB . . 5.310 4.374 4.119 4.748 . 0 0 "[ . 1 . 2]" 1
2054 1 81 GLN QB 1 82 LYS H . . 3.570 2.593 2.400 2.789 . 0 0 "[ . 1 . 2]" 1
2055 1 81 GLN QB 1 82 LYS QG . . 5.140 3.246 2.602 4.407 . 0 0 "[ . 1 . 2]" 1
2056 1 81 GLN QB 1 83 LEU H . . 5.180 4.939 4.807 5.179 . 0 0 "[ . 1 . 2]" 1
2057 1 81 GLN QG 1 82 LYS H . . 5.630 4.090 3.442 4.272 . 0 0 "[ . 1 . 2]" 1
2058 1 82 LYS H 1 82 LYS HB2 . . 3.740 2.270 2.194 2.898 . 0 0 "[ . 1 . 2]" 1
2059 1 82 LYS H 1 82 LYS HB3 . . 3.740 3.536 3.451 3.721 . 0 0 "[ . 1 . 2]" 1
2060 1 82 LYS H 1 82 LYS QD . . 3.640 3.302 2.463 3.686 0.046 18 0 "[ . 1 . 2]" 1
2061 1 82 LYS H 1 82 LYS HG2 . . 5.000 4.005 2.422 4.416 . 0 0 "[ . 1 . 2]" 1
2062 1 82 LYS H 1 82 LYS HG3 . . 5.000 3.217 2.596 4.248 . 0 0 "[ . 1 . 2]" 1
2063 1 82 LYS H 1 83 LEU QB . . 5.230 4.567 4.375 4.868 . 0 0 "[ . 1 . 2]" 1
2064 1 82 LYS H 1 83 LEU MD1 . . 6.000 5.737 4.904 5.950 . 0 0 "[ . 1 . 2]" 1
2065 1 82 LYS H 1 83 LEU MD2 . . 6.000 3.373 3.220 3.592 . 0 0 "[ . 1 . 2]" 1
2066 1 82 LYS H 1 84 ASN H . . 5.840 4.323 4.117 4.456 . 0 0 "[ . 1 . 2]" 1
2067 1 82 LYS HA 1 82 LYS HD2 . . 4.310 3.848 2.676 4.356 0.046 17 0 "[ . 1 . 2]" 1
2068 1 82 LYS HA 1 82 LYS QD . . 3.640 3.468 2.634 3.822 0.182 1 0 "[ . 1 . 2]" 1
2069 1 82 LYS HA 1 82 LYS HD3 . . 4.310 4.156 3.921 4.339 0.029 2 0 "[ . 1 . 2]" 1
2070 1 82 LYS HA 1 83 LEU QD . . 5.870 3.948 3.845 4.004 . 0 0 "[ . 1 . 2]" 1
2071 1 82 LYS HA 1 84 ASN H . . 5.980 4.437 4.343 4.589 . 0 0 "[ . 1 . 2]" 1
2072 1 82 LYS QB 1 82 LYS QD . . 3.060 2.247 2.023 2.958 . 0 0 "[ . 1 . 2]" 1
2073 1 82 LYS QB 1 82 LYS QE . . 4.210 3.124 2.180 3.872 . 0 0 "[ . 1 . 2]" 1
2074 1 82 LYS QB 1 84 ASN H . . 5.810 4.799 4.648 4.875 . 0 0 "[ . 1 . 2]" 1
2075 1 82 LYS HB2 1 83 LEU H . . 4.230 2.986 2.555 3.090 . 0 0 "[ . 1 . 2]" 1
2076 1 82 LYS HB3 1 83 LEU H . . 4.230 3.514 3.030 3.821 . 0 0 "[ . 1 . 2]" 1
2077 1 82 LYS QD 1 83 LEU H . . 5.760 4.861 4.412 5.160 . 0 0 "[ . 1 . 2]" 1
2078 1 82 LYS QD 1 83 LEU QD . . 4.420 3.794 3.396 4.289 . 0 0 "[ . 1 . 2]" 1
2079 1 82 LYS QE 1 83 LEU QD . . 5.300 4.487 3.211 5.344 0.044 11 0 "[ . 1 . 2]" 1
2080 1 82 LYS QG 1 83 LEU H . . 5.650 4.434 3.769 4.668 . 0 0 "[ . 1 . 2]" 1
2081 1 82 LYS QG 1 83 LEU HA . . 5.810 5.554 5.256 5.710 . 0 0 "[ . 1 . 2]" 1
2082 1 82 LYS QG 1 83 LEU QD . . 4.210 3.774 2.982 4.031 . 0 0 "[ . 1 . 2]" 1
2083 1 83 LEU H 1 83 LEU HB2 . . 3.760 2.318 2.250 2.493 . 0 0 "[ . 1 . 2]" 1
2084 1 83 LEU H 1 83 LEU HB3 . . 3.760 3.553 3.516 3.573 . 0 0 "[ . 1 . 2]" 1
2085 1 83 LEU H 1 83 LEU MD1 . . 4.880 3.939 3.141 4.082 . 0 0 "[ . 1 . 2]" 1
2086 1 83 LEU H 1 83 LEU MD2 . . 4.880 2.208 1.932 2.308 . 0 0 "[ . 1 . 2]" 1
2087 1 83 LEU H 1 83 LEU HG . . 3.760 3.805 3.780 3.884 0.124 20 0 "[ . 1 . 2]" 1
2088 1 83 LEU H 1 84 ASN H . . 3.760 2.664 2.577 2.772 . 0 0 "[ . 1 . 2]" 1
2089 1 83 LEU H 1 85 ASN QD . . 5.810 5.234 4.938 5.708 . 0 0 "[ . 1 . 2]" 1
2090 1 83 LEU H 1 95 ILE MD . . 4.930 4.787 4.691 4.943 0.013 16 0 "[ . 1 . 2]" 1
2091 1 83 LEU HA 1 83 LEU QD . . 3.380 2.164 2.109 2.233 . 0 0 "[ . 1 . 2]" 1
2092 1 83 LEU HA 1 83 LEU HG . . 3.640 3.724 3.689 3.740 0.100 3 0 "[ . 1 . 2]" 1
2093 1 83 LEU HA 1 86 TYR H . . 4.320 3.523 3.148 3.831 . 0 0 "[ . 1 . 2]" 1
2094 1 83 LEU HA 1 86 TYR QB . . 3.670 2.176 2.014 2.285 . 0 0 "[ . 1 . 2]" 1
2095 1 83 LEU HA 1 86 TYR QD . . 4.680 4.020 3.688 4.179 . 0 0 "[ . 1 . 2]" 1
2096 1 83 LEU QB 1 83 LEU QD . . 2.790 2.075 2.066 2.101 . 0 0 "[ . 1 . 2]" 1
2097 1 83 LEU QB 1 83 LEU HG . . 2.640 2.109 2.096 2.122 . 0 0 "[ . 1 . 2]" 1
2098 1 83 LEU QB 1 85 ASN QD . . 5.610 5.578 5.330 5.640 0.030 20 0 "[ . 1 . 2]" 1
2099 1 83 LEU QB 1 86 TYR H . . 5.080 4.125 3.906 4.350 . 0 0 "[ . 1 . 2]" 1
2100 1 83 LEU QB 1 86 TYR QB . . 4.820 3.004 2.656 3.150 . 0 0 "[ . 1 . 2]" 1
2101 1 83 LEU QB 1 86 TYR QD . . 5.300 4.109 3.868 4.283 . 0 0 "[ . 1 . 2]" 1
2102 1 83 LEU QB 1 95 ILE MD . . 3.320 2.181 2.091 2.418 . 0 0 "[ . 1 . 2]" 1
2103 1 83 LEU HB2 1 84 ASN H . . 5.170 3.472 3.378 3.542 . 0 0 "[ . 1 . 2]" 1
2104 1 83 LEU HB2 1 95 ILE MD . . 3.800 2.884 2.804 2.981 . 0 0 "[ . 1 . 2]" 1
2105 1 83 LEU HB3 1 84 ASN H . . 5.170 4.092 4.022 4.271 . 0 0 "[ . 1 . 2]" 1
2106 1 83 LEU HB3 1 95 ILE MD . . 3.800 2.263 2.145 2.591 . 0 0 "[ . 1 . 2]" 1
2107 1 83 LEU QD 1 85 ASN QD . . 5.720 4.838 4.375 5.210 . 0 0 "[ . 1 . 2]" 1
2108 1 83 LEU QD 1 86 TYR H . . 5.210 4.286 4.082 4.539 . 0 0 "[ . 1 . 2]" 1
2109 1 83 LEU QD 1 86 TYR HA . . 5.920 4.456 4.345 4.596 . 0 0 "[ . 1 . 2]" 1
2110 1 83 LEU QD 1 86 TYR QB . . 3.840 2.473 2.362 2.722 . 0 0 "[ . 1 . 2]" 1
2111 1 83 LEU QD 1 86 TYR QD . . 3.900 2.836 2.745 2.982 . 0 0 "[ . 1 . 2]" 1
2112 1 83 LEU QD 1 86 TYR QE . . 4.550 3.537 3.418 3.622 . 0 0 "[ . 1 . 2]" 1
2113 1 83 LEU QD 1 88 TYR QD . . 5.920 5.806 5.522 5.962 0.042 20 0 "[ . 1 . 2]" 1
2114 1 83 LEU QD 1 95 ILE HB . . 5.920 5.200 4.925 5.293 . 0 0 "[ . 1 . 2]" 1
2115 1 83 LEU MD1 1 84 ASN H . . 6.000 5.066 4.797 5.135 . 0 0 "[ . 1 . 2]" 1
2116 1 83 LEU MD1 1 86 TYR H . . 6.000 4.436 4.227 4.694 . 0 0 "[ . 1 . 2]" 1
2117 1 83 LEU MD1 1 86 TYR QD . . 5.200 2.859 2.765 3.000 . 0 0 "[ . 1 . 2]" 1
2118 1 83 LEU MD1 1 86 TYR QE . . 6.000 3.581 3.460 3.672 . 0 0 "[ . 1 . 2]" 1
2119 1 83 LEU MD1 1 95 ILE MD . . 4.300 3.324 3.065 4.277 . 0 0 "[ . 1 . 2]" 1
2120 1 83 LEU MD2 1 84 ASN H . . 6.000 4.355 4.281 4.432 . 0 0 "[ . 1 . 2]" 1
2121 1 83 LEU MD2 1 86 TYR H . . 6.000 5.680 5.319 6.031 0.031 20 0 "[ . 1 . 2]" 1
2122 1 83 LEU MD2 1 86 TYR QD . . 5.200 4.720 4.589 5.215 0.015 20 0 "[ . 1 . 2]" 1
2123 1 83 LEU MD2 1 86 TYR QE . . 6.000 5.484 5.304 5.872 . 0 0 "[ . 1 . 2]" 1
2124 1 83 LEU MD2 1 95 ILE MD . . 4.300 4.293 3.865 4.335 0.035 2 0 "[ . 1 . 2]" 1
2125 1 83 LEU HG 1 84 ASN H . . 5.840 5.599 5.517 5.738 . 0 0 "[ . 1 . 2]" 1
2126 1 84 ASN H 1 84 ASN QB . . 3.110 2.210 2.120 2.283 . 0 0 "[ . 1 . 2]" 1
2127 1 84 ASN H 1 85 ASN H . . 5.630 3.309 2.994 3.808 . 0 0 "[ . 1 . 2]" 1
2128 1 84 ASN H 1 95 ILE H . . 6.000 5.561 5.404 5.868 . 0 0 "[ . 1 . 2]" 1
2129 1 84 ASN H 1 95 ILE HB . . 5.000 3.847 3.560 4.004 . 0 0 "[ . 1 . 2]" 1
2130 1 84 ASN H 1 95 ILE MD . . 4.840 4.733 4.573 4.858 0.018 5 0 "[ . 1 . 2]" 1
2131 1 84 ASN H 1 95 ILE QG . . 5.350 3.238 3.084 3.446 . 0 0 "[ . 1 . 2]" 1
2132 1 84 ASN H 1 95 ILE MG . . 4.840 4.394 3.850 4.609 . 0 0 "[ . 1 . 2]" 1
2133 1 84 ASN HA 1 84 ASN QD . . 4.120 3.674 2.725 4.066 . 0 0 "[ . 1 . 2]" 1
2134 1 84 ASN HA 1 84 ASN HD22 . . 4.970 4.421 3.897 4.646 . 0 0 "[ . 1 . 2]" 1
2135 1 84 ASN HA 1 86 TYR H . . 6.000 3.904 3.737 4.138 . 0 0 "[ . 1 . 2]" 1
2136 1 84 ASN HA 1 95 ILE H . . 4.280 3.140 3.038 3.312 . 0 0 "[ . 1 . 2]" 1
2137 1 84 ASN HA 1 95 ILE HB . . 4.190 2.910 2.240 3.337 . 0 0 "[ . 1 . 2]" 1
2138 1 84 ASN HA 1 95 ILE MD . . 4.080 3.795 3.631 4.094 0.014 10 0 "[ . 1 . 2]" 1
2139 1 84 ASN HA 1 95 ILE QG . . 4.380 2.162 2.032 2.429 . 0 0 "[ . 1 . 2]" 1
2140 1 84 ASN QB 1 84 ASN QD . . 3.020 2.256 2.199 2.377 . 0 0 "[ . 1 . 2]" 1
2141 1 84 ASN QB 1 94 GLN HA . . 5.810 5.021 4.652 5.755 . 0 0 "[ . 1 . 2]" 1
2142 1 84 ASN QB 1 95 ILE H . . 4.800 3.801 3.432 4.459 . 0 0 "[ . 1 . 2]" 1
2143 1 84 ASN QB 1 95 ILE HB . . 3.950 2.574 2.221 3.102 . 0 0 "[ . 1 . 2]" 1
2144 1 84 ASN QD 1 95 ILE H . . 5.810 3.415 2.616 3.780 . 0 0 "[ . 1 . 2]" 1
2145 1 85 ASN H 1 85 ASN HD21 . . 6.000 3.705 2.541 4.522 . 0 0 "[ . 1 . 2]" 1
2146 1 85 ASN H 1 85 ASN QD . . 5.240 3.428 2.480 4.105 . 0 0 "[ . 1 . 2]" 1
2147 1 85 ASN H 1 85 ASN HD22 . . 6.000 4.098 3.409 4.736 . 0 0 "[ . 1 . 2]" 1
2148 1 85 ASN H 1 86 TYR H . . 4.180 1.831 1.726 2.144 . 0 0 "[ . 1 . 2]" 1
2149 1 85 ASN H 1 86 TYR QB . . 4.610 3.238 3.064 3.474 . 0 0 "[ . 1 . 2]" 1
2150 1 85 ASN H 1 87 ASN H . . 6.000 5.994 5.922 6.037 0.037 20 0 "[ . 1 . 2]" 1
2151 1 85 ASN H 1 95 ILE HB . . 6.000 5.423 5.021 5.727 . 0 0 "[ . 1 . 2]" 1
2152 1 85 ASN H 1 95 ILE QG . . 5.310 3.755 3.349 4.187 . 0 0 "[ . 1 . 2]" 1
2153 1 85 ASN HA 1 85 ASN QD . . 4.630 3.976 3.837 4.098 . 0 0 "[ . 1 . 2]" 1
2154 1 85 ASN HA 1 85 ASN HD22 . . 5.450 5.151 5.054 5.247 . 0 0 "[ . 1 . 2]" 1
2155 1 85 ASN HA 1 93 LEU H . . 4.850 4.867 4.857 4.886 0.036 5 0 "[ . 1 . 2]" 1
2156 1 85 ASN QB 1 85 ASN QD . . 3.090 2.343 2.224 2.514 . 0 0 "[ . 1 . 2]" 1
2157 1 86 TYR H 1 86 TYR HB2 . . 3.720 2.503 2.278 2.737 . 0 0 "[ . 1 . 2]" 1
2158 1 86 TYR H 1 86 TYR HB3 . . 3.720 2.196 2.146 2.254 . 0 0 "[ . 1 . 2]" 1
2159 1 86 TYR H 1 86 TYR QD . . 4.790 4.023 3.992 4.046 . 0 0 "[ . 1 . 2]" 1
2160 1 86 TYR H 1 86 TYR QE . . 6.000 6.060 6.044 6.081 0.081 10 0 "[ . 1 . 2]" 1
2161 1 86 TYR H 1 87 ASN HA . . 6.000 5.482 5.269 5.660 . 0 0 "[ . 1 . 2]" 1
2162 1 86 TYR H 1 93 LEU H . . 5.170 3.762 3.265 4.179 . 0 0 "[ . 1 . 2]" 1
2163 1 86 TYR H 1 93 LEU QB . . 4.170 3.560 3.117 4.072 . 0 0 "[ . 1 . 2]" 1
2164 1 86 TYR H 1 95 ILE MD . . 4.790 4.432 4.312 4.630 . 0 0 "[ . 1 . 2]" 1
2165 1 86 TYR HA 1 86 TYR QD . . 3.730 2.682 2.606 2.860 . 0 0 "[ . 1 . 2]" 1
2166 1 86 TYR HA 1 86 TYR QE . . 4.910 4.694 4.651 4.756 . 0 0 "[ . 1 . 2]" 1
2167 1 86 TYR HA 1 87 ASN H . . 3.300 2.171 2.104 2.209 . 0 0 "[ . 1 . 2]" 1
2168 1 86 TYR QB 1 87 ASN H . . 4.080 3.895 3.809 3.942 . 0 0 "[ . 1 . 2]" 1
2169 1 86 TYR QB 1 87 ASN HA . . 5.810 4.964 4.900 5.031 . 0 0 "[ . 1 . 2]" 1
2170 1 86 TYR QB 1 93 LEU H . . 5.110 3.660 3.503 3.815 . 0 0 "[ . 1 . 2]" 1
2171 1 86 TYR QB 1 95 ILE MD . . 3.450 3.499 3.483 3.516 0.066 19 0 "[ . 1 . 2]" 1
2172 1 86 TYR HB2 1 87 ASN H . . 4.760 4.317 4.193 4.382 . 0 0 "[ . 1 . 2]" 1
2173 1 86 TYR HB3 1 87 ASN H . . 4.760 4.432 4.342 4.513 . 0 0 "[ . 1 . 2]" 1
2174 1 86 TYR QD 1 88 TYR H . . 5.180 4.945 4.633 5.102 . 0 0 "[ . 1 . 2]" 1
2175 1 86 TYR QD 1 88 TYR QB . . 3.830 3.016 2.706 3.233 . 0 0 "[ . 1 . 2]" 1
2176 1 86 TYR QD 1 93 LEU H . . 6.000 4.018 3.869 4.162 . 0 0 "[ . 1 . 2]" 1
2177 1 86 TYR QD 1 93 LEU QD . . 3.670 2.093 2.060 2.145 . 0 0 "[ . 1 . 2]" 1
2178 1 86 TYR QD 1 93 LEU HG . . 5.720 2.381 2.252 2.542 . 0 0 "[ . 1 . 2]" 1
2179 1 86 TYR QD 1 95 ILE MD . . 4.200 3.944 3.766 4.093 . 0 0 "[ . 1 . 2]" 1
2180 1 86 TYR QE 1 88 TYR H . . 6.000 5.207 5.052 5.334 . 0 0 "[ . 1 . 2]" 1
2181 1 86 TYR QE 1 93 LEU MD1 . . 4.360 2.718 2.517 2.877 . 0 0 "[ . 1 . 2]" 1
2182 1 86 TYR QE 1 93 LEU QD . . 3.720 2.691 2.502 2.840 . 0 0 "[ . 1 . 2]" 1
2183 1 86 TYR QE 1 93 LEU MD2 . . 4.360 4.358 4.263 4.379 0.019 16 0 "[ . 1 . 2]" 1
2184 1 87 ASN H 1 87 ASN HB2 . . 3.860 2.633 2.372 3.675 . 0 0 "[ . 1 . 2]" 1
2185 1 87 ASN H 1 87 ASN HB3 . . 3.860 3.145 2.415 3.642 . 0 0 "[ . 1 . 2]" 1
2186 1 87 ASN H 1 87 ASN HD21 . . 6.000 4.668 4.116 4.860 . 0 0 "[ . 1 . 2]" 1
2187 1 87 ASN H 1 87 ASN QD . . 5.190 4.343 3.874 4.639 . 0 0 "[ . 1 . 2]" 1
2188 1 87 ASN H 1 87 ASN HD22 . . 6.000 5.249 4.415 5.939 . 0 0 "[ . 1 . 2]" 1
2189 1 87 ASN H 1 88 TYR H . . 5.680 4.523 4.492 4.562 . 0 0 "[ . 1 . 2]" 1
2190 1 87 ASN H 1 88 TYR QB . . 5.810 4.759 4.593 4.936 . 0 0 "[ . 1 . 2]" 1
2191 1 87 ASN H 1 93 LEU H . . 6.000 4.912 4.792 5.095 . 0 0 "[ . 1 . 2]" 1
2192 1 87 ASN H 1 93 LEU QD . . 5.920 5.517 5.410 5.655 . 0 0 "[ . 1 . 2]" 1
2193 1 87 ASN HA 1 90 GLY H . . 5.250 4.918 4.609 5.260 0.010 5 0 "[ . 1 . 2]" 1
2194 1 87 ASN QB 1 88 TYR H . . 4.370 3.387 2.972 3.848 . 0 0 "[ . 1 . 2]" 1
2195 1 87 ASN QD 1 88 TYR H . . 5.810 4.616 3.115 5.431 . 0 0 "[ . 1 . 2]" 1
2196 1 87 ASN QD 1 90 GLY H . . 5.810 4.834 3.709 5.823 0.013 8 0 "[ . 1 . 2]" 1
2197 1 87 ASN QD 1 90 GLY QA . . 5.120 4.046 2.817 5.125 0.005 12 0 "[ . 1 . 2]" 1
2198 1 88 TYR H 1 88 TYR QB . . 3.670 2.595 2.508 2.655 . 0 0 "[ . 1 . 2]" 1
2199 1 88 TYR H 1 89 GLY H . . 6.000 4.192 4.148 4.235 . 0 0 "[ . 1 . 2]" 1
2200 1 88 TYR H 1 90 GLY H . . 5.560 3.452 3.230 3.646 . 0 0 "[ . 1 . 2]" 1
2201 1 88 TYR H 1 91 CYS H . . 4.580 3.166 2.959 3.667 . 0 0 "[ . 1 . 2]" 1
2202 1 88 TYR H 1 91 CYS QB . . 5.520 3.734 3.618 3.957 . 0 0 "[ . 1 . 2]" 1
2203 1 88 TYR H 1 92 SER H . . 6.000 4.797 4.650 4.964 . 0 0 "[ . 1 . 2]" 1
2204 1 88 TYR H 1 93 LEU H . . 5.830 4.334 4.092 4.574 . 0 0 "[ . 1 . 2]" 1
2205 1 88 TYR H 1 93 LEU MD1 . . 5.030 4.997 4.749 5.064 0.034 10 0 "[ . 1 . 2]" 1
2206 1 88 TYR H 1 93 LEU MD2 . . 5.030 3.875 3.691 4.215 . 0 0 "[ . 1 . 2]" 1
2207 1 88 TYR H 1 93 LEU HG . . 5.000 3.984 3.740 4.165 . 0 0 "[ . 1 . 2]" 1
2208 1 88 TYR HA 1 88 TYR QD . . 4.290 2.536 2.287 2.854 . 0 0 "[ . 1 . 2]" 1
2209 1 88 TYR HA 1 88 TYR QE . . 4.510 4.465 4.343 4.539 0.029 16 0 "[ . 1 . 2]" 1
2210 1 88 TYR HA 1 90 GLY H . . 5.270 3.567 3.281 3.758 . 0 0 "[ . 1 . 2]" 1
2211 1 88 TYR QB 1 91 CYS H . . 5.530 4.414 4.158 5.006 . 0 0 "[ . 1 . 2]" 1
2212 1 88 TYR QB 1 93 LEU H . . 5.110 4.430 4.122 4.662 . 0 0 "[ . 1 . 2]" 1
2213 1 88 TYR QB 1 93 LEU QD . . 3.060 2.363 2.152 2.510 . 0 0 "[ . 1 . 2]" 1
2214 1 88 TYR QB 1 93 LEU HG . . 4.230 2.764 2.393 2.970 . 0 0 "[ . 1 . 2]" 1
2215 1 88 TYR HB2 1 93 LEU MD1 . . 4.130 3.369 2.816 3.727 . 0 0 "[ . 1 . 2]" 1
2216 1 88 TYR HB2 1 93 LEU MD2 . . 4.130 3.786 3.290 4.138 0.008 12 0 "[ . 1 . 2]" 1
2217 1 88 TYR HB2 1 93 LEU HG . . 4.900 3.406 2.923 3.934 . 0 0 "[ . 1 . 2]" 1
2218 1 88 TYR HB3 1 93 LEU MD1 . . 4.130 3.103 2.800 3.266 . 0 0 "[ . 1 . 2]" 1
2219 1 88 TYR HB3 1 93 LEU MD2 . . 4.130 2.565 2.348 2.749 . 0 0 "[ . 1 . 2]" 1
2220 1 88 TYR HB3 1 93 LEU HG . . 4.900 2.962 2.508 3.226 . 0 0 "[ . 1 . 2]" 1
2221 1 88 TYR QD 1 89 GLY H . . 5.500 3.669 3.554 3.941 . 0 0 "[ . 1 . 2]" 1
2222 1 88 TYR QD 1 89 GLY HA2 . . 6.000 5.135 4.824 5.328 . 0 0 "[ . 1 . 2]" 1
2223 1 88 TYR QD 1 89 GLY QA . . 5.190 4.176 3.696 4.465 . 0 0 "[ . 1 . 2]" 1
2224 1 88 TYR QD 1 89 GLY HA3 . . 6.000 4.428 3.839 4.800 . 0 0 "[ . 1 . 2]" 1
2225 1 88 TYR QD 1 91 CYS QB . . 4.710 4.424 3.684 4.716 0.006 8 0 "[ . 1 . 2]" 1
2226 1 88 TYR QD 1 93 LEU MD1 . . 3.710 3.411 3.239 3.599 . 0 0 "[ . 1 . 2]" 1
2227 1 88 TYR QD 1 93 LEU MD2 . . 3.710 2.839 2.479 3.157 . 0 0 "[ . 1 . 2]" 1
2228 1 88 TYR QD 1 93 LEU HG . . 5.590 4.398 4.054 4.616 . 0 0 "[ . 1 . 2]" 1
2229 1 88 TYR QE 1 89 GLY H . . 6.000 4.679 4.425 4.878 . 0 0 "[ . 1 . 2]" 1
2230 1 88 TYR QE 1 93 LEU QD . . 4.330 4.193 3.819 4.343 0.013 17 0 "[ . 1 . 2]" 1
2231 1 89 GLY H 1 90 GLY H . . 4.840 2.747 2.570 2.829 . 0 0 "[ . 1 . 2]" 1
2232 1 89 GLY H 1 91 CYS H . . 6.000 4.321 4.229 4.695 . 0 0 "[ . 1 . 2]" 1
2233 1 89 GLY QA 1 91 CYS H . . 5.810 3.371 3.222 3.515 . 0 0 "[ . 1 . 2]" 1
2234 1 90 GLY H 1 91 CYS H . . 4.340 2.474 2.335 2.907 . 0 0 "[ . 1 . 2]" 1
2235 1 91 CYS H 1 91 CYS QB . . 3.360 2.388 2.350 2.427 . 0 0 "[ . 1 . 2]" 1
2236 1 91 CYS H 1 92 SER H . . 5.760 4.525 4.413 4.635 . 0 0 "[ . 1 . 2]" 1
2237 1 91 CYS H 1 93 LEU QD . . 5.590 4.679 4.526 5.059 . 0 0 "[ . 1 . 2]" 1
2238 1 91 CYS HA 1 92 SER H . . 3.420 2.262 2.200 2.517 . 0 0 "[ . 1 . 2]" 1
2239 1 91 CYS QB 1 92 SER H . . 4.350 3.151 2.282 3.397 . 0 0 "[ . 1 . 2]" 1
2240 1 91 CYS QB 1 92 SER QB . . 4.900 4.724 4.327 4.905 0.005 9 0 "[ . 1 . 2]" 1
2241 1 91 CYS QB 1 93 LEU QD . . 4.280 2.965 2.806 3.318 . 0 0 "[ . 1 . 2]" 1
2242 1 92 SER H 1 92 SER HB2 . . 4.060 2.673 2.434 3.001 . 0 0 "[ . 1 . 2]" 1
2243 1 92 SER H 1 92 SER QB . . 3.250 2.371 2.298 2.557 . 0 0 "[ . 1 . 2]" 1
2244 1 92 SER H 1 92 SER HB3 . . 4.060 2.792 2.488 3.762 . 0 0 "[ . 1 . 2]" 1
2245 1 92 SER H 1 93 LEU H . . 4.990 4.560 4.464 4.624 . 0 0 "[ . 1 . 2]" 1
2246 1 92 SER HA 1 93 LEU H . . 3.440 2.221 2.186 2.288 . 0 0 "[ . 1 . 2]" 1
2247 1 93 LEU H 1 93 LEU QB . . 3.310 2.547 2.513 2.593 . 0 0 "[ . 1 . 2]" 1
2248 1 93 LEU H 1 93 LEU MD1 . . 4.130 3.970 3.913 4.041 . 0 0 "[ . 1 . 2]" 1
2249 1 93 LEU H 1 93 LEU QD . . 3.480 2.976 2.850 3.200 . 0 0 "[ . 1 . 2]" 1
2250 1 93 LEU H 1 93 LEU MD2 . . 4.130 3.076 2.928 3.354 . 0 0 "[ . 1 . 2]" 1
2251 1 93 LEU H 1 93 LEU HG . . 3.460 2.527 2.410 2.684 . 0 0 "[ . 1 . 2]" 1
2252 1 93 LEU H 1 94 GLN H . . 5.880 4.587 4.561 4.615 . 0 0 "[ . 1 . 2]" 1
2253 1 93 LEU HA 1 93 LEU MD1 . . 4.050 3.764 3.707 3.806 . 0 0 "[ . 1 . 2]" 1
2254 1 93 LEU HA 1 93 LEU QD . . 3.280 2.219 2.185 2.253 . 0 0 "[ . 1 . 2]" 1
2255 1 93 LEU HA 1 93 LEU MD2 . . 4.050 2.235 2.200 2.270 . 0 0 "[ . 1 . 2]" 1
2256 1 93 LEU HA 1 94 GLN H . . 3.190 2.151 2.107 2.207 . 0 0 "[ . 1 . 2]" 1
2257 1 93 LEU QB 1 93 LEU QD . . 2.570 1.976 1.964 1.988 . 0 0 "[ . 1 . 2]" 1
2258 1 93 LEU QB 1 94 GLN H . . 3.870 2.843 2.664 2.936 . 0 0 "[ . 1 . 2]" 1
2259 1 93 LEU HB2 1 93 LEU MD1 . . 3.410 2.397 2.334 2.429 . 0 0 "[ . 1 . 2]" 1
2260 1 93 LEU HB2 1 93 LEU MD2 . . 3.410 3.260 3.247 3.274 . 0 0 "[ . 1 . 2]" 1
2261 1 93 LEU HB3 1 93 LEU MD1 . . 3.410 2.271 2.227 2.305 . 0 0 "[ . 1 . 2]" 1
2262 1 93 LEU HB3 1 93 LEU MD2 . . 3.410 2.583 2.541 2.635 . 0 0 "[ . 1 . 2]" 1
2263 1 93 LEU QD 1 94 GLN H . . 4.310 3.567 3.478 3.631 . 0 0 "[ . 1 . 2]" 1
2264 1 93 LEU QD 1 95 ILE QG . . 3.960 3.982 3.964 3.999 0.039 2 0 "[ . 1 . 2]" 1
2265 1 94 GLN H 1 94 GLN QB . . 3.460 2.525 2.425 2.641 . 0 0 "[ . 1 . 2]" 1
2266 1 94 GLN H 1 94 GLN QE . . 5.080 4.442 3.387 5.091 0.011 11 0 "[ . 1 . 2]" 1
2267 1 94 GLN H 1 94 GLN HG2 . . 3.680 3.222 2.316 3.716 0.036 18 0 "[ . 1 . 2]" 1
2268 1 94 GLN H 1 94 GLN QG . . 3.230 2.538 2.295 2.811 . 0 0 "[ . 1 . 2]" 1
2269 1 94 GLN H 1 94 GLN HG3 . . 3.680 3.086 2.622 3.759 0.079 2 0 "[ . 1 . 2]" 1
2270 1 94 GLN H 1 95 ILE H . . 5.410 4.492 4.416 4.541 . 0 0 "[ . 1 . 2]" 1
2271 1 94 GLN H 1 95 ILE HA . . 6.000 5.050 4.913 5.193 . 0 0 "[ . 1 . 2]" 1
2272 1 94 GLN H 1 95 ILE QG . . 5.320 4.203 4.084 4.332 . 0 0 "[ . 1 . 2]" 1
2273 1 94 GLN HA 1 94 GLN HE21 . . 6.000 4.646 3.777 5.200 . 0 0 "[ . 1 . 2]" 1
2274 1 94 GLN HA 1 94 GLN HE22 . . 6.000 5.315 3.968 6.011 0.011 12 0 "[ . 1 . 2]" 1
2275 1 94 GLN HA 1 94 GLN QG . . 3.680 2.709 2.417 3.254 . 0 0 "[ . 1 . 2]" 1
2276 1 94 GLN HA 1 95 ILE H . . 3.280 2.247 2.168 2.286 . 0 0 "[ . 1 . 2]" 1
2277 1 94 GLN HA 1 95 ILE HB . . 5.280 4.719 4.587 4.838 . 0 0 "[ . 1 . 2]" 1
2278 1 94 GLN QG 1 95 ILE H . . 5.810 4.464 4.173 4.920 . 0 0 "[ . 1 . 2]" 1
2279 1 95 ILE H 1 95 ILE HB . . 3.770 2.873 2.775 2.957 . 0 0 "[ . 1 . 2]" 1
2280 1 95 ILE H 1 95 ILE MD . . 4.040 3.936 3.814 4.072 0.032 10 0 "[ . 1 . 2]" 1
2281 1 95 ILE H 1 95 ILE QG . . 3.680 2.718 2.586 2.875 . 0 0 "[ . 1 . 2]" 1
2282 1 95 ILE H 1 95 ILE MG . . 4.150 3.992 3.953 4.039 . 0 0 "[ . 1 . 2]" 1
2283 1 95 ILE H 1 96 SER H . . 4.520 4.370 4.316 4.413 . 0 0 "[ . 1 . 2]" 1
2284 1 95 ILE HA 1 95 ILE MD . . 3.960 2.756 2.567 2.870 . 0 0 "[ . 1 . 2]" 1
2285 1 95 ILE HA 1 95 ILE QG . . 3.570 3.159 3.054 3.217 . 0 0 "[ . 1 . 2]" 1
2286 1 95 ILE HA 1 96 SER H . . 3.330 2.190 2.162 2.236 . 0 0 "[ . 1 . 2]" 1
2287 1 95 ILE HB 1 95 ILE MD . . 3.210 3.255 3.240 3.265 0.055 19 0 "[ . 1 . 2]" 1
2288 1 95 ILE HB 1 96 SER H . . 5.150 3.841 3.752 4.016 . 0 0 "[ . 1 . 2]" 1
2289 1 95 ILE QG 1 95 ILE MG . . 3.010 2.373 2.317 2.410 . 0 0 "[ . 1 . 2]" 1
2290 1 95 ILE QG 1 96 SER H . . 4.670 4.716 4.705 4.730 0.060 13 0 "[ . 1 . 2]" 1
2291 1 95 ILE HG12 1 95 ILE MG . . 3.480 3.249 3.241 3.262 . 0 0 "[ . 1 . 2]" 1
2292 1 95 ILE HG13 1 95 ILE MG . . 3.480 2.440 2.372 2.486 . 0 0 "[ . 1 . 2]" 1
2293 1 95 ILE MG 1 96 SER H . . 3.730 2.419 2.346 2.571 . 0 0 "[ . 1 . 2]" 1
2294 1 95 ILE MG 1 97 TYR H . . 5.660 5.313 5.228 5.404 . 0 0 "[ . 1 . 2]" 1
2295 1 96 SER H 1 96 SER QB . . 3.650 3.122 2.698 3.322 . 0 0 "[ . 1 . 2]" 1
2296 1 96 SER H 1 96 SER HG . . 5.100 3.548 2.791 4.993 . 0 0 "[ . 1 . 2]" 1
2297 1 96 SER H 1 97 TYR H . . 6.000 4.408 4.381 4.456 . 0 0 "[ . 1 . 2]" 1
2298 1 96 SER HA 1 97 TYR H . . 3.550 2.642 2.535 2.743 . 0 0 "[ . 1 . 2]" 1
2299 1 96 SER QB 1 97 TYR H . . 3.320 2.390 2.014 3.164 . 0 0 "[ . 1 . 2]" 1
2300 1 96 SER HG 1 97 TYR H . . 6.000 3.709 2.949 4.343 . 0 0 "[ . 1 . 2]" 1
2301 1 97 TYR H 1 97 TYR QB . . 3.500 2.211 2.122 2.310 . 0 0 "[ . 1 . 2]" 1
2302 1 97 TYR H 1 97 TYR QD . . 5.190 3.323 2.797 3.639 . 0 0 "[ . 1 . 2]" 1
2303 1 97 TYR H 1 98 ALA H . . 5.750 4.542 4.347 4.594 . 0 0 "[ . 1 . 2]" 1
2304 1 97 TYR HA 1 98 ALA H . . 3.410 2.177 2.080 2.242 . 0 0 "[ . 1 . 2]" 1
2305 1 97 TYR QB 1 98 ALA H . . 4.240 3.239 2.806 3.555 . 0 0 "[ . 1 . 2]" 1
2306 1 97 TYR QB 1 98 ALA MB . . 5.710 4.421 3.904 4.720 . 0 0 "[ . 1 . 2]" 1
2307 1 97 TYR QD 1 98 ALA H . . 5.960 3.166 2.766 3.337 . 0 0 "[ . 1 . 2]" 1
2308 1 97 TYR QD 1 99 ARG HA . . 6.000 5.658 5.086 5.864 . 0 0 "[ . 1 . 2]" 1
2309 1 98 ALA H 1 98 ALA MB . . 3.270 2.060 1.969 2.106 . 0 0 "[ . 1 . 2]" 1
2310 1 98 ALA MB 1 101 ASP H . . 4.240 3.982 3.583 4.247 0.007 12 0 "[ . 1 . 2]" 1
2311 1 99 ARG H 1 99 ARG QB . . 3.640 2.145 2.054 2.454 . 0 0 "[ . 1 . 2]" 1
2312 1 99 ARG H 1 99 ARG QG . . 4.760 3.776 3.610 3.969 . 0 0 "[ . 1 . 2]" 1
2313 1 99 ARG H 1 100 ARG H . . 6.000 2.786 2.430 3.082 . 0 0 "[ . 1 . 2]" 1
2314 1 99 ARG H 1 101 ASP H . . 5.250 5.248 4.603 5.299 0.049 10 0 "[ . 1 . 2]" 1
2315 1 99 ARG HA 1 99 ARG HG2 . . 4.250 3.668 3.419 4.011 . 0 0 "[ . 1 . 2]" 1
2316 1 99 ARG HA 1 99 ARG QG . . 3.440 2.812 2.606 3.226 . 0 0 "[ . 1 . 2]" 1
2317 1 99 ARG HA 1 99 ARG HG3 . . 4.250 2.922 2.703 3.400 . 0 0 "[ . 1 . 2]" 1
2318 1 99 ARG HA 1 100 ARG H . . 3.450 3.537 3.520 3.567 0.117 6 0 "[ . 1 . 2]" 1
2319 1 99 ARG QB 1 99 ARG QD . . 3.120 2.341 2.124 2.468 . 0 0 "[ . 1 . 2]" 1
2320 1 99 ARG QB 1 99 ARG HE . . 3.840 2.909 1.871 3.896 0.056 13 0 "[ . 1 . 2]" 1
2321 1 99 ARG HB2 1 99 ARG HD2 . . 4.000 3.419 2.421 3.722 . 0 0 "[ . 1 . 2]" 1
2322 1 99 ARG HB2 1 99 ARG HD3 . . 4.000 2.787 2.337 3.766 . 0 0 "[ . 1 . 2]" 1
2323 1 99 ARG HB2 1 99 ARG HE . . 4.440 3.494 1.892 4.421 . 0 0 "[ . 1 . 2]" 1
2324 1 99 ARG HB3 1 99 ARG HD2 . . 4.000 3.594 2.610 3.926 . 0 0 "[ . 1 . 2]" 1
2325 1 99 ARG HB3 1 99 ARG HD3 . . 4.000 3.384 2.514 4.104 0.104 8 0 "[ . 1 . 2]" 1
2326 1 99 ARG HB3 1 99 ARG HE . . 4.440 3.331 2.231 4.329 . 0 0 "[ . 1 . 2]" 1
2327 1 99 ARG QD 1 100 ARG H . . 5.740 4.707 3.704 5.143 . 0 0 "[ . 1 . 2]" 1
2328 1 99 ARG QD 1 100 ARG HA . . 5.810 5.769 5.515 5.861 0.051 13 0 "[ . 1 . 2]" 1
2329 1 99 ARG HE 1 100 ARG H . . 5.190 5.143 4.602 5.287 0.097 9 0 "[ . 1 . 2]" 1
2330 1 99 ARG QG 1 100 ARG H . . 4.420 2.816 2.182 3.387 . 0 0 "[ . 1 . 2]" 1
2331 1 100 ARG H 1 100 ARG QB . . 3.560 2.566 2.372 2.707 . 0 0 "[ . 1 . 2]" 1
2332 1 100 ARG H 1 100 ARG QD . . 5.810 4.364 4.305 4.588 . 0 0 "[ . 1 . 2]" 1
2333 1 100 ARG H 1 100 ARG QG . . 4.000 4.140 4.057 4.185 0.185 8 0 "[ . 1 . 2]" 1
2334 1 100 ARG H 1 101 ASP H . . 4.660 3.553 3.300 3.878 . 0 0 "[ . 1 . 2]" 1
2335 1 100 ARG HA 1 100 ARG QG . . 3.570 2.477 2.255 3.121 . 0 0 "[ . 1 . 2]" 1
2336 1 100 ARG HA 1 101 ASP QB . . 5.810 3.625 3.505 4.152 . 0 0 "[ . 1 . 2]" 1
2337 1 100 ARG QB 1 100 ARG HE . . 3.890 3.826 2.779 3.957 0.067 9 0 "[ . 1 . 2]" 1
2338 1 100 ARG QB 1 100 ARG QG . . 2.210 1.925 1.913 1.956 . 0 0 "[ . 1 . 2]" 1
2339 1 100 ARG QB 1 101 ASP H . . 4.460 3.937 3.914 3.955 . 0 0 "[ . 1 . 2]" 1
2340 1 100 ARG QD 1 101 ASP HA . . 5.810 3.638 3.395 3.781 . 0 0 "[ . 1 . 2]" 1
2341 1 100 ARG HE 1 101 ASP H . . 6.000 5.666 4.257 6.001 0.001 5 0 "[ . 1 . 2]" 1
2342 1 100 ARG QG 1 101 ASP H . . 4.270 4.205 4.093 4.276 0.006 6 0 "[ . 1 . 2]" 1
2343 1 101 ASP H 1 101 ASP QB . . 3.540 3.071 2.957 3.416 . 0 0 "[ . 1 . 2]" 1
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