NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
419974 |
2edz   |
10267 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2edz
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 1843
_Distance_constraint_stats_list.Viol_count 329
_Distance_constraint_stats_list.Viol_total 52.364
_Distance_constraint_stats_list.Viol_max 0.083
_Distance_constraint_stats_list.Viol_rms 0.0015
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0080
_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 8 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 ALA 0.001 0.001 19 0 "[ . 1 . 2]"
1 10 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 THR 0.008 0.005 15 0 "[ . 1 . 2]"
1 12 PHE 0.036 0.015 14 0 "[ . 1 . 2]"
1 13 ASN 0.401 0.080 18 0 "[ . 1 . 2]"
1 14 PRO 0.392 0.080 18 0 "[ . 1 . 2]"
1 15 ARG 0.009 0.003 7 0 "[ . 1 . 2]"
1 16 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 LYS 0.010 0.005 12 0 "[ . 1 . 2]"
1 19 LEU 0.087 0.021 2 0 "[ . 1 . 2]"
1 20 SER 0.079 0.021 2 0 "[ . 1 . 2]"
1 21 LYS 0.025 0.018 13 0 "[ . 1 . 2]"
1 22 GLN 0.056 0.018 20 0 "[ . 1 . 2]"
1 23 GLU 0.215 0.062 2 0 "[ . 1 . 2]"
1 24 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 TYR 0.027 0.007 8 0 "[ . 1 . 2]"
1 28 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 PHE 0.014 0.004 12 0 "[ . 1 . 2]"
1 30 PHE 0.011 0.008 8 0 "[ . 1 . 2]"
1 31 LEU 0.008 0.008 12 0 "[ . 1 . 2]"
1 32 ARG 0.014 0.008 8 0 "[ . 1 . 2]"
1 33 ILE 0.002 0.001 12 0 "[ . 1 . 2]"
1 34 GLU 0.001 0.001 12 0 "[ . 1 . 2]"
1 35 LYS 0.026 0.023 13 0 "[ . 1 . 2]"
1 36 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 THR 0.145 0.045 20 0 "[ . 1 . 2]"
1 38 ASP 0.003 0.003 17 0 "[ . 1 . 2]"
1 39 GLY 0.036 0.020 1 0 "[ . 1 . 2]"
1 40 HIS 0.074 0.020 1 0 "[ . 1 . 2]"
1 41 LEU 0.029 0.013 12 0 "[ . 1 . 2]"
1 42 ILE 0.015 0.007 10 0 "[ . 1 . 2]"
1 43 ARG 0.054 0.046 11 0 "[ . 1 . 2]"
1 44 VAL 0.051 0.046 11 0 "[ . 1 . 2]"
1 45 ILE 0.016 0.004 4 0 "[ . 1 . 2]"
1 46 GLU 0.037 0.014 8 0 "[ . 1 . 2]"
1 47 GLU 0.025 0.025 11 0 "[ . 1 . 2]"
1 48 GLY 0.031 0.025 11 0 "[ . 1 . 2]"
1 49 SER 0.013 0.005 11 0 "[ . 1 . 2]"
1 50 PRO 0.082 0.017 17 0 "[ . 1 . 2]"
1 51 ALA 0.072 0.017 17 0 "[ . 1 . 2]"
1 52 GLU 0.003 0.002 1 0 "[ . 1 . 2]"
1 53 LYS 0.001 0.001 5 0 "[ . 1 . 2]"
1 54 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 LEU 0.009 0.009 17 0 "[ . 1 . 2]"
1 57 LEU 0.481 0.065 19 0 "[ . 1 . 2]"
1 58 ASP 0.028 0.010 5 0 "[ . 1 . 2]"
1 59 GLY 0.006 0.003 12 0 "[ . 1 . 2]"
1 60 ASP 0.007 0.003 4 0 "[ . 1 . 2]"
1 61 ARG 0.025 0.013 12 0 "[ . 1 . 2]"
1 62 VAL 0.063 0.015 17 0 "[ . 1 . 2]"
1 63 LEU 0.015 0.005 20 0 "[ . 1 . 2]"
1 64 ARG 0.012 0.008 20 0 "[ . 1 . 2]"
1 65 ILE 0.031 0.006 10 0 "[ . 1 . 2]"
1 66 ASN 0.026 0.013 17 0 "[ . 1 . 2]"
1 67 GLY 0.002 0.002 20 0 "[ . 1 . 2]"
1 68 VAL 0.001 0.001 20 0 "[ . 1 . 2]"
1 69 PHE 0.068 0.016 10 0 "[ . 1 . 2]"
1 70 VAL 0.007 0.003 15 0 "[ . 1 . 2]"
1 71 ASP 0.012 0.007 9 0 "[ . 1 . 2]"
1 72 LYS 0.181 0.039 5 0 "[ . 1 . 2]"
1 73 GLU 0.032 0.024 9 0 "[ . 1 . 2]"
1 74 GLU 0.009 0.007 10 0 "[ . 1 . 2]"
1 75 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 ALA 0.019 0.019 10 0 "[ . 1 . 2]"
1 77 GLN 0.017 0.008 10 0 "[ . 1 . 2]"
1 78 VAL 0.008 0.003 10 0 "[ . 1 . 2]"
1 79 VAL 0.030 0.019 10 0 "[ . 1 . 2]"
1 80 GLU 0.211 0.083 16 0 "[ . 1 . 2]"
1 81 LEU 0.070 0.028 16 0 "[ . 1 . 2]"
1 82 VAL 0.015 0.004 19 0 "[ . 1 . 2]"
1 83 ARG 0.072 0.037 17 0 "[ . 1 . 2]"
1 84 LYS 0.001 0.001 6 0 "[ . 1 . 2]"
1 85 SER 0.021 0.007 12 0 "[ . 1 . 2]"
1 86 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 ASN 0.002 0.001 19 0 "[ . 1 . 2]"
1 88 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 VAL 0.012 0.007 12 0 "[ . 1 . 2]"
1 90 THR 0.009 0.003 17 0 "[ . 1 . 2]"
1 91 LEU 0.006 0.004 20 0 "[ . 1 . 2]"
1 92 LEU 0.007 0.002 10 0 "[ . 1 . 2]"
1 93 VAL 0.027 0.004 20 0 "[ . 1 . 2]"
1 94 LEU 0.002 0.002 16 0 "[ . 1 . 2]"
1 95 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 TYR 0.002 0.002 1 0 "[ . 1 . 2]"
1 100 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 LYS 0.004 0.002 7 0 "[ . 1 . 2]"
1 102 ALA 0.008 0.002 15 0 "[ . 1 . 2]"
1 103 VAL 0.002 0.002 15 0 "[ . 1 . 2]"
1 104 LYS 0.021 0.011 13 0 "[ . 1 . 2]"
1 105 ASN 0.003 0.003 9 0 "[ . 1 . 2]"
1 106 GLN 0.000 0.000 15 0 "[ . 1 . 2]"
1 107 VAL 0.003 0.002 12 0 "[ . 1 . 2]"
1 108 ASP 0.003 0.002 15 0 "[ . 1 . 2]"
1 109 LEU 0.017 0.004 12 0 "[ . 1 . 2]"
1 110 LYS 0.023 0.013 10 0 "[ . 1 . 2]"
1 111 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 LEU 0.030 0.005 20 0 "[ . 1 . 2]"
1 113 ASP 0.002 0.001 20 0 "[ . 1 . 2]"
1 114 GLN 0.029 0.021 18 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 MET QB 1 9 ALA H . . 4.810 3.070 2.100 3.920 . 0 0 "[ . 1 . 2]" 1
2 1 9 ALA MB 1 10 SER H . . 4.550 2.808 2.073 3.694 . 0 0 "[ . 1 . 2]" 1
3 1 9 ALA MB 1 107 VAL QG . . 4.170 3.364 1.818 4.171 0.001 19 0 "[ . 1 . 2]" 1
4 1 10 SER HA 1 11 THR MG . . 4.090 3.703 3.462 4.062 . 0 0 "[ . 1 . 2]" 1
5 1 10 SER HB2 1 11 THR H . . 5.500 3.553 2.197 4.592 . 0 0 "[ . 1 . 2]" 1
6 1 10 SER HB3 1 11 THR H . . 5.500 3.160 2.190 3.951 . 0 0 "[ . 1 . 2]" 1
7 1 11 THR H 1 11 THR MG . . 4.160 2.645 2.229 3.207 . 0 0 "[ . 1 . 2]" 1
8 1 11 THR H 1 12 PHE H . . 4.320 4.273 4.207 4.325 0.005 15 0 "[ . 1 . 2]" 1
9 1 11 THR HA 1 11 THR HB . . 2.850 2.470 2.422 2.517 . 0 0 "[ . 1 . 2]" 1
10 1 11 THR HA 1 11 THR MG . . 3.230 2.638 2.257 3.207 . 0 0 "[ . 1 . 2]" 1
11 1 11 THR HA 1 12 PHE H . . 3.200 2.185 2.141 2.240 . 0 0 "[ . 1 . 2]" 1
12 1 11 THR HA 1 12 PHE HB2 . . 5.070 4.566 4.363 4.792 . 0 0 "[ . 1 . 2]" 1
13 1 11 THR HA 1 12 PHE QD . . 4.440 3.426 2.956 4.096 . 0 0 "[ . 1 . 2]" 1
14 1 11 THR HB 1 12 PHE H . . 4.100 3.658 3.013 4.068 . 0 0 "[ . 1 . 2]" 1
15 1 11 THR MG 1 12 PHE H . . 4.450 3.945 3.716 4.168 . 0 0 "[ . 1 . 2]" 1
16 1 12 PHE H 1 12 PHE HB2 . . 3.340 2.459 2.310 2.673 . 0 0 "[ . 1 . 2]" 1
17 1 12 PHE H 1 12 PHE QD . . 4.000 2.176 1.912 2.569 . 0 0 "[ . 1 . 2]" 1
18 1 12 PHE H 1 12 PHE QE . . 4.670 4.296 4.076 4.621 . 0 0 "[ . 1 . 2]" 1
19 1 12 PHE H 1 13 ASN H . . 4.610 4.570 4.494 4.625 0.015 14 0 "[ . 1 . 2]" 1
20 1 12 PHE H 1 112 LEU MD1 . . 4.530 4.450 4.057 4.534 0.004 20 0 "[ . 1 . 2]" 1
21 1 12 PHE HB2 1 13 ASN H . . 4.770 3.586 3.212 4.139 . 0 0 "[ . 1 . 2]" 1
22 1 12 PHE HB2 1 14 PRO HD3 . . 4.520 3.432 3.103 3.665 . 0 0 "[ . 1 . 2]" 1
23 1 12 PHE HB2 1 94 LEU MD1 . . 4.330 2.818 2.263 3.616 . 0 0 "[ . 1 . 2]" 1
24 1 12 PHE HB2 1 112 LEU MD1 . . 4.260 3.341 2.645 3.890 . 0 0 "[ . 1 . 2]" 1
25 1 12 PHE HB2 1 112 LEU MD2 . . 3.800 1.994 1.785 2.330 . 0 0 "[ . 1 . 2]" 1
26 1 12 PHE HB3 1 13 ASN H . . 3.960 2.387 1.943 3.150 . 0 0 "[ . 1 . 2]" 1
27 1 12 PHE HB3 1 14 PRO HD3 . . 4.930 3.883 3.429 4.521 . 0 0 "[ . 1 . 2]" 1
28 1 12 PHE HB3 1 94 LEU MD1 . . 3.720 2.396 1.981 2.858 . 0 0 "[ . 1 . 2]" 1
29 1 12 PHE HB3 1 94 LEU MD2 . . 4.560 3.426 2.736 3.901 . 0 0 "[ . 1 . 2]" 1
30 1 12 PHE HB3 1 112 LEU MD2 . . 3.840 3.388 3.090 3.777 . 0 0 "[ . 1 . 2]" 1
31 1 12 PHE QD 1 13 ASN H . . 4.810 3.713 3.078 4.221 . 0 0 "[ . 1 . 2]" 1
32 1 12 PHE QD 1 94 LEU MD1 . . 4.300 3.503 2.860 3.923 . 0 0 "[ . 1 . 2]" 1
33 1 12 PHE QD 1 94 LEU MD2 . . 4.640 3.516 2.763 3.957 . 0 0 "[ . 1 . 2]" 1
34 1 12 PHE QD 1 94 LEU HG . . 5.500 4.865 4.350 5.474 . 0 0 "[ . 1 . 2]" 1
35 1 12 PHE QD 1 98 SER HA . . 4.820 3.773 3.187 4.483 . 0 0 "[ . 1 . 2]" 1
36 1 12 PHE QD 1 98 SER HB2 . . 4.370 3.725 2.045 4.346 . 0 0 "[ . 1 . 2]" 1
37 1 12 PHE QD 1 98 SER QB . . 3.820 2.535 1.986 3.690 . 0 0 "[ . 1 . 2]" 1
38 1 12 PHE QD 1 98 SER HB3 . . 4.370 2.773 1.997 4.344 . 0 0 "[ . 1 . 2]" 1
39 1 12 PHE QD 1 101 LYS QB . . 5.500 4.844 3.871 5.345 . 0 0 "[ . 1 . 2]" 1
40 1 12 PHE QD 1 102 ALA MB . . 3.820 3.436 2.969 3.821 0.001 3 0 "[ . 1 . 2]" 1
41 1 12 PHE QD 1 107 VAL QG . . 4.400 3.052 2.490 3.739 . 0 0 "[ . 1 . 2]" 1
42 1 12 PHE QD 1 112 LEU MD1 . . 4.610 3.698 3.364 4.177 . 0 0 "[ . 1 . 2]" 1
43 1 12 PHE QD 1 112 LEU MD2 . . 4.160 2.285 1.917 3.038 . 0 0 "[ . 1 . 2]" 1
44 1 12 PHE QE 1 98 SER HA . . 4.440 2.830 2.222 3.641 . 0 0 "[ . 1 . 2]" 1
45 1 12 PHE QE 1 98 SER QB . . 4.390 3.259 2.057 4.167 . 0 0 "[ . 1 . 2]" 1
46 1 12 PHE QE 1 101 LYS QB . . 3.930 2.981 2.141 3.837 . 0 0 "[ . 1 . 2]" 1
47 1 12 PHE QE 1 101 LYS QD . . 4.550 3.029 2.259 4.431 . 0 0 "[ . 1 . 2]" 1
48 1 12 PHE QE 1 101 LYS QE . . 5.210 4.379 2.145 5.209 . 0 0 "[ . 1 . 2]" 1
49 1 12 PHE QE 1 102 ALA H . . 4.260 3.861 3.342 4.237 . 0 0 "[ . 1 . 2]" 1
50 1 12 PHE QE 1 102 ALA HA . . 4.570 3.181 2.720 3.621 . 0 0 "[ . 1 . 2]" 1
51 1 12 PHE QE 1 102 ALA MB . . 3.800 2.289 1.974 3.261 . 0 0 "[ . 1 . 2]" 1
52 1 12 PHE QE 1 107 VAL MG1 . . 4.270 2.213 1.924 3.095 . 0 0 "[ . 1 . 2]" 1
53 1 12 PHE QE 1 107 VAL QG . . 3.590 2.111 1.805 2.889 . 0 0 "[ . 1 . 2]" 1
54 1 12 PHE QE 1 107 VAL MG2 . . 4.270 2.864 1.982 3.462 . 0 0 "[ . 1 . 2]" 1
55 1 12 PHE HZ 1 101 LYS QB . . 4.000 3.103 2.150 3.745 . 0 0 "[ . 1 . 2]" 1
56 1 12 PHE HZ 1 101 LYS QG . . 4.620 3.091 2.276 4.385 . 0 0 "[ . 1 . 2]" 1
57 1 12 PHE HZ 1 102 ALA H . . 4.620 3.474 3.099 4.033 . 0 0 "[ . 1 . 2]" 1
58 1 12 PHE HZ 1 102 ALA HA . . 3.990 2.976 2.252 3.874 . 0 0 "[ . 1 . 2]" 1
59 1 12 PHE HZ 1 102 ALA MB . . 3.980 3.014 2.513 3.807 . 0 0 "[ . 1 . 2]" 1
60 1 12 PHE HZ 1 107 VAL MG1 . . 4.770 4.090 3.599 4.645 . 0 0 "[ . 1 . 2]" 1
61 1 12 PHE HZ 1 107 VAL QG . . 3.900 3.299 2.681 3.779 . 0 0 "[ . 1 . 2]" 1
62 1 12 PHE HZ 1 107 VAL MG2 . . 4.770 3.502 2.766 4.170 . 0 0 "[ . 1 . 2]" 1
63 1 13 ASN H 1 13 ASN HB2 . . 3.860 3.194 2.638 3.775 . 0 0 "[ . 1 . 2]" 1
64 1 13 ASN H 1 13 ASN QB . . 3.270 2.757 2.323 3.070 . 0 0 "[ . 1 . 2]" 1
65 1 13 ASN H 1 13 ASN HB3 . . 3.860 3.330 2.372 3.806 . 0 0 "[ . 1 . 2]" 1
66 1 13 ASN H 1 13 ASN QD . . 4.510 3.755 2.454 4.425 . 0 0 "[ . 1 . 2]" 1
67 1 13 ASN H 1 14 PRO HD2 . . 4.740 4.377 4.203 4.521 . 0 0 "[ . 1 . 2]" 1
68 1 13 ASN H 1 94 LEU MD1 . . 3.950 3.516 2.871 3.904 . 0 0 "[ . 1 . 2]" 1
69 1 13 ASN HA 1 14 PRO HD2 . . 3.080 1.952 1.917 1.992 . 0 0 "[ . 1 . 2]" 1
70 1 13 ASN HA 1 14 PRO HD3 . . 3.310 2.675 2.558 2.770 . 0 0 "[ . 1 . 2]" 1
71 1 13 ASN HA 1 14 PRO HG2 . . 4.400 4.132 4.115 4.154 . 0 0 "[ . 1 . 2]" 1
72 1 13 ASN HA 1 14 PRO HG3 . . 4.680 4.487 4.414 4.552 . 0 0 "[ . 1 . 2]" 1
73 1 13 ASN HA 1 94 LEU MD1 . . 4.680 4.491 4.055 4.679 . 0 0 "[ . 1 . 2]" 1
74 1 13 ASN QB 1 14 PRO HD2 . . 4.060 3.740 3.583 4.087 0.027 13 0 "[ . 1 . 2]" 1
75 1 13 ASN QB 1 94 LEU MD1 . . 5.340 4.713 4.041 5.077 . 0 0 "[ . 1 . 2]" 1
76 1 13 ASN HB2 1 14 PRO HD2 . . 4.690 4.350 3.899 4.740 0.050 11 0 "[ . 1 . 2]" 1
77 1 13 ASN HB3 1 14 PRO HD2 . . 4.690 4.179 3.729 4.770 0.080 18 0 "[ . 1 . 2]" 1
78 1 14 PRO HA 1 15 ARG H . . 3.040 2.380 2.241 2.591 . 0 0 "[ . 1 . 2]" 1
79 1 14 PRO HB2 1 15 ARG H . . 3.760 2.687 2.172 3.077 . 0 0 "[ . 1 . 2]" 1
80 1 14 PRO HB2 1 63 LEU MD1 . . 3.760 3.137 2.883 3.528 . 0 0 "[ . 1 . 2]" 1
81 1 14 PRO HB2 1 92 LEU MD2 . . 3.180 2.576 2.230 3.173 . 0 0 "[ . 1 . 2]" 1
82 1 14 PRO HB2 1 93 VAL H . . 4.830 4.225 3.613 4.778 . 0 0 "[ . 1 . 2]" 1
83 1 14 PRO HB3 1 15 ARG H . . 3.840 3.499 3.249 3.710 . 0 0 "[ . 1 . 2]" 1
84 1 14 PRO HB3 1 63 LEU MD1 . . 3.760 2.477 2.185 2.850 . 0 0 "[ . 1 . 2]" 1
85 1 14 PRO HB3 1 94 LEU MD1 . . 4.210 2.297 1.972 2.693 . 0 0 "[ . 1 . 2]" 1
86 1 14 PRO HB3 1 112 LEU HB3 . . 3.880 3.351 2.771 3.881 0.001 12 0 "[ . 1 . 2]" 1
87 1 14 PRO HD2 1 94 LEU MD1 . . 4.600 4.338 4.011 4.523 . 0 0 "[ . 1 . 2]" 1
88 1 14 PRO HD2 1 112 LEU MD2 . . 4.300 3.963 3.595 4.183 . 0 0 "[ . 1 . 2]" 1
89 1 14 PRO HD3 1 94 LEU MD1 . . 4.210 3.163 2.836 3.452 . 0 0 "[ . 1 . 2]" 1
90 1 14 PRO HD3 1 112 LEU HB3 . . 4.470 3.157 2.706 3.549 . 0 0 "[ . 1 . 2]" 1
91 1 14 PRO HD3 1 112 LEU MD1 . . 4.520 4.166 3.643 4.519 . 0 0 "[ . 1 . 2]" 1
92 1 14 PRO HD3 1 112 LEU MD2 . . 4.210 2.568 2.241 3.056 . 0 0 "[ . 1 . 2]" 1
93 1 14 PRO HG2 1 63 LEU MD1 . . 4.530 4.328 3.982 4.532 0.002 17 0 "[ . 1 . 2]" 1
94 1 14 PRO HG2 1 92 LEU MD1 . . 4.730 3.840 3.281 4.556 . 0 0 "[ . 1 . 2]" 1
95 1 14 PRO HG2 1 92 LEU MD2 . . 3.860 2.902 2.152 3.553 . 0 0 "[ . 1 . 2]" 1
96 1 14 PRO HG2 1 112 LEU HB3 . . 4.150 3.965 3.701 4.142 . 0 0 "[ . 1 . 2]" 1
97 1 14 PRO HG2 1 114 GLN H . . 3.530 2.913 2.472 3.484 . 0 0 "[ . 1 . 2]" 1
98 1 14 PRO HG2 1 114 GLN HA . . 4.780 3.386 2.472 3.942 . 0 0 "[ . 1 . 2]" 1
99 1 14 PRO HG3 1 63 LEU MD1 . . 3.900 3.304 2.811 3.673 . 0 0 "[ . 1 . 2]" 1
100 1 14 PRO HG3 1 92 LEU MD1 . . 4.340 3.777 3.324 4.341 0.001 5 0 "[ . 1 . 2]" 1
101 1 14 PRO HG3 1 94 LEU MD1 . . 4.290 3.880 3.613 4.133 . 0 0 "[ . 1 . 2]" 1
102 1 14 PRO HG3 1 112 LEU HA . . 4.870 3.565 3.101 4.007 . 0 0 "[ . 1 . 2]" 1
103 1 14 PRO HG3 1 112 LEU HB3 . . 3.520 2.231 2.000 2.382 . 0 0 "[ . 1 . 2]" 1
104 1 14 PRO HG3 1 113 ASP H . . 4.230 3.846 3.410 4.230 0.000 12 0 "[ . 1 . 2]" 1
105 1 14 PRO HG3 1 114 GLN HA . . 4.910 4.639 4.047 4.913 0.003 8 0 "[ . 1 . 2]" 1
106 1 15 ARG H 1 15 ARG HB2 . . 3.730 2.795 2.264 3.281 . 0 0 "[ . 1 . 2]" 1
107 1 15 ARG H 1 15 ARG QB . . 3.250 2.382 2.232 2.589 . 0 0 "[ . 1 . 2]" 1
108 1 15 ARG H 1 15 ARG HB3 . . 3.730 2.865 2.298 3.644 . 0 0 "[ . 1 . 2]" 1
109 1 15 ARG H 1 15 ARG QD . . 4.880 4.409 3.601 4.817 . 0 0 "[ . 1 . 2]" 1
110 1 15 ARG H 1 15 ARG QG . . 4.470 3.751 2.903 4.150 . 0 0 "[ . 1 . 2]" 1
111 1 15 ARG H 1 92 LEU MD2 . . 4.550 3.864 3.382 4.442 . 0 0 "[ . 1 . 2]" 1
112 1 15 ARG H 1 93 VAL H . . 3.770 3.452 2.864 3.753 . 0 0 "[ . 1 . 2]" 1
113 1 15 ARG H 1 93 VAL MG2 . . 3.650 3.209 2.987 3.388 . 0 0 "[ . 1 . 2]" 1
114 1 15 ARG H 1 94 LEU MD1 . . 4.190 3.729 3.433 4.030 . 0 0 "[ . 1 . 2]" 1
115 1 15 ARG HA 1 15 ARG QG . . 3.670 2.518 2.291 3.085 . 0 0 "[ . 1 . 2]" 1
116 1 15 ARG HA 1 16 GLU H . . 2.870 2.171 2.141 2.289 . 0 0 "[ . 1 . 2]" 1
117 1 15 ARG QB 1 15 ARG QD . . 3.270 2.190 2.003 2.475 . 0 0 "[ . 1 . 2]" 1
118 1 15 ARG QB 1 93 VAL H . . 3.720 3.596 3.216 3.723 0.003 7 0 "[ . 1 . 2]" 1
119 1 15 ARG QB 1 93 VAL MG1 . . 5.130 4.527 4.192 4.751 . 0 0 "[ . 1 . 2]" 1
120 1 15 ARG QB 1 93 VAL MG2 . . 3.230 2.157 1.865 2.360 . 0 0 "[ . 1 . 2]" 1
121 1 15 ARG HB2 1 16 GLU H . . 4.530 4.243 4.007 4.517 . 0 0 "[ . 1 . 2]" 1
122 1 15 ARG HB2 1 93 VAL MG2 . . 3.890 3.172 2.010 3.808 . 0 0 "[ . 1 . 2]" 1
123 1 15 ARG HB3 1 16 GLU H . . 4.530 3.920 2.780 4.472 . 0 0 "[ . 1 . 2]" 1
124 1 15 ARG HB3 1 93 VAL MG2 . . 3.890 2.411 1.876 3.124 . 0 0 "[ . 1 . 2]" 1
125 1 15 ARG QD 1 93 VAL MG2 . . 4.080 3.255 2.541 4.080 0.000 17 0 "[ . 1 . 2]" 1
126 1 15 ARG HD2 1 93 VAL MG2 . . 4.800 3.955 2.584 4.795 . 0 0 "[ . 1 . 2]" 1
127 1 15 ARG HD3 1 93 VAL MG2 . . 4.800 3.819 2.582 4.796 . 0 0 "[ . 1 . 2]" 1
128 1 15 ARG HE 1 93 VAL MG2 . . 4.810 4.267 3.236 4.812 0.002 20 0 "[ . 1 . 2]" 1
129 1 15 ARG QG 1 93 VAL MG2 . . 4.500 3.381 2.401 4.090 . 0 0 "[ . 1 . 2]" 1
130 1 15 ARG HG2 1 16 GLU H . . 4.660 3.672 2.674 4.604 . 0 0 "[ . 1 . 2]" 1
131 1 15 ARG HG3 1 16 GLU H . . 4.660 3.651 2.458 4.629 . 0 0 "[ . 1 . 2]" 1
132 1 16 GLU H 1 16 GLU HB2 . . 3.360 2.707 2.464 2.958 . 0 0 "[ . 1 . 2]" 1
133 1 16 GLU H 1 16 GLU HB3 . . 3.360 2.549 2.208 2.806 . 0 0 "[ . 1 . 2]" 1
134 1 16 GLU H 1 16 GLU QG . . 4.610 4.024 3.959 4.115 . 0 0 "[ . 1 . 2]" 1
135 1 16 GLU H 1 92 LEU MD2 . . 4.210 3.605 3.162 3.922 . 0 0 "[ . 1 . 2]" 1
136 1 16 GLU QB 1 90 THR MG . . 4.470 3.857 3.416 4.145 . 0 0 "[ . 1 . 2]" 1
137 1 16 GLU HB2 1 92 LEU MD2 . . 3.930 2.420 2.018 2.731 . 0 0 "[ . 1 . 2]" 1
138 1 16 GLU HB3 1 92 LEU MD2 . . 3.930 3.760 3.488 3.930 . 0 0 "[ . 1 . 2]" 1
139 1 16 GLU QG 1 17 CYS H . . 3.390 2.472 2.010 3.084 . 0 0 "[ . 1 . 2]" 1
140 1 16 GLU QG 1 18 LYS QE . . 4.450 3.685 2.450 4.373 . 0 0 "[ . 1 . 2]" 1
141 1 16 GLU QG 1 18 LYS QG . . 4.620 3.284 2.815 4.119 . 0 0 "[ . 1 . 2]" 1
142 1 16 GLU QG 1 92 LEU HG . . 4.700 3.612 3.030 4.591 . 0 0 "[ . 1 . 2]" 1
143 1 16 GLU HG2 1 17 CYS H . . 4.010 2.734 2.026 3.768 . 0 0 "[ . 1 . 2]" 1
144 1 16 GLU HG2 1 90 THR MG . . 3.300 2.538 2.193 3.260 . 0 0 "[ . 1 . 2]" 1
145 1 16 GLU HG2 1 92 LEU MD2 . . 4.360 3.730 2.062 4.105 . 0 0 "[ . 1 . 2]" 1
146 1 16 GLU HG3 1 17 CYS H . . 4.010 3.275 2.032 3.994 . 0 0 "[ . 1 . 2]" 1
147 1 16 GLU HG3 1 90 THR MG . . 3.300 2.467 1.940 2.995 . 0 0 "[ . 1 . 2]" 1
148 1 16 GLU HG3 1 92 LEU MD2 . . 4.360 2.789 1.977 4.086 . 0 0 "[ . 1 . 2]" 1
149 1 17 CYS H 1 17 CYS QB . . 3.410 2.610 2.384 2.794 . 0 0 "[ . 1 . 2]" 1
150 1 17 CYS H 1 18 LYS H . . 4.650 4.294 4.058 4.524 . 0 0 "[ . 1 . 2]" 1
151 1 17 CYS H 1 90 THR MG . . 4.240 3.330 2.693 4.113 . 0 0 "[ . 1 . 2]" 1
152 1 17 CYS H 1 91 LEU H . . 4.010 2.919 2.525 3.353 . 0 0 "[ . 1 . 2]" 1
153 1 17 CYS H 1 91 LEU HB2 . . 4.530 3.967 3.473 4.379 . 0 0 "[ . 1 . 2]" 1
154 1 17 CYS H 1 92 LEU HA . . 4.130 3.677 3.447 3.947 . 0 0 "[ . 1 . 2]" 1
155 1 17 CYS H 1 92 LEU MD2 . . 4.240 3.851 3.574 4.166 . 0 0 "[ . 1 . 2]" 1
156 1 17 CYS QB 1 18 LYS H . . 3.880 3.157 2.811 3.874 . 0 0 "[ . 1 . 2]" 1
157 1 17 CYS QB 1 19 LEU MD1 . . 3.430 2.613 2.350 3.425 . 0 0 "[ . 1 . 2]" 1
158 1 17 CYS QB 1 54 ALA MB . . 3.360 2.282 1.929 3.100 . 0 0 "[ . 1 . 2]" 1
159 1 17 CYS QB 1 56 LEU MD1 . . 3.580 3.179 2.890 3.525 . 0 0 "[ . 1 . 2]" 1
160 1 17 CYS QB 1 56 LEU MD2 . . 4.780 4.395 3.791 4.768 . 0 0 "[ . 1 . 2]" 1
161 1 17 CYS QB 1 90 THR HA . . 5.410 4.718 3.717 5.274 . 0 0 "[ . 1 . 2]" 1
162 1 17 CYS QB 1 91 LEU H . . 4.460 3.336 2.284 3.928 . 0 0 "[ . 1 . 2]" 1
163 1 17 CYS QB 1 91 LEU HB2 . . 3.750 2.691 2.220 3.220 . 0 0 "[ . 1 . 2]" 1
164 1 17 CYS QB 1 91 LEU HB3 . . 4.720 4.247 3.800 4.704 . 0 0 "[ . 1 . 2]" 1
165 1 17 CYS QB 1 91 LEU MD1 . . 4.410 3.437 2.978 4.034 . 0 0 "[ . 1 . 2]" 1
166 1 17 CYS QB 1 91 LEU HG . . 5.240 4.329 3.335 5.028 . 0 0 "[ . 1 . 2]" 1
167 1 17 CYS QB 1 93 VAL MG1 . . 4.300 3.724 3.216 4.045 . 0 0 "[ . 1 . 2]" 1
168 1 17 CYS QB 1 93 VAL MG2 . . 4.620 3.882 2.710 4.581 . 0 0 "[ . 1 . 2]" 1
169 1 18 LYS H 1 18 LYS HB2 . . 3.630 2.389 2.268 2.510 . 0 0 "[ . 1 . 2]" 1
170 1 18 LYS H 1 18 LYS QB . . 3.100 2.356 2.242 2.467 . 0 0 "[ . 1 . 2]" 1
171 1 18 LYS H 1 18 LYS HB3 . . 3.630 3.593 3.524 3.635 0.005 12 0 "[ . 1 . 2]" 1
172 1 18 LYS H 1 18 LYS QG . . 3.680 3.208 2.771 3.531 . 0 0 "[ . 1 . 2]" 1
173 1 18 LYS H 1 19 LEU MD1 . . 4.600 3.928 3.359 4.330 . 0 0 "[ . 1 . 2]" 1
174 1 18 LYS H 1 54 ALA MB . . 4.120 3.129 2.012 3.833 . 0 0 "[ . 1 . 2]" 1
175 1 18 LYS QB 1 19 LEU H . . 4.150 3.566 3.209 3.759 . 0 0 "[ . 1 . 2]" 1
176 1 18 LYS QD 1 90 THR MG . . 4.810 4.281 2.934 4.727 . 0 0 "[ . 1 . 2]" 1
177 1 18 LYS QE 1 18 LYS QG . . 3.340 2.183 2.058 2.382 . 0 0 "[ . 1 . 2]" 1
178 1 18 LYS QE 1 90 THR MG . . 4.040 3.487 2.677 3.931 . 0 0 "[ . 1 . 2]" 1
179 1 18 LYS QG 1 19 LEU H . . 4.560 4.134 3.754 4.525 . 0 0 "[ . 1 . 2]" 1
180 1 18 LYS QG 1 90 THR HA . . 4.450 3.422 2.701 4.179 . 0 0 "[ . 1 . 2]" 1
181 1 18 LYS QG 1 90 THR MG . . 3.410 3.019 2.637 3.412 0.002 19 0 "[ . 1 . 2]" 1
182 1 19 LEU H 1 19 LEU QB . . 3.220 2.212 2.142 2.321 . 0 0 "[ . 1 . 2]" 1
183 1 19 LEU H 1 19 LEU MD1 . . 3.540 2.535 2.224 2.909 . 0 0 "[ . 1 . 2]" 1
184 1 19 LEU H 1 19 LEU HG . . 4.590 4.010 3.826 4.282 . 0 0 "[ . 1 . 2]" 1
185 1 19 LEU H 1 20 SER H . . 4.580 4.543 4.350 4.601 0.021 2 0 "[ . 1 . 2]" 1
186 1 19 LEU H 1 89 VAL H . . 3.910 3.134 2.747 3.433 . 0 0 "[ . 1 . 2]" 1
187 1 19 LEU H 1 89 VAL MG2 . . 5.210 4.871 4.515 5.174 . 0 0 "[ . 1 . 2]" 1
188 1 19 LEU H 1 90 THR HA . . 3.850 3.666 3.424 3.845 . 0 0 "[ . 1 . 2]" 1
189 1 19 LEU H 1 91 LEU H . . 5.080 4.608 3.925 5.029 . 0 0 "[ . 1 . 2]" 1
190 1 19 LEU QB 1 19 LEU MD1 . . 2.990 2.151 2.005 2.276 . 0 0 "[ . 1 . 2]" 1
191 1 19 LEU QB 1 19 LEU MD2 . . 3.080 2.048 1.969 2.099 . 0 0 "[ . 1 . 2]" 1
192 1 19 LEU QB 1 20 SER H . . 3.500 2.971 2.713 3.397 . 0 0 "[ . 1 . 2]" 1
193 1 19 LEU QB 1 20 SER HA . . 4.620 4.001 3.940 4.092 . 0 0 "[ . 1 . 2]" 1
194 1 19 LEU QB 1 27 TYR QB . . 5.230 4.236 3.952 4.575 . 0 0 "[ . 1 . 2]" 1
195 1 19 LEU QB 1 27 TYR QD . . 3.510 2.951 2.609 3.253 . 0 0 "[ . 1 . 2]" 1
196 1 19 LEU QB 1 27 TYR QE . . 3.570 2.320 2.002 2.758 . 0 0 "[ . 1 . 2]" 1
197 1 19 LEU QB 1 29 PHE QE . . 4.830 4.045 3.563 4.388 . 0 0 "[ . 1 . 2]" 1
198 1 19 LEU QB 1 50 PRO HB2 . . 5.000 4.185 3.836 4.589 . 0 0 "[ . 1 . 2]" 1
199 1 19 LEU QB 1 88 SER HA . . 5.430 4.377 3.758 4.718 . 0 0 "[ . 1 . 2]" 1
200 1 19 LEU QB 1 89 VAL H . . 3.950 3.207 2.662 3.766 . 0 0 "[ . 1 . 2]" 1
201 1 19 LEU QB 1 89 VAL MG2 . . 3.810 3.689 3.424 3.799 . 0 0 "[ . 1 . 2]" 1
202 1 19 LEU MD1 1 27 TYR QD . . 4.980 4.832 4.637 4.987 0.007 8 0 "[ . 1 . 2]" 1
203 1 19 LEU MD1 1 29 PHE QE . . 4.200 3.849 3.355 4.189 . 0 0 "[ . 1 . 2]" 1
204 1 19 LEU MD1 1 51 ALA HA . . 4.380 3.147 2.600 3.805 . 0 0 "[ . 1 . 2]" 1
205 1 19 LEU MD1 1 54 ALA MB . . 3.120 2.492 2.220 3.052 . 0 0 "[ . 1 . 2]" 1
206 1 19 LEU MD1 1 56 LEU H . . 5.500 5.072 4.410 5.393 . 0 0 "[ . 1 . 2]" 1
207 1 19 LEU MD1 1 56 LEU HB2 . . 4.150 3.599 3.084 3.959 . 0 0 "[ . 1 . 2]" 1
208 1 19 LEU MD1 1 56 LEU MD2 . . 3.530 2.909 2.478 3.475 . 0 0 "[ . 1 . 2]" 1
209 1 19 LEU MD2 1 20 SER H . . 4.530 4.237 4.009 4.511 . 0 0 "[ . 1 . 2]" 1
210 1 19 LEU MD2 1 27 TYR HA . . 4.720 4.007 3.499 4.445 . 0 0 "[ . 1 . 2]" 1
211 1 19 LEU MD2 1 27 TYR HB2 . . 4.190 3.790 3.449 4.087 . 0 0 "[ . 1 . 2]" 1
212 1 19 LEU MD2 1 27 TYR QB . . 3.500 2.547 2.191 2.883 . 0 0 "[ . 1 . 2]" 1
213 1 19 LEU MD2 1 27 TYR HB3 . . 4.190 2.590 2.215 2.947 . 0 0 "[ . 1 . 2]" 1
214 1 19 LEU MD2 1 27 TYR QD . . 3.710 2.547 2.177 2.821 . 0 0 "[ . 1 . 2]" 1
215 1 19 LEU MD2 1 27 TYR QE . . 4.800 3.400 3.002 3.797 . 0 0 "[ . 1 . 2]" 1
216 1 19 LEU MD2 1 29 PHE QD . . 4.100 2.659 2.257 2.968 . 0 0 "[ . 1 . 2]" 1
217 1 19 LEU MD2 1 29 PHE QE . . 3.590 2.129 1.979 2.392 . 0 0 "[ . 1 . 2]" 1
218 1 19 LEU MD2 1 50 PRO HB2 . . 4.790 3.963 3.531 4.499 . 0 0 "[ . 1 . 2]" 1
219 1 19 LEU MD2 1 50 PRO HG2 . . 5.270 3.828 3.201 4.456 . 0 0 "[ . 1 . 2]" 1
220 1 19 LEU MD2 1 51 ALA H . . 4.340 3.828 3.296 4.337 . 0 0 "[ . 1 . 2]" 1
221 1 19 LEU MD2 1 51 ALA HA . . 3.450 2.036 1.859 2.574 . 0 0 "[ . 1 . 2]" 1
222 1 19 LEU MD2 1 51 ALA MB . . 3.340 2.156 1.811 2.721 . 0 0 "[ . 1 . 2]" 1
223 1 19 LEU MD2 1 56 LEU MD2 . . 3.510 2.979 2.590 3.299 . 0 0 "[ . 1 . 2]" 1
224 1 19 LEU HG 1 50 PRO HB2 . . 5.500 4.136 3.593 4.815 . 0 0 "[ . 1 . 2]" 1
225 1 20 SER H 1 20 SER HB2 . . 3.990 3.679 2.604 3.907 . 0 0 "[ . 1 . 2]" 1
226 1 20 SER H 1 20 SER HB3 . . 3.990 3.185 2.719 3.748 . 0 0 "[ . 1 . 2]" 1
227 1 20 SER H 1 21 LYS H . . 4.660 4.256 4.106 4.356 . 0 0 "[ . 1 . 2]" 1
228 1 20 SER H 1 27 TYR QE . . 4.480 3.169 2.652 3.692 . 0 0 "[ . 1 . 2]" 1
229 1 20 SER H 1 50 PRO HB2 . . 4.560 3.021 2.502 3.508 . 0 0 "[ . 1 . 2]" 1
230 1 20 SER H 1 50 PRO HB3 . . 4.670 4.205 3.701 4.660 . 0 0 "[ . 1 . 2]" 1
231 1 20 SER HA 1 21 LYS H . . 2.950 2.155 2.138 2.192 . 0 0 "[ . 1 . 2]" 1
232 1 20 SER HA 1 27 TYR QE . . 3.820 3.038 2.723 3.318 . 0 0 "[ . 1 . 2]" 1
233 1 20 SER HA 1 87 ASN QB . . 5.130 4.182 3.599 4.692 . 0 0 "[ . 1 . 2]" 1
234 1 20 SER QB 1 27 TYR QE . . 4.680 4.519 4.301 4.680 0.000 10 0 "[ . 1 . 2]" 1
235 1 20 SER HB2 1 21 LYS H . . 4.350 3.502 3.057 4.295 . 0 0 "[ . 1 . 2]" 1
236 1 20 SER HB3 1 21 LYS H . . 4.350 4.165 3.288 4.351 0.001 7 0 "[ . 1 . 2]" 1
237 1 21 LYS H 1 21 LYS QD . . 4.570 4.258 1.754 4.571 0.001 3 0 "[ . 1 . 2]" 1
238 1 21 LYS H 1 21 LYS HG2 . . 3.830 2.665 2.250 3.248 . 0 0 "[ . 1 . 2]" 1
239 1 21 LYS H 1 21 LYS QG . . 3.350 2.540 2.208 3.085 . 0 0 "[ . 1 . 2]" 1
240 1 21 LYS H 1 21 LYS HG3 . . 3.830 3.251 2.859 3.848 0.018 13 0 "[ . 1 . 2]" 1
241 1 21 LYS H 1 22 GLN H . . 4.620 4.423 4.364 4.490 . 0 0 "[ . 1 . 2]" 1
242 1 21 LYS H 1 27 TYR QE . . 4.080 3.092 2.405 3.489 . 0 0 "[ . 1 . 2]" 1
243 1 21 LYS H 1 87 ASN HA . . 4.440 3.600 3.056 4.223 . 0 0 "[ . 1 . 2]" 1
244 1 21 LYS H 1 87 ASN HB2 . . 4.970 4.667 4.009 4.971 0.001 12 0 "[ . 1 . 2]" 1
245 1 21 LYS H 1 87 ASN QB . . 4.110 3.295 2.793 3.841 . 0 0 "[ . 1 . 2]" 1
246 1 21 LYS H 1 87 ASN HB3 . . 4.970 3.374 2.850 3.998 . 0 0 "[ . 1 . 2]" 1
247 1 21 LYS HA 1 22 GLN QG . . 4.670 3.791 3.348 4.607 . 0 0 "[ . 1 . 2]" 1
248 1 21 LYS HA 1 25 GLN QB . . 5.290 4.304 3.698 4.957 . 0 0 "[ . 1 . 2]" 1
249 1 21 LYS QB 1 22 GLN H . . 3.220 2.379 2.102 2.656 . 0 0 "[ . 1 . 2]" 1
250 1 21 LYS QB 1 25 GLN QB . . 4.100 2.972 2.120 3.729 . 0 0 "[ . 1 . 2]" 1
251 1 21 LYS QB 1 27 TYR HA . . 4.560 3.049 2.516 3.470 . 0 0 "[ . 1 . 2]" 1
252 1 21 LYS QB 1 27 TYR QD . . 4.330 2.713 2.417 3.043 . 0 0 "[ . 1 . 2]" 1
253 1 21 LYS QB 1 50 PRO HG3 . . 3.990 3.384 2.478 3.986 . 0 0 "[ . 1 . 2]" 1
254 1 21 LYS HB2 1 22 GLN H . . 3.990 2.404 2.116 2.698 . 0 0 "[ . 1 . 2]" 1
255 1 21 LYS HB2 1 50 PRO HG3 . . 4.560 4.008 2.958 4.563 0.003 10 0 "[ . 1 . 2]" 1
256 1 21 LYS HB3 1 22 GLN H . . 3.990 3.804 3.623 3.977 . 0 0 "[ . 1 . 2]" 1
257 1 21 LYS HB3 1 50 PRO HG3 . . 4.560 3.658 2.659 4.403 . 0 0 "[ . 1 . 2]" 1
258 1 21 LYS QD 1 27 TYR HA . . 4.480 3.457 2.956 4.478 . 0 0 "[ . 1 . 2]" 1
259 1 21 LYS QD 1 27 TYR QD . . 4.430 2.959 2.746 3.526 . 0 0 "[ . 1 . 2]" 1
260 1 21 LYS QD 1 27 TYR QE . . 3.850 2.857 2.345 3.280 . 0 0 "[ . 1 . 2]" 1
261 1 21 LYS QE 1 27 TYR QE . . 4.540 3.073 2.104 4.347 . 0 0 "[ . 1 . 2]" 1
262 1 21 LYS QE 1 87 ASN HA . . 4.080 3.623 2.253 4.081 0.001 19 0 "[ . 1 . 2]" 1
263 1 21 LYS QG 1 22 GLN H . . 4.280 3.222 2.677 3.777 . 0 0 "[ . 1 . 2]" 1
264 1 21 LYS QG 1 87 ASN QB . . 4.980 3.837 2.920 4.286 . 0 0 "[ . 1 . 2]" 1
265 1 21 LYS HG2 1 87 ASN HA . . 4.620 3.272 2.542 3.960 . 0 0 "[ . 1 . 2]" 1
266 1 21 LYS HG3 1 87 ASN HA . . 4.620 3.289 2.105 4.605 . 0 0 "[ . 1 . 2]" 1
267 1 22 GLN H 1 22 GLN HB2 . . 3.640 2.417 2.224 2.604 . 0 0 "[ . 1 . 2]" 1
268 1 22 GLN H 1 22 GLN QB . . 3.070 2.382 2.201 2.551 . 0 0 "[ . 1 . 2]" 1
269 1 22 GLN H 1 22 GLN HB3 . . 3.640 3.617 3.517 3.658 0.018 20 0 "[ . 1 . 2]" 1
270 1 22 GLN H 1 22 GLN QG . . 3.360 2.704 2.217 3.342 . 0 0 "[ . 1 . 2]" 1
271 1 22 GLN H 1 23 GLU H . . 4.590 4.560 4.516 4.587 . 0 0 "[ . 1 . 2]" 1
272 1 22 GLN H 1 25 GLN H . . 4.540 4.191 3.863 4.503 . 0 0 "[ . 1 . 2]" 1
273 1 22 GLN H 1 25 GLN QB . . 3.750 2.498 1.879 3.043 . 0 0 "[ . 1 . 2]" 1
274 1 22 GLN HA 1 22 GLN QG . . 3.740 2.547 2.225 3.038 . 0 0 "[ . 1 . 2]" 1
275 1 22 GLN HA 1 23 GLU H . . 3.020 2.386 2.224 2.557 . 0 0 "[ . 1 . 2]" 1
276 1 22 GLN QB 1 23 GLU H . . 3.300 2.462 2.083 2.855 . 0 0 "[ . 1 . 2]" 1
277 1 22 GLN QB 1 25 GLN H . . 4.670 3.472 3.087 4.136 . 0 0 "[ . 1 . 2]" 1
278 1 22 GLN QB 1 25 GLN QB . . 4.210 2.330 1.917 2.686 . 0 0 "[ . 1 . 2]" 1
279 1 22 GLN QB 1 25 GLN QG . . 4.470 3.647 2.786 4.387 . 0 0 "[ . 1 . 2]" 1
280 1 22 GLN HB2 1 23 GLU H . . 3.950 3.715 3.349 3.951 0.001 3 0 "[ . 1 . 2]" 1
281 1 22 GLN HB3 1 23 GLU H . . 3.950 2.502 2.100 2.930 . 0 0 "[ . 1 . 2]" 1
282 1 22 GLN QG 1 23 GLU H . . 4.620 3.943 3.316 4.551 . 0 0 "[ . 1 . 2]" 1
283 1 23 GLU H 1 23 GLU HB2 . . 3.700 2.952 2.171 3.594 . 0 0 "[ . 1 . 2]" 1
284 1 23 GLU H 1 23 GLU QB . . 3.080 2.365 2.120 2.798 . 0 0 "[ . 1 . 2]" 1
285 1 23 GLU H 1 23 GLU HB3 . . 3.700 2.813 2.214 3.615 . 0 0 "[ . 1 . 2]" 1
286 1 23 GLU H 1 23 GLU HG2 . . 4.490 3.307 1.914 4.510 0.020 8 0 "[ . 1 . 2]" 1
287 1 23 GLU H 1 23 GLU QG . . 3.760 2.899 1.865 3.809 0.049 8 0 "[ . 1 . 2]" 1
288 1 23 GLU H 1 23 GLU HG3 . . 4.490 3.518 2.193 4.412 . 0 0 "[ . 1 . 2]" 1
289 1 23 GLU H 1 25 GLN H . . 5.000 4.500 4.201 4.811 . 0 0 "[ . 1 . 2]" 1
290 1 23 GLU H 1 87 ASN QD . . 4.590 3.298 2.393 3.984 . 0 0 "[ . 1 . 2]" 1
291 1 23 GLU HA 1 23 GLU HG2 . . 4.180 3.292 2.189 3.942 . 0 0 "[ . 1 . 2]" 1
292 1 23 GLU HA 1 23 GLU QG . . 3.540 2.856 2.167 3.466 . 0 0 "[ . 1 . 2]" 1
293 1 23 GLU HA 1 23 GLU HG3 . . 4.180 3.324 2.390 4.242 0.062 2 0 "[ . 1 . 2]" 1
294 1 23 GLU HA 1 25 GLN H . . 4.350 3.868 3.570 4.053 . 0 0 "[ . 1 . 2]" 1
295 1 23 GLU HA 1 87 ASN HD21 . . 4.160 3.642 2.881 4.073 . 0 0 "[ . 1 . 2]" 1
296 1 23 GLU HA 1 87 ASN QD . . 3.580 3.096 1.971 3.536 . 0 0 "[ . 1 . 2]" 1
297 1 23 GLU HA 1 87 ASN HD22 . . 4.160 3.471 1.981 3.967 . 0 0 "[ . 1 . 2]" 1
298 1 23 GLU QB 1 87 ASN QD . . 3.560 3.008 2.402 3.537 . 0 0 "[ . 1 . 2]" 1
299 1 24 GLY H 1 25 GLN H . . 3.980 2.630 1.922 3.059 . 0 0 "[ . 1 . 2]" 1
300 1 25 GLN H 1 25 GLN HB2 . . 3.540 2.484 2.177 2.915 . 0 0 "[ . 1 . 2]" 1
301 1 25 GLN H 1 25 GLN QB . . 3.020 2.300 2.156 2.539 . 0 0 "[ . 1 . 2]" 1
302 1 25 GLN H 1 25 GLN HB3 . . 3.540 2.855 2.529 3.503 . 0 0 "[ . 1 . 2]" 1
303 1 25 GLN H 1 25 GLN QG . . 4.420 3.901 2.915 4.195 . 0 0 "[ . 1 . 2]" 1
304 1 25 GLN H 1 26 ASN H . . 5.410 4.572 4.389 4.630 . 0 0 "[ . 1 . 2]" 1
305 1 25 GLN HA 1 25 GLN QG . . 3.710 2.515 2.249 2.941 . 0 0 "[ . 1 . 2]" 1
306 1 25 GLN QB 1 26 ASN H . . 3.810 3.135 2.182 3.641 . 0 0 "[ . 1 . 2]" 1
307 1 25 GLN QE 1 26 ASN H . . 4.460 3.694 1.830 4.459 . 0 0 "[ . 1 . 2]" 1
308 1 25 GLN QG 1 26 ASN H . . 4.040 2.280 1.882 3.917 . 0 0 "[ . 1 . 2]" 1
309 1 25 GLN HG2 1 26 ASN H . . 4.650 3.000 1.911 4.412 . 0 0 "[ . 1 . 2]" 1
310 1 25 GLN HG3 1 26 ASN H . . 4.650 2.818 1.916 4.381 . 0 0 "[ . 1 . 2]" 1
311 1 26 ASN H 1 26 ASN QB . . 3.530 2.501 2.240 2.945 . 0 0 "[ . 1 . 2]" 1
312 1 26 ASN QB 1 28 GLY H . . 4.050 2.926 2.424 3.613 . 0 0 "[ . 1 . 2]" 1
313 1 26 ASN HB2 1 28 GLY H . . 4.900 3.830 2.439 4.900 . 0 0 "[ . 1 . 2]" 1
314 1 26 ASN HB3 1 28 GLY H . . 4.900 3.427 2.523 4.544 . 0 0 "[ . 1 . 2]" 1
315 1 27 TYR HA 1 27 TYR QD . . 3.440 2.294 2.011 2.568 . 0 0 "[ . 1 . 2]" 1
316 1 27 TYR HA 1 50 PRO HB2 . . 4.480 4.290 3.859 4.483 0.003 12 0 "[ . 1 . 2]" 1
317 1 27 TYR HA 1 50 PRO HB3 . . 5.370 5.096 4.799 5.288 . 0 0 "[ . 1 . 2]" 1
318 1 27 TYR HA 1 50 PRO HG2 . . 3.750 2.385 2.004 2.782 . 0 0 "[ . 1 . 2]" 1
319 1 27 TYR HA 1 50 PRO HG3 . . 4.030 3.206 2.823 3.443 . 0 0 "[ . 1 . 2]" 1
320 1 27 TYR HA 1 51 ALA MB . . 5.090 4.122 3.807 4.532 . 0 0 "[ . 1 . 2]" 1
321 1 27 TYR QB 1 28 GLY H . . 4.450 2.731 2.327 2.969 . 0 0 "[ . 1 . 2]" 1
322 1 27 TYR QB 1 29 PHE H . . 4.200 2.655 2.557 2.751 . 0 0 "[ . 1 . 2]" 1
323 1 27 TYR QB 1 29 PHE QD . . 3.810 2.127 1.951 2.411 . 0 0 "[ . 1 . 2]" 1
324 1 27 TYR QB 1 29 PHE QE . . 3.550 2.774 2.479 3.141 . 0 0 "[ . 1 . 2]" 1
325 1 27 TYR QB 1 51 ALA MB . . 4.320 2.626 2.117 2.999 . 0 0 "[ . 1 . 2]" 1
326 1 27 TYR HB2 1 28 GLY H . . 5.080 2.883 2.482 3.150 . 0 0 "[ . 1 . 2]" 1
327 1 27 TYR HB2 1 29 PHE H . . 4.900 3.233 2.995 3.348 . 0 0 "[ . 1 . 2]" 1
328 1 27 TYR HB2 1 29 PHE QE . . 4.150 3.422 2.973 3.928 . 0 0 "[ . 1 . 2]" 1
329 1 27 TYR HB3 1 28 GLY H . . 5.080 3.382 2.812 3.632 . 0 0 "[ . 1 . 2]" 1
330 1 27 TYR HB3 1 29 PHE H . . 4.900 2.829 2.686 2.955 . 0 0 "[ . 1 . 2]" 1
331 1 27 TYR HB3 1 29 PHE QE . . 4.150 2.951 2.578 3.313 . 0 0 "[ . 1 . 2]" 1
332 1 27 TYR QD 1 28 GLY H . . 5.020 4.603 4.351 4.741 . 0 0 "[ . 1 . 2]" 1
333 1 27 TYR QD 1 29 PHE QE . . 4.000 3.403 2.694 3.801 . 0 0 "[ . 1 . 2]" 1
334 1 27 TYR QD 1 50 PRO HB2 . . 4.400 3.170 2.930 3.372 . 0 0 "[ . 1 . 2]" 1
335 1 27 TYR QD 1 50 PRO HB3 . . 4.640 4.579 4.377 4.645 0.005 19 0 "[ . 1 . 2]" 1
336 1 27 TYR QD 1 50 PRO HG2 . . 3.830 2.571 2.265 2.873 . 0 0 "[ . 1 . 2]" 1
337 1 27 TYR QD 1 50 PRO HG3 . . 4.750 3.641 3.224 4.024 . 0 0 "[ . 1 . 2]" 1
338 1 27 TYR QD 1 51 ALA H . . 5.340 4.594 4.298 5.032 . 0 0 "[ . 1 . 2]" 1
339 1 27 TYR QD 1 82 VAL MG1 . . 4.010 3.288 2.777 3.692 . 0 0 "[ . 1 . 2]" 1
340 1 27 TYR QE 1 82 VAL MG1 . . 3.830 2.801 2.266 3.320 . 0 0 "[ . 1 . 2]" 1
341 1 27 TYR QE 1 89 VAL H . . 4.700 4.262 3.477 4.695 . 0 0 "[ . 1 . 2]" 1
342 1 27 TYR QE 1 89 VAL MG2 . . 3.950 2.543 1.977 3.193 . 0 0 "[ . 1 . 2]" 1
343 1 28 GLY H 1 29 PHE H . . 3.440 2.563 2.038 2.825 . 0 0 "[ . 1 . 2]" 1
344 1 28 GLY H 1 29 PHE QD . . 4.870 4.154 3.687 4.499 . 0 0 "[ . 1 . 2]" 1
345 1 28 GLY HA2 1 46 GLU QB . . 4.140 3.092 2.339 3.950 . 0 0 "[ . 1 . 2]" 1
346 1 28 GLY HA3 1 46 GLU QB . . 4.140 3.293 2.867 4.070 . 0 0 "[ . 1 . 2]" 1
347 1 29 PHE H 1 51 ALA H . . 4.850 4.831 4.762 4.854 0.004 12 0 "[ . 1 . 2]" 1
348 1 29 PHE H 1 51 ALA MB . . 4.580 2.626 2.331 2.786 . 0 0 "[ . 1 . 2]" 1
349 1 29 PHE HA 1 30 PHE H . . 3.290 2.315 2.225 2.508 . 0 0 "[ . 1 . 2]" 1
350 1 29 PHE HA 1 42 ILE MG . . 4.700 3.804 3.337 4.555 . 0 0 "[ . 1 . 2]" 1
351 1 29 PHE HA 1 45 ILE MD . . 5.470 5.054 4.647 5.402 . 0 0 "[ . 1 . 2]" 1
352 1 29 PHE HB2 1 30 PHE H . . 3.650 2.827 2.475 3.048 . 0 0 "[ . 1 . 2]" 1
353 1 29 PHE HB2 1 42 ILE MG . . 3.630 2.215 1.881 2.853 . 0 0 "[ . 1 . 2]" 1
354 1 29 PHE HB2 1 43 ARG H . . 4.950 4.532 3.841 4.949 . 0 0 "[ . 1 . 2]" 1
355 1 29 PHE HB2 1 45 ILE MD . . 4.440 3.986 3.579 4.435 . 0 0 "[ . 1 . 2]" 1
356 1 29 PHE HB2 1 45 ILE HG12 . . 4.690 2.735 2.256 3.230 . 0 0 "[ . 1 . 2]" 1
357 1 29 PHE HB2 1 51 ALA MB . . 4.160 3.332 3.173 3.711 . 0 0 "[ . 1 . 2]" 1
358 1 29 PHE HB3 1 30 PHE H . . 4.230 4.095 3.849 4.229 . 0 0 "[ . 1 . 2]" 1
359 1 29 PHE HB3 1 42 ILE MG . . 4.250 3.418 3.008 3.948 . 0 0 "[ . 1 . 2]" 1
360 1 29 PHE HB3 1 45 ILE HG12 . . 4.430 3.217 2.862 3.664 . 0 0 "[ . 1 . 2]" 1
361 1 29 PHE HB3 1 45 ILE HG13 . . 5.170 4.708 4.367 5.061 . 0 0 "[ . 1 . 2]" 1
362 1 29 PHE HB3 1 45 ILE MG . . 4.660 3.561 2.959 4.264 . 0 0 "[ . 1 . 2]" 1
363 1 29 PHE HB3 1 51 ALA MB . . 3.690 1.982 1.828 2.293 . 0 0 "[ . 1 . 2]" 1
364 1 29 PHE HB3 1 56 LEU MD2 . . 4.740 2.996 2.407 3.735 . 0 0 "[ . 1 . 2]" 1
365 1 29 PHE QD 1 30 PHE H . . 4.350 3.226 2.662 3.780 . 0 0 "[ . 1 . 2]" 1
366 1 29 PHE QD 1 31 LEU MD2 . . 4.350 3.853 3.387 4.321 . 0 0 "[ . 1 . 2]" 1
367 1 29 PHE QD 1 31 LEU HG . . 4.490 4.023 3.467 4.427 . 0 0 "[ . 1 . 2]" 1
368 1 29 PHE QD 1 42 ILE HA . . 4.590 3.583 2.878 4.122 . 0 0 "[ . 1 . 2]" 1
369 1 29 PHE QD 1 42 ILE MD . . 4.010 3.708 2.831 3.985 . 0 0 "[ . 1 . 2]" 1
370 1 29 PHE QD 1 42 ILE QG . . 4.320 2.453 2.006 3.180 . 0 0 "[ . 1 . 2]" 1
371 1 29 PHE QD 1 42 ILE MG . . 3.760 2.023 1.874 2.293 . 0 0 "[ . 1 . 2]" 1
372 1 29 PHE QD 1 43 ARG H . . 4.860 4.200 3.480 4.703 . 0 0 "[ . 1 . 2]" 1
373 1 29 PHE QD 1 51 ALA MB . . 3.370 1.996 1.861 2.333 . 0 0 "[ . 1 . 2]" 1
374 1 29 PHE QD 1 56 LEU MD2 . . 4.410 2.969 2.494 3.647 . 0 0 "[ . 1 . 2]" 1
375 1 29 PHE QE 1 31 LEU QB . . 5.140 4.624 4.312 5.096 . 0 0 "[ . 1 . 2]" 1
376 1 29 PHE QE 1 31 LEU MD2 . . 3.660 2.518 1.929 3.064 . 0 0 "[ . 1 . 2]" 1
377 1 29 PHE QE 1 31 LEU HG . . 3.830 2.711 2.201 3.331 . 0 0 "[ . 1 . 2]" 1
378 1 29 PHE QE 1 42 ILE MD . . 3.950 3.585 3.029 3.857 . 0 0 "[ . 1 . 2]" 1
379 1 29 PHE QE 1 42 ILE MG . . 4.520 3.683 2.853 4.012 . 0 0 "[ . 1 . 2]" 1
380 1 29 PHE QE 1 51 ALA MB . . 4.280 3.567 3.226 4.030 . 0 0 "[ . 1 . 2]" 1
381 1 29 PHE QE 1 56 LEU MD2 . . 4.520 3.537 3.155 4.419 . 0 0 "[ . 1 . 2]" 1
382 1 29 PHE QE 1 82 VAL MG1 . . 4.050 3.750 3.031 4.045 . 0 0 "[ . 1 . 2]" 1
383 1 29 PHE QE 1 89 VAL MG2 . . 5.500 5.056 4.465 5.469 . 0 0 "[ . 1 . 2]" 1
384 1 29 PHE QE 1 91 LEU MD1 . . 4.380 3.016 2.798 3.265 . 0 0 "[ . 1 . 2]" 1
385 1 29 PHE QE 1 91 LEU MD2 . . 5.090 3.997 3.614 4.449 . 0 0 "[ . 1 . 2]" 1
386 1 29 PHE HZ 1 31 LEU MD1 . . 4.720 3.881 3.213 4.666 . 0 0 "[ . 1 . 2]" 1
387 1 29 PHE HZ 1 31 LEU MD2 . . 5.040 4.040 3.177 4.620 . 0 0 "[ . 1 . 2]" 1
388 1 29 PHE HZ 1 82 VAL MG1 . . 4.740 3.409 2.796 4.274 . 0 0 "[ . 1 . 2]" 1
389 1 29 PHE HZ 1 82 VAL MG2 . . 4.000 3.661 3.177 4.004 0.004 19 0 "[ . 1 . 2]" 1
390 1 29 PHE HZ 1 91 LEU MD1 . . 3.890 2.447 2.018 2.775 . 0 0 "[ . 1 . 2]" 1
391 1 29 PHE HZ 1 91 LEU MD2 . . 4.690 3.335 2.908 3.881 . 0 0 "[ . 1 . 2]" 1
392 1 30 PHE H 1 30 PHE HB2 . . 3.960 2.676 2.466 2.863 . 0 0 "[ . 1 . 2]" 1
393 1 30 PHE H 1 30 PHE QB . . 3.430 2.624 2.429 2.789 . 0 0 "[ . 1 . 2]" 1
394 1 30 PHE H 1 30 PHE HB3 . . 3.960 3.791 3.644 3.901 . 0 0 "[ . 1 . 2]" 1
395 1 30 PHE H 1 30 PHE QD . . 4.590 3.341 2.794 3.722 . 0 0 "[ . 1 . 2]" 1
396 1 30 PHE H 1 42 ILE HA . . 4.710 4.536 4.163 4.711 0.001 20 0 "[ . 1 . 2]" 1
397 1 30 PHE H 1 42 ILE MG . . 4.430 3.196 2.649 3.793 . 0 0 "[ . 1 . 2]" 1
398 1 30 PHE H 1 44 VAL HB . . 4.580 3.419 2.879 3.800 . 0 0 "[ . 1 . 2]" 1
399 1 30 PHE HA 1 30 PHE QD . . 4.050 2.574 2.311 2.992 . 0 0 "[ . 1 . 2]" 1
400 1 30 PHE HA 1 30 PHE QE . . 4.660 4.510 4.335 4.637 . 0 0 "[ . 1 . 2]" 1
401 1 30 PHE HA 1 31 LEU H . . 3.190 2.294 2.176 2.409 . 0 0 "[ . 1 . 2]" 1
402 1 30 PHE HA 1 31 LEU HG . . 5.340 3.977 3.533 4.429 . 0 0 "[ . 1 . 2]" 1
403 1 30 PHE QB 1 31 LEU H . . 3.630 2.689 2.392 3.047 . 0 0 "[ . 1 . 2]" 1
404 1 30 PHE QB 1 32 ARG QG . . 4.220 3.229 2.763 4.228 0.008 8 0 "[ . 1 . 2]" 1
405 1 30 PHE QB 1 43 ARG H . . 4.560 4.149 3.577 4.476 . 0 0 "[ . 1 . 2]" 1
406 1 30 PHE QB 1 43 ARG QB . . 4.950 4.526 3.870 4.951 0.001 10 0 "[ . 1 . 2]" 1
407 1 30 PHE QB 1 44 VAL HB . . 4.420 2.967 2.558 3.604 . 0 0 "[ . 1 . 2]" 1
408 1 30 PHE QB 1 44 VAL MG1 . . 4.630 3.910 3.558 4.429 . 0 0 "[ . 1 . 2]" 1
409 1 30 PHE QB 1 44 VAL MG2 . . 4.300 3.193 2.738 3.811 . 0 0 "[ . 1 . 2]" 1
410 1 30 PHE HB2 1 31 LEU H . . 4.360 3.863 3.548 4.178 . 0 0 "[ . 1 . 2]" 1
411 1 30 PHE HB3 1 31 LEU H . . 4.360 2.747 2.422 3.137 . 0 0 "[ . 1 . 2]" 1
412 1 30 PHE QD 1 31 LEU H . . 4.690 3.672 3.028 4.206 . 0 0 "[ . 1 . 2]" 1
413 1 30 PHE QD 1 44 VAL HB . . 3.980 2.161 2.006 2.527 . 0 0 "[ . 1 . 2]" 1
414 1 30 PHE QD 1 44 VAL MG1 . . 4.140 2.420 2.056 2.746 . 0 0 "[ . 1 . 2]" 1
415 1 30 PHE QD 1 44 VAL MG2 . . 4.020 3.131 2.270 3.503 . 0 0 "[ . 1 . 2]" 1
416 1 30 PHE QE 1 44 VAL HB . . 4.490 4.001 2.991 4.450 . 0 0 "[ . 1 . 2]" 1
417 1 30 PHE QE 1 44 VAL MG1 . . 4.500 2.691 1.965 3.074 . 0 0 "[ . 1 . 2]" 1
418 1 30 PHE QE 1 44 VAL MG2 . . 4.930 4.548 3.673 4.932 0.002 4 0 "[ . 1 . 2]" 1
419 1 31 LEU H 1 31 LEU HB2 . . 3.720 2.373 2.205 2.579 . 0 0 "[ . 1 . 2]" 1
420 1 31 LEU H 1 31 LEU HB3 . . 3.720 3.593 3.485 3.728 0.008 12 0 "[ . 1 . 2]" 1
421 1 31 LEU H 1 31 LEU MD1 . . 4.520 3.583 3.218 3.950 . 0 0 "[ . 1 . 2]" 1
422 1 31 LEU H 1 31 LEU MD2 . . 5.020 4.006 3.731 4.358 . 0 0 "[ . 1 . 2]" 1
423 1 31 LEU H 1 31 LEU HG . . 4.020 2.883 2.409 3.558 . 0 0 "[ . 1 . 2]" 1
424 1 31 LEU H 1 32 ARG H . . 4.890 4.326 4.142 4.523 . 0 0 "[ . 1 . 2]" 1
425 1 31 LEU HA 1 31 LEU MD2 . . 3.510 2.305 1.973 2.544 . 0 0 "[ . 1 . 2]" 1
426 1 31 LEU HA 1 31 LEU HG . . 4.150 2.791 2.594 2.948 . 0 0 "[ . 1 . 2]" 1
427 1 31 LEU HA 1 32 ARG H . . 3.210 2.157 2.139 2.211 . 0 0 "[ . 1 . 2]" 1
428 1 31 LEU HA 1 42 ILE HA . . 4.370 3.217 2.382 3.620 . 0 0 "[ . 1 . 2]" 1
429 1 31 LEU HA 1 43 ARG H . . 4.560 4.122 3.127 4.509 . 0 0 "[ . 1 . 2]" 1
430 1 31 LEU QB 1 75 HIS HE1 . . 3.910 2.527 2.061 3.359 . 0 0 "[ . 1 . 2]" 1
431 1 31 LEU HB2 1 75 HIS HE1 . . 4.560 2.581 2.073 3.464 . 0 0 "[ . 1 . 2]" 1
432 1 31 LEU HB3 1 75 HIS HE1 . . 4.560 3.818 3.059 4.547 . 0 0 "[ . 1 . 2]" 1
433 1 31 LEU MD1 1 75 HIS HE1 . . 4.130 3.415 2.690 4.075 . 0 0 "[ . 1 . 2]" 1
434 1 31 LEU MD2 1 32 ARG H . . 4.170 3.660 3.205 4.129 . 0 0 "[ . 1 . 2]" 1
435 1 31 LEU MD2 1 40 HIS HA . . 5.350 4.425 3.777 4.987 . 0 0 "[ . 1 . 2]" 1
436 1 31 LEU MD2 1 40 HIS HB2 . . 4.370 3.054 2.650 3.544 . 0 0 "[ . 1 . 2]" 1
437 1 31 LEU MD2 1 40 HIS QB . . 3.680 2.182 1.837 2.588 . 0 0 "[ . 1 . 2]" 1
438 1 31 LEU MD2 1 40 HIS HB3 . . 4.370 2.240 1.861 2.741 . 0 0 "[ . 1 . 2]" 1
439 1 31 LEU MD2 1 41 LEU H . . 5.350 4.511 3.914 5.259 . 0 0 "[ . 1 . 2]" 1
440 1 31 LEU MD2 1 41 LEU HA . . 5.500 5.064 4.436 5.460 . 0 0 "[ . 1 . 2]" 1
441 1 31 LEU MD2 1 42 ILE H . . 5.160 4.903 4.003 5.160 . 14 0 "[ . 1 . 2]" 1
442 1 31 LEU MD2 1 42 ILE HA . . 4.280 3.738 2.718 4.267 . 0 0 "[ . 1 . 2]" 1
443 1 31 LEU MD2 1 62 VAL H . . 5.500 4.521 4.020 5.045 . 0 0 "[ . 1 . 2]" 1
444 1 32 ARG H 1 32 ARG QB . . 3.620 2.522 2.243 3.092 . 0 0 "[ . 1 . 2]" 1
445 1 32 ARG H 1 32 ARG HG2 . . 4.340 3.127 2.674 3.985 . 0 0 "[ . 1 . 2]" 1
446 1 32 ARG H 1 32 ARG QG . . 3.720 2.903 2.204 3.312 . 0 0 "[ . 1 . 2]" 1
447 1 32 ARG H 1 32 ARG HG3 . . 4.340 3.802 2.227 4.262 . 0 0 "[ . 1 . 2]" 1
448 1 32 ARG H 1 41 LEU H . . 4.520 4.083 3.342 4.437 . 0 0 "[ . 1 . 2]" 1
449 1 32 ARG H 1 42 ILE HA . . 4.840 3.375 2.856 4.068 . 0 0 "[ . 1 . 2]" 1
450 1 32 ARG H 1 43 ARG H . . 4.780 3.828 3.025 4.462 . 0 0 "[ . 1 . 2]" 1
451 1 32 ARG QB 1 33 ILE H . . 3.560 2.755 2.156 3.236 . 0 0 "[ . 1 . 2]" 1
452 1 32 ARG QB 1 43 ARG QD . . 4.520 3.960 2.948 4.520 . 0 0 "[ . 1 . 2]" 1
453 1 32 ARG QD 1 33 ILE H . . 4.550 3.531 2.877 4.541 . 0 0 "[ . 1 . 2]" 1
454 1 32 ARG QG 1 43 ARG QB . . 3.370 2.549 1.976 3.372 0.002 11 0 "[ . 1 . 2]" 1
455 1 32 ARG QG 1 43 ARG QD . . 5.010 3.765 1.938 4.990 . 0 0 "[ . 1 . 2]" 1
456 1 32 ARG QG 1 43 ARG HE . . 4.870 4.362 3.513 4.874 0.004 12 0 "[ . 1 . 2]" 1
457 1 32 ARG QG 1 44 VAL HB . . 5.340 4.797 4.141 5.331 . 0 0 "[ . 1 . 2]" 1
458 1 32 ARG QG 1 44 VAL MG2 . . 4.120 3.185 2.621 3.677 . 0 0 "[ . 1 . 2]" 1
459 1 33 ILE H 1 33 ILE HB . . 4.020 3.731 3.568 3.840 . 0 0 "[ . 1 . 2]" 1
460 1 33 ILE H 1 33 ILE MD . . 3.970 3.608 3.043 3.961 . 0 0 "[ . 1 . 2]" 1
461 1 33 ILE H 1 33 ILE HG12 . . 4.160 2.717 1.956 3.632 . 0 0 "[ . 1 . 2]" 1
462 1 33 ILE H 1 33 ILE QG . . 3.510 2.036 1.850 2.271 . 0 0 "[ . 1 . 2]" 1
463 1 33 ILE H 1 33 ILE HG13 . . 4.160 2.370 1.918 2.892 . 0 0 "[ . 1 . 2]" 1
464 1 33 ILE H 1 33 ILE MG . . 4.250 2.851 2.508 3.204 . 0 0 "[ . 1 . 2]" 1
465 1 33 ILE H 1 34 GLU H . . 4.830 4.490 4.358 4.570 . 0 0 "[ . 1 . 2]" 1
466 1 33 ILE HA 1 33 ILE MD . . 4.230 3.944 3.546 4.181 . 0 0 "[ . 1 . 2]" 1
467 1 33 ILE HA 1 33 ILE MG . . 3.610 2.247 2.061 2.384 . 0 0 "[ . 1 . 2]" 1
468 1 33 ILE HA 1 34 GLU H . . 3.140 2.254 2.163 2.357 . 0 0 "[ . 1 . 2]" 1
469 1 33 ILE HA 1 41 LEU MD1 . . 4.260 3.696 3.122 4.261 0.001 1 0 "[ . 1 . 2]" 1
470 1 33 ILE HB 1 33 ILE MD . . 3.570 2.234 2.106 2.378 . 0 0 "[ . 1 . 2]" 1
471 1 33 ILE HB 1 34 GLU H . . 4.220 2.809 2.510 3.172 . 0 0 "[ . 1 . 2]" 1
472 1 33 ILE MD 1 34 GLU H . . 4.830 4.033 3.037 4.831 0.001 12 0 "[ . 1 . 2]" 1
473 1 33 ILE MD 1 75 HIS HB2 . . 4.830 4.314 3.479 4.827 . 0 0 "[ . 1 . 2]" 1
474 1 33 ILE QG 1 34 GLU H . . 4.720 4.093 3.713 4.428 . 0 0 "[ . 1 . 2]" 1
475 1 33 ILE MG 1 34 GLU H . . 4.180 3.741 3.255 3.978 . 0 0 "[ . 1 . 2]" 1
476 1 33 ILE MG 1 40 HIS HA . . 4.430 3.388 2.732 4.111 . 0 0 "[ . 1 . 2]" 1
477 1 33 ILE MG 1 40 HIS HE1 . . 4.470 2.543 1.889 3.686 . 0 0 "[ . 1 . 2]" 1
478 1 33 ILE MG 1 41 LEU H . . 4.440 4.010 2.757 4.398 . 0 0 "[ . 1 . 2]" 1
479 1 33 ILE MG 1 75 HIS HA . . 4.570 3.985 3.243 4.567 . 0 0 "[ . 1 . 2]" 1
480 1 33 ILE MG 1 75 HIS HB2 . . 3.970 2.567 1.946 3.059 . 0 0 "[ . 1 . 2]" 1
481 1 33 ILE MG 1 75 HIS HB3 . . 4.300 3.798 3.174 4.202 . 0 0 "[ . 1 . 2]" 1
482 1 34 GLU H 1 34 GLU HB2 . . 4.080 2.675 2.306 3.052 . 0 0 "[ . 1 . 2]" 1
483 1 34 GLU H 1 34 GLU QB . . 3.490 2.471 2.277 2.595 . 0 0 "[ . 1 . 2]" 1
484 1 34 GLU H 1 34 GLU HB3 . . 4.080 3.210 2.640 3.775 . 0 0 "[ . 1 . 2]" 1
485 1 34 GLU H 1 34 GLU QG . . 4.520 3.694 2.908 4.269 . 0 0 "[ . 1 . 2]" 1
486 1 34 GLU H 1 35 LYS H . . 4.810 4.465 4.306 4.551 . 0 0 "[ . 1 . 2]" 1
487 1 34 GLU H 1 37 THR HB . . 4.610 3.358 2.838 4.362 . 0 0 "[ . 1 . 2]" 1
488 1 34 GLU H 1 41 LEU MD1 . . 4.280 3.292 2.422 3.946 . 0 0 "[ . 1 . 2]" 1
489 1 34 GLU HA 1 34 GLU HG2 . . 4.190 3.007 2.249 3.796 . 0 0 "[ . 1 . 2]" 1
490 1 34 GLU HA 1 34 GLU QG . . 3.620 2.555 2.195 2.914 . 0 0 "[ . 1 . 2]" 1
491 1 34 GLU HA 1 34 GLU HG3 . . 4.190 3.094 2.431 3.764 . 0 0 "[ . 1 . 2]" 1
492 1 34 GLU QB 1 35 LYS H . . 3.920 3.004 2.339 3.740 . 0 0 "[ . 1 . 2]" 1
493 1 34 GLU QB 1 37 THR H . . 4.920 4.455 4.151 4.914 . 0 0 "[ . 1 . 2]" 1
494 1 34 GLU QB 1 37 THR HB . . 3.790 2.404 2.019 3.407 . 0 0 "[ . 1 . 2]" 1
495 1 34 GLU QB 1 41 LEU MD1 . . 3.530 2.529 1.759 3.338 . 0 0 "[ . 1 . 2]" 1
496 1 34 GLU HB2 1 35 LYS H . . 4.540 4.000 3.713 4.381 . 0 0 "[ . 1 . 2]" 1
497 1 34 GLU HB2 1 37 THR HB . . 4.420 3.250 2.080 4.263 . 0 0 "[ . 1 . 2]" 1
498 1 34 GLU HB2 1 37 THR MG . . 4.560 3.249 2.064 4.085 . 0 0 "[ . 1 . 2]" 1
499 1 34 GLU HB3 1 35 LYS H . . 4.540 3.158 2.364 4.110 . 0 0 "[ . 1 . 2]" 1
500 1 34 GLU HB3 1 37 THR HB . . 4.420 2.903 2.029 4.333 . 0 0 "[ . 1 . 2]" 1
501 1 34 GLU HB3 1 37 THR MG . . 4.560 3.187 1.971 4.336 . 0 0 "[ . 1 . 2]" 1
502 1 34 GLU QG 1 35 LYS H . . 4.660 3.093 1.835 4.306 . 0 0 "[ . 1 . 2]" 1
503 1 34 GLU QG 1 37 THR MG . . 4.880 3.764 3.020 4.469 . 0 0 "[ . 1 . 2]" 1
504 1 34 GLU QG 1 41 LEU MD1 . . 4.180 3.304 1.895 3.977 . 0 0 "[ . 1 . 2]" 1
505 1 34 GLU HG2 1 41 LEU MD1 . . 5.040 3.936 2.346 4.986 . 0 0 "[ . 1 . 2]" 1
506 1 34 GLU HG3 1 41 LEU MD1 . . 5.040 3.826 2.000 4.997 . 0 0 "[ . 1 . 2]" 1
507 1 35 LYS H 1 35 LYS HB2 . . 4.200 2.585 2.218 3.630 . 0 0 "[ . 1 . 2]" 1
508 1 35 LYS H 1 35 LYS QB . . 3.650 2.281 2.173 2.611 . 0 0 "[ . 1 . 2]" 1
509 1 35 LYS H 1 35 LYS HB3 . . 4.200 3.004 2.366 3.573 . 0 0 "[ . 1 . 2]" 1
510 1 35 LYS H 1 36 ASP H . . 5.200 4.581 4.460 4.639 . 0 0 "[ . 1 . 2]" 1
511 1 35 LYS HA 1 35 LYS QD . . 4.180 3.305 2.098 4.203 0.023 13 0 "[ . 1 . 2]" 1
512 1 35 LYS HA 1 35 LYS QG . . 3.690 2.565 2.179 3.395 . 0 0 "[ . 1 . 2]" 1
513 1 35 LYS HA 1 36 ASP H . . 3.520 2.204 2.139 2.285 . 0 0 "[ . 1 . 2]" 1
514 1 35 LYS HA 1 37 THR H . . 4.500 3.785 3.584 4.089 . 0 0 "[ . 1 . 2]" 1
515 1 35 LYS QB 1 35 LYS QE . . 3.950 2.874 2.009 3.707 . 0 0 "[ . 1 . 2]" 1
516 1 35 LYS QB 1 37 THR H . . 5.340 5.062 4.846 5.313 . 0 0 "[ . 1 . 2]" 1
517 1 35 LYS QE 1 35 LYS QG . . 3.460 2.254 2.097 2.570 . 0 0 "[ . 1 . 2]" 1
518 1 35 LYS QG 1 36 ASP H . . 4.830 3.306 2.221 4.424 . 0 0 "[ . 1 . 2]" 1
519 1 35 LYS HG2 1 36 ASP H . . 5.500 4.047 2.249 5.199 . 0 0 "[ . 1 . 2]" 1
520 1 35 LYS HG3 1 36 ASP H . . 5.500 3.814 2.263 5.225 . 0 0 "[ . 1 . 2]" 1
521 1 36 ASP H 1 37 THR H . . 3.640 2.802 2.589 3.050 . 0 0 "[ . 1 . 2]" 1
522 1 36 ASP HA 1 37 THR H . . 3.460 2.738 2.649 2.814 . 0 0 "[ . 1 . 2]" 1
523 1 36 ASP QB 1 37 THR H . . 4.400 3.896 3.845 4.041 . 0 0 "[ . 1 . 2]" 1
524 1 36 ASP QB 1 37 THR HA . . 4.740 4.394 4.254 4.616 . 0 0 "[ . 1 . 2]" 1
525 1 37 THR H 1 37 THR HB . . 3.530 2.937 2.780 3.575 0.045 20 0 "[ . 1 . 2]" 1
526 1 37 THR H 1 37 THR MG . . 3.960 3.771 2.422 3.999 0.039 14 0 "[ . 1 . 2]" 1
527 1 37 THR HA 1 37 THR MG . . 3.330 2.362 2.169 3.181 . 0 0 "[ . 1 . 2]" 1
528 1 37 THR HA 1 38 ASP QB . . 4.740 4.229 3.918 4.604 . 0 0 "[ . 1 . 2]" 1
529 1 37 THR HB 1 38 ASP H . . 5.100 3.810 2.087 4.275 . 0 0 "[ . 1 . 2]" 1
530 1 37 THR HB 1 41 LEU MD1 . . 4.680 3.357 2.868 3.769 . 0 0 "[ . 1 . 2]" 1
531 1 37 THR MG 1 38 ASP H . . 3.940 2.303 1.922 3.487 . 0 0 "[ . 1 . 2]" 1
532 1 37 THR MG 1 41 LEU MD1 . . 3.270 2.036 1.754 2.471 . 0 0 "[ . 1 . 2]" 1
533 1 37 THR MG 1 41 LEU MD2 . . 3.580 3.021 2.219 3.571 . 0 0 "[ . 1 . 2]" 1
534 1 37 THR MG 1 61 ARG QH1 . . 5.100 4.206 2.055 5.037 . 0 0 "[ . 1 . 2]" 1
535 1 37 THR MG 1 61 ARG QH2 . . 4.070 2.963 2.001 4.072 0.002 20 0 "[ . 1 . 2]" 1
536 1 38 ASP QB 1 99 TYR QE . . 3.310 2.480 1.991 3.299 . 0 0 "[ . 1 . 2]" 1
537 1 38 ASP QB 1 103 VAL QG . . 3.990 3.297 2.556 3.753 . 0 0 "[ . 1 . 2]" 1
538 1 38 ASP HB2 1 39 GLY H . . 4.290 3.913 2.705 4.293 0.003 17 0 "[ . 1 . 2]" 1
539 1 38 ASP HB2 1 99 TYR QE . . 3.810 3.005 2.133 3.698 . 0 0 "[ . 1 . 2]" 1
540 1 38 ASP HB2 1 103 VAL MG1 . . 6.410 4.578 3.484 5.338 . 0 0 "[ . 1 . 2]" 1
541 1 38 ASP HB2 1 103 VAL MG2 . . 6.410 3.839 2.767 4.427 . 0 0 "[ . 1 . 2]" 1
542 1 38 ASP HB3 1 39 GLY H . . 4.290 3.180 2.354 4.170 . 0 0 "[ . 1 . 2]" 1
543 1 38 ASP HB3 1 99 TYR QE . . 3.810 3.005 2.006 3.795 . 0 0 "[ . 1 . 2]" 1
544 1 38 ASP HB3 1 103 VAL MG1 . . 6.410 5.127 4.128 5.871 . 0 0 "[ . 1 . 2]" 1
545 1 38 ASP HB3 1 103 VAL MG2 . . 6.410 4.033 3.158 4.807 . 0 0 "[ . 1 . 2]" 1
546 1 39 GLY H 1 40 HIS H . . 4.600 4.456 4.177 4.620 0.020 1 0 "[ . 1 . 2]" 1
547 1 39 GLY QA 1 61 ARG QG . . 3.770 2.848 1.858 3.762 . 0 0 "[ . 1 . 2]" 1
548 1 40 HIS H 1 40 HIS HB2 . . 3.960 2.339 2.218 2.560 . 0 0 "[ . 1 . 2]" 1
549 1 40 HIS H 1 40 HIS QB . . 3.430 2.310 2.194 2.512 . 0 0 "[ . 1 . 2]" 1
550 1 40 HIS H 1 40 HIS HB3 . . 3.960 3.579 3.497 3.660 . 0 0 "[ . 1 . 2]" 1
551 1 40 HIS H 1 40 HIS HD2 . . 4.680 3.375 2.831 4.094 . 0 0 "[ . 1 . 2]" 1
552 1 40 HIS H 1 61 ARG QG . . 4.520 3.708 2.004 4.517 . 0 0 "[ . 1 . 2]" 1
553 1 40 HIS H 1 62 VAL H . . 4.810 3.087 2.828 3.528 . 0 0 "[ . 1 . 2]" 1
554 1 40 HIS HA 1 41 LEU H . . 3.280 2.183 2.141 2.292 . 0 0 "[ . 1 . 2]" 1
555 1 40 HIS HA 1 41 LEU MD1 . . 4.760 3.725 2.617 4.761 0.001 1 0 "[ . 1 . 2]" 1
556 1 40 HIS HA 1 62 VAL H . . 4.970 4.963 4.903 4.985 0.015 17 0 "[ . 1 . 2]" 1
557 1 40 HIS QB 1 62 VAL HB . . 4.400 4.183 3.775 4.405 0.005 12 0 "[ . 1 . 2]" 1
558 1 40 HIS QB 1 62 VAL MG1 . . 4.240 1.834 1.760 1.911 . 0 0 "[ . 1 . 2]" 1
559 1 40 HIS QB 1 62 VAL MG2 . . 4.490 3.959 3.648 4.270 . 0 0 "[ . 1 . 2]" 1
560 1 40 HIS QB 1 78 VAL MG2 . . 4.620 4.295 3.916 4.604 . 0 0 "[ . 1 . 2]" 1
561 1 40 HIS HB2 1 62 VAL H . . 4.360 3.242 2.334 3.624 . 0 0 "[ . 1 . 2]" 1
562 1 40 HIS HB2 1 62 VAL MG1 . . 4.820 1.863 1.782 1.939 . 0 0 "[ . 1 . 2]" 1
563 1 40 HIS HB2 1 62 VAL MG2 . . 5.360 4.113 3.772 4.494 . 0 0 "[ . 1 . 2]" 1
564 1 40 HIS HB2 1 78 VAL MG1 . . 4.960 4.442 3.736 4.960 0.000 1 0 "[ . 1 . 2]" 1
565 1 40 HIS HB3 1 62 VAL H . . 4.360 4.241 3.838 4.364 0.004 17 0 "[ . 1 . 2]" 1
566 1 40 HIS HB3 1 62 VAL MG1 . . 4.820 2.746 2.564 2.906 . 0 0 "[ . 1 . 2]" 1
567 1 40 HIS HB3 1 62 VAL MG2 . . 5.360 5.162 4.846 5.345 . 0 0 "[ . 1 . 2]" 1
568 1 40 HIS HB3 1 78 VAL MG1 . . 4.960 4.713 4.304 4.948 . 0 0 "[ . 1 . 2]" 1
569 1 40 HIS HD2 1 62 VAL MG2 . . 5.500 4.831 4.034 5.395 . 0 0 "[ . 1 . 2]" 1
570 1 40 HIS HD2 1 70 VAL MG2 . . 4.340 3.001 2.408 3.842 . 0 0 "[ . 1 . 2]" 1
571 1 40 HIS HD2 1 71 ASP HA . . 4.690 4.230 3.763 4.605 . 0 0 "[ . 1 . 2]" 1
572 1 40 HIS HD2 1 78 VAL MG2 . . 4.390 3.071 2.541 3.784 . 0 0 "[ . 1 . 2]" 1
573 1 40 HIS HE1 1 74 GLU HA . . 4.960 4.503 3.636 4.952 . 0 0 "[ . 1 . 2]" 1
574 1 40 HIS HE1 1 75 HIS HA . . 3.520 2.345 2.030 3.212 . 0 0 "[ . 1 . 2]" 1
575 1 40 HIS HE1 1 75 HIS HB2 . . 4.380 2.448 2.002 4.123 . 0 0 "[ . 1 . 2]" 1
576 1 40 HIS HE1 1 78 VAL MG2 . . 4.430 3.496 2.379 4.102 . 0 0 "[ . 1 . 2]" 1
577 1 41 LEU H 1 41 LEU HB2 . . 4.130 2.397 2.171 2.676 . 0 0 "[ . 1 . 2]" 1
578 1 41 LEU H 1 41 LEU QB . . 3.480 2.364 2.150 2.621 . 0 0 "[ . 1 . 2]" 1
579 1 41 LEU H 1 41 LEU HB3 . . 4.130 3.616 3.481 3.766 . 0 0 "[ . 1 . 2]" 1
580 1 41 LEU H 1 41 LEU MD1 . . 4.220 2.711 1.874 3.977 . 0 0 "[ . 1 . 2]" 1
581 1 41 LEU H 1 41 LEU MD2 . . 4.660 4.074 2.016 4.446 . 0 0 "[ . 1 . 2]" 1
582 1 41 LEU H 1 41 LEU HG . . 4.040 3.472 2.609 3.985 . 0 0 "[ . 1 . 2]" 1
583 1 41 LEU H 1 42 ILE H . . 4.680 4.482 4.124 4.600 . 0 0 "[ . 1 . 2]" 1
584 1 41 LEU HA 1 41 LEU MD2 . . 3.880 3.193 2.162 3.679 . 0 0 "[ . 1 . 2]" 1
585 1 41 LEU HA 1 41 LEU HG . . 3.960 2.581 2.248 3.822 . 0 0 "[ . 1 . 2]" 1
586 1 41 LEU HA 1 42 ILE H . . 3.170 2.190 2.142 2.317 . 0 0 "[ . 1 . 2]" 1
587 1 41 LEU QB 1 41 LEU MD2 . . 3.180 2.064 1.919 2.358 . 0 0 "[ . 1 . 2]" 1
588 1 41 LEU MD1 1 59 GLY QA . . 4.930 4.519 2.103 4.933 0.003 12 0 "[ . 1 . 2]" 1
589 1 41 LEU MD1 1 61 ARG QD . . 4.620 3.650 2.871 4.615 . 0 0 "[ . 1 . 2]" 1
590 1 41 LEU MD2 1 59 GLY QA . . 4.190 2.767 2.179 4.193 0.003 1 0 "[ . 1 . 2]" 1
591 1 41 LEU MD2 1 61 ARG QD . . 4.100 2.955 1.895 4.102 0.002 9 0 "[ . 1 . 2]" 1
592 1 41 LEU MD2 1 61 ARG HE . . 4.490 2.956 1.767 4.466 . 0 0 "[ . 1 . 2]" 1
593 1 41 LEU MD2 1 61 ARG QH2 . . 4.270 3.196 2.349 4.283 0.013 12 0 "[ . 1 . 2]" 1
594 1 42 ILE H 1 42 ILE HB . . 3.560 2.455 2.379 2.612 . 0 0 "[ . 1 . 2]" 1
595 1 42 ILE H 1 42 ILE MD . . 4.140 2.844 1.878 3.834 . 0 0 "[ . 1 . 2]" 1
596 1 42 ILE H 1 42 ILE HG12 . . 4.250 4.067 3.884 4.246 . 0 0 "[ . 1 . 2]" 1
597 1 42 ILE H 1 42 ILE HG13 . . 4.250 3.006 2.478 3.569 . 0 0 "[ . 1 . 2]" 1
598 1 42 ILE H 1 42 ILE MG . . 4.150 3.762 3.716 3.838 . 0 0 "[ . 1 . 2]" 1
599 1 42 ILE H 1 59 GLY H . . 4.870 3.148 2.386 3.784 . 0 0 "[ . 1 . 2]" 1
600 1 42 ILE H 1 60 ASP H . . 4.250 3.331 2.774 4.143 . 0 0 "[ . 1 . 2]" 1
601 1 42 ILE H 1 60 ASP QB . . 4.520 3.904 3.557 4.458 . 0 0 "[ . 1 . 2]" 1
602 1 42 ILE HA 1 42 ILE MD . . 3.910 3.586 3.193 3.878 . 0 0 "[ . 1 . 2]" 1
603 1 42 ILE HA 1 42 ILE MG . . 3.610 2.420 2.336 2.517 . 0 0 "[ . 1 . 2]" 1
604 1 42 ILE HA 1 43 ARG H . . 3.060 2.171 2.140 2.232 . 0 0 "[ . 1 . 2]" 1
605 1 42 ILE HB 1 43 ARG H . . 4.800 4.232 3.990 4.452 . 0 0 "[ . 1 . 2]" 1
606 1 42 ILE HB 1 59 GLY H . . 4.590 3.346 2.711 3.887 . 0 0 "[ . 1 . 2]" 1
607 1 42 ILE HB 1 60 ASP H . . 3.710 3.277 2.782 3.681 . 0 0 "[ . 1 . 2]" 1
608 1 42 ILE HB 1 60 ASP QB . . 3.900 3.090 2.834 3.432 . 0 0 "[ . 1 . 2]" 1
609 1 42 ILE MD 1 42 ILE MG . . 3.220 2.698 2.188 3.173 . 0 0 "[ . 1 . 2]" 1
610 1 42 ILE MD 1 56 LEU MD1 . . 3.000 2.395 1.986 2.991 . 0 0 "[ . 1 . 2]" 1
611 1 42 ILE MD 1 56 LEU HG . . 4.010 3.076 2.274 3.748 . 0 0 "[ . 1 . 2]" 1
612 1 42 ILE MD 1 60 ASP HB2 . . 4.310 2.442 2.028 3.679 . 0 0 "[ . 1 . 2]" 1
613 1 42 ILE MD 1 60 ASP QB . . 3.580 2.285 1.983 2.593 . 0 0 "[ . 1 . 2]" 1
614 1 42 ILE MD 1 60 ASP HB3 . . 4.310 2.989 2.311 3.427 . 0 0 "[ . 1 . 2]" 1
615 1 42 ILE MD 1 62 VAL HA . . 4.730 4.293 3.566 4.728 . 0 0 "[ . 1 . 2]" 1
616 1 42 ILE MD 1 62 VAL HB . . 4.290 3.095 2.570 3.638 . 0 0 "[ . 1 . 2]" 1
617 1 42 ILE MD 1 62 VAL MG1 . . 3.350 3.117 2.506 3.357 0.007 10 0 "[ . 1 . 2]" 1
618 1 42 ILE MD 1 93 VAL HB . . 4.610 4.463 4.149 4.611 0.001 10 0 "[ . 1 . 2]" 1
619 1 42 ILE MD 1 93 VAL MG1 . . 3.220 2.718 2.446 3.056 . 0 0 "[ . 1 . 2]" 1
620 1 42 ILE QG 1 42 ILE MG . . 3.120 2.081 1.949 2.237 . 0 0 "[ . 1 . 2]" 1
621 1 42 ILE QG 1 60 ASP QB . . 4.070 3.929 3.584 4.067 . 0 0 "[ . 1 . 2]" 1
622 1 42 ILE QG 1 62 VAL MG1 . . 4.230 3.684 3.098 4.228 . 0 0 "[ . 1 . 2]" 1
623 1 42 ILE QG 1 93 VAL MG1 . . 5.340 4.318 3.930 4.581 . 0 0 "[ . 1 . 2]" 1
624 1 42 ILE HG12 1 42 ILE MG . . 3.610 2.133 2.000 2.287 . 0 0 "[ . 1 . 2]" 1
625 1 42 ILE HG13 1 42 ILE MG . . 3.610 2.940 2.617 3.174 . 0 0 "[ . 1 . 2]" 1
626 1 42 ILE MG 1 43 ARG H . . 3.820 2.492 1.936 3.097 . 0 0 "[ . 1 . 2]" 1
627 1 42 ILE MG 1 45 ILE HG12 . . 4.260 2.586 2.189 3.072 . 0 0 "[ . 1 . 2]" 1
628 1 42 ILE MG 1 56 LEU MD2 . . 3.260 2.125 1.836 2.638 . 0 0 "[ . 1 . 2]" 1
629 1 42 ILE MG 1 56 LEU HG . . 3.830 2.976 2.234 3.476 . 0 0 "[ . 1 . 2]" 1
630 1 42 ILE MG 1 58 ASP HA . . 4.200 3.246 2.652 3.913 . 0 0 "[ . 1 . 2]" 1
631 1 42 ILE MG 1 59 GLY H . . 4.640 4.105 3.531 4.597 . 0 0 "[ . 1 . 2]" 1
632 1 42 ILE MG 1 60 ASP H . . 4.710 4.522 4.254 4.702 . 0 0 "[ . 1 . 2]" 1
633 1 42 ILE MG 1 60 ASP QB . . 4.750 4.111 3.707 4.441 . 0 0 "[ . 1 . 2]" 1
634 1 43 ARG H 1 43 ARG QB . . 3.520 2.705 2.556 3.141 . 0 0 "[ . 1 . 2]" 1
635 1 43 ARG H 1 43 ARG QD . . 5.280 4.529 2.791 5.251 . 0 0 "[ . 1 . 2]" 1
636 1 43 ARG H 1 43 ARG QG . . 5.070 3.752 2.625 4.330 . 0 0 "[ . 1 . 2]" 1
637 1 43 ARG QB 1 43 ARG QD . . 3.320 2.279 2.028 2.526 . 0 0 "[ . 1 . 2]" 1
638 1 43 ARG QB 1 44 VAL H . . 3.640 2.732 2.069 3.479 . 0 0 "[ . 1 . 2]" 1
639 1 43 ARG QB 1 44 VAL MG2 . . 3.330 2.332 2.147 2.734 . 0 0 "[ . 1 . 2]" 1
640 1 43 ARG HB2 1 44 VAL MG2 . . 3.910 3.352 2.387 3.910 0.000 8 0 "[ . 1 . 2]" 1
641 1 43 ARG HB3 1 44 VAL MG2 . . 3.910 2.501 2.199 3.956 0.046 11 0 "[ . 1 . 2]" 1
642 1 43 ARG QD 1 44 VAL H . . 5.030 4.045 2.789 5.000 . 0 0 "[ . 1 . 2]" 1
643 1 43 ARG QG 1 44 VAL H . . 4.710 2.787 1.882 4.307 . 0 0 "[ . 1 . 2]" 1
644 1 44 VAL H 1 44 VAL MG1 . . 4.100 3.965 3.862 4.000 . 0 0 "[ . 1 . 2]" 1
645 1 44 VAL H 1 44 VAL MG2 . . 3.730 2.649 2.340 2.747 . 0 0 "[ . 1 . 2]" 1
646 1 44 VAL H 1 45 ILE H . . 3.960 2.655 2.505 2.776 . 0 0 "[ . 1 . 2]" 1
647 1 44 VAL HA 1 44 VAL MG1 . . 3.240 2.246 2.144 2.337 . 0 0 "[ . 1 . 2]" 1
648 1 44 VAL HA 1 44 VAL MG2 . . 3.530 2.524 2.364 2.627 . 0 0 "[ . 1 . 2]" 1
649 1 44 VAL HA 1 45 ILE H . . 3.190 2.713 2.631 2.871 . 0 0 "[ . 1 . 2]" 1
650 1 44 VAL MG1 1 45 ILE H . . 4.190 4.057 3.938 4.193 0.003 11 0 "[ . 1 . 2]" 1
651 1 44 VAL MG1 1 46 GLU HA . . 5.110 4.595 4.071 5.027 . 0 0 "[ . 1 . 2]" 1
652 1 44 VAL MG2 1 45 ILE H . . 4.470 4.308 4.201 4.354 . 0 0 "[ . 1 . 2]" 1
653 1 45 ILE H 1 45 ILE HB . . 3.250 2.507 2.427 2.571 . 0 0 "[ . 1 . 2]" 1
654 1 45 ILE H 1 45 ILE MD . . 4.230 3.573 3.319 3.761 . 0 0 "[ . 1 . 2]" 1
655 1 45 ILE H 1 45 ILE HG12 . . 3.800 3.641 3.402 3.798 . 0 0 "[ . 1 . 2]" 1
656 1 45 ILE H 1 45 ILE HG13 . . 3.680 2.312 2.038 2.487 . 0 0 "[ . 1 . 2]" 1
657 1 45 ILE H 1 45 ILE MG . . 4.150 3.776 3.753 3.805 . 0 0 "[ . 1 . 2]" 1
658 1 45 ILE H 1 46 GLU H . . 4.720 4.167 3.964 4.322 . 0 0 "[ . 1 . 2]" 1
659 1 45 ILE H 1 46 GLU HA . . 5.410 5.159 5.070 5.301 . 0 0 "[ . 1 . 2]" 1
660 1 45 ILE HA 1 45 ILE MD . . 3.990 3.861 3.816 3.909 . 0 0 "[ . 1 . 2]" 1
661 1 45 ILE HA 1 45 ILE MG . . 3.570 2.394 2.286 2.459 . 0 0 "[ . 1 . 2]" 1
662 1 45 ILE HA 1 46 GLU H . . 3.130 2.225 2.154 2.343 . 0 0 "[ . 1 . 2]" 1
663 1 45 ILE HA 1 51 ALA MB . . 4.440 4.105 3.826 4.353 . 0 0 "[ . 1 . 2]" 1
664 1 45 ILE HB 1 45 ILE MD . . 3.620 2.297 2.199 2.418 . 0 0 "[ . 1 . 2]" 1
665 1 45 ILE MD 1 45 ILE MG . . 3.350 2.199 1.955 2.394 . 0 0 "[ . 1 . 2]" 1
666 1 45 ILE MD 1 56 LEU H . . 5.500 5.120 4.895 5.444 . 0 0 "[ . 1 . 2]" 1
667 1 45 ILE MD 1 56 LEU HA . . 4.780 4.492 4.043 4.731 . 0 0 "[ . 1 . 2]" 1
668 1 45 ILE MD 1 56 LEU HB3 . . 3.650 3.281 2.883 3.615 . 0 0 "[ . 1 . 2]" 1
669 1 45 ILE MD 1 57 LEU H . . 4.310 3.778 3.286 4.219 . 0 0 "[ . 1 . 2]" 1
670 1 45 ILE MD 1 57 LEU HA . . 3.740 2.449 2.016 3.451 . 0 0 "[ . 1 . 2]" 1
671 1 45 ILE MD 1 58 ASP H . . 3.870 2.575 2.012 3.031 . 0 0 "[ . 1 . 2]" 1
672 1 45 ILE MD 1 58 ASP HA . . 3.980 2.386 1.978 2.953 . 0 0 "[ . 1 . 2]" 1
673 1 45 ILE MD 1 58 ASP QB . . 3.590 2.628 2.205 2.984 . 0 0 "[ . 1 . 2]" 1
674 1 45 ILE HG12 1 45 ILE MG . . 2.720 2.237 2.101 2.397 . 0 0 "[ . 1 . 2]" 1
675 1 45 ILE HG12 1 51 ALA MB . . 4.140 3.783 3.194 4.077 . 0 0 "[ . 1 . 2]" 1
676 1 45 ILE HG13 1 58 ASP QB . . 5.260 3.634 3.140 4.260 . 0 0 "[ . 1 . 2]" 1
677 1 45 ILE MG 1 46 GLU H . . 3.850 3.202 2.884 3.562 . 0 0 "[ . 1 . 2]" 1
678 1 45 ILE MG 1 46 GLU HA . . 4.620 4.323 4.038 4.588 . 0 0 "[ . 1 . 2]" 1
679 1 45 ILE MG 1 46 GLU QB . . 4.220 4.180 4.045 4.224 0.004 4 0 "[ . 1 . 2]" 1
680 1 45 ILE MG 1 49 SER H . . 4.850 4.480 4.281 4.770 . 0 0 "[ . 1 . 2]" 1
681 1 45 ILE MG 1 49 SER HG . . 4.030 2.709 2.309 3.342 . 0 0 "[ . 1 . 2]" 1
682 1 45 ILE MG 1 51 ALA MB . . 3.300 2.977 2.461 3.300 0.000 14 0 "[ . 1 . 2]" 1
683 1 45 ILE MG 1 52 GLU H . . 3.970 3.421 2.893 3.856 . 0 0 "[ . 1 . 2]" 1
684 1 45 ILE MG 1 52 GLU HA . . 3.560 3.108 2.747 3.458 . 0 0 "[ . 1 . 2]" 1
685 1 45 ILE MG 1 52 GLU HB2 . . 3.520 2.127 1.866 2.467 . 0 0 "[ . 1 . 2]" 1
686 1 45 ILE MG 1 52 GLU HB3 . . 4.620 3.503 3.224 3.866 . 0 0 "[ . 1 . 2]" 1
687 1 45 ILE MG 1 52 GLU HG2 . . 4.410 3.691 3.035 4.352 . 0 0 "[ . 1 . 2]" 1
688 1 45 ILE MG 1 52 GLU QG . . 3.580 2.828 2.058 3.484 . 0 0 "[ . 1 . 2]" 1
689 1 45 ILE MG 1 52 GLU HG3 . . 4.410 3.145 2.073 4.347 . 0 0 "[ . 1 . 2]" 1
690 1 45 ILE MG 1 58 ASP H . . 5.250 4.956 4.589 5.251 0.001 1 0 "[ . 1 . 2]" 1
691 1 46 GLU H 1 46 GLU QB . . 3.320 2.216 2.124 2.429 . 0 0 "[ . 1 . 2]" 1
692 1 46 GLU H 1 46 GLU HG2 . . 4.620 4.252 2.248 4.634 0.014 8 0 "[ . 1 . 2]" 1
693 1 46 GLU H 1 46 GLU QG . . 4.060 3.692 2.223 4.063 0.003 17 0 "[ . 1 . 2]" 1
694 1 46 GLU H 1 46 GLU HG3 . . 4.620 4.159 2.798 4.599 . 0 0 "[ . 1 . 2]" 1
695 1 46 GLU H 1 49 SER QB . . 4.580 3.929 3.566 4.305 . 0 0 "[ . 1 . 2]" 1
696 1 46 GLU H 1 49 SER HG . . 4.690 4.168 3.565 4.691 0.001 11 0 "[ . 1 . 2]" 1
697 1 46 GLU HA 1 46 GLU HG2 . . 4.190 3.050 2.231 3.750 . 0 0 "[ . 1 . 2]" 1
698 1 46 GLU HA 1 46 GLU QG . . 3.630 2.508 2.208 2.906 . 0 0 "[ . 1 . 2]" 1
699 1 46 GLU HA 1 46 GLU HG3 . . 4.190 2.851 2.350 3.734 . 0 0 "[ . 1 . 2]" 1
700 1 46 GLU HA 1 47 GLU H . . 2.940 2.301 2.225 2.424 . 0 0 "[ . 1 . 2]" 1
701 1 46 GLU QB 1 47 GLU H . . 4.480 3.228 2.415 3.471 . 0 0 "[ . 1 . 2]" 1
702 1 46 GLU QB 1 49 SER H . . 4.820 4.535 4.098 4.822 0.002 15 0 "[ . 1 . 2]" 1
703 1 46 GLU QB 1 49 SER QB . . 3.740 2.442 2.144 2.879 . 0 0 "[ . 1 . 2]" 1
704 1 46 GLU QB 1 49 SER HG . . 4.140 3.792 3.393 4.142 0.002 11 0 "[ . 1 . 2]" 1
705 1 46 GLU QB 1 51 ALA MB . . 5.310 5.009 4.668 5.292 . 0 0 "[ . 1 . 2]" 1
706 1 46 GLU QG 1 47 GLU H . . 4.250 2.520 2.016 4.217 . 0 0 "[ . 1 . 2]" 1
707 1 46 GLU HG2 1 47 GLU H . . 4.920 3.179 2.069 4.652 . 0 0 "[ . 1 . 2]" 1
708 1 46 GLU HG3 1 47 GLU H . . 4.920 3.113 2.063 4.826 . 0 0 "[ . 1 . 2]" 1
709 1 47 GLU H 1 47 GLU QB . . 3.170 2.243 2.148 2.505 . 0 0 "[ . 1 . 2]" 1
710 1 47 GLU H 1 47 GLU QG . . 4.440 3.676 2.210 4.059 . 0 0 "[ . 1 . 2]" 1
711 1 47 GLU H 1 48 GLY H . . 4.820 4.594 4.423 4.633 . 0 0 "[ . 1 . 2]" 1
712 1 47 GLU HA 1 47 GLU QG . . 3.670 2.383 2.161 3.328 . 0 0 "[ . 1 . 2]" 1
713 1 47 GLU HA 1 48 GLY H . . 3.050 2.306 2.145 2.502 . 0 0 "[ . 1 . 2]" 1
714 1 47 GLU QB 1 48 GLY H . . 3.950 3.196 2.269 3.817 . 0 0 "[ . 1 . 2]" 1
715 1 47 GLU QG 1 48 GLY H . . 3.770 2.728 1.848 3.795 0.025 11 0 "[ . 1 . 2]" 1
716 1 48 GLY H 1 49 SER H . . 3.610 2.715 2.212 2.882 . 0 0 "[ . 1 . 2]" 1
717 1 48 GLY H 1 49 SER QB . . 4.780 4.677 4.546 4.785 0.005 11 0 "[ . 1 . 2]" 1
718 1 48 GLY H 1 49 SER HG . . 5.440 4.873 3.745 5.319 . 0 0 "[ . 1 . 2]" 1
719 1 49 SER H 1 49 SER QB . . 3.500 2.577 2.394 3.078 . 0 0 "[ . 1 . 2]" 1
720 1 49 SER H 1 49 SER HG . . 3.300 2.686 1.899 2.988 . 0 0 "[ . 1 . 2]" 1
721 1 49 SER H 1 52 GLU H . . 4.180 4.044 3.900 4.182 0.002 1 0 "[ . 1 . 2]" 1
722 1 49 SER H 1 52 GLU HB2 . . 4.300 4.059 3.685 4.301 0.001 10 0 "[ . 1 . 2]" 1
723 1 49 SER H 1 52 GLU HB3 . . 3.640 3.466 3.339 3.633 . 0 0 "[ . 1 . 2]" 1
724 1 49 SER H 1 53 LYS H . . 4.920 4.536 4.248 4.856 . 0 0 "[ . 1 . 2]" 1
725 1 49 SER QB 1 51 ALA H . . 3.970 2.888 2.277 3.073 . 0 0 "[ . 1 . 2]" 1
726 1 49 SER HG 1 52 GLU H . . 3.760 2.627 2.147 3.473 . 0 0 "[ . 1 . 2]" 1
727 1 49 SER HG 1 52 GLU HB2 . . 4.630 2.830 2.219 3.385 . 0 0 "[ . 1 . 2]" 1
728 1 50 PRO HA 1 53 LYS QB . . 3.700 2.802 2.377 3.233 . 0 0 "[ . 1 . 2]" 1
729 1 50 PRO HB2 1 51 ALA MB . . 5.500 4.618 4.506 4.725 . 0 0 "[ . 1 . 2]" 1
730 1 50 PRO HB3 1 51 ALA H . . 4.410 4.388 4.239 4.427 0.017 17 0 "[ . 1 . 2]" 1
731 1 50 PRO QD 1 51 ALA H . . 4.440 2.756 2.625 2.806 . 0 0 "[ . 1 . 2]" 1
732 1 50 PRO HG2 1 51 ALA H . . 3.800 2.984 2.591 3.097 . 0 0 "[ . 1 . 2]" 1
733 1 50 PRO HG2 1 51 ALA MB . . 4.380 3.662 3.568 3.828 . 0 0 "[ . 1 . 2]" 1
734 1 51 ALA H 1 51 ALA MB . . 3.160 2.190 2.058 2.286 . 0 0 "[ . 1 . 2]" 1
735 1 51 ALA H 1 52 GLU H . . 3.810 2.405 2.256 2.542 . 0 0 "[ . 1 . 2]" 1
736 1 51 ALA HA 1 54 ALA H . . 4.540 4.098 3.819 4.291 . 0 0 "[ . 1 . 2]" 1
737 1 51 ALA HA 1 54 ALA MB . . 3.790 3.522 2.787 3.789 . 0 0 "[ . 1 . 2]" 1
738 1 51 ALA HA 1 56 LEU MD2 . . 3.990 3.556 3.092 3.938 . 0 0 "[ . 1 . 2]" 1
739 1 51 ALA MB 1 52 GLU H . . 3.570 2.695 2.481 2.891 . 0 0 "[ . 1 . 2]" 1
740 1 51 ALA MB 1 52 GLU HB2 . . 4.680 3.912 3.700 4.128 . 0 0 "[ . 1 . 2]" 1
741 1 51 ALA MB 1 56 LEU HB3 . . 4.490 3.546 2.980 3.947 . 0 0 "[ . 1 . 2]" 1
742 1 51 ALA MB 1 56 LEU MD2 . . 3.320 2.490 2.204 3.287 . 0 0 "[ . 1 . 2]" 1
743 1 52 GLU H 1 52 GLU HB2 . . 3.490 2.537 2.365 2.718 . 0 0 "[ . 1 . 2]" 1
744 1 52 GLU H 1 52 GLU HB3 . . 3.490 2.599 2.436 2.729 . 0 0 "[ . 1 . 2]" 1
745 1 52 GLU H 1 52 GLU HG2 . . 4.870 4.536 4.431 4.654 . 0 0 "[ . 1 . 2]" 1
746 1 52 GLU H 1 52 GLU QG . . 4.240 4.009 3.958 4.094 . 0 0 "[ . 1 . 2]" 1
747 1 52 GLU H 1 52 GLU HG3 . . 4.870 4.471 4.348 4.653 . 0 0 "[ . 1 . 2]" 1
748 1 52 GLU H 1 53 LYS H . . 3.350 2.465 2.247 2.659 . 0 0 "[ . 1 . 2]" 1
749 1 52 GLU H 1 53 LYS QB . . 4.630 4.338 4.208 4.542 . 0 0 "[ . 1 . 2]" 1
750 1 52 GLU HA 1 52 GLU HG2 . . 3.940 3.133 2.442 3.811 . 0 0 "[ . 1 . 2]" 1
751 1 52 GLU HA 1 52 GLU HG3 . . 3.940 2.772 2.276 3.593 . 0 0 "[ . 1 . 2]" 1
752 1 52 GLU HA 1 55 GLY H . . 4.560 4.144 3.151 4.556 . 0 0 "[ . 1 . 2]" 1
753 1 52 GLU HB2 1 53 LYS H . . 3.870 3.782 3.587 3.871 0.001 5 0 "[ . 1 . 2]" 1
754 1 52 GLU HB3 1 53 LYS H . . 3.610 2.582 2.359 2.884 . 0 0 "[ . 1 . 2]" 1
755 1 52 GLU HB3 1 53 LYS HA . . 4.660 4.072 3.918 4.216 . 0 0 "[ . 1 . 2]" 1
756 1 52 GLU QG 1 53 LYS H . . 4.420 3.857 3.460 4.197 . 0 0 "[ . 1 . 2]" 1
757 1 52 GLU QG 1 53 LYS HA . . 4.490 4.063 3.551 4.490 . 0 0 "[ . 1 . 2]" 1
758 1 53 LYS H 1 53 LYS QB . . 3.180 2.318 2.202 2.471 . 0 0 "[ . 1 . 2]" 1
759 1 53 LYS H 1 53 LYS HG2 . . 4.060 2.995 2.234 3.908 . 0 0 "[ . 1 . 2]" 1
760 1 53 LYS H 1 53 LYS QG . . 3.360 2.520 2.123 2.721 . 0 0 "[ . 1 . 2]" 1
761 1 53 LYS H 1 53 LYS HG3 . . 4.060 3.126 2.146 3.668 . 0 0 "[ . 1 . 2]" 1
762 1 53 LYS H 1 54 ALA H . . 3.450 2.824 2.734 2.895 . 0 0 "[ . 1 . 2]" 1
763 1 53 LYS H 1 55 GLY H . . 5.260 4.487 3.994 4.688 . 0 0 "[ . 1 . 2]" 1
764 1 53 LYS HA 1 53 LYS HG2 . . 4.030 2.985 2.173 3.958 . 0 0 "[ . 1 . 2]" 1
765 1 53 LYS HA 1 53 LYS HG3 . . 4.030 3.367 2.672 3.701 . 0 0 "[ . 1 . 2]" 1
766 1 53 LYS HA 1 55 GLY H . . 4.460 3.506 3.296 3.990 . 0 0 "[ . 1 . 2]" 1
767 1 53 LYS QB 1 53 LYS QE . . 4.530 2.941 2.105 3.747 . 0 0 "[ . 1 . 2]" 1
768 1 53 LYS QB 1 54 ALA H . . 3.860 3.202 2.782 3.633 . 0 0 "[ . 1 . 2]" 1
769 1 53 LYS QB 1 54 ALA MB . . 4.680 4.124 3.769 4.574 . 0 0 "[ . 1 . 2]" 1
770 1 53 LYS QE 1 53 LYS QG . . 3.280 2.276 2.069 2.570 . 0 0 "[ . 1 . 2]" 1
771 1 53 LYS QG 1 54 ALA H . . 4.650 3.582 2.071 4.525 . 0 0 "[ . 1 . 2]" 1
772 1 53 LYS HG2 1 54 ALA H . . 5.500 4.197 2.618 5.275 . 0 0 "[ . 1 . 2]" 1
773 1 53 LYS HG3 1 54 ALA H . . 5.500 3.946 2.135 5.319 . 0 0 "[ . 1 . 2]" 1
774 1 54 ALA H 1 54 ALA MB . . 2.990 2.162 2.078 2.246 . 0 0 "[ . 1 . 2]" 1
775 1 54 ALA H 1 55 GLY H . . 3.430 2.856 2.455 3.059 . 0 0 "[ . 1 . 2]" 1
776 1 54 ALA H 1 56 LEU H . . 4.590 3.371 3.190 3.746 . 0 0 "[ . 1 . 2]" 1
777 1 54 ALA MB 1 55 GLY H . . 3.750 3.520 2.921 3.656 . 0 0 "[ . 1 . 2]" 1
778 1 54 ALA MB 1 56 LEU H . . 4.470 3.256 2.690 3.493 . 0 0 "[ . 1 . 2]" 1
779 1 54 ALA MB 1 56 LEU MD1 . . 4.360 3.727 3.410 4.266 . 0 0 "[ . 1 . 2]" 1
780 1 54 ALA MB 1 56 LEU MD2 . . 4.500 4.049 3.632 4.471 . 0 0 "[ . 1 . 2]" 1
781 1 55 GLY H 1 56 LEU H . . 3.340 2.627 2.029 2.897 . 0 0 "[ . 1 . 2]" 1
782 1 56 LEU H 1 56 LEU HB2 . . 3.000 2.335 2.163 2.523 . 0 0 "[ . 1 . 2]" 1
783 1 56 LEU H 1 56 LEU HB3 . . 3.780 2.778 2.671 2.914 . 0 0 "[ . 1 . 2]" 1
784 1 56 LEU H 1 56 LEU MD1 . . 3.970 3.783 3.519 3.959 . 0 0 "[ . 1 . 2]" 1
785 1 56 LEU H 1 56 LEU MD2 . . 4.460 4.282 4.227 4.342 . 0 0 "[ . 1 . 2]" 1
786 1 56 LEU H 1 56 LEU HG . . 4.620 4.550 4.460 4.601 . 0 0 "[ . 1 . 2]" 1
787 1 56 LEU HA 1 56 LEU MD1 . . 3.270 2.159 1.979 2.500 . 0 0 "[ . 1 . 2]" 1
788 1 56 LEU HA 1 56 LEU MD2 . . 4.530 3.837 3.808 3.865 . 0 0 "[ . 1 . 2]" 1
789 1 56 LEU HA 1 57 LEU H . . 3.180 2.151 2.140 2.211 . 0 0 "[ . 1 . 2]" 1
790 1 56 LEU HA 1 57 LEU QD . . 4.390 3.365 2.685 4.399 0.009 17 0 "[ . 1 . 2]" 1
791 1 56 LEU HB2 1 56 LEU MD1 . . 3.250 2.265 2.064 2.351 . 0 0 "[ . 1 . 2]" 1
792 1 56 LEU HB3 1 56 LEU MD1 . . 3.450 3.172 3.140 3.185 . 0 0 "[ . 1 . 2]" 1
793 1 56 LEU HB3 1 57 LEU H . . 4.370 4.034 3.692 4.175 . 0 0 "[ . 1 . 2]" 1
794 1 56 LEU MD1 1 57 LEU H . . 4.090 3.384 3.020 3.781 . 0 0 "[ . 1 . 2]" 1
795 1 56 LEU MD1 1 60 ASP QB . . 4.240 2.977 2.554 3.600 . 0 0 "[ . 1 . 2]" 1
796 1 56 LEU HG 1 57 LEU H . . 3.960 3.096 2.475 3.405 . 0 0 "[ . 1 . 2]" 1
797 1 57 LEU H 1 57 LEU HB2 . . 3.960 2.719 2.254 3.602 . 0 0 "[ . 1 . 2]" 1
798 1 57 LEU H 1 57 LEU QB . . 3.350 2.572 2.228 3.151 . 0 0 "[ . 1 . 2]" 1
799 1 57 LEU H 1 57 LEU HB3 . . 3.960 3.560 3.271 3.780 . 0 0 "[ . 1 . 2]" 1
800 1 57 LEU H 1 57 LEU MD1 . . 4.660 3.335 2.244 4.127 . 0 0 "[ . 1 . 2]" 1
801 1 57 LEU H 1 57 LEU QD . . 4.040 2.649 1.937 3.733 . 0 0 "[ . 1 . 2]" 1
802 1 57 LEU H 1 57 LEU MD2 . . 4.660 3.585 1.944 4.655 . 0 0 "[ . 1 . 2]" 1
803 1 57 LEU H 1 57 LEU HG . . 4.360 3.580 2.120 4.373 0.013 7 0 "[ . 1 . 2]" 1
804 1 57 LEU H 1 60 ASP QB . . 4.770 3.569 2.905 4.088 . 0 0 "[ . 1 . 2]" 1
805 1 57 LEU HA 1 57 LEU MD1 . . 4.050 3.271 2.030 4.115 0.065 19 0 "[ . 1 . 2]" 1
806 1 57 LEU HA 1 57 LEU QD . . 3.000 2.709 1.941 3.035 0.035 19 0 "[ . 1 . 2]" 1
807 1 57 LEU HA 1 57 LEU MD2 . . 4.050 3.161 2.388 3.673 . 0 0 "[ . 1 . 2]" 1
808 1 57 LEU HA 1 58 ASP H . . 3.300 2.417 2.267 2.536 . 0 0 "[ . 1 . 2]" 1
809 1 57 LEU QB 1 57 LEU QD . . 2.820 1.886 1.829 2.024 . 0 0 "[ . 1 . 2]" 1
810 1 57 LEU QB 1 58 ASP H . . 3.710 2.401 2.101 2.815 . 0 0 "[ . 1 . 2]" 1
811 1 57 LEU QB 1 58 ASP QB . . 4.540 4.265 3.811 4.535 . 0 0 "[ . 1 . 2]" 1
812 1 57 LEU HB2 1 58 ASP H . . 4.550 3.451 2.314 4.117 . 0 0 "[ . 1 . 2]" 1
813 1 57 LEU HB3 1 58 ASP H . . 4.550 2.678 2.118 3.364 . 0 0 "[ . 1 . 2]" 1
814 1 57 LEU QD 1 58 ASP H . . 4.010 3.434 2.337 3.911 . 0 0 "[ . 1 . 2]" 1
815 1 57 LEU QD 1 58 ASP QB . . 5.280 4.750 3.735 5.284 0.004 12 0 "[ . 1 . 2]" 1
816 1 57 LEU MD1 1 58 ASP H . . 4.780 4.167 2.347 4.698 . 0 0 "[ . 1 . 2]" 1
817 1 57 LEU MD2 1 58 ASP H . . 4.780 3.992 2.760 4.680 . 0 0 "[ . 1 . 2]" 1
818 1 57 LEU HG 1 58 ASP H . . 4.460 4.069 3.503 4.466 0.006 17 0 "[ . 1 . 2]" 1
819 1 58 ASP H 1 58 ASP HB2 . . 3.600 3.233 2.337 3.610 0.010 5 0 "[ . 1 . 2]" 1
820 1 58 ASP H 1 58 ASP QB . . 3.090 2.397 2.149 2.775 . 0 0 "[ . 1 . 2]" 1
821 1 58 ASP H 1 58 ASP HB3 . . 3.600 2.543 2.213 2.897 . 0 0 "[ . 1 . 2]" 1
822 1 58 ASP H 1 59 GLY H . . 4.890 4.526 4.355 4.651 . 0 0 "[ . 1 . 2]" 1
823 1 58 ASP HA 1 59 GLY H . . 3.210 2.172 2.143 2.322 . 0 0 "[ . 1 . 2]" 1
824 1 58 ASP HA 1 59 GLY QA . . 4.600 3.934 3.897 4.022 . 0 0 "[ . 1 . 2]" 1
825 1 58 ASP HA 1 60 ASP H . . 4.330 3.475 3.222 3.682 . 0 0 "[ . 1 . 2]" 1
826 1 58 ASP QB 1 59 GLY H . . 4.480 3.360 2.609 3.876 . 0 0 "[ . 1 . 2]" 1
827 1 59 GLY H 1 60 ASP H . . 3.690 2.288 1.943 2.987 . 0 0 "[ . 1 . 2]" 1
828 1 59 GLY H 1 60 ASP QB . . 5.200 4.142 3.866 4.591 . 0 0 "[ . 1 . 2]" 1
829 1 60 ASP H 1 60 ASP QB . . 3.360 2.321 2.126 2.566 . 0 0 "[ . 1 . 2]" 1
830 1 60 ASP HA 1 61 ARG H . . 3.140 2.240 2.138 2.353 . 0 0 "[ . 1 . 2]" 1
831 1 60 ASP QB 1 61 ARG H . . 3.840 2.925 2.583 3.392 . 0 0 "[ . 1 . 2]" 1
832 1 60 ASP QB 1 93 VAL HB . . 3.510 2.415 2.092 3.178 . 0 0 "[ . 1 . 2]" 1
833 1 60 ASP QB 1 93 VAL MG1 . . 3.690 2.320 1.917 3.132 . 0 0 "[ . 1 . 2]" 1
834 1 60 ASP QB 1 93 VAL MG2 . . 4.010 3.450 3.103 3.722 . 0 0 "[ . 1 . 2]" 1
835 1 60 ASP HB2 1 61 ARG H . . 4.420 4.101 3.794 4.415 . 0 0 "[ . 1 . 2]" 1
836 1 60 ASP HB2 1 93 VAL HB . . 4.150 4.037 3.852 4.152 0.002 17 0 "[ . 1 . 2]" 1
837 1 60 ASP HB2 1 93 VAL MG1 . . 4.310 3.275 3.023 4.313 0.003 4 0 "[ . 1 . 2]" 1
838 1 60 ASP HB2 1 93 VAL MG2 . . 4.790 4.559 4.241 4.791 0.001 16 0 "[ . 1 . 2]" 1
839 1 60 ASP HB3 1 61 ARG H . . 4.420 3.000 2.623 3.524 . 0 0 "[ . 1 . 2]" 1
840 1 60 ASP HB3 1 93 VAL HB . . 4.150 2.437 2.101 3.300 . 0 0 "[ . 1 . 2]" 1
841 1 60 ASP HB3 1 93 VAL MG1 . . 4.310 2.380 1.939 3.216 . 0 0 "[ . 1 . 2]" 1
842 1 60 ASP HB3 1 93 VAL MG2 . . 4.790 3.578 3.178 3.983 . 0 0 "[ . 1 . 2]" 1
843 1 61 ARG H 1 61 ARG HB2 . . 4.030 2.383 2.223 2.577 . 0 0 "[ . 1 . 2]" 1
844 1 61 ARG H 1 61 ARG QB . . 3.440 2.350 2.199 2.528 . 0 0 "[ . 1 . 2]" 1
845 1 61 ARG H 1 61 ARG HB3 . . 4.030 3.585 3.491 3.659 . 0 0 "[ . 1 . 2]" 1
846 1 61 ARG H 1 61 ARG HD2 . . 4.900 3.398 2.561 4.675 . 0 0 "[ . 1 . 2]" 1
847 1 61 ARG H 1 61 ARG QD . . 4.250 2.784 2.258 3.698 . 0 0 "[ . 1 . 2]" 1
848 1 61 ARG H 1 61 ARG HD3 . . 4.900 3.100 2.271 3.875 . 0 0 "[ . 1 . 2]" 1
849 1 61 ARG H 1 62 VAL H . . 4.880 4.395 4.211 4.496 . 0 0 "[ . 1 . 2]" 1
850 1 61 ARG H 1 93 VAL HA . . 4.900 4.109 3.799 4.367 . 0 0 "[ . 1 . 2]" 1
851 1 61 ARG H 1 93 VAL HB . . 3.900 3.606 3.286 3.897 . 0 0 "[ . 1 . 2]" 1
852 1 61 ARG H 1 93 VAL MG1 . . 4.330 3.959 3.656 4.320 . 0 0 "[ . 1 . 2]" 1
853 1 61 ARG H 1 99 TYR QD . . 5.400 5.031 4.339 5.397 . 0 0 "[ . 1 . 2]" 1
854 1 61 ARG HA 1 61 ARG HD2 . . 4.630 3.220 2.701 3.826 . 0 0 "[ . 1 . 2]" 1
855 1 61 ARG HA 1 61 ARG QD . . 3.840 2.970 2.352 3.181 . 0 0 "[ . 1 . 2]" 1
856 1 61 ARG HA 1 61 ARG HD3 . . 4.630 3.715 2.447 4.189 . 0 0 "[ . 1 . 2]" 1
857 1 61 ARG HA 1 62 VAL H . . 3.200 2.159 2.140 2.234 . 0 0 "[ . 1 . 2]" 1
858 1 61 ARG HA 1 62 VAL MG1 . . 4.680 3.594 3.472 3.746 . 0 0 "[ . 1 . 2]" 1
859 1 61 ARG HA 1 93 VAL MG1 . . 4.780 4.582 4.105 4.778 . 0 0 "[ . 1 . 2]" 1
860 1 61 ARG QB 1 62 VAL H . . 3.890 3.258 2.917 3.516 . 0 0 "[ . 1 . 2]" 1
861 1 61 ARG QB 1 99 TYR QD . . 3.900 3.056 2.524 3.470 . 0 0 "[ . 1 . 2]" 1
862 1 61 ARG HB2 1 62 VAL H . . 4.550 4.359 4.178 4.499 . 0 0 "[ . 1 . 2]" 1
863 1 61 ARG HB2 1 99 TYR QD . . 4.440 3.263 2.808 3.698 . 0 0 "[ . 1 . 2]" 1
864 1 61 ARG HB3 1 62 VAL H . . 4.550 3.366 2.977 3.670 . 0 0 "[ . 1 . 2]" 1
865 1 61 ARG HB3 1 99 TYR QD . . 4.440 3.732 2.859 4.400 . 0 0 "[ . 1 . 2]" 1
866 1 61 ARG QD 1 61 ARG QH2 . . 3.840 3.650 3.610 3.682 . 0 0 "[ . 1 . 2]" 1
867 1 61 ARG QD 1 62 VAL H . . 5.340 4.839 3.997 5.057 . 0 0 "[ . 1 . 2]" 1
868 1 61 ARG QD 1 99 TYR QD . . 4.590 4.307 3.768 4.592 0.002 1 0 "[ . 1 . 2]" 1
869 1 61 ARG QG 1 99 TYR QD . . 4.680 4.075 3.439 4.679 . 0 0 "[ . 1 . 2]" 1
870 1 62 VAL H 1 62 VAL HB . . 3.510 2.951 2.782 3.089 . 0 0 "[ . 1 . 2]" 1
871 1 62 VAL H 1 62 VAL MG1 . . 3.410 1.916 1.836 2.046 . 0 0 "[ . 1 . 2]" 1
872 1 62 VAL H 1 62 VAL MG2 . . 4.100 3.733 3.696 3.778 . 0 0 "[ . 1 . 2]" 1
873 1 62 VAL H 1 63 LEU H . . 4.860 4.432 4.077 4.546 . 0 0 "[ . 1 . 2]" 1
874 1 62 VAL HA 1 62 VAL MG1 . . 3.480 3.175 3.166 3.187 . 0 0 "[ . 1 . 2]" 1
875 1 62 VAL HA 1 62 VAL MG2 . . 3.300 2.469 2.429 2.538 . 0 0 "[ . 1 . 2]" 1
876 1 62 VAL HA 1 63 LEU H . . 3.140 2.151 2.141 2.252 . 0 0 "[ . 1 . 2]" 1
877 1 62 VAL HA 1 63 LEU MD1 . . 4.780 4.655 4.561 4.782 0.002 20 0 "[ . 1 . 2]" 1
878 1 62 VAL HA 1 63 LEU HG . . 4.750 3.863 3.668 4.004 . 0 0 "[ . 1 . 2]" 1
879 1 62 VAL HA 1 64 ARG H . . 4.340 4.180 3.972 4.331 . 0 0 "[ . 1 . 2]" 1
880 1 62 VAL HA 1 92 LEU H . . 4.700 4.045 3.644 4.472 . 0 0 "[ . 1 . 2]" 1
881 1 62 VAL HA 1 93 VAL HA . . 3.730 2.831 2.573 3.145 . 0 0 "[ . 1 . 2]" 1
882 1 62 VAL HA 1 93 VAL MG1 . . 3.340 2.913 2.527 3.332 . 0 0 "[ . 1 . 2]" 1
883 1 62 VAL HA 1 94 LEU H . . 4.660 4.383 3.974 4.658 . 0 0 "[ . 1 . 2]" 1
884 1 62 VAL HB 1 70 VAL MG2 . . 5.500 4.855 4.605 5.153 . 0 0 "[ . 1 . 2]" 1
885 1 62 VAL MG1 1 63 LEU H . . 4.250 4.183 4.118 4.245 . 0 0 "[ . 1 . 2]" 1
886 1 62 VAL MG1 1 64 ARG H . . 5.270 5.057 4.634 5.213 . 0 0 "[ . 1 . 2]" 1
887 1 62 VAL MG1 1 65 ILE HG12 . . 5.500 4.482 3.922 4.905 . 0 0 "[ . 1 . 2]" 1
888 1 62 VAL MG2 1 63 LEU H . . 3.590 2.681 2.400 3.324 . 0 0 "[ . 1 . 2]" 1
889 1 62 VAL MG2 1 63 LEU HB2 . . 4.400 4.233 4.119 4.383 . 0 0 "[ . 1 . 2]" 1
890 1 62 VAL MG2 1 64 ARG H . . 3.750 2.746 2.496 3.071 . 0 0 "[ . 1 . 2]" 1
891 1 62 VAL MG2 1 64 ARG HA . . 4.580 3.689 3.528 3.839 . 0 0 "[ . 1 . 2]" 1
892 1 62 VAL MG2 1 65 ILE H . . 3.960 3.884 3.764 3.966 0.006 10 0 "[ . 1 . 2]" 1
893 1 62 VAL MG2 1 65 ILE HA . . 4.620 3.169 2.808 3.298 . 0 0 "[ . 1 . 2]" 1
894 1 62 VAL MG2 1 65 ILE HB . . 3.420 3.049 2.839 3.300 . 0 0 "[ . 1 . 2]" 1
895 1 62 VAL MG2 1 65 ILE HG12 . . 3.500 3.143 2.861 3.381 . 0 0 "[ . 1 . 2]" 1
896 1 62 VAL MG2 1 70 VAL HB . . 5.500 5.005 4.228 5.501 0.001 1 0 "[ . 1 . 2]" 1
897 1 62 VAL MG2 1 70 VAL MG2 . . 3.050 2.591 2.109 2.998 . 0 0 "[ . 1 . 2]" 1
898 1 62 VAL MG2 1 78 VAL MG1 . . 4.140 3.767 3.253 4.143 0.003 10 0 "[ . 1 . 2]" 1
899 1 62 VAL MG2 1 91 LEU HA . . 4.570 3.277 2.736 3.656 . 0 0 "[ . 1 . 2]" 1
900 1 62 VAL MG2 1 92 LEU H . . 3.920 2.715 2.231 3.182 . 0 0 "[ . 1 . 2]" 1
901 1 63 LEU H 1 63 LEU HB2 . . 3.980 2.500 2.424 2.700 . 0 0 "[ . 1 . 2]" 1
902 1 63 LEU H 1 63 LEU HB3 . . 4.170 3.616 3.591 3.646 . 0 0 "[ . 1 . 2]" 1
903 1 63 LEU H 1 63 LEU MD1 . . 4.090 3.265 3.127 3.416 . 0 0 "[ . 1 . 2]" 1
904 1 63 LEU H 1 63 LEU MD2 . . 4.440 3.774 3.400 3.971 . 0 0 "[ . 1 . 2]" 1
905 1 63 LEU H 1 63 LEU HG . . 3.270 2.405 1.927 2.660 . 0 0 "[ . 1 . 2]" 1
906 1 63 LEU H 1 64 ARG H . . 3.300 2.559 2.384 3.062 . 0 0 "[ . 1 . 2]" 1
907 1 63 LEU H 1 92 LEU H . . 4.400 3.782 3.430 4.275 . 0 0 "[ . 1 . 2]" 1
908 1 63 LEU H 1 93 VAL HA . . 3.720 3.473 3.241 3.699 . 0 0 "[ . 1 . 2]" 1
909 1 63 LEU H 1 94 LEU H . . 4.930 4.544 3.960 4.886 . 0 0 "[ . 1 . 2]" 1
910 1 63 LEU HA 1 63 LEU MD1 . . 4.450 3.937 3.912 3.983 . 0 0 "[ . 1 . 2]" 1
911 1 63 LEU HA 1 63 LEU MD2 . . 3.160 2.458 2.223 2.667 . 0 0 "[ . 1 . 2]" 1
912 1 63 LEU HB2 1 63 LEU MD1 . . 3.310 2.172 2.008 2.242 . 0 0 "[ . 1 . 2]" 1
913 1 63 LEU HB2 1 64 ARG H . . 3.870 2.297 2.090 2.456 . 0 0 "[ . 1 . 2]" 1
914 1 63 LEU HB2 1 69 PHE QE . . 5.130 4.876 3.831 5.126 . 0 0 "[ . 1 . 2]" 1
915 1 63 LEU HB2 1 92 LEU QB . . 4.130 2.607 2.239 2.777 . 0 0 "[ . 1 . 2]" 1
916 1 63 LEU HB3 1 63 LEU MD2 . . 3.280 2.128 2.015 2.268 . 0 0 "[ . 1 . 2]" 1
917 1 63 LEU HB3 1 64 ARG H . . 4.320 3.430 3.290 3.617 . 0 0 "[ . 1 . 2]" 1
918 1 63 LEU HB3 1 69 PHE QD . . 4.390 3.970 3.234 4.280 . 0 0 "[ . 1 . 2]" 1
919 1 63 LEU MD1 1 64 ARG H . . 4.580 3.980 3.587 4.180 . 0 0 "[ . 1 . 2]" 1
920 1 63 LEU MD1 1 92 LEU HA . . 5.150 4.543 3.930 4.877 . 0 0 "[ . 1 . 2]" 1
921 1 63 LEU MD1 1 92 LEU QB . . 3.780 2.584 1.931 2.936 . 0 0 "[ . 1 . 2]" 1
922 1 63 LEU MD1 1 93 VAL HA . . 4.460 3.836 3.373 4.066 . 0 0 "[ . 1 . 2]" 1
923 1 63 LEU MD1 1 94 LEU H . . 4.440 3.525 2.880 4.001 . 0 0 "[ . 1 . 2]" 1
924 1 63 LEU MD1 1 94 LEU HB2 . . 4.000 2.071 1.869 2.481 . 0 0 "[ . 1 . 2]" 1
925 1 63 LEU MD1 1 94 LEU QB . . 3.420 2.046 1.851 2.418 . 0 0 "[ . 1 . 2]" 1
926 1 63 LEU MD1 1 94 LEU HB3 . . 4.000 3.274 2.363 3.857 . 0 0 "[ . 1 . 2]" 1
927 1 63 LEU MD1 1 109 LEU HA . . 5.320 4.924 4.356 5.309 . 0 0 "[ . 1 . 2]" 1
928 1 63 LEU MD1 1 109 LEU MD2 . . 4.000 3.599 2.949 3.940 . 0 0 "[ . 1 . 2]" 1
929 1 63 LEU MD1 1 112 LEU H . . 5.050 4.939 4.688 5.055 0.005 20 0 "[ . 1 . 2]" 1
930 1 63 LEU MD1 1 112 LEU HB2 . . 4.010 2.637 2.333 3.004 . 0 0 "[ . 1 . 2]" 1
931 1 63 LEU MD1 1 112 LEU HB3 . . 4.250 2.726 2.315 3.082 . 0 0 "[ . 1 . 2]" 1
932 1 63 LEU MD2 1 69 PHE QD . . 4.980 4.870 4.442 4.984 0.004 19 0 "[ . 1 . 2]" 1
933 1 63 LEU MD2 1 69 PHE QE . . 4.010 3.418 2.654 3.609 . 0 0 "[ . 1 . 2]" 1
934 1 63 LEU MD2 1 94 LEU H . . 4.800 4.433 3.698 4.792 . 0 0 "[ . 1 . 2]" 1
935 1 63 LEU MD2 1 94 LEU QB . . 4.100 2.996 2.375 3.505 . 0 0 "[ . 1 . 2]" 1
936 1 63 LEU MD2 1 99 TYR QD . . 3.620 3.021 2.634 3.520 . 0 0 "[ . 1 . 2]" 1
937 1 63 LEU MD2 1 99 TYR QE . . 3.390 2.280 1.942 2.756 . 0 0 "[ . 1 . 2]" 1
938 1 63 LEU MD2 1 109 LEU HA . . 4.530 4.137 3.941 4.382 . 0 0 "[ . 1 . 2]" 1
939 1 63 LEU MD2 1 109 LEU HB2 . . 4.030 3.856 3.317 4.031 0.001 8 0 "[ . 1 . 2]" 1
940 1 63 LEU MD2 1 109 LEU QB . . 3.160 2.490 1.987 2.664 . 0 0 "[ . 1 . 2]" 1
941 1 63 LEU MD2 1 109 LEU HB3 . . 4.030 2.523 2.002 2.703 . 0 0 "[ . 1 . 2]" 1
942 1 63 LEU MD2 1 109 LEU MD1 . . 3.230 2.777 2.252 3.116 . 0 0 "[ . 1 . 2]" 1
943 1 63 LEU MD2 1 109 LEU MD2 . . 3.350 2.432 1.992 2.670 . 0 0 "[ . 1 . 2]" 1
944 1 63 LEU HG 1 93 VAL HA . . 4.650 3.853 3.236 4.349 . 0 0 "[ . 1 . 2]" 1
945 1 64 ARG H 1 64 ARG QB . . 3.470 2.644 2.496 2.937 . 0 0 "[ . 1 . 2]" 1
946 1 64 ARG H 1 64 ARG QG . . 4.120 2.957 2.450 3.203 . 0 0 "[ . 1 . 2]" 1
947 1 64 ARG H 1 70 VAL MG2 . . 4.720 4.268 3.897 4.720 . 0 0 "[ . 1 . 2]" 1
948 1 64 ARG H 1 92 LEU H . . 3.700 3.160 2.839 3.410 . 0 0 "[ . 1 . 2]" 1
949 1 64 ARG H 1 92 LEU HB2 . . 4.480 2.293 2.108 2.416 . 0 0 "[ . 1 . 2]" 1
950 1 64 ARG H 1 92 LEU QB . . 3.610 2.272 2.093 2.390 . 0 0 "[ . 1 . 2]" 1
951 1 64 ARG H 1 92 LEU HB3 . . 4.480 3.705 3.304 3.976 . 0 0 "[ . 1 . 2]" 1
952 1 64 ARG H 1 92 LEU MD1 . . 4.730 3.329 3.063 3.621 . 0 0 "[ . 1 . 2]" 1
953 1 64 ARG H 1 92 LEU MD2 . . 5.190 5.031 4.891 5.158 . 0 0 "[ . 1 . 2]" 1
954 1 64 ARG H 1 92 LEU HG . . 4.730 4.471 4.185 4.717 . 0 0 "[ . 1 . 2]" 1
955 1 64 ARG HA 1 64 ARG HG2 . . 4.120 2.550 2.308 2.902 . 0 0 "[ . 1 . 2]" 1
956 1 64 ARG HA 1 64 ARG QG . . 3.590 2.436 2.268 2.748 . 0 0 "[ . 1 . 2]" 1
957 1 64 ARG HA 1 64 ARG HG3 . . 4.120 3.179 2.782 3.483 . 0 0 "[ . 1 . 2]" 1
958 1 64 ARG HA 1 65 ILE H . . 3.050 2.205 2.181 2.273 . 0 0 "[ . 1 . 2]" 1
959 1 64 ARG HA 1 65 ILE MG . . 4.870 4.205 4.096 4.307 . 0 0 "[ . 1 . 2]" 1
960 1 64 ARG HA 1 68 VAL H . . 4.710 3.741 3.556 3.999 . 0 0 "[ . 1 . 2]" 1
961 1 64 ARG HA 1 69 PHE HA . . 3.900 2.535 2.183 2.743 . 0 0 "[ . 1 . 2]" 1
962 1 64 ARG HA 1 69 PHE QD . . 4.800 3.912 3.241 4.179 . 0 0 "[ . 1 . 2]" 1
963 1 64 ARG HA 1 70 VAL H . . 3.640 2.545 2.294 2.804 . 0 0 "[ . 1 . 2]" 1
964 1 64 ARG HA 1 70 VAL MG1 . . 4.310 3.797 3.489 4.182 . 0 0 "[ . 1 . 2]" 1
965 1 64 ARG HA 1 70 VAL MG2 . . 3.700 2.759 2.331 3.202 . 0 0 "[ . 1 . 2]" 1
966 1 64 ARG HA 1 92 LEU MD1 . . 5.020 4.728 4.503 4.968 . 0 0 "[ . 1 . 2]" 1
967 1 64 ARG QB 1 64 ARG QD . . 3.260 2.098 2.025 2.146 . 0 0 "[ . 1 . 2]" 1
968 1 64 ARG QB 1 65 ILE H . . 3.470 2.938 2.781 3.025 . 0 0 "[ . 1 . 2]" 1
969 1 64 ARG QB 1 67 GLY H . . 3.860 3.277 3.203 3.381 . 0 0 "[ . 1 . 2]" 1
970 1 64 ARG QB 1 68 VAL H . . 4.170 2.467 2.222 2.863 . 0 0 "[ . 1 . 2]" 1
971 1 64 ARG QB 1 69 PHE QD . . 4.700 4.109 3.736 4.255 . 0 0 "[ . 1 . 2]" 1
972 1 64 ARG QB 1 70 VAL H . . 5.230 4.405 3.744 4.723 . 0 0 "[ . 1 . 2]" 1
973 1 64 ARG QB 1 92 LEU MD1 . . 4.200 2.190 1.981 2.516 . 0 0 "[ . 1 . 2]" 1
974 1 64 ARG HB2 1 65 ILE H . . 4.130 4.018 3.512 4.131 0.001 11 0 "[ . 1 . 2]" 1
975 1 64 ARG HB2 1 67 GLY H . . 4.450 4.082 3.346 4.361 . 0 0 "[ . 1 . 2]" 1
976 1 64 ARG HB2 1 92 LEU MD1 . . 4.810 2.209 1.992 2.548 . 0 0 "[ . 1 . 2]" 1
977 1 64 ARG HB3 1 65 ILE H . . 4.130 3.021 2.895 3.111 . 0 0 "[ . 1 . 2]" 1
978 1 64 ARG HB3 1 67 GLY H . . 4.450 3.493 3.308 4.112 . 0 0 "[ . 1 . 2]" 1
979 1 64 ARG HB3 1 92 LEU MD1 . . 4.810 3.618 3.340 3.967 . 0 0 "[ . 1 . 2]" 1
980 1 64 ARG QD 1 67 GLY HA2 . . 4.330 3.504 3.291 3.828 . 0 0 "[ . 1 . 2]" 1
981 1 64 ARG QD 1 67 GLY HA3 . . 5.260 4.961 4.637 5.235 . 0 0 "[ . 1 . 2]" 1
982 1 64 ARG QD 1 92 LEU MD1 . . 3.600 2.700 2.299 3.601 0.001 9 0 "[ . 1 . 2]" 1
983 1 64 ARG HD2 1 67 GLY HA2 . . 5.100 4.593 3.353 5.102 0.002 20 0 "[ . 1 . 2]" 1
984 1 64 ARG HD3 1 67 GLY HA2 . . 5.100 3.779 3.357 5.048 . 0 0 "[ . 1 . 2]" 1
985 1 64 ARG HE 1 69 PHE QD . . 4.720 2.964 1.973 4.085 . 0 0 "[ . 1 . 2]" 1
986 1 64 ARG HE 1 69 PHE QE . . 4.840 4.230 3.253 4.848 0.008 20 0 "[ . 1 . 2]" 1
987 1 64 ARG HE 1 92 LEU MD1 . . 4.660 4.365 2.639 4.661 0.001 10 0 "[ . 1 . 2]" 1
988 1 64 ARG QG 1 65 ILE H . . 4.450 4.081 3.869 4.374 . 0 0 "[ . 1 . 2]" 1
989 1 64 ARG QG 1 69 PHE HA . . 3.650 2.095 1.967 2.387 . 0 0 "[ . 1 . 2]" 1
990 1 64 ARG QG 1 70 VAL H . . 4.190 3.604 3.292 3.843 . 0 0 "[ . 1 . 2]" 1
991 1 64 ARG QG 1 92 LEU MD1 . . 4.290 3.007 2.521 3.480 . 0 0 "[ . 1 . 2]" 1
992 1 64 ARG HG2 1 69 PHE HA . . 4.320 2.110 1.999 2.406 . 0 0 "[ . 1 . 2]" 1
993 1 64 ARG HG2 1 69 PHE QD . . 3.860 2.108 1.999 2.268 . 0 0 "[ . 1 . 2]" 1
994 1 64 ARG HG2 1 92 LEU MD1 . . 4.990 4.252 3.848 4.559 . 0 0 "[ . 1 . 2]" 1
995 1 64 ARG HG3 1 69 PHE HA . . 4.320 3.602 2.921 4.050 . 0 0 "[ . 1 . 2]" 1
996 1 64 ARG HG3 1 69 PHE QD . . 3.860 2.872 1.997 3.568 . 0 0 "[ . 1 . 2]" 1
997 1 64 ARG HG3 1 92 LEU MD1 . . 4.990 3.081 2.556 3.620 . 0 0 "[ . 1 . 2]" 1
998 1 65 ILE H 1 65 ILE HB . . 3.510 2.688 2.618 2.820 . 0 0 "[ . 1 . 2]" 1
999 1 65 ILE H 1 65 ILE HG12 . . 4.610 4.519 4.426 4.611 0.001 12 0 "[ . 1 . 2]" 1
1000 1 65 ILE H 1 65 ILE MG . . 3.820 2.342 2.226 2.450 . 0 0 "[ . 1 . 2]" 1
1001 1 65 ILE H 1 67 GLY H . . 4.380 3.886 3.752 4.117 . 0 0 "[ . 1 . 2]" 1
1002 1 65 ILE H 1 68 VAL H . . 3.790 2.567 2.442 2.707 . 0 0 "[ . 1 . 2]" 1
1003 1 65 ILE H 1 68 VAL HB . . 4.300 3.313 3.127 3.487 . 0 0 "[ . 1 . 2]" 1
1004 1 65 ILE H 1 68 VAL MG1 . . 4.800 4.106 3.944 4.274 . 0 0 "[ . 1 . 2]" 1
1005 1 65 ILE H 1 68 VAL MG2 . . 4.590 4.501 4.386 4.589 . 0 0 "[ . 1 . 2]" 1
1006 1 65 ILE H 1 69 PHE HA . . 4.750 3.918 3.588 4.122 . 0 0 "[ . 1 . 2]" 1
1007 1 65 ILE H 1 70 VAL MG1 . . 3.680 2.812 2.382 3.231 . 0 0 "[ . 1 . 2]" 1
1008 1 65 ILE H 1 70 VAL MG2 . . 4.130 2.773 2.255 3.182 . 0 0 "[ . 1 . 2]" 1
1009 1 65 ILE HA 1 65 ILE MD . . 3.360 2.444 2.079 2.887 . 0 0 "[ . 1 . 2]" 1
1010 1 65 ILE HA 1 65 ILE HG12 . . 4.060 2.411 2.166 2.620 . 0 0 "[ . 1 . 2]" 1
1011 1 65 ILE HA 1 65 ILE HG13 . . 4.190 3.588 3.489 3.634 . 0 0 "[ . 1 . 2]" 1
1012 1 65 ILE HA 1 66 ASN H . . 2.980 2.144 2.141 2.157 . 0 0 "[ . 1 . 2]" 1
1013 1 65 ILE HA 1 70 VAL MG2 . . 4.360 3.996 3.703 4.322 . 0 0 "[ . 1 . 2]" 1
1014 1 65 ILE HA 1 91 LEU HA . . 4.200 3.111 2.973 3.325 . 0 0 "[ . 1 . 2]" 1
1015 1 65 ILE HA 1 91 LEU MD2 . . 3.730 2.510 2.238 2.894 . 0 0 "[ . 1 . 2]" 1
1016 1 65 ILE HB 1 65 ILE MD . . 3.250 3.218 3.196 3.226 . 0 0 "[ . 1 . 2]" 1
1017 1 65 ILE HB 1 66 ASN H . . 5.240 4.407 4.365 4.431 . 0 0 "[ . 1 . 2]" 1
1018 1 65 ILE HB 1 68 VAL H . . 5.180 4.861 4.631 5.003 . 0 0 "[ . 1 . 2]" 1
1019 1 65 ILE HB 1 68 VAL HB . . 4.730 4.573 4.440 4.692 . 0 0 "[ . 1 . 2]" 1
1020 1 65 ILE HB 1 70 VAL MG1 . . 3.790 2.688 2.287 3.000 . 0 0 "[ . 1 . 2]" 1
1021 1 65 ILE HB 1 70 VAL MG2 . . 4.400 2.060 1.959 2.370 . 0 0 "[ . 1 . 2]" 1
1022 1 65 ILE HB 1 81 LEU QD . . 4.750 4.194 3.743 4.755 0.005 6 0 "[ . 1 . 2]" 1
1023 1 65 ILE MD 1 65 ILE MG . . 2.760 1.942 1.858 2.182 . 0 0 "[ . 1 . 2]" 1
1024 1 65 ILE MD 1 66 ASN H . . 3.700 1.995 1.826 2.479 . 0 0 "[ . 1 . 2]" 1
1025 1 65 ILE MD 1 66 ASN QB . . 4.070 1.897 1.846 1.955 . 0 0 "[ . 1 . 2]" 1
1026 1 65 ILE MD 1 66 ASN HD21 . . 4.270 3.412 1.881 3.678 . 0 0 "[ . 1 . 2]" 1
1027 1 65 ILE MD 1 66 ASN HD22 . . 4.850 4.641 2.753 4.855 0.005 2 0 "[ . 1 . 2]" 1
1028 1 65 ILE MD 1 68 VAL H . . 5.430 4.652 4.315 4.949 . 0 0 "[ . 1 . 2]" 1
1029 1 65 ILE MD 1 68 VAL HB . . 5.070 4.492 4.240 4.717 . 0 0 "[ . 1 . 2]" 1
1030 1 65 ILE MD 1 78 VAL MG1 . . 4.410 3.755 3.397 4.108 . 0 0 "[ . 1 . 2]" 1
1031 1 65 ILE MD 1 81 LEU H . . 5.500 5.180 4.275 5.501 0.001 8 0 "[ . 1 . 2]" 1
1032 1 65 ILE MD 1 81 LEU HA . . 5.120 4.783 3.956 5.119 . 0 0 "[ . 1 . 2]" 1
1033 1 65 ILE MD 1 81 LEU HB2 . . 3.980 3.446 2.817 3.786 . 0 0 "[ . 1 . 2]" 1
1034 1 65 ILE MD 1 81 LEU HB3 . . 3.900 2.994 1.980 3.783 . 0 0 "[ . 1 . 2]" 1
1035 1 65 ILE MD 1 82 VAL H . . 4.630 3.527 2.583 3.981 . 0 0 "[ . 1 . 2]" 1
1036 1 65 ILE MD 1 82 VAL HA . . 3.940 2.444 2.159 3.097 . 0 0 "[ . 1 . 2]" 1
1037 1 65 ILE MD 1 82 VAL MG2 . . 3.460 2.022 1.719 2.529 . 0 0 "[ . 1 . 2]" 1
1038 1 65 ILE MD 1 85 SER HB2 . . 4.830 4.291 3.427 4.790 . 0 0 "[ . 1 . 2]" 1
1039 1 65 ILE MD 1 85 SER HB3 . . 4.830 4.367 3.779 4.698 . 0 0 "[ . 1 . 2]" 1
1040 1 65 ILE MD 1 89 VAL HB . . 5.400 4.299 3.677 4.848 . 0 0 "[ . 1 . 2]" 1
1041 1 65 ILE MD 1 89 VAL MG1 . . 3.030 2.048 1.693 2.288 . 0 0 "[ . 1 . 2]" 1
1042 1 65 ILE MD 1 90 THR H . . 4.050 3.781 3.248 4.053 0.003 17 0 "[ . 1 . 2]" 1
1043 1 65 ILE HG12 1 65 ILE MG . . 3.310 3.190 3.161 3.200 . 0 0 "[ . 1 . 2]" 1
1044 1 65 ILE HG12 1 70 VAL MG1 . . 4.850 4.697 4.398 4.848 . 0 0 "[ . 1 . 2]" 1
1045 1 65 ILE HG12 1 70 VAL MG2 . . 4.220 4.013 3.784 4.223 0.003 15 0 "[ . 1 . 2]" 1
1046 1 65 ILE HG12 1 78 VAL MG1 . . 4.450 3.483 3.044 3.939 . 0 0 "[ . 1 . 2]" 1
1047 1 65 ILE HG12 1 91 LEU MD2 . . 3.850 2.015 1.867 2.306 . 0 0 "[ . 1 . 2]" 1
1048 1 65 ILE HG13 1 70 VAL MG2 . . 4.260 3.949 3.640 4.238 . 0 0 "[ . 1 . 2]" 1
1049 1 65 ILE HG13 1 82 VAL HB . . 4.890 4.763 4.567 4.890 . 0 0 "[ . 1 . 2]" 1
1050 1 65 ILE MG 1 68 VAL H . . 4.810 3.303 3.006 3.508 . 0 0 "[ . 1 . 2]" 1
1051 1 65 ILE MG 1 68 VAL HB . . 4.150 2.090 1.968 2.279 . 0 0 "[ . 1 . 2]" 1
1052 1 65 ILE MG 1 68 VAL MG1 . . 3.900 3.074 2.899 3.303 . 0 0 "[ . 1 . 2]" 1
1053 1 65 ILE MG 1 68 VAL MG2 . . 3.680 3.261 3.141 3.394 . 0 0 "[ . 1 . 2]" 1
1054 1 65 ILE MG 1 70 VAL HB . . 4.280 4.113 3.925 4.280 0.000 10 0 "[ . 1 . 2]" 1
1055 1 65 ILE MG 1 70 VAL MG2 . . 3.390 2.838 2.598 3.114 . 0 0 "[ . 1 . 2]" 1
1056 1 65 ILE MG 1 78 VAL HA . . 3.980 3.092 2.761 3.330 . 0 0 "[ . 1 . 2]" 1
1057 1 65 ILE MG 1 78 VAL HB . . 5.110 5.002 4.701 5.111 0.001 13 0 "[ . 1 . 2]" 1
1058 1 65 ILE MG 1 78 VAL MG1 . . 3.020 2.533 2.246 2.741 . 0 0 "[ . 1 . 2]" 1
1059 1 65 ILE MG 1 78 VAL MG2 . . 4.180 3.662 3.283 4.024 . 0 0 "[ . 1 . 2]" 1
1060 1 65 ILE MG 1 81 LEU H . . 5.470 4.284 3.934 4.574 . 0 0 "[ . 1 . 2]" 1
1061 1 65 ILE MG 1 81 LEU HB2 . . 3.560 2.320 2.043 2.703 . 0 0 "[ . 1 . 2]" 1
1062 1 65 ILE MG 1 81 LEU QD . . 4.170 2.100 1.735 2.712 . 0 0 "[ . 1 . 2]" 1
1063 1 65 ILE MG 1 81 LEU HG . . 4.310 3.402 1.948 4.298 . 0 0 "[ . 1 . 2]" 1
1064 1 65 ILE MG 1 82 VAL H . . 4.350 3.974 3.462 4.299 . 0 0 "[ . 1 . 2]" 1
1065 1 65 ILE MG 1 82 VAL HA . . 4.880 4.470 4.123 4.880 . 13 0 "[ . 1 . 2]" 1
1066 1 65 ILE MG 1 82 VAL MG2 . . 4.020 3.328 3.024 3.728 . 0 0 "[ . 1 . 2]" 1
1067 1 66 ASN H 1 66 ASN HD22 . . 5.500 5.336 3.776 5.513 0.013 17 0 "[ . 1 . 2]" 1
1068 1 66 ASN H 1 67 GLY H . . 3.730 2.804 2.732 2.874 . 0 0 "[ . 1 . 2]" 1
1069 1 66 ASN H 1 89 VAL MG1 . . 4.350 3.171 2.534 3.698 . 0 0 "[ . 1 . 2]" 1
1070 1 66 ASN H 1 90 THR H . . 3.910 3.531 3.080 3.891 . 0 0 "[ . 1 . 2]" 1
1071 1 66 ASN H 1 90 THR HB . . 4.090 3.611 3.294 4.005 . 0 0 "[ . 1 . 2]" 1
1072 1 66 ASN H 1 90 THR MG . . 4.730 4.330 4.037 4.690 . 0 0 "[ . 1 . 2]" 1
1073 1 66 ASN H 1 91 LEU HA . . 4.370 3.421 3.149 3.726 . 0 0 "[ . 1 . 2]" 1
1074 1 66 ASN H 1 91 LEU MD2 . . 4.570 2.958 2.603 3.335 . 0 0 "[ . 1 . 2]" 1
1075 1 66 ASN H 1 91 LEU HG . . 5.500 4.414 4.048 5.086 . 0 0 "[ . 1 . 2]" 1
1076 1 66 ASN HA 1 67 GLY H . . 3.470 2.952 2.878 2.988 . 0 0 "[ . 1 . 2]" 1
1077 1 66 ASN HA 1 89 VAL MG1 . . 4.460 3.423 2.653 4.235 . 0 0 "[ . 1 . 2]" 1
1078 1 66 ASN HA 1 90 THR HB . . 3.530 2.621 2.197 2.893 . 0 0 "[ . 1 . 2]" 1
1079 1 66 ASN HA 1 90 THR MG . . 4.310 4.131 3.745 4.312 0.002 8 0 "[ . 1 . 2]" 1
1080 1 66 ASN QB 1 66 ASN HD22 . . 3.670 3.335 3.267 3.418 . 0 0 "[ . 1 . 2]" 1
1081 1 66 ASN QB 1 67 GLY H . . 4.400 3.777 3.737 3.839 . 0 0 "[ . 1 . 2]" 1
1082 1 66 ASN QB 1 68 VAL H . . 4.580 4.393 4.043 4.581 0.001 20 0 "[ . 1 . 2]" 1
1083 1 66 ASN QB 1 68 VAL MG2 . . 4.260 3.345 3.097 3.504 . 0 0 "[ . 1 . 2]" 1
1084 1 66 ASN HD21 1 85 SER QB . . 4.070 2.747 2.137 3.976 . 0 0 "[ . 1 . 2]" 1
1085 1 66 ASN HD21 1 85 SER HG . . 4.360 2.813 1.900 4.164 . 0 0 "[ . 1 . 2]" 1
1086 1 66 ASN HD21 1 89 VAL HA . . 4.510 2.370 1.916 3.656 . 0 0 "[ . 1 . 2]" 1
1087 1 66 ASN HD21 1 89 VAL MG1 . . 4.320 2.236 1.848 2.571 . 0 0 "[ . 1 . 2]" 1
1088 1 66 ASN HD21 1 91 LEU MD2 . . 5.500 4.891 3.090 5.360 . 0 0 "[ . 1 . 2]" 1
1089 1 66 ASN HD22 1 85 SER HA . . 4.390 3.402 2.530 4.322 . 0 0 "[ . 1 . 2]" 1
1090 1 66 ASN HD22 1 85 SER HB2 . . 4.740 4.027 2.106 4.624 . 0 0 "[ . 1 . 2]" 1
1091 1 66 ASN HD22 1 85 SER QB . . 3.930 2.612 2.044 3.819 . 0 0 "[ . 1 . 2]" 1
1092 1 66 ASN HD22 1 85 SER HB3 . . 4.740 2.759 2.120 4.501 . 0 0 "[ . 1 . 2]" 1
1093 1 66 ASN HD22 1 85 SER HG . . 4.350 3.472 1.902 4.235 . 0 0 "[ . 1 . 2]" 1
1094 1 66 ASN HD22 1 89 VAL HA . . 4.760 2.942 2.083 3.466 . 0 0 "[ . 1 . 2]" 1
1095 1 66 ASN HD22 1 89 VAL MG1 . . 3.830 3.487 1.738 3.828 . 0 0 "[ . 1 . 2]" 1
1096 1 66 ASN HD22 1 90 THR H . . 4.520 3.457 1.995 3.953 . 0 0 "[ . 1 . 2]" 1
1097 1 67 GLY H 1 68 VAL H . . 3.710 2.382 2.273 2.521 . 0 0 "[ . 1 . 2]" 1
1098 1 67 GLY H 1 68 VAL MG2 . . 5.190 4.105 4.016 4.194 . 0 0 "[ . 1 . 2]" 1
1099 1 67 GLY H 1 90 THR HB . . 4.780 4.007 3.471 4.647 . 0 0 "[ . 1 . 2]" 1
1100 1 67 GLY H 1 90 THR MG . . 5.500 4.418 3.963 4.770 . 0 0 "[ . 1 . 2]" 1
1101 1 67 GLY H 1 92 LEU MD1 . . 5.500 4.735 4.040 5.194 . 0 0 "[ . 1 . 2]" 1
1102 1 67 GLY HA2 1 68 VAL MG2 . . 5.160 4.161 4.075 4.246 . 0 0 "[ . 1 . 2]" 1
1103 1 67 GLY HA2 1 92 LEU MD1 . . 5.420 4.347 3.526 4.898 . 0 0 "[ . 1 . 2]" 1
1104 1 68 VAL H 1 68 VAL HB . . 3.080 2.859 2.762 2.957 . 0 0 "[ . 1 . 2]" 1
1105 1 68 VAL H 1 68 VAL MG1 . . 4.030 3.920 3.876 3.953 . 0 0 "[ . 1 . 2]" 1
1106 1 68 VAL H 1 68 VAL MG2 . . 3.120 3.003 2.767 3.109 . 0 0 "[ . 1 . 2]" 1
1107 1 68 VAL H 1 70 VAL MG1 . . 4.610 4.362 4.231 4.588 . 0 0 "[ . 1 . 2]" 1
1108 1 68 VAL HA 1 68 VAL MG1 . . 3.250 2.375 2.292 2.474 . 0 0 "[ . 1 . 2]" 1
1109 1 68 VAL HA 1 68 VAL MG2 . . 3.240 2.392 2.313 2.466 . 0 0 "[ . 1 . 2]" 1
1110 1 68 VAL HA 1 69 PHE H . . 2.920 2.145 2.140 2.164 . 0 0 "[ . 1 . 2]" 1
1111 1 68 VAL HA 1 69 PHE HB2 . . 5.040 4.368 4.269 4.494 . 0 0 "[ . 1 . 2]" 1
1112 1 68 VAL HA 1 69 PHE QB . . 4.200 4.067 4.042 4.088 . 0 0 "[ . 1 . 2]" 1
1113 1 68 VAL HA 1 69 PHE HB3 . . 5.040 4.856 4.700 4.998 . 0 0 "[ . 1 . 2]" 1
1114 1 68 VAL HB 1 69 PHE H . . 4.660 4.269 4.125 4.350 . 0 0 "[ . 1 . 2]" 1
1115 1 68 VAL MG1 1 69 PHE H . . 3.490 2.646 2.301 2.930 . 0 0 "[ . 1 . 2]" 1
1116 1 68 VAL MG1 1 69 PHE QB . . 4.690 3.727 3.572 3.887 . 0 0 "[ . 1 . 2]" 1
1117 1 68 VAL MG1 1 70 VAL H . . 5.250 4.416 4.032 4.713 . 0 0 "[ . 1 . 2]" 1
1118 1 68 VAL MG1 1 70 VAL MG1 . . 3.060 2.432 2.185 2.690 . 0 0 "[ . 1 . 2]" 1
1119 1 68 VAL MG2 1 69 PHE H . . 4.230 4.068 3.927 4.176 . 0 0 "[ . 1 . 2]" 1
1120 1 68 VAL MG2 1 70 VAL MG1 . . 4.290 4.179 4.039 4.287 . 0 0 "[ . 1 . 2]" 1
1121 1 69 PHE H 1 69 PHE HB2 . . 3.330 2.310 2.218 2.388 . 0 0 "[ . 1 . 2]" 1
1122 1 69 PHE H 1 69 PHE HB3 . . 3.330 2.779 2.681 2.895 . 0 0 "[ . 1 . 2]" 1
1123 1 69 PHE H 1 69 PHE QD . . 4.100 4.042 3.928 4.116 0.016 10 0 "[ . 1 . 2]" 1
1124 1 69 PHE H 1 70 VAL H . . 4.610 4.404 4.283 4.489 . 0 0 "[ . 1 . 2]" 1
1125 1 69 PHE HA 1 69 PHE QD . . 3.590 2.348 2.089 2.655 . 0 0 "[ . 1 . 2]" 1
1126 1 69 PHE HA 1 70 VAL H . . 3.180 2.151 2.139 2.186 . 0 0 "[ . 1 . 2]" 1
1127 1 69 PHE HA 1 70 VAL MG2 . . 4.270 3.714 3.537 3.841 . 0 0 "[ . 1 . 2]" 1
1128 1 69 PHE QB 1 70 VAL H . . 4.440 3.871 3.774 3.959 . 0 0 "[ . 1 . 2]" 1
1129 1 69 PHE QB 1 110 LYS QD . . 5.120 3.957 2.581 5.066 . 0 0 "[ . 1 . 2]" 1
1130 1 69 PHE QD 1 70 VAL H . . 4.040 3.740 3.324 4.040 . 15 0 "[ . 1 . 2]" 1
1131 1 69 PHE QD 1 71 ASP H . . 4.630 3.313 2.869 3.644 . 0 0 "[ . 1 . 2]" 1
1132 1 69 PHE QD 1 110 LYS HA . . 4.080 3.014 2.127 3.457 . 0 0 "[ . 1 . 2]" 1
1133 1 69 PHE QD 1 110 LYS QB . . 5.150 4.120 2.195 4.824 . 0 0 "[ . 1 . 2]" 1
1134 1 69 PHE QD 1 110 LYS QD . . 4.510 3.570 2.531 4.326 . 0 0 "[ . 1 . 2]" 1
1135 1 69 PHE QD 1 110 LYS QE . . 4.060 3.210 2.245 4.060 . 4 0 "[ . 1 . 2]" 1
1136 1 69 PHE QD 1 110 LYS HG2 . . 4.750 3.490 2.750 4.763 0.013 10 0 "[ . 1 . 2]" 1
1137 1 69 PHE QD 1 110 LYS HG3 . . 4.750 4.172 3.375 4.739 . 0 0 "[ . 1 . 2]" 1
1138 1 69 PHE QE 1 71 ASP HB2 . . 4.330 3.102 2.645 3.849 . 0 0 "[ . 1 . 2]" 1
1139 1 69 PHE QE 1 71 ASP HB3 . . 4.330 2.577 2.080 3.849 . 0 0 "[ . 1 . 2]" 1
1140 1 69 PHE QE 1 72 LYS H . . 4.260 4.100 3.861 4.265 0.005 20 0 "[ . 1 . 2]" 1
1141 1 69 PHE QE 1 109 LEU HA . . 5.120 4.886 4.483 5.120 . 0 0 "[ . 1 . 2]" 1
1142 1 69 PHE QE 1 109 LEU HB2 . . 4.310 3.322 2.705 3.811 . 0 0 "[ . 1 . 2]" 1
1143 1 69 PHE QE 1 109 LEU QB . . 3.610 2.873 2.339 3.253 . 0 0 "[ . 1 . 2]" 1
1144 1 69 PHE QE 1 109 LEU HB3 . . 4.310 3.160 2.560 3.553 . 0 0 "[ . 1 . 2]" 1
1145 1 69 PHE QE 1 109 LEU MD1 . . 4.440 4.036 3.347 4.384 . 0 0 "[ . 1 . 2]" 1
1146 1 69 PHE QE 1 110 LYS H . . 4.390 3.690 2.926 4.242 . 0 0 "[ . 1 . 2]" 1
1147 1 69 PHE QE 1 110 LYS HA . . 4.300 2.722 2.266 3.248 . 0 0 "[ . 1 . 2]" 1
1148 1 69 PHE QE 1 110 LYS HB2 . . 5.500 4.686 3.722 5.126 . 0 0 "[ . 1 . 2]" 1
1149 1 69 PHE QE 1 110 LYS QB . . 4.680 4.042 2.328 4.662 . 0 0 "[ . 1 . 2]" 1
1150 1 69 PHE QE 1 110 LYS HB3 . . 5.500 4.501 2.352 5.487 . 0 0 "[ . 1 . 2]" 1
1151 1 69 PHE QE 1 110 LYS QD . . 4.850 3.649 2.513 4.422 . 0 0 "[ . 1 . 2]" 1
1152 1 69 PHE QE 1 110 LYS HG2 . . 5.480 3.415 2.689 4.920 . 0 0 "[ . 1 . 2]" 1
1153 1 69 PHE QE 1 110 LYS HG3 . . 5.480 3.671 2.803 5.161 . 0 0 "[ . 1 . 2]" 1
1154 1 69 PHE HZ 1 71 ASP HB2 . . 4.520 3.001 2.515 4.178 . 0 0 "[ . 1 . 2]" 1
1155 1 69 PHE HZ 1 71 ASP QB . . 3.900 2.674 2.380 3.107 . 0 0 "[ . 1 . 2]" 1
1156 1 69 PHE HZ 1 71 ASP HB3 . . 4.520 3.127 2.442 3.882 . 0 0 "[ . 1 . 2]" 1
1157 1 69 PHE HZ 1 109 LEU H . . 4.720 4.423 3.833 4.709 . 0 0 "[ . 1 . 2]" 1
1158 1 69 PHE HZ 1 109 LEU QB . . 3.780 2.684 1.909 3.181 . 0 0 "[ . 1 . 2]" 1
1159 1 69 PHE HZ 1 109 LEU MD1 . . 4.440 3.481 2.390 4.170 . 0 0 "[ . 1 . 2]" 1
1160 1 69 PHE HZ 1 110 LYS H . . 4.520 3.714 2.925 4.289 . 0 0 "[ . 1 . 2]" 1
1161 1 70 VAL H 1 70 VAL MG1 . . 3.790 2.937 2.780 3.159 . 0 0 "[ . 1 . 2]" 1
1162 1 70 VAL H 1 70 VAL MG2 . . 3.180 1.959 1.883 2.162 . 0 0 "[ . 1 . 2]" 1
1163 1 70 VAL H 1 71 ASP H . . 3.360 2.913 2.578 3.340 . 0 0 "[ . 1 . 2]" 1
1164 1 70 VAL HA 1 70 VAL MG1 . . 3.220 2.279 2.172 2.390 . 0 0 "[ . 1 . 2]" 1
1165 1 70 VAL HA 1 73 GLU H . . 3.580 3.005 2.884 3.242 . 0 0 "[ . 1 . 2]" 1
1166 1 70 VAL HA 1 73 GLU HB2 . . 4.480 2.379 2.186 2.688 . 0 0 "[ . 1 . 2]" 1
1167 1 70 VAL HA 1 73 GLU HB3 . . 4.210 3.833 3.583 4.104 . 0 0 "[ . 1 . 2]" 1
1168 1 70 VAL HA 1 73 GLU HG2 . . 3.820 2.834 2.068 3.786 . 0 0 "[ . 1 . 2]" 1
1169 1 70 VAL HA 1 73 GLU HG3 . . 3.820 2.449 2.001 2.972 . 0 0 "[ . 1 . 2]" 1
1170 1 70 VAL HA 1 78 VAL MG2 . . 4.440 3.786 3.506 4.051 . 0 0 "[ . 1 . 2]" 1
1171 1 70 VAL HB 1 73 GLU HB2 . . 3.290 2.471 2.008 2.907 . 0 0 "[ . 1 . 2]" 1
1172 1 70 VAL HB 1 73 GLU HB3 . . 4.180 3.733 3.150 4.179 . 0 0 "[ . 1 . 2]" 1
1173 1 70 VAL HB 1 78 VAL HA . . 4.860 4.197 3.610 4.559 . 0 0 "[ . 1 . 2]" 1
1174 1 70 VAL HB 1 78 VAL MG1 . . 3.760 3.256 2.229 3.743 . 0 0 "[ . 1 . 2]" 1
1175 1 70 VAL HB 1 78 VAL MG2 . . 3.180 1.933 1.847 2.011 . 0 0 "[ . 1 . 2]" 1
1176 1 70 VAL MG1 1 73 GLU H . . 4.840 4.572 4.350 4.785 . 0 0 "[ . 1 . 2]" 1
1177 1 70 VAL MG1 1 73 GLU HB2 . . 4.320 2.998 2.522 3.288 . 0 0 "[ . 1 . 2]" 1
1178 1 70 VAL MG1 1 73 GLU HB3 . . 4.230 3.520 3.051 3.885 . 0 0 "[ . 1 . 2]" 1
1179 1 70 VAL MG1 1 73 GLU HG2 . . 4.340 3.770 3.269 4.223 . 0 0 "[ . 1 . 2]" 1
1180 1 70 VAL MG1 1 73 GLU QG . . 3.790 2.600 1.970 3.225 . 0 0 "[ . 1 . 2]" 1
1181 1 70 VAL MG1 1 73 GLU HG3 . . 4.340 2.659 1.983 3.359 . 0 0 "[ . 1 . 2]" 1
1182 1 70 VAL MG1 1 78 VAL H . . 4.560 4.468 4.054 4.562 0.002 6 0 "[ . 1 . 2]" 1
1183 1 70 VAL MG1 1 78 VAL HA . . 4.650 2.811 2.454 3.058 . 0 0 "[ . 1 . 2]" 1
1184 1 70 VAL MG1 1 78 VAL MG1 . . 3.420 2.746 1.946 3.182 . 0 0 "[ . 1 . 2]" 1
1185 1 70 VAL MG1 1 78 VAL MG2 . . 3.430 2.241 1.942 2.708 . 0 0 "[ . 1 . 2]" 1
1186 1 70 VAL MG2 1 71 ASP H . . 4.130 3.797 3.641 4.116 . 0 0 "[ . 1 . 2]" 1
1187 1 70 VAL MG2 1 71 ASP HA . . 4.580 3.914 3.679 4.153 . 0 0 "[ . 1 . 2]" 1
1188 1 70 VAL MG2 1 73 GLU HB3 . . 5.500 5.149 4.679 5.396 . 0 0 "[ . 1 . 2]" 1
1189 1 70 VAL MG2 1 78 VAL MG1 . . 3.370 2.507 1.898 2.896 . 0 0 "[ . 1 . 2]" 1
1190 1 70 VAL MG2 1 78 VAL MG2 . . 3.750 2.579 2.015 3.232 . 0 0 "[ . 1 . 2]" 1
1191 1 71 ASP H 1 71 ASP HB2 . . 3.750 2.774 2.203 3.674 . 0 0 "[ . 1 . 2]" 1
1192 1 71 ASP H 1 71 ASP HB3 . . 3.750 2.573 2.193 3.506 . 0 0 "[ . 1 . 2]" 1
1193 1 71 ASP H 1 72 LYS H . . 3.860 2.466 2.290 2.716 . 0 0 "[ . 1 . 2]" 1
1194 1 71 ASP QB 1 72 LYS H . . 3.670 2.695 2.411 3.337 . 0 0 "[ . 1 . 2]" 1
1195 1 71 ASP QB 1 72 LYS QB . . 4.480 3.877 3.489 4.487 0.007 9 0 "[ . 1 . 2]" 1
1196 1 72 LYS H 1 72 LYS HB2 . . 3.730 2.641 2.259 3.047 . 0 0 "[ . 1 . 2]" 1
1197 1 72 LYS H 1 72 LYS HB3 . . 3.730 3.022 2.410 3.680 . 0 0 "[ . 1 . 2]" 1
1198 1 72 LYS H 1 72 LYS HG2 . . 4.720 3.900 2.908 4.713 . 0 0 "[ . 1 . 2]" 1
1199 1 72 LYS H 1 72 LYS QG . . 3.990 3.510 2.833 4.016 0.026 5 0 "[ . 1 . 2]" 1
1200 1 72 LYS H 1 72 LYS HG3 . . 4.720 4.181 3.904 4.373 . 0 0 "[ . 1 . 2]" 1
1201 1 72 LYS H 1 73 GLU H . . 3.170 2.136 1.933 2.435 . 0 0 "[ . 1 . 2]" 1
1202 1 72 LYS HA 1 72 LYS HD2 . . 3.950 2.877 2.007 3.959 0.009 9 0 "[ . 1 . 2]" 1
1203 1 72 LYS HA 1 72 LYS QD . . 3.380 2.342 1.995 3.141 . 0 0 "[ . 1 . 2]" 1
1204 1 72 LYS HA 1 72 LYS HD3 . . 3.950 3.029 2.096 3.989 0.039 5 0 "[ . 1 . 2]" 1
1205 1 72 LYS HA 1 72 LYS QG . . 3.680 2.750 2.420 2.976 . 0 0 "[ . 1 . 2]" 1
1206 1 72 LYS QB 1 72 LYS QD . . 3.330 2.299 2.116 2.597 . 0 0 "[ . 1 . 2]" 1
1207 1 72 LYS QB 1 73 GLU H . . 4.000 3.043 2.924 3.676 . 0 0 "[ . 1 . 2]" 1
1208 1 72 LYS QE 1 72 LYS QG . . 3.320 2.229 2.035 2.567 . 0 0 "[ . 1 . 2]" 1
1209 1 72 LYS QG 1 73 GLU H . . 4.570 4.149 3.740 4.594 0.024 9 0 "[ . 1 . 2]" 1
1210 1 73 GLU H 1 73 GLU HB2 . . 3.330 2.439 2.239 2.654 . 0 0 "[ . 1 . 2]" 1
1211 1 73 GLU H 1 73 GLU HB3 . . 3.610 3.582 3.528 3.598 . 0 0 "[ . 1 . 2]" 1
1212 1 73 GLU H 1 73 GLU HG2 . . 4.010 2.521 1.915 3.738 . 0 0 "[ . 1 . 2]" 1
1213 1 73 GLU H 1 73 GLU QG . . 3.250 2.320 1.903 2.842 . 0 0 "[ . 1 . 2]" 1
1214 1 73 GLU H 1 73 GLU HG3 . . 4.010 3.392 2.278 3.883 . 0 0 "[ . 1 . 2]" 1
1215 1 73 GLU H 1 74 GLU H . . 4.690 4.635 4.601 4.649 . 0 0 "[ . 1 . 2]" 1
1216 1 73 GLU H 1 78 VAL MG2 . . 4.820 4.608 4.135 4.820 0.000 1 0 "[ . 1 . 2]" 1
1217 1 73 GLU HA 1 73 GLU HG2 . . 4.150 2.761 2.243 3.090 . 0 0 "[ . 1 . 2]" 1
1218 1 73 GLU HA 1 73 GLU HG3 . . 4.150 3.603 3.096 3.822 . 0 0 "[ . 1 . 2]" 1
1219 1 73 GLU HA 1 74 GLU H . . 3.000 2.387 2.192 2.540 . 0 0 "[ . 1 . 2]" 1
1220 1 73 GLU HA 1 77 GLN HB2 . . 5.060 4.093 3.430 4.386 . 0 0 "[ . 1 . 2]" 1
1221 1 73 GLU HA 1 78 VAL MG2 . . 5.160 4.718 4.127 5.059 . 0 0 "[ . 1 . 2]" 1
1222 1 73 GLU HB2 1 78 VAL MG2 . . 3.680 2.759 2.333 3.078 . 0 0 "[ . 1 . 2]" 1
1223 1 73 GLU HB3 1 74 GLU H . . 4.080 2.485 2.128 3.061 . 0 0 "[ . 1 . 2]" 1
1224 1 73 GLU HB3 1 77 GLN H . . 4.790 4.556 4.142 4.798 0.008 10 0 "[ . 1 . 2]" 1
1225 1 73 GLU HB3 1 78 VAL MG2 . . 3.840 2.844 2.112 3.177 . 0 0 "[ . 1 . 2]" 1
1226 1 73 GLU QG 1 74 GLU H . . 4.590 4.099 3.542 4.388 . 0 0 "[ . 1 . 2]" 1
1227 1 73 GLU QG 1 78 VAL MG2 . . 4.190 3.777 3.261 4.099 . 0 0 "[ . 1 . 2]" 1
1228 1 74 GLU H 1 74 GLU HB2 . . 3.980 2.605 2.187 3.652 . 0 0 "[ . 1 . 2]" 1
1229 1 74 GLU H 1 74 GLU QB . . 3.240 2.333 2.165 2.573 . 0 0 "[ . 1 . 2]" 1
1230 1 74 GLU H 1 74 GLU HB3 . . 3.980 2.965 2.477 3.623 . 0 0 "[ . 1 . 2]" 1
1231 1 74 GLU H 1 74 GLU HG2 . . 5.220 4.127 2.157 4.701 . 0 0 "[ . 1 . 2]" 1
1232 1 74 GLU H 1 74 GLU QG . . 4.360 3.549 2.139 4.086 . 0 0 "[ . 1 . 2]" 1
1233 1 74 GLU H 1 74 GLU HG3 . . 5.220 4.068 3.165 4.616 . 0 0 "[ . 1 . 2]" 1
1234 1 74 GLU H 1 77 GLN H . . 4.880 3.729 3.362 3.997 . 0 0 "[ . 1 . 2]" 1
1235 1 74 GLU H 1 77 GLN HB2 . . 3.640 2.329 1.950 2.670 . 0 0 "[ . 1 . 2]" 1
1236 1 74 GLU H 1 77 GLN HB3 . . 3.960 3.630 3.139 3.962 0.002 10 0 "[ . 1 . 2]" 1
1237 1 74 GLU H 1 77 GLN QG . . 4.050 2.770 2.122 3.446 . 0 0 "[ . 1 . 2]" 1
1238 1 74 GLU H 1 78 VAL H . . 5.500 4.512 4.134 4.899 . 0 0 "[ . 1 . 2]" 1
1239 1 74 GLU HA 1 76 ALA H . . 4.770 4.398 4.085 4.715 . 0 0 "[ . 1 . 2]" 1
1240 1 74 GLU HA 1 77 GLN HB2 . . 5.500 4.390 4.134 4.623 . 0 0 "[ . 1 . 2]" 1
1241 1 74 GLU HA 1 78 VAL MG2 . . 5.380 4.305 3.899 4.792 . 0 0 "[ . 1 . 2]" 1
1242 1 74 GLU QB 1 76 ALA H . . 3.840 3.033 2.351 3.604 . 0 0 "[ . 1 . 2]" 1
1243 1 74 GLU QB 1 76 ALA MB . . 4.260 3.238 2.924 3.673 . 0 0 "[ . 1 . 2]" 1
1244 1 74 GLU QB 1 77 GLN H . . 4.000 2.849 2.395 3.824 . 0 0 "[ . 1 . 2]" 1
1245 1 74 GLU HB2 1 77 GLN H . . 4.590 3.893 2.841 4.587 . 0 0 "[ . 1 . 2]" 1
1246 1 74 GLU HB3 1 77 GLN H . . 4.590 3.106 2.412 4.597 0.007 10 0 "[ . 1 . 2]" 1
1247 1 74 GLU QG 1 76 ALA H . . 4.790 3.137 1.931 4.613 . 0 0 "[ . 1 . 2]" 1
1248 1 74 GLU HG2 1 76 ALA H . . 5.500 3.605 1.943 5.420 . 0 0 "[ . 1 . 2]" 1
1249 1 74 GLU HG3 1 76 ALA H . . 5.500 4.102 1.980 5.493 . 0 0 "[ . 1 . 2]" 1
1250 1 75 HIS H 1 75 HIS HB3 . . 4.130 2.454 2.294 2.598 . 0 0 "[ . 1 . 2]" 1
1251 1 75 HIS H 1 76 ALA H . . 4.260 2.894 2.650 3.105 . 0 0 "[ . 1 . 2]" 1
1252 1 75 HIS HA 1 78 VAL H . . 4.220 3.360 3.080 3.626 . 0 0 "[ . 1 . 2]" 1
1253 1 75 HIS HA 1 78 VAL HB . . 3.840 2.930 2.314 3.389 . 0 0 "[ . 1 . 2]" 1
1254 1 75 HIS HA 1 78 VAL MG2 . . 3.940 2.861 2.304 3.183 . 0 0 "[ . 1 . 2]" 1
1255 1 75 HIS HB2 1 76 ALA H . . 4.420 3.929 3.707 4.162 . 0 0 "[ . 1 . 2]" 1
1256 1 75 HIS HB3 1 76 ALA H . . 3.520 2.578 2.231 2.943 . 0 0 "[ . 1 . 2]" 1
1257 1 75 HIS HB3 1 76 ALA MB . . 4.580 4.006 3.812 4.196 . 0 0 "[ . 1 . 2]" 1
1258 1 75 HIS HD2 1 79 VAL MG1 . . 5.500 4.410 2.987 5.499 . 0 0 "[ . 1 . 2]" 1
1259 1 75 HIS HE1 1 79 VAL MG1 . . 4.920 4.292 2.831 4.918 . 0 0 "[ . 1 . 2]" 1
1260 1 76 ALA H 1 76 ALA MB . . 2.950 2.194 2.080 2.253 . 0 0 "[ . 1 . 2]" 1
1261 1 76 ALA H 1 77 GLN H . . 3.610 2.670 2.448 2.996 . 0 0 "[ . 1 . 2]" 1
1262 1 76 ALA H 1 77 GLN HB2 . . 5.500 4.693 4.351 5.016 . 0 0 "[ . 1 . 2]" 1
1263 1 76 ALA HA 1 78 VAL H . . 4.720 4.437 3.970 4.642 . 0 0 "[ . 1 . 2]" 1
1264 1 76 ALA HA 1 79 VAL H . . 4.860 3.930 3.573 4.079 . 0 0 "[ . 1 . 2]" 1
1265 1 76 ALA HA 1 79 VAL HB . . 4.080 3.874 3.518 4.099 0.019 10 0 "[ . 1 . 2]" 1
1266 1 76 ALA HA 1 79 VAL MG1 . . 3.660 2.011 1.882 2.217 . 0 0 "[ . 1 . 2]" 1
1267 1 76 ALA HA 1 79 VAL MG2 . . 4.540 4.381 4.214 4.528 . 0 0 "[ . 1 . 2]" 1
1268 1 76 ALA MB 1 77 GLN H . . 3.530 2.769 2.512 2.986 . 0 0 "[ . 1 . 2]" 1
1269 1 76 ALA MB 1 77 GLN HA . . 4.550 3.863 3.789 3.959 . 0 0 "[ . 1 . 2]" 1
1270 1 76 ALA MB 1 77 GLN QG . . 4.390 3.445 3.147 3.820 . 0 0 "[ . 1 . 2]" 1
1271 1 76 ALA MB 1 78 VAL H . . 4.760 4.622 4.363 4.759 . 0 0 "[ . 1 . 2]" 1
1272 1 76 ALA MB 1 79 VAL MG1 . . 4.660 3.276 3.145 3.400 . 0 0 "[ . 1 . 2]" 1
1273 1 77 GLN H 1 77 GLN HB2 . . 3.270 2.275 2.183 2.458 . 0 0 "[ . 1 . 2]" 1
1274 1 77 GLN H 1 77 GLN HB3 . . 3.600 3.539 3.491 3.600 0.000 7 0 "[ . 1 . 2]" 1
1275 1 77 GLN H 1 77 GLN HG2 . . 4.410 2.927 2.287 3.914 . 0 0 "[ . 1 . 2]" 1
1276 1 77 GLN H 1 77 GLN QG . . 3.540 2.742 2.264 3.040 . 0 0 "[ . 1 . 2]" 1
1277 1 77 GLN H 1 77 GLN HG3 . . 4.410 3.704 2.614 4.183 . 0 0 "[ . 1 . 2]" 1
1278 1 77 GLN H 1 78 VAL H . . 3.180 2.485 2.275 2.672 . 0 0 "[ . 1 . 2]" 1
1279 1 77 GLN H 1 78 VAL HB . . 5.170 4.792 4.443 5.032 . 0 0 "[ . 1 . 2]" 1
1280 1 77 GLN H 1 78 VAL MG2 . . 4.440 3.897 3.531 4.214 . 0 0 "[ . 1 . 2]" 1
1281 1 77 GLN H 1 79 VAL H . . 4.900 4.306 3.737 4.681 . 0 0 "[ . 1 . 2]" 1
1282 1 77 GLN HA 1 77 GLN QE . . 3.960 3.072 1.914 3.960 . 12 0 "[ . 1 . 2]" 1
1283 1 77 GLN HA 1 77 GLN QG . . 3.710 2.600 2.145 2.907 . 0 0 "[ . 1 . 2]" 1
1284 1 77 GLN HA 1 81 LEU QD . . 4.750 4.254 3.899 4.684 . 0 0 "[ . 1 . 2]" 1
1285 1 77 GLN HB3 1 77 GLN QE . . 4.300 2.922 2.064 3.808 . 0 0 "[ . 1 . 2]" 1
1286 1 77 GLN HB3 1 78 VAL H . . 3.850 3.488 3.199 3.767 . 0 0 "[ . 1 . 2]" 1
1287 1 77 GLN HB3 1 78 VAL HA . . 5.290 4.207 4.030 4.469 . 0 0 "[ . 1 . 2]" 1
1288 1 77 GLN HB3 1 81 LEU QD . . 3.960 3.559 3.022 3.955 . 0 0 "[ . 1 . 2]" 1
1289 1 77 GLN QE 1 81 LEU QD . . 4.910 4.307 2.843 4.903 . 0 0 "[ . 1 . 2]" 1
1290 1 77 GLN QG 1 78 VAL H . . 4.730 4.286 4.061 4.452 . 0 0 "[ . 1 . 2]" 1
1291 1 78 VAL H 1 78 VAL HB . . 3.250 2.574 2.467 2.765 . 0 0 "[ . 1 . 2]" 1
1292 1 78 VAL H 1 78 VAL MG1 . . 3.870 3.771 3.756 3.814 . 0 0 "[ . 1 . 2]" 1
1293 1 78 VAL H 1 78 VAL MG2 . . 3.170 2.182 1.944 2.444 . 0 0 "[ . 1 . 2]" 1
1294 1 78 VAL H 1 79 VAL H . . 3.350 2.698 2.424 2.897 . 0 0 "[ . 1 . 2]" 1
1295 1 78 VAL H 1 81 LEU QD . . 5.280 4.230 3.691 4.533 . 0 0 "[ . 1 . 2]" 1
1296 1 78 VAL HA 1 78 VAL MG1 . . 3.370 2.319 2.095 2.458 . 0 0 "[ . 1 . 2]" 1
1297 1 78 VAL HA 1 78 VAL MG2 . . 3.260 2.392 2.259 2.513 . 0 0 "[ . 1 . 2]" 1
1298 1 78 VAL HA 1 81 LEU H . . 3.930 3.379 3.144 3.753 . 0 0 "[ . 1 . 2]" 1
1299 1 78 VAL HA 1 81 LEU HB2 . . 3.770 2.942 2.501 3.405 . 0 0 "[ . 1 . 2]" 1
1300 1 78 VAL HA 1 81 LEU HB3 . . 5.250 4.559 4.141 5.006 . 0 0 "[ . 1 . 2]" 1
1301 1 78 VAL HA 1 81 LEU QD . . 3.390 2.315 1.917 2.810 . 0 0 "[ . 1 . 2]" 1
1302 1 78 VAL HA 1 81 LEU HG . . 4.160 3.714 3.322 4.017 . 0 0 "[ . 1 . 2]" 1
1303 1 78 VAL HB 1 79 VAL H . . 3.460 2.285 2.038 2.943 . 0 0 "[ . 1 . 2]" 1
1304 1 78 VAL HB 1 79 VAL HA . . 4.620 4.090 3.968 4.372 . 0 0 "[ . 1 . 2]" 1
1305 1 78 VAL HB 1 79 VAL MG1 . . 4.420 4.233 3.941 4.420 0.000 6 0 "[ . 1 . 2]" 1
1306 1 78 VAL MG1 1 79 VAL H . . 4.050 3.272 2.987 3.912 . 0 0 "[ . 1 . 2]" 1
1307 1 78 VAL MG1 1 79 VAL HA . . 4.430 3.502 3.257 4.106 . 0 0 "[ . 1 . 2]" 1
1308 1 78 VAL MG1 1 81 LEU HB2 . . 4.370 3.366 2.938 3.891 . 0 0 "[ . 1 . 2]" 1
1309 1 78 VAL MG1 1 82 VAL MG2 . . 3.710 2.519 1.985 3.074 . 0 0 "[ . 1 . 2]" 1
1310 1 78 VAL MG2 1 79 VAL H . . 3.990 3.652 3.502 3.988 . 0 0 "[ . 1 . 2]" 1
1311 1 79 VAL H 1 79 VAL HB . . 3.120 2.462 2.324 2.648 . 0 0 "[ . 1 . 2]" 1
1312 1 79 VAL H 1 79 VAL MG1 . . 3.170 2.282 1.967 2.591 . 0 0 "[ . 1 . 2]" 1
1313 1 79 VAL H 1 79 VAL MG2 . . 3.770 3.751 3.698 3.774 0.004 11 0 "[ . 1 . 2]" 1
1314 1 79 VAL H 1 80 GLU H . . 3.460 2.881 2.509 3.067 . 0 0 "[ . 1 . 2]" 1
1315 1 79 VAL H 1 81 LEU H . . 4.750 4.463 4.071 4.676 . 0 0 "[ . 1 . 2]" 1
1316 1 79 VAL HA 1 79 VAL MG1 . . 3.230 3.198 3.185 3.204 . 0 0 "[ . 1 . 2]" 1
1317 1 79 VAL HA 1 79 VAL MG2 . . 3.180 2.313 2.183 2.407 . 0 0 "[ . 1 . 2]" 1
1318 1 79 VAL HA 1 82 VAL H . . 4.270 3.612 3.313 3.914 . 0 0 "[ . 1 . 2]" 1
1319 1 79 VAL HA 1 82 VAL HB . . 3.910 3.019 2.708 3.258 . 0 0 "[ . 1 . 2]" 1
1320 1 79 VAL HA 1 82 VAL MG2 . . 3.890 2.859 2.356 3.445 . 0 0 "[ . 1 . 2]" 1
1321 1 79 VAL HA 1 83 ARG H . . 4.970 4.443 3.990 4.969 . 0 0 "[ . 1 . 2]" 1
1322 1 79 VAL HB 1 80 GLU H . . 4.120 3.914 3.717 4.124 0.004 10 0 "[ . 1 . 2]" 1
1323 1 79 VAL MG1 1 80 GLU H . . 3.990 1.993 1.778 2.345 . 0 0 "[ . 1 . 2]" 1
1324 1 79 VAL MG1 1 82 VAL HB . . 5.500 5.243 4.928 5.491 . 0 0 "[ . 1 . 2]" 1
1325 1 79 VAL MG2 1 80 GLU H . . 3.940 3.675 3.431 3.908 . 0 0 "[ . 1 . 2]" 1
1326 1 79 VAL MG2 1 80 GLU HA . . 4.400 3.751 3.506 4.007 . 0 0 "[ . 1 . 2]" 1
1327 1 79 VAL MG2 1 82 VAL HB . . 4.820 3.668 3.191 4.137 . 0 0 "[ . 1 . 2]" 1
1328 1 79 VAL MG2 1 83 ARG H . . 4.760 4.202 3.679 4.655 . 0 0 "[ . 1 . 2]" 1
1329 1 80 GLU H 1 80 GLU HB2 . . 3.430 2.662 2.229 3.513 0.083 16 0 "[ . 1 . 2]" 1
1330 1 80 GLU H 1 80 GLU QB . . 2.960 2.226 2.153 2.270 . 0 0 "[ . 1 . 2]" 1
1331 1 80 GLU H 1 80 GLU HB3 . . 3.430 2.480 2.192 2.863 . 0 0 "[ . 1 . 2]" 1
1332 1 80 GLU H 1 80 GLU QG . . 4.540 3.846 2.761 4.044 . 0 0 "[ . 1 . 2]" 1
1333 1 80 GLU H 1 81 LEU H . . 3.490 2.695 2.459 2.986 . 0 0 "[ . 1 . 2]" 1
1334 1 80 GLU HA 1 80 GLU HG2 . . 4.190 3.303 2.410 3.798 . 0 0 "[ . 1 . 2]" 1
1335 1 80 GLU HA 1 80 GLU QG . . 3.670 2.590 2.258 3.265 . 0 0 "[ . 1 . 2]" 1
1336 1 80 GLU HA 1 80 GLU HG3 . . 4.190 2.785 2.299 3.590 . 0 0 "[ . 1 . 2]" 1
1337 1 80 GLU HA 1 82 VAL H . . 5.080 4.485 4.040 5.020 . 0 0 "[ . 1 . 2]" 1
1338 1 80 GLU HA 1 83 ARG H . . 4.040 3.513 3.221 3.889 . 0 0 "[ . 1 . 2]" 1
1339 1 80 GLU HA 1 83 ARG QB . . 3.750 2.850 2.378 3.751 0.001 15 0 "[ . 1 . 2]" 1
1340 1 80 GLU HA 1 83 ARG QD . . 4.690 3.445 2.104 4.658 . 0 0 "[ . 1 . 2]" 1
1341 1 80 GLU HA 1 83 ARG QG . . 4.440 3.667 2.006 4.448 0.008 19 0 "[ . 1 . 2]" 1
1342 1 80 GLU HA 1 84 LYS H . . 4.460 4.154 3.879 4.450 . 0 0 "[ . 1 . 2]" 1
1343 1 80 GLU QB 1 81 LEU H . . 3.270 2.585 2.206 3.298 0.028 16 0 "[ . 1 . 2]" 1
1344 1 80 GLU QG 1 81 LEU HA . . 4.640 3.574 2.879 4.444 . 0 0 "[ . 1 . 2]" 1
1345 1 80 GLU QG 1 84 LYS H . . 4.830 4.081 3.463 4.620 . 0 0 "[ . 1 . 2]" 1
1346 1 80 GLU QG 1 84 LYS QD . . 3.850 2.924 1.984 3.602 . 0 0 "[ . 1 . 2]" 1
1347 1 80 GLU QG 1 84 LYS QG . . 4.570 3.576 2.647 4.515 . 0 0 "[ . 1 . 2]" 1
1348 1 80 GLU HG2 1 84 LYS QD . . 4.510 3.293 2.001 4.463 . 0 0 "[ . 1 . 2]" 1
1349 1 80 GLU HG3 1 84 LYS QD . . 4.510 3.792 2.075 4.504 . 0 0 "[ . 1 . 2]" 1
1350 1 81 LEU H 1 81 LEU HB2 . . 3.640 2.383 2.175 2.674 . 0 0 "[ . 1 . 2]" 1
1351 1 81 LEU H 1 81 LEU HB3 . . 3.720 3.558 3.489 3.599 . 0 0 "[ . 1 . 2]" 1
1352 1 81 LEU H 1 81 LEU MD1 . . 4.050 3.443 3.141 3.902 . 0 0 "[ . 1 . 2]" 1
1353 1 81 LEU H 1 81 LEU QD . . 3.460 2.766 1.862 3.243 . 0 0 "[ . 1 . 2]" 1
1354 1 81 LEU H 1 81 LEU MD2 . . 4.050 3.208 1.869 3.975 . 0 0 "[ . 1 . 2]" 1
1355 1 81 LEU H 1 81 LEU HG . . 4.020 2.832 1.924 4.029 0.009 6 0 "[ . 1 . 2]" 1
1356 1 81 LEU H 1 82 VAL H . . 3.560 2.740 2.389 2.988 . 0 0 "[ . 1 . 2]" 1
1357 1 81 LEU H 1 82 VAL MG2 . . 4.480 4.140 3.859 4.401 . 0 0 "[ . 1 . 2]" 1
1358 1 81 LEU HA 1 81 LEU MD1 . . 4.270 3.333 1.966 3.965 . 0 0 "[ . 1 . 2]" 1
1359 1 81 LEU HA 1 81 LEU QD . . 2.860 2.202 1.892 2.508 . 0 0 "[ . 1 . 2]" 1
1360 1 81 LEU HA 1 81 LEU MD2 . . 4.270 2.394 2.032 3.043 . 0 0 "[ . 1 . 2]" 1
1361 1 81 LEU HA 1 81 LEU HG . . 4.010 3.082 2.643 3.715 . 0 0 "[ . 1 . 2]" 1
1362 1 81 LEU HA 1 84 LYS H . . 4.200 3.636 3.200 4.023 . 0 0 "[ . 1 . 2]" 1
1363 1 81 LEU HA 1 84 LYS QB . . 4.450 3.545 2.208 4.339 . 0 0 "[ . 1 . 2]" 1
1364 1 81 LEU HA 1 84 LYS QD . . 4.100 2.434 1.979 3.268 . 0 0 "[ . 1 . 2]" 1
1365 1 81 LEU HA 1 84 LYS QG . . 4.570 2.624 1.992 4.048 . 0 0 "[ . 1 . 2]" 1
1366 1 81 LEU HB2 1 81 LEU MD1 . . 3.560 2.439 1.989 3.191 . 0 0 "[ . 1 . 2]" 1
1367 1 81 LEU HB2 1 81 LEU QD . . 3.080 2.150 1.968 2.380 . 0 0 "[ . 1 . 2]" 1
1368 1 81 LEU HB2 1 81 LEU MD2 . . 3.560 2.912 2.167 3.188 . 0 0 "[ . 1 . 2]" 1
1369 1 81 LEU HB2 1 82 VAL H . . 3.730 2.617 2.407 2.841 . 0 0 "[ . 1 . 2]" 1
1370 1 81 LEU HB3 1 82 VAL H . . 4.200 3.438 2.798 3.956 . 0 0 "[ . 1 . 2]" 1
1371 1 81 LEU QD 1 82 VAL H . . 4.020 3.935 3.485 4.023 0.003 8 0 "[ . 1 . 2]" 1
1372 1 81 LEU QD 1 84 LYS QD . . 3.720 2.504 2.014 3.282 . 0 0 "[ . 1 . 2]" 1
1373 1 81 LEU QD 1 84 LYS QE . . 4.180 3.446 2.154 4.079 . 0 0 "[ . 1 . 2]" 1
1374 1 81 LEU HG 1 82 VAL H . . 5.110 4.599 4.244 5.049 . 0 0 "[ . 1 . 2]" 1
1375 1 82 VAL H 1 82 VAL HB . . 3.250 2.576 2.439 2.678 . 0 0 "[ . 1 . 2]" 1
1376 1 82 VAL H 1 82 VAL MG1 . . 4.150 3.765 3.750 3.783 . 0 0 "[ . 1 . 2]" 1
1377 1 82 VAL H 1 82 VAL MG2 . . 3.130 2.101 1.881 2.304 . 0 0 "[ . 1 . 2]" 1
1378 1 82 VAL H 1 83 ARG H . . 3.360 2.669 2.440 3.053 . 0 0 "[ . 1 . 2]" 1
1379 1 82 VAL H 1 84 LYS H . . 4.710 4.482 4.095 4.711 0.001 6 0 "[ . 1 . 2]" 1
1380 1 82 VAL HA 1 82 VAL MG1 . . 3.390 2.366 2.232 2.471 . 0 0 "[ . 1 . 2]" 1
1381 1 82 VAL HA 1 82 VAL MG2 . . 3.200 2.393 2.282 2.501 . 0 0 "[ . 1 . 2]" 1
1382 1 82 VAL HA 1 85 SER H . . 4.140 3.695 3.459 3.849 . 0 0 "[ . 1 . 2]" 1
1383 1 82 VAL HA 1 85 SER HB2 . . 4.470 3.144 2.423 4.472 0.002 12 0 "[ . 1 . 2]" 1
1384 1 82 VAL HA 1 85 SER QB . . 3.850 2.917 2.396 3.340 . 0 0 "[ . 1 . 2]" 1
1385 1 82 VAL HA 1 85 SER HB3 . . 4.470 3.989 2.552 4.469 . 0 0 "[ . 1 . 2]" 1
1386 1 82 VAL HA 1 85 SER HG . . 4.600 2.730 2.056 4.515 . 0 0 "[ . 1 . 2]" 1
1387 1 82 VAL HA 1 89 VAL MG1 . . 3.800 2.702 2.115 3.056 . 0 0 "[ . 1 . 2]" 1
1388 1 82 VAL HA 1 89 VAL MG2 . . 4.640 3.092 2.513 3.597 . 0 0 "[ . 1 . 2]" 1
1389 1 82 VAL HB 1 83 ARG H . . 3.480 2.772 2.424 3.150 . 0 0 "[ . 1 . 2]" 1
1390 1 82 VAL MG1 1 83 ARG H . . 4.220 3.612 3.197 3.947 . 0 0 "[ . 1 . 2]" 1
1391 1 82 VAL MG1 1 85 SER H . . 4.910 4.794 4.552 4.907 . 0 0 "[ . 1 . 2]" 1
1392 1 82 VAL MG1 1 89 VAL MG2 . . 3.700 2.452 2.053 2.959 . 0 0 "[ . 1 . 2]" 1
1393 1 82 VAL MG2 1 83 ARG H . . 4.010 3.861 3.744 4.007 . 0 0 "[ . 1 . 2]" 1
1394 1 83 ARG H 1 83 ARG HB2 . . 3.630 2.646 2.197 3.606 . 0 0 "[ . 1 . 2]" 1
1395 1 83 ARG H 1 83 ARG QB . . 3.010 2.281 2.136 2.489 . 0 0 "[ . 1 . 2]" 1
1396 1 83 ARG H 1 83 ARG HB3 . . 3.630 2.937 2.218 3.628 . 0 0 "[ . 1 . 2]" 1
1397 1 83 ARG H 1 83 ARG QD . . 5.280 4.184 3.237 4.657 . 0 0 "[ . 1 . 2]" 1
1398 1 83 ARG H 1 83 ARG HG2 . . 4.530 3.738 2.319 4.476 . 0 0 "[ . 1 . 2]" 1
1399 1 83 ARG H 1 83 ARG QG . . 3.900 3.084 2.136 3.902 0.002 4 0 "[ . 1 . 2]" 1
1400 1 83 ARG H 1 83 ARG HG3 . . 4.530 3.535 2.152 4.484 . 0 0 "[ . 1 . 2]" 1
1401 1 83 ARG H 1 84 LYS H . . 3.550 2.689 2.432 2.904 . 0 0 "[ . 1 . 2]" 1
1402 1 83 ARG H 1 85 SER H . . 4.630 3.876 3.562 4.173 . 0 0 "[ . 1 . 2]" 1
1403 1 83 ARG HA 1 83 ARG QD . . 4.770 3.904 2.092 4.535 . 0 0 "[ . 1 . 2]" 1
1404 1 83 ARG HA 1 83 ARG HG2 . . 3.770 3.039 2.207 3.807 0.037 17 0 "[ . 1 . 2]" 1
1405 1 83 ARG HA 1 83 ARG HG3 . . 3.770 2.984 2.600 3.769 . 0 0 "[ . 1 . 2]" 1
1406 1 83 ARG HA 1 85 SER H . . 4.600 4.308 3.919 4.515 . 0 0 "[ . 1 . 2]" 1
1407 1 83 ARG QB 1 83 ARG QD . . 3.220 2.220 2.032 2.756 . 0 0 "[ . 1 . 2]" 1
1408 1 83 ARG HB2 1 84 LYS H . . 4.110 3.148 2.225 3.994 . 0 0 "[ . 1 . 2]" 1
1409 1 83 ARG HB3 1 84 LYS H . . 4.110 2.918 2.088 3.829 . 0 0 "[ . 1 . 2]" 1
1410 1 84 LYS H 1 84 LYS QB . . 3.040 2.416 2.200 2.577 . 0 0 "[ . 1 . 2]" 1
1411 1 84 LYS H 1 84 LYS QD . . 4.440 3.687 3.184 4.052 . 0 0 "[ . 1 . 2]" 1
1412 1 84 LYS H 1 84 LYS HG2 . . 4.130 2.658 1.906 3.960 . 0 0 "[ . 1 . 2]" 1
1413 1 84 LYS H 1 84 LYS HG3 . . 4.130 3.159 1.949 3.796 . 0 0 "[ . 1 . 2]" 1
1414 1 84 LYS H 1 85 SER H . . 3.430 2.677 2.392 2.884 . 0 0 "[ . 1 . 2]" 1
1415 1 84 LYS HA 1 84 LYS HG2 . . 4.230 3.389 2.364 3.877 . 0 0 "[ . 1 . 2]" 1
1416 1 84 LYS HA 1 84 LYS QG . . 3.600 3.048 2.268 3.343 . 0 0 "[ . 1 . 2]" 1
1417 1 84 LYS HA 1 84 LYS HG3 . . 4.230 3.496 2.682 3.912 . 0 0 "[ . 1 . 2]" 1
1418 1 84 LYS HA 1 86 GLY H . . 5.200 4.270 3.842 4.611 . 0 0 "[ . 1 . 2]" 1
1419 1 84 LYS QB 1 84 LYS QD . . 3.280 2.176 2.061 2.305 . 0 0 "[ . 1 . 2]" 1
1420 1 84 LYS QB 1 85 SER H . . 3.980 3.226 2.553 3.621 . 0 0 "[ . 1 . 2]" 1
1421 1 85 SER H 1 85 SER HB2 . . 3.630 2.649 2.192 3.611 . 0 0 "[ . 1 . 2]" 1
1422 1 85 SER H 1 85 SER QB . . 3.040 2.481 2.149 2.756 . 0 0 "[ . 1 . 2]" 1
1423 1 85 SER H 1 85 SER HB3 . . 3.630 3.464 2.383 3.626 . 0 0 "[ . 1 . 2]" 1
1424 1 85 SER H 1 85 SER HG . . 3.890 3.492 2.964 3.897 0.007 20 0 "[ . 1 . 2]" 1
1425 1 85 SER H 1 86 GLY H . . 3.350 3.110 2.947 3.227 . 0 0 "[ . 1 . 2]" 1
1426 1 85 SER H 1 89 VAL MG1 . . 4.920 4.745 4.526 4.894 . 0 0 "[ . 1 . 2]" 1
1427 1 85 SER HA 1 89 VAL MG1 . . 4.840 4.658 4.417 4.826 . 0 0 "[ . 1 . 2]" 1
1428 1 85 SER QB 1 86 GLY H . . 3.130 2.440 2.113 3.129 . 0 0 "[ . 1 . 2]" 1
1429 1 85 SER QB 1 89 VAL HA . . 4.400 2.897 2.480 3.312 . 0 0 "[ . 1 . 2]" 1
1430 1 85 SER QB 1 89 VAL MG1 . . 3.440 2.582 2.311 2.791 . 0 0 "[ . 1 . 2]" 1
1431 1 85 SER HB2 1 86 GLY H . . 3.760 2.585 2.139 3.423 . 0 0 "[ . 1 . 2]" 1
1432 1 85 SER HB2 1 89 VAL HB . . 4.960 4.828 4.618 4.959 . 0 0 "[ . 1 . 2]" 1
1433 1 85 SER HB2 1 89 VAL MG1 . . 3.930 3.038 2.619 3.374 . 0 0 "[ . 1 . 2]" 1
1434 1 85 SER HB3 1 86 GLY H . . 3.760 3.296 2.148 3.755 . 0 0 "[ . 1 . 2]" 1
1435 1 85 SER HB3 1 89 VAL HB . . 4.960 4.697 4.467 4.967 0.007 12 0 "[ . 1 . 2]" 1
1436 1 85 SER HB3 1 89 VAL MG1 . . 3.930 2.825 2.476 3.482 . 0 0 "[ . 1 . 2]" 1
1437 1 85 SER HG 1 89 VAL HA . . 4.390 3.795 2.313 4.354 . 0 0 "[ . 1 . 2]" 1
1438 1 85 SER HG 1 89 VAL HB . . 4.870 4.772 4.419 4.874 0.004 2 0 "[ . 1 . 2]" 1
1439 1 85 SER HG 1 89 VAL MG1 . . 4.230 2.222 1.959 4.186 . 0 0 "[ . 1 . 2]" 1
1440 1 87 ASN QB 1 87 ASN QD . . 2.980 2.329 2.074 2.583 . 0 0 "[ . 1 . 2]" 1
1441 1 87 ASN QB 1 88 SER H . . 4.340 2.561 2.303 3.135 . 0 0 "[ . 1 . 2]" 1
1442 1 87 ASN QB 1 88 SER HA . . 4.580 4.056 3.953 4.252 . 0 0 "[ . 1 . 2]" 1
1443 1 88 SER H 1 88 SER QB . . 3.470 2.713 2.344 3.043 . 0 0 "[ . 1 . 2]" 1
1444 1 88 SER H 1 89 VAL H . . 4.630 4.444 4.322 4.554 . 0 0 "[ . 1 . 2]" 1
1445 1 88 SER HA 1 89 VAL H . . 2.900 2.186 2.138 2.414 . 0 0 "[ . 1 . 2]" 1
1446 1 88 SER HA 1 89 VAL MG2 . . 4.340 3.489 2.950 3.813 . 0 0 "[ . 1 . 2]" 1
1447 1 88 SER QB 1 89 VAL H . . 3.750 3.170 2.392 3.733 . 0 0 "[ . 1 . 2]" 1
1448 1 88 SER QB 1 89 VAL HA . . 4.650 4.396 4.040 4.634 . 0 0 "[ . 1 . 2]" 1
1449 1 88 SER QB 1 89 VAL MG2 . . 4.820 4.437 4.071 4.694 . 0 0 "[ . 1 . 2]" 1
1450 1 89 VAL H 1 89 VAL HB . . 4.180 2.808 2.649 2.997 . 0 0 "[ . 1 . 2]" 1
1451 1 89 VAL H 1 89 VAL MG1 . . 4.310 3.920 3.858 3.988 . 0 0 "[ . 1 . 2]" 1
1452 1 89 VAL H 1 89 VAL MG2 . . 3.440 2.777 2.610 2.961 . 0 0 "[ . 1 . 2]" 1
1453 1 89 VAL HA 1 89 VAL MG1 . . 3.300 2.349 2.234 2.454 . 0 0 "[ . 1 . 2]" 1
1454 1 89 VAL HA 1 90 THR H . . 2.900 2.212 2.145 2.319 . 0 0 "[ . 1 . 2]" 1
1455 1 89 VAL HB 1 90 THR H . . 4.230 3.912 3.622 4.157 . 0 0 "[ . 1 . 2]" 1
1456 1 89 VAL MG1 1 90 THR H . . 3.250 2.220 1.945 2.645 . 0 0 "[ . 1 . 2]" 1
1457 1 89 VAL MG1 1 91 LEU MD1 . . 4.390 3.373 3.013 3.730 . 0 0 "[ . 1 . 2]" 1
1458 1 89 VAL MG1 1 91 LEU MD2 . . 3.410 2.319 1.834 2.780 . 0 0 "[ . 1 . 2]" 1
1459 1 89 VAL MG1 1 91 LEU HG . . 3.890 2.844 2.438 3.374 . 0 0 "[ . 1 . 2]" 1
1460 1 89 VAL MG2 1 90 THR H . . 4.340 4.022 3.881 4.191 . 0 0 "[ . 1 . 2]" 1
1461 1 90 THR H 1 90 THR HB . . 3.280 2.632 2.478 2.752 . 0 0 "[ . 1 . 2]" 1
1462 1 90 THR H 1 90 THR MG . . 4.360 3.844 3.780 3.897 . 0 0 "[ . 1 . 2]" 1
1463 1 90 THR H 1 91 LEU H . . 4.650 4.433 4.078 4.544 . 0 0 "[ . 1 . 2]" 1
1464 1 90 THR HA 1 90 THR MG . . 3.330 2.364 2.227 2.482 . 0 0 "[ . 1 . 2]" 1
1465 1 90 THR HA 1 91 LEU H . . 3.000 2.182 2.143 2.250 . 0 0 "[ . 1 . 2]" 1
1466 1 90 THR HB 1 91 LEU H . . 5.170 4.070 3.780 4.374 . 0 0 "[ . 1 . 2]" 1
1467 1 90 THR MG 1 91 LEU H . . 3.580 2.434 1.955 3.164 . 0 0 "[ . 1 . 2]" 1
1468 1 91 LEU H 1 91 LEU HB2 . . 3.700 2.799 2.628 2.908 . 0 0 "[ . 1 . 2]" 1
1469 1 91 LEU H 1 91 LEU MD1 . . 4.290 3.892 3.456 4.268 . 0 0 "[ . 1 . 2]" 1
1470 1 91 LEU H 1 91 LEU MD2 . . 4.270 3.889 3.319 4.141 . 0 0 "[ . 1 . 2]" 1
1471 1 91 LEU H 1 91 LEU HG . . 4.010 2.865 2.380 3.107 . 0 0 "[ . 1 . 2]" 1
1472 1 91 LEU H 1 92 LEU H . . 4.780 4.361 4.185 4.536 . 0 0 "[ . 1 . 2]" 1
1473 1 91 LEU HA 1 91 LEU MD1 . . 4.730 3.953 3.896 3.994 . 0 0 "[ . 1 . 2]" 1
1474 1 91 LEU HA 1 91 LEU MD2 . . 3.330 2.311 1.977 2.558 . 0 0 "[ . 1 . 2]" 1
1475 1 91 LEU HA 1 92 LEU H . . 3.040 2.208 2.140 2.319 . 0 0 "[ . 1 . 2]" 1
1476 1 91 LEU HB2 1 92 LEU H . . 4.210 3.919 3.551 4.151 . 0 0 "[ . 1 . 2]" 1
1477 1 91 LEU HB2 1 93 VAL MG1 . . 3.580 3.502 3.315 3.581 0.001 10 0 "[ . 1 . 2]" 1
1478 1 91 LEU HB3 1 91 LEU MD1 . . 3.630 2.517 2.310 2.659 . 0 0 "[ . 1 . 2]" 1
1479 1 91 LEU HB3 1 91 LEU MD2 . . 3.520 2.232 2.121 2.375 . 0 0 "[ . 1 . 2]" 1
1480 1 91 LEU HB3 1 92 LEU H . . 4.110 3.027 2.689 3.480 . 0 0 "[ . 1 . 2]" 1
1481 1 91 LEU HB3 1 93 VAL MG1 . . 3.500 3.420 3.234 3.504 0.004 20 0 "[ . 1 . 2]" 1
1482 1 91 LEU MD2 1 92 LEU H . . 4.240 3.730 3.537 4.037 . 0 0 "[ . 1 . 2]" 1
1483 1 92 LEU H 1 92 LEU QB . . 3.360 2.367 2.271 2.499 . 0 0 "[ . 1 . 2]" 1
1484 1 92 LEU H 1 92 LEU MD1 . . 4.380 3.923 3.622 4.170 . 0 0 "[ . 1 . 2]" 1
1485 1 92 LEU H 1 92 LEU MD2 . . 4.760 4.079 3.889 4.215 . 0 0 "[ . 1 . 2]" 1
1486 1 92 LEU H 1 92 LEU HG . . 4.620 3.191 2.855 3.539 . 0 0 "[ . 1 . 2]" 1
1487 1 92 LEU H 1 93 VAL H . . 4.820 4.221 4.090 4.363 . 0 0 "[ . 1 . 2]" 1
1488 1 92 LEU H 1 93 VAL MG1 . . 5.040 4.111 3.687 4.467 . 0 0 "[ . 1 . 2]" 1
1489 1 92 LEU HA 1 92 LEU MD1 . . 4.260 3.853 3.810 3.895 . 0 0 "[ . 1 . 2]" 1
1490 1 92 LEU HA 1 92 LEU MD2 . . 3.110 2.133 1.996 2.343 . 0 0 "[ . 1 . 2]" 1
1491 1 92 LEU HA 1 92 LEU HG . . 4.000 2.850 2.697 2.953 . 0 0 "[ . 1 . 2]" 1
1492 1 92 LEU HA 1 93 VAL H . . 3.030 2.151 2.142 2.156 . 0 0 "[ . 1 . 2]" 1
1493 1 92 LEU HA 1 93 VAL MG2 . . 4.560 3.785 3.625 3.996 . 0 0 "[ . 1 . 2]" 1
1494 1 92 LEU QB 1 92 LEU MD1 . . 3.110 2.048 1.964 2.100 . 0 0 "[ . 1 . 2]" 1
1495 1 92 LEU QB 1 93 VAL H . . 4.270 3.513 3.424 3.560 . 0 0 "[ . 1 . 2]" 1
1496 1 92 LEU MD1 1 113 ASP HA . . 3.910 2.577 1.980 3.157 . 0 0 "[ . 1 . 2]" 1
1497 1 92 LEU MD1 1 113 ASP HB2 . . 5.000 4.332 3.804 4.950 . 0 0 "[ . 1 . 2]" 1
1498 1 92 LEU MD1 1 113 ASP QB . . 4.310 3.840 3.087 4.295 . 0 0 "[ . 1 . 2]" 1
1499 1 92 LEU MD1 1 113 ASP HB3 . . 5.000 4.425 3.181 4.999 . 0 0 "[ . 1 . 2]" 1
1500 1 92 LEU MD1 1 114 GLN H . . 4.540 2.823 2.009 3.424 . 0 0 "[ . 1 . 2]" 1
1501 1 92 LEU MD2 1 93 VAL H . . 3.670 3.483 3.198 3.672 0.002 10 0 "[ . 1 . 2]" 1
1502 1 92 LEU MD2 1 113 ASP QB . . 5.340 4.994 4.079 5.341 0.001 20 0 "[ . 1 . 2]" 1
1503 1 92 LEU MD2 1 114 GLN H . . 3.950 2.603 1.844 3.025 . 0 0 "[ . 1 . 2]" 1
1504 1 92 LEU MD2 1 114 GLN HA . . 4.600 4.212 1.909 4.602 0.002 4 0 "[ . 1 . 2]" 1
1505 1 92 LEU MD2 1 114 GLN HB2 . . 4.630 3.037 2.019 4.452 . 0 0 "[ . 1 . 2]" 1
1506 1 92 LEU MD2 1 114 GLN QB . . 3.960 2.432 1.819 2.977 . 0 0 "[ . 1 . 2]" 1
1507 1 92 LEU MD2 1 114 GLN HB3 . . 4.630 2.865 2.026 4.402 . 0 0 "[ . 1 . 2]" 1
1508 1 92 LEU MD2 1 114 GLN QG . . 4.410 3.449 2.416 4.215 . 0 0 "[ . 1 . 2]" 1
1509 1 92 LEU HG 1 93 VAL H . . 5.080 4.976 4.841 5.079 . 0 0 "[ . 1 . 2]" 1
1510 1 93 VAL H 1 93 VAL MG1 . . 3.570 2.671 2.505 2.840 . 0 0 "[ . 1 . 2]" 1
1511 1 93 VAL H 1 93 VAL MG2 . . 3.140 1.984 1.897 2.171 . 0 0 "[ . 1 . 2]" 1
1512 1 93 VAL H 1 94 LEU H . . 5.300 4.461 4.303 4.522 . 0 0 "[ . 1 . 2]" 1
1513 1 93 VAL HA 1 93 VAL MG1 . . 3.340 2.352 2.227 2.505 . 0 0 "[ . 1 . 2]" 1
1514 1 93 VAL HA 1 94 LEU H . . 3.180 2.183 2.142 2.284 . 0 0 "[ . 1 . 2]" 1
1515 1 93 VAL HA 1 94 LEU QB . . 4.550 3.997 3.948 4.059 . 0 0 "[ . 1 . 2]" 1
1516 1 93 VAL HB 1 94 LEU H . . 3.600 3.090 2.691 3.404 . 0 0 "[ . 1 . 2]" 1
1517 1 93 VAL MG1 1 94 LEU H . . 4.230 3.908 3.746 4.175 . 0 0 "[ . 1 . 2]" 1
1518 1 93 VAL MG2 1 94 LEU H . . 4.110 3.877 3.646 4.112 0.002 16 0 "[ . 1 . 2]" 1
1519 1 94 LEU H 1 94 LEU HB2 . . 4.010 2.798 2.616 3.065 . 0 0 "[ . 1 . 2]" 1
1520 1 94 LEU H 1 94 LEU QB . . 3.440 2.411 2.314 2.507 . 0 0 "[ . 1 . 2]" 1
1521 1 94 LEU H 1 94 LEU HB3 . . 4.010 2.648 2.486 2.787 . 0 0 "[ . 1 . 2]" 1
1522 1 94 LEU H 1 94 LEU HG . . 4.790 4.539 4.362 4.617 . 0 0 "[ . 1 . 2]" 1
1523 1 94 LEU HA 1 94 LEU MD1 . . 3.100 2.152 1.936 2.477 . 0 0 "[ . 1 . 2]" 1
1524 1 94 LEU QB 1 94 LEU MD1 . . 3.140 2.225 2.069 2.361 . 0 0 "[ . 1 . 2]" 1
1525 1 94 LEU QB 1 99 TYR QD . . 3.820 2.479 2.209 2.806 . 0 0 "[ . 1 . 2]" 1
1526 1 94 LEU HB2 1 94 LEU MD1 . . 3.590 2.273 2.099 2.432 . 0 0 "[ . 1 . 2]" 1
1527 1 94 LEU HB2 1 94 LEU MD2 . . 3.490 2.454 2.227 2.572 . 0 0 "[ . 1 . 2]" 1
1528 1 94 LEU HB2 1 95 ASP H . . 4.520 3.941 3.807 4.096 . 0 0 "[ . 1 . 2]" 1
1529 1 94 LEU HB2 1 99 TYR QD . . 4.580 3.793 3.309 4.494 . 0 0 "[ . 1 . 2]" 1
1530 1 94 LEU HB3 1 94 LEU MD1 . . 3.590 3.178 3.143 3.196 . 0 0 "[ . 1 . 2]" 1
1531 1 94 LEU HB3 1 94 LEU MD2 . . 3.490 2.225 2.058 2.404 . 0 0 "[ . 1 . 2]" 1
1532 1 94 LEU HB3 1 95 ASP H . . 4.520 3.574 3.315 3.856 . 0 0 "[ . 1 . 2]" 1
1533 1 94 LEU HB3 1 99 TYR QD . . 4.580 2.516 2.228 2.854 . 0 0 "[ . 1 . 2]" 1
1534 1 94 LEU MD1 1 95 ASP H . . 3.490 2.468 1.970 3.219 . 0 0 "[ . 1 . 2]" 1
1535 1 94 LEU MD1 1 98 SER HA . . 5.500 5.268 5.026 5.486 . 0 0 "[ . 1 . 2]" 1
1536 1 94 LEU MD1 1 98 SER HB2 . . 3.770 3.350 2.977 3.725 . 0 0 "[ . 1 . 2]" 1
1537 1 94 LEU MD1 1 98 SER HB3 . . 3.770 3.177 2.838 3.698 . 0 0 "[ . 1 . 2]" 1
1538 1 94 LEU MD1 1 99 TYR HB2 . . 5.500 4.913 4.542 5.253 . 0 0 "[ . 1 . 2]" 1
1539 1 94 LEU MD2 1 95 ASP H . . 4.800 3.740 3.627 3.950 . 0 0 "[ . 1 . 2]" 1
1540 1 94 LEU MD2 1 98 SER HB2 . . 4.380 3.103 2.306 4.032 . 0 0 "[ . 1 . 2]" 1
1541 1 94 LEU MD2 1 98 SER QB . . 3.590 2.492 1.985 3.222 . 0 0 "[ . 1 . 2]" 1
1542 1 94 LEU MD2 1 98 SER HB3 . . 4.380 2.730 2.166 3.936 . 0 0 "[ . 1 . 2]" 1
1543 1 94 LEU MD2 1 99 TYR H . . 4.230 2.872 2.270 3.307 . 0 0 "[ . 1 . 2]" 1
1544 1 94 LEU MD2 1 99 TYR HA . . 3.270 2.235 1.948 2.643 . 0 0 "[ . 1 . 2]" 1
1545 1 94 LEU MD2 1 99 TYR HB2 . . 4.200 2.721 2.239 3.327 . 0 0 "[ . 1 . 2]" 1
1546 1 94 LEU MD2 1 99 TYR HB3 . . 4.500 3.993 3.550 4.478 . 0 0 "[ . 1 . 2]" 1
1547 1 94 LEU MD2 1 99 TYR QD . . 3.420 2.607 2.167 2.999 . 0 0 "[ . 1 . 2]" 1
1548 1 94 LEU HG 1 95 ASP H . . 4.190 2.023 1.900 2.273 . 0 0 "[ . 1 . 2]" 1
1549 1 94 LEU HG 1 98 SER HB2 . . 4.100 2.738 2.128 3.867 . 0 0 "[ . 1 . 2]" 1
1550 1 94 LEU HG 1 98 SER HB3 . . 4.100 3.070 2.154 4.099 . 0 0 "[ . 1 . 2]" 1
1551 1 94 LEU HG 1 99 TYR H . . 3.970 3.297 2.823 3.698 . 0 0 "[ . 1 . 2]" 1
1552 1 94 LEU HG 1 99 TYR HA . . 4.470 4.218 3.891 4.466 . 0 0 "[ . 1 . 2]" 1
1553 1 94 LEU HG 1 99 TYR HB2 . . 4.690 3.672 3.083 4.038 . 0 0 "[ . 1 . 2]" 1
1554 1 94 LEU HG 1 99 TYR QD . . 4.730 4.275 3.760 4.637 . 0 0 "[ . 1 . 2]" 1
1555 1 95 ASP H 1 95 ASP HB2 . . 4.190 2.621 2.256 3.603 . 0 0 "[ . 1 . 2]" 1
1556 1 95 ASP H 1 95 ASP QB . . 3.510 2.401 2.191 2.738 . 0 0 "[ . 1 . 2]" 1
1557 1 95 ASP H 1 95 ASP HB3 . . 4.190 3.235 2.307 3.612 . 0 0 "[ . 1 . 2]" 1
1558 1 95 ASP HA 1 96 GLY H . . 3.230 2.206 2.148 2.281 . 0 0 "[ . 1 . 2]" 1
1559 1 95 ASP QB 1 96 GLY H . . 3.500 3.148 2.808 3.499 . 0 0 "[ . 1 . 2]" 1
1560 1 95 ASP QB 1 97 ASP H . . 4.360 3.565 2.958 4.339 . 0 0 "[ . 1 . 2]" 1
1561 1 95 ASP HB2 1 96 GLY H . . 4.310 3.973 3.040 4.305 . 0 0 "[ . 1 . 2]" 1
1562 1 95 ASP HB3 1 96 GLY H . . 4.310 3.418 2.861 4.140 . 0 0 "[ . 1 . 2]" 1
1563 1 97 ASP H 1 97 ASP HB2 . . 3.670 2.578 2.254 3.614 . 0 0 "[ . 1 . 2]" 1
1564 1 97 ASP H 1 97 ASP QB . . 3.060 2.384 2.193 2.767 . 0 0 "[ . 1 . 2]" 1
1565 1 97 ASP H 1 97 ASP HB3 . . 3.670 3.242 2.319 3.618 . 0 0 "[ . 1 . 2]" 1
1566 1 97 ASP H 1 98 SER H . . 3.430 3.001 2.829 3.176 . 0 0 "[ . 1 . 2]" 1
1567 1 97 ASP HA 1 100 GLU H . . 4.450 3.919 3.407 4.413 . 0 0 "[ . 1 . 2]" 1
1568 1 97 ASP HA 1 100 GLU QB . . 4.780 3.163 2.734 4.248 . 0 0 "[ . 1 . 2]" 1
1569 1 97 ASP QB 1 98 SER H . . 3.340 2.431 2.145 3.240 . 0 0 "[ . 1 . 2]" 1
1570 1 97 ASP HB2 1 98 SER H . . 3.940 2.848 2.173 3.832 . 0 0 "[ . 1 . 2]" 1
1571 1 97 ASP HB3 1 98 SER H . . 3.940 3.068 2.238 3.760 . 0 0 "[ . 1 . 2]" 1
1572 1 98 SER H 1 98 SER HB2 . . 3.870 2.502 2.205 3.602 . 0 0 "[ . 1 . 2]" 1
1573 1 98 SER H 1 98 SER QB . . 3.260 2.366 2.145 2.554 . 0 0 "[ . 1 . 2]" 1
1574 1 98 SER H 1 98 SER HB3 . . 3.870 3.350 2.255 3.606 . 0 0 "[ . 1 . 2]" 1
1575 1 98 SER H 1 99 TYR H . . 3.510 2.856 2.388 3.045 . 0 0 "[ . 1 . 2]" 1
1576 1 98 SER H 1 100 GLU H . . 5.150 4.586 4.275 5.046 . 0 0 "[ . 1 . 2]" 1
1577 1 98 SER H 1 101 LYS H . . 5.400 4.826 4.668 5.039 . 0 0 "[ . 1 . 2]" 1
1578 1 98 SER HA 1 101 LYS H . . 4.090 3.648 3.003 3.970 . 0 0 "[ . 1 . 2]" 1
1579 1 98 SER HA 1 101 LYS QB . . 3.590 2.665 2.016 3.062 . 0 0 "[ . 1 . 2]" 1
1580 1 98 SER HA 1 101 LYS QD . . 4.340 3.570 3.114 4.285 . 0 0 "[ . 1 . 2]" 1
1581 1 98 SER HA 1 101 LYS QE . . 5.420 4.378 3.625 5.296 . 0 0 "[ . 1 . 2]" 1
1582 1 98 SER QB 1 99 TYR H . . 3.570 2.450 2.135 3.325 . 0 0 "[ . 1 . 2]" 1
1583 1 99 TYR H 1 99 TYR HB2 . . 3.400 2.296 2.185 2.392 . 0 0 "[ . 1 . 2]" 1
1584 1 99 TYR H 1 99 TYR HB3 . . 3.410 2.811 2.672 3.037 . 0 0 "[ . 1 . 2]" 1
1585 1 99 TYR H 1 99 TYR QD . . 4.440 4.099 3.930 4.162 . 0 0 "[ . 1 . 2]" 1
1586 1 99 TYR H 1 100 GLU H . . 3.670 2.984 2.809 3.181 . 0 0 "[ . 1 . 2]" 1
1587 1 99 TYR H 1 100 GLU HG3 . . 4.750 4.631 4.359 4.749 . 0 0 "[ . 1 . 2]" 1
1588 1 99 TYR HA 1 99 TYR QD . . 3.890 3.055 2.698 3.145 . 0 0 "[ . 1 . 2]" 1
1589 1 99 TYR HA 1 101 LYS H . . 4.880 4.543 4.025 4.789 . 0 0 "[ . 1 . 2]" 1
1590 1 99 TYR HA 1 103 VAL H . . 4.800 4.005 3.224 4.778 . 0 0 "[ . 1 . 2]" 1
1591 1 99 TYR HA 1 109 LEU MD2 . . 4.150 3.550 2.971 3.994 . 0 0 "[ . 1 . 2]" 1
1592 1 99 TYR HB2 1 100 GLU H . . 4.030 3.515 3.354 3.705 . 0 0 "[ . 1 . 2]" 1
1593 1 99 TYR HB3 1 100 GLU H . . 3.630 2.195 1.907 2.411 . 0 0 "[ . 1 . 2]" 1
1594 1 99 TYR HB3 1 100 GLU HG3 . . 4.570 3.209 2.935 3.539 . 0 0 "[ . 1 . 2]" 1
1595 1 99 TYR QD 1 100 GLU H . . 4.040 3.374 3.058 3.852 . 0 0 "[ . 1 . 2]" 1
1596 1 99 TYR QD 1 100 GLU HA . . 3.970 3.050 2.815 3.737 . 0 0 "[ . 1 . 2]" 1
1597 1 99 TYR QD 1 100 GLU HG2 . . 4.240 3.989 3.669 4.178 . 0 0 "[ . 1 . 2]" 1
1598 1 99 TYR QD 1 100 GLU HG3 . . 4.600 4.137 3.560 4.559 . 0 0 "[ . 1 . 2]" 1
1599 1 99 TYR QD 1 102 ALA MB . . 5.080 4.433 4.155 4.736 . 0 0 "[ . 1 . 2]" 1
1600 1 99 TYR QD 1 103 VAL MG1 . . 5.400 3.759 2.012 5.221 . 0 0 "[ . 1 . 2]" 1
1601 1 99 TYR QD 1 103 VAL QG . . 3.920 2.524 2.004 2.985 . 0 0 "[ . 1 . 2]" 1
1602 1 99 TYR QD 1 103 VAL MG2 . . 5.400 3.274 2.089 4.647 . 0 0 "[ . 1 . 2]" 1
1603 1 99 TYR QD 1 109 LEU MD2 . . 4.330 4.057 3.696 4.284 . 0 0 "[ . 1 . 2]" 1
1604 1 99 TYR QE 1 103 VAL QG . . 3.590 2.649 2.060 3.299 . 0 0 "[ . 1 . 2]" 1
1605 1 99 TYR QE 1 109 LEU MD1 . . 3.470 3.229 2.825 3.465 . 0 0 "[ . 1 . 2]" 1
1606 1 100 GLU H 1 100 GLU HB2 . . 3.710 2.588 2.481 2.750 . 0 0 "[ . 1 . 2]" 1
1607 1 100 GLU H 1 100 GLU QB . . 3.170 2.532 2.439 2.668 . 0 0 "[ . 1 . 2]" 1
1608 1 100 GLU H 1 100 GLU HB3 . . 3.710 3.594 3.588 3.607 . 0 0 "[ . 1 . 2]" 1
1609 1 100 GLU H 1 100 GLU HG2 . . 3.500 3.183 2.821 3.437 . 0 0 "[ . 1 . 2]" 1
1610 1 100 GLU H 1 100 GLU HG3 . . 3.880 2.101 1.927 2.355 . 0 0 "[ . 1 . 2]" 1
1611 1 100 GLU H 1 101 LYS H . . 3.340 2.839 2.513 2.996 . 0 0 "[ . 1 . 2]" 1
1612 1 100 GLU H 1 103 VAL H . . 5.500 5.038 4.824 5.346 . 0 0 "[ . 1 . 2]" 1
1613 1 100 GLU H 1 103 VAL QG . . 4.900 4.144 3.582 4.824 . 0 0 "[ . 1 . 2]" 1
1614 1 100 GLU HA 1 100 GLU HG2 . . 3.980 2.549 2.366 2.790 . 0 0 "[ . 1 . 2]" 1
1615 1 100 GLU HA 1 100 GLU HG3 . . 3.470 3.152 2.903 3.338 . 0 0 "[ . 1 . 2]" 1
1616 1 100 GLU HA 1 103 VAL MG1 . . 4.400 3.237 1.852 4.358 . 0 0 "[ . 1 . 2]" 1
1617 1 100 GLU HA 1 103 VAL QG . . 3.570 2.519 1.850 3.479 . 0 0 "[ . 1 . 2]" 1
1618 1 100 GLU HA 1 103 VAL MG2 . . 4.400 3.651 2.521 4.399 . 0 0 "[ . 1 . 2]" 1
1619 1 100 GLU QB 1 101 LYS H . . 3.450 2.457 2.262 2.716 . 0 0 "[ . 1 . 2]" 1
1620 1 100 GLU HB2 1 101 LYS H . . 4.160 2.503 2.293 2.778 . 0 0 "[ . 1 . 2]" 1
1621 1 100 GLU HB3 1 101 LYS H . . 4.160 3.591 3.412 3.867 . 0 0 "[ . 1 . 2]" 1
1622 1 100 GLU HG2 1 103 VAL QG . . 5.200 4.142 3.480 4.908 . 0 0 "[ . 1 . 2]" 1
1623 1 101 LYS H 1 101 LYS QB . . 2.920 2.203 2.122 2.249 . 0 0 "[ . 1 . 2]" 1
1624 1 101 LYS H 1 101 LYS QD . . 5.180 4.458 3.613 4.689 . 0 0 "[ . 1 . 2]" 1
1625 1 101 LYS H 1 101 LYS QE . . 5.500 4.540 3.857 5.473 . 0 0 "[ . 1 . 2]" 1
1626 1 101 LYS H 1 101 LYS QG . . 4.690 3.940 3.789 4.033 . 0 0 "[ . 1 . 2]" 1
1627 1 101 LYS H 1 102 ALA H . . 3.330 2.809 2.489 2.971 . 0 0 "[ . 1 . 2]" 1
1628 1 101 LYS H 1 102 ALA MB . . 4.420 4.355 4.121 4.421 0.001 6 0 "[ . 1 . 2]" 1
1629 1 101 LYS H 1 103 VAL H . . 5.500 4.623 4.090 4.941 . 0 0 "[ . 1 . 2]" 1
1630 1 101 LYS HA 1 101 LYS QE . . 4.150 3.865 3.364 4.150 . 0 0 "[ . 1 . 2]" 1
1631 1 101 LYS HA 1 101 LYS HG2 . . 3.960 3.148 2.539 3.655 . 0 0 "[ . 1 . 2]" 1
1632 1 101 LYS HA 1 101 LYS QG . . 3.440 2.430 2.192 2.635 . 0 0 "[ . 1 . 2]" 1
1633 1 101 LYS HA 1 101 LYS HG3 . . 3.960 2.556 2.233 2.789 . 0 0 "[ . 1 . 2]" 1
1634 1 101 LYS HA 1 102 ALA HA . . 5.040 4.800 4.705 4.863 . 0 0 "[ . 1 . 2]" 1
1635 1 101 LYS HA 1 104 LYS H . . 4.230 3.842 3.476 4.137 . 0 0 "[ . 1 . 2]" 1
1636 1 101 LYS HA 1 105 ASN QD . . 4.570 3.720 3.123 4.231 . 0 0 "[ . 1 . 2]" 1
1637 1 101 LYS QB 1 101 LYS QE . . 4.040 2.290 1.969 3.604 . 0 0 "[ . 1 . 2]" 1
1638 1 101 LYS QB 1 102 ALA H . . 3.340 2.430 2.053 2.870 . 0 0 "[ . 1 . 2]" 1
1639 1 101 LYS QB 1 102 ALA MB . . 4.150 3.761 3.513 3.922 . 0 0 "[ . 1 . 2]" 1
1640 1 101 LYS QB 1 105 ASN HD21 . . 4.700 4.243 3.705 4.699 . 0 0 "[ . 1 . 2]" 1
1641 1 101 LYS QB 1 105 ASN HD22 . . 4.700 4.380 3.826 4.694 . 0 0 "[ . 1 . 2]" 1
1642 1 101 LYS QD 1 105 ASN HD21 . . 5.500 3.975 3.411 4.374 . 0 0 "[ . 1 . 2]" 1
1643 1 101 LYS QD 1 105 ASN HD22 . . 5.500 3.650 2.839 4.372 . 0 0 "[ . 1 . 2]" 1
1644 1 101 LYS QE 1 105 ASN QD . . 4.590 3.951 2.096 4.575 . 0 0 "[ . 1 . 2]" 1
1645 1 101 LYS QG 1 102 ALA H . . 4.280 3.639 2.981 4.114 . 0 0 "[ . 1 . 2]" 1
1646 1 101 LYS QG 1 105 ASN QD . . 3.590 2.145 1.816 2.410 . 0 0 "[ . 1 . 2]" 1
1647 1 101 LYS HG2 1 102 ALA H . . 5.000 3.860 3.043 4.855 . 0 0 "[ . 1 . 2]" 1
1648 1 101 LYS HG2 1 105 ASN HD21 . . 4.930 2.794 1.940 4.082 . 0 0 "[ . 1 . 2]" 1
1649 1 101 LYS HG2 1 105 ASN HD22 . . 4.930 2.847 1.905 4.100 . 0 0 "[ . 1 . 2]" 1
1650 1 101 LYS HG3 1 102 ALA H . . 5.000 4.613 4.271 5.002 0.002 7 0 "[ . 1 . 2]" 1
1651 1 101 LYS HG3 1 105 ASN HD21 . . 4.930 3.496 2.237 4.850 . 0 0 "[ . 1 . 2]" 1
1652 1 101 LYS HG3 1 105 ASN HD22 . . 4.930 2.850 2.122 3.955 . 0 0 "[ . 1 . 2]" 1
1653 1 102 ALA H 1 102 ALA MB . . 2.980 2.066 2.026 2.255 . 0 0 "[ . 1 . 2]" 1
1654 1 102 ALA H 1 103 VAL H . . 3.470 2.927 2.675 3.092 . 0 0 "[ . 1 . 2]" 1
1655 1 102 ALA H 1 103 VAL QG . . 4.400 4.009 3.375 4.402 0.002 15 0 "[ . 1 . 2]" 1
1656 1 102 ALA H 1 104 LYS H . . 4.620 4.130 3.647 4.513 . 0 0 "[ . 1 . 2]" 1
1657 1 102 ALA HA 1 104 LYS H . . 4.830 4.298 3.779 4.646 . 0 0 "[ . 1 . 2]" 1
1658 1 102 ALA HA 1 105 ASN H . . 4.000 3.389 3.108 3.550 . 0 0 "[ . 1 . 2]" 1
1659 1 102 ALA HA 1 105 ASN QB . . 3.860 3.004 2.224 3.312 . 0 0 "[ . 1 . 2]" 1
1660 1 102 ALA HA 1 105 ASN QD . . 4.830 3.243 2.698 4.003 . 0 0 "[ . 1 . 2]" 1
1661 1 102 ALA HA 1 107 VAL H . . 3.760 3.387 2.811 3.762 0.002 12 0 "[ . 1 . 2]" 1
1662 1 102 ALA HA 1 107 VAL HB . . 3.730 2.652 2.061 3.059 . 0 0 "[ . 1 . 2]" 1
1663 1 102 ALA HA 1 107 VAL MG1 . . 4.390 3.802 2.449 4.106 . 0 0 "[ . 1 . 2]" 1
1664 1 102 ALA HA 1 107 VAL QG . . 3.040 2.293 1.951 2.895 . 0 0 "[ . 1 . 2]" 1
1665 1 102 ALA HA 1 107 VAL MG2 . . 4.390 2.396 1.956 4.093 . 0 0 "[ . 1 . 2]" 1
1666 1 102 ALA MB 1 103 VAL H . . 3.120 2.289 2.102 2.511 . 0 0 "[ . 1 . 2]" 1
1667 1 102 ALA MB 1 105 ASN H . . 5.500 4.489 4.284 4.625 . 0 0 "[ . 1 . 2]" 1
1668 1 102 ALA MB 1 105 ASN QB . . 4.520 4.351 3.732 4.520 . 0 0 "[ . 1 . 2]" 1
1669 1 102 ALA MB 1 105 ASN QD . . 5.340 4.542 4.143 5.132 . 0 0 "[ . 1 . 2]" 1
1670 1 102 ALA MB 1 107 VAL H . . 4.280 3.501 3.224 4.024 . 0 0 "[ . 1 . 2]" 1
1671 1 102 ALA MB 1 107 VAL HB . . 3.210 2.330 2.043 3.209 . 0 0 "[ . 1 . 2]" 1
1672 1 102 ALA MB 1 107 VAL QG . . 3.290 2.737 1.724 3.286 . 0 0 "[ . 1 . 2]" 1
1673 1 102 ALA MB 1 109 LEU MD2 . . 3.200 2.083 1.862 2.571 . 0 0 "[ . 1 . 2]" 1
1674 1 103 VAL H 1 103 VAL HB . . 3.050 2.577 2.353 2.734 . 0 0 "[ . 1 . 2]" 1
1675 1 103 VAL H 1 103 VAL MG1 . . 3.910 3.071 1.900 3.781 . 0 0 "[ . 1 . 2]" 1
1676 1 103 VAL H 1 103 VAL QG . . 2.920 2.095 1.876 2.486 . 0 0 "[ . 1 . 2]" 1
1677 1 103 VAL H 1 103 VAL MG2 . . 3.910 2.801 1.881 3.775 . 0 0 "[ . 1 . 2]" 1
1678 1 103 VAL H 1 104 LYS H . . 3.370 2.914 2.567 3.098 . 0 0 "[ . 1 . 2]" 1
1679 1 103 VAL H 1 105 ASN H . . 4.620 4.373 3.993 4.569 . 0 0 "[ . 1 . 2]" 1
1680 1 103 VAL HA 1 103 VAL MG1 . . 3.240 2.774 2.338 3.203 . 0 0 "[ . 1 . 2]" 1
1681 1 103 VAL HA 1 103 VAL QG . . 2.830 2.207 2.060 2.373 . 0 0 "[ . 1 . 2]" 1
1682 1 103 VAL HA 1 103 VAL MG2 . . 3.240 2.358 2.261 2.446 . 0 0 "[ . 1 . 2]" 1
1683 1 103 VAL HA 1 106 GLN H . . 3.870 3.721 3.503 3.870 . 15 0 "[ . 1 . 2]" 1
1684 1 103 VAL HA 1 106 GLN HA . . 4.620 3.476 3.216 4.240 . 0 0 "[ . 1 . 2]" 1
1685 1 103 VAL HA 1 107 VAL H . . 4.540 3.889 3.198 4.534 . 0 0 "[ . 1 . 2]" 1
1686 1 103 VAL QG 1 104 LYS H . . 3.490 2.656 1.882 3.186 . 0 0 "[ . 1 . 2]" 1
1687 1 103 VAL QG 1 104 LYS HA . . 3.930 3.233 2.900 3.491 . 0 0 "[ . 1 . 2]" 1
1688 1 103 VAL MG1 1 104 LYS H . . 3.990 2.767 1.889 3.419 . 0 0 "[ . 1 . 2]" 1
1689 1 103 VAL MG2 1 104 LYS H . . 3.990 3.753 3.483 3.970 . 0 0 "[ . 1 . 2]" 1
1690 1 104 LYS H 1 104 LYS QB . . 2.780 2.265 2.124 2.589 . 0 0 "[ . 1 . 2]" 1
1691 1 104 LYS H 1 104 LYS QD . . 5.010 4.061 2.468 4.557 . 0 0 "[ . 1 . 2]" 1
1692 1 104 LYS H 1 104 LYS QE . . 5.320 4.662 3.154 5.313 . 0 0 "[ . 1 . 2]" 1
1693 1 104 LYS H 1 104 LYS QG . . 4.010 3.187 1.888 4.021 0.011 13 0 "[ . 1 . 2]" 1
1694 1 104 LYS H 1 105 ASN H . . 3.380 2.659 2.298 2.950 . 0 0 "[ . 1 . 2]" 1
1695 1 104 LYS HA 1 104 LYS QD . . 3.460 2.449 1.988 3.230 . 0 0 "[ . 1 . 2]" 1
1696 1 104 LYS HA 1 106 GLN H . . 4.150 3.647 3.475 3.755 . 0 0 "[ . 1 . 2]" 1
1697 1 104 LYS QB 1 105 ASN H . . 3.410 2.560 2.330 2.917 . 0 0 "[ . 1 . 2]" 1
1698 1 104 LYS QB 1 105 ASN QD . . 5.310 3.706 2.998 4.952 . 0 0 "[ . 1 . 2]" 1
1699 1 104 LYS QB 1 106 GLN H . . 4.680 4.344 4.219 4.517 . 0 0 "[ . 1 . 2]" 1
1700 1 104 LYS QD 1 104 LYS QG . . 2.340 2.045 2.023 2.092 . 0 0 "[ . 1 . 2]" 1
1701 1 104 LYS QE 1 104 LYS QG . . 3.290 2.186 2.041 2.547 . 0 0 "[ . 1 . 2]" 1
1702 1 104 LYS QG 1 105 ASN H . . 4.490 3.975 3.335 4.493 0.003 9 0 "[ . 1 . 2]" 1
1703 1 105 ASN H 1 105 ASN HB2 . . 3.780 2.523 2.379 2.698 . 0 0 "[ . 1 . 2]" 1
1704 1 105 ASN H 1 105 ASN QB . . 3.040 2.479 2.348 2.629 . 0 0 "[ . 1 . 2]" 1
1705 1 105 ASN H 1 105 ASN HB3 . . 3.780 3.640 3.598 3.691 . 0 0 "[ . 1 . 2]" 1
1706 1 105 ASN H 1 106 GLN HA . . 5.020 4.695 4.494 4.784 . 0 0 "[ . 1 . 2]" 1
1707 1 105 ASN H 1 107 VAL QG . . 4.090 3.608 3.269 4.023 . 0 0 "[ . 1 . 2]" 1
1708 1 105 ASN QB 1 106 GLN H . . 4.390 3.659 3.442 3.727 . 0 0 "[ . 1 . 2]" 1
1709 1 105 ASN QB 1 107 VAL H . . 4.410 3.322 2.890 3.644 . 0 0 "[ . 1 . 2]" 1
1710 1 105 ASN QB 1 107 VAL HA . . 5.340 4.344 4.101 4.685 . 0 0 "[ . 1 . 2]" 1
1711 1 105 ASN QB 1 107 VAL HB . . 4.740 3.824 2.833 4.239 . 0 0 "[ . 1 . 2]" 1
1712 1 105 ASN QB 1 107 VAL QG . . 3.150 1.974 1.834 3.150 . 15 0 "[ . 1 . 2]" 1
1713 1 106 GLN H 1 106 GLN HA . . 2.840 2.298 2.276 2.314 . 0 0 "[ . 1 . 2]" 1
1714 1 106 GLN H 1 106 GLN QB . . 3.680 3.121 2.842 3.271 . 0 0 "[ . 1 . 2]" 1
1715 1 106 GLN H 1 106 GLN QG . . 3.760 2.697 2.264 3.123 . 0 0 "[ . 1 . 2]" 1
1716 1 106 GLN H 1 107 VAL H . . 3.370 2.973 2.702 3.110 . 0 0 "[ . 1 . 2]" 1
1717 1 106 GLN H 1 107 VAL QG . . 4.250 4.036 3.896 4.208 . 0 0 "[ . 1 . 2]" 1
1718 1 106 GLN HA 1 106 GLN QG . . 3.370 2.553 2.238 3.338 . 0 0 "[ . 1 . 2]" 1
1719 1 106 GLN HA 1 107 VAL H . . 3.380 2.751 2.645 2.974 . 0 0 "[ . 1 . 2]" 1
1720 1 106 GLN HA 1 107 VAL QG . . 4.560 4.355 4.239 4.446 . 0 0 "[ . 1 . 2]" 1
1721 1 106 GLN HB2 1 107 VAL H . . 5.500 4.308 4.045 4.440 . 0 0 "[ . 1 . 2]" 1
1722 1 106 GLN HB3 1 107 VAL H . . 5.500 4.396 4.346 4.644 . 0 0 "[ . 1 . 2]" 1
1723 1 106 GLN QG 1 107 VAL H . . 5.500 4.602 3.961 4.933 . 0 0 "[ . 1 . 2]" 1
1724 1 107 VAL H 1 107 VAL HB . . 3.000 2.489 2.396 2.567 . 0 0 "[ . 1 . 2]" 1
1725 1 107 VAL H 1 107 VAL MG1 . . 3.860 3.701 2.365 3.789 . 0 0 "[ . 1 . 2]" 1
1726 1 107 VAL H 1 107 VAL QG . . 2.930 2.390 2.070 2.659 . 0 0 "[ . 1 . 2]" 1
1727 1 107 VAL H 1 107 VAL MG2 . . 3.860 2.488 2.080 3.753 . 0 0 "[ . 1 . 2]" 1
1728 1 107 VAL H 1 108 ASP H . . 4.730 4.527 4.419 4.639 . 0 0 "[ . 1 . 2]" 1
1729 1 107 VAL HA 1 107 VAL MG1 . . 3.230 2.450 2.293 3.190 . 0 0 "[ . 1 . 2]" 1
1730 1 107 VAL HA 1 107 VAL QG . . 2.820 2.120 2.057 2.219 . 0 0 "[ . 1 . 2]" 1
1731 1 107 VAL HA 1 107 VAL MG2 . . 3.230 2.339 2.264 2.435 . 0 0 "[ . 1 . 2]" 1
1732 1 107 VAL HA 1 108 ASP H . . 2.940 2.179 2.139 2.306 . 0 0 "[ . 1 . 2]" 1
1733 1 107 VAL HA 1 108 ASP QB . . 4.690 4.518 4.358 4.655 . 0 0 "[ . 1 . 2]" 1
1734 1 107 VAL HB 1 108 ASP H . . 4.600 4.134 3.832 4.309 . 0 0 "[ . 1 . 2]" 1
1735 1 107 VAL HB 1 109 LEU MD2 . . 4.710 3.894 3.165 4.711 0.001 15 0 "[ . 1 . 2]" 1
1736 1 107 VAL QG 1 108 ASP H . . 3.340 2.451 2.023 2.786 . 0 0 "[ . 1 . 2]" 1
1737 1 107 VAL QG 1 109 LEU HA . . 4.290 4.023 3.173 4.257 . 0 0 "[ . 1 . 2]" 1
1738 1 107 VAL MG1 1 108 ASP H . . 4.290 2.552 2.032 3.518 . 0 0 "[ . 1 . 2]" 1
1739 1 107 VAL MG2 1 108 ASP H . . 4.290 3.889 2.039 4.108 . 0 0 "[ . 1 . 2]" 1
1740 1 108 ASP H 1 108 ASP HB2 . . 3.700 2.688 2.401 3.598 . 0 0 "[ . 1 . 2]" 1
1741 1 108 ASP H 1 108 ASP QB . . 3.190 2.577 2.367 2.803 . 0 0 "[ . 1 . 2]" 1
1742 1 108 ASP H 1 108 ASP HB3 . . 3.700 3.545 2.731 3.622 . 0 0 "[ . 1 . 2]" 1
1743 1 108 ASP HA 1 109 LEU H . . 2.870 2.157 2.139 2.335 . 0 0 "[ . 1 . 2]" 1
1744 1 108 ASP HA 1 109 LEU HA . . 4.600 4.403 4.371 4.562 . 0 0 "[ . 1 . 2]" 1
1745 1 108 ASP HA 1 109 LEU MD1 . . 5.320 5.129 4.906 5.321 0.001 15 0 "[ . 1 . 2]" 1
1746 1 108 ASP HA 1 109 LEU MD2 . . 5.390 5.001 4.838 5.236 . 0 0 "[ . 1 . 2]" 1
1747 1 108 ASP HA 1 110 LYS H . . 4.010 3.685 3.392 3.953 . 0 0 "[ . 1 . 2]" 1
1748 1 108 ASP QB 1 110 LYS H . . 4.730 3.587 3.187 3.859 . 0 0 "[ . 1 . 2]" 1
1749 1 108 ASP QB 1 110 LYS QB . . 4.640 3.759 3.282 4.640 . 0 0 "[ . 1 . 2]" 1
1750 1 108 ASP QB 1 111 GLU H . . 4.090 3.106 2.915 3.275 . 0 0 "[ . 1 . 2]" 1
1751 1 108 ASP QB 1 111 GLU QB . . 4.240 3.213 2.803 3.476 . 0 0 "[ . 1 . 2]" 1
1752 1 108 ASP QB 1 111 GLU QG . . 3.950 2.275 1.911 2.965 . 0 0 "[ . 1 . 2]" 1
1753 1 108 ASP HB2 1 109 LEU H . . 4.420 4.233 3.578 4.422 0.002 15 0 "[ . 1 . 2]" 1
1754 1 108 ASP HB3 1 109 LEU H . . 4.420 3.563 3.297 4.185 . 0 0 "[ . 1 . 2]" 1
1755 1 109 LEU H 1 109 LEU HB2 . . 3.980 2.399 2.291 2.506 . 0 0 "[ . 1 . 2]" 1
1756 1 109 LEU H 1 109 LEU QB . . 3.210 2.366 2.265 2.460 . 0 0 "[ . 1 . 2]" 1
1757 1 109 LEU H 1 109 LEU HB3 . . 3.980 3.617 3.560 3.677 . 0 0 "[ . 1 . 2]" 1
1758 1 109 LEU H 1 109 LEU MD1 . . 3.840 3.720 3.531 3.841 0.001 12 0 "[ . 1 . 2]" 1
1759 1 109 LEU H 1 109 LEU MD2 . . 3.970 3.793 3.354 3.963 . 0 0 "[ . 1 . 2]" 1
1760 1 109 LEU H 1 109 LEU HG . . 3.140 2.760 2.199 2.978 . 0 0 "[ . 1 . 2]" 1
1761 1 109 LEU H 1 110 LYS H . . 3.410 2.250 2.018 2.790 . 0 0 "[ . 1 . 2]" 1
1762 1 109 LEU H 1 111 GLU H . . 4.640 3.980 3.751 4.234 . 0 0 "[ . 1 . 2]" 1
1763 1 109 LEU HA 1 109 LEU MD1 . . 4.020 3.879 3.854 3.905 . 0 0 "[ . 1 . 2]" 1
1764 1 109 LEU HA 1 109 LEU MD2 . . 3.110 2.015 1.971 2.217 . 0 0 "[ . 1 . 2]" 1
1765 1 109 LEU HA 1 111 GLU H . . 4.330 3.741 3.367 3.946 . 0 0 "[ . 1 . 2]" 1
1766 1 109 LEU HA 1 112 LEU H . . 4.150 3.316 3.092 4.068 . 0 0 "[ . 1 . 2]" 1
1767 1 109 LEU HA 1 112 LEU MD1 . . 3.680 2.189 1.972 2.454 . 0 0 "[ . 1 . 2]" 1
1768 1 109 LEU HA 1 112 LEU MD2 . . 4.260 3.288 2.995 3.501 . 0 0 "[ . 1 . 2]" 1
1769 1 109 LEU HA 1 112 LEU HG . . 3.760 2.094 1.998 2.385 . 0 0 "[ . 1 . 2]" 1
1770 1 109 LEU QB 1 109 LEU MD1 . . 3.020 2.074 2.026 2.100 . 0 0 "[ . 1 . 2]" 1
1771 1 109 LEU QB 1 109 LEU MD2 . . 3.090 2.282 2.196 2.309 . 0 0 "[ . 1 . 2]" 1
1772 1 109 LEU QB 1 110 LYS H . . 3.520 2.752 2.572 3.068 . 0 0 "[ . 1 . 2]" 1
1773 1 109 LEU QB 1 110 LYS HA . . 4.670 3.896 3.845 3.995 . 0 0 "[ . 1 . 2]" 1
1774 1 109 LEU QB 1 112 LEU H . . 5.340 4.452 4.265 4.874 . 0 0 "[ . 1 . 2]" 1
1775 1 109 LEU HB2 1 110 LYS H . . 4.070 2.835 2.637 3.182 . 0 0 "[ . 1 . 2]" 1
1776 1 109 LEU HB3 1 110 LYS H . . 4.070 3.730 3.474 4.026 . 0 0 "[ . 1 . 2]" 1
1777 1 109 LEU MD1 1 110 LYS H . . 4.820 4.636 4.456 4.821 0.001 16 0 "[ . 1 . 2]" 1
1778 1 109 LEU MD2 1 112 LEU MD2 . . 2.920 2.915 2.887 2.924 0.004 12 0 "[ . 1 . 2]" 1
1779 1 110 LYS H 1 110 LYS HB2 . . 3.660 2.538 2.205 3.598 . 0 0 "[ . 1 . 2]" 1
1780 1 110 LYS H 1 110 LYS QB . . 3.010 2.330 2.183 2.521 . 0 0 "[ . 1 . 2]" 1
1781 1 110 LYS H 1 110 LYS HB3 . . 3.660 3.389 2.339 3.602 . 0 0 "[ . 1 . 2]" 1
1782 1 110 LYS H 1 110 LYS QD . . 4.650 3.742 1.897 4.532 . 0 0 "[ . 1 . 2]" 1
1783 1 110 LYS H 1 110 LYS HG2 . . 4.320 3.320 2.290 3.913 . 0 0 "[ . 1 . 2]" 1
1784 1 110 LYS H 1 110 LYS QG . . 3.470 2.502 2.064 3.455 . 0 0 "[ . 1 . 2]" 1
1785 1 110 LYS H 1 110 LYS HG3 . . 4.320 2.904 2.084 3.878 . 0 0 "[ . 1 . 2]" 1
1786 1 110 LYS H 1 111 GLU H . . 3.170 2.758 2.507 2.896 . 0 0 "[ . 1 . 2]" 1
1787 1 110 LYS H 1 111 GLU QB . . 5.050 4.852 4.617 4.977 . 0 0 "[ . 1 . 2]" 1
1788 1 110 LYS H 1 111 GLU QG . . 4.510 4.160 3.704 4.420 . 0 0 "[ . 1 . 2]" 1
1789 1 110 LYS H 1 112 LEU H . . 4.490 4.371 4.209 4.452 . 0 0 "[ . 1 . 2]" 1
1790 1 110 LYS HA 1 110 LYS HG2 . . 4.140 2.714 2.203 3.677 . 0 0 "[ . 1 . 2]" 1
1791 1 110 LYS HA 1 110 LYS QG . . 3.580 2.506 2.157 3.343 . 0 0 "[ . 1 . 2]" 1
1792 1 110 LYS HA 1 110 LYS HG3 . . 4.140 3.144 2.454 3.914 . 0 0 "[ . 1 . 2]" 1
1793 1 110 LYS HA 1 112 LEU H . . 4.690 4.198 3.540 4.527 . 0 0 "[ . 1 . 2]" 1
1794 1 110 LYS QB 1 110 LYS QD . . 3.240 2.166 2.059 2.611 . 0 0 "[ . 1 . 2]" 1
1795 1 110 LYS QB 1 110 LYS QE . . 3.850 3.001 2.129 3.733 . 0 0 "[ . 1 . 2]" 1
1796 1 110 LYS QB 1 111 GLU H . . 3.740 2.969 2.720 3.662 . 0 0 "[ . 1 . 2]" 1
1797 1 110 LYS HB2 1 110 LYS QD . . 3.740 2.656 2.196 3.405 . 0 0 "[ . 1 . 2]" 1
1798 1 110 LYS HB2 1 111 GLU H . . 4.340 3.140 2.791 4.189 . 0 0 "[ . 1 . 2]" 1
1799 1 110 LYS HB3 1 110 LYS QD . . 3.740 2.442 2.084 3.389 . 0 0 "[ . 1 . 2]" 1
1800 1 110 LYS HB3 1 111 GLU H . . 4.340 3.737 3.419 4.119 . 0 0 "[ . 1 . 2]" 1
1801 1 110 LYS QE 1 110 LYS QG . . 3.110 2.234 2.039 2.576 . 0 0 "[ . 1 . 2]" 1
1802 1 110 LYS QG 1 111 GLU H . . 4.940 4.034 2.099 4.612 . 0 0 "[ . 1 . 2]" 1
1803 1 111 GLU H 1 111 GLU HB2 . . 3.930 2.731 2.403 3.706 . 0 0 "[ . 1 . 2]" 1
1804 1 111 GLU H 1 111 GLU QB . . 3.090 2.489 2.369 2.848 . 0 0 "[ . 1 . 2]" 1
1805 1 111 GLU H 1 111 GLU HB3 . . 3.930 3.412 2.541 3.665 . 0 0 "[ . 1 . 2]" 1
1806 1 111 GLU H 1 111 GLU HG2 . . 3.730 2.764 1.979 3.660 . 0 0 "[ . 1 . 2]" 1
1807 1 111 GLU H 1 111 GLU QG . . 3.160 2.198 1.960 2.564 . 0 0 "[ . 1 . 2]" 1
1808 1 111 GLU H 1 111 GLU HG3 . . 3.730 2.796 2.202 3.638 . 0 0 "[ . 1 . 2]" 1
1809 1 111 GLU H 1 112 LEU H . . 3.190 2.612 2.412 2.820 . 0 0 "[ . 1 . 2]" 1
1810 1 111 GLU H 1 112 LEU HG . . 4.180 3.831 3.231 4.071 . 0 0 "[ . 1 . 2]" 1
1811 1 111 GLU HA 1 111 GLU HG2 . . 3.950 2.846 2.386 3.794 . 0 0 "[ . 1 . 2]" 1
1812 1 111 GLU HA 1 111 GLU QG . . 3.450 2.698 2.326 3.339 . 0 0 "[ . 1 . 2]" 1
1813 1 111 GLU HA 1 111 GLU HG3 . . 3.950 3.473 3.038 3.818 . 0 0 "[ . 1 . 2]" 1
1814 1 111 GLU QB 1 112 LEU H . . 4.030 2.867 2.420 4.005 . 0 0 "[ . 1 . 2]" 1
1815 1 111 GLU QB 1 112 LEU MD2 . . 4.730 3.950 3.102 4.722 . 0 0 "[ . 1 . 2]" 1
1816 1 111 GLU HB2 1 112 LEU H . . 4.730 3.000 2.463 4.444 . 0 0 "[ . 1 . 2]" 1
1817 1 111 GLU HB3 1 112 LEU H . . 4.730 3.833 3.552 4.550 . 0 0 "[ . 1 . 2]" 1
1818 1 111 GLU QG 1 112 LEU H . . 5.340 3.736 2.016 4.484 . 0 0 "[ . 1 . 2]" 1
1819 1 112 LEU H 1 112 LEU HB2 . . 3.570 2.695 2.308 2.920 . 0 0 "[ . 1 . 2]" 1
1820 1 112 LEU H 1 112 LEU HB3 . . 3.640 3.590 3.563 3.643 0.003 11 0 "[ . 1 . 2]" 1
1821 1 112 LEU H 1 112 LEU MD1 . . 4.070 3.467 3.262 3.820 . 0 0 "[ . 1 . 2]" 1
1822 1 112 LEU H 1 112 LEU MD2 . . 4.310 3.092 2.339 3.938 . 0 0 "[ . 1 . 2]" 1
1823 1 112 LEU H 1 112 LEU HG . . 2.970 2.003 1.899 2.897 . 0 0 "[ . 1 . 2]" 1
1824 1 112 LEU H 1 113 ASP H . . 4.500 4.287 4.155 4.398 . 0 0 "[ . 1 . 2]" 1
1825 1 112 LEU HA 1 112 LEU MD1 . . 4.360 3.919 3.860 3.961 . 0 0 "[ . 1 . 2]" 1
1826 1 112 LEU HA 1 112 LEU MD2 . . 3.190 2.305 2.162 2.483 . 0 0 "[ . 1 . 2]" 1
1827 1 112 LEU HA 1 113 ASP H . . 2.950 2.181 2.141 2.249 . 0 0 "[ . 1 . 2]" 1
1828 1 112 LEU HA 1 114 GLN H . . 5.500 5.294 4.460 5.499 . 0 0 "[ . 1 . 2]" 1
1829 1 112 LEU HB2 1 112 LEU MD1 . . 3.590 2.283 2.090 2.397 . 0 0 "[ . 1 . 2]" 1
1830 1 112 LEU HB3 1 112 LEU MD2 . . 3.430 2.236 2.110 2.369 . 0 0 "[ . 1 . 2]" 1
1831 1 112 LEU HB3 1 113 ASP H . . 4.040 3.792 3.541 3.997 . 0 0 "[ . 1 . 2]" 1
1832 1 112 LEU MD2 1 113 ASP H . . 4.170 4.039 3.695 4.166 . 0 0 "[ . 1 . 2]" 1
1833 1 113 ASP H 1 113 ASP HB2 . . 4.040 3.486 2.521 4.004 . 0 0 "[ . 1 . 2]" 1
1834 1 113 ASP H 1 113 ASP HB3 . . 4.040 3.319 2.712 3.936 . 0 0 "[ . 1 . 2]" 1
1835 1 113 ASP H 1 114 GLN H . . 3.890 3.826 3.538 3.891 0.001 4 0 "[ . 1 . 2]" 1
1836 1 113 ASP HA 1 114 GLN H . . 3.090 2.187 2.150 2.404 . 0 0 "[ . 1 . 2]" 1
1837 1 113 ASP HA 1 114 GLN QB . . 4.580 4.171 4.037 4.399 . 0 0 "[ . 1 . 2]" 1
1838 1 113 ASP HB2 1 114 GLN H . . 4.550 4.153 3.683 4.532 . 0 0 "[ . 1 . 2]" 1
1839 1 113 ASP HB3 1 114 GLN H . . 4.550 4.303 3.698 4.509 . 0 0 "[ . 1 . 2]" 1
1840 1 114 GLN H 1 114 GLN HB2 . . 3.910 2.800 2.172 3.887 . 0 0 "[ . 1 . 2]" 1
1841 1 114 GLN H 1 114 GLN HB3 . . 3.910 2.676 2.306 3.540 . 0 0 "[ . 1 . 2]" 1
1842 1 114 GLN H 1 114 GLN QG . . 4.020 3.536 2.400 4.041 0.021 18 0 "[ . 1 . 2]" 1
1843 1 114 GLN HA 1 114 GLN QG . . 3.800 2.876 2.272 3.586 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Wednesday, May 15, 2024 9:41:10 PM GMT (wattos1)