NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
405375 |
1x5k   |
11111 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1x5k
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 2230
_Distance_constraint_stats_list.Viol_count 625
_Distance_constraint_stats_list.Viol_total 165.342
_Distance_constraint_stats_list.Viol_max 0.245
_Distance_constraint_stats_list.Viol_rms 0.0031
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0132
_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 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 GLU 0.085 0.018 16 0 "[ . 1 . 2]"
1 16 LEU 0.421 0.078 16 0 "[ . 1 . 2]"
1 17 VAL 0.359 0.078 16 0 "[ . 1 . 2]"
1 18 PRO 0.064 0.023 19 0 "[ . 1 . 2]"
1 19 THR 0.023 0.012 11 0 "[ . 1 . 2]"
1 20 SER 0.030 0.010 18 0 "[ . 1 . 2]"
1 21 PRO 0.026 0.015 16 0 "[ . 1 . 2]"
1 22 PRO 0.022 0.009 19 0 "[ . 1 . 2]"
1 23 LYS 0.001 0.001 17 0 "[ . 1 . 2]"
1 24 ASP 0.006 0.005 5 0 "[ . 1 . 2]"
1 25 VAL 0.021 0.008 19 0 "[ . 1 . 2]"
1 26 THR 0.012 0.005 10 0 "[ . 1 . 2]"
1 27 VAL 0.021 0.007 13 0 "[ . 1 . 2]"
1 28 VAL 0.044 0.014 16 0 "[ . 1 . 2]"
1 29 SER 0.127 0.037 13 0 "[ . 1 . 2]"
1 30 LYS 0.991 0.118 13 0 "[ . 1 . 2]"
1 31 GLU 0.458 0.092 15 0 "[ . 1 . 2]"
1 32 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 LYS 0.694 0.151 18 0 "[ . 1 . 2]"
1 34 PRO 0.085 0.030 7 0 "[ . 1 . 2]"
1 35 LYS 0.419 0.151 18 0 "[ . 1 . 2]"
1 36 THR 0.215 0.061 13 0 "[ . 1 . 2]"
1 37 ILE 0.049 0.007 13 0 "[ . 1 . 2]"
1 38 ILE 0.019 0.005 17 0 "[ . 1 . 2]"
1 39 VAL 0.075 0.018 8 0 "[ . 1 . 2]"
1 40 ASN 0.119 0.046 16 0 "[ . 1 . 2]"
1 41 TRP 0.021 0.004 16 0 "[ . 1 . 2]"
1 42 GLN 0.151 0.129 15 0 "[ . 1 . 2]"
1 43 PRO 0.135 0.129 15 0 "[ . 1 . 2]"
1 44 PRO 0.002 0.002 7 0 "[ . 1 . 2]"
1 45 SER 0.001 0.001 13 0 "[ . 1 . 2]"
1 46 GLU 0.011 0.007 18 0 "[ . 1 . 2]"
1 47 ALA 0.086 0.035 17 0 "[ . 1 . 2]"
1 48 ASN 0.269 0.037 16 0 "[ . 1 . 2]"
1 49 GLY 0.206 0.037 16 0 "[ . 1 . 2]"
1 50 LYS 0.056 0.022 20 0 "[ . 1 . 2]"
1 51 ILE 0.057 0.017 19 0 "[ . 1 . 2]"
1 52 THR 0.166 0.110 10 0 "[ . 1 . 2]"
1 53 GLY 0.013 0.013 10 0 "[ . 1 . 2]"
1 54 TYR 0.044 0.016 2 0 "[ . 1 . 2]"
1 55 ILE 0.168 0.040 19 0 "[ . 1 . 2]"
1 56 ILE 0.023 0.009 7 0 "[ . 1 . 2]"
1 57 TYR 0.076 0.013 16 0 "[ . 1 . 2]"
1 58 TYR 0.030 0.015 2 0 "[ . 1 . 2]"
1 59 SER 0.022 0.020 2 0 "[ . 1 . 2]"
1 60 THR 0.002 0.002 9 0 "[ . 1 . 2]"
1 61 ASP 0.011 0.008 16 0 "[ . 1 . 2]"
1 62 VAL 0.093 0.015 1 0 "[ . 1 . 2]"
1 63 ASN 0.022 0.022 13 0 "[ . 1 . 2]"
1 64 ALA 0.032 0.022 13 0 "[ . 1 . 2]"
1 65 GLU 0.017 0.010 2 0 "[ . 1 . 2]"
1 66 ILE 0.053 0.016 2 0 "[ . 1 . 2]"
1 67 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 ASP 0.003 0.003 13 0 "[ . 1 . 2]"
1 69 TRP 0.094 0.020 2 0 "[ . 1 . 2]"
1 70 VAL 0.002 0.002 20 0 "[ . 1 . 2]"
1 71 ILE 0.071 0.020 16 0 "[ . 1 . 2]"
1 72 GLU 0.494 0.043 20 0 "[ . 1 . 2]"
1 73 PRO 0.473 0.043 20 0 "[ . 1 . 2]"
1 74 VAL 0.148 0.030 15 0 "[ . 1 . 2]"
1 75 VAL 0.001 0.001 13 0 "[ . 1 . 2]"
1 76 GLY 0.000 0.000 2 0 "[ . 1 . 2]"
1 77 ASN 0.005 0.005 19 0 "[ . 1 . 2]"
1 78 ARG 0.371 0.079 19 0 "[ . 1 . 2]"
1 79 LEU 0.008 0.004 16 0 "[ . 1 . 2]"
1 80 THR 0.025 0.011 20 0 "[ . 1 . 2]"
1 81 HIS 0.036 0.009 16 0 "[ . 1 . 2]"
1 82 GLN 0.019 0.007 20 0 "[ . 1 . 2]"
1 83 ILE 0.089 0.021 12 0 "[ . 1 . 2]"
1 84 GLN 0.329 0.085 18 0 "[ . 1 . 2]"
1 85 GLU 0.126 0.041 13 0 "[ . 1 . 2]"
1 86 LEU 0.157 0.049 13 0 "[ . 1 . 2]"
1 87 THR 0.496 0.173 14 0 "[ . 1 . 2]"
1 88 LEU 0.118 0.023 9 0 "[ . 1 . 2]"
1 89 ASP 0.025 0.014 14 0 "[ . 1 . 2]"
1 90 THR 0.384 0.173 14 0 "[ . 1 . 2]"
1 91 PRO 0.025 0.015 9 0 "[ . 1 . 2]"
1 92 TYR 0.015 0.006 2 0 "[ . 1 . 2]"
1 93 TYR 0.034 0.008 16 0 "[ . 1 . 2]"
1 94 PHE 0.015 0.004 16 0 "[ . 1 . 2]"
1 95 LYS 0.018 0.006 16 0 "[ . 1 . 2]"
1 96 ILE 0.030 0.005 2 0 "[ . 1 . 2]"
1 97 GLN 0.089 0.021 3 0 "[ . 1 . 2]"
1 98 ALA 0.086 0.021 3 0 "[ . 1 . 2]"
1 99 ARG 0.267 0.030 6 0 "[ . 1 . 2]"
1 100 ASN 0.116 0.021 16 0 "[ . 1 . 2]"
1 101 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 LYS 0.206 0.061 10 0 "[ . 1 . 2]"
1 103 GLY 0.046 0.020 10 0 "[ . 1 . 2]"
1 104 MET 0.775 0.245 20 0 "[ . 1 . 2]"
1 105 GLY 0.193 0.049 19 0 "[ . 1 . 2]"
1 106 PRO 0.073 0.058 3 0 "[ . 1 . 2]"
1 107 MET 0.132 0.058 3 0 "[ . 1 . 2]"
1 108 SER 0.033 0.015 16 0 "[ . 1 . 2]"
1 109 GLU 0.317 0.104 6 0 "[ . 1 . 2]"
1 110 ALA 0.003 0.002 10 0 "[ . 1 . 2]"
1 111 VAL 0.014 0.007 1 0 "[ . 1 . 2]"
1 112 GLN 0.003 0.002 3 0 "[ . 1 . 2]"
1 113 PHE 0.067 0.029 7 0 "[ . 1 . 2]"
1 114 ARG 0.014 0.005 18 0 "[ . 1 . 2]"
1 115 THR 0.035 0.015 9 0 "[ . 1 . 2]"
1 116 PRO 0.743 0.051 7 0 "[ . 1 . 2]"
1 117 LYS 0.814 0.051 7 0 "[ . 1 . 2]"
1 118 ALA 0.047 0.011 14 0 "[ . 1 . 2]"
1 119 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 120 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 121 PRO 0.000 0.000 . 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 THR HA 1 8 THR MG . . 3.670 2.557 2.210 3.198 . 0 0 "[ . 1 . 2]" 1
2 1 13 THR HA 1 13 THR MG . . 3.360 2.411 2.156 3.203 . 0 0 "[ . 1 . 2]" 1
3 1 13 THR HB 1 14 PHE H . . 4.870 3.849 2.267 4.420 . 0 0 "[ . 1 . 2]" 1
4 1 13 THR MG 1 14 PHE H . . 4.960 3.438 1.826 4.389 . 0 0 "[ . 1 . 2]" 1
5 1 14 PHE HA 1 14 PHE QD . . 4.210 3.211 2.060 3.721 . 0 0 "[ . 1 . 2]" 1
6 1 14 PHE HA 1 15 GLU H . . 3.170 2.258 2.140 2.844 . 0 0 "[ . 1 . 2]" 1
7 1 14 PHE QB 1 16 LEU QD . . 5.050 4.122 3.055 4.989 . 0 0 "[ . 1 . 2]" 1
8 1 14 PHE QD 1 16 LEU QD . . 4.570 2.882 2.115 3.742 . 0 0 "[ . 1 . 2]" 1
9 1 14 PHE QE 1 16 LEU QD . . 4.650 2.683 1.894 4.584 . 0 0 "[ . 1 . 2]" 1
10 1 15 GLU H 1 15 GLU HB2 . . 3.370 2.574 2.179 3.242 . 0 0 "[ . 1 . 2]" 1
11 1 15 GLU H 1 15 GLU HB3 . . 4.000 3.268 2.875 3.743 . 0 0 "[ . 1 . 2]" 1
12 1 15 GLU H 1 15 GLU QG . . 4.910 3.867 2.822 4.410 . 0 0 "[ . 1 . 2]" 1
13 1 15 GLU H 1 102 LYS QD . . 5.130 3.739 2.597 5.054 . 0 0 "[ . 1 . 2]" 1
14 1 15 GLU HA 1 15 GLU HG2 . . 4.040 3.228 2.326 3.650 . 0 0 "[ . 1 . 2]" 1
15 1 15 GLU HA 1 15 GLU QG . . 3.430 2.402 2.133 2.863 . 0 0 "[ . 1 . 2]" 1
16 1 15 GLU HA 1 15 GLU HG3 . . 4.040 2.586 2.169 3.586 . 0 0 "[ . 1 . 2]" 1
17 1 15 GLU HA 1 16 LEU H . . 3.300 2.419 2.196 2.623 . 0 0 "[ . 1 . 2]" 1
18 1 15 GLU HA 1 16 LEU HA . . 4.540 4.450 4.392 4.532 . 0 0 "[ . 1 . 2]" 1
19 1 15 GLU HA 1 16 LEU MD1 . . 5.500 4.390 2.601 5.173 . 0 0 "[ . 1 . 2]" 1
20 1 15 GLU HA 1 16 LEU QD . . 4.830 3.299 2.455 4.148 . 0 0 "[ . 1 . 2]" 1
21 1 15 GLU HA 1 16 LEU MD2 . . 5.500 3.833 2.477 5.370 . 0 0 "[ . 1 . 2]" 1
22 1 15 GLU HA 1 16 LEU HG . . 5.500 4.348 3.230 5.518 0.018 16 0 "[ . 1 . 2]" 1
23 1 15 GLU HA 1 102 LYS QD . . 5.500 4.923 3.922 5.503 0.003 2 0 "[ . 1 . 2]" 1
24 1 15 GLU HB2 1 102 LYS QE . . 4.470 3.248 1.907 4.473 0.003 8 0 "[ . 1 . 2]" 1
25 1 15 GLU HB3 1 16 LEU H . . 4.120 2.875 2.046 3.433 . 0 0 "[ . 1 . 2]" 1
26 1 15 GLU HB3 1 16 LEU HA . . 4.680 4.258 4.057 4.413 . 0 0 "[ . 1 . 2]" 1
27 1 15 GLU HB3 1 17 VAL MG1 . . 4.650 4.630 4.569 4.663 0.013 11 0 "[ . 1 . 2]" 1
28 1 15 GLU HB3 1 49 GLY QA . . 4.570 4.129 3.628 4.570 . 0 0 "[ . 1 . 2]" 1
29 1 15 GLU HB3 1 102 LYS QE . . 4.540 3.354 2.073 4.541 0.001 2 0 "[ . 1 . 2]" 1
30 1 15 GLU HB3 1 102 LYS HG2 . . 4.620 2.696 2.045 3.963 . 0 0 "[ . 1 . 2]" 1
31 1 15 GLU HB3 1 102 LYS QG . . 3.940 2.185 1.838 2.996 . 0 0 "[ . 1 . 2]" 1
32 1 15 GLU HB3 1 102 LYS HG3 . . 4.620 2.663 1.991 4.382 . 0 0 "[ . 1 . 2]" 1
33 1 15 GLU QG 1 16 LEU H . . 3.890 2.582 1.842 3.903 0.013 2 0 "[ . 1 . 2]" 1
34 1 15 GLU QG 1 49 GLY QA . . 3.820 2.694 1.910 3.687 . 0 0 "[ . 1 . 2]" 1
35 1 16 LEU H 1 16 LEU HB2 . . 3.520 2.659 2.429 2.849 . 0 0 "[ . 1 . 2]" 1
36 1 16 LEU H 1 16 LEU MD1 . . 4.510 3.820 2.215 4.352 . 0 0 "[ . 1 . 2]" 1
37 1 16 LEU H 1 16 LEU QD . . 3.930 2.953 2.201 3.662 . 0 0 "[ . 1 . 2]" 1
38 1 16 LEU H 1 16 LEU MD2 . . 4.510 3.406 2.221 4.409 . 0 0 "[ . 1 . 2]" 1
39 1 16 LEU H 1 16 LEU HG . . 4.470 3.647 2.770 4.460 . 0 0 "[ . 1 . 2]" 1
40 1 16 LEU H 1 17 VAL H . . 4.420 4.126 3.958 4.283 . 0 0 "[ . 1 . 2]" 1
41 1 16 LEU H 1 17 VAL MG2 . . 5.500 5.489 5.375 5.578 0.078 16 0 "[ . 1 . 2]" 1
42 1 16 LEU H 1 48 ASN QB . . 3.680 3.364 3.097 3.578 . 0 0 "[ . 1 . 2]" 1
43 1 16 LEU HA 1 16 LEU MD1 . . 4.150 3.167 2.000 3.965 . 0 0 "[ . 1 . 2]" 1
44 1 16 LEU HA 1 16 LEU QD . . 2.980 2.268 1.975 3.031 0.051 11 0 "[ . 1 . 2]" 1
45 1 16 LEU HA 1 16 LEU MD2 . . 4.150 2.598 1.981 3.622 . 0 0 "[ . 1 . 2]" 1
46 1 16 LEU HA 1 16 LEU HG . . 4.110 3.259 2.424 3.773 . 0 0 "[ . 1 . 2]" 1
47 1 16 LEU HA 1 17 VAL H . . 2.950 2.145 2.139 2.151 . 0 0 "[ . 1 . 2]" 1
48 1 16 LEU HA 1 17 VAL MG1 . . 4.040 4.012 3.897 4.083 0.043 16 0 "[ . 1 . 2]" 1
49 1 16 LEU HA 1 17 VAL MG2 . . 3.850 3.491 3.424 3.562 . 0 0 "[ . 1 . 2]" 1
50 1 16 LEU HB2 1 16 LEU QD . . 3.040 2.190 1.994 2.376 . 0 0 "[ . 1 . 2]" 1
51 1 16 LEU HB2 1 17 VAL H . . 4.440 4.353 4.201 4.441 0.001 5 0 "[ . 1 . 2]" 1
52 1 16 LEU HB2 1 48 ASN HA . . 4.850 4.538 4.164 4.853 0.003 15 0 "[ . 1 . 2]" 1
53 1 16 LEU HB2 1 48 ASN QB . . 3.770 2.148 1.966 2.420 . 0 0 "[ . 1 . 2]" 1
54 1 16 LEU HB2 1 48 ASN HD21 . . 5.050 3.636 3.143 4.182 . 0 0 "[ . 1 . 2]" 1
55 1 16 LEU HB2 1 48 ASN QD . . 4.200 3.514 3.053 3.885 . 0 0 "[ . 1 . 2]" 1
56 1 16 LEU HB2 1 48 ASN HD22 . . 5.050 4.711 4.144 5.055 0.005 17 0 "[ . 1 . 2]" 1
57 1 16 LEU HB3 1 16 LEU MD1 . . 3.630 2.450 2.147 3.154 . 0 0 "[ . 1 . 2]" 1
58 1 16 LEU HB3 1 16 LEU QD . . 3.030 2.118 1.985 2.361 . 0 0 "[ . 1 . 2]" 1
59 1 16 LEU HB3 1 16 LEU MD2 . . 3.630 2.599 2.024 3.192 . 0 0 "[ . 1 . 2]" 1
60 1 16 LEU HB3 1 17 VAL H . . 3.650 3.596 3.486 3.657 0.007 11 0 "[ . 1 . 2]" 1
61 1 16 LEU HB3 1 17 VAL MG2 . . 4.110 3.986 3.882 4.078 . 0 0 "[ . 1 . 2]" 1
62 1 16 LEU HB3 1 48 ASN QB . . 4.250 3.229 2.889 3.551 . 0 0 "[ . 1 . 2]" 1
63 1 16 LEU QD 1 17 VAL H . . 4.850 3.721 3.338 4.440 . 0 0 "[ . 1 . 2]" 1
64 1 16 LEU QD 1 48 ASN QB . . 3.910 3.177 2.652 3.804 . 0 0 "[ . 1 . 2]" 1
65 1 16 LEU QD 1 48 ASN QD . . 4.110 3.994 3.743 4.124 0.014 18 0 "[ . 1 . 2]" 1
66 1 16 LEU MD1 1 48 ASN QB . . 4.680 3.607 2.677 4.672 . 0 0 "[ . 1 . 2]" 1
67 1 16 LEU MD2 1 48 ASN QB . . 4.680 4.100 3.300 4.690 0.010 3 0 "[ . 1 . 2]" 1
68 1 16 LEU HG 1 48 ASN QB . . 4.620 4.143 3.730 4.628 0.008 11 0 "[ . 1 . 2]" 1
69 1 17 VAL H 1 17 VAL HB . . 3.780 3.614 3.598 3.630 . 0 0 "[ . 1 . 2]" 1
70 1 17 VAL H 1 17 VAL MG1 . . 3.300 2.348 2.141 2.516 . 0 0 "[ . 1 . 2]" 1
71 1 17 VAL H 1 17 VAL MG2 . . 2.860 1.961 1.869 2.124 . 0 0 "[ . 1 . 2]" 1
72 1 17 VAL H 1 18 PRO HD2 . . 4.810 4.744 4.723 4.771 . 0 0 "[ . 1 . 2]" 1
73 1 17 VAL HA 1 17 VAL MG1 . . 3.240 2.261 2.158 2.354 . 0 0 "[ . 1 . 2]" 1
74 1 17 VAL HA 1 17 VAL MG2 . . 3.750 3.185 3.171 3.195 . 0 0 "[ . 1 . 2]" 1
75 1 17 VAL HA 1 18 PRO HD2 . . 3.720 2.377 2.297 2.403 . 0 0 "[ . 1 . 2]" 1
76 1 17 VAL HA 1 18 PRO HD3 . . 3.470 2.291 2.268 2.301 . 0 0 "[ . 1 . 2]" 1
77 1 17 VAL HA 1 18 PRO HG2 . . 4.650 4.494 4.429 4.514 . 0 0 "[ . 1 . 2]" 1
78 1 17 VAL HA 1 100 ASN H . . 5.250 4.697 4.238 5.199 . 0 0 "[ . 1 . 2]" 1
79 1 17 VAL HA 1 100 ASN HD21 . . 4.510 3.567 3.272 3.790 . 0 0 "[ . 1 . 2]" 1
80 1 17 VAL HA 1 100 ASN QD . . 3.790 2.376 1.890 3.600 . 0 0 "[ . 1 . 2]" 1
81 1 17 VAL HA 1 100 ASN HD22 . . 4.510 2.573 1.899 4.527 0.017 16 0 "[ . 1 . 2]" 1
82 1 17 VAL HA 1 102 LYS QB . . 3.990 3.333 2.977 3.608 . 0 0 "[ . 1 . 2]" 1
83 1 17 VAL HB 1 18 PRO HD2 . . 3.690 2.037 1.993 2.226 . 0 0 "[ . 1 . 2]" 1
84 1 17 VAL HB 1 18 PRO HD3 . . 3.730 3.484 3.446 3.645 . 0 0 "[ . 1 . 2]" 1
85 1 17 VAL HB 1 19 THR H . . 5.500 5.223 5.034 5.431 . 0 0 "[ . 1 . 2]" 1
86 1 17 VAL HB 1 103 GLY H . . 4.640 4.183 3.941 4.383 . 0 0 "[ . 1 . 2]" 1
87 1 17 VAL MG1 1 18 PRO HD2 . . 3.920 2.923 2.745 3.084 . 0 0 "[ . 1 . 2]" 1
88 1 17 VAL MG1 1 100 ASN H . . 4.550 3.837 3.520 4.179 . 0 0 "[ . 1 . 2]" 1
89 1 17 VAL MG1 1 100 ASN QD . . 5.130 3.466 2.770 4.544 . 0 0 "[ . 1 . 2]" 1
90 1 17 VAL MG1 1 102 LYS H . . 4.280 4.004 3.756 4.178 . 0 0 "[ . 1 . 2]" 1
91 1 17 VAL MG1 1 102 LYS HB2 . . 3.900 2.143 1.869 2.459 . 0 0 "[ . 1 . 2]" 1
92 1 17 VAL MG1 1 102 LYS QB . . 3.280 1.888 1.723 2.067 . 0 0 "[ . 1 . 2]" 1
93 1 17 VAL MG1 1 102 LYS HB3 . . 3.900 2.156 1.937 2.656 . 0 0 "[ . 1 . 2]" 1
94 1 17 VAL MG1 1 102 LYS QE . . 5.340 4.361 2.740 5.327 . 0 0 "[ . 1 . 2]" 1
95 1 17 VAL MG1 1 102 LYS HG2 . . 4.360 3.781 2.958 4.337 . 0 0 "[ . 1 . 2]" 1
96 1 17 VAL MG1 1 102 LYS HG3 . . 4.360 3.375 2.897 4.114 . 0 0 "[ . 1 . 2]" 1
97 1 17 VAL MG1 1 103 GLY H . . 3.690 2.078 1.825 2.328 . 0 0 "[ . 1 . 2]" 1
98 1 17 VAL MG1 1 103 GLY HA2 . . 3.900 3.727 3.459 3.861 . 0 0 "[ . 1 . 2]" 1
99 1 17 VAL MG1 1 103 GLY HA3 . . 3.900 2.666 2.284 2.831 . 0 0 "[ . 1 . 2]" 1
100 1 17 VAL MG1 1 104 MET H . . 3.760 3.677 3.500 3.776 0.016 3 0 "[ . 1 . 2]" 1
101 1 17 VAL MG1 1 105 GLY H . . 5.460 5.385 5.275 5.464 0.004 9 0 "[ . 1 . 2]" 1
102 1 17 VAL MG2 1 18 PRO HD2 . . 3.990 3.664 3.590 3.798 . 0 0 "[ . 1 . 2]" 1
103 1 17 VAL MG2 1 18 PRO HD3 . . 5.050 4.568 4.516 4.638 . 0 0 "[ . 1 . 2]" 1
104 1 17 VAL MG2 1 104 MET H . . 5.180 5.053 4.685 5.188 0.008 11 0 "[ . 1 . 2]" 1
105 1 17 VAL MG2 1 105 GLY HA2 . . 4.750 3.793 3.510 4.001 . 0 0 "[ . 1 . 2]" 1
106 1 17 VAL MG2 1 105 GLY HA3 . . 5.480 4.719 4.469 5.042 . 0 0 "[ . 1 . 2]" 1
107 1 18 PRO HA 1 19 THR H . . 3.220 2.231 2.186 2.281 . 0 0 "[ . 1 . 2]" 1
108 1 18 PRO HA 1 20 SER H . . 3.820 3.311 3.151 3.437 . 0 0 "[ . 1 . 2]" 1
109 1 18 PRO HA 1 48 ASN HD21 . . 3.880 3.002 2.316 3.526 . 0 0 "[ . 1 . 2]" 1
110 1 18 PRO HA 1 48 ASN HD22 . . 3.880 3.708 1.898 3.882 0.002 11 0 "[ . 1 . 2]" 1
111 1 18 PRO HB2 1 19 THR H . . 4.320 4.025 3.914 4.117 . 0 0 "[ . 1 . 2]" 1
112 1 18 PRO HB2 1 19 THR HA . . 5.210 4.775 4.724 4.849 . 0 0 "[ . 1 . 2]" 1
113 1 18 PRO HB2 1 20 SER H . . 3.650 2.949 2.799 3.128 . 0 0 "[ . 1 . 2]" 1
114 1 18 PRO HB2 1 20 SER QB . . 5.340 4.496 4.074 5.200 . 0 0 "[ . 1 . 2]" 1
115 1 18 PRO HB2 1 98 ALA MB . . 3.410 3.251 2.839 3.419 0.009 4 0 "[ . 1 . 2]" 1
116 1 18 PRO HB2 1 105 GLY H . . 5.500 5.216 4.740 5.501 0.001 20 0 "[ . 1 . 2]" 1
117 1 18 PRO HB2 1 105 GLY HA2 . . 5.500 5.208 4.875 5.499 . 0 0 "[ . 1 . 2]" 1
118 1 18 PRO HB2 1 105 GLY HA3 . . 3.990 3.840 3.583 3.991 0.001 3 0 "[ . 1 . 2]" 1
119 1 18 PRO HB3 1 19 THR H . . 4.480 4.358 4.272 4.431 . 0 0 "[ . 1 . 2]" 1
120 1 18 PRO HB3 1 20 SER H . . 4.330 4.160 4.101 4.277 . 0 0 "[ . 1 . 2]" 1
121 1 18 PRO HB3 1 44 PRO QG . . 4.570 3.133 2.578 3.529 . 0 0 "[ . 1 . 2]" 1
122 1 18 PRO HB3 1 47 ALA HA . . 3.900 3.372 2.567 3.855 . 0 0 "[ . 1 . 2]" 1
123 1 18 PRO HB3 1 48 ASN H . . 5.490 4.421 3.661 5.495 0.005 17 0 "[ . 1 . 2]" 1
124 1 18 PRO HB3 1 51 ILE MD . . 4.620 3.216 2.668 3.727 . 0 0 "[ . 1 . 2]" 1
125 1 18 PRO HB3 1 98 ALA MB . . 4.110 3.734 3.349 3.994 . 0 0 "[ . 1 . 2]" 1
126 1 18 PRO HD2 1 100 ASN H . . 4.630 3.693 3.395 3.959 . 0 0 "[ . 1 . 2]" 1
127 1 18 PRO HD2 1 105 GLY H . . 4.540 4.463 4.322 4.563 0.023 19 0 "[ . 1 . 2]" 1
128 1 18 PRO HD2 1 105 GLY HA3 . . 4.770 4.183 3.830 4.535 . 0 0 "[ . 1 . 2]" 1
129 1 18 PRO HD3 1 100 ASN H . . 4.630 3.927 3.538 4.381 . 0 0 "[ . 1 . 2]" 1
130 1 18 PRO HD3 1 100 ASN HD21 . . 4.800 3.043 2.577 3.437 . 0 0 "[ . 1 . 2]" 1
131 1 18 PRO HD3 1 100 ASN QD . . 4.220 2.343 2.019 2.779 . 0 0 "[ . 1 . 2]" 1
132 1 18 PRO HD3 1 100 ASN HD22 . . 4.800 2.452 2.056 2.995 . 0 0 "[ . 1 . 2]" 1
133 1 18 PRO HG2 1 105 GLY H . . 4.940 3.376 3.003 3.586 . 0 0 "[ . 1 . 2]" 1
134 1 18 PRO HG2 1 105 GLY HA3 . . 4.610 2.783 2.287 3.177 . 0 0 "[ . 1 . 2]" 1
135 1 18 PRO HG3 1 47 ALA HA . . 5.500 5.206 4.477 5.510 0.010 16 0 "[ . 1 . 2]" 1
136 1 18 PRO HG3 1 51 ILE MD . . 3.630 2.965 2.521 3.538 . 0 0 "[ . 1 . 2]" 1
137 1 18 PRO HG3 1 98 ALA MB . . 4.000 2.857 2.365 3.427 . 0 0 "[ . 1 . 2]" 1
138 1 18 PRO HG3 1 100 ASN H . . 4.710 4.175 3.534 4.389 . 0 0 "[ . 1 . 2]" 1
139 1 18 PRO HG3 1 100 ASN QD . . 4.830 3.870 2.732 4.591 . 0 0 "[ . 1 . 2]" 1
140 1 19 THR H 1 19 THR MG . . 3.720 2.064 1.881 2.309 . 0 0 "[ . 1 . 2]" 1
141 1 19 THR H 1 20 SER H . . 3.060 2.772 2.551 2.995 . 0 0 "[ . 1 . 2]" 1
142 1 19 THR H 1 46 GLU QB . . 5.340 4.327 3.547 4.971 . 0 0 "[ . 1 . 2]" 1
143 1 19 THR H 1 48 ASN QB . . 4.800 4.564 3.830 4.812 0.012 11 0 "[ . 1 . 2]" 1
144 1 19 THR H 1 48 ASN HD21 . . 3.710 3.033 2.573 3.378 . 0 0 "[ . 1 . 2]" 1
145 1 19 THR H 1 48 ASN HD22 . . 3.710 3.178 1.939 3.712 0.002 13 0 "[ . 1 . 2]" 1
146 1 19 THR HA 1 19 THR MG . . 3.370 2.923 2.432 3.208 . 0 0 "[ . 1 . 2]" 1
147 1 19 THR HA 1 105 GLY HA3 . . 5.500 3.833 3.383 4.340 . 0 0 "[ . 1 . 2]" 1
148 1 19 THR HA 1 106 PRO HD2 . . 4.460 2.979 2.346 3.533 . 0 0 "[ . 1 . 2]" 1
149 1 19 THR HA 1 106 PRO QD . . 3.880 2.078 1.936 2.400 . 0 0 "[ . 1 . 2]" 1
150 1 19 THR HA 1 106 PRO HD3 . . 4.460 2.130 1.996 2.487 . 0 0 "[ . 1 . 2]" 1
151 1 19 THR HA 1 106 PRO QG . . 5.320 3.139 2.638 3.524 . 0 0 "[ . 1 . 2]" 1
152 1 19 THR MG 1 20 SER H . . 4.250 3.695 3.174 4.206 . 0 0 "[ . 1 . 2]" 1
153 1 19 THR MG 1 48 ASN HD21 . . 3.580 3.267 2.818 3.491 . 0 0 "[ . 1 . 2]" 1
154 1 19 THR MG 1 48 ASN HD22 . . 3.580 2.969 1.942 3.560 . 0 0 "[ . 1 . 2]" 1
155 1 19 THR MG 1 106 PRO QD . . 4.840 4.257 3.826 4.710 . 0 0 "[ . 1 . 2]" 1
156 1 20 SER H 1 20 SER HB2 . . 4.190 3.199 2.447 3.887 . 0 0 "[ . 1 . 2]" 1
157 1 20 SER H 1 20 SER HB3 . . 4.190 3.030 2.563 3.773 . 0 0 "[ . 1 . 2]" 1
158 1 20 SER H 1 46 GLU QB . . 4.740 4.259 3.207 4.741 0.001 15 0 "[ . 1 . 2]" 1
159 1 20 SER H 1 48 ASN HD21 . . 5.500 5.369 5.032 5.510 0.010 18 0 "[ . 1 . 2]" 1
160 1 20 SER H 1 48 ASN QD . . 4.800 4.681 3.912 4.806 0.006 16 0 "[ . 1 . 2]" 1
161 1 20 SER H 1 48 ASN HD22 . . 5.500 5.200 4.005 5.502 0.002 3 0 "[ . 1 . 2]" 1
162 1 20 SER H 1 105 GLY HA3 . . 4.700 4.452 4.129 4.700 . 0 0 "[ . 1 . 2]" 1
163 1 20 SER H 1 106 PRO HD2 . . 4.280 3.260 2.957 3.480 . 0 0 "[ . 1 . 2]" 1
164 1 20 SER H 1 106 PRO QD . . 3.680 3.107 2.768 3.308 . 0 0 "[ . 1 . 2]" 1
165 1 20 SER H 1 106 PRO HD3 . . 4.280 3.970 3.161 4.278 . 0 0 "[ . 1 . 2]" 1
166 1 20 SER H 1 106 PRO QG . . 4.350 3.560 2.971 3.933 . 0 0 "[ . 1 . 2]" 1
167 1 20 SER HA 1 21 PRO QD . . 3.130 1.974 1.935 2.009 . 0 0 "[ . 1 . 2]" 1
168 1 20 SER HA 1 21 PRO HG2 . . 4.750 4.339 4.278 4.395 . 0 0 "[ . 1 . 2]" 1
169 1 20 SER HA 1 21 PRO QG . . 4.070 3.875 3.835 3.913 . 0 0 "[ . 1 . 2]" 1
170 1 20 SER HA 1 21 PRO HG3 . . 4.750 4.361 4.333 4.391 . 0 0 "[ . 1 . 2]" 1
171 1 20 SER HA 1 106 PRO HG2 . . 4.260 3.415 3.196 3.661 . 0 0 "[ . 1 . 2]" 1
172 1 20 SER HA 1 106 PRO HG3 . . 4.260 3.154 2.493 3.841 . 0 0 "[ . 1 . 2]" 1
173 1 20 SER QB 1 21 PRO QD . . 3.670 2.883 2.257 3.337 . 0 0 "[ . 1 . 2]" 1
174 1 20 SER QB 1 21 PRO QG . . 5.110 4.354 3.816 4.796 . 0 0 "[ . 1 . 2]" 1
175 1 20 SER QB 1 46 GLU QB . . 4.090 2.704 2.021 3.944 . 0 0 "[ . 1 . 2]" 1
176 1 21 PRO HA 1 22 PRO HD2 . . 4.090 2.469 2.330 2.564 . 0 0 "[ . 1 . 2]" 1
177 1 21 PRO HA 1 22 PRO HD3 . . 4.090 2.337 2.283 2.383 . 0 0 "[ . 1 . 2]" 1
178 1 21 PRO QB 1 22 PRO QD . . 3.580 2.116 1.944 2.366 . 0 0 "[ . 1 . 2]" 1
179 1 21 PRO QB 1 108 SER H . . 4.400 4.087 3.619 4.407 0.007 19 0 "[ . 1 . 2]" 1
180 1 21 PRO QB 1 108 SER HA . . 3.340 2.817 2.301 3.285 . 0 0 "[ . 1 . 2]" 1
181 1 21 PRO QB 1 108 SER QB . . 3.990 2.791 2.254 3.152 . 0 0 "[ . 1 . 2]" 1
182 1 21 PRO HB2 1 108 SER HA . . 3.980 3.488 3.072 3.846 . 0 0 "[ . 1 . 2]" 1
183 1 21 PRO HB3 1 108 SER HA . . 3.980 2.989 2.352 3.565 . 0 0 "[ . 1 . 2]" 1
184 1 21 PRO QD 1 106 PRO QB . . 4.560 3.563 3.000 4.130 . 0 0 "[ . 1 . 2]" 1
185 1 21 PRO QD 1 106 PRO QG . . 3.660 2.607 2.264 2.963 . 0 0 "[ . 1 . 2]" 1
186 1 21 PRO QG 1 108 SER HA . . 4.400 4.027 3.310 4.415 0.015 16 0 "[ . 1 . 2]" 1
187 1 22 PRO HA 1 23 LYS H . . 3.000 2.469 2.287 2.687 . 0 0 "[ . 1 . 2]" 1
188 1 22 PRO HA 1 23 LYS HG2 . . 4.690 4.007 3.683 4.330 . 0 0 "[ . 1 . 2]" 1
189 1 22 PRO HA 1 23 LYS HG3 . . 4.500 3.307 3.077 3.508 . 0 0 "[ . 1 . 2]" 1
190 1 22 PRO HA 1 41 TRP HD1 . . 5.140 4.956 4.598 5.142 0.002 10 0 "[ . 1 . 2]" 1
191 1 22 PRO QB 1 23 LYS H . . 3.640 2.398 1.953 2.807 . 0 0 "[ . 1 . 2]" 1
192 1 22 PRO QB 1 23 LYS HG3 . . 4.740 4.503 4.149 4.695 . 0 0 "[ . 1 . 2]" 1
193 1 22 PRO QB 1 25 VAL MG2 . . 3.940 2.939 2.609 3.142 . 0 0 "[ . 1 . 2]" 1
194 1 22 PRO QB 1 41 TRP HD1 . . 3.590 3.149 2.669 3.450 . 0 0 "[ . 1 . 2]" 1
195 1 22 PRO QB 1 42 GLN H . . 4.060 3.265 2.462 3.693 . 0 0 "[ . 1 . 2]" 1
196 1 22 PRO QB 1 96 ILE HB . . 3.990 3.574 3.315 3.799 . 0 0 "[ . 1 . 2]" 1
197 1 22 PRO HB2 1 25 VAL MG2 . . 4.590 2.990 2.646 3.205 . 0 0 "[ . 1 . 2]" 1
198 1 22 PRO HB2 1 41 TRP HD1 . . 4.390 3.532 3.057 3.902 . 0 0 "[ . 1 . 2]" 1
199 1 22 PRO HB2 1 96 ILE HB . . 4.560 3.850 3.544 4.122 . 0 0 "[ . 1 . 2]" 1
200 1 22 PRO HB2 1 96 ILE MG . . 3.950 3.149 2.636 3.678 . 0 0 "[ . 1 . 2]" 1
201 1 22 PRO HB3 1 25 VAL MG2 . . 4.590 4.342 3.967 4.591 0.001 19 0 "[ . 1 . 2]" 1
202 1 22 PRO HB3 1 41 TRP HD1 . . 4.390 3.544 2.943 3.926 . 0 0 "[ . 1 . 2]" 1
203 1 22 PRO HB3 1 96 ILE HB . . 4.560 4.246 3.866 4.542 . 0 0 "[ . 1 . 2]" 1
204 1 22 PRO HB3 1 96 ILE MG . . 3.950 2.983 2.544 3.438 . 0 0 "[ . 1 . 2]" 1
205 1 22 PRO QD 1 96 ILE MG . . 4.200 3.628 3.286 4.038 . 0 0 "[ . 1 . 2]" 1
206 1 22 PRO QD 1 98 ALA H . . 4.210 3.360 2.896 3.771 . 0 0 "[ . 1 . 2]" 1
207 1 22 PRO QD 1 98 ALA MB . . 5.350 3.694 3.427 4.067 . 0 0 "[ . 1 . 2]" 1
208 1 22 PRO QD 1 108 SER H . . 4.290 3.629 3.240 4.018 . 0 0 "[ . 1 . 2]" 1
209 1 22 PRO QD 1 108 SER QB . . 4.160 2.174 1.957 2.665 . 0 0 "[ . 1 . 2]" 1
210 1 22 PRO HD2 1 96 ILE MG . . 4.830 4.465 4.015 4.831 0.001 5 0 "[ . 1 . 2]" 1
211 1 22 PRO HD3 1 96 ILE MG . . 4.830 3.841 3.487 4.332 . 0 0 "[ . 1 . 2]" 1
212 1 22 PRO HG2 1 25 VAL MG2 . . 4.640 2.671 2.360 2.952 . 0 0 "[ . 1 . 2]" 1
213 1 22 PRO HG2 1 96 ILE HB . . 4.780 2.757 2.393 3.195 . 0 0 "[ . 1 . 2]" 1
214 1 22 PRO HG2 1 96 ILE MG . . 4.390 3.335 2.964 3.606 . 0 0 "[ . 1 . 2]" 1
215 1 22 PRO HG3 1 25 VAL MG2 . . 4.450 3.759 3.317 4.084 . 0 0 "[ . 1 . 2]" 1
216 1 22 PRO HG3 1 41 TRP HD1 . . 5.500 4.959 4.050 5.503 0.003 2 0 "[ . 1 . 2]" 1
217 1 22 PRO HG3 1 96 ILE HB . . 4.330 2.366 2.001 2.752 . 0 0 "[ . 1 . 2]" 1
218 1 22 PRO HG3 1 96 ILE MG . . 3.580 2.173 1.889 2.593 . 0 0 "[ . 1 . 2]" 1
219 1 22 PRO HG3 1 97 GLN H . . 4.630 3.901 3.251 4.398 . 0 0 "[ . 1 . 2]" 1
220 1 22 PRO HG3 1 98 ALA H . . 4.770 4.537 4.047 4.779 0.009 19 0 "[ . 1 . 2]" 1
221 1 23 LYS H 1 23 LYS HB2 . . 4.100 2.941 2.789 3.134 . 0 0 "[ . 1 . 2]" 1
222 1 23 LYS H 1 23 LYS QB . . 3.430 2.854 2.721 3.020 . 0 0 "[ . 1 . 2]" 1
223 1 23 LYS H 1 23 LYS HB3 . . 4.100 3.865 3.765 3.972 . 0 0 "[ . 1 . 2]" 1
224 1 23 LYS H 1 23 LYS HG2 . . 3.650 3.490 3.216 3.619 . 0 0 "[ . 1 . 2]" 1
225 1 23 LYS H 1 23 LYS HG3 . . 3.360 2.670 2.340 2.981 . 0 0 "[ . 1 . 2]" 1
226 1 23 LYS H 1 24 ASP H . . 4.850 4.415 4.378 4.476 . 0 0 "[ . 1 . 2]" 1
227 1 23 LYS H 1 25 VAL MG2 . . 4.610 3.831 3.403 4.128 . 0 0 "[ . 1 . 2]" 1
228 1 23 LYS H 1 41 TRP HB2 . . 4.440 3.980 3.335 4.441 0.001 17 0 "[ . 1 . 2]" 1
229 1 23 LYS H 1 41 TRP HD1 . . 4.710 4.333 3.843 4.653 . 0 0 "[ . 1 . 2]" 1
230 1 23 LYS H 1 42 GLN H . . 3.800 2.938 2.519 3.291 . 0 0 "[ . 1 . 2]" 1
231 1 23 LYS H 1 43 PRO HA . . 4.840 4.359 4.170 4.618 . 0 0 "[ . 1 . 2]" 1
232 1 23 LYS HA 1 23 LYS HG2 . . 3.870 2.742 2.581 2.872 . 0 0 "[ . 1 . 2]" 1
233 1 23 LYS HA 1 23 LYS HG3 . . 4.130 3.457 3.322 3.567 . 0 0 "[ . 1 . 2]" 1
234 1 23 LYS HA 1 24 ASP H . . 3.150 2.567 2.459 2.640 . 0 0 "[ . 1 . 2]" 1
235 1 23 LYS HA 1 24 ASP HA . . 4.720 4.593 4.533 4.657 . 0 0 "[ . 1 . 2]" 1
236 1 23 LYS QB 1 23 LYS QE . . 3.580 2.289 1.970 2.992 . 0 0 "[ . 1 . 2]" 1
237 1 23 LYS QB 1 24 ASP HA . . 4.320 4.092 3.998 4.206 . 0 0 "[ . 1 . 2]" 1
238 1 23 LYS QB 1 24 ASP QB . . 3.930 3.241 3.090 3.636 . 0 0 "[ . 1 . 2]" 1
239 1 23 LYS QB 1 42 GLN QB . . 3.820 2.838 2.378 3.441 . 0 0 "[ . 1 . 2]" 1
240 1 23 LYS HB2 1 24 ASP H . . 3.620 2.965 2.818 3.171 . 0 0 "[ . 1 . 2]" 1
241 1 23 LYS HB2 1 24 ASP HA . . 4.990 4.732 4.582 4.900 . 0 0 "[ . 1 . 2]" 1
242 1 23 LYS HB3 1 24 ASP H . . 3.620 2.301 2.144 2.521 . 0 0 "[ . 1 . 2]" 1
243 1 23 LYS HB3 1 24 ASP HA . . 4.990 4.484 4.351 4.679 . 0 0 "[ . 1 . 2]" 1
244 1 23 LYS QD 1 24 ASP H . . 4.770 4.535 4.179 4.744 . 0 0 "[ . 1 . 2]" 1
245 1 23 LYS QD 1 44 PRO HA . . 4.320 2.892 2.279 3.688 . 0 0 "[ . 1 . 2]" 1
246 1 23 LYS QD 1 45 SER H . . 4.560 2.635 2.067 3.366 . 0 0 "[ . 1 . 2]" 1
247 1 23 LYS QD 1 45 SER HA . . 4.970 4.533 3.979 4.970 0.000 13 0 "[ . 1 . 2]" 1
248 1 23 LYS QD 1 45 SER QB . . 3.920 3.275 2.844 3.709 . 0 0 "[ . 1 . 2]" 1
249 1 23 LYS QE 1 23 LYS HG2 . . 3.700 2.668 2.120 3.407 . 0 0 "[ . 1 . 2]" 1
250 1 23 LYS QE 1 24 ASP H . . 4.780 4.419 3.769 4.780 0.000 17 0 "[ . 1 . 2]" 1
251 1 23 LYS QE 1 45 SER QB . . 4.270 3.873 2.828 4.249 . 0 0 "[ . 1 . 2]" 1
252 1 23 LYS HG2 1 24 ASP H . . 4.600 4.452 4.309 4.598 . 0 0 "[ . 1 . 2]" 1
253 1 23 LYS HG3 1 24 ASP H . . 5.180 4.829 4.746 4.963 . 0 0 "[ . 1 . 2]" 1
254 1 23 LYS HG3 1 43 PRO HA . . 5.500 5.067 4.717 5.381 . 0 0 "[ . 1 . 2]" 1
255 1 23 LYS HG3 1 44 PRO HA . . 4.100 2.495 2.145 2.969 . 0 0 "[ . 1 . 2]" 1
256 1 24 ASP H 1 24 ASP HA . . 2.930 2.283 2.274 2.300 . 0 0 "[ . 1 . 2]" 1
257 1 24 ASP H 1 24 ASP HB2 . . 4.210 3.142 2.882 3.517 . 0 0 "[ . 1 . 2]" 1
258 1 24 ASP H 1 24 ASP HB3 . . 4.210 3.887 3.685 4.096 . 0 0 "[ . 1 . 2]" 1
259 1 24 ASP H 1 25 VAL H . . 3.370 2.834 2.661 3.081 . 0 0 "[ . 1 . 2]" 1
260 1 24 ASP H 1 25 VAL MG2 . . 4.640 4.083 3.916 4.336 . 0 0 "[ . 1 . 2]" 1
261 1 24 ASP HA 1 25 VAL H . . 3.140 2.798 2.627 2.953 . 0 0 "[ . 1 . 2]" 1
262 1 24 ASP HA 1 25 VAL MG2 . . 4.720 4.654 4.415 4.721 0.001 19 0 "[ . 1 . 2]" 1
263 1 24 ASP QB 1 42 GLN H . . 4.520 3.092 2.574 3.699 . 0 0 "[ . 1 . 2]" 1
264 1 24 ASP QB 1 42 GLN QB . . 3.640 2.174 1.973 2.525 . 0 0 "[ . 1 . 2]" 1
265 1 24 ASP HB2 1 25 VAL H . . 4.590 4.422 4.175 4.595 0.005 5 0 "[ . 1 . 2]" 1
266 1 24 ASP HB3 1 25 VAL H . . 4.590 4.274 4.064 4.482 . 0 0 "[ . 1 . 2]" 1
267 1 25 VAL H 1 25 VAL HB . . 3.020 2.437 2.341 2.517 . 0 0 "[ . 1 . 2]" 1
268 1 25 VAL H 1 25 VAL MG1 . . 3.960 3.748 3.698 3.783 . 0 0 "[ . 1 . 2]" 1
269 1 25 VAL H 1 25 VAL MG2 . . 2.920 2.405 2.177 2.744 . 0 0 "[ . 1 . 2]" 1
270 1 25 VAL H 1 26 THR H . . 4.540 4.393 4.332 4.535 . 0 0 "[ . 1 . 2]" 1
271 1 25 VAL H 1 26 THR MG . . 4.340 4.203 3.965 4.321 . 0 0 "[ . 1 . 2]" 1
272 1 25 VAL HA 1 25 VAL MG1 . . 3.320 2.417 2.353 2.495 . 0 0 "[ . 1 . 2]" 1
273 1 25 VAL HA 1 25 VAL MG2 . . 3.370 2.283 2.142 2.362 . 0 0 "[ . 1 . 2]" 1
274 1 25 VAL HA 1 26 THR H . . 2.890 2.151 2.140 2.169 . 0 0 "[ . 1 . 2]" 1
275 1 25 VAL HA 1 41 TRP HB3 . . 4.610 2.908 2.504 3.249 . 0 0 "[ . 1 . 2]" 1
276 1 25 VAL HA 1 42 GLN H . . 4.760 4.430 4.120 4.768 0.008 19 0 "[ . 1 . 2]" 1
277 1 25 VAL HB 1 26 THR H . . 4.600 4.391 4.222 4.466 . 0 0 "[ . 1 . 2]" 1
278 1 25 VAL HB 1 111 VAL QG . . 3.770 3.581 3.271 3.749 . 0 0 "[ . 1 . 2]" 1
279 1 25 VAL MG1 1 26 THR H . . 3.510 2.888 2.345 3.139 . 0 0 "[ . 1 . 2]" 1
280 1 25 VAL MG1 1 27 VAL MG2 . . 3.440 3.045 2.837 3.232 . 0 0 "[ . 1 . 2]" 1
281 1 25 VAL MG1 1 39 VAL MG2 . . 5.160 4.844 4.571 5.164 0.004 2 0 "[ . 1 . 2]" 1
282 1 25 VAL MG1 1 41 TRP HB2 . . 4.900 4.480 3.831 4.854 . 0 0 "[ . 1 . 2]" 1
283 1 25 VAL MG1 1 41 TRP HB3 . . 4.440 3.816 3.129 4.117 . 0 0 "[ . 1 . 2]" 1
284 1 25 VAL MG1 1 96 ILE MD . . 3.180 1.965 1.818 2.383 . 0 0 "[ . 1 . 2]" 1
285 1 25 VAL MG1 1 111 VAL H . . 5.500 4.975 4.652 5.281 . 0 0 "[ . 1 . 2]" 1
286 1 25 VAL MG1 1 111 VAL HB . . 4.230 3.830 3.469 4.009 . 0 0 "[ . 1 . 2]" 1
287 1 25 VAL MG1 1 111 VAL QG . . 2.990 1.930 1.795 2.127 . 0 0 "[ . 1 . 2]" 1
288 1 25 VAL MG2 1 26 THR H . . 4.360 4.057 3.894 4.153 . 0 0 "[ . 1 . 2]" 1
289 1 25 VAL MG2 1 41 TRP HA . . 4.160 3.760 3.042 4.097 . 0 0 "[ . 1 . 2]" 1
290 1 25 VAL MG2 1 41 TRP HB2 . . 3.820 2.861 2.377 3.183 . 0 0 "[ . 1 . 2]" 1
291 1 25 VAL MG2 1 41 TRP HB3 . . 3.710 3.209 2.539 3.658 . 0 0 "[ . 1 . 2]" 1
292 1 25 VAL MG2 1 42 GLN H . . 4.280 3.853 3.463 4.248 . 0 0 "[ . 1 . 2]" 1
293 1 25 VAL MG2 1 96 ILE H . . 4.440 4.290 3.937 4.442 0.002 4 0 "[ . 1 . 2]" 1
294 1 25 VAL MG2 1 96 ILE MD . . 3.280 2.086 1.787 2.571 . 0 0 "[ . 1 . 2]" 1
295 1 25 VAL MG2 1 96 ILE MG . . 3.730 3.611 3.359 3.730 0.000 19 0 "[ . 1 . 2]" 1
296 1 25 VAL MG2 1 108 SER HB2 . . 4.450 3.593 3.175 4.134 . 0 0 "[ . 1 . 2]" 1
297 1 25 VAL MG2 1 108 SER QB . . 3.870 3.293 2.866 3.789 . 0 0 "[ . 1 . 2]" 1
298 1 25 VAL MG2 1 108 SER HB3 . . 4.450 3.841 3.244 4.401 . 0 0 "[ . 1 . 2]" 1
299 1 25 VAL MG2 1 108 SER HG . . 4.300 3.713 3.033 4.239 . 0 0 "[ . 1 . 2]" 1
300 1 26 THR H 1 26 THR HB . . 3.920 3.803 3.732 3.856 . 0 0 "[ . 1 . 2]" 1
301 1 26 THR H 1 26 THR MG . . 3.830 3.187 3.041 3.377 . 0 0 "[ . 1 . 2]" 1
302 1 26 THR H 1 27 VAL H . . 4.590 4.399 4.324 4.468 . 0 0 "[ . 1 . 2]" 1
303 1 26 THR H 1 27 VAL MG2 . . 4.930 3.945 3.752 4.113 . 0 0 "[ . 1 . 2]" 1
304 1 26 THR H 1 40 ASN H . . 3.800 3.545 3.294 3.805 0.005 10 0 "[ . 1 . 2]" 1
305 1 26 THR H 1 40 ASN HB2 . . 4.470 3.813 3.342 4.250 . 0 0 "[ . 1 . 2]" 1
306 1 26 THR H 1 41 TRP HA . . 4.030 3.537 3.178 3.943 . 0 0 "[ . 1 . 2]" 1
307 1 26 THR H 1 41 TRP HB2 . . 5.380 4.829 4.476 5.234 . 0 0 "[ . 1 . 2]" 1
308 1 26 THR H 1 41 TRP HB3 . . 4.580 3.759 3.455 4.166 . 0 0 "[ . 1 . 2]" 1
309 1 26 THR HA 1 26 THR MG . . 3.040 2.240 2.149 2.346 . 0 0 "[ . 1 . 2]" 1
310 1 26 THR HA 1 27 VAL H . . 2.760 2.245 2.203 2.300 . 0 0 "[ . 1 . 2]" 1
311 1 26 THR HA 1 27 VAL HB . . 4.800 4.599 4.419 4.717 . 0 0 "[ . 1 . 2]" 1
312 1 26 THR HA 1 27 VAL MG2 . . 3.990 3.427 3.214 3.733 . 0 0 "[ . 1 . 2]" 1
313 1 26 THR HB 1 27 VAL H . . 3.330 2.835 2.654 3.009 . 0 0 "[ . 1 . 2]" 1
314 1 26 THR HB 1 27 VAL MG2 . . 4.880 4.718 4.564 4.830 . 0 0 "[ . 1 . 2]" 1
315 1 26 THR HB 1 28 VAL MG1 . . 4.060 3.249 3.115 3.389 . 0 0 "[ . 1 . 2]" 1
316 1 26 THR HB 1 28 VAL MG2 . . 4.950 4.737 4.483 4.955 0.005 16 0 "[ . 1 . 2]" 1
317 1 26 THR HB 1 40 ASN HB2 . . 4.420 4.181 3.906 4.410 . 0 0 "[ . 1 . 2]" 1
318 1 26 THR MG 1 27 VAL H . . 3.670 3.639 3.550 3.670 0.000 15 0 "[ . 1 . 2]" 1
319 1 26 THR MG 1 40 ASN HB2 . . 4.180 4.141 4.045 4.182 0.002 20 0 "[ . 1 . 2]" 1
320 1 27 VAL H 1 27 VAL HB . . 3.460 2.759 2.674 2.830 . 0 0 "[ . 1 . 2]" 1
321 1 27 VAL H 1 27 VAL MG1 . . 4.220 3.898 3.826 3.930 . 0 0 "[ . 1 . 2]" 1
322 1 27 VAL H 1 27 VAL MG2 . . 3.550 2.811 2.618 3.087 . 0 0 "[ . 1 . 2]" 1
323 1 27 VAL H 1 28 VAL MG1 . . 4.240 3.769 3.546 3.955 . 0 0 "[ . 1 . 2]" 1
324 1 27 VAL HA 1 27 VAL MG1 . . 3.360 2.328 2.232 2.453 . 0 0 "[ . 1 . 2]" 1
325 1 27 VAL HA 1 27 VAL MG2 . . 3.410 2.402 2.306 2.538 . 0 0 "[ . 1 . 2]" 1
326 1 27 VAL HA 1 28 VAL H . . 2.880 2.153 2.141 2.168 . 0 0 "[ . 1 . 2]" 1
327 1 27 VAL HA 1 28 VAL MG1 . . 4.810 3.917 3.717 4.134 . 0 0 "[ . 1 . 2]" 1
328 1 27 VAL HA 1 28 VAL MG2 . . 4.210 3.877 3.707 4.000 . 0 0 "[ . 1 . 2]" 1
329 1 27 VAL HA 1 39 VAL MG1 . . 4.170 3.456 3.029 3.934 . 0 0 "[ . 1 . 2]" 1
330 1 27 VAL HA 1 39 VAL MG2 . . 4.300 2.946 2.368 3.274 . 0 0 "[ . 1 . 2]" 1
331 1 27 VAL HA 1 40 ASN H . . 3.960 3.394 3.045 3.804 . 0 0 "[ . 1 . 2]" 1
332 1 27 VAL HB 1 111 VAL QG . . 4.210 3.225 2.903 3.580 . 0 0 "[ . 1 . 2]" 1
333 1 27 VAL HB 1 113 PHE HB2 . . 4.280 2.835 2.447 3.120 . 0 0 "[ . 1 . 2]" 1
334 1 27 VAL HB 1 113 PHE QB . . 3.640 2.765 2.398 3.045 . 0 0 "[ . 1 . 2]" 1
335 1 27 VAL HB 1 113 PHE HB3 . . 4.280 3.841 3.442 4.253 . 0 0 "[ . 1 . 2]" 1
336 1 27 VAL HB 1 113 PHE QD . . 3.990 2.953 2.517 3.414 . 0 0 "[ . 1 . 2]" 1
337 1 27 VAL HB 1 113 PHE QE . . 5.270 4.256 3.846 4.668 . 0 0 "[ . 1 . 2]" 1
338 1 27 VAL MG1 1 28 VAL H . . 3.420 2.910 2.631 3.132 . 0 0 "[ . 1 . 2]" 1
339 1 27 VAL MG1 1 28 VAL HA . . 4.520 3.853 3.703 4.071 . 0 0 "[ . 1 . 2]" 1
340 1 27 VAL MG1 1 28 VAL MG1 . . 4.660 4.506 4.319 4.638 . 0 0 "[ . 1 . 2]" 1
341 1 27 VAL MG1 1 28 VAL MG2 . . 4.400 4.193 4.021 4.386 . 0 0 "[ . 1 . 2]" 1
342 1 27 VAL MG1 1 37 ILE HB . . 3.640 3.090 2.915 3.251 . 0 0 "[ . 1 . 2]" 1
343 1 27 VAL MG1 1 37 ILE MD . . 3.150 2.205 2.003 2.384 . 0 0 "[ . 1 . 2]" 1
344 1 27 VAL MG1 1 37 ILE HG12 . . 4.700 4.642 4.449 4.707 0.007 13 0 "[ . 1 . 2]" 1
345 1 27 VAL MG1 1 37 ILE HG13 . . 4.280 4.160 3.954 4.284 0.004 6 0 "[ . 1 . 2]" 1
346 1 27 VAL MG1 1 37 ILE MG . . 3.770 3.654 3.502 3.741 . 0 0 "[ . 1 . 2]" 1
347 1 27 VAL MG1 1 38 ILE H . . 4.290 4.054 3.894 4.285 . 0 0 "[ . 1 . 2]" 1
348 1 27 VAL MG1 1 39 VAL MG1 . . 4.200 3.630 3.349 3.932 . 0 0 "[ . 1 . 2]" 1
349 1 27 VAL MG1 1 39 VAL MG2 . . 3.570 2.176 1.976 2.489 . 0 0 "[ . 1 . 2]" 1
350 1 27 VAL MG1 1 94 PHE QE . . 4.260 3.107 2.644 3.329 . 0 0 "[ . 1 . 2]" 1
351 1 27 VAL MG1 1 94 PHE HZ . . 4.770 4.075 3.737 4.412 . 0 0 "[ . 1 . 2]" 1
352 1 27 VAL MG1 1 111 VAL QG . . 4.340 3.664 3.325 3.964 . 0 0 "[ . 1 . 2]" 1
353 1 27 VAL MG1 1 113 PHE HB2 . . 4.010 2.954 2.696 3.164 . 0 0 "[ . 1 . 2]" 1
354 1 27 VAL MG1 1 113 PHE HB3 . . 4.010 2.824 2.499 3.200 . 0 0 "[ . 1 . 2]" 1
355 1 27 VAL MG1 1 113 PHE QD . . 3.710 2.810 2.584 3.037 . 0 0 "[ . 1 . 2]" 1
356 1 27 VAL MG1 1 113 PHE QE . . 4.350 3.334 3.134 3.605 . 0 0 "[ . 1 . 2]" 1
357 1 27 VAL MG2 1 28 VAL H . . 4.600 4.183 4.107 4.234 . 0 0 "[ . 1 . 2]" 1
358 1 27 VAL MG2 1 39 VAL HB . . 4.780 4.345 4.080 4.707 . 0 0 "[ . 1 . 2]" 1
359 1 27 VAL MG2 1 39 VAL MG1 . . 3.220 2.274 1.949 2.660 . 0 0 "[ . 1 . 2]" 1
360 1 27 VAL MG2 1 39 VAL MG2 . . 3.000 2.212 1.900 2.714 . 0 0 "[ . 1 . 2]" 1
361 1 27 VAL MG2 1 40 ASN H . . 4.640 4.147 3.841 4.464 . 0 0 "[ . 1 . 2]" 1
362 1 27 VAL MG2 1 94 PHE H . . 5.370 4.532 4.228 5.155 . 0 0 "[ . 1 . 2]" 1
363 1 27 VAL MG2 1 94 PHE HB2 . . 4.830 2.984 2.646 3.383 . 0 0 "[ . 1 . 2]" 1
364 1 27 VAL MG2 1 94 PHE HB3 . . 4.860 3.945 3.557 4.387 . 0 0 "[ . 1 . 2]" 1
365 1 27 VAL MG2 1 94 PHE QD . . 3.800 3.061 2.639 3.418 . 0 0 "[ . 1 . 2]" 1
366 1 27 VAL MG2 1 94 PHE QE . . 4.280 4.191 3.978 4.284 0.004 16 0 "[ . 1 . 2]" 1
367 1 27 VAL MG2 1 111 VAL HB . . 4.190 3.192 2.707 3.537 . 0 0 "[ . 1 . 2]" 1
368 1 27 VAL MG2 1 111 VAL QG . . 3.200 2.070 1.827 2.374 . 0 0 "[ . 1 . 2]" 1
369 1 27 VAL MG2 1 113 PHE HB2 . . 4.070 3.378 3.163 3.639 . 0 0 "[ . 1 . 2]" 1
370 1 27 VAL MG2 1 113 PHE QB . . 3.550 3.147 2.910 3.380 . 0 0 "[ . 1 . 2]" 1
371 1 27 VAL MG2 1 113 PHE HB3 . . 4.070 3.768 3.401 4.070 . 0 0 "[ . 1 . 2]" 1
372 1 28 VAL H 1 28 VAL HB . . 4.200 3.746 3.689 3.797 . 0 0 "[ . 1 . 2]" 1
373 1 28 VAL H 1 28 VAL MG1 . . 3.710 2.795 2.649 2.958 . 0 0 "[ . 1 . 2]" 1
374 1 28 VAL H 1 28 VAL MG2 . . 3.300 2.188 1.924 2.310 . 0 0 "[ . 1 . 2]" 1
375 1 28 VAL H 1 29 SER H . . 4.720 4.485 4.452 4.524 . 0 0 "[ . 1 . 2]" 1
376 1 28 VAL H 1 37 ILE HB . . 4.560 4.412 4.112 4.562 0.002 1 0 "[ . 1 . 2]" 1
377 1 28 VAL H 1 37 ILE MD . . 5.140 4.693 4.502 4.970 . 0 0 "[ . 1 . 2]" 1
378 1 28 VAL H 1 38 ILE H . . 3.730 3.532 3.177 3.731 0.001 10 0 "[ . 1 . 2]" 1
379 1 28 VAL H 1 38 ILE HB . . 4.210 3.836 3.571 4.097 . 0 0 "[ . 1 . 2]" 1
380 1 28 VAL H 1 40 ASN H . . 5.050 4.098 3.667 4.545 . 0 0 "[ . 1 . 2]" 1
381 1 28 VAL HA 1 28 VAL MG1 . . 3.190 2.314 2.224 2.449 . 0 0 "[ . 1 . 2]" 1
382 1 28 VAL HA 1 28 VAL MG2 . . 3.600 3.191 3.182 3.198 . 0 0 "[ . 1 . 2]" 1
383 1 28 VAL HA 1 29 SER H . . 2.870 2.493 2.403 2.613 . 0 0 "[ . 1 . 2]" 1
384 1 28 VAL HA 1 113 PHE QD . . 4.870 4.737 4.337 4.872 0.002 10 0 "[ . 1 . 2]" 1
385 1 28 VAL HA 1 113 PHE QE . . 4.000 3.206 2.907 3.597 . 0 0 "[ . 1 . 2]" 1
386 1 28 VAL HA 1 113 PHE HZ . . 4.370 3.967 3.440 4.369 . 0 0 "[ . 1 . 2]" 1
387 1 28 VAL HB 1 29 SER H . . 3.120 2.202 1.950 2.375 . 0 0 "[ . 1 . 2]" 1
388 1 28 VAL HB 1 38 ILE HB . . 4.820 4.576 4.268 4.822 0.002 7 0 "[ . 1 . 2]" 1
389 1 28 VAL MG1 1 29 SER H . . 3.790 3.612 3.431 3.746 . 0 0 "[ . 1 . 2]" 1
390 1 28 VAL MG1 1 38 ILE H . . 5.250 5.085 4.908 5.255 0.005 17 0 "[ . 1 . 2]" 1
391 1 28 VAL MG1 1 38 ILE HB . . 4.600 4.461 4.182 4.600 0.000 20 0 "[ . 1 . 2]" 1
392 1 28 VAL MG1 1 40 ASN H . . 5.020 4.699 4.150 5.019 . 0 0 "[ . 1 . 2]" 1
393 1 28 VAL MG1 1 40 ASN QD . . 4.260 3.489 2.930 4.227 . 0 0 "[ . 1 . 2]" 1
394 1 28 VAL MG2 1 29 SER H . . 3.720 3.269 2.968 3.602 . 0 0 "[ . 1 . 2]" 1
395 1 28 VAL MG2 1 29 SER HA . . 4.510 3.908 3.617 4.344 . 0 0 "[ . 1 . 2]" 1
396 1 28 VAL MG2 1 38 ILE H . . 3.880 2.599 2.297 2.927 . 0 0 "[ . 1 . 2]" 1
397 1 28 VAL MG2 1 38 ILE HB . . 3.060 2.008 1.865 2.105 . 0 0 "[ . 1 . 2]" 1
398 1 28 VAL MG2 1 40 ASN HD21 . . 4.270 3.586 2.835 4.273 0.003 9 0 "[ . 1 . 2]" 1
399 1 28 VAL MG2 1 40 ASN HD22 . . 4.270 2.742 2.014 3.150 . 0 0 "[ . 1 . 2]" 1
400 1 28 VAL MG2 1 113 PHE QE . . 5.500 5.427 5.256 5.514 0.014 16 0 "[ . 1 . 2]" 1
401 1 29 SER H 1 29 SER HB2 . . 3.820 3.267 2.425 3.754 . 0 0 "[ . 1 . 2]" 1
402 1 29 SER H 1 29 SER QB . . 3.000 2.609 2.323 2.988 . 0 0 "[ . 1 . 2]" 1
403 1 29 SER H 1 29 SER HB3 . . 3.820 2.992 2.398 3.679 . 0 0 "[ . 1 . 2]" 1
404 1 29 SER H 1 29 SER HG . . 4.760 3.246 2.059 4.634 . 0 0 "[ . 1 . 2]" 1
405 1 29 SER H 1 30 LYS H . . 4.660 4.507 4.389 4.576 . 0 0 "[ . 1 . 2]" 1
406 1 29 SER H 1 113 PHE QE . . 4.590 4.287 3.988 4.571 . 0 0 "[ . 1 . 2]" 1
407 1 29 SER H 1 113 PHE HZ . . 4.320 3.897 3.328 4.324 0.004 17 0 "[ . 1 . 2]" 1
408 1 29 SER HA 1 30 LYS H . . 3.110 2.325 2.156 2.488 . 0 0 "[ . 1 . 2]" 1
409 1 29 SER HA 1 37 ILE HB . . 4.580 2.985 2.686 3.188 . 0 0 "[ . 1 . 2]" 1
410 1 29 SER HA 1 37 ILE MG . . 3.820 2.372 2.061 2.630 . 0 0 "[ . 1 . 2]" 1
411 1 29 SER HA 1 38 ILE H . . 3.910 3.109 2.865 3.365 . 0 0 "[ . 1 . 2]" 1
412 1 29 SER QB 1 30 LYS H . . 3.520 2.819 2.282 3.539 0.019 8 0 "[ . 1 . 2]" 1
413 1 29 SER QB 1 37 ILE MG . . 5.000 2.939 2.519 3.508 . 0 0 "[ . 1 . 2]" 1
414 1 29 SER QB 1 113 PHE QE . . 4.320 3.568 2.775 4.289 . 0 0 "[ . 1 . 2]" 1
415 1 29 SER QB 1 116 PRO HG3 . . 3.820 2.401 1.945 3.215 . 0 0 "[ . 1 . 2]" 1
416 1 29 SER HB2 1 30 LYS H . . 4.130 3.240 2.302 4.167 0.037 13 0 "[ . 1 . 2]" 1
417 1 29 SER HB2 1 113 PHE QE . . 5.050 4.345 2.823 5.046 . 0 0 "[ . 1 . 2]" 1
418 1 29 SER HB2 1 113 PHE HZ . . 4.190 3.376 2.119 4.162 . 0 0 "[ . 1 . 2]" 1
419 1 29 SER HB2 1 116 PRO HG3 . . 4.380 2.751 2.024 3.741 . 0 0 "[ . 1 . 2]" 1
420 1 29 SER HB3 1 30 LYS H . . 4.130 3.608 2.342 4.133 0.003 4 0 "[ . 1 . 2]" 1
421 1 29 SER HB3 1 113 PHE QE . . 5.050 4.044 2.894 4.981 . 0 0 "[ . 1 . 2]" 1
422 1 29 SER HB3 1 113 PHE HZ . . 4.190 3.076 2.052 4.219 0.029 7 0 "[ . 1 . 2]" 1
423 1 29 SER HB3 1 116 PRO HG3 . . 4.380 3.029 2.177 4.043 . 0 0 "[ . 1 . 2]" 1
424 1 29 SER HG 1 30 LYS H . . 4.890 3.704 2.250 4.350 . 0 0 "[ . 1 . 2]" 1
425 1 30 LYS H 1 30 LYS HB2 . . 3.500 2.662 2.271 2.974 . 0 0 "[ . 1 . 2]" 1
426 1 30 LYS H 1 30 LYS HB3 . . 3.500 2.548 2.336 2.802 . 0 0 "[ . 1 . 2]" 1
427 1 30 LYS H 1 30 LYS HD2 . . 5.500 4.924 4.336 5.618 0.118 13 0 "[ . 1 . 2]" 1
428 1 30 LYS H 1 30 LYS HD3 . . 5.500 4.964 4.168 5.445 . 0 0 "[ . 1 . 2]" 1
429 1 30 LYS H 1 30 LYS HG2 . . 5.410 4.547 4.282 4.644 . 0 0 "[ . 1 . 2]" 1
430 1 30 LYS H 1 30 LYS QG . . 4.660 4.002 3.897 4.047 . 0 0 "[ . 1 . 2]" 1
431 1 30 LYS H 1 30 LYS HG3 . . 5.410 4.448 4.305 4.549 . 0 0 "[ . 1 . 2]" 1
432 1 30 LYS H 1 31 GLU H . . 5.220 4.570 4.307 4.646 . 0 0 "[ . 1 . 2]" 1
433 1 30 LYS H 1 36 THR H . . 4.900 4.692 4.230 4.911 0.011 13 0 "[ . 1 . 2]" 1
434 1 30 LYS H 1 36 THR HB . . 4.750 4.132 3.747 4.702 . 0 0 "[ . 1 . 2]" 1
435 1 30 LYS H 1 36 THR MG . . 4.550 3.947 2.931 4.479 . 0 0 "[ . 1 . 2]" 1
436 1 30 LYS H 1 37 ILE H . . 5.500 4.700 4.367 5.242 . 0 0 "[ . 1 . 2]" 1
437 1 30 LYS H 1 37 ILE MG . . 4.440 3.113 2.591 3.424 . 0 0 "[ . 1 . 2]" 1
438 1 30 LYS H 1 38 ILE H . . 4.730 4.220 3.760 4.576 . 0 0 "[ . 1 . 2]" 1
439 1 30 LYS H 1 38 ILE MD . . 4.180 3.167 2.766 3.527 . 0 0 "[ . 1 . 2]" 1
440 1 30 LYS HA 1 30 LYS QD . . 4.020 3.081 2.413 3.907 . 0 0 "[ . 1 . 2]" 1
441 1 30 LYS HA 1 30 LYS QG . . 3.470 2.524 2.250 2.820 . 0 0 "[ . 1 . 2]" 1
442 1 30 LYS HA 1 31 GLU H . . 3.290 2.248 2.153 2.319 . 0 0 "[ . 1 . 2]" 1
443 1 30 LYS HA 1 31 GLU HB2 . . 4.840 4.500 4.369 4.695 . 0 0 "[ . 1 . 2]" 1
444 1 30 LYS HA 1 31 GLU QB . . 4.250 4.079 4.047 4.105 . 0 0 "[ . 1 . 2]" 1
445 1 30 LYS HA 1 31 GLU HB3 . . 4.840 4.686 4.481 4.836 . 0 0 "[ . 1 . 2]" 1
446 1 30 LYS HA 1 38 ILE MD . . 3.330 2.497 1.974 2.770 . 0 0 "[ . 1 . 2]" 1
447 1 30 LYS HA 1 38 ILE HG12 . . 5.370 4.938 4.453 5.296 . 0 0 "[ . 1 . 2]" 1
448 1 30 LYS QB 1 30 LYS QE . . 4.470 3.453 2.489 3.755 . 0 0 "[ . 1 . 2]" 1
449 1 30 LYS QB 1 33 LYS H . . 3.800 3.033 2.084 3.602 . 0 0 "[ . 1 . 2]" 1
450 1 30 LYS QB 1 33 LYS QB . . 3.730 2.983 2.237 3.427 . 0 0 "[ . 1 . 2]" 1
451 1 30 LYS QB 1 36 THR H . . 4.180 3.712 3.337 4.042 . 0 0 "[ . 1 . 2]" 1
452 1 30 LYS QB 1 36 THR HB . . 3.790 2.242 1.948 2.777 . 0 0 "[ . 1 . 2]" 1
453 1 30 LYS QB 1 36 THR MG . . 3.590 2.212 1.901 2.604 . 0 0 "[ . 1 . 2]" 1
454 1 30 LYS QB 1 38 ILE MD . . 3.720 2.123 1.855 2.671 . 0 0 "[ . 1 . 2]" 1
455 1 30 LYS HB2 1 30 LYS HD2 . . 4.100 2.589 2.083 3.542 . 0 0 "[ . 1 . 2]" 1
456 1 30 LYS HB2 1 30 LYS HD3 . . 4.100 2.604 2.093 3.173 . 0 0 "[ . 1 . 2]" 1
457 1 30 LYS HB2 1 38 ILE MD . . 4.470 2.140 1.865 2.715 . 0 0 "[ . 1 . 2]" 1
458 1 30 LYS HB3 1 30 LYS HD2 . . 4.100 3.542 2.952 4.199 0.099 8 0 "[ . 1 . 2]" 1
459 1 30 LYS HB3 1 30 LYS HD3 . . 4.100 3.228 2.718 3.551 . 0 0 "[ . 1 . 2]" 1
460 1 30 LYS HB3 1 38 ILE MD . . 4.470 3.559 3.201 4.072 . 0 0 "[ . 1 . 2]" 1
461 1 30 LYS QD 1 33 LYS QB . . 5.180 3.768 2.442 5.140 . 0 0 "[ . 1 . 2]" 1
462 1 30 LYS QD 1 36 THR HB . . 4.410 3.319 2.282 4.434 0.024 13 0 "[ . 1 . 2]" 1
463 1 30 LYS QD 1 36 THR MG . . 3.310 2.228 1.818 3.040 . 0 0 "[ . 1 . 2]" 1
464 1 30 LYS QD 1 38 ILE MD . . 3.770 2.274 1.822 2.871 . 0 0 "[ . 1 . 2]" 1
465 1 30 LYS HD2 1 33 LYS H . . 5.500 5.145 4.649 5.419 . 0 0 "[ . 1 . 2]" 1
466 1 30 LYS HD2 1 36 THR MG . . 3.860 3.090 1.936 3.882 0.022 13 0 "[ . 1 . 2]" 1
467 1 30 LYS HD2 1 38 ILE MD . . 4.350 2.530 1.969 3.495 . 0 0 "[ . 1 . 2]" 1
468 1 30 LYS HD3 1 33 LYS H . . 5.500 4.686 3.404 5.505 0.005 1 0 "[ . 1 . 2]" 1
469 1 30 LYS HD3 1 36 THR MG . . 3.860 2.370 1.891 3.175 . 0 0 "[ . 1 . 2]" 1
470 1 30 LYS HD3 1 38 ILE MD . . 4.350 3.075 1.981 4.322 . 0 0 "[ . 1 . 2]" 1
471 1 30 LYS QE 1 30 LYS QG . . 3.220 2.178 2.055 2.318 . 0 0 "[ . 1 . 2]" 1
472 1 30 LYS QE 1 33 LYS QB . . 4.960 4.215 3.275 4.907 . 0 0 "[ . 1 . 2]" 1
473 1 30 LYS QE 1 36 THR MG . . 4.840 3.401 1.714 4.151 . 0 0 "[ . 1 . 2]" 1
474 1 30 LYS QE 1 38 ILE HG13 . . 5.340 5.047 3.443 5.333 . 0 0 "[ . 1 . 2]" 1
475 1 30 LYS HE2 1 36 THR MG . . 5.500 3.984 1.774 4.963 . 0 0 "[ . 1 . 2]" 1
476 1 30 LYS HE2 1 38 ILE MD . . 5.500 4.191 2.904 4.923 . 0 0 "[ . 1 . 2]" 1
477 1 30 LYS HE3 1 36 THR MG . . 5.500 3.816 2.264 4.518 . 0 0 "[ . 1 . 2]" 1
478 1 30 LYS HE3 1 38 ILE MD . . 5.500 4.123 3.135 4.717 . 0 0 "[ . 1 . 2]" 1
479 1 30 LYS QG 1 31 GLU H . . 4.240 2.187 1.866 3.187 . 0 0 "[ . 1 . 2]" 1
480 1 30 LYS QG 1 32 GLY QA . . 4.570 3.652 3.159 4.338 . 0 0 "[ . 1 . 2]" 1
481 1 30 LYS QG 1 33 LYS H . . 3.340 2.458 2.055 2.863 . 0 0 "[ . 1 . 2]" 1
482 1 30 LYS QG 1 36 THR HB . . 4.450 3.168 2.390 3.981 . 0 0 "[ . 1 . 2]" 1
483 1 30 LYS QG 1 36 THR MG . . 4.320 3.172 2.274 3.906 . 0 0 "[ . 1 . 2]" 1
484 1 30 LYS QG 1 38 ILE MD . . 4.180 3.289 2.850 3.718 . 0 0 "[ . 1 . 2]" 1
485 1 30 LYS HG2 1 31 GLU H . . 4.840 3.484 2.829 3.956 . 0 0 "[ . 1 . 2]" 1
486 1 30 LYS HG2 1 31 GLU HA . . 5.500 5.164 4.477 5.592 0.092 15 0 "[ . 1 . 2]" 1
487 1 30 LYS HG2 1 33 LYS H . . 3.990 2.652 2.064 3.142 . 0 0 "[ . 1 . 2]" 1
488 1 30 LYS HG2 1 36 THR MG . . 5.160 3.359 2.299 4.261 . 0 0 "[ . 1 . 2]" 1
489 1 30 LYS HG2 1 38 ILE MD . . 4.780 4.100 3.714 4.383 . 0 0 "[ . 1 . 2]" 1
490 1 30 LYS HG3 1 31 GLU H . . 4.840 2.242 1.873 3.361 . 0 0 "[ . 1 . 2]" 1
491 1 30 LYS HG3 1 31 GLU HA . . 5.500 4.511 3.930 5.490 . 0 0 "[ . 1 . 2]" 1
492 1 30 LYS HG3 1 33 LYS H . . 3.990 3.361 2.459 3.978 . 0 0 "[ . 1 . 2]" 1
493 1 30 LYS HG3 1 36 THR MG . . 5.160 4.088 3.594 4.641 . 0 0 "[ . 1 . 2]" 1
494 1 30 LYS HG3 1 38 ILE MD . . 4.780 3.508 2.925 4.058 . 0 0 "[ . 1 . 2]" 1
495 1 31 GLU H 1 31 GLU HB2 . . 3.700 2.666 2.413 2.979 . 0 0 "[ . 1 . 2]" 1
496 1 31 GLU H 1 31 GLU QB . . 3.190 2.268 2.220 2.326 . 0 0 "[ . 1 . 2]" 1
497 1 31 GLU H 1 31 GLU HB3 . . 3.700 2.484 2.290 2.636 . 0 0 "[ . 1 . 2]" 1
498 1 31 GLU H 1 31 GLU QG . . 4.500 3.979 3.866 4.081 . 0 0 "[ . 1 . 2]" 1
499 1 31 GLU H 1 33 LYS H . . 5.470 4.024 3.546 4.571 . 0 0 "[ . 1 . 2]" 1
500 1 31 GLU H 1 38 ILE MD . . 4.490 4.088 3.260 4.484 . 0 0 "[ . 1 . 2]" 1
501 1 31 GLU HA 1 31 GLU QG . . 3.710 2.525 2.305 2.985 . 0 0 "[ . 1 . 2]" 1
502 1 31 GLU HA 1 33 LYS H . . 4.210 4.029 3.707 4.203 . 0 0 "[ . 1 . 2]" 1
503 1 31 GLU QG 1 32 GLY H . . 4.570 3.327 2.851 4.175 . 0 0 "[ . 1 . 2]" 1
504 1 31 GLU QG 1 33 LYS H . . 5.200 4.955 4.572 5.204 0.004 8 0 "[ . 1 . 2]" 1
505 1 32 GLY H 1 33 LYS H . . 3.960 2.781 1.961 3.012 . 0 0 "[ . 1 . 2]" 1
506 1 33 LYS H 1 33 LYS HB2 . . 3.640 2.944 2.553 3.470 . 0 0 "[ . 1 . 2]" 1
507 1 33 LYS H 1 33 LYS QB . . 3.090 2.606 2.382 2.800 . 0 0 "[ . 1 . 2]" 1
508 1 33 LYS H 1 33 LYS HB3 . . 3.640 2.996 2.537 3.266 . 0 0 "[ . 1 . 2]" 1
509 1 33 LYS H 1 33 LYS HG2 . . 5.400 4.634 4.372 5.102 . 0 0 "[ . 1 . 2]" 1
510 1 33 LYS H 1 33 LYS QG . . 4.570 4.142 4.023 4.244 . 0 0 "[ . 1 . 2]" 1
511 1 33 LYS H 1 33 LYS HG3 . . 5.400 4.732 4.324 5.039 . 0 0 "[ . 1 . 2]" 1
512 1 33 LYS H 1 34 PRO HD2 . . 5.010 4.673 4.406 4.786 . 0 0 "[ . 1 . 2]" 1
513 1 33 LYS H 1 34 PRO HD3 . . 4.570 4.353 3.828 4.600 0.030 7 0 "[ . 1 . 2]" 1
514 1 33 LYS H 1 36 THR HB . . 5.220 4.137 3.592 4.682 . 0 0 "[ . 1 . 2]" 1
515 1 33 LYS H 1 36 THR MG . . 5.470 4.995 4.458 5.431 . 0 0 "[ . 1 . 2]" 1
516 1 33 LYS HA 1 33 LYS HD2 . . 4.060 3.502 2.434 4.140 0.080 18 0 "[ . 1 . 2]" 1
517 1 33 LYS HA 1 33 LYS QD . . 3.450 2.785 2.108 3.165 . 0 0 "[ . 1 . 2]" 1
518 1 33 LYS HA 1 33 LYS HD3 . . 4.060 2.969 2.310 3.334 . 0 0 "[ . 1 . 2]" 1
519 1 33 LYS HA 1 34 PRO HD2 . . 3.220 2.001 1.913 2.118 . 0 0 "[ . 1 . 2]" 1
520 1 33 LYS HA 1 34 PRO HD3 . . 3.370 2.343 2.258 2.498 . 0 0 "[ . 1 . 2]" 1
521 1 33 LYS HA 1 34 PRO HG2 . . 5.060 4.193 4.117 4.287 . 0 0 "[ . 1 . 2]" 1
522 1 33 LYS HA 1 34 PRO QG . . 4.210 3.795 3.766 3.842 . 0 0 "[ . 1 . 2]" 1
523 1 33 LYS HA 1 34 PRO HG3 . . 5.060 4.336 4.317 4.382 . 0 0 "[ . 1 . 2]" 1
524 1 33 LYS HA 1 35 LYS H . . 4.490 3.984 3.393 4.323 . 0 0 "[ . 1 . 2]" 1
525 1 33 LYS HA 1 36 THR H . . 4.890 4.454 4.275 4.683 . 0 0 "[ . 1 . 2]" 1
526 1 33 LYS HA 1 36 THR HB . . 5.400 4.783 4.508 5.202 . 0 0 "[ . 1 . 2]" 1
527 1 33 LYS QB 1 36 THR H . . 3.970 2.953 2.523 3.574 . 0 0 "[ . 1 . 2]" 1
528 1 33 LYS QB 1 36 THR HB . . 3.480 2.161 1.982 2.425 . 0 0 "[ . 1 . 2]" 1
529 1 33 LYS QB 1 36 THR MG . . 4.110 3.435 3.248 3.646 . 0 0 "[ . 1 . 2]" 1
530 1 33 LYS HB2 1 36 THR HB . . 4.100 3.634 3.326 3.860 . 0 0 "[ . 1 . 2]" 1
531 1 33 LYS HB2 1 36 THR MG . . 4.670 4.509 4.125 4.731 0.061 13 0 "[ . 1 . 2]" 1
532 1 33 LYS HB3 1 36 THR HB . . 4.100 2.178 1.996 2.455 . 0 0 "[ . 1 . 2]" 1
533 1 33 LYS HB3 1 36 THR MG . . 4.670 3.568 3.326 3.816 . 0 0 "[ . 1 . 2]" 1
534 1 33 LYS QD 1 34 PRO HD2 . . 4.240 2.229 1.971 2.894 . 0 0 "[ . 1 . 2]" 1
535 1 33 LYS QD 1 35 LYS HB3 . . 4.440 3.808 3.283 4.470 0.030 4 0 "[ . 1 . 2]" 1
536 1 33 LYS QD 1 36 THR H . . 4.020 2.656 1.864 3.873 . 0 0 "[ . 1 . 2]" 1
537 1 33 LYS QE 1 33 LYS QG . . 3.310 2.204 2.007 2.414 . 0 0 "[ . 1 . 2]" 1
538 1 33 LYS QE 1 35 LYS QD . . 3.090 2.758 1.814 3.241 0.151 18 0 "[ . 1 . 2]" 1
539 1 33 LYS QE 1 35 LYS QG . . 4.350 3.327 1.946 4.034 . 0 0 "[ . 1 . 2]" 1
540 1 33 LYS QE 1 85 GLU H . . 4.140 3.293 2.582 4.029 . 0 0 "[ . 1 . 2]" 1
541 1 33 LYS QE 1 85 GLU HA . . 4.410 4.083 3.608 4.418 0.008 7 0 "[ . 1 . 2]" 1
542 1 33 LYS QE 1 86 LEU H . . 4.790 4.571 4.169 4.839 0.049 13 0 "[ . 1 . 2]" 1
543 1 33 LYS QG 1 36 THR HB . . 4.460 3.549 1.929 4.468 0.008 18 0 "[ . 1 . 2]" 1
544 1 34 PRO HA 1 36 THR H . . 4.470 3.945 3.476 4.460 . 0 0 "[ . 1 . 2]" 1
545 1 34 PRO HA 1 116 PRO HG3 . . 3.540 2.863 2.315 3.541 0.001 6 0 "[ . 1 . 2]" 1
546 1 34 PRO HB2 1 35 LYS QG . . 4.420 3.794 3.500 4.017 . 0 0 "[ . 1 . 2]" 1
547 1 34 PRO HB2 1 88 LEU MD1 . . 4.770 3.318 2.854 3.662 . 0 0 "[ . 1 . 2]" 1
548 1 34 PRO HB2 1 88 LEU MD2 . . 3.060 1.971 1.825 2.112 . 0 0 "[ . 1 . 2]" 1
549 1 34 PRO HB2 1 118 ALA MB . . 5.430 4.347 3.793 4.868 . 0 0 "[ . 1 . 2]" 1
550 1 34 PRO HB3 1 88 LEU MD1 . . 4.680 4.336 4.075 4.617 . 0 0 "[ . 1 . 2]" 1
551 1 34 PRO HB3 1 88 LEU MD2 . . 3.830 3.406 3.162 3.624 . 0 0 "[ . 1 . 2]" 1
552 1 34 PRO HB3 1 118 ALA MB . . 4.880 4.272 3.714 4.798 . 0 0 "[ . 1 . 2]" 1
553 1 34 PRO HD2 1 35 LYS H . . 4.000 2.716 2.646 2.784 . 0 0 "[ . 1 . 2]" 1
554 1 34 PRO HD2 1 35 LYS HB2 . . 4.750 4.295 4.082 4.637 . 0 0 "[ . 1 . 2]" 1
555 1 34 PRO HD2 1 88 LEU MD2 . . 5.160 4.694 4.340 5.012 . 0 0 "[ . 1 . 2]" 1
556 1 34 PRO HD3 1 35 LYS H . . 4.450 3.861 3.834 3.886 . 0 0 "[ . 1 . 2]" 1
557 1 34 PRO QG 1 35 LYS QG . . 4.320 2.685 2.188 3.005 . 0 0 "[ . 1 . 2]" 1
558 1 34 PRO QG 1 88 LEU MD1 . . 3.840 3.065 2.712 3.557 . 0 0 "[ . 1 . 2]" 1
559 1 34 PRO QG 1 88 LEU MD2 . . 3.380 2.712 2.309 3.022 . 0 0 "[ . 1 . 2]" 1
560 1 34 PRO QG 1 118 ALA H . . 4.660 4.108 3.679 4.552 . 0 0 "[ . 1 . 2]" 1
561 1 34 PRO QG 1 118 ALA HA . . 4.070 2.702 2.213 3.143 . 0 0 "[ . 1 . 2]" 1
562 1 34 PRO QG 1 118 ALA MB . . 4.070 2.793 2.380 3.374 . 0 0 "[ . 1 . 2]" 1
563 1 34 PRO HG2 1 35 LYS H . . 4.220 2.111 1.873 2.754 . 0 0 "[ . 1 . 2]" 1
564 1 34 PRO HG2 1 88 LEU MD1 . . 4.470 3.307 2.939 3.853 . 0 0 "[ . 1 . 2]" 1
565 1 34 PRO HG2 1 88 LEU MD2 . . 3.880 2.811 2.386 3.151 . 0 0 "[ . 1 . 2]" 1
566 1 34 PRO HG3 1 35 LYS H . . 4.220 3.687 3.507 4.167 . 0 0 "[ . 1 . 2]" 1
567 1 34 PRO HG3 1 88 LEU MD1 . . 4.470 3.638 3.183 4.177 . 0 0 "[ . 1 . 2]" 1
568 1 34 PRO HG3 1 88 LEU MD2 . . 3.880 3.574 3.073 3.885 0.005 2 0 "[ . 1 . 2]" 1
569 1 35 LYS H 1 35 LYS HB2 . . 3.360 2.420 2.207 2.719 . 0 0 "[ . 1 . 2]" 1
570 1 35 LYS H 1 35 LYS HB3 . . 3.730 3.567 3.508 3.601 . 0 0 "[ . 1 . 2]" 1
571 1 35 LYS H 1 35 LYS QD . . 4.380 4.037 3.460 4.279 . 0 0 "[ . 1 . 2]" 1
572 1 35 LYS H 1 35 LYS HG2 . . 3.920 3.453 2.727 3.934 0.014 20 0 "[ . 1 . 2]" 1
573 1 35 LYS H 1 35 LYS QG . . 3.330 2.425 1.895 2.847 . 0 0 "[ . 1 . 2]" 1
574 1 35 LYS H 1 35 LYS HG3 . . 3.920 2.482 1.909 2.921 . 0 0 "[ . 1 . 2]" 1
575 1 35 LYS H 1 36 THR H . . 3.140 2.660 2.376 2.863 . 0 0 "[ . 1 . 2]" 1
576 1 35 LYS H 1 86 LEU H . . 5.500 5.364 5.116 5.487 . 0 0 "[ . 1 . 2]" 1
577 1 35 LYS H 1 88 LEU MD2 . . 4.220 3.138 2.716 3.673 . 0 0 "[ . 1 . 2]" 1
578 1 35 LYS HA 1 35 LYS QD . . 4.400 3.905 3.666 4.142 . 0 0 "[ . 1 . 2]" 1
579 1 35 LYS HA 1 35 LYS HG2 . . 3.900 2.464 2.290 2.798 . 0 0 "[ . 1 . 2]" 1
580 1 35 LYS HA 1 35 LYS QG . . 3.380 2.351 2.226 2.597 . 0 0 "[ . 1 . 2]" 1
581 1 35 LYS HA 1 35 LYS HG3 . . 3.900 3.083 2.635 3.445 . 0 0 "[ . 1 . 2]" 1
582 1 35 LYS HA 1 86 LEU H . . 3.990 3.563 3.204 4.001 0.011 13 0 "[ . 1 . 2]" 1
583 1 35 LYS HA 1 86 LEU QB . . 4.550 3.145 2.864 3.556 . 0 0 "[ . 1 . 2]" 1
584 1 35 LYS HA 1 86 LEU MD1 . . 4.620 4.429 4.064 4.627 0.007 9 0 "[ . 1 . 2]" 1
585 1 35 LYS HA 1 88 LEU MD2 . . 3.140 2.442 2.042 2.835 . 0 0 "[ . 1 . 2]" 1
586 1 35 LYS HB2 1 36 THR H . . 4.430 3.112 2.573 3.814 . 0 0 "[ . 1 . 2]" 1
587 1 35 LYS HB2 1 85 GLU H . . 4.340 3.474 2.844 3.895 . 0 0 "[ . 1 . 2]" 1
588 1 35 LYS HB2 1 85 GLU HA . . 4.450 4.189 3.740 4.395 . 0 0 "[ . 1 . 2]" 1
589 1 35 LYS HB2 1 86 LEU H . . 3.950 3.632 2.737 3.955 0.005 5 0 "[ . 1 . 2]" 1
590 1 35 LYS HB3 1 35 LYS QD . . 3.300 2.358 2.064 2.630 . 0 0 "[ . 1 . 2]" 1
591 1 35 LYS HB3 1 36 THR H . . 4.520 3.907 3.575 4.210 . 0 0 "[ . 1 . 2]" 1
592 1 35 LYS HB3 1 85 GLU H . . 3.610 2.890 2.153 3.651 0.041 13 0 "[ . 1 . 2]" 1
593 1 35 LYS HB3 1 85 GLU HA . . 4.010 3.234 2.950 3.875 . 0 0 "[ . 1 . 2]" 1
594 1 35 LYS HB3 1 86 LEU H . . 3.370 2.022 1.882 2.261 . 0 0 "[ . 1 . 2]" 1
595 1 35 LYS HB3 1 88 LEU MD2 . . 4.300 3.999 3.460 4.301 0.001 7 0 "[ . 1 . 2]" 1
596 1 35 LYS QD 1 85 GLU H . . 4.640 3.741 2.822 4.153 . 0 0 "[ . 1 . 2]" 1
597 1 35 LYS QD 1 85 GLU HA . . 3.760 2.908 2.206 3.426 . 0 0 "[ . 1 . 2]" 1
598 1 35 LYS QD 1 86 LEU H . . 4.590 3.257 2.349 4.055 . 0 0 "[ . 1 . 2]" 1
599 1 35 LYS QD 1 88 LEU MD1 . . 4.840 4.186 3.221 4.828 . 0 0 "[ . 1 . 2]" 1
600 1 35 LYS QD 1 88 LEU MD2 . . 4.100 3.902 3.469 4.103 0.003 17 0 "[ . 1 . 2]" 1
601 1 35 LYS QG 1 88 LEU MD1 . . 3.470 3.006 2.462 3.489 0.019 9 0 "[ . 1 . 2]" 1
602 1 35 LYS QG 1 88 LEU MD2 . . 3.050 2.074 1.847 2.263 . 0 0 "[ . 1 . 2]" 1
603 1 35 LYS QG 1 88 LEU HG . . 3.990 2.851 2.467 3.423 . 0 0 "[ . 1 . 2]" 1
604 1 35 LYS HG2 1 85 GLU HA . . 5.500 4.838 4.261 5.424 . 0 0 "[ . 1 . 2]" 1
605 1 35 LYS HG2 1 88 LEU MD2 . . 3.590 2.272 1.968 3.193 . 0 0 "[ . 1 . 2]" 1
606 1 35 LYS HG2 1 88 LEU HG . . 4.670 2.982 2.614 3.601 . 0 0 "[ . 1 . 2]" 1
607 1 35 LYS HG3 1 85 GLU HA . . 5.500 5.350 4.803 5.517 0.017 9 0 "[ . 1 . 2]" 1
608 1 35 LYS HG3 1 88 LEU MD2 . . 3.590 2.631 1.992 3.256 . 0 0 "[ . 1 . 2]" 1
609 1 35 LYS HG3 1 88 LEU HG . . 4.670 3.799 2.855 4.422 . 0 0 "[ . 1 . 2]" 1
610 1 36 THR H 1 36 THR HB . . 3.180 2.558 2.342 2.756 . 0 0 "[ . 1 . 2]" 1
611 1 36 THR H 1 36 THR MG . . 3.850 3.789 3.691 3.840 . 0 0 "[ . 1 . 2]" 1
612 1 36 THR H 1 37 ILE H . . 4.720 4.523 4.461 4.612 . 0 0 "[ . 1 . 2]" 1
613 1 36 THR H 1 84 GLN HA . . 5.190 4.295 3.826 4.677 . 0 0 "[ . 1 . 2]" 1
614 1 36 THR HA 1 36 THR MG . . 3.420 2.384 2.217 2.565 . 0 0 "[ . 1 . 2]" 1
615 1 36 THR HA 1 37 ILE H . . 3.030 2.201 2.143 2.305 . 0 0 "[ . 1 . 2]" 1
616 1 36 THR HA 1 37 ILE HG12 . . 4.490 4.054 3.906 4.216 . 0 0 "[ . 1 . 2]" 1
617 1 36 THR HA 1 37 ILE HG13 . . 5.200 4.737 4.601 4.968 . 0 0 "[ . 1 . 2]" 1
618 1 36 THR HA 1 37 ILE MG . . 4.870 3.631 3.474 3.776 . 0 0 "[ . 1 . 2]" 1
619 1 36 THR HA 1 83 ILE MG . . 4.890 4.636 4.389 4.836 . 0 0 "[ . 1 . 2]" 1
620 1 36 THR HA 1 84 GLN H . . 4.880 4.561 4.219 4.772 . 0 0 "[ . 1 . 2]" 1
621 1 36 THR HA 1 84 GLN HA . . 3.580 2.137 2.009 2.333 . 0 0 "[ . 1 . 2]" 1
622 1 36 THR HA 1 85 GLU H . . 4.390 4.192 3.956 4.372 . 0 0 "[ . 1 . 2]" 1
623 1 36 THR HB 1 37 ILE H . . 4.530 4.040 3.863 4.275 . 0 0 "[ . 1 . 2]" 1
624 1 36 THR HB 1 84 GLN HA . . 5.500 4.622 3.943 5.011 . 0 0 "[ . 1 . 2]" 1
625 1 36 THR MG 1 37 ILE H . . 3.360 2.287 1.939 2.764 . 0 0 "[ . 1 . 2]" 1
626 1 36 THR MG 1 38 ILE MD . . 3.850 2.864 2.520 3.300 . 0 0 "[ . 1 . 2]" 1
627 1 36 THR MG 1 38 ILE HG13 . . 3.930 3.670 3.458 3.909 . 0 0 "[ . 1 . 2]" 1
628 1 36 THR MG 1 82 GLN HA . . 4.740 3.884 3.581 4.111 . 0 0 "[ . 1 . 2]" 1
629 1 36 THR MG 1 82 GLN QB . . 3.480 3.081 2.857 3.307 . 0 0 "[ . 1 . 2]" 1
630 1 36 THR MG 1 82 GLN QG . . 4.150 3.359 2.998 3.932 . 0 0 "[ . 1 . 2]" 1
631 1 36 THR MG 1 83 ILE H . . 4.560 3.685 3.274 4.109 . 0 0 "[ . 1 . 2]" 1
632 1 36 THR MG 1 84 GLN HA . . 3.930 3.347 2.843 3.648 . 0 0 "[ . 1 . 2]" 1
633 1 36 THR MG 1 84 GLN QB . . 3.940 3.101 2.082 3.839 . 0 0 "[ . 1 . 2]" 1
634 1 36 THR MG 1 84 GLN HG2 . . 4.510 2.789 1.956 4.202 . 0 0 "[ . 1 . 2]" 1
635 1 36 THR MG 1 84 GLN QG . . 3.810 2.702 1.940 3.813 0.003 15 0 "[ . 1 . 2]" 1
636 1 36 THR MG 1 84 GLN HG3 . . 4.510 3.920 3.218 4.522 0.012 20 0 "[ . 1 . 2]" 1
637 1 36 THR MG 1 85 GLU H . . 5.380 5.093 4.665 5.363 . 0 0 "[ . 1 . 2]" 1
638 1 37 ILE H 1 37 ILE HG12 . . 3.840 2.739 2.647 2.898 . 0 0 "[ . 1 . 2]" 1
639 1 37 ILE H 1 37 ILE HG13 . . 3.780 2.762 2.636 3.013 . 0 0 "[ . 1 . 2]" 1
640 1 37 ILE H 1 37 ILE MG . . 3.540 3.015 2.915 3.102 . 0 0 "[ . 1 . 2]" 1
641 1 37 ILE H 1 82 GLN HA . . 4.490 4.358 4.135 4.493 0.003 20 0 "[ . 1 . 2]" 1
642 1 37 ILE H 1 83 ILE H . . 3.680 3.188 2.698 3.492 . 0 0 "[ . 1 . 2]" 1
643 1 37 ILE H 1 83 ILE HB . . 4.560 3.784 3.403 4.020 . 0 0 "[ . 1 . 2]" 1
644 1 37 ILE H 1 83 ILE MG . . 5.270 4.459 4.310 4.682 . 0 0 "[ . 1 . 2]" 1
645 1 37 ILE H 1 84 GLN HA . . 4.090 3.663 3.328 3.815 . 0 0 "[ . 1 . 2]" 1
646 1 37 ILE H 1 86 LEU MD1 . . 4.040 3.636 3.320 4.043 0.003 7 0 "[ . 1 . 2]" 1
647 1 37 ILE HB 1 37 ILE MD . . 3.090 2.244 2.133 2.349 . 0 0 "[ . 1 . 2]" 1
648 1 37 ILE HB 1 38 ILE H . . 3.280 2.567 2.275 2.857 . 0 0 "[ . 1 . 2]" 1
649 1 37 ILE HB 1 39 VAL MG2 . . 4.030 3.929 3.750 4.031 0.001 6 0 "[ . 1 . 2]" 1
650 1 37 ILE HB 1 113 PHE QE . . 5.500 4.008 3.659 4.444 . 0 0 "[ . 1 . 2]" 1
651 1 37 ILE MD 1 37 ILE MG . . 3.050 2.357 2.169 2.488 . 0 0 "[ . 1 . 2]" 1
652 1 37 ILE MD 1 39 VAL HB . . 5.340 4.742 4.465 5.218 . 0 0 "[ . 1 . 2]" 1
653 1 37 ILE MD 1 39 VAL MG2 . . 3.070 2.421 2.273 2.798 . 0 0 "[ . 1 . 2]" 1
654 1 37 ILE MD 1 83 ILE HB . . 3.890 3.160 2.624 3.451 . 0 0 "[ . 1 . 2]" 1
655 1 37 ILE MD 1 83 ILE MD . . 3.170 3.010 2.700 3.170 . 0 0 "[ . 1 . 2]" 1
656 1 37 ILE MD 1 86 LEU MD1 . . 3.110 2.622 2.154 2.902 . 0 0 "[ . 1 . 2]" 1
657 1 37 ILE MD 1 92 TYR QB . . 5.010 4.169 3.941 4.469 . 0 0 "[ . 1 . 2]" 1
658 1 37 ILE MD 1 94 PHE QD . . 4.140 3.518 3.333 3.779 . 0 0 "[ . 1 . 2]" 1
659 1 37 ILE MD 1 94 PHE QE . . 3.530 2.388 1.985 2.759 . 0 0 "[ . 1 . 2]" 1
660 1 37 ILE MD 1 94 PHE HZ . . 3.540 2.163 1.892 2.474 . 0 0 "[ . 1 . 2]" 1
661 1 37 ILE MD 1 113 PHE QB . . 5.340 4.082 3.897 4.382 . 0 0 "[ . 1 . 2]" 1
662 1 37 ILE MD 1 113 PHE QD . . 4.130 3.396 3.133 3.596 . 0 0 "[ . 1 . 2]" 1
663 1 37 ILE MD 1 113 PHE QE . . 4.460 3.552 2.882 4.008 . 0 0 "[ . 1 . 2]" 1
664 1 37 ILE MD 1 115 THR MG . . 4.170 3.933 3.642 4.121 . 0 0 "[ . 1 . 2]" 1
665 1 37 ILE HG12 1 37 ILE MG . . 3.280 2.135 2.073 2.252 . 0 0 "[ . 1 . 2]" 1
666 1 37 ILE HG12 1 83 ILE H . . 4.290 4.065 3.805 4.293 0.003 15 0 "[ . 1 . 2]" 1
667 1 37 ILE HG12 1 83 ILE HB . . 4.070 2.996 2.771 3.183 . 0 0 "[ . 1 . 2]" 1
668 1 37 ILE HG12 1 86 LEU QB . . 5.270 4.251 3.854 4.675 . 0 0 "[ . 1 . 2]" 1
669 1 37 ILE HG12 1 86 LEU MD1 . . 3.440 2.162 1.939 2.582 . 0 0 "[ . 1 . 2]" 1
670 1 37 ILE HG12 1 94 PHE HZ . . 4.360 3.937 3.563 4.306 . 0 0 "[ . 1 . 2]" 1
671 1 37 ILE HG12 1 113 PHE QE . . 5.500 5.110 4.658 5.494 . 0 0 "[ . 1 . 2]" 1
672 1 37 ILE HG13 1 37 ILE MG . . 3.600 3.148 3.130 3.174 . 0 0 "[ . 1 . 2]" 1
673 1 37 ILE HG13 1 39 VAL MG2 . . 4.310 3.379 3.099 3.544 . 0 0 "[ . 1 . 2]" 1
674 1 37 ILE HG13 1 82 GLN HA . . 5.250 4.368 3.976 4.615 . 0 0 "[ . 1 . 2]" 1
675 1 37 ILE HG13 1 83 ILE H . . 3.750 2.987 2.656 3.190 . 0 0 "[ . 1 . 2]" 1
676 1 37 ILE HG13 1 83 ILE HB . . 3.900 2.808 2.432 3.009 . 0 0 "[ . 1 . 2]" 1
677 1 37 ILE HG13 1 83 ILE MG . . 4.430 4.223 3.856 4.435 0.005 13 0 "[ . 1 . 2]" 1
678 1 37 ILE HG13 1 86 LEU MD1 . . 3.800 3.377 3.088 3.803 0.003 7 0 "[ . 1 . 2]" 1
679 1 37 ILE HG13 1 94 PHE HZ . . 5.180 4.807 4.476 5.153 . 0 0 "[ . 1 . 2]" 1
680 1 37 ILE MG 1 38 ILE H . . 3.980 3.773 3.633 3.873 . 0 0 "[ . 1 . 2]" 1
681 1 37 ILE MG 1 83 ILE H . . 5.500 5.169 4.918 5.354 . 0 0 "[ . 1 . 2]" 1
682 1 37 ILE MG 1 83 ILE MG . . 5.020 4.832 4.545 5.022 0.002 15 0 "[ . 1 . 2]" 1
683 1 37 ILE MG 1 86 LEU MD1 . . 3.410 2.696 2.220 3.279 . 0 0 "[ . 1 . 2]" 1
684 1 37 ILE MG 1 94 PHE QE . . 4.720 4.454 4.036 4.716 . 0 0 "[ . 1 . 2]" 1
685 1 37 ILE MG 1 94 PHE HZ . . 4.720 4.004 3.563 4.373 . 0 0 "[ . 1 . 2]" 1
686 1 37 ILE MG 1 113 PHE QD . . 3.990 3.726 3.402 3.994 0.004 4 0 "[ . 1 . 2]" 1
687 1 37 ILE MG 1 113 PHE QE . . 3.630 2.349 1.995 2.653 . 0 0 "[ . 1 . 2]" 1
688 1 37 ILE MG 1 113 PHE HZ . . 4.560 3.463 2.652 4.139 . 0 0 "[ . 1 . 2]" 1
689 1 37 ILE MG 1 115 THR MG . . 3.680 3.231 2.949 3.451 . 0 0 "[ . 1 . 2]" 1
690 1 37 ILE MG 1 116 PRO QD . . 5.350 2.969 2.697 3.321 . 0 0 "[ . 1 . 2]" 1
691 1 38 ILE H 1 38 ILE HB . . 3.500 2.665 2.562 2.775 . 0 0 "[ . 1 . 2]" 1
692 1 38 ILE H 1 38 ILE MD . . 3.570 2.216 1.883 2.508 . 0 0 "[ . 1 . 2]" 1
693 1 38 ILE H 1 38 ILE HG13 . . 4.210 3.552 3.262 3.740 . 0 0 "[ . 1 . 2]" 1
694 1 38 ILE HA 1 38 ILE MD . . 3.910 3.295 3.139 3.412 . 0 0 "[ . 1 . 2]" 1
695 1 38 ILE HA 1 38 ILE HG12 . . 3.990 3.572 3.512 3.694 . 0 0 "[ . 1 . 2]" 1
696 1 38 ILE HA 1 38 ILE HG13 . . 3.840 2.385 2.321 2.511 . 0 0 "[ . 1 . 2]" 1
697 1 38 ILE HA 1 38 ILE MG . . 3.350 2.340 2.267 2.442 . 0 0 "[ . 1 . 2]" 1
698 1 38 ILE HA 1 39 VAL H . . 3.020 2.161 2.140 2.210 . 0 0 "[ . 1 . 2]" 1
699 1 38 ILE HA 1 39 VAL MG2 . . 4.220 3.731 3.537 3.953 . 0 0 "[ . 1 . 2]" 1
700 1 38 ILE HA 1 81 HIS H . . 4.440 4.314 3.953 4.442 0.002 10 0 "[ . 1 . 2]" 1
701 1 38 ILE HA 1 82 GLN HA . . 3.660 2.707 2.427 2.831 . 0 0 "[ . 1 . 2]" 1
702 1 38 ILE HA 1 82 GLN HG2 . . 4.980 3.990 3.341 4.951 . 0 0 "[ . 1 . 2]" 1
703 1 38 ILE HA 1 82 GLN QG . . 4.210 3.194 2.945 3.469 . 0 0 "[ . 1 . 2]" 1
704 1 38 ILE HA 1 82 GLN HG3 . . 4.980 3.490 2.979 4.156 . 0 0 "[ . 1 . 2]" 1
705 1 38 ILE HA 1 83 ILE H . . 4.320 3.714 3.446 3.966 . 0 0 "[ . 1 . 2]" 1
706 1 38 ILE HB 1 38 ILE MD . . 3.130 2.219 2.152 2.294 . 0 0 "[ . 1 . 2]" 1
707 1 38 ILE HB 1 39 VAL H . . 4.600 4.143 3.914 4.303 . 0 0 "[ . 1 . 2]" 1
708 1 38 ILE HB 1 40 ASN QD . . 4.830 3.481 2.935 3.960 . 0 0 "[ . 1 . 2]" 1
709 1 38 ILE MD 1 82 GLN HA . . 4.610 4.347 4.013 4.598 . 0 0 "[ . 1 . 2]" 1
710 1 38 ILE MD 1 82 GLN QB . . 4.800 4.551 3.986 4.803 0.003 19 0 "[ . 1 . 2]" 1
711 1 38 ILE MD 1 82 GLN QE . . 4.930 3.941 2.786 4.925 . 0 0 "[ . 1 . 2]" 1
712 1 38 ILE MD 1 82 GLN HG2 . . 4.480 3.502 2.986 4.405 . 0 0 "[ . 1 . 2]" 1
713 1 38 ILE MD 1 82 GLN QG . . 3.910 3.230 2.893 3.727 . 0 0 "[ . 1 . 2]" 1
714 1 38 ILE MD 1 82 GLN HG3 . . 4.480 4.085 3.412 4.465 . 0 0 "[ . 1 . 2]" 1
715 1 38 ILE HG12 1 38 ILE MG . . 3.300 2.115 1.999 2.245 . 0 0 "[ . 1 . 2]" 1
716 1 38 ILE HG12 1 39 VAL H . . 5.330 5.192 4.936 5.332 0.002 6 0 "[ . 1 . 2]" 1
717 1 38 ILE HG12 1 82 GLN HA . . 5.130 4.700 4.240 5.104 . 0 0 "[ . 1 . 2]" 1
718 1 38 ILE HG12 1 82 GLN QG . . 4.010 2.896 2.628 3.239 . 0 0 "[ . 1 . 2]" 1
719 1 38 ILE HG13 1 39 VAL H . . 4.480 4.377 4.263 4.449 . 0 0 "[ . 1 . 2]" 1
720 1 38 ILE HG13 1 82 GLN QB . . 4.560 3.810 3.168 4.133 . 0 0 "[ . 1 . 2]" 1
721 1 38 ILE HG13 1 82 GLN HG2 . . 4.610 2.392 1.998 3.434 . 0 0 "[ . 1 . 2]" 1
722 1 38 ILE HG13 1 82 GLN QG . . 3.760 2.041 1.880 2.347 . 0 0 "[ . 1 . 2]" 1
723 1 38 ILE HG13 1 82 GLN HG3 . . 4.610 2.581 2.012 3.138 . 0 0 "[ . 1 . 2]" 1
724 1 38 ILE MG 1 39 VAL H . . 3.430 2.458 2.082 2.901 . 0 0 "[ . 1 . 2]" 1
725 1 38 ILE MG 1 40 ASN H . . 4.680 3.861 3.473 4.163 . 0 0 "[ . 1 . 2]" 1
726 1 38 ILE MG 1 40 ASN HD21 . . 3.840 3.377 2.846 3.746 . 0 0 "[ . 1 . 2]" 1
727 1 38 ILE MG 1 40 ASN QD . . 3.370 2.297 2.013 2.707 . 0 0 "[ . 1 . 2]" 1
728 1 38 ILE MG 1 40 ASN HD22 . . 3.840 2.342 2.031 2.778 . 0 0 "[ . 1 . 2]" 1
729 1 38 ILE MG 1 80 THR HB . . 4.110 3.730 3.461 4.005 . 0 0 "[ . 1 . 2]" 1
730 1 38 ILE MG 1 80 THR MG . . 3.850 3.674 3.393 3.848 . 0 0 "[ . 1 . 2]" 1
731 1 38 ILE MG 1 81 HIS H . . 3.640 3.277 2.907 3.544 . 0 0 "[ . 1 . 2]" 1
732 1 38 ILE MG 1 82 GLN H . . 5.500 4.998 4.696 5.243 . 0 0 "[ . 1 . 2]" 1
733 1 38 ILE MG 1 82 GLN HA . . 4.140 3.830 3.535 4.142 0.002 7 0 "[ . 1 . 2]" 1
734 1 38 ILE MG 1 82 GLN QB . . 5.060 4.601 4.211 4.884 . 0 0 "[ . 1 . 2]" 1
735 1 38 ILE MG 1 82 GLN QE . . 4.860 3.280 1.880 4.801 . 0 0 "[ . 1 . 2]" 1
736 1 38 ILE MG 1 82 GLN HG2 . . 4.640 3.759 3.472 4.561 . 0 0 "[ . 1 . 2]" 1
737 1 38 ILE MG 1 82 GLN QG . . 3.860 2.837 2.370 3.346 . 0 0 "[ . 1 . 2]" 1
738 1 38 ILE MG 1 82 GLN HG3 . . 4.640 2.957 2.410 3.524 . 0 0 "[ . 1 . 2]" 1
739 1 39 VAL H 1 39 VAL HB . . 3.640 2.577 2.459 2.690 . 0 0 "[ . 1 . 2]" 1
740 1 39 VAL H 1 39 VAL MG1 . . 3.980 3.817 3.764 3.861 . 0 0 "[ . 1 . 2]" 1
741 1 39 VAL H 1 39 VAL MG2 . . 3.590 2.763 2.437 2.986 . 0 0 "[ . 1 . 2]" 1
742 1 39 VAL H 1 41 TRP HZ3 . . 4.710 4.207 3.853 4.422 . 0 0 "[ . 1 . 2]" 1
743 1 39 VAL H 1 80 THR HA . . 4.720 4.449 4.206 4.731 0.011 20 0 "[ . 1 . 2]" 1
744 1 39 VAL H 1 82 GLN HA . . 4.040 3.874 3.550 4.035 . 0 0 "[ . 1 . 2]" 1
745 1 39 VAL HB 1 40 ASN H . . 4.590 4.353 4.167 4.466 . 0 0 "[ . 1 . 2]" 1
746 1 39 VAL HB 1 41 TRP HE3 . . 5.010 3.688 3.349 3.949 . 0 0 "[ . 1 . 2]" 1
747 1 39 VAL HB 1 41 TRP HH2 . . 5.370 4.913 4.473 5.336 . 0 0 "[ . 1 . 2]" 1
748 1 39 VAL HB 1 41 TRP HZ3 . . 3.730 2.708 2.253 3.087 . 0 0 "[ . 1 . 2]" 1
749 1 39 VAL HB 1 56 ILE MD . . 3.980 2.867 2.605 3.082 . 0 0 "[ . 1 . 2]" 1
750 1 39 VAL HB 1 81 HIS H . . 4.070 3.302 3.133 3.489 . 0 0 "[ . 1 . 2]" 1
751 1 39 VAL HB 1 81 HIS HB2 . . 4.880 4.283 3.807 4.673 . 0 0 "[ . 1 . 2]" 1
752 1 39 VAL HB 1 81 HIS HB3 . . 4.540 3.250 2.754 3.583 . 0 0 "[ . 1 . 2]" 1
753 1 39 VAL MG1 1 40 ASN H . . 3.430 2.858 2.527 3.148 . 0 0 "[ . 1 . 2]" 1
754 1 39 VAL MG1 1 40 ASN HA . . 4.450 3.813 3.550 3.974 . 0 0 "[ . 1 . 2]" 1
755 1 39 VAL MG1 1 40 ASN HB2 . . 5.210 4.837 4.626 4.963 . 0 0 "[ . 1 . 2]" 1
756 1 39 VAL MG1 1 41 TRP HA . . 5.240 4.956 4.534 5.120 . 0 0 "[ . 1 . 2]" 1
757 1 39 VAL MG1 1 41 TRP HB3 . . 4.330 3.441 3.133 3.645 . 0 0 "[ . 1 . 2]" 1
758 1 39 VAL MG1 1 41 TRP HE3 . . 3.180 2.114 1.962 2.339 . 0 0 "[ . 1 . 2]" 1
759 1 39 VAL MG1 1 41 TRP HZ3 . . 3.530 2.770 2.163 3.119 . 0 0 "[ . 1 . 2]" 1
760 1 39 VAL MG1 1 56 ILE MD . . 3.380 2.881 2.251 3.222 . 0 0 "[ . 1 . 2]" 1
761 1 39 VAL MG1 1 80 THR HA . . 5.490 4.383 4.194 4.564 . 0 0 "[ . 1 . 2]" 1
762 1 39 VAL MG1 1 81 HIS H . . 4.390 4.224 3.930 4.387 . 0 0 "[ . 1 . 2]" 1
763 1 39 VAL MG1 1 81 HIS HB3 . . 5.500 4.449 3.950 4.864 . 0 0 "[ . 1 . 2]" 1
764 1 39 VAL MG1 1 94 PHE QD . . 4.840 4.507 4.100 4.831 . 0 0 "[ . 1 . 2]" 1
765 1 39 VAL MG1 1 96 ILE MD . . 3.260 2.134 1.800 2.420 . 0 0 "[ . 1 . 2]" 1
766 1 39 VAL MG2 1 40 ASN H . . 4.150 4.103 3.998 4.168 0.018 8 0 "[ . 1 . 2]" 1
767 1 39 VAL MG2 1 41 TRP HE3 . . 5.010 4.692 4.450 4.893 . 0 0 "[ . 1 . 2]" 1
768 1 39 VAL MG2 1 41 TRP HZ3 . . 4.650 4.282 3.925 4.616 . 0 0 "[ . 1 . 2]" 1
769 1 39 VAL MG2 1 56 ILE MD . . 3.630 3.465 3.136 3.624 . 0 0 "[ . 1 . 2]" 1
770 1 39 VAL MG2 1 56 ILE MG . . 3.730 3.480 3.128 3.733 0.003 7 0 "[ . 1 . 2]" 1
771 1 39 VAL MG2 1 81 HIS H . . 4.630 4.515 4.384 4.632 0.002 19 0 "[ . 1 . 2]" 1
772 1 39 VAL MG2 1 81 HIS HB3 . . 4.580 4.000 3.532 4.352 . 0 0 "[ . 1 . 2]" 1
773 1 39 VAL MG2 1 83 ILE MD . . 3.450 2.985 2.629 3.452 0.002 13 0 "[ . 1 . 2]" 1
774 1 39 VAL MG2 1 83 ILE HG13 . . 4.530 4.093 3.702 4.485 . 0 0 "[ . 1 . 2]" 1
775 1 39 VAL MG2 1 94 PHE QD . . 4.480 3.431 2.933 3.773 . 0 0 "[ . 1 . 2]" 1
776 1 39 VAL MG2 1 94 PHE QE . . 4.490 3.957 3.357 4.304 . 0 0 "[ . 1 . 2]" 1
777 1 39 VAL MG2 1 96 ILE MD . . 4.280 4.156 3.776 4.281 0.001 19 0 "[ . 1 . 2]" 1
778 1 40 ASN H 1 40 ASN HB2 . . 3.520 2.742 2.567 2.891 . 0 0 "[ . 1 . 2]" 1
779 1 40 ASN H 1 40 ASN QD . . 4.400 2.890 1.860 4.114 . 0 0 "[ . 1 . 2]" 1
780 1 40 ASN H 1 41 TRP H . . 4.600 4.526 4.405 4.583 . 0 0 "[ . 1 . 2]" 1
781 1 40 ASN H 1 41 TRP HE3 . . 4.380 4.048 3.681 4.316 . 0 0 "[ . 1 . 2]" 1
782 1 40 ASN HA 1 41 TRP H . . 2.940 2.301 2.140 2.436 . 0 0 "[ . 1 . 2]" 1
783 1 40 ASN HA 1 41 TRP HE3 . . 4.160 3.147 2.758 3.396 . 0 0 "[ . 1 . 2]" 1
784 1 40 ASN HA 1 41 TRP HZ3 . . 4.510 4.138 3.584 4.437 . 0 0 "[ . 1 . 2]" 1
785 1 40 ASN HA 1 80 THR HA . . 3.580 2.624 2.309 3.067 . 0 0 "[ . 1 . 2]" 1
786 1 40 ASN HA 1 80 THR HB . . 4.270 2.939 2.507 3.223 . 0 0 "[ . 1 . 2]" 1
787 1 40 ASN HA 1 80 THR MG . . 4.690 4.460 4.124 4.638 . 0 0 "[ . 1 . 2]" 1
788 1 40 ASN HA 1 81 HIS H . . 4.420 4.117 3.826 4.369 . 0 0 "[ . 1 . 2]" 1
789 1 40 ASN HB2 1 40 ASN QD . . 3.410 2.603 2.117 3.303 . 0 0 "[ . 1 . 2]" 1
790 1 40 ASN HB2 1 40 ASN HD22 . . 4.020 3.683 3.443 4.066 0.046 16 0 "[ . 1 . 2]" 1
791 1 40 ASN HB2 1 41 TRP HA . . 5.460 4.307 4.048 4.636 . 0 0 "[ . 1 . 2]" 1
792 1 40 ASN HB3 1 41 TRP H . . 3.510 2.826 2.438 3.442 . 0 0 "[ . 1 . 2]" 1
793 1 40 ASN HB3 1 41 TRP HA . . 5.500 4.545 4.290 4.836 . 0 0 "[ . 1 . 2]" 1
794 1 40 ASN HB3 1 80 THR MG . . 5.180 4.978 4.469 5.178 . 0 0 "[ . 1 . 2]" 1
795 1 40 ASN QD 1 80 THR MG . . 5.340 4.829 3.912 5.341 0.001 8 0 "[ . 1 . 2]" 1
796 1 41 TRP H 1 41 TRP HE3 . . 4.050 3.475 2.834 3.790 . 0 0 "[ . 1 . 2]" 1
797 1 41 TRP H 1 79 LEU HB2 . . 4.350 3.873 3.215 4.347 . 0 0 "[ . 1 . 2]" 1
798 1 41 TRP H 1 79 LEU QB . . 3.640 3.035 2.798 3.345 . 0 0 "[ . 1 . 2]" 1
799 1 41 TRP H 1 79 LEU HB3 . . 4.350 3.195 2.953 3.479 . 0 0 "[ . 1 . 2]" 1
800 1 41 TRP H 1 79 LEU MD2 . . 5.040 4.740 4.356 4.974 . 0 0 "[ . 1 . 2]" 1
801 1 41 TRP H 1 80 THR HB . . 4.910 4.194 3.851 4.571 . 0 0 "[ . 1 . 2]" 1
802 1 41 TRP HA 1 42 GLN H . . 3.220 2.599 2.496 2.650 . 0 0 "[ . 1 . 2]" 1
803 1 41 TRP HB2 1 42 GLN H . . 3.400 2.125 2.041 2.301 . 0 0 "[ . 1 . 2]" 1
804 1 41 TRP HB2 1 96 ILE MD . . 4.460 2.664 2.292 3.090 . 0 0 "[ . 1 . 2]" 1
805 1 41 TRP HB3 1 42 GLN H . . 3.850 3.630 3.574 3.747 . 0 0 "[ . 1 . 2]" 1
806 1 41 TRP HB3 1 96 ILE MD . . 4.250 1.985 1.844 2.235 . 0 0 "[ . 1 . 2]" 1
807 1 41 TRP HD1 1 42 GLN H . . 4.240 2.803 2.569 3.042 . 0 0 "[ . 1 . 2]" 1
808 1 41 TRP HD1 1 43 PRO HA . . 4.930 4.077 3.929 4.187 . 0 0 "[ . 1 . 2]" 1
809 1 41 TRP HD1 1 79 LEU QB . . 4.550 3.602 3.082 4.141 . 0 0 "[ . 1 . 2]" 1
810 1 41 TRP HD1 1 79 LEU MD1 . . 5.470 4.520 4.143 4.747 . 0 0 "[ . 1 . 2]" 1
811 1 41 TRP HD1 1 79 LEU MD2 . . 3.840 2.897 2.605 3.342 . 0 0 "[ . 1 . 2]" 1
812 1 41 TRP HE1 1 54 TYR HB3 . . 4.670 3.578 3.049 4.067 . 0 0 "[ . 1 . 2]" 1
813 1 41 TRP HE1 1 79 LEU HA . . 4.140 2.661 2.297 2.883 . 0 0 "[ . 1 . 2]" 1
814 1 41 TRP HE1 1 79 LEU QB . . 5.290 3.631 3.116 4.210 . 0 0 "[ . 1 . 2]" 1
815 1 41 TRP HE1 1 79 LEU MD1 . . 4.880 4.828 4.555 4.884 0.004 16 0 "[ . 1 . 2]" 1
816 1 41 TRP HE1 1 79 LEU MD2 . . 3.530 2.436 2.058 2.784 . 0 0 "[ . 1 . 2]" 1
817 1 41 TRP HE3 1 56 ILE MD . . 4.410 3.737 3.287 4.154 . 0 0 "[ . 1 . 2]" 1
818 1 41 TRP HE3 1 81 HIS H . . 4.910 4.399 4.036 4.725 . 0 0 "[ . 1 . 2]" 1
819 1 41 TRP HE3 1 96 ILE MD . . 3.990 2.612 1.970 3.212 . 0 0 "[ . 1 . 2]" 1
820 1 41 TRP HE3 1 96 ILE MG . . 4.770 3.796 3.204 4.178 . 0 0 "[ . 1 . 2]" 1
821 1 41 TRP HH2 1 56 ILE MD . . 4.070 2.192 1.970 2.338 . 0 0 "[ . 1 . 2]" 1
822 1 41 TRP HH2 1 74 VAL MG1 . . 3.470 3.093 2.772 3.398 . 0 0 "[ . 1 . 2]" 1
823 1 41 TRP HH2 1 74 VAL MG2 . . 3.500 2.151 1.963 2.575 . 0 0 "[ . 1 . 2]" 1
824 1 41 TRP HH2 1 81 HIS H . . 4.950 3.778 3.483 4.109 . 0 0 "[ . 1 . 2]" 1
825 1 41 TRP HH2 1 81 HIS HB2 . . 3.760 2.261 2.018 2.422 . 0 0 "[ . 1 . 2]" 1
826 1 41 TRP HH2 1 81 HIS HB3 . . 3.910 3.695 3.272 3.904 . 0 0 "[ . 1 . 2]" 1
827 1 41 TRP HH2 1 96 ILE MG . . 5.500 4.636 4.120 5.010 . 0 0 "[ . 1 . 2]" 1
828 1 41 TRP HZ2 1 54 TYR HB2 . . 4.460 2.402 2.126 2.694 . 0 0 "[ . 1 . 2]" 1
829 1 41 TRP HZ2 1 54 TYR HB3 . . 4.540 3.462 2.716 3.887 . 0 0 "[ . 1 . 2]" 1
830 1 41 TRP HZ2 1 74 VAL MG1 . . 3.480 3.135 2.519 3.483 0.003 13 0 "[ . 1 . 2]" 1
831 1 41 TRP HZ2 1 74 VAL MG2 . . 4.020 2.787 2.090 3.356 . 0 0 "[ . 1 . 2]" 1
832 1 41 TRP HZ2 1 79 LEU H . . 5.210 5.008 4.728 5.211 0.001 4 0 "[ . 1 . 2]" 1
833 1 41 TRP HZ2 1 79 LEU HA . . 4.390 2.773 2.474 3.136 . 0 0 "[ . 1 . 2]" 1
834 1 41 TRP HZ2 1 79 LEU MD2 . . 4.560 4.012 3.677 4.336 . 0 0 "[ . 1 . 2]" 1
835 1 41 TRP HZ2 1 80 THR H . . 4.830 4.285 3.945 4.592 . 0 0 "[ . 1 . 2]" 1
836 1 41 TRP HZ2 1 81 HIS HB2 . . 4.760 4.644 4.334 4.759 . 0 0 "[ . 1 . 2]" 1
837 1 41 TRP HZ3 1 56 ILE MD . . 3.690 2.168 1.936 2.463 . 0 0 "[ . 1 . 2]" 1
838 1 41 TRP HZ3 1 80 THR HA . . 4.340 2.862 2.455 3.377 . 0 0 "[ . 1 . 2]" 1
839 1 41 TRP HZ3 1 81 HIS H . . 3.590 2.654 2.316 3.235 . 0 0 "[ . 1 . 2]" 1
840 1 41 TRP HZ3 1 81 HIS HB3 . . 3.910 3.194 2.894 3.681 . 0 0 "[ . 1 . 2]" 1
841 1 41 TRP HZ3 1 96 ILE MG . . 5.250 4.562 4.017 5.065 . 0 0 "[ . 1 . 2]" 1
842 1 42 GLN H 1 42 GLN HB2 . . 3.840 2.756 2.601 3.656 . 0 0 "[ . 1 . 2]" 1
843 1 42 GLN H 1 42 GLN QB . . 3.310 2.650 2.549 2.716 . 0 0 "[ . 1 . 2]" 1
844 1 42 GLN H 1 42 GLN HB3 . . 3.840 3.713 2.699 3.851 0.011 10 0 "[ . 1 . 2]" 1
845 1 42 GLN H 1 42 GLN HG2 . . 4.520 3.812 3.235 4.319 . 0 0 "[ . 1 . 2]" 1
846 1 42 GLN H 1 42 GLN HG3 . . 4.520 4.179 3.778 4.521 0.001 19 0 "[ . 1 . 2]" 1
847 1 42 GLN QB 1 43 PRO HD2 . . 3.630 2.062 1.989 2.947 . 0 0 "[ . 1 . 2]" 1
848 1 42 GLN QB 1 43 PRO HD3 . . 4.070 3.410 3.359 3.915 . 0 0 "[ . 1 . 2]" 1
849 1 42 GLN HB2 1 43 PRO HD2 . . 4.200 3.586 3.028 3.702 . 0 0 "[ . 1 . 2]" 1
850 1 42 GLN HB2 1 43 PRO HD3 . . 4.820 4.665 4.103 4.751 . 0 0 "[ . 1 . 2]" 1
851 1 42 GLN HB3 1 43 PRO HD2 . . 4.200 2.126 1.999 4.046 . 0 0 "[ . 1 . 2]" 1
852 1 42 GLN HB3 1 43 PRO HD3 . . 4.820 3.543 3.443 4.949 0.129 15 0 "[ . 1 . 2]" 1
853 1 42 GLN QE 1 79 LEU MD1 . . 3.860 2.909 2.058 3.733 . 0 0 "[ . 1 . 2]" 1
854 1 42 GLN HE21 1 79 LEU MD1 . . 4.550 3.395 2.826 4.506 . 0 0 "[ . 1 . 2]" 1
855 1 42 GLN HE22 1 79 LEU MD1 . . 4.550 3.689 2.089 4.545 . 0 0 "[ . 1 . 2]" 1
856 1 42 GLN QG 1 43 PRO HD2 . . 3.960 3.141 1.964 3.795 . 0 0 "[ . 1 . 2]" 1
857 1 42 GLN QG 1 79 LEU MD1 . . 4.720 3.102 2.135 4.224 . 0 0 "[ . 1 . 2]" 1
858 1 42 GLN HG2 1 43 PRO HD2 . . 4.580 3.508 2.653 4.371 . 0 0 "[ . 1 . 2]" 1
859 1 42 GLN HG3 1 43 PRO HD2 . . 4.580 3.944 1.972 4.287 . 0 0 "[ . 1 . 2]" 1
860 1 43 PRO HA 1 44 PRO QD . . 3.290 2.035 1.975 2.129 . 0 0 "[ . 1 . 2]" 1
861 1 43 PRO HA 1 44 PRO HG2 . . 4.630 4.429 4.338 4.565 . 0 0 "[ . 1 . 2]" 1
862 1 43 PRO HA 1 44 PRO HG3 . . 4.630 4.419 4.365 4.515 . 0 0 "[ . 1 . 2]" 1
863 1 43 PRO HA 1 51 ILE MD . . 4.790 4.539 4.232 4.794 0.004 15 0 "[ . 1 . 2]" 1
864 1 43 PRO HA 1 51 ILE HG13 . . 5.500 4.502 3.999 5.117 . 0 0 "[ . 1 . 2]" 1
865 1 43 PRO HA 1 51 ILE MG . . 5.240 4.643 4.174 5.191 . 0 0 "[ . 1 . 2]" 1
866 1 43 PRO HA 1 79 LEU MD2 . . 4.530 3.895 3.519 4.324 . 0 0 "[ . 1 . 2]" 1
867 1 43 PRO HA 1 98 ALA MB . . 4.440 3.696 3.478 3.962 . 0 0 "[ . 1 . 2]" 1
868 1 43 PRO QB 1 44 PRO QD . . 3.370 2.432 2.132 2.635 . 0 0 "[ . 1 . 2]" 1
869 1 43 PRO QB 1 51 ILE HG13 . . 4.410 2.862 2.426 3.127 . 0 0 "[ . 1 . 2]" 1
870 1 43 PRO QB 1 51 ILE MG . . 4.480 3.613 3.059 3.925 . 0 0 "[ . 1 . 2]" 1
871 1 43 PRO QB 1 54 TYR HH . . 4.420 2.507 1.990 3.212 . 0 0 "[ . 1 . 2]" 1
872 1 43 PRO QB 1 79 LEU MD1 . . 5.060 4.383 4.079 4.653 . 0 0 "[ . 1 . 2]" 1
873 1 43 PRO QB 1 79 LEU MD2 . . 3.910 3.254 2.990 3.449 . 0 0 "[ . 1 . 2]" 1
874 1 43 PRO HD2 1 79 LEU MD1 . . 3.830 2.974 2.491 3.329 . 0 0 "[ . 1 . 2]" 1
875 1 43 PRO HD2 1 79 LEU MD2 . . 3.930 3.472 3.181 3.770 . 0 0 "[ . 1 . 2]" 1
876 1 43 PRO HD3 1 79 LEU MD1 . . 3.580 2.245 1.965 2.528 . 0 0 "[ . 1 . 2]" 1
877 1 43 PRO HD3 1 79 LEU MD2 . . 3.590 2.028 1.888 2.302 . 0 0 "[ . 1 . 2]" 1
878 1 43 PRO QG 1 51 ILE HG13 . . 4.530 4.412 4.063 4.532 0.002 16 0 "[ . 1 . 2]" 1
879 1 43 PRO QG 1 54 TYR HH . . 4.620 3.708 3.105 4.178 . 0 0 "[ . 1 . 2]" 1
880 1 43 PRO QG 1 79 LEU MD1 . . 3.680 3.425 2.926 3.670 . 0 0 "[ . 1 . 2]" 1
881 1 43 PRO QG 1 79 LEU MD2 . . 3.490 3.210 2.732 3.452 . 0 0 "[ . 1 . 2]" 1
882 1 44 PRO HA 1 46 GLU H . . 4.600 4.069 3.746 4.450 . 0 0 "[ . 1 . 2]" 1
883 1 44 PRO QB 1 46 GLU H . . 4.060 2.672 2.186 3.017 . 0 0 "[ . 1 . 2]" 1
884 1 44 PRO QD 1 51 ILE MD . . 3.510 3.001 2.477 3.422 . 0 0 "[ . 1 . 2]" 1
885 1 44 PRO QD 1 51 ILE HG13 . . 4.420 3.489 2.728 4.384 . 0 0 "[ . 1 . 2]" 1
886 1 44 PRO QD 1 98 ALA MB . . 4.150 2.631 2.356 2.891 . 0 0 "[ . 1 . 2]" 1
887 1 44 PRO QG 1 47 ALA HA . . 3.880 3.137 2.653 3.670 . 0 0 "[ . 1 . 2]" 1
888 1 44 PRO QG 1 47 ALA MB . . 4.020 3.364 2.257 3.953 . 0 0 "[ . 1 . 2]" 1
889 1 44 PRO QG 1 51 ILE MD . . 4.020 3.261 2.708 3.959 . 0 0 "[ . 1 . 2]" 1
890 1 44 PRO QG 1 98 ALA MB . . 3.150 2.922 2.557 3.152 0.002 7 0 "[ . 1 . 2]" 1
891 1 45 SER H 1 46 GLU H . . 4.440 2.694 2.346 2.914 . 0 0 "[ . 1 . 2]" 1
892 1 45 SER QB 1 46 GLU H . . 3.810 2.761 2.286 3.616 . 0 0 "[ . 1 . 2]" 1
893 1 45 SER QB 1 46 GLU QG . . 4.190 3.562 2.971 4.191 0.001 13 0 "[ . 1 . 2]" 1
894 1 45 SER HB2 1 46 GLU H . . 4.490 3.576 2.790 4.146 . 0 0 "[ . 1 . 2]" 1
895 1 45 SER HB3 1 46 GLU H . . 4.490 3.061 2.312 4.226 . 0 0 "[ . 1 . 2]" 1
896 1 46 GLU H 1 46 GLU HB2 . . 4.140 2.367 2.220 2.595 . 0 0 "[ . 1 . 2]" 1
897 1 46 GLU H 1 46 GLU QB . . 3.630 2.335 2.197 2.538 . 0 0 "[ . 1 . 2]" 1
898 1 46 GLU H 1 46 GLU HB3 . . 4.140 3.580 3.502 3.684 . 0 0 "[ . 1 . 2]" 1
899 1 46 GLU H 1 46 GLU QG . . 3.740 2.705 2.099 3.572 . 0 0 "[ . 1 . 2]" 1
900 1 46 GLU HA 1 47 ALA MB . . 4.850 4.293 4.146 4.440 . 0 0 "[ . 1 . 2]" 1
901 1 46 GLU HA 1 48 ASN H . . 4.520 4.163 3.344 4.527 0.007 18 0 "[ . 1 . 2]" 1
902 1 46 GLU QB 1 48 ASN QD . . 3.940 2.936 1.883 3.937 . 0 0 "[ . 1 . 2]" 1
903 1 47 ALA H 1 47 ALA MB . . 3.200 2.432 2.120 2.733 . 0 0 "[ . 1 . 2]" 1
904 1 47 ALA H 1 48 ASN H . . 3.590 3.241 2.779 3.593 0.003 2 0 "[ . 1 . 2]" 1
905 1 47 ALA HA 1 49 GLY H . . 3.860 3.429 3.080 3.895 0.035 17 0 "[ . 1 . 2]" 1
906 1 47 ALA HA 1 51 ILE MD . . 3.970 3.309 2.639 3.804 . 0 0 "[ . 1 . 2]" 1
907 1 47 ALA MB 1 48 ASN H . . 3.850 3.557 2.536 3.720 . 0 0 "[ . 1 . 2]" 1
908 1 47 ALA MB 1 48 ASN HA . . 5.220 4.470 4.094 4.666 . 0 0 "[ . 1 . 2]" 1
909 1 47 ALA MB 1 49 GLY H . . 3.710 3.299 2.269 3.645 . 0 0 "[ . 1 . 2]" 1
910 1 48 ASN H 1 49 GLY H . . 3.680 3.044 2.871 3.489 . 0 0 "[ . 1 . 2]" 1
911 1 48 ASN HA 1 49 GLY H . . 3.500 3.258 2.642 3.537 0.037 16 0 "[ . 1 . 2]" 1
912 1 48 ASN QB 1 48 ASN HD22 . . 3.730 3.228 3.213 3.305 . 0 0 "[ . 1 . 2]" 1
913 1 48 ASN QB 1 49 GLY H . . 4.510 3.169 2.582 3.919 . 0 0 "[ . 1 . 2]" 1
914 1 48 ASN QB 1 100 ASN HD21 . . 5.500 4.948 3.910 5.453 . 0 0 "[ . 1 . 2]" 1
915 1 48 ASN QB 1 100 ASN QD . . 4.660 4.270 3.383 4.675 0.015 11 0 "[ . 1 . 2]" 1
916 1 48 ASN QB 1 100 ASN HD22 . . 5.500 4.674 3.704 5.205 . 0 0 "[ . 1 . 2]" 1
917 1 49 GLY H 1 50 LYS H . . 4.910 4.189 3.326 4.467 . 0 0 "[ . 1 . 2]" 1
918 1 49 GLY HA2 1 50 LYS QB . . 4.680 4.220 4.085 4.626 . 0 0 "[ . 1 . 2]" 1
919 1 49 GLY HA3 1 50 LYS QB . . 4.680 4.523 4.132 4.702 0.022 20 0 "[ . 1 . 2]" 1
920 1 50 LYS H 1 50 LYS QB . . 3.340 2.427 2.137 3.177 . 0 0 "[ . 1 . 2]" 1
921 1 50 LYS H 1 50 LYS HG2 . . 4.820 3.969 1.914 4.707 . 0 0 "[ . 1 . 2]" 1
922 1 50 LYS H 1 50 LYS HG3 . . 4.820 4.217 2.670 4.778 . 0 0 "[ . 1 . 2]" 1
923 1 50 LYS H 1 51 ILE H . . 4.790 4.453 4.149 4.618 . 0 0 "[ . 1 . 2]" 1
924 1 50 LYS HA 1 50 LYS QG . . 3.650 2.649 2.189 3.448 . 0 0 "[ . 1 . 2]" 1
925 1 50 LYS HA 1 51 ILE H . . 2.900 2.225 2.140 2.636 . 0 0 "[ . 1 . 2]" 1
926 1 50 LYS HA 1 51 ILE HG12 . . 4.790 3.573 3.140 3.898 . 0 0 "[ . 1 . 2]" 1
927 1 50 LYS QB 1 51 ILE H . . 3.880 3.436 1.985 3.887 0.007 19 0 "[ . 1 . 2]" 1
928 1 50 LYS QB 1 52 THR MG . . 4.090 3.882 3.560 4.098 0.008 1 0 "[ . 1 . 2]" 1
929 1 50 LYS QG 1 51 ILE H . . 3.920 2.987 2.302 3.896 . 0 0 "[ . 1 . 2]" 1
930 1 50 LYS QG 1 52 THR MG . . 4.380 3.541 2.433 4.358 . 0 0 "[ . 1 . 2]" 1
931 1 50 LYS HG2 1 51 ILE H . . 4.590 3.662 2.492 4.593 0.003 14 0 "[ . 1 . 2]" 1
932 1 50 LYS HG3 1 51 ILE H . . 4.590 3.370 2.316 4.224 . 0 0 "[ . 1 . 2]" 1
933 1 51 ILE H 1 51 ILE HB . . 3.170 2.640 2.469 2.863 . 0 0 "[ . 1 . 2]" 1
934 1 51 ILE H 1 51 ILE HG12 . . 3.610 2.187 1.912 2.913 . 0 0 "[ . 1 . 2]" 1
935 1 51 ILE H 1 51 ILE HG13 . . 4.720 3.646 3.362 4.276 . 0 0 "[ . 1 . 2]" 1
936 1 51 ILE H 1 51 ILE MG . . 4.090 3.799 3.765 3.944 . 0 0 "[ . 1 . 2]" 1
937 1 51 ILE H 1 52 THR H . . 4.710 4.494 4.222 4.620 . 0 0 "[ . 1 . 2]" 1
938 1 51 ILE HA 1 51 ILE MD . . 3.290 2.142 1.975 2.317 . 0 0 "[ . 1 . 2]" 1
939 1 51 ILE HA 1 51 ILE MG . . 3.340 2.256 2.167 2.355 . 0 0 "[ . 1 . 2]" 1
940 1 51 ILE HA 1 52 THR H . . 3.210 2.184 2.139 2.256 . 0 0 "[ . 1 . 2]" 1
941 1 51 ILE HA 1 52 THR MG . . 4.670 3.647 3.290 4.151 . 0 0 "[ . 1 . 2]" 1
942 1 51 ILE HA 1 53 GLY H . . 4.140 3.835 3.388 4.056 . 0 0 "[ . 1 . 2]" 1
943 1 51 ILE HA 1 100 ASN HA . . 4.010 3.023 2.457 3.494 . 0 0 "[ . 1 . 2]" 1
944 1 51 ILE HA 1 100 ASN HB2 . . 4.540 3.953 3.331 4.557 0.017 19 0 "[ . 1 . 2]" 1
945 1 51 ILE HA 1 100 ASN QB . . 3.990 2.749 2.129 3.469 . 0 0 "[ . 1 . 2]" 1
946 1 51 ILE HA 1 100 ASN HB3 . . 4.540 2.808 2.154 3.600 . 0 0 "[ . 1 . 2]" 1
947 1 51 ILE HB 1 77 ASN QB . . 5.300 4.574 3.861 5.305 0.005 19 0 "[ . 1 . 2]" 1
948 1 51 ILE MD 1 52 THR H . . 4.250 3.706 3.296 3.957 . 0 0 "[ . 1 . 2]" 1
949 1 51 ILE MD 1 53 GLY H . . 4.760 4.529 4.167 4.738 . 0 0 "[ . 1 . 2]" 1
950 1 51 ILE MD 1 54 TYR HH . . 4.740 4.076 3.003 4.734 . 0 0 "[ . 1 . 2]" 1
951 1 51 ILE MD 1 98 ALA MB . . 3.180 2.467 2.082 2.851 . 0 0 "[ . 1 . 2]" 1
952 1 51 ILE MD 1 99 ARG H . . 4.600 3.766 3.180 4.228 . 0 0 "[ . 1 . 2]" 1
953 1 51 ILE MD 1 100 ASN H . . 5.210 4.601 4.199 4.882 . 0 0 "[ . 1 . 2]" 1
954 1 51 ILE MD 1 100 ASN HA . . 4.620 4.061 3.637 4.401 . 0 0 "[ . 1 . 2]" 1
955 1 51 ILE MD 1 100 ASN HB2 . . 4.660 4.346 3.872 4.665 0.005 15 0 "[ . 1 . 2]" 1
956 1 51 ILE MD 1 100 ASN QB . . 3.950 3.092 2.456 3.958 0.008 16 0 "[ . 1 . 2]" 1
957 1 51 ILE MD 1 100 ASN HB3 . . 4.660 3.205 2.480 4.343 . 0 0 "[ . 1 . 2]" 1
958 1 51 ILE MD 1 100 ASN HD21 . . 4.980 3.844 3.383 4.222 . 0 0 "[ . 1 . 2]" 1
959 1 51 ILE MD 1 100 ASN QD . . 4.150 3.338 2.020 3.982 . 0 0 "[ . 1 . 2]" 1
960 1 51 ILE MD 1 100 ASN HD22 . . 4.980 4.103 2.033 4.981 0.001 7 0 "[ . 1 . 2]" 1
961 1 51 ILE HG13 1 51 ILE MG . . 3.500 2.342 2.075 2.489 . 0 0 "[ . 1 . 2]" 1
962 1 51 ILE MG 1 52 THR H . . 3.570 2.417 1.906 3.037 . 0 0 "[ . 1 . 2]" 1
963 1 51 ILE MG 1 52 THR MG . . 4.650 4.263 3.942 4.643 . 0 0 "[ . 1 . 2]" 1
964 1 51 ILE MG 1 53 GLY H . . 3.140 2.500 2.181 2.819 . 0 0 "[ . 1 . 2]" 1
965 1 51 ILE MG 1 54 TYR HH . . 4.210 2.466 1.905 3.280 . 0 0 "[ . 1 . 2]" 1
966 1 51 ILE MG 1 77 ASN HA . . 4.540 4.098 3.392 4.532 . 0 0 "[ . 1 . 2]" 1
967 1 51 ILE MG 1 98 ALA MB . . 3.690 2.808 2.249 3.648 . 0 0 "[ . 1 . 2]" 1
968 1 51 ILE MG 1 99 ARG H . . 3.710 3.153 2.631 3.697 . 0 0 "[ . 1 . 2]" 1
969 1 51 ILE MG 1 100 ASN HA . . 4.720 3.866 3.514 4.197 . 0 0 "[ . 1 . 2]" 1
970 1 51 ILE MG 1 100 ASN QB . . 5.280 4.136 3.581 4.820 . 0 0 "[ . 1 . 2]" 1
971 1 52 THR H 1 52 THR MG . . 3.680 2.619 1.867 3.118 . 0 0 "[ . 1 . 2]" 1
972 1 52 THR H 1 53 GLY H . . 3.040 2.104 1.798 2.589 . 0 0 "[ . 1 . 2]" 1
973 1 52 THR H 1 99 ARG H . . 5.380 4.559 4.006 5.200 . 0 0 "[ . 1 . 2]" 1
974 1 52 THR H 1 100 ASN HA . . 3.480 2.305 1.889 2.745 . 0 0 "[ . 1 . 2]" 1
975 1 52 THR H 1 100 ASN HB2 . . 4.630 4.443 3.960 4.651 0.021 16 0 "[ . 1 . 2]" 1
976 1 52 THR H 1 100 ASN QB . . 4.050 3.471 3.182 3.812 . 0 0 "[ . 1 . 2]" 1
977 1 52 THR H 1 100 ASN HB3 . . 4.630 3.639 3.247 4.079 . 0 0 "[ . 1 . 2]" 1
978 1 52 THR HA 1 52 THR MG . . 3.050 2.417 2.147 3.160 0.110 10 0 "[ . 1 . 2]" 1
979 1 52 THR MG 1 53 GLY H . . 4.260 3.856 2.921 4.220 . 0 0 "[ . 1 . 2]" 1
980 1 52 THR MG 1 100 ASN HA . . 3.800 2.607 2.027 3.144 . 0 0 "[ . 1 . 2]" 1
981 1 52 THR MG 1 101 SER HA . . 4.230 2.867 2.259 3.649 . 0 0 "[ . 1 . 2]" 1
982 1 52 THR MG 1 101 SER QB . . 4.170 3.069 2.157 3.946 . 0 0 "[ . 1 . 2]" 1
983 1 53 GLY H 1 54 TYR H . . 4.580 4.347 4.232 4.394 . 0 0 "[ . 1 . 2]" 1
984 1 53 GLY H 1 98 ALA MB . . 5.500 5.288 4.758 5.501 0.001 1 0 "[ . 1 . 2]" 1
985 1 53 GLY H 1 99 ARG H . . 4.070 3.768 3.251 4.028 . 0 0 "[ . 1 . 2]" 1
986 1 53 GLY H 1 99 ARG QG . . 4.150 3.484 2.658 4.163 0.013 10 0 "[ . 1 . 2]" 1
987 1 53 GLY H 1 100 ASN HA . . 4.130 3.660 3.350 4.028 . 0 0 "[ . 1 . 2]" 1
988 1 53 GLY QA 1 75 VAL HA . . 4.700 4.318 3.289 4.694 . 0 0 "[ . 1 . 2]" 1
989 1 53 GLY QA 1 99 ARG QG . . 5.030 4.016 3.396 4.825 . 0 0 "[ . 1 . 2]" 1
990 1 53 GLY HA2 1 54 TYR H . . 3.240 2.647 2.180 2.884 . 0 0 "[ . 1 . 2]" 1
991 1 53 GLY HA3 1 54 TYR H . . 3.240 2.495 2.288 3.078 . 0 0 "[ . 1 . 2]" 1
992 1 54 TYR H 1 54 TYR HB2 . . 3.840 2.905 2.714 3.147 . 0 0 "[ . 1 . 2]" 1
993 1 54 TYR H 1 74 VAL H . . 3.950 3.215 3.048 3.400 . 0 0 "[ . 1 . 2]" 1
994 1 54 TYR H 1 74 VAL HB . . 3.430 2.637 2.327 2.838 . 0 0 "[ . 1 . 2]" 1
995 1 54 TYR H 1 74 VAL MG1 . . 4.030 3.878 3.644 4.029 . 0 0 "[ . 1 . 2]" 1
996 1 54 TYR H 1 74 VAL MG2 . . 4.100 3.942 3.549 4.101 0.001 15 0 "[ . 1 . 2]" 1
997 1 54 TYR H 1 75 VAL HA . . 5.470 5.145 4.283 5.421 . 0 0 "[ . 1 . 2]" 1
998 1 54 TYR H 1 99 ARG H . . 5.500 5.155 4.858 5.437 . 0 0 "[ . 1 . 2]" 1
999 1 54 TYR HA 1 55 ILE H . . 3.200 2.363 2.227 2.536 . 0 0 "[ . 1 . 2]" 1
1000 1 54 TYR HA 1 96 ILE MG . . 5.210 4.919 4.600 5.212 0.002 3 0 "[ . 1 . 2]" 1
1001 1 54 TYR HA 1 98 ALA MB . . 4.510 4.293 4.041 4.526 0.016 2 0 "[ . 1 . 2]" 1
1002 1 54 TYR HA 1 99 ARG H . . 3.770 3.079 2.567 3.480 . 0 0 "[ . 1 . 2]" 1
1003 1 54 TYR HB2 1 55 ILE H . . 4.490 3.572 3.300 3.834 . 0 0 "[ . 1 . 2]" 1
1004 1 54 TYR HB2 1 74 VAL HB . . 3.920 2.762 2.257 2.966 . 0 0 "[ . 1 . 2]" 1
1005 1 54 TYR HB2 1 74 VAL MG1 . . 4.050 3.705 3.412 3.817 . 0 0 "[ . 1 . 2]" 1
1006 1 54 TYR HB2 1 74 VAL MG2 . . 3.830 2.933 2.495 3.264 . 0 0 "[ . 1 . 2]" 1
1007 1 54 TYR HB2 1 96 ILE MG . . 4.650 4.132 3.652 4.586 . 0 0 "[ . 1 . 2]" 1
1008 1 54 TYR HB3 1 55 ILE H . . 3.630 2.578 2.181 2.941 . 0 0 "[ . 1 . 2]" 1
1009 1 54 TYR HB3 1 74 VAL HB . . 4.570 4.394 3.969 4.573 0.003 19 0 "[ . 1 . 2]" 1
1010 1 54 TYR HB3 1 74 VAL MG1 . . 5.260 5.166 4.769 5.265 0.005 9 0 "[ . 1 . 2]" 1
1011 1 54 TYR HB3 1 74 VAL MG2 . . 4.620 4.023 3.421 4.391 . 0 0 "[ . 1 . 2]" 1
1012 1 54 TYR HB3 1 96 ILE MG . . 4.250 3.180 2.826 3.479 . 0 0 "[ . 1 . 2]" 1
1013 1 54 TYR HB3 1 97 GLN H . . 5.310 3.566 3.256 3.995 . 0 0 "[ . 1 . 2]" 1
1014 1 54 TYR HB3 1 99 ARG H . . 5.130 4.855 4.325 5.142 0.012 19 0 "[ . 1 . 2]" 1
1015 1 54 TYR HH 1 79 LEU MD2 . . 3.920 2.678 2.003 3.553 . 0 0 "[ . 1 . 2]" 1
1016 1 55 ILE H 1 55 ILE HB . . 3.700 2.745 2.542 2.895 . 0 0 "[ . 1 . 2]" 1
1017 1 55 ILE H 1 55 ILE HG12 . . 4.420 4.174 3.954 4.460 0.040 19 0 "[ . 1 . 2]" 1
1018 1 55 ILE H 1 55 ILE QG . . 3.710 2.854 2.627 3.226 . 0 0 "[ . 1 . 2]" 1
1019 1 55 ILE H 1 55 ILE HG13 . . 4.420 2.907 2.667 3.310 . 0 0 "[ . 1 . 2]" 1
1020 1 55 ILE H 1 55 ILE MG . . 4.290 3.884 3.709 3.955 . 0 0 "[ . 1 . 2]" 1
1021 1 55 ILE H 1 56 ILE H . . 4.470 4.346 4.119 4.464 . 0 0 "[ . 1 . 2]" 1
1022 1 55 ILE H 1 56 ILE HA . . 4.980 4.807 4.633 4.989 0.009 7 0 "[ . 1 . 2]" 1
1023 1 55 ILE H 1 74 VAL MG2 . . 4.920 4.490 4.101 4.898 . 0 0 "[ . 1 . 2]" 1
1024 1 55 ILE H 1 96 ILE HA . . 5.000 4.814 4.554 5.005 0.005 2 0 "[ . 1 . 2]" 1
1025 1 55 ILE H 1 96 ILE MG . . 4.430 4.051 3.762 4.344 . 0 0 "[ . 1 . 2]" 1
1026 1 55 ILE H 1 97 GLN H . . 3.670 3.121 2.869 3.490 . 0 0 "[ . 1 . 2]" 1
1027 1 55 ILE H 1 97 GLN QB . . 4.450 3.523 2.841 4.245 . 0 0 "[ . 1 . 2]" 1
1028 1 55 ILE H 1 97 GLN QG . . 5.500 3.968 2.058 4.837 . 0 0 "[ . 1 . 2]" 1
1029 1 55 ILE H 1 99 ARG H . . 5.150 4.844 4.022 5.171 0.021 19 0 "[ . 1 . 2]" 1
1030 1 55 ILE HA 1 55 ILE HG12 . . 4.030 2.714 2.595 2.862 . 0 0 "[ . 1 . 2]" 1
1031 1 55 ILE HA 1 55 ILE HG13 . . 4.030 2.850 2.549 3.110 . 0 0 "[ . 1 . 2]" 1
1032 1 55 ILE HA 1 55 ILE MG . . 3.410 2.355 2.234 2.543 . 0 0 "[ . 1 . 2]" 1
1033 1 55 ILE HA 1 56 ILE H . . 3.090 2.186 2.139 2.244 . 0 0 "[ . 1 . 2]" 1
1034 1 55 ILE HA 1 56 ILE HB . . 4.750 4.550 4.450 4.735 . 0 0 "[ . 1 . 2]" 1
1035 1 55 ILE HA 1 71 ILE MG . . 4.760 4.279 4.116 4.518 . 0 0 "[ . 1 . 2]" 1
1036 1 55 ILE HA 1 73 PRO HA . . 3.590 2.462 2.212 2.679 . 0 0 "[ . 1 . 2]" 1
1037 1 55 ILE HA 1 73 PRO HB3 . . 5.010 4.457 4.199 4.776 . 0 0 "[ . 1 . 2]" 1
1038 1 55 ILE HA 1 74 VAL H . . 3.850 3.127 2.891 3.381 . 0 0 "[ . 1 . 2]" 1
1039 1 55 ILE HB 1 55 ILE MD . . 3.380 2.275 2.120 2.383 . 0 0 "[ . 1 . 2]" 1
1040 1 55 ILE HB 1 56 ILE H . . 4.750 4.050 3.879 4.238 . 0 0 "[ . 1 . 2]" 1
1041 1 55 ILE HB 1 57 TYR QE . . 3.690 2.857 2.338 3.481 . 0 0 "[ . 1 . 2]" 1
1042 1 55 ILE HB 1 97 GLN H . . 5.200 4.464 4.024 5.189 . 0 0 "[ . 1 . 2]" 1
1043 1 55 ILE MD 1 55 ILE MG . . 2.860 2.160 1.970 2.399 . 0 0 "[ . 1 . 2]" 1
1044 1 55 ILE MD 1 57 TYR QE . . 4.170 3.688 3.524 4.149 . 0 0 "[ . 1 . 2]" 1
1045 1 55 ILE MD 1 99 ARG HD2 . . 4.180 3.227 1.986 4.019 . 0 0 "[ . 1 . 2]" 1
1046 1 55 ILE MD 1 99 ARG QD . . 3.640 2.206 1.846 3.129 . 0 0 "[ . 1 . 2]" 1
1047 1 55 ILE MD 1 99 ARG HD3 . . 4.180 2.315 1.861 3.590 . 0 0 "[ . 1 . 2]" 1
1048 1 55 ILE MD 1 99 ARG QG . . 4.410 3.610 2.717 4.413 0.003 7 0 "[ . 1 . 2]" 1
1049 1 55 ILE MD 1 104 MET ME . . 3.390 3.056 1.816 3.389 . 0 0 "[ . 1 . 2]" 1
1050 1 55 ILE MD 1 104 MET HG2 . . 4.260 2.729 2.083 3.526 . 0 0 "[ . 1 . 2]" 1
1051 1 55 ILE MD 1 104 MET QG . . 3.540 2.650 2.056 3.370 . 0 0 "[ . 1 . 2]" 1
1052 1 55 ILE MD 1 104 MET HG3 . . 4.260 3.657 2.996 4.283 0.023 19 0 "[ . 1 . 2]" 1
1053 1 55 ILE QG 1 55 ILE MG . . 2.910 2.238 2.179 2.300 . 0 0 "[ . 1 . 2]" 1
1054 1 55 ILE QG 1 56 ILE H . . 4.490 4.087 3.659 4.307 . 0 0 "[ . 1 . 2]" 1
1055 1 55 ILE QG 1 73 PRO HA . . 4.140 2.542 1.931 2.958 . 0 0 "[ . 1 . 2]" 1
1056 1 55 ILE QG 1 73 PRO HB3 . . 4.150 2.999 2.543 3.397 . 0 0 "[ . 1 . 2]" 1
1057 1 55 ILE QG 1 74 VAL H . . 4.740 3.577 3.152 3.889 . 0 0 "[ . 1 . 2]" 1
1058 1 55 ILE HG12 1 55 ILE MG . . 3.420 2.287 2.222 2.359 . 0 0 "[ . 1 . 2]" 1
1059 1 55 ILE HG12 1 73 PRO HB3 . . 4.800 3.048 2.612 3.486 . 0 0 "[ . 1 . 2]" 1
1060 1 55 ILE HG13 1 55 ILE MG . . 3.420 3.178 3.146 3.199 . 0 0 "[ . 1 . 2]" 1
1061 1 55 ILE HG13 1 73 PRO HB3 . . 4.800 4.485 3.498 4.802 0.002 9 0 "[ . 1 . 2]" 1
1062 1 55 ILE MG 1 56 ILE H . . 3.530 2.411 2.023 2.815 . 0 0 "[ . 1 . 2]" 1
1063 1 55 ILE MG 1 56 ILE HA . . 4.340 3.685 3.387 3.946 . 0 0 "[ . 1 . 2]" 1
1064 1 55 ILE MG 1 56 ILE HB . . 4.730 4.428 4.177 4.690 . 0 0 "[ . 1 . 2]" 1
1065 1 55 ILE MG 1 57 TYR QD . . 4.210 3.383 3.222 3.620 . 0 0 "[ . 1 . 2]" 1
1066 1 55 ILE MG 1 57 TYR QE . . 3.730 2.601 2.435 2.782 . 0 0 "[ . 1 . 2]" 1
1067 1 55 ILE MG 1 71 ILE HA . . 4.120 3.113 2.896 3.239 . 0 0 "[ . 1 . 2]" 1
1068 1 55 ILE MG 1 71 ILE HB . . 4.470 4.398 4.266 4.476 0.006 14 0 "[ . 1 . 2]" 1
1069 1 55 ILE MG 1 71 ILE MD . . 4.070 3.994 3.856 4.090 0.020 16 0 "[ . 1 . 2]" 1
1070 1 55 ILE MG 1 71 ILE HG12 . . 4.400 3.442 3.261 3.617 . 0 0 "[ . 1 . 2]" 1
1071 1 55 ILE MG 1 71 ILE HG13 . . 4.820 4.680 4.521 4.823 0.003 13 0 "[ . 1 . 2]" 1
1072 1 55 ILE MG 1 71 ILE MG . . 2.910 1.953 1.830 2.066 . 0 0 "[ . 1 . 2]" 1
1073 1 55 ILE MG 1 72 GLU H . . 3.870 2.793 2.444 3.069 . 0 0 "[ . 1 . 2]" 1
1074 1 55 ILE MG 1 72 GLU HB2 . . 5.120 4.241 3.872 4.530 . 0 0 "[ . 1 . 2]" 1
1075 1 55 ILE MG 1 73 PRO HA . . 4.490 2.989 2.592 3.346 . 0 0 "[ . 1 . 2]" 1
1076 1 55 ILE MG 1 73 PRO HB3 . . 4.290 3.735 3.116 4.218 . 0 0 "[ . 1 . 2]" 1
1077 1 55 ILE MG 1 73 PRO HG3 . . 5.400 4.953 4.336 5.311 . 0 0 "[ . 1 . 2]" 1
1078 1 55 ILE MG 1 74 VAL H . . 4.750 4.549 4.345 4.727 . 0 0 "[ . 1 . 2]" 1
1079 1 55 ILE MG 1 74 VAL MG2 . . 5.260 4.640 4.399 4.827 . 0 0 "[ . 1 . 2]" 1
1080 1 55 ILE MG 1 104 MET ME . . 4.800 4.590 3.508 4.817 0.017 2 0 "[ . 1 . 2]" 1
1081 1 56 ILE H 1 56 ILE HB . . 3.450 2.581 2.478 2.663 . 0 0 "[ . 1 . 2]" 1
1082 1 56 ILE H 1 56 ILE QG . . 3.690 2.774 2.387 2.999 . 0 0 "[ . 1 . 2]" 1
1083 1 56 ILE H 1 56 ILE MG . . 4.120 3.815 3.760 3.852 . 0 0 "[ . 1 . 2]" 1
1084 1 56 ILE H 1 71 ILE MG . . 4.690 4.193 3.820 4.691 0.001 2 0 "[ . 1 . 2]" 1
1085 1 56 ILE H 1 72 GLU H . . 4.170 3.022 2.761 3.438 . 0 0 "[ . 1 . 2]" 1
1086 1 56 ILE H 1 72 GLU HB2 . . 3.950 3.180 2.802 3.459 . 0 0 "[ . 1 . 2]" 1
1087 1 56 ILE H 1 72 GLU HB3 . . 4.440 3.645 3.316 3.856 . 0 0 "[ . 1 . 2]" 1
1088 1 56 ILE H 1 73 PRO HA . . 4.650 3.712 3.507 3.987 . 0 0 "[ . 1 . 2]" 1
1089 1 56 ILE H 1 74 VAL H . . 4.900 4.620 4.132 4.838 . 0 0 "[ . 1 . 2]" 1
1090 1 56 ILE H 1 74 VAL MG2 . . 4.310 3.615 3.279 3.936 . 0 0 "[ . 1 . 2]" 1
1091 1 56 ILE HA 1 56 ILE MD . . 4.340 3.853 3.811 3.917 . 0 0 "[ . 1 . 2]" 1
1092 1 56 ILE HA 1 56 ILE MG . . 3.420 2.387 2.224 2.477 . 0 0 "[ . 1 . 2]" 1
1093 1 56 ILE HA 1 57 TYR H . . 3.250 2.186 2.148 2.252 . 0 0 "[ . 1 . 2]" 1
1094 1 56 ILE HA 1 57 TYR QD . . 4.760 3.169 2.863 3.726 . 0 0 "[ . 1 . 2]" 1
1095 1 56 ILE HA 1 96 ILE HA . . 3.760 2.702 2.557 2.857 . 0 0 "[ . 1 . 2]" 1
1096 1 56 ILE HA 1 96 ILE HG13 . . 4.620 4.511 4.133 4.623 0.003 11 0 "[ . 1 . 2]" 1
1097 1 56 ILE HA 1 96 ILE MG . . 4.390 4.150 3.919 4.335 . 0 0 "[ . 1 . 2]" 1
1098 1 56 ILE HA 1 97 GLN H . . 4.400 3.870 3.530 4.225 . 0 0 "[ . 1 . 2]" 1
1099 1 56 ILE HB 1 56 ILE MD . . 3.350 2.296 2.135 2.402 . 0 0 "[ . 1 . 2]" 1
1100 1 56 ILE HB 1 57 TYR H . . 4.700 4.089 3.895 4.233 . 0 0 "[ . 1 . 2]" 1
1101 1 56 ILE HB 1 72 GLU H . . 5.270 3.873 3.692 4.317 . 0 0 "[ . 1 . 2]" 1
1102 1 56 ILE HB 1 72 GLU HB3 . . 3.930 2.780 2.526 3.017 . 0 0 "[ . 1 . 2]" 1
1103 1 56 ILE HB 1 74 VAL MG2 . . 4.180 3.939 3.762 4.076 . 0 0 "[ . 1 . 2]" 1
1104 1 56 ILE HB 1 81 HIS HD2 . . 4.610 3.564 3.221 3.877 . 0 0 "[ . 1 . 2]" 1
1105 1 56 ILE MD 1 56 ILE MG . . 3.000 2.139 1.960 2.383 . 0 0 "[ . 1 . 2]" 1
1106 1 56 ILE MD 1 72 GLU HB3 . . 4.230 3.526 3.101 3.871 . 0 0 "[ . 1 . 2]" 1
1107 1 56 ILE MD 1 74 VAL MG1 . . 4.460 4.106 3.825 4.355 . 0 0 "[ . 1 . 2]" 1
1108 1 56 ILE MD 1 74 VAL MG2 . . 2.930 2.473 2.049 2.780 . 0 0 "[ . 1 . 2]" 1
1109 1 56 ILE MD 1 81 HIS H . . 4.800 3.762 3.502 4.079 . 0 0 "[ . 1 . 2]" 1
1110 1 56 ILE MD 1 81 HIS HB2 . . 3.840 2.165 1.866 2.579 . 0 0 "[ . 1 . 2]" 1
1111 1 56 ILE MD 1 81 HIS HB3 . . 3.630 2.279 2.016 2.728 . 0 0 "[ . 1 . 2]" 1
1112 1 56 ILE MD 1 81 HIS HD2 . . 3.290 2.594 2.079 3.034 . 0 0 "[ . 1 . 2]" 1
1113 1 56 ILE MD 1 82 GLN H . . 5.500 5.105 4.707 5.435 . 0 0 "[ . 1 . 2]" 1
1114 1 56 ILE MD 1 96 ILE MG . . 4.130 3.826 3.289 4.104 . 0 0 "[ . 1 . 2]" 1
1115 1 56 ILE QG 1 56 ILE MG . . 3.300 2.225 2.119 2.310 . 0 0 "[ . 1 . 2]" 1
1116 1 56 ILE QG 1 57 TYR H . . 5.220 4.005 3.857 4.162 . 0 0 "[ . 1 . 2]" 1
1117 1 56 ILE QG 1 81 HIS HD2 . . 5.340 4.577 4.122 4.997 . 0 0 "[ . 1 . 2]" 1
1118 1 56 ILE QG 1 96 ILE MG . . 3.940 2.981 2.524 3.226 . 0 0 "[ . 1 . 2]" 1
1119 1 56 ILE MG 1 57 TYR H . . 3.510 2.235 1.898 2.668 . 0 0 "[ . 1 . 2]" 1
1120 1 56 ILE MG 1 57 TYR HA . . 4.890 3.572 3.433 3.812 . 0 0 "[ . 1 . 2]" 1
1121 1 56 ILE MG 1 58 TYR HA . . 5.180 4.522 4.227 4.697 . 0 0 "[ . 1 . 2]" 1
1122 1 56 ILE MG 1 58 TYR HB2 . . 4.810 4.598 4.382 4.808 . 0 0 "[ . 1 . 2]" 1
1123 1 56 ILE MG 1 58 TYR QB . . 4.110 3.096 2.921 3.292 . 0 0 "[ . 1 . 2]" 1
1124 1 56 ILE MG 1 58 TYR HB3 . . 4.810 3.147 2.966 3.352 . 0 0 "[ . 1 . 2]" 1
1125 1 56 ILE MG 1 58 TYR QD . . 3.500 2.937 2.415 3.378 . 0 0 "[ . 1 . 2]" 1
1126 1 56 ILE MG 1 72 GLU HB2 . . 4.400 3.132 2.676 3.448 . 0 0 "[ . 1 . 2]" 1
1127 1 56 ILE MG 1 72 GLU HB3 . . 4.180 3.962 3.539 4.184 0.004 1 0 "[ . 1 . 2]" 1
1128 1 56 ILE MG 1 74 VAL MG2 . . 5.280 4.658 4.464 4.819 . 0 0 "[ . 1 . 2]" 1
1129 1 56 ILE MG 1 81 HIS HD2 . . 4.700 3.818 3.398 4.391 . 0 0 "[ . 1 . 2]" 1
1130 1 56 ILE MG 1 83 ILE MD . . 3.190 2.663 2.249 3.088 . 0 0 "[ . 1 . 2]" 1
1131 1 56 ILE MG 1 94 PHE HA . . 4.810 3.802 3.677 3.959 . 0 0 "[ . 1 . 2]" 1
1132 1 56 ILE MG 1 94 PHE HB3 . . 4.150 2.966 2.740 3.173 . 0 0 "[ . 1 . 2]" 1
1133 1 56 ILE MG 1 94 PHE QD . . 3.500 3.073 2.771 3.311 . 0 0 "[ . 1 . 2]" 1
1134 1 56 ILE MG 1 95 LYS H . . 4.520 2.668 2.445 2.917 . 0 0 "[ . 1 . 2]" 1
1135 1 56 ILE MG 1 96 ILE HA . . 4.740 3.680 3.306 3.971 . 0 0 "[ . 1 . 2]" 1
1136 1 56 ILE MG 1 96 ILE MG . . 4.650 4.447 4.085 4.641 . 0 0 "[ . 1 . 2]" 1
1137 1 57 TYR H 1 57 TYR HB2 . . 3.960 2.761 2.610 2.859 . 0 0 "[ . 1 . 2]" 1
1138 1 57 TYR H 1 57 TYR QD . . 3.510 2.367 2.073 2.728 . 0 0 "[ . 1 . 2]" 1
1139 1 57 TYR H 1 57 TYR QE . . 4.580 4.390 4.208 4.585 0.005 1 0 "[ . 1 . 2]" 1
1140 1 57 TYR H 1 95 LYS H . . 4.040 2.762 2.425 2.926 . 0 0 "[ . 1 . 2]" 1
1141 1 57 TYR H 1 95 LYS HB2 . . 4.830 2.971 2.666 3.215 . 0 0 "[ . 1 . 2]" 1
1142 1 57 TYR H 1 95 LYS QG . . 5.500 4.679 4.091 4.993 . 0 0 "[ . 1 . 2]" 1
1143 1 57 TYR H 1 96 ILE HA . . 4.250 3.888 3.704 4.024 . 0 0 "[ . 1 . 2]" 1
1144 1 57 TYR HA 1 57 TYR QD . . 3.790 3.135 2.873 3.247 . 0 0 "[ . 1 . 2]" 1
1145 1 57 TYR HA 1 58 TYR H . . 3.070 2.149 2.138 2.190 . 0 0 "[ . 1 . 2]" 1
1146 1 57 TYR HA 1 69 TRP HE3 . . 4.530 3.725 3.519 3.954 . 0 0 "[ . 1 . 2]" 1
1147 1 57 TYR HA 1 70 VAL H . . 4.600 4.395 4.136 4.599 . 0 0 "[ . 1 . 2]" 1
1148 1 57 TYR HA 1 71 ILE HA . . 3.830 3.520 3.357 3.632 . 0 0 "[ . 1 . 2]" 1
1149 1 57 TYR HA 1 71 ILE MG . . 5.200 5.125 4.935 5.206 0.006 2 0 "[ . 1 . 2]" 1
1150 1 57 TYR HA 1 72 GLU H . . 4.540 3.566 3.440 3.702 . 0 0 "[ . 1 . 2]" 1
1151 1 57 TYR HB2 1 58 TYR H . . 4.410 4.115 3.993 4.227 . 0 0 "[ . 1 . 2]" 1
1152 1 57 TYR HB2 1 69 TRP HB3 . . 4.450 3.634 3.308 4.161 . 0 0 "[ . 1 . 2]" 1
1153 1 57 TYR HB2 1 69 TRP HE3 . . 4.100 2.792 2.509 3.261 . 0 0 "[ . 1 . 2]" 1
1154 1 57 TYR HB2 1 95 LYS HB2 . . 4.480 2.223 1.995 2.651 . 0 0 "[ . 1 . 2]" 1
1155 1 57 TYR HB2 1 95 LYS HB3 . . 4.810 3.567 3.068 4.258 . 0 0 "[ . 1 . 2]" 1
1156 1 57 TYR HB2 1 95 LYS QG . . 4.660 3.834 3.043 4.403 . 0 0 "[ . 1 . 2]" 1
1157 1 57 TYR HB3 1 58 TYR H . . 4.210 3.368 3.067 3.597 . 0 0 "[ . 1 . 2]" 1
1158 1 57 TYR HB3 1 66 ILE MD . . 4.630 3.261 2.648 4.105 . 0 0 "[ . 1 . 2]" 1
1159 1 57 TYR HB3 1 69 TRP HB3 . . 4.200 2.174 2.000 2.744 . 0 0 "[ . 1 . 2]" 1
1160 1 57 TYR HB3 1 69 TRP HE3 . . 3.930 2.553 2.028 3.039 . 0 0 "[ . 1 . 2]" 1
1161 1 57 TYR HB3 1 70 VAL H . . 4.870 4.463 4.030 4.835 . 0 0 "[ . 1 . 2]" 1
1162 1 57 TYR QD 1 66 ILE MD . . 3.970 3.322 2.720 3.968 . 0 0 "[ . 1 . 2]" 1
1163 1 57 TYR QD 1 69 TRP H . . 5.500 5.462 5.274 5.506 0.006 10 0 "[ . 1 . 2]" 1
1164 1 57 TYR QD 1 69 TRP HB2 . . 4.090 3.416 3.206 3.701 . 0 0 "[ . 1 . 2]" 1
1165 1 57 TYR QD 1 69 TRP HB3 . . 4.400 3.426 2.822 3.991 . 0 0 "[ . 1 . 2]" 1
1166 1 57 TYR QD 1 70 VAL H . . 5.500 5.018 4.652 5.365 . 0 0 "[ . 1 . 2]" 1
1167 1 57 TYR QD 1 71 ILE HA . . 4.470 3.209 2.527 3.541 . 0 0 "[ . 1 . 2]" 1
1168 1 57 TYR QD 1 71 ILE MD . . 4.430 4.380 4.236 4.443 0.013 16 0 "[ . 1 . 2]" 1
1169 1 57 TYR QD 1 71 ILE HG12 . . 3.810 3.069 2.888 3.272 . 0 0 "[ . 1 . 2]" 1
1170 1 57 TYR QD 1 71 ILE HG13 . . 4.700 3.633 3.352 3.882 . 0 0 "[ . 1 . 2]" 1
1171 1 57 TYR QD 1 71 ILE MG . . 4.460 4.194 3.902 4.445 . 0 0 "[ . 1 . 2]" 1
1172 1 57 TYR QD 1 95 LYS H . . 4.600 4.415 3.963 4.599 . 0 0 "[ . 1 . 2]" 1
1173 1 57 TYR QD 1 95 LYS HB2 . . 3.760 2.962 2.617 3.341 . 0 0 "[ . 1 . 2]" 1
1174 1 57 TYR QD 1 95 LYS HB3 . . 4.780 3.269 2.672 4.579 . 0 0 "[ . 1 . 2]" 1
1175 1 57 TYR QD 1 95 LYS QD . . 4.730 4.226 3.580 4.663 . 0 0 "[ . 1 . 2]" 1
1176 1 57 TYR QD 1 96 ILE HA . . 4.670 4.061 3.768 4.383 . 0 0 "[ . 1 . 2]" 1
1177 1 57 TYR QD 1 107 MET ME . . 4.290 3.781 3.267 4.191 . 0 0 "[ . 1 . 2]" 1
1178 1 57 TYR QE 1 66 ILE MD . . 4.590 4.048 3.233 4.569 . 0 0 "[ . 1 . 2]" 1
1179 1 57 TYR QE 1 71 ILE MD . . 3.670 3.387 3.130 3.622 . 0 0 "[ . 1 . 2]" 1
1180 1 57 TYR QE 1 71 ILE HG12 . . 3.660 2.242 2.005 2.581 . 0 0 "[ . 1 . 2]" 1
1181 1 57 TYR QE 1 71 ILE HG13 . . 4.200 3.750 3.257 4.162 . 0 0 "[ . 1 . 2]" 1
1182 1 57 TYR QE 1 71 ILE MG . . 4.120 3.293 2.932 3.718 . 0 0 "[ . 1 . 2]" 1
1183 1 57 TYR QE 1 97 GLN H . . 4.770 4.166 3.812 4.763 . 0 0 "[ . 1 . 2]" 1
1184 1 57 TYR QE 1 97 GLN HB2 . . 3.810 3.104 2.371 3.818 0.008 1 0 "[ . 1 . 2]" 1
1185 1 57 TYR QE 1 97 GLN QB . . 3.170 2.263 1.922 2.766 . 0 0 "[ . 1 . 2]" 1
1186 1 57 TYR QE 1 97 GLN HB3 . . 3.810 2.347 2.027 2.839 . 0 0 "[ . 1 . 2]" 1
1187 1 57 TYR QE 1 97 GLN QG . . 4.510 3.740 1.984 4.461 . 0 0 "[ . 1 . 2]" 1
1188 1 57 TYR QE 1 107 MET ME . . 3.490 2.942 2.266 3.491 0.001 4 0 "[ . 1 . 2]" 1
1189 1 57 TYR QE 1 107 MET QG . . 4.560 3.828 2.453 4.563 0.003 2 0 "[ . 1 . 2]" 1
1190 1 58 TYR H 1 58 TYR QD . . 3.660 3.251 2.936 3.417 . 0 0 "[ . 1 . 2]" 1
1191 1 58 TYR H 1 59 SER H . . 4.930 4.384 4.287 4.472 . 0 0 "[ . 1 . 2]" 1
1192 1 58 TYR H 1 69 TRP HA . . 5.250 4.612 4.206 5.265 0.015 2 0 "[ . 1 . 2]" 1
1193 1 58 TYR H 1 69 TRP HB3 . . 4.180 3.497 3.113 3.828 . 0 0 "[ . 1 . 2]" 1
1194 1 58 TYR H 1 69 TRP HE3 . . 4.210 3.192 2.926 3.434 . 0 0 "[ . 1 . 2]" 1
1195 1 58 TYR H 1 70 VAL H . . 3.820 3.284 2.967 3.538 . 0 0 "[ . 1 . 2]" 1
1196 1 58 TYR H 1 70 VAL HB . . 4.620 4.491 4.203 4.620 . 0 0 "[ . 1 . 2]" 1
1197 1 58 TYR H 1 70 VAL MG1 . . 4.310 2.043 1.853 2.321 . 0 0 "[ . 1 . 2]" 1
1198 1 58 TYR H 1 71 ILE HA . . 5.500 4.992 4.768 5.152 . 0 0 "[ . 1 . 2]" 1
1199 1 58 TYR HA 1 58 TYR QD . . 4.230 3.642 3.583 3.696 . 0 0 "[ . 1 . 2]" 1
1200 1 58 TYR HA 1 59 SER H . . 3.190 2.257 2.187 2.427 . 0 0 "[ . 1 . 2]" 1
1201 1 58 TYR HA 1 69 TRP HE3 . . 3.800 2.755 2.303 3.094 . 0 0 "[ . 1 . 2]" 1
1202 1 58 TYR HA 1 69 TRP HZ3 . . 3.810 2.623 2.082 2.947 . 0 0 "[ . 1 . 2]" 1
1203 1 58 TYR HA 1 93 TYR H . . 4.920 4.704 4.409 4.877 . 0 0 "[ . 1 . 2]" 1
1204 1 58 TYR HA 1 94 PHE HA . . 4.010 2.631 2.351 2.807 . 0 0 "[ . 1 . 2]" 1
1205 1 58 TYR HA 1 95 LYS H . . 4.370 3.929 3.634 4.141 . 0 0 "[ . 1 . 2]" 1
1206 1 58 TYR QB 1 59 SER H . . 3.570 2.821 2.395 3.022 . 0 0 "[ . 1 . 2]" 1
1207 1 58 TYR QB 1 94 PHE QD . . 4.170 2.167 1.994 2.658 . 0 0 "[ . 1 . 2]" 1
1208 1 58 TYR HB2 1 59 SER H . . 4.380 2.876 2.420 3.098 . 0 0 "[ . 1 . 2]" 1
1209 1 58 TYR HB2 1 94 PHE HA . . 4.690 3.313 3.085 3.708 . 0 0 "[ . 1 . 2]" 1
1210 1 58 TYR HB3 1 59 SER H . . 4.380 4.094 3.813 4.214 . 0 0 "[ . 1 . 2]" 1
1211 1 58 TYR HB3 1 94 PHE HA . . 4.690 2.973 2.475 3.384 . 0 0 "[ . 1 . 2]" 1
1212 1 58 TYR QD 1 59 SER H . . 3.710 3.161 2.804 3.480 . 0 0 "[ . 1 . 2]" 1
1213 1 58 TYR QD 1 59 SER HA . . 3.710 2.657 2.428 2.930 . 0 0 "[ . 1 . 2]" 1
1214 1 58 TYR QD 1 59 SER QB . . 4.600 4.185 3.888 4.560 . 0 0 "[ . 1 . 2]" 1
1215 1 58 TYR QD 1 60 THR H . . 4.940 4.543 4.018 4.932 . 0 0 "[ . 1 . 2]" 1
1216 1 58 TYR QD 1 60 THR MG . . 4.720 4.540 4.350 4.690 . 0 0 "[ . 1 . 2]" 1
1217 1 58 TYR QD 1 70 VAL H . . 5.500 4.672 4.455 4.802 . 0 0 "[ . 1 . 2]" 1
1218 1 58 TYR QD 1 70 VAL HB . . 4.960 4.701 4.490 4.822 . 0 0 "[ . 1 . 2]" 1
1219 1 58 TYR QD 1 70 VAL MG1 . . 3.640 2.772 2.530 2.897 . 0 0 "[ . 1 . 2]" 1
1220 1 58 TYR QD 1 83 ILE MD . . 3.530 2.282 2.015 2.681 . 0 0 "[ . 1 . 2]" 1
1221 1 58 TYR QD 1 83 ILE MG . . 4.530 3.645 3.202 4.232 . 0 0 "[ . 1 . 2]" 1
1222 1 58 TYR QD 1 86 LEU MD2 . . 4.030 3.734 3.283 3.988 . 0 0 "[ . 1 . 2]" 1
1223 1 58 TYR QD 1 92 TYR QD . . 3.270 3.025 2.785 3.271 0.001 2 0 "[ . 1 . 2]" 1
1224 1 58 TYR QD 1 92 TYR QE . . 3.540 3.315 3.071 3.521 . 0 0 "[ . 1 . 2]" 1
1225 1 58 TYR QE 1 70 VAL HB . . 4.120 4.065 3.926 4.122 0.002 20 0 "[ . 1 . 2]" 1
1226 1 58 TYR QE 1 70 VAL MG1 . . 3.930 2.493 2.223 2.671 . 0 0 "[ . 1 . 2]" 1
1227 1 58 TYR QE 1 70 VAL MG2 . . 3.800 3.630 3.250 3.800 . 0 0 "[ . 1 . 2]" 1
1228 1 58 TYR QE 1 72 GLU HB2 . . 4.240 4.169 4.013 4.249 0.009 16 0 "[ . 1 . 2]" 1
1229 1 58 TYR QE 1 72 GLU HG2 . . 3.870 2.471 2.046 2.912 . 0 0 "[ . 1 . 2]" 1
1230 1 58 TYR QE 1 72 GLU HG3 . . 3.870 2.679 2.035 3.452 . 0 0 "[ . 1 . 2]" 1
1231 1 58 TYR QE 1 83 ILE MD . . 3.470 2.726 2.231 3.411 . 0 0 "[ . 1 . 2]" 1
1232 1 58 TYR QE 1 83 ILE MG . . 3.800 2.765 2.143 3.427 . 0 0 "[ . 1 . 2]" 1
1233 1 58 TYR QE 1 86 LEU MD2 . . 3.570 3.206 2.758 3.514 . 0 0 "[ . 1 . 2]" 1
1234 1 58 TYR QE 1 92 TYR QE . . 3.910 3.467 3.089 3.905 . 0 0 "[ . 1 . 2]" 1
1235 1 59 SER H 1 59 SER HB2 . . 4.130 3.379 2.983 4.016 . 0 0 "[ . 1 . 2]" 1
1236 1 59 SER H 1 59 SER QB . . 3.540 2.891 2.760 3.042 . 0 0 "[ . 1 . 2]" 1
1237 1 59 SER H 1 59 SER HB3 . . 4.130 3.235 2.898 3.874 . 0 0 "[ . 1 . 2]" 1
1238 1 59 SER H 1 69 TRP HE3 . . 4.680 3.906 3.445 4.274 . 0 0 "[ . 1 . 2]" 1
1239 1 59 SER H 1 69 TRP HZ3 . . 4.190 3.585 2.822 4.070 . 0 0 "[ . 1 . 2]" 1
1240 1 59 SER H 1 93 TYR H . . 3.740 3.344 3.176 3.636 . 0 0 "[ . 1 . 2]" 1
1241 1 59 SER H 1 93 TYR HB2 . . 4.560 3.692 3.408 4.103 . 0 0 "[ . 1 . 2]" 1
1242 1 59 SER H 1 94 PHE HA . . 4.450 4.271 3.981 4.453 0.003 19 0 "[ . 1 . 2]" 1
1243 1 59 SER HA 1 60 THR H . . 2.960 2.347 2.164 2.632 . 0 0 "[ . 1 . 2]" 1
1244 1 59 SER HA 1 70 VAL H . . 4.590 4.346 3.935 4.573 . 0 0 "[ . 1 . 2]" 1
1245 1 59 SER HA 1 92 TYR QE . . 5.070 4.068 3.569 4.579 . 0 0 "[ . 1 . 2]" 1
1246 1 59 SER QB 1 60 THR H . . 3.700 3.201 2.526 3.697 . 0 0 "[ . 1 . 2]" 1
1247 1 59 SER QB 1 60 THR MG . . 5.340 4.743 4.201 5.032 . 0 0 "[ . 1 . 2]" 1
1248 1 59 SER QB 1 61 ASP H . . 3.740 2.921 2.195 3.517 . 0 0 "[ . 1 . 2]" 1
1249 1 59 SER QB 1 69 TRP HA . . 3.670 2.324 2.031 3.195 . 0 0 "[ . 1 . 2]" 1
1250 1 59 SER QB 1 69 TRP HB3 . . 4.560 3.518 2.809 3.842 . 0 0 "[ . 1 . 2]" 1
1251 1 59 SER QB 1 69 TRP HD1 . . 5.240 3.979 3.651 4.410 . 0 0 "[ . 1 . 2]" 1
1252 1 59 SER QB 1 69 TRP HE1 . . 5.340 3.956 3.626 4.334 . 0 0 "[ . 1 . 2]" 1
1253 1 59 SER QB 1 69 TRP HZ2 . . 5.340 4.195 3.768 4.567 . 0 0 "[ . 1 . 2]" 1
1254 1 59 SER QB 1 69 TRP HZ3 . . 5.340 4.398 3.686 4.877 . 0 0 "[ . 1 . 2]" 1
1255 1 59 SER QB 1 70 VAL H . . 4.690 3.213 2.833 3.971 . 0 0 "[ . 1 . 2]" 1
1256 1 59 SER QB 1 93 TYR QD . . 5.340 4.632 4.105 5.056 . 0 0 "[ . 1 . 2]" 1
1257 1 59 SER HB2 1 60 THR H . . 4.230 3.881 2.558 4.176 . 0 0 "[ . 1 . 2]" 1
1258 1 59 SER HB2 1 69 TRP HA . . 4.330 2.396 2.048 3.383 . 0 0 "[ . 1 . 2]" 1
1259 1 59 SER HB2 1 69 TRP HE3 . . 4.790 3.926 3.031 4.790 . 0 0 "[ . 1 . 2]" 1
1260 1 59 SER HB3 1 60 THR H . . 4.230 3.509 2.781 4.216 . 0 0 "[ . 1 . 2]" 1
1261 1 59 SER HB3 1 69 TRP HA . . 4.330 3.513 2.617 3.950 . 0 0 "[ . 1 . 2]" 1
1262 1 59 SER HB3 1 69 TRP HE3 . . 4.790 4.327 3.032 4.810 0.020 2 0 "[ . 1 . 2]" 1
1263 1 60 THR H 1 60 THR HB . . 4.170 3.633 3.607 3.687 . 0 0 "[ . 1 . 2]" 1
1264 1 60 THR H 1 60 THR MG . . 3.280 2.291 1.906 2.926 . 0 0 "[ . 1 . 2]" 1
1265 1 60 THR H 1 92 TYR QE . . 4.750 4.243 3.107 4.752 0.002 9 0 "[ . 1 . 2]" 1
1266 1 60 THR HA 1 60 THR MG . . 3.100 2.389 2.250 2.521 . 0 0 "[ . 1 . 2]" 1
1267 1 60 THR HA 1 92 TYR QE . . 5.500 4.220 3.579 4.822 . 0 0 "[ . 1 . 2]" 1
1268 1 60 THR HB 1 61 ASP H . . 4.840 4.099 3.559 4.458 . 0 0 "[ . 1 . 2]" 1
1269 1 60 THR MG 1 61 ASP H . . 4.540 4.096 3.686 4.379 . 0 0 "[ . 1 . 2]" 1
1270 1 60 THR MG 1 61 ASP QB . . 5.340 5.232 4.988 5.340 . 0 0 "[ . 1 . 2]" 1
1271 1 60 THR MG 1 87 THR H . . 5.500 5.095 4.748 5.490 . 0 0 "[ . 1 . 2]" 1
1272 1 60 THR MG 1 90 THR HB . . 5.270 4.818 4.465 5.270 0.000 12 0 "[ . 1 . 2]" 1
1273 1 60 THR MG 1 92 TYR QE . . 3.430 2.595 2.101 2.965 . 0 0 "[ . 1 . 2]" 1
1274 1 61 ASP H 1 61 ASP HB2 . . 4.060 2.780 2.235 3.527 . 0 0 "[ . 1 . 2]" 1
1275 1 61 ASP H 1 61 ASP QB . . 3.320 2.575 2.211 2.925 . 0 0 "[ . 1 . 2]" 1
1276 1 61 ASP H 1 61 ASP HB3 . . 4.060 3.376 2.492 3.891 . 0 0 "[ . 1 . 2]" 1
1277 1 61 ASP H 1 62 VAL H . . 4.880 4.381 3.876 4.623 . 0 0 "[ . 1 . 2]" 1
1278 1 61 ASP H 1 64 ALA MB . . 4.130 3.915 3.536 4.125 . 0 0 "[ . 1 . 2]" 1
1279 1 61 ASP H 1 93 TYR QD . . 4.600 3.844 2.598 4.608 0.008 16 0 "[ . 1 . 2]" 1
1280 1 61 ASP QB 1 62 VAL H . . 4.190 3.159 2.575 3.815 . 0 0 "[ . 1 . 2]" 1
1281 1 61 ASP QB 1 63 ASN H . . 4.550 3.110 2.477 4.210 . 0 0 "[ . 1 . 2]" 1
1282 1 61 ASP QB 1 64 ALA H . . 3.680 2.575 1.930 3.517 . 0 0 "[ . 1 . 2]" 1
1283 1 61 ASP QB 1 64 ALA HA . . 4.350 3.848 3.460 4.295 . 0 0 "[ . 1 . 2]" 1
1284 1 61 ASP QB 1 64 ALA MB . . 3.160 1.972 1.770 2.388 . 0 0 "[ . 1 . 2]" 1
1285 1 61 ASP QB 1 69 TRP HE1 . . 5.340 4.330 3.782 5.288 . 0 0 "[ . 1 . 2]" 1
1286 1 61 ASP HB2 1 64 ALA MB . . 3.670 2.534 1.972 3.461 . 0 0 "[ . 1 . 2]" 1
1287 1 61 ASP HB3 1 64 ALA MB . . 3.670 2.202 1.833 3.340 . 0 0 "[ . 1 . 2]" 1
1288 1 62 VAL H 1 62 VAL HB . . 3.340 2.791 2.519 3.064 . 0 0 "[ . 1 . 2]" 1
1289 1 62 VAL H 1 62 VAL MG1 . . 3.190 2.068 1.880 2.343 . 0 0 "[ . 1 . 2]" 1
1290 1 62 VAL H 1 62 VAL MG2 . . 3.840 3.825 3.783 3.855 0.015 1 0 "[ . 1 . 2]" 1
1291 1 62 VAL H 1 63 ASN H . . 3.450 2.180 1.967 2.483 . 0 0 "[ . 1 . 2]" 1
1292 1 62 VAL H 1 64 ALA H . . 4.460 3.746 3.239 4.384 . 0 0 "[ . 1 . 2]" 1
1293 1 62 VAL H 1 69 TRP HZ2 . . 4.910 4.659 4.323 4.889 . 0 0 "[ . 1 . 2]" 1
1294 1 62 VAL H 1 93 TYR QD . . 4.440 4.337 3.922 4.442 0.002 8 0 "[ . 1 . 2]" 1
1295 1 62 VAL H 1 93 TYR QE . . 4.080 3.618 2.916 4.085 0.005 2 0 "[ . 1 . 2]" 1
1296 1 62 VAL HA 1 62 VAL MG1 . . 3.730 3.191 3.174 3.203 . 0 0 "[ . 1 . 2]" 1
1297 1 62 VAL HA 1 62 VAL MG2 . . 3.090 2.255 2.173 2.373 . 0 0 "[ . 1 . 2]" 1
1298 1 62 VAL HA 1 64 ALA H . . 4.340 3.922 3.531 4.329 . 0 0 "[ . 1 . 2]" 1
1299 1 62 VAL HA 1 64 ALA MB . . 4.740 4.511 4.245 4.741 0.001 3 0 "[ . 1 . 2]" 1
1300 1 62 VAL HA 1 69 TRP HE1 . . 4.590 4.254 4.025 4.511 . 0 0 "[ . 1 . 2]" 1
1301 1 62 VAL HA 1 69 TRP HH2 . . 4.060 3.243 2.842 3.541 . 0 0 "[ . 1 . 2]" 1
1302 1 62 VAL HA 1 69 TRP HZ2 . . 3.180 2.052 1.990 2.275 . 0 0 "[ . 1 . 2]" 1
1303 1 62 VAL HA 1 93 TYR HB2 . . 4.690 3.762 3.319 4.088 . 0 0 "[ . 1 . 2]" 1
1304 1 62 VAL HA 1 93 TYR HB3 . . 5.040 4.441 3.856 4.861 . 0 0 "[ . 1 . 2]" 1
1305 1 62 VAL HA 1 93 TYR QD . . 4.430 3.770 3.422 4.174 . 0 0 "[ . 1 . 2]" 1
1306 1 62 VAL HA 1 110 ALA MB . . 4.880 4.028 3.540 4.423 . 0 0 "[ . 1 . 2]" 1
1307 1 62 VAL HB 1 63 ASN H . . 4.410 4.109 3.815 4.358 . 0 0 "[ . 1 . 2]" 1
1308 1 62 VAL HB 1 93 TYR QD . . 4.420 3.317 2.954 3.690 . 0 0 "[ . 1 . 2]" 1
1309 1 62 VAL HB 1 93 TYR QE . . 4.060 3.027 2.730 3.511 . 0 0 "[ . 1 . 2]" 1
1310 1 62 VAL MG1 1 63 ASN H . . 3.420 2.338 1.880 2.991 . 0 0 "[ . 1 . 2]" 1
1311 1 62 VAL MG1 1 63 ASN HB2 . . 4.940 3.841 3.206 4.591 . 0 0 "[ . 1 . 2]" 1
1312 1 62 VAL MG1 1 63 ASN QB . . 4.260 3.382 2.924 3.790 . 0 0 "[ . 1 . 2]" 1
1313 1 62 VAL MG1 1 63 ASN HB3 . . 4.940 4.064 2.972 4.563 . 0 0 "[ . 1 . 2]" 1
1314 1 62 VAL MG1 1 63 ASN HD21 . . 4.030 2.686 1.942 3.239 . 0 0 "[ . 1 . 2]" 1
1315 1 62 VAL MG1 1 63 ASN HD22 . . 4.030 2.806 2.147 3.957 . 0 0 "[ . 1 . 2]" 1
1316 1 62 VAL MG1 1 64 ALA H . . 4.600 4.244 3.949 4.592 . 0 0 "[ . 1 . 2]" 1
1317 1 62 VAL MG1 1 93 TYR QE . . 4.100 3.505 3.135 4.039 . 0 0 "[ . 1 . 2]" 1
1318 1 62 VAL MG1 1 110 ALA MB . . 4.920 4.558 4.094 4.776 . 0 0 "[ . 1 . 2]" 1
1319 1 62 VAL MG2 1 63 ASN H . . 4.450 3.944 3.611 4.186 . 0 0 "[ . 1 . 2]" 1
1320 1 62 VAL MG2 1 69 TRP HH2 . . 3.680 3.394 2.930 3.666 . 0 0 "[ . 1 . 2]" 1
1321 1 62 VAL MG2 1 69 TRP HZ2 . . 3.740 3.183 2.630 3.597 . 0 0 "[ . 1 . 2]" 1
1322 1 62 VAL MG2 1 93 TYR HB2 . . 4.190 3.945 3.613 4.192 0.002 2 0 "[ . 1 . 2]" 1
1323 1 62 VAL MG2 1 93 TYR HB3 . . 4.120 3.590 3.279 3.962 . 0 0 "[ . 1 . 2]" 1
1324 1 62 VAL MG2 1 93 TYR QD . . 3.950 3.216 2.762 3.732 . 0 0 "[ . 1 . 2]" 1
1325 1 62 VAL MG2 1 110 ALA MB . . 2.980 2.430 1.957 2.665 . 0 0 "[ . 1 . 2]" 1
1326 1 63 ASN H 1 63 ASN HB2 . . 3.780 2.774 2.282 3.724 . 0 0 "[ . 1 . 2]" 1
1327 1 63 ASN H 1 63 ASN QB . . 3.130 2.567 2.256 3.029 . 0 0 "[ . 1 . 2]" 1
1328 1 63 ASN H 1 63 ASN HB3 . . 3.780 3.517 2.813 3.753 . 0 0 "[ . 1 . 2]" 1
1329 1 63 ASN H 1 63 ASN HD21 . . 4.340 3.122 1.995 4.147 . 0 0 "[ . 1 . 2]" 1
1330 1 63 ASN H 1 63 ASN QD . . 3.820 2.964 1.968 3.723 . 0 0 "[ . 1 . 2]" 1
1331 1 63 ASN H 1 63 ASN HD22 . . 4.340 3.920 3.004 4.339 . 0 0 "[ . 1 . 2]" 1
1332 1 63 ASN H 1 64 ALA H . . 2.980 2.321 1.834 2.890 . 0 0 "[ . 1 . 2]" 1
1333 1 63 ASN H 1 64 ALA HA . . 4.920 4.707 4.418 4.919 . 0 0 "[ . 1 . 2]" 1
1334 1 63 ASN H 1 64 ALA MB . . 4.180 3.822 3.487 4.153 . 0 0 "[ . 1 . 2]" 1
1335 1 63 ASN QB 1 63 ASN QD . . 2.930 2.206 2.066 2.565 . 0 0 "[ . 1 . 2]" 1
1336 1 63 ASN QB 1 64 ALA H . . 3.780 3.429 3.063 3.802 0.022 13 0 "[ . 1 . 2]" 1
1337 1 63 ASN HB2 1 64 ALA H . . 4.500 3.653 3.173 4.201 . 0 0 "[ . 1 . 2]" 1
1338 1 63 ASN HB3 1 64 ALA H . . 4.500 4.257 4.034 4.479 . 0 0 "[ . 1 . 2]" 1
1339 1 64 ALA H 1 64 ALA MB . . 2.860 2.152 2.033 2.339 . 0 0 "[ . 1 . 2]" 1
1340 1 64 ALA H 1 65 GLU H . . 4.700 4.591 4.504 4.643 . 0 0 "[ . 1 . 2]" 1
1341 1 64 ALA H 1 69 TRP HE1 . . 3.790 3.226 2.735 3.502 . 0 0 "[ . 1 . 2]" 1
1342 1 64 ALA H 1 69 TRP HZ2 . . 4.360 4.082 3.515 4.343 . 0 0 "[ . 1 . 2]" 1
1343 1 64 ALA HA 1 65 GLU H . . 2.860 2.226 2.167 2.338 . 0 0 "[ . 1 . 2]" 1
1344 1 64 ALA HA 1 65 GLU HB2 . . 4.530 4.461 4.401 4.531 0.001 1 0 "[ . 1 . 2]" 1
1345 1 64 ALA HA 1 69 TRP HE1 . . 4.470 4.286 4.066 4.472 0.002 13 0 "[ . 1 . 2]" 1
1346 1 64 ALA MB 1 65 GLU H . . 3.310 2.872 2.531 3.077 . 0 0 "[ . 1 . 2]" 1
1347 1 64 ALA MB 1 65 GLU HA . . 4.630 4.450 4.283 4.546 . 0 0 "[ . 1 . 2]" 1
1348 1 64 ALA MB 1 65 GLU HB2 . . 4.510 4.316 4.159 4.396 . 0 0 "[ . 1 . 2]" 1
1349 1 64 ALA MB 1 65 GLU HB3 . . 5.340 5.286 5.130 5.346 0.006 4 0 "[ . 1 . 2]" 1
1350 1 64 ALA MB 1 66 ILE HA . . 5.120 5.010 4.931 5.091 . 0 0 "[ . 1 . 2]" 1
1351 1 64 ALA MB 1 68 ASP H . . 4.360 4.189 3.987 4.349 . 0 0 "[ . 1 . 2]" 1
1352 1 64 ALA MB 1 68 ASP HB2 . . 3.620 2.998 2.304 3.587 . 0 0 "[ . 1 . 2]" 1
1353 1 64 ALA MB 1 68 ASP QB . . 3.150 2.292 1.996 3.124 . 0 0 "[ . 1 . 2]" 1
1354 1 64 ALA MB 1 68 ASP HB3 . . 3.620 2.592 2.027 3.620 0.000 4 0 "[ . 1 . 2]" 1
1355 1 64 ALA MB 1 69 TRP H . . 4.090 4.038 3.937 4.090 . 5 0 "[ . 1 . 2]" 1
1356 1 64 ALA MB 1 69 TRP HD1 . . 3.400 2.904 2.665 3.105 . 0 0 "[ . 1 . 2]" 1
1357 1 64 ALA MB 1 69 TRP HE1 . . 3.080 2.443 2.175 2.676 . 0 0 "[ . 1 . 2]" 1
1358 1 64 ALA MB 1 69 TRP HZ2 . . 4.390 4.136 3.930 4.376 . 0 0 "[ . 1 . 2]" 1
1359 1 65 GLU H 1 65 GLU HB2 . . 3.320 2.277 2.231 2.346 . 0 0 "[ . 1 . 2]" 1
1360 1 65 GLU H 1 65 GLU HB3 . . 3.590 3.544 3.521 3.569 . 0 0 "[ . 1 . 2]" 1
1361 1 65 GLU H 1 65 GLU HG2 . . 4.330 3.851 2.848 4.176 . 0 0 "[ . 1 . 2]" 1
1362 1 65 GLU H 1 65 GLU QG . . 3.770 3.100 2.472 3.472 . 0 0 "[ . 1 . 2]" 1
1363 1 65 GLU H 1 65 GLU HG3 . . 4.330 3.362 2.506 3.950 . 0 0 "[ . 1 . 2]" 1
1364 1 65 GLU H 1 66 ILE H . . 4.660 4.577 4.542 4.611 . 0 0 "[ . 1 . 2]" 1
1365 1 65 GLU H 1 68 ASP QB . . 4.570 3.350 2.748 4.444 . 0 0 "[ . 1 . 2]" 1
1366 1 65 GLU HA 1 65 GLU HG2 . . 3.760 3.134 2.280 3.676 . 0 0 "[ . 1 . 2]" 1
1367 1 65 GLU HA 1 65 GLU QG . . 3.270 2.321 2.161 2.585 . 0 0 "[ . 1 . 2]" 1
1368 1 65 GLU HA 1 65 GLU HG3 . . 3.760 2.590 2.183 3.608 . 0 0 "[ . 1 . 2]" 1
1369 1 65 GLU HA 1 66 ILE H . . 2.950 2.174 2.151 2.203 . 0 0 "[ . 1 . 2]" 1
1370 1 65 GLU HA 1 66 ILE HA . . 4.540 4.329 4.319 4.347 . 0 0 "[ . 1 . 2]" 1
1371 1 65 GLU HA 1 66 ILE HB . . 4.630 4.507 4.425 4.602 . 0 0 "[ . 1 . 2]" 1
1372 1 65 GLU HA 1 66 ILE MG . . 4.230 4.039 3.785 4.226 . 0 0 "[ . 1 . 2]" 1
1373 1 65 GLU HA 1 67 HIS H . . 4.640 3.862 3.713 4.067 . 0 0 "[ . 1 . 2]" 1
1374 1 65 GLU HB2 1 66 ILE H . . 4.370 4.289 4.195 4.380 0.010 2 0 "[ . 1 . 2]" 1
1375 1 65 GLU HB2 1 66 ILE MG . . 5.220 4.932 4.711 5.116 . 0 0 "[ . 1 . 2]" 1
1376 1 65 GLU HB2 1 67 HIS H . . 4.760 3.686 3.460 4.086 . 0 0 "[ . 1 . 2]" 1
1377 1 65 GLU HB2 1 67 HIS HE1 . . 4.430 3.333 2.437 4.384 . 0 0 "[ . 1 . 2]" 1
1378 1 65 GLU HB3 1 66 ILE H . . 3.830 3.204 3.048 3.349 . 0 0 "[ . 1 . 2]" 1
1379 1 65 GLU HB3 1 66 ILE MG . . 4.410 3.535 3.311 3.743 . 0 0 "[ . 1 . 2]" 1
1380 1 65 GLU HB3 1 67 HIS H . . 4.390 2.471 2.296 2.689 . 0 0 "[ . 1 . 2]" 1
1381 1 65 GLU HB3 1 67 HIS HE1 . . 4.080 3.363 2.866 3.972 . 0 0 "[ . 1 . 2]" 1
1382 1 65 GLU QG 1 66 ILE H . . 4.160 3.740 3.611 4.099 . 0 0 "[ . 1 . 2]" 1
1383 1 65 GLU QG 1 67 HIS HE1 . . 4.620 3.178 2.005 4.182 . 0 0 "[ . 1 . 2]" 1
1384 1 66 ILE H 1 66 ILE HB . . 3.110 2.374 2.295 2.471 . 0 0 "[ . 1 . 2]" 1
1385 1 66 ILE H 1 66 ILE MD . . 4.320 3.828 3.605 3.965 . 0 0 "[ . 1 . 2]" 1
1386 1 66 ILE H 1 66 ILE HG12 . . 4.820 4.674 4.630 4.703 . 0 0 "[ . 1 . 2]" 1
1387 1 66 ILE H 1 66 ILE QG . . 4.170 4.098 4.080 4.115 . 0 0 "[ . 1 . 2]" 1
1388 1 66 ILE H 1 66 ILE HG13 . . 4.820 4.534 4.485 4.570 . 0 0 "[ . 1 . 2]" 1
1389 1 66 ILE H 1 66 ILE MG . . 3.200 2.452 2.212 2.652 . 0 0 "[ . 1 . 2]" 1
1390 1 66 ILE H 1 67 HIS H . . 3.890 2.897 2.731 3.000 . 0 0 "[ . 1 . 2]" 1
1391 1 66 ILE H 1 69 TRP HD1 . . 4.910 4.267 3.723 4.727 . 0 0 "[ . 1 . 2]" 1
1392 1 66 ILE HA 1 66 ILE MD . . 3.160 2.028 1.970 2.197 . 0 0 "[ . 1 . 2]" 1
1393 1 66 ILE HA 1 66 ILE QG . . 3.580 2.766 2.618 3.007 . 0 0 "[ . 1 . 2]" 1
1394 1 66 ILE HA 1 66 ILE MG . . 3.610 3.193 3.183 3.202 . 0 0 "[ . 1 . 2]" 1
1395 1 66 ILE HA 1 68 ASP H . . 4.520 4.348 3.960 4.523 0.003 13 0 "[ . 1 . 2]" 1
1396 1 66 ILE HA 1 69 TRP H . . 3.920 3.421 3.142 3.935 0.015 2 0 "[ . 1 . 2]" 1
1397 1 66 ILE HA 1 69 TRP HD1 . . 3.140 2.803 2.392 3.156 0.016 2 0 "[ . 1 . 2]" 1
1398 1 66 ILE HA 1 69 TRP HE1 . . 4.050 3.960 3.620 4.047 . 0 0 "[ . 1 . 2]" 1
1399 1 66 ILE HA 1 107 MET ME . . 5.500 5.226 4.757 5.486 . 0 0 "[ . 1 . 2]" 1
1400 1 66 ILE HB 1 66 ILE MD . . 3.350 2.361 2.254 2.492 . 0 0 "[ . 1 . 2]" 1
1401 1 66 ILE HB 1 67 HIS H . . 4.220 3.943 3.795 4.049 . 0 0 "[ . 1 . 2]" 1
1402 1 66 ILE MD 1 66 ILE MG . . 3.590 3.242 3.210 3.256 . 0 0 "[ . 1 . 2]" 1
1403 1 66 ILE MD 1 69 TRP H . . 4.510 4.337 4.116 4.512 0.002 9 0 "[ . 1 . 2]" 1
1404 1 66 ILE MD 1 69 TRP HB2 . . 4.040 2.813 2.315 3.266 . 0 0 "[ . 1 . 2]" 1
1405 1 66 ILE MD 1 69 TRP HD1 . . 4.120 3.989 3.598 4.119 . 0 0 "[ . 1 . 2]" 1
1406 1 66 ILE MD 1 69 TRP HE1 . . 4.850 4.603 4.250 4.798 . 0 0 "[ . 1 . 2]" 1
1407 1 66 ILE MD 1 95 LYS QD . . 4.180 3.238 2.445 4.186 0.006 16 0 "[ . 1 . 2]" 1
1408 1 66 ILE MD 1 95 LYS HE2 . . 4.550 4.096 3.257 4.552 0.002 2 0 "[ . 1 . 2]" 1
1409 1 66 ILE MD 1 95 LYS QE . . 3.810 3.347 2.694 3.808 . 0 0 "[ . 1 . 2]" 1
1410 1 66 ILE MD 1 95 LYS HE3 . . 4.550 3.641 2.772 4.463 . 0 0 "[ . 1 . 2]" 1
1411 1 66 ILE MD 1 107 MET ME . . 3.350 2.567 1.986 2.972 . 0 0 "[ . 1 . 2]" 1
1412 1 66 ILE QG 1 107 MET ME . . 3.430 2.345 1.955 2.865 . 0 0 "[ . 1 . 2]" 1
1413 1 66 ILE MG 1 67 HIS H . . 3.280 2.184 1.927 2.541 . 0 0 "[ . 1 . 2]" 1
1414 1 66 ILE MG 1 67 HIS HA . . 4.070 3.079 2.876 3.328 . 0 0 "[ . 1 . 2]" 1
1415 1 66 ILE MG 1 67 HIS HB2 . . 4.850 4.294 4.074 4.549 . 0 0 "[ . 1 . 2]" 1
1416 1 66 ILE MG 1 67 HIS QB . . 4.190 3.332 2.905 3.965 . 0 0 "[ . 1 . 2]" 1
1417 1 66 ILE MG 1 67 HIS HB3 . . 4.850 3.533 2.961 4.368 . 0 0 "[ . 1 . 2]" 1
1418 1 66 ILE MG 1 68 ASP H . . 4.670 4.383 4.153 4.637 . 0 0 "[ . 1 . 2]" 1
1419 1 66 ILE MG 1 69 TRP HB2 . . 5.500 4.782 4.348 5.496 . 0 0 "[ . 1 . 2]" 1
1420 1 67 HIS H 1 67 HIS HB2 . . 3.850 3.323 2.847 3.590 . 0 0 "[ . 1 . 2]" 1
1421 1 67 HIS H 1 67 HIS HB3 . . 3.850 2.773 2.234 3.543 . 0 0 "[ . 1 . 2]" 1
1422 1 67 HIS H 1 68 ASP H . . 3.510 2.678 2.340 2.883 . 0 0 "[ . 1 . 2]" 1
1423 1 67 HIS HA 1 69 TRP H . . 4.420 4.125 3.776 4.402 . 0 0 "[ . 1 . 2]" 1
1424 1 67 HIS QB 1 67 HIS HD2 . . 3.460 3.003 2.638 3.215 . 0 0 "[ . 1 . 2]" 1
1425 1 67 HIS QB 1 68 ASP H . . 3.960 3.041 2.324 3.547 . 0 0 "[ . 1 . 2]" 1
1426 1 67 HIS HB2 1 68 ASP H . . 4.610 3.400 2.347 4.209 . 0 0 "[ . 1 . 2]" 1
1427 1 67 HIS HB3 1 68 ASP H . . 4.610 3.747 3.537 4.226 . 0 0 "[ . 1 . 2]" 1
1428 1 68 ASP H 1 68 ASP HB2 . . 3.620 2.430 2.211 3.555 . 0 0 "[ . 1 . 2]" 1
1429 1 68 ASP H 1 68 ASP QB . . 3.090 2.262 2.165 2.710 . 0 0 "[ . 1 . 2]" 1
1430 1 68 ASP H 1 68 ASP HB3 . . 3.620 2.981 2.308 3.582 . 0 0 "[ . 1 . 2]" 1
1431 1 68 ASP H 1 69 TRP H . . 3.170 2.631 2.407 2.777 . 0 0 "[ . 1 . 2]" 1
1432 1 68 ASP H 1 69 TRP HD1 . . 4.040 3.417 3.190 3.570 . 0 0 "[ . 1 . 2]" 1
1433 1 68 ASP QB 1 69 TRP H . . 3.810 2.828 2.673 3.337 . 0 0 "[ . 1 . 2]" 1
1434 1 68 ASP QB 1 69 TRP HD1 . . 4.490 2.875 2.470 4.128 . 0 0 "[ . 1 . 2]" 1
1435 1 68 ASP HB2 1 69 TRP H . . 4.330 3.551 2.789 4.247 . 0 0 "[ . 1 . 2]" 1
1436 1 68 ASP HB3 1 69 TRP H . . 4.330 3.191 2.722 4.093 . 0 0 "[ . 1 . 2]" 1
1437 1 69 TRP H 1 69 TRP HB2 . . 3.310 2.415 2.349 2.456 . 0 0 "[ . 1 . 2]" 1
1438 1 69 TRP H 1 69 TRP HD1 . . 3.260 1.950 1.900 2.124 . 0 0 "[ . 1 . 2]" 1
1439 1 69 TRP H 1 69 TRP HE1 . . 4.730 4.494 4.402 4.690 . 0 0 "[ . 1 . 2]" 1
1440 1 69 TRP H 1 70 VAL H . . 4.650 4.595 4.502 4.641 . 0 0 "[ . 1 . 2]" 1
1441 1 69 TRP HA 1 69 TRP HD1 . . 4.390 3.399 3.145 3.683 . 0 0 "[ . 1 . 2]" 1
1442 1 69 TRP HA 1 69 TRP HE3 . . 4.890 4.158 3.851 4.446 . 0 0 "[ . 1 . 2]" 1
1443 1 69 TRP HA 1 70 VAL H . . 3.170 2.222 2.142 2.376 . 0 0 "[ . 1 . 2]" 1
1444 1 69 TRP HA 1 70 VAL HA . . 4.740 4.343 4.319 4.380 . 0 0 "[ . 1 . 2]" 1
1445 1 69 TRP HA 1 70 VAL HB . . 4.770 4.422 4.364 4.503 . 0 0 "[ . 1 . 2]" 1
1446 1 69 TRP HB2 1 69 TRP HE1 . . 4.960 4.907 4.858 4.959 . 0 0 "[ . 1 . 2]" 1
1447 1 69 TRP HB2 1 69 TRP HE3 . . 4.020 3.789 3.634 3.929 . 0 0 "[ . 1 . 2]" 1
1448 1 69 TRP HB2 1 70 VAL H . . 4.420 4.095 3.735 4.363 . 0 0 "[ . 1 . 2]" 1
1449 1 69 TRP HB3 1 70 VAL H . . 3.570 3.010 2.498 3.448 . 0 0 "[ . 1 . 2]" 1
1450 1 69 TRP HB3 1 70 VAL MG1 . . 4.680 4.015 3.617 4.377 . 0 0 "[ . 1 . 2]" 1
1451 1 69 TRP HH2 1 93 TYR HB2 . . 4.240 2.171 1.994 2.770 . 0 0 "[ . 1 . 2]" 1
1452 1 69 TRP HH2 1 93 TYR HB3 . . 4.210 2.695 2.416 3.193 . 0 0 "[ . 1 . 2]" 1
1453 1 69 TRP HH2 1 95 LYS QD . . 4.540 4.072 3.151 4.536 . 0 0 "[ . 1 . 2]" 1
1454 1 69 TRP HH2 1 95 LYS QE . . 4.030 2.999 2.322 3.903 . 0 0 "[ . 1 . 2]" 1
1455 1 69 TRP HH2 1 95 LYS QG . . 4.350 3.440 3.096 3.824 . 0 0 "[ . 1 . 2]" 1
1456 1 69 TRP HH2 1 110 ALA MB . . 3.980 2.713 2.116 3.153 . 0 0 "[ . 1 . 2]" 1
1457 1 69 TRP HZ2 1 93 TYR HB2 . . 4.880 3.931 3.654 4.447 . 0 0 "[ . 1 . 2]" 1
1458 1 69 TRP HZ2 1 110 ALA MB . . 4.850 3.955 3.442 4.376 . 0 0 "[ . 1 . 2]" 1
1459 1 69 TRP HZ3 1 94 PHE H . . 5.450 4.443 4.140 4.746 . 0 0 "[ . 1 . 2]" 1
1460 1 69 TRP HZ3 1 94 PHE HA . . 3.910 3.128 2.760 3.483 . 0 0 "[ . 1 . 2]" 1
1461 1 69 TRP HZ3 1 95 LYS H . . 4.810 3.860 3.591 4.130 . 0 0 "[ . 1 . 2]" 1
1462 1 69 TRP HZ3 1 95 LYS HB2 . . 5.060 3.631 3.042 4.829 . 0 0 "[ . 1 . 2]" 1
1463 1 69 TRP HZ3 1 95 LYS QE . . 4.960 3.258 2.531 4.631 . 0 0 "[ . 1 . 2]" 1
1464 1 69 TRP HZ3 1 95 LYS QG . . 4.010 2.572 2.011 3.138 . 0 0 "[ . 1 . 2]" 1
1465 1 69 TRP HZ3 1 110 ALA MB . . 5.500 4.125 3.581 4.627 . 0 0 "[ . 1 . 2]" 1
1466 1 69 TRP HZ3 1 111 VAL H . . 5.500 5.138 4.342 5.507 0.007 1 0 "[ . 1 . 2]" 1
1467 1 70 VAL H 1 70 VAL HB . . 3.340 2.474 2.313 2.604 . 0 0 "[ . 1 . 2]" 1
1468 1 70 VAL H 1 70 VAL MG1 . . 3.100 2.324 2.163 2.478 . 0 0 "[ . 1 . 2]" 1
1469 1 70 VAL H 1 70 VAL MG2 . . 4.090 3.756 3.695 3.789 . 0 0 "[ . 1 . 2]" 1
1470 1 70 VAL H 1 71 ILE H . . 4.730 4.622 4.599 4.643 . 0 0 "[ . 1 . 2]" 1
1471 1 70 VAL HA 1 70 VAL MG1 . . 3.210 3.185 3.171 3.195 . 0 0 "[ . 1 . 2]" 1
1472 1 70 VAL HA 1 70 VAL MG2 . . 3.140 2.233 2.106 2.370 . 0 0 "[ . 1 . 2]" 1
1473 1 70 VAL HA 1 71 ILE H . . 2.880 2.288 2.231 2.323 . 0 0 "[ . 1 . 2]" 1
1474 1 70 VAL HA 1 71 ILE HA . . 5.100 4.380 4.366 4.391 . 0 0 "[ . 1 . 2]" 1
1475 1 70 VAL HA 1 71 ILE HB . . 4.820 4.616 4.529 4.685 . 0 0 "[ . 1 . 2]" 1
1476 1 70 VAL HA 1 71 ILE MD . . 4.870 4.726 4.578 4.848 . 0 0 "[ . 1 . 2]" 1
1477 1 70 VAL HA 1 71 ILE HG13 . . 3.860 3.560 3.417 3.688 . 0 0 "[ . 1 . 2]" 1
1478 1 70 VAL HB 1 71 ILE H . . 4.290 4.019 3.975 4.148 . 0 0 "[ . 1 . 2]" 1
1479 1 70 VAL MG1 1 71 ILE H . . 3.800 3.433 3.211 3.683 . 0 0 "[ . 1 . 2]" 1
1480 1 70 VAL MG1 1 72 GLU HB2 . . 4.570 3.778 3.472 4.014 . 0 0 "[ . 1 . 2]" 1
1481 1 70 VAL MG2 1 71 ILE H . . 3.070 2.005 1.870 2.133 . 0 0 "[ . 1 . 2]" 1
1482 1 70 VAL MG2 1 71 ILE HA . . 4.420 3.967 3.762 4.193 . 0 0 "[ . 1 . 2]" 1
1483 1 70 VAL MG2 1 71 ILE HB . . 4.070 3.976 3.871 4.051 . 0 0 "[ . 1 . 2]" 1
1484 1 70 VAL MG2 1 72 GLU HB2 . . 4.970 4.794 4.609 4.928 . 0 0 "[ . 1 . 2]" 1
1485 1 70 VAL MG2 1 72 GLU HG2 . . 4.840 3.480 2.938 4.316 . 0 0 "[ . 1 . 2]" 1
1486 1 70 VAL MG2 1 72 GLU QG . . 4.180 3.309 2.894 3.852 . 0 0 "[ . 1 . 2]" 1
1487 1 70 VAL MG2 1 72 GLU HG3 . . 4.840 4.456 4.146 4.796 . 0 0 "[ . 1 . 2]" 1
1488 1 71 ILE H 1 71 ILE HB . . 3.200 2.544 2.497 2.616 . 0 0 "[ . 1 . 2]" 1
1489 1 71 ILE H 1 71 ILE MD . . 3.930 3.759 3.581 3.857 . 0 0 "[ . 1 . 2]" 1
1490 1 71 ILE H 1 71 ILE HG12 . . 4.260 3.962 3.796 4.111 . 0 0 "[ . 1 . 2]" 1
1491 1 71 ILE H 1 71 ILE HG13 . . 3.520 2.690 2.541 2.896 . 0 0 "[ . 1 . 2]" 1
1492 1 71 ILE H 1 71 ILE MG . . 4.040 3.807 3.772 3.842 . 0 0 "[ . 1 . 2]" 1
1493 1 71 ILE H 1 72 GLU H . . 4.780 4.265 4.177 4.395 . 0 0 "[ . 1 . 2]" 1
1494 1 71 ILE HA 1 71 ILE MD . . 4.140 3.859 3.828 3.890 . 0 0 "[ . 1 . 2]" 1
1495 1 71 ILE HA 1 71 ILE HG12 . . 3.860 2.615 2.552 2.707 . 0 0 "[ . 1 . 2]" 1
1496 1 71 ILE HA 1 71 ILE MG . . 3.330 2.346 2.277 2.399 . 0 0 "[ . 1 . 2]" 1
1497 1 71 ILE HA 1 72 GLU H . . 3.080 2.149 2.140 2.163 . 0 0 "[ . 1 . 2]" 1
1498 1 71 ILE HA 1 72 GLU HB2 . . 4.770 4.350 4.301 4.408 . 0 0 "[ . 1 . 2]" 1
1499 1 71 ILE HB 1 71 ILE MD . . 3.080 2.351 2.256 2.437 . 0 0 "[ . 1 . 2]" 1
1500 1 71 ILE HB 1 72 GLU H . . 4.620 4.360 4.271 4.420 . 0 0 "[ . 1 . 2]" 1
1501 1 71 ILE HB 1 73 PRO HG3 . . 5.430 5.109 4.882 5.280 . 0 0 "[ . 1 . 2]" 1
1502 1 71 ILE MD 1 71 ILE MG . . 2.970 2.045 1.947 2.170 . 0 0 "[ . 1 . 2]" 1
1503 1 71 ILE MD 1 72 GLU H . . 5.420 5.358 5.228 5.423 0.003 16 0 "[ . 1 . 2]" 1
1504 1 71 ILE HG12 1 71 ILE MG . . 3.170 2.310 2.223 2.361 . 0 0 "[ . 1 . 2]" 1
1505 1 71 ILE MG 1 72 GLU H . . 3.570 2.864 2.564 3.077 . 0 0 "[ . 1 . 2]" 1
1506 1 71 ILE MG 1 72 GLU HA . . 4.160 3.798 3.688 3.893 . 0 0 "[ . 1 . 2]" 1
1507 1 71 ILE MG 1 72 GLU HB2 . . 5.230 4.805 4.670 4.941 . 0 0 "[ . 1 . 2]" 1
1508 1 71 ILE MG 1 73 PRO HB3 . . 4.770 3.320 3.235 3.483 . 0 0 "[ . 1 . 2]" 1
1509 1 71 ILE MG 1 73 PRO HD2 . . 4.040 3.577 3.459 3.687 . 0 0 "[ . 1 . 2]" 1
1510 1 71 ILE MG 1 73 PRO QD . . 3.320 2.025 1.951 2.219 . 0 0 "[ . 1 . 2]" 1
1511 1 71 ILE MG 1 73 PRO HD3 . . 4.040 2.037 1.960 2.237 . 0 0 "[ . 1 . 2]" 1
1512 1 71 ILE MG 1 73 PRO HG2 . . 4.860 4.449 4.347 4.547 . 0 0 "[ . 1 . 2]" 1
1513 1 71 ILE MG 1 73 PRO HG3 . . 3.720 3.339 3.194 3.547 . 0 0 "[ . 1 . 2]" 1
1514 1 72 GLU H 1 72 GLU HB2 . . 3.630 2.361 2.325 2.486 . 0 0 "[ . 1 . 2]" 1
1515 1 72 GLU H 1 72 GLU HB3 . . 3.900 3.558 3.529 3.612 . 0 0 "[ . 1 . 2]" 1
1516 1 72 GLU H 1 72 GLU HG2 . . 4.860 3.681 3.272 4.489 . 0 0 "[ . 1 . 2]" 1
1517 1 72 GLU H 1 72 GLU QG . . 4.220 3.489 3.167 4.011 . 0 0 "[ . 1 . 2]" 1
1518 1 72 GLU H 1 72 GLU HG3 . . 4.860 4.438 4.201 4.582 . 0 0 "[ . 1 . 2]" 1
1519 1 72 GLU HA 1 73 PRO HD2 . . 3.200 1.965 1.954 1.978 . 0 0 "[ . 1 . 2]" 1
1520 1 72 GLU HA 1 73 PRO HD3 . . 3.200 2.715 2.687 2.743 . 0 0 "[ . 1 . 2]" 1
1521 1 72 GLU HA 1 73 PRO HG3 . . 4.490 4.513 4.494 4.533 0.043 20 0 "[ . 1 . 2]" 1
1522 1 72 GLU HB2 1 74 VAL MG2 . . 5.500 4.827 4.532 5.033 . 0 0 "[ . 1 . 2]" 1
1523 1 72 GLU HB2 1 81 HIS HD2 . . 5.050 3.900 3.454 4.383 . 0 0 "[ . 1 . 2]" 1
1524 1 72 GLU HB3 1 81 HIS HD2 . . 4.680 2.834 2.343 3.482 . 0 0 "[ . 1 . 2]" 1
1525 1 72 GLU HB3 1 83 ILE MD . . 4.290 3.926 3.631 4.269 . 0 0 "[ . 1 . 2]" 1
1526 1 72 GLU QG 1 81 HIS HD2 . . 4.180 3.188 2.693 3.613 . 0 0 "[ . 1 . 2]" 1
1527 1 72 GLU QG 1 83 ILE MD . . 3.250 2.642 2.117 2.935 . 0 0 "[ . 1 . 2]" 1
1528 1 72 GLU QG 1 83 ILE HG12 . . 4.020 2.976 2.455 3.470 . 0 0 "[ . 1 . 2]" 1
1529 1 72 GLU QG 1 83 ILE HG13 . . 4.720 4.238 3.736 4.726 0.006 20 0 "[ . 1 . 2]" 1
1530 1 72 GLU QG 1 83 ILE MG . . 4.150 3.658 3.185 4.075 . 0 0 "[ . 1 . 2]" 1
1531 1 72 GLU HG2 1 81 HIS HD2 . . 4.830 4.375 3.227 4.819 . 0 0 "[ . 1 . 2]" 1
1532 1 72 GLU HG2 1 83 ILE MD . . 4.080 3.523 2.139 4.076 . 0 0 "[ . 1 . 2]" 1
1533 1 72 GLU HG3 1 81 HIS HD2 . . 4.830 3.397 2.722 4.425 . 0 0 "[ . 1 . 2]" 1
1534 1 72 GLU HG3 1 83 ILE MD . . 4.080 3.054 2.435 4.025 . 0 0 "[ . 1 . 2]" 1
1535 1 73 PRO HA 1 74 VAL H . . 3.030 2.176 2.152 2.244 . 0 0 "[ . 1 . 2]" 1
1536 1 73 PRO HA 1 74 VAL MG2 . . 4.340 3.563 3.316 3.880 . 0 0 "[ . 1 . 2]" 1
1537 1 73 PRO HB2 1 74 VAL H . . 4.000 3.407 3.065 3.694 . 0 0 "[ . 1 . 2]" 1
1538 1 73 PRO HB2 1 75 VAL MG1 . . 4.150 3.966 3.722 4.150 . 0 0 "[ . 1 . 2]" 1
1539 1 73 PRO HB3 1 74 VAL H . . 4.110 3.919 3.703 4.112 0.002 8 0 "[ . 1 . 2]" 1
1540 1 74 VAL H 1 74 VAL HB . . 3.520 2.600 2.487 2.690 . 0 0 "[ . 1 . 2]" 1
1541 1 74 VAL H 1 74 VAL MG1 . . 4.260 3.832 3.784 3.874 . 0 0 "[ . 1 . 2]" 1
1542 1 74 VAL H 1 74 VAL MG2 . . 3.500 2.536 2.204 2.736 . 0 0 "[ . 1 . 2]" 1
1543 1 74 VAL HA 1 74 VAL MG1 . . 3.350 2.328 2.217 2.444 . 0 0 "[ . 1 . 2]" 1
1544 1 74 VAL HA 1 74 VAL MG2 . . 3.470 2.402 2.259 2.525 . 0 0 "[ . 1 . 2]" 1
1545 1 74 VAL HA 1 75 VAL H . . 2.950 2.174 2.141 2.277 . 0 0 "[ . 1 . 2]" 1
1546 1 74 VAL HA 1 75 VAL MG1 . . 4.300 3.782 3.506 4.073 . 0 0 "[ . 1 . 2]" 1
1547 1 74 VAL HA 1 75 VAL MG2 . . 4.600 3.803 3.620 3.977 . 0 0 "[ . 1 . 2]" 1
1548 1 74 VAL HA 1 81 HIS HE1 . . 4.960 4.230 3.422 4.958 . 0 0 "[ . 1 . 2]" 1
1549 1 74 VAL MG1 1 75 VAL H . . 3.590 2.652 1.997 3.335 . 0 0 "[ . 1 . 2]" 1
1550 1 74 VAL MG1 1 78 ARG H . . 4.070 2.914 1.926 3.864 . 0 0 "[ . 1 . 2]" 1
1551 1 74 VAL MG1 1 78 ARG HB2 . . 3.780 2.827 2.383 3.320 . 0 0 "[ . 1 . 2]" 1
1552 1 74 VAL MG1 1 78 ARG HB3 . . 3.750 1.906 1.787 2.246 . 0 0 "[ . 1 . 2]" 1
1553 1 74 VAL MG1 1 78 ARG QD . . 3.830 3.497 2.689 3.860 0.030 15 0 "[ . 1 . 2]" 1
1554 1 74 VAL MG1 1 78 ARG QG . . 3.770 3.205 2.823 3.563 . 0 0 "[ . 1 . 2]" 1
1555 1 74 VAL MG1 1 80 THR H . . 4.760 3.721 3.084 3.993 . 0 0 "[ . 1 . 2]" 1
1556 1 74 VAL MG1 1 81 HIS HB2 . . 4.230 3.571 3.355 3.721 . 0 0 "[ . 1 . 2]" 1
1557 1 74 VAL MG1 1 81 HIS HB3 . . 5.150 5.065 4.888 5.159 0.009 16 0 "[ . 1 . 2]" 1
1558 1 74 VAL MG2 1 75 VAL H . . 4.270 4.112 3.916 4.271 0.001 13 0 "[ . 1 . 2]" 1
1559 1 74 VAL MG2 1 75 VAL MG2 . . 5.500 5.034 4.893 5.148 . 0 0 "[ . 1 . 2]" 1
1560 1 74 VAL MG2 1 81 HIS HB2 . . 3.850 2.552 2.373 2.717 . 0 0 "[ . 1 . 2]" 1
1561 1 74 VAL MG2 1 81 HIS HB3 . . 3.980 3.853 3.736 3.978 . 0 0 "[ . 1 . 2]" 1
1562 1 74 VAL MG2 1 81 HIS HD2 . . 4.170 4.008 3.651 4.172 0.002 13 0 "[ . 1 . 2]" 1
1563 1 74 VAL MG2 1 81 HIS HE1 . . 4.710 4.023 3.081 4.632 . 0 0 "[ . 1 . 2]" 1
1564 1 74 VAL MG2 1 96 ILE MG . . 5.500 4.645 4.299 5.095 . 0 0 "[ . 1 . 2]" 1
1565 1 75 VAL H 1 75 VAL HB . . 3.840 3.649 3.610 3.800 . 0 0 "[ . 1 . 2]" 1
1566 1 75 VAL H 1 75 VAL MG1 . . 3.600 2.401 2.006 2.852 . 0 0 "[ . 1 . 2]" 1
1567 1 75 VAL H 1 75 VAL MG2 . . 3.710 2.168 1.925 2.382 . 0 0 "[ . 1 . 2]" 1
1568 1 75 VAL HA 1 75 VAL MG1 . . 2.960 2.330 2.180 2.415 . 0 0 "[ . 1 . 2]" 1
1569 1 75 VAL HA 1 76 GLY H . . 3.080 2.413 2.265 2.636 . 0 0 "[ . 1 . 2]" 1
1570 1 75 VAL HB 1 76 GLY H . . 4.440 2.391 1.968 2.764 . 0 0 "[ . 1 . 2]" 1
1571 1 75 VAL HB 1 76 GLY QA . . 4.940 3.774 3.667 3.879 . 0 0 "[ . 1 . 2]" 1
1572 1 75 VAL MG1 1 76 GLY H . . 4.110 3.690 3.535 3.832 . 0 0 "[ . 1 . 2]" 1
1573 1 75 VAL MG2 1 76 GLY H . . 4.330 3.403 2.991 3.648 . 0 0 "[ . 1 . 2]" 1
1574 1 75 VAL MG2 1 76 GLY HA2 . . 4.820 4.531 4.173 4.820 0.000 2 0 "[ . 1 . 2]" 1
1575 1 75 VAL MG2 1 76 GLY QA . . 4.230 3.451 3.270 3.722 . 0 0 "[ . 1 . 2]" 1
1576 1 75 VAL MG2 1 76 GLY HA3 . . 4.820 3.579 3.416 3.873 . 0 0 "[ . 1 . 2]" 1
1577 1 75 VAL MG2 1 78 ARG HB2 . . 5.120 4.062 3.570 4.548 . 0 0 "[ . 1 . 2]" 1
1578 1 75 VAL MG2 1 78 ARG QG . . 5.330 5.161 4.876 5.330 0.000 7 0 "[ . 1 . 2]" 1
1579 1 77 ASN H 1 78 ARG H . . 4.640 3.193 2.508 3.905 . 0 0 "[ . 1 . 2]" 1
1580 1 77 ASN HA 1 78 ARG H . . 3.460 2.755 2.360 3.351 . 0 0 "[ . 1 . 2]" 1
1581 1 78 ARG H 1 78 ARG HB2 . . 3.540 2.352 2.159 2.639 . 0 0 "[ . 1 . 2]" 1
1582 1 78 ARG H 1 78 ARG HB3 . . 3.940 2.878 2.767 3.123 . 0 0 "[ . 1 . 2]" 1
1583 1 78 ARG H 1 78 ARG HD2 . . 5.500 4.542 3.754 5.027 . 0 0 "[ . 1 . 2]" 1
1584 1 78 ARG H 1 78 ARG HD3 . . 5.500 4.902 4.244 5.579 0.079 19 0 "[ . 1 . 2]" 1
1585 1 78 ARG H 1 78 ARG QG . . 4.530 3.997 3.777 4.174 . 0 0 "[ . 1 . 2]" 1
1586 1 78 ARG HA 1 78 ARG HD2 . . 4.550 3.437 2.477 4.586 0.036 11 0 "[ . 1 . 2]" 1
1587 1 78 ARG HA 1 78 ARG HD3 . . 4.550 4.158 3.367 4.603 0.053 17 0 "[ . 1 . 2]" 1
1588 1 78 ARG HA 1 78 ARG QG . . 3.560 2.279 2.117 2.415 . 0 0 "[ . 1 . 2]" 1
1589 1 78 ARG HA 1 79 LEU H . . 3.170 2.220 2.144 2.314 . 0 0 "[ . 1 . 2]" 1
1590 1 78 ARG HA 1 79 LEU MD2 . . 4.920 4.475 3.979 4.809 . 0 0 "[ . 1 . 2]" 1
1591 1 78 ARG HA 1 79 LEU HG . . 4.260 3.613 3.213 4.065 . 0 0 "[ . 1 . 2]" 1
1592 1 78 ARG HA 1 80 THR H . . 3.970 3.679 3.459 3.835 . 0 0 "[ . 1 . 2]" 1
1593 1 78 ARG HA 1 80 THR MG . . 4.220 4.134 3.905 4.222 0.002 1 0 "[ . 1 . 2]" 1
1594 1 78 ARG HB2 1 80 THR H . . 4.710 4.441 4.273 4.553 . 0 0 "[ . 1 . 2]" 1
1595 1 78 ARG HB3 1 78 ARG HD2 . . 3.940 3.404 2.792 3.906 . 0 0 "[ . 1 . 2]" 1
1596 1 78 ARG HB3 1 78 ARG HD3 . . 3.940 3.186 2.546 3.935 . 0 0 "[ . 1 . 2]" 1
1597 1 78 ARG HB3 1 79 LEU H . . 4.270 3.685 3.422 3.996 . 0 0 "[ . 1 . 2]" 1
1598 1 78 ARG HB3 1 80 THR H . . 3.790 3.222 2.914 3.501 . 0 0 "[ . 1 . 2]" 1
1599 1 78 ARG HB3 1 80 THR MG . . 4.270 4.067 3.805 4.273 0.003 15 0 "[ . 1 . 2]" 1
1600 1 78 ARG QD 1 80 THR H . . 4.470 4.043 3.165 4.364 . 0 0 "[ . 1 . 2]" 1
1601 1 78 ARG HD2 1 79 LEU H . . 5.500 4.640 3.766 5.377 . 0 0 "[ . 1 . 2]" 1
1602 1 78 ARG HD2 1 80 THR H . . 5.120 4.719 4.281 5.070 . 0 0 "[ . 1 . 2]" 1
1603 1 78 ARG HD2 1 80 THR MG . . 4.640 3.989 3.683 4.322 . 0 0 "[ . 1 . 2]" 1
1604 1 78 ARG HD3 1 79 LEU H . . 5.500 5.050 4.358 5.410 . 0 0 "[ . 1 . 2]" 1
1605 1 78 ARG HD3 1 80 THR H . . 5.120 4.528 3.231 5.124 0.004 2 0 "[ . 1 . 2]" 1
1606 1 78 ARG HD3 1 80 THR MG . . 4.640 3.744 2.726 4.466 . 0 0 "[ . 1 . 2]" 1
1607 1 78 ARG QG 1 79 LEU H . . 4.840 2.465 2.121 2.819 . 0 0 "[ . 1 . 2]" 1
1608 1 78 ARG QG 1 80 THR H . . 4.070 2.083 1.931 2.237 . 0 0 "[ . 1 . 2]" 1
1609 1 78 ARG QG 1 80 THR HB . . 5.400 4.404 4.152 4.715 . 0 0 "[ . 1 . 2]" 1
1610 1 78 ARG QG 1 80 THR MG . . 3.990 2.102 1.915 2.271 . 0 0 "[ . 1 . 2]" 1
1611 1 79 LEU H 1 79 LEU QB . . 3.600 2.549 2.363 2.761 . 0 0 "[ . 1 . 2]" 1
1612 1 79 LEU H 1 79 LEU MD1 . . 4.730 3.740 3.438 4.157 . 0 0 "[ . 1 . 2]" 1
1613 1 79 LEU H 1 79 LEU MD2 . . 3.920 3.714 3.364 3.880 . 0 0 "[ . 1 . 2]" 1
1614 1 79 LEU H 1 79 LEU HG . . 3.910 2.661 2.324 2.943 . 0 0 "[ . 1 . 2]" 1
1615 1 79 LEU H 1 80 THR H . . 3.200 2.246 2.044 2.557 . 0 0 "[ . 1 . 2]" 1
1616 1 79 LEU H 1 80 THR HB . . 5.500 4.605 4.229 5.114 . 0 0 "[ . 1 . 2]" 1
1617 1 79 LEU H 1 80 THR MG . . 4.050 3.070 2.810 3.456 . 0 0 "[ . 1 . 2]" 1
1618 1 79 LEU HA 1 79 LEU MD1 . . 4.410 3.923 3.760 4.003 . 0 0 "[ . 1 . 2]" 1
1619 1 79 LEU HA 1 79 LEU MD2 . . 3.110 2.251 1.963 2.581 . 0 0 "[ . 1 . 2]" 1
1620 1 79 LEU HA 1 79 LEU HG . . 4.240 3.099 2.970 3.318 . 0 0 "[ . 1 . 2]" 1
1621 1 79 LEU QB 1 79 LEU MD2 . . 3.220 2.216 2.046 2.408 . 0 0 "[ . 1 . 2]" 1
1622 1 79 LEU QB 1 80 THR H . . 4.420 3.471 3.300 3.628 . 0 0 "[ . 1 . 2]" 1
1623 1 79 LEU QB 1 80 THR HB . . 5.340 4.075 3.964 4.170 . 0 0 "[ . 1 . 2]" 1
1624 1 79 LEU QB 1 80 THR MG . . 4.750 3.817 3.502 4.199 . 0 0 "[ . 1 . 2]" 1
1625 1 79 LEU MD2 1 80 THR H . . 4.980 4.775 4.435 4.950 . 0 0 "[ . 1 . 2]" 1
1626 1 79 LEU HG 1 80 THR H . . 4.900 4.613 4.403 4.787 . 0 0 "[ . 1 . 2]" 1
1627 1 80 THR H 1 80 THR HB . . 3.790 3.331 3.225 3.471 . 0 0 "[ . 1 . 2]" 1
1628 1 80 THR H 1 80 THR MG . . 3.250 2.065 1.922 2.293 . 0 0 "[ . 1 . 2]" 1
1629 1 80 THR H 1 81 HIS H . . 4.600 4.400 4.340 4.446 . 0 0 "[ . 1 . 2]" 1
1630 1 80 THR HA 1 80 THR MG . . 3.750 3.189 3.165 3.207 . 0 0 "[ . 1 . 2]" 1
1631 1 80 THR HA 1 81 HIS H . . 3.020 2.245 2.188 2.335 . 0 0 "[ . 1 . 2]" 1
1632 1 80 THR HB 1 81 HIS H . . 4.030 3.905 3.665 4.024 . 0 0 "[ . 1 . 2]" 1
1633 1 80 THR MG 1 81 HIS H . . 4.000 3.878 3.673 3.999 . 0 0 "[ . 1 . 2]" 1
1634 1 81 HIS H 1 81 HIS HB2 . . 4.050 3.005 2.910 3.155 . 0 0 "[ . 1 . 2]" 1
1635 1 81 HIS H 1 81 HIS HB3 . . 3.920 2.926 2.808 3.088 . 0 0 "[ . 1 . 2]" 1
1636 1 81 HIS H 1 82 GLN H . . 4.640 4.404 4.327 4.471 . 0 0 "[ . 1 . 2]" 1
1637 1 81 HIS HB2 1 82 GLN H . . 4.340 4.121 3.964 4.297 . 0 0 "[ . 1 . 2]" 1
1638 1 81 HIS HB3 1 82 GLN H . . 4.450 3.666 3.204 3.934 . 0 0 "[ . 1 . 2]" 1
1639 1 81 HIS HD2 1 83 ILE HA . . 5.020 4.830 4.510 5.024 0.004 9 0 "[ . 1 . 2]" 1
1640 1 81 HIS HD2 1 83 ILE HB . . 5.500 5.177 4.757 5.485 . 0 0 "[ . 1 . 2]" 1
1641 1 81 HIS HD2 1 83 ILE MD . . 3.620 2.750 2.211 3.250 . 0 0 "[ . 1 . 2]" 1
1642 1 81 HIS HD2 1 83 ILE HG12 . . 3.650 2.864 2.500 3.438 . 0 0 "[ . 1 . 2]" 1
1643 1 81 HIS HD2 1 83 ILE HG13 . . 3.530 2.791 2.409 3.082 . 0 0 "[ . 1 . 2]" 1
1644 1 81 HIS HE1 1 82 GLN H . . 4.740 4.083 3.734 4.481 . 0 0 "[ . 1 . 2]" 1
1645 1 82 GLN H 1 82 GLN QB . . 3.150 2.424 2.261 2.628 . 0 0 "[ . 1 . 2]" 1
1646 1 82 GLN H 1 82 GLN HG2 . . 4.630 4.441 4.155 4.637 0.007 20 0 "[ . 1 . 2]" 1
1647 1 82 GLN H 1 82 GLN QG . . 3.990 3.413 3.184 3.682 . 0 0 "[ . 1 . 2]" 1
1648 1 82 GLN H 1 82 GLN HG3 . . 4.630 3.558 3.261 3.976 . 0 0 "[ . 1 . 2]" 1
1649 1 82 GLN H 1 83 ILE H . . 4.630 4.148 3.920 4.462 . 0 0 "[ . 1 . 2]" 1
1650 1 82 GLN HA 1 83 ILE H . . 3.010 2.169 2.139 2.208 . 0 0 "[ . 1 . 2]" 1
1651 1 82 GLN HA 1 83 ILE HB . . 5.440 4.673 4.551 4.826 . 0 0 "[ . 1 . 2]" 1
1652 1 82 GLN QB 1 83 ILE H . . 3.820 3.535 3.045 3.730 . 0 0 "[ . 1 . 2]" 1
1653 1 82 GLN QG 1 83 ILE H . . 4.620 4.063 3.614 4.389 . 0 0 "[ . 1 . 2]" 1
1654 1 83 ILE H 1 83 ILE HB . . 3.560 2.575 2.457 2.783 . 0 0 "[ . 1 . 2]" 1
1655 1 83 ILE H 1 83 ILE HG12 . . 4.340 3.865 3.506 4.217 . 0 0 "[ . 1 . 2]" 1
1656 1 83 ILE H 1 83 ILE HG13 . . 4.020 2.604 2.240 2.996 . 0 0 "[ . 1 . 2]" 1
1657 1 83 ILE H 1 83 ILE MG . . 4.570 3.817 3.757 3.911 . 0 0 "[ . 1 . 2]" 1
1658 1 83 ILE H 1 84 GLN QG . . 5.340 4.665 4.022 5.223 . 0 0 "[ . 1 . 2]" 1
1659 1 83 ILE HA 1 83 ILE HG12 . . 3.780 2.614 2.528 2.686 . 0 0 "[ . 1 . 2]" 1
1660 1 83 ILE HA 1 83 ILE HG13 . . 3.910 2.935 2.756 3.111 . 0 0 "[ . 1 . 2]" 1
1661 1 83 ILE HA 1 83 ILE MG . . 3.310 2.331 2.206 2.463 . 0 0 "[ . 1 . 2]" 1
1662 1 83 ILE HA 1 84 GLN H . . 2.870 2.172 2.140 2.242 . 0 0 "[ . 1 . 2]" 1
1663 1 83 ILE HA 1 84 GLN HA . . 4.790 4.405 4.390 4.436 . 0 0 "[ . 1 . 2]" 1
1664 1 83 ILE HA 1 84 GLN QB . . 4.680 4.568 4.467 4.685 0.005 1 0 "[ . 1 . 2]" 1
1665 1 83 ILE HA 1 84 GLN HG2 . . 4.720 4.218 3.714 4.741 0.021 12 0 "[ . 1 . 2]" 1
1666 1 83 ILE HA 1 84 GLN QG . . 4.140 3.478 3.150 3.792 . 0 0 "[ . 1 . 2]" 1
1667 1 83 ILE HA 1 84 GLN HG3 . . 4.720 3.786 3.198 4.467 . 0 0 "[ . 1 . 2]" 1
1668 1 83 ILE HB 1 84 GLN H . . 4.660 4.144 3.805 4.434 . 0 0 "[ . 1 . 2]" 1
1669 1 83 ILE HB 1 86 LEU MD1 . . 3.540 2.588 2.198 3.007 . 0 0 "[ . 1 . 2]" 1
1670 1 83 ILE MD 1 94 PHE QD . . 4.180 2.940 2.713 3.248 . 0 0 "[ . 1 . 2]" 1
1671 1 83 ILE MD 1 94 PHE QE . . 4.040 2.568 2.116 2.918 . 0 0 "[ . 1 . 2]" 1
1672 1 83 ILE HG12 1 83 ILE MG . . 3.280 2.316 2.220 2.415 . 0 0 "[ . 1 . 2]" 1
1673 1 83 ILE HG12 1 84 GLN H . . 4.640 4.417 4.158 4.646 0.006 20 0 "[ . 1 . 2]" 1
1674 1 83 ILE HG13 1 83 ILE MG . . 3.460 3.188 3.173 3.202 . 0 0 "[ . 1 . 2]" 1
1675 1 83 ILE HG13 1 84 GLN H . . 5.130 4.963 4.811 5.132 0.002 20 0 "[ . 1 . 2]" 1
1676 1 83 ILE MG 1 84 GLN H . . 3.400 2.449 1.952 3.030 . 0 0 "[ . 1 . 2]" 1
1677 1 83 ILE MG 1 84 GLN HA . . 4.880 3.672 3.447 3.958 . 0 0 "[ . 1 . 2]" 1
1678 1 83 ILE MG 1 84 GLN QB . . 4.940 4.450 4.232 4.771 . 0 0 "[ . 1 . 2]" 1
1679 1 83 ILE MG 1 86 LEU H . . 5.050 4.745 4.313 5.041 . 0 0 "[ . 1 . 2]" 1
1680 1 83 ILE MG 1 86 LEU QB . . 5.500 3.925 3.660 4.132 . 0 0 "[ . 1 . 2]" 1
1681 1 83 ILE MG 1 86 LEU MD1 . . 3.430 2.002 1.814 2.252 . 0 0 "[ . 1 . 2]" 1
1682 1 83 ILE MG 1 86 LEU MD2 . . 3.040 2.426 1.935 2.862 . 0 0 "[ . 1 . 2]" 1
1683 1 83 ILE MG 1 86 LEU HG . . 3.470 2.338 1.971 2.684 . 0 0 "[ . 1 . 2]" 1
1684 1 83 ILE MG 1 94 PHE QE . . 4.870 3.523 2.785 4.118 . 0 0 "[ . 1 . 2]" 1
1685 1 84 GLN H 1 84 GLN QB . . 3.360 2.913 2.625 3.216 . 0 0 "[ . 1 . 2]" 1
1686 1 84 GLN H 1 84 GLN HG2 . . 3.870 3.106 2.400 3.663 . 0 0 "[ . 1 . 2]" 1
1687 1 84 GLN H 1 84 GLN QG . . 3.400 2.319 1.887 2.745 . 0 0 "[ . 1 . 2]" 1
1688 1 84 GLN H 1 84 GLN HG3 . . 3.870 2.428 1.961 2.856 . 0 0 "[ . 1 . 2]" 1
1689 1 84 GLN H 1 85 GLU H . . 4.520 4.416 4.374 4.488 . 0 0 "[ . 1 . 2]" 1
1690 1 84 GLN H 1 86 LEU MD1 . . 5.260 4.520 4.210 4.908 . 0 0 "[ . 1 . 2]" 1
1691 1 84 GLN H 1 86 LEU HG . . 4.990 4.367 4.092 4.559 . 0 0 "[ . 1 . 2]" 1
1692 1 84 GLN HA 1 84 GLN HG2 . . 4.040 3.225 2.556 4.125 0.085 18 0 "[ . 1 . 2]" 1
1693 1 84 GLN HA 1 84 GLN HG3 . . 4.040 3.558 3.373 3.692 . 0 0 "[ . 1 . 2]" 1
1694 1 84 GLN HA 1 85 GLU H . . 3.310 2.618 2.533 2.664 . 0 0 "[ . 1 . 2]" 1
1695 1 84 GLN HA 1 85 GLU HA . . 4.750 4.662 4.609 4.701 . 0 0 "[ . 1 . 2]" 1
1696 1 84 GLN HA 1 86 LEU H . . 4.530 3.583 3.263 3.850 . 0 0 "[ . 1 . 2]" 1
1697 1 84 GLN QB 1 85 GLU H . . 3.200 2.070 1.894 2.232 . 0 0 "[ . 1 . 2]" 1
1698 1 84 GLN HB2 1 85 GLU H . . 3.730 2.494 1.907 3.091 . 0 0 "[ . 1 . 2]" 1
1699 1 84 GLN HB3 1 85 GLU H . . 3.730 2.719 2.118 3.464 . 0 0 "[ . 1 . 2]" 1
1700 1 84 GLN QG 1 85 GLU H . . 4.270 3.939 3.432 4.159 . 0 0 "[ . 1 . 2]" 1
1701 1 84 GLN HG2 1 85 GLU H . . 5.090 4.519 4.279 4.871 . 0 0 "[ . 1 . 2]" 1
1702 1 84 GLN HG3 1 85 GLU H . . 5.090 4.441 3.551 4.823 . 0 0 "[ . 1 . 2]" 1
1703 1 85 GLU H 1 85 GLU HG2 . . 4.340 3.326 2.638 4.323 . 0 0 "[ . 1 . 2]" 1
1704 1 85 GLU H 1 85 GLU QG . . 3.680 2.894 2.613 3.692 0.012 9 0 "[ . 1 . 2]" 1
1705 1 85 GLU H 1 85 GLU HG3 . . 4.340 3.607 2.742 4.316 . 0 0 "[ . 1 . 2]" 1
1706 1 85 GLU H 1 86 LEU H . . 3.620 2.727 2.623 3.007 . 0 0 "[ . 1 . 2]" 1
1707 1 85 GLU H 1 86 LEU QB . . 4.850 4.594 4.438 4.791 . 0 0 "[ . 1 . 2]" 1
1708 1 85 GLU HA 1 85 GLU HG2 . . 3.860 2.684 2.172 3.777 . 0 0 "[ . 1 . 2]" 1
1709 1 85 GLU HA 1 85 GLU QG . . 3.300 2.522 2.133 3.339 0.039 20 0 "[ . 1 . 2]" 1
1710 1 85 GLU HA 1 85 GLU HG3 . . 3.860 3.314 2.615 3.837 . 0 0 "[ . 1 . 2]" 1
1711 1 85 GLU HA 1 86 LEU H . . 3.530 2.759 2.615 2.907 . 0 0 "[ . 1 . 2]" 1
1712 1 85 GLU HA 1 86 LEU QB . . 5.500 4.901 4.746 5.034 . 0 0 "[ . 1 . 2]" 1
1713 1 86 LEU H 1 86 LEU QB . . 3.200 2.381 2.188 2.639 . 0 0 "[ . 1 . 2]" 1
1714 1 86 LEU H 1 86 LEU MD1 . . 4.010 3.921 3.762 4.020 0.010 9 0 "[ . 1 . 2]" 1
1715 1 86 LEU H 1 86 LEU MD2 . . 4.090 3.946 3.691 4.091 0.001 8 0 "[ . 1 . 2]" 1
1716 1 86 LEU H 1 86 LEU HG . . 3.270 3.055 2.721 3.272 0.002 8 0 "[ . 1 . 2]" 1
1717 1 86 LEU H 1 87 THR H . . 4.680 4.511 4.429 4.578 . 0 0 "[ . 1 . 2]" 1
1718 1 86 LEU HA 1 86 LEU MD1 . . 4.240 3.860 3.803 3.959 . 0 0 "[ . 1 . 2]" 1
1719 1 86 LEU HA 1 86 LEU MD2 . . 2.940 2.087 1.966 2.351 . 0 0 "[ . 1 . 2]" 1
1720 1 86 LEU HA 1 86 LEU HG . . 4.060 2.939 2.737 3.120 . 0 0 "[ . 1 . 2]" 1
1721 1 86 LEU HA 1 87 THR H . . 3.230 2.402 2.206 2.647 . 0 0 "[ . 1 . 2]" 1
1722 1 86 LEU HA 1 92 TYR QE . . 5.500 4.607 4.232 4.970 . 0 0 "[ . 1 . 2]" 1
1723 1 86 LEU QB 1 86 LEU MD1 . . 3.140 2.054 2.007 2.099 . 0 0 "[ . 1 . 2]" 1
1724 1 86 LEU QB 1 86 LEU MD2 . . 3.180 2.246 2.114 2.305 . 0 0 "[ . 1 . 2]" 1
1725 1 86 LEU QB 1 87 THR H . . 3.250 2.425 1.900 2.927 . 0 0 "[ . 1 . 2]" 1
1726 1 86 LEU QB 1 92 TYR QD . . 5.160 4.471 4.189 4.848 . 0 0 "[ . 1 . 2]" 1
1727 1 86 LEU QB 1 92 TYR QE . . 5.430 4.100 3.466 4.668 . 0 0 "[ . 1 . 2]" 1
1728 1 86 LEU MD1 1 87 THR H . . 4.790 4.407 3.917 4.807 0.017 9 0 "[ . 1 . 2]" 1
1729 1 86 LEU MD1 1 92 TYR QD . . 4.220 4.066 3.803 4.208 . 0 0 "[ . 1 . 2]" 1
1730 1 86 LEU MD1 1 92 TYR QE . . 4.890 4.520 4.043 4.817 . 0 0 "[ . 1 . 2]" 1
1731 1 86 LEU MD1 1 94 PHE QE . . 4.260 2.782 2.362 3.210 . 0 0 "[ . 1 . 2]" 1
1732 1 86 LEU MD1 1 94 PHE HZ . . 4.020 2.703 2.369 3.012 . 0 0 "[ . 1 . 2]" 1
1733 1 86 LEU MD1 1 115 THR MG . . 3.450 3.241 3.027 3.416 . 0 0 "[ . 1 . 2]" 1
1734 1 86 LEU MD2 1 87 THR H . . 3.770 3.049 2.426 3.632 . 0 0 "[ . 1 . 2]" 1
1735 1 86 LEU MD2 1 92 TYR QD . . 4.170 3.321 2.794 3.788 . 0 0 "[ . 1 . 2]" 1
1736 1 86 LEU MD2 1 92 TYR QE . . 3.940 2.862 2.369 3.368 . 0 0 "[ . 1 . 2]" 1
1737 1 86 LEU MD2 1 115 THR MG . . 4.970 4.125 3.722 4.600 . 0 0 "[ . 1 . 2]" 1
1738 1 86 LEU HG 1 87 THR H . . 5.500 4.715 4.433 4.981 . 0 0 "[ . 1 . 2]" 1
1739 1 87 THR H 1 87 THR HB . . 3.390 2.704 2.207 2.862 . 0 0 "[ . 1 . 2]" 1
1740 1 87 THR H 1 88 LEU H . . 4.730 4.583 4.472 4.616 . 0 0 "[ . 1 . 2]" 1
1741 1 87 THR H 1 90 THR MG . . 5.500 5.107 4.700 5.501 0.001 8 0 "[ . 1 . 2]" 1
1742 1 87 THR H 1 92 TYR QE . . 3.790 3.342 2.874 3.684 . 0 0 "[ . 1 . 2]" 1
1743 1 87 THR HA 1 87 THR MG . . 3.060 2.297 2.056 3.141 0.081 14 0 "[ . 1 . 2]" 1
1744 1 87 THR HA 1 88 LEU H . . 2.960 2.295 2.166 2.533 . 0 0 "[ . 1 . 2]" 1
1745 1 87 THR HA 1 88 LEU HB2 . . 5.050 4.812 4.663 4.978 . 0 0 "[ . 1 . 2]" 1
1746 1 87 THR HA 1 88 LEU MD2 . . 4.570 4.254 3.683 4.549 . 0 0 "[ . 1 . 2]" 1
1747 1 87 THR HA 1 88 LEU HG . . 3.800 3.453 3.176 3.637 . 0 0 "[ . 1 . 2]" 1
1748 1 87 THR HB 1 88 LEU H . . 3.960 3.656 3.140 3.961 0.001 18 0 "[ . 1 . 2]" 1
1749 1 87 THR HB 1 90 THR MG . . 3.950 3.329 3.025 4.123 0.173 14 0 "[ . 1 . 2]" 1
1750 1 87 THR HB 1 92 TYR QE . . 4.130 2.211 1.996 3.676 . 0 0 "[ . 1 . 2]" 1
1751 1 87 THR MG 1 88 LEU H . . 3.320 2.141 1.877 2.628 . 0 0 "[ . 1 . 2]" 1
1752 1 87 THR MG 1 88 LEU HA . . 4.630 4.072 3.431 4.315 . 0 0 "[ . 1 . 2]" 1
1753 1 87 THR MG 1 88 LEU HB2 . . 4.480 4.070 3.844 4.391 . 0 0 "[ . 1 . 2]" 1
1754 1 87 THR MG 1 90 THR HB . . 3.790 3.053 1.799 3.586 . 0 0 "[ . 1 . 2]" 1
1755 1 87 THR MG 1 90 THR MG . . 3.860 3.339 2.136 3.805 . 0 0 "[ . 1 . 2]" 1
1756 1 87 THR MG 1 92 TYR QE . . 3.820 3.372 1.908 3.755 . 0 0 "[ . 1 . 2]" 1
1757 1 88 LEU H 1 88 LEU HB2 . . 3.620 2.647 2.513 2.842 . 0 0 "[ . 1 . 2]" 1
1758 1 88 LEU H 1 88 LEU HB3 . . 3.830 3.686 3.621 3.802 . 0 0 "[ . 1 . 2]" 1
1759 1 88 LEU H 1 88 LEU MD1 . . 3.860 3.595 3.391 3.851 . 0 0 "[ . 1 . 2]" 1
1760 1 88 LEU H 1 88 LEU MD2 . . 3.950 3.555 3.317 3.887 . 0 0 "[ . 1 . 2]" 1
1761 1 88 LEU H 1 88 LEU HG . . 3.010 2.368 2.081 2.578 . 0 0 "[ . 1 . 2]" 1
1762 1 88 LEU H 1 89 ASP H . . 4.740 4.525 4.477 4.576 . 0 0 "[ . 1 . 2]" 1
1763 1 88 LEU H 1 89 ASP HB3 . . 5.500 5.100 4.810 5.301 . 0 0 "[ . 1 . 2]" 1
1764 1 88 LEU H 1 117 LYS QE . . 5.330 4.861 4.635 5.036 . 0 0 "[ . 1 . 2]" 1
1765 1 88 LEU HA 1 88 LEU MD1 . . 4.310 3.958 3.890 3.996 . 0 0 "[ . 1 . 2]" 1
1766 1 88 LEU HA 1 88 LEU MD2 . . 3.420 2.238 2.045 2.529 . 0 0 "[ . 1 . 2]" 1
1767 1 88 LEU HA 1 88 LEU HG . . 4.140 3.161 3.043 3.338 . 0 0 "[ . 1 . 2]" 1
1768 1 88 LEU HA 1 89 ASP H . . 3.370 2.481 2.377 2.594 . 0 0 "[ . 1 . 2]" 1
1769 1 88 LEU HA 1 90 THR H . . 3.950 3.507 3.265 3.835 . 0 0 "[ . 1 . 2]" 1
1770 1 88 LEU HA 1 115 THR HB . . 4.030 2.245 2.000 2.693 . 0 0 "[ . 1 . 2]" 1
1771 1 88 LEU HA 1 115 THR HG1 . . 3.720 2.196 1.994 2.421 . 0 0 "[ . 1 . 2]" 1
1772 1 88 LEU HA 1 115 THR MG . . 4.180 3.155 2.891 3.409 . 0 0 "[ . 1 . 2]" 1
1773 1 88 LEU HB2 1 88 LEU MD1 . . 3.270 2.181 1.995 2.395 . 0 0 "[ . 1 . 2]" 1
1774 1 88 LEU HB2 1 89 ASP H . . 3.710 3.271 3.076 3.503 . 0 0 "[ . 1 . 2]" 1
1775 1 88 LEU HB2 1 89 ASP HB2 . . 4.320 4.063 3.684 4.322 0.002 1 0 "[ . 1 . 2]" 1
1776 1 88 LEU HB2 1 90 THR H . . 5.500 5.291 5.023 5.523 0.023 9 0 "[ . 1 . 2]" 1
1777 1 88 LEU HB3 1 88 LEU MD2 . . 3.180 2.271 2.131 2.405 . 0 0 "[ . 1 . 2]" 1
1778 1 88 LEU HB3 1 89 ASP H . . 3.860 2.328 2.118 2.520 . 0 0 "[ . 1 . 2]" 1
1779 1 88 LEU HB3 1 117 LYS QE . . 2.690 1.963 1.896 2.066 . 0 0 "[ . 1 . 2]" 1
1780 1 88 LEU MD1 1 89 ASP H . . 4.580 4.416 4.185 4.581 0.001 7 0 "[ . 1 . 2]" 1
1781 1 88 LEU MD1 1 117 LYS HA . . 3.480 2.957 2.520 3.325 . 0 0 "[ . 1 . 2]" 1
1782 1 88 LEU MD1 1 117 LYS QE . . 3.420 2.702 2.350 3.217 . 0 0 "[ . 1 . 2]" 1
1783 1 88 LEU MD1 1 118 ALA H . . 3.920 2.821 2.494 3.040 . 0 0 "[ . 1 . 2]" 1
1784 1 88 LEU MD1 1 118 ALA HA . . 4.370 4.228 3.929 4.372 0.002 7 0 "[ . 1 . 2]" 1
1785 1 88 LEU MD1 1 118 ALA MB . . 3.150 2.740 2.362 2.881 . 0 0 "[ . 1 . 2]" 1
1786 1 88 LEU MD2 1 89 ASP H . . 3.780 3.620 3.377 3.782 0.002 8 0 "[ . 1 . 2]" 1
1787 1 88 LEU MD2 1 115 THR HB . . 4.480 2.703 2.425 3.217 . 0 0 "[ . 1 . 2]" 1
1788 1 88 LEU MD2 1 115 THR HG1 . . 4.120 3.969 3.601 4.123 0.003 12 0 "[ . 1 . 2]" 1
1789 1 88 LEU MD2 1 115 THR MG . . 3.870 3.534 3.316 3.875 0.005 9 0 "[ . 1 . 2]" 1
1790 1 88 LEU MD2 1 116 PRO HB2 . . 4.680 4.205 3.864 4.680 . 0 0 "[ . 1 . 2]" 1
1791 1 88 LEU MD2 1 116 PRO QD . . 5.270 3.242 2.845 3.777 . 0 0 "[ . 1 . 2]" 1
1792 1 88 LEU MD2 1 117 LYS QE . . 3.830 3.395 3.071 3.600 . 0 0 "[ . 1 . 2]" 1
1793 1 88 LEU MD2 1 118 ALA H . . 4.570 3.989 3.475 4.343 . 0 0 "[ . 1 . 2]" 1
1794 1 88 LEU MD2 1 118 ALA HA . . 4.830 4.753 4.242 4.836 0.006 2 0 "[ . 1 . 2]" 1
1795 1 88 LEU MD2 1 118 ALA MB . . 4.090 4.004 3.620 4.093 0.003 5 0 "[ . 1 . 2]" 1
1796 1 88 LEU HG 1 117 LYS QE . . 4.960 4.419 4.211 4.591 . 0 0 "[ . 1 . 2]" 1
1797 1 89 ASP H 1 89 ASP HB2 . . 3.860 2.947 2.812 3.070 . 0 0 "[ . 1 . 2]" 1
1798 1 89 ASP H 1 89 ASP HB3 . . 4.150 3.460 3.331 3.654 . 0 0 "[ . 1 . 2]" 1
1799 1 89 ASP H 1 90 THR H . . 3.680 2.959 2.832 3.166 . 0 0 "[ . 1 . 2]" 1
1800 1 89 ASP H 1 115 THR HB . . 4.350 3.420 3.185 3.702 . 0 0 "[ . 1 . 2]" 1
1801 1 89 ASP H 1 115 THR HG1 . . 4.100 3.153 2.815 3.443 . 0 0 "[ . 1 . 2]" 1
1802 1 89 ASP H 1 115 THR MG . . 4.690 4.471 4.310 4.596 . 0 0 "[ . 1 . 2]" 1
1803 1 89 ASP H 1 117 LYS HD2 . . 4.320 3.890 3.626 4.184 . 0 0 "[ . 1 . 2]" 1
1804 1 89 ASP H 1 117 LYS QE . . 4.660 2.380 2.167 2.907 . 0 0 "[ . 1 . 2]" 1
1805 1 89 ASP H 1 117 LYS HG2 . . 4.430 3.504 3.300 3.777 . 0 0 "[ . 1 . 2]" 1
1806 1 89 ASP HA 1 90 THR H . . 3.280 2.767 2.614 2.897 . 0 0 "[ . 1 . 2]" 1
1807 1 89 ASP HA 1 114 ARG QG . . 4.420 3.464 2.868 3.864 . 0 0 "[ . 1 . 2]" 1
1808 1 89 ASP HA 1 117 LYS HD2 . . 4.950 3.754 3.427 4.070 . 0 0 "[ . 1 . 2]" 1
1809 1 89 ASP HB2 1 90 THR H . . 4.720 4.626 4.530 4.655 . 0 0 "[ . 1 . 2]" 1
1810 1 89 ASP HB2 1 117 LYS HD2 . . 4.360 2.198 2.000 2.481 . 0 0 "[ . 1 . 2]" 1
1811 1 89 ASP HB2 1 117 LYS HG2 . . 3.980 3.849 3.594 3.983 0.003 2 0 "[ . 1 . 2]" 1
1812 1 89 ASP HB2 1 117 LYS HG3 . . 4.580 4.393 4.166 4.560 . 0 0 "[ . 1 . 2]" 1
1813 1 89 ASP HB3 1 90 THR H . . 4.360 4.250 4.124 4.374 0.014 14 0 "[ . 1 . 2]" 1
1814 1 90 THR H 1 90 THR HB . . 3.400 2.839 2.720 2.962 . 0 0 "[ . 1 . 2]" 1
1815 1 90 THR H 1 90 THR MG . . 4.000 3.901 3.770 3.978 . 0 0 "[ . 1 . 2]" 1
1816 1 90 THR H 1 92 TYR QD . . 4.820 4.278 4.042 4.493 . 0 0 "[ . 1 . 2]" 1
1817 1 90 THR H 1 92 TYR QE . . 4.920 4.717 4.582 4.891 . 0 0 "[ . 1 . 2]" 1
1818 1 90 THR H 1 114 ARG HA . . 4.780 4.520 4.089 4.783 0.003 8 0 "[ . 1 . 2]" 1
1819 1 90 THR H 1 114 ARG HG2 . . 4.510 4.125 3.541 4.419 . 0 0 "[ . 1 . 2]" 1
1820 1 90 THR H 1 114 ARG HG3 . . 4.510 4.135 3.434 4.453 . 0 0 "[ . 1 . 2]" 1
1821 1 90 THR H 1 115 THR H . . 3.470 3.020 2.520 3.334 . 0 0 "[ . 1 . 2]" 1
1822 1 90 THR H 1 115 THR HB . . 4.200 3.930 3.738 4.118 . 0 0 "[ . 1 . 2]" 1
1823 1 90 THR H 1 115 THR HG1 . . 3.330 2.017 1.898 2.228 . 0 0 "[ . 1 . 2]" 1
1824 1 90 THR H 1 115 THR MG . . 4.000 3.515 3.350 3.740 . 0 0 "[ . 1 . 2]" 1
1825 1 90 THR HB 1 92 TYR QE . . 3.430 2.205 2.057 2.446 . 0 0 "[ . 1 . 2]" 1
1826 1 90 THR HB 1 115 THR HG1 . . 3.980 2.928 2.550 3.303 . 0 0 "[ . 1 . 2]" 1
1827 1 90 THR HB 1 115 THR MG . . 4.320 3.667 3.409 3.889 . 0 0 "[ . 1 . 2]" 1
1828 1 90 THR HG1 1 92 TYR QE . . 5.120 4.120 3.244 4.745 . 0 0 "[ . 1 . 2]" 1
1829 1 90 THR MG 1 91 PRO HB2 . . 5.260 4.475 4.283 4.690 . 0 0 "[ . 1 . 2]" 1
1830 1 90 THR MG 1 91 PRO HD2 . . 3.990 2.022 1.855 2.434 . 0 0 "[ . 1 . 2]" 1
1831 1 90 THR MG 1 91 PRO QD . . 3.410 2.006 1.844 2.404 . 0 0 "[ . 1 . 2]" 1
1832 1 90 THR MG 1 91 PRO HD3 . . 3.990 3.384 3.190 3.727 . 0 0 "[ . 1 . 2]" 1
1833 1 90 THR MG 1 91 PRO HG2 . . 4.770 3.208 2.971 3.583 . 0 0 "[ . 1 . 2]" 1
1834 1 90 THR MG 1 91 PRO QG . . 4.170 3.110 2.890 3.459 . 0 0 "[ . 1 . 2]" 1
1835 1 90 THR MG 1 91 PRO HG3 . . 4.770 4.175 3.938 4.564 . 0 0 "[ . 1 . 2]" 1
1836 1 90 THR MG 1 92 TYR QD . . 4.180 2.667 2.130 3.391 . 0 0 "[ . 1 . 2]" 1
1837 1 90 THR MG 1 92 TYR QE . . 3.670 2.221 1.942 2.854 . 0 0 "[ . 1 . 2]" 1
1838 1 90 THR MG 1 115 THR HG1 . . 4.730 4.341 4.029 4.732 0.002 1 0 "[ . 1 . 2]" 1
1839 1 91 PRO HA 1 92 TYR H . . 3.010 2.178 2.150 2.227 . 0 0 "[ . 1 . 2]" 1
1840 1 91 PRO HA 1 114 ARG HA . . 3.850 2.495 2.008 2.852 . 0 0 "[ . 1 . 2]" 1
1841 1 91 PRO HA 1 114 ARG QB . . 4.550 4.035 3.661 4.384 . 0 0 "[ . 1 . 2]" 1
1842 1 91 PRO HA 1 114 ARG QG . . 4.250 3.298 2.985 3.688 . 0 0 "[ . 1 . 2]" 1
1843 1 91 PRO HA 1 115 THR H . . 3.990 3.728 3.272 4.005 0.015 9 0 "[ . 1 . 2]" 1
1844 1 91 PRO HB2 1 92 TYR H . . 4.100 3.842 3.548 4.023 . 0 0 "[ . 1 . 2]" 1
1845 1 91 PRO HB2 1 93 TYR QE . . 4.310 3.752 3.327 4.047 . 0 0 "[ . 1 . 2]" 1
1846 1 91 PRO HB2 1 112 GLN QE . . 4.670 3.071 1.925 4.671 0.001 5 0 "[ . 1 . 2]" 1
1847 1 91 PRO HB3 1 92 TYR H . . 4.560 4.220 4.011 4.356 . 0 0 "[ . 1 . 2]" 1
1848 1 91 PRO HB3 1 114 ARG HA . . 4.530 4.146 3.348 4.535 0.005 7 0 "[ . 1 . 2]" 1
1849 1 92 TYR H 1 92 TYR HB2 . . 4.010 2.363 2.287 2.550 . 0 0 "[ . 1 . 2]" 1
1850 1 92 TYR H 1 92 TYR QB . . 3.400 2.330 2.260 2.503 . 0 0 "[ . 1 . 2]" 1
1851 1 92 TYR H 1 92 TYR HB3 . . 4.010 3.547 3.510 3.631 . 0 0 "[ . 1 . 2]" 1
1852 1 92 TYR H 1 92 TYR QD . . 3.880 3.095 2.966 3.488 . 0 0 "[ . 1 . 2]" 1
1853 1 92 TYR H 1 94 PHE QE . . 4.600 4.234 3.595 4.600 0.000 6 0 "[ . 1 . 2]" 1
1854 1 92 TYR H 1 113 PHE H . . 3.840 3.448 3.077 3.819 . 0 0 "[ . 1 . 2]" 1
1855 1 92 TYR H 1 114 ARG HA . . 3.610 3.269 3.043 3.445 . 0 0 "[ . 1 . 2]" 1
1856 1 92 TYR H 1 114 ARG QG . . 5.050 4.804 4.487 5.014 . 0 0 "[ . 1 . 2]" 1
1857 1 92 TYR H 1 115 THR H . . 4.350 3.975 3.547 4.312 . 0 0 "[ . 1 . 2]" 1
1858 1 92 TYR H 1 115 THR MG . . 4.820 3.929 3.497 4.426 . 0 0 "[ . 1 . 2]" 1
1859 1 92 TYR HA 1 92 TYR QD . . 4.530 3.022 2.894 3.048 . 0 0 "[ . 1 . 2]" 1
1860 1 92 TYR HA 1 93 TYR H . . 3.060 2.192 2.143 2.277 . 0 0 "[ . 1 . 2]" 1
1861 1 92 TYR HA 1 93 TYR HB2 . . 4.900 4.793 4.646 4.878 . 0 0 "[ . 1 . 2]" 1
1862 1 92 TYR HA 1 93 TYR QE . . 4.300 4.241 4.129 4.306 0.006 2 0 "[ . 1 . 2]" 1
1863 1 92 TYR QB 1 93 TYR H . . 3.880 3.094 2.804 3.331 . 0 0 "[ . 1 . 2]" 1
1864 1 92 TYR QB 1 94 PHE HZ . . 3.890 2.757 2.284 3.216 . 0 0 "[ . 1 . 2]" 1
1865 1 92 TYR HB2 1 93 TYR H . . 4.420 4.289 4.112 4.426 0.006 10 0 "[ . 1 . 2]" 1
1866 1 92 TYR HB2 1 94 PHE QE . . 4.080 3.114 2.666 3.409 . 0 0 "[ . 1 . 2]" 1
1867 1 92 TYR HB2 1 94 PHE HZ . . 4.430 3.238 2.471 3.909 . 0 0 "[ . 1 . 2]" 1
1868 1 92 TYR HB3 1 93 TYR H . . 4.420 3.174 2.854 3.445 . 0 0 "[ . 1 . 2]" 1
1869 1 92 TYR HB3 1 94 PHE QE . . 4.080 3.056 2.621 3.332 . 0 0 "[ . 1 . 2]" 1
1870 1 92 TYR HB3 1 94 PHE HZ . . 4.430 3.002 2.689 3.421 . 0 0 "[ . 1 . 2]" 1
1871 1 92 TYR QD 1 93 TYR H . . 4.140 3.778 3.394 4.066 . 0 0 "[ . 1 . 2]" 1
1872 1 92 TYR QD 1 94 PHE HZ . . 4.520 4.008 3.514 4.359 . 0 0 "[ . 1 . 2]" 1
1873 1 92 TYR QD 1 115 THR H . . 4.710 4.212 3.791 4.639 . 0 0 "[ . 1 . 2]" 1
1874 1 92 TYR QD 1 115 THR MG . . 3.360 2.651 2.093 3.035 . 0 0 "[ . 1 . 2]" 1
1875 1 92 TYR QE 1 115 THR MG . . 3.960 3.620 3.096 3.959 . 0 0 "[ . 1 . 2]" 1
1876 1 93 TYR H 1 93 TYR HB2 . . 3.790 2.718 2.647 2.783 . 0 0 "[ . 1 . 2]" 1
1877 1 93 TYR H 1 93 TYR HB3 . . 4.100 3.724 3.637 3.798 . 0 0 "[ . 1 . 2]" 1
1878 1 93 TYR H 1 93 TYR QD . . 3.490 2.287 1.928 2.613 . 0 0 "[ . 1 . 2]" 1
1879 1 93 TYR H 1 93 TYR QE . . 4.520 4.185 3.795 4.516 . 0 0 "[ . 1 . 2]" 1
1880 1 93 TYR HA 1 93 TYR QD . . 3.850 3.079 2.939 3.186 . 0 0 "[ . 1 . 2]" 1
1881 1 93 TYR HA 1 94 PHE H . . 3.120 2.155 2.138 2.212 . 0 0 "[ . 1 . 2]" 1
1882 1 93 TYR HA 1 94 PHE QD . . 4.290 3.496 3.223 3.872 . 0 0 "[ . 1 . 2]" 1
1883 1 93 TYR HA 1 110 ALA MB . . 4.340 4.076 3.742 4.334 . 0 0 "[ . 1 . 2]" 1
1884 1 93 TYR HA 1 111 VAL H . . 4.440 4.122 3.641 4.357 . 0 0 "[ . 1 . 2]" 1
1885 1 93 TYR HA 1 111 VAL QG . . 4.750 4.405 4.267 4.594 . 0 0 "[ . 1 . 2]" 1
1886 1 93 TYR HA 1 112 GLN HA . . 3.740 2.637 2.374 2.832 . 0 0 "[ . 1 . 2]" 1
1887 1 93 TYR HA 1 113 PHE H . . 4.030 3.368 3.130 3.575 . 0 0 "[ . 1 . 2]" 1
1888 1 93 TYR HB2 1 94 PHE H . . 4.620 4.057 3.888 4.211 . 0 0 "[ . 1 . 2]" 1
1889 1 93 TYR HB2 1 110 ALA MB . . 3.830 3.457 3.196 3.756 . 0 0 "[ . 1 . 2]" 1
1890 1 93 TYR HB3 1 94 PHE H . . 3.990 3.331 2.973 3.558 . 0 0 "[ . 1 . 2]" 1
1891 1 93 TYR HB3 1 110 ALA MB . . 3.490 2.282 2.052 2.574 . 0 0 "[ . 1 . 2]" 1
1892 1 93 TYR HB3 1 111 VAL H . . 4.780 3.837 3.255 4.188 . 0 0 "[ . 1 . 2]" 1
1893 1 93 TYR QD 1 94 PHE H . . 5.210 4.552 4.196 4.737 . 0 0 "[ . 1 . 2]" 1
1894 1 93 TYR QD 1 110 ALA MB . . 3.230 2.746 2.396 3.074 . 0 0 "[ . 1 . 2]" 1
1895 1 93 TYR QD 1 111 VAL H . . 5.500 4.855 4.007 5.313 . 0 0 "[ . 1 . 2]" 1
1896 1 93 TYR QD 1 112 GLN H . . 4.850 3.889 3.438 4.303 . 0 0 "[ . 1 . 2]" 1
1897 1 93 TYR QD 1 112 GLN HA . . 4.460 2.931 2.554 3.211 . 0 0 "[ . 1 . 2]" 1
1898 1 93 TYR QD 1 112 GLN HB2 . . 4.510 2.687 2.196 2.909 . 0 0 "[ . 1 . 2]" 1
1899 1 93 TYR QD 1 112 GLN QB . . 3.820 2.662 2.183 2.875 . 0 0 "[ . 1 . 2]" 1
1900 1 93 TYR QD 1 112 GLN HB3 . . 4.510 4.329 3.858 4.512 0.002 3 0 "[ . 1 . 2]" 1
1901 1 93 TYR QD 1 112 GLN HG2 . . 5.010 4.784 4.206 4.993 . 0 0 "[ . 1 . 2]" 1
1902 1 93 TYR QD 1 112 GLN QG . . 4.270 3.381 2.946 3.682 . 0 0 "[ . 1 . 2]" 1
1903 1 93 TYR QD 1 112 GLN HG3 . . 5.010 3.458 3.009 3.797 . 0 0 "[ . 1 . 2]" 1
1904 1 93 TYR QE 1 110 ALA MB . . 4.800 4.379 4.023 4.708 . 0 0 "[ . 1 . 2]" 1
1905 1 93 TYR QE 1 112 GLN HA . . 4.890 4.083 3.643 4.484 . 0 0 "[ . 1 . 2]" 1
1906 1 93 TYR QE 1 112 GLN QB . . 3.430 2.833 2.107 3.256 . 0 0 "[ . 1 . 2]" 1
1907 1 93 TYR QE 1 112 GLN QE . . 4.440 3.346 2.240 4.213 . 0 0 "[ . 1 . 2]" 1
1908 1 93 TYR QE 1 112 GLN QG . . 3.440 2.836 2.288 3.274 . 0 0 "[ . 1 . 2]" 1
1909 1 94 PHE H 1 94 PHE HB2 . . 3.790 2.656 2.542 2.763 . 0 0 "[ . 1 . 2]" 1
1910 1 94 PHE H 1 94 PHE QD . . 3.650 2.535 2.105 2.888 . 0 0 "[ . 1 . 2]" 1
1911 1 94 PHE H 1 94 PHE QE . . 5.500 4.510 4.155 4.848 . 0 0 "[ . 1 . 2]" 1
1912 1 94 PHE H 1 95 LYS H . . 4.640 4.503 4.440 4.540 . 0 0 "[ . 1 . 2]" 1
1913 1 94 PHE H 1 110 ALA MB . . 4.870 4.372 3.902 4.746 . 0 0 "[ . 1 . 2]" 1
1914 1 94 PHE H 1 111 VAL HB . . 3.940 2.868 2.608 3.103 . 0 0 "[ . 1 . 2]" 1
1915 1 94 PHE H 1 111 VAL QG . . 4.310 3.549 3.347 3.771 . 0 0 "[ . 1 . 2]" 1
1916 1 94 PHE H 1 112 GLN HA . . 4.290 4.079 3.854 4.283 . 0 0 "[ . 1 . 2]" 1
1917 1 94 PHE H 1 113 PHE H . . 4.920 4.413 3.975 4.696 . 0 0 "[ . 1 . 2]" 1
1918 1 94 PHE HA 1 94 PHE QD . . 3.990 2.987 2.791 3.161 . 0 0 "[ . 1 . 2]" 1
1919 1 94 PHE HA 1 95 LYS H . . 3.040 2.310 2.246 2.477 . 0 0 "[ . 1 . 2]" 1
1920 1 94 PHE HB2 1 95 LYS H . . 4.350 3.713 3.331 3.904 . 0 0 "[ . 1 . 2]" 1
1921 1 94 PHE HB2 1 111 VAL H . . 4.610 4.102 3.781 4.427 . 0 0 "[ . 1 . 2]" 1
1922 1 94 PHE HB2 1 111 VAL HB . . 4.180 2.694 2.435 2.902 . 0 0 "[ . 1 . 2]" 1
1923 1 94 PHE HB2 1 111 VAL QG . . 3.690 3.290 3.035 3.446 . 0 0 "[ . 1 . 2]" 1
1924 1 94 PHE HB3 1 95 LYS H . . 3.920 2.692 2.330 2.870 . 0 0 "[ . 1 . 2]" 1
1925 1 94 PHE HB3 1 111 VAL HB . . 4.450 4.316 3.947 4.453 0.003 2 0 "[ . 1 . 2]" 1
1926 1 94 PHE HB3 1 111 VAL QG . . 4.610 4.434 4.103 4.564 . 0 0 "[ . 1 . 2]" 1
1927 1 94 PHE QD 1 95 LYS H . . 4.280 4.026 3.850 4.240 . 0 0 "[ . 1 . 2]" 1
1928 1 94 PHE QD 1 111 VAL HB . . 4.670 3.450 3.067 3.826 . 0 0 "[ . 1 . 2]" 1
1929 1 94 PHE QD 1 111 VAL QG . . 3.900 3.234 2.934 3.465 . 0 0 "[ . 1 . 2]" 1
1930 1 94 PHE QE 1 111 VAL QG . . 4.980 4.671 4.256 4.961 . 0 0 "[ . 1 . 2]" 1
1931 1 94 PHE QE 1 113 PHE H . . 4.120 3.584 3.040 4.021 . 0 0 "[ . 1 . 2]" 1
1932 1 94 PHE QE 1 113 PHE HB2 . . 4.360 3.811 3.596 4.285 . 0 0 "[ . 1 . 2]" 1
1933 1 94 PHE QE 1 113 PHE QB . . 3.630 2.131 1.988 2.580 . 0 0 "[ . 1 . 2]" 1
1934 1 94 PHE QE 1 113 PHE HB3 . . 4.360 2.142 1.998 2.601 . 0 0 "[ . 1 . 2]" 1
1935 1 95 LYS H 1 95 LYS HB2 . . 3.950 2.744 2.595 3.023 . 0 0 "[ . 1 . 2]" 1
1936 1 95 LYS H 1 95 LYS QG . . 4.020 3.302 2.473 3.674 . 0 0 "[ . 1 . 2]" 1
1937 1 95 LYS HA 1 95 LYS QD . . 4.830 3.901 3.640 4.315 . 0 0 "[ . 1 . 2]" 1
1938 1 95 LYS HA 1 96 ILE H . . 3.160 2.198 2.153 2.288 . 0 0 "[ . 1 . 2]" 1
1939 1 95 LYS HA 1 108 SER HG . . 4.430 3.095 2.418 4.128 . 0 0 "[ . 1 . 2]" 1
1940 1 95 LYS HB2 1 95 LYS QD . . 3.430 2.619 2.170 3.051 . 0 0 "[ . 1 . 2]" 1
1941 1 95 LYS HB2 1 95 LYS QE . . 4.420 3.409 2.142 4.135 . 0 0 "[ . 1 . 2]" 1
1942 1 95 LYS HB2 1 96 ILE H . . 4.270 4.151 3.927 4.271 0.001 15 0 "[ . 1 . 2]" 1
1943 1 95 LYS HB3 1 95 LYS QD . . 3.850 2.309 2.064 2.816 . 0 0 "[ . 1 . 2]" 1
1944 1 95 LYS HB3 1 96 ILE H . . 4.500 3.090 2.773 3.352 . 0 0 "[ . 1 . 2]" 1
1945 1 95 LYS HB3 1 108 SER H . . 4.540 3.721 3.121 4.086 . 0 0 "[ . 1 . 2]" 1
1946 1 95 LYS QD 1 107 MET HB2 . . 4.300 3.898 2.876 4.306 0.006 2 0 "[ . 1 . 2]" 1
1947 1 95 LYS QD 1 107 MET HB3 . . 3.930 2.770 1.993 3.413 . 0 0 "[ . 1 . 2]" 1
1948 1 95 LYS QD 1 110 ALA MB . . 3.900 3.541 2.874 3.902 0.002 10 0 "[ . 1 . 2]" 1
1949 1 95 LYS QE 1 110 ALA MB . . 4.710 2.797 1.999 4.354 . 0 0 "[ . 1 . 2]" 1
1950 1 95 LYS HE2 1 95 LYS QG . . 3.810 2.446 2.083 3.282 . 0 0 "[ . 1 . 2]" 1
1951 1 95 LYS HE3 1 95 LYS QG . . 3.810 2.755 2.104 3.400 . 0 0 "[ . 1 . 2]" 1
1952 1 95 LYS QG 1 108 SER H . . 5.500 4.609 3.940 5.470 . 0 0 "[ . 1 . 2]" 1
1953 1 95 LYS QG 1 110 ALA MB . . 3.590 3.105 2.765 3.448 . 0 0 "[ . 1 . 2]" 1
1954 1 95 LYS QG 1 111 VAL H . . 4.220 3.268 2.830 3.605 . 0 0 "[ . 1 . 2]" 1
1955 1 96 ILE H 1 96 ILE HB . . 3.600 2.648 2.531 2.806 . 0 0 "[ . 1 . 2]" 1
1956 1 96 ILE H 1 96 ILE HG12 . . 4.770 4.066 3.925 4.287 . 0 0 "[ . 1 . 2]" 1
1957 1 96 ILE H 1 96 ILE HG13 . . 4.320 2.705 2.543 2.953 . 0 0 "[ . 1 . 2]" 1
1958 1 96 ILE H 1 96 ILE MG . . 3.960 3.852 3.794 3.917 . 0 0 "[ . 1 . 2]" 1
1959 1 96 ILE H 1 97 GLN H . . 4.880 4.487 4.409 4.566 . 0 0 "[ . 1 . 2]" 1
1960 1 96 ILE H 1 108 SER H . . 3.680 3.552 3.227 3.683 0.003 5 0 "[ . 1 . 2]" 1
1961 1 96 ILE H 1 108 SER HB2 . . 4.590 4.101 3.689 4.570 . 0 0 "[ . 1 . 2]" 1
1962 1 96 ILE H 1 108 SER QB . . 4.040 3.237 2.177 3.995 . 0 0 "[ . 1 . 2]" 1
1963 1 96 ILE H 1 108 SER HB3 . . 4.590 3.449 2.191 4.409 . 0 0 "[ . 1 . 2]" 1
1964 1 96 ILE H 1 108 SER HG . . 3.570 2.619 1.977 3.445 . 0 0 "[ . 1 . 2]" 1
1965 1 96 ILE HA 1 96 ILE HG12 . . 3.000 2.785 2.511 2.918 . 0 0 "[ . 1 . 2]" 1
1966 1 96 ILE HA 1 96 ILE HG13 . . 4.100 2.802 2.691 2.974 . 0 0 "[ . 1 . 2]" 1
1967 1 96 ILE HA 1 96 ILE MG . . 3.670 2.381 2.280 2.465 . 0 0 "[ . 1 . 2]" 1
1968 1 96 ILE HA 1 97 GLN H . . 3.190 2.255 2.206 2.365 . 0 0 "[ . 1 . 2]" 1
1969 1 96 ILE HA 1 97 GLN QB . . 4.600 3.974 3.916 4.191 . 0 0 "[ . 1 . 2]" 1
1970 1 96 ILE HB 1 96 ILE MD . . 3.430 2.278 2.118 2.376 . 0 0 "[ . 1 . 2]" 1
1971 1 96 ILE HB 1 97 GLN H . . 3.970 3.846 3.548 3.959 . 0 0 "[ . 1 . 2]" 1
1972 1 96 ILE HB 1 108 SER H . . 5.500 4.861 4.248 5.447 . 0 0 "[ . 1 . 2]" 1
1973 1 96 ILE MD 1 96 ILE MG . . 3.090 2.264 1.988 2.466 . 0 0 "[ . 1 . 2]" 1
1974 1 96 ILE HG12 1 96 ILE MG . . 3.610 2.193 2.053 2.359 . 0 0 "[ . 1 . 2]" 1
1975 1 96 ILE HG13 1 96 ILE MG . . 3.420 3.156 3.129 3.202 . 0 0 "[ . 1 . 2]" 1
1976 1 96 ILE HG13 1 97 GLN H . . 4.830 4.783 4.684 4.834 0.004 6 0 "[ . 1 . 2]" 1
1977 1 96 ILE MG 1 97 GLN H . . 3.580 2.057 1.859 2.288 . 0 0 "[ . 1 . 2]" 1
1978 1 97 GLN H 1 97 GLN QB . . 3.440 2.763 2.599 3.214 . 0 0 "[ . 1 . 2]" 1
1979 1 97 GLN H 1 97 GLN QG . . 4.220 3.888 2.644 4.210 . 0 0 "[ . 1 . 2]" 1
1980 1 97 GLN H 1 98 ALA H . . 5.010 4.313 4.224 4.427 . 0 0 "[ . 1 . 2]" 1
1981 1 97 GLN QB 1 97 GLN QE . . 3.700 2.802 1.800 3.267 . 0 0 "[ . 1 . 2]" 1
1982 1 97 GLN QB 1 98 ALA H . . 4.220 3.398 2.159 3.699 . 0 0 "[ . 1 . 2]" 1
1983 1 97 GLN QB 1 107 MET HA . . 4.460 2.789 2.309 3.527 . 0 0 "[ . 1 . 2]" 1
1984 1 97 GLN QB 1 108 SER H . . 4.490 3.793 3.232 4.394 . 0 0 "[ . 1 . 2]" 1
1985 1 97 GLN QE 1 104 MET ME . . 3.940 3.469 2.507 3.959 0.019 3 0 "[ . 1 . 2]" 1
1986 1 97 GLN QE 1 104 MET QG . . 5.180 3.615 2.508 4.248 . 0 0 "[ . 1 . 2]" 1
1987 1 97 GLN QE 1 107 MET H . . 5.340 4.573 3.262 5.361 0.021 3 0 "[ . 1 . 2]" 1
1988 1 97 GLN QE 1 107 MET ME . . 3.290 2.325 1.859 2.852 . 0 0 "[ . 1 . 2]" 1
1989 1 97 GLN QE 1 107 MET QG . . 4.760 2.991 2.131 4.524 . 0 0 "[ . 1 . 2]" 1
1990 1 97 GLN HE21 1 104 MET HB2 . . 4.570 3.620 2.419 4.580 0.010 19 0 "[ . 1 . 2]" 1
1991 1 97 GLN HE21 1 104 MET HB3 . . 4.230 3.007 1.900 4.231 0.001 20 0 "[ . 1 . 2]" 1
1992 1 97 GLN HE21 1 107 MET ME . . 3.900 3.046 2.361 3.624 . 0 0 "[ . 1 . 2]" 1
1993 1 97 GLN HE22 1 104 MET HB2 . . 4.570 3.021 2.226 3.875 . 0 0 "[ . 1 . 2]" 1
1994 1 97 GLN HE22 1 104 MET HB3 . . 4.230 2.868 2.251 3.573 . 0 0 "[ . 1 . 2]" 1
1995 1 97 GLN HE22 1 107 MET ME . . 3.900 2.501 1.891 3.381 . 0 0 "[ . 1 . 2]" 1
1996 1 97 GLN QG 1 98 ALA H . . 4.050 2.433 1.996 3.576 . 0 0 "[ . 1 . 2]" 1
1997 1 98 ALA H 1 98 ALA MB . . 3.510 2.368 2.196 2.666 . 0 0 "[ . 1 . 2]" 1
1998 1 98 ALA H 1 99 ARG H . . 4.710 4.473 4.300 4.558 . 0 0 "[ . 1 . 2]" 1
1999 1 98 ALA H 1 105 GLY H . . 4.660 3.897 3.415 4.256 . 0 0 "[ . 1 . 2]" 1
2000 1 98 ALA MB 1 99 ARG H . . 3.330 2.893 2.415 3.263 . 0 0 "[ . 1 . 2]" 1
2001 1 98 ALA MB 1 105 GLY H . . 4.680 4.476 4.125 4.701 0.021 3 0 "[ . 1 . 2]" 1
2002 1 99 ARG H 1 99 ARG HG2 . . 4.690 3.236 2.382 4.124 . 0 0 "[ . 1 . 2]" 1
2003 1 99 ARG H 1 99 ARG QG . . 4.050 3.048 2.360 3.832 . 0 0 "[ . 1 . 2]" 1
2004 1 99 ARG H 1 99 ARG HG3 . . 4.690 3.852 2.750 4.720 0.030 6 0 "[ . 1 . 2]" 1
2005 1 99 ARG H 1 100 ASN H . . 4.630 4.379 4.250 4.495 . 0 0 "[ . 1 . 2]" 1
2006 1 99 ARG HA 1 100 ASN H . . 2.940 2.262 2.190 2.348 . 0 0 "[ . 1 . 2]" 1
2007 1 99 ARG HA 1 103 GLY H . . 4.990 4.697 4.445 4.981 . 0 0 "[ . 1 . 2]" 1
2008 1 99 ARG HA 1 105 GLY H . . 3.970 3.573 2.920 3.966 . 0 0 "[ . 1 . 2]" 1
2009 1 99 ARG HB2 1 99 ARG HD2 . . 3.960 2.711 2.118 3.895 . 0 0 "[ . 1 . 2]" 1
2010 1 99 ARG HB2 1 99 ARG HD3 . . 3.960 2.836 2.397 3.311 . 0 0 "[ . 1 . 2]" 1
2011 1 99 ARG HB2 1 100 ASN H . . 4.200 3.173 2.592 3.793 . 0 0 "[ . 1 . 2]" 1
2012 1 99 ARG HB2 1 103 GLY H . . 5.460 4.965 4.355 5.480 0.020 10 0 "[ . 1 . 2]" 1
2013 1 99 ARG HB2 1 104 MET ME . . 5.420 4.744 4.415 5.216 . 0 0 "[ . 1 . 2]" 1
2014 1 99 ARG HB2 1 104 MET QG . . 4.040 2.096 1.931 3.498 . 0 0 "[ . 1 . 2]" 1
2015 1 99 ARG HB2 1 105 GLY H . . 4.480 4.220 3.909 4.493 0.013 19 0 "[ . 1 . 2]" 1
2016 1 99 ARG HB3 1 100 ASN H . . 4.750 4.113 3.902 4.298 . 0 0 "[ . 1 . 2]" 1
2017 1 99 ARG HB3 1 104 MET ME . . 5.500 5.086 4.503 5.523 0.023 3 0 "[ . 1 . 2]" 1
2018 1 99 ARG HB3 1 104 MET QG . . 4.570 2.696 1.956 4.019 . 0 0 "[ . 1 . 2]" 1
2019 1 99 ARG QD 1 104 MET ME . . 4.250 3.694 3.142 4.255 0.005 16 0 "[ . 1 . 2]" 1
2020 1 99 ARG QD 1 104 MET QG . . 4.750 2.158 1.783 3.447 . 0 0 "[ . 1 . 2]" 1
2021 1 99 ARG HD2 1 104 MET ME . . 5.030 4.349 3.235 5.055 0.025 19 0 "[ . 1 . 2]" 1
2022 1 99 ARG HD3 1 104 MET ME . . 5.030 4.234 3.285 5.033 0.003 1 0 "[ . 1 . 2]" 1
2023 1 99 ARG QG 1 100 ASN H . . 3.940 3.085 2.093 3.913 . 0 0 "[ . 1 . 2]" 1
2024 1 100 ASN H 1 100 ASN QD . . 4.980 4.001 3.826 4.329 . 0 0 "[ . 1 . 2]" 1
2025 1 100 ASN H 1 102 LYS H . . 4.410 4.049 3.660 4.379 . 0 0 "[ . 1 . 2]" 1
2026 1 100 ASN H 1 103 GLY H . . 3.490 3.023 2.813 3.225 . 0 0 "[ . 1 . 2]" 1
2027 1 100 ASN QB 1 102 LYS H . . 4.790 2.867 2.424 3.308 . 0 0 "[ . 1 . 2]" 1
2028 1 101 SER H 1 102 LYS H . . 4.870 2.866 2.715 3.035 . 0 0 "[ . 1 . 2]" 1
2029 1 101 SER QB 1 102 LYS H . . 4.290 2.819 2.481 3.600 . 0 0 "[ . 1 . 2]" 1
2030 1 102 LYS H 1 102 LYS QB . . 3.160 2.305 2.162 2.523 . 0 0 "[ . 1 . 2]" 1
2031 1 102 LYS H 1 102 LYS QD . . 4.190 3.378 1.883 4.209 0.019 3 0 "[ . 1 . 2]" 1
2032 1 102 LYS H 1 102 LYS HG2 . . 4.040 2.966 2.078 4.101 0.061 10 0 "[ . 1 . 2]" 1
2033 1 102 LYS H 1 102 LYS HG3 . . 4.040 3.736 3.252 4.034 . 0 0 "[ . 1 . 2]" 1
2034 1 102 LYS H 1 103 GLY H . . 3.140 2.939 2.686 3.069 . 0 0 "[ . 1 . 2]" 1
2035 1 102 LYS HA 1 102 LYS QD . . 3.130 2.409 1.984 3.173 0.043 15 0 "[ . 1 . 2]" 1
2036 1 102 LYS HA 1 102 LYS QE . . 4.370 3.184 1.951 4.221 . 0 0 "[ . 1 . 2]" 1
2037 1 102 LYS HA 1 102 LYS HG2 . . 4.090 3.052 2.654 3.653 . 0 0 "[ . 1 . 2]" 1
2038 1 102 LYS HA 1 102 LYS HG3 . . 4.090 3.340 2.317 3.822 . 0 0 "[ . 1 . 2]" 1
2039 1 102 LYS QB 1 102 LYS QE . . 4.400 3.094 1.975 3.812 . 0 0 "[ . 1 . 2]" 1
2040 1 102 LYS QB 1 103 GLY H . . 3.530 2.049 1.899 2.216 . 0 0 "[ . 1 . 2]" 1
2041 1 102 LYS HB2 1 103 GLY H . . 4.400 2.129 1.923 2.337 . 0 0 "[ . 1 . 2]" 1
2042 1 102 LYS HB3 1 103 GLY H . . 4.400 2.765 2.504 3.137 . 0 0 "[ . 1 . 2]" 1
2043 1 102 LYS QD 1 103 GLY H . . 5.500 4.465 3.898 4.809 . 0 0 "[ . 1 . 2]" 1
2044 1 102 LYS QE 1 102 LYS QG . . 3.270 2.230 2.040 2.586 . 0 0 "[ . 1 . 2]" 1
2045 1 102 LYS QG 1 103 GLY H . . 4.760 3.931 3.660 4.230 . 0 0 "[ . 1 . 2]" 1
2046 1 102 LYS HG2 1 103 GLY H . . 5.500 4.371 3.952 4.723 . 0 0 "[ . 1 . 2]" 1
2047 1 102 LYS HG3 1 103 GLY H . . 5.500 4.460 4.201 4.774 . 0 0 "[ . 1 . 2]" 1
2048 1 103 GLY H 1 104 MET H . . 4.400 4.267 4.165 4.358 . 0 0 "[ . 1 . 2]" 1
2049 1 103 GLY QA 1 104 MET H . . 2.770 2.219 2.175 2.269 . 0 0 "[ . 1 . 2]" 1
2050 1 103 GLY QA 1 104 MET ME . . 4.770 4.473 3.588 4.773 0.003 13 0 "[ . 1 . 2]" 1
2051 1 103 GLY QA 1 104 MET QG . . 3.860 3.335 3.060 3.471 . 0 0 "[ . 1 . 2]" 1
2052 1 103 GLY HA2 1 104 MET H . . 3.170 2.845 2.689 2.966 . 0 0 "[ . 1 . 2]" 1
2053 1 103 GLY HA2 1 104 MET ME . . 5.500 4.876 3.885 5.278 . 0 0 "[ . 1 . 2]" 1
2054 1 103 GLY HA3 1 104 MET H . . 3.170 2.321 2.237 2.445 . 0 0 "[ . 1 . 2]" 1
2055 1 103 GLY HA3 1 104 MET ME . . 5.500 5.208 4.216 5.514 0.014 2 0 "[ . 1 . 2]" 1
2056 1 104 MET H 1 104 MET HB2 . . 3.210 2.741 2.466 3.455 0.245 20 0 "[ . 1 . 2]" 1
2057 1 104 MET H 1 104 MET HB3 . . 3.810 3.692 3.307 3.813 0.003 10 0 "[ . 1 . 2]" 1
2058 1 104 MET H 1 104 MET ME . . 4.210 3.711 2.855 4.055 . 0 0 "[ . 1 . 2]" 1
2059 1 104 MET H 1 104 MET HG2 . . 3.820 3.648 2.115 3.855 0.035 3 0 "[ . 1 . 2]" 1
2060 1 104 MET H 1 104 MET HG3 . . 3.820 2.633 2.033 2.924 . 0 0 "[ . 1 . 2]" 1
2061 1 104 MET H 1 105 GLY H . . 5.260 4.521 4.485 4.560 . 0 0 "[ . 1 . 2]" 1
2062 1 104 MET HB2 1 105 GLY H . . 3.980 3.320 2.109 3.884 . 0 0 "[ . 1 . 2]" 1
2063 1 104 MET HB3 1 105 GLY H . . 3.980 2.541 2.132 3.129 . 0 0 "[ . 1 . 2]" 1
2064 1 104 MET ME 1 105 GLY H . . 5.500 5.474 5.325 5.549 0.049 19 0 "[ . 1 . 2]" 1
2065 1 104 MET QG 1 105 GLY H . . 4.410 4.058 3.759 4.334 . 0 0 "[ . 1 . 2]" 1
2066 1 104 MET HG2 1 105 GLY H . . 5.180 4.449 3.960 4.924 . 0 0 "[ . 1 . 2]" 1
2067 1 104 MET HG3 1 105 GLY H . . 5.180 4.779 4.186 5.102 . 0 0 "[ . 1 . 2]" 1
2068 1 105 GLY H 1 106 PRO HD2 . . 5.150 4.246 4.055 4.404 . 0 0 "[ . 1 . 2]" 1
2069 1 105 GLY H 1 106 PRO QD . . 4.380 4.032 3.879 4.154 . 0 0 "[ . 1 . 2]" 1
2070 1 105 GLY H 1 106 PRO HD3 . . 5.150 5.027 4.940 5.091 . 0 0 "[ . 1 . 2]" 1
2071 1 105 GLY HA2 1 106 PRO HD2 . . 3.820 3.114 2.945 3.261 . 0 0 "[ . 1 . 2]" 1
2072 1 105 GLY HA2 1 106 PRO HD3 . . 3.820 2.825 2.660 2.984 . 0 0 "[ . 1 . 2]" 1
2073 1 105 GLY HA3 1 106 PRO HD2 . . 3.930 2.018 1.944 2.127 . 0 0 "[ . 1 . 2]" 1
2074 1 105 GLY HA3 1 106 PRO HD3 . . 3.930 2.808 2.656 2.980 . 0 0 "[ . 1 . 2]" 1
2075 1 105 GLY HA3 1 106 PRO QG . . 4.760 3.869 3.810 3.952 . 0 0 "[ . 1 . 2]" 1
2076 1 106 PRO HA 1 107 MET H . . 2.840 2.293 2.180 2.721 . 0 0 "[ . 1 . 2]" 1
2077 1 106 PRO QB 1 107 MET H . . 3.330 2.830 1.894 3.158 . 0 0 "[ . 1 . 2]" 1
2078 1 106 PRO HB2 1 107 MET H . . 3.820 2.957 1.909 3.344 . 0 0 "[ . 1 . 2]" 1
2079 1 106 PRO HB3 1 107 MET H . . 3.820 3.652 3.148 3.878 0.058 3 0 "[ . 1 . 2]" 1
2080 1 107 MET H 1 107 MET HB2 . . 3.120 2.460 2.231 2.634 . 0 0 "[ . 1 . 2]" 1
2081 1 107 MET H 1 107 MET HB3 . . 3.760 3.623 3.521 3.736 . 0 0 "[ . 1 . 2]" 1
2082 1 107 MET H 1 107 MET ME . . 4.850 4.499 3.492 4.857 0.007 16 0 "[ . 1 . 2]" 1
2083 1 107 MET H 1 107 MET QG . . 3.500 2.768 2.070 3.485 . 0 0 "[ . 1 . 2]" 1
2084 1 107 MET H 1 108 SER H . . 4.700 4.542 4.386 4.618 . 0 0 "[ . 1 . 2]" 1
2085 1 107 MET HA 1 107 MET ME . . 4.550 4.319 3.920 4.565 0.015 16 0 "[ . 1 . 2]" 1
2086 1 107 MET HA 1 107 MET QG . . 3.610 2.537 2.196 3.135 . 0 0 "[ . 1 . 2]" 1
2087 1 107 MET HA 1 108 SER H . . 3.030 2.228 2.143 2.317 . 0 0 "[ . 1 . 2]" 1
2088 1 107 MET HB2 1 107 MET ME . . 4.470 4.032 3.642 4.270 . 0 0 "[ . 1 . 2]" 1
2089 1 107 MET HB2 1 108 SER H . . 4.440 4.023 3.644 4.417 . 0 0 "[ . 1 . 2]" 1
2090 1 107 MET HB3 1 107 MET ME . . 4.460 4.032 3.569 4.296 . 0 0 "[ . 1 . 2]" 1
2091 1 107 MET HB3 1 108 SER H . . 3.730 2.971 2.676 3.459 . 0 0 "[ . 1 . 2]" 1
2092 1 107 MET ME 1 107 MET HG2 . . 3.410 2.490 2.089 2.847 . 0 0 "[ . 1 . 2]" 1
2093 1 107 MET ME 1 107 MET HG3 . . 3.410 2.488 2.124 2.899 . 0 0 "[ . 1 . 2]" 1
2094 1 108 SER H 1 108 SER HB2 . . 3.880 3.478 2.912 3.641 . 0 0 "[ . 1 . 2]" 1
2095 1 108 SER H 1 108 SER QB . . 3.370 2.477 2.145 2.725 . 0 0 "[ . 1 . 2]" 1
2096 1 108 SER H 1 108 SER HB3 . . 3.880 2.538 2.192 2.819 . 0 0 "[ . 1 . 2]" 1
2097 1 108 SER H 1 108 SER HG . . 4.200 3.485 2.454 4.203 0.003 5 0 "[ . 1 . 2]" 1
2098 1 108 SER HA 1 109 GLU H . . 3.080 2.471 2.344 2.560 . 0 0 "[ . 1 . 2]" 1
2099 1 108 SER QB 1 109 GLU H . . 3.230 2.499 2.112 3.174 . 0 0 "[ . 1 . 2]" 1
2100 1 108 SER HB2 1 109 GLU H . . 3.820 2.580 2.128 3.459 . 0 0 "[ . 1 . 2]" 1
2101 1 108 SER HB3 1 109 GLU H . . 3.820 3.714 3.523 3.820 0.000 14 0 "[ . 1 . 2]" 1
2102 1 108 SER HG 1 109 GLU H . . 4.060 3.351 2.522 4.009 . 0 0 "[ . 1 . 2]" 1
2103 1 109 GLU H 1 109 GLU HB2 . . 3.730 2.971 2.199 3.608 . 0 0 "[ . 1 . 2]" 1
2104 1 109 GLU H 1 109 GLU QB . . 3.000 2.387 2.177 2.581 . 0 0 "[ . 1 . 2]" 1
2105 1 109 GLU H 1 109 GLU HB3 . . 3.730 3.031 2.328 3.598 . 0 0 "[ . 1 . 2]" 1
2106 1 109 GLU H 1 109 GLU HG2 . . 4.000 2.864 1.924 3.752 . 0 0 "[ . 1 . 2]" 1
2107 1 109 GLU H 1 109 GLU QG . . 3.420 2.499 1.913 3.265 . 0 0 "[ . 1 . 2]" 1
2108 1 109 GLU H 1 109 GLU HG3 . . 4.000 3.294 2.292 3.997 . 0 0 "[ . 1 . 2]" 1
2109 1 109 GLU HA 1 109 GLU HG2 . . 4.100 3.102 2.214 3.828 . 0 0 "[ . 1 . 2]" 1
2110 1 109 GLU HA 1 109 GLU QG . . 3.570 2.902 2.171 3.401 . 0 0 "[ . 1 . 2]" 1
2111 1 109 GLU HA 1 109 GLU HG3 . . 4.100 3.628 2.816 4.204 0.104 6 0 "[ . 1 . 2]" 1
2112 1 109 GLU HA 1 110 ALA H . . 2.500 2.237 2.139 2.421 . 0 0 "[ . 1 . 2]" 1
2113 1 109 GLU HA 1 110 ALA MB . . 4.110 4.020 3.921 4.098 . 0 0 "[ . 1 . 2]" 1
2114 1 110 ALA MB 1 111 VAL H . . 3.410 3.271 2.862 3.410 . 20 0 "[ . 1 . 2]" 1
2115 1 110 ALA MB 1 111 VAL HA . . 5.230 4.297 4.027 4.388 . 0 0 "[ . 1 . 2]" 1
2116 1 111 VAL H 1 111 VAL HB . . 3.580 2.494 2.409 2.610 . 0 0 "[ . 1 . 2]" 1
2117 1 111 VAL H 1 111 VAL QG . . 3.260 2.497 2.230 2.769 . 0 0 "[ . 1 . 2]" 1
2118 1 111 VAL H 1 112 GLN H . . 4.590 4.259 4.059 4.375 . 0 0 "[ . 1 . 2]" 1
2119 1 111 VAL HA 1 111 VAL QG . . 2.930 2.082 2.043 2.161 . 0 0 "[ . 1 . 2]" 1
2120 1 111 VAL HA 1 112 GLN H . . 2.740 2.171 2.144 2.186 . 0 0 "[ . 1 . 2]" 1
2121 1 111 VAL HA 1 112 GLN HA . . 4.740 4.431 4.403 4.445 . 0 0 "[ . 1 . 2]" 1
2122 1 111 VAL HA 1 112 GLN QB . . 5.030 4.135 4.097 4.154 . 0 0 "[ . 1 . 2]" 1
2123 1 111 VAL HB 1 112 GLN H . . 4.560 4.415 4.341 4.467 . 0 0 "[ . 1 . 2]" 1
2124 1 111 VAL QG 1 112 GLN H . . 3.350 2.970 2.721 3.148 . 0 0 "[ . 1 . 2]" 1
2125 1 111 VAL QG 1 112 GLN HA . . 4.690 4.038 3.867 4.120 . 0 0 "[ . 1 . 2]" 1
2126 1 112 GLN H 1 112 GLN HB2 . . 3.660 2.571 2.438 2.753 . 0 0 "[ . 1 . 2]" 1
2127 1 112 GLN H 1 112 GLN QB . . 3.010 2.279 2.257 2.319 . 0 0 "[ . 1 . 2]" 1
2128 1 112 GLN H 1 112 GLN HB3 . . 3.660 2.556 2.398 2.677 . 0 0 "[ . 1 . 2]" 1
2129 1 112 GLN H 1 112 GLN HG2 . . 4.560 4.471 4.348 4.528 . 0 0 "[ . 1 . 2]" 1
2130 1 112 GLN H 1 112 GLN HG3 . . 4.560 4.475 4.392 4.560 0.000 5 0 "[ . 1 . 2]" 1
2131 1 112 GLN H 1 113 PHE H . . 4.690 4.375 4.259 4.537 . 0 0 "[ . 1 . 2]" 1
2132 1 112 GLN HA 1 112 GLN HG2 . . 3.930 3.063 2.740 3.316 . 0 0 "[ . 1 . 2]" 1
2133 1 112 GLN HA 1 112 GLN HG3 . . 3.930 2.532 2.371 2.794 . 0 0 "[ . 1 . 2]" 1
2134 1 112 GLN HA 1 113 PHE H . . 2.960 2.156 2.138 2.188 . 0 0 "[ . 1 . 2]" 1
2135 1 112 GLN QB 1 112 GLN QE . . 3.960 3.332 2.223 3.568 . 0 0 "[ . 1 . 2]" 1
2136 1 112 GLN QB 1 113 PHE H . . 4.430 3.885 3.723 3.973 . 0 0 "[ . 1 . 2]" 1
2137 1 112 GLN QG 1 113 PHE H . . 3.490 3.132 2.591 3.416 . 0 0 "[ . 1 . 2]" 1
2138 1 112 GLN QG 1 113 PHE HA . . 4.810 3.901 3.517 4.156 . 0 0 "[ . 1 . 2]" 1
2139 1 112 GLN HG2 1 113 PHE H . . 4.080 3.518 2.672 4.062 . 0 0 "[ . 1 . 2]" 1
2140 1 112 GLN HG3 1 113 PHE H . . 4.080 3.614 3.063 4.038 . 0 0 "[ . 1 . 2]" 1
2141 1 113 PHE H 1 113 PHE HB2 . . 3.920 3.290 3.113 3.466 . 0 0 "[ . 1 . 2]" 1
2142 1 113 PHE H 1 113 PHE HB3 . . 3.920 2.601 2.453 2.791 . 0 0 "[ . 1 . 2]" 1
2143 1 113 PHE H 1 113 PHE QD . . 4.310 4.091 3.863 4.253 . 0 0 "[ . 1 . 2]" 1
2144 1 113 PHE H 1 114 ARG H . . 4.500 4.183 4.018 4.348 . 0 0 "[ . 1 . 2]" 1
2145 1 113 PHE HA 1 113 PHE QD . . 3.850 3.001 2.691 3.158 . 0 0 "[ . 1 . 2]" 1
2146 1 113 PHE HA 1 113 PHE QE . . 5.290 4.804 4.643 4.943 . 0 0 "[ . 1 . 2]" 1
2147 1 113 PHE HA 1 114 ARG H . . 2.800 2.145 2.139 2.172 . 0 0 "[ . 1 . 2]" 1
2148 1 113 PHE HA 1 114 ARG HB2 . . 5.500 4.355 4.223 4.535 . 0 0 "[ . 1 . 2]" 1
2149 1 113 PHE HA 1 114 ARG QB . . 4.780 4.061 4.008 4.087 . 0 0 "[ . 1 . 2]" 1
2150 1 113 PHE HA 1 114 ARG HB3 . . 5.500 4.870 4.635 4.987 . 0 0 "[ . 1 . 2]" 1
2151 1 113 PHE QB 1 114 ARG H . . 4.030 3.842 3.687 3.918 . 0 0 "[ . 1 . 2]" 1
2152 1 113 PHE HB2 1 114 ARG H . . 4.670 4.240 4.108 4.374 . 0 0 "[ . 1 . 2]" 1
2153 1 113 PHE HB3 1 114 ARG H . . 4.670 4.398 4.171 4.463 . 0 0 "[ . 1 . 2]" 1
2154 1 113 PHE QD 1 114 ARG H . . 3.980 3.788 3.358 3.976 . 0 0 "[ . 1 . 2]" 1
2155 1 113 PHE QD 1 115 THR H . . 5.060 4.438 3.865 4.948 . 0 0 "[ . 1 . 2]" 1
2156 1 113 PHE QD 1 115 THR HA . . 4.170 3.682 3.213 4.156 . 0 0 "[ . 1 . 2]" 1
2157 1 113 PHE QD 1 115 THR MG . . 3.760 3.277 2.972 3.636 . 0 0 "[ . 1 . 2]" 1
2158 1 113 PHE QE 1 115 THR HA . . 3.700 2.540 2.112 3.045 . 0 0 "[ . 1 . 2]" 1
2159 1 113 PHE QE 1 115 THR HB . . 5.500 4.721 4.282 5.174 . 0 0 "[ . 1 . 2]" 1
2160 1 113 PHE QE 1 115 THR MG . . 3.660 3.057 2.421 3.642 . 0 0 "[ . 1 . 2]" 1
2161 1 113 PHE QE 1 116 PRO HD2 . . 4.610 3.555 3.092 3.975 . 0 0 "[ . 1 . 2]" 1
2162 1 113 PHE QE 1 116 PRO QD . . 4.050 2.625 2.239 3.079 . 0 0 "[ . 1 . 2]" 1
2163 1 113 PHE QE 1 116 PRO HD3 . . 4.610 2.711 2.272 3.238 . 0 0 "[ . 1 . 2]" 1
2164 1 113 PHE HZ 1 115 THR HA . . 4.660 4.130 3.423 4.652 . 0 0 "[ . 1 . 2]" 1
2165 1 113 PHE HZ 1 116 PRO QD . . 4.660 3.057 2.498 3.684 . 0 0 "[ . 1 . 2]" 1
2166 1 114 ARG H 1 114 ARG HB2 . . 3.510 2.359 2.259 2.557 . 0 0 "[ . 1 . 2]" 1
2167 1 114 ARG H 1 114 ARG QB . . 3.060 2.224 2.179 2.273 . 0 0 "[ . 1 . 2]" 1
2168 1 114 ARG H 1 114 ARG HB3 . . 3.510 2.753 2.523 2.861 . 0 0 "[ . 1 . 2]" 1
2169 1 114 ARG H 1 114 ARG HG2 . . 4.650 4.574 4.435 4.634 . 0 0 "[ . 1 . 2]" 1
2170 1 114 ARG H 1 114 ARG HG3 . . 4.650 4.316 4.215 4.513 . 0 0 "[ . 1 . 2]" 1
2171 1 114 ARG H 1 115 THR H . . 4.600 4.543 4.458 4.605 0.005 18 0 "[ . 1 . 2]" 1
2172 1 114 ARG HA 1 114 ARG HG2 . . 4.090 3.022 2.691 3.344 . 0 0 "[ . 1 . 2]" 1
2173 1 114 ARG HA 1 114 ARG HG3 . . 4.090 2.360 2.212 2.863 . 0 0 "[ . 1 . 2]" 1
2174 1 114 ARG HA 1 115 THR H . . 3.060 2.172 2.139 2.245 . 0 0 "[ . 1 . 2]" 1
2175 1 114 ARG QB 1 114 ARG QD . . 3.240 2.194 2.046 2.343 . 0 0 "[ . 1 . 2]" 1
2176 1 114 ARG QB 1 115 THR H . . 4.230 3.655 3.456 3.810 . 0 0 "[ . 1 . 2]" 1
2177 1 114 ARG HG2 1 115 THR H . . 3.960 3.070 2.167 3.601 . 0 0 "[ . 1 . 2]" 1
2178 1 114 ARG HG3 1 115 THR H . . 3.960 3.216 2.701 3.648 . 0 0 "[ . 1 . 2]" 1
2179 1 115 THR H 1 115 THR HG1 . . 3.990 3.130 2.986 3.372 . 0 0 "[ . 1 . 2]" 1
2180 1 115 THR H 1 115 THR MG . . 3.400 2.689 2.422 2.954 . 0 0 "[ . 1 . 2]" 1
2181 1 115 THR HA 1 115 THR MG . . 3.260 2.122 2.033 2.187 . 0 0 "[ . 1 . 2]" 1
2182 1 115 THR HA 1 116 PRO HD2 . . 3.490 2.306 2.237 2.371 . 0 0 "[ . 1 . 2]" 1
2183 1 115 THR HA 1 116 PRO QD . . 3.040 2.039 2.002 2.074 . 0 0 "[ . 1 . 2]" 1
2184 1 115 THR HA 1 116 PRO HD3 . . 3.490 2.272 2.258 2.290 . 0 0 "[ . 1 . 2]" 1
2185 1 115 THR HA 1 116 PRO HG2 . . 4.840 4.437 4.381 4.490 . 0 0 "[ . 1 . 2]" 1
2186 1 115 THR HB 1 116 PRO HD2 . . 4.000 2.286 2.113 2.481 . 0 0 "[ . 1 . 2]" 1
2187 1 115 THR HB 1 116 PRO QD . . 3.430 2.265 2.098 2.453 . 0 0 "[ . 1 . 2]" 1
2188 1 115 THR HB 1 116 PRO HD3 . . 4.000 3.692 3.550 3.848 . 0 0 "[ . 1 . 2]" 1
2189 1 115 THR HG1 1 115 THR MG . . 3.340 2.159 1.986 2.329 . 0 0 "[ . 1 . 2]" 1
2190 1 115 THR MG 1 116 PRO HD2 . . 4.510 2.879 2.680 3.098 . 0 0 "[ . 1 . 2]" 1
2191 1 115 THR MG 1 116 PRO QD . . 3.710 2.777 2.593 2.972 . 0 0 "[ . 1 . 2]" 1
2192 1 115 THR MG 1 116 PRO HD3 . . 4.510 3.650 3.449 3.826 . 0 0 "[ . 1 . 2]" 1
2193 1 116 PRO HA 1 117 LYS H . . 2.780 2.724 2.721 2.728 . 0 0 "[ . 1 . 2]" 1
2194 1 116 PRO HA 1 117 LYS HA . . 5.490 4.543 4.529 4.558 . 0 0 "[ . 1 . 2]" 1
2195 1 116 PRO HA 1 117 LYS HB2 . . 4.620 4.528 4.438 4.621 0.001 6 0 "[ . 1 . 2]" 1
2196 1 116 PRO HA 1 117 LYS HG2 . . 4.890 3.606 3.451 3.786 . 0 0 "[ . 1 . 2]" 1
2197 1 116 PRO HA 1 117 LYS HG3 . . 4.660 4.697 4.681 4.711 0.051 7 0 "[ . 1 . 2]" 1
2198 1 116 PRO HB2 1 117 LYS H . . 3.520 1.898 1.891 1.903 . 0 0 "[ . 1 . 2]" 1
2199 1 116 PRO HB2 1 117 LYS HA . . 4.490 4.104 4.083 4.124 . 0 0 "[ . 1 . 2]" 1
2200 1 116 PRO HB3 1 117 LYS H . . 3.400 3.144 3.142 3.146 . 0 0 "[ . 1 . 2]" 1
2201 1 116 PRO HG2 1 117 LYS HA . . 5.280 4.612 4.583 4.641 . 0 0 "[ . 1 . 2]" 1
2202 1 117 LYS H 1 117 LYS HB2 . . 3.030 2.738 2.704 2.781 . 0 0 "[ . 1 . 2]" 1
2203 1 117 LYS H 1 117 LYS HB3 . . 3.880 3.831 3.808 3.857 . 0 0 "[ . 1 . 2]" 1
2204 1 117 LYS H 1 117 LYS QE . . 4.630 4.284 4.109 4.418 . 0 0 "[ . 1 . 2]" 1
2205 1 117 LYS H 1 117 LYS HG2 . . 3.970 3.322 3.184 3.467 . 0 0 "[ . 1 . 2]" 1
2206 1 117 LYS H 1 117 LYS HG3 . . 4.180 4.135 4.061 4.200 0.020 7 0 "[ . 1 . 2]" 1
2207 1 117 LYS H 1 118 ALA H . . 4.450 4.411 4.370 4.436 . 0 0 "[ . 1 . 2]" 1
2208 1 117 LYS HA 1 117 LYS HD2 . . 4.110 4.039 3.913 4.125 0.015 16 0 "[ . 1 . 2]" 1
2209 1 117 LYS HA 1 117 LYS QE . . 3.680 1.964 1.855 2.211 . 0 0 "[ . 1 . 2]" 1
2210 1 117 LYS HA 1 117 LYS HG2 . . 3.600 2.612 2.519 2.699 . 0 0 "[ . 1 . 2]" 1
2211 1 117 LYS HA 1 117 LYS HG3 . . 4.080 3.744 3.702 3.781 . 0 0 "[ . 1 . 2]" 1
2212 1 117 LYS HA 1 118 ALA H . . 2.880 2.325 2.248 2.402 . 0 0 "[ . 1 . 2]" 1
2213 1 117 LYS HB2 1 117 LYS QE . . 4.590 3.704 3.424 3.992 . 0 0 "[ . 1 . 2]" 1
2214 1 117 LYS HB2 1 117 LYS HG3 . . 2.930 2.250 2.242 2.257 . 0 0 "[ . 1 . 2]" 1
2215 1 117 LYS HB2 1 118 ALA H . . 4.090 3.829 3.655 3.967 . 0 0 "[ . 1 . 2]" 1
2216 1 117 LYS HB2 1 118 ALA HA . . 5.310 5.196 5.087 5.280 . 0 0 "[ . 1 . 2]" 1
2217 1 117 LYS HB3 1 117 LYS QE . . 4.450 2.700 2.152 3.284 . 0 0 "[ . 1 . 2]" 1
2218 1 117 LYS HB3 1 118 ALA H . . 3.340 2.632 2.429 2.850 . 0 0 "[ . 1 . 2]" 1
2219 1 117 LYS HB3 1 118 ALA MB . . 4.350 4.251 4.073 4.352 0.002 3 0 "[ . 1 . 2]" 1
2220 1 117 LYS HD2 1 117 LYS HG3 . . 2.770 2.393 2.331 2.484 . 0 0 "[ . 1 . 2]" 1
2221 1 117 LYS HD2 1 118 ALA H . . 5.420 5.253 5.108 5.424 0.004 6 0 "[ . 1 . 2]" 1
2222 1 117 LYS QE 1 117 LYS HG2 . . 2.820 2.295 2.211 2.456 . 0 0 "[ . 1 . 2]" 1
2223 1 117 LYS QE 1 117 LYS HG3 . . 3.460 3.314 3.272 3.372 . 0 0 "[ . 1 . 2]" 1
2224 1 117 LYS QE 1 118 ALA MB . . 4.850 4.199 3.711 4.861 0.011 14 0 "[ . 1 . 2]" 1
2225 1 117 LYS HG2 1 118 ALA H . . 4.860 4.561 4.451 4.675 . 0 0 "[ . 1 . 2]" 1
2226 1 118 ALA H 1 118 ALA MB . . 2.960 2.194 2.046 2.290 . 0 0 "[ . 1 . 2]" 1
2227 1 118 ALA H 1 119 SER HA . . 5.450 5.208 4.855 5.444 . 0 0 "[ . 1 . 2]" 1
2228 1 118 ALA MB 1 119 SER HA . . 4.550 4.125 3.719 4.461 . 0 0 "[ . 1 . 2]" 1
2229 1 120 GLY QA 1 121 PRO QD . . 2.750 1.988 1.851 2.141 . 0 0 "[ . 1 . 2]" 1
2230 1 120 GLY QA 1 121 PRO QG . . 4.300 3.744 3.646 3.934 . 0 0 "[ . 1 . 2]" 1
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