NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
523873 |
2kpn   |
16561 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kpn
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 1794
_Distance_constraint_stats_list.Viol_count 564
_Distance_constraint_stats_list.Viol_total 360.963
_Distance_constraint_stats_list.Viol_max 0.262
_Distance_constraint_stats_list.Viol_rms 0.0055
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0005
_Distance_constraint_stats_list.Viol_average_violations_only 0.0320
_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 5 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 SER 0.009 0.009 19 0 "[ . 1 . 2]"
1 8 ASP 1.195 0.104 7 0 "[ . 1 . 2]"
1 9 LEU 0.317 0.101 11 0 "[ . 1 . 2]"
1 10 GLU 0.806 0.101 5 0 "[ . 1 . 2]"
1 11 PRO 1.490 0.262 10 0 "[ . 1 . 2]"
1 12 LYS 0.230 0.177 20 0 "[ . 1 . 2]"
1 13 LEU 0.337 0.064 16 0 "[ . 1 . 2]"
1 14 THR 0.432 0.069 14 0 "[ . 1 . 2]"
1 15 VAL 0.120 0.033 7 0 "[ . 1 . 2]"
1 16 PRO 1.311 0.088 19 0 "[ . 1 . 2]"
1 17 VAL 0.082 0.028 8 0 "[ . 1 . 2]"
1 18 GLY 0.238 0.040 7 0 "[ . 1 . 2]"
1 19 ALA 0.000 0.000 11 0 "[ . 1 . 2]"
1 20 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 ILE 0.532 0.061 16 0 "[ . 1 . 2]"
1 22 HIS 1.052 0.093 10 0 "[ . 1 . 2]"
1 23 VAL 0.197 0.054 13 0 "[ . 1 . 2]"
1 24 GLY 0.024 0.024 9 0 "[ . 1 . 2]"
1 25 ASP 0.228 0.054 11 0 "[ . 1 . 2]"
1 26 SER 0.070 0.040 18 0 "[ . 1 . 2]"
1 27 PHE 0.557 0.067 19 0 "[ . 1 . 2]"
1 28 VAL 0.774 0.137 11 0 "[ . 1 . 2]"
1 29 PRO 0.256 0.033 11 0 "[ . 1 . 2]"
1 30 MET 1.006 0.086 6 0 "[ . 1 . 2]"
1 31 ALA 0.401 0.086 6 0 "[ . 1 . 2]"
1 32 GLU 0.773 0.137 11 0 "[ . 1 . 2]"
1 33 VAL 0.306 0.066 11 0 "[ . 1 . 2]"
1 34 LEU 0.966 0.069 14 0 "[ . 1 . 2]"
1 35 ALA 0.486 0.062 12 0 "[ . 1 . 2]"
1 36 ILE 0.172 0.054 19 0 "[ . 1 . 2]"
1 37 ASP 0.273 0.052 3 0 "[ . 1 . 2]"
1 38 LYS 0.051 0.019 15 0 "[ . 1 . 2]"
1 39 GLU 1.107 0.262 10 0 "[ . 1 . 2]"
1 40 ASP 0.571 0.075 5 0 "[ . 1 . 2]"
1 41 GLY 0.313 0.052 3 0 "[ . 1 . 2]"
1 42 ASP 0.184 0.054 19 0 "[ . 1 . 2]"
1 43 LEU 1.040 0.075 5 0 "[ . 1 . 2]"
1 44 THR 0.109 0.050 3 0 "[ . 1 . 2]"
1 45 SER 0.060 0.044 4 0 "[ . 1 . 2]"
1 46 LYS 1.246 0.154 20 0 "[ . 1 . 2]"
1 47 ILE 0.366 0.064 16 0 "[ . 1 . 2]"
1 48 LYS 0.344 0.153 14 0 "[ . 1 . 2]"
1 49 VAL 0.486 0.153 14 0 "[ . 1 . 2]"
1 50 ASP 0.227 0.054 6 0 "[ . 1 . 2]"
1 51 GLY 0.088 0.027 11 0 "[ . 1 . 2]"
1 52 GLU 0.229 0.074 15 0 "[ . 1 . 2]"
1 53 VAL 0.187 0.026 2 0 "[ . 1 . 2]"
1 54 ASP 0.298 0.108 15 0 "[ . 1 . 2]"
1 55 THR 0.128 0.032 13 0 "[ . 1 . 2]"
1 56 THR 0.116 0.045 12 0 "[ . 1 . 2]"
1 57 LYS 0.190 0.075 1 0 "[ . 1 . 2]"
1 58 ALA 0.567 0.058 8 0 "[ . 1 . 2]"
1 59 GLY 0.212 0.071 15 0 "[ . 1 . 2]"
1 60 THR 0.383 0.084 14 0 "[ . 1 . 2]"
1 61 TYR 0.261 0.108 15 0 "[ . 1 . 2]"
1 62 VAL 0.068 0.068 10 0 "[ . 1 . 2]"
1 63 LEU 0.451 0.074 15 0 "[ . 1 . 2]"
1 64 THR 0.606 0.054 6 0 "[ . 1 . 2]"
1 65 TYR 0.172 0.029 14 0 "[ . 1 . 2]"
1 66 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 THR 0.175 0.049 16 0 "[ . 1 . 2]"
1 69 ASP 0.217 0.089 5 0 "[ . 1 . 2]"
1 70 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 LYS 0.270 0.220 6 0 "[ . 1 . 2]"
1 72 GLY 0.006 0.006 17 0 "[ . 1 . 2]"
1 73 HIS 2.205 0.104 7 0 "[ . 1 . 2]"
1 74 GLU 0.345 0.061 11 0 "[ . 1 . 2]"
1 75 VAL 0.177 0.056 16 0 "[ . 1 . 2]"
1 76 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 ALA 0.298 0.053 10 0 "[ . 1 . 2]"
1 78 LYS 0.208 0.068 10 0 "[ . 1 . 2]"
1 79 GLN 1.338 0.088 19 0 "[ . 1 . 2]"
1 80 THR 0.122 0.040 7 0 "[ . 1 . 2]"
1 81 VAL 0.032 0.032 4 0 "[ . 1 . 2]"
1 82 THR 0.268 0.084 14 0 "[ . 1 . 2]"
1 83 VAL 0.042 0.022 7 0 "[ . 1 . 2]"
1 84 LYS 0.317 0.139 15 0 "[ . 1 . 2]"
1 85 VAL 1.525 0.086 4 0 "[ . 1 . 2]"
1 86 ARG 0.264 0.042 14 0 "[ . 1 . 2]"
1 87 GLU 0.269 0.069 1 0 "[ . 1 . 2]"
1 88 GLU 0.132 0.052 6 0 "[ . 1 . 2]"
1 89 VAL 0.089 0.052 6 0 "[ . 1 . 2]"
1 90 LYS 0.128 0.081 6 0 "[ . 1 . 2]"
1 91 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 ASP 0.172 0.086 18 0 "[ . 1 . 2]"
1 93 LYS 0.172 0.086 18 0 "[ . 1 . 2]"
1 94 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 ILE 0.082 0.038 1 0 "[ . 1 . 2]"
1 96 LEU 0.166 0.045 16 0 "[ . 1 . 2]"
1 97 GLU 0.011 0.011 6 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 5 GLU QG 1 6 THR H 5.500 . 6.050 3.957 1.901 4.887 . 0 0 "[ . 1 . 2]" 1
2 1 6 THR HA 1 6 THR MG 3.310 . 3.640 2.556 2.349 3.227 . 0 0 "[ . 1 . 2]" 1
3 1 6 THR HB 1 7 SER H 5.500 . 6.050 3.519 1.942 4.520 . 0 0 "[ . 1 . 2]" 1
4 1 7 SER HA 1 8 ASP H 2.840 . 3.120 2.211 2.156 2.345 . 0 0 "[ . 1 . 2]" 1
5 1 7 SER HA 1 8 ASP HB2 4.860 . 5.350 4.690 4.408 4.999 . 0 0 "[ . 1 . 2]" 1
6 1 7 SER HA 1 8 ASP HB3 4.930 . 5.420 4.643 4.426 4.840 . 0 0 "[ . 1 . 2]" 1
7 1 7 SER QB 1 8 ASP H 3.600 . 3.960 3.360 2.567 3.741 . 0 0 "[ . 1 . 2]" 1
8 1 7 SER QB 1 9 LEU MD2 3.760 . 4.140 3.628 2.794 4.149 0.009 19 0 "[ . 1 . 2]" 1
9 1 8 ASP H 1 8 ASP HB2 3.540 . 3.890 2.762 2.552 2.983 . 0 0 "[ . 1 . 2]" 1
10 1 8 ASP H 1 8 ASP HB3 3.480 . 3.830 2.466 2.291 2.652 . 0 0 "[ . 1 . 2]" 1
11 1 8 ASP H 1 9 LEU H 4.760 . 5.240 4.505 4.305 4.614 . 0 0 "[ . 1 . 2]" 1
12 1 8 ASP H 1 9 LEU MD2 4.890 . 5.380 5.016 4.517 5.409 0.029 6 0 "[ . 1 . 2]" 1
13 1 8 ASP HA 1 9 LEU H 3.070 . 3.380 2.171 2.100 2.352 . 0 0 "[ . 1 . 2]" 1
14 1 8 ASP HA 1 9 LEU HB2 4.670 . 5.140 4.621 4.536 4.733 . 0 0 "[ . 1 . 2]" 1
15 1 8 ASP HA 1 9 LEU HG 4.940 . 5.430 3.877 3.418 4.175 . 0 0 "[ . 1 . 2]" 1
16 1 8 ASP HA 1 73 HIS HE1 4.180 . 4.600 4.604 4.079 4.704 0.104 7 0 "[ . 1 . 2]" 1
17 1 8 ASP HB2 1 9 LEU H 4.340 . 4.770 4.146 3.800 4.355 . 0 0 "[ . 1 . 2]" 1
18 1 8 ASP HB2 1 71 LYS QB 4.990 . 5.490 3.265 2.074 4.026 . 0 0 "[ . 1 . 2]" 1
19 1 8 ASP HB2 1 71 LYS QG 4.830 . 5.310 2.946 2.303 3.524 . 0 0 "[ . 1 . 2]" 1
20 1 8 ASP HB2 1 73 HIS HE1 3.890 . 4.280 3.829 3.143 4.197 . 0 0 "[ . 1 . 2]" 1
21 1 8 ASP HB3 1 9 LEU H 4.580 . 5.040 4.174 3.567 4.393 . 0 0 "[ . 1 . 2]" 1
22 1 8 ASP HB3 1 71 LYS QB 4.860 . 5.350 3.448 2.718 4.033 . 0 0 "[ . 1 . 2]" 1
23 1 8 ASP HB3 1 71 LYS QG 4.890 . 5.380 3.882 2.576 4.753 . 0 0 "[ . 1 . 2]" 1
24 1 8 ASP HB3 1 73 HIS HE1 3.220 . 3.540 2.164 1.719 2.793 0.081 10 0 "[ . 1 . 2]" 1
25 1 9 LEU H 1 9 LEU HB2 3.500 . 3.850 2.506 2.450 2.605 . 0 0 "[ . 1 . 2]" 1
26 1 9 LEU H 1 9 LEU HB3 3.860 . 4.250 3.650 3.610 3.725 . 0 0 "[ . 1 . 2]" 1
27 1 9 LEU H 1 9 LEU MD1 4.180 . 4.600 3.807 3.679 3.922 . 0 0 "[ . 1 . 2]" 1
28 1 9 LEU H 1 9 LEU MD2 4.190 . 4.610 3.428 3.252 3.662 . 0 0 "[ . 1 . 2]" 1
29 1 9 LEU H 1 9 LEU HG 3.580 . 3.940 2.538 2.337 2.707 . 0 0 "[ . 1 . 2]" 1
30 1 9 LEU H 1 10 GLU H 4.540 . 4.990 4.494 4.420 4.566 . 0 0 "[ . 1 . 2]" 1
31 1 9 LEU HA 1 9 LEU MD1 4.060 . 4.470 3.871 3.823 3.930 . 0 0 "[ . 1 . 2]" 1
32 1 9 LEU HA 1 9 LEU MD2 3.230 . 3.550 2.050 1.960 2.157 . 0 0 "[ . 1 . 2]" 1
33 1 9 LEU HA 1 9 LEU HG 4.130 . 4.540 3.187 3.135 3.249 . 0 0 "[ . 1 . 2]" 1
34 1 9 LEU HA 1 10 GLU H 2.820 . 3.100 2.183 2.133 2.227 . 0 0 "[ . 1 . 2]" 1
35 1 9 LEU HA 1 10 GLU QG 4.280 . 4.710 4.286 3.542 4.756 0.046 9 0 "[ . 1 . 2]" 1
36 1 9 LEU HB2 1 9 LEU MD1 3.270 . 3.600 2.366 2.302 2.413 . 0 0 "[ . 1 . 2]" 1
37 1 9 LEU HB2 1 9 LEU MD2 3.440 . 3.780 3.215 3.207 3.220 . 0 0 "[ . 1 . 2]" 1
38 1 9 LEU HB2 1 10 GLU H 4.490 . 4.940 4.143 4.032 4.305 . 0 0 "[ . 1 . 2]" 1
39 1 9 LEU HB3 1 9 LEU MD1 3.320 . 3.650 2.381 2.339 2.436 . 0 0 "[ . 1 . 2]" 1
40 1 9 LEU HB3 1 9 LEU MD2 3.400 . 3.740 2.416 2.341 2.458 . 0 0 "[ . 1 . 2]" 1
41 1 9 LEU HB3 1 10 GLU H 3.540 . 3.890 3.240 3.029 3.550 . 0 0 "[ . 1 . 2]" 1
42 1 9 LEU MD1 1 10 GLU H 5.500 . 6.050 5.032 4.793 5.271 . 0 0 "[ . 1 . 2]" 1
43 1 9 LEU MD1 1 38 LYS H 5.290 . 5.820 4.439 3.283 5.453 . 0 0 "[ . 1 . 2]" 1
44 1 9 LEU MD1 1 38 LYS QB 4.550 . 5.010 2.721 1.781 3.819 0.019 15 0 "[ . 1 . 2]" 1
45 1 9 LEU MD1 1 38 LYS QD 3.260 . 3.590 2.039 1.782 2.683 0.018 2 0 "[ . 1 . 2]" 1
46 1 9 LEU MD1 1 38 LYS QE 4.030 . 4.430 3.090 2.251 3.862 . 0 0 "[ . 1 . 2]" 1
47 1 9 LEU MD1 1 39 GLU H 5.490 . 6.040 4.956 3.185 6.141 0.101 11 0 "[ . 1 . 2]" 1
48 1 9 LEU MD2 1 10 GLU H 3.880 . 4.270 3.660 3.460 3.854 . 0 0 "[ . 1 . 2]" 1
49 1 9 LEU HG 1 10 GLU H 5.240 . 5.760 5.182 5.096 5.310 . 0 0 "[ . 1 . 2]" 1
50 1 10 GLU H 1 10 GLU HB2 3.700 . 4.070 3.464 2.597 3.656 . 0 0 "[ . 1 . 2]" 1
51 1 10 GLU H 1 10 GLU HB3 3.410 . 3.750 2.884 2.593 3.638 . 0 0 "[ . 1 . 2]" 1
52 1 10 GLU H 1 10 GLU QG 3.190 . 3.510 2.497 1.816 3.107 . 0 0 "[ . 1 . 2]" 1
53 1 10 GLU H 1 11 PRO HD2 4.850 . 5.330 4.943 4.782 5.348 0.018 8 0 "[ . 1 . 2]" 1
54 1 10 GLU H 1 73 HIS QB 4.970 . 5.470 4.256 3.821 4.693 . 0 0 "[ . 1 . 2]" 1
55 1 10 GLU H 1 75 VAL QG 5.440 . 5.980 5.127 4.704 5.676 . 0 0 "[ . 1 . 2]" 1
56 1 10 GLU HA 1 11 PRO HD2 3.690 . 4.060 2.496 2.194 2.956 . 0 0 "[ . 1 . 2]" 1
57 1 10 GLU HA 1 11 PRO HD3 3.760 . 4.140 2.276 1.891 2.470 . 0 0 "[ . 1 . 2]" 1
58 1 10 GLU HA 1 11 PRO HG3 4.760 . 5.240 4.444 3.953 4.574 . 0 0 "[ . 1 . 2]" 1
59 1 10 GLU HA 1 73 HIS QB 3.890 . 4.280 2.358 1.978 2.668 . 0 0 "[ . 1 . 2]" 1
60 1 10 GLU HA 1 75 VAL QG 4.580 . 5.040 4.044 3.635 4.453 . 0 0 "[ . 1 . 2]" 1
61 1 10 GLU HB2 1 11 PRO HD2 4.440 . 4.880 2.537 1.932 3.654 . 0 0 "[ . 1 . 2]" 1
62 1 10 GLU HB2 1 11 PRO HD3 4.850 . 5.330 3.761 3.059 4.839 . 0 0 "[ . 1 . 2]" 1
63 1 10 GLU HB2 1 73 HIS QB 4.760 . 5.240 2.948 2.355 4.062 . 0 0 "[ . 1 . 2]" 1
64 1 10 GLU HB2 1 75 VAL MG1 4.510 . 4.960 2.843 1.970 4.966 0.006 6 0 "[ . 1 . 2]" 1
65 1 10 GLU HB2 1 75 VAL QG 3.140 . 3.450 2.504 1.960 3.107 . 0 0 "[ . 1 . 2]" 1
66 1 10 GLU HB2 1 75 VAL MG2 4.510 . 4.960 3.807 2.256 4.769 . 0 0 "[ . 1 . 2]" 1
67 1 10 GLU HB3 1 73 HIS H 5.500 . 6.050 5.779 5.404 6.151 0.101 5 0 "[ . 1 . 2]" 1
68 1 10 GLU HB3 1 73 HIS QB 4.300 . 4.730 2.447 1.857 2.890 . 0 0 "[ . 1 . 2]" 1
69 1 10 GLU QG 1 11 PRO HD2 4.270 . 4.700 3.948 3.468 4.304 . 0 0 "[ . 1 . 2]" 1
70 1 10 GLU QG 1 73 HIS QB 4.480 . 4.930 3.789 1.794 4.393 0.006 19 0 "[ . 1 . 2]" 1
71 1 10 GLU QG 1 75 VAL QG 3.570 . 3.930 3.021 2.243 3.923 . 0 0 "[ . 1 . 2]" 1
72 1 10 GLU HG2 1 11 PRO HD3 5.500 . 6.050 5.423 4.938 5.811 . 0 0 "[ . 1 . 2]" 1
73 1 10 GLU HG2 1 73 HIS QB 5.220 . 5.740 4.469 2.624 5.011 . 0 0 "[ . 1 . 2]" 1
74 1 10 GLU HG2 1 73 HIS HD2 5.500 . 6.050 5.591 4.033 6.124 0.074 18 0 "[ . 1 . 2]" 1
75 1 10 GLU HG2 1 75 VAL MG1 5.970 . 6.570 4.118 3.011 6.575 0.005 6 0 "[ . 1 . 2]" 1
76 1 10 GLU HG2 1 75 VAL MG2 5.970 . 6.570 5.257 3.723 6.626 0.056 16 0 "[ . 1 . 2]" 1
77 1 10 GLU HG3 1 11 PRO HD3 5.500 . 6.050 5.431 4.403 6.081 0.031 1 0 "[ . 1 . 2]" 1
78 1 10 GLU HG3 1 73 HIS QB 5.220 . 5.740 4.150 1.810 4.913 . 0 0 "[ . 1 . 2]" 1
79 1 10 GLU HG3 1 73 HIS HD2 5.500 . 6.050 5.159 2.952 6.099 0.049 6 0 "[ . 1 . 2]" 1
80 1 10 GLU HG3 1 75 VAL MG1 5.970 . 6.570 3.541 2.320 5.216 . 0 0 "[ . 1 . 2]" 1
81 1 10 GLU HG3 1 75 VAL MG2 5.970 . 6.570 4.841 3.216 5.856 . 0 0 "[ . 1 . 2]" 1
82 1 11 PRO HA 1 12 LYS H 3.020 . 3.320 2.213 2.153 2.278 . 0 0 "[ . 1 . 2]" 1
83 1 11 PRO HA 1 37 ASP HA 3.690 . 4.060 2.425 1.849 2.758 . 0 0 "[ . 1 . 2]" 1
84 1 11 PRO HA 1 39 GLU H 5.500 . 6.050 6.056 5.876 6.312 0.262 10 0 "[ . 1 . 2]" 1
85 1 11 PRO HA 1 73 HIS QB 5.500 . 6.050 5.633 5.163 6.065 0.015 19 0 "[ . 1 . 2]" 1
86 1 11 PRO QB 1 37 ASP HA 4.280 . 4.710 3.284 2.793 4.079 . 0 0 "[ . 1 . 2]" 1
87 1 11 PRO QB 1 37 ASP HB2 4.020 . 4.420 2.104 1.791 2.853 0.009 17 0 "[ . 1 . 2]" 1
88 1 11 PRO QB 1 37 ASP HB3 4.620 . 5.080 3.752 3.470 4.441 . 0 0 "[ . 1 . 2]" 1
89 1 11 PRO QB 1 43 LEU MD1 3.980 . 4.380 1.908 1.740 2.334 0.060 15 0 "[ . 1 . 2]" 1
90 1 11 PRO QB 1 67 VAL MG1 3.840 . 4.220 2.968 2.070 3.494 . 0 0 "[ . 1 . 2]" 1
91 1 11 PRO QB 1 75 VAL QG 4.250 . 4.680 3.382 2.677 4.023 . 0 0 "[ . 1 . 2]" 1
92 1 11 PRO HB2 1 12 LYS H 3.960 . 4.360 3.264 2.809 3.756 . 0 0 "[ . 1 . 2]" 1
93 1 11 PRO HB2 1 35 ALA MB 4.690 . 5.160 3.321 2.905 3.774 . 0 0 "[ . 1 . 2]" 1
94 1 11 PRO HB2 1 37 ASP HA 5.090 . 5.600 4.329 3.699 5.441 . 0 0 "[ . 1 . 2]" 1
95 1 11 PRO HB2 1 37 ASP HB2 4.780 . 5.260 3.627 3.178 4.480 . 0 0 "[ . 1 . 2]" 1
96 1 11 PRO HB2 1 67 VAL MG1 4.570 . 5.030 3.046 2.100 3.606 . 0 0 "[ . 1 . 2]" 1
97 1 11 PRO HB2 1 67 VAL MG2 4.520 . 4.970 3.659 3.033 4.413 . 0 0 "[ . 1 . 2]" 1
98 1 11 PRO HB3 1 12 LYS H 3.960 . 4.360 3.730 3.337 3.971 . 0 0 "[ . 1 . 2]" 1
99 1 11 PRO HB3 1 35 ALA MB 4.690 . 5.160 4.341 3.417 4.992 . 0 0 "[ . 1 . 2]" 1
100 1 11 PRO HB3 1 37 ASP HA 5.090 . 5.600 3.406 2.890 4.214 . 0 0 "[ . 1 . 2]" 1
101 1 11 PRO HB3 1 37 ASP HB2 4.780 . 5.260 2.119 1.798 2.886 0.002 17 0 "[ . 1 . 2]" 1
102 1 11 PRO HB3 1 67 VAL MG1 4.570 . 5.030 4.124 3.141 4.686 . 0 0 "[ . 1 . 2]" 1
103 1 11 PRO HB3 1 67 VAL MG2 4.520 . 4.970 4.118 3.219 4.845 . 0 0 "[ . 1 . 2]" 1
104 1 11 PRO HD2 1 69 ASP H 4.740 . 5.210 4.390 3.878 4.841 . 0 0 "[ . 1 . 2]" 1
105 1 11 PRO HD2 1 69 ASP QB 5.180 . 5.700 3.027 2.571 3.421 . 0 0 "[ . 1 . 2]" 1
106 1 11 PRO HD2 1 73 HIS QB 4.120 . 4.530 2.633 2.160 3.122 . 0 0 "[ . 1 . 2]" 1
107 1 11 PRO HD2 1 75 VAL MG1 4.350 . 4.790 3.100 2.249 4.735 . 0 0 "[ . 1 . 2]" 1
108 1 11 PRO HD2 1 75 VAL QG 3.430 . 3.770 2.569 2.188 3.077 . 0 0 "[ . 1 . 2]" 1
109 1 11 PRO HD2 1 75 VAL MG2 4.350 . 4.790 3.059 2.219 3.694 . 0 0 "[ . 1 . 2]" 1
110 1 11 PRO HD3 1 69 ASP H 4.880 . 5.370 4.034 3.609 4.605 . 0 0 "[ . 1 . 2]" 1
111 1 11 PRO HD3 1 69 ASP QB 5.150 . 5.670 1.937 1.711 2.514 0.089 5 0 "[ . 1 . 2]" 1
112 1 11 PRO HD3 1 73 HIS QB 4.350 . 4.790 2.672 2.203 3.299 . 0 0 "[ . 1 . 2]" 1
113 1 11 PRO HD3 1 75 VAL MG1 5.500 . 6.050 4.563 3.742 6.105 0.055 13 0 "[ . 1 . 2]" 1
114 1 11 PRO HD3 1 75 VAL QG 4.490 . 4.940 3.831 3.424 4.301 . 0 0 "[ . 1 . 2]" 1
115 1 11 PRO HD3 1 75 VAL MG2 5.500 . 6.050 4.286 3.601 4.720 . 0 0 "[ . 1 . 2]" 1
116 1 11 PRO HG2 1 67 VAL MG1 4.030 . 4.430 2.618 2.186 3.012 . 0 0 "[ . 1 . 2]" 1
117 1 11 PRO HG2 1 69 ASP H 5.010 . 5.510 4.533 3.576 5.029 . 0 0 "[ . 1 . 2]" 1
118 1 11 PRO HG2 1 69 ASP QB 4.580 . 5.040 3.718 2.481 4.268 . 0 0 "[ . 1 . 2]" 1
119 1 11 PRO HG2 1 75 VAL MG1 4.130 . 4.540 3.545 2.452 4.537 . 0 0 "[ . 1 . 2]" 1
120 1 11 PRO HG2 1 75 VAL QG 3.400 . 3.740 2.289 1.797 3.459 0.003 20 0 "[ . 1 . 2]" 1
121 1 11 PRO HG2 1 75 VAL MG2 4.130 . 4.540 2.323 1.841 3.588 . 0 0 "[ . 1 . 2]" 1
122 1 11 PRO HG3 1 37 ASP HB2 5.140 . 5.650 3.882 1.899 4.429 . 0 0 "[ . 1 . 2]" 1
123 1 11 PRO HG3 1 43 LEU MD1 3.820 . 4.200 2.586 2.212 3.099 . 0 0 "[ . 1 . 2]" 1
124 1 11 PRO HG3 1 67 VAL MG1 4.030 . 4.430 3.255 2.888 4.383 . 0 0 "[ . 1 . 2]" 1
125 1 11 PRO HG3 1 67 VAL MG2 4.210 . 4.630 3.438 2.981 4.205 . 0 0 "[ . 1 . 2]" 1
126 1 11 PRO HG3 1 69 ASP H 4.070 . 4.480 3.518 2.828 4.266 . 0 0 "[ . 1 . 2]" 1
127 1 11 PRO HG3 1 69 ASP HB2 4.920 . 5.410 2.574 1.940 3.226 . 0 0 "[ . 1 . 2]" 1
128 1 11 PRO HG3 1 69 ASP HB3 4.920 . 5.410 3.937 2.077 4.796 . 0 0 "[ . 1 . 2]" 1
129 1 11 PRO HG3 1 73 HIS H 5.500 . 6.050 5.682 5.339 6.082 0.032 9 0 "[ . 1 . 2]" 1
130 1 11 PRO HG3 1 75 VAL QG 4.520 . 4.970 3.479 2.955 4.555 . 0 0 "[ . 1 . 2]" 1
131 1 12 LYS H 1 12 LYS HB2 3.420 . 3.760 2.707 2.419 2.868 . 0 0 "[ . 1 . 2]" 1
132 1 12 LYS H 1 12 LYS HB3 3.420 . 3.760 2.466 2.252 2.832 . 0 0 "[ . 1 . 2]" 1
133 1 12 LYS H 1 12 LYS HG2 5.070 . 5.580 4.596 4.367 4.683 . 0 0 "[ . 1 . 2]" 1
134 1 12 LYS H 1 12 LYS QG 4.410 . 4.850 4.021 3.885 4.088 . 0 0 "[ . 1 . 2]" 1
135 1 12 LYS H 1 12 LYS HG3 5.070 . 5.580 4.453 4.246 4.674 . 0 0 "[ . 1 . 2]" 1
136 1 12 LYS H 1 13 LEU H 4.580 . 5.040 4.283 4.176 4.372 . 0 0 "[ . 1 . 2]" 1
137 1 12 LYS H 1 35 ALA HA 5.170 . 5.690 4.952 4.679 5.233 . 0 0 "[ . 1 . 2]" 1
138 1 12 LYS H 1 35 ALA MB 5.090 . 5.600 4.890 4.668 5.144 . 0 0 "[ . 1 . 2]" 1
139 1 12 LYS H 1 37 ASP HA 3.840 . 4.220 3.156 2.841 3.700 . 0 0 "[ . 1 . 2]" 1
140 1 12 LYS H 1 38 LYS H 5.040 . 5.540 4.907 4.592 5.303 . 0 0 "[ . 1 . 2]" 1
141 1 12 LYS H 1 43 LEU MD1 5.360 . 5.900 4.890 4.575 5.358 . 0 0 "[ . 1 . 2]" 1
142 1 12 LYS HA 1 12 LYS QD 3.380 . 3.720 2.511 1.932 3.897 0.177 20 0 "[ . 1 . 2]" 1
143 1 12 LYS HA 1 12 LYS QG 3.510 . 3.860 2.878 2.344 3.143 . 0 0 "[ . 1 . 2]" 1
144 1 12 LYS HA 1 13 LEU H 2.760 . 3.040 2.176 2.135 2.224 . 0 0 "[ . 1 . 2]" 1
145 1 12 LYS HA 1 13 LEU HB2 4.620 . 5.080 4.687 4.559 4.814 . 0 0 "[ . 1 . 2]" 1
146 1 12 LYS HA 1 13 LEU HB3 5.110 . 5.620 4.617 4.558 4.714 . 0 0 "[ . 1 . 2]" 1
147 1 12 LYS HA 1 75 VAL MG1 5.500 . 6.050 4.906 4.162 5.497 . 0 0 "[ . 1 . 2]" 1
148 1 12 LYS HA 1 75 VAL QG 4.080 . 4.490 3.957 3.678 4.227 . 0 0 "[ . 1 . 2]" 1
149 1 12 LYS HA 1 75 VAL MG2 5.500 . 6.050 4.208 3.813 4.581 . 0 0 "[ . 1 . 2]" 1
150 1 12 LYS QB 1 12 LYS QD 2.470 . 2.720 2.360 2.158 2.773 0.053 7 0 "[ . 1 . 2]" 1
151 1 12 LYS QB 1 13 LEU H 4.060 . 4.470 3.958 3.895 4.010 . 0 0 "[ . 1 . 2]" 1
152 1 12 LYS HB2 1 12 LYS QD 3.260 . 3.590 2.611 2.315 3.343 . 0 0 "[ . 1 . 2]" 1
153 1 12 LYS HB2 1 13 LEU H 4.740 . 5.210 4.461 4.396 4.586 . 0 0 "[ . 1 . 2]" 1
154 1 12 LYS HB2 1 37 ASP HA 5.500 . 6.050 5.169 4.657 5.852 . 0 0 "[ . 1 . 2]" 1
155 1 12 LYS HB3 1 12 LYS QD 3.260 . 3.590 3.124 2.194 3.503 . 0 0 "[ . 1 . 2]" 1
156 1 12 LYS HB3 1 13 LEU H 4.740 . 5.210 4.431 4.213 4.561 . 0 0 "[ . 1 . 2]" 1
157 1 12 LYS HB3 1 37 ASP HA 5.500 . 6.050 4.897 4.046 6.044 . 0 0 "[ . 1 . 2]" 1
158 1 12 LYS QE 1 12 LYS HG2 3.700 . 4.070 2.714 2.381 3.537 . 0 0 "[ . 1 . 2]" 1
159 1 12 LYS QE 1 12 LYS QG 3.070 . 3.380 2.321 2.136 2.793 . 0 0 "[ . 1 . 2]" 1
160 1 12 LYS QE 1 12 LYS HG3 3.700 . 4.070 2.635 2.303 3.513 . 0 0 "[ . 1 . 2]" 1
161 1 12 LYS QG 1 13 LEU H 3.900 . 4.290 3.639 3.249 3.898 . 0 0 "[ . 1 . 2]" 1
162 1 13 LEU H 1 13 LEU HB2 3.400 . 3.740 2.762 2.710 2.878 . 0 0 "[ . 1 . 2]" 1
163 1 13 LEU H 1 13 LEU HB3 3.590 . 3.950 2.460 2.424 2.500 . 0 0 "[ . 1 . 2]" 1
164 1 13 LEU H 1 13 LEU MD1 4.440 . 4.880 4.244 4.203 4.291 . 0 0 "[ . 1 . 2]" 1
165 1 13 LEU H 1 13 LEU MD2 4.870 . 5.360 4.333 4.289 4.397 . 0 0 "[ . 1 . 2]" 1
166 1 13 LEU H 1 13 LEU HG 5.410 . 5.950 4.444 4.422 4.468 . 0 0 "[ . 1 . 2]" 1
167 1 13 LEU H 1 14 THR H 4.750 . 5.220 4.354 4.280 4.527 . 0 0 "[ . 1 . 2]" 1
168 1 13 LEU H 1 75 VAL MG1 4.590 . 5.050 4.451 2.950 5.000 . 0 0 "[ . 1 . 2]" 1
169 1 13 LEU H 1 75 VAL QG 3.790 . 4.170 3.106 2.793 3.404 . 0 0 "[ . 1 . 2]" 1
170 1 13 LEU H 1 75 VAL MG2 4.590 . 5.050 3.311 2.835 4.113 . 0 0 "[ . 1 . 2]" 1
171 1 13 LEU HA 1 13 LEU MD1 3.520 . 3.870 2.094 2.043 2.150 . 0 0 "[ . 1 . 2]" 1
172 1 13 LEU HA 1 14 THR H 2.970 . 3.270 2.172 2.149 2.197 . 0 0 "[ . 1 . 2]" 1
173 1 13 LEU HA 1 15 VAL MG2 4.510 . 4.960 4.308 4.219 4.552 . 0 0 "[ . 1 . 2]" 1
174 1 13 LEU HA 1 33 VAL MG1 4.500 . 4.950 4.609 4.330 4.946 . 0 0 "[ . 1 . 2]" 1
175 1 13 LEU HA 1 34 LEU H 4.900 . 5.390 5.036 4.798 5.286 . 0 0 "[ . 1 . 2]" 1
176 1 13 LEU HA 1 35 ALA HA 3.780 . 4.160 2.403 2.283 2.540 . 0 0 "[ . 1 . 2]" 1
177 1 13 LEU HA 1 35 ALA MB 4.160 . 4.580 2.811 2.477 3.005 . 0 0 "[ . 1 . 2]" 1
178 1 13 LEU HA 1 36 ILE H 4.150 . 4.570 3.801 3.503 4.057 . 0 0 "[ . 1 . 2]" 1
179 1 13 LEU HA 1 67 VAL MG1 4.960 . 5.460 3.558 3.285 3.843 . 0 0 "[ . 1 . 2]" 1
180 1 13 LEU HA 1 77 ALA MB 5.500 . 6.050 5.485 5.018 5.767 . 0 0 "[ . 1 . 2]" 1
181 1 13 LEU HB2 1 14 THR H 4.590 . 5.050 4.402 4.218 4.463 . 0 0 "[ . 1 . 2]" 1
182 1 13 LEU HB2 1 15 VAL MG2 4.620 . 5.080 4.538 4.444 4.724 . 0 0 "[ . 1 . 2]" 1
183 1 13 LEU HB2 1 67 VAL MG1 4.120 . 4.530 2.335 2.038 2.625 . 0 0 "[ . 1 . 2]" 1
184 1 13 LEU HB2 1 75 VAL QG 3.390 . 3.730 2.451 2.176 2.885 . 0 0 "[ . 1 . 2]" 1
185 1 13 LEU HB2 1 77 ALA MB 4.460 . 4.910 4.706 4.250 4.963 0.053 10 0 "[ . 1 . 2]" 1
186 1 13 LEU HB3 1 13 LEU MD2 3.340 . 3.670 2.336 2.299 2.353 . 0 0 "[ . 1 . 2]" 1
187 1 13 LEU HB3 1 14 THR H 4.470 . 4.920 4.368 4.139 4.434 . 0 0 "[ . 1 . 2]" 1
188 1 13 LEU HB3 1 14 THR HA 5.500 . 6.050 5.033 4.816 5.109 . 0 0 "[ . 1 . 2]" 1
189 1 13 LEU HB3 1 15 VAL MG2 3.910 . 4.300 3.899 3.745 4.132 . 0 0 "[ . 1 . 2]" 1
190 1 13 LEU HB3 1 77 ALA MB 3.850 . 4.230 3.572 3.018 3.874 . 0 0 "[ . 1 . 2]" 1
191 1 13 LEU MD1 1 14 THR H 3.380 . 3.720 2.696 2.243 2.912 . 0 0 "[ . 1 . 2]" 1
192 1 13 LEU MD1 1 14 THR HB 5.310 . 5.840 4.574 4.472 4.706 . 0 0 "[ . 1 . 2]" 1
193 1 13 LEU MD1 1 15 VAL H 5.500 . 6.050 5.020 4.818 5.155 . 0 0 "[ . 1 . 2]" 1
194 1 13 LEU MD1 1 34 LEU H 4.670 . 5.140 3.759 3.475 4.149 . 0 0 "[ . 1 . 2]" 1
195 1 13 LEU MD1 1 35 ALA H 4.390 . 4.830 4.294 3.958 4.470 . 0 0 "[ . 1 . 2]" 1
196 1 13 LEU MD1 1 35 ALA HA 4.130 . 4.540 3.115 2.897 3.346 . 0 0 "[ . 1 . 2]" 1
197 1 13 LEU MD1 1 35 ALA MB 2.990 . 3.290 2.030 1.892 2.170 . 0 0 "[ . 1 . 2]" 1
198 1 13 LEU MD1 1 36 ILE H 4.850 . 5.330 4.809 4.577 5.095 . 0 0 "[ . 1 . 2]" 1
199 1 13 LEU MD1 1 47 ILE HA 4.020 . 4.420 4.322 4.104 4.484 0.064 16 0 "[ . 1 . 2]" 1
200 1 13 LEU MD1 1 47 ILE HB 4.840 . 5.320 4.631 4.341 4.814 . 0 0 "[ . 1 . 2]" 1
201 1 13 LEU MD1 1 47 ILE MG 3.030 . 3.330 2.813 2.483 2.980 . 0 0 "[ . 1 . 2]" 1
202 1 13 LEU MD1 1 48 LYS H 5.440 . 5.980 5.463 4.963 5.823 . 0 0 "[ . 1 . 2]" 1
203 1 13 LEU MD1 1 65 TYR HB2 4.600 . 5.060 3.444 3.256 3.681 . 0 0 "[ . 1 . 2]" 1
204 1 13 LEU MD1 1 65 TYR HB3 4.300 . 4.730 3.096 2.863 3.455 . 0 0 "[ . 1 . 2]" 1
205 1 13 LEU MD2 1 14 THR H 5.010 . 5.510 4.869 4.457 5.009 . 0 0 "[ . 1 . 2]" 1
206 1 13 LEU MD2 1 15 VAL H 5.500 . 6.050 5.277 5.029 5.492 . 0 0 "[ . 1 . 2]" 1
207 1 13 LEU MD2 1 15 VAL HA 5.500 . 6.050 5.622 5.433 5.888 . 0 0 "[ . 1 . 2]" 1
208 1 13 LEU MD2 1 15 VAL HB 4.910 . 5.400 4.333 3.918 4.652 . 0 0 "[ . 1 . 2]" 1
209 1 13 LEU MD2 1 15 VAL MG1 4.500 . 4.950 4.350 4.106 4.547 . 0 0 "[ . 1 . 2]" 1
210 1 13 LEU MD2 1 15 VAL MG2 3.030 . 3.330 2.574 2.368 2.776 . 0 0 "[ . 1 . 2]" 1
211 1 13 LEU MD2 1 47 ILE MD 4.300 . 4.730 4.084 3.853 4.336 . 0 0 "[ . 1 . 2]" 1
212 1 13 LEU MD2 1 65 TYR H 4.160 . 4.580 4.175 3.964 4.506 . 0 0 "[ . 1 . 2]" 1
213 1 13 LEU MD2 1 65 TYR HA 5.030 . 5.530 4.422 4.132 4.759 . 0 0 "[ . 1 . 2]" 1
214 1 13 LEU MD2 1 65 TYR HB2 3.980 . 4.380 2.559 2.265 2.885 . 0 0 "[ . 1 . 2]" 1
215 1 13 LEU MD2 1 65 TYR HB3 4.230 . 4.650 3.103 2.647 3.491 . 0 0 "[ . 1 . 2]" 1
216 1 13 LEU MD2 1 65 TYR QD 4.730 . 5.200 4.234 3.929 4.501 . 0 0 "[ . 1 . 2]" 1
217 1 13 LEU MD2 1 66 THR HA 4.100 . 4.510 3.043 2.710 3.349 . 0 0 "[ . 1 . 2]" 1
218 1 13 LEU MD2 1 67 VAL H 4.580 . 5.040 3.003 2.428 3.375 . 0 0 "[ . 1 . 2]" 1
219 1 13 LEU MD2 1 67 VAL HB 4.400 . 4.840 3.606 3.225 4.029 . 0 0 "[ . 1 . 2]" 1
220 1 13 LEU MD2 1 75 VAL HB 4.240 . 4.660 3.827 3.079 4.305 . 0 0 "[ . 1 . 2]" 1
221 1 13 LEU MD2 1 75 VAL QG 3.540 . 3.890 2.517 2.266 2.797 . 0 0 "[ . 1 . 2]" 1
222 1 13 LEU MD2 1 76 THR H 4.580 . 5.040 3.863 3.602 4.106 . 0 0 "[ . 1 . 2]" 1
223 1 13 LEU MD2 1 76 THR HA 3.830 . 4.210 2.518 2.352 2.845 . 0 0 "[ . 1 . 2]" 1
224 1 13 LEU MD2 1 76 THR HB 5.160 . 5.680 4.458 4.281 4.789 . 0 0 "[ . 1 . 2]" 1
225 1 13 LEU MD2 1 77 ALA H 3.580 . 3.940 2.557 2.304 2.772 . 0 0 "[ . 1 . 2]" 1
226 1 13 LEU MD2 1 77 ALA HA 4.840 . 5.320 4.086 3.902 4.250 . 0 0 "[ . 1 . 2]" 1
227 1 13 LEU MD2 1 77 ALA MB 3.060 . 3.370 2.327 2.189 2.540 . 0 0 "[ . 1 . 2]" 1
228 1 13 LEU HG 1 14 THR H 4.330 . 4.760 3.586 3.045 3.770 . 0 0 "[ . 1 . 2]" 1
229 1 13 LEU HG 1 15 VAL MG1 4.820 . 5.300 4.622 4.517 4.872 . 0 0 "[ . 1 . 2]" 1
230 1 13 LEU HG 1 15 VAL MG2 3.550 . 3.900 1.887 1.787 2.060 0.013 12 0 "[ . 1 . 2]" 1
231 1 13 LEU HG 1 33 VAL MG1 4.180 . 4.600 3.529 3.160 3.852 . 0 0 "[ . 1 . 2]" 1
232 1 13 LEU HG 1 34 LEU H 5.120 . 5.630 5.195 4.872 5.622 . 0 0 "[ . 1 . 2]" 1
233 1 14 THR H 1 14 THR HB 3.630 . 3.990 2.544 2.487 2.662 . 0 0 "[ . 1 . 2]" 1
234 1 14 THR H 1 14 THR MG 4.080 . 4.490 3.820 3.802 3.878 . 0 0 "[ . 1 . 2]" 1
235 1 14 THR H 1 15 VAL H 4.360 . 4.800 4.323 4.165 4.375 . 0 0 "[ . 1 . 2]" 1
236 1 14 THR H 1 15 VAL MG2 4.660 . 5.130 3.844 3.539 4.011 . 0 0 "[ . 1 . 2]" 1
237 1 14 THR H 1 33 VAL HA 5.150 . 5.670 5.230 4.907 5.722 0.052 2 0 "[ . 1 . 2]" 1
238 1 14 THR H 1 34 LEU H 3.870 . 4.260 3.408 3.035 3.620 . 0 0 "[ . 1 . 2]" 1
239 1 14 THR H 1 34 LEU HA 4.890 . 5.380 4.903 4.773 4.988 . 0 0 "[ . 1 . 2]" 1
240 1 14 THR H 1 34 LEU HB2 4.810 . 5.290 4.685 3.568 5.359 0.069 14 0 "[ . 1 . 2]" 1
241 1 14 THR H 1 34 LEU HB3 4.400 . 4.840 4.256 3.623 4.877 0.037 1 0 "[ . 1 . 2]" 1
242 1 14 THR H 1 34 LEU QD 4.980 . 5.480 4.218 3.155 4.919 . 0 0 "[ . 1 . 2]" 1
243 1 14 THR H 1 35 ALA HA 3.830 . 4.210 3.017 2.705 3.384 . 0 0 "[ . 1 . 2]" 1
244 1 14 THR H 1 35 ALA MB 4.570 . 5.030 3.819 3.604 4.096 . 0 0 "[ . 1 . 2]" 1
245 1 14 THR H 1 36 ILE H 4.770 . 5.250 4.551 4.191 5.236 . 0 0 "[ . 1 . 2]" 1
246 1 14 THR H 1 47 ILE MD 5.220 . 5.740 4.426 4.071 4.596 . 0 0 "[ . 1 . 2]" 1
247 1 14 THR HA 1 14 THR MG 3.250 . 3.580 2.411 2.379 2.448 . 0 0 "[ . 1 . 2]" 1
248 1 14 THR HA 1 15 VAL H 2.640 . 2.900 2.149 2.117 2.176 . 0 0 "[ . 1 . 2]" 1
249 1 14 THR HA 1 15 VAL HB 4.980 . 5.480 4.679 4.566 4.763 . 0 0 "[ . 1 . 2]" 1
250 1 14 THR HA 1 34 LEU H 4.990 . 5.490 4.837 4.563 5.024 . 0 0 "[ . 1 . 2]" 1
251 1 14 THR HB 1 15 VAL H 4.360 . 4.800 4.368 4.326 4.400 . 0 0 "[ . 1 . 2]" 1
252 1 14 THR HB 1 33 VAL HA 4.430 . 4.870 4.219 3.942 4.508 . 0 0 "[ . 1 . 2]" 1
253 1 14 THR HB 1 34 LEU H 4.040 . 4.440 2.714 2.406 3.101 . 0 0 "[ . 1 . 2]" 1
254 1 14 THR HB 1 34 LEU HA 4.560 . 5.020 4.665 4.367 4.936 . 0 0 "[ . 1 . 2]" 1
255 1 14 THR HB 1 34 LEU HB2 4.120 . 4.530 3.206 2.012 4.039 . 0 0 "[ . 1 . 2]" 1
256 1 14 THR HB 1 34 LEU HB3 3.890 . 4.280 3.090 1.967 4.291 0.011 5 0 "[ . 1 . 2]" 1
257 1 14 THR HB 1 34 LEU MD1 4.910 . 5.400 4.378 3.271 5.202 . 0 0 "[ . 1 . 2]" 1
258 1 14 THR HB 1 34 LEU QD 4.100 . 4.510 3.290 2.686 3.971 . 0 0 "[ . 1 . 2]" 1
259 1 14 THR HB 1 34 LEU MD2 4.910 . 5.400 3.590 2.722 4.654 . 0 0 "[ . 1 . 2]" 1
260 1 14 THR HB 1 34 LEU HG 5.280 . 5.810 5.049 3.996 5.811 0.001 4 0 "[ . 1 . 2]" 1
261 1 14 THR MG 1 15 VAL H 3.480 . 3.830 3.082 3.047 3.133 . 0 0 "[ . 1 . 2]" 1
262 1 14 THR MG 1 34 LEU H 4.420 . 4.860 3.665 3.405 3.896 . 0 0 "[ . 1 . 2]" 1
263 1 15 VAL H 1 15 VAL HB 3.700 . 4.070 2.748 2.645 2.827 . 0 0 "[ . 1 . 2]" 1
264 1 15 VAL H 1 15 VAL MG1 4.140 . 4.550 3.899 3.858 3.923 . 0 0 "[ . 1 . 2]" 1
265 1 15 VAL H 1 15 VAL MG2 3.550 . 3.900 2.932 2.810 3.017 . 0 0 "[ . 1 . 2]" 1
266 1 15 VAL H 1 16 PRO HD2 4.890 . 5.380 4.885 4.795 4.965 . 0 0 "[ . 1 . 2]" 1
267 1 15 VAL H 1 16 PRO HD3 4.900 . 5.390 4.596 4.343 4.793 . 0 0 "[ . 1 . 2]" 1
268 1 15 VAL H 1 77 ALA MB 4.440 . 4.880 4.007 3.663 4.426 . 0 0 "[ . 1 . 2]" 1
269 1 15 VAL HA 1 16 PRO HD2 3.690 . 4.060 2.212 2.061 2.325 . 0 0 "[ . 1 . 2]" 1
270 1 15 VAL HA 1 16 PRO HD3 3.560 . 3.920 2.328 2.209 2.425 . 0 0 "[ . 1 . 2]" 1
271 1 15 VAL HA 1 16 PRO HG2 4.700 . 5.170 4.382 4.256 4.469 . 0 0 "[ . 1 . 2]" 1
272 1 15 VAL HA 1 16 PRO HG3 4.500 . 4.950 4.431 4.386 4.479 . 0 0 "[ . 1 . 2]" 1
273 1 15 VAL HA 1 33 VAL MG1 4.560 . 5.020 3.067 2.773 3.421 . 0 0 "[ . 1 . 2]" 1
274 1 15 VAL HA 1 33 VAL MG2 3.690 . 4.060 2.682 2.153 3.284 . 0 0 "[ . 1 . 2]" 1
275 1 15 VAL HA 1 34 LEU H 5.280 . 5.810 4.303 3.945 4.743 . 0 0 "[ . 1 . 2]" 1
276 1 15 VAL HA 1 77 ALA MB 4.730 . 5.200 4.613 4.446 4.831 . 0 0 "[ . 1 . 2]" 1
277 1 15 VAL HA 1 79 GLN HB2 4.860 . 5.350 4.793 4.499 5.186 . 0 0 "[ . 1 . 2]" 1
278 1 15 VAL HB 1 16 PRO HD2 4.260 . 4.690 4.289 4.163 4.450 . 0 0 "[ . 1 . 2]" 1
279 1 15 VAL HB 1 16 PRO HD3 4.930 . 5.420 5.021 4.943 5.113 . 0 0 "[ . 1 . 2]" 1
280 1 15 VAL HB 1 33 VAL MG1 5.230 . 5.750 4.410 4.315 4.585 . 0 0 "[ . 1 . 2]" 1
281 1 15 VAL HB 1 33 VAL MG2 4.910 . 5.400 4.643 4.159 5.250 . 0 0 "[ . 1 . 2]" 1
282 1 15 VAL HB 1 65 TYR QD 5.500 . 6.050 4.328 4.100 4.699 . 0 0 "[ . 1 . 2]" 1
283 1 15 VAL MG1 1 16 PRO QB 4.650 . 5.120 4.231 4.093 4.412 . 0 0 "[ . 1 . 2]" 1
284 1 15 VAL MG1 1 16 PRO HD2 4.020 . 4.420 2.141 1.885 2.362 . 0 0 "[ . 1 . 2]" 1
285 1 15 VAL MG1 1 16 PRO HD3 4.310 . 4.740 3.469 3.260 3.613 . 0 0 "[ . 1 . 2]" 1
286 1 15 VAL MG1 1 16 PRO HG2 4.510 . 4.960 3.484 3.211 3.780 . 0 0 "[ . 1 . 2]" 1
287 1 15 VAL MG1 1 33 VAL HA 4.950 . 5.440 4.636 4.136 5.303 . 0 0 "[ . 1 . 2]" 1
288 1 15 VAL MG1 1 33 VAL MG1 4.030 . 4.430 3.457 3.303 3.613 . 0 0 "[ . 1 . 2]" 1
289 1 15 VAL MG1 1 33 VAL MG2 3.620 . 3.980 2.627 2.176 3.274 . 0 0 "[ . 1 . 2]" 1
290 1 15 VAL MG1 1 34 LEU H 5.500 . 6.050 5.661 5.327 5.913 . 0 0 "[ . 1 . 2]" 1
291 1 15 VAL MG1 1 65 TYR QD 3.750 . 4.130 2.188 1.951 2.515 . 0 0 "[ . 1 . 2]" 1
292 1 15 VAL MG1 1 65 TYR QE 3.610 . 3.970 2.672 2.429 3.026 . 0 0 "[ . 1 . 2]" 1
293 1 15 VAL MG1 1 77 ALA HA 5.380 . 5.920 4.644 4.351 4.977 . 0 0 "[ . 1 . 2]" 1
294 1 15 VAL MG1 1 77 ALA MB 3.510 . 3.860 2.798 2.574 3.138 . 0 0 "[ . 1 . 2]" 1
295 1 15 VAL MG1 1 79 GLN H 4.690 . 5.160 3.666 3.480 3.876 . 0 0 "[ . 1 . 2]" 1
296 1 15 VAL MG1 1 79 GLN HA 4.510 . 4.960 3.329 3.067 3.657 . 0 0 "[ . 1 . 2]" 1
297 1 15 VAL MG1 1 79 GLN HB2 3.650 . 4.020 2.236 2.044 2.555 . 0 0 "[ . 1 . 2]" 1
298 1 15 VAL MG1 1 79 GLN HE21 4.350 . 4.790 3.810 3.290 4.204 . 0 0 "[ . 1 . 2]" 1
299 1 15 VAL MG1 1 79 GLN HE22 4.520 . 4.970 4.431 3.967 4.838 . 0 0 "[ . 1 . 2]" 1
300 1 15 VAL MG2 1 16 PRO HD2 4.590 . 5.050 3.593 3.455 3.718 . 0 0 "[ . 1 . 2]" 1
301 1 15 VAL MG2 1 16 PRO HD3 4.630 . 5.090 4.256 4.102 4.400 . 0 0 "[ . 1 . 2]" 1
302 1 15 VAL MG2 1 33 VAL HA 4.380 . 4.820 3.743 3.156 4.173 . 0 0 "[ . 1 . 2]" 1
303 1 15 VAL MG2 1 33 VAL MG1 3.740 . 4.110 1.862 1.767 2.005 0.033 7 0 "[ . 1 . 2]" 1
304 1 15 VAL MG2 1 33 VAL MG2 3.750 . 4.130 2.568 2.048 3.127 . 0 0 "[ . 1 . 2]" 1
305 1 15 VAL MG2 1 34 LEU H 4.780 . 5.260 3.966 3.679 4.243 . 0 0 "[ . 1 . 2]" 1
306 1 15 VAL MG2 1 65 TYR HB2 4.410 . 4.850 2.318 2.007 2.555 . 0 0 "[ . 1 . 2]" 1
307 1 15 VAL MG2 1 65 TYR HB3 4.960 . 5.460 3.333 3.083 3.515 . 0 0 "[ . 1 . 2]" 1
308 1 15 VAL MG2 1 65 TYR QD 3.760 . 4.140 2.663 2.470 2.883 . 0 0 "[ . 1 . 2]" 1
309 1 15 VAL MG2 1 77 ALA H 4.860 . 5.350 3.715 3.456 3.944 . 0 0 "[ . 1 . 2]" 1
310 1 15 VAL MG2 1 77 ALA MB 3.180 . 3.500 1.952 1.791 2.138 0.009 13 0 "[ . 1 . 2]" 1
311 1 15 VAL MG2 1 79 GLN H 5.500 . 6.050 5.544 5.289 5.796 . 0 0 "[ . 1 . 2]" 1
312 1 15 VAL MG2 1 79 GLN HB2 4.610 . 5.070 4.535 4.271 4.894 . 0 0 "[ . 1 . 2]" 1
313 1 16 PRO HA 1 17 VAL H 2.860 . 3.150 2.236 2.174 2.332 . 0 0 "[ . 1 . 2]" 1
314 1 16 PRO HA 1 17 VAL HB 4.520 . 4.970 4.526 4.421 4.601 . 0 0 "[ . 1 . 2]" 1
315 1 16 PRO HA 1 17 VAL MG1 4.160 . 4.580 3.924 3.833 4.105 . 0 0 "[ . 1 . 2]" 1
316 1 16 PRO HA 1 18 GLY H 4.180 . 4.600 4.072 3.799 4.341 . 0 0 "[ . 1 . 2]" 1
317 1 16 PRO QB 1 17 VAL H 3.360 . 3.700 3.126 2.779 3.457 . 0 0 "[ . 1 . 2]" 1
318 1 16 PRO HB2 1 17 VAL H 3.900 . 4.290 3.300 2.881 3.695 . 0 0 "[ . 1 . 2]" 1
319 1 16 PRO HB2 1 18 GLY H 4.090 . 4.500 2.977 2.706 3.175 . 0 0 "[ . 1 . 2]" 1
320 1 16 PRO HB3 1 17 VAL H 3.900 . 4.290 3.886 3.625 4.159 . 0 0 "[ . 1 . 2]" 1
321 1 16 PRO HB3 1 18 GLY H 4.090 . 4.500 4.458 4.284 4.537 0.037 12 0 "[ . 1 . 2]" 1
322 1 16 PRO HD2 1 33 VAL MG2 3.920 . 4.310 2.486 2.116 3.177 . 0 0 "[ . 1 . 2]" 1
323 1 16 PRO HD2 1 65 TYR QE 5.500 . 6.050 4.162 3.785 4.640 . 0 0 "[ . 1 . 2]" 1
324 1 16 PRO HD2 1 79 GLN HB2 4.500 . 4.950 3.298 3.185 3.479 . 0 0 "[ . 1 . 2]" 1
325 1 16 PRO HD2 1 79 GLN HE21 5.500 . 6.050 4.338 3.643 4.601 . 0 0 "[ . 1 . 2]" 1
326 1 16 PRO HD3 1 33 VAL MG2 3.900 . 4.290 3.113 2.770 3.656 . 0 0 "[ . 1 . 2]" 1
327 1 16 PRO HD3 1 79 GLN HB2 4.470 . 4.920 4.970 4.932 5.008 0.088 19 0 "[ . 1 . 2]" 1
328 1 16 PRO HD3 1 79 GLN HE21 5.500 . 6.050 5.882 5.283 6.101 0.051 5 0 "[ . 1 . 2]" 1
329 1 16 PRO HG2 1 17 VAL H 4.540 . 4.990 4.848 4.595 5.018 0.028 8 0 "[ . 1 . 2]" 1
330 1 16 PRO HG2 1 18 GLY H 4.500 . 4.950 4.578 4.018 4.945 . 0 0 "[ . 1 . 2]" 1
331 1 16 PRO HG2 1 79 GLN HA 4.590 . 5.050 4.738 4.502 4.991 . 0 0 "[ . 1 . 2]" 1
332 1 16 PRO HG2 1 79 GLN HE22 4.680 . 5.150 3.659 3.182 4.087 . 0 0 "[ . 1 . 2]" 1
333 1 16 PRO HG3 1 79 GLN HE21 5.150 . 5.670 5.275 4.791 5.672 0.002 6 0 "[ . 1 . 2]" 1
334 1 16 PRO HG3 1 79 GLN HE22 4.640 . 5.100 4.413 3.875 4.874 . 0 0 "[ . 1 . 2]" 1
335 1 17 VAL H 1 17 VAL HB 3.110 . 3.420 2.571 2.465 2.717 . 0 0 "[ . 1 . 2]" 1
336 1 17 VAL H 1 17 VAL MG1 3.080 . 3.390 2.061 1.965 2.179 . 0 0 "[ . 1 . 2]" 1
337 1 17 VAL H 1 17 VAL MG2 3.830 . 4.210 3.790 3.771 3.821 . 0 0 "[ . 1 . 2]" 1
338 1 17 VAL H 1 18 GLY H 3.080 . 3.390 2.650 2.427 2.737 . 0 0 "[ . 1 . 2]" 1
339 1 17 VAL HA 1 17 VAL MG1 3.290 . 3.620 3.223 3.219 3.227 . 0 0 "[ . 1 . 2]" 1
340 1 17 VAL HA 1 17 VAL MG2 3.350 . 3.690 2.354 2.325 2.381 . 0 0 "[ . 1 . 2]" 1
341 1 17 VAL HA 1 79 GLN HA 4.570 . 5.030 3.175 2.708 3.795 . 0 0 "[ . 1 . 2]" 1
342 1 17 VAL HA 1 80 THR H 5.010 . 5.510 3.861 3.499 4.282 . 0 0 "[ . 1 . 2]" 1
343 1 17 VAL HB 1 18 GLY H 4.150 . 4.570 4.079 4.005 4.187 . 0 0 "[ . 1 . 2]" 1
344 1 17 VAL MG1 1 18 GLY H 3.340 . 3.670 2.323 2.158 2.613 . 0 0 "[ . 1 . 2]" 1
345 1 17 VAL MG1 1 18 GLY HA3 3.350 . 3.690 3.104 3.009 3.193 . 0 0 "[ . 1 . 2]" 1
346 1 17 VAL MG1 1 19 ALA H 5.500 . 6.050 5.438 5.249 5.583 . 0 0 "[ . 1 . 2]" 1
347 1 17 VAL MG2 1 18 GLY H 3.990 . 4.390 3.796 3.622 4.035 . 0 0 "[ . 1 . 2]" 1
348 1 18 GLY H 1 19 ALA H 4.350 . 4.790 4.360 4.189 4.437 . 0 0 "[ . 1 . 2]" 1
349 1 18 GLY H 1 19 ALA MB 4.640 . 5.100 4.506 4.334 4.771 . 0 0 "[ . 1 . 2]" 1
350 1 18 GLY H 1 80 THR H 4.700 . 5.170 4.351 4.090 4.546 . 0 0 "[ . 1 . 2]" 1
351 1 18 GLY HA2 1 19 ALA H 3.190 . 3.510 2.276 2.165 2.474 . 0 0 "[ . 1 . 2]" 1
352 1 18 GLY HA2 1 19 ALA MB 4.790 . 5.270 3.900 3.824 3.988 . 0 0 "[ . 1 . 2]" 1
353 1 18 GLY HA2 1 79 GLN HG2 4.920 . 5.410 3.629 2.745 4.670 . 0 0 "[ . 1 . 2]" 1
354 1 18 GLY HA2 1 79 GLN HG3 4.320 . 4.750 3.275 2.382 4.118 . 0 0 "[ . 1 . 2]" 1
355 1 18 GLY HA2 1 80 THR H 3.500 . 3.850 2.545 2.218 2.793 . 0 0 "[ . 1 . 2]" 1
356 1 18 GLY HA2 1 80 THR MG 4.000 . 4.400 3.804 2.248 4.411 0.011 18 0 "[ . 1 . 2]" 1
357 1 18 GLY HA3 1 19 ALA H 2.960 . 3.260 2.888 2.633 3.101 . 0 0 "[ . 1 . 2]" 1
358 1 18 GLY HA3 1 79 GLN HG3 5.320 . 5.850 4.753 3.989 5.348 . 0 0 "[ . 1 . 2]" 1
359 1 18 GLY HA3 1 80 THR H 3.750 . 4.130 3.910 3.087 4.170 0.040 7 0 "[ . 1 . 2]" 1
360 1 19 ALA H 1 19 ALA MB 3.260 . 3.590 2.671 2.556 2.758 . 0 0 "[ . 1 . 2]" 1
361 1 19 ALA H 1 20 THR H 4.430 . 4.870 4.323 4.017 4.480 . 0 0 "[ . 1 . 2]" 1
362 1 19 ALA H 1 79 GLN HG2 5.090 . 5.600 4.087 3.503 4.713 . 0 0 "[ . 1 . 2]" 1
363 1 19 ALA H 1 79 GLN HG3 4.560 . 5.020 4.261 3.809 4.713 . 0 0 "[ . 1 . 2]" 1
364 1 19 ALA H 1 80 THR H 4.450 . 4.890 4.326 4.063 4.663 . 0 0 "[ . 1 . 2]" 1
365 1 19 ALA H 1 80 THR MG 4.520 . 4.970 4.054 3.102 4.703 . 0 0 "[ . 1 . 2]" 1
366 1 19 ALA H 1 81 VAL HA 3.480 . 3.830 2.572 2.238 3.106 . 0 0 "[ . 1 . 2]" 1
367 1 19 ALA H 1 81 VAL MG1 4.780 . 5.260 4.143 3.704 4.709 . 0 0 "[ . 1 . 2]" 1
368 1 19 ALA H 1 81 VAL MG2 4.150 . 4.570 3.629 3.193 4.184 . 0 0 "[ . 1 . 2]" 1
369 1 19 ALA H 1 82 THR H 3.820 . 4.200 3.565 3.188 3.928 . 0 0 "[ . 1 . 2]" 1
370 1 19 ALA HA 1 20 THR H 2.830 . 3.110 2.283 2.164 2.418 . 0 0 "[ . 1 . 2]" 1
371 1 19 ALA HA 1 20 THR HB 4.750 . 5.220 4.632 4.495 4.728 . 0 0 "[ . 1 . 2]" 1
372 1 19 ALA MB 1 20 THR H 3.200 . 3.520 2.813 2.510 3.268 . 0 0 "[ . 1 . 2]" 1
373 1 19 ALA MB 1 20 THR HA 4.650 . 5.120 4.112 3.962 4.309 . 0 0 "[ . 1 . 2]" 1
374 1 19 ALA MB 1 20 THR HB 4.950 . 5.440 5.104 4.913 5.298 . 0 0 "[ . 1 . 2]" 1
375 1 19 ALA MB 1 21 ILE H 5.500 . 6.050 4.878 4.677 5.037 . 0 0 "[ . 1 . 2]" 1
376 1 19 ALA MB 1 21 ILE MD 4.870 . 5.360 4.589 4.074 4.903 . 0 0 "[ . 1 . 2]" 1
377 1 19 ALA MB 1 21 ILE MG 3.490 . 3.840 3.359 3.024 3.568 . 0 0 "[ . 1 . 2]" 1
378 1 19 ALA MB 1 27 PHE QE 3.650 . 4.020 2.549 2.103 3.104 . 0 0 "[ . 1 . 2]" 1
379 1 19 ALA MB 1 81 VAL MG1 3.820 . 4.200 2.607 2.131 3.042 . 0 0 "[ . 1 . 2]" 1
380 1 19 ALA MB 1 81 VAL MG2 3.610 . 3.970 2.260 1.800 2.919 . 11 0 "[ . 1 . 2]" 1
381 1 19 ALA MB 1 82 THR H 4.540 . 4.990 3.944 3.461 4.199 . 0 0 "[ . 1 . 2]" 1
382 1 20 THR H 1 20 THR HB 3.340 . 3.670 2.731 2.556 2.888 . 0 0 "[ . 1 . 2]" 1
383 1 20 THR H 1 20 THR MG 4.280 . 4.710 3.907 3.835 3.978 . 0 0 "[ . 1 . 2]" 1
384 1 20 THR H 1 21 ILE H 4.450 . 4.890 4.309 4.153 4.488 . 0 0 "[ . 1 . 2]" 1
385 1 20 THR H 1 21 ILE MG 4.650 . 5.120 3.837 3.480 4.237 . 0 0 "[ . 1 . 2]" 1
386 1 20 THR HA 1 20 THR MG 3.370 . 3.710 2.403 2.322 2.475 . 0 0 "[ . 1 . 2]" 1
387 1 20 THR HA 1 21 ILE H 3.050 . 3.360 2.157 2.129 2.178 . 0 0 "[ . 1 . 2]" 1
388 1 20 THR HA 1 81 VAL MG1 5.060 . 5.570 3.758 3.394 4.040 . 0 0 "[ . 1 . 2]" 1
389 1 20 THR HA 1 82 THR H 3.800 . 4.180 2.743 2.358 3.212 . 0 0 "[ . 1 . 2]" 1
390 1 20 THR HA 1 82 THR HB 4.020 . 4.420 2.991 2.748 3.362 . 0 0 "[ . 1 . 2]" 1
391 1 20 THR HA 1 82 THR MG 4.410 . 4.850 4.095 3.834 4.394 . 0 0 "[ . 1 . 2]" 1
392 1 20 THR HB 1 21 ILE H 4.620 . 5.080 4.242 4.096 4.319 . 0 0 "[ . 1 . 2]" 1
393 1 20 THR HB 1 84 LYS QD 5.500 . 6.050 4.981 4.449 5.666 . 0 0 "[ . 1 . 2]" 1
394 1 20 THR MG 1 21 ILE H 3.370 . 3.710 2.782 2.597 2.924 . 0 0 "[ . 1 . 2]" 1
395 1 20 THR MG 1 82 THR H 4.680 . 5.150 4.262 3.835 4.722 . 0 0 "[ . 1 . 2]" 1
396 1 20 THR MG 1 82 THR HB 3.800 . 4.180 2.947 2.363 3.546 . 0 0 "[ . 1 . 2]" 1
397 1 20 THR MG 1 84 LYS H 4.600 . 5.060 3.989 3.456 4.490 . 0 0 "[ . 1 . 2]" 1
398 1 20 THR MG 1 84 LYS HB2 5.120 . 5.630 4.001 3.491 5.033 . 0 0 "[ . 1 . 2]" 1
399 1 20 THR MG 1 84 LYS QB 4.270 . 4.700 3.656 3.380 4.030 . 0 0 "[ . 1 . 2]" 1
400 1 20 THR MG 1 84 LYS HB3 5.120 . 5.630 4.601 3.706 5.184 . 0 0 "[ . 1 . 2]" 1
401 1 20 THR MG 1 84 LYS QD 3.310 . 3.640 2.545 2.110 2.970 . 0 0 "[ . 1 . 2]" 1
402 1 20 THR MG 1 84 LYS QE 4.190 . 4.610 3.447 2.097 4.531 . 0 0 "[ . 1 . 2]" 1
403 1 21 ILE H 1 21 ILE MD 4.390 . 4.830 3.927 3.839 4.046 . 0 0 "[ . 1 . 2]" 1
404 1 21 ILE H 1 21 ILE HG12 3.850 . 4.230 2.286 2.166 2.452 . 0 0 "[ . 1 . 2]" 1
405 1 21 ILE H 1 21 ILE QG 3.310 . 3.640 2.221 2.118 2.361 . 0 0 "[ . 1 . 2]" 1
406 1 21 ILE H 1 21 ILE HG13 3.850 . 4.230 3.025 2.989 3.104 . 0 0 "[ . 1 . 2]" 1
407 1 21 ILE H 1 81 VAL MG1 4.480 . 4.930 3.675 3.377 3.963 . 0 0 "[ . 1 . 2]" 1
408 1 21 ILE H 1 82 THR HB 4.410 . 4.850 4.325 4.095 4.717 . 0 0 "[ . 1 . 2]" 1
409 1 21 ILE H 1 83 VAL H 5.230 . 5.750 4.760 4.558 4.914 . 0 0 "[ . 1 . 2]" 1
410 1 21 ILE H 1 83 VAL HA 4.010 . 4.410 2.854 2.683 3.029 . 0 0 "[ . 1 . 2]" 1
411 1 21 ILE H 1 83 VAL MG2 4.720 . 5.190 3.814 3.591 4.079 . 0 0 "[ . 1 . 2]" 1
412 1 21 ILE H 1 84 LYS H 4.210 . 4.630 3.954 3.688 4.157 . 0 0 "[ . 1 . 2]" 1
413 1 21 ILE H 1 84 LYS QD 5.500 . 6.050 5.262 4.682 5.902 . 0 0 "[ . 1 . 2]" 1
414 1 21 ILE H 1 84 LYS QG 4.790 . 5.270 4.354 3.930 4.769 . 0 0 "[ . 1 . 2]" 1
415 1 21 ILE HA 1 21 ILE MD 4.320 . 4.750 4.204 4.191 4.211 . 0 0 "[ . 1 . 2]" 1
416 1 21 ILE HA 1 21 ILE MG 3.230 . 3.550 2.335 2.298 2.370 . 0 0 "[ . 1 . 2]" 1
417 1 21 ILE HA 1 22 HIS H 3.490 . 3.840 2.571 2.491 2.605 . 0 0 "[ . 1 . 2]" 1
418 1 21 ILE HB 1 22 HIS H 3.250 . 3.580 2.116 2.033 2.175 . 0 0 "[ . 1 . 2]" 1
419 1 21 ILE HB 1 25 ASP H 4.930 . 5.420 4.643 4.192 5.098 . 0 0 "[ . 1 . 2]" 1
420 1 21 ILE HB 1 25 ASP QB 4.320 . 4.750 2.424 1.951 3.457 . 0 0 "[ . 1 . 2]" 1
421 1 21 ILE HB 1 26 SER H 5.420 . 5.960 4.921 4.151 5.803 . 0 0 "[ . 1 . 2]" 1
422 1 21 ILE MD 1 21 ILE MG 3.090 . 3.400 1.944 1.921 1.986 . 0 0 "[ . 1 . 2]" 1
423 1 21 ILE MD 1 22 HIS H 4.150 . 4.570 3.974 3.774 4.110 . 0 0 "[ . 1 . 2]" 1
424 1 21 ILE MD 1 25 ASP H 4.560 . 5.020 4.515 4.077 4.973 . 0 0 "[ . 1 . 2]" 1
425 1 21 ILE MD 1 25 ASP HB2 4.140 . 4.550 3.623 2.749 4.589 0.039 11 0 "[ . 1 . 2]" 1
426 1 21 ILE MD 1 25 ASP QB 3.600 . 3.960 3.054 2.274 4.014 0.054 11 0 "[ . 1 . 2]" 1
427 1 21 ILE MD 1 25 ASP HB3 4.140 . 4.550 3.603 2.292 4.581 0.031 6 0 "[ . 1 . 2]" 1
428 1 21 ILE MD 1 26 SER H 4.870 . 5.360 4.705 3.884 5.377 0.017 6 0 "[ . 1 . 2]" 1
429 1 21 ILE MD 1 27 PHE H 4.560 . 5.020 4.449 3.944 5.070 0.050 20 0 "[ . 1 . 2]" 1
430 1 21 ILE MD 1 27 PHE HA 4.550 . 5.010 4.252 3.897 4.691 . 0 0 "[ . 1 . 2]" 1
431 1 21 ILE MD 1 27 PHE HB2 4.160 . 4.580 2.260 1.913 2.689 . 0 0 "[ . 1 . 2]" 1
432 1 21 ILE MD 1 27 PHE QB 3.510 . 3.860 2.211 1.895 2.624 . 0 0 "[ . 1 . 2]" 1
433 1 21 ILE MD 1 27 PHE HB3 4.160 . 4.580 3.207 2.894 3.657 . 0 0 "[ . 1 . 2]" 1
434 1 21 ILE MD 1 27 PHE QD 3.760 . 4.140 3.038 2.499 3.431 . 0 0 "[ . 1 . 2]" 1
435 1 21 ILE MD 1 27 PHE QE 4.130 . 4.540 4.431 4.007 4.601 0.061 16 0 "[ . 1 . 2]" 1
436 1 21 ILE MD 1 53 VAL MG1 3.810 . 4.190 2.386 1.942 3.116 . 0 0 "[ . 1 . 2]" 1
437 1 21 ILE MD 1 55 THR HA 4.480 . 4.930 3.664 3.334 4.155 . 0 0 "[ . 1 . 2]" 1
438 1 21 ILE MD 1 55 THR MG 3.300 . 3.630 2.562 2.038 3.426 . 0 0 "[ . 1 . 2]" 1
439 1 21 ILE MD 1 81 VAL MG1 3.530 . 3.880 2.644 2.332 3.125 . 0 0 "[ . 1 . 2]" 1
440 1 21 ILE MD 1 83 VAL HA 4.530 . 4.980 3.983 3.663 4.325 . 0 0 "[ . 1 . 2]" 1
441 1 21 ILE QG 1 81 VAL MG1 3.920 . 4.310 2.622 2.308 3.019 . 0 0 "[ . 1 . 2]" 1
442 1 21 ILE QG 1 83 VAL HA 3.880 . 4.270 2.508 2.292 2.809 . 0 0 "[ . 1 . 2]" 1
443 1 21 ILE QG 1 83 VAL MG1 4.700 . 5.170 2.430 2.199 2.685 . 0 0 "[ . 1 . 2]" 1
444 1 21 ILE QG 1 83 VAL MG2 4.020 . 4.420 2.057 1.857 2.260 . 0 0 "[ . 1 . 2]" 1
445 1 21 ILE QG 1 84 LYS H 4.300 . 4.730 3.791 3.502 4.111 . 0 0 "[ . 1 . 2]" 1
446 1 21 ILE HG12 1 81 VAL MG1 4.680 . 5.150 2.668 2.339 3.084 . 0 0 "[ . 1 . 2]" 1
447 1 21 ILE HG12 1 83 VAL HA 4.700 . 5.170 3.177 2.896 3.445 . 0 0 "[ . 1 . 2]" 1
448 1 21 ILE HG13 1 81 VAL MG1 4.680 . 5.150 3.860 3.549 4.301 . 0 0 "[ . 1 . 2]" 1
449 1 21 ILE HG13 1 83 VAL HA 4.700 . 5.170 2.630 2.366 2.976 . 0 0 "[ . 1 . 2]" 1
450 1 21 ILE MG 1 22 HIS H 3.670 . 4.040 3.556 3.508 3.603 . 0 0 "[ . 1 . 2]" 1
451 1 21 ILE MG 1 25 ASP HB2 4.610 . 5.070 4.004 3.273 4.721 . 0 0 "[ . 1 . 2]" 1
452 1 21 ILE MG 1 25 ASP QB 3.950 . 4.350 3.327 2.811 4.053 . 0 0 "[ . 1 . 2]" 1
453 1 21 ILE MG 1 25 ASP HB3 4.610 . 5.070 3.609 3.061 4.723 . 0 0 "[ . 1 . 2]" 1
454 1 21 ILE MG 1 27 PHE QD 3.770 . 4.150 2.577 2.149 3.247 . 0 0 "[ . 1 . 2]" 1
455 1 21 ILE MG 1 27 PHE QE 4.360 . 4.800 3.853 3.342 4.649 . 0 0 "[ . 1 . 2]" 1
456 1 21 ILE MG 1 81 VAL MG1 4.000 . 4.400 3.214 2.827 3.588 . 0 0 "[ . 1 . 2]" 1
457 1 22 HIS H 1 22 HIS HB2 3.720 . 4.090 2.587 2.483 2.725 . 0 0 "[ . 1 . 2]" 1
458 1 22 HIS H 1 22 HIS QB 3.190 . 3.510 2.543 2.446 2.669 . 0 0 "[ . 1 . 2]" 1
459 1 22 HIS H 1 22 HIS HB3 3.720 . 4.090 3.751 3.690 3.812 . 0 0 "[ . 1 . 2]" 1
460 1 22 HIS H 1 23 VAL H 4.560 . 5.020 4.514 4.401 4.555 . 0 0 "[ . 1 . 2]" 1
461 1 22 HIS H 1 25 ASP H 4.730 . 5.200 4.124 3.666 4.703 . 0 0 "[ . 1 . 2]" 1
462 1 22 HIS H 1 25 ASP QB 3.840 . 4.220 2.441 1.993 3.037 . 0 0 "[ . 1 . 2]" 1
463 1 22 HIS HA 1 22 HIS HD2 3.810 . 4.190 3.178 2.967 3.453 . 0 0 "[ . 1 . 2]" 1
464 1 22 HIS HA 1 23 VAL H 3.110 . 3.420 2.354 2.186 2.519 . 0 0 "[ . 1 . 2]" 1
465 1 22 HIS HA 1 23 VAL HB 5.070 . 5.580 4.873 4.744 5.036 . 0 0 "[ . 1 . 2]" 1
466 1 22 HIS HA 1 23 VAL MG2 4.320 . 4.750 3.725 3.596 3.836 . 0 0 "[ . 1 . 2]" 1
467 1 22 HIS HA 1 83 VAL HA 4.530 . 4.980 3.782 3.534 3.990 . 0 0 "[ . 1 . 2]" 1
468 1 22 HIS HA 1 83 VAL MG1 4.210 . 4.630 3.024 2.686 3.296 . 0 0 "[ . 1 . 2]" 1
469 1 22 HIS HA 1 84 LYS H 3.650 . 4.020 2.318 2.044 2.747 . 0 0 "[ . 1 . 2]" 1
470 1 22 HIS HA 1 84 LYS QB 4.370 . 4.810 3.469 2.736 4.499 . 0 0 "[ . 1 . 2]" 1
471 1 22 HIS QB 1 23 VAL H 3.470 . 3.820 2.475 2.121 2.912 . 0 0 "[ . 1 . 2]" 1
472 1 22 HIS HB2 1 23 VAL H 4.320 . 4.750 3.724 3.475 4.091 . 0 0 "[ . 1 . 2]" 1
473 1 22 HIS HB3 1 23 VAL H 4.320 . 4.750 2.513 2.140 2.980 . 0 0 "[ . 1 . 2]" 1
474 1 22 HIS HD2 1 23 VAL H 4.560 . 5.020 4.096 3.863 4.484 . 0 0 "[ . 1 . 2]" 1
475 1 22 HIS HD2 1 84 LYS HA 4.770 . 5.250 4.875 4.488 5.214 . 0 0 "[ . 1 . 2]" 1
476 1 22 HIS HD2 1 84 LYS QB 3.450 . 3.790 2.710 2.087 3.883 0.093 10 0 "[ . 1 . 2]" 1
477 1 22 HIS HD2 1 84 LYS QD 4.030 . 4.430 3.967 3.007 4.408 . 0 0 "[ . 1 . 2]" 1
478 1 22 HIS HD2 1 85 VAL H 4.160 . 4.580 4.423 4.067 4.642 0.062 9 0 "[ . 1 . 2]" 1
479 1 22 HIS HD2 1 85 VAL HA 4.110 . 4.520 4.529 4.310 4.606 0.086 4 0 "[ . 1 . 2]" 1
480 1 22 HIS HD2 1 85 VAL MG2 5.230 . 5.750 5.653 5.417 5.799 0.049 9 0 "[ . 1 . 2]" 1
481 1 22 HIS HD2 1 86 ARG H 4.820 . 5.300 4.638 3.820 5.142 . 0 0 "[ . 1 . 2]" 1
482 1 22 HIS HD2 1 86 ARG HA 3.830 . 4.210 3.804 3.149 4.243 0.033 14 0 "[ . 1 . 2]" 1
483 1 23 VAL H 1 23 VAL HB 3.220 . 3.540 2.531 2.473 2.612 . 0 0 "[ . 1 . 2]" 1
484 1 23 VAL H 1 23 VAL MG1 3.990 . 4.390 3.777 3.767 3.787 . 0 0 "[ . 1 . 2]" 1
485 1 23 VAL H 1 23 VAL MG2 3.050 . 3.360 2.076 1.936 2.180 . 0 0 "[ . 1 . 2]" 1
486 1 23 VAL H 1 24 GLY H 4.670 . 5.140 4.506 4.436 4.634 . 0 0 "[ . 1 . 2]" 1
487 1 23 VAL H 1 83 VAL HA 5.280 . 5.810 5.239 4.844 5.680 . 0 0 "[ . 1 . 2]" 1
488 1 23 VAL H 1 83 VAL MG1 3.530 . 3.880 3.120 2.809 3.630 . 0 0 "[ . 1 . 2]" 1
489 1 23 VAL H 1 84 LYS H 4.100 . 4.510 3.869 3.580 4.270 . 0 0 "[ . 1 . 2]" 1
490 1 23 VAL H 1 84 LYS HA 5.440 . 5.980 4.988 4.773 5.296 . 0 0 "[ . 1 . 2]" 1
491 1 23 VAL H 1 84 LYS QB 5.200 . 5.720 4.669 4.256 5.295 . 0 0 "[ . 1 . 2]" 1
492 1 23 VAL H 1 85 VAL HA 3.900 . 4.290 2.964 2.414 3.528 . 0 0 "[ . 1 . 2]" 1
493 1 23 VAL H 1 85 VAL MG1 5.490 . 6.040 4.601 4.089 5.196 . 0 0 "[ . 1 . 2]" 1
494 1 23 VAL H 1 85 VAL MG2 5.500 . 6.050 4.561 3.962 5.105 . 0 0 "[ . 1 . 2]" 1
495 1 23 VAL H 1 86 ARG H 4.300 . 4.730 3.711 2.798 4.472 . 0 0 "[ . 1 . 2]" 1
496 1 23 VAL HA 1 23 VAL MG1 3.370 . 3.710 2.447 2.413 2.488 . 0 0 "[ . 1 . 2]" 1
497 1 23 VAL HA 1 24 GLY H 3.100 . 3.410 2.165 2.143 2.235 . 0 0 "[ . 1 . 2]" 1
498 1 23 VAL HA 1 25 ASP H 3.920 . 4.310 3.534 3.350 3.807 . 0 0 "[ . 1 . 2]" 1
499 1 23 VAL HA 1 83 VAL MG1 3.790 . 4.170 2.922 2.499 3.326 . 0 0 "[ . 1 . 2]" 1
500 1 23 VAL HB 1 24 GLY H 4.270 . 4.700 4.303 4.123 4.403 . 0 0 "[ . 1 . 2]" 1
501 1 23 VAL HB 1 86 ARG H 3.950 . 4.350 2.948 2.222 3.645 . 0 0 "[ . 1 . 2]" 1
502 1 23 VAL MG1 1 24 GLY H 3.330 . 3.660 2.864 2.474 3.045 . 0 0 "[ . 1 . 2]" 1
503 1 23 VAL MG1 1 24 GLY QA 4.400 . 4.840 3.231 3.030 3.388 . 0 0 "[ . 1 . 2]" 1
504 1 23 VAL MG1 1 25 ASP H 4.390 . 4.830 4.628 4.405 4.836 0.006 18 0 "[ . 1 . 2]" 1
505 1 23 VAL MG1 1 56 THR H 4.650 . 5.120 4.223 4.006 4.418 . 0 0 "[ . 1 . 2]" 1
506 1 23 VAL MG1 1 56 THR HA 3.290 . 3.620 2.021 1.755 2.416 0.045 12 0 "[ . 1 . 2]" 1
507 1 23 VAL MG1 1 57 LYS H 4.260 . 4.690 3.990 3.406 4.683 . 0 0 "[ . 1 . 2]" 1
508 1 23 VAL MG2 1 24 GLY H 4.210 . 4.630 4.066 3.931 4.154 . 0 0 "[ . 1 . 2]" 1
509 1 23 VAL MG2 1 25 ASP H 5.210 . 5.730 5.252 5.097 5.478 . 0 0 "[ . 1 . 2]" 1
510 1 23 VAL MG2 1 56 THR H 5.310 . 5.840 4.796 4.230 5.481 . 0 0 "[ . 1 . 2]" 1
511 1 23 VAL MG2 1 56 THR HA 4.330 . 4.760 3.706 2.744 4.487 . 0 0 "[ . 1 . 2]" 1
512 1 23 VAL MG2 1 57 LYS H 4.200 . 4.620 3.764 3.283 4.330 . 0 0 "[ . 1 . 2]" 1
513 1 23 VAL MG2 1 57 LYS HA 4.360 . 4.800 3.431 2.917 3.966 . 0 0 "[ . 1 . 2]" 1
514 1 23 VAL MG2 1 58 ALA H 3.690 . 4.060 3.204 2.693 3.671 . 0 0 "[ . 1 . 2]" 1
515 1 23 VAL MG2 1 58 ALA HA 4.150 . 4.570 3.205 2.669 3.769 . 0 0 "[ . 1 . 2]" 1
516 1 23 VAL MG2 1 58 ALA MB 3.540 . 3.890 2.673 2.193 3.285 . 0 0 "[ . 1 . 2]" 1
517 1 23 VAL MG2 1 59 GLY H 5.000 . 5.500 4.934 4.478 5.554 0.054 13 0 "[ . 1 . 2]" 1
518 1 23 VAL MG2 1 83 VAL HB 4.500 . 4.950 4.296 3.897 4.933 . 0 0 "[ . 1 . 2]" 1
519 1 23 VAL MG2 1 83 VAL MG1 2.970 . 3.270 2.383 2.097 2.885 . 0 0 "[ . 1 . 2]" 1
520 1 23 VAL MG2 1 84 LYS HA 4.740 . 5.210 4.107 3.735 4.537 . 0 0 "[ . 1 . 2]" 1
521 1 23 VAL MG2 1 85 VAL H 4.540 . 4.990 3.835 3.589 4.049 . 0 0 "[ . 1 . 2]" 1
522 1 23 VAL MG2 1 85 VAL HA 3.520 . 3.870 2.137 1.809 2.590 . 0 0 "[ . 1 . 2]" 1
523 1 23 VAL MG2 1 85 VAL HB 4.630 . 5.090 4.345 4.057 4.721 . 0 0 "[ . 1 . 2]" 1
524 1 23 VAL MG2 1 85 VAL MG1 3.880 . 4.270 2.867 2.411 3.450 . 0 0 "[ . 1 . 2]" 1
525 1 23 VAL MG2 1 86 ARG H 3.800 . 4.180 3.526 2.915 4.137 . 0 0 "[ . 1 . 2]" 1
526 1 24 GLY H 1 25 ASP H 3.500 . 3.850 2.451 2.205 2.778 . 0 0 "[ . 1 . 2]" 1
527 1 24 GLY H 1 55 THR HA 4.160 . 4.580 3.787 3.401 4.036 . 0 0 "[ . 1 . 2]" 1
528 1 24 GLY H 1 55 THR HB 3.790 . 4.170 2.669 1.870 3.267 . 0 0 "[ . 1 . 2]" 1
529 1 24 GLY H 1 55 THR MG 4.190 . 4.610 4.199 3.622 4.634 0.024 9 0 "[ . 1 . 2]" 1
530 1 24 GLY H 1 56 THR HA 4.640 . 5.100 3.784 3.194 4.189 . 0 0 "[ . 1 . 2]" 1
531 1 24 GLY H 1 83 VAL MG1 4.590 . 5.050 4.327 3.840 4.890 . 0 0 "[ . 1 . 2]" 1
532 1 24 GLY QA 1 55 THR MG 5.340 . 5.870 4.873 4.351 5.311 . 0 0 "[ . 1 . 2]" 1
533 1 25 ASP H 1 25 ASP HB2 3.690 . 4.060 2.443 2.163 3.681 . 0 0 "[ . 1 . 2]" 1
534 1 25 ASP H 1 25 ASP QB 3.060 . 3.370 2.324 2.114 2.609 . 0 0 "[ . 1 . 2]" 1
535 1 25 ASP H 1 25 ASP HB3 3.690 . 4.060 3.292 2.604 3.633 . 0 0 "[ . 1 . 2]" 1
536 1 25 ASP H 1 55 THR MG 4.560 . 5.020 4.156 3.228 4.797 . 0 0 "[ . 1 . 2]" 1
537 1 25 ASP HA 1 26 SER H 2.910 . 3.200 2.564 2.158 2.828 . 0 0 "[ . 1 . 2]" 1
538 1 25 ASP QB 1 26 SER H 3.220 . 3.540 2.420 1.787 3.343 0.013 2 0 "[ . 1 . 2]" 1
539 1 25 ASP HB2 1 26 SER H 3.830 . 4.210 3.541 1.991 4.250 0.040 18 0 "[ . 1 . 2]" 1
540 1 25 ASP HB3 1 26 SER H 3.830 . 4.210 2.548 1.801 3.610 . 0 0 "[ . 1 . 2]" 1
541 1 26 SER H 1 26 SER QB 3.060 . 3.370 2.708 2.469 3.208 . 0 0 "[ . 1 . 2]" 1
542 1 26 SER H 1 27 PHE H 4.650 . 5.120 4.454 4.081 4.625 . 0 0 "[ . 1 . 2]" 1
543 1 26 SER HA 1 27 PHE H 2.730 . 3.000 2.264 2.148 2.552 . 0 0 "[ . 1 . 2]" 1
544 1 26 SER HA 1 55 THR MG 4.510 . 4.960 3.081 2.214 4.033 . 0 0 "[ . 1 . 2]" 1
545 1 26 SER QB 1 27 PHE H 3.280 . 3.610 2.864 2.158 3.472 . 0 0 "[ . 1 . 2]" 1
546 1 26 SER QB 1 28 VAL MG2 3.880 . 4.270 3.654 3.350 3.996 . 0 0 "[ . 1 . 2]" 1
547 1 27 PHE H 1 27 PHE HB2 3.900 . 4.290 3.219 2.906 3.424 . 0 0 "[ . 1 . 2]" 1
548 1 27 PHE H 1 27 PHE QB 3.370 . 3.710 2.670 2.469 2.835 . 0 0 "[ . 1 . 2]" 1
549 1 27 PHE H 1 27 PHE HB3 3.900 . 4.290 2.853 2.619 3.043 . 0 0 "[ . 1 . 2]" 1
550 1 27 PHE H 1 27 PHE QD 4.570 . 5.030 4.406 4.298 4.495 . 0 0 "[ . 1 . 2]" 1
551 1 27 PHE H 1 28 VAL H 4.310 . 4.740 4.210 3.896 4.452 . 0 0 "[ . 1 . 2]" 1
552 1 27 PHE H 1 28 VAL MG2 4.340 . 4.770 3.846 3.458 4.283 . 0 0 "[ . 1 . 2]" 1
553 1 27 PHE H 1 55 THR MG 3.820 . 4.200 3.581 2.770 4.223 0.023 19 0 "[ . 1 . 2]" 1
554 1 27 PHE HA 1 27 PHE QD 3.860 . 4.250 2.830 2.559 2.989 . 0 0 "[ . 1 . 2]" 1
555 1 27 PHE HA 1 28 VAL H 2.910 . 3.200 2.189 2.145 2.245 . 0 0 "[ . 1 . 2]" 1
556 1 27 PHE HA 1 28 VAL HB 4.730 . 5.200 4.678 4.592 4.769 . 0 0 "[ . 1 . 2]" 1
557 1 27 PHE HA 1 28 VAL MG2 3.960 . 4.360 3.605 3.311 3.842 . 0 0 "[ . 1 . 2]" 1
558 1 27 PHE QB 1 55 THR MG 3.600 . 3.960 3.350 2.753 3.737 . 0 0 "[ . 1 . 2]" 1
559 1 27 PHE QB 1 81 VAL MG1 5.060 . 5.570 3.872 3.469 4.319 . 0 0 "[ . 1 . 2]" 1
560 1 27 PHE HB2 1 28 VAL H 4.550 . 5.010 4.310 4.145 4.462 . 0 0 "[ . 1 . 2]" 1
561 1 27 PHE HB2 1 55 THR MG 4.110 . 4.520 3.886 3.336 4.535 0.015 19 0 "[ . 1 . 2]" 1
562 1 27 PHE HB3 1 28 VAL H 4.550 . 5.010 4.200 4.014 4.375 . 0 0 "[ . 1 . 2]" 1
563 1 27 PHE HB3 1 55 THR MG 4.110 . 4.520 3.692 2.895 4.337 . 0 0 "[ . 1 . 2]" 1
564 1 27 PHE QD 1 28 VAL H 3.890 . 4.280 3.624 3.333 3.948 . 0 0 "[ . 1 . 2]" 1
565 1 27 PHE QD 1 29 PRO HA 4.680 . 5.150 4.255 3.685 4.769 . 0 0 "[ . 1 . 2]" 1
566 1 27 PHE QD 1 29 PRO QB 4.320 . 4.750 4.049 3.183 4.712 . 0 0 "[ . 1 . 2]" 1
567 1 27 PHE QD 1 29 PRO HD2 4.920 . 5.410 4.113 3.664 4.569 . 0 0 "[ . 1 . 2]" 1
568 1 27 PHE QD 1 29 PRO HD3 4.920 . 5.410 2.479 2.013 2.959 . 0 0 "[ . 1 . 2]" 1
569 1 27 PHE QD 1 29 PRO HG2 5.010 . 5.510 4.978 4.091 5.530 0.020 6 0 "[ . 1 . 2]" 1
570 1 27 PHE QD 1 29 PRO HG3 4.350 . 4.790 3.786 2.648 4.584 . 0 0 "[ . 1 . 2]" 1
571 1 27 PHE QD 1 53 VAL HB 4.560 . 5.020 3.766 2.795 4.621 . 0 0 "[ . 1 . 2]" 1
572 1 27 PHE QD 1 53 VAL MG2 4.360 . 4.800 3.649 2.445 4.233 . 0 0 "[ . 1 . 2]" 1
573 1 27 PHE QD 1 55 THR MG 4.780 . 5.260 4.884 4.181 5.292 0.032 13 0 "[ . 1 . 2]" 1
574 1 27 PHE QD 1 63 LEU MD1 4.000 . 4.400 3.501 3.048 4.032 . 0 0 "[ . 1 . 2]" 1
575 1 27 PHE QD 1 81 VAL MG1 4.740 . 5.210 3.648 3.254 4.067 . 0 0 "[ . 1 . 2]" 1
576 1 27 PHE QD 1 81 VAL MG2 4.650 . 5.120 3.955 3.712 4.231 . 0 0 "[ . 1 . 2]" 1
577 1 27 PHE QE 1 29 PRO HA 3.470 . 3.820 2.988 2.397 3.639 . 0 0 "[ . 1 . 2]" 1
578 1 27 PHE QE 1 29 PRO QB 3.830 . 4.210 2.835 2.116 3.737 . 0 0 "[ . 1 . 2]" 1
579 1 27 PHE QE 1 29 PRO HG2 5.460 . 6.010 4.914 4.213 5.330 . 0 0 "[ . 1 . 2]" 1
580 1 27 PHE QE 1 29 PRO HG3 4.330 . 4.760 3.702 2.455 4.514 . 0 0 "[ . 1 . 2]" 1
581 1 27 PHE QE 1 53 VAL MG2 4.130 . 4.540 3.546 2.416 4.440 . 0 0 "[ . 1 . 2]" 1
582 1 27 PHE QE 1 63 LEU MD1 3.390 . 3.730 2.283 1.985 2.629 . 0 0 "[ . 1 . 2]" 1
583 1 27 PHE QE 1 63 LEU MD2 5.090 . 5.600 4.540 3.921 5.025 . 0 0 "[ . 1 . 2]" 1
584 1 27 PHE QE 1 79 GLN HE21 4.860 . 5.350 3.915 3.306 5.157 . 0 0 "[ . 1 . 2]" 1
585 1 27 PHE QE 1 79 GLN HE22 4.530 . 4.980 3.066 2.219 4.543 . 0 0 "[ . 1 . 2]" 1
586 1 27 PHE QE 1 81 VAL MG1 5.020 . 5.520 3.540 3.156 4.188 . 0 0 "[ . 1 . 2]" 1
587 1 27 PHE QE 1 81 VAL MG2 4.240 . 4.660 2.941 2.660 3.335 . 0 0 "[ . 1 . 2]" 1
588 1 27 PHE HZ 1 29 PRO HA 4.280 . 4.710 3.869 3.235 4.400 . 0 0 "[ . 1 . 2]" 1
589 1 27 PHE HZ 1 79 GLN HE21 4.370 . 4.810 3.374 2.799 4.197 . 0 0 "[ . 1 . 2]" 1
590 1 27 PHE HZ 1 79 GLN HE22 4.350 . 4.790 2.154 1.733 3.724 0.067 19 0 "[ . 1 . 2]" 1
591 1 27 PHE HZ 1 81 VAL MG2 4.390 . 4.830 2.808 2.211 3.528 . 0 0 "[ . 1 . 2]" 1
592 1 28 VAL H 1 28 VAL HB 3.440 . 3.780 2.674 2.548 2.792 . 0 0 "[ . 1 . 2]" 1
593 1 28 VAL H 1 28 VAL MG1 4.040 . 4.440 3.884 3.826 3.940 . 0 0 "[ . 1 . 2]" 1
594 1 28 VAL H 1 28 VAL MG2 3.300 . 3.630 2.673 2.568 2.777 . 0 0 "[ . 1 . 2]" 1
595 1 28 VAL H 1 29 PRO HD2 4.930 . 5.420 4.657 4.404 5.097 . 0 0 "[ . 1 . 2]" 1
596 1 28 VAL H 1 29 PRO HD3 4.930 . 5.420 4.154 3.923 4.538 . 0 0 "[ . 1 . 2]" 1
597 1 28 VAL H 1 31 ALA MB 4.680 . 5.150 4.210 3.703 5.165 0.015 18 0 "[ . 1 . 2]" 1
598 1 28 VAL HA 1 28 VAL MG1 3.270 . 3.600 2.394 2.357 2.450 . 0 0 "[ . 1 . 2]" 1
599 1 28 VAL HA 1 28 VAL MG2 3.390 . 3.730 2.417 2.348 2.471 . 0 0 "[ . 1 . 2]" 1
600 1 28 VAL HA 1 29 PRO HD2 3.530 . 3.880 2.056 1.883 2.485 . 0 0 "[ . 1 . 2]" 1
601 1 28 VAL HA 1 29 PRO HD3 3.530 . 3.880 2.534 2.054 2.752 . 0 0 "[ . 1 . 2]" 1
602 1 28 VAL HA 1 29 PRO HG2 4.540 . 4.990 4.206 4.059 4.454 . 0 0 "[ . 1 . 2]" 1
603 1 28 VAL HA 1 29 PRO HG3 4.720 . 5.190 4.433 4.253 4.505 . 0 0 "[ . 1 . 2]" 1
604 1 28 VAL HA 1 30 MET H 4.500 . 4.950 3.868 3.632 4.293 . 0 0 "[ . 1 . 2]" 1
605 1 28 VAL HB 1 31 ALA H 3.980 . 4.380 3.549 3.329 4.165 . 0 0 "[ . 1 . 2]" 1
606 1 28 VAL HB 1 31 ALA MB 3.460 . 3.810 2.309 1.998 3.085 . 0 0 "[ . 1 . 2]" 1
607 1 28 VAL HB 1 32 GLU H 4.920 . 5.410 4.390 3.438 5.010 . 0 0 "[ . 1 . 2]" 1
608 1 28 VAL MG1 1 29 PRO HD2 4.450 . 4.890 3.027 2.602 3.209 . 0 0 "[ . 1 . 2]" 1
609 1 28 VAL MG1 1 29 PRO QD 3.770 . 4.150 2.949 2.566 3.130 . 0 0 "[ . 1 . 2]" 1
610 1 28 VAL MG1 1 29 PRO HD3 4.450 . 4.890 4.110 3.734 4.347 . 0 0 "[ . 1 . 2]" 1
611 1 28 VAL MG1 1 30 MET H 3.200 . 3.520 2.564 2.260 2.924 . 0 0 "[ . 1 . 2]" 1
612 1 28 VAL MG1 1 30 MET HA 4.770 . 5.250 4.378 4.171 4.818 . 0 0 "[ . 1 . 2]" 1
613 1 28 VAL MG1 1 30 MET HB2 4.800 . 5.280 3.037 2.753 3.530 . 0 0 "[ . 1 . 2]" 1
614 1 28 VAL MG1 1 30 MET QB 4.180 . 4.600 2.972 2.703 3.444 . 0 0 "[ . 1 . 2]" 1
615 1 28 VAL MG1 1 30 MET HB3 4.800 . 5.280 4.228 3.935 4.789 . 0 0 "[ . 1 . 2]" 1
616 1 28 VAL MG1 1 30 MET QG 5.030 . 5.530 4.103 3.799 4.441 . 0 0 "[ . 1 . 2]" 1
617 1 28 VAL MG1 1 31 ALA H 3.070 . 3.380 2.054 1.789 2.381 0.011 11 0 "[ . 1 . 2]" 1
618 1 28 VAL MG1 1 31 ALA HA 4.150 . 4.570 3.750 3.428 3.978 . 0 0 "[ . 1 . 2]" 1
619 1 28 VAL MG1 1 31 ALA MB 3.320 . 3.650 2.091 1.899 2.302 . 0 0 "[ . 1 . 2]" 1
620 1 28 VAL MG1 1 32 GLU H 4.440 . 4.880 3.814 3.418 4.109 . 0 0 "[ . 1 . 2]" 1
621 1 28 VAL MG1 1 32 GLU HA 5.500 . 6.050 6.004 5.652 6.187 0.137 11 0 "[ . 1 . 2]" 1
622 1 28 VAL MG2 1 29 PRO QD 4.210 . 4.630 3.696 3.454 3.793 . 0 0 "[ . 1 . 2]" 1
623 1 28 VAL MG2 1 31 ALA H 5.010 . 5.510 4.702 4.517 4.990 . 0 0 "[ . 1 . 2]" 1
624 1 28 VAL MG2 1 31 ALA MB 3.890 . 4.280 3.375 3.103 3.839 . 0 0 "[ . 1 . 2]" 1
625 1 29 PRO HA 1 33 VAL MG2 5.040 . 5.540 3.497 2.693 4.258 . 0 0 "[ . 1 . 2]" 1
626 1 29 PRO HA 1 49 VAL MG2 5.500 . 6.050 5.157 4.440 6.083 0.033 11 0 "[ . 1 . 2]" 1
627 1 29 PRO HA 1 63 LEU MD1 4.070 . 4.480 3.813 3.196 4.376 . 0 0 "[ . 1 . 2]" 1
628 1 29 PRO HA 1 65 TYR QE 5.070 . 5.580 3.902 3.390 4.549 . 0 0 "[ . 1 . 2]" 1
629 1 29 PRO HA 1 65 TYR HH 4.020 . 4.420 3.359 2.830 3.925 . 0 0 "[ . 1 . 2]" 1
630 1 29 PRO HA 1 79 GLN HE21 5.470 . 6.020 4.705 3.898 5.400 . 0 0 "[ . 1 . 2]" 1
631 1 29 PRO QB 1 30 MET H 4.020 . 4.420 2.986 2.440 3.327 . 0 0 "[ . 1 . 2]" 1
632 1 29 PRO QB 1 49 VAL MG1 3.620 . 3.980 2.681 2.279 3.118 . 0 0 "[ . 1 . 2]" 1
633 1 29 PRO QB 1 49 VAL MG2 3.950 . 4.350 2.878 2.004 3.751 . 0 0 "[ . 1 . 2]" 1
634 1 29 PRO QB 1 63 LEU MD1 3.320 . 3.650 2.450 2.002 2.952 . 0 0 "[ . 1 . 2]" 1
635 1 29 PRO QB 1 65 TYR HH 4.350 . 4.790 2.385 1.788 3.377 0.012 17 0 "[ . 1 . 2]" 1
636 1 29 PRO HB2 1 49 VAL MG1 4.170 . 4.590 2.866 2.353 3.249 . 0 0 "[ . 1 . 2]" 1
637 1 29 PRO HB2 1 63 LEU MD1 3.780 . 4.160 3.652 2.938 4.169 0.009 3 0 "[ . 1 . 2]" 1
638 1 29 PRO HB2 1 65 TYR QE 3.760 . 4.140 2.385 1.937 2.991 . 0 0 "[ . 1 . 2]" 1
639 1 29 PRO HB2 1 65 TYR HH 5.150 . 5.670 3.346 2.104 4.976 . 0 0 "[ . 1 . 2]" 1
640 1 29 PRO HB3 1 49 VAL MG1 4.170 . 4.590 3.312 2.604 4.015 . 0 0 "[ . 1 . 2]" 1
641 1 29 PRO HB3 1 63 LEU MD1 3.780 . 4.160 2.493 2.034 3.029 . 0 0 "[ . 1 . 2]" 1
642 1 29 PRO HB3 1 65 TYR QE 3.760 . 4.140 2.962 1.774 3.970 0.026 16 0 "[ . 1 . 2]" 1
643 1 29 PRO HB3 1 65 TYR HH 5.150 . 5.670 2.489 1.793 3.596 0.007 17 0 "[ . 1 . 2]" 1
644 1 29 PRO QD 1 30 MET H 3.940 . 4.330 2.911 2.529 3.098 . 0 0 "[ . 1 . 2]" 1
645 1 29 PRO QD 1 30 MET QB 4.900 . 5.390 4.466 4.078 4.703 . 0 0 "[ . 1 . 2]" 1
646 1 29 PRO HD2 1 30 MET H 4.710 . 5.180 2.981 2.565 3.189 . 0 0 "[ . 1 . 2]" 1
647 1 29 PRO HD3 1 30 MET H 4.710 . 5.180 4.100 3.853 4.203 . 0 0 "[ . 1 . 2]" 1
648 1 29 PRO HG2 1 30 MET H 4.940 . 5.430 2.884 2.275 4.115 . 0 0 "[ . 1 . 2]" 1
649 1 29 PRO HG2 1 49 VAL MG1 4.720 . 5.190 3.318 2.329 3.890 . 0 0 "[ . 1 . 2]" 1
650 1 29 PRO HG2 1 49 VAL MG2 4.720 . 5.190 3.679 2.947 4.307 . 0 0 "[ . 1 . 2]" 1
651 1 29 PRO HG2 1 63 LEU MD1 4.610 . 5.070 4.284 2.912 5.074 0.004 18 0 "[ . 1 . 2]" 1
652 1 29 PRO HG3 1 30 MET H 4.160 . 4.580 4.172 3.880 4.612 0.032 16 0 "[ . 1 . 2]" 1
653 1 29 PRO HG3 1 49 VAL MG1 4.340 . 4.770 3.321 2.594 3.940 . 0 0 "[ . 1 . 2]" 1
654 1 29 PRO HG3 1 49 VAL MG2 4.560 . 5.020 4.420 3.404 5.043 0.023 9 0 "[ . 1 . 2]" 1
655 1 29 PRO HG3 1 63 LEU MD1 3.850 . 4.230 3.194 2.299 4.064 . 0 0 "[ . 1 . 2]" 1
656 1 30 MET H 1 30 MET HB2 3.550 . 3.900 2.388 2.339 2.426 . 0 0 "[ . 1 . 2]" 1
657 1 30 MET H 1 30 MET QB 3.020 . 3.320 2.356 2.310 2.392 . 0 0 "[ . 1 . 2]" 1
658 1 30 MET H 1 30 MET HB3 3.550 . 3.900 3.610 3.591 3.630 . 0 0 "[ . 1 . 2]" 1
659 1 30 MET H 1 30 MET ME 4.540 . 4.990 4.103 3.876 4.782 . 0 0 "[ . 1 . 2]" 1
660 1 30 MET H 1 30 MET HG2 4.130 . 4.540 2.754 2.547 3.671 . 0 0 "[ . 1 . 2]" 1
661 1 30 MET H 1 30 MET QG 3.610 . 3.970 2.603 2.516 2.690 . 0 0 "[ . 1 . 2]" 1
662 1 30 MET H 1 30 MET HG3 4.130 . 4.540 3.492 2.716 3.912 . 0 0 "[ . 1 . 2]" 1
663 1 30 MET H 1 31 ALA H 3.470 . 3.820 2.605 2.529 2.719 . 0 0 "[ . 1 . 2]" 1
664 1 30 MET H 1 31 ALA MB 4.360 . 4.800 4.236 4.127 4.292 . 0 0 "[ . 1 . 2]" 1
665 1 30 MET H 1 49 VAL MG2 4.810 . 5.290 4.286 3.508 4.813 . 0 0 "[ . 1 . 2]" 1
666 1 30 MET HA 1 30 MET ME 3.660 . 4.030 2.048 1.751 3.630 0.049 3 0 "[ . 1 . 2]" 1
667 1 30 MET HA 1 33 VAL H 4.430 . 4.870 3.729 3.175 4.307 . 0 0 "[ . 1 . 2]" 1
668 1 30 MET HA 1 33 VAL HB 4.200 . 4.620 3.311 2.584 3.913 . 0 0 "[ . 1 . 2]" 1
669 1 30 MET HA 1 33 VAL MG2 5.170 . 5.690 4.144 2.282 4.820 . 0 0 "[ . 1 . 2]" 1
670 1 30 MET HA 1 65 TYR QE 4.840 . 5.320 4.445 3.509 5.328 0.008 3 0 "[ . 1 . 2]" 1
671 1 30 MET QB 1 30 MET ME 3.840 . 4.220 2.470 1.796 2.727 0.004 6 0 "[ . 1 . 2]" 1
672 1 30 MET QB 1 31 ALA H 3.920 . 4.310 3.330 3.198 3.562 . 0 0 "[ . 1 . 2]" 1
673 1 30 MET HB2 1 31 ALA H 4.620 . 5.080 3.506 3.339 3.795 . 0 0 "[ . 1 . 2]" 1
674 1 30 MET HB3 1 31 ALA H 4.620 . 5.080 4.160 4.059 4.314 . 0 0 "[ . 1 . 2]" 1
675 1 30 MET ME 1 30 MET HG2 3.470 . 3.820 2.612 2.475 3.413 . 0 0 "[ . 1 . 2]" 1
676 1 30 MET ME 1 30 MET HG3 3.470 . 3.820 3.341 2.540 3.440 . 0 0 "[ . 1 . 2]" 1
677 1 30 MET ME 1 31 ALA H 5.020 . 5.520 4.755 4.477 5.374 . 0 0 "[ . 1 . 2]" 1
678 1 30 MET ME 1 31 ALA HA 4.810 . 5.290 5.267 5.064 5.376 0.086 6 0 "[ . 1 . 2]" 1
679 1 30 MET ME 1 33 VAL H 4.580 . 5.040 4.536 4.041 5.106 0.066 11 0 "[ . 1 . 2]" 1
680 1 30 MET ME 1 33 VAL MG1 3.860 . 4.250 3.648 3.043 4.265 0.015 12 0 "[ . 1 . 2]" 1
681 1 30 MET ME 1 33 VAL MG2 4.550 . 5.010 4.231 3.571 4.976 . 0 0 "[ . 1 . 2]" 1
682 1 30 MET ME 1 44 THR HA 4.900 . 5.390 4.499 3.868 4.977 . 0 0 "[ . 1 . 2]" 1
683 1 30 MET ME 1 44 THR MG 3.180 . 3.500 3.077 2.569 3.519 0.019 15 0 "[ . 1 . 2]" 1
684 1 30 MET ME 1 45 SER HA 4.510 . 4.960 4.293 3.059 5.004 0.044 4 0 "[ . 1 . 2]" 1
685 1 30 MET ME 1 47 ILE H 4.380 . 4.820 3.780 3.092 4.281 . 0 0 "[ . 1 . 2]" 1
686 1 30 MET ME 1 47 ILE HB 3.180 . 3.500 1.994 1.764 2.444 0.036 17 0 "[ . 1 . 2]" 1
687 1 30 MET ME 1 47 ILE MD 3.050 . 3.360 2.701 2.192 3.315 . 0 0 "[ . 1 . 2]" 1
688 1 30 MET ME 1 47 ILE MG 3.420 . 3.760 2.610 2.247 3.031 . 0 0 "[ . 1 . 2]" 1
689 1 30 MET ME 1 48 LYS H 5.500 . 6.050 5.220 4.843 5.557 . 0 0 "[ . 1 . 2]" 1
690 1 30 MET ME 1 48 LYS HA 5.500 . 6.050 4.982 4.431 5.604 . 0 0 "[ . 1 . 2]" 1
691 1 30 MET ME 1 49 VAL HA 5.500 . 6.050 5.106 4.501 6.052 0.002 14 0 "[ . 1 . 2]" 1
692 1 30 MET ME 1 49 VAL MG2 3.600 . 3.960 2.537 1.991 3.494 . 0 0 "[ . 1 . 2]" 1
693 1 30 MET ME 1 65 TYR QD 5.020 . 5.520 3.626 2.828 4.606 . 0 0 "[ . 1 . 2]" 1
694 1 30 MET ME 1 65 TYR QE 4.780 . 5.260 3.938 2.933 5.226 . 0 0 "[ . 1 . 2]" 1
695 1 30 MET QG 1 49 VAL MG2 3.620 . 3.980 2.478 2.068 3.053 . 0 0 "[ . 1 . 2]" 1
696 1 31 ALA H 1 31 ALA MB 2.920 . 3.210 2.358 2.271 2.474 . 0 0 "[ . 1 . 2]" 1
697 1 31 ALA H 1 32 GLU H 4.280 . 4.710 2.233 1.954 2.627 . 0 0 "[ . 1 . 2]" 1
698 1 31 ALA H 1 32 GLU QG 5.210 . 5.730 3.893 3.356 4.286 . 0 0 "[ . 1 . 2]" 1
699 1 31 ALA H 1 33 VAL H 4.800 . 5.280 3.680 3.273 4.095 . 0 0 "[ . 1 . 2]" 1
700 1 31 ALA HA 1 32 GLU HA 4.790 . 5.270 4.665 4.555 4.796 . 0 0 "[ . 1 . 2]" 1
701 1 31 ALA HA 1 32 GLU QB 5.480 . 6.030 5.497 5.383 5.555 . 0 0 "[ . 1 . 2]" 1
702 1 31 ALA HA 1 33 VAL H 4.310 . 4.740 4.078 3.737 4.615 . 0 0 "[ . 1 . 2]" 1
703 1 31 ALA MB 1 32 GLU H 3.250 . 3.580 2.762 2.396 3.187 . 0 0 "[ . 1 . 2]" 1
704 1 31 ALA MB 1 32 GLU HA 4.750 . 5.220 3.937 3.814 4.148 . 0 0 "[ . 1 . 2]" 1
705 1 31 ALA MB 1 32 GLU QB 4.890 . 5.380 4.239 4.003 4.464 . 0 0 "[ . 1 . 2]" 1
706 1 31 ALA MB 1 32 GLU HG2 4.290 . 4.720 3.603 2.861 4.296 . 0 0 "[ . 1 . 2]" 1
707 1 31 ALA MB 1 32 GLU HG3 4.290 . 4.720 3.600 2.742 4.743 0.023 13 0 "[ . 1 . 2]" 1
708 1 31 ALA MB 1 33 VAL H 4.620 . 5.080 4.432 4.175 4.781 . 0 0 "[ . 1 . 2]" 1
709 1 32 GLU H 1 32 GLU QB 3.480 . 3.830 2.458 2.365 2.579 . 0 0 "[ . 1 . 2]" 1
710 1 32 GLU H 1 32 GLU HG2 4.280 . 4.710 3.193 2.236 4.007 . 0 0 "[ . 1 . 2]" 1
711 1 32 GLU H 1 32 GLU QG 3.480 . 3.830 2.466 2.218 2.848 . 0 0 "[ . 1 . 2]" 1
712 1 32 GLU H 1 32 GLU HG3 4.280 . 4.710 3.050 2.336 3.875 . 0 0 "[ . 1 . 2]" 1
713 1 32 GLU H 1 33 VAL H 3.300 . 3.630 2.435 1.950 2.709 . 0 0 "[ . 1 . 2]" 1
714 1 32 GLU H 1 33 VAL HB 4.710 . 5.180 4.589 4.226 5.011 . 0 0 "[ . 1 . 2]" 1
715 1 32 GLU H 1 33 VAL MG2 5.060 . 5.570 3.744 3.060 4.173 . 0 0 "[ . 1 . 2]" 1
716 1 32 GLU HA 1 32 GLU HG2 3.620 . 3.980 2.770 2.436 3.219 . 0 0 "[ . 1 . 2]" 1
717 1 32 GLU HA 1 32 GLU HG3 3.620 . 3.980 3.346 2.906 3.831 . 0 0 "[ . 1 . 2]" 1
718 1 32 GLU HA 1 33 VAL H 3.510 . 3.860 3.348 3.153 3.542 . 0 0 "[ . 1 . 2]" 1
719 1 32 GLU QB 1 33 VAL H 4.000 . 4.400 3.263 2.701 3.589 . 0 0 "[ . 1 . 2]" 1
720 1 32 GLU QG 1 33 VAL H 4.820 . 5.300 4.335 4.059 4.513 . 0 0 "[ . 1 . 2]" 1
721 1 32 GLU HG2 1 33 VAL H 5.500 . 6.050 4.952 4.380 5.283 . 0 0 "[ . 1 . 2]" 1
722 1 32 GLU HG3 1 33 VAL H 5.500 . 6.050 4.964 4.279 5.670 . 0 0 "[ . 1 . 2]" 1
723 1 33 VAL H 1 33 VAL HB 3.120 . 3.430 2.614 2.487 2.697 . 0 0 "[ . 1 . 2]" 1
724 1 33 VAL H 1 33 VAL MG1 4.000 . 4.400 3.853 3.793 3.901 . 0 0 "[ . 1 . 2]" 1
725 1 33 VAL H 1 33 VAL MG2 3.210 . 3.530 2.671 2.323 2.849 . 0 0 "[ . 1 . 2]" 1
726 1 33 VAL H 1 34 LEU H 4.500 . 4.950 4.462 4.336 4.602 . 0 0 "[ . 1 . 2]" 1
727 1 33 VAL H 1 47 ILE MD 5.410 . 5.950 5.011 4.677 5.304 . 0 0 "[ . 1 . 2]" 1
728 1 33 VAL HA 1 34 LEU H 3.020 . 3.320 2.229 2.142 2.356 . 0 0 "[ . 1 . 2]" 1
729 1 33 VAL HA 1 47 ILE MD 4.710 . 5.180 4.521 4.322 4.809 . 0 0 "[ . 1 . 2]" 1
730 1 33 VAL HB 1 34 LEU H 4.250 . 4.680 4.057 3.745 4.265 . 0 0 "[ . 1 . 2]" 1
731 1 33 VAL HB 1 65 TYR QD 4.160 . 4.580 4.114 3.799 4.594 0.014 11 0 "[ . 1 . 2]" 1
732 1 33 VAL MG1 1 34 LEU H 3.500 . 3.850 2.435 2.023 2.746 . 0 0 "[ . 1 . 2]" 1
733 1 33 VAL MG1 1 34 LEU HB2 5.500 . 6.050 4.698 4.463 4.841 . 0 0 "[ . 1 . 2]" 1
734 1 33 VAL MG1 1 44 THR MG 4.630 . 5.090 3.832 3.542 4.004 . 0 0 "[ . 1 . 2]" 1
735 1 33 VAL MG1 1 47 ILE MG 3.550 . 3.900 2.496 2.199 2.915 . 0 0 "[ . 1 . 2]" 1
736 1 33 VAL MG1 1 65 TYR QD 4.050 . 4.460 3.084 2.797 3.435 . 0 0 "[ . 1 . 2]" 1
737 1 33 VAL MG1 1 77 ALA MB 4.690 . 5.160 4.459 4.171 4.774 . 0 0 "[ . 1 . 2]" 1
738 1 33 VAL MG2 1 34 LEU H 4.150 . 4.570 3.937 3.843 4.035 . 0 0 "[ . 1 . 2]" 1
739 1 33 VAL MG2 1 65 TYR QE 3.440 . 3.780 2.786 2.668 2.852 . 0 0 "[ . 1 . 2]" 1
740 1 33 VAL MG2 1 65 TYR HH 4.210 . 4.630 3.399 2.402 3.951 . 0 0 "[ . 1 . 2]" 1
741 1 33 VAL MG2 1 79 GLN HE21 4.440 . 4.880 3.796 3.027 4.377 . 0 0 "[ . 1 . 2]" 1
742 1 33 VAL MG2 1 79 GLN HE22 4.670 . 5.140 3.436 2.567 4.191 . 0 0 "[ . 1 . 2]" 1
743 1 34 LEU H 1 34 LEU HB2 4.100 . 4.510 2.949 2.566 3.338 . 0 0 "[ . 1 . 2]" 1
744 1 34 LEU H 1 34 LEU HB3 3.700 . 4.070 3.268 2.765 3.808 . 0 0 "[ . 1 . 2]" 1
745 1 34 LEU H 1 34 LEU MD1 4.420 . 4.860 4.049 2.455 4.816 . 0 0 "[ . 1 . 2]" 1
746 1 34 LEU H 1 34 LEU QD 3.830 . 4.210 3.288 2.415 4.022 . 0 0 "[ . 1 . 2]" 1
747 1 34 LEU H 1 34 LEU MD2 4.420 . 4.860 3.834 2.448 4.616 . 0 0 "[ . 1 . 2]" 1
748 1 34 LEU H 1 34 LEU HG 5.000 . 5.500 4.530 3.972 4.786 . 0 0 "[ . 1 . 2]" 1
749 1 34 LEU H 1 44 THR MG 5.500 . 6.050 4.448 4.161 4.751 . 0 0 "[ . 1 . 2]" 1
750 1 34 LEU H 1 47 ILE MD 4.440 . 4.880 3.684 3.335 4.106 . 0 0 "[ . 1 . 2]" 1
751 1 34 LEU HA 1 34 LEU MD1 3.540 . 3.890 3.035 1.961 3.810 . 0 0 "[ . 1 . 2]" 1
752 1 34 LEU HA 1 34 LEU MD2 3.540 . 3.890 3.337 2.593 3.930 0.040 13 0 "[ . 1 . 2]" 1
753 1 34 LEU HA 1 35 ALA H 2.920 . 3.210 2.337 2.226 2.443 . 0 0 "[ . 1 . 2]" 1
754 1 34 LEU HA 1 35 ALA HA 4.960 . 5.460 4.514 4.452 4.562 . 0 0 "[ . 1 . 2]" 1
755 1 34 LEU HA 1 35 ALA MB 4.240 . 4.660 3.947 3.897 4.016 . 0 0 "[ . 1 . 2]" 1
756 1 34 LEU HA 1 44 THR HB 5.240 . 5.760 4.484 4.146 4.741 . 0 0 "[ . 1 . 2]" 1
757 1 34 LEU HA 1 44 THR MG 3.620 . 3.980 2.149 1.815 2.573 . 0 0 "[ . 1 . 2]" 1
758 1 34 LEU HA 1 47 ILE MD 4.590 . 5.050 2.918 2.513 3.158 . 0 0 "[ . 1 . 2]" 1
759 1 34 LEU HB2 1 34 LEU MD1 3.450 . 3.790 2.489 2.169 3.217 . 0 0 "[ . 1 . 2]" 1
760 1 34 LEU HB2 1 34 LEU MD2 3.450 . 3.790 2.783 2.279 3.219 . 0 0 "[ . 1 . 2]" 1
761 1 34 LEU HB2 1 35 ALA H 4.010 . 4.410 3.946 3.593 4.411 0.001 20 0 "[ . 1 . 2]" 1
762 1 34 LEU HB3 1 35 ALA H 4.000 . 4.400 3.288 2.381 4.023 . 0 0 "[ . 1 . 2]" 1
763 1 34 LEU HB3 1 35 ALA HA 4.810 . 5.290 4.440 4.105 4.741 . 0 0 "[ . 1 . 2]" 1
764 1 34 LEU QD 1 35 ALA H 3.530 . 3.880 2.919 1.912 3.934 0.054 5 0 "[ . 1 . 2]" 1
765 1 34 LEU QD 1 35 ALA HA 5.060 . 5.570 3.962 2.648 5.238 . 0 0 "[ . 1 . 2]" 1
766 1 34 LEU QD 1 44 THR MG 3.660 . 4.030 3.127 2.047 4.080 0.050 3 0 "[ . 1 . 2]" 1
767 1 34 LEU MD1 1 35 ALA H 4.250 . 4.680 3.960 2.298 4.733 0.053 8 0 "[ . 1 . 2]" 1
768 1 34 LEU MD2 1 35 ALA H 4.250 . 4.680 3.434 1.914 4.742 0.062 12 0 "[ . 1 . 2]" 1
769 1 34 LEU HG 1 35 ALA H 4.320 . 4.750 3.402 2.203 4.742 . 0 0 "[ . 1 . 2]" 1
770 1 35 ALA H 1 36 ILE H 4.220 . 4.640 4.209 4.118 4.339 . 0 0 "[ . 1 . 2]" 1
771 1 35 ALA H 1 36 ILE HG12 4.150 . 4.570 3.761 3.486 4.265 . 0 0 "[ . 1 . 2]" 1
772 1 35 ALA H 1 43 LEU H 4.840 . 5.320 4.364 4.132 4.673 . 0 0 "[ . 1 . 2]" 1
773 1 35 ALA H 1 44 THR H 4.640 . 5.100 3.659 3.285 3.857 . 0 0 "[ . 1 . 2]" 1
774 1 35 ALA H 1 44 THR HA 4.070 . 4.480 2.854 2.675 3.140 . 0 0 "[ . 1 . 2]" 1
775 1 35 ALA H 1 44 THR HB 4.550 . 5.010 4.018 3.778 4.326 . 0 0 "[ . 1 . 2]" 1
776 1 35 ALA H 1 44 THR MG 4.220 . 4.640 2.987 2.685 3.299 . 0 0 "[ . 1 . 2]" 1
777 1 35 ALA H 1 47 ILE MD 3.690 . 4.060 2.964 2.540 3.184 . 0 0 "[ . 1 . 2]" 1
778 1 35 ALA HA 1 36 ILE H 2.860 . 3.150 2.166 2.138 2.196 . 0 0 "[ . 1 . 2]" 1
779 1 35 ALA HA 1 36 ILE HB 5.210 . 5.730 4.597 4.527 4.693 . 0 0 "[ . 1 . 2]" 1
780 1 35 ALA HA 1 36 ILE HG12 4.770 . 5.250 3.828 3.610 4.048 . 0 0 "[ . 1 . 2]" 1
781 1 35 ALA HA 1 43 LEU QB 5.340 . 5.870 4.570 4.195 4.806 . 0 0 "[ . 1 . 2]" 1
782 1 35 ALA HA 1 47 ILE MD 5.270 . 5.800 3.735 3.543 3.917 . 0 0 "[ . 1 . 2]" 1
783 1 35 ALA MB 1 36 ILE H 3.510 . 3.860 3.140 3.005 3.204 . 0 0 "[ . 1 . 2]" 1
784 1 35 ALA MB 1 43 LEU H 4.110 . 4.520 3.454 3.117 3.744 . 0 0 "[ . 1 . 2]" 1
785 1 35 ALA MB 1 43 LEU HA 4.620 . 5.080 4.328 4.169 4.514 . 0 0 "[ . 1 . 2]" 1
786 1 35 ALA MB 1 43 LEU QB 3.520 . 3.870 2.514 2.211 2.728 . 0 0 "[ . 1 . 2]" 1
787 1 35 ALA MB 1 43 LEU MD1 3.760 . 4.140 3.753 3.339 4.027 . 0 0 "[ . 1 . 2]" 1
788 1 35 ALA MB 1 43 LEU HG 4.920 . 5.410 4.526 3.983 4.815 . 0 0 "[ . 1 . 2]" 1
789 1 35 ALA MB 1 44 THR H 4.310 . 4.740 3.349 2.982 3.740 . 0 0 "[ . 1 . 2]" 1
790 1 35 ALA MB 1 44 THR HA 3.930 . 4.320 2.327 2.041 2.580 . 0 0 "[ . 1 . 2]" 1
791 1 35 ALA MB 1 46 LYS H 4.560 . 5.020 4.402 4.200 4.630 . 0 0 "[ . 1 . 2]" 1
792 1 35 ALA MB 1 47 ILE H 4.200 . 4.620 4.456 4.166 4.630 0.010 19 0 "[ . 1 . 2]" 1
793 1 35 ALA MB 1 47 ILE HA 4.770 . 5.250 4.550 4.307 4.825 . 0 0 "[ . 1 . 2]" 1
794 1 35 ALA MB 1 47 ILE MD 2.920 . 3.210 1.959 1.790 2.131 0.010 13 0 "[ . 1 . 2]" 1
795 1 35 ALA MB 1 47 ILE HG12 4.380 . 4.820 2.596 2.397 2.814 . 0 0 "[ . 1 . 2]" 1
796 1 35 ALA MB 1 47 ILE HG13 3.870 . 4.260 2.763 2.679 2.880 . 0 0 "[ . 1 . 2]" 1
797 1 35 ALA MB 1 67 VAL MG1 3.320 . 3.650 2.340 2.121 2.655 . 0 0 "[ . 1 . 2]" 1
798 1 36 ILE H 1 36 ILE HB 3.390 . 3.730 2.719 2.638 2.783 . 0 0 "[ . 1 . 2]" 1
799 1 36 ILE H 1 36 ILE MD 4.610 . 5.070 3.823 3.604 3.895 . 0 0 "[ . 1 . 2]" 1
800 1 36 ILE H 1 36 ILE HG12 4.050 . 4.460 3.008 2.789 3.115 . 0 0 "[ . 1 . 2]" 1
801 1 36 ILE H 1 36 ILE HG13 4.420 . 4.860 4.300 4.182 4.390 . 0 0 "[ . 1 . 2]" 1
802 1 36 ILE H 1 36 ILE MG 4.060 . 4.470 3.891 3.851 3.930 . 0 0 "[ . 1 . 2]" 1
803 1 36 ILE H 1 37 ASP H 4.590 . 5.050 4.325 4.186 4.435 . 0 0 "[ . 1 . 2]" 1
804 1 36 ILE HA 1 36 ILE MD 3.870 . 4.260 2.060 1.935 2.173 . 0 0 "[ . 1 . 2]" 1
805 1 36 ILE HA 1 37 ASP H 3.150 . 3.470 2.189 2.148 2.244 . 0 0 "[ . 1 . 2]" 1
806 1 36 ILE HA 1 41 GLY H 5.200 . 5.720 5.205 4.802 5.754 0.034 1 0 "[ . 1 . 2]" 1
807 1 36 ILE HA 1 43 LEU H 3.920 . 4.310 2.636 2.353 3.000 . 0 0 "[ . 1 . 2]" 1
808 1 36 ILE HB 1 37 ASP H 4.560 . 5.020 4.202 3.996 4.347 . 0 0 "[ . 1 . 2]" 1
809 1 36 ILE MD 1 37 ASP H 4.440 . 4.880 3.667 3.406 3.842 . 0 0 "[ . 1 . 2]" 1
810 1 36 ILE MD 1 42 ASP H 4.630 . 5.090 3.935 3.639 4.663 . 0 0 "[ . 1 . 2]" 1
811 1 36 ILE MD 1 42 ASP HA 3.860 . 4.250 1.965 1.746 2.585 0.054 19 0 "[ . 1 . 2]" 1
812 1 36 ILE MD 1 42 ASP HB2 4.670 . 5.140 3.031 2.712 3.442 . 0 0 "[ . 1 . 2]" 1
813 1 36 ILE MD 1 42 ASP QB 4.010 . 4.410 2.956 2.667 3.325 . 0 0 "[ . 1 . 2]" 1
814 1 36 ILE MD 1 42 ASP HB3 4.670 . 5.140 4.114 3.886 4.455 . 0 0 "[ . 1 . 2]" 1
815 1 36 ILE MD 1 43 LEU H 3.660 . 4.030 2.829 2.377 3.370 . 0 0 "[ . 1 . 2]" 1
816 1 36 ILE HG12 1 36 ILE MG 3.400 . 3.740 3.215 3.209 3.221 . 0 0 "[ . 1 . 2]" 1
817 1 36 ILE HG12 1 43 LEU H 4.590 . 5.050 4.667 4.286 5.042 . 0 0 "[ . 1 . 2]" 1
818 1 36 ILE HG13 1 36 ILE MG 3.100 . 3.410 2.374 2.335 2.392 . 0 0 "[ . 1 . 2]" 1
819 1 36 ILE MG 1 37 ASP H 3.640 . 4.000 2.675 2.254 2.960 . 0 0 "[ . 1 . 2]" 1
820 1 37 ASP H 1 37 ASP HB3 3.990 . 4.390 2.638 2.476 2.790 . 0 0 "[ . 1 . 2]" 1
821 1 37 ASP H 1 38 LYS H 4.740 . 5.210 4.500 4.398 4.592 . 0 0 "[ . 1 . 2]" 1
822 1 37 ASP H 1 40 ASP H 5.110 . 5.620 5.020 4.427 5.645 0.025 12 0 "[ . 1 . 2]" 1
823 1 37 ASP H 1 41 GLY H 3.960 . 4.360 3.323 2.970 3.733 . 0 0 "[ . 1 . 2]" 1
824 1 37 ASP H 1 43 LEU H 4.500 . 4.950 3.601 3.197 3.909 . 0 0 "[ . 1 . 2]" 1
825 1 37 ASP H 1 43 LEU MD1 5.200 . 5.720 3.622 3.162 4.381 . 0 0 "[ . 1 . 2]" 1
826 1 37 ASP H 1 43 LEU HG 4.080 . 4.490 2.924 2.401 3.931 . 0 0 "[ . 1 . 2]" 1
827 1 37 ASP HA 1 38 LYS H 3.200 . 3.520 2.267 2.170 2.343 . 0 0 "[ . 1 . 2]" 1
828 1 37 ASP HA 1 38 LYS HA 4.770 . 5.250 4.304 4.224 4.358 . 0 0 "[ . 1 . 2]" 1
829 1 37 ASP HA 1 38 LYS HB2 5.500 . 6.050 4.593 4.370 4.806 . 0 0 "[ . 1 . 2]" 1
830 1 37 ASP HA 1 38 LYS HB3 5.500 . 6.050 5.107 4.559 5.773 . 0 0 "[ . 1 . 2]" 1
831 1 37 ASP HA 1 39 GLU H 4.350 . 4.790 4.346 3.937 4.837 0.047 10 0 "[ . 1 . 2]" 1
832 1 37 ASP HA 1 43 LEU MD1 4.590 . 5.050 4.010 3.653 4.335 . 0 0 "[ . 1 . 2]" 1
833 1 37 ASP HB2 1 38 LYS H 4.680 . 5.150 4.081 3.884 4.263 . 0 0 "[ . 1 . 2]" 1
834 1 37 ASP HB2 1 40 ASP H 4.710 . 5.180 4.381 4.124 4.669 . 0 0 "[ . 1 . 2]" 1
835 1 37 ASP HB2 1 40 ASP HB2 4.600 . 5.060 4.842 4.500 5.088 0.028 19 0 "[ . 1 . 2]" 1
836 1 37 ASP HB2 1 40 ASP HB3 4.600 . 5.060 3.839 3.304 4.214 . 0 0 "[ . 1 . 2]" 1
837 1 37 ASP HB2 1 41 GLY H 3.970 . 4.370 4.182 3.724 4.422 0.052 3 0 "[ . 1 . 2]" 1
838 1 37 ASP HB2 1 43 LEU MD1 3.830 . 4.210 2.014 1.795 2.258 0.005 5 0 "[ . 1 . 2]" 1
839 1 37 ASP HB2 1 43 LEU HG 4.830 . 5.310 3.009 2.555 3.442 . 0 0 "[ . 1 . 2]" 1
840 1 37 ASP HB3 1 38 LYS H 5.000 . 5.500 3.900 3.652 4.170 . 0 0 "[ . 1 . 2]" 1
841 1 37 ASP HB3 1 39 GLU H 4.290 . 4.720 3.963 3.228 4.444 . 0 0 "[ . 1 . 2]" 1
842 1 37 ASP HB3 1 40 ASP H 3.720 . 4.090 2.909 2.430 3.373 . 0 0 "[ . 1 . 2]" 1
843 1 37 ASP HB3 1 40 ASP QB 4.390 . 4.830 2.484 2.055 2.793 . 0 0 "[ . 1 . 2]" 1
844 1 37 ASP HB3 1 41 GLY H 3.600 . 3.960 2.503 1.961 2.830 . 0 0 "[ . 1 . 2]" 1
845 1 37 ASP HB3 1 43 LEU MD1 4.220 . 4.640 2.692 2.466 3.036 . 0 0 "[ . 1 . 2]" 1
846 1 37 ASP HB3 1 43 LEU HG 4.920 . 5.410 2.968 2.511 3.449 . 0 0 "[ . 1 . 2]" 1
847 1 38 LYS H 1 38 LYS HB2 3.620 . 3.980 2.531 2.349 2.780 . 0 0 "[ . 1 . 2]" 1
848 1 38 LYS H 1 38 LYS QB 3.040 . 3.340 2.318 2.213 2.578 . 0 0 "[ . 1 . 2]" 1
849 1 38 LYS H 1 38 LYS HB3 3.620 . 3.980 2.896 2.328 3.616 . 0 0 "[ . 1 . 2]" 1
850 1 38 LYS H 1 38 LYS HG2 4.650 . 5.120 4.107 3.118 4.525 . 0 0 "[ . 1 . 2]" 1
851 1 38 LYS H 1 38 LYS HG3 4.650 . 5.120 3.706 1.982 4.559 . 0 0 "[ . 1 . 2]" 1
852 1 38 LYS H 1 39 GLU H 3.660 . 4.030 2.725 2.571 3.002 . 0 0 "[ . 1 . 2]" 1
853 1 38 LYS HA 1 38 LYS HG2 3.880 . 4.270 2.966 2.417 3.371 . 0 0 "[ . 1 . 2]" 1
854 1 38 LYS HA 1 38 LYS QG 3.320 . 3.650 2.458 2.349 2.632 . 0 0 "[ . 1 . 2]" 1
855 1 38 LYS HA 1 38 LYS HG3 3.880 . 4.270 2.758 2.420 3.229 . 0 0 "[ . 1 . 2]" 1
856 1 38 LYS QB 1 38 LYS QD 2.840 . 3.120 2.241 2.123 2.393 . 0 0 "[ . 1 . 2]" 1
857 1 38 LYS QB 1 39 GLU H 3.370 . 3.710 2.656 2.245 2.947 . 0 0 "[ . 1 . 2]" 1
858 1 38 LYS QB 1 40 ASP H 5.340 . 5.870 4.898 4.399 5.157 . 0 0 "[ . 1 . 2]" 1
859 1 38 LYS QE 1 38 LYS QG 3.320 . 3.650 2.390 2.152 2.833 . 0 0 "[ . 1 . 2]" 1
860 1 38 LYS QG 1 39 GLU H 4.020 . 4.420 3.787 3.259 4.344 . 0 0 "[ . 1 . 2]" 1
861 1 39 GLU H 1 39 GLU HB2 3.650 . 4.020 3.157 2.442 3.748 . 0 0 "[ . 1 . 2]" 1
862 1 39 GLU H 1 39 GLU QB 3.070 . 3.380 2.655 2.405 3.014 . 0 0 "[ . 1 . 2]" 1
863 1 39 GLU H 1 39 GLU HB3 3.650 . 4.020 3.227 2.526 3.693 . 0 0 "[ . 1 . 2]" 1
864 1 39 GLU H 1 39 GLU HG2 3.990 . 4.390 3.147 1.936 3.942 . 0 0 "[ . 1 . 2]" 1
865 1 39 GLU H 1 39 GLU QG 3.200 . 3.520 2.450 1.920 3.455 . 0 0 "[ . 1 . 2]" 1
866 1 39 GLU H 1 39 GLU HG3 3.990 . 4.390 2.999 2.126 4.082 . 0 0 "[ . 1 . 2]" 1
867 1 39 GLU H 1 40 ASP H 3.450 . 3.790 2.523 2.352 2.633 . 0 0 "[ . 1 . 2]" 1
868 1 39 GLU HA 1 39 GLU HG2 4.130 . 4.540 3.670 2.844 4.005 . 0 0 "[ . 1 . 2]" 1
869 1 39 GLU HA 1 39 GLU QG 3.390 . 3.730 2.962 2.461 3.439 . 0 0 "[ . 1 . 2]" 1
870 1 39 GLU HA 1 39 GLU HG3 4.130 . 4.540 3.226 2.499 4.230 . 0 0 "[ . 1 . 2]" 1
871 1 39 GLU QB 1 40 ASP H 3.370 . 3.710 2.846 2.238 3.517 . 0 0 "[ . 1 . 2]" 1
872 1 39 GLU HB2 1 40 ASP H 3.990 . 4.390 3.026 2.263 4.083 . 0 0 "[ . 1 . 2]" 1
873 1 39 GLU HB3 1 40 ASP H 3.990 . 4.390 3.796 3.450 4.069 . 0 0 "[ . 1 . 2]" 1
874 1 40 ASP H 1 40 ASP HB2 4.090 . 4.500 2.513 2.324 2.706 . 0 0 "[ . 1 . 2]" 1
875 1 40 ASP H 1 40 ASP QB 3.440 . 3.780 2.288 2.208 2.351 . 0 0 "[ . 1 . 2]" 1
876 1 40 ASP H 1 40 ASP HB3 4.090 . 4.500 2.653 2.525 2.753 . 0 0 "[ . 1 . 2]" 1
877 1 40 ASP H 1 41 GLY H 3.530 . 3.880 2.488 2.262 2.717 . 0 0 "[ . 1 . 2]" 1
878 1 40 ASP H 1 43 LEU MD1 4.220 . 4.640 4.602 4.311 4.715 0.075 5 0 "[ . 1 . 2]" 1
879 1 40 ASP H 1 43 LEU HG 5.500 . 6.050 5.385 4.966 5.753 . 0 0 "[ . 1 . 2]" 1
880 1 40 ASP HA 1 43 LEU MD2 4.550 . 5.010 4.811 4.100 5.048 0.038 5 0 "[ . 1 . 2]" 1
881 1 40 ASP QB 1 41 GLY H 3.800 . 4.180 2.598 2.388 2.903 . 0 0 "[ . 1 . 2]" 1
882 1 40 ASP QB 1 43 LEU MD1 3.820 . 4.200 2.978 2.370 3.408 . 0 0 "[ . 1 . 2]" 1
883 1 40 ASP QB 1 43 LEU MD2 3.130 . 3.440 2.489 2.029 2.823 . 0 0 "[ . 1 . 2]" 1
884 1 40 ASP QB 1 43 LEU HG 4.440 . 4.880 3.400 3.112 3.864 . 0 0 "[ . 1 . 2]" 1
885 1 40 ASP HB2 1 43 LEU MD1 4.480 . 4.930 3.922 3.528 4.343 . 0 0 "[ . 1 . 2]" 1
886 1 40 ASP HB2 1 43 LEU MD2 3.620 . 3.980 3.592 3.105 4.007 0.027 13 0 "[ . 1 . 2]" 1
887 1 40 ASP HB2 1 43 LEU HG 5.150 . 5.670 5.045 4.598 5.543 . 0 0 "[ . 1 . 2]" 1
888 1 40 ASP HB3 1 43 LEU MD1 4.480 . 4.930 3.091 2.408 3.562 . 0 0 "[ . 1 . 2]" 1
889 1 40 ASP HB3 1 43 LEU MD2 3.620 . 3.980 2.545 2.045 2.952 . 0 0 "[ . 1 . 2]" 1
890 1 40 ASP HB3 1 43 LEU HG 5.150 . 5.670 3.457 3.165 3.943 . 0 0 "[ . 1 . 2]" 1
891 1 41 GLY H 1 42 ASP H 4.150 . 4.570 4.431 4.201 4.593 0.023 10 0 "[ . 1 . 2]" 1
892 1 41 GLY H 1 43 LEU MD1 4.160 . 4.580 4.483 4.252 4.617 0.037 7 0 "[ . 1 . 2]" 1
893 1 41 GLY H 1 43 LEU MD2 4.960 . 5.460 4.223 3.502 4.759 . 0 0 "[ . 1 . 2]" 1
894 1 41 GLY H 1 43 LEU HG 4.570 . 5.030 4.150 3.872 4.476 . 0 0 "[ . 1 . 2]" 1
895 1 41 GLY HA2 1 42 ASP HB2 5.500 . 6.050 5.095 4.869 5.342 . 0 0 "[ . 1 . 2]" 1
896 1 41 GLY HA2 1 42 ASP HB3 5.500 . 6.050 5.585 5.385 5.825 . 0 0 "[ . 1 . 2]" 1
897 1 41 GLY HA3 1 42 ASP H 3.250 . 3.580 2.205 2.160 2.333 . 0 0 "[ . 1 . 2]" 1
898 1 41 GLY HA3 1 42 ASP HB2 4.850 . 5.330 4.664 4.399 4.871 . 0 0 "[ . 1 . 2]" 1
899 1 41 GLY HA3 1 42 ASP QB 4.240 . 4.660 4.154 4.070 4.265 . 0 0 "[ . 1 . 2]" 1
900 1 41 GLY HA3 1 42 ASP HB3 4.850 . 5.330 4.672 4.473 4.797 . 0 0 "[ . 1 . 2]" 1
901 1 42 ASP H 1 42 ASP HB2 3.310 . 3.640 2.605 2.453 2.778 . 0 0 "[ . 1 . 2]" 1
902 1 42 ASP H 1 42 ASP HB3 3.310 . 3.640 2.525 2.341 2.626 . 0 0 "[ . 1 . 2]" 1
903 1 42 ASP HA 1 43 LEU H 3.260 . 3.590 2.153 2.127 2.179 . 0 0 "[ . 1 . 2]" 1
904 1 42 ASP QB 1 43 LEU H 4.340 . 4.770 3.858 3.724 3.952 . 0 0 "[ . 1 . 2]" 1
905 1 42 ASP HB2 1 43 LEU H 4.940 . 5.430 4.356 4.175 4.449 . 0 0 "[ . 1 . 2]" 1
906 1 42 ASP HB3 1 43 LEU H 4.940 . 5.430 4.308 4.118 4.424 . 0 0 "[ . 1 . 2]" 1
907 1 43 LEU H 1 43 LEU HB2 4.020 . 4.420 2.582 2.474 2.694 . 0 0 "[ . 1 . 2]" 1
908 1 43 LEU H 1 43 LEU QB 3.450 . 3.790 2.538 2.438 2.638 . 0 0 "[ . 1 . 2]" 1
909 1 43 LEU H 1 43 LEU HB3 4.020 . 4.420 3.735 3.677 3.788 . 0 0 "[ . 1 . 2]" 1
910 1 43 LEU H 1 43 LEU MD1 4.910 . 5.400 4.101 3.993 4.185 . 0 0 "[ . 1 . 2]" 1
911 1 43 LEU H 1 43 LEU MD2 3.770 . 4.150 3.579 3.204 3.818 . 0 0 "[ . 1 . 2]" 1
912 1 43 LEU H 1 43 LEU HG 4.260 . 4.690 2.937 2.677 3.119 . 0 0 "[ . 1 . 2]" 1
913 1 43 LEU H 1 44 THR H 3.600 . 3.960 2.352 2.101 2.530 . 0 0 "[ . 1 . 2]" 1
914 1 43 LEU H 1 44 THR HA 5.040 . 5.540 4.445 4.279 4.744 . 0 0 "[ . 1 . 2]" 1
915 1 43 LEU H 1 44 THR HB 4.850 . 5.330 4.881 4.621 5.090 . 0 0 "[ . 1 . 2]" 1
916 1 43 LEU HA 1 43 LEU MD2 2.880 . 3.170 2.006 1.934 2.134 . 0 0 "[ . 1 . 2]" 1
917 1 43 LEU HA 1 45 SER H 4.100 . 4.510 3.644 3.409 3.883 . 0 0 "[ . 1 . 2]" 1
918 1 43 LEU HA 1 46 LYS H 4.480 . 4.930 3.391 3.173 3.662 . 0 0 "[ . 1 . 2]" 1
919 1 43 LEU HA 1 46 LYS HG2 4.670 . 5.140 3.479 2.196 5.148 0.008 4 0 "[ . 1 . 2]" 1
920 1 43 LEU HA 1 46 LYS QG 3.830 . 4.210 2.702 2.042 3.373 . 0 0 "[ . 1 . 2]" 1
921 1 43 LEU HA 1 46 LYS HG3 4.670 . 5.140 3.085 2.428 3.420 . 0 0 "[ . 1 . 2]" 1
922 1 43 LEU HA 1 47 ILE H 5.500 . 6.050 5.580 5.187 5.900 . 0 0 "[ . 1 . 2]" 1
923 1 43 LEU QB 1 43 LEU MD2 3.080 . 3.390 2.388 2.347 2.442 . 0 0 "[ . 1 . 2]" 1
924 1 43 LEU QB 1 44 THR H 4.310 . 4.740 3.618 3.404 3.750 . 0 0 "[ . 1 . 2]" 1
925 1 43 LEU MD1 1 69 ASP H 5.100 . 5.610 4.079 3.673 4.629 . 0 0 "[ . 1 . 2]" 1
926 1 43 LEU MD1 1 69 ASP HA 3.640 . 4.000 2.224 1.880 2.672 . 0 0 "[ . 1 . 2]" 1
927 1 43 LEU MD1 1 69 ASP HB2 4.580 . 5.040 3.320 2.404 4.553 . 0 0 "[ . 1 . 2]" 1
928 1 43 LEU MD1 1 69 ASP HB3 4.580 . 5.040 4.320 3.066 5.097 0.057 19 0 "[ . 1 . 2]" 1
929 1 43 LEU MD1 1 70 SER H 4.090 . 4.500 3.304 2.600 3.708 . 0 0 "[ . 1 . 2]" 1
930 1 43 LEU MD1 1 71 LYS H 5.500 . 6.050 5.250 4.738 5.604 . 0 0 "[ . 1 . 2]" 1
931 1 43 LEU MD2 1 44 THR H 4.940 . 5.430 4.515 4.347 4.607 . 0 0 "[ . 1 . 2]" 1
932 1 43 LEU MD2 1 45 SER H 5.500 . 6.050 5.080 4.825 5.333 . 0 0 "[ . 1 . 2]" 1
933 1 43 LEU MD2 1 46 LYS H 4.510 . 4.960 4.512 4.194 4.853 . 0 0 "[ . 1 . 2]" 1
934 1 43 LEU MD2 1 46 LYS QD 3.560 . 3.920 3.017 1.743 3.930 0.057 15 0 "[ . 1 . 2]" 1
935 1 43 LEU MD2 1 46 LYS QE 3.950 . 4.350 2.948 1.791 4.380 0.030 14 0 "[ . 1 . 2]" 1
936 1 44 THR H 1 44 THR HB 3.590 . 3.950 2.642 2.574 2.722 . 0 0 "[ . 1 . 2]" 1
937 1 44 THR H 1 44 THR MG 3.780 . 4.160 3.784 3.774 3.794 . 0 0 "[ . 1 . 2]" 1
938 1 44 THR H 1 45 SER H 3.970 . 4.370 2.740 2.685 2.825 . 0 0 "[ . 1 . 2]" 1
939 1 44 THR H 1 47 ILE MD 5.310 . 5.840 4.493 4.278 4.700 . 0 0 "[ . 1 . 2]" 1
940 1 44 THR HA 1 44 THR MG 3.520 . 3.870 2.379 2.346 2.420 . 0 0 "[ . 1 . 2]" 1
941 1 44 THR HA 1 46 LYS H 4.760 . 5.240 3.779 3.581 3.968 . 0 0 "[ . 1 . 2]" 1
942 1 44 THR HA 1 47 ILE H 4.450 . 4.890 3.822 3.521 4.183 . 0 0 "[ . 1 . 2]" 1
943 1 44 THR HA 1 47 ILE HB 4.910 . 5.400 4.113 3.830 4.377 . 0 0 "[ . 1 . 2]" 1
944 1 44 THR HA 1 47 ILE MD 3.570 . 3.930 2.202 2.072 2.345 . 0 0 "[ . 1 . 2]" 1
945 1 44 THR HA 1 47 ILE HG12 5.210 . 5.730 3.614 3.416 3.842 . 0 0 "[ . 1 . 2]" 1
946 1 44 THR HA 1 47 ILE HG13 4.460 . 4.910 2.312 2.166 2.607 . 0 0 "[ . 1 . 2]" 1
947 1 44 THR HB 1 45 SER H 3.610 . 3.970 2.744 2.546 3.002 . 0 0 "[ . 1 . 2]" 1
948 1 44 THR MG 1 45 SER H 3.800 . 4.180 3.655 3.524 3.845 . 0 0 "[ . 1 . 2]" 1
949 1 44 THR MG 1 47 ILE H 4.760 . 5.240 4.462 4.242 4.753 . 0 0 "[ . 1 . 2]" 1
950 1 44 THR MG 1 47 ILE MD 3.560 . 3.920 2.236 2.022 2.583 . 0 0 "[ . 1 . 2]" 1
951 1 45 SER H 1 45 SER HB2 3.770 . 4.150 2.724 2.456 3.622 . 0 0 "[ . 1 . 2]" 1
952 1 45 SER H 1 45 SER QB 3.310 . 3.640 2.432 2.254 2.612 . 0 0 "[ . 1 . 2]" 1
953 1 45 SER H 1 45 SER HB3 3.770 . 4.150 3.095 2.449 3.649 . 0 0 "[ . 1 . 2]" 1
954 1 45 SER H 1 46 LYS H 3.590 . 3.950 2.604 2.414 2.728 . 0 0 "[ . 1 . 2]" 1
955 1 45 SER H 1 46 LYS HB2 4.750 . 5.220 4.846 4.578 5.015 . 0 0 "[ . 1 . 2]" 1
956 1 45 SER H 1 47 ILE H 4.650 . 5.120 4.276 4.133 4.436 . 0 0 "[ . 1 . 2]" 1
957 1 45 SER H 1 47 ILE MD 5.500 . 6.050 4.949 4.823 5.058 . 0 0 "[ . 1 . 2]" 1
958 1 45 SER HA 1 47 ILE H 4.790 . 5.270 3.666 3.412 3.925 . 0 0 "[ . 1 . 2]" 1
959 1 45 SER QB 1 46 LYS H 4.450 . 4.890 3.259 2.972 3.856 . 0 0 "[ . 1 . 2]" 1
960 1 46 LYS H 1 46 LYS HB2 3.180 . 3.500 2.513 2.418 2.653 . 0 0 "[ . 1 . 2]" 1
961 1 46 LYS H 1 46 LYS HB3 3.750 . 4.130 3.660 3.612 3.748 . 0 0 "[ . 1 . 2]" 1
962 1 46 LYS H 1 46 LYS QD 4.420 . 4.860 3.872 3.495 4.557 . 0 0 "[ . 1 . 2]" 1
963 1 46 LYS H 1 46 LYS QE 4.990 . 5.490 4.669 3.767 5.515 0.025 7 0 "[ . 1 . 2]" 1
964 1 46 LYS H 1 46 LYS HG2 3.610 . 3.970 2.934 2.318 3.866 . 0 0 "[ . 1 . 2]" 1
965 1 46 LYS H 1 46 LYS HG3 3.610 . 3.970 3.307 2.366 3.992 0.022 17 0 "[ . 1 . 2]" 1
966 1 46 LYS H 1 47 ILE H 3.150 . 3.470 2.454 2.211 2.615 . 0 0 "[ . 1 . 2]" 1
967 1 46 LYS H 1 47 ILE HB 5.000 . 5.500 4.763 4.529 4.915 . 0 0 "[ . 1 . 2]" 1
968 1 46 LYS H 1 47 ILE HG13 3.940 . 4.330 3.425 3.055 3.672 . 0 0 "[ . 1 . 2]" 1
969 1 46 LYS H 1 67 VAL MG2 4.750 . 5.220 3.684 3.458 3.975 . 0 0 "[ . 1 . 2]" 1
970 1 46 LYS HA 1 46 LYS QD 3.470 . 3.820 2.940 2.004 3.974 0.154 20 0 "[ . 1 . 2]" 1
971 1 46 LYS HA 1 46 LYS HG2 3.860 . 4.250 2.852 2.409 3.248 . 0 0 "[ . 1 . 2]" 1
972 1 46 LYS HA 1 46 LYS HG3 3.860 . 4.250 3.547 3.082 3.868 . 0 0 "[ . 1 . 2]" 1
973 1 46 LYS HB2 1 47 ILE H 4.970 . 5.470 3.583 3.163 3.805 . 0 0 "[ . 1 . 2]" 1
974 1 46 LYS HB2 1 67 VAL MG2 3.150 . 3.470 2.165 1.832 2.659 . 0 0 "[ . 1 . 2]" 1
975 1 46 LYS HB3 1 46 LYS QD 3.480 . 3.830 2.403 2.274 2.927 . 0 0 "[ . 1 . 2]" 1
976 1 46 LYS HB3 1 47 ILE H 4.350 . 4.790 4.306 4.073 4.411 . 0 0 "[ . 1 . 2]" 1
977 1 46 LYS QE 1 46 LYS QG 3.250 . 3.580 2.275 2.126 2.387 . 0 0 "[ . 1 . 2]" 1
978 1 46 LYS QG 1 47 ILE H 4.280 . 4.710 4.394 4.255 4.522 . 0 0 "[ . 1 . 2]" 1
979 1 46 LYS HG2 1 47 ILE H 5.130 . 5.640 4.835 4.489 5.259 . 0 0 "[ . 1 . 2]" 1
980 1 46 LYS HG3 1 47 ILE H 5.130 . 5.640 5.234 4.601 5.670 0.030 19 0 "[ . 1 . 2]" 1
981 1 47 ILE H 1 47 ILE HB 3.020 . 3.320 2.530 2.493 2.589 . 0 0 "[ . 1 . 2]" 1
982 1 47 ILE H 1 47 ILE MD 3.830 . 4.210 3.644 3.585 3.712 . 0 0 "[ . 1 . 2]" 1
983 1 47 ILE H 1 47 ILE HG12 3.830 . 4.210 3.476 3.317 3.573 . 0 0 "[ . 1 . 2]" 1
984 1 47 ILE H 1 47 ILE HG13 3.290 . 3.620 2.232 2.099 2.329 . 0 0 "[ . 1 . 2]" 1
985 1 47 ILE H 1 47 ILE MG 4.180 . 4.600 3.794 3.776 3.818 . 0 0 "[ . 1 . 2]" 1
986 1 47 ILE H 1 48 LYS H 4.570 . 5.030 4.484 4.393 4.619 . 0 0 "[ . 1 . 2]" 1
987 1 47 ILE H 1 48 LYS HA 5.500 . 6.050 5.433 5.255 5.562 . 0 0 "[ . 1 . 2]" 1
988 1 47 ILE H 1 67 VAL HA 5.500 . 6.050 4.877 4.456 5.241 . 0 0 "[ . 1 . 2]" 1
989 1 47 ILE H 1 67 VAL MG2 4.140 . 4.550 3.645 3.359 4.032 . 0 0 "[ . 1 . 2]" 1
990 1 47 ILE HA 1 47 ILE HG13 4.060 . 4.470 3.045 2.991 3.124 . 0 0 "[ . 1 . 2]" 1
991 1 47 ILE HA 1 47 ILE MG 3.420 . 3.760 2.414 2.367 2.440 . 0 0 "[ . 1 . 2]" 1
992 1 47 ILE HA 1 48 LYS H 3.090 . 3.400 2.163 2.111 2.226 . 0 0 "[ . 1 . 2]" 1
993 1 47 ILE HA 1 66 THR H 4.900 . 5.390 4.197 3.912 4.511 . 0 0 "[ . 1 . 2]" 1
994 1 47 ILE HA 1 67 VAL HA 4.380 . 4.820 2.756 2.201 3.280 . 0 0 "[ . 1 . 2]" 1
995 1 47 ILE HA 1 67 VAL HB 3.770 . 4.150 2.717 2.413 3.010 . 0 0 "[ . 1 . 2]" 1
996 1 47 ILE HA 1 67 VAL MG1 4.540 . 4.990 4.285 4.063 4.485 . 0 0 "[ . 1 . 2]" 1
997 1 47 ILE HA 1 67 VAL MG2 3.610 . 3.970 3.145 2.833 3.493 . 0 0 "[ . 1 . 2]" 1
998 1 47 ILE HA 1 68 THR H 5.450 . 6.000 4.584 3.856 5.190 . 0 0 "[ . 1 . 2]" 1
999 1 47 ILE HB 1 47 ILE MD 3.290 . 3.620 2.427 2.403 2.459 . 0 0 "[ . 1 . 2]" 1
1000 1 47 ILE HB 1 48 LYS H 5.480 . 6.030 4.252 4.047 4.370 . 0 0 "[ . 1 . 2]" 1
1001 1 47 ILE HB 1 49 VAL MG2 5.240 . 5.760 3.969 3.577 4.451 . 0 0 "[ . 1 . 2]" 1
1002 1 47 ILE MD 1 47 ILE MG 3.150 . 3.470 1.941 1.907 1.968 . 0 0 "[ . 1 . 2]" 1
1003 1 47 ILE MD 1 48 LYS H 5.250 . 5.780 5.197 4.914 5.352 . 0 0 "[ . 1 . 2]" 1
1004 1 47 ILE MD 1 65 TYR QD 5.500 . 6.050 4.218 3.834 4.695 . 0 0 "[ . 1 . 2]" 1
1005 1 47 ILE HG12 1 67 VAL HB 4.360 . 4.800 2.086 1.801 2.499 . 0 0 "[ . 1 . 2]" 1
1006 1 47 ILE HG13 1 48 LYS H 5.500 . 6.050 5.096 4.975 5.201 . 0 0 "[ . 1 . 2]" 1
1007 1 47 ILE HG13 1 67 VAL MG1 4.990 . 5.490 4.468 4.055 4.800 . 0 0 "[ . 1 . 2]" 1
1008 1 47 ILE MG 1 48 LYS H 3.370 . 3.710 2.819 2.411 3.066 . 0 0 "[ . 1 . 2]" 1
1009 1 47 ILE MG 1 49 VAL H 4.860 . 5.350 4.084 3.841 4.490 . 0 0 "[ . 1 . 2]" 1
1010 1 47 ILE MG 1 65 TYR H 5.350 . 5.890 5.110 4.827 5.307 . 0 0 "[ . 1 . 2]" 1
1011 1 47 ILE MG 1 65 TYR HA 4.310 . 4.740 3.152 2.787 3.403 . 0 0 "[ . 1 . 2]" 1
1012 1 47 ILE MG 1 65 TYR HB2 4.200 . 4.620 3.594 3.424 3.777 . 0 0 "[ . 1 . 2]" 1
1013 1 47 ILE MG 1 65 TYR HB3 3.890 . 4.280 2.209 1.996 2.421 . 0 0 "[ . 1 . 2]" 1
1014 1 47 ILE MG 1 65 TYR QD 3.040 . 3.340 2.467 2.085 2.814 . 0 0 "[ . 1 . 2]" 1
1015 1 47 ILE MG 1 65 TYR QE 4.390 . 4.830 4.167 3.811 4.572 . 0 0 "[ . 1 . 2]" 1
1016 1 47 ILE MG 1 67 VAL HB 4.960 . 5.460 3.276 3.007 3.669 . 0 0 "[ . 1 . 2]" 1
1017 1 48 LYS H 1 48 LYS HB2 3.470 . 3.820 2.728 2.346 3.033 . 0 0 "[ . 1 . 2]" 1
1018 1 48 LYS H 1 48 LYS HB3 3.470 . 3.820 2.617 2.314 3.638 . 0 0 "[ . 1 . 2]" 1
1019 1 48 LYS H 1 48 LYS QD 4.580 . 5.040 4.495 4.004 4.912 . 0 0 "[ . 1 . 2]" 1
1020 1 48 LYS H 1 48 LYS HG2 4.940 . 5.430 4.459 4.021 4.765 . 0 0 "[ . 1 . 2]" 1
1021 1 48 LYS H 1 48 LYS QG 4.230 . 4.650 3.911 2.812 4.136 . 0 0 "[ . 1 . 2]" 1
1022 1 48 LYS H 1 48 LYS HG3 4.940 . 5.430 4.391 2.871 4.689 . 0 0 "[ . 1 . 2]" 1
1023 1 48 LYS H 1 49 VAL H 4.610 . 5.070 4.485 4.391 4.585 . 0 0 "[ . 1 . 2]" 1
1024 1 48 LYS H 1 49 VAL MG2 5.500 . 6.050 4.709 4.496 4.988 . 0 0 "[ . 1 . 2]" 1
1025 1 48 LYS H 1 65 TYR HA 4.670 . 5.140 4.616 4.066 5.136 . 0 0 "[ . 1 . 2]" 1
1026 1 48 LYS H 1 66 THR H 3.910 . 4.300 3.001 2.467 3.283 . 0 0 "[ . 1 . 2]" 1
1027 1 48 LYS H 1 66 THR HB 4.840 . 5.320 3.746 3.496 4.114 . 0 0 "[ . 1 . 2]" 1
1028 1 48 LYS H 1 66 THR MG 5.050 . 5.560 4.364 4.065 4.613 . 0 0 "[ . 1 . 2]" 1
1029 1 48 LYS H 1 67 VAL MG1 5.500 . 6.050 5.326 5.089 5.535 . 0 0 "[ . 1 . 2]" 1
1030 1 48 LYS H 1 67 VAL MG2 4.450 . 4.890 4.665 4.362 4.868 . 0 0 "[ . 1 . 2]" 1
1031 1 48 LYS H 1 68 THR H 5.500 . 6.050 5.307 4.839 5.713 . 0 0 "[ . 1 . 2]" 1
1032 1 48 LYS HA 1 49 VAL H 2.770 . 3.050 2.185 2.119 2.267 . 0 0 "[ . 1 . 2]" 1
1033 1 48 LYS QB 1 48 LYS QD 3.070 . 3.380 2.327 2.121 2.824 . 0 0 "[ . 1 . 2]" 1
1034 1 48 LYS QB 1 49 VAL H 3.550 . 3.900 3.705 3.224 3.895 . 0 0 "[ . 1 . 2]" 1
1035 1 48 LYS QB 1 66 THR H 4.110 . 4.520 3.219 2.490 3.672 . 0 0 "[ . 1 . 2]" 1
1036 1 48 LYS QB 1 66 THR HB 3.930 . 4.320 2.658 2.084 3.179 . 0 0 "[ . 1 . 2]" 1
1037 1 48 LYS HB2 1 48 LYS QD 3.740 . 4.110 2.645 2.348 3.292 . 0 0 "[ . 1 . 2]" 1
1038 1 48 LYS HB2 1 49 VAL H 4.350 . 4.790 4.261 4.040 4.421 . 0 0 "[ . 1 . 2]" 1
1039 1 48 LYS HB2 1 66 THR HB 4.770 . 5.250 4.031 2.838 4.775 . 0 0 "[ . 1 . 2]" 1
1040 1 48 LYS HB3 1 48 LYS QD 3.740 . 4.110 2.751 2.259 3.531 . 0 0 "[ . 1 . 2]" 1
1041 1 48 LYS HB3 1 49 VAL H 4.350 . 4.790 4.099 3.331 4.376 . 0 0 "[ . 1 . 2]" 1
1042 1 48 LYS HB3 1 66 THR HB 4.770 . 5.250 2.827 2.108 4.411 . 0 0 "[ . 1 . 2]" 1
1043 1 48 LYS QG 1 49 VAL H 3.770 . 4.150 2.950 2.243 3.955 . 0 0 "[ . 1 . 2]" 1
1044 1 48 LYS HG2 1 49 VAL H 4.320 . 4.750 3.602 2.348 4.787 0.037 1 0 "[ . 1 . 2]" 1
1045 1 48 LYS HG3 1 49 VAL H 4.320 . 4.750 3.378 2.705 4.903 0.153 14 0 "[ . 1 . 2]" 1
1046 1 49 VAL H 1 49 VAL HB 2.990 . 3.290 2.584 2.541 2.652 . 0 0 "[ . 1 . 2]" 1
1047 1 49 VAL H 1 49 VAL MG1 3.900 . 4.290 3.841 3.825 3.876 . 0 0 "[ . 1 . 2]" 1
1048 1 49 VAL H 1 49 VAL MG2 3.430 . 3.770 2.426 2.323 2.670 . 0 0 "[ . 1 . 2]" 1
1049 1 49 VAL H 1 50 ASP H 4.570 . 5.030 4.406 4.201 4.560 . 0 0 "[ . 1 . 2]" 1
1050 1 49 VAL H 1 66 THR H 5.500 . 6.050 5.135 5.001 5.345 . 0 0 "[ . 1 . 2]" 1
1051 1 49 VAL HA 1 49 VAL MG1 3.250 . 3.580 2.395 2.377 2.418 . 0 0 "[ . 1 . 2]" 1
1052 1 49 VAL HA 1 49 VAL MG2 3.480 . 3.830 2.428 2.392 2.461 . 0 0 "[ . 1 . 2]" 1
1053 1 49 VAL HA 1 50 ASP H 3.000 . 3.300 2.180 2.148 2.257 . 0 0 "[ . 1 . 2]" 1
1054 1 49 VAL HA 1 50 ASP HB2 5.220 . 5.740 4.607 4.457 4.817 . 0 0 "[ . 1 . 2]" 1
1055 1 49 VAL HA 1 50 ASP QB 4.400 . 4.840 4.130 4.026 4.401 . 0 0 "[ . 1 . 2]" 1
1056 1 49 VAL HA 1 50 ASP HB3 5.220 . 5.740 4.694 4.474 5.741 0.001 8 0 "[ . 1 . 2]" 1
1057 1 49 VAL HA 1 65 TYR HA 4.010 . 4.410 2.854 2.656 3.050 . 0 0 "[ . 1 . 2]" 1
1058 1 49 VAL HA 1 65 TYR QD 4.480 . 4.930 3.098 2.820 3.450 . 0 0 "[ . 1 . 2]" 1
1059 1 49 VAL HA 1 66 THR H 4.700 . 5.170 4.050 3.705 4.342 . 0 0 "[ . 1 . 2]" 1
1060 1 49 VAL HB 1 50 ASP H 4.430 . 4.870 4.199 3.924 4.402 . 0 0 "[ . 1 . 2]" 1
1061 1 49 VAL MG1 1 50 ASP H 3.410 . 3.750 2.782 2.306 3.178 . 0 0 "[ . 1 . 2]" 1
1062 1 49 VAL MG1 1 50 ASP HA 4.240 . 4.660 3.670 3.394 3.987 . 0 0 "[ . 1 . 2]" 1
1063 1 49 VAL MG1 1 51 GLY H 4.690 . 5.160 4.314 3.918 4.857 . 0 0 "[ . 1 . 2]" 1
1064 1 49 VAL MG1 1 63 LEU HB3 4.030 . 4.430 3.163 2.535 3.815 . 0 0 "[ . 1 . 2]" 1
1065 1 49 VAL MG1 1 63 LEU MD1 3.810 . 4.190 3.236 2.469 3.805 . 0 0 "[ . 1 . 2]" 1
1066 1 49 VAL MG1 1 64 THR H 4.680 . 5.150 4.032 3.493 4.497 . 0 0 "[ . 1 . 2]" 1
1067 1 49 VAL MG1 1 65 TYR HA 4.750 . 5.220 4.250 3.807 4.595 . 0 0 "[ . 1 . 2]" 1
1068 1 49 VAL MG1 1 65 TYR QD 4.640 . 5.100 3.244 2.782 3.571 . 0 0 "[ . 1 . 2]" 1
1069 1 49 VAL MG1 1 65 TYR QE 4.490 . 4.940 2.509 2.247 2.784 . 0 0 "[ . 1 . 2]" 1
1070 1 49 VAL MG2 1 50 ASP H 4.230 . 4.650 4.110 3.970 4.244 . 0 0 "[ . 1 . 2]" 1
1071 1 49 VAL MG2 1 65 TYR HA 4.740 . 5.210 3.867 3.545 4.322 . 0 0 "[ . 1 . 2]" 1
1072 1 49 VAL MG2 1 65 TYR QD 3.100 . 3.410 2.048 1.771 2.354 0.029 14 0 "[ . 1 . 2]" 1
1073 1 49 VAL MG2 1 65 TYR QE 3.120 . 3.430 2.408 2.176 2.662 . 0 0 "[ . 1 . 2]" 1
1074 1 50 ASP H 1 50 ASP HB2 3.680 . 4.050 2.987 2.471 3.242 . 0 0 "[ . 1 . 2]" 1
1075 1 50 ASP H 1 50 ASP HB3 3.680 . 4.050 2.683 2.416 3.675 . 0 0 "[ . 1 . 2]" 1
1076 1 50 ASP H 1 51 GLY H 4.400 . 4.840 4.443 4.298 4.553 . 0 0 "[ . 1 . 2]" 1
1077 1 50 ASP H 1 64 THR H 3.810 . 4.190 3.153 2.659 3.485 . 0 0 "[ . 1 . 2]" 1
1078 1 50 ASP H 1 64 THR HB 4.340 . 4.770 3.456 2.943 3.927 . 0 0 "[ . 1 . 2]" 1
1079 1 50 ASP H 1 64 THR MG 5.070 . 5.580 4.153 3.757 4.643 . 0 0 "[ . 1 . 2]" 1
1080 1 50 ASP H 1 65 TYR H 5.500 . 6.050 4.955 4.823 5.142 . 0 0 "[ . 1 . 2]" 1
1081 1 50 ASP H 1 65 TYR HA 4.220 . 4.640 3.614 3.306 3.914 . 0 0 "[ . 1 . 2]" 1
1082 1 50 ASP H 1 65 TYR QD 4.550 . 5.010 4.607 4.216 5.023 0.013 10 0 "[ . 1 . 2]" 1
1083 1 50 ASP H 1 66 THR H 5.140 . 5.650 4.888 4.345 5.486 . 0 0 "[ . 1 . 2]" 1
1084 1 50 ASP HA 1 51 GLY H 2.790 . 3.070 2.221 2.161 2.354 . 0 0 "[ . 1 . 2]" 1
1085 1 50 ASP HA 1 51 GLY HA2 4.880 . 5.370 4.493 4.436 4.583 . 0 0 "[ . 1 . 2]" 1
1086 1 50 ASP QB 1 51 GLY H 3.850 . 4.230 3.629 3.023 3.840 . 0 0 "[ . 1 . 2]" 1
1087 1 50 ASP QB 1 64 THR H 4.090 . 4.500 3.118 2.615 3.710 . 0 0 "[ . 1 . 2]" 1
1088 1 50 ASP HB2 1 51 GLY H 4.490 . 4.940 4.154 3.911 4.433 . 0 0 "[ . 1 . 2]" 1
1089 1 50 ASP HB2 1 64 THR H 4.870 . 5.360 4.654 3.074 5.313 . 0 0 "[ . 1 . 2]" 1
1090 1 50 ASP HB2 1 64 THR HB 3.850 . 4.230 3.365 1.785 3.951 0.015 8 0 "[ . 1 . 2]" 1
1091 1 50 ASP HB2 1 64 THR MG 4.330 . 4.760 4.055 3.242 4.562 . 0 0 "[ . 1 . 2]" 1
1092 1 50 ASP HB3 1 51 GLY H 4.490 . 4.940 4.023 3.107 4.235 . 0 0 "[ . 1 . 2]" 1
1093 1 50 ASP HB3 1 64 THR H 4.870 . 5.360 3.216 2.638 4.062 . 0 0 "[ . 1 . 2]" 1
1094 1 50 ASP HB3 1 64 THR HB 3.850 . 4.230 1.944 1.746 3.013 0.054 6 0 "[ . 1 . 2]" 1
1095 1 50 ASP HB3 1 64 THR MG 4.330 . 4.760 3.320 2.990 4.282 . 0 0 "[ . 1 . 2]" 1
1096 1 51 GLY H 1 52 GLU H 4.570 . 5.030 4.462 4.265 4.537 . 0 0 "[ . 1 . 2]" 1
1097 1 51 GLY H 1 52 GLU QB 4.820 . 5.300 4.688 4.302 5.234 . 0 0 "[ . 1 . 2]" 1
1098 1 51 GLY H 1 63 LEU MD2 4.700 . 5.170 4.400 3.960 4.741 . 0 0 "[ . 1 . 2]" 1
1099 1 51 GLY HA2 1 52 GLU H 2.890 . 3.180 2.553 2.329 2.889 . 0 0 "[ . 1 . 2]" 1
1100 1 51 GLY HA2 1 63 LEU HA 5.220 . 5.740 4.510 3.805 4.754 . 0 0 "[ . 1 . 2]" 1
1101 1 51 GLY HA2 1 63 LEU MD2 4.300 . 4.730 3.675 3.397 3.822 . 0 0 "[ . 1 . 2]" 1
1102 1 51 GLY HA3 1 52 GLU H 3.040 . 3.340 2.611 2.292 2.901 . 0 0 "[ . 1 . 2]" 1
1103 1 51 GLY HA3 1 63 LEU MD1 4.690 . 5.160 4.976 4.559 5.187 0.027 11 0 "[ . 1 . 2]" 1
1104 1 51 GLY HA3 1 64 THR H 4.250 . 4.680 3.640 3.347 3.904 . 0 0 "[ . 1 . 2]" 1
1105 1 52 GLU H 1 52 GLU QB 3.290 . 3.620 2.847 2.613 3.323 . 0 0 "[ . 1 . 2]" 1
1106 1 52 GLU H 1 52 GLU HG2 4.970 . 5.470 4.411 2.414 5.216 . 0 0 "[ . 1 . 2]" 1
1107 1 52 GLU H 1 52 GLU QG 4.310 . 4.740 3.940 2.355 4.354 . 0 0 "[ . 1 . 2]" 1
1108 1 52 GLU H 1 52 GLU HG3 4.970 . 5.470 4.545 3.278 4.890 . 0 0 "[ . 1 . 2]" 1
1109 1 52 GLU H 1 53 VAL H 4.270 . 4.700 4.282 4.113 4.411 . 0 0 "[ . 1 . 2]" 1
1110 1 52 GLU H 1 53 VAL MG2 4.970 . 5.470 4.104 3.715 4.575 . 0 0 "[ . 1 . 2]" 1
1111 1 52 GLU H 1 63 LEU HA 4.340 . 4.770 4.602 3.949 4.844 0.074 15 0 "[ . 1 . 2]" 1
1112 1 52 GLU H 1 63 LEU MD1 4.990 . 5.490 5.127 4.509 5.484 . 0 0 "[ . 1 . 2]" 1
1113 1 52 GLU H 1 63 LEU MD2 3.700 . 4.070 2.750 2.055 3.011 . 0 0 "[ . 1 . 2]" 1
1114 1 52 GLU HA 1 52 GLU QG 3.460 . 3.810 2.745 2.352 3.354 . 0 0 "[ . 1 . 2]" 1
1115 1 52 GLU HA 1 53 VAL H 2.710 . 2.980 2.225 2.168 2.319 . 0 0 "[ . 1 . 2]" 1
1116 1 52 GLU HA 1 53 VAL MG2 4.130 . 4.540 3.527 3.336 3.719 . 0 0 "[ . 1 . 2]" 1
1117 1 52 GLU HA 1 63 LEU MD1 4.880 . 5.370 4.368 3.558 5.296 . 0 0 "[ . 1 . 2]" 1
1118 1 52 GLU HA 1 63 LEU MD2 3.590 . 3.950 2.826 2.334 3.444 . 0 0 "[ . 1 . 2]" 1
1119 1 52 GLU QB 1 53 VAL H 3.610 . 3.970 3.472 2.651 3.768 . 0 0 "[ . 1 . 2]" 1
1120 1 52 GLU QB 1 54 ASP H 5.500 . 6.050 5.329 4.454 5.726 . 0 0 "[ . 1 . 2]" 1
1121 1 52 GLU QG 1 53 VAL H 3.880 . 4.270 2.867 2.265 4.220 . 0 0 "[ . 1 . 2]" 1
1122 1 53 VAL H 1 53 VAL HB 3.250 . 3.580 2.634 2.533 2.741 . 0 0 "[ . 1 . 2]" 1
1123 1 53 VAL H 1 53 VAL MG1 3.980 . 4.380 3.864 3.818 3.907 . 0 0 "[ . 1 . 2]" 1
1124 1 53 VAL H 1 53 VAL MG2 3.400 . 3.740 2.675 2.392 2.863 . 0 0 "[ . 1 . 2]" 1
1125 1 53 VAL H 1 54 ASP H 4.490 . 4.940 4.337 4.114 4.527 . 0 0 "[ . 1 . 2]" 1
1126 1 53 VAL H 1 61 TYR QD 5.500 . 6.050 5.477 5.187 5.743 . 0 0 "[ . 1 . 2]" 1
1127 1 53 VAL H 1 63 LEU MD1 4.710 . 5.180 4.186 3.554 5.144 . 0 0 "[ . 1 . 2]" 1
1128 1 53 VAL H 1 63 LEU MD2 3.620 . 3.980 3.320 2.834 3.926 . 0 0 "[ . 1 . 2]" 1
1129 1 53 VAL HA 1 54 ASP H 3.010 . 3.310 2.184 2.154 2.264 . 0 0 "[ . 1 . 2]" 1
1130 1 53 VAL HA 1 54 ASP QB 4.660 . 5.130 4.335 4.077 4.569 . 0 0 "[ . 1 . 2]" 1
1131 1 53 VAL HA 1 61 TYR QB 4.400 . 4.840 2.758 2.296 3.345 . 0 0 "[ . 1 . 2]" 1
1132 1 53 VAL HA 1 61 TYR QD 4.910 . 5.400 3.123 2.793 3.276 . 0 0 "[ . 1 . 2]" 1
1133 1 53 VAL HA 1 61 TYR QE 4.240 . 4.660 4.078 3.495 4.495 . 0 0 "[ . 1 . 2]" 1
1134 1 53 VAL HA 1 63 LEU MD2 4.850 . 5.330 4.058 3.684 4.420 . 0 0 "[ . 1 . 2]" 1
1135 1 53 VAL HA 1 83 VAL MG2 5.490 . 6.040 4.389 3.941 4.739 . 0 0 "[ . 1 . 2]" 1
1136 1 53 VAL HB 1 54 ASP H 4.330 . 4.760 4.254 3.916 4.404 . 0 0 "[ . 1 . 2]" 1
1137 1 53 VAL HB 1 63 LEU MD2 4.430 . 4.870 4.003 3.686 4.367 . 0 0 "[ . 1 . 2]" 1
1138 1 53 VAL MG1 1 54 ASP H 3.750 . 4.130 2.814 2.295 3.120 . 0 0 "[ . 1 . 2]" 1
1139 1 53 VAL MG1 1 54 ASP HA 4.500 . 4.950 3.892 3.591 4.139 . 0 0 "[ . 1 . 2]" 1
1140 1 53 VAL MG1 1 55 THR H 4.800 . 5.280 4.442 4.288 4.746 . 0 0 "[ . 1 . 2]" 1
1141 1 53 VAL MG1 1 55 THR HA 4.280 . 4.710 3.954 3.721 4.254 . 0 0 "[ . 1 . 2]" 1
1142 1 53 VAL MG1 1 55 THR MG 3.620 . 3.980 3.151 2.718 3.890 . 0 0 "[ . 1 . 2]" 1
1143 1 53 VAL MG1 1 61 TYR QB 4.320 . 4.750 2.897 2.366 4.325 . 0 0 "[ . 1 . 2]" 1
1144 1 53 VAL MG1 1 61 TYR QD 4.160 . 4.580 2.278 1.785 3.632 0.015 15 0 "[ . 1 . 2]" 1
1145 1 53 VAL MG1 1 61 TYR QE 4.880 . 5.370 3.418 2.933 4.344 . 0 0 "[ . 1 . 2]" 1
1146 1 53 VAL MG1 1 63 LEU MD2 4.370 . 4.810 4.401 4.248 4.469 . 0 0 "[ . 1 . 2]" 1
1147 1 53 VAL MG1 1 81 VAL MG1 3.530 . 3.880 2.189 1.900 2.685 . 0 0 "[ . 1 . 2]" 1
1148 1 53 VAL MG1 1 81 VAL MG2 3.960 . 4.360 3.546 3.120 3.923 . 0 0 "[ . 1 . 2]" 1
1149 1 53 VAL MG1 1 83 VAL MG2 3.230 . 3.550 2.350 2.079 2.825 . 0 0 "[ . 1 . 2]" 1
1150 1 53 VAL MG2 1 54 ASP H 4.110 . 4.520 4.100 3.988 4.207 . 0 0 "[ . 1 . 2]" 1
1151 1 53 VAL MG2 1 55 THR MG 5.210 . 5.730 5.112 4.836 5.468 . 0 0 "[ . 1 . 2]" 1
1152 1 53 VAL MG2 1 61 TYR H 4.790 . 5.270 4.174 3.814 5.270 . 0 0 "[ . 1 . 2]" 1
1153 1 53 VAL MG2 1 61 TYR HB2 4.360 . 4.800 1.995 1.796 3.494 0.004 15 0 "[ . 1 . 2]" 1
1154 1 53 VAL MG2 1 61 TYR QB 3.690 . 4.060 1.953 1.774 3.378 0.026 2 0 "[ . 1 . 2]" 1
1155 1 53 VAL MG2 1 61 TYR HB3 4.360 . 4.800 2.858 2.487 4.484 . 0 0 "[ . 1 . 2]" 1
1156 1 53 VAL MG2 1 61 TYR QD 4.330 . 4.760 3.271 2.864 3.928 . 0 0 "[ . 1 . 2]" 1
1157 1 53 VAL MG2 1 63 LEU MD1 3.080 . 3.390 2.018 1.824 2.193 . 0 0 "[ . 1 . 2]" 1
1158 1 53 VAL MG2 1 63 LEU MD2 3.060 . 3.370 1.885 1.785 2.103 0.015 15 0 "[ . 1 . 2]" 1
1159 1 53 VAL MG2 1 63 LEU HG 4.020 . 4.420 2.692 2.179 3.370 . 0 0 "[ . 1 . 2]" 1
1160 1 53 VAL MG2 1 81 VAL HB 3.830 . 4.210 2.533 2.255 3.131 . 0 0 "[ . 1 . 2]" 1
1161 1 53 VAL MG2 1 81 VAL MG1 3.440 . 3.780 2.614 2.107 3.093 . 0 0 "[ . 1 . 2]" 1
1162 1 54 ASP H 1 54 ASP HB2 3.820 . 4.200 2.659 2.285 3.702 . 0 0 "[ . 1 . 2]" 1
1163 1 54 ASP H 1 54 ASP QB 3.270 . 3.600 2.425 2.260 2.849 . 0 0 "[ . 1 . 2]" 1
1164 1 54 ASP H 1 54 ASP HB3 3.820 . 4.200 3.206 2.414 3.655 . 0 0 "[ . 1 . 2]" 1
1165 1 54 ASP H 1 55 THR H 4.690 . 5.160 4.567 4.513 4.607 . 0 0 "[ . 1 . 2]" 1
1166 1 54 ASP H 1 55 THR MG 5.500 . 6.050 4.929 4.550 5.195 . 0 0 "[ . 1 . 2]" 1
1167 1 54 ASP H 1 61 TYR QB 4.760 . 5.240 4.110 3.527 4.593 . 0 0 "[ . 1 . 2]" 1
1168 1 54 ASP H 1 61 TYR QD 4.900 . 5.390 3.425 2.700 3.757 . 0 0 "[ . 1 . 2]" 1
1169 1 54 ASP H 1 61 TYR QE 4.280 . 4.710 3.124 2.397 3.549 . 0 0 "[ . 1 . 2]" 1
1170 1 54 ASP H 1 83 VAL MG2 4.460 . 4.910 3.828 3.285 4.289 . 0 0 "[ . 1 . 2]" 1
1171 1 54 ASP HA 1 55 THR H 2.890 . 3.180 2.220 2.166 2.292 . 0 0 "[ . 1 . 2]" 1
1172 1 54 ASP HA 1 55 THR HA 5.180 . 5.700 4.417 4.381 4.459 . 0 0 "[ . 1 . 2]" 1
1173 1 54 ASP HA 1 55 THR MG 4.590 . 5.050 3.640 3.439 3.867 . 0 0 "[ . 1 . 2]" 1
1174 1 54 ASP HA 1 56 THR H 4.060 . 4.470 3.755 3.403 4.089 . 0 0 "[ . 1 . 2]" 1
1175 1 54 ASP QB 1 55 THR H 4.000 . 4.400 3.206 2.643 3.670 . 0 0 "[ . 1 . 2]" 1
1176 1 54 ASP QB 1 57 LYS H 4.150 . 4.570 2.964 2.254 3.693 . 0 0 "[ . 1 . 2]" 1
1177 1 54 ASP QB 1 57 LYS QB 3.950 . 4.350 2.887 1.783 4.254 0.017 12 0 "[ . 1 . 2]" 1
1178 1 54 ASP QB 1 61 TYR QE 4.130 . 4.540 3.098 2.286 4.648 0.108 15 0 "[ . 1 . 2]" 1
1179 1 54 ASP HB2 1 55 THR H 4.620 . 5.080 4.038 2.719 4.335 . 0 0 "[ . 1 . 2]" 1
1180 1 54 ASP HB2 1 57 LYS H 4.840 . 5.320 3.871 2.874 4.941 . 0 0 "[ . 1 . 2]" 1
1181 1 54 ASP HB2 1 57 LYS HB2 5.500 . 6.050 4.725 3.065 5.804 . 0 0 "[ . 1 . 2]" 1
1182 1 54 ASP HB2 1 57 LYS HB3 5.500 . 6.050 3.760 1.831 6.125 0.075 1 0 "[ . 1 . 2]" 1
1183 1 54 ASP HB2 1 61 TYR QE 4.880 . 5.370 3.453 2.300 5.277 . 0 0 "[ . 1 . 2]" 1
1184 1 54 ASP HB3 1 55 THR H 4.620 . 5.080 3.462 2.683 4.100 . 0 0 "[ . 1 . 2]" 1
1185 1 54 ASP HB3 1 57 LYS H 4.840 . 5.320 3.150 2.280 5.090 . 0 0 "[ . 1 . 2]" 1
1186 1 54 ASP HB3 1 57 LYS HB2 5.500 . 6.050 4.126 3.047 6.104 0.054 15 0 "[ . 1 . 2]" 1
1187 1 54 ASP HB3 1 57 LYS HB3 5.500 . 6.050 3.423 2.247 5.556 . 0 0 "[ . 1 . 2]" 1
1188 1 54 ASP HB3 1 61 TYR QE 4.880 . 5.370 4.109 3.029 5.162 . 0 0 "[ . 1 . 2]" 1
1189 1 55 THR H 1 55 THR MG 3.250 . 3.580 2.656 2.509 2.882 . 0 0 "[ . 1 . 2]" 1
1190 1 55 THR H 1 56 THR H 3.370 . 3.710 2.280 1.910 2.706 . 0 0 "[ . 1 . 2]" 1
1191 1 55 THR H 1 56 THR HA 5.480 . 6.030 4.850 4.695 4.963 . 0 0 "[ . 1 . 2]" 1
1192 1 55 THR H 1 56 THR MG 3.890 . 4.280 3.493 3.208 3.932 . 0 0 "[ . 1 . 2]" 1
1193 1 55 THR H 1 57 LYS H 4.310 . 4.740 4.015 3.483 4.596 . 0 0 "[ . 1 . 2]" 1
1194 1 55 THR H 1 83 VAL MG2 5.430 . 5.970 4.983 4.652 5.309 . 0 0 "[ . 1 . 2]" 1
1195 1 55 THR HA 1 55 THR MG 3.390 . 3.730 2.364 2.326 2.423 . 0 0 "[ . 1 . 2]" 1
1196 1 55 THR HA 1 57 LYS H 4.250 . 4.680 3.980 3.655 4.346 . 0 0 "[ . 1 . 2]" 1
1197 1 55 THR HA 1 83 VAL MG1 3.470 . 3.820 2.843 2.234 3.301 . 0 0 "[ . 1 . 2]" 1
1198 1 55 THR HA 1 83 VAL MG2 4.090 . 4.500 3.338 2.796 3.827 . 0 0 "[ . 1 . 2]" 1
1199 1 55 THR HB 1 56 THR H 4.490 . 4.940 4.249 3.865 4.472 . 0 0 "[ . 1 . 2]" 1
1200 1 55 THR MG 1 83 VAL MG1 5.000 . 5.500 4.017 3.319 4.602 . 0 0 "[ . 1 . 2]" 1
1201 1 55 THR MG 1 83 VAL MG2 4.600 . 5.060 3.775 2.906 4.394 . 0 0 "[ . 1 . 2]" 1
1202 1 56 THR H 1 56 THR MG 3.350 . 3.690 2.422 1.964 2.793 . 0 0 "[ . 1 . 2]" 1
1203 1 56 THR H 1 57 LYS H 3.260 . 3.590 2.198 1.947 2.582 . 0 0 "[ . 1 . 2]" 1
1204 1 56 THR H 1 57 LYS HB2 5.180 . 5.700 4.543 4.111 4.971 . 0 0 "[ . 1 . 2]" 1
1205 1 56 THR H 1 57 LYS HB3 5.180 . 5.700 4.629 4.089 5.533 . 0 0 "[ . 1 . 2]" 1
1206 1 56 THR HA 1 56 THR MG 3.270 . 3.600 2.671 2.301 3.227 . 0 0 "[ . 1 . 2]" 1
1207 1 56 THR MG 1 57 LYS H 4.140 . 4.550 3.655 2.397 4.315 . 0 0 "[ . 1 . 2]" 1
1208 1 57 LYS H 1 57 LYS HB2 3.640 . 4.000 2.993 2.405 3.255 . 0 0 "[ . 1 . 2]" 1
1209 1 57 LYS H 1 57 LYS HB3 3.640 . 4.000 2.863 2.557 3.526 . 0 0 "[ . 1 . 2]" 1
1210 1 57 LYS H 1 57 LYS HG2 4.930 . 5.420 4.652 4.426 5.053 . 0 0 "[ . 1 . 2]" 1
1211 1 57 LYS H 1 57 LYS QG 4.320 . 4.750 4.136 4.029 4.316 . 0 0 "[ . 1 . 2]" 1
1212 1 57 LYS H 1 57 LYS HG3 4.930 . 5.420 4.671 4.415 5.034 . 0 0 "[ . 1 . 2]" 1
1213 1 57 LYS H 1 58 ALA H 4.640 . 5.100 4.350 4.269 4.461 . 0 0 "[ . 1 . 2]" 1
1214 1 57 LYS H 1 83 VAL MG1 4.350 . 4.790 3.830 3.214 4.484 . 0 0 "[ . 1 . 2]" 1
1215 1 57 LYS HA 1 57 LYS QD 4.660 . 5.130 3.153 1.951 4.278 . 0 0 "[ . 1 . 2]" 1
1216 1 57 LYS HA 1 57 LYS HG2 4.230 . 4.650 3.287 2.426 3.826 . 0 0 "[ . 1 . 2]" 1
1217 1 57 LYS HA 1 57 LYS QG 3.690 . 4.060 2.573 2.351 3.032 . 0 0 "[ . 1 . 2]" 1
1218 1 57 LYS HA 1 57 LYS HG3 4.230 . 4.650 2.794 2.381 3.668 . 0 0 "[ . 1 . 2]" 1
1219 1 57 LYS HA 1 58 ALA H 2.920 . 3.210 2.188 2.147 2.236 . 0 0 "[ . 1 . 2]" 1
1220 1 57 LYS HA 1 58 ALA MB 4.280 . 4.710 4.012 3.979 4.060 . 0 0 "[ . 1 . 2]" 1
1221 1 57 LYS QB 1 57 LYS QG 2.320 . 2.550 2.050 1.997 2.095 . 0 0 "[ . 1 . 2]" 1
1222 1 57 LYS QB 1 58 ALA H 3.810 . 4.190 3.659 3.188 3.862 . 0 0 "[ . 1 . 2]" 1
1223 1 57 LYS HB2 1 58 ALA H 4.410 . 4.850 4.284 4.098 4.416 . 0 0 "[ . 1 . 2]" 1
1224 1 57 LYS HB3 1 58 ALA H 4.410 . 4.850 4.006 3.278 4.309 . 0 0 "[ . 1 . 2]" 1
1225 1 57 LYS QD 1 58 ALA H 5.060 . 5.570 3.787 1.973 5.023 . 0 0 "[ . 1 . 2]" 1
1226 1 57 LYS QG 1 58 ALA H 4.310 . 4.740 2.953 2.445 3.750 . 0 0 "[ . 1 . 2]" 1
1227 1 57 LYS HG2 1 58 ALA H 4.920 . 5.410 3.704 2.635 4.939 . 0 0 "[ . 1 . 2]" 1
1228 1 57 LYS HG3 1 58 ALA H 4.920 . 5.410 3.294 2.792 4.618 . 0 0 "[ . 1 . 2]" 1
1229 1 58 ALA H 1 58 ALA MB 3.000 . 3.300 2.259 2.242 2.298 . 0 0 "[ . 1 . 2]" 1
1230 1 58 ALA H 1 83 VAL MG1 4.420 . 4.860 4.242 3.949 4.622 . 0 0 "[ . 1 . 2]" 1
1231 1 58 ALA H 1 85 VAL MG1 4.870 . 5.360 5.225 4.893 5.411 0.051 12 0 "[ . 1 . 2]" 1
1232 1 58 ALA H 1 85 VAL MG2 3.950 . 4.350 3.392 3.067 3.827 . 0 0 "[ . 1 . 2]" 1
1233 1 58 ALA HA 1 59 GLY H 3.000 . 3.300 2.214 2.156 2.255 . 0 0 "[ . 1 . 2]" 1
1234 1 58 ALA HA 1 61 TYR QE 5.240 . 5.760 4.315 3.432 5.442 . 0 0 "[ . 1 . 2]" 1
1235 1 58 ALA HA 1 83 VAL H 4.880 . 5.370 4.448 4.192 4.794 . 0 0 "[ . 1 . 2]" 1
1236 1 58 ALA HA 1 83 VAL HB 3.700 . 4.070 2.404 2.051 2.925 . 0 0 "[ . 1 . 2]" 1
1237 1 58 ALA HA 1 83 VAL MG1 3.730 . 4.100 2.390 2.060 2.953 . 0 0 "[ . 1 . 2]" 1
1238 1 58 ALA HA 1 83 VAL MG2 4.650 . 5.120 3.967 3.651 4.492 . 0 0 "[ . 1 . 2]" 1
1239 1 58 ALA HA 1 85 VAL MG1 5.500 . 6.050 6.028 5.922 6.108 0.058 8 0 "[ . 1 . 2]" 1
1240 1 58 ALA MB 1 59 GLY H 3.180 . 3.500 2.901 2.718 3.455 . 0 0 "[ . 1 . 2]" 1
1241 1 58 ALA MB 1 60 THR H 5.500 . 6.050 5.930 5.793 6.097 0.047 12 0 "[ . 1 . 2]" 1
1242 1 58 ALA MB 1 83 VAL H 5.200 . 5.720 4.929 4.658 5.263 . 0 0 "[ . 1 . 2]" 1
1243 1 58 ALA MB 1 83 VAL HA 5.500 . 6.050 5.047 4.619 5.707 . 0 0 "[ . 1 . 2]" 1
1244 1 58 ALA MB 1 83 VAL HB 4.430 . 4.870 3.841 3.396 4.475 . 0 0 "[ . 1 . 2]" 1
1245 1 58 ALA MB 1 83 VAL MG1 4.000 . 4.400 3.236 2.650 3.894 . 0 0 "[ . 1 . 2]" 1
1246 1 58 ALA MB 1 84 LYS HA 4.030 . 4.430 2.557 2.136 3.057 . 0 0 "[ . 1 . 2]" 1
1247 1 58 ALA MB 1 85 VAL H 3.450 . 3.790 3.050 2.685 3.729 . 0 0 "[ . 1 . 2]" 1
1248 1 58 ALA MB 1 85 VAL HA 4.330 . 4.760 3.520 2.838 4.109 . 0 0 "[ . 1 . 2]" 1
1249 1 58 ALA MB 1 85 VAL HB 4.280 . 4.710 4.092 3.921 4.365 . 0 0 "[ . 1 . 2]" 1
1250 1 58 ALA MB 1 85 VAL MG2 3.150 . 3.470 1.880 1.747 2.025 0.053 15 0 "[ . 1 . 2]" 1
1251 1 59 GLY H 1 60 THR H 4.110 . 4.520 4.363 4.295 4.429 . 0 0 "[ . 1 . 2]" 1
1252 1 59 GLY H 1 61 TYR QE 4.320 . 4.750 3.623 2.994 4.498 . 0 0 "[ . 1 . 2]" 1
1253 1 59 GLY H 1 83 VAL H 3.770 . 4.150 2.853 2.633 3.131 . 0 0 "[ . 1 . 2]" 1
1254 1 59 GLY H 1 83 VAL HB 3.430 . 3.770 2.111 1.778 2.568 0.022 7 0 "[ . 1 . 2]" 1
1255 1 59 GLY H 1 83 VAL MG1 3.680 . 4.050 3.441 3.180 3.861 . 0 0 "[ . 1 . 2]" 1
1256 1 59 GLY H 1 83 VAL MG2 4.600 . 5.060 3.592 3.187 3.893 . 0 0 "[ . 1 . 2]" 1
1257 1 59 GLY H 1 84 LYS HA 4.630 . 5.090 4.273 3.918 5.062 . 0 0 "[ . 1 . 2]" 1
1258 1 59 GLY H 1 85 VAL MG2 4.950 . 5.440 5.264 4.980 5.511 0.071 15 0 "[ . 1 . 2]" 1
1259 1 59 GLY QA 1 60 THR H 2.700 . 2.970 2.275 2.229 2.304 . 0 0 "[ . 1 . 2]" 1
1260 1 59 GLY QA 1 61 TYR QE 4.110 . 4.520 3.608 3.426 3.915 . 0 0 "[ . 1 . 2]" 1
1261 1 59 GLY QA 1 83 VAL H 5.340 . 5.870 4.002 3.838 4.247 . 0 0 "[ . 1 . 2]" 1
1262 1 59 GLY QA 1 83 VAL MG2 5.000 . 5.500 4.566 4.290 4.899 . 0 0 "[ . 1 . 2]" 1
1263 1 59 GLY HA2 1 60 THR H 3.140 . 3.450 2.455 2.331 2.654 . 0 0 "[ . 1 . 2]" 1
1264 1 59 GLY HA3 1 60 THR H 3.140 . 3.450 2.713 2.513 2.855 . 0 0 "[ . 1 . 2]" 1
1265 1 60 THR H 1 60 THR HB 3.230 . 3.550 2.527 2.443 2.646 . 0 0 "[ . 1 . 2]" 1
1266 1 60 THR H 1 60 THR MG 3.820 . 4.200 3.819 3.777 3.879 . 0 0 "[ . 1 . 2]" 1
1267 1 60 THR H 1 61 TYR H 4.790 . 5.270 4.445 4.300 4.520 . 0 0 "[ . 1 . 2]" 1
1268 1 60 THR H 1 82 THR HA 4.590 . 5.050 4.552 4.253 4.791 . 0 0 "[ . 1 . 2]" 1
1269 1 60 THR H 1 83 VAL H 5.190 . 5.710 4.667 4.359 4.900 . 0 0 "[ . 1 . 2]" 1
1270 1 60 THR HA 1 60 THR MG 3.540 . 3.890 2.443 2.372 2.496 . 0 0 "[ . 1 . 2]" 1
1271 1 60 THR HA 1 61 TYR H 3.090 . 3.400 2.150 2.134 2.170 . 0 0 "[ . 1 . 2]" 1
1272 1 60 THR HB 1 61 TYR H 4.550 . 5.010 4.263 4.185 4.328 . 0 0 "[ . 1 . 2]" 1
1273 1 60 THR HB 1 82 THR HA 4.400 . 4.840 4.696 4.359 4.924 0.084 14 0 "[ . 1 . 2]" 1
1274 1 60 THR MG 1 61 TYR H 3.520 . 3.870 2.761 2.606 2.823 . 0 0 "[ . 1 . 2]" 1
1275 1 60 THR MG 1 81 VAL H 3.910 . 4.300 3.638 3.280 3.994 . 0 0 "[ . 1 . 2]" 1
1276 1 60 THR MG 1 81 VAL HB 4.790 . 5.270 4.816 4.583 5.302 0.032 4 0 "[ . 1 . 2]" 1
1277 1 60 THR MG 1 82 THR H 4.900 . 5.390 4.360 3.867 4.724 . 0 0 "[ . 1 . 2]" 1
1278 1 60 THR MG 1 82 THR HA 3.510 . 3.860 3.231 2.849 3.495 . 0 0 "[ . 1 . 2]" 1
1279 1 61 TYR H 1 61 TYR QB 3.660 . 4.030 2.656 2.570 2.756 . 0 0 "[ . 1 . 2]" 1
1280 1 61 TYR H 1 61 TYR QD 4.300 . 4.730 2.832 2.501 3.375 . 0 0 "[ . 1 . 2]" 1
1281 1 61 TYR H 1 61 TYR QE 5.050 . 5.560 4.675 4.483 5.204 . 0 0 "[ . 1 . 2]" 1
1282 1 61 TYR H 1 62 VAL H 4.710 . 5.180 4.386 4.172 4.505 . 0 0 "[ . 1 . 2]" 1
1283 1 61 TYR H 1 81 VAL H 4.160 . 4.580 3.503 3.274 3.686 . 0 0 "[ . 1 . 2]" 1
1284 1 61 TYR H 1 81 VAL HB 4.470 . 4.920 3.365 3.085 3.796 . 0 0 "[ . 1 . 2]" 1
1285 1 61 TYR H 1 82 THR H 5.330 . 5.860 4.825 4.581 4.928 . 0 0 "[ . 1 . 2]" 1
1286 1 61 TYR H 1 82 THR HA 4.380 . 4.820 3.362 3.065 3.571 . 0 0 "[ . 1 . 2]" 1
1287 1 61 TYR HA 1 62 VAL H 2.900 . 3.190 2.223 2.157 2.338 . 0 0 "[ . 1 . 2]" 1
1288 1 61 TYR QB 1 62 VAL H 3.680 . 4.050 3.102 2.728 3.513 . 0 0 "[ . 1 . 2]" 1
1289 1 61 TYR QB 1 63 LEU MD2 5.180 . 5.700 3.420 2.818 4.045 . 0 0 "[ . 1 . 2]" 1
1290 1 61 TYR QB 1 81 VAL HB 4.090 . 4.500 2.929 2.505 3.339 . 0 0 "[ . 1 . 2]" 1
1291 1 61 TYR QB 1 81 VAL MG1 5.310 . 5.840 3.894 3.496 4.325 . 0 0 "[ . 1 . 2]" 1
1292 1 61 TYR QB 1 81 VAL MG2 4.800 . 5.280 4.016 3.630 4.378 . 0 0 "[ . 1 . 2]" 1
1293 1 61 TYR HB2 1 62 VAL H 4.390 . 4.830 4.062 3.700 4.331 . 0 0 "[ . 1 . 2]" 1
1294 1 61 TYR HB2 1 81 VAL HB 4.760 . 5.240 2.965 2.526 3.395 . 0 0 "[ . 1 . 2]" 1
1295 1 61 TYR HB3 1 62 VAL H 4.390 . 4.830 3.223 2.781 3.729 . 0 0 "[ . 1 . 2]" 1
1296 1 61 TYR HB3 1 81 VAL HB 4.760 . 5.240 4.560 4.119 5.006 . 0 0 "[ . 1 . 2]" 1
1297 1 61 TYR QD 1 62 VAL H 4.830 . 5.310 4.321 3.569 4.689 . 0 0 "[ . 1 . 2]" 1
1298 1 61 TYR QD 1 63 LEU MD2 5.500 . 6.050 5.003 4.368 5.663 . 0 0 "[ . 1 . 2]" 1
1299 1 61 TYR QD 1 83 VAL MG2 4.240 . 4.660 2.490 2.125 3.162 . 0 0 "[ . 1 . 2]" 1
1300 1 61 TYR QE 1 83 VAL H 5.320 . 5.850 3.963 3.291 5.019 . 0 0 "[ . 1 . 2]" 1
1301 1 61 TYR QE 1 83 VAL HB 3.930 . 4.320 2.897 2.281 4.001 . 0 0 "[ . 1 . 2]" 1
1302 1 61 TYR QE 1 83 VAL MG1 4.540 . 4.990 3.799 3.325 4.802 . 0 0 "[ . 1 . 2]" 1
1303 1 61 TYR QE 1 83 VAL MG2 3.410 . 3.750 2.415 1.908 3.497 . 0 0 "[ . 1 . 2]" 1
1304 1 62 VAL H 1 62 VAL HB 3.150 . 3.470 2.595 2.534 2.690 . 0 0 "[ . 1 . 2]" 1
1305 1 62 VAL H 1 62 VAL MG1 4.030 . 4.430 3.846 3.816 3.892 . 0 0 "[ . 1 . 2]" 1
1306 1 62 VAL H 1 62 VAL MG2 3.320 . 3.650 2.451 2.304 2.661 . 0 0 "[ . 1 . 2]" 1
1307 1 62 VAL H 1 63 LEU H 4.690 . 5.160 4.406 4.234 4.531 . 0 0 "[ . 1 . 2]" 1
1308 1 62 VAL HA 1 62 VAL MG1 3.410 . 3.750 2.392 2.367 2.419 . 0 0 "[ . 1 . 2]" 1
1309 1 62 VAL HA 1 63 LEU H 3.100 . 3.410 2.158 2.141 2.200 . 0 0 "[ . 1 . 2]" 1
1310 1 62 VAL HA 1 63 LEU HG 5.190 . 5.710 3.938 3.758 4.088 . 0 0 "[ . 1 . 2]" 1
1311 1 62 VAL HA 1 78 LYS HB3 5.500 . 6.050 5.004 4.596 5.567 . 0 0 "[ . 1 . 2]" 1
1312 1 62 VAL HA 1 79 GLN H 4.570 . 5.030 4.439 4.151 4.858 . 0 0 "[ . 1 . 2]" 1
1313 1 62 VAL HA 1 79 GLN HG2 5.290 . 5.820 5.130 4.856 5.456 . 0 0 "[ . 1 . 2]" 1
1314 1 62 VAL HB 1 63 LEU H 5.130 . 5.640 4.234 3.980 4.354 . 0 0 "[ . 1 . 2]" 1
1315 1 62 VAL MG1 1 63 LEU H 3.400 . 3.740 2.812 2.362 3.096 . 0 0 "[ . 1 . 2]" 1
1316 1 62 VAL MG1 1 78 LYS HA 4.770 . 5.250 4.123 3.696 4.722 . 0 0 "[ . 1 . 2]" 1
1317 1 62 VAL MG1 1 78 LYS HB2 4.180 . 4.600 3.711 3.210 4.480 . 0 0 "[ . 1 . 2]" 1
1318 1 62 VAL MG1 1 78 LYS HB3 3.580 . 3.940 2.528 2.066 3.223 . 0 0 "[ . 1 . 2]" 1
1319 1 62 VAL MG1 1 78 LYS QD 3.200 . 3.520 2.583 2.137 3.588 0.068 10 0 "[ . 1 . 2]" 1
1320 1 62 VAL MG1 1 78 LYS QE 4.150 . 4.570 3.760 1.908 4.509 . 0 0 "[ . 1 . 2]" 1
1321 1 62 VAL MG1 1 79 GLN H 4.320 . 4.750 3.238 2.846 3.701 . 0 0 "[ . 1 . 2]" 1
1322 1 62 VAL MG2 1 79 GLN H 5.500 . 6.050 5.318 5.011 5.750 . 0 0 "[ . 1 . 2]" 1
1323 1 63 LEU H 1 63 LEU HB2 3.890 . 4.280 2.539 2.474 2.685 . 0 0 "[ . 1 . 2]" 1
1324 1 63 LEU H 1 63 LEU HB3 3.980 . 4.380 3.689 3.639 3.804 . 0 0 "[ . 1 . 2]" 1
1325 1 63 LEU H 1 63 LEU MD1 3.930 . 4.320 3.898 3.770 4.101 . 0 0 "[ . 1 . 2]" 1
1326 1 63 LEU H 1 63 LEU MD2 4.470 . 4.920 3.519 3.208 3.780 . 0 0 "[ . 1 . 2]" 1
1327 1 63 LEU H 1 63 LEU HG 4.040 . 4.440 2.685 2.392 3.022 . 0 0 "[ . 1 . 2]" 1
1328 1 63 LEU H 1 64 THR H 4.760 . 5.240 4.507 4.367 4.603 . 0 0 "[ . 1 . 2]" 1
1329 1 63 LEU H 1 81 VAL H 4.890 . 5.380 3.899 3.596 4.246 . 0 0 "[ . 1 . 2]" 1
1330 1 63 LEU HA 1 63 LEU MD1 4.290 . 4.720 3.871 3.851 3.897 . 0 0 "[ . 1 . 2]" 1
1331 1 63 LEU HA 1 63 LEU MD2 3.310 . 3.640 2.047 1.979 2.109 . 0 0 "[ . 1 . 2]" 1
1332 1 63 LEU HA 1 64 THR H 3.000 . 3.300 2.213 2.140 2.295 . 0 0 "[ . 1 . 2]" 1
1333 1 63 LEU HB2 1 63 LEU MD1 3.110 . 3.420 2.360 2.318 2.393 . 0 0 "[ . 1 . 2]" 1
1334 1 63 LEU HB2 1 64 THR H 4.370 . 4.810 4.060 3.800 4.253 . 0 0 "[ . 1 . 2]" 1
1335 1 63 LEU HB2 1 65 TYR QE 3.670 . 4.040 2.819 2.565 3.036 . 0 0 "[ . 1 . 2]" 1
1336 1 63 LEU HB2 1 79 GLN H 4.520 . 4.970 3.388 3.127 3.653 . 0 0 "[ . 1 . 2]" 1
1337 1 63 LEU HB2 1 79 GLN HB3 4.680 . 5.150 2.539 2.216 3.186 . 0 0 "[ . 1 . 2]" 1
1338 1 63 LEU HB2 1 79 GLN HE21 4.640 . 5.100 2.819 2.406 3.800 . 0 0 "[ . 1 . 2]" 1
1339 1 63 LEU HB3 1 63 LEU MD1 3.170 . 3.490 2.379 2.343 2.416 . 0 0 "[ . 1 . 2]" 1
1340 1 63 LEU HB3 1 63 LEU MD2 3.120 . 3.430 2.412 2.368 2.450 . 0 0 "[ . 1 . 2]" 1
1341 1 63 LEU HB3 1 64 THR H 4.030 . 4.430 3.093 2.713 3.342 . 0 0 "[ . 1 . 2]" 1
1342 1 63 LEU HB3 1 65 TYR QE 3.630 . 3.990 3.411 3.109 3.600 . 0 0 "[ . 1 . 2]" 1
1343 1 63 LEU HB3 1 79 GLN H 5.060 . 5.570 4.613 4.387 4.788 . 0 0 "[ . 1 . 2]" 1
1344 1 63 LEU MD1 1 64 THR H 4.580 . 5.040 4.920 4.625 5.065 0.025 14 0 "[ . 1 . 2]" 1
1345 1 63 LEU MD1 1 65 TYR QE 3.690 . 4.060 3.362 3.238 3.498 . 0 0 "[ . 1 . 2]" 1
1346 1 63 LEU MD1 1 65 TYR HH 4.200 . 4.620 2.180 1.792 2.897 0.008 8 0 "[ . 1 . 2]" 1
1347 1 63 LEU MD1 1 79 GLN H 5.500 . 6.050 5.107 4.844 5.365 . 0 0 "[ . 1 . 2]" 1
1348 1 63 LEU MD1 1 79 GLN HB3 4.870 . 5.360 3.531 3.109 4.215 . 0 0 "[ . 1 . 2]" 1
1349 1 63 LEU MD1 1 79 GLN HE21 4.540 . 4.990 2.590 2.038 3.887 . 0 0 "[ . 1 . 2]" 1
1350 1 63 LEU MD1 1 79 GLN HE22 5.000 . 5.500 3.045 2.491 4.507 . 0 0 "[ . 1 . 2]" 1
1351 1 63 LEU MD1 1 81 VAL MG2 3.640 . 4.000 2.450 2.171 2.728 . 0 0 "[ . 1 . 2]" 1
1352 1 63 LEU MD2 1 64 THR H 3.690 . 4.060 3.613 3.435 3.791 . 0 0 "[ . 1 . 2]" 1
1353 1 63 LEU MD2 1 81 VAL MG2 4.030 . 4.430 3.930 3.681 4.183 . 0 0 "[ . 1 . 2]" 1
1354 1 63 LEU HG 1 64 THR H 5.290 . 5.820 5.149 4.990 5.270 . 0 0 "[ . 1 . 2]" 1
1355 1 63 LEU HG 1 65 TYR QE 4.710 . 5.180 4.968 4.709 5.185 0.005 6 0 "[ . 1 . 2]" 1
1356 1 64 THR H 1 64 THR HB 3.630 . 3.990 2.625 2.500 2.718 . 0 0 "[ . 1 . 2]" 1
1357 1 64 THR H 1 64 THR MG 4.050 . 4.460 3.864 3.800 3.905 . 0 0 "[ . 1 . 2]" 1
1358 1 64 THR H 1 78 LYS HG2 5.500 . 6.050 4.634 4.362 5.030 . 0 0 "[ . 1 . 2]" 1
1359 1 64 THR HA 1 64 THR MG 3.410 . 3.750 2.409 2.346 2.501 . 0 0 "[ . 1 . 2]" 1
1360 1 64 THR HA 1 65 TYR H 3.240 . 3.560 2.188 2.154 2.258 . 0 0 "[ . 1 . 2]" 1
1361 1 64 THR HA 1 65 TYR QD 3.730 . 4.100 3.682 3.452 3.915 . 0 0 "[ . 1 . 2]" 1
1362 1 64 THR HA 1 65 TYR QE 5.270 . 5.800 4.708 4.391 4.991 . 0 0 "[ . 1 . 2]" 1
1363 1 64 THR HA 1 77 ALA H 4.400 . 4.840 4.783 4.557 4.865 0.025 10 0 "[ . 1 . 2]" 1
1364 1 64 THR HA 1 77 ALA MB 5.500 . 6.050 5.326 5.111 5.434 . 0 0 "[ . 1 . 2]" 1
1365 1 64 THR HA 1 78 LYS HA 3.890 . 4.280 2.366 2.183 2.572 . 0 0 "[ . 1 . 2]" 1
1366 1 64 THR HA 1 78 LYS HB2 5.500 . 6.050 4.705 4.563 4.869 . 0 0 "[ . 1 . 2]" 1
1367 1 64 THR HA 1 78 LYS HB3 5.480 . 6.030 3.787 3.507 4.298 . 0 0 "[ . 1 . 2]" 1
1368 1 64 THR HA 1 78 LYS HG2 4.740 . 5.210 2.354 2.102 2.727 . 0 0 "[ . 1 . 2]" 1
1369 1 64 THR HA 1 78 LYS HG3 4.260 . 4.690 3.625 3.190 4.061 . 0 0 "[ . 1 . 2]" 1
1370 1 64 THR HB 1 65 TYR H 4.480 . 4.930 4.118 3.822 4.281 . 0 0 "[ . 1 . 2]" 1
1371 1 64 THR MG 1 65 TYR H 3.490 . 3.840 2.560 2.231 2.843 . 0 0 "[ . 1 . 2]" 1
1372 1 64 THR MG 1 65 TYR HA 4.710 . 5.180 3.655 3.528 3.850 . 0 0 "[ . 1 . 2]" 1
1373 1 64 THR MG 1 65 TYR QD 4.520 . 4.970 4.664 4.470 4.786 . 0 0 "[ . 1 . 2]" 1
1374 1 64 THR MG 1 66 THR H 4.530 . 4.980 4.076 3.709 4.563 . 0 0 "[ . 1 . 2]" 1
1375 1 64 THR MG 1 77 ALA H 3.440 . 3.780 3.702 3.507 3.808 0.028 1 0 "[ . 1 . 2]" 1
1376 1 64 THR MG 1 78 LYS HA 4.560 . 5.020 3.787 3.423 4.074 . 0 0 "[ . 1 . 2]" 1
1377 1 64 THR MG 1 78 LYS QE 3.890 . 4.280 3.199 2.384 4.327 0.047 8 0 "[ . 1 . 2]" 1
1378 1 64 THR MG 1 79 GLN H 5.500 . 6.050 5.386 5.110 5.707 . 0 0 "[ . 1 . 2]" 1
1379 1 65 TYR H 1 65 TYR HB2 3.920 . 4.310 2.682 2.588 2.785 . 0 0 "[ . 1 . 2]" 1
1380 1 65 TYR H 1 65 TYR HB3 4.140 . 4.550 3.788 3.708 3.863 . 0 0 "[ . 1 . 2]" 1
1381 1 65 TYR H 1 65 TYR QD 3.490 . 3.840 2.826 2.436 3.052 . 0 0 "[ . 1 . 2]" 1
1382 1 65 TYR H 1 65 TYR QE 4.460 . 4.910 4.705 4.415 4.920 0.010 9 0 "[ . 1 . 2]" 1
1383 1 65 TYR H 1 66 THR H 4.860 . 5.350 4.333 4.123 4.462 . 0 0 "[ . 1 . 2]" 1
1384 1 65 TYR H 1 76 THR HA 5.000 . 5.500 4.755 4.561 5.013 . 0 0 "[ . 1 . 2]" 1
1385 1 65 TYR H 1 77 ALA H 3.910 . 4.300 3.060 2.865 3.292 . 0 0 "[ . 1 . 2]" 1
1386 1 65 TYR H 1 77 ALA HA 4.890 . 5.380 4.814 4.712 4.986 . 0 0 "[ . 1 . 2]" 1
1387 1 65 TYR H 1 77 ALA MB 4.460 . 4.910 4.183 3.972 4.292 . 0 0 "[ . 1 . 2]" 1
1388 1 65 TYR H 1 78 LYS HA 3.950 . 4.350 3.130 2.888 3.323 . 0 0 "[ . 1 . 2]" 1
1389 1 65 TYR H 1 78 LYS HG3 4.930 . 5.420 4.366 4.029 4.820 . 0 0 "[ . 1 . 2]" 1
1390 1 65 TYR H 1 79 GLN H 5.330 . 5.860 4.949 4.563 5.148 . 0 0 "[ . 1 . 2]" 1
1391 1 65 TYR HA 1 65 TYR QD 3.960 . 4.360 2.872 2.768 3.002 . 0 0 "[ . 1 . 2]" 1
1392 1 65 TYR HA 1 66 THR H 2.950 . 3.250 2.183 2.151 2.228 . 0 0 "[ . 1 . 2]" 1
1393 1 65 TYR HB2 1 66 THR H 4.430 . 4.870 4.188 3.969 4.340 . 0 0 "[ . 1 . 2]" 1
1394 1 65 TYR HB2 1 77 ALA H 4.370 . 4.810 3.326 3.070 3.519 . 0 0 "[ . 1 . 2]" 1
1395 1 65 TYR HB2 1 77 ALA MB 4.280 . 4.710 3.393 3.188 3.556 . 0 0 "[ . 1 . 2]" 1
1396 1 65 TYR HB3 1 66 THR H 4.360 . 4.800 3.369 2.956 3.632 . 0 0 "[ . 1 . 2]" 1
1397 1 65 TYR HB3 1 77 ALA H 5.210 . 5.730 4.635 4.441 4.775 . 0 0 "[ . 1 . 2]" 1
1398 1 65 TYR HB3 1 77 ALA MB 4.660 . 5.130 4.793 4.575 5.006 . 0 0 "[ . 1 . 2]" 1
1399 1 65 TYR QD 1 65 TYR HH 4.500 . 4.950 4.298 4.288 4.309 . 0 0 "[ . 1 . 2]" 1
1400 1 65 TYR QD 1 66 THR H 4.580 . 5.040 4.337 3.992 4.530 . 0 0 "[ . 1 . 2]" 1
1401 1 65 TYR QD 1 77 ALA H 4.670 . 5.140 4.493 4.260 4.758 . 0 0 "[ . 1 . 2]" 1
1402 1 65 TYR QD 1 77 ALA MB 4.000 . 4.400 3.795 3.412 4.035 . 0 0 "[ . 1 . 2]" 1
1403 1 65 TYR QD 1 78 LYS HA 3.880 . 4.270 3.131 2.830 3.420 . 0 0 "[ . 1 . 2]" 1
1404 1 65 TYR QD 1 79 GLN H 4.200 . 4.620 3.944 3.649 4.256 . 0 0 "[ . 1 . 2]" 1
1405 1 65 TYR QD 1 79 GLN HB3 4.120 . 4.530 4.067 3.588 4.357 . 0 0 "[ . 1 . 2]" 1
1406 1 65 TYR QE 1 65 TYR HH 3.100 . 3.410 2.425 2.391 2.455 . 0 0 "[ . 1 . 2]" 1
1407 1 65 TYR QE 1 78 LYS HA 4.490 . 4.940 4.099 3.684 4.402 . 0 0 "[ . 1 . 2]" 1
1408 1 65 TYR QE 1 79 GLN H 3.860 . 4.250 3.402 3.022 3.667 . 0 0 "[ . 1 . 2]" 1
1409 1 65 TYR QE 1 79 GLN HB3 3.230 . 3.550 2.067 1.794 2.319 0.006 10 0 "[ . 1 . 2]" 1
1410 1 65 TYR HH 1 79 GLN HE21 4.330 . 4.760 2.691 1.939 3.308 . 0 0 "[ . 1 . 2]" 1
1411 1 65 TYR HH 1 79 GLN HE22 4.400 . 4.840 2.869 1.800 3.576 . 0 0 "[ . 1 . 2]" 1
1412 1 66 THR H 1 66 THR HB 3.790 . 4.170 2.735 2.638 2.859 . 0 0 "[ . 1 . 2]" 1
1413 1 66 THR HA 1 66 THR MG 3.450 . 3.790 2.404 2.358 2.465 . 0 0 "[ . 1 . 2]" 1
1414 1 66 THR HA 1 67 VAL H 2.940 . 3.230 2.195 2.145 2.254 . 0 0 "[ . 1 . 2]" 1
1415 1 66 THR HA 1 67 VAL HB 4.680 . 5.150 4.573 4.463 4.646 . 0 0 "[ . 1 . 2]" 1
1416 1 66 THR HA 1 67 VAL MG1 4.540 . 4.990 3.704 3.583 3.817 . 0 0 "[ . 1 . 2]" 1
1417 1 66 THR HA 1 75 VAL H 5.110 . 5.620 4.937 4.646 5.228 . 0 0 "[ . 1 . 2]" 1
1418 1 66 THR HA 1 76 THR HA 3.740 . 4.110 2.278 2.134 2.545 . 0 0 "[ . 1 . 2]" 1
1419 1 66 THR HA 1 76 THR HB 4.740 . 5.210 3.003 2.496 3.754 . 0 0 "[ . 1 . 2]" 1
1420 1 66 THR HA 1 77 ALA H 4.080 . 4.490 3.710 3.512 3.916 . 0 0 "[ . 1 . 2]" 1
1421 1 66 THR HB 1 67 VAL H 4.320 . 4.750 4.163 4.048 4.260 . 0 0 "[ . 1 . 2]" 1
1422 1 66 THR MG 1 67 VAL H 3.280 . 3.610 2.638 2.416 2.826 . 0 0 "[ . 1 . 2]" 1
1423 1 66 THR MG 1 67 VAL MG1 4.100 . 4.510 4.101 4.017 4.230 . 0 0 "[ . 1 . 2]" 1
1424 1 66 THR MG 1 74 GLU HA 4.530 . 4.980 4.296 3.960 4.832 . 0 0 "[ . 1 . 2]" 1
1425 1 66 THR MG 1 74 GLU HB2 4.630 . 5.090 4.496 4.200 4.939 . 0 0 "[ . 1 . 2]" 1
1426 1 66 THR MG 1 74 GLU HB3 4.890 . 5.380 4.479 4.036 4.892 . 0 0 "[ . 1 . 2]" 1
1427 1 66 THR MG 1 74 GLU HG2 3.390 . 3.730 2.510 2.121 2.954 . 0 0 "[ . 1 . 2]" 1
1428 1 66 THR MG 1 74 GLU HG3 3.390 . 3.730 2.601 2.274 3.024 . 0 0 "[ . 1 . 2]" 1
1429 1 66 THR MG 1 75 VAL H 4.130 . 4.540 3.827 3.399 4.355 . 0 0 "[ . 1 . 2]" 1
1430 1 66 THR MG 1 76 THR HA 3.790 . 4.170 3.469 3.183 3.741 . 0 0 "[ . 1 . 2]" 1
1431 1 66 THR MG 1 76 THR HB 3.520 . 3.870 2.433 2.031 3.151 . 0 0 "[ . 1 . 2]" 1
1432 1 67 VAL H 1 67 VAL HB 4.020 . 4.420 3.181 2.996 3.301 . 0 0 "[ . 1 . 2]" 1
1433 1 67 VAL H 1 67 VAL MG1 3.220 . 3.540 2.198 2.070 2.363 . 0 0 "[ . 1 . 2]" 1
1434 1 67 VAL H 1 67 VAL MG2 3.970 . 4.370 3.934 3.891 3.993 . 0 0 "[ . 1 . 2]" 1
1435 1 67 VAL H 1 68 THR H 4.480 . 4.930 4.432 4.351 4.521 . 0 0 "[ . 1 . 2]" 1
1436 1 67 VAL H 1 74 GLU HA 4.700 . 5.170 4.709 4.259 5.107 . 0 0 "[ . 1 . 2]" 1
1437 1 67 VAL H 1 74 GLU QG 4.860 . 5.350 3.745 3.501 4.135 . 0 0 "[ . 1 . 2]" 1
1438 1 67 VAL H 1 75 VAL H 3.580 . 3.940 3.344 3.149 3.536 . 0 0 "[ . 1 . 2]" 1
1439 1 67 VAL H 1 75 VAL QG 4.830 . 5.310 3.359 3.105 4.284 . 0 0 "[ . 1 . 2]" 1
1440 1 67 VAL H 1 76 THR HA 3.950 . 4.350 3.477 3.220 3.755 . 0 0 "[ . 1 . 2]" 1
1441 1 67 VAL HA 1 67 VAL MG2 3.010 . 3.310 2.370 2.338 2.404 . 0 0 "[ . 1 . 2]" 1
1442 1 67 VAL HA 1 68 THR H 2.920 . 3.210 2.232 2.179 2.326 . 0 0 "[ . 1 . 2]" 1
1443 1 67 VAL HA 1 68 THR HA 4.920 . 5.410 4.415 4.386 4.485 . 0 0 "[ . 1 . 2]" 1
1444 1 67 VAL HB 1 68 THR H 4.300 . 4.730 4.071 3.988 4.167 . 0 0 "[ . 1 . 2]" 1
1445 1 67 VAL MG1 1 68 THR H 4.230 . 4.650 3.828 3.633 3.976 . 0 0 "[ . 1 . 2]" 1
1446 1 67 VAL MG1 1 68 THR HA 4.900 . 5.390 4.057 3.666 4.177 . 0 0 "[ . 1 . 2]" 1
1447 1 67 VAL MG1 1 69 ASP H 5.050 . 5.560 4.813 4.405 5.195 . 0 0 "[ . 1 . 2]" 1
1448 1 67 VAL MG1 1 74 GLU HA 4.850 . 5.330 4.180 3.928 4.509 . 0 0 "[ . 1 . 2]" 1
1449 1 67 VAL MG1 1 75 VAL H 3.990 . 4.390 3.017 2.683 3.308 . 0 0 "[ . 1 . 2]" 1
1450 1 67 VAL MG1 1 75 VAL HB 4.120 . 4.530 3.987 2.309 4.426 . 0 0 "[ . 1 . 2]" 1
1451 1 67 VAL MG1 1 75 VAL QG 3.630 . 3.990 2.142 1.912 2.982 . 0 0 "[ . 1 . 2]" 1
1452 1 67 VAL MG2 1 68 THR H 3.120 . 3.430 2.345 2.137 2.546 . 0 0 "[ . 1 . 2]" 1
1453 1 67 VAL MG2 1 68 THR HA 4.840 . 5.320 3.811 3.592 3.902 . 0 0 "[ . 1 . 2]" 1
1454 1 67 VAL MG2 1 68 THR HB 4.900 . 5.390 4.372 4.133 4.598 . 0 0 "[ . 1 . 2]" 1
1455 1 67 VAL MG2 1 69 ASP H 4.870 . 5.360 4.446 4.190 4.773 . 0 0 "[ . 1 . 2]" 1
1456 1 68 THR H 1 68 THR HB 3.490 . 3.840 2.672 2.610 2.766 . 0 0 "[ . 1 . 2]" 1
1457 1 68 THR H 1 68 THR MG 3.920 . 4.310 3.883 3.856 3.926 . 0 0 "[ . 1 . 2]" 1
1458 1 68 THR H 1 69 ASP H 4.680 . 5.150 4.439 4.321 4.539 . 0 0 "[ . 1 . 2]" 1
1459 1 68 THR HA 1 68 THR MG 3.560 . 3.920 2.369 2.330 2.429 . 0 0 "[ . 1 . 2]" 1
1460 1 68 THR HA 1 69 ASP H 2.940 . 3.230 2.174 2.128 2.271 . 0 0 "[ . 1 . 2]" 1
1461 1 68 THR HA 1 69 ASP HA 5.280 . 5.810 4.413 4.376 4.446 . 0 0 "[ . 1 . 2]" 1
1462 1 68 THR HA 1 73 HIS H 5.280 . 5.810 5.238 4.508 5.682 . 0 0 "[ . 1 . 2]" 1
1463 1 68 THR HA 1 74 GLU H 4.990 . 5.490 4.666 4.380 5.071 . 0 0 "[ . 1 . 2]" 1
1464 1 68 THR HA 1 74 GLU HA 3.730 . 4.100 2.221 1.893 2.599 . 0 0 "[ . 1 . 2]" 1
1465 1 68 THR HA 1 74 GLU HG2 4.890 . 5.380 4.375 3.736 5.174 . 0 0 "[ . 1 . 2]" 1
1466 1 68 THR HA 1 74 GLU QG 4.170 . 4.590 3.040 2.499 3.737 . 0 0 "[ . 1 . 2]" 1
1467 1 68 THR HA 1 74 GLU HG3 4.890 . 5.380 3.156 2.520 4.666 . 0 0 "[ . 1 . 2]" 1
1468 1 68 THR HA 1 75 VAL H 3.950 . 4.350 3.613 3.223 3.967 . 0 0 "[ . 1 . 2]" 1
1469 1 68 THR HA 1 75 VAL QG 5.440 . 5.980 4.405 4.064 4.762 . 0 0 "[ . 1 . 2]" 1
1470 1 68 THR HB 1 69 ASP H 4.150 . 4.570 4.065 3.845 4.278 . 0 0 "[ . 1 . 2]" 1
1471 1 68 THR HB 1 74 GLU HA 5.050 . 5.560 5.076 4.620 5.569 0.009 19 0 "[ . 1 . 2]" 1
1472 1 68 THR MG 1 69 ASP H 3.380 . 3.720 2.551 2.239 2.926 . 0 0 "[ . 1 . 2]" 1
1473 1 68 THR MG 1 69 ASP HA 4.410 . 4.850 4.011 3.832 4.153 . 0 0 "[ . 1 . 2]" 1
1474 1 68 THR MG 1 72 GLY H 4.110 . 4.520 3.647 3.188 4.091 . 0 0 "[ . 1 . 2]" 1
1475 1 68 THR MG 1 72 GLY HA2 3.460 . 3.810 3.094 2.206 3.816 0.006 17 0 "[ . 1 . 2]" 1
1476 1 68 THR MG 1 72 GLY HA3 4.900 . 5.390 4.477 3.516 5.261 . 0 0 "[ . 1 . 2]" 1
1477 1 68 THR MG 1 73 HIS H 3.940 . 4.330 4.027 3.104 4.379 0.049 16 0 "[ . 1 . 2]" 1
1478 1 68 THR MG 1 74 GLU H 4.570 . 5.030 4.289 3.780 4.999 . 0 0 "[ . 1 . 2]" 1
1479 1 68 THR MG 1 74 GLU HA 4.040 . 4.440 3.365 2.974 3.833 . 0 0 "[ . 1 . 2]" 1
1480 1 68 THR MG 1 74 GLU HB2 4.130 . 4.540 2.604 2.067 3.011 . 0 0 "[ . 1 . 2]" 1
1481 1 68 THR MG 1 74 GLU HB3 4.140 . 4.550 4.163 3.679 4.589 0.039 19 0 "[ . 1 . 2]" 1
1482 1 68 THR MG 1 74 GLU QG 4.270 . 4.700 3.538 3.131 3.900 . 0 0 "[ . 1 . 2]" 1
1483 1 69 ASP H 1 70 SER H 4.930 . 5.420 4.612 4.506 4.652 . 0 0 "[ . 1 . 2]" 1
1484 1 69 ASP H 1 70 SER HA 5.500 . 6.050 5.604 5.310 5.740 . 0 0 "[ . 1 . 2]" 1
1485 1 69 ASP H 1 71 LYS H 4.970 . 5.470 5.139 4.615 5.379 . 0 0 "[ . 1 . 2]" 1
1486 1 69 ASP H 1 73 HIS H 3.730 . 4.100 3.411 2.793 3.878 . 0 0 "[ . 1 . 2]" 1
1487 1 69 ASP H 1 73 HIS QB 4.370 . 4.810 3.647 3.266 4.024 . 0 0 "[ . 1 . 2]" 1
1488 1 69 ASP H 1 74 GLU HA 3.990 . 4.390 3.190 2.786 4.010 . 0 0 "[ . 1 . 2]" 1
1489 1 69 ASP H 1 75 VAL H 4.900 . 5.390 4.681 4.205 5.303 . 0 0 "[ . 1 . 2]" 1
1490 1 69 ASP H 1 75 VAL QG 5.320 . 5.850 4.634 4.285 5.122 . 0 0 "[ . 1 . 2]" 1
1491 1 69 ASP HA 1 70 SER H 3.450 . 3.790 2.356 2.298 2.559 . 0 0 "[ . 1 . 2]" 1
1492 1 69 ASP HA 1 70 SER HA 4.690 . 5.160 4.333 4.274 4.409 . 0 0 "[ . 1 . 2]" 1
1493 1 69 ASP HA 1 71 LYS H 4.390 . 4.830 4.210 3.918 4.512 . 0 0 "[ . 1 . 2]" 1
1494 1 69 ASP QB 1 70 SER H 3.560 . 3.920 3.363 2.478 3.553 . 0 0 "[ . 1 . 2]" 1
1495 1 69 ASP HB2 1 70 SER H 4.240 . 4.660 3.856 2.512 4.151 . 0 0 "[ . 1 . 2]" 1
1496 1 69 ASP HB2 1 71 LYS H 4.710 . 5.180 4.408 3.941 4.595 . 0 0 "[ . 1 . 2]" 1
1497 1 69 ASP HB3 1 70 SER H 4.240 . 4.660 3.784 3.362 4.066 . 0 0 "[ . 1 . 2]" 1
1498 1 69 ASP HB3 1 71 LYS H 4.710 . 5.180 3.430 2.815 4.329 . 0 0 "[ . 1 . 2]" 1
1499 1 70 SER H 1 71 LYS H 4.040 . 4.440 2.703 2.542 2.899 . 0 0 "[ . 1 . 2]" 1
1500 1 71 LYS H 1 71 LYS HB2 3.880 . 4.270 2.480 2.288 2.694 . 0 0 "[ . 1 . 2]" 1
1501 1 71 LYS H 1 71 LYS QB 3.270 . 3.600 2.441 2.261 2.636 . 0 0 "[ . 1 . 2]" 1
1502 1 71 LYS H 1 71 LYS HB3 3.880 . 4.270 3.650 3.518 3.738 . 0 0 "[ . 1 . 2]" 1
1503 1 71 LYS H 1 71 LYS QD 3.930 . 4.320 3.122 1.885 4.540 0.220 6 0 "[ . 1 . 2]" 1
1504 1 71 LYS H 1 71 LYS QE 5.090 . 5.600 4.392 2.905 5.195 . 0 0 "[ . 1 . 2]" 1
1505 1 71 LYS H 1 71 LYS HG2 4.300 . 4.730 3.217 2.284 4.352 . 0 0 "[ . 1 . 2]" 1
1506 1 71 LYS H 1 71 LYS QG 3.740 . 4.110 2.904 2.262 3.893 . 0 0 "[ . 1 . 2]" 1
1507 1 71 LYS H 1 71 LYS HG3 4.300 . 4.730 3.766 2.714 4.389 . 0 0 "[ . 1 . 2]" 1
1508 1 71 LYS H 1 72 GLY H 3.190 . 3.510 2.491 2.298 2.709 . 0 0 "[ . 1 . 2]" 1
1509 1 71 LYS H 1 72 GLY HA2 4.910 . 5.400 4.888 4.730 5.105 . 0 0 "[ . 1 . 2]" 1
1510 1 71 LYS H 1 73 HIS H 4.050 . 4.460 3.712 3.442 4.005 . 0 0 "[ . 1 . 2]" 1
1511 1 71 LYS HA 1 71 LYS QD 3.320 . 3.650 2.572 1.975 3.700 0.050 6 0 "[ . 1 . 2]" 1
1512 1 71 LYS HA 1 73 HIS H 5.340 . 5.870 5.015 4.729 5.342 . 0 0 "[ . 1 . 2]" 1
1513 1 71 LYS QB 1 71 LYS QD 3.170 . 3.490 2.371 2.189 2.722 . 0 0 "[ . 1 . 2]" 1
1514 1 71 LYS QB 1 73 HIS H 4.170 . 4.590 3.676 2.996 4.374 . 0 0 "[ . 1 . 2]" 1
1515 1 71 LYS HB2 1 72 GLY H 4.280 . 4.710 3.599 3.253 4.036 . 0 0 "[ . 1 . 2]" 1
1516 1 71 LYS HB3 1 72 GLY H 4.280 . 4.710 4.261 4.088 4.514 . 0 0 "[ . 1 . 2]" 1
1517 1 71 LYS QE 1 71 LYS HG2 3.430 . 3.770 2.701 2.366 3.523 . 0 0 "[ . 1 . 2]" 1
1518 1 71 LYS QE 1 71 LYS QG 2.910 . 3.200 2.289 2.140 2.771 . 0 0 "[ . 1 . 2]" 1
1519 1 71 LYS QE 1 71 LYS HG3 3.430 . 3.770 2.622 2.223 3.309 . 0 0 "[ . 1 . 2]" 1
1520 1 72 GLY H 1 73 HIS H 3.180 . 3.500 2.372 2.220 2.528 . 0 0 "[ . 1 . 2]" 1
1521 1 73 HIS H 1 73 HIS QB 3.400 . 3.740 2.372 2.275 2.456 . 0 0 "[ . 1 . 2]" 1
1522 1 73 HIS H 1 73 HIS HD2 4.790 . 5.270 4.835 4.274 5.269 . 0 0 "[ . 1 . 2]" 1
1523 1 73 HIS H 1 74 GLU HB2 5.500 . 6.050 5.541 5.136 5.904 . 0 0 "[ . 1 . 2]" 1
1524 1 73 HIS HA 1 73 HIS HD2 3.670 . 4.040 2.844 2.523 3.277 . 0 0 "[ . 1 . 2]" 1
1525 1 73 HIS HA 1 74 GLU H 2.910 . 3.200 2.179 2.134 2.242 . 0 0 "[ . 1 . 2]" 1
1526 1 73 HIS QB 1 74 GLU H 3.990 . 4.390 3.440 2.972 3.699 . 0 0 "[ . 1 . 2]" 1
1527 1 73 HIS QB 1 75 VAL QG 3.880 . 4.270 3.280 2.776 3.593 . 0 0 "[ . 1 . 2]" 1
1528 1 73 HIS HD2 1 74 GLU H 4.030 . 4.430 4.356 3.837 4.491 0.061 11 0 "[ . 1 . 2]" 1
1529 1 74 GLU H 1 74 GLU HB2 3.370 . 3.710 2.947 2.774 3.184 . 0 0 "[ . 1 . 2]" 1
1530 1 74 GLU H 1 74 GLU HB3 3.420 . 3.760 2.581 2.417 2.814 . 0 0 "[ . 1 . 2]" 1
1531 1 74 GLU H 1 74 GLU HG2 4.860 . 5.350 4.458 4.396 4.575 . 0 0 "[ . 1 . 2]" 1
1532 1 74 GLU H 1 74 GLU HG3 4.860 . 5.350 4.688 4.606 5.016 . 0 0 "[ . 1 . 2]" 1
1533 1 74 GLU H 1 75 VAL H 4.450 . 4.890 4.357 4.129 4.511 . 0 0 "[ . 1 . 2]" 1
1534 1 74 GLU H 1 75 VAL QG 4.340 . 4.770 3.983 3.692 4.238 . 0 0 "[ . 1 . 2]" 1
1535 1 74 GLU HA 1 74 GLU HG2 4.130 . 4.540 3.058 2.495 3.229 . 0 0 "[ . 1 . 2]" 1
1536 1 74 GLU HA 1 74 GLU QG 3.510 . 3.860 2.462 2.388 2.498 . 0 0 "[ . 1 . 2]" 1
1537 1 74 GLU HA 1 74 GLU HG3 4.130 . 4.540 2.667 2.486 3.550 . 0 0 "[ . 1 . 2]" 1
1538 1 74 GLU HA 1 75 VAL H 3.040 . 3.340 2.166 2.143 2.221 . 0 0 "[ . 1 . 2]" 1
1539 1 74 GLU HA 1 75 VAL MG1 5.500 . 6.050 4.065 3.691 5.506 . 0 0 "[ . 1 . 2]" 1
1540 1 74 GLU HA 1 75 VAL QG 4.080 . 4.490 3.398 3.285 3.623 . 0 0 "[ . 1 . 2]" 1
1541 1 74 GLU HA 1 75 VAL MG2 5.500 . 6.050 3.735 3.531 3.910 . 0 0 "[ . 1 . 2]" 1
1542 1 74 GLU HB2 1 75 VAL H 4.840 . 5.320 4.321 4.156 4.467 . 0 0 "[ . 1 . 2]" 1
1543 1 74 GLU HB3 1 75 VAL H 4.740 . 5.210 4.280 4.056 4.430 . 0 0 "[ . 1 . 2]" 1
1544 1 74 GLU QG 1 75 VAL H 3.580 . 3.940 2.947 2.461 3.286 . 0 0 "[ . 1 . 2]" 1
1545 1 74 GLU HG2 1 75 VAL H 4.360 . 4.800 3.248 2.480 3.769 . 0 0 "[ . 1 . 2]" 1
1546 1 74 GLU HG3 1 75 VAL H 4.360 . 4.800 3.480 2.898 4.484 . 0 0 "[ . 1 . 2]" 1
1547 1 75 VAL H 1 75 VAL HB 4.110 . 4.520 3.644 2.612 3.890 . 0 0 "[ . 1 . 2]" 1
1548 1 75 VAL H 1 75 VAL MG1 4.250 . 4.680 3.010 2.628 3.908 . 0 0 "[ . 1 . 2]" 1
1549 1 75 VAL H 1 75 VAL QG 3.490 . 3.840 2.169 1.984 2.715 . 0 0 "[ . 1 . 2]" 1
1550 1 75 VAL H 1 75 VAL MG2 4.250 . 4.680 2.227 2.044 2.771 . 0 0 "[ . 1 . 2]" 1
1551 1 75 VAL H 1 76 THR H 4.580 . 5.040 4.510 4.366 4.570 . 0 0 "[ . 1 . 2]" 1
1552 1 75 VAL HA 1 75 VAL MG1 3.560 . 3.920 2.365 2.328 2.414 . 0 0 "[ . 1 . 2]" 1
1553 1 75 VAL HA 1 75 VAL MG2 3.560 . 3.920 3.105 2.431 3.228 . 0 0 "[ . 1 . 2]" 1
1554 1 75 VAL HA 1 76 THR H 2.690 . 2.960 2.352 2.222 2.421 . 0 0 "[ . 1 . 2]" 1
1555 1 75 VAL HA 1 76 THR HA 4.890 . 5.380 4.488 4.453 4.519 . 0 0 "[ . 1 . 2]" 1
1556 1 75 VAL HA 1 76 THR HB 4.950 . 5.440 4.423 4.275 4.617 . 0 0 "[ . 1 . 2]" 1
1557 1 75 VAL HB 1 76 THR H 4.090 . 4.500 2.782 2.411 4.168 . 0 0 "[ . 1 . 2]" 1
1558 1 75 VAL QG 1 76 THR H 3.660 . 4.030 3.110 2.155 3.326 . 0 0 "[ . 1 . 2]" 1
1559 1 75 VAL QG 1 76 THR HA 4.790 . 5.270 3.672 3.443 3.779 . 0 0 "[ . 1 . 2]" 1
1560 1 75 VAL MG1 1 76 THR H 4.220 . 4.640 3.540 2.165 3.831 . 0 0 "[ . 1 . 2]" 1
1561 1 75 VAL MG2 1 76 THR H 4.220 . 4.640 3.616 3.353 4.098 . 0 0 "[ . 1 . 2]" 1
1562 1 76 THR H 1 76 THR HB 3.780 . 4.160 3.358 3.281 3.491 . 0 0 "[ . 1 . 2]" 1
1563 1 76 THR H 1 76 THR MG 3.520 . 3.870 2.330 2.234 2.440 . 0 0 "[ . 1 . 2]" 1
1564 1 76 THR H 1 77 ALA H 4.750 . 5.220 4.398 4.290 4.452 . 0 0 "[ . 1 . 2]" 1
1565 1 76 THR HA 1 76 THR MG 3.510 . 3.860 3.222 3.209 3.227 . 0 0 "[ . 1 . 2]" 1
1566 1 76 THR HA 1 77 ALA H 2.960 . 3.260 2.244 2.154 2.320 . 0 0 "[ . 1 . 2]" 1
1567 1 76 THR HA 1 77 ALA HA 4.610 . 5.070 4.489 4.447 4.518 . 0 0 "[ . 1 . 2]" 1
1568 1 76 THR HA 1 77 ALA MB 4.540 . 4.990 3.925 3.872 3.966 . 0 0 "[ . 1 . 2]" 1
1569 1 76 THR HB 1 77 ALA H 3.840 . 4.220 3.934 3.857 4.138 . 0 0 "[ . 1 . 2]" 1
1570 1 76 THR MG 1 77 ALA H 3.930 . 4.320 3.775 3.578 4.043 . 0 0 "[ . 1 . 2]" 1
1571 1 77 ALA H 1 78 LYS H 4.430 . 4.870 4.418 4.339 4.470 . 0 0 "[ . 1 . 2]" 1
1572 1 77 ALA H 1 78 LYS HG3 4.890 . 5.380 4.652 4.368 5.036 . 0 0 "[ . 1 . 2]" 1
1573 1 77 ALA HA 1 78 LYS H 2.820 . 3.100 2.402 2.257 2.472 . 0 0 "[ . 1 . 2]" 1
1574 1 77 ALA HA 1 78 LYS HB2 4.970 . 5.470 4.502 4.303 4.682 . 0 0 "[ . 1 . 2]" 1
1575 1 77 ALA HA 1 78 LYS HB3 5.500 . 6.050 5.645 5.578 5.702 . 0 0 "[ . 1 . 2]" 1
1576 1 77 ALA MB 1 78 LYS H 2.990 . 3.290 2.527 2.404 2.812 . 0 0 "[ . 1 . 2]" 1
1577 1 77 ALA MB 1 78 LYS HA 4.930 . 5.420 4.133 4.058 4.255 . 0 0 "[ . 1 . 2]" 1
1578 1 78 LYS H 1 78 LYS HB2 3.370 . 3.710 2.625 2.505 2.702 . 0 0 "[ . 1 . 2]" 1
1579 1 78 LYS H 1 78 LYS HB3 4.160 . 4.580 3.771 3.691 3.827 . 0 0 "[ . 1 . 2]" 1
1580 1 78 LYS H 1 78 LYS QD 5.500 . 6.050 4.388 4.000 4.930 . 0 0 "[ . 1 . 2]" 1
1581 1 78 LYS H 1 78 LYS HG2 4.630 . 5.090 4.080 3.755 4.418 . 0 0 "[ . 1 . 2]" 1
1582 1 78 LYS H 1 78 LYS HG3 3.680 . 4.050 3.039 2.589 3.417 . 0 0 "[ . 1 . 2]" 1
1583 1 78 LYS H 1 79 GLN H 4.460 . 4.910 4.505 4.458 4.551 . 0 0 "[ . 1 . 2]" 1
1584 1 78 LYS HA 1 78 LYS QD 4.330 . 4.760 4.029 3.972 4.278 . 0 0 "[ . 1 . 2]" 1
1585 1 78 LYS HA 1 78 LYS HG3 3.930 . 4.320 3.034 2.761 3.206 . 0 0 "[ . 1 . 2]" 1
1586 1 78 LYS HA 1 79 GLN H 3.060 . 3.370 2.304 2.240 2.342 . 0 0 "[ . 1 . 2]" 1
1587 1 78 LYS HA 1 79 GLN HB2 5.500 . 6.050 4.505 4.398 4.612 . 0 0 "[ . 1 . 2]" 1
1588 1 78 LYS HA 1 79 GLN HB3 5.500 . 6.050 4.409 4.304 4.511 . 0 0 "[ . 1 . 2]" 1
1589 1 78 LYS HB2 1 79 GLN H 4.460 . 4.910 3.787 3.640 3.945 . 0 0 "[ . 1 . 2]" 1
1590 1 78 LYS HB2 1 79 GLN HA 5.500 . 6.050 4.780 4.469 5.004 . 0 0 "[ . 1 . 2]" 1
1591 1 78 LYS HB3 1 78 LYS QD 3.270 . 3.600 2.440 2.358 2.873 . 0 0 "[ . 1 . 2]" 1
1592 1 78 LYS HB3 1 78 LYS QE 4.750 . 5.220 3.744 2.058 4.229 . 0 0 "[ . 1 . 2]" 1
1593 1 78 LYS HB3 1 79 GLN H 3.680 . 4.050 2.589 2.487 2.766 . 0 0 "[ . 1 . 2]" 1
1594 1 78 LYS HB3 1 79 GLN HA 5.500 . 6.050 4.404 4.218 4.581 . 0 0 "[ . 1 . 2]" 1
1595 1 78 LYS QD 1 79 GLN H 5.500 . 6.050 4.650 4.437 5.176 . 0 0 "[ . 1 . 2]" 1
1596 1 78 LYS QE 1 78 LYS HG2 3.640 . 4.000 2.681 2.389 3.483 . 0 0 "[ . 1 . 2]" 1
1597 1 78 LYS QE 1 78 LYS HG3 3.370 . 3.710 2.603 2.356 3.504 . 0 0 "[ . 1 . 2]" 1
1598 1 78 LYS HG2 1 79 GLN H 4.370 . 4.810 3.982 3.575 4.231 . 0 0 "[ . 1 . 2]" 1
1599 1 78 LYS HG3 1 79 GLN H 4.880 . 5.370 4.840 4.552 5.000 . 0 0 "[ . 1 . 2]" 1
1600 1 79 GLN H 1 79 GLN HB3 3.910 . 4.300 2.657 2.597 2.762 . 0 0 "[ . 1 . 2]" 1
1601 1 79 GLN H 1 79 GLN HG2 5.120 . 5.630 4.349 4.274 4.433 . 0 0 "[ . 1 . 2]" 1
1602 1 79 GLN H 1 80 THR H 4.780 . 5.260 4.292 4.108 4.414 . 0 0 "[ . 1 . 2]" 1
1603 1 79 GLN H 1 81 VAL MG2 5.500 . 6.050 5.036 4.822 5.325 . 0 0 "[ . 1 . 2]" 1
1604 1 79 GLN HA 1 80 THR H 3.100 . 3.410 2.188 2.159 2.257 . 0 0 "[ . 1 . 2]" 1
1605 1 79 GLN HB2 1 79 GLN HE22 4.270 . 4.700 3.857 3.720 3.982 . 0 0 "[ . 1 . 2]" 1
1606 1 79 GLN HB2 1 80 THR H 5.500 . 6.050 4.200 4.048 4.312 . 0 0 "[ . 1 . 2]" 1
1607 1 79 GLN HB3 1 79 GLN HE21 3.790 . 4.170 1.815 1.771 1.907 0.029 3 0 "[ . 1 . 2]" 1
1608 1 79 GLN HB3 1 79 GLN HE22 4.510 . 4.960 3.448 3.398 3.544 . 0 0 "[ . 1 . 2]" 1
1609 1 79 GLN HB3 1 80 THR H 5.500 . 6.050 4.279 4.118 4.403 . 0 0 "[ . 1 . 2]" 1
1610 1 79 GLN HE21 1 81 VAL MG2 4.040 . 4.440 3.316 2.857 3.868 . 0 0 "[ . 1 . 2]" 1
1611 1 79 GLN HE22 1 81 VAL MG2 4.780 . 5.260 3.533 3.023 4.223 . 0 0 "[ . 1 . 2]" 1
1612 1 79 GLN HG2 1 80 THR H 4.180 . 4.600 3.144 2.771 3.517 . 0 0 "[ . 1 . 2]" 1
1613 1 79 GLN HG2 1 81 VAL MG2 3.790 . 4.170 2.294 2.129 2.508 . 0 0 "[ . 1 . 2]" 1
1614 1 79 GLN HG3 1 80 THR H 3.650 . 4.020 3.173 2.819 3.438 . 0 0 "[ . 1 . 2]" 1
1615 1 79 GLN HG3 1 81 VAL MG2 3.640 . 4.000 3.593 3.392 3.875 . 0 0 "[ . 1 . 2]" 1
1616 1 80 THR H 1 80 THR HB 3.800 . 4.180 2.569 2.445 2.912 . 0 0 "[ . 1 . 2]" 1
1617 1 80 THR H 1 80 THR MG 4.130 . 4.540 3.634 1.928 3.851 . 0 0 "[ . 1 . 2]" 1
1618 1 80 THR H 1 81 VAL H 4.820 . 5.300 4.293 4.244 4.401 . 0 0 "[ . 1 . 2]" 1
1619 1 80 THR H 1 81 VAL MG2 4.640 . 5.100 4.343 4.196 4.596 . 0 0 "[ . 1 . 2]" 1
1620 1 80 THR HA 1 80 THR MG 3.240 . 3.560 2.501 2.346 3.232 . 0 0 "[ . 1 . 2]" 1
1621 1 80 THR HA 1 81 VAL H 3.200 . 3.520 2.192 2.152 2.217 . 0 0 "[ . 1 . 2]" 1
1622 1 80 THR HB 1 81 VAL H 5.170 . 5.690 4.420 4.339 4.474 . 0 0 "[ . 1 . 2]" 1
1623 1 80 THR MG 1 81 VAL H 3.840 . 4.220 3.302 3.088 4.204 . 0 0 "[ . 1 . 2]" 1
1624 1 81 VAL H 1 81 VAL HB 3.390 . 3.730 2.590 2.563 2.640 . 0 0 "[ . 1 . 2]" 1
1625 1 81 VAL H 1 81 VAL MG1 4.430 . 4.870 3.841 3.828 3.860 . 0 0 "[ . 1 . 2]" 1
1626 1 81 VAL H 1 81 VAL MG2 3.660 . 4.030 2.389 2.322 2.497 . 0 0 "[ . 1 . 2]" 1
1627 1 81 VAL H 1 82 THR H 4.780 . 5.260 4.432 4.242 4.576 . 0 0 "[ . 1 . 2]" 1
1628 1 81 VAL HA 1 82 THR H 3.070 . 3.380 2.196 2.165 2.258 . 0 0 "[ . 1 . 2]" 1
1629 1 81 VAL HB 1 82 THR H 4.760 . 5.240 4.189 3.965 4.408 . 0 0 "[ . 1 . 2]" 1
1630 1 81 VAL HB 1 83 VAL MG2 4.240 . 4.660 4.199 3.935 4.522 . 0 0 "[ . 1 . 2]" 1
1631 1 81 VAL MG1 1 82 THR H 3.670 . 4.040 2.766 2.370 3.224 . 0 0 "[ . 1 . 2]" 1
1632 1 81 VAL MG1 1 82 THR HB 5.350 . 5.890 4.752 4.548 5.035 . 0 0 "[ . 1 . 2]" 1
1633 1 81 VAL MG1 1 83 VAL HA 4.990 . 5.490 4.224 4.036 4.446 . 0 0 "[ . 1 . 2]" 1
1634 1 81 VAL MG1 1 83 VAL MG2 3.710 . 4.080 2.699 2.452 3.025 . 0 0 "[ . 1 . 2]" 1
1635 1 81 VAL MG2 1 82 THR H 4.370 . 4.810 4.131 4.009 4.277 . 0 0 "[ . 1 . 2]" 1
1636 1 82 THR H 1 82 THR HB 3.580 . 3.940 2.627 2.466 2.783 . 0 0 "[ . 1 . 2]" 1
1637 1 82 THR H 1 82 THR MG 4.050 . 4.460 3.861 3.795 3.925 . 0 0 "[ . 1 . 2]" 1
1638 1 82 THR H 1 83 VAL H 5.490 . 6.040 4.317 4.125 4.489 . 0 0 "[ . 1 . 2]" 1
1639 1 82 THR H 1 83 VAL MG2 5.500 . 6.050 4.479 4.190 4.732 . 0 0 "[ . 1 . 2]" 1
1640 1 82 THR HA 1 83 VAL H 3.090 . 3.400 2.155 2.122 2.197 . 0 0 "[ . 1 . 2]" 1
1641 1 82 THR HA 1 83 VAL MG2 4.410 . 4.850 3.609 3.463 3.777 . 0 0 "[ . 1 . 2]" 1
1642 1 82 THR HB 1 83 VAL H 4.740 . 5.210 4.305 4.159 4.390 . 0 0 "[ . 1 . 2]" 1
1643 1 82 THR MG 1 83 VAL H 3.540 . 3.890 2.904 2.603 3.156 . 0 0 "[ . 1 . 2]" 1
1644 1 82 THR MG 1 83 VAL HA 5.180 . 5.700 3.876 3.670 4.018 . 0 0 "[ . 1 . 2]" 1
1645 1 82 THR MG 1 84 LYS H 4.370 . 4.810 4.261 3.833 4.495 . 0 0 "[ . 1 . 2]" 1
1646 1 83 VAL H 1 83 VAL HB 3.780 . 4.160 2.593 2.544 2.636 . 0 0 "[ . 1 . 2]" 1
1647 1 83 VAL H 1 83 VAL MG1 4.100 . 4.510 3.835 3.813 3.862 . 0 0 "[ . 1 . 2]" 1
1648 1 83 VAL H 1 83 VAL MG2 3.670 . 4.040 2.326 2.202 2.526 . 0 0 "[ . 1 . 2]" 1
1649 1 83 VAL H 1 84 LYS H 4.510 . 4.960 4.490 4.366 4.550 . 0 0 "[ . 1 . 2]" 1
1650 1 83 VAL HA 1 84 LYS H 3.180 . 3.500 2.189 2.151 2.231 . 0 0 "[ . 1 . 2]" 1
1651 1 83 VAL MG1 1 84 LYS H 3.700 . 4.070 2.639 2.425 2.979 . 0 0 "[ . 1 . 2]" 1
1652 1 83 VAL MG2 1 84 LYS H 4.500 . 4.950 4.109 4.023 4.222 . 0 0 "[ . 1 . 2]" 1
1653 1 84 LYS H 1 84 LYS HB2 4.180 . 4.600 2.852 2.517 3.827 . 0 0 "[ . 1 . 2]" 1
1654 1 84 LYS H 1 84 LYS QB 3.530 . 3.880 2.660 2.477 3.110 . 0 0 "[ . 1 . 2]" 1
1655 1 84 LYS H 1 84 LYS HB3 4.180 . 4.600 3.645 2.995 3.837 . 0 0 "[ . 1 . 2]" 1
1656 1 84 LYS H 1 84 LYS QD 4.570 . 5.030 4.186 3.683 4.458 . 0 0 "[ . 1 . 2]" 1
1657 1 84 LYS H 1 84 LYS QG 3.900 . 4.290 2.685 2.066 3.032 . 0 0 "[ . 1 . 2]" 1
1658 1 84 LYS H 1 85 VAL H 4.800 . 5.280 4.516 4.470 4.549 . 0 0 "[ . 1 . 2]" 1
1659 1 84 LYS HA 1 84 LYS QE 4.300 . 4.730 4.310 3.872 4.869 0.139 15 0 "[ . 1 . 2]" 1
1660 1 84 LYS HA 1 85 VAL H 2.870 . 3.160 2.356 2.261 2.595 . 0 0 "[ . 1 . 2]" 1
1661 1 84 LYS HA 1 85 VAL HB 5.050 . 5.560 4.907 4.728 5.063 . 0 0 "[ . 1 . 2]" 1
1662 1 84 LYS HA 1 85 VAL MG2 3.780 . 4.160 3.388 3.183 3.520 . 0 0 "[ . 1 . 2]" 1
1663 1 84 LYS QB 1 84 LYS QD 3.180 . 3.500 2.280 2.126 2.388 . 0 0 "[ . 1 . 2]" 1
1664 1 84 LYS QB 1 85 VAL H 3.750 . 4.130 2.571 2.153 2.867 . 0 0 "[ . 1 . 2]" 1
1665 1 84 LYS QB 1 85 VAL MG1 5.340 . 5.870 5.320 5.155 5.450 . 0 0 "[ . 1 . 2]" 1
1666 1 84 LYS QB 1 85 VAL MG2 5.270 . 5.800 4.188 3.893 4.458 . 0 0 "[ . 1 . 2]" 1
1667 1 84 LYS HB2 1 84 LYS QD 3.730 . 4.100 2.533 2.369 3.167 . 0 0 "[ . 1 . 2]" 1
1668 1 84 LYS HB2 1 84 LYS QE 4.820 . 5.300 3.219 1.933 4.005 . 0 0 "[ . 1 . 2]" 1
1669 1 84 LYS HB2 1 85 VAL H 4.600 . 5.060 3.518 2.398 4.046 . 0 0 "[ . 1 . 2]" 1
1670 1 84 LYS HB3 1 84 LYS QD 3.730 . 4.100 2.690 2.339 3.039 . 0 0 "[ . 1 . 2]" 1
1671 1 84 LYS HB3 1 84 LYS QE 4.820 . 5.300 2.844 1.947 4.214 . 0 0 "[ . 1 . 2]" 1
1672 1 84 LYS HB3 1 85 VAL H 4.600 . 5.060 2.873 2.179 3.845 . 0 0 "[ . 1 . 2]" 1
1673 1 84 LYS QD 1 85 VAL H 5.500 . 6.050 5.011 4.211 5.426 . 0 0 "[ . 1 . 2]" 1
1674 1 84 LYS QE 1 84 LYS QG 3.280 . 3.610 2.395 2.150 2.833 . 0 0 "[ . 1 . 2]" 1
1675 1 84 LYS QG 1 85 VAL H 4.730 . 5.200 3.911 3.568 4.052 . 0 0 "[ . 1 . 2]" 1
1676 1 85 VAL H 1 85 VAL HB 3.320 . 3.650 2.613 2.475 2.696 . 0 0 "[ . 1 . 2]" 1
1677 1 85 VAL H 1 85 VAL MG1 3.930 . 4.320 3.814 3.763 3.861 . 0 0 "[ . 1 . 2]" 1
1678 1 85 VAL H 1 85 VAL MG2 3.130 . 3.440 2.125 1.968 2.360 . 0 0 "[ . 1 . 2]" 1
1679 1 85 VAL H 1 86 ARG H 4.650 . 5.120 4.601 4.420 4.666 . 0 0 "[ . 1 . 2]" 1
1680 1 85 VAL HA 1 85 VAL MG1 3.180 . 3.500 2.365 2.316 2.429 . 0 0 "[ . 1 . 2]" 1
1681 1 85 VAL HA 1 85 VAL MG2 3.550 . 3.900 2.470 2.396 2.543 . 0 0 "[ . 1 . 2]" 1
1682 1 85 VAL HA 1 86 ARG H 2.820 . 3.100 2.265 2.164 2.418 . 0 0 "[ . 1 . 2]" 1
1683 1 85 VAL HA 1 86 ARG QG 4.590 . 5.050 4.053 3.661 5.078 0.028 20 0 "[ . 1 . 2]" 1
1684 1 85 VAL HB 1 86 ARG H 4.120 . 4.530 3.877 3.579 4.239 . 0 0 "[ . 1 . 2]" 1
1685 1 85 VAL MG1 1 86 ARG H 3.380 . 3.720 2.285 1.888 2.859 . 0 0 "[ . 1 . 2]" 1
1686 1 85 VAL MG1 1 87 GLU H 5.170 . 5.690 3.771 1.731 5.045 0.069 1 0 "[ . 1 . 2]" 1
1687 1 86 ARG H 1 86 ARG HB2 3.700 . 4.070 3.231 2.333 3.929 . 0 0 "[ . 1 . 2]" 1
1688 1 86 ARG H 1 86 ARG QB 3.130 . 3.440 2.633 2.305 3.270 . 0 0 "[ . 1 . 2]" 1
1689 1 86 ARG H 1 86 ARG HB3 3.700 . 4.070 3.141 2.557 3.664 . 0 0 "[ . 1 . 2]" 1
1690 1 86 ARG H 1 86 ARG QD 4.330 . 4.760 3.798 1.794 4.561 0.006 8 0 "[ . 1 . 2]" 1
1691 1 86 ARG H 1 86 ARG HG2 4.160 . 4.580 2.685 1.934 4.016 . 0 0 "[ . 1 . 2]" 1
1692 1 86 ARG H 1 86 ARG QG 3.420 . 3.760 2.361 1.795 3.354 0.005 12 0 "[ . 1 . 2]" 1
1693 1 86 ARG H 1 86 ARG HG3 4.160 . 4.580 3.131 1.802 4.027 . 0 0 "[ . 1 . 2]" 1
1694 1 86 ARG H 1 87 GLU H 4.780 . 5.260 3.696 1.856 4.656 . 0 0 "[ . 1 . 2]" 1
1695 1 86 ARG HA 1 86 ARG QD 4.280 . 4.710 3.843 2.061 4.565 . 0 0 "[ . 1 . 2]" 1
1696 1 86 ARG HA 1 86 ARG HG2 4.120 . 4.530 3.460 2.451 4.229 . 0 0 "[ . 1 . 2]" 1
1697 1 86 ARG HA 1 86 ARG HG3 4.120 . 4.530 3.601 2.382 4.210 . 0 0 "[ . 1 . 2]" 1
1698 1 86 ARG HA 1 87 GLU H 3.530 . 3.880 2.821 2.159 3.565 . 0 0 "[ . 1 . 2]" 1
1699 1 86 ARG HA 1 87 GLU QG 4.970 . 5.470 4.190 3.442 5.476 0.006 4 0 "[ . 1 . 2]" 1
1700 1 86 ARG QB 1 86 ARG QD 3.240 . 3.560 2.278 2.114 2.808 . 0 0 "[ . 1 . 2]" 1
1701 1 86 ARG QB 1 87 GLU H 3.830 . 4.210 2.902 1.884 3.903 . 0 0 "[ . 1 . 2]" 1
1702 1 86 ARG HB2 1 86 ARG QD 3.710 . 4.080 2.625 2.286 3.539 . 0 0 "[ . 1 . 2]" 1
1703 1 86 ARG HB2 1 87 GLU H 4.580 . 5.040 3.410 2.019 4.309 . 0 0 "[ . 1 . 2]" 1
1704 1 86 ARG HB3 1 86 ARG QD 3.710 . 4.080 2.662 2.271 3.335 . 0 0 "[ . 1 . 2]" 1
1705 1 86 ARG HB3 1 87 GLU H 4.580 . 5.040 3.513 1.906 4.462 . 0 0 "[ . 1 . 2]" 1
1706 1 86 ARG QD 1 87 GLU H 4.680 . 5.150 4.267 3.363 5.187 0.037 1 0 "[ . 1 . 2]" 1
1707 1 86 ARG QG 1 87 GLU H 3.980 . 4.380 3.383 1.870 4.422 0.042 14 0 "[ . 1 . 2]" 1
1708 1 86 ARG HG2 1 87 GLU H 4.680 . 5.150 4.068 2.445 5.126 . 0 0 "[ . 1 . 2]" 1
1709 1 86 ARG HG3 1 87 GLU H 4.680 . 5.150 3.786 1.888 5.155 0.005 14 0 "[ . 1 . 2]" 1
1710 1 87 GLU H 1 87 GLU HB2 3.810 . 4.190 2.841 2.412 3.947 . 0 0 "[ . 1 . 2]" 1
1711 1 87 GLU H 1 87 GLU QB 3.090 . 3.400 2.601 2.377 3.201 . 0 0 "[ . 1 . 2]" 1
1712 1 87 GLU H 1 87 GLU HB3 3.810 . 4.190 3.519 2.666 3.899 . 0 0 "[ . 1 . 2]" 1
1713 1 87 GLU H 1 87 GLU QG 3.590 . 3.950 2.515 1.879 3.397 . 0 0 "[ . 1 . 2]" 1
1714 1 87 GLU HA 1 88 GLU H 3.170 . 3.490 2.374 2.105 3.393 . 0 0 "[ . 1 . 2]" 1
1715 1 87 GLU HB2 1 88 GLU H 4.160 . 4.580 3.876 2.620 4.537 . 0 0 "[ . 1 . 2]" 1
1716 1 87 GLU HB3 1 88 GLU H 4.160 . 4.580 3.741 2.034 4.482 . 0 0 "[ . 1 . 2]" 1
1717 1 88 GLU H 1 88 GLU QG 3.650 . 4.020 2.699 1.977 4.063 0.043 12 0 "[ . 1 . 2]" 1
1718 1 88 GLU H 1 89 VAL H 4.390 . 4.830 4.215 2.429 4.653 . 0 0 "[ . 1 . 2]" 1
1719 1 88 GLU HA 1 88 GLU QG 3.630 . 3.990 2.866 2.366 3.537 . 0 0 "[ . 1 . 2]" 1
1720 1 88 GLU HA 1 89 VAL H 2.730 . 3.000 2.382 2.162 3.052 0.052 6 0 "[ . 1 . 2]" 1
1721 1 88 GLU HA 1 89 VAL MG1 5.300 . 5.830 4.348 3.362 5.619 . 0 0 "[ . 1 . 2]" 1
1722 1 88 GLU HA 1 89 VAL QG 4.530 . 4.980 3.522 3.152 4.149 . 0 0 "[ . 1 . 2]" 1
1723 1 88 GLU HA 1 89 VAL MG2 5.300 . 5.830 4.082 3.253 5.529 . 0 0 "[ . 1 . 2]" 1
1724 1 88 GLU HB2 1 89 VAL H 4.470 . 4.920 3.569 2.196 4.573 . 0 0 "[ . 1 . 2]" 1
1725 1 88 GLU HB3 1 89 VAL H 4.470 . 4.920 3.693 2.085 4.554 . 0 0 "[ . 1 . 2]" 1
1726 1 88 GLU QG 1 89 VAL H 4.560 . 5.020 4.009 2.560 4.607 . 0 0 "[ . 1 . 2]" 1
1727 1 89 VAL H 1 89 VAL HB 3.870 . 4.260 3.234 2.533 3.852 . 0 0 "[ . 1 . 2]" 1
1728 1 89 VAL H 1 89 VAL MG1 3.840 . 4.220 2.875 1.864 3.881 . 0 0 "[ . 1 . 2]" 1
1729 1 89 VAL H 1 89 VAL QG 3.340 . 3.670 2.046 1.815 2.626 . 0 0 "[ . 1 . 2]" 1
1730 1 89 VAL H 1 89 VAL MG2 3.840 . 4.220 2.374 1.869 3.863 . 0 0 "[ . 1 . 2]" 1
1731 1 89 VAL H 1 90 LYS H 4.590 . 5.050 4.345 2.429 4.637 . 0 0 "[ . 1 . 2]" 1
1732 1 89 VAL HA 1 90 LYS H 2.790 . 3.070 2.328 2.132 2.909 . 0 0 "[ . 1 . 2]" 1
1733 1 89 VAL HB 1 90 LYS H 4.370 . 4.810 3.507 1.957 4.454 . 0 0 "[ . 1 . 2]" 1
1734 1 89 VAL QG 1 90 LYS H 4.030 . 4.430 3.013 2.381 3.780 . 0 0 "[ . 1 . 2]" 1
1735 1 89 VAL MG1 1 90 LYS H 4.650 . 5.120 3.551 2.406 4.393 . 0 0 "[ . 1 . 2]" 1
1736 1 89 VAL MG2 1 90 LYS H 4.650 . 5.120 3.601 2.402 4.274 . 0 0 "[ . 1 . 2]" 1
1737 1 90 LYS H 1 90 LYS HB2 3.910 . 4.300 3.227 2.432 3.893 . 0 0 "[ . 1 . 2]" 1
1738 1 90 LYS H 1 90 LYS QB 3.260 . 3.590 2.649 2.399 3.108 . 0 0 "[ . 1 . 2]" 1
1739 1 90 LYS H 1 90 LYS HB3 3.910 . 4.300 3.175 2.603 3.892 . 0 0 "[ . 1 . 2]" 1
1740 1 90 LYS H 1 90 LYS QD 4.030 . 4.430 4.018 3.534 4.511 0.081 6 0 "[ . 1 . 2]" 1
1741 1 90 LYS H 1 90 LYS HG2 4.320 . 4.750 2.775 1.908 4.449 . 0 0 "[ . 1 . 2]" 1
1742 1 90 LYS H 1 90 LYS HG3 4.320 . 4.750 2.937 2.208 3.517 . 0 0 "[ . 1 . 2]" 1
1743 1 90 LYS HA 1 91 ASN H 3.490 . 3.840 2.617 2.144 3.567 . 0 0 "[ . 1 . 2]" 1
1744 1 90 LYS QB 1 90 LYS QD 2.390 . 2.630 2.197 2.118 2.366 . 0 0 "[ . 1 . 2]" 1
1745 1 90 LYS HB2 1 90 LYS QD 2.770 . 3.050 2.445 2.254 3.045 . 0 0 "[ . 1 . 2]" 1
1746 1 90 LYS HB2 1 91 ASN H 4.790 . 5.270 3.672 1.975 4.508 . 0 0 "[ . 1 . 2]" 1
1747 1 90 LYS HB3 1 90 LYS QD 2.770 . 3.050 2.535 2.332 2.955 . 0 0 "[ . 1 . 2]" 1
1748 1 90 LYS HB3 1 91 ASN H 4.790 . 5.270 3.982 2.952 4.546 . 0 0 "[ . 1 . 2]" 1
1749 1 91 ASN HA 1 92 ASP H 3.210 . 3.530 2.470 2.145 3.322 . 0 0 "[ . 1 . 2]" 1
1750 1 92 ASP H 1 92 ASP QB 3.680 . 4.050 2.505 2.255 3.022 . 0 0 "[ . 1 . 2]" 1
1751 1 92 ASP H 1 93 LYS H 4.100 . 4.510 3.655 2.374 4.596 0.086 18 0 "[ . 1 . 2]" 1
1752 1 92 ASP HA 1 93 LYS H 3.130 . 3.440 2.606 2.134 3.477 0.037 13 0 "[ . 1 . 2]" 1
1753 1 92 ASP QB 1 93 LYS H 4.090 . 4.500 3.726 3.094 4.045 . 0 0 "[ . 1 . 2]" 1
1754 1 93 LYS H 1 93 LYS HB2 4.080 . 4.490 3.228 2.342 3.904 . 0 0 "[ . 1 . 2]" 1
1755 1 93 LYS H 1 93 LYS QB 3.530 . 3.880 2.882 2.314 3.375 . 0 0 "[ . 1 . 2]" 1
1756 1 93 LYS H 1 93 LYS HB3 4.080 . 4.490 3.490 2.549 4.102 . 0 0 "[ . 1 . 2]" 1
1757 1 93 LYS H 1 93 LYS HG2 5.310 . 5.840 3.621 2.093 5.166 . 0 0 "[ . 1 . 2]" 1
1758 1 93 LYS H 1 93 LYS QG 4.580 . 5.040 3.184 2.070 4.439 . 0 0 "[ . 1 . 2]" 1
1759 1 93 LYS H 1 93 LYS HG3 5.310 . 5.840 3.824 2.104 4.899 . 0 0 "[ . 1 . 2]" 1
1760 1 93 LYS HA 1 94 PRO HD2 3.370 . 3.710 2.407 1.947 2.893 . 0 0 "[ . 1 . 2]" 1
1761 1 93 LYS HA 1 94 PRO QD 2.940 . 3.230 2.090 1.865 2.394 . 0 0 "[ . 1 . 2]" 1
1762 1 93 LYS HA 1 94 PRO HD3 3.370 . 3.710 2.419 1.888 2.878 . 0 0 "[ . 1 . 2]" 1
1763 1 93 LYS QB 1 93 LYS QD 2.620 . 2.880 2.367 2.110 2.857 . 0 0 "[ . 1 . 2]" 1
1764 1 93 LYS QB 1 94 PRO QD 4.210 . 4.630 3.181 1.945 3.901 . 0 0 "[ . 1 . 2]" 1
1765 1 94 PRO HA 1 95 ILE H 2.860 . 3.150 2.331 2.158 2.799 . 0 0 "[ . 1 . 2]" 1
1766 1 94 PRO HB2 1 95 ILE H 4.470 . 4.920 3.870 1.992 4.350 . 0 0 "[ . 1 . 2]" 1
1767 1 94 PRO HB3 1 95 ILE H 4.470 . 4.920 4.146 3.296 4.679 . 0 0 "[ . 1 . 2]" 1
1768 1 95 ILE H 1 95 ILE MD 4.700 . 5.170 3.540 1.792 4.349 0.008 5 0 "[ . 1 . 2]" 1
1769 1 95 ILE H 1 95 ILE HG12 3.990 . 4.390 2.825 1.898 3.859 . 0 0 "[ . 1 . 2]" 1
1770 1 95 ILE H 1 95 ILE HG13 3.990 . 4.390 2.773 1.794 3.761 0.006 10 0 "[ . 1 . 2]" 1
1771 1 95 ILE H 1 95 ILE MG 4.170 . 4.590 3.299 2.314 4.057 . 0 0 "[ . 1 . 2]" 1
1772 1 95 ILE HA 1 96 LEU H 2.930 . 3.220 2.497 2.144 3.258 0.038 1 0 "[ . 1 . 2]" 1
1773 1 95 ILE HB 1 96 LEU H 4.420 . 4.860 3.978 2.145 4.502 . 0 0 "[ . 1 . 2]" 1
1774 1 95 ILE QG 1 95 ILE MG 3.180 . 3.500 2.328 2.111 2.382 . 0 0 "[ . 1 . 2]" 1
1775 1 95 ILE MG 1 96 LEU H 4.320 . 4.750 3.643 2.560 4.401 . 0 0 "[ . 1 . 2]" 1
1776 1 96 LEU H 1 96 LEU HB2 4.120 . 4.530 2.841 2.270 3.843 . 0 0 "[ . 1 . 2]" 1
1777 1 96 LEU H 1 96 LEU QB 3.610 . 3.970 2.514 2.160 3.237 . 0 0 "[ . 1 . 2]" 1
1778 1 96 LEU H 1 96 LEU HB3 4.120 . 4.530 3.057 2.390 3.696 . 0 0 "[ . 1 . 2]" 1
1779 1 96 LEU H 1 96 LEU MD1 5.200 . 5.720 3.833 2.006 4.392 . 0 0 "[ . 1 . 2]" 1
1780 1 96 LEU H 1 96 LEU QD 4.390 . 4.830 3.329 1.755 4.111 0.045 16 0 "[ . 1 . 2]" 1
1781 1 96 LEU H 1 96 LEU MD2 5.200 . 5.720 3.917 1.758 5.001 0.042 16 0 "[ . 1 . 2]" 1
1782 1 96 LEU H 1 96 LEU HG 4.590 . 5.050 3.692 2.014 4.928 . 0 0 "[ . 1 . 2]" 1
1783 1 96 LEU HA 1 96 LEU QD 3.700 . 4.070 2.277 1.923 3.419 . 0 0 "[ . 1 . 2]" 1
1784 1 96 LEU HA 1 96 LEU HG 4.040 . 4.440 3.262 2.534 3.755 . 0 0 "[ . 1 . 2]" 1
1785 1 96 LEU HA 1 97 GLU H 3.130 . 3.440 2.441 2.125 3.451 0.011 6 0 "[ . 1 . 2]" 1
1786 1 96 LEU QB 1 97 GLU H 4.120 . 4.530 3.442 2.070 4.057 . 0 0 "[ . 1 . 2]" 1
1787 1 96 LEU QD 1 97 GLU H 4.430 . 4.870 3.172 2.027 4.388 . 0 0 "[ . 1 . 2]" 1
1788 1 96 LEU HG 1 97 GLU H 5.500 . 6.050 4.332 2.596 5.281 . 0 0 "[ . 1 . 2]" 1
1789 1 97 GLU H 1 97 GLU HB2 4.150 . 4.570 2.777 2.427 3.642 . 0 0 "[ . 1 . 2]" 1
1790 1 97 GLU H 1 97 GLU QB 3.480 . 3.830 2.500 2.241 3.266 . 0 0 "[ . 1 . 2]" 1
1791 1 97 GLU H 1 97 GLU HB3 4.150 . 4.570 3.206 2.439 4.019 . 0 0 "[ . 1 . 2]" 1
1792 1 97 GLU H 1 97 GLU HG2 4.840 . 5.320 3.677 1.834 4.728 . 0 0 "[ . 1 . 2]" 1
1793 1 97 GLU H 1 97 GLU QG 4.220 . 4.640 3.024 1.820 4.139 . 0 0 "[ . 1 . 2]" 1
1794 1 97 GLU H 1 97 GLU HG3 4.840 . 5.320 3.543 2.272 4.784 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Saturday, April 20, 2024 11:36:22 AM GMT (wattos1)