NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
583257 |
2mja   |
19713 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mja
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 2185
_Distance_constraint_stats_list.Viol_count 3043
_Distance_constraint_stats_list.Viol_total 2608.750
_Distance_constraint_stats_list.Viol_max 0.406
_Distance_constraint_stats_list.Viol_rms 0.0158
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0030
_Distance_constraint_stats_list.Viol_average_violations_only 0.0429
_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 1 MET 6.271 0.232 18 0 "[ . 1 . 2]"
1 2 LEU 2.472 0.101 12 0 "[ . 1 . 2]"
1 3 MET 7.399 0.181 16 0 "[ . 1 . 2]"
1 4 ILE 5.827 0.269 12 0 "[ . 1 . 2]"
1 5 THR 0.158 0.104 12 0 "[ . 1 . 2]"
1 6 SER 0.307 0.149 12 0 "[ . 1 . 2]"
1 7 PHE 1.493 0.104 12 0 "[ . 1 . 2]"
1 8 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 ASN 0.765 0.063 9 0 "[ . 1 . 2]"
1 10 PRO 0.659 0.081 6 0 "[ . 1 . 2]"
1 11 ARG 1.116 0.406 16 0 "[ . 1 . 2]"
1 12 VAL 1.556 0.406 16 0 "[ . 1 . 2]"
1 13 ALA 1.734 0.081 6 0 "[ . 1 . 2]"
1 14 GLN 1.759 0.204 19 0 "[ . 1 . 2]"
1 15 ALA 1.922 0.293 3 0 "[ . 1 . 2]"
1 16 PHE 0.976 0.084 9 0 "[ . 1 . 2]"
1 17 VAL 5.289 0.300 19 0 "[ . 1 . 2]"
1 18 ASP 0.135 0.135 19 0 "[ . 1 . 2]"
1 19 TYR 3.831 0.317 8 0 "[ . 1 . 2]"
1 20 MET 4.194 0.317 8 0 "[ . 1 . 2]"
1 21 ALA 0.607 0.064 1 0 "[ . 1 . 2]"
1 22 THR 0.101 0.014 5 0 "[ . 1 . 2]"
1 23 GLN 0.129 0.014 5 0 "[ . 1 . 2]"
1 24 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 VAL 3.396 0.151 13 0 "[ . 1 . 2]"
1 26 ILE 1.248 0.064 1 0 "[ . 1 . 2]"
1 27 LEU 1.927 0.080 18 0 "[ . 1 . 2]"
1 28 THR 3.468 0.163 17 0 "[ . 1 . 2]"
1 29 ILE 3.114 0.300 19 0 "[ . 1 . 2]"
1 30 GLN 1.812 0.127 12 0 "[ . 1 . 2]"
1 31 GLN 1.982 0.150 2 0 "[ . 1 . 2]"
1 32 HIS 1.910 0.150 2 0 "[ . 1 . 2]"
1 33 ASN 0.066 0.024 5 0 "[ . 1 . 2]"
1 34 GLN 0.099 0.024 5 0 "[ . 1 . 2]"
1 35 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 ASP 3.192 0.152 18 0 "[ . 1 . 2]"
1 37 VAL 0.850 0.053 4 0 "[ . 1 . 2]"
1 38 TRP 7.397 0.207 12 0 "[ . 1 . 2]"
1 39 LEU 5.069 0.184 19 0 "[ . 1 . 2]"
1 40 ALA 2.608 0.090 14 0 "[ . 1 . 2]"
1 41 ASP 0.058 0.022 20 0 "[ . 1 . 2]"
1 42 GLU 2.855 0.124 1 0 "[ . 1 . 2]"
1 43 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 GLN 1.490 0.107 19 0 "[ . 1 . 2]"
1 45 ALA 1.170 0.089 2 0 "[ . 1 . 2]"
1 46 GLU 0.070 0.029 7 0 "[ . 1 . 2]"
1 47 ARG 0.484 0.063 15 0 "[ . 1 . 2]"
1 48 VAL 3.634 0.089 2 0 "[ . 1 . 2]"
1 49 ARG 2.520 0.085 5 0 "[ . 1 . 2]"
1 50 ALA 0.015 0.015 15 0 "[ . 1 . 2]"
1 51 GLU 1.649 0.166 1 0 "[ . 1 . 2]"
1 52 LEU 4.231 0.182 2 0 "[ . 1 . 2]"
1 53 ALA 0.793 0.106 10 0 "[ . 1 . 2]"
1 54 ARG 0.047 0.020 1 0 "[ . 1 . 2]"
1 55 PHE 4.214 0.177 11 0 "[ . 1 . 2]"
1 56 LEU 1.177 0.208 9 0 "[ . 1 . 2]"
1 57 GLU 1.521 0.114 19 0 "[ . 1 . 2]"
1 58 ASN 2.841 0.132 19 0 "[ . 1 . 2]"
1 59 PRO 0.002 0.002 18 0 "[ . 1 . 2]"
1 60 ALA 0.430 0.099 9 0 "[ . 1 . 2]"
1 61 ASP 0.765 0.099 9 0 "[ . 1 . 2]"
1 62 LEU 4.799 0.177 11 0 "[ . 1 . 2]"
1 63 GLU 1.756 0.198 11 0 "[ . 1 . 2]"
2 1 MET 6.283 0.207 12 0 "[ . 1 . 2]"
2 2 LEU 2.057 0.071 16 0 "[ . 1 . 2]"
2 3 MET 7.666 0.188 16 0 "[ . 1 . 2]"
2 4 ILE 5.800 0.188 16 0 "[ . 1 . 2]"
2 5 THR 0.100 0.022 8 0 "[ . 1 . 2]"
2 6 SER 0.142 0.022 8 0 "[ . 1 . 2]"
2 7 PHE 1.401 0.059 18 0 "[ . 1 . 2]"
2 8 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 9 ASN 0.759 0.071 10 0 "[ . 1 . 2]"
2 10 PRO 0.636 0.064 4 0 "[ . 1 . 2]"
2 11 ARG 0.988 0.134 6 0 "[ . 1 . 2]"
2 12 VAL 2.340 0.134 6 0 "[ . 1 . 2]"
2 13 ALA 1.146 0.071 3 0 "[ . 1 . 2]"
2 14 GLN 1.307 0.130 14 0 "[ . 1 . 2]"
2 15 ALA 0.569 0.263 11 0 "[ . 1 . 2]"
2 16 PHE 1.316 0.120 5 0 "[ . 1 . 2]"
2 17 VAL 2.501 0.263 11 0 "[ . 1 . 2]"
2 18 ASP 0.002 0.002 13 0 "[ . 1 . 2]"
2 19 TYR 3.577 0.310 11 0 "[ . 1 . 2]"
2 20 MET 2.804 0.310 11 0 "[ . 1 . 2]"
2 21 ALA 0.590 0.061 1 0 "[ . 1 . 2]"
2 22 THR 0.119 0.023 5 0 "[ . 1 . 2]"
2 23 GLN 0.052 0.012 11 0 "[ . 1 . 2]"
2 24 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 25 VAL 3.852 0.166 1 0 "[ . 1 . 2]"
2 26 ILE 0.869 0.061 1 0 "[ . 1 . 2]"
2 27 LEU 2.617 0.156 15 0 "[ . 1 . 2]"
2 28 THR 2.794 0.140 14 0 "[ . 1 . 2]"
2 29 ILE 2.996 0.101 6 0 "[ . 1 . 2]"
2 30 GLN 1.818 0.106 14 0 "[ . 1 . 2]"
2 31 GLN 1.880 0.084 15 0 "[ . 1 . 2]"
2 32 HIS 1.863 0.085 13 0 "[ . 1 . 2]"
2 33 ASN 0.075 0.039 15 0 "[ . 1 . 2]"
2 34 GLN 0.082 0.039 15 0 "[ . 1 . 2]"
2 35 SER 0.418 0.054 3 0 "[ . 1 . 2]"
2 36 ASP 3.052 0.145 2 0 "[ . 1 . 2]"
2 37 VAL 1.446 0.269 12 0 "[ . 1 . 2]"
2 38 TRP 7.630 0.232 18 0 "[ . 1 . 2]"
2 39 LEU 7.107 0.183 4 0 "[ . 1 . 2]"
2 40 ALA 2.239 0.104 14 0 "[ . 1 . 2]"
2 41 ASP 0.136 0.057 19 0 "[ . 1 . 2]"
2 42 GLU 3.275 0.166 9 0 "[ . 1 . 2]"
2 43 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 44 GLN 2.219 0.155 15 0 "[ . 1 . 2]"
2 45 ALA 1.555 0.126 19 0 "[ . 1 . 2]"
2 46 GLU 0.124 0.044 12 0 "[ . 1 . 2]"
2 47 ARG 4.269 0.169 19 0 "[ . 1 . 2]"
2 48 VAL 4.165 0.126 19 0 "[ . 1 . 2]"
2 49 ARG 2.062 0.089 12 0 "[ . 1 . 2]"
2 50 ALA 0.068 0.026 15 0 "[ . 1 . 2]"
2 51 GLU 1.358 0.151 13 0 "[ . 1 . 2]"
2 52 LEU 3.347 0.186 11 0 "[ . 1 . 2]"
2 53 ALA 0.634 0.084 9 0 "[ . 1 . 2]"
2 54 ARG 0.036 0.014 13 0 "[ . 1 . 2]"
2 55 PHE 4.000 0.178 9 0 "[ . 1 . 2]"
2 56 LEU 0.835 0.203 9 0 "[ . 1 . 2]"
2 57 GLU 1.720 0.091 8 0 "[ . 1 . 2]"
2 58 ASN 3.028 0.125 15 0 "[ . 1 . 2]"
2 59 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
2 60 ALA 0.467 0.097 9 0 "[ . 1 . 2]"
2 61 ASP 1.452 0.159 10 0 "[ . 1 . 2]"
2 62 LEU 6.120 0.178 9 0 "[ . 1 . 2]"
2 63 GLU 3.731 0.205 11 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 1 MET HB3 1 1 MET ME . . 2.650 2.213 2.069 2.298 . 0 0 "[ . 1 . 2]" 1
2 1 1 MET HB3 1 1 MET HG2 . . 2.820 2.821 2.783 2.836 0.016 5 0 "[ . 1 . 2]" 1
3 1 1 MET HB3 2 38 TRP HA . . 5.500 5.570 5.536 5.597 0.097 6 0 "[ . 1 . 2]" 1
4 1 1 MET HB3 2 38 TRP HB2 . . 3.660 3.433 3.191 3.504 . 0 0 "[ . 1 . 2]" 1
5 1 1 MET ME 1 1 MET HG2 . . 2.990 2.432 2.396 2.518 . 0 0 "[ . 1 . 2]" 1
6 1 1 MET ME 1 28 THR HB . . 4.100 4.030 3.758 4.121 0.021 13 0 "[ . 1 . 2]" 1
7 1 1 MET ME 1 28 THR MG . . 3.980 3.997 3.726 4.076 0.096 14 0 "[ . 1 . 2]" 1
8 1 1 MET ME 2 38 TRP HA . . 4.800 4.363 4.280 4.637 . 0 0 "[ . 1 . 2]" 1
9 1 1 MET ME 2 38 TRP HB2 . . 3.200 2.349 2.257 2.752 . 0 0 "[ . 1 . 2]" 1
10 1 1 MET ME 2 38 TRP HD1 . . 5.500 5.618 5.584 5.732 0.232 18 0 "[ . 1 . 2]" 1
11 1 1 MET ME 2 38 TRP HZ3 . . 3.390 3.349 3.091 3.426 0.036 13 0 "[ . 1 . 2]" 1
12 1 1 MET ME 2 39 LEU HA . . 4.200 3.258 3.131 3.428 . 0 0 "[ . 1 . 2]" 1
13 1 1 MET ME 2 40 ALA HA . . 3.110 1.934 1.903 1.994 . 0 0 "[ . 1 . 2]" 1
14 1 1 MET ME 2 40 ALA MB . . 2.620 2.190 1.920 2.291 . 0 0 "[ . 1 . 2]" 1
15 1 1 MET HG2 2 40 ALA HA . . 2.860 2.918 2.878 2.940 0.080 5 0 "[ . 1 . 2]" 1
16 1 1 MET HG2 2 40 ALA MB . . 3.160 3.005 2.842 3.095 . 0 0 "[ . 1 . 2]" 1
17 1 2 LEU H 1 2 LEU HG . . 5.500 4.449 4.312 4.593 . 0 0 "[ . 1 . 2]" 1
18 1 2 LEU H 2 39 LEU H . . 3.970 3.324 3.272 3.397 . 0 0 "[ . 1 . 2]" 1
19 1 2 LEU H 2 39 LEU HB3 . . 4.920 3.811 3.697 3.916 . 0 0 "[ . 1 . 2]" 1
20 1 2 LEU HA 1 2 LEU HB2 . . 2.870 2.596 2.371 2.735 . 0 0 "[ . 1 . 2]" 1
21 1 2 LEU HA 1 2 LEU QD . . 2.990 2.295 2.125 2.583 . 0 0 "[ . 1 . 2]" 1
22 1 2 LEU HA 1 2 LEU HG . . 3.440 2.800 2.409 3.312 . 0 0 "[ . 1 . 2]" 1
23 1 2 LEU HA 1 3 MET H . . 3.050 2.142 2.140 2.146 . 0 0 "[ . 1 . 2]" 1
24 1 2 LEU HA 1 3 MET HA . . 5.500 4.375 4.364 4.384 . 0 0 "[ . 1 . 2]" 1
25 1 2 LEU HA 2 42 GLU QG . . 5.340 4.766 4.526 5.000 . 0 0 "[ . 1 . 2]" 1
26 1 2 LEU HB2 1 2 LEU MD1 . . 3.480 2.294 2.245 2.383 . 0 0 "[ . 1 . 2]" 1
27 1 2 LEU HB2 1 2 LEU QD . . 2.860 2.168 2.033 2.282 . 0 0 "[ . 1 . 2]" 1
28 1 2 LEU HB2 1 2 LEU MD2 . . 3.480 2.871 2.245 3.192 . 0 0 "[ . 1 . 2]" 1
29 1 2 LEU HB2 1 3 MET H . . 4.560 4.397 4.169 4.517 . 0 0 "[ . 1 . 2]" 1
30 1 2 LEU HB2 2 42 GLU HA . . 4.950 3.787 3.506 4.200 . 0 0 "[ . 1 . 2]" 1
31 1 2 LEU HB2 2 42 GLU HB2 . . 5.500 5.470 5.244 5.552 0.052 19 0 "[ . 1 . 2]" 1
32 1 2 LEU HB2 2 42 GLU QG . . 3.260 2.613 2.341 2.863 . 0 0 "[ . 1 . 2]" 1
33 1 2 LEU HB3 1 2 LEU MD1 . . 3.360 2.660 2.296 3.192 . 0 0 "[ . 1 . 2]" 1
34 1 2 LEU HB3 1 2 LEU QD . . 2.780 2.162 2.032 2.309 . 0 0 "[ . 1 . 2]" 1
35 1 2 LEU HB3 1 2 LEU MD2 . . 3.360 2.336 2.212 2.398 . 0 0 "[ . 1 . 2]" 1
36 1 2 LEU HB3 2 39 LEU MD2 . . 4.150 4.180 4.083 4.251 0.101 12 0 "[ . 1 . 2]" 1
37 1 2 LEU HB3 2 42 GLU HA . . 4.560 3.792 3.312 4.140 . 0 0 "[ . 1 . 2]" 1
38 1 2 LEU HB3 2 42 GLU QG . . 4.560 3.622 2.814 4.186 . 0 0 "[ . 1 . 2]" 1
39 1 2 LEU HB3 2 45 ALA HA . . 5.500 5.063 4.921 5.260 . 0 0 "[ . 1 . 2]" 1
40 1 2 LEU QD 1 3 MET H . . 5.050 2.313 2.080 2.541 . 0 0 "[ . 1 . 2]" 1
41 1 2 LEU QD 1 3 MET HG2 . . 5.440 5.308 5.008 5.492 0.052 16 0 "[ . 1 . 2]" 1
42 1 2 LEU QD 1 3 MET HG3 . . 5.440 5.405 5.119 5.479 0.039 15 0 "[ . 1 . 2]" 1
43 1 2 LEU QD 2 42 GLU HA . . 3.190 3.180 3.056 3.219 0.029 9 0 "[ . 1 . 2]" 1
44 1 2 LEU QD 2 42 GLU HB2 . . 4.710 4.658 4.477 4.715 0.005 4 0 "[ . 1 . 2]" 1
45 1 2 LEU QD 2 42 GLU HB3 . . 3.340 3.363 3.341 3.401 0.061 20 0 "[ . 1 . 2]" 1
46 1 2 LEU QD 2 42 GLU QG . . 3.060 2.755 2.332 3.020 . 0 0 "[ . 1 . 2]" 1
47 1 2 LEU QD 2 45 ALA MB . . 2.640 2.409 1.913 2.617 . 0 0 "[ . 1 . 2]" 1
48 1 2 LEU QD 2 46 GLU H . . 5.440 5.291 4.950 5.484 0.044 12 0 "[ . 1 . 2]" 1
49 1 2 LEU QD 2 46 GLU QG . . 5.280 4.841 4.604 5.097 . 0 0 "[ . 1 . 2]" 1
50 1 2 LEU HG 2 42 GLU HA . . 5.470 5.376 5.122 5.536 0.066 15 0 "[ . 1 . 2]" 1
51 1 2 LEU HG 2 42 GLU QG . . 4.680 4.233 3.787 4.714 0.034 11 0 "[ . 1 . 2]" 1
52 1 3 MET H 1 3 MET QB . . 3.650 2.097 2.073 2.117 . 0 0 "[ . 1 . 2]" 1
53 1 3 MET H 1 3 MET HG2 . . 4.950 4.374 4.338 4.404 . 0 0 "[ . 1 . 2]" 1
54 1 3 MET H 1 3 MET HG3 . . 4.090 4.029 3.911 4.095 0.005 1 0 "[ . 1 . 2]" 1
55 1 3 MET HA 1 3 MET ME . . 4.530 4.173 4.081 4.285 . 0 0 "[ . 1 . 2]" 1
56 1 3 MET HA 1 3 MET HG2 . . 3.460 2.361 2.286 2.434 . 0 0 "[ . 1 . 2]" 1
57 1 3 MET HA 1 3 MET HG3 . . 3.430 2.775 2.635 2.897 . 0 0 "[ . 1 . 2]" 1
58 1 3 MET HA 1 4 ILE H . . 3.410 2.147 2.141 2.162 . 0 0 "[ . 1 . 2]" 1
59 1 3 MET HA 1 4 ILE HA . . 4.830 4.383 4.372 4.398 . 0 0 "[ . 1 . 2]" 1
60 1 3 MET HA 1 4 ILE MD . . 5.270 4.375 4.228 4.632 . 0 0 "[ . 1 . 2]" 1
61 1 3 MET HA 1 4 ILE MG . . 5.500 5.461 5.432 5.466 . 0 0 "[ . 1 . 2]" 1
62 1 3 MET HA 2 38 TRP HA . . 3.470 2.086 1.990 2.307 . 0 0 "[ . 1 . 2]" 1
63 1 3 MET HA 2 38 TRP HB2 . . 4.160 3.590 3.389 3.706 . 0 0 "[ . 1 . 2]" 1
64 1 3 MET HA 2 39 LEU H . . 4.100 3.236 3.178 3.360 . 0 0 "[ . 1 . 2]" 1
65 1 3 MET QB 1 3 MET ME . . 3.460 3.405 3.132 3.575 0.115 3 0 "[ . 1 . 2]" 1
66 1 3 MET HB2 1 3 MET ME . . 4.330 4.183 4.076 4.236 . 0 0 "[ . 1 . 2]" 1
67 1 3 MET HB2 2 38 TRP HA . . 5.000 4.737 4.598 4.997 . 0 0 "[ . 1 . 2]" 1
68 1 3 MET HB3 1 3 MET ME . . 4.330 3.613 3.255 3.860 . 0 0 "[ . 1 . 2]" 1
69 1 3 MET HB3 2 38 TRP HA . . 5.000 4.887 4.783 5.038 0.038 12 0 "[ . 1 . 2]" 1
70 1 3 MET ME 1 3 MET HG2 . . 3.510 2.113 1.986 2.236 . 0 0 "[ . 1 . 2]" 1
71 1 3 MET ME 1 3 MET HG3 . . 3.540 2.866 2.654 3.113 . 0 0 "[ . 1 . 2]" 1
72 1 3 MET ME 1 4 ILE H . . 5.500 4.198 3.853 4.495 . 0 0 "[ . 1 . 2]" 1
73 1 3 MET ME 1 5 THR HA . . 3.260 3.014 2.564 3.246 . 0 0 "[ . 1 . 2]" 1
74 1 3 MET ME 1 5 THR MG . . 4.670 4.097 3.977 4.212 . 0 0 "[ . 1 . 2]" 1
75 1 3 MET ME 1 6 SER HA . . 3.820 2.922 2.713 3.468 . 0 0 "[ . 1 . 2]" 1
76 1 3 MET ME 1 6 SER QB . . 3.040 1.992 1.850 2.304 . 0 0 "[ . 1 . 2]" 1
77 1 3 MET ME 2 36 ASP HA . . 3.770 3.061 2.831 3.409 . 0 0 "[ . 1 . 2]" 1
78 1 3 MET ME 2 36 ASP QB . . 2.930 2.715 2.231 2.967 0.037 18 0 "[ . 1 . 2]" 1
79 1 3 MET ME 2 38 TRP HA . . 5.190 4.793 4.707 4.920 . 0 0 "[ . 1 . 2]" 1
80 1 3 MET HG2 1 4 ILE HA . . 5.500 5.073 4.955 5.203 . 0 0 "[ . 1 . 2]" 1
81 1 3 MET HG2 1 4 ILE MG . . 5.500 5.622 5.576 5.681 0.181 16 0 "[ . 1 . 2]" 1
82 1 3 MET HG2 1 5 THR HA . . 4.720 4.489 4.373 4.559 . 0 0 "[ . 1 . 2]" 1
83 1 3 MET HG2 2 36 ASP QB . . 4.720 4.343 3.873 4.830 0.110 12 0 "[ . 1 . 2]" 1
84 1 3 MET HG2 2 38 TRP HA . . 3.700 3.452 3.369 3.647 . 0 0 "[ . 1 . 2]" 1
85 1 3 MET HG2 2 38 TRP HB2 . . 5.020 5.121 5.065 5.182 0.162 16 0 "[ . 1 . 2]" 1
86 1 3 MET HG3 2 36 ASP HB2 . . 5.500 5.388 5.068 5.645 0.145 2 0 "[ . 1 . 2]" 1
87 1 3 MET HG3 2 36 ASP QB . . 4.810 4.237 3.847 4.813 0.003 12 0 "[ . 1 . 2]" 1
88 1 3 MET HG3 2 36 ASP HB3 . . 5.500 4.610 3.936 5.567 0.067 8 0 "[ . 1 . 2]" 1
89 1 3 MET HG3 2 38 TRP HA . . 4.410 4.167 3.953 4.416 0.006 3 0 "[ . 1 . 2]" 1
90 1 4 ILE H 1 4 ILE MD . . 5.500 3.336 3.205 3.614 . 0 0 "[ . 1 . 2]" 1
91 1 4 ILE H 1 4 ILE HG12 . . 5.500 2.507 2.379 2.823 . 0 0 "[ . 1 . 2]" 1
92 1 4 ILE H 1 4 ILE HG13 . . 5.500 3.898 3.808 4.091 . 0 0 "[ . 1 . 2]" 1
93 1 4 ILE H 1 5 THR H . . 3.460 2.473 2.327 2.621 . 0 0 "[ . 1 . 2]" 1
94 1 4 ILE HA 1 4 ILE MD . . 2.970 2.006 1.921 2.055 . 0 0 "[ . 1 . 2]" 1
95 1 4 ILE HA 1 4 ILE HG12 . . 4.110 3.088 2.976 3.137 . 0 0 "[ . 1 . 2]" 1
96 1 4 ILE HA 1 5 THR HA . . 4.780 4.694 4.675 4.714 . 0 0 "[ . 1 . 2]" 1
97 1 4 ILE HA 2 48 VAL QG . . 4.320 3.883 3.782 4.089 . 0 0 "[ . 1 . 2]" 1
98 1 4 ILE HA 2 49 ARG HD2 . . 4.870 4.378 4.000 4.598 . 0 0 "[ . 1 . 2]" 1
99 1 4 ILE HB 1 4 ILE MD . . 3.390 3.224 3.220 3.226 . 0 0 "[ . 1 . 2]" 1
100 1 4 ILE HB 1 5 THR H . . 3.330 2.499 2.401 2.556 . 0 0 "[ . 1 . 2]" 1
101 1 4 ILE HB 1 5 THR MG . . 3.770 3.150 3.092 3.313 . 0 0 "[ . 1 . 2]" 1
102 1 4 ILE HB 2 37 VAL HA . . 5.150 4.579 4.483 5.070 . 0 0 "[ . 1 . 2]" 1
103 1 4 ILE HB 2 37 VAL HB . . 4.470 2.685 2.462 4.166 . 0 0 "[ . 1 . 2]" 1
104 1 4 ILE HB 2 37 VAL QG . . 3.350 2.192 1.784 2.494 . 0 0 "[ . 1 . 2]" 1
105 1 4 ILE HB 2 38 TRP HA . . 5.500 3.514 3.137 3.628 . 0 0 "[ . 1 . 2]" 1
106 1 4 ILE HB 2 39 LEU HA . . 5.500 5.626 5.508 5.683 0.183 4 0 "[ . 1 . 2]" 1
107 1 4 ILE HB 2 39 LEU HB2 . . 5.130 4.352 4.297 4.432 . 0 0 "[ . 1 . 2]" 1
108 1 4 ILE MD 2 38 TRP HA . . 5.500 4.132 3.969 4.392 . 0 0 "[ . 1 . 2]" 1
109 1 4 ILE MD 2 39 LEU HA . . 4.860 4.259 4.183 4.874 0.014 12 0 "[ . 1 . 2]" 1
110 1 4 ILE MD 2 39 LEU HB2 . . 3.270 2.352 2.206 3.076 . 0 0 "[ . 1 . 2]" 1
111 1 4 ILE MD 2 45 ALA HA . . 3.410 2.305 2.095 2.453 . 0 0 "[ . 1 . 2]" 1
112 1 4 ILE MD 2 45 ALA MB . . 3.040 2.622 2.433 2.765 . 0 0 "[ . 1 . 2]" 1
113 1 4 ILE MD 2 48 VAL H . . 4.700 4.588 4.487 4.670 . 0 0 "[ . 1 . 2]" 1
114 1 4 ILE MD 2 48 VAL HB . . 3.820 3.490 3.329 3.621 . 0 0 "[ . 1 . 2]" 1
115 1 4 ILE MD 2 49 ARG H . . 4.680 3.880 3.593 4.032 . 0 0 "[ . 1 . 2]" 1
116 1 4 ILE MD 2 49 ARG HD3 . . 4.810 4.658 4.247 4.811 0.001 15 0 "[ . 1 . 2]" 1
117 1 4 ILE HG12 2 38 TRP HA . . 4.440 2.849 2.628 3.034 . 0 0 "[ . 1 . 2]" 1
118 1 4 ILE HG12 2 39 LEU HB2 . . 3.580 2.401 2.326 2.600 . 0 0 "[ . 1 . 2]" 1
119 1 4 ILE HG12 2 48 VAL HB . . 5.500 5.271 4.999 5.467 . 0 0 "[ . 1 . 2]" 1
120 1 4 ILE HG13 1 4 ILE MG . . 2.580 2.257 2.189 2.291 . 0 0 "[ . 1 . 2]" 1
121 1 4 ILE HG13 2 39 LEU HB3 . . 4.390 3.204 3.091 3.422 . 0 0 "[ . 1 . 2]" 1
122 1 4 ILE HG13 2 48 VAL QG . . 4.550 2.622 2.244 2.865 . 0 0 "[ . 1 . 2]" 1
123 1 4 ILE MG 1 5 THR H . . 3.760 3.199 3.066 3.352 . 0 0 "[ . 1 . 2]" 1
124 1 4 ILE MG 1 5 THR HA . . 4.360 4.172 4.122 4.293 . 0 0 "[ . 1 . 2]" 1
125 1 4 ILE MG 1 5 THR MG . . 3.090 2.349 1.978 2.559 . 0 0 "[ . 1 . 2]" 1
126 1 4 ILE MG 2 37 VAL H . . 5.500 5.462 5.300 5.521 0.021 2 0 "[ . 1 . 2]" 1
127 1 4 ILE MG 2 37 VAL HA . . 5.500 5.528 5.445 5.769 0.269 12 0 "[ . 1 . 2]" 1
128 1 4 ILE MG 2 37 VAL HB . . 4.710 3.405 3.245 4.504 . 0 0 "[ . 1 . 2]" 1
129 1 4 ILE MG 2 37 VAL QG . . 3.550 2.826 2.272 2.943 . 0 0 "[ . 1 . 2]" 1
130 1 4 ILE MG 2 38 TRP HA . . 5.500 4.879 4.652 4.969 . 0 0 "[ . 1 . 2]" 1
131 1 4 ILE MG 2 39 LEU H . . 5.500 5.111 4.968 5.187 . 0 0 "[ . 1 . 2]" 1
132 1 4 ILE MG 2 39 LEU HB2 . . 5.500 4.167 4.006 4.331 . 0 0 "[ . 1 . 2]" 1
133 1 4 ILE MG 2 45 ALA HA . . 4.860 4.560 4.367 4.782 . 0 0 "[ . 1 . 2]" 1
134 1 4 ILE MG 2 48 VAL HA . . 5.300 4.668 4.565 4.777 . 0 0 "[ . 1 . 2]" 1
135 1 4 ILE MG 2 48 VAL HB . . 3.930 2.772 2.570 2.955 . 0 0 "[ . 1 . 2]" 1
136 1 4 ILE MG 2 48 VAL QG . . 3.410 2.419 2.293 2.609 . 0 0 "[ . 1 . 2]" 1
137 1 4 ILE MG 2 49 ARG HA . . 4.540 3.190 3.035 3.334 . 0 0 "[ . 1 . 2]" 1
138 1 4 ILE MG 2 49 ARG HD2 . . 4.820 4.460 4.228 4.636 . 0 0 "[ . 1 . 2]" 1
139 1 4 ILE MG 2 49 ARG HG3 . . 4.400 2.945 2.677 3.099 . 0 0 "[ . 1 . 2]" 1
140 1 4 ILE MG 2 52 LEU HA . . 5.500 5.305 5.218 5.427 . 0 0 "[ . 1 . 2]" 1
141 1 4 ILE MG 2 52 LEU QB . . 4.710 3.164 3.078 3.302 . 0 0 "[ . 1 . 2]" 1
142 1 4 ILE MG 2 52 LEU MD1 . . 3.610 2.054 1.781 2.343 . 0 0 "[ . 1 . 2]" 1
143 1 4 ILE MG 2 52 LEU QD . . 3.070 1.994 1.775 2.197 . 0 0 "[ . 1 . 2]" 1
144 1 4 ILE MG 2 52 LEU MD2 . . 3.610 3.001 2.411 3.630 0.020 6 0 "[ . 1 . 2]" 1
145 1 5 THR H 1 5 THR HB . . 3.880 3.465 3.434 3.503 . 0 0 "[ . 1 . 2]" 1
146 1 5 THR H 1 5 THR MG . . 3.670 2.775 2.738 2.841 . 0 0 "[ . 1 . 2]" 1
147 1 5 THR H 2 37 VAL H . . 3.940 3.396 3.299 3.545 . 0 0 "[ . 1 . 2]" 1
148 1 5 THR H 2 38 TRP HA . . 4.270 3.930 3.762 4.000 . 0 0 "[ . 1 . 2]" 1
149 1 5 THR HA 1 5 THR MG . . 3.510 3.200 3.195 3.205 . 0 0 "[ . 1 . 2]" 1
150 1 5 THR HA 1 6 SER H . . 3.220 2.607 2.511 2.670 . 0 0 "[ . 1 . 2]" 1
151 1 5 THR HA 1 6 SER HA . . 5.500 4.488 4.436 4.508 . 0 0 "[ . 1 . 2]" 1
152 1 5 THR HA 1 6 SER QB . . 4.380 4.074 3.855 4.386 0.006 18 0 "[ . 1 . 2]" 1
153 1 5 THR HA 2 52 LEU MD1 . . 5.500 4.773 4.229 5.120 . 0 0 "[ . 1 . 2]" 1
154 1 5 THR HA 2 52 LEU QD . . 4.680 4.111 3.950 4.340 . 0 0 "[ . 1 . 2]" 1
155 1 5 THR HA 2 52 LEU MD2 . . 5.500 4.573 4.122 4.977 . 0 0 "[ . 1 . 2]" 1
156 1 5 THR HB 2 52 LEU QD . . 3.510 2.184 1.934 2.511 . 0 0 "[ . 1 . 2]" 1
157 1 5 THR MG 1 6 SER H . . 3.970 2.752 2.572 3.046 . 0 0 "[ . 1 . 2]" 1
158 1 5 THR MG 1 6 SER HA . . 3.700 3.403 3.320 3.604 . 0 0 "[ . 1 . 2]" 1
159 1 5 THR MG 1 6 SER QB . . 4.860 4.448 4.311 4.697 . 0 0 "[ . 1 . 2]" 1
160 1 5 THR MG 1 7 PHE HA . . 5.310 4.715 4.473 4.930 . 0 0 "[ . 1 . 2]" 1
161 1 5 THR MG 1 7 PHE HB3 . . 5.500 5.318 5.144 5.604 0.104 12 0 "[ . 1 . 2]" 1
162 1 5 THR MG 1 7 PHE QD . . 3.880 3.267 2.459 3.757 . 0 0 "[ . 1 . 2]" 1
163 1 5 THR MG 1 7 PHE HZ . . 3.530 2.704 2.304 3.493 . 0 0 "[ . 1 . 2]" 1
164 1 5 THR MG 1 13 ALA HA . . 5.500 5.259 5.085 5.538 0.038 12 0 "[ . 1 . 2]" 1
165 1 5 THR MG 2 37 VAL H . . 5.500 3.444 3.242 3.615 . 0 0 "[ . 1 . 2]" 1
166 1 5 THR MG 2 37 VAL HB . . 4.000 2.190 1.944 3.981 . 0 0 "[ . 1 . 2]" 1
167 1 5 THR MG 2 37 VAL MG1 . . 3.600 2.899 2.320 3.276 . 0 0 "[ . 1 . 2]" 1
168 1 5 THR MG 2 37 VAL QG . . 2.910 1.977 1.731 2.194 . 0 0 "[ . 1 . 2]" 1
169 1 5 THR MG 2 37 VAL MG2 . . 3.600 2.013 1.787 2.240 . 0 0 "[ . 1 . 2]" 1
170 1 5 THR MG 2 48 VAL QG . . 5.440 5.208 5.075 5.320 . 0 0 "[ . 1 . 2]" 1
171 1 5 THR MG 2 52 LEU MD1 . . 3.110 1.820 1.781 1.892 . 0 0 "[ . 1 . 2]" 1
172 1 5 THR MG 2 52 LEU QD . . 2.680 1.765 1.725 1.841 . 0 0 "[ . 1 . 2]" 1
173 1 5 THR MG 2 52 LEU MD2 . . 3.110 2.426 2.115 2.819 . 0 0 "[ . 1 . 2]" 1
174 1 6 SER H 1 6 SER QB . . 3.260 2.905 2.628 3.175 . 0 0 "[ . 1 . 2]" 1
175 1 6 SER HA 1 7 PHE HB2 . . 5.040 4.412 4.286 4.510 . 0 0 "[ . 1 . 2]" 1
176 1 6 SER HA 1 7 PHE QD . . 5.500 4.422 3.332 4.773 . 0 0 "[ . 1 . 2]" 1
177 1 6 SER HA 2 36 ASP HA . . 3.340 2.221 1.974 2.341 . 0 0 "[ . 1 . 2]" 1
178 1 6 SER HA 2 36 ASP QB . . 4.750 4.016 3.593 4.394 . 0 0 "[ . 1 . 2]" 1
179 1 6 SER HA 2 37 VAL H . . 3.950 2.553 2.361 2.637 . 0 0 "[ . 1 . 2]" 1
180 1 6 SER HA 2 37 VAL HB . . 5.500 4.507 4.305 5.649 0.149 12 0 "[ . 1 . 2]" 1
181 1 6 SER HA 2 37 VAL QG . . 3.330 3.260 2.877 3.370 0.040 19 0 "[ . 1 . 2]" 1
182 1 6 SER QB 2 36 ASP HA . . 3.960 3.108 2.632 3.312 . 0 0 "[ . 1 . 2]" 1
183 1 6 SER QB 2 37 VAL QG . . 5.260 4.609 4.155 4.726 . 0 0 "[ . 1 . 2]" 1
184 1 7 PHE H 1 7 PHE QD . . 5.500 3.597 3.023 3.833 . 0 0 "[ . 1 . 2]" 1
185 1 7 PHE H 1 7 PHE QE . . 5.500 5.293 5.122 5.438 . 0 0 "[ . 1 . 2]" 1
186 1 7 PHE H 2 37 VAL H . . 4.760 3.870 3.669 4.267 . 0 0 "[ . 1 . 2]" 1
187 1 7 PHE HA 1 7 PHE QE . . 5.500 4.330 4.220 4.594 . 0 0 "[ . 1 . 2]" 1
188 1 7 PHE HA 1 8 ALA HA . . 4.810 4.437 4.386 4.484 . 0 0 "[ . 1 . 2]" 1
189 1 7 PHE HA 1 8 ALA MB . . 4.020 3.849 3.766 3.921 . 0 0 "[ . 1 . 2]" 1
190 1 7 PHE HA 1 12 VAL HB . . 5.500 5.451 5.158 5.530 0.030 17 0 "[ . 1 . 2]" 1
191 1 7 PHE HA 1 12 VAL QG . . 5.130 4.401 4.071 4.617 . 0 0 "[ . 1 . 2]" 1
192 1 7 PHE HA 2 37 VAL QG . . 5.090 4.830 4.672 5.015 . 0 0 "[ . 1 . 2]" 1
193 1 7 PHE HB2 1 12 VAL MG1 . . 5.500 3.920 3.579 4.194 . 0 0 "[ . 1 . 2]" 1
194 1 7 PHE HB2 1 12 VAL QG . . 4.210 3.827 3.522 4.034 . 0 0 "[ . 1 . 2]" 1
195 1 7 PHE HB2 1 12 VAL MG2 . . 5.500 5.373 5.180 5.547 0.047 20 0 "[ . 1 . 2]" 1
196 1 7 PHE HB2 1 13 ALA HA . . 3.800 3.805 3.679 3.870 0.070 9 0 "[ . 1 . 2]" 1
197 1 7 PHE HB2 1 13 ALA MB . . 3.170 2.919 2.662 3.165 . 0 0 "[ . 1 . 2]" 1
198 1 7 PHE HB2 1 29 ILE MD . . 4.350 4.172 3.874 4.306 . 0 0 "[ . 1 . 2]" 1
199 1 7 PHE HB2 1 29 ILE MG . . 5.490 4.597 4.332 4.963 . 0 0 "[ . 1 . 2]" 1
200 1 7 PHE HB2 2 35 SER HB3 . . 5.500 3.783 3.358 4.212 . 0 0 "[ . 1 . 2]" 1
201 1 7 PHE HB2 2 37 VAL H . . 5.500 5.247 5.014 5.507 0.007 9 0 "[ . 1 . 2]" 1
202 1 7 PHE HB2 2 37 VAL QG . . 3.700 3.400 3.252 3.646 . 0 0 "[ . 1 . 2]" 1
203 1 7 PHE HB3 1 12 VAL MG1 . . 4.590 3.221 2.925 3.496 . 0 0 "[ . 1 . 2]" 1
204 1 7 PHE HB3 1 12 VAL QG . . 3.700 3.110 2.857 3.297 . 0 0 "[ . 1 . 2]" 1
205 1 7 PHE HB3 1 12 VAL MG2 . . 4.590 4.119 3.910 4.298 . 0 0 "[ . 1 . 2]" 1
206 1 7 PHE HB3 1 13 ALA HA . . 4.550 4.512 4.354 4.602 0.052 17 0 "[ . 1 . 2]" 1
207 1 7 PHE HB3 1 13 ALA MB . . 3.960 3.803 3.526 3.971 0.011 18 0 "[ . 1 . 2]" 1
208 1 7 PHE HB3 1 29 ILE MD . . 5.500 5.448 5.148 5.553 0.053 9 0 "[ . 1 . 2]" 1
209 1 7 PHE QD 1 12 VAL QG . . 3.630 2.724 2.117 3.071 . 0 0 "[ . 1 . 2]" 1
210 1 7 PHE QD 1 13 ALA HA . . 4.210 2.569 2.064 3.665 . 0 0 "[ . 1 . 2]" 1
211 1 7 PHE QD 1 13 ALA MB . . 3.830 3.012 2.576 3.843 0.013 15 0 "[ . 1 . 2]" 1
212 1 7 PHE QD 1 29 ILE MD . . 5.270 3.295 2.858 3.899 . 0 0 "[ . 1 . 2]" 1
213 1 7 PHE QD 1 29 ILE MG . . 5.500 4.637 4.275 5.218 . 0 0 "[ . 1 . 2]" 1
214 1 7 PHE QD 2 37 VAL HB . . 5.060 4.622 4.110 4.863 . 0 0 "[ . 1 . 2]" 1
215 1 7 PHE QD 2 37 VAL MG1 . . 4.340 4.202 2.346 4.364 0.024 4 0 "[ . 1 . 2]" 1
216 1 7 PHE QD 2 37 VAL QG . . 3.440 2.198 1.875 2.377 . 0 0 "[ . 1 . 2]" 1
217 1 7 PHE QD 2 37 VAL MG2 . . 4.340 2.306 1.877 4.345 0.005 12 0 "[ . 1 . 2]" 1
218 1 7 PHE QE 2 52 LEU QB . . 5.340 5.225 4.910 5.384 0.044 12 0 "[ . 1 . 2]" 1
219 1 7 PHE QE 2 52 LEU MD1 . . 4.970 2.712 1.974 3.160 . 0 0 "[ . 1 . 2]" 1
220 1 7 PHE QE 2 52 LEU QD . . 4.050 2.619 1.962 2.939 . 0 0 "[ . 1 . 2]" 1
221 1 7 PHE QE 2 52 LEU MD2 . . 4.970 3.718 3.275 4.198 . 0 0 "[ . 1 . 2]" 1
222 1 7 PHE QE 2 52 LEU HG . . 5.500 4.105 3.702 4.441 . 0 0 "[ . 1 . 2]" 1
223 1 7 PHE HZ 2 52 LEU MD1 . . 4.780 2.264 1.945 3.084 . 0 0 "[ . 1 . 2]" 1
224 1 7 PHE HZ 2 52 LEU MD2 . . 4.780 3.367 2.809 3.814 . 0 0 "[ . 1 . 2]" 1
225 1 7 PHE HZ 2 56 LEU MD1 . . 4.100 3.272 2.896 4.098 . 0 0 "[ . 1 . 2]" 1
226 1 7 PHE HZ 2 56 LEU QD . . 2.720 2.664 2.036 2.767 0.047 4 0 "[ . 1 . 2]" 1
227 1 7 PHE HZ 2 56 LEU MD2 . . 4.100 2.918 2.071 3.439 . 0 0 "[ . 1 . 2]" 1
228 1 7 PHE HZ 2 56 LEU HG . . 5.430 3.214 2.380 5.007 . 0 0 "[ . 1 . 2]" 1
229 1 8 ALA MB 1 9 ASN HA . . 4.610 4.387 4.303 4.464 . 0 0 "[ . 1 . 2]" 1
230 1 8 ALA MB 1 9 ASN HB2 . . 4.340 4.004 3.889 4.135 . 0 0 "[ . 1 . 2]" 1
231 1 9 ASN HA 1 10 PRO HA . . 4.480 4.404 4.397 4.410 . 0 0 "[ . 1 . 2]" 1
232 1 9 ASN HA 1 10 PRO HB3 . . 5.030 4.830 4.829 4.833 . 0 0 "[ . 1 . 2]" 1
233 1 9 ASN HA 1 10 PRO HD2 . . 3.590 2.232 2.185 2.294 . 0 0 "[ . 1 . 2]" 1
234 1 9 ASN HA 1 10 PRO HD3 . . 3.580 2.257 2.253 2.267 . 0 0 "[ . 1 . 2]" 1
235 1 9 ASN HA 1 10 PRO HG2 . . 4.600 4.377 4.340 4.427 . 0 0 "[ . 1 . 2]" 1
236 1 9 ASN HA 1 10 PRO HG3 . . 4.600 4.383 4.362 4.412 . 0 0 "[ . 1 . 2]" 1
237 1 9 ASN HB2 1 10 PRO HD2 . . 4.440 4.061 3.968 4.133 . 0 0 "[ . 1 . 2]" 1
238 1 9 ASN HB2 1 10 PRO HD3 . . 5.340 4.950 4.904 4.993 . 0 0 "[ . 1 . 2]" 1
239 1 9 ASN HB2 1 12 VAL MG1 . . 4.470 4.386 4.118 4.489 0.019 15 0 "[ . 1 . 2]" 1
240 1 9 ASN HB2 1 12 VAL QG . . 3.220 2.701 2.465 2.912 . 0 0 "[ . 1 . 2]" 1
241 1 9 ASN HB2 1 12 VAL MG2 . . 4.470 2.727 2.484 2.951 . 0 0 "[ . 1 . 2]" 1
242 1 9 ASN HB3 1 10 PRO HA . . 5.010 4.821 4.791 4.842 . 0 0 "[ . 1 . 2]" 1
243 1 9 ASN HB3 1 10 PRO HD2 . . 4.390 2.887 2.675 3.043 . 0 0 "[ . 1 . 2]" 1
244 1 9 ASN HB3 1 10 PRO HD3 . . 5.190 4.146 3.989 4.258 . 0 0 "[ . 1 . 2]" 1
245 1 9 ASN HB3 1 12 VAL H . . 4.290 2.535 2.458 2.648 . 0 0 "[ . 1 . 2]" 1
246 1 9 ASN HB3 1 12 VAL HB . . 3.900 3.282 2.991 3.680 . 0 0 "[ . 1 . 2]" 1
247 1 9 ASN HB3 1 12 VAL QG . . 3.430 2.691 2.301 2.924 . 0 0 "[ . 1 . 2]" 1
248 1 9 ASN HB3 2 63 GLU HA . . 5.500 5.531 5.467 5.563 0.063 9 0 "[ . 1 . 2]" 1
249 1 9 ASN QD 1 12 VAL QG . . 3.740 3.318 3.004 3.763 0.023 9 0 "[ . 1 . 2]" 1
250 1 10 PRO HA 1 13 ALA MB . . 4.040 2.556 2.505 2.604 . 0 0 "[ . 1 . 2]" 1
251 1 10 PRO HA 1 29 ILE MG . . 4.600 4.128 3.805 4.425 . 0 0 "[ . 1 . 2]" 1
252 1 10 PRO HA 1 31 GLN HG2 . . 5.500 4.974 4.427 5.394 . 0 0 "[ . 1 . 2]" 1
253 1 10 PRO HA 1 31 GLN HG3 . . 5.500 4.112 3.663 4.595 . 0 0 "[ . 1 . 2]" 1
254 1 10 PRO HB3 1 13 ALA MB . . 4.520 4.552 4.509 4.601 0.081 6 0 "[ . 1 . 2]" 1
255 1 10 PRO QG 1 13 ALA MB . . 5.350 5.215 5.178 5.256 . 0 0 "[ . 1 . 2]" 1
256 1 11 ARG H 1 11 ARG QD . . 5.340 3.830 2.304 4.540 . 0 0 "[ . 1 . 2]" 1
257 1 11 ARG H 1 11 ARG HG2 . . 5.500 3.028 1.944 4.628 . 0 0 "[ . 1 . 2]" 1
258 1 11 ARG H 1 11 ARG HG3 . . 5.500 3.246 1.931 4.495 . 0 0 "[ . 1 . 2]" 1
259 1 11 ARG H 1 12 VAL QG . . 5.170 4.263 3.950 4.372 . 0 0 "[ . 1 . 2]" 1
260 1 11 ARG H 1 13 ALA H . . 4.500 4.472 4.387 4.550 0.050 5 0 "[ . 1 . 2]" 1
261 1 11 ARG HA 1 11 ARG QD . . 5.010 3.504 1.973 4.565 . 0 0 "[ . 1 . 2]" 1
262 1 11 ARG HA 1 11 ARG QG . . 3.590 2.740 2.127 3.341 . 0 0 "[ . 1 . 2]" 1
263 1 11 ARG QD 1 12 VAL QG . . 4.610 4.238 3.343 5.016 0.406 16 0 "[ . 1 . 2]" 1
264 1 11 ARG QG 1 12 VAL QG . . 4.510 3.735 2.020 4.670 0.160 8 0 "[ . 1 . 2]" 1
265 1 12 VAL H 1 12 VAL HB . . 3.080 2.537 2.438 2.695 . 0 0 "[ . 1 . 2]" 1
266 1 12 VAL H 1 12 VAL MG1 . . 3.950 3.761 3.749 3.766 . 0 0 "[ . 1 . 2]" 1
267 1 12 VAL H 1 12 VAL QG . . 3.160 2.067 1.860 2.267 . 0 0 "[ . 1 . 2]" 1
268 1 12 VAL H 1 12 VAL MG2 . . 3.950 2.077 1.865 2.286 . 0 0 "[ . 1 . 2]" 1
269 1 12 VAL H 1 13 ALA H . . 3.340 2.804 2.743 2.844 . 0 0 "[ . 1 . 2]" 1
270 1 12 VAL H 1 15 ALA H . . 4.930 4.704 4.625 4.847 . 0 0 "[ . 1 . 2]" 1
271 1 12 VAL H 2 63 GLU HA . . 4.840 4.782 4.188 4.881 0.041 7 0 "[ . 1 . 2]" 1
272 1 12 VAL HA 1 12 VAL MG1 . . 3.330 2.351 2.178 2.418 . 0 0 "[ . 1 . 2]" 1
273 1 12 VAL HA 1 12 VAL MG2 . . 3.330 2.418 2.336 2.477 . 0 0 "[ . 1 . 2]" 1
274 1 12 VAL HA 1 15 ALA H . . 4.110 3.722 3.635 3.792 . 0 0 "[ . 1 . 2]" 1
275 1 12 VAL HA 1 15 ALA MB . . 3.230 2.436 2.330 2.558 . 0 0 "[ . 1 . 2]" 1
276 1 12 VAL HA 2 62 LEU HB2 . . 5.500 2.895 2.604 3.300 . 0 0 "[ . 1 . 2]" 1
277 1 12 VAL HA 2 62 LEU HB3 . . 5.500 3.896 3.458 4.375 . 0 0 "[ . 1 . 2]" 1
278 1 12 VAL HA 2 62 LEU MD1 . . 5.240 4.085 3.768 4.464 . 0 0 "[ . 1 . 2]" 1
279 1 12 VAL HA 2 62 LEU QD . . 4.610 3.894 3.611 4.227 . 0 0 "[ . 1 . 2]" 1
280 1 12 VAL HA 2 62 LEU MD2 . . 5.240 4.927 4.615 5.256 0.016 9 0 "[ . 1 . 2]" 1
281 1 12 VAL HB 1 13 ALA H . . 3.920 2.321 2.239 2.415 . 0 0 "[ . 1 . 2]" 1
282 1 12 VAL QG 1 13 ALA HA . . 3.680 3.281 3.119 3.643 . 0 0 "[ . 1 . 2]" 1
283 1 12 VAL QG 1 13 ALA MB . . 4.260 3.839 3.701 4.010 . 0 0 "[ . 1 . 2]" 1
284 1 12 VAL QG 1 15 ALA MB . . 3.830 3.380 3.261 3.462 . 0 0 "[ . 1 . 2]" 1
285 1 12 VAL QG 1 16 PHE QB . . 4.110 3.499 3.270 3.671 . 0 0 "[ . 1 . 2]" 1
286 1 12 VAL QG 1 16 PHE QE . . 4.150 1.993 1.892 2.274 . 0 0 "[ . 1 . 2]" 1
287 1 12 VAL QG 1 16 PHE HZ . . 4.180 3.919 3.754 4.181 0.001 19 0 "[ . 1 . 2]" 1
288 1 12 VAL QG 2 62 LEU HA . . 5.210 3.439 2.810 3.756 . 0 0 "[ . 1 . 2]" 1
289 1 12 VAL QG 2 62 LEU HB3 . . 3.150 3.033 2.433 3.193 0.043 14 0 "[ . 1 . 2]" 1
290 1 12 VAL QG 2 63 GLU H . . 5.440 3.825 3.517 4.135 . 0 0 "[ . 1 . 2]" 1
291 1 12 VAL QG 2 63 GLU HA . . 4.640 2.748 2.562 2.965 . 0 0 "[ . 1 . 2]" 1
292 1 12 VAL QG 2 63 GLU HG2 . . 5.440 4.731 4.052 5.310 . 0 0 "[ . 1 . 2]" 1
293 1 12 VAL MG1 1 13 ALA H . . 4.280 3.165 2.980 3.468 . 0 0 "[ . 1 . 2]" 1
294 1 12 VAL MG1 2 62 LEU HB2 . . 2.900 2.131 1.949 2.429 . 0 0 "[ . 1 . 2]" 1
295 1 12 VAL MG1 2 63 GLU HA . . 5.390 4.839 4.672 5.091 . 0 0 "[ . 1 . 2]" 1
296 1 12 VAL MG2 1 13 ALA H . . 4.280 3.733 3.523 3.805 . 0 0 "[ . 1 . 2]" 1
297 1 12 VAL MG2 2 62 LEU HB2 . . 2.900 2.523 2.099 2.771 . 0 0 "[ . 1 . 2]" 1
298 1 12 VAL MG2 2 63 GLU HA . . 5.390 2.764 2.574 2.988 . 0 0 "[ . 1 . 2]" 1
299 1 13 ALA H 1 13 ALA MB . . 3.310 2.139 2.033 2.239 . 0 0 "[ . 1 . 2]" 1
300 1 13 ALA H 1 14 GLN H . . 3.920 3.041 2.948 3.089 . 0 0 "[ . 1 . 2]" 1
301 1 13 ALA HA 1 15 ALA MB . . 5.120 5.018 4.888 5.125 0.005 10 0 "[ . 1 . 2]" 1
302 1 13 ALA HA 1 16 PHE QB . . 4.440 2.911 2.750 3.095 . 0 0 "[ . 1 . 2]" 1
303 1 13 ALA HA 1 29 ILE MD . . 3.690 2.669 2.108 2.941 . 0 0 "[ . 1 . 2]" 1
304 1 13 ALA HA 1 29 ILE MG . . 4.930 4.065 3.810 4.454 . 0 0 "[ . 1 . 2]" 1
305 1 13 ALA HA 2 35 SER HB2 . . 4.950 4.266 3.769 4.614 . 0 0 "[ . 1 . 2]" 1
306 1 13 ALA HA 2 37 VAL QG . . 3.330 3.138 2.984 3.289 . 0 0 "[ . 1 . 2]" 1
307 1 13 ALA MB 1 14 GLN HA . . 4.830 3.677 3.581 3.752 . 0 0 "[ . 1 . 2]" 1
308 1 13 ALA MB 1 29 ILE HA . . 4.900 4.306 4.125 4.504 . 0 0 "[ . 1 . 2]" 1
309 1 13 ALA MB 1 29 ILE HB . . 4.760 3.673 3.405 4.180 . 0 0 "[ . 1 . 2]" 1
310 1 13 ALA MB 1 29 ILE MD . . 2.900 2.031 1.900 2.223 . 0 0 "[ . 1 . 2]" 1
311 1 13 ALA MB 1 29 ILE HG13 . . 3.460 2.220 1.964 2.705 . 0 0 "[ . 1 . 2]" 1
312 1 13 ALA MB 1 29 ILE MG . . 2.990 1.926 1.821 2.243 . 0 0 "[ . 1 . 2]" 1
313 1 13 ALA MB 1 31 GLN HA . . 5.500 5.479 5.377 5.568 0.068 12 0 "[ . 1 . 2]" 1
314 1 13 ALA MB 1 31 GLN HG2 . . 5.500 5.432 5.019 5.579 0.079 2 0 "[ . 1 . 2]" 1
315 1 13 ALA MB 1 31 GLN QG . . 4.810 4.279 4.203 4.408 . 0 0 "[ . 1 . 2]" 1
316 1 13 ALA MB 1 31 GLN HG3 . . 5.500 4.484 4.365 4.657 . 0 0 "[ . 1 . 2]" 1
317 1 13 ALA MB 2 35 SER HA . . 4.400 4.049 3.872 4.188 . 0 0 "[ . 1 . 2]" 1
318 1 13 ALA MB 2 35 SER HB2 . . 3.390 2.220 1.975 2.669 . 0 0 "[ . 1 . 2]" 1
319 1 13 ALA MB 2 35 SER HB3 . . 3.080 2.097 1.932 2.289 . 0 0 "[ . 1 . 2]" 1
320 1 13 ALA MB 2 37 VAL QG . . 3.410 3.144 3.007 3.300 . 0 0 "[ . 1 . 2]" 1
321 1 14 GLN HA 1 14 GLN HG3 . . 3.280 3.166 2.688 3.277 . 0 0 "[ . 1 . 2]" 1
322 1 14 GLN HA 1 17 VAL MG1 . . 3.990 3.731 2.044 4.160 0.170 17 0 "[ . 1 . 2]" 1
323 1 14 GLN HA 1 17 VAL QG . . 3.320 2.403 1.908 3.342 0.022 11 0 "[ . 1 . 2]" 1
324 1 14 GLN HA 1 17 VAL MG2 . . 3.990 2.569 1.916 4.194 0.204 19 0 "[ . 1 . 2]" 1
325 1 14 GLN HA 1 18 ASP H . . 4.420 4.178 3.979 4.293 . 0 0 "[ . 1 . 2]" 1
326 1 14 GLN HA 1 29 ILE HB . . 5.500 5.045 4.739 5.269 . 0 0 "[ . 1 . 2]" 1
327 1 14 GLN HA 1 29 ILE HG13 . . 3.400 3.354 3.083 3.449 0.049 10 0 "[ . 1 . 2]" 1
328 1 14 GLN HB2 1 14 GLN QE . . 4.570 3.847 2.905 4.124 . 0 0 "[ . 1 . 2]" 1
329 1 14 GLN HB2 1 29 ILE HG13 . . 4.810 4.740 4.429 4.854 0.044 7 0 "[ . 1 . 2]" 1
330 1 14 GLN QE 1 14 GLN HG3 . . 3.290 2.244 2.099 3.256 . 0 0 "[ . 1 . 2]" 1
331 1 14 GLN QE 1 17 VAL QG . . 3.650 3.039 1.969 3.612 . 0 0 "[ . 1 . 2]" 1
332 1 14 GLN HG3 1 15 ALA H . . 3.950 3.437 3.226 3.765 . 0 0 "[ . 1 . 2]" 1
333 1 14 GLN HG3 1 15 ALA HA . . 3.790 3.465 3.298 3.810 0.020 9 0 "[ . 1 . 2]" 1
334 1 15 ALA HA 1 17 VAL H . . 5.470 4.908 4.566 5.140 . 0 0 "[ . 1 . 2]" 1
335 1 15 ALA HA 1 17 VAL QG . . 5.230 4.788 4.385 5.523 0.293 3 0 "[ . 1 . 2]" 1
336 1 15 ALA HA 1 18 ASP QB . . 3.160 2.452 2.354 2.518 . 0 0 "[ . 1 . 2]" 1
337 1 15 ALA MB 1 16 PHE H . . 3.220 2.408 2.204 2.579 . 0 0 "[ . 1 . 2]" 1
338 1 15 ALA MB 1 16 PHE HA . . 4.470 3.769 3.722 3.819 . 0 0 "[ . 1 . 2]" 1
339 1 15 ALA MB 1 16 PHE QD . . 4.490 3.488 3.003 4.105 . 0 0 "[ . 1 . 2]" 1
340 1 15 ALA MB 1 18 ASP HB2 . . 4.730 4.423 4.267 4.865 0.135 19 0 "[ . 1 . 2]" 1
341 1 15 ALA MB 1 18 ASP QB . . 3.900 3.731 3.636 3.852 . 0 0 "[ . 1 . 2]" 1
342 1 15 ALA MB 1 18 ASP HB3 . . 4.730 4.026 3.917 4.123 . 0 0 "[ . 1 . 2]" 1
343 1 15 ALA MB 1 19 TYR QD . . 4.780 4.293 4.006 4.791 0.011 19 0 "[ . 1 . 2]" 1
344 1 16 PHE H 1 16 PHE HB2 . . 3.590 2.165 2.108 2.226 . 0 0 "[ . 1 . 2]" 1
345 1 16 PHE H 1 16 PHE QB . . 3.010 2.145 2.089 2.204 . 0 0 "[ . 1 . 2]" 1
346 1 16 PHE H 1 16 PHE HB3 . . 3.590 3.475 3.409 3.521 . 0 0 "[ . 1 . 2]" 1
347 1 16 PHE H 1 16 PHE QD . . 5.500 2.705 2.314 3.273 . 0 0 "[ . 1 . 2]" 1
348 1 16 PHE H 1 16 PHE QE . . 5.500 4.874 4.599 5.252 . 0 0 "[ . 1 . 2]" 1
349 1 16 PHE H 1 19 TYR QD . . 5.500 4.410 4.288 4.667 . 0 0 "[ . 1 . 2]" 1
350 1 16 PHE HA 1 16 PHE QD . . 4.140 2.917 2.567 3.036 . 0 0 "[ . 1 . 2]" 1
351 1 16 PHE HA 1 16 PHE QE . . 5.500 4.439 4.300 4.496 . 0 0 "[ . 1 . 2]" 1
352 1 16 PHE HA 1 17 VAL QG . . 5.440 4.593 4.455 4.836 . 0 0 "[ . 1 . 2]" 1
353 1 16 PHE HA 1 19 TYR QB . . 4.230 3.987 3.556 4.256 0.026 5 0 "[ . 1 . 2]" 1
354 1 16 PHE HA 1 19 TYR QD . . 4.390 1.989 1.930 2.148 . 0 0 "[ . 1 . 2]" 1
355 1 16 PHE HA 2 52 LEU QD . . 5.440 5.031 4.488 5.478 0.038 18 0 "[ . 1 . 2]" 1
356 1 16 PHE QB 1 17 VAL H . . 3.630 2.405 2.326 2.576 . 0 0 "[ . 1 . 2]" 1
357 1 16 PHE QB 1 17 VAL QG . . 5.280 3.086 2.966 3.500 . 0 0 "[ . 1 . 2]" 1
358 1 16 PHE QB 1 29 ILE MD . . 4.170 3.632 3.491 3.750 . 0 0 "[ . 1 . 2]" 1
359 1 16 PHE HB2 1 17 VAL H . . 4.180 2.621 2.556 2.759 . 0 0 "[ . 1 . 2]" 1
360 1 16 PHE HB2 1 19 TYR QD . . 5.070 4.888 4.828 5.028 . 0 0 "[ . 1 . 2]" 1
361 1 16 PHE HB3 1 17 VAL H . . 4.180 2.809 2.596 3.127 . 0 0 "[ . 1 . 2]" 1
362 1 16 PHE HB3 1 19 TYR QD . . 5.070 4.370 4.140 4.649 . 0 0 "[ . 1 . 2]" 1
363 1 16 PHE QD 1 17 VAL HA . . 5.500 5.353 5.177 5.534 0.034 17 0 "[ . 1 . 2]" 1
364 1 16 PHE QD 1 27 LEU QD . . 5.200 4.523 3.706 5.280 0.080 18 0 "[ . 1 . 2]" 1
365 1 16 PHE QD 2 37 VAL QG . . 4.640 4.023 3.881 4.190 . 0 0 "[ . 1 . 2]" 1
366 1 16 PHE QD 2 55 PHE QB . . 4.690 3.960 3.753 4.233 . 0 0 "[ . 1 . 2]" 1
367 1 16 PHE QE 2 37 VAL QG . . 5.440 5.043 4.850 5.192 . 0 0 "[ . 1 . 2]" 1
368 1 16 PHE QE 2 52 LEU MD1 . . 4.600 2.871 2.201 3.741 . 0 0 "[ . 1 . 2]" 1
369 1 16 PHE QE 2 52 LEU QD . . 3.930 2.691 2.186 3.214 . 0 0 "[ . 1 . 2]" 1
370 1 16 PHE QE 2 52 LEU MD2 . . 4.600 3.665 3.287 4.260 . 0 0 "[ . 1 . 2]" 1
371 1 16 PHE QE 2 56 LEU MD1 . . 5.000 4.037 3.450 4.298 . 0 0 "[ . 1 . 2]" 1
372 1 16 PHE QE 2 56 LEU QD . . 3.920 2.672 2.043 3.214 . 0 0 "[ . 1 . 2]" 1
373 1 16 PHE QE 2 56 LEU MD2 . . 5.000 2.730 2.050 3.416 . 0 0 "[ . 1 . 2]" 1
374 1 16 PHE HZ 2 53 ALA HA . . 5.500 5.521 5.390 5.584 0.084 9 0 "[ . 1 . 2]" 1
375 1 16 PHE HZ 2 55 PHE QB . . 3.990 2.684 2.246 2.958 . 0 0 "[ . 1 . 2]" 1
376 1 16 PHE HZ 2 56 LEU H . . 4.700 3.131 2.923 3.381 . 0 0 "[ . 1 . 2]" 1
377 1 16 PHE HZ 2 56 LEU HA . . 3.970 2.639 2.241 3.130 . 0 0 "[ . 1 . 2]" 1
378 1 16 PHE HZ 2 56 LEU QD . . 2.850 2.460 1.843 2.892 0.042 20 0 "[ . 1 . 2]" 1
379 1 16 PHE HZ 2 56 LEU HG . . 4.600 2.268 1.976 4.534 . 0 0 "[ . 1 . 2]" 1
380 1 16 PHE HZ 2 62 LEU HB2 . . 5.410 4.774 4.409 5.343 . 0 0 "[ . 1 . 2]" 1
381 1 16 PHE HZ 2 62 LEU QD . . 3.940 2.532 2.234 3.174 . 0 0 "[ . 1 . 2]" 1
382 1 17 VAL HA 1 17 VAL MG1 . . 3.350 2.338 2.214 3.169 . 0 0 "[ . 1 . 2]" 1
383 1 17 VAL HA 1 17 VAL MG2 . . 3.350 2.831 2.215 3.204 . 0 0 "[ . 1 . 2]" 1
384 1 17 VAL HA 1 18 ASP HA . . 5.500 4.772 4.755 4.781 . 0 0 "[ . 1 . 2]" 1
385 1 17 VAL HA 1 19 TYR QD . . 5.440 5.264 4.965 5.385 . 0 0 "[ . 1 . 2]" 1
386 1 17 VAL HA 1 20 MET H . . 4.010 3.535 3.486 3.646 . 0 0 "[ . 1 . 2]" 1
387 1 17 VAL HA 1 27 LEU HB2 . . 5.500 2.375 2.212 2.540 . 0 0 "[ . 1 . 2]" 1
388 1 17 VAL HA 1 27 LEU HB3 . . 4.230 3.447 3.189 3.600 . 0 0 "[ . 1 . 2]" 1
389 1 17 VAL HA 1 27 LEU MD1 . . 4.570 3.221 2.051 4.590 0.020 7 0 "[ . 1 . 2]" 1
390 1 17 VAL HA 1 27 LEU QD . . 3.740 2.815 2.048 3.758 0.018 4 0 "[ . 1 . 2]" 1
391 1 17 VAL HA 1 27 LEU MD2 . . 4.570 4.229 3.580 4.641 0.071 20 0 "[ . 1 . 2]" 1
392 1 17 VAL HA 1 27 LEU HG . . 3.780 3.542 3.136 3.806 0.026 8 0 "[ . 1 . 2]" 1
393 1 17 VAL HA 1 29 ILE MD . . 4.880 4.745 4.413 4.886 0.006 18 0 "[ . 1 . 2]" 1
394 1 17 VAL HB 1 27 LEU HB2 . . 5.500 3.180 2.454 4.399 . 0 0 "[ . 1 . 2]" 1
395 1 17 VAL HB 1 27 LEU HB3 . . 5.500 3.907 3.020 4.820 . 0 0 "[ . 1 . 2]" 1
396 1 17 VAL HB 1 27 LEU QD . . 5.440 4.291 3.319 5.380 . 0 0 "[ . 1 . 2]" 1
397 1 17 VAL HB 1 28 THR HA . . 5.380 5.050 4.690 5.543 0.163 17 0 "[ . 1 . 2]" 1
398 1 17 VAL QG 1 18 ASP H . . 3.640 2.750 2.114 3.468 . 0 0 "[ . 1 . 2]" 1
399 1 17 VAL QG 1 18 ASP HA . . 3.700 3.323 3.133 3.679 . 0 0 "[ . 1 . 2]" 1
400 1 17 VAL QG 1 21 ALA MB . . 4.360 3.488 2.739 4.052 . 0 0 "[ . 1 . 2]" 1
401 1 17 VAL QG 1 27 LEU HB2 . . 3.680 2.203 1.828 2.610 . 0 0 "[ . 1 . 2]" 1
402 1 17 VAL QG 1 27 LEU HB3 . . 3.290 2.114 1.878 3.016 . 0 0 "[ . 1 . 2]" 1
403 1 17 VAL QG 1 27 LEU QD . . 3.180 2.712 2.090 3.216 0.036 7 0 "[ . 1 . 2]" 1
404 1 17 VAL QG 1 28 THR HA . . 4.940 3.243 2.901 3.541 . 0 0 "[ . 1 . 2]" 1
405 1 17 VAL QG 1 29 ILE HA . . 4.000 3.977 3.907 4.300 0.300 19 0 "[ . 1 . 2]" 1
406 1 17 VAL QG 1 29 ILE HB . . 5.370 3.669 3.493 3.863 . 0 0 "[ . 1 . 2]" 1
407 1 17 VAL QG 1 29 ILE MD . . 2.850 1.994 1.869 2.287 . 0 0 "[ . 1 . 2]" 1
408 1 17 VAL MG1 1 27 LEU HB2 . . 5.040 2.372 1.983 4.201 . 0 0 "[ . 1 . 2]" 1
409 1 17 VAL MG1 1 27 LEU HB3 . . 4.540 2.537 1.932 4.563 0.023 19 0 "[ . 1 . 2]" 1
410 1 17 VAL MG2 1 27 LEU HB2 . . 5.040 3.421 1.987 4.316 . 0 0 "[ . 1 . 2]" 1
411 1 17 VAL MG2 1 27 LEU HB3 . . 4.540 3.603 1.915 4.593 0.053 8 0 "[ . 1 . 2]" 1
412 1 18 ASP H 1 18 ASP HB2 . . 3.530 2.440 2.343 2.637 . 0 0 "[ . 1 . 2]" 1
413 1 18 ASP H 1 18 ASP QB . . 3.090 2.248 2.223 2.270 . 0 0 "[ . 1 . 2]" 1
414 1 18 ASP H 1 18 ASP HB3 . . 3.530 2.653 2.458 2.762 . 0 0 "[ . 1 . 2]" 1
415 1 18 ASP H 1 19 TYR H . . 3.230 2.774 2.742 2.811 . 0 0 "[ . 1 . 2]" 1
416 1 18 ASP HA 1 21 ALA MB . . 3.030 2.889 2.632 3.009 . 0 0 "[ . 1 . 2]" 1
417 1 19 TYR H 1 19 TYR HB2 . . 3.680 3.480 3.363 3.536 . 0 0 "[ . 1 . 2]" 1
418 1 19 TYR H 1 19 TYR QB . . 3.160 2.158 2.062 2.234 . 0 0 "[ . 1 . 2]" 1
419 1 19 TYR H 1 19 TYR HB3 . . 3.680 2.179 2.081 2.259 . 0 0 "[ . 1 . 2]" 1
420 1 19 TYR H 1 19 TYR QD . . 4.350 2.851 2.738 3.107 . 0 0 "[ . 1 . 2]" 1
421 1 19 TYR H 1 19 TYR QE . . 5.500 4.919 4.709 5.277 . 0 0 "[ . 1 . 2]" 1
422 1 19 TYR H 1 20 MET H . . 3.590 2.612 2.589 2.694 . 0 0 "[ . 1 . 2]" 1
423 1 19 TYR HA 1 19 TYR QE . . 5.500 5.515 5.420 5.574 0.074 5 0 "[ . 1 . 2]" 1
424 1 19 TYR HA 1 22 THR MG . . 3.470 1.934 1.886 2.019 . 0 0 "[ . 1 . 2]" 1
425 1 19 TYR QB 1 22 THR MG . . 4.230 3.312 3.248 3.457 . 0 0 "[ . 1 . 2]" 1
426 1 19 TYR QD 1 20 MET H . . 4.640 3.293 2.934 3.411 . 0 0 "[ . 1 . 2]" 1
427 1 19 TYR QD 1 20 MET HA . . 4.510 3.476 3.075 3.835 . 0 0 "[ . 1 . 2]" 1
428 1 19 TYR QD 1 20 MET HG2 . . 5.500 4.052 3.157 5.817 0.317 8 0 "[ . 1 . 2]" 1
429 1 19 TYR QD 1 20 MET QG . . 4.730 3.649 3.053 4.908 0.178 19 0 "[ . 1 . 2]" 1
430 1 19 TYR QD 1 20 MET HG3 . . 5.500 4.418 3.986 5.335 . 0 0 "[ . 1 . 2]" 1
431 1 19 TYR QD 1 22 THR MG . . 3.960 3.866 3.643 3.970 0.010 5 0 "[ . 1 . 2]" 1
432 1 19 TYR QD 1 23 GLN HG2 . . 3.750 3.270 3.014 3.500 . 0 0 "[ . 1 . 2]" 1
433 1 19 TYR QE 1 20 MET HA . . 4.910 3.702 3.407 3.908 . 0 0 "[ . 1 . 2]" 1
434 1 19 TYR QE 1 20 MET ME . . 3.490 2.309 1.935 2.782 . 0 0 "[ . 1 . 2]" 1
435 1 19 TYR QE 1 20 MET HG2 . . 5.500 3.492 2.809 4.975 . 0 0 "[ . 1 . 2]" 1
436 1 19 TYR QE 1 20 MET QG . . 4.830 3.138 2.687 4.288 . 0 0 "[ . 1 . 2]" 1
437 1 19 TYR QE 1 20 MET HG3 . . 5.500 3.721 3.300 4.688 . 0 0 "[ . 1 . 2]" 1
438 1 19 TYR QE 1 25 VAL MG2 . . 5.500 5.533 5.507 5.605 0.105 19 0 "[ . 1 . 2]" 1
439 1 19 TYR QE 2 51 GLU HA . . 5.430 5.059 4.812 5.441 0.011 19 0 "[ . 1 . 2]" 1
440 1 19 TYR QE 2 51 GLU HB2 . . 4.110 3.552 3.039 4.153 0.043 14 0 "[ . 1 . 2]" 1
441 1 19 TYR QE 2 51 GLU HB3 . . 3.840 2.780 2.507 3.364 . 0 0 "[ . 1 . 2]" 1
442 1 19 TYR QE 2 51 GLU HG2 . . 5.190 4.717 4.378 5.221 0.031 19 0 "[ . 1 . 2]" 1
443 1 19 TYR QE 2 51 GLU HG3 . . 4.510 3.398 3.018 3.830 . 0 0 "[ . 1 . 2]" 1
444 1 19 TYR QE 2 52 LEU HA . . 3.750 3.727 3.451 3.829 0.079 8 0 "[ . 1 . 2]" 1
445 1 19 TYR QE 2 52 LEU QB . . 5.340 4.511 4.293 4.653 . 0 0 "[ . 1 . 2]" 1
446 1 19 TYR QE 2 52 LEU HG . . 5.500 5.110 4.568 5.488 . 0 0 "[ . 1 . 2]" 1
447 1 20 MET H 1 20 MET ME . . 5.500 4.212 3.917 4.766 . 0 0 "[ . 1 . 2]" 1
448 1 20 MET H 1 20 MET HG2 . . 5.500 3.312 2.551 4.662 . 0 0 "[ . 1 . 2]" 1
449 1 20 MET H 1 20 MET HG3 . . 5.500 3.672 3.110 4.408 . 0 0 "[ . 1 . 2]" 1
450 1 20 MET H 1 21 ALA H . . 3.330 2.485 2.417 2.537 . 0 0 "[ . 1 . 2]" 1
451 1 20 MET H 1 22 THR H . . 5.280 4.031 3.963 4.165 . 0 0 "[ . 1 . 2]" 1
452 1 20 MET H 1 27 LEU HB2 . . 5.500 5.337 5.118 5.516 0.016 5 0 "[ . 1 . 2]" 1
453 1 20 MET HA 1 20 MET ME . . 3.020 2.184 1.906 2.819 . 0 0 "[ . 1 . 2]" 1
454 1 20 MET HA 1 20 MET QG . . 3.590 2.413 2.261 2.552 . 0 0 "[ . 1 . 2]" 1
455 1 20 MET HA 1 23 GLN H . . 5.330 3.558 3.370 3.623 . 0 0 "[ . 1 . 2]" 1
456 1 20 MET HA 1 23 GLN HA . . 5.500 5.427 5.183 5.512 0.012 9 0 "[ . 1 . 2]" 1
457 1 20 MET HA 1 23 GLN HB2 . . 4.400 2.556 2.316 2.657 . 0 0 "[ . 1 . 2]" 1
458 1 20 MET HA 1 23 GLN QB . . 3.850 2.531 2.298 2.630 . 0 0 "[ . 1 . 2]" 1
459 1 20 MET HA 1 23 GLN HB3 . . 4.400 4.082 3.857 4.199 . 0 0 "[ . 1 . 2]" 1
460 1 20 MET HA 1 25 VAL HB . . 3.610 3.523 3.224 3.648 0.038 16 0 "[ . 1 . 2]" 1
461 1 20 MET HA 1 25 VAL MG1 . . 4.880 4.761 4.322 4.903 0.023 16 0 "[ . 1 . 2]" 1
462 1 20 MET HA 1 25 VAL MG2 . . 5.110 3.970 3.844 4.108 . 0 0 "[ . 1 . 2]" 1
463 1 20 MET HA 2 47 ARG HD2 . . 5.500 5.557 5.298 5.669 0.169 19 0 "[ . 1 . 2]" 1
464 1 20 MET HA 2 48 VAL QG . . 5.080 4.501 4.289 4.968 . 0 0 "[ . 1 . 2]" 1
465 1 20 MET QB 1 25 VAL MG1 . . 5.320 3.375 2.649 3.964 . 0 0 "[ . 1 . 2]" 1
466 1 20 MET ME 1 20 MET QG . . 3.380 2.214 2.082 2.389 . 0 0 "[ . 1 . 2]" 1
467 1 20 MET ME 1 25 VAL H . . 5.020 4.514 4.106 4.903 . 0 0 "[ . 1 . 2]" 1
468 1 20 MET ME 1 25 VAL HB . . 3.180 2.798 2.295 3.210 0.030 19 0 "[ . 1 . 2]" 1
469 1 20 MET ME 1 25 VAL MG1 . . 3.390 3.307 2.955 3.472 0.082 11 0 "[ . 1 . 2]" 1
470 1 20 MET ME 1 25 VAL MG2 . . 3.000 2.629 1.971 2.961 . 0 0 "[ . 1 . 2]" 1
471 1 20 MET ME 1 27 LEU QD . . 4.380 3.606 3.069 3.905 . 0 0 "[ . 1 . 2]" 1
472 1 20 MET ME 2 47 ARG HD2 . . 3.850 2.806 2.397 3.214 . 0 0 "[ . 1 . 2]" 1
473 1 20 MET ME 2 47 ARG HD3 . . 4.050 2.452 1.984 3.023 . 0 0 "[ . 1 . 2]" 1
474 1 20 MET ME 2 48 VAL HA . . 3.260 2.319 1.923 2.982 . 0 0 "[ . 1 . 2]" 1
475 1 20 MET ME 2 48 VAL HB . . 5.390 3.746 3.367 4.185 . 0 0 "[ . 1 . 2]" 1
476 1 20 MET ME 2 48 VAL QG . . 2.740 2.288 1.936 2.767 0.027 20 0 "[ . 1 . 2]" 1
477 1 20 MET ME 2 51 GLU HB2 . . 4.350 2.418 1.965 2.944 . 0 0 "[ . 1 . 2]" 1
478 1 20 MET ME 2 51 GLU HB3 . . 3.530 3.136 2.859 3.488 . 0 0 "[ . 1 . 2]" 1
479 1 20 MET ME 2 51 GLU HG2 . . 4.000 3.302 2.601 3.817 . 0 0 "[ . 1 . 2]" 1
480 1 20 MET ME 2 51 GLU HG3 . . 3.120 2.928 2.525 3.134 0.014 10 0 "[ . 1 . 2]" 1
481 1 20 MET QG 2 48 VAL QG . . 3.860 3.229 1.886 3.859 . 0 0 "[ . 1 . 2]" 1
482 1 21 ALA H 1 22 THR H . . 3.410 2.633 2.595 2.694 . 0 0 "[ . 1 . 2]" 1
483 1 21 ALA H 1 23 GLN H . . 4.470 3.828 3.804 3.858 . 0 0 "[ . 1 . 2]" 1
484 1 21 ALA HA 1 26 ILE HB . . 5.500 5.526 5.416 5.564 0.064 1 0 "[ . 1 . 2]" 1
485 1 21 ALA HA 1 26 ILE MD . . 3.040 2.677 2.520 2.861 . 0 0 "[ . 1 . 2]" 1
486 1 21 ALA HA 1 26 ILE MG . . 4.690 4.572 4.380 4.685 . 0 0 "[ . 1 . 2]" 1
487 1 21 ALA MB 1 22 THR H . . 3.550 2.572 2.522 2.628 . 0 0 "[ . 1 . 2]" 1
488 1 21 ALA MB 1 22 THR HA . . 5.500 3.829 3.801 3.862 . 0 0 "[ . 1 . 2]" 1
489 1 21 ALA MB 1 26 ILE MD . . 3.290 2.549 2.392 2.819 . 0 0 "[ . 1 . 2]" 1
490 1 22 THR H 1 22 THR HB . . 3.170 2.584 2.528 2.681 . 0 0 "[ . 1 . 2]" 1
491 1 22 THR H 1 22 THR MG . . 3.190 2.036 1.944 2.113 . 0 0 "[ . 1 . 2]" 1
492 1 22 THR H 1 23 GLN H . . 3.410 2.563 2.466 2.597 . 0 0 "[ . 1 . 2]" 1
493 1 22 THR HA 1 22 THR MG . . 3.340 3.206 3.205 3.208 . 0 0 "[ . 1 . 2]" 1
494 1 22 THR HA 1 23 GLN HG2 . . 5.500 5.485 5.402 5.514 0.014 5 0 "[ . 1 . 2]" 1
495 1 22 THR MG 1 23 GLN HG2 . . 3.820 2.480 2.406 2.546 . 0 0 "[ . 1 . 2]" 1
496 1 23 GLN H 1 23 GLN HB2 . . 3.920 2.271 2.254 2.292 . 0 0 "[ . 1 . 2]" 1
497 1 23 GLN H 1 23 GLN QB . . 3.100 2.246 2.229 2.266 . 0 0 "[ . 1 . 2]" 1
498 1 23 GLN H 1 23 GLN HB3 . . 3.920 3.540 3.519 3.563 . 0 0 "[ . 1 . 2]" 1
499 1 23 GLN H 1 23 GLN HE21 . . 4.530 4.227 4.014 4.529 . 0 0 "[ . 1 . 2]" 1
500 1 23 GLN H 1 23 GLN HG2 . . 3.580 3.116 2.993 3.265 . 0 0 "[ . 1 . 2]" 1
501 1 23 GLN H 1 24 GLY H . . 3.280 2.330 2.279 2.418 . 0 0 "[ . 1 . 2]" 1
502 1 23 GLN HA 1 23 GLN HE21 . . 4.000 2.219 1.952 3.094 . 0 0 "[ . 1 . 2]" 1
503 1 23 GLN HA 1 23 GLN HE22 . . 4.080 3.212 3.083 3.481 . 0 0 "[ . 1 . 2]" 1
504 1 23 GLN HA 1 23 GLN HG2 . . 3.240 2.705 2.509 2.827 . 0 0 "[ . 1 . 2]" 1
505 1 23 GLN QB 1 24 GLY H . . 3.870 3.352 3.325 3.402 . 0 0 "[ . 1 . 2]" 1
506 1 23 GLN HE22 1 23 GLN HG2 . . 3.670 3.482 3.436 3.511 . 0 0 "[ . 1 . 2]" 1
507 1 24 GLY H 1 25 VAL MG2 . . 4.720 4.103 3.953 4.264 . 0 0 "[ . 1 . 2]" 1
508 1 24 GLY QA 1 25 VAL HB . . 5.340 5.089 4.926 5.162 . 0 0 "[ . 1 . 2]" 1
509 1 24 GLY QA 1 25 VAL MG2 . . 4.300 3.386 3.287 3.510 . 0 0 "[ . 1 . 2]" 1
510 1 25 VAL HA 1 25 VAL MG1 . . 3.050 2.173 2.118 2.358 . 0 0 "[ . 1 . 2]" 1
511 1 25 VAL HA 1 25 VAL MG2 . . 3.080 2.458 2.416 2.525 . 0 0 "[ . 1 . 2]" 1
512 1 25 VAL HA 1 26 ILE HB . . 5.210 4.625 4.611 4.632 . 0 0 "[ . 1 . 2]" 1
513 1 25 VAL HA 1 26 ILE MD . . 4.540 4.512 4.449 4.544 0.004 6 0 "[ . 1 . 2]" 1
514 1 25 VAL HA 1 26 ILE HG12 . . 4.800 3.922 3.898 3.962 . 0 0 "[ . 1 . 2]" 1
515 1 25 VAL HA 1 26 ILE MG . . 5.470 5.480 5.479 5.482 0.012 12 0 "[ . 1 . 2]" 1
516 1 25 VAL HA 1 27 LEU QD . . 5.280 4.609 3.901 5.291 0.011 12 0 "[ . 1 . 2]" 1
517 1 25 VAL HA 2 44 GLN QB . . 5.160 4.238 4.046 4.445 . 0 0 "[ . 1 . 2]" 1
518 1 25 VAL HA 2 44 GLN HG2 . . 5.470 3.519 3.069 4.860 . 0 0 "[ . 1 . 2]" 1
519 1 25 VAL HA 2 44 GLN QG . . 4.680 3.269 3.015 3.838 . 0 0 "[ . 1 . 2]" 1
520 1 25 VAL HA 2 44 GLN HG3 . . 5.470 4.337 3.237 4.771 . 0 0 "[ . 1 . 2]" 1
521 1 25 VAL HA 2 48 VAL QG . . 4.830 4.504 4.468 4.545 . 0 0 "[ . 1 . 2]" 1
522 1 25 VAL HB 2 44 GLN QG . . 4.930 4.223 3.829 4.670 . 0 0 "[ . 1 . 2]" 1
523 1 25 VAL HB 2 47 ARG HD2 . . 4.130 3.950 3.663 4.179 0.049 15 0 "[ . 1 . 2]" 1
524 1 25 VAL HB 2 48 VAL QG . . 4.150 3.006 2.844 3.414 . 0 0 "[ . 1 . 2]" 1
525 1 25 VAL MG1 1 26 ILE HB . . 4.580 4.581 4.444 4.633 0.053 15 0 "[ . 1 . 2]" 1
526 1 25 VAL MG1 1 26 ILE HG12 . . 4.920 4.911 4.866 4.935 0.015 16 0 "[ . 1 . 2]" 1
527 1 25 VAL MG1 1 27 LEU QD . . 2.910 2.352 1.865 2.915 0.005 12 0 "[ . 1 . 2]" 1
528 1 25 VAL MG1 2 44 GLN HA . . 4.660 4.234 4.032 4.654 . 0 0 "[ . 1 . 2]" 1
529 1 25 VAL MG1 2 44 GLN HB2 . . 3.720 3.258 2.845 3.735 0.015 13 0 "[ . 1 . 2]" 1
530 1 25 VAL MG1 2 44 GLN QB . . 3.080 2.153 1.890 2.495 . 0 0 "[ . 1 . 2]" 1
531 1 25 VAL MG1 2 44 GLN HB3 . . 3.720 2.184 1.918 2.534 . 0 0 "[ . 1 . 2]" 1
532 1 25 VAL MG1 2 44 GLN HG2 . . 3.860 2.696 2.261 3.702 . 0 0 "[ . 1 . 2]" 1
533 1 25 VAL MG1 2 44 GLN QG . . 3.380 2.312 2.028 2.764 . 0 0 "[ . 1 . 2]" 1
534 1 25 VAL MG1 2 44 GLN HG3 . . 3.860 2.603 2.244 3.796 . 0 0 "[ . 1 . 2]" 1
535 1 25 VAL MG1 2 47 ARG HD2 . . 3.940 3.213 2.806 3.399 . 0 0 "[ . 1 . 2]" 1
536 1 25 VAL MG1 2 47 ARG HD3 . . 4.760 3.997 3.511 4.427 . 0 0 "[ . 1 . 2]" 1
537 1 25 VAL MG1 2 48 VAL HA . . 4.340 4.306 4.105 4.371 0.031 5 0 "[ . 1 . 2]" 1
538 1 25 VAL MG1 2 48 VAL QG . . 2.730 1.790 1.744 1.838 . 0 0 "[ . 1 . 2]" 1
539 1 25 VAL MG2 2 44 GLN HA . . 4.520 4.406 4.099 4.568 0.048 13 0 "[ . 1 . 2]" 1
540 1 25 VAL MG2 2 44 GLN QB . . 3.430 3.221 2.794 3.405 . 0 0 "[ . 1 . 2]" 1
541 1 25 VAL MG2 2 44 GLN QE . . 5.070 3.377 2.093 4.543 . 0 0 "[ . 1 . 2]" 1
542 1 25 VAL MG2 2 44 GLN HG2 . . 3.570 2.621 2.141 3.633 0.063 18 0 "[ . 1 . 2]" 1
543 1 25 VAL MG2 2 44 GLN HG3 . . 3.570 2.216 1.961 3.603 0.033 19 0 "[ . 1 . 2]" 1
544 1 25 VAL MG2 2 47 ARG HD2 . . 3.900 1.974 1.874 2.126 . 0 0 "[ . 1 . 2]" 1
545 1 25 VAL MG2 2 47 ARG HD3 . . 3.980 3.205 2.978 3.377 . 0 0 "[ . 1 . 2]" 1
546 1 25 VAL MG2 2 48 VAL HA . . 4.700 4.548 4.435 4.634 . 0 0 "[ . 1 . 2]" 1
547 1 25 VAL MG2 2 48 VAL QG . . 2.870 2.777 2.677 2.874 0.004 12 0 "[ . 1 . 2]" 1
548 1 25 VAL MG2 2 51 GLU HG2 . . 5.500 5.556 5.512 5.651 0.151 13 0 "[ . 1 . 2]" 1
549 1 25 VAL MG2 2 51 GLU HG3 . . 5.500 5.342 5.034 5.498 . 0 0 "[ . 1 . 2]" 1
550 1 26 ILE H 1 26 ILE MD . . 5.500 3.361 3.299 3.402 . 0 0 "[ . 1 . 2]" 1
551 1 26 ILE HA 1 26 ILE MD . . 2.840 2.055 1.988 2.080 . 0 0 "[ . 1 . 2]" 1
552 1 26 ILE HA 1 26 ILE HG12 . . 3.650 3.065 3.045 3.095 . 0 0 "[ . 1 . 2]" 1
553 1 26 ILE HA 1 26 ILE HG13 . . 3.810 3.711 3.697 3.720 . 0 0 "[ . 1 . 2]" 1
554 1 26 ILE HA 1 26 ILE MG . . 3.000 2.334 2.301 2.392 . 0 0 "[ . 1 . 2]" 1
555 1 26 ILE HA 1 27 LEU H . . 3.060 2.165 2.146 2.172 . 0 0 "[ . 1 . 2]" 1
556 1 26 ILE HA 1 27 LEU HA . . 5.110 4.402 4.394 4.409 . 0 0 "[ . 1 . 2]" 1
557 1 26 ILE HA 1 27 LEU QD . . 4.690 3.926 3.149 4.575 . 0 0 "[ . 1 . 2]" 1
558 1 26 ILE HB 1 26 ILE MD . . 3.360 3.224 3.217 3.230 . 0 0 "[ . 1 . 2]" 1
559 1 26 ILE HG12 1 26 ILE MG . . 3.220 3.194 3.185 3.202 . 0 0 "[ . 1 . 2]" 1
560 1 26 ILE HG13 1 26 ILE MG . . 3.040 2.285 2.242 2.358 . 0 0 "[ . 1 . 2]" 1
561 1 26 ILE MG 1 27 LEU HA . . 4.200 3.600 3.477 3.715 . 0 0 "[ . 1 . 2]" 1
562 1 26 ILE MG 1 28 THR HA . . 5.210 4.662 4.620 4.710 . 0 0 "[ . 1 . 2]" 1
563 1 27 LEU H 1 27 LEU MD1 . . 5.500 4.297 4.177 4.463 . 0 0 "[ . 1 . 2]" 1
564 1 27 LEU H 1 27 LEU MD2 . . 5.500 3.428 2.606 4.059 . 0 0 "[ . 1 . 2]" 1
565 1 27 LEU HA 1 27 LEU MD1 . . 4.160 3.075 1.961 3.816 . 0 0 "[ . 1 . 2]" 1
566 1 27 LEU HA 1 27 LEU QD . . 3.140 1.964 1.901 2.118 . 0 0 "[ . 1 . 2]" 1
567 1 27 LEU HA 1 27 LEU MD2 . . 4.160 2.162 1.929 2.596 . 0 0 "[ . 1 . 2]" 1
568 1 27 LEU HA 1 28 THR H . . 3.070 2.382 2.366 2.401 . 0 0 "[ . 1 . 2]" 1
569 1 27 LEU HA 1 28 THR HB . . 5.300 5.218 5.152 5.261 . 0 0 "[ . 1 . 2]" 1
570 1 27 LEU HA 1 28 THR MG . . 5.500 5.015 4.964 5.092 . 0 0 "[ . 1 . 2]" 1
571 1 27 LEU HA 2 39 LEU HA . . 4.600 3.070 2.915 3.215 . 0 0 "[ . 1 . 2]" 1
572 1 27 LEU HA 2 39 LEU HB2 . . 4.310 3.983 3.870 4.150 . 0 0 "[ . 1 . 2]" 1
573 1 27 LEU HA 2 39 LEU HG . . 5.500 5.485 5.419 5.540 0.040 17 0 "[ . 1 . 2]" 1
574 1 27 LEU HA 2 48 VAL QG . . 5.420 4.825 4.659 4.985 . 0 0 "[ . 1 . 2]" 1
575 1 27 LEU HB2 1 27 LEU MD1 . . 3.310 2.726 2.271 3.186 . 0 0 "[ . 1 . 2]" 1
576 1 27 LEU HB2 1 27 LEU QD . . 2.870 2.306 2.225 2.427 . 0 0 "[ . 1 . 2]" 1
577 1 27 LEU HB2 1 27 LEU MD2 . . 3.310 2.824 2.301 3.195 . 0 0 "[ . 1 . 2]" 1
578 1 27 LEU HB2 1 28 THR H . . 4.130 3.840 3.737 3.942 . 0 0 "[ . 1 . 2]" 1
579 1 27 LEU HB2 2 39 LEU MD1 . . 5.500 4.835 4.685 4.936 . 0 0 "[ . 1 . 2]" 1
580 1 27 LEU HB3 1 27 LEU QD . . 2.920 2.139 2.041 2.306 . 0 0 "[ . 1 . 2]" 1
581 1 27 LEU HB3 1 28 THR H . . 3.580 2.497 2.422 2.582 . 0 0 "[ . 1 . 2]" 1
582 1 27 LEU HB3 1 28 THR HB . . 5.500 5.524 5.487 5.568 0.068 15 0 "[ . 1 . 2]" 1
583 1 27 LEU HB3 2 38 TRP H . . 5.420 4.516 4.267 4.704 . 0 0 "[ . 1 . 2]" 1
584 1 27 LEU QD 1 28 THR H . . 3.800 2.737 2.313 3.091 . 0 0 "[ . 1 . 2]" 1
585 1 27 LEU QD 1 28 THR HA . . 5.440 4.858 4.539 5.044 . 0 0 "[ . 1 . 2]" 1
586 1 27 LEU QD 2 37 VAL HA . . 4.930 4.374 3.882 4.625 . 0 0 "[ . 1 . 2]" 1
587 1 27 LEU QD 2 37 VAL HB . . 4.200 4.054 3.087 4.244 0.044 11 0 "[ . 1 . 2]" 1
588 1 27 LEU QD 2 37 VAL QG . . 3.070 2.109 1.789 2.687 . 0 0 "[ . 1 . 2]" 1
589 1 27 LEU QD 2 39 LEU H . . 5.440 3.819 3.545 4.042 . 0 0 "[ . 1 . 2]" 1
590 1 27 LEU QD 2 39 LEU HA . . 3.280 2.590 2.296 2.769 . 0 0 "[ . 1 . 2]" 1
591 1 27 LEU QD 2 39 LEU HB2 . . 3.790 1.986 1.873 2.171 . 0 0 "[ . 1 . 2]" 1
592 1 27 LEU QD 2 39 LEU HB3 . . 4.050 3.375 3.254 3.539 . 0 0 "[ . 1 . 2]" 1
593 1 27 LEU QD 2 48 VAL HA . . 4.810 4.319 4.038 4.492 . 0 0 "[ . 1 . 2]" 1
594 1 27 LEU QD 2 48 VAL HB . . 4.280 2.930 2.569 3.209 . 0 0 "[ . 1 . 2]" 1
595 1 27 LEU QD 2 48 VAL QG . . 2.630 2.032 1.829 2.334 . 0 0 "[ . 1 . 2]" 1
596 1 27 LEU MD1 2 48 VAL HA . . 5.500 4.924 4.272 5.563 0.063 15 0 "[ . 1 . 2]" 1
597 1 27 LEU MD1 2 48 VAL HB . . 5.500 3.224 2.738 3.583 . 0 0 "[ . 1 . 2]" 1
598 1 27 LEU MD1 2 48 VAL MG1 . . 4.210 2.752 2.288 3.413 . 0 0 "[ . 1 . 2]" 1
599 1 27 LEU MD1 2 48 VAL MG2 . . 4.210 3.558 2.991 4.005 . 0 0 "[ . 1 . 2]" 1
600 1 27 LEU MD2 2 48 VAL HA . . 5.500 4.940 4.504 5.234 . 0 0 "[ . 1 . 2]" 1
601 1 27 LEU MD2 2 48 VAL HB . . 5.500 3.388 3.110 3.651 . 0 0 "[ . 1 . 2]" 1
602 1 27 LEU MD2 2 48 VAL MG1 . . 4.210 2.202 1.892 2.640 . 0 0 "[ . 1 . 2]" 1
603 1 27 LEU MD2 2 48 VAL MG2 . . 4.210 3.265 2.779 3.846 . 0 0 "[ . 1 . 2]" 1
604 1 28 THR H 1 28 THR HB . . 4.200 3.199 3.132 3.230 . 0 0 "[ . 1 . 2]" 1
605 1 28 THR H 1 28 THR MG . . 4.050 3.877 3.852 3.905 . 0 0 "[ . 1 . 2]" 1
606 1 28 THR H 2 38 TRP H . . 3.830 3.052 2.850 3.131 . 0 0 "[ . 1 . 2]" 1
607 1 28 THR HA 1 28 THR HB . . 3.020 2.921 2.908 2.943 . 0 0 "[ . 1 . 2]" 1
608 1 28 THR HA 1 28 THR MG . . 2.810 2.040 2.009 2.099 . 0 0 "[ . 1 . 2]" 1
609 1 28 THR HA 1 29 ILE H . . 3.330 2.252 2.176 2.311 . 0 0 "[ . 1 . 2]" 1
610 1 28 THR HA 1 29 ILE HA . . 5.040 4.412 4.386 4.424 . 0 0 "[ . 1 . 2]" 1
611 1 28 THR HA 1 29 ILE HB . . 4.690 4.519 4.475 4.575 . 0 0 "[ . 1 . 2]" 1
612 1 28 THR HA 1 29 ILE MD . . 5.500 4.528 4.334 4.690 . 0 0 "[ . 1 . 2]" 1
613 1 28 THR HA 1 29 ILE HG12 . . 5.090 3.650 3.569 3.768 . 0 0 "[ . 1 . 2]" 1
614 1 28 THR HA 1 29 ILE HG13 . . 5.490 5.309 5.245 5.380 . 0 0 "[ . 1 . 2]" 1
615 1 28 THR HB 1 29 ILE H . . 3.620 3.349 3.208 3.664 0.044 12 0 "[ . 1 . 2]" 1
616 1 28 THR HB 1 29 ILE MD . . 5.430 5.073 4.825 5.283 . 0 0 "[ . 1 . 2]" 1
617 1 28 THR HB 1 29 ILE HG12 . . 5.500 5.334 5.270 5.539 0.039 12 0 "[ . 1 . 2]" 1
618 1 28 THR HB 1 30 GLN HG2 . . 5.340 5.307 5.115 5.373 0.033 11 0 "[ . 1 . 2]" 1
619 1 28 THR HB 2 38 TRP HA . . 5.500 5.519 5.421 5.553 0.053 19 0 "[ . 1 . 2]" 1
620 1 28 THR HB 2 38 TRP HH2 . . 4.930 3.917 3.849 4.017 . 0 0 "[ . 1 . 2]" 1
621 1 28 THR MG 1 29 ILE HB . . 4.780 4.743 4.583 4.819 0.039 13 0 "[ . 1 . 2]" 1
622 1 28 THR MG 1 30 GLN HG2 . . 4.630 4.586 4.321 4.658 0.028 11 0 "[ . 1 . 2]" 1
623 1 29 ILE H 1 29 ILE HB . . 3.140 2.632 2.549 2.672 . 0 0 "[ . 1 . 2]" 1
624 1 29 ILE H 1 29 ILE MD . . 4.110 3.851 3.728 3.924 . 0 0 "[ . 1 . 2]" 1
625 1 29 ILE H 1 29 ILE HG13 . . 5.200 4.214 3.994 4.287 . 0 0 "[ . 1 . 2]" 1
626 1 29 ILE HA 1 29 ILE MD . . 3.550 1.979 1.948 2.043 . 0 0 "[ . 1 . 2]" 1
627 1 29 ILE HA 1 29 ILE MG . . 3.250 2.409 2.338 2.441 . 0 0 "[ . 1 . 2]" 1
628 1 29 ILE HA 1 30 GLN H . . 3.020 2.228 2.217 2.243 . 0 0 "[ . 1 . 2]" 1
629 1 29 ILE HA 1 30 GLN HA . . 4.430 4.406 4.401 4.411 . 0 0 "[ . 1 . 2]" 1
630 1 29 ILE HA 1 30 GLN HG2 . . 5.160 5.116 5.032 5.173 0.013 19 0 "[ . 1 . 2]" 1
631 1 29 ILE HA 2 37 VAL HA . . 3.850 2.628 2.410 2.727 . 0 0 "[ . 1 . 2]" 1
632 1 29 ILE HA 2 37 VAL MG1 . . 4.840 3.793 3.408 3.889 . 0 0 "[ . 1 . 2]" 1
633 1 29 ILE HA 2 37 VAL QG . . 4.170 3.290 3.241 3.353 . 0 0 "[ . 1 . 2]" 1
634 1 29 ILE HA 2 37 VAL MG2 . . 4.840 3.660 3.520 4.986 0.146 12 0 "[ . 1 . 2]" 1
635 1 29 ILE HB 1 30 GLN H . . 4.410 3.980 3.937 4.047 . 0 0 "[ . 1 . 2]" 1
636 1 29 ILE HB 2 37 VAL HA . . 5.500 5.395 5.288 5.492 . 0 0 "[ . 1 . 2]" 1
637 1 29 ILE MD 1 30 GLN HA . . 5.500 5.561 5.510 5.627 0.127 12 0 "[ . 1 . 2]" 1
638 1 29 ILE MD 2 35 SER HA . . 5.500 4.523 4.301 4.649 . 0 0 "[ . 1 . 2]" 1
639 1 29 ILE MD 2 35 SER HB2 . . 4.000 3.792 3.445 4.023 0.023 16 0 "[ . 1 . 2]" 1
640 1 29 ILE MD 2 35 SER HB3 . . 5.500 3.147 2.744 3.560 . 0 0 "[ . 1 . 2]" 1
641 1 29 ILE MD 2 37 VAL HA . . 4.140 2.182 1.978 2.387 . 0 0 "[ . 1 . 2]" 1
642 1 29 ILE MD 2 37 VAL QG . . 3.750 1.756 1.670 1.848 . 0 0 "[ . 1 . 2]" 1
643 1 29 ILE MD 2 38 TRP HD1 . . 5.060 4.451 4.307 4.629 . 0 0 "[ . 1 . 2]" 1
644 1 29 ILE HG12 2 35 SER HB3 . . 5.500 5.475 5.259 5.554 0.054 3 0 "[ . 1 . 2]" 1
645 1 29 ILE HG12 2 37 VAL HA . . 5.500 4.229 4.123 4.303 . 0 0 "[ . 1 . 2]" 1
646 1 29 ILE HG13 2 37 VAL HA . . 5.500 5.099 4.992 5.229 . 0 0 "[ . 1 . 2]" 1
647 1 29 ILE MG 1 30 GLN HA . . 4.430 3.468 3.445 3.601 . 0 0 "[ . 1 . 2]" 1
648 1 29 ILE MG 1 30 GLN HG2 . . 5.020 4.992 4.963 5.035 0.015 6 0 "[ . 1 . 2]" 1
649 1 29 ILE MG 1 31 GLN HA . . 4.020 3.766 3.717 3.858 . 0 0 "[ . 1 . 2]" 1
650 1 29 ILE MG 1 31 GLN HB2 . . 3.950 3.704 3.269 3.976 0.026 7 0 "[ . 1 . 2]" 1
651 1 29 ILE MG 1 31 GLN QG . . 3.540 3.311 3.033 3.578 0.038 2 0 "[ . 1 . 2]" 1
652 1 29 ILE MG 2 35 SER HA . . 4.010 2.855 2.694 2.984 . 0 0 "[ . 1 . 2]" 1
653 1 29 ILE MG 2 35 SER HB2 . . 3.610 3.243 2.833 3.497 . 0 0 "[ . 1 . 2]" 1
654 1 29 ILE MG 2 35 SER HB3 . . 3.300 1.972 1.902 2.118 . 0 0 "[ . 1 . 2]" 1
655 1 29 ILE MG 2 36 ASP HA . . 5.500 4.645 4.534 4.771 . 0 0 "[ . 1 . 2]" 1
656 1 29 ILE MG 2 36 ASP QB . . 5.340 4.538 4.442 4.786 . 0 0 "[ . 1 . 2]" 1
657 1 29 ILE MG 2 37 VAL HA . . 5.500 3.992 3.870 4.211 . 0 0 "[ . 1 . 2]" 1
658 1 30 GLN H 1 30 GLN HB2 . . 3.700 2.451 2.429 2.476 . 0 0 "[ . 1 . 2]" 1
659 1 30 GLN H 1 30 GLN HB3 . . 3.780 3.499 3.456 3.521 . 0 0 "[ . 1 . 2]" 1
660 1 30 GLN H 1 30 GLN HG2 . . 5.500 4.015 3.971 4.036 . 0 0 "[ . 1 . 2]" 1
661 1 30 GLN H 2 36 ASP H . . 3.640 2.599 2.402 2.938 . 0 0 "[ . 1 . 2]" 1
662 1 30 GLN H 2 36 ASP HA . . 5.200 4.325 4.287 4.406 . 0 0 "[ . 1 . 2]" 1
663 1 30 GLN H 2 36 ASP HB2 . . 4.980 3.965 3.270 5.057 0.077 12 0 "[ . 1 . 2]" 1
664 1 30 GLN H 2 36 ASP HB3 . . 4.980 3.972 3.359 4.493 . 0 0 "[ . 1 . 2]" 1
665 1 30 GLN H 2 37 VAL HA . . 5.400 3.956 3.665 4.019 . 0 0 "[ . 1 . 2]" 1
666 1 30 GLN H 2 38 TRP HD1 . . 4.100 4.035 3.839 4.144 0.044 12 0 "[ . 1 . 2]" 1
667 1 30 GLN H 2 38 TRP HE1 . . 4.960 2.635 2.450 2.934 . 0 0 "[ . 1 . 2]" 1
668 1 30 GLN HA 1 30 GLN QE . . 4.040 3.455 2.852 4.110 0.070 14 0 "[ . 1 . 2]" 1
669 1 30 GLN HA 1 30 GLN HG2 . . 2.810 2.083 2.068 2.126 . 0 0 "[ . 1 . 2]" 1
670 1 30 GLN HA 1 31 GLN H . . 2.990 2.171 2.164 2.175 . 0 0 "[ . 1 . 2]" 1
671 1 30 GLN HB2 1 30 GLN HG2 . . 2.840 2.813 2.732 2.837 . 0 0 "[ . 1 . 2]" 1
672 1 30 GLN HB2 1 31 GLN HA . . 5.500 5.488 5.424 5.537 0.037 3 0 "[ . 1 . 2]" 1
673 1 30 GLN HB2 1 32 HIS HD2 . . 4.810 4.363 3.905 4.683 . 0 0 "[ . 1 . 2]" 1
674 1 30 GLN HB2 2 36 ASP H . . 4.340 3.063 2.894 3.228 . 0 0 "[ . 1 . 2]" 1
675 1 30 GLN HB2 2 36 ASP HA . . 5.500 4.629 4.501 4.719 . 0 0 "[ . 1 . 2]" 1
676 1 30 GLN HB2 2 36 ASP HB2 . . 4.440 2.852 1.988 4.180 . 0 0 "[ . 1 . 2]" 1
677 1 30 GLN HB2 2 36 ASP QB . . 3.690 2.123 1.976 2.438 . 0 0 "[ . 1 . 2]" 1
678 1 30 GLN HB2 2 36 ASP HB3 . . 4.440 2.853 2.028 3.483 . 0 0 "[ . 1 . 2]" 1
679 1 30 GLN HB2 2 37 VAL HA . . 5.500 5.103 4.739 5.185 . 0 0 "[ . 1 . 2]" 1
680 1 30 GLN HB2 2 38 TRP HE1 . . 3.720 1.901 1.882 1.930 . 0 0 "[ . 1 . 2]" 1
681 1 30 GLN HB3 1 30 GLN HG2 . . 2.990 2.857 2.835 2.919 . 0 0 "[ . 1 . 2]" 1
682 1 30 GLN HB3 1 31 GLN HA . . 5.100 4.673 4.580 4.718 . 0 0 "[ . 1 . 2]" 1
683 1 30 GLN HB3 1 32 HIS HD2 . . 5.000 2.951 2.499 3.184 . 0 0 "[ . 1 . 2]" 1
684 1 30 GLN HB3 2 36 ASP QB . . 4.340 2.812 2.644 2.939 . 0 0 "[ . 1 . 2]" 1
685 1 30 GLN HB3 2 38 TRP HE1 . . 3.640 3.495 3.479 3.519 . 0 0 "[ . 1 . 2]" 1
686 1 30 GLN HG2 2 36 ASP QB . . 5.320 4.721 4.585 5.003 . 0 0 "[ . 1 . 2]" 1
687 1 30 GLN HG2 2 38 TRP HH2 . . 4.350 4.152 4.055 4.299 . 0 0 "[ . 1 . 2]" 1
688 1 30 GLN HG2 2 38 TRP HZ2 . . 4.910 1.982 1.973 1.993 . 0 0 "[ . 1 . 2]" 1
689 1 31 GLN H 1 31 GLN HB2 . . 3.400 2.179 2.127 2.353 . 0 0 "[ . 1 . 2]" 1
690 1 31 GLN H 1 31 GLN HB3 . . 3.580 3.195 2.991 3.368 . 0 0 "[ . 1 . 2]" 1
691 1 31 GLN H 1 31 GLN QG . . 4.100 3.629 3.486 3.888 . 0 0 "[ . 1 . 2]" 1
692 1 31 GLN HA 1 31 GLN HG2 . . 3.410 2.360 2.059 3.282 . 0 0 "[ . 1 . 2]" 1
693 1 31 GLN HA 1 31 GLN HG3 . . 3.410 2.700 2.041 3.066 . 0 0 "[ . 1 . 2]" 1
694 1 31 GLN HA 1 32 HIS H . . 3.170 2.172 2.139 2.250 . 0 0 "[ . 1 . 2]" 1
695 1 31 GLN HA 1 32 HIS HD2 . . 5.500 3.675 3.258 3.777 . 0 0 "[ . 1 . 2]" 1
696 1 31 GLN HA 2 35 SER HA . . 3.350 2.621 2.550 2.705 . 0 0 "[ . 1 . 2]" 1
697 1 31 GLN HA 2 36 ASP H . . 3.960 3.998 3.971 4.041 0.081 19 0 "[ . 1 . 2]" 1
698 1 31 GLN HB3 2 35 SER HA . . 5.370 5.342 5.256 5.393 0.023 17 0 "[ . 1 . 2]" 1
699 1 31 GLN QG 1 32 HIS H . . 4.750 3.539 2.865 3.837 . 0 0 "[ . 1 . 2]" 1
700 1 31 GLN QG 1 32 HIS QB . . 5.180 5.015 4.792 5.330 0.150 2 0 "[ . 1 . 2]" 1
701 1 31 GLN QG 1 32 HIS HD2 . . 5.340 5.341 4.906 5.383 0.043 16 0 "[ . 1 . 2]" 1
702 1 32 HIS H 1 32 HIS HD2 . . 5.500 2.354 2.037 2.878 . 0 0 "[ . 1 . 2]" 1
703 1 32 HIS H 1 32 HIS HE1 . . 5.500 5.519 5.048 5.592 0.092 13 0 "[ . 1 . 2]" 1
704 1 32 HIS HA 1 32 HIS HD2 . . 5.350 2.782 2.572 4.242 . 0 0 "[ . 1 . 2]" 1
705 1 32 HIS HA 1 33 ASN HA . . 5.050 4.565 4.427 4.688 . 0 0 "[ . 1 . 2]" 1
706 1 32 HIS HA 2 34 GLN QB . . 5.190 4.809 4.452 5.196 0.006 2 0 "[ . 1 . 2]" 1
707 1 32 HIS HD2 2 34 GLN QB . . 4.560 3.706 3.333 4.093 . 0 0 "[ . 1 . 2]" 1
708 1 32 HIS HD2 2 36 ASP HB2 . . 5.500 4.420 3.800 5.347 . 0 0 "[ . 1 . 2]" 1
709 1 32 HIS HD2 2 36 ASP QB . . 4.670 3.955 3.736 4.284 . 0 0 "[ . 1 . 2]" 1
710 1 32 HIS HD2 2 36 ASP HB3 . . 5.500 5.031 4.070 5.553 0.053 7 0 "[ . 1 . 2]" 1
711 1 32 HIS HE1 2 34 GLN QB . . 4.680 3.280 2.697 3.677 . 0 0 "[ . 1 . 2]" 1
712 1 33 ASN HA 1 34 GLN HA . . 5.310 4.423 4.369 4.711 . 0 0 "[ . 1 . 2]" 1
713 1 33 ASN HA 1 34 GLN QB . . 4.940 4.332 4.021 4.906 . 0 0 "[ . 1 . 2]" 1
714 1 33 ASN HA 1 34 GLN QG . . 4.770 4.492 3.588 4.794 0.024 5 0 "[ . 1 . 2]" 1
715 1 33 ASN QB 1 33 ASN QD . . 3.100 2.149 2.063 2.376 . 0 0 "[ . 1 . 2]" 1
716 1 34 GLN H 1 34 GLN QB . . 3.260 2.702 2.385 2.879 . 0 0 "[ . 1 . 2]" 1
717 1 34 GLN HA 1 34 GLN QG . . 3.090 2.344 2.074 3.070 . 0 0 "[ . 1 . 2]" 1
718 1 34 GLN QB 2 32 HIS HA . . 5.190 4.809 4.451 5.207 0.017 3 0 "[ . 1 . 2]" 1
719 1 34 GLN QB 2 32 HIS HD2 . . 4.560 3.820 3.499 4.442 . 0 0 "[ . 1 . 2]" 1
720 1 34 GLN QB 2 32 HIS HE1 . . 4.680 3.300 2.763 3.610 . 0 0 "[ . 1 . 2]" 1
721 1 35 SER HA 1 36 ASP H . . 3.240 2.188 2.145 2.234 . 0 0 "[ . 1 . 2]" 1
722 1 35 SER HA 2 13 ALA MB . . 4.400 4.120 3.921 4.253 . 0 0 "[ . 1 . 2]" 1
723 1 35 SER HA 2 29 ILE MD . . 5.500 4.560 4.310 4.673 . 0 0 "[ . 1 . 2]" 1
724 1 35 SER HA 2 29 ILE MG . . 4.010 2.887 2.736 2.976 . 0 0 "[ . 1 . 2]" 1
725 1 35 SER HA 2 31 GLN HA . . 3.350 2.602 2.543 2.704 . 0 0 "[ . 1 . 2]" 1
726 1 35 SER HA 2 31 GLN QB . . 5.220 4.456 4.247 4.596 . 0 0 "[ . 1 . 2]" 1
727 1 35 SER QB 2 7 PHE HB2 . . 5.340 2.373 2.043 2.657 . 0 0 "[ . 1 . 2]" 1
728 1 35 SER QB 2 13 ALA HA . . 4.830 3.887 3.671 4.095 . 0 0 "[ . 1 . 2]" 1
729 1 35 SER QB 2 13 ALA MB . . 2.860 1.909 1.852 2.026 . 0 0 "[ . 1 . 2]" 1
730 1 35 SER QB 2 29 ILE MD . . 3.910 3.003 2.693 3.347 . 0 0 "[ . 1 . 2]" 1
731 1 35 SER QB 2 29 ILE HG12 . . 5.340 5.256 5.126 5.335 . 0 0 "[ . 1 . 2]" 1
732 1 35 SER QB 2 29 ILE MG . . 3.060 1.986 1.898 2.146 . 0 0 "[ . 1 . 2]" 1
733 1 35 SER HB2 2 13 ALA MB . . 3.390 2.151 1.933 2.431 . 0 0 "[ . 1 . 2]" 1
734 1 35 SER HB2 2 29 ILE MG . . 3.610 3.167 2.526 3.562 . 0 0 "[ . 1 . 2]" 1
735 1 35 SER HB3 2 13 ALA MB . . 3.390 2.211 1.965 2.651 . 0 0 "[ . 1 . 2]" 1
736 1 35 SER HB3 2 29 ILE MG . . 3.610 2.016 1.908 2.321 . 0 0 "[ . 1 . 2]" 1
737 1 36 ASP H 1 36 ASP HB2 . . 3.890 2.670 2.125 3.149 . 0 0 "[ . 1 . 2]" 1
738 1 36 ASP H 1 36 ASP QB . . 3.350 2.243 2.101 2.369 . 0 0 "[ . 1 . 2]" 1
739 1 36 ASP H 1 36 ASP HB3 . . 3.890 2.950 2.159 3.613 . 0 0 "[ . 1 . 2]" 1
740 1 36 ASP H 1 37 VAL H . . 5.430 4.500 4.472 4.527 . 0 0 "[ . 1 . 2]" 1
741 1 36 ASP H 2 30 GLN H . . 3.640 2.603 2.430 2.715 . 0 0 "[ . 1 . 2]" 1
742 1 36 ASP H 2 30 GLN HB2 . . 4.340 3.061 3.019 3.117 . 0 0 "[ . 1 . 2]" 1
743 1 36 ASP H 2 31 GLN HA . . 3.960 4.002 3.980 4.044 0.084 15 0 "[ . 1 . 2]" 1
744 1 36 ASP HA 1 37 VAL H . . 3.060 2.149 2.143 2.155 . 0 0 "[ . 1 . 2]" 1
745 1 36 ASP HA 1 37 VAL QG . . 4.660 3.460 3.385 3.511 . 0 0 "[ . 1 . 2]" 1
746 1 36 ASP HA 2 3 MET ME . . 3.770 2.982 2.744 3.195 . 0 0 "[ . 1 . 2]" 1
747 1 36 ASP HA 2 6 SER HA . . 3.340 2.303 2.160 2.394 . 0 0 "[ . 1 . 2]" 1
748 1 36 ASP HA 2 6 SER QB . . 3.960 3.155 2.984 3.300 . 0 0 "[ . 1 . 2]" 1
749 1 36 ASP HA 2 29 ILE MG . . 5.500 4.653 4.567 4.713 . 0 0 "[ . 1 . 2]" 1
750 1 36 ASP HA 2 30 GLN H . . 5.200 4.338 4.301 4.376 . 0 0 "[ . 1 . 2]" 1
751 1 36 ASP HA 2 30 GLN HB2 . . 5.500 4.642 4.560 4.744 . 0 0 "[ . 1 . 2]" 1
752 1 36 ASP QB 2 3 MET ME . . 2.930 2.745 2.405 2.972 0.042 11 0 "[ . 1 . 2]" 1
753 1 36 ASP QB 2 3 MET HG2 . . 4.720 4.382 3.921 4.833 0.113 2 0 "[ . 1 . 2]" 1
754 1 36 ASP QB 2 3 MET HG3 . . 4.810 4.249 3.820 4.747 . 0 0 "[ . 1 . 2]" 1
755 1 36 ASP QB 2 6 SER HA . . 4.750 4.077 3.811 4.515 . 0 0 "[ . 1 . 2]" 1
756 1 36 ASP QB 2 29 ILE MG . . 5.340 4.542 4.477 4.593 . 0 0 "[ . 1 . 2]" 1
757 1 36 ASP QB 2 30 GLN HB2 . . 3.690 2.127 1.971 2.348 . 0 0 "[ . 1 . 2]" 1
758 1 36 ASP QB 2 30 GLN HB3 . . 4.340 2.840 2.653 2.945 . 0 0 "[ . 1 . 2]" 1
759 1 36 ASP QB 2 30 GLN HG2 . . 5.320 4.739 4.576 4.968 . 0 0 "[ . 1 . 2]" 1
760 1 36 ASP QB 2 32 HIS HD2 . . 4.670 4.006 3.536 4.435 . 0 0 "[ . 1 . 2]" 1
761 1 36 ASP HB2 2 3 MET HG3 . . 5.500 5.320 4.897 5.652 0.152 18 0 "[ . 1 . 2]" 1
762 1 36 ASP HB2 2 30 GLN H . . 4.980 4.039 3.307 4.900 . 0 0 "[ . 1 . 2]" 1
763 1 36 ASP HB2 2 30 GLN HB2 . . 4.440 2.933 1.982 4.068 . 0 0 "[ . 1 . 2]" 1
764 1 36 ASP HB2 2 32 HIS HD2 . . 5.500 4.553 3.590 5.544 0.044 2 0 "[ . 1 . 2]" 1
765 1 36 ASP HB3 2 3 MET HG3 . . 5.500 4.691 3.898 5.590 0.090 4 0 "[ . 1 . 2]" 1
766 1 36 ASP HB3 2 30 GLN H . . 4.980 3.945 3.301 4.509 . 0 0 "[ . 1 . 2]" 1
767 1 36 ASP HB3 2 30 GLN HB2 . . 4.440 2.827 2.011 3.508 . 0 0 "[ . 1 . 2]" 1
768 1 36 ASP HB3 2 32 HIS HD2 . . 5.500 5.007 4.162 5.549 0.049 6 0 "[ . 1 . 2]" 1
769 1 37 VAL H 2 4 ILE MG . . 5.500 5.502 5.444 5.545 0.045 13 0 "[ . 1 . 2]" 1
770 1 37 VAL H 2 5 THR H . . 3.940 3.424 3.388 3.456 . 0 0 "[ . 1 . 2]" 1
771 1 37 VAL H 2 5 THR MG . . 5.500 3.510 3.346 3.665 . 0 0 "[ . 1 . 2]" 1
772 1 37 VAL H 2 6 SER HA . . 3.950 2.560 2.504 2.628 . 0 0 "[ . 1 . 2]" 1
773 1 37 VAL H 2 7 PHE H . . 4.760 3.818 3.656 4.261 . 0 0 "[ . 1 . 2]" 1
774 1 37 VAL H 2 7 PHE HB2 . . 5.500 5.279 5.112 5.495 . 0 0 "[ . 1 . 2]" 1
775 1 37 VAL HA 1 37 VAL MG1 . . 3.350 2.236 2.179 2.342 . 0 0 "[ . 1 . 2]" 1
776 1 37 VAL HA 1 37 VAL MG2 . . 3.350 2.456 2.422 2.525 . 0 0 "[ . 1 . 2]" 1
777 1 37 VAL HA 1 38 TRP H . . 3.000 2.141 2.139 2.143 . 0 0 "[ . 1 . 2]" 1
778 1 37 VAL HA 1 38 TRP HD1 . . 4.180 2.946 2.863 3.017 . 0 0 "[ . 1 . 2]" 1
779 1 37 VAL HA 2 4 ILE HB . . 5.150 4.562 4.503 4.621 . 0 0 "[ . 1 . 2]" 1
780 1 37 VAL HA 2 4 ILE MG . . 5.500 5.512 5.461 5.553 0.053 4 0 "[ . 1 . 2]" 1
781 1 37 VAL HA 2 27 LEU QD . . 4.930 4.332 3.849 4.673 . 0 0 "[ . 1 . 2]" 1
782 1 37 VAL HA 2 29 ILE HA . . 3.850 2.634 2.585 2.664 . 0 0 "[ . 1 . 2]" 1
783 1 37 VAL HA 2 29 ILE HB . . 5.500 5.390 5.336 5.426 . 0 0 "[ . 1 . 2]" 1
784 1 37 VAL HA 2 29 ILE MD . . 4.140 2.154 1.987 2.407 . 0 0 "[ . 1 . 2]" 1
785 1 37 VAL HA 2 29 ILE HG12 . . 5.500 4.222 4.124 4.380 . 0 0 "[ . 1 . 2]" 1
786 1 37 VAL HA 2 29 ILE HG13 . . 5.500 5.077 5.004 5.153 . 0 0 "[ . 1 . 2]" 1
787 1 37 VAL HA 2 29 ILE MG . . 5.500 3.972 3.848 4.060 . 0 0 "[ . 1 . 2]" 1
788 1 37 VAL HA 2 30 GLN H . . 5.400 3.979 3.910 4.011 . 0 0 "[ . 1 . 2]" 1
789 1 37 VAL HA 2 30 GLN HB2 . . 5.500 5.143 5.055 5.193 . 0 0 "[ . 1 . 2]" 1
790 1 37 VAL HB 1 38 TRP HA . . 4.980 4.579 4.502 4.618 . 0 0 "[ . 1 . 2]" 1
791 1 37 VAL HB 1 38 TRP HD1 . . 4.950 4.898 4.835 4.954 0.004 8 0 "[ . 1 . 2]" 1
792 1 37 VAL HB 2 4 ILE HB . . 4.470 2.647 2.529 2.761 . 0 0 "[ . 1 . 2]" 1
793 1 37 VAL HB 2 4 ILE MG . . 4.710 3.357 3.230 3.415 . 0 0 "[ . 1 . 2]" 1
794 1 37 VAL HB 2 5 THR MG . . 4.000 2.103 1.936 2.294 . 0 0 "[ . 1 . 2]" 1
795 1 37 VAL HB 2 6 SER HA . . 5.500 4.392 4.261 4.620 . 0 0 "[ . 1 . 2]" 1
796 1 37 VAL HB 2 7 PHE QD . . 5.060 4.711 4.126 4.916 . 0 0 "[ . 1 . 2]" 1
797 1 37 VAL HB 2 27 LEU QD . . 4.200 4.079 3.815 4.241 0.041 14 0 "[ . 1 . 2]" 1
798 1 37 VAL QG 1 38 TRP H . . 3.350 2.784 2.658 2.880 . 0 0 "[ . 1 . 2]" 1
799 1 37 VAL QG 1 38 TRP HA . . 4.330 3.771 3.630 3.888 . 0 0 "[ . 1 . 2]" 1
800 1 37 VAL QG 1 38 TRP HD1 . . 4.400 4.018 3.956 4.080 . 0 0 "[ . 1 . 2]" 1
801 1 37 VAL QG 2 4 ILE HB . . 3.350 2.193 1.974 2.680 . 0 0 "[ . 1 . 2]" 1
802 1 37 VAL QG 2 4 ILE MG . . 3.550 2.833 2.733 2.934 . 0 0 "[ . 1 . 2]" 1
803 1 37 VAL QG 2 5 THR MG . . 2.910 1.999 1.853 2.146 . 0 0 "[ . 1 . 2]" 1
804 1 37 VAL QG 2 6 SER HA . . 3.330 3.236 3.000 3.352 0.022 15 0 "[ . 1 . 2]" 1
805 1 37 VAL QG 2 6 SER QB . . 5.260 4.601 4.421 4.694 . 0 0 "[ . 1 . 2]" 1
806 1 37 VAL QG 2 7 PHE HA . . 5.090 4.789 4.653 4.976 . 0 0 "[ . 1 . 2]" 1
807 1 37 VAL QG 2 7 PHE HB2 . . 3.700 3.365 3.271 3.618 . 0 0 "[ . 1 . 2]" 1
808 1 37 VAL QG 2 7 PHE QD . . 3.440 2.256 1.881 2.399 . 0 0 "[ . 1 . 2]" 1
809 1 37 VAL QG 2 13 ALA HA . . 3.330 3.226 3.117 3.337 0.007 4 0 "[ . 1 . 2]" 1
810 1 37 VAL QG 2 13 ALA MB . . 3.410 3.207 3.075 3.309 . 0 0 "[ . 1 . 2]" 1
811 1 37 VAL QG 2 16 PHE QD . . 4.640 4.040 3.627 4.155 . 0 0 "[ . 1 . 2]" 1
812 1 37 VAL QG 2 16 PHE QE . . 5.440 5.064 4.887 5.182 . 0 0 "[ . 1 . 2]" 1
813 1 37 VAL QG 2 27 LEU QD . . 3.070 2.058 1.769 2.269 . 0 0 "[ . 1 . 2]" 1
814 1 37 VAL QG 2 29 ILE HA . . 4.170 3.283 3.235 3.340 . 0 0 "[ . 1 . 2]" 1
815 1 37 VAL QG 2 29 ILE MD . . 3.750 1.735 1.676 1.793 . 0 0 "[ . 1 . 2]" 1
816 1 37 VAL MG1 2 5 THR MG . . 3.600 2.881 2.655 3.054 . 0 0 "[ . 1 . 2]" 1
817 1 37 VAL MG1 2 7 PHE QD . . 4.340 4.260 4.135 4.356 0.016 20 0 "[ . 1 . 2]" 1
818 1 37 VAL MG1 2 29 ILE HA . . 4.840 3.812 3.643 3.945 . 0 0 "[ . 1 . 2]" 1
819 1 37 VAL MG2 2 5 THR MG . . 3.600 2.039 1.891 2.199 . 0 0 "[ . 1 . 2]" 1
820 1 37 VAL MG2 2 7 PHE QD . . 4.340 2.265 1.883 2.411 . 0 0 "[ . 1 . 2]" 1
821 1 37 VAL MG2 2 29 ILE HA . . 4.840 3.585 3.508 3.643 . 0 0 "[ . 1 . 2]" 1
822 1 38 TRP H 1 38 TRP HB2 . . 3.780 3.581 3.565 3.599 . 0 0 "[ . 1 . 2]" 1
823 1 38 TRP H 1 38 TRP HD1 . . 3.770 2.514 2.455 2.572 . 0 0 "[ . 1 . 2]" 1
824 1 38 TRP H 2 27 LEU HB3 . . 5.420 4.613 4.403 4.809 . 0 0 "[ . 1 . 2]" 1
825 1 38 TRP H 2 28 THR H . . 3.830 3.120 3.063 3.184 . 0 0 "[ . 1 . 2]" 1
826 1 38 TRP HA 1 39 LEU HA . . 4.480 4.397 4.385 4.411 . 0 0 "[ . 1 . 2]" 1
827 1 38 TRP HA 2 1 MET HB3 . . 5.500 5.563 5.511 5.599 0.099 20 0 "[ . 1 . 2]" 1
828 1 38 TRP HA 2 1 MET ME . . 4.800 4.316 4.261 4.483 . 0 0 "[ . 1 . 2]" 1
829 1 38 TRP HA 2 3 MET HA . . 3.470 2.049 1.982 2.145 . 0 0 "[ . 1 . 2]" 1
830 1 38 TRP HA 2 3 MET HB2 . . 5.000 4.692 4.590 4.779 . 0 0 "[ . 1 . 2]" 1
831 1 38 TRP HA 2 3 MET HB3 . . 5.000 4.861 4.767 4.954 . 0 0 "[ . 1 . 2]" 1
832 1 38 TRP HA 2 3 MET ME . . 5.190 4.766 4.660 4.918 . 0 0 "[ . 1 . 2]" 1
833 1 38 TRP HA 2 3 MET HG2 . . 3.700 3.416 3.349 3.499 . 0 0 "[ . 1 . 2]" 1
834 1 38 TRP HA 2 3 MET HG3 . . 4.410 4.109 3.845 4.276 . 0 0 "[ . 1 . 2]" 1
835 1 38 TRP HA 2 4 ILE HB . . 5.500 3.563 3.458 3.624 . 0 0 "[ . 1 . 2]" 1
836 1 38 TRP HA 2 4 ILE MD . . 5.500 4.196 4.076 4.324 . 0 0 "[ . 1 . 2]" 1
837 1 38 TRP HA 2 4 ILE HG12 . . 4.440 2.917 2.784 3.072 . 0 0 "[ . 1 . 2]" 1
838 1 38 TRP HA 2 4 ILE MG . . 5.500 4.924 4.836 4.973 . 0 0 "[ . 1 . 2]" 1
839 1 38 TRP HA 2 5 THR H . . 4.270 3.944 3.894 3.994 . 0 0 "[ . 1 . 2]" 1
840 1 38 TRP HA 2 28 THR HB . . 5.500 5.480 5.421 5.560 0.060 14 0 "[ . 1 . 2]" 1
841 1 38 TRP HB2 1 38 TRP HZ3 . . 5.500 4.822 4.821 4.823 . 0 0 "[ . 1 . 2]" 1
842 1 38 TRP HB2 1 40 ALA HA . . 5.500 5.570 5.517 5.590 0.090 14 0 "[ . 1 . 2]" 1
843 1 38 TRP HB2 2 1 MET HB3 . . 3.660 3.463 3.310 3.505 . 0 0 "[ . 1 . 2]" 1
844 1 38 TRP HB2 2 1 MET ME . . 3.200 2.305 2.243 2.593 . 0 0 "[ . 1 . 2]" 1
845 1 38 TRP HB2 2 3 MET HA . . 4.160 3.617 3.496 3.680 . 0 0 "[ . 1 . 2]" 1
846 1 38 TRP HB2 2 3 MET HG2 . . 5.020 5.127 5.094 5.200 0.180 11 0 "[ . 1 . 2]" 1
847 1 38 TRP HD1 2 1 MET ME . . 5.500 5.607 5.569 5.707 0.207 12 0 "[ . 1 . 2]" 1
848 1 38 TRP HD1 2 29 ILE MD . . 5.060 4.459 4.361 4.634 . 0 0 "[ . 1 . 2]" 1
849 1 38 TRP HD1 2 30 GLN H . . 4.100 4.051 3.896 4.125 0.025 6 0 "[ . 1 . 2]" 1
850 1 38 TRP HE1 2 30 GLN H . . 4.960 2.673 2.520 2.780 . 0 0 "[ . 1 . 2]" 1
851 1 38 TRP HE1 2 30 GLN HB2 . . 3.720 1.898 1.876 1.938 . 0 0 "[ . 1 . 2]" 1
852 1 38 TRP HE1 2 30 GLN HB3 . . 3.640 3.492 3.475 3.508 . 0 0 "[ . 1 . 2]" 1
853 1 38 TRP HH2 2 28 THR HB . . 4.930 3.945 3.873 4.025 . 0 0 "[ . 1 . 2]" 1
854 1 38 TRP HH2 2 30 GLN HG2 . . 4.350 4.178 4.105 4.228 . 0 0 "[ . 1 . 2]" 1
855 1 38 TRP HZ2 2 30 GLN HG2 . . 4.910 1.983 1.969 1.994 . 0 0 "[ . 1 . 2]" 1
856 1 38 TRP HZ3 2 1 MET ME . . 3.390 3.377 3.172 3.426 0.036 5 0 "[ . 1 . 2]" 1
857 1 39 LEU H 1 39 LEU MD1 . . 5.500 4.367 4.314 4.413 . 0 0 "[ . 1 . 2]" 1
858 1 39 LEU H 1 39 LEU MD2 . . 5.500 4.370 4.332 4.426 . 0 0 "[ . 1 . 2]" 1
859 1 39 LEU H 2 2 LEU H . . 3.970 3.296 3.252 3.368 . 0 0 "[ . 1 . 2]" 1
860 1 39 LEU H 2 3 MET HA . . 4.100 3.211 3.148 3.267 . 0 0 "[ . 1 . 2]" 1
861 1 39 LEU H 2 4 ILE MG . . 5.500 5.172 5.071 5.244 . 0 0 "[ . 1 . 2]" 1
862 1 39 LEU H 2 27 LEU QD . . 5.440 3.899 3.692 4.127 . 0 0 "[ . 1 . 2]" 1
863 1 39 LEU HA 1 39 LEU MD1 . . 3.360 2.160 2.054 2.401 . 0 0 "[ . 1 . 2]" 1
864 1 39 LEU HA 1 39 LEU MD2 . . 3.980 3.951 3.922 3.962 . 0 0 "[ . 1 . 2]" 1
865 1 39 LEU HA 1 39 LEU HG . . 4.080 3.227 3.195 3.249 . 0 0 "[ . 1 . 2]" 1
866 1 39 LEU HA 1 40 ALA H . . 3.170 2.299 2.281 2.317 . 0 0 "[ . 1 . 2]" 1
867 1 39 LEU HA 1 40 ALA HA . . 4.560 4.369 4.364 4.374 . 0 0 "[ . 1 . 2]" 1
868 1 39 LEU HA 1 40 ALA MB . . 4.350 3.865 3.854 3.885 . 0 0 "[ . 1 . 2]" 1
869 1 39 LEU HA 1 48 VAL QG . . 5.440 4.901 4.764 5.046 . 0 0 "[ . 1 . 2]" 1
870 1 39 LEU HA 2 1 MET ME . . 4.200 3.212 3.121 3.373 . 0 0 "[ . 1 . 2]" 1
871 1 39 LEU HA 2 4 ILE HB . . 5.500 5.633 5.590 5.684 0.184 19 0 "[ . 1 . 2]" 1
872 1 39 LEU HA 2 4 ILE MD . . 4.860 4.278 4.196 4.444 . 0 0 "[ . 1 . 2]" 1
873 1 39 LEU HA 2 27 LEU HA . . 4.600 3.143 3.033 3.282 . 0 0 "[ . 1 . 2]" 1
874 1 39 LEU HA 2 27 LEU QD . . 3.280 2.711 2.534 2.892 . 0 0 "[ . 1 . 2]" 1
875 1 39 LEU HB2 1 48 VAL MG1 . . 4.730 3.949 3.777 4.108 . 0 0 "[ . 1 . 2]" 1
876 1 39 LEU HB2 1 48 VAL QG . . 3.650 3.172 3.027 3.322 . 0 0 "[ . 1 . 2]" 1
877 1 39 LEU HB2 1 48 VAL MG2 . . 4.730 3.343 3.185 3.509 . 0 0 "[ . 1 . 2]" 1
878 1 39 LEU HB2 2 4 ILE HB . . 5.130 4.334 4.266 4.384 . 0 0 "[ . 1 . 2]" 1
879 1 39 LEU HB2 2 4 ILE MD . . 3.270 2.385 2.269 2.566 . 0 0 "[ . 1 . 2]" 1
880 1 39 LEU HB2 2 4 ILE HG12 . . 3.580 2.375 2.308 2.429 . 0 0 "[ . 1 . 2]" 1
881 1 39 LEU HB2 2 4 ILE MG . . 5.500 4.184 4.050 4.342 . 0 0 "[ . 1 . 2]" 1
882 1 39 LEU HB2 2 27 LEU HA . . 4.310 3.907 3.828 4.097 . 0 0 "[ . 1 . 2]" 1
883 1 39 LEU HB2 2 27 LEU QD . . 3.790 1.990 1.877 2.052 . 0 0 "[ . 1 . 2]" 1
884 1 39 LEU HB3 1 39 LEU MD2 . . 3.580 2.318 2.298 2.349 . 0 0 "[ . 1 . 2]" 1
885 1 39 LEU HB3 1 40 ALA H . . 4.740 3.925 3.845 3.958 . 0 0 "[ . 1 . 2]" 1
886 1 39 LEU HB3 2 2 LEU H . . 4.920 3.839 3.711 3.947 . 0 0 "[ . 1 . 2]" 1
887 1 39 LEU HB3 2 4 ILE HG13 . . 4.390 3.161 3.039 3.264 . 0 0 "[ . 1 . 2]" 1
888 1 39 LEU HB3 2 27 LEU QD . . 4.050 3.372 3.247 3.454 . 0 0 "[ . 1 . 2]" 1
889 1 39 LEU MD1 1 40 ALA H . . 3.800 1.948 1.896 2.124 . 0 0 "[ . 1 . 2]" 1
890 1 39 LEU MD1 1 40 ALA MB . . 3.780 3.426 3.373 3.493 . 0 0 "[ . 1 . 2]" 1
891 1 39 LEU MD1 1 41 ASP H . . 3.390 1.929 1.896 2.169 . 0 0 "[ . 1 . 2]" 1
892 1 39 LEU MD1 1 41 ASP HA . . 4.370 4.215 4.131 4.378 0.008 20 0 "[ . 1 . 2]" 1
893 1 39 LEU MD1 1 41 ASP HB2 . . 4.020 2.988 2.605 3.317 . 0 0 "[ . 1 . 2]" 1
894 1 39 LEU MD1 1 41 ASP HB3 . . 3.720 2.516 2.219 3.522 . 0 0 "[ . 1 . 2]" 1
895 1 39 LEU MD1 1 44 GLN QB . . 3.470 3.053 2.797 3.164 . 0 0 "[ . 1 . 2]" 1
896 1 39 LEU MD1 1 44 GLN HG2 . . 4.990 4.499 4.335 5.064 0.074 15 0 "[ . 1 . 2]" 1
897 1 39 LEU MD1 1 44 GLN QG . . 4.320 4.163 4.087 4.427 0.107 19 0 "[ . 1 . 2]" 1
898 1 39 LEU MD1 1 44 GLN HG3 . . 4.990 4.952 4.341 5.033 0.043 19 0 "[ . 1 . 2]" 1
899 1 39 LEU MD1 1 45 ALA MB . . 5.500 4.590 4.541 4.650 . 0 0 "[ . 1 . 2]" 1
900 1 39 LEU MD1 2 27 LEU HB2 . . 5.500 4.875 4.738 4.971 . 0 0 "[ . 1 . 2]" 1
901 1 39 LEU MD2 1 41 ASP HA . . 4.600 4.392 4.360 4.454 . 0 0 "[ . 1 . 2]" 1
902 1 39 LEU MD2 1 42 GLU HA . . 3.710 3.225 3.168 3.303 . 0 0 "[ . 1 . 2]" 1
903 1 39 LEU MD2 1 42 GLU HB2 . . 5.500 5.577 5.549 5.624 0.124 1 0 "[ . 1 . 2]" 1
904 1 39 LEU MD2 1 42 GLU QG . . 5.340 4.636 4.556 4.726 . 0 0 "[ . 1 . 2]" 1
905 1 39 LEU MD2 1 44 GLN H . . 3.730 3.266 3.137 3.354 . 0 0 "[ . 1 . 2]" 1
906 1 39 LEU MD2 1 44 GLN HB2 . . 4.100 2.858 2.341 3.294 . 0 0 "[ . 1 . 2]" 1
907 1 39 LEU MD2 1 44 GLN HB3 . . 4.100 2.260 2.087 2.502 . 0 0 "[ . 1 . 2]" 1
908 1 39 LEU MD2 1 44 GLN QG . . 4.350 3.831 3.714 4.016 . 0 0 "[ . 1 . 2]" 1
909 1 39 LEU MD2 1 45 ALA H . . 3.830 2.499 2.401 2.579 . 0 0 "[ . 1 . 2]" 1
910 1 39 LEU MD2 1 45 ALA HA . . 2.720 1.939 1.920 1.979 . 0 0 "[ . 1 . 2]" 1
911 1 39 LEU MD2 1 45 ALA MB . . 3.190 2.195 2.117 2.299 . 0 0 "[ . 1 . 2]" 1
912 1 39 LEU MD2 1 47 ARG QD . . 5.340 5.093 4.840 5.324 . 0 0 "[ . 1 . 2]" 1
913 1 39 LEU MD2 1 48 VAL HA . . 5.500 5.290 5.207 5.343 . 0 0 "[ . 1 . 2]" 1
914 1 39 LEU MD2 1 48 VAL HB . . 4.620 3.986 3.894 4.079 . 0 0 "[ . 1 . 2]" 1
915 1 39 LEU MD2 1 48 VAL MG1 . . 3.660 2.501 2.293 2.664 . 0 0 "[ . 1 . 2]" 1
916 1 39 LEU MD2 1 48 VAL QG . . 2.980 1.858 1.817 1.880 . 0 0 "[ . 1 . 2]" 1
917 1 39 LEU MD2 1 48 VAL MG2 . . 3.660 1.918 1.904 1.943 . 0 0 "[ . 1 . 2]" 1
918 1 39 LEU MD2 2 2 LEU HB3 . . 4.150 4.158 4.070 4.206 0.056 9 0 "[ . 1 . 2]" 1
919 1 39 LEU HG 1 40 ALA MB . . 4.150 3.995 3.965 4.019 . 0 0 "[ . 1 . 2]" 1
920 1 39 LEU HG 1 41 ASP HA . . 5.500 4.134 4.119 4.154 . 0 0 "[ . 1 . 2]" 1
921 1 39 LEU HG 1 41 ASP HB2 . . 4.720 4.150 3.597 4.373 . 0 0 "[ . 1 . 2]" 1
922 1 39 LEU HG 1 41 ASP HB3 . . 4.510 3.446 3.334 4.016 . 0 0 "[ . 1 . 2]" 1
923 1 39 LEU HG 1 42 GLU HA . . 4.970 4.165 4.111 4.207 . 0 0 "[ . 1 . 2]" 1
924 1 39 LEU HG 1 42 GLU QG . . 5.180 4.867 4.716 5.019 . 0 0 "[ . 1 . 2]" 1
925 1 39 LEU HG 2 27 LEU HA . . 5.500 5.497 5.448 5.531 0.031 20 0 "[ . 1 . 2]" 1
926 1 40 ALA H 1 40 ALA MB . . 3.270 2.299 2.236 2.348 . 0 0 "[ . 1 . 2]" 1
927 1 40 ALA H 1 41 ASP H . . 3.530 2.098 2.067 2.137 . 0 0 "[ . 1 . 2]" 1
928 1 40 ALA HA 2 1 MET ME . . 3.110 1.925 1.907 1.966 . 0 0 "[ . 1 . 2]" 1
929 1 40 ALA HA 2 1 MET HG2 . . 2.860 2.919 2.892 2.938 0.078 17 0 "[ . 1 . 2]" 1
930 1 40 ALA MB 1 41 ASP H . . 3.460 2.850 2.783 2.901 . 0 0 "[ . 1 . 2]" 1
931 1 40 ALA MB 1 41 ASP HA . . 3.940 3.844 3.828 3.869 . 0 0 "[ . 1 . 2]" 1
932 1 40 ALA MB 1 41 ASP HB2 . . 4.220 3.867 3.800 3.919 . 0 0 "[ . 1 . 2]" 1
933 1 40 ALA MB 1 41 ASP HB3 . . 5.130 4.801 4.590 5.152 0.022 20 0 "[ . 1 . 2]" 1
934 1 40 ALA MB 2 1 MET ME . . 2.620 2.212 1.953 2.281 . 0 0 "[ . 1 . 2]" 1
935 1 40 ALA MB 2 1 MET HG2 . . 3.160 3.013 2.917 3.117 . 0 0 "[ . 1 . 2]" 1
936 1 41 ASP H 1 41 ASP HB2 . . 3.290 2.564 2.193 2.745 . 0 0 "[ . 1 . 2]" 1
937 1 41 ASP H 1 41 ASP HB3 . . 3.240 2.671 2.473 3.248 0.008 20 0 "[ . 1 . 2]" 1
938 1 41 ASP H 1 42 GLU H . . 4.500 4.030 3.992 4.075 . 0 0 "[ . 1 . 2]" 1
939 1 41 ASP HA 1 42 GLU H . . 3.000 2.271 2.242 2.290 . 0 0 "[ . 1 . 2]" 1
940 1 41 ASP HA 1 42 GLU HA . . 5.070 4.528 4.508 4.539 . 0 0 "[ . 1 . 2]" 1
941 1 41 ASP HA 1 42 GLU HB2 . . 4.670 4.519 4.411 4.598 . 0 0 "[ . 1 . 2]" 1
942 1 41 ASP HA 1 42 GLU QG . . 5.340 4.171 3.928 4.690 . 0 0 "[ . 1 . 2]" 1
943 1 41 ASP HB3 1 44 GLN QB . . 4.370 2.048 1.950 2.166 . 0 0 "[ . 1 . 2]" 1
944 1 41 ASP HB3 1 44 GLN QG . . 3.750 3.621 3.402 3.770 0.020 19 0 "[ . 1 . 2]" 1
945 1 42 GLU H 1 42 GLU HB2 . . 3.290 2.532 2.394 2.627 . 0 0 "[ . 1 . 2]" 1
946 1 42 GLU H 1 42 GLU HB3 . . 3.620 3.592 3.580 3.596 . 0 0 "[ . 1 . 2]" 1
947 1 42 GLU H 1 42 GLU QG . . 3.190 2.159 1.954 2.695 . 0 0 "[ . 1 . 2]" 1
948 1 42 GLU HA 1 42 GLU QG . . 3.730 2.437 2.344 2.519 . 0 0 "[ . 1 . 2]" 1
949 1 42 GLU HA 1 43 SER HA . . 5.500 4.843 4.832 4.858 . 0 0 "[ . 1 . 2]" 1
950 1 42 GLU HA 1 44 GLN H . . 5.500 4.072 4.009 4.128 . 0 0 "[ . 1 . 2]" 1
951 1 42 GLU HA 1 45 ALA MB . . 4.610 2.044 1.966 2.217 . 0 0 "[ . 1 . 2]" 1
952 1 42 GLU HA 2 2 LEU HB2 . . 4.950 3.629 3.452 4.125 . 0 0 "[ . 1 . 2]" 1
953 1 42 GLU HA 2 2 LEU HB3 . . 4.560 3.877 3.318 4.109 . 0 0 "[ . 1 . 2]" 1
954 1 42 GLU HA 2 2 LEU QD . . 3.190 3.197 3.105 3.234 0.044 18 0 "[ . 1 . 2]" 1
955 1 42 GLU HA 2 2 LEU HG . . 5.470 5.449 5.158 5.541 0.071 16 0 "[ . 1 . 2]" 1
956 1 42 GLU HB2 1 43 SER HA . . 4.770 4.277 4.168 4.438 . 0 0 "[ . 1 . 2]" 1
957 1 42 GLU HB2 2 2 LEU HB2 . . 5.500 5.360 5.088 5.517 0.017 15 0 "[ . 1 . 2]" 1
958 1 42 GLU HB2 2 2 LEU QD . . 4.710 4.635 4.474 4.716 0.006 1 0 "[ . 1 . 2]" 1
959 1 42 GLU HB3 1 45 ALA H . . 4.780 4.750 4.706 4.805 0.025 19 0 "[ . 1 . 2]" 1
960 1 42 GLU HB3 1 45 ALA MB . . 5.210 3.634 3.563 3.720 . 0 0 "[ . 1 . 2]" 1
961 1 42 GLU HB3 2 2 LEU QD . . 3.340 3.354 3.320 3.392 0.052 13 0 "[ . 1 . 2]" 1
962 1 42 GLU QG 1 45 ALA MB . . 4.990 3.706 3.491 3.903 . 0 0 "[ . 1 . 2]" 1
963 1 42 GLU QG 2 2 LEU HA . . 5.340 4.725 4.474 4.969 . 0 0 "[ . 1 . 2]" 1
964 1 42 GLU QG 2 2 LEU HB2 . . 3.260 2.525 2.172 2.823 . 0 0 "[ . 1 . 2]" 1
965 1 42 GLU QG 2 2 LEU HB3 . . 4.560 3.731 2.867 4.191 . 0 0 "[ . 1 . 2]" 1
966 1 42 GLU QG 2 2 LEU QD . . 3.060 2.724 2.331 3.037 . 0 0 "[ . 1 . 2]" 1
967 1 42 GLU QG 2 2 LEU HG . . 4.680 4.029 3.734 4.715 0.035 13 0 "[ . 1 . 2]" 1
968 1 43 SER H 1 43 SER QB . . 3.170 2.693 2.132 2.807 . 0 0 "[ . 1 . 2]" 1
969 1 43 SER H 1 44 GLN H . . 3.520 2.741 2.717 2.774 . 0 0 "[ . 1 . 2]" 1
970 1 43 SER QB 1 44 GLN QG . . 5.180 4.685 3.561 5.044 . 0 0 "[ . 1 . 2]" 1
971 1 44 GLN H 1 44 GLN QB . . 3.470 2.146 2.126 2.189 . 0 0 "[ . 1 . 2]" 1
972 1 44 GLN H 1 44 GLN QG . . 4.370 3.883 3.179 4.073 . 0 0 "[ . 1 . 2]" 1
973 1 44 GLN HA 1 44 GLN HG2 . . 3.610 3.485 2.516 3.607 . 0 0 "[ . 1 . 2]" 1
974 1 44 GLN HA 1 44 GLN HG3 . . 3.610 2.692 2.547 3.577 . 0 0 "[ . 1 . 2]" 1
975 1 44 GLN HA 1 47 ARG HD2 . . 5.500 4.886 4.034 5.047 . 0 0 "[ . 1 . 2]" 1
976 1 44 GLN HA 1 47 ARG QD . . 4.750 4.555 3.943 4.682 . 0 0 "[ . 1 . 2]" 1
977 1 44 GLN HA 1 47 ARG HD3 . . 5.500 5.471 5.122 5.558 0.058 17 0 "[ . 1 . 2]" 1
978 1 44 GLN HA 1 48 VAL QG . . 4.050 3.961 3.702 4.105 0.055 11 0 "[ . 1 . 2]" 1
979 1 44 GLN HA 2 25 VAL MG1 . . 4.660 4.335 4.079 4.678 0.018 13 0 "[ . 1 . 2]" 1
980 1 44 GLN HA 2 25 VAL MG2 . . 4.520 4.518 4.046 4.589 0.069 13 0 "[ . 1 . 2]" 1
981 1 44 GLN QB 1 45 ALA H . . 3.730 3.187 3.162 3.199 . 0 0 "[ . 1 . 2]" 1
982 1 44 GLN QB 1 45 ALA HA . . 4.430 3.962 3.942 4.007 . 0 0 "[ . 1 . 2]" 1
983 1 44 GLN QB 1 48 VAL QG . . 3.470 2.660 2.311 2.870 . 0 0 "[ . 1 . 2]" 1
984 1 44 GLN QB 2 25 VAL HA . . 5.160 4.336 4.143 4.465 . 0 0 "[ . 1 . 2]" 1
985 1 44 GLN QB 2 25 VAL MG1 . . 3.080 2.257 1.907 2.516 . 0 0 "[ . 1 . 2]" 1
986 1 44 GLN QB 2 25 VAL MG2 . . 3.430 3.309 2.918 3.444 0.014 9 0 "[ . 1 . 2]" 1
987 1 44 GLN HB2 2 25 VAL MG1 . . 3.720 3.395 3.007 3.742 0.022 13 0 "[ . 1 . 2]" 1
988 1 44 GLN HB3 2 25 VAL MG1 . . 3.720 2.291 1.929 2.559 . 0 0 "[ . 1 . 2]" 1
989 1 44 GLN QE 2 25 VAL MG2 . . 5.070 3.499 2.101 4.693 . 0 0 "[ . 1 . 2]" 1
990 1 44 GLN QG 1 47 ARG QD . . 4.380 3.030 2.155 4.181 . 0 0 "[ . 1 . 2]" 1
991 1 44 GLN QG 1 48 VAL QG . . 3.740 3.285 3.001 3.791 0.051 15 0 "[ . 1 . 2]" 1
992 1 44 GLN QG 2 25 VAL HA . . 4.680 3.395 3.215 3.983 . 0 0 "[ . 1 . 2]" 1
993 1 44 GLN QG 2 25 VAL HB . . 4.930 4.355 4.021 4.797 . 0 0 "[ . 1 . 2]" 1
994 1 44 GLN QG 2 25 VAL MG1 . . 3.380 2.399 2.192 2.886 . 0 0 "[ . 1 . 2]" 1
995 1 44 GLN HG2 2 25 VAL HA . . 5.470 3.592 3.303 4.935 . 0 0 "[ . 1 . 2]" 1
996 1 44 GLN HG2 2 25 VAL MG1 . . 3.860 2.757 2.468 3.782 . 0 0 "[ . 1 . 2]" 1
997 1 44 GLN HG2 2 25 VAL MG2 . . 3.570 2.681 2.135 3.658 0.088 15 0 "[ . 1 . 2]" 1
998 1 44 GLN HG3 2 25 VAL HA . . 5.470 4.474 3.309 4.913 . 0 0 "[ . 1 . 2]" 1
999 1 44 GLN HG3 2 25 VAL MG1 . . 3.860 2.695 2.442 3.860 0.000 19 0 "[ . 1 . 2]" 1
1000 1 44 GLN HG3 2 25 VAL MG2 . . 3.570 2.336 2.146 3.580 0.010 19 0 "[ . 1 . 2]" 1
1001 1 45 ALA H 1 46 GLU H . . 3.880 2.782 2.714 2.840 . 0 0 "[ . 1 . 2]" 1
1002 1 45 ALA H 1 48 VAL MG1 . . 5.050 4.638 4.287 4.819 . 0 0 "[ . 1 . 2]" 1
1003 1 45 ALA H 1 48 VAL QG . . 4.350 3.678 3.576 3.728 . 0 0 "[ . 1 . 2]" 1
1004 1 45 ALA H 1 48 VAL MG2 . . 5.050 3.860 3.808 3.887 . 0 0 "[ . 1 . 2]" 1
1005 1 45 ALA HA 1 48 VAL HB . . 4.620 4.599 4.483 4.647 0.027 19 0 "[ . 1 . 2]" 1
1006 1 45 ALA HA 1 48 VAL MG1 . . 3.700 3.441 3.225 3.526 . 0 0 "[ . 1 . 2]" 1
1007 1 45 ALA HA 1 48 VAL QG . . 3.160 1.908 1.838 1.938 . 0 0 "[ . 1 . 2]" 1
1008 1 45 ALA HA 1 48 VAL MG2 . . 3.700 1.918 1.849 1.948 . 0 0 "[ . 1 . 2]" 1
1009 1 45 ALA HA 2 2 LEU HB3 . . 5.500 5.039 4.825 5.234 . 0 0 "[ . 1 . 2]" 1
1010 1 45 ALA HA 2 4 ILE MD . . 3.410 2.290 2.132 2.429 . 0 0 "[ . 1 . 2]" 1
1011 1 45 ALA HA 2 4 ILE MG . . 4.860 4.558 4.338 4.729 . 0 0 "[ . 1 . 2]" 1
1012 1 45 ALA MB 1 46 GLU H . . 3.280 2.705 2.563 2.878 . 0 0 "[ . 1 . 2]" 1
1013 1 45 ALA MB 1 46 GLU HA . . 3.990 3.826 3.766 3.903 . 0 0 "[ . 1 . 2]" 1
1014 1 45 ALA MB 1 46 GLU HB2 . . 4.880 4.756 4.550 4.873 . 0 0 "[ . 1 . 2]" 1
1015 1 45 ALA MB 1 46 GLU HG2 . . 4.560 4.003 3.479 4.502 . 0 0 "[ . 1 . 2]" 1
1016 1 45 ALA MB 1 46 GLU QG . . 3.990 3.209 3.056 3.379 . 0 0 "[ . 1 . 2]" 1
1017 1 45 ALA MB 1 46 GLU HG3 . . 4.560 3.449 3.121 4.416 . 0 0 "[ . 1 . 2]" 1
1018 1 45 ALA MB 1 48 VAL MG1 . . 4.610 4.635 4.451 4.699 0.089 2 0 "[ . 1 . 2]" 1
1019 1 45 ALA MB 1 48 VAL MG2 . . 4.610 3.170 3.132 3.211 . 0 0 "[ . 1 . 2]" 1
1020 1 45 ALA MB 1 49 ARG HD2 . . 4.290 2.779 2.623 3.058 . 0 0 "[ . 1 . 2]" 1
1021 1 45 ALA MB 1 49 ARG HD3 . . 4.280 3.824 3.610 4.145 . 0 0 "[ . 1 . 2]" 1
1022 1 45 ALA MB 2 2 LEU QD . . 2.640 2.510 2.090 2.644 0.004 19 0 "[ . 1 . 2]" 1
1023 1 45 ALA MB 2 4 ILE MD . . 3.040 2.595 2.463 2.710 . 0 0 "[ . 1 . 2]" 1
1024 1 46 GLU H 1 46 GLU HB2 . . 3.000 2.530 2.341 2.690 . 0 0 "[ . 1 . 2]" 1
1025 1 46 GLU H 1 46 GLU HG2 . . 4.350 3.275 2.771 3.685 . 0 0 "[ . 1 . 2]" 1
1026 1 46 GLU H 1 46 GLU QG . . 3.690 2.198 1.959 2.615 . 0 0 "[ . 1 . 2]" 1
1027 1 46 GLU H 1 46 GLU HG3 . . 4.350 2.261 1.992 3.187 . 0 0 "[ . 1 . 2]" 1
1028 1 46 GLU H 1 47 ARG H . . 3.430 2.677 2.572 2.772 . 0 0 "[ . 1 . 2]" 1
1029 1 46 GLU H 1 49 ARG HD2 . . 5.360 4.683 4.231 5.220 . 0 0 "[ . 1 . 2]" 1
1030 1 46 GLU H 2 2 LEU QD . . 5.440 5.342 4.950 5.469 0.029 7 0 "[ . 1 . 2]" 1
1031 1 46 GLU HA 1 46 GLU HG2 . . 3.670 2.580 2.367 2.864 . 0 0 "[ . 1 . 2]" 1
1032 1 46 GLU HA 1 46 GLU QG . . 3.160 2.457 2.303 2.537 . 0 0 "[ . 1 . 2]" 1
1033 1 46 GLU HA 1 46 GLU HG3 . . 3.670 3.182 2.779 3.632 . 0 0 "[ . 1 . 2]" 1
1034 1 46 GLU HA 1 48 VAL QG . . 5.440 4.065 3.849 4.211 . 0 0 "[ . 1 . 2]" 1
1035 1 46 GLU HA 1 49 ARG H . . 4.020 3.588 3.408 3.728 . 0 0 "[ . 1 . 2]" 1
1036 1 46 GLU HA 1 49 ARG HB2 . . 3.630 2.523 2.463 2.589 . 0 0 "[ . 1 . 2]" 1
1037 1 46 GLU HA 1 49 ARG HD2 . . 3.990 3.523 3.138 3.935 . 0 0 "[ . 1 . 2]" 1
1038 1 46 GLU HA 1 49 ARG HD3 . . 4.260 2.484 2.199 3.018 . 0 0 "[ . 1 . 2]" 1
1039 1 46 GLU HA 1 49 ARG HG3 . . 5.190 4.520 4.434 4.700 . 0 0 "[ . 1 . 2]" 1
1040 1 46 GLU QG 1 48 VAL QG . . 5.280 4.909 4.728 5.099 . 0 0 "[ . 1 . 2]" 1
1041 1 46 GLU QG 1 49 ARG HD2 . . 5.340 4.536 4.335 4.779 . 0 0 "[ . 1 . 2]" 1
1042 1 46 GLU QG 2 2 LEU QD . . 5.280 4.837 4.620 4.989 . 0 0 "[ . 1 . 2]" 1
1043 1 46 GLU HG2 1 49 ARG HD3 . . 5.310 4.023 3.631 4.583 . 0 0 "[ . 1 . 2]" 1
1044 1 46 GLU HG3 1 49 ARG HD3 . . 5.310 4.946 4.394 5.314 0.004 4 0 "[ . 1 . 2]" 1
1045 1 47 ARG H 1 47 ARG QB . . 2.730 2.238 2.207 2.247 . 0 0 "[ . 1 . 2]" 1
1046 1 47 ARG H 1 47 ARG QD . . 5.340 4.241 4.098 4.341 . 0 0 "[ . 1 . 2]" 1
1047 1 47 ARG H 1 48 VAL H . . 3.480 2.831 2.692 2.921 . 0 0 "[ . 1 . 2]" 1
1048 1 47 ARG H 1 48 VAL MG1 . . 5.490 4.473 4.257 4.589 . 0 0 "[ . 1 . 2]" 1
1049 1 47 ARG H 1 48 VAL QG . . 4.740 3.585 3.558 3.635 . 0 0 "[ . 1 . 2]" 1
1050 1 47 ARG H 1 48 VAL MG2 . . 5.490 3.779 3.722 3.910 . 0 0 "[ . 1 . 2]" 1
1051 1 47 ARG HA 1 47 ARG QD . . 3.940 3.656 3.426 3.946 0.006 16 0 "[ . 1 . 2]" 1
1052 1 47 ARG HA 1 48 VAL MG1 . . 5.500 5.066 4.920 5.144 . 0 0 "[ . 1 . 2]" 1
1053 1 47 ARG HA 1 48 VAL MG2 . . 5.500 4.887 4.846 4.966 . 0 0 "[ . 1 . 2]" 1
1054 1 47 ARG HA 1 49 ARG H . . 4.840 4.421 4.262 4.584 . 0 0 "[ . 1 . 2]" 1
1055 1 47 ARG HA 1 50 ALA MB . . 3.790 3.082 2.968 3.209 . 0 0 "[ . 1 . 2]" 1
1056 1 47 ARG HA 1 51 GLU HG2 . . 5.500 3.880 3.688 3.957 . 0 0 "[ . 1 . 2]" 1
1057 1 47 ARG HA 1 51 GLU HG3 . . 5.500 5.421 5.191 5.532 0.032 1 0 "[ . 1 . 2]" 1
1058 1 47 ARG QB 1 48 VAL HA . . 5.340 4.237 4.034 4.596 . 0 0 "[ . 1 . 2]" 1
1059 1 47 ARG QD 1 48 VAL HA . . 4.780 2.615 2.421 2.849 . 0 0 "[ . 1 . 2]" 1
1060 1 47 ARG QD 1 48 VAL QG . . 3.770 2.295 1.927 2.523 . 0 0 "[ . 1 . 2]" 1
1061 1 47 ARG QD 1 51 GLU HB2 . . 4.210 3.867 3.459 4.243 0.033 14 0 "[ . 1 . 2]" 1
1062 1 47 ARG QD 1 51 GLU HB3 . . 5.340 4.950 4.601 5.310 . 0 0 "[ . 1 . 2]" 1
1063 1 47 ARG QD 1 51 GLU HG2 . . 5.250 3.126 2.842 3.533 . 0 0 "[ . 1 . 2]" 1
1064 1 47 ARG QD 1 51 GLU HG3 . . 4.700 3.599 3.249 3.898 . 0 0 "[ . 1 . 2]" 1
1065 1 47 ARG QD 2 20 MET HA . . 5.340 5.230 5.050 5.403 0.063 15 0 "[ . 1 . 2]" 1
1066 1 47 ARG QD 2 20 MET ME . . 3.510 2.380 1.864 2.802 . 0 0 "[ . 1 . 2]" 1
1067 1 47 ARG QD 2 25 VAL HB . . 4.050 3.889 3.596 4.077 0.027 15 0 "[ . 1 . 2]" 1
1068 1 47 ARG QD 2 25 VAL MG1 . . 3.760 3.121 2.725 3.368 . 0 0 "[ . 1 . 2]" 1
1069 1 47 ARG HD2 1 48 VAL HA . . 5.500 4.006 3.011 4.521 . 0 0 "[ . 1 . 2]" 1
1070 1 47 ARG HD2 2 20 MET ME . . 4.050 3.046 2.291 3.595 . 0 0 "[ . 1 . 2]" 1
1071 1 47 ARG HD2 2 25 VAL MG2 . . 3.980 2.031 1.865 2.132 . 0 0 "[ . 1 . 2]" 1
1072 1 47 ARG HD3 1 48 VAL HA . . 5.500 2.691 2.443 3.092 . 0 0 "[ . 1 . 2]" 1
1073 1 47 ARG HD3 2 20 MET ME . . 4.050 2.561 1.898 2.981 . 0 0 "[ . 1 . 2]" 1
1074 1 47 ARG HD3 2 25 VAL MG2 . . 3.980 3.085 2.686 3.345 . 0 0 "[ . 1 . 2]" 1
1075 1 48 VAL H 1 48 VAL MG1 . . 3.680 2.365 2.237 2.430 . 0 0 "[ . 1 . 2]" 1
1076 1 48 VAL H 1 48 VAL QG . . 3.200 1.886 1.847 1.956 . 0 0 "[ . 1 . 2]" 1
1077 1 48 VAL H 1 48 VAL MG2 . . 3.680 1.985 1.920 2.159 . 0 0 "[ . 1 . 2]" 1
1078 1 48 VAL H 1 49 ARG HG3 . . 5.500 5.510 5.481 5.524 0.024 19 0 "[ . 1 . 2]" 1
1079 1 48 VAL H 2 4 ILE MD . . 4.700 4.599 4.525 4.680 . 0 0 "[ . 1 . 2]" 1
1080 1 48 VAL HA 1 48 VAL MG1 . . 3.410 2.236 2.194 2.318 . 0 0 "[ . 1 . 2]" 1
1081 1 48 VAL HA 1 48 VAL QG . . 2.870 2.196 2.158 2.267 . 0 0 "[ . 1 . 2]" 1
1082 1 48 VAL HA 1 48 VAL MG2 . . 3.410 3.201 3.199 3.203 . 0 0 "[ . 1 . 2]" 1
1083 1 48 VAL HA 1 49 ARG HB2 . . 5.500 5.576 5.562 5.585 0.085 5 0 "[ . 1 . 2]" 1
1084 1 48 VAL HA 1 50 ALA MB . . 5.160 5.049 4.941 5.175 0.015 15 0 "[ . 1 . 2]" 1
1085 1 48 VAL HA 1 51 GLU HB2 . . 3.450 2.838 2.714 2.941 . 0 0 "[ . 1 . 2]" 1
1086 1 48 VAL HA 1 51 GLU HB3 . . 4.620 4.503 4.341 4.623 0.003 5 0 "[ . 1 . 2]" 1
1087 1 48 VAL HA 1 51 GLU HG2 . . 4.310 3.599 3.395 3.965 . 0 0 "[ . 1 . 2]" 1
1088 1 48 VAL HA 1 51 GLU HG3 . . 4.770 4.369 4.177 4.590 . 0 0 "[ . 1 . 2]" 1
1089 1 48 VAL HA 1 52 LEU QB . . 5.340 4.017 3.942 4.091 . 0 0 "[ . 1 . 2]" 1
1090 1 48 VAL HA 2 4 ILE MG . . 5.300 4.709 4.556 4.814 . 0 0 "[ . 1 . 2]" 1
1091 1 48 VAL HA 2 20 MET ME . . 3.260 2.406 1.934 2.883 . 0 0 "[ . 1 . 2]" 1
1092 1 48 VAL HA 2 25 VAL MG1 . . 4.340 4.308 4.103 4.387 0.047 16 0 "[ . 1 . 2]" 1
1093 1 48 VAL HA 2 25 VAL MG2 . . 4.700 4.529 4.411 4.651 . 0 0 "[ . 1 . 2]" 1
1094 1 48 VAL HA 2 27 LEU MD1 . . 5.500 5.058 4.429 5.561 0.061 13 0 "[ . 1 . 2]" 1
1095 1 48 VAL HA 2 27 LEU QD . . 4.810 4.403 4.169 4.598 . 0 0 "[ . 1 . 2]" 1
1096 1 48 VAL HA 2 27 LEU MD2 . . 5.500 4.988 4.702 5.320 . 0 0 "[ . 1 . 2]" 1
1097 1 48 VAL HB 2 4 ILE MD . . 3.820 3.461 3.349 3.618 . 0 0 "[ . 1 . 2]" 1
1098 1 48 VAL HB 2 4 ILE HG12 . . 5.500 5.335 5.207 5.428 . 0 0 "[ . 1 . 2]" 1
1099 1 48 VAL HB 2 4 ILE MG . . 3.930 2.822 2.657 2.959 . 0 0 "[ . 1 . 2]" 1
1100 1 48 VAL HB 2 20 MET ME . . 5.390 3.790 3.408 4.120 . 0 0 "[ . 1 . 2]" 1
1101 1 48 VAL HB 2 27 LEU MD1 . . 5.500 3.316 2.931 3.607 . 0 0 "[ . 1 . 2]" 1
1102 1 48 VAL HB 2 27 LEU QD . . 4.280 2.979 2.722 3.235 . 0 0 "[ . 1 . 2]" 1
1103 1 48 VAL HB 2 27 LEU MD2 . . 5.500 3.396 3.188 3.658 . 0 0 "[ . 1 . 2]" 1
1104 1 48 VAL QG 1 49 ARG H . . 3.840 2.027 1.961 2.085 . 0 0 "[ . 1 . 2]" 1
1105 1 48 VAL QG 1 49 ARG HA . . 4.410 3.158 3.076 3.197 . 0 0 "[ . 1 . 2]" 1
1106 1 48 VAL QG 1 49 ARG HB2 . . 5.270 3.428 3.296 3.485 . 0 0 "[ . 1 . 2]" 1
1107 1 48 VAL QG 1 49 ARG HD2 . . 4.220 3.616 3.521 3.777 . 0 0 "[ . 1 . 2]" 1
1108 1 48 VAL QG 1 49 ARG HD3 . . 5.440 4.234 4.059 4.486 . 0 0 "[ . 1 . 2]" 1
1109 1 48 VAL QG 1 49 ARG HG3 . . 4.910 2.848 2.737 2.974 . 0 0 "[ . 1 . 2]" 1
1110 1 48 VAL QG 1 51 GLU HB2 . . 4.720 4.263 4.167 4.346 . 0 0 "[ . 1 . 2]" 1
1111 1 48 VAL QG 1 51 GLU HG2 . . 5.310 4.617 4.461 4.884 . 0 0 "[ . 1 . 2]" 1
1112 1 48 VAL QG 1 51 GLU HG3 . . 5.440 5.077 4.948 5.249 . 0 0 "[ . 1 . 2]" 1
1113 1 48 VAL QG 1 52 LEU QD . . 3.920 3.809 3.683 3.927 0.007 4 0 "[ . 1 . 2]" 1
1114 1 48 VAL QG 2 4 ILE HA . . 4.320 3.881 3.771 3.970 . 0 0 "[ . 1 . 2]" 1
1115 1 48 VAL QG 2 4 ILE HG13 . . 4.550 2.703 2.560 2.901 . 0 0 "[ . 1 . 2]" 1
1116 1 48 VAL QG 2 4 ILE MG . . 3.410 2.442 2.232 2.606 . 0 0 "[ . 1 . 2]" 1
1117 1 48 VAL QG 2 5 THR MG . . 5.440 5.228 5.123 5.310 . 0 0 "[ . 1 . 2]" 1
1118 1 48 VAL QG 2 20 MET HA . . 5.080 4.602 4.418 5.007 . 0 0 "[ . 1 . 2]" 1
1119 1 48 VAL QG 2 20 MET ME . . 2.740 2.398 2.049 2.749 0.009 1 0 "[ . 1 . 2]" 1
1120 1 48 VAL QG 2 20 MET QG . . 3.860 3.267 1.936 3.870 0.010 1 0 "[ . 1 . 2]" 1
1121 1 48 VAL QG 2 25 VAL HA . . 4.830 4.497 4.450 4.535 . 0 0 "[ . 1 . 2]" 1
1122 1 48 VAL QG 2 25 VAL HB . . 4.150 3.032 2.886 3.467 . 0 0 "[ . 1 . 2]" 1
1123 1 48 VAL QG 2 25 VAL MG1 . . 2.730 1.779 1.742 1.823 . 0 0 "[ . 1 . 2]" 1
1124 1 48 VAL QG 2 25 VAL MG2 . . 2.870 2.734 2.570 2.822 . 0 0 "[ . 1 . 2]" 1
1125 1 48 VAL QG 2 27 LEU HA . . 5.420 4.876 4.783 5.129 . 0 0 "[ . 1 . 2]" 1
1126 1 48 VAL QG 2 27 LEU QD . . 2.630 2.069 1.862 2.455 . 0 0 "[ . 1 . 2]" 1
1127 1 48 VAL MG1 1 49 ARG HA . . 5.500 5.398 5.387 5.407 . 0 0 "[ . 1 . 2]" 1
1128 1 48 VAL MG1 1 51 GLU HB2 . . 5.450 4.476 4.360 4.571 . 0 0 "[ . 1 . 2]" 1
1129 1 48 VAL MG1 2 27 LEU MD1 . . 4.210 2.932 2.478 3.453 . 0 0 "[ . 1 . 2]" 1
1130 1 48 VAL MG1 2 27 LEU MD2 . . 4.210 2.229 1.894 2.777 . 0 0 "[ . 1 . 2]" 1
1131 1 48 VAL MG2 1 49 ARG HA . . 5.500 3.180 3.094 3.220 . 0 0 "[ . 1 . 2]" 1
1132 1 48 VAL MG2 1 51 GLU HB2 . . 5.450 5.359 5.272 5.441 . 0 0 "[ . 1 . 2]" 1
1133 1 48 VAL MG2 2 27 LEU MD1 . . 4.210 3.606 3.073 4.053 . 0 0 "[ . 1 . 2]" 1
1134 1 48 VAL MG2 2 27 LEU MD2 . . 4.210 3.275 2.896 3.863 . 0 0 "[ . 1 . 2]" 1
1135 1 49 ARG H 1 49 ARG HB2 . . 2.860 2.157 2.110 2.184 . 0 0 "[ . 1 . 2]" 1
1136 1 49 ARG H 1 49 ARG HD2 . . 5.500 3.976 3.833 4.229 . 0 0 "[ . 1 . 2]" 1
1137 1 49 ARG H 1 49 ARG HD3 . . 4.290 3.872 3.679 4.139 . 0 0 "[ . 1 . 2]" 1
1138 1 49 ARG H 1 49 ARG HG3 . . 3.490 3.084 3.008 3.225 . 0 0 "[ . 1 . 2]" 1
1139 1 49 ARG H 1 50 ALA H . . 3.270 2.803 2.732 2.845 . 0 0 "[ . 1 . 2]" 1
1140 1 49 ARG H 2 4 ILE MD . . 4.680 3.868 3.747 4.018 . 0 0 "[ . 1 . 2]" 1
1141 1 49 ARG HA 1 49 ARG HD2 . . 4.380 4.383 4.297 4.406 0.026 19 0 "[ . 1 . 2]" 1
1142 1 49 ARG HA 1 49 ARG HD3 . . 4.790 4.364 4.320 4.428 . 0 0 "[ . 1 . 2]" 1
1143 1 49 ARG HA 1 49 ARG HG3 . . 4.010 2.327 2.292 2.387 . 0 0 "[ . 1 . 2]" 1
1144 1 49 ARG HA 1 52 LEU QB . . 5.210 2.743 2.681 2.809 . 0 0 "[ . 1 . 2]" 1
1145 1 49 ARG HA 1 52 LEU MD1 . . 4.960 4.030 3.529 4.567 . 0 0 "[ . 1 . 2]" 1
1146 1 49 ARG HA 1 52 LEU QD . . 4.120 3.261 3.052 3.356 . 0 0 "[ . 1 . 2]" 1
1147 1 49 ARG HA 1 52 LEU MD2 . . 4.960 3.552 3.111 4.042 . 0 0 "[ . 1 . 2]" 1
1148 1 49 ARG HA 1 52 LEU HG . . 5.500 5.509 5.374 5.572 0.072 14 0 "[ . 1 . 2]" 1
1149 1 49 ARG HA 2 4 ILE MG . . 4.540 3.208 3.014 3.341 . 0 0 "[ . 1 . 2]" 1
1150 1 49 ARG HB2 1 49 ARG HD3 . . 3.340 2.112 2.029 2.268 . 0 0 "[ . 1 . 2]" 1
1151 1 49 ARG HB2 1 50 ALA H . . 3.260 2.734 2.621 2.937 . 0 0 "[ . 1 . 2]" 1
1152 1 49 ARG HD2 2 4 ILE HA . . 4.870 4.397 3.981 4.645 . 0 0 "[ . 1 . 2]" 1
1153 1 49 ARG HD2 2 4 ILE MG . . 4.820 4.525 4.219 4.731 . 0 0 "[ . 1 . 2]" 1
1154 1 49 ARG HD3 2 4 ILE MD . . 4.810 4.699 4.498 4.814 0.004 14 0 "[ . 1 . 2]" 1
1155 1 49 ARG HG3 2 4 ILE MG . . 4.400 2.988 2.739 3.198 . 0 0 "[ . 1 . 2]" 1
1156 1 50 ALA H 1 50 ALA MB . . 2.920 2.204 2.086 2.240 . 0 0 "[ . 1 . 2]" 1
1157 1 50 ALA H 1 51 GLU H . . 3.390 2.852 2.733 2.917 . 0 0 "[ . 1 . 2]" 1
1158 1 50 ALA HA 1 53 ALA H . . 4.220 3.781 3.675 3.899 . 0 0 "[ . 1 . 2]" 1
1159 1 50 ALA HA 1 53 ALA MB . . 3.130 2.909 2.751 3.063 . 0 0 "[ . 1 . 2]" 1
1160 1 50 ALA MB 1 51 GLU H . . 3.370 2.240 2.128 2.352 . 0 0 "[ . 1 . 2]" 1
1161 1 50 ALA MB 1 51 GLU HB3 . . 5.240 5.105 5.042 5.190 . 0 0 "[ . 1 . 2]" 1
1162 1 50 ALA MB 1 51 GLU HG2 . . 4.340 3.420 3.329 3.575 . 0 0 "[ . 1 . 2]" 1
1163 1 50 ALA MB 1 51 GLU HG3 . . 5.070 4.817 4.696 5.016 . 0 0 "[ . 1 . 2]" 1
1164 1 50 ALA MB 1 54 ARG QD . . 3.900 3.115 2.769 3.721 . 0 0 "[ . 1 . 2]" 1
1165 1 51 GLU H 1 51 GLU HB2 . . 3.790 2.574 2.416 2.655 . 0 0 "[ . 1 . 2]" 1
1166 1 51 GLU H 1 51 GLU HB3 . . 3.700 3.588 3.581 3.592 . 0 0 "[ . 1 . 2]" 1
1167 1 51 GLU H 1 51 GLU HG2 . . 3.760 2.265 2.169 2.475 . 0 0 "[ . 1 . 2]" 1
1168 1 51 GLU H 1 51 GLU HG3 . . 4.760 3.719 3.641 3.881 . 0 0 "[ . 1 . 2]" 1
1169 1 51 GLU H 1 52 LEU H . . 3.510 2.830 2.753 2.914 . 0 0 "[ . 1 . 2]" 1
1170 1 51 GLU HA 1 51 GLU HG2 . . 3.480 3.369 3.235 3.445 . 0 0 "[ . 1 . 2]" 1
1171 1 51 GLU HA 1 54 ARG H . . 4.180 3.477 3.399 3.549 . 0 0 "[ . 1 . 2]" 1
1172 1 51 GLU HA 1 54 ARG HA . . 5.500 5.400 5.215 5.520 0.020 1 0 "[ . 1 . 2]" 1
1173 1 51 GLU HA 1 54 ARG QB . . 3.490 2.516 2.300 2.674 . 0 0 "[ . 1 . 2]" 1
1174 1 51 GLU HA 1 54 ARG QD . . 3.590 2.662 2.076 3.090 . 0 0 "[ . 1 . 2]" 1
1175 1 51 GLU HA 2 19 TYR QE . . 5.430 5.219 5.079 5.454 0.024 15 0 "[ . 1 . 2]" 1
1176 1 51 GLU HB2 2 19 TYR QE . . 4.110 3.710 3.146 4.129 0.019 7 0 "[ . 1 . 2]" 1
1177 1 51 GLU HB2 2 20 MET ME . . 4.350 2.482 1.960 2.894 . 0 0 "[ . 1 . 2]" 1
1178 1 51 GLU HB3 1 54 ARG QD . . 5.340 4.753 4.192 5.057 . 0 0 "[ . 1 . 2]" 1
1179 1 51 GLU HB3 2 19 TYR QE . . 3.840 2.988 2.792 3.417 . 0 0 "[ . 1 . 2]" 1
1180 1 51 GLU HB3 2 20 MET ME . . 3.530 3.194 2.866 3.483 . 0 0 "[ . 1 . 2]" 1
1181 1 51 GLU HG2 2 19 TYR QE . . 5.190 4.901 4.525 5.235 0.045 15 0 "[ . 1 . 2]" 1
1182 1 51 GLU HG2 2 20 MET ME . . 4.000 3.316 2.527 3.749 . 0 0 "[ . 1 . 2]" 1
1183 1 51 GLU HG2 2 25 VAL MG2 . . 5.500 5.560 5.517 5.666 0.166 1 0 "[ . 1 . 2]" 1
1184 1 51 GLU HG3 2 19 TYR QE . . 4.510 3.593 3.360 3.836 . 0 0 "[ . 1 . 2]" 1
1185 1 51 GLU HG3 2 20 MET ME . . 3.120 2.943 2.407 3.225 0.105 15 0 "[ . 1 . 2]" 1
1186 1 51 GLU HG3 2 25 VAL MG2 . . 5.500 5.355 5.220 5.512 0.012 16 0 "[ . 1 . 2]" 1
1187 1 52 LEU H 1 52 LEU HB2 . . 3.480 2.456 2.333 2.563 . 0 0 "[ . 1 . 2]" 1
1188 1 52 LEU H 1 52 LEU QB . . 2.860 2.226 2.202 2.236 . 0 0 "[ . 1 . 2]" 1
1189 1 52 LEU H 1 52 LEU HB3 . . 3.480 2.558 2.447 2.700 . 0 0 "[ . 1 . 2]" 1
1190 1 52 LEU H 1 52 LEU MD1 . . 5.500 4.117 4.032 4.190 . 0 0 "[ . 1 . 2]" 1
1191 1 52 LEU H 1 52 LEU QD . . 4.060 3.695 3.676 3.718 . 0 0 "[ . 1 . 2]" 1
1192 1 52 LEU H 1 52 LEU MD2 . . 5.500 4.182 4.096 4.259 . 0 0 "[ . 1 . 2]" 1
1193 1 52 LEU H 1 52 LEU HG . . 5.500 4.434 4.361 4.452 . 0 0 "[ . 1 . 2]" 1
1194 1 52 LEU H 1 53 ALA H . . 3.100 2.895 2.772 2.996 . 0 0 "[ . 1 . 2]" 1
1195 1 52 LEU HA 1 52 LEU MD1 . . 4.010 3.324 2.919 3.648 . 0 0 "[ . 1 . 2]" 1
1196 1 52 LEU HA 1 52 LEU QD . . 2.910 2.987 2.836 3.092 0.182 2 0 "[ . 1 . 2]" 1
1197 1 52 LEU HA 1 52 LEU MD2 . . 4.010 3.541 3.142 3.858 . 0 0 "[ . 1 . 2]" 1
1198 1 52 LEU HA 1 52 LEU HG . . 3.420 2.544 2.439 2.684 . 0 0 "[ . 1 . 2]" 1
1199 1 52 LEU HA 1 55 PHE HB2 . . 3.880 3.177 2.949 3.380 . 0 0 "[ . 1 . 2]" 1
1200 1 52 LEU HA 1 55 PHE HB3 . . 4.480 3.014 2.716 3.217 . 0 0 "[ . 1 . 2]" 1
1201 1 52 LEU HA 1 56 LEU QD . . 5.230 4.576 3.370 4.878 . 0 0 "[ . 1 . 2]" 1
1202 1 52 LEU HA 2 4 ILE MG . . 5.500 5.286 5.219 5.360 . 0 0 "[ . 1 . 2]" 1
1203 1 52 LEU HA 2 19 TYR QE . . 3.750 3.748 3.530 3.850 0.100 19 0 "[ . 1 . 2]" 1
1204 1 52 LEU QB 1 52 LEU QD . . 2.780 1.778 1.737 1.821 . 0 0 "[ . 1 . 2]" 1
1205 1 52 LEU QB 1 53 ALA H . . 3.280 2.292 2.172 2.384 . 0 0 "[ . 1 . 2]" 1
1206 1 52 LEU QB 1 56 LEU QD . . 5.280 4.173 3.488 4.423 . 0 0 "[ . 1 . 2]" 1
1207 1 52 LEU QB 2 4 ILE MG . . 4.710 3.155 3.064 3.232 . 0 0 "[ . 1 . 2]" 1
1208 1 52 LEU QB 2 7 PHE QE . . 5.340 5.218 5.019 5.362 0.022 12 0 "[ . 1 . 2]" 1
1209 1 52 LEU QB 2 19 TYR QE . . 5.340 4.577 4.394 4.743 . 0 0 "[ . 1 . 2]" 1
1210 1 52 LEU QD 1 53 ALA HA . . 5.440 2.887 2.510 3.430 . 0 0 "[ . 1 . 2]" 1
1211 1 52 LEU QD 1 55 PHE HB2 . . 5.220 5.042 4.900 5.128 . 0 0 "[ . 1 . 2]" 1
1212 1 52 LEU QD 1 55 PHE HB3 . . 4.300 4.339 4.187 4.423 0.123 9 0 "[ . 1 . 2]" 1
1213 1 52 LEU QD 1 56 LEU HA . . 5.210 4.842 4.487 5.199 . 0 0 "[ . 1 . 2]" 1
1214 1 52 LEU QD 1 56 LEU QD . . 3.020 2.002 1.715 2.543 . 0 0 "[ . 1 . 2]" 1
1215 1 52 LEU QD 1 56 LEU HG . . 3.230 2.867 2.442 3.272 0.042 8 0 "[ . 1 . 2]" 1
1216 1 52 LEU QD 2 4 ILE MG . . 3.070 1.914 1.777 2.131 . 0 0 "[ . 1 . 2]" 1
1217 1 52 LEU QD 2 5 THR HA . . 4.680 4.071 3.889 4.280 . 0 0 "[ . 1 . 2]" 1
1218 1 52 LEU QD 2 5 THR HB . . 3.510 2.117 1.923 2.393 . 0 0 "[ . 1 . 2]" 1
1219 1 52 LEU QD 2 5 THR MG . . 2.680 1.755 1.671 1.806 . 0 0 "[ . 1 . 2]" 1
1220 1 52 LEU QD 2 7 PHE QE . . 4.050 2.643 2.278 2.953 . 0 0 "[ . 1 . 2]" 1
1221 1 52 LEU QD 2 16 PHE HA . . 5.440 5.123 4.503 5.553 0.113 18 0 "[ . 1 . 2]" 1
1222 1 52 LEU QD 2 16 PHE QE . . 3.930 2.794 2.114 3.255 . 0 0 "[ . 1 . 2]" 1
1223 1 52 LEU MD1 1 53 ALA MB . . 5.500 5.256 5.026 5.477 . 0 0 "[ . 1 . 2]" 1
1224 1 52 LEU MD1 2 4 ILE MG . . 3.610 1.965 1.782 2.294 . 0 0 "[ . 1 . 2]" 1
1225 1 52 LEU MD1 2 5 THR HA . . 5.500 4.687 4.241 5.115 . 0 0 "[ . 1 . 2]" 1
1226 1 52 LEU MD1 2 5 THR MG . . 3.110 1.824 1.780 1.900 . 0 0 "[ . 1 . 2]" 1
1227 1 52 LEU MD1 2 7 PHE QE . . 4.970 2.783 2.314 3.192 . 0 0 "[ . 1 . 2]" 1
1228 1 52 LEU MD1 2 7 PHE HZ . . 4.780 2.261 1.963 3.411 . 0 0 "[ . 1 . 2]" 1
1229 1 52 LEU MD1 2 16 PHE QE . . 4.600 3.092 2.278 3.712 . 0 0 "[ . 1 . 2]" 1
1230 1 52 LEU MD2 1 53 ALA MB . . 5.500 3.374 3.218 3.602 . 0 0 "[ . 1 . 2]" 1
1231 1 52 LEU MD2 2 4 ILE MG . . 3.610 3.096 2.329 3.620 0.010 14 0 "[ . 1 . 2]" 1
1232 1 52 LEU MD2 2 5 THR HA . . 5.500 4.618 4.047 5.211 . 0 0 "[ . 1 . 2]" 1
1233 1 52 LEU MD2 2 5 THR MG . . 3.110 2.367 1.922 2.723 . 0 0 "[ . 1 . 2]" 1
1234 1 52 LEU MD2 2 7 PHE QE . . 4.970 3.491 2.972 4.003 . 0 0 "[ . 1 . 2]" 1
1235 1 52 LEU MD2 2 7 PHE HZ . . 4.780 3.018 2.189 3.636 . 0 0 "[ . 1 . 2]" 1
1236 1 52 LEU MD2 2 16 PHE QE . . 4.600 3.560 2.138 4.283 . 0 0 "[ . 1 . 2]" 1
1237 1 52 LEU HG 2 7 PHE QE . . 5.500 4.018 3.761 4.273 . 0 0 "[ . 1 . 2]" 1
1238 1 52 LEU HG 2 19 TYR QE . . 5.500 4.952 4.456 5.516 0.016 19 0 "[ . 1 . 2]" 1
1239 1 53 ALA H 1 53 ALA MB . . 2.900 2.097 2.055 2.165 . 0 0 "[ . 1 . 2]" 1
1240 1 53 ALA HA 1 56 LEU H . . 5.500 3.450 3.284 3.579 . 0 0 "[ . 1 . 2]" 1
1241 1 53 ALA HA 1 56 LEU QB . . 3.940 2.608 2.367 2.740 . 0 0 "[ . 1 . 2]" 1
1242 1 53 ALA HA 1 56 LEU QD . . 3.150 2.889 2.433 3.063 . 0 0 "[ . 1 . 2]" 1
1243 1 53 ALA HA 1 56 LEU HG . . 5.140 4.151 3.648 4.599 . 0 0 "[ . 1 . 2]" 1
1244 1 53 ALA HA 2 16 PHE HZ . . 5.500 5.507 5.371 5.595 0.095 9 0 "[ . 1 . 2]" 1
1245 1 53 ALA MB 1 54 ARG H . . 3.350 2.746 2.587 2.890 . 0 0 "[ . 1 . 2]" 1
1246 1 53 ALA MB 1 54 ARG HA . . 5.500 3.802 3.736 3.858 . 0 0 "[ . 1 . 2]" 1
1247 1 53 ALA MB 1 54 ARG QD . . 5.040 4.573 3.883 4.962 . 0 0 "[ . 1 . 2]" 1
1248 1 53 ALA MB 1 56 LEU QD . . 4.020 3.918 3.576 4.126 0.106 10 0 "[ . 1 . 2]" 1
1249 1 53 ALA MB 1 57 GLU HG2 . . 5.500 5.288 4.932 5.515 0.015 15 0 "[ . 1 . 2]" 1
1250 1 54 ARG H 1 54 ARG QB . . 2.940 2.285 2.169 2.445 . 0 0 "[ . 1 . 2]" 1
1251 1 54 ARG H 1 54 ARG QD . . 4.070 3.597 3.190 3.866 . 0 0 "[ . 1 . 2]" 1
1252 1 54 ARG H 1 54 ARG QG . . 3.280 2.626 2.217 3.179 . 0 0 "[ . 1 . 2]" 1
1253 1 54 ARG H 1 55 PHE H . . 3.610 2.480 2.359 2.578 . 0 0 "[ . 1 . 2]" 1
1254 1 54 ARG HA 1 54 ARG QD . . 4.690 4.054 3.816 4.228 . 0 0 "[ . 1 . 2]" 1
1255 1 54 ARG HA 1 57 GLU HG2 . . 4.780 2.672 2.431 3.045 . 0 0 "[ . 1 . 2]" 1
1256 1 54 ARG HA 1 57 GLU HG3 . . 4.570 4.122 3.734 4.448 . 0 0 "[ . 1 . 2]" 1
1257 1 54 ARG QB 1 54 ARG QD . . 2.770 2.129 2.048 2.268 . 0 0 "[ . 1 . 2]" 1
1258 1 55 PHE H 1 56 LEU H . . 4.230 2.354 2.296 2.404 . 0 0 "[ . 1 . 2]" 1
1259 1 55 PHE HA 1 55 PHE QD . . 3.410 2.371 2.101 3.111 . 0 0 "[ . 1 . 2]" 1
1260 1 55 PHE HA 1 55 PHE QE . . 5.500 4.310 4.198 4.631 . 0 0 "[ . 1 . 2]" 1
1261 1 55 PHE HA 1 62 LEU QD . . 5.090 3.662 3.411 4.151 . 0 0 "[ . 1 . 2]" 1
1262 1 55 PHE HB3 1 56 LEU H . . 3.790 2.688 2.556 2.990 . 0 0 "[ . 1 . 2]" 1
1263 1 55 PHE HB3 1 56 LEU QD . . 4.480 4.272 2.775 4.514 0.034 1 0 "[ . 1 . 2]" 1
1264 1 55 PHE HB3 1 62 LEU QD . . 5.170 3.195 2.890 3.919 . 0 0 "[ . 1 . 2]" 1
1265 1 55 PHE HB3 2 16 PHE QD . . 4.800 4.189 3.971 4.726 . 0 0 "[ . 1 . 2]" 1
1266 1 55 PHE HB3 2 16 PHE HZ . . 4.060 2.639 2.344 2.903 . 0 0 "[ . 1 . 2]" 1
1267 1 55 PHE QD 1 58 ASN HB2 . . 5.500 3.572 3.144 3.895 . 0 0 "[ . 1 . 2]" 1
1268 1 55 PHE QD 1 58 ASN HB3 . . 5.500 4.520 4.038 4.962 . 0 0 "[ . 1 . 2]" 1
1269 1 55 PHE QD 1 61 ASP HB2 . . 5.500 5.245 4.740 5.501 0.001 17 0 "[ . 1 . 2]" 1
1270 1 55 PHE QD 1 61 ASP HB3 . . 5.500 5.216 4.539 5.522 0.022 3 0 "[ . 1 . 2]" 1
1271 1 55 PHE QD 1 62 LEU HA . . 5.290 4.922 4.714 5.240 . 0 0 "[ . 1 . 2]" 1
1272 1 55 PHE QD 1 62 LEU HB2 . . 5.500 4.196 4.076 4.466 . 0 0 "[ . 1 . 2]" 1
1273 1 55 PHE QD 1 62 LEU HB3 . . 4.850 2.847 2.647 3.132 . 0 0 "[ . 1 . 2]" 1
1274 1 55 PHE QD 1 62 LEU QD . . 4.200 2.132 1.860 2.399 . 0 0 "[ . 1 . 2]" 1
1275 1 55 PHE QD 1 62 LEU HG . . 4.280 4.211 3.036 4.457 0.177 11 0 "[ . 1 . 2]" 1
1276 1 55 PHE QE 1 58 ASN HB3 . . 5.500 4.789 4.104 5.230 . 0 0 "[ . 1 . 2]" 1
1277 1 55 PHE HZ 1 61 ASP HB2 . . 4.420 2.891 2.215 3.602 . 0 0 "[ . 1 . 2]" 1
1278 1 55 PHE HZ 1 61 ASP HB3 . . 5.060 2.198 1.977 2.686 . 0 0 "[ . 1 . 2]" 1
1279 1 55 PHE HZ 1 62 LEU HA . . 4.420 4.290 4.031 4.445 0.025 13 0 "[ . 1 . 2]" 1
1280 1 55 PHE HZ 1 62 LEU HB2 . . 5.500 5.591 5.526 5.671 0.171 11 0 "[ . 1 . 2]" 1
1281 1 55 PHE HZ 1 62 LEU HB3 . . 5.500 3.968 3.884 4.062 . 0 0 "[ . 1 . 2]" 1
1282 1 55 PHE HZ 1 62 LEU HG . . 5.500 4.638 4.154 5.260 . 0 0 "[ . 1 . 2]" 1
1283 1 56 LEU H 1 56 LEU QB . . 3.420 2.130 2.037 2.303 . 0 0 "[ . 1 . 2]" 1
1284 1 56 LEU H 1 56 LEU MD1 . . 5.500 3.803 3.586 4.058 . 0 0 "[ . 1 . 2]" 1
1285 1 56 LEU H 1 56 LEU MD2 . . 5.500 3.749 2.204 4.067 . 0 0 "[ . 1 . 2]" 1
1286 1 56 LEU H 1 57 GLU H . . 3.550 2.707 2.600 2.758 . 0 0 "[ . 1 . 2]" 1
1287 1 56 LEU H 2 16 PHE HZ . . 4.700 3.072 2.842 3.680 . 0 0 "[ . 1 . 2]" 1
1288 1 56 LEU HA 1 56 LEU MD1 . . 3.990 3.628 2.070 3.851 . 0 0 "[ . 1 . 2]" 1
1289 1 56 LEU HA 1 56 LEU QD . . 2.670 2.031 1.947 2.249 . 0 0 "[ . 1 . 2]" 1
1290 1 56 LEU HA 1 56 LEU MD2 . . 3.990 2.093 1.953 2.564 . 0 0 "[ . 1 . 2]" 1
1291 1 56 LEU HA 1 56 LEU HG . . 3.440 2.838 2.626 3.648 0.208 9 0 "[ . 1 . 2]" 1
1292 1 56 LEU HA 2 16 PHE HZ . . 3.970 2.645 2.288 3.512 . 0 0 "[ . 1 . 2]" 1
1293 1 56 LEU QB 1 56 LEU QD . . 2.480 1.928 1.877 2.039 . 0 0 "[ . 1 . 2]" 1
1294 1 56 LEU QD 1 57 GLU H . . 4.810 4.124 3.907 4.192 . 0 0 "[ . 1 . 2]" 1
1295 1 56 LEU QD 2 7 PHE HZ . . 2.720 2.683 2.358 2.756 0.036 15 0 "[ . 1 . 2]" 1
1296 1 56 LEU QD 2 16 PHE QE . . 3.920 2.517 2.034 3.143 . 0 0 "[ . 1 . 2]" 1
1297 1 56 LEU QD 2 16 PHE HZ . . 2.850 2.468 1.843 2.862 0.012 18 0 "[ . 1 . 2]" 1
1298 1 56 LEU MD1 2 7 PHE HZ . . 4.100 3.119 2.559 4.112 0.012 10 0 "[ . 1 . 2]" 1
1299 1 56 LEU MD1 2 16 PHE QE . . 5.000 3.913 2.803 4.375 . 0 0 "[ . 1 . 2]" 1
1300 1 56 LEU MD2 2 7 PHE HZ . . 4.100 3.068 2.372 3.687 . 0 0 "[ . 1 . 2]" 1
1301 1 56 LEU MD2 2 16 PHE QE . . 5.000 2.590 2.040 3.289 . 0 0 "[ . 1 . 2]" 1
1302 1 56 LEU HG 2 7 PHE HZ . . 5.430 3.226 2.494 5.043 . 0 0 "[ . 1 . 2]" 1
1303 1 56 LEU HG 2 16 PHE HZ . . 4.600 2.325 1.972 4.639 0.039 10 0 "[ . 1 . 2]" 1
1304 1 57 GLU H 1 57 GLU HB3 . . 3.010 2.481 2.399 2.676 . 0 0 "[ . 1 . 2]" 1
1305 1 57 GLU H 1 57 GLU HG2 . . 3.290 2.308 1.947 2.470 . 0 0 "[ . 1 . 2]" 1
1306 1 57 GLU H 1 57 GLU HG3 . . 4.320 3.551 3.442 3.733 . 0 0 "[ . 1 . 2]" 1
1307 1 57 GLU HA 1 57 GLU HB3 . . 2.670 2.538 2.438 2.586 . 0 0 "[ . 1 . 2]" 1
1308 1 57 GLU HA 1 57 GLU HG2 . . 3.970 3.765 3.631 3.798 . 0 0 "[ . 1 . 2]" 1
1309 1 57 GLU HA 1 57 GLU HG3 . . 4.040 3.699 3.642 3.896 . 0 0 "[ . 1 . 2]" 1
1310 1 57 GLU HA 1 58 ASN HA . . 4.880 4.529 4.518 4.536 . 0 0 "[ . 1 . 2]" 1
1311 1 57 GLU HA 1 58 ASN HB2 . . 5.500 5.559 5.537 5.614 0.114 19 0 "[ . 1 . 2]" 1
1312 1 57 GLU HA 1 59 PRO QD . . 4.230 3.065 2.958 3.183 . 0 0 "[ . 1 . 2]" 1
1313 1 57 GLU HB3 1 57 GLU HG2 . . 2.680 2.471 2.436 2.609 . 0 0 "[ . 1 . 2]" 1
1314 1 57 GLU HG2 1 58 ASN HA . . 5.370 4.690 4.435 4.781 . 0 0 "[ . 1 . 2]" 1
1315 1 57 GLU HG2 1 58 ASN HB2 . . 4.270 4.189 4.069 4.275 0.005 15 0 "[ . 1 . 2]" 1
1316 1 57 GLU HG2 1 58 ASN HB3 . . 5.500 5.497 5.240 5.525 0.025 18 0 "[ . 1 . 2]" 1
1317 1 57 GLU HG2 1 59 PRO QD . . 5.350 5.120 4.897 5.170 . 0 0 "[ . 1 . 2]" 1
1318 1 57 GLU HG3 1 58 ASN HA . . 5.500 3.786 3.691 4.215 . 0 0 "[ . 1 . 2]" 1
1319 1 57 GLU HG3 1 58 ASN HB2 . . 4.660 4.339 4.153 4.671 0.011 19 0 "[ . 1 . 2]" 1
1320 1 57 GLU HG3 1 58 ASN HB3 . . 5.410 5.138 5.003 5.376 . 0 0 "[ . 1 . 2]" 1
1321 1 57 GLU HG3 1 59 PRO QD . . 5.350 4.423 4.274 4.828 . 0 0 "[ . 1 . 2]" 1
1322 1 58 ASN HA 1 59 PRO HA . . 4.780 4.652 4.632 4.670 . 0 0 "[ . 1 . 2]" 1
1323 1 58 ASN HA 1 59 PRO QB . . 5.230 4.819 4.783 4.855 . 0 0 "[ . 1 . 2]" 1
1324 1 58 ASN HA 1 59 PRO QD . . 3.000 2.045 1.999 2.095 . 0 0 "[ . 1 . 2]" 1
1325 1 58 ASN HA 1 59 PRO QG . . 4.350 3.924 3.889 3.961 . 0 0 "[ . 1 . 2]" 1
1326 1 58 ASN HA 1 60 ALA MB . . 4.530 4.393 4.234 4.530 . 0 0 "[ . 1 . 2]" 1
1327 1 58 ASN HA 1 62 LEU QD . . 5.440 4.680 4.167 4.970 . 0 0 "[ . 1 . 2]" 1
1328 1 58 ASN HB2 1 59 PRO HA . . 5.490 5.345 5.252 5.389 . 0 0 "[ . 1 . 2]" 1
1329 1 58 ASN HB2 1 60 ALA MB . . 5.500 4.995 4.675 5.248 . 0 0 "[ . 1 . 2]" 1
1330 1 58 ASN HB2 1 62 LEU MD1 . . 5.500 5.567 5.527 5.632 0.132 19 0 "[ . 1 . 2]" 1
1331 1 58 ASN HB2 1 62 LEU MD2 . . 5.500 3.668 3.161 3.975 . 0 0 "[ . 1 . 2]" 1
1332 1 58 ASN HB2 1 62 LEU HG . . 5.500 5.220 4.759 5.417 . 0 0 "[ . 1 . 2]" 1
1333 1 58 ASN HB3 1 59 PRO HA . . 5.410 5.114 5.086 5.172 . 0 0 "[ . 1 . 2]" 1
1334 1 58 ASN HB3 1 60 ALA MB . . 5.500 3.644 3.345 3.966 . 0 0 "[ . 1 . 2]" 1
1335 1 58 ASN HB3 1 62 LEU HG . . 5.500 5.329 5.050 5.503 0.003 11 0 "[ . 1 . 2]" 1
1336 1 59 PRO HA 1 60 ALA MB . . 4.420 4.219 4.097 4.311 . 0 0 "[ . 1 . 2]" 1
1337 1 59 PRO HA 1 62 LEU QD . . 3.660 2.277 1.920 2.992 . 0 0 "[ . 1 . 2]" 1
1338 1 59 PRO HA 1 62 LEU HG . . 3.590 3.110 2.694 3.592 0.002 18 0 "[ . 1 . 2]" 1
1339 1 59 PRO QD 1 60 ALA MB . . 5.350 4.427 4.234 4.585 . 0 0 "[ . 1 . 2]" 1
1340 1 59 PRO QD 1 62 LEU QD . . 4.630 3.939 3.567 4.412 . 0 0 "[ . 1 . 2]" 1
1341 1 60 ALA HA 1 61 ASP HA . . 4.840 4.622 4.579 4.726 . 0 0 "[ . 1 . 2]" 1
1342 1 60 ALA HA 1 61 ASP HB2 . . 5.500 5.506 5.415 5.599 0.099 9 0 "[ . 1 . 2]" 1
1343 1 60 ALA HA 1 63 GLU QG . . 4.910 2.992 2.140 4.307 . 0 0 "[ . 1 . 2]" 1
1344 1 60 ALA MB 1 61 ASP HA . . 3.960 3.780 3.629 3.861 . 0 0 "[ . 1 . 2]" 1
1345 1 60 ALA MB 1 61 ASP HB2 . . 4.530 3.573 3.379 3.905 . 0 0 "[ . 1 . 2]" 1
1346 1 60 ALA MB 1 61 ASP HB3 . . 5.360 4.868 4.700 5.133 . 0 0 "[ . 1 . 2]" 1
1347 1 61 ASP HA 1 61 ASP HB2 . . 3.000 2.853 2.813 2.921 . 0 0 "[ . 1 . 2]" 1
1348 1 61 ASP HA 1 62 LEU QD . . 5.270 5.108 4.855 5.229 . 0 0 "[ . 1 . 2]" 1
1349 1 61 ASP HA 1 63 GLU HG2 . . 5.500 5.200 3.682 5.586 0.086 19 0 "[ . 1 . 2]" 1
1350 1 61 ASP HA 1 63 GLU HG3 . . 5.500 4.266 3.692 5.060 . 0 0 "[ . 1 . 2]" 1
1351 1 61 ASP HB2 1 62 LEU HA . . 5.190 5.081 4.909 5.191 0.001 4 0 "[ . 1 . 2]" 1
1352 1 61 ASP HB2 1 62 LEU HB3 . . 5.500 5.259 4.985 5.388 . 0 0 "[ . 1 . 2]" 1
1353 1 61 ASP HB2 1 62 LEU QD . . 5.010 4.553 4.049 4.837 . 0 0 "[ . 1 . 2]" 1
1354 1 61 ASP HB2 1 62 LEU HG . . 4.630 4.456 4.185 4.663 0.033 5 0 "[ . 1 . 2]" 1
1355 1 61 ASP HB3 1 62 LEU HA . . 4.010 3.752 3.704 3.813 . 0 0 "[ . 1 . 2]" 1
1356 1 61 ASP HB3 1 62 LEU HG . . 4.730 4.400 4.051 4.741 0.011 5 0 "[ . 1 . 2]" 1
1357 1 62 LEU H 1 62 LEU HB3 . . 3.590 2.703 2.671 2.773 . 0 0 "[ . 1 . 2]" 1
1358 1 62 LEU H 1 62 LEU MD1 . . 5.500 3.376 2.814 3.570 . 0 0 "[ . 1 . 2]" 1
1359 1 62 LEU H 1 62 LEU QD . . 4.600 2.831 2.669 2.915 . 0 0 "[ . 1 . 2]" 1
1360 1 62 LEU H 1 62 LEU MD2 . . 5.500 3.087 2.759 3.476 . 0 0 "[ . 1 . 2]" 1
1361 1 62 LEU HA 2 12 VAL QG . . 5.210 3.515 3.052 3.764 . 0 0 "[ . 1 . 2]" 1
1362 1 62 LEU HB2 1 62 LEU QD . . 3.090 1.969 1.914 2.069 . 0 0 "[ . 1 . 2]" 1
1363 1 62 LEU HB2 1 63 GLU QG . . 5.340 4.877 4.539 5.254 . 0 0 "[ . 1 . 2]" 1
1364 1 62 LEU HB2 2 12 VAL HA . . 5.500 2.846 2.463 3.278 . 0 0 "[ . 1 . 2]" 1
1365 1 62 LEU HB2 2 12 VAL MG1 . . 2.900 2.128 1.945 2.398 . 0 0 "[ . 1 . 2]" 1
1366 1 62 LEU HB2 2 12 VAL MG2 . . 2.900 2.579 2.155 2.710 . 0 0 "[ . 1 . 2]" 1
1367 1 62 LEU HB2 2 16 PHE HZ . . 5.410 4.786 4.531 5.292 . 0 0 "[ . 1 . 2]" 1
1368 1 62 LEU HB3 2 12 VAL HA . . 5.500 3.939 3.579 4.313 . 0 0 "[ . 1 . 2]" 1
1369 1 62 LEU HB3 2 12 VAL QG . . 3.150 3.100 2.677 3.222 0.072 11 0 "[ . 1 . 2]" 1
1370 1 62 LEU QD 2 12 VAL HA . . 4.610 3.812 3.467 4.143 . 0 0 "[ . 1 . 2]" 1
1371 1 62 LEU QD 2 16 PHE HZ . . 3.940 2.513 2.316 2.884 . 0 0 "[ . 1 . 2]" 1
1372 1 62 LEU MD1 2 12 VAL HA . . 5.240 3.982 3.567 4.350 . 0 0 "[ . 1 . 2]" 1
1373 1 62 LEU MD2 2 12 VAL HA . . 5.240 4.878 4.588 5.204 . 0 0 "[ . 1 . 2]" 1
1374 1 62 LEU HG 1 63 GLU QG . . 4.290 3.704 3.108 4.334 0.044 11 0 "[ . 1 . 2]" 1
1375 1 63 GLU H 1 63 GLU QB . . 3.230 2.771 2.614 3.428 0.198 11 0 "[ . 1 . 2]" 1
1376 1 63 GLU H 2 12 VAL QG . . 5.440 3.813 3.432 4.086 . 0 0 "[ . 1 . 2]" 1
1377 1 63 GLU HA 1 63 GLU HG2 . . 3.910 3.285 2.418 3.946 0.036 1 0 "[ . 1 . 2]" 1
1378 1 63 GLU HA 1 63 GLU QG . . 3.390 2.948 2.358 3.339 . 0 0 "[ . 1 . 2]" 1
1379 1 63 GLU HA 1 63 GLU HG3 . . 3.910 3.581 3.278 3.800 . 0 0 "[ . 1 . 2]" 1
1380 1 63 GLU HA 2 9 ASN HB3 . . 5.500 5.532 5.406 5.571 0.071 10 0 "[ . 1 . 2]" 1
1381 1 63 GLU HA 2 12 VAL H . . 4.840 4.823 4.307 4.901 0.061 19 0 "[ . 1 . 2]" 1
1382 1 63 GLU HA 2 12 VAL MG1 . . 5.390 4.794 4.406 5.077 . 0 0 "[ . 1 . 2]" 1
1383 1 63 GLU HA 2 12 VAL QG . . 4.640 2.707 2.489 2.961 . 0 0 "[ . 1 . 2]" 1
1384 1 63 GLU HA 2 12 VAL MG2 . . 5.390 2.722 2.503 2.981 . 0 0 "[ . 1 . 2]" 1
1385 1 63 GLU QG 2 12 VAL QG . . 5.280 4.301 3.794 4.748 . 0 0 "[ . 1 . 2]" 1
1386 2 1 MET HB3 2 1 MET ME . . 2.650 2.236 2.159 2.290 . 0 0 "[ . 1 . 2]" 1
1387 2 1 MET HB3 2 1 MET HG2 . . 2.820 2.829 2.805 2.838 0.018 18 0 "[ . 1 . 2]" 1
1388 2 1 MET ME 2 1 MET HG2 . . 2.990 2.430 2.390 2.474 . 0 0 "[ . 1 . 2]" 1
1389 2 1 MET ME 2 28 THR HB . . 4.100 4.083 3.893 4.134 0.034 8 0 "[ . 1 . 2]" 1
1390 2 1 MET ME 2 28 THR MG . . 3.980 4.020 3.869 4.071 0.091 14 0 "[ . 1 . 2]" 1
1391 2 2 LEU H 2 2 LEU HG . . 5.500 4.473 4.376 4.566 . 0 0 "[ . 1 . 2]" 1
1392 2 2 LEU HA 2 2 LEU HB2 . . 2.870 2.661 2.398 2.743 . 0 0 "[ . 1 . 2]" 1
1393 2 2 LEU HA 2 2 LEU QD . . 2.990 2.361 2.127 2.670 . 0 0 "[ . 1 . 2]" 1
1394 2 2 LEU HA 2 2 LEU HG . . 3.440 2.620 2.385 3.309 . 0 0 "[ . 1 . 2]" 1
1395 2 2 LEU HA 2 3 MET H . . 3.050 2.142 2.140 2.146 . 0 0 "[ . 1 . 2]" 1
1396 2 2 LEU HA 2 3 MET HA . . 5.500 4.376 4.363 4.383 . 0 0 "[ . 1 . 2]" 1
1397 2 2 LEU HB2 2 2 LEU MD1 . . 3.480 2.295 2.234 2.374 . 0 0 "[ . 1 . 2]" 1
1398 2 2 LEU HB2 2 2 LEU QD . . 2.860 2.210 2.042 2.283 . 0 0 "[ . 1 . 2]" 1
1399 2 2 LEU HB2 2 2 LEU MD2 . . 3.480 3.048 2.254 3.191 . 0 0 "[ . 1 . 2]" 1
1400 2 2 LEU HB2 2 3 MET H . . 4.560 4.456 4.198 4.515 . 0 0 "[ . 1 . 2]" 1
1401 2 2 LEU HB3 2 2 LEU MD1 . . 3.360 2.496 2.308 3.190 . 0 0 "[ . 1 . 2]" 1
1402 2 2 LEU HB3 2 2 LEU QD . . 2.780 2.110 2.018 2.302 . 0 0 "[ . 1 . 2]" 1
1403 2 2 LEU HB3 2 2 LEU MD2 . . 3.360 2.306 2.176 2.381 . 0 0 "[ . 1 . 2]" 1
1404 2 2 LEU QD 2 3 MET H . . 5.050 2.379 2.202 2.647 . 0 0 "[ . 1 . 2]" 1
1405 2 2 LEU QD 2 3 MET HG2 . . 5.440 5.288 5.073 5.477 0.037 15 0 "[ . 1 . 2]" 1
1406 2 2 LEU QD 2 3 MET HG3 . . 5.440 5.420 5.262 5.497 0.057 18 0 "[ . 1 . 2]" 1
1407 2 3 MET H 2 3 MET QB . . 3.650 2.098 2.077 2.117 . 0 0 "[ . 1 . 2]" 1
1408 2 3 MET H 2 3 MET HG2 . . 4.950 4.375 4.341 4.416 . 0 0 "[ . 1 . 2]" 1
1409 2 3 MET H 2 3 MET HG3 . . 4.090 4.033 3.926 4.097 0.007 5 0 "[ . 1 . 2]" 1
1410 2 3 MET HA 2 3 MET ME . . 4.530 4.175 4.086 4.254 . 0 0 "[ . 1 . 2]" 1
1411 2 3 MET HA 2 3 MET HG2 . . 3.460 2.362 2.294 2.460 . 0 0 "[ . 1 . 2]" 1
1412 2 3 MET HA 2 3 MET HG3 . . 3.430 2.776 2.615 2.874 . 0 0 "[ . 1 . 2]" 1
1413 2 3 MET HA 2 4 ILE H . . 3.410 2.144 2.141 2.157 . 0 0 "[ . 1 . 2]" 1
1414 2 3 MET HA 2 4 ILE HA . . 4.830 4.387 4.372 4.406 . 0 0 "[ . 1 . 2]" 1
1415 2 3 MET HA 2 4 ILE MD . . 5.270 4.422 4.293 4.535 . 0 0 "[ . 1 . 2]" 1
1416 2 3 MET HA 2 4 ILE MG . . 5.500 5.461 5.455 5.467 . 0 0 "[ . 1 . 2]" 1
1417 2 3 MET QB 2 3 MET ME . . 3.460 3.405 3.092 3.546 0.086 3 0 "[ . 1 . 2]" 1
1418 2 3 MET HB2 2 3 MET ME . . 4.330 4.185 4.071 4.233 . 0 0 "[ . 1 . 2]" 1
1419 2 3 MET HB3 2 3 MET ME . . 4.330 3.612 3.204 3.810 . 0 0 "[ . 1 . 2]" 1
1420 2 3 MET ME 2 3 MET HG2 . . 3.510 2.109 1.992 2.190 . 0 0 "[ . 1 . 2]" 1
1421 2 3 MET ME 2 3 MET HG3 . . 3.540 2.866 2.711 3.135 . 0 0 "[ . 1 . 2]" 1
1422 2 3 MET ME 2 4 ILE H . . 5.500 4.268 4.116 4.545 . 0 0 "[ . 1 . 2]" 1
1423 2 3 MET ME 2 5 THR HA . . 3.260 3.030 2.705 3.249 . 0 0 "[ . 1 . 2]" 1
1424 2 3 MET ME 2 5 THR MG . . 4.670 4.083 3.954 4.164 . 0 0 "[ . 1 . 2]" 1
1425 2 3 MET ME 2 6 SER HA . . 3.820 2.829 2.525 3.084 . 0 0 "[ . 1 . 2]" 1
1426 2 3 MET ME 2 6 SER QB . . 3.040 1.925 1.841 2.120 . 0 0 "[ . 1 . 2]" 1
1427 2 3 MET HG2 2 4 ILE HA . . 5.500 5.106 5.002 5.211 . 0 0 "[ . 1 . 2]" 1
1428 2 3 MET HG2 2 4 ILE MG . . 5.500 5.626 5.576 5.688 0.188 16 0 "[ . 1 . 2]" 1
1429 2 3 MET HG2 2 5 THR HA . . 4.720 4.488 4.378 4.585 . 0 0 "[ . 1 . 2]" 1
1430 2 4 ILE H 2 4 ILE MD . . 5.500 3.324 3.247 3.431 . 0 0 "[ . 1 . 2]" 1
1431 2 4 ILE H 2 4 ILE HG12 . . 5.500 2.464 2.359 2.600 . 0 0 "[ . 1 . 2]" 1
1432 2 4 ILE H 2 4 ILE HG13 . . 5.500 3.862 3.780 3.968 . 0 0 "[ . 1 . 2]" 1
1433 2 4 ILE H 2 5 THR H . . 3.460 2.519 2.337 2.656 . 0 0 "[ . 1 . 2]" 1
1434 2 4 ILE HA 2 4 ILE MD . . 2.970 2.008 1.922 2.045 . 0 0 "[ . 1 . 2]" 1
1435 2 4 ILE HA 2 4 ILE HG12 . . 4.110 3.075 3.039 3.118 . 0 0 "[ . 1 . 2]" 1
1436 2 4 ILE HA 2 5 THR HA . . 4.780 4.694 4.670 4.704 . 0 0 "[ . 1 . 2]" 1
1437 2 4 ILE HB 2 4 ILE MD . . 3.390 3.224 3.221 3.227 . 0 0 "[ . 1 . 2]" 1
1438 2 4 ILE HB 2 5 THR H . . 3.330 2.497 2.403 2.569 . 0 0 "[ . 1 . 2]" 1
1439 2 4 ILE HB 2 5 THR MG . . 3.770 3.144 3.072 3.233 . 0 0 "[ . 1 . 2]" 1
1440 2 4 ILE HG13 2 4 ILE MG . . 2.580 2.262 2.191 2.288 . 0 0 "[ . 1 . 2]" 1
1441 2 4 ILE MG 2 5 THR H . . 3.760 3.191 3.086 3.299 . 0 0 "[ . 1 . 2]" 1
1442 2 4 ILE MG 2 5 THR HA . . 4.360 4.167 4.105 4.267 . 0 0 "[ . 1 . 2]" 1
1443 2 4 ILE MG 2 5 THR MG . . 3.090 2.338 2.141 2.557 . 0 0 "[ . 1 . 2]" 1
1444 2 5 THR H 2 5 THR HB . . 3.880 3.468 3.405 3.497 . 0 0 "[ . 1 . 2]" 1
1445 2 5 THR H 2 5 THR MG . . 3.670 2.764 2.687 2.789 . 0 0 "[ . 1 . 2]" 1
1446 2 5 THR HA 2 5 THR MG . . 3.510 3.200 3.194 3.204 . 0 0 "[ . 1 . 2]" 1
1447 2 5 THR HA 2 6 SER H . . 3.220 2.588 2.428 2.666 . 0 0 "[ . 1 . 2]" 1
1448 2 5 THR HA 2 6 SER HA . . 5.500 4.479 4.408 4.502 . 0 0 "[ . 1 . 2]" 1
1449 2 5 THR HA 2 6 SER QB . . 4.380 4.082 3.858 4.402 0.022 8 0 "[ . 1 . 2]" 1
1450 2 5 THR MG 2 6 SER H . . 3.970 2.801 2.557 3.205 . 0 0 "[ . 1 . 2]" 1
1451 2 5 THR MG 2 6 SER HA . . 3.700 3.436 3.318 3.721 0.021 1 0 "[ . 1 . 2]" 1
1452 2 5 THR MG 2 6 SER QB . . 4.860 4.477 4.277 4.682 . 0 0 "[ . 1 . 2]" 1
1453 2 5 THR MG 2 7 PHE HA . . 5.310 4.698 4.471 4.867 . 0 0 "[ . 1 . 2]" 1
1454 2 5 THR MG 2 7 PHE HB3 . . 5.500 5.245 5.127 5.517 0.017 4 0 "[ . 1 . 2]" 1
1455 2 5 THR MG 2 7 PHE QD . . 3.880 3.342 2.641 3.498 . 0 0 "[ . 1 . 2]" 1
1456 2 5 THR MG 2 7 PHE HZ . . 3.530 2.469 2.226 3.106 . 0 0 "[ . 1 . 2]" 1
1457 2 5 THR MG 2 13 ALA HA . . 5.500 5.248 5.095 5.381 . 0 0 "[ . 1 . 2]" 1
1458 2 6 SER H 2 6 SER QB . . 3.260 2.887 2.583 3.179 . 0 0 "[ . 1 . 2]" 1
1459 2 6 SER HA 2 7 PHE HB2 . . 5.040 4.456 4.306 4.513 . 0 0 "[ . 1 . 2]" 1
1460 2 6 SER HA 2 7 PHE QD . . 5.500 4.559 3.494 4.744 . 0 0 "[ . 1 . 2]" 1
1461 2 7 PHE H 2 7 PHE QD . . 5.500 3.648 3.263 3.781 . 0 0 "[ . 1 . 2]" 1
1462 2 7 PHE H 2 7 PHE QE . . 5.500 5.256 5.150 5.382 . 0 0 "[ . 1 . 2]" 1
1463 2 7 PHE HA 2 7 PHE QE . . 5.500 4.305 4.236 4.548 . 0 0 "[ . 1 . 2]" 1
1464 2 7 PHE HA 2 8 ALA HA . . 4.810 4.450 4.416 4.496 . 0 0 "[ . 1 . 2]" 1
1465 2 7 PHE HA 2 8 ALA MB . . 4.020 3.837 3.774 3.902 . 0 0 "[ . 1 . 2]" 1
1466 2 7 PHE HA 2 12 VAL HB . . 5.500 5.524 5.503 5.559 0.059 18 0 "[ . 1 . 2]" 1
1467 2 7 PHE HA 2 12 VAL QG . . 5.130 4.466 4.337 4.645 . 0 0 "[ . 1 . 2]" 1
1468 2 7 PHE HB2 2 12 VAL MG1 . . 5.500 3.987 3.738 4.297 . 0 0 "[ . 1 . 2]" 1
1469 2 7 PHE HB2 2 12 VAL QG . . 4.210 3.897 3.677 4.156 . 0 0 "[ . 1 . 2]" 1
1470 2 7 PHE HB2 2 12 VAL MG2 . . 5.500 5.505 5.392 5.543 0.043 7 0 "[ . 1 . 2]" 1
1471 2 7 PHE HB2 2 13 ALA HA . . 3.800 3.716 3.567 3.816 0.016 5 0 "[ . 1 . 2]" 1
1472 2 7 PHE HB2 2 13 ALA MB . . 3.170 2.780 2.534 3.100 . 0 0 "[ . 1 . 2]" 1
1473 2 7 PHE HB2 2 29 ILE MD . . 4.350 4.182 3.901 4.268 . 0 0 "[ . 1 . 2]" 1
1474 2 7 PHE HB2 2 29 ILE MG . . 5.490 4.604 4.300 4.752 . 0 0 "[ . 1 . 2]" 1
1475 2 7 PHE HB3 2 12 VAL MG1 . . 4.590 3.215 2.980 3.440 . 0 0 "[ . 1 . 2]" 1
1476 2 7 PHE HB3 2 12 VAL QG . . 3.700 3.123 2.920 3.307 . 0 0 "[ . 1 . 2]" 1
1477 2 7 PHE HB3 2 12 VAL MG2 . . 4.590 4.250 4.138 4.298 . 0 0 "[ . 1 . 2]" 1
1478 2 7 PHE HB3 2 13 ALA HA . . 4.550 4.374 4.283 4.509 . 0 0 "[ . 1 . 2]" 1
1479 2 7 PHE HB3 2 13 ALA MB . . 3.960 3.665 3.479 3.939 . 0 0 "[ . 1 . 2]" 1
1480 2 7 PHE HB3 2 29 ILE MD . . 5.500 5.468 5.186 5.525 0.025 4 0 "[ . 1 . 2]" 1
1481 2 7 PHE QD 2 12 VAL QG . . 3.630 2.933 2.235 3.261 . 0 0 "[ . 1 . 2]" 1
1482 2 7 PHE QD 2 13 ALA HA . . 4.210 2.330 2.064 3.531 . 0 0 "[ . 1 . 2]" 1
1483 2 7 PHE QD 2 13 ALA MB . . 3.830 2.851 2.542 3.691 . 0 0 "[ . 1 . 2]" 1
1484 2 7 PHE QD 2 29 ILE MD . . 5.270 3.222 2.997 3.715 . 0 0 "[ . 1 . 2]" 1
1485 2 7 PHE QD 2 29 ILE MG . . 5.500 4.585 4.247 5.088 . 0 0 "[ . 1 . 2]" 1
1486 2 8 ALA MB 2 9 ASN HA . . 4.610 4.390 4.321 4.457 . 0 0 "[ . 1 . 2]" 1
1487 2 8 ALA MB 2 9 ASN HB2 . . 4.340 4.027 3.874 4.141 . 0 0 "[ . 1 . 2]" 1
1488 2 9 ASN HA 2 10 PRO HA . . 4.480 4.406 4.402 4.410 . 0 0 "[ . 1 . 2]" 1
1489 2 9 ASN HA 2 10 PRO HB3 . . 5.030 4.830 4.829 4.831 . 0 0 "[ . 1 . 2]" 1
1490 2 9 ASN HA 2 10 PRO HD2 . . 3.590 2.217 2.181 2.247 . 0 0 "[ . 1 . 2]" 1
1491 2 9 ASN HA 2 10 PRO HD3 . . 3.580 2.255 2.252 2.258 . 0 0 "[ . 1 . 2]" 1
1492 2 9 ASN HA 2 10 PRO HG2 . . 4.600 4.365 4.336 4.389 . 0 0 "[ . 1 . 2]" 1
1493 2 9 ASN HA 2 10 PRO HG3 . . 4.600 4.375 4.360 4.389 . 0 0 "[ . 1 . 2]" 1
1494 2 9 ASN HB2 2 10 PRO HD2 . . 4.440 4.083 4.036 4.141 . 0 0 "[ . 1 . 2]" 1
1495 2 9 ASN HB2 2 10 PRO HD3 . . 5.340 4.960 4.922 4.995 . 0 0 "[ . 1 . 2]" 1
1496 2 9 ASN HB2 2 12 VAL MG1 . . 4.470 4.320 4.044 4.485 0.015 3 0 "[ . 1 . 2]" 1
1497 2 9 ASN HB2 2 12 VAL QG . . 3.220 2.716 2.469 2.948 . 0 0 "[ . 1 . 2]" 1
1498 2 9 ASN HB2 2 12 VAL MG2 . . 4.470 2.746 2.483 2.993 . 0 0 "[ . 1 . 2]" 1
1499 2 9 ASN HB3 2 10 PRO HA . . 5.010 4.828 4.813 4.846 . 0 0 "[ . 1 . 2]" 1
1500 2 9 ASN HB3 2 10 PRO HD2 . . 4.390 2.935 2.781 3.113 . 0 0 "[ . 1 . 2]" 1
1501 2 9 ASN HB3 2 10 PRO HD3 . . 5.190 4.182 4.070 4.308 . 0 0 "[ . 1 . 2]" 1
1502 2 9 ASN HB3 2 12 VAL H . . 4.290 2.476 2.373 2.552 . 0 0 "[ . 1 . 2]" 1
1503 2 9 ASN HB3 2 12 VAL HB . . 3.900 3.151 2.875 3.384 . 0 0 "[ . 1 . 2]" 1
1504 2 9 ASN HB3 2 12 VAL QG . . 3.430 2.642 2.464 2.799 . 0 0 "[ . 1 . 2]" 1
1505 2 9 ASN HD21 2 12 VAL QG . . 3.910 3.323 2.963 3.758 . 0 0 "[ . 1 . 2]" 1
1506 2 9 ASN HD22 2 12 VAL QG . . 4.740 4.490 4.266 4.743 0.003 16 0 "[ . 1 . 2]" 1
1507 2 10 PRO HA 2 13 ALA MB . . 4.040 2.538 2.481 2.611 . 0 0 "[ . 1 . 2]" 1
1508 2 10 PRO HA 2 29 ILE MG . . 4.600 4.295 4.142 4.500 . 0 0 "[ . 1 . 2]" 1
1509 2 10 PRO HA 2 31 GLN HG2 . . 5.500 5.151 4.957 5.387 . 0 0 "[ . 1 . 2]" 1
1510 2 10 PRO HA 2 31 GLN HG3 . . 5.500 4.291 3.969 4.645 . 0 0 "[ . 1 . 2]" 1
1511 2 10 PRO HB3 2 13 ALA MB . . 4.520 4.551 4.505 4.584 0.064 4 0 "[ . 1 . 2]" 1
1512 2 10 PRO QG 2 13 ALA MB . . 5.350 5.205 5.152 5.260 . 0 0 "[ . 1 . 2]" 1
1513 2 11 ARG H 2 11 ARG QD . . 5.340 3.695 1.942 4.695 . 0 0 "[ . 1 . 2]" 1
1514 2 11 ARG H 2 11 ARG HG2 . . 5.500 3.225 1.944 4.598 . 0 0 "[ . 1 . 2]" 1
1515 2 11 ARG H 2 11 ARG HG3 . . 5.500 3.214 1.935 4.522 . 0 0 "[ . 1 . 2]" 1
1516 2 11 ARG H 2 12 VAL QG . . 5.170 4.234 4.094 4.359 . 0 0 "[ . 1 . 2]" 1
1517 2 11 ARG H 2 13 ALA H . . 4.500 4.463 4.329 4.520 0.020 2 0 "[ . 1 . 2]" 1
1518 2 11 ARG HA 2 11 ARG QD . . 5.010 3.536 2.093 4.424 . 0 0 "[ . 1 . 2]" 1
1519 2 11 ARG HA 2 11 ARG QG . . 3.590 2.603 2.129 3.342 . 0 0 "[ . 1 . 2]" 1
1520 2 11 ARG QD 2 12 VAL QG . . 4.610 4.286 3.296 4.712 0.102 10 0 "[ . 1 . 2]" 1
1521 2 11 ARG QG 2 12 VAL QG . . 4.510 3.896 1.976 4.644 0.134 6 0 "[ . 1 . 2]" 1
1522 2 12 VAL H 2 12 VAL HB . . 3.080 2.527 2.446 2.616 . 0 0 "[ . 1 . 2]" 1
1523 2 12 VAL H 2 12 VAL MG1 . . 3.950 3.763 3.751 3.768 . 0 0 "[ . 1 . 2]" 1
1524 2 12 VAL H 2 12 VAL QG . . 3.160 2.096 1.903 2.234 . 0 0 "[ . 1 . 2]" 1
1525 2 12 VAL H 2 12 VAL MG2 . . 3.950 2.107 1.908 2.251 . 0 0 "[ . 1 . 2]" 1
1526 2 12 VAL H 2 13 ALA H . . 3.340 2.746 2.700 2.774 . 0 0 "[ . 1 . 2]" 1
1527 2 12 VAL H 2 15 ALA H . . 4.930 4.659 4.587 4.741 . 0 0 "[ . 1 . 2]" 1
1528 2 12 VAL HA 2 12 VAL MG1 . . 3.330 2.332 2.252 2.402 . 0 0 "[ . 1 . 2]" 1
1529 2 12 VAL HA 2 12 VAL MG2 . . 3.330 2.423 2.383 2.469 . 0 0 "[ . 1 . 2]" 1
1530 2 12 VAL HA 2 15 ALA H . . 4.110 3.735 3.615 3.888 . 0 0 "[ . 1 . 2]" 1
1531 2 12 VAL HA 2 15 ALA MB . . 3.230 2.436 2.302 2.629 . 0 0 "[ . 1 . 2]" 1
1532 2 12 VAL HB 2 13 ALA H . . 3.920 2.316 2.240 2.422 . 0 0 "[ . 1 . 2]" 1
1533 2 12 VAL QG 2 13 ALA HA . . 3.680 3.314 3.144 3.602 . 0 0 "[ . 1 . 2]" 1
1534 2 12 VAL QG 2 13 ALA MB . . 4.260 3.843 3.736 3.970 . 0 0 "[ . 1 . 2]" 1
1535 2 12 VAL QG 2 15 ALA MB . . 3.830 3.400 3.278 3.535 . 0 0 "[ . 1 . 2]" 1
1536 2 12 VAL QG 2 16 PHE QB . . 4.110 3.530 3.396 3.670 . 0 0 "[ . 1 . 2]" 1
1537 2 12 VAL QG 2 16 PHE QE . . 4.150 2.046 1.900 2.888 . 0 0 "[ . 1 . 2]" 1
1538 2 12 VAL QG 2 16 PHE HZ . . 4.180 3.913 3.549 4.210 0.030 9 0 "[ . 1 . 2]" 1
1539 2 12 VAL MG1 2 13 ALA H . . 4.280 3.186 3.018 3.410 . 0 0 "[ . 1 . 2]" 1
1540 2 12 VAL MG2 2 13 ALA H . . 4.280 3.725 3.635 3.800 . 0 0 "[ . 1 . 2]" 1
1541 2 13 ALA H 2 13 ALA MB . . 3.310 2.153 2.055 2.228 . 0 0 "[ . 1 . 2]" 1
1542 2 13 ALA H 2 14 GLN H . . 3.920 3.020 2.917 3.074 . 0 0 "[ . 1 . 2]" 1
1543 2 13 ALA HA 2 15 ALA MB . . 5.120 5.049 4.932 5.132 0.012 10 0 "[ . 1 . 2]" 1
1544 2 13 ALA HA 2 16 PHE QB . . 4.440 2.870 2.761 3.084 . 0 0 "[ . 1 . 2]" 1
1545 2 13 ALA HA 2 29 ILE MD . . 3.690 2.839 2.591 3.110 . 0 0 "[ . 1 . 2]" 1
1546 2 13 ALA HA 2 29 ILE MG . . 4.930 4.142 3.806 4.371 . 0 0 "[ . 1 . 2]" 1
1547 2 13 ALA MB 2 14 GLN HA . . 4.830 3.694 3.607 3.753 . 0 0 "[ . 1 . 2]" 1
1548 2 13 ALA MB 2 29 ILE HA . . 4.900 4.469 4.320 4.611 . 0 0 "[ . 1 . 2]" 1
1549 2 13 ALA MB 2 29 ILE HB . . 4.760 3.832 3.482 4.005 . 0 0 "[ . 1 . 2]" 1
1550 2 13 ALA MB 2 29 ILE MD . . 2.900 2.188 1.934 2.490 . 0 0 "[ . 1 . 2]" 1
1551 2 13 ALA MB 2 29 ILE HG13 . . 3.460 2.407 2.161 2.603 . 0 0 "[ . 1 . 2]" 1
1552 2 13 ALA MB 2 29 ILE MG . . 2.990 1.991 1.826 2.134 . 0 0 "[ . 1 . 2]" 1
1553 2 13 ALA MB 2 31 GLN HA . . 5.500 5.494 5.376 5.571 0.071 3 0 "[ . 1 . 2]" 1
1554 2 13 ALA MB 2 31 GLN HG2 . . 5.500 5.425 5.146 5.516 0.016 2 0 "[ . 1 . 2]" 1
1555 2 13 ALA MB 2 31 GLN QG . . 4.810 4.290 4.166 4.579 . 0 0 "[ . 1 . 2]" 1
1556 2 13 ALA MB 2 31 GLN HG3 . . 5.500 4.501 4.355 4.891 . 0 0 "[ . 1 . 2]" 1
1557 2 14 GLN HA 2 14 GLN HG3 . . 3.280 3.178 2.714 3.282 0.002 12 0 "[ . 1 . 2]" 1
1558 2 14 GLN HA 2 17 VAL MG1 . . 3.990 3.714 3.524 4.120 0.130 14 0 "[ . 1 . 2]" 1
1559 2 14 GLN HA 2 17 VAL QG . . 3.320 2.158 1.911 3.340 0.020 14 0 "[ . 1 . 2]" 1
1560 2 14 GLN HA 2 17 VAL MG2 . . 3.990 2.215 1.919 3.982 . 0 0 "[ . 1 . 2]" 1
1561 2 14 GLN HA 2 18 ASP H . . 4.420 4.144 4.045 4.261 . 0 0 "[ . 1 . 2]" 1
1562 2 14 GLN HA 2 29 ILE HB . . 5.500 5.077 4.697 5.209 . 0 0 "[ . 1 . 2]" 1
1563 2 14 GLN HA 2 29 ILE HG13 . . 3.400 3.391 3.044 3.445 0.045 20 0 "[ . 1 . 2]" 1
1564 2 14 GLN HB2 2 14 GLN QE . . 4.570 3.854 2.905 4.124 . 0 0 "[ . 1 . 2]" 1
1565 2 14 GLN HB2 2 29 ILE HG13 . . 4.810 4.832 4.505 4.893 0.083 3 0 "[ . 1 . 2]" 1
1566 2 14 GLN QE 2 14 GLN HG3 . . 3.290 2.242 2.100 3.256 . 0 0 "[ . 1 . 2]" 1
1567 2 14 GLN QE 2 17 VAL QG . . 3.650 2.824 1.973 3.553 . 0 0 "[ . 1 . 2]" 1
1568 2 14 GLN HG3 2 15 ALA H . . 3.950 3.409 3.160 3.766 . 0 0 "[ . 1 . 2]" 1
1569 2 14 GLN HG3 2 15 ALA HA . . 3.790 3.436 3.254 3.806 0.016 9 0 "[ . 1 . 2]" 1
1570 2 15 ALA HA 2 17 VAL H . . 5.470 4.953 4.643 5.065 . 0 0 "[ . 1 . 2]" 1
1571 2 15 ALA HA 2 17 VAL QG . . 5.230 4.559 4.344 5.493 0.263 11 0 "[ . 1 . 2]" 1
1572 2 15 ALA HA 2 18 ASP QB . . 3.160 2.442 2.351 2.621 . 0 0 "[ . 1 . 2]" 1
1573 2 15 ALA MB 2 16 PHE H . . 3.220 2.468 2.275 2.575 . 0 0 "[ . 1 . 2]" 1
1574 2 15 ALA MB 2 16 PHE HA . . 4.470 3.786 3.728 3.818 . 0 0 "[ . 1 . 2]" 1
1575 2 15 ALA MB 2 16 PHE QD . . 4.490 3.626 2.904 4.113 . 0 0 "[ . 1 . 2]" 1
1576 2 15 ALA MB 2 18 ASP HB2 . . 4.730 4.470 4.303 4.660 . 0 0 "[ . 1 . 2]" 1
1577 2 15 ALA MB 2 18 ASP QB . . 3.900 3.729 3.687 3.853 . 0 0 "[ . 1 . 2]" 1
1578 2 15 ALA MB 2 18 ASP HB3 . . 4.730 3.996 3.898 4.180 . 0 0 "[ . 1 . 2]" 1
1579 2 15 ALA MB 2 19 TYR QD . . 4.780 4.299 3.962 4.592 . 0 0 "[ . 1 . 2]" 1
1580 2 16 PHE H 2 16 PHE HB2 . . 3.590 2.147 2.090 2.216 . 0 0 "[ . 1 . 2]" 1
1581 2 16 PHE H 2 16 PHE QB . . 3.010 2.127 2.071 2.194 . 0 0 "[ . 1 . 2]" 1
1582 2 16 PHE H 2 16 PHE HB3 . . 3.590 3.459 3.383 3.514 . 0 0 "[ . 1 . 2]" 1
1583 2 16 PHE H 2 16 PHE QD . . 5.500 2.833 2.439 3.214 . 0 0 "[ . 1 . 2]" 1
1584 2 16 PHE H 2 16 PHE QE . . 5.500 4.963 4.666 5.210 . 0 0 "[ . 1 . 2]" 1
1585 2 16 PHE H 2 19 TYR QD . . 5.500 4.437 4.291 4.630 . 0 0 "[ . 1 . 2]" 1
1586 2 16 PHE HA 2 16 PHE QD . . 4.140 2.823 2.282 3.017 . 0 0 "[ . 1 . 2]" 1
1587 2 16 PHE HA 2 16 PHE QE . . 5.500 4.403 4.229 4.487 . 0 0 "[ . 1 . 2]" 1
1588 2 16 PHE HA 2 17 VAL QG . . 5.440 4.528 4.433 5.051 . 0 0 "[ . 1 . 2]" 1
1589 2 16 PHE HA 2 19 TYR HB3 . . 4.320 4.061 3.652 4.311 . 0 0 "[ . 1 . 2]" 1
1590 2 16 PHE HA 2 19 TYR QD . . 4.390 2.003 1.957 2.082 . 0 0 "[ . 1 . 2]" 1
1591 2 16 PHE QB 2 17 VAL H . . 3.630 2.386 2.326 2.526 . 0 0 "[ . 1 . 2]" 1
1592 2 16 PHE QB 2 17 VAL QG . . 5.280 3.054 2.967 3.560 . 0 0 "[ . 1 . 2]" 1
1593 2 16 PHE QB 2 29 ILE MD . . 4.170 3.652 3.429 3.841 . 0 0 "[ . 1 . 2]" 1
1594 2 16 PHE HB2 2 17 VAL H . . 4.180 2.619 2.495 2.764 . 0 0 "[ . 1 . 2]" 1
1595 2 16 PHE HB2 2 19 TYR QD . . 5.070 4.898 4.849 4.981 . 0 0 "[ . 1 . 2]" 1
1596 2 16 PHE HB3 2 17 VAL H . . 4.180 2.758 2.550 3.058 . 0 0 "[ . 1 . 2]" 1
1597 2 16 PHE HB3 2 19 TYR QD . . 5.070 4.396 4.244 4.597 . 0 0 "[ . 1 . 2]" 1
1598 2 16 PHE QD 2 17 VAL HA . . 5.500 5.313 4.999 5.620 0.120 5 0 "[ . 1 . 2]" 1
1599 2 16 PHE QD 2 27 LEU QD . . 5.200 4.587 3.933 5.274 0.074 18 0 "[ . 1 . 2]" 1
1600 2 17 VAL HA 2 17 VAL MG1 . . 3.350 2.278 2.172 2.739 . 0 0 "[ . 1 . 2]" 1
1601 2 17 VAL HA 2 17 VAL MG2 . . 3.350 3.050 2.156 3.203 . 0 0 "[ . 1 . 2]" 1
1602 2 17 VAL HA 2 18 ASP HA . . 5.500 4.773 4.757 4.790 . 0 0 "[ . 1 . 2]" 1
1603 2 17 VAL HA 2 19 TYR QD . . 5.440 5.280 5.091 5.434 . 0 0 "[ . 1 . 2]" 1
1604 2 17 VAL HA 2 20 MET H . . 4.010 3.540 3.487 3.620 . 0 0 "[ . 1 . 2]" 1
1605 2 17 VAL HA 2 27 LEU HB2 . . 5.500 2.418 2.268 2.567 . 0 0 "[ . 1 . 2]" 1
1606 2 17 VAL HA 2 27 LEU HB3 . . 4.230 3.458 3.128 3.601 . 0 0 "[ . 1 . 2]" 1
1607 2 17 VAL HA 2 27 LEU MD1 . . 4.570 3.273 2.002 4.568 . 0 0 "[ . 1 . 2]" 1
1608 2 17 VAL HA 2 27 LEU QD . . 3.740 2.892 2.000 3.896 0.156 15 0 "[ . 1 . 2]" 1
1609 2 17 VAL HA 2 27 LEU MD2 . . 4.570 4.273 3.593 4.597 0.027 14 0 "[ . 1 . 2]" 1
1610 2 17 VAL HA 2 27 LEU HG . . 3.780 3.535 3.152 3.816 0.036 1 0 "[ . 1 . 2]" 1
1611 2 17 VAL HA 2 29 ILE MD . . 4.880 4.716 4.634 4.788 . 0 0 "[ . 1 . 2]" 1
1612 2 17 VAL HB 2 27 LEU HB2 . . 5.500 2.913 2.406 4.698 . 0 0 "[ . 1 . 2]" 1
1613 2 17 VAL HB 2 27 LEU HB3 . . 5.500 3.692 3.147 4.997 . 0 0 "[ . 1 . 2]" 1
1614 2 17 VAL HB 2 27 LEU QD . . 5.440 4.176 3.596 5.450 0.010 15 0 "[ . 1 . 2]" 1
1615 2 17 VAL HB 2 28 THR HA . . 5.380 4.887 4.677 5.520 0.140 14 0 "[ . 1 . 2]" 1
1616 2 17 VAL QG 2 18 ASP H . . 3.640 2.523 2.335 3.434 . 0 0 "[ . 1 . 2]" 1
1617 2 17 VAL QG 2 18 ASP HA . . 3.700 3.237 2.958 3.566 . 0 0 "[ . 1 . 2]" 1
1618 2 17 VAL QG 2 21 ALA MB . . 4.360 3.785 2.766 4.111 . 0 0 "[ . 1 . 2]" 1
1619 2 17 VAL QG 2 27 LEU HB2 . . 3.680 2.344 1.890 2.751 . 0 0 "[ . 1 . 2]" 1
1620 2 17 VAL QG 2 27 LEU HB3 . . 3.290 2.077 1.909 2.278 . 0 0 "[ . 1 . 2]" 1
1621 2 17 VAL QG 2 27 LEU QD . . 3.180 2.724 2.261 3.217 0.037 7 0 "[ . 1 . 2]" 1
1622 2 17 VAL QG 2 28 THR HA . . 4.940 3.348 2.813 3.632 . 0 0 "[ . 1 . 2]" 1
1623 2 17 VAL QG 2 29 ILE HA . . 4.000 3.945 3.897 4.076 0.076 15 0 "[ . 1 . 2]" 1
1624 2 17 VAL QG 2 29 ILE HB . . 5.370 3.589 3.506 3.776 . 0 0 "[ . 1 . 2]" 1
1625 2 17 VAL QG 2 29 ILE MD . . 2.850 1.952 1.862 2.668 . 0 0 "[ . 1 . 2]" 1
1626 2 17 VAL MG1 2 27 LEU HB2 . . 5.040 2.448 2.120 3.531 . 0 0 "[ . 1 . 2]" 1
1627 2 17 VAL MG1 2 27 LEU HB3 . . 4.540 2.297 1.911 4.062 . 0 0 "[ . 1 . 2]" 1
1628 2 17 VAL MG2 2 27 LEU HB2 . . 5.040 3.887 2.004 4.354 . 0 0 "[ . 1 . 2]" 1
1629 2 17 VAL MG2 2 27 LEU HB3 . . 4.540 4.161 1.957 4.601 0.061 2 0 "[ . 1 . 2]" 1
1630 2 18 ASP H 2 18 ASP HB2 . . 3.530 2.461 2.346 2.615 . 0 0 "[ . 1 . 2]" 1
1631 2 18 ASP H 2 18 ASP QB . . 3.090 2.253 2.222 2.268 . 0 0 "[ . 1 . 2]" 1
1632 2 18 ASP H 2 18 ASP HB3 . . 3.530 2.628 2.468 2.755 . 0 0 "[ . 1 . 2]" 1
1633 2 18 ASP H 2 19 TYR H . . 3.230 2.778 2.745 2.810 . 0 0 "[ . 1 . 2]" 1
1634 2 18 ASP HA 2 21 ALA MB . . 3.030 2.866 2.646 3.032 0.002 13 0 "[ . 1 . 2]" 1
1635 2 19 TYR H 2 19 TYR HB2 . . 3.680 3.470 3.356 3.531 . 0 0 "[ . 1 . 2]" 1
1636 2 19 TYR H 2 19 TYR HB3 . . 3.450 2.168 2.079 2.250 . 0 0 "[ . 1 . 2]" 1
1637 2 19 TYR H 2 19 TYR QD . . 4.350 2.904 2.780 3.276 . 0 0 "[ . 1 . 2]" 1
1638 2 19 TYR H 2 19 TYR QE . . 5.500 4.964 4.746 5.356 . 0 0 "[ . 1 . 2]" 1
1639 2 19 TYR H 2 20 MET H . . 3.590 2.619 2.596 2.652 . 0 0 "[ . 1 . 2]" 1
1640 2 19 TYR HA 2 19 TYR QE . . 5.500 5.501 5.362 5.569 0.069 5 0 "[ . 1 . 2]" 1
1641 2 19 TYR HA 2 22 THR MG . . 3.470 1.950 1.887 2.033 . 0 0 "[ . 1 . 2]" 1
1642 2 19 TYR HB3 2 22 THR MG . . 4.320 4.189 4.095 4.309 . 0 0 "[ . 1 . 2]" 1
1643 2 19 TYR QD 2 20 MET H . . 4.640 3.288 3.177 3.395 . 0 0 "[ . 1 . 2]" 1
1644 2 19 TYR QD 2 20 MET HA . . 4.510 3.464 3.014 3.747 . 0 0 "[ . 1 . 2]" 1
1645 2 19 TYR QD 2 20 MET HG2 . . 5.500 4.046 3.114 5.810 0.310 11 0 "[ . 1 . 2]" 1
1646 2 19 TYR QD 2 20 MET QG . . 4.730 3.618 3.025 4.733 0.003 11 0 "[ . 1 . 2]" 1
1647 2 19 TYR QD 2 20 MET HG3 . . 5.500 4.369 4.000 5.014 . 0 0 "[ . 1 . 2]" 1
1648 2 19 TYR QD 2 22 THR MG . . 3.960 3.831 3.487 3.983 0.023 5 0 "[ . 1 . 2]" 1
1649 2 19 TYR QD 2 23 GLN HG2 . . 3.750 3.186 2.783 3.417 . 0 0 "[ . 1 . 2]" 1
1650 2 19 TYR QE 2 20 MET HA . . 4.910 3.681 3.384 3.907 . 0 0 "[ . 1 . 2]" 1
1651 2 19 TYR QE 2 20 MET ME . . 3.490 2.346 1.960 2.751 . 0 0 "[ . 1 . 2]" 1
1652 2 19 TYR QE 2 20 MET HG2 . . 5.500 3.455 2.732 4.946 . 0 0 "[ . 1 . 2]" 1
1653 2 19 TYR QE 2 20 MET QG . . 4.830 3.083 2.657 4.059 . 0 0 "[ . 1 . 2]" 1
1654 2 19 TYR QE 2 20 MET HG3 . . 5.500 3.669 3.275 4.313 . 0 0 "[ . 1 . 2]" 1
1655 2 19 TYR QE 2 25 VAL MG2 . . 5.500 5.537 5.501 5.584 0.084 15 0 "[ . 1 . 2]" 1
1656 2 20 MET H 2 20 MET ME . . 5.500 4.258 3.920 4.786 . 0 0 "[ . 1 . 2]" 1
1657 2 20 MET H 2 20 MET HG2 . . 5.500 3.365 2.634 4.676 . 0 0 "[ . 1 . 2]" 1
1658 2 20 MET H 2 20 MET HG3 . . 5.500 3.717 3.180 4.409 . 0 0 "[ . 1 . 2]" 1
1659 2 20 MET H 2 21 ALA H . . 3.330 2.488 2.430 2.569 . 0 0 "[ . 1 . 2]" 1
1660 2 20 MET H 2 22 THR H . . 5.280 4.034 3.979 4.148 . 0 0 "[ . 1 . 2]" 1
1661 2 20 MET H 2 27 LEU HB2 . . 5.500 5.355 5.011 5.528 0.028 19 0 "[ . 1 . 2]" 1
1662 2 20 MET HA 2 20 MET ME . . 3.020 2.223 1.909 2.856 . 0 0 "[ . 1 . 2]" 1
1663 2 20 MET HA 2 20 MET QG . . 3.590 2.388 2.254 2.519 . 0 0 "[ . 1 . 2]" 1
1664 2 20 MET HA 2 23 GLN H . . 5.330 3.520 3.403 3.611 . 0 0 "[ . 1 . 2]" 1
1665 2 20 MET HA 2 23 GLN HA . . 5.500 5.378 5.224 5.511 0.011 3 0 "[ . 1 . 2]" 1
1666 2 20 MET HA 2 23 GLN HB2 . . 4.400 2.510 2.372 2.655 . 0 0 "[ . 1 . 2]" 1
1667 2 20 MET HA 2 23 GLN QB . . 3.850 2.487 2.353 2.628 . 0 0 "[ . 1 . 2]" 1
1668 2 20 MET HA 2 23 GLN HB3 . . 4.400 4.039 3.914 4.198 . 0 0 "[ . 1 . 2]" 1
1669 2 20 MET HA 2 25 VAL HB . . 3.610 3.546 3.202 3.675 0.065 11 0 "[ . 1 . 2]" 1
1670 2 20 MET HA 2 25 VAL MG1 . . 4.880 4.770 4.292 4.902 0.022 14 0 "[ . 1 . 2]" 1
1671 2 20 MET HA 2 25 VAL MG2 . . 5.110 4.032 3.868 4.263 . 0 0 "[ . 1 . 2]" 1
1672 2 20 MET QB 2 25 VAL MG1 . . 5.320 3.376 2.648 4.001 . 0 0 "[ . 1 . 2]" 1
1673 2 20 MET ME 2 20 MET QG . . 3.380 2.189 2.087 2.332 . 0 0 "[ . 1 . 2]" 1
1674 2 20 MET ME 2 25 VAL H . . 5.020 4.471 4.157 4.845 . 0 0 "[ . 1 . 2]" 1
1675 2 20 MET ME 2 25 VAL HB . . 3.180 2.777 2.329 3.204 0.024 8 0 "[ . 1 . 2]" 1
1676 2 20 MET ME 2 25 VAL MG1 . . 3.390 3.320 2.863 3.434 0.044 8 0 "[ . 1 . 2]" 1
1677 2 20 MET ME 2 25 VAL MG2 . . 3.000 2.574 1.948 2.916 . 0 0 "[ . 1 . 2]" 1
1678 2 20 MET ME 2 27 LEU QD . . 4.380 3.707 3.210 4.061 . 0 0 "[ . 1 . 2]" 1
1679 2 21 ALA H 2 22 THR H . . 3.410 2.637 2.592 2.708 . 0 0 "[ . 1 . 2]" 1
1680 2 21 ALA H 2 23 GLN H . . 4.470 3.828 3.807 3.867 . 0 0 "[ . 1 . 2]" 1
1681 2 21 ALA HA 2 26 ILE HB . . 5.500 5.524 5.440 5.561 0.061 1 0 "[ . 1 . 2]" 1
1682 2 21 ALA HA 2 26 ILE MD . . 3.040 2.661 2.422 2.847 . 0 0 "[ . 1 . 2]" 1
1683 2 21 ALA HA 2 26 ILE MG . . 4.690 4.547 4.419 4.690 . 0 0 "[ . 1 . 2]" 1
1684 2 21 ALA MB 2 22 THR H . . 3.550 2.582 2.500 2.643 . 0 0 "[ . 1 . 2]" 1
1685 2 21 ALA MB 2 22 THR HA . . 5.500 3.834 3.787 3.865 . 0 0 "[ . 1 . 2]" 1
1686 2 21 ALA MB 2 26 ILE MD . . 3.290 2.568 2.267 2.765 . 0 0 "[ . 1 . 2]" 1
1687 2 22 THR H 2 22 THR HB . . 3.170 2.598 2.528 2.685 . 0 0 "[ . 1 . 2]" 1
1688 2 22 THR H 2 22 THR MG . . 3.190 2.023 1.929 2.117 . 0 0 "[ . 1 . 2]" 1
1689 2 22 THR H 2 23 GLN H . . 3.410 2.543 2.477 2.636 . 0 0 "[ . 1 . 2]" 1
1690 2 22 THR HA 2 22 THR MG . . 3.340 3.206 3.204 3.208 . 0 0 "[ . 1 . 2]" 1
1691 2 22 THR HA 2 23 GLN HG2 . . 5.500 5.482 5.423 5.512 0.012 11 0 "[ . 1 . 2]" 1
1692 2 22 THR MG 2 23 GLN HG2 . . 3.820 2.487 2.422 2.534 . 0 0 "[ . 1 . 2]" 1
1693 2 23 GLN H 2 23 GLN HB2 . . 3.920 2.268 2.258 2.288 . 0 0 "[ . 1 . 2]" 1
1694 2 23 GLN H 2 23 GLN QB . . 3.100 2.243 2.233 2.263 . 0 0 "[ . 1 . 2]" 1
1695 2 23 GLN H 2 23 GLN HB3 . . 3.920 3.540 3.529 3.557 . 0 0 "[ . 1 . 2]" 1
1696 2 23 GLN H 2 23 GLN HE21 . . 4.530 4.246 4.062 4.509 . 0 0 "[ . 1 . 2]" 1
1697 2 23 GLN H 2 23 GLN HG2 . . 3.580 3.096 3.011 3.259 . 0 0 "[ . 1 . 2]" 1
1698 2 23 GLN H 2 24 GLY H . . 3.280 2.346 2.260 2.416 . 0 0 "[ . 1 . 2]" 1
1699 2 23 GLN HA 2 23 GLN HE21 . . 4.000 2.205 1.970 3.008 . 0 0 "[ . 1 . 2]" 1
1700 2 23 GLN HA 2 23 GLN HE22 . . 4.080 3.239 3.123 3.448 . 0 0 "[ . 1 . 2]" 1
1701 2 23 GLN HA 2 23 GLN HG2 . . 3.240 2.684 2.517 2.811 . 0 0 "[ . 1 . 2]" 1
1702 2 23 GLN QB 2 24 GLY H . . 3.870 3.352 3.320 3.389 . 0 0 "[ . 1 . 2]" 1
1703 2 23 GLN HE22 2 23 GLN HG2 . . 3.670 3.483 3.437 3.509 . 0 0 "[ . 1 . 2]" 1
1704 2 24 GLY H 2 25 VAL MG2 . . 4.720 4.126 3.980 4.296 . 0 0 "[ . 1 . 2]" 1
1705 2 24 GLY QA 2 25 VAL HB . . 5.340 5.071 4.933 5.137 . 0 0 "[ . 1 . 2]" 1
1706 2 24 GLY QA 2 25 VAL MG2 . . 4.300 3.387 3.299 3.532 . 0 0 "[ . 1 . 2]" 1
1707 2 25 VAL HA 2 25 VAL MG1 . . 3.050 2.187 2.133 2.349 . 0 0 "[ . 1 . 2]" 1
1708 2 25 VAL HA 2 25 VAL MG2 . . 3.080 2.448 2.409 2.516 . 0 0 "[ . 1 . 2]" 1
1709 2 25 VAL HA 2 26 ILE HB . . 5.210 4.627 4.617 4.639 . 0 0 "[ . 1 . 2]" 1
1710 2 25 VAL HA 2 26 ILE MD . . 4.540 4.492 4.432 4.528 . 0 0 "[ . 1 . 2]" 1
1711 2 25 VAL HA 2 26 ILE HG12 . . 4.800 3.917 3.882 3.951 . 0 0 "[ . 1 . 2]" 1
1712 2 25 VAL HA 2 26 ILE MG . . 5.470 5.480 5.478 5.482 0.012 20 0 "[ . 1 . 2]" 1
1713 2 25 VAL HA 2 27 LEU QD . . 5.280 4.566 3.969 5.194 . 0 0 "[ . 1 . 2]" 1
1714 2 25 VAL MG1 2 26 ILE HB . . 4.580 4.552 4.459 4.618 0.038 14 0 "[ . 1 . 2]" 1
1715 2 25 VAL MG1 2 26 ILE HG12 . . 4.920 4.889 4.849 4.920 0.000 14 0 "[ . 1 . 2]" 1
1716 2 25 VAL MG1 2 27 LEU QD . . 2.910 2.288 1.786 2.836 . 0 0 "[ . 1 . 2]" 1
1717 2 26 ILE H 2 26 ILE MD . . 5.500 3.351 3.326 3.390 . 0 0 "[ . 1 . 2]" 1
1718 2 26 ILE HA 2 26 ILE MD . . 2.840 2.049 1.984 2.084 . 0 0 "[ . 1 . 2]" 1
1719 2 26 ILE HA 2 26 ILE HG12 . . 3.650 3.073 3.053 3.100 . 0 0 "[ . 1 . 2]" 1
1720 2 26 ILE HA 2 26 ILE HG13 . . 3.810 3.710 3.699 3.719 . 0 0 "[ . 1 . 2]" 1
1721 2 26 ILE HA 2 26 ILE MG . . 3.000 2.331 2.302 2.395 . 0 0 "[ . 1 . 2]" 1
1722 2 26 ILE HA 2 27 LEU H . . 3.060 2.166 2.145 2.172 . 0 0 "[ . 1 . 2]" 1
1723 2 26 ILE HA 2 27 LEU HA . . 5.110 4.403 4.393 4.407 . 0 0 "[ . 1 . 2]" 1
1724 2 26 ILE HA 2 27 LEU QD . . 4.690 3.901 3.148 4.510 . 0 0 "[ . 1 . 2]" 1
1725 2 26 ILE HB 2 26 ILE MD . . 3.360 3.224 3.216 3.231 . 0 0 "[ . 1 . 2]" 1
1726 2 26 ILE HG12 2 26 ILE MG . . 3.220 3.193 3.185 3.202 . 0 0 "[ . 1 . 2]" 1
1727 2 26 ILE HG13 2 26 ILE MG . . 3.040 2.281 2.244 2.358 . 0 0 "[ . 1 . 2]" 1
1728 2 26 ILE MG 2 27 LEU HA . . 4.200 3.603 3.477 3.699 . 0 0 "[ . 1 . 2]" 1
1729 2 26 ILE MG 2 28 THR HA . . 5.210 4.655 4.601 4.699 . 0 0 "[ . 1 . 2]" 1
1730 2 27 LEU H 2 27 LEU MD1 . . 5.500 4.328 4.226 4.502 . 0 0 "[ . 1 . 2]" 1
1731 2 27 LEU H 2 27 LEU MD2 . . 5.500 3.419 2.726 4.016 . 0 0 "[ . 1 . 2]" 1
1732 2 27 LEU HA 2 27 LEU MD1 . . 4.160 3.070 1.957 3.822 . 0 0 "[ . 1 . 2]" 1
1733 2 27 LEU HA 2 27 LEU QD . . 3.140 1.954 1.896 2.077 . 0 0 "[ . 1 . 2]" 1
1734 2 27 LEU HA 2 27 LEU MD2 . . 4.160 2.111 1.936 2.574 . 0 0 "[ . 1 . 2]" 1
1735 2 27 LEU HA 2 28 THR H . . 3.070 2.383 2.346 2.404 . 0 0 "[ . 1 . 2]" 1
1736 2 27 LEU HA 2 28 THR HB . . 5.300 5.236 5.083 5.268 . 0 0 "[ . 1 . 2]" 1
1737 2 27 LEU HA 2 28 THR MG . . 5.500 4.993 4.959 5.163 . 0 0 "[ . 1 . 2]" 1
1738 2 27 LEU HB2 2 27 LEU MD1 . . 3.310 2.755 2.287 3.185 . 0 0 "[ . 1 . 2]" 1
1739 2 27 LEU HB2 2 27 LEU QD . . 2.870 2.329 2.238 2.456 . 0 0 "[ . 1 . 2]" 1
1740 2 27 LEU HB2 2 27 LEU MD2 . . 3.310 2.815 2.301 3.195 . 0 0 "[ . 1 . 2]" 1
1741 2 27 LEU HB2 2 28 THR H . . 4.130 3.847 3.666 3.990 . 0 0 "[ . 1 . 2]" 1
1742 2 27 LEU HB3 2 27 LEU QD . . 2.920 2.115 1.993 2.309 . 0 0 "[ . 1 . 2]" 1
1743 2 27 LEU HB3 2 28 THR H . . 3.580 2.503 2.401 2.654 . 0 0 "[ . 1 . 2]" 1
1744 2 27 LEU HB3 2 28 THR HB . . 5.500 5.530 5.502 5.566 0.066 15 0 "[ . 1 . 2]" 1
1745 2 27 LEU QD 2 28 THR H . . 3.800 2.692 2.390 3.029 . 0 0 "[ . 1 . 2]" 1
1746 2 27 LEU QD 2 28 THR HA . . 5.440 4.828 4.574 5.038 . 0 0 "[ . 1 . 2]" 1
1747 2 28 THR H 2 28 THR HB . . 4.200 3.209 3.086 3.234 . 0 0 "[ . 1 . 2]" 1
1748 2 28 THR H 2 28 THR MG . . 4.050 3.866 3.853 3.921 . 0 0 "[ . 1 . 2]" 1
1749 2 28 THR HA 2 28 THR HB . . 3.020 2.916 2.906 2.960 . 0 0 "[ . 1 . 2]" 1
1750 2 28 THR HA 2 28 THR MG . . 2.810 2.049 2.005 2.111 . 0 0 "[ . 1 . 2]" 1
1751 2 28 THR HA 2 29 ILE H . . 3.330 2.250 2.196 2.280 . 0 0 "[ . 1 . 2]" 1
1752 2 28 THR HA 2 29 ILE HA . . 5.040 4.414 4.395 4.420 . 0 0 "[ . 1 . 2]" 1
1753 2 28 THR HA 2 29 ILE HB . . 4.690 4.519 4.475 4.548 . 0 0 "[ . 1 . 2]" 1
1754 2 28 THR HA 2 29 ILE MD . . 5.500 4.512 4.255 4.687 . 0 0 "[ . 1 . 2]" 1
1755 2 28 THR HA 2 29 ILE HG12 . . 5.090 3.640 3.575 3.757 . 0 0 "[ . 1 . 2]" 1
1756 2 28 THR HA 2 29 ILE HG13 . . 5.490 5.303 5.253 5.420 . 0 0 "[ . 1 . 2]" 1
1757 2 28 THR HB 2 29 ILE H . . 3.620 3.337 3.254 3.529 . 0 0 "[ . 1 . 2]" 1
1758 2 28 THR HB 2 29 ILE MD . . 5.430 5.031 4.904 5.225 . 0 0 "[ . 1 . 2]" 1
1759 2 28 THR HB 2 29 ILE HG12 . . 5.500 5.306 5.256 5.482 . 0 0 "[ . 1 . 2]" 1
1760 2 28 THR HB 2 30 GLN HG2 . . 5.340 5.317 5.237 5.354 0.014 11 0 "[ . 1 . 2]" 1
1761 2 28 THR MG 2 29 ILE HB . . 4.780 4.781 4.560 4.821 0.041 19 0 "[ . 1 . 2]" 1
1762 2 28 THR MG 2 30 GLN HG2 . . 4.630 4.588 4.354 4.654 0.024 15 0 "[ . 1 . 2]" 1
1763 2 29 ILE H 2 29 ILE HB . . 3.140 2.647 2.573 2.674 . 0 0 "[ . 1 . 2]" 1
1764 2 29 ILE H 2 29 ILE MD . . 4.110 3.853 3.754 3.949 . 0 0 "[ . 1 . 2]" 1
1765 2 29 ILE H 2 29 ILE HG13 . . 5.200 4.230 4.136 4.292 . 0 0 "[ . 1 . 2]" 1
1766 2 29 ILE HA 2 29 ILE MD . . 3.550 1.987 1.953 2.065 . 0 0 "[ . 1 . 2]" 1
1767 2 29 ILE HA 2 29 ILE MG . . 3.250 2.402 2.345 2.434 . 0 0 "[ . 1 . 2]" 1
1768 2 29 ILE HA 2 30 GLN H . . 3.020 2.231 2.224 2.243 . 0 0 "[ . 1 . 2]" 1
1769 2 29 ILE HA 2 30 GLN HA . . 4.430 4.408 4.403 4.413 . 0 0 "[ . 1 . 2]" 1
1770 2 29 ILE HA 2 30 GLN HG2 . . 5.160 5.094 5.048 5.145 . 0 0 "[ . 1 . 2]" 1
1771 2 29 ILE HB 2 30 GLN H . . 4.410 3.970 3.920 4.002 . 0 0 "[ . 1 . 2]" 1
1772 2 29 ILE MD 2 30 GLN HA . . 5.500 5.566 5.534 5.601 0.101 6 0 "[ . 1 . 2]" 1
1773 2 29 ILE MG 2 30 GLN HA . . 4.430 3.468 3.435 3.573 . 0 0 "[ . 1 . 2]" 1
1774 2 29 ILE MG 2 30 GLN HG2 . . 5.020 4.981 4.956 5.010 . 0 0 "[ . 1 . 2]" 1
1775 2 29 ILE MG 2 31 GLN HA . . 4.020 3.769 3.717 3.855 . 0 0 "[ . 1 . 2]" 1
1776 2 29 ILE MG 2 31 GLN QB . . 3.880 3.640 3.258 3.905 0.025 7 0 "[ . 1 . 2]" 1
1777 2 29 ILE MG 2 31 GLN QG . . 3.540 3.326 3.097 3.557 0.017 2 0 "[ . 1 . 2]" 1
1778 2 30 GLN H 2 30 GLN HB2 . . 3.700 2.462 2.433 2.484 . 0 0 "[ . 1 . 2]" 1
1779 2 30 GLN H 2 30 GLN HB3 . . 3.780 3.511 3.459 3.527 . 0 0 "[ . 1 . 2]" 1
1780 2 30 GLN H 2 30 GLN HG2 . . 5.500 4.009 3.972 4.037 . 0 0 "[ . 1 . 2]" 1
1781 2 30 GLN HA 2 30 GLN QE . . 4.040 3.453 2.849 4.146 0.106 14 0 "[ . 1 . 2]" 1
1782 2 30 GLN HA 2 30 GLN HG2 . . 2.810 2.087 2.073 2.128 . 0 0 "[ . 1 . 2]" 1
1783 2 30 GLN HA 2 31 GLN H . . 2.990 2.170 2.153 2.174 . 0 0 "[ . 1 . 2]" 1
1784 2 30 GLN HB2 2 30 GLN HG2 . . 2.840 2.813 2.739 2.830 . 0 0 "[ . 1 . 2]" 1
1785 2 30 GLN HB2 2 31 GLN HA . . 5.500 5.488 5.443 5.515 0.015 15 0 "[ . 1 . 2]" 1
1786 2 30 GLN HB2 2 32 HIS HD2 . . 4.810 4.378 3.962 4.732 . 0 0 "[ . 1 . 2]" 1
1787 2 30 GLN HB3 2 30 GLN HG2 . . 2.990 2.857 2.840 2.916 . 0 0 "[ . 1 . 2]" 1
1788 2 30 GLN HB3 2 31 GLN HA . . 5.100 4.688 4.613 4.751 . 0 0 "[ . 1 . 2]" 1
1789 2 30 GLN HB3 2 32 HIS HD2 . . 5.000 2.968 2.560 3.254 . 0 0 "[ . 1 . 2]" 1
1790 2 31 GLN H 2 31 GLN HB2 . . 3.580 2.170 2.111 2.280 . 0 0 "[ . 1 . 2]" 1
1791 2 31 GLN H 2 31 GLN QB . . 3.100 2.135 2.086 2.219 . 0 0 "[ . 1 . 2]" 1
1792 2 31 GLN H 2 31 GLN HB3 . . 3.580 3.193 3.036 3.367 . 0 0 "[ . 1 . 2]" 1
1793 2 31 GLN H 2 31 GLN QG . . 4.100 3.615 3.449 3.815 . 0 0 "[ . 1 . 2]" 1
1794 2 31 GLN HA 2 31 GLN HG2 . . 3.410 2.342 2.074 2.935 . 0 0 "[ . 1 . 2]" 1
1795 2 31 GLN HA 2 31 GLN HG3 . . 3.410 2.705 2.155 3.073 . 0 0 "[ . 1 . 2]" 1
1796 2 31 GLN HA 2 32 HIS H . . 3.170 2.172 2.139 2.242 . 0 0 "[ . 1 . 2]" 1
1797 2 31 GLN HA 2 32 HIS HD2 . . 5.500 3.715 3.626 3.895 . 0 0 "[ . 1 . 2]" 1
1798 2 31 GLN QG 2 32 HIS H . . 4.750 3.511 2.915 3.849 . 0 0 "[ . 1 . 2]" 1
1799 2 31 GLN QG 2 32 HIS QB . . 5.180 4.990 4.782 5.208 0.028 10 0 "[ . 1 . 2]" 1
1800 2 31 GLN QG 2 32 HIS HD2 . . 5.340 5.365 5.347 5.397 0.057 2 0 "[ . 1 . 2]" 1
1801 2 32 HIS H 2 32 HIS HD2 . . 5.500 2.428 2.034 3.505 . 0 0 "[ . 1 . 2]" 1
1802 2 32 HIS H 2 32 HIS HE1 . . 5.500 5.539 5.443 5.585 0.085 13 0 "[ . 1 . 2]" 1
1803 2 32 HIS HA 2 32 HIS HD2 . . 5.350 2.697 2.569 2.870 . 0 0 "[ . 1 . 2]" 1
1804 2 32 HIS HA 2 33 ASN HA . . 5.050 4.576 4.447 4.698 . 0 0 "[ . 1 . 2]" 1
1805 2 33 ASN HA 2 34 GLN HA . . 5.310 4.424 4.369 4.695 . 0 0 "[ . 1 . 2]" 1
1806 2 33 ASN HA 2 34 GLN QB . . 4.940 4.313 4.002 4.882 . 0 0 "[ . 1 . 2]" 1
1807 2 33 ASN HA 2 34 GLN QG . . 4.770 4.491 3.588 4.809 0.039 15 0 "[ . 1 . 2]" 1
1808 2 33 ASN QB 2 33 ASN QD . . 3.100 2.148 2.063 2.377 . 0 0 "[ . 1 . 2]" 1
1809 2 34 GLN H 2 34 GLN QB . . 3.260 2.723 2.375 2.896 . 0 0 "[ . 1 . 2]" 1
1810 2 34 GLN HA 2 34 GLN QG . . 3.090 2.339 2.062 3.060 . 0 0 "[ . 1 . 2]" 1
1811 2 35 SER HA 2 36 ASP H . . 3.240 2.193 2.163 2.239 . 0 0 "[ . 1 . 2]" 1
1812 2 36 ASP H 2 36 ASP HB2 . . 3.890 2.620 2.139 3.141 . 0 0 "[ . 1 . 2]" 1
1813 2 36 ASP H 2 36 ASP QB . . 3.350 2.250 2.116 2.369 . 0 0 "[ . 1 . 2]" 1
1814 2 36 ASP H 2 36 ASP HB3 . . 3.890 3.019 2.235 3.612 . 0 0 "[ . 1 . 2]" 1
1815 2 36 ASP H 2 37 VAL H . . 5.430 4.501 4.478 4.532 . 0 0 "[ . 1 . 2]" 1
1816 2 36 ASP HA 2 37 VAL H . . 3.060 2.151 2.141 2.159 . 0 0 "[ . 1 . 2]" 1
1817 2 36 ASP HA 2 37 VAL QG . . 4.660 3.445 3.275 3.501 . 0 0 "[ . 1 . 2]" 1
1818 2 37 VAL HA 2 37 VAL MG1 . . 3.350 2.247 2.121 2.594 . 0 0 "[ . 1 . 2]" 1
1819 2 37 VAL HA 2 37 VAL MG2 . . 3.350 2.490 2.429 3.133 . 0 0 "[ . 1 . 2]" 1
1820 2 37 VAL HA 2 38 TRP H . . 3.000 2.144 2.140 2.163 . 0 0 "[ . 1 . 2]" 1
1821 2 37 VAL HA 2 38 TRP HD1 . . 4.180 2.902 2.736 3.011 . 0 0 "[ . 1 . 2]" 1
1822 2 37 VAL HB 2 38 TRP HA . . 4.980 4.583 4.507 4.894 . 0 0 "[ . 1 . 2]" 1
1823 2 37 VAL HB 2 38 TRP HD1 . . 4.950 4.853 4.755 4.936 . 0 0 "[ . 1 . 2]" 1
1824 2 37 VAL QG 2 38 TRP H . . 3.350 2.782 2.636 3.282 . 0 0 "[ . 1 . 2]" 1
1825 2 37 VAL QG 2 38 TRP HA . . 4.330 3.735 3.305 3.909 . 0 0 "[ . 1 . 2]" 1
1826 2 37 VAL QG 2 38 TRP HD1 . . 4.400 3.987 3.904 4.066 . 0 0 "[ . 1 . 2]" 1
1827 2 38 TRP H 2 38 TRP HB2 . . 3.780 3.584 3.558 3.610 . 0 0 "[ . 1 . 2]" 1
1828 2 38 TRP H 2 38 TRP HD1 . . 3.770 2.528 2.481 2.628 . 0 0 "[ . 1 . 2]" 1
1829 2 38 TRP HA 2 39 LEU HA . . 4.480 4.392 4.382 4.403 . 0 0 "[ . 1 . 2]" 1
1830 2 38 TRP HB2 2 38 TRP HZ3 . . 5.500 4.822 4.821 4.823 . 0 0 "[ . 1 . 2]" 1
1831 2 38 TRP HB2 2 40 ALA HA . . 5.500 5.551 5.446 5.604 0.104 14 0 "[ . 1 . 2]" 1
1832 2 39 LEU H 2 39 LEU MD1 . . 5.500 4.335 4.286 4.375 . 0 0 "[ . 1 . 2]" 1
1833 2 39 LEU H 2 39 LEU MD2 . . 5.500 4.375 4.344 4.413 . 0 0 "[ . 1 . 2]" 1
1834 2 39 LEU HA 2 39 LEU MD1 . . 3.360 2.098 2.010 2.257 . 0 0 "[ . 1 . 2]" 1
1835 2 39 LEU HA 2 39 LEU MD2 . . 3.980 3.936 3.919 3.953 . 0 0 "[ . 1 . 2]" 1
1836 2 39 LEU HA 2 39 LEU HG . . 4.080 3.232 3.205 3.254 . 0 0 "[ . 1 . 2]" 1
1837 2 39 LEU HA 2 40 ALA H . . 3.170 2.306 2.295 2.323 . 0 0 "[ . 1 . 2]" 1
1838 2 39 LEU HA 2 40 ALA HA . . 4.560 4.371 4.365 4.378 . 0 0 "[ . 1 . 2]" 1
1839 2 39 LEU HA 2 40 ALA MB . . 4.350 3.862 3.850 3.879 . 0 0 "[ . 1 . 2]" 1
1840 2 39 LEU HA 2 48 VAL QG . . 5.440 4.778 4.548 4.961 . 0 0 "[ . 1 . 2]" 1
1841 2 39 LEU HB2 2 48 VAL MG1 . . 4.730 3.811 3.477 4.010 . 0 0 "[ . 1 . 2]" 1
1842 2 39 LEU HB2 2 48 VAL QG . . 3.650 3.054 2.839 3.242 . 0 0 "[ . 1 . 2]" 1
1843 2 39 LEU HB2 2 48 VAL MG2 . . 4.730 3.216 2.993 3.431 . 0 0 "[ . 1 . 2]" 1
1844 2 39 LEU HB3 2 39 LEU MD2 . . 3.580 2.331 2.304 2.356 . 0 0 "[ . 1 . 2]" 1
1845 2 39 LEU HB3 2 40 ALA H . . 4.740 3.896 3.834 3.932 . 0 0 "[ . 1 . 2]" 1
1846 2 39 LEU MD1 2 40 ALA H . . 3.800 1.933 1.886 2.102 . 0 0 "[ . 1 . 2]" 1
1847 2 39 LEU MD1 2 40 ALA MB . . 3.780 3.408 3.305 3.463 . 0 0 "[ . 1 . 2]" 1
1848 2 39 LEU MD1 2 41 ASP H . . 3.390 1.942 1.908 2.043 . 0 0 "[ . 1 . 2]" 1
1849 2 39 LEU MD1 2 41 ASP HA . . 4.370 4.262 4.146 4.403 0.033 18 0 "[ . 1 . 2]" 1
1850 2 39 LEU MD1 2 41 ASP HB2 . . 4.020 3.093 2.758 3.433 . 0 0 "[ . 1 . 2]" 1
1851 2 39 LEU MD1 2 41 ASP HB3 . . 3.720 2.567 2.280 3.053 . 0 0 "[ . 1 . 2]" 1
1852 2 39 LEU MD1 2 44 GLN QB . . 3.470 3.024 2.809 3.145 . 0 0 "[ . 1 . 2]" 1
1853 2 39 LEU MD1 2 44 GLN HG2 . . 4.990 4.474 4.185 5.058 0.068 18 0 "[ . 1 . 2]" 1
1854 2 39 LEU MD1 2 44 GLN QG . . 4.320 4.117 3.926 4.389 0.069 19 0 "[ . 1 . 2]" 1
1855 2 39 LEU MD1 2 44 GLN HG3 . . 4.990 4.885 4.312 5.061 0.071 19 0 "[ . 1 . 2]" 1
1856 2 39 LEU MD1 2 45 ALA MB . . 5.500 4.628 4.537 4.726 . 0 0 "[ . 1 . 2]" 1
1857 2 39 LEU MD2 2 41 ASP HA . . 4.600 4.420 4.382 4.461 . 0 0 "[ . 1 . 2]" 1
1858 2 39 LEU MD2 2 42 GLU HA . . 3.710 3.239 3.147 3.339 . 0 0 "[ . 1 . 2]" 1
1859 2 39 LEU MD2 2 42 GLU HB2 . . 5.500 5.592 5.536 5.666 0.166 9 0 "[ . 1 . 2]" 1
1860 2 39 LEU MD2 2 42 GLU QG . . 5.340 4.671 4.594 4.752 . 0 0 "[ . 1 . 2]" 1
1861 2 39 LEU MD2 2 44 GLN H . . 3.730 3.220 3.098 3.307 . 0 0 "[ . 1 . 2]" 1
1862 2 39 LEU MD2 2 44 GLN HB2 . . 4.100 2.773 2.345 3.102 . 0 0 "[ . 1 . 2]" 1
1863 2 39 LEU MD2 2 44 GLN HB3 . . 4.100 2.188 1.968 2.488 . 0 0 "[ . 1 . 2]" 1
1864 2 39 LEU MD2 2 44 GLN QG . . 4.350 3.770 3.622 3.912 . 0 0 "[ . 1 . 2]" 1
1865 2 39 LEU MD2 2 45 ALA H . . 3.830 2.464 2.378 2.551 . 0 0 "[ . 1 . 2]" 1
1866 2 39 LEU MD2 2 45 ALA HA . . 2.720 1.925 1.884 1.987 . 0 0 "[ . 1 . 2]" 1
1867 2 39 LEU MD2 2 45 ALA MB . . 3.190 2.244 2.109 2.366 . 0 0 "[ . 1 . 2]" 1
1868 2 39 LEU MD2 2 47 ARG HD2 . . 5.500 5.532 5.264 5.666 0.166 1 0 "[ . 1 . 2]" 1
1869 2 39 LEU MD2 2 48 VAL HA . . 5.500 5.215 5.039 5.329 . 0 0 "[ . 1 . 2]" 1
1870 2 39 LEU MD2 2 48 VAL HB . . 4.620 3.957 3.827 4.124 . 0 0 "[ . 1 . 2]" 1
1871 2 39 LEU MD2 2 48 VAL MG1 . . 3.660 2.434 2.213 2.595 . 0 0 "[ . 1 . 2]" 1
1872 2 39 LEU MD2 2 48 VAL QG . . 2.980 1.845 1.795 1.900 . 0 0 "[ . 1 . 2]" 1
1873 2 39 LEU MD2 2 48 VAL MG2 . . 3.660 1.912 1.892 1.975 . 0 0 "[ . 1 . 2]" 1
1874 2 39 LEU HG 2 40 ALA MB . . 4.150 3.998 3.966 4.027 . 0 0 "[ . 1 . 2]" 1
1875 2 39 LEU HG 2 41 ASP HA . . 5.500 4.134 4.106 4.155 . 0 0 "[ . 1 . 2]" 1
1876 2 39 LEU HG 2 41 ASP HB2 . . 4.720 4.198 3.990 4.447 . 0 0 "[ . 1 . 2]" 1
1877 2 39 LEU HG 2 41 ASP HB3 . . 4.510 3.444 3.361 3.634 . 0 0 "[ . 1 . 2]" 1
1878 2 39 LEU HG 2 42 GLU HA . . 4.970 4.162 4.086 4.236 . 0 0 "[ . 1 . 2]" 1
1879 2 39 LEU HG 2 42 GLU QG . . 5.180 4.892 4.805 5.014 . 0 0 "[ . 1 . 2]" 1
1880 2 40 ALA H 2 40 ALA MB . . 3.270 2.305 2.232 2.343 . 0 0 "[ . 1 . 2]" 1
1881 2 40 ALA H 2 41 ASP H . . 3.530 2.088 2.046 2.127 . 0 0 "[ . 1 . 2]" 1
1882 2 40 ALA MB 2 41 ASP H . . 3.460 2.849 2.779 2.906 . 0 0 "[ . 1 . 2]" 1
1883 2 40 ALA MB 2 41 ASP HA . . 3.940 3.852 3.823 3.872 . 0 0 "[ . 1 . 2]" 1
1884 2 40 ALA MB 2 41 ASP HB2 . . 4.220 3.834 3.712 3.906 . 0 0 "[ . 1 . 2]" 1
1885 2 40 ALA MB 2 41 ASP HB3 . . 5.130 4.761 4.550 4.946 . 0 0 "[ . 1 . 2]" 1
1886 2 41 ASP H 2 41 ASP HB2 . . 3.290 2.597 2.410 2.807 . 0 0 "[ . 1 . 2]" 1
1887 2 41 ASP H 2 41 ASP HB3 . . 3.240 2.648 2.451 2.880 . 0 0 "[ . 1 . 2]" 1
1888 2 41 ASP H 2 42 GLU H . . 4.500 4.048 4.016 4.089 . 0 0 "[ . 1 . 2]" 1
1889 2 41 ASP HA 2 42 GLU H . . 3.000 2.257 2.235 2.273 . 0 0 "[ . 1 . 2]" 1
1890 2 41 ASP HA 2 42 GLU HA . . 5.070 4.518 4.503 4.529 . 0 0 "[ . 1 . 2]" 1
1891 2 41 ASP HA 2 42 GLU HB2 . . 4.670 4.533 4.430 4.601 . 0 0 "[ . 1 . 2]" 1
1892 2 41 ASP HA 2 42 GLU QG . . 5.340 4.108 3.923 4.626 . 0 0 "[ . 1 . 2]" 1
1893 2 41 ASP HB3 2 44 GLN QB . . 4.370 2.027 1.957 2.183 . 0 0 "[ . 1 . 2]" 1
1894 2 41 ASP HB3 2 44 GLN QG . . 3.750 3.606 3.363 3.807 0.057 19 0 "[ . 1 . 2]" 1
1895 2 42 GLU H 2 42 GLU HB2 . . 3.290 2.554 2.439 2.638 . 0 0 "[ . 1 . 2]" 1
1896 2 42 GLU H 2 42 GLU HB3 . . 3.620 3.593 3.588 3.595 . 0 0 "[ . 1 . 2]" 1
1897 2 42 GLU H 2 42 GLU QG . . 3.190 2.116 1.950 2.656 . 0 0 "[ . 1 . 2]" 1
1898 2 42 GLU HA 2 42 GLU QG . . 3.730 2.450 2.365 2.527 . 0 0 "[ . 1 . 2]" 1
1899 2 42 GLU HA 2 43 SER HA . . 5.500 4.845 4.831 4.860 . 0 0 "[ . 1 . 2]" 1
1900 2 42 GLU HA 2 44 GLN H . . 5.500 4.050 4.004 4.135 . 0 0 "[ . 1 . 2]" 1
1901 2 42 GLU HA 2 45 ALA MB . . 4.610 2.047 1.975 2.247 . 0 0 "[ . 1 . 2]" 1
1902 2 42 GLU HB2 2 43 SER HA . . 4.770 4.252 4.164 4.402 . 0 0 "[ . 1 . 2]" 1
1903 2 42 GLU HB3 2 45 ALA H . . 4.780 4.741 4.685 4.811 0.031 19 0 "[ . 1 . 2]" 1
1904 2 42 GLU HB3 2 45 ALA MB . . 5.210 3.606 3.536 3.725 . 0 0 "[ . 1 . 2]" 1
1905 2 42 GLU QG 2 45 ALA MB . . 4.990 3.726 3.513 3.962 . 0 0 "[ . 1 . 2]" 1
1906 2 43 SER H 2 43 SER QB . . 3.170 2.692 2.135 2.809 . 0 0 "[ . 1 . 2]" 1
1907 2 43 SER H 2 44 GLN H . . 3.520 2.739 2.713 2.773 . 0 0 "[ . 1 . 2]" 1
1908 2 43 SER QB 2 44 GLN QG . . 5.180 4.636 3.533 5.018 . 0 0 "[ . 1 . 2]" 1
1909 2 44 GLN H 2 44 GLN QB . . 3.470 2.145 2.121 2.170 . 0 0 "[ . 1 . 2]" 1
1910 2 44 GLN H 2 44 GLN QG . . 4.370 3.858 3.161 4.054 . 0 0 "[ . 1 . 2]" 1
1911 2 44 GLN HA 2 44 GLN HG2 . . 3.610 3.453 2.547 3.583 . 0 0 "[ . 1 . 2]" 1
1912 2 44 GLN HA 2 44 GLN HG3 . . 3.610 2.722 2.495 3.580 . 0 0 "[ . 1 . 2]" 1
1913 2 44 GLN HA 2 47 ARG HD2 . . 5.200 4.913 4.645 5.121 . 0 0 "[ . 1 . 2]" 1
1914 2 44 GLN HA 2 47 ARG HD3 . . 5.500 5.522 5.268 5.590 0.090 16 0 "[ . 1 . 2]" 1
1915 2 44 GLN HA 2 48 VAL QG . . 4.050 3.978 3.741 4.115 0.065 12 0 "[ . 1 . 2]" 1
1916 2 44 GLN QB 2 45 ALA H . . 3.730 3.185 3.166 3.195 . 0 0 "[ . 1 . 2]" 1
1917 2 44 GLN QB 2 45 ALA HA . . 4.430 3.963 3.939 4.021 . 0 0 "[ . 1 . 2]" 1
1918 2 44 GLN QB 2 48 VAL QG . . 3.470 2.648 2.359 2.855 . 0 0 "[ . 1 . 2]" 1
1919 2 44 GLN QG 2 47 ARG HD2 . . 4.490 3.175 2.761 4.193 . 0 0 "[ . 1 . 2]" 1
1920 2 44 GLN QG 2 48 VAL QG . . 3.740 3.321 3.054 3.815 0.075 15 0 "[ . 1 . 2]" 1
1921 2 44 GLN HG2 2 47 ARG HD2 . . 5.200 4.498 3.493 5.355 0.155 15 0 "[ . 1 . 2]" 1
1922 2 44 GLN HG3 2 47 ARG HD2 . . 5.200 3.327 2.806 5.206 0.006 19 0 "[ . 1 . 2]" 1
1923 2 45 ALA H 2 46 GLU H . . 3.880 2.801 2.736 2.876 . 0 0 "[ . 1 . 2]" 1
1924 2 45 ALA H 2 48 VAL MG1 . . 5.050 4.642 4.339 4.794 . 0 0 "[ . 1 . 2]" 1
1925 2 45 ALA H 2 48 VAL QG . . 4.350 3.680 3.581 3.729 . 0 0 "[ . 1 . 2]" 1
1926 2 45 ALA H 2 48 VAL MG2 . . 5.050 3.862 3.815 3.893 . 0 0 "[ . 1 . 2]" 1
1927 2 45 ALA HA 2 48 VAL HB . . 4.620 4.616 4.511 4.673 0.053 15 0 "[ . 1 . 2]" 1
1928 2 45 ALA HA 2 48 VAL MG1 . . 3.700 3.456 3.282 3.557 . 0 0 "[ . 1 . 2]" 1
1929 2 45 ALA HA 2 48 VAL QG . . 3.160 1.913 1.859 1.948 . 0 0 "[ . 1 . 2]" 1
1930 2 45 ALA HA 2 48 VAL MG2 . . 3.700 1.922 1.868 1.957 . 0 0 "[ . 1 . 2]" 1
1931 2 45 ALA MB 2 46 GLU H . . 3.280 2.677 2.543 2.847 . 0 0 "[ . 1 . 2]" 1
1932 2 45 ALA MB 2 46 GLU HA . . 3.990 3.821 3.749 3.901 . 0 0 "[ . 1 . 2]" 1
1933 2 45 ALA MB 2 46 GLU HB2 . . 4.880 4.730 4.513 4.843 . 0 0 "[ . 1 . 2]" 1
1934 2 45 ALA MB 2 46 GLU HG2 . . 4.560 3.988 3.449 4.491 . 0 0 "[ . 1 . 2]" 1
1935 2 45 ALA MB 2 46 GLU QG . . 3.990 3.186 3.054 3.377 . 0 0 "[ . 1 . 2]" 1
1936 2 45 ALA MB 2 46 GLU HG3 . . 4.560 3.418 3.135 4.367 . 0 0 "[ . 1 . 2]" 1
1937 2 45 ALA MB 2 48 VAL MG1 . . 4.610 4.644 4.490 4.736 0.126 19 0 "[ . 1 . 2]" 1
1938 2 45 ALA MB 2 48 VAL MG2 . . 4.610 3.177 3.134 3.232 . 0 0 "[ . 1 . 2]" 1
1939 2 45 ALA MB 2 49 ARG HD2 . . 4.290 2.797 2.559 3.092 . 0 0 "[ . 1 . 2]" 1
1940 2 45 ALA MB 2 49 ARG HD3 . . 4.280 3.808 3.559 4.137 . 0 0 "[ . 1 . 2]" 1
1941 2 46 GLU H 2 46 GLU HB2 . . 3.000 2.529 2.343 2.695 . 0 0 "[ . 1 . 2]" 1
1942 2 46 GLU H 2 46 GLU HG2 . . 4.350 3.276 2.777 3.677 . 0 0 "[ . 1 . 2]" 1
1943 2 46 GLU H 2 46 GLU QG . . 3.690 2.198 1.954 2.614 . 0 0 "[ . 1 . 2]" 1
1944 2 46 GLU H 2 46 GLU HG3 . . 4.350 2.261 1.987 3.184 . 0 0 "[ . 1 . 2]" 1
1945 2 46 GLU H 2 47 ARG H . . 3.430 2.651 2.560 2.707 . 0 0 "[ . 1 . 2]" 1
1946 2 46 GLU H 2 49 ARG HD2 . . 5.360 4.725 4.328 5.142 . 0 0 "[ . 1 . 2]" 1
1947 2 46 GLU HA 2 46 GLU HG2 . . 3.670 2.579 2.366 2.853 . 0 0 "[ . 1 . 2]" 1
1948 2 46 GLU HA 2 46 GLU QG . . 3.160 2.456 2.303 2.540 . 0 0 "[ . 1 . 2]" 1
1949 2 46 GLU HA 2 46 GLU HG3 . . 3.670 3.181 2.782 3.632 . 0 0 "[ . 1 . 2]" 1
1950 2 46 GLU HA 2 48 VAL QG . . 5.440 4.079 3.866 4.193 . 0 0 "[ . 1 . 2]" 1
1951 2 46 GLU HA 2 49 ARG H . . 4.020 3.584 3.406 3.687 . 0 0 "[ . 1 . 2]" 1
1952 2 46 GLU HA 2 49 ARG HB2 . . 3.630 2.518 2.473 2.580 . 0 0 "[ . 1 . 2]" 1
1953 2 46 GLU HA 2 49 ARG HD2 . . 3.990 3.569 3.190 3.832 . 0 0 "[ . 1 . 2]" 1
1954 2 46 GLU HA 2 49 ARG HD3 . . 4.260 2.503 2.189 3.051 . 0 0 "[ . 1 . 2]" 1
1955 2 46 GLU HA 2 49 ARG HG3 . . 5.190 4.555 4.478 4.720 . 0 0 "[ . 1 . 2]" 1
1956 2 46 GLU QG 2 48 VAL QG . . 5.280 4.927 4.726 5.109 . 0 0 "[ . 1 . 2]" 1
1957 2 46 GLU QG 2 49 ARG HD2 . . 5.340 4.568 4.369 4.769 . 0 0 "[ . 1 . 2]" 1
1958 2 46 GLU HG2 2 49 ARG HD3 . . 5.310 4.019 3.630 4.531 . 0 0 "[ . 1 . 2]" 1
1959 2 46 GLU HG3 2 49 ARG HD3 . . 5.310 4.938 4.424 5.314 0.004 4 0 "[ . 1 . 2]" 1
1960 2 47 ARG H 2 47 ARG QB . . 2.730 2.235 2.193 2.247 . 0 0 "[ . 1 . 2]" 1
1961 2 47 ARG H 2 47 ARG HD3 . . 5.500 4.583 4.432 4.663 . 0 0 "[ . 1 . 2]" 1
1962 2 47 ARG H 2 48 VAL H . . 3.480 2.798 2.686 2.862 . 0 0 "[ . 1 . 2]" 1
1963 2 47 ARG H 2 48 VAL MG1 . . 5.490 4.449 4.243 4.561 . 0 0 "[ . 1 . 2]" 1
1964 2 47 ARG H 2 48 VAL QG . . 4.740 3.560 3.505 3.597 . 0 0 "[ . 1 . 2]" 1
1965 2 47 ARG H 2 48 VAL MG2 . . 5.490 3.749 3.650 3.848 . 0 0 "[ . 1 . 2]" 1
1966 2 47 ARG HA 2 47 ARG HD3 . . 4.010 3.705 3.466 3.859 . 0 0 "[ . 1 . 2]" 1
1967 2 47 ARG HA 2 48 VAL MG1 . . 5.500 5.071 4.967 5.170 . 0 0 "[ . 1 . 2]" 1
1968 2 47 ARG HA 2 48 VAL MG2 . . 5.500 4.890 4.834 4.959 . 0 0 "[ . 1 . 2]" 1
1969 2 47 ARG HA 2 49 ARG H . . 4.840 4.420 4.290 4.590 . 0 0 "[ . 1 . 2]" 1
1970 2 47 ARG HA 2 50 ALA MB . . 3.790 3.097 2.937 3.213 . 0 0 "[ . 1 . 2]" 1
1971 2 47 ARG HA 2 51 GLU HG2 . . 5.500 3.834 3.644 3.960 . 0 0 "[ . 1 . 2]" 1
1972 2 47 ARG HA 2 51 GLU HG3 . . 5.500 5.381 5.186 5.515 0.015 14 0 "[ . 1 . 2]" 1
1973 2 47 ARG QB 2 48 VAL HA . . 5.340 4.246 4.105 4.609 . 0 0 "[ . 1 . 2]" 1
1974 2 47 ARG HD2 2 48 VAL HA . . 5.500 3.816 2.931 4.224 . 0 0 "[ . 1 . 2]" 1
1975 2 47 ARG HD2 2 48 VAL QG . . 4.070 2.775 1.961 3.196 . 0 0 "[ . 1 . 2]" 1
1976 2 47 ARG HD2 2 51 GLU HG3 . . 4.810 4.671 4.249 4.827 0.017 1 0 "[ . 1 . 2]" 1
1977 2 47 ARG HD3 2 48 VAL HA . . 5.260 2.622 2.420 3.223 . 0 0 "[ . 1 . 2]" 1
1978 2 47 ARG HD3 2 48 VAL QG . . 4.450 2.674 2.204 3.259 . 0 0 "[ . 1 . 2]" 1
1979 2 47 ARG HD3 2 51 GLU HB2 . . 4.300 3.769 3.518 4.000 . 0 0 "[ . 1 . 2]" 1
1980 2 47 ARG HD3 2 51 GLU HB3 . . 5.500 4.986 4.665 5.278 . 0 0 "[ . 1 . 2]" 1
1981 2 47 ARG HD3 2 51 GLU HG2 . . 5.400 3.063 2.817 3.513 . 0 0 "[ . 1 . 2]" 1
1982 2 48 VAL H 2 48 VAL MG1 . . 3.680 2.370 2.255 2.449 . 0 0 "[ . 1 . 2]" 1
1983 2 48 VAL H 2 48 VAL QG . . 3.200 1.875 1.850 1.934 . 0 0 "[ . 1 . 2]" 1
1984 2 48 VAL H 2 48 VAL MG2 . . 3.680 1.969 1.919 2.105 . 0 0 "[ . 1 . 2]" 1
1985 2 48 VAL H 2 49 ARG HG3 . . 5.500 5.510 5.490 5.518 0.018 5 0 "[ . 1 . 2]" 1
1986 2 48 VAL HA 2 48 VAL MG1 . . 3.410 2.230 2.177 2.331 . 0 0 "[ . 1 . 2]" 1
1987 2 48 VAL HA 2 48 VAL QG . . 2.870 2.190 2.143 2.277 . 0 0 "[ . 1 . 2]" 1
1988 2 48 VAL HA 2 48 VAL MG2 . . 3.410 3.201 3.198 3.202 . 0 0 "[ . 1 . 2]" 1
1989 2 48 VAL HA 2 49 ARG HB2 . . 5.500 5.575 5.556 5.589 0.089 12 0 "[ . 1 . 2]" 1
1990 2 48 VAL HA 2 50 ALA MB . . 5.160 5.087 4.932 5.186 0.026 15 0 "[ . 1 . 2]" 1
1991 2 48 VAL HA 2 51 GLU HB2 . . 3.450 2.810 2.602 2.937 . 0 0 "[ . 1 . 2]" 1
1992 2 48 VAL HA 2 51 GLU HB3 . . 4.620 4.466 4.185 4.617 . 0 0 "[ . 1 . 2]" 1
1993 2 48 VAL HA 2 51 GLU HG2 . . 4.310 3.693 3.439 4.017 . 0 0 "[ . 1 . 2]" 1
1994 2 48 VAL HA 2 51 GLU HG3 . . 4.770 4.406 4.317 4.615 . 0 0 "[ . 1 . 2]" 1
1995 2 48 VAL HA 2 52 LEU QB . . 5.340 4.026 3.947 4.087 . 0 0 "[ . 1 . 2]" 1
1996 2 48 VAL QG 2 49 ARG H . . 3.840 2.037 1.959 2.081 . 0 0 "[ . 1 . 2]" 1
1997 2 48 VAL QG 2 49 ARG HA . . 4.410 3.166 3.096 3.238 . 0 0 "[ . 1 . 2]" 1
1998 2 48 VAL QG 2 49 ARG HB2 . . 5.270 3.426 3.318 3.487 . 0 0 "[ . 1 . 2]" 1
1999 2 48 VAL QG 2 49 ARG HD2 . . 4.220 3.601 3.515 3.741 . 0 0 "[ . 1 . 2]" 1
2000 2 48 VAL QG 2 49 ARG HD3 . . 5.440 4.217 4.029 4.462 . 0 0 "[ . 1 . 2]" 1
2001 2 48 VAL QG 2 49 ARG HG3 . . 4.910 2.860 2.768 2.976 . 0 0 "[ . 1 . 2]" 1
2002 2 48 VAL QG 2 51 GLU HB2 . . 4.720 4.241 4.097 4.327 . 0 0 "[ . 1 . 2]" 1
2003 2 48 VAL QG 2 51 GLU HG2 . . 5.310 4.678 4.507 4.918 . 0 0 "[ . 1 . 2]" 1
2004 2 48 VAL QG 2 51 GLU HG3 . . 5.440 5.098 5.007 5.264 . 0 0 "[ . 1 . 2]" 1
2005 2 48 VAL QG 2 52 LEU QD . . 3.920 3.866 3.701 3.948 0.028 12 0 "[ . 1 . 2]" 1
2006 2 48 VAL MG1 2 49 ARG HA . . 5.500 5.400 5.389 5.406 . 0 0 "[ . 1 . 2]" 1
2007 2 48 VAL MG1 2 51 GLU HB2 . . 5.450 4.451 4.293 4.557 . 0 0 "[ . 1 . 2]" 1
2008 2 48 VAL MG2 2 49 ARG HA . . 5.500 3.188 3.114 3.264 . 0 0 "[ . 1 . 2]" 1
2009 2 48 VAL MG2 2 51 GLU HB2 . . 5.450 5.337 5.183 5.431 . 0 0 "[ . 1 . 2]" 1
2010 2 49 ARG H 2 49 ARG HB2 . . 2.860 2.153 2.109 2.180 . 0 0 "[ . 1 . 2]" 1
2011 2 49 ARG H 2 49 ARG HD2 . . 5.500 3.975 3.815 4.126 . 0 0 "[ . 1 . 2]" 1
2012 2 49 ARG H 2 49 ARG HD3 . . 4.290 3.860 3.652 4.155 . 0 0 "[ . 1 . 2]" 1
2013 2 49 ARG H 2 49 ARG HG3 . . 3.490 3.103 3.021 3.244 . 0 0 "[ . 1 . 2]" 1
2014 2 49 ARG H 2 50 ALA H . . 3.270 2.807 2.735 2.900 . 0 0 "[ . 1 . 2]" 1
2015 2 49 ARG HA 2 49 ARG HD2 . . 4.380 4.372 4.293 4.398 0.018 19 0 "[ . 1 . 2]" 1
2016 2 49 ARG HA 2 49 ARG HD3 . . 4.790 4.359 4.317 4.425 . 0 0 "[ . 1 . 2]" 1
2017 2 49 ARG HA 2 49 ARG HG3 . . 4.010 2.317 2.268 2.361 . 0 0 "[ . 1 . 2]" 1
2018 2 49 ARG HA 2 52 LEU QB . . 5.210 2.730 2.639 2.856 . 0 0 "[ . 1 . 2]" 1
2019 2 49 ARG HA 2 52 LEU MD1 . . 4.960 4.142 3.622 4.659 . 0 0 "[ . 1 . 2]" 1
2020 2 49 ARG HA 2 52 LEU QD . . 4.120 3.187 2.983 3.324 . 0 0 "[ . 1 . 2]" 1
2021 2 49 ARG HA 2 52 LEU MD2 . . 4.960 3.377 3.042 3.780 . 0 0 "[ . 1 . 2]" 1
2022 2 49 ARG HA 2 52 LEU HG . . 5.500 5.472 5.345 5.542 0.042 7 0 "[ . 1 . 2]" 1
2023 2 49 ARG HB2 2 49 ARG HD3 . . 3.340 2.108 2.022 2.274 . 0 0 "[ . 1 . 2]" 1
2024 2 49 ARG HB2 2 50 ALA H . . 3.260 2.719 2.571 2.928 . 0 0 "[ . 1 . 2]" 1
2025 2 50 ALA H 2 50 ALA MB . . 2.920 2.203 2.083 2.237 . 0 0 "[ . 1 . 2]" 1
2026 2 50 ALA H 2 51 GLU H . . 3.390 2.854 2.712 2.951 . 0 0 "[ . 1 . 2]" 1
2027 2 50 ALA HA 2 53 ALA H . . 4.220 3.765 3.647 3.849 . 0 0 "[ . 1 . 2]" 1
2028 2 50 ALA HA 2 53 ALA MB . . 3.130 2.904 2.688 3.047 . 0 0 "[ . 1 . 2]" 1
2029 2 50 ALA MB 2 51 GLU H . . 3.370 2.245 2.112 2.413 . 0 0 "[ . 1 . 2]" 1
2030 2 50 ALA MB 2 51 GLU HB3 . . 5.240 5.119 5.038 5.195 . 0 0 "[ . 1 . 2]" 1
2031 2 50 ALA MB 2 51 GLU HG2 . . 4.340 3.435 3.317 3.575 . 0 0 "[ . 1 . 2]" 1
2032 2 50 ALA MB 2 51 GLU HG3 . . 5.070 4.849 4.706 5.013 . 0 0 "[ . 1 . 2]" 1
2033 2 50 ALA MB 2 54 ARG QD . . 3.900 3.137 2.832 3.626 . 0 0 "[ . 1 . 2]" 1
2034 2 51 GLU H 2 51 GLU HB2 . . 3.790 2.544 2.383 2.638 . 0 0 "[ . 1 . 2]" 1
2035 2 51 GLU H 2 51 GLU HB3 . . 3.700 3.589 3.574 3.594 . 0 0 "[ . 1 . 2]" 1
2036 2 51 GLU H 2 51 GLU HG2 . . 3.760 2.299 2.200 2.474 . 0 0 "[ . 1 . 2]" 1
2037 2 51 GLU H 2 51 GLU HG3 . . 4.760 3.748 3.659 3.879 . 0 0 "[ . 1 . 2]" 1
2038 2 51 GLU H 2 52 LEU H . . 3.510 2.826 2.738 2.901 . 0 0 "[ . 1 . 2]" 1
2039 2 51 GLU HA 2 51 GLU HG2 . . 3.480 3.341 3.120 3.444 . 0 0 "[ . 1 . 2]" 1
2040 2 51 GLU HA 2 54 ARG H . . 4.180 3.484 3.394 3.552 . 0 0 "[ . 1 . 2]" 1
2041 2 51 GLU HA 2 54 ARG HA . . 5.500 5.414 5.289 5.514 0.014 13 0 "[ . 1 . 2]" 1
2042 2 51 GLU HA 2 54 ARG QB . . 3.490 2.540 2.404 2.787 . 0 0 "[ . 1 . 2]" 1
2043 2 51 GLU HA 2 54 ARG QD . . 3.590 2.679 2.077 3.028 . 0 0 "[ . 1 . 2]" 1
2044 2 51 GLU HB3 2 54 ARG QD . . 5.340 4.797 4.205 5.088 . 0 0 "[ . 1 . 2]" 1
2045 2 52 LEU H 2 52 LEU HB2 . . 3.480 2.501 2.422 2.649 . 0 0 "[ . 1 . 2]" 1
2046 2 52 LEU H 2 52 LEU QB . . 2.860 2.229 2.209 2.235 . 0 0 "[ . 1 . 2]" 1
2047 2 52 LEU H 2 52 LEU HB3 . . 3.480 2.511 2.365 2.598 . 0 0 "[ . 1 . 2]" 1
2048 2 52 LEU H 2 52 LEU MD1 . . 5.500 4.142 4.076 4.243 . 0 0 "[ . 1 . 2]" 1
2049 2 52 LEU H 2 52 LEU QD . . 4.060 3.695 3.677 3.714 . 0 0 "[ . 1 . 2]" 1
2050 2 52 LEU H 2 52 LEU MD2 . . 5.500 4.154 4.052 4.216 . 0 0 "[ . 1 . 2]" 1
2051 2 52 LEU H 2 52 LEU HG . . 5.500 4.446 4.424 4.452 . 0 0 "[ . 1 . 2]" 1
2052 2 52 LEU H 2 53 ALA H . . 3.100 2.888 2.746 2.966 . 0 0 "[ . 1 . 2]" 1
2053 2 52 LEU HA 2 52 LEU MD1 . . 4.010 3.223 2.974 3.609 . 0 0 "[ . 1 . 2]" 1
2054 2 52 LEU HA 2 52 LEU QD . . 2.910 2.978 2.877 3.096 0.186 11 0 "[ . 1 . 2]" 1
2055 2 52 LEU HA 2 52 LEU MD2 . . 4.010 3.657 3.292 3.863 . 0 0 "[ . 1 . 2]" 1
2056 2 52 LEU HA 2 52 LEU HG . . 3.420 2.594 2.473 2.748 . 0 0 "[ . 1 . 2]" 1
2057 2 52 LEU HA 2 55 PHE HB2 . . 4.480 3.204 2.986 3.383 . 0 0 "[ . 1 . 2]" 1
2058 2 52 LEU HA 2 55 PHE QB . . 3.660 2.727 2.437 2.902 . 0 0 "[ . 1 . 2]" 1
2059 2 52 LEU HA 2 55 PHE HB3 . . 4.480 2.975 2.552 3.353 . 0 0 "[ . 1 . 2]" 1
2060 2 52 LEU HA 2 56 LEU QD . . 5.230 4.568 3.432 4.879 . 0 0 "[ . 1 . 2]" 1
2061 2 52 LEU QB 2 52 LEU QD . . 2.780 1.775 1.734 1.818 . 0 0 "[ . 1 . 2]" 1
2062 2 52 LEU QB 2 53 ALA H . . 3.280 2.311 2.199 2.436 . 0 0 "[ . 1 . 2]" 1
2063 2 52 LEU QB 2 56 LEU QD . . 5.280 4.146 3.559 4.472 . 0 0 "[ . 1 . 2]" 1
2064 2 52 LEU QD 2 53 ALA HA . . 5.440 2.927 2.464 3.337 . 0 0 "[ . 1 . 2]" 1
2065 2 52 LEU QD 2 55 PHE QB . . 4.110 4.139 3.974 4.210 0.100 10 0 "[ . 1 . 2]" 1
2066 2 52 LEU QD 2 56 LEU HA . . 5.210 4.942 4.503 5.191 . 0 0 "[ . 1 . 2]" 1
2067 2 52 LEU QD 2 56 LEU QD . . 3.020 2.043 1.725 2.423 . 0 0 "[ . 1 . 2]" 1
2068 2 52 LEU QD 2 56 LEU HG . . 3.230 2.962 2.373 3.289 0.059 9 0 "[ . 1 . 2]" 1
2069 2 52 LEU MD1 2 53 ALA MB . . 5.500 5.288 5.078 5.453 . 0 0 "[ . 1 . 2]" 1
2070 2 52 LEU MD2 2 53 ALA MB . . 5.500 3.332 3.172 3.529 . 0 0 "[ . 1 . 2]" 1
2071 2 53 ALA H 2 53 ALA MB . . 2.900 2.097 2.055 2.168 . 0 0 "[ . 1 . 2]" 1
2072 2 53 ALA HA 2 56 LEU H . . 5.500 3.442 3.299 3.562 . 0 0 "[ . 1 . 2]" 1
2073 2 53 ALA HA 2 56 LEU QB . . 3.940 2.612 2.460 2.866 . 0 0 "[ . 1 . 2]" 1
2074 2 53 ALA HA 2 56 LEU QD . . 3.150 2.710 2.079 3.066 . 0 0 "[ . 1 . 2]" 1
2075 2 53 ALA HA 2 56 LEU HG . . 5.140 4.011 3.333 4.572 . 0 0 "[ . 1 . 2]" 1
2076 2 53 ALA MB 2 54 ARG H . . 3.350 2.738 2.619 2.910 . 0 0 "[ . 1 . 2]" 1
2077 2 53 ALA MB 2 54 ARG HA . . 5.500 3.800 3.728 3.848 . 0 0 "[ . 1 . 2]" 1
2078 2 53 ALA MB 2 54 ARG QD . . 5.040 4.568 3.863 4.983 . 0 0 "[ . 1 . 2]" 1
2079 2 53 ALA MB 2 56 LEU QD . . 4.020 3.768 3.300 4.049 0.029 9 0 "[ . 1 . 2]" 1
2080 2 53 ALA MB 2 57 GLU HG2 . . 5.500 5.318 4.943 5.520 0.020 15 0 "[ . 1 . 2]" 1
2081 2 54 ARG H 2 54 ARG QB . . 2.940 2.290 2.121 2.492 . 0 0 "[ . 1 . 2]" 1
2082 2 54 ARG H 2 54 ARG QD . . 4.070 3.597 3.192 3.875 . 0 0 "[ . 1 . 2]" 1
2083 2 54 ARG H 2 54 ARG QG . . 3.280 2.618 2.129 3.276 . 0 0 "[ . 1 . 2]" 1
2084 2 54 ARG H 2 55 PHE H . . 3.610 2.483 2.351 2.600 . 0 0 "[ . 1 . 2]" 1
2085 2 54 ARG HA 2 54 ARG QD . . 4.690 4.050 3.713 4.235 . 0 0 "[ . 1 . 2]" 1
2086 2 54 ARG HA 2 57 GLU HG2 . . 4.780 2.709 2.444 2.918 . 0 0 "[ . 1 . 2]" 1
2087 2 54 ARG HA 2 57 GLU HG3 . . 4.570 4.161 3.771 4.484 . 0 0 "[ . 1 . 2]" 1
2088 2 54 ARG QB 2 54 ARG QD . . 2.770 2.127 2.018 2.268 . 0 0 "[ . 1 . 2]" 1
2089 2 55 PHE H 2 56 LEU H . . 4.230 2.350 2.296 2.402 . 0 0 "[ . 1 . 2]" 1
2090 2 55 PHE HA 2 55 PHE QD . . 3.410 2.370 2.106 3.122 . 0 0 "[ . 1 . 2]" 1
2091 2 55 PHE HA 2 55 PHE QE . . 5.500 4.320 4.189 4.643 . 0 0 "[ . 1 . 2]" 1
2092 2 55 PHE HA 2 62 LEU QD . . 5.090 3.683 3.425 4.223 . 0 0 "[ . 1 . 2]" 1
2093 2 55 PHE QB 2 56 LEU H . . 3.730 2.645 2.499 2.778 . 0 0 "[ . 1 . 2]" 1
2094 2 55 PHE QB 2 56 LEU QD . . 4.380 4.167 2.807 4.413 0.033 20 0 "[ . 1 . 2]" 1
2095 2 55 PHE QB 2 62 LEU QD . . 5.030 3.136 2.793 3.800 . 0 0 "[ . 1 . 2]" 1
2096 2 55 PHE QD 2 58 ASN HB2 . . 5.500 3.530 3.036 3.903 . 0 0 "[ . 1 . 2]" 1
2097 2 55 PHE QD 2 58 ASN HB3 . . 5.500 4.457 3.770 5.005 . 0 0 "[ . 1 . 2]" 1
2098 2 55 PHE QD 2 61 ASP HB2 . . 5.500 5.235 4.713 5.518 0.018 7 0 "[ . 1 . 2]" 1
2099 2 55 PHE QD 2 61 ASP HB3 . . 5.500 5.239 4.545 5.529 0.029 7 0 "[ . 1 . 2]" 1
2100 2 55 PHE QD 2 62 LEU HA . . 5.290 4.927 4.742 5.186 . 0 0 "[ . 1 . 2]" 1
2101 2 55 PHE QD 2 62 LEU HB2 . . 5.500 4.248 4.010 4.596 . 0 0 "[ . 1 . 2]" 1
2102 2 55 PHE QD 2 62 LEU HB3 . . 4.850 2.881 2.654 3.156 . 0 0 "[ . 1 . 2]" 1
2103 2 55 PHE QD 2 62 LEU QD . . 4.200 2.151 1.869 2.565 . 0 0 "[ . 1 . 2]" 1
2104 2 55 PHE QD 2 62 LEU HG . . 4.280 4.261 2.800 4.453 0.173 14 0 "[ . 1 . 2]" 1
2105 2 55 PHE QE 2 58 ASN HB3 . . 5.500 4.712 4.061 5.273 . 0 0 "[ . 1 . 2]" 1
2106 2 55 PHE HZ 2 61 ASP HB2 . . 4.420 2.696 2.167 3.545 . 0 0 "[ . 1 . 2]" 1
2107 2 55 PHE HZ 2 61 ASP HB3 . . 5.060 2.139 1.981 2.408 . 0 0 "[ . 1 . 2]" 1
2108 2 55 PHE HZ 2 62 LEU HA . . 4.420 4.296 4.085 4.465 0.045 13 0 "[ . 1 . 2]" 1
2109 2 55 PHE HZ 2 62 LEU HB2 . . 5.500 5.586 5.504 5.678 0.178 9 0 "[ . 1 . 2]" 1
2110 2 55 PHE HZ 2 62 LEU HB3 . . 5.500 3.983 3.886 4.095 . 0 0 "[ . 1 . 2]" 1
2111 2 55 PHE HZ 2 62 LEU HG . . 5.500 4.518 3.867 5.301 . 0 0 "[ . 1 . 2]" 1
2112 2 56 LEU H 2 56 LEU QB . . 3.420 2.156 2.084 2.366 . 0 0 "[ . 1 . 2]" 1
2113 2 56 LEU H 2 56 LEU MD1 . . 5.500 3.743 3.531 3.888 . 0 0 "[ . 1 . 2]" 1
2114 2 56 LEU H 2 56 LEU MD2 . . 5.500 3.795 2.145 4.133 . 0 0 "[ . 1 . 2]" 1
2115 2 56 LEU H 2 57 GLU H . . 3.550 2.720 2.605 2.787 . 0 0 "[ . 1 . 2]" 1
2116 2 56 LEU HA 2 56 LEU MD1 . . 3.990 3.719 2.077 3.870 . 0 0 "[ . 1 . 2]" 1
2117 2 56 LEU HA 2 56 LEU QD . . 2.670 2.044 1.943 2.376 . 0 0 "[ . 1 . 2]" 1
2118 2 56 LEU HA 2 56 LEU MD2 . . 3.990 2.081 1.949 2.564 . 0 0 "[ . 1 . 2]" 1
2119 2 56 LEU HA 2 56 LEU HG . . 3.440 2.795 2.523 3.643 0.203 9 0 "[ . 1 . 2]" 1
2120 2 56 LEU QB 2 56 LEU QD . . 2.480 1.917 1.820 2.031 . 0 0 "[ . 1 . 2]" 1
2121 2 56 LEU QD 2 57 GLU H . . 4.810 4.128 3.905 4.190 . 0 0 "[ . 1 . 2]" 1
2122 2 57 GLU H 2 57 GLU HB3 . . 3.010 2.495 2.447 2.672 . 0 0 "[ . 1 . 2]" 1
2123 2 57 GLU H 2 57 GLU HG2 . . 3.290 2.283 1.951 2.366 . 0 0 "[ . 1 . 2]" 1
2124 2 57 GLU H 2 57 GLU HG3 . . 4.320 3.529 3.438 3.573 . 0 0 "[ . 1 . 2]" 1
2125 2 57 GLU HA 2 57 GLU HB3 . . 2.670 2.532 2.439 2.554 . 0 0 "[ . 1 . 2]" 1
2126 2 57 GLU HA 2 57 GLU HG2 . . 3.970 3.763 3.634 3.801 . 0 0 "[ . 1 . 2]" 1
2127 2 57 GLU HA 2 57 GLU HG3 . . 4.040 3.706 3.661 3.893 . 0 0 "[ . 1 . 2]" 1
2128 2 57 GLU HA 2 58 ASN HA . . 4.880 4.529 4.516 4.538 . 0 0 "[ . 1 . 2]" 1
2129 2 57 GLU HA 2 58 ASN HB2 . . 5.500 5.563 5.526 5.591 0.091 8 0 "[ . 1 . 2]" 1
2130 2 57 GLU HA 2 59 PRO QD . . 4.230 3.075 2.966 3.155 . 0 0 "[ . 1 . 2]" 1
2131 2 57 GLU HB3 2 57 GLU HG2 . . 2.680 2.472 2.432 2.607 . 0 0 "[ . 1 . 2]" 1
2132 2 57 GLU HG2 2 58 ASN HA . . 5.370 4.715 4.634 4.794 . 0 0 "[ . 1 . 2]" 1
2133 2 57 GLU HG2 2 58 ASN HB2 . . 4.270 4.209 4.059 4.290 0.020 15 0 "[ . 1 . 2]" 1
2134 2 57 GLU HG2 2 58 ASN HB3 . . 5.500 5.518 5.506 5.530 0.030 18 0 "[ . 1 . 2]" 1
2135 2 57 GLU HG2 2 59 PRO QD . . 5.350 5.139 5.054 5.167 . 0 0 "[ . 1 . 2]" 1
2136 2 57 GLU HG3 2 58 ASN HA . . 5.500 3.796 3.696 4.221 . 0 0 "[ . 1 . 2]" 1
2137 2 57 GLU HG3 2 58 ASN HB2 . . 4.660 4.330 4.193 4.578 . 0 0 "[ . 1 . 2]" 1
2138 2 57 GLU HG3 2 58 ASN HB3 . . 5.410 5.130 4.989 5.394 . 0 0 "[ . 1 . 2]" 1
2139 2 57 GLU HG3 2 59 PRO QD . . 5.350 4.440 4.339 4.830 . 0 0 "[ . 1 . 2]" 1
2140 2 58 ASN HA 2 59 PRO HA . . 4.780 4.650 4.636 4.672 . 0 0 "[ . 1 . 2]" 1
2141 2 58 ASN HA 2 59 PRO QB . . 5.230 4.817 4.789 4.857 . 0 0 "[ . 1 . 2]" 1
2142 2 58 ASN HA 2 59 PRO QD . . 3.000 2.042 2.005 2.097 . 0 0 "[ . 1 . 2]" 1
2143 2 58 ASN HA 2 59 PRO QG . . 4.350 3.921 3.894 3.964 . 0 0 "[ . 1 . 2]" 1
2144 2 58 ASN HA 2 60 ALA MB . . 4.530 4.412 4.225 4.536 0.006 17 0 "[ . 1 . 2]" 1
2145 2 58 ASN HA 2 62 LEU QD . . 5.440 4.641 4.240 4.869 . 0 0 "[ . 1 . 2]" 1
2146 2 58 ASN HB2 2 59 PRO HA . . 5.490 5.343 5.270 5.393 . 0 0 "[ . 1 . 2]" 1
2147 2 58 ASN HB2 2 60 ALA MB . . 5.500 4.964 4.693 5.302 . 0 0 "[ . 1 . 2]" 1
2148 2 58 ASN HB2 2 62 LEU MD1 . . 5.500 5.566 5.527 5.625 0.125 15 0 "[ . 1 . 2]" 1
2149 2 58 ASN HB2 2 62 LEU MD2 . . 5.500 3.667 3.385 4.261 . 0 0 "[ . 1 . 2]" 1
2150 2 58 ASN HB2 2 62 LEU HG . . 5.500 5.314 4.854 5.497 . 0 0 "[ . 1 . 2]" 1
2151 2 58 ASN HB3 2 59 PRO HA . . 5.410 5.118 5.077 5.146 . 0 0 "[ . 1 . 2]" 1
2152 2 58 ASN HB3 2 60 ALA MB . . 5.500 3.621 3.351 4.054 . 0 0 "[ . 1 . 2]" 1
2153 2 58 ASN HB3 2 62 LEU HG . . 5.500 5.412 5.190 5.512 0.012 19 0 "[ . 1 . 2]" 1
2154 2 59 PRO HA 2 60 ALA MB . . 4.420 4.216 4.074 4.314 . 0 0 "[ . 1 . 2]" 1
2155 2 59 PRO HA 2 62 LEU QD . . 3.660 2.218 1.875 2.954 . 0 0 "[ . 1 . 2]" 1
2156 2 59 PRO HA 2 62 LEU HG . . 3.590 3.047 2.648 3.482 . 0 0 "[ . 1 . 2]" 1
2157 2 59 PRO QD 2 60 ALA MB . . 5.350 4.455 4.234 4.625 . 0 0 "[ . 1 . 2]" 1
2158 2 59 PRO QD 2 62 LEU QD . . 4.630 3.890 3.566 4.330 . 0 0 "[ . 1 . 2]" 1
2159 2 60 ALA HA 2 61 ASP HA . . 4.840 4.620 4.574 4.729 . 0 0 "[ . 1 . 2]" 1
2160 2 60 ALA HA 2 61 ASP HB2 . . 5.500 5.504 5.394 5.597 0.097 9 0 "[ . 1 . 2]" 1
2161 2 60 ALA HA 2 63 GLU HG3 . . 5.040 3.435 2.521 5.062 0.022 11 0 "[ . 1 . 2]" 1
2162 2 60 ALA MB 2 61 ASP HA . . 3.960 3.778 3.615 3.904 . 0 0 "[ . 1 . 2]" 1
2163 2 60 ALA MB 2 61 ASP HB2 . . 4.530 3.549 3.304 3.943 . 0 0 "[ . 1 . 2]" 1
2164 2 60 ALA MB 2 61 ASP HB3 . . 5.360 4.848 4.643 5.147 . 0 0 "[ . 1 . 2]" 1
2165 2 61 ASP HA 2 61 ASP HB2 . . 3.000 2.853 2.808 2.931 . 0 0 "[ . 1 . 2]" 1
2166 2 61 ASP HA 2 62 LEU QD . . 5.270 5.075 4.566 5.241 . 0 0 "[ . 1 . 2]" 1
2167 2 61 ASP HA 2 63 GLU HG2 . . 5.500 5.371 4.096 5.659 0.159 10 0 "[ . 1 . 2]" 1
2168 2 61 ASP HA 2 63 GLU HG3 . . 5.500 4.034 3.583 4.411 . 0 0 "[ . 1 . 2]" 1
2169 2 61 ASP HB2 2 62 LEU HA . . 5.190 5.078 4.863 5.197 0.007 4 0 "[ . 1 . 2]" 1
2170 2 61 ASP HB2 2 62 LEU HB3 . . 5.500 5.287 4.945 5.447 . 0 0 "[ . 1 . 2]" 1
2171 2 61 ASP HB2 2 62 LEU QD . . 5.010 4.505 3.936 4.826 . 0 0 "[ . 1 . 2]" 1
2172 2 61 ASP HB2 2 62 LEU HG . . 4.630 4.497 4.266 4.664 0.034 16 0 "[ . 1 . 2]" 1
2173 2 61 ASP HB3 2 62 LEU HA . . 4.010 3.765 3.712 3.873 . 0 0 "[ . 1 . 2]" 1
2174 2 61 ASP HB3 2 62 LEU HG . . 4.730 4.453 4.140 4.758 0.028 19 0 "[ . 1 . 2]" 1
2175 2 62 LEU H 2 62 LEU HB3 . . 3.590 2.720 2.686 2.870 . 0 0 "[ . 1 . 2]" 1
2176 2 62 LEU H 2 62 LEU MD1 . . 5.500 3.373 2.376 3.631 . 0 0 "[ . 1 . 2]" 1
2177 2 62 LEU H 2 62 LEU QD . . 4.600 2.769 2.343 2.904 . 0 0 "[ . 1 . 2]" 1
2178 2 62 LEU H 2 62 LEU MD2 . . 5.500 3.030 2.693 3.555 . 0 0 "[ . 1 . 2]" 1
2179 2 62 LEU HB2 2 62 LEU QD . . 3.090 1.964 1.905 2.101 . 0 0 "[ . 1 . 2]" 1
2180 2 62 LEU HB2 2 63 GLU HG3 . . 5.500 5.504 5.211 5.658 0.158 10 0 "[ . 1 . 2]" 1
2181 2 62 LEU HG 2 63 GLU HG2 . . 4.560 3.968 3.307 4.623 0.063 14 0 "[ . 1 . 2]" 1
2182 2 62 LEU HG 2 63 GLU HG3 . . 5.240 4.232 3.787 5.226 . 0 0 "[ . 1 . 2]" 1
2183 2 63 GLU H 2 63 GLU QB . . 3.230 2.802 2.635 3.435 0.205 11 0 "[ . 1 . 2]" 1
2184 2 63 GLU HA 2 63 GLU HG2 . . 3.910 3.397 2.495 3.983 0.073 1 0 "[ . 1 . 2]" 1
2185 2 63 GLU HA 2 63 GLU HG3 . . 3.720 3.535 3.330 3.686 . 0 0 "[ . 1 . 2]" 1
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