NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
424893 |
2g9o   |
7069 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2g9o
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 1367
_Distance_constraint_stats_list.Viol_count 5407
_Distance_constraint_stats_list.Viol_total 8642.261
_Distance_constraint_stats_list.Viol_max 0.829
_Distance_constraint_stats_list.Viol_rms 0.0250
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0070
_Distance_constraint_stats_list.Viol_average_violations_only 0.0533
_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 2 ASP 2.091 0.089 22 0 "[ . 1 . 2 . 3]"
1 3 SER 5.186 0.135 15 0 "[ . 1 . 2 . 3]"
1 4 THR 7.405 0.167 18 0 "[ . 1 . 2 . 3]"
1 5 ALA 5.212 0.167 18 0 "[ . 1 . 2 . 3]"
1 6 THR 4.341 0.130 30 0 "[ . 1 . 2 . 3]"
1 7 PHE 19.483 0.163 26 0 "[ . 1 . 2 . 3]"
1 8 ILE 12.342 0.157 25 0 "[ . 1 . 2 . 3]"
1 9 ILE 19.036 0.175 29 0 "[ . 1 . 2 . 3]"
1 10 ASP 8.599 0.229 11 0 "[ . 1 . 2 . 3]"
1 11 GLY 3.690 0.199 5 0 "[ . 1 . 2 . 3]"
1 12 MET 11.709 0.265 26 0 "[ . 1 . 2 . 3]"
1 13 HIS 4.259 0.171 14 0 "[ . 1 . 2 . 3]"
1 14 CYS 4.543 0.153 30 0 "[ . 1 . 2 . 3]"
1 15 LYS 5.443 0.149 6 0 "[ . 1 . 2 . 3]"
1 16 SER 3.203 0.132 27 0 "[ . 1 . 2 . 3]"
1 17 CYS 14.693 0.265 26 0 "[ . 1 . 2 . 3]"
1 18 VAL 4.131 0.149 6 0 "[ . 1 . 2 . 3]"
1 19 SER 6.825 0.149 17 0 "[ . 1 . 2 . 3]"
1 20 ASN 9.614 0.152 9 0 "[ . 1 . 2 . 3]"
1 21 ILE 9.292 0.198 1 0 "[ . 1 . 2 . 3]"
1 22 GLU 6.017 0.149 17 0 "[ . 1 . 2 . 3]"
1 23 SER 5.272 0.134 26 0 "[ . 1 . 2 . 3]"
1 24 THR 5.996 0.125 30 0 "[ . 1 . 2 . 3]"
1 25 LEU 5.343 0.151 20 0 "[ . 1 . 2 . 3]"
1 26 SER 6.619 0.151 20 0 "[ . 1 . 2 . 3]"
1 27 ALA 6.915 0.102 3 0 "[ . 1 . 2 . 3]"
1 28 LEU 7.137 0.140 25 0 "[ . 1 . 2 . 3]"
1 30 TYR 5.254 0.165 28 0 "[ . 1 . 2 . 3]"
1 31 VAL 18.166 0.151 30 0 "[ . 1 . 2 . 3]"
1 32 SER 0.970 0.078 28 0 "[ . 1 . 2 . 3]"
1 33 SER 7.737 0.246 29 0 "[ . 1 . 2 . 3]"
1 34 ILE 8.515 0.150 4 0 "[ . 1 . 2 . 3]"
1 35 VAL 5.728 0.123 30 0 "[ . 1 . 2 . 3]"
1 36 VAL 7.039 0.181 24 0 "[ . 1 . 2 . 3]"
1 37 SER 3.466 0.150 23 0 "[ . 1 . 2 . 3]"
1 38 LEU 11.031 0.181 24 0 "[ . 1 . 2 . 3]"
1 39 GLU 9.394 0.220 9 0 "[ . 1 . 2 . 3]"
1 40 ASN 8.410 0.170 21 0 "[ . 1 . 2 . 3]"
1 41 ARG 5.332 0.219 12 0 "[ . 1 . 2 . 3]"
1 42 SER 9.120 0.175 29 0 "[ . 1 . 2 . 3]"
1 43 ALA 7.165 0.123 30 0 "[ . 1 . 2 . 3]"
1 44 ILE 2.538 0.056 16 0 "[ . 1 . 2 . 3]"
1 45 VAL 1.884 0.092 21 0 "[ . 1 . 2 . 3]"
1 46 VAL 3.757 0.246 29 0 "[ . 1 . 2 . 3]"
1 47 TYR 7.800 0.151 30 0 "[ . 1 . 2 . 3]"
1 48 ASN 4.969 0.301 28 0 "[ . 1 . 2 . 3]"
1 49 ALA 0.976 0.071 1 0 "[ . 1 . 2 . 3]"
1 50 SER 1.801 0.165 28 0 "[ . 1 . 2 . 3]"
1 51 SER 1.509 0.137 30 0 "[ . 1 . 2 . 3]"
1 52 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 53 THR 1.242 0.122 12 0 "[ . 1 . 2 . 3]"
1 54 PRO 1.557 0.129 24 0 "[ . 1 . 2 . 3]"
1 55 GLU 5.813 0.829 17 5 "[ . 1* . + ** .- 3]"
1 56 SER 10.089 0.829 17 5 "[ . 1* . + ** .- 3]"
1 57 LEU 11.802 0.163 26 0 "[ . 1 . 2 . 3]"
1 58 ARG 10.798 0.217 5 0 "[ . 1 . 2 . 3]"
1 59 LYS 8.240 0.171 11 0 "[ . 1 . 2 . 3]"
1 60 ALA 4.427 0.129 10 0 "[ . 1 . 2 . 3]"
1 61 ILE 9.121 0.124 8 0 "[ . 1 . 2 . 3]"
1 62 GLU 4.024 0.107 4 0 "[ . 1 . 2 . 3]"
1 63 ALA 4.888 0.124 8 0 "[ . 1 . 2 . 3]"
1 64 VAL 19.361 0.149 26 0 "[ . 1 . 2 . 3]"
1 65 SER 11.593 0.278 12 0 "[ . 1 . 2 . 3]"
1 66 PRO 6.202 0.149 26 0 "[ . 1 . 2 . 3]"
1 67 GLY 0.412 0.136 2 0 "[ . 1 . 2 . 3]"
1 68 LEU 3.976 0.278 12 0 "[ . 1 . 2 . 3]"
1 69 TYR 15.369 0.179 14 0 "[ . 1 . 2 . 3]"
1 70 ARG 16.044 0.413 13 0 "[ . 1 . 2 . 3]"
1 71 VAL 8.234 0.413 13 0 "[ . 1 . 2 . 3]"
1 72 SER 5.785 0.158 30 0 "[ . 1 . 2 . 3]"
1 73 ILE 7.499 0.164 30 0 "[ . 1 . 2 . 3]"
1 74 THR 3.361 0.246 16 0 "[ . 1 . 2 . 3]"
1 75 SER 4.105 0.203 26 0 "[ . 1 . 2 . 3]"
1 76 GLU 6.939 0.373 9 0 "[ . 1 . 2 . 3]"
1 77 VAL 8.224 0.373 9 0 "[ . 1 . 2 . 3]"
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 2 ASP H 1 2 ASP HA . . 2.850 2.881 2.784 2.939 0.089 22 0 "[ . 1 . 2 . 3]" 1
2 1 2 ASP H 1 2 ASP HB2 . . 4.150 3.260 2.321 3.813 . 0 0 "[ . 1 . 2 . 3]" 1
3 1 2 ASP H 1 2 ASP HB3 . . 3.500 3.109 2.594 3.574 0.074 12 0 "[ . 1 . 2 . 3]" 1
4 1 2 ASP H 1 3 SER H . . 5.350 4.514 4.294 4.674 . 0 0 "[ . 1 . 2 . 3]" 1
5 1 2 ASP HA 1 2 ASP HB3 . . 2.400 2.356 2.208 2.472 0.072 8 0 "[ . 1 . 2 . 3]" 1
6 1 2 ASP HA 1 3 SER H . . 3.130 2.360 2.078 2.754 . 0 0 "[ . 1 . 2 . 3]" 1
7 1 2 ASP HB2 1 3 SER H . . 3.790 2.767 1.893 3.797 0.007 10 0 "[ . 1 . 2 . 3]" 1
8 1 2 ASP HB2 1 46 VAL MG1 . . 3.520 2.685 2.225 3.193 . 0 0 "[ . 1 . 2 . 3]" 1
9 1 2 ASP HB2 1 47 TYR H . . 5.220 4.350 3.240 5.272 0.052 10 0 "[ . 1 . 2 . 3]" 1
10 1 2 ASP HB3 1 3 SER H . . 4.310 3.276 2.224 4.025 . 0 0 "[ . 1 . 2 . 3]" 1
11 1 2 ASP HB3 1 46 VAL MG1 . . 3.730 3.389 2.521 3.768 0.038 22 0 "[ . 1 . 2 . 3]" 1
12 1 3 SER H 1 3 SER HB3 . . 3.550 2.693 2.425 3.604 0.054 1 0 "[ . 1 . 2 . 3]" 1
13 1 3 SER H 1 4 THR H . . 5.000 4.391 4.280 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
14 1 3 SER H 1 46 VAL MG1 . . 4.310 3.965 3.254 4.327 0.017 4 0 "[ . 1 . 2 . 3]" 1
15 1 3 SER H 1 47 TYR H . . 4.320 3.390 2.955 3.781 . 0 0 "[ . 1 . 2 . 3]" 1
16 1 3 SER H 1 47 TYR QD . . 5.170 4.600 4.269 4.813 . 0 0 "[ . 1 . 2 . 3]" 1
17 1 3 SER H 1 47 TYR QE . . 5.500 5.170 4.916 5.470 . 0 0 "[ . 1 . 2 . 3]" 1
18 1 3 SER H 1 49 ALA MB . . 4.670 4.672 4.441 4.741 0.071 1 0 "[ . 1 . 2 . 3]" 1
19 1 3 SER HA 1 4 THR H . . 2.910 2.587 2.366 2.716 . 0 0 "[ . 1 . 2 . 3]" 1
20 1 3 SER HA 1 4 THR HA . . 5.330 4.634 4.547 4.693 . 0 0 "[ . 1 . 2 . 3]" 1
21 1 3 SER HA 1 47 TYR QE . . 5.370 5.127 4.475 5.419 0.049 6 0 "[ . 1 . 2 . 3]" 1
22 1 3 SER HB2 1 4 THR H . . 3.600 3.673 3.539 3.735 0.135 15 0 "[ . 1 . 2 . 3]" 1
23 1 3 SER HB2 1 47 TYR QD . . 5.190 4.716 3.030 4.960 . 0 0 "[ . 1 . 2 . 3]" 1
24 1 3 SER HB2 1 47 TYR QE . . 4.090 4.099 3.365 4.174 0.084 28 0 "[ . 1 . 2 . 3]" 1
25 1 3 SER HB2 1 48 ASN HA . . 5.160 4.616 3.264 5.159 . 0 0 "[ . 1 . 2 . 3]" 1
26 1 3 SER HB2 1 49 ALA MB . . 4.150 3.527 2.580 4.171 0.021 4 0 "[ . 1 . 2 . 3]" 1
27 1 3 SER HB3 1 4 THR H . . 4.060 3.127 2.687 3.483 . 0 0 "[ . 1 . 2 . 3]" 1
28 1 3 SER HB3 1 47 TYR QE . . 4.160 3.179 2.846 3.315 . 0 0 "[ . 1 . 2 . 3]" 1
29 1 3 SER HB3 1 48 ASN HA . . 4.390 4.418 4.258 4.506 0.116 8 0 "[ . 1 . 2 . 3]" 1
30 1 3 SER HB3 1 49 ALA MB . . 3.850 3.420 2.654 3.864 0.014 21 0 "[ . 1 . 2 . 3]" 1
31 1 4 THR H 1 4 THR HB . . 3.260 3.036 2.906 3.293 0.033 30 0 "[ . 1 . 2 . 3]" 1
32 1 4 THR H 1 4 THR MG . . 4.380 3.871 3.044 4.042 . 0 0 "[ . 1 . 2 . 3]" 1
33 1 4 THR H 1 5 ALA H . . 4.690 4.275 4.186 4.386 . 0 0 "[ . 1 . 2 . 3]" 1
34 1 4 THR H 1 5 ALA HA . . 4.800 4.918 4.877 4.967 0.167 18 0 "[ . 1 . 2 . 3]" 1
35 1 4 THR H 1 47 TYR QE . . 4.780 3.310 2.739 3.702 . 0 0 "[ . 1 . 2 . 3]" 1
36 1 4 THR HA 1 4 THR MG . . 3.610 2.720 2.564 3.210 . 0 0 "[ . 1 . 2 . 3]" 1
37 1 4 THR HA 1 5 ALA H . . 2.910 2.203 2.083 2.381 . 0 0 "[ . 1 . 2 . 3]" 1
38 1 4 THR HA 1 5 ALA MB . . 4.880 3.912 3.808 3.982 . 0 0 "[ . 1 . 2 . 3]" 1
39 1 4 THR HA 1 44 ILE MG . . 5.500 4.831 4.556 5.154 . 0 0 "[ . 1 . 2 . 3]" 1
40 1 4 THR HA 1 46 VAL HA . . 3.340 2.250 2.138 2.426 . 0 0 "[ . 1 . 2 . 3]" 1
41 1 4 THR HA 1 46 VAL HB . . 5.500 5.254 5.129 5.432 . 0 0 "[ . 1 . 2 . 3]" 1
42 1 4 THR HA 1 46 VAL MG1 . . 4.000 3.892 3.732 4.053 0.053 15 0 "[ . 1 . 2 . 3]" 1
43 1 4 THR HA 1 46 VAL MG2 . . 4.330 3.720 3.506 3.930 . 0 0 "[ . 1 . 2 . 3]" 1
44 1 4 THR HA 1 47 TYR H . . 4.360 2.889 2.619 3.183 . 0 0 "[ . 1 . 2 . 3]" 1
45 1 4 THR HA 1 47 TYR QD . . 3.980 2.903 2.452 3.228 . 0 0 "[ . 1 . 2 . 3]" 1
46 1 4 THR HA 1 47 TYR QE . . 4.150 3.322 3.002 3.787 . 0 0 "[ . 1 . 2 . 3]" 1
47 1 4 THR HB 1 5 ALA H . . 4.280 4.062 3.882 4.162 . 0 0 "[ . 1 . 2 . 3]" 1
48 1 4 THR HB 1 46 VAL MG1 . . 4.220 4.145 3.253 4.290 0.070 4 0 "[ . 1 . 2 . 3]" 1
49 1 4 THR MG 1 5 ALA H . . 3.690 2.355 2.133 2.781 . 0 0 "[ . 1 . 2 . 3]" 1
50 1 4 THR MG 1 5 ALA HA . . 3.810 3.178 2.996 3.422 . 0 0 "[ . 1 . 2 . 3]" 1
51 1 4 THR MG 1 44 ILE MG . . 2.700 2.495 2.147 2.725 0.025 15 0 "[ . 1 . 2 . 3]" 1
52 1 4 THR MG 1 45 VAL HB . . 5.500 4.969 4.697 5.592 0.092 21 0 "[ . 1 . 2 . 3]" 1
53 1 4 THR MG 1 46 VAL HA . . 4.790 3.534 3.212 4.235 . 0 0 "[ . 1 . 2 . 3]" 1
54 1 4 THR MG 1 46 VAL MG2 . . 3.490 2.848 2.427 3.521 0.031 15 0 "[ . 1 . 2 . 3]" 1
55 1 4 THR MG 1 47 TYR QD . . 5.500 4.927 4.627 5.333 . 0 0 "[ . 1 . 2 . 3]" 1
56 1 4 THR MG 1 47 TYR QE . . 5.500 4.850 4.582 5.324 . 0 0 "[ . 1 . 2 . 3]" 1
57 1 5 ALA H 1 6 THR H . . 4.980 4.366 4.320 4.420 . 0 0 "[ . 1 . 2 . 3]" 1
58 1 5 ALA H 1 7 PHE QD . . 5.500 5.331 5.128 5.502 0.002 11 0 "[ . 1 . 2 . 3]" 1
59 1 5 ALA H 1 7 PHE QE . . 5.500 3.833 3.560 4.048 . 0 0 "[ . 1 . 2 . 3]" 1
60 1 5 ALA H 1 44 ILE MG . . 5.160 3.953 3.555 4.410 . 0 0 "[ . 1 . 2 . 3]" 1
61 1 5 ALA H 1 45 VAL H . . 3.970 3.064 2.844 3.248 . 0 0 "[ . 1 . 2 . 3]" 1
62 1 5 ALA H 1 45 VAL HB . . 4.390 3.594 3.376 3.786 . 0 0 "[ . 1 . 2 . 3]" 1
63 1 5 ALA H 1 46 VAL HA . . 4.200 3.729 3.620 3.853 . 0 0 "[ . 1 . 2 . 3]" 1
64 1 5 ALA H 1 46 VAL MG2 . . 5.230 4.330 4.084 4.601 . 0 0 "[ . 1 . 2 . 3]" 1
65 1 5 ALA H 1 47 TYR QD . . 4.180 3.675 3.411 3.916 . 0 0 "[ . 1 . 2 . 3]" 1
66 1 5 ALA H 1 47 TYR QE . . 3.950 3.590 3.298 3.968 0.018 13 0 "[ . 1 . 2 . 3]" 1
67 1 5 ALA H 1 57 LEU MD1 . . 5.500 3.794 3.511 3.976 . 0 0 "[ . 1 . 2 . 3]" 1
68 1 5 ALA HA 1 6 THR H . . 2.790 2.354 2.237 2.450 . 0 0 "[ . 1 . 2 . 3]" 1
69 1 5 ALA MB 1 6 THR H . . 3.630 2.482 2.370 2.629 . 0 0 "[ . 1 . 2 . 3]" 1
70 1 5 ALA MB 1 6 THR HA . . 5.120 4.139 4.066 4.235 . 0 0 "[ . 1 . 2 . 3]" 1
71 1 5 ALA MB 1 7 PHE QD . . 3.740 3.794 3.773 3.808 0.068 13 0 "[ . 1 . 2 . 3]" 1
72 1 5 ALA MB 1 7 PHE QE . . 3.490 2.195 2.123 2.294 . 0 0 "[ . 1 . 2 . 3]" 1
73 1 5 ALA MB 1 45 VAL H . . 5.090 4.140 3.935 4.356 . 0 0 "[ . 1 . 2 . 3]" 1
74 1 5 ALA MB 1 45 VAL HB . . 4.000 3.527 3.135 3.805 . 0 0 "[ . 1 . 2 . 3]" 1
75 1 5 ALA MB 1 47 TYR QD . . 4.310 3.713 3.470 3.947 . 0 0 "[ . 1 . 2 . 3]" 1
76 1 5 ALA MB 1 47 TYR QE . . 3.300 2.511 2.227 2.974 . 0 0 "[ . 1 . 2 . 3]" 1
77 1 5 ALA MB 1 54 PRO HA . . 4.350 3.305 2.958 3.761 . 0 0 "[ . 1 . 2 . 3]" 1
78 1 5 ALA MB 1 54 PRO HB2 . . 4.540 2.846 2.644 3.084 . 0 0 "[ . 1 . 2 . 3]" 1
79 1 5 ALA MB 1 54 PRO HB3 . . 4.300 2.263 2.086 2.590 . 0 0 "[ . 1 . 2 . 3]" 1
80 1 5 ALA MB 1 54 PRO HG3 . . 4.530 3.832 3.592 4.208 . 0 0 "[ . 1 . 2 . 3]" 1
81 1 5 ALA MB 1 57 LEU MD1 . . 4.340 2.487 2.241 2.942 . 0 0 "[ . 1 . 2 . 3]" 1
82 1 5 ALA MB 1 73 ILE HA . . 5.500 5.158 4.836 5.475 . 0 0 "[ . 1 . 2 . 3]" 1
83 1 6 THR H 1 6 THR HB . . 3.260 2.692 2.604 2.745 . 0 0 "[ . 1 . 2 . 3]" 1
84 1 6 THR H 1 6 THR MG . . 4.170 3.869 3.013 3.929 . 0 0 "[ . 1 . 2 . 3]" 1
85 1 6 THR H 1 7 PHE H . . 4.550 4.371 4.328 4.424 . 0 0 "[ . 1 . 2 . 3]" 1
86 1 6 THR H 1 7 PHE QD . . 5.110 4.488 4.292 4.663 . 0 0 "[ . 1 . 2 . 3]" 1
87 1 6 THR H 1 73 ILE MG . . 4.440 3.191 2.899 3.461 . 0 0 "[ . 1 . 2 . 3]" 1
88 1 6 THR HA 1 6 THR MG . . 3.350 2.346 2.258 3.155 . 0 0 "[ . 1 . 2 . 3]" 1
89 1 6 THR HA 1 7 PHE H . . 2.950 2.112 2.053 2.175 . 0 0 "[ . 1 . 2 . 3]" 1
90 1 6 THR HA 1 7 PHE HB2 . . 4.820 4.596 4.383 4.774 . 0 0 "[ . 1 . 2 . 3]" 1
91 1 6 THR HA 1 7 PHE QD . . 4.000 3.119 2.871 3.353 . 0 0 "[ . 1 . 2 . 3]" 1
92 1 6 THR HA 1 7 PHE QE . . 4.820 4.100 3.931 4.217 . 0 0 "[ . 1 . 2 . 3]" 1
93 1 6 THR HA 1 43 ALA H . . 4.890 4.628 4.499 4.823 . 0 0 "[ . 1 . 2 . 3]" 1
94 1 6 THR HA 1 43 ALA MB . . 5.270 4.571 4.408 4.817 . 0 0 "[ . 1 . 2 . 3]" 1
95 1 6 THR HA 1 44 ILE HA . . 3.370 2.439 2.236 2.555 . 0 0 "[ . 1 . 2 . 3]" 1
96 1 6 THR HA 1 44 ILE HB . . 5.500 5.337 5.158 5.460 . 0 0 "[ . 1 . 2 . 3]" 1
97 1 6 THR HA 1 44 ILE HG12 . . 5.070 3.552 3.122 3.820 . 0 0 "[ . 1 . 2 . 3]" 1
98 1 6 THR HA 1 44 ILE MG . . 4.500 3.860 3.578 4.025 . 0 0 "[ . 1 . 2 . 3]" 1
99 1 6 THR HA 1 45 VAL H . . 4.230 3.337 3.112 3.524 . 0 0 "[ . 1 . 2 . 3]" 1
100 1 6 THR HA 1 45 VAL HB . . 5.500 4.930 4.667 5.240 . 0 0 "[ . 1 . 2 . 3]" 1
101 1 6 THR HB 1 7 PHE H . . 3.830 3.905 3.874 3.960 0.130 30 0 "[ . 1 . 2 . 3]" 1
102 1 6 THR HB 1 44 ILE HG12 . . 5.500 4.408 3.351 4.648 . 0 0 "[ . 1 . 2 . 3]" 1
103 1 6 THR HB 1 73 ILE MG . . 4.200 4.001 3.811 4.258 0.058 30 0 "[ . 1 . 2 . 3]" 1
104 1 6 THR MG 1 7 PHE H . . 3.280 2.382 2.300 2.710 . 0 0 "[ . 1 . 2 . 3]" 1
105 1 6 THR MG 1 7 PHE HA . . 4.530 3.674 3.307 3.750 . 0 0 "[ . 1 . 2 . 3]" 1
106 1 6 THR MG 1 7 PHE HB2 . . 5.500 4.732 4.612 4.955 . 0 0 "[ . 1 . 2 . 3]" 1
107 1 6 THR MG 1 7 PHE HB3 . . 5.500 5.269 5.178 5.324 . 0 0 "[ . 1 . 2 . 3]" 1
108 1 6 THR MG 1 7 PHE QD . . 4.980 4.413 4.277 4.650 . 0 0 "[ . 1 . 2 . 3]" 1
109 1 6 THR MG 1 7 PHE QE . . 5.500 5.524 5.351 5.551 0.051 19 0 "[ . 1 . 2 . 3]" 1
110 1 6 THR MG 1 42 SER HA . . 5.480 4.791 4.461 5.514 0.034 30 0 "[ . 1 . 2 . 3]" 1
111 1 6 THR MG 1 43 ALA H . . 5.210 3.639 3.323 4.615 . 0 0 "[ . 1 . 2 . 3]" 1
112 1 6 THR MG 1 73 ILE HA . . 4.630 4.617 3.147 4.713 0.083 22 0 "[ . 1 . 2 . 3]" 1
113 1 7 PHE H 1 7 PHE HB2 . . 3.660 2.910 2.799 3.024 . 0 0 "[ . 1 . 2 . 3]" 1
114 1 7 PHE H 1 7 PHE QD . . 3.420 2.817 2.565 3.195 . 0 0 "[ . 1 . 2 . 3]" 1
115 1 7 PHE H 1 7 PHE QE . . 5.240 4.682 4.525 4.909 . 0 0 "[ . 1 . 2 . 3]" 1
116 1 7 PHE H 1 42 SER HA . . 4.770 4.764 4.642 4.814 0.044 3 0 "[ . 1 . 2 . 3]" 1
117 1 7 PHE H 1 43 ALA H . . 3.850 2.987 2.867 3.134 . 0 0 "[ . 1 . 2 . 3]" 1
118 1 7 PHE H 1 43 ALA MB . . 4.580 3.609 3.417 3.899 . 0 0 "[ . 1 . 2 . 3]" 1
119 1 7 PHE H 1 45 VAL H . . 5.500 4.778 4.461 5.042 . 0 0 "[ . 1 . 2 . 3]" 1
120 1 7 PHE H 1 61 ILE MD . . 5.300 4.297 4.209 4.439 . 0 0 "[ . 1 . 2 . 3]" 1
121 1 7 PHE HA 1 7 PHE QD . . 3.750 3.108 2.906 3.266 . 0 0 "[ . 1 . 2 . 3]" 1
122 1 7 PHE HA 1 7 PHE QE . . 4.970 4.796 4.627 4.912 . 0 0 "[ . 1 . 2 . 3]" 1
123 1 7 PHE HA 1 8 ILE H . . 3.060 2.242 2.181 2.296 . 0 0 "[ . 1 . 2 . 3]" 1
124 1 7 PHE HA 1 8 ILE HB . . 5.060 4.233 4.093 4.455 . 0 0 "[ . 1 . 2 . 3]" 1
125 1 7 PHE HA 1 8 ILE MG . . 5.500 3.728 3.582 3.975 . 0 0 "[ . 1 . 2 . 3]" 1
126 1 7 PHE HA 1 71 VAL MG1 . . 4.960 3.840 3.564 4.125 . 0 0 "[ . 1 . 2 . 3]" 1
127 1 7 PHE HA 1 72 SER H . . 5.090 4.348 4.118 4.554 . 0 0 "[ . 1 . 2 . 3]" 1
128 1 7 PHE HA 1 73 ILE HA . . 3.350 2.380 2.229 2.556 . 0 0 "[ . 1 . 2 . 3]" 1
129 1 7 PHE HA 1 73 ILE MG . . 5.160 4.042 3.904 4.172 . 0 0 "[ . 1 . 2 . 3]" 1
130 1 7 PHE HA 1 74 THR H . . 3.740 2.976 2.698 3.537 . 0 0 "[ . 1 . 2 . 3]" 1
131 1 7 PHE HB2 1 8 ILE H . . 4.480 3.809 3.636 3.993 . 0 0 "[ . 1 . 2 . 3]" 1
132 1 7 PHE HB2 1 8 ILE HA . . 5.150 4.545 4.436 4.620 . 0 0 "[ . 1 . 2 . 3]" 1
133 1 7 PHE HB2 1 8 ILE MG . . 5.500 5.528 5.450 5.566 0.066 13 0 "[ . 1 . 2 . 3]" 1
134 1 7 PHE HB2 1 9 ILE MD . . 5.090 3.545 3.154 4.066 . 0 0 "[ . 1 . 2 . 3]" 1
135 1 7 PHE HB2 1 9 ILE HG12 . . 5.750 5.830 5.771 5.876 0.126 29 0 "[ . 1 . 2 . 3]" 1
136 1 7 PHE HB2 1 42 SER HA . . 5.480 4.790 4.682 4.994 . 0 0 "[ . 1 . 2 . 3]" 1
137 1 7 PHE HB2 1 43 ALA H . . 4.440 3.617 3.470 3.734 . 0 0 "[ . 1 . 2 . 3]" 1
138 1 7 PHE HB2 1 43 ALA MB . . 4.760 3.035 2.888 3.206 . 0 0 "[ . 1 . 2 . 3]" 1
139 1 7 PHE HB2 1 58 ARG HA . . 4.970 4.564 4.403 4.843 . 0 0 "[ . 1 . 2 . 3]" 1
140 1 7 PHE HB2 1 61 ILE MD . . 4.990 2.129 2.065 2.203 . 0 0 "[ . 1 . 2 . 3]" 1
141 1 7 PHE HB2 1 71 VAL MG1 . . 4.390 3.327 3.080 3.633 . 0 0 "[ . 1 . 2 . 3]" 1
142 1 7 PHE HB2 1 73 ILE HA . . 5.390 5.174 5.014 5.411 0.021 29 0 "[ . 1 . 2 . 3]" 1
143 1 7 PHE HB3 1 8 ILE H . . 3.600 2.913 2.701 3.177 . 0 0 "[ . 1 . 2 . 3]" 1
144 1 7 PHE HB3 1 9 ILE MD . . 5.300 3.986 3.365 4.641 . 0 0 "[ . 1 . 2 . 3]" 1
145 1 7 PHE HB3 1 43 ALA H . . 5.220 4.947 4.839 5.080 . 0 0 "[ . 1 . 2 . 3]" 1
146 1 7 PHE HB3 1 43 ALA MB . . 4.580 4.580 4.426 4.664 0.084 3 0 "[ . 1 . 2 . 3]" 1
147 1 7 PHE HB3 1 61 ILE MD . . 5.050 2.500 2.308 2.685 . 0 0 "[ . 1 . 2 . 3]" 1
148 1 7 PHE HB3 1 61 ILE MG . . 5.450 4.301 3.928 4.556 . 0 0 "[ . 1 . 2 . 3]" 1
149 1 7 PHE HB3 1 71 VAL HA . . 5.500 4.681 4.337 5.080 . 0 0 "[ . 1 . 2 . 3]" 1
150 1 7 PHE HB3 1 71 VAL MG1 . . 3.520 2.312 2.129 2.569 . 0 0 "[ . 1 . 2 . 3]" 1
151 1 7 PHE HB3 1 72 SER H . . 5.460 3.955 3.670 4.173 . 0 0 "[ . 1 . 2 . 3]" 1
152 1 7 PHE HB3 1 73 ILE H . . 5.550 5.604 5.561 5.645 0.095 26 0 "[ . 1 . 2 . 3]" 1
153 1 7 PHE HB3 1 73 ILE HA . . 5.030 4.110 3.895 4.495 . 0 0 "[ . 1 . 2 . 3]" 1
154 1 7 PHE QD 1 8 ILE H . . 5.230 4.322 4.163 4.515 . 0 0 "[ . 1 . 2 . 3]" 1
155 1 7 PHE QD 1 43 ALA H . . 4.860 4.609 4.413 4.750 . 0 0 "[ . 1 . 2 . 3]" 1
156 1 7 PHE QD 1 43 ALA MB . . 3.920 3.360 3.026 3.723 . 0 0 "[ . 1 . 2 . 3]" 1
157 1 7 PHE QD 1 44 ILE H . . 5.500 5.503 5.355 5.548 0.048 4 0 "[ . 1 . 2 . 3]" 1
158 1 7 PHE QD 1 44 ILE HA . . 5.000 4.135 3.874 4.432 . 0 0 "[ . 1 . 2 . 3]" 1
159 1 7 PHE QD 1 45 VAL H . . 4.740 3.741 3.529 3.938 . 0 0 "[ . 1 . 2 . 3]" 1
160 1 7 PHE QD 1 45 VAL HB . . 3.480 3.466 3.297 3.521 0.041 15 0 "[ . 1 . 2 . 3]" 1
161 1 7 PHE QD 1 45 VAL MG1 . . 5.080 4.441 4.335 4.527 . 0 0 "[ . 1 . 2 . 3]" 1
162 1 7 PHE QD 1 45 VAL MG2 . . 3.300 2.250 2.138 2.359 . 0 0 "[ . 1 . 2 . 3]" 1
163 1 7 PHE QD 1 57 LEU HB2 . . 4.340 4.275 4.191 4.344 0.004 2 0 "[ . 1 . 2 . 3]" 1
164 1 7 PHE QD 1 57 LEU HB3 . . 4.550 4.265 4.140 4.432 . 0 0 "[ . 1 . 2 . 3]" 1
165 1 7 PHE QD 1 57 LEU MD1 . . 3.770 3.910 3.885 3.933 0.163 26 0 "[ . 1 . 2 . 3]" 1
166 1 7 PHE QD 1 58 ARG H . . 4.110 3.985 3.792 4.155 0.045 11 0 "[ . 1 . 2 . 3]" 1
167 1 7 PHE QD 1 58 ARG HA . . 3.860 3.107 2.808 3.397 . 0 0 "[ . 1 . 2 . 3]" 1
168 1 7 PHE QD 1 58 ARG HB3 . . 4.090 4.062 3.083 4.184 0.094 5 0 "[ . 1 . 2 . 3]" 1
169 1 7 PHE QD 1 61 ILE MD . . 3.870 2.840 2.686 3.012 . 0 0 "[ . 1 . 2 . 3]" 1
170 1 7 PHE QD 1 71 VAL MG1 . . 3.410 2.890 2.563 3.152 . 0 0 "[ . 1 . 2 . 3]" 1
171 1 7 PHE QD 1 72 SER H . . 5.030 4.832 4.542 5.062 0.032 6 0 "[ . 1 . 2 . 3]" 1
172 1 7 PHE QD 1 72 SER HA . . 5.500 4.856 4.102 5.299 . 0 0 "[ . 1 . 2 . 3]" 1
173 1 7 PHE QD 1 73 ILE H . . 4.770 4.608 4.075 4.814 0.044 9 0 "[ . 1 . 2 . 3]" 1
174 1 7 PHE QD 1 73 ILE HA . . 3.660 3.465 3.180 3.681 0.021 16 0 "[ . 1 . 2 . 3]" 1
175 1 7 PHE QD 1 73 ILE HB . . 5.070 5.067 4.954 5.100 0.030 10 0 "[ . 1 . 2 . 3]" 1
176 1 7 PHE QD 1 73 ILE HG12 . . 4.120 2.595 2.300 4.153 0.033 30 0 "[ . 1 . 2 . 3]" 1
177 1 7 PHE QD 1 73 ILE HG13 . . 3.790 3.024 2.658 3.446 . 0 0 "[ . 1 . 2 . 3]" 1
178 1 7 PHE QD 1 73 ILE MG . . 4.570 4.139 3.659 4.317 . 0 0 "[ . 1 . 2 . 3]" 1
179 1 7 PHE QE 1 45 VAL H . . 4.810 3.599 3.334 3.903 . 0 0 "[ . 1 . 2 . 3]" 1
180 1 7 PHE QE 1 45 VAL HB . . 3.430 2.338 2.200 2.498 . 0 0 "[ . 1 . 2 . 3]" 1
181 1 7 PHE QE 1 45 VAL MG1 . . 4.580 3.709 3.599 3.809 . 0 0 "[ . 1 . 2 . 3]" 1
182 1 7 PHE QE 1 54 PRO HA . . 3.940 3.889 3.510 4.069 0.129 24 0 "[ . 1 . 2 . 3]" 1
183 1 7 PHE QE 1 54 PRO HB3 . . 4.280 3.903 3.620 4.163 . 0 0 "[ . 1 . 2 . 3]" 1
184 1 7 PHE QE 1 55 GLU H . . 5.080 4.744 4.284 5.097 0.017 19 0 "[ . 1 . 2 . 3]" 1
185 1 7 PHE QE 1 55 GLU HA . . 5.400 3.770 2.829 4.257 . 0 0 "[ . 1 . 2 . 3]" 1
186 1 7 PHE QE 1 57 LEU HB3 . . 3.780 3.383 3.181 3.643 . 0 0 "[ . 1 . 2 . 3]" 1
187 1 7 PHE QE 1 57 LEU MD1 . . 4.020 2.245 2.157 2.340 . 0 0 "[ . 1 . 2 . 3]" 1
188 1 7 PHE QE 1 58 ARG H . . 3.930 2.894 2.639 3.092 . 0 0 "[ . 1 . 2 . 3]" 1
189 1 7 PHE QE 1 58 ARG HA . . 4.040 3.882 3.662 4.040 . 0 0 "[ . 1 . 2 . 3]" 1
190 1 7 PHE QE 1 58 ARG HB3 . . 3.650 3.543 2.388 3.733 0.083 28 0 "[ . 1 . 2 . 3]" 1
191 1 7 PHE QE 1 61 ILE MD . . 4.490 4.049 3.855 4.194 . 0 0 "[ . 1 . 2 . 3]" 1
192 1 7 PHE QE 1 73 ILE HA . . 4.810 4.625 4.265 4.860 0.050 29 0 "[ . 1 . 2 . 3]" 1
193 1 7 PHE QE 1 73 ILE HB . . 5.500 5.238 4.944 5.379 . 0 0 "[ . 1 . 2 . 3]" 1
194 1 7 PHE QE 1 73 ILE MD . . 3.360 2.602 2.178 2.935 . 0 0 "[ . 1 . 2 . 3]" 1
195 1 7 PHE QE 1 73 ILE HG12 . . 4.300 2.462 2.192 3.044 . 0 0 "[ . 1 . 2 . 3]" 1
196 1 7 PHE QE 1 73 ILE HG13 . . 3.690 3.380 2.353 3.734 0.044 1 0 "[ . 1 . 2 . 3]" 1
197 1 7 PHE QE 1 73 ILE MG . . 4.030 3.934 3.095 4.101 0.071 30 0 "[ . 1 . 2 . 3]" 1
198 1 8 ILE H 1 8 ILE HB . . 3.450 3.010 2.907 3.166 . 0 0 "[ . 1 . 2 . 3]" 1
199 1 8 ILE H 1 8 ILE HG12 . . 4.760 4.620 4.557 4.708 . 0 0 "[ . 1 . 2 . 3]" 1
200 1 8 ILE H 1 8 ILE HG13 . . 4.470 4.542 4.519 4.575 0.105 20 0 "[ . 1 . 2 . 3]" 1
201 1 8 ILE H 1 8 ILE MG . . 4.190 2.256 2.127 2.381 . 0 0 "[ . 1 . 2 . 3]" 1
202 1 8 ILE H 1 71 VAL HA . . 4.920 4.197 4.021 4.385 . 0 0 "[ . 1 . 2 . 3]" 1
203 1 8 ILE H 1 71 VAL MG1 . . 3.770 3.302 2.731 3.647 . 0 0 "[ . 1 . 2 . 3]" 1
204 1 8 ILE H 1 72 SER H . . 3.920 2.695 2.571 2.945 . 0 0 "[ . 1 . 2 . 3]" 1
205 1 8 ILE H 1 73 ILE HA . . 5.230 3.712 3.544 3.971 . 0 0 "[ . 1 . 2 . 3]" 1
206 1 8 ILE H 1 74 THR H . . 4.430 4.004 3.158 4.384 . 0 0 "[ . 1 . 2 . 3]" 1
207 1 8 ILE HA 1 8 ILE MD . . 3.850 3.543 3.435 3.630 . 0 0 "[ . 1 . 2 . 3]" 1
208 1 8 ILE HA 1 8 ILE MG . . 3.500 3.281 3.247 3.304 . 0 0 "[ . 1 . 2 . 3]" 1
209 1 8 ILE HA 1 9 ILE H . . 2.780 2.098 2.016 2.160 . 0 0 "[ . 1 . 2 . 3]" 1
210 1 8 ILE HA 1 9 ILE MD . . 5.130 2.372 2.264 2.475 . 0 0 "[ . 1 . 2 . 3]" 1
211 1 8 ILE HA 1 9 ILE HG12 . . 5.050 5.133 5.084 5.207 0.157 25 0 "[ . 1 . 2 . 3]" 1
212 1 8 ILE HA 1 42 SER H . . 4.710 4.699 4.531 4.780 0.070 6 0 "[ . 1 . 2 . 3]" 1
213 1 8 ILE HA 1 42 SER HA . . 3.180 2.193 2.075 2.289 . 0 0 "[ . 1 . 2 . 3]" 1
214 1 8 ILE HB 1 9 ILE H . . 5.090 4.171 4.098 4.244 . 0 0 "[ . 1 . 2 . 3]" 1
215 1 8 ILE HB 1 42 SER HA . . 4.470 3.944 3.760 4.189 . 0 0 "[ . 1 . 2 . 3]" 1
216 1 8 ILE HB 1 42 SER HB3 . . 3.040 2.556 2.250 2.941 . 0 0 "[ . 1 . 2 . 3]" 1
217 1 8 ILE HB 1 72 SER H . . 5.040 5.094 5.054 5.147 0.107 8 0 "[ . 1 . 2 . 3]" 1
218 1 8 ILE HB 1 74 THR H . . 4.480 4.515 3.910 4.595 0.115 12 0 "[ . 1 . 2 . 3]" 1
219 1 8 ILE HB 1 74 THR MG . . 4.930 2.822 2.159 4.123 . 0 0 "[ . 1 . 2 . 3]" 1
220 1 8 ILE MD 1 9 ILE H . . 4.650 4.130 4.016 4.204 . 0 0 "[ . 1 . 2 . 3]" 1
221 1 8 ILE MD 1 42 SER HA . . 4.130 4.184 4.154 4.213 0.083 27 0 "[ . 1 . 2 . 3]" 1
222 1 8 ILE MD 1 42 SER HB2 . . 4.480 3.677 3.462 4.013 . 0 0 "[ . 1 . 2 . 3]" 1
223 1 8 ILE MD 1 42 SER HB3 . . 4.560 2.367 2.248 2.564 . 0 0 "[ . 1 . 2 . 3]" 1
224 1 8 ILE HG12 1 9 ILE HA . . 4.580 4.606 4.486 4.638 0.058 27 0 "[ . 1 . 2 . 3]" 1
225 1 8 ILE HG13 1 42 SER HA . . 4.440 3.181 2.935 3.485 . 0 0 "[ . 1 . 2 . 3]" 1
226 1 8 ILE MG 1 9 ILE H . . 3.960 3.883 3.521 3.989 0.029 3 0 "[ . 1 . 2 . 3]" 1
227 1 8 ILE MG 1 9 ILE HA . . 5.260 4.264 3.866 4.489 . 0 0 "[ . 1 . 2 . 3]" 1
228 1 8 ILE MG 1 10 ASP H . . 4.970 4.500 3.819 5.037 0.067 11 0 "[ . 1 . 2 . 3]" 1
229 1 8 ILE MG 1 42 SER HA . . 5.080 4.954 4.843 5.069 . 0 0 "[ . 1 . 2 . 3]" 1
230 1 8 ILE MG 1 72 SER H . . 4.920 3.054 2.878 3.238 . 0 0 "[ . 1 . 2 . 3]" 1
231 1 8 ILE MG 1 72 SER HB3 . . 4.170 3.544 2.987 4.186 0.016 23 0 "[ . 1 . 2 . 3]" 1
232 1 9 ILE H 1 9 ILE HB . . 3.690 2.615 2.488 2.729 . 0 0 "[ . 1 . 2 . 3]" 1
233 1 9 ILE H 1 9 ILE MD . . 4.330 2.212 2.081 2.369 . 0 0 "[ . 1 . 2 . 3]" 1
234 1 9 ILE H 1 9 ILE HG12 . . 3.970 4.012 3.972 4.038 0.068 9 0 "[ . 1 . 2 . 3]" 1
235 1 9 ILE H 1 41 ARG HA . . 4.660 4.542 4.140 4.702 0.042 13 0 "[ . 1 . 2 . 3]" 1
236 1 9 ILE H 1 41 ARG HB2 . . 4.450 3.403 3.009 3.750 . 0 0 "[ . 1 . 2 . 3]" 1
237 1 9 ILE H 1 42 SER HA . . 4.290 3.208 2.964 3.350 . 0 0 "[ . 1 . 2 . 3]" 1
238 1 9 ILE H 1 71 VAL HA . . 5.440 4.708 4.577 4.877 . 0 0 "[ . 1 . 2 . 3]" 1
239 1 9 ILE H 1 71 VAL MG1 . . 5.500 4.628 3.942 5.148 . 0 0 "[ . 1 . 2 . 3]" 1
240 1 9 ILE HA 1 9 ILE MD . . 4.460 3.495 3.236 3.644 . 0 0 "[ . 1 . 2 . 3]" 1
241 1 9 ILE HA 1 9 ILE HG12 . . 4.040 3.844 3.706 3.989 . 0 0 "[ . 1 . 2 . 3]" 1
242 1 9 ILE HA 1 9 ILE HG13 . . 4.120 2.842 2.619 3.076 . 0 0 "[ . 1 . 2 . 3]" 1
243 1 9 ILE HA 1 9 ILE MG . . 3.540 2.285 2.163 2.386 . 0 0 "[ . 1 . 2 . 3]" 1
244 1 9 ILE HA 1 10 ASP H . . 3.060 2.237 2.138 2.456 . 0 0 "[ . 1 . 2 . 3]" 1
245 1 9 ILE HA 1 10 ASP HB2 . . 5.500 4.370 4.026 4.867 . 0 0 "[ . 1 . 2 . 3]" 1
246 1 9 ILE HA 1 10 ASP HB3 . . 5.370 5.242 4.679 5.502 0.132 25 0 "[ . 1 . 2 . 3]" 1
247 1 9 ILE HA 1 61 ILE MD . . 5.500 5.536 5.480 5.585 0.085 14 0 "[ . 1 . 2 . 3]" 1
248 1 9 ILE HA 1 61 ILE MG . . 5.330 4.494 4.222 4.936 . 0 0 "[ . 1 . 2 . 3]" 1
249 1 9 ILE HA 1 71 VAL H . . 5.320 4.315 3.799 4.931 . 0 0 "[ . 1 . 2 . 3]" 1
250 1 9 ILE HA 1 71 VAL HA . . 3.390 2.440 2.248 2.733 . 0 0 "[ . 1 . 2 . 3]" 1
251 1 9 ILE HA 1 72 SER H . . 4.340 3.701 3.472 4.032 . 0 0 "[ . 1 . 2 . 3]" 1
252 1 9 ILE HB 1 9 ILE MD . . 3.740 2.364 2.215 2.507 . 0 0 "[ . 1 . 2 . 3]" 1
253 1 9 ILE HB 1 10 ASP H . . 5.020 4.225 3.562 4.515 . 0 0 "[ . 1 . 2 . 3]" 1
254 1 9 ILE HB 1 21 ILE MD . . 5.500 3.701 3.332 4.278 . 0 0 "[ . 1 . 2 . 3]" 1
255 1 9 ILE HB 1 42 SER HA . . 5.500 4.869 4.652 5.154 . 0 0 "[ . 1 . 2 . 3]" 1
256 1 9 ILE MD 1 9 ILE MG . . 3.490 3.248 3.123 3.320 . 0 0 "[ . 1 . 2 . 3]" 1
257 1 9 ILE MD 1 12 MET HB2 . . 4.380 4.322 3.872 4.465 0.085 7 0 "[ . 1 . 2 . 3]" 1
258 1 9 ILE MD 1 12 MET HG2 . . 5.000 4.614 2.372 5.128 0.128 27 0 "[ . 1 . 2 . 3]" 1
259 1 9 ILE MD 1 12 MET HG3 . . 5.000 4.212 3.342 5.027 0.027 26 0 "[ . 1 . 2 . 3]" 1
260 1 9 ILE MD 1 41 ARG HA . . 5.160 4.012 3.482 4.605 . 0 0 "[ . 1 . 2 . 3]" 1
261 1 9 ILE MD 1 42 SER HA . . 4.680 2.446 2.307 2.628 . 0 0 "[ . 1 . 2 . 3]" 1
262 1 9 ILE MD 1 61 ILE MD . . 3.930 2.606 2.249 3.253 . 0 0 "[ . 1 . 2 . 3]" 1
263 1 9 ILE MD 1 61 ILE MG . . 3.160 2.333 2.145 2.737 . 0 0 "[ . 1 . 2 . 3]" 1
264 1 9 ILE MD 1 69 TYR QD . . 4.650 4.702 4.654 4.739 0.089 27 0 "[ . 1 . 2 . 3]" 1
265 1 9 ILE MD 1 71 VAL HA . . 5.500 4.336 3.680 4.819 . 0 0 "[ . 1 . 2 . 3]" 1
266 1 9 ILE MD 1 72 SER H . . 5.500 4.718 4.018 5.251 . 0 0 "[ . 1 . 2 . 3]" 1
267 1 9 ILE HG12 1 21 ILE MD . . 5.500 2.421 2.237 2.705 . 0 0 "[ . 1 . 2 . 3]" 1
268 1 9 ILE HG12 1 42 SER HA . . 5.150 5.241 5.169 5.325 0.175 29 0 "[ . 1 . 2 . 3]" 1
269 1 9 ILE HG12 1 61 ILE MD . . 5.170 3.988 3.842 4.241 . 0 0 "[ . 1 . 2 . 3]" 1
270 1 9 ILE HG12 1 61 ILE MG . . 4.070 2.375 2.184 2.716 . 0 0 "[ . 1 . 2 . 3]" 1
271 1 9 ILE HG12 1 71 VAL HA . . 5.090 5.007 4.642 5.168 0.078 26 0 "[ . 1 . 2 . 3]" 1
272 1 9 ILE HG13 1 10 ASP H . . 5.410 4.958 4.522 5.211 . 0 0 "[ . 1 . 2 . 3]" 1
273 1 9 ILE HG13 1 61 ILE MG . . 3.850 2.198 2.092 2.350 . 0 0 "[ . 1 . 2 . 3]" 1
274 1 9 ILE HG13 1 69 TYR HA . . 5.500 5.346 4.895 5.548 0.048 27 0 "[ . 1 . 2 . 3]" 1
275 1 9 ILE HG13 1 69 TYR HB3 . . 4.480 4.243 3.705 4.562 0.082 10 0 "[ . 1 . 2 . 3]" 1
276 1 9 ILE HG13 1 69 TYR QD . . 4.270 3.927 3.617 4.118 . 0 0 "[ . 1 . 2 . 3]" 1
277 1 9 ILE HG13 1 69 TYR QE . . 4.330 4.326 4.263 4.380 0.050 19 0 "[ . 1 . 2 . 3]" 1
278 1 9 ILE HG13 1 71 VAL HA . . 5.240 3.434 3.062 3.692 . 0 0 "[ . 1 . 2 . 3]" 1
279 1 9 ILE HG13 1 72 SER H . . 5.500 4.711 4.385 5.035 . 0 0 "[ . 1 . 2 . 3]" 1
280 1 9 ILE MG 1 10 ASP H . . 4.170 2.971 2.046 3.429 . 0 0 "[ . 1 . 2 . 3]" 1
281 1 9 ILE MG 1 10 ASP HA . . 5.500 3.979 3.226 4.403 . 0 0 "[ . 1 . 2 . 3]" 1
282 1 9 ILE MG 1 11 GLY H . . 5.500 3.001 1.772 4.313 . 0 0 "[ . 1 . 2 . 3]" 1
283 1 9 ILE MG 1 11 GLY HA3 . . 5.500 3.730 2.815 4.576 . 0 0 "[ . 1 . 2 . 3]" 1
284 1 9 ILE MG 1 12 MET H . . 4.550 2.653 2.002 3.368 . 0 0 "[ . 1 . 2 . 3]" 1
285 1 9 ILE MG 1 12 MET HA . . 5.500 3.374 2.444 4.011 . 0 0 "[ . 1 . 2 . 3]" 1
286 1 9 ILE MG 1 12 MET HB3 . . 3.750 2.705 2.037 3.811 0.061 30 0 "[ . 1 . 2 . 3]" 1
287 1 9 ILE MG 1 12 MET HG2 . . 4.450 3.946 3.254 4.558 0.108 19 0 "[ . 1 . 2 . 3]" 1
288 1 9 ILE MG 1 21 ILE MD . . 4.060 3.358 2.980 3.723 . 0 0 "[ . 1 . 2 . 3]" 1
289 1 9 ILE MG 1 41 ARG HB2 . . 5.500 4.749 4.037 5.546 0.046 16 0 "[ . 1 . 2 . 3]" 1
290 1 9 ILE MG 1 68 LEU HA . . 6.500 6.167 5.776 6.490 . 0 0 "[ . 1 . 2 . 3]" 1
291 1 9 ILE MG 1 69 TYR H . . 5.390 4.512 4.341 4.695 . 0 0 "[ . 1 . 2 . 3]" 1
292 1 9 ILE MG 1 69 TYR HA . . 4.550 2.404 2.222 2.609 . 0 0 "[ . 1 . 2 . 3]" 1
293 1 9 ILE MG 1 69 TYR HB2 . . 4.200 3.786 3.583 3.972 . 0 0 "[ . 1 . 2 . 3]" 1
294 1 9 ILE MG 1 69 TYR HB3 . . 3.810 2.561 2.291 2.806 . 0 0 "[ . 1 . 2 . 3]" 1
295 1 9 ILE MG 1 69 TYR QD . . 4.160 2.798 2.702 2.862 . 0 0 "[ . 1 . 2 . 3]" 1
296 1 9 ILE MG 1 69 TYR QE . . 4.970 3.168 2.975 3.431 . 0 0 "[ . 1 . 2 . 3]" 1
297 1 9 ILE MG 1 70 ARG H . . 4.470 2.947 2.420 3.260 . 0 0 "[ . 1 . 2 . 3]" 1
298 1 9 ILE MG 1 70 ARG HB2 . . 4.690 4.359 3.522 4.792 0.102 22 0 "[ . 1 . 2 . 3]" 1
299 1 9 ILE MG 1 70 ARG HB3 . . 4.530 4.264 3.820 4.702 0.172 29 0 "[ . 1 . 2 . 3]" 1
300 1 9 ILE MG 1 71 VAL H . . 5.460 3.966 3.387 4.848 . 0 0 "[ . 1 . 2 . 3]" 1
301 1 9 ILE MG 1 71 VAL HA . . 4.990 3.498 3.095 3.921 . 0 0 "[ . 1 . 2 . 3]" 1
302 1 9 ILE MG 1 71 VAL MG2 . . 3.800 2.304 2.058 2.608 . 0 0 "[ . 1 . 2 . 3]" 1
303 1 10 ASP H 1 10 ASP HB2 . . 3.560 2.390 1.963 3.228 . 0 0 "[ . 1 . 2 . 3]" 1
304 1 10 ASP H 1 10 ASP HB3 . . 3.400 3.096 2.511 3.410 0.010 25 0 "[ . 1 . 2 . 3]" 1
305 1 10 ASP H 1 11 GLY H . . 4.870 3.741 2.735 4.543 . 0 0 "[ . 1 . 2 . 3]" 1
306 1 10 ASP H 1 69 TYR HA . . 5.340 4.648 3.277 5.348 0.008 28 0 "[ . 1 . 2 . 3]" 1
307 1 10 ASP H 1 70 ARG H . . 4.050 3.338 2.211 3.932 . 0 0 "[ . 1 . 2 . 3]" 1
308 1 10 ASP H 1 70 ARG HB2 . . 4.950 3.311 2.088 4.198 . 0 0 "[ . 1 . 2 . 3]" 1
309 1 10 ASP H 1 71 VAL HA . . 4.220 3.797 3.307 4.207 . 0 0 "[ . 1 . 2 . 3]" 1
310 1 10 ASP H 1 71 VAL MG2 . . 5.590 4.465 3.897 4.941 . 0 0 "[ . 1 . 2 . 3]" 1
311 1 10 ASP H 1 72 SER H . . 5.370 4.806 4.367 5.416 0.046 11 0 "[ . 1 . 2 . 3]" 1
312 1 10 ASP HA 1 11 GLY H . . 3.060 2.507 2.042 3.174 0.114 5 0 "[ . 1 . 2 . 3]" 1
313 1 10 ASP HA 1 12 MET H . . 4.360 3.735 2.887 4.463 0.103 30 0 "[ . 1 . 2 . 3]" 1
314 1 10 ASP HB2 1 11 GLY H . . 4.510 4.374 3.900 4.611 0.101 7 0 "[ . 1 . 2 . 3]" 1
315 1 10 ASP HB2 1 70 ARG H . . 5.290 4.664 4.187 5.366 0.076 17 0 "[ . 1 . 2 . 3]" 1
316 1 10 ASP HB2 1 70 ARG HB2 . . 3.390 3.468 3.305 3.599 0.209 30 0 "[ . 1 . 2 . 3]" 1
317 1 10 ASP HB2 1 70 ARG HB3 . . 4.100 2.606 2.026 4.133 0.033 6 0 "[ . 1 . 2 . 3]" 1
318 1 10 ASP HB3 1 11 GLY H . . 4.680 3.986 3.210 4.399 . 0 0 "[ . 1 . 2 . 3]" 1
319 1 10 ASP HB3 1 11 GLY HA3 . . 5.450 4.801 4.381 5.205 . 0 0 "[ . 1 . 2 . 3]" 1
320 1 10 ASP HB3 1 70 ARG H . . 4.410 4.184 3.588 4.638 0.228 2 0 "[ . 1 . 2 . 3]" 1
321 1 10 ASP HB3 1 70 ARG HB2 . . 3.600 2.735 2.024 3.617 0.017 25 0 "[ . 1 . 2 . 3]" 1
322 1 10 ASP HB3 1 70 ARG HB3 . . 3.790 2.522 2.106 3.781 . 0 0 "[ . 1 . 2 . 3]" 1
323 1 10 ASP HB3 1 70 ARG HG2 . . 3.880 3.753 2.367 4.109 0.229 11 0 "[ . 1 . 2 . 3]" 1
324 1 11 GLY H 1 12 MET H . . 3.580 2.142 1.826 2.596 . 0 0 "[ . 1 . 2 . 3]" 1
325 1 11 GLY H 1 12 MET HB2 . . 5.520 4.904 3.002 5.690 0.170 13 0 "[ . 1 . 2 . 3]" 1
326 1 11 GLY H 1 12 MET HG2 . . 5.590 4.909 3.680 5.789 0.199 5 0 "[ . 1 . 2 . 3]" 1
327 1 11 GLY HA3 1 68 LEU MD2 . . 5.430 4.573 3.897 5.293 . 0 0 "[ . 1 . 2 . 3]" 1
328 1 11 GLY HA3 1 68 LEU HG . . 5.430 3.476 2.404 5.444 0.014 14 0 "[ . 1 . 2 . 3]" 1
329 1 12 MET H 1 12 MET HB3 . . 3.940 2.504 2.057 3.505 . 0 0 "[ . 1 . 2 . 3]" 1
330 1 12 MET H 1 69 TYR QD . . 4.930 4.578 3.615 4.959 0.029 2 0 "[ . 1 . 2 . 3]" 1
331 1 12 MET H 1 69 TYR QE . . 5.150 4.664 4.098 5.160 0.010 2 0 "[ . 1 . 2 . 3]" 1
332 1 12 MET HA 1 13 HIS HD2 . . 4.120 3.383 2.767 4.134 0.014 17 0 "[ . 1 . 2 . 3]" 1
333 1 12 MET HA 1 17 CYS HB2 . . 4.660 3.981 3.171 4.431 . 0 0 "[ . 1 . 2 . 3]" 1
334 1 12 MET HA 1 69 TYR QD . . 3.750 3.438 2.916 3.783 0.033 5 0 "[ . 1 . 2 . 3]" 1
335 1 12 MET HA 1 69 TYR QE . . 3.210 2.298 2.026 2.632 . 0 0 "[ . 1 . 2 . 3]" 1
336 1 12 MET HB2 1 14 CYS H . . 4.690 4.070 3.610 4.744 0.054 28 0 "[ . 1 . 2 . 3]" 1
337 1 12 MET HB2 1 17 CYS HB2 . . 4.730 3.415 2.001 4.976 0.246 30 0 "[ . 1 . 2 . 3]" 1
338 1 12 MET HB2 1 17 CYS HB3 . . 4.730 3.068 2.000 4.834 0.104 17 0 "[ . 1 . 2 . 3]" 1
339 1 12 MET HB2 1 69 TYR HA . . 6.000 5.596 4.770 6.026 0.026 23 0 "[ . 1 . 2 . 3]" 1
340 1 12 MET HB2 1 69 TYR QE . . 4.920 3.509 2.716 4.559 . 0 0 "[ . 1 . 2 . 3]" 1
341 1 12 MET HB3 1 17 CYS H . . 6.500 6.547 5.859 6.765 0.265 26 0 "[ . 1 . 2 . 3]" 1
342 1 12 MET HG2 1 17 CYS HB2 . . 4.590 3.730 2.264 4.724 0.134 10 0 "[ . 1 . 2 . 3]" 1
343 1 12 MET HG2 1 17 CYS HB3 . . 4.420 3.473 1.930 4.501 0.081 7 0 "[ . 1 . 2 . 3]" 1
344 1 12 MET HG3 1 14 CYS H . . 4.530 3.321 1.763 4.608 0.078 28 0 "[ . 1 . 2 . 3]" 1
345 1 12 MET HG3 1 17 CYS HB2 . . 3.820 3.435 2.339 4.049 0.229 25 0 "[ . 1 . 2 . 3]" 1
346 1 12 MET HG3 1 69 TYR QE . . 5.500 4.731 3.320 5.374 . 0 0 "[ . 1 . 2 . 3]" 1
347 1 13 HIS H 1 13 HIS HD2 . . 5.010 2.386 1.920 3.545 . 0 0 "[ . 1 . 2 . 3]" 1
348 1 13 HIS H 1 14 CYS H . . 3.760 3.185 1.847 3.708 . 0 0 "[ . 1 . 2 . 3]" 1
349 1 13 HIS H 1 69 TYR QE . . 5.240 3.178 2.628 3.843 . 0 0 "[ . 1 . 2 . 3]" 1
350 1 13 HIS HA 1 13 HIS HB2 . . 2.970 3.015 2.988 3.029 0.059 26 0 "[ . 1 . 2 . 3]" 1
351 1 13 HIS HA 1 13 HIS HB3 . . 2.990 2.457 2.304 2.609 . 0 0 "[ . 1 . 2 . 3]" 1
352 1 13 HIS HA 1 13 HIS HD2 . . 4.800 3.089 2.557 4.355 . 0 0 "[ . 1 . 2 . 3]" 1
353 1 13 HIS HB2 1 13 HIS HD2 . . 3.960 3.482 2.660 3.915 . 0 0 "[ . 1 . 2 . 3]" 1
354 1 13 HIS HB2 1 14 CYS H . . 4.610 3.816 2.732 4.365 . 0 0 "[ . 1 . 2 . 3]" 1
355 1 13 HIS HB2 1 17 CYS HA . . 4.500 3.917 2.715 4.520 0.020 19 0 "[ . 1 . 2 . 3]" 1
356 1 13 HIS HB2 1 17 CYS HB3 . . 3.870 3.673 2.315 4.041 0.171 14 0 "[ . 1 . 2 . 3]" 1
357 1 13 HIS HD2 1 14 CYS H . . 5.270 4.992 4.666 5.376 0.106 4 0 "[ . 1 . 2 . 3]" 1
358 1 13 HIS HD2 1 68 LEU MD1 . . 3.880 3.713 2.660 3.946 0.066 4 0 "[ . 1 . 2 . 3]" 1
359 1 13 HIS HD2 1 68 LEU MD2 . . 5.500 2.582 2.104 5.192 . 0 0 "[ . 1 . 2 . 3]" 1
360 1 13 HIS HD2 1 68 LEU HG . . 5.500 4.262 3.085 5.516 0.016 4 0 "[ . 1 . 2 . 3]" 1
361 1 13 HIS HD2 1 69 TYR QE . . 4.110 3.681 2.551 4.167 0.057 20 0 "[ . 1 . 2 . 3]" 1
362 1 14 CYS H 1 17 CYS H . . 4.640 4.112 3.484 4.679 0.039 25 0 "[ . 1 . 2 . 3]" 1
363 1 14 CYS H 1 17 CYS HB2 . . 4.650 3.366 2.506 4.734 0.084 18 0 "[ . 1 . 2 . 3]" 1
364 1 14 CYS H 1 17 CYS HB3 . . 3.830 3.783 2.935 3.983 0.153 30 0 "[ . 1 . 2 . 3]" 1
365 1 14 CYS HA 1 14 CYS HB2 . . 2.980 2.791 2.468 3.028 0.048 5 0 "[ . 1 . 2 . 3]" 1
366 1 14 CYS HA 1 14 CYS HB3 . . 3.020 2.696 2.366 3.047 0.027 25 0 "[ . 1 . 2 . 3]" 1
367 1 14 CYS HA 1 17 CYS H . . 5.500 4.965 4.177 5.556 0.056 30 0 "[ . 1 . 2 . 3]" 1
368 1 14 CYS HB3 1 15 LYS QB . . 4.290 4.152 3.496 4.384 0.094 19 0 "[ . 1 . 2 . 3]" 1
369 1 15 LYS HA 1 15 LYS HD3 . . 4.010 3.632 2.060 4.127 0.117 1 0 "[ . 1 . 2 . 3]" 1
370 1 15 LYS HA 1 15 LYS QE . . 5.500 3.381 1.992 4.612 . 0 0 "[ . 1 . 2 . 3]" 1
371 1 15 LYS HA 1 18 VAL H . . 4.010 3.717 3.167 4.066 0.056 6 0 "[ . 1 . 2 . 3]" 1
372 1 15 LYS HA 1 18 VAL HB . . 3.700 3.329 2.103 3.849 0.149 6 0 "[ . 1 . 2 . 3]" 1
373 1 15 LYS HA 1 18 VAL MG2 . . 3.590 2.734 2.183 3.619 0.029 7 0 "[ . 1 . 2 . 3]" 1
374 1 15 LYS HA 1 38 LEU MD2 . . 3.470 3.112 2.109 3.592 0.122 6 0 "[ . 1 . 2 . 3]" 1
375 1 15 LYS QB 1 15 LYS HD3 . . 3.580 2.668 2.131 3.508 . 0 0 "[ . 1 . 2 . 3]" 1
376 1 15 LYS QB 1 15 LYS QE . . 4.350 3.552 2.658 3.955 . 0 0 "[ . 1 . 2 . 3]" 1
377 1 15 LYS HD2 1 15 LYS QG . . 2.760 2.342 2.107 2.569 . 0 0 "[ . 1 . 2 . 3]" 1
378 1 15 LYS QE 1 15 LYS QG . . 3.390 2.326 2.013 2.907 . 0 0 "[ . 1 . 2 . 3]" 1
379 1 15 LYS QE 1 38 LEU HA . . 4.050 3.987 3.380 4.147 0.097 14 0 "[ . 1 . 2 . 3]" 1
380 1 15 LYS QE 1 38 LEU HB3 . . 3.780 3.672 1.994 3.909 0.129 8 0 "[ . 1 . 2 . 3]" 1
381 1 15 LYS QE 1 38 LEU MD2 . . 5.340 2.658 1.838 3.720 . 0 0 "[ . 1 . 2 . 3]" 1
382 1 15 LYS QE 1 38 LEU HG . . 4.500 4.075 1.907 4.574 0.074 16 0 "[ . 1 . 2 . 3]" 1
383 1 16 SER HA 1 18 VAL H . . 4.900 4.229 3.824 4.870 . 0 0 "[ . 1 . 2 . 3]" 1
384 1 16 SER HA 1 18 VAL HB . . 5.070 4.453 3.715 5.047 . 0 0 "[ . 1 . 2 . 3]" 1
385 1 16 SER HA 1 19 SER H . . 3.640 3.484 3.123 3.682 0.042 8 0 "[ . 1 . 2 . 3]" 1
386 1 16 SER HA 1 19 SER QB . . 3.180 3.249 3.194 3.312 0.132 27 0 "[ . 1 . 2 . 3]" 1
387 1 16 SER QB 1 17 CYS H . . 3.920 3.136 2.482 3.861 . 0 0 "[ . 1 . 2 . 3]" 1
388 1 16 SER QB 1 20 ASN H . . 5.060 5.092 5.018 5.141 0.081 3 0 "[ . 1 . 2 . 3]" 1
389 1 16 SER QB 1 20 ASN HD21 . . 5.060 4.466 3.800 5.064 0.004 6 0 "[ . 1 . 2 . 3]" 1
390 1 17 CYS H 1 17 CYS HB2 . . 3.760 2.608 2.018 3.629 . 0 0 "[ . 1 . 2 . 3]" 1
391 1 17 CYS H 1 17 CYS HB3 . . 3.500 3.113 2.154 3.543 0.043 22 0 "[ . 1 . 2 . 3]" 1
392 1 17 CYS H 1 18 VAL H . . 3.350 2.716 2.478 2.965 . 0 0 "[ . 1 . 2 . 3]" 1
393 1 17 CYS H 1 18 VAL HB . . 4.850 4.646 4.285 4.895 0.045 13 0 "[ . 1 . 2 . 3]" 1
394 1 17 CYS H 1 18 VAL MG2 . . 4.810 4.064 3.447 4.533 . 0 0 "[ . 1 . 2 . 3]" 1
395 1 17 CYS H 1 19 SER H . . 4.530 4.560 4.409 4.637 0.107 29 0 "[ . 1 . 2 . 3]" 1
396 1 17 CYS HA 1 20 ASN H . . 4.500 3.491 3.004 4.093 . 0 0 "[ . 1 . 2 . 3]" 1
397 1 17 CYS HA 1 20 ASN HB2 . . 4.600 3.079 2.647 3.499 . 0 0 "[ . 1 . 2 . 3]" 1
398 1 17 CYS HA 1 21 ILE H . . 4.560 4.279 3.981 4.564 0.004 27 0 "[ . 1 . 2 . 3]" 1
399 1 17 CYS HA 1 21 ILE MD . . 5.340 4.393 3.931 4.698 . 0 0 "[ . 1 . 2 . 3]" 1
400 1 17 CYS HA 1 21 ILE HG12 . . 4.020 4.053 3.742 4.154 0.134 5 0 "[ . 1 . 2 . 3]" 1
401 1 17 CYS HA 1 69 TYR QE . . 5.010 4.835 4.105 5.088 0.078 9 0 "[ . 1 . 2 . 3]" 1
402 1 17 CYS HB2 1 18 VAL H . . 3.770 3.300 2.857 3.855 0.085 26 0 "[ . 1 . 2 . 3]" 1
403 1 17 CYS HB2 1 21 ILE MD . . 4.900 3.815 2.309 4.646 . 0 0 "[ . 1 . 2 . 3]" 1
404 1 17 CYS HB2 1 21 ILE HG12 . . 5.360 4.868 3.471 5.558 0.198 1 0 "[ . 1 . 2 . 3]" 1
405 1 17 CYS HB3 1 18 VAL H . . 4.510 3.469 2.463 4.078 . 0 0 "[ . 1 . 2 . 3]" 1
406 1 17 CYS HB3 1 69 TYR QE . . 5.050 3.885 3.490 5.091 0.041 26 0 "[ . 1 . 2 . 3]" 1
407 1 18 VAL H 1 18 VAL HB . . 3.160 2.403 2.066 2.587 . 0 0 "[ . 1 . 2 . 3]" 1
408 1 18 VAL H 1 18 VAL MG1 . . 4.380 3.738 3.585 3.849 . 0 0 "[ . 1 . 2 . 3]" 1
409 1 18 VAL H 1 18 VAL MG2 . . 3.360 2.106 1.829 2.466 . 0 0 "[ . 1 . 2 . 3]" 1
410 1 18 VAL H 1 19 SER H . . 3.410 3.013 2.676 3.369 . 0 0 "[ . 1 . 2 . 3]" 1
411 1 18 VAL H 1 20 ASN H . . 5.150 4.444 4.109 4.768 . 0 0 "[ . 1 . 2 . 3]" 1
412 1 18 VAL H 1 21 ILE MD . . 5.500 4.513 3.857 5.376 . 0 0 "[ . 1 . 2 . 3]" 1
413 1 18 VAL H 1 21 ILE HG12 . . 5.500 5.078 4.817 5.363 . 0 0 "[ . 1 . 2 . 3]" 1
414 1 18 VAL H 1 36 VAL MG2 . . 5.440 5.268 4.513 5.550 0.110 4 0 "[ . 1 . 2 . 3]" 1
415 1 18 VAL H 1 38 LEU MD2 . . 5.710 5.016 4.107 5.659 . 0 0 "[ . 1 . 2 . 3]" 1
416 1 18 VAL HA 1 18 VAL MG1 . . 3.140 2.609 2.363 2.839 . 0 0 "[ . 1 . 2 . 3]" 1
417 1 18 VAL HA 1 18 VAL MG2 . . 3.350 2.341 2.095 2.511 . 0 0 "[ . 1 . 2 . 3]" 1
418 1 18 VAL HA 1 19 SER HA . . 4.990 4.824 4.636 4.926 . 0 0 "[ . 1 . 2 . 3]" 1
419 1 18 VAL HA 1 20 ASN H . . 5.410 4.594 4.283 4.795 . 0 0 "[ . 1 . 2 . 3]" 1
420 1 18 VAL HA 1 21 ILE H . . 4.600 3.558 3.259 3.902 . 0 0 "[ . 1 . 2 . 3]" 1
421 1 18 VAL HA 1 21 ILE HB . . 3.770 3.276 2.898 3.579 . 0 0 "[ . 1 . 2 . 3]" 1
422 1 18 VAL HA 1 21 ILE MD . . 4.620 3.412 2.777 4.536 . 0 0 "[ . 1 . 2 . 3]" 1
423 1 18 VAL HA 1 21 ILE HG12 . . 3.930 3.957 3.772 4.035 0.105 14 0 "[ . 1 . 2 . 3]" 1
424 1 18 VAL HA 1 21 ILE HG13 . . 4.800 2.336 2.135 2.955 . 0 0 "[ . 1 . 2 . 3]" 1
425 1 18 VAL HA 1 22 GLU H . . 4.800 4.080 3.625 4.726 . 0 0 "[ . 1 . 2 . 3]" 1
426 1 18 VAL HA 1 36 VAL MG2 . . 3.560 2.979 2.266 3.203 . 0 0 "[ . 1 . 2 . 3]" 1
427 1 18 VAL HB 1 19 SER H . . 3.100 2.522 2.210 2.867 . 0 0 "[ . 1 . 2 . 3]" 1
428 1 18 VAL HB 1 19 SER HA . . 4.900 4.530 4.225 4.908 0.008 16 0 "[ . 1 . 2 . 3]" 1
429 1 18 VAL HB 1 38 LEU MD1 . . 5.050 4.474 2.091 5.130 0.080 21 0 "[ . 1 . 2 . 3]" 1
430 1 18 VAL HB 1 38 LEU MD2 . . 5.130 3.364 2.433 4.339 . 0 0 "[ . 1 . 2 . 3]" 1
431 1 18 VAL MG1 1 19 SER H . . 4.060 3.061 2.756 3.377 . 0 0 "[ . 1 . 2 . 3]" 1
432 1 18 VAL MG1 1 19 SER HA . . 4.070 3.300 2.971 3.619 . 0 0 "[ . 1 . 2 . 3]" 1
433 1 18 VAL MG1 1 19 SER QB . . 3.950 3.703 3.139 3.970 0.020 12 0 "[ . 1 . 2 . 3]" 1
434 1 18 VAL MG1 1 21 ILE H . . 5.500 4.769 4.539 4.971 . 0 0 "[ . 1 . 2 . 3]" 1
435 1 18 VAL MG1 1 22 GLU H . . 4.600 4.067 3.710 4.622 0.022 16 0 "[ . 1 . 2 . 3]" 1
436 1 18 VAL MG1 1 38 LEU H . . 4.670 4.006 3.510 4.693 0.023 7 0 "[ . 1 . 2 . 3]" 1
437 1 18 VAL MG2 1 19 SER H . . 4.250 3.920 3.766 4.222 . 0 0 "[ . 1 . 2 . 3]" 1
438 1 18 VAL MG2 1 19 SER QB . . 5.500 5.068 4.884 5.526 0.026 4 0 "[ . 1 . 2 . 3]" 1
439 1 18 VAL MG2 1 38 LEU HA . . 4.710 2.316 1.918 3.640 . 0 0 "[ . 1 . 2 . 3]" 1
440 1 19 SER H 1 19 SER QB . . 2.990 2.149 2.059 2.276 . 0 0 "[ . 1 . 2 . 3]" 1
441 1 19 SER H 1 20 ASN H . . 3.570 2.809 2.605 3.023 . 0 0 "[ . 1 . 2 . 3]" 1
442 1 19 SER H 1 21 ILE H . . 4.770 4.149 3.989 4.371 . 0 0 "[ . 1 . 2 . 3]" 1
443 1 19 SER HA 1 19 SER QB . . 2.750 2.428 2.326 2.528 . 0 0 "[ . 1 . 2 . 3]" 1
444 1 19 SER HA 1 21 ILE H . . 5.110 4.309 3.717 4.637 . 0 0 "[ . 1 . 2 . 3]" 1
445 1 19 SER HA 1 22 GLU H . . 4.220 3.590 2.778 4.025 . 0 0 "[ . 1 . 2 . 3]" 1
446 1 19 SER HA 1 22 GLU HB2 . . 3.570 2.655 2.177 2.842 . 0 0 "[ . 1 . 2 . 3]" 1
447 1 19 SER HA 1 22 GLU HB3 . . 4.100 4.167 3.780 4.249 0.149 17 0 "[ . 1 . 2 . 3]" 1
448 1 19 SER HA 1 22 GLU HG3 . . 4.750 3.668 2.737 4.791 0.041 16 0 "[ . 1 . 2 . 3]" 1
449 1 19 SER HA 1 23 SER H . . 4.560 4.012 3.610 4.490 . 0 0 "[ . 1 . 2 . 3]" 1
450 1 19 SER QB 1 20 ASN H . . 3.140 2.661 2.420 3.160 0.020 4 0 "[ . 1 . 2 . 3]" 1
451 1 19 SER QB 1 20 ASN HD21 . . 5.030 4.788 3.790 5.110 0.080 12 0 "[ . 1 . 2 . 3]" 1
452 1 19 SER QB 1 21 ILE H . . 5.310 4.739 4.538 5.058 . 0 0 "[ . 1 . 2 . 3]" 1
453 1 20 ASN H 1 20 ASN HB2 . . 3.510 2.539 2.474 2.664 . 0 0 "[ . 1 . 2 . 3]" 1
454 1 20 ASN H 1 20 ASN HB3 . . 3.980 3.619 3.571 3.699 . 0 0 "[ . 1 . 2 . 3]" 1
455 1 20 ASN H 1 20 ASN HD21 . . 5.090 3.029 2.067 3.553 . 0 0 "[ . 1 . 2 . 3]" 1
456 1 20 ASN H 1 20 ASN HD22 . . 4.700 3.757 3.438 3.942 . 0 0 "[ . 1 . 2 . 3]" 1
457 1 20 ASN H 1 21 ILE H . . 3.730 2.663 2.527 2.812 . 0 0 "[ . 1 . 2 . 3]" 1
458 1 20 ASN H 1 21 ILE MD . . 5.500 5.429 5.173 5.531 0.031 20 0 "[ . 1 . 2 . 3]" 1
459 1 20 ASN H 1 21 ILE HG12 . . 5.100 4.339 4.130 4.506 . 0 0 "[ . 1 . 2 . 3]" 1
460 1 20 ASN H 1 64 VAL MG1 . . 5.500 5.440 5.219 5.549 0.049 12 0 "[ . 1 . 2 . 3]" 1
461 1 20 ASN H 1 64 VAL MG2 . . 5.100 4.957 4.694 5.115 0.015 30 0 "[ . 1 . 2 . 3]" 1
462 1 20 ASN HA 1 20 ASN HB2 . . 2.980 3.018 3.007 3.028 0.048 1 0 "[ . 1 . 2 . 3]" 1
463 1 20 ASN HA 1 20 ASN HD21 . . 4.830 4.304 3.783 4.531 . 0 0 "[ . 1 . 2 . 3]" 1
464 1 20 ASN HA 1 20 ASN HD22 . . 5.110 4.640 4.441 4.795 . 0 0 "[ . 1 . 2 . 3]" 1
465 1 20 ASN HA 1 23 SER H . . 4.500 3.587 3.419 3.862 . 0 0 "[ . 1 . 2 . 3]" 1
466 1 20 ASN HA 1 24 THR H . . 4.230 3.821 3.578 4.052 . 0 0 "[ . 1 . 2 . 3]" 1
467 1 20 ASN HA 1 64 VAL MG2 . . 5.200 3.804 3.627 4.095 . 0 0 "[ . 1 . 2 . 3]" 1
468 1 20 ASN HB2 1 20 ASN HD22 . . 3.740 3.464 3.404 3.530 . 0 0 "[ . 1 . 2 . 3]" 1
469 1 20 ASN HB2 1 21 ILE H . . 3.870 2.531 2.323 2.684 . 0 0 "[ . 1 . 2 . 3]" 1
470 1 20 ASN HB2 1 23 SER QB . . 5.230 5.277 5.172 5.323 0.093 25 0 "[ . 1 . 2 . 3]" 1
471 1 20 ASN HB2 1 24 THR H . . 5.380 5.371 5.281 5.454 0.074 20 0 "[ . 1 . 2 . 3]" 1
472 1 20 ASN HB2 1 64 VAL MG2 . . 4.010 3.012 2.704 3.183 . 0 0 "[ . 1 . 2 . 3]" 1
473 1 20 ASN HB3 1 20 ASN HD22 . . 3.920 3.895 3.808 3.988 0.068 17 0 "[ . 1 . 2 . 3]" 1
474 1 20 ASN HB3 1 21 ILE H . . 3.920 3.624 3.450 3.742 . 0 0 "[ . 1 . 2 . 3]" 1
475 1 20 ASN HB3 1 21 ILE HG12 . . 3.980 4.094 4.029 4.132 0.152 9 0 "[ . 1 . 2 . 3]" 1
476 1 20 ASN HB3 1 64 VAL MG2 . . 3.710 2.074 1.963 2.154 . 0 0 "[ . 1 . 2 . 3]" 1
477 1 20 ASN HD21 1 64 VAL MG2 . . 5.010 4.121 3.721 4.786 . 0 0 "[ . 1 . 2 . 3]" 1
478 1 20 ASN HD22 1 21 ILE HG12 . . 6.950 6.059 6.001 6.142 . 0 0 "[ . 1 . 2 . 3]" 1
479 1 20 ASN HD22 1 64 VAL MG1 . . 5.500 5.357 5.090 5.519 0.019 1 0 "[ . 1 . 2 . 3]" 1
480 1 20 ASN HD22 1 64 VAL MG2 . . 4.790 4.766 4.558 4.876 0.086 27 0 "[ . 1 . 2 . 3]" 1
481 1 21 ILE H 1 21 ILE HB . . 3.250 2.892 2.622 3.105 . 0 0 "[ . 1 . 2 . 3]" 1
482 1 21 ILE H 1 21 ILE MD . . 4.400 3.777 3.603 3.859 . 0 0 "[ . 1 . 2 . 3]" 1
483 1 21 ILE H 1 21 ILE HG12 . . 3.480 2.294 2.140 2.404 . 0 0 "[ . 1 . 2 . 3]" 1
484 1 21 ILE H 1 21 ILE HG13 . . 3.630 2.410 2.073 3.194 . 0 0 "[ . 1 . 2 . 3]" 1
485 1 21 ILE H 1 21 ILE MG . . 3.940 3.813 3.725 3.845 . 0 0 "[ . 1 . 2 . 3]" 1
486 1 21 ILE H 1 22 GLU H . . 3.770 2.678 2.585 2.829 . 0 0 "[ . 1 . 2 . 3]" 1
487 1 21 ILE H 1 22 GLU HG3 . . 5.500 4.786 4.318 5.530 0.030 16 0 "[ . 1 . 2 . 3]" 1
488 1 21 ILE H 1 36 VAL MG2 . . 5.320 4.520 4.094 5.017 . 0 0 "[ . 1 . 2 . 3]" 1
489 1 21 ILE H 1 64 VAL MG1 . . 5.400 4.186 3.934 4.449 . 0 0 "[ . 1 . 2 . 3]" 1
490 1 21 ILE H 1 64 VAL MG2 . . 4.460 4.183 3.761 4.464 0.004 10 0 "[ . 1 . 2 . 3]" 1
491 1 21 ILE H 1 69 TYR QE . . 5.500 5.384 5.077 5.535 0.035 21 0 "[ . 1 . 2 . 3]" 1
492 1 21 ILE HA 1 21 ILE MD . . 4.570 3.680 2.748 3.999 . 0 0 "[ . 1 . 2 . 3]" 1
493 1 21 ILE HA 1 21 ILE HG12 . . 3.700 2.880 2.766 3.088 . 0 0 "[ . 1 . 2 . 3]" 1
494 1 21 ILE HA 1 21 ILE MG . . 3.140 2.213 2.149 2.301 . 0 0 "[ . 1 . 2 . 3]" 1
495 1 21 ILE HA 1 23 SER H . . 5.310 4.488 3.855 4.685 . 0 0 "[ . 1 . 2 . 3]" 1
496 1 21 ILE HA 1 24 THR H . . 3.960 3.499 3.293 3.676 . 0 0 "[ . 1 . 2 . 3]" 1
497 1 21 ILE HA 1 24 THR HB . . 3.440 2.926 2.675 3.130 . 0 0 "[ . 1 . 2 . 3]" 1
498 1 21 ILE HA 1 24 THR MG . . 4.850 4.345 4.140 4.495 . 0 0 "[ . 1 . 2 . 3]" 1
499 1 21 ILE HA 1 25 LEU H . . 4.910 3.586 3.284 3.761 . 0 0 "[ . 1 . 2 . 3]" 1
500 1 21 ILE HA 1 61 ILE MG . . 5.370 4.215 3.945 4.459 . 0 0 "[ . 1 . 2 . 3]" 1
501 1 21 ILE HA 1 64 VAL MG1 . . 3.430 3.175 2.900 3.460 0.030 12 0 "[ . 1 . 2 . 3]" 1
502 1 21 ILE HA 1 64 VAL MG2 . . 3.900 3.319 2.900 3.715 . 0 0 "[ . 1 . 2 . 3]" 1
503 1 21 ILE HA 1 69 TYR QE . . 4.850 4.616 4.297 4.857 0.007 1 0 "[ . 1 . 2 . 3]" 1
504 1 21 ILE HB 1 21 ILE MD . . 3.300 2.773 2.554 3.195 . 0 0 "[ . 1 . 2 . 3]" 1
505 1 21 ILE HB 1 22 GLU H . . 3.520 2.661 2.325 3.073 . 0 0 "[ . 1 . 2 . 3]" 1
506 1 21 ILE HB 1 22 GLU HG3 . . 5.400 3.990 3.550 4.406 . 0 0 "[ . 1 . 2 . 3]" 1
507 1 21 ILE MD 1 21 ILE MG . . 3.320 2.016 1.969 2.062 . 0 0 "[ . 1 . 2 . 3]" 1
508 1 21 ILE MD 1 22 GLU H . . 5.410 4.835 4.610 5.050 . 0 0 "[ . 1 . 2 . 3]" 1
509 1 21 ILE MD 1 36 VAL MG2 . . 4.620 3.413 3.057 3.876 . 0 0 "[ . 1 . 2 . 3]" 1
510 1 21 ILE MD 1 61 ILE HA . . 5.500 4.256 3.185 4.636 . 0 0 "[ . 1 . 2 . 3]" 1
511 1 21 ILE MD 1 61 ILE MD . . 5.500 3.761 3.225 4.114 . 0 0 "[ . 1 . 2 . 3]" 1
512 1 21 ILE MD 1 64 VAL HB . . 5.430 5.021 3.988 5.429 . 0 0 "[ . 1 . 2 . 3]" 1
513 1 21 ILE MD 1 64 VAL MG1 . . 4.950 3.057 2.364 3.300 . 0 0 "[ . 1 . 2 . 3]" 1
514 1 21 ILE MD 1 64 VAL MG2 . . 5.180 4.619 3.981 4.883 . 0 0 "[ . 1 . 2 . 3]" 1
515 1 21 ILE MD 1 69 TYR QD . . 4.690 3.822 3.392 3.941 . 0 0 "[ . 1 . 2 . 3]" 1
516 1 21 ILE MD 1 69 TYR QE . . 4.020 2.134 1.992 2.235 . 0 0 "[ . 1 . 2 . 3]" 1
517 1 21 ILE HG12 1 61 ILE MG . . 5.290 4.057 3.838 4.301 . 0 0 "[ . 1 . 2 . 3]" 1
518 1 21 ILE HG12 1 64 VAL MG1 . . 4.600 2.810 2.474 3.223 . 0 0 "[ . 1 . 2 . 3]" 1
519 1 21 ILE HG12 1 64 VAL MG2 . . 4.400 3.869 3.431 4.300 . 0 0 "[ . 1 . 2 . 3]" 1
520 1 21 ILE HG12 1 69 TYR QE . . 4.660 3.273 3.050 3.535 . 0 0 "[ . 1 . 2 . 3]" 1
521 1 21 ILE HG13 1 69 TYR QE . . 4.400 4.426 4.289 4.483 0.083 3 0 "[ . 1 . 2 . 3]" 1
522 1 21 ILE MG 1 22 GLU H . . 4.250 3.773 3.338 4.091 . 0 0 "[ . 1 . 2 . 3]" 1
523 1 21 ILE MG 1 22 GLU HG3 . . 5.210 4.994 4.206 5.265 0.055 18 0 "[ . 1 . 2 . 3]" 1
524 1 21 ILE MG 1 24 THR HB . . 4.130 4.096 3.844 4.209 0.079 26 0 "[ . 1 . 2 . 3]" 1
525 1 21 ILE MG 1 36 VAL MG2 . . 3.610 3.179 2.687 3.628 0.018 1 0 "[ . 1 . 2 . 3]" 1
526 1 21 ILE MG 1 43 ALA H . . 5.400 5.124 4.817 5.442 0.042 17 0 "[ . 1 . 2 . 3]" 1
527 1 21 ILE MG 1 43 ALA MB . . 3.050 2.654 2.282 3.010 . 0 0 "[ . 1 . 2 . 3]" 1
528 1 22 GLU H 1 22 GLU HB2 . . 3.430 2.300 2.077 2.454 . 0 0 "[ . 1 . 2 . 3]" 1
529 1 22 GLU H 1 22 GLU HB3 . . 3.490 3.510 3.397 3.560 0.070 4 0 "[ . 1 . 2 . 3]" 1
530 1 22 GLU H 1 22 GLU HG2 . . 4.410 3.263 2.302 4.141 . 0 0 "[ . 1 . 2 . 3]" 1
531 1 22 GLU H 1 22 GLU HG3 . . 3.620 2.538 2.146 3.137 . 0 0 "[ . 1 . 2 . 3]" 1
532 1 22 GLU H 1 23 SER H . . 3.680 2.882 2.777 2.984 . 0 0 "[ . 1 . 2 . 3]" 1
533 1 22 GLU H 1 23 SER HA . . 5.500 5.444 5.368 5.506 0.006 23 0 "[ . 1 . 2 . 3]" 1
534 1 22 GLU H 1 23 SER QB . . 5.440 4.737 4.482 5.004 . 0 0 "[ . 1 . 2 . 3]" 1
535 1 22 GLU H 1 24 THR H . . 5.270 4.502 4.280 4.736 . 0 0 "[ . 1 . 2 . 3]" 1
536 1 22 GLU H 1 36 VAL MG1 . . 5.290 4.043 3.350 4.502 . 0 0 "[ . 1 . 2 . 3]" 1
537 1 22 GLU H 1 36 VAL MG2 . . 4.520 3.483 2.794 4.420 . 0 0 "[ . 1 . 2 . 3]" 1
538 1 22 GLU HA 1 22 GLU HB3 . . 2.910 2.595 2.509 2.796 . 0 0 "[ . 1 . 2 . 3]" 1
539 1 22 GLU HA 1 22 GLU HG2 . . 3.940 2.418 2.198 2.765 . 0 0 "[ . 1 . 2 . 3]" 1
540 1 22 GLU HA 1 22 GLU HG3 . . 3.660 3.120 2.446 3.689 0.029 24 0 "[ . 1 . 2 . 3]" 1
541 1 22 GLU HA 1 34 ILE MD . . 3.530 2.201 2.000 2.435 . 0 0 "[ . 1 . 2 . 3]" 1
542 1 22 GLU HB2 1 23 SER H . . 3.700 2.536 2.280 3.233 . 0 0 "[ . 1 . 2 . 3]" 1
543 1 22 GLU HB3 1 23 SER H . . 4.010 3.313 2.997 3.978 . 0 0 "[ . 1 . 2 . 3]" 1
544 1 22 GLU HG2 1 35 VAL HA . . 4.780 4.374 3.886 4.898 0.118 24 0 "[ . 1 . 2 . 3]" 1
545 1 22 GLU HG2 1 36 VAL H . . 4.620 3.646 2.941 4.663 0.043 7 0 "[ . 1 . 2 . 3]" 1
546 1 22 GLU HG2 1 36 VAL MG1 . . 3.810 3.408 2.486 3.934 0.124 4 0 "[ . 1 . 2 . 3]" 1
547 1 22 GLU HG3 1 23 SER H . . 5.360 4.556 4.317 4.892 . 0 0 "[ . 1 . 2 . 3]" 1
548 1 22 GLU HG3 1 34 ILE MD . . 5.500 4.332 3.168 5.043 . 0 0 "[ . 1 . 2 . 3]" 1
549 1 22 GLU HG3 1 34 ILE MG . . 5.110 4.755 3.948 5.133 0.023 4 0 "[ . 1 . 2 . 3]" 1
550 1 22 GLU HG3 1 35 VAL HA . . 5.460 5.404 4.395 5.510 0.050 6 0 "[ . 1 . 2 . 3]" 1
551 1 22 GLU HG3 1 36 VAL H . . 4.830 4.191 3.292 4.861 0.031 7 0 "[ . 1 . 2 . 3]" 1
552 1 22 GLU HG3 1 36 VAL HB . . 3.490 2.726 2.131 3.532 0.042 21 0 "[ . 1 . 2 . 3]" 1
553 1 22 GLU HG3 1 36 VAL MG1 . . 3.670 2.846 1.940 3.742 0.072 24 0 "[ . 1 . 2 . 3]" 1
554 1 22 GLU HG3 1 36 VAL MG2 . . 3.970 2.999 2.172 3.986 0.016 26 0 "[ . 1 . 2 . 3]" 1
555 1 23 SER H 1 23 SER QB . . 3.460 2.332 2.158 2.593 . 0 0 "[ . 1 . 2 . 3]" 1
556 1 23 SER H 1 24 THR H . . 3.460 2.887 2.500 2.977 . 0 0 "[ . 1 . 2 . 3]" 1
557 1 23 SER H 1 25 LEU H . . 5.400 4.380 3.827 4.571 . 0 0 "[ . 1 . 2 . 3]" 1
558 1 23 SER HA 1 23 SER QB . . 2.400 2.392 2.354 2.409 0.009 28 0 "[ . 1 . 2 . 3]" 1
559 1 23 SER HA 1 24 THR H . . 3.530 3.563 3.545 3.581 0.051 28 0 "[ . 1 . 2 . 3]" 1
560 1 23 SER HA 1 26 SER H . . 3.550 3.625 3.586 3.684 0.134 26 0 "[ . 1 . 2 . 3]" 1
561 1 23 SER QB 1 26 SER H . . 5.070 5.065 4.907 5.126 0.056 18 0 "[ . 1 . 2 . 3]" 1
562 1 24 THR H 1 24 THR HA . . 2.850 2.881 2.785 2.920 0.070 21 0 "[ . 1 . 2 . 3]" 1
563 1 24 THR H 1 24 THR HB . . 2.830 2.468 2.357 2.587 . 0 0 "[ . 1 . 2 . 3]" 1
564 1 24 THR H 1 24 THR MG . . 4.170 3.778 3.742 3.817 . 0 0 "[ . 1 . 2 . 3]" 1
565 1 24 THR H 1 25 LEU H . . 4.140 2.610 2.439 2.943 . 0 0 "[ . 1 . 2 . 3]" 1
566 1 24 THR H 1 25 LEU MD2 . . 5.680 4.112 3.682 5.280 . 0 0 "[ . 1 . 2 . 3]" 1
567 1 24 THR H 1 26 SER H . . 5.140 4.123 3.829 4.354 . 0 0 "[ . 1 . 2 . 3]" 1
568 1 24 THR HA 1 24 THR MG . . 3.140 2.449 2.366 2.539 . 0 0 "[ . 1 . 2 . 3]" 1
569 1 24 THR HA 1 27 ALA H . . 4.330 4.369 4.295 4.405 0.075 18 0 "[ . 1 . 2 . 3]" 1
570 1 24 THR HA 1 27 ALA MB . . 3.900 3.235 3.102 3.398 . 0 0 "[ . 1 . 2 . 3]" 1
571 1 24 THR HB 1 25 LEU H . . 3.710 2.799 2.590 2.922 . 0 0 "[ . 1 . 2 . 3]" 1
572 1 24 THR HB 1 25 LEU HB2 . . 5.200 4.847 4.465 5.145 . 0 0 "[ . 1 . 2 . 3]" 1
573 1 24 THR HB 1 25 LEU MD2 . . 4.350 2.791 2.285 3.790 . 0 0 "[ . 1 . 2 . 3]" 1
574 1 24 THR HB 1 64 VAL MG1 . . 3.850 3.908 3.867 3.975 0.125 30 0 "[ . 1 . 2 . 3]" 1
575 1 24 THR MG 1 25 LEU H . . 4.510 3.575 3.436 3.746 . 0 0 "[ . 1 . 2 . 3]" 1
576 1 24 THR MG 1 25 LEU HA . . 4.180 3.735 3.572 3.951 . 0 0 "[ . 1 . 2 . 3]" 1
577 1 24 THR MG 1 26 SER H . . 5.500 5.407 5.130 5.513 0.013 25 0 "[ . 1 . 2 . 3]" 1
578 1 24 THR MG 1 27 ALA H . . 5.230 5.150 4.905 5.259 0.029 8 0 "[ . 1 . 2 . 3]" 1
579 1 25 LEU H 1 25 LEU HB2 . . 3.610 2.325 2.196 2.472 . 0 0 "[ . 1 . 2 . 3]" 1
580 1 25 LEU H 1 25 LEU HB3 . . 4.030 3.572 3.512 3.650 . 0 0 "[ . 1 . 2 . 3]" 1
581 1 25 LEU H 1 25 LEU MD1 . . 4.770 4.111 3.836 4.203 . 0 0 "[ . 1 . 2 . 3]" 1
582 1 25 LEU H 1 25 LEU MD2 . . 4.490 2.490 2.242 3.213 . 0 0 "[ . 1 . 2 . 3]" 1
583 1 25 LEU H 1 25 LEU HG . . 4.920 3.394 2.402 3.712 . 0 0 "[ . 1 . 2 . 3]" 1
584 1 25 LEU H 1 26 SER H . . 3.540 2.689 2.633 2.743 . 0 0 "[ . 1 . 2 . 3]" 1
585 1 25 LEU H 1 27 ALA H . . 4.680 4.288 4.195 4.415 . 0 0 "[ . 1 . 2 . 3]" 1
586 1 25 LEU H 1 34 ILE MD . . 5.280 3.757 3.602 3.888 . 0 0 "[ . 1 . 2 . 3]" 1
587 1 25 LEU H 1 34 ILE MG . . 5.500 4.896 4.560 5.091 . 0 0 "[ . 1 . 2 . 3]" 1
588 1 25 LEU HA 1 25 LEU MD1 . . 3.520 2.774 2.279 3.582 0.062 23 0 "[ . 1 . 2 . 3]" 1
589 1 25 LEU HA 1 25 LEU MD2 . . 3.670 2.238 2.073 2.402 . 0 0 "[ . 1 . 2 . 3]" 1
590 1 25 LEU HA 1 25 LEU HG . . 3.840 3.703 3.348 3.811 . 0 0 "[ . 1 . 2 . 3]" 1
591 1 25 LEU HA 1 27 ALA H . . 4.180 3.512 3.351 3.607 . 0 0 "[ . 1 . 2 . 3]" 1
592 1 25 LEU HA 1 28 LEU MD1 . . 4.770 2.106 1.951 2.297 . 0 0 "[ . 1 . 2 . 3]" 1
593 1 25 LEU HA 1 28 LEU MD2 . . 3.580 3.624 3.587 3.645 0.065 25 0 "[ . 1 . 2 . 3]" 1
594 1 25 LEU HA 1 28 LEU HG . . 3.720 2.634 2.484 2.824 . 0 0 "[ . 1 . 2 . 3]" 1
595 1 25 LEU HA 1 31 VAL MG1 . . 4.760 3.946 3.682 4.092 . 0 0 "[ . 1 . 2 . 3]" 1
596 1 25 LEU HB2 1 26 SER H . . 4.010 2.780 2.639 3.182 . 0 0 "[ . 1 . 2 . 3]" 1
597 1 25 LEU HB2 1 26 SER HB3 . . 5.040 5.073 4.820 5.191 0.151 20 0 "[ . 1 . 2 . 3]" 1
598 1 25 LEU HB2 1 27 ALA H . . 5.090 4.864 4.777 5.144 0.054 30 0 "[ . 1 . 2 . 3]" 1
599 1 25 LEU HB2 1 34 ILE MD . . 3.770 2.050 1.978 2.119 . 0 0 "[ . 1 . 2 . 3]" 1
600 1 25 LEU HB3 1 26 SER H . . 4.180 3.586 3.412 4.071 . 0 0 "[ . 1 . 2 . 3]" 1
601 1 25 LEU MD1 1 26 SER H . . 5.000 4.926 4.797 5.045 0.045 21 0 "[ . 1 . 2 . 3]" 1
602 1 25 LEU MD1 1 28 LEU HG . . 5.520 4.420 4.003 5.506 . 0 0 "[ . 1 . 2 . 3]" 1
603 1 25 LEU MD1 1 45 VAL HA . . 4.670 4.654 4.382 4.736 0.066 13 0 "[ . 1 . 2 . 3]" 1
604 1 25 LEU MD1 1 45 VAL MG2 . . 2.880 2.163 1.985 2.313 . 0 0 "[ . 1 . 2 . 3]" 1
605 1 25 LEU MD1 1 60 ALA H . . 5.500 4.406 3.973 5.513 0.013 21 0 "[ . 1 . 2 . 3]" 1
606 1 25 LEU MD1 1 60 ALA MB . . 3.690 2.592 2.159 3.577 . 0 0 "[ . 1 . 2 . 3]" 1
607 1 25 LEU MD1 1 61 ILE HA . . 4.060 4.092 3.694 4.139 0.079 16 0 "[ . 1 . 2 . 3]" 1
608 1 25 LEU MD1 1 61 ILE HG13 . . 4.240 2.215 2.091 3.297 . 0 0 "[ . 1 . 2 . 3]" 1
609 1 25 LEU MD2 1 27 ALA H . . 5.500 5.051 4.842 5.134 . 0 0 "[ . 1 . 2 . 3]" 1
610 1 25 LEU MD2 1 60 ALA H . . 5.420 4.369 3.822 4.622 . 0 0 "[ . 1 . 2 . 3]" 1
611 1 25 LEU MD2 1 61 ILE H . . 4.760 2.967 2.681 3.141 . 0 0 "[ . 1 . 2 . 3]" 1
612 1 25 LEU MD2 1 61 ILE HA . . 3.290 2.478 2.296 2.909 . 0 0 "[ . 1 . 2 . 3]" 1
613 1 25 LEU MD2 1 61 ILE MD . . 4.540 3.546 3.438 3.623 . 0 0 "[ . 1 . 2 . 3]" 1
614 1 25 LEU MD2 1 61 ILE HG12 . . 4.320 2.178 2.086 2.484 . 0 0 "[ . 1 . 2 . 3]" 1
615 1 25 LEU MD2 1 61 ILE HG13 . . 3.940 2.568 2.227 3.390 . 0 0 "[ . 1 . 2 . 3]" 1
616 1 26 SER H 1 26 SER HB2 . . 3.460 2.569 2.312 3.537 0.077 30 0 "[ . 1 . 2 . 3]" 1
617 1 26 SER H 1 26 SER HB3 . . 3.630 2.551 2.360 2.723 . 0 0 "[ . 1 . 2 . 3]" 1
618 1 26 SER H 1 27 ALA H . . 3.320 2.965 2.772 3.069 . 0 0 "[ . 1 . 2 . 3]" 1
619 1 26 SER H 1 27 ALA MB . . 5.140 4.238 3.903 4.379 . 0 0 "[ . 1 . 2 . 3]" 1
620 1 26 SER H 1 28 LEU H . . 4.990 4.675 4.542 5.011 0.021 28 0 "[ . 1 . 2 . 3]" 1
621 1 26 SER H 1 34 ILE MD . . 4.510 3.424 3.290 3.653 . 0 0 "[ . 1 . 2 . 3]" 1
622 1 26 SER H 1 34 ILE MG . . 4.220 3.297 2.939 3.531 . 0 0 "[ . 1 . 2 . 3]" 1
623 1 26 SER HA 1 27 ALA H . . 3.430 3.107 3.026 3.339 . 0 0 "[ . 1 . 2 . 3]" 1
624 1 26 SER HA 1 28 LEU H . . 4.350 3.596 3.437 4.196 . 0 0 "[ . 1 . 2 . 3]" 1
625 1 26 SER HA 1 31 VAL MG1 . . 4.880 2.340 2.153 2.958 . 0 0 "[ . 1 . 2 . 3]" 1
626 1 26 SER HA 1 31 VAL MG2 . . 3.470 3.498 3.243 3.549 0.079 27 0 "[ . 1 . 2 . 3]" 1
627 1 26 SER HA 1 34 ILE HB . . 5.420 4.228 3.227 4.387 . 0 0 "[ . 1 . 2 . 3]" 1
628 1 26 SER HA 1 34 ILE MG . . 4.090 3.252 2.752 3.546 . 0 0 "[ . 1 . 2 . 3]" 1
629 1 26 SER HB3 1 34 ILE MG . . 3.330 3.333 2.367 3.405 0.075 16 0 "[ . 1 . 2 . 3]" 1
630 1 27 ALA H 1 27 ALA MB . . 3.040 2.379 2.342 2.423 . 0 0 "[ . 1 . 2 . 3]" 1
631 1 27 ALA H 1 28 LEU H . . 3.240 2.159 2.069 2.395 . 0 0 "[ . 1 . 2 . 3]" 1
632 1 27 ALA H 1 28 LEU HA . . 4.420 4.475 4.437 4.513 0.093 28 0 "[ . 1 . 2 . 3]" 1
633 1 27 ALA H 1 28 LEU HG . . 4.280 3.137 2.914 3.293 . 0 0 "[ . 1 . 2 . 3]" 1
634 1 27 ALA H 1 31 VAL HB . . 5.700 5.773 5.741 5.802 0.102 3 0 "[ . 1 . 2 . 3]" 1
635 1 27 ALA H 1 34 ILE MD . . 5.500 5.544 5.365 5.591 0.091 19 0 "[ . 1 . 2 . 3]" 1
636 1 27 ALA H 1 34 ILE MG . . 5.410 5.351 5.074 5.445 0.035 2 0 "[ . 1 . 2 . 3]" 1
637 1 27 ALA MB 1 28 LEU H . . 4.020 3.360 3.296 3.504 . 0 0 "[ . 1 . 2 . 3]" 1
638 1 27 ALA MB 1 28 LEU HG . . 4.780 3.703 3.512 3.896 . 0 0 "[ . 1 . 2 . 3]" 1
639 1 28 LEU H 1 28 LEU QB . . 2.950 2.422 2.350 2.571 . 0 0 "[ . 1 . 2 . 3]" 1
640 1 28 LEU H 1 28 LEU MD1 . . 4.210 3.392 3.318 3.492 . 0 0 "[ . 1 . 2 . 3]" 1
641 1 28 LEU H 1 28 LEU MD2 . . 4.200 3.694 3.630 3.773 . 0 0 "[ . 1 . 2 . 3]" 1
642 1 28 LEU H 1 28 LEU HG . . 3.270 2.372 2.268 2.483 . 0 0 "[ . 1 . 2 . 3]" 1
643 1 28 LEU H 1 31 VAL HB . . 4.100 4.185 4.063 4.240 0.140 25 0 "[ . 1 . 2 . 3]" 1
644 1 28 LEU H 1 31 VAL MG1 . . 4.600 2.287 1.947 2.417 . 0 0 "[ . 1 . 2 . 3]" 1
645 1 28 LEU H 1 31 VAL MG2 . . 4.940 4.573 4.195 4.732 . 0 0 "[ . 1 . 2 . 3]" 1
646 1 28 LEU QB 1 28 LEU MD2 . . 3.210 2.221 2.154 2.250 . 0 0 "[ . 1 . 2 . 3]" 1
647 1 28 LEU QB 1 30 TYR QD . . 5.110 2.739 2.598 2.937 . 0 0 "[ . 1 . 2 . 3]" 1
648 1 28 LEU QB 1 30 TYR QE . . 4.200 2.396 2.244 2.586 . 0 0 "[ . 1 . 2 . 3]" 1
649 1 28 LEU QB 1 31 VAL H . . 4.980 3.036 2.897 3.295 . 0 0 "[ . 1 . 2 . 3]" 1
650 1 28 LEU QB 1 31 VAL HB . . 4.530 2.500 2.370 2.788 . 0 0 "[ . 1 . 2 . 3]" 1
651 1 28 LEU QB 1 31 VAL MG1 . . 3.420 2.108 1.966 2.208 . 0 0 "[ . 1 . 2 . 3]" 1
652 1 28 LEU MD1 1 30 TYR QD . . 5.430 3.672 3.445 3.772 . 0 0 "[ . 1 . 2 . 3]" 1
653 1 28 LEU MD1 1 30 TYR QE . . 4.300 2.073 1.984 2.157 . 0 0 "[ . 1 . 2 . 3]" 1
654 1 28 LEU MD2 1 30 TYR QD . . 4.430 4.481 4.460 4.506 0.076 21 0 "[ . 1 . 2 . 3]" 1
655 1 28 LEU MD2 1 30 TYR QE . . 3.410 3.145 2.974 3.314 . 0 0 "[ . 1 . 2 . 3]" 1
656 1 28 LEU HG 1 31 VAL MG1 . . 4.070 3.528 2.860 3.742 . 0 0 "[ . 1 . 2 . 3]" 1
657 1 30 TYR HB2 1 47 TYR HB2 . . 3.630 3.498 3.312 3.642 0.012 14 0 "[ . 1 . 2 . 3]" 1
658 1 30 TYR HB2 1 48 ASN H . . 3.480 3.543 3.492 3.645 0.165 28 0 "[ . 1 . 2 . 3]" 1
659 1 30 TYR QD 1 31 VAL H . . 5.040 2.845 2.554 3.552 . 0 0 "[ . 1 . 2 . 3]" 1
660 1 30 TYR QD 1 31 VAL HA . . 4.990 3.278 3.043 4.053 . 0 0 "[ . 1 . 2 . 3]" 1
661 1 30 TYR QD 1 31 VAL HB . . 5.030 2.552 2.392 2.880 . 0 0 "[ . 1 . 2 . 3]" 1
662 1 30 TYR QD 1 31 VAL MG1 . . 3.550 3.583 3.540 3.613 0.063 16 0 "[ . 1 . 2 . 3]" 1
663 1 30 TYR QD 1 45 VAL MG1 . . 5.500 5.172 4.978 5.338 . 0 0 "[ . 1 . 2 . 3]" 1
664 1 30 TYR QD 1 47 TYR HA . . 5.140 4.671 4.338 4.854 . 0 0 "[ . 1 . 2 . 3]" 1
665 1 30 TYR QD 1 47 TYR HB2 . . 4.280 3.198 2.945 3.397 . 0 0 "[ . 1 . 2 . 3]" 1
666 1 30 TYR QD 1 47 TYR HB3 . . 5.070 3.963 3.611 4.246 . 0 0 "[ . 1 . 2 . 3]" 1
667 1 30 TYR QD 1 47 TYR QD . . 4.510 4.406 3.892 4.567 0.057 20 0 "[ . 1 . 2 . 3]" 1
668 1 30 TYR QD 1 48 ASN H . . 4.760 4.570 4.348 4.763 0.003 21 0 "[ . 1 . 2 . 3]" 1
669 1 30 TYR QD 1 56 SER HB2 . . 5.450 5.149 4.427 5.493 0.043 17 0 "[ . 1 . 2 . 3]" 1
670 1 30 TYR QD 1 57 LEU MD1 . . 5.490 4.857 4.676 5.051 . 0 0 "[ . 1 . 2 . 3]" 1
671 1 30 TYR QD 1 57 LEU MD2 . . 3.750 3.016 2.775 3.256 . 0 0 "[ . 1 . 2 . 3]" 1
672 1 30 TYR QE 1 31 VAL MG1 . . 4.220 4.222 4.049 4.254 0.034 24 0 "[ . 1 . 2 . 3]" 1
673 1 30 TYR QE 1 47 TYR HB2 . . 5.180 4.721 4.288 5.087 . 0 0 "[ . 1 . 2 . 3]" 1
674 1 30 TYR QE 1 47 TYR HB3 . . 5.460 4.909 4.638 5.465 0.005 28 0 "[ . 1 . 2 . 3]" 1
675 1 30 TYR QE 1 57 LEU HA . . 5.390 3.994 3.542 4.211 . 0 0 "[ . 1 . 2 . 3]" 1
676 1 30 TYR QE 1 57 LEU MD1 . . 5.500 4.564 4.292 4.853 . 0 0 "[ . 1 . 2 . 3]" 1
677 1 30 TYR QE 1 57 LEU MD2 . . 3.540 2.073 1.935 2.256 . 0 0 "[ . 1 . 2 . 3]" 1
678 1 31 VAL H 1 31 VAL HB . . 3.240 2.904 2.765 3.205 . 0 0 "[ . 1 . 2 . 3]" 1
679 1 31 VAL H 1 31 VAL MG1 . . 4.180 2.300 2.042 2.489 . 0 0 "[ . 1 . 2 . 3]" 1
680 1 31 VAL H 1 31 VAL MG2 . . 4.310 3.989 3.942 4.056 . 0 0 "[ . 1 . 2 . 3]" 1
681 1 31 VAL H 1 32 SER H . . 5.500 4.583 4.476 4.637 . 0 0 "[ . 1 . 2 . 3]" 1
682 1 31 VAL HA 1 31 VAL MG1 . . 3.500 3.170 3.136 3.220 . 0 0 "[ . 1 . 2 . 3]" 1
683 1 31 VAL HA 1 31 VAL MG2 . . 3.650 2.343 2.277 2.438 . 0 0 "[ . 1 . 2 . 3]" 1
684 1 31 VAL HA 1 32 SER H . . 3.110 2.220 2.146 2.307 . 0 0 "[ . 1 . 2 . 3]" 1
685 1 31 VAL HA 1 33 SER H . . 3.930 3.946 3.830 3.990 0.060 29 0 "[ . 1 . 2 . 3]" 1
686 1 31 VAL HA 1 45 VAL MG1 . . 4.760 4.496 4.366 4.609 . 0 0 "[ . 1 . 2 . 3]" 1
687 1 31 VAL HA 1 47 TYR H . . 5.500 4.719 4.626 4.810 . 0 0 "[ . 1 . 2 . 3]" 1
688 1 31 VAL HA 1 47 TYR HA . . 3.280 1.911 1.820 1.976 . 0 0 "[ . 1 . 2 . 3]" 1
689 1 31 VAL HA 1 47 TYR HB2 . . 4.020 2.546 2.367 3.151 . 0 0 "[ . 1 . 2 . 3]" 1
690 1 31 VAL HA 1 47 TYR HB3 . . 4.190 2.874 2.543 3.490 . 0 0 "[ . 1 . 2 . 3]" 1
691 1 31 VAL HA 1 47 TYR QD . . 5.130 4.469 4.303 4.941 . 0 0 "[ . 1 . 2 . 3]" 1
692 1 31 VAL HA 1 48 ASN H . . 4.150 2.869 2.516 3.511 . 0 0 "[ . 1 . 2 . 3]" 1
693 1 31 VAL HB 1 32 SER H . . 5.090 4.142 4.005 4.252 . 0 0 "[ . 1 . 2 . 3]" 1
694 1 31 VAL HB 1 45 VAL MG1 . . 5.400 3.683 3.449 3.851 . 0 0 "[ . 1 . 2 . 3]" 1
695 1 31 VAL HB 1 47 TYR HA . . 5.500 4.021 3.368 4.283 . 0 0 "[ . 1 . 2 . 3]" 1
696 1 31 VAL MG1 1 32 SER H . . 4.930 3.660 3.517 3.907 . 0 0 "[ . 1 . 2 . 3]" 1
697 1 31 VAL MG1 1 47 TYR HA . . 4.360 4.464 4.395 4.511 0.151 30 0 "[ . 1 . 2 . 3]" 1
698 1 31 VAL MG1 1 47 TYR HB2 . . 4.800 4.817 4.727 4.859 0.059 1 0 "[ . 1 . 2 . 3]" 1
699 1 31 VAL MG1 1 47 TYR HB3 . . 4.510 4.519 4.432 4.572 0.062 16 0 "[ . 1 . 2 . 3]" 1
700 1 31 VAL MG1 1 57 LEU MD1 . . 4.850 4.921 4.908 4.932 0.082 9 0 "[ . 1 . 2 . 3]" 1
701 1 31 VAL MG1 1 57 LEU MD2 . . 3.680 3.720 3.580 3.756 0.076 6 0 "[ . 1 . 2 . 3]" 1
702 1 31 VAL MG2 1 32 SER H . . 3.980 2.402 2.266 2.573 . 0 0 "[ . 1 . 2 . 3]" 1
703 1 31 VAL MG2 1 32 SER HA . . 4.890 4.237 4.023 4.398 . 0 0 "[ . 1 . 2 . 3]" 1
704 1 31 VAL MG2 1 32 SER HB3 . . 5.500 4.480 3.952 5.262 . 0 0 "[ . 1 . 2 . 3]" 1
705 1 31 VAL MG2 1 33 SER H . . 3.460 2.041 1.900 2.256 . 0 0 "[ . 1 . 2 . 3]" 1
706 1 31 VAL MG2 1 34 ILE H . . 4.700 4.768 4.701 4.801 0.101 21 0 "[ . 1 . 2 . 3]" 1
707 1 31 VAL MG2 1 34 ILE HA . . 4.900 4.446 4.387 4.503 . 0 0 "[ . 1 . 2 . 3]" 1
708 1 31 VAL MG2 1 45 VAL HA . . 4.170 3.867 3.757 3.995 . 0 0 "[ . 1 . 2 . 3]" 1
709 1 31 VAL MG2 1 45 VAL MG1 . . 3.590 2.039 1.953 2.137 . 0 0 "[ . 1 . 2 . 3]" 1
710 1 31 VAL MG2 1 46 VAL H . . 5.240 2.896 2.815 2.987 . 0 0 "[ . 1 . 2 . 3]" 1
711 1 31 VAL MG2 1 47 TYR HA . . 4.940 2.632 2.363 2.875 . 0 0 "[ . 1 . 2 . 3]" 1
712 1 31 VAL MG2 1 47 TYR HB2 . . 5.500 3.308 3.110 3.579 . 0 0 "[ . 1 . 2 . 3]" 1
713 1 31 VAL MG2 1 47 TYR HB3 . . 4.920 2.239 2.107 2.640 . 0 0 "[ . 1 . 2 . 3]" 1
714 1 32 SER H 1 32 SER HB2 . . 3.630 2.689 2.260 3.091 . 0 0 "[ . 1 . 2 . 3]" 1
715 1 32 SER H 1 33 SER H . . 3.080 2.173 2.063 2.393 . 0 0 "[ . 1 . 2 . 3]" 1
716 1 32 SER H 1 45 VAL MG1 . . 5.500 4.755 4.614 4.966 . 0 0 "[ . 1 . 2 . 3]" 1
717 1 32 SER H 1 46 VAL HB . . 4.840 4.193 3.879 4.415 . 0 0 "[ . 1 . 2 . 3]" 1
718 1 32 SER H 1 46 VAL MG1 . . 4.920 3.879 3.589 4.089 . 0 0 "[ . 1 . 2 . 3]" 1
719 1 32 SER H 1 47 TYR HA . . 3.850 1.981 1.739 2.603 . 0 0 "[ . 1 . 2 . 3]" 1
720 1 32 SER H 1 47 TYR HB2 . . 5.200 4.112 3.819 4.779 . 0 0 "[ . 1 . 2 . 3]" 1
721 1 32 SER H 1 47 TYR HB3 . . 5.380 3.938 3.654 4.651 . 0 0 "[ . 1 . 2 . 3]" 1
722 1 32 SER H 1 48 ASN H . . 5.480 3.605 3.185 4.431 . 0 0 "[ . 1 . 2 . 3]" 1
723 1 32 SER H 1 48 ASN HB2 . . 5.500 4.554 4.017 5.507 0.007 28 0 "[ . 1 . 2 . 3]" 1
724 1 32 SER HA 1 32 SER HB3 . . 3.020 2.937 2.422 3.043 0.023 12 0 "[ . 1 . 2 . 3]" 1
725 1 32 SER HB2 1 47 TYR HA . . 5.380 3.580 2.982 4.961 . 0 0 "[ . 1 . 2 . 3]" 1
726 1 32 SER HB2 1 48 ASN HA . . 5.000 4.506 4.115 5.056 0.056 10 0 "[ . 1 . 2 . 3]" 1
727 1 32 SER HB3 1 46 VAL MG1 . . 3.660 2.895 2.210 3.701 0.041 20 0 "[ . 1 . 2 . 3]" 1
728 1 32 SER HB3 1 47 TYR HA . . 5.500 3.901 3.238 5.039 . 0 0 "[ . 1 . 2 . 3]" 1
729 1 32 SER HB3 1 48 ASN HB2 . . 4.300 4.195 3.708 4.378 0.078 28 0 "[ . 1 . 2 . 3]" 1
730 1 33 SER H 1 33 SER HB3 . . 3.910 3.867 3.321 3.942 0.032 17 0 "[ . 1 . 2 . 3]" 1
731 1 33 SER H 1 34 ILE H . . 4.330 4.330 4.296 4.391 0.061 29 0 "[ . 1 . 2 . 3]" 1
732 1 33 SER H 1 34 ILE HA . . 5.190 5.038 4.880 5.140 . 0 0 "[ . 1 . 2 . 3]" 1
733 1 33 SER H 1 34 ILE MG . . 5.500 4.683 4.388 5.114 . 0 0 "[ . 1 . 2 . 3]" 1
734 1 33 SER H 1 45 VAL MG1 . . 5.130 4.368 4.215 4.533 . 0 0 "[ . 1 . 2 . 3]" 1
735 1 33 SER H 1 46 VAL H . . 4.660 3.420 3.200 3.591 . 0 0 "[ . 1 . 2 . 3]" 1
736 1 33 SER H 1 46 VAL HB . . 3.250 2.921 2.474 3.184 . 0 0 "[ . 1 . 2 . 3]" 1
737 1 33 SER H 1 46 VAL MG1 . . 4.260 3.702 3.503 3.955 . 0 0 "[ . 1 . 2 . 3]" 1
738 1 33 SER H 1 46 VAL MG2 . . 4.600 4.410 4.008 4.608 0.008 15 0 "[ . 1 . 2 . 3]" 1
739 1 33 SER H 1 47 TYR HA . . 4.970 3.783 3.680 4.050 . 0 0 "[ . 1 . 2 . 3]" 1
740 1 33 SER HA 1 33 SER HB2 . . 2.940 2.949 2.634 2.990 0.050 23 0 "[ . 1 . 2 . 3]" 1
741 1 33 SER HA 1 34 ILE H . . 2.570 2.437 2.366 2.501 . 0 0 "[ . 1 . 2 . 3]" 1
742 1 33 SER HA 1 34 ILE HA . . 4.860 4.640 4.509 4.694 . 0 0 "[ . 1 . 2 . 3]" 1
743 1 33 SER HA 1 34 ILE HB . . 5.500 4.361 4.104 4.554 . 0 0 "[ . 1 . 2 . 3]" 1
744 1 33 SER HA 1 34 ILE MG . . 4.610 3.247 3.054 3.641 . 0 0 "[ . 1 . 2 . 3]" 1
745 1 33 SER HA 1 46 VAL HB . . 5.430 4.061 3.945 4.166 . 0 0 "[ . 1 . 2 . 3]" 1
746 1 33 SER HB2 1 34 ILE H . . 3.510 3.595 3.157 3.660 0.150 4 0 "[ . 1 . 2 . 3]" 1
747 1 33 SER HB2 1 34 ILE HA . . 5.130 5.043 3.938 5.275 0.145 19 0 "[ . 1 . 2 . 3]" 1
748 1 33 SER HB2 1 46 VAL MG1 . . 3.580 2.629 2.452 3.592 0.012 22 0 "[ . 1 . 2 . 3]" 1
749 1 33 SER HB2 1 46 VAL MG2 . . 3.480 3.189 2.301 3.503 0.023 18 0 "[ . 1 . 2 . 3]" 1
750 1 33 SER HB3 1 34 ILE H . . 3.930 2.299 2.173 2.999 . 0 0 "[ . 1 . 2 . 3]" 1
751 1 33 SER HB3 1 46 VAL H . . 5.240 4.388 3.619 5.126 . 0 0 "[ . 1 . 2 . 3]" 1
752 1 33 SER HB3 1 46 VAL HA . . 6.000 5.746 5.003 6.246 0.246 29 0 "[ . 1 . 2 . 3]" 1
753 1 33 SER HB3 1 46 VAL HB . . 3.360 2.803 2.166 3.391 0.031 29 0 "[ . 1 . 2 . 3]" 1
754 1 33 SER HB3 1 46 VAL MG1 . . 3.460 3.508 3.297 3.565 0.105 29 0 "[ . 1 . 2 . 3]" 1
755 1 33 SER HB3 1 46 VAL MG2 . . 3.740 2.999 2.361 3.530 . 0 0 "[ . 1 . 2 . 3]" 1
756 1 34 ILE H 1 34 ILE MD . . 5.500 5.046 4.974 5.094 . 0 0 "[ . 1 . 2 . 3]" 1
757 1 34 ILE H 1 34 ILE MG . . 3.470 2.680 2.559 2.769 . 0 0 "[ . 1 . 2 . 3]" 1
758 1 34 ILE H 1 45 VAL HA . . 5.500 4.877 4.726 5.018 . 0 0 "[ . 1 . 2 . 3]" 1
759 1 34 ILE H 1 46 VAL H . . 5.080 4.338 4.149 4.521 . 0 0 "[ . 1 . 2 . 3]" 1
760 1 34 ILE H 1 46 VAL HB . . 5.050 4.058 3.873 4.585 . 0 0 "[ . 1 . 2 . 3]" 1
761 1 34 ILE H 1 46 VAL MG2 . . 4.940 3.881 3.402 4.199 . 0 0 "[ . 1 . 2 . 3]" 1
762 1 34 ILE HA 1 34 ILE MD . . 4.310 3.745 3.669 3.844 . 0 0 "[ . 1 . 2 . 3]" 1
763 1 34 ILE HA 1 34 ILE HG12 . . 3.600 3.268 2.518 3.375 . 0 0 "[ . 1 . 2 . 3]" 1
764 1 34 ILE HA 1 35 VAL H . . 2.970 2.215 2.157 2.314 . 0 0 "[ . 1 . 2 . 3]" 1
765 1 34 ILE HA 1 35 VAL HA . . 4.750 4.539 4.514 4.606 . 0 0 "[ . 1 . 2 . 3]" 1
766 1 34 ILE HA 1 35 VAL HB . . 4.590 4.501 4.383 4.600 0.010 28 0 "[ . 1 . 2 . 3]" 1
767 1 34 ILE HA 1 43 ALA MB . . 5.500 5.285 5.099 5.499 . 0 0 "[ . 1 . 2 . 3]" 1
768 1 34 ILE HA 1 44 ILE H . . 5.220 4.870 4.756 4.994 . 0 0 "[ . 1 . 2 . 3]" 1
769 1 34 ILE HA 1 44 ILE HB . . 5.500 4.939 4.720 5.108 . 0 0 "[ . 1 . 2 . 3]" 1
770 1 34 ILE HA 1 45 VAL H . . 5.420 4.767 4.679 4.930 . 0 0 "[ . 1 . 2 . 3]" 1
771 1 34 ILE HA 1 45 VAL HA . . 2.850 2.266 2.134 2.404 . 0 0 "[ . 1 . 2 . 3]" 1
772 1 34 ILE HA 1 46 VAL H . . 4.260 2.896 2.656 3.106 . 0 0 "[ . 1 . 2 . 3]" 1
773 1 34 ILE HB 1 35 VAL H . . 4.230 3.942 3.864 4.049 . 0 0 "[ . 1 . 2 . 3]" 1
774 1 34 ILE HB 1 45 VAL HA . . 4.260 2.973 2.671 3.354 . 0 0 "[ . 1 . 2 . 3]" 1
775 1 34 ILE HB 1 45 VAL MG1 . . 4.100 2.635 2.362 3.126 . 0 0 "[ . 1 . 2 . 3]" 1
776 1 34 ILE MD 1 35 VAL H . . 4.100 3.889 3.437 3.976 . 0 0 "[ . 1 . 2 . 3]" 1
777 1 34 ILE MD 1 35 VAL HA . . 5.500 4.906 4.023 5.097 . 0 0 "[ . 1 . 2 . 3]" 1
778 1 34 ILE MD 1 36 VAL H . . 5.470 4.999 3.796 5.489 0.019 2 0 "[ . 1 . 2 . 3]" 1
779 1 34 ILE MD 1 45 VAL HA . . 4.460 3.464 3.157 3.991 . 0 0 "[ . 1 . 2 . 3]" 1
780 1 34 ILE HG12 1 35 VAL H . . 3.900 2.638 1.896 2.780 . 0 0 "[ . 1 . 2 . 3]" 1
781 1 34 ILE HG13 1 35 VAL H . . 3.410 2.366 2.167 3.395 . 0 0 "[ . 1 . 2 . 3]" 1
782 1 34 ILE MG 1 35 VAL H . . 5.010 3.774 3.360 3.866 . 0 0 "[ . 1 . 2 . 3]" 1
783 1 34 ILE MG 1 35 VAL HA . . 4.950 3.741 3.131 3.909 . 0 0 "[ . 1 . 2 . 3]" 1
784 1 34 ILE MG 1 36 VAL H . . 5.500 4.750 3.902 5.257 . 0 0 "[ . 1 . 2 . 3]" 1
785 1 34 ILE MG 1 45 VAL HA . . 5.080 4.424 4.224 4.629 . 0 0 "[ . 1 . 2 . 3]" 1
786 1 35 VAL H 1 35 VAL HB . . 3.750 2.808 2.711 2.920 . 0 0 "[ . 1 . 2 . 3]" 1
787 1 35 VAL H 1 35 VAL MG2 . . 4.400 3.370 3.303 3.532 . 0 0 "[ . 1 . 2 . 3]" 1
788 1 35 VAL H 1 36 VAL H . . 5.000 4.154 3.869 4.335 . 0 0 "[ . 1 . 2 . 3]" 1
789 1 35 VAL H 1 43 ALA HA . . 4.830 4.752 4.578 4.873 0.043 7 0 "[ . 1 . 2 . 3]" 1
790 1 35 VAL H 1 44 ILE H . . 4.070 3.174 3.031 3.269 . 0 0 "[ . 1 . 2 . 3]" 1
791 1 35 VAL H 1 44 ILE HB . . 4.450 3.513 3.314 3.737 . 0 0 "[ . 1 . 2 . 3]" 1
792 1 35 VAL H 1 45 VAL HA . . 4.560 3.502 3.365 3.622 . 0 0 "[ . 1 . 2 . 3]" 1
793 1 35 VAL H 1 46 VAL H . . 5.500 4.904 4.727 5.088 . 0 0 "[ . 1 . 2 . 3]" 1
794 1 35 VAL HA 1 35 VAL MG1 . . 3.340 2.613 2.566 2.655 . 0 0 "[ . 1 . 2 . 3]" 1
795 1 35 VAL HA 1 35 VAL MG2 . . 3.370 2.234 2.186 2.291 . 0 0 "[ . 1 . 2 . 3]" 1
796 1 35 VAL HA 1 36 VAL H . . 2.790 2.152 1.974 2.325 . 0 0 "[ . 1 . 2 . 3]" 1
797 1 35 VAL HA 1 44 ILE H . . 5.500 4.953 4.880 5.030 . 0 0 "[ . 1 . 2 . 3]" 1
798 1 35 VAL HB 1 36 VAL H . . 4.670 4.217 4.025 4.373 . 0 0 "[ . 1 . 2 . 3]" 1
799 1 35 VAL HB 1 43 ALA HA . . 5.500 5.578 5.534 5.623 0.123 30 0 "[ . 1 . 2 . 3]" 1
800 1 35 VAL HB 1 44 ILE H . . 4.770 3.976 3.817 4.109 . 0 0 "[ . 1 . 2 . 3]" 1
801 1 35 VAL HB 1 44 ILE HB . . 3.690 2.845 2.515 3.171 . 0 0 "[ . 1 . 2 . 3]" 1
802 1 35 VAL HB 1 44 ILE MG . . 4.220 3.846 3.511 4.177 . 0 0 "[ . 1 . 2 . 3]" 1
803 1 35 VAL MG2 1 36 VAL H . . 3.630 3.711 3.669 3.742 0.112 30 0 "[ . 1 . 2 . 3]" 1
804 1 36 VAL H 1 36 VAL HB . . 3.390 2.754 2.439 3.302 . 0 0 "[ . 1 . 2 . 3]" 1
805 1 36 VAL H 1 36 VAL MG1 . . 4.000 3.184 2.075 3.893 . 0 0 "[ . 1 . 2 . 3]" 1
806 1 36 VAL H 1 37 SER H . . 4.840 4.536 4.324 4.660 . 0 0 "[ . 1 . 2 . 3]" 1
807 1 36 VAL H 1 43 ALA HA . . 5.340 4.830 4.585 4.975 . 0 0 "[ . 1 . 2 . 3]" 1
808 1 36 VAL HA 1 36 VAL MG2 . . 2.970 2.295 2.191 2.423 . 0 0 "[ . 1 . 2 . 3]" 1
809 1 36 VAL HA 1 37 SER H . . 2.910 2.161 1.981 2.351 . 0 0 "[ . 1 . 2 . 3]" 1
810 1 36 VAL HA 1 43 ALA HA . . 2.980 2.107 1.958 2.263 . 0 0 "[ . 1 . 2 . 3]" 1
811 1 36 VAL HA 1 43 ALA MB . . 3.620 3.305 2.885 3.636 0.016 4 0 "[ . 1 . 2 . 3]" 1
812 1 36 VAL HB 1 37 SER H . . 4.510 4.065 3.890 4.205 . 0 0 "[ . 1 . 2 . 3]" 1
813 1 36 VAL HB 1 43 ALA HA . . 5.400 4.225 3.104 4.909 . 0 0 "[ . 1 . 2 . 3]" 1
814 1 36 VAL MG1 1 43 ALA MB . . 4.140 3.740 3.102 4.245 0.105 1 0 "[ . 1 . 2 . 3]" 1
815 1 36 VAL MG2 1 37 SER H . . 3.550 2.947 2.082 3.606 0.056 4 0 "[ . 1 . 2 . 3]" 1
816 1 36 VAL MG2 1 38 LEU H . . 5.500 5.216 4.352 5.681 0.181 24 0 "[ . 1 . 2 . 3]" 1
817 1 36 VAL MG2 1 42 SER H . . 5.360 4.562 3.506 5.415 0.055 27 0 "[ . 1 . 2 . 3]" 1
818 1 36 VAL MG2 1 43 ALA H . . 5.500 4.212 3.779 4.531 . 0 0 "[ . 1 . 2 . 3]" 1
819 1 36 VAL MG2 1 43 ALA HA . . 3.650 2.574 2.255 2.983 . 0 0 "[ . 1 . 2 . 3]" 1
820 1 36 VAL MG2 1 43 ALA MB . . 3.660 2.108 2.004 2.401 . 0 0 "[ . 1 . 2 . 3]" 1
821 1 37 SER H 1 37 SER HB2 . . 3.440 2.457 2.212 3.523 0.083 21 0 "[ . 1 . 2 . 3]" 1
822 1 37 SER H 1 37 SER HB3 . . 3.780 3.442 2.708 3.667 . 0 0 "[ . 1 . 2 . 3]" 1
823 1 37 SER H 1 38 LEU H . . 4.580 4.219 3.883 4.594 0.014 13 0 "[ . 1 . 2 . 3]" 1
824 1 37 SER H 1 42 SER H . . 4.050 3.764 3.432 4.067 0.017 22 0 "[ . 1 . 2 . 3]" 1
825 1 37 SER H 1 42 SER HB2 . . 5.180 4.962 4.559 5.234 0.054 24 0 "[ . 1 . 2 . 3]" 1
826 1 37 SER H 1 43 ALA HA . . 3.930 3.133 2.733 3.599 . 0 0 "[ . 1 . 2 . 3]" 1
827 1 37 SER H 1 43 ALA MB . . 4.910 4.271 3.844 4.619 . 0 0 "[ . 1 . 2 . 3]" 1
828 1 37 SER HA 1 37 SER HB3 . . 2.940 2.571 2.332 2.986 0.046 12 0 "[ . 1 . 2 . 3]" 1
829 1 37 SER HA 1 38 LEU H . . 2.970 2.265 2.081 2.391 . 0 0 "[ . 1 . 2 . 3]" 1
830 1 37 SER HB2 1 40 ASN HB2 . . 4.030 2.619 2.141 3.191 . 0 0 "[ . 1 . 2 . 3]" 1
831 1 37 SER HB2 1 40 ASN HB3 . . 4.040 3.796 2.963 4.148 0.108 24 0 "[ . 1 . 2 . 3]" 1
832 1 37 SER HB2 1 42 SER H . . 4.120 2.934 1.944 4.163 0.043 9 0 "[ . 1 . 2 . 3]" 1
833 1 37 SER HB3 1 38 LEU H . . 4.050 3.919 2.983 4.200 0.150 23 0 "[ . 1 . 2 . 3]" 1
834 1 37 SER HB3 1 39 GLU H . . 4.480 3.729 2.928 4.317 . 0 0 "[ . 1 . 2 . 3]" 1
835 1 37 SER HB3 1 40 ASN H . . 4.270 2.672 1.846 3.623 . 0 0 "[ . 1 . 2 . 3]" 1
836 1 37 SER HB3 1 40 ASN HD22 . . 5.390 5.031 4.023 5.470 0.080 21 0 "[ . 1 . 2 . 3]" 1
837 1 37 SER HB3 1 42 SER H . . 4.110 3.920 3.070 4.191 0.081 14 0 "[ . 1 . 2 . 3]" 1
838 1 38 LEU H 1 38 LEU HB2 . . 3.380 2.190 1.937 2.666 . 0 0 "[ . 1 . 2 . 3]" 1
839 1 38 LEU H 1 38 LEU HB3 . . 3.470 2.973 2.318 3.472 0.002 17 0 "[ . 1 . 2 . 3]" 1
840 1 38 LEU H 1 38 LEU MD1 . . 4.300 4.123 3.291 4.373 0.073 24 0 "[ . 1 . 2 . 3]" 1
841 1 38 LEU H 1 38 LEU MD2 . . 4.580 4.117 3.626 4.460 . 0 0 "[ . 1 . 2 . 3]" 1
842 1 38 LEU H 1 39 GLU H . . 3.440 2.843 1.940 3.222 . 0 0 "[ . 1 . 2 . 3]" 1
843 1 38 LEU H 1 39 GLU HA . . 5.470 5.433 4.721 5.639 0.169 18 0 "[ . 1 . 2 . 3]" 1
844 1 38 LEU H 1 40 ASN H . . 5.500 4.300 3.350 4.818 . 0 0 "[ . 1 . 2 . 3]" 1
845 1 38 LEU HA 1 38 LEU MD2 . . 3.640 2.512 1.997 3.735 0.095 5 0 "[ . 1 . 2 . 3]" 1
846 1 38 LEU HB2 1 38 LEU MD2 . . 3.300 2.861 2.188 3.284 . 0 0 "[ . 1 . 2 . 3]" 1
847 1 38 LEU HB2 1 39 GLU H . . 3.750 3.625 2.882 3.858 0.108 6 0 "[ . 1 . 2 . 3]" 1
848 1 38 LEU HB3 1 38 LEU MD2 . . 3.670 2.708 2.237 3.256 . 0 0 "[ . 1 . 2 . 3]" 1
849 1 38 LEU HB3 1 39 GLU H . . 3.340 2.858 2.439 3.376 0.036 23 0 "[ . 1 . 2 . 3]" 1
850 1 38 LEU HB3 1 40 ASN H . . 5.500 5.180 4.785 5.582 0.082 12 0 "[ . 1 . 2 . 3]" 1
851 1 38 LEU MD2 1 39 GLU H . . 4.590 4.480 3.928 4.631 0.041 9 0 "[ . 1 . 2 . 3]" 1
852 1 38 LEU MD2 1 39 GLU HA . . 5.010 4.769 3.692 5.100 0.090 1 0 "[ . 1 . 2 . 3]" 1
853 1 39 GLU H 1 39 GLU HB2 . . 3.240 2.533 1.940 3.460 0.220 9 0 "[ . 1 . 2 . 3]" 1
854 1 39 GLU H 1 39 GLU HB3 . . 3.640 2.842 2.314 3.662 0.022 26 0 "[ . 1 . 2 . 3]" 1
855 1 39 GLU H 1 39 GLU HG2 . . 4.400 3.829 2.014 4.472 0.072 15 0 "[ . 1 . 2 . 3]" 1
856 1 39 GLU H 1 39 GLU HG3 . . 4.320 4.022 2.222 4.509 0.189 14 0 "[ . 1 . 2 . 3]" 1
857 1 39 GLU H 1 40 ASN H . . 3.510 2.599 2.242 2.964 . 0 0 "[ . 1 . 2 . 3]" 1
858 1 39 GLU H 1 40 ASN HB2 . . 5.500 4.690 4.184 5.203 . 0 0 "[ . 1 . 2 . 3]" 1
859 1 39 GLU H 1 40 ASN HD21 . . 5.500 4.652 3.730 5.536 0.036 2 0 "[ . 1 . 2 . 3]" 1
860 1 39 GLU HA 1 39 GLU HB2 . . 3.080 2.646 2.218 3.044 . 0 0 "[ . 1 . 2 . 3]" 1
861 1 39 GLU HA 1 39 GLU HG2 . . 4.010 3.048 2.332 3.956 . 0 0 "[ . 1 . 2 . 3]" 1
862 1 39 GLU HA 1 39 GLU HG3 . . 3.990 3.315 2.544 4.159 0.169 13 0 "[ . 1 . 2 . 3]" 1
863 1 39 GLU HA 1 40 ASN HD21 . . 5.500 4.752 4.056 5.455 . 0 0 "[ . 1 . 2 . 3]" 1
864 1 39 GLU HA 1 40 ASN HD22 . . 5.490 5.497 5.236 5.613 0.123 25 0 "[ . 1 . 2 . 3]" 1
865 1 39 GLU HB2 1 40 ASN H . . 3.710 3.592 2.704 3.837 0.127 7 0 "[ . 1 . 2 . 3]" 1
866 1 39 GLU HB2 1 40 ASN HD22 . . 4.660 4.360 3.451 4.747 0.087 15 0 "[ . 1 . 2 . 3]" 1
867 1 39 GLU HB3 1 40 ASN H . . 4.170 3.101 2.030 4.302 0.132 30 0 "[ . 1 . 2 . 3]" 1
868 1 39 GLU HB3 1 40 ASN HD21 . . 5.500 3.208 1.924 4.892 . 0 0 "[ . 1 . 2 . 3]" 1
869 1 40 ASN H 1 40 ASN HB2 . . 3.370 2.492 2.145 2.817 . 0 0 "[ . 1 . 2 . 3]" 1
870 1 40 ASN H 1 40 ASN HB3 . . 3.740 3.627 3.442 3.824 0.084 30 0 "[ . 1 . 2 . 3]" 1
871 1 40 ASN H 1 40 ASN HD21 . . 4.910 2.975 2.023 3.550 . 0 0 "[ . 1 . 2 . 3]" 1
872 1 40 ASN HA 1 40 ASN HD21 . . 3.790 2.832 2.042 3.691 . 0 0 "[ . 1 . 2 . 3]" 1
873 1 40 ASN HA 1 40 ASN HD22 . . 3.560 3.651 3.571 3.730 0.170 21 0 "[ . 1 . 2 . 3]" 1
874 1 40 ASN HA 1 41 ARG H . . 3.250 2.554 2.186 3.153 . 0 0 "[ . 1 . 2 . 3]" 1
875 1 40 ASN HA 1 41 ARG HD2 . . 4.140 3.854 2.687 4.243 0.103 8 0 "[ . 1 . 2 . 3]" 1
876 1 40 ASN HA 1 41 ARG HD3 . . 4.410 4.100 3.008 4.547 0.137 24 0 "[ . 1 . 2 . 3]" 1
877 1 40 ASN HA 1 42 SER H . . 4.780 4.568 4.244 4.810 0.030 4 0 "[ . 1 . 2 . 3]" 1
878 1 40 ASN HB2 1 41 ARG H . . 4.630 3.432 2.837 4.232 . 0 0 "[ . 1 . 2 . 3]" 1
879 1 40 ASN HB2 1 42 SER H . . 4.330 3.363 2.386 4.064 . 0 0 "[ . 1 . 2 . 3]" 1
880 1 40 ASN HB3 1 41 ARG H . . 4.570 2.271 1.842 4.451 . 0 0 "[ . 1 . 2 . 3]" 1
881 1 40 ASN HB3 1 42 SER H . . 4.540 3.364 2.908 4.337 . 0 0 "[ . 1 . 2 . 3]" 1
882 1 40 ASN HB3 1 42 SER HB3 . . 4.820 4.437 4.057 4.838 0.018 16 0 "[ . 1 . 2 . 3]" 1
883 1 41 ARG H 1 41 ARG HB2 . . 4.060 3.346 2.496 3.929 . 0 0 "[ . 1 . 2 . 3]" 1
884 1 41 ARG H 1 41 ARG HB3 . . 3.870 3.292 2.661 3.909 0.039 4 0 "[ . 1 . 2 . 3]" 1
885 1 41 ARG H 1 41 ARG HD2 . . 5.270 3.057 2.058 4.163 . 0 0 "[ . 1 . 2 . 3]" 1
886 1 41 ARG H 1 41 ARG HG2 . . 4.720 3.138 1.838 4.755 0.035 17 0 "[ . 1 . 2 . 3]" 1
887 1 41 ARG H 1 41 ARG HG3 . . 4.470 3.575 2.645 4.304 . 0 0 "[ . 1 . 2 . 3]" 1
888 1 41 ARG H 1 42 SER H . . 3.400 3.071 2.698 3.473 0.073 2 0 "[ . 1 . 2 . 3]" 1
889 1 41 ARG HA 1 41 ARG HD2 . . 4.890 4.179 2.821 4.750 . 0 0 "[ . 1 . 2 . 3]" 1
890 1 41 ARG HA 1 41 ARG HG2 . . 3.930 3.637 3.284 3.854 . 0 0 "[ . 1 . 2 . 3]" 1
891 1 41 ARG HA 1 42 SER H . . 3.060 2.888 2.687 3.126 0.066 5 0 "[ . 1 . 2 . 3]" 1
892 1 41 ARG HB2 1 41 ARG HD3 . . 4.010 3.447 2.136 4.129 0.119 5 0 "[ . 1 . 2 . 3]" 1
893 1 41 ARG HB2 1 42 SER H . . 4.770 4.463 4.105 4.626 . 0 0 "[ . 1 . 2 . 3]" 1
894 1 41 ARG HB3 1 41 ARG HD2 . . 3.840 2.914 2.099 4.059 0.219 12 0 "[ . 1 . 2 . 3]" 1
895 1 41 ARG HB3 1 41 ARG HD3 . . 3.520 3.434 3.105 3.645 0.125 5 0 "[ . 1 . 2 . 3]" 1
896 1 41 ARG HB3 1 42 SER H . . 5.190 4.664 4.485 4.812 . 0 0 "[ . 1 . 2 . 3]" 1
897 1 42 SER H 1 42 SER HB2 . . 3.740 3.760 3.659 3.807 0.067 23 0 "[ . 1 . 2 . 3]" 1
898 1 42 SER H 1 43 ALA H . . 5.000 4.474 4.415 4.543 . 0 0 "[ . 1 . 2 . 3]" 1
899 1 42 SER HA 1 43 ALA H . . 2.860 2.255 2.149 2.351 . 0 0 "[ . 1 . 2 . 3]" 1
900 1 42 SER HA 1 43 ALA HA . . 5.220 4.502 4.436 4.554 . 0 0 "[ . 1 . 2 . 3]" 1
901 1 42 SER HA 1 43 ALA MB . . 4.960 3.731 3.633 3.863 . 0 0 "[ . 1 . 2 . 3]" 1
902 1 42 SER HB2 1 43 ALA H . . 3.930 2.514 2.303 2.817 . 0 0 "[ . 1 . 2 . 3]" 1
903 1 42 SER HB3 1 43 ALA H . . 3.440 3.493 3.362 3.550 0.110 26 0 "[ . 1 . 2 . 3]" 1
904 1 43 ALA H 1 44 ILE HG13 . . 4.670 4.708 4.685 4.726 0.056 16 0 "[ . 1 . 2 . 3]" 1
905 1 43 ALA HA 1 44 ILE H . . 2.900 2.150 2.073 2.199 . 0 0 "[ . 1 . 2 . 3]" 1
906 1 43 ALA HA 1 44 ILE HB . . 4.620 4.540 4.480 4.627 0.007 5 0 "[ . 1 . 2 . 3]" 1
907 1 43 ALA HA 1 44 ILE HG13 . . 5.280 3.853 3.645 4.005 . 0 0 "[ . 1 . 2 . 3]" 1
908 1 43 ALA MB 1 44 ILE H . . 4.070 2.951 2.799 3.129 . 0 0 "[ . 1 . 2 . 3]" 1
909 1 43 ALA MB 1 61 ILE MD . . 4.310 2.652 2.407 2.873 . 0 0 "[ . 1 . 2 . 3]" 1
910 1 43 ALA MB 1 61 ILE HG13 . . 4.820 4.830 4.554 4.917 0.097 21 0 "[ . 1 . 2 . 3]" 1
911 1 44 ILE H 1 44 ILE HB . . 3.510 2.569 2.520 2.640 . 0 0 "[ . 1 . 2 . 3]" 1
912 1 44 ILE H 1 44 ILE HG12 . . 4.390 4.053 3.813 4.148 . 0 0 "[ . 1 . 2 . 3]" 1
913 1 44 ILE H 1 44 ILE HG13 . . 4.620 2.887 2.621 2.989 . 0 0 "[ . 1 . 2 . 3]" 1
914 1 44 ILE H 1 44 ILE MG . . 3.810 3.829 3.817 3.849 0.039 21 0 "[ . 1 . 2 . 3]" 1
915 1 44 ILE H 1 45 VAL H . . 5.030 4.230 4.159 4.328 . 0 0 "[ . 1 . 2 . 3]" 1
916 1 44 ILE HA 1 44 ILE MD . . 3.900 3.899 3.874 3.923 0.023 3 0 "[ . 1 . 2 . 3]" 1
917 1 44 ILE HA 1 44 ILE HG12 . . 4.200 2.595 2.533 2.671 . 0 0 "[ . 1 . 2 . 3]" 1
918 1 44 ILE HA 1 44 ILE HG13 . . 3.440 2.987 2.885 3.135 . 0 0 "[ . 1 . 2 . 3]" 1
919 1 44 ILE HA 1 44 ILE MG . . 3.400 2.403 2.367 2.429 . 0 0 "[ . 1 . 2 . 3]" 1
920 1 44 ILE HA 1 45 VAL H . . 2.990 2.146 2.098 2.209 . 0 0 "[ . 1 . 2 . 3]" 1
921 1 44 ILE HA 1 45 VAL HB . . 4.770 4.553 4.375 4.657 . 0 0 "[ . 1 . 2 . 3]" 1
922 1 44 ILE HB 1 45 VAL H . . 4.510 4.343 4.267 4.405 . 0 0 "[ . 1 . 2 . 3]" 1
923 1 44 ILE HG12 1 44 ILE MG . . 3.590 2.386 2.330 2.444 . 0 0 "[ . 1 . 2 . 3]" 1
924 1 44 ILE HG12 1 45 VAL H . . 4.870 4.562 4.427 4.730 . 0 0 "[ . 1 . 2 . 3]" 1
925 1 44 ILE HG13 1 45 VAL H . . 5.270 5.068 4.954 5.209 . 0 0 "[ . 1 . 2 . 3]" 1
926 1 44 ILE MG 1 45 VAL H . . 3.650 2.940 2.782 3.094 . 0 0 "[ . 1 . 2 . 3]" 1
927 1 45 VAL H 1 45 VAL HB . . 3.570 2.617 2.457 2.702 . 0 0 "[ . 1 . 2 . 3]" 1
928 1 45 VAL H 1 45 VAL MG1 . . 4.710 3.882 3.832 3.923 . 0 0 "[ . 1 . 2 . 3]" 1
929 1 45 VAL H 1 45 VAL MG2 . . 3.900 2.559 2.465 2.631 . 0 0 "[ . 1 . 2 . 3]" 1
930 1 45 VAL H 1 46 VAL H . . 4.960 4.452 4.396 4.506 . 0 0 "[ . 1 . 2 . 3]" 1
931 1 45 VAL H 1 57 LEU MD1 . . 5.500 4.201 3.958 4.346 . 0 0 "[ . 1 . 2 . 3]" 1
932 1 45 VAL HA 1 45 VAL MG1 . . 3.590 2.304 2.231 2.391 . 0 0 "[ . 1 . 2 . 3]" 1
933 1 45 VAL HA 1 45 VAL MG2 . . 3.690 2.558 2.504 2.640 . 0 0 "[ . 1 . 2 . 3]" 1
934 1 45 VAL HA 1 46 VAL H . . 3.000 2.233 2.178 2.278 . 0 0 "[ . 1 . 2 . 3]" 1
935 1 45 VAL HA 1 46 VAL HB . . 5.110 4.471 4.303 4.704 . 0 0 "[ . 1 . 2 . 3]" 1
936 1 45 VAL HB 1 46 VAL H . . 5.290 4.064 3.914 4.225 . 0 0 "[ . 1 . 2 . 3]" 1
937 1 45 VAL HB 1 46 VAL HA . . 5.330 4.905 4.782 4.988 . 0 0 "[ . 1 . 2 . 3]" 1
938 1 45 VAL HB 1 47 TYR QD . . 4.450 4.042 3.736 4.458 0.008 28 0 "[ . 1 . 2 . 3]" 1
939 1 45 VAL HB 1 47 TYR QE . . 5.500 5.125 4.690 5.531 0.031 13 0 "[ . 1 . 2 . 3]" 1
940 1 45 VAL HB 1 57 LEU MD1 . . 4.240 2.055 1.978 2.191 . 0 0 "[ . 1 . 2 . 3]" 1
941 1 45 VAL HB 1 57 LEU MD2 . . 5.470 4.027 3.935 4.122 . 0 0 "[ . 1 . 2 . 3]" 1
942 1 45 VAL MG1 1 46 VAL H . . 3.770 2.598 2.420 2.894 . 0 0 "[ . 1 . 2 . 3]" 1
943 1 45 VAL MG1 1 46 VAL HA . . 4.430 4.122 4.000 4.288 . 0 0 "[ . 1 . 2 . 3]" 1
944 1 45 VAL MG1 1 46 VAL HB . . 5.420 4.631 4.498 4.819 . 0 0 "[ . 1 . 2 . 3]" 1
945 1 45 VAL MG1 1 47 TYR H . . 5.470 4.348 3.656 4.608 . 0 0 "[ . 1 . 2 . 3]" 1
946 1 45 VAL MG1 1 47 TYR HA . . 5.120 4.468 3.765 4.654 . 0 0 "[ . 1 . 2 . 3]" 1
947 1 45 VAL MG1 1 47 TYR HB2 . . 5.090 4.537 3.942 4.762 . 0 0 "[ . 1 . 2 . 3]" 1
948 1 45 VAL MG1 1 47 TYR HB3 . . 3.760 3.062 2.438 3.260 . 0 0 "[ . 1 . 2 . 3]" 1
949 1 45 VAL MG1 1 47 TYR QD . . 3.700 3.445 3.117 3.728 0.028 28 0 "[ . 1 . 2 . 3]" 1
950 1 45 VAL MG1 1 57 LEU MD1 . . 3.790 2.033 1.971 2.087 . 0 0 "[ . 1 . 2 . 3]" 1
951 1 45 VAL MG1 1 57 LEU MD2 . . 4.300 2.238 2.131 2.378 . 0 0 "[ . 1 . 2 . 3]" 1
952 1 45 VAL MG2 1 57 LEU MD1 . . 4.640 2.902 2.662 3.082 . 0 0 "[ . 1 . 2 . 3]" 1
953 1 46 VAL H 1 46 VAL HB . . 3.770 2.514 2.397 2.642 . 0 0 "[ . 1 . 2 . 3]" 1
954 1 46 VAL H 1 46 VAL MG2 . . 4.040 2.603 2.463 2.729 . 0 0 "[ . 1 . 2 . 3]" 1
955 1 46 VAL H 1 47 TYR QD . . 5.500 4.637 4.407 5.037 . 0 0 "[ . 1 . 2 . 3]" 1
956 1 46 VAL HA 1 46 VAL MG1 . . 3.370 2.501 2.383 2.597 . 0 0 "[ . 1 . 2 . 3]" 1
957 1 46 VAL HA 1 46 VAL MG2 . . 3.240 2.534 2.444 2.593 . 0 0 "[ . 1 . 2 . 3]" 1
958 1 46 VAL HA 1 47 TYR H . . 3.140 2.235 2.132 2.316 . 0 0 "[ . 1 . 2 . 3]" 1
959 1 46 VAL HA 1 47 TYR QD . . 3.810 3.384 3.149 3.637 . 0 0 "[ . 1 . 2 . 3]" 1
960 1 46 VAL HA 1 47 TYR QE . . 5.140 4.953 4.720 5.178 0.038 21 0 "[ . 1 . 2 . 3]" 1
961 1 46 VAL HB 1 47 TYR H . . 5.170 4.367 4.189 4.466 . 0 0 "[ . 1 . 2 . 3]" 1
962 1 46 VAL MG1 1 47 TYR H . . 4.000 3.209 2.869 3.458 . 0 0 "[ . 1 . 2 . 3]" 1
963 1 47 TYR H 1 47 TYR QD . . 3.460 2.365 1.694 2.652 . 0 0 "[ . 1 . 2 . 3]" 1
964 1 47 TYR H 1 47 TYR QE . . 4.790 4.084 3.871 4.282 . 0 0 "[ . 1 . 2 . 3]" 1
965 1 47 TYR H 1 48 ASN HA . . 5.180 4.946 4.642 5.147 . 0 0 "[ . 1 . 2 . 3]" 1
966 1 47 TYR HA 1 47 TYR QD . . 4.110 3.747 3.727 3.771 . 0 0 "[ . 1 . 2 . 3]" 1
967 1 47 TYR HA 1 48 ASN H . . 3.200 2.379 2.216 2.922 . 0 0 "[ . 1 . 2 . 3]" 1
968 1 47 TYR HA 1 57 LEU MD1 . . 5.500 4.620 4.336 4.903 . 0 0 "[ . 1 . 2 . 3]" 1
969 1 47 TYR HA 1 57 LEU MD2 . . 5.500 4.614 4.346 4.914 . 0 0 "[ . 1 . 2 . 3]" 1
970 1 47 TYR HB2 1 48 ASN H . . 4.220 2.685 2.304 3.035 . 0 0 "[ . 1 . 2 . 3]" 1
971 1 47 TYR HB2 1 49 ALA MB . . 5.500 4.481 3.668 4.947 . 0 0 "[ . 1 . 2 . 3]" 1
972 1 47 TYR HB2 1 57 LEU MD1 . . 4.590 3.725 3.273 4.019 . 0 0 "[ . 1 . 2 . 3]" 1
973 1 47 TYR HB2 1 57 LEU MD2 . . 4.600 3.189 2.808 3.622 . 0 0 "[ . 1 . 2 . 3]" 1
974 1 47 TYR HB3 1 48 ASN H . . 4.210 3.976 3.702 4.166 . 0 0 "[ . 1 . 2 . 3]" 1
975 1 47 TYR HB3 1 57 LEU MD1 . . 4.080 2.454 2.135 2.786 . 0 0 "[ . 1 . 2 . 3]" 1
976 1 47 TYR HB3 1 57 LEU MD2 . . 5.020 2.657 2.397 2.925 . 0 0 "[ . 1 . 2 . 3]" 1
977 1 47 TYR QD 1 48 ASN H . . 4.410 3.561 2.764 4.417 0.007 28 0 "[ . 1 . 2 . 3]" 1
978 1 47 TYR QD 1 49 ALA H . . 5.180 4.489 3.620 5.056 . 0 0 "[ . 1 . 2 . 3]" 1
979 1 47 TYR QD 1 49 ALA MB . . 4.160 2.661 2.203 3.130 . 0 0 "[ . 1 . 2 . 3]" 1
980 1 47 TYR QD 1 54 PRO HA . . 5.500 5.074 4.579 5.390 . 0 0 "[ . 1 . 2 . 3]" 1
981 1 47 TYR QD 1 57 LEU HB2 . . 5.500 5.408 5.313 5.510 0.010 5 0 "[ . 1 . 2 . 3]" 1
982 1 47 TYR QD 1 57 LEU MD1 . . 3.930 2.266 2.111 2.906 . 0 0 "[ . 1 . 2 . 3]" 1
983 1 47 TYR QD 1 57 LEU MD2 . . 3.610 3.576 3.200 3.661 0.051 2 0 "[ . 1 . 2 . 3]" 1
984 1 47 TYR QE 1 49 ALA H . . 5.400 4.990 4.345 5.411 0.011 19 0 "[ . 1 . 2 . 3]" 1
985 1 47 TYR QE 1 49 ALA MB . . 3.500 2.364 2.089 3.508 0.008 28 0 "[ . 1 . 2 . 3]" 1
986 1 47 TYR QE 1 54 PRO HA . . 3.990 3.838 3.280 4.041 0.051 7 0 "[ . 1 . 2 . 3]" 1
987 1 47 TYR QE 1 54 PRO HB2 . . 5.500 5.251 4.855 5.553 0.053 30 0 "[ . 1 . 2 . 3]" 1
988 1 47 TYR QE 1 54 PRO HB3 . . 5.500 3.892 3.432 4.334 . 0 0 "[ . 1 . 2 . 3]" 1
989 1 47 TYR QE 1 57 LEU MD1 . . 4.520 2.912 2.654 3.468 . 0 0 "[ . 1 . 2 . 3]" 1
990 1 47 TYR QE 1 57 LEU MD2 . . 4.670 4.703 4.587 4.738 0.068 19 0 "[ . 1 . 2 . 3]" 1
991 1 48 ASN H 1 48 ASN HB2 . . 3.610 2.769 2.248 3.761 0.151 28 0 "[ . 1 . 2 . 3]" 1
992 1 48 ASN H 1 48 ASN HB3 . . 3.660 2.615 2.333 3.306 . 0 0 "[ . 1 . 2 . 3]" 1
993 1 48 ASN H 1 48 ASN HD21 . . 5.500 4.619 2.181 5.197 . 0 0 "[ . 1 . 2 . 3]" 1
994 1 48 ASN H 1 49 ALA H . . 4.650 4.342 3.758 4.588 . 0 0 "[ . 1 . 2 . 3]" 1
995 1 48 ASN H 1 57 LEU MD2 . . 5.500 5.485 5.110 5.588 0.088 15 0 "[ . 1 . 2 . 3]" 1
996 1 48 ASN HA 1 48 ASN HB2 . . 2.810 2.509 2.365 2.855 0.045 4 0 "[ . 1 . 2 . 3]" 1
997 1 48 ASN HA 1 48 ASN HD21 . . 3.900 3.172 2.032 3.926 0.026 9 0 "[ . 1 . 2 . 3]" 1
998 1 48 ASN HA 1 48 ASN HD22 . . 4.600 3.940 3.441 4.901 0.301 28 0 "[ . 1 . 2 . 3]" 1
999 1 48 ASN HA 1 49 ALA H . . 3.400 2.166 2.006 2.326 . 0 0 "[ . 1 . 2 . 3]" 1
1000 1 48 ASN HB2 1 49 ALA H . . 5.160 4.412 4.089 4.722 . 0 0 "[ . 1 . 2 . 3]" 1
1001 1 48 ASN HB3 1 49 ALA H . . 4.990 4.329 3.991 4.557 . 0 0 "[ . 1 . 2 . 3]" 1
1002 1 49 ALA H 1 49 ALA MB . . 3.410 2.825 2.623 2.940 . 0 0 "[ . 1 . 2 . 3]" 1
1003 1 49 ALA H 1 50 SER H . . 4.500 4.210 3.818 4.426 . 0 0 "[ . 1 . 2 . 3]" 1
1004 1 49 ALA HA 1 50 SER H . . 3.070 2.345 2.192 2.757 . 0 0 "[ . 1 . 2 . 3]" 1
1005 1 49 ALA HA 1 51 SER H . . 4.280 3.908 3.474 4.347 0.067 28 0 "[ . 1 . 2 . 3]" 1
1006 1 49 ALA MB 1 50 SER H . . 4.310 2.832 1.936 3.536 . 0 0 "[ . 1 . 2 . 3]" 1
1007 1 49 ALA MB 1 50 SER HA . . 4.830 4.260 3.808 4.473 . 0 0 "[ . 1 . 2 . 3]" 1
1008 1 50 SER H 1 50 SER HB2 . . 3.560 2.940 2.516 3.725 0.165 28 0 "[ . 1 . 2 . 3]" 1
1009 1 50 SER H 1 50 SER HB3 . . 3.920 3.227 2.335 3.985 0.065 8 0 "[ . 1 . 2 . 3]" 1
1010 1 50 SER H 1 51 SER H . . 3.710 2.727 1.979 3.304 . 0 0 "[ . 1 . 2 . 3]" 1
1011 1 50 SER H 1 51 SER HA . . 5.110 5.066 4.407 5.247 0.137 30 0 "[ . 1 . 2 . 3]" 1
1012 1 52 VAL H 1 53 THR H . . 4.800 4.227 3.239 4.501 . 0 0 "[ . 1 . 2 . 3]" 1
1013 1 52 VAL HA 1 52 VAL QG . . 2.960 2.233 2.140 2.439 . 0 0 "[ . 1 . 2 . 3]" 1
1014 1 52 VAL HA 1 53 THR H . . 3.570 2.258 2.096 3.027 . 0 0 "[ . 1 . 2 . 3]" 1
1015 1 52 VAL QG 1 53 THR H . . 4.870 2.960 1.856 3.791 . 0 0 "[ . 1 . 2 . 3]" 1
1016 1 53 THR H 1 53 THR MG . . 4.070 3.210 1.887 4.086 0.016 10 0 "[ . 1 . 2 . 3]" 1
1017 1 53 THR H 1 54 PRO HD2 . . 4.850 4.268 3.012 4.871 0.021 28 0 "[ . 1 . 2 . 3]" 1
1018 1 53 THR H 1 54 PRO HD3 . . 5.380 3.843 2.309 5.334 . 0 0 "[ . 1 . 2 . 3]" 1
1019 1 53 THR HA 1 53 THR MG . . 3.190 2.683 2.127 3.247 0.057 2 0 "[ . 1 . 2 . 3]" 1
1020 1 53 THR HA 1 54 PRO HD2 . . 2.780 2.242 2.084 2.704 . 0 0 "[ . 1 . 2 . 3]" 1
1021 1 53 THR HA 1 54 PRO HD3 . . 3.390 2.864 2.527 3.432 0.042 22 0 "[ . 1 . 2 . 3]" 1
1022 1 53 THR HA 1 54 PRO HG2 . . 4.780 4.405 4.171 4.792 0.012 22 0 "[ . 1 . 2 . 3]" 1
1023 1 53 THR HA 1 54 PRO HG3 . . 5.280 4.750 4.553 5.288 0.008 22 0 "[ . 1 . 2 . 3]" 1
1024 1 53 THR HA 1 55 GLU H . . 4.900 3.589 3.140 3.968 . 0 0 "[ . 1 . 2 . 3]" 1
1025 1 53 THR MG 1 54 PRO HD2 . . 4.340 3.892 2.215 4.462 0.122 12 0 "[ . 1 . 2 . 3]" 1
1026 1 53 THR MG 1 55 GLU H . . 5.080 3.224 1.741 4.734 . 0 0 "[ . 1 . 2 . 3]" 1
1027 1 53 THR MG 1 55 GLU HB3 . . 5.440 3.706 1.984 5.538 0.098 21 0 "[ . 1 . 2 . 3]" 1
1028 1 53 THR MG 1 56 SER HA . . 5.500 4.758 3.667 5.568 0.068 6 0 "[ . 1 . 2 . 3]" 1
1029 1 54 PRO HA 1 57 LEU HB2 . . 4.830 3.614 3.027 4.348 . 0 0 "[ . 1 . 2 . 3]" 1
1030 1 54 PRO HA 1 57 LEU MD1 . . 3.610 3.214 2.883 3.613 0.003 4 0 "[ . 1 . 2 . 3]" 1
1031 1 54 PRO HA 1 57 LEU HG . . 4.460 3.380 2.905 3.811 . 0 0 "[ . 1 . 2 . 3]" 1
1032 1 54 PRO HA 1 73 ILE MD . . 4.530 4.497 4.325 4.610 0.080 30 0 "[ . 1 . 2 . 3]" 1
1033 1 54 PRO HB2 1 55 GLU H . . 4.000 3.804 3.612 3.998 . 0 0 "[ . 1 . 2 . 3]" 1
1034 1 54 PRO HB3 1 57 LEU MD1 . . 5.110 4.153 3.581 4.556 . 0 0 "[ . 1 . 2 . 3]" 1
1035 1 54 PRO HD2 1 55 GLU H . . 3.710 2.851 2.423 3.161 . 0 0 "[ . 1 . 2 . 3]" 1
1036 1 54 PRO HG2 1 55 GLU H . . 4.750 2.736 2.354 3.034 . 0 0 "[ . 1 . 2 . 3]" 1
1037 1 55 GLU H 1 55 GLU HB2 . . 3.360 2.393 1.974 3.400 0.040 17 0 "[ . 1 . 2 . 3]" 1
1038 1 55 GLU H 1 55 GLU HB3 . . 3.930 2.980 1.993 3.645 . 0 0 "[ . 1 . 2 . 3]" 1
1039 1 55 GLU H 1 55 GLU HG2 . . 4.530 3.803 2.414 4.542 0.012 29 0 "[ . 1 . 2 . 3]" 1
1040 1 55 GLU H 1 56 SER H . . 3.930 2.930 2.762 3.251 . 0 0 "[ . 1 . 2 . 3]" 1
1041 1 55 GLU H 1 57 LEU H . . 5.500 4.562 4.308 4.776 . 0 0 "[ . 1 . 2 . 3]" 1
1042 1 55 GLU H 1 73 ILE MD . . 5.400 3.782 3.271 4.313 . 0 0 "[ . 1 . 2 . 3]" 1
1043 1 55 GLU HA 1 57 LEU H . . 5.150 4.367 3.789 4.725 . 0 0 "[ . 1 . 2 . 3]" 1
1044 1 55 GLU HA 1 58 ARG H . . 4.070 3.428 2.651 3.820 . 0 0 "[ . 1 . 2 . 3]" 1
1045 1 55 GLU HA 1 58 ARG HB2 . . 3.800 3.191 2.366 3.901 0.101 26 0 "[ . 1 . 2 . 3]" 1
1046 1 55 GLU HB3 1 56 SER H . . 4.530 3.446 2.930 4.455 . 0 0 "[ . 1 . 2 . 3]" 1
1047 1 55 GLU HB3 1 56 SER HA . . 4.390 4.477 3.905 5.219 0.829 17 5 "[ . 1* . + ** .- 3]" 1
1048 1 56 SER H 1 56 SER HB2 . . 3.660 3.124 2.461 3.658 . 0 0 "[ . 1 . 2 . 3]" 1
1049 1 56 SER H 1 56 SER HB3 . . 3.390 3.129 2.636 3.545 0.155 10 0 "[ . 1 . 2 . 3]" 1
1050 1 56 SER H 1 57 LEU H . . 3.760 2.614 2.492 2.734 . 0 0 "[ . 1 . 2 . 3]" 1
1051 1 56 SER H 1 57 LEU HG . . 4.410 4.402 4.092 4.532 0.122 4 0 "[ . 1 . 2 . 3]" 1
1052 1 56 SER HA 1 56 SER HB3 . . 2.880 2.379 2.268 2.480 . 0 0 "[ . 1 . 2 . 3]" 1
1053 1 56 SER HA 1 59 LYS HB2 . . 4.500 2.532 2.028 3.141 . 0 0 "[ . 1 . 2 . 3]" 1
1054 1 56 SER HA 1 60 ALA H . . 4.500 4.287 4.066 4.548 0.048 11 0 "[ . 1 . 2 . 3]" 1
1055 1 56 SER HB2 1 57 LEU H . . 3.570 3.165 2.625 3.611 0.041 13 0 "[ . 1 . 2 . 3]" 1
1056 1 56 SER HB2 1 57 LEU MD2 . . 4.850 3.815 3.238 4.298 . 0 0 "[ . 1 . 2 . 3]" 1
1057 1 56 SER HB2 1 60 ALA H . . 5.320 5.354 5.055 5.449 0.129 10 0 "[ . 1 . 2 . 3]" 1
1058 1 56 SER HB3 1 57 LEU H . . 4.460 3.995 3.772 4.232 . 0 0 "[ . 1 . 2 . 3]" 1
1059 1 57 LEU H 1 57 LEU HB2 . . 4.070 2.506 2.394 2.646 . 0 0 "[ . 1 . 2 . 3]" 1
1060 1 57 LEU H 1 57 LEU HB3 . . 3.660 3.629 3.567 3.663 0.003 27 0 "[ . 1 . 2 . 3]" 1
1061 1 57 LEU H 1 57 LEU MD1 . . 4.450 3.755 3.589 3.884 . 0 0 "[ . 1 . 2 . 3]" 1
1062 1 57 LEU H 1 57 LEU MD2 . . 4.160 3.333 2.978 3.570 . 0 0 "[ . 1 . 2 . 3]" 1
1063 1 57 LEU H 1 57 LEU HG . . 3.460 2.393 2.115 2.632 . 0 0 "[ . 1 . 2 . 3]" 1
1064 1 57 LEU H 1 58 ARG H . . 3.560 2.611 2.435 2.919 . 0 0 "[ . 1 . 2 . 3]" 1
1065 1 57 LEU H 1 58 ARG HA . . 5.500 5.255 5.105 5.453 . 0 0 "[ . 1 . 2 . 3]" 1
1066 1 57 LEU H 1 60 ALA MB . . 5.450 4.761 4.686 4.854 . 0 0 "[ . 1 . 2 . 3]" 1
1067 1 57 LEU HA 1 57 LEU MD1 . . 4.570 3.868 3.830 3.918 . 0 0 "[ . 1 . 2 . 3]" 1
1068 1 57 LEU HA 1 57 LEU MD2 . . 3.270 2.243 2.150 2.340 . 0 0 "[ . 1 . 2 . 3]" 1
1069 1 57 LEU HA 1 57 LEU HG . . 4.040 3.314 3.204 3.413 . 0 0 "[ . 1 . 2 . 3]" 1
1070 1 57 LEU HA 1 60 ALA H . . 3.720 3.045 2.861 3.253 . 0 0 "[ . 1 . 2 . 3]" 1
1071 1 57 LEU HA 1 60 ALA MB . . 3.260 2.469 2.390 2.571 . 0 0 "[ . 1 . 2 . 3]" 1
1072 1 57 LEU HA 1 61 ILE H . . 5.000 4.150 3.949 4.297 . 0 0 "[ . 1 . 2 . 3]" 1
1073 1 57 LEU HA 1 61 ILE MD . . 5.350 4.973 4.812 5.228 . 0 0 "[ . 1 . 2 . 3]" 1
1074 1 57 LEU HA 1 61 ILE HG13 . . 5.440 4.341 4.163 4.667 . 0 0 "[ . 1 . 2 . 3]" 1
1075 1 57 LEU HB2 1 60 ALA MB . . 4.900 4.900 4.832 4.953 0.053 9 0 "[ . 1 . 2 . 3]" 1
1076 1 57 LEU HB2 1 61 ILE MD . . 5.100 4.483 4.238 4.762 . 0 0 "[ . 1 . 2 . 3]" 1
1077 1 57 LEU HB3 1 58 ARG H . . 3.620 3.631 3.577 3.659 0.039 29 0 "[ . 1 . 2 . 3]" 1
1078 1 57 LEU HB3 1 61 ILE MD . . 5.500 3.807 3.586 4.008 . 0 0 "[ . 1 . 2 . 3]" 1
1079 1 57 LEU MD1 1 58 ARG H . . 5.290 4.463 4.336 4.556 . 0 0 "[ . 1 . 2 . 3]" 1
1080 1 57 LEU MD1 1 60 ALA MB . . 5.500 5.063 4.914 5.267 . 0 0 "[ . 1 . 2 . 3]" 1
1081 1 57 LEU MD1 1 61 ILE MD . . 5.500 4.588 4.415 4.727 . 0 0 "[ . 1 . 2 . 3]" 1
1082 1 57 LEU MD2 1 58 ARG H . . 5.500 4.755 4.631 4.836 . 0 0 "[ . 1 . 2 . 3]" 1
1083 1 57 LEU MD2 1 60 ALA H . . 5.500 4.749 4.497 4.947 . 0 0 "[ . 1 . 2 . 3]" 1
1084 1 57 LEU HG 1 58 ARG H . . 5.270 4.311 4.091 4.446 . 0 0 "[ . 1 . 2 . 3]" 1
1085 1 58 ARG H 1 58 ARG HB2 . . 3.420 2.466 2.205 3.491 0.071 11 0 "[ . 1 . 2 . 3]" 1
1086 1 58 ARG H 1 58 ARG HB3 . . 3.250 2.475 2.213 2.782 . 0 0 "[ . 1 . 2 . 3]" 1
1087 1 58 ARG H 1 58 ARG HG2 . . 4.170 4.281 3.324 4.387 0.217 5 0 "[ . 1 . 2 . 3]" 1
1088 1 58 ARG H 1 58 ARG HG3 . . 5.120 4.427 4.193 4.564 . 0 0 "[ . 1 . 2 . 3]" 1
1089 1 58 ARG H 1 59 LYS H . . 3.630 2.955 2.830 3.139 . 0 0 "[ . 1 . 2 . 3]" 1
1090 1 58 ARG H 1 60 ALA H . . 5.500 4.219 4.149 4.366 . 0 0 "[ . 1 . 2 . 3]" 1
1091 1 58 ARG H 1 61 ILE MD . . 5.500 4.485 4.268 4.795 . 0 0 "[ . 1 . 2 . 3]" 1
1092 1 58 ARG HA 1 58 ARG HG2 . . 4.090 2.783 2.208 3.969 . 0 0 "[ . 1 . 2 . 3]" 1
1093 1 58 ARG HA 1 58 ARG HG3 . . 3.530 3.097 2.651 3.589 0.059 11 0 "[ . 1 . 2 . 3]" 1
1094 1 58 ARG HA 1 60 ALA H . . 5.090 4.508 4.376 4.644 . 0 0 "[ . 1 . 2 . 3]" 1
1095 1 58 ARG HA 1 61 ILE H . . 3.680 3.589 3.446 3.702 0.022 23 0 "[ . 1 . 2 . 3]" 1
1096 1 58 ARG HA 1 61 ILE MD . . 4.190 2.647 2.384 3.031 . 0 0 "[ . 1 . 2 . 3]" 1
1097 1 58 ARG HA 1 61 ILE MG . . 5.330 4.421 4.213 4.667 . 0 0 "[ . 1 . 2 . 3]" 1
1098 1 58 ARG HA 1 62 GLU H . . 5.500 4.122 4.009 4.319 . 0 0 "[ . 1 . 2 . 3]" 1
1099 1 58 ARG HA 1 71 VAL HB . . 4.540 4.153 3.762 4.555 0.015 9 0 "[ . 1 . 2 . 3]" 1
1100 1 58 ARG HA 1 71 VAL MG1 . . 3.210 2.422 2.136 2.961 . 0 0 "[ . 1 . 2 . 3]" 1
1101 1 58 ARG HB2 1 59 LYS H . . 3.660 3.742 3.666 3.831 0.171 11 0 "[ . 1 . 2 . 3]" 1
1102 1 58 ARG HB2 1 59 LYS HD2 . . 5.500 5.301 4.856 5.604 0.104 11 0 "[ . 1 . 2 . 3]" 1
1103 1 58 ARG HB3 1 61 ILE MD . . 5.500 5.245 4.622 5.516 0.016 21 0 "[ . 1 . 2 . 3]" 1
1104 1 58 ARG HG3 1 71 VAL HB . . 4.390 3.259 2.187 4.341 . 0 0 "[ . 1 . 2 . 3]" 1
1105 1 59 LYS H 1 59 LYS HB3 . . 3.340 3.406 3.351 3.485 0.145 13 0 "[ . 1 . 2 . 3]" 1
1106 1 59 LYS H 1 59 LYS HD2 . . 3.920 3.042 2.669 3.892 . 0 0 "[ . 1 . 2 . 3]" 1
1107 1 59 LYS H 1 59 LYS HD3 . . 3.990 2.928 2.313 4.082 0.092 24 0 "[ . 1 . 2 . 3]" 1
1108 1 59 LYS H 1 59 LYS QG . . 3.570 3.487 2.187 3.659 0.089 4 0 "[ . 1 . 2 . 3]" 1
1109 1 59 LYS H 1 60 ALA H . . 3.240 2.991 2.849 3.143 . 0 0 "[ . 1 . 2 . 3]" 1
1110 1 59 LYS HA 1 59 LYS HD2 . . 4.110 2.264 2.006 3.656 . 0 0 "[ . 1 . 2 . 3]" 1
1111 1 59 LYS HA 1 59 LYS HD3 . . 3.390 3.396 2.881 3.544 0.154 13 0 "[ . 1 . 2 . 3]" 1
1112 1 59 LYS HA 1 59 LYS QE . . 5.160 3.633 2.233 4.452 . 0 0 "[ . 1 . 2 . 3]" 1
1113 1 59 LYS HA 1 59 LYS QG . . 3.870 2.463 2.124 3.066 . 0 0 "[ . 1 . 2 . 3]" 1
1114 1 59 LYS HA 1 62 GLU H . . 4.000 3.266 3.036 3.480 . 0 0 "[ . 1 . 2 . 3]" 1
1115 1 59 LYS HA 1 62 GLU HB2 . . 4.000 2.332 2.159 2.501 . 0 0 "[ . 1 . 2 . 3]" 1
1116 1 59 LYS HA 1 62 GLU HB3 . . 4.100 4.014 3.841 4.150 0.050 4 0 "[ . 1 . 2 . 3]" 1
1117 1 59 LYS HA 1 62 GLU HG3 . . 4.300 3.557 3.030 3.833 . 0 0 "[ . 1 . 2 . 3]" 1
1118 1 59 LYS HB2 1 60 ALA H . . 3.780 3.177 2.818 3.508 . 0 0 "[ . 1 . 2 . 3]" 1
1119 1 59 LYS HB3 1 60 ALA H . . 4.380 3.332 2.858 3.899 . 0 0 "[ . 1 . 2 . 3]" 1
1120 1 59 LYS QG 1 60 ALA H . . 5.250 4.649 4.408 4.884 . 0 0 "[ . 1 . 2 . 3]" 1
1121 1 60 ALA H 1 60 ALA MB . . 3.050 2.220 2.175 2.260 . 0 0 "[ . 1 . 2 . 3]" 1
1122 1 60 ALA H 1 61 ILE HB . . 5.500 5.040 4.847 5.548 0.048 21 0 "[ . 1 . 2 . 3]" 1
1123 1 60 ALA H 1 61 ILE HG12 . . 5.700 5.750 4.959 5.802 0.102 3 0 "[ . 1 . 2 . 3]" 1
1124 1 60 ALA H 1 62 GLU H . . 5.120 4.382 4.233 4.570 . 0 0 "[ . 1 . 2 . 3]" 1
1125 1 60 ALA H 1 63 ALA H . . 5.140 4.731 4.626 4.909 . 0 0 "[ . 1 . 2 . 3]" 1
1126 1 60 ALA HA 1 62 GLU H . . 5.090 4.832 4.679 5.028 . 0 0 "[ . 1 . 2 . 3]" 1
1127 1 60 ALA HA 1 63 ALA MB . . 3.300 2.517 2.395 2.755 . 0 0 "[ . 1 . 2 . 3]" 1
1128 1 60 ALA MB 1 61 ILE H . . 3.570 2.707 2.615 2.850 . 0 0 "[ . 1 . 2 . 3]" 1
1129 1 60 ALA MB 1 61 ILE HA . . 5.230 4.090 4.036 4.166 . 0 0 "[ . 1 . 2 . 3]" 1
1130 1 60 ALA MB 1 62 GLU H . . 5.230 4.895 4.810 5.024 . 0 0 "[ . 1 . 2 . 3]" 1
1131 1 60 ALA MB 1 63 ALA H . . 5.040 4.564 4.420 4.727 . 0 0 "[ . 1 . 2 . 3]" 1
1132 1 61 ILE H 1 61 ILE HB . . 3.310 2.651 2.567 2.975 . 0 0 "[ . 1 . 2 . 3]" 1
1133 1 61 ILE H 1 61 ILE MD . . 4.340 3.644 3.536 3.822 . 0 0 "[ . 1 . 2 . 3]" 1
1134 1 61 ILE H 1 61 ILE HG12 . . 3.390 3.343 2.548 3.426 0.036 12 0 "[ . 1 . 2 . 3]" 1
1135 1 61 ILE H 1 61 ILE HG13 . . 3.880 2.159 2.069 2.279 . 0 0 "[ . 1 . 2 . 3]" 1
1136 1 61 ILE H 1 61 ILE MG . . 4.020 3.821 3.787 3.845 . 0 0 "[ . 1 . 2 . 3]" 1
1137 1 61 ILE H 1 62 GLU H . . 3.430 2.821 2.619 2.974 . 0 0 "[ . 1 . 2 . 3]" 1
1138 1 61 ILE H 1 62 GLU HG3 . . 5.500 4.743 4.424 5.002 . 0 0 "[ . 1 . 2 . 3]" 1
1139 1 61 ILE H 1 63 ALA MB . . 4.830 4.725 4.626 4.833 0.003 23 0 "[ . 1 . 2 . 3]" 1
1140 1 61 ILE H 1 64 VAL MG1 . . 5.500 5.534 5.464 5.596 0.096 8 0 "[ . 1 . 2 . 3]" 1
1141 1 61 ILE H 1 71 VAL MG1 . . 5.090 4.285 3.981 4.679 . 0 0 "[ . 1 . 2 . 3]" 1
1142 1 61 ILE H 1 71 VAL MG2 . . 4.710 4.431 4.225 4.669 . 0 0 "[ . 1 . 2 . 3]" 1
1143 1 61 ILE HA 1 61 ILE MD . . 4.760 3.966 3.886 4.043 . 0 0 "[ . 1 . 2 . 3]" 1
1144 1 61 ILE HA 1 61 ILE HG12 . . 3.870 2.697 2.520 2.859 . 0 0 "[ . 1 . 2 . 3]" 1
1145 1 61 ILE HA 1 61 ILE HG13 . . 3.540 3.193 3.121 3.638 0.098 21 0 "[ . 1 . 2 . 3]" 1
1146 1 61 ILE HA 1 61 ILE MG . . 3.520 2.317 2.203 2.405 . 0 0 "[ . 1 . 2 . 3]" 1
1147 1 61 ILE HA 1 63 ALA H . . 3.860 3.938 3.877 3.984 0.124 8 0 "[ . 1 . 2 . 3]" 1
1148 1 61 ILE HA 1 64 VAL HB . . 5.150 3.213 3.035 3.508 . 0 0 "[ . 1 . 2 . 3]" 1
1149 1 61 ILE HA 1 64 VAL MG1 . . 3.460 3.184 3.082 3.297 . 0 0 "[ . 1 . 2 . 3]" 1
1150 1 61 ILE HA 1 69 TYR QD . . 5.500 3.880 3.767 3.992 . 0 0 "[ . 1 . 2 . 3]" 1
1151 1 61 ILE HA 1 69 TYR QE . . 5.500 3.821 3.588 4.103 . 0 0 "[ . 1 . 2 . 3]" 1
1152 1 61 ILE HB 1 61 ILE MD . . 3.730 2.402 2.347 2.598 . 0 0 "[ . 1 . 2 . 3]" 1
1153 1 61 ILE HB 1 62 GLU H . . 3.570 2.497 2.372 2.601 . 0 0 "[ . 1 . 2 . 3]" 1
1154 1 61 ILE HB 1 71 VAL MG2 . . 4.140 2.358 2.134 2.596 . 0 0 "[ . 1 . 2 . 3]" 1
1155 1 61 ILE MD 1 61 ILE MG . . 3.570 2.034 1.991 2.070 . 0 0 "[ . 1 . 2 . 3]" 1
1156 1 61 ILE MD 1 62 GLU H . . 5.500 4.471 4.341 4.614 . 0 0 "[ . 1 . 2 . 3]" 1
1157 1 61 ILE MD 1 71 VAL MG1 . . 4.300 2.252 2.086 2.455 . 0 0 "[ . 1 . 2 . 3]" 1
1158 1 61 ILE MD 1 71 VAL MG2 . . 4.180 3.492 3.317 3.683 . 0 0 "[ . 1 . 2 . 3]" 1
1159 1 61 ILE HG13 1 62 GLU H . . 5.500 4.205 3.696 4.306 . 0 0 "[ . 1 . 2 . 3]" 1
1160 1 61 ILE HG13 1 63 ALA H . . 6.500 5.784 5.645 5.973 . 0 0 "[ . 1 . 2 . 3]" 1
1161 1 61 ILE HG13 1 71 VAL MG1 . . 4.710 3.817 2.996 4.040 . 0 0 "[ . 1 . 2 . 3]" 1
1162 1 61 ILE MG 1 62 GLU H . . 4.660 3.415 3.246 3.790 . 0 0 "[ . 1 . 2 . 3]" 1
1163 1 61 ILE MG 1 62 GLU HG2 . . 5.500 4.694 4.278 5.264 . 0 0 "[ . 1 . 2 . 3]" 1
1164 1 61 ILE MG 1 63 ALA H . . 4.920 4.816 4.733 4.915 . 0 0 "[ . 1 . 2 . 3]" 1
1165 1 61 ILE MG 1 64 VAL HB . . 5.500 4.210 3.988 4.515 . 0 0 "[ . 1 . 2 . 3]" 1
1166 1 61 ILE MG 1 64 VAL MG1 . . 4.660 2.965 2.784 3.181 . 0 0 "[ . 1 . 2 . 3]" 1
1167 1 61 ILE MG 1 69 TYR QD . . 4.170 2.006 1.961 2.091 . 0 0 "[ . 1 . 2 . 3]" 1
1168 1 61 ILE MG 1 69 TYR QE . . 5.240 2.269 2.132 2.711 . 0 0 "[ . 1 . 2 . 3]" 1
1169 1 61 ILE MG 1 71 VAL HA . . 5.500 4.404 4.120 4.861 . 0 0 "[ . 1 . 2 . 3]" 1
1170 1 61 ILE MG 1 71 VAL MG1 . . 4.810 2.698 2.444 3.112 . 0 0 "[ . 1 . 2 . 3]" 1
1171 1 61 ILE MG 1 71 VAL MG2 . . 3.520 2.092 1.979 2.755 . 0 0 "[ . 1 . 2 . 3]" 1
1172 1 62 GLU H 1 62 GLU HB2 . . 3.570 2.509 2.387 2.585 . 0 0 "[ . 1 . 2 . 3]" 1
1173 1 62 GLU H 1 62 GLU HB3 . . 3.520 3.593 3.574 3.609 0.089 7 0 "[ . 1 . 2 . 3]" 1
1174 1 62 GLU H 1 62 GLU HG2 . . 4.230 3.511 3.370 3.717 . 0 0 "[ . 1 . 2 . 3]" 1
1175 1 62 GLU H 1 62 GLU HG3 . . 3.690 2.261 2.138 2.405 . 0 0 "[ . 1 . 2 . 3]" 1
1176 1 62 GLU H 1 71 VAL MG1 . . 5.240 3.644 3.426 4.035 . 0 0 "[ . 1 . 2 . 3]" 1
1177 1 62 GLU H 1 71 VAL MG2 . . 4.410 2.678 2.502 2.924 . 0 0 "[ . 1 . 2 . 3]" 1
1178 1 62 GLU HA 1 62 GLU HB3 . . 2.930 2.477 2.424 2.565 . 0 0 "[ . 1 . 2 . 3]" 1
1179 1 62 GLU HA 1 62 GLU HG2 . . 3.530 2.530 2.304 2.849 . 0 0 "[ . 1 . 2 . 3]" 1
1180 1 62 GLU HA 1 62 GLU HG3 . . 3.850 2.973 2.768 3.082 . 0 0 "[ . 1 . 2 . 3]" 1
1181 1 62 GLU HA 1 64 VAL H . . 5.050 3.741 3.650 3.861 . 0 0 "[ . 1 . 2 . 3]" 1
1182 1 62 GLU HA 1 64 VAL MG1 . . 5.500 4.410 4.270 4.536 . 0 0 "[ . 1 . 2 . 3]" 1
1183 1 62 GLU HA 1 65 SER H . . 5.380 3.838 3.675 4.085 . 0 0 "[ . 1 . 2 . 3]" 1
1184 1 62 GLU HA 1 69 TYR HB2 . . 3.450 2.567 2.462 2.688 . 0 0 "[ . 1 . 2 . 3]" 1
1185 1 62 GLU HA 1 69 TYR HB3 . . 3.810 2.798 2.408 3.198 . 0 0 "[ . 1 . 2 . 3]" 1
1186 1 62 GLU HA 1 69 TYR QD . . 3.760 2.901 2.637 3.171 . 0 0 "[ . 1 . 2 . 3]" 1
1187 1 62 GLU HA 1 69 TYR QE . . 5.390 5.073 4.871 5.323 . 0 0 "[ . 1 . 2 . 3]" 1
1188 1 62 GLU HA 1 71 VAL MG2 . . 3.890 2.688 2.453 3.021 . 0 0 "[ . 1 . 2 . 3]" 1
1189 1 62 GLU HB2 1 63 ALA H . . 3.700 3.100 2.803 3.381 . 0 0 "[ . 1 . 2 . 3]" 1
1190 1 62 GLU HB3 1 69 TYR HB2 . . 4.230 4.287 4.235 4.337 0.107 4 0 "[ . 1 . 2 . 3]" 1
1191 1 62 GLU HG2 1 71 VAL H . . 4.410 3.132 2.803 3.457 . 0 0 "[ . 1 . 2 . 3]" 1
1192 1 62 GLU HG3 1 63 ALA H . . 4.990 4.660 4.485 4.776 . 0 0 "[ . 1 . 2 . 3]" 1
1193 1 62 GLU HG3 1 71 VAL H . . 4.350 4.006 3.413 4.335 . 0 0 "[ . 1 . 2 . 3]" 1
1194 1 62 GLU HG3 1 71 VAL HA . . 5.500 4.989 4.739 5.269 . 0 0 "[ . 1 . 2 . 3]" 1
1195 1 62 GLU HG3 1 71 VAL HB . . 3.740 2.316 2.135 2.586 . 0 0 "[ . 1 . 2 . 3]" 1
1196 1 62 GLU HG3 1 71 VAL MG1 . . 5.500 3.223 2.897 3.604 . 0 0 "[ . 1 . 2 . 3]" 1
1197 1 62 GLU HG3 1 71 VAL MG2 . . 4.270 2.214 2.057 2.339 . 0 0 "[ . 1 . 2 . 3]" 1
1198 1 63 ALA H 1 63 ALA MB . . 2.920 2.246 2.212 2.288 . 0 0 "[ . 1 . 2 . 3]" 1
1199 1 63 ALA H 1 69 TYR QD . . 5.210 4.994 4.793 5.198 . 0 0 "[ . 1 . 2 . 3]" 1
1200 1 63 ALA HA 1 64 VAL H . . 3.130 3.215 3.169 3.253 0.123 4 0 "[ . 1 . 2 . 3]" 1
1201 1 63 ALA HA 1 65 SER H . . 4.800 4.239 4.129 4.653 . 0 0 "[ . 1 . 2 . 3]" 1
1202 1 63 ALA HA 1 66 PRO HD2 . . 4.430 4.034 3.878 4.258 . 0 0 "[ . 1 . 2 . 3]" 1
1203 1 63 ALA MB 1 64 VAL H . . 4.320 3.405 3.347 3.459 . 0 0 "[ . 1 . 2 . 3]" 1
1204 1 63 ALA MB 1 64 VAL MG1 . . 5.590 4.989 4.877 5.095 . 0 0 "[ . 1 . 2 . 3]" 1
1205 1 64 VAL H 1 64 VAL HB . . 3.040 2.639 2.600 2.725 . 0 0 "[ . 1 . 2 . 3]" 1
1206 1 64 VAL H 1 64 VAL MG1 . . 3.260 2.629 2.556 2.701 . 0 0 "[ . 1 . 2 . 3]" 1
1207 1 64 VAL H 1 64 VAL MG2 . . 4.000 3.894 3.867 3.940 . 0 0 "[ . 1 . 2 . 3]" 1
1208 1 64 VAL H 1 65 SER H . . 3.360 2.192 2.104 2.323 . 0 0 "[ . 1 . 2 . 3]" 1
1209 1 64 VAL H 1 65 SER HA . . 5.390 4.747 4.667 4.855 . 0 0 "[ . 1 . 2 . 3]" 1
1210 1 64 VAL H 1 65 SER HB2 . . 5.500 5.548 5.511 5.611 0.111 30 0 "[ . 1 . 2 . 3]" 1
1211 1 64 VAL H 1 66 PRO HD2 . . 4.290 4.412 4.371 4.439 0.149 26 0 "[ . 1 . 2 . 3]" 1
1212 1 64 VAL H 1 69 TYR QD . . 4.330 3.919 3.779 4.025 . 0 0 "[ . 1 . 2 . 3]" 1
1213 1 64 VAL H 1 69 TYR QE . . 4.590 4.604 4.509 4.665 0.075 19 0 "[ . 1 . 2 . 3]" 1
1214 1 64 VAL HA 1 64 VAL MG1 . . 3.250 3.231 3.218 3.252 0.002 27 0 "[ . 1 . 2 . 3]" 1
1215 1 64 VAL HA 1 64 VAL MG2 . . 3.220 2.126 2.085 2.162 . 0 0 "[ . 1 . 2 . 3]" 1
1216 1 64 VAL HB 1 65 SER H . . 3.900 3.814 3.721 3.893 . 0 0 "[ . 1 . 2 . 3]" 1
1217 1 64 VAL HB 1 69 TYR QD . . 4.640 4.746 4.710 4.786 0.146 15 0 "[ . 1 . 2 . 3]" 1
1218 1 64 VAL HB 1 69 TYR QE . . 4.010 4.088 4.039 4.128 0.118 30 0 "[ . 1 . 2 . 3]" 1
1219 1 64 VAL MG1 1 65 SER H . . 4.940 2.391 2.247 2.512 . 0 0 "[ . 1 . 2 . 3]" 1
1220 1 64 VAL MG1 1 65 SER HB3 . . 5.460 4.241 3.613 4.565 . 0 0 "[ . 1 . 2 . 3]" 1
1221 1 64 VAL MG1 1 69 TYR QE . . 4.400 2.032 1.933 2.120 . 0 0 "[ . 1 . 2 . 3]" 1
1222 1 64 VAL MG2 1 65 SER H . . 4.860 4.095 3.962 4.167 . 0 0 "[ . 1 . 2 . 3]" 1
1223 1 64 VAL MG2 1 65 SER HB3 . . 5.160 5.226 5.203 5.244 0.084 14 0 "[ . 1 . 2 . 3]" 1
1224 1 64 VAL MG2 1 69 TYR QE . . 6.230 4.213 4.135 4.271 . 0 0 "[ . 1 . 2 . 3]" 1
1225 1 65 SER H 1 65 SER HB2 . . 3.960 3.400 3.261 3.501 . 0 0 "[ . 1 . 2 . 3]" 1
1226 1 65 SER H 1 65 SER HB3 . . 3.930 3.952 3.004 4.005 0.075 14 0 "[ . 1 . 2 . 3]" 1
1227 1 65 SER H 1 66 PRO HA . . 5.220 4.130 4.017 4.386 . 0 0 "[ . 1 . 2 . 3]" 1
1228 1 65 SER H 1 66 PRO HD2 . . 3.690 3.374 3.260 3.553 . 0 0 "[ . 1 . 2 . 3]" 1
1229 1 65 SER H 1 66 PRO HD3 . . 4.330 2.738 2.529 3.122 . 0 0 "[ . 1 . 2 . 3]" 1
1230 1 65 SER H 1 69 TYR QD . . 4.200 3.474 3.327 3.607 . 0 0 "[ . 1 . 2 . 3]" 1
1231 1 65 SER H 1 69 TYR QE . . 4.120 4.136 3.908 4.177 0.057 28 0 "[ . 1 . 2 . 3]" 1
1232 1 65 SER HA 1 66 PRO HA . . 4.620 4.630 4.617 4.647 0.027 4 0 "[ . 1 . 2 . 3]" 1
1233 1 65 SER HA 1 66 PRO HD2 . . 3.180 2.135 2.091 2.206 . 0 0 "[ . 1 . 2 . 3]" 1
1234 1 65 SER HA 1 66 PRO HD3 . . 3.350 3.206 3.157 3.337 . 0 0 "[ . 1 . 2 . 3]" 1
1235 1 65 SER HA 1 66 PRO HG3 . . 4.860 4.758 4.712 4.832 . 0 0 "[ . 1 . 2 . 3]" 1
1236 1 65 SER HA 1 69 TYR QE . . 5.250 5.253 5.142 5.349 0.099 12 0 "[ . 1 . 2 . 3]" 1
1237 1 65 SER HB2 1 68 LEU H . . 4.330 4.267 3.933 4.608 0.278 12 0 "[ . 1 . 2 . 3]" 1
1238 1 65 SER HB2 1 68 LEU HB3 . . 4.090 2.825 2.333 4.154 0.064 14 0 "[ . 1 . 2 . 3]" 1
1239 1 65 SER HB2 1 68 LEU MD1 . . 4.750 4.660 3.027 4.834 0.084 3 0 "[ . 1 . 2 . 3]" 1
1240 1 65 SER HB2 1 68 LEU HG . . 5.370 3.568 2.245 5.442 0.072 12 0 "[ . 1 . 2 . 3]" 1
1241 1 65 SER HB2 1 69 TYR QE . . 3.720 2.884 2.589 3.199 . 0 0 "[ . 1 . 2 . 3]" 1
1242 1 65 SER HB3 1 66 PRO HD3 . . 5.080 5.154 5.131 5.175 0.095 20 0 "[ . 1 . 2 . 3]" 1
1243 1 65 SER HB3 1 68 LEU HB3 . . 5.030 3.360 2.165 5.076 0.046 14 0 "[ . 1 . 2 . 3]" 1
1244 1 65 SER HB3 1 69 TYR QD . . 4.430 4.043 2.464 4.309 . 0 0 "[ . 1 . 2 . 3]" 1
1245 1 65 SER HB3 1 69 TYR QE . . 3.890 3.885 3.052 3.958 0.068 8 0 "[ . 1 . 2 . 3]" 1
1246 1 66 PRO HA 1 67 GLY H . . 3.300 2.164 2.084 2.234 . 0 0 "[ . 1 . 2 . 3]" 1
1247 1 66 PRO HA 1 68 LEU H . . 3.890 3.578 3.367 3.880 . 0 0 "[ . 1 . 2 . 3]" 1
1248 1 66 PRO HA 1 69 TYR H . . 5.100 3.604 3.331 4.230 . 0 0 "[ . 1 . 2 . 3]" 1
1249 1 67 GLY H 1 68 LEU H . . 3.630 3.073 2.872 3.305 . 0 0 "[ . 1 . 2 . 3]" 1
1250 1 67 GLY H 1 69 TYR H . . 5.420 3.716 3.302 4.035 . 0 0 "[ . 1 . 2 . 3]" 1
1251 1 67 GLY HA3 1 69 TYR H . . 5.060 4.946 4.680 5.196 0.136 2 0 "[ . 1 . 2 . 3]" 1
1252 1 68 LEU H 1 68 LEU HB2 . . 3.460 2.767 2.429 3.494 0.034 7 0 "[ . 1 . 2 . 3]" 1
1253 1 68 LEU H 1 68 LEU HB3 . . 3.460 2.348 2.154 3.562 0.102 14 0 "[ . 1 . 2 . 3]" 1
1254 1 68 LEU H 1 68 LEU MD1 . . 5.030 4.262 3.874 4.363 . 0 0 "[ . 1 . 2 . 3]" 1
1255 1 68 LEU H 1 68 LEU MD2 . . 4.600 4.108 2.937 4.251 . 0 0 "[ . 1 . 2 . 3]" 1
1256 1 68 LEU H 1 69 TYR H . . 3.100 2.335 2.168 2.612 . 0 0 "[ . 1 . 2 . 3]" 1
1257 1 68 LEU H 1 69 TYR HA . . 5.500 5.015 4.856 5.231 . 0 0 "[ . 1 . 2 . 3]" 1
1258 1 68 LEU H 1 69 TYR HB2 . . 4.840 4.238 3.936 4.641 . 0 0 "[ . 1 . 2 . 3]" 1
1259 1 68 LEU H 1 69 TYR QD . . 4.850 4.508 3.993 4.785 . 0 0 "[ . 1 . 2 . 3]" 1
1260 1 68 LEU HA 1 68 LEU MD1 . . 3.840 2.360 2.131 3.836 . 0 0 "[ . 1 . 2 . 3]" 1
1261 1 68 LEU HA 1 68 LEU MD2 . . 3.820 3.810 2.272 3.954 0.134 7 0 "[ . 1 . 2 . 3]" 1
1262 1 68 LEU HA 1 68 LEU HG . . 3.960 3.277 2.670 3.747 . 0 0 "[ . 1 . 2 . 3]" 1
1263 1 68 LEU HA 1 69 TYR HA . . 5.500 4.748 4.586 4.839 . 0 0 "[ . 1 . 2 . 3]" 1
1264 1 68 LEU HA 1 69 TYR QD . . 5.390 4.696 4.402 5.133 . 0 0 "[ . 1 . 2 . 3]" 1
1265 1 68 LEU HB3 1 69 TYR H . . 4.080 2.668 2.279 3.519 . 0 0 "[ . 1 . 2 . 3]" 1
1266 1 68 LEU MD1 1 69 TYR H . . 5.500 4.370 3.668 4.955 . 0 0 "[ . 1 . 2 . 3]" 1
1267 1 68 LEU MD2 1 69 TYR H . . 4.910 4.209 3.757 4.756 . 0 0 "[ . 1 . 2 . 3]" 1
1268 1 68 LEU HG 1 69 TYR H . . 5.190 3.576 2.649 4.439 . 0 0 "[ . 1 . 2 . 3]" 1
1269 1 68 LEU HG 1 69 TYR HA . . 5.500 3.723 3.314 5.679 0.179 14 0 "[ . 1 . 2 . 3]" 1
1270 1 68 LEU HG 1 69 TYR QD . . 4.190 2.461 2.131 4.098 . 0 0 "[ . 1 . 2 . 3]" 1
1271 1 68 LEU HG 1 69 TYR QE . . 4.980 3.733 3.396 5.032 0.052 14 0 "[ . 1 . 2 . 3]" 1
1272 1 69 TYR H 1 69 TYR HB2 . . 3.620 2.225 2.103 2.323 . 0 0 "[ . 1 . 2 . 3]" 1
1273 1 69 TYR H 1 69 TYR HB3 . . 3.700 3.475 3.408 3.540 . 0 0 "[ . 1 . 2 . 3]" 1
1274 1 69 TYR H 1 69 TYR QD . . 4.230 2.837 2.614 3.160 . 0 0 "[ . 1 . 2 . 3]" 1
1275 1 69 TYR H 1 70 ARG H . . 5.070 4.333 4.134 4.543 . 0 0 "[ . 1 . 2 . 3]" 1
1276 1 69 TYR HA 1 69 TYR QD . . 3.040 2.343 2.207 2.536 . 0 0 "[ . 1 . 2 . 3]" 1
1277 1 69 TYR HA 1 69 TYR QE . . 4.370 4.368 4.263 4.420 0.050 6 0 "[ . 1 . 2 . 3]" 1
1278 1 69 TYR HA 1 70 ARG H . . 2.980 2.183 2.076 2.319 . 0 0 "[ . 1 . 2 . 3]" 1
1279 1 69 TYR HA 1 70 ARG HB2 . . 5.500 4.379 4.070 4.764 . 0 0 "[ . 1 . 2 . 3]" 1
1280 1 69 TYR HB2 1 70 ARG H . . 4.900 4.632 4.438 4.742 . 0 0 "[ . 1 . 2 . 3]" 1
1281 1 69 TYR HB2 1 71 VAL MG2 . . 4.250 3.268 2.958 3.656 . 0 0 "[ . 1 . 2 . 3]" 1
1282 1 69 TYR HB3 1 70 ARG H . . 4.160 3.902 3.501 4.162 0.002 14 0 "[ . 1 . 2 . 3]" 1
1283 1 69 TYR HB3 1 71 VAL MG2 . . 4.290 2.056 1.948 2.303 . 0 0 "[ . 1 . 2 . 3]" 1
1284 1 69 TYR QD 1 70 ARG H . . 4.730 4.312 4.128 4.487 . 0 0 "[ . 1 . 2 . 3]" 1
1285 1 70 ARG H 1 70 ARG HB2 . . 3.790 2.252 2.027 2.557 . 0 0 "[ . 1 . 2 . 3]" 1
1286 1 70 ARG H 1 70 ARG HB3 . . 3.920 2.874 2.238 3.551 . 0 0 "[ . 1 . 2 . 3]" 1
1287 1 70 ARG H 1 70 ARG HG2 . . 4.620 4.223 2.875 4.621 0.001 5 0 "[ . 1 . 2 . 3]" 1
1288 1 70 ARG H 1 70 ARG HG3 . . 5.130 4.062 2.792 4.617 . 0 0 "[ . 1 . 2 . 3]" 1
1289 1 70 ARG H 1 71 VAL H . . 4.920 3.924 3.356 4.632 . 0 0 "[ . 1 . 2 . 3]" 1
1290 1 70 ARG H 1 71 VAL MG2 . . 5.010 4.137 3.637 4.459 . 0 0 "[ . 1 . 2 . 3]" 1
1291 1 70 ARG HA 1 70 ARG HD2 . . 4.400 3.734 2.124 4.546 0.146 11 0 "[ . 1 . 2 . 3]" 1
1292 1 70 ARG HA 1 70 ARG HD3 . . 4.080 3.403 2.171 4.198 0.118 10 0 "[ . 1 . 2 . 3]" 1
1293 1 70 ARG HA 1 70 ARG HG2 . . 3.680 2.975 2.297 3.747 0.067 2 0 "[ . 1 . 2 . 3]" 1
1294 1 70 ARG HA 1 70 ARG HG3 . . 3.810 3.110 2.287 3.884 0.074 20 0 "[ . 1 . 2 . 3]" 1
1295 1 70 ARG HA 1 71 VAL H . . 3.200 2.469 2.269 2.755 . 0 0 "[ . 1 . 2 . 3]" 1
1296 1 70 ARG HA 1 71 VAL MG2 . . 4.210 4.076 3.671 4.289 0.079 11 0 "[ . 1 . 2 . 3]" 1
1297 1 70 ARG HB2 1 70 ARG HD3 . . 3.720 3.224 2.336 4.002 0.282 23 0 "[ . 1 . 2 . 3]" 1
1298 1 70 ARG HB2 1 71 VAL H . . 5.070 4.613 4.323 4.854 . 0 0 "[ . 1 . 2 . 3]" 1
1299 1 70 ARG HB3 1 70 ARG HD3 . . 4.030 3.199 2.064 4.155 0.125 25 0 "[ . 1 . 2 . 3]" 1
1300 1 70 ARG HB3 1 71 VAL H . . 4.890 4.217 3.376 4.596 . 0 0 "[ . 1 . 2 . 3]" 1
1301 1 70 ARG HB3 1 71 VAL HA . . 5.500 4.640 3.931 4.931 . 0 0 "[ . 1 . 2 . 3]" 1
1302 1 70 ARG HD3 1 71 VAL H . . 5.600 5.174 3.449 5.838 0.238 21 0 "[ . 1 . 2 . 3]" 1
1303 1 70 ARG HG2 1 71 VAL H . . 5.600 5.037 4.084 5.717 0.117 26 0 "[ . 1 . 2 . 3]" 1
1304 1 70 ARG HG3 1 71 VAL H . . 5.420 5.115 3.920 5.833 0.413 13 0 "[ . 1 . 2 . 3]" 1
1305 1 71 VAL H 1 71 VAL HB . . 3.640 2.859 2.718 3.018 . 0 0 "[ . 1 . 2 . 3]" 1
1306 1 71 VAL H 1 71 VAL MG1 . . 4.540 3.940 3.849 4.049 . 0 0 "[ . 1 . 2 . 3]" 1
1307 1 71 VAL H 1 71 VAL MG2 . . 3.950 2.231 1.908 2.927 . 0 0 "[ . 1 . 2 . 3]" 1
1308 1 71 VAL H 1 72 SER H . . 5.480 4.550 4.399 4.655 . 0 0 "[ . 1 . 2 . 3]" 1
1309 1 71 VAL HA 1 71 VAL MG1 . . 3.580 2.307 2.203 2.362 . 0 0 "[ . 1 . 2 . 3]" 1
1310 1 71 VAL HA 1 71 VAL MG2 . . 3.420 2.436 2.349 2.601 . 0 0 "[ . 1 . 2 . 3]" 1
1311 1 71 VAL HA 1 72 SER H . . 2.880 2.077 1.968 2.183 . 0 0 "[ . 1 . 2 . 3]" 1
1312 1 71 VAL HA 1 72 SER HA . . 5.100 4.433 4.387 4.497 . 0 0 "[ . 1 . 2 . 3]" 1
1313 1 71 VAL HA 1 72 SER HB3 . . 5.380 5.342 4.665 5.525 0.145 9 0 "[ . 1 . 2 . 3]" 1
1314 1 71 VAL HB 1 72 SER H . . 5.070 4.024 3.794 4.208 . 0 0 "[ . 1 . 2 . 3]" 1
1315 1 71 VAL MG1 1 72 SER H . . 3.740 2.536 2.204 2.777 . 0 0 "[ . 1 . 2 . 3]" 1
1316 1 71 VAL MG1 1 72 SER HA . . 5.040 3.709 3.319 3.972 . 0 0 "[ . 1 . 2 . 3]" 1
1317 1 72 SER H 1 72 SER HB2 . . 4.090 2.947 2.605 3.962 . 0 0 "[ . 1 . 2 . 3]" 1
1318 1 72 SER H 1 72 SER HB3 . . 3.730 3.699 2.978 3.809 0.079 12 0 "[ . 1 . 2 . 3]" 1
1319 1 72 SER HA 1 73 ILE H . . 3.050 2.323 2.180 2.493 . 0 0 "[ . 1 . 2 . 3]" 1
1320 1 72 SER HA 1 73 ILE HA . . 5.100 4.515 4.405 4.599 . 0 0 "[ . 1 . 2 . 3]" 1
1321 1 72 SER HA 1 73 ILE HB . . 4.910 4.690 4.563 4.861 . 0 0 "[ . 1 . 2 . 3]" 1
1322 1 72 SER HA 1 73 ILE HG12 . . 5.340 5.151 4.758 5.498 0.158 30 0 "[ . 1 . 2 . 3]" 1
1323 1 72 SER HB2 1 73 ILE H . . 3.730 3.616 2.572 3.810 0.080 26 0 "[ . 1 . 2 . 3]" 1
1324 1 72 SER HB3 1 73 ILE H . . 3.780 3.048 2.384 3.810 0.030 6 0 "[ . 1 . 2 . 3]" 1
1325 1 73 ILE H 1 73 ILE HB . . 3.000 2.472 2.375 2.629 . 0 0 "[ . 1 . 2 . 3]" 1
1326 1 73 ILE H 1 73 ILE MD . . 4.190 3.691 2.133 3.951 . 0 0 "[ . 1 . 2 . 3]" 1
1327 1 73 ILE H 1 73 ILE HG12 . . 3.870 3.780 3.395 3.888 0.018 10 0 "[ . 1 . 2 . 3]" 1
1328 1 73 ILE H 1 73 ILE MG . . 4.100 3.815 3.769 3.854 . 0 0 "[ . 1 . 2 . 3]" 1
1329 1 73 ILE HA 1 73 ILE HG13 . . 4.040 3.032 2.582 3.265 . 0 0 "[ . 1 . 2 . 3]" 1
1330 1 73 ILE HA 1 73 ILE MG . . 3.500 2.456 2.322 2.532 . 0 0 "[ . 1 . 2 . 3]" 1
1331 1 73 ILE HA 1 74 THR H . . 3.010 2.130 2.038 2.266 . 0 0 "[ . 1 . 2 . 3]" 1
1332 1 73 ILE HA 1 74 THR HA . . 5.450 4.391 4.288 4.512 . 0 0 "[ . 1 . 2 . 3]" 1
1333 1 73 ILE HA 1 74 THR HB . . 5.360 4.875 4.330 5.458 0.098 16 0 "[ . 1 . 2 . 3]" 1
1334 1 73 ILE HA 1 74 THR MG . . 5.000 4.298 3.469 5.099 0.099 6 0 "[ . 1 . 2 . 3]" 1
1335 1 73 ILE HA 1 75 SER H . . 5.500 5.407 4.388 5.664 0.164 30 0 "[ . 1 . 2 . 3]" 1
1336 1 73 ILE HB 1 73 ILE MD . . 3.750 2.433 2.344 2.498 . 0 0 "[ . 1 . 2 . 3]" 1
1337 1 73 ILE HB 1 74 THR HA . . 5.370 5.048 4.774 5.272 . 0 0 "[ . 1 . 2 . 3]" 1
1338 1 73 ILE MG 1 74 THR H . . 3.840 2.944 2.676 3.672 . 0 0 "[ . 1 . 2 . 3]" 1
1339 1 73 ILE MG 1 74 THR HA . . 4.420 3.949 3.546 4.430 0.010 1 0 "[ . 1 . 2 . 3]" 1
1340 1 73 ILE MG 1 75 SER H . . 4.260 3.671 2.617 4.277 0.017 21 0 "[ . 1 . 2 . 3]" 1
1341 1 73 ILE MG 1 75 SER HB2 . . 5.070 3.229 2.395 4.439 . 0 0 "[ . 1 . 2 . 3]" 1
1342 1 74 THR H 1 74 THR HB . . 3.100 3.027 2.787 3.346 0.246 16 0 "[ . 1 . 2 . 3]" 1
1343 1 74 THR H 1 74 THR MG . . 3.660 2.751 1.976 3.680 0.020 14 0 "[ . 1 . 2 . 3]" 1
1344 1 74 THR H 1 75 SER H . . 5.090 4.186 3.390 4.443 . 0 0 "[ . 1 . 2 . 3]" 1
1345 1 74 THR HA 1 74 THR MG . . 3.350 2.786 2.100 3.285 . 0 0 "[ . 1 . 2 . 3]" 1
1346 1 74 THR HA 1 75 SER H . . 3.490 2.169 2.015 2.611 . 0 0 "[ . 1 . 2 . 3]" 1
1347 1 74 THR HB 1 75 SER H . . 4.480 4.281 4.101 4.540 0.060 27 0 "[ . 1 . 2 . 3]" 1
1348 1 74 THR MG 1 75 SER H . . 4.990 3.960 3.176 4.415 . 0 0 "[ . 1 . 2 . 3]" 1
1349 1 75 SER H 1 77 VAL QG . . 3.460 3.426 2.860 3.527 0.067 17 0 "[ . 1 . 2 . 3]" 1
1350 1 75 SER HA 1 76 GLU H . . 3.220 2.485 2.229 3.423 0.203 26 0 "[ . 1 . 2 . 3]" 1
1351 1 75 SER HB2 1 76 GLU H . . 4.070 3.664 2.680 4.107 0.037 27 0 "[ . 1 . 2 . 3]" 1
1352 1 75 SER HB2 1 77 VAL H . . 5.200 5.054 3.948 5.295 0.095 26 0 "[ . 1 . 2 . 3]" 1
1353 1 75 SER HB3 1 77 VAL H . . 5.230 4.755 3.681 5.353 0.123 4 0 "[ . 1 . 2 . 3]" 1
1354 1 76 GLU H 1 76 GLU HB2 . . 3.370 2.609 1.944 3.514 0.144 6 0 "[ . 1 . 2 . 3]" 1
1355 1 76 GLU H 1 76 GLU HB3 . . 3.880 2.659 2.371 3.499 . 0 0 "[ . 1 . 2 . 3]" 1
1356 1 76 GLU H 1 76 GLU HG2 . . 4.680 4.402 2.505 4.722 0.042 2 0 "[ . 1 . 2 . 3]" 1
1357 1 76 GLU H 1 77 VAL H . . 4.020 3.878 2.237 4.393 0.373 9 0 "[ . 1 . 2 . 3]" 1
1358 1 76 GLU H 1 77 VAL QG . . 4.070 3.786 1.906 4.135 0.065 3 0 "[ . 1 . 2 . 3]" 1
1359 1 76 GLU HA 1 76 GLU HG2 . . 3.490 2.996 2.290 3.653 0.163 6 0 "[ . 1 . 2 . 3]" 1
1360 1 76 GLU HA 1 77 VAL H . . 3.060 2.260 2.038 2.826 . 0 0 "[ . 1 . 2 . 3]" 1
1361 1 76 GLU HA 1 77 VAL QG . . 4.950 3.676 3.162 4.261 . 0 0 "[ . 1 . 2 . 3]" 1
1362 1 76 GLU HB2 1 76 GLU HG2 . . 3.040 2.954 2.396 3.056 0.016 1 0 "[ . 1 . 2 . 3]" 1
1363 1 76 GLU HB2 1 77 VAL H . . 4.440 4.339 3.262 4.517 0.077 4 0 "[ . 1 . 2 . 3]" 1
1364 1 76 GLU HG2 1 77 VAL H . . 5.440 4.031 2.688 5.242 . 0 0 "[ . 1 . 2 . 3]" 1
1365 1 77 VAL H 1 77 VAL HB . . 3.970 3.455 2.412 3.980 0.010 29 0 "[ . 1 . 2 . 3]" 1
1366 1 77 VAL H 1 77 VAL QG . . 3.630 2.245 1.960 2.648 . 0 0 "[ . 1 . 2 . 3]" 1
1367 1 77 VAL HA 1 77 VAL QG . . 3.060 2.275 2.124 2.430 . 0 0 "[ . 1 . 2 . 3]" 1
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