NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
632721 |
6ews   |
34193 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6ews
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 1602
_Distance_constraint_stats_list.Viol_count 4148
_Distance_constraint_stats_list.Viol_total 4444.248
_Distance_constraint_stats_list.Viol_max 0.292
_Distance_constraint_stats_list.Viol_rms 0.0199
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0069
_Distance_constraint_stats_list.Viol_average_violations_only 0.0536
_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 LYS 10.296 0.089 2 0 "[ . 1 . 2]"
1 3 ASN 5.032 0.089 2 0 "[ . 1 . 2]"
1 4 ALA 10.522 0.143 7 0 "[ . 1 . 2]"
1 5 ALA 6.645 0.088 7 0 "[ . 1 . 2]"
1 6 GLN 12.879 0.085 4 0 "[ . 1 . 2]"
1 7 ILE 13.563 0.100 19 0 "[ . 1 . 2]"
1 8 VAL 9.664 0.112 16 0 "[ . 1 . 2]"
1 9 ASP 4.692 0.112 16 0 "[ . 1 . 2]"
1 10 GLU 4.590 0.094 15 0 "[ . 1 . 2]"
1 11 ALA 10.440 0.105 15 0 "[ . 1 . 2]"
1 12 LEU 3.880 0.099 18 0 "[ . 1 . 2]"
1 13 ASN 7.008 0.086 11 0 "[ . 1 . 2]"
1 14 GLN 10.591 0.102 18 0 "[ . 1 . 2]"
1 15 GLY 2.656 0.086 11 0 "[ . 1 . 2]"
1 16 ILE 14.067 0.109 2 0 "[ . 1 . 2]"
1 17 THR 6.947 0.093 16 0 "[ . 1 . 2]"
1 18 LEU 11.284 0.292 2 0 "[ . 1 . 2]"
1 19 PHE 4.542 0.093 16 0 "[ . 1 . 2]"
1 20 VAL 8.193 0.164 2 0 "[ . 1 . 2]"
1 21 ALA 5.817 0.090 13 0 "[ . 1 . 2]"
1 22 ASP 5.066 0.087 2 0 "[ . 1 . 2]"
1 23 ASN 5.921 0.164 2 0 "[ . 1 . 2]"
1 24 ARG 5.340 0.085 10 0 "[ . 1 . 2]"
1 25 LEU 6.164 0.100 2 0 "[ . 1 . 2]"
1 26 GLN 7.508 0.092 18 0 "[ . 1 . 2]"
1 27 TYR 3.995 0.105 15 0 "[ . 1 . 2]"
1 28 GLU 2.866 0.086 7 0 "[ . 1 . 2]"
1 29 THR 6.576 0.100 10 0 "[ . 1 . 2]"
1 30 SER 0.297 0.083 15 0 "[ . 1 . 2]"
1 31 ARG 1.662 0.109 2 0 "[ . 1 . 2]"
1 32 ASP 0.659 0.093 10 0 "[ . 1 . 2]"
1 33 ASN 2.154 0.109 2 0 "[ . 1 . 2]"
1 34 ILE 13.666 0.109 2 0 "[ . 1 . 2]"
1 35 PRO 10.273 0.097 2 0 "[ . 1 . 2]"
1 36 GLU 8.425 0.116 7 0 "[ . 1 . 2]"
1 37 GLU 2.833 0.087 8 0 "[ . 1 . 2]"
1 38 LEU 18.956 0.116 7 0 "[ . 1 . 2]"
1 39 LEU 7.337 0.097 2 0 "[ . 1 . 2]"
1 40 ASN 4.600 0.088 10 0 "[ . 1 . 2]"
1 41 GLU 9.440 0.100 19 0 "[ . 1 . 2]"
1 42 TRP 5.530 0.091 3 0 "[ . 1 . 2]"
1 43 LYS 5.740 0.096 4 0 "[ . 1 . 2]"
1 44 TYR 4.039 0.087 2 0 "[ . 1 . 2]"
1 45 TYR 4.569 0.152 2 0 "[ . 1 . 2]"
1 46 ARG 9.648 0.100 2 0 "[ . 1 . 2]"
1 47 GLN 2.016 0.087 19 0 "[ . 1 . 2]"
1 48 ASP 5.734 0.104 6 0 "[ . 1 . 2]"
1 49 LEU 11.465 0.292 2 0 "[ . 1 . 2]"
1 50 ILE 18.845 0.119 3 0 "[ . 1 . 2]"
1 51 ASP 5.072 0.078 13 0 "[ . 1 . 2]"
1 52 PHE 5.024 0.129 14 0 "[ . 1 . 2]"
1 53 LEU 13.183 0.119 3 0 "[ . 1 . 2]"
1 54 GLN 15.371 0.144 2 0 "[ . 1 . 2]"
1 55 GLN 5.301 0.120 2 0 "[ . 1 . 2]"
1 56 LEU 7.099 0.096 2 0 "[ . 1 . 2]"
1 57 ASP 4.536 0.091 8 0 "[ . 1 . 2]"
1 58 ALA 4.141 0.115 12 0 "[ . 1 . 2]"
1 59 LYS 2.863 0.115 2 0 "[ . 1 . 2]"
1 60 GLU 1.247 0.115 2 0 "[ . 1 . 2]"
1 61 GLU 1.067 0.094 20 0 "[ . 1 . 2]"
1 62 THR 0.317 0.094 18 0 "[ . 1 . 2]"
1 63 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 LYS HA 1 2 LYS QD . . 4.280 4.041 3.911 4.110 . 0 0 "[ . 1 . 2]" 1
2 1 2 LYS HA 1 2 LYS HG2 . . 3.230 2.968 2.753 3.075 . 0 0 "[ . 1 . 2]" 1
3 1 2 LYS HA 1 2 LYS HG3 . . 3.290 2.517 2.324 2.668 . 0 0 "[ . 1 . 2]" 1
4 1 2 LYS HA 1 3 ASN H . . 2.920 2.106 2.043 2.197 . 0 0 "[ . 1 . 2]" 1
5 1 2 LYS HA 1 3 ASN HB2 . . 5.500 5.406 5.104 5.589 0.089 2 0 "[ . 1 . 2]" 1
6 1 2 LYS HA 1 6 GLN H . . 5.400 5.372 5.181 5.473 0.073 7 0 "[ . 1 . 2]" 1
7 1 2 LYS HA 1 6 GLN HE21 . . 3.090 2.679 2.213 2.949 . 0 0 "[ . 1 . 2]" 1
8 1 2 LYS HA 1 7 ILE MD . . 5.500 5.007 4.763 5.277 . 0 0 "[ . 1 . 2]" 1
9 1 2 LYS HB2 1 2 LYS HE2 . . 5.450 4.808 4.684 4.928 . 0 0 "[ . 1 . 2]" 1
10 1 2 LYS HB2 1 2 LYS QE . . 4.660 4.065 3.725 4.231 . 0 0 "[ . 1 . 2]" 1
11 1 2 LYS HB2 1 2 LYS HE3 . . 5.450 4.400 3.911 4.676 . 0 0 "[ . 1 . 2]" 1
12 1 2 LYS HB2 1 3 ASN H . . 4.830 4.471 4.365 4.545 . 0 0 "[ . 1 . 2]" 1
13 1 2 LYS HB2 1 6 GLN HB2 . . 4.820 4.710 4.472 4.818 . 0 0 "[ . 1 . 2]" 1
14 1 2 LYS HB2 1 6 GLN HE21 . . 5.060 4.854 4.453 5.113 0.053 8 0 "[ . 1 . 2]" 1
15 1 2 LYS HB2 1 7 ILE MD . . 4.890 4.574 4.343 4.787 . 0 0 "[ . 1 . 2]" 1
16 1 2 LYS HB3 1 2 LYS HE2 . . 5.500 4.735 4.537 4.900 . 0 0 "[ . 1 . 2]" 1
17 1 2 LYS HB3 1 2 LYS QE . . 4.670 4.091 3.997 4.203 . 0 0 "[ . 1 . 2]" 1
18 1 2 LYS HB3 1 2 LYS HE3 . . 5.500 4.478 4.337 4.592 . 0 0 "[ . 1 . 2]" 1
19 1 2 LYS HB3 1 3 ASN H . . 4.740 4.343 4.187 4.412 . 0 0 "[ . 1 . 2]" 1
20 1 2 LYS HB3 1 6 GLN HE21 . . 5.180 5.222 4.912 5.248 0.068 5 0 "[ . 1 . 2]" 1
21 1 2 LYS HB3 1 7 ILE H . . 5.310 5.328 5.121 5.375 0.065 8 0 "[ . 1 . 2]" 1
22 1 2 LYS HB3 1 7 ILE MD . . 4.300 3.082 2.841 3.295 . 0 0 "[ . 1 . 2]" 1
23 1 2 LYS QD 1 6 GLN HB2 . . 4.030 3.889 3.728 3.990 . 0 0 "[ . 1 . 2]" 1
24 1 2 LYS QD 1 6 GLN HE21 . . 5.340 5.321 5.186 5.415 0.075 5 0 "[ . 1 . 2]" 1
25 1 2 LYS QD 1 7 ILE H . . 5.340 4.150 3.990 4.331 . 0 0 "[ . 1 . 2]" 1
26 1 2 LYS QD 1 7 ILE HA . . 3.180 3.204 2.984 3.255 0.075 14 0 "[ . 1 . 2]" 1
27 1 2 LYS QD 1 7 ILE MD . . 3.860 3.046 2.792 3.206 . 0 0 "[ . 1 . 2]" 1
28 1 2 LYS QD 1 7 ILE HG12 . . 3.470 2.218 2.054 2.440 . 0 0 "[ . 1 . 2]" 1
29 1 2 LYS QD 1 7 ILE MG . . 3.960 3.234 3.012 3.330 . 0 0 "[ . 1 . 2]" 1
30 1 2 LYS HD2 1 6 GLN HB2 . . 4.630 4.666 4.559 4.692 0.062 9 0 "[ . 1 . 2]" 1
31 1 2 LYS HD2 1 7 ILE MD . . 4.410 4.389 4.154 4.492 0.082 4 0 "[ . 1 . 2]" 1
32 1 2 LYS HD2 1 7 ILE HG12 . . 4.180 3.858 3.747 4.012 . 0 0 "[ . 1 . 2]" 1
33 1 2 LYS HD2 1 7 ILE MG . . 4.700 4.737 4.561 4.785 0.085 3 0 "[ . 1 . 2]" 1
34 1 2 LYS HD3 1 6 GLN HB2 . . 4.630 4.166 3.956 4.324 . 0 0 "[ . 1 . 2]" 1
35 1 2 LYS HD3 1 7 ILE MD . . 4.410 3.107 2.838 3.284 . 0 0 "[ . 1 . 2]" 1
36 1 2 LYS HD3 1 7 ILE HG12 . . 4.180 2.232 2.063 2.461 . 0 0 "[ . 1 . 2]" 1
37 1 2 LYS HD3 1 7 ILE MG . . 4.700 3.292 3.055 3.398 . 0 0 "[ . 1 . 2]" 1
38 1 2 LYS QE 1 2 LYS HG2 . . 3.310 2.571 2.356 2.788 . 0 0 "[ . 1 . 2]" 1
39 1 2 LYS QE 1 2 LYS HG3 . . 3.630 2.515 2.131 2.791 . 0 0 "[ . 1 . 2]" 1
40 1 2 LYS QE 1 6 GLN H . . 5.340 4.533 4.241 4.966 . 0 0 "[ . 1 . 2]" 1
41 1 2 LYS QE 1 6 GLN HB2 . . 4.030 2.869 2.605 3.193 . 0 0 "[ . 1 . 2]" 1
42 1 2 LYS QE 1 6 GLN HE21 . . 4.920 4.935 4.660 5.005 0.085 4 0 "[ . 1 . 2]" 1
43 1 2 LYS QE 1 6 GLN HE22 . . 5.340 5.088 4.396 5.419 0.079 8 0 "[ . 1 . 2]" 1
44 1 2 LYS QE 1 7 ILE H . . 5.340 3.401 3.000 3.837 . 0 0 "[ . 1 . 2]" 1
45 1 2 LYS QE 1 7 ILE HA . . 4.370 2.513 2.040 2.860 . 0 0 "[ . 1 . 2]" 1
46 1 2 LYS QE 1 7 ILE MD . . 4.800 4.213 3.889 4.496 . 0 0 "[ . 1 . 2]" 1
47 1 2 LYS QE 1 7 ILE HG12 . . 4.440 3.023 2.638 3.297 . 0 0 "[ . 1 . 2]" 1
48 1 2 LYS QE 1 8 VAL H . . 5.340 5.109 4.691 5.408 0.068 20 0 "[ . 1 . 2]" 1
49 1 2 LYS HE2 1 7 ILE MD . . 5.500 4.692 4.264 5.174 . 0 0 "[ . 1 . 2]" 1
50 1 2 LYS HE3 1 7 ILE MD . . 5.500 4.838 4.373 5.564 0.064 3 0 "[ . 1 . 2]" 1
51 1 2 LYS HG2 1 3 ASN H . . 4.650 3.568 3.247 3.840 . 0 0 "[ . 1 . 2]" 1
52 1 2 LYS HG2 1 6 GLN HE21 . . 4.230 3.806 3.658 4.022 . 0 0 "[ . 1 . 2]" 1
53 1 2 LYS HG2 1 6 GLN HE22 . . 4.680 4.319 3.994 4.706 0.026 2 0 "[ . 1 . 2]" 1
54 1 2 LYS HG2 1 7 ILE MD . . 4.180 3.427 3.310 3.506 . 0 0 "[ . 1 . 2]" 1
55 1 2 LYS HG3 1 3 ASN H . . 3.860 3.781 3.500 3.942 0.082 2 0 "[ . 1 . 2]" 1
56 1 2 LYS HG3 1 6 GLN HE21 . . 3.980 3.339 3.103 3.613 . 0 0 "[ . 1 . 2]" 1
57 1 2 LYS HG3 1 6 GLN HE22 . . 5.500 3.183 2.674 3.485 . 0 0 "[ . 1 . 2]" 1
58 1 2 LYS HG3 1 6 GLN HG2 . . 4.210 4.276 4.235 4.287 0.077 12 0 "[ . 1 . 2]" 1
59 1 3 ASN H 1 3 ASN HB2 . . 3.690 3.360 3.005 3.566 . 0 0 "[ . 1 . 2]" 1
60 1 3 ASN H 1 3 ASN HB3 . . 3.660 3.196 2.825 3.645 . 0 0 "[ . 1 . 2]" 1
61 1 3 ASN H 1 3 ASN HD21 . . 5.500 3.991 3.007 4.429 . 0 0 "[ . 1 . 2]" 1
62 1 3 ASN H 1 3 ASN HD22 . . 4.550 3.821 3.055 4.174 . 0 0 "[ . 1 . 2]" 1
63 1 3 ASN H 1 4 ALA H . . 4.860 4.602 4.454 4.700 . 0 0 "[ . 1 . 2]" 1
64 1 3 ASN H 1 5 ALA H . . 5.500 5.412 5.292 5.495 . 0 0 "[ . 1 . 2]" 1
65 1 3 ASN H 1 6 GLN H . . 4.490 4.211 4.065 4.345 . 0 0 "[ . 1 . 2]" 1
66 1 3 ASN H 1 6 GLN HB2 . . 3.710 3.414 3.248 3.516 . 0 0 "[ . 1 . 2]" 1
67 1 3 ASN H 1 6 GLN HB3 . . 4.830 4.870 4.696 4.901 0.071 7 0 "[ . 1 . 2]" 1
68 1 3 ASN H 1 6 GLN HG3 . . 4.710 3.914 3.461 4.141 . 0 0 "[ . 1 . 2]" 1
69 1 3 ASN H 1 7 ILE H . . 5.500 5.250 5.017 5.469 . 0 0 "[ . 1 . 2]" 1
70 1 3 ASN H 1 7 ILE MD . . 5.220 5.110 4.948 5.258 0.038 18 0 "[ . 1 . 2]" 1
71 1 3 ASN HA 1 3 ASN HD21 . . 4.640 4.633 4.479 4.699 0.059 7 0 "[ . 1 . 2]" 1
72 1 3 ASN HA 1 4 ALA H . . 2.780 2.285 2.200 2.358 . 0 0 "[ . 1 . 2]" 1
73 1 3 ASN HA 1 4 ALA HA . . 4.530 4.318 4.249 4.441 . 0 0 "[ . 1 . 2]" 1
74 1 3 ASN HA 1 4 ALA MB . . 4.190 4.053 3.977 4.167 . 0 0 "[ . 1 . 2]" 1
75 1 3 ASN HA 1 5 ALA H . . 4.610 4.463 4.348 4.559 . 0 0 "[ . 1 . 2]" 1
76 1 3 ASN HA 1 6 GLN H . . 4.880 4.875 4.633 4.941 0.061 5 0 "[ . 1 . 2]" 1
77 1 3 ASN HB2 1 3 ASN HD21 . . 3.420 2.245 2.117 2.317 . 0 0 "[ . 1 . 2]" 1
78 1 3 ASN HB2 1 3 ASN HD22 . . 3.910 3.519 3.434 3.565 . 0 0 "[ . 1 . 2]" 1
79 1 3 ASN HB2 1 4 ALA H . . 3.450 2.864 2.415 3.432 . 0 0 "[ . 1 . 2]" 1
80 1 3 ASN HB2 1 4 ALA HA . . 5.500 4.869 4.691 5.076 . 0 0 "[ . 1 . 2]" 1
81 1 3 ASN HB2 1 5 ALA H . . 3.190 2.866 2.581 2.947 . 0 0 "[ . 1 . 2]" 1
82 1 3 ASN HB2 1 5 ALA MB . . 5.500 3.240 2.664 3.712 . 0 0 "[ . 1 . 2]" 1
83 1 3 ASN HB2 1 6 GLN H . . 4.240 3.565 2.995 4.036 . 0 0 "[ . 1 . 2]" 1
84 1 3 ASN HB2 1 7 ILE H . . 5.460 5.300 4.917 5.528 0.068 13 0 "[ . 1 . 2]" 1
85 1 3 ASN HB3 1 3 ASN HD21 . . 3.520 3.269 3.010 3.419 . 0 0 "[ . 1 . 2]" 1
86 1 3 ASN HB3 1 4 ALA H . . 3.480 3.280 2.731 3.557 0.077 1 0 "[ . 1 . 2]" 1
87 1 3 ASN HB3 1 4 ALA MB . . 5.170 4.584 3.965 4.967 . 0 0 "[ . 1 . 2]" 1
88 1 3 ASN HB3 1 6 GLN H . . 5.500 4.907 4.589 5.116 . 0 0 "[ . 1 . 2]" 1
89 1 3 ASN HD21 1 5 ALA H . . 4.720 3.734 2.786 4.774 0.054 4 0 "[ . 1 . 2]" 1
90 1 3 ASN HD21 1 5 ALA MB . . 4.310 2.634 1.893 3.557 . 0 0 "[ . 1 . 2]" 1
91 1 3 ASN HD21 1 6 GLN HB2 . . 5.330 4.789 4.040 5.239 . 0 0 "[ . 1 . 2]" 1
92 1 3 ASN HD21 1 6 GLN HG2 . . 5.500 5.132 3.710 5.569 0.069 1 0 "[ . 1 . 2]" 1
93 1 3 ASN HD22 1 5 ALA MB . . 5.020 3.621 2.403 5.068 0.048 20 0 "[ . 1 . 2]" 1
94 1 3 ASN HD22 1 6 GLN HB2 . . 5.500 4.810 4.071 5.558 0.058 4 0 "[ . 1 . 2]" 1
95 1 3 ASN HD22 1 6 GLN HE21 . . 5.500 3.170 2.303 3.546 . 0 0 "[ . 1 . 2]" 1
96 1 3 ASN HD22 1 6 GLN HG2 . . 5.500 4.655 3.648 5.567 0.067 6 0 "[ . 1 . 2]" 1
97 1 4 ALA H 1 4 ALA MB . . 2.830 2.165 2.059 2.239 . 0 0 "[ . 1 . 2]" 1
98 1 4 ALA H 1 5 ALA H . . 3.440 2.958 2.869 3.002 . 0 0 "[ . 1 . 2]" 1
99 1 4 ALA H 1 5 ALA HA . . 5.400 5.467 5.425 5.476 0.076 8 0 "[ . 1 . 2]" 1
100 1 4 ALA H 1 5 ALA MB . . 4.480 4.530 4.391 4.562 0.082 9 0 "[ . 1 . 2]" 1
101 1 4 ALA H 1 6 GLN H . . 4.620 4.511 4.292 4.592 . 0 0 "[ . 1 . 2]" 1
102 1 4 ALA H 1 6 GLN HB2 . . 5.500 5.537 5.406 5.566 0.066 18 0 "[ . 1 . 2]" 1
103 1 4 ALA H 1 7 ILE H . . 5.500 4.877 4.747 4.968 . 0 0 "[ . 1 . 2]" 1
104 1 4 ALA H 1 7 ILE HB . . 5.460 5.497 5.358 5.535 0.075 9 0 "[ . 1 . 2]" 1
105 1 4 ALA H 1 7 ILE MD . . 4.560 4.337 4.100 4.604 0.044 15 0 "[ . 1 . 2]" 1
106 1 4 ALA H 1 7 ILE HG13 . . 4.650 3.977 3.883 4.091 . 0 0 "[ . 1 . 2]" 1
107 1 4 ALA H 1 48 ASP HA . . 5.500 5.339 4.811 5.567 0.067 20 0 "[ . 1 . 2]" 1
108 1 4 ALA H 1 52 PHE QB . . 4.800 4.372 4.024 4.699 . 0 0 "[ . 1 . 2]" 1
109 1 4 ALA HA 1 5 ALA HA . . 5.130 4.833 4.772 4.936 . 0 0 "[ . 1 . 2]" 1
110 1 4 ALA HA 1 6 GLN H . . 4.410 4.398 4.083 4.473 0.063 9 0 "[ . 1 . 2]" 1
111 1 4 ALA HA 1 6 GLN HB2 . . 5.500 5.307 5.123 5.409 . 0 0 "[ . 1 . 2]" 1
112 1 4 ALA HA 1 7 ILE H . . 3.450 3.375 3.155 3.481 0.031 13 0 "[ . 1 . 2]" 1
113 1 4 ALA HA 1 7 ILE HB . . 3.240 2.920 2.700 3.015 . 0 0 "[ . 1 . 2]" 1
114 1 4 ALA HA 1 7 ILE MD . . 3.290 2.984 2.537 3.282 . 0 0 "[ . 1 . 2]" 1
115 1 4 ALA HA 1 7 ILE HG12 . . 4.840 3.979 3.841 4.115 . 0 0 "[ . 1 . 2]" 1
116 1 4 ALA HA 1 7 ILE HG13 . . 3.850 2.243 2.147 2.361 . 0 0 "[ . 1 . 2]" 1
117 1 4 ALA HA 1 7 ILE MG . . 4.490 4.227 4.021 4.356 . 0 0 "[ . 1 . 2]" 1
118 1 4 ALA HA 1 8 VAL H . . 4.180 3.989 3.582 4.214 0.034 18 0 "[ . 1 . 2]" 1
119 1 4 ALA HA 1 48 ASP HB3 . . 4.410 4.000 3.458 4.457 0.047 5 0 "[ . 1 . 2]" 1
120 1 4 ALA HA 1 49 LEU HA . . 4.100 3.194 2.984 3.382 . 0 0 "[ . 1 . 2]" 1
121 1 4 ALA HA 1 49 LEU HB2 . . 5.500 5.385 5.233 5.559 0.059 18 0 "[ . 1 . 2]" 1
122 1 4 ALA HA 1 49 LEU QD . . 3.420 3.201 2.884 3.484 0.064 11 0 "[ . 1 . 2]" 1
123 1 4 ALA HA 1 52 PHE QB . . 4.500 4.526 4.339 4.580 0.080 5 0 "[ . 1 . 2]" 1
124 1 4 ALA MB 1 5 ALA H . . 2.940 2.350 2.209 2.528 . 0 0 "[ . 1 . 2]" 1
125 1 4 ALA MB 1 5 ALA HA . . 4.210 3.724 3.644 3.808 . 0 0 "[ . 1 . 2]" 1
126 1 4 ALA MB 1 5 ALA MB . . 5.400 3.676 3.551 3.840 . 0 0 "[ . 1 . 2]" 1
127 1 4 ALA MB 1 6 GLN H . . 4.610 4.539 4.425 4.616 0.006 9 0 "[ . 1 . 2]" 1
128 1 4 ALA MB 1 7 ILE H . . 5.270 4.480 4.360 4.558 . 0 0 "[ . 1 . 2]" 1
129 1 4 ALA MB 1 7 ILE HB . . 5.500 4.126 3.907 4.275 . 0 0 "[ . 1 . 2]" 1
130 1 4 ALA MB 1 7 ILE MD . . 4.210 4.031 3.638 4.260 0.050 15 0 "[ . 1 . 2]" 1
131 1 4 ALA MB 1 8 VAL H . . 4.400 4.330 3.997 4.465 0.065 8 0 "[ . 1 . 2]" 1
132 1 4 ALA MB 1 48 ASP HA . . 4.670 4.199 3.904 4.453 . 0 0 "[ . 1 . 2]" 1
133 1 4 ALA MB 1 48 ASP HB2 . . 5.500 4.950 4.397 5.166 . 0 0 "[ . 1 . 2]" 1
134 1 4 ALA MB 1 48 ASP HB3 . . 3.710 3.645 3.015 3.798 0.088 6 0 "[ . 1 . 2]" 1
135 1 4 ALA MB 1 49 LEU HA . . 2.880 1.994 1.854 2.149 . 0 0 "[ . 1 . 2]" 1
136 1 4 ALA MB 1 49 LEU QD . . 2.990 2.876 2.468 3.133 0.143 7 0 "[ . 1 . 2]" 1
137 1 4 ALA MB 1 50 ILE HA . . 5.500 5.549 5.457 5.594 0.094 16 0 "[ . 1 . 2]" 1
138 1 4 ALA MB 1 51 ASP H . . 5.210 4.763 4.558 4.931 . 0 0 "[ . 1 . 2]" 1
139 1 4 ALA MB 1 51 ASP HB3 . . 5.470 4.150 3.825 4.471 . 0 0 "[ . 1 . 2]" 1
140 1 4 ALA MB 1 52 PHE H . . 3.400 3.269 3.099 3.436 0.036 14 0 "[ . 1 . 2]" 1
141 1 4 ALA MB 1 52 PHE HA . . 4.370 4.360 4.147 4.435 0.065 5 0 "[ . 1 . 2]" 1
142 1 4 ALA MB 1 52 PHE HB2 . . 3.180 2.114 1.863 2.385 . 0 0 "[ . 1 . 2]" 1
143 1 4 ALA MB 1 52 PHE HB3 . . 3.180 2.782 2.119 3.099 . 0 0 "[ . 1 . 2]" 1
144 1 4 ALA MB 1 53 LEU H . . 4.350 3.987 3.842 4.227 . 0 0 "[ . 1 . 2]" 1
145 1 5 ALA H 1 5 ALA MB . . 2.570 2.196 2.062 2.255 . 0 0 "[ . 1 . 2]" 1
146 1 5 ALA H 1 6 GLN H . . 3.000 2.953 2.786 3.004 0.004 12 0 "[ . 1 . 2]" 1
147 1 5 ALA H 1 7 ILE H . . 4.200 4.199 4.112 4.250 0.050 1 0 "[ . 1 . 2]" 1
148 1 5 ALA H 1 7 ILE HG13 . . 4.640 4.665 4.527 4.709 0.069 13 0 "[ . 1 . 2]" 1
149 1 5 ALA H 1 8 VAL H . . 4.840 4.835 4.702 4.899 0.059 16 0 "[ . 1 . 2]" 1
150 1 5 ALA HA 1 6 GLN H . . 3.540 3.585 3.519 3.605 0.065 7 0 "[ . 1 . 2]" 1
151 1 5 ALA HA 1 7 ILE H . . 4.660 4.385 4.194 4.578 . 0 0 "[ . 1 . 2]" 1
152 1 5 ALA HA 1 8 VAL H . . 4.020 3.692 3.431 4.013 . 0 0 "[ . 1 . 2]" 1
153 1 5 ALA HA 1 8 VAL HB . . 3.340 3.156 2.684 3.400 0.060 10 0 "[ . 1 . 2]" 1
154 1 5 ALA HA 1 8 VAL MG1 . . 4.710 4.478 3.990 4.758 0.048 5 0 "[ . 1 . 2]" 1
155 1 5 ALA HA 1 8 VAL QG . . 3.690 3.358 3.137 3.556 . 0 0 "[ . 1 . 2]" 1
156 1 5 ALA HA 1 8 VAL MG2 . . 4.710 3.478 3.250 3.673 . 0 0 "[ . 1 . 2]" 1
157 1 5 ALA HA 1 9 ASP H . . 4.280 4.149 3.921 4.316 0.036 12 0 "[ . 1 . 2]" 1
158 1 5 ALA HA 1 56 LEU MD1 . . 4.400 4.394 4.065 4.488 0.088 7 0 "[ . 1 . 2]" 1
159 1 5 ALA MB 1 6 GLN H . . 2.990 2.569 2.447 2.780 . 0 0 "[ . 1 . 2]" 1
160 1 5 ALA MB 1 6 GLN HA . . 3.980 3.902 3.791 3.983 0.003 12 0 "[ . 1 . 2]" 1
161 1 5 ALA MB 1 6 GLN HB2 . . 4.540 4.422 4.327 4.591 0.051 20 0 "[ . 1 . 2]" 1
162 1 5 ALA MB 1 6 GLN HE21 . . 5.210 4.830 4.307 5.242 0.032 1 0 "[ . 1 . 2]" 1
163 1 5 ALA MB 1 6 GLN HG2 . . 5.230 4.503 4.235 4.668 . 0 0 "[ . 1 . 2]" 1
164 1 5 ALA MB 1 8 VAL H . . 5.290 4.824 4.669 5.062 . 0 0 "[ . 1 . 2]" 1
165 1 5 ALA MB 1 9 ASP H . . 5.070 4.719 4.481 4.952 . 0 0 "[ . 1 . 2]" 1
166 1 5 ALA MB 1 56 LEU MD1 . . 4.450 4.181 3.853 4.476 0.026 5 0 "[ . 1 . 2]" 1
167 1 6 GLN H 1 6 GLN HB2 . . 2.880 2.300 2.224 2.408 . 0 0 "[ . 1 . 2]" 1
168 1 6 GLN H 1 6 GLN HB3 . . 3.670 3.541 3.499 3.594 . 0 0 "[ . 1 . 2]" 1
169 1 6 GLN H 1 6 GLN HE21 . . 4.800 3.840 3.297 4.152 . 0 0 "[ . 1 . 2]" 1
170 1 6 GLN H 1 6 GLN HE22 . . 5.500 5.402 4.975 5.568 0.068 1 0 "[ . 1 . 2]" 1
171 1 6 GLN H 1 6 GLN HG2 . . 3.750 3.735 3.415 3.812 0.062 8 0 "[ . 1 . 2]" 1
172 1 6 GLN H 1 6 GLN HG3 . . 3.610 2.655 2.417 2.801 . 0 0 "[ . 1 . 2]" 1
173 1 6 GLN H 1 7 ILE HB . . 5.280 5.101 4.910 5.256 . 0 0 "[ . 1 . 2]" 1
174 1 6 GLN H 1 7 ILE MD . . 5.500 5.288 5.076 5.438 . 0 0 "[ . 1 . 2]" 1
175 1 6 GLN H 1 7 ILE HG12 . . 4.540 4.593 4.568 4.606 0.066 11 0 "[ . 1 . 2]" 1
176 1 6 GLN H 1 7 ILE HG13 . . 4.150 3.961 3.681 4.171 0.021 5 0 "[ . 1 . 2]" 1
177 1 6 GLN H 1 8 VAL H . . 4.360 4.261 4.126 4.392 0.032 5 0 "[ . 1 . 2]" 1
178 1 6 GLN H 1 9 ASP HB2 . . 5.500 4.843 4.587 5.148 . 0 0 "[ . 1 . 2]" 1
179 1 6 GLN HA 1 6 GLN HE21 . . 5.140 5.003 4.758 5.177 0.037 20 0 "[ . 1 . 2]" 1
180 1 6 GLN HA 1 6 GLN HG2 . . 2.770 2.499 2.359 2.647 . 0 0 "[ . 1 . 2]" 1
181 1 6 GLN HA 1 6 GLN HG3 . . 3.120 3.055 2.865 3.170 0.050 20 0 "[ . 1 . 2]" 1
182 1 6 GLN HA 1 7 ILE HA . . 4.960 4.800 4.758 4.859 . 0 0 "[ . 1 . 2]" 1
183 1 6 GLN HA 1 8 VAL H . . 4.970 4.636 4.466 4.810 . 0 0 "[ . 1 . 2]" 1
184 1 6 GLN HA 1 9 ASP H . . 3.910 3.471 3.307 3.674 . 0 0 "[ . 1 . 2]" 1
185 1 6 GLN HA 1 9 ASP HB2 . . 3.140 2.447 2.163 3.012 . 0 0 "[ . 1 . 2]" 1
186 1 6 GLN HA 1 9 ASP HB3 . . 4.300 3.768 3.416 4.089 . 0 0 "[ . 1 . 2]" 1
187 1 6 GLN HB2 1 6 GLN HE21 . . 3.180 2.778 2.483 3.101 . 0 0 "[ . 1 . 2]" 1
188 1 6 GLN HB2 1 6 GLN HE22 . . 4.190 3.825 3.586 4.027 . 0 0 "[ . 1 . 2]" 1
189 1 6 GLN HB2 1 7 ILE H . . 3.470 2.787 2.659 2.910 . 0 0 "[ . 1 . 2]" 1
190 1 6 GLN HB2 1 7 ILE HA . . 4.740 4.466 4.332 4.583 . 0 0 "[ . 1 . 2]" 1
191 1 6 GLN HB2 1 7 ILE MD . . 4.950 4.791 4.642 4.913 . 0 0 "[ . 1 . 2]" 1
192 1 6 GLN HB2 1 7 ILE HG12 . . 5.500 3.615 3.413 3.793 . 0 0 "[ . 1 . 2]" 1
193 1 6 GLN HB3 1 6 GLN HE21 . . 3.940 3.762 3.511 3.923 . 0 0 "[ . 1 . 2]" 1
194 1 6 GLN HB3 1 7 ILE H . . 3.810 3.618 3.511 3.713 . 0 0 "[ . 1 . 2]" 1
195 1 6 GLN HE21 1 6 GLN HG3 . . 3.460 2.366 2.276 2.467 . 0 0 "[ . 1 . 2]" 1
196 1 6 GLN HE21 1 7 ILE H . . 5.500 5.318 4.849 5.547 0.047 20 0 "[ . 1 . 2]" 1
197 1 6 GLN HE22 1 6 GLN HG3 . . 3.670 3.599 3.534 3.660 . 0 0 "[ . 1 . 2]" 1
198 1 6 GLN HG3 1 7 ILE H . . 4.780 4.638 4.409 4.759 . 0 0 "[ . 1 . 2]" 1
199 1 7 ILE H 1 7 ILE HB . . 3.290 2.773 2.716 2.844 . 0 0 "[ . 1 . 2]" 1
200 1 7 ILE H 1 7 ILE MD . . 3.750 3.749 3.675 3.815 0.065 15 0 "[ . 1 . 2]" 1
201 1 7 ILE H 1 7 ILE HG12 . . 3.310 2.569 2.449 2.697 . 0 0 "[ . 1 . 2]" 1
202 1 7 ILE H 1 7 ILE HG13 . . 3.220 2.140 2.005 2.252 . 0 0 "[ . 1 . 2]" 1
203 1 7 ILE H 1 7 ILE MG . . 3.840 3.777 3.748 3.816 . 0 0 "[ . 1 . 2]" 1
204 1 7 ILE H 1 8 VAL H . . 3.380 2.652 2.533 2.760 . 0 0 "[ . 1 . 2]" 1
205 1 7 ILE H 1 8 VAL HA . . 5.410 5.275 5.205 5.372 . 0 0 "[ . 1 . 2]" 1
206 1 7 ILE H 1 8 VAL HB . . 5.500 4.885 4.587 5.054 . 0 0 "[ . 1 . 2]" 1
207 1 7 ILE H 1 8 VAL QG . . 4.430 4.103 4.023 4.164 . 0 0 "[ . 1 . 2]" 1
208 1 7 ILE H 1 9 ASP H . . 4.100 4.023 3.900 4.108 0.008 13 0 "[ . 1 . 2]" 1
209 1 7 ILE H 1 10 GLU H . . 4.860 4.792 4.684 4.885 0.025 14 0 "[ . 1 . 2]" 1
210 1 7 ILE HA 1 7 ILE MD . . 3.790 3.724 3.631 3.814 0.024 18 0 "[ . 1 . 2]" 1
211 1 7 ILE HA 1 7 ILE HG12 . . 3.170 2.633 2.554 2.738 . 0 0 "[ . 1 . 2]" 1
212 1 7 ILE HA 1 7 ILE HG13 . . 4.150 3.570 3.491 3.643 . 0 0 "[ . 1 . 2]" 1
213 1 7 ILE HA 1 7 ILE MG . . 3.050 2.259 2.183 2.321 . 0 0 "[ . 1 . 2]" 1
214 1 7 ILE HA 1 9 ASP H . . 4.540 4.466 4.349 4.595 0.055 20 0 "[ . 1 . 2]" 1
215 1 7 ILE HA 1 10 GLU H . . 3.850 3.553 3.415 3.754 . 0 0 "[ . 1 . 2]" 1
216 1 7 ILE HA 1 10 GLU HB2 . . 3.380 2.803 2.593 2.987 . 0 0 "[ . 1 . 2]" 1
217 1 7 ILE HA 1 10 GLU HB3 . . 4.340 4.195 3.447 4.404 0.064 3 0 "[ . 1 . 2]" 1
218 1 7 ILE HA 1 10 GLU QG . . 5.340 3.864 3.072 4.787 . 0 0 "[ . 1 . 2]" 1
219 1 7 ILE HA 1 11 ALA H . . 4.790 4.367 4.215 4.569 . 0 0 "[ . 1 . 2]" 1
220 1 7 ILE HB 1 7 ILE MD . . 3.460 2.688 2.596 2.777 . 0 0 "[ . 1 . 2]" 1
221 1 7 ILE HB 1 8 VAL H . . 3.520 2.568 2.295 2.785 . 0 0 "[ . 1 . 2]" 1
222 1 7 ILE HB 1 8 VAL HA . . 4.330 4.173 3.983 4.263 . 0 0 "[ . 1 . 2]" 1
223 1 7 ILE HB 1 11 ALA MB . . 5.500 5.196 5.001 5.454 . 0 0 "[ . 1 . 2]" 1
224 1 7 ILE HB 1 49 LEU QD . . 3.210 2.361 2.186 2.596 . 0 0 "[ . 1 . 2]" 1
225 1 7 ILE MD 1 7 ILE MG . . 3.040 1.989 1.854 2.047 . 0 0 "[ . 1 . 2]" 1
226 1 7 ILE MD 1 8 VAL H . . 4.720 4.751 4.519 4.808 0.088 11 0 "[ . 1 . 2]" 1
227 1 7 ILE MD 1 41 GLU HB3 . . 5.500 5.479 5.206 5.587 0.087 11 0 "[ . 1 . 2]" 1
228 1 7 ILE MD 1 42 TRP HZ3 . . 4.520 4.158 3.943 4.382 . 0 0 "[ . 1 . 2]" 1
229 1 7 ILE MD 1 45 TYR H . . 4.950 4.275 4.088 4.480 . 0 0 "[ . 1 . 2]" 1
230 1 7 ILE MD 1 45 TYR HA . . 5.220 4.389 4.170 4.613 . 0 0 "[ . 1 . 2]" 1
231 1 7 ILE MD 1 45 TYR HB2 . . 4.020 2.354 2.128 2.497 . 0 0 "[ . 1 . 2]" 1
232 1 7 ILE MD 1 45 TYR HB3 . . 3.950 2.413 2.151 2.682 . 0 0 "[ . 1 . 2]" 1
233 1 7 ILE MD 1 48 ASP H . . 5.500 5.152 4.674 5.575 0.075 13 0 "[ . 1 . 2]" 1
234 1 7 ILE MD 1 48 ASP HB3 . . 4.410 3.205 2.693 3.707 . 0 0 "[ . 1 . 2]" 1
235 1 7 ILE MD 1 49 LEU H . . 5.330 4.176 3.739 4.711 . 0 0 "[ . 1 . 2]" 1
236 1 7 ILE MD 1 49 LEU QD . . 3.710 2.682 1.993 3.010 . 0 0 "[ . 1 . 2]" 1
237 1 7 ILE HG12 1 7 ILE MG . . 3.130 2.668 2.562 2.762 . 0 0 "[ . 1 . 2]" 1
238 1 7 ILE HG12 1 8 VAL H . . 4.500 4.540 4.479 4.569 0.069 18 0 "[ . 1 . 2]" 1
239 1 7 ILE HG12 1 10 GLU HB2 . . 5.500 5.301 5.034 5.424 . 0 0 "[ . 1 . 2]" 1
240 1 7 ILE HG12 1 45 TYR HB3 . . 5.500 5.299 4.938 5.563 0.063 5 0 "[ . 1 . 2]" 1
241 1 7 ILE HG13 1 8 VAL H . . 4.040 3.844 3.760 3.891 . 0 0 "[ . 1 . 2]" 1
242 1 7 ILE HG13 1 8 VAL QG . . 4.570 4.528 4.409 4.610 0.040 11 0 "[ . 1 . 2]" 1
243 1 7 ILE MG 1 8 VAL H . . 3.840 3.714 3.524 3.908 0.068 4 0 "[ . 1 . 2]" 1
244 1 7 ILE MG 1 8 VAL HA . . 4.760 3.896 3.758 4.157 . 0 0 "[ . 1 . 2]" 1
245 1 7 ILE MG 1 10 GLU H . . 4.990 4.734 4.477 4.984 . 0 0 "[ . 1 . 2]" 1
246 1 7 ILE MG 1 10 GLU HB2 . . 4.230 3.873 3.567 4.297 0.067 8 0 "[ . 1 . 2]" 1
247 1 7 ILE MG 1 11 ALA MB . . 4.260 3.585 3.314 3.953 . 0 0 "[ . 1 . 2]" 1
248 1 7 ILE MG 1 41 GLU HB3 . . 4.070 4.113 4.002 4.170 0.100 19 0 "[ . 1 . 2]" 1
249 1 7 ILE MG 1 42 TRP H . . 4.900 4.859 4.655 4.991 0.091 3 0 "[ . 1 . 2]" 1
250 1 7 ILE MG 1 42 TRP HA . . 4.130 3.184 2.746 3.487 . 0 0 "[ . 1 . 2]" 1
251 1 7 ILE MG 1 42 TRP HB2 . . 5.500 5.275 4.798 5.585 0.085 4 0 "[ . 1 . 2]" 1
252 1 7 ILE MG 1 42 TRP HB3 . . 5.500 4.316 3.692 4.991 . 0 0 "[ . 1 . 2]" 1
253 1 7 ILE MG 1 42 TRP HZ3 . . 3.210 2.191 2.060 2.383 . 0 0 "[ . 1 . 2]" 1
254 1 7 ILE MG 1 45 TYR HB3 . . 4.650 4.133 3.579 4.529 . 0 0 "[ . 1 . 2]" 1
255 1 7 ILE MG 1 49 LEU QD . . 3.310 2.143 1.887 2.339 . 0 0 "[ . 1 . 2]" 1
256 1 8 VAL H 1 8 VAL HB . . 2.990 2.543 2.342 2.667 . 0 0 "[ . 1 . 2]" 1
257 1 8 VAL H 1 8 VAL MG1 . . 3.800 3.817 3.725 3.876 0.076 4 0 "[ . 1 . 2]" 1
258 1 8 VAL H 1 8 VAL QG . . 2.800 2.172 2.100 2.294 . 0 0 "[ . 1 . 2]" 1
259 1 8 VAL H 1 8 VAL MG2 . . 3.800 2.185 2.110 2.313 . 0 0 "[ . 1 . 2]" 1
260 1 8 VAL H 1 9 ASP H . . 3.280 2.722 2.607 2.812 . 0 0 "[ . 1 . 2]" 1
261 1 8 VAL H 1 9 ASP HA . . 5.500 5.353 5.250 5.396 . 0 0 "[ . 1 . 2]" 1
262 1 8 VAL H 1 9 ASP HB2 . . 4.760 4.606 4.342 4.805 0.045 14 0 "[ . 1 . 2]" 1
263 1 8 VAL H 1 10 GLU H . . 4.650 4.272 4.030 4.428 . 0 0 "[ . 1 . 2]" 1
264 1 8 VAL H 1 53 LEU QD . . 5.210 4.872 4.649 5.285 0.075 7 0 "[ . 1 . 2]" 1
265 1 8 VAL HA 1 8 VAL MG1 . . 2.850 2.481 2.363 2.585 . 0 0 "[ . 1 . 2]" 1
266 1 8 VAL HA 1 8 VAL QG . . 2.480 2.148 2.067 2.172 . 0 0 "[ . 1 . 2]" 1
267 1 8 VAL HA 1 8 VAL MG2 . . 2.850 2.359 2.272 2.434 . 0 0 "[ . 1 . 2]" 1
268 1 8 VAL HA 1 9 ASP HA . . 4.880 4.830 4.734 4.911 0.031 11 0 "[ . 1 . 2]" 1
269 1 8 VAL HA 1 10 GLU H . . 4.740 4.349 4.070 4.557 . 0 0 "[ . 1 . 2]" 1
270 1 8 VAL HA 1 11 ALA H . . 3.980 3.261 3.165 3.434 . 0 0 "[ . 1 . 2]" 1
271 1 8 VAL HA 1 11 ALA HA . . 5.500 5.340 5.230 5.530 0.030 20 0 "[ . 1 . 2]" 1
272 1 8 VAL HA 1 11 ALA MB . . 3.240 2.684 2.538 2.861 . 0 0 "[ . 1 . 2]" 1
273 1 8 VAL HA 1 12 LEU H . . 4.510 3.880 3.736 4.119 . 0 0 "[ . 1 . 2]" 1
274 1 8 VAL HA 1 18 LEU HB2 . . 4.260 3.873 3.633 4.036 . 0 0 "[ . 1 . 2]" 1
275 1 8 VAL HA 1 18 LEU MD2 . . 5.500 2.010 1.956 2.105 . 0 0 "[ . 1 . 2]" 1
276 1 8 VAL HA 1 49 LEU QD . . 3.770 3.375 3.179 3.473 . 0 0 "[ . 1 . 2]" 1
277 1 8 VAL HA 1 53 LEU QD . . 5.440 4.787 4.632 4.984 . 0 0 "[ . 1 . 2]" 1
278 1 8 VAL HB 1 9 ASP H . . 3.100 2.826 2.629 2.914 . 0 0 "[ . 1 . 2]" 1
279 1 8 VAL HB 1 9 ASP HA . . 5.500 4.498 4.261 4.623 . 0 0 "[ . 1 . 2]" 1
280 1 8 VAL HB 1 9 ASP HB2 . . 5.500 4.802 4.374 5.046 . 0 0 "[ . 1 . 2]" 1
281 1 8 VAL HB 1 11 ALA H . . 5.500 5.552 5.456 5.570 0.070 12 0 "[ . 1 . 2]" 1
282 1 8 VAL HB 1 18 LEU HB2 . . 4.630 4.707 4.695 4.733 0.103 2 0 "[ . 1 . 2]" 1
283 1 8 VAL HB 1 49 LEU QD . . 4.010 4.059 3.959 4.098 0.088 7 0 "[ . 1 . 2]" 1
284 1 8 VAL HB 1 56 LEU MD1 . . 5.500 5.201 4.868 5.451 . 0 0 "[ . 1 . 2]" 1
285 1 8 VAL QG 1 9 ASP H . . 3.280 3.335 3.237 3.392 0.112 16 0 "[ . 1 . 2]" 1
286 1 8 VAL QG 1 9 ASP HA . . 4.030 3.639 3.439 3.778 . 0 0 "[ . 1 . 2]" 1
287 1 8 VAL QG 1 10 GLU H . . 5.160 4.722 4.544 4.869 . 0 0 "[ . 1 . 2]" 1
288 1 8 VAL QG 1 11 ALA H . . 4.570 4.268 4.170 4.360 . 0 0 "[ . 1 . 2]" 1
289 1 8 VAL QG 1 11 ALA MB . . 3.580 3.273 3.114 3.548 . 0 0 "[ . 1 . 2]" 1
290 1 8 VAL QG 1 12 LEU HB2 . . 3.830 3.217 2.860 3.449 . 0 0 "[ . 1 . 2]" 1
291 1 8 VAL QG 1 12 LEU HB3 . . 4.360 4.019 3.737 4.314 . 0 0 "[ . 1 . 2]" 1
292 1 8 VAL QG 1 16 ILE MD . . 4.520 4.349 4.246 4.610 0.090 20 0 "[ . 1 . 2]" 1
293 1 8 VAL QG 1 18 LEU H . . 4.070 2.423 2.127 2.729 . 0 0 "[ . 1 . 2]" 1
294 1 8 VAL QG 1 18 LEU HB2 . . 3.680 2.033 1.983 2.131 . 0 0 "[ . 1 . 2]" 1
295 1 8 VAL QG 1 18 LEU MD1 . . 4.400 3.759 3.628 3.818 . 0 0 "[ . 1 . 2]" 1
296 1 8 VAL QG 1 18 LEU MD2 . . 4.270 1.999 1.903 2.174 . 0 0 "[ . 1 . 2]" 1
297 1 8 VAL QG 1 49 LEU QD . . 3.900 1.892 1.794 1.934 . 0 0 "[ . 1 . 2]" 1
298 1 8 VAL QG 1 53 LEU QD . . 3.470 2.148 2.030 2.332 . 0 0 "[ . 1 . 2]" 1
299 1 8 VAL QG 1 56 LEU MD1 . . 4.610 3.869 3.619 4.080 . 0 0 "[ . 1 . 2]" 1
300 1 8 VAL QG 1 56 LEU MD2 . . 5.440 2.811 2.612 3.381 . 0 0 "[ . 1 . 2]" 1
301 1 8 VAL MG1 1 9 ASP H . . 4.000 3.598 3.422 3.718 . 0 0 "[ . 1 . 2]" 1
302 1 8 VAL MG1 1 16 ILE MD . . 5.500 4.675 4.500 5.047 . 0 0 "[ . 1 . 2]" 1
303 1 8 VAL MG2 1 9 ASP H . . 4.000 3.956 3.854 4.070 0.070 14 0 "[ . 1 . 2]" 1
304 1 8 VAL MG2 1 16 ILE MD . . 5.500 5.193 5.082 5.327 . 0 0 "[ . 1 . 2]" 1
305 1 9 ASP H 1 9 ASP HB2 . . 2.840 2.190 2.080 2.320 . 0 0 "[ . 1 . 2]" 1
306 1 9 ASP H 1 10 GLU H . . 3.250 2.756 2.635 2.822 . 0 0 "[ . 1 . 2]" 1
307 1 9 ASP H 1 10 GLU HB2 . . 4.790 4.644 4.441 4.752 . 0 0 "[ . 1 . 2]" 1
308 1 9 ASP H 1 11 ALA H . . 4.180 4.178 4.096 4.233 0.053 1 0 "[ . 1 . 2]" 1
309 1 9 ASP H 1 12 LEU HB3 . . 5.200 4.919 4.699 5.121 . 0 0 "[ . 1 . 2]" 1
310 1 9 ASP HA 1 11 ALA H . . 4.450 4.415 4.208 4.510 0.060 19 0 "[ . 1 . 2]" 1
311 1 9 ASP HA 1 12 LEU H . . 3.500 3.504 3.299 3.566 0.066 19 0 "[ . 1 . 2]" 1
312 1 9 ASP HA 1 12 LEU HB2 . . 3.870 3.478 3.152 3.735 . 0 0 "[ . 1 . 2]" 1
313 1 9 ASP HA 1 12 LEU HB3 . . 3.550 2.482 2.217 2.662 . 0 0 "[ . 1 . 2]" 1
314 1 9 ASP HA 1 12 LEU QD . . 3.050 2.919 2.460 3.149 0.099 18 0 "[ . 1 . 2]" 1
315 1 9 ASP HA 1 12 LEU HG . . 4.770 4.557 4.269 4.817 0.047 18 0 "[ . 1 . 2]" 1
316 1 9 ASP HB2 1 10 GLU H . . 3.420 2.915 2.430 3.488 0.068 14 0 "[ . 1 . 2]" 1
317 1 9 ASP HB2 1 10 GLU HB2 . . 5.500 4.883 4.401 5.475 . 0 0 "[ . 1 . 2]" 1
318 1 9 ASP HB3 1 10 GLU H . . 3.080 3.121 2.914 3.157 0.077 4 0 "[ . 1 . 2]" 1
319 1 9 ASP HB3 1 10 GLU HA . . 4.620 4.032 3.883 4.109 . 0 0 "[ . 1 . 2]" 1
320 1 9 ASP HB3 1 10 GLU HB2 . . 5.500 5.007 4.415 5.255 . 0 0 "[ . 1 . 2]" 1
321 1 9 ASP HB3 1 13 ASN H . . 5.500 5.352 5.075 5.557 0.057 17 0 "[ . 1 . 2]" 1
322 1 10 GLU H 1 10 GLU HB2 . . 2.930 2.200 2.087 2.276 . 0 0 "[ . 1 . 2]" 1
323 1 10 GLU H 1 10 GLU HB3 . . 3.480 3.438 3.070 3.539 0.059 6 0 "[ . 1 . 2]" 1
324 1 10 GLU H 1 10 GLU HG2 . . 5.000 3.321 2.593 4.528 . 0 0 "[ . 1 . 2]" 1
325 1 10 GLU H 1 10 GLU QG . . 4.270 3.016 2.535 3.931 . 0 0 "[ . 1 . 2]" 1
326 1 10 GLU H 1 10 GLU HG3 . . 5.000 3.803 3.011 4.442 . 0 0 "[ . 1 . 2]" 1
327 1 10 GLU H 1 11 ALA H . . 3.360 2.694 2.491 2.845 . 0 0 "[ . 1 . 2]" 1
328 1 10 GLU H 1 11 ALA HA . . 5.370 5.325 5.183 5.413 0.043 12 0 "[ . 1 . 2]" 1
329 1 10 GLU H 1 11 ALA MB . . 4.450 4.356 4.173 4.483 0.033 8 0 "[ . 1 . 2]" 1
330 1 10 GLU H 1 12 LEU H . . 4.360 4.169 3.909 4.347 . 0 0 "[ . 1 . 2]" 1
331 1 10 GLU H 1 13 ASN H . . 5.500 4.929 4.677 5.133 . 0 0 "[ . 1 . 2]" 1
332 1 10 GLU HA 1 10 GLU QG . . 2.750 2.524 2.074 2.813 0.063 3 0 "[ . 1 . 2]" 1
333 1 10 GLU HA 1 12 LEU H . . 4.830 4.573 4.441 4.736 . 0 0 "[ . 1 . 2]" 1
334 1 10 GLU HA 1 13 ASN H . . 3.910 3.679 3.388 3.919 0.009 18 0 "[ . 1 . 2]" 1
335 1 10 GLU HA 1 13 ASN QB . . 3.230 2.850 2.439 3.164 . 0 0 "[ . 1 . 2]" 1
336 1 10 GLU HA 1 13 ASN HD21 . . 4.130 3.906 3.413 4.199 0.069 13 0 "[ . 1 . 2]" 1
337 1 10 GLU HA 1 13 ASN HD22 . . 5.500 5.440 5.140 5.566 0.066 15 0 "[ . 1 . 2]" 1
338 1 10 GLU HB2 1 11 ALA H . . 3.450 2.946 2.638 3.385 . 0 0 "[ . 1 . 2]" 1
339 1 10 GLU HB2 1 11 ALA MB . . 4.620 4.252 3.883 4.714 0.094 15 0 "[ . 1 . 2]" 1
340 1 10 GLU HB3 1 11 ALA H . . 3.510 3.258 2.552 3.473 . 0 0 "[ . 1 . 2]" 1
341 1 10 GLU HB3 1 11 ALA MB . . 4.270 4.253 3.600 4.361 0.091 20 0 "[ . 1 . 2]" 1
342 1 10 GLU HB3 1 13 ASN QB . . 5.500 4.711 4.402 5.092 . 0 0 "[ . 1 . 2]" 1
343 1 10 GLU QG 1 13 ASN QB . . 5.340 4.588 3.643 5.249 . 0 0 "[ . 1 . 2]" 1
344 1 10 GLU HG2 1 11 ALA H . . 5.500 4.842 4.407 5.368 . 0 0 "[ . 1 . 2]" 1
345 1 10 GLU HG3 1 11 ALA H . . 5.500 5.034 4.813 5.233 . 0 0 "[ . 1 . 2]" 1
346 1 11 ALA H 1 11 ALA MB . . 2.950 2.182 2.102 2.245 . 0 0 "[ . 1 . 2]" 1
347 1 11 ALA H 1 12 LEU H . . 3.270 2.580 2.449 2.683 . 0 0 "[ . 1 . 2]" 1
348 1 11 ALA H 1 13 ASN QB . . 5.170 4.769 4.525 4.953 . 0 0 "[ . 1 . 2]" 1
349 1 11 ALA H 1 16 ILE MG . . 4.730 4.749 4.496 4.821 0.091 4 0 "[ . 1 . 2]" 1
350 1 11 ALA H 1 18 LEU MD2 . . 4.290 3.771 3.613 3.860 . 0 0 "[ . 1 . 2]" 1
351 1 11 ALA H 1 38 LEU MD1 . . 5.240 5.127 5.002 5.294 0.054 12 0 "[ . 1 . 2]" 1
352 1 11 ALA H 1 42 TRP HZ2 . . 4.770 3.875 3.686 4.162 . 0 0 "[ . 1 . 2]" 1
353 1 11 ALA HA 1 12 LEU H . . 3.560 3.555 3.523 3.585 0.025 19 0 "[ . 1 . 2]" 1
354 1 11 ALA HA 1 14 GLN H . . 3.520 3.472 3.301 3.578 0.058 10 0 "[ . 1 . 2]" 1
355 1 11 ALA HA 1 14 GLN HB3 . . 5.500 5.015 4.517 5.230 . 0 0 "[ . 1 . 2]" 1
356 1 11 ALA HA 1 14 GLN HE21 . . 4.160 3.453 2.800 3.778 . 0 0 "[ . 1 . 2]" 1
357 1 11 ALA HA 1 14 GLN HG2 . . 4.530 4.338 4.064 4.582 0.052 11 0 "[ . 1 . 2]" 1
358 1 11 ALA HA 1 14 GLN HG3 . . 5.500 2.603 2.349 2.834 . 0 0 "[ . 1 . 2]" 1
359 1 11 ALA HA 1 16 ILE MD . . 4.210 4.039 3.884 4.194 . 0 0 "[ . 1 . 2]" 1
360 1 11 ALA HA 1 16 ILE MG . . 3.600 2.777 2.578 2.910 . 0 0 "[ . 1 . 2]" 1
361 1 11 ALA HA 1 38 LEU MD1 . . 3.700 3.097 2.946 3.255 . 0 0 "[ . 1 . 2]" 1
362 1 11 ALA MB 1 12 LEU H . . 3.070 2.522 2.377 2.697 . 0 0 "[ . 1 . 2]" 1
363 1 11 ALA MB 1 13 ASN H . . 4.610 4.483 4.412 4.618 0.008 15 0 "[ . 1 . 2]" 1
364 1 11 ALA MB 1 14 GLN H . . 4.630 4.468 4.350 4.567 . 0 0 "[ . 1 . 2]" 1
365 1 11 ALA MB 1 14 GLN HB2 . . 4.450 4.377 3.988 4.526 0.076 10 0 "[ . 1 . 2]" 1
366 1 11 ALA MB 1 14 GLN HE22 . . 5.500 5.526 5.170 5.594 0.094 12 0 "[ . 1 . 2]" 1
367 1 11 ALA MB 1 14 GLN HG3 . . 4.650 4.212 3.986 4.434 . 0 0 "[ . 1 . 2]" 1
368 1 11 ALA MB 1 15 GLY H . . 5.500 5.418 5.064 5.556 0.056 6 0 "[ . 1 . 2]" 1
369 1 11 ALA MB 1 16 ILE H . . 5.020 3.923 3.746 4.041 . 0 0 "[ . 1 . 2]" 1
370 1 11 ALA MB 1 16 ILE MD . . 3.270 2.181 2.096 2.319 . 0 0 "[ . 1 . 2]" 1
371 1 11 ALA MB 1 16 ILE MG . . 2.970 2.072 1.976 2.205 . 0 0 "[ . 1 . 2]" 1
372 1 11 ALA MB 1 17 THR MG . . 5.500 4.917 4.516 5.280 . 0 0 "[ . 1 . 2]" 1
373 1 11 ALA MB 1 18 LEU H . . 4.610 4.426 4.209 4.654 0.044 14 0 "[ . 1 . 2]" 1
374 1 11 ALA MB 1 18 LEU HB2 . . 5.500 4.643 4.542 4.749 . 0 0 "[ . 1 . 2]" 1
375 1 11 ALA MB 1 18 LEU HB3 . . 5.450 5.355 5.304 5.437 . 0 0 "[ . 1 . 2]" 1
376 1 11 ALA MB 1 18 LEU MD1 . . 3.280 3.283 3.158 3.371 0.091 18 0 "[ . 1 . 2]" 1
377 1 11 ALA MB 1 18 LEU MD2 . . 3.770 1.902 1.852 1.968 . 0 0 "[ . 1 . 2]" 1
378 1 11 ALA MB 1 27 TYR HB3 . . 5.070 5.163 5.140 5.175 0.105 15 0 "[ . 1 . 2]" 1
379 1 11 ALA MB 1 38 LEU MD1 . . 3.470 3.119 2.985 3.181 . 0 0 "[ . 1 . 2]" 1
380 1 11 ALA MB 1 38 LEU HG . . 5.500 5.574 5.503 5.592 0.092 15 0 "[ . 1 . 2]" 1
381 1 11 ALA MB 1 42 TRP HD1 . . 4.700 4.217 3.727 4.689 . 0 0 "[ . 1 . 2]" 1
382 1 11 ALA MB 1 42 TRP HZ3 . . 4.790 4.539 4.240 4.829 0.039 4 0 "[ . 1 . 2]" 1
383 1 12 LEU H 1 12 LEU HB2 . . 3.000 2.609 2.511 2.771 . 0 0 "[ . 1 . 2]" 1
384 1 12 LEU H 1 12 LEU HB3 . . 3.020 2.309 2.161 2.442 . 0 0 "[ . 1 . 2]" 1
385 1 12 LEU H 1 12 LEU MD1 . . 5.500 4.202 4.115 4.340 . 0 0 "[ . 1 . 2]" 1
386 1 12 LEU H 1 12 LEU QD . . 4.600 3.725 3.667 3.780 . 0 0 "[ . 1 . 2]" 1
387 1 12 LEU H 1 12 LEU MD2 . . 5.500 4.164 4.048 4.259 . 0 0 "[ . 1 . 2]" 1
388 1 12 LEU H 1 13 ASN QB . . 4.560 4.344 4.175 4.464 . 0 0 "[ . 1 . 2]" 1
389 1 12 LEU H 1 14 GLN H . . 5.500 4.208 4.020 4.322 . 0 0 "[ . 1 . 2]" 1
390 1 12 LEU H 1 16 ILE H . . 5.170 4.488 4.342 4.705 . 0 0 "[ . 1 . 2]" 1
391 1 12 LEU H 1 16 ILE MG . . 4.440 4.317 3.980 4.430 . 0 0 "[ . 1 . 2]" 1
392 1 12 LEU HA 1 12 LEU HB2 . . 2.850 2.387 2.310 2.434 . 0 0 "[ . 1 . 2]" 1
393 1 12 LEU HA 1 12 LEU QD . . 2.600 2.265 2.171 2.475 . 0 0 "[ . 1 . 2]" 1
394 1 12 LEU HA 1 12 LEU HG . . 3.590 3.291 3.166 3.427 . 0 0 "[ . 1 . 2]" 1
395 1 12 LEU HA 1 15 GLY H . . 5.500 3.437 3.103 3.723 . 0 0 "[ . 1 . 2]" 1
396 1 12 LEU HA 1 16 ILE H . . 3.190 2.700 2.488 3.137 . 0 0 "[ . 1 . 2]" 1
397 1 12 LEU HA 1 16 ILE HA . . 5.500 4.725 4.560 4.985 . 0 0 "[ . 1 . 2]" 1
398 1 12 LEU HB2 1 12 LEU MD1 . . 3.290 2.412 2.213 2.518 . 0 0 "[ . 1 . 2]" 1
399 1 12 LEU HB2 1 12 LEU QD . . 2.830 2.147 2.052 2.227 . 0 0 "[ . 1 . 2]" 1
400 1 12 LEU HB2 1 12 LEU MD2 . . 3.290 2.412 2.335 2.498 . 0 0 "[ . 1 . 2]" 1
401 1 12 LEU HB3 1 12 LEU QD . . 2.910 2.245 2.150 2.289 . 0 0 "[ . 1 . 2]" 1
402 1 12 LEU HB3 1 13 ASN H . . 3.300 2.696 2.458 2.888 . 0 0 "[ . 1 . 2]" 1
403 1 12 LEU HB3 1 13 ASN QB . . 5.500 4.189 3.951 4.389 . 0 0 "[ . 1 . 2]" 1
404 1 12 LEU HB3 1 14 GLN H . . 5.190 5.039 4.829 5.125 . 0 0 "[ . 1 . 2]" 1
405 1 12 LEU QD 1 14 GLN H . . 5.040 4.842 4.719 4.941 . 0 0 "[ . 1 . 2]" 1
406 1 12 LEU QD 1 15 GLY H . . 4.000 3.827 3.621 4.065 0.065 5 0 "[ . 1 . 2]" 1
407 1 12 LEU QD 1 16 ILE H . . 5.440 3.962 3.729 4.430 . 0 0 "[ . 1 . 2]" 1
408 1 12 LEU MD1 1 13 ASN H . . 5.500 4.326 4.207 4.369 . 0 0 "[ . 1 . 2]" 1
409 1 12 LEU MD1 1 13 ASN QB . . 5.500 5.354 5.278 5.437 . 0 0 "[ . 1 . 2]" 1
410 1 12 LEU MD1 1 17 THR MG . . 5.500 3.870 3.204 4.744 . 0 0 "[ . 1 . 2]" 1
411 1 12 LEU MD2 1 13 ASN H . . 5.500 4.203 4.119 4.305 . 0 0 "[ . 1 . 2]" 1
412 1 12 LEU MD2 1 13 ASN QB . . 5.500 4.951 4.697 5.132 . 0 0 "[ . 1 . 2]" 1
413 1 12 LEU MD2 1 17 THR MG . . 5.500 4.631 4.098 5.557 0.057 13 0 "[ . 1 . 2]" 1
414 1 12 LEU HG 1 13 ASN H . . 3.330 3.398 3.381 3.411 0.081 7 0 "[ . 1 . 2]" 1
415 1 12 LEU HG 1 13 ASN QB . . 4.520 4.499 4.321 4.580 0.060 20 0 "[ . 1 . 2]" 1
416 1 12 LEU HG 1 14 GLN H . . 5.140 5.179 5.112 5.204 0.064 10 0 "[ . 1 . 2]" 1
417 1 12 LEU HG 1 15 GLY H . . 4.910 4.670 4.497 4.885 . 0 0 "[ . 1 . 2]" 1
418 1 13 ASN H 1 13 ASN HA . . 2.870 2.801 2.763 2.832 . 0 0 "[ . 1 . 2]" 1
419 1 13 ASN H 1 13 ASN QB . . 2.660 2.071 2.003 2.133 . 0 0 "[ . 1 . 2]" 1
420 1 13 ASN H 1 13 ASN HD21 . . 4.220 4.119 3.556 4.288 0.068 6 0 "[ . 1 . 2]" 1
421 1 13 ASN H 1 13 ASN HD22 . . 5.500 5.433 4.987 5.558 0.058 7 0 "[ . 1 . 2]" 1
422 1 13 ASN H 1 14 GLN H . . 3.200 2.784 2.672 2.858 . 0 0 "[ . 1 . 2]" 1
423 1 13 ASN H 1 14 GLN HB2 . . 5.290 5.323 5.120 5.353 0.063 6 0 "[ . 1 . 2]" 1
424 1 13 ASN H 1 14 GLN HG2 . . 4.880 4.912 4.688 4.946 0.066 17 0 "[ . 1 . 2]" 1
425 1 13 ASN H 1 15 GLY H . . 4.070 4.071 3.909 4.131 0.061 15 0 "[ . 1 . 2]" 1
426 1 13 ASN H 1 16 ILE H . . 5.500 4.857 4.766 4.997 . 0 0 "[ . 1 . 2]" 1
427 1 13 ASN HA 1 13 ASN QB . . 2.580 2.504 2.458 2.557 . 0 0 "[ . 1 . 2]" 1
428 1 13 ASN HA 1 13 ASN HD21 . . 4.410 3.666 2.991 4.244 . 0 0 "[ . 1 . 2]" 1
429 1 13 ASN HA 1 13 ASN HD22 . . 4.520 4.146 3.751 4.496 . 0 0 "[ . 1 . 2]" 1
430 1 13 ASN HA 1 15 GLY H . . 5.500 3.814 3.628 4.174 . 0 0 "[ . 1 . 2]" 1
431 1 13 ASN QB 1 13 ASN HD22 . . 3.400 3.271 3.219 3.349 . 0 0 "[ . 1 . 2]" 1
432 1 13 ASN QB 1 14 GLN H . . 3.380 2.773 2.643 2.987 . 0 0 "[ . 1 . 2]" 1
433 1 13 ASN QB 1 14 GLN HG2 . . 4.190 2.996 2.780 3.162 . 0 0 "[ . 1 . 2]" 1
434 1 13 ASN QB 1 14 GLN HG3 . . 4.050 3.299 2.923 3.677 . 0 0 "[ . 1 . 2]" 1
435 1 13 ASN QB 1 15 GLY H . . 4.420 4.479 4.400 4.506 0.086 11 0 "[ . 1 . 2]" 1
436 1 14 GLN H 1 14 GLN HB2 . . 3.320 2.707 2.638 2.809 . 0 0 "[ . 1 . 2]" 1
437 1 14 GLN H 1 14 GLN HB3 . . 3.790 3.640 3.574 3.716 . 0 0 "[ . 1 . 2]" 1
438 1 14 GLN H 1 14 GLN HE21 . . 4.860 4.562 4.212 4.916 0.056 15 0 "[ . 1 . 2]" 1
439 1 14 GLN H 1 14 GLN HG2 . . 3.370 2.850 2.586 3.111 . 0 0 "[ . 1 . 2]" 1
440 1 14 GLN H 1 14 GLN HG3 . . 5.500 2.323 2.147 2.671 . 0 0 "[ . 1 . 2]" 1
441 1 14 GLN H 1 15 GLY H . . 3.150 2.484 2.287 2.657 . 0 0 "[ . 1 . 2]" 1
442 1 14 GLN H 1 15 GLY QA . . 4.760 4.361 4.160 4.490 . 0 0 "[ . 1 . 2]" 1
443 1 14 GLN H 1 16 ILE H . . 3.910 3.496 3.297 3.666 . 0 0 "[ . 1 . 2]" 1
444 1 14 GLN H 1 16 ILE MG . . 4.480 3.511 3.407 3.662 . 0 0 "[ . 1 . 2]" 1
445 1 14 GLN H 1 38 LEU MD1 . . 4.710 4.784 4.746 4.803 0.093 20 0 "[ . 1 . 2]" 1
446 1 14 GLN HA 1 14 GLN HE21 . . 5.500 5.474 5.359 5.557 0.057 4 0 "[ . 1 . 2]" 1
447 1 14 GLN HA 1 14 GLN HG2 . . 3.520 2.707 2.593 2.774 . 0 0 "[ . 1 . 2]" 1
448 1 14 GLN HA 1 14 GLN HG3 . . 3.760 3.612 3.501 3.739 . 0 0 "[ . 1 . 2]" 1
449 1 14 GLN HB2 1 14 GLN HE21 . . 4.380 4.153 3.691 4.353 . 0 0 "[ . 1 . 2]" 1
450 1 14 GLN HB2 1 15 GLY H . . 4.290 3.701 3.226 3.950 . 0 0 "[ . 1 . 2]" 1
451 1 14 GLN HB2 1 16 ILE H . . 4.420 3.582 3.190 3.857 . 0 0 "[ . 1 . 2]" 1
452 1 14 GLN HB2 1 16 ILE MG . . 3.730 2.065 2.007 2.107 . 0 0 "[ . 1 . 2]" 1
453 1 14 GLN HB2 1 34 ILE MD . . 4.960 4.471 4.202 4.821 . 0 0 "[ . 1 . 2]" 1
454 1 14 GLN HB2 1 38 LEU MD1 . . 5.500 3.066 2.709 3.276 . 0 0 "[ . 1 . 2]" 1
455 1 14 GLN HB3 1 14 GLN HE21 . . 4.630 4.438 4.075 4.552 . 0 0 "[ . 1 . 2]" 1
456 1 14 GLN HB3 1 16 ILE MG . . 5.500 3.401 3.105 3.561 . 0 0 "[ . 1 . 2]" 1
457 1 14 GLN HB3 1 38 LEU MD1 . . 5.500 3.687 3.055 3.945 . 0 0 "[ . 1 . 2]" 1
458 1 14 GLN HE21 1 14 GLN HG2 . . 3.510 2.938 2.762 3.273 . 0 0 "[ . 1 . 2]" 1
459 1 14 GLN HE21 1 16 ILE MG . . 4.820 4.736 4.248 4.898 0.078 9 0 "[ . 1 . 2]" 1
460 1 14 GLN HE21 1 38 LEU MD1 . . 3.800 2.997 2.442 3.240 . 0 0 "[ . 1 . 2]" 1
461 1 14 GLN HE22 1 14 GLN HG2 . . 3.910 3.845 3.733 3.979 0.069 12 0 "[ . 1 . 2]" 1
462 1 14 GLN HE22 1 14 GLN HG3 . . 3.950 3.530 3.464 3.609 . 0 0 "[ . 1 . 2]" 1
463 1 14 GLN HE22 1 38 LEU MD1 . . 4.180 2.626 2.451 2.894 . 0 0 "[ . 1 . 2]" 1
464 1 14 GLN HE22 1 38 LEU MD2 . . 3.660 2.315 2.007 2.710 . 0 0 "[ . 1 . 2]" 1
465 1 14 GLN HG2 1 15 GLY H . . 4.800 4.810 4.615 4.861 0.061 7 0 "[ . 1 . 2]" 1
466 1 14 GLN HG2 1 16 ILE MG . . 4.460 4.540 4.349 4.562 0.102 18 0 "[ . 1 . 2]" 1
467 1 14 GLN HG2 1 38 LEU MD1 . . 5.500 4.205 4.066 4.312 . 0 0 "[ . 1 . 2]" 1
468 1 14 GLN HG3 1 15 GLY H . . 4.820 4.563 4.254 4.871 0.051 12 0 "[ . 1 . 2]" 1
469 1 14 GLN HG3 1 16 ILE MG . . 3.560 3.496 3.168 3.641 0.081 9 0 "[ . 1 . 2]" 1
470 1 14 GLN HG3 1 38 LEU MD1 . . 5.500 3.216 3.080 3.362 . 0 0 "[ . 1 . 2]" 1
471 1 14 GLN HG3 1 38 LEU HG . . 5.500 5.521 5.193 5.571 0.071 6 0 "[ . 1 . 2]" 1
472 1 15 GLY H 1 16 ILE H . . 3.230 2.588 2.254 2.787 . 0 0 "[ . 1 . 2]" 1
473 1 15 GLY QA 1 16 ILE HA . . 4.330 4.056 4.008 4.089 . 0 0 "[ . 1 . 2]" 1
474 1 15 GLY QA 1 31 ARG QD . . 4.560 3.740 2.977 4.422 . 0 0 "[ . 1 . 2]" 1
475 1 15 GLY QA 1 31 ARG QG . . 5.340 3.568 2.878 4.008 . 0 0 "[ . 1 . 2]" 1
476 1 16 ILE H 1 16 ILE HB . . 3.380 3.351 3.180 3.429 0.049 3 0 "[ . 1 . 2]" 1
477 1 16 ILE H 1 16 ILE MD . . 3.970 4.035 3.930 4.051 0.081 3 0 "[ . 1 . 2]" 1
478 1 16 ILE H 1 16 ILE HG12 . . 4.590 4.578 4.506 4.620 0.030 17 0 "[ . 1 . 2]" 1
479 1 16 ILE H 1 16 ILE HG13 . . 5.500 5.023 4.904 5.080 . 0 0 "[ . 1 . 2]" 1
480 1 16 ILE H 1 16 ILE MG . . 3.360 2.289 2.066 2.400 . 0 0 "[ . 1 . 2]" 1
481 1 16 ILE H 1 17 THR H . . 4.520 4.281 4.127 4.423 . 0 0 "[ . 1 . 2]" 1
482 1 16 ILE H 1 34 ILE MD . . 5.310 5.221 4.824 5.378 0.068 13 0 "[ . 1 . 2]" 1
483 1 16 ILE H 1 38 LEU MD1 . . 5.500 5.130 4.872 5.350 . 0 0 "[ . 1 . 2]" 1
484 1 16 ILE HA 1 16 ILE MD . . 3.670 3.490 3.420 3.557 . 0 0 "[ . 1 . 2]" 1
485 1 16 ILE HA 1 16 ILE HG12 . . 3.430 2.468 2.421 2.548 . 0 0 "[ . 1 . 2]" 1
486 1 16 ILE HA 1 16 ILE MG . . 3.590 3.254 3.197 3.280 . 0 0 "[ . 1 . 2]" 1
487 1 16 ILE HA 1 17 THR H . . 3.060 2.156 2.072 2.310 . 0 0 "[ . 1 . 2]" 1
488 1 16 ILE HA 1 17 THR MG . . 5.500 5.390 5.122 5.512 0.012 18 0 "[ . 1 . 2]" 1
489 1 16 ILE HA 1 29 THR HB . . 5.500 2.352 2.213 2.416 . 0 0 "[ . 1 . 2]" 1
490 1 16 ILE HA 1 29 THR MG . . 3.990 4.011 3.897 4.073 0.083 15 0 "[ . 1 . 2]" 1
491 1 16 ILE HB 1 16 ILE MD . . 3.210 3.199 3.152 3.219 0.009 1 0 "[ . 1 . 2]" 1
492 1 16 ILE HB 1 17 THR H . . 4.270 4.048 3.873 4.174 . 0 0 "[ . 1 . 2]" 1
493 1 16 ILE HB 1 18 LEU MD1 . . 5.500 5.589 5.546 5.603 0.103 5 0 "[ . 1 . 2]" 1
494 1 16 ILE HB 1 29 THR HB . . 4.870 2.172 2.072 2.243 . 0 0 "[ . 1 . 2]" 1
495 1 16 ILE HB 1 34 ILE MD . . 3.750 2.753 2.500 2.963 . 0 0 "[ . 1 . 2]" 1
496 1 16 ILE HB 1 38 LEU MD1 . . 4.880 4.418 4.024 4.576 . 0 0 "[ . 1 . 2]" 1
497 1 16 ILE MD 1 16 ILE MG . . 2.690 2.057 1.804 2.117 . 0 0 "[ . 1 . 2]" 1
498 1 16 ILE MD 1 17 THR H . . 3.310 3.163 2.823 3.373 0.063 19 0 "[ . 1 . 2]" 1
499 1 16 ILE MD 1 17 THR HA . . 3.920 3.378 3.192 3.618 . 0 0 "[ . 1 . 2]" 1
500 1 16 ILE MD 1 17 THR MG . . 5.500 4.715 4.530 4.856 . 0 0 "[ . 1 . 2]" 1
501 1 16 ILE MD 1 18 LEU H . . 4.310 4.184 4.007 4.359 0.049 4 0 "[ . 1 . 2]" 1
502 1 16 ILE MD 1 18 LEU HA . . 3.830 3.715 3.479 3.815 . 0 0 "[ . 1 . 2]" 1
503 1 16 ILE MD 1 18 LEU MD1 . . 4.070 2.019 1.872 2.048 . 0 0 "[ . 1 . 2]" 1
504 1 16 ILE MD 1 18 LEU MD2 . . 3.320 2.128 1.996 2.233 . 0 0 "[ . 1 . 2]" 1
505 1 16 ILE MD 1 18 LEU HG . . 5.500 4.091 3.964 4.170 . 0 0 "[ . 1 . 2]" 1
506 1 16 ILE MD 1 27 TYR HA . . 3.970 3.557 3.230 3.930 . 0 0 "[ . 1 . 2]" 1
507 1 16 ILE MD 1 27 TYR HB2 . . 3.260 2.391 2.114 2.733 . 0 0 "[ . 1 . 2]" 1
508 1 16 ILE MD 1 27 TYR HB3 . . 3.410 2.217 2.078 2.405 . 0 0 "[ . 1 . 2]" 1
509 1 16 ILE MD 1 28 GLU H . . 3.710 3.492 3.178 3.740 0.030 8 0 "[ . 1 . 2]" 1
510 1 16 ILE MD 1 29 THR H . . 5.500 5.586 5.521 5.600 0.100 10 0 "[ . 1 . 2]" 1
511 1 16 ILE MD 1 29 THR HB . . 3.930 3.859 3.759 3.973 0.043 5 0 "[ . 1 . 2]" 1
512 1 16 ILE MD 1 29 THR MG . . 4.430 4.339 4.028 4.515 0.085 7 0 "[ . 1 . 2]" 1
513 1 16 ILE MD 1 34 ILE MD . . 3.160 2.943 2.733 3.163 0.003 15 0 "[ . 1 . 2]" 1
514 1 16 ILE MD 1 38 LEU MD1 . . 5.500 3.009 2.845 3.166 . 0 0 "[ . 1 . 2]" 1
515 1 16 ILE HG12 1 16 ILE MG . . 3.140 3.226 3.126 3.236 0.096 19 0 "[ . 1 . 2]" 1
516 1 16 ILE HG12 1 17 THR H . . 4.240 2.577 2.203 2.739 . 0 0 "[ . 1 . 2]" 1
517 1 16 ILE HG12 1 17 THR HA . . 4.720 4.659 4.338 4.774 0.054 12 0 "[ . 1 . 2]" 1
518 1 16 ILE HG12 1 29 THR H . . 5.500 4.383 4.323 4.469 . 0 0 "[ . 1 . 2]" 1
519 1 16 ILE HG12 1 29 THR HB . . 3.970 2.276 2.150 2.418 . 0 0 "[ . 1 . 2]" 1
520 1 16 ILE HG12 1 29 THR MG . . 3.770 3.522 3.314 3.674 . 0 0 "[ . 1 . 2]" 1
521 1 16 ILE HG12 1 34 ILE MD . . 4.040 3.481 3.364 3.617 . 0 0 "[ . 1 . 2]" 1
522 1 16 ILE HG12 1 34 ILE HG12 . . 5.500 5.252 4.961 5.564 0.064 2 0 "[ . 1 . 2]" 1
523 1 16 ILE HG13 1 17 THR H . . 4.930 4.264 3.903 4.417 . 0 0 "[ . 1 . 2]" 1
524 1 16 ILE HG13 1 29 THR HB . . 4.570 2.705 2.623 2.831 . 0 0 "[ . 1 . 2]" 1
525 1 16 ILE HG13 1 31 ARG HD2 . . 5.500 5.191 4.421 5.609 0.109 2 0 "[ . 1 . 2]" 1
526 1 16 ILE HG13 1 31 ARG QD . . 4.690 4.367 3.903 4.774 0.084 13 0 "[ . 1 . 2]" 1
527 1 16 ILE HG13 1 31 ARG HD3 . . 5.500 4.761 4.151 5.551 0.051 9 0 "[ . 1 . 2]" 1
528 1 16 ILE HG13 1 34 ILE MD . . 5.500 2.060 1.987 2.157 . 0 0 "[ . 1 . 2]" 1
529 1 16 ILE MG 1 17 THR H . . 4.480 4.249 4.065 4.353 . 0 0 "[ . 1 . 2]" 1
530 1 16 ILE MG 1 18 LEU MD1 . . 5.500 4.237 4.002 4.335 . 0 0 "[ . 1 . 2]" 1
531 1 16 ILE MG 1 18 LEU MD2 . . 4.320 3.657 3.299 3.862 . 0 0 "[ . 1 . 2]" 1
532 1 16 ILE MG 1 27 TYR HB2 . . 4.990 4.972 4.815 5.069 0.079 8 0 "[ . 1 . 2]" 1
533 1 16 ILE MG 1 27 TYR HB3 . . 5.500 5.254 5.082 5.382 . 0 0 "[ . 1 . 2]" 1
534 1 16 ILE MG 1 29 THR HA . . 5.470 5.130 4.905 5.374 . 0 0 "[ . 1 . 2]" 1
535 1 16 ILE MG 1 29 THR HB . . 3.810 3.802 3.715 3.878 0.068 19 0 "[ . 1 . 2]" 1
536 1 16 ILE MG 1 31 ARG HD2 . . 4.220 3.300 2.778 3.841 . 0 0 "[ . 1 . 2]" 1
537 1 16 ILE MG 1 31 ARG QD . . 3.600 3.111 2.662 3.585 . 0 0 "[ . 1 . 2]" 1
538 1 16 ILE MG 1 31 ARG HD3 . . 4.220 3.852 3.404 4.299 0.079 4 0 "[ . 1 . 2]" 1
539 1 16 ILE MG 1 34 ILE MD . . 2.860 2.265 2.080 2.571 . 0 0 "[ . 1 . 2]" 1
540 1 16 ILE MG 1 35 PRO HD2 . . 4.710 4.493 4.222 4.807 0.097 2 0 "[ . 1 . 2]" 1
541 1 16 ILE MG 1 38 LEU MD1 . . 2.760 2.228 2.052 2.345 . 0 0 "[ . 1 . 2]" 1
542 1 17 THR H 1 17 THR HB . . 3.260 2.575 2.362 2.865 . 0 0 "[ . 1 . 2]" 1
543 1 17 THR H 1 17 THR MG . . 3.930 3.842 3.748 3.910 . 0 0 "[ . 1 . 2]" 1
544 1 17 THR H 1 18 LEU H . . 4.580 4.519 4.428 4.570 . 0 0 "[ . 1 . 2]" 1
545 1 17 THR H 1 27 TYR HA . . 5.350 4.677 4.485 5.008 . 0 0 "[ . 1 . 2]" 1
546 1 17 THR H 1 27 TYR HB2 . . 4.960 4.536 4.210 4.939 . 0 0 "[ . 1 . 2]" 1
547 1 17 THR H 1 27 TYR HB3 . . 5.500 5.201 4.947 5.556 0.056 2 0 "[ . 1 . 2]" 1
548 1 17 THR H 1 28 GLU H . . 3.450 2.870 2.704 3.212 . 0 0 "[ . 1 . 2]" 1
549 1 17 THR H 1 28 GLU HB2 . . 5.500 5.194 4.726 5.473 . 0 0 "[ . 1 . 2]" 1
550 1 17 THR H 1 28 GLU HB3 . . 4.270 3.818 3.497 4.160 . 0 0 "[ . 1 . 2]" 1
551 1 17 THR H 1 28 GLU QG . . 4.800 4.585 4.080 4.870 0.070 7 0 "[ . 1 . 2]" 1
552 1 17 THR H 1 29 THR HA . . 4.160 3.507 3.154 3.784 . 0 0 "[ . 1 . 2]" 1
553 1 17 THR H 1 29 THR HB . . 3.900 3.586 3.381 3.741 . 0 0 "[ . 1 . 2]" 1
554 1 17 THR H 1 29 THR MG . . 4.850 4.887 4.708 4.939 0.089 10 0 "[ . 1 . 2]" 1
555 1 17 THR H 1 34 ILE MD . . 5.500 5.553 5.377 5.591 0.091 7 0 "[ . 1 . 2]" 1
556 1 17 THR HA 1 17 THR MG . . 2.880 2.396 2.185 2.589 . 0 0 "[ . 1 . 2]" 1
557 1 17 THR HA 1 18 LEU H . . 2.910 2.343 2.233 2.412 . 0 0 "[ . 1 . 2]" 1
558 1 17 THR HA 1 18 LEU HB2 . . 4.580 4.603 4.531 4.639 0.059 1 0 "[ . 1 . 2]" 1
559 1 17 THR HA 1 18 LEU HG . . 5.500 5.568 5.549 5.575 0.075 19 0 "[ . 1 . 2]" 1
560 1 17 THR HB 1 18 LEU H . . 3.860 3.719 3.388 3.919 0.059 9 0 "[ . 1 . 2]" 1
561 1 17 THR HB 1 28 GLU H . . 3.640 3.465 3.100 3.685 0.045 5 0 "[ . 1 . 2]" 1
562 1 17 THR HB 1 28 GLU HB2 . . 5.500 4.469 3.898 5.017 . 0 0 "[ . 1 . 2]" 1
563 1 17 THR HB 1 28 GLU HB3 . . 3.430 2.837 2.304 3.340 . 0 0 "[ . 1 . 2]" 1
564 1 17 THR HB 1 28 GLU QG . . 4.450 4.179 3.125 4.511 0.061 5 0 "[ . 1 . 2]" 1
565 1 17 THR MG 1 18 LEU H . . 3.390 2.170 1.985 2.367 . 0 0 "[ . 1 . 2]" 1
566 1 17 THR MG 1 18 LEU HA . . 5.500 4.007 3.778 4.351 . 0 0 "[ . 1 . 2]" 1
567 1 17 THR MG 1 19 PHE H . . 5.500 4.611 4.323 4.883 . 0 0 "[ . 1 . 2]" 1
568 1 17 THR MG 1 19 PHE HA . . 5.500 4.557 4.258 4.941 . 0 0 "[ . 1 . 2]" 1
569 1 17 THR MG 1 19 PHE QB . . 4.410 4.324 3.403 4.503 0.093 16 0 "[ . 1 . 2]" 1
570 1 17 THR MG 1 27 TYR HA . . 5.500 4.900 4.621 5.144 . 0 0 "[ . 1 . 2]" 1
571 1 17 THR MG 1 28 GLU H . . 4.490 4.402 4.103 4.563 0.073 10 0 "[ . 1 . 2]" 1
572 1 17 THR MG 1 28 GLU HB2 . . 5.500 5.141 4.802 5.523 0.023 2 0 "[ . 1 . 2]" 1
573 1 17 THR MG 1 28 GLU HB3 . . 4.280 3.979 3.652 4.337 0.057 5 0 "[ . 1 . 2]" 1
574 1 17 THR MG 1 28 GLU QG . . 5.500 5.033 4.027 5.452 . 0 0 "[ . 1 . 2]" 1
575 1 18 LEU H 1 18 LEU HB2 . . 3.410 2.665 2.479 2.748 . 0 0 "[ . 1 . 2]" 1
576 1 18 LEU H 1 18 LEU HB3 . . 4.100 3.726 3.680 3.774 . 0 0 "[ . 1 . 2]" 1
577 1 18 LEU H 1 18 LEU MD1 . . 3.910 3.697 3.546 3.789 . 0 0 "[ . 1 . 2]" 1
578 1 18 LEU H 1 18 LEU MD2 . . 3.820 2.599 2.094 2.748 . 0 0 "[ . 1 . 2]" 1
579 1 18 LEU H 1 18 LEU HG . . 4.480 4.388 4.257 4.471 . 0 0 "[ . 1 . 2]" 1
580 1 18 LEU H 1 19 PHE H . . 4.510 4.370 4.208 4.469 . 0 0 "[ . 1 . 2]" 1
581 1 18 LEU H 1 53 LEU MD1 . . 4.900 4.498 4.211 4.866 . 0 0 "[ . 1 . 2]" 1
582 1 18 LEU H 1 53 LEU QD . . 4.220 3.876 3.646 4.014 . 0 0 "[ . 1 . 2]" 1
583 1 18 LEU H 1 53 LEU MD2 . . 4.900 4.284 3.766 4.658 . 0 0 "[ . 1 . 2]" 1
584 1 18 LEU HA 1 18 LEU MD2 . . 3.160 3.205 3.131 3.238 0.078 13 0 "[ . 1 . 2]" 1
585 1 18 LEU HA 1 19 PHE H . . 2.860 2.168 2.120 2.206 . 0 0 "[ . 1 . 2]" 1
586 1 18 LEU HA 1 27 TYR HA . . 5.460 2.233 2.089 2.401 . 0 0 "[ . 1 . 2]" 1
587 1 18 LEU HA 1 27 TYR HB2 . . 4.520 4.336 4.066 4.579 0.059 1 0 "[ . 1 . 2]" 1
588 1 18 LEU HA 1 27 TYR HB3 . . 4.100 3.258 2.906 3.463 . 0 0 "[ . 1 . 2]" 1
589 1 18 LEU HA 1 53 LEU QD . . 4.600 3.491 3.456 3.568 . 0 0 "[ . 1 . 2]" 1
590 1 18 LEU HB2 1 18 LEU MD1 . . 3.420 3.253 3.187 3.281 . 0 0 "[ . 1 . 2]" 1
591 1 18 LEU HB2 1 19 PHE H . . 4.380 4.231 4.141 4.284 . 0 0 "[ . 1 . 2]" 1
592 1 18 LEU HB2 1 25 LEU MD2 . . 4.820 3.932 3.639 4.266 . 0 0 "[ . 1 . 2]" 1
593 1 18 LEU HB2 1 49 LEU HG . . 5.460 5.547 5.519 5.752 0.292 2 0 "[ . 1 . 2]" 1
594 1 18 LEU HB2 1 53 LEU MD1 . . 3.740 2.921 2.713 3.176 . 0 0 "[ . 1 . 2]" 1
595 1 18 LEU HB2 1 53 LEU QD . . 3.280 2.443 2.238 2.562 . 0 0 "[ . 1 . 2]" 1
596 1 18 LEU HB2 1 53 LEU MD2 . . 3.740 2.654 2.290 2.881 . 0 0 "[ . 1 . 2]" 1
597 1 18 LEU HB3 1 18 LEU MD1 . . 3.570 2.446 2.387 2.550 . 0 0 "[ . 1 . 2]" 1
598 1 18 LEU HB3 1 19 PHE H . . 3.350 3.194 3.037 3.342 . 0 0 "[ . 1 . 2]" 1
599 1 18 LEU HB3 1 25 LEU MD2 . . 4.110 2.591 2.292 2.967 . 0 0 "[ . 1 . 2]" 1
600 1 18 LEU HB3 1 27 TYR HB3 . . 5.500 4.767 4.600 4.920 . 0 0 "[ . 1 . 2]" 1
601 1 18 LEU HB3 1 53 LEU QD . . 3.820 2.052 1.987 2.125 . 0 0 "[ . 1 . 2]" 1
602 1 18 LEU MD1 1 19 PHE H . . 3.660 3.577 3.434 3.734 0.074 20 0 "[ . 1 . 2]" 1
603 1 18 LEU MD1 1 26 GLN H . . 4.810 4.404 4.247 4.633 . 0 0 "[ . 1 . 2]" 1
604 1 18 LEU MD1 1 28 GLU H . . 4.120 3.815 3.553 4.086 . 0 0 "[ . 1 . 2]" 1
605 1 18 LEU MD1 1 49 LEU HB2 . . 5.500 5.542 5.440 5.589 0.089 13 0 "[ . 1 . 2]" 1
606 1 18 LEU MD1 1 49 LEU HB3 . . 5.110 4.923 4.779 5.064 . 0 0 "[ . 1 . 2]" 1
607 1 18 LEU MD1 1 53 LEU QD . . 3.970 3.563 3.496 3.684 . 0 0 "[ . 1 . 2]" 1
608 1 18 LEU MD2 1 19 PHE H . . 4.900 4.940 4.817 4.966 0.066 14 0 "[ . 1 . 2]" 1
609 1 18 LEU MD2 1 27 TYR HA . . 5.500 4.425 4.233 4.630 . 0 0 "[ . 1 . 2]" 1
610 1 18 LEU MD2 1 27 TYR HB3 . . 4.030 3.988 3.923 4.041 0.011 9 0 "[ . 1 . 2]" 1
611 1 18 LEU MD2 1 42 TRP HB2 . . 5.500 5.224 4.395 5.561 0.061 7 0 "[ . 1 . 2]" 1
612 1 18 LEU MD2 1 53 LEU QD . . 4.450 3.778 3.643 3.851 . 0 0 "[ . 1 . 2]" 1
613 1 18 LEU HG 1 25 LEU MD1 . . 5.500 3.935 3.590 4.321 . 0 0 "[ . 1 . 2]" 1
614 1 18 LEU HG 1 27 TYR HB3 . . 5.500 4.796 4.642 4.911 . 0 0 "[ . 1 . 2]" 1
615 1 18 LEU HG 1 42 TRP HB2 . . 5.500 5.146 4.245 5.571 0.071 4 0 "[ . 1 . 2]" 1
616 1 19 PHE H 1 19 PHE QB . . 3.440 2.674 2.519 2.830 . 0 0 "[ . 1 . 2]" 1
617 1 19 PHE H 1 20 VAL H . . 4.450 4.473 4.404 4.508 0.058 11 0 "[ . 1 . 2]" 1
618 1 19 PHE H 1 25 LEU MD1 . . 4.620 4.249 3.847 4.659 0.039 13 0 "[ . 1 . 2]" 1
619 1 19 PHE H 1 25 LEU MD2 . . 4.120 3.536 3.294 4.180 0.060 20 0 "[ . 1 . 2]" 1
620 1 19 PHE H 1 26 GLN H . . 3.760 3.204 3.055 3.463 . 0 0 "[ . 1 . 2]" 1
621 1 19 PHE H 1 26 GLN HB2 . . 4.500 3.889 3.669 4.071 . 0 0 "[ . 1 . 2]" 1
622 1 19 PHE H 1 26 GLN HB3 . . 4.700 4.160 3.758 4.360 . 0 0 "[ . 1 . 2]" 1
623 1 19 PHE H 1 27 TYR HA . . 3.680 2.886 2.634 3.099 . 0 0 "[ . 1 . 2]" 1
624 1 19 PHE H 1 27 TYR HB3 . . 4.610 4.563 4.250 4.680 0.070 17 0 "[ . 1 . 2]" 1
625 1 19 PHE H 1 28 GLU H . . 4.570 4.611 4.252 4.647 0.077 9 0 "[ . 1 . 2]" 1
626 1 19 PHE H 1 53 LEU MD1 . . 4.940 2.915 2.767 3.001 . 0 0 "[ . 1 . 2]" 1
627 1 19 PHE H 1 53 LEU QD . . 3.530 2.876 2.746 2.969 . 0 0 "[ . 1 . 2]" 1
628 1 19 PHE H 1 53 LEU MD2 . . 4.940 4.536 3.686 4.967 0.027 9 0 "[ . 1 . 2]" 1
629 1 19 PHE HA 1 20 VAL H . . 3.080 2.501 2.397 2.630 . 0 0 "[ . 1 . 2]" 1
630 1 19 PHE HA 1 53 LEU HB2 . . 5.150 4.569 4.299 4.819 . 0 0 "[ . 1 . 2]" 1
631 1 19 PHE HA 1 53 LEU HB3 . . 4.410 2.940 2.637 3.219 . 0 0 "[ . 1 . 2]" 1
632 1 19 PHE HA 1 53 LEU MD1 . . 4.000 2.411 2.128 2.763 . 0 0 "[ . 1 . 2]" 1
633 1 19 PHE HA 1 53 LEU QD . . 3.400 2.319 2.117 2.487 . 0 0 "[ . 1 . 2]" 1
634 1 19 PHE HA 1 53 LEU MD2 . . 4.000 3.377 2.466 3.963 . 0 0 "[ . 1 . 2]" 1
635 1 19 PHE QB 1 20 VAL H . . 2.930 2.364 2.133 2.913 . 0 0 "[ . 1 . 2]" 1
636 1 19 PHE QB 1 21 ALA H . . 5.340 5.217 5.046 5.391 0.051 12 0 "[ . 1 . 2]" 1
637 1 19 PHE QB 1 27 TYR HA . . 5.340 4.160 3.724 4.680 . 0 0 "[ . 1 . 2]" 1
638 1 19 PHE QB 1 53 LEU QD . . 4.220 3.800 3.614 3.903 . 0 0 "[ . 1 . 2]" 1
639 1 20 VAL H 1 20 VAL HB . . 3.210 2.531 2.391 2.661 . 0 0 "[ . 1 . 2]" 1
640 1 20 VAL H 1 20 VAL MG1 . . 3.770 3.614 3.454 3.738 . 0 0 "[ . 1 . 2]" 1
641 1 20 VAL H 1 20 VAL MG2 . . 3.520 3.384 3.320 3.464 . 0 0 "[ . 1 . 2]" 1
642 1 20 VAL H 1 21 ALA H . . 4.540 4.393 4.269 4.511 . 0 0 "[ . 1 . 2]" 1
643 1 20 VAL H 1 21 ALA MB . . 5.500 4.576 4.439 4.704 . 0 0 "[ . 1 . 2]" 1
644 1 20 VAL H 1 53 LEU HB2 . . 4.590 4.467 4.217 4.642 0.052 9 0 "[ . 1 . 2]" 1
645 1 20 VAL H 1 53 LEU HB3 . . 4.090 3.203 2.868 3.483 . 0 0 "[ . 1 . 2]" 1
646 1 20 VAL H 1 53 LEU MD1 . . 5.500 3.603 3.087 3.843 . 0 0 "[ . 1 . 2]" 1
647 1 20 VAL H 1 53 LEU QD . . 4.040 3.508 3.047 3.755 . 0 0 "[ . 1 . 2]" 1
648 1 20 VAL H 1 53 LEU MD2 . . 5.500 4.915 4.097 5.457 . 0 0 "[ . 1 . 2]" 1
649 1 20 VAL H 1 54 GLN HA . . 5.120 5.112 4.979 5.202 0.082 2 0 "[ . 1 . 2]" 1
650 1 20 VAL HA 1 20 VAL MG1 . . 3.240 2.798 2.728 2.900 . 0 0 "[ . 1 . 2]" 1
651 1 20 VAL HA 1 20 VAL MG2 . . 3.190 2.180 2.144 2.218 . 0 0 "[ . 1 . 2]" 1
652 1 20 VAL HA 1 21 ALA H . . 2.850 2.132 2.025 2.242 . 0 0 "[ . 1 . 2]" 1
653 1 20 VAL HA 1 21 ALA MB . . 4.050 3.905 3.829 3.981 . 0 0 "[ . 1 . 2]" 1
654 1 20 VAL HA 1 24 ARG H . . 4.380 4.357 4.228 4.440 0.060 14 0 "[ . 1 . 2]" 1
655 1 20 VAL HA 1 25 LEU HA . . 5.460 3.378 3.007 3.594 . 0 0 "[ . 1 . 2]" 1
656 1 20 VAL HA 1 26 GLN H . . 3.710 3.328 3.083 3.490 . 0 0 "[ . 1 . 2]" 1
657 1 20 VAL HA 1 26 GLN HE21 . . 5.010 2.643 2.315 3.003 . 0 0 "[ . 1 . 2]" 1
658 1 20 VAL HA 1 26 GLN HE22 . . 4.770 3.501 3.121 3.901 . 0 0 "[ . 1 . 2]" 1
659 1 20 VAL HA 1 53 LEU HB2 . . 5.420 4.691 4.440 4.833 . 0 0 "[ . 1 . 2]" 1
660 1 20 VAL HB 1 50 ILE HA . . 4.220 4.271 4.147 4.290 0.070 11 0 "[ . 1 . 2]" 1
661 1 20 VAL HB 1 50 ILE MG . . 4.230 4.119 4.023 4.231 0.001 4 0 "[ . 1 . 2]" 1
662 1 20 VAL HB 1 53 LEU H . . 5.500 5.325 5.159 5.478 . 0 0 "[ . 1 . 2]" 1
663 1 20 VAL HB 1 53 LEU HB3 . . 3.570 2.667 2.457 2.890 . 0 0 "[ . 1 . 2]" 1
664 1 20 VAL HB 1 53 LEU MD1 . . 5.190 3.690 3.314 3.846 . 0 0 "[ . 1 . 2]" 1
665 1 20 VAL HB 1 53 LEU QD . . 4.020 3.591 3.256 3.748 . 0 0 "[ . 1 . 2]" 1
666 1 20 VAL HB 1 53 LEU MD2 . . 5.190 4.948 4.496 5.256 0.066 9 0 "[ . 1 . 2]" 1
667 1 20 VAL HB 1 54 GLN HA . . 3.770 3.184 3.035 3.404 . 0 0 "[ . 1 . 2]" 1
668 1 20 VAL HB 1 54 GLN HB2 . . 5.500 5.563 5.458 5.644 0.144 2 0 "[ . 1 . 2]" 1
669 1 20 VAL MG1 1 21 ALA H . . 3.110 2.539 2.301 2.725 . 0 0 "[ . 1 . 2]" 1
670 1 20 VAL MG1 1 21 ALA HA . . 3.730 3.229 2.931 3.367 . 0 0 "[ . 1 . 2]" 1
671 1 20 VAL MG1 1 21 ALA MB . . 4.050 4.022 3.769 4.120 0.070 6 0 "[ . 1 . 2]" 1
672 1 20 VAL MG1 1 22 ASP H . . 5.210 4.503 4.065 4.743 . 0 0 "[ . 1 . 2]" 1
673 1 20 VAL MG1 1 23 ASN H . . 3.350 3.199 2.970 3.350 . 0 0 "[ . 1 . 2]" 1
674 1 20 VAL MG1 1 23 ASN HA . . 3.240 2.921 2.577 3.279 0.039 2 0 "[ . 1 . 2]" 1
675 1 20 VAL MG1 1 23 ASN HB2 . . 5.250 4.939 4.622 5.173 . 0 0 "[ . 1 . 2]" 1
676 1 20 VAL MG1 1 23 ASN HB3 . . 5.500 5.430 5.106 5.664 0.164 2 0 "[ . 1 . 2]" 1
677 1 20 VAL MG1 1 24 ARG H . . 3.240 3.269 3.025 3.320 0.080 11 0 "[ . 1 . 2]" 1
678 1 20 VAL MG1 1 25 LEU HA . . 5.500 4.723 4.552 4.947 . 0 0 "[ . 1 . 2]" 1
679 1 20 VAL MG1 1 26 GLN H . . 5.480 5.443 5.239 5.561 0.081 19 0 "[ . 1 . 2]" 1
680 1 20 VAL MG1 1 26 GLN HE22 . . 4.970 4.255 3.937 4.643 . 0 0 "[ . 1 . 2]" 1
681 1 20 VAL MG1 1 50 ILE HA . . 4.330 4.284 4.084 4.405 0.075 20 0 "[ . 1 . 2]" 1
682 1 20 VAL MG1 1 53 LEU QD . . 4.570 4.290 4.097 4.409 . 0 0 "[ . 1 . 2]" 1
683 1 20 VAL MG1 1 54 GLN H . . 4.320 3.974 3.767 4.097 . 0 0 "[ . 1 . 2]" 1
684 1 20 VAL MG1 1 54 GLN HA . . 3.700 3.015 2.756 3.256 . 0 0 "[ . 1 . 2]" 1
685 1 20 VAL MG1 1 54 GLN HB3 . . 5.500 3.935 3.622 4.202 . 0 0 "[ . 1 . 2]" 1
686 1 20 VAL MG1 1 54 GLN HE21 . . 3.380 2.186 1.773 2.589 . 0 0 "[ . 1 . 2]" 1
687 1 20 VAL MG1 1 54 GLN HE22 . . 3.500 3.072 2.754 3.300 . 0 0 "[ . 1 . 2]" 1
688 1 20 VAL MG1 1 54 GLN HG2 . . 3.890 2.359 2.206 2.529 . 0 0 "[ . 1 . 2]" 1
689 1 20 VAL MG1 1 54 GLN HG3 . . 4.030 3.850 3.739 3.953 . 0 0 "[ . 1 . 2]" 1
690 1 20 VAL MG2 1 21 ALA H . . 3.630 3.275 3.203 3.358 . 0 0 "[ . 1 . 2]" 1
691 1 20 VAL MG2 1 21 ALA HA . . 5.500 5.179 5.047 5.265 . 0 0 "[ . 1 . 2]" 1
692 1 20 VAL MG2 1 23 ASN H . . 5.090 4.973 4.744 5.170 0.080 17 0 "[ . 1 . 2]" 1
693 1 20 VAL MG2 1 24 ARG H . . 4.040 3.887 3.676 4.106 0.066 11 0 "[ . 1 . 2]" 1
694 1 20 VAL MG2 1 24 ARG HA . . 5.500 4.160 3.877 4.385 . 0 0 "[ . 1 . 2]" 1
695 1 20 VAL MG2 1 25 LEU HA . . 3.410 2.723 2.569 2.873 . 0 0 "[ . 1 . 2]" 1
696 1 20 VAL MG2 1 25 LEU MD2 . . 3.120 3.070 2.843 3.208 0.088 15 0 "[ . 1 . 2]" 1
697 1 20 VAL MG2 1 26 GLN H . . 4.240 3.611 3.450 3.819 . 0 0 "[ . 1 . 2]" 1
698 1 20 VAL MG2 1 50 ILE H . . 4.430 4.159 4.029 4.254 . 0 0 "[ . 1 . 2]" 1
699 1 20 VAL MG2 1 50 ILE HA . . 3.110 2.160 1.973 2.245 . 0 0 "[ . 1 . 2]" 1
700 1 20 VAL MG2 1 50 ILE HB . . 4.030 3.936 3.723 4.007 . 0 0 "[ . 1 . 2]" 1
701 1 20 VAL MG2 1 53 LEU H . . 5.500 4.052 3.888 4.138 . 0 0 "[ . 1 . 2]" 1
702 1 20 VAL MG2 1 53 LEU HA . . 5.500 4.450 4.300 4.519 . 0 0 "[ . 1 . 2]" 1
703 1 20 VAL MG2 1 53 LEU HB2 . . 3.110 2.051 1.894 2.106 . 0 0 "[ . 1 . 2]" 1
704 1 20 VAL MG2 1 53 LEU HB3 . . 3.520 2.616 2.456 2.727 . 0 0 "[ . 1 . 2]" 1
705 1 20 VAL MG2 1 53 LEU QD . . 3.170 2.031 1.885 2.142 . 0 0 "[ . 1 . 2]" 1
706 1 20 VAL MG2 1 54 GLN H . . 3.920 3.286 3.148 3.371 . 0 0 "[ . 1 . 2]" 1
707 1 20 VAL MG2 1 54 GLN HA . . 3.940 3.887 3.684 4.007 0.067 16 0 "[ . 1 . 2]" 1
708 1 20 VAL MG2 1 54 GLN HB2 . . 4.970 4.948 4.747 5.056 0.086 13 0 "[ . 1 . 2]" 1
709 1 20 VAL MG2 1 54 GLN HE22 . . 5.500 4.308 3.970 4.628 . 0 0 "[ . 1 . 2]" 1
710 1 20 VAL MG2 1 54 GLN HG2 . . 3.800 2.549 2.327 2.752 . 0 0 "[ . 1 . 2]" 1
711 1 20 VAL MG2 1 54 GLN HG3 . . 5.500 3.822 3.487 4.066 . 0 0 "[ . 1 . 2]" 1
712 1 21 ALA H 1 21 ALA MB . . 3.190 2.756 2.672 2.837 . 0 0 "[ . 1 . 2]" 1
713 1 21 ALA H 1 22 ASP H . . 5.270 4.164 4.063 4.282 . 0 0 "[ . 1 . 2]" 1
714 1 21 ALA H 1 23 ASN H . . 4.450 3.827 3.578 4.045 . 0 0 "[ . 1 . 2]" 1
715 1 21 ALA H 1 23 ASN HA . . 4.970 4.633 4.334 4.831 . 0 0 "[ . 1 . 2]" 1
716 1 21 ALA H 1 24 ARG H . . 3.360 2.930 2.723 3.112 . 0 0 "[ . 1 . 2]" 1
717 1 21 ALA H 1 24 ARG QD . . 5.340 5.240 4.894 5.425 0.085 10 0 "[ . 1 . 2]" 1
718 1 21 ALA H 1 24 ARG QG . . 4.820 3.493 3.207 3.643 . 0 0 "[ . 1 . 2]" 1
719 1 21 ALA H 1 25 LEU HA . . 4.680 4.638 4.226 4.749 0.069 13 0 "[ . 1 . 2]" 1
720 1 21 ALA H 1 26 GLN H . . 5.500 4.752 4.439 5.010 . 0 0 "[ . 1 . 2]" 1
721 1 21 ALA H 1 26 GLN HB2 . . 4.900 3.954 3.529 4.169 . 0 0 "[ . 1 . 2]" 1
722 1 21 ALA H 1 26 GLN HE21 . . 4.070 2.500 2.322 2.726 . 0 0 "[ . 1 . 2]" 1
723 1 21 ALA H 1 26 GLN HE22 . . 3.720 2.114 1.769 2.525 . 0 0 "[ . 1 . 2]" 1
724 1 21 ALA H 1 26 GLN HG2 . . 5.500 5.530 5.244 5.577 0.077 13 0 "[ . 1 . 2]" 1
725 1 21 ALA H 1 26 GLN HG3 . . 5.500 5.410 4.957 5.569 0.069 20 0 "[ . 1 . 2]" 1
726 1 21 ALA HA 1 22 ASP HA . . 5.500 4.486 4.370 4.607 . 0 0 "[ . 1 . 2]" 1
727 1 21 ALA HA 1 22 ASP HB2 . . 4.390 4.463 4.450 4.477 0.087 2 0 "[ . 1 . 2]" 1
728 1 21 ALA HA 1 22 ASP HB3 . . 5.440 5.229 4.947 5.498 0.058 1 0 "[ . 1 . 2]" 1
729 1 21 ALA HA 1 23 ASN H . . 3.870 3.517 3.427 3.613 . 0 0 "[ . 1 . 2]" 1
730 1 21 ALA HA 1 26 GLN HE21 . . 5.240 4.980 4.715 5.127 . 0 0 "[ . 1 . 2]" 1
731 1 21 ALA HA 1 26 GLN HE22 . . 4.560 4.064 3.598 4.438 . 0 0 "[ . 1 . 2]" 1
732 1 21 ALA MB 1 22 ASP H . . 3.660 2.744 2.644 3.001 . 0 0 "[ . 1 . 2]" 1
733 1 21 ALA MB 1 22 ASP HA . . 4.880 4.389 4.311 4.495 . 0 0 "[ . 1 . 2]" 1
734 1 21 ALA MB 1 22 ASP HB2 . . 3.890 3.162 3.005 3.297 . 0 0 "[ . 1 . 2]" 1
735 1 21 ALA MB 1 22 ASP HB3 . . 4.350 4.109 3.887 4.389 0.039 10 0 "[ . 1 . 2]" 1
736 1 21 ALA MB 1 23 ASN H . . 4.700 4.477 4.383 4.592 . 0 0 "[ . 1 . 2]" 1
737 1 21 ALA MB 1 24 ARG H . . 4.490 4.468 4.371 4.529 0.039 19 0 "[ . 1 . 2]" 1
738 1 21 ALA MB 1 26 GLN HB2 . . 4.450 3.537 3.142 3.930 . 0 0 "[ . 1 . 2]" 1
739 1 21 ALA MB 1 26 GLN HE21 . . 3.180 3.169 2.848 3.270 0.090 13 0 "[ . 1 . 2]" 1
740 1 21 ALA MB 1 26 GLN HE22 . . 3.310 2.472 2.175 2.759 . 0 0 "[ . 1 . 2]" 1
741 1 22 ASP H 1 22 ASP HB3 . . 4.060 3.813 3.677 3.969 . 0 0 "[ . 1 . 2]" 1
742 1 22 ASP H 1 23 ASN H . . 4.220 2.854 2.605 2.938 . 0 0 "[ . 1 . 2]" 1
743 1 22 ASP H 1 23 ASN HA . . 4.990 5.046 4.872 5.070 0.080 12 0 "[ . 1 . 2]" 1
744 1 22 ASP H 1 24 ARG H . . 5.460 4.434 4.287 4.580 . 0 0 "[ . 1 . 2]" 1
745 1 22 ASP HA 1 22 ASP HB2 . . 2.900 2.718 2.587 2.861 . 0 0 "[ . 1 . 2]" 1
746 1 22 ASP HA 1 23 ASN H . . 3.300 2.965 2.864 3.083 . 0 0 "[ . 1 . 2]" 1
747 1 22 ASP HA 1 23 ASN HA . . 5.500 4.899 4.772 4.992 . 0 0 "[ . 1 . 2]" 1
748 1 22 ASP HA 1 23 ASN HB2 . . 4.360 4.292 4.079 4.413 0.053 5 0 "[ . 1 . 2]" 1
749 1 22 ASP HA 1 23 ASN HB3 . . 4.660 4.556 4.315 4.728 0.068 7 0 "[ . 1 . 2]" 1
750 1 22 ASP HA 1 24 ARG H . . 5.130 4.443 4.307 4.680 . 0 0 "[ . 1 . 2]" 1
751 1 22 ASP HB2 1 23 ASN H . . 4.610 4.428 4.317 4.509 . 0 0 "[ . 1 . 2]" 1
752 1 22 ASP HB2 1 24 ARG H . . 5.100 4.450 4.200 4.900 . 0 0 "[ . 1 . 2]" 1
753 1 22 ASP HB2 1 24 ARG QB . . 4.810 4.885 4.855 4.895 0.085 9 0 "[ . 1 . 2]" 1
754 1 22 ASP HB2 1 24 ARG QD . . 4.460 3.663 3.105 4.526 0.066 8 0 "[ . 1 . 2]" 1
755 1 22 ASP HB2 1 24 ARG QG . . 4.330 3.656 3.251 4.272 . 0 0 "[ . 1 . 2]" 1
756 1 22 ASP HB3 1 23 ASN H . . 4.200 4.166 4.067 4.260 0.060 10 0 "[ . 1 . 2]" 1
757 1 22 ASP HB3 1 24 ARG H . . 4.400 3.466 3.138 3.937 . 0 0 "[ . 1 . 2]" 1
758 1 22 ASP HB3 1 24 ARG QB . . 5.340 3.366 3.265 3.639 . 0 0 "[ . 1 . 2]" 1
759 1 22 ASP HB3 1 24 ARG HD2 . . 4.630 3.093 2.268 4.425 . 0 0 "[ . 1 . 2]" 1
760 1 22 ASP HB3 1 24 ARG QD . . 3.830 2.537 2.208 3.567 . 0 0 "[ . 1 . 2]" 1
761 1 22 ASP HB3 1 24 ARG HD3 . . 4.630 3.027 2.280 4.481 . 0 0 "[ . 1 . 2]" 1
762 1 22 ASP HB3 1 26 GLN HE22 . . 4.880 3.682 3.170 4.291 . 0 0 "[ . 1 . 2]" 1
763 1 23 ASN H 1 23 ASN HA . . 2.610 2.208 2.155 2.274 . 0 0 "[ . 1 . 2]" 1
764 1 23 ASN H 1 23 ASN HB2 . . 3.450 3.021 2.914 3.135 . 0 0 "[ . 1 . 2]" 1
765 1 23 ASN H 1 23 ASN HB3 . . 3.780 3.660 3.507 3.768 . 0 0 "[ . 1 . 2]" 1
766 1 23 ASN H 1 23 ASN HD21 . . 4.880 4.072 3.514 4.380 . 0 0 "[ . 1 . 2]" 1
767 1 23 ASN H 1 24 ARG H . . 3.270 2.785 2.626 2.839 . 0 0 "[ . 1 . 2]" 1
768 1 23 ASN H 1 24 ARG QB . . 5.200 4.904 4.681 5.014 . 0 0 "[ . 1 . 2]" 1
769 1 23 ASN H 1 24 ARG QG . . 4.900 4.623 4.333 4.847 . 0 0 "[ . 1 . 2]" 1
770 1 23 ASN H 1 54 GLN HE21 . . 5.150 5.138 4.857 5.215 0.065 5 0 "[ . 1 . 2]" 1
771 1 23 ASN H 1 54 GLN HE22 . . 4.840 4.762 4.288 4.912 0.072 20 0 "[ . 1 . 2]" 1
772 1 23 ASN HA 1 23 ASN HD21 . . 4.410 2.476 2.175 2.813 . 0 0 "[ . 1 . 2]" 1
773 1 23 ASN HA 1 24 ARG H . . 3.230 3.012 2.821 3.167 . 0 0 "[ . 1 . 2]" 1
774 1 23 ASN HA 1 24 ARG HA . . 5.500 4.516 4.379 4.611 . 0 0 "[ . 1 . 2]" 1
775 1 23 ASN HA 1 50 ILE MG . . 4.030 4.062 3.944 4.115 0.085 19 0 "[ . 1 . 2]" 1
776 1 23 ASN HA 1 54 GLN HE21 . . 4.420 3.430 3.118 3.671 . 0 0 "[ . 1 . 2]" 1
777 1 23 ASN HA 1 54 GLN HE22 . . 3.840 3.012 2.619 3.360 . 0 0 "[ . 1 . 2]" 1
778 1 23 ASN HB2 1 23 ASN HD21 . . 3.340 2.467 2.275 2.612 . 0 0 "[ . 1 . 2]" 1
779 1 23 ASN HB2 1 23 ASN HD22 . . 3.570 3.576 3.384 3.629 0.059 15 0 "[ . 1 . 2]" 1
780 1 23 ASN HB2 1 24 ARG H . . 4.820 4.578 4.480 4.675 . 0 0 "[ . 1 . 2]" 1
781 1 23 ASN HB3 1 24 ARG H . . 4.280 4.106 3.906 4.242 . 0 0 "[ . 1 . 2]" 1
782 1 23 ASN HD21 1 24 ARG H . . 5.500 5.423 5.160 5.570 0.070 4 0 "[ . 1 . 2]" 1
783 1 24 ARG H 1 24 ARG QB . . 2.920 2.793 2.614 2.963 0.043 19 0 "[ . 1 . 2]" 1
784 1 24 ARG H 1 24 ARG HD2 . . 5.500 4.529 4.005 5.200 . 0 0 "[ . 1 . 2]" 1
785 1 24 ARG H 1 24 ARG HD3 . . 5.500 4.618 3.940 5.326 . 0 0 "[ . 1 . 2]" 1
786 1 24 ARG H 1 24 ARG QG . . 3.150 2.481 2.207 2.780 . 0 0 "[ . 1 . 2]" 1
787 1 24 ARG H 1 25 LEU H . . 4.560 4.486 4.406 4.593 0.033 4 0 "[ . 1 . 2]" 1
788 1 24 ARG H 1 25 LEU HA . . 5.500 5.122 4.854 5.338 . 0 0 "[ . 1 . 2]" 1
789 1 24 ARG H 1 26 GLN HE21 . . 4.660 4.032 3.640 4.217 . 0 0 "[ . 1 . 2]" 1
790 1 24 ARG H 1 26 GLN HE22 . . 4.460 3.050 2.816 3.336 . 0 0 "[ . 1 . 2]" 1
791 1 24 ARG HA 1 24 ARG QB . . 2.580 2.173 2.131 2.199 . 0 0 "[ . 1 . 2]" 1
792 1 24 ARG HA 1 24 ARG QD . . 4.540 4.466 4.252 4.589 0.049 11 0 "[ . 1 . 2]" 1
793 1 24 ARG HA 1 24 ARG QG . . 3.400 3.339 3.258 3.394 . 0 0 "[ . 1 . 2]" 1
794 1 24 ARG HA 1 25 LEU H . . 2.740 2.406 2.279 2.542 . 0 0 "[ . 1 . 2]" 1
795 1 24 ARG HA 1 25 LEU HB2 . . 4.490 4.387 4.261 4.457 . 0 0 "[ . 1 . 2]" 1
796 1 24 ARG HA 1 25 LEU HB3 . . 5.070 4.804 4.621 4.979 . 0 0 "[ . 1 . 2]" 1
797 1 24 ARG HA 1 26 GLN HE21 . . 5.500 5.178 4.813 5.375 . 0 0 "[ . 1 . 2]" 1
798 1 24 ARG HA 1 50 ILE MD . . 3.680 2.706 2.438 2.947 . 0 0 "[ . 1 . 2]" 1
799 1 24 ARG QB 1 24 ARG QD . . 2.700 2.253 2.072 2.441 . 0 0 "[ . 1 . 2]" 1
800 1 24 ARG QB 1 26 GLN HE21 . . 5.020 4.663 4.330 4.864 . 0 0 "[ . 1 . 2]" 1
801 1 24 ARG QB 1 26 GLN HE22 . . 4.480 4.067 3.853 4.367 . 0 0 "[ . 1 . 2]" 1
802 1 24 ARG QD 1 25 LEU H . . 5.340 4.721 4.079 5.064 . 0 0 "[ . 1 . 2]" 1
803 1 24 ARG HD2 1 26 GLN HE21 . . 5.500 5.412 4.604 5.569 0.069 6 0 "[ . 1 . 2]" 1
804 1 24 ARG HD2 1 26 GLN HE22 . . 5.500 4.427 3.610 5.105 . 0 0 "[ . 1 . 2]" 1
805 1 24 ARG HD3 1 26 GLN HE21 . . 5.500 4.851 4.120 5.547 0.047 8 0 "[ . 1 . 2]" 1
806 1 24 ARG HD3 1 26 GLN HE22 . . 5.500 3.846 3.108 4.800 . 0 0 "[ . 1 . 2]" 1
807 1 24 ARG QG 1 25 LEU H . . 4.630 3.078 2.827 3.379 . 0 0 "[ . 1 . 2]" 1
808 1 24 ARG QG 1 25 LEU HA . . 5.380 4.184 3.938 4.345 . 0 0 "[ . 1 . 2]" 1
809 1 24 ARG QG 1 26 GLN HE21 . . 4.970 2.812 2.428 3.047 . 0 0 "[ . 1 . 2]" 1
810 1 24 ARG QG 1 26 GLN HE22 . . 4.470 2.031 1.742 2.318 . 0 0 "[ . 1 . 2]" 1
811 1 25 LEU H 1 25 LEU HB2 . . 3.240 2.510 2.330 2.597 . 0 0 "[ . 1 . 2]" 1
812 1 25 LEU H 1 25 LEU HB3 . . 2.970 2.436 2.362 2.551 . 0 0 "[ . 1 . 2]" 1
813 1 25 LEU H 1 25 LEU HG . . 4.830 4.540 4.454 4.623 . 0 0 "[ . 1 . 2]" 1
814 1 25 LEU H 1 26 GLN H . . 4.600 4.596 4.527 4.634 0.034 1 0 "[ . 1 . 2]" 1
815 1 25 LEU H 1 46 ARG QG . . 5.060 3.965 3.791 4.105 . 0 0 "[ . 1 . 2]" 1
816 1 25 LEU H 1 50 ILE MD . . 3.150 2.427 2.278 2.815 . 0 0 "[ . 1 . 2]" 1
817 1 25 LEU H 1 50 ILE HG12 . . 3.780 3.681 3.501 3.827 0.047 9 0 "[ . 1 . 2]" 1
818 1 25 LEU HA 1 25 LEU MD1 . . 3.860 3.335 3.013 3.451 . 0 0 "[ . 1 . 2]" 1
819 1 25 LEU HA 1 25 LEU MD2 . . 2.980 2.185 1.924 2.257 . 0 0 "[ . 1 . 2]" 1
820 1 25 LEU HA 1 26 GLN H . . 2.760 2.258 2.176 2.328 . 0 0 "[ . 1 . 2]" 1
821 1 25 LEU HA 1 26 GLN HE21 . . 5.140 3.550 3.360 3.792 . 0 0 "[ . 1 . 2]" 1
822 1 25 LEU HA 1 26 GLN HE22 . . 5.500 4.789 4.377 5.218 . 0 0 "[ . 1 . 2]" 1
823 1 25 LEU HA 1 46 ARG QG . . 5.500 5.386 5.276 5.557 0.057 20 0 "[ . 1 . 2]" 1
824 1 25 LEU HA 1 50 ILE HA . . 4.430 4.440 4.297 4.497 0.067 3 0 "[ . 1 . 2]" 1
825 1 25 LEU HA 1 50 ILE MD . . 4.360 3.395 3.198 3.577 . 0 0 "[ . 1 . 2]" 1
826 1 25 LEU HA 1 53 LEU QD . . 4.310 3.161 2.977 3.400 . 0 0 "[ . 1 . 2]" 1
827 1 25 LEU HB2 1 26 GLN H . . 4.470 4.373 4.202 4.486 0.016 20 0 "[ . 1 . 2]" 1
828 1 25 LEU HB2 1 46 ARG HA . . 4.010 3.419 3.246 3.635 . 0 0 "[ . 1 . 2]" 1
829 1 25 LEU HB2 1 46 ARG HD2 . . 5.500 5.571 5.564 5.600 0.100 2 0 "[ . 1 . 2]" 1
830 1 25 LEU HB2 1 46 ARG HD3 . . 5.500 5.526 5.457 5.562 0.062 6 0 "[ . 1 . 2]" 1
831 1 25 LEU HB2 1 46 ARG QG . . 5.500 3.247 3.174 3.386 . 0 0 "[ . 1 . 2]" 1
832 1 25 LEU HB2 1 50 ILE MD . . 3.170 2.136 1.931 2.207 . 0 0 "[ . 1 . 2]" 1
833 1 25 LEU HB2 1 50 ILE HG12 . . 4.320 3.304 3.202 3.458 . 0 0 "[ . 1 . 2]" 1
834 1 25 LEU HB2 1 50 ILE HG13 . . 3.730 2.483 2.389 2.639 . 0 0 "[ . 1 . 2]" 1
835 1 25 LEU HB3 1 25 LEU MD1 . . 3.290 2.296 2.125 2.427 . 0 0 "[ . 1 . 2]" 1
836 1 25 LEU HB3 1 25 LEU MD2 . . 3.630 3.257 3.184 3.275 . 0 0 "[ . 1 . 2]" 1
837 1 25 LEU HB3 1 26 GLN H . . 4.500 4.195 4.034 4.310 . 0 0 "[ . 1 . 2]" 1
838 1 25 LEU HB3 1 46 ARG QG . . 5.500 3.605 3.377 3.897 . 0 0 "[ . 1 . 2]" 1
839 1 25 LEU HB3 1 50 ILE MD . . 3.440 3.334 3.195 3.492 0.052 3 0 "[ . 1 . 2]" 1
840 1 25 LEU MD1 1 26 GLN H . . 3.640 2.807 2.555 3.071 . 0 0 "[ . 1 . 2]" 1
841 1 25 LEU MD1 1 26 GLN HE21 . . 5.180 4.985 4.690 5.236 0.056 18 0 "[ . 1 . 2]" 1
842 1 25 LEU MD1 1 42 TRP HB2 . . 3.700 3.242 2.921 3.765 0.065 8 0 "[ . 1 . 2]" 1
843 1 25 LEU MD1 1 42 TRP HB3 . . 4.040 2.671 2.261 3.312 . 0 0 "[ . 1 . 2]" 1
844 1 25 LEU MD1 1 46 ARG HA . . 3.800 3.862 3.697 3.884 0.084 7 0 "[ . 1 . 2]" 1
845 1 25 LEU MD1 1 49 LEU HB2 . . 4.630 4.558 4.419 4.692 0.062 6 0 "[ . 1 . 2]" 1
846 1 25 LEU MD2 1 26 GLN H . . 3.240 2.252 1.887 2.932 . 0 0 "[ . 1 . 2]" 1
847 1 25 LEU MD2 1 27 TYR HB3 . . 5.500 4.890 4.711 5.286 . 0 0 "[ . 1 . 2]" 1
848 1 25 LEU MD2 1 46 ARG HA . . 4.230 3.219 2.551 3.516 . 0 0 "[ . 1 . 2]" 1
849 1 25 LEU MD2 1 49 LEU HB2 . . 4.160 2.761 2.346 2.992 . 0 0 "[ . 1 . 2]" 1
850 1 25 LEU MD2 1 49 LEU HB3 . . 3.850 2.324 2.146 2.512 . 0 0 "[ . 1 . 2]" 1
851 1 25 LEU MD2 1 53 LEU QD . . 5.110 1.927 1.817 2.005 . 0 0 "[ . 1 . 2]" 1
852 1 25 LEU HG 1 50 ILE H . . 5.040 4.488 4.278 4.823 . 0 0 "[ . 1 . 2]" 1
853 1 26 GLN H 1 26 GLN HB2 . . 3.580 2.671 2.554 2.801 . 0 0 "[ . 1 . 2]" 1
854 1 26 GLN H 1 26 GLN HB3 . . 3.780 3.659 3.521 3.766 . 0 0 "[ . 1 . 2]" 1
855 1 26 GLN H 1 26 GLN HE21 . . 5.500 2.961 2.731 3.117 . 0 0 "[ . 1 . 2]" 1
856 1 26 GLN H 1 26 GLN HE22 . . 4.760 4.646 4.401 4.829 0.069 13 0 "[ . 1 . 2]" 1
857 1 26 GLN H 1 26 GLN HG2 . . 4.980 4.885 4.699 4.970 . 0 0 "[ . 1 . 2]" 1
858 1 26 GLN H 1 26 GLN HG3 . . 4.170 4.066 3.699 4.234 0.064 20 0 "[ . 1 . 2]" 1
859 1 26 GLN H 1 27 TYR H . . 4.690 4.343 4.284 4.409 . 0 0 "[ . 1 . 2]" 1
860 1 26 GLN H 1 27 TYR QE . . 5.500 5.519 5.048 5.580 0.080 19 0 "[ . 1 . 2]" 1
861 1 26 GLN H 1 53 LEU QD . . 5.000 3.257 3.071 3.354 . 0 0 "[ . 1 . 2]" 1
862 1 26 GLN HA 1 26 GLN HE21 . . 5.500 3.759 3.510 4.013 . 0 0 "[ . 1 . 2]" 1
863 1 26 GLN HA 1 26 GLN HE22 . . 5.500 5.092 4.677 5.386 . 0 0 "[ . 1 . 2]" 1
864 1 26 GLN HA 1 26 GLN HG2 . . 3.260 3.225 2.917 3.333 0.073 20 0 "[ . 1 . 2]" 1
865 1 26 GLN HA 1 26 GLN HG3 . . 3.410 2.160 2.003 2.270 . 0 0 "[ . 1 . 2]" 1
866 1 26 GLN HA 1 27 TYR H . . 2.840 2.487 2.355 2.637 . 0 0 "[ . 1 . 2]" 1
867 1 26 GLN HB2 1 26 GLN HE21 . . 4.630 2.079 1.910 2.386 . 0 0 "[ . 1 . 2]" 1
868 1 26 GLN HB2 1 26 GLN HE22 . . 4.970 3.476 3.185 3.583 . 0 0 "[ . 1 . 2]" 1
869 1 26 GLN HB2 1 27 TYR H . . 3.950 3.699 3.429 3.938 . 0 0 "[ . 1 . 2]" 1
870 1 26 GLN HB3 1 26 GLN HE21 . . 4.600 3.582 3.458 3.822 . 0 0 "[ . 1 . 2]" 1
871 1 26 GLN HB3 1 26 GLN HE22 . . 4.870 4.777 4.580 4.834 . 0 0 "[ . 1 . 2]" 1
872 1 26 GLN HB3 1 27 TYR H . . 3.070 2.272 2.014 2.529 . 0 0 "[ . 1 . 2]" 1
873 1 26 GLN HE21 1 26 GLN HG3 . . 3.460 3.067 2.699 3.333 . 0 0 "[ . 1 . 2]" 1
874 1 26 GLN HE21 1 53 LEU QD . . 5.010 4.985 4.708 5.102 0.092 18 0 "[ . 1 . 2]" 1
875 1 26 GLN HE22 1 26 GLN HG3 . . 3.740 3.768 3.582 3.825 0.085 6 0 "[ . 1 . 2]" 1
876 1 26 GLN HG2 1 27 TYR H . . 3.790 3.684 3.177 3.810 0.020 7 0 "[ . 1 . 2]" 1
877 1 27 TYR H 1 28 GLU H . . 4.530 4.275 4.187 4.354 . 0 0 "[ . 1 . 2]" 1
878 1 27 TYR H 1 28 GLU HA . . 5.500 4.710 4.614 4.823 . 0 0 "[ . 1 . 2]" 1
879 1 27 TYR HA 1 28 GLU H . . 3.010 2.256 2.164 2.330 . 0 0 "[ . 1 . 2]" 1
880 1 27 TYR HA 1 28 GLU HB2 . . 4.670 4.331 3.982 4.556 . 0 0 "[ . 1 . 2]" 1
881 1 27 TYR HA 1 28 GLU HB3 . . 5.500 4.429 4.053 4.607 . 0 0 "[ . 1 . 2]" 1
882 1 27 TYR HB2 1 28 GLU H . . 3.400 2.789 2.439 3.065 . 0 0 "[ . 1 . 2]" 1
883 1 27 TYR HB2 1 34 ILE MD . . 4.650 4.237 3.989 4.505 . 0 0 "[ . 1 . 2]" 1
884 1 27 TYR HB3 1 28 GLU H . . 3.770 3.513 3.251 3.782 0.012 9 0 "[ . 1 . 2]" 1
885 1 27 TYR HB3 1 34 ILE MD . . 5.500 5.003 4.701 5.315 . 0 0 "[ . 1 . 2]" 1
886 1 28 GLU H 1 28 GLU HB3 . . 3.320 2.780 2.536 2.982 . 0 0 "[ . 1 . 2]" 1
887 1 28 GLU H 1 28 GLU QG . . 4.130 4.115 3.866 4.216 0.086 7 0 "[ . 1 . 2]" 1
888 1 28 GLU H 1 29 THR H . . 4.330 4.125 3.868 4.319 . 0 0 "[ . 1 . 2]" 1
889 1 28 GLU H 1 29 THR MG . . 5.100 4.736 4.426 5.007 . 0 0 "[ . 1 . 2]" 1
890 1 28 GLU HA 1 29 THR H . . 2.670 2.171 2.090 2.239 . 0 0 "[ . 1 . 2]" 1
891 1 28 GLU HB2 1 29 THR H . . 5.500 4.360 4.151 4.601 . 0 0 "[ . 1 . 2]" 1
892 1 28 GLU HB3 1 29 THR H . . 4.430 4.313 4.165 4.484 0.054 18 0 "[ . 1 . 2]" 1
893 1 28 GLU QG 1 29 THR H . . 3.470 3.102 2.679 3.549 0.079 12 0 "[ . 1 . 2]" 1
894 1 29 THR H 1 29 THR MG . . 3.100 2.372 2.176 2.569 . 0 0 "[ . 1 . 2]" 1
895 1 29 THR H 1 34 ILE MD . . 5.500 5.462 5.236 5.581 0.081 3 0 "[ . 1 . 2]" 1
896 1 29 THR HA 1 29 THR MG . . 3.360 3.278 3.191 3.300 . 0 0 "[ . 1 . 2]" 1
897 1 29 THR HA 1 31 ARG H . . 4.160 3.925 3.632 4.203 0.043 3 0 "[ . 1 . 2]" 1
898 1 29 THR HB 1 30 SER H . . 5.150 3.814 3.543 4.251 . 0 0 "[ . 1 . 2]" 1
899 1 29 THR HB 1 31 ARG H . . 4.370 4.104 3.942 4.406 0.036 5 0 "[ . 1 . 2]" 1
900 1 29 THR HB 1 31 ARG QD . . 4.780 3.861 3.578 4.241 . 0 0 "[ . 1 . 2]" 1
901 1 29 THR HB 1 34 ILE MD . . 4.350 3.300 3.061 3.554 . 0 0 "[ . 1 . 2]" 1
902 1 29 THR MG 1 30 SER H . . 4.790 3.371 2.847 4.026 . 0 0 "[ . 1 . 2]" 1
903 1 29 THR MG 1 30 SER HA . . 4.210 4.017 3.581 4.293 0.083 15 0 "[ . 1 . 2]" 1
904 1 29 THR MG 1 30 SER QB . . 5.280 4.812 4.547 5.255 . 0 0 "[ . 1 . 2]" 1
905 1 29 THR MG 1 31 ARG H . . 3.180 2.417 2.073 2.856 . 0 0 "[ . 1 . 2]" 1
906 1 29 THR MG 1 31 ARG HB2 . . 4.500 2.542 2.165 2.874 . 0 0 "[ . 1 . 2]" 1
907 1 29 THR MG 1 31 ARG QB . . 3.660 2.515 2.146 2.836 . 0 0 "[ . 1 . 2]" 1
908 1 29 THR MG 1 31 ARG HB3 . . 4.500 4.005 3.511 4.339 . 0 0 "[ . 1 . 2]" 1
909 1 29 THR MG 1 31 ARG HD2 . . 4.580 4.071 3.000 4.470 . 0 0 "[ . 1 . 2]" 1
910 1 29 THR MG 1 31 ARG QD . . 3.950 2.960 2.583 3.238 . 0 0 "[ . 1 . 2]" 1
911 1 29 THR MG 1 31 ARG HD3 . . 4.580 3.079 2.622 3.508 . 0 0 "[ . 1 . 2]" 1
912 1 29 THR MG 1 31 ARG QG . . 4.710 3.556 3.071 3.826 . 0 0 "[ . 1 . 2]" 1
913 1 29 THR MG 1 32 ASP H . . 5.500 5.343 5.137 5.556 0.056 12 0 "[ . 1 . 2]" 1
914 1 29 THR MG 1 33 ASN H . . 4.530 4.561 4.361 4.617 0.087 3 0 "[ . 1 . 2]" 1
915 1 29 THR MG 1 34 ILE HA . . 4.000 3.845 3.506 4.066 0.066 2 0 "[ . 1 . 2]" 1
916 1 29 THR MG 1 34 ILE MD . . 2.870 2.472 2.243 2.755 . 0 0 "[ . 1 . 2]" 1
917 1 30 SER H 1 30 SER HB2 . . 3.760 2.762 2.337 3.600 . 0 0 "[ . 1 . 2]" 1
918 1 30 SER H 1 30 SER HB3 . . 3.760 3.041 2.420 3.808 0.048 14 0 "[ . 1 . 2]" 1
919 1 30 SER H 1 31 ARG H . . 4.300 2.213 1.891 2.744 . 0 0 "[ . 1 . 2]" 1
920 1 30 SER H 1 31 ARG QG . . 4.890 3.231 2.756 3.831 . 0 0 "[ . 1 . 2]" 1
921 1 30 SER QB 1 31 ARG H . . 4.210 3.626 3.348 3.887 . 0 0 "[ . 1 . 2]" 1
922 1 31 ARG H 1 31 ARG HB2 . . 3.690 2.334 2.096 2.568 . 0 0 "[ . 1 . 2]" 1
923 1 31 ARG H 1 31 ARG QB . . 3.210 2.303 2.077 2.519 . 0 0 "[ . 1 . 2]" 1
924 1 31 ARG H 1 31 ARG HB3 . . 3.690 3.541 3.392 3.639 . 0 0 "[ . 1 . 2]" 1
925 1 31 ARG H 1 31 ARG HD2 . . 4.400 4.346 3.905 4.459 0.059 12 0 "[ . 1 . 2]" 1
926 1 31 ARG H 1 31 ARG HD3 . . 4.400 3.901 3.482 4.427 0.027 4 0 "[ . 1 . 2]" 1
927 1 31 ARG H 1 31 ARG QG . . 2.870 2.405 2.084 2.677 . 0 0 "[ . 1 . 2]" 1
928 1 31 ARG H 1 33 ASN H . . 5.500 5.010 4.644 5.416 . 0 0 "[ . 1 . 2]" 1
929 1 31 ARG H 1 34 ILE MD . . 5.500 5.142 4.844 5.508 0.008 5 0 "[ . 1 . 2]" 1
930 1 31 ARG HA 1 31 ARG QD . . 4.780 4.215 4.069 4.331 . 0 0 "[ . 1 . 2]" 1
931 1 31 ARG HA 1 31 ARG QG . . 2.820 2.460 2.322 2.663 . 0 0 "[ . 1 . 2]" 1
932 1 31 ARG HA 1 32 ASP H . . 2.790 2.444 2.313 2.585 . 0 0 "[ . 1 . 2]" 1
933 1 31 ARG HA 1 33 ASN H . . 4.660 4.225 4.001 4.373 . 0 0 "[ . 1 . 2]" 1
934 1 31 ARG QB 1 31 ARG QD . . 3.150 2.214 2.143 2.291 . 0 0 "[ . 1 . 2]" 1
935 1 31 ARG QB 1 32 ASP H . . 3.370 2.427 2.203 2.630 . 0 0 "[ . 1 . 2]" 1
936 1 31 ARG QB 1 34 ILE MD . . 5.180 3.766 3.519 4.257 . 0 0 "[ . 1 . 2]" 1
937 1 31 ARG HB2 1 32 ASP H . . 3.930 3.672 3.372 3.925 . 0 0 "[ . 1 . 2]" 1
938 1 31 ARG HB2 1 32 ASP QB . . 5.500 5.244 4.893 5.578 0.078 20 0 "[ . 1 . 2]" 1
939 1 31 ARG HB2 1 33 ASN H . . 3.630 3.251 2.786 3.668 0.038 13 0 "[ . 1 . 2]" 1
940 1 31 ARG HB3 1 32 ASP H . . 3.930 2.463 2.225 2.676 . 0 0 "[ . 1 . 2]" 1
941 1 31 ARG HB3 1 32 ASP QB . . 5.500 4.140 3.760 4.668 . 0 0 "[ . 1 . 2]" 1
942 1 31 ARG HB3 1 33 ASN H . . 3.630 2.625 2.414 2.814 . 0 0 "[ . 1 . 2]" 1
943 1 31 ARG QD 1 34 ILE HA . . 4.110 3.428 3.016 3.940 . 0 0 "[ . 1 . 2]" 1
944 1 31 ARG QD 1 34 ILE MD . . 3.810 2.605 2.244 3.145 . 0 0 "[ . 1 . 2]" 1
945 1 31 ARG HD2 1 34 ILE MD . . 4.380 3.559 2.907 4.138 . 0 0 "[ . 1 . 2]" 1
946 1 31 ARG HD3 1 34 ILE MD . . 4.380 2.690 2.293 3.259 . 0 0 "[ . 1 . 2]" 1
947 1 31 ARG QG 1 33 ASN H . . 4.820 4.621 4.357 4.834 0.014 13 0 "[ . 1 . 2]" 1
948 1 32 ASP H 1 32 ASP QB . . 3.290 2.274 2.075 2.658 . 0 0 "[ . 1 . 2]" 1
949 1 32 ASP H 1 33 ASN H . . 4.090 2.583 2.344 2.749 . 0 0 "[ . 1 . 2]" 1
950 1 32 ASP HA 1 32 ASP QB . . 2.440 2.376 2.162 2.533 0.093 10 0 "[ . 1 . 2]" 1
951 1 32 ASP QB 1 33 ASN H . . 5.500 2.907 2.521 3.607 . 0 0 "[ . 1 . 2]" 1
952 1 33 ASN H 1 33 ASN QD . . 5.340 4.294 2.782 5.251 . 0 0 "[ . 1 . 2]" 1
953 1 33 ASN H 1 34 ILE H . . 4.510 4.259 4.150 4.325 . 0 0 "[ . 1 . 2]" 1
954 1 33 ASN H 1 34 ILE HA . . 5.170 4.410 4.200 4.559 . 0 0 "[ . 1 . 2]" 1
955 1 33 ASN H 1 34 ILE MD . . 5.500 5.483 5.407 5.558 0.058 7 0 "[ . 1 . 2]" 1
956 1 33 ASN HA 1 34 ILE H . . 2.850 2.570 2.335 2.869 0.019 19 0 "[ . 1 . 2]" 1
957 1 33 ASN HA 1 34 ILE HB . . 4.440 4.372 4.222 4.486 0.046 1 0 "[ . 1 . 2]" 1
958 1 33 ASN HA 1 34 ILE MG . . 4.520 3.971 3.830 4.219 . 0 0 "[ . 1 . 2]" 1
959 1 33 ASN QB 1 33 ASN QD . . 3.060 2.351 2.063 2.810 . 0 0 "[ . 1 . 2]" 1
960 1 33 ASN QB 1 34 ILE H . . 3.170 2.741 2.071 3.247 0.077 2 0 "[ . 1 . 2]" 1
961 1 33 ASN QB 1 34 ILE HA . . 4.780 4.374 3.945 4.701 . 0 0 "[ . 1 . 2]" 1
962 1 33 ASN QB 1 34 ILE HB . . 5.340 5.199 4.876 5.449 0.109 2 0 "[ . 1 . 2]" 1
963 1 33 ASN QD 1 34 ILE H . . 5.340 3.852 2.186 5.109 . 0 0 "[ . 1 . 2]" 1
964 1 34 ILE H 1 34 ILE HB . . 3.230 2.922 2.641 3.265 0.035 20 0 "[ . 1 . 2]" 1
965 1 34 ILE H 1 34 ILE MD . . 4.320 4.345 4.198 4.414 0.094 20 0 "[ . 1 . 2]" 1
966 1 34 ILE H 1 34 ILE HG12 . . 5.500 4.838 4.722 4.978 . 0 0 "[ . 1 . 2]" 1
967 1 34 ILE H 1 34 ILE HG13 . . 4.580 4.502 4.435 4.537 . 0 0 "[ . 1 . 2]" 1
968 1 34 ILE H 1 34 ILE MG . . 3.350 2.075 1.944 2.294 . 0 0 "[ . 1 . 2]" 1
969 1 34 ILE H 1 35 PRO HD2 . . 5.000 4.965 4.809 5.048 0.048 10 0 "[ . 1 . 2]" 1
970 1 34 ILE H 1 35 PRO HD3 . . 4.860 4.759 4.475 4.904 0.044 10 0 "[ . 1 . 2]" 1
971 1 34 ILE H 1 39 LEU QD . . 5.440 4.423 4.217 4.540 . 0 0 "[ . 1 . 2]" 1
972 1 34 ILE HA 1 34 ILE MD . . 3.500 2.232 2.153 2.440 . 0 0 "[ . 1 . 2]" 1
973 1 34 ILE HA 1 34 ILE HG13 . . 2.920 2.863 2.607 2.935 0.015 5 0 "[ . 1 . 2]" 1
974 1 34 ILE HA 1 34 ILE MG . . 3.440 3.252 3.193 3.269 . 0 0 "[ . 1 . 2]" 1
975 1 34 ILE HA 1 35 PRO HD2 . . 2.810 2.359 2.054 2.434 . 0 0 "[ . 1 . 2]" 1
976 1 34 ILE HA 1 35 PRO HD3 . . 2.840 2.312 2.262 2.358 . 0 0 "[ . 1 . 2]" 1
977 1 34 ILE HA 1 38 LEU HG . . 4.690 4.680 4.542 4.759 0.069 19 0 "[ . 1 . 2]" 1
978 1 34 ILE HA 1 39 LEU QD . . 5.440 4.908 4.720 5.016 . 0 0 "[ . 1 . 2]" 1
979 1 34 ILE HB 1 34 ILE MD . . 3.120 2.234 2.142 2.290 . 0 0 "[ . 1 . 2]" 1
980 1 34 ILE HB 1 34 ILE HG12 . . 2.870 2.624 2.580 2.665 . 0 0 "[ . 1 . 2]" 1
981 1 34 ILE HB 1 35 PRO HD2 . . 4.160 4.033 3.913 4.103 . 0 0 "[ . 1 . 2]" 1
982 1 34 ILE HB 1 35 PRO HD3 . . 4.760 4.691 4.617 4.777 0.017 9 0 "[ . 1 . 2]" 1
983 1 34 ILE HB 1 39 LEU QD . . 5.440 3.920 3.753 4.165 . 0 0 "[ . 1 . 2]" 1
984 1 34 ILE HB 1 39 LEU HG . . 5.230 4.810 4.617 4.947 . 0 0 "[ . 1 . 2]" 1
985 1 34 ILE MD 1 34 ILE MG . . 3.340 3.183 3.159 3.221 . 0 0 "[ . 1 . 2]" 1
986 1 34 ILE MD 1 35 PRO HD2 . . 4.620 2.080 1.989 2.196 . 0 0 "[ . 1 . 2]" 1
987 1 34 ILE MD 1 35 PRO HD3 . . 4.370 3.092 2.937 3.422 . 0 0 "[ . 1 . 2]" 1
988 1 34 ILE MD 1 35 PRO HG2 . . 4.700 3.794 3.577 3.945 . 0 0 "[ . 1 . 2]" 1
989 1 34 ILE MD 1 35 PRO HG3 . . 5.340 4.267 4.184 4.411 . 0 0 "[ . 1 . 2]" 1
990 1 34 ILE MD 1 38 LEU HG . . 3.220 2.730 2.599 2.813 . 0 0 "[ . 1 . 2]" 1
991 1 34 ILE MD 1 42 TRP HD1 . . 4.430 4.325 4.151 4.487 0.057 17 0 "[ . 1 . 2]" 1
992 1 34 ILE MD 1 42 TRP HZ2 . . 5.140 5.081 4.760 5.221 0.081 5 0 "[ . 1 . 2]" 1
993 1 34 ILE HG12 1 34 ILE MG . . 3.570 2.229 2.187 2.261 . 0 0 "[ . 1 . 2]" 1
994 1 34 ILE HG12 1 39 LEU H . . 4.390 4.183 4.053 4.300 . 0 0 "[ . 1 . 2]" 1
995 1 34 ILE HG12 1 39 LEU HA . . 4.330 4.385 4.304 4.400 0.070 16 0 "[ . 1 . 2]" 1
996 1 34 ILE HG12 1 39 LEU HB2 . . 5.500 5.351 5.108 5.551 0.051 9 0 "[ . 1 . 2]" 1
997 1 34 ILE HG12 1 39 LEU HG . . 4.070 2.973 2.727 3.222 . 0 0 "[ . 1 . 2]" 1
998 1 34 ILE HG13 1 35 PRO HB2 . . 4.840 4.897 4.848 4.912 0.072 17 0 "[ . 1 . 2]" 1
999 1 34 ILE HG13 1 35 PRO HD2 . . 3.190 2.175 2.031 2.218 . 0 0 "[ . 1 . 2]" 1
1000 1 34 ILE HG13 1 35 PRO HD3 . . 3.650 3.681 3.570 3.707 0.057 6 0 "[ . 1 . 2]" 1
1001 1 34 ILE HG13 1 35 PRO HG2 . . 4.100 3.558 3.312 3.676 . 0 0 "[ . 1 . 2]" 1
1002 1 34 ILE HG13 1 36 GLU HA . . 5.500 5.107 4.877 5.286 . 0 0 "[ . 1 . 2]" 1
1003 1 34 ILE HG13 1 37 GLU QG . . 5.500 5.481 5.349 5.572 0.072 1 0 "[ . 1 . 2]" 1
1004 1 34 ILE HG13 1 38 LEU H . . 4.220 4.274 4.225 4.284 0.064 5 0 "[ . 1 . 2]" 1
1005 1 34 ILE HG13 1 38 LEU HA . . 5.500 5.270 5.091 5.390 . 0 0 "[ . 1 . 2]" 1
1006 1 34 ILE HG13 1 38 LEU HB2 . . 3.230 2.428 2.292 2.518 . 0 0 "[ . 1 . 2]" 1
1007 1 34 ILE HG13 1 38 LEU HG . . 3.550 3.475 3.213 3.571 0.021 6 0 "[ . 1 . 2]" 1
1008 1 34 ILE HG13 1 39 LEU H . . 4.610 3.603 3.438 3.812 . 0 0 "[ . 1 . 2]" 1
1009 1 34 ILE HG13 1 39 LEU HB2 . . 5.500 5.190 4.905 5.404 . 0 0 "[ . 1 . 2]" 1
1010 1 34 ILE HG13 1 39 LEU HG . . 4.410 3.018 2.801 3.257 . 0 0 "[ . 1 . 2]" 1
1011 1 34 ILE MG 1 35 PRO HD2 . . 4.670 4.052 3.940 4.110 . 0 0 "[ . 1 . 2]" 1
1012 1 34 ILE MG 1 35 PRO HD3 . . 4.640 4.709 4.635 4.725 0.085 1 0 "[ . 1 . 2]" 1
1013 1 34 ILE MG 1 38 LEU H . . 5.500 5.519 5.285 5.574 0.074 14 0 "[ . 1 . 2]" 1
1014 1 34 ILE MG 1 38 LEU HG . . 5.500 5.521 5.267 5.588 0.088 6 0 "[ . 1 . 2]" 1
1015 1 35 PRO HA 1 36 GLU H . . 2.550 2.316 2.221 2.376 . 0 0 "[ . 1 . 2]" 1
1016 1 35 PRO HA 1 36 GLU HA . . 4.330 4.359 4.329 4.380 0.050 7 0 "[ . 1 . 2]" 1
1017 1 35 PRO HA 1 36 GLU HB3 . . 5.500 4.691 4.496 4.846 . 0 0 "[ . 1 . 2]" 1
1018 1 35 PRO HA 1 37 GLU H . . 4.450 4.227 4.120 4.391 . 0 0 "[ . 1 . 2]" 1
1019 1 35 PRO HA 1 38 LEU H . . 4.940 4.843 4.589 4.898 . 0 0 "[ . 1 . 2]" 1
1020 1 35 PRO HA 1 38 LEU MD2 . . 5.500 5.337 5.217 5.452 . 0 0 "[ . 1 . 2]" 1
1021 1 35 PRO HA 1 39 LEU QD . . 5.440 4.918 4.466 5.201 . 0 0 "[ . 1 . 2]" 1
1022 1 35 PRO HB2 1 36 GLU H . . 3.660 3.040 2.933 3.164 . 0 0 "[ . 1 . 2]" 1
1023 1 35 PRO HB2 1 36 GLU HA . . 4.880 4.793 4.730 4.899 0.019 19 0 "[ . 1 . 2]" 1
1024 1 35 PRO HB2 1 37 GLU H . . 4.000 2.656 2.486 2.838 . 0 0 "[ . 1 . 2]" 1
1025 1 35 PRO HB2 1 38 LEU H . . 3.720 2.946 2.886 3.039 . 0 0 "[ . 1 . 2]" 1
1026 1 35 PRO HB2 1 38 LEU HA . . 5.500 5.550 5.375 5.570 0.070 18 0 "[ . 1 . 2]" 1
1027 1 35 PRO HB2 1 38 LEU HB3 . . 5.500 5.527 5.415 5.562 0.062 11 0 "[ . 1 . 2]" 1
1028 1 35 PRO HB2 1 38 LEU MD2 . . 3.750 3.222 3.080 3.337 . 0 0 "[ . 1 . 2]" 1
1029 1 35 PRO HB2 1 38 LEU HG . . 4.400 4.463 4.417 4.478 0.078 5 0 "[ . 1 . 2]" 1
1030 1 35 PRO HB3 1 36 GLU H . . 3.800 3.644 3.530 3.781 . 0 0 "[ . 1 . 2]" 1
1031 1 35 PRO HB3 1 37 GLU H . . 4.450 4.250 4.070 4.390 . 0 0 "[ . 1 . 2]" 1
1032 1 35 PRO HB3 1 38 LEU H . . 4.840 4.629 4.530 4.751 . 0 0 "[ . 1 . 2]" 1
1033 1 35 PRO HB3 1 38 LEU MD2 . . 4.490 4.275 4.158 4.400 . 0 0 "[ . 1 . 2]" 1
1034 1 35 PRO HB3 1 38 LEU HG . . 5.500 5.111 4.932 5.170 . 0 0 "[ . 1 . 2]" 1
1035 1 35 PRO HD2 1 38 LEU H . . 4.870 4.281 4.185 4.439 . 0 0 "[ . 1 . 2]" 1
1036 1 35 PRO HD2 1 38 LEU HA . . 5.500 5.532 5.409 5.559 0.059 7 0 "[ . 1 . 2]" 1
1037 1 35 PRO HD2 1 38 LEU HB2 . . 3.780 2.756 2.639 2.826 . 0 0 "[ . 1 . 2]" 1
1038 1 35 PRO HD2 1 38 LEU HB3 . . 5.070 3.741 3.589 3.797 . 0 0 "[ . 1 . 2]" 1
1039 1 35 PRO HD2 1 38 LEU MD1 . . 4.660 3.942 3.878 4.027 . 0 0 "[ . 1 . 2]" 1
1040 1 35 PRO HD2 1 38 LEU MD2 . . 4.350 3.700 3.650 3.866 . 0 0 "[ . 1 . 2]" 1
1041 1 35 PRO HD2 1 38 LEU HG . . 3.990 2.483 2.411 2.589 . 0 0 "[ . 1 . 2]" 1
1042 1 35 PRO HD3 1 38 LEU HB2 . . 4.390 4.354 4.228 4.419 0.029 7 0 "[ . 1 . 2]" 1
1043 1 35 PRO HD3 1 38 LEU HG . . 3.950 3.823 3.733 3.893 . 0 0 "[ . 1 . 2]" 1
1044 1 35 PRO HG2 1 36 GLU H . . 4.880 4.705 4.573 4.790 . 0 0 "[ . 1 . 2]" 1
1045 1 35 PRO HG2 1 36 GLU QG . . 5.500 5.566 5.530 5.581 0.081 6 0 "[ . 1 . 2]" 1
1046 1 35 PRO HG2 1 37 GLU H . . 4.340 4.170 3.860 4.390 0.050 2 0 "[ . 1 . 2]" 1
1047 1 35 PRO HG2 1 38 LEU H . . 3.890 2.668 2.454 2.858 . 0 0 "[ . 1 . 2]" 1
1048 1 35 PRO HG2 1 38 LEU HA . . 4.420 4.390 4.099 4.476 0.056 18 0 "[ . 1 . 2]" 1
1049 1 35 PRO HG2 1 38 LEU HB2 . . 4.310 2.331 1.979 2.442 . 0 0 "[ . 1 . 2]" 1
1050 1 35 PRO HG2 1 38 LEU HB3 . . 4.800 3.811 3.511 3.906 . 0 0 "[ . 1 . 2]" 1
1051 1 35 PRO HG2 1 38 LEU MD2 . . 5.500 2.099 2.055 2.229 . 0 0 "[ . 1 . 2]" 1
1052 1 35 PRO HG2 1 38 LEU HG . . 5.500 2.295 2.129 2.346 . 0 0 "[ . 1 . 2]" 1
1053 1 35 PRO HG2 1 39 LEU H . . 4.440 4.396 4.152 4.490 0.050 4 0 "[ . 1 . 2]" 1
1054 1 36 GLU H 1 36 GLU HB2 . . 3.730 3.609 3.554 3.667 . 0 0 "[ . 1 . 2]" 1
1055 1 36 GLU H 1 36 GLU HB3 . . 2.850 2.668 2.476 2.835 . 0 0 "[ . 1 . 2]" 1
1056 1 36 GLU H 1 36 GLU QG . . 3.380 1.952 1.744 2.207 . 0 0 "[ . 1 . 2]" 1
1057 1 36 GLU H 1 37 GLU H . . 3.360 2.698 2.621 2.816 . 0 0 "[ . 1 . 2]" 1
1058 1 36 GLU H 1 37 GLU HA . . 5.470 5.305 5.238 5.399 . 0 0 "[ . 1 . 2]" 1
1059 1 36 GLU H 1 38 LEU H . . 4.420 4.361 4.190 4.463 0.043 14 0 "[ . 1 . 2]" 1
1060 1 36 GLU H 1 39 LEU H . . 5.120 4.937 4.857 5.030 . 0 0 "[ . 1 . 2]" 1
1061 1 36 GLU H 1 39 LEU HB2 . . 5.500 5.275 5.030 5.445 . 0 0 "[ . 1 . 2]" 1
1062 1 36 GLU H 1 39 LEU QD . . 5.440 4.521 4.023 4.928 . 0 0 "[ . 1 . 2]" 1
1063 1 36 GLU HA 1 36 GLU HB2 . . 2.930 2.485 2.383 2.563 . 0 0 "[ . 1 . 2]" 1
1064 1 36 GLU HA 1 36 GLU HB3 . . 2.900 2.368 2.282 2.458 . 0 0 "[ . 1 . 2]" 1
1065 1 36 GLU HA 1 36 GLU QG . . 3.500 3.362 3.331 3.389 . 0 0 "[ . 1 . 2]" 1
1066 1 36 GLU HA 1 37 GLU HA . . 5.500 4.827 4.763 4.905 . 0 0 "[ . 1 . 2]" 1
1067 1 36 GLU HA 1 38 LEU H . . 4.210 4.206 3.956 4.279 0.069 13 0 "[ . 1 . 2]" 1
1068 1 36 GLU HA 1 38 LEU HB2 . . 5.210 4.886 4.744 5.024 . 0 0 "[ . 1 . 2]" 1
1069 1 36 GLU HA 1 39 LEU H . . 3.380 3.230 3.000 3.320 . 0 0 "[ . 1 . 2]" 1
1070 1 36 GLU HA 1 39 LEU HA . . 5.500 5.228 5.002 5.374 . 0 0 "[ . 1 . 2]" 1
1071 1 36 GLU HA 1 39 LEU HB2 . . 3.160 2.528 2.277 2.782 . 0 0 "[ . 1 . 2]" 1
1072 1 36 GLU HA 1 39 LEU HB3 . . 4.570 4.177 3.901 4.452 . 0 0 "[ . 1 . 2]" 1
1073 1 36 GLU HA 1 39 LEU QD . . 3.390 2.557 2.106 3.005 . 0 0 "[ . 1 . 2]" 1
1074 1 36 GLU HA 1 39 LEU HG . . 3.460 3.348 3.004 3.513 0.053 9 0 "[ . 1 . 2]" 1
1075 1 36 GLU HA 1 40 ASN H . . 3.840 3.797 3.690 3.887 0.047 3 0 "[ . 1 . 2]" 1
1076 1 36 GLU HA 1 40 ASN QB . . 5.500 4.905 4.776 5.069 . 0 0 "[ . 1 . 2]" 1
1077 1 36 GLU HB2 1 39 LEU HB2 . . 5.500 4.070 3.750 4.404 . 0 0 "[ . 1 . 2]" 1
1078 1 36 GLU HB2 1 40 ASN H . . 4.590 4.340 4.184 4.468 . 0 0 "[ . 1 . 2]" 1
1079 1 36 GLU HB2 1 40 ASN QB . . 4.300 4.381 4.364 4.388 0.088 10 0 "[ . 1 . 2]" 1
1080 1 36 GLU HB2 1 40 ASN HD21 . . 4.250 2.668 2.395 3.669 . 0 0 "[ . 1 . 2]" 1
1081 1 36 GLU HB2 1 40 ASN HD22 . . 4.120 2.943 2.457 3.400 . 0 0 "[ . 1 . 2]" 1
1082 1 36 GLU HB3 1 37 GLU H . . 4.040 4.079 3.953 4.111 0.071 6 0 "[ . 1 . 2]" 1
1083 1 36 GLU HB3 1 39 LEU H . . 5.500 5.525 5.256 5.565 0.065 20 0 "[ . 1 . 2]" 1
1084 1 36 GLU HB3 1 40 ASN HD21 . . 5.500 4.359 4.092 5.405 . 0 0 "[ . 1 . 2]" 1
1085 1 36 GLU QG 1 37 GLU H . . 3.140 2.223 1.937 2.397 . 0 0 "[ . 1 . 2]" 1
1086 1 36 GLU QG 1 37 GLU HA . . 3.730 3.484 3.169 3.787 0.057 1 0 "[ . 1 . 2]" 1
1087 1 36 GLU QG 1 38 LEU MD2 . . 5.500 5.594 5.488 5.616 0.116 7 0 "[ . 1 . 2]" 1
1088 1 36 GLU QG 1 39 LEU HB2 . . 5.500 5.254 4.920 5.503 0.003 1 0 "[ . 1 . 2]" 1
1089 1 36 GLU QG 1 39 LEU QD . . 5.440 4.995 4.639 5.343 . 0 0 "[ . 1 . 2]" 1
1090 1 36 GLU QG 1 40 ASN HD21 . . 4.150 3.625 2.820 4.161 0.011 19 0 "[ . 1 . 2]" 1
1091 1 36 GLU QG 1 40 ASN HD22 . . 5.500 4.312 3.466 4.906 . 0 0 "[ . 1 . 2]" 1
1092 1 37 GLU H 1 37 GLU QB . . 2.790 2.656 2.412 2.829 0.039 1 0 "[ . 1 . 2]" 1
1093 1 37 GLU H 1 37 GLU QG . . 3.560 2.037 1.668 2.459 . 0 0 "[ . 1 . 2]" 1
1094 1 37 GLU H 1 38 LEU H . . 3.160 2.727 2.625 2.860 . 0 0 "[ . 1 . 2]" 1
1095 1 37 GLU H 1 38 LEU HA . . 5.500 5.370 5.275 5.476 . 0 0 "[ . 1 . 2]" 1
1096 1 37 GLU H 1 38 LEU HB2 . . 4.830 4.593 4.496 4.781 . 0 0 "[ . 1 . 2]" 1
1097 1 37 GLU H 1 38 LEU MD2 . . 4.260 4.157 4.012 4.281 0.021 19 0 "[ . 1 . 2]" 1
1098 1 37 GLU H 1 39 LEU H . . 4.370 4.214 4.068 4.413 0.043 8 0 "[ . 1 . 2]" 1
1099 1 37 GLU H 1 39 LEU HB2 . . 5.490 5.182 4.960 5.482 . 0 0 "[ . 1 . 2]" 1
1100 1 37 GLU H 1 40 ASN H . . 4.930 4.678 4.584 4.799 . 0 0 "[ . 1 . 2]" 1
1101 1 37 GLU H 1 40 ASN QB . . 4.820 4.620 4.452 4.772 . 0 0 "[ . 1 . 2]" 1
1102 1 37 GLU HA 1 37 GLU QB . . 2.540 2.159 2.139 2.175 . 0 0 "[ . 1 . 2]" 1
1103 1 37 GLU HA 1 37 GLU QG . . 3.900 3.350 3.284 3.499 . 0 0 "[ . 1 . 2]" 1
1104 1 37 GLU HA 1 38 LEU H . . 3.540 3.565 3.505 3.590 0.050 20 0 "[ . 1 . 2]" 1
1105 1 37 GLU HA 1 38 LEU MD2 . . 5.000 4.696 4.526 4.774 . 0 0 "[ . 1 . 2]" 1
1106 1 37 GLU HA 1 40 ASN H . . 3.990 3.532 3.369 3.726 . 0 0 "[ . 1 . 2]" 1
1107 1 37 GLU HA 1 40 ASN QB . . 2.940 2.418 2.251 2.673 . 0 0 "[ . 1 . 2]" 1
1108 1 37 GLU HA 1 40 ASN HD21 . . 3.960 3.207 2.717 3.575 . 0 0 "[ . 1 . 2]" 1
1109 1 37 GLU HA 1 41 GLU H . . 4.510 4.016 3.851 4.237 . 0 0 "[ . 1 . 2]" 1
1110 1 37 GLU QB 1 38 LEU H . . 3.570 3.428 3.291 3.589 0.019 8 0 "[ . 1 . 2]" 1
1111 1 37 GLU QB 1 38 LEU HA . . 4.440 4.346 4.056 4.527 0.087 8 0 "[ . 1 . 2]" 1
1112 1 37 GLU QG 1 38 LEU H . . 3.790 2.098 1.855 2.245 . 0 0 "[ . 1 . 2]" 1
1113 1 37 GLU QG 1 38 LEU HB3 . . 5.500 4.923 4.690 5.098 . 0 0 "[ . 1 . 2]" 1
1114 1 37 GLU QG 1 38 LEU MD1 . . 5.470 4.544 4.176 4.847 . 0 0 "[ . 1 . 2]" 1
1115 1 37 GLU QG 1 38 LEU MD2 . . 5.500 2.046 1.900 2.199 . 0 0 "[ . 1 . 2]" 1
1116 1 37 GLU QG 1 38 LEU HG . . 5.500 4.195 4.016 4.354 . 0 0 "[ . 1 . 2]" 1
1117 1 37 GLU QG 1 39 LEU H . . 5.500 4.440 4.237 4.580 . 0 0 "[ . 1 . 2]" 1
1118 1 38 LEU H 1 38 LEU HB2 . . 3.030 2.171 2.125 2.207 . 0 0 "[ . 1 . 2]" 1
1119 1 38 LEU H 1 38 LEU HB3 . . 3.660 3.479 3.441 3.511 . 0 0 "[ . 1 . 2]" 1
1120 1 38 LEU H 1 38 LEU MD1 . . 5.500 4.191 4.108 4.266 . 0 0 "[ . 1 . 2]" 1
1121 1 38 LEU H 1 38 LEU MD2 . . 3.340 2.360 2.249 2.513 . 0 0 "[ . 1 . 2]" 1
1122 1 38 LEU H 1 38 LEU HG . . 3.920 3.701 3.618 3.828 . 0 0 "[ . 1 . 2]" 1
1123 1 38 LEU H 1 39 LEU H . . 3.150 2.604 2.491 2.662 . 0 0 "[ . 1 . 2]" 1
1124 1 38 LEU H 1 39 LEU HA . . 5.220 5.242 5.137 5.281 0.061 15 0 "[ . 1 . 2]" 1
1125 1 38 LEU H 1 39 LEU HB2 . . 4.790 4.723 4.500 4.837 0.047 10 0 "[ . 1 . 2]" 1
1126 1 38 LEU H 1 39 LEU QD . . 5.440 4.858 4.658 4.944 . 0 0 "[ . 1 . 2]" 1
1127 1 38 LEU H 1 39 LEU HG . . 5.500 4.633 4.341 4.825 . 0 0 "[ . 1 . 2]" 1
1128 1 38 LEU H 1 40 ASN H . . 4.180 4.117 3.848 4.226 0.046 5 0 "[ . 1 . 2]" 1
1129 1 38 LEU H 1 40 ASN QB . . 4.950 4.770 4.584 4.962 0.012 20 0 "[ . 1 . 2]" 1
1130 1 38 LEU H 1 41 GLU H . . 4.930 4.650 4.517 4.730 . 0 0 "[ . 1 . 2]" 1
1131 1 38 LEU HA 1 38 LEU MD2 . . 2.790 2.163 2.041 2.200 . 0 0 "[ . 1 . 2]" 1
1132 1 38 LEU HA 1 38 LEU HG . . 3.990 3.752 3.650 3.785 . 0 0 "[ . 1 . 2]" 1
1133 1 38 LEU HA 1 39 LEU HA . . 5.500 4.795 4.761 4.818 . 0 0 "[ . 1 . 2]" 1
1134 1 38 LEU HA 1 40 ASN H . . 4.930 4.630 4.483 4.745 . 0 0 "[ . 1 . 2]" 1
1135 1 38 LEU HA 1 40 ASN QB . . 5.320 5.160 4.959 5.375 0.055 20 0 "[ . 1 . 2]" 1
1136 1 38 LEU HA 1 41 GLU H . . 3.620 3.497 3.362 3.618 . 0 0 "[ . 1 . 2]" 1
1137 1 38 LEU HA 1 41 GLU HB2 . . 3.210 2.675 2.376 3.227 0.017 20 0 "[ . 1 . 2]" 1
1138 1 38 LEU HA 1 41 GLU HB3 . . 3.950 3.932 3.610 4.022 0.072 12 0 "[ . 1 . 2]" 1
1139 1 38 LEU HA 1 42 TRP H . . 4.450 3.966 3.870 4.250 . 0 0 "[ . 1 . 2]" 1
1140 1 38 LEU HB2 1 38 LEU MD2 . . 3.340 2.712 2.579 2.745 . 0 0 "[ . 1 . 2]" 1
1141 1 38 LEU HB2 1 39 LEU H . . 3.520 2.555 2.379 2.767 . 0 0 "[ . 1 . 2]" 1
1142 1 38 LEU HB2 1 39 LEU HA . . 4.670 4.590 4.517 4.767 0.097 2 0 "[ . 1 . 2]" 1
1143 1 38 LEU HB2 1 41 GLU H . . 5.500 5.551 5.449 5.597 0.097 2 0 "[ . 1 . 2]" 1
1144 1 38 LEU HB3 1 39 LEU H . . 3.340 3.121 2.922 3.249 . 0 0 "[ . 1 . 2]" 1
1145 1 38 LEU HB3 1 39 LEU HA . . 4.970 3.992 3.891 4.079 . 0 0 "[ . 1 . 2]" 1
1146 1 38 LEU MD1 1 41 GLU HB2 . . 5.500 4.307 3.986 5.034 . 0 0 "[ . 1 . 2]" 1
1147 1 38 LEU MD1 1 42 TRP H . . 5.500 4.905 4.788 5.068 . 0 0 "[ . 1 . 2]" 1
1148 1 38 LEU MD1 1 42 TRP HZ2 . . 5.500 2.081 1.940 2.194 . 0 0 "[ . 1 . 2]" 1
1149 1 38 LEU MD2 1 41 GLU H . . 5.120 4.952 4.841 5.035 . 0 0 "[ . 1 . 2]" 1
1150 1 38 LEU MD2 1 41 GLU HB2 . . 5.500 4.045 3.808 4.383 . 0 0 "[ . 1 . 2]" 1
1151 1 38 LEU MD2 1 42 TRP H . . 5.500 5.562 5.500 5.588 0.088 7 0 "[ . 1 . 2]" 1
1152 1 39 LEU H 1 39 LEU HB2 . . 3.290 2.485 2.419 2.538 . 0 0 "[ . 1 . 2]" 1
1153 1 39 LEU H 1 39 LEU HB3 . . 3.730 3.631 3.588 3.664 . 0 0 "[ . 1 . 2]" 1
1154 1 39 LEU H 1 39 LEU QD . . 3.550 3.170 3.049 3.245 . 0 0 "[ . 1 . 2]" 1
1155 1 39 LEU H 1 39 LEU HG . . 3.090 2.439 2.259 2.509 . 0 0 "[ . 1 . 2]" 1
1156 1 39 LEU H 1 40 ASN H . . 3.280 2.757 2.651 2.834 . 0 0 "[ . 1 . 2]" 1
1157 1 39 LEU H 1 40 ASN QB . . 4.610 4.481 4.359 4.656 0.046 20 0 "[ . 1 . 2]" 1
1158 1 39 LEU H 1 41 GLU H . . 4.700 4.176 3.968 4.329 . 0 0 "[ . 1 . 2]" 1
1159 1 39 LEU H 1 41 GLU HB2 . . 5.500 5.074 4.872 5.544 0.044 20 0 "[ . 1 . 2]" 1
1160 1 39 LEU H 1 43 LYS QD . . 5.280 5.215 5.012 5.360 0.080 12 0 "[ . 1 . 2]" 1
1161 1 39 LEU HA 1 39 LEU QD . . 2.850 2.115 2.044 2.305 . 0 0 "[ . 1 . 2]" 1
1162 1 39 LEU HA 1 39 LEU HG . . 3.480 3.066 2.778 3.246 . 0 0 "[ . 1 . 2]" 1
1163 1 39 LEU HA 1 41 GLU H . . 4.380 4.416 4.135 4.449 0.069 9 0 "[ . 1 . 2]" 1
1164 1 39 LEU HA 1 42 TRP H . . 3.910 3.721 3.551 3.909 . 0 0 "[ . 1 . 2]" 1
1165 1 39 LEU HA 1 42 TRP HB2 . . 5.500 3.157 2.822 3.552 . 0 0 "[ . 1 . 2]" 1
1166 1 39 LEU HA 1 42 TRP HD1 . . 3.960 3.489 3.044 4.002 0.042 13 0 "[ . 1 . 2]" 1
1167 1 39 LEU HA 1 43 LYS H . . 3.960 3.901 3.698 4.011 0.051 19 0 "[ . 1 . 2]" 1
1168 1 39 LEU HA 1 43 LYS QB . . 4.730 4.786 4.675 4.809 0.079 3 0 "[ . 1 . 2]" 1
1169 1 39 LEU HA 1 43 LYS HG2 . . 5.380 5.373 5.114 5.448 0.068 19 0 "[ . 1 . 2]" 1
1170 1 39 LEU HB2 1 40 ASN H . . 3.300 2.495 2.364 2.658 . 0 0 "[ . 1 . 2]" 1
1171 1 39 LEU HB2 1 40 ASN HA . . 5.500 4.375 4.238 4.460 . 0 0 "[ . 1 . 2]" 1
1172 1 39 LEU HB2 1 41 GLU H . . 5.130 5.037 4.827 5.175 0.045 8 0 "[ . 1 . 2]" 1
1173 1 39 LEU HB3 1 40 ASN H . . 3.640 3.424 3.243 3.575 . 0 0 "[ . 1 . 2]" 1
1174 1 39 LEU QD 1 42 TRP H . . 5.440 5.040 4.803 5.331 . 0 0 "[ . 1 . 2]" 1
1175 1 39 LEU QD 1 42 TRP HB2 . . 4.350 4.036 3.619 4.411 0.061 15 0 "[ . 1 . 2]" 1
1176 1 39 LEU MD1 1 40 ASN H . . 5.500 4.433 4.244 4.632 . 0 0 "[ . 1 . 2]" 1
1177 1 39 LEU MD2 1 40 ASN H . . 5.500 4.678 4.584 4.754 . 0 0 "[ . 1 . 2]" 1
1178 1 39 LEU HG 1 40 ASN H . . 4.520 4.422 4.293 4.546 0.026 8 0 "[ . 1 . 2]" 1
1179 1 40 ASN H 1 40 ASN QB . . 2.750 2.203 2.122 2.304 . 0 0 "[ . 1 . 2]" 1
1180 1 40 ASN H 1 40 ASN HD21 . . 4.300 2.839 2.369 3.917 . 0 0 "[ . 1 . 2]" 1
1181 1 40 ASN H 1 40 ASN HD22 . . 4.280 4.104 3.867 4.348 0.068 5 0 "[ . 1 . 2]" 1
1182 1 40 ASN H 1 41 GLU H . . 3.260 2.807 2.652 2.867 . 0 0 "[ . 1 . 2]" 1
1183 1 40 ASN H 1 41 GLU HA . . 5.500 5.414 5.257 5.472 . 0 0 "[ . 1 . 2]" 1
1184 1 40 ASN H 1 41 GLU HB2 . . 4.620 4.630 4.476 4.683 0.063 20 0 "[ . 1 . 2]" 1
1185 1 40 ASN H 1 42 TRP H . . 5.500 4.514 4.313 4.707 . 0 0 "[ . 1 . 2]" 1
1186 1 40 ASN H 1 43 LYS QB . . 4.820 4.551 4.335 4.744 . 0 0 "[ . 1 . 2]" 1
1187 1 40 ASN H 1 43 LYS QD . . 4.580 3.860 3.634 4.196 . 0 0 "[ . 1 . 2]" 1
1188 1 40 ASN HA 1 40 ASN QB . . 2.710 2.492 2.425 2.530 . 0 0 "[ . 1 . 2]" 1
1189 1 40 ASN HA 1 41 GLU HB2 . . 5.500 5.562 5.535 5.569 0.069 5 0 "[ . 1 . 2]" 1
1190 1 40 ASN HA 1 42 TRP H . . 5.500 4.808 4.587 4.976 . 0 0 "[ . 1 . 2]" 1
1191 1 40 ASN HA 1 43 LYS H . . 4.120 3.560 3.332 3.745 . 0 0 "[ . 1 . 2]" 1
1192 1 40 ASN HA 1 43 LYS QB . . 2.860 2.411 2.063 2.630 . 0 0 "[ . 1 . 2]" 1
1193 1 40 ASN HA 1 43 LYS QD . . 3.870 2.663 2.317 3.079 . 0 0 "[ . 1 . 2]" 1
1194 1 40 ASN HA 1 43 LYS QE . . 5.500 4.332 3.320 4.758 . 0 0 "[ . 1 . 2]" 1
1195 1 40 ASN HA 1 43 LYS HG2 . . 5.500 5.034 4.590 5.427 . 0 0 "[ . 1 . 2]" 1
1196 1 40 ASN HA 1 43 LYS HG3 . . 4.500 4.198 3.814 4.479 . 0 0 "[ . 1 . 2]" 1
1197 1 40 ASN QB 1 40 ASN HD21 . . 3.090 2.231 2.112 2.352 . 0 0 "[ . 1 . 2]" 1
1198 1 40 ASN QB 1 40 ASN HD22 . . 3.330 3.314 3.221 3.377 0.047 11 0 "[ . 1 . 2]" 1
1199 1 40 ASN QB 1 41 GLU H . . 3.160 2.779 2.673 2.922 . 0 0 "[ . 1 . 2]" 1
1200 1 40 ASN QB 1 41 GLU HA . . 5.500 3.961 3.837 4.076 . 0 0 "[ . 1 . 2]" 1
1201 1 40 ASN QB 1 42 TRP H . . 5.100 4.992 4.863 5.150 0.050 15 0 "[ . 1 . 2]" 1
1202 1 40 ASN QB 1 43 LYS H . . 5.500 4.983 4.817 5.085 . 0 0 "[ . 1 . 2]" 1
1203 1 40 ASN QB 1 43 LYS QB . . 5.500 4.328 3.927 4.572 . 0 0 "[ . 1 . 2]" 1
1204 1 40 ASN QB 1 44 TYR H . . 5.180 5.009 4.767 5.244 0.064 4 0 "[ . 1 . 2]" 1
1205 1 40 ASN QB 1 44 TYR QB . . 5.340 4.562 4.352 4.892 . 0 0 "[ . 1 . 2]" 1
1206 1 40 ASN HD21 1 41 GLU H . . 5.080 4.882 4.655 5.143 0.063 19 0 "[ . 1 . 2]" 1
1207 1 41 GLU H 1 41 GLU HB2 . . 2.970 2.075 2.042 2.107 . 0 0 "[ . 1 . 2]" 1
1208 1 41 GLU H 1 41 GLU HB3 . . 3.400 3.361 3.011 3.459 0.059 19 0 "[ . 1 . 2]" 1
1209 1 41 GLU H 1 42 TRP H . . 3.170 2.728 2.598 2.855 . 0 0 "[ . 1 . 2]" 1
1210 1 41 GLU H 1 42 TRP HB2 . . 5.260 4.986 4.490 5.162 . 0 0 "[ . 1 . 2]" 1
1211 1 41 GLU H 1 43 LYS H . . 4.210 3.974 3.784 4.143 . 0 0 "[ . 1 . 2]" 1
1212 1 41 GLU H 1 44 TYR H . . 4.660 4.701 4.627 4.737 0.077 7 0 "[ . 1 . 2]" 1
1213 1 41 GLU HA 1 41 GLU HB2 . . 2.910 2.944 2.760 2.983 0.073 4 0 "[ . 1 . 2]" 1
1214 1 41 GLU HA 1 44 TYR H . . 4.040 3.554 3.388 3.737 . 0 0 "[ . 1 . 2]" 1
1215 1 41 GLU HA 1 44 TYR HA . . 5.500 5.526 5.290 5.587 0.087 2 0 "[ . 1 . 2]" 1
1216 1 41 GLU HA 1 44 TYR HB2 . . 3.870 3.248 2.925 3.606 . 0 0 "[ . 1 . 2]" 1
1217 1 41 GLU HA 1 44 TYR HB3 . . 3.870 3.371 2.958 3.653 . 0 0 "[ . 1 . 2]" 1
1218 1 41 GLU HB2 1 42 TRP H . . 3.390 2.772 2.414 3.303 . 0 0 "[ . 1 . 2]" 1
1219 1 41 GLU HB2 1 42 TRP HZ3 . . 4.910 4.483 4.140 4.797 . 0 0 "[ . 1 . 2]" 1
1220 1 41 GLU HB3 1 42 TRP H . . 3.790 2.888 2.563 3.180 . 0 0 "[ . 1 . 2]" 1
1221 1 42 TRP H 1 42 TRP HB2 . . 3.500 2.598 2.323 2.709 . 0 0 "[ . 1 . 2]" 1
1222 1 42 TRP H 1 42 TRP HB3 . . 3.880 3.580 3.472 3.626 . 0 0 "[ . 1 . 2]" 1
1223 1 42 TRP H 1 43 LYS H . . 3.460 2.741 2.615 2.853 . 0 0 "[ . 1 . 2]" 1
1224 1 42 TRP H 1 43 LYS QB . . 4.620 4.569 4.429 4.688 0.068 15 0 "[ . 1 . 2]" 1
1225 1 42 TRP H 1 44 TYR H . . 4.440 4.117 4.024 4.204 . 0 0 "[ . 1 . 2]" 1
1226 1 42 TRP H 1 45 TYR H . . 5.370 5.302 5.090 5.445 0.075 4 0 "[ . 1 . 2]" 1
1227 1 42 TRP HA 1 45 TYR HB3 . . 5.500 5.331 5.036 5.563 0.063 5 0 "[ . 1 . 2]" 1
1228 1 42 TRP HB2 1 43 LYS H . . 3.530 2.827 2.616 3.026 . 0 0 "[ . 1 . 2]" 1
1229 1 42 TRP HB2 1 43 LYS HG3 . . 4.100 3.636 3.364 4.106 0.006 10 0 "[ . 1 . 2]" 1
1230 1 42 TRP HB2 1 49 LEU QD . . 4.750 3.929 3.587 4.628 . 0 0 "[ . 1 . 2]" 1
1231 1 42 TRP HB3 1 43 LYS H . . 4.150 3.927 3.707 4.099 . 0 0 "[ . 1 . 2]" 1
1232 1 42 TRP HB3 1 44 TYR H . . 5.500 5.550 5.484 5.571 0.071 1 0 "[ . 1 . 2]" 1
1233 1 42 TRP HB3 1 49 LEU MD1 . . 4.500 2.719 2.380 3.774 . 0 0 "[ . 1 . 2]" 1
1234 1 42 TRP HB3 1 49 LEU QD . . 3.890 2.645 2.358 3.515 . 0 0 "[ . 1 . 2]" 1
1235 1 42 TRP HB3 1 49 LEU MD2 . . 4.500 3.978 3.264 4.484 . 0 0 "[ . 1 . 2]" 1
1236 1 43 LYS H 1 43 LYS QB . . 2.830 2.229 2.114 2.346 . 0 0 "[ . 1 . 2]" 1
1237 1 43 LYS H 1 43 LYS QD . . 3.920 3.562 3.434 3.733 . 0 0 "[ . 1 . 2]" 1
1238 1 43 LYS H 1 43 LYS HG2 . . 3.730 3.793 3.751 3.806 0.076 10 0 "[ . 1 . 2]" 1
1239 1 43 LYS H 1 43 LYS HG3 . . 4.160 2.534 2.409 2.682 . 0 0 "[ . 1 . 2]" 1
1240 1 43 LYS H 1 44 TYR H . . 3.290 2.608 2.461 2.750 . 0 0 "[ . 1 . 2]" 1
1241 1 43 LYS H 1 44 TYR QB . . 5.340 4.369 4.218 4.485 . 0 0 "[ . 1 . 2]" 1
1242 1 43 LYS H 1 45 TYR H . . 5.500 4.534 4.227 4.943 . 0 0 "[ . 1 . 2]" 1
1243 1 43 LYS H 1 49 LEU QD . . 5.110 4.827 4.463 5.206 0.096 4 0 "[ . 1 . 2]" 1
1244 1 43 LYS HA 1 43 LYS QB . . 2.800 2.457 2.419 2.511 . 0 0 "[ . 1 . 2]" 1
1245 1 43 LYS HA 1 43 LYS QD . . 4.220 4.093 4.022 4.185 . 0 0 "[ . 1 . 2]" 1
1246 1 43 LYS HA 1 43 LYS HG2 . . 3.370 2.493 2.367 2.642 . 0 0 "[ . 1 . 2]" 1
1247 1 43 LYS HA 1 43 LYS HG3 . . 3.610 2.679 2.559 2.785 . 0 0 "[ . 1 . 2]" 1
1248 1 43 LYS HA 1 46 ARG H . . 3.780 3.416 3.066 3.818 0.038 10 0 "[ . 1 . 2]" 1
1249 1 43 LYS HA 1 46 ARG HA . . 5.500 4.137 3.694 4.607 . 0 0 "[ . 1 . 2]" 1
1250 1 43 LYS HA 1 46 ARG HB2 . . 4.010 3.578 3.203 3.925 . 0 0 "[ . 1 . 2]" 1
1251 1 43 LYS HA 1 46 ARG QB . . 3.290 2.215 1.984 2.496 . 0 0 "[ . 1 . 2]" 1
1252 1 43 LYS HA 1 46 ARG HB3 . . 4.010 2.237 1.995 2.530 . 0 0 "[ . 1 . 2]" 1
1253 1 43 LYS HA 1 46 ARG HD2 . . 4.690 3.755 3.073 4.348 . 0 0 "[ . 1 . 2]" 1
1254 1 43 LYS HA 1 46 ARG HD3 . . 4.970 4.201 3.788 4.558 . 0 0 "[ . 1 . 2]" 1
1255 1 43 LYS HA 1 46 ARG QG . . 5.500 4.062 3.909 4.238 . 0 0 "[ . 1 . 2]" 1
1256 1 43 LYS QB 1 43 LYS QD . . 3.120 2.247 2.072 2.366 . 0 0 "[ . 1 . 2]" 1
1257 1 43 LYS QB 1 43 LYS QE . . 3.590 2.687 2.019 3.676 0.086 1 0 "[ . 1 . 2]" 1
1258 1 43 LYS QB 1 44 TYR H . . 3.140 2.826 2.682 2.932 . 0 0 "[ . 1 . 2]" 1
1259 1 43 LYS QB 1 44 TYR QB . . 5.340 4.103 3.928 4.323 . 0 0 "[ . 1 . 2]" 1
1260 1 43 LYS QB 1 46 ARG HD2 . . 4.870 4.233 3.634 4.713 . 0 0 "[ . 1 . 2]" 1
1261 1 43 LYS QB 1 46 ARG HD3 . . 5.440 5.090 4.604 5.491 0.051 11 0 "[ . 1 . 2]" 1
1262 1 43 LYS QD 1 44 TYR H . . 4.940 4.990 4.772 5.025 0.085 15 0 "[ . 1 . 2]" 1
1263 1 43 LYS HG2 1 46 ARG QB . . 5.340 3.950 3.474 4.422 . 0 0 "[ . 1 . 2]" 1
1264 1 43 LYS HG3 1 44 TYR H . . 4.690 4.634 4.509 4.740 0.050 4 0 "[ . 1 . 2]" 1
1265 1 44 TYR H 1 44 TYR HB2 . . 3.090 2.389 2.231 2.639 . 0 0 "[ . 1 . 2]" 1
1266 1 44 TYR H 1 44 TYR HB3 . . 3.090 2.685 2.432 2.797 . 0 0 "[ . 1 . 2]" 1
1267 1 44 TYR H 1 45 TYR HB2 . . 5.500 5.043 4.892 5.343 . 0 0 "[ . 1 . 2]" 1
1268 1 44 TYR H 1 46 ARG H . . 4.460 4.092 3.867 4.384 . 0 0 "[ . 1 . 2]" 1
1269 1 44 TYR QB 1 45 TYR HB2 . . 5.340 4.084 3.828 4.406 . 0 0 "[ . 1 . 2]" 1
1270 1 44 TYR QB 1 46 ARG H . . 5.020 4.610 4.369 4.885 . 0 0 "[ . 1 . 2]" 1
1271 1 45 TYR H 1 45 TYR HB2 . . 3.820 2.404 2.243 2.576 . 0 0 "[ . 1 . 2]" 1
1272 1 45 TYR H 1 45 TYR HB3 . . 3.880 3.592 3.466 3.727 . 0 0 "[ . 1 . 2]" 1
1273 1 45 TYR H 1 46 ARG H . . 3.500 2.815 2.476 3.144 . 0 0 "[ . 1 . 2]" 1
1274 1 45 TYR H 1 46 ARG QB . . 5.340 4.513 4.055 4.848 . 0 0 "[ . 1 . 2]" 1
1275 1 45 TYR H 1 48 ASP H . . 5.500 5.565 5.520 5.583 0.083 13 0 "[ . 1 . 2]" 1
1276 1 45 TYR HA 1 46 ARG HD3 . . 4.860 4.190 3.734 4.349 . 0 0 "[ . 1 . 2]" 1
1277 1 45 TYR HA 1 47 GLN H . . 4.690 3.689 3.348 3.965 . 0 0 "[ . 1 . 2]" 1
1278 1 45 TYR HB2 1 46 ARG H . . 4.460 4.151 4.032 4.241 . 0 0 "[ . 1 . 2]" 1
1279 1 45 TYR HB2 1 48 ASP HB2 . . 4.690 4.638 4.369 4.766 0.076 16 0 "[ . 1 . 2]" 1
1280 1 45 TYR HB2 1 49 LEU MD1 . . 4.780 2.700 2.217 3.234 . 0 0 "[ . 1 . 2]" 1
1281 1 45 TYR HB2 1 49 LEU QD . . 3.890 2.682 2.213 3.189 . 0 0 "[ . 1 . 2]" 1
1282 1 45 TYR HB2 1 49 LEU MD2 . . 4.780 4.854 4.749 4.932 0.152 2 0 "[ . 1 . 2]" 1
1283 1 45 TYR HB2 1 49 LEU HG . . 5.500 4.048 3.674 4.692 . 0 0 "[ . 1 . 2]" 1
1284 1 45 TYR HB3 1 48 ASP H . . 4.300 3.635 3.323 3.909 . 0 0 "[ . 1 . 2]" 1
1285 1 45 TYR HB3 1 48 ASP HB2 . . 4.540 2.951 2.699 3.114 . 0 0 "[ . 1 . 2]" 1
1286 1 45 TYR HB3 1 48 ASP HB3 . . 3.730 2.386 2.230 2.737 . 0 0 "[ . 1 . 2]" 1
1287 1 45 TYR HB3 1 49 LEU H . . 4.330 3.458 3.278 3.650 . 0 0 "[ . 1 . 2]" 1
1288 1 45 TYR HB3 1 49 LEU QD . . 3.830 3.170 2.239 3.855 0.025 8 0 "[ . 1 . 2]" 1
1289 1 45 TYR HB3 1 49 LEU HG . . 4.220 3.938 3.443 4.286 0.066 9 0 "[ . 1 . 2]" 1
1290 1 46 ARG H 1 46 ARG HB2 . . 3.590 3.551 3.472 3.626 0.036 1 0 "[ . 1 . 2]" 1
1291 1 46 ARG H 1 46 ARG QB . . 3.020 2.300 2.169 2.406 . 0 0 "[ . 1 . 2]" 1
1292 1 46 ARG H 1 46 ARG HB3 . . 3.590 2.330 2.190 2.442 . 0 0 "[ . 1 . 2]" 1
1293 1 46 ARG H 1 46 ARG HD2 . . 4.360 3.321 3.052 3.657 . 0 0 "[ . 1 . 2]" 1
1294 1 46 ARG H 1 46 ARG HD3 . . 4.350 2.145 1.958 2.383 . 0 0 "[ . 1 . 2]" 1
1295 1 46 ARG H 1 46 ARG QG . . 3.610 3.612 3.507 3.675 0.065 9 0 "[ . 1 . 2]" 1
1296 1 46 ARG H 1 47 GLN H . . 3.750 2.974 2.762 3.181 . 0 0 "[ . 1 . 2]" 1
1297 1 46 ARG H 1 47 GLN QB . . 5.050 4.696 4.421 5.010 . 0 0 "[ . 1 . 2]" 1
1298 1 46 ARG H 1 49 LEU HB2 . . 4.750 4.727 4.600 4.799 0.049 17 0 "[ . 1 . 2]" 1
1299 1 46 ARG H 1 50 ILE MD . . 5.080 5.162 5.085 5.174 0.094 6 0 "[ . 1 . 2]" 1
1300 1 46 ARG HA 1 46 ARG HD2 . . 5.010 4.762 4.591 4.948 . 0 0 "[ . 1 . 2]" 1
1301 1 46 ARG HA 1 46 ARG HD3 . . 4.120 3.848 3.753 3.974 . 0 0 "[ . 1 . 2]" 1
1302 1 46 ARG HA 1 46 ARG QG . . 3.360 3.426 3.342 3.439 0.079 6 0 "[ . 1 . 2]" 1
1303 1 46 ARG HA 1 49 LEU H . . 4.230 3.595 3.452 3.726 . 0 0 "[ . 1 . 2]" 1
1304 1 46 ARG HA 1 49 LEU HB2 . . 3.910 2.417 2.314 2.523 . 0 0 "[ . 1 . 2]" 1
1305 1 46 ARG HA 1 49 LEU HB3 . . 4.470 3.871 3.746 4.020 . 0 0 "[ . 1 . 2]" 1
1306 1 46 ARG HA 1 49 LEU QD . . 3.480 2.523 2.285 2.798 . 0 0 "[ . 1 . 2]" 1
1307 1 46 ARG HA 1 49 LEU HG . . 4.990 4.632 4.164 5.053 0.063 13 0 "[ . 1 . 2]" 1
1308 1 46 ARG HA 1 50 ILE H . . 3.730 3.655 3.550 3.731 0.001 14 0 "[ . 1 . 2]" 1
1309 1 46 ARG QB 1 46 ARG HD2 . . 3.270 2.570 2.428 2.742 . 0 0 "[ . 1 . 2]" 1
1310 1 46 ARG QB 1 46 ARG HD3 . . 3.280 2.553 2.463 2.708 . 0 0 "[ . 1 . 2]" 1
1311 1 46 ARG QB 1 47 GLN H . . 3.620 3.559 3.432 3.610 . 0 0 "[ . 1 . 2]" 1
1312 1 46 ARG QB 1 49 LEU HB2 . . 5.340 4.077 3.939 4.274 . 0 0 "[ . 1 . 2]" 1
1313 1 46 ARG HB2 1 46 ARG HD2 . . 3.760 3.673 3.584 3.758 . 0 0 "[ . 1 . 2]" 1
1314 1 46 ARG HB2 1 46 ARG HD3 . . 3.740 3.584 3.523 3.660 . 0 0 "[ . 1 . 2]" 1
1315 1 46 ARG HB2 1 47 GLN H . . 4.300 4.097 4.032 4.160 . 0 0 "[ . 1 . 2]" 1
1316 1 46 ARG HB3 1 46 ARG HD2 . . 3.760 2.624 2.469 2.818 . 0 0 "[ . 1 . 2]" 1
1317 1 46 ARG HB3 1 46 ARG HD3 . . 3.740 2.614 2.514 2.793 . 0 0 "[ . 1 . 2]" 1
1318 1 46 ARG HB3 1 47 GLN H . . 4.300 3.911 3.693 4.021 . 0 0 "[ . 1 . 2]" 1
1319 1 46 ARG HD2 1 47 GLN H . . 4.560 3.857 3.570 4.016 . 0 0 "[ . 1 . 2]" 1
1320 1 46 ARG HD3 1 47 GLN H . . 4.730 2.268 1.905 2.515 . 0 0 "[ . 1 . 2]" 1
1321 1 46 ARG HD3 1 50 ILE MD . . 4.480 4.520 4.394 4.566 0.086 1 0 "[ . 1 . 2]" 1
1322 1 46 ARG QG 1 47 GLN H . . 3.650 2.678 2.542 2.796 . 0 0 "[ . 1 . 2]" 1
1323 1 46 ARG QG 1 50 ILE H . . 4.660 4.713 4.613 4.744 0.084 1 0 "[ . 1 . 2]" 1
1324 1 46 ARG QG 1 50 ILE HB . . 4.620 4.502 4.376 4.639 0.019 5 0 "[ . 1 . 2]" 1
1325 1 46 ARG QG 1 50 ILE MD . . 3.150 2.279 2.211 2.393 . 0 0 "[ . 1 . 2]" 1
1326 1 47 GLN H 1 47 GLN QB . . 2.870 2.181 2.032 2.260 . 0 0 "[ . 1 . 2]" 1
1327 1 47 GLN H 1 48 ASP H . . 3.230 2.648 2.497 2.787 . 0 0 "[ . 1 . 2]" 1
1328 1 47 GLN H 1 48 ASP HA . . 5.500 5.264 5.150 5.391 . 0 0 "[ . 1 . 2]" 1
1329 1 47 GLN H 1 48 ASP HB2 . . 4.980 4.665 4.284 5.008 0.028 4 0 "[ . 1 . 2]" 1
1330 1 47 GLN H 1 48 ASP HB3 . . 5.500 5.298 5.027 5.555 0.055 4 0 "[ . 1 . 2]" 1
1331 1 47 GLN H 1 49 LEU H . . 5.500 4.113 3.872 4.243 . 0 0 "[ . 1 . 2]" 1
1332 1 47 GLN H 1 50 ILE H . . 4.840 4.771 4.644 4.894 0.054 19 0 "[ . 1 . 2]" 1
1333 1 47 GLN H 1 50 ILE MD . . 4.160 3.786 3.626 4.001 . 0 0 "[ . 1 . 2]" 1
1334 1 47 GLN QB 1 48 ASP H . . 3.290 2.714 2.457 2.990 . 0 0 "[ . 1 . 2]" 1
1335 1 47 GLN QB 1 48 ASP HA . . 5.340 4.105 3.876 4.433 . 0 0 "[ . 1 . 2]" 1
1336 1 47 GLN QB 1 49 LEU H . . 5.340 4.740 4.540 4.969 . 0 0 "[ . 1 . 2]" 1
1337 1 47 GLN QB 1 50 ILE HB . . 5.340 4.695 4.256 5.040 . 0 0 "[ . 1 . 2]" 1
1338 1 47 GLN QE 1 50 ILE MD . . 3.810 3.422 3.090 3.821 0.011 12 0 "[ . 1 . 2]" 1
1339 1 47 GLN QE 1 50 ILE MG . . 3.400 2.928 2.276 3.464 0.064 3 0 "[ . 1 . 2]" 1
1340 1 47 GLN QE 1 51 ASP H . . 4.050 3.383 2.616 3.822 . 0 0 "[ . 1 . 2]" 1
1341 1 47 GLN HE21 1 50 ILE HB . . 4.050 3.410 2.776 3.973 . 0 0 "[ . 1 . 2]" 1
1342 1 47 GLN HE21 1 50 ILE MD . . 4.520 3.912 3.305 4.587 0.067 4 0 "[ . 1 . 2]" 1
1343 1 47 GLN HE21 1 50 ILE MG . . 3.890 3.445 2.387 3.964 0.074 8 0 "[ . 1 . 2]" 1
1344 1 47 GLN HE21 1 51 ASP H . . 4.730 3.788 2.735 4.781 0.051 3 0 "[ . 1 . 2]" 1
1345 1 47 GLN HE22 1 50 ILE HB . . 4.050 3.669 3.131 4.080 0.030 3 0 "[ . 1 . 2]" 1
1346 1 47 GLN HE22 1 50 ILE MD . . 4.520 4.063 3.191 4.607 0.087 19 0 "[ . 1 . 2]" 1
1347 1 47 GLN HE22 1 50 ILE MG . . 3.890 3.249 2.729 3.968 0.078 5 0 "[ . 1 . 2]" 1
1348 1 47 GLN HE22 1 51 ASP H . . 4.730 4.092 3.088 4.793 0.063 16 0 "[ . 1 . 2]" 1
1349 1 48 ASP H 1 48 ASP HB2 . . 3.580 2.213 2.044 2.439 . 0 0 "[ . 1 . 2]" 1
1350 1 48 ASP H 1 48 ASP HB3 . . 3.210 2.872 2.585 3.050 . 0 0 "[ . 1 . 2]" 1
1351 1 48 ASP H 1 49 LEU H . . 3.510 2.518 2.384 2.636 . 0 0 "[ . 1 . 2]" 1
1352 1 48 ASP H 1 49 LEU HB2 . . 4.990 4.384 4.216 4.543 . 0 0 "[ . 1 . 2]" 1
1353 1 48 ASP H 1 49 LEU QD . . 4.500 4.470 3.910 4.604 0.104 6 0 "[ . 1 . 2]" 1
1354 1 48 ASP H 1 50 ILE H . . 4.630 4.438 4.254 4.666 0.036 19 0 "[ . 1 . 2]" 1
1355 1 48 ASP HA 1 51 ASP HB2 . . 3.650 3.454 2.896 3.697 0.047 9 0 "[ . 1 . 2]" 1
1356 1 48 ASP HA 1 51 ASP HB3 . . 3.910 3.636 3.204 3.958 0.048 12 0 "[ . 1 . 2]" 1
1357 1 48 ASP HA 1 52 PHE H . . 4.950 4.999 4.917 5.022 0.072 12 0 "[ . 1 . 2]" 1
1358 1 48 ASP HB2 1 49 LEU H . . 3.740 3.427 3.246 3.710 . 0 0 "[ . 1 . 2]" 1
1359 1 48 ASP HB3 1 49 LEU H . . 3.760 2.529 2.363 2.882 . 0 0 "[ . 1 . 2]" 1
1360 1 48 ASP HB3 1 49 LEU QD . . 5.440 3.910 3.176 4.351 . 0 0 "[ . 1 . 2]" 1
1361 1 48 ASP HB3 1 50 ILE H . . 5.500 5.379 5.269 5.486 . 0 0 "[ . 1 . 2]" 1
1362 1 49 LEU H 1 49 LEU HB2 . . 3.490 2.282 2.171 2.361 . 0 0 "[ . 1 . 2]" 1
1363 1 49 LEU H 1 49 LEU HB3 . . 3.560 3.536 3.484 3.569 0.009 5 0 "[ . 1 . 2]" 1
1364 1 49 LEU H 1 49 LEU MD1 . . 4.400 3.116 2.588 3.397 . 0 0 "[ . 1 . 2]" 1
1365 1 49 LEU H 1 49 LEU QD . . 3.500 3.022 2.567 3.227 . 0 0 "[ . 1 . 2]" 1
1366 1 49 LEU H 1 49 LEU MD2 . . 4.400 4.178 3.964 4.401 0.001 20 0 "[ . 1 . 2]" 1
1367 1 49 LEU H 1 49 LEU HG . . 4.250 3.102 2.736 3.573 . 0 0 "[ . 1 . 2]" 1
1368 1 49 LEU H 1 50 ILE H . . 3.580 2.945 2.639 3.106 . 0 0 "[ . 1 . 2]" 1
1369 1 49 LEU H 1 50 ILE HB . . 4.890 4.788 4.574 4.946 0.056 19 0 "[ . 1 . 2]" 1
1370 1 49 LEU H 1 50 ILE MD . . 5.080 4.964 4.735 5.136 0.056 12 0 "[ . 1 . 2]" 1
1371 1 49 LEU H 1 50 ILE HG13 . . 5.500 5.028 4.746 5.198 . 0 0 "[ . 1 . 2]" 1
1372 1 49 LEU H 1 51 ASP HB2 . . 5.500 5.472 5.009 5.568 0.068 3 0 "[ . 1 . 2]" 1
1373 1 49 LEU H 1 53 LEU QD . . 5.380 4.890 4.760 5.036 . 0 0 "[ . 1 . 2]" 1
1374 1 49 LEU HA 1 49 LEU QD . . 3.030 2.550 2.277 2.901 . 0 0 "[ . 1 . 2]" 1
1375 1 49 LEU HA 1 49 LEU HG . . 3.710 2.398 2.141 2.615 . 0 0 "[ . 1 . 2]" 1
1376 1 49 LEU HA 1 52 PHE H . . 3.790 3.800 3.539 3.854 0.064 12 0 "[ . 1 . 2]" 1
1377 1 49 LEU HA 1 52 PHE QB . . 3.850 3.391 3.132 3.606 . 0 0 "[ . 1 . 2]" 1
1378 1 49 LEU HA 1 53 LEU QD . . 5.440 3.341 2.983 3.858 . 0 0 "[ . 1 . 2]" 1
1379 1 49 LEU HA 1 53 LEU HG . . 5.500 3.592 3.484 3.798 . 0 0 "[ . 1 . 2]" 1
1380 1 49 LEU HB2 1 50 ILE H . . 3.740 2.399 2.269 2.571 . 0 0 "[ . 1 . 2]" 1
1381 1 49 LEU HB2 1 50 ILE HA . . 4.770 4.568 4.431 4.676 . 0 0 "[ . 1 . 2]" 1
1382 1 49 LEU HB2 1 53 LEU QD . . 5.030 3.647 3.492 3.859 . 0 0 "[ . 1 . 2]" 1
1383 1 49 LEU HB3 1 49 LEU MD1 . . 3.450 2.786 2.594 3.074 . 0 0 "[ . 1 . 2]" 1
1384 1 49 LEU HB3 1 49 LEU QD . . 3.020 2.088 1.886 2.128 . 0 0 "[ . 1 . 2]" 1
1385 1 49 LEU HB3 1 49 LEU MD2 . . 3.450 2.167 1.913 2.238 . 0 0 "[ . 1 . 2]" 1
1386 1 49 LEU HB3 1 50 ILE H . . 3.740 2.796 2.618 3.023 . 0 0 "[ . 1 . 2]" 1
1387 1 49 LEU HB3 1 50 ILE HA . . 4.120 3.873 3.768 3.965 . 0 0 "[ . 1 . 2]" 1
1388 1 49 LEU HB3 1 51 ASP H . . 5.500 5.303 5.186 5.392 . 0 0 "[ . 1 . 2]" 1
1389 1 49 LEU HB3 1 52 PHE H . . 5.370 5.342 5.184 5.425 0.055 8 0 "[ . 1 . 2]" 1
1390 1 49 LEU HB3 1 53 LEU QD . . 3.640 2.386 2.249 2.605 . 0 0 "[ . 1 . 2]" 1
1391 1 49 LEU QD 1 50 ILE H . . 4.690 3.836 3.741 3.910 . 0 0 "[ . 1 . 2]" 1
1392 1 49 LEU QD 1 52 PHE QB . . 4.310 4.309 4.087 4.439 0.129 14 0 "[ . 1 . 2]" 1
1393 1 49 LEU QD 1 53 LEU QD . . 3.870 2.147 1.970 2.575 . 0 0 "[ . 1 . 2]" 1
1394 1 50 ILE H 1 50 ILE HB . . 3.220 2.476 2.401 2.536 . 0 0 "[ . 1 . 2]" 1
1395 1 50 ILE H 1 50 ILE MD . . 3.270 3.209 3.131 3.284 0.014 10 0 "[ . 1 . 2]" 1
1396 1 50 ILE H 1 50 ILE HG12 . . 4.380 3.750 3.652 3.848 . 0 0 "[ . 1 . 2]" 1
1397 1 50 ILE H 1 50 ILE HG13 . . 3.430 2.313 2.198 2.440 . 0 0 "[ . 1 . 2]" 1
1398 1 50 ILE H 1 52 PHE H . . 5.140 4.588 4.401 4.764 . 0 0 "[ . 1 . 2]" 1
1399 1 50 ILE H 1 53 LEU QD . . 4.620 3.666 3.193 3.994 . 0 0 "[ . 1 . 2]" 1
1400 1 50 ILE HA 1 50 ILE MD . . 3.840 3.903 3.798 3.932 0.092 16 0 "[ . 1 . 2]" 1
1401 1 50 ILE HA 1 50 ILE HG12 . . 3.040 2.841 2.757 2.893 . 0 0 "[ . 1 . 2]" 1
1402 1 50 ILE HA 1 50 ILE HG13 . . 3.860 2.617 2.494 2.705 . 0 0 "[ . 1 . 2]" 1
1403 1 50 ILE HA 1 50 ILE MG . . 2.680 2.568 2.444 2.686 0.006 7 0 "[ . 1 . 2]" 1
1404 1 50 ILE HA 1 52 PHE H . . 4.560 4.330 4.096 4.540 . 0 0 "[ . 1 . 2]" 1
1405 1 50 ILE HA 1 53 LEU H . . 3.970 3.148 3.057 3.267 . 0 0 "[ . 1 . 2]" 1
1406 1 50 ILE HA 1 53 LEU HA . . 4.950 4.824 4.664 4.925 . 0 0 "[ . 1 . 2]" 1
1407 1 50 ILE HA 1 53 LEU HB2 . . 3.090 2.092 1.974 2.158 . 0 0 "[ . 1 . 2]" 1
1408 1 50 ILE HA 1 53 LEU HB3 . . 4.030 3.657 3.482 3.760 . 0 0 "[ . 1 . 2]" 1
1409 1 50 ILE HA 1 53 LEU MD1 . . 3.960 2.825 2.072 3.257 . 0 0 "[ . 1 . 2]" 1
1410 1 50 ILE HA 1 53 LEU QD . . 3.390 2.760 2.066 3.126 . 0 0 "[ . 1 . 2]" 1
1411 1 50 ILE HA 1 53 LEU MD2 . . 3.960 4.050 3.939 4.079 0.119 3 0 "[ . 1 . 2]" 1
1412 1 50 ILE HA 1 54 GLN H . . 4.160 3.657 3.541 3.783 . 0 0 "[ . 1 . 2]" 1
1413 1 50 ILE HA 1 54 GLN HG2 . . 4.670 3.840 3.610 4.029 . 0 0 "[ . 1 . 2]" 1
1414 1 50 ILE HA 1 54 GLN HG3 . . 4.390 4.445 4.326 4.468 0.078 1 0 "[ . 1 . 2]" 1
1415 1 50 ILE HB 1 50 ILE MD . . 3.040 2.248 2.131 2.311 . 0 0 "[ . 1 . 2]" 1
1416 1 50 ILE HB 1 51 ASP H . . 3.140 2.604 2.501 2.682 . 0 0 "[ . 1 . 2]" 1
1417 1 50 ILE HB 1 51 ASP HB2 . . 5.500 4.335 4.185 4.447 . 0 0 "[ . 1 . 2]" 1
1418 1 50 ILE MD 1 53 LEU QD . . 5.090 4.485 4.067 4.773 . 0 0 "[ . 1 . 2]" 1
1419 1 50 ILE HG12 1 50 ILE MG . . 3.420 2.274 2.148 2.352 . 0 0 "[ . 1 . 2]" 1
1420 1 50 ILE HG13 1 53 LEU HB3 . . 5.500 5.568 5.563 5.576 0.076 19 0 "[ . 1 . 2]" 1
1421 1 50 ILE HG13 1 53 LEU QD . . 5.440 3.351 2.758 3.797 . 0 0 "[ . 1 . 2]" 1
1422 1 50 ILE MG 1 51 ASP H . . 3.200 3.076 2.926 3.181 . 0 0 "[ . 1 . 2]" 1
1423 1 50 ILE MG 1 51 ASP HA . . 3.460 3.101 2.961 3.256 . 0 0 "[ . 1 . 2]" 1
1424 1 50 ILE MG 1 51 ASP HB2 . . 4.640 4.220 3.969 4.402 . 0 0 "[ . 1 . 2]" 1
1425 1 50 ILE MG 1 53 LEU H . . 4.400 4.481 4.458 4.492 0.092 9 0 "[ . 1 . 2]" 1
1426 1 50 ILE MG 1 53 LEU QD . . 5.440 4.181 3.763 4.415 . 0 0 "[ . 1 . 2]" 1
1427 1 50 ILE MG 1 54 GLN H . . 3.600 3.660 3.431 3.688 0.088 1 0 "[ . 1 . 2]" 1
1428 1 50 ILE MG 1 54 GLN HB3 . . 4.800 4.751 4.545 4.852 0.052 9 0 "[ . 1 . 2]" 1
1429 1 50 ILE MG 1 54 GLN HE21 . . 3.930 2.040 1.839 2.717 . 0 0 "[ . 1 . 2]" 1
1430 1 50 ILE MG 1 54 GLN HE22 . . 3.970 3.295 3.074 3.487 . 0 0 "[ . 1 . 2]" 1
1431 1 50 ILE MG 1 54 GLN HG2 . . 3.400 2.447 2.334 2.538 . 0 0 "[ . 1 . 2]" 1
1432 1 50 ILE MG 1 54 GLN HG3 . . 4.030 2.690 2.436 2.811 . 0 0 "[ . 1 . 2]" 1
1433 1 51 ASP H 1 51 ASP HB2 . . 3.140 2.163 2.034 2.251 . 0 0 "[ . 1 . 2]" 1
1434 1 51 ASP H 1 51 ASP HB3 . . 3.100 2.782 2.425 3.085 . 0 0 "[ . 1 . 2]" 1
1435 1 51 ASP H 1 52 PHE H . . 3.380 2.943 2.855 3.030 . 0 0 "[ . 1 . 2]" 1
1436 1 51 ASP H 1 52 PHE QB . . 5.180 4.764 4.543 4.948 . 0 0 "[ . 1 . 2]" 1
1437 1 51 ASP H 1 53 LEU H . . 4.070 4.079 4.004 4.134 0.064 14 0 "[ . 1 . 2]" 1
1438 1 51 ASP HA 1 51 ASP HB2 . . 2.790 2.616 2.471 2.752 . 0 0 "[ . 1 . 2]" 1
1439 1 51 ASP HA 1 54 GLN H . . 5.500 4.168 3.861 4.423 . 0 0 "[ . 1 . 2]" 1
1440 1 51 ASP HA 1 54 GLN HB2 . . 4.220 4.127 3.876 4.280 0.060 19 0 "[ . 1 . 2]" 1
1441 1 51 ASP HA 1 54 GLN HE21 . . 5.190 5.236 5.119 5.268 0.078 13 0 "[ . 1 . 2]" 1
1442 1 51 ASP HA 1 54 GLN HG2 . . 4.320 4.357 3.968 4.394 0.074 14 0 "[ . 1 . 2]" 1
1443 1 51 ASP HA 1 54 GLN HG3 . . 5.500 2.913 2.372 3.194 . 0 0 "[ . 1 . 2]" 1
1444 1 51 ASP HB2 1 52 PHE H . . 3.800 3.660 3.293 3.825 0.025 11 0 "[ . 1 . 2]" 1
1445 1 51 ASP HB2 1 53 LEU H . . 5.500 5.531 5.266 5.567 0.067 11 0 "[ . 1 . 2]" 1
1446 1 51 ASP HB3 1 52 PHE H . . 3.400 2.538 2.296 2.819 . 0 0 "[ . 1 . 2]" 1
1447 1 52 PHE H 1 52 PHE HB2 . . 3.550 2.261 2.044 2.505 . 0 0 "[ . 1 . 2]" 1
1448 1 52 PHE H 1 52 PHE QB . . 2.950 2.193 2.021 2.304 . 0 0 "[ . 1 . 2]" 1
1449 1 52 PHE H 1 52 PHE HB3 . . 3.550 3.281 2.365 3.592 0.042 12 0 "[ . 1 . 2]" 1
1450 1 52 PHE H 1 53 LEU H . . 3.430 2.363 2.209 2.558 . 0 0 "[ . 1 . 2]" 1
1451 1 52 PHE H 1 53 LEU HA . . 5.230 5.033 4.876 5.207 . 0 0 "[ . 1 . 2]" 1
1452 1 52 PHE H 1 53 LEU HB2 . . 4.840 4.686 4.488 4.889 0.049 20 0 "[ . 1 . 2]" 1
1453 1 52 PHE H 1 53 LEU QD . . 4.320 4.030 3.765 4.408 0.088 7 0 "[ . 1 . 2]" 1
1454 1 52 PHE H 1 53 LEU HG . . 5.500 4.195 3.978 4.493 . 0 0 "[ . 1 . 2]" 1
1455 1 52 PHE H 1 54 GLN H . . 5.500 4.193 4.053 4.419 . 0 0 "[ . 1 . 2]" 1
1456 1 52 PHE HA 1 53 LEU QD . . 5.440 4.790 4.523 5.295 . 0 0 "[ . 1 . 2]" 1
1457 1 52 PHE QB 1 53 LEU QD . . 3.820 2.964 2.661 3.721 . 0 0 "[ . 1 . 2]" 1
1458 1 52 PHE QB 1 53 LEU HG . . 5.200 4.110 3.660 4.468 . 0 0 "[ . 1 . 2]" 1
1459 1 52 PHE HB2 1 53 LEU H . . 3.800 3.110 2.787 3.856 0.056 9 0 "[ . 1 . 2]" 1
1460 1 52 PHE HB3 1 53 LEU H . . 3.800 3.316 2.665 3.703 . 0 0 "[ . 1 . 2]" 1
1461 1 53 LEU H 1 53 LEU HB2 . . 3.190 2.593 2.497 2.664 . 0 0 "[ . 1 . 2]" 1
1462 1 53 LEU H 1 53 LEU HB3 . . 3.790 3.660 3.586 3.700 . 0 0 "[ . 1 . 2]" 1
1463 1 53 LEU H 1 53 LEU MD1 . . 4.670 3.919 3.706 4.035 . 0 0 "[ . 1 . 2]" 1
1464 1 53 LEU H 1 53 LEU QD . . 3.360 2.600 2.210 3.074 . 0 0 "[ . 1 . 2]" 1
1465 1 53 LEU H 1 53 LEU MD2 . . 4.670 2.651 2.222 3.281 . 0 0 "[ . 1 . 2]" 1
1466 1 53 LEU H 1 53 LEU HG . . 3.580 2.502 2.261 2.768 . 0 0 "[ . 1 . 2]" 1
1467 1 53 LEU H 1 54 GLN H . . 3.380 2.747 2.669 2.826 . 0 0 "[ . 1 . 2]" 1
1468 1 53 LEU H 1 54 GLN HB2 . . 5.500 5.024 4.638 5.314 . 0 0 "[ . 1 . 2]" 1
1469 1 53 LEU H 1 55 GLN H . . 4.610 4.236 4.081 4.455 . 0 0 "[ . 1 . 2]" 1
1470 1 53 LEU H 1 55 GLN QB . . 5.500 5.340 5.102 5.538 0.038 5 0 "[ . 1 . 2]" 1
1471 1 53 LEU H 1 56 LEU H . . 5.390 4.688 4.572 4.900 . 0 0 "[ . 1 . 2]" 1
1472 1 53 LEU H 1 56 LEU MD1 . . 4.180 4.191 3.978 4.254 0.074 9 0 "[ . 1 . 2]" 1
1473 1 53 LEU HA 1 53 LEU MD1 . . 3.630 3.640 3.417 3.734 0.104 16 0 "[ . 1 . 2]" 1
1474 1 53 LEU HA 1 53 LEU QD . . 2.580 2.116 1.893 2.215 . 0 0 "[ . 1 . 2]" 1
1475 1 53 LEU HA 1 53 LEU MD2 . . 3.630 2.131 1.901 2.235 . 0 0 "[ . 1 . 2]" 1
1476 1 53 LEU HA 1 53 LEU HG . . 3.950 3.457 3.047 3.659 . 0 0 "[ . 1 . 2]" 1
1477 1 53 LEU HA 1 55 GLN H . . 4.800 4.229 3.907 4.524 . 0 0 "[ . 1 . 2]" 1
1478 1 53 LEU HA 1 55 GLN QG . . 5.500 5.541 5.336 5.586 0.086 6 0 "[ . 1 . 2]" 1
1479 1 53 LEU HA 1 56 LEU H . . 3.720 3.152 2.930 3.297 . 0 0 "[ . 1 . 2]" 1
1480 1 53 LEU HA 1 56 LEU HB2 . . 4.090 2.164 2.052 2.241 . 0 0 "[ . 1 . 2]" 1
1481 1 53 LEU HA 1 56 LEU HB3 . . 3.670 3.603 3.329 3.727 0.057 9 0 "[ . 1 . 2]" 1
1482 1 53 LEU HA 1 56 LEU MD1 . . 5.500 3.013 2.762 3.406 . 0 0 "[ . 1 . 2]" 1
1483 1 53 LEU HA 1 56 LEU MD2 . . 3.710 3.153 2.780 3.767 0.057 4 0 "[ . 1 . 2]" 1
1484 1 53 LEU HA 1 56 LEU HG . . 4.930 4.927 4.743 5.001 0.071 19 0 "[ . 1 . 2]" 1
1485 1 53 LEU HB2 1 53 LEU MD1 . . 3.480 2.569 2.414 2.674 . 0 0 "[ . 1 . 2]" 1
1486 1 53 LEU HB2 1 53 LEU MD2 . . 3.480 3.203 3.100 3.244 . 0 0 "[ . 1 . 2]" 1
1487 1 53 LEU HB2 1 54 GLN H . . 3.380 2.627 2.476 2.737 . 0 0 "[ . 1 . 2]" 1
1488 1 53 LEU HB2 1 56 LEU H . . 5.500 5.323 5.168 5.436 . 0 0 "[ . 1 . 2]" 1
1489 1 53 LEU HB2 1 56 LEU HB2 . . 5.140 5.022 4.848 5.120 . 0 0 "[ . 1 . 2]" 1
1490 1 53 LEU HB3 1 53 LEU MD1 . . 3.350 2.237 2.112 2.323 . 0 0 "[ . 1 . 2]" 1
1491 1 53 LEU HB3 1 53 LEU QD . . 2.820 2.131 2.067 2.170 . 0 0 "[ . 1 . 2]" 1
1492 1 53 LEU HB3 1 53 LEU MD2 . . 3.350 2.719 2.392 2.941 . 0 0 "[ . 1 . 2]" 1
1493 1 53 LEU HB3 1 54 GLN H . . 3.780 3.675 3.502 3.797 0.017 13 0 "[ . 1 . 2]" 1
1494 1 53 LEU QD 1 54 GLN H . . 4.040 4.094 3.957 4.133 0.093 20 0 "[ . 1 . 2]" 1
1495 1 53 LEU QD 1 56 LEU H . . 4.580 4.507 4.356 4.647 0.067 5 0 "[ . 1 . 2]" 1
1496 1 53 LEU QD 1 56 LEU HB2 . . 4.490 3.370 3.163 3.588 . 0 0 "[ . 1 . 2]" 1
1497 1 53 LEU QD 1 56 LEU MD2 . . 5.440 2.629 2.339 3.296 . 0 0 "[ . 1 . 2]" 1
1498 1 53 LEU MD1 1 54 GLN H . . 4.790 4.769 4.523 4.859 0.069 1 0 "[ . 1 . 2]" 1
1499 1 53 LEU MD2 1 54 GLN H . . 4.790 4.465 4.248 4.608 . 0 0 "[ . 1 . 2]" 1
1500 1 53 LEU HG 1 54 GLN H . . 4.600 4.358 4.272 4.482 . 0 0 "[ . 1 . 2]" 1
1501 1 54 GLN H 1 54 GLN HB2 . . 3.090 2.628 2.338 2.814 . 0 0 "[ . 1 . 2]" 1
1502 1 54 GLN H 1 54 GLN HB3 . . 3.590 3.597 3.521 3.637 0.047 15 0 "[ . 1 . 2]" 1
1503 1 54 GLN H 1 54 GLN HG2 . . 3.450 2.286 2.159 2.378 . 0 0 "[ . 1 . 2]" 1
1504 1 54 GLN H 1 54 GLN HG3 . . 3.500 2.649 2.455 2.902 . 0 0 "[ . 1 . 2]" 1
1505 1 54 GLN H 1 55 GLN H . . 3.200 2.691 2.606 2.772 . 0 0 "[ . 1 . 2]" 1
1506 1 54 GLN H 1 56 LEU H . . 4.550 4.073 3.969 4.208 . 0 0 "[ . 1 . 2]" 1
1507 1 54 GLN H 1 56 LEU MD1 . . 5.500 5.171 4.982 5.336 . 0 0 "[ . 1 . 2]" 1
1508 1 54 GLN HA 1 54 GLN HB3 . . 2.780 2.453 2.357 2.584 . 0 0 "[ . 1 . 2]" 1
1509 1 54 GLN HA 1 54 GLN HE21 . . 4.410 4.425 3.776 4.491 0.081 19 0 "[ . 1 . 2]" 1
1510 1 54 GLN HA 1 54 GLN HG2 . . 3.240 2.688 2.580 2.789 . 0 0 "[ . 1 . 2]" 1
1511 1 54 GLN HA 1 54 GLN HG3 . . 3.810 3.782 3.709 3.851 0.041 19 0 "[ . 1 . 2]" 1
1512 1 54 GLN HA 1 57 ASP H . . 3.990 3.988 3.811 4.061 0.071 18 0 "[ . 1 . 2]" 1
1513 1 54 GLN HA 1 57 ASP HB2 . . 4.820 4.749 4.248 4.885 0.065 18 0 "[ . 1 . 2]" 1
1514 1 54 GLN HA 1 57 ASP HB3 . . 5.500 3.893 3.416 4.310 . 0 0 "[ . 1 . 2]" 1
1515 1 54 GLN HB2 1 55 GLN H . . 4.010 2.485 2.083 2.787 . 0 0 "[ . 1 . 2]" 1
1516 1 54 GLN HB3 1 54 GLN HG3 . . 2.950 2.887 2.767 2.952 0.002 13 0 "[ . 1 . 2]" 1
1517 1 54 GLN HE22 1 54 GLN HG3 . . 3.970 3.870 3.762 4.035 0.065 13 0 "[ . 1 . 2]" 1
1518 1 54 GLN HG2 1 55 GLN H . . 4.380 4.372 4.211 4.446 0.066 13 0 "[ . 1 . 2]" 1
1519 1 54 GLN HG3 1 55 GLN H . . 4.110 4.148 4.007 4.230 0.120 2 0 "[ . 1 . 2]" 1
1520 1 54 GLN HG3 1 55 GLN QG . . 4.490 4.414 4.112 4.569 0.079 5 0 "[ . 1 . 2]" 1
1521 1 55 GLN H 1 55 GLN QB . . 2.780 2.604 2.424 2.706 . 0 0 "[ . 1 . 2]" 1
1522 1 55 GLN H 1 55 GLN QG . . 3.400 2.022 1.811 2.270 . 0 0 "[ . 1 . 2]" 1
1523 1 55 GLN H 1 56 LEU HA . . 5.390 5.198 5.032 5.363 . 0 0 "[ . 1 . 2]" 1
1524 1 55 GLN H 1 56 LEU HB2 . . 4.340 4.362 4.215 4.411 0.071 5 0 "[ . 1 . 2]" 1
1525 1 55 GLN H 1 56 LEU MD1 . . 4.750 4.309 4.031 4.635 . 0 0 "[ . 1 . 2]" 1
1526 1 55 GLN H 1 57 ASP H . . 4.340 4.252 3.986 4.391 0.051 19 0 "[ . 1 . 2]" 1
1527 1 55 GLN H 1 58 ALA H . . 5.130 4.485 4.266 4.783 . 0 0 "[ . 1 . 2]" 1
1528 1 55 GLN HA 1 55 GLN QG . . 3.550 2.773 2.517 3.233 . 0 0 "[ . 1 . 2]" 1
1529 1 55 GLN HA 1 58 ALA MB . . 3.600 3.547 3.203 3.701 0.101 2 0 "[ . 1 . 2]" 1
1530 1 55 GLN QB 1 56 LEU H . . 3.340 2.752 2.506 3.269 . 0 0 "[ . 1 . 2]" 1
1531 1 55 GLN QB 1 56 LEU HB2 . . 4.540 4.439 4.235 4.609 0.069 20 0 "[ . 1 . 2]" 1
1532 1 55 GLN QB 1 56 LEU MD1 . . 5.500 3.139 2.916 3.535 . 0 0 "[ . 1 . 2]" 1
1533 1 55 GLN QB 1 57 ASP H . . 4.950 4.827 4.556 5.001 0.051 4 0 "[ . 1 . 2]" 1
1534 1 55 GLN QB 1 58 ALA H . . 4.880 4.636 4.427 4.790 . 0 0 "[ . 1 . 2]" 1
1535 1 55 GLN QB 1 58 ALA MB . . 4.630 4.443 4.159 4.685 0.055 4 0 "[ . 1 . 2]" 1
1536 1 55 GLN QG 1 56 LEU H . . 4.290 3.877 3.647 4.247 . 0 0 "[ . 1 . 2]" 1
1537 1 55 GLN QG 1 58 ALA H . . 5.500 5.346 5.032 5.580 0.080 5 0 "[ . 1 . 2]" 1
1538 1 56 LEU H 1 56 LEU HB2 . . 2.720 2.121 2.016 2.195 . 0 0 "[ . 1 . 2]" 1
1539 1 56 LEU H 1 56 LEU HB3 . . 3.490 3.389 3.298 3.470 . 0 0 "[ . 1 . 2]" 1
1540 1 56 LEU H 1 56 LEU MD1 . . 5.500 2.737 2.490 3.059 . 0 0 "[ . 1 . 2]" 1
1541 1 56 LEU H 1 56 LEU MD2 . . 5.500 4.179 3.999 4.416 . 0 0 "[ . 1 . 2]" 1
1542 1 56 LEU H 1 56 LEU HG . . 4.170 4.117 4.018 4.227 0.057 20 0 "[ . 1 . 2]" 1
1543 1 56 LEU H 1 57 ASP H . . 3.330 2.689 2.233 2.953 . 0 0 "[ . 1 . 2]" 1
1544 1 56 LEU H 1 58 ALA H . . 5.300 3.777 3.367 4.056 . 0 0 "[ . 1 . 2]" 1
1545 1 56 LEU H 1 58 ALA MB . . 5.490 5.171 4.770 5.355 . 0 0 "[ . 1 . 2]" 1
1546 1 56 LEU HA 1 56 LEU HB3 . . 2.980 2.791 2.743 2.857 . 0 0 "[ . 1 . 2]" 1
1547 1 56 LEU HA 1 56 LEU MD1 . . 3.110 2.536 2.360 2.852 . 0 0 "[ . 1 . 2]" 1
1548 1 56 LEU HA 1 56 LEU MD2 . . 3.610 3.673 3.497 3.706 0.096 2 0 "[ . 1 . 2]" 1
1549 1 56 LEU HA 1 56 LEU HG . . 2.700 2.255 2.098 2.325 . 0 0 "[ . 1 . 2]" 1
1550 1 56 LEU HA 1 57 ASP H . . 3.540 3.558 3.491 3.594 0.054 17 0 "[ . 1 . 2]" 1
1551 1 56 LEU HA 1 58 ALA H . . 4.590 4.422 4.033 4.652 0.062 12 0 "[ . 1 . 2]" 1
1552 1 56 LEU HA 1 58 ALA MB . . 4.860 4.702 4.328 4.942 0.082 5 0 "[ . 1 . 2]" 1
1553 1 56 LEU HB2 1 56 LEU MD1 . . 3.450 2.357 2.170 2.466 . 0 0 "[ . 1 . 2]" 1
1554 1 56 LEU HB2 1 56 LEU MD2 . . 3.250 2.533 2.428 2.697 . 0 0 "[ . 1 . 2]" 1
1555 1 56 LEU HB2 1 57 ASP H . . 3.200 3.019 2.702 3.248 0.048 7 0 "[ . 1 . 2]" 1
1556 1 56 LEU HB2 1 57 ASP HB3 . . 5.500 5.365 4.969 5.559 0.059 18 0 "[ . 1 . 2]" 1
1557 1 56 LEU HB3 1 56 LEU MD1 . . 3.360 3.228 3.158 3.267 . 0 0 "[ . 1 . 2]" 1
1558 1 56 LEU HB3 1 56 LEU MD2 . . 3.080 2.245 2.179 2.294 . 0 0 "[ . 1 . 2]" 1
1559 1 56 LEU HB3 1 57 ASP H . . 3.790 3.082 2.792 3.414 . 0 0 "[ . 1 . 2]" 1
1560 1 56 LEU HB3 1 57 ASP HB2 . . 3.990 3.985 3.758 4.050 0.060 17 0 "[ . 1 . 2]" 1
1561 1 56 LEU MD1 1 57 ASP H . . 4.680 4.524 4.399 4.691 0.011 7 0 "[ . 1 . 2]" 1
1562 1 56 LEU MD2 1 57 ASP H . . 5.500 4.740 4.415 4.990 . 0 0 "[ . 1 . 2]" 1
1563 1 56 LEU HG 1 57 ASP H . . 5.150 4.975 4.829 5.101 . 0 0 "[ . 1 . 2]" 1
1564 1 57 ASP H 1 57 ASP HB2 . . 2.710 2.524 2.296 2.693 . 0 0 "[ . 1 . 2]" 1
1565 1 57 ASP H 1 57 ASP HB3 . . 3.120 2.632 2.461 2.831 . 0 0 "[ . 1 . 2]" 1
1566 1 57 ASP HA 1 57 ASP HB2 . . 2.930 2.544 2.490 2.632 . 0 0 "[ . 1 . 2]" 1
1567 1 57 ASP HA 1 58 ALA MB . . 4.510 4.158 4.014 4.281 . 0 0 "[ . 1 . 2]" 1
1568 1 57 ASP HA 1 59 LYS H . . 4.830 4.543 4.180 4.889 0.059 1 0 "[ . 1 . 2]" 1
1569 1 57 ASP HB2 1 58 ALA H . . 4.010 3.938 3.677 4.046 0.036 7 0 "[ . 1 . 2]" 1
1570 1 57 ASP HB2 1 58 ALA MB . . 5.500 5.564 5.502 5.591 0.091 8 0 "[ . 1 . 2]" 1
1571 1 57 ASP HB3 1 58 ALA H . . 3.680 2.991 2.604 3.210 . 0 0 "[ . 1 . 2]" 1
1572 1 58 ALA H 1 58 ALA MB . . 2.950 2.782 2.594 2.898 . 0 0 "[ . 1 . 2]" 1
1573 1 58 ALA H 1 59 LYS H . . 3.650 2.831 2.641 3.066 . 0 0 "[ . 1 . 2]" 1
1574 1 58 ALA HA 1 59 LYS H . . 2.940 2.874 2.542 3.013 0.073 8 0 "[ . 1 . 2]" 1
1575 1 58 ALA MB 1 59 LYS H . . 3.930 3.679 3.505 3.772 . 0 0 "[ . 1 . 2]" 1
1576 1 58 ALA MB 1 59 LYS QD . . 5.500 5.348 4.370 5.615 0.115 12 0 "[ . 1 . 2]" 1
1577 1 59 LYS H 1 59 LYS QB . . 3.190 2.531 2.118 3.192 0.002 11 0 "[ . 1 . 2]" 1
1578 1 59 LYS H 1 59 LYS QG . . 4.340 3.774 1.823 4.350 0.010 20 0 "[ . 1 . 2]" 1
1579 1 59 LYS H 1 60 GLU H . . 4.370 4.337 3.895 4.485 0.115 2 0 "[ . 1 . 2]" 1
1580 1 59 LYS HA 1 59 LYS QD . . 4.330 2.992 2.115 4.410 0.080 11 0 "[ . 1 . 2]" 1
1581 1 59 LYS HA 1 59 LYS HG2 . . 4.230 3.667 2.757 4.267 0.037 1 0 "[ . 1 . 2]" 1
1582 1 59 LYS HA 1 59 LYS HG3 . . 4.230 3.144 2.492 4.252 0.022 8 0 "[ . 1 . 2]" 1
1583 1 59 LYS HA 1 60 GLU H . . 3.130 2.320 2.038 2.642 . 0 0 "[ . 1 . 2]" 1
1584 1 59 LYS HB2 1 60 GLU H . . 5.500 3.778 1.995 4.540 . 0 0 "[ . 1 . 2]" 1
1585 1 59 LYS HB3 1 60 GLU H . . 5.500 3.891 3.303 4.498 . 0 0 "[ . 1 . 2]" 1
1586 1 59 LYS QD 1 61 GLU QG . . 5.500 4.815 2.821 5.563 0.063 9 0 "[ . 1 . 2]" 1
1587 1 59 LYS QG 1 60 GLU QB . . 4.760 4.552 4.073 4.850 0.090 5 0 "[ . 1 . 2]" 1
1588 1 59 LYS QG 1 61 GLU QB . . 4.760 4.252 3.079 4.841 0.081 20 0 "[ . 1 . 2]" 1
1589 1 60 GLU H 1 60 GLU QG . . 3.970 3.239 2.189 4.016 0.046 7 0 "[ . 1 . 2]" 1
1590 1 60 GLU H 1 61 GLU H . . 5.500 4.308 3.422 4.614 . 0 0 "[ . 1 . 2]" 1
1591 1 60 GLU HA 1 61 GLU H . . 2.810 2.364 1.963 2.758 . 0 0 "[ . 1 . 2]" 1
1592 1 60 GLU HA 1 61 GLU QG . . 5.500 4.368 3.178 5.594 0.094 20 0 "[ . 1 . 2]" 1
1593 1 60 GLU QB 1 61 GLU H . . 3.920 2.992 1.880 3.991 0.071 12 0 "[ . 1 . 2]" 1
1594 1 60 GLU HB2 1 61 GLU H . . 4.610 3.835 2.247 4.661 0.051 3 0 "[ . 1 . 2]" 1
1595 1 60 GLU HB3 1 61 GLU H . . 4.610 3.333 1.903 4.476 . 0 0 "[ . 1 . 2]" 1
1596 1 60 GLU QG 1 61 GLU H . . 4.840 3.844 2.504 4.775 . 0 0 "[ . 1 . 2]" 1
1597 1 61 GLU H 1 61 GLU QG . . 5.020 3.323 2.146 4.308 . 0 0 "[ . 1 . 2]" 1
1598 1 61 GLU HA 1 62 THR H . . 3.280 2.508 2.121 3.331 0.051 9 0 "[ . 1 . 2]" 1
1599 1 61 GLU QG 1 62 THR MG . . 5.500 4.999 2.865 5.594 0.094 18 0 "[ . 1 . 2]" 1
1600 1 62 THR H 1 62 THR HB . . 3.930 3.269 2.272 3.818 . 0 0 "[ . 1 . 2]" 1
1601 1 62 THR HA 1 63 GLN H . . 3.080 2.452 2.050 2.771 . 0 0 "[ . 1 . 2]" 1
1602 1 62 THR HB 1 63 GLN H . . 5.500 3.436 2.009 4.399 . 0 0 "[ . 1 . 2]" 1
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