NMR Restraints Grid
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NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
454981 |
3pdz   |
4516 | cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_3pdz
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 1202
_Distance_constraint_stats_list.Viol_count 4357
_Distance_constraint_stats_list.Viol_total 4929.414
_Distance_constraint_stats_list.Viol_max 0.241
_Distance_constraint_stats_list.Viol_rms 0.0175
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0046
_Distance_constraint_stats_list.Viol_average_violations_only 0.0377
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 2 LYS 0.259 0.062 6 0 "[ . 1 . 2 . 3]"
1 3 PRO 1.377 0.225 5 0 "[ . 1 . 2 . 3]"
1 4 GLY 0.348 0.034 24 0 "[ . 1 . 2 . 3]"
1 5 ASP 4.524 0.225 5 0 "[ . 1 . 2 . 3]"
1 6 ILE 6.233 0.138 9 0 "[ . 1 . 2 . 3]"
1 7 PHE 3.772 0.107 15 0 "[ . 1 . 2 . 3]"
1 8 GLU 8.241 0.109 7 0 "[ . 1 . 2 . 3]"
1 9 VAL 5.310 0.082 4 0 "[ . 1 . 2 . 3]"
1 10 GLU 3.791 0.054 8 0 "[ . 1 . 2 . 3]"
1 11 LEU 7.747 0.106 13 0 "[ . 1 . 2 . 3]"
1 12 ALA 3.080 0.082 13 0 "[ . 1 . 2 . 3]"
1 13 LYS 3.818 0.223 13 0 "[ . 1 . 2 . 3]"
1 14 ASN 2.479 0.223 13 0 "[ . 1 . 2 . 3]"
1 15 ASP 0.122 0.062 26 0 "[ . 1 . 2 . 3]"
1 16 ASN 0.408 0.031 23 0 "[ . 1 . 2 . 3]"
1 17 SER 2.564 0.145 21 0 "[ . 1 . 2 . 3]"
1 18 LEU 5.248 0.145 21 0 "[ . 1 . 2 . 3]"
1 19 GLY 2.838 0.114 27 0 "[ . 1 . 2 . 3]"
1 20 ILE 14.630 0.161 17 0 "[ . 1 . 2 . 3]"
1 21 SER 2.823 0.093 14 0 "[ . 1 . 2 . 3]"
1 22 VAL 7.128 0.134 13 0 "[ . 1 . 2 . 3]"
1 23 THR 3.225 0.116 24 0 "[ . 1 . 2 . 3]"
1 24 GLY 0.650 0.056 17 0 "[ . 1 . 2 . 3]"
1 25 GLY 2.142 0.085 23 0 "[ . 1 . 2 . 3]"
1 26 VAL 2.547 0.099 16 0 "[ . 1 . 2 . 3]"
1 27 ASN 0.783 0.037 17 0 "[ . 1 . 2 . 3]"
1 28 THR 0.125 0.032 16 0 "[ . 1 . 2 . 3]"
1 29 SER 0.041 0.009 7 0 "[ . 1 . 2 . 3]"
1 30 VAL 0.087 0.008 17 0 "[ . 1 . 2 . 3]"
1 31 ARG 0.151 0.046 10 0 "[ . 1 . 2 . 3]"
1 32 HIS 0.154 0.046 10 0 "[ . 1 . 2 . 3]"
1 33 GLY 3.374 0.105 27 0 "[ . 1 . 2 . 3]"
1 34 GLY 0.620 0.061 3 0 "[ . 1 . 2 . 3]"
1 35 ILE 3.725 0.096 20 0 "[ . 1 . 2 . 3]"
1 36 TYR 7.231 0.096 20 0 "[ . 1 . 2 . 3]"
1 37 VAL 11.621 0.200 20 0 "[ . 1 . 2 . 3]"
1 38 LYS 5.315 0.101 26 0 "[ . 1 . 2 . 3]"
1 39 ALA 6.540 0.143 21 0 "[ . 1 . 2 . 3]"
1 40 VAL 7.768 0.161 17 0 "[ . 1 . 2 . 3]"
1 41 ILE 11.099 0.241 6 0 "[ . 1 . 2 . 3]"
1 42 PRO 0.009 0.009 13 0 "[ . 1 . 2 . 3]"
1 43 GLN 1.406 0.057 8 0 "[ . 1 . 2 . 3]"
1 44 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 45 ALA 2.728 0.091 16 0 "[ . 1 . 2 . 3]"
1 46 ALA 1.729 0.054 2 0 "[ . 1 . 2 . 3]"
1 47 GLU 10.603 0.241 6 0 "[ . 1 . 2 . 3]"
1 48 SER 0.060 0.023 13 0 "[ . 1 . 2 . 3]"
1 49 ASP 1.383 0.080 29 0 "[ . 1 . 2 . 3]"
1 50 GLY 2.108 0.107 8 0 "[ . 1 . 2 . 3]"
1 51 ARG 1.500 0.057 13 0 "[ . 1 . 2 . 3]"
1 52 ILE 4.992 0.106 14 0 "[ . 1 . 2 . 3]"
1 53 HIS 6.727 0.186 21 0 "[ . 1 . 2 . 3]"
1 54 LYS 10.993 0.186 21 0 "[ . 1 . 2 . 3]"
1 55 GLY 6.020 0.127 11 0 "[ . 1 . 2 . 3]"
1 56 ASP 4.973 0.200 20 0 "[ . 1 . 2 . 3]"
1 57 ARG 0.911 0.037 30 0 "[ . 1 . 2 . 3]"
1 58 VAL 2.278 0.077 26 0 "[ . 1 . 2 . 3]"
1 59 LEU 2.431 0.081 24 0 "[ . 1 . 2 . 3]"
1 60 ALA 2.697 0.081 12 0 "[ . 1 . 2 . 3]"
1 61 VAL 2.076 0.046 25 0 "[ . 1 . 2 . 3]"
1 62 ASN 1.257 0.042 22 0 "[ . 1 . 2 . 3]"
1 63 GLY 1.986 0.081 12 0 "[ . 1 . 2 . 3]"
1 64 VAL 2.041 0.042 30 0 "[ . 1 . 2 . 3]"
1 65 SER 1.839 0.051 4 0 "[ . 1 . 2 . 3]"
1 66 LEU 0.604 0.051 4 0 "[ . 1 . 2 . 3]"
1 67 GLU 0.287 0.030 15 0 "[ . 1 . 2 . 3]"
1 68 GLY 0.004 0.004 2 0 "[ . 1 . 2 . 3]"
1 69 ALA 0.043 0.009 25 0 "[ . 1 . 2 . 3]"
1 70 THR 6.531 0.105 27 0 "[ . 1 . 2 . 3]"
1 71 HIS 4.789 0.116 24 0 "[ . 1 . 2 . 3]"
1 72 LYS 8.691 0.140 17 0 "[ . 1 . 2 . 3]"
1 73 GLN 1.098 0.075 2 0 "[ . 1 . 2 . 3]"
1 74 ALA 5.614 0.209 6 0 "[ . 1 . 2 . 3]"
1 75 VAL 7.796 0.140 17 0 "[ . 1 . 2 . 3]"
1 76 GLU 2.182 0.075 26 0 "[ . 1 . 2 . 3]"
1 77 THR 5.421 0.209 6 0 "[ . 1 . 2 . 3]"
1 78 LEU 0.590 0.043 24 0 "[ . 1 . 2 . 3]"
1 79 ARG 2.891 0.085 10 0 "[ . 1 . 2 . 3]"
1 80 ASN 0.624 0.028 15 0 "[ . 1 . 2 . 3]"
1 81 THR 1.747 0.046 17 0 "[ . 1 . 2 . 3]"
1 82 GLY 2.252 0.118 2 0 "[ . 1 . 2 . 3]"
1 83 GLN 2.272 0.118 2 0 "[ . 1 . 2 . 3]"
1 84 VAL 3.539 0.082 13 0 "[ . 1 . 2 . 3]"
1 85 VAL 4.611 0.106 13 0 "[ . 1 . 2 . 3]"
1 86 HIS 0.927 0.042 22 0 "[ . 1 . 2 . 3]"
1 87 LEU 5.976 0.078 24 0 "[ . 1 . 2 . 3]"
1 88 LEU 4.240 0.109 7 0 "[ . 1 . 2 . 3]"
1 89 LEU 11.697 0.107 15 0 "[ . 1 . 2 . 3]"
1 90 GLU 3.881 0.106 7 0 "[ . 1 . 2 . 3]"
1 91 LYS 1.617 0.048 2 0 "[ . 1 . 2 . 3]"
1 92 GLY 0.764 0.040 27 0 "[ . 1 . 2 . 3]"
1 93 GLN 0.004 0.002 30 0 "[ . 1 . 2 . 3]"
1 94 SER 0.004 0.004 20 0 "[ . 1 . 2 . 3]"
1 95 PRO 0.004 0.004 20 0 "[ . 1 . 2 . 3]"
1 96 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 PRO HA 1 1 PRO QG 3.200 . 4.000 3.286 3.081 3.428 . 0 0 "[ . 1 . 2 . 3]" 1
2 1 1 PRO HA 1 2 LYS H 3.200 . 4.000 2.639 2.148 3.568 . 0 0 "[ . 1 . 2 . 3]" 1
3 1 1 PRO QB 1 2 LYS H 4.000 . 5.000 3.183 1.977 3.959 . 0 0 "[ . 1 . 2 . 3]" 1
4 1 2 LYS H 1 2 LYS QB 3.200 . 4.000 2.929 2.650 3.306 . 0 0 "[ . 1 . 2 . 3]" 1
5 1 2 LYS H 1 2 LYS QD 4.000 . 5.000 4.275 1.972 5.060 0.060 11 0 "[ . 1 . 2 . 3]" 1
6 1 2 LYS H 1 2 LYS QG 3.200 . 4.000 3.227 2.300 4.062 0.062 6 0 "[ . 1 . 2 . 3]" 1
7 1 2 LYS HA 1 2 LYS QD 4.000 . 5.000 3.850 2.384 4.343 . 0 0 "[ . 1 . 2 . 3]" 1
8 1 2 LYS HA 1 2 LYS QG 3.200 . 4.000 2.777 2.113 3.452 . 0 0 "[ . 1 . 2 . 3]" 1
9 1 2 LYS QB 1 2 LYS QE 3.200 . 4.000 3.178 2.372 3.800 . 0 0 "[ . 1 . 2 . 3]" 1
10 1 3 PRO HA 1 3 PRO QG 3.200 . 4.000 3.252 2.821 3.505 . 0 0 "[ . 1 . 2 . 3]" 1
11 1 3 PRO QB 1 3 PRO QD 3.200 . 4.000 2.771 2.750 2.840 . 0 0 "[ . 1 . 2 . 3]" 1
12 1 3 PRO QB 1 4 GLY H 4.000 . 5.000 2.260 1.814 3.822 . 0 0 "[ . 1 . 2 . 3]" 1
13 1 3 PRO QB 1 5 ASP H 3.200 . 4.000 3.747 2.541 4.225 0.225 5 0 "[ . 1 . 2 . 3]" 1
14 1 4 GLY H 1 5 ASP H 3.200 . 4.000 2.846 2.728 3.277 . 0 0 "[ . 1 . 2 . 3]" 1
15 1 4 GLY H 1 91 LYS H 4.000 . 5.000 5.007 4.949 5.034 0.034 24 0 "[ . 1 . 2 . 3]" 1
16 1 4 GLY H 1 91 LYS QB 4.000 . 5.000 2.804 2.422 3.570 . 0 0 "[ . 1 . 2 . 3]" 1
17 1 4 GLY HA2 1 5 ASP H 3.200 . 4.000 3.457 3.398 3.553 . 0 0 "[ . 1 . 2 . 3]" 1
18 1 4 GLY HA3 1 5 ASP H 3.200 . 4.000 3.025 2.785 3.137 . 0 0 "[ . 1 . 2 . 3]" 1
19 1 5 ASP H 1 5 ASP HB2 3.200 . 4.000 2.513 2.131 3.587 . 0 0 "[ . 1 . 2 . 3]" 1
20 1 5 ASP H 1 5 ASP HB3 3.200 . 4.000 3.274 2.544 3.611 . 0 0 "[ . 1 . 2 . 3]" 1
21 1 5 ASP H 1 91 LYS HB3 4.000 . 5.000 3.898 3.481 4.690 . 0 0 "[ . 1 . 2 . 3]" 1
22 1 5 ASP HA 1 6 ILE HB 3.200 . 4.000 4.103 4.074 4.138 0.138 9 0 "[ . 1 . 2 . 3]" 1
23 1 5 ASP HA 1 6 ILE MD 3.200 . 4.000 3.391 3.179 3.702 . 0 0 "[ . 1 . 2 . 3]" 1
24 1 5 ASP HB2 1 6 ILE H 3.200 . 4.000 3.823 2.802 4.021 0.021 19 0 "[ . 1 . 2 . 3]" 1
25 1 5 ASP HB3 1 6 ILE H 4.000 . 5.000 3.045 2.425 3.982 . 0 0 "[ . 1 . 2 . 3]" 1
26 1 6 ILE H 1 6 ILE HB 3.200 . 4.000 2.193 2.046 2.254 . 0 0 "[ . 1 . 2 . 3]" 1
27 1 6 ILE H 1 6 ILE HG12 4.000 . 5.000 4.368 4.115 4.575 . 0 0 "[ . 1 . 2 . 3]" 1
28 1 6 ILE H 1 6 ILE HG13 4.000 . 5.000 4.303 4.099 4.408 . 0 0 "[ . 1 . 2 . 3]" 1
29 1 6 ILE H 1 6 ILE MG 3.200 . 4.000 3.404 3.298 3.474 . 0 0 "[ . 1 . 2 . 3]" 1
30 1 6 ILE H 1 7 PHE H 4.000 . 5.000 4.542 4.502 4.614 . 0 0 "[ . 1 . 2 . 3]" 1
31 1 6 ILE HA 1 6 ILE MD 3.200 . 4.000 2.324 2.113 2.518 . 0 0 "[ . 1 . 2 . 3]" 1
32 1 6 ILE HA 1 6 ILE QG 3.200 . 4.000 2.291 2.171 2.406 . 0 0 "[ . 1 . 2 . 3]" 1
33 1 6 ILE HA 1 6 ILE MG 3.200 . 4.000 2.801 2.736 2.860 . 0 0 "[ . 1 . 2 . 3]" 1
34 1 6 ILE HA 1 7 PHE H 2.600 . 3.000 2.245 2.206 2.307 . 0 0 "[ . 1 . 2 . 3]" 1
35 1 6 ILE HA 1 7 PHE HA 4.000 . 5.000 4.437 4.418 4.469 . 0 0 "[ . 1 . 2 . 3]" 1
36 1 6 ILE HA 1 90 GLU HA 2.600 . 3.000 1.912 1.812 1.999 . 0 0 "[ . 1 . 2 . 3]" 1
37 1 6 ILE HA 1 90 GLU HB2 2.600 . 3.000 3.030 3.017 3.047 0.047 21 0 "[ . 1 . 2 . 3]" 1
38 1 6 ILE HA 1 90 GLU QG 3.200 . 4.000 3.539 3.035 3.847 . 0 0 "[ . 1 . 2 . 3]" 1
39 1 6 ILE HA 1 91 LYS H 3.200 . 4.000 2.719 2.574 2.886 . 0 0 "[ . 1 . 2 . 3]" 1
40 1 6 ILE HB 1 6 ILE MD 3.200 . 4.000 2.327 2.227 2.445 . 0 0 "[ . 1 . 2 . 3]" 1
41 1 6 ILE HB 1 7 PHE H 4.000 . 5.000 4.236 4.166 4.317 . 0 0 "[ . 1 . 2 . 3]" 1
42 1 6 ILE MD 1 90 GLU HA 2.600 . 3.000 2.902 2.746 3.008 0.008 9 0 "[ . 1 . 2 . 3]" 1
43 1 6 ILE MD 1 90 GLU HB2 4.000 . 5.000 1.950 1.907 2.021 . 0 0 "[ . 1 . 2 . 3]" 1
44 1 6 ILE MD 1 90 GLU QG 3.200 . 4.000 2.518 2.034 2.969 . 0 0 "[ . 1 . 2 . 3]" 1
45 1 6 ILE QG 1 90 GLU HA 3.200 . 4.000 2.472 2.311 2.644 . 0 0 "[ . 1 . 2 . 3]" 1
46 1 6 ILE MG 1 7 PHE H 3.200 . 4.000 2.349 2.183 2.477 . 0 0 "[ . 1 . 2 . 3]" 1
47 1 6 ILE MG 1 7 PHE HA 2.600 . 3.000 3.048 3.021 3.060 0.060 13 0 "[ . 1 . 2 . 3]" 1
48 1 6 ILE MG 1 8 GLU QG 4.000 . 5.000 4.740 4.489 5.005 0.005 2 0 "[ . 1 . 2 . 3]" 1
49 1 6 ILE MG 1 88 LEU HG 4.000 . 5.000 4.214 3.787 5.020 0.020 12 0 "[ . 1 . 2 . 3]" 1
50 1 6 ILE MG 1 89 LEU H 3.200 . 4.000 4.020 4.006 4.034 0.034 3 0 "[ . 1 . 2 . 3]" 1
51 1 7 PHE H 1 7 PHE QB 3.200 . 4.000 3.005 2.960 3.063 . 0 0 "[ . 1 . 2 . 3]" 1
52 1 7 PHE H 1 7 PHE QD 3.200 . 4.000 3.219 1.870 3.360 . 0 0 "[ . 1 . 2 . 3]" 1
53 1 7 PHE H 1 8 GLU H 4.000 . 5.000 4.406 4.330 4.425 . 0 0 "[ . 1 . 2 . 3]" 1
54 1 7 PHE H 1 89 LEU H 4.000 . 5.000 3.914 3.794 4.004 . 0 0 "[ . 1 . 2 . 3]" 1
55 1 7 PHE H 1 89 LEU HG 4.000 . 5.000 4.956 4.797 5.027 0.027 11 0 "[ . 1 . 2 . 3]" 1
56 1 7 PHE H 1 91 LYS HB2 4.000 . 5.000 5.024 4.994 5.048 0.048 2 0 "[ . 1 . 2 . 3]" 1
57 1 7 PHE HA 1 7 PHE QD 3.200 . 4.000 3.637 3.612 3.677 . 0 0 "[ . 1 . 2 . 3]" 1
58 1 7 PHE HA 1 8 GLU QG 4.000 . 5.000 3.641 3.449 4.380 . 0 0 "[ . 1 . 2 . 3]" 1
59 1 7 PHE QB 1 7 PHE QD 2.600 . 3.000 2.128 2.125 2.161 . 0 0 "[ . 1 . 2 . 3]" 1
60 1 7 PHE QB 1 7 PHE QE 3.200 . 4.000 3.925 3.921 3.939 . 0 0 "[ . 1 . 2 . 3]" 1
61 1 7 PHE QB 1 8 GLU H 3.200 . 4.000 2.583 2.458 2.935 . 0 0 "[ . 1 . 2 . 3]" 1
62 1 7 PHE QD 1 89 LEU QB 4.000 . 5.000 4.015 3.091 4.156 . 0 0 "[ . 1 . 2 . 3]" 1
63 1 7 PHE QD 1 89 LEU MD1 4.000 . 5.000 3.590 3.077 3.863 . 0 0 "[ . 1 . 2 . 3]" 1
64 1 7 PHE QD 1 89 LEU MD2 4.000 . 5.000 5.030 5.010 5.107 0.107 15 0 "[ . 1 . 2 . 3]" 1
65 1 7 PHE QD 1 91 LYS H 3.200 . 4.000 2.958 2.413 3.242 . 0 0 "[ . 1 . 2 . 3]" 1
66 1 7 PHE QD 1 91 LYS HA 3.200 . 4.000 2.915 2.653 3.697 . 0 0 "[ . 1 . 2 . 3]" 1
67 1 7 PHE QD 1 91 LYS QB 3.200 . 4.000 2.968 2.683 3.543 . 0 0 "[ . 1 . 2 . 3]" 1
68 1 7 PHE QD 1 91 LYS QD 4.000 . 5.000 2.905 2.073 4.092 . 0 0 "[ . 1 . 2 . 3]" 1
69 1 7 PHE QE 1 52 ILE HA 4.000 . 5.000 3.722 3.148 3.966 . 0 0 "[ . 1 . 2 . 3]" 1
70 1 7 PHE QE 1 52 ILE MD 3.200 . 4.000 3.679 3.218 4.003 0.003 15 0 "[ . 1 . 2 . 3]" 1
71 1 7 PHE QE 1 56 ASP HA 4.000 . 5.000 4.367 3.513 4.639 . 0 0 "[ . 1 . 2 . 3]" 1
72 1 7 PHE QE 1 56 ASP QB 4.000 . 5.000 4.311 2.780 4.649 . 0 0 "[ . 1 . 2 . 3]" 1
73 1 7 PHE QE 1 89 LEU QB 3.200 . 4.000 3.426 1.993 3.656 . 0 0 "[ . 1 . 2 . 3]" 1
74 1 7 PHE QE 1 89 LEU MD1 3.200 . 4.000 2.009 1.846 2.596 . 0 0 "[ . 1 . 2 . 3]" 1
75 1 7 PHE QE 1 89 LEU MD2 4.000 . 5.000 4.273 4.161 4.513 . 0 0 "[ . 1 . 2 . 3]" 1
76 1 7 PHE QE 1 91 LYS H 4.000 . 5.000 3.943 3.291 4.188 . 0 0 "[ . 1 . 2 . 3]" 1
77 1 7 PHE QE 1 91 LYS HA 3.200 . 4.000 2.177 1.941 2.779 . 0 0 "[ . 1 . 2 . 3]" 1
78 1 7 PHE QE 1 91 LYS QB 3.200 . 4.000 3.929 3.490 4.026 0.026 15 0 "[ . 1 . 2 . 3]" 1
79 1 7 PHE QE 1 91 LYS QD 3.200 . 4.000 2.834 2.318 4.002 0.002 15 0 "[ . 1 . 2 . 3]" 1
80 1 7 PHE QE 1 91 LYS QE 3.200 . 4.000 3.395 1.999 4.009 0.009 22 0 "[ . 1 . 2 . 3]" 1
81 1 7 PHE QE 1 92 GLY H 3.200 . 4.000 3.175 2.842 3.644 . 0 0 "[ . 1 . 2 . 3]" 1
82 1 7 PHE HZ 1 52 ILE HA 3.200 . 4.000 3.871 3.372 4.050 0.050 24 0 "[ . 1 . 2 . 3]" 1
83 1 7 PHE HZ 1 52 ILE MD 3.200 . 4.000 3.557 3.187 4.022 0.022 5 0 "[ . 1 . 2 . 3]" 1
84 1 7 PHE HZ 1 53 HIS H 4.000 . 5.000 3.738 2.964 3.959 . 0 0 "[ . 1 . 2 . 3]" 1
85 1 7 PHE HZ 1 89 LEU QB 4.000 . 5.000 3.546 3.289 3.805 . 0 0 "[ . 1 . 2 . 3]" 1
86 1 7 PHE HZ 1 89 LEU MD1 3.200 . 4.000 2.294 2.076 2.455 . 0 0 "[ . 1 . 2 . 3]" 1
87 1 7 PHE HZ 1 89 LEU MD2 4.000 . 5.000 4.945 4.747 5.019 0.019 10 0 "[ . 1 . 2 . 3]" 1
88 1 7 PHE HZ 1 91 LYS HA 4.000 . 5.000 4.507 3.685 4.833 . 0 0 "[ . 1 . 2 . 3]" 1
89 1 7 PHE HZ 1 91 LYS QD 4.000 . 5.000 4.836 4.358 5.011 0.011 23 0 "[ . 1 . 2 . 3]" 1
90 1 8 GLU H 1 8 GLU QB 3.200 . 4.000 3.053 2.914 3.091 . 0 0 "[ . 1 . 2 . 3]" 1
91 1 8 GLU H 1 8 GLU QG 3.200 . 4.000 1.991 1.896 2.466 . 0 0 "[ . 1 . 2 . 3]" 1
92 1 8 GLU H 1 88 LEU MD1 4.000 . 5.000 4.564 4.416 4.639 . 0 0 "[ . 1 . 2 . 3]" 1
93 1 8 GLU HA 1 8 GLU QG 3.200 . 4.000 3.330 3.313 3.449 . 0 0 "[ . 1 . 2 . 3]" 1
94 1 8 GLU HA 1 9 VAL H 2.600 . 3.000 2.177 2.157 2.196 . 0 0 "[ . 1 . 2 . 3]" 1
95 1 8 GLU HA 1 9 VAL HA 4.000 . 5.000 4.371 4.360 4.385 . 0 0 "[ . 1 . 2 . 3]" 1
96 1 8 GLU HA 1 9 VAL MG1 2.600 . 3.000 3.063 3.035 3.082 0.082 4 0 "[ . 1 . 2 . 3]" 1
97 1 8 GLU HA 1 88 LEU HA 2.600 . 3.000 2.023 1.998 2.045 . 0 0 "[ . 1 . 2 . 3]" 1
98 1 8 GLU HA 1 88 LEU HB2 4.000 . 5.000 5.008 4.988 5.024 0.024 9 0 "[ . 1 . 2 . 3]" 1
99 1 8 GLU HA 1 88 LEU HB3 4.000 . 5.000 4.416 4.135 4.569 . 0 0 "[ . 1 . 2 . 3]" 1
100 1 8 GLU HA 1 88 LEU MD1 2.600 . 3.000 3.093 3.065 3.109 0.109 7 0 "[ . 1 . 2 . 3]" 1
101 1 8 GLU HA 1 89 LEU H 3.200 . 4.000 2.106 2.020 2.149 . 0 0 "[ . 1 . 2 . 3]" 1
102 1 8 GLU HA 1 89 LEU HA 4.000 . 5.000 5.021 4.926 5.058 0.058 18 0 "[ . 1 . 2 . 3]" 1
103 1 8 GLU HA 1 89 LEU MD1 3.200 . 4.000 4.009 3.727 4.046 0.046 8 0 "[ . 1 . 2 . 3]" 1
104 1 8 GLU HA 1 89 LEU MD2 4.000 . 5.000 3.679 3.391 3.953 . 0 0 "[ . 1 . 2 . 3]" 1
105 1 8 GLU QB 1 9 VAL H 3.200 . 4.000 2.814 2.783 2.848 . 0 0 "[ . 1 . 2 . 3]" 1
106 1 8 GLU QB 1 88 LEU HA 3.200 . 4.000 1.958 1.919 1.989 . 0 0 "[ . 1 . 2 . 3]" 1
107 1 8 GLU QG 1 9 VAL H 3.200 . 4.000 4.039 4.025 4.051 0.051 24 0 "[ . 1 . 2 . 3]" 1
108 1 8 GLU QG 1 86 HIS HE1 3.200 . 4.000 2.759 2.057 3.450 . 0 0 "[ . 1 . 2 . 3]" 1
109 1 8 GLU QG 1 88 LEU HA 3.200 . 4.000 4.027 4.012 4.038 0.038 12 0 "[ . 1 . 2 . 3]" 1
110 1 8 GLU QG 1 88 LEU MD1 3.200 . 4.000 3.020 2.524 3.264 . 0 0 "[ . 1 . 2 . 3]" 1
111 1 9 VAL H 1 9 VAL HB 3.200 . 4.000 3.458 3.399 3.535 . 0 0 "[ . 1 . 2 . 3]" 1
112 1 9 VAL H 1 9 VAL MG1 3.200 . 4.000 1.829 1.789 1.879 0.011 26 0 "[ . 1 . 2 . 3]" 1
113 1 9 VAL H 1 9 VAL MG2 4.000 . 5.000 3.424 3.302 3.508 . 0 0 "[ . 1 . 2 . 3]" 1
114 1 9 VAL H 1 10 GLU H 4.000 . 5.000 4.310 4.291 4.337 . 0 0 "[ . 1 . 2 . 3]" 1
115 1 9 VAL H 1 10 GLU HA 4.000 . 5.000 4.946 4.923 4.966 . 0 0 "[ . 1 . 2 . 3]" 1
116 1 9 VAL H 1 87 LEU H 4.000 . 5.000 3.249 3.152 3.364 . 0 0 "[ . 1 . 2 . 3]" 1
117 1 9 VAL H 1 88 LEU HA 4.000 . 5.000 3.444 3.401 3.511 . 0 0 "[ . 1 . 2 . 3]" 1
118 1 9 VAL H 1 89 LEU MD1 4.000 . 5.000 3.623 3.368 3.703 . 0 0 "[ . 1 . 2 . 3]" 1
119 1 9 VAL H 1 89 LEU MD2 3.200 . 4.000 3.429 3.183 3.775 . 0 0 "[ . 1 . 2 . 3]" 1
120 1 9 VAL HA 1 9 VAL MG1 3.200 . 4.000 3.039 2.972 3.084 . 0 0 "[ . 1 . 2 . 3]" 1
121 1 9 VAL HA 1 9 VAL MG2 3.200 . 4.000 2.807 2.745 2.892 . 0 0 "[ . 1 . 2 . 3]" 1
122 1 9 VAL HA 1 10 GLU QB 3.200 . 4.000 4.049 4.041 4.054 0.054 8 0 "[ . 1 . 2 . 3]" 1
123 1 9 VAL HA 1 89 LEU MD1 4.000 . 5.000 4.559 4.208 4.673 . 0 0 "[ . 1 . 2 . 3]" 1
124 1 9 VAL HB 1 10 GLU H 3.200 . 4.000 3.953 3.848 4.012 0.012 11 0 "[ . 1 . 2 . 3]" 1
125 1 9 VAL HB 1 51 ARG HA 3.200 . 4.000 3.880 3.578 4.015 0.015 27 0 "[ . 1 . 2 . 3]" 1
126 1 9 VAL HB 1 51 ARG QD 4.000 . 5.000 3.223 1.944 4.672 . 0 0 "[ . 1 . 2 . 3]" 1
127 1 9 VAL HB 1 89 LEU MD1 3.200 . 4.000 3.317 2.991 3.513 . 0 0 "[ . 1 . 2 . 3]" 1
128 1 9 VAL MG1 1 10 GLU H 4.000 . 5.000 4.443 4.424 4.464 . 0 0 "[ . 1 . 2 . 3]" 1
129 1 9 VAL MG1 1 51 ARG QB 3.200 . 4.000 3.508 3.199 3.947 . 0 0 "[ . 1 . 2 . 3]" 1
130 1 9 VAL MG1 1 86 HIS HA 4.000 . 5.000 4.918 4.705 5.027 0.027 23 0 "[ . 1 . 2 . 3]" 1
131 1 9 VAL MG1 1 87 LEU H 4.000 . 5.000 3.052 2.848 3.188 . 0 0 "[ . 1 . 2 . 3]" 1
132 1 9 VAL MG1 1 87 LEU MD2 3.200 . 4.000 3.191 3.089 3.309 . 0 0 "[ . 1 . 2 . 3]" 1
133 1 9 VAL MG1 1 89 LEU MD1 3.200 . 4.000 1.790 1.780 1.798 0.020 23 0 "[ . 1 . 2 . 3]" 1
134 1 9 VAL MG1 1 89 LEU MD2 4.000 . 5.000 2.242 1.992 2.499 . 0 0 "[ . 1 . 2 . 3]" 1
135 1 9 VAL MG2 1 10 GLU HA 4.000 . 5.000 3.543 3.482 3.581 . 0 0 "[ . 1 . 2 . 3]" 1
136 1 9 VAL MG2 1 11 LEU QB 4.000 . 5.000 2.410 2.320 2.550 . 0 0 "[ . 1 . 2 . 3]" 1
137 1 9 VAL MG2 1 11 LEU HG 4.000 . 5.000 4.904 4.805 5.000 . 29 0 "[ . 1 . 2 . 3]" 1
138 1 9 VAL MG2 1 51 ARG QB 3.200 . 4.000 1.897 1.811 2.140 . 0 0 "[ . 1 . 2 . 3]" 1
139 1 9 VAL MG2 1 51 ARG QD 4.000 . 5.000 2.821 2.391 3.558 . 0 0 "[ . 1 . 2 . 3]" 1
140 1 9 VAL MG2 1 85 VAL HB 3.200 . 4.000 3.969 3.806 4.031 0.031 13 0 "[ . 1 . 2 . 3]" 1
141 1 9 VAL MG2 1 86 HIS HA 4.000 . 5.000 4.298 4.086 4.570 . 0 0 "[ . 1 . 2 . 3]" 1
142 1 10 GLU H 1 10 GLU QB 3.200 . 4.000 2.348 2.339 2.360 . 0 0 "[ . 1 . 2 . 3]" 1
143 1 10 GLU H 1 51 ARG QD 4.000 . 5.000 2.410 1.911 3.602 . 0 0 "[ . 1 . 2 . 3]" 1
144 1 10 GLU HA 1 11 LEU H 2.600 . 3.000 2.412 2.378 2.447 . 0 0 "[ . 1 . 2 . 3]" 1
145 1 10 GLU HA 1 86 HIS QB 4.000 . 5.000 4.119 3.676 4.468 . 0 0 "[ . 1 . 2 . 3]" 1
146 1 10 GLU QB 1 11 LEU H 3.200 . 4.000 4.040 4.031 4.044 0.044 7 0 "[ . 1 . 2 . 3]" 1
147 1 10 GLU QB 1 86 HIS HA 3.200 . 4.000 3.675 3.481 3.794 . 0 0 "[ . 1 . 2 . 3]" 1
148 1 10 GLU QB 1 86 HIS HE1 3.200 . 4.000 3.664 3.136 3.995 . 0 0 "[ . 1 . 2 . 3]" 1
149 1 10 GLU HB2 1 87 LEU H 4.000 . 5.000 5.036 5.020 5.053 0.053 23 0 "[ . 1 . 2 . 3]" 1
150 1 11 LEU H 1 11 LEU QB 3.200 . 4.000 2.242 2.207 2.294 . 0 0 "[ . 1 . 2 . 3]" 1
151 1 11 LEU H 1 11 LEU MD1 4.000 . 5.000 3.702 3.556 3.911 . 0 0 "[ . 1 . 2 . 3]" 1
152 1 11 LEU H 1 11 LEU MD2 4.000 . 5.000 4.297 4.200 4.351 . 0 0 "[ . 1 . 2 . 3]" 1
153 1 11 LEU H 1 11 LEU HG 4.000 . 5.000 4.621 4.599 4.664 . 0 0 "[ . 1 . 2 . 3]" 1
154 1 11 LEU H 1 12 ALA H 4.000 . 5.000 4.582 4.574 4.586 . 0 0 "[ . 1 . 2 . 3]" 1
155 1 11 LEU H 1 51 ARG HB2 4.000 . 5.000 5.008 4.870 5.057 0.057 13 0 "[ . 1 . 2 . 3]" 1
156 1 11 LEU H 1 51 ARG HB3 4.000 . 5.000 4.682 4.501 4.853 . 0 0 "[ . 1 . 2 . 3]" 1
157 1 11 LEU H 1 51 ARG QD 3.200 . 4.000 4.011 3.981 4.044 0.044 12 0 "[ . 1 . 2 . 3]" 1
158 1 11 LEU H 1 51 ARG HG3 3.200 . 4.000 3.907 3.192 4.021 0.021 19 0 "[ . 1 . 2 . 3]" 1
159 1 11 LEU H 1 85 VAL H 4.000 . 5.000 3.882 3.722 3.990 . 0 0 "[ . 1 . 2 . 3]" 1
160 1 11 LEU H 1 85 VAL MG1 3.200 . 4.000 2.051 1.907 2.309 . 0 0 "[ . 1 . 2 . 3]" 1
161 1 11 LEU H 1 85 VAL MG2 4.000 . 5.000 4.186 4.015 4.295 . 0 0 "[ . 1 . 2 . 3]" 1
162 1 11 LEU HA 1 11 LEU MD1 3.200 . 4.000 1.901 1.824 1.987 . 0 0 "[ . 1 . 2 . 3]" 1
163 1 11 LEU HA 1 11 LEU QD 3.200 . 4.000 1.896 1.821 1.980 . 0 0 "[ . 1 . 2 . 3]" 1
164 1 11 LEU HA 1 11 LEU HG 3.200 . 4.000 2.753 2.673 2.936 . 0 0 "[ . 1 . 2 . 3]" 1
165 1 11 LEU HA 1 12 ALA H 2.600 . 3.000 2.439 2.388 2.478 . 0 0 "[ . 1 . 2 . 3]" 1
166 1 11 LEU HA 1 85 VAL HB 3.200 . 4.000 3.811 3.671 3.868 . 0 0 "[ . 1 . 2 . 3]" 1
167 1 11 LEU HA 1 85 VAL MG1 3.200 . 4.000 4.070 4.037 4.106 0.106 13 0 "[ . 1 . 2 . 3]" 1
168 1 11 LEU QB 1 11 LEU QD 2.600 . 3.000 1.948 1.922 1.971 . 0 0 "[ . 1 . 2 . 3]" 1
169 1 11 LEU QB 1 45 ALA MB 4.000 . 5.000 4.453 3.973 4.897 . 0 0 "[ . 1 . 2 . 3]" 1
170 1 11 LEU QB 1 46 ALA HA 4.000 . 5.000 4.566 4.457 4.713 . 0 0 "[ . 1 . 2 . 3]" 1
171 1 11 LEU QB 1 85 VAL MG2 3.200 . 4.000 2.677 2.477 2.784 . 0 0 "[ . 1 . 2 . 3]" 1
172 1 11 LEU HB2 1 12 ALA H 3.200 . 4.000 4.020 3.977 4.060 0.060 13 0 "[ . 1 . 2 . 3]" 1
173 1 11 LEU HB2 1 85 VAL H 4.000 . 5.000 5.030 5.008 5.055 0.055 14 0 "[ . 1 . 2 . 3]" 1
174 1 11 LEU HB3 1 13 LYS H 4.000 . 5.000 4.306 4.166 4.455 . 0 0 "[ . 1 . 2 . 3]" 1
175 1 11 LEU HB3 1 85 VAL H 4.000 . 5.000 3.917 3.830 3.961 . 0 0 "[ . 1 . 2 . 3]" 1
176 1 11 LEU QD 1 18 LEU HA 4.000 . 5.000 3.190 2.811 3.575 . 0 0 "[ . 1 . 2 . 3]" 1
177 1 11 LEU QD 1 45 ALA MB 3.200 . 4.000 2.292 1.838 2.932 . 0 0 "[ . 1 . 2 . 3]" 1
178 1 11 LEU QD 1 46 ALA HA 2.600 . 3.000 2.138 2.020 2.382 . 0 0 "[ . 1 . 2 . 3]" 1
179 1 11 LEU QD 1 46 ALA MB 2.600 . 3.000 3.015 2.939 3.041 0.041 29 0 "[ . 1 . 2 . 3]" 1
180 1 11 LEU QD 1 49 ASP HA 3.200 . 4.000 4.032 3.998 4.080 0.080 29 0 "[ . 1 . 2 . 3]" 1
181 1 11 LEU QD 1 49 ASP QB 3.200 . 4.000 1.835 1.784 1.896 0.016 21 0 "[ . 1 . 2 . 3]" 1
182 1 11 LEU QD 1 51 ARG QB 4.000 . 5.000 2.109 1.797 2.689 0.003 24 0 "[ . 1 . 2 . 3]" 1
183 1 11 LEU QD 1 85 VAL HB 3.200 . 4.000 3.603 3.435 3.695 . 0 0 "[ . 1 . 2 . 3]" 1
184 1 11 LEU MD1 1 12 ALA H 3.200 . 4.000 3.102 2.659 3.277 . 0 0 "[ . 1 . 2 . 3]" 1
185 1 11 LEU MD1 1 49 ASP H 3.200 . 4.000 3.846 3.616 4.015 0.015 19 0 "[ . 1 . 2 . 3]" 1
186 1 11 LEU MD1 1 49 ASP HA 4.000 . 5.000 4.150 4.098 4.202 . 0 0 "[ . 1 . 2 . 3]" 1
187 1 11 LEU MD2 1 46 ALA HA 2.600 . 3.000 2.163 2.038 2.440 . 0 0 "[ . 1 . 2 . 3]" 1
188 1 11 LEU HG 1 12 ALA H 2.600 . 3.000 2.119 1.981 2.236 . 0 0 "[ . 1 . 2 . 3]" 1
189 1 12 ALA H 1 12 ALA MB 2.600 . 3.000 2.332 2.297 2.360 . 0 0 "[ . 1 . 2 . 3]" 1
190 1 12 ALA H 1 85 VAL HB 3.200 . 4.000 3.906 3.825 4.009 0.009 28 0 "[ . 1 . 2 . 3]" 1
191 1 12 ALA HA 1 13 LYS H 2.600 . 3.000 2.204 2.175 2.231 . 0 0 "[ . 1 . 2 . 3]" 1
192 1 12 ALA HA 1 13 LYS QB 4.000 . 5.000 4.088 4.045 4.154 . 0 0 "[ . 1 . 2 . 3]" 1
193 1 12 ALA HA 1 14 ASN H 4.000 . 5.000 3.524 3.348 4.313 . 0 0 "[ . 1 . 2 . 3]" 1
194 1 12 ALA HA 1 84 VAL HA 2.600 . 3.000 2.779 2.698 2.870 . 0 0 "[ . 1 . 2 . 3]" 1
195 1 12 ALA HA 1 84 VAL MG1 2.600 . 3.000 2.438 2.194 2.649 . 0 0 "[ . 1 . 2 . 3]" 1
196 1 12 ALA HA 1 84 VAL MG2 2.600 . 3.000 3.025 3.022 3.031 0.031 26 0 "[ . 1 . 2 . 3]" 1
197 1 12 ALA HA 1 85 VAL H 3.200 . 4.000 2.783 2.728 2.859 . 0 0 "[ . 1 . 2 . 3]" 1
198 1 12 ALA HA 1 85 VAL HB 3.200 . 4.000 3.967 3.910 4.041 0.041 28 0 "[ . 1 . 2 . 3]" 1
199 1 12 ALA MB 1 13 LYS H 4.000 . 5.000 3.525 3.479 3.561 . 0 0 "[ . 1 . 2 . 3]" 1
200 1 12 ALA MB 1 14 ASN H 4.000 . 5.000 3.138 2.741 3.485 . 0 0 "[ . 1 . 2 . 3]" 1
201 1 12 ALA MB 1 14 ASN QD 4.000 . 5.000 4.679 3.523 5.023 0.023 26 0 "[ . 1 . 2 . 3]" 1
202 1 12 ALA MB 1 84 VAL HA 3.200 . 4.000 4.044 4.015 4.082 0.082 13 0 "[ . 1 . 2 . 3]" 1
203 1 13 LYS H 1 13 LYS HB2 3.200 . 4.000 2.242 2.095 2.578 . 0 0 "[ . 1 . 2 . 3]" 1
204 1 13 LYS H 1 13 LYS HB3 3.200 . 4.000 2.835 2.449 2.992 . 0 0 "[ . 1 . 2 . 3]" 1
205 1 13 LYS H 1 14 ASN H 4.000 . 5.000 2.882 2.622 3.666 . 0 0 "[ . 1 . 2 . 3]" 1
206 1 13 LYS H 1 14 ASN HB2 4.000 . 5.000 4.810 4.507 5.003 0.003 8 0 "[ . 1 . 2 . 3]" 1
207 1 13 LYS H 1 84 VAL HA 2.600 . 3.000 1.943 1.896 1.995 . 0 0 "[ . 1 . 2 . 3]" 1
208 1 13 LYS H 1 84 VAL MG1 3.200 . 4.000 3.121 2.971 3.299 . 0 0 "[ . 1 . 2 . 3]" 1
209 1 13 LYS H 1 84 VAL MG2 4.000 . 5.000 3.673 3.584 3.758 . 0 0 "[ . 1 . 2 . 3]" 1
210 1 13 LYS H 1 85 VAL H 4.000 . 5.000 2.139 1.966 2.389 . 0 0 "[ . 1 . 2 . 3]" 1
211 1 13 LYS H 1 85 VAL HB 3.200 . 4.000 3.259 3.094 3.446 . 0 0 "[ . 1 . 2 . 3]" 1
212 1 13 LYS H 1 85 VAL MG2 4.000 . 5.000 2.625 2.371 2.863 . 0 0 "[ . 1 . 2 . 3]" 1
213 1 13 LYS HA 1 13 LYS QD 3.200 . 4.000 2.677 1.868 3.045 . 0 0 "[ . 1 . 2 . 3]" 1
214 1 13 LYS HA 1 13 LYS QE 4.000 . 5.000 2.282 1.915 3.007 . 0 0 "[ . 1 . 2 . 3]" 1
215 1 13 LYS HA 1 13 LYS QG 3.200 . 4.000 2.583 2.327 3.149 . 0 0 "[ . 1 . 2 . 3]" 1
216 1 13 LYS HA 1 14 ASN H 3.200 . 4.000 3.282 2.511 3.505 . 0 0 "[ . 1 . 2 . 3]" 1
217 1 13 LYS HA 1 17 SER HA 4.000 . 5.000 3.593 3.161 3.939 . 0 0 "[ . 1 . 2 . 3]" 1
218 1 13 LYS HA 1 85 VAL MG2 4.000 . 5.000 2.214 1.927 2.725 . 0 0 "[ . 1 . 2 . 3]" 1
219 1 13 LYS QB 1 85 VAL MG2 3.200 . 4.000 1.893 1.773 2.061 0.027 23 0 "[ . 1 . 2 . 3]" 1
220 1 13 LYS HB2 1 13 LYS QE 4.000 . 5.000 3.446 2.281 3.967 . 0 0 "[ . 1 . 2 . 3]" 1
221 1 13 LYS HB2 1 14 ASN H 4.000 . 5.000 4.006 3.608 4.597 . 0 0 "[ . 1 . 2 . 3]" 1
222 1 13 LYS HB3 1 13 LYS HE2 3.200 . 4.000 3.886 3.765 4.105 0.105 23 0 "[ . 1 . 2 . 3]" 1
223 1 13 LYS HB3 1 14 ASN H 3.200 . 4.000 3.342 2.859 4.223 0.223 13 0 "[ . 1 . 2 . 3]" 1
224 1 13 LYS HB3 1 84 VAL H 3.200 . 4.000 4.026 3.962 4.059 0.059 21 0 "[ . 1 . 2 . 3]" 1
225 1 13 LYS HD3 1 14 ASN H 3.200 . 4.000 4.048 4.016 4.090 0.090 23 0 "[ . 1 . 2 . 3]" 1
226 1 13 LYS QE 1 13 LYS QG 3.200 . 4.000 2.120 1.958 2.226 . 0 0 "[ . 1 . 2 . 3]" 1
227 1 13 LYS QE 1 17 SER H 4.000 . 5.000 4.400 3.331 5.032 0.032 23 0 "[ . 1 . 2 . 3]" 1
228 1 13 LYS QE 1 85 VAL MG1 4.000 . 5.000 4.777 3.900 5.036 0.036 13 0 "[ . 1 . 2 . 3]" 1
229 1 13 LYS QE 1 85 VAL MG2 3.200 . 4.000 2.785 1.944 3.205 . 0 0 "[ . 1 . 2 . 3]" 1
230 1 14 ASN H 1 14 ASN QB 3.200 . 4.000 2.312 2.154 2.448 . 0 0 "[ . 1 . 2 . 3]" 1
231 1 14 ASN H 1 84 VAL HA 4.000 . 5.000 3.521 2.838 4.987 . 0 0 "[ . 1 . 2 . 3]" 1
232 1 14 ASN HA 1 15 ASP H 3.200 . 4.000 2.896 2.129 3.572 . 0 0 "[ . 1 . 2 . 3]" 1
233 1 14 ASN HA 1 15 ASP HA 4.000 . 5.000 4.582 4.298 4.839 . 0 0 "[ . 1 . 2 . 3]" 1
234 1 14 ASN HA 1 16 ASN H 4.000 . 5.000 4.040 3.287 4.533 . 0 0 "[ . 1 . 2 . 3]" 1
235 1 14 ASN HB3 1 15 ASP H 4.000 . 5.000 3.239 1.904 4.380 . 0 0 "[ . 1 . 2 . 3]" 1
236 1 15 ASP H 1 15 ASP HB2 4.000 . 5.000 2.880 2.093 3.806 . 0 0 "[ . 1 . 2 . 3]" 1
237 1 15 ASP H 1 15 ASP HB3 3.200 . 4.000 3.490 2.602 4.062 0.062 26 0 "[ . 1 . 2 . 3]" 1
238 1 15 ASP HB2 1 16 ASN H 4.000 . 5.000 3.532 2.589 4.398 . 0 0 "[ . 1 . 2 . 3]" 1
239 1 16 ASN H 1 16 ASN HB2 3.200 . 4.000 3.179 2.824 3.984 . 0 0 "[ . 1 . 2 . 3]" 1
240 1 16 ASN H 1 16 ASN HB3 3.200 . 4.000 3.608 3.304 3.897 . 0 0 "[ . 1 . 2 . 3]" 1
241 1 16 ASN H 1 45 ALA MB 4.000 . 5.000 4.426 3.767 4.937 . 0 0 "[ . 1 . 2 . 3]" 1
242 1 16 ASN HA 1 17 SER H 3.200 . 4.000 2.319 2.140 2.542 . 0 0 "[ . 1 . 2 . 3]" 1
243 1 16 ASN HA 1 17 SER QB 4.000 . 5.000 4.499 4.006 4.904 . 0 0 "[ . 1 . 2 . 3]" 1
244 1 16 ASN QB 1 45 ALA HA 3.200 . 4.000 3.991 3.790 4.031 0.031 23 0 "[ . 1 . 2 . 3]" 1
245 1 16 ASN QB 1 45 ALA MB 3.200 . 4.000 1.896 1.809 2.120 . 0 0 "[ . 1 . 2 . 3]" 1
246 1 16 ASN HB2 1 16 ASN QD 3.200 . 4.000 2.728 2.100 3.346 . 0 0 "[ . 1 . 2 . 3]" 1
247 1 16 ASN HB3 1 16 ASN QD 3.200 . 4.000 2.581 2.105 3.325 . 0 0 "[ . 1 . 2 . 3]" 1
248 1 16 ASN HB3 1 17 SER H 3.200 . 4.000 3.153 2.169 4.023 0.023 29 0 "[ . 1 . 2 . 3]" 1
249 1 17 SER H 1 17 SER QB 3.200 . 4.000 2.562 2.121 2.958 . 0 0 "[ . 1 . 2 . 3]" 1
250 1 17 SER H 1 45 ALA MB 4.000 . 5.000 3.561 2.946 4.032 . 0 0 "[ . 1 . 2 . 3]" 1
251 1 17 SER HA 1 18 LEU H 4.000 . 5.000 2.855 2.695 3.542 . 0 0 "[ . 1 . 2 . 3]" 1
252 1 17 SER HA 1 85 VAL MG2 4.000 . 5.000 4.210 3.066 4.722 . 0 0 "[ . 1 . 2 . 3]" 1
253 1 17 SER QB 1 18 LEU HA 3.200 . 4.000 4.083 4.025 4.145 0.145 21 0 "[ . 1 . 2 . 3]" 1
254 1 18 LEU HA 1 18 LEU MD1 3.200 . 4.000 2.433 1.907 3.943 . 0 0 "[ . 1 . 2 . 3]" 1
255 1 18 LEU HA 1 18 LEU MD2 3.200 . 4.000 3.125 2.045 3.585 . 0 0 "[ . 1 . 2 . 3]" 1
256 1 18 LEU HA 1 18 LEU HG 3.200 . 4.000 3.471 2.304 3.806 . 0 0 "[ . 1 . 2 . 3]" 1
257 1 18 LEU HA 1 45 ALA MB 2.600 . 3.000 3.025 2.979 3.055 0.055 23 0 "[ . 1 . 2 . 3]" 1
258 1 18 LEU HA 1 46 ALA HA 3.200 . 4.000 3.908 3.598 4.039 0.039 27 0 "[ . 1 . 2 . 3]" 1
259 1 18 LEU HA 1 46 ALA MB 4.000 . 5.000 2.592 2.336 2.835 . 0 0 "[ . 1 . 2 . 3]" 1
260 1 18 LEU QB 1 20 ILE H 4.000 . 5.000 2.782 2.516 3.011 . 0 0 "[ . 1 . 2 . 3]" 1
261 1 18 LEU QB 1 20 ILE MD 4.000 . 5.000 5.020 3.799 5.109 0.109 24 0 "[ . 1 . 2 . 3]" 1
262 1 18 LEU QB 1 20 ILE MG 4.000 . 5.000 3.923 3.665 4.168 . 0 0 "[ . 1 . 2 . 3]" 1
263 1 18 LEU QB 1 46 ALA MB 4.000 . 5.000 2.248 1.932 2.701 . 0 0 "[ . 1 . 2 . 3]" 1
264 1 18 LEU MD1 1 85 VAL MG1 2.600 . 3.000 2.479 1.937 3.010 0.010 18 0 "[ . 1 . 2 . 3]" 1
265 1 18 LEU MD2 1 79 ARG HA 4.000 . 5.000 3.182 2.025 5.002 0.002 4 0 "[ . 1 . 2 . 3]" 1
266 1 18 LEU MD2 1 85 VAL MG2 3.200 . 4.000 2.684 1.843 3.667 . 0 0 "[ . 1 . 2 . 3]" 1
267 1 18 LEU HG 1 85 VAL MG1 4.000 . 5.000 3.892 3.201 4.557 . 0 0 "[ . 1 . 2 . 3]" 1
268 1 19 GLY H 1 20 ILE H 3.200 . 4.000 2.172 1.938 2.383 . 0 0 "[ . 1 . 2 . 3]" 1
269 1 19 GLY QA 1 20 ILE HA 4.000 . 5.000 4.006 3.985 4.017 . 0 0 "[ . 1 . 2 . 3]" 1
270 1 19 GLY QA 1 20 ILE MG 4.000 . 5.000 4.879 3.678 5.001 0.001 13 0 "[ . 1 . 2 . 3]" 1
271 1 19 GLY QA 1 46 ALA MB 4.000 . 5.000 2.905 2.189 3.480 . 0 0 "[ . 1 . 2 . 3]" 1
272 1 19 GLY HA2 1 20 ILE H 3.200 . 4.000 2.830 2.729 3.079 . 0 0 "[ . 1 . 2 . 3]" 1
273 1 19 GLY HA2 1 41 ILE MG 3.200 . 4.000 4.041 4.020 4.114 0.114 27 0 "[ . 1 . 2 . 3]" 1
274 1 19 GLY HA3 1 20 ILE H 3.200 . 4.000 3.506 3.468 3.534 . 0 0 "[ . 1 . 2 . 3]" 1
275 1 19 GLY HA3 1 45 ALA H 3.200 . 4.000 4.050 3.919 4.091 0.091 16 0 "[ . 1 . 2 . 3]" 1
276 1 20 ILE H 1 20 ILE HB 3.200 . 4.000 2.486 2.377 3.812 . 0 0 "[ . 1 . 2 . 3]" 1
277 1 20 ILE H 1 20 ILE MD 4.000 . 5.000 4.572 3.665 4.630 . 0 0 "[ . 1 . 2 . 3]" 1
278 1 20 ILE H 1 20 ILE HG12 4.000 . 5.000 4.384 2.263 4.540 . 0 0 "[ . 1 . 2 . 3]" 1
279 1 20 ILE H 1 20 ILE HG13 4.000 . 5.000 4.164 3.615 4.283 . 0 0 "[ . 1 . 2 . 3]" 1
280 1 20 ILE H 1 20 ILE MG 3.200 . 4.000 2.956 2.714 3.083 . 0 0 "[ . 1 . 2 . 3]" 1
281 1 20 ILE HA 1 20 ILE MD 4.000 . 5.000 3.629 3.570 4.199 . 0 0 "[ . 1 . 2 . 3]" 1
282 1 20 ILE HA 1 20 ILE QG 3.200 . 4.000 2.091 2.005 3.283 . 0 0 "[ . 1 . 2 . 3]" 1
283 1 20 ILE HA 1 20 ILE MG 3.200 . 4.000 2.991 2.435 3.046 . 0 0 "[ . 1 . 2 . 3]" 1
284 1 20 ILE HA 1 39 ALA H 4.000 . 5.000 5.047 4.176 5.129 0.129 11 0 "[ . 1 . 2 . 3]" 1
285 1 20 ILE HA 1 40 VAL HA 2.600 . 3.000 2.751 2.383 3.041 0.041 16 0 "[ . 1 . 2 . 3]" 1
286 1 20 ILE HA 1 41 ILE H 3.200 . 4.000 1.977 1.883 2.077 . 0 0 "[ . 1 . 2 . 3]" 1
287 1 20 ILE HA 1 41 ILE MD 4.000 . 5.000 2.660 2.563 3.798 . 0 0 "[ . 1 . 2 . 3]" 1
288 1 20 ILE HA 1 41 ILE QG 3.200 . 4.000 3.374 2.056 3.729 . 0 0 "[ . 1 . 2 . 3]" 1
289 1 20 ILE HA 1 41 ILE MG 4.000 . 5.000 4.467 4.162 4.736 . 0 0 "[ . 1 . 2 . 3]" 1
290 1 20 ILE HB 1 20 ILE MD 3.200 . 4.000 2.623 2.507 2.696 . 0 0 "[ . 1 . 2 . 3]" 1
291 1 20 ILE HB 1 22 VAL MG1 4.000 . 5.000 3.963 3.750 4.144 . 0 0 "[ . 1 . 2 . 3]" 1
292 1 20 ILE HB 1 41 ILE MD 4.000 . 5.000 5.031 5.013 5.058 0.058 5 0 "[ . 1 . 2 . 3]" 1
293 1 20 ILE HB 1 52 ILE MG 4.000 . 5.000 2.688 2.045 4.324 . 0 0 "[ . 1 . 2 . 3]" 1
294 1 20 ILE MD 1 37 VAL HA 4.000 . 5.000 3.872 3.329 4.446 . 0 0 "[ . 1 . 2 . 3]" 1
295 1 20 ILE MD 1 38 LYS H 3.200 . 4.000 3.930 3.644 4.091 0.091 5 0 "[ . 1 . 2 . 3]" 1
296 1 20 ILE MD 1 52 ILE QG 3.200 . 4.000 1.955 1.744 3.092 0.056 24 0 "[ . 1 . 2 . 3]" 1
297 1 20 ILE MD 1 52 ILE MG 3.200 . 4.000 1.774 1.743 1.793 0.057 16 0 "[ . 1 . 2 . 3]" 1
298 1 20 ILE QG 1 22 VAL MG1 3.200 . 4.000 4.015 1.854 4.134 0.134 13 0 "[ . 1 . 2 . 3]" 1
299 1 20 ILE QG 1 38 LYS H 4.000 . 5.000 4.849 3.847 5.007 0.007 29 0 "[ . 1 . 2 . 3]" 1
300 1 20 ILE QG 1 39 ALA H 3.200 . 4.000 3.735 3.601 4.128 0.128 21 0 "[ . 1 . 2 . 3]" 1
301 1 20 ILE MG 1 37 VAL HB 4.000 . 5.000 2.539 2.298 3.383 . 0 0 "[ . 1 . 2 . 3]" 1
302 1 20 ILE MG 1 38 LYS H 4.000 . 5.000 3.839 3.544 5.035 0.035 21 0 "[ . 1 . 2 . 3]" 1
303 1 20 ILE MG 1 39 ALA H 3.200 . 4.000 3.947 3.698 4.143 0.143 21 0 "[ . 1 . 2 . 3]" 1
304 1 20 ILE MG 1 40 VAL HA 3.200 . 4.000 4.053 2.016 4.161 0.161 17 0 "[ . 1 . 2 . 3]" 1
305 1 20 ILE MG 1 41 ILE H 4.000 . 5.000 4.452 3.238 4.640 . 0 0 "[ . 1 . 2 . 3]" 1
306 1 20 ILE MG 1 41 ILE QG 4.000 . 5.000 4.875 4.047 5.036 0.036 30 0 "[ . 1 . 2 . 3]" 1
307 1 20 ILE MG 1 46 ALA MB 3.200 . 4.000 3.871 2.091 4.026 0.026 22 0 "[ . 1 . 2 . 3]" 1
308 1 21 SER H 1 21 SER QB 3.200 . 4.000 2.321 2.240 2.620 . 0 0 "[ . 1 . 2 . 3]" 1
309 1 21 SER H 1 38 LYS H 6.000 4.500 7.000 4.643 4.422 4.867 0.078 21 0 "[ . 1 . 2 . 3]" 1
310 1 21 SER H 1 39 ALA H 3.200 . 4.000 3.512 3.140 3.665 . 0 0 "[ . 1 . 2 . 3]" 1
311 1 21 SER HA 1 22 VAL H 3.200 . 4.000 2.188 2.172 2.208 . 0 0 "[ . 1 . 2 . 3]" 1
312 1 21 SER HA 1 22 VAL MG1 4.000 . 5.000 3.773 3.390 4.132 . 0 0 "[ . 1 . 2 . 3]" 1
313 1 21 SER QB 1 38 LYS H 6.000 4.500 7.000 4.483 4.458 4.663 0.042 14 0 "[ . 1 . 2 . 3]" 1
314 1 21 SER QB 1 39 ALA H 3.200 . 4.000 3.543 3.263 4.045 0.045 26 0 "[ . 1 . 2 . 3]" 1
315 1 21 SER QB 1 39 ALA MB 4.000 . 5.000 3.753 3.422 4.015 . 0 0 "[ . 1 . 2 . 3]" 1
316 1 21 SER QB 1 41 ILE MD 3.200 . 4.000 1.858 1.752 2.424 0.048 28 0 "[ . 1 . 2 . 3]" 1
317 1 21 SER QB 1 41 ILE MG 3.200 . 4.000 4.056 4.037 4.093 0.093 14 0 "[ . 1 . 2 . 3]" 1
318 1 22 VAL H 1 22 VAL HB 4.000 . 5.000 3.668 3.622 3.684 . 0 0 "[ . 1 . 2 . 3]" 1
319 1 22 VAL H 1 22 VAL MG1 4.000 . 5.000 2.400 1.908 2.807 . 0 0 "[ . 1 . 2 . 3]" 1
320 1 22 VAL H 1 22 VAL MG2 3.200 . 4.000 2.230 1.974 2.557 . 0 0 "[ . 1 . 2 . 3]" 1
321 1 22 VAL H 1 38 LYS H 6.000 4.500 7.000 4.467 4.399 4.524 0.101 26 0 "[ . 1 . 2 . 3]" 1
322 1 22 VAL HA 1 22 VAL MG1 3.200 . 4.000 2.377 2.219 2.684 . 0 0 "[ . 1 . 2 . 3]" 1
323 1 22 VAL HA 1 22 VAL MG2 3.200 . 4.000 3.187 3.155 3.200 . 0 0 "[ . 1 . 2 . 3]" 1
324 1 22 VAL HA 1 23 THR H 3.200 . 4.000 2.255 2.205 2.296 . 0 0 "[ . 1 . 2 . 3]" 1
325 1 22 VAL HA 1 23 THR MG 4.000 . 5.000 4.565 3.510 5.069 0.069 19 0 "[ . 1 . 2 . 3]" 1
326 1 22 VAL HA 1 38 LYS H 3.200 . 4.000 2.088 2.012 2.198 . 0 0 "[ . 1 . 2 . 3]" 1
327 1 22 VAL HA 1 38 LYS HA 4.000 . 5.000 4.697 4.540 4.896 . 0 0 "[ . 1 . 2 . 3]" 1
328 1 22 VAL HA 1 39 ALA H 3.200 . 4.000 4.010 3.938 4.077 0.077 21 0 "[ . 1 . 2 . 3]" 1
329 1 22 VAL HB 1 23 THR H 3.200 . 4.000 2.635 2.506 2.789 . 0 0 "[ . 1 . 2 . 3]" 1
330 1 22 VAL HB 1 38 LYS H 4.000 . 5.000 4.308 4.031 4.626 . 0 0 "[ . 1 . 2 . 3]" 1
331 1 22 VAL MG1 1 75 VAL HA 4.000 . 5.000 3.769 3.510 3.985 . 0 0 "[ . 1 . 2 . 3]" 1
332 1 22 VAL MG1 1 75 VAL HB 4.000 . 5.000 5.079 5.027 5.118 0.118 17 0 "[ . 1 . 2 . 3]" 1
333 1 22 VAL MG2 1 23 THR HA 4.000 . 5.000 3.610 3.142 4.062 . 0 0 "[ . 1 . 2 . 3]" 1
334 1 22 VAL MG2 1 35 ILE MD 3.200 . 4.000 2.399 1.781 3.177 0.019 23 0 "[ . 1 . 2 . 3]" 1
335 1 22 VAL MG2 1 35 ILE QG 4.000 . 5.000 3.769 3.218 4.326 . 0 0 "[ . 1 . 2 . 3]" 1
336 1 22 VAL MG2 1 37 VAL HA 4.000 . 5.000 4.328 3.803 4.732 . 0 0 "[ . 1 . 2 . 3]" 1
337 1 22 VAL MG2 1 71 HIS HA 4.000 . 5.000 4.324 3.655 4.677 . 0 0 "[ . 1 . 2 . 3]" 1
338 1 22 VAL MG2 1 71 HIS HD2 3.200 . 4.000 1.894 1.811 2.088 . 0 0 "[ . 1 . 2 . 3]" 1
339 1 22 VAL MG2 1 71 HIS HE1 3.200 . 4.000 3.831 3.554 3.971 . 0 0 "[ . 1 . 2 . 3]" 1
340 1 22 VAL MG2 1 74 ALA MB 3.200 . 4.000 3.909 3.562 4.013 0.013 8 0 "[ . 1 . 2 . 3]" 1
341 1 22 VAL MG2 1 75 VAL HA 3.200 . 4.000 3.009 2.767 3.225 . 0 0 "[ . 1 . 2 . 3]" 1
342 1 22 VAL MG2 1 75 VAL HB 4.000 . 5.000 3.135 2.994 3.393 . 0 0 "[ . 1 . 2 . 3]" 1
343 1 23 THR H 1 23 THR HB 3.200 . 4.000 3.329 3.103 3.869 . 0 0 "[ . 1 . 2 . 3]" 1
344 1 23 THR H 1 23 THR MG 3.200 . 4.000 3.486 2.345 3.977 . 0 0 "[ . 1 . 2 . 3]" 1
345 1 23 THR H 1 38 LYS HB2 4.000 . 5.000 4.318 3.384 4.787 . 0 0 "[ . 1 . 2 . 3]" 1
346 1 23 THR H 1 38 LYS HB3 4.000 . 5.000 3.952 3.317 5.036 0.036 26 0 "[ . 1 . 2 . 3]" 1
347 1 23 THR HA 1 23 THR MG 3.200 . 4.000 2.475 2.014 3.219 . 0 0 "[ . 1 . 2 . 3]" 1
348 1 23 THR HA 1 24 GLY H 2.600 . 3.000 2.602 2.319 2.696 . 0 0 "[ . 1 . 2 . 3]" 1
349 1 23 THR HA 1 71 HIS HD2 3.200 . 4.000 4.005 3.868 4.042 0.042 5 0 "[ . 1 . 2 . 3]" 1
350 1 23 THR HA 1 71 HIS HE1 3.200 . 4.000 3.649 2.711 4.022 0.022 14 0 "[ . 1 . 2 . 3]" 1
351 1 23 THR HB 1 38 LYS HB2 3.200 . 4.000 3.414 2.441 4.030 0.030 11 0 "[ . 1 . 2 . 3]" 1
352 1 23 THR HB 1 38 LYS HB3 3.200 . 4.000 4.031 4.001 4.060 0.060 6 0 "[ . 1 . 2 . 3]" 1
353 1 23 THR HB 1 38 LYS QD 4.000 . 5.000 4.679 3.305 5.025 0.025 19 0 "[ . 1 . 2 . 3]" 1
354 1 23 THR MG 1 38 LYS HA 4.000 . 5.000 4.244 2.369 5.017 0.017 18 0 "[ . 1 . 2 . 3]" 1
355 1 23 THR MG 1 38 LYS HB2 3.200 . 4.000 3.103 1.854 3.783 . 0 0 "[ . 1 . 2 . 3]" 1
356 1 23 THR MG 1 38 LYS HB3 3.200 . 4.000 3.654 1.982 4.014 0.014 25 0 "[ . 1 . 2 . 3]" 1
357 1 23 THR MG 1 38 LYS QG 4.000 . 5.000 4.150 1.864 4.958 . 0 0 "[ . 1 . 2 . 3]" 1
358 1 23 THR MG 1 71 HIS HE1 4.000 . 5.000 4.452 3.919 5.116 0.116 24 0 "[ . 1 . 2 . 3]" 1
359 1 24 GLY HA2 1 25 GLY H 4.000 . 5.000 3.166 2.133 3.332 . 0 0 "[ . 1 . 2 . 3]" 1
360 1 24 GLY HA2 1 26 VAL H 3.200 . 4.000 3.990 3.871 4.023 0.023 17 0 "[ . 1 . 2 . 3]" 1
361 1 24 GLY HA3 1 25 GLY H 3.200 . 4.000 2.254 2.129 3.321 . 0 0 "[ . 1 . 2 . 3]" 1
362 1 24 GLY HA3 1 30 VAL MG1 3.200 . 4.000 2.885 2.396 3.256 . 0 0 "[ . 1 . 2 . 3]" 1
363 1 24 GLY HA3 1 35 ILE HA 4.000 . 5.000 4.552 4.224 4.863 . 0 0 "[ . 1 . 2 . 3]" 1
364 1 24 GLY HA3 1 35 ILE MD 4.000 . 5.000 4.677 4.005 5.056 0.056 17 0 "[ . 1 . 2 . 3]" 1
365 1 25 GLY H 1 30 VAL MG1 4.000 . 5.000 2.184 1.888 2.980 . 0 0 "[ . 1 . 2 . 3]" 1
366 1 25 GLY H 1 30 VAL MG2 4.000 . 5.000 3.538 2.582 3.963 . 0 0 "[ . 1 . 2 . 3]" 1
367 1 25 GLY H 1 35 ILE MD 4.000 . 5.000 4.201 3.696 4.875 . 0 0 "[ . 1 . 2 . 3]" 1
368 1 25 GLY H 1 35 ILE QG 3.200 . 4.000 3.140 2.636 4.073 0.073 18 0 "[ . 1 . 2 . 3]" 1
369 1 25 GLY HA2 1 26 VAL H 3.200 . 4.000 3.551 3.525 3.560 . 0 0 "[ . 1 . 2 . 3]" 1
370 1 25 GLY HA2 1 30 VAL MG1 4.000 . 5.000 2.782 2.253 3.461 . 0 0 "[ . 1 . 2 . 3]" 1
371 1 25 GLY HA2 1 30 VAL MG2 4.000 . 5.000 3.037 1.953 3.487 . 0 0 "[ . 1 . 2 . 3]" 1
372 1 25 GLY HA2 1 34 GLY H 4.000 . 5.000 4.642 4.506 4.763 . 0 0 "[ . 1 . 2 . 3]" 1
373 1 25 GLY HA2 1 71 HIS H 3.200 . 4.000 4.065 4.044 4.085 0.085 23 0 "[ . 1 . 2 . 3]" 1
374 1 25 GLY HA3 1 26 VAL H 3.200 . 4.000 2.541 2.495 2.836 . 0 0 "[ . 1 . 2 . 3]" 1
375 1 25 GLY HA3 1 30 VAL MG1 4.000 . 5.000 3.901 3.440 4.382 . 0 0 "[ . 1 . 2 . 3]" 1
376 1 25 GLY HA3 1 35 ILE MD 4.000 . 5.000 3.736 3.434 4.399 . 0 0 "[ . 1 . 2 . 3]" 1
377 1 25 GLY HA3 1 71 HIS H 3.200 . 4.000 2.466 2.436 2.496 . 0 0 "[ . 1 . 2 . 3]" 1
378 1 26 VAL H 1 26 VAL HB 3.200 . 4.000 3.630 3.596 3.671 . 0 0 "[ . 1 . 2 . 3]" 1
379 1 26 VAL H 1 26 VAL MG1 3.200 . 4.000 2.583 2.327 2.782 . 0 0 "[ . 1 . 2 . 3]" 1
380 1 26 VAL H 1 26 VAL MG2 3.200 . 4.000 1.980 1.894 2.065 . 0 0 "[ . 1 . 2 . 3]" 1
381 1 26 VAL H 1 27 ASN H 4.000 . 5.000 4.593 4.529 4.656 . 0 0 "[ . 1 . 2 . 3]" 1
382 1 26 VAL H 1 70 THR HA 3.200 . 4.000 2.838 2.777 2.966 . 0 0 "[ . 1 . 2 . 3]" 1
383 1 26 VAL H 1 70 THR HB 4.000 . 5.000 2.796 2.680 2.907 . 0 0 "[ . 1 . 2 . 3]" 1
384 1 26 VAL H 1 70 THR MG 4.000 . 5.000 4.021 3.924 4.203 . 0 0 "[ . 1 . 2 . 3]" 1
385 1 26 VAL H 1 71 HIS H 4.000 . 5.000 2.005 1.941 2.230 . 0 0 "[ . 1 . 2 . 3]" 1
386 1 26 VAL H 1 71 HIS HA 4.000 . 5.000 3.936 3.831 4.245 . 0 0 "[ . 1 . 2 . 3]" 1
387 1 26 VAL H 1 71 HIS HB3 4.000 . 5.000 2.939 2.763 3.370 . 0 0 "[ . 1 . 2 . 3]" 1
388 1 26 VAL HA 1 26 VAL MG1 3.200 . 4.000 2.141 2.006 2.229 . 0 0 "[ . 1 . 2 . 3]" 1
389 1 26 VAL HA 1 26 VAL MG2 3.200 . 4.000 3.125 3.091 3.159 . 0 0 "[ . 1 . 2 . 3]" 1
390 1 26 VAL HA 1 27 ASN H 3.200 . 4.000 2.215 2.149 2.386 . 0 0 "[ . 1 . 2 . 3]" 1
391 1 26 VAL HA 1 70 THR MG 4.000 . 5.000 2.068 1.938 2.388 . 0 0 "[ . 1 . 2 . 3]" 1
392 1 26 VAL HB 1 27 ASN H 4.000 . 5.000 2.970 2.456 3.249 . 0 0 "[ . 1 . 2 . 3]" 1
393 1 26 VAL HB 1 28 THR H 3.200 . 4.000 3.389 3.196 3.697 . 0 0 "[ . 1 . 2 . 3]" 1
394 1 26 VAL HB 1 70 THR HA 4.000 . 5.000 4.552 4.430 4.739 . 0 0 "[ . 1 . 2 . 3]" 1
395 1 26 VAL HB 1 70 THR HB 4.000 . 5.000 4.020 3.850 4.200 . 0 0 "[ . 1 . 2 . 3]" 1
396 1 26 VAL HB 1 70 THR MG 4.000 . 5.000 3.701 3.317 3.978 . 0 0 "[ . 1 . 2 . 3]" 1
397 1 26 VAL MG1 1 70 THR HA 3.200 . 4.000 3.419 3.283 3.615 . 0 0 "[ . 1 . 2 . 3]" 1
398 1 26 VAL MG1 1 70 THR HB 4.000 . 5.000 1.908 1.827 2.106 . 0 0 "[ . 1 . 2 . 3]" 1
399 1 26 VAL MG1 1 70 THR MG 3.200 . 4.000 1.996 1.847 2.336 . 0 0 "[ . 1 . 2 . 3]" 1
400 1 26 VAL MG1 1 71 HIS HB2 4.000 . 5.000 4.791 4.471 5.007 0.007 18 0 "[ . 1 . 2 . 3]" 1
401 1 26 VAL MG1 1 71 HIS HB3 3.200 . 4.000 3.547 3.193 3.780 . 0 0 "[ . 1 . 2 . 3]" 1
402 1 26 VAL MG2 1 29 SER H 4.000 . 5.000 2.824 2.247 3.273 . 0 0 "[ . 1 . 2 . 3]" 1
403 1 26 VAL MG2 1 70 THR HA 3.200 . 4.000 4.076 4.051 4.099 0.099 16 0 "[ . 1 . 2 . 3]" 1
404 1 26 VAL MG2 1 71 HIS H 4.000 . 5.000 3.437 3.253 3.678 . 0 0 "[ . 1 . 2 . 3]" 1
405 1 26 VAL MG2 1 71 HIS HB3 3.200 . 4.000 3.545 3.196 3.880 . 0 0 "[ . 1 . 2 . 3]" 1
406 1 27 ASN H 1 27 ASN QB 3.200 . 4.000 2.535 2.244 2.764 . 0 0 "[ . 1 . 2 . 3]" 1
407 1 27 ASN H 1 28 THR H 3.200 . 4.000 3.598 3.368 3.705 . 0 0 "[ . 1 . 2 . 3]" 1
408 1 27 ASN H 1 30 VAL MG2 4.000 . 5.000 4.401 4.214 4.686 . 0 0 "[ . 1 . 2 . 3]" 1
409 1 27 ASN H 1 33 GLY HA2 4.000 . 5.000 4.146 4.002 4.471 . 0 0 "[ . 1 . 2 . 3]" 1
410 1 27 ASN H 1 70 THR HA 4.000 . 5.000 3.527 3.213 3.865 . 0 0 "[ . 1 . 2 . 3]" 1
411 1 27 ASN H 1 70 THR MG 3.200 . 4.000 2.588 2.293 2.790 . 0 0 "[ . 1 . 2 . 3]" 1
412 1 27 ASN HA 1 28 THR H 2.600 . 3.000 2.571 2.506 2.654 . 0 0 "[ . 1 . 2 . 3]" 1
413 1 27 ASN HA 1 29 SER H 4.000 . 5.000 4.831 4.459 5.009 0.009 7 0 "[ . 1 . 2 . 3]" 1
414 1 27 ASN HA 1 30 VAL MG2 3.200 . 4.000 2.823 2.503 3.339 . 0 0 "[ . 1 . 2 . 3]" 1
415 1 27 ASN HA 1 32 HIS H 4.000 . 5.000 4.722 4.215 5.004 0.004 29 0 "[ . 1 . 2 . 3]" 1
416 1 27 ASN HA 1 32 HIS HA 4.000 . 5.000 4.022 3.455 4.545 . 0 0 "[ . 1 . 2 . 3]" 1
417 1 27 ASN HA 1 33 GLY H 4.000 . 5.000 4.511 4.163 4.783 . 0 0 "[ . 1 . 2 . 3]" 1
418 1 27 ASN HA 1 33 GLY HA3 3.200 . 4.000 4.019 3.957 4.037 0.037 17 0 "[ . 1 . 2 . 3]" 1
419 1 27 ASN HA 1 70 THR MG 4.000 . 5.000 4.889 4.710 5.005 0.005 3 0 "[ . 1 . 2 . 3]" 1
420 1 27 ASN QB 1 28 THR H 3.200 . 4.000 3.961 3.906 4.032 0.032 16 0 "[ . 1 . 2 . 3]" 1
421 1 27 ASN QB 1 70 THR MG 4.000 . 5.000 3.978 3.494 4.383 . 0 0 "[ . 1 . 2 . 3]" 1
422 1 28 THR H 1 28 THR HB 4.000 . 5.000 3.150 2.937 3.730 . 0 0 "[ . 1 . 2 . 3]" 1
423 1 28 THR H 1 28 THR MG 4.000 . 5.000 3.999 3.632 4.036 . 0 0 "[ . 1 . 2 . 3]" 1
424 1 28 THR H 1 29 SER HA 4.000 . 5.000 4.644 4.513 4.734 . 0 0 "[ . 1 . 2 . 3]" 1
425 1 28 THR H 1 30 VAL MG2 3.200 . 4.000 2.848 2.530 3.218 . 0 0 "[ . 1 . 2 . 3]" 1
426 1 28 THR HA 1 29 SER H 3.200 . 4.000 3.565 3.553 3.571 . 0 0 "[ . 1 . 2 . 3]" 1
427 1 28 THR HA 1 30 VAL H 4.000 . 5.000 4.856 4.488 5.008 0.008 10 0 "[ . 1 . 2 . 3]" 1
428 1 28 THR HB 1 29 SER H 2.600 . 3.000 2.215 1.989 2.639 . 0 0 "[ . 1 . 2 . 3]" 1
429 1 28 THR HB 1 30 VAL H 4.000 . 5.000 4.672 4.343 4.921 . 0 0 "[ . 1 . 2 . 3]" 1
430 1 28 THR MG 1 29 SER H 4.000 . 5.000 3.573 3.035 3.895 . 0 0 "[ . 1 . 2 . 3]" 1
431 1 29 SER H 1 29 SER HB2 4.000 . 5.000 2.501 2.127 3.610 . 0 0 "[ . 1 . 2 . 3]" 1
432 1 29 SER H 1 29 SER HB3 4.000 . 5.000 3.025 2.296 3.629 . 0 0 "[ . 1 . 2 . 3]" 1
433 1 29 SER H 1 30 VAL MG2 4.000 . 5.000 3.818 3.432 4.045 . 0 0 "[ . 1 . 2 . 3]" 1
434 1 29 SER HA 1 30 VAL H 3.200 . 4.000 3.539 3.486 3.562 . 0 0 "[ . 1 . 2 . 3]" 1
435 1 29 SER HB2 1 30 VAL H 4.000 . 5.000 3.309 2.456 3.961 . 0 0 "[ . 1 . 2 . 3]" 1
436 1 30 VAL H 1 30 VAL HB 3.200 . 4.000 3.641 3.622 3.669 . 0 0 "[ . 1 . 2 . 3]" 1
437 1 30 VAL H 1 30 VAL MG1 3.200 . 4.000 2.273 2.062 2.584 . 0 0 "[ . 1 . 2 . 3]" 1
438 1 30 VAL H 1 30 VAL MG2 3.200 . 4.000 2.116 1.934 2.285 . 0 0 "[ . 1 . 2 . 3]" 1
439 1 30 VAL H 1 31 ARG H 4.000 . 5.000 4.488 4.427 4.527 . 0 0 "[ . 1 . 2 . 3]" 1
440 1 30 VAL HA 1 30 VAL MG1 2.600 . 3.000 2.382 2.235 2.477 . 0 0 "[ . 1 . 2 . 3]" 1
441 1 30 VAL HA 1 30 VAL MG2 3.200 . 4.000 3.197 3.190 3.205 . 0 0 "[ . 1 . 2 . 3]" 1
442 1 30 VAL HA 1 31 ARG H 3.200 . 4.000 2.664 2.624 2.736 . 0 0 "[ . 1 . 2 . 3]" 1
443 1 30 VAL HA 1 36 TYR QD 4.000 . 5.000 4.628 4.341 5.007 0.007 10 0 "[ . 1 . 2 . 3]" 1
444 1 30 VAL HA 1 36 TYR QE 4.000 . 5.000 4.089 3.725 4.738 . 0 0 "[ . 1 . 2 . 3]" 1
445 1 30 VAL HB 1 31 ARG H 3.200 . 4.000 1.944 1.895 1.984 . 0 0 "[ . 1 . 2 . 3]" 1
446 1 30 VAL HB 1 31 ARG HA 4.000 . 5.000 4.591 4.514 4.638 . 0 0 "[ . 1 . 2 . 3]" 1
447 1 30 VAL HB 1 36 TYR QD 4.000 . 5.000 3.309 2.893 3.671 . 0 0 "[ . 1 . 2 . 3]" 1
448 1 30 VAL HB 1 36 TYR QE 3.200 . 4.000 2.167 1.939 2.682 . 0 0 "[ . 1 . 2 . 3]" 1
449 1 30 VAL MG1 1 31 ARG H 3.200 . 4.000 3.550 3.445 3.598 . 0 0 "[ . 1 . 2 . 3]" 1
450 1 30 VAL MG1 1 35 ILE HA 4.000 . 5.000 3.218 2.837 3.797 . 0 0 "[ . 1 . 2 . 3]" 1
451 1 30 VAL MG1 1 36 TYR QB 4.000 . 5.000 3.064 2.661 3.349 . 0 0 "[ . 1 . 2 . 3]" 1
452 1 30 VAL MG1 1 36 TYR QD 3.200 . 4.000 2.039 1.849 2.518 . 0 0 "[ . 1 . 2 . 3]" 1
453 1 30 VAL MG1 1 36 TYR QE 3.200 . 4.000 2.809 2.412 3.489 . 0 0 "[ . 1 . 2 . 3]" 1
454 1 30 VAL MG2 1 31 ARG H 3.200 . 4.000 2.873 2.561 3.154 . 0 0 "[ . 1 . 2 . 3]" 1
455 1 30 VAL MG2 1 32 HIS H 4.000 . 5.000 2.900 1.943 4.718 . 0 0 "[ . 1 . 2 . 3]" 1
456 1 30 VAL MG2 1 33 GLY H 3.200 . 4.000 3.019 2.334 4.004 0.004 10 0 "[ . 1 . 2 . 3]" 1
457 1 30 VAL MG2 1 33 GLY HA2 3.200 . 4.000 2.697 2.460 2.969 . 0 0 "[ . 1 . 2 . 3]" 1
458 1 30 VAL MG2 1 33 GLY HA3 4.000 . 5.000 3.947 3.695 4.373 . 0 0 "[ . 1 . 2 . 3]" 1
459 1 30 VAL MG2 1 35 ILE HA 4.000 . 5.000 4.147 3.536 4.587 . 0 0 "[ . 1 . 2 . 3]" 1
460 1 30 VAL MG2 1 36 TYR QD 3.200 . 4.000 3.818 3.169 4.008 0.008 17 0 "[ . 1 . 2 . 3]" 1
461 1 30 VAL MG2 1 36 TYR QE 3.200 . 4.000 3.329 2.895 3.667 . 0 0 "[ . 1 . 2 . 3]" 1
462 1 31 ARG H 1 31 ARG QB 3.200 . 4.000 2.275 2.038 2.714 . 0 0 "[ . 1 . 2 . 3]" 1
463 1 31 ARG H 1 31 ARG QG 4.000 . 5.000 2.983 1.965 3.985 . 0 0 "[ . 1 . 2 . 3]" 1
464 1 31 ARG HA 1 31 ARG QD 4.000 . 5.000 3.328 2.337 4.278 . 0 0 "[ . 1 . 2 . 3]" 1
465 1 31 ARG HA 1 31 ARG QG 3.200 . 4.000 2.482 2.031 3.393 . 0 0 "[ . 1 . 2 . 3]" 1
466 1 31 ARG QB 1 31 ARG QD 3.200 . 4.000 2.144 1.928 2.355 . 0 0 "[ . 1 . 2 . 3]" 1
467 1 31 ARG QB 1 36 TYR QE 4.000 . 5.000 3.940 3.556 4.721 . 0 0 "[ . 1 . 2 . 3]" 1
468 1 31 ARG HB2 1 32 HIS H 3.200 . 4.000 3.049 2.119 4.046 0.046 10 0 "[ . 1 . 2 . 3]" 1
469 1 31 ARG QD 1 32 HIS HE1 4.000 . 5.000 4.211 2.275 5.004 0.004 2 0 "[ . 1 . 2 . 3]" 1
470 1 32 HIS H 1 32 HIS QB 3.200 . 4.000 3.074 2.607 3.359 . 0 0 "[ . 1 . 2 . 3]" 1
471 1 32 HIS HA 1 33 GLY H 3.200 . 4.000 3.553 3.517 3.574 . 0 0 "[ . 1 . 2 . 3]" 1
472 1 33 GLY H 1 34 GLY H 3.200 . 4.000 1.879 1.779 1.999 0.021 15 0 "[ . 1 . 2 . 3]" 1
473 1 33 GLY H 1 34 GLY HA2 4.000 . 5.000 4.242 4.176 4.309 . 0 0 "[ . 1 . 2 . 3]" 1
474 1 33 GLY H 1 34 GLY HA3 3.200 . 4.000 3.896 3.876 3.924 . 0 0 "[ . 1 . 2 . 3]" 1
475 1 33 GLY H 1 68 GLY HA2 4.000 . 5.000 4.695 4.215 5.004 0.004 2 0 "[ . 1 . 2 . 3]" 1
476 1 33 GLY HA2 1 69 ALA H 4.000 . 5.000 3.012 2.715 3.305 . 0 0 "[ . 1 . 2 . 3]" 1
477 1 33 GLY HA2 1 70 THR HA 3.200 . 4.000 4.088 4.055 4.105 0.105 27 0 "[ . 1 . 2 . 3]" 1
478 1 33 GLY HA2 1 70 THR MG 4.000 . 5.000 4.912 4.765 5.025 0.025 10 0 "[ . 1 . 2 . 3]" 1
479 1 33 GLY HA3 1 34 GLY H 3.200 . 4.000 3.477 3.445 3.521 . 0 0 "[ . 1 . 2 . 3]" 1
480 1 33 GLY HA3 1 69 ALA H 4.000 . 5.000 1.896 1.803 1.963 . 0 0 "[ . 1 . 2 . 3]" 1
481 1 34 GLY H 1 35 ILE H 4.000 . 5.000 4.608 4.581 4.633 . 0 0 "[ . 1 . 2 . 3]" 1
482 1 34 GLY H 1 36 TYR QD 4.000 . 5.000 5.017 4.974 5.061 0.061 3 0 "[ . 1 . 2 . 3]" 1
483 1 34 GLY H 1 36 TYR QE 3.200 . 4.000 3.577 3.386 3.830 . 0 0 "[ . 1 . 2 . 3]" 1
484 1 34 GLY QA 1 35 ILE H 3.200 . 4.000 2.251 2.220 2.279 . 0 0 "[ . 1 . 2 . 3]" 1
485 1 34 GLY QA 1 36 TYR QE 3.200 . 4.000 3.158 2.956 3.421 . 0 0 "[ . 1 . 2 . 3]" 1
486 1 34 GLY HA3 1 36 TYR QD 4.000 . 5.000 4.499 4.299 4.643 . 0 0 "[ . 1 . 2 . 3]" 1
487 1 35 ILE H 1 35 ILE HB 3.200 . 4.000 2.399 2.271 2.793 . 0 0 "[ . 1 . 2 . 3]" 1
488 1 35 ILE H 1 35 ILE QG 4.000 . 5.000 3.847 3.704 4.152 . 0 0 "[ . 1 . 2 . 3]" 1
489 1 35 ILE H 1 35 ILE MG 4.000 . 5.000 2.847 2.322 3.056 . 0 0 "[ . 1 . 2 . 3]" 1
490 1 35 ILE HA 1 35 ILE MD 3.200 . 4.000 3.291 2.935 3.669 . 0 0 "[ . 1 . 2 . 3]" 1
491 1 35 ILE HA 1 35 ILE QG 3.200 . 4.000 1.997 1.908 2.203 . 0 0 "[ . 1 . 2 . 3]" 1
492 1 35 ILE HA 1 35 ILE MG 3.200 . 4.000 3.093 3.029 3.190 . 0 0 "[ . 1 . 2 . 3]" 1
493 1 35 ILE HA 1 36 TYR H 3.200 . 4.000 2.244 2.209 2.280 . 0 0 "[ . 1 . 2 . 3]" 1
494 1 35 ILE HA 1 36 TYR QD 3.200 . 4.000 2.830 2.625 2.979 . 0 0 "[ . 1 . 2 . 3]" 1
495 1 35 ILE HA 1 74 ALA MB 4.000 . 5.000 4.113 3.923 4.329 . 0 0 "[ . 1 . 2 . 3]" 1
496 1 35 ILE HB 1 35 ILE MD 3.200 . 4.000 2.974 2.604 3.196 . 0 0 "[ . 1 . 2 . 3]" 1
497 1 35 ILE HB 1 36 TYR H 3.200 . 4.000 4.059 3.990 4.096 0.096 20 0 "[ . 1 . 2 . 3]" 1
498 1 35 ILE HB 1 66 LEU QD 4.000 . 5.000 2.966 2.554 3.524 . 0 0 "[ . 1 . 2 . 3]" 1
499 1 35 ILE HB 1 74 ALA MB 4.000 . 5.000 2.186 2.052 2.302 . 0 0 "[ . 1 . 2 . 3]" 1
500 1 35 ILE MD 1 37 VAL HA 4.000 . 5.000 3.476 2.707 4.314 . 0 0 "[ . 1 . 2 . 3]" 1
501 1 35 ILE MD 1 71 HIS HA 4.000 . 5.000 2.621 1.984 3.568 . 0 0 "[ . 1 . 2 . 3]" 1
502 1 35 ILE MD 1 74 ALA H 4.000 . 5.000 4.267 3.124 5.069 0.069 22 0 "[ . 1 . 2 . 3]" 1
503 1 35 ILE MD 1 74 ALA MB 3.200 . 4.000 2.466 1.796 3.281 0.004 17 0 "[ . 1 . 2 . 3]" 1
504 1 35 ILE QG 1 36 TYR HA 4.000 . 5.000 4.899 4.443 5.079 0.079 3 0 "[ . 1 . 2 . 3]" 1
505 1 35 ILE QG 1 58 VAL MG2 4.000 . 5.000 3.772 3.483 4.162 . 0 0 "[ . 1 . 2 . 3]" 1
506 1 35 ILE QG 1 74 ALA MB 4.000 . 5.000 2.089 1.808 2.712 . 0 0 "[ . 1 . 2 . 3]" 1
507 1 35 ILE HG13 1 74 ALA H 3.200 . 4.000 3.564 3.114 4.004 0.004 15 0 "[ . 1 . 2 . 3]" 1
508 1 35 ILE HG13 1 74 ALA MB 2.600 . 3.000 2.110 1.817 2.773 . 0 0 "[ . 1 . 2 . 3]" 1
509 1 35 ILE MG 1 66 LEU QB 4.000 . 5.000 4.730 3.884 5.010 0.010 7 0 "[ . 1 . 2 . 3]" 1
510 1 35 ILE MG 1 71 HIS HA 4.000 . 5.000 4.311 3.882 4.436 . 0 0 "[ . 1 . 2 . 3]" 1
511 1 35 ILE MG 1 74 ALA HA 4.000 . 5.000 4.855 3.895 5.029 0.029 20 0 "[ . 1 . 2 . 3]" 1
512 1 35 ILE MG 1 74 ALA MB 3.200 . 4.000 2.443 1.773 2.620 0.027 22 0 "[ . 1 . 2 . 3]" 1
513 1 36 TYR H 1 36 TYR HB2 3.200 . 4.000 2.718 2.634 2.790 . 0 0 "[ . 1 . 2 . 3]" 1
514 1 36 TYR H 1 36 TYR HB3 3.200 . 4.000 3.818 3.766 3.860 . 0 0 "[ . 1 . 2 . 3]" 1
515 1 36 TYR H 1 36 TYR QD 3.200 . 4.000 2.807 2.528 2.889 . 0 0 "[ . 1 . 2 . 3]" 1
516 1 36 TYR H 1 36 TYR QE 4.000 . 5.000 5.017 4.826 5.047 0.047 20 0 "[ . 1 . 2 . 3]" 1
517 1 36 TYR H 1 37 VAL H 3.200 . 4.000 3.959 3.903 4.080 0.080 22 0 "[ . 1 . 2 . 3]" 1
518 1 36 TYR HA 1 36 TYR QD 3.200 . 4.000 3.145 3.109 3.174 . 0 0 "[ . 1 . 2 . 3]" 1
519 1 36 TYR HA 1 36 TYR QE 4.000 . 5.000 4.688 4.656 4.750 . 0 0 "[ . 1 . 2 . 3]" 1
520 1 36 TYR HA 1 37 VAL H 3.200 . 4.000 2.144 2.098 2.172 . 0 0 "[ . 1 . 2 . 3]" 1
521 1 36 TYR HA 1 55 GLY QA 2.600 . 3.000 3.033 3.003 3.083 0.083 27 0 "[ . 1 . 2 . 3]" 1
522 1 36 TYR HA 1 57 ARG H 4.000 . 5.000 4.679 4.500 4.832 . 0 0 "[ . 1 . 2 . 3]" 1
523 1 36 TYR HA 1 58 VAL MG1 3.200 . 4.000 4.018 3.964 4.042 0.042 28 0 "[ . 1 . 2 . 3]" 1
524 1 36 TYR HA 1 58 VAL MG2 4.000 . 5.000 5.016 4.870 5.077 0.077 26 0 "[ . 1 . 2 . 3]" 1
525 1 36 TYR HB2 1 36 TYR QD 2.600 . 3.000 2.552 2.497 2.646 . 0 0 "[ . 1 . 2 . 3]" 1
526 1 36 TYR HB2 1 36 TYR QE 4.000 . 5.000 4.455 4.438 4.479 . 0 0 "[ . 1 . 2 . 3]" 1
527 1 36 TYR HB2 1 37 VAL H 4.000 . 5.000 4.428 4.349 4.460 . 0 0 "[ . 1 . 2 . 3]" 1
528 1 36 TYR HB3 1 36 TYR QD 2.600 . 3.000 2.296 2.269 2.315 . 0 0 "[ . 1 . 2 . 3]" 1
529 1 36 TYR HB3 1 36 TYR QE 4.000 . 5.000 4.385 4.376 4.394 . 0 0 "[ . 1 . 2 . 3]" 1
530 1 36 TYR QD 1 37 VAL H 4.000 . 5.000 4.670 4.608 4.726 . 0 0 "[ . 1 . 2 . 3]" 1
531 1 36 TYR QD 1 55 GLY QA 3.200 . 4.000 3.073 2.927 3.117 . 0 0 "[ . 1 . 2 . 3]" 1
532 1 36 TYR QD 1 56 ASP HA 4.000 . 5.000 4.958 4.739 5.021 0.021 16 0 "[ . 1 . 2 . 3]" 1
533 1 36 TYR QD 1 57 ARG H 4.000 . 5.000 4.802 4.404 4.934 . 0 0 "[ . 1 . 2 . 3]" 1
534 1 36 TYR QD 1 57 ARG QB 4.000 . 5.000 4.347 3.591 4.803 . 0 0 "[ . 1 . 2 . 3]" 1
535 1 36 TYR QD 1 57 ARG QD 4.000 . 5.000 4.612 3.846 5.017 0.017 24 0 "[ . 1 . 2 . 3]" 1
536 1 36 TYR QD 1 57 ARG QG 3.200 . 4.000 3.443 2.885 4.004 0.004 3 0 "[ . 1 . 2 . 3]" 1
537 1 36 TYR QE 1 55 GLY QA 4.000 . 5.000 4.998 4.857 5.024 0.024 6 0 "[ . 1 . 2 . 3]" 1
538 1 36 TYR QE 1 57 ARG H 4.000 . 5.000 4.955 4.425 5.026 0.026 20 0 "[ . 1 . 2 . 3]" 1
539 1 36 TYR QE 1 57 ARG QB 3.200 . 4.000 3.540 2.615 4.037 0.037 30 0 "[ . 1 . 2 . 3]" 1
540 1 36 TYR QE 1 57 ARG QD 3.200 . 4.000 3.170 1.896 4.007 0.007 12 0 "[ . 1 . 2 . 3]" 1
541 1 36 TYR QE 1 57 ARG QG 3.200 . 4.000 2.540 2.177 3.110 . 0 0 "[ . 1 . 2 . 3]" 1
542 1 37 VAL H 1 37 VAL HB 3.200 . 4.000 3.526 3.497 3.565 . 0 0 "[ . 1 . 2 . 3]" 1
543 1 37 VAL H 1 37 VAL MG1 3.200 . 4.000 1.805 1.732 1.847 0.068 14 0 "[ . 1 . 2 . 3]" 1
544 1 37 VAL H 1 37 VAL MG2 3.200 . 4.000 2.983 2.912 3.093 . 0 0 "[ . 1 . 2 . 3]" 1
545 1 37 VAL H 1 38 LYS H 4.000 . 5.000 4.631 4.612 4.648 . 0 0 "[ . 1 . 2 . 3]" 1
546 1 37 VAL H 1 55 GLY H 4.000 . 5.000 3.733 3.670 3.765 . 0 0 "[ . 1 . 2 . 3]" 1
547 1 37 VAL H 1 55 GLY QA 3.200 . 4.000 2.801 2.679 2.851 . 0 0 "[ . 1 . 2 . 3]" 1
548 1 37 VAL H 1 56 ASP H 4.000 . 5.000 2.550 2.328 2.829 . 0 0 "[ . 1 . 2 . 3]" 1
549 1 37 VAL H 1 58 VAL MG1 3.200 . 4.000 3.753 3.551 3.866 . 0 0 "[ . 1 . 2 . 3]" 1
550 1 37 VAL HA 1 37 VAL MG1 3.200 . 4.000 2.679 2.633 2.751 . 0 0 "[ . 1 . 2 . 3]" 1
551 1 37 VAL HA 1 37 VAL MG2 3.200 . 4.000 3.131 3.114 3.148 . 0 0 "[ . 1 . 2 . 3]" 1
552 1 37 VAL HA 1 38 LYS H 2.600 . 3.000 2.279 2.233 2.458 . 0 0 "[ . 1 . 2 . 3]" 1
553 1 37 VAL HB 1 52 ILE MG 4.000 . 5.000 4.259 2.839 4.681 . 0 0 "[ . 1 . 2 . 3]" 1
554 1 37 VAL HB 1 54 LYS HA 4.000 . 5.000 4.321 4.242 4.419 . 0 0 "[ . 1 . 2 . 3]" 1
555 1 37 VAL HB 1 55 GLY H 3.200 . 4.000 4.106 4.062 4.127 0.127 11 0 "[ . 1 . 2 . 3]" 1
556 1 37 VAL HB 1 56 ASP H 3.200 . 4.000 4.113 4.068 4.200 0.200 20 0 "[ . 1 . 2 . 3]" 1
557 1 37 VAL MG1 1 52 ILE QG 4.000 . 5.000 2.424 1.907 4.169 . 0 0 "[ . 1 . 2 . 3]" 1
558 1 37 VAL MG1 1 52 ILE MG 4.000 . 5.000 3.226 1.760 3.846 0.040 14 0 "[ . 1 . 2 . 3]" 1
559 1 37 VAL MG1 1 53 HIS HA 4.000 . 5.000 4.797 4.645 4.968 . 0 0 "[ . 1 . 2 . 3]" 1
560 1 37 VAL MG1 1 54 LYS H 4.000 . 5.000 5.063 5.027 5.131 0.131 27 0 "[ . 1 . 2 . 3]" 1
561 1 37 VAL MG1 1 54 LYS HA 3.200 . 4.000 4.038 3.970 4.060 0.060 21 0 "[ . 1 . 2 . 3]" 1
562 1 37 VAL MG1 1 55 GLY H 3.200 . 4.000 3.623 3.533 3.687 . 0 0 "[ . 1 . 2 . 3]" 1
563 1 37 VAL MG1 1 55 GLY QA 4.000 . 5.000 3.608 3.411 3.712 . 0 0 "[ . 1 . 2 . 3]" 1
564 1 37 VAL MG1 1 56 ASP H 3.200 . 4.000 1.842 1.764 1.911 0.036 16 0 "[ . 1 . 2 . 3]" 1
565 1 37 VAL MG1 1 56 ASP HA 4.000 . 5.000 3.770 3.618 3.851 . 0 0 "[ . 1 . 2 . 3]" 1
566 1 37 VAL MG1 1 56 ASP QB 3.200 . 4.000 1.835 1.772 2.822 0.028 22 0 "[ . 1 . 2 . 3]" 1
567 1 37 VAL MG2 1 39 ALA HA 2.600 . 3.000 2.810 2.762 2.958 . 0 0 "[ . 1 . 2 . 3]" 1
568 1 37 VAL MG2 1 54 LYS HA 2.600 . 3.000 1.819 1.768 1.884 0.032 27 0 "[ . 1 . 2 . 3]" 1
569 1 37 VAL MG2 1 55 GLY H 4.000 . 5.000 1.770 1.737 1.807 0.063 20 0 "[ . 1 . 2 . 3]" 1
570 1 37 VAL MG2 1 56 ASP H 3.200 . 4.000 1.826 1.789 1.890 0.011 13 0 "[ . 1 . 2 . 3]" 1
571 1 37 VAL MG2 1 56 ASP HA 4.000 . 5.000 4.341 4.267 4.417 . 0 0 "[ . 1 . 2 . 3]" 1
572 1 37 VAL MG2 1 56 ASP QB 4.000 . 5.000 2.910 2.808 3.398 . 0 0 "[ . 1 . 2 . 3]" 1
573 1 38 LYS H 1 38 LYS HB2 3.200 . 4.000 3.210 2.289 3.603 . 0 0 "[ . 1 . 2 . 3]" 1
574 1 38 LYS H 1 38 LYS HB3 3.200 . 4.000 2.329 2.134 2.933 . 0 0 "[ . 1 . 2 . 3]" 1
575 1 38 LYS H 1 38 LYS QD 4.000 . 5.000 4.646 4.415 5.010 0.010 28 0 "[ . 1 . 2 . 3]" 1
576 1 38 LYS H 1 38 LYS QG 4.000 . 5.000 3.451 3.065 4.017 . 0 0 "[ . 1 . 2 . 3]" 1
577 1 38 LYS H 1 39 ALA H 3.200 . 4.000 2.332 2.103 2.438 . 0 0 "[ . 1 . 2 . 3]" 1
578 1 38 LYS HA 1 38 LYS QD 3.200 . 4.000 3.728 2.331 4.043 0.043 27 0 "[ . 1 . 2 . 3]" 1
579 1 38 LYS HA 1 38 LYS QE 3.200 . 4.000 3.727 2.015 4.063 0.063 19 0 "[ . 1 . 2 . 3]" 1
580 1 38 LYS HA 1 38 LYS QG 3.200 . 4.000 2.976 2.214 3.333 . 0 0 "[ . 1 . 2 . 3]" 1
581 1 38 LYS HA 1 39 ALA H 4.000 . 5.000 3.542 3.524 3.559 . 0 0 "[ . 1 . 2 . 3]" 1
582 1 38 LYS HA 1 54 LYS HA 4.000 . 5.000 4.765 4.230 4.898 . 0 0 "[ . 1 . 2 . 3]" 1
583 1 38 LYS HA 1 54 LYS QE 3.200 . 4.000 3.575 2.504 4.029 0.029 3 0 "[ . 1 . 2 . 3]" 1
584 1 38 LYS HB2 1 38 LYS HE3 3.200 . 4.000 3.099 2.110 4.019 0.019 5 0 "[ . 1 . 2 . 3]" 1
585 1 38 LYS HB2 1 39 ALA H 3.200 . 4.000 3.924 3.363 4.091 0.091 21 0 "[ . 1 . 2 . 3]" 1
586 1 38 LYS HB3 1 39 ALA H 3.200 . 4.000 2.961 2.424 3.353 . 0 0 "[ . 1 . 2 . 3]" 1
587 1 38 LYS HB3 1 39 ALA MB 4.000 . 5.000 4.184 3.174 4.644 . 0 0 "[ . 1 . 2 . 3]" 1
588 1 38 LYS QE 1 38 LYS QG 3.200 . 4.000 2.186 2.019 2.568 . 0 0 "[ . 1 . 2 . 3]" 1
589 1 38 LYS QE 1 39 ALA MB 4.000 . 5.000 3.137 1.814 4.970 . 0 0 "[ . 1 . 2 . 3]" 1
590 1 38 LYS HE3 1 39 ALA H 4.000 . 5.000 4.656 3.311 5.010 0.010 30 0 "[ . 1 . 2 . 3]" 1
591 1 39 ALA H 1 39 ALA MB 3.200 . 4.000 2.846 2.840 2.875 . 0 0 "[ . 1 . 2 . 3]" 1
592 1 39 ALA H 1 40 VAL H 4.000 . 5.000 4.347 4.329 4.387 . 0 0 "[ . 1 . 2 . 3]" 1
593 1 39 ALA H 1 40 VAL HA 4.000 . 5.000 4.583 4.539 4.666 . 0 0 "[ . 1 . 2 . 3]" 1
594 1 39 ALA H 1 54 LYS QE 4.000 . 5.000 4.944 4.350 5.042 0.042 27 0 "[ . 1 . 2 . 3]" 1
595 1 39 ALA HA 1 40 VAL H 2.600 . 3.000 2.508 2.446 2.541 . 0 0 "[ . 1 . 2 . 3]" 1
596 1 39 ALA HA 1 40 VAL MG2 4.000 . 5.000 3.348 3.276 3.508 . 0 0 "[ . 1 . 2 . 3]" 1
597 1 39 ALA HA 1 54 LYS HA 4.000 . 5.000 2.531 2.471 2.624 . 0 0 "[ . 1 . 2 . 3]" 1
598 1 39 ALA HA 1 54 LYS QE 4.000 . 5.000 3.785 3.586 4.058 . 0 0 "[ . 1 . 2 . 3]" 1
599 1 39 ALA MB 1 40 VAL H 3.200 . 4.000 2.271 2.191 2.362 . 0 0 "[ . 1 . 2 . 3]" 1
600 1 39 ALA MB 1 41 ILE MD 3.200 . 4.000 2.771 2.600 3.235 . 0 0 "[ . 1 . 2 . 3]" 1
601 1 39 ALA MB 1 54 LYS HA 3.200 . 4.000 4.067 3.966 4.099 0.099 24 0 "[ . 1 . 2 . 3]" 1
602 1 39 ALA MB 1 55 GLY H 4.000 . 5.000 5.020 4.979 5.055 0.055 3 0 "[ . 1 . 2 . 3]" 1
603 1 40 VAL H 1 40 VAL HB 3.200 . 4.000 3.453 3.385 3.547 . 0 0 "[ . 1 . 2 . 3]" 1
604 1 40 VAL H 1 40 VAL MG1 4.000 . 5.000 3.393 3.206 3.510 . 0 0 "[ . 1 . 2 . 3]" 1
605 1 40 VAL H 1 40 VAL MG2 3.200 . 4.000 1.845 1.832 1.878 . 0 0 "[ . 1 . 2 . 3]" 1
606 1 40 VAL HA 1 40 VAL MG1 3.200 . 4.000 2.143 2.007 2.187 . 0 0 "[ . 1 . 2 . 3]" 1
607 1 40 VAL HA 1 40 VAL MG2 2.600 . 3.000 3.069 3.025 3.127 0.127 14 0 "[ . 1 . 2 . 3]" 1
608 1 40 VAL HA 1 41 ILE H 2.600 . 3.000 2.144 2.123 2.279 . 0 0 "[ . 1 . 2 . 3]" 1
609 1 40 VAL HA 1 41 ILE HA 4.000 . 5.000 4.371 4.352 4.520 . 0 0 "[ . 1 . 2 . 3]" 1
610 1 40 VAL MG1 1 46 ALA MB 3.200 . 4.000 2.834 2.358 3.061 . 0 0 "[ . 1 . 2 . 3]" 1
611 1 40 VAL MG1 1 47 GLU H 3.200 . 4.000 3.557 3.249 3.820 . 0 0 "[ . 1 . 2 . 3]" 1
612 1 40 VAL MG1 1 47 GLU HA 2.600 . 3.000 2.552 2.275 2.660 . 0 0 "[ . 1 . 2 . 3]" 1
613 1 40 VAL MG1 1 47 GLU HB2 3.200 . 4.000 3.688 2.879 4.037 0.037 3 0 "[ . 1 . 2 . 3]" 1
614 1 40 VAL MG1 1 50 GLY HA3 4.000 . 5.000 4.758 4.339 5.025 0.025 24 0 "[ . 1 . 2 . 3]" 1
615 1 40 VAL MG1 1 52 ILE HB 4.000 . 5.000 3.974 2.322 4.623 . 0 0 "[ . 1 . 2 . 3]" 1
616 1 40 VAL MG1 1 53 HIS H 3.200 . 4.000 4.042 4.005 4.099 0.099 23 0 "[ . 1 . 2 . 3]" 1
617 1 40 VAL MG1 1 53 HIS HA 3.200 . 4.000 2.765 2.330 3.273 . 0 0 "[ . 1 . 2 . 3]" 1
618 1 40 VAL MG1 1 53 HIS HD2 4.000 . 5.000 4.529 3.612 4.996 . 0 0 "[ . 1 . 2 . 3]" 1
619 1 40 VAL MG2 1 53 HIS HA 2.600 . 3.000 2.971 2.646 3.018 0.018 30 0 "[ . 1 . 2 . 3]" 1
620 1 40 VAL MG2 1 53 HIS QB 4.000 . 5.000 4.258 3.517 4.502 . 0 0 "[ . 1 . 2 . 3]" 1
621 1 40 VAL MG2 1 53 HIS HD2 4.000 . 5.000 3.930 2.997 4.546 . 0 0 "[ . 1 . 2 . 3]" 1
622 1 40 VAL MG2 1 54 LYS HA 4.000 . 5.000 4.064 3.850 4.604 . 0 0 "[ . 1 . 2 . 3]" 1
623 1 40 VAL MG2 1 54 LYS QB 3.200 . 4.000 3.881 3.476 4.033 0.033 5 0 "[ . 1 . 2 . 3]" 1
624 1 41 ILE H 1 41 ILE HB 3.200 . 4.000 2.404 2.264 2.794 . 0 0 "[ . 1 . 2 . 3]" 1
625 1 41 ILE H 1 41 ILE MD 3.200 . 4.000 2.064 1.922 2.878 . 0 0 "[ . 1 . 2 . 3]" 1
626 1 41 ILE H 1 41 ILE QG 3.200 . 4.000 3.132 2.072 3.397 . 0 0 "[ . 1 . 2 . 3]" 1
627 1 41 ILE H 1 41 ILE MG 4.000 . 5.000 3.722 3.672 3.773 . 0 0 "[ . 1 . 2 . 3]" 1
628 1 41 ILE H 1 47 GLU HB3 4.000 . 5.000 3.753 3.506 4.171 . 0 0 "[ . 1 . 2 . 3]" 1
629 1 41 ILE HA 1 41 ILE MD 3.200 . 4.000 2.033 1.920 2.177 . 0 0 "[ . 1 . 2 . 3]" 1
630 1 41 ILE HA 1 41 ILE QG 3.200 . 4.000 2.779 2.619 3.250 . 0 0 "[ . 1 . 2 . 3]" 1
631 1 41 ILE HA 1 41 ILE MG 2.600 . 3.000 2.469 2.230 2.575 . 0 0 "[ . 1 . 2 . 3]" 1
632 1 41 ILE HA 1 42 PRO HA 4.000 . 5.000 4.462 4.440 4.505 . 0 0 "[ . 1 . 2 . 3]" 1
633 1 41 ILE HA 1 42 PRO QB 4.000 . 5.000 4.590 4.558 4.645 . 0 0 "[ . 1 . 2 . 3]" 1
634 1 41 ILE HA 1 42 PRO QD 2.600 . 3.000 1.843 1.804 1.902 . 0 0 "[ . 1 . 2 . 3]" 1
635 1 41 ILE HA 1 47 GLU HB3 3.200 . 4.000 4.214 4.179 4.241 0.241 6 0 "[ . 1 . 2 . 3]" 1
636 1 41 ILE MD 1 42 PRO QD 4.000 . 5.000 3.159 2.474 3.325 . 0 0 "[ . 1 . 2 . 3]" 1
637 1 41 ILE MD 1 42 PRO QG 4.000 . 5.000 4.838 4.123 5.009 0.009 13 0 "[ . 1 . 2 . 3]" 1
638 1 41 ILE MG 1 42 PRO HA 4.000 . 5.000 4.246 4.149 4.578 . 0 0 "[ . 1 . 2 . 3]" 1
639 1 41 ILE MG 1 42 PRO QD 3.200 . 4.000 2.486 2.181 2.720 . 0 0 "[ . 1 . 2 . 3]" 1
640 1 41 ILE MG 1 42 PRO QG 4.000 . 5.000 3.749 3.187 4.367 . 0 0 "[ . 1 . 2 . 3]" 1
641 1 41 ILE MG 1 43 GLN QG 4.000 . 5.000 3.269 2.562 3.948 . 0 0 "[ . 1 . 2 . 3]" 1
642 1 42 PRO HA 1 42 PRO QG 3.200 . 4.000 3.265 2.945 3.498 . 0 0 "[ . 1 . 2 . 3]" 1
643 1 42 PRO HA 1 43 GLN H 2.600 . 3.000 2.598 2.453 2.667 . 0 0 "[ . 1 . 2 . 3]" 1
644 1 42 PRO HA 1 43 GLN HA 4.000 . 5.000 4.338 4.290 4.359 . 0 0 "[ . 1 . 2 . 3]" 1
645 1 42 PRO HA 1 48 SER H 4.000 . 5.000 4.469 3.576 4.882 . 0 0 "[ . 1 . 2 . 3]" 1
646 1 42 PRO QB 1 43 GLN H 4.000 . 5.000 3.960 3.906 3.996 . 0 0 "[ . 1 . 2 . 3]" 1
647 1 43 GLN H 1 43 GLN QB 3.200 . 4.000 2.708 2.661 2.913 . 0 0 "[ . 1 . 2 . 3]" 1
648 1 43 GLN H 1 43 GLN QG 3.200 . 4.000 3.855 3.554 4.045 0.045 17 0 "[ . 1 . 2 . 3]" 1
649 1 43 GLN H 1 44 GLY H 3.200 . 4.000 2.023 1.941 2.092 . 0 0 "[ . 1 . 2 . 3]" 1
650 1 43 GLN H 1 47 GLU HB2 3.200 . 4.000 4.032 3.943 4.057 0.057 8 0 "[ . 1 . 2 . 3]" 1
651 1 43 GLN H 1 47 GLU HB3 3.200 . 4.000 3.041 2.474 3.275 . 0 0 "[ . 1 . 2 . 3]" 1
652 1 43 GLN HA 1 43 GLN QG 3.200 . 4.000 2.323 2.011 3.009 . 0 0 "[ . 1 . 2 . 3]" 1
653 1 43 GLN QB 1 44 GLY H 4.000 . 5.000 2.554 2.343 2.725 . 0 0 "[ . 1 . 2 . 3]" 1
654 1 43 GLN QG 1 44 GLY H 4.000 . 5.000 4.052 3.098 4.439 . 0 0 "[ . 1 . 2 . 3]" 1
655 1 44 GLY H 1 45 ALA H 4.000 . 5.000 4.562 4.549 4.584 . 0 0 "[ . 1 . 2 . 3]" 1
656 1 44 GLY H 1 47 GLU H 4.000 . 5.000 4.013 3.949 4.136 . 0 0 "[ . 1 . 2 . 3]" 1
657 1 44 GLY HA2 1 45 ALA H 3.200 . 4.000 2.331 2.222 2.390 . 0 0 "[ . 1 . 2 . 3]" 1
658 1 44 GLY HA3 1 45 ALA MB 4.000 . 5.000 4.332 4.265 4.390 . 0 0 "[ . 1 . 2 . 3]" 1
659 1 45 ALA H 1 45 ALA MB 3.200 . 4.000 2.101 2.002 2.229 . 0 0 "[ . 1 . 2 . 3]" 1
660 1 45 ALA H 1 46 ALA H 3.200 . 4.000 2.872 2.751 3.031 . 0 0 "[ . 1 . 2 . 3]" 1
661 1 45 ALA HA 1 48 SER QB 2.600 . 3.000 2.389 2.172 2.603 . 0 0 "[ . 1 . 2 . 3]" 1
662 1 45 ALA HA 1 49 ASP QB 4.000 . 5.000 4.429 3.569 4.858 . 0 0 "[ . 1 . 2 . 3]" 1
663 1 46 ALA H 1 46 ALA MB 3.200 . 4.000 2.218 2.120 2.252 . 0 0 "[ . 1 . 2 . 3]" 1
664 1 46 ALA H 1 47 GLU H 3.200 . 4.000 2.792 2.683 2.999 . 0 0 "[ . 1 . 2 . 3]" 1
665 1 46 ALA H 1 48 SER H 4.000 . 5.000 3.845 3.698 3.912 . 0 0 "[ . 1 . 2 . 3]" 1
666 1 46 ALA H 1 49 ASP H 4.000 . 5.000 4.871 4.476 5.035 0.035 25 0 "[ . 1 . 2 . 3]" 1
667 1 46 ALA HA 1 47 GLU H 3.200 . 4.000 3.576 3.561 3.598 . 0 0 "[ . 1 . 2 . 3]" 1
668 1 46 ALA HA 1 49 ASP QB 3.200 . 4.000 3.642 3.443 3.842 . 0 0 "[ . 1 . 2 . 3]" 1
669 1 46 ALA HA 1 51 ARG H 4.000 . 5.000 3.533 3.391 3.717 . 0 0 "[ . 1 . 2 . 3]" 1
670 1 46 ALA MB 1 47 GLU H 3.200 . 4.000 2.169 2.062 2.279 . 0 0 "[ . 1 . 2 . 3]" 1
671 1 46 ALA MB 1 47 GLU HB2 4.000 . 5.000 4.638 3.771 5.054 0.054 2 0 "[ . 1 . 2 . 3]" 1
672 1 46 ALA MB 1 47 GLU HB3 4.000 . 5.000 3.988 3.799 4.397 . 0 0 "[ . 1 . 2 . 3]" 1
673 1 46 ALA MB 1 52 ILE HB 3.200 . 4.000 3.456 2.483 3.828 . 0 0 "[ . 1 . 2 . 3]" 1
674 1 46 ALA MB 1 52 ILE MG 4.000 . 5.000 2.350 1.790 4.548 0.010 29 0 "[ . 1 . 2 . 3]" 1
675 1 47 GLU H 1 47 GLU HB2 3.200 . 4.000 3.253 2.464 3.598 . 0 0 "[ . 1 . 2 . 3]" 1
676 1 47 GLU H 1 47 GLU HB3 3.200 . 4.000 2.502 2.394 2.706 . 0 0 "[ . 1 . 2 . 3]" 1
677 1 47 GLU H 1 48 SER H 3.200 . 4.000 2.709 2.655 2.749 . 0 0 "[ . 1 . 2 . 3]" 1
678 1 47 GLU H 1 48 SER QB 4.000 . 5.000 4.479 4.346 4.810 . 0 0 "[ . 1 . 2 . 3]" 1
679 1 47 GLU HA 1 48 SER H 3.200 . 4.000 3.530 3.497 3.544 . 0 0 "[ . 1 . 2 . 3]" 1
680 1 47 GLU HA 1 50 GLY H 3.200 . 4.000 3.636 3.401 3.747 . 0 0 "[ . 1 . 2 . 3]" 1
681 1 47 GLU HA 1 50 GLY HA2 2.600 . 3.000 3.068 3.006 3.107 0.107 8 0 "[ . 1 . 2 . 3]" 1
682 1 47 GLU HA 1 50 GLY HA3 4.000 . 5.000 4.542 4.503 4.581 . 0 0 "[ . 1 . 2 . 3]" 1
683 1 47 GLU HB2 1 48 SER H 3.200 . 4.000 3.837 3.726 4.023 0.023 13 0 "[ . 1 . 2 . 3]" 1
684 1 47 GLU HB3 1 48 SER H 3.200 . 4.000 3.474 2.774 3.820 . 0 0 "[ . 1 . 2 . 3]" 1
685 1 48 SER H 1 48 SER QB 2.600 . 3.000 2.231 2.050 2.596 . 0 0 "[ . 1 . 2 . 3]" 1
686 1 48 SER H 1 49 ASP H 3.200 . 4.000 3.081 2.948 3.137 . 0 0 "[ . 1 . 2 . 3]" 1
687 1 48 SER HA 1 49 ASP HA 4.000 . 5.000 4.722 4.697 4.740 . 0 0 "[ . 1 . 2 . 3]" 1
688 1 48 SER QB 1 49 ASP H 3.200 . 4.000 2.068 1.939 2.290 . 0 0 "[ . 1 . 2 . 3]" 1
689 1 49 ASP H 1 49 ASP QB 3.200 . 4.000 2.141 2.055 2.318 . 0 0 "[ . 1 . 2 . 3]" 1
690 1 49 ASP H 1 50 GLY H 3.200 . 4.000 2.613 2.532 2.641 . 0 0 "[ . 1 . 2 . 3]" 1
691 1 49 ASP HA 1 50 GLY H 3.200 . 4.000 3.516 3.509 3.522 . 0 0 "[ . 1 . 2 . 3]" 1
692 1 49 ASP HA 1 50 GLY HA3 4.000 . 5.000 4.584 4.575 4.591 . 0 0 "[ . 1 . 2 . 3]" 1
693 1 49 ASP QB 1 50 GLY H 3.200 . 4.000 2.658 2.554 2.746 . 0 0 "[ . 1 . 2 . 3]" 1
694 1 51 ARG H 1 51 ARG QB 3.200 . 4.000 2.210 2.090 2.391 . 0 0 "[ . 1 . 2 . 3]" 1
695 1 51 ARG H 1 51 ARG QG 3.200 . 4.000 3.178 2.520 4.025 0.025 25 0 "[ . 1 . 2 . 3]" 1
696 1 51 ARG H 1 52 ILE H 3.200 . 4.000 2.522 2.396 2.628 . 0 0 "[ . 1 . 2 . 3]" 1
697 1 51 ARG HA 1 51 ARG QD 4.000 . 5.000 2.552 1.963 3.218 . 0 0 "[ . 1 . 2 . 3]" 1
698 1 51 ARG HA 1 51 ARG QG 3.200 . 4.000 2.534 2.419 2.684 . 0 0 "[ . 1 . 2 . 3]" 1
699 1 51 ARG HA 1 52 ILE H 4.000 . 5.000 3.551 3.498 3.566 . 0 0 "[ . 1 . 2 . 3]" 1
700 1 51 ARG HA 1 53 HIS HE1 3.200 . 4.000 3.653 3.082 4.007 0.007 24 0 "[ . 1 . 2 . 3]" 1
701 1 52 ILE H 1 52 ILE HB 2.600 . 3.000 2.535 2.363 2.609 . 0 0 "[ . 1 . 2 . 3]" 1
702 1 52 ILE H 1 52 ILE MD 3.200 . 4.000 3.987 3.809 4.048 0.048 8 0 "[ . 1 . 2 . 3]" 1
703 1 52 ILE H 1 52 ILE QG 3.200 . 4.000 3.743 2.353 4.070 0.070 22 0 "[ . 1 . 2 . 3]" 1
704 1 52 ILE H 1 52 ILE MG 3.200 . 4.000 2.419 2.001 3.811 . 0 0 "[ . 1 . 2 . 3]" 1
705 1 52 ILE HA 1 52 ILE MD 3.200 . 4.000 2.084 1.799 2.747 0.001 8 0 "[ . 1 . 2 . 3]" 1
706 1 52 ILE HA 1 52 ILE QG 3.200 . 4.000 2.792 2.507 2.895 . 0 0 "[ . 1 . 2 . 3]" 1
707 1 52 ILE HA 1 52 ILE MG 3.200 . 4.000 3.035 2.281 3.207 . 0 0 "[ . 1 . 2 . 3]" 1
708 1 52 ILE HA 1 53 HIS H 2.600 . 3.000 2.398 2.296 2.453 . 0 0 "[ . 1 . 2 . 3]" 1
709 1 52 ILE HA 1 53 HIS HA 4.000 . 5.000 4.496 4.461 4.524 . 0 0 "[ . 1 . 2 . 3]" 1
710 1 52 ILE HA 1 53 HIS HE1 4.000 . 5.000 4.782 4.346 5.001 0.001 29 0 "[ . 1 . 2 . 3]" 1
711 1 52 ILE HA 1 89 LEU MD1 4.000 . 5.000 3.075 2.953 3.209 . 0 0 "[ . 1 . 2 . 3]" 1
712 1 52 ILE HA 1 89 LEU MD2 4.000 . 5.000 4.949 4.560 5.014 0.014 21 0 "[ . 1 . 2 . 3]" 1
713 1 52 ILE HB 1 52 ILE MD 3.200 . 4.000 2.511 2.154 3.226 . 0 0 "[ . 1 . 2 . 3]" 1
714 1 52 ILE HB 1 89 LEU MD1 4.000 . 5.000 4.188 3.807 5.017 0.017 21 0 "[ . 1 . 2 . 3]" 1
715 1 52 ILE MD 1 56 ASP H 4.000 . 5.000 4.227 3.843 5.106 0.106 14 0 "[ . 1 . 2 . 3]" 1
716 1 52 ILE MD 1 56 ASP QB 3.200 . 4.000 2.155 1.809 3.510 . 0 0 "[ . 1 . 2 . 3]" 1
717 1 52 ILE MD 1 58 VAL MG1 4.000 . 5.000 2.509 1.968 2.999 . 0 0 "[ . 1 . 2 . 3]" 1
718 1 52 ILE MD 1 89 LEU QB 4.000 . 5.000 3.791 3.577 4.059 . 0 0 "[ . 1 . 2 . 3]" 1
719 1 52 ILE MD 1 89 LEU MD1 2.600 . 3.000 1.793 1.777 1.838 0.023 9 0 "[ . 1 . 2 . 3]" 1
720 1 52 ILE MD 1 89 LEU MD2 3.200 . 4.000 2.781 2.341 2.996 . 0 0 "[ . 1 . 2 . 3]" 1
721 1 52 ILE MD 1 89 LEU HG 4.000 . 5.000 4.023 3.821 4.132 . 0 0 "[ . 1 . 2 . 3]" 1
722 1 52 ILE QG 1 89 LEU MD1 4.000 . 5.000 3.568 3.309 3.627 . 0 0 "[ . 1 . 2 . 3]" 1
723 1 52 ILE QG 1 89 LEU MD2 4.000 . 5.000 4.567 4.082 4.792 . 0 0 "[ . 1 . 2 . 3]" 1
724 1 52 ILE MG 1 53 HIS H 4.000 . 5.000 3.054 1.787 3.593 0.013 5 0 "[ . 1 . 2 . 3]" 1
725 1 52 ILE MG 1 53 HIS HA 4.000 . 5.000 3.457 3.129 3.618 . 0 0 "[ . 1 . 2 . 3]" 1
726 1 53 HIS H 1 53 HIS HB2 3.200 . 4.000 2.830 2.755 2.940 . 0 0 "[ . 1 . 2 . 3]" 1
727 1 53 HIS H 1 53 HIS HB3 3.200 . 4.000 3.884 3.847 3.936 . 0 0 "[ . 1 . 2 . 3]" 1
728 1 53 HIS H 1 56 ASP QB 3.200 . 4.000 2.547 2.374 2.758 . 0 0 "[ . 1 . 2 . 3]" 1
729 1 53 HIS HA 1 53 HIS HD2 3.200 . 4.000 3.303 2.993 3.728 . 0 0 "[ . 1 . 2 . 3]" 1
730 1 53 HIS HA 1 54 LYS H 3.200 . 4.000 2.247 2.095 2.341 . 0 0 "[ . 1 . 2 . 3]" 1
731 1 53 HIS HA 1 54 LYS HA 3.200 . 4.000 4.175 4.168 4.186 0.186 21 0 "[ . 1 . 2 . 3]" 1
732 1 53 HIS HB2 1 53 HIS HD2 3.200 . 4.000 3.894 3.775 3.954 . 0 0 "[ . 1 . 2 . 3]" 1
733 1 53 HIS HB2 1 53 HIS HE1 4.000 . 5.000 4.763 4.727 4.834 . 0 0 "[ . 1 . 2 . 3]" 1
734 1 53 HIS HB2 1 54 LYS H 3.200 . 4.000 3.672 3.405 3.880 . 0 0 "[ . 1 . 2 . 3]" 1
735 1 53 HIS HB3 1 53 HIS HD2 3.200 . 4.000 2.813 2.709 2.935 . 0 0 "[ . 1 . 2 . 3]" 1
736 1 53 HIS HB3 1 54 LYS H 3.200 . 4.000 2.494 2.257 2.991 . 0 0 "[ . 1 . 2 . 3]" 1
737 1 53 HIS HD2 1 54 LYS H 4.000 . 5.000 4.161 3.941 4.711 . 0 0 "[ . 1 . 2 . 3]" 1
738 1 54 LYS H 1 54 LYS QB 3.200 . 4.000 2.071 2.016 2.116 . 0 0 "[ . 1 . 2 . 3]" 1
739 1 54 LYS H 1 54 LYS QD 4.000 . 5.000 4.476 4.204 4.860 . 0 0 "[ . 1 . 2 . 3]" 1
740 1 54 LYS H 1 54 LYS QG 4.000 . 5.000 3.177 2.940 3.539 . 0 0 "[ . 1 . 2 . 3]" 1
741 1 54 LYS H 1 55 GLY H 4.000 . 5.000 4.560 4.521 4.583 . 0 0 "[ . 1 . 2 . 3]" 1
742 1 54 LYS HA 1 54 LYS QD 4.000 . 5.000 3.981 3.467 4.489 . 0 0 "[ . 1 . 2 . 3]" 1
743 1 54 LYS HA 1 54 LYS QE 4.000 . 5.000 3.569 2.793 3.911 . 0 0 "[ . 1 . 2 . 3]" 1
744 1 54 LYS HA 1 54 LYS QG 3.200 . 4.000 2.176 2.011 3.407 . 0 0 "[ . 1 . 2 . 3]" 1
745 1 54 LYS QB 1 55 GLY H 4.000 . 5.000 3.342 3.160 3.502 . 0 0 "[ . 1 . 2 . 3]" 1
746 1 54 LYS HB3 1 54 LYS HE2 2.600 . 3.000 2.581 1.972 3.054 0.054 27 0 "[ . 1 . 2 . 3]" 1
747 1 54 LYS QD 1 55 GLY H 4.000 . 5.000 4.658 2.755 5.014 0.014 15 0 "[ . 1 . 2 . 3]" 1
748 1 54 LYS QE 1 54 LYS QG 3.200 . 4.000 2.175 2.002 2.684 . 0 0 "[ . 1 . 2 . 3]" 1
749 1 55 GLY H 1 56 ASP H 3.200 . 4.000 2.893 2.807 2.954 . 0 0 "[ . 1 . 2 . 3]" 1
750 1 55 GLY QA 1 56 ASP H 3.200 . 4.000 2.799 2.757 2.864 . 0 0 "[ . 1 . 2 . 3]" 1
751 1 56 ASP H 1 56 ASP QB 3.200 . 4.000 2.114 2.076 2.441 . 0 0 "[ . 1 . 2 . 3]" 1
752 1 56 ASP HA 1 57 ARG H 3.200 . 4.000 2.159 2.142 2.170 . 0 0 "[ . 1 . 2 . 3]" 1
753 1 56 ASP HA 1 90 GLU H 4.000 . 5.000 4.868 4.240 5.011 0.011 14 0 "[ . 1 . 2 . 3]" 1
754 1 56 ASP HA 1 91 LYS HA 4.000 . 5.000 4.791 4.066 5.020 0.020 28 0 "[ . 1 . 2 . 3]" 1
755 1 56 ASP HA 1 92 GLY H 3.200 . 4.000 3.105 2.694 3.439 . 0 0 "[ . 1 . 2 . 3]" 1
756 1 56 ASP HA 1 92 GLY QA 2.600 . 3.000 3.004 2.936 3.026 0.026 15 0 "[ . 1 . 2 . 3]" 1
757 1 56 ASP QB 1 57 ARG H 3.200 . 4.000 3.377 3.078 3.601 . 0 0 "[ . 1 . 2 . 3]" 1
758 1 56 ASP QB 1 89 LEU MD1 4.000 . 5.000 2.323 1.984 2.966 . 0 0 "[ . 1 . 2 . 3]" 1
759 1 56 ASP QB 1 89 LEU MD2 3.200 . 4.000 3.782 3.558 4.025 0.025 20 0 "[ . 1 . 2 . 3]" 1
760 1 56 ASP QB 1 92 GLY H 4.000 . 5.000 4.889 3.842 5.040 0.040 27 0 "[ . 1 . 2 . 3]" 1
761 1 57 ARG H 1 57 ARG QB 3.200 . 4.000 2.342 2.103 2.786 . 0 0 "[ . 1 . 2 . 3]" 1
762 1 57 ARG H 1 57 ARG QG 3.200 . 4.000 3.275 1.882 3.997 . 0 0 "[ . 1 . 2 . 3]" 1
763 1 57 ARG H 1 90 GLU H 3.200 . 4.000 3.242 2.692 3.417 . 0 0 "[ . 1 . 2 . 3]" 1
764 1 57 ARG H 1 90 GLU QG 3.200 . 4.000 4.011 3.991 4.027 0.027 11 0 "[ . 1 . 2 . 3]" 1
765 1 57 ARG H 1 91 LYS HA 4.000 . 5.000 4.630 4.275 4.869 . 0 0 "[ . 1 . 2 . 3]" 1
766 1 57 ARG H 1 92 GLY H 4.000 . 5.000 3.262 2.823 3.710 . 0 0 "[ . 1 . 2 . 3]" 1
767 1 57 ARG HA 1 57 ARG QD 4.000 . 5.000 3.658 2.392 4.235 . 0 0 "[ . 1 . 2 . 3]" 1
768 1 57 ARG HA 1 57 ARG QG 3.200 . 4.000 2.353 2.036 2.762 . 0 0 "[ . 1 . 2 . 3]" 1
769 1 57 ARG HA 1 58 VAL MG2 4.000 . 5.000 4.307 4.197 4.564 . 0 0 "[ . 1 . 2 . 3]" 1
770 1 57 ARG HA 1 59 LEU QD 3.200 . 4.000 3.819 3.449 4.032 0.032 9 0 "[ . 1 . 2 . 3]" 1
771 1 57 ARG QB 1 90 GLU H 4.000 . 5.000 2.749 2.547 2.930 . 0 0 "[ . 1 . 2 . 3]" 1
772 1 57 ARG QB 1 90 GLU QG 3.200 . 4.000 2.356 1.893 2.803 . 0 0 "[ . 1 . 2 . 3]" 1
773 1 57 ARG QG 1 90 GLU H 4.000 . 5.000 4.450 3.765 4.976 . 0 0 "[ . 1 . 2 . 3]" 1
774 1 57 ARG QG 1 90 GLU QG 3.200 . 4.000 3.337 2.486 3.952 . 0 0 "[ . 1 . 2 . 3]" 1
775 1 58 VAL H 1 58 VAL HB 3.200 . 4.000 3.641 3.602 3.674 . 0 0 "[ . 1 . 2 . 3]" 1
776 1 58 VAL H 1 58 VAL MG1 3.200 . 4.000 1.936 1.841 1.998 . 0 0 "[ . 1 . 2 . 3]" 1
777 1 58 VAL H 1 58 VAL MG2 3.200 . 4.000 2.513 2.407 2.742 . 0 0 "[ . 1 . 2 . 3]" 1
778 1 58 VAL H 1 89 LEU MD2 4.000 . 5.000 3.933 3.637 4.195 . 0 0 "[ . 1 . 2 . 3]" 1
779 1 58 VAL HA 1 58 VAL MG1 2.600 . 3.000 2.558 2.508 2.662 . 0 0 "[ . 1 . 2 . 3]" 1
780 1 58 VAL HA 1 58 VAL MG2 3.200 . 4.000 3.177 3.148 3.191 . 0 0 "[ . 1 . 2 . 3]" 1
781 1 58 VAL HA 1 59 LEU H 2.600 . 3.000 2.113 2.090 2.133 . 0 0 "[ . 1 . 2 . 3]" 1
782 1 58 VAL HA 1 87 LEU MD2 4.000 . 5.000 3.225 3.088 3.380 . 0 0 "[ . 1 . 2 . 3]" 1
783 1 58 VAL HA 1 89 LEU HA 2.600 . 3.000 2.250 1.980 2.414 . 0 0 "[ . 1 . 2 . 3]" 1
784 1 58 VAL HA 1 89 LEU MD1 4.000 . 5.000 3.715 3.600 3.945 . 0 0 "[ . 1 . 2 . 3]" 1
785 1 58 VAL HA 1 89 LEU MD2 3.200 . 4.000 1.865 1.793 2.196 0.007 8 0 "[ . 1 . 2 . 3]" 1
786 1 58 VAL HB 1 87 LEU MD2 4.000 . 5.000 1.914 1.857 1.954 . 0 0 "[ . 1 . 2 . 3]" 1
787 1 58 VAL HB 1 89 LEU HA 4.000 . 5.000 4.205 3.910 4.438 . 0 0 "[ . 1 . 2 . 3]" 1
788 1 58 VAL HB 1 89 LEU MD1 3.200 . 4.000 4.026 4.000 4.076 0.076 26 0 "[ . 1 . 2 . 3]" 1
789 1 58 VAL HB 1 89 LEU MD2 4.000 . 5.000 2.018 1.805 2.338 . 0 0 "[ . 1 . 2 . 3]" 1
790 1 58 VAL MG1 1 59 LEU H 4.000 . 5.000 4.286 4.235 4.350 . 0 0 "[ . 1 . 2 . 3]" 1
791 1 58 VAL MG1 1 87 LEU QB 4.000 . 5.000 4.144 3.956 4.260 . 0 0 "[ . 1 . 2 . 3]" 1
792 1 58 VAL MG1 1 89 LEU HA 4.000 . 5.000 4.223 3.975 4.396 . 0 0 "[ . 1 . 2 . 3]" 1
793 1 58 VAL MG1 1 89 LEU QB 4.000 . 5.000 2.696 2.428 3.051 . 0 0 "[ . 1 . 2 . 3]" 1
794 1 58 VAL MG1 1 89 LEU MD2 2.600 . 3.000 2.079 1.806 2.385 . 0 0 "[ . 1 . 2 . 3]" 1
795 1 58 VAL MG2 1 59 LEU H 3.200 . 4.000 3.819 3.685 3.913 . 0 0 "[ . 1 . 2 . 3]" 1
796 1 58 VAL MG2 1 66 LEU QB 4.000 . 5.000 3.069 2.802 3.265 . 0 0 "[ . 1 . 2 . 3]" 1
797 1 58 VAL MG2 1 87 LEU MD2 3.200 . 4.000 2.756 2.423 2.952 . 0 0 "[ . 1 . 2 . 3]" 1
798 1 58 VAL MG2 1 89 LEU HA 4.000 . 5.000 4.895 4.673 5.018 0.018 20 0 "[ . 1 . 2 . 3]" 1
799 1 58 VAL MG2 1 89 LEU MD2 3.200 . 4.000 3.453 3.220 3.693 . 0 0 "[ . 1 . 2 . 3]" 1
800 1 59 LEU H 1 59 LEU QB 3.200 . 4.000 2.435 2.295 2.523 . 0 0 "[ . 1 . 2 . 3]" 1
801 1 59 LEU H 1 59 LEU MD2 3.200 . 4.000 2.913 2.178 3.474 . 0 0 "[ . 1 . 2 . 3]" 1
802 1 59 LEU H 1 59 LEU HG 4.000 . 5.000 3.496 2.755 4.341 . 0 0 "[ . 1 . 2 . 3]" 1
803 1 59 LEU H 1 60 ALA H 3.200 . 4.000 2.146 2.103 2.196 . 0 0 "[ . 1 . 2 . 3]" 1
804 1 59 LEU H 1 89 LEU HA 4.000 . 5.000 2.002 1.911 2.279 . 0 0 "[ . 1 . 2 . 3]" 1
805 1 59 LEU H 1 89 LEU MD2 3.200 . 4.000 3.138 2.962 3.431 . 0 0 "[ . 1 . 2 . 3]" 1
806 1 59 LEU H 1 89 LEU HG 4.000 . 5.000 5.045 5.012 5.081 0.081 24 0 "[ . 1 . 2 . 3]" 1
807 1 59 LEU H 1 90 GLU H 4.000 . 5.000 4.272 4.109 4.669 . 0 0 "[ . 1 . 2 . 3]" 1
808 1 59 LEU HA 1 59 LEU QD 4.000 . 5.000 1.948 1.861 2.086 . 0 0 "[ . 1 . 2 . 3]" 1
809 1 59 LEU HA 1 59 LEU MD2 2.600 . 3.000 2.292 1.903 2.977 . 0 0 "[ . 1 . 2 . 3]" 1
810 1 59 LEU HA 1 59 LEU HG 4.000 . 5.000 3.475 3.252 3.723 . 0 0 "[ . 1 . 2 . 3]" 1
811 1 59 LEU HA 1 60 ALA H 3.200 . 4.000 3.422 3.383 3.459 . 0 0 "[ . 1 . 2 . 3]" 1
812 1 59 LEU HA 1 66 LEU HB3 3.200 . 4.000 2.661 2.193 3.533 . 0 0 "[ . 1 . 2 . 3]" 1
813 1 59 LEU QB 1 59 LEU QD 2.600 . 3.000 1.959 1.910 2.082 . 0 0 "[ . 1 . 2 . 3]" 1
814 1 59 LEU QB 1 60 ALA H 3.200 . 4.000 3.145 3.014 3.253 . 0 0 "[ . 1 . 2 . 3]" 1
815 1 59 LEU QB 1 60 ALA MB 4.000 . 5.000 3.340 3.229 3.395 . 0 0 "[ . 1 . 2 . 3]" 1
816 1 59 LEU HB3 1 67 GLU H 3.200 . 4.000 3.999 3.815 4.030 0.030 15 0 "[ . 1 . 2 . 3]" 1
817 1 59 LEU QD 1 65 SER HA 4.000 . 5.000 4.943 4.464 5.043 0.043 18 0 "[ . 1 . 2 . 3]" 1
818 1 59 LEU QD 1 67 GLU QB 4.000 . 5.000 3.556 2.219 4.419 . 0 0 "[ . 1 . 2 . 3]" 1
819 1 59 LEU QD 1 90 GLU HB3 4.000 . 5.000 2.711 1.949 3.178 . 0 0 "[ . 1 . 2 . 3]" 1
820 1 59 LEU MD2 1 90 GLU H 4.000 . 5.000 4.164 3.010 5.012 0.012 18 0 "[ . 1 . 2 . 3]" 1
821 1 60 ALA H 1 60 ALA MB 3.200 . 4.000 2.615 2.590 2.657 . 0 0 "[ . 1 . 2 . 3]" 1
822 1 60 ALA H 1 65 SER HA 4.000 . 5.000 5.014 4.998 5.031 0.031 30 0 "[ . 1 . 2 . 3]" 1
823 1 60 ALA H 1 88 LEU H 4.000 . 5.000 3.503 3.141 3.713 . 0 0 "[ . 1 . 2 . 3]" 1
824 1 60 ALA HA 1 61 VAL H 2.600 . 3.000 2.220 2.197 2.259 . 0 0 "[ . 1 . 2 . 3]" 1
825 1 60 ALA HA 1 61 VAL MG2 3.200 . 4.000 3.494 3.348 3.580 . 0 0 "[ . 1 . 2 . 3]" 1
826 1 60 ALA HA 1 63 GLY H 4.000 . 5.000 4.443 4.361 4.513 . 0 0 "[ . 1 . 2 . 3]" 1
827 1 60 ALA HA 1 63 GLY HA2 4.000 . 5.000 5.066 5.054 5.081 0.081 12 0 "[ . 1 . 2 . 3]" 1
828 1 60 ALA HA 1 64 VAL H 3.200 . 4.000 3.903 3.846 3.945 . 0 0 "[ . 1 . 2 . 3]" 1
829 1 60 ALA HA 1 64 VAL MG1 4.000 . 5.000 3.304 3.252 3.352 . 0 0 "[ . 1 . 2 . 3]" 1
830 1 60 ALA HA 1 65 SER HA 2.600 . 3.000 2.822 2.790 2.881 . 0 0 "[ . 1 . 2 . 3]" 1
831 1 60 ALA HA 1 66 LEU H 3.200 . 4.000 3.179 2.783 3.490 . 0 0 "[ . 1 . 2 . 3]" 1
832 1 60 ALA HA 1 66 LEU HA 4.000 . 5.000 4.980 4.880 5.021 0.021 14 0 "[ . 1 . 2 . 3]" 1
833 1 60 ALA HA 1 66 LEU QB 3.200 . 4.000 3.541 3.339 3.809 . 0 0 "[ . 1 . 2 . 3]" 1
834 1 60 ALA MB 1 61 VAL HA 3.200 . 4.000 3.884 3.855 3.934 . 0 0 "[ . 1 . 2 . 3]" 1
835 1 60 ALA MB 1 62 ASN H 4.000 . 5.000 4.071 3.875 4.181 . 0 0 "[ . 1 . 2 . 3]" 1
836 1 60 ALA MB 1 63 GLY H 3.200 . 4.000 2.912 2.724 3.080 . 0 0 "[ . 1 . 2 . 3]" 1
837 1 60 ALA MB 1 63 GLY HA2 3.200 . 4.000 3.161 2.990 3.326 . 0 0 "[ . 1 . 2 . 3]" 1
838 1 60 ALA MB 1 64 VAL H 3.200 . 4.000 3.580 3.405 3.719 . 0 0 "[ . 1 . 2 . 3]" 1
839 1 60 ALA MB 1 65 SER HA 2.600 . 3.000 2.971 2.868 3.018 0.018 7 0 "[ . 1 . 2 . 3]" 1
840 1 60 ALA MB 1 66 LEU H 4.000 . 5.000 3.958 3.779 4.131 . 0 0 "[ . 1 . 2 . 3]" 1
841 1 60 ALA MB 1 88 LEU H 3.200 . 4.000 2.617 2.378 2.844 . 0 0 "[ . 1 . 2 . 3]" 1
842 1 60 ALA MB 1 88 LEU HB2 3.200 . 4.000 1.937 1.807 2.271 . 0 0 "[ . 1 . 2 . 3]" 1
843 1 61 VAL H 1 61 VAL HB 3.200 . 4.000 2.883 2.821 2.984 . 0 0 "[ . 1 . 2 . 3]" 1
844 1 61 VAL H 1 61 VAL MG1 3.200 . 4.000 3.947 3.910 3.981 . 0 0 "[ . 1 . 2 . 3]" 1
845 1 61 VAL H 1 61 VAL MG2 4.000 . 5.000 2.929 2.778 3.013 . 0 0 "[ . 1 . 2 . 3]" 1
846 1 61 VAL H 1 62 ASN H 4.000 . 5.000 3.822 3.682 3.873 . 0 0 "[ . 1 . 2 . 3]" 1
847 1 61 VAL H 1 64 VAL H 3.200 . 4.000 2.173 2.128 2.221 . 0 0 "[ . 1 . 2 . 3]" 1
848 1 61 VAL H 1 64 VAL HB 3.200 . 4.000 4.029 4.018 4.042 0.042 30 0 "[ . 1 . 2 . 3]" 1
849 1 61 VAL HA 1 61 VAL MG1 3.200 . 4.000 2.246 2.175 2.376 . 0 0 "[ . 1 . 2 . 3]" 1
850 1 61 VAL HA 1 61 VAL MG2 3.200 . 4.000 2.429 2.329 2.516 . 0 0 "[ . 1 . 2 . 3]" 1
851 1 61 VAL HA 1 62 ASN H 2.600 . 3.000 2.188 2.171 2.222 . 0 0 "[ . 1 . 2 . 3]" 1
852 1 61 VAL HA 1 63 GLY H 4.000 . 5.000 3.581 3.534 3.702 . 0 0 "[ . 1 . 2 . 3]" 1
853 1 61 VAL HA 1 64 VAL MG1 4.000 . 5.000 3.634 3.576 3.673 . 0 0 "[ . 1 . 2 . 3]" 1
854 1 61 VAL HA 1 81 THR MG 3.200 . 4.000 4.014 3.987 4.046 0.046 25 0 "[ . 1 . 2 . 3]" 1
855 1 61 VAL HA 1 87 LEU HA 2.600 . 3.000 2.354 2.129 2.616 . 0 0 "[ . 1 . 2 . 3]" 1
856 1 61 VAL HA 1 87 LEU MD1 4.000 . 5.000 3.321 3.095 3.461 . 0 0 "[ . 1 . 2 . 3]" 1
857 1 61 VAL HA 1 87 LEU MD2 3.200 . 4.000 3.243 3.155 3.342 . 0 0 "[ . 1 . 2 . 3]" 1
858 1 61 VAL HA 1 87 LEU HG 3.200 . 4.000 1.908 1.857 1.949 . 0 0 "[ . 1 . 2 . 3]" 1
859 1 61 VAL HA 1 88 LEU H 4.000 . 5.000 3.630 3.338 3.955 . 0 0 "[ . 1 . 2 . 3]" 1
860 1 61 VAL HB 1 62 ASN H 4.000 . 5.000 4.367 4.280 4.429 . 0 0 "[ . 1 . 2 . 3]" 1
861 1 61 VAL HB 1 64 VAL MG1 4.000 . 5.000 1.798 1.784 1.819 0.016 19 0 "[ . 1 . 2 . 3]" 1
862 1 61 VAL HB 1 77 THR HB 4.000 . 5.000 2.148 1.905 2.793 . 0 0 "[ . 1 . 2 . 3]" 1
863 1 61 VAL HB 1 77 THR MG 3.200 . 4.000 3.383 3.062 3.465 . 0 0 "[ . 1 . 2 . 3]" 1
864 1 61 VAL MG1 1 62 ASN H 3.200 . 4.000 3.139 2.996 3.274 . 0 0 "[ . 1 . 2 . 3]" 1
865 1 61 VAL MG1 1 62 ASN HB2 4.000 . 5.000 3.098 2.831 3.689 . 0 0 "[ . 1 . 2 . 3]" 1
866 1 61 VAL MG1 1 62 ASN HB3 4.000 . 5.000 4.507 4.326 4.664 . 0 0 "[ . 1 . 2 . 3]" 1
867 1 61 VAL MG1 1 64 VAL HB 4.000 . 5.000 4.773 4.625 4.997 . 0 0 "[ . 1 . 2 . 3]" 1
868 1 61 VAL MG1 1 64 VAL MG1 3.200 . 4.000 3.069 2.942 3.189 . 0 0 "[ . 1 . 2 . 3]" 1
869 1 61 VAL MG1 1 77 THR HA 3.200 . 4.000 3.496 3.279 3.879 . 0 0 "[ . 1 . 2 . 3]" 1
870 1 61 VAL MG1 1 77 THR HB 3.200 . 4.000 2.850 2.671 3.086 . 0 0 "[ . 1 . 2 . 3]" 1
871 1 61 VAL MG1 1 77 THR MG 3.200 . 4.000 3.988 3.713 4.015 0.015 11 0 "[ . 1 . 2 . 3]" 1
872 1 61 VAL MG1 1 78 LEU HA 4.000 . 5.000 1.897 1.845 2.005 . 0 0 "[ . 1 . 2 . 3]" 1
873 1 61 VAL MG1 1 81 THR HA 3.200 . 4.000 3.155 2.899 3.404 . 0 0 "[ . 1 . 2 . 3]" 1
874 1 61 VAL MG1 1 81 THR MG 2.600 . 3.000 1.992 1.870 2.083 . 0 0 "[ . 1 . 2 . 3]" 1
875 1 61 VAL MG1 1 86 HIS H 4.000 . 5.000 4.441 4.276 4.596 . 0 0 "[ . 1 . 2 . 3]" 1
876 1 61 VAL MG2 1 77 THR HB 4.000 . 5.000 2.018 1.897 2.242 . 0 0 "[ . 1 . 2 . 3]" 1
877 1 61 VAL MG2 1 77 THR MG 3.200 . 4.000 3.108 2.909 3.386 . 0 0 "[ . 1 . 2 . 3]" 1
878 1 61 VAL MG2 1 78 LEU HA 2.600 . 3.000 2.516 2.264 2.786 . 0 0 "[ . 1 . 2 . 3]" 1
879 1 61 VAL MG2 1 78 LEU QB 3.200 . 4.000 3.694 3.450 3.879 . 0 0 "[ . 1 . 2 . 3]" 1
880 1 61 VAL MG2 1 78 LEU HG 3.200 . 4.000 3.619 3.389 3.776 . 0 0 "[ . 1 . 2 . 3]" 1
881 1 61 VAL MG2 1 81 THR MG 3.200 . 4.000 3.990 3.835 4.040 0.040 10 0 "[ . 1 . 2 . 3]" 1
882 1 61 VAL MG2 1 87 LEU HA 3.200 . 4.000 3.706 3.535 3.903 . 0 0 "[ . 1 . 2 . 3]" 1
883 1 61 VAL MG2 1 87 LEU MD1 3.200 . 4.000 2.389 1.925 2.739 . 0 0 "[ . 1 . 2 . 3]" 1
884 1 62 ASN H 1 62 ASN HB2 3.200 . 4.000 3.415 3.322 3.730 . 0 0 "[ . 1 . 2 . 3]" 1
885 1 62 ASN H 1 62 ASN HB3 4.000 . 5.000 4.111 4.053 4.126 . 0 0 "[ . 1 . 2 . 3]" 1
886 1 62 ASN H 1 63 GLY H 3.200 . 4.000 2.540 2.473 2.560 . 0 0 "[ . 1 . 2 . 3]" 1
887 1 62 ASN H 1 63 GLY HA2 4.000 . 5.000 4.817 4.752 4.836 . 0 0 "[ . 1 . 2 . 3]" 1
888 1 62 ASN H 1 64 VAL H 4.000 . 5.000 4.045 3.989 4.068 . 0 0 "[ . 1 . 2 . 3]" 1
889 1 62 ASN H 1 81 THR MG 4.000 . 5.000 4.001 3.848 4.315 . 0 0 "[ . 1 . 2 . 3]" 1
890 1 62 ASN H 1 86 HIS H 3.200 . 4.000 4.002 3.789 4.042 0.042 22 0 "[ . 1 . 2 . 3]" 1
891 1 62 ASN H 1 86 HIS QB 4.000 . 5.000 3.278 3.094 3.438 . 0 0 "[ . 1 . 2 . 3]" 1
892 1 62 ASN H 1 87 LEU HA 3.200 . 4.000 2.892 2.707 3.044 . 0 0 "[ . 1 . 2 . 3]" 1
893 1 62 ASN H 1 88 LEU MD1 4.000 . 5.000 4.249 3.873 4.763 . 0 0 "[ . 1 . 2 . 3]" 1
894 1 62 ASN HA 1 86 HIS H 3.200 . 4.000 3.882 3.529 4.006 0.006 8 0 "[ . 1 . 2 . 3]" 1
895 1 62 ASN HB2 1 62 ASN QD 3.200 . 4.000 2.748 2.525 3.320 . 0 0 "[ . 1 . 2 . 3]" 1
896 1 62 ASN HB2 1 63 GLY H 4.000 . 5.000 3.946 3.870 3.990 . 0 0 "[ . 1 . 2 . 3]" 1
897 1 62 ASN HB3 1 62 ASN QD 3.200 . 4.000 3.252 2.764 3.351 . 0 0 "[ . 1 . 2 . 3]" 1
898 1 62 ASN HB3 1 63 GLY H 4.000 . 5.000 4.286 4.202 4.503 . 0 0 "[ . 1 . 2 . 3]" 1
899 1 62 ASN QD 1 85 VAL HA 4.000 . 5.000 2.585 2.487 2.638 . 0 0 "[ . 1 . 2 . 3]" 1
900 1 62 ASN QD 1 85 VAL MG1 3.200 . 4.000 4.024 4.007 4.039 0.039 17 0 "[ . 1 . 2 . 3]" 1
901 1 62 ASN QD 1 85 VAL MG2 4.000 . 5.000 3.924 3.753 4.027 . 0 0 "[ . 1 . 2 . 3]" 1
902 1 63 GLY H 1 64 VAL H 3.200 . 4.000 2.228 2.205 2.248 . 0 0 "[ . 1 . 2 . 3]" 1
903 1 63 GLY H 1 64 VAL HB 4.000 . 5.000 4.753 4.729 4.777 . 0 0 "[ . 1 . 2 . 3]" 1
904 1 63 GLY H 1 64 VAL MG1 3.200 . 4.000 3.772 3.708 3.834 . 0 0 "[ . 1 . 2 . 3]" 1
905 1 63 GLY H 1 86 HIS QB 4.000 . 5.000 4.725 4.347 5.001 0.001 20 0 "[ . 1 . 2 . 3]" 1
906 1 63 GLY HA2 1 64 VAL H 4.000 . 5.000 3.238 3.217 3.254 . 0 0 "[ . 1 . 2 . 3]" 1
907 1 63 GLY HA3 1 64 VAL H 3.200 . 4.000 3.357 3.347 3.369 . 0 0 "[ . 1 . 2 . 3]" 1
908 1 64 VAL H 1 64 VAL HB 3.200 . 4.000 2.661 2.629 2.685 . 0 0 "[ . 1 . 2 . 3]" 1
909 1 64 VAL H 1 64 VAL MG1 3.200 . 4.000 2.203 2.150 2.265 . 0 0 "[ . 1 . 2 . 3]" 1
910 1 64 VAL H 1 64 VAL MG2 3.200 . 4.000 3.834 3.828 3.841 . 0 0 "[ . 1 . 2 . 3]" 1
911 1 64 VAL HA 1 64 VAL MG1 3.200 . 4.000 3.201 3.197 3.205 . 0 0 "[ . 1 . 2 . 3]" 1
912 1 64 VAL HA 1 64 VAL MG2 2.600 . 3.000 2.218 2.084 2.307 . 0 0 "[ . 1 . 2 . 3]" 1
913 1 64 VAL HA 1 65 SER H 2.600 . 3.000 2.153 2.149 2.158 . 0 0 "[ . 1 . 2 . 3]" 1
914 1 64 VAL HB 1 65 SER H 4.000 . 5.000 4.504 4.489 4.528 . 0 0 "[ . 1 . 2 . 3]" 1
915 1 64 VAL HB 1 77 THR MG 3.200 . 4.000 4.008 3.778 4.026 0.026 6 0 "[ . 1 . 2 . 3]" 1
916 1 64 VAL MG1 1 65 SER H 3.200 . 4.000 4.019 3.999 4.037 0.037 15 0 "[ . 1 . 2 . 3]" 1
917 1 64 VAL MG1 1 77 THR MG 4.000 . 5.000 2.006 1.874 2.092 . 0 0 "[ . 1 . 2 . 3]" 1
918 1 64 VAL MG2 1 77 THR MG 3.200 . 4.000 2.573 2.404 2.740 . 0 0 "[ . 1 . 2 . 3]" 1
919 1 65 SER H 1 65 SER HB2 3.200 . 4.000 2.495 2.119 3.514 . 0 0 "[ . 1 . 2 . 3]" 1
920 1 65 SER H 1 65 SER HB3 3.200 . 4.000 3.394 2.904 3.592 . 0 0 "[ . 1 . 2 . 3]" 1
921 1 65 SER H 1 66 LEU H 4.000 . 5.000 4.552 4.433 4.603 . 0 0 "[ . 1 . 2 . 3]" 1
922 1 65 SER HA 1 66 LEU H 3.200 . 4.000 2.151 2.100 2.188 . 0 0 "[ . 1 . 2 . 3]" 1
923 1 65 SER HA 1 66 LEU QB 3.200 . 4.000 3.976 3.935 4.051 0.051 4 0 "[ . 1 . 2 . 3]" 1
924 1 65 SER HA 1 66 LEU QD 4.000 . 5.000 4.388 3.656 5.007 0.007 14 0 "[ . 1 . 2 . 3]" 1
925 1 65 SER HB3 1 66 LEU H 3.200 . 4.000 3.440 3.055 3.991 . 0 0 "[ . 1 . 2 . 3]" 1
926 1 66 LEU H 1 66 LEU HB2 3.200 . 4.000 2.227 2.127 2.384 . 0 0 "[ . 1 . 2 . 3]" 1
927 1 66 LEU H 1 66 LEU HB3 3.200 . 4.000 3.145 2.936 3.452 . 0 0 "[ . 1 . 2 . 3]" 1
928 1 66 LEU H 1 66 LEU MD1 4.000 . 5.000 4.095 3.041 4.331 . 0 0 "[ . 1 . 2 . 3]" 1
929 1 66 LEU H 1 66 LEU MD2 4.000 . 5.000 3.647 2.807 4.430 . 0 0 "[ . 1 . 2 . 3]" 1
930 1 66 LEU H 1 66 LEU HG 4.000 . 5.000 4.365 3.498 4.693 . 0 0 "[ . 1 . 2 . 3]" 1
931 1 66 LEU H 1 67 GLU H 3.200 . 4.000 2.248 2.141 2.372 . 0 0 "[ . 1 . 2 . 3]" 1
932 1 66 LEU HA 1 66 LEU QD 3.200 . 4.000 2.060 1.832 2.856 . 0 0 "[ . 1 . 2 . 3]" 1
933 1 66 LEU HA 1 66 LEU MD2 2.600 . 3.000 2.268 1.938 3.019 0.019 4 0 "[ . 1 . 2 . 3]" 1
934 1 66 LEU HA 1 67 GLU H 3.200 . 4.000 3.432 3.363 3.473 . 0 0 "[ . 1 . 2 . 3]" 1
935 1 66 LEU QD 1 69 ALA MB 4.000 . 5.000 2.134 1.796 3.197 0.004 19 0 "[ . 1 . 2 . 3]" 1
936 1 66 LEU QD 1 73 GLN QB 4.000 . 5.000 3.065 2.729 4.040 . 0 0 "[ . 1 . 2 . 3]" 1
937 1 66 LEU QD 1 74 ALA MB 3.200 . 4.000 1.845 1.762 2.076 0.038 14 0 "[ . 1 . 2 . 3]" 1
938 1 66 LEU QD 1 77 THR HA 4.000 . 5.000 4.655 4.173 4.959 . 0 0 "[ . 1 . 2 . 3]" 1
939 1 66 LEU QD 1 77 THR HB 3.200 . 4.000 3.093 2.446 3.417 . 0 0 "[ . 1 . 2 . 3]" 1
940 1 66 LEU QD 1 77 THR MG 3.200 . 4.000 2.184 1.829 2.914 . 0 0 "[ . 1 . 2 . 3]" 1
941 1 67 GLU H 1 67 GLU QB 3.200 . 4.000 2.263 2.048 2.625 . 0 0 "[ . 1 . 2 . 3]" 1
942 1 67 GLU H 1 68 GLY H 4.000 . 5.000 4.285 4.218 4.403 . 0 0 "[ . 1 . 2 . 3]" 1
943 1 67 GLU HA 1 68 GLY H 3.200 . 4.000 2.189 2.148 2.219 . 0 0 "[ . 1 . 2 . 3]" 1
944 1 67 GLU HA 1 69 ALA H 4.000 . 5.000 4.580 4.324 4.799 . 0 0 "[ . 1 . 2 . 3]" 1
945 1 68 GLY H 1 69 ALA H 3.200 . 4.000 2.494 2.315 2.634 . 0 0 "[ . 1 . 2 . 3]" 1
946 1 68 GLY QA 1 69 ALA H 3.200 . 4.000 2.475 2.407 2.575 . 0 0 "[ . 1 . 2 . 3]" 1
947 1 69 ALA H 1 69 ALA MB 2.600 . 3.000 2.845 2.825 2.880 . 0 0 "[ . 1 . 2 . 3]" 1
948 1 69 ALA HA 1 70 THR MG 4.000 . 5.000 3.368 3.202 3.514 . 0 0 "[ . 1 . 2 . 3]" 1
949 1 69 ALA HA 1 73 GLN QB 3.200 . 4.000 3.497 2.893 3.823 . 0 0 "[ . 1 . 2 . 3]" 1
950 1 69 ALA HA 1 73 GLN QG 3.200 . 4.000 3.679 3.349 4.002 0.002 24 0 "[ . 1 . 2 . 3]" 1
951 1 69 ALA MB 1 73 GLN H 4.000 . 5.000 4.243 4.100 4.380 . 0 0 "[ . 1 . 2 . 3]" 1
952 1 69 ALA MB 1 73 GLN HA 4.000 . 5.000 4.183 3.987 4.332 . 0 0 "[ . 1 . 2 . 3]" 1
953 1 69 ALA MB 1 73 GLN QB 4.000 . 5.000 1.844 1.791 2.013 0.009 25 0 "[ . 1 . 2 . 3]" 1
954 1 69 ALA MB 1 74 ALA H 3.200 . 4.000 3.553 3.151 3.905 . 0 0 "[ . 1 . 2 . 3]" 1
955 1 70 THR H 1 70 THR HB 4.000 . 5.000 3.642 3.581 3.668 . 0 0 "[ . 1 . 2 . 3]" 1
956 1 70 THR H 1 70 THR MG 3.200 . 4.000 2.171 1.990 2.388 . 0 0 "[ . 1 . 2 . 3]" 1
957 1 70 THR H 1 71 HIS H 4.000 . 5.000 4.449 4.408 4.499 . 0 0 "[ . 1 . 2 . 3]" 1
958 1 70 THR H 1 73 GLN H 4.000 . 5.000 3.682 3.479 3.915 . 0 0 "[ . 1 . 2 . 3]" 1
959 1 70 THR HA 1 70 THR MG 2.600 . 3.000 2.537 2.463 2.639 . 0 0 "[ . 1 . 2 . 3]" 1
960 1 70 THR HA 1 71 HIS H 3.200 . 4.000 2.662 2.635 2.691 . 0 0 "[ . 1 . 2 . 3]" 1
961 1 70 THR HA 1 72 LYS H 4.000 . 5.000 5.051 5.024 5.085 0.085 9 0 "[ . 1 . 2 . 3]" 1
962 1 70 THR HB 1 72 LYS H 3.200 . 4.000 3.790 3.692 3.930 . 0 0 "[ . 1 . 2 . 3]" 1
963 1 70 THR HB 1 73 GLN H 4.000 . 5.000 4.207 4.000 4.370 . 0 0 "[ . 1 . 2 . 3]" 1
964 1 70 THR MG 1 71 HIS H 3.200 . 4.000 3.707 3.666 3.775 . 0 0 "[ . 1 . 2 . 3]" 1
965 1 70 THR MG 1 72 LYS H 4.000 . 5.000 4.739 4.656 4.800 . 0 0 "[ . 1 . 2 . 3]" 1
966 1 70 THR MG 1 73 GLN H 4.000 . 5.000 4.167 4.026 4.248 . 0 0 "[ . 1 . 2 . 3]" 1
967 1 70 THR MG 1 73 GLN QG 4.000 . 5.000 3.261 2.345 4.746 . 0 0 "[ . 1 . 2 . 3]" 1
968 1 71 HIS H 1 71 HIS HB2 3.200 . 4.000 3.032 2.745 3.145 . 0 0 "[ . 1 . 2 . 3]" 1
969 1 71 HIS H 1 71 HIS HB3 3.200 . 4.000 2.091 2.049 2.243 . 0 0 "[ . 1 . 2 . 3]" 1
970 1 71 HIS H 1 72 LYS H 3.200 . 4.000 2.833 2.800 2.881 . 0 0 "[ . 1 . 2 . 3]" 1
971 1 71 HIS H 1 72 LYS HB2 4.000 . 5.000 5.030 5.012 5.045 0.045 9 0 "[ . 1 . 2 . 3]" 1
972 1 71 HIS H 1 72 LYS HB3 4.000 . 5.000 5.016 4.975 5.043 0.043 23 0 "[ . 1 . 2 . 3]" 1
973 1 71 HIS HA 1 71 HIS HD2 4.000 . 5.000 3.211 2.955 3.349 . 0 0 "[ . 1 . 2 . 3]" 1
974 1 71 HIS HA 1 72 LYS H 3.200 . 4.000 3.553 3.533 3.570 . 0 0 "[ . 1 . 2 . 3]" 1
975 1 71 HIS HA 1 74 ALA MB 4.000 . 5.000 3.202 2.996 3.423 . 0 0 "[ . 1 . 2 . 3]" 1
976 1 71 HIS HB2 1 71 HIS HD2 3.200 . 4.000 3.295 3.150 3.627 . 0 0 "[ . 1 . 2 . 3]" 1
977 1 71 HIS HB2 1 72 LYS H 3.200 . 4.000 3.846 3.718 3.907 . 0 0 "[ . 1 . 2 . 3]" 1
978 1 71 HIS HB3 1 71 HIS HD2 3.200 . 4.000 3.935 3.798 3.972 . 0 0 "[ . 1 . 2 . 3]" 1
979 1 71 HIS HB3 1 72 LYS H 3.200 . 4.000 2.647 2.301 2.756 . 0 0 "[ . 1 . 2 . 3]" 1
980 1 71 HIS HD2 1 75 VAL HB 4.000 . 5.000 2.960 2.530 3.354 . 0 0 "[ . 1 . 2 . 3]" 1
981 1 71 HIS HD2 1 75 VAL MG1 4.000 . 5.000 4.381 4.032 4.735 . 0 0 "[ . 1 . 2 . 3]" 1
982 1 71 HIS HD2 1 75 VAL MG2 3.200 . 4.000 2.583 2.314 2.875 . 0 0 "[ . 1 . 2 . 3]" 1
983 1 72 LYS H 1 72 LYS HB2 3.200 . 4.000 2.336 2.302 2.363 . 0 0 "[ . 1 . 2 . 3]" 1
984 1 72 LYS H 1 72 LYS HB3 3.200 . 4.000 2.699 2.672 2.713 . 0 0 "[ . 1 . 2 . 3]" 1
985 1 72 LYS H 1 72 LYS QD 4.000 . 5.000 4.527 4.211 4.762 . 0 0 "[ . 1 . 2 . 3]" 1
986 1 72 LYS H 1 72 LYS QG 4.000 . 5.000 3.932 3.907 3.982 . 0 0 "[ . 1 . 2 . 3]" 1
987 1 72 LYS H 1 73 GLN H 3.200 . 4.000 2.749 2.698 2.780 . 0 0 "[ . 1 . 2 . 3]" 1
988 1 72 LYS HA 1 72 LYS QD 4.000 . 5.000 4.012 3.272 4.199 . 0 0 "[ . 1 . 2 . 3]" 1
989 1 72 LYS HA 1 72 LYS QG 3.200 . 4.000 2.393 2.266 2.442 . 0 0 "[ . 1 . 2 . 3]" 1
990 1 72 LYS HA 1 73 GLN H 3.200 . 4.000 3.511 3.487 3.527 . 0 0 "[ . 1 . 2 . 3]" 1
991 1 72 LYS HA 1 75 VAL H 3.200 . 4.000 3.300 3.183 3.488 . 0 0 "[ . 1 . 2 . 3]" 1
992 1 72 LYS HA 1 75 VAL HB 2.600 . 3.000 1.945 1.894 2.040 . 0 0 "[ . 1 . 2 . 3]" 1
993 1 72 LYS HA 1 75 VAL MG1 2.600 . 3.000 2.514 2.315 2.703 . 0 0 "[ . 1 . 2 . 3]" 1
994 1 72 LYS HA 1 75 VAL MG2 2.600 . 3.000 3.111 3.076 3.140 0.140 17 0 "[ . 1 . 2 . 3]" 1
995 1 72 LYS HA 1 76 GLU H 3.200 . 4.000 4.046 4.008 4.075 0.075 26 0 "[ . 1 . 2 . 3]" 1
996 1 72 LYS HA 1 76 GLU QG 3.200 . 4.000 4.021 3.948 4.056 0.056 24 0 "[ . 1 . 2 . 3]" 1
997 1 72 LYS HB3 1 72 LYS HE3 2.600 . 3.000 2.467 1.989 3.001 0.001 15 0 "[ . 1 . 2 . 3]" 1
998 1 72 LYS HB3 1 73 GLN H 3.200 . 4.000 2.775 2.701 2.862 . 0 0 "[ . 1 . 2 . 3]" 1
999 1 72 LYS QE 1 72 LYS QG 3.200 . 4.000 2.367 2.061 2.667 . 0 0 "[ . 1 . 2 . 3]" 1
1000 1 72 LYS QG 1 73 GLN H 3.200 . 4.000 4.003 3.947 4.029 0.029 5 0 "[ . 1 . 2 . 3]" 1
1001 1 73 GLN H 1 73 GLN QB 3.200 . 4.000 2.293 2.100 2.420 . 0 0 "[ . 1 . 2 . 3]" 1
1002 1 73 GLN H 1 73 GLN QG 3.200 . 4.000 2.955 2.396 3.936 . 0 0 "[ . 1 . 2 . 3]" 1
1003 1 73 GLN H 1 74 ALA H 3.200 . 4.000 2.756 2.695 2.860 . 0 0 "[ . 1 . 2 . 3]" 1
1004 1 73 GLN H 1 76 GLU H 4.000 . 5.000 4.748 4.671 4.820 . 0 0 "[ . 1 . 2 . 3]" 1
1005 1 73 GLN HA 1 73 GLN QG 3.200 . 4.000 2.200 2.069 2.299 . 0 0 "[ . 1 . 2 . 3]" 1
1006 1 73 GLN HA 1 76 GLU H 4.000 . 5.000 3.721 3.599 3.819 . 0 0 "[ . 1 . 2 . 3]" 1
1007 1 73 GLN HA 1 77 THR H 4.000 . 5.000 4.711 4.566 4.853 . 0 0 "[ . 1 . 2 . 3]" 1
1008 1 73 GLN HA 1 77 THR MG 4.000 . 5.000 4.693 4.339 5.039 0.039 6 0 "[ . 1 . 2 . 3]" 1
1009 1 73 GLN QB 1 74 ALA H 3.200 . 4.000 2.378 2.285 2.463 . 0 0 "[ . 1 . 2 . 3]" 1
1010 1 73 GLN QB 1 74 ALA MB 3.200 . 4.000 3.632 3.547 3.726 . 0 0 "[ . 1 . 2 . 3]" 1
1011 1 73 GLN QG 1 74 ALA H 3.200 . 4.000 4.022 3.974 4.075 0.075 2 0 "[ . 1 . 2 . 3]" 1
1012 1 74 ALA H 1 74 ALA MB 3.200 . 4.000 2.180 2.048 2.257 . 0 0 "[ . 1 . 2 . 3]" 1
1013 1 74 ALA H 1 77 THR H 4.000 . 5.000 4.662 4.587 4.758 . 0 0 "[ . 1 . 2 . 3]" 1
1014 1 74 ALA HA 1 77 THR MG 3.200 . 4.000 2.652 2.111 3.495 . 0 0 "[ . 1 . 2 . 3]" 1
1015 1 74 ALA HA 1 78 LEU QD 4.000 . 5.000 3.460 3.263 3.609 . 0 0 "[ . 1 . 2 . 3]" 1
1016 1 74 ALA MB 1 77 THR H 3.200 . 4.000 4.137 4.107 4.209 0.209 6 0 "[ . 1 . 2 . 3]" 1
1017 1 74 ALA MB 1 78 LEU QD 4.000 . 5.000 2.455 2.313 2.589 . 0 0 "[ . 1 . 2 . 3]" 1
1018 1 75 VAL H 1 75 VAL HB 3.200 . 4.000 2.080 2.071 2.089 . 0 0 "[ . 1 . 2 . 3]" 1
1019 1 75 VAL H 1 75 VAL MG1 3.200 . 4.000 3.294 3.234 3.375 . 0 0 "[ . 1 . 2 . 3]" 1
1020 1 75 VAL H 1 75 VAL MG2 3.200 . 4.000 3.258 3.160 3.322 . 0 0 "[ . 1 . 2 . 3]" 1
1021 1 75 VAL HA 1 75 VAL MG1 3.200 . 4.000 3.026 2.987 3.062 . 0 0 "[ . 1 . 2 . 3]" 1
1022 1 75 VAL HA 1 75 VAL MG2 2.600 . 3.000 1.958 1.936 2.026 . 0 0 "[ . 1 . 2 . 3]" 1
1023 1 75 VAL HA 1 76 GLU H 3.200 . 4.000 3.502 3.491 3.516 . 0 0 "[ . 1 . 2 . 3]" 1
1024 1 75 VAL HA 1 78 LEU H 3.200 . 4.000 3.838 3.755 3.965 . 0 0 "[ . 1 . 2 . 3]" 1
1025 1 75 VAL HA 1 78 LEU HB2 4.000 . 5.000 3.315 3.194 3.477 . 0 0 "[ . 1 . 2 . 3]" 1
1026 1 75 VAL HA 1 78 LEU HB3 4.000 . 5.000 4.816 4.672 4.998 . 0 0 "[ . 1 . 2 . 3]" 1
1027 1 75 VAL HA 1 78 LEU HG 4.000 . 5.000 2.871 2.724 3.072 . 0 0 "[ . 1 . 2 . 3]" 1
1028 1 75 VAL HA 1 79 ARG H 4.000 . 5.000 3.822 3.764 3.888 . 0 0 "[ . 1 . 2 . 3]" 1
1029 1 75 VAL HA 1 79 ARG QB 3.200 . 4.000 4.069 4.045 4.085 0.085 10 0 "[ . 1 . 2 . 3]" 1
1030 1 75 VAL HB 1 76 GLU H 3.200 . 4.000 3.170 3.072 3.243 . 0 0 "[ . 1 . 2 . 3]" 1
1031 1 75 VAL MG1 1 76 GLU H 3.200 . 4.000 2.153 2.078 2.234 . 0 0 "[ . 1 . 2 . 3]" 1
1032 1 75 VAL MG1 1 76 GLU HA 2.600 . 3.000 2.885 2.856 2.904 . 0 0 "[ . 1 . 2 . 3]" 1
1033 1 75 VAL MG1 1 76 GLU QG 4.000 . 5.000 1.948 1.878 2.036 . 0 0 "[ . 1 . 2 . 3]" 1
1034 1 75 VAL MG2 1 76 GLU H 4.000 . 5.000 4.130 4.113 4.153 . 0 0 "[ . 1 . 2 . 3]" 1
1035 1 75 VAL MG2 1 76 GLU HA 4.000 . 5.000 4.954 4.890 5.009 0.009 18 0 "[ . 1 . 2 . 3]" 1
1036 1 75 VAL MG2 1 79 ARG QB 4.000 . 5.000 4.120 3.994 4.254 . 0 0 "[ . 1 . 2 . 3]" 1
1037 1 76 GLU H 1 76 GLU QB 3.200 . 4.000 2.487 2.397 2.625 . 0 0 "[ . 1 . 2 . 3]" 1
1038 1 76 GLU H 1 76 GLU QG 3.200 . 4.000 2.193 2.091 2.302 . 0 0 "[ . 1 . 2 . 3]" 1
1039 1 76 GLU H 1 77 THR H 3.200 . 4.000 2.638 2.605 2.675 . 0 0 "[ . 1 . 2 . 3]" 1
1040 1 76 GLU HA 1 76 GLU QG 3.200 . 4.000 2.541 2.459 2.641 . 0 0 "[ . 1 . 2 . 3]" 1
1041 1 76 GLU HA 1 79 ARG H 3.200 . 4.000 3.856 3.822 3.891 . 0 0 "[ . 1 . 2 . 3]" 1
1042 1 76 GLU HA 1 79 ARG QB 2.600 . 3.000 2.940 2.816 3.008 0.008 4 0 "[ . 1 . 2 . 3]" 1
1043 1 76 GLU HA 1 80 ASN H 4.000 . 5.000 3.342 3.242 3.443 . 0 0 "[ . 1 . 2 . 3]" 1
1044 1 76 GLU QB 1 80 ASN QD 4.000 . 5.000 2.414 1.865 3.245 . 0 0 "[ . 1 . 2 . 3]" 1
1045 1 76 GLU QG 1 80 ASN QD 4.000 . 5.000 3.655 2.966 4.176 . 0 0 "[ . 1 . 2 . 3]" 1
1046 1 77 THR H 1 77 THR HB 3.200 . 4.000 3.596 3.487 3.620 . 0 0 "[ . 1 . 2 . 3]" 1
1047 1 77 THR H 1 77 THR MG 3.200 . 4.000 2.414 2.099 2.925 . 0 0 "[ . 1 . 2 . 3]" 1
1048 1 77 THR H 1 78 LEU H 3.200 . 4.000 2.810 2.773 2.839 . 0 0 "[ . 1 . 2 . 3]" 1
1049 1 77 THR HA 1 77 THR MG 3.200 . 4.000 2.363 2.157 2.495 . 0 0 "[ . 1 . 2 . 3]" 1
1050 1 77 THR HB 1 80 ASN QB 4.000 . 5.000 5.021 5.014 5.028 0.028 15 0 "[ . 1 . 2 . 3]" 1
1051 1 77 THR MG 1 78 LEU H 4.000 . 5.000 3.868 3.666 4.041 . 0 0 "[ . 1 . 2 . 3]" 1
1052 1 77 THR MG 1 78 LEU QD 4.000 . 5.000 3.960 3.766 4.094 . 0 0 "[ . 1 . 2 . 3]" 1
1053 1 78 LEU H 1 78 LEU HB2 3.200 . 4.000 2.900 2.886 2.929 . 0 0 "[ . 1 . 2 . 3]" 1
1054 1 78 LEU H 1 78 LEU HB3 3.200 . 4.000 3.565 3.556 3.574 . 0 0 "[ . 1 . 2 . 3]" 1
1055 1 78 LEU H 1 78 LEU QD 3.200 . 4.000 2.302 2.040 2.497 . 0 0 "[ . 1 . 2 . 3]" 1
1056 1 78 LEU H 1 78 LEU HG 3.200 . 4.000 1.956 1.890 2.015 . 0 0 "[ . 1 . 2 . 3]" 1
1057 1 78 LEU H 1 79 ARG H 3.200 . 4.000 2.792 2.768 2.812 . 0 0 "[ . 1 . 2 . 3]" 1
1058 1 78 LEU HA 1 78 LEU QD 3.200 . 4.000 2.119 2.003 2.303 . 0 0 "[ . 1 . 2 . 3]" 1
1059 1 78 LEU HA 1 78 LEU MD2 2.600 . 3.000 2.129 2.009 2.322 . 0 0 "[ . 1 . 2 . 3]" 1
1060 1 78 LEU HA 1 78 LEU HG 4.000 . 5.000 3.523 3.447 3.576 . 0 0 "[ . 1 . 2 . 3]" 1
1061 1 78 LEU HA 1 81 THR MG 3.200 . 4.000 3.258 3.085 3.414 . 0 0 "[ . 1 . 2 . 3]" 1
1062 1 78 LEU HA 1 85 VAL MG1 4.000 . 5.000 4.798 4.588 4.988 . 0 0 "[ . 1 . 2 . 3]" 1
1063 1 78 LEU HA 1 87 LEU MD1 3.200 . 4.000 1.981 1.854 2.257 . 0 0 "[ . 1 . 2 . 3]" 1
1064 1 78 LEU QB 1 78 LEU QD 2.600 . 3.000 1.939 1.915 1.970 . 0 0 "[ . 1 . 2 . 3]" 1
1065 1 78 LEU QB 1 85 VAL MG1 4.000 . 5.000 4.658 4.466 4.893 . 0 0 "[ . 1 . 2 . 3]" 1
1066 1 78 LEU QD 1 87 LEU HG 4.000 . 5.000 3.176 2.977 3.412 . 0 0 "[ . 1 . 2 . 3]" 1
1067 1 78 LEU HG 1 79 ARG QB 4.000 . 5.000 5.020 5.001 5.043 0.043 24 0 "[ . 1 . 2 . 3]" 1
1068 1 79 ARG H 1 79 ARG QB 2.600 . 3.000 2.133 2.092 2.185 . 0 0 "[ . 1 . 2 . 3]" 1
1069 1 79 ARG H 1 80 ASN H 3.200 . 4.000 2.756 2.698 2.790 . 0 0 "[ . 1 . 2 . 3]" 1
1070 1 79 ARG H 1 80 ASN QB 4.000 . 5.000 4.700 4.591 4.801 . 0 0 "[ . 1 . 2 . 3]" 1
1071 1 79 ARG HA 1 81 THR H 3.200 . 4.000 3.992 3.895 4.025 0.025 13 0 "[ . 1 . 2 . 3]" 1
1072 1 79 ARG QB 1 80 ASN H 3.200 . 4.000 2.151 2.073 2.224 . 0 0 "[ . 1 . 2 . 3]" 1
1073 1 80 ASN H 1 80 ASN QB 3.200 . 4.000 2.441 2.307 2.544 . 0 0 "[ . 1 . 2 . 3]" 1
1074 1 80 ASN HA 1 81 THR H 3.200 . 4.000 2.570 2.541 2.625 . 0 0 "[ . 1 . 2 . 3]" 1
1075 1 80 ASN QB 1 81 THR H 3.200 . 4.000 3.919 3.913 3.928 . 0 0 "[ . 1 . 2 . 3]" 1
1076 1 81 THR H 1 81 THR HB 3.200 . 4.000 3.333 3.296 3.376 . 0 0 "[ . 1 . 2 . 3]" 1
1077 1 81 THR H 1 81 THR MG 3.200 . 4.000 3.473 3.422 3.525 . 0 0 "[ . 1 . 2 . 3]" 1
1078 1 81 THR H 1 82 GLY H 4.000 . 5.000 2.707 2.614 2.842 . 0 0 "[ . 1 . 2 . 3]" 1
1079 1 81 THR HA 1 81 THR MG 3.200 . 4.000 2.010 1.983 2.050 . 0 0 "[ . 1 . 2 . 3]" 1
1080 1 81 THR HB 1 85 VAL MG1 4.000 . 5.000 4.918 4.627 5.006 0.006 1 0 "[ . 1 . 2 . 3]" 1
1081 1 81 THR HB 1 85 VAL MG2 3.200 . 4.000 2.974 2.801 3.184 . 0 0 "[ . 1 . 2 . 3]" 1
1082 1 81 THR MG 1 82 GLY H 3.200 . 4.000 3.801 3.712 3.856 . 0 0 "[ . 1 . 2 . 3]" 1
1083 1 81 THR MG 1 84 VAL H 4.000 . 5.000 5.020 4.997 5.046 0.046 17 0 "[ . 1 . 2 . 3]" 1
1084 1 81 THR MG 1 85 VAL HA 4.000 . 5.000 2.038 1.905 2.206 . 0 0 "[ . 1 . 2 . 3]" 1
1085 1 81 THR MG 1 85 VAL MG1 3.200 . 4.000 3.221 2.948 3.385 . 0 0 "[ . 1 . 2 . 3]" 1
1086 1 81 THR MG 1 85 VAL MG2 4.000 . 5.000 2.611 2.313 2.934 . 0 0 "[ . 1 . 2 . 3]" 1
1087 1 82 GLY H 1 83 GLN H 3.200 . 4.000 4.075 4.037 4.118 0.118 2 0 "[ . 1 . 2 . 3]" 1
1088 1 82 GLY H 1 85 VAL MG2 4.000 . 5.000 4.280 4.121 4.384 . 0 0 "[ . 1 . 2 . 3]" 1
1089 1 82 GLY QA 1 83 GLN H 3.200 . 4.000 2.118 2.085 2.165 . 0 0 "[ . 1 . 2 . 3]" 1
1090 1 83 GLN H 1 83 GLN HB2 3.200 . 4.000 3.444 2.982 3.543 . 0 0 "[ . 1 . 2 . 3]" 1
1091 1 83 GLN H 1 83 GLN HB3 4.000 . 5.000 3.084 2.931 3.542 . 0 0 "[ . 1 . 2 . 3]" 1
1092 1 83 GLN H 1 83 GLN HG3 3.200 . 4.000 1.942 1.843 2.013 . 0 0 "[ . 1 . 2 . 3]" 1
1093 1 83 GLN H 1 84 VAL H 3.200 . 4.000 3.230 3.112 3.331 . 0 0 "[ . 1 . 2 . 3]" 1
1094 1 83 GLN HA 1 83 GLN QG 3.200 . 4.000 3.194 2.750 3.285 . 0 0 "[ . 1 . 2 . 3]" 1
1095 1 83 GLN HB2 1 84 VAL H 3.200 . 4.000 2.206 1.782 2.383 0.018 7 0 "[ . 1 . 2 . 3]" 1
1096 1 83 GLN HB2 1 84 VAL MG2 3.200 . 4.000 2.582 2.458 2.885 . 0 0 "[ . 1 . 2 . 3]" 1
1097 1 83 GLN HB3 1 84 VAL H 4.000 . 5.000 3.505 3.302 3.571 . 0 0 "[ . 1 . 2 . 3]" 1
1098 1 83 GLN QG 1 84 VAL H 3.200 . 4.000 2.375 1.942 3.731 . 0 0 "[ . 1 . 2 . 3]" 1
1099 1 83 GLN QG 1 84 VAL MG2 4.000 . 5.000 4.101 3.908 4.596 . 0 0 "[ . 1 . 2 . 3]" 1
1100 1 84 VAL H 1 84 VAL HB 2.600 . 3.000 2.500 2.473 2.529 . 0 0 "[ . 1 . 2 . 3]" 1
1101 1 84 VAL H 1 84 VAL MG1 3.200 . 4.000 3.783 3.761 3.804 . 0 0 "[ . 1 . 2 . 3]" 1
1102 1 84 VAL H 1 84 VAL MG2 3.200 . 4.000 2.724 2.650 2.809 . 0 0 "[ . 1 . 2 . 3]" 1
1103 1 84 VAL H 1 85 VAL H 4.000 . 5.000 4.520 4.513 4.527 . 0 0 "[ . 1 . 2 . 3]" 1
1104 1 84 VAL HA 1 84 VAL MG1 3.200 . 4.000 2.473 2.431 2.510 . 0 0 "[ . 1 . 2 . 3]" 1
1105 1 84 VAL HA 1 84 VAL MG2 2.600 . 3.000 2.337 2.297 2.380 . 0 0 "[ . 1 . 2 . 3]" 1
1106 1 84 VAL HA 1 85 VAL H 2.600 . 3.000 2.361 2.336 2.397 . 0 0 "[ . 1 . 2 . 3]" 1
1107 1 84 VAL HA 1 85 VAL MG2 4.000 . 5.000 3.902 3.709 4.022 . 0 0 "[ . 1 . 2 . 3]" 1
1108 1 85 VAL H 1 85 VAL HB 3.200 . 4.000 2.329 2.296 2.388 . 0 0 "[ . 1 . 2 . 3]" 1
1109 1 85 VAL H 1 85 VAL MG1 3.200 . 4.000 3.675 3.640 3.735 . 0 0 "[ . 1 . 2 . 3]" 1
1110 1 85 VAL H 1 85 VAL MG2 3.200 . 4.000 2.932 2.749 3.028 . 0 0 "[ . 1 . 2 . 3]" 1
1111 1 85 VAL H 1 86 HIS H 4.000 . 5.000 3.847 3.795 3.900 . 0 0 "[ . 1 . 2 . 3]" 1
1112 1 85 VAL HA 1 85 VAL MG1 3.200 . 4.000 2.561 2.480 2.609 . 0 0 "[ . 1 . 2 . 3]" 1
1113 1 85 VAL HA 1 85 VAL MG2 3.200 . 4.000 2.104 2.063 2.183 . 0 0 "[ . 1 . 2 . 3]" 1
1114 1 85 VAL HA 1 86 HIS H 2.600 . 3.000 2.316 2.273 2.364 . 0 0 "[ . 1 . 2 . 3]" 1
1115 1 85 VAL HA 1 86 HIS QB 4.000 . 5.000 4.337 4.307 4.372 . 0 0 "[ . 1 . 2 . 3]" 1
1116 1 85 VAL HB 1 86 HIS H 4.000 . 5.000 4.562 4.517 4.579 . 0 0 "[ . 1 . 2 . 3]" 1
1117 1 85 VAL MG1 1 86 HIS H 3.200 . 4.000 3.565 3.511 3.599 . 0 0 "[ . 1 . 2 . 3]" 1
1118 1 85 VAL MG1 1 86 HIS HA 4.000 . 5.000 3.837 3.767 3.949 . 0 0 "[ . 1 . 2 . 3]" 1
1119 1 85 VAL MG2 1 86 HIS H 4.000 . 5.000 4.144 4.081 4.235 . 0 0 "[ . 1 . 2 . 3]" 1
1120 1 86 HIS H 1 86 HIS QB 3.200 . 4.000 2.369 2.321 2.398 . 0 0 "[ . 1 . 2 . 3]" 1
1121 1 86 HIS QB 1 86 HIS HD2 2.600 . 3.000 2.676 2.625 2.718 . 0 0 "[ . 1 . 2 . 3]" 1
1122 1 86 HIS QB 1 87 LEU H 3.200 . 4.000 3.998 3.957 4.022 0.022 20 0 "[ . 1 . 2 . 3]" 1
1123 1 86 HIS HE1 1 88 LEU MD1 3.200 . 4.000 2.705 2.273 3.003 . 0 0 "[ . 1 . 2 . 3]" 1
1124 1 86 HIS HE1 1 88 LEU HG 4.000 . 5.000 4.857 4.342 5.004 0.004 18 0 "[ . 1 . 2 . 3]" 1
1125 1 87 LEU H 1 87 LEU HB2 3.200 . 4.000 2.242 2.222 2.258 . 0 0 "[ . 1 . 2 . 3]" 1
1126 1 87 LEU H 1 87 LEU HB3 3.200 . 4.000 3.236 3.201 3.256 . 0 0 "[ . 1 . 2 . 3]" 1
1127 1 87 LEU H 1 87 LEU HG 3.200 . 4.000 4.059 4.048 4.075 0.075 21 0 "[ . 1 . 2 . 3]" 1
1128 1 87 LEU H 1 88 LEU H 4.000 . 5.000 4.405 4.337 4.463 . 0 0 "[ . 1 . 2 . 3]" 1
1129 1 87 LEU H 1 89 LEU MD2 4.000 . 5.000 4.399 4.260 4.653 . 0 0 "[ . 1 . 2 . 3]" 1
1130 1 87 LEU HA 1 87 LEU MD1 3.200 . 4.000 3.482 3.461 3.525 . 0 0 "[ . 1 . 2 . 3]" 1
1131 1 87 LEU HA 1 87 LEU MD2 2.600 . 3.000 2.975 2.917 3.009 0.009 23 0 "[ . 1 . 2 . 3]" 1
1132 1 87 LEU HA 1 87 LEU HG 3.200 . 4.000 2.100 2.086 2.122 . 0 0 "[ . 1 . 2 . 3]" 1
1133 1 87 LEU HA 1 88 LEU H 2.600 . 3.000 2.148 2.138 2.168 . 0 0 "[ . 1 . 2 . 3]" 1
1134 1 87 LEU HA 1 89 LEU MD2 3.200 . 4.000 3.539 3.397 3.807 . 0 0 "[ . 1 . 2 . 3]" 1
1135 1 87 LEU HB2 1 87 LEU MD1 3.200 . 4.000 1.960 1.913 2.147 . 0 0 "[ . 1 . 2 . 3]" 1
1136 1 87 LEU HB2 1 87 LEU MD2 2.600 . 3.000 3.041 3.024 3.064 0.064 20 0 "[ . 1 . 2 . 3]" 1
1137 1 87 LEU HB2 1 88 LEU H 4.000 . 5.000 4.510 4.451 4.563 . 0 0 "[ . 1 . 2 . 3]" 1
1138 1 87 LEU HB3 1 88 LEU H 4.000 . 5.000 3.686 3.561 3.811 . 0 0 "[ . 1 . 2 . 3]" 1
1139 1 87 LEU MD2 1 88 LEU H 4.000 . 5.000 3.226 2.941 3.429 . 0 0 "[ . 1 . 2 . 3]" 1
1140 1 87 LEU MD2 1 89 LEU HA 3.200 . 4.000 4.056 4.041 4.078 0.078 24 0 "[ . 1 . 2 . 3]" 1
1141 1 88 LEU H 1 88 LEU HB2 3.200 . 4.000 2.409 2.252 2.784 . 0 0 "[ . 1 . 2 . 3]" 1
1142 1 88 LEU H 1 88 LEU HB3 3.200 . 4.000 3.586 3.519 3.724 . 0 0 "[ . 1 . 2 . 3]" 1
1143 1 88 LEU H 1 88 LEU MD1 4.000 . 5.000 2.652 2.519 2.820 . 0 0 "[ . 1 . 2 . 3]" 1
1144 1 88 LEU H 1 88 LEU MD2 3.200 . 4.000 3.297 1.846 3.889 . 0 0 "[ . 1 . 2 . 3]" 1
1145 1 88 LEU H 1 88 LEU HG 4.000 . 5.000 4.251 3.899 4.423 . 0 0 "[ . 1 . 2 . 3]" 1
1146 1 88 LEU H 1 89 LEU MD2 4.000 . 5.000 3.275 3.108 3.612 . 0 0 "[ . 1 . 2 . 3]" 1
1147 1 88 LEU HA 1 88 LEU MD1 3.200 . 4.000 2.041 1.949 2.069 . 0 0 "[ . 1 . 2 . 3]" 1
1148 1 88 LEU HA 1 88 LEU MD2 3.200 . 4.000 3.748 3.490 3.838 . 0 0 "[ . 1 . 2 . 3]" 1
1149 1 88 LEU HA 1 88 LEU HG 4.000 . 5.000 2.973 2.669 3.773 . 0 0 "[ . 1 . 2 . 3]" 1
1150 1 88 LEU HA 1 89 LEU H 2.600 . 3.000 2.176 2.165 2.189 . 0 0 "[ . 1 . 2 . 3]" 1
1151 1 88 LEU HA 1 89 LEU MD1 4.000 . 5.000 5.003 4.882 5.025 0.025 25 0 "[ . 1 . 2 . 3]" 1
1152 1 88 LEU HB2 1 88 LEU MD1 3.200 . 4.000 2.749 2.586 3.174 . 0 0 "[ . 1 . 2 . 3]" 1
1153 1 88 LEU HB2 1 88 LEU MD2 3.200 . 4.000 2.181 2.073 2.294 . 0 0 "[ . 1 . 2 . 3]" 1
1154 1 88 LEU HB2 1 89 LEU H 4.000 . 5.000 4.477 4.264 4.562 . 0 0 "[ . 1 . 2 . 3]" 1
1155 1 88 LEU HB3 1 89 LEU H 4.000 . 5.000 3.857 3.812 3.897 . 0 0 "[ . 1 . 2 . 3]" 1
1156 1 89 LEU H 1 89 LEU QB 3.200 . 4.000 2.932 2.866 2.967 . 0 0 "[ . 1 . 2 . 3]" 1
1157 1 89 LEU H 1 89 LEU MD1 3.200 . 4.000 3.552 3.450 3.591 . 0 0 "[ . 1 . 2 . 3]" 1
1158 1 89 LEU H 1 89 LEU MD2 4.000 . 5.000 2.727 2.536 3.023 . 0 0 "[ . 1 . 2 . 3]" 1
1159 1 89 LEU H 1 89 LEU HG 4.000 . 5.000 1.864 1.823 1.937 . 0 0 "[ . 1 . 2 . 3]" 1
1160 1 89 LEU HA 1 89 LEU MD1 3.200 . 4.000 4.038 4.015 4.054 0.054 26 0 "[ . 1 . 2 . 3]" 1
1161 1 89 LEU HA 1 89 LEU MD2 3.200 . 4.000 2.700 2.554 2.813 . 0 0 "[ . 1 . 2 . 3]" 1
1162 1 89 LEU HA 1 89 LEU HG 3.200 . 4.000 3.494 3.418 3.562 . 0 0 "[ . 1 . 2 . 3]" 1
1163 1 89 LEU HA 1 90 GLU H 3.200 . 4.000 2.763 2.721 2.817 . 0 0 "[ . 1 . 2 . 3]" 1
1164 1 89 LEU QB 1 90 GLU H 3.200 . 4.000 1.907 1.865 1.965 . 0 0 "[ . 1 . 2 . 3]" 1
1165 1 89 LEU MD1 1 90 GLU H 4.000 . 5.000 3.680 3.611 3.751 . 0 0 "[ . 1 . 2 . 3]" 1
1166 1 89 LEU MD2 1 90 GLU H 3.200 . 4.000 4.085 4.043 4.106 0.106 7 0 "[ . 1 . 2 . 3]" 1
1167 1 89 LEU HG 1 90 GLU H 4.000 . 5.000 4.347 4.300 4.419 . 0 0 "[ . 1 . 2 . 3]" 1
1168 1 90 GLU H 1 90 GLU HB2 3.200 . 4.000 3.651 3.556 3.760 . 0 0 "[ . 1 . 2 . 3]" 1
1169 1 90 GLU H 1 90 GLU HB3 4.000 . 5.000 2.672 2.630 2.741 . 0 0 "[ . 1 . 2 . 3]" 1
1170 1 90 GLU H 1 90 GLU QG 3.200 . 4.000 3.694 3.512 3.907 . 0 0 "[ . 1 . 2 . 3]" 1
1171 1 90 GLU H 1 91 LYS H 4.000 . 5.000 4.288 4.119 4.375 . 0 0 "[ . 1 . 2 . 3]" 1
1172 1 90 GLU HA 1 90 GLU QG 3.200 . 4.000 2.840 2.686 2.966 . 0 0 "[ . 1 . 2 . 3]" 1
1173 1 90 GLU HA 1 91 LYS H 3.200 . 4.000 2.208 2.156 2.268 . 0 0 "[ . 1 . 2 . 3]" 1
1174 1 91 LYS H 1 91 LYS QB 3.200 . 4.000 2.157 2.044 2.248 . 0 0 "[ . 1 . 2 . 3]" 1
1175 1 91 LYS H 1 91 LYS QD 4.000 . 5.000 3.910 3.514 4.269 . 0 0 "[ . 1 . 2 . 3]" 1
1176 1 91 LYS H 1 91 LYS QG 4.000 . 5.000 3.957 3.326 4.061 . 0 0 "[ . 1 . 2 . 3]" 1
1177 1 91 LYS H 1 92 GLY H 4.000 . 5.000 4.319 4.207 4.430 . 0 0 "[ . 1 . 2 . 3]" 1
1178 1 91 LYS HA 1 91 LYS QD 4.000 . 5.000 2.195 1.894 2.826 . 0 0 "[ . 1 . 2 . 3]" 1
1179 1 91 LYS HA 1 91 LYS QE 4.000 . 5.000 3.111 1.987 3.892 . 0 0 "[ . 1 . 2 . 3]" 1
1180 1 91 LYS QB 1 91 LYS QE 3.200 . 4.000 3.112 1.949 3.868 . 0 0 "[ . 1 . 2 . 3]" 1
1181 1 91 LYS QB 1 92 GLY H 4.000 . 5.000 3.912 3.821 3.954 . 0 0 "[ . 1 . 2 . 3]" 1
1182 1 91 LYS QD 1 92 GLY H 4.000 . 5.000 3.686 2.802 4.544 . 0 0 "[ . 1 . 2 . 3]" 1
1183 1 91 LYS QE 1 91 LYS QG 3.200 . 4.000 2.230 1.939 2.819 . 0 0 "[ . 1 . 2 . 3]" 1
1184 1 91 LYS QE 1 92 GLY H 4.000 . 5.000 4.109 2.223 5.008 0.008 27 0 "[ . 1 . 2 . 3]" 1
1185 1 91 LYS HG2 1 92 GLY H 4.000 . 5.000 4.952 4.606 5.031 0.031 4 0 "[ . 1 . 2 . 3]" 1
1186 1 92 GLY H 1 93 GLN H 4.000 . 5.000 4.400 3.610 4.637 . 0 0 "[ . 1 . 2 . 3]" 1
1187 1 92 GLY QA 1 93 GLN H 3.200 . 4.000 2.225 2.114 2.578 . 0 0 "[ . 1 . 2 . 3]" 1
1188 1 92 GLY QA 1 93 GLN HA 4.000 . 5.000 3.993 3.930 4.115 . 0 0 "[ . 1 . 2 . 3]" 1
1189 1 93 GLN H 1 93 GLN QB 2.600 . 3.000 2.385 2.083 2.781 . 0 0 "[ . 1 . 2 . 3]" 1
1190 1 93 GLN H 1 93 GLN QG 3.200 . 4.000 2.948 1.978 4.002 0.002 30 0 "[ . 1 . 2 . 3]" 1
1191 1 93 GLN HA 1 93 GLN QG 3.200 . 4.000 2.558 2.004 3.342 . 0 0 "[ . 1 . 2 . 3]" 1
1192 1 93 GLN HA 1 94 SER H 2.600 . 3.000 2.224 2.137 2.778 . 0 0 "[ . 1 . 2 . 3]" 1
1193 1 93 GLN HA 1 94 SER HA 4.000 . 5.000 4.392 4.322 4.589 . 0 0 "[ . 1 . 2 . 3]" 1
1194 1 93 GLN QG 1 94 SER H 4.000 . 5.000 3.784 2.101 4.751 . 0 0 "[ . 1 . 2 . 3]" 1
1195 1 94 SER H 1 94 SER QB 3.200 . 4.000 2.375 2.129 2.941 . 0 0 "[ . 1 . 2 . 3]" 1
1196 1 94 SER HA 1 95 PRO QG 3.200 . 4.000 3.891 3.824 4.004 0.004 20 0 "[ . 1 . 2 . 3]" 1
1197 1 95 PRO HA 1 95 PRO QG 2.600 . 3.000 2.886 2.866 2.943 . 0 0 "[ . 1 . 2 . 3]" 1
1198 1 95 PRO HA 1 96 THR H 3.200 . 4.000 3.208 2.152 3.574 . 0 0 "[ . 1 . 2 . 3]" 1
1199 1 95 PRO QB 1 96 THR MG 4.000 . 5.000 3.793 2.718 4.814 . 0 0 "[ . 1 . 2 . 3]" 1
1200 1 96 THR H 1 96 THR HB 3.200 . 4.000 3.206 2.551 3.683 . 0 0 "[ . 1 . 2 . 3]" 1
1201 1 96 THR H 1 96 THR MG 3.200 . 4.000 2.848 1.932 3.823 . 0 0 "[ . 1 . 2 . 3]" 1
1202 1 96 THR HA 1 96 THR MG 3.200 . 4.000 2.507 2.103 3.221 . 0 0 "[ . 1 . 2 . 3]" 1
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