NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
485085 |
2jy9   |
15584 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2jy9
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 1366
_Distance_constraint_stats_list.Viol_count 1333
_Distance_constraint_stats_list.Viol_total 1794.175
_Distance_constraint_stats_list.Viol_max 0.427
_Distance_constraint_stats_list.Viol_rms 0.0199
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0033
_Distance_constraint_stats_list.Viol_average_violations_only 0.0673
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 0.547 0.054 13 0 "[ . 1 . 2]"
1 2 ILE 0.308 0.091 6 0 "[ . 1 . 2]"
1 3 ALA 0.068 0.068 7 0 "[ . 1 . 2]"
1 4 ILE 0.479 0.081 1 0 "[ . 1 . 2]"
1 5 SER 0.210 0.081 1 0 "[ . 1 . 2]"
1 6 ARG 0.633 0.329 1 0 "[ . 1 . 2]"
1 7 THR 0.633 0.329 1 0 "[ . 1 . 2]"
1 8 VAL 0.075 0.071 18 0 "[ . 1 . 2]"
1 9 SER 1.509 0.116 10 0 "[ . 1 . 2]"
1 10 ILE 1.397 0.116 10 0 "[ . 1 . 2]"
1 11 ALA 0.233 0.058 1 0 "[ . 1 . 2]"
1 12 ASP 1.257 0.154 12 0 "[ . 1 . 2]"
1 13 ASN 0.830 0.129 16 0 "[ . 1 . 2]"
1 14 GLU 4.240 0.274 20 0 "[ . 1 . 2]"
1 15 LEU 0.579 0.094 9 0 "[ . 1 . 2]"
1 16 GLU 2.721 0.129 4 0 "[ . 1 . 2]"
1 17 ILE 1.392 0.129 4 0 "[ . 1 . 2]"
1 18 THR 1.883 0.152 20 0 "[ . 1 . 2]"
1 19 ALA 0.775 0.126 7 0 "[ . 1 . 2]"
1 20 ILE 1.490 0.221 15 0 "[ . 1 . 2]"
1 21 ARG 1.765 0.221 15 0 "[ . 1 . 2]"
1 22 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 GLN 0.051 0.045 3 0 "[ . 1 . 2]"
1 24 GLY 0.051 0.045 3 0 "[ . 1 . 2]"
1 26 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 GLN 1.422 0.228 4 0 "[ . 1 . 2]"
1 29 HIS 3.676 0.262 7 0 "[ . 1 . 2]"
1 30 VAL 4.321 0.262 7 0 "[ . 1 . 2]"
1 31 ASN 1.924 0.178 20 0 "[ . 1 . 2]"
1 32 LYS 0.153 0.072 14 0 "[ . 1 . 2]"
1 33 THR 0.463 0.079 12 0 "[ . 1 . 2]"
1 34 SER 0.490 0.079 15 0 "[ . 1 . 2]"
1 35 SER 0.492 0.093 15 0 "[ . 1 . 2]"
1 36 ALA 2.929 0.263 7 0 "[ . 1 . 2]"
1 37 ILE 3.445 0.263 7 0 "[ . 1 . 2]"
1 38 HIS 1.519 0.104 5 0 "[ . 1 . 2]"
1 39 LEU 1.507 0.100 16 0 "[ . 1 . 2]"
1 40 ARG 1.635 0.131 5 0 "[ . 1 . 2]"
1 41 PHE 0.181 0.091 8 0 "[ . 1 . 2]"
1 42 ASP 0.684 0.130 5 0 "[ . 1 . 2]"
1 43 ILE 0.766 0.115 10 0 "[ . 1 . 2]"
1 44 ARG 0.659 0.115 10 0 "[ . 1 . 2]"
1 45 ALA 0.054 0.054 5 0 "[ . 1 . 2]"
1 46 SER 3.343 0.330 18 0 "[ . 1 . 2]"
1 47 GLY 2.064 0.240 15 0 "[ . 1 . 2]"
1 48 LEU 0.112 0.095 14 0 "[ . 1 . 2]"
1 49 PRO 0.197 0.079 15 0 "[ . 1 . 2]"
1 50 GLU 0.283 0.084 7 0 "[ . 1 . 2]"
1 51 TYR 1.786 0.128 9 0 "[ . 1 . 2]"
1 52 TYR 2.746 0.138 2 0 "[ . 1 . 2]"
1 53 LYS 0.415 0.097 1 0 "[ . 1 . 2]"
1 54 GLN 0.924 0.298 6 0 "[ . 1 . 2]"
1 55 ARG 3.098 0.228 17 0 "[ . 1 . 2]"
1 56 LEU 0.323 0.071 4 0 "[ . 1 . 2]"
1 57 LEU 0.120 0.036 2 0 "[ . 1 . 2]"
1 58 THR 1.885 0.172 18 0 "[ . 1 . 2]"
1 59 ALA 0.903 0.131 9 0 "[ . 1 . 2]"
1 60 SER 0.168 0.128 7 0 "[ . 1 . 2]"
1 61 HIS 1.614 0.131 9 0 "[ . 1 . 2]"
1 62 HIS 1.856 0.206 5 0 "[ . 1 . 2]"
1 63 LEU 2.423 0.427 5 0 "[ . 1 . 2]"
1 64 ILE 1.909 0.126 12 0 "[ . 1 . 2]"
1 65 SER 2.452 0.139 9 0 "[ . 1 . 2]"
1 66 ASP 0.106 0.049 4 0 "[ . 1 . 2]"
1 67 ASP 1.293 0.153 15 0 "[ . 1 . 2]"
1 68 GLY 1.209 0.153 15 0 "[ . 1 . 2]"
1 69 VAL 2.288 0.155 15 0 "[ . 1 . 2]"
1 70 ILE 0.173 0.042 16 0 "[ . 1 . 2]"
1 71 ILE 1.527 0.162 5 0 "[ . 1 . 2]"
1 72 ILE 1.358 0.162 5 0 "[ . 1 . 2]"
1 73 LYS 3.396 0.368 8 0 "[ . 1 . 2]"
1 74 ALA 3.561 0.368 8 0 "[ . 1 . 2]"
1 75 GLN 2.016 0.193 7 0 "[ . 1 . 2]"
1 76 GLU 2.950 0.289 12 0 "[ . 1 . 2]"
1 77 PHE 1.232 0.133 15 0 "[ . 1 . 2]"
1 79 SER 0.346 0.101 2 0 "[ . 1 . 2]"
1 80 GLN 1.252 0.165 4 0 "[ . 1 . 2]"
1 81 GLU 2.874 0.352 12 0 "[ . 1 . 2]"
1 82 LEU 5.775 0.375 6 0 "[ . 1 . 2]"
1 83 ASN 5.612 0.217 9 0 "[ . 1 . 2]"
1 84 ARG 2.248 0.162 14 0 "[ . 1 . 2]"
1 85 GLU 5.007 0.187 19 0 "[ . 1 . 2]"
1 86 ALA 1.681 0.106 17 0 "[ . 1 . 2]"
1 87 ALA 0.032 0.025 14 0 "[ . 1 . 2]"
1 88 ILE 0.655 0.042 6 0 "[ . 1 . 2]"
1 89 ALA 0.754 0.059 10 0 "[ . 1 . 2]"
1 90 ARG 1.579 0.106 17 0 "[ . 1 . 2]"
1 91 LEU 1.496 0.085 13 0 "[ . 1 . 2]"
1 92 VAL 0.927 0.085 13 0 "[ . 1 . 2]"
1 93 ALA 0.752 0.151 8 0 "[ . 1 . 2]"
1 94 VAL 1.149 0.274 10 0 "[ . 1 . 2]"
1 95 ILE 1.037 0.096 4 0 "[ . 1 . 2]"
1 96 LYS 1.481 0.250 18 0 "[ . 1 . 2]"
1 97 GLU 0.921 0.274 10 0 "[ . 1 . 2]"
1 98 LEU 1.283 0.109 8 0 "[ . 1 . 2]"
1 99 THR 0.315 0.095 9 0 "[ . 1 . 2]"
1 100 ALA 0.572 0.092 4 0 "[ . 1 . 2]"
1 101 GLU 3.056 0.264 8 0 "[ . 1 . 2]"
1 102 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 SER 0.242 0.085 11 0 "[ . 1 . 2]"
1 106 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 THR 0.535 0.156 11 0 "[ . 1 . 2]"
1 109 ARG 0.535 0.156 11 0 "[ . 1 . 2]"
1 110 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 ARG 0.356 0.356 18 0 "[ . 1 . 2]"
1 119 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 120 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 122 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 123 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 124 GLN 0.088 0.082 12 0 "[ . 1 . 2]"
1 128 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 129 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 130 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 131 LEU 0.101 0.082 15 0 "[ . 1 . 2]"
1 132 ARG 0.011 0.011 7 0 "[ . 1 . 2]"
1 133 GLY 0.011 0.011 7 0 "[ . 1 . 2]"
1 134 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 135 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 136 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 137 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 138 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 139 LEU 0.207 0.079 15 0 "[ . 1 . 2]"
1 140 ASP 0.105 0.079 15 0 "[ . 1 . 2]"
1 141 LEU 0.002 0.002 13 0 "[ . 1 . 2]"
1 142 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 MET HA 1 2 ILE H . . 3.160 2.279 2.141 2.512 . 0 0 "[ . 1 . 2]" 1
2 1 1 MET HA 1 11 ALA HA . . 3.980 3.567 2.621 4.031 0.051 17 0 "[ . 1 . 2]" 1
3 1 1 MET HA 1 12 ASP H . . 3.950 3.120 2.033 3.985 0.035 11 0 "[ . 1 . 2]" 1
4 1 1 MET QB 1 2 ILE H . . 4.090 3.380 2.325 3.855 . 0 0 "[ . 1 . 2]" 1
5 1 1 MET QB 1 9 SER QB . . 6.400 4.741 3.335 5.781 . 0 0 "[ . 1 . 2]" 1
6 1 1 MET QB 1 11 ALA HA . . 5.780 4.049 2.178 4.820 . 0 0 "[ . 1 . 2]" 1
7 1 1 MET QB 1 12 ASP H . . 5.940 4.079 2.628 5.016 . 0 0 "[ . 1 . 2]" 1
8 1 1 MET HB2 1 2 ILE H . . 4.310 3.827 2.346 4.335 0.025 1 0 "[ . 1 . 2]" 1
9 1 1 MET HB2 1 9 SER HB2 . . 7.720 6.840 4.707 7.770 0.050 18 0 "[ . 1 . 2]" 1
10 1 1 MET HB2 1 9 SER HB3 . . 7.720 5.760 3.500 7.050 . 0 0 "[ . 1 . 2]" 1
11 1 1 MET HB2 1 11 ALA HA . . 6.000 4.250 2.297 5.091 . 0 0 "[ . 1 . 2]" 1
12 1 1 MET HB3 1 2 ILE H . . 4.310 3.938 3.521 4.319 0.009 1 0 "[ . 1 . 2]" 1
13 1 1 MET HB3 1 9 SER HB2 . . 7.720 6.863 4.770 7.751 0.031 1 0 "[ . 1 . 2]" 1
14 1 1 MET HB3 1 9 SER HB3 . . 7.720 5.607 4.011 6.977 . 0 0 "[ . 1 . 2]" 1
15 1 1 MET HB3 1 11 ALA HA . . 6.000 5.139 2.701 6.054 0.054 13 0 "[ . 1 . 2]" 1
16 1 1 MET ME 1 2 ILE H . . 7.020 4.110 3.157 5.524 . 0 0 "[ . 1 . 2]" 1
17 1 1 MET ME 1 9 SER HB2 . . 5.720 2.823 2.182 4.846 . 0 0 "[ . 1 . 2]" 1
18 1 1 MET ME 1 9 SER QB . . 5.580 2.213 1.766 3.867 . 0 0 "[ . 1 . 2]" 1
19 1 1 MET ME 1 9 SER HB3 . . 5.720 2.346 1.800 4.064 . 0 0 "[ . 1 . 2]" 1
20 1 1 MET ME 1 11 ALA HA . . 6.550 3.545 2.305 5.956 . 0 0 "[ . 1 . 2]" 1
21 1 1 MET QG 1 2 ILE H . . 5.740 2.724 1.909 3.649 . 0 0 "[ . 1 . 2]" 1
22 1 1 MET QG 1 9 SER QB . . 5.190 3.328 1.991 4.171 . 0 0 "[ . 1 . 2]" 1
23 1 1 MET QG 1 10 ILE H . . 6.880 4.003 2.915 5.417 . 0 0 "[ . 1 . 2]" 1
24 1 1 MET QG 1 11 ALA HA . . 6.200 3.562 2.113 5.239 . 0 0 "[ . 1 . 2]" 1
25 1 1 MET HG2 1 2 ILE H . . 6.000 3.525 1.956 4.749 . 0 0 "[ . 1 . 2]" 1
26 1 1 MET HG2 1 9 SER HB2 . . 6.540 5.330 3.104 6.586 0.046 7 0 "[ . 1 . 2]" 1
27 1 1 MET HG2 1 9 SER HB3 . . 6.540 4.107 2.034 5.830 . 0 0 "[ . 1 . 2]" 1
28 1 1 MET HG2 1 12 ASP H . . 6.000 5.437 4.209 5.915 . 0 0 "[ . 1 . 2]" 1
29 1 1 MET HG3 1 2 ILE H . . 6.000 2.989 2.463 3.797 . 0 0 "[ . 1 . 2]" 1
30 1 1 MET HG3 1 9 SER HB2 . . 6.540 5.200 4.095 5.897 . 0 0 "[ . 1 . 2]" 1
31 1 1 MET HG3 1 9 SER HB3 . . 6.540 4.026 3.464 4.749 . 0 0 "[ . 1 . 2]" 1
32 1 1 MET HG3 1 12 ASP H . . 6.000 4.690 2.586 6.016 0.016 1 0 "[ . 1 . 2]" 1
33 1 2 ILE H 1 2 ILE HB . . 3.340 2.543 2.444 2.623 . 0 0 "[ . 1 . 2]" 1
34 1 2 ILE H 1 2 ILE MD . . 4.250 2.651 1.781 3.612 . 0 0 "[ . 1 . 2]" 1
35 1 2 ILE H 1 2 ILE QG . . 4.970 3.016 2.086 3.658 . 0 0 "[ . 1 . 2]" 1
36 1 2 ILE H 1 3 ALA H . . 4.850 4.342 4.098 4.488 . 0 0 "[ . 1 . 2]" 1
37 1 2 ILE H 1 10 ILE H . . 3.660 3.495 2.971 3.725 0.065 5 0 "[ . 1 . 2]" 1
38 1 2 ILE H 1 11 ALA HA . . 5.390 3.760 3.129 4.218 . 0 0 "[ . 1 . 2]" 1
39 1 2 ILE HA 1 2 ILE MD . . 4.610 2.768 1.952 3.867 . 0 0 "[ . 1 . 2]" 1
40 1 2 ILE HA 1 3 ALA H . . 2.510 2.152 2.118 2.215 . 0 0 "[ . 1 . 2]" 1
41 1 2 ILE HA 1 88 ILE MG . . 7.020 3.468 2.622 4.681 . 0 0 "[ . 1 . 2]" 1
42 1 2 ILE HB 1 3 ALA H . . 4.700 4.295 4.148 4.443 . 0 0 "[ . 1 . 2]" 1
43 1 2 ILE HB 1 4 ILE MD . . 6.980 3.887 2.951 4.445 . 0 0 "[ . 1 . 2]" 1
44 1 2 ILE HB 1 10 ILE H . . 4.130 2.972 2.526 3.763 . 0 0 "[ . 1 . 2]" 1
45 1 2 ILE HB 1 10 ILE HB . . 3.440 2.072 1.754 3.015 . 0 0 "[ . 1 . 2]" 1
46 1 2 ILE HB 1 10 ILE MD . . 6.800 3.602 2.816 4.821 . 0 0 "[ . 1 . 2]" 1
47 1 2 ILE HB 1 10 ILE MG . . 5.790 3.236 2.156 3.955 . 0 0 "[ . 1 . 2]" 1
48 1 2 ILE MD 1 3 ALA H . . 6.440 4.483 3.498 5.251 . 0 0 "[ . 1 . 2]" 1
49 1 2 ILE MD 1 10 ILE H . . 5.650 4.781 4.137 5.496 . 0 0 "[ . 1 . 2]" 1
50 1 2 ILE MD 1 10 ILE HB . . 4.540 3.725 2.559 4.631 0.091 6 0 "[ . 1 . 2]" 1
51 1 2 ILE MD 1 10 ILE MD . . 6.460 4.634 3.583 5.462 . 0 0 "[ . 1 . 2]" 1
52 1 2 ILE MD 1 12 ASP HA . . 4.970 2.924 1.937 4.805 . 0 0 "[ . 1 . 2]" 1
53 1 2 ILE QG 1 3 ALA H . . 5.450 4.379 3.883 4.869 . 0 0 "[ . 1 . 2]" 1
54 1 2 ILE QG 1 10 ILE HB . . 6.880 3.591 2.547 4.919 . 0 0 "[ . 1 . 2]" 1
55 1 2 ILE HG12 1 3 ALA H . . 6.000 5.233 4.567 5.653 . 0 0 "[ . 1 . 2]" 1
56 1 2 ILE HG13 1 3 ALA H . . 6.000 4.823 4.037 5.813 . 0 0 "[ . 1 . 2]" 1
57 1 2 ILE MG 1 3 ALA H . . 4.140 2.904 2.530 3.397 . 0 0 "[ . 1 . 2]" 1
58 1 2 ILE MG 1 4 ILE H . . 7.020 3.880 3.462 4.333 . 0 0 "[ . 1 . 2]" 1
59 1 2 ILE MG 1 4 ILE HA . . 6.150 4.062 3.328 4.565 . 0 0 "[ . 1 . 2]" 1
60 1 2 ILE MG 1 10 ILE H . . 5.000 3.520 3.041 4.019 . 0 0 "[ . 1 . 2]" 1
61 1 2 ILE MG 1 10 ILE HB . . 5.360 2.950 2.456 3.847 . 0 0 "[ . 1 . 2]" 1
62 1 2 ILE MG 1 10 ILE MD . . 6.920 2.935 2.191 4.672 . 0 0 "[ . 1 . 2]" 1
63 1 2 ILE MG 1 92 VAL MG2 . . 5.300 2.977 1.783 3.762 . 0 0 "[ . 1 . 2]" 1
64 1 3 ALA H 1 3 ALA MB . . 3.420 2.351 2.260 2.454 . 0 0 "[ . 1 . 2]" 1
65 1 3 ALA HA 1 4 ILE H . . 3.190 2.136 2.091 2.188 . 0 0 "[ . 1 . 2]" 1
66 1 3 ALA HA 1 9 SER HA . . 3.730 2.897 1.900 3.798 0.068 7 0 "[ . 1 . 2]" 1
67 1 3 ALA HA 1 9 SER HB2 . . 5.280 4.618 3.654 5.207 . 0 0 "[ . 1 . 2]" 1
68 1 3 ALA HA 1 9 SER QB . . 4.820 3.111 2.203 3.613 . 0 0 "[ . 1 . 2]" 1
69 1 3 ALA HA 1 9 SER HB3 . . 5.280 3.165 2.222 3.685 . 0 0 "[ . 1 . 2]" 1
70 1 3 ALA HA 1 10 ILE H . . 4.810 3.680 2.875 4.148 . 0 0 "[ . 1 . 2]" 1
71 1 3 ALA MB 1 9 SER HA . . 5.690 4.389 3.320 5.185 . 0 0 "[ . 1 . 2]" 1
72 1 4 ILE H 1 4 ILE HB . . 3.480 2.628 2.562 2.705 . 0 0 "[ . 1 . 2]" 1
73 1 4 ILE H 1 4 ILE HG12 . . 5.320 2.355 2.034 2.579 . 0 0 "[ . 1 . 2]" 1
74 1 4 ILE H 1 4 ILE QG . . 5.050 2.333 2.023 2.548 . 0 0 "[ . 1 . 2]" 1
75 1 4 ILE H 1 4 ILE HG13 . . 5.320 3.802 3.570 3.972 . 0 0 "[ . 1 . 2]" 1
76 1 4 ILE H 1 9 SER HA . . 3.800 2.546 2.050 2.881 . 0 0 "[ . 1 . 2]" 1
77 1 4 ILE HA 1 4 ILE MD . . 3.820 2.135 2.045 2.195 . 0 0 "[ . 1 . 2]" 1
78 1 4 ILE HA 1 92 VAL MG1 . . 4.720 3.714 2.794 4.467 . 0 0 "[ . 1 . 2]" 1
79 1 4 ILE HA 1 95 ILE MD . . 7.020 3.776 2.977 4.224 . 0 0 "[ . 1 . 2]" 1
80 1 4 ILE HB 1 5 SER H . . 3.550 3.513 3.386 3.631 0.081 1 0 "[ . 1 . 2]" 1
81 1 4 ILE HB 1 95 ILE MD . . 5.040 4.786 4.413 5.118 0.078 2 0 "[ . 1 . 2]" 1
82 1 4 ILE MD 1 5 SER H . . 4.790 3.786 3.653 3.920 . 0 0 "[ . 1 . 2]" 1
83 1 4 ILE MD 1 9 SER HA . . 6.950 4.426 3.830 5.025 . 0 0 "[ . 1 . 2]" 1
84 1 4 ILE MD 1 10 ILE MD . . 5.920 2.680 2.141 3.313 . 0 0 "[ . 1 . 2]" 1
85 1 4 ILE MD 1 52 TYR QE . . 8.790 5.844 3.922 8.293 . 0 0 "[ . 1 . 2]" 1
86 1 4 ILE MD 1 56 LEU QD . . 8.830 5.337 4.521 6.319 . 0 0 "[ . 1 . 2]" 1
87 1 4 ILE MD 1 92 VAL HA . . 4.280 3.858 2.986 4.318 0.038 1 0 "[ . 1 . 2]" 1
88 1 4 ILE MD 1 92 VAL HB . . 7.020 5.480 4.486 6.369 . 0 0 "[ . 1 . 2]" 1
89 1 4 ILE MD 1 95 ILE HB . . 5.540 4.357 3.568 5.072 . 0 0 "[ . 1 . 2]" 1
90 1 4 ILE MD 1 95 ILE MD . . 5.380 2.023 1.811 2.228 . 0 0 "[ . 1 . 2]" 1
91 1 4 ILE QG 1 10 ILE H . . 5.700 3.441 2.011 4.071 . 0 0 "[ . 1 . 2]" 1
92 1 4 ILE QG 1 95 ILE MD . . 6.100 3.615 3.252 3.869 . 0 0 "[ . 1 . 2]" 1
93 1 4 ILE HG12 1 5 SER H . . 6.000 4.966 4.922 5.025 . 0 0 "[ . 1 . 2]" 1
94 1 4 ILE HG12 1 10 ILE H . . 6.000 3.536 2.040 4.202 . 0 0 "[ . 1 . 2]" 1
95 1 4 ILE HG12 1 10 ILE MD . . 4.820 3.045 2.352 3.855 . 0 0 "[ . 1 . 2]" 1
96 1 4 ILE HG12 1 95 ILE MD . . 6.480 4.475 4.276 4.740 . 0 0 "[ . 1 . 2]" 1
97 1 4 ILE HG13 1 5 SER H . . 6.000 4.963 4.884 5.082 . 0 0 "[ . 1 . 2]" 1
98 1 4 ILE HG13 1 10 ILE H . . 6.000 4.732 3.046 5.453 . 0 0 "[ . 1 . 2]" 1
99 1 4 ILE HG13 1 10 ILE MD . . 4.820 2.559 1.770 3.415 . 0 0 "[ . 1 . 2]" 1
100 1 4 ILE HG13 1 95 ILE MD . . 6.480 3.834 3.371 4.265 . 0 0 "[ . 1 . 2]" 1
101 1 4 ILE MG 1 5 SER H . . 4.500 1.845 1.764 1.993 . 0 0 "[ . 1 . 2]" 1
102 1 4 ILE MG 1 5 SER QB . . 6.310 3.275 2.814 3.701 . 0 0 "[ . 1 . 2]" 1
103 1 4 ILE MG 1 52 TYR QD . . 7.130 4.161 3.472 5.669 . 0 0 "[ . 1 . 2]" 1
104 1 4 ILE MG 1 52 TYR QE . . 6.380 3.800 2.364 5.875 . 0 0 "[ . 1 . 2]" 1
105 1 4 ILE MG 1 95 ILE MD . . 5.230 2.395 1.853 2.903 . 0 0 "[ . 1 . 2]" 1
106 1 5 SER H 1 5 SER QB . . 3.650 2.500 2.205 2.755 . 0 0 "[ . 1 . 2]" 1
107 1 5 SER H 1 95 ILE MD . . 4.820 4.255 3.167 4.779 . 0 0 "[ . 1 . 2]" 1
108 1 6 ARG QB 1 7 THR MG . . 5.160 3.389 2.570 4.694 . 0 0 "[ . 1 . 2]" 1
109 1 6 ARG HB2 1 7 THR MG . . 5.760 4.565 3.221 6.089 0.329 1 0 "[ . 1 . 2]" 1
110 1 6 ARG HB3 1 7 THR MG . . 5.760 3.508 2.681 4.882 . 0 0 "[ . 1 . 2]" 1
111 1 6 ARG QG 1 7 THR MG . . 5.750 3.773 1.780 5.166 . 0 0 "[ . 1 . 2]" 1
112 1 6 ARG HG2 1 7 THR MG . . 5.940 4.273 1.787 5.780 . 0 0 "[ . 1 . 2]" 1
113 1 6 ARG HG3 1 7 THR MG . . 5.940 4.549 2.275 6.160 0.220 20 0 "[ . 1 . 2]" 1
114 1 7 THR H 1 7 THR MG . . 4.570 2.661 1.876 4.107 . 0 0 "[ . 1 . 2]" 1
115 1 7 THR H 1 8 VAL H . . 3.480 2.584 1.755 3.376 . 0 0 "[ . 1 . 2]" 1
116 1 7 THR HB 1 8 VAL H . . 4.740 4.378 3.010 4.672 . 0 0 "[ . 1 . 2]" 1
117 1 7 THR MG 1 8 VAL H . . 6.690 3.600 2.784 4.359 . 0 0 "[ . 1 . 2]" 1
118 1 7 THR MG 1 8 VAL QG . . 9.590 3.329 2.390 5.032 . 0 0 "[ . 1 . 2]" 1
119 1 8 VAL H 1 8 VAL HB . . 3.050 2.684 2.538 3.121 0.071 18 0 "[ . 1 . 2]" 1
120 1 8 VAL H 1 8 VAL MG1 . . 4.640 3.301 1.958 3.910 . 0 0 "[ . 1 . 2]" 1
121 1 8 VAL H 1 8 VAL QG . . 3.950 2.295 1.952 2.629 . 0 0 "[ . 1 . 2]" 1
122 1 8 VAL H 1 8 VAL MG2 . . 4.640 2.855 2.189 3.893 . 0 0 "[ . 1 . 2]" 1
123 1 8 VAL H 1 9 SER H . . 5.750 4.422 4.230 4.612 . 0 0 "[ . 1 . 2]" 1
124 1 8 VAL HA 1 9 SER H . . 2.720 2.186 2.133 2.284 . 0 0 "[ . 1 . 2]" 1
125 1 8 VAL HB 1 9 SER H . . 4.850 4.148 3.863 4.371 . 0 0 "[ . 1 . 2]" 1
126 1 8 VAL HB 1 52 TYR QE . . 7.810 6.018 3.947 7.810 . 0 0 "[ . 1 . 2]" 1
127 1 8 VAL QG 1 9 SER H . . 4.220 2.626 2.087 3.072 . 0 0 "[ . 1 . 2]" 1
128 1 8 VAL QG 1 9 SER HA . . 6.740 3.447 3.071 3.992 . 0 0 "[ . 1 . 2]" 1
129 1 8 VAL QG 1 9 SER QB . . 8.440 4.318 3.898 4.569 . 0 0 "[ . 1 . 2]" 1
130 1 8 VAL QG 1 48 LEU HA . . 5.340 3.033 2.235 3.742 . 0 0 "[ . 1 . 2]" 1
131 1 8 VAL QG 1 48 LEU MD1 . . 8.440 4.574 3.909 5.379 . 0 0 "[ . 1 . 2]" 1
132 1 8 VAL QG 1 48 LEU MD2 . . 7.680 2.587 1.934 3.524 . 0 0 "[ . 1 . 2]" 1
133 1 8 VAL QG 1 49 PRO QD . . 6.110 2.308 1.753 2.837 . 0 0 "[ . 1 . 2]" 1
134 1 8 VAL QG 1 49 PRO QG . . 5.380 2.522 2.021 3.356 . 0 0 "[ . 1 . 2]" 1
135 1 8 VAL QG 1 52 TYR QD . . 10.700 4.498 3.502 5.460 . 0 0 "[ . 1 . 2]" 1
136 1 8 VAL QG 1 52 TYR QE . . 7.740 4.361 2.898 6.127 . 0 0 "[ . 1 . 2]" 1
137 1 8 VAL MG1 1 9 SER H . . 5.220 3.090 2.302 4.086 . 0 0 "[ . 1 . 2]" 1
138 1 8 VAL MG1 1 9 SER HA . . 7.020 3.650 3.282 4.122 . 0 0 "[ . 1 . 2]" 1
139 1 8 VAL MG1 1 48 LEU HA . . 5.650 3.352 2.523 4.527 . 0 0 "[ . 1 . 2]" 1
140 1 8 VAL MG1 1 49 PRO HD2 . . 8.110 3.731 2.880 4.953 . 0 0 "[ . 1 . 2]" 1
141 1 8 VAL MG1 1 49 PRO HD3 . . 8.110 2.890 1.830 3.726 . 0 0 "[ . 1 . 2]" 1
142 1 8 VAL MG1 1 49 PRO HG2 . . 6.520 4.120 2.599 5.568 . 0 0 "[ . 1 . 2]" 1
143 1 8 VAL MG1 1 49 PRO HG3 . . 6.520 3.970 2.635 5.317 . 0 0 "[ . 1 . 2]" 1
144 1 8 VAL MG1 1 52 TYR QE . . 8.040 5.416 3.134 6.948 . 0 0 "[ . 1 . 2]" 1
145 1 8 VAL MG2 1 9 SER H . . 5.220 3.630 2.103 4.240 . 0 0 "[ . 1 . 2]" 1
146 1 8 VAL MG2 1 9 SER HA . . 7.020 4.919 3.418 5.621 . 0 0 "[ . 1 . 2]" 1
147 1 8 VAL MG2 1 48 LEU HA . . 5.650 3.766 2.342 4.600 . 0 0 "[ . 1 . 2]" 1
148 1 8 VAL MG2 1 49 PRO HD2 . . 8.110 3.688 2.888 5.069 . 0 0 "[ . 1 . 2]" 1
149 1 8 VAL MG2 1 49 PRO HD3 . . 8.110 2.729 1.783 3.693 . 0 0 "[ . 1 . 2]" 1
150 1 8 VAL MG2 1 49 PRO HG2 . . 6.520 3.444 2.357 5.082 . 0 0 "[ . 1 . 2]" 1
151 1 8 VAL MG2 1 49 PRO HG3 . . 6.520 3.062 2.185 4.457 . 0 0 "[ . 1 . 2]" 1
152 1 8 VAL MG2 1 52 TYR QE . . 8.040 5.029 2.938 7.349 . 0 0 "[ . 1 . 2]" 1
153 1 9 SER H 1 10 ILE H . . 5.600 4.427 4.331 4.544 . 0 0 "[ . 1 . 2]" 1
154 1 9 SER HA 1 10 ILE H . . 2.830 2.300 2.225 2.431 . 0 0 "[ . 1 . 2]" 1
155 1 9 SER QB 1 10 ILE H . . 3.440 2.645 2.428 2.883 . 0 0 "[ . 1 . 2]" 1
156 1 9 SER HB2 1 10 ILE H . . 3.620 3.677 3.629 3.736 0.116 10 0 "[ . 1 . 2]" 1
157 1 9 SER HB3 1 10 ILE H . . 3.620 2.714 2.466 3.013 . 0 0 "[ . 1 . 2]" 1
158 1 10 ILE H 1 10 ILE HB . . 3.440 2.668 2.325 2.799 . 0 0 "[ . 1 . 2]" 1
159 1 10 ILE H 1 10 ILE MD . . 5.830 3.514 2.313 4.204 . 0 0 "[ . 1 . 2]" 1
160 1 10 ILE H 1 10 ILE HG12 . . 4.960 4.185 3.853 4.583 . 0 0 "[ . 1 . 2]" 1
161 1 10 ILE H 1 10 ILE QG . . 4.480 3.186 2.598 3.989 . 0 0 "[ . 1 . 2]" 1
162 1 10 ILE H 1 10 ILE HG13 . . 4.960 3.335 2.641 4.405 . 0 0 "[ . 1 . 2]" 1
163 1 10 ILE H 1 11 ALA H . . 5.030 4.384 4.237 4.499 . 0 0 "[ . 1 . 2]" 1
164 1 10 ILE HA 1 11 ALA H . . 2.650 2.219 2.147 2.355 . 0 0 "[ . 1 . 2]" 1
165 1 10 ILE HA 1 11 ALA MB . . 7.020 4.029 3.921 4.098 . 0 0 "[ . 1 . 2]" 1
166 1 10 ILE HB 1 11 ALA H . . 4.560 4.066 3.756 4.302 . 0 0 "[ . 1 . 2]" 1
167 1 10 ILE MD 1 15 LEU MD1 . . 7.000 5.216 3.281 6.987 . 0 0 "[ . 1 . 2]" 1
168 1 10 ILE MD 1 15 LEU MD2 . . 6.850 4.186 2.581 5.796 . 0 0 "[ . 1 . 2]" 1
169 1 10 ILE MD 1 41 PHE QD . . 8.930 4.339 3.175 5.554 . 0 0 "[ . 1 . 2]" 1
170 1 10 ILE MD 1 41 PHE QE . . 7.280 2.774 1.951 3.911 . 0 0 "[ . 1 . 2]" 1
171 1 10 ILE MD 1 48 LEU MD1 . . 7.970 3.987 2.699 5.062 . 0 0 "[ . 1 . 2]" 1
172 1 10 ILE MD 1 48 LEU MD2 . . 6.600 2.572 1.905 3.693 . 0 0 "[ . 1 . 2]" 1
173 1 10 ILE MD 1 56 LEU QD . . 9.590 5.771 5.011 6.941 . 0 0 "[ . 1 . 2]" 1
174 1 10 ILE MD 1 91 LEU QD . . 7.830 4.384 3.038 5.912 . 0 0 "[ . 1 . 2]" 1
175 1 10 ILE MD 1 95 ILE MD . . 5.590 4.349 3.419 5.094 . 0 0 "[ . 1 . 2]" 1
176 1 10 ILE QG 1 11 ALA H . . 5.400 4.016 3.271 4.277 . 0 0 "[ . 1 . 2]" 1
177 1 10 ILE QG 1 41 PHE QE . . 8.980 3.646 2.028 5.088 . 0 0 "[ . 1 . 2]" 1
178 1 10 ILE QG 1 48 LEU MD2 . . 5.380 3.590 2.525 4.785 . 0 0 "[ . 1 . 2]" 1
179 1 10 ILE HG12 1 11 ALA H . . 5.750 4.616 4.207 5.139 . 0 0 "[ . 1 . 2]" 1
180 1 10 ILE HG13 1 11 ALA H . . 5.750 4.639 3.341 5.116 . 0 0 "[ . 1 . 2]" 1
181 1 10 ILE MG 1 11 ALA H . . 4.350 2.446 2.035 2.743 . 0 0 "[ . 1 . 2]" 1
182 1 10 ILE MG 1 11 ALA MB . . 8.040 3.477 3.132 3.852 . 0 0 "[ . 1 . 2]" 1
183 1 10 ILE MG 1 14 GLU H . . 5.180 3.956 3.503 4.668 . 0 0 "[ . 1 . 2]" 1
184 1 10 ILE MG 1 14 GLU HB2 . . 5.330 2.550 2.042 3.646 . 0 0 "[ . 1 . 2]" 1
185 1 10 ILE MG 1 14 GLU HB3 . . 4.430 3.192 2.399 4.288 . 0 0 "[ . 1 . 2]" 1
186 1 10 ILE MG 1 14 GLU QG . . 6.130 3.217 1.848 4.848 . 0 0 "[ . 1 . 2]" 1
187 1 10 ILE MG 1 41 PHE QD . . 8.100 4.255 3.223 5.463 . 0 0 "[ . 1 . 2]" 1
188 1 10 ILE MG 1 41 PHE QE . . 6.670 3.201 1.842 4.433 . 0 0 "[ . 1 . 2]" 1
189 1 11 ALA H 1 11 ALA MB . . 3.420 2.245 2.212 2.287 . 0 0 "[ . 1 . 2]" 1
190 1 11 ALA H 1 12 ASP H . . 6.000 4.593 4.472 4.645 . 0 0 "[ . 1 . 2]" 1
191 1 11 ALA H 1 14 GLU HB2 . . 4.340 3.649 2.600 4.349 0.009 9 0 "[ . 1 . 2]" 1
192 1 11 ALA H 1 14 GLU HB3 . . 5.530 4.729 3.713 5.547 0.017 6 0 "[ . 1 . 2]" 1
193 1 11 ALA H 1 14 GLU QG . . 5.080 3.214 2.325 4.457 . 0 0 "[ . 1 . 2]" 1
194 1 11 ALA HA 1 12 ASP H . . 2.580 2.306 2.165 2.638 0.058 1 0 "[ . 1 . 2]" 1
195 1 11 ALA HA 1 14 GLU HB2 . . 5.780 4.999 4.092 5.517 . 0 0 "[ . 1 . 2]" 1
196 1 11 ALA MB 1 12 ASP H . . 3.850 2.590 1.889 3.146 . 0 0 "[ . 1 . 2]" 1
197 1 11 ALA MB 1 13 ASN H . . 3.990 2.813 2.389 3.403 . 0 0 "[ . 1 . 2]" 1
198 1 11 ALA MB 1 13 ASN HB2 . . 7.020 4.200 3.026 5.348 . 0 0 "[ . 1 . 2]" 1
199 1 11 ALA MB 1 13 ASN HB3 . . 7.020 4.099 2.792 5.405 . 0 0 "[ . 1 . 2]" 1
200 1 11 ALA MB 1 14 GLU H . . 4.320 3.111 2.633 3.738 . 0 0 "[ . 1 . 2]" 1
201 1 11 ALA MB 1 14 GLU HB2 . . 4.750 3.145 1.985 3.878 . 0 0 "[ . 1 . 2]" 1
202 1 11 ALA MB 1 14 GLU HG2 . . 4.750 2.511 1.785 3.917 . 0 0 "[ . 1 . 2]" 1
203 1 11 ALA MB 1 14 GLU QG . . 4.610 2.004 1.740 3.698 . 0 0 "[ . 1 . 2]" 1
204 1 11 ALA MB 1 14 GLU HG3 . . 4.750 2.566 1.782 4.539 . 0 0 "[ . 1 . 2]" 1
205 1 12 ASP H 1 12 ASP HB2 . . 3.440 2.747 2.266 3.594 0.154 12 0 "[ . 1 . 2]" 1
206 1 12 ASP H 1 12 ASP HB3 . . 3.440 2.715 2.407 3.560 0.120 10 0 "[ . 1 . 2]" 1
207 1 12 ASP H 1 13 ASN H . . 3.440 2.581 2.388 2.779 . 0 0 "[ . 1 . 2]" 1
208 1 12 ASP HA 1 15 LEU H . . 4.700 4.188 3.373 4.794 0.094 9 0 "[ . 1 . 2]" 1
209 1 12 ASP HA 1 15 LEU MD1 . . 5.470 3.644 2.454 5.305 . 0 0 "[ . 1 . 2]" 1
210 1 12 ASP QB 1 13 ASN H . . 3.980 2.926 2.308 3.771 . 0 0 "[ . 1 . 2]" 1
211 1 12 ASP HB2 1 13 ASN H . . 4.340 3.816 2.989 4.141 . 0 0 "[ . 1 . 2]" 1
212 1 12 ASP HB3 1 13 ASN H . . 4.340 3.209 2.330 4.372 0.032 6 0 "[ . 1 . 2]" 1
213 1 13 ASN H 1 13 ASN HB2 . . 3.440 2.566 2.327 3.569 0.129 16 0 "[ . 1 . 2]" 1
214 1 13 ASN H 1 13 ASN HB3 . . 3.700 2.890 2.513 3.651 . 0 0 "[ . 1 . 2]" 1
215 1 13 ASN H 1 14 GLU H . . 3.230 2.560 2.274 2.916 . 0 0 "[ . 1 . 2]" 1
216 1 13 ASN HA 1 13 ASN HB2 . . 2.980 2.657 2.465 3.019 0.039 15 0 "[ . 1 . 2]" 1
217 1 13 ASN HA 1 13 ASN HB3 . . 2.980 2.854 2.437 3.026 0.046 19 0 "[ . 1 . 2]" 1
218 1 13 ASN HB2 1 14 GLU H . . 5.170 4.081 3.447 4.496 . 0 0 "[ . 1 . 2]" 1
219 1 14 GLU H 1 14 GLU HB2 . . 3.440 2.302 2.134 2.532 . 0 0 "[ . 1 . 2]" 1
220 1 14 GLU H 1 14 GLU HB3 . . 3.300 3.507 3.296 3.574 0.274 20 0 "[ . 1 . 2]" 1
221 1 14 GLU H 1 14 GLU HG2 . . 4.340 3.091 2.105 4.366 0.026 8 0 "[ . 1 . 2]" 1
222 1 14 GLU H 1 14 GLU QG . . 4.050 2.712 2.091 3.790 . 0 0 "[ . 1 . 2]" 1
223 1 14 GLU H 1 14 GLU HG3 . . 4.340 3.571 2.340 4.210 . 0 0 "[ . 1 . 2]" 1
224 1 14 GLU H 1 15 LEU H . . 2.900 2.414 2.182 2.710 . 0 0 "[ . 1 . 2]" 1
225 1 14 GLU HA 1 15 LEU H . . 3.520 3.390 3.166 3.546 0.026 15 0 "[ . 1 . 2]" 1
226 1 14 GLU HB2 1 15 LEU H . . 3.910 3.225 2.564 3.815 . 0 0 "[ . 1 . 2]" 1
227 1 14 GLU HB2 1 41 PHE QE . . 8.130 5.948 3.158 8.005 . 0 0 "[ . 1 . 2]" 1
228 1 14 GLU HB3 1 15 LEU H . . 4.270 3.892 3.140 4.255 . 0 0 "[ . 1 . 2]" 1
229 1 14 GLU HB3 1 41 PHE QE . . 8.130 5.881 2.537 7.873 . 0 0 "[ . 1 . 2]" 1
230 1 14 GLU QG 1 15 LEU H . . 5.780 4.383 3.861 4.964 . 0 0 "[ . 1 . 2]" 1
231 1 14 GLU HG2 1 15 LEU H . . 6.000 4.829 4.054 5.839 . 0 0 "[ . 1 . 2]" 1
232 1 14 GLU HG3 1 15 LEU H . . 6.000 5.157 4.499 5.607 . 0 0 "[ . 1 . 2]" 1
233 1 15 LEU H 1 15 LEU HB2 . . 3.080 2.453 2.394 2.493 . 0 0 "[ . 1 . 2]" 1
234 1 15 LEU H 1 15 LEU HB3 . . 3.880 3.611 3.587 3.628 . 0 0 "[ . 1 . 2]" 1
235 1 15 LEU H 1 15 LEU MD1 . . 4.570 3.749 3.658 3.857 . 0 0 "[ . 1 . 2]" 1
236 1 15 LEU H 1 15 LEU MD2 . . 4.350 3.398 3.230 3.549 . 0 0 "[ . 1 . 2]" 1
237 1 15 LEU H 1 15 LEU HG . . 2.870 2.483 2.355 2.620 . 0 0 "[ . 1 . 2]" 1
238 1 15 LEU H 1 16 GLU H . . 4.920 4.556 4.448 4.637 . 0 0 "[ . 1 . 2]" 1
239 1 15 LEU HA 1 15 LEU MD2 . . 4.210 1.987 1.912 2.081 . 0 0 "[ . 1 . 2]" 1
240 1 15 LEU HA 1 16 GLU H . . 3.010 2.205 2.114 2.371 . 0 0 "[ . 1 . 2]" 1
241 1 15 LEU HB2 1 16 GLU H . . 4.200 4.041 3.654 4.235 0.035 9 0 "[ . 1 . 2]" 1
242 1 15 LEU HB2 1 17 ILE MD . . 4.970 3.091 2.496 3.753 . 0 0 "[ . 1 . 2]" 1
243 1 15 LEU HB2 1 17 ILE QG . . 6.880 3.370 2.810 4.454 . 0 0 "[ . 1 . 2]" 1
244 1 15 LEU HB3 1 16 GLU H . . 3.520 3.019 2.446 3.361 . 0 0 "[ . 1 . 2]" 1
245 1 15 LEU HB3 1 17 ILE MD . . 4.570 2.998 2.452 3.731 . 0 0 "[ . 1 . 2]" 1
246 1 15 LEU HB3 1 17 ILE QG . . 6.880 3.761 2.974 4.804 . 0 0 "[ . 1 . 2]" 1
247 1 15 LEU MD1 1 16 GLU H . . 5.000 4.811 4.340 5.064 0.064 2 0 "[ . 1 . 2]" 1
248 1 15 LEU MD1 1 91 LEU MD1 . . 6.710 4.388 2.927 5.442 . 0 0 "[ . 1 . 2]" 1
249 1 15 LEU MD1 1 91 LEU QD . . 6.450 3.248 2.305 4.485 . 0 0 "[ . 1 . 2]" 1
250 1 15 LEU MD1 1 91 LEU MD2 . . 6.710 3.361 2.412 4.805 . 0 0 "[ . 1 . 2]" 1
251 1 15 LEU MD2 1 16 GLU H . . 4.710 3.480 3.203 3.641 . 0 0 "[ . 1 . 2]" 1
252 1 15 LEU MD2 1 41 PHE QB . . 5.670 3.334 2.154 4.999 . 0 0 "[ . 1 . 2]" 1
253 1 15 LEU MD2 1 91 LEU MD1 . . 6.200 4.431 2.815 5.387 . 0 0 "[ . 1 . 2]" 1
254 1 15 LEU MD2 1 91 LEU QD . . 5.610 3.594 2.438 4.675 . 0 0 "[ . 1 . 2]" 1
255 1 15 LEU MD2 1 91 LEU MD2 . . 6.200 3.821 2.538 5.130 . 0 0 "[ . 1 . 2]" 1
256 1 15 LEU HG 1 16 GLU H . . 6.000 5.070 4.878 5.221 . 0 0 "[ . 1 . 2]" 1
257 1 16 GLU H 1 16 GLU HB2 . . 3.550 2.477 2.252 3.620 0.070 7 0 "[ . 1 . 2]" 1
258 1 16 GLU H 1 16 GLU HB3 . . 3.550 3.367 2.510 3.634 0.084 3 0 "[ . 1 . 2]" 1
259 1 16 GLU H 1 16 GLU HG2 . . 4.450 3.621 2.515 4.475 0.025 20 0 "[ . 1 . 2]" 1
260 1 16 GLU H 1 16 GLU QG . . 4.270 2.877 2.317 4.029 . 0 0 "[ . 1 . 2]" 1
261 1 16 GLU H 1 16 GLU HG3 . . 4.450 3.292 2.353 4.574 0.124 20 0 "[ . 1 . 2]" 1
262 1 16 GLU H 1 17 ILE H . . 5.060 4.259 4.114 4.490 . 0 0 "[ . 1 . 2]" 1
263 1 16 GLU H 1 40 ARG H . . 3.730 3.498 2.819 3.792 0.062 17 0 "[ . 1 . 2]" 1
264 1 16 GLU HA 1 17 ILE H . . 2.540 2.149 2.061 2.223 . 0 0 "[ . 1 . 2]" 1
265 1 16 GLU QB 1 40 ARG H . . 4.760 3.050 2.383 4.867 0.107 7 0 "[ . 1 . 2]" 1
266 1 16 GLU HB2 1 17 ILE H . . 4.420 4.378 3.180 4.549 0.129 4 0 "[ . 1 . 2]" 1
267 1 16 GLU HB3 1 17 ILE H . . 4.420 3.873 3.481 4.305 . 0 0 "[ . 1 . 2]" 1
268 1 16 GLU QG 1 17 ILE H . . 4.820 4.155 3.052 4.625 . 0 0 "[ . 1 . 2]" 1
269 1 16 GLU HG2 1 17 ILE H . . 5.280 4.447 3.227 5.039 . 0 0 "[ . 1 . 2]" 1
270 1 16 GLU HG3 1 17 ILE H . . 5.280 5.041 3.387 5.384 0.104 5 0 "[ . 1 . 2]" 1
271 1 17 ILE H 1 17 ILE HB . . 3.080 2.562 2.503 2.712 . 0 0 "[ . 1 . 2]" 1
272 1 17 ILE H 1 17 ILE MD . . 4.500 3.474 3.323 3.836 . 0 0 "[ . 1 . 2]" 1
273 1 17 ILE H 1 17 ILE QG . . 4.360 2.459 2.240 2.950 . 0 0 "[ . 1 . 2]" 1
274 1 17 ILE H 1 18 THR H . . 5.420 4.389 4.200 4.554 . 0 0 "[ . 1 . 2]" 1
275 1 17 ILE HA 1 18 THR H . . 2.720 2.146 2.094 2.175 . 0 0 "[ . 1 . 2]" 1
276 1 17 ILE HA 1 39 LEU HA . . 4.200 2.797 2.498 3.093 . 0 0 "[ . 1 . 2]" 1
277 1 17 ILE HA 1 39 LEU MD1 . . 6.260 4.946 3.970 5.474 . 0 0 "[ . 1 . 2]" 1
278 1 17 ILE HA 1 39 LEU MD2 . . 7.020 4.925 4.480 5.322 . 0 0 "[ . 1 . 2]" 1
279 1 17 ILE HA 1 39 LEU HG . . 6.000 5.856 5.298 6.051 0.051 5 0 "[ . 1 . 2]" 1
280 1 17 ILE HA 1 40 ARG H . . 4.520 4.265 3.572 4.610 0.090 7 0 "[ . 1 . 2]" 1
281 1 17 ILE HB 1 18 THR H . . 4.880 4.220 4.044 4.315 . 0 0 "[ . 1 . 2]" 1
282 1 17 ILE MD 1 18 THR H . . 4.460 3.736 3.603 3.887 . 0 0 "[ . 1 . 2]" 1
283 1 17 ILE MD 1 39 LEU HA . . 6.550 3.139 2.595 3.824 . 0 0 "[ . 1 . 2]" 1
284 1 17 ILE MD 1 84 ARG QD . . 5.670 3.725 2.999 4.871 . 0 0 "[ . 1 . 2]" 1
285 1 17 ILE QG 1 18 THR H . . 5.780 4.712 4.580 4.811 . 0 0 "[ . 1 . 2]" 1
286 1 17 ILE QG 1 39 LEU HA . . 6.880 4.924 4.437 5.450 . 0 0 "[ . 1 . 2]" 1
287 1 17 ILE HG12 1 18 THR H . . 6.000 5.124 5.041 5.204 . 0 0 "[ . 1 . 2]" 1
288 1 17 ILE HG13 1 18 THR H . . 6.000 5.501 5.257 5.681 . 0 0 "[ . 1 . 2]" 1
289 1 17 ILE MG 1 18 THR H . . 4.710 2.806 2.456 3.053 . 0 0 "[ . 1 . 2]" 1
290 1 17 ILE MG 1 84 ARG QD . . 6.460 3.988 2.257 6.051 . 0 0 "[ . 1 . 2]" 1
291 1 18 THR H 1 18 THR HB . . 3.480 3.326 2.920 3.632 0.152 20 0 "[ . 1 . 2]" 1
292 1 18 THR H 1 18 THR MG . . 4.500 3.658 3.191 3.966 . 0 0 "[ . 1 . 2]" 1
293 1 18 THR H 1 38 HIS H . . 3.700 3.445 2.979 3.786 0.086 6 0 "[ . 1 . 2]" 1
294 1 18 THR H 1 38 HIS HB3 . . 5.570 3.443 2.647 3.829 . 0 0 "[ . 1 . 2]" 1
295 1 18 THR H 1 39 LEU HA . . 3.730 3.192 2.771 3.678 . 0 0 "[ . 1 . 2]" 1
296 1 18 THR HA 1 19 ALA H . . 2.440 2.259 2.184 2.300 . 0 0 "[ . 1 . 2]" 1
297 1 18 THR HB 1 19 ALA H . . 3.300 3.188 2.804 3.426 0.126 7 0 "[ . 1 . 2]" 1
298 1 18 THR HB 1 38 HIS H . . 6.000 4.664 3.820 5.378 . 0 0 "[ . 1 . 2]" 1
299 1 18 THR HB 1 38 HIS HB2 . . 4.780 4.387 3.223 4.843 0.063 9 0 "[ . 1 . 2]" 1
300 1 18 THR HB 1 38 HIS HB3 . . 4.810 2.832 1.768 3.342 . 0 0 "[ . 1 . 2]" 1
301 1 18 THR MG 1 19 ALA H . . 3.810 2.783 2.161 3.488 . 0 0 "[ . 1 . 2]" 1
302 1 19 ALA H 1 19 ALA MB . . 3.420 2.315 2.263 2.392 . 0 0 "[ . 1 . 2]" 1
303 1 19 ALA H 1 20 ILE H . . 5.170 4.501 4.252 4.611 . 0 0 "[ . 1 . 2]" 1
304 1 19 ALA HA 1 20 ILE H . . 2.830 2.203 2.148 2.320 . 0 0 "[ . 1 . 2]" 1
305 1 19 ALA MB 1 20 ILE H . . 4.030 2.970 2.640 3.355 . 0 0 "[ . 1 . 2]" 1
306 1 20 ILE H 1 20 ILE HB . . 3.160 2.565 2.436 2.663 . 0 0 "[ . 1 . 2]" 1
307 1 20 ILE H 1 20 ILE MD . . 5.290 3.614 1.743 3.940 . 0 0 "[ . 1 . 2]" 1
308 1 20 ILE H 1 20 ILE QG . . 4.830 2.313 2.011 3.052 . 0 0 "[ . 1 . 2]" 1
309 1 20 ILE H 1 20 ILE MG . . 4.500 3.798 3.762 3.839 . 0 0 "[ . 1 . 2]" 1
310 1 20 ILE H 1 21 ARG H . . 5.750 4.423 4.064 4.605 . 0 0 "[ . 1 . 2]" 1
311 1 20 ILE HA 1 20 ILE MD . . 4.390 3.607 1.952 3.881 . 0 0 "[ . 1 . 2]" 1
312 1 20 ILE HA 1 21 ARG H . . 2.690 2.137 2.089 2.239 . 0 0 "[ . 1 . 2]" 1
313 1 20 ILE HB 1 20 ILE MD . . 3.670 2.524 2.277 3.234 . 0 0 "[ . 1 . 2]" 1
314 1 20 ILE HB 1 21 ARG H . . 4.160 4.196 3.898 4.381 0.221 15 0 "[ . 1 . 2]" 1
315 1 20 ILE HB 1 36 ALA MB . . 4.530 2.365 1.691 3.797 . 0 0 "[ . 1 . 2]" 1
316 1 20 ILE HB 1 38 HIS H . . 6.000 5.710 5.309 6.060 0.060 12 0 "[ . 1 . 2]" 1
317 1 20 ILE MD 1 21 ARG H . . 6.260 4.971 3.452 5.494 . 0 0 "[ . 1 . 2]" 1
318 1 20 ILE MD 1 36 ALA MB . . 5.810 2.127 1.728 3.836 . 0 0 "[ . 1 . 2]" 1
319 1 20 ILE MD 1 37 ILE HA . . 6.730 4.396 3.215 5.445 . 0 0 "[ . 1 . 2]" 1
320 1 20 ILE MD 1 38 HIS H . . 5.720 4.018 2.667 4.380 . 0 0 "[ . 1 . 2]" 1
321 1 20 ILE MD 1 38 HIS HA . . 5.360 3.380 2.824 4.051 . 0 0 "[ . 1 . 2]" 1
322 1 20 ILE MD 1 38 HIS HB2 . . 4.320 2.206 1.771 2.960 . 0 0 "[ . 1 . 2]" 1
323 1 20 ILE MD 1 38 HIS HB3 . . 5.940 3.574 2.737 4.156 . 0 0 "[ . 1 . 2]" 1
324 1 20 ILE MD 1 38 HIS HD2 . . 5.650 3.323 2.385 4.332 . 0 0 "[ . 1 . 2]" 1
325 1 20 ILE MD 1 73 LYS QD . . 5.630 3.552 2.348 4.504 . 0 0 "[ . 1 . 2]" 1
326 1 20 ILE MD 1 73 LYS QE . . 6.100 3.338 1.902 5.209 . 0 0 "[ . 1 . 2]" 1
327 1 20 ILE MD 1 73 LYS QG . . 7.220 2.543 1.782 4.588 . 0 0 "[ . 1 . 2]" 1
328 1 20 ILE QG 1 21 ARG H . . 5.800 4.241 4.030 4.595 . 0 0 "[ . 1 . 2]" 1
329 1 20 ILE QG 1 38 HIS HB2 . . 5.550 2.018 1.708 2.773 . 0 0 "[ . 1 . 2]" 1
330 1 20 ILE QG 1 38 HIS HB3 . . 5.620 2.840 2.586 3.490 . 0 0 "[ . 1 . 2]" 1
331 1 20 ILE HG12 1 37 ILE HA . . 6.000 5.449 4.586 6.046 0.046 14 0 "[ . 1 . 2]" 1
332 1 20 ILE HG12 1 38 HIS HB2 . . 6.000 2.285 1.722 3.056 . 0 0 "[ . 1 . 2]" 1
333 1 20 ILE HG12 1 38 HIS HB3 . . 6.000 3.270 2.863 4.514 . 0 0 "[ . 1 . 2]" 1
334 1 20 ILE HG13 1 37 ILE HA . . 6.000 4.207 3.458 5.775 . 0 0 "[ . 1 . 2]" 1
335 1 20 ILE HG13 1 38 HIS HB2 . . 6.000 2.456 1.910 3.621 . 0 0 "[ . 1 . 2]" 1
336 1 20 ILE HG13 1 38 HIS HB3 . . 6.000 3.266 2.812 4.956 . 0 0 "[ . 1 . 2]" 1
337 1 20 ILE MG 1 21 ARG H . . 4.030 2.779 2.293 3.425 . 0 0 "[ . 1 . 2]" 1
338 1 20 ILE MG 1 36 ALA MB . . 6.960 3.223 2.599 4.003 . 0 0 "[ . 1 . 2]" 1
339 1 20 ILE MG 1 38 HIS HB2 . . 5.400 4.178 3.598 4.905 . 0 0 "[ . 1 . 2]" 1
340 1 20 ILE MG 1 38 HIS HB3 . . 6.190 5.050 4.519 5.523 . 0 0 "[ . 1 . 2]" 1
341 1 21 ARG H 1 21 ARG HB2 . . 3.440 2.932 2.374 3.565 0.125 16 0 "[ . 1 . 2]" 1
342 1 21 ARG H 1 21 ARG QB . . 3.220 2.484 2.245 2.792 . 0 0 "[ . 1 . 2]" 1
343 1 21 ARG H 1 21 ARG HB3 . . 3.440 2.816 2.435 3.624 0.184 15 0 "[ . 1 . 2]" 1
344 1 22 ALA H 1 23 GLN H . . 4.990 3.528 2.167 4.628 . 0 0 "[ . 1 . 2]" 1
345 1 23 GLN HA 1 24 GLY H . . 3.190 2.416 2.118 3.235 0.045 3 0 "[ . 1 . 2]" 1
346 1 23 GLN HG2 1 24 GLY H . . 6.000 4.352 1.729 5.758 . 0 0 "[ . 1 . 2]" 1
347 1 23 GLN HG3 1 24 GLY H . . 6.000 3.952 1.916 5.351 . 0 0 "[ . 1 . 2]" 1
348 1 26 GLY QA 1 30 VAL QG . . 8.480 4.544 2.453 7.716 . 0 0 "[ . 1 . 2]" 1
349 1 27 GLY QA 1 30 VAL QG . . 7.850 4.870 2.801 5.997 . 0 0 "[ . 1 . 2]" 1
350 1 27 GLY HA2 1 30 VAL MG1 . . 9.970 7.056 5.517 8.998 . 0 0 "[ . 1 . 2]" 1
351 1 27 GLY HA2 1 30 VAL MG2 . . 9.970 6.530 4.046 9.441 . 0 0 "[ . 1 . 2]" 1
352 1 27 GLY HA3 1 30 VAL MG1 . . 9.970 6.786 4.281 9.415 . 0 0 "[ . 1 . 2]" 1
353 1 27 GLY HA3 1 30 VAL MG2 . . 9.970 6.149 2.876 8.895 . 0 0 "[ . 1 . 2]" 1
354 1 28 GLN H 1 28 GLN HB2 . . 4.160 3.104 2.454 3.972 . 0 0 "[ . 1 . 2]" 1
355 1 28 GLN H 1 28 GLN QB . . 3.700 2.794 2.304 3.396 . 0 0 "[ . 1 . 2]" 1
356 1 28 GLN H 1 28 GLN HB3 . . 4.160 3.503 2.503 4.094 . 0 0 "[ . 1 . 2]" 1
357 1 28 GLN HA 1 29 HIS H . . 3.190 2.498 2.075 2.841 . 0 0 "[ . 1 . 2]" 1
358 1 28 GLN QB 1 29 HIS H . . 3.250 2.412 1.770 3.287 0.037 8 0 "[ . 1 . 2]" 1
359 1 28 GLN HB2 1 29 HIS H . . 3.590 3.261 1.921 3.818 0.228 4 0 "[ . 1 . 2]" 1
360 1 28 GLN HB3 1 29 HIS H . . 3.590 2.739 1.777 3.738 0.148 14 0 "[ . 1 . 2]" 1
361 1 29 HIS HA 1 30 VAL H . . 3.120 2.593 2.081 3.242 0.122 6 0 "[ . 1 . 2]" 1
362 1 29 HIS HB2 1 30 VAL H . . 4.160 3.873 2.967 4.422 0.262 7 0 "[ . 1 . 2]" 1
363 1 29 HIS HB3 1 30 VAL H . . 4.160 3.903 2.074 4.308 0.148 17 0 "[ . 1 . 2]" 1
364 1 30 VAL H 1 30 VAL HB . . 3.300 2.821 2.491 3.442 0.142 14 0 "[ . 1 . 2]" 1
365 1 30 VAL H 1 30 VAL QG . . 4.190 2.236 1.855 2.773 . 0 0 "[ . 1 . 2]" 1
366 1 30 VAL H 1 31 ASN H . . 5.390 3.451 1.788 4.581 . 0 0 "[ . 1 . 2]" 1
367 1 30 VAL HA 1 31 ASN H . . 3.410 2.752 2.086 3.523 0.113 18 0 "[ . 1 . 2]" 1
368 1 30 VAL HB 1 31 ASN H . . 3.880 3.719 1.963 4.058 0.178 20 0 "[ . 1 . 2]" 1
369 1 30 VAL QG 1 31 ASN H . . 6.070 2.527 2.018 3.649 . 0 0 "[ . 1 . 2]" 1
370 1 30 VAL MG1 1 31 ASN H . . 6.550 2.837 2.147 4.235 . 0 0 "[ . 1 . 2]" 1
371 1 30 VAL MG2 1 31 ASN H . . 6.550 3.658 2.030 4.169 . 0 0 "[ . 1 . 2]" 1
372 1 31 ASN HB2 1 32 LYS H . . 4.810 3.615 2.098 4.481 . 0 0 "[ . 1 . 2]" 1
373 1 31 ASN HB3 1 32 LYS H . . 4.810 3.781 2.188 4.608 . 0 0 "[ . 1 . 2]" 1
374 1 32 LYS H 1 33 THR H . . 5.170 3.740 1.974 4.645 . 0 0 "[ . 1 . 2]" 1
375 1 32 LYS HA 1 33 THR H . . 3.340 2.596 2.093 3.412 0.072 14 0 "[ . 1 . 2]" 1
376 1 32 LYS HB2 1 33 THR H . . 5.060 3.833 2.069 4.634 . 0 0 "[ . 1 . 2]" 1
377 1 32 LYS HB3 1 33 THR H . . 5.060 3.640 2.109 4.487 . 0 0 "[ . 1 . 2]" 1
378 1 33 THR H 1 33 THR HB . . 4.090 3.289 2.629 3.752 . 0 0 "[ . 1 . 2]" 1
379 1 33 THR H 1 33 THR MG . . 4.500 3.161 1.973 4.025 . 0 0 "[ . 1 . 2]" 1
380 1 33 THR H 1 34 SER H . . 4.780 3.714 2.262 4.549 . 0 0 "[ . 1 . 2]" 1
381 1 33 THR HA 1 34 SER H . . 3.120 2.513 2.105 3.171 0.051 15 0 "[ . 1 . 2]" 1
382 1 33 THR HB 1 34 SER H . . 4.240 3.878 2.002 4.319 0.079 12 0 "[ . 1 . 2]" 1
383 1 33 THR MG 1 34 SER H . . 6.770 3.680 2.560 4.370 . 0 0 "[ . 1 . 2]" 1
384 1 34 SER H 1 34 SER HB2 . . 3.980 3.006 2.495 3.851 . 0 0 "[ . 1 . 2]" 1
385 1 34 SER H 1 34 SER QB . . 3.750 2.715 2.300 3.390 . 0 0 "[ . 1 . 2]" 1
386 1 34 SER H 1 34 SER HB3 . . 3.980 3.425 2.678 4.059 0.079 15 0 "[ . 1 . 2]" 1
387 1 34 SER HB2 1 35 SER H . . 4.630 3.802 2.386 4.590 . 0 0 "[ . 1 . 2]" 1
388 1 34 SER HB3 1 35 SER H . . 4.630 3.917 1.710 4.677 0.047 19 0 "[ . 1 . 2]" 1
389 1 35 SER H 1 36 ALA H . . 3.550 3.102 1.843 3.643 0.093 15 0 "[ . 1 . 2]" 1
390 1 35 SER HA 1 36 ALA H . . 3.230 2.541 2.196 3.247 0.017 7 0 "[ . 1 . 2]" 1
391 1 35 SER HA 1 36 ALA MB . . 6.120 4.393 4.150 4.851 . 0 0 "[ . 1 . 2]" 1
392 1 36 ALA H 1 36 ALA MB . . 3.420 2.511 2.245 2.732 . 0 0 "[ . 1 . 2]" 1
393 1 36 ALA H 1 37 ILE H . . 4.270 4.393 4.297 4.533 0.263 7 0 "[ . 1 . 2]" 1
394 1 36 ALA HA 1 37 ILE H . . 2.760 2.343 2.125 2.620 . 0 0 "[ . 1 . 2]" 1
395 1 36 ALA HA 1 37 ILE MD . . 6.050 4.243 3.759 4.828 . 0 0 "[ . 1 . 2]" 1
396 1 36 ALA MB 1 37 ILE H . . 4.170 2.506 2.046 3.055 . 0 0 "[ . 1 . 2]" 1
397 1 36 ALA MB 1 37 ILE HA . . 6.050 4.190 4.036 4.313 . 0 0 "[ . 1 . 2]" 1
398 1 36 ALA MB 1 74 ALA H . . 4.610 3.727 2.676 4.363 . 0 0 "[ . 1 . 2]" 1
399 1 36 ALA MB 1 75 GLN HA . . 4.250 3.454 2.744 4.151 . 0 0 "[ . 1 . 2]" 1
400 1 36 ALA MB 1 75 GLN QB . . 5.130 2.101 1.695 2.862 . 0 0 "[ . 1 . 2]" 1
401 1 36 ALA MB 1 75 GLN HG2 . . 5.360 3.651 2.543 4.808 . 0 0 "[ . 1 . 2]" 1
402 1 36 ALA MB 1 75 GLN QG . . 4.690 3.421 2.513 4.218 . 0 0 "[ . 1 . 2]" 1
403 1 36 ALA MB 1 75 GLN HG3 . . 5.360 4.301 3.817 5.387 0.027 11 0 "[ . 1 . 2]" 1
404 1 37 ILE H 1 37 ILE HB . . 3.080 2.514 2.440 2.580 . 0 0 "[ . 1 . 2]" 1
405 1 37 ILE H 1 37 ILE MD . . 5.080 3.607 3.440 3.801 . 0 0 "[ . 1 . 2]" 1
406 1 37 ILE H 1 37 ILE HG12 . . 4.490 2.668 2.481 2.891 . 0 0 "[ . 1 . 2]" 1
407 1 37 ILE H 1 37 ILE QG . . 4.200 2.630 2.453 2.840 . 0 0 "[ . 1 . 2]" 1
408 1 37 ILE H 1 37 ILE HG13 . . 4.490 3.996 3.870 4.151 . 0 0 "[ . 1 . 2]" 1
409 1 37 ILE H 1 37 ILE MG . . 4.750 3.797 3.751 3.826 . 0 0 "[ . 1 . 2]" 1
410 1 37 ILE H 1 38 HIS H . . 6.000 4.402 4.269 4.490 . 0 0 "[ . 1 . 2]" 1
411 1 37 ILE H 1 74 ALA H . . 3.660 3.285 2.844 3.678 0.018 3 0 "[ . 1 . 2]" 1
412 1 37 ILE H 1 74 ALA MB . . 4.820 3.286 2.684 3.937 . 0 0 "[ . 1 . 2]" 1
413 1 37 ILE H 1 75 GLN HA . . 4.160 3.875 3.461 4.201 0.041 14 0 "[ . 1 . 2]" 1
414 1 37 ILE H 1 83 ASN HB2 . . 4.880 4.796 4.413 4.970 0.090 20 0 "[ . 1 . 2]" 1
415 1 37 ILE H 1 83 ASN QB . . 4.640 3.543 3.050 3.931 . 0 0 "[ . 1 . 2]" 1
416 1 37 ILE H 1 83 ASN HB3 . . 4.880 3.659 3.100 4.150 . 0 0 "[ . 1 . 2]" 1
417 1 37 ILE HA 1 37 ILE MD . . 3.530 1.967 1.871 2.040 . 0 0 "[ . 1 . 2]" 1
418 1 37 ILE HA 1 38 HIS H . . 2.800 2.125 2.071 2.184 . 0 0 "[ . 1 . 2]" 1
419 1 37 ILE HB 1 38 HIS H . . 4.270 4.214 4.042 4.338 0.068 12 0 "[ . 1 . 2]" 1
420 1 37 ILE HB 1 74 ALA H . . 5.320 3.549 3.059 4.241 . 0 0 "[ . 1 . 2]" 1
421 1 37 ILE HB 1 74 ALA MB . . 4.390 2.302 1.748 3.427 . 0 0 "[ . 1 . 2]" 1
422 1 37 ILE HB 1 83 ASN QB . . 6.230 2.862 2.310 3.384 . 0 0 "[ . 1 . 2]" 1
423 1 37 ILE HB 1 84 ARG QG . . 5.840 4.803 3.767 5.846 0.006 5 0 "[ . 1 . 2]" 1
424 1 37 ILE MD 1 38 HIS H . . 4.210 3.537 3.342 3.710 . 0 0 "[ . 1 . 2]" 1
425 1 37 ILE MD 1 74 ALA MB . . 8.040 4.712 4.248 5.609 . 0 0 "[ . 1 . 2]" 1
426 1 37 ILE MD 1 80 GLN H . . 6.080 4.937 4.318 5.609 . 0 0 "[ . 1 . 2]" 1
427 1 37 ILE MD 1 80 GLN HA . . 4.900 3.045 2.347 3.723 . 0 0 "[ . 1 . 2]" 1
428 1 37 ILE MD 1 80 GLN HB2 . . 5.470 3.753 2.092 4.594 . 0 0 "[ . 1 . 2]" 1
429 1 37 ILE MD 1 80 GLN HB3 . . 4.720 2.486 1.751 4.332 . 0 0 "[ . 1 . 2]" 1
430 1 37 ILE MD 1 80 GLN HG2 . . 5.000 3.074 2.409 4.296 . 0 0 "[ . 1 . 2]" 1
431 1 37 ILE MD 1 80 GLN QG . . 4.730 2.444 1.777 3.680 . 0 0 "[ . 1 . 2]" 1
432 1 37 ILE MD 1 80 GLN HG3 . . 5.000 2.648 1.830 4.001 . 0 0 "[ . 1 . 2]" 1
433 1 37 ILE MD 1 83 ASN QB . . 6.500 3.372 3.085 3.930 . 0 0 "[ . 1 . 2]" 1
434 1 37 ILE MD 1 84 ARG H . . 5.040 4.314 3.781 5.050 0.010 1 0 "[ . 1 . 2]" 1
435 1 37 ILE MD 1 84 ARG HA . . 5.260 4.277 3.620 5.287 0.027 1 0 "[ . 1 . 2]" 1
436 1 37 ILE MD 1 84 ARG QB . . 5.780 4.024 2.875 5.413 . 0 0 "[ . 1 . 2]" 1
437 1 37 ILE MD 1 84 ARG QD . . 7.400 4.085 3.002 5.700 . 0 0 "[ . 1 . 2]" 1
438 1 37 ILE MD 1 84 ARG QG . . 6.750 3.455 2.405 4.871 . 0 0 "[ . 1 . 2]" 1
439 1 37 ILE QG 1 38 HIS H . . 6.410 4.612 4.524 4.737 . 0 0 "[ . 1 . 2]" 1
440 1 37 ILE MG 1 38 HIS H . . 4.250 2.714 2.450 3.010 . 0 0 "[ . 1 . 2]" 1
441 1 37 ILE MG 1 74 ALA H . . 5.040 4.158 3.585 4.829 . 0 0 "[ . 1 . 2]" 1
442 1 37 ILE MG 1 74 ALA MB . . 8.040 3.351 2.655 4.239 . 0 0 "[ . 1 . 2]" 1
443 1 37 ILE MG 1 80 GLN HB2 . . 7.020 6.257 4.642 7.150 0.130 16 0 "[ . 1 . 2]" 1
444 1 37 ILE MG 1 80 GLN HB3 . . 7.020 5.006 4.547 6.546 . 0 0 "[ . 1 . 2]" 1
445 1 37 ILE MG 1 80 GLN HG2 . . 6.260 5.865 5.397 6.269 0.009 14 0 "[ . 1 . 2]" 1
446 1 37 ILE MG 1 80 GLN QG . . 5.810 5.014 4.335 5.590 . 0 0 "[ . 1 . 2]" 1
447 1 37 ILE MG 1 80 GLN HG3 . . 6.260 5.488 4.553 6.324 0.064 4 0 "[ . 1 . 2]" 1
448 1 37 ILE MG 1 83 ASN QB . . 7.900 3.712 3.216 4.373 . 0 0 "[ . 1 . 2]" 1
449 1 37 ILE MG 1 84 ARG H . . 4.680 4.169 3.696 4.640 . 0 0 "[ . 1 . 2]" 1
450 1 37 ILE MG 1 84 ARG HA . . 4.860 2.515 1.814 3.181 . 0 0 "[ . 1 . 2]" 1
451 1 37 ILE MG 1 84 ARG QG . . 5.020 2.766 1.938 3.985 . 0 0 "[ . 1 . 2]" 1
452 1 37 ILE MG 1 87 ALA MB . . 6.670 2.961 2.369 3.664 . 0 0 "[ . 1 . 2]" 1
453 1 38 HIS H 1 38 HIS HB2 . . 3.440 3.111 2.947 3.338 . 0 0 "[ . 1 . 2]" 1
454 1 38 HIS H 1 38 HIS HB3 . . 3.440 2.596 2.423 2.817 . 0 0 "[ . 1 . 2]" 1
455 1 38 HIS H 1 39 LEU H . . 5.780 4.201 3.958 4.375 . 0 0 "[ . 1 . 2]" 1
456 1 38 HIS HA 1 38 HIS HD2 . . 4.990 3.250 2.620 3.588 . 0 0 "[ . 1 . 2]" 1
457 1 38 HIS HA 1 39 LEU H . . 2.870 2.167 2.130 2.225 . 0 0 "[ . 1 . 2]" 1
458 1 38 HIS HA 1 39 LEU MD1 . . 6.770 5.642 5.449 5.774 . 0 0 "[ . 1 . 2]" 1
459 1 38 HIS HB2 1 39 LEU H . . 4.340 4.323 4.076 4.440 0.100 16 0 "[ . 1 . 2]" 1
460 1 38 HIS HB2 1 73 LYS QG . . 5.910 4.058 2.992 5.431 . 0 0 "[ . 1 . 2]" 1
461 1 38 HIS HB3 1 39 LEU H . . 4.560 4.321 4.136 4.501 . 0 0 "[ . 1 . 2]" 1
462 1 38 HIS HB3 1 73 LYS QG . . 6.840 5.582 4.482 6.916 0.076 4 0 "[ . 1 . 2]" 1
463 1 38 HIS HD2 1 71 ILE MG . . 5.580 2.871 2.200 5.684 0.104 5 0 "[ . 1 . 2]" 1
464 1 38 HIS HD2 1 73 LYS HD2 . . 6.000 4.503 3.165 5.755 . 0 0 "[ . 1 . 2]" 1
465 1 38 HIS HD2 1 73 LYS HD3 . . 6.000 4.937 2.964 6.045 0.045 9 0 "[ . 1 . 2]" 1
466 1 39 LEU H 1 39 LEU HB2 . . 3.840 3.856 3.759 3.940 0.100 9 0 "[ . 1 . 2]" 1
467 1 39 LEU H 1 39 LEU HB3 . . 3.230 3.110 2.892 3.248 0.018 2 0 "[ . 1 . 2]" 1
468 1 39 LEU H 1 39 LEU MD1 . . 5.260 4.170 4.061 4.280 . 0 0 "[ . 1 . 2]" 1
469 1 39 LEU H 1 39 LEU MD2 . . 4.680 1.760 1.711 1.807 . 0 0 "[ . 1 . 2]" 1
470 1 39 LEU H 1 39 LEU HG . . 4.130 3.201 2.992 3.510 . 0 0 "[ . 1 . 2]" 1
471 1 39 LEU H 1 40 ARG H . . 6.000 4.419 4.358 4.509 . 0 0 "[ . 1 . 2]" 1
472 1 39 LEU H 1 72 ILE H . . 3.550 3.343 3.106 3.578 0.028 5 0 "[ . 1 . 2]" 1
473 1 39 LEU H 1 72 ILE HB . . 4.340 3.637 3.029 4.147 . 0 0 "[ . 1 . 2]" 1
474 1 39 LEU HA 1 39 LEU MD2 . . 4.390 3.596 3.549 3.667 . 0 0 "[ . 1 . 2]" 1
475 1 39 LEU HA 1 40 ARG H . . 2.870 2.255 2.200 2.298 . 0 0 "[ . 1 . 2]" 1
476 1 39 LEU HB2 1 40 ARG H . . 4.130 2.761 2.686 2.902 . 0 0 "[ . 1 . 2]" 1
477 1 39 LEU HB3 1 40 ARG H . . 4.200 3.988 3.924 4.093 . 0 0 "[ . 1 . 2]" 1
478 1 39 LEU MD1 1 40 ARG H . . 5.110 4.252 4.102 4.435 . 0 0 "[ . 1 . 2]" 1
479 1 39 LEU MD1 1 87 ALA H . . 6.550 5.351 4.891 5.713 . 0 0 "[ . 1 . 2]" 1
480 1 39 LEU MD1 1 87 ALA MB . . 5.910 2.765 2.218 3.164 . 0 0 "[ . 1 . 2]" 1
481 1 39 LEU MD1 1 88 ILE H . . 5.180 4.128 3.698 4.451 . 0 0 "[ . 1 . 2]" 1
482 1 39 LEU MD1 1 88 ILE HA . . 4.500 3.400 2.921 3.929 . 0 0 "[ . 1 . 2]" 1
483 1 39 LEU MD1 1 91 LEU HB3 . . 7.020 3.885 3.070 4.814 . 0 0 "[ . 1 . 2]" 1
484 1 39 LEU MD1 1 91 LEU MD1 . . 6.270 4.216 3.743 4.795 . 0 0 "[ . 1 . 2]" 1
485 1 39 LEU MD1 1 91 LEU QD . . 5.770 2.141 1.848 2.702 . 0 0 "[ . 1 . 2]" 1
486 1 39 LEU MD1 1 91 LEU MD2 . . 6.270 2.148 1.853 2.716 . 0 0 "[ . 1 . 2]" 1
487 1 39 LEU MD2 1 40 ARG H . . 4.970 4.643 4.489 4.753 . 0 0 "[ . 1 . 2]" 1
488 1 39 LEU MD2 1 40 ARG HA . . 5.040 4.893 4.555 5.076 0.036 18 0 "[ . 1 . 2]" 1
489 1 39 LEU MD2 1 87 ALA HA . . 5.900 3.769 3.352 4.181 . 0 0 "[ . 1 . 2]" 1
490 1 39 LEU MD2 1 87 ALA MB . . 5.700 1.842 1.747 1.944 . 0 0 "[ . 1 . 2]" 1
491 1 39 LEU MD2 1 88 ILE HA . . 5.870 4.680 3.871 5.352 . 0 0 "[ . 1 . 2]" 1
492 1 39 LEU MD2 1 91 LEU HB3 . . 6.080 4.484 3.783 5.130 . 0 0 "[ . 1 . 2]" 1
493 1 39 LEU HG 1 91 LEU QD . . 7.160 3.669 2.735 4.273 . 0 0 "[ . 1 . 2]" 1
494 1 40 ARG H 1 40 ARG HB2 . . 3.880 3.306 2.315 3.894 0.014 9 0 "[ . 1 . 2]" 1
495 1 40 ARG H 1 40 ARG QB . . 3.690 2.776 2.286 3.143 . 0 0 "[ . 1 . 2]" 1
496 1 40 ARG H 1 40 ARG HB3 . . 3.880 3.209 2.488 3.697 . 0 0 "[ . 1 . 2]" 1
497 1 40 ARG HA 1 41 PHE H . . 2.720 2.168 2.088 2.294 . 0 0 "[ . 1 . 2]" 1
498 1 40 ARG HA 1 69 VAL MG2 . . 5.620 3.438 2.980 4.033 . 0 0 "[ . 1 . 2]" 1
499 1 40 ARG HA 1 71 ILE HA . . 4.060 2.876 2.125 3.733 . 0 0 "[ . 1 . 2]" 1
500 1 40 ARG HA 1 71 ILE MD . . 5.690 3.283 2.005 4.052 . 0 0 "[ . 1 . 2]" 1
501 1 40 ARG HA 1 71 ILE MG . . 5.900 4.637 3.527 6.031 0.131 5 0 "[ . 1 . 2]" 1
502 1 40 ARG HA 1 72 ILE H . . 4.490 3.812 3.158 4.504 0.014 5 0 "[ . 1 . 2]" 1
503 1 40 ARG QB 1 69 VAL MG2 . . 4.190 2.649 1.916 3.765 . 0 0 "[ . 1 . 2]" 1
504 1 40 ARG QB 1 71 ILE MD . . 5.740 3.087 1.992 4.913 . 0 0 "[ . 1 . 2]" 1
505 1 40 ARG HB2 1 41 PHE H . . 4.420 3.684 2.652 4.511 0.091 8 0 "[ . 1 . 2]" 1
506 1 40 ARG HB2 1 69 VAL MG2 . . 4.360 3.126 1.931 4.389 0.029 11 0 "[ . 1 . 2]" 1
507 1 40 ARG HB3 1 41 PHE H . . 4.420 3.937 2.810 4.425 0.005 19 0 "[ . 1 . 2]" 1
508 1 40 ARG HB3 1 69 VAL MG2 . . 4.360 3.450 2.247 4.259 . 0 0 "[ . 1 . 2]" 1
509 1 40 ARG QD 1 71 ILE MD . . 6.140 3.566 2.259 4.920 . 0 0 "[ . 1 . 2]" 1
510 1 40 ARG HD2 1 69 VAL MG2 . . 5.870 3.623 2.254 5.103 . 0 0 "[ . 1 . 2]" 1
511 1 40 ARG HD3 1 69 VAL MG2 . . 5.870 4.019 2.742 5.132 . 0 0 "[ . 1 . 2]" 1
512 1 40 ARG QG 1 69 VAL MG2 . . 4.570 3.113 1.770 4.140 . 0 0 "[ . 1 . 2]" 1
513 1 40 ARG HG2 1 41 PHE H . . 6.000 4.511 2.260 5.582 . 0 0 "[ . 1 . 2]" 1
514 1 40 ARG HG2 1 69 VAL MG2 . . 4.860 3.742 2.086 4.981 0.121 13 0 "[ . 1 . 2]" 1
515 1 40 ARG HG2 1 71 ILE MD . . 5.870 4.100 2.413 5.713 . 0 0 "[ . 1 . 2]" 1
516 1 40 ARG HG3 1 41 PHE H . . 6.000 4.379 2.944 5.340 . 0 0 "[ . 1 . 2]" 1
517 1 40 ARG HG3 1 69 VAL MG2 . . 4.860 3.556 1.913 4.875 0.015 12 0 "[ . 1 . 2]" 1
518 1 40 ARG HG3 1 71 ILE MD . . 5.870 4.072 1.970 5.845 . 0 0 "[ . 1 . 2]" 1
519 1 41 PHE H 1 41 PHE HB2 . . 3.980 2.967 2.441 3.451 . 0 0 "[ . 1 . 2]" 1
520 1 41 PHE H 1 41 PHE QB . . 3.790 2.492 2.299 2.830 . 0 0 "[ . 1 . 2]" 1
521 1 41 PHE H 1 41 PHE HB3 . . 3.980 2.706 2.499 3.007 . 0 0 "[ . 1 . 2]" 1
522 1 41 PHE H 1 69 VAL MG2 . . 3.960 2.887 2.269 3.577 . 0 0 "[ . 1 . 2]" 1
523 1 41 PHE H 1 70 ILE HB . . 6.000 3.582 2.739 5.228 . 0 0 "[ . 1 . 2]" 1
524 1 41 PHE H 1 71 ILE MD . . 5.690 3.827 3.103 5.478 . 0 0 "[ . 1 . 2]" 1
525 1 41 PHE HA 1 42 ASP H . . 2.980 2.162 2.101 2.209 . 0 0 "[ . 1 . 2]" 1
526 1 41 PHE QB 1 70 ILE H . . 5.370 3.406 2.931 3.932 . 0 0 "[ . 1 . 2]" 1
527 1 41 PHE QB 1 70 ILE HB . . 5.400 2.728 1.787 4.845 . 0 0 "[ . 1 . 2]" 1
528 1 41 PHE QB 1 70 ILE MD . . 6.240 2.745 1.871 3.622 . 0 0 "[ . 1 . 2]" 1
529 1 41 PHE QB 1 91 LEU QD . . 6.720 3.173 2.613 3.968 . 0 0 "[ . 1 . 2]" 1
530 1 41 PHE HB2 1 42 ASP H . . 4.780 4.450 4.166 4.597 . 0 0 "[ . 1 . 2]" 1
531 1 41 PHE HB2 1 91 LEU MD1 . . 8.090 4.277 3.632 5.526 . 0 0 "[ . 1 . 2]" 1
532 1 41 PHE HB2 1 91 LEU MD2 . . 8.090 3.594 2.754 4.633 . 0 0 "[ . 1 . 2]" 1
533 1 41 PHE HB3 1 42 ASP H . . 4.780 4.329 4.091 4.440 . 0 0 "[ . 1 . 2]" 1
534 1 41 PHE HB3 1 91 LEU MD1 . . 8.090 4.525 3.701 5.280 . 0 0 "[ . 1 . 2]" 1
535 1 41 PHE HB3 1 91 LEU MD2 . . 8.090 4.334 3.640 5.268 . 0 0 "[ . 1 . 2]" 1
536 1 41 PHE QD 1 42 ASP H . . 8.130 3.892 3.273 4.148 . 0 0 "[ . 1 . 2]" 1
537 1 41 PHE QD 1 70 ILE HB . . 7.770 3.811 2.719 6.180 . 0 0 "[ . 1 . 2]" 1
538 1 41 PHE QD 1 70 ILE MD . . 6.700 2.293 1.802 3.327 . 0 0 "[ . 1 . 2]" 1
539 1 41 PHE QD 1 70 ILE MG . . 9.150 4.266 3.521 5.189 . 0 0 "[ . 1 . 2]" 1
540 1 41 PHE QD 1 91 LEU MD1 . . 8.680 3.887 3.085 5.196 . 0 0 "[ . 1 . 2]" 1
541 1 41 PHE QD 1 91 LEU QD . . 7.780 3.477 2.533 4.698 . 0 0 "[ . 1 . 2]" 1
542 1 41 PHE QD 1 91 LEU MD2 . . 8.680 4.027 2.693 5.359 . 0 0 "[ . 1 . 2]" 1
543 1 41 PHE QD 1 95 ILE MD . . 7.350 4.575 3.502 5.682 . 0 0 "[ . 1 . 2]" 1
544 1 41 PHE QE 1 43 ILE H . . 8.130 5.721 4.661 7.305 . 0 0 "[ . 1 . 2]" 1
545 1 41 PHE QE 1 43 ILE HA . . 7.200 4.383 2.925 6.080 . 0 0 "[ . 1 . 2]" 1
546 1 41 PHE QE 1 43 ILE MD . . 8.360 4.741 3.345 7.650 . 0 0 "[ . 1 . 2]" 1
547 1 41 PHE QE 1 43 ILE MG . . 7.890 5.284 3.251 7.160 . 0 0 "[ . 1 . 2]" 1
548 1 41 PHE QE 1 48 LEU MD1 . . 9.150 2.340 1.760 3.576 . 0 0 "[ . 1 . 2]" 1
549 1 41 PHE QE 1 56 LEU QD . . 9.620 3.617 2.379 5.567 . 0 0 "[ . 1 . 2]" 1
550 1 41 PHE HZ 1 48 LEU MD1 . . 5.470 3.078 1.799 5.487 0.017 14 0 "[ . 1 . 2]" 1
551 1 41 PHE HZ 1 48 LEU HG . . 5.960 3.891 2.580 4.845 . 0 0 "[ . 1 . 2]" 1
552 1 42 ASP H 1 42 ASP HB2 . . 3.660 3.216 2.736 3.790 0.130 5 0 "[ . 1 . 2]" 1
553 1 42 ASP H 1 42 ASP QB . . 3.430 2.542 2.307 3.035 . 0 0 "[ . 1 . 2]" 1
554 1 42 ASP H 1 42 ASP HB3 . . 3.660 2.675 2.383 3.193 . 0 0 "[ . 1 . 2]" 1
555 1 42 ASP H 1 43 ILE H . . 5.280 4.446 3.879 4.558 . 0 0 "[ . 1 . 2]" 1
556 1 42 ASP H 1 45 ALA MB . . 5.000 3.442 2.639 4.674 . 0 0 "[ . 1 . 2]" 1
557 1 42 ASP H 1 69 VAL MG1 . . 7.020 6.015 5.692 6.268 . 0 0 "[ . 1 . 2]" 1
558 1 42 ASP H 1 69 VAL MG2 . . 4.210 3.380 3.007 3.584 . 0 0 "[ . 1 . 2]" 1
559 1 42 ASP HA 1 43 ILE H . . 3.050 2.225 2.111 2.362 . 0 0 "[ . 1 . 2]" 1
560 1 42 ASP HA 1 69 VAL MG1 . . 5.690 4.487 4.255 4.765 . 0 0 "[ . 1 . 2]" 1
561 1 42 ASP HA 1 69 VAL MG2 . . 4.390 2.390 1.780 3.204 . 0 0 "[ . 1 . 2]" 1
562 1 42 ASP HA 1 70 ILE H . . 4.880 3.322 2.763 3.829 . 0 0 "[ . 1 . 2]" 1
563 1 42 ASP QB 1 45 ALA MB . . 5.310 2.845 1.939 4.168 . 0 0 "[ . 1 . 2]" 1
564 1 42 ASP QB 1 69 VAL MG1 . . 5.590 4.059 3.181 4.494 . 0 0 "[ . 1 . 2]" 1
565 1 42 ASP QB 1 69 VAL MG2 . . 6.090 2.251 1.815 2.717 . 0 0 "[ . 1 . 2]" 1
566 1 42 ASP HB2 1 45 ALA MB . . 5.760 3.943 2.296 4.617 . 0 0 "[ . 1 . 2]" 1
567 1 42 ASP HB2 1 69 VAL MG1 . . 5.900 4.437 4.000 5.428 . 0 0 "[ . 1 . 2]" 1
568 1 42 ASP HB2 1 69 VAL MG2 . . 6.230 2.742 2.165 4.014 . 0 0 "[ . 1 . 2]" 1
569 1 42 ASP HB3 1 45 ALA MB . . 5.760 3.085 1.952 4.947 . 0 0 "[ . 1 . 2]" 1
570 1 42 ASP HB3 1 69 VAL MG1 . . 5.900 5.129 3.339 5.968 0.068 3 0 "[ . 1 . 2]" 1
571 1 42 ASP HB3 1 69 VAL MG2 . . 6.230 3.129 1.825 3.966 . 0 0 "[ . 1 . 2]" 1
572 1 43 ILE H 1 43 ILE HB . . 3.440 2.488 2.250 2.786 . 0 0 "[ . 1 . 2]" 1
573 1 43 ILE H 1 43 ILE MD . . 4.720 2.560 1.775 3.485 . 0 0 "[ . 1 . 2]" 1
574 1 43 ILE H 1 43 ILE MG . . 4.350 3.737 3.644 3.803 . 0 0 "[ . 1 . 2]" 1
575 1 43 ILE H 1 44 ARG H . . 3.910 2.585 2.227 2.794 . 0 0 "[ . 1 . 2]" 1
576 1 43 ILE HA 1 46 SER H . . 4.160 3.767 3.424 4.150 . 0 0 "[ . 1 . 2]" 1
577 1 43 ILE MD 1 44 ARG H . . 4.250 4.083 3.150 4.365 0.115 10 0 "[ . 1 . 2]" 1
578 1 43 ILE MD 1 53 LYS HA . . 5.330 4.137 2.082 5.419 0.089 16 0 "[ . 1 . 2]" 1
579 1 43 ILE MD 1 56 LEU HB2 . . 4.790 3.338 1.820 4.192 . 0 0 "[ . 1 . 2]" 1
580 1 43 ILE MD 1 56 LEU QB . . 4.580 2.814 1.769 3.837 . 0 0 "[ . 1 . 2]" 1
581 1 43 ILE MD 1 56 LEU HB3 . . 4.790 3.122 1.835 4.600 . 0 0 "[ . 1 . 2]" 1
582 1 43 ILE MD 1 69 VAL HA . . 6.440 3.653 2.386 5.223 . 0 0 "[ . 1 . 2]" 1
583 1 43 ILE MD 1 70 ILE H . . 6.590 4.594 3.132 6.625 0.035 5 0 "[ . 1 . 2]" 1
584 1 43 ILE QG 1 44 ARG H . . 6.020 4.231 3.778 4.576 . 0 0 "[ . 1 . 2]" 1
585 1 43 ILE MG 1 44 ARG H . . 4.070 3.348 2.928 3.837 . 0 0 "[ . 1 . 2]" 1
586 1 43 ILE MG 1 53 LYS HA . . 4.390 3.475 2.365 4.366 . 0 0 "[ . 1 . 2]" 1
587 1 43 ILE MG 1 56 LEU QB . . 5.380 4.343 3.192 5.396 0.016 13 0 "[ . 1 . 2]" 1
588 1 44 ARG H 1 44 ARG QB . . 3.790 2.261 2.050 2.485 . 0 0 "[ . 1 . 2]" 1
589 1 44 ARG H 1 45 ALA H . . 3.260 2.666 2.514 3.053 . 0 0 "[ . 1 . 2]" 1
590 1 44 ARG H 1 46 SER H . . 4.600 4.226 3.929 4.621 0.021 5 0 "[ . 1 . 2]" 1
591 1 44 ARG QB 1 45 ALA H . . 4.400 2.910 2.520 3.403 . 0 0 "[ . 1 . 2]" 1
592 1 45 ALA H 1 45 ALA MB . . 3.420 2.257 2.225 2.343 . 0 0 "[ . 1 . 2]" 1
593 1 45 ALA H 1 46 SER H . . 2.830 2.573 2.327 2.884 0.054 5 0 "[ . 1 . 2]" 1
594 1 45 ALA MB 1 46 SER H . . 3.740 2.927 2.180 3.287 . 0 0 "[ . 1 . 2]" 1
595 1 46 SER H 1 46 SER HB2 . . 3.590 3.158 2.449 3.920 0.330 18 0 "[ . 1 . 2]" 1
596 1 46 SER H 1 46 SER QB . . 3.350 2.761 2.357 3.090 . 0 0 "[ . 1 . 2]" 1
597 1 46 SER H 1 46 SER HB3 . . 3.590 3.242 2.594 3.833 0.243 14 0 "[ . 1 . 2]" 1
598 1 46 SER H 1 47 GLY H . . 4.270 4.220 2.231 4.510 0.240 15 0 "[ . 1 . 2]" 1
599 1 46 SER HA 1 47 GLY H . . 3.080 2.602 2.026 3.234 0.154 11 0 "[ . 1 . 2]" 1
600 1 46 SER QB 1 47 GLY H . . 3.940 2.648 1.829 3.745 . 0 0 "[ . 1 . 2]" 1
601 1 46 SER HB2 1 47 GLY H . . 4.130 3.214 1.920 4.206 0.076 3 0 "[ . 1 . 2]" 1
602 1 46 SER HB3 1 47 GLY H . . 4.130 3.151 1.856 4.200 0.070 3 0 "[ . 1 . 2]" 1
603 1 47 GLY H 1 48 LEU H . . 3.770 3.196 2.332 3.865 0.095 14 0 "[ . 1 . 2]" 1
604 1 48 LEU H 1 48 LEU HB2 . . 3.300 2.459 2.383 2.511 . 0 0 "[ . 1 . 2]" 1
605 1 48 LEU H 1 48 LEU HB3 . . 3.730 3.590 3.577 3.601 . 0 0 "[ . 1 . 2]" 1
606 1 48 LEU H 1 48 LEU MD1 . . 4.070 3.649 3.489 3.756 . 0 0 "[ . 1 . 2]" 1
607 1 48 LEU H 1 48 LEU MD2 . . 4.100 3.352 3.196 3.547 . 0 0 "[ . 1 . 2]" 1
608 1 48 LEU H 1 48 LEU HG . . 3.340 2.352 2.194 2.488 . 0 0 "[ . 1 . 2]" 1
609 1 48 LEU HA 1 48 LEU MD2 . . 3.920 2.020 1.918 2.096 . 0 0 "[ . 1 . 2]" 1
610 1 48 LEU MD1 1 52 TYR HB2 . . 5.690 4.036 3.153 5.396 . 0 0 "[ . 1 . 2]" 1
611 1 48 LEU MD1 1 52 TYR HB3 . . 5.800 3.567 2.398 4.640 . 0 0 "[ . 1 . 2]" 1
612 1 48 LEU MD1 1 52 TYR QD . . 9.150 4.264 1.792 5.475 . 0 0 "[ . 1 . 2]" 1
613 1 48 LEU MD1 1 52 TYR QE . . 8.940 5.627 2.109 7.149 . 0 0 "[ . 1 . 2]" 1
614 1 48 LEU MD2 1 49 PRO HD2 . . 4.820 3.054 2.634 3.295 . 0 0 "[ . 1 . 2]" 1
615 1 48 LEU MD2 1 49 PRO QD . . 4.580 2.695 2.451 2.832 . 0 0 "[ . 1 . 2]" 1
616 1 48 LEU MD2 1 49 PRO HD3 . . 4.820 3.050 2.731 3.561 . 0 0 "[ . 1 . 2]" 1
617 1 48 LEU MD2 1 52 TYR HB2 . . 7.020 4.246 3.449 5.242 . 0 0 "[ . 1 . 2]" 1
618 1 48 LEU MD2 1 52 TYR HB3 . . 6.080 4.254 3.386 5.319 . 0 0 "[ . 1 . 2]" 1
619 1 48 LEU MD2 1 52 TYR QD . . 7.810 4.299 2.525 5.469 . 0 0 "[ . 1 . 2]" 1
620 1 48 LEU MD2 1 52 TYR QE . . 8.680 5.179 2.778 6.596 . 0 0 "[ . 1 . 2]" 1
621 1 49 PRO HA 1 50 GLU H . . 3.300 2.276 2.161 2.404 . 0 0 "[ . 1 . 2]" 1
622 1 49 PRO QB 1 51 TYR H . . 4.020 2.950 2.567 3.365 . 0 0 "[ . 1 . 2]" 1
623 1 49 PRO QB 1 51 TYR QD . . 9.010 4.062 2.629 5.099 . 0 0 "[ . 1 . 2]" 1
624 1 49 PRO QB 1 52 TYR H . . 4.290 2.764 2.334 3.076 . 0 0 "[ . 1 . 2]" 1
625 1 49 PRO HB2 1 51 TYR H . . 4.380 3.080 2.635 3.563 . 0 0 "[ . 1 . 2]" 1
626 1 49 PRO HB2 1 52 TYR H . . 4.560 2.793 2.351 3.121 . 0 0 "[ . 1 . 2]" 1
627 1 49 PRO HB2 1 52 TYR QD . . 8.130 2.485 1.741 5.220 . 0 0 "[ . 1 . 2]" 1
628 1 49 PRO HB3 1 51 TYR H . . 4.380 3.833 3.472 4.315 . 0 0 "[ . 1 . 2]" 1
629 1 49 PRO HB3 1 52 TYR H . . 4.560 4.421 3.956 4.639 0.079 15 0 "[ . 1 . 2]" 1
630 1 49 PRO HB3 1 52 TYR QD . . 8.130 4.015 3.177 6.445 . 0 0 "[ . 1 . 2]" 1
631 1 49 PRO QD 1 52 TYR H . . 6.170 4.065 3.575 4.918 . 0 0 "[ . 1 . 2]" 1
632 1 49 PRO QG 1 52 TYR QD . . 9.020 2.843 1.788 4.655 . 0 0 "[ . 1 . 2]" 1
633 1 50 GLU H 1 50 GLU HB2 . . 3.950 2.892 2.221 3.618 . 0 0 "[ . 1 . 2]" 1
634 1 50 GLU H 1 50 GLU QB . . 3.790 2.466 2.138 2.729 . 0 0 "[ . 1 . 2]" 1
635 1 50 GLU H 1 50 GLU HB3 . . 3.950 3.094 2.468 3.609 . 0 0 "[ . 1 . 2]" 1
636 1 50 GLU H 1 51 TYR H . . 5.100 2.739 2.575 2.998 . 0 0 "[ . 1 . 2]" 1
637 1 50 GLU HA 1 53 LYS H . . 3.880 3.331 2.788 3.910 0.030 8 0 "[ . 1 . 2]" 1
638 1 50 GLU QB 1 51 TYR H . . 3.780 2.931 2.343 3.583 . 0 0 "[ . 1 . 2]" 1
639 1 50 GLU HB2 1 51 TYR H . . 4.060 3.249 2.391 4.125 0.065 3 0 "[ . 1 . 2]" 1
640 1 50 GLU HB3 1 51 TYR H . . 4.060 3.675 2.581 4.144 0.084 7 0 "[ . 1 . 2]" 1
641 1 50 GLU QG 1 51 TYR HA . . 6.880 4.712 3.245 5.874 . 0 0 "[ . 1 . 2]" 1
642 1 51 TYR H 1 51 TYR HB2 . . 3.440 2.391 2.166 2.613 . 0 0 "[ . 1 . 2]" 1
643 1 51 TYR H 1 51 TYR HB3 . . 3.440 3.158 2.481 3.568 0.128 9 0 "[ . 1 . 2]" 1
644 1 51 TYR H 1 52 TYR H . . 3.620 2.743 2.591 2.880 . 0 0 "[ . 1 . 2]" 1
645 1 51 TYR HA 1 55 ARG H . . 4.700 4.548 4.092 4.745 0.045 12 0 "[ . 1 . 2]" 1
646 1 51 TYR QB 1 52 TYR H . . 3.430 2.596 2.329 2.968 . 0 0 "[ . 1 . 2]" 1
647 1 51 TYR HB2 1 52 TYR H . . 3.800 3.188 2.402 3.874 0.074 1 0 "[ . 1 . 2]" 1
648 1 51 TYR HB3 1 52 TYR H . . 3.800 3.126 2.407 3.799 . 0 0 "[ . 1 . 2]" 1
649 1 51 TYR QD 1 52 TYR H . . 7.590 4.008 3.175 4.617 . 0 0 "[ . 1 . 2]" 1
650 1 51 TYR QD 1 52 TYR HA . . 8.130 4.936 3.142 5.986 . 0 0 "[ . 1 . 2]" 1
651 1 52 TYR H 1 52 TYR HB2 . . 3.190 2.359 2.137 2.522 . 0 0 "[ . 1 . 2]" 1
652 1 52 TYR H 1 52 TYR HB3 . . 3.440 3.448 2.519 3.578 0.138 2 0 "[ . 1 . 2]" 1
653 1 52 TYR H 1 53 LYS H . . 3.080 2.473 2.253 2.702 . 0 0 "[ . 1 . 2]" 1
654 1 52 TYR H 1 99 THR MG . . 5.540 5.157 3.984 5.629 0.089 14 0 "[ . 1 . 2]" 1
655 1 52 TYR HA 1 55 ARG H . . 3.770 3.560 3.212 3.826 0.056 11 0 "[ . 1 . 2]" 1
656 1 52 TYR HA 1 99 THR MG . . 5.330 3.467 2.097 5.002 . 0 0 "[ . 1 . 2]" 1
657 1 52 TYR HB2 1 53 LYS H . . 3.620 2.780 2.452 3.717 0.097 1 0 "[ . 1 . 2]" 1
658 1 52 TYR HB3 1 53 LYS H . . 3.800 3.424 2.419 3.791 . 0 0 "[ . 1 . 2]" 1
659 1 52 TYR QD 1 53 LYS H . . 8.130 4.116 3.670 4.575 . 0 0 "[ . 1 . 2]" 1
660 1 52 TYR QD 1 56 LEU QD . . 10.080 3.878 2.538 4.682 . 0 0 "[ . 1 . 2]" 1
661 1 52 TYR QD 1 99 THR MG . . 9.150 2.821 1.776 4.190 . 0 0 "[ . 1 . 2]" 1
662 1 52 TYR QE 1 95 ILE MG . . 6.810 2.886 1.957 5.978 . 0 0 "[ . 1 . 2]" 1
663 1 53 LYS H 1 54 GLN H . . 3.190 2.797 2.574 3.042 . 0 0 "[ . 1 . 2]" 1
664 1 53 LYS HA 1 56 LEU H . . 4.990 3.617 3.231 3.915 . 0 0 "[ . 1 . 2]" 1
665 1 53 LYS HA 1 56 LEU MD1 . . 4.970 2.420 1.817 2.927 . 0 0 "[ . 1 . 2]" 1
666 1 53 LYS HA 1 56 LEU QD . . 4.520 2.412 1.815 2.908 . 0 0 "[ . 1 . 2]" 1
667 1 53 LYS HA 1 56 LEU MD2 . . 4.970 4.696 4.146 5.007 0.037 5 0 "[ . 1 . 2]" 1
668 1 54 GLN H 1 54 GLN HB2 . . 3.840 2.519 2.190 3.619 . 0 0 "[ . 1 . 2]" 1
669 1 54 GLN H 1 54 GLN QB . . 3.610 2.425 2.168 2.521 . 0 0 "[ . 1 . 2]" 1
670 1 54 GLN H 1 54 GLN HB3 . . 3.840 3.536 2.558 3.618 . 0 0 "[ . 1 . 2]" 1
671 1 54 GLN H 1 54 GLN HG2 . . 3.590 2.630 2.096 3.620 0.030 15 0 "[ . 1 . 2]" 1
672 1 54 GLN H 1 54 GLN QG . . 3.270 2.283 2.082 3.316 0.046 6 0 "[ . 1 . 2]" 1
673 1 54 GLN H 1 54 GLN HG3 . . 3.590 3.291 2.206 3.888 0.298 6 0 "[ . 1 . 2]" 1
674 1 54 GLN H 1 55 ARG H . . 3.160 2.714 2.579 2.901 . 0 0 "[ . 1 . 2]" 1
675 1 54 GLN HA 1 57 LEU MD1 . . 6.880 4.277 2.774 6.440 . 0 0 "[ . 1 . 2]" 1
676 1 54 GLN HA 1 57 LEU QD . . 5.780 3.252 2.624 4.310 . 0 0 "[ . 1 . 2]" 1
677 1 54 GLN HA 1 57 LEU MD2 . . 6.880 4.399 2.631 5.329 . 0 0 "[ . 1 . 2]" 1
678 1 54 GLN QB 1 55 ARG H . . 3.490 2.592 2.287 3.407 . 0 0 "[ . 1 . 2]" 1
679 1 54 GLN HB2 1 55 ARG H . . 3.770 2.670 2.326 3.780 0.010 19 0 "[ . 1 . 2]" 1
680 1 54 GLN HB3 1 55 ARG H . . 3.770 3.597 3.342 3.872 0.102 19 0 "[ . 1 . 2]" 1
681 1 54 GLN QG 1 55 ARG H . . 5.370 3.994 2.111 4.518 . 0 0 "[ . 1 . 2]" 1
682 1 54 GLN HG2 1 55 ARG H . . 5.860 4.435 2.401 5.095 . 0 0 "[ . 1 . 2]" 1
683 1 54 GLN HG3 1 55 ARG H . . 5.860 4.654 2.341 5.120 . 0 0 "[ . 1 . 2]" 1
684 1 55 ARG H 1 55 ARG HB2 . . 3.230 2.451 2.251 2.643 . 0 0 "[ . 1 . 2]" 1
685 1 55 ARG H 1 55 ARG HB3 . . 3.620 3.568 3.520 3.616 . 0 0 "[ . 1 . 2]" 1
686 1 55 ARG H 1 55 ARG HD2 . . 5.640 4.619 4.094 5.068 . 0 0 "[ . 1 . 2]" 1
687 1 55 ARG H 1 55 ARG QD . . 5.030 3.923 3.329 4.257 . 0 0 "[ . 1 . 2]" 1
688 1 55 ARG H 1 55 ARG HD3 . . 5.640 4.337 3.438 4.888 . 0 0 "[ . 1 . 2]" 1
689 1 55 ARG H 1 55 ARG HG2 . . 3.230 2.466 1.866 3.312 0.082 11 0 "[ . 1 . 2]" 1
690 1 55 ARG H 1 55 ARG HG3 . . 3.190 3.086 2.188 3.418 0.228 17 0 "[ . 1 . 2]" 1
691 1 55 ARG H 1 56 LEU H . . 3.120 2.678 2.505 2.793 . 0 0 "[ . 1 . 2]" 1
692 1 55 ARG HA 1 55 ARG HD2 . . 5.530 3.868 3.113 4.803 . 0 0 "[ . 1 . 2]" 1
693 1 55 ARG HA 1 55 ARG HD3 . . 5.530 2.971 2.121 4.436 . 0 0 "[ . 1 . 2]" 1
694 1 55 ARG HA 1 55 ARG HG2 . . 4.130 2.667 2.348 3.078 . 0 0 "[ . 1 . 2]" 1
695 1 55 ARG HB2 1 56 LEU H . . 3.160 2.773 2.406 3.081 . 0 0 "[ . 1 . 2]" 1
696 1 55 ARG HB3 1 56 LEU H . . 4.020 3.737 3.508 4.030 0.010 4 0 "[ . 1 . 2]" 1
697 1 56 LEU H 1 56 LEU HB2 . . 3.840 2.464 2.382 2.531 . 0 0 "[ . 1 . 2]" 1
698 1 56 LEU H 1 56 LEU HB3 . . 3.840 3.588 3.575 3.600 . 0 0 "[ . 1 . 2]" 1
699 1 56 LEU H 1 56 LEU MD1 . . 4.720 3.589 3.430 3.699 . 0 0 "[ . 1 . 2]" 1
700 1 56 LEU H 1 56 LEU QD . . 4.050 3.091 2.967 3.185 . 0 0 "[ . 1 . 2]" 1
701 1 56 LEU H 1 56 LEU MD2 . . 4.720 3.383 3.152 3.660 . 0 0 "[ . 1 . 2]" 1
702 1 56 LEU H 1 56 LEU HG . . 3.700 2.313 2.182 2.480 . 0 0 "[ . 1 . 2]" 1
703 1 56 LEU H 1 57 LEU H . . 3.370 2.613 2.492 2.797 . 0 0 "[ . 1 . 2]" 1
704 1 56 LEU HA 1 56 LEU QD . . 4.150 2.022 1.952 2.111 . 0 0 "[ . 1 . 2]" 1
705 1 56 LEU HA 1 58 THR H . . 4.850 4.293 3.873 4.745 . 0 0 "[ . 1 . 2]" 1
706 1 56 LEU HA 1 59 ALA H . . 4.090 3.932 3.646 4.161 0.071 4 0 "[ . 1 . 2]" 1
707 1 56 LEU HA 1 59 ALA MB . . 4.210 3.609 2.840 3.955 . 0 0 "[ . 1 . 2]" 1
708 1 56 LEU HA 1 64 ILE MD . . 5.330 3.898 3.299 4.847 . 0 0 "[ . 1 . 2]" 1
709 1 56 LEU HA 1 98 LEU MD1 . . 7.020 4.220 2.440 5.842 . 0 0 "[ . 1 . 2]" 1
710 1 56 LEU HA 1 98 LEU QD . . 6.250 2.339 1.771 5.431 . 0 0 "[ . 1 . 2]" 1
711 1 56 LEU HA 1 98 LEU MD2 . . 7.020 2.656 1.774 6.457 . 0 0 "[ . 1 . 2]" 1
712 1 56 LEU QB 1 57 LEU H . . 3.950 2.741 2.575 2.858 . 0 0 "[ . 1 . 2]" 1
713 1 56 LEU HB2 1 57 LEU H . . 4.240 2.814 2.629 2.944 . 0 0 "[ . 1 . 2]" 1
714 1 56 LEU HB3 1 57 LEU H . . 4.240 3.778 3.561 3.909 . 0 0 "[ . 1 . 2]" 1
715 1 56 LEU QD 1 57 LEU H . . 8.570 4.171 4.071 4.239 . 0 0 "[ . 1 . 2]" 1
716 1 56 LEU QD 1 95 ILE MD . . 6.060 4.032 3.156 4.841 . 0 0 "[ . 1 . 2]" 1
717 1 56 LEU MD1 1 95 ILE MD . . 7.000 4.604 3.458 5.736 . 0 0 "[ . 1 . 2]" 1
718 1 56 LEU MD2 1 95 ILE MD . . 7.000 4.493 3.545 5.478 . 0 0 "[ . 1 . 2]" 1
719 1 56 LEU HG 1 57 LEU H . . 4.810 4.433 4.275 4.570 . 0 0 "[ . 1 . 2]" 1
720 1 57 LEU H 1 57 LEU HB2 . . 3.050 2.378 2.231 2.470 . 0 0 "[ . 1 . 2]" 1
721 1 57 LEU H 1 57 LEU HB3 . . 3.700 3.593 3.516 3.637 . 0 0 "[ . 1 . 2]" 1
722 1 57 LEU H 1 57 LEU MD1 . . 4.250 3.755 3.528 3.910 . 0 0 "[ . 1 . 2]" 1
723 1 57 LEU H 1 57 LEU QD . . 3.840 2.815 2.187 3.249 . 0 0 "[ . 1 . 2]" 1
724 1 57 LEU H 1 57 LEU MD2 . . 4.250 2.975 2.208 3.542 . 0 0 "[ . 1 . 2]" 1
725 1 57 LEU H 1 57 LEU HG . . 4.490 3.281 2.453 4.233 . 0 0 "[ . 1 . 2]" 1
726 1 57 LEU H 1 58 THR H . . 3.120 2.384 2.265 2.662 . 0 0 "[ . 1 . 2]" 1
727 1 57 LEU H 1 59 ALA H . . 4.380 4.136 3.958 4.382 0.002 18 0 "[ . 1 . 2]" 1
728 1 57 LEU HA 1 57 LEU MD1 . . 4.680 2.951 1.819 3.861 . 0 0 "[ . 1 . 2]" 1
729 1 57 LEU HA 1 57 LEU QD . . 3.980 1.903 1.792 1.994 . 0 0 "[ . 1 . 2]" 1
730 1 57 LEU HA 1 57 LEU MD2 . . 4.680 2.316 1.901 2.992 . 0 0 "[ . 1 . 2]" 1
731 1 57 LEU HB2 1 58 THR H . . 3.770 3.059 2.531 3.401 . 0 0 "[ . 1 . 2]" 1
732 1 57 LEU HB3 1 58 THR H . . 4.020 3.833 3.334 4.056 0.036 2 0 "[ . 1 . 2]" 1
733 1 57 LEU QD 1 58 THR H . . 4.990 4.076 3.740 4.319 . 0 0 "[ . 1 . 2]" 1
734 1 57 LEU QD 1 68 GLY H . . 6.120 4.045 2.175 5.403 . 0 0 "[ . 1 . 2]" 1
735 1 57 LEU QD 1 68 GLY QA . . 6.330 2.445 1.799 3.168 . 0 0 "[ . 1 . 2]" 1
736 1 57 LEU MD1 1 58 THR H . . 5.510 4.777 4.477 5.058 . 0 0 "[ . 1 . 2]" 1
737 1 57 LEU MD1 1 68 GLY HA2 . . 7.990 4.144 1.922 5.716 . 0 0 "[ . 1 . 2]" 1
738 1 57 LEU MD1 1 68 GLY HA3 . . 7.990 3.910 2.251 5.240 . 0 0 "[ . 1 . 2]" 1
739 1 57 LEU MD2 1 58 THR H . . 5.510 4.438 3.949 4.720 . 0 0 "[ . 1 . 2]" 1
740 1 57 LEU MD2 1 68 GLY HA2 . . 7.990 3.405 2.031 5.062 . 0 0 "[ . 1 . 2]" 1
741 1 57 LEU MD2 1 68 GLY HA3 . . 7.990 3.294 1.920 5.223 . 0 0 "[ . 1 . 2]" 1
742 1 58 THR H 1 58 THR HB . . 3.840 3.277 2.428 3.643 . 0 0 "[ . 1 . 2]" 1
743 1 58 THR H 1 58 THR MG . . 3.600 3.014 2.540 3.772 0.172 18 0 "[ . 1 . 2]" 1
744 1 58 THR H 1 59 ALA H . . 2.900 2.442 2.165 2.705 . 0 0 "[ . 1 . 2]" 1
745 1 58 THR H 1 59 ALA MB . . 5.430 4.216 3.948 4.504 . 0 0 "[ . 1 . 2]" 1
746 1 58 THR HA 1 58 THR HB . . 2.870 2.697 2.516 3.006 0.136 12 0 "[ . 1 . 2]" 1
747 1 58 THR HA 1 58 THR MG . . 3.490 2.281 2.201 2.429 . 0 0 "[ . 1 . 2]" 1
748 1 58 THR HB 1 59 ALA H . . 3.660 3.221 2.020 3.677 0.017 16 0 "[ . 1 . 2]" 1
749 1 58 THR MG 1 59 ALA H . . 4.610 3.878 3.234 4.207 . 0 0 "[ . 1 . 2]" 1
750 1 59 ALA H 1 59 ALA MB . . 3.420 2.351 2.236 2.874 . 0 0 "[ . 1 . 2]" 1
751 1 59 ALA H 1 60 SER H . . 5.460 4.250 3.862 4.622 . 0 0 "[ . 1 . 2]" 1
752 1 59 ALA HA 1 60 SER H . . 2.800 2.228 2.109 2.732 . 0 0 "[ . 1 . 2]" 1
753 1 59 ALA MB 1 60 SER HA . . 6.150 4.356 3.679 4.599 . 0 0 "[ . 1 . 2]" 1
754 1 59 ALA MB 1 61 HIS H . . 5.580 3.786 2.472 5.204 . 0 0 "[ . 1 . 2]" 1
755 1 59 ALA MB 1 61 HIS HB2 . . 5.790 3.651 2.850 4.781 . 0 0 "[ . 1 . 2]" 1
756 1 59 ALA MB 1 61 HIS QB . . 5.600 3.551 2.787 4.546 . 0 0 "[ . 1 . 2]" 1
757 1 59 ALA MB 1 61 HIS HB3 . . 5.790 4.916 3.935 5.815 0.025 13 0 "[ . 1 . 2]" 1
758 1 59 ALA MB 1 61 HIS HD2 . . 5.870 5.624 4.394 6.001 0.131 9 0 "[ . 1 . 2]" 1
759 1 59 ALA MB 1 64 ILE MD . . 6.780 4.708 2.240 5.538 . 0 0 "[ . 1 . 2]" 1
760 1 59 ALA MB 1 98 LEU HA . . 4.890 3.944 2.972 4.928 0.038 5 0 "[ . 1 . 2]" 1
761 1 59 ALA MB 1 98 LEU MD1 . . 5.770 2.713 1.792 3.575 . 0 0 "[ . 1 . 2]" 1
762 1 59 ALA MB 1 98 LEU QD . . 5.400 2.085 1.788 2.496 . 0 0 "[ . 1 . 2]" 1
763 1 59 ALA MB 1 98 LEU MD2 . . 5.770 2.570 1.866 3.914 . 0 0 "[ . 1 . 2]" 1
764 1 60 SER H 1 60 SER HB2 . . 3.700 2.706 2.508 3.545 . 0 0 "[ . 1 . 2]" 1
765 1 60 SER H 1 60 SER QB . . 3.370 2.533 2.285 2.926 . 0 0 "[ . 1 . 2]" 1
766 1 60 SER H 1 60 SER HB3 . . 3.700 3.361 2.566 3.630 . 0 0 "[ . 1 . 2]" 1
767 1 60 SER H 1 61 HIS H . . 5.780 3.776 1.788 4.555 . 0 0 "[ . 1 . 2]" 1
768 1 60 SER HA 1 61 HIS H . . 2.800 2.358 2.130 2.928 0.128 7 0 "[ . 1 . 2]" 1
769 1 60 SER QB 1 61 HIS H . . 4.370 3.766 3.112 4.037 . 0 0 "[ . 1 . 2]" 1
770 1 60 SER HB2 1 61 HIS H . . 4.670 4.426 4.009 4.627 . 0 0 "[ . 1 . 2]" 1
771 1 60 SER HB3 1 61 HIS H . . 4.670 4.101 3.243 4.605 . 0 0 "[ . 1 . 2]" 1
772 1 61 HIS H 1 61 HIS HB2 . . 3.730 2.457 2.091 2.828 . 0 0 "[ . 1 . 2]" 1
773 1 61 HIS H 1 61 HIS QB . . 3.550 2.348 2.053 2.759 . 0 0 "[ . 1 . 2]" 1
774 1 61 HIS H 1 61 HIS HB3 . . 3.730 3.137 2.585 3.842 0.112 7 0 "[ . 1 . 2]" 1
775 1 61 HIS H 1 64 ILE H . . 4.560 4.222 3.353 4.646 0.086 16 0 "[ . 1 . 2]" 1
776 1 61 HIS H 1 64 ILE HB . . 5.420 3.942 2.804 5.125 . 0 0 "[ . 1 . 2]" 1
777 1 61 HIS H 1 64 ILE MD . . 5.040 4.316 3.228 5.000 . 0 0 "[ . 1 . 2]" 1
778 1 61 HIS H 1 64 ILE MG . . 5.790 4.731 3.858 5.789 . 0 0 "[ . 1 . 2]" 1
779 1 61 HIS HA 1 62 HIS H . . 3.480 2.413 2.166 3.530 0.050 12 0 "[ . 1 . 2]" 1
780 1 61 HIS HA 1 98 LEU QD . . 8.570 4.841 4.084 6.041 . 0 0 "[ . 1 . 2]" 1
781 1 61 HIS QB 1 64 ILE MD . . 5.760 3.576 2.892 4.700 . 0 0 "[ . 1 . 2]" 1
782 1 61 HIS QB 1 98 LEU QD . . 5.920 2.904 2.096 4.577 . 0 0 "[ . 1 . 2]" 1
783 1 61 HIS HB2 1 62 HIS H . . 5.210 4.231 3.774 4.486 . 0 0 "[ . 1 . 2]" 1
784 1 61 HIS HB2 1 64 ILE MD . . 6.410 4.206 3.074 5.577 . 0 0 "[ . 1 . 2]" 1
785 1 61 HIS HB2 1 98 LEU MD1 . . 6.660 3.376 2.190 5.958 . 0 0 "[ . 1 . 2]" 1
786 1 61 HIS HB2 1 98 LEU MD2 . . 6.660 3.680 2.377 5.197 . 0 0 "[ . 1 . 2]" 1
787 1 61 HIS HB3 1 62 HIS H . . 5.210 3.354 2.507 4.042 . 0 0 "[ . 1 . 2]" 1
788 1 61 HIS HB3 1 64 ILE MD . . 6.410 4.095 3.198 5.888 . 0 0 "[ . 1 . 2]" 1
789 1 61 HIS HB3 1 98 LEU MD1 . . 6.660 4.242 2.352 6.346 . 0 0 "[ . 1 . 2]" 1
790 1 61 HIS HB3 1 98 LEU MD2 . . 6.660 4.425 3.026 6.155 . 0 0 "[ . 1 . 2]" 1
791 1 61 HIS HD2 1 94 VAL MG1 . . 5.330 2.756 1.771 3.978 . 0 0 "[ . 1 . 2]" 1
792 1 61 HIS HD2 1 94 VAL MG2 . . 3.990 3.515 2.033 4.098 0.108 19 0 "[ . 1 . 2]" 1
793 1 61 HIS HD2 1 98 LEU MD1 . . 5.830 3.859 1.930 5.283 . 0 0 "[ . 1 . 2]" 1
794 1 61 HIS HD2 1 98 LEU QD . . 4.800 3.378 1.926 4.798 . 0 0 "[ . 1 . 2]" 1
795 1 61 HIS HD2 1 98 LEU MD2 . . 5.830 4.526 2.545 5.796 . 0 0 "[ . 1 . 2]" 1
796 1 62 HIS H 1 62 HIS HA . . 2.870 2.785 2.259 2.906 0.036 19 0 "[ . 1 . 2]" 1
797 1 62 HIS HA 1 63 LEU QD . . 8.210 4.688 3.657 5.218 . 0 0 "[ . 1 . 2]" 1
798 1 62 HIS HD2 1 63 LEU H . . 4.200 4.152 3.281 4.406 0.206 5 0 "[ . 1 . 2]" 1
799 1 63 LEU H 1 63 LEU QB . . 3.800 2.432 2.271 2.741 . 0 0 "[ . 1 . 2]" 1
800 1 63 LEU H 1 63 LEU MD1 . . 5.330 3.106 1.889 4.395 . 0 0 "[ . 1 . 2]" 1
801 1 63 LEU H 1 63 LEU QD . . 4.550 2.705 1.885 3.753 . 0 0 "[ . 1 . 2]" 1
802 1 63 LEU H 1 63 LEU MD2 . . 5.330 3.627 2.130 4.686 . 0 0 "[ . 1 . 2]" 1
803 1 63 LEU H 1 63 LEU HG . . 3.660 3.049 2.189 4.087 0.427 5 0 "[ . 1 . 2]" 1
804 1 63 LEU H 1 64 ILE H . . 2.980 2.397 1.662 2.777 . 0 0 "[ . 1 . 2]" 1
805 1 63 LEU HB2 1 64 ILE H . . 4.160 3.146 2.683 3.519 . 0 0 "[ . 1 . 2]" 1
806 1 63 LEU HB3 1 64 ILE H . . 4.160 3.966 3.525 4.203 0.043 13 0 "[ . 1 . 2]" 1
807 1 63 LEU QD 1 64 ILE H . . 6.730 4.093 3.568 4.345 . 0 0 "[ . 1 . 2]" 1
808 1 63 LEU QD 1 73 LYS H . . 7.600 4.521 3.184 6.008 . 0 0 "[ . 1 . 2]" 1
809 1 63 LEU QD 1 94 VAL MG1 . . 6.620 2.780 2.140 3.295 . 0 0 "[ . 1 . 2]" 1
810 1 63 LEU QD 1 94 VAL MG2 . . 5.880 2.001 1.761 2.501 . 0 0 "[ . 1 . 2]" 1
811 1 63 LEU MD1 1 94 VAL MG1 . . 6.990 3.171 2.144 4.241 . 0 0 "[ . 1 . 2]" 1
812 1 63 LEU MD1 1 94 VAL MG2 . . 6.490 2.490 1.763 3.870 . 0 0 "[ . 1 . 2]" 1
813 1 63 LEU MD2 1 94 VAL MG1 . . 6.990 4.065 2.244 5.262 . 0 0 "[ . 1 . 2]" 1
814 1 63 LEU MD2 1 94 VAL MG2 . . 6.490 3.178 1.782 4.235 . 0 0 "[ . 1 . 2]" 1
815 1 63 LEU HG 1 64 ILE H . . 5.500 4.810 4.384 5.311 . 0 0 "[ . 1 . 2]" 1
816 1 64 ILE H 1 64 ILE HB . . 2.900 2.617 2.525 2.727 . 0 0 "[ . 1 . 2]" 1
817 1 64 ILE H 1 64 ILE MD . . 3.820 3.186 2.989 3.337 . 0 0 "[ . 1 . 2]" 1
818 1 64 ILE H 1 64 ILE MG . . 4.680 3.794 3.766 3.814 . 0 0 "[ . 1 . 2]" 1
819 1 64 ILE H 1 65 SER H . . 5.060 4.530 4.459 4.618 . 0 0 "[ . 1 . 2]" 1
820 1 64 ILE HA 1 65 SER H . . 2.900 2.194 2.148 2.256 . 0 0 "[ . 1 . 2]" 1
821 1 64 ILE HA 1 70 ILE MG . . 5.610 3.440 1.773 4.312 . 0 0 "[ . 1 . 2]" 1
822 1 64 ILE HA 1 71 ILE H . . 4.310 3.714 3.091 4.341 0.031 16 0 "[ . 1 . 2]" 1
823 1 64 ILE HB 1 65 SER H . . 3.950 4.024 3.966 4.076 0.126 12 0 "[ . 1 . 2]" 1
824 1 64 ILE MD 1 65 SER H . . 4.610 3.853 3.655 4.085 . 0 0 "[ . 1 . 2]" 1
825 1 64 ILE MG 1 65 SER H . . 3.600 2.569 2.403 2.764 . 0 0 "[ . 1 . 2]" 1
826 1 64 ILE MG 1 65 SER QB . . 6.750 4.022 3.696 4.496 . 0 0 "[ . 1 . 2]" 1
827 1 64 ILE MG 1 68 GLY H . . 4.680 3.540 2.622 4.621 . 0 0 "[ . 1 . 2]" 1
828 1 64 ILE MG 1 68 GLY HA2 . . 6.230 2.899 2.022 3.649 . 0 0 "[ . 1 . 2]" 1
829 1 64 ILE MG 1 68 GLY QA . . 5.490 2.854 2.009 3.569 . 0 0 "[ . 1 . 2]" 1
830 1 64 ILE MG 1 68 GLY HA3 . . 6.230 4.313 3.491 5.049 . 0 0 "[ . 1 . 2]" 1
831 1 64 ILE MG 1 69 VAL H . . 3.780 3.115 2.545 3.807 0.027 12 0 "[ . 1 . 2]" 1
832 1 65 SER H 1 65 SER HB2 . . 3.700 2.699 2.489 3.626 . 0 0 "[ . 1 . 2]" 1
833 1 65 SER H 1 65 SER QB . . 3.520 2.447 2.253 2.875 . 0 0 "[ . 1 . 2]" 1
834 1 65 SER H 1 65 SER HB3 . . 3.700 3.116 2.402 3.724 0.024 15 0 "[ . 1 . 2]" 1
835 1 65 SER H 1 66 ASP H . . 3.800 2.866 2.497 3.140 . 0 0 "[ . 1 . 2]" 1
836 1 65 SER H 1 69 VAL H . . 3.550 3.562 3.281 3.689 0.139 9 0 "[ . 1 . 2]" 1
837 1 65 SER HA 1 71 ILE MD . . 5.650 4.459 3.861 5.545 . 0 0 "[ . 1 . 2]" 1
838 1 65 SER QB 1 66 ASP H . . 3.740 2.113 1.796 2.518 . 0 0 "[ . 1 . 2]" 1
839 1 65 SER QB 1 67 ASP H . . 5.440 3.735 2.992 4.571 . 0 0 "[ . 1 . 2]" 1
840 1 65 SER QB 1 71 ILE MD . . 4.870 2.570 1.751 3.943 . 0 0 "[ . 1 . 2]" 1
841 1 65 SER HB2 1 66 ASP H . . 4.020 2.726 1.817 3.841 . 0 0 "[ . 1 . 2]" 1
842 1 65 SER HB2 1 71 ILE MD . . 5.260 2.807 1.779 4.418 . 0 0 "[ . 1 . 2]" 1
843 1 65 SER HB3 1 66 ASP H . . 4.020 2.776 1.870 3.527 . 0 0 "[ . 1 . 2]" 1
844 1 65 SER HB3 1 71 ILE MD . . 5.260 3.199 1.985 5.300 0.040 5 0 "[ . 1 . 2]" 1
845 1 66 ASP H 1 66 ASP HB2 . . 3.770 3.379 2.444 3.710 . 0 0 "[ . 1 . 2]" 1
846 1 66 ASP H 1 66 ASP QB . . 3.550 2.831 2.270 3.087 . 0 0 "[ . 1 . 2]" 1
847 1 66 ASP H 1 66 ASP HB3 . . 3.770 3.086 2.693 3.792 0.022 8 0 "[ . 1 . 2]" 1
848 1 66 ASP H 1 67 ASP H . . 3.620 2.428 1.886 2.968 . 0 0 "[ . 1 . 2]" 1
849 1 66 ASP QB 1 67 ASP H . . 3.630 2.253 1.819 2.634 . 0 0 "[ . 1 . 2]" 1
850 1 66 ASP HB2 1 67 ASP H . . 3.840 3.485 2.151 3.889 0.049 4 0 "[ . 1 . 2]" 1
851 1 66 ASP HB3 1 67 ASP H . . 3.840 2.423 1.826 3.566 . 0 0 "[ . 1 . 2]" 1
852 1 67 ASP H 1 67 ASP HA . . 2.940 2.881 2.806 2.931 . 0 0 "[ . 1 . 2]" 1
853 1 67 ASP H 1 67 ASP HB2 . . 3.480 2.574 2.335 3.432 . 0 0 "[ . 1 . 2]" 1
854 1 67 ASP H 1 67 ASP HB3 . . 3.880 3.102 2.425 3.617 . 0 0 "[ . 1 . 2]" 1
855 1 67 ASP H 1 68 GLY H . . 3.260 2.970 2.450 3.379 0.119 8 0 "[ . 1 . 2]" 1
856 1 67 ASP H 1 69 VAL H . . 4.600 3.555 2.687 4.183 . 0 0 "[ . 1 . 2]" 1
857 1 67 ASP HA 1 68 GLY H . . 3.370 3.112 2.496 3.523 0.153 15 0 "[ . 1 . 2]" 1
858 1 67 ASP HB2 1 68 GLY H . . 4.990 3.857 1.940 4.625 . 0 0 "[ . 1 . 2]" 1
859 1 67 ASP HB2 1 69 VAL MG1 . . 5.470 3.668 1.870 5.191 . 0 0 "[ . 1 . 2]" 1
860 1 67 ASP HB3 1 69 VAL MG1 . . 6.910 3.801 2.554 5.311 . 0 0 "[ . 1 . 2]" 1
861 1 68 GLY H 1 69 VAL H . . 3.050 2.455 1.903 2.920 . 0 0 "[ . 1 . 2]" 1
862 1 68 GLY H 1 69 VAL MG1 . . 6.870 3.442 2.732 3.952 . 0 0 "[ . 1 . 2]" 1
863 1 69 VAL H 1 69 VAL HB . . 3.080 3.080 2.831 3.235 0.155 15 0 "[ . 1 . 2]" 1
864 1 69 VAL H 1 69 VAL MG1 . . 3.740 2.091 1.869 2.353 . 0 0 "[ . 1 . 2]" 1
865 1 69 VAL H 1 69 VAL MG2 . . 4.540 3.870 3.781 3.963 . 0 0 "[ . 1 . 2]" 1
866 1 69 VAL H 1 70 ILE H . . 4.630 4.431 4.296 4.557 . 0 0 "[ . 1 . 2]" 1
867 1 69 VAL HA 1 70 ILE H . . 3.260 2.234 2.193 2.273 . 0 0 "[ . 1 . 2]" 1
868 1 69 VAL HB 1 70 ILE H . . 4.090 4.036 3.953 4.105 0.015 15 0 "[ . 1 . 2]" 1
869 1 69 VAL MG1 1 70 ILE H . . 4.210 3.802 3.695 3.936 . 0 0 "[ . 1 . 2]" 1
870 1 69 VAL MG2 1 70 ILE H . . 5.980 2.320 2.255 2.380 . 0 0 "[ . 1 . 2]" 1
871 1 69 VAL MG2 1 71 ILE MD . . 5.990 2.283 1.850 4.459 . 0 0 "[ . 1 . 2]" 1
872 1 70 ILE H 1 70 ILE HB . . 3.700 2.840 2.551 3.742 0.042 16 0 "[ . 1 . 2]" 1
873 1 70 ILE H 1 70 ILE MD . . 5.220 3.328 1.901 3.865 . 0 0 "[ . 1 . 2]" 1
874 1 70 ILE H 1 70 ILE HG12 . . 5.600 3.417 2.080 4.266 . 0 0 "[ . 1 . 2]" 1
875 1 70 ILE H 1 70 ILE QG . . 4.790 2.516 1.924 3.457 . 0 0 "[ . 1 . 2]" 1
876 1 70 ILE H 1 70 ILE HG13 . . 5.600 2.755 1.942 3.654 . 0 0 "[ . 1 . 2]" 1
877 1 70 ILE HA 1 71 ILE H . . 2.760 2.158 2.117 2.203 . 0 0 "[ . 1 . 2]" 1
878 1 70 ILE HB 1 71 ILE H . . 4.780 3.965 3.018 4.293 . 0 0 "[ . 1 . 2]" 1
879 1 70 ILE HB 1 91 LEU QD . . 6.300 4.727 3.980 6.306 0.006 16 0 "[ . 1 . 2]" 1
880 1 70 ILE MD 1 71 ILE H . . 6.980 5.087 4.715 5.356 . 0 0 "[ . 1 . 2]" 1
881 1 70 ILE MD 1 98 LEU QD . . 7.720 4.461 2.880 6.152 . 0 0 "[ . 1 . 2]" 1
882 1 70 ILE QG 1 71 ILE H . . 5.400 4.235 3.826 4.437 . 0 0 "[ . 1 . 2]" 1
883 1 70 ILE MG 1 71 ILE H . . 4.390 3.008 2.406 3.981 . 0 0 "[ . 1 . 2]" 1
884 1 70 ILE MG 1 98 LEU QD . . 7.500 4.889 3.786 5.874 . 0 0 "[ . 1 . 2]" 1
885 1 71 ILE H 1 71 ILE HB . . 3.300 2.503 2.344 3.220 . 0 0 "[ . 1 . 2]" 1
886 1 71 ILE H 1 71 ILE MD . . 4.680 2.949 2.377 4.388 . 0 0 "[ . 1 . 2]" 1
887 1 71 ILE H 1 72 ILE H . . 4.780 4.296 4.142 4.404 . 0 0 "[ . 1 . 2]" 1
888 1 71 ILE HA 1 71 ILE MD . . 4.610 2.547 1.875 3.085 . 0 0 "[ . 1 . 2]" 1
889 1 71 ILE HA 1 72 ILE H . . 2.690 2.117 2.086 2.164 . 0 0 "[ . 1 . 2]" 1
890 1 71 ILE HB 1 72 ILE H . . 4.780 4.407 4.249 4.510 . 0 0 "[ . 1 . 2]" 1
891 1 71 ILE MD 1 72 ILE H . . 5.290 4.276 2.442 4.863 . 0 0 "[ . 1 . 2]" 1
892 1 71 ILE QG 1 72 ILE H . . 4.610 3.781 2.840 4.611 0.001 8 0 "[ . 1 . 2]" 1
893 1 71 ILE HG12 1 72 ILE H . . 5.140 5.105 4.488 5.246 0.106 15 0 "[ . 1 . 2]" 1
894 1 71 ILE HG13 1 72 ILE H . . 5.140 3.920 2.871 5.302 0.162 8 0 "[ . 1 . 2]" 1
895 1 71 ILE MG 1 72 ILE H . . 3.960 2.988 2.721 4.122 0.162 5 0 "[ . 1 . 2]" 1
896 1 71 ILE MG 1 73 LYS QD . . 6.820 3.856 2.500 5.768 . 0 0 "[ . 1 . 2]" 1
897 1 71 ILE MG 1 73 LYS HE2 . . 5.690 4.623 2.199 5.774 0.084 3 0 "[ . 1 . 2]" 1
898 1 71 ILE MG 1 73 LYS QE . . 5.230 3.809 1.941 5.124 . 0 0 "[ . 1 . 2]" 1
899 1 71 ILE MG 1 73 LYS HE3 . . 5.690 4.206 1.985 5.751 0.061 2 0 "[ . 1 . 2]" 1
900 1 72 ILE H 1 72 ILE HB . . 3.800 2.646 2.531 2.767 . 0 0 "[ . 1 . 2]" 1
901 1 72 ILE H 1 72 ILE MD . . 4.720 2.714 1.905 3.784 . 0 0 "[ . 1 . 2]" 1
902 1 72 ILE H 1 72 ILE HG12 . . 4.740 3.760 2.545 4.511 . 0 0 "[ . 1 . 2]" 1
903 1 72 ILE H 1 72 ILE QG . . 4.530 3.153 2.514 3.620 . 0 0 "[ . 1 . 2]" 1
904 1 72 ILE H 1 72 ILE HG13 . . 4.740 3.744 3.344 4.242 . 0 0 "[ . 1 . 2]" 1
905 1 72 ILE H 1 72 ILE MG . . 4.710 3.851 3.778 3.899 . 0 0 "[ . 1 . 2]" 1
906 1 72 ILE H 1 73 LYS H . . 4.600 4.345 4.217 4.490 . 0 0 "[ . 1 . 2]" 1
907 1 72 ILE HA 1 72 ILE MD . . 4.610 2.862 2.009 3.462 . 0 0 "[ . 1 . 2]" 1
908 1 72 ILE HA 1 73 LYS H . . 2.510 2.157 2.114 2.263 . 0 0 "[ . 1 . 2]" 1
909 1 72 ILE HB 1 91 LEU QD . . 8.500 4.132 3.414 5.117 . 0 0 "[ . 1 . 2]" 1
910 1 72 ILE MD 1 73 LYS H . . 6.050 4.521 3.567 5.049 . 0 0 "[ . 1 . 2]" 1
911 1 72 ILE MD 1 90 ARG HA . . 7.020 6.224 4.762 7.043 0.023 18 0 "[ . 1 . 2]" 1
912 1 72 ILE MD 1 90 ARG HB2 . . 5.650 4.962 3.312 5.718 0.068 11 0 "[ . 1 . 2]" 1
913 1 72 ILE MD 1 90 ARG QB . . 4.930 4.049 2.696 4.712 . 0 0 "[ . 1 . 2]" 1
914 1 72 ILE MD 1 90 ARG HB3 . . 5.650 4.360 2.855 5.216 . 0 0 "[ . 1 . 2]" 1
915 1 72 ILE MD 1 90 ARG QG . . 5.990 5.044 2.450 6.023 0.033 13 0 "[ . 1 . 2]" 1
916 1 72 ILE MD 1 91 LEU HA . . 4.210 3.554 2.173 4.236 0.026 12 0 "[ . 1 . 2]" 1
917 1 72 ILE MD 1 91 LEU HB2 . . 4.970 3.267 2.521 4.349 . 0 0 "[ . 1 . 2]" 1
918 1 72 ILE MD 1 91 LEU HB3 . . 5.040 2.715 1.943 3.775 . 0 0 "[ . 1 . 2]" 1
919 1 72 ILE MD 1 91 LEU MD1 . . 7.320 4.382 3.705 5.477 . 0 0 "[ . 1 . 2]" 1
920 1 72 ILE MD 1 91 LEU QD . . 6.460 3.145 2.198 4.510 . 0 0 "[ . 1 . 2]" 1
921 1 72 ILE MD 1 91 LEU MD2 . . 7.320 3.255 2.211 4.845 . 0 0 "[ . 1 . 2]" 1
922 1 72 ILE MD 1 92 VAL H . . 6.520 5.765 4.993 6.519 . 0 0 "[ . 1 . 2]" 1
923 1 72 ILE QG 1 73 LYS H . . 5.860 4.358 4.051 4.740 . 0 0 "[ . 1 . 2]" 1
924 1 72 ILE HG12 1 73 LYS H . . 6.000 5.167 4.943 5.411 . 0 0 "[ . 1 . 2]" 1
925 1 72 ILE HG13 1 73 LYS H . . 6.000 4.779 4.275 5.600 . 0 0 "[ . 1 . 2]" 1
926 1 72 ILE MG 1 73 LYS H . . 4.350 2.685 2.257 2.972 . 0 0 "[ . 1 . 2]" 1
927 1 72 ILE MG 1 73 LYS HA . . 6.080 3.589 3.333 3.832 . 0 0 "[ . 1 . 2]" 1
928 1 72 ILE MG 1 74 ALA MB . . 7.570 2.894 2.341 3.391 . 0 0 "[ . 1 . 2]" 1
929 1 72 ILE MG 1 87 ALA H . . 5.070 4.598 4.358 5.095 0.025 14 0 "[ . 1 . 2]" 1
930 1 72 ILE MG 1 87 ALA HA . . 3.810 2.403 2.004 2.857 . 0 0 "[ . 1 . 2]" 1
931 1 72 ILE MG 1 87 ALA MB . . 6.530 2.404 1.873 2.987 . 0 0 "[ . 1 . 2]" 1
932 1 72 ILE MG 1 90 ARG H . . 5.690 4.577 3.910 5.352 . 0 0 "[ . 1 . 2]" 1
933 1 72 ILE MG 1 90 ARG QB . . 5.020 2.743 1.992 3.879 . 0 0 "[ . 1 . 2]" 1
934 1 72 ILE MG 1 90 ARG QD . . 6.060 4.326 1.958 6.094 0.034 1 0 "[ . 1 . 2]" 1
935 1 72 ILE MG 1 90 ARG QG . . 5.950 3.400 2.122 4.943 . 0 0 "[ . 1 . 2]" 1
936 1 73 LYS H 1 73 LYS HB2 . . 4.060 2.843 2.286 3.830 . 0 0 "[ . 1 . 2]" 1
937 1 73 LYS H 1 73 LYS QB . . 3.890 2.488 2.260 2.881 . 0 0 "[ . 1 . 2]" 1
938 1 73 LYS H 1 73 LYS HB3 . . 4.060 3.246 2.537 3.719 . 0 0 "[ . 1 . 2]" 1
939 1 73 LYS H 1 73 LYS HG2 . . 5.140 4.021 2.231 4.651 . 0 0 "[ . 1 . 2]" 1
940 1 73 LYS H 1 73 LYS QG . . 4.580 3.287 2.214 4.086 . 0 0 "[ . 1 . 2]" 1
941 1 73 LYS H 1 73 LYS HG3 . . 5.140 3.744 3.020 4.647 . 0 0 "[ . 1 . 2]" 1
942 1 73 LYS H 1 74 ALA H . . 4.450 4.280 4.020 4.466 0.016 5 0 "[ . 1 . 2]" 1
943 1 73 LYS HA 1 73 LYS HG2 . . 4.200 3.023 2.381 3.735 . 0 0 "[ . 1 . 2]" 1
944 1 73 LYS HA 1 73 LYS QG . . 3.960 2.563 2.222 3.408 . 0 0 "[ . 1 . 2]" 1
945 1 73 LYS HA 1 73 LYS HG3 . . 4.200 2.879 2.323 4.218 0.018 11 0 "[ . 1 . 2]" 1
946 1 73 LYS HA 1 74 ALA H . . 2.870 2.157 2.032 2.356 . 0 0 "[ . 1 . 2]" 1
947 1 73 LYS HA 1 74 ALA MB . . 5.400 3.935 3.763 4.101 . 0 0 "[ . 1 . 2]" 1
948 1 73 LYS QB 1 74 ALA H . . 4.260 3.305 2.493 3.977 . 0 0 "[ . 1 . 2]" 1
949 1 73 LYS HB2 1 74 ALA H . . 4.600 4.029 2.754 4.627 0.027 3 0 "[ . 1 . 2]" 1
950 1 73 LYS HB3 1 74 ALA H . . 4.600 3.751 2.530 4.434 . 0 0 "[ . 1 . 2]" 1
951 1 73 LYS QG 1 74 ALA H . . 4.200 3.623 2.887 4.004 . 0 0 "[ . 1 . 2]" 1
952 1 73 LYS HG2 1 74 ALA H . . 4.380 4.055 2.931 4.568 0.188 12 0 "[ . 1 . 2]" 1
953 1 73 LYS HG3 1 74 ALA H . . 4.380 4.245 3.405 4.748 0.368 8 0 "[ . 1 . 2]" 1
954 1 74 ALA H 1 74 ALA MB . . 3.630 2.506 2.309 2.742 . 0 0 "[ . 1 . 2]" 1
955 1 74 ALA H 1 75 GLN H . . 4.310 4.308 4.071 4.460 0.150 6 0 "[ . 1 . 2]" 1
956 1 74 ALA HA 1 75 GLN H . . 3.260 2.143 2.076 2.239 . 0 0 "[ . 1 . 2]" 1
957 1 74 ALA MB 1 75 GLN H . . 3.560 3.033 2.542 3.182 . 0 0 "[ . 1 . 2]" 1
958 1 74 ALA MB 1 83 ASN HB2 . . 5.070 4.261 3.426 5.081 0.011 1 0 "[ . 1 . 2]" 1
959 1 74 ALA MB 1 83 ASN QB . . 4.690 2.821 2.020 3.618 . 0 0 "[ . 1 . 2]" 1
960 1 74 ALA MB 1 83 ASN HB3 . . 5.070 2.864 2.034 3.703 . 0 0 "[ . 1 . 2]" 1
961 1 74 ALA MB 1 86 ALA H . . 5.540 4.794 4.250 5.558 0.018 1 0 "[ . 1 . 2]" 1
962 1 74 ALA MB 1 86 ALA MB . . 5.700 3.124 2.362 3.721 . 0 0 "[ . 1 . 2]" 1
963 1 74 ALA MB 1 87 ALA HA . . 6.050 3.131 2.528 3.785 . 0 0 "[ . 1 . 2]" 1
964 1 75 GLN H 1 75 GLN HB2 . . 4.200 3.912 3.506 4.012 . 0 0 "[ . 1 . 2]" 1
965 1 75 GLN H 1 75 GLN HB3 . . 4.200 3.497 2.789 3.622 . 0 0 "[ . 1 . 2]" 1
966 1 75 GLN H 1 75 GLN HG2 . . 4.740 3.021 2.552 4.933 0.193 7 0 "[ . 1 . 2]" 1
967 1 75 GLN H 1 75 GLN QG . . 4.080 2.668 2.285 4.007 . 0 0 "[ . 1 . 2]" 1
968 1 75 GLN H 1 75 GLN HG3 . . 4.740 3.218 2.303 4.391 . 0 0 "[ . 1 . 2]" 1
969 1 75 GLN H 1 76 GLU H . . 3.620 3.674 3.628 3.756 0.136 3 0 "[ . 1 . 2]" 1
970 1 75 GLN H 1 76 GLU QB . . 5.120 4.508 3.633 5.117 . 0 0 "[ . 1 . 2]" 1
971 1 75 GLN HA 1 76 GLU H . . 2.800 2.157 2.100 2.219 . 0 0 "[ . 1 . 2]" 1
972 1 75 GLN QE 1 76 GLU QB . . 7.560 6.325 4.203 7.259 . 0 0 "[ . 1 . 2]" 1
973 1 75 GLN QG 1 76 GLU H . . 5.480 4.390 3.726 4.731 . 0 0 "[ . 1 . 2]" 1
974 1 75 GLN HG2 1 76 GLU H . . 5.960 5.234 4.532 5.827 . 0 0 "[ . 1 . 2]" 1
975 1 75 GLN HG3 1 76 GLU H . . 5.960 4.787 3.827 5.629 . 0 0 "[ . 1 . 2]" 1
976 1 76 GLU H 1 76 GLU HB2 . . 3.440 2.687 2.392 3.229 . 0 0 "[ . 1 . 2]" 1
977 1 76 GLU H 1 76 GLU QB . . 3.250 2.436 2.259 2.706 . 0 0 "[ . 1 . 2]" 1
978 1 76 GLU H 1 76 GLU HB3 . . 3.440 3.109 2.373 3.729 0.289 12 0 "[ . 1 . 2]" 1
979 1 76 GLU H 1 76 GLU HG2 . . 4.920 3.987 2.803 4.625 . 0 0 "[ . 1 . 2]" 1
980 1 76 GLU H 1 76 GLU QG . . 4.320 3.612 2.753 4.174 . 0 0 "[ . 1 . 2]" 1
981 1 76 GLU H 1 76 GLU HG3 . . 4.920 4.335 3.068 4.874 . 0 0 "[ . 1 . 2]" 1
982 1 76 GLU H 1 77 PHE H . . 3.120 2.465 1.829 3.024 . 0 0 "[ . 1 . 2]" 1
983 1 76 GLU HA 1 76 GLU HG2 . . 3.910 2.801 2.324 3.261 . 0 0 "[ . 1 . 2]" 1
984 1 76 GLU HA 1 76 GLU HG3 . . 3.910 3.206 2.383 3.783 . 0 0 "[ . 1 . 2]" 1
985 1 76 GLU HB2 1 77 PHE H . . 3.700 3.006 2.105 3.684 . 0 0 "[ . 1 . 2]" 1
986 1 76 GLU HB2 1 77 PHE QD . . 8.130 5.857 2.827 7.031 . 0 0 "[ . 1 . 2]" 1
987 1 76 GLU HB3 1 77 PHE H . . 3.700 2.520 1.840 3.737 0.037 14 0 "[ . 1 . 2]" 1
988 1 76 GLU HB3 1 77 PHE QD . . 8.130 5.018 2.413 5.792 . 0 0 "[ . 1 . 2]" 1
989 1 76 GLU QG 1 77 PHE H . . 5.430 3.614 2.805 4.360 . 0 0 "[ . 1 . 2]" 1
990 1 76 GLU HG2 1 77 PHE H . . 6.000 3.964 2.867 4.961 . 0 0 "[ . 1 . 2]" 1
991 1 76 GLU HG2 1 77 PHE QD . . 8.130 5.766 2.050 7.773 . 0 0 "[ . 1 . 2]" 1
992 1 76 GLU HG3 1 77 PHE H . . 6.000 4.389 3.789 5.311 . 0 0 "[ . 1 . 2]" 1
993 1 76 GLU HG3 1 77 PHE QD . . 8.130 6.249 3.539 7.657 . 0 0 "[ . 1 . 2]" 1
994 1 77 PHE H 1 77 PHE HB2 . . 3.620 3.060 2.377 3.569 . 0 0 "[ . 1 . 2]" 1
995 1 77 PHE H 1 77 PHE QB . . 3.280 2.694 2.327 3.024 . 0 0 "[ . 1 . 2]" 1
996 1 77 PHE H 1 77 PHE HB3 . . 3.620 3.139 2.661 3.733 0.113 6 0 "[ . 1 . 2]" 1
997 1 77 PHE H 1 83 ASN HD21 . . 4.130 4.023 3.153 4.263 0.133 15 0 "[ . 1 . 2]" 1
998 1 77 PHE H 1 83 ASN QD . . 3.530 2.540 1.989 2.956 . 0 0 "[ . 1 . 2]" 1
999 1 77 PHE H 1 83 ASN HD22 . . 4.130 2.576 1.997 3.112 . 0 0 "[ . 1 . 2]" 1
1000 1 77 PHE QD 1 82 LEU MD1 . . 8.930 5.047 2.239 7.328 . 0 0 "[ . 1 . 2]" 1
1001 1 77 PHE QD 1 82 LEU QD . . 8.740 3.670 1.812 6.320 . 0 0 "[ . 1 . 2]" 1
1002 1 77 PHE QD 1 82 LEU MD2 . . 8.930 3.877 1.830 6.984 . 0 0 "[ . 1 . 2]" 1
1003 1 79 SER H 1 79 SER QB . . 3.790 2.801 2.274 3.436 . 0 0 "[ . 1 . 2]" 1
1004 1 79 SER HA 1 82 LEU H . . 4.850 4.646 4.183 4.951 0.101 2 0 "[ . 1 . 2]" 1
1005 1 79 SER QB 1 80 GLN H . . 4.200 3.628 3.352 3.939 . 0 0 "[ . 1 . 2]" 1
1006 1 79 SER QB 1 82 LEU H . . 3.940 2.961 2.745 3.206 . 0 0 "[ . 1 . 2]" 1
1007 1 79 SER QB 1 82 LEU HB3 . . 6.880 3.243 2.093 4.066 . 0 0 "[ . 1 . 2]" 1
1008 1 79 SER QB 1 82 LEU QD . . 6.260 2.041 1.774 2.739 . 0 0 "[ . 1 . 2]" 1
1009 1 79 SER QB 1 82 LEU HG . . 6.880 2.839 2.185 4.343 . 0 0 "[ . 1 . 2]" 1
1010 1 79 SER QB 1 83 ASN H . . 5.400 3.952 3.509 4.285 . 0 0 "[ . 1 . 2]" 1
1011 1 79 SER HB2 1 80 GLN H . . 4.450 4.380 4.255 4.472 0.022 17 0 "[ . 1 . 2]" 1
1012 1 79 SER HB2 1 82 LEU H . . 4.130 3.516 3.006 4.027 . 0 0 "[ . 1 . 2]" 1
1013 1 79 SER HB2 1 82 LEU MD1 . . 8.060 4.053 3.336 5.746 . 0 0 "[ . 1 . 2]" 1
1014 1 79 SER HB2 1 82 LEU MD2 . . 8.060 2.201 1.799 3.619 . 0 0 "[ . 1 . 2]" 1
1015 1 79 SER HB3 1 80 GLN H . . 4.450 3.887 3.509 4.449 . 0 0 "[ . 1 . 2]" 1
1016 1 79 SER HB3 1 82 LEU H . . 4.130 3.221 2.827 3.522 . 0 0 "[ . 1 . 2]" 1
1017 1 79 SER HB3 1 82 LEU MD1 . . 8.060 4.938 3.755 6.044 . 0 0 "[ . 1 . 2]" 1
1018 1 79 SER HB3 1 82 LEU MD2 . . 8.060 2.925 1.802 4.308 . 0 0 "[ . 1 . 2]" 1
1019 1 80 GLN H 1 80 GLN HB2 . . 4.130 2.483 2.063 3.586 . 0 0 "[ . 1 . 2]" 1
1020 1 80 GLN HA 1 82 LEU H . . 5.210 4.533 4.149 4.877 . 0 0 "[ . 1 . 2]" 1
1021 1 80 GLN HA 1 83 ASN H . . 3.910 3.454 2.999 3.850 . 0 0 "[ . 1 . 2]" 1
1022 1 80 GLN HA 1 83 ASN QB . . 4.790 2.364 1.917 2.845 . 0 0 "[ . 1 . 2]" 1
1023 1 80 GLN HA 1 83 ASN HD21 . . 5.820 3.830 2.116 5.808 . 0 0 "[ . 1 . 2]" 1
1024 1 80 GLN HA 1 83 ASN QD . . 5.440 3.564 2.103 5.178 . 0 0 "[ . 1 . 2]" 1
1025 1 80 GLN HA 1 83 ASN HD22 . . 5.820 4.623 3.642 5.860 0.040 3 0 "[ . 1 . 2]" 1
1026 1 80 GLN HB2 1 81 GLU H . . 3.620 2.943 2.618 3.726 0.106 4 0 "[ . 1 . 2]" 1
1027 1 80 GLN HB3 1 81 GLU H . . 3.730 3.713 2.957 3.895 0.165 4 0 "[ . 1 . 2]" 1
1028 1 80 GLN HG2 1 81 GLU H . . 6.000 5.074 2.110 5.546 . 0 0 "[ . 1 . 2]" 1
1029 1 80 GLN HG3 1 81 GLU H . . 6.000 4.908 3.733 5.295 . 0 0 "[ . 1 . 2]" 1
1030 1 81 GLU H 1 81 GLU HB2 . . 3.120 2.397 2.056 2.511 . 0 0 "[ . 1 . 2]" 1
1031 1 81 GLU H 1 81 GLU QB . . 2.940 2.207 2.039 2.255 . 0 0 "[ . 1 . 2]" 1
1032 1 81 GLU H 1 81 GLU HB3 . . 3.120 2.694 2.425 3.472 0.352 12 0 "[ . 1 . 2]" 1
1033 1 81 GLU H 1 81 GLU HG2 . . 4.810 4.383 3.684 4.586 . 0 0 "[ . 1 . 2]" 1
1034 1 81 GLU H 1 81 GLU QG . . 4.400 3.892 3.227 4.043 . 0 0 "[ . 1 . 2]" 1
1035 1 81 GLU H 1 81 GLU HG3 . . 4.810 4.357 3.567 4.517 . 0 0 "[ . 1 . 2]" 1
1036 1 81 GLU H 1 82 LEU H . . 3.340 2.866 2.764 2.974 . 0 0 "[ . 1 . 2]" 1
1037 1 81 GLU HA 1 84 ARG H . . 3.840 3.698 3.397 3.931 0.091 15 0 "[ . 1 . 2]" 1
1038 1 81 GLU HB2 1 82 LEU H . . 3.660 3.568 2.457 3.749 0.089 6 0 "[ . 1 . 2]" 1
1039 1 81 GLU HB3 1 82 LEU H . . 3.660 2.443 2.266 3.263 . 0 0 "[ . 1 . 2]" 1
1040 1 81 GLU QG 1 82 LEU H . . 5.240 3.621 3.235 4.500 . 0 0 "[ . 1 . 2]" 1
1041 1 81 GLU QG 1 82 LEU QD . . 9.450 5.074 4.616 5.913 . 0 0 "[ . 1 . 2]" 1
1042 1 81 GLU HG2 1 82 LEU H . . 6.000 3.895 3.324 5.121 . 0 0 "[ . 1 . 2]" 1
1043 1 81 GLU HG3 1 82 LEU H . . 6.000 4.575 3.562 4.988 . 0 0 "[ . 1 . 2]" 1
1044 1 82 LEU H 1 82 LEU HB3 . . 3.440 2.376 1.999 2.662 . 0 0 "[ . 1 . 2]" 1
1045 1 82 LEU H 1 82 LEU MD1 . . 5.250 3.940 3.570 4.353 . 0 0 "[ . 1 . 2]" 1
1046 1 82 LEU H 1 82 LEU QD . . 4.490 3.177 2.909 3.678 . 0 0 "[ . 1 . 2]" 1
1047 1 82 LEU H 1 82 LEU MD2 . . 5.250 3.357 3.067 4.010 . 0 0 "[ . 1 . 2]" 1
1048 1 82 LEU H 1 82 LEU HG . . 3.590 2.774 2.060 3.965 0.375 6 0 "[ . 1 . 2]" 1
1049 1 82 LEU H 1 83 ASN H . . 3.260 2.502 2.415 2.644 . 0 0 "[ . 1 . 2]" 1
1050 1 82 LEU HA 1 85 GLU H . . 3.730 3.294 3.072 3.722 . 0 0 "[ . 1 . 2]" 1
1051 1 82 LEU HA 1 85 GLU HB2 . . 4.200 2.923 2.037 4.387 0.187 19 0 "[ . 1 . 2]" 1
1052 1 82 LEU HA 1 85 GLU QB . . 3.950 2.706 2.028 3.523 . 0 0 "[ . 1 . 2]" 1
1053 1 82 LEU HA 1 85 GLU HB3 . . 4.200 4.035 3.353 4.331 0.131 2 0 "[ . 1 . 2]" 1
1054 1 82 LEU HA 1 86 ALA H . . 4.200 3.892 3.474 4.134 . 0 0 "[ . 1 . 2]" 1
1055 1 82 LEU HB2 1 83 ASN H . . 4.380 4.029 3.774 4.265 . 0 0 "[ . 1 . 2]" 1
1056 1 82 LEU HB3 1 82 LEU HG . . 2.800 2.614 2.468 2.658 . 0 0 "[ . 1 . 2]" 1
1057 1 82 LEU HB3 1 83 ASN H . . 3.730 3.688 2.935 3.947 0.217 9 0 "[ . 1 . 2]" 1
1058 1 82 LEU QD 1 83 ASN H . . 4.170 2.916 2.423 3.731 . 0 0 "[ . 1 . 2]" 1
1059 1 82 LEU MD1 1 83 ASN H . . 4.680 3.090 2.447 4.200 . 0 0 "[ . 1 . 2]" 1
1060 1 82 LEU MD2 1 83 ASN H . . 4.680 3.917 3.613 4.175 . 0 0 "[ . 1 . 2]" 1
1061 1 82 LEU HG 1 83 ASN H . . 4.130 2.398 2.183 3.217 . 0 0 "[ . 1 . 2]" 1
1062 1 83 ASN H 1 83 ASN HB2 . . 3.480 2.385 2.133 2.671 . 0 0 "[ . 1 . 2]" 1
1063 1 83 ASN H 1 83 ASN HB3 . . 3.480 3.568 3.416 3.605 0.125 17 0 "[ . 1 . 2]" 1
1064 1 83 ASN H 1 83 ASN HD21 . . 4.990 3.277 1.909 4.637 . 0 0 "[ . 1 . 2]" 1
1065 1 83 ASN H 1 83 ASN QD . . 4.840 3.113 1.901 4.166 . 0 0 "[ . 1 . 2]" 1
1066 1 83 ASN H 1 83 ASN HD22 . . 4.990 4.115 3.491 4.717 . 0 0 "[ . 1 . 2]" 1
1067 1 83 ASN H 1 84 ARG H . . 3.120 2.642 2.503 2.752 . 0 0 "[ . 1 . 2]" 1
1068 1 83 ASN QB 1 84 ARG H . . 4.180 2.648 2.491 2.855 . 0 0 "[ . 1 . 2]" 1
1069 1 83 ASN HB2 1 84 ARG H . . 4.340 2.745 2.533 3.047 . 0 0 "[ . 1 . 2]" 1
1070 1 83 ASN HB3 1 84 ARG H . . 4.340 3.547 3.152 3.749 . 0 0 "[ . 1 . 2]" 1
1071 1 83 ASN QD 1 84 ARG H . . 5.920 4.624 4.042 5.153 . 0 0 "[ . 1 . 2]" 1
1072 1 84 ARG H 1 84 ARG HB2 . . 3.410 2.377 2.202 2.551 . 0 0 "[ . 1 . 2]" 1
1073 1 84 ARG H 1 84 ARG QB . . 3.150 2.266 2.180 2.499 . 0 0 "[ . 1 . 2]" 1
1074 1 84 ARG H 1 84 ARG HB3 . . 3.410 3.079 2.520 3.572 0.162 14 0 "[ . 1 . 2]" 1
1075 1 84 ARG H 1 84 ARG HG2 . . 5.030 4.063 3.164 4.621 . 0 0 "[ . 1 . 2]" 1
1076 1 84 ARG H 1 84 ARG QG . . 4.310 3.227 2.126 4.042 . 0 0 "[ . 1 . 2]" 1
1077 1 84 ARG H 1 84 ARG HG3 . . 5.030 3.473 2.160 4.463 . 0 0 "[ . 1 . 2]" 1
1078 1 84 ARG H 1 85 GLU H . . 3.160 2.703 2.550 2.829 . 0 0 "[ . 1 . 2]" 1
1079 1 84 ARG HA 1 87 ALA H . . 3.840 3.511 3.260 3.792 . 0 0 "[ . 1 . 2]" 1
1080 1 84 ARG HA 1 87 ALA MB . . 5.470 2.679 2.429 2.917 . 0 0 "[ . 1 . 2]" 1
1081 1 84 ARG QB 1 85 GLU H . . 3.290 2.344 2.189 2.575 . 0 0 "[ . 1 . 2]" 1
1082 1 84 ARG HB2 1 85 GLU H . . 3.550 3.059 2.358 3.663 0.113 5 0 "[ . 1 . 2]" 1
1083 1 84 ARG HB3 1 85 GLU H . . 3.550 2.800 2.207 3.525 . 0 0 "[ . 1 . 2]" 1
1084 1 84 ARG QG 1 85 GLU H . . 4.800 3.861 3.389 4.260 . 0 0 "[ . 1 . 2]" 1
1085 1 84 ARG HG2 1 85 GLU H . . 5.240 4.359 3.500 5.007 . 0 0 "[ . 1 . 2]" 1
1086 1 84 ARG HG3 1 85 GLU H . . 5.240 4.524 3.897 4.938 . 0 0 "[ . 1 . 2]" 1
1087 1 85 GLU H 1 85 GLU HB2 . . 3.440 2.637 2.224 3.565 0.125 19 0 "[ . 1 . 2]" 1
1088 1 85 GLU H 1 85 GLU QB . . 3.160 2.375 2.201 2.505 . 0 0 "[ . 1 . 2]" 1
1089 1 85 GLU H 1 85 GLU HB3 . . 3.440 3.321 2.383 3.568 0.128 10 0 "[ . 1 . 2]" 1
1090 1 85 GLU H 1 85 GLU HG2 . . 3.520 2.612 2.009 3.525 0.005 2 0 "[ . 1 . 2]" 1
1091 1 85 GLU H 1 85 GLU QG . . 3.330 2.252 1.950 2.538 . 0 0 "[ . 1 . 2]" 1
1092 1 85 GLU H 1 85 GLU HG3 . . 3.520 3.113 1.969 3.615 0.095 4 0 "[ . 1 . 2]" 1
1093 1 85 GLU H 1 86 ALA H . . 2.980 2.752 2.613 2.889 . 0 0 "[ . 1 . 2]" 1
1094 1 85 GLU H 1 87 ALA H . . 4.960 4.175 3.955 4.350 . 0 0 "[ . 1 . 2]" 1
1095 1 85 GLU H 1 88 ILE MD . . 5.690 4.249 4.002 4.495 . 0 0 "[ . 1 . 2]" 1
1096 1 85 GLU HA 1 85 GLU HG2 . . 4.240 3.016 2.351 4.177 . 0 0 "[ . 1 . 2]" 1
1097 1 85 GLU HA 1 85 GLU HG3 . . 4.240 3.546 2.969 3.810 . 0 0 "[ . 1 . 2]" 1
1098 1 85 GLU HA 1 86 ALA H . . 3.520 3.535 3.503 3.557 0.037 1 0 "[ . 1 . 2]" 1
1099 1 85 GLU HA 1 88 ILE H . . 4.380 3.467 3.158 3.840 . 0 0 "[ . 1 . 2]" 1
1100 1 85 GLU HA 1 88 ILE HB . . 3.910 2.790 2.469 3.129 . 0 0 "[ . 1 . 2]" 1
1101 1 85 GLU HA 1 88 ILE MD . . 4.500 2.473 1.948 3.064 . 0 0 "[ . 1 . 2]" 1
1102 1 85 GLU HA 1 88 ILE MG . . 6.050 4.121 3.824 4.433 . 0 0 "[ . 1 . 2]" 1
1103 1 85 GLU HA 1 89 ALA H . . 4.240 3.928 3.709 4.128 . 0 0 "[ . 1 . 2]" 1
1104 1 85 GLU HB2 1 86 ALA H . . 3.910 2.868 2.502 3.949 0.039 14 0 "[ . 1 . 2]" 1
1105 1 85 GLU HB3 1 86 ALA H . . 3.910 3.611 3.244 4.001 0.091 19 0 "[ . 1 . 2]" 1
1106 1 85 GLU QG 1 86 ALA H . . 5.030 3.678 1.896 4.288 . 0 0 "[ . 1 . 2]" 1
1107 1 85 GLU HG2 1 86 ALA H . . 5.500 4.295 2.589 5.079 . 0 0 "[ . 1 . 2]" 1
1108 1 85 GLU HG3 1 86 ALA H . . 5.500 4.208 1.904 5.048 . 0 0 "[ . 1 . 2]" 1
1109 1 86 ALA H 1 86 ALA MB . . 3.420 2.244 2.234 2.255 . 0 0 "[ . 1 . 2]" 1
1110 1 86 ALA H 1 87 ALA H . . 3.160 2.643 2.525 2.737 . 0 0 "[ . 1 . 2]" 1
1111 1 86 ALA HA 1 87 ALA H . . 3.550 3.531 3.488 3.555 0.005 15 0 "[ . 1 . 2]" 1
1112 1 86 ALA HA 1 89 ALA H . . 3.590 3.464 3.234 3.649 0.059 10 0 "[ . 1 . 2]" 1
1113 1 86 ALA HA 1 89 ALA MB . . 4.140 2.582 2.427 2.754 . 0 0 "[ . 1 . 2]" 1
1114 1 86 ALA HA 1 90 ARG H . . 3.880 3.932 3.879 3.986 0.106 17 0 "[ . 1 . 2]" 1
1115 1 86 ALA MB 1 87 ALA H . . 3.420 2.549 2.445 2.775 . 0 0 "[ . 1 . 2]" 1
1116 1 86 ALA MB 1 87 ALA HA . . 6.050 3.862 3.790 3.936 . 0 0 "[ . 1 . 2]" 1
1117 1 87 ALA H 1 87 ALA MB . . 3.420 2.234 2.219 2.244 . 0 0 "[ . 1 . 2]" 1
1118 1 87 ALA H 1 88 ILE H . . 3.410 2.686 2.586 2.794 . 0 0 "[ . 1 . 2]" 1
1119 1 87 ALA H 1 89 ALA H . . 4.740 4.217 4.077 4.346 . 0 0 "[ . 1 . 2]" 1
1120 1 87 ALA H 1 89 ALA MB . . 7.020 4.837 4.701 4.985 . 0 0 "[ . 1 . 2]" 1
1121 1 87 ALA HA 1 90 ARG H . . 4.020 3.539 3.194 3.758 . 0 0 "[ . 1 . 2]" 1
1122 1 87 ALA HA 1 90 ARG QB . . 4.860 2.607 2.178 2.939 . 0 0 "[ . 1 . 2]" 1
1123 1 87 ALA HA 1 90 ARG QG . . 6.880 3.762 2.857 4.647 . 0 0 "[ . 1 . 2]" 1
1124 1 87 ALA MB 1 88 ILE H . . 4.250 2.453 2.350 2.585 . 0 0 "[ . 1 . 2]" 1
1125 1 87 ALA MB 1 90 ARG H . . 6.260 4.612 4.367 4.771 . 0 0 "[ . 1 . 2]" 1
1126 1 88 ILE H 1 88 ILE HB . . 2.540 2.536 2.490 2.554 0.014 2 0 "[ . 1 . 2]" 1
1127 1 88 ILE H 1 88 ILE MD . . 3.960 3.543 3.507 3.581 . 0 0 "[ . 1 . 2]" 1
1128 1 88 ILE H 1 88 ILE HG12 . . 4.520 3.396 3.358 3.476 . 0 0 "[ . 1 . 2]" 1
1129 1 88 ILE H 1 88 ILE HG13 . . 5.460 2.106 2.066 2.177 . 0 0 "[ . 1 . 2]" 1
1130 1 88 ILE H 1 89 ALA H . . 2.940 2.749 2.680 2.812 . 0 0 "[ . 1 . 2]" 1
1131 1 88 ILE HA 1 88 ILE MD . . 4.790 3.840 3.823 3.857 . 0 0 "[ . 1 . 2]" 1
1132 1 88 ILE HA 1 91 LEU H . . 3.800 3.518 3.403 3.627 . 0 0 "[ . 1 . 2]" 1
1133 1 88 ILE HA 1 91 LEU HB3 . . 4.060 4.001 3.769 4.099 0.039 11 0 "[ . 1 . 2]" 1
1134 1 88 ILE HA 1 91 LEU MD1 . . 6.770 3.619 3.148 3.984 . 0 0 "[ . 1 . 2]" 1
1135 1 88 ILE HA 1 91 LEU QD . . 6.230 1.959 1.842 2.078 . 0 0 "[ . 1 . 2]" 1
1136 1 88 ILE HA 1 91 LEU MD2 . . 6.770 1.968 1.847 2.085 . 0 0 "[ . 1 . 2]" 1
1137 1 88 ILE HA 1 91 LEU HG . . 6.000 2.529 2.103 2.929 . 0 0 "[ . 1 . 2]" 1
1138 1 88 ILE HA 1 92 VAL H . . 5.030 4.136 3.846 4.423 . 0 0 "[ . 1 . 2]" 1
1139 1 88 ILE HB 1 88 ILE MD . . 3.560 2.406 2.388 2.424 . 0 0 "[ . 1 . 2]" 1
1140 1 88 ILE HB 1 89 ALA H . . 3.910 2.415 2.368 2.454 . 0 0 "[ . 1 . 2]" 1
1141 1 88 ILE MD 1 89 ALA H . . 4.390 4.408 4.360 4.432 0.042 6 0 "[ . 1 . 2]" 1
1142 1 88 ILE HG12 1 89 ALA H . . 6.000 4.911 4.875 4.930 . 0 0 "[ . 1 . 2]" 1
1143 1 88 ILE HG13 1 89 ALA H . . 4.420 4.173 4.138 4.217 . 0 0 "[ . 1 . 2]" 1
1144 1 88 ILE HG13 1 91 LEU QD . . 6.090 3.874 3.625 4.151 . 0 0 "[ . 1 . 2]" 1
1145 1 88 ILE MG 1 89 ALA H . . 4.170 3.254 3.169 3.339 . 0 0 "[ . 1 . 2]" 1
1146 1 88 ILE MG 1 92 VAL H . . 6.050 3.992 3.791 4.305 . 0 0 "[ . 1 . 2]" 1
1147 1 89 ALA H 1 89 ALA MB . . 3.420 2.234 2.219 2.248 . 0 0 "[ . 1 . 2]" 1
1148 1 89 ALA HA 1 91 LEU H . . 4.780 4.521 4.328 4.677 . 0 0 "[ . 1 . 2]" 1
1149 1 89 ALA HA 1 92 VAL H . . 3.840 3.602 3.400 3.866 0.026 17 0 "[ . 1 . 2]" 1
1150 1 89 ALA HA 1 92 VAL HB . . 3.480 2.763 2.515 3.072 . 0 0 "[ . 1 . 2]" 1
1151 1 89 ALA HA 1 92 VAL MG1 . . 4.610 4.072 3.838 4.357 . 0 0 "[ . 1 . 2]" 1
1152 1 89 ALA HA 1 92 VAL MG2 . . 4.530 3.098 2.757 3.586 . 0 0 "[ . 1 . 2]" 1
1153 1 89 ALA HA 1 93 ALA H . . 4.130 4.079 3.925 4.182 0.052 5 0 "[ . 1 . 2]" 1
1154 1 89 ALA MB 1 90 ARG H . . 3.420 2.600 2.424 2.836 . 0 0 "[ . 1 . 2]" 1
1155 1 90 ARG H 1 90 ARG HB2 . . 3.660 2.303 2.107 2.602 . 0 0 "[ . 1 . 2]" 1
1156 1 90 ARG H 1 90 ARG QB . . 3.270 2.230 2.069 2.445 . 0 0 "[ . 1 . 2]" 1
1157 1 90 ARG H 1 90 ARG HB3 . . 3.660 3.253 2.522 3.618 . 0 0 "[ . 1 . 2]" 1
1158 1 90 ARG H 1 91 LEU H . . 2.980 2.758 2.598 2.858 . 0 0 "[ . 1 . 2]" 1
1159 1 90 ARG HA 1 93 ALA H . . 4.560 3.556 3.199 3.820 . 0 0 "[ . 1 . 2]" 1
1160 1 90 ARG HA 1 93 ALA MB . . 4.460 2.727 2.309 3.094 . 0 0 "[ . 1 . 2]" 1
1161 1 90 ARG HA 1 94 VAL H . . 4.380 4.259 3.983 4.434 0.054 14 0 "[ . 1 . 2]" 1
1162 1 90 ARG QB 1 91 LEU H . . 3.830 2.598 2.351 2.786 . 0 0 "[ . 1 . 2]" 1
1163 1 90 ARG QB 1 93 ALA MB . . 6.710 4.283 3.800 4.672 . 0 0 "[ . 1 . 2]" 1
1164 1 90 ARG HB2 1 91 LEU H . . 4.020 3.110 2.579 4.015 . 0 0 "[ . 1 . 2]" 1
1165 1 90 ARG HB3 1 91 LEU H . . 4.020 3.051 2.378 3.766 . 0 0 "[ . 1 . 2]" 1
1166 1 91 LEU H 1 91 LEU HB2 . . 3.840 3.628 3.611 3.646 . 0 0 "[ . 1 . 2]" 1
1167 1 91 LEU H 1 91 LEU HB3 . . 3.480 2.522 2.466 2.578 . 0 0 "[ . 1 . 2]" 1
1168 1 91 LEU H 1 91 LEU MD1 . . 5.540 3.850 3.765 3.953 . 0 0 "[ . 1 . 2]" 1
1169 1 91 LEU H 1 91 LEU QD . . 4.940 3.001 2.941 3.076 . 0 0 "[ . 1 . 2]" 1
1170 1 91 LEU H 1 91 LEU MD2 . . 5.540 3.132 3.044 3.229 . 0 0 "[ . 1 . 2]" 1
1171 1 91 LEU H 1 91 LEU HG . . 2.940 2.441 2.325 2.590 . 0 0 "[ . 1 . 2]" 1
1172 1 91 LEU H 1 92 VAL H . . 3.190 2.578 2.483 2.659 . 0 0 "[ . 1 . 2]" 1
1173 1 91 LEU HA 1 91 LEU HG . . 3.770 3.718 3.702 3.739 . 0 0 "[ . 1 . 2]" 1
1174 1 91 LEU HA 1 94 VAL H . . 4.270 3.226 3.039 3.426 . 0 0 "[ . 1 . 2]" 1
1175 1 91 LEU HA 1 95 ILE H . . 4.700 4.123 3.808 4.626 . 0 0 "[ . 1 . 2]" 1
1176 1 91 LEU HA 1 95 ILE MD . . 7.020 4.901 4.664 5.222 . 0 0 "[ . 1 . 2]" 1
1177 1 91 LEU HB2 1 92 VAL H . . 4.270 3.927 3.876 3.994 . 0 0 "[ . 1 . 2]" 1
1178 1 91 LEU HB3 1 92 VAL H . . 3.880 3.916 3.876 3.965 0.085 13 0 "[ . 1 . 2]" 1
1179 1 91 LEU HB3 1 92 VAL MG2 . . 5.470 4.868 4.754 5.003 . 0 0 "[ . 1 . 2]" 1
1180 1 91 LEU MD1 1 92 VAL H . . 4.790 2.725 2.511 2.861 . 0 0 "[ . 1 . 2]" 1
1181 1 91 LEU MD2 1 92 VAL H . . 4.790 3.857 3.779 3.939 . 0 0 "[ . 1 . 2]" 1
1182 1 91 LEU HG 1 92 VAL H . . 3.590 2.147 2.047 2.241 . 0 0 "[ . 1 . 2]" 1
1183 1 91 LEU HG 1 95 ILE MD . . 4.430 4.452 4.306 4.491 0.061 16 0 "[ . 1 . 2]" 1
1184 1 92 VAL H 1 92 VAL HB . . 3.230 2.535 2.459 2.599 . 0 0 "[ . 1 . 2]" 1
1185 1 92 VAL H 1 92 VAL MG2 . . 3.420 2.128 2.054 2.230 . 0 0 "[ . 1 . 2]" 1
1186 1 92 VAL H 1 93 ALA H . . 3.410 2.662 2.526 2.771 . 0 0 "[ . 1 . 2]" 1
1187 1 92 VAL HA 1 92 VAL MG2 . . 3.740 2.367 2.325 2.426 . 0 0 "[ . 1 . 2]" 1
1188 1 92 VAL HA 1 95 ILE H . . 4.270 3.384 3.090 3.582 . 0 0 "[ . 1 . 2]" 1
1189 1 92 VAL HA 1 95 ILE HB . . 3.950 2.772 2.356 3.093 . 0 0 "[ . 1 . 2]" 1
1190 1 92 VAL HA 1 95 ILE MD . . 5.180 2.138 1.780 2.579 . 0 0 "[ . 1 . 2]" 1
1191 1 92 VAL HB 1 93 ALA H . . 3.190 2.644 2.543 2.813 . 0 0 "[ . 1 . 2]" 1
1192 1 92 VAL MG1 1 93 ALA H . . 4.750 3.431 3.291 3.647 . 0 0 "[ . 1 . 2]" 1
1193 1 92 VAL MG1 1 95 ILE MD . . 6.780 3.305 2.318 3.938 . 0 0 "[ . 1 . 2]" 1
1194 1 92 VAL MG1 1 96 LYS H . . 6.480 4.127 3.842 4.561 . 0 0 "[ . 1 . 2]" 1
1195 1 92 VAL MG1 1 96 LYS HD2 . . 4.930 3.388 2.048 4.383 . 0 0 "[ . 1 . 2]" 1
1196 1 92 VAL MG1 1 96 LYS QD . . 4.690 2.982 1.885 4.104 . 0 0 "[ . 1 . 2]" 1
1197 1 92 VAL MG1 1 96 LYS HD3 . . 4.930 3.697 2.166 4.981 0.051 6 0 "[ . 1 . 2]" 1
1198 1 92 VAL MG1 1 96 LYS HE2 . . 5.110 3.039 1.770 4.129 . 0 0 "[ . 1 . 2]" 1
1199 1 92 VAL MG1 1 96 LYS QE . . 4.670 2.342 1.758 3.838 . 0 0 "[ . 1 . 2]" 1
1200 1 92 VAL MG1 1 96 LYS HE3 . . 5.110 2.907 1.813 4.620 . 0 0 "[ . 1 . 2]" 1
1201 1 92 VAL MG2 1 93 ALA H . . 4.680 3.852 3.780 3.958 . 0 0 "[ . 1 . 2]" 1
1202 1 92 VAL MG2 1 95 ILE MD . . 6.820 3.019 2.531 3.445 . 0 0 "[ . 1 . 2]" 1
1203 1 93 ALA H 1 94 VAL H . . 3.340 2.704 2.571 2.798 . 0 0 "[ . 1 . 2]" 1
1204 1 93 ALA HA 1 96 LYS HB2 . . 4.380 2.835 2.530 4.531 0.151 8 0 "[ . 1 . 2]" 1
1205 1 93 ALA HA 1 96 LYS QB . . 3.890 2.764 2.507 3.867 . 0 0 "[ . 1 . 2]" 1
1206 1 93 ALA HA 1 96 LYS HB3 . . 4.380 4.269 2.969 4.444 0.064 2 0 "[ . 1 . 2]" 1
1207 1 93 ALA HA 1 96 LYS HD2 . . 5.930 3.735 2.189 5.913 . 0 0 "[ . 1 . 2]" 1
1208 1 93 ALA HA 1 96 LYS QD . . 5.600 3.155 2.063 4.614 . 0 0 "[ . 1 . 2]" 1
1209 1 93 ALA HA 1 96 LYS HD3 . . 5.930 4.051 2.074 5.131 . 0 0 "[ . 1 . 2]" 1
1210 1 93 ALA HA 1 96 LYS HE2 . . 6.000 4.637 2.701 6.005 0.005 12 0 "[ . 1 . 2]" 1
1211 1 93 ALA HA 1 96 LYS QE . . 5.700 3.706 1.793 4.964 . 0 0 "[ . 1 . 2]" 1
1212 1 93 ALA HA 1 96 LYS HE3 . . 6.000 4.022 1.802 5.655 . 0 0 "[ . 1 . 2]" 1
1213 1 93 ALA MB 1 94 VAL H . . 3.530 2.489 2.380 2.590 . 0 0 "[ . 1 . 2]" 1
1214 1 93 ALA MB 1 94 VAL HA . . 5.180 3.860 3.819 3.919 . 0 0 "[ . 1 . 2]" 1
1215 1 94 VAL H 1 94 VAL HB . . 3.050 2.533 2.342 2.720 . 0 0 "[ . 1 . 2]" 1
1216 1 94 VAL H 1 94 VAL MG1 . . 4.540 3.768 3.717 3.793 . 0 0 "[ . 1 . 2]" 1
1217 1 94 VAL H 1 94 VAL MG2 . . 3.810 2.095 1.802 2.428 . 0 0 "[ . 1 . 2]" 1
1218 1 94 VAL H 1 95 ILE H . . 2.980 2.739 2.677 2.817 . 0 0 "[ . 1 . 2]" 1
1219 1 94 VAL HA 1 97 GLU HB2 . . 4.130 2.657 1.980 4.404 0.274 10 0 "[ . 1 . 2]" 1
1220 1 94 VAL HA 1 97 GLU QB . . 3.980 2.600 1.968 3.772 . 0 0 "[ . 1 . 2]" 1
1221 1 94 VAL HA 1 97 GLU HB3 . . 4.130 4.068 3.407 4.199 0.069 14 0 "[ . 1 . 2]" 1
1222 1 94 VAL HA 1 97 GLU HG2 . . 6.000 3.514 1.761 4.488 . 0 0 "[ . 1 . 2]" 1
1223 1 94 VAL HA 1 97 GLU QG . . 5.650 2.609 1.714 3.536 . 0 0 "[ . 1 . 2]" 1
1224 1 94 VAL HA 1 97 GLU HG3 . . 6.000 2.802 1.991 3.862 . 0 0 "[ . 1 . 2]" 1
1225 1 94 VAL HA 1 98 LEU H . . 4.780 4.301 3.817 4.812 0.032 18 0 "[ . 1 . 2]" 1
1226 1 94 VAL HB 1 95 ILE H . . 3.340 2.570 2.414 2.843 . 0 0 "[ . 1 . 2]" 1
1227 1 94 VAL MG1 1 95 ILE H . . 4.140 3.346 3.145 3.651 . 0 0 "[ . 1 . 2]" 1
1228 1 94 VAL MG1 1 95 ILE HA . . 5.000 3.447 3.235 3.788 . 0 0 "[ . 1 . 2]" 1
1229 1 94 VAL MG1 1 97 GLU H . . 7.020 4.408 4.191 4.714 . 0 0 "[ . 1 . 2]" 1
1230 1 94 VAL MG1 1 98 LEU H . . 5.940 4.073 3.722 4.570 . 0 0 "[ . 1 . 2]" 1
1231 1 94 VAL MG2 1 95 ILE H . . 4.710 3.827 3.584 4.089 . 0 0 "[ . 1 . 2]" 1
1232 1 95 ILE H 1 95 ILE HB . . 2.760 2.515 2.376 2.604 . 0 0 "[ . 1 . 2]" 1
1233 1 95 ILE H 1 95 ILE MD . . 4.210 3.531 3.368 3.630 . 0 0 "[ . 1 . 2]" 1
1234 1 95 ILE H 1 95 ILE QG . . 4.140 2.089 1.874 2.308 . 0 0 "[ . 1 . 2]" 1
1235 1 95 ILE H 1 95 ILE MG . . 4.500 3.762 3.730 3.776 . 0 0 "[ . 1 . 2]" 1
1236 1 95 ILE H 1 96 LYS H . . 3.120 2.764 2.674 2.865 . 0 0 "[ . 1 . 2]" 1
1237 1 95 ILE HA 1 95 ILE QG . . 3.760 2.381 2.288 2.479 . 0 0 "[ . 1 . 2]" 1
1238 1 95 ILE HA 1 98 LEU H . . 4.600 3.669 3.197 4.293 . 0 0 "[ . 1 . 2]" 1
1239 1 95 ILE HB 1 96 LYS H . . 2.940 2.616 2.470 2.841 . 0 0 "[ . 1 . 2]" 1
1240 1 95 ILE MD 1 96 LYS H . . 5.080 4.576 4.425 4.802 . 0 0 "[ . 1 . 2]" 1
1241 1 95 ILE QG 1 96 LYS H . . 5.220 4.046 3.921 4.186 . 0 0 "[ . 1 . 2]" 1
1242 1 95 ILE MG 1 96 LYS H . . 3.810 3.342 2.988 3.615 . 0 0 "[ . 1 . 2]" 1
1243 1 95 ILE MG 1 96 LYS HE2 . . 6.330 5.245 3.988 6.426 0.096 4 0 "[ . 1 . 2]" 1
1244 1 95 ILE MG 1 96 LYS QE . . 5.950 4.690 3.715 5.515 . 0 0 "[ . 1 . 2]" 1
1245 1 95 ILE MG 1 96 LYS HE3 . . 6.330 5.424 4.100 6.391 0.061 13 0 "[ . 1 . 2]" 1
1246 1 96 LYS H 1 96 LYS HD2 . . 5.640 4.026 2.471 4.933 . 0 0 "[ . 1 . 2]" 1
1247 1 96 LYS H 1 96 LYS QD . . 5.020 3.479 2.271 4.510 . 0 0 "[ . 1 . 2]" 1
1248 1 96 LYS H 1 96 LYS HD3 . . 5.640 4.100 2.376 5.666 0.026 14 0 "[ . 1 . 2]" 1
1249 1 96 LYS H 1 96 LYS HG2 . . 4.850 3.721 1.888 4.524 . 0 0 "[ . 1 . 2]" 1
1250 1 96 LYS H 1 96 LYS HG3 . . 3.880 2.994 2.056 4.130 0.250 18 0 "[ . 1 . 2]" 1
1251 1 96 LYS H 1 97 GLU H . . 3.080 2.573 2.408 2.750 . 0 0 "[ . 1 . 2]" 1
1252 1 96 LYS HA 1 99 THR H . . 4.630 3.447 3.090 3.660 . 0 0 "[ . 1 . 2]" 1
1253 1 96 LYS HA 1 100 ALA H . . 5.240 4.000 2.903 4.864 . 0 0 "[ . 1 . 2]" 1
1254 1 96 LYS HB2 1 97 GLU H . . 4.920 3.043 2.645 3.807 . 0 0 "[ . 1 . 2]" 1
1255 1 96 LYS HB3 1 97 GLU H . . 4.920 3.674 2.892 4.196 . 0 0 "[ . 1 . 2]" 1
1256 1 96 LYS QD 1 97 GLU H . . 6.880 4.846 4.211 5.664 . 0 0 "[ . 1 . 2]" 1
1257 1 97 GLU H 1 97 GLU HA . . 2.940 2.832 2.744 2.870 . 0 0 "[ . 1 . 2]" 1
1258 1 97 GLU H 1 97 GLU HB2 . . 3.660 2.480 2.115 3.616 . 0 0 "[ . 1 . 2]" 1
1259 1 97 GLU H 1 97 GLU QB . . 3.480 2.401 2.096 2.727 . 0 0 "[ . 1 . 2]" 1
1260 1 97 GLU H 1 97 GLU HB3 . . 3.660 3.547 2.821 3.623 . 0 0 "[ . 1 . 2]" 1
1261 1 97 GLU H 1 97 GLU HG2 . . 4.240 2.840 2.029 3.606 . 0 0 "[ . 1 . 2]" 1
1262 1 97 GLU H 1 97 GLU QG . . 3.520 2.377 1.993 2.941 . 0 0 "[ . 1 . 2]" 1
1263 1 97 GLU H 1 97 GLU HG3 . . 4.240 3.133 2.272 4.051 . 0 0 "[ . 1 . 2]" 1
1264 1 97 GLU H 1 98 LEU H . . 3.080 2.618 2.411 2.894 . 0 0 "[ . 1 . 2]" 1
1265 1 97 GLU HA 1 100 ALA H . . 4.200 3.946 3.450 4.292 0.092 4 0 "[ . 1 . 2]" 1
1266 1 97 GLU HA 1 100 ALA MB . . 4.710 3.337 2.516 4.535 . 0 0 "[ . 1 . 2]" 1
1267 1 97 GLU QB 1 98 LEU H . . 3.780 2.693 2.414 3.573 . 0 0 "[ . 1 . 2]" 1
1268 1 97 GLU HB2 1 98 LEU H . . 4.160 2.783 2.464 3.859 . 0 0 "[ . 1 . 2]" 1
1269 1 97 GLU HB3 1 98 LEU H . . 4.160 3.648 3.214 4.216 0.056 10 0 "[ . 1 . 2]" 1
1270 1 97 GLU QG 1 98 LEU H . . 4.970 4.066 2.474 4.419 . 0 0 "[ . 1 . 2]" 1
1271 1 97 GLU QG 1 98 LEU QD . . 8.870 3.851 1.968 4.251 . 0 0 "[ . 1 . 2]" 1
1272 1 98 LEU H 1 98 LEU HB2 . . 3.520 2.236 2.170 2.305 . 0 0 "[ . 1 . 2]" 1
1273 1 98 LEU H 1 98 LEU QB . . 3.350 2.213 2.149 2.278 . 0 0 "[ . 1 . 2]" 1
1274 1 98 LEU H 1 98 LEU HB3 . . 3.520 3.520 3.467 3.564 0.044 16 0 "[ . 1 . 2]" 1
1275 1 98 LEU H 1 98 LEU MD1 . . 4.930 2.741 2.262 4.088 . 0 0 "[ . 1 . 2]" 1
1276 1 98 LEU H 1 98 LEU MD2 . . 4.930 3.543 2.273 4.098 . 0 0 "[ . 1 . 2]" 1
1277 1 98 LEU H 1 98 LEU HG . . 4.020 4.043 3.901 4.129 0.109 8 0 "[ . 1 . 2]" 1
1278 1 98 LEU H 1 99 THR H . . 3.230 2.483 2.296 2.637 . 0 0 "[ . 1 . 2]" 1
1279 1 98 LEU H 1 100 ALA H . . 4.450 4.049 3.634 4.403 . 0 0 "[ . 1 . 2]" 1
1280 1 98 LEU QB 1 99 THR MG . . 6.530 3.539 2.761 5.233 . 0 0 "[ . 1 . 2]" 1
1281 1 98 LEU HB2 1 99 THR H . . 5.710 3.104 2.811 3.500 . 0 0 "[ . 1 . 2]" 1
1282 1 98 LEU HB3 1 99 THR H . . 5.710 3.650 3.392 4.072 . 0 0 "[ . 1 . 2]" 1
1283 1 98 LEU QD 1 99 THR H . . 6.480 3.981 3.886 4.099 . 0 0 "[ . 1 . 2]" 1
1284 1 98 LEU HG 1 99 THR H . . 5.420 5.272 5.137 5.515 0.095 9 0 "[ . 1 . 2]" 1
1285 1 99 THR H 1 99 THR MG . . 3.960 2.972 2.516 3.895 . 0 0 "[ . 1 . 2]" 1
1286 1 99 THR H 1 100 ALA H . . 3.160 2.421 2.078 2.916 . 0 0 "[ . 1 . 2]" 1
1287 1 99 THR H 1 100 ALA MB . . 5.360 4.129 3.965 4.405 . 0 0 "[ . 1 . 2]" 1
1288 1 99 THR HB 1 100 ALA H . . 4.380 3.677 2.465 4.422 0.042 11 0 "[ . 1 . 2]" 1
1289 1 99 THR MG 1 100 ALA H . . 5.430 4.106 3.583 4.358 . 0 0 "[ . 1 . 2]" 1
1290 1 100 ALA H 1 100 ALA HA . . 2.900 2.886 2.801 2.935 0.035 6 0 "[ . 1 . 2]" 1
1291 1 100 ALA H 1 100 ALA MB . . 3.670 2.292 2.235 2.356 . 0 0 "[ . 1 . 2]" 1
1292 1 100 ALA H 1 101 GLU H . . 4.780 4.514 4.304 4.620 . 0 0 "[ . 1 . 2]" 1
1293 1 100 ALA HA 1 101 GLU H . . 3.160 2.295 2.127 2.523 . 0 0 "[ . 1 . 2]" 1
1294 1 100 ALA MB 1 101 GLU H . . 3.960 2.739 2.249 3.346 . 0 0 "[ . 1 . 2]" 1
1295 1 101 GLU H 1 101 GLU HB2 . . 3.300 2.407 2.087 2.683 . 0 0 "[ . 1 . 2]" 1
1296 1 101 GLU H 1 101 GLU QB . . 3.070 2.309 2.068 2.485 . 0 0 "[ . 1 . 2]" 1
1297 1 101 GLU H 1 101 GLU HB3 . . 3.300 3.247 2.331 3.564 0.264 8 0 "[ . 1 . 2]" 1
1298 1 101 GLU H 1 101 GLU HG2 . . 4.630 3.715 2.807 4.620 . 0 0 "[ . 1 . 2]" 1
1299 1 101 GLU H 1 101 GLU QG . . 4.180 2.849 1.928 4.076 . 0 0 "[ . 1 . 2]" 1
1300 1 101 GLU H 1 101 GLU HG3 . . 4.630 3.123 1.945 4.612 . 0 0 "[ . 1 . 2]" 1
1301 1 101 GLU H 1 102 GLN H . . 5.320 3.999 2.553 4.556 . 0 0 "[ . 1 . 2]" 1
1302 1 104 SER H 1 104 SER HB2 . . 3.950 3.155 2.570 3.882 . 0 0 "[ . 1 . 2]" 1
1303 1 104 SER H 1 104 SER HB3 . . 3.950 3.328 2.500 4.035 0.085 11 0 "[ . 1 . 2]" 1
1304 1 106 ARG QB 1 107 ALA H . . 4.440 3.404 1.758 4.017 . 0 0 "[ . 1 . 2]" 1
1305 1 106 ARG HB2 1 107 ALA H . . 4.670 4.149 3.266 4.592 . 0 0 "[ . 1 . 2]" 1
1306 1 106 ARG HB3 1 107 ALA H . . 4.670 3.708 1.765 4.466 . 0 0 "[ . 1 . 2]" 1
1307 1 107 ALA HA 1 108 THR H . . 3.260 2.471 2.128 3.172 . 0 0 "[ . 1 . 2]" 1
1308 1 108 THR H 1 108 THR MG . . 4.250 3.309 1.914 4.024 . 0 0 "[ . 1 . 2]" 1
1309 1 108 THR H 1 109 ARG H . . 4.310 3.953 2.205 4.380 0.070 9 0 "[ . 1 . 2]" 1
1310 1 108 THR HA 1 109 ARG H . . 3.050 2.340 2.111 3.206 0.156 11 0 "[ . 1 . 2]" 1
1311 1 108 THR HB 1 109 ARG H . . 6.000 4.047 1.969 4.526 . 0 0 "[ . 1 . 2]" 1
1312 1 108 THR MG 1 109 ARG H . . 6.800 3.333 2.440 4.282 . 0 0 "[ . 1 . 2]" 1
1313 1 110 PRO HA 1 111 THR H . . 3.080 2.288 2.127 2.949 . 0 0 "[ . 1 . 2]" 1
1314 1 111 THR MG 1 112 ARG H . . 7.020 3.303 2.009 4.291 . 0 0 "[ . 1 . 2]" 1
1315 1 112 ARG HA 1 112 ARG HG2 . . 3.880 3.045 2.380 3.794 . 0 0 "[ . 1 . 2]" 1
1316 1 112 ARG HA 1 112 ARG QG . . 3.540 2.600 2.245 3.448 . 0 0 "[ . 1 . 2]" 1
1317 1 112 ARG HA 1 112 ARG HG3 . . 3.880 3.079 2.319 4.236 0.356 18 0 "[ . 1 . 2]" 1
1318 1 119 LEU HB2 1 120 SER H . . 5.960 3.801 2.361 4.548 . 0 0 "[ . 1 . 2]" 1
1319 1 119 LEU HB3 1 120 SER H . . 5.960 3.940 1.861 4.484 . 0 0 "[ . 1 . 2]" 1
1320 1 119 LEU HG 1 120 SER H . . 6.000 4.091 1.730 5.215 . 0 0 "[ . 1 . 2]" 1
1321 1 122 LYS HA 1 123 ALA H . . 3.120 2.195 2.092 2.652 . 0 0 "[ . 1 . 2]" 1
1322 1 123 ALA HA 1 124 GLN H . . 2.940 2.241 2.101 2.841 . 0 0 "[ . 1 . 2]" 1
1323 1 123 ALA MB 1 124 GLN H . . 3.890 3.144 2.601 3.644 . 0 0 "[ . 1 . 2]" 1
1324 1 124 GLN H 1 124 GLN HB2 . . 3.800 3.133 2.435 3.882 0.082 12 0 "[ . 1 . 2]" 1
1325 1 124 GLN H 1 124 GLN QB . . 3.430 2.736 2.400 3.175 . 0 0 "[ . 1 . 2]" 1
1326 1 124 GLN H 1 124 GLN HB3 . . 3.800 3.237 2.779 3.806 0.006 8 0 "[ . 1 . 2]" 1
1327 1 128 VAL HA 1 129 LYS H . . 3.300 2.274 2.111 3.185 . 0 0 "[ . 1 . 2]" 1
1328 1 128 VAL HB 1 129 LYS H . . 5.860 3.674 1.968 4.521 . 0 0 "[ . 1 . 2]" 1
1329 1 128 VAL QG 1 129 LYS H . . 7.450 3.084 2.221 3.751 . 0 0 "[ . 1 . 2]" 1
1330 1 129 LYS HA 1 130 ALA H . . 3.340 2.200 2.096 2.576 . 0 0 "[ . 1 . 2]" 1
1331 1 129 LYS QG 1 130 ALA H . . 4.940 3.740 2.726 4.698 . 0 0 "[ . 1 . 2]" 1
1332 1 130 ALA HA 1 131 LEU H . . 3.230 2.232 2.136 2.380 . 0 0 "[ . 1 . 2]" 1
1333 1 131 LEU H 1 131 LEU QB . . 3.890 2.901 2.329 3.335 . 0 0 "[ . 1 . 2]" 1
1334 1 131 LEU H 1 131 LEU HG . . 5.100 3.795 2.099 5.182 0.082 15 0 "[ . 1 . 2]" 1
1335 1 131 LEU QD 1 132 ARG H . . 6.670 3.261 2.161 4.323 . 0 0 "[ . 1 . 2]" 1
1336 1 131 LEU MD1 1 132 ARG H . . 7.020 3.514 2.176 4.831 . 0 0 "[ . 1 . 2]" 1
1337 1 131 LEU MD2 1 132 ARG H . . 7.020 4.367 2.739 5.255 . 0 0 "[ . 1 . 2]" 1
1338 1 132 ARG HA 1 133 GLY H . . 3.300 2.337 2.152 2.667 . 0 0 "[ . 1 . 2]" 1
1339 1 132 ARG QB 1 133 GLY H . . 4.170 2.919 1.934 3.973 . 0 0 "[ . 1 . 2]" 1
1340 1 132 ARG HB2 1 133 GLY H . . 4.520 3.567 2.086 4.531 0.011 7 0 "[ . 1 . 2]" 1
1341 1 132 ARG HB3 1 133 GLY H . . 4.520 3.469 1.947 4.420 . 0 0 "[ . 1 . 2]" 1
1342 1 134 LYS HA 1 135 VAL H . . 3.550 2.263 2.124 2.853 . 0 0 "[ . 1 . 2]" 1
1343 1 135 VAL HA 1 136 ARG H . . 3.230 2.251 2.124 2.708 . 0 0 "[ . 1 . 2]" 1
1344 1 135 VAL QG 1 136 ARG H . . 6.010 2.796 2.073 3.552 . 0 0 "[ . 1 . 2]" 1
1345 1 135 VAL MG1 1 136 ARG H . . 6.300 3.668 2.615 4.262 . 0 0 "[ . 1 . 2]" 1
1346 1 135 VAL MG2 1 136 ARG H . . 6.300 3.136 2.087 4.296 . 0 0 "[ . 1 . 2]" 1
1347 1 136 ARG HA 1 137 ARG H . . 3.050 2.252 2.102 2.661 . 0 0 "[ . 1 . 2]" 1
1348 1 136 ARG HG2 1 137 ARG H . . 6.000 4.490 2.427 5.620 . 0 0 "[ . 1 . 2]" 1
1349 1 136 ARG HG3 1 137 ARG H . . 6.000 4.076 2.803 5.424 . 0 0 "[ . 1 . 2]" 1
1350 1 138 PRO HA 1 139 LEU H . . 3.440 2.297 2.147 2.855 . 0 0 "[ . 1 . 2]" 1
1351 1 139 LEU H 1 139 LEU HB2 . . 4.160 2.943 2.236 4.048 . 0 0 "[ . 1 . 2]" 1
1352 1 139 LEU H 1 139 LEU QB . . 3.700 2.627 2.167 3.266 . 0 0 "[ . 1 . 2]" 1
1353 1 139 LEU H 1 139 LEU HB3 . . 4.160 3.299 2.555 3.831 . 0 0 "[ . 1 . 2]" 1
1354 1 139 LEU H 1 139 LEU HG . . 4.560 3.723 2.099 4.612 0.052 6 0 "[ . 1 . 2]" 1
1355 1 139 LEU HA 1 140 ASP H . . 2.870 2.193 2.091 2.389 . 0 0 "[ . 1 . 2]" 1
1356 1 139 LEU HB2 1 140 ASP H . . 4.520 4.089 2.946 4.599 0.079 15 0 "[ . 1 . 2]" 1
1357 1 139 LEU HB3 1 140 ASP H . . 4.520 3.826 2.592 4.331 . 0 0 "[ . 1 . 2]" 1
1358 1 139 LEU QD 1 140 ASP H . . 8.430 3.397 2.398 4.462 . 0 0 "[ . 1 . 2]" 1
1359 1 140 ASP H 1 140 ASP HB2 . . 4.200 3.225 2.432 3.818 . 0 0 "[ . 1 . 2]" 1
1360 1 140 ASP H 1 140 ASP QB . . 3.740 2.655 2.265 3.039 . 0 0 "[ . 1 . 2]" 1
1361 1 140 ASP H 1 140 ASP HB3 . . 4.200 2.989 2.418 3.737 . 0 0 "[ . 1 . 2]" 1
1362 1 140 ASP HA 1 141 LEU H . . 3.120 2.297 2.123 3.122 0.002 13 0 "[ . 1 . 2]" 1
1363 1 141 LEU MD1 1 142 GLU H . . 7.020 3.984 1.962 5.441 . 0 0 "[ . 1 . 2]" 1
1364 1 141 LEU MD2 1 142 GLU H . . 7.020 3.903 2.484 5.423 . 0 0 "[ . 1 . 2]" 1
1365 1 142 GLU H 1 142 GLU HB2 . . 3.980 3.213 2.150 3.793 . 0 0 "[ . 1 . 2]" 1
1366 1 142 GLU H 1 142 GLU HB3 . . 3.980 3.154 2.452 3.755 . 0 0 "[ . 1 . 2]" 1
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