NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
549540 |
2lvi   |
18571 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lvi
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 1283
_Distance_constraint_stats_list.Viol_count 1451
_Distance_constraint_stats_list.Viol_total 1687.894
_Distance_constraint_stats_list.Viol_max 0.672
_Distance_constraint_stats_list.Viol_rms 0.0206
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0033
_Distance_constraint_stats_list.Viol_average_violations_only 0.0582
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 ASP 0.518 0.139 9 0 "[ . 1 . 2]"
1 3 ASP 1.351 0.120 3 0 "[ . 1 . 2]"
1 4 MET 1.688 0.120 3 0 "[ . 1 . 2]"
1 5 GLU 0.359 0.139 9 0 "[ . 1 . 2]"
1 6 ARG 0.062 0.020 3 0 "[ . 1 . 2]"
1 7 ILE 1.397 0.102 17 0 "[ . 1 . 2]"
1 8 PHE 1.643 0.092 2 0 "[ . 1 . 2]"
1 9 LYS 0.371 0.053 16 0 "[ . 1 . 2]"
1 10 ARG 1.491 0.084 18 0 "[ . 1 . 2]"
1 11 PHE 3.583 0.102 17 0 "[ . 1 . 2]"
1 12 ASP 0.376 0.044 2 0 "[ . 1 . 2]"
1 13 THR 0.602 0.096 2 0 "[ . 1 . 2]"
1 14 ASN 0.946 0.333 5 0 "[ . 1 . 2]"
1 15 GLY 0.021 0.020 7 0 "[ . 1 . 2]"
1 16 ASP 0.139 0.082 2 0 "[ . 1 . 2]"
1 17 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 LYS 0.381 0.101 20 0 "[ . 1 . 2]"
1 19 ILE 1.195 0.091 8 0 "[ . 1 . 2]"
1 20 SER 2.846 0.147 13 0 "[ . 1 . 2]"
1 21 LEU 14.329 0.672 20 8 "[ . * -**** *+]"
1 22 SER 2.296 0.147 13 0 "[ . 1 . 2]"
1 23 GLU 5.533 0.672 20 8 "[ . * -**** *+]"
1 24 LEU 8.741 0.402 20 0 "[ . 1 . 2]"
1 25 THR 2.967 0.190 16 0 "[ . 1 . 2]"
1 26 ASP 3.857 0.140 8 0 "[ . 1 . 2]"
1 27 ALA 2.054 0.099 1 0 "[ . 1 . 2]"
1 28 LEU 6.550 0.175 13 0 "[ . 1 . 2]"
1 29 ARG 5.257 0.209 17 0 "[ . 1 . 2]"
1 30 THR 4.592 0.240 1 0 "[ . 1 . 2]"
1 31 LEU 3.268 0.226 9 0 "[ . 1 . 2]"
1 32 GLY 1.545 0.240 1 0 "[ . 1 . 2]"
1 33 SER 0.527 0.117 16 0 "[ . 1 . 2]"
1 34 THR 0.536 0.117 16 0 "[ . 1 . 2]"
1 35 SER 0.377 0.212 18 0 "[ . 1 . 2]"
1 36 ALA 0.631 0.212 18 0 "[ . 1 . 2]"
1 37 ASP 3.618 0.259 18 0 "[ . 1 . 2]"
1 38 GLU 0.883 0.103 2 0 "[ . 1 . 2]"
1 39 VAL 2.582 0.227 7 0 "[ . 1 . 2]"
1 40 GLN 4.161 0.259 18 0 "[ . 1 . 2]"
1 41 ARG 1.465 0.092 11 0 "[ . 1 . 2]"
1 42 MET 2.553 0.254 15 0 "[ . 1 . 2]"
1 43 MET 1.124 0.135 7 0 "[ . 1 . 2]"
1 44 ALA 0.151 0.069 11 0 "[ . 1 . 2]"
1 45 GLU 0.343 0.063 14 0 "[ . 1 . 2]"
1 46 ILE 2.051 0.121 4 0 "[ . 1 . 2]"
1 47 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 THR 1.354 0.168 12 0 "[ . 1 . 2]"
1 49 ASP 0.703 0.192 11 0 "[ . 1 . 2]"
1 50 GLY 0.557 0.192 11 0 "[ . 1 . 2]"
1 51 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 GLY 2.433 0.203 7 0 "[ . 1 . 2]"
1 53 PHE 2.165 0.164 12 0 "[ . 1 . 2]"
1 54 ILE 1.119 0.204 8 0 "[ . 1 . 2]"
1 55 ASP 1.624 0.124 18 0 "[ . 1 . 2]"
1 56 PHE 1.704 0.101 20 0 "[ . 1 . 2]"
1 57 ASN 3.342 0.124 18 0 "[ . 1 . 2]"
1 58 GLU 0.271 0.096 16 0 "[ . 1 . 2]"
1 59 PHE 0.097 0.035 4 0 "[ . 1 . 2]"
1 60 ILE 1.440 0.135 5 0 "[ . 1 . 2]"
1 61 SER 0.211 0.096 15 0 "[ . 1 . 2]"
1 62 PHE 3.124 0.181 20 0 "[ . 1 . 2]"
1 63 CYS 3.993 0.190 7 0 "[ . 1 . 2]"
1 64 ASN 0.073 0.047 12 0 "[ . 1 . 2]"
1 65 ALA 1.784 0.195 12 0 "[ . 1 . 2]"
1 66 ASN 6.620 0.339 8 0 "[ . 1 . 2]"
1 67 PRO 0.235 0.195 12 0 "[ . 1 . 2]"
1 68 GLY 0.457 0.087 1 0 "[ . 1 . 2]"
1 69 LEU 4.299 0.215 20 0 "[ . 1 . 2]"
1 70 MET 7.168 0.339 8 0 "[ . 1 . 2]"
1 71 LYS 0.381 0.168 18 0 "[ . 1 . 2]"
1 72 ASP 2.057 0.172 3 0 "[ . 1 . 2]"
1 73 VAL 2.443 0.155 5 0 "[ . 1 . 2]"
1 74 ALA 2.307 0.270 9 0 "[ . 1 . 2]"
1 75 LYS 1.807 0.289 12 0 "[ . 1 . 2]"
1 76 VAL 3.687 0.270 9 0 "[ . 1 . 2]"
1 77 PHE 0.388 0.041 3 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 ASP HA 1 3 ASP H . . 3.460 2.483 2.139 3.554 0.094 3 0 "[ . 1 . 2]" 1
2 1 2 ASP HA 1 4 MET H . . 4.340 4.178 3.576 4.387 0.047 4 0 "[ . 1 . 2]" 1
3 1 2 ASP QB 1 5 GLU H . . 3.230 2.762 2.010 3.257 0.027 9 0 "[ . 1 . 2]" 1
4 1 2 ASP QB 1 5 GLU HA . . 5.300 4.435 4.045 4.859 . 0 0 "[ . 1 . 2]" 1
5 1 2 ASP QB 1 5 GLU QB . . 3.670 2.297 1.955 3.809 0.139 9 0 "[ . 1 . 2]" 1
6 1 2 ASP QB 1 6 ARG H . . 4.110 2.476 1.916 4.130 0.020 3 0 "[ . 1 . 2]" 1
7 1 2 ASP HB2 1 3 ASP HA . . 5.500 4.837 4.107 5.340 . 0 0 "[ . 1 . 2]" 1
8 1 2 ASP HB3 1 3 ASP HA . . 5.500 4.613 4.185 5.580 0.080 18 0 "[ . 1 . 2]" 1
9 1 3 ASP H 1 3 ASP QB . . 3.420 2.608 2.318 3.088 . 0 0 "[ . 1 . 2]" 1
10 1 3 ASP H 1 74 ALA MB . . 5.500 3.976 3.828 4.175 . 0 0 "[ . 1 . 2]" 1
11 1 3 ASP HA 1 6 ARG H . . 5.230 4.896 4.082 5.166 . 0 0 "[ . 1 . 2]" 1
12 1 3 ASP HA 1 6 ARG HB2 . . 5.500 5.246 4.301 5.506 0.006 16 0 "[ . 1 . 2]" 1
13 1 3 ASP HA 1 6 ARG QB . . 4.710 4.440 3.775 4.711 0.001 20 0 "[ . 1 . 2]" 1
14 1 3 ASP HA 1 6 ARG HB3 . . 5.500 4.801 4.180 5.126 . 0 0 "[ . 1 . 2]" 1
15 1 3 ASP HA 1 73 VAL H . . 5.010 4.909 4.597 5.066 0.056 12 0 "[ . 1 . 2]" 1
16 1 3 ASP HA 1 74 ALA H . . 3.830 3.870 3.806 3.921 0.091 12 0 "[ . 1 . 2]" 1
17 1 3 ASP HA 1 74 ALA MB . . 5.500 2.009 1.908 2.333 . 0 0 "[ . 1 . 2]" 1
18 1 3 ASP QB 1 4 MET H . . 3.420 2.723 2.371 3.540 0.120 3 0 "[ . 1 . 2]" 1
19 1 3 ASP QB 1 4 MET ME . . 4.070 3.099 2.809 3.939 . 0 0 "[ . 1 . 2]" 1
20 1 3 ASP QB 1 70 MET HA . . 5.340 4.947 4.005 5.365 0.025 9 0 "[ . 1 . 2]" 1
21 1 3 ASP QB 1 73 VAL H . . 5.260 4.961 2.928 5.260 . 0 0 "[ . 1 . 2]" 1
22 1 3 ASP QB 1 74 ALA H . . 5.070 4.657 3.073 5.048 . 0 0 "[ . 1 . 2]" 1
23 1 3 ASP QB 1 74 ALA MB . . 4.690 3.515 3.000 3.909 . 0 0 "[ . 1 . 2]" 1
24 1 3 ASP HB2 1 4 MET H . . 3.950 2.818 2.415 3.984 0.034 3 0 "[ . 1 . 2]" 1
25 1 3 ASP HB3 1 4 MET H . . 3.950 3.732 3.457 3.963 0.013 3 0 "[ . 1 . 2]" 1
26 1 4 MET H 1 4 MET HB2 . . 3.870 3.782 3.752 3.808 . 0 0 "[ . 1 . 2]" 1
27 1 4 MET H 1 4 MET HB3 . . 3.170 3.111 2.905 3.194 0.024 20 0 "[ . 1 . 2]" 1
28 1 4 MET H 1 4 MET ME . . 4.060 3.706 3.630 3.739 . 0 0 "[ . 1 . 2]" 1
29 1 4 MET H 1 4 MET HG2 . . 3.710 2.627 2.498 2.985 . 0 0 "[ . 1 . 2]" 1
30 1 4 MET H 1 4 MET HG3 . . 4.470 3.892 3.816 4.018 . 0 0 "[ . 1 . 2]" 1
31 1 4 MET H 1 7 ILE MD . . 5.500 4.809 4.364 4.976 . 0 0 "[ . 1 . 2]" 1
32 1 4 MET HA 1 4 MET ME . . 5.500 4.139 4.011 4.433 . 0 0 "[ . 1 . 2]" 1
33 1 4 MET HA 1 6 ARG H . . 5.500 4.008 3.590 4.476 . 0 0 "[ . 1 . 2]" 1
34 1 4 MET HA 1 7 ILE H . . 3.490 3.379 3.218 3.514 0.024 3 0 "[ . 1 . 2]" 1
35 1 4 MET HA 1 7 ILE HB . . 5.500 3.528 3.216 3.764 . 0 0 "[ . 1 . 2]" 1
36 1 4 MET HA 1 7 ILE MD . . 4.940 2.563 2.021 2.929 . 0 0 "[ . 1 . 2]" 1
37 1 4 MET HA 1 8 PHE H . . 4.680 4.064 3.850 4.349 . 0 0 "[ . 1 . 2]" 1
38 1 4 MET HA 1 59 PHE QE . . 5.400 4.057 3.837 4.379 . 0 0 "[ . 1 . 2]" 1
39 1 4 MET HB2 1 4 MET HG2 . . 2.980 2.637 2.618 2.709 . 0 0 "[ . 1 . 2]" 1
40 1 4 MET HB2 1 59 PHE QE . . 4.540 2.094 1.967 2.441 . 0 0 "[ . 1 . 2]" 1
41 1 4 MET HB2 1 60 ILE HA . . 5.500 4.860 4.547 5.162 . 0 0 "[ . 1 . 2]" 1
42 1 4 MET HB2 1 60 ILE MD . . 4.660 3.191 2.748 3.534 . 0 0 "[ . 1 . 2]" 1
43 1 4 MET HB3 1 60 ILE HA . . 5.500 5.277 5.033 5.517 0.017 15 0 "[ . 1 . 2]" 1
44 1 4 MET HB3 1 60 ILE MD . . 4.660 3.728 3.478 4.018 . 0 0 "[ . 1 . 2]" 1
45 1 4 MET HB3 1 63 CYS QB . . 5.340 3.636 2.744 4.156 . 0 0 "[ . 1 . 2]" 1
46 1 4 MET ME 1 4 MET HG2 . . 3.950 3.384 3.361 3.397 . 0 0 "[ . 1 . 2]" 1
47 1 4 MET ME 1 4 MET HG3 . . 2.740 2.381 2.286 2.445 . 0 0 "[ . 1 . 2]" 1
48 1 4 MET ME 1 59 PHE QE . . 5.500 4.137 3.650 4.402 . 0 0 "[ . 1 . 2]" 1
49 1 4 MET ME 1 60 ILE HA . . 4.640 3.741 3.414 4.074 . 0 0 "[ . 1 . 2]" 1
50 1 4 MET ME 1 60 ILE MD . . 5.500 2.495 2.187 2.678 . 0 0 "[ . 1 . 2]" 1
51 1 4 MET ME 1 60 ILE QG . . 5.500 4.420 4.035 4.606 . 0 0 "[ . 1 . 2]" 1
52 1 4 MET ME 1 60 ILE MG . . 5.500 2.973 2.657 3.191 . 0 0 "[ . 1 . 2]" 1
53 1 4 MET ME 1 63 CYS QB . . 5.340 2.835 1.842 3.604 . 0 0 "[ . 1 . 2]" 1
54 1 4 MET ME 1 65 ALA HA . . 5.500 4.947 4.612 5.162 . 0 0 "[ . 1 . 2]" 1
55 1 4 MET HG2 1 5 GLU H . . 4.250 2.159 2.051 2.404 . 0 0 "[ . 1 . 2]" 1
56 1 4 MET HG2 1 8 PHE HB3 . . 4.900 4.868 4.539 4.935 0.035 8 0 "[ . 1 . 2]" 1
57 1 4 MET HG2 1 60 ILE MD . . 4.060 3.178 2.999 3.271 . 0 0 "[ . 1 . 2]" 1
58 1 4 MET HG3 1 5 GLU H . . 4.810 3.883 3.786 4.109 . 0 0 "[ . 1 . 2]" 1
59 1 4 MET HG3 1 8 PHE HB3 . . 5.500 5.528 5.466 5.592 0.092 2 0 "[ . 1 . 2]" 1
60 1 4 MET HG3 1 60 ILE HA . . 4.350 4.270 3.801 4.430 0.080 2 0 "[ . 1 . 2]" 1
61 1 4 MET HG3 1 60 ILE MD . . 5.500 2.012 1.934 2.089 . 0 0 "[ . 1 . 2]" 1
62 1 4 MET HG3 1 60 ILE QG . . 5.500 3.999 3.883 4.105 . 0 0 "[ . 1 . 2]" 1
63 1 5 GLU H 1 5 GLU QB . . 2.720 2.348 2.136 2.623 . 0 0 "[ . 1 . 2]" 1
64 1 5 GLU H 1 5 GLU QG . . 3.440 2.592 1.959 3.449 0.009 4 0 "[ . 1 . 2]" 1
65 1 5 GLU H 1 6 ARG H . . 3.100 2.670 2.444 2.859 . 0 0 "[ . 1 . 2]" 1
66 1 5 GLU H 1 6 ARG HA . . 5.500 5.267 5.075 5.416 . 0 0 "[ . 1 . 2]" 1
67 1 5 GLU H 1 7 ILE H . . 4.410 4.036 3.933 4.104 . 0 0 "[ . 1 . 2]" 1
68 1 5 GLU H 1 60 ILE MD . . 5.500 4.924 4.847 4.993 . 0 0 "[ . 1 . 2]" 1
69 1 5 GLU HA 1 5 GLU QG . . 3.240 2.522 2.124 3.331 0.091 9 0 "[ . 1 . 2]" 1
70 1 5 GLU HA 1 8 PHE H . . 4.150 3.393 3.093 3.683 . 0 0 "[ . 1 . 2]" 1
71 1 5 GLU HA 1 8 PHE HB2 . . 4.660 3.838 3.513 4.414 . 0 0 "[ . 1 . 2]" 1
72 1 5 GLU HA 1 8 PHE HB3 . . 3.230 2.536 2.247 3.008 . 0 0 "[ . 1 . 2]" 1
73 1 5 GLU HA 1 8 PHE HD2 . . 5.500 3.506 3.219 3.826 . 0 0 "[ . 1 . 2]" 1
74 1 5 GLU HA 1 60 ILE MD . . 5.500 4.873 4.584 5.120 . 0 0 "[ . 1 . 2]" 1
75 1 5 GLU QB 1 6 ARG H . . 3.800 2.839 2.414 3.630 . 0 0 "[ . 1 . 2]" 1
76 1 5 GLU QB 1 8 PHE HB3 . . 5.340 4.453 4.149 4.822 . 0 0 "[ . 1 . 2]" 1
77 1 5 GLU HB2 1 6 ARG H . . 4.430 2.989 2.475 4.116 . 0 0 "[ . 1 . 2]" 1
78 1 5 GLU HB3 1 6 ARG H . . 4.430 3.659 3.000 4.110 . 0 0 "[ . 1 . 2]" 1
79 1 5 GLU HG2 1 6 ARG H . . 5.500 4.693 2.384 5.438 . 0 0 "[ . 1 . 2]" 1
80 1 5 GLU HG3 1 6 ARG H . . 5.500 4.590 2.726 5.248 . 0 0 "[ . 1 . 2]" 1
81 1 6 ARG H 1 6 ARG QB . . 2.520 2.253 2.212 2.319 . 0 0 "[ . 1 . 2]" 1
82 1 6 ARG H 1 6 ARG QD . . 4.840 4.337 4.071 4.650 . 0 0 "[ . 1 . 2]" 1
83 1 6 ARG H 1 6 ARG HG2 . . 5.500 4.570 4.465 4.680 . 0 0 "[ . 1 . 2]" 1
84 1 6 ARG H 1 6 ARG HG3 . . 5.500 4.429 4.309 4.507 . 0 0 "[ . 1 . 2]" 1
85 1 6 ARG HA 1 6 ARG HD2 . . 5.420 3.755 2.222 4.798 . 0 0 "[ . 1 . 2]" 1
86 1 6 ARG HA 1 6 ARG HD3 . . 5.420 3.505 1.999 4.799 . 0 0 "[ . 1 . 2]" 1
87 1 6 ARG HA 1 6 ARG HG2 . . 4.050 3.434 2.746 3.822 . 0 0 "[ . 1 . 2]" 1
88 1 6 ARG HA 1 6 ARG QG . . 3.230 2.623 2.289 3.089 . 0 0 "[ . 1 . 2]" 1
89 1 6 ARG HA 1 6 ARG HG3 . . 4.050 2.741 2.341 3.261 . 0 0 "[ . 1 . 2]" 1
90 1 6 ARG HA 1 9 LYS H . . 4.790 4.385 3.917 4.738 . 0 0 "[ . 1 . 2]" 1
91 1 6 ARG HA 1 10 ARG H . . 5.060 4.708 4.415 5.072 0.012 12 0 "[ . 1 . 2]" 1
92 1 6 ARG QB 1 6 ARG QD . . 2.750 2.294 2.038 2.745 . 0 0 "[ . 1 . 2]" 1
93 1 6 ARG QB 1 6 ARG QG . . 2.320 2.041 1.994 2.086 . 0 0 "[ . 1 . 2]" 1
94 1 6 ARG QB 1 7 ILE H . . 3.450 3.006 2.860 3.279 . 0 0 "[ . 1 . 2]" 1
95 1 6 ARG QB 1 74 ALA HA . . 4.270 3.651 3.152 4.207 . 0 0 "[ . 1 . 2]" 1
96 1 6 ARG QG 1 7 ILE H . . 4.400 4.098 3.737 4.254 . 0 0 "[ . 1 . 2]" 1
97 1 6 ARG QG 1 7 ILE HA . . 4.140 4.025 3.624 4.153 0.013 16 0 "[ . 1 . 2]" 1
98 1 7 ILE H 1 7 ILE HB . . 2.940 2.885 2.809 2.993 0.053 12 0 "[ . 1 . 2]" 1
99 1 7 ILE H 1 7 ILE MD . . 4.550 3.671 3.621 3.837 . 0 0 "[ . 1 . 2]" 1
100 1 7 ILE H 1 7 ILE HG12 . . 2.990 2.909 2.696 3.041 0.051 12 0 "[ . 1 . 2]" 1
101 1 7 ILE H 1 7 ILE HG13 . . 2.970 1.983 1.915 2.189 . 0 0 "[ . 1 . 2]" 1
102 1 7 ILE H 1 8 PHE HB2 . . 5.090 4.882 4.479 5.068 . 0 0 "[ . 1 . 2]" 1
103 1 7 ILE H 1 8 PHE HB3 . . 4.440 4.193 3.979 4.355 . 0 0 "[ . 1 . 2]" 1
104 1 7 ILE H 1 9 LYS H . . 4.510 4.028 3.734 4.260 . 0 0 "[ . 1 . 2]" 1
105 1 7 ILE H 1 10 ARG H . . 4.840 4.536 4.354 4.681 . 0 0 "[ . 1 . 2]" 1
106 1 7 ILE H 1 10 ARG HB2 . . 5.500 4.639 4.394 4.918 . 0 0 "[ . 1 . 2]" 1
107 1 7 ILE H 1 74 ALA MB . . 5.160 3.988 3.416 4.635 . 0 0 "[ . 1 . 2]" 1
108 1 7 ILE HA 1 7 ILE MD . . 4.490 3.894 3.855 3.919 . 0 0 "[ . 1 . 2]" 1
109 1 7 ILE HA 1 7 ILE HG12 . . 3.370 2.800 2.733 2.864 . 0 0 "[ . 1 . 2]" 1
110 1 7 ILE HA 1 7 ILE HG13 . . 3.610 3.452 3.388 3.533 . 0 0 "[ . 1 . 2]" 1
111 1 7 ILE HA 1 10 ARG H . . 4.920 3.423 3.221 3.560 . 0 0 "[ . 1 . 2]" 1
112 1 7 ILE HA 1 10 ARG HB2 . . 4.460 2.357 2.051 2.500 . 0 0 "[ . 1 . 2]" 1
113 1 7 ILE HA 1 10 ARG HB3 . . 3.740 3.513 3.170 3.744 0.004 3 0 "[ . 1 . 2]" 1
114 1 7 ILE HA 1 10 ARG HD2 . . 5.500 4.960 4.065 5.509 0.009 14 0 "[ . 1 . 2]" 1
115 1 7 ILE HA 1 10 ARG QD . . 4.750 3.847 3.377 4.048 . 0 0 "[ . 1 . 2]" 1
116 1 7 ILE HA 1 10 ARG HD3 . . 5.500 4.116 3.605 4.836 . 0 0 "[ . 1 . 2]" 1
117 1 7 ILE HA 1 10 ARG HG2 . . 5.500 3.787 3.439 4.138 . 0 0 "[ . 1 . 2]" 1
118 1 7 ILE HA 1 11 PHE HD2 . . 5.500 4.385 4.178 4.641 . 0 0 "[ . 1 . 2]" 1
119 1 7 ILE HA 1 11 PHE HE2 . . 5.500 4.496 4.296 4.624 . 0 0 "[ . 1 . 2]" 1
120 1 7 ILE HB 1 7 ILE MD . . 3.080 2.483 2.447 2.521 . 0 0 "[ . 1 . 2]" 1
121 1 7 ILE HB 1 8 PHE H . . 3.460 2.525 2.178 2.836 . 0 0 "[ . 1 . 2]" 1
122 1 7 ILE HB 1 8 PHE HA . . 5.430 3.857 3.813 3.944 . 0 0 "[ . 1 . 2]" 1
123 1 7 ILE HB 1 8 PHE HB2 . . 5.500 4.385 4.150 4.526 . 0 0 "[ . 1 . 2]" 1
124 1 7 ILE HB 1 8 PHE HB3 . . 5.500 4.749 4.474 5.038 . 0 0 "[ . 1 . 2]" 1
125 1 7 ILE HB 1 10 ARG H . . 5.380 5.164 5.006 5.333 . 0 0 "[ . 1 . 2]" 1
126 1 7 ILE HB 1 11 PHE HB2 . . 5.500 5.558 5.520 5.602 0.102 17 0 "[ . 1 . 2]" 1
127 1 7 ILE HB 1 11 PHE HD2 . . 5.100 3.821 3.657 3.973 . 0 0 "[ . 1 . 2]" 1
128 1 7 ILE HB 1 59 PHE QE . . 5.500 3.512 3.287 3.742 . 0 0 "[ . 1 . 2]" 1
129 1 7 ILE MD 1 8 PHE H . . 4.970 4.313 4.068 4.494 . 0 0 "[ . 1 . 2]" 1
130 1 7 ILE MD 1 73 VAL HA . . 5.500 5.004 4.901 5.086 . 0 0 "[ . 1 . 2]" 1
131 1 7 ILE MD 1 74 ALA H . . 4.650 3.486 3.063 3.862 . 0 0 "[ . 1 . 2]" 1
132 1 7 ILE MD 1 74 ALA HA . . 3.750 3.191 2.703 3.562 . 0 0 "[ . 1 . 2]" 1
133 1 7 ILE MD 1 74 ALA MB . . 3.770 2.533 1.953 3.327 . 0 0 "[ . 1 . 2]" 1
134 1 7 ILE HG12 1 8 PHE H . . 5.470 4.487 4.375 4.561 . 0 0 "[ . 1 . 2]" 1
135 1 7 ILE HG12 1 74 ALA HA . . 5.500 3.156 2.602 3.685 . 0 0 "[ . 1 . 2]" 1
136 1 7 ILE HG12 1 74 ALA MB . . 5.200 2.915 2.185 3.923 . 0 0 "[ . 1 . 2]" 1
137 1 7 ILE HG13 1 8 PHE H . . 3.750 3.446 3.352 3.549 . 0 0 "[ . 1 . 2]" 1
138 1 7 ILE HG13 1 59 PHE QE . . 5.500 4.977 4.827 5.085 . 0 0 "[ . 1 . 2]" 1
139 1 7 ILE HG13 1 74 ALA HA . . 4.940 4.207 3.631 4.726 . 0 0 "[ . 1 . 2]" 1
140 1 7 ILE HG13 1 74 ALA MB . . 4.090 2.915 2.349 3.833 . 0 0 "[ . 1 . 2]" 1
141 1 7 ILE MG 1 8 PHE H . . 5.500 3.849 3.624 4.054 . 0 0 "[ . 1 . 2]" 1
142 1 7 ILE MG 1 11 PHE HE2 . . 4.340 1.923 1.878 1.962 . 0 0 "[ . 1 . 2]" 1
143 1 8 PHE H 1 8 PHE HB2 . . 3.640 2.717 2.630 2.793 . 0 0 "[ . 1 . 2]" 1
144 1 8 PHE H 1 8 PHE HB3 . . 3.230 2.362 2.305 2.440 . 0 0 "[ . 1 . 2]" 1
145 1 8 PHE H 1 8 PHE HD1 . . 5.500 4.810 4.678 4.954 . 0 0 "[ . 1 . 2]" 1
146 1 8 PHE H 1 8 PHE HD2 . . 5.500 4.540 4.355 4.709 . 0 0 "[ . 1 . 2]" 1
147 1 8 PHE H 1 9 LYS H . . 3.710 2.912 2.596 3.033 . 0 0 "[ . 1 . 2]" 1
148 1 8 PHE H 1 9 LYS QG . . 5.270 4.963 4.258 5.292 0.022 2 0 "[ . 1 . 2]" 1
149 1 8 PHE H 1 10 ARG H . . 4.150 3.957 3.777 4.114 . 0 0 "[ . 1 . 2]" 1
150 1 8 PHE H 1 10 ARG HB2 . . 5.500 4.748 4.503 5.007 . 0 0 "[ . 1 . 2]" 1
151 1 8 PHE H 1 11 PHE H . . 4.920 4.851 4.764 4.951 0.031 12 0 "[ . 1 . 2]" 1
152 1 8 PHE HA 1 8 PHE HD1 . . 3.670 2.630 2.351 3.076 . 0 0 "[ . 1 . 2]" 1
153 1 8 PHE HA 1 11 PHE H . . 4.630 3.532 3.402 3.748 . 0 0 "[ . 1 . 2]" 1
154 1 8 PHE HA 1 11 PHE HB3 . . 5.500 4.893 4.699 5.256 . 0 0 "[ . 1 . 2]" 1
155 1 8 PHE HA 1 11 PHE HD2 . . 3.650 3.299 2.838 3.510 . 0 0 "[ . 1 . 2]" 1
156 1 8 PHE HA 1 11 PHE HE2 . . 5.500 5.420 4.925 5.557 0.057 12 0 "[ . 1 . 2]" 1
157 1 8 PHE HA 1 12 ASP H . . 5.500 4.260 3.982 4.732 . 0 0 "[ . 1 . 2]" 1
158 1 8 PHE HA 1 12 ASP HB2 . . 5.500 4.364 4.251 4.486 . 0 0 "[ . 1 . 2]" 1
159 1 8 PHE HA 1 19 ILE MD . . 4.210 2.766 2.501 3.210 . 0 0 "[ . 1 . 2]" 1
160 1 8 PHE HA 1 19 ILE MG . . 3.950 3.065 2.719 3.639 . 0 0 "[ . 1 . 2]" 1
161 1 8 PHE HB2 1 8 PHE HD1 . . 3.710 2.639 2.431 2.789 . 0 0 "[ . 1 . 2]" 1
162 1 8 PHE HB2 1 9 LYS H . . 4.080 3.858 3.712 4.069 . 0 0 "[ . 1 . 2]" 1
163 1 8 PHE HB2 1 19 ILE MD . . 5.500 3.629 3.136 4.172 . 0 0 "[ . 1 . 2]" 1
164 1 8 PHE HB2 1 56 PHE HA . . 5.430 5.280 4.908 5.458 0.028 11 0 "[ . 1 . 2]" 1
165 1 8 PHE HB2 1 56 PHE HE1 . . 5.500 4.556 3.254 5.516 0.016 20 0 "[ . 1 . 2]" 1
166 1 8 PHE HB2 1 59 PHE QD . . 4.690 3.585 3.291 4.043 . 0 0 "[ . 1 . 2]" 1
167 1 8 PHE HB3 1 9 LYS H . . 3.250 2.456 2.242 2.786 . 0 0 "[ . 1 . 2]" 1
168 1 8 PHE HB3 1 9 LYS HB2 . . 5.500 4.610 4.395 5.057 . 0 0 "[ . 1 . 2]" 1
169 1 8 PHE HB3 1 12 ASP HB2 . . 5.500 5.449 5.267 5.525 0.025 8 0 "[ . 1 . 2]" 1
170 1 8 PHE HD1 1 12 ASP HB2 . . 5.390 3.795 3.381 4.041 . 0 0 "[ . 1 . 2]" 1
171 1 8 PHE HD1 1 12 ASP HB3 . . 5.500 5.270 4.595 5.516 0.016 3 0 "[ . 1 . 2]" 1
172 1 8 PHE HD1 1 19 ILE MD . . 4.190 2.135 1.972 2.370 . 0 0 "[ . 1 . 2]" 1
173 1 8 PHE HD1 1 19 ILE MG . . 4.210 2.671 2.186 2.955 . 0 0 "[ . 1 . 2]" 1
174 1 8 PHE HD1 1 56 PHE HB2 . . 5.500 5.391 4.995 5.524 0.024 4 0 "[ . 1 . 2]" 1
175 1 8 PHE HD2 1 9 LYS H . . 5.500 3.062 2.510 3.651 . 0 0 "[ . 1 . 2]" 1
176 1 8 PHE HD2 1 9 LYS HA . . 4.390 3.732 3.013 4.194 . 0 0 "[ . 1 . 2]" 1
177 1 8 PHE HD2 1 9 LYS HD2 . . 5.500 4.876 3.876 5.510 0.010 2 0 "[ . 1 . 2]" 1
178 1 8 PHE HD2 1 9 LYS HD3 . . 5.500 4.972 3.926 5.494 . 0 0 "[ . 1 . 2]" 1
179 1 8 PHE HD2 1 9 LYS HG2 . . 5.460 3.271 2.458 4.263 . 0 0 "[ . 1 . 2]" 1
180 1 8 PHE HD2 1 9 LYS QG . . 4.790 2.600 2.305 2.921 . 0 0 "[ . 1 . 2]" 1
181 1 8 PHE HD2 1 9 LYS HG3 . . 5.460 3.057 2.378 4.413 . 0 0 "[ . 1 . 2]" 1
182 1 8 PHE HD2 1 12 ASP HB2 . . 5.500 4.902 4.558 5.265 . 0 0 "[ . 1 . 2]" 1
183 1 8 PHE HD2 1 12 ASP HB3 . . 5.500 5.090 4.640 5.505 0.005 11 0 "[ . 1 . 2]" 1
184 1 8 PHE HE1 1 12 ASP HB2 . . 4.820 3.515 3.056 3.738 . 0 0 "[ . 1 . 2]" 1
185 1 8 PHE HE1 1 18 LYS HA . . 4.100 3.413 2.810 4.112 0.012 20 0 "[ . 1 . 2]" 1
186 1 8 PHE HE1 1 19 ILE H . . 5.500 4.463 3.884 5.173 . 0 0 "[ . 1 . 2]" 1
187 1 8 PHE HE1 1 19 ILE MD . . 4.010 3.668 3.350 3.837 . 0 0 "[ . 1 . 2]" 1
188 1 8 PHE HE1 1 19 ILE HG12 . . 4.060 3.807 3.517 4.063 0.003 15 0 "[ . 1 . 2]" 1
189 1 8 PHE HE1 1 19 ILE MG . . 4.720 2.731 2.285 3.107 . 0 0 "[ . 1 . 2]" 1
190 1 8 PHE HE1 1 56 PHE HA . . 3.810 3.696 3.270 3.855 0.045 20 0 "[ . 1 . 2]" 1
191 1 8 PHE HE2 1 12 ASP HB2 . . 5.370 4.690 4.245 5.066 . 0 0 "[ . 1 . 2]" 1
192 1 9 LYS H 1 9 LYS HB2 . . 3.050 2.326 2.191 2.552 . 0 0 "[ . 1 . 2]" 1
193 1 9 LYS H 1 9 LYS QD . . 4.780 3.983 3.088 4.429 . 0 0 "[ . 1 . 2]" 1
194 1 9 LYS H 1 9 LYS QG . . 2.860 2.555 2.058 2.849 . 0 0 "[ . 1 . 2]" 1
195 1 9 LYS H 1 10 ARG H . . 3.520 2.660 2.466 2.766 . 0 0 "[ . 1 . 2]" 1
196 1 9 LYS H 1 10 ARG HB2 . . 5.160 4.473 4.254 4.596 . 0 0 "[ . 1 . 2]" 1
197 1 9 LYS H 1 11 PHE H . . 4.570 4.392 4.191 4.590 0.020 11 0 "[ . 1 . 2]" 1
198 1 9 LYS HA 1 9 LYS HD2 . . 5.390 4.271 2.862 4.911 . 0 0 "[ . 1 . 2]" 1
199 1 9 LYS HA 1 9 LYS QD . . 4.630 3.648 2.385 4.203 . 0 0 "[ . 1 . 2]" 1
200 1 9 LYS HA 1 9 LYS HD3 . . 5.390 3.981 2.552 4.567 . 0 0 "[ . 1 . 2]" 1
201 1 9 LYS HA 1 9 LYS HG2 . . 3.730 2.455 2.218 2.899 . 0 0 "[ . 1 . 2]" 1
202 1 9 LYS HA 1 9 LYS QG . . 3.020 2.333 2.181 2.531 . 0 0 "[ . 1 . 2]" 1
203 1 9 LYS HA 1 9 LYS HG3 . . 3.730 3.146 2.478 3.640 . 0 0 "[ . 1 . 2]" 1
204 1 9 LYS HA 1 10 ARG QD . . 5.340 5.214 5.070 5.347 0.007 12 0 "[ . 1 . 2]" 1
205 1 9 LYS HA 1 11 PHE H . . 4.620 4.484 4.061 4.673 0.053 16 0 "[ . 1 . 2]" 1
206 1 9 LYS HA 1 12 ASP H . . 3.700 3.361 3.142 3.557 . 0 0 "[ . 1 . 2]" 1
207 1 9 LYS HA 1 12 ASP HB2 . . 3.990 3.331 2.814 3.719 . 0 0 "[ . 1 . 2]" 1
208 1 9 LYS HA 1 12 ASP HB3 . . 3.400 2.412 2.222 2.671 . 0 0 "[ . 1 . 2]" 1
209 1 9 LYS HA 1 19 ILE MG . . 5.500 4.720 4.449 4.964 . 0 0 "[ . 1 . 2]" 1
210 1 9 LYS HB2 1 9 LYS QG . . 2.510 2.279 2.132 2.488 . 0 0 "[ . 1 . 2]" 1
211 1 9 LYS HB2 1 10 ARG H . . 3.380 2.996 2.823 3.118 . 0 0 "[ . 1 . 2]" 1
212 1 9 LYS HB2 1 10 ARG HA . . 5.110 4.574 4.323 4.761 . 0 0 "[ . 1 . 2]" 1
213 1 9 LYS HB2 1 11 PHE H . . 5.500 5.379 5.160 5.493 . 0 0 "[ . 1 . 2]" 1
214 1 9 LYS HB3 1 9 LYS QE . . 5.040 3.091 2.009 3.935 . 0 0 "[ . 1 . 2]" 1
215 1 9 LYS HB3 1 9 LYS QG . . 2.590 2.385 2.191 2.517 . 0 0 "[ . 1 . 2]" 1
216 1 9 LYS HB3 1 10 ARG HA . . 5.420 4.300 4.121 4.655 . 0 0 "[ . 1 . 2]" 1
217 1 9 LYS QD 1 10 ARG QD . . 5.180 5.051 4.572 5.203 0.023 4 0 "[ . 1 . 2]" 1
218 1 9 LYS QG 1 10 ARG H . . 4.580 4.338 4.143 4.477 . 0 0 "[ . 1 . 2]" 1
219 1 9 LYS HG2 1 10 ARG H . . 5.390 5.045 4.816 5.312 . 0 0 "[ . 1 . 2]" 1
220 1 9 LYS HG3 1 10 ARG H . . 5.390 4.780 4.352 5.282 . 0 0 "[ . 1 . 2]" 1
221 1 10 ARG H 1 10 ARG HB2 . . 3.150 2.080 2.069 2.108 . 0 0 "[ . 1 . 2]" 1
222 1 10 ARG H 1 10 ARG HB3 . . 3.460 3.270 3.211 3.331 . 0 0 "[ . 1 . 2]" 1
223 1 10 ARG H 1 10 ARG QD . . 3.760 2.903 2.700 3.081 . 0 0 "[ . 1 . 2]" 1
224 1 10 ARG H 1 10 ARG HG2 . . 4.830 4.311 4.193 4.460 . 0 0 "[ . 1 . 2]" 1
225 1 10 ARG H 1 10 ARG HG3 . . 4.570 4.389 4.321 4.425 . 0 0 "[ . 1 . 2]" 1
226 1 10 ARG H 1 11 PHE H . . 3.070 2.601 2.484 2.814 . 0 0 "[ . 1 . 2]" 1
227 1 10 ARG H 1 11 PHE HB2 . . 4.990 4.719 4.573 4.934 . 0 0 "[ . 1 . 2]" 1
228 1 10 ARG HA 1 10 ARG QD . . 2.940 2.195 1.977 2.526 . 0 0 "[ . 1 . 2]" 1
229 1 10 ARG HA 1 10 ARG HG2 . . 3.920 3.577 3.567 3.579 . 0 0 "[ . 1 . 2]" 1
230 1 10 ARG HA 1 10 ARG HG3 . . 3.600 2.506 2.366 2.568 . 0 0 "[ . 1 . 2]" 1
231 1 10 ARG HA 1 11 PHE HA . . 4.890 4.672 4.593 4.718 . 0 0 "[ . 1 . 2]" 1
232 1 10 ARG HB2 1 10 ARG QD . . 3.610 2.374 2.340 2.434 . 0 0 "[ . 1 . 2]" 1
233 1 10 ARG HB2 1 11 PHE H . . 3.300 3.089 2.986 3.352 0.053 2 0 "[ . 1 . 2]" 1
234 1 10 ARG HB2 1 11 PHE HE2 . . 5.500 5.503 5.229 5.564 0.064 17 0 "[ . 1 . 2]" 1
235 1 10 ARG HB3 1 11 PHE H . . 3.060 2.884 2.695 3.144 0.084 18 0 "[ . 1 . 2]" 1
236 1 10 ARG HB3 1 11 PHE HA . . 5.350 3.932 3.871 4.091 . 0 0 "[ . 1 . 2]" 1
237 1 10 ARG HB3 1 11 PHE HE1 . . 5.500 5.273 4.759 5.524 0.024 17 0 "[ . 1 . 2]" 1
238 1 10 ARG HB3 1 11 PHE HE2 . . 5.500 5.094 4.567 5.351 . 0 0 "[ . 1 . 2]" 1
239 1 10 ARG HG2 1 11 PHE H . . 5.250 5.091 4.949 5.328 0.078 18 0 "[ . 1 . 2]" 1
240 1 10 ARG HG3 1 11 PHE H . . 5.040 4.865 4.751 4.985 . 0 0 "[ . 1 . 2]" 1
241 1 10 ARG HG3 1 11 PHE HA . . 5.500 5.505 5.428 5.536 0.036 17 0 "[ . 1 . 2]" 1
242 1 11 PHE H 1 11 PHE HB2 . . 3.500 2.360 2.313 2.438 . 0 0 "[ . 1 . 2]" 1
243 1 11 PHE H 1 11 PHE HB3 . . 3.680 3.592 3.570 3.651 . 0 0 "[ . 1 . 2]" 1
244 1 11 PHE H 1 12 ASP H . . 3.110 2.400 2.096 2.539 . 0 0 "[ . 1 . 2]" 1
245 1 11 PHE H 1 12 ASP HB2 . . 5.500 4.533 4.070 4.684 . 0 0 "[ . 1 . 2]" 1
246 1 11 PHE H 1 12 ASP HB3 . . 4.960 4.789 4.482 4.979 0.019 8 0 "[ . 1 . 2]" 1
247 1 11 PHE H 1 13 THR H . . 5.140 4.956 3.823 5.177 0.037 7 0 "[ . 1 . 2]" 1
248 1 11 PHE H 1 19 ILE HB . . 5.500 5.038 4.734 5.161 . 0 0 "[ . 1 . 2]" 1
249 1 11 PHE H 1 19 ILE MD . . 5.250 4.377 4.235 4.566 . 0 0 "[ . 1 . 2]" 1
250 1 11 PHE H 1 19 ILE MG . . 4.180 3.543 3.270 3.998 . 0 0 "[ . 1 . 2]" 1
251 1 11 PHE HA 1 11 PHE HD1 . . 3.150 2.272 2.167 2.363 . 0 0 "[ . 1 . 2]" 1
252 1 11 PHE HA 1 11 PHE HE1 . . 5.280 4.475 4.449 4.531 . 0 0 "[ . 1 . 2]" 1
253 1 11 PHE HA 1 13 THR H . . 4.290 3.697 3.492 3.955 . 0 0 "[ . 1 . 2]" 1
254 1 11 PHE HA 1 13 THR MG . . 4.840 4.305 3.816 4.553 . 0 0 "[ . 1 . 2]" 1
255 1 11 PHE HA 1 19 ILE HB . . 5.500 4.477 4.198 4.636 . 0 0 "[ . 1 . 2]" 1
256 1 11 PHE HA 1 19 ILE MD . . 5.500 5.065 4.878 5.138 . 0 0 "[ . 1 . 2]" 1
257 1 11 PHE HA 1 19 ILE MG . . 5.380 3.869 3.753 4.316 . 0 0 "[ . 1 . 2]" 1
258 1 11 PHE HB2 1 11 PHE HD2 . . 3.180 2.283 2.281 2.286 . 0 0 "[ . 1 . 2]" 1
259 1 11 PHE HB2 1 12 ASP H . . 4.290 3.202 2.924 3.597 . 0 0 "[ . 1 . 2]" 1
260 1 11 PHE HB2 1 19 ILE HB . . 3.000 2.806 2.445 2.988 . 0 0 "[ . 1 . 2]" 1
261 1 11 PHE HB2 1 19 ILE MD . . 4.070 2.550 2.405 2.660 . 0 0 "[ . 1 . 2]" 1
262 1 11 PHE HB2 1 19 ILE HG13 . . 5.150 4.623 4.358 4.788 . 0 0 "[ . 1 . 2]" 1
263 1 11 PHE HB2 1 19 ILE MG . . 3.460 2.115 1.947 2.569 . 0 0 "[ . 1 . 2]" 1
264 1 11 PHE HB2 1 20 SER H . . 5.500 5.370 5.042 5.544 0.044 12 0 "[ . 1 . 2]" 1
265 1 11 PHE HB3 1 11 PHE HE1 . . 4.910 4.844 4.815 4.885 . 0 0 "[ . 1 . 2]" 1
266 1 11 PHE HB3 1 12 ASP H . . 4.610 3.965 3.795 4.257 . 0 0 "[ . 1 . 2]" 1
267 1 11 PHE HB3 1 19 ILE HB . . 3.500 2.052 1.982 2.163 . 0 0 "[ . 1 . 2]" 1
268 1 11 PHE HB3 1 19 ILE MD . . 3.390 3.121 2.796 3.284 . 0 0 "[ . 1 . 2]" 1
269 1 11 PHE HB3 1 19 ILE MG . . 3.490 2.584 2.372 2.959 . 0 0 "[ . 1 . 2]" 1
270 1 11 PHE HB3 1 20 SER H . . 4.830 3.858 3.541 4.092 . 0 0 "[ . 1 . 2]" 1
271 1 11 PHE HD1 1 20 SER H . . 5.500 5.317 4.819 5.548 0.048 2 0 "[ . 1 . 2]" 1
272 1 11 PHE HD2 1 19 ILE MD . . 3.610 2.843 2.554 3.100 . 0 0 "[ . 1 . 2]" 1
273 1 11 PHE HD2 1 24 LEU HA . . 5.150 4.744 4.313 5.145 . 0 0 "[ . 1 . 2]" 1
274 1 12 ASP H 1 12 ASP HB2 . . 3.510 2.610 2.447 2.866 . 0 0 "[ . 1 . 2]" 1
275 1 12 ASP H 1 12 ASP HB3 . . 3.110 2.632 2.506 2.857 . 0 0 "[ . 1 . 2]" 1
276 1 12 ASP H 1 13 THR H . . 3.530 3.303 2.595 3.549 0.019 7 0 "[ . 1 . 2]" 1
277 1 12 ASP H 1 13 THR MG . . 5.500 4.099 3.772 4.388 . 0 0 "[ . 1 . 2]" 1
278 1 12 ASP H 1 19 ILE HA . . 5.500 5.478 5.368 5.544 0.044 2 0 "[ . 1 . 2]" 1
279 1 12 ASP H 1 19 ILE MG . . 3.850 2.859 2.669 3.144 . 0 0 "[ . 1 . 2]" 1
280 1 12 ASP HA 1 13 THR H . . 3.160 2.684 2.571 3.108 . 0 0 "[ . 1 . 2]" 1
281 1 12 ASP HB2 1 19 ILE MG . . 3.990 2.404 2.199 2.616 . 0 0 "[ . 1 . 2]" 1
282 1 12 ASP HB3 1 13 THR H . . 4.530 4.281 3.841 4.389 . 0 0 "[ . 1 . 2]" 1
283 1 12 ASP HB3 1 13 THR HA . . 5.500 4.680 4.441 4.877 . 0 0 "[ . 1 . 2]" 1
284 1 12 ASP HB3 1 19 ILE MG . . 4.860 3.667 3.506 3.820 . 0 0 "[ . 1 . 2]" 1
285 1 13 THR H 1 13 THR HB . . 4.160 3.609 3.531 3.756 . 0 0 "[ . 1 . 2]" 1
286 1 13 THR H 1 13 THR MG . . 3.860 3.103 2.722 3.343 . 0 0 "[ . 1 . 2]" 1
287 1 13 THR H 1 14 ASN H . . 3.080 2.513 1.941 2.989 . 0 0 "[ . 1 . 2]" 1
288 1 13 THR H 1 19 ILE MG . . 5.500 3.941 3.623 4.353 . 0 0 "[ . 1 . 2]" 1
289 1 13 THR HA 1 13 THR HB . . 2.930 2.620 2.577 2.677 . 0 0 "[ . 1 . 2]" 1
290 1 13 THR HA 1 14 ASN HA . . 5.210 4.701 4.481 4.890 . 0 0 "[ . 1 . 2]" 1
291 1 13 THR HA 1 15 GLY H . . 5.290 4.457 3.790 5.289 . 0 0 "[ . 1 . 2]" 1
292 1 13 THR HB 1 14 ASN H . . 4.270 4.070 3.373 4.366 0.096 2 0 "[ . 1 . 2]" 1
293 1 13 THR HB 1 14 ASN HA . . 4.650 4.435 4.046 4.606 . 0 0 "[ . 1 . 2]" 1
294 1 13 THR MG 1 14 ASN H . . 5.500 4.337 4.122 4.419 . 0 0 "[ . 1 . 2]" 1
295 1 14 ASN H 1 14 ASN QB . . 2.370 2.257 2.097 2.400 0.030 7 0 "[ . 1 . 2]" 1
296 1 14 ASN H 1 15 GLY H . . 2.960 2.637 2.033 2.933 . 0 0 "[ . 1 . 2]" 1
297 1 14 ASN QB 1 14 ASN HD21 . . 2.760 2.180 2.088 2.664 . 0 0 "[ . 1 . 2]" 1
298 1 14 ASN QB 1 14 ASN HD22 . . 3.370 3.228 3.213 3.440 0.070 5 0 "[ . 1 . 2]" 1
299 1 14 ASN QB 1 16 ASP H . . 4.210 2.895 2.232 4.292 0.082 2 0 "[ . 1 . 2]" 1
300 1 14 ASN HB2 1 14 ASN HD21 . . 3.200 2.488 2.116 3.065 . 0 0 "[ . 1 . 2]" 1
301 1 14 ASN HB2 1 15 GLY H . . 3.620 3.211 2.296 3.640 0.020 7 0 "[ . 1 . 2]" 1
302 1 14 ASN HB3 1 14 ASN HD21 . . 3.200 2.754 2.155 3.533 0.333 5 0 "[ . 1 . 2]" 1
303 1 14 ASN HB3 1 15 GLY H . . 3.620 2.655 1.949 3.613 . 0 0 "[ . 1 . 2]" 1
304 1 15 GLY H 1 15 GLY QA . . 2.500 2.378 2.221 2.501 0.001 19 0 "[ . 1 . 2]" 1
305 1 15 GLY H 1 16 ASP H . . 3.120 2.236 1.900 2.755 . 0 0 "[ . 1 . 2]" 1
306 1 15 GLY H 1 16 ASP HA . . 5.500 4.704 4.169 5.231 . 0 0 "[ . 1 . 2]" 1
307 1 15 GLY H 1 17 GLY H . . 4.790 3.328 2.629 4.095 . 0 0 "[ . 1 . 2]" 1
308 1 15 GLY QA 1 17 GLY H . . 5.150 4.049 3.256 5.112 . 0 0 "[ . 1 . 2]" 1
309 1 16 ASP H 1 16 ASP QB . . 3.050 2.463 2.197 2.963 . 0 0 "[ . 1 . 2]" 1
310 1 16 ASP H 1 17 GLY H . . 3.050 2.588 1.953 3.021 . 0 0 "[ . 1 . 2]" 1
311 1 16 ASP H 1 17 GLY HA2 . . 5.390 4.833 4.158 5.379 . 0 0 "[ . 1 . 2]" 1
312 1 16 ASP H 1 17 GLY QA . . 4.750 4.401 3.883 4.656 . 0 0 "[ . 1 . 2]" 1
313 1 16 ASP H 1 17 GLY HA3 . . 5.390 5.103 4.655 5.371 . 0 0 "[ . 1 . 2]" 1
314 1 16 ASP HA 1 18 LYS H . . 5.500 4.979 4.234 5.552 0.052 2 0 "[ . 1 . 2]" 1
315 1 17 GLY H 1 18 LYS H . . 3.340 2.582 1.900 3.223 . 0 0 "[ . 1 . 2]" 1
316 1 17 GLY QA 1 18 LYS H . . 2.980 2.664 2.204 2.920 . 0 0 "[ . 1 . 2]" 1
317 1 18 LYS H 1 18 LYS QB . . 3.550 2.662 2.494 2.791 . 0 0 "[ . 1 . 2]" 1
318 1 18 LYS H 1 18 LYS QD . . 4.120 3.957 3.651 4.147 0.027 3 0 "[ . 1 . 2]" 1
319 1 18 LYS H 1 18 LYS HG3 . . 3.130 2.361 1.946 3.140 0.010 19 0 "[ . 1 . 2]" 1
320 1 18 LYS H 1 55 ASP HA . . 4.550 4.237 3.790 4.573 0.023 3 0 "[ . 1 . 2]" 1
321 1 18 LYS HA 1 18 LYS HD2 . . 5.160 4.754 4.319 5.043 . 0 0 "[ . 1 . 2]" 1
322 1 18 LYS HA 1 18 LYS QD . . 4.480 4.099 3.847 4.304 . 0 0 "[ . 1 . 2]" 1
323 1 18 LYS HA 1 18 LYS HD3 . . 5.160 4.515 4.065 4.922 . 0 0 "[ . 1 . 2]" 1
324 1 18 LYS HA 1 18 LYS HG2 . . 4.230 2.749 2.481 3.043 . 0 0 "[ . 1 . 2]" 1
325 1 18 LYS HA 1 19 ILE H . . 2.950 2.528 2.268 2.693 . 0 0 "[ . 1 . 2]" 1
326 1 18 LYS HA 1 19 ILE MD . . 5.500 4.982 4.836 5.049 . 0 0 "[ . 1 . 2]" 1
327 1 18 LYS HA 1 19 ILE HG12 . . 5.270 3.834 3.668 4.048 . 0 0 "[ . 1 . 2]" 1
328 1 18 LYS HA 1 19 ILE MG . . 3.690 3.395 3.253 3.534 . 0 0 "[ . 1 . 2]" 1
329 1 18 LYS HA 1 53 PHE HB3 . . 5.500 4.689 4.256 4.986 . 0 0 "[ . 1 . 2]" 1
330 1 18 LYS HA 1 55 ASP H . . 4.980 4.409 4.118 4.589 . 0 0 "[ . 1 . 2]" 1
331 1 18 LYS HA 1 55 ASP HB2 . . 5.500 4.563 3.910 5.381 . 0 0 "[ . 1 . 2]" 1
332 1 18 LYS HA 1 55 ASP HB3 . . 5.500 5.094 4.605 5.379 . 0 0 "[ . 1 . 2]" 1
333 1 18 LYS HA 1 56 PHE H . . 5.500 5.355 5.142 5.601 0.101 20 0 "[ . 1 . 2]" 1
334 1 18 LYS QB 1 18 LYS HG2 . . 2.580 2.323 2.167 2.428 . 0 0 "[ . 1 . 2]" 1
335 1 18 LYS QB 1 18 LYS HG3 . . 2.780 2.361 2.256 2.510 . 0 0 "[ . 1 . 2]" 1
336 1 18 LYS QB 1 19 ILE H . . 3.510 2.239 1.936 2.740 . 0 0 "[ . 1 . 2]" 1
337 1 18 LYS QB 1 19 ILE MG . . 5.500 4.240 4.047 4.465 . 0 0 "[ . 1 . 2]" 1
338 1 18 LYS QB 1 53 PHE HA . . 4.640 4.067 3.708 4.466 . 0 0 "[ . 1 . 2]" 1
339 1 18 LYS QB 1 53 PHE HB2 . . 3.980 3.399 3.075 3.654 . 0 0 "[ . 1 . 2]" 1
340 1 18 LYS QB 1 53 PHE HB3 . . 3.320 2.265 2.069 2.589 . 0 0 "[ . 1 . 2]" 1
341 1 18 LYS QB 1 53 PHE QD . . 4.640 3.165 2.767 3.759 . 0 0 "[ . 1 . 2]" 1
342 1 18 LYS QB 1 54 ILE H . . 5.040 2.281 1.945 2.716 . 0 0 "[ . 1 . 2]" 1
343 1 18 LYS QB 1 55 ASP HA . . 4.660 3.083 2.855 3.526 . 0 0 "[ . 1 . 2]" 1
344 1 18 LYS QD 1 18 LYS HG3 . . 2.560 2.310 2.161 2.505 . 0 0 "[ . 1 . 2]" 1
345 1 18 LYS QD 1 53 PHE HB2 . . 4.310 2.935 2.615 3.584 . 0 0 "[ . 1 . 2]" 1
346 1 18 LYS QD 1 54 ILE H . . 5.010 3.815 3.319 4.638 . 0 0 "[ . 1 . 2]" 1
347 1 18 LYS HD2 1 53 PHE HB2 . . 5.100 3.711 2.708 4.739 . 0 0 "[ . 1 . 2]" 1
348 1 18 LYS HD3 1 53 PHE HB2 . . 5.100 3.325 2.648 4.726 . 0 0 "[ . 1 . 2]" 1
349 1 18 LYS QE 1 18 LYS HG3 . . 3.710 2.682 1.979 3.426 . 0 0 "[ . 1 . 2]" 1
350 1 18 LYS HG2 1 19 ILE H . . 4.670 4.309 3.964 4.515 . 0 0 "[ . 1 . 2]" 1
351 1 18 LYS HG2 1 53 PHE HB2 . . 5.500 5.186 4.304 5.512 0.012 18 0 "[ . 1 . 2]" 1
352 1 18 LYS HG2 1 55 ASP HA . . 3.410 2.054 1.977 2.725 . 0 0 "[ . 1 . 2]" 1
353 1 18 LYS HG2 1 55 ASP QB . . 4.680 2.720 2.150 3.613 . 0 0 "[ . 1 . 2]" 1
354 1 18 LYS HG3 1 19 ILE H . . 5.210 4.801 4.521 4.990 . 0 0 "[ . 1 . 2]" 1
355 1 18 LYS HG3 1 53 PHE HB2 . . 5.500 5.415 5.181 5.523 0.023 3 0 "[ . 1 . 2]" 1
356 1 19 ILE H 1 19 ILE MD . . 5.500 3.901 3.755 4.092 . 0 0 "[ . 1 . 2]" 1
357 1 19 ILE H 1 19 ILE HG12 . . 3.590 2.264 2.083 2.513 . 0 0 "[ . 1 . 2]" 1
358 1 19 ILE H 1 19 ILE HG13 . . 3.740 3.065 2.859 3.221 . 0 0 "[ . 1 . 2]" 1
359 1 19 ILE H 1 19 ILE MG . . 3.470 2.965 2.783 3.134 . 0 0 "[ . 1 . 2]" 1
360 1 19 ILE H 1 21 LEU H . . 5.500 5.182 4.442 5.473 . 0 0 "[ . 1 . 2]" 1
361 1 19 ILE H 1 53 PHE HA . . 5.500 4.145 3.725 4.602 . 0 0 "[ . 1 . 2]" 1
362 1 19 ILE H 1 53 PHE HB2 . . 5.420 5.060 4.595 5.261 . 0 0 "[ . 1 . 2]" 1
363 1 19 ILE H 1 53 PHE HB3 . . 3.510 3.398 2.985 3.601 0.091 8 0 "[ . 1 . 2]" 1
364 1 19 ILE H 1 53 PHE QD . . 5.500 3.768 2.965 4.146 . 0 0 "[ . 1 . 2]" 1
365 1 19 ILE H 1 54 ILE H . . 3.180 2.270 1.907 2.547 . 0 0 "[ . 1 . 2]" 1
366 1 19 ILE H 1 54 ILE QG . . 4.400 2.876 2.672 3.373 . 0 0 "[ . 1 . 2]" 1
367 1 19 ILE HA 1 20 SER H . . 3.220 2.202 2.168 2.265 . 0 0 "[ . 1 . 2]" 1
368 1 19 ILE HB 1 19 ILE MD . . 2.850 2.372 2.298 2.426 . 0 0 "[ . 1 . 2]" 1
369 1 19 ILE HB 1 20 SER H . . 3.050 2.986 2.749 3.127 0.077 9 0 "[ . 1 . 2]" 1
370 1 19 ILE HB 1 20 SER HA . . 5.500 4.963 4.858 5.025 . 0 0 "[ . 1 . 2]" 1
371 1 19 ILE MD 1 19 ILE MG . . 3.550 2.081 2.002 2.208 . 0 0 "[ . 1 . 2]" 1
372 1 19 ILE MD 1 21 LEU HA . . 5.500 4.279 3.854 4.699 . 0 0 "[ . 1 . 2]" 1
373 1 19 ILE MD 1 24 LEU HA . . 5.500 5.086 5.016 5.154 . 0 0 "[ . 1 . 2]" 1
374 1 19 ILE MD 1 24 LEU HB2 . . 5.500 3.359 3.230 3.574 . 0 0 "[ . 1 . 2]" 1
375 1 19 ILE MD 1 24 LEU HB3 . . 5.500 4.233 4.024 4.749 . 0 0 "[ . 1 . 2]" 1
376 1 19 ILE MD 1 24 LEU MD1 . . 4.400 1.855 1.786 2.402 . 0 0 "[ . 1 . 2]" 1
377 1 19 ILE MD 1 54 ILE HB . . 5.500 4.541 4.256 4.703 . 0 0 "[ . 1 . 2]" 1
378 1 19 ILE MD 1 54 ILE MD . . 3.740 2.063 1.925 2.308 . 0 0 "[ . 1 . 2]" 1
379 1 19 ILE MD 1 54 ILE QG . . 3.820 2.702 2.310 2.877 . 0 0 "[ . 1 . 2]" 1
380 1 19 ILE MD 1 56 PHE HA . . 5.500 4.774 4.480 5.009 . 0 0 "[ . 1 . 2]" 1
381 1 19 ILE MD 1 59 PHE HB2 . . 4.700 2.877 2.591 3.048 . 0 0 "[ . 1 . 2]" 1
382 1 19 ILE HG12 1 19 ILE MG . . 3.590 2.372 2.264 2.439 . 0 0 "[ . 1 . 2]" 1
383 1 19 ILE HG12 1 20 SER H . . 5.020 4.962 4.784 5.045 0.025 8 0 "[ . 1 . 2]" 1
384 1 19 ILE HG13 1 20 SER H . . 4.410 4.132 3.868 4.263 . 0 0 "[ . 1 . 2]" 1
385 1 19 ILE HG13 1 21 LEU H . . 5.500 4.146 3.443 4.775 . 0 0 "[ . 1 . 2]" 1
386 1 19 ILE HG13 1 59 PHE HB2 . . 5.500 4.395 4.089 4.980 . 0 0 "[ . 1 . 2]" 1
387 1 19 ILE MG 1 54 ILE QG . . 5.340 3.859 3.721 3.981 . 0 0 "[ . 1 . 2]" 1
388 1 20 SER H 1 20 SER HB2 . . 3.670 2.647 2.078 3.560 . 0 0 "[ . 1 . 2]" 1
389 1 20 SER H 1 20 SER QB . . 2.810 2.517 2.057 2.887 0.077 4 0 "[ . 1 . 2]" 1
390 1 20 SER H 1 20 SER HB3 . . 3.670 3.394 2.781 3.590 . 0 0 "[ . 1 . 2]" 1
391 1 20 SER H 1 21 LEU H . . 4.570 4.309 4.048 4.435 . 0 0 "[ . 1 . 2]" 1
392 1 20 SER H 1 23 GLU H . . 5.500 5.212 4.904 5.592 0.092 10 0 "[ . 1 . 2]" 1
393 1 20 SER H 1 53 PHE HA . . 5.500 4.932 4.364 5.610 0.110 19 0 "[ . 1 . 2]" 1
394 1 20 SER H 1 53 PHE QE . . 5.310 3.708 2.750 4.565 . 0 0 "[ . 1 . 2]" 1
395 1 20 SER HA 1 21 LEU H . . 3.020 2.181 2.142 2.306 . 0 0 "[ . 1 . 2]" 1
396 1 20 SER HA 1 21 LEU HB2 . . 5.500 5.116 4.421 5.550 0.050 5 0 "[ . 1 . 2]" 1
397 1 20 SER HA 1 21 LEU QB . . 4.790 4.480 4.063 4.770 . 0 0 "[ . 1 . 2]" 1
398 1 20 SER HA 1 21 LEU HB3 . . 5.500 4.982 4.414 5.242 . 0 0 "[ . 1 . 2]" 1
399 1 20 SER HA 1 22 SER H . . 4.340 4.038 3.657 4.487 0.147 13 0 "[ . 1 . 2]" 1
400 1 20 SER HA 1 53 PHE HA . . 4.110 2.963 2.157 3.794 . 0 0 "[ . 1 . 2]" 1
401 1 20 SER HA 1 53 PHE HB3 . . 5.500 4.133 3.711 4.709 . 0 0 "[ . 1 . 2]" 1
402 1 20 SER HA 1 53 PHE QD . . 3.490 2.676 2.079 3.078 . 0 0 "[ . 1 . 2]" 1
403 1 20 SER HA 1 53 PHE QE . . 5.400 3.167 2.309 3.747 . 0 0 "[ . 1 . 2]" 1
404 1 20 SER QB 1 21 LEU H . . 3.910 3.649 3.445 3.857 . 0 0 "[ . 1 . 2]" 1
405 1 20 SER QB 1 23 GLU H . . 3.430 2.665 2.216 3.157 . 0 0 "[ . 1 . 2]" 1
406 1 20 SER QB 1 23 GLU HB2 . . 2.370 2.075 1.775 2.372 0.002 12 0 "[ . 1 . 2]" 1
407 1 20 SER QB 1 23 GLU HB3 . . 5.340 3.166 1.886 3.881 . 0 0 "[ . 1 . 2]" 1
408 1 20 SER QB 1 53 PHE QE . . 4.150 3.147 2.268 3.850 . 0 0 "[ . 1 . 2]" 1
409 1 20 SER HB2 1 24 LEU H . . 5.500 4.503 3.830 5.519 0.019 9 0 "[ . 1 . 2]" 1
410 1 20 SER HB2 1 53 PHE QE . . 4.890 3.929 2.284 4.698 . 0 0 "[ . 1 . 2]" 1
411 1 20 SER HB3 1 24 LEU H . . 5.500 4.774 3.566 5.541 0.041 4 0 "[ . 1 . 2]" 1
412 1 20 SER HB3 1 53 PHE QE . . 4.890 3.625 2.843 4.489 . 0 0 "[ . 1 . 2]" 1
413 1 21 LEU H 1 21 LEU QB . . 2.770 2.587 2.188 2.860 0.090 8 0 "[ . 1 . 2]" 1
414 1 21 LEU H 1 21 LEU HG . . 4.710 2.899 1.832 4.615 . 0 0 "[ . 1 . 2]" 1
415 1 21 LEU H 1 22 SER H . . 3.030 2.906 2.815 3.086 0.056 16 0 "[ . 1 . 2]" 1
416 1 21 LEU H 1 23 GLU H . . 4.400 4.042 3.658 4.450 0.050 4 0 "[ . 1 . 2]" 1
417 1 21 LEU H 1 52 GLY HA2 . . 5.500 4.649 4.349 5.242 . 0 0 "[ . 1 . 2]" 1
418 1 21 LEU H 1 52 GLY HA3 . . 5.500 4.842 4.522 5.326 . 0 0 "[ . 1 . 2]" 1
419 1 21 LEU H 1 53 PHE HA . . 3.460 2.431 1.939 2.720 . 0 0 "[ . 1 . 2]" 1
420 1 21 LEU H 1 54 ILE H . . 4.520 4.270 3.517 4.571 0.051 13 0 "[ . 1 . 2]" 1
421 1 21 LEU H 1 54 ILE QG . . 5.340 3.728 3.327 4.465 . 0 0 "[ . 1 . 2]" 1
422 1 21 LEU H 1 54 ILE MG . . 5.500 4.646 3.893 5.241 . 0 0 "[ . 1 . 2]" 1
423 1 21 LEU HA 1 21 LEU MD2 . . 3.270 2.888 1.977 3.433 0.163 5 0 "[ . 1 . 2]" 1
424 1 21 LEU HA 1 21 LEU HG . . 3.680 3.328 2.824 3.769 0.089 20 0 "[ . 1 . 2]" 1
425 1 21 LEU HA 1 24 LEU H . . 4.000 3.053 2.884 3.340 . 0 0 "[ . 1 . 2]" 1
426 1 21 LEU HA 1 24 LEU QB . . 3.390 2.438 2.142 2.730 . 0 0 "[ . 1 . 2]" 1
427 1 21 LEU HA 1 24 LEU MD1 . . 4.420 3.640 3.289 3.800 . 0 0 "[ . 1 . 2]" 1
428 1 21 LEU HA 1 24 LEU HG . . 5.500 5.281 4.917 5.569 0.069 16 0 "[ . 1 . 2]" 1
429 1 21 LEU HA 1 25 THR H . . 5.370 3.705 3.352 4.527 . 0 0 "[ . 1 . 2]" 1
430 1 21 LEU HA 1 54 ILE MD . . 4.950 3.423 2.916 3.605 . 0 0 "[ . 1 . 2]" 1
431 1 21 LEU QB 1 22 SER H . . 2.880 2.594 1.930 3.021 0.141 12 0 "[ . 1 . 2]" 1
432 1 21 LEU QB 1 23 GLU H . . 5.340 4.458 4.080 4.907 . 0 0 "[ . 1 . 2]" 1
433 1 21 LEU QB 1 24 LEU H . . 5.340 4.498 4.331 4.663 . 0 0 "[ . 1 . 2]" 1
434 1 21 LEU QB 1 43 MET QG . . 5.180 3.322 1.852 4.685 . 0 0 "[ . 1 . 2]" 1
435 1 21 LEU QB 1 48 THR HB . . 5.340 5.109 4.189 5.411 0.071 14 0 "[ . 1 . 2]" 1
436 1 21 LEU QB 1 52 GLY QA . . 4.320 3.793 2.547 4.523 0.203 7 0 "[ . 1 . 2]" 1
437 1 21 LEU QB 1 53 PHE H . . 5.340 4.645 3.256 5.504 0.164 12 0 "[ . 1 . 2]" 1
438 1 21 LEU QB 1 53 PHE HA . . 5.340 3.509 2.071 4.581 . 0 0 "[ . 1 . 2]" 1
439 1 21 LEU QB 1 54 ILE H . . 5.340 4.794 3.335 5.544 0.204 8 0 "[ . 1 . 2]" 1
440 1 21 LEU QB 1 54 ILE MG . . 5.220 3.397 2.661 3.698 . 0 0 "[ . 1 . 2]" 1
441 1 21 LEU MD1 1 22 SER H . . 3.530 3.182 2.416 3.544 0.014 19 0 "[ . 1 . 2]" 1
442 1 21 LEU MD1 1 43 MET H . . 5.500 4.764 4.566 4.981 . 0 0 "[ . 1 . 2]" 1
443 1 21 LEU MD1 1 43 MET HA . . 5.500 4.176 3.632 4.726 . 0 0 "[ . 1 . 2]" 1
444 1 21 LEU MD1 1 43 MET QB . . 5.340 2.371 1.895 2.942 . 0 0 "[ . 1 . 2]" 1
445 1 21 LEU MD1 1 43 MET HG2 . . 4.420 2.751 1.910 3.641 . 0 0 "[ . 1 . 2]" 1
446 1 21 LEU MD1 1 43 MET QG . . 4.050 1.981 1.796 2.342 . 0 0 "[ . 1 . 2]" 1
447 1 21 LEU MD1 1 43 MET HG3 . . 4.420 2.376 1.891 3.327 . 0 0 "[ . 1 . 2]" 1
448 1 21 LEU MD1 1 44 ALA H . . 5.350 4.404 4.068 4.638 . 0 0 "[ . 1 . 2]" 1
449 1 21 LEU MD1 1 48 THR HB . . 5.500 2.971 2.660 3.865 . 0 0 "[ . 1 . 2]" 1
450 1 21 LEU MD1 1 52 GLY HA2 . . 5.500 2.152 1.952 2.730 . 0 0 "[ . 1 . 2]" 1
451 1 21 LEU MD1 1 52 GLY HA3 . . 5.500 3.481 2.749 4.151 . 0 0 "[ . 1 . 2]" 1
452 1 21 LEU MD1 1 53 PHE HA . . 5.500 4.154 3.907 4.488 . 0 0 "[ . 1 . 2]" 1
453 1 21 LEU HG 1 23 GLU H . . 5.500 5.289 4.592 6.172 0.672 20 8 "[ . * -**** *+]" 1
454 1 21 LEU HG 1 24 LEU H . . 5.500 5.590 5.479 5.902 0.402 20 0 "[ . 1 . 2]" 1
455 1 21 LEU HG 1 48 THR HB . . 5.500 5.184 4.123 5.643 0.143 11 0 "[ . 1 . 2]" 1
456 1 22 SER H 1 22 SER QB . . 2.580 2.317 2.159 2.563 . 0 0 "[ . 1 . 2]" 1
457 1 22 SER H 1 23 GLU H . . 2.890 2.805 2.724 2.898 0.008 4 0 "[ . 1 . 2]" 1
458 1 22 SER H 1 23 GLU HB2 . . 4.940 4.871 4.639 5.020 0.080 19 0 "[ . 1 . 2]" 1
459 1 22 SER H 1 24 LEU H . . 5.500 4.149 3.989 4.264 . 0 0 "[ . 1 . 2]" 1
460 1 22 SER HA 1 24 LEU H . . 4.630 4.342 4.026 4.486 . 0 0 "[ . 1 . 2]" 1
461 1 22 SER HA 1 25 THR H . . 4.160 4.044 3.747 4.246 0.086 20 0 "[ . 1 . 2]" 1
462 1 22 SER HA 1 25 THR HB . . 5.310 4.431 4.141 4.871 . 0 0 "[ . 1 . 2]" 1
463 1 22 SER HA 1 25 THR MG . . 5.060 2.246 1.895 3.087 . 0 0 "[ . 1 . 2]" 1
464 1 23 GLU H 1 23 GLU HB2 . . 3.320 2.336 2.156 2.518 . 0 0 "[ . 1 . 2]" 1
465 1 23 GLU H 1 24 LEU QB . . 4.910 4.078 3.799 4.386 . 0 0 "[ . 1 . 2]" 1
466 1 23 GLU H 1 26 ASP H . . 5.500 4.820 4.738 5.010 . 0 0 "[ . 1 . 2]" 1
467 1 23 GLU HA 1 26 ASP H . . 3.990 3.705 3.516 3.852 . 0 0 "[ . 1 . 2]" 1
468 1 23 GLU HA 1 26 ASP HB2 . . 3.900 3.827 3.674 3.911 0.011 6 0 "[ . 1 . 2]" 1
469 1 23 GLU HA 1 26 ASP HB3 . . 3.660 3.163 3.075 3.222 . 0 0 "[ . 1 . 2]" 1
470 1 23 GLU HA 1 27 ALA H . . 4.960 4.266 4.235 4.367 . 0 0 "[ . 1 . 2]" 1
471 1 23 GLU HA 1 27 ALA MB . . 5.500 4.068 3.929 4.219 . 0 0 "[ . 1 . 2]" 1
472 1 23 GLU HB2 1 24 LEU H . . 4.300 3.225 2.873 3.894 . 0 0 "[ . 1 . 2]" 1
473 1 23 GLU HB2 1 24 LEU QB . . 5.340 4.593 4.160 5.364 0.024 16 0 "[ . 1 . 2]" 1
474 1 23 GLU HB3 1 24 LEU H . . 4.580 3.410 2.840 3.856 . 0 0 "[ . 1 . 2]" 1
475 1 23 GLU HB3 1 24 LEU QB . . 5.340 4.538 4.010 5.058 . 0 0 "[ . 1 . 2]" 1
476 1 23 GLU HB3 1 26 ASP H . . 5.500 5.415 5.303 5.536 0.036 7 0 "[ . 1 . 2]" 1
477 1 23 GLU HG2 1 24 LEU H . . 5.500 4.940 4.419 5.485 . 0 0 "[ . 1 . 2]" 1
478 1 23 GLU HG3 1 24 LEU H . . 5.500 4.913 4.315 5.316 . 0 0 "[ . 1 . 2]" 1
479 1 24 LEU H 1 24 LEU HB2 . . 3.440 2.507 2.483 2.539 . 0 0 "[ . 1 . 2]" 1
480 1 24 LEU H 1 24 LEU QB . . 3.010 2.246 2.240 2.264 . 0 0 "[ . 1 . 2]" 1
481 1 24 LEU H 1 24 LEU HB3 . . 3.440 2.537 2.522 2.552 . 0 0 "[ . 1 . 2]" 1
482 1 24 LEU H 1 24 LEU MD1 . . 5.250 4.182 4.171 4.208 . 0 0 "[ . 1 . 2]" 1
483 1 24 LEU H 1 24 LEU MD2 . . 5.500 4.076 4.060 4.094 . 0 0 "[ . 1 . 2]" 1
484 1 24 LEU H 1 24 LEU HG . . 4.690 4.465 4.455 4.479 . 0 0 "[ . 1 . 2]" 1
485 1 24 LEU H 1 25 THR H . . 3.260 2.684 2.643 2.714 . 0 0 "[ . 1 . 2]" 1
486 1 24 LEU H 1 25 THR HB . . 5.500 5.089 5.016 5.166 . 0 0 "[ . 1 . 2]" 1
487 1 24 LEU H 1 26 ASP H . . 3.690 3.785 3.635 3.830 0.140 8 0 "[ . 1 . 2]" 1
488 1 24 LEU HA 1 24 LEU MD2 . . 3.980 3.305 3.287 3.330 . 0 0 "[ . 1 . 2]" 1
489 1 24 LEU HA 1 24 LEU HG . . 3.410 2.455 2.437 2.469 . 0 0 "[ . 1 . 2]" 1
490 1 24 LEU HA 1 26 ASP H . . 5.270 3.919 3.889 3.990 . 0 0 "[ . 1 . 2]" 1
491 1 24 LEU HA 1 27 ALA H . . 3.790 3.047 3.019 3.113 . 0 0 "[ . 1 . 2]" 1
492 1 24 LEU HA 1 28 LEU H . . 5.500 4.903 4.786 5.097 . 0 0 "[ . 1 . 2]" 1
493 1 24 LEU HA 1 28 LEU HB2 . . 5.500 5.654 5.625 5.675 0.175 13 0 "[ . 1 . 2]" 1
494 1 24 LEU QB 1 25 THR H . . 3.330 2.226 2.145 2.297 . 0 0 "[ . 1 . 2]" 1
495 1 24 LEU HB2 1 24 LEU MD1 . . 3.540 2.002 1.993 2.010 . 0 0 "[ . 1 . 2]" 1
496 1 24 LEU HB2 1 25 THR H . . 3.990 3.652 3.594 3.701 . 0 0 "[ . 1 . 2]" 1
497 1 24 LEU HB3 1 24 LEU MD1 . . 3.540 2.667 2.660 2.675 . 0 0 "[ . 1 . 2]" 1
498 1 24 LEU HB3 1 25 THR H . . 3.990 2.246 2.162 2.319 . 0 0 "[ . 1 . 2]" 1
499 1 24 LEU MD1 1 25 THR H . . 5.500 4.458 4.392 4.509 . 0 0 "[ . 1 . 2]" 1
500 1 24 LEU MD1 1 25 THR HA . . 5.500 5.239 5.233 5.245 . 0 0 "[ . 1 . 2]" 1
501 1 24 LEU MD2 1 25 THR H . . 5.500 2.670 2.624 2.713 . 0 0 "[ . 1 . 2]" 1
502 1 24 LEU MD2 1 26 ASP H . . 5.200 4.351 4.310 4.396 . 0 0 "[ . 1 . 2]" 1
503 1 24 LEU MD2 1 27 ALA H . . 5.500 4.409 4.386 4.449 . 0 0 "[ . 1 . 2]" 1
504 1 24 LEU MD2 1 28 LEU H . . 5.500 4.786 4.691 4.920 . 0 0 "[ . 1 . 2]" 1
505 1 24 LEU MD2 1 28 LEU MD1 . . 3.240 1.707 1.694 1.720 . 0 0 "[ . 1 . 2]" 1
506 1 24 LEU MD2 1 28 LEU MD2 . . 5.500 2.857 2.717 2.954 . 0 0 "[ . 1 . 2]" 1
507 1 24 LEU MD2 1 28 LEU HG . . 3.370 2.551 2.497 2.639 . 0 0 "[ . 1 . 2]" 1
508 1 24 LEU HG 1 25 THR H . . 5.500 4.390 4.354 4.432 . 0 0 "[ . 1 . 2]" 1
509 1 24 LEU HG 1 25 THR HA . . 4.880 4.887 4.844 4.911 0.031 15 0 "[ . 1 . 2]" 1
510 1 24 LEU HG 1 28 LEU HB2 . . 5.500 5.568 5.514 5.626 0.126 7 0 "[ . 1 . 2]" 1
511 1 24 LEU HG 1 28 LEU MD1 . . 4.030 3.420 3.410 3.435 . 0 0 "[ . 1 . 2]" 1
512 1 24 LEU HG 1 28 LEU HG . . 4.180 3.356 3.236 3.474 . 0 0 "[ . 1 . 2]" 1
513 1 25 THR H 1 25 THR HB . . 3.520 2.529 2.457 2.594 . 0 0 "[ . 1 . 2]" 1
514 1 25 THR H 1 25 THR MG . . 4.230 2.320 2.245 2.388 . 0 0 "[ . 1 . 2]" 1
515 1 25 THR H 1 26 ASP HA . . 5.500 5.351 5.333 5.362 . 0 0 "[ . 1 . 2]" 1
516 1 25 THR H 1 26 ASP HB2 . . 5.500 4.927 4.872 4.957 . 0 0 "[ . 1 . 2]" 1
517 1 25 THR H 1 27 ALA H . . 4.460 3.986 3.963 4.019 . 0 0 "[ . 1 . 2]" 1
518 1 25 THR H 1 28 LEU MD1 . . 5.500 3.592 3.556 3.627 . 0 0 "[ . 1 . 2]" 1
519 1 25 THR H 1 39 VAL MG1 . . 5.500 4.585 3.890 5.128 . 0 0 "[ . 1 . 2]" 1
520 1 25 THR H 1 40 GLN HA . . 5.500 5.448 5.210 5.547 0.047 5 0 "[ . 1 . 2]" 1
521 1 25 THR HA 1 27 ALA H . . 4.250 4.233 4.136 4.264 0.014 18 0 "[ . 1 . 2]" 1
522 1 25 THR HA 1 28 LEU H . . 5.500 4.346 4.285 4.443 . 0 0 "[ . 1 . 2]" 1
523 1 25 THR HA 1 28 LEU HB2 . . 3.550 3.376 3.251 3.444 . 0 0 "[ . 1 . 2]" 1
524 1 25 THR HA 1 28 LEU HB3 . . 4.960 4.813 4.681 4.876 . 0 0 "[ . 1 . 2]" 1
525 1 25 THR HA 1 28 LEU MD1 . . 4.060 1.862 1.833 1.888 . 0 0 "[ . 1 . 2]" 1
526 1 25 THR HA 1 29 ARG H . . 5.360 5.464 5.350 5.550 0.190 16 0 "[ . 1 . 2]" 1
527 1 25 THR HA 1 39 VAL MG1 . . 5.230 3.042 2.206 3.469 . 0 0 "[ . 1 . 2]" 1
528 1 25 THR HA 1 40 GLN HB2 . . 5.490 5.271 4.823 5.558 0.068 18 0 "[ . 1 . 2]" 1
529 1 25 THR HA 1 40 GLN HG3 . . 5.500 5.077 4.373 5.518 0.018 20 0 "[ . 1 . 2]" 1
530 1 25 THR HB 1 26 ASP H . . 4.230 4.100 4.041 4.134 . 0 0 "[ . 1 . 2]" 1
531 1 25 THR HB 1 39 VAL MG1 . . 5.270 2.795 2.005 3.515 . 0 0 "[ . 1 . 2]" 1
532 1 25 THR HB 1 40 GLN H . . 5.070 4.633 4.130 4.973 . 0 0 "[ . 1 . 2]" 1
533 1 25 THR HB 1 40 GLN HB2 . . 5.040 4.772 4.256 5.077 0.037 15 0 "[ . 1 . 2]" 1
534 1 25 THR MG 1 26 ASP H . . 4.990 2.033 1.971 2.109 . 0 0 "[ . 1 . 2]" 1
535 1 25 THR MG 1 26 ASP HA . . 5.500 3.614 3.541 3.688 . 0 0 "[ . 1 . 2]" 1
536 1 25 THR MG 1 27 ALA H . . 5.500 4.008 3.976 4.074 . 0 0 "[ . 1 . 2]" 1
537 1 25 THR MG 1 40 GLN HA . . 4.460 2.534 1.965 3.112 . 0 0 "[ . 1 . 2]" 1
538 1 25 THR MG 1 40 GLN HB2 . . 4.930 3.659 3.300 3.917 . 0 0 "[ . 1 . 2]" 1
539 1 25 THR MG 1 40 GLN HE21 . . 5.500 3.328 2.895 3.632 . 0 0 "[ . 1 . 2]" 1
540 1 25 THR MG 1 40 GLN HG2 . . 5.500 1.951 1.922 1.979 . 0 0 "[ . 1 . 2]" 1
541 1 25 THR MG 1 40 GLN HG3 . . 5.180 2.516 2.221 3.288 . 0 0 "[ . 1 . 2]" 1
542 1 26 ASP H 1 26 ASP HB2 . . 3.480 2.549 2.481 2.582 . 0 0 "[ . 1 . 2]" 1
543 1 26 ASP H 1 26 ASP HB3 . . 3.220 2.767 2.739 2.792 . 0 0 "[ . 1 . 2]" 1
544 1 26 ASP H 1 27 ALA H . . 3.080 2.162 2.139 2.236 . 0 0 "[ . 1 . 2]" 1
545 1 26 ASP H 1 27 ALA MB . . 5.500 3.919 3.883 3.969 . 0 0 "[ . 1 . 2]" 1
546 1 26 ASP H 1 28 LEU HB2 . . 5.500 4.917 4.887 4.949 . 0 0 "[ . 1 . 2]" 1
547 1 26 ASP H 1 28 LEU MD1 . . 5.500 4.263 4.243 4.312 . 0 0 "[ . 1 . 2]" 1
548 1 26 ASP H 1 28 LEU HG . . 5.500 5.530 5.448 5.558 0.058 6 0 "[ . 1 . 2]" 1
549 1 26 ASP HA 1 26 ASP HB2 . . 2.550 2.606 2.590 2.618 0.068 14 0 "[ . 1 . 2]" 1
550 1 26 ASP HA 1 29 ARG H . . 5.500 4.225 4.087 4.468 . 0 0 "[ . 1 . 2]" 1
551 1 26 ASP HB2 1 27 ALA H . . 4.340 3.936 3.887 3.981 . 0 0 "[ . 1 . 2]" 1
552 1 26 ASP HB3 1 27 ALA H . . 3.590 3.129 3.062 3.177 . 0 0 "[ . 1 . 2]" 1
553 1 26 ASP HB3 1 27 ALA MB . . 5.500 3.863 3.815 3.910 . 0 0 "[ . 1 . 2]" 1
554 1 27 ALA H 1 28 LEU H . . 3.290 2.685 2.621 2.780 . 0 0 "[ . 1 . 2]" 1
555 1 27 ALA H 1 28 LEU HA . . 5.390 4.854 4.790 4.898 . 0 0 "[ . 1 . 2]" 1
556 1 27 ALA H 1 28 LEU HB2 . . 4.190 4.246 4.139 4.274 0.084 13 0 "[ . 1 . 2]" 1
557 1 27 ALA H 1 28 LEU MD1 . . 4.500 4.142 4.099 4.213 . 0 0 "[ . 1 . 2]" 1
558 1 27 ALA H 1 28 LEU HG . . 5.500 4.419 4.316 4.474 . 0 0 "[ . 1 . 2]" 1
559 1 27 ALA H 1 29 ARG H . . 4.880 4.917 4.823 4.979 0.099 1 0 "[ . 1 . 2]" 1
560 1 27 ALA MB 1 28 LEU HA . . 5.500 4.133 4.109 4.161 . 0 0 "[ . 1 . 2]" 1
561 1 28 LEU H 1 28 LEU HB2 . . 3.680 2.268 2.244 2.307 . 0 0 "[ . 1 . 2]" 1
562 1 28 LEU H 1 28 LEU HB3 . . 4.140 3.513 3.497 3.530 . 0 0 "[ . 1 . 2]" 1
563 1 28 LEU H 1 28 LEU MD1 . . 5.130 3.626 3.549 3.734 . 0 0 "[ . 1 . 2]" 1
564 1 28 LEU H 1 28 LEU HG . . 4.080 3.468 3.403 3.591 . 0 0 "[ . 1 . 2]" 1
565 1 28 LEU H 1 31 LEU HG . . 5.450 4.694 4.523 4.872 . 0 0 "[ . 1 . 2]" 1
566 1 28 LEU H 1 36 ALA MB . . 4.600 3.485 3.166 3.824 . 0 0 "[ . 1 . 2]" 1
567 1 28 LEU HA 1 28 LEU MD2 . . 3.370 2.630 2.504 2.688 . 0 0 "[ . 1 . 2]" 1
568 1 28 LEU HA 1 28 LEU HG . . 3.310 2.453 2.427 2.478 . 0 0 "[ . 1 . 2]" 1
569 1 28 LEU HA 1 31 LEU H . . 4.060 3.506 3.296 3.701 . 0 0 "[ . 1 . 2]" 1
570 1 28 LEU HA 1 31 LEU HB2 . . 3.810 3.455 2.954 3.794 . 0 0 "[ . 1 . 2]" 1
571 1 28 LEU HA 1 31 LEU MD1 . . 5.420 2.508 2.045 2.841 . 0 0 "[ . 1 . 2]" 1
572 1 28 LEU HA 1 31 LEU HG . . 4.470 2.955 2.625 3.320 . 0 0 "[ . 1 . 2]" 1
573 1 28 LEU HA 1 33 SER H . . 5.500 5.059 4.502 5.524 0.024 20 0 "[ . 1 . 2]" 1
574 1 28 LEU HA 1 33 SER QB . . 4.370 3.996 3.492 4.432 0.062 4 0 "[ . 1 . 2]" 1
575 1 28 LEU HB2 1 28 LEU MD1 . . 3.060 2.144 2.135 2.161 . 0 0 "[ . 1 . 2]" 1
576 1 28 LEU HB2 1 29 ARG H . . 2.980 2.549 2.455 2.657 . 0 0 "[ . 1 . 2]" 1
577 1 28 LEU HB2 1 33 SER QB . . 4.520 3.936 3.476 4.564 0.044 16 0 "[ . 1 . 2]" 1
578 1 28 LEU HB2 1 36 ALA HA . . 3.870 3.514 2.816 3.978 0.108 2 0 "[ . 1 . 2]" 1
579 1 28 LEU HB3 1 28 LEU MD2 . . 3.090 2.026 1.986 2.199 . 0 0 "[ . 1 . 2]" 1
580 1 28 LEU HB3 1 29 ARG H . . 3.190 2.981 2.849 3.113 . 0 0 "[ . 1 . 2]" 1
581 1 28 LEU HB3 1 33 SER HB2 . . 4.100 2.826 2.321 3.851 . 0 0 "[ . 1 . 2]" 1
582 1 28 LEU HB3 1 33 SER QB . . 3.370 2.564 2.191 3.013 . 0 0 "[ . 1 . 2]" 1
583 1 28 LEU HB3 1 33 SER HB3 . . 4.100 3.116 2.493 3.980 . 0 0 "[ . 1 . 2]" 1
584 1 28 LEU HB3 1 36 ALA HA . . 5.170 3.902 3.585 4.196 . 0 0 "[ . 1 . 2]" 1
585 1 28 LEU MD1 1 29 ARG H . . 5.500 4.264 4.165 4.379 . 0 0 "[ . 1 . 2]" 1
586 1 28 LEU MD1 1 36 ALA HA . . 4.200 2.853 2.535 3.326 . 0 0 "[ . 1 . 2]" 1
587 1 28 LEU MD1 1 36 ALA MB . . 4.440 3.125 2.617 3.618 . 0 0 "[ . 1 . 2]" 1
588 1 28 LEU MD2 1 29 ARG H . . 5.500 4.538 4.452 4.643 . 0 0 "[ . 1 . 2]" 1
589 1 28 LEU MD2 1 33 SER HA . . 5.440 4.754 3.963 5.097 . 0 0 "[ . 1 . 2]" 1
590 1 28 LEU MD2 1 33 SER HB2 . . 3.970 3.335 2.441 3.746 . 0 0 "[ . 1 . 2]" 1
591 1 28 LEU MD2 1 33 SER HB3 . . 3.970 3.065 2.481 3.518 . 0 0 "[ . 1 . 2]" 1
592 1 28 LEU HG 1 36 ALA MB . . 5.500 4.747 4.260 5.066 . 0 0 "[ . 1 . 2]" 1
593 1 29 ARG H 1 29 ARG HB2 . . 3.460 2.546 2.063 3.587 0.127 18 0 "[ . 1 . 2]" 1
594 1 29 ARG H 1 29 ARG QB . . 2.960 2.241 2.041 2.652 . 0 0 "[ . 1 . 2]" 1
595 1 29 ARG H 1 29 ARG HB3 . . 3.460 2.921 2.344 3.453 . 0 0 "[ . 1 . 2]" 1
596 1 29 ARG H 1 29 ARG HD2 . . 5.500 4.731 3.808 5.494 . 0 0 "[ . 1 . 2]" 1
597 1 29 ARG H 1 29 ARG HD3 . . 5.500 4.566 3.577 5.606 0.106 1 0 "[ . 1 . 2]" 1
598 1 29 ARG H 1 29 ARG HG2 . . 4.670 3.793 1.939 4.633 . 0 0 "[ . 1 . 2]" 1
599 1 29 ARG H 1 29 ARG QG . . 3.980 3.280 1.908 4.000 0.020 10 0 "[ . 1 . 2]" 1
600 1 29 ARG H 1 29 ARG HG3 . . 4.670 3.758 2.551 4.521 . 0 0 "[ . 1 . 2]" 1
601 1 29 ARG H 1 30 THR H . . 2.890 2.728 2.595 2.824 . 0 0 "[ . 1 . 2]" 1
602 1 29 ARG H 1 30 THR HB . . 5.500 5.093 4.821 5.301 . 0 0 "[ . 1 . 2]" 1
603 1 29 ARG H 1 30 THR MG . . 5.500 3.917 3.780 4.033 . 0 0 "[ . 1 . 2]" 1
604 1 29 ARG H 1 31 LEU H . . 4.380 4.243 3.966 4.458 0.078 3 0 "[ . 1 . 2]" 1
605 1 29 ARG H 1 32 GLY H . . 5.480 5.245 4.937 5.597 0.117 6 0 "[ . 1 . 2]" 1
606 1 29 ARG H 1 36 ALA HA . . 5.370 4.643 3.965 5.102 . 0 0 "[ . 1 . 2]" 1
607 1 29 ARG HA 1 29 ARG HD2 . . 5.240 4.168 2.001 5.244 0.004 8 0 "[ . 1 . 2]" 1
608 1 29 ARG HA 1 29 ARG QD . . 4.490 3.753 1.985 4.274 . 0 0 "[ . 1 . 2]" 1
609 1 29 ARG HA 1 29 ARG HD3 . . 5.240 4.386 3.294 5.264 0.024 18 0 "[ . 1 . 2]" 1
610 1 29 ARG HA 1 29 ARG HG2 . . 3.790 3.040 2.080 3.806 0.016 17 0 "[ . 1 . 2]" 1
611 1 29 ARG HA 1 29 ARG QG . . 3.270 2.532 2.048 3.334 0.064 18 0 "[ . 1 . 2]" 1
612 1 29 ARG HA 1 29 ARG HG3 . . 3.790 2.911 2.186 3.809 0.019 18 0 "[ . 1 . 2]" 1
613 1 29 ARG HA 1 32 GLY H . . 4.790 3.539 3.088 3.897 . 0 0 "[ . 1 . 2]" 1
614 1 29 ARG HA 1 36 ALA MB . . 3.800 3.268 3.011 3.585 . 0 0 "[ . 1 . 2]" 1
615 1 29 ARG QB 1 30 THR H . . 3.260 3.020 2.687 3.469 0.209 17 0 "[ . 1 . 2]" 1
616 1 29 ARG QG 1 30 THR H . . 5.020 3.773 1.943 4.604 . 0 0 "[ . 1 . 2]" 1
617 1 29 ARG QG 1 36 ALA MB . . 3.880 2.821 1.927 3.642 . 0 0 "[ . 1 . 2]" 1
618 1 30 THR H 1 30 THR HB . . 3.220 2.597 2.486 2.716 . 0 0 "[ . 1 . 2]" 1
619 1 30 THR H 1 30 THR MG . . 4.410 2.042 1.880 2.215 . 0 0 "[ . 1 . 2]" 1
620 1 30 THR H 1 31 LEU H . . 2.920 2.582 2.418 2.771 . 0 0 "[ . 1 . 2]" 1
621 1 30 THR H 1 31 LEU MD2 . . 5.500 4.750 4.534 4.820 . 0 0 "[ . 1 . 2]" 1
622 1 30 THR H 1 31 LEU HG . . 5.500 3.863 3.491 4.047 . 0 0 "[ . 1 . 2]" 1
623 1 30 THR H 1 36 ALA MB . . 5.500 4.626 4.275 4.772 . 0 0 "[ . 1 . 2]" 1
624 1 30 THR HA 1 32 GLY H . . 5.320 3.784 3.547 4.088 . 0 0 "[ . 1 . 2]" 1
625 1 30 THR HB 1 31 LEU H . . 4.090 4.060 3.902 4.183 0.093 11 0 "[ . 1 . 2]" 1
626 1 30 THR HB 1 31 LEU MD2 . . 5.500 4.763 4.577 4.826 . 0 0 "[ . 1 . 2]" 1
627 1 30 THR HB 1 31 LEU HG . . 4.770 4.865 4.718 4.996 0.226 9 0 "[ . 1 . 2]" 1
628 1 30 THR HB 1 32 GLY H . . 5.490 5.536 5.275 5.730 0.240 1 0 "[ . 1 . 2]" 1
629 1 30 THR MG 1 31 LEU H . . 3.960 2.337 1.990 2.630 . 0 0 "[ . 1 . 2]" 1
630 1 30 THR MG 1 31 LEU MD2 . . 4.840 2.202 2.075 2.263 . 0 0 "[ . 1 . 2]" 1
631 1 30 THR MG 1 31 LEU HG . . 5.500 2.124 1.935 2.242 . 0 0 "[ . 1 . 2]" 1
632 1 30 THR MG 1 32 GLY H . . 5.500 4.218 4.001 4.447 . 0 0 "[ . 1 . 2]" 1
633 1 31 LEU H 1 31 LEU HB2 . . 3.490 2.678 2.595 2.736 . 0 0 "[ . 1 . 2]" 1
634 1 31 LEU H 1 31 LEU HB3 . . 3.860 3.643 3.575 3.731 . 0 0 "[ . 1 . 2]" 1
635 1 31 LEU H 1 31 LEU MD1 . . 5.500 3.626 3.464 3.874 . 0 0 "[ . 1 . 2]" 1
636 1 31 LEU H 1 31 LEU MD2 . . 3.850 3.228 2.936 3.461 . 0 0 "[ . 1 . 2]" 1
637 1 31 LEU H 1 31 LEU HG . . 3.030 2.186 1.889 2.533 . 0 0 "[ . 1 . 2]" 1
638 1 31 LEU H 1 32 GLY H . . 2.990 2.480 2.180 2.624 . 0 0 "[ . 1 . 2]" 1
639 1 31 LEU H 1 32 GLY HA2 . . 5.480 4.825 4.640 5.062 . 0 0 "[ . 1 . 2]" 1
640 1 31 LEU H 1 32 GLY QA . . 4.610 4.398 4.244 4.564 . 0 0 "[ . 1 . 2]" 1
641 1 31 LEU H 1 32 GLY HA3 . . 5.480 5.071 4.895 5.223 . 0 0 "[ . 1 . 2]" 1
642 1 31 LEU HA 1 31 LEU MD2 . . 3.350 2.094 1.984 2.243 . 0 0 "[ . 1 . 2]" 1
643 1 31 LEU HA 1 31 LEU HG . . 3.400 3.277 3.233 3.334 . 0 0 "[ . 1 . 2]" 1
644 1 31 LEU HB2 1 32 GLY H . . 4.290 3.435 2.921 4.000 . 0 0 "[ . 1 . 2]" 1
645 1 31 LEU HB3 1 32 GLY H . . 4.540 4.311 4.065 4.499 . 0 0 "[ . 1 . 2]" 1
646 1 31 LEU HB3 1 76 VAL MG2 . . 5.500 4.969 4.683 5.096 . 0 0 "[ . 1 . 2]" 1
647 1 31 LEU MD2 1 32 GLY H . . 5.200 4.591 4.447 4.698 . 0 0 "[ . 1 . 2]" 1
648 1 31 LEU HG 1 32 GLY H . . 4.760 4.362 4.053 4.796 0.036 18 0 "[ . 1 . 2]" 1
649 1 32 GLY H 1 32 GLY QA . . 2.470 2.310 2.196 2.465 . 0 0 "[ . 1 . 2]" 1
650 1 32 GLY QA 1 76 VAL MG1 . . 4.780 2.226 1.907 2.634 . 0 0 "[ . 1 . 2]" 1
651 1 32 GLY QA 1 76 VAL MG2 . . 5.210 3.529 3.317 3.824 . 0 0 "[ . 1 . 2]" 1
652 1 32 GLY HA2 1 76 VAL MG1 . . 5.500 3.721 3.336 3.953 . 0 0 "[ . 1 . 2]" 1
653 1 32 GLY HA2 1 76 VAL MG2 . . 5.500 4.985 4.645 5.156 . 0 0 "[ . 1 . 2]" 1
654 1 32 GLY HA3 1 76 VAL MG1 . . 5.500 2.245 1.918 2.689 . 0 0 "[ . 1 . 2]" 1
655 1 32 GLY HA3 1 76 VAL MG2 . . 5.500 3.610 3.384 3.948 . 0 0 "[ . 1 . 2]" 1
656 1 33 SER H 1 33 SER HB2 . . 4.020 2.928 2.403 3.780 . 0 0 "[ . 1 . 2]" 1
657 1 33 SER H 1 33 SER QB . . 3.350 2.606 2.154 2.878 . 0 0 "[ . 1 . 2]" 1
658 1 33 SER H 1 33 SER HB3 . . 4.020 3.404 2.175 3.824 . 0 0 "[ . 1 . 2]" 1
659 1 33 SER H 1 34 THR H . . 4.630 4.373 1.858 4.647 0.017 4 0 "[ . 1 . 2]" 1
660 1 33 SER HA 1 34 THR MG . . 5.500 4.835 3.865 5.096 . 0 0 "[ . 1 . 2]" 1
661 1 33 SER QB 1 34 THR H . . 4.130 2.368 1.910 3.262 . 0 0 "[ . 1 . 2]" 1
662 1 33 SER QB 1 34 THR HB . . 5.340 5.269 4.900 5.457 0.117 16 0 "[ . 1 . 2]" 1
663 1 33 SER QB 1 35 SER H . . 3.910 3.048 2.295 3.837 . 0 0 "[ . 1 . 2]" 1
664 1 34 THR HB 1 35 SER H . . 4.140 3.329 2.517 4.146 0.006 16 0 "[ . 1 . 2]" 1
665 1 34 THR HB 1 35 SER HA . . 4.710 4.223 3.922 4.778 0.068 18 0 "[ . 1 . 2]" 1
666 1 34 THR HB 1 36 ALA H . . 5.500 5.168 4.574 5.541 0.041 19 0 "[ . 1 . 2]" 1
667 1 34 THR MG 1 36 ALA H . . 5.500 5.000 4.484 5.138 . 0 0 "[ . 1 . 2]" 1
668 1 35 SER H 1 36 ALA H . . 3.730 3.086 1.918 3.784 0.054 6 0 "[ . 1 . 2]" 1
669 1 35 SER HA 1 36 ALA H . . 3.330 2.702 2.407 3.542 0.212 18 0 "[ . 1 . 2]" 1
670 1 35 SER HA 1 36 ALA MB . . 5.500 4.420 3.855 4.618 . 0 0 "[ . 1 . 2]" 1
671 1 35 SER HA 1 37 ASP H . . 4.950 3.837 3.067 4.389 . 0 0 "[ . 1 . 2]" 1
672 1 35 SER HA 1 38 GLU H . . 5.500 3.593 3.029 5.500 . 0 0 "[ . 1 . 2]" 1
673 1 36 ALA H 1 37 ASP H . . 2.830 2.354 1.864 2.799 . 0 0 "[ . 1 . 2]" 1
674 1 36 ALA HA 1 38 GLU H . . 4.690 3.909 3.430 4.721 0.031 9 0 "[ . 1 . 2]" 1
675 1 36 ALA HA 1 39 VAL H . . 4.530 4.000 3.578 4.603 0.073 9 0 "[ . 1 . 2]" 1
676 1 36 ALA HA 1 39 VAL MG1 . . 5.180 2.993 2.552 3.885 . 0 0 "[ . 1 . 2]" 1
677 1 36 ALA MB 1 37 ASP H . . 3.550 2.623 2.226 3.325 . 0 0 "[ . 1 . 2]" 1
678 1 36 ALA MB 1 38 GLU H . . 5.500 4.236 3.979 4.695 . 0 0 "[ . 1 . 2]" 1
679 1 37 ASP H 1 37 ASP QB . . 3.660 2.289 2.139 2.686 . 0 0 "[ . 1 . 2]" 1
680 1 37 ASP H 1 38 GLU H . . 2.730 2.476 1.950 2.643 . 0 0 "[ . 1 . 2]" 1
681 1 37 ASP H 1 38 GLU HA . . 5.300 4.994 4.637 5.136 . 0 0 "[ . 1 . 2]" 1
682 1 37 ASP H 1 38 GLU QB . . 4.590 4.479 4.244 4.672 0.082 6 0 "[ . 1 . 2]" 1
683 1 37 ASP H 1 38 GLU HG2 . . 5.500 4.174 2.981 5.393 . 0 0 "[ . 1 . 2]" 1
684 1 37 ASP H 1 38 GLU HG3 . . 5.500 5.151 4.066 5.603 0.103 2 0 "[ . 1 . 2]" 1
685 1 37 ASP H 1 40 GLN HB2 . . 4.730 4.337 4.102 4.557 . 0 0 "[ . 1 . 2]" 1
686 1 37 ASP H 1 40 GLN HG3 . . 5.500 5.648 5.541 5.759 0.259 18 0 "[ . 1 . 2]" 1
687 1 37 ASP HA 1 40 GLN H . . 4.150 3.085 2.645 3.543 . 0 0 "[ . 1 . 2]" 1
688 1 37 ASP HA 1 40 GLN HB2 . . 3.330 2.035 1.888 2.241 . 0 0 "[ . 1 . 2]" 1
689 1 37 ASP HA 1 40 GLN HG2 . . 4.970 4.628 4.415 4.899 . 0 0 "[ . 1 . 2]" 1
690 1 37 ASP HA 1 40 GLN HG3 . . 4.820 3.600 3.361 3.931 . 0 0 "[ . 1 . 2]" 1
691 1 37 ASP HA 1 41 ARG H . . 5.040 4.559 3.823 5.069 0.029 18 0 "[ . 1 . 2]" 1
692 1 37 ASP QB 1 38 GLU H . . 4.160 3.216 2.798 3.828 . 0 0 "[ . 1 . 2]" 1
693 1 37 ASP QB 1 39 VAL H . . 5.340 5.030 4.600 5.416 0.076 18 0 "[ . 1 . 2]" 1
694 1 37 ASP HB2 1 38 GLU H . . 4.780 3.825 2.872 4.376 . 0 0 "[ . 1 . 2]" 1
695 1 37 ASP HB2 1 40 GLN HB2 . . 5.500 4.631 4.077 5.145 . 0 0 "[ . 1 . 2]" 1
696 1 37 ASP HB3 1 38 GLU H . . 4.780 3.627 2.973 4.404 . 0 0 "[ . 1 . 2]" 1
697 1 37 ASP HB3 1 40 GLN HB2 . . 5.500 4.706 4.183 4.995 . 0 0 "[ . 1 . 2]" 1
698 1 38 GLU H 1 38 GLU QB . . 3.120 2.427 2.272 2.631 . 0 0 "[ . 1 . 2]" 1
699 1 38 GLU H 1 38 GLU HG2 . . 5.090 2.494 1.886 3.772 . 0 0 "[ . 1 . 2]" 1
700 1 38 GLU H 1 38 GLU QG . . 4.300 2.340 1.874 2.772 . 0 0 "[ . 1 . 2]" 1
701 1 38 GLU H 1 38 GLU HG3 . . 5.090 3.325 2.202 3.778 . 0 0 "[ . 1 . 2]" 1
702 1 38 GLU H 1 39 VAL H . . 2.860 2.613 2.298 2.895 0.035 20 0 "[ . 1 . 2]" 1
703 1 38 GLU H 1 39 VAL HB . . 5.500 5.339 5.010 5.599 0.099 11 0 "[ . 1 . 2]" 1
704 1 38 GLU H 1 39 VAL MG1 . . 4.380 3.779 3.489 4.022 . 0 0 "[ . 1 . 2]" 1
705 1 38 GLU HA 1 38 GLU QG . . 3.700 2.884 2.265 3.450 . 0 0 "[ . 1 . 2]" 1
706 1 38 GLU HA 1 40 GLN H . . 5.490 4.368 4.135 4.682 . 0 0 "[ . 1 . 2]" 1
707 1 38 GLU HA 1 41 ARG H . . 5.230 4.656 4.289 5.065 . 0 0 "[ . 1 . 2]" 1
708 1 38 GLU HA 1 41 ARG QD . . 5.340 4.878 4.292 5.368 0.028 14 0 "[ . 1 . 2]" 1
709 1 38 GLU HA 1 41 ARG HG2 . . 4.340 4.125 3.654 4.364 0.024 8 0 "[ . 1 . 2]" 1
710 1 38 GLU QB 1 39 VAL H . . 3.560 2.873 2.204 3.595 0.035 14 0 "[ . 1 . 2]" 1
711 1 38 GLU HG2 1 39 VAL H . . 5.500 3.934 2.382 4.882 . 0 0 "[ . 1 . 2]" 1
712 1 38 GLU HG3 1 39 VAL H . . 5.500 3.931 1.976 5.121 . 0 0 "[ . 1 . 2]" 1
713 1 39 VAL H 1 39 VAL HB . . 3.260 2.955 2.720 3.196 . 0 0 "[ . 1 . 2]" 1
714 1 39 VAL H 1 39 VAL MG1 . . 3.160 1.964 1.873 2.061 . 0 0 "[ . 1 . 2]" 1
715 1 39 VAL H 1 39 VAL MG2 . . 4.710 3.800 3.760 3.858 . 0 0 "[ . 1 . 2]" 1
716 1 39 VAL HA 1 39 VAL MG2 . . 3.480 2.389 2.357 2.408 . 0 0 "[ . 1 . 2]" 1
717 1 39 VAL HA 1 41 ARG H . . 5.060 3.470 3.294 3.529 . 0 0 "[ . 1 . 2]" 1
718 1 39 VAL HA 1 41 ARG HG3 . . 5.500 4.443 3.951 4.755 . 0 0 "[ . 1 . 2]" 1
719 1 39 VAL HA 1 42 MET H . . 4.130 2.825 2.529 3.126 . 0 0 "[ . 1 . 2]" 1
720 1 39 VAL HA 1 42 MET QB . . 3.300 2.389 1.946 3.527 0.227 7 0 "[ . 1 . 2]" 1
721 1 39 VAL HA 1 42 MET QG . . 4.270 3.225 1.807 4.033 . 0 0 "[ . 1 . 2]" 1
722 1 39 VAL HA 1 43 MET H . . 4.600 4.042 3.599 4.633 0.033 2 0 "[ . 1 . 2]" 1
723 1 39 VAL HA 1 46 ILE HG12 . . 5.500 5.276 5.008 5.562 0.062 5 0 "[ . 1 . 2]" 1
724 1 39 VAL HA 1 62 PHE HE2 . . 5.500 5.403 5.084 5.543 0.043 6 0 "[ . 1 . 2]" 1
725 1 39 VAL HB 1 41 ARG H . . 5.500 5.485 5.365 5.560 0.060 18 0 "[ . 1 . 2]" 1
726 1 39 VAL HB 1 46 ILE HG12 . . 5.500 5.533 5.364 5.620 0.120 11 0 "[ . 1 . 2]" 1
727 1 39 VAL MG1 1 40 GLN H . . 4.800 2.302 2.109 2.650 . 0 0 "[ . 1 . 2]" 1
728 1 39 VAL MG1 1 41 ARG H . . 5.500 4.383 4.287 4.490 . 0 0 "[ . 1 . 2]" 1
729 1 39 VAL MG1 1 62 PHE HE2 . . 5.500 2.579 1.985 3.818 . 0 0 "[ . 1 . 2]" 1
730 1 39 VAL MG2 1 40 GLN H . . 4.200 3.786 3.731 3.891 . 0 0 "[ . 1 . 2]" 1
731 1 39 VAL MG2 1 40 GLN HA . . 4.660 3.697 3.632 3.764 . 0 0 "[ . 1 . 2]" 1
732 1 39 VAL MG2 1 40 GLN HB2 . . 5.500 5.162 5.093 5.232 . 0 0 "[ . 1 . 2]" 1
733 1 39 VAL MG2 1 41 ARG H . . 5.500 4.373 4.260 4.435 . 0 0 "[ . 1 . 2]" 1
734 1 39 VAL MG2 1 42 MET H . . 4.640 3.445 3.306 3.595 . 0 0 "[ . 1 . 2]" 1
735 1 39 VAL MG2 1 43 MET H . . 5.430 3.224 2.937 3.461 . 0 0 "[ . 1 . 2]" 1
736 1 39 VAL MG2 1 43 MET HA . . 3.700 2.335 2.158 2.568 . 0 0 "[ . 1 . 2]" 1
737 1 39 VAL MG2 1 43 MET QB . . 3.370 1.956 1.886 2.043 . 0 0 "[ . 1 . 2]" 1
738 1 39 VAL MG2 1 43 MET HG2 . . 5.000 3.905 3.526 4.322 . 0 0 "[ . 1 . 2]" 1
739 1 39 VAL MG2 1 43 MET QG . . 4.220 3.481 2.625 3.938 . 0 0 "[ . 1 . 2]" 1
740 1 39 VAL MG2 1 43 MET HG3 . . 5.000 4.025 2.687 4.598 . 0 0 "[ . 1 . 2]" 1
741 1 39 VAL MG2 1 44 ALA H . . 5.500 4.718 4.613 4.813 . 0 0 "[ . 1 . 2]" 1
742 1 39 VAL MG2 1 62 PHE HE2 . . 5.500 3.442 2.578 4.195 . 0 0 "[ . 1 . 2]" 1
743 1 40 GLN H 1 40 GLN HB2 . . 2.950 2.161 2.062 2.271 . 0 0 "[ . 1 . 2]" 1
744 1 40 GLN H 1 40 GLN HG2 . . 4.440 4.226 4.113 4.327 . 0 0 "[ . 1 . 2]" 1
745 1 40 GLN H 1 40 GLN HG3 . . 4.290 4.133 3.635 4.358 0.068 11 0 "[ . 1 . 2]" 1
746 1 40 GLN H 1 41 ARG H . . 2.850 2.722 2.640 2.781 . 0 0 "[ . 1 . 2]" 1
747 1 40 GLN H 1 41 ARG HG3 . . 5.500 4.829 4.572 5.269 . 0 0 "[ . 1 . 2]" 1
748 1 40 GLN HA 1 40 GLN HG2 . . 2.780 2.174 2.089 2.275 . 0 0 "[ . 1 . 2]" 1
749 1 40 GLN HA 1 40 GLN HG3 . . 4.220 3.139 2.768 3.394 . 0 0 "[ . 1 . 2]" 1
750 1 40 GLN HA 1 42 MET H . . 4.480 4.077 3.862 4.379 . 0 0 "[ . 1 . 2]" 1
751 1 40 GLN HA 1 43 MET H . . 4.540 4.435 4.008 4.596 0.056 4 0 "[ . 1 . 2]" 1
752 1 40 GLN HA 1 43 MET QB . . 4.230 3.547 3.130 3.802 . 0 0 "[ . 1 . 2]" 1
753 1 40 GLN HB3 1 41 ARG H . . 3.440 3.134 3.000 3.406 . 0 0 "[ . 1 . 2]" 1
754 1 40 GLN HB3 1 41 ARG HA . . 4.520 4.365 4.242 4.504 . 0 0 "[ . 1 . 2]" 1
755 1 40 GLN HG2 1 41 ARG H . . 5.030 4.848 4.757 4.969 . 0 0 "[ . 1 . 2]" 1
756 1 40 GLN HG3 1 41 ARG H . . 5.500 5.441 5.289 5.592 0.092 11 0 "[ . 1 . 2]" 1
757 1 41 ARG H 1 41 ARG HB3 . . 3.180 3.069 2.889 3.191 0.011 15 0 "[ . 1 . 2]" 1
758 1 41 ARG H 1 41 ARG HD2 . . 5.500 4.675 4.454 4.859 . 0 0 "[ . 1 . 2]" 1
759 1 41 ARG H 1 41 ARG HD3 . . 5.500 4.767 4.605 4.892 . 0 0 "[ . 1 . 2]" 1
760 1 41 ARG H 1 41 ARG HG2 . . 3.530 2.734 2.316 3.015 . 0 0 "[ . 1 . 2]" 1
761 1 41 ARG H 1 41 ARG HG3 . . 3.820 2.494 2.266 2.828 . 0 0 "[ . 1 . 2]" 1
762 1 41 ARG H 1 42 MET H . . 2.580 2.121 1.876 2.273 . 0 0 "[ . 1 . 2]" 1
763 1 41 ARG H 1 42 MET HA . . 5.500 4.706 4.588 4.825 . 0 0 "[ . 1 . 2]" 1
764 1 41 ARG H 1 42 MET QG . . 4.550 3.644 3.003 4.302 . 0 0 "[ . 1 . 2]" 1
765 1 41 ARG H 1 43 MET H . . 4.440 3.956 3.541 4.459 0.019 2 0 "[ . 1 . 2]" 1
766 1 41 ARG HB2 1 41 ARG QD . . 2.980 2.094 1.938 2.482 . 0 0 "[ . 1 . 2]" 1
767 1 41 ARG HB2 1 42 MET H . . 4.750 4.367 4.137 4.451 . 0 0 "[ . 1 . 2]" 1
768 1 41 ARG HB3 1 41 ARG HG2 . . 2.530 2.253 2.213 2.346 . 0 0 "[ . 1 . 2]" 1
769 1 41 ARG HB3 1 42 MET H . . 5.120 4.434 4.262 4.518 . 0 0 "[ . 1 . 2]" 1
770 1 41 ARG QD 1 42 MET HA . . 5.340 4.912 4.405 5.378 0.038 14 0 "[ . 1 . 2]" 1
771 1 41 ARG HD2 1 42 MET H . . 5.500 5.362 4.697 5.535 0.035 8 0 "[ . 1 . 2]" 1
772 1 41 ARG HD3 1 42 MET H . . 5.500 5.401 4.985 5.567 0.067 14 0 "[ . 1 . 2]" 1
773 1 41 ARG HG2 1 42 MET H . . 4.470 4.305 3.537 4.531 0.061 9 0 "[ . 1 . 2]" 1
774 1 41 ARG HG3 1 42 MET H . . 3.610 3.174 2.642 3.390 . 0 0 "[ . 1 . 2]" 1
775 1 41 ARG HG3 1 42 MET HA . . 4.400 4.219 3.730 4.400 0.000 6 0 "[ . 1 . 2]" 1
776 1 42 MET H 1 42 MET QB . . 2.910 2.725 2.387 3.005 0.095 7 0 "[ . 1 . 2]" 1
777 1 42 MET H 1 42 MET HG2 . . 3.950 3.503 2.545 3.975 0.025 9 0 "[ . 1 . 2]" 1
778 1 42 MET H 1 42 MET QG . . 3.280 2.992 2.517 3.310 0.030 18 0 "[ . 1 . 2]" 1
779 1 42 MET H 1 42 MET HG3 . . 3.950 3.492 2.843 4.204 0.254 15 0 "[ . 1 . 2]" 1
780 1 42 MET H 1 43 MET H . . 2.830 2.121 1.862 2.756 . 0 0 "[ . 1 . 2]" 1
781 1 42 MET H 1 44 ALA H . . 4.910 4.252 3.984 4.780 . 0 0 "[ . 1 . 2]" 1
782 1 42 MET H 1 45 GLU H . . 5.500 5.396 5.135 5.563 0.063 14 0 "[ . 1 . 2]" 1
783 1 42 MET HA 1 42 MET HG2 . . 4.010 2.760 2.277 4.141 0.131 7 0 "[ . 1 . 2]" 1
784 1 42 MET HA 1 42 MET QG . . 3.370 2.608 2.240 3.338 . 0 0 "[ . 1 . 2]" 1
785 1 42 MET HA 1 42 MET HG3 . . 4.010 3.474 3.132 3.862 . 0 0 "[ . 1 . 2]" 1
786 1 42 MET HA 1 45 GLU H . . 4.630 3.585 3.305 3.894 . 0 0 "[ . 1 . 2]" 1
787 1 42 MET HA 1 45 GLU HB3 . . 3.960 3.726 3.195 4.004 0.044 7 0 "[ . 1 . 2]" 1
788 1 42 MET HA 1 45 GLU HG2 . . 3.670 2.107 1.975 2.317 . 0 0 "[ . 1 . 2]" 1
789 1 42 MET HA 1 45 GLU HG3 . . 4.670 3.636 3.020 3.858 . 0 0 "[ . 1 . 2]" 1
790 1 42 MET HA 1 46 ILE MG . . 4.960 4.480 4.205 4.760 . 0 0 "[ . 1 . 2]" 1
791 1 42 MET QB 1 43 MET H . . 3.990 3.722 3.465 3.999 0.009 7 0 "[ . 1 . 2]" 1
792 1 42 MET QG 1 43 MET H . . 5.340 4.199 3.096 4.553 . 0 0 "[ . 1 . 2]" 1
793 1 42 MET QG 1 46 ILE MG . . 5.340 4.312 1.900 4.977 . 0 0 "[ . 1 . 2]" 1
794 1 43 MET H 1 43 MET HB2 . . 3.720 3.074 2.466 3.646 . 0 0 "[ . 1 . 2]" 1
795 1 43 MET H 1 43 MET QB . . 3.040 2.403 2.265 2.579 . 0 0 "[ . 1 . 2]" 1
796 1 43 MET H 1 43 MET HB3 . . 3.720 2.595 2.431 2.699 . 0 0 "[ . 1 . 2]" 1
797 1 43 MET H 1 43 MET QG . . 4.670 3.093 2.023 4.062 . 0 0 "[ . 1 . 2]" 1
798 1 43 MET H 1 44 ALA H . . 3.450 2.398 2.129 2.659 . 0 0 "[ . 1 . 2]" 1
799 1 43 MET H 1 44 ALA HA . . 5.500 5.063 4.853 5.269 . 0 0 "[ . 1 . 2]" 1
800 1 43 MET H 1 44 ALA MB . . 5.500 4.075 3.811 4.357 . 0 0 "[ . 1 . 2]" 1
801 1 43 MET H 1 45 GLU H . . 4.420 3.971 3.575 4.350 . 0 0 "[ . 1 . 2]" 1
802 1 43 MET H 1 46 ILE MD . . 5.500 5.006 4.485 5.139 . 0 0 "[ . 1 . 2]" 1
803 1 43 MET HA 1 43 MET HG2 . . 3.810 3.656 3.420 3.766 . 0 0 "[ . 1 . 2]" 1
804 1 43 MET HA 1 43 MET HG3 . . 3.810 3.227 2.233 3.945 0.135 7 0 "[ . 1 . 2]" 1
805 1 43 MET HA 1 45 GLU H . . 5.500 3.623 3.486 3.818 . 0 0 "[ . 1 . 2]" 1
806 1 43 MET HA 1 46 ILE H . . 4.380 4.010 3.668 4.338 . 0 0 "[ . 1 . 2]" 1
807 1 43 MET HA 1 46 ILE HB . . 5.230 4.818 4.667 4.973 . 0 0 "[ . 1 . 2]" 1
808 1 43 MET HA 1 46 ILE MD . . 4.410 2.507 1.966 2.637 . 0 0 "[ . 1 . 2]" 1
809 1 43 MET HA 1 46 ILE HG12 . . 4.390 2.022 1.947 2.164 . 0 0 "[ . 1 . 2]" 1
810 1 43 MET HA 1 46 ILE HG13 . . 3.250 3.112 2.455 3.371 0.121 4 0 "[ . 1 . 2]" 1
811 1 43 MET HA 1 46 ILE MG . . 5.470 3.383 3.064 3.597 . 0 0 "[ . 1 . 2]" 1
812 1 43 MET HA 1 47 ASP H . . 5.500 4.998 4.288 5.355 . 0 0 "[ . 1 . 2]" 1
813 1 43 MET QB 1 44 ALA H . . 4.030 3.303 2.862 3.750 . 0 0 "[ . 1 . 2]" 1
814 1 43 MET QB 1 44 ALA HA . . 5.340 4.365 4.155 4.590 . 0 0 "[ . 1 . 2]" 1
815 1 43 MET QB 1 45 GLU H . . 5.340 4.664 4.491 4.908 . 0 0 "[ . 1 . 2]" 1
816 1 43 MET QB 1 46 ILE HG12 . . 5.340 3.997 3.677 4.299 . 0 0 "[ . 1 . 2]" 1
817 1 43 MET QG 1 44 ALA H . . 4.410 3.293 2.224 4.276 . 0 0 "[ . 1 . 2]" 1
818 1 43 MET QG 1 44 ALA HA . . 5.340 3.869 3.543 4.384 . 0 0 "[ . 1 . 2]" 1
819 1 43 MET QG 1 46 ILE HG13 . . 5.340 4.570 3.410 5.394 0.054 1 0 "[ . 1 . 2]" 1
820 1 43 MET HG2 1 44 ALA H . . 5.240 3.751 2.247 5.295 0.055 5 0 "[ . 1 . 2]" 1
821 1 43 MET HG3 1 44 ALA H . . 5.240 3.855 3.008 4.792 . 0 0 "[ . 1 . 2]" 1
822 1 44 ALA H 1 45 GLU H . . 2.810 2.465 2.222 2.637 . 0 0 "[ . 1 . 2]" 1
823 1 44 ALA H 1 45 GLU HG2 . . 4.430 3.766 3.469 4.213 . 0 0 "[ . 1 . 2]" 1
824 1 44 ALA H 1 46 ILE H . . 4.540 4.276 3.793 4.609 0.069 11 0 "[ . 1 . 2]" 1
825 1 44 ALA H 1 46 ILE MG . . 5.500 5.076 4.853 5.206 . 0 0 "[ . 1 . 2]" 1
826 1 44 ALA HA 1 45 GLU HB3 . . 5.500 5.273 5.062 5.457 . 0 0 "[ . 1 . 2]" 1
827 1 44 ALA HA 1 46 ILE H . . 5.130 3.768 3.574 3.969 . 0 0 "[ . 1 . 2]" 1
828 1 44 ALA MB 1 45 GLU H . . 5.010 3.423 3.223 3.552 . 0 0 "[ . 1 . 2]" 1
829 1 45 GLU H 1 45 GLU HB2 . . 4.090 3.837 3.742 3.952 . 0 0 "[ . 1 . 2]" 1
830 1 45 GLU H 1 45 GLU HB3 . . 3.610 3.034 2.800 3.298 . 0 0 "[ . 1 . 2]" 1
831 1 45 GLU H 1 45 GLU HG2 . . 3.830 2.463 2.272 3.208 . 0 0 "[ . 1 . 2]" 1
832 1 45 GLU H 1 45 GLU HG3 . . 4.120 3.276 2.353 3.709 . 0 0 "[ . 1 . 2]" 1
833 1 45 GLU H 1 46 ILE HG12 . . 4.920 3.317 2.807 4.024 . 0 0 "[ . 1 . 2]" 1
834 1 45 GLU H 1 46 ILE HG13 . . 3.560 3.322 2.411 3.579 0.019 18 0 "[ . 1 . 2]" 1
835 1 45 GLU H 1 46 ILE MG . . 4.960 3.650 3.473 3.796 . 0 0 "[ . 1 . 2]" 1
836 1 45 GLU HA 1 45 GLU HB2 . . 2.900 2.387 2.329 2.441 . 0 0 "[ . 1 . 2]" 1
837 1 45 GLU HA 1 45 GLU HG3 . . 3.920 3.682 3.565 3.812 . 0 0 "[ . 1 . 2]" 1
838 1 45 GLU HA 1 46 ILE H . . 3.530 3.095 2.904 3.351 . 0 0 "[ . 1 . 2]" 1
839 1 45 GLU HB2 1 45 GLU HG3 . . 2.940 2.476 2.315 2.842 . 0 0 "[ . 1 . 2]" 1
840 1 45 GLU HB3 1 46 ILE H . . 4.540 4.427 4.086 4.573 0.033 11 0 "[ . 1 . 2]" 1
841 1 45 GLU HG2 1 46 ILE H . . 5.370 3.868 2.962 4.795 . 0 0 "[ . 1 . 2]" 1
842 1 45 GLU HG3 1 46 ILE H . . 4.460 3.787 3.225 4.398 . 0 0 "[ . 1 . 2]" 1
843 1 45 GLU HG3 1 46 ILE HA . . 4.850 3.850 3.408 4.193 . 0 0 "[ . 1 . 2]" 1
844 1 45 GLU HG3 1 46 ILE HG13 . . 5.450 5.041 4.539 5.462 0.012 4 0 "[ . 1 . 2]" 1
845 1 46 ILE H 1 46 ILE HB . . 3.830 3.669 3.587 3.764 . 0 0 "[ . 1 . 2]" 1
846 1 46 ILE H 1 46 ILE MD . . 4.610 3.563 2.320 3.665 . 0 0 "[ . 1 . 2]" 1
847 1 46 ILE H 1 46 ILE HG12 . . 3.540 2.753 2.346 3.516 . 0 0 "[ . 1 . 2]" 1
848 1 46 ILE H 1 46 ILE HG13 . . 3.490 1.927 1.815 2.054 . 0 0 "[ . 1 . 2]" 1
849 1 46 ILE H 1 46 ILE MG . . 4.430 3.131 2.797 3.422 . 0 0 "[ . 1 . 2]" 1
850 1 46 ILE H 1 47 ASP H . . 3.100 2.014 1.853 2.691 . 0 0 "[ . 1 . 2]" 1
851 1 46 ILE H 1 47 ASP QB . . 5.340 4.472 4.276 4.919 . 0 0 "[ . 1 . 2]" 1
852 1 46 ILE H 1 48 THR H . . 5.500 3.830 3.524 4.171 . 0 0 "[ . 1 . 2]" 1
853 1 46 ILE HA 1 46 ILE HG13 . . 3.610 3.525 3.467 3.555 . 0 0 "[ . 1 . 2]" 1
854 1 46 ILE HA 1 46 ILE MG . . 3.650 2.109 1.996 2.192 . 0 0 "[ . 1 . 2]" 1
855 1 46 ILE HB 1 46 ILE MD . . 3.270 2.064 1.997 2.190 . 0 0 "[ . 1 . 2]" 1
856 1 46 ILE HB 1 46 ILE HG12 . . 2.970 2.913 2.576 2.972 0.002 6 0 "[ . 1 . 2]" 1
857 1 46 ILE HB 1 47 ASP H . . 3.960 3.642 2.367 3.923 . 0 0 "[ . 1 . 2]" 1
858 1 46 ILE HB 1 62 PHE HB2 . . 3.630 3.487 2.741 3.688 0.058 13 0 "[ . 1 . 2]" 1
859 1 46 ILE MD 1 46 ILE HG12 . . 2.400 2.076 2.072 2.089 . 0 0 "[ . 1 . 2]" 1
860 1 46 ILE MD 1 46 ILE HG13 . . 2.570 2.078 2.073 2.092 . 0 0 "[ . 1 . 2]" 1
861 1 46 ILE MD 1 47 ASP HB2 . . 4.260 2.928 2.175 3.545 . 0 0 "[ . 1 . 2]" 1
862 1 46 ILE MD 1 47 ASP QB . . 3.620 2.820 2.158 3.279 . 0 0 "[ . 1 . 2]" 1
863 1 46 ILE MD 1 47 ASP HB3 . . 4.260 3.834 3.419 4.080 . 0 0 "[ . 1 . 2]" 1
864 1 46 ILE MD 1 48 THR H . . 5.500 3.022 2.353 3.385 . 0 0 "[ . 1 . 2]" 1
865 1 46 ILE MD 1 62 PHE H . . 4.500 3.483 2.923 4.210 . 0 0 "[ . 1 . 2]" 1
866 1 46 ILE MD 1 62 PHE HB2 . . 4.440 2.533 2.080 3.549 . 0 0 "[ . 1 . 2]" 1
867 1 46 ILE MD 1 62 PHE HB3 . . 5.110 2.214 1.887 2.877 . 0 0 "[ . 1 . 2]" 1
868 1 46 ILE HG13 1 46 ILE MG . . 3.480 3.021 2.486 3.112 . 0 0 "[ . 1 . 2]" 1
869 1 46 ILE HG13 1 47 ASP H . . 5.500 2.104 1.850 3.073 . 0 0 "[ . 1 . 2]" 1
870 1 46 ILE HG13 1 47 ASP QB . . 5.340 3.546 3.296 4.626 . 0 0 "[ . 1 . 2]" 1
871 1 46 ILE MG 1 62 PHE H . . 5.500 5.117 4.930 5.190 . 0 0 "[ . 1 . 2]" 1
872 1 46 ILE MG 1 62 PHE HB2 . . 5.460 2.920 2.383 3.161 . 0 0 "[ . 1 . 2]" 1
873 1 46 ILE MG 1 62 PHE HB3 . . 5.500 3.974 3.476 4.314 . 0 0 "[ . 1 . 2]" 1
874 1 46 ILE MG 1 62 PHE HD2 . . 4.870 4.035 3.013 4.371 . 0 0 "[ . 1 . 2]" 1
875 1 47 ASP H 1 47 ASP HB2 . . 4.060 3.076 2.799 3.246 . 0 0 "[ . 1 . 2]" 1
876 1 47 ASP H 1 47 ASP QB . . 3.450 2.923 2.644 2.990 . 0 0 "[ . 1 . 2]" 1
877 1 47 ASP H 1 47 ASP HB3 . . 4.060 3.683 3.250 3.967 . 0 0 "[ . 1 . 2]" 1
878 1 47 ASP H 1 48 THR H . . 4.550 2.280 1.683 2.562 . 0 0 "[ . 1 . 2]" 1
879 1 47 ASP QB 1 48 THR H . . 3.280 2.435 2.006 2.968 . 0 0 "[ . 1 . 2]" 1
880 1 47 ASP QB 1 48 THR HB . . 5.340 4.830 3.924 5.190 . 0 0 "[ . 1 . 2]" 1
881 1 47 ASP HB2 1 48 THR H . . 3.870 2.930 2.030 3.604 . 0 0 "[ . 1 . 2]" 1
882 1 47 ASP HB2 1 54 ILE MG . . 5.390 4.219 3.410 4.697 . 0 0 "[ . 1 . 2]" 1
883 1 47 ASP HB2 1 58 GLU HA . . 4.510 3.222 2.881 3.620 . 0 0 "[ . 1 . 2]" 1
884 1 47 ASP HB3 1 48 THR H . . 3.870 2.747 2.203 3.224 . 0 0 "[ . 1 . 2]" 1
885 1 47 ASP HB3 1 54 ILE MG . . 5.390 3.591 3.237 4.112 . 0 0 "[ . 1 . 2]" 1
886 1 47 ASP HB3 1 58 GLU HA . . 4.510 2.854 2.229 3.416 . 0 0 "[ . 1 . 2]" 1
887 1 48 THR H 1 48 THR HB . . 3.570 2.768 2.520 3.229 . 0 0 "[ . 1 . 2]" 1
888 1 48 THR H 1 49 ASP H . . 5.500 4.474 4.324 4.644 . 0 0 "[ . 1 . 2]" 1
889 1 48 THR H 1 54 ILE MG . . 4.820 3.527 3.264 3.781 . 0 0 "[ . 1 . 2]" 1
890 1 48 THR HA 1 49 ASP H . . 3.510 2.161 2.140 2.409 . 0 0 "[ . 1 . 2]" 1
891 1 48 THR HA 1 54 ILE MG . . 4.260 3.231 2.029 3.467 . 0 0 "[ . 1 . 2]" 1
892 1 48 THR HB 1 49 ASP H . . 5.500 4.163 3.743 4.379 . 0 0 "[ . 1 . 2]" 1
893 1 48 THR HB 1 52 GLY H . . 5.500 4.824 4.140 5.668 0.168 12 0 "[ . 1 . 2]" 1
894 1 48 THR HB 1 52 GLY QA . . 4.830 4.629 3.676 4.917 0.087 7 0 "[ . 1 . 2]" 1
895 1 48 THR HB 1 53 PHE H . . 5.500 5.039 3.691 5.512 0.012 7 0 "[ . 1 . 2]" 1
896 1 48 THR HB 1 54 ILE MG . . 5.090 3.984 2.339 4.322 . 0 0 "[ . 1 . 2]" 1
897 1 48 THR MG 1 49 ASP H . . 4.000 2.903 2.435 3.475 . 0 0 "[ . 1 . 2]" 1
898 1 48 THR MG 1 52 GLY QA . . 5.340 2.621 1.914 3.304 . 0 0 "[ . 1 . 2]" 1
899 1 48 THR MG 1 53 PHE H . . 5.500 2.454 1.872 3.956 . 0 0 "[ . 1 . 2]" 1
900 1 49 ASP H 1 49 ASP HB2 . . 3.760 2.671 2.233 3.661 . 0 0 "[ . 1 . 2]" 1
901 1 49 ASP H 1 49 ASP QB . . 3.190 2.462 2.161 3.313 0.123 6 0 "[ . 1 . 2]" 1
902 1 49 ASP H 1 49 ASP HB3 . . 3.760 3.173 2.376 3.783 0.023 6 0 "[ . 1 . 2]" 1
903 1 49 ASP H 1 50 GLY H . . 3.220 2.522 1.838 3.214 . 0 0 "[ . 1 . 2]" 1
904 1 49 ASP H 1 54 ILE MG . . 5.500 4.854 3.147 5.064 . 0 0 "[ . 1 . 2]" 1
905 1 49 ASP QB 1 50 GLY H . . 3.030 2.697 1.940 3.222 0.192 11 0 "[ . 1 . 2]" 1
906 1 51 ASP H 1 51 ASP QB . . 3.290 2.554 2.192 3.187 . 0 0 "[ . 1 . 2]" 1
907 1 51 ASP H 1 52 GLY H . . 3.060 2.452 1.890 2.880 . 0 0 "[ . 1 . 2]" 1
908 1 51 ASP H 1 52 GLY HA2 . . 5.500 4.736 4.033 5.217 . 0 0 "[ . 1 . 2]" 1
909 1 51 ASP H 1 52 GLY HA3 . . 5.500 5.040 4.515 5.406 . 0 0 "[ . 1 . 2]" 1
910 1 51 ASP HB2 1 52 GLY H . . 5.500 3.116 2.308 4.252 . 0 0 "[ . 1 . 2]" 1
911 1 51 ASP HB3 1 52 GLY H . . 5.500 3.753 2.505 4.378 . 0 0 "[ . 1 . 2]" 1
912 1 52 GLY H 1 53 PHE H . . 2.690 2.176 1.877 2.634 . 0 0 "[ . 1 . 2]" 1
913 1 52 GLY QA 1 53 PHE H . . 3.050 2.786 2.483 2.919 . 0 0 "[ . 1 . 2]" 1
914 1 52 GLY QA 1 53 PHE HA . . 5.340 4.002 3.964 4.024 . 0 0 "[ . 1 . 2]" 1
915 1 53 PHE H 1 53 PHE HB2 . . 3.170 2.820 2.657 2.900 . 0 0 "[ . 1 . 2]" 1
916 1 53 PHE H 1 53 PHE HB3 . . 4.000 3.879 3.775 3.920 . 0 0 "[ . 1 . 2]" 1
917 1 53 PHE H 1 53 PHE QD . . 4.760 2.994 2.710 3.408 . 0 0 "[ . 1 . 2]" 1
918 1 53 PHE H 1 54 ILE H . . 4.920 4.408 4.396 4.427 . 0 0 "[ . 1 . 2]" 1
919 1 53 PHE HA 1 53 PHE QD . . 3.330 3.041 2.846 3.124 . 0 0 "[ . 1 . 2]" 1
920 1 53 PHE HA 1 53 PHE QE . . 5.500 4.676 4.561 4.772 . 0 0 "[ . 1 . 2]" 1
921 1 53 PHE HA 1 54 ILE H . . 2.990 2.502 2.469 2.562 . 0 0 "[ . 1 . 2]" 1
922 1 53 PHE HA 1 54 ILE HA . . 4.810 4.545 4.532 4.560 . 0 0 "[ . 1 . 2]" 1
923 1 53 PHE HA 1 54 ILE QG . . 5.180 3.201 3.114 3.299 . 0 0 "[ . 1 . 2]" 1
924 1 53 PHE HA 1 54 ILE MG . . 4.330 3.738 3.606 3.852 . 0 0 "[ . 1 . 2]" 1
925 1 53 PHE HB2 1 53 PHE QD . . 3.290 2.436 2.354 2.483 . 0 0 "[ . 1 . 2]" 1
926 1 53 PHE HB2 1 54 ILE H . . 3.460 3.445 3.303 3.544 0.084 7 0 "[ . 1 . 2]" 1
927 1 53 PHE HB3 1 54 ILE H . . 3.140 2.229 2.117 2.294 . 0 0 "[ . 1 . 2]" 1
928 1 53 PHE QD 1 54 ILE H . . 4.950 3.652 3.341 3.901 . 0 0 "[ . 1 . 2]" 1
929 1 54 ILE H 1 54 ILE HB . . 4.030 3.873 3.842 3.902 . 0 0 "[ . 1 . 2]" 1
930 1 54 ILE H 1 54 ILE MD . . 5.010 4.042 3.982 4.067 . 0 0 "[ . 1 . 2]" 1
931 1 54 ILE H 1 54 ILE HG12 . . 3.600 2.469 2.373 2.560 . 0 0 "[ . 1 . 2]" 1
932 1 54 ILE H 1 54 ILE QG . . 3.080 2.351 2.280 2.384 . 0 0 "[ . 1 . 2]" 1
933 1 54 ILE H 1 54 ILE HG13 . . 3.600 2.968 2.842 3.138 . 0 0 "[ . 1 . 2]" 1
934 1 54 ILE H 1 54 ILE MG . . 3.630 3.395 3.311 3.464 . 0 0 "[ . 1 . 2]" 1
935 1 54 ILE HA 1 55 ASP H . . 2.970 2.170 2.139 2.411 . 0 0 "[ . 1 . 2]" 1
936 1 54 ILE HB 1 54 ILE MD . . 3.300 2.403 2.356 2.472 . 0 0 "[ . 1 . 2]" 1
937 1 54 ILE HB 1 55 ASP H . . 3.500 3.193 2.361 3.461 . 0 0 "[ . 1 . 2]" 1
938 1 54 ILE HB 1 56 PHE H . . 4.240 3.927 3.680 4.061 . 0 0 "[ . 1 . 2]" 1
939 1 54 ILE HB 1 58 GLU HB2 . . 2.770 2.257 2.053 2.468 . 0 0 "[ . 1 . 2]" 1
940 1 54 ILE HB 1 59 PHE H . . 4.180 3.045 2.769 3.405 . 0 0 "[ . 1 . 2]" 1
941 1 54 ILE MD 1 58 GLU H . . 5.500 5.041 4.889 5.166 . 0 0 "[ . 1 . 2]" 1
942 1 54 ILE MD 1 58 GLU HB2 . . 4.180 3.603 3.358 3.821 . 0 0 "[ . 1 . 2]" 1
943 1 54 ILE MD 1 59 PHE H . . 3.750 3.444 3.208 3.622 . 0 0 "[ . 1 . 2]" 1
944 1 54 ILE MD 1 59 PHE HA . . 3.560 2.043 1.879 2.262 . 0 0 "[ . 1 . 2]" 1
945 1 54 ILE MD 1 59 PHE HB2 . . 3.570 1.961 1.907 2.060 . 0 0 "[ . 1 . 2]" 1
946 1 54 ILE MD 1 59 PHE QD . . 3.470 2.156 1.959 2.561 . 0 0 "[ . 1 . 2]" 1
947 1 54 ILE MD 1 59 PHE QE . . 5.130 4.158 4.014 4.362 . 0 0 "[ . 1 . 2]" 1
948 1 54 ILE QG 1 58 GLU HB2 . . 4.840 4.249 4.090 4.422 . 0 0 "[ . 1 . 2]" 1
949 1 54 ILE QG 1 59 PHE HA . . 5.340 4.062 3.733 4.381 . 0 0 "[ . 1 . 2]" 1
950 1 54 ILE QG 1 59 PHE HB2 . . 4.350 2.709 2.434 2.972 . 0 0 "[ . 1 . 2]" 1
951 1 54 ILE MG 1 55 ASP H . . 4.300 3.676 3.394 3.824 . 0 0 "[ . 1 . 2]" 1
952 1 54 ILE MG 1 56 PHE H . . 5.500 4.976 4.848 5.033 . 0 0 "[ . 1 . 2]" 1
953 1 54 ILE MG 1 58 GLU H . . 5.400 4.153 4.045 4.258 . 0 0 "[ . 1 . 2]" 1
954 1 54 ILE MG 1 58 GLU HA . . 5.500 4.049 3.942 4.254 . 0 0 "[ . 1 . 2]" 1
955 1 54 ILE MG 1 58 GLU HB2 . . 4.040 2.015 1.951 2.160 . 0 0 "[ . 1 . 2]" 1
956 1 54 ILE MG 1 58 GLU HB3 . . 3.770 2.204 1.961 2.586 . 0 0 "[ . 1 . 2]" 1
957 1 54 ILE MG 1 58 GLU QG . . 4.300 3.123 2.785 3.416 . 0 0 "[ . 1 . 2]" 1
958 1 54 ILE MG 1 59 PHE H . . 4.410 3.840 3.649 4.065 . 0 0 "[ . 1 . 2]" 1
959 1 54 ILE MG 1 59 PHE HB2 . . 5.500 3.905 3.779 4.030 . 0 0 "[ . 1 . 2]" 1
960 1 54 ILE MG 1 59 PHE QD . . 5.500 4.859 4.736 4.968 . 0 0 "[ . 1 . 2]" 1
961 1 55 ASP H 1 55 ASP HB2 . . 3.800 2.700 2.330 3.079 . 0 0 "[ . 1 . 2]" 1
962 1 55 ASP H 1 55 ASP QB . . 2.980 2.245 2.194 2.391 . 0 0 "[ . 1 . 2]" 1
963 1 55 ASP H 1 55 ASP HB3 . . 3.800 2.587 2.285 3.590 . 0 0 "[ . 1 . 2]" 1
964 1 55 ASP H 1 56 PHE H . . 3.140 2.905 2.549 3.106 . 0 0 "[ . 1 . 2]" 1
965 1 55 ASP H 1 58 GLU HB2 . . 4.050 3.579 3.430 3.780 . 0 0 "[ . 1 . 2]" 1
966 1 55 ASP HA 1 55 ASP QB . . 2.440 2.315 2.267 2.441 0.001 3 0 "[ . 1 . 2]" 1
967 1 55 ASP HA 1 57 ASN H . . 5.500 5.579 5.510 5.624 0.124 18 0 "[ . 1 . 2]" 1
968 1 55 ASP QB 1 56 PHE H . . 3.060 2.159 2.046 2.302 . 0 0 "[ . 1 . 2]" 1
969 1 55 ASP QB 1 56 PHE HB2 . . 5.190 4.182 3.367 4.472 . 0 0 "[ . 1 . 2]" 1
970 1 55 ASP QB 1 56 PHE HB3 . . 5.340 4.127 3.563 4.502 . 0 0 "[ . 1 . 2]" 1
971 1 55 ASP QB 1 57 ASN H . . 4.570 3.494 3.328 3.594 . 0 0 "[ . 1 . 2]" 1
972 1 55 ASP HB2 1 56 PHE H . . 3.850 3.368 2.100 3.762 . 0 0 "[ . 1 . 2]" 1
973 1 55 ASP HB3 1 56 PHE H . . 3.850 2.325 2.079 3.039 . 0 0 "[ . 1 . 2]" 1
974 1 56 PHE H 1 56 PHE HB2 . . 3.520 3.378 3.217 3.484 . 0 0 "[ . 1 . 2]" 1
975 1 56 PHE H 1 56 PHE HB3 . . 3.780 3.091 2.955 3.275 . 0 0 "[ . 1 . 2]" 1
976 1 56 PHE H 1 57 ASN H . . 2.770 2.178 2.078 2.238 . 0 0 "[ . 1 . 2]" 1
977 1 56 PHE H 1 57 ASN QB . . 4.030 3.698 3.591 3.761 . 0 0 "[ . 1 . 2]" 1
978 1 56 PHE H 1 60 ILE H . . 5.500 5.336 5.261 5.453 . 0 0 "[ . 1 . 2]" 1
979 1 56 PHE HA 1 56 PHE HD1 . . 3.770 2.460 2.034 3.242 . 0 0 "[ . 1 . 2]" 1
980 1 56 PHE HA 1 57 ASN QB . . 5.340 5.242 5.215 5.325 . 0 0 "[ . 1 . 2]" 1
981 1 56 PHE HA 1 58 GLU H . . 5.500 4.499 3.948 4.801 . 0 0 "[ . 1 . 2]" 1
982 1 56 PHE HA 1 59 PHE H . . 3.880 3.380 3.143 3.568 . 0 0 "[ . 1 . 2]" 1
983 1 56 PHE HA 1 60 ILE H . . 4.860 4.279 4.068 4.553 . 0 0 "[ . 1 . 2]" 1
984 1 56 PHE HA 1 60 ILE QG . . 5.110 3.899 3.694 4.236 . 0 0 "[ . 1 . 2]" 1
985 1 56 PHE HB2 1 57 ASN H . . 3.720 3.667 3.450 3.767 0.047 16 0 "[ . 1 . 2]" 1
986 1 56 PHE HB2 1 57 ASN QB . . 5.340 5.373 5.153 5.436 0.096 8 0 "[ . 1 . 2]" 1
987 1 56 PHE HB3 1 57 ASN H . . 3.240 2.351 2.290 2.432 . 0 0 "[ . 1 . 2]" 1
988 1 56 PHE HB3 1 57 ASN HA . . 5.500 4.107 3.871 4.229 . 0 0 "[ . 1 . 2]" 1
989 1 56 PHE HB3 1 60 ILE QG . . 5.500 4.633 4.296 4.752 . 0 0 "[ . 1 . 2]" 1
990 1 56 PHE HD1 1 60 ILE MD . . 4.380 3.512 3.314 3.683 . 0 0 "[ . 1 . 2]" 1
991 1 56 PHE HE1 1 60 ILE MD . . 5.110 2.008 1.956 2.355 . 0 0 "[ . 1 . 2]" 1
992 1 56 PHE HE1 1 60 ILE QG . . 4.670 2.604 2.024 2.927 . 0 0 "[ . 1 . 2]" 1
993 1 56 PHE HE1 1 60 ILE MG . . 5.500 4.561 3.899 4.798 . 0 0 "[ . 1 . 2]" 1
994 1 57 ASN H 1 57 ASN HB2 . . 3.640 2.218 2.074 2.899 . 0 0 "[ . 1 . 2]" 1
995 1 57 ASN H 1 57 ASN QB . . 2.880 2.111 2.050 2.224 . 0 0 "[ . 1 . 2]" 1
996 1 57 ASN H 1 57 ASN HB3 . . 3.640 3.068 2.218 3.532 . 0 0 "[ . 1 . 2]" 1
997 1 57 ASN H 1 57 ASN QD . . 3.810 3.458 2.426 3.875 0.065 2 0 "[ . 1 . 2]" 1
998 1 57 ASN H 1 58 GLU H . . 3.000 2.818 2.668 2.886 . 0 0 "[ . 1 . 2]" 1
999 1 57 ASN HA 1 58 GLU QG . . 5.340 5.174 4.959 5.384 0.044 18 0 "[ . 1 . 2]" 1
1000 1 57 ASN HA 1 60 ILE H . . 3.860 3.464 3.203 3.721 . 0 0 "[ . 1 . 2]" 1
1001 1 57 ASN HA 1 60 ILE HB . . 3.790 3.050 2.776 3.313 . 0 0 "[ . 1 . 2]" 1
1002 1 57 ASN HA 1 60 ILE QG . . 4.110 3.506 3.252 3.673 . 0 0 "[ . 1 . 2]" 1
1003 1 57 ASN HA 1 60 ILE MG . . 5.500 4.435 4.231 4.659 . 0 0 "[ . 1 . 2]" 1
1004 1 57 ASN HA 1 61 SER H . . 5.500 4.274 3.937 4.570 . 0 0 "[ . 1 . 2]" 1
1005 1 57 ASN QB 1 58 GLU HA . . 4.920 3.890 3.709 4.459 . 0 0 "[ . 1 . 2]" 1
1006 1 57 ASN QB 1 59 PHE H . . 5.340 4.439 4.264 4.741 . 0 0 "[ . 1 . 2]" 1
1007 1 57 ASN QB 1 61 SER H . . 5.340 5.158 4.717 5.365 0.025 8 0 "[ . 1 . 2]" 1
1008 1 57 ASN HB2 1 58 GLU H . . 3.920 3.349 2.742 4.016 0.096 16 0 "[ . 1 . 2]" 1
1009 1 57 ASN HB3 1 58 GLU H . . 3.920 2.751 2.404 3.563 . 0 0 "[ . 1 . 2]" 1
1010 1 57 ASN QD 1 58 GLU H . . 5.170 4.608 2.275 5.003 . 0 0 "[ . 1 . 2]" 1
1011 1 58 GLU H 1 58 GLU HB2 . . 2.860 2.521 2.348 2.680 . 0 0 "[ . 1 . 2]" 1
1012 1 58 GLU H 1 58 GLU HB3 . . 3.630 3.594 3.578 3.635 0.005 13 0 "[ . 1 . 2]" 1
1013 1 58 GLU H 1 58 GLU QG . . 3.110 2.343 1.919 2.867 . 0 0 "[ . 1 . 2]" 1
1014 1 58 GLU HA 1 58 GLU QG . . 3.640 2.556 2.303 3.142 . 0 0 "[ . 1 . 2]" 1
1015 1 58 GLU HA 1 61 SER H . . 4.180 3.422 3.254 3.738 . 0 0 "[ . 1 . 2]" 1
1016 1 58 GLU HA 1 62 PHE H . . 5.170 4.691 4.273 5.067 . 0 0 "[ . 1 . 2]" 1
1017 1 58 GLU HB2 1 59 PHE H . . 3.190 3.012 2.846 3.205 0.015 19 0 "[ . 1 . 2]" 1
1018 1 58 GLU HB3 1 59 PHE H . . 4.350 3.979 3.741 4.161 . 0 0 "[ . 1 . 2]" 1
1019 1 59 PHE H 1 59 PHE HB3 . . 2.990 2.259 2.228 2.289 . 0 0 "[ . 1 . 2]" 1
1020 1 59 PHE H 1 60 ILE HB . . 5.070 4.637 4.421 4.808 . 0 0 "[ . 1 . 2]" 1
1021 1 59 PHE H 1 61 SER H . . 4.100 3.801 3.689 3.969 . 0 0 "[ . 1 . 2]" 1
1022 1 59 PHE H 1 62 PHE H . . 5.500 5.393 5.253 5.535 0.035 4 0 "[ . 1 . 2]" 1
1023 1 59 PHE HA 1 59 PHE HB2 . . 2.400 2.332 2.319 2.351 . 0 0 "[ . 1 . 2]" 1
1024 1 59 PHE HA 1 59 PHE QD . . 4.230 2.932 2.806 3.050 . 0 0 "[ . 1 . 2]" 1
1025 1 59 PHE HA 1 61 SER H . . 4.630 4.244 4.017 4.500 . 0 0 "[ . 1 . 2]" 1
1026 1 59 PHE HB3 1 59 PHE QD . . 3.330 2.346 2.302 2.399 . 0 0 "[ . 1 . 2]" 1
1027 1 59 PHE HB3 1 60 ILE H . . 3.270 2.926 2.564 3.162 . 0 0 "[ . 1 . 2]" 1
1028 1 59 PHE HB3 1 60 ILE HB . . 5.310 5.064 4.871 5.180 . 0 0 "[ . 1 . 2]" 1
1029 1 59 PHE HB3 1 61 SER H . . 5.500 5.035 4.696 5.232 . 0 0 "[ . 1 . 2]" 1
1030 1 59 PHE QD 1 60 ILE H . . 5.500 3.267 2.671 3.559 . 0 0 "[ . 1 . 2]" 1
1031 1 59 PHE QD 1 60 ILE HA . . 4.580 3.503 2.982 3.707 . 0 0 "[ . 1 . 2]" 1
1032 1 59 PHE QD 1 60 ILE MD . . 4.660 2.396 2.131 2.622 . 0 0 "[ . 1 . 2]" 1
1033 1 59 PHE QD 1 60 ILE QG . . 4.830 2.265 1.976 2.526 . 0 0 "[ . 1 . 2]" 1
1034 1 59 PHE QD 1 60 ILE MG . . 5.500 4.566 4.186 4.783 . 0 0 "[ . 1 . 2]" 1
1035 1 59 PHE QE 1 60 ILE QG . . 5.500 3.828 3.622 4.000 . 0 0 "[ . 1 . 2]" 1
1036 1 60 ILE H 1 60 ILE HB . . 3.150 2.464 2.425 2.498 . 0 0 "[ . 1 . 2]" 1
1037 1 60 ILE H 1 60 ILE MD . . 4.430 3.559 3.345 3.673 . 0 0 "[ . 1 . 2]" 1
1038 1 60 ILE H 1 60 ILE QG . . 2.950 2.372 2.181 2.536 . 0 0 "[ . 1 . 2]" 1
1039 1 60 ILE H 1 60 ILE MG . . 4.410 3.764 3.749 3.776 . 0 0 "[ . 1 . 2]" 1
1040 1 60 ILE H 1 61 SER H . . 3.370 2.365 2.212 2.525 . 0 0 "[ . 1 . 2]" 1
1041 1 60 ILE H 1 62 PHE H . . 4.670 4.486 4.008 4.664 . 0 0 "[ . 1 . 2]" 1
1042 1 60 ILE H 1 63 CYS H . . 5.190 4.672 4.552 4.813 . 0 0 "[ . 1 . 2]" 1
1043 1 60 ILE H 1 63 CYS QB . . 4.800 4.365 4.107 4.804 0.004 12 0 "[ . 1 . 2]" 1
1044 1 60 ILE HA 1 60 ILE MD . . 3.400 1.987 1.954 2.037 . 0 0 "[ . 1 . 2]" 1
1045 1 60 ILE HA 1 60 ILE QG . . 3.630 2.834 2.764 2.924 . 0 0 "[ . 1 . 2]" 1
1046 1 60 ILE HA 1 60 ILE MG . . 3.680 2.403 2.348 2.434 . 0 0 "[ . 1 . 2]" 1
1047 1 60 ILE HA 1 62 PHE H . . 5.500 4.414 3.656 4.751 . 0 0 "[ . 1 . 2]" 1
1048 1 60 ILE HA 1 63 CYS H . . 4.270 3.102 2.823 3.322 . 0 0 "[ . 1 . 2]" 1
1049 1 60 ILE HA 1 63 CYS QB . . 3.170 1.988 1.927 2.123 . 0 0 "[ . 1 . 2]" 1
1050 1 60 ILE HB 1 61 SER H . . 3.370 2.957 2.758 3.131 . 0 0 "[ . 1 . 2]" 1
1051 1 60 ILE HB 1 62 PHE H . . 5.500 5.496 5.037 5.635 0.135 5 0 "[ . 1 . 2]" 1
1052 1 60 ILE HB 1 63 CYS QB . . 5.200 4.699 4.367 4.960 . 0 0 "[ . 1 . 2]" 1
1053 1 60 ILE MD 1 61 SER H . . 5.500 4.734 4.638 4.781 . 0 0 "[ . 1 . 2]" 1
1054 1 60 ILE MD 1 63 CYS H . . 5.500 4.607 4.298 4.831 . 0 0 "[ . 1 . 2]" 1
1055 1 60 ILE MD 1 63 CYS QB . . 4.220 2.798 2.542 2.966 . 0 0 "[ . 1 . 2]" 1
1056 1 60 ILE QG 1 61 SER H . . 4.650 4.155 4.102 4.214 . 0 0 "[ . 1 . 2]" 1
1057 1 60 ILE MG 1 61 SER H . . 3.970 3.622 3.443 3.762 . 0 0 "[ . 1 . 2]" 1
1058 1 60 ILE MG 1 61 SER HA . . 3.830 3.537 3.379 3.684 . 0 0 "[ . 1 . 2]" 1
1059 1 60 ILE MG 1 63 CYS H . . 5.500 4.134 3.861 4.295 . 0 0 "[ . 1 . 2]" 1
1060 1 61 SER H 1 61 SER HB2 . . 3.940 2.657 2.079 3.591 . 0 0 "[ . 1 . 2]" 1
1061 1 61 SER H 1 61 SER QB . . 3.390 2.233 2.054 2.499 . 0 0 "[ . 1 . 2]" 1
1062 1 61 SER H 1 61 SER HB3 . . 3.940 2.812 2.215 3.593 . 0 0 "[ . 1 . 2]" 1
1063 1 61 SER H 1 62 PHE HB3 . . 5.500 4.853 4.522 5.007 . 0 0 "[ . 1 . 2]" 1
1064 1 61 SER H 1 62 PHE HD1 . . 5.350 5.053 4.716 5.446 0.096 15 0 "[ . 1 . 2]" 1
1065 1 61 SER H 1 63 CYS H . . 4.290 3.756 3.698 3.937 . 0 0 "[ . 1 . 2]" 1
1066 1 61 SER QB 1 62 PHE H . . 3.320 2.602 2.163 3.317 . 0 0 "[ . 1 . 2]" 1
1067 1 62 PHE H 1 62 PHE HB2 . . 3.490 3.387 3.344 3.496 0.006 1 0 "[ . 1 . 2]" 1
1068 1 62 PHE H 1 62 PHE HB3 . . 2.690 2.145 2.085 2.279 . 0 0 "[ . 1 . 2]" 1
1069 1 62 PHE H 1 62 PHE HD1 . . 4.600 3.086 2.815 3.272 . 0 0 "[ . 1 . 2]" 1
1070 1 62 PHE H 1 62 PHE HE1 . . 5.500 5.511 5.252 5.681 0.181 20 0 "[ . 1 . 2]" 1
1071 1 62 PHE H 1 63 CYS H . . 2.580 2.374 2.086 2.576 . 0 0 "[ . 1 . 2]" 1
1072 1 62 PHE H 1 63 CYS HA . . 5.500 5.001 4.762 5.131 . 0 0 "[ . 1 . 2]" 1
1073 1 62 PHE H 1 63 CYS QB . . 4.580 4.184 4.033 4.351 . 0 0 "[ . 1 . 2]" 1
1074 1 62 PHE HA 1 62 PHE HD2 . . 3.830 3.651 3.489 3.839 0.009 16 0 "[ . 1 . 2]" 1
1075 1 62 PHE HA 1 64 ASN H . . 4.760 3.952 3.614 4.774 0.014 7 0 "[ . 1 . 2]" 1
1076 1 62 PHE HB2 1 62 PHE HD2 . . 3.370 2.347 2.318 2.372 . 0 0 "[ . 1 . 2]" 1
1077 1 62 PHE HB2 1 63 CYS H . . 4.580 4.403 4.338 4.466 . 0 0 "[ . 1 . 2]" 1
1078 1 62 PHE HB3 1 62 PHE HD1 . . 3.330 2.506 2.466 2.561 . 0 0 "[ . 1 . 2]" 1
1079 1 62 PHE HB3 1 63 CYS H . . 3.700 3.554 3.423 3.728 0.028 2 0 "[ . 1 . 2]" 1
1080 1 62 PHE HB3 1 63 CYS QB . . 5.340 5.016 4.680 5.367 0.027 3 0 "[ . 1 . 2]" 1
1081 1 62 PHE HD1 1 63 CYS H . . 4.480 2.872 2.522 3.061 . 0 0 "[ . 1 . 2]" 1
1082 1 62 PHE HD1 1 63 CYS HA . . 4.000 3.904 3.703 4.041 0.041 16 0 "[ . 1 . 2]" 1
1083 1 62 PHE HD1 1 70 MET QG . . 5.340 5.284 5.172 5.405 0.065 15 0 "[ . 1 . 2]" 1
1084 1 62 PHE HE1 1 63 CYS HA . . 5.500 4.117 3.887 4.268 . 0 0 "[ . 1 . 2]" 1
1085 1 62 PHE HE1 1 70 MET QG . . 4.610 4.574 4.300 4.665 0.055 9 0 "[ . 1 . 2]" 1
1086 1 63 CYS H 1 63 CYS HB2 . . 3.740 2.545 2.184 2.970 . 0 0 "[ . 1 . 2]" 1
1087 1 63 CYS H 1 63 CYS QB . . 3.260 2.281 2.163 2.363 . 0 0 "[ . 1 . 2]" 1
1088 1 63 CYS H 1 63 CYS HB3 . . 3.740 2.925 2.353 3.606 . 0 0 "[ . 1 . 2]" 1
1089 1 63 CYS H 1 65 ALA H . . 5.500 5.544 5.165 5.643 0.143 6 0 "[ . 1 . 2]" 1
1090 1 63 CYS HA 1 64 ASN HA . . 5.470 4.602 4.425 4.696 . 0 0 "[ . 1 . 2]" 1
1091 1 63 CYS HA 1 65 ALA H . . 4.700 3.333 3.063 3.519 . 0 0 "[ . 1 . 2]" 1
1092 1 63 CYS HA 1 65 ALA HA . . 5.500 5.048 4.774 5.168 . 0 0 "[ . 1 . 2]" 1
1093 1 63 CYS HA 1 69 LEU MD1 . . 5.500 3.016 2.154 3.651 . 0 0 "[ . 1 . 2]" 1
1094 1 63 CYS HA 1 69 LEU HG . . 5.500 4.519 4.048 4.837 . 0 0 "[ . 1 . 2]" 1
1095 1 63 CYS HA 1 70 MET H . . 5.500 5.579 5.060 5.690 0.190 7 0 "[ . 1 . 2]" 1
1096 1 63 CYS HA 1 70 MET QB . . 4.590 3.807 3.132 4.347 . 0 0 "[ . 1 . 2]" 1
1097 1 63 CYS HA 1 70 MET HG2 . . 3.640 3.418 2.409 3.695 0.055 18 0 "[ . 1 . 2]" 1
1098 1 63 CYS HA 1 70 MET HG3 . . 3.640 2.212 1.941 3.699 0.059 12 0 "[ . 1 . 2]" 1
1099 1 63 CYS QB 1 64 ASN H . . 4.350 3.971 3.897 4.046 . 0 0 "[ . 1 . 2]" 1
1100 1 63 CYS QB 1 65 ALA H . . 5.340 4.581 4.181 5.020 . 0 0 "[ . 1 . 2]" 1
1101 1 63 CYS QB 1 70 MET QB . . 5.180 3.755 2.981 4.242 . 0 0 "[ . 1 . 2]" 1
1102 1 63 CYS HB2 1 64 ASN H . . 5.200 4.531 4.378 4.654 . 0 0 "[ . 1 . 2]" 1
1103 1 63 CYS HB3 1 64 ASN H . . 5.200 4.398 4.279 4.541 . 0 0 "[ . 1 . 2]" 1
1104 1 64 ASN H 1 64 ASN HB2 . . 3.040 2.598 2.298 2.794 . 0 0 "[ . 1 . 2]" 1
1105 1 64 ASN H 1 64 ASN HD21 . . 4.290 3.355 2.500 3.981 . 0 0 "[ . 1 . 2]" 1
1106 1 64 ASN H 1 64 ASN QD . . 3.690 3.145 2.438 3.653 . 0 0 "[ . 1 . 2]" 1
1107 1 64 ASN H 1 64 ASN HD22 . . 4.290 3.864 3.263 4.291 0.001 8 0 "[ . 1 . 2]" 1
1108 1 64 ASN H 1 65 ALA H . . 3.310 2.530 2.069 2.825 . 0 0 "[ . 1 . 2]" 1
1109 1 64 ASN H 1 65 ALA MB . . 5.030 4.500 4.339 4.613 . 0 0 "[ . 1 . 2]" 1
1110 1 64 ASN H 1 66 ASN H . . 5.380 4.553 4.013 5.102 . 0 0 "[ . 1 . 2]" 1
1111 1 64 ASN H 1 70 MET QB . . 5.340 4.995 4.378 5.387 0.047 12 0 "[ . 1 . 2]" 1
1112 1 64 ASN H 1 70 MET HG2 . . 5.500 4.677 4.215 5.058 . 0 0 "[ . 1 . 2]" 1
1113 1 64 ASN H 1 70 MET HG3 . . 5.500 3.836 3.333 4.891 . 0 0 "[ . 1 . 2]" 1
1114 1 64 ASN HA 1 65 ALA MB . . 4.140 3.994 3.891 4.078 . 0 0 "[ . 1 . 2]" 1
1115 1 64 ASN HB2 1 64 ASN QD . . 3.400 2.498 2.095 3.349 . 0 0 "[ . 1 . 2]" 1
1116 1 64 ASN HB2 1 65 ALA H . . 3.470 2.924 2.603 3.387 . 0 0 "[ . 1 . 2]" 1
1117 1 64 ASN HB2 1 65 ALA HA . . 5.020 4.654 4.359 4.975 . 0 0 "[ . 1 . 2]" 1
1118 1 64 ASN HB2 1 66 ASN H . . 5.010 3.028 2.683 3.718 . 0 0 "[ . 1 . 2]" 1
1119 1 64 ASN HB3 1 66 ASN H . . 5.500 3.674 2.859 4.704 . 0 0 "[ . 1 . 2]" 1
1120 1 65 ALA H 1 66 ASN H . . 3.130 2.851 2.606 3.066 . 0 0 "[ . 1 . 2]" 1
1121 1 65 ALA H 1 66 ASN HD21 . . 4.910 4.592 4.359 4.846 . 0 0 "[ . 1 . 2]" 1
1122 1 65 ALA H 1 67 PRO HD2 . . 5.500 4.057 3.589 4.484 . 0 0 "[ . 1 . 2]" 1
1123 1 65 ALA H 1 70 MET QG . . 5.320 2.763 2.498 2.950 . 0 0 "[ . 1 . 2]" 1
1124 1 65 ALA HA 1 66 ASN H . . 2.950 2.781 2.529 2.955 0.005 1 0 "[ . 1 . 2]" 1
1125 1 65 ALA HA 1 66 ASN HB2 . . 5.230 4.915 4.665 5.105 . 0 0 "[ . 1 . 2]" 1
1126 1 65 ALA HA 1 67 PRO HD2 . . 4.220 3.693 3.490 4.026 . 0 0 "[ . 1 . 2]" 1
1127 1 65 ALA HA 1 67 PRO HD3 . . 5.500 5.399 5.198 5.695 0.195 12 0 "[ . 1 . 2]" 1
1128 1 65 ALA HA 1 67 PRO HG2 . . 5.500 4.778 4.634 5.159 . 0 0 "[ . 1 . 2]" 1
1129 1 65 ALA HA 1 69 LEU H . . 3.850 3.001 2.408 3.860 0.010 12 0 "[ . 1 . 2]" 1
1130 1 65 ALA HA 1 69 LEU MD1 . . 5.500 3.988 3.469 4.286 . 0 0 "[ . 1 . 2]" 1
1131 1 65 ALA HA 1 69 LEU MD2 . . 5.500 2.956 2.502 4.312 . 0 0 "[ . 1 . 2]" 1
1132 1 65 ALA HA 1 69 LEU HG . . 3.460 2.750 2.207 3.411 . 0 0 "[ . 1 . 2]" 1
1133 1 65 ALA HA 1 70 MET H . . 3.950 2.410 2.140 3.165 . 0 0 "[ . 1 . 2]" 1
1134 1 66 ASN H 1 66 ASN HD21 . . 3.610 3.001 2.867 3.217 . 0 0 "[ . 1 . 2]" 1
1135 1 66 ASN H 1 67 PRO HD2 . . 3.420 1.842 1.731 1.906 . 0 0 "[ . 1 . 2]" 1
1136 1 66 ASN H 1 67 PRO HD3 . . 3.540 3.077 3.032 3.121 . 0 0 "[ . 1 . 2]" 1
1137 1 66 ASN H 1 67 PRO HG2 . . 4.510 4.006 3.865 4.074 . 0 0 "[ . 1 . 2]" 1
1138 1 66 ASN H 1 67 PRO HG3 . . 5.100 4.515 4.421 4.575 . 0 0 "[ . 1 . 2]" 1
1139 1 66 ASN H 1 69 LEU H . . 4.330 4.092 3.995 4.180 . 0 0 "[ . 1 . 2]" 1
1140 1 66 ASN H 1 69 LEU HB3 . . 5.500 5.624 5.530 5.715 0.215 20 0 "[ . 1 . 2]" 1
1141 1 66 ASN H 1 69 LEU HG . . 4.670 4.197 3.949 4.710 0.040 13 0 "[ . 1 . 2]" 1
1142 1 66 ASN H 1 70 MET H . . 5.100 4.815 4.565 5.051 . 0 0 "[ . 1 . 2]" 1
1143 1 66 ASN H 1 70 MET HG2 . . 5.500 5.447 4.604 5.700 0.200 5 0 "[ . 1 . 2]" 1
1144 1 66 ASN H 1 70 MET HG3 . . 5.500 5.579 4.686 5.839 0.339 8 0 "[ . 1 . 2]" 1
1145 1 66 ASN HB2 1 67 PRO HD2 . . 3.600 2.416 2.373 2.462 . 0 0 "[ . 1 . 2]" 1
1146 1 66 ASN HB2 1 67 PRO HD3 . . 4.040 2.131 2.110 2.172 . 0 0 "[ . 1 . 2]" 1
1147 1 67 PRO HA 1 68 GLY HA3 . . 4.770 4.530 4.488 4.578 . 0 0 "[ . 1 . 2]" 1
1148 1 67 PRO HD2 1 68 GLY H . . 4.400 2.741 2.654 2.870 . 0 0 "[ . 1 . 2]" 1
1149 1 67 PRO HD3 1 68 GLY H . . 3.970 3.889 3.839 3.962 . 0 0 "[ . 1 . 2]" 1
1150 1 67 PRO HD3 1 69 LEU H . . 5.460 5.009 4.835 5.328 . 0 0 "[ . 1 . 2]" 1
1151 1 67 PRO HG2 1 68 GLY H . . 3.280 2.618 2.193 3.098 . 0 0 "[ . 1 . 2]" 1
1152 1 67 PRO HG2 1 69 LEU H . . 3.910 2.847 2.487 3.446 . 0 0 "[ . 1 . 2]" 1
1153 1 68 GLY H 1 69 LEU H . . 3.280 2.055 1.823 2.359 . 0 0 "[ . 1 . 2]" 1
1154 1 68 GLY H 1 69 LEU HB3 . . 4.970 4.232 3.947 4.642 . 0 0 "[ . 1 . 2]" 1
1155 1 68 GLY H 1 69 LEU HG . . 5.280 4.125 3.777 4.684 . 0 0 "[ . 1 . 2]" 1
1156 1 68 GLY H 1 70 MET H . . 4.240 3.888 3.755 4.119 . 0 0 "[ . 1 . 2]" 1
1157 1 68 GLY H 1 71 LYS H . . 4.740 4.317 4.158 4.555 . 0 0 "[ . 1 . 2]" 1
1158 1 68 GLY H 1 72 ASP H . . 5.500 5.400 4.957 5.587 0.087 1 0 "[ . 1 . 2]" 1
1159 1 68 GLY HA2 1 69 LEU H . . 3.510 2.885 2.689 3.010 . 0 0 "[ . 1 . 2]" 1
1160 1 68 GLY HA2 1 70 MET H . . 4.670 3.612 3.447 3.698 . 0 0 "[ . 1 . 2]" 1
1161 1 68 GLY HA2 1 71 LYS H . . 4.510 2.951 2.797 3.151 . 0 0 "[ . 1 . 2]" 1
1162 1 68 GLY HA2 1 71 LYS QB . . 2.820 2.359 2.079 2.877 0.057 18 0 "[ . 1 . 2]" 1
1163 1 68 GLY HA2 1 72 ASP H . . 5.500 3.378 2.790 3.637 . 0 0 "[ . 1 . 2]" 1
1164 1 69 LEU H 1 69 LEU HB3 . . 2.930 2.734 2.573 2.939 0.009 9 0 "[ . 1 . 2]" 1
1165 1 69 LEU H 1 69 LEU MD1 . . 5.500 3.891 3.637 4.008 . 0 0 "[ . 1 . 2]" 1
1166 1 69 LEU H 1 69 LEU MD2 . . 4.320 2.150 1.906 3.087 . 0 0 "[ . 1 . 2]" 1
1167 1 69 LEU H 1 69 LEU HG . . 3.360 2.446 2.134 2.756 . 0 0 "[ . 1 . 2]" 1
1168 1 69 LEU H 1 70 MET HA . . 5.500 4.999 4.812 5.226 . 0 0 "[ . 1 . 2]" 1
1169 1 69 LEU H 1 70 MET QB . . 5.340 4.603 4.372 5.083 . 0 0 "[ . 1 . 2]" 1
1170 1 69 LEU H 1 70 MET HG2 . . 5.500 4.158 3.821 5.547 0.047 12 0 "[ . 1 . 2]" 1
1171 1 69 LEU H 1 70 MET HG3 . . 5.500 5.315 3.990 5.572 0.072 13 0 "[ . 1 . 2]" 1
1172 1 69 LEU HA 1 70 MET HA . . 4.640 4.546 4.521 4.600 . 0 0 "[ . 1 . 2]" 1
1173 1 69 LEU HA 1 71 LYS H . . 4.650 4.565 4.332 4.668 0.018 6 0 "[ . 1 . 2]" 1
1174 1 69 LEU HA 1 72 ASP H . . 4.460 4.363 3.902 4.579 0.119 12 0 "[ . 1 . 2]" 1
1175 1 69 LEU HB3 1 69 LEU MD2 . . 3.220 2.050 1.931 2.118 . 0 0 "[ . 1 . 2]" 1
1176 1 69 LEU MD1 1 70 MET HG2 . . 5.500 2.080 1.936 2.836 . 0 0 "[ . 1 . 2]" 1
1177 1 69 LEU MD1 1 70 MET QG . . 4.750 2.006 1.896 2.743 . 0 0 "[ . 1 . 2]" 1
1178 1 69 LEU MD1 1 70 MET HG3 . . 5.500 2.699 2.324 3.641 . 0 0 "[ . 1 . 2]" 1
1179 1 69 LEU HG 1 70 MET H . . 3.350 2.115 2.005 2.289 . 0 0 "[ . 1 . 2]" 1
1180 1 69 LEU HG 1 70 MET QG . . 3.560 1.953 1.837 2.745 . 0 0 "[ . 1 . 2]" 1
1181 1 69 LEU HG 1 71 LYS H . . 4.240 3.989 3.799 4.318 0.078 13 0 "[ . 1 . 2]" 1
1182 1 69 LEU HG 1 72 ASP H . . 5.500 5.546 5.408 5.672 0.172 3 0 "[ . 1 . 2]" 1
1183 1 70 MET H 1 70 MET HB2 . . 4.080 2.738 2.578 3.733 . 0 0 "[ . 1 . 2]" 1
1184 1 70 MET H 1 70 MET QB . . 3.510 2.645 2.534 2.925 . 0 0 "[ . 1 . 2]" 1
1185 1 70 MET H 1 70 MET HB3 . . 4.080 3.724 3.056 3.816 . 0 0 "[ . 1 . 2]" 1
1186 1 70 MET H 1 70 MET HG2 . . 3.940 2.652 2.364 3.486 . 0 0 "[ . 1 . 2]" 1
1187 1 70 MET H 1 70 MET QG . . 3.310 2.528 1.918 2.756 . 0 0 "[ . 1 . 2]" 1
1188 1 70 MET H 1 70 MET HG3 . . 3.940 3.676 1.927 4.007 0.067 10 0 "[ . 1 . 2]" 1
1189 1 70 MET H 1 71 LYS H . . 3.290 1.922 1.854 2.121 . 0 0 "[ . 1 . 2]" 1
1190 1 70 MET H 1 71 LYS HA . . 5.080 4.627 4.516 4.816 . 0 0 "[ . 1 . 2]" 1
1191 1 70 MET H 1 71 LYS HB2 . . 5.500 4.243 3.743 5.439 . 0 0 "[ . 1 . 2]" 1
1192 1 70 MET H 1 71 LYS QB . . 4.810 3.718 3.589 3.895 . 0 0 "[ . 1 . 2]" 1
1193 1 70 MET H 1 71 LYS HB3 . . 5.500 4.262 3.890 5.502 0.002 13 0 "[ . 1 . 2]" 1
1194 1 70 MET H 1 73 VAL H . . 5.500 5.305 5.034 5.486 . 0 0 "[ . 1 . 2]" 1
1195 1 70 MET H 1 73 VAL MG1 . . 5.500 4.826 4.750 4.862 . 0 0 "[ . 1 . 2]" 1
1196 1 70 MET HA 1 72 ASP H . . 5.500 4.032 3.764 4.323 . 0 0 "[ . 1 . 2]" 1
1197 1 70 MET HA 1 73 VAL H . . 4.200 3.940 3.726 4.133 . 0 0 "[ . 1 . 2]" 1
1198 1 70 MET HA 1 73 VAL HB . . 4.300 2.781 2.482 3.108 . 0 0 "[ . 1 . 2]" 1
1199 1 70 MET HA 1 73 VAL MG1 . . 5.490 2.450 2.350 2.644 . 0 0 "[ . 1 . 2]" 1
1200 1 70 MET HA 1 74 ALA H . . 5.500 4.450 4.024 4.837 . 0 0 "[ . 1 . 2]" 1
1201 1 70 MET QB 1 71 LYS H . . 3.830 3.046 2.971 3.645 . 0 0 "[ . 1 . 2]" 1
1202 1 70 MET QB 1 72 ASP H . . 5.340 4.768 4.598 4.927 . 0 0 "[ . 1 . 2]" 1
1203 1 70 MET HB2 1 71 LYS H . . 4.430 3.146 3.052 4.022 . 0 0 "[ . 1 . 2]" 1
1204 1 70 MET HB3 1 71 LYS H . . 4.430 4.123 4.030 4.338 . 0 0 "[ . 1 . 2]" 1
1205 1 70 MET QG 1 71 LYS H . . 4.150 3.942 2.591 4.186 0.036 3 0 "[ . 1 . 2]" 1
1206 1 71 LYS H 1 71 LYS HB2 . . 3.530 2.630 2.177 3.551 0.021 18 0 "[ . 1 . 2]" 1
1207 1 71 LYS H 1 71 LYS QB . . 3.070 2.238 2.146 2.303 . 0 0 "[ . 1 . 2]" 1
1208 1 71 LYS H 1 71 LYS HB3 . . 3.530 2.581 2.282 3.454 . 0 0 "[ . 1 . 2]" 1
1209 1 71 LYS H 1 71 LYS HD2 . . 5.500 4.852 4.271 5.311 . 0 0 "[ . 1 . 2]" 1
1210 1 71 LYS H 1 71 LYS HD3 . . 5.500 4.890 3.694 5.265 . 0 0 "[ . 1 . 2]" 1
1211 1 71 LYS H 1 71 LYS HG2 . . 5.270 4.427 3.587 4.649 . 0 0 "[ . 1 . 2]" 1
1212 1 71 LYS H 1 71 LYS QG . . 4.500 3.856 2.714 4.049 . 0 0 "[ . 1 . 2]" 1
1213 1 71 LYS H 1 71 LYS HG3 . . 5.270 4.291 2.809 4.659 . 0 0 "[ . 1 . 2]" 1
1214 1 71 LYS H 1 72 ASP H . . 3.330 2.393 2.132 2.523 . 0 0 "[ . 1 . 2]" 1
1215 1 71 LYS H 1 72 ASP HA . . 5.190 5.084 4.860 5.190 0.000 12 0 "[ . 1 . 2]" 1
1216 1 71 LYS H 1 73 VAL HB . . 5.250 4.757 4.341 4.944 . 0 0 "[ . 1 . 2]" 1
1217 1 71 LYS H 1 73 VAL MG1 . . 5.500 4.774 4.636 4.957 . 0 0 "[ . 1 . 2]" 1
1218 1 71 LYS QB 1 72 ASP H . . 3.330 2.939 2.761 3.498 0.168 18 0 "[ . 1 . 2]" 1
1219 1 72 ASP H 1 72 ASP HB2 . . 3.920 2.744 2.336 3.729 . 0 0 "[ . 1 . 2]" 1
1220 1 72 ASP H 1 72 ASP QB . . 3.390 2.529 2.307 3.251 . 0 0 "[ . 1 . 2]" 1
1221 1 72 ASP H 1 72 ASP HB3 . . 3.920 3.190 2.708 3.859 . 0 0 "[ . 1 . 2]" 1
1222 1 72 ASP H 1 73 VAL H . . 2.810 2.774 2.644 2.843 0.033 6 0 "[ . 1 . 2]" 1
1223 1 72 ASP H 1 73 VAL HA . . 5.500 4.850 4.562 5.017 . 0 0 "[ . 1 . 2]" 1
1224 1 72 ASP H 1 73 VAL MG1 . . 5.180 4.419 4.179 4.570 . 0 0 "[ . 1 . 2]" 1
1225 1 72 ASP HB2 1 73 VAL H . . 5.390 4.396 4.064 4.575 . 0 0 "[ . 1 . 2]" 1
1226 1 72 ASP HB3 1 73 VAL H . . 5.390 4.284 3.999 4.649 . 0 0 "[ . 1 . 2]" 1
1227 1 73 VAL H 1 73 VAL HB . . 3.120 2.775 2.681 2.876 . 0 0 "[ . 1 . 2]" 1
1228 1 73 VAL H 1 73 VAL MG1 . . 3.070 2.714 2.499 2.868 . 0 0 "[ . 1 . 2]" 1
1229 1 73 VAL H 1 74 ALA HA . . 4.660 4.536 4.464 4.592 . 0 0 "[ . 1 . 2]" 1
1230 1 73 VAL H 1 74 ALA MB . . 4.250 3.548 3.430 3.609 . 0 0 "[ . 1 . 2]" 1
1231 1 73 VAL H 1 75 LYS H . . 5.500 3.261 3.032 3.582 . 0 0 "[ . 1 . 2]" 1
1232 1 73 VAL H 1 76 VAL HB . . 5.460 5.483 5.175 5.608 0.148 3 0 "[ . 1 . 2]" 1
1233 1 73 VAL HA 1 73 VAL MG2 . . 3.230 1.993 1.936 2.085 . 0 0 "[ . 1 . 2]" 1
1234 1 73 VAL HA 1 74 ALA MB . . 5.500 4.986 4.963 4.998 . 0 0 "[ . 1 . 2]" 1
1235 1 73 VAL HA 1 75 LYS H . . 3.970 3.678 3.583 3.939 . 0 0 "[ . 1 . 2]" 1
1236 1 73 VAL HA 1 75 LYS QG . . 5.340 4.596 3.863 5.360 0.020 14 0 "[ . 1 . 2]" 1
1237 1 73 VAL HA 1 76 VAL H . . 3.210 3.187 2.853 3.365 0.155 5 0 "[ . 1 . 2]" 1
1238 1 73 VAL HA 1 76 VAL HB . . 4.810 2.957 2.363 3.229 . 0 0 "[ . 1 . 2]" 1
1239 1 73 VAL HA 1 76 VAL MG2 . . 4.230 2.056 1.867 2.497 . 0 0 "[ . 1 . 2]" 1
1240 1 73 VAL HB 1 74 ALA H . . 4.140 3.625 3.538 3.734 . 0 0 "[ . 1 . 2]" 1
1241 1 73 VAL HB 1 74 ALA MB . . 5.500 4.980 4.889 5.101 . 0 0 "[ . 1 . 2]" 1
1242 1 73 VAL HB 1 75 LYS H . . 5.500 5.298 5.197 5.497 . 0 0 "[ . 1 . 2]" 1
1243 1 73 VAL MG1 1 74 ALA H . . 5.300 2.209 2.093 2.274 . 0 0 "[ . 1 . 2]" 1
1244 1 73 VAL MG1 1 75 LYS H . . 5.500 4.103 4.030 4.217 . 0 0 "[ . 1 . 2]" 1
1245 1 73 VAL MG2 1 74 ALA H . . 5.120 4.189 4.080 4.230 . 0 0 "[ . 1 . 2]" 1
1246 1 73 VAL MG2 1 74 ALA HA . . 5.430 4.654 4.356 4.787 . 0 0 "[ . 1 . 2]" 1
1247 1 73 VAL MG2 1 75 LYS H . . 5.500 4.909 4.792 5.098 . 0 0 "[ . 1 . 2]" 1
1248 1 73 VAL MG2 1 76 VAL HB . . 4.120 3.307 2.424 3.803 . 0 0 "[ . 1 . 2]" 1
1249 1 73 VAL MG2 1 77 PHE H . . 5.500 5.052 4.720 5.381 . 0 0 "[ . 1 . 2]" 1
1250 1 74 ALA H 1 74 ALA MB . . 3.090 2.175 2.158 2.185 . 0 0 "[ . 1 . 2]" 1
1251 1 74 ALA H 1 75 LYS H . . 3.430 2.544 2.417 2.728 . 0 0 "[ . 1 . 2]" 1
1252 1 74 ALA H 1 75 LYS HD2 . . 5.500 4.744 3.044 5.562 0.062 6 0 "[ . 1 . 2]" 1
1253 1 74 ALA H 1 75 LYS HD3 . . 5.500 4.459 2.843 5.558 0.058 3 0 "[ . 1 . 2]" 1
1254 1 74 ALA H 1 76 VAL H . . 4.110 3.938 3.866 4.049 . 0 0 "[ . 1 . 2]" 1
1255 1 74 ALA HA 1 76 VAL HB . . 5.500 5.359 5.066 5.770 0.270 9 0 "[ . 1 . 2]" 1
1256 1 75 LYS H 1 75 LYS QB . . 3.680 2.891 2.626 3.128 . 0 0 "[ . 1 . 2]" 1
1257 1 75 LYS H 1 75 LYS HD2 . . 4.540 3.354 1.958 4.090 . 0 0 "[ . 1 . 2]" 1
1258 1 75 LYS H 1 75 LYS QD . . 3.730 2.910 1.944 3.510 . 0 0 "[ . 1 . 2]" 1
1259 1 75 LYS H 1 75 LYS HD3 . . 4.540 3.327 2.853 3.825 . 0 0 "[ . 1 . 2]" 1
1260 1 75 LYS H 1 75 LYS QG . . 3.760 2.076 1.723 2.560 . 0 0 "[ . 1 . 2]" 1
1261 1 75 LYS H 1 76 VAL MG2 . . 4.450 3.229 2.991 3.527 . 0 0 "[ . 1 . 2]" 1
1262 1 75 LYS HA 1 75 LYS QD . . 3.830 3.135 2.072 3.923 0.093 9 0 "[ . 1 . 2]" 1
1263 1 75 LYS HA 1 75 LYS HE2 . . 5.500 4.805 4.382 5.601 0.101 2 0 "[ . 1 . 2]" 1
1264 1 75 LYS HA 1 75 LYS HE3 . . 5.500 4.907 3.883 5.789 0.289 12 0 "[ . 1 . 2]" 1
1265 1 75 LYS HA 1 75 LYS HG2 . . 4.220 3.682 3.277 4.207 . 0 0 "[ . 1 . 2]" 1
1266 1 75 LYS HA 1 75 LYS QG . . 3.640 3.312 3.110 3.433 . 0 0 "[ . 1 . 2]" 1
1267 1 75 LYS HA 1 75 LYS HG3 . . 4.220 3.908 3.583 4.236 0.016 1 0 "[ . 1 . 2]" 1
1268 1 75 LYS QB 1 75 LYS QD . . 2.520 2.396 2.213 2.620 0.100 12 0 "[ . 1 . 2]" 1
1269 1 75 LYS QB 1 75 LYS QE . . 3.040 2.471 2.003 3.099 0.059 2 0 "[ . 1 . 2]" 1
1270 1 75 LYS QB 1 76 VAL H . . 4.110 3.463 2.936 3.758 . 0 0 "[ . 1 . 2]" 1
1271 1 75 LYS HB2 1 76 VAL H . . 4.830 3.696 3.005 4.185 . 0 0 "[ . 1 . 2]" 1
1272 1 75 LYS HB3 1 76 VAL H . . 4.830 4.291 4.129 4.410 . 0 0 "[ . 1 . 2]" 1
1273 1 75 LYS QD 1 76 VAL H . . 4.840 3.797 2.686 4.713 . 0 0 "[ . 1 . 2]" 1
1274 1 75 LYS HD2 1 76 VAL H . . 5.500 4.441 3.723 5.178 . 0 0 "[ . 1 . 2]" 1
1275 1 75 LYS HD3 1 76 VAL H . . 5.500 4.293 2.735 5.519 0.019 17 0 "[ . 1 . 2]" 1
1276 1 75 LYS HG2 1 76 VAL H . . 5.500 3.673 2.430 4.596 . 0 0 "[ . 1 . 2]" 1
1277 1 75 LYS HG3 1 76 VAL H . . 5.500 4.152 2.925 5.170 . 0 0 "[ . 1 . 2]" 1
1278 1 76 VAL H 1 76 VAL HA . . 2.910 2.821 2.752 2.911 0.001 9 0 "[ . 1 . 2]" 1
1279 1 76 VAL H 1 76 VAL HB . . 2.950 2.563 2.400 2.853 . 0 0 "[ . 1 . 2]" 1
1280 1 76 VAL H 1 76 VAL MG2 . . 3.010 2.106 1.831 2.375 . 0 0 "[ . 1 . 2]" 1
1281 1 76 VAL HA 1 77 PHE H . . 3.530 3.212 2.369 3.571 0.041 3 0 "[ . 1 . 2]" 1
1282 1 76 VAL HB 1 77 PHE H . . 4.080 2.478 1.968 3.485 . 0 0 "[ . 1 . 2]" 1
1283 1 76 VAL MG1 1 77 PHE H . . 5.250 2.434 1.826 3.378 . 0 0 "[ . 1 . 2]" 1
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