Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
520357 | 2lg7 RC | 17799 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lg7
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 1693
_Distance_constraint_stats_list.Viol_count 2793
_Distance_constraint_stats_list.Viol_total 5030.281
_Distance_constraint_stats_list.Viol_max 0.958
_Distance_constraint_stats_list.Viol_rms 0.0401
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0074
_Distance_constraint_stats_list.Viol_average_violations_only 0.0901
_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 3 ASP 0.136 0.067 10 0 "[ . 1 . 2]"
1 4 ASP 0.338 0.118 19 0 "[ . 1 . 2]"
1 5 GLU 0.122 0.064 10 0 "[ . 1 . 2]"
1 6 PRO 0.220 0.093 4 0 "[ . 1 . 2]"
1 7 GLY 0.240 0.071 5 0 "[ . 1 . 2]"
1 8 GLY 2.741 0.560 6 3 "[ -.+ 1 .* 2]"
1 9 LYS 8.232 0.562 7 5 "[ -.*+ 1 * .* 2]"
1 10 GLY 7.788 0.524 4 1 "[ +. 1 . 2]"
1 11 ALA 7.906 0.604 20 3 "[ . 1 - * +]"
1 12 MET 7.548 0.283 14 0 "[ . 1 . 2]"
1 13 TYR 4.551 0.126 8 0 "[ . 1 . 2]"
1 14 GLU 1.077 0.093 20 0 "[ . 1 . 2]"
1 15 VAL 5.924 0.134 8 0 "[ . 1 . 2]"
1 16 THR 5.582 0.132 6 0 "[ . 1 . 2]"
1 17 ILE 10.139 0.173 6 0 "[ . 1 . 2]"
1 18 GLU 3.666 0.111 6 0 "[ . 1 . 2]"
1 19 GLN 5.777 0.482 6 0 "[ . 1 . 2]"
1 20 SER 0.595 0.080 14 0 "[ . 1 . 2]"
1 21 GLY 1.210 0.100 9 0 "[ . 1 . 2]"
1 22 ASP 3.331 0.413 11 0 "[ . 1 . 2]"
1 23 PHE 5.691 0.413 11 0 "[ . 1 . 2]"
1 24 ARG 3.370 0.330 5 0 "[ . 1 . 2]"
1 25 SER 2.493 0.392 1 0 "[ . 1 . 2]"
1 26 PHE 6.388 0.429 3 0 "[ . 1 . 2]"
1 27 ILE 8.876 0.519 9 2 "[ .- +1 . 2]"
1 28 LYS 1.849 0.116 8 0 "[ . 1 . 2]"
1 29 SER 1.670 0.082 5 0 "[ . 1 . 2]"
1 30 VAL 1.431 0.081 4 0 "[ . 1 . 2]"
1 31 VAL 2.009 0.107 14 0 "[ . 1 . 2]"
1 32 VAL 2.293 0.107 14 0 "[ . 1 . 2]"
1 33 VAL 1.022 0.084 10 0 "[ . 1 . 2]"
1 34 ALA 3.516 0.115 10 0 "[ . 1 . 2]"
1 35 ASN 2.868 0.088 13 0 "[ . 1 . 2]"
1 36 GLY 5.866 0.112 2 0 "[ . 1 . 2]"
1 37 THR 1.931 0.101 6 0 "[ . 1 . 2]"
1 38 GLN 3.938 0.106 11 0 "[ . 1 . 2]"
1 39 LEU 3.759 0.115 20 0 "[ . 1 . 2]"
1 40 LYS 4.169 0.114 4 0 "[ . 1 . 2]"
1 41 ASP 2.569 0.094 1 0 "[ . 1 . 2]"
1 42 GLY 2.713 0.343 18 0 "[ . 1 . 2]"
1 43 ALA 1.611 0.108 12 0 "[ . 1 . 2]"
1 44 THR 5.071 0.797 17 1 "[ . 1 . + 2]"
1 45 GLY 1.335 0.086 11 0 "[ . 1 . 2]"
1 46 GLU 5.701 0.797 17 1 "[ . 1 . + 2]"
1 47 SER 1.974 0.101 16 0 "[ . 1 . 2]"
1 48 LEU 2.562 0.105 7 0 "[ . 1 . 2]"
1 49 ALA 4.590 0.115 20 0 "[ . 1 . 2]"
1 50 SER 1.177 0.088 15 0 "[ . 1 . 2]"
1 51 PRO 2.242 0.249 9 0 "[ . 1 . 2]"
1 52 VAL 1.524 0.107 3 0 "[ . 1 . 2]"
1 53 ILE 1.980 0.249 9 0 "[ . 1 . 2]"
1 54 LEU 5.360 0.601 20 1 "[ . 1 . +]"
1 55 SER 1.930 0.132 10 0 "[ . 1 . 2]"
1 56 ASP 9.983 0.356 1 0 "[ . 1 . 2]"
1 57 GLU 4.980 0.356 1 0 "[ . 1 . 2]"
1 58 GLU 5.406 0.601 20 2 "[ . -1 . +]"
1 59 LEU 2.310 0.083 16 0 "[ . 1 . 2]"
1 60 ALA 1.753 0.089 9 0 "[ . 1 . 2]"
1 61 VAL 4.626 0.909 8 1 "[ . + 1 . 2]"
1 62 GLU 7.041 0.909 8 1 "[ . + 1 . 2]"
1 63 LYS 16.603 0.924 14 9 "[* ***-* 1* +* 2]"
1 64 VAL 6.744 0.924 14 3 "[ *. 1* +. 2]"
1 65 THR 5.349 0.343 18 0 "[ . 1 . 2]"
1 66 LEU 4.912 0.110 18 0 "[ . 1 . 2]"
1 67 SER 1.940 0.090 6 0 "[ . 1 . 2]"
1 68 THR 3.976 0.116 9 0 "[ . 1 . 2]"
1 69 THR 5.561 0.114 4 0 "[ . 1 . 2]"
1 70 GLY 1.013 0.081 18 0 "[ . 1 . 2]"
1 71 LYS 6.646 0.143 11 0 "[ . 1 . 2]"
1 72 ALA 6.713 0.162 2 0 "[ . 1 . 2]"
1 73 ILE 7.495 0.484 8 0 "[ . 1 . 2]"
1 74 GLU 1.053 0.088 15 0 "[ . 1 . 2]"
1 75 PHE 1.409 0.117 3 0 "[ . 1 . 2]"
1 76 ALA 2.627 0.127 6 0 "[ . 1 . 2]"
1 77 VAL 0.528 0.117 6 0 "[ . 1 . 2]"
1 78 SER 3.773 0.958 1 2 "[+ . 1 - 2]"
1 79 GLY 0.903 0.412 1 0 "[ . 1 . 2]"
1 80 GLY 0.453 0.130 15 0 "[ . 1 . 2]"
1 81 VAL 2.546 0.174 10 0 "[ . 1 . 2]"
1 82 VAL 4.424 0.109 8 0 "[ . 1 . 2]"
1 83 ASP 1.220 0.105 19 0 "[ . 1 . 2]"
1 84 GLY 4.823 0.519 9 2 "[ .- +1 . 2]"
1 85 GLU 3.117 0.718 13 2 "[ . 1 + - 2]"
1 91 GLU 1.139 0.202 3 0 "[ . 1 . 2]"
1 92 PRO 1.212 0.285 17 0 "[ . 1 . 2]"
1 93 MET 2.912 0.348 17 0 "[ . 1 . 2]"
1 94 GLN 6.232 0.447 10 0 "[ . 1 . 2]"
1 95 TRP 3.755 0.268 16 0 "[ . 1 . 2]"
1 96 VAL 1.583 0.119 6 0 "[ . 1 . 2]"
1 97 VAL 5.392 0.868 14 3 "[ * - 1 +. 2]"
1 98 THR 5.959 0.844 15 2 "[ . 1 - + 2]"
1 99 VAL 0.419 0.098 9 0 "[ . 1 . 2]"
1 100 TYR 4.301 0.120 8 0 "[ . 1 . 2]"
1 101 LYS 3.175 0.604 20 3 "[ . 1 - * +]"
1 102 ASN 3.593 0.283 14 0 "[ . 1 . 2]"
1 103 GLY 2.687 0.102 3 0 "[ . 1 . 2]"
1 104 LYS 5.980 0.849 14 1 "[ . 1 +. 2]"
1 105 GLU 3.465 0.849 14 1 "[ . 1 +. 2]"
1 106 ILE 6.569 0.183 8 0 "[ . 1 . 2]"
1 107 GLU 2.634 0.785 3 1 "[ + . 1 . 2]"
1 108 LYS 9.258 0.844 15 5 "[ -. * * * + 2]"
1 109 LYS 12.779 0.907 7 6 "[ *-* + * *. 2]"
1 110 SER 3.259 0.907 7 2 "[ . + 1 -. 2]"
1 111 LEU 0.724 0.089 12 0 "[ . 1 . 2]"
1 112 VAL 0.595 0.120 3 0 "[ . 1 . 2]"
1 113 PHE 4.081 0.454 16 0 "[ . 1 . 2]"
1 114 ARG 4.140 0.500 20 0 "[ . 1 . 2]"
1 115 ASP 2.462 0.500 20 0 "[ . 1 . 2]"
1 117 LYS 6.457 0.557 12 1 "[ . 1 + . 2]"
1 119 ILE 7.046 0.725 6 4 "[ **-+ 1 . 2]"
1 120 SER 6.470 0.725 6 4 "[ **-+ 1 . 2]"
1 121 THR 3.711 0.132 12 0 "[ . 1 . 2]"
1 122 ASP 1.989 0.133 18 0 "[ . 1 . 2]"
1 123 ASP 0.084 0.044 7 0 "[ . 1 . 2]"
1 124 LEU 6.127 0.958 1 3 "[+ . - 1 * 2]"
1 125 ASN 1.414 0.283 13 0 "[ . 1 . 2]"
1 126 LEU 2.908 0.917 15 2 "[- . 1 + 2]"
1 127 TYR 4.081 0.127 6 0 "[ . 1 . 2]"
1 128 TYR 4.412 0.137 16 0 "[ . 1 . 2]"
1 129 ASN 1.681 0.097 16 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 3 ASP H 1 4 ASP H . . 4.420 4.206 3.406 4.487 0.067 10 0 "[ . 1 . 2]" 1
2 1 3 ASP QB 1 4 ASP H . . 5.500 3.022 2.160 4.034 . 0 0 "[ . 1 . 2]" 1
3 1 4 ASP H 1 4 ASP HB2 . . 3.870 3.165 2.276 3.988 0.118 19 0 "[ . 1 . 2]" 1
4 1 4 ASP H 1 4 ASP HB3 . . 4.180 3.176 2.498 3.819 . 0 0 "[ . 1 . 2]" 1
5 1 4 ASP HA 1 5 GLU H . . 3.130 2.358 2.090 2.695 . 0 0 "[ . 1 . 2]" 1
6 1 4 ASP HB2 1 5 GLU H . . 4.740 3.978 2.486 4.707 . 0 0 "[ . 1 . 2]" 1
7 1 4 ASP HB2 1 6 PRO QD . . 5.500 3.887 2.207 5.168 . 0 0 "[ . 1 . 2]" 1
8 1 4 ASP HB3 1 5 GLU H . . 5.500 3.783 2.617 4.547 . 0 0 "[ . 1 . 2]" 1
9 1 4 ASP HB3 1 6 PRO QD . . 5.300 3.226 2.102 4.996 . 0 0 "[ . 1 . 2]" 1
10 1 5 GLU H 1 5 GLU QG . . 4.450 3.350 2.037 4.295 . 0 0 "[ . 1 . 2]" 1
11 1 5 GLU H 1 6 PRO QD . . 5.010 3.179 2.286 4.343 . 0 0 "[ . 1 . 2]" 1
12 1 5 GLU HA 1 6 PRO QD . . 3.170 2.185 2.023 2.461 . 0 0 "[ . 1 . 2]" 1
13 1 5 GLU HA 1 7 GLY H . . 5.500 4.769 2.945 5.564 0.064 10 0 "[ . 1 . 2]" 1
14 1 5 GLU QB 1 6 PRO QD . . 4.900 3.767 2.504 3.939 . 0 0 "[ . 1 . 2]" 1
15 1 5 GLU QB 1 7 GLY H . . 5.150 4.290 3.184 5.030 . 0 0 "[ . 1 . 2]" 1
16 1 5 GLU QG 1 6 PRO QD . . 5.420 3.992 2.422 4.557 . 0 0 "[ . 1 . 2]" 1
17 1 6 PRO HA 1 7 GLY H . . 3.320 2.429 2.117 3.349 0.029 2 0 "[ . 1 . 2]" 1
18 1 6 PRO HA 1 8 GLY H . . 5.470 4.588 3.155 5.563 0.093 4 0 "[ . 1 . 2]" 1
19 1 6 PRO QG 1 7 GLY H . . 5.450 4.536 3.281 4.906 . 0 0 "[ . 1 . 2]" 1
20 1 7 GLY H 1 8 GLY H . . 3.950 3.078 2.054 4.021 0.071 5 0 "[ . 1 . 2]" 1
21 1 8 GLY HA2 1 9 LYS H . . 2.890 2.531 2.190 3.450 0.560 6 2 "[ .+ 1 .- 2]" 1
22 1 8 GLY HA2 1 9 LYS HG2 . . 4.930 4.521 3.173 5.480 0.550 4 1 "[ +. 1 . 2]" 1
23 1 9 LYS H 1 9 LYS HB2 . . 3.420 2.789 2.187 3.970 0.550 12 1 "[ . 1 + . 2]" 1
24 1 9 LYS H 1 9 LYS HB3 . . 3.920 3.626 2.756 3.975 0.055 17 0 "[ . 1 . 2]" 1
25 1 9 LYS H 1 9 LYS QD . . 5.500 4.263 2.279 4.952 . 0 0 "[ . 1 . 2]" 1
26 1 9 LYS H 1 9 LYS HG2 . . 4.050 3.315 2.468 4.021 . 0 0 "[ . 1 . 2]" 1
27 1 9 LYS H 1 9 LYS HG3 . . 4.530 4.024 2.405 4.610 0.080 3 0 "[ . 1 . 2]" 1
28 1 9 LYS HA 1 9 LYS QD . . 3.440 2.479 2.055 3.450 0.010 4 0 "[ . 1 . 2]" 1
29 1 9 LYS HA 1 9 LYS HG2 . . 3.650 2.946 2.214 4.212 0.562 7 2 "[ -. + 1 . 2]" 1
30 1 9 LYS HA 1 9 LYS HG3 . . 4.140 3.745 3.321 4.194 0.054 12 0 "[ . 1 . 2]" 1
31 1 9 LYS HA 1 10 GLY H . . 2.850 2.206 1.905 2.705 . 0 0 "[ . 1 . 2]" 1
32 1 9 LYS HA 1 73 ILE MG . . 5.500 5.071 4.195 5.582 0.082 19 0 "[ . 1 . 2]" 1
33 1 9 LYS HB2 1 10 GLY H . . 4.230 3.877 1.811 4.318 0.088 1 0 "[ . 1 . 2]" 1
34 1 9 LYS HB3 1 10 GLY H . . 3.820 3.182 2.343 4.297 0.477 4 0 "[ . 1 . 2]" 1
35 1 9 LYS QD 1 10 GLY H . . 4.460 3.337 2.498 4.174 . 0 0 "[ . 1 . 2]" 1
36 1 9 LYS HG2 1 10 GLY H . . 4.710 4.597 2.808 5.234 0.524 4 1 "[ +. 1 . 2]" 1
37 1 10 GLY H 1 11 ALA MB . . 5.500 5.239 4.567 5.603 0.103 17 0 "[ . 1 . 2]" 1
38 1 10 GLY H 1 73 ILE HA . . 4.410 4.007 3.218 4.484 0.074 7 0 "[ . 1 . 2]" 1
39 1 10 GLY H 1 73 ILE MG . . 4.550 4.326 3.819 4.631 0.081 6 0 "[ . 1 . 2]" 1
40 1 10 GLY HA2 1 11 ALA H . . 3.240 2.432 2.160 2.611 . 0 0 "[ . 1 . 2]" 1
41 1 10 GLY HA2 1 11 ALA MB . . 5.500 3.910 3.764 4.132 . 0 0 "[ . 1 . 2]" 1
42 1 10 GLY HA2 1 71 LYS HB3 . . 4.610 4.066 3.410 4.668 0.058 12 0 "[ . 1 . 2]" 1
43 1 10 GLY HA2 1 72 ALA H . . 4.860 4.803 4.360 4.934 0.074 17 0 "[ . 1 . 2]" 1
44 1 10 GLY HA2 1 73 ILE MG . . 4.650 4.239 3.657 4.735 0.085 18 0 "[ . 1 . 2]" 1
45 1 10 GLY HA3 1 11 ALA H . . 3.230 2.732 2.465 3.250 0.020 2 0 "[ . 1 . 2]" 1
46 1 10 GLY HA3 1 71 LYS HB2 . . 5.400 3.912 3.212 4.643 . 0 0 "[ . 1 . 2]" 1
47 1 10 GLY HA3 1 71 LYS HB3 . . 4.630 2.646 2.099 3.448 . 0 0 "[ . 1 . 2]" 1
48 1 10 GLY HA3 1 71 LYS QG . . 4.950 4.018 2.509 5.008 0.058 20 0 "[ . 1 . 2]" 1
49 1 10 GLY HA3 1 72 ALA H . . 4.740 4.205 3.463 4.902 0.162 2 0 "[ . 1 . 2]" 1
50 1 10 GLY HA3 1 73 ILE H . . 5.320 4.685 3.834 5.696 0.376 2 0 "[ . 1 . 2]" 1
51 1 10 GLY HA3 1 73 ILE HA . . 3.640 3.011 2.398 3.734 0.094 2 0 "[ . 1 . 2]" 1
52 1 10 GLY HA3 1 73 ILE MG . . 4.270 4.348 4.046 4.754 0.484 8 0 "[ . 1 . 2]" 1
53 1 11 ALA H 1 11 ALA MB . . 3.600 2.627 2.410 2.837 . 0 0 "[ . 1 . 2]" 1
54 1 11 ALA H 1 12 MET H . . 5.500 4.417 4.312 4.555 . 0 0 "[ . 1 . 2]" 1
55 1 11 ALA H 1 71 LYS HA . . 4.260 3.971 3.522 4.323 0.063 18 0 "[ . 1 . 2]" 1
56 1 11 ALA H 1 71 LYS HB3 . . 4.300 3.489 2.748 4.351 0.051 15 0 "[ . 1 . 2]" 1
57 1 11 ALA H 1 71 LYS QD . . 4.810 3.845 3.220 4.837 0.027 13 0 "[ . 1 . 2]" 1
58 1 11 ALA H 1 72 ALA H . . 3.430 3.019 2.612 3.500 0.070 1 0 "[ . 1 . 2]" 1
59 1 11 ALA H 1 72 ALA MB . . 4.580 3.457 3.153 3.797 . 0 0 "[ . 1 . 2]" 1
60 1 11 ALA H 1 73 ILE HA . . 4.500 4.249 3.739 4.578 0.078 1 0 "[ . 1 . 2]" 1
61 1 11 ALA HA 1 12 MET H . . 3.020 2.465 2.304 2.677 . 0 0 "[ . 1 . 2]" 1
62 1 11 ALA HA 1 71 LYS HA . . 4.250 4.053 3.687 4.330 0.080 12 0 "[ . 1 . 2]" 1
63 1 11 ALA HA 1 71 LYS QD . . 4.670 2.326 1.970 3.398 . 0 0 "[ . 1 . 2]" 1
64 1 11 ALA HA 1 71 LYS QG . . 3.960 3.738 2.256 4.060 0.100 3 0 "[ . 1 . 2]" 1
65 1 11 ALA HA 1 102 ASN HB3 . . 4.970 4.788 4.026 5.047 0.077 11 0 "[ . 1 . 2]" 1
66 1 11 ALA HA 1 102 ASN QD . . 4.590 4.182 3.555 4.502 . 0 0 "[ . 1 . 2]" 1
67 1 11 ALA MB 1 12 MET H . . 3.120 2.382 2.117 2.687 . 0 0 "[ . 1 . 2]" 1
68 1 11 ALA MB 1 12 MET HB2 . . 5.060 4.296 3.939 4.653 . 0 0 "[ . 1 . 2]" 1
69 1 11 ALA MB 1 12 MET HG2 . . 5.500 5.498 4.901 5.609 0.109 16 0 "[ . 1 . 2]" 1
70 1 11 ALA MB 1 12 MET HG3 . . 5.500 4.832 4.360 5.605 0.105 8 0 "[ . 1 . 2]" 1
71 1 11 ALA MB 1 71 LYS HA . . 5.300 4.863 4.561 5.210 . 0 0 "[ . 1 . 2]" 1
72 1 11 ALA MB 1 71 LYS QD . . 5.500 3.766 3.467 4.576 . 0 0 "[ . 1 . 2]" 1
73 1 11 ALA MB 1 72 ALA H . . 5.010 4.432 4.118 5.002 . 0 0 "[ . 1 . 2]" 1
74 1 11 ALA MB 1 101 LYS HE2 . . 3.980 3.433 2.011 4.077 0.097 3 0 "[ . 1 . 2]" 1
75 1 11 ALA MB 1 101 LYS HE3 . . 3.450 3.303 2.455 4.054 0.604 20 3 "[ . 1 - * +]" 1
76 1 11 ALA MB 1 101 LYS QG . . 3.750 3.263 2.722 3.707 . 0 0 "[ . 1 . 2]" 1
77 1 11 ALA MB 1 102 ASN H . . 4.630 3.861 3.542 4.217 . 0 0 "[ . 1 . 2]" 1
78 1 11 ALA MB 1 102 ASN HA . . 5.500 5.342 4.727 5.598 0.098 8 0 "[ . 1 . 2]" 1
79 1 11 ALA MB 1 102 ASN QD . . 3.690 2.424 1.985 3.168 . 0 0 "[ . 1 . 2]" 1
80 1 12 MET H 1 12 MET HB2 . . 3.550 2.424 2.306 2.581 . 0 0 "[ . 1 . 2]" 1
81 1 12 MET H 1 12 MET HB3 . . 4.060 3.624 3.402 3.727 . 0 0 "[ . 1 . 2]" 1
82 1 12 MET H 1 12 MET HG2 . . 3.940 3.814 3.195 3.995 0.055 14 0 "[ . 1 . 2]" 1
83 1 12 MET H 1 12 MET HG3 . . 3.920 2.900 2.367 3.881 . 0 0 "[ . 1 . 2]" 1
84 1 12 MET H 1 71 LYS HA . . 5.170 4.308 4.020 4.698 . 0 0 "[ . 1 . 2]" 1
85 1 12 MET H 1 71 LYS QD . . 5.500 3.037 2.831 3.502 . 0 0 "[ . 1 . 2]" 1
86 1 12 MET H 1 71 LYS QE . . 5.190 3.774 2.646 4.907 . 0 0 "[ . 1 . 2]" 1
87 1 12 MET H 1 71 LYS QG . . 5.040 4.898 3.764 5.129 0.089 16 0 "[ . 1 . 2]" 1
88 1 12 MET H 1 102 ASN H . . 4.750 4.237 3.710 4.689 . 0 0 "[ . 1 . 2]" 1
89 1 12 MET H 1 102 ASN HA . . 4.800 4.636 3.817 4.884 0.084 16 0 "[ . 1 . 2]" 1
90 1 12 MET H 1 102 ASN HB3 . . 3.590 2.731 2.362 3.204 . 0 0 "[ . 1 . 2]" 1
91 1 12 MET HA 1 12 MET HG2 . . 4.230 2.387 2.095 2.658 . 0 0 "[ . 1 . 2]" 1
92 1 12 MET HA 1 12 MET HG3 . . 4.030 2.992 2.637 3.567 . 0 0 "[ . 1 . 2]" 1
93 1 12 MET HA 1 13 TYR H . . 2.950 2.346 2.247 2.458 . 0 0 "[ . 1 . 2]" 1
94 1 12 MET HA 1 13 TYR QD . . 4.960 3.854 3.391 4.275 . 0 0 "[ . 1 . 2]" 1
95 1 12 MET HA 1 68 THR H . . 5.500 4.826 4.494 5.436 . 0 0 "[ . 1 . 2]" 1
96 1 12 MET HA 1 68 THR HB . . 4.760 3.822 3.285 4.699 . 0 0 "[ . 1 . 2]" 1
97 1 12 MET HA 1 68 THR MG . . 4.650 3.548 2.952 4.515 . 0 0 "[ . 1 . 2]" 1
98 1 12 MET HA 1 71 LYS HA . . 4.120 3.270 2.672 3.832 . 0 0 "[ . 1 . 2]" 1
99 1 12 MET HA 1 71 LYS QD . . 3.530 3.587 3.226 3.628 0.098 15 0 "[ . 1 . 2]" 1
100 1 12 MET HA 1 72 ALA H . . 4.440 3.314 2.711 3.891 . 0 0 "[ . 1 . 2]" 1
101 1 12 MET HB2 1 13 TYR H . . 5.140 3.952 3.755 4.238 . 0 0 "[ . 1 . 2]" 1
102 1 12 MET HB2 1 13 TYR HA . . 5.080 4.533 4.334 5.030 . 0 0 "[ . 1 . 2]" 1
103 1 12 MET HB2 1 102 ASN H . . 4.490 4.155 3.603 4.773 0.283 14 0 "[ . 1 . 2]" 1
104 1 12 MET HB2 1 102 ASN HA . . 3.710 3.114 2.567 3.809 0.099 14 0 "[ . 1 . 2]" 1
105 1 12 MET HB3 1 13 TYR H . . 4.300 2.749 2.379 3.110 . 0 0 "[ . 1 . 2]" 1
106 1 12 MET HB3 1 102 ASN H . . 5.500 4.993 4.334 5.560 0.060 15 0 "[ . 1 . 2]" 1
107 1 12 MET HB3 1 102 ASN HA . . 4.330 3.811 3.036 4.382 0.052 16 0 "[ . 1 . 2]" 1
108 1 12 MET HG2 1 13 TYR H . . 4.850 3.983 3.582 4.384 . 0 0 "[ . 1 . 2]" 1
109 1 12 MET HG2 1 70 GLY QA . . 4.980 3.971 2.748 4.641 . 0 0 "[ . 1 . 2]" 1
110 1 12 MET HG2 1 71 LYS HA . . 5.180 3.440 2.918 3.827 . 0 0 "[ . 1 . 2]" 1
111 1 12 MET HG2 1 71 LYS QD . . 4.910 3.131 2.538 3.697 . 0 0 "[ . 1 . 2]" 1
112 1 12 MET HG2 1 71 LYS QG . . 4.730 4.679 4.157 4.873 0.143 11 0 "[ . 1 . 2]" 1
113 1 12 MET HG3 1 13 TYR H . . 4.830 4.862 4.688 4.918 0.088 12 0 "[ . 1 . 2]" 1
114 1 12 MET HG3 1 70 GLY QA . . 5.040 4.583 3.775 5.121 0.081 18 0 "[ . 1 . 2]" 1
115 1 12 MET HG3 1 71 LYS HA . . 5.060 3.634 2.825 4.582 . 0 0 "[ . 1 . 2]" 1
116 1 12 MET HG3 1 71 LYS QD . . 4.780 2.365 1.975 3.608 . 0 0 "[ . 1 . 2]" 1
117 1 12 MET HG3 1 71 LYS QE . . 5.480 3.004 1.958 4.155 . 0 0 "[ . 1 . 2]" 1
118 1 12 MET HG3 1 71 LYS QG . . 4.810 4.136 3.602 4.844 0.034 8 0 "[ . 1 . 2]" 1
119 1 13 TYR H 1 13 TYR QB . . 3.300 3.222 3.078 3.309 0.009 8 0 "[ . 1 . 2]" 1
120 1 13 TYR H 1 14 GLU H . . 5.500 4.307 4.174 4.445 . 0 0 "[ . 1 . 2]" 1
121 1 13 TYR H 1 68 THR H . . 4.120 3.317 2.914 3.818 . 0 0 "[ . 1 . 2]" 1
122 1 13 TYR H 1 68 THR HB . . 5.400 4.192 3.776 4.818 . 0 0 "[ . 1 . 2]" 1
123 1 13 TYR H 1 68 THR MG . . 3.680 3.169 2.539 3.786 0.106 9 0 "[ . 1 . 2]" 1
124 1 13 TYR HA 1 14 GLU H . . 2.950 2.472 2.348 2.765 . 0 0 "[ . 1 . 2]" 1
125 1 13 TYR HA 1 101 LYS HA . . 3.580 2.618 2.067 3.341 . 0 0 "[ . 1 . 2]" 1
126 1 13 TYR HA 1 102 ASN H . . 4.490 3.680 2.803 4.344 . 0 0 "[ . 1 . 2]" 1
127 1 13 TYR QB 1 14 GLU H . . 3.580 2.390 2.210 2.581 . 0 0 "[ . 1 . 2]" 1
128 1 13 TYR QB 1 14 GLU HA . . 5.390 4.440 4.061 4.661 . 0 0 "[ . 1 . 2]" 1
129 1 13 TYR QD 1 15 VAL H . . 5.000 3.964 3.074 4.534 . 0 0 "[ . 1 . 2]" 1
130 1 13 TYR QD 1 15 VAL HB . . 3.380 2.768 2.237 3.161 . 0 0 "[ . 1 . 2]" 1
131 1 13 TYR QD 1 15 VAL MG2 . . 4.430 4.224 3.833 4.525 0.095 16 0 "[ . 1 . 2]" 1
132 1 13 TYR QD 1 68 THR MG . . 3.710 2.828 2.272 3.549 . 0 0 "[ . 1 . 2]" 1
133 1 13 TYR QD 1 72 ALA MB . . 3.900 2.492 2.090 3.045 . 0 0 "[ . 1 . 2]" 1
134 1 13 TYR QE 1 15 VAL H . . 4.600 4.237 3.400 4.683 0.083 6 0 "[ . 1 . 2]" 1
135 1 13 TYR QE 1 15 VAL HB . . 3.490 2.755 2.293 3.275 . 0 0 "[ . 1 . 2]" 1
136 1 13 TYR QE 1 15 VAL MG1 . . 3.150 2.383 2.002 2.860 . 0 0 "[ . 1 . 2]" 1
137 1 13 TYR QE 1 15 VAL MG2 . . 3.750 3.828 3.521 3.876 0.126 8 0 "[ . 1 . 2]" 1
138 1 13 TYR QE 1 34 ALA MB . . 3.510 3.411 2.608 3.625 0.115 10 0 "[ . 1 . 2]" 1
139 1 13 TYR QE 1 72 ALA MB . . 4.340 2.215 1.983 3.012 . 0 0 "[ . 1 . 2]" 1
140 1 14 GLU H 1 14 GLU HG2 . . 5.460 4.383 4.154 4.656 . 0 0 "[ . 1 . 2]" 1
141 1 14 GLU H 1 100 TYR H . . 3.730 3.156 2.817 3.800 0.070 15 0 "[ . 1 . 2]" 1
142 1 14 GLU H 1 100 TYR HB2 . . 4.130 2.943 2.221 3.447 . 0 0 "[ . 1 . 2]" 1
143 1 14 GLU H 1 100 TYR HB3 . . 4.820 4.239 3.649 4.669 . 0 0 "[ . 1 . 2]" 1
144 1 14 GLU H 1 100 TYR QD . . 4.880 4.350 3.573 4.799 . 0 0 "[ . 1 . 2]" 1
145 1 14 GLU H 1 100 TYR QR . . 5.410 4.290 3.542 4.719 . 0 0 "[ . 1 . 2]" 1
146 1 14 GLU H 1 101 LYS HA . . 4.700 3.913 3.476 4.759 0.059 11 0 "[ . 1 . 2]" 1
147 1 14 GLU HA 1 14 GLU HG3 . . 3.900 2.622 2.425 2.936 . 0 0 "[ . 1 . 2]" 1
148 1 14 GLU HA 1 15 VAL H . . 2.920 2.378 2.234 2.505 . 0 0 "[ . 1 . 2]" 1
149 1 14 GLU HA 1 15 VAL MG1 . . 4.540 3.786 3.427 4.161 . 0 0 "[ . 1 . 2]" 1
150 1 14 GLU HA 1 67 SER HA . . 3.190 2.315 2.121 2.665 . 0 0 "[ . 1 . 2]" 1
151 1 14 GLU HA 1 67 SER QB . . 4.260 2.833 2.471 3.060 . 0 0 "[ . 1 . 2]" 1
152 1 14 GLU HA 1 68 THR H . . 4.280 3.794 3.424 4.071 . 0 0 "[ . 1 . 2]" 1
153 1 14 GLU QB 1 67 SER HA . . 4.200 3.760 3.320 4.168 . 0 0 "[ . 1 . 2]" 1
154 1 14 GLU QB 1 67 SER QB . . 3.990 2.842 2.363 3.265 . 0 0 "[ . 1 . 2]" 1
155 1 14 GLU QB 1 68 THR H . . 4.950 4.448 4.079 4.840 . 0 0 "[ . 1 . 2]" 1
156 1 14 GLU QB 1 100 TYR HB2 . . 4.020 2.254 2.088 2.542 . 0 0 "[ . 1 . 2]" 1
157 1 14 GLU QB 1 100 TYR QR . . 4.560 3.305 2.595 3.859 . 0 0 "[ . 1 . 2]" 1
158 1 14 GLU HG2 1 15 VAL H . . 3.890 3.107 2.634 3.917 0.027 17 0 "[ . 1 . 2]" 1
159 1 14 GLU HG2 1 15 VAL HA . . 5.500 4.055 3.755 4.861 . 0 0 "[ . 1 . 2]" 1
160 1 14 GLU HG2 1 16 THR MG . . 5.320 4.665 4.164 5.180 . 0 0 "[ . 1 . 2]" 1
161 1 14 GLU HG2 1 65 THR MG . . 4.230 2.875 2.447 3.497 . 0 0 "[ . 1 . 2]" 1
162 1 14 GLU HG2 1 67 SER HA . . 5.500 5.206 4.985 5.565 0.065 5 0 "[ . 1 . 2]" 1
163 1 14 GLU HG2 1 67 SER QB . . 4.390 3.983 3.751 4.346 . 0 0 "[ . 1 . 2]" 1
164 1 14 GLU HG2 1 100 TYR HB2 . . 5.260 3.726 2.523 4.260 . 0 0 "[ . 1 . 2]" 1
165 1 14 GLU HG2 1 100 TYR QR . . 4.670 3.026 2.327 3.755 . 0 0 "[ . 1 . 2]" 1
166 1 14 GLU HG3 1 15 VAL H . . 3.980 2.776 2.135 3.587 . 0 0 "[ . 1 . 2]" 1
167 1 14 GLU HG3 1 16 THR MG . . 5.380 5.368 5.056 5.473 0.093 20 0 "[ . 1 . 2]" 1
168 1 14 GLU HG3 1 65 THR MG . . 3.970 2.625 2.185 3.379 . 0 0 "[ . 1 . 2]" 1
169 1 14 GLU HG3 1 66 LEU H . . 5.280 4.397 3.810 5.301 0.021 5 0 "[ . 1 . 2]" 1
170 1 14 GLU HG3 1 67 SER HA . . 4.810 3.825 3.533 4.442 . 0 0 "[ . 1 . 2]" 1
171 1 14 GLU HG3 1 67 SER QB . . 4.370 2.407 2.153 2.906 . 0 0 "[ . 1 . 2]" 1
172 1 15 VAL H 1 15 VAL HB . . 3.670 3.248 2.762 3.698 0.028 12 0 "[ . 1 . 2]" 1
173 1 15 VAL H 1 15 VAL MG1 . . 3.280 2.382 2.149 2.628 . 0 0 "[ . 1 . 2]" 1
174 1 15 VAL H 1 15 VAL MG2 . . 4.700 3.967 3.821 4.070 . 0 0 "[ . 1 . 2]" 1
175 1 15 VAL H 1 65 THR MG . . 4.720 3.756 3.021 4.486 . 0 0 "[ . 1 . 2]" 1
176 1 15 VAL H 1 66 LEU HB2 . . 5.110 4.003 3.121 4.790 . 0 0 "[ . 1 . 2]" 1
177 1 15 VAL H 1 67 SER HA . . 3.860 3.682 3.411 3.917 0.057 5 0 "[ . 1 . 2]" 1
178 1 15 VAL H 1 67 SER QB . . 4.900 3.920 3.608 4.480 . 0 0 "[ . 1 . 2]" 1
179 1 15 VAL HA 1 15 VAL MG2 . . 3.330 2.373 2.256 2.600 . 0 0 "[ . 1 . 2]" 1
180 1 15 VAL HA 1 16 THR H . . 2.850 2.243 2.018 2.448 . 0 0 "[ . 1 . 2]" 1
181 1 15 VAL HA 1 16 THR HA . . 5.090 4.439 4.338 4.516 . 0 0 "[ . 1 . 2]" 1
182 1 15 VAL HA 1 16 THR HB . . 5.450 4.724 4.335 5.254 . 0 0 "[ . 1 . 2]" 1
183 1 15 VAL HA 1 16 THR MG . . 5.100 5.010 3.547 5.232 0.132 6 0 "[ . 1 . 2]" 1
184 1 15 VAL HA 1 77 VAL QG . . 5.500 4.850 4.230 5.164 . 0 0 "[ . 1 . 2]" 1
185 1 15 VAL HA 1 98 THR H . . 5.500 4.907 4.544 5.543 0.043 5 0 "[ . 1 . 2]" 1
186 1 15 VAL HA 1 99 VAL HA . . 3.490 2.487 2.135 3.133 . 0 0 "[ . 1 . 2]" 1
187 1 15 VAL HA 1 99 VAL QG . . 4.350 3.214 2.676 4.206 . 0 0 "[ . 1 . 2]" 1
188 1 15 VAL HA 1 100 TYR H . . 4.040 3.193 2.772 3.673 . 0 0 "[ . 1 . 2]" 1
189 1 15 VAL HA 1 100 TYR QR . . 4.720 3.218 2.362 4.195 . 0 0 "[ . 1 . 2]" 1
190 1 15 VAL HB 1 16 THR H . . 4.330 4.113 3.754 4.336 0.006 11 0 "[ . 1 . 2]" 1
191 1 15 VAL HB 1 32 VAL QG . . 5.280 3.644 2.352 4.454 . 0 0 "[ . 1 . 2]" 1
192 1 15 VAL HB 1 77 VAL QG . . 4.210 3.900 3.181 4.147 . 0 0 "[ . 1 . 2]" 1
193 1 15 VAL HB 1 99 VAL QG . . 4.110 2.830 2.153 3.983 . 0 0 "[ . 1 . 2]" 1
194 1 15 VAL MG1 1 17 ILE MD . . 5.500 5.445 4.698 5.634 0.134 8 0 "[ . 1 . 2]" 1
195 1 15 VAL MG1 1 17 ILE MG . . 4.790 4.009 3.103 4.894 0.104 12 0 "[ . 1 . 2]" 1
196 1 15 VAL MG1 1 32 VAL QG . . 3.650 2.012 1.804 2.742 . 0 0 "[ . 1 . 2]" 1
197 1 15 VAL MG1 1 66 LEU H . . 3.840 3.003 2.489 3.909 0.069 6 0 "[ . 1 . 2]" 1
198 1 15 VAL MG1 1 66 LEU HB2 . . 3.360 2.497 1.984 3.456 0.096 12 0 "[ . 1 . 2]" 1
199 1 15 VAL MG1 1 67 SER H . . 5.500 4.963 4.510 5.416 . 0 0 "[ . 1 . 2]" 1
200 1 15 VAL MG1 1 67 SER HA . . 4.990 4.144 3.628 4.606 . 0 0 "[ . 1 . 2]" 1
201 1 15 VAL MG2 1 16 THR H . . 3.420 2.457 2.052 2.987 . 0 0 "[ . 1 . 2]" 1
202 1 15 VAL MG2 1 16 THR HA . . 5.050 3.981 3.573 4.310 . 0 0 "[ . 1 . 2]" 1
203 1 15 VAL MG2 1 17 ILE HA . . 5.500 4.541 3.835 5.128 . 0 0 "[ . 1 . 2]" 1
204 1 15 VAL MG2 1 17 ILE MD . . 5.500 4.336 3.596 4.911 . 0 0 "[ . 1 . 2]" 1
205 1 15 VAL MG2 1 17 ILE MG . . 4.390 4.046 3.376 4.513 0.123 8 0 "[ . 1 . 2]" 1
206 1 15 VAL MG2 1 77 VAL QG . . 3.180 2.600 1.798 3.062 . 0 0 "[ . 1 . 2]" 1
207 1 15 VAL MG2 1 98 THR H . . 4.580 3.865 3.089 4.666 0.086 11 0 "[ . 1 . 2]" 1
208 1 15 VAL MG2 1 99 VAL HA . . 4.790 2.845 2.205 3.614 . 0 0 "[ . 1 . 2]" 1
209 1 15 VAL MG2 1 100 TYR H . . 5.300 4.364 3.848 4.981 . 0 0 "[ . 1 . 2]" 1
210 1 16 THR H 1 16 THR HB . . 3.760 2.949 2.541 3.489 . 0 0 "[ . 1 . 2]" 1
211 1 16 THR H 1 16 THR MG . . 4.530 3.733 2.380 3.976 . 0 0 "[ . 1 . 2]" 1
212 1 16 THR H 1 65 THR MG . . 5.410 4.706 4.100 5.250 . 0 0 "[ . 1 . 2]" 1
213 1 16 THR H 1 98 THR H . . 3.730 3.178 2.782 3.662 . 0 0 "[ . 1 . 2]" 1
214 1 16 THR H 1 98 THR HB . . 4.770 4.012 3.576 4.849 0.079 17 0 "[ . 1 . 2]" 1
215 1 16 THR H 1 99 VAL HA . . 4.290 3.549 3.043 4.060 . 0 0 "[ . 1 . 2]" 1
216 1 16 THR H 1 99 VAL QG . . 5.500 3.973 3.289 5.133 . 0 0 "[ . 1 . 2]" 1
217 1 16 THR H 1 100 TYR QR . . 4.710 3.622 3.137 4.292 . 0 0 "[ . 1 . 2]" 1
218 1 16 THR HA 1 16 THR MG . . 3.340 2.316 2.137 3.277 . 0 0 "[ . 1 . 2]" 1
219 1 16 THR HA 1 17 ILE H . . 2.850 2.211 2.083 2.316 . 0 0 "[ . 1 . 2]" 1
220 1 16 THR HA 1 17 ILE HA . . 4.680 4.463 4.404 4.504 . 0 0 "[ . 1 . 2]" 1
221 1 16 THR HA 1 17 ILE MG . . 5.090 3.570 3.111 3.847 . 0 0 "[ . 1 . 2]" 1
222 1 16 THR HA 1 64 VAL H . . 5.110 4.721 4.302 5.144 0.034 14 0 "[ . 1 . 2]" 1
223 1 16 THR HA 1 64 VAL QG . . 5.500 4.564 3.843 5.151 . 0 0 "[ . 1 . 2]" 1
224 1 16 THR HA 1 65 THR HA . . 3.240 2.566 2.237 2.903 . 0 0 "[ . 1 . 2]" 1
225 1 16 THR HA 1 65 THR MG . . 4.340 3.319 2.895 3.826 . 0 0 "[ . 1 . 2]" 1
226 1 16 THR HA 1 66 LEU H . . 4.560 3.829 3.192 4.151 . 0 0 "[ . 1 . 2]" 1
227 1 16 THR HB 1 17 ILE H . . 4.270 4.054 3.589 4.349 0.079 9 0 "[ . 1 . 2]" 1
228 1 16 THR HB 1 98 THR H . . 5.270 3.586 2.874 5.350 0.080 18 0 "[ . 1 . 2]" 1
229 1 16 THR HB 1 100 TYR QR . . 5.500 3.217 2.416 4.166 . 0 0 "[ . 1 . 2]" 1
230 1 16 THR MG 1 17 ILE H . . 3.880 3.091 2.599 3.965 0.085 18 0 "[ . 1 . 2]" 1
231 1 16 THR MG 1 18 GLU HB2 . . 5.500 5.263 3.891 5.603 0.103 18 0 "[ . 1 . 2]" 1
232 1 16 THR MG 1 18 GLU QG . . 4.360 3.338 2.342 4.471 0.111 6 0 "[ . 1 . 2]" 1
233 1 16 THR MG 1 64 VAL H . . 5.500 4.499 3.817 5.467 . 0 0 "[ . 1 . 2]" 1
234 1 16 THR MG 1 65 THR HA . . 4.000 3.140 2.672 3.828 . 0 0 "[ . 1 . 2]" 1
235 1 16 THR MG 1 65 THR HB . . 4.550 4.254 3.931 4.665 0.115 19 0 "[ . 1 . 2]" 1
236 1 16 THR MG 1 66 LEU H . . 4.920 4.862 4.423 5.030 0.110 18 0 "[ . 1 . 2]" 1
237 1 16 THR MG 1 98 THR HB . . 5.390 3.956 2.347 4.587 . 0 0 "[ . 1 . 2]" 1
238 1 16 THR MG 1 100 TYR QR . . 3.790 3.379 2.045 3.659 . 0 0 "[ . 1 . 2]" 1
239 1 16 THR MG 1 100 TYR QE . . 3.620 3.465 2.053 3.740 0.120 8 0 "[ . 1 . 2]" 1
240 1 17 ILE H 1 17 ILE HB . . 3.530 3.134 2.812 3.426 . 0 0 "[ . 1 . 2]" 1
241 1 17 ILE H 1 17 ILE MD . . 4.510 4.455 4.308 4.626 0.116 18 0 "[ . 1 . 2]" 1
242 1 17 ILE H 1 17 ILE HG12 . . 4.750 4.758 4.282 4.923 0.173 6 0 "[ . 1 . 2]" 1
243 1 17 ILE H 1 17 ILE MG . . 4.390 2.125 1.898 2.283 . 0 0 "[ . 1 . 2]" 1
244 1 17 ILE H 1 63 LYS HA . . 5.500 4.770 4.511 5.251 . 0 0 "[ . 1 . 2]" 1
245 1 17 ILE H 1 64 VAL H . . 3.920 3.290 2.864 3.835 . 0 0 "[ . 1 . 2]" 1
246 1 17 ILE H 1 64 VAL QG . . 4.760 3.927 3.329 4.660 . 0 0 "[ . 1 . 2]" 1
247 1 17 ILE H 1 65 THR HA . . 4.060 3.838 3.409 4.106 0.046 2 0 "[ . 1 . 2]" 1
248 1 17 ILE HA 1 17 ILE MD . . 3.500 2.436 2.125 3.558 0.058 20 0 "[ . 1 . 2]" 1
249 1 17 ILE HA 1 17 ILE HG12 . . 4.010 3.748 3.330 3.869 . 0 0 "[ . 1 . 2]" 1
250 1 17 ILE HA 1 17 ILE HG13 . . 3.890 2.903 2.330 3.308 . 0 0 "[ . 1 . 2]" 1
251 1 17 ILE HA 1 18 GLU H . . 2.990 2.221 2.115 2.386 . 0 0 "[ . 1 . 2]" 1
252 1 17 ILE HA 1 18 GLU HB2 . . 5.170 4.422 3.581 4.783 . 0 0 "[ . 1 . 2]" 1
253 1 17 ILE HA 1 97 VAL HA . . 3.870 2.773 2.333 3.372 . 0 0 "[ . 1 . 2]" 1
254 1 17 ILE HA 1 98 THR H . . 4.460 3.964 3.599 4.515 0.055 9 0 "[ . 1 . 2]" 1
255 1 17 ILE HB 1 17 ILE MD . . 3.180 2.306 2.138 2.474 . 0 0 "[ . 1 . 2]" 1
256 1 17 ILE MD 1 17 ILE MG . . 3.440 3.073 2.141 3.311 . 0 0 "[ . 1 . 2]" 1
257 1 17 ILE MD 1 18 GLU H . . 4.010 2.834 2.021 4.065 0.055 20 0 "[ . 1 . 2]" 1
258 1 17 ILE MD 1 19 GLN H . . 5.500 4.805 3.921 5.538 0.038 7 0 "[ . 1 . 2]" 1
259 1 17 ILE MD 1 19 GLN HA . . 5.240 4.731 3.959 5.328 0.088 7 0 "[ . 1 . 2]" 1
260 1 17 ILE MD 1 19 GLN HE21 . . 5.500 5.258 3.521 5.610 0.110 1 0 "[ . 1 . 2]" 1
261 1 17 ILE MD 1 19 GLN QG . . 3.860 2.996 2.358 3.471 . 0 0 "[ . 1 . 2]" 1
262 1 17 ILE MD 1 30 VAL QG . . 5.050 3.856 3.044 4.653 . 0 0 "[ . 1 . 2]" 1
263 1 17 ILE MD 1 95 TRP HA . . 5.010 4.550 3.936 5.108 0.098 18 0 "[ . 1 . 2]" 1
264 1 17 ILE MD 1 95 TRP HB3 . . 4.600 4.231 3.377 4.698 0.098 4 0 "[ . 1 . 2]" 1
265 1 17 ILE MD 1 95 TRP HE1 . . 4.730 4.452 3.808 4.831 0.101 4 0 "[ . 1 . 2]" 1
266 1 17 ILE MD 1 95 TRP HZ2 . . 4.040 3.601 3.126 4.132 0.092 5 0 "[ . 1 . 2]" 1
267 1 17 ILE MD 1 96 VAL H . . 5.010 4.079 3.206 4.955 . 0 0 "[ . 1 . 2]" 1
268 1 17 ILE MD 1 97 VAL HA . . 4.490 3.358 2.880 4.471 . 0 0 "[ . 1 . 2]" 1
269 1 17 ILE MD 1 97 VAL HB . . 4.330 4.347 4.186 4.416 0.086 18 0 "[ . 1 . 2]" 1
270 1 17 ILE MD 1 97 VAL MG2 . . 3.980 2.572 1.973 4.091 0.111 8 0 "[ . 1 . 2]" 1
271 1 17 ILE HG12 1 17 ILE MG . . 3.090 2.224 2.159 2.341 . 0 0 "[ . 1 . 2]" 1
272 1 17 ILE HG12 1 18 GLU H . . 5.480 4.150 3.072 4.760 . 0 0 "[ . 1 . 2]" 1
273 1 17 ILE HG12 1 18 GLU HA . . 5.500 5.257 4.105 5.584 0.084 8 0 "[ . 1 . 2]" 1
274 1 17 ILE HG12 1 19 GLN QG . . 5.500 3.042 2.089 3.571 . 0 0 "[ . 1 . 2]" 1
275 1 17 ILE HG13 1 17 ILE MG . . 3.520 2.656 2.381 3.246 . 0 0 "[ . 1 . 2]" 1
276 1 17 ILE HG13 1 18 GLU HA . . 5.130 3.954 3.375 4.707 . 0 0 "[ . 1 . 2]" 1
277 1 17 ILE HG13 1 97 VAL MG1 . . 4.870 4.469 2.232 4.965 0.095 1 0 "[ . 1 . 2]" 1
278 1 17 ILE MG 1 18 GLU HA . . 5.500 4.056 3.519 4.540 . 0 0 "[ . 1 . 2]" 1
279 1 17 ILE MG 1 19 GLN HE21 . . 5.500 4.926 3.747 5.596 0.096 16 0 "[ . 1 . 2]" 1
280 1 17 ILE MG 1 19 GLN QG . . 3.940 3.658 2.890 4.052 0.112 11 0 "[ . 1 . 2]" 1
281 1 17 ILE MG 1 64 VAL H . . 5.380 2.683 2.208 3.231 . 0 0 "[ . 1 . 2]" 1
282 1 17 ILE MG 1 64 VAL HB . . 4.470 3.679 2.046 4.574 0.104 18 0 "[ . 1 . 2]" 1
283 1 17 ILE MG 1 64 VAL QG . . 3.770 2.316 1.906 3.075 . 0 0 "[ . 1 . 2]" 1
284 1 17 ILE MG 1 65 THR HA . . 5.500 4.278 3.845 4.598 . 0 0 "[ . 1 . 2]" 1
285 1 17 ILE MG 1 66 LEU QD . . 5.500 3.461 2.397 4.190 . 0 0 "[ . 1 . 2]" 1
286 1 18 GLU H 1 18 GLU HB2 . . 4.080 2.640 2.380 2.934 . 0 0 "[ . 1 . 2]" 1
287 1 18 GLU H 1 18 GLU HB3 . . 3.930 3.697 3.140 3.899 . 0 0 "[ . 1 . 2]" 1
288 1 18 GLU H 1 18 GLU QG . . 4.480 3.290 2.767 4.045 . 0 0 "[ . 1 . 2]" 1
289 1 18 GLU H 1 18 GLU HG3 . . 4.750 3.472 2.831 4.508 . 0 0 "[ . 1 . 2]" 1
290 1 18 GLU H 1 19 GLN H . . 4.950 3.950 3.244 4.227 . 0 0 "[ . 1 . 2]" 1
291 1 18 GLU H 1 96 VAL H . . 3.820 3.170 2.647 3.884 0.064 9 0 "[ . 1 . 2]" 1
292 1 18 GLU H 1 97 VAL HA . . 4.830 3.877 3.495 4.439 . 0 0 "[ . 1 . 2]" 1
293 1 18 GLU HA 1 18 GLU QG . . 3.530 2.416 2.122 2.589 . 0 0 "[ . 1 . 2]" 1
294 1 18 GLU HA 1 19 GLN H . . 2.970 2.218 2.119 2.393 . 0 0 "[ . 1 . 2]" 1
295 1 18 GLU HA 1 63 LYS HA . . 3.560 2.992 2.623 3.626 0.066 12 0 "[ . 1 . 2]" 1
296 1 18 GLU HA 1 63 LYS HB2 . . 4.620 3.632 2.102 4.698 0.078 12 0 "[ . 1 . 2]" 1
297 1 18 GLU HA 1 63 LYS QD . . 5.500 3.283 2.077 4.582 . 0 0 "[ . 1 . 2]" 1
298 1 18 GLU HA 1 63 LYS HG3 . . 4.960 3.247 1.997 4.644 . 0 0 "[ . 1 . 2]" 1
299 1 18 GLU HA 1 64 VAL H . . 4.510 4.166 3.712 4.589 0.079 11 0 "[ . 1 . 2]" 1
300 1 18 GLU HB2 1 19 GLN H . . 4.480 4.499 4.328 4.550 0.070 16 0 "[ . 1 . 2]" 1
301 1 18 GLU HB2 1 95 TRP HA . . 5.220 4.651 4.178 5.180 . 0 0 "[ . 1 . 2]" 1
302 1 18 GLU HB2 1 96 VAL H . . 4.250 3.157 2.350 4.328 0.078 6 0 "[ . 1 . 2]" 1
303 1 18 GLU HB2 1 96 VAL QG . . 5.490 3.193 2.285 3.816 . 0 0 "[ . 1 . 2]" 1
304 1 18 GLU HB3 1 19 GLN H . . 5.190 3.873 3.227 4.393 . 0 0 "[ . 1 . 2]" 1
305 1 18 GLU HB3 1 96 VAL H . . 4.850 4.232 3.132 4.925 0.075 14 0 "[ . 1 . 2]" 1
306 1 18 GLU QG 1 19 GLN H . . 4.970 4.250 2.645 4.579 . 0 0 "[ . 1 . 2]" 1
307 1 18 GLU QG 1 63 LYS HA . . 5.030 4.218 3.635 5.110 0.080 12 0 "[ . 1 . 2]" 1
308 1 18 GLU QG 1 63 LYS QD . . 5.010 3.093 2.045 5.104 0.094 4 0 "[ . 1 . 2]" 1
309 1 18 GLU QG 1 63 LYS HG3 . . 4.330 2.961 2.106 3.700 . 0 0 "[ . 1 . 2]" 1
310 1 18 GLU QG 1 96 VAL H . . 5.210 4.899 4.355 5.297 0.087 6 0 "[ . 1 . 2]" 1
311 1 19 GLN H 1 19 GLN HB3 . . 4.090 3.695 3.597 3.814 . 0 0 "[ . 1 . 2]" 1
312 1 19 GLN H 1 19 GLN HE21 . . 5.500 4.635 3.581 5.326 . 0 0 "[ . 1 . 2]" 1
313 1 19 GLN H 1 62 GLU HA . . 4.220 3.943 3.200 4.298 0.078 2 0 "[ . 1 . 2]" 1
314 1 19 GLN H 1 63 LYS HA . . 4.250 3.223 2.911 3.683 . 0 0 "[ . 1 . 2]" 1
315 1 19 GLN H 1 64 VAL H . . 5.290 5.073 4.581 5.368 0.078 9 0 "[ . 1 . 2]" 1
316 1 19 GLN HA 1 20 SER H . . 3.180 2.387 2.141 2.613 . 0 0 "[ . 1 . 2]" 1
317 1 19 GLN HA 1 20 SER HA . . 5.140 4.569 4.397 4.725 . 0 0 "[ . 1 . 2]" 1
318 1 19 GLN HA 1 95 TRP HA . . 4.140 3.251 2.425 3.987 . 0 0 "[ . 1 . 2]" 1
319 1 19 GLN HA 1 95 TRP HE1 . . 5.480 3.279 2.139 3.912 . 0 0 "[ . 1 . 2]" 1
320 1 19 GLN HA 1 96 VAL H . . 5.070 4.444 3.761 5.094 0.024 14 0 "[ . 1 . 2]" 1
321 1 19 GLN HB2 1 20 SER H . . 4.840 3.691 2.981 4.260 . 0 0 "[ . 1 . 2]" 1
322 1 19 GLN HB2 1 20 SER HA . . 5.160 4.317 3.942 4.793 . 0 0 "[ . 1 . 2]" 1
323 1 19 GLN HB2 1 23 PHE QB . . 4.860 3.427 2.710 4.610 . 0 0 "[ . 1 . 2]" 1
324 1 19 GLN HB2 1 23 PHE QD . . 5.120 3.571 2.714 4.144 . 0 0 "[ . 1 . 2]" 1
325 1 19 GLN HB2 1 23 PHE QE . . 5.500 4.324 3.428 5.165 . 0 0 "[ . 1 . 2]" 1
326 1 19 GLN HB2 1 62 GLU HA . . 4.610 2.591 2.179 3.130 . 0 0 "[ . 1 . 2]" 1
327 1 19 GLN HB2 1 95 TRP HE1 . . 5.500 4.089 3.711 4.537 . 0 0 "[ . 1 . 2]" 1
328 1 19 GLN HB3 1 19 GLN HE21 . . 4.650 3.405 2.363 4.287 . 0 0 "[ . 1 . 2]" 1
329 1 19 GLN HB3 1 19 GLN HE22 . . 4.960 4.300 3.642 5.018 0.058 10 0 "[ . 1 . 2]" 1
330 1 19 GLN HB3 1 20 SER H . . 5.200 2.898 2.380 3.680 . 0 0 "[ . 1 . 2]" 1
331 1 19 GLN HB3 1 20 SER HA . . 5.140 4.510 4.052 4.998 . 0 0 "[ . 1 . 2]" 1
332 1 19 GLN HB3 1 23 PHE QB . . 4.990 2.402 2.040 3.282 . 0 0 "[ . 1 . 2]" 1
333 1 19 GLN HB3 1 23 PHE QE . . 5.500 4.842 3.661 5.588 0.088 4 0 "[ . 1 . 2]" 1
334 1 19 GLN HB3 1 62 GLU HA . . 4.210 4.138 3.721 4.692 0.482 6 0 "[ . 1 . 2]" 1
335 1 19 GLN HB3 1 95 TRP HE1 . . 5.450 2.588 2.110 3.073 . 0 0 "[ . 1 . 2]" 1
336 1 19 GLN HB3 1 95 TRP HZ2 . . 5.010 4.601 3.965 5.084 0.074 13 0 "[ . 1 . 2]" 1
337 1 19 GLN HE21 1 59 LEU QD . . 5.500 3.267 2.214 4.291 . 0 0 "[ . 1 . 2]" 1
338 1 19 GLN HE21 1 62 GLU HA . . 5.190 3.978 2.499 5.247 0.057 2 0 "[ . 1 . 2]" 1
339 1 19 GLN HE22 1 59 LEU HA . . 4.860 4.246 3.397 4.939 0.079 13 0 "[ . 1 . 2]" 1
340 1 19 GLN HE22 1 59 LEU QD . . 4.510 2.663 2.025 3.822 . 0 0 "[ . 1 . 2]" 1
341 1 19 GLN QG 1 62 GLU HA . . 5.270 4.187 3.208 4.904 . 0 0 "[ . 1 . 2]" 1
342 1 19 GLN QG 1 95 TRP HA . . 5.340 4.454 3.860 5.424 0.084 3 0 "[ . 1 . 2]" 1
343 1 19 GLN QG 1 95 TRP HE1 . . 4.290 2.459 2.070 3.424 . 0 0 "[ . 1 . 2]" 1
344 1 19 GLN QG 1 95 TRP HZ2 . . 3.370 3.009 2.382 3.466 0.096 19 0 "[ . 1 . 2]" 1
345 1 20 SER H 1 23 PHE H . . 5.490 5.114 4.117 5.570 0.080 14 0 "[ . 1 . 2]" 1
346 1 20 SER H 1 23 PHE QB . . 5.500 3.328 2.441 4.546 . 0 0 "[ . 1 . 2]" 1
347 1 20 SER HA 1 21 GLY H . . 3.080 2.555 2.284 2.812 . 0 0 "[ . 1 . 2]" 1
348 1 20 SER HA 1 23 PHE QD . . 3.810 2.885 2.131 3.553 . 0 0 "[ . 1 . 2]" 1
349 1 20 SER HA 1 23 PHE QE . . 4.050 3.384 2.656 4.116 0.066 2 0 "[ . 1 . 2]" 1
350 1 20 SER HA 1 62 GLU HA . . 5.240 4.550 3.456 5.300 0.060 16 0 "[ . 1 . 2]" 1
351 1 20 SER QB 1 21 GLY H . . 3.680 2.610 2.158 3.390 . 0 0 "[ . 1 . 2]" 1
352 1 20 SER QB 1 63 LYS QD . . 5.160 4.719 3.929 5.084 . 0 0 "[ . 1 . 2]" 1
353 1 20 SER QB 1 63 LYS QE . . 4.620 4.190 3.398 4.590 . 0 0 "[ . 1 . 2]" 1
354 1 21 GLY H 1 22 ASP H . . 4.900 4.524 4.143 4.697 . 0 0 "[ . 1 . 2]" 1
355 1 21 GLY QA 1 22 ASP HB2 . . 5.500 4.176 3.721 5.211 . 0 0 "[ . 1 . 2]" 1
356 1 21 GLY QA 1 22 ASP HB3 . . 5.140 5.007 4.058 5.234 0.094 4 0 "[ . 1 . 2]" 1
357 1 21 GLY QA 1 23 PHE H . . 5.040 4.205 3.674 5.140 0.100 9 0 "[ . 1 . 2]" 1
358 1 21 GLY QA 1 93 MET HA . . 4.340 3.085 2.218 4.420 0.080 5 0 "[ . 1 . 2]" 1
359 1 21 GLY QA 1 94 GLN H . . 5.470 4.395 3.410 5.548 0.078 7 0 "[ . 1 . 2]" 1
360 1 22 ASP H 1 22 ASP HB2 . . 3.620 2.511 2.231 3.788 0.168 11 0 "[ . 1 . 2]" 1
361 1 22 ASP H 1 22 ASP HB3 . . 3.770 3.359 2.503 3.694 . 0 0 "[ . 1 . 2]" 1
362 1 22 ASP H 1 23 PHE H . . 5.180 3.548 2.445 4.304 . 0 0 "[ . 1 . 2]" 1
363 1 22 ASP H 1 23 PHE QD . . 5.500 4.848 3.606 5.317 . 0 0 "[ . 1 . 2]" 1
364 1 22 ASP H 1 93 MET HA . . 4.360 4.035 2.872 4.444 0.084 7 0 "[ . 1 . 2]" 1
365 1 22 ASP H 1 93 MET QB . . 4.860 3.203 1.890 4.701 . 0 0 "[ . 1 . 2]" 1
366 1 22 ASP HA 1 23 PHE H . . 3.180 2.399 2.089 2.739 . 0 0 "[ . 1 . 2]" 1
367 1 22 ASP HA 1 23 PHE QD . . 4.630 4.389 3.321 4.677 0.047 6 0 "[ . 1 . 2]" 1
368 1 22 ASP HA 1 24 ARG H . . 4.280 3.443 2.988 3.874 . 0 0 "[ . 1 . 2]" 1
369 1 22 ASP HB2 1 23 PHE H . . 5.500 4.490 4.202 4.705 . 0 0 "[ . 1 . 2]" 1
370 1 22 ASP HB3 1 23 PHE H . . 4.170 4.215 3.818 4.583 0.413 11 0 "[ . 1 . 2]" 1
371 1 22 ASP HB3 1 25 SER H . . 5.150 4.524 3.117 5.222 0.072 9 0 "[ . 1 . 2]" 1
372 1 22 ASP HB3 1 25 SER HB2 . . 5.470 3.657 2.460 5.252 . 0 0 "[ . 1 . 2]" 1
373 1 23 PHE H 1 23 PHE QB . . 3.820 2.707 2.372 3.111 . 0 0 "[ . 1 . 2]" 1
374 1 23 PHE H 1 23 PHE QD . . 3.430 2.645 2.372 3.024 . 0 0 "[ . 1 . 2]" 1
375 1 23 PHE H 1 24 ARG H . . 3.890 2.675 1.897 3.215 . 0 0 "[ . 1 . 2]" 1
376 1 23 PHE H 1 93 MET QB . . 5.470 4.654 3.623 5.349 . 0 0 "[ . 1 . 2]" 1
377 1 23 PHE HA 1 25 SER H . . 4.670 3.779 3.111 4.592 . 0 0 "[ . 1 . 2]" 1
378 1 23 PHE HA 1 26 PHE H . . 5.110 4.752 3.778 5.191 0.081 2 0 "[ . 1 . 2]" 1
379 1 23 PHE HA 1 26 PHE QD . . 3.700 2.949 2.301 3.797 0.097 7 0 "[ . 1 . 2]" 1
380 1 23 PHE HA 1 26 PHE QE . . 4.570 3.766 2.094 4.645 0.075 7 0 "[ . 1 . 2]" 1
381 1 23 PHE HA 1 93 MET QB . . 4.710 3.993 3.057 4.587 . 0 0 "[ . 1 . 2]" 1
382 1 23 PHE QD 1 24 ARG H . . 4.490 3.247 2.755 3.911 . 0 0 "[ . 1 . 2]" 1
383 1 23 PHE QD 1 24 ARG HB3 . . 4.610 3.794 2.570 4.700 0.090 13 0 "[ . 1 . 2]" 1
384 1 23 PHE QE 1 24 ARG HB2 . . 5.500 4.888 3.991 5.573 0.073 6 0 "[ . 1 . 2]" 1
385 1 23 PHE QE 1 24 ARG HB3 . . 4.720 4.080 2.897 4.826 0.106 13 0 "[ . 1 . 2]" 1
386 1 23 PHE QE 1 24 ARG QD . . 4.810 3.019 2.229 4.000 . 0 0 "[ . 1 . 2]" 1
387 1 23 PHE QE 1 24 ARG HG2 . . 5.500 3.292 2.299 5.262 . 0 0 "[ . 1 . 2]" 1
388 1 23 PHE QE 1 24 ARG HG3 . . 5.500 3.887 2.146 5.568 0.068 17 0 "[ . 1 . 2]" 1
389 1 23 PHE QE 1 60 ALA HA . . 4.480 2.924 2.180 4.475 . 0 0 "[ . 1 . 2]" 1
390 1 23 PHE QE 1 62 GLU HA . . 5.230 3.372 2.254 4.288 . 0 0 "[ . 1 . 2]" 1
391 1 23 PHE QE 1 62 GLU HB2 . . 4.990 4.913 4.438 5.073 0.083 12 0 "[ . 1 . 2]" 1
392 1 23 PHE QE 1 62 GLU HG2 . . 4.240 2.753 2.208 4.100 . 0 0 "[ . 1 . 2]" 1
393 1 23 PHE QE 1 62 GLU HG3 . . 4.410 3.907 2.551 4.476 0.066 12 0 "[ . 1 . 2]" 1
394 1 24 ARG H 1 24 ARG HB2 . . 4.060 3.121 2.243 3.876 . 0 0 "[ . 1 . 2]" 1
395 1 24 ARG H 1 24 ARG HB3 . . 4.120 3.343 2.635 3.799 . 0 0 "[ . 1 . 2]" 1
396 1 24 ARG H 1 24 ARG QD . . 4.850 3.827 1.912 4.386 . 0 0 "[ . 1 . 2]" 1
397 1 24 ARG H 1 24 ARG HG2 . . 3.680 2.869 1.980 3.961 0.281 13 0 "[ . 1 . 2]" 1
398 1 24 ARG H 1 24 ARG HG3 . . 4.060 2.769 1.914 3.753 . 0 0 "[ . 1 . 2]" 1
399 1 24 ARG H 1 25 SER H . . 3.510 2.897 2.296 3.595 0.085 20 0 "[ . 1 . 2]" 1
400 1 24 ARG HA 1 24 ARG QD . . 4.810 4.052 3.726 4.272 . 0 0 "[ . 1 . 2]" 1
401 1 24 ARG HA 1 24 ARG HG2 . . 4.140 3.132 2.251 3.830 . 0 0 "[ . 1 . 2]" 1
402 1 24 ARG HA 1 24 ARG HG3 . . 3.860 3.584 2.916 4.190 0.330 5 0 "[ . 1 . 2]" 1
403 1 24 ARG HA 1 26 PHE H . . 4.930 3.554 3.188 3.898 . 0 0 "[ . 1 . 2]" 1
404 1 24 ARG HB2 1 24 ARG QD . . 3.920 2.681 2.253 3.301 . 0 0 "[ . 1 . 2]" 1
405 1 24 ARG HB3 1 24 ARG QD . . 3.760 2.392 2.100 2.791 . 0 0 "[ . 1 . 2]" 1
406 1 24 ARG HB3 1 60 ALA HA . . 4.600 3.691 2.079 4.685 0.085 14 0 "[ . 1 . 2]" 1
407 1 24 ARG QD 1 60 ALA HA . . 4.090 3.402 2.130 3.731 . 0 0 "[ . 1 . 2]" 1
408 1 24 ARG QD 1 60 ALA MB . . 4.860 3.092 2.068 4.173 . 0 0 "[ . 1 . 2]" 1
409 1 24 ARG HG2 1 60 ALA HA . . 5.500 3.843 2.114 5.573 0.073 5 0 "[ . 1 . 2]" 1
410 1 24 ARG HG3 1 25 SER H . . 5.500 4.757 4.128 5.406 . 0 0 "[ . 1 . 2]" 1
411 1 25 SER H 1 25 SER HB2 . . 3.240 2.741 2.198 3.632 0.392 1 0 "[ . 1 . 2]" 1
412 1 25 SER H 1 25 SER HB3 . . 3.800 3.590 2.474 3.880 0.080 20 0 "[ . 1 . 2]" 1
413 1 25 SER H 1 26 PHE H . . 3.410 2.510 1.783 3.373 . 0 0 "[ . 1 . 2]" 1
414 1 25 SER HB2 1 26 PHE H . . 4.390 3.945 2.848 4.459 0.069 16 0 "[ . 1 . 2]" 1
415 1 25 SER HB3 1 26 PHE H . . 4.320 4.296 3.682 4.460 0.140 1 0 "[ . 1 . 2]" 1
416 1 26 PHE H 1 26 PHE HB3 . . 3.670 3.641 2.596 3.898 0.228 20 0 "[ . 1 . 2]" 1
417 1 26 PHE H 1 27 ILE H . . 5.420 4.272 3.910 4.588 . 0 0 "[ . 1 . 2]" 1
418 1 26 PHE HA 1 27 ILE H . . 3.310 2.278 2.063 2.600 . 0 0 "[ . 1 . 2]" 1
419 1 26 PHE HA 1 27 ILE HA . . 4.890 4.445 4.287 4.595 . 0 0 "[ . 1 . 2]" 1
420 1 26 PHE HA 1 27 ILE HB . . 5.070 4.602 4.195 4.853 . 0 0 "[ . 1 . 2]" 1
421 1 26 PHE HA 1 27 ILE HG12 . . 4.320 3.744 3.079 4.749 0.429 3 0 "[ . 1 . 2]" 1
422 1 26 PHE HA 1 27 ILE HG13 . . 5.500 5.026 3.307 5.579 0.079 17 0 "[ . 1 . 2]" 1
423 1 26 PHE HA 1 81 VAL QG . . 5.320 3.327 2.315 4.497 . 0 0 "[ . 1 . 2]" 1
424 1 26 PHE HA 1 84 GLY H . . 5.050 4.766 3.018 5.135 0.085 3 0 "[ . 1 . 2]" 1
425 1 26 PHE HB2 1 27 ILE H . . 4.420 3.923 2.142 4.617 0.197 2 0 "[ . 1 . 2]" 1
426 1 26 PHE HB2 1 81 VAL QG . . 3.970 3.311 1.983 4.100 0.130 14 0 "[ . 1 . 2]" 1
427 1 26 PHE HB3 1 27 ILE H . . 4.900 3.348 2.367 3.917 . 0 0 "[ . 1 . 2]" 1
428 1 26 PHE HB3 1 81 VAL QG . . 4.340 2.452 1.996 3.834 . 0 0 "[ . 1 . 2]" 1
429 1 26 PHE QD 1 27 ILE H . . 4.610 3.954 2.841 4.678 0.068 3 0 "[ . 1 . 2]" 1
430 1 26 PHE QD 1 81 VAL QG . . 3.640 2.513 2.010 3.652 0.012 10 0 "[ . 1 . 2]" 1
431 1 27 ILE H 1 27 ILE HB . . 3.610 2.470 2.101 2.632 . 0 0 "[ . 1 . 2]" 1
432 1 27 ILE H 1 27 ILE MD . . 4.570 3.403 2.843 3.890 . 0 0 "[ . 1 . 2]" 1
433 1 27 ILE H 1 27 ILE HG12 . . 4.410 2.508 1.994 3.438 . 0 0 "[ . 1 . 2]" 1
434 1 27 ILE H 1 27 ILE HG13 . . 4.590 3.530 2.169 4.204 . 0 0 "[ . 1 . 2]" 1
435 1 27 ILE H 1 27 ILE MG . . 4.570 3.785 3.634 3.860 . 0 0 "[ . 1 . 2]" 1
436 1 27 ILE H 1 28 LYS H . . 5.500 4.223 3.782 4.690 . 0 0 "[ . 1 . 2]" 1
437 1 27 ILE H 1 81 VAL HA . . 5.500 4.976 4.361 5.574 0.074 18 0 "[ . 1 . 2]" 1
438 1 27 ILE H 1 81 VAL QG . . 5.500 2.705 1.810 3.728 . 0 0 "[ . 1 . 2]" 1
439 1 27 ILE H 1 82 VAL H . . 5.310 3.493 2.757 4.176 . 0 0 "[ . 1 . 2]" 1
440 1 27 ILE H 1 82 VAL QG . . 5.500 3.950 3.558 4.462 . 0 0 "[ . 1 . 2]" 1
441 1 27 ILE HA 1 27 ILE HG12 . . 3.970 3.140 2.409 3.482 . 0 0 "[ . 1 . 2]" 1
442 1 27 ILE HA 1 27 ILE HG13 . . 3.950 3.721 3.134 3.888 . 0 0 "[ . 1 . 2]" 1
443 1 27 ILE HA 1 27 ILE MG . . 3.650 2.453 2.320 2.769 . 0 0 "[ . 1 . 2]" 1
444 1 27 ILE HA 1 28 LYS H . . 2.970 2.279 2.049 2.441 . 0 0 "[ . 1 . 2]" 1
445 1 27 ILE HA 1 28 LYS QD . . 5.150 4.525 3.395 5.266 0.116 8 0 "[ . 1 . 2]" 1
446 1 27 ILE HA 1 56 ASP HB3 . . 5.160 3.341 2.189 4.915 . 0 0 "[ . 1 . 2]" 1
447 1 27 ILE HA 1 82 VAL H . . 5.500 5.034 4.701 5.577 0.077 10 0 "[ . 1 . 2]" 1
448 1 27 ILE HB 1 28 LYS H . . 5.110 4.468 4.024 4.689 . 0 0 "[ . 1 . 2]" 1
449 1 27 ILE HB 1 28 LYS HA . . 5.230 4.853 4.505 5.304 0.074 2 0 "[ . 1 . 2]" 1
450 1 27 ILE HB 1 81 VAL QG . . 5.360 3.488 3.010 4.443 . 0 0 "[ . 1 . 2]" 1
451 1 27 ILE HB 1 82 VAL H . . 4.380 2.870 2.460 3.353 . 0 0 "[ . 1 . 2]" 1
452 1 27 ILE HB 1 82 VAL HA . . 5.430 4.930 4.404 5.506 0.076 18 0 "[ . 1 . 2]" 1
453 1 27 ILE HB 1 82 VAL HB . . 4.550 4.448 2.103 4.628 0.078 10 0 "[ . 1 . 2]" 1
454 1 27 ILE HB 1 82 VAL QG . . 3.500 2.213 1.944 3.130 . 0 0 "[ . 1 . 2]" 1
455 1 27 ILE MD 1 56 ASP HB2 . . 5.320 3.541 2.244 5.172 . 0 0 "[ . 1 . 2]" 1
456 1 27 ILE MD 1 56 ASP HB3 . . 5.110 3.731 2.684 5.061 . 0 0 "[ . 1 . 2]" 1
457 1 27 ILE MD 1 82 VAL H . . 5.460 5.369 4.852 5.569 0.109 8 0 "[ . 1 . 2]" 1
458 1 27 ILE MD 1 84 GLY HA2 . . 5.210 3.622 2.056 4.555 . 0 0 "[ . 1 . 2]" 1
459 1 27 ILE MD 1 85 GLU H . . 5.500 4.381 3.001 5.582 0.082 4 0 "[ . 1 . 2]" 1
460 1 27 ILE HG12 1 81 VAL QG . . 5.240 4.512 3.745 5.414 0.174 10 0 "[ . 1 . 2]" 1
461 1 27 ILE HG12 1 82 VAL QG . . 4.680 3.801 2.983 4.462 . 0 0 "[ . 1 . 2]" 1
462 1 27 ILE HG12 1 84 GLY HA2 . . 4.560 3.891 3.111 4.856 0.296 18 0 "[ . 1 . 2]" 1
463 1 27 ILE HG12 1 84 GLY HA3 . . 4.440 2.785 2.188 4.184 . 0 0 "[ . 1 . 2]" 1
464 1 27 ILE HG13 1 84 GLY HA2 . . 4.420 2.970 2.167 3.713 . 0 0 "[ . 1 . 2]" 1
465 1 27 ILE HG13 1 84 GLY HA3 . . 5.050 2.307 2.034 2.716 . 0 0 "[ . 1 . 2]" 1
466 1 27 ILE MG 1 28 LYS H . . 4.510 3.469 2.406 4.116 . 0 0 "[ . 1 . 2]" 1
467 1 27 ILE MG 1 56 ASP H . . 5.500 4.462 3.686 5.601 0.101 5 0 "[ . 1 . 2]" 1
468 1 27 ILE MG 1 56 ASP HB2 . . 4.860 3.313 2.144 4.801 . 0 0 "[ . 1 . 2]" 1
469 1 27 ILE MG 1 56 ASP HB3 . . 4.790 3.023 2.172 4.443 . 0 0 "[ . 1 . 2]" 1
470 1 27 ILE MG 1 81 VAL HA . . 5.290 4.841 3.840 5.381 0.091 2 0 "[ . 1 . 2]" 1
471 1 27 ILE MG 1 82 VAL HB . . 5.500 4.430 2.604 4.997 . 0 0 "[ . 1 . 2]" 1
472 1 27 ILE MG 1 84 GLY HA2 . . 4.420 4.193 3.117 4.515 0.095 17 0 "[ . 1 . 2]" 1
473 1 27 ILE MG 1 84 GLY HA3 . . 3.980 4.122 3.785 4.499 0.519 9 2 "[ .- +1 . 2]" 1
474 1 28 LYS H 1 28 LYS QD . . 4.230 3.296 2.258 4.314 0.084 2 0 "[ . 1 . 2]" 1
475 1 28 LYS H 1 56 ASP H . . 5.090 4.552 3.771 5.069 . 0 0 "[ . 1 . 2]" 1
476 1 28 LYS H 1 56 ASP HA . . 4.830 3.049 2.425 3.489 . 0 0 "[ . 1 . 2]" 1
477 1 28 LYS H 1 56 ASP HB3 . . 5.410 3.480 2.259 4.678 . 0 0 "[ . 1 . 2]" 1
478 1 28 LYS H 1 59 LEU QD . . 5.440 3.981 2.414 5.090 . 0 0 "[ . 1 . 2]" 1
479 1 28 LYS HA 1 28 LYS QD . . 4.730 3.248 1.965 4.478 . 0 0 "[ . 1 . 2]" 1
480 1 28 LYS HA 1 29 SER H . . 3.180 2.466 2.060 2.982 . 0 0 "[ . 1 . 2]" 1
481 1 28 LYS HA 1 56 ASP HA . . 5.140 5.146 4.773 5.226 0.086 1 0 "[ . 1 . 2]" 1
482 1 28 LYS HA 1 81 VAL QG . . 4.250 3.499 2.168 4.269 0.019 5 0 "[ . 1 . 2]" 1
483 1 28 LYS HB3 1 29 SER H . . 4.470 3.284 1.735 4.294 . 0 0 "[ . 1 . 2]" 1
484 1 28 LYS HB3 1 81 VAL QG . . 5.500 2.819 2.007 4.649 . 0 0 "[ . 1 . 2]" 1
485 1 28 LYS QD 1 29 SER H . . 5.200 4.024 2.593 5.261 0.061 20 0 "[ . 1 . 2]" 1
486 1 29 SER H 1 29 SER HB2 . . 3.730 2.945 2.387 3.812 0.082 5 0 "[ . 1 . 2]" 1
487 1 29 SER H 1 29 SER HB3 . . 3.820 3.683 2.899 3.888 0.068 6 0 "[ . 1 . 2]" 1
488 1 29 SER H 1 30 VAL QG . . 5.400 4.386 3.703 5.012 . 0 0 "[ . 1 . 2]" 1
489 1 29 SER H 1 59 LEU QD . . 5.500 4.044 2.766 5.074 . 0 0 "[ . 1 . 2]" 1
490 1 29 SER H 1 81 VAL QG . . 5.500 4.813 3.026 5.512 0.012 5 0 "[ . 1 . 2]" 1
491 1 29 SER HA 1 30 VAL H . . 2.750 2.419 2.106 2.595 . 0 0 "[ . 1 . 2]" 1
492 1 29 SER HA 1 30 VAL HB . . 4.630 4.552 4.199 4.709 0.079 7 0 "[ . 1 . 2]" 1
493 1 29 SER HA 1 30 VAL QG . . 4.950 3.654 3.050 4.160 . 0 0 "[ . 1 . 2]" 1
494 1 29 SER HA 1 54 LEU HB2 . . 4.680 4.419 3.932 4.755 0.075 17 0 "[ . 1 . 2]" 1
495 1 29 SER HA 1 59 LEU QD . . 4.310 2.903 2.069 4.011 . 0 0 "[ . 1 . 2]" 1
496 1 29 SER HB2 1 30 VAL HA . . 5.430 4.445 3.860 4.953 . 0 0 "[ . 1 . 2]" 1
497 1 29 SER HB2 1 30 VAL QG . . 5.500 4.720 4.326 5.237 . 0 0 "[ . 1 . 2]" 1
498 1 29 SER HB2 1 31 VAL QG . . 4.570 3.920 2.766 4.576 0.006 8 0 "[ . 1 . 2]" 1
499 1 29 SER HB3 1 30 VAL H . . 4.170 2.948 2.280 3.827 . 0 0 "[ . 1 . 2]" 1
500 1 29 SER HB3 1 31 VAL QG . . 4.690 4.326 3.387 4.726 0.036 9 0 "[ . 1 . 2]" 1
501 1 30 VAL H 1 30 VAL HB . . 3.740 2.751 2.443 3.010 . 0 0 "[ . 1 . 2]" 1
502 1 30 VAL H 1 30 VAL QG . . 4.000 2.837 1.995 3.201 . 0 0 "[ . 1 . 2]" 1
503 1 30 VAL H 1 31 VAL H . . 5.120 4.073 3.561 4.522 . 0 0 "[ . 1 . 2]" 1
504 1 30 VAL H 1 31 VAL QG . . 5.500 4.256 3.562 5.134 . 0 0 "[ . 1 . 2]" 1
505 1 30 VAL H 1 53 ILE MG . . 4.830 4.106 3.099 4.900 0.070 10 0 "[ . 1 . 2]" 1
506 1 30 VAL H 1 54 LEU H . . 3.970 3.561 2.831 4.039 0.069 14 0 "[ . 1 . 2]" 1
507 1 30 VAL H 1 54 LEU HB2 . . 4.150 2.921 2.305 3.366 . 0 0 "[ . 1 . 2]" 1
508 1 30 VAL H 1 54 LEU HB3 . . 4.840 4.161 3.605 4.787 . 0 0 "[ . 1 . 2]" 1
509 1 30 VAL H 1 54 LEU QD . . 5.100 4.253 3.718 4.717 . 0 0 "[ . 1 . 2]" 1
510 1 30 VAL H 1 55 SER HA . . 4.180 3.702 2.895 4.235 0.055 5 0 "[ . 1 . 2]" 1
511 1 30 VAL H 1 59 LEU QD . . 4.370 3.164 2.040 4.241 . 0 0 "[ . 1 . 2]" 1
512 1 30 VAL HA 1 31 VAL H . . 2.890 2.213 2.086 2.630 . 0 0 "[ . 1 . 2]" 1
513 1 30 VAL HA 1 59 LEU QD . . 5.400 3.992 3.459 4.793 . 0 0 "[ . 1 . 2]" 1
514 1 30 VAL HB 1 31 VAL H . . 5.030 4.329 3.848 4.560 . 0 0 "[ . 1 . 2]" 1
515 1 30 VAL HB 1 54 LEU H . . 4.420 3.859 2.581 4.456 0.036 18 0 "[ . 1 . 2]" 1
516 1 30 VAL HB 1 54 LEU HB2 . . 3.580 2.382 2.047 3.179 . 0 0 "[ . 1 . 2]" 1
517 1 30 VAL HB 1 54 LEU HB3 . . 4.490 3.826 3.332 4.571 0.081 4 0 "[ . 1 . 2]" 1
518 1 30 VAL HB 1 54 LEU QD . . 3.530 2.733 2.189 3.609 0.079 4 0 "[ . 1 . 2]" 1
519 1 30 VAL QG 1 31 VAL H . . 3.480 2.882 1.960 3.388 . 0 0 "[ . 1 . 2]" 1
520 1 30 VAL QG 1 32 VAL H . . 5.160 2.902 1.797 3.769 . 0 0 "[ . 1 . 2]" 1
521 1 30 VAL QG 1 32 VAL HA . . 4.320 4.160 3.788 4.375 0.055 7 0 "[ . 1 . 2]" 1
522 1 30 VAL QG 1 54 LEU H . . 5.100 3.785 1.997 4.424 . 0 0 "[ . 1 . 2]" 1
523 1 30 VAL QG 1 54 LEU HB2 . . 4.460 3.022 1.953 3.532 . 0 0 "[ . 1 . 2]" 1
524 1 30 VAL QG 1 54 LEU HB3 . . 5.500 3.996 3.335 4.433 . 0 0 "[ . 1 . 2]" 1
525 1 30 VAL QG 1 54 LEU HG . . 5.500 3.718 2.245 4.555 . 0 0 "[ . 1 . 2]" 1
526 1 30 VAL QG 1 59 LEU HA . . 4.820 4.328 3.674 4.773 . 0 0 "[ . 1 . 2]" 1
527 1 30 VAL QG 1 59 LEU QD . . 3.360 1.925 1.763 2.646 . 0 0 "[ . 1 . 2]" 1
528 1 31 VAL H 1 31 VAL HB . . 3.390 2.839 2.282 3.256 . 0 0 "[ . 1 . 2]" 1
529 1 31 VAL H 1 31 VAL QG . . 3.660 2.321 1.811 2.777 . 0 0 "[ . 1 . 2]" 1
530 1 31 VAL H 1 32 VAL H . . 4.310 3.748 2.303 4.385 0.075 19 0 "[ . 1 . 2]" 1
531 1 31 VAL HA 1 31 VAL QG . . 3.120 2.260 2.113 2.520 . 0 0 "[ . 1 . 2]" 1
532 1 31 VAL HA 1 32 VAL H . . 2.860 2.368 2.070 2.937 0.077 6 0 "[ . 1 . 2]" 1
533 1 31 VAL HA 1 53 ILE QG . . 4.900 3.343 2.342 4.527 . 0 0 "[ . 1 . 2]" 1
534 1 31 VAL HA 1 53 ILE MG . . 5.220 2.736 2.151 3.626 . 0 0 "[ . 1 . 2]" 1
535 1 31 VAL HA 1 54 LEU H . . 4.340 3.808 3.070 4.426 0.086 4 0 "[ . 1 . 2]" 1
536 1 31 VAL HB 1 32 VAL HA . . 4.790 4.794 4.258 4.897 0.107 14 0 "[ . 1 . 2]" 1
537 1 31 VAL QG 1 76 ALA H . . 4.550 3.739 2.013 4.556 0.006 11 0 "[ . 1 . 2]" 1
538 1 31 VAL QG 1 76 ALA MB . . 3.540 2.525 1.924 3.557 0.017 5 0 "[ . 1 . 2]" 1
539 1 32 VAL H 1 32 VAL HB . . 3.400 3.143 2.591 3.495 0.095 17 0 "[ . 1 . 2]" 1
540 1 32 VAL H 1 32 VAL QG . . 3.170 2.629 2.132 3.140 . 0 0 "[ . 1 . 2]" 1
541 1 32 VAL H 1 33 VAL H . . 5.290 3.756 3.461 4.141 . 0 0 "[ . 1 . 2]" 1
542 1 32 VAL H 1 33 VAL HA . . 5.410 4.959 4.426 5.459 0.049 18 0 "[ . 1 . 2]" 1
543 1 32 VAL H 1 54 LEU H . . 5.440 4.114 3.297 5.266 . 0 0 "[ . 1 . 2]" 1
544 1 32 VAL HA 1 32 VAL QG . . 3.250 2.306 2.081 2.621 . 0 0 "[ . 1 . 2]" 1
545 1 32 VAL HA 1 33 VAL H . . 2.910 2.264 2.154 2.434 . 0 0 "[ . 1 . 2]" 1
546 1 32 VAL HB 1 33 VAL H . . 5.430 4.503 4.179 4.666 . 0 0 "[ . 1 . 2]" 1
547 1 32 VAL QG 1 33 VAL H . . 3.880 3.321 2.714 3.675 . 0 0 "[ . 1 . 2]" 1
548 1 32 VAL QG 1 33 VAL HA . . 5.050 3.326 2.888 3.778 . 0 0 "[ . 1 . 2]" 1
549 1 32 VAL QG 1 39 LEU QD . . 3.650 2.692 2.178 3.483 . 0 0 "[ . 1 . 2]" 1
550 1 32 VAL QG 1 39 LEU HG . . 4.930 4.425 3.112 4.964 0.034 10 0 "[ . 1 . 2]" 1
551 1 32 VAL QG 1 75 PHE HA . . 5.420 4.834 3.502 5.366 . 0 0 "[ . 1 . 2]" 1
552 1 32 VAL QG 1 76 ALA H . . 5.360 4.182 2.881 5.080 . 0 0 "[ . 1 . 2]" 1
553 1 33 VAL H 1 33 VAL HB . . 4.110 3.400 3.188 3.950 . 0 0 "[ . 1 . 2]" 1
554 1 33 VAL H 1 33 VAL QG . . 3.220 2.653 2.378 2.846 . 0 0 "[ . 1 . 2]" 1
555 1 33 VAL H 1 75 PHE HA . . 5.310 3.674 2.972 4.247 . 0 0 "[ . 1 . 2]" 1
556 1 33 VAL H 1 76 ALA H . . 4.390 4.292 3.360 4.474 0.084 10 0 "[ . 1 . 2]" 1
557 1 33 VAL HA 1 33 VAL QG . . 3.190 2.201 2.141 2.491 . 0 0 "[ . 1 . 2]" 1
558 1 33 VAL HA 1 34 ALA H . . 2.840 2.603 2.308 2.893 0.053 13 0 "[ . 1 . 2]" 1
559 1 33 VAL HA 1 34 ALA HA . . 5.090 4.522 4.310 4.670 . 0 0 "[ . 1 . 2]" 1
560 1 33 VAL HA 1 34 ALA MB . . 4.720 4.135 3.945 4.277 . 0 0 "[ . 1 . 2]" 1
561 1 33 VAL HA 1 39 LEU QD . . 4.330 2.091 1.915 2.377 . 0 0 "[ . 1 . 2]" 1
562 1 33 VAL HB 1 34 ALA H . . 5.190 3.752 3.013 3.924 . 0 0 "[ . 1 . 2]" 1
563 1 33 VAL QG 1 34 ALA H . . 3.840 1.852 1.600 3.403 . 0 0 "[ . 1 . 2]" 1
564 1 33 VAL QG 1 34 ALA HA . . 4.680 3.568 3.031 4.017 . 0 0 "[ . 1 . 2]" 1
565 1 33 VAL QG 1 35 ASN H . . 4.510 3.965 3.183 4.263 . 0 0 "[ . 1 . 2]" 1
566 1 33 VAL QG 1 35 ASN QB . . 4.870 4.377 3.786 4.597 . 0 0 "[ . 1 . 2]" 1
567 1 33 VAL QG 1 35 ASN QD . . 4.820 3.163 2.566 3.823 . 0 0 "[ . 1 . 2]" 1
568 1 33 VAL QG 1 51 PRO HA . . 4.050 1.989 1.804 2.279 . 0 0 "[ . 1 . 2]" 1
569 1 33 VAL QG 1 51 PRO HB2 . . 3.410 2.404 2.103 2.720 . 0 0 "[ . 1 . 2]" 1
570 1 33 VAL QG 1 51 PRO QD . . 5.330 4.065 3.799 4.239 . 0 0 "[ . 1 . 2]" 1
571 1 33 VAL QG 1 51 PRO HG2 . . 4.580 4.189 3.947 4.376 . 0 0 "[ . 1 . 2]" 1
572 1 34 ALA H 1 34 ALA MB . . 3.590 2.317 2.168 2.713 . 0 0 "[ . 1 . 2]" 1
573 1 34 ALA H 1 35 ASN H . . 4.780 4.367 3.994 4.524 . 0 0 "[ . 1 . 2]" 1
574 1 34 ALA H 1 39 LEU H . . 5.380 5.439 5.315 5.464 0.084 18 0 "[ . 1 . 2]" 1
575 1 34 ALA H 1 39 LEU QD . . 4.210 2.357 1.832 2.701 . 0 0 "[ . 1 . 2]" 1
576 1 34 ALA H 1 51 PRO HA . . 4.340 4.210 3.761 4.432 0.092 3 0 "[ . 1 . 2]" 1
577 1 34 ALA HA 1 35 ASN H . . 2.910 2.202 2.102 2.441 . 0 0 "[ . 1 . 2]" 1
578 1 34 ALA HA 1 35 ASN QB . . 4.710 4.031 3.909 4.135 . 0 0 "[ . 1 . 2]" 1
579 1 34 ALA HA 1 72 ALA MB . . 3.850 2.573 2.121 3.688 . 0 0 "[ . 1 . 2]" 1
580 1 34 ALA HA 1 73 ILE H . . 4.980 3.620 3.177 4.045 . 0 0 "[ . 1 . 2]" 1
581 1 34 ALA HA 1 74 GLU H . . 5.360 3.582 3.126 3.831 . 0 0 "[ . 1 . 2]" 1
582 1 34 ALA MB 1 35 ASN H . . 4.010 2.984 2.194 3.433 . 0 0 "[ . 1 . 2]" 1
583 1 34 ALA MB 1 36 GLY HA3 . . 4.170 4.137 3.838 4.274 0.104 13 0 "[ . 1 . 2]" 1
584 1 34 ALA MB 1 37 THR H . . 4.480 2.488 1.887 3.364 . 0 0 "[ . 1 . 2]" 1
585 1 34 ALA MB 1 37 THR HB . . 5.500 3.890 3.499 4.494 . 0 0 "[ . 1 . 2]" 1
586 1 34 ALA MB 1 37 THR MG . . 3.310 2.031 1.865 2.445 . 0 0 "[ . 1 . 2]" 1
587 1 34 ALA MB 1 38 GLN H . . 5.500 4.427 3.880 5.483 . 0 0 "[ . 1 . 2]" 1
588 1 34 ALA MB 1 39 LEU QD . . 3.320 2.497 2.132 2.882 . 0 0 "[ . 1 . 2]" 1
589 1 34 ALA MB 1 72 ALA H . . 5.500 4.091 3.709 4.413 . 0 0 "[ . 1 . 2]" 1
590 1 34 ALA MB 1 72 ALA HA . . 5.310 2.099 1.963 2.316 . 0 0 "[ . 1 . 2]" 1
591 1 34 ALA MB 1 72 ALA MB . . 3.450 2.183 2.006 2.345 . 0 0 "[ . 1 . 2]" 1
592 1 34 ALA MB 1 73 ILE QG . . 4.030 3.783 3.396 4.011 . 0 0 "[ . 1 . 2]" 1
593 1 35 ASN H 1 35 ASN QB . . 3.290 2.130 2.007 2.292 . 0 0 "[ . 1 . 2]" 1
594 1 35 ASN H 1 35 ASN QD . . 5.500 3.414 2.367 3.852 . 0 0 "[ . 1 . 2]" 1
595 1 35 ASN H 1 36 GLY H . . 5.050 3.024 2.717 3.467 . 0 0 "[ . 1 . 2]" 1
596 1 35 ASN H 1 37 THR H . . 4.690 4.702 4.339 4.768 0.078 15 0 "[ . 1 . 2]" 1
597 1 35 ASN H 1 72 ALA MB . . 4.020 3.555 2.932 4.058 0.038 13 0 "[ . 1 . 2]" 1
598 1 35 ASN H 1 73 ILE H . . 5.040 2.786 2.301 3.474 . 0 0 "[ . 1 . 2]" 1
599 1 35 ASN H 1 74 GLU H . . 3.850 2.408 2.023 2.713 . 0 0 "[ . 1 . 2]" 1
600 1 35 ASN H 1 74 GLU QB . . 4.610 3.581 3.213 3.886 . 0 0 "[ . 1 . 2]" 1
601 1 35 ASN H 1 74 GLU QG . . 5.390 4.088 2.286 4.608 . 0 0 "[ . 1 . 2]" 1
602 1 35 ASN HA 1 36 GLY H . . 2.970 2.973 2.592 3.053 0.083 19 0 "[ . 1 . 2]" 1
603 1 35 ASN HA 1 36 GLY HA2 . . 4.400 4.434 4.221 4.488 0.088 13 0 "[ . 1 . 2]" 1
604 1 35 ASN HA 1 74 GLU QB . . 5.160 4.777 4.475 5.065 . 0 0 "[ . 1 . 2]" 1
605 1 35 ASN QB 1 36 GLY H . . 4.450 3.787 3.659 3.923 . 0 0 "[ . 1 . 2]" 1
606 1 35 ASN QB 1 72 ALA MB . . 5.500 4.762 4.282 5.269 . 0 0 "[ . 1 . 2]" 1
607 1 35 ASN QB 1 73 ILE H . . 4.440 3.586 3.318 3.927 . 0 0 "[ . 1 . 2]" 1
608 1 35 ASN QB 1 73 ILE HB . . 4.230 2.218 2.047 2.808 . 0 0 "[ . 1 . 2]" 1
609 1 35 ASN QB 1 73 ILE QG . . 4.390 3.166 2.603 3.603 . 0 0 "[ . 1 . 2]" 1
610 1 35 ASN QB 1 73 ILE MG . . 4.280 3.170 2.602 3.694 . 0 0 "[ . 1 . 2]" 1
611 1 35 ASN QB 1 74 GLU H . . 3.700 2.438 2.017 2.979 . 0 0 "[ . 1 . 2]" 1
612 1 35 ASN QB 1 74 GLU QB . . 3.820 2.294 2.083 2.573 . 0 0 "[ . 1 . 2]" 1
613 1 35 ASN QB 1 74 GLU QG . . 5.300 2.452 1.869 2.833 . 0 0 "[ . 1 . 2]" 1
614 1 35 ASN QD 1 53 ILE MD . . 4.300 4.097 3.847 4.244 . 0 0 "[ . 1 . 2]" 1
615 1 35 ASN QD 1 74 GLU H . . 5.500 4.288 3.561 5.156 . 0 0 "[ . 1 . 2]" 1
616 1 35 ASN QD 1 74 GLU QB . . 4.380 2.875 2.075 3.592 . 0 0 "[ . 1 . 2]" 1
617 1 35 ASN QD 1 74 GLU QG . . 4.800 3.416 1.911 4.098 . 0 0 "[ . 1 . 2]" 1
618 1 36 GLY H 1 37 THR H . . 3.260 2.432 1.850 2.837 . 0 0 "[ . 1 . 2]" 1
619 1 36 GLY H 1 73 ILE H . . 4.780 3.776 3.415 4.182 . 0 0 "[ . 1 . 2]" 1
620 1 36 GLY H 1 73 ILE HB . . 5.170 4.554 4.429 4.714 . 0 0 "[ . 1 . 2]" 1
621 1 36 GLY H 1 73 ILE MG . . 5.480 5.560 5.479 5.592 0.112 2 0 "[ . 1 . 2]" 1
622 1 36 GLY HA2 1 73 ILE QG . . 5.450 3.514 2.978 3.910 . 0 0 "[ . 1 . 2]" 1
623 1 36 GLY HA2 1 73 ILE MG . . 5.500 5.472 5.146 5.605 0.105 18 0 "[ . 1 . 2]" 1
624 1 36 GLY HA3 1 72 ALA HA . . 4.720 4.625 3.752 4.801 0.081 16 0 "[ . 1 . 2]" 1
625 1 36 GLY HA3 1 73 ILE QG . . 5.500 2.286 1.997 2.617 . 0 0 "[ . 1 . 2]" 1
626 1 37 THR H 1 37 THR HB . . 3.990 2.621 2.234 3.351 . 0 0 "[ . 1 . 2]" 1
627 1 37 THR H 1 37 THR MG . . 3.340 2.382 2.172 2.873 . 0 0 "[ . 1 . 2]" 1
628 1 37 THR H 1 38 GLN H . . 4.780 4.480 4.184 4.664 . 0 0 "[ . 1 . 2]" 1
629 1 37 THR H 1 72 ALA MB . . 5.150 4.722 4.032 5.230 0.080 13 0 "[ . 1 . 2]" 1
630 1 37 THR HA 1 38 GLN H . . 3.220 2.616 2.500 2.817 . 0 0 "[ . 1 . 2]" 1
631 1 37 THR HB 1 38 GLN H . . 4.050 3.761 3.558 3.895 . 0 0 "[ . 1 . 2]" 1
632 1 37 THR HB 1 71 LYS HB2 . . 4.650 4.221 3.908 4.729 0.079 9 0 "[ . 1 . 2]" 1
633 1 37 THR HB 1 72 ALA HA . . 4.500 4.304 3.805 4.576 0.076 8 0 "[ . 1 . 2]" 1
634 1 37 THR MG 1 38 GLN H . . 3.760 2.805 2.384 3.109 . 0 0 "[ . 1 . 2]" 1
635 1 37 THR MG 1 39 LEU QD . . 3.970 3.471 2.932 3.888 . 0 0 "[ . 1 . 2]" 1
636 1 37 THR MG 1 68 THR H . . 5.500 5.289 4.933 5.601 0.101 6 0 "[ . 1 . 2]" 1
637 1 37 THR MG 1 68 THR HB . . 3.200 2.500 2.125 2.976 . 0 0 "[ . 1 . 2]" 1
638 1 37 THR MG 1 68 THR MG . . 3.630 2.707 2.080 3.410 . 0 0 "[ . 1 . 2]" 1
639 1 37 THR MG 1 69 THR H . . 4.090 2.935 2.472 3.224 . 0 0 "[ . 1 . 2]" 1
640 1 37 THR MG 1 70 GLY H . . 4.080 2.322 1.973 2.718 . 0 0 "[ . 1 . 2]" 1
641 1 37 THR MG 1 70 GLY QA . . 5.460 3.134 2.710 3.487 . 0 0 "[ . 1 . 2]" 1
642 1 37 THR MG 1 71 LYS H . . 5.500 2.766 2.090 3.493 . 0 0 "[ . 1 . 2]" 1
643 1 37 THR MG 1 71 LYS HA . . 4.690 3.535 3.223 3.877 . 0 0 "[ . 1 . 2]" 1
644 1 37 THR MG 1 72 ALA H . . 4.750 3.507 3.131 4.009 . 0 0 "[ . 1 . 2]" 1
645 1 37 THR MG 1 72 ALA HA . . 3.500 2.576 2.153 2.935 . 0 0 "[ . 1 . 2]" 1
646 1 37 THR MG 1 72 ALA MB . . 3.450 3.180 2.734 3.546 0.096 13 0 "[ . 1 . 2]" 1
647 1 38 GLN H 1 38 GLN QB . . 3.530 2.250 2.131 2.403 . 0 0 "[ . 1 . 2]" 1
648 1 38 GLN H 1 38 GLN HG2 . . 4.700 4.260 4.036 4.668 . 0 0 "[ . 1 . 2]" 1
649 1 38 GLN H 1 38 GLN HG3 . . 4.180 3.167 2.887 3.965 . 0 0 "[ . 1 . 2]" 1
650 1 38 GLN H 1 39 LEU H . . 4.660 4.490 4.366 4.579 . 0 0 "[ . 1 . 2]" 1
651 1 38 GLN H 1 39 LEU QD . . 5.460 5.216 4.833 5.413 . 0 0 "[ . 1 . 2]" 1
652 1 38 GLN H 1 69 THR H . . 4.460 3.998 3.582 4.500 0.040 2 0 "[ . 1 . 2]" 1
653 1 38 GLN H 1 69 THR MG . . 4.800 4.132 3.852 4.524 . 0 0 "[ . 1 . 2]" 1
654 1 38 GLN H 1 70 GLY H . . 4.280 3.849 3.286 4.352 0.072 15 0 "[ . 1 . 2]" 1
655 1 38 GLN HA 1 38 GLN HG2 . . 3.580 2.714 2.300 3.399 . 0 0 "[ . 1 . 2]" 1
656 1 38 GLN HA 1 38 GLN HG3 . . 3.600 2.466 2.067 2.794 . 0 0 "[ . 1 . 2]" 1
657 1 38 GLN HA 1 39 LEU H . . 3.220 2.295 2.177 2.471 . 0 0 "[ . 1 . 2]" 1
658 1 38 GLN HA 1 39 LEU HB2 . . 5.370 4.053 3.618 4.278 . 0 0 "[ . 1 . 2]" 1
659 1 38 GLN HA 1 39 LEU QD . . 4.460 4.259 3.776 4.457 . 0 0 "[ . 1 . 2]" 1
660 1 38 GLN HA 1 49 ALA HA . . 4.510 3.898 3.374 4.553 0.043 7 0 "[ . 1 . 2]" 1
661 1 38 GLN QB 1 39 LEU H . . 3.180 2.506 2.152 2.878 . 0 0 "[ . 1 . 2]" 1
662 1 38 GLN QB 1 39 LEU HA . . 4.920 4.194 3.910 4.584 . 0 0 "[ . 1 . 2]" 1
663 1 38 GLN QB 1 39 LEU QD . . 5.500 4.826 4.499 5.097 . 0 0 "[ . 1 . 2]" 1
664 1 38 GLN QB 1 47 SER QB . . 4.110 3.163 2.704 3.805 . 0 0 "[ . 1 . 2]" 1
665 1 38 GLN QB 1 48 LEU H . . 4.270 3.221 2.526 3.924 . 0 0 "[ . 1 . 2]" 1
666 1 38 GLN QB 1 49 ALA HA . . 4.400 4.047 3.815 4.342 . 0 0 "[ . 1 . 2]" 1
667 1 38 GLN QB 1 49 ALA MB . . 5.500 5.172 4.939 5.429 . 0 0 "[ . 1 . 2]" 1
668 1 38 GLN QB 1 69 THR H . . 5.330 4.140 3.899 4.519 . 0 0 "[ . 1 . 2]" 1
669 1 38 GLN QB 1 69 THR HB . . 5.140 4.135 3.714 4.583 . 0 0 "[ . 1 . 2]" 1
670 1 38 GLN QB 1 69 THR MG . . 3.590 2.799 2.411 3.046 . 0 0 "[ . 1 . 2]" 1
671 1 38 GLN HE21 1 47 SER QB . . 5.410 4.196 2.597 5.291 . 0 0 "[ . 1 . 2]" 1
672 1 38 GLN HE21 1 49 ALA H . . 5.500 4.796 3.330 5.579 0.079 19 0 "[ . 1 . 2]" 1
673 1 38 GLN HE21 1 49 ALA HA . . 4.810 3.316 2.498 4.192 . 0 0 "[ . 1 . 2]" 1
674 1 38 GLN HE21 1 49 ALA MB . . 4.670 4.055 3.241 4.745 0.075 19 0 "[ . 1 . 2]" 1
675 1 38 GLN HE22 1 49 ALA MB . . 5.270 5.097 4.448 5.375 0.105 18 0 "[ . 1 . 2]" 1
676 1 38 GLN HG2 1 39 LEU H . . 4.220 3.664 3.357 4.010 . 0 0 "[ . 1 . 2]" 1
677 1 38 GLN HG2 1 48 LEU H . . 5.150 4.544 3.755 5.224 0.074 7 0 "[ . 1 . 2]" 1
678 1 38 GLN HG2 1 49 ALA HA . . 3.780 2.398 2.147 2.840 . 0 0 "[ . 1 . 2]" 1
679 1 38 GLN HG2 1 49 ALA MB . . 4.730 3.924 3.479 4.247 . 0 0 "[ . 1 . 2]" 1
680 1 38 GLN HG2 1 50 SER H . . 5.030 3.965 2.847 5.079 0.049 18 0 "[ . 1 . 2]" 1
681 1 38 GLN HG2 1 69 THR MG . . 5.500 5.092 4.662 5.517 0.017 8 0 "[ . 1 . 2]" 1
682 1 38 GLN HG3 1 39 LEU H . . 4.280 4.238 3.471 4.372 0.092 10 0 "[ . 1 . 2]" 1
683 1 38 GLN HG3 1 49 ALA HA . . 3.970 3.405 2.055 4.046 0.076 16 0 "[ . 1 . 2]" 1
684 1 38 GLN HG3 1 49 ALA MB . . 5.320 4.737 3.735 5.342 0.022 16 0 "[ . 1 . 2]" 1
685 1 38 GLN HG3 1 50 SER H . . 4.930 4.220 3.209 5.005 0.075 3 0 "[ . 1 . 2]" 1
686 1 38 GLN HG3 1 69 THR MG . . 5.300 5.273 4.858 5.406 0.106 11 0 "[ . 1 . 2]" 1
687 1 39 LEU H 1 39 LEU HB2 . . 3.590 2.473 2.150 2.738 . 0 0 "[ . 1 . 2]" 1
688 1 39 LEU H 1 39 LEU HB3 . . 4.110 3.224 3.065 3.394 . 0 0 "[ . 1 . 2]" 1
689 1 39 LEU H 1 39 LEU QD . . 4.040 3.584 3.286 3.868 . 0 0 "[ . 1 . 2]" 1
690 1 39 LEU H 1 39 LEU HG . . 4.710 4.506 4.321 4.699 . 0 0 "[ . 1 . 2]" 1
691 1 39 LEU H 1 48 LEU H . . 3.930 3.207 2.809 3.978 0.048 7 0 "[ . 1 . 2]" 1
692 1 39 LEU H 1 48 LEU QB . . 4.140 3.473 2.889 4.229 0.089 20 0 "[ . 1 . 2]" 1
693 1 39 LEU H 1 49 ALA HA . . 5.280 4.471 4.078 4.734 . 0 0 "[ . 1 . 2]" 1
694 1 39 LEU H 1 49 ALA MB . . 5.500 5.480 5.263 5.615 0.115 20 0 "[ . 1 . 2]" 1
695 1 39 LEU H 1 69 THR MG . . 4.690 3.937 3.564 4.348 . 0 0 "[ . 1 . 2]" 1
696 1 39 LEU HA 1 39 LEU QD . . 3.200 2.368 1.932 2.815 . 0 0 "[ . 1 . 2]" 1
697 1 39 LEU HA 1 39 LEU HG . . 3.940 2.771 2.009 3.681 . 0 0 "[ . 1 . 2]" 1
698 1 39 LEU HA 1 40 LYS H . . 3.080 2.410 2.173 2.544 . 0 0 "[ . 1 . 2]" 1
699 1 39 LEU HA 1 67 SER H . . 5.290 4.724 4.503 5.049 . 0 0 "[ . 1 . 2]" 1
700 1 39 LEU HA 1 69 THR H . . 4.020 3.115 2.609 4.057 0.037 7 0 "[ . 1 . 2]" 1
701 1 39 LEU HA 1 69 THR MG . . 4.200 3.047 2.572 3.709 . 0 0 "[ . 1 . 2]" 1
702 1 39 LEU HB2 1 39 LEU QD . . 2.970 2.255 2.060 2.519 . 0 0 "[ . 1 . 2]" 1
703 1 39 LEU HB2 1 40 LYS H . . 4.420 4.043 3.807 4.449 0.029 5 0 "[ . 1 . 2]" 1
704 1 39 LEU HB3 1 40 LYS H . . 4.080 2.899 2.478 3.506 . 0 0 "[ . 1 . 2]" 1
705 1 39 LEU HB3 1 48 LEU H . . 4.990 4.245 3.852 4.610 . 0 0 "[ . 1 . 2]" 1
706 1 39 LEU HB3 1 67 SER H . . 5.130 4.876 4.277 5.201 0.071 5 0 "[ . 1 . 2]" 1
707 1 39 LEU QD 1 40 LYS H . . 3.950 2.227 1.698 2.689 . 0 0 "[ . 1 . 2]" 1
708 1 39 LEU QD 1 40 LYS HA . . 4.500 4.350 4.095 4.473 . 0 0 "[ . 1 . 2]" 1
709 1 39 LEU QD 1 41 ASP HA . . 4.830 4.305 3.648 4.817 . 0 0 "[ . 1 . 2]" 1
710 1 39 LEU QD 1 67 SER H . . 3.960 2.521 2.143 2.740 . 0 0 "[ . 1 . 2]" 1
711 1 39 LEU QD 1 67 SER HA . . 4.510 3.352 3.125 3.651 . 0 0 "[ . 1 . 2]" 1
712 1 39 LEU QD 1 67 SER QB . . 4.820 4.160 3.777 4.332 . 0 0 "[ . 1 . 2]" 1
713 1 39 LEU QD 1 68 THR H . . 4.290 3.733 3.331 3.955 . 0 0 "[ . 1 . 2]" 1
714 1 39 LEU QD 1 68 THR HA . . 3.400 2.675 2.234 3.084 . 0 0 "[ . 1 . 2]" 1
715 1 39 LEU QD 1 68 THR HB . . 5.500 4.011 3.497 4.334 . 0 0 "[ . 1 . 2]" 1
716 1 39 LEU QD 1 68 THR MG . . 3.340 2.143 1.951 2.576 . 0 0 "[ . 1 . 2]" 1
717 1 39 LEU QD 1 69 THR H . . 4.780 4.013 3.685 4.371 . 0 0 "[ . 1 . 2]" 1
718 1 39 LEU HG 1 40 LYS H . . 5.090 3.361 2.167 4.773 . 0 0 "[ . 1 . 2]" 1
719 1 40 LYS H 1 40 LYS HB2 . . 3.320 3.025 2.824 3.319 . 0 0 "[ . 1 . 2]" 1
720 1 40 LYS H 1 40 LYS HB3 . . 3.430 2.581 2.397 2.716 . 0 0 "[ . 1 . 2]" 1
721 1 40 LYS H 1 40 LYS QD . . 5.500 4.956 4.607 5.114 . 0 0 "[ . 1 . 2]" 1
722 1 40 LYS H 1 40 LYS QE . . 5.080 4.559 4.114 5.186 0.106 16 0 "[ . 1 . 2]" 1
723 1 40 LYS H 1 40 LYS QG . . 5.010 4.015 3.876 4.094 . 0 0 "[ . 1 . 2]" 1
724 1 40 LYS H 1 41 ASP H . . 4.560 4.311 4.189 4.460 . 0 0 "[ . 1 . 2]" 1
725 1 40 LYS H 1 66 LEU HA . . 4.980 4.583 4.271 4.839 . 0 0 "[ . 1 . 2]" 1
726 1 40 LYS H 1 67 SER H . . 3.540 2.832 2.567 3.059 . 0 0 "[ . 1 . 2]" 1
727 1 40 LYS H 1 67 SER QB . . 4.900 4.409 4.237 4.626 . 0 0 "[ . 1 . 2]" 1
728 1 40 LYS H 1 68 THR HA . . 4.230 3.654 3.275 4.167 . 0 0 "[ . 1 . 2]" 1
729 1 40 LYS H 1 68 THR MG . . 5.500 4.824 4.416 5.376 . 0 0 "[ . 1 . 2]" 1
730 1 40 LYS H 1 69 THR H . . 4.800 4.616 4.096 4.873 0.073 7 0 "[ . 1 . 2]" 1
731 1 40 LYS H 1 69 THR MG . . 3.850 3.613 3.259 3.915 0.065 13 0 "[ . 1 . 2]" 1
732 1 40 LYS HA 1 40 LYS QD . . 4.630 4.124 3.766 4.315 . 0 0 "[ . 1 . 2]" 1
733 1 40 LYS HA 1 40 LYS QG . . 4.020 2.430 2.278 2.572 . 0 0 "[ . 1 . 2]" 1
734 1 40 LYS HA 1 41 ASP H . . 2.830 2.143 2.054 2.245 . 0 0 "[ . 1 . 2]" 1
735 1 40 LYS HA 1 41 ASP QB . . 4.870 4.025 3.705 4.206 . 0 0 "[ . 1 . 2]" 1
736 1 40 LYS HA 1 48 LEU QD . . 4.570 2.863 2.370 4.507 . 0 0 "[ . 1 . 2]" 1
737 1 40 LYS HB2 1 40 LYS QE . . 5.020 2.792 2.066 3.317 . 0 0 "[ . 1 . 2]" 1
738 1 40 LYS HB2 1 41 ASP H . . 4.370 4.200 3.879 4.294 . 0 0 "[ . 1 . 2]" 1
739 1 40 LYS HB2 1 67 SER H . . 5.170 4.578 4.223 4.776 . 0 0 "[ . 1 . 2]" 1
740 1 40 LYS HB2 1 69 THR MG . . 3.360 2.327 2.068 2.646 . 0 0 "[ . 1 . 2]" 1
741 1 40 LYS HB3 1 41 ASP HA . . 5.500 5.216 5.017 5.399 . 0 0 "[ . 1 . 2]" 1
742 1 40 LYS HB3 1 67 SER H . . 3.820 3.023 2.653 3.249 . 0 0 "[ . 1 . 2]" 1
743 1 40 LYS HB3 1 67 SER QB . . 4.800 3.113 2.795 3.358 . 0 0 "[ . 1 . 2]" 1
744 1 40 LYS HB3 1 69 THR HA . . 5.380 5.087 4.463 5.426 0.046 8 0 "[ . 1 . 2]" 1
745 1 40 LYS HB3 1 69 THR MG . . 3.800 3.596 3.296 3.894 0.094 16 0 "[ . 1 . 2]" 1
746 1 40 LYS QD 1 41 ASP H . . 4.590 4.622 4.256 4.684 0.094 1 0 "[ . 1 . 2]" 1
747 1 40 LYS QD 1 45 GLY HA2 . . 4.340 2.515 2.197 3.045 . 0 0 "[ . 1 . 2]" 1
748 1 40 LYS QD 1 45 GLY HA3 . . 4.810 2.946 2.547 3.500 . 0 0 "[ . 1 . 2]" 1
749 1 40 LYS QD 1 67 SER QB . . 4.950 4.055 2.785 4.853 . 0 0 "[ . 1 . 2]" 1
750 1 40 LYS QD 1 69 THR HA . . 5.080 4.712 3.983 5.153 0.073 13 0 "[ . 1 . 2]" 1
751 1 40 LYS QD 1 69 THR MG . . 4.090 3.560 3.043 4.156 0.066 13 0 "[ . 1 . 2]" 1
752 1 40 LYS QE 1 45 GLY H . . 5.500 5.002 4.182 5.577 0.077 7 0 "[ . 1 . 2]" 1
753 1 40 LYS QE 1 45 GLY HA2 . . 3.950 3.233 2.240 3.687 . 0 0 "[ . 1 . 2]" 1
754 1 40 LYS QE 1 45 GLY HA3 . . 4.320 3.977 3.111 4.406 0.086 11 0 "[ . 1 . 2]" 1
755 1 40 LYS QE 1 69 THR HA . . 5.180 4.844 3.275 5.262 0.082 2 0 "[ . 1 . 2]" 1
756 1 40 LYS QE 1 69 THR MG . . 4.510 3.705 2.205 4.624 0.114 4 0 "[ . 1 . 2]" 1
757 1 40 LYS QG 1 41 ASP H . . 3.910 2.593 2.153 2.766 . 0 0 "[ . 1 . 2]" 1
758 1 40 LYS QG 1 41 ASP HA . . 4.780 4.276 4.031 4.491 . 0 0 "[ . 1 . 2]" 1
759 1 40 LYS QG 1 45 GLY H . . 5.170 3.826 3.584 4.460 . 0 0 "[ . 1 . 2]" 1
760 1 40 LYS QG 1 45 GLY HA2 . . 4.690 2.212 2.027 2.475 . 0 0 "[ . 1 . 2]" 1
761 1 40 LYS QG 1 45 GLY HA3 . . 4.800 3.458 3.155 4.026 . 0 0 "[ . 1 . 2]" 1
762 1 40 LYS QG 1 46 GLU H . . 5.440 3.718 3.306 4.132 . 0 0 "[ . 1 . 2]" 1
763 1 40 LYS QG 1 47 SER HA . . 4.120 3.673 3.095 4.213 0.093 16 0 "[ . 1 . 2]" 1
764 1 41 ASP H 1 41 ASP QB . . 3.290 2.256 2.092 2.438 . 0 0 "[ . 1 . 2]" 1
765 1 41 ASP H 1 46 GLU H . . 4.360 3.566 3.109 3.941 . 0 0 "[ . 1 . 2]" 1
766 1 41 ASP H 1 46 GLU HA . . 5.500 4.986 4.712 5.560 0.060 19 0 "[ . 1 . 2]" 1
767 1 41 ASP H 1 48 LEU QD . . 4.360 2.495 2.133 3.472 . 0 0 "[ . 1 . 2]" 1
768 1 41 ASP H 1 48 LEU HG . . 4.990 4.826 3.857 5.063 0.073 8 0 "[ . 1 . 2]" 1
769 1 41 ASP H 1 66 LEU QD . . 4.430 4.252 4.045 4.485 0.055 6 0 "[ . 1 . 2]" 1
770 1 41 ASP H 1 67 SER H . . 5.450 5.405 5.110 5.532 0.082 9 0 "[ . 1 . 2]" 1
771 1 41 ASP HA 1 42 GLY H . . 2.930 2.313 2.165 2.517 . 0 0 "[ . 1 . 2]" 1
772 1 41 ASP HA 1 42 GLY HA2 . . 4.920 4.442 4.345 4.599 . 0 0 "[ . 1 . 2]" 1
773 1 41 ASP HA 1 42 GLY HA3 . . 4.750 4.426 4.305 4.557 . 0 0 "[ . 1 . 2]" 1
774 1 41 ASP HA 1 43 ALA H . . 4.700 4.014 3.540 4.361 . 0 0 "[ . 1 . 2]" 1
775 1 41 ASP HA 1 66 LEU HA . . 4.120 3.720 3.262 4.019 . 0 0 "[ . 1 . 2]" 1
776 1 41 ASP HA 1 66 LEU QD . . 3.170 2.083 1.921 2.226 . 0 0 "[ . 1 . 2]" 1
777 1 41 ASP HA 1 66 LEU HG . . 5.030 4.434 3.037 4.803 . 0 0 "[ . 1 . 2]" 1
778 1 41 ASP QB 1 42 GLY H . . 4.750 3.434 2.971 3.803 . 0 0 "[ . 1 . 2]" 1
779 1 41 ASP QB 1 43 ALA H . . 4.940 3.148 1.888 3.560 . 0 0 "[ . 1 . 2]" 1
780 1 41 ASP QB 1 44 THR H . . 4.410 3.444 2.820 3.924 . 0 0 "[ . 1 . 2]" 1
781 1 41 ASP QB 1 45 GLY H . . 4.380 3.539 2.776 4.225 . 0 0 "[ . 1 . 2]" 1
782 1 41 ASP QB 1 46 GLU H . . 3.700 2.960 2.356 3.618 . 0 0 "[ . 1 . 2]" 1
783 1 41 ASP QB 1 46 GLU HB2 . . 4.650 2.843 2.180 3.471 . 0 0 "[ . 1 . 2]" 1
784 1 41 ASP QB 1 46 GLU HB3 . . 4.820 4.195 3.651 4.580 . 0 0 "[ . 1 . 2]" 1
785 1 41 ASP QB 1 48 LEU QD . . 3.790 2.026 1.934 2.185 . 0 0 "[ . 1 . 2]" 1
786 1 41 ASP QB 1 48 LEU HG . . 4.790 3.716 3.119 4.245 . 0 0 "[ . 1 . 2]" 1
787 1 41 ASP QB 1 66 LEU QD . . 3.960 3.601 3.106 3.770 . 0 0 "[ . 1 . 2]" 1
788 1 42 GLY H 1 43 ALA H . . 3.370 2.592 2.184 2.860 . 0 0 "[ . 1 . 2]" 1
789 1 42 GLY H 1 43 ALA MB . . 4.490 4.211 3.866 4.464 . 0 0 "[ . 1 . 2]" 1
790 1 42 GLY H 1 44 THR H . . 5.500 4.884 4.326 5.215 . 0 0 "[ . 1 . 2]" 1
791 1 42 GLY H 1 66 LEU HA . . 4.290 3.945 2.978 4.371 0.081 4 0 "[ . 1 . 2]" 1
792 1 42 GLY H 1 66 LEU QD . . 3.760 2.508 1.712 3.298 . 0 0 "[ . 1 . 2]" 1
793 1 42 GLY HA2 1 43 ALA MB . . 5.060 4.964 4.811 5.064 0.004 1 0 "[ . 1 . 2]" 1
794 1 42 GLY HA2 1 65 THR MG . . 4.880 4.908 4.353 5.223 0.343 18 0 "[ . 1 . 2]" 1
795 1 42 GLY HA3 1 43 ALA H . . 3.530 3.361 3.113 3.507 . 0 0 "[ . 1 . 2]" 1
796 1 42 GLY HA3 1 43 ALA MB . . 5.500 4.795 4.574 4.982 . 0 0 "[ . 1 . 2]" 1
797 1 42 GLY HA3 1 65 THR MG . . 5.130 4.745 4.158 5.196 0.066 9 0 "[ . 1 . 2]" 1
798 1 43 ALA H 1 43 ALA MB . . 2.940 2.248 2.172 2.308 . 0 0 "[ . 1 . 2]" 1
799 1 43 ALA H 1 44 THR H . . 3.090 2.689 2.345 2.920 . 0 0 "[ . 1 . 2]" 1
800 1 43 ALA H 1 44 THR HA . . 5.440 5.240 5.003 5.448 0.008 5 0 "[ . 1 . 2]" 1
801 1 43 ALA H 1 44 THR MG . . 4.700 4.718 3.959 4.808 0.108 12 0 "[ . 1 . 2]" 1
802 1 43 ALA H 1 45 GLY H . . 4.220 3.602 3.162 3.897 . 0 0 "[ . 1 . 2]" 1
803 1 43 ALA H 1 45 GLY HA2 . . 5.500 5.306 4.778 5.574 0.074 19 0 "[ . 1 . 2]" 1
804 1 43 ALA HA 1 44 THR MG . . 5.500 4.090 3.625 5.103 . 0 0 "[ . 1 . 2]" 1
805 1 43 ALA MB 1 44 THR H . . 3.400 2.225 1.939 2.667 . 0 0 "[ . 1 . 2]" 1
806 1 43 ALA MB 1 44 THR HA . . 4.310 4.072 3.907 4.388 0.078 12 0 "[ . 1 . 2]" 1
807 1 43 ALA MB 1 44 THR MG . . 3.630 2.529 2.218 3.367 . 0 0 "[ . 1 . 2]" 1
808 1 43 ALA MB 1 45 GLY H . . 4.800 3.968 3.632 4.398 . 0 0 "[ . 1 . 2]" 1
809 1 44 THR H 1 44 THR MG . . 3.240 2.932 2.052 3.323 0.083 11 0 "[ . 1 . 2]" 1
810 1 44 THR H 1 45 GLY H . . 2.810 2.075 1.868 2.257 . 0 0 "[ . 1 . 2]" 1
811 1 44 THR H 1 45 GLY HA2 . . 4.400 4.291 4.046 4.434 0.034 9 0 "[ . 1 . 2]" 1
812 1 44 THR H 1 45 GLY HA3 . . 4.800 4.764 4.586 4.878 0.078 9 0 "[ . 1 . 2]" 1
813 1 44 THR HA 1 44 THR MG . . 3.220 2.417 2.195 3.266 0.046 13 0 "[ . 1 . 2]" 1
814 1 44 THR HA 1 46 GLU HG2 . . 5.500 5.251 4.784 6.297 0.797 17 1 "[ . 1 . + 2]" 1
815 1 44 THR HB 1 46 GLU HG2 . . 3.900 3.379 2.346 4.263 0.363 12 0 "[ . 1 . 2]" 1
816 1 44 THR HB 1 46 GLU HG3 . . 4.170 4.041 3.378 4.248 0.078 11 0 "[ . 1 . 2]" 1
817 1 44 THR MG 1 45 GLY H . . 4.560 4.206 2.661 4.504 . 0 0 "[ . 1 . 2]" 1
818 1 44 THR MG 1 46 GLU H . . 5.490 4.478 1.847 5.156 . 0 0 "[ . 1 . 2]" 1
819 1 44 THR MG 1 46 GLU HB2 . . 5.500 5.045 2.146 5.604 0.104 17 0 "[ . 1 . 2]" 1
820 1 44 THR MG 1 46 GLU HG2 . . 5.500 3.944 1.875 5.168 . 0 0 "[ . 1 . 2]" 1
821 1 44 THR MG 1 46 GLU HG3 . . 5.500 3.972 2.124 4.733 . 0 0 "[ . 1 . 2]" 1
822 1 45 GLY H 1 46 GLU H . . 3.570 2.479 2.091 2.794 . 0 0 "[ . 1 . 2]" 1
823 1 46 GLU H 1 46 GLU HB2 . . 3.430 2.312 2.024 2.632 . 0 0 "[ . 1 . 2]" 1
824 1 46 GLU H 1 46 GLU HB3 . . 3.510 3.536 3.319 3.587 0.077 12 0 "[ . 1 . 2]" 1
825 1 46 GLU H 1 46 GLU HG2 . . 3.820 2.774 2.359 3.302 . 0 0 "[ . 1 . 2]" 1
826 1 46 GLU H 1 46 GLU HG3 . . 3.970 3.354 2.164 3.989 0.019 19 0 "[ . 1 . 2]" 1
827 1 46 GLU H 1 47 SER H . . 4.820 4.576 4.460 4.685 . 0 0 "[ . 1 . 2]" 1
828 1 46 GLU H 1 48 LEU QD . . 5.500 4.140 3.411 4.732 . 0 0 "[ . 1 . 2]" 1
829 1 46 GLU HA 1 46 GLU HG2 . . 3.900 2.669 2.361 3.046 . 0 0 "[ . 1 . 2]" 1
830 1 46 GLU HA 1 46 GLU HG3 . . 3.840 3.706 3.314 3.859 0.019 20 0 "[ . 1 . 2]" 1
831 1 46 GLU HA 1 47 SER H . . 2.700 2.338 2.144 2.569 . 0 0 "[ . 1 . 2]" 1
832 1 46 GLU HA 1 47 SER HA . . 5.040 4.452 4.383 4.520 . 0 0 "[ . 1 . 2]" 1
833 1 46 GLU HA 1 47 SER QB . . 4.720 4.432 3.974 4.571 . 0 0 "[ . 1 . 2]" 1
834 1 46 GLU HA 1 48 LEU QD . . 5.280 4.367 3.977 4.859 . 0 0 "[ . 1 . 2]" 1
835 1 46 GLU HB2 1 47 SER H . . 3.750 3.810 3.664 3.836 0.086 2 0 "[ . 1 . 2]" 1
836 1 46 GLU HB2 1 47 SER HA . . 5.210 4.980 4.444 5.264 0.054 11 0 "[ . 1 . 2]" 1
837 1 46 GLU HB2 1 48 LEU QD . . 4.400 2.948 2.436 3.577 . 0 0 "[ . 1 . 2]" 1
838 1 46 GLU HB3 1 46 GLU HG3 . . 2.930 2.713 2.483 3.050 0.120 12 0 "[ . 1 . 2]" 1
839 1 46 GLU HB3 1 47 SER H . . 3.660 2.643 2.388 3.008 . 0 0 "[ . 1 . 2]" 1
840 1 46 GLU HB3 1 48 LEU QD . . 4.150 2.967 2.540 3.549 . 0 0 "[ . 1 . 2]" 1
841 1 47 SER H 1 47 SER QB . . 3.280 2.874 2.449 3.089 . 0 0 "[ . 1 . 2]" 1
842 1 47 SER H 1 48 LEU H . . 4.650 4.432 4.180 4.579 . 0 0 "[ . 1 . 2]" 1
843 1 47 SER H 1 48 LEU QD . . 4.550 3.569 3.079 4.150 . 0 0 "[ . 1 . 2]" 1
844 1 47 SER H 1 69 THR MG . . 5.500 5.284 4.784 5.601 0.101 16 0 "[ . 1 . 2]" 1
845 1 47 SER HA 1 48 LEU H . . 2.840 2.204 2.076 2.302 . 0 0 "[ . 1 . 2]" 1
846 1 47 SER HA 1 48 LEU QB . . 4.770 4.316 3.856 4.585 . 0 0 "[ . 1 . 2]" 1
847 1 47 SER HA 1 48 LEU QD . . 4.380 2.952 2.371 4.072 . 0 0 "[ . 1 . 2]" 1
848 1 47 SER HA 1 69 THR MG . . 4.440 3.383 2.857 3.774 . 0 0 "[ . 1 . 2]" 1
849 1 47 SER QB 1 48 LEU H . . 3.950 3.149 2.741 3.618 . 0 0 "[ . 1 . 2]" 1
850 1 47 SER QB 1 69 THR MG . . 4.240 2.599 2.138 3.377 . 0 0 "[ . 1 . 2]" 1
851 1 48 LEU H 1 48 LEU QB . . 3.090 2.572 2.339 2.776 . 0 0 "[ . 1 . 2]" 1
852 1 48 LEU H 1 48 LEU QD . . 4.010 2.584 2.014 3.500 . 0 0 "[ . 1 . 2]" 1
853 1 48 LEU H 1 49 ALA H . . 4.780 4.435 4.363 4.555 . 0 0 "[ . 1 . 2]" 1
854 1 48 LEU HA 1 48 LEU QD . . 2.910 2.208 2.063 2.435 . 0 0 "[ . 1 . 2]" 1
855 1 48 LEU HA 1 48 LEU HG . . 4.010 3.631 2.908 3.987 . 0 0 "[ . 1 . 2]" 1
856 1 48 LEU HA 1 49 ALA H . . 2.760 2.286 2.084 2.615 . 0 0 "[ . 1 . 2]" 1
857 1 48 LEU HA 1 49 ALA MB . . 3.990 3.991 3.844 4.095 0.105 7 0 "[ . 1 . 2]" 1
858 1 48 LEU QB 1 48 LEU QD . . 2.780 2.060 1.941 2.114 . 0 0 "[ . 1 . 2]" 1
859 1 48 LEU QB 1 49 ALA H . . 3.380 2.538 2.045 2.881 . 0 0 "[ . 1 . 2]" 1
860 1 48 LEU QB 1 49 ALA HA . . 5.500 4.420 4.161 4.587 . 0 0 "[ . 1 . 2]" 1
861 1 48 LEU QD 1 49 ALA H . . 3.720 3.472 3.010 3.661 . 0 0 "[ . 1 . 2]" 1
862 1 48 LEU QD 1 49 ALA MB . . 4.920 4.517 3.970 4.744 . 0 0 "[ . 1 . 2]" 1
863 1 48 LEU HG 1 49 ALA H . . 4.760 4.717 4.334 4.844 0.084 9 0 "[ . 1 . 2]" 1
864 1 49 ALA H 1 49 ALA MB . . 2.830 2.217 2.107 2.285 . 0 0 "[ . 1 . 2]" 1
865 1 49 ALA H 1 50 SER H . . 4.560 4.582 4.368 4.635 0.075 11 0 "[ . 1 . 2]" 1
866 1 49 ALA H 1 52 VAL QG . . 5.080 4.223 3.548 4.920 . 0 0 "[ . 1 . 2]" 1
867 1 49 ALA HA 1 50 SER H . . 2.850 2.490 2.111 2.785 . 0 0 "[ . 1 . 2]" 1
868 1 49 ALA MB 1 50 SER H . . 3.240 2.393 2.088 3.328 0.088 15 0 "[ . 1 . 2]" 1
869 1 50 SER H 1 51 PRO HA . . 5.140 4.819 4.611 4.926 . 0 0 "[ . 1 . 2]" 1
870 1 50 SER HA 1 51 PRO HA . . 3.070 2.408 2.024 2.710 . 0 0 "[ . 1 . 2]" 1
871 1 50 SER HA 1 52 VAL H . . 3.840 3.656 3.322 3.888 0.048 17 0 "[ . 1 . 2]" 1
872 1 50 SER HA 1 52 VAL QG . . 3.920 2.357 2.087 2.875 . 0 0 "[ . 1 . 2]" 1
873 1 51 PRO HA 1 52 VAL H . . 3.030 2.430 2.096 2.539 . 0 0 "[ . 1 . 2]" 1
874 1 51 PRO HA 1 52 VAL HA . . 5.420 4.606 4.350 4.671 . 0 0 "[ . 1 . 2]" 1
875 1 51 PRO HA 1 52 VAL HB . . 4.610 4.526 4.194 4.717 0.107 3 0 "[ . 1 . 2]" 1
876 1 51 PRO HA 1 53 ILE MD . . 5.500 4.758 4.155 5.569 0.069 2 0 "[ . 1 . 2]" 1
877 1 51 PRO HB2 1 52 VAL H . . 4.100 2.624 2.362 2.895 . 0 0 "[ . 1 . 2]" 1
878 1 51 PRO HB2 1 52 VAL HA . . 4.500 4.240 3.958 4.584 0.084 3 0 "[ . 1 . 2]" 1
879 1 51 PRO HB3 1 52 VAL H . . 3.870 3.584 3.456 3.770 . 0 0 "[ . 1 . 2]" 1
880 1 51 PRO QD 1 53 ILE MD . . 5.500 5.030 4.410 5.615 0.115 9 0 "[ . 1 . 2]" 1
881 1 51 PRO HG2 1 52 VAL H . . 5.200 4.293 4.018 4.591 . 0 0 "[ . 1 . 2]" 1
882 1 51 PRO HG2 1 53 ILE MD . . 4.830 3.812 2.976 4.602 . 0 0 "[ . 1 . 2]" 1
883 1 51 PRO HG2 1 53 ILE QG . . 5.500 4.635 3.945 5.244 . 0 0 "[ . 1 . 2]" 1
884 1 51 PRO HG3 1 52 VAL H . . 5.220 5.101 4.876 5.291 0.071 19 0 "[ . 1 . 2]" 1
885 1 51 PRO HG3 1 53 ILE MD . . 4.530 3.980 3.335 4.779 0.249 9 0 "[ . 1 . 2]" 1
886 1 52 VAL H 1 52 VAL HB . . 3.400 3.052 2.606 3.480 0.080 7 0 "[ . 1 . 2]" 1
887 1 52 VAL H 1 52 VAL QG . . 3.630 2.820 1.786 3.090 . 0 0 "[ . 1 . 2]" 1
888 1 52 VAL H 1 53 ILE H . . 4.790 3.775 2.746 4.159 . 0 0 "[ . 1 . 2]" 1
889 1 52 VAL H 1 53 ILE HA . . 4.730 4.335 3.785 4.601 . 0 0 "[ . 1 . 2]" 1
890 1 52 VAL H 1 53 ILE MD . . 5.430 3.806 2.712 4.466 . 0 0 "[ . 1 . 2]" 1
891 1 52 VAL HA 1 52 VAL QG . . 3.250 2.246 2.141 2.444 . 0 0 "[ . 1 . 2]" 1
892 1 52 VAL HA 1 53 ILE H . . 2.650 2.276 2.157 2.372 . 0 0 "[ . 1 . 2]" 1
893 1 52 VAL HA 1 53 ILE HB . . 4.770 4.574 4.063 4.827 0.057 17 0 "[ . 1 . 2]" 1
894 1 52 VAL HA 1 53 ILE QG . . 4.750 4.023 3.379 4.622 . 0 0 "[ . 1 . 2]" 1
895 1 52 VAL QG 1 53 ILE H . . 3.520 3.058 2.346 3.460 . 0 0 "[ . 1 . 2]" 1
896 1 52 VAL QG 1 54 LEU H . . 5.210 4.198 3.584 4.886 . 0 0 "[ . 1 . 2]" 1
897 1 53 ILE H 1 53 ILE HB . . 3.180 2.584 2.366 2.866 . 0 0 "[ . 1 . 2]" 1
898 1 53 ILE H 1 53 ILE MD . . 4.020 3.587 2.625 4.123 0.103 12 0 "[ . 1 . 2]" 1
899 1 53 ILE H 1 53 ILE QG . . 3.720 3.040 2.278 3.488 . 0 0 "[ . 1 . 2]" 1
900 1 53 ILE H 1 53 ILE MG . . 3.990 3.823 3.667 3.945 . 0 0 "[ . 1 . 2]" 1
901 1 53 ILE H 1 54 LEU H . . 5.010 4.218 3.746 4.560 . 0 0 "[ . 1 . 2]" 1
902 1 53 ILE H 1 54 LEU QD . . 5.200 3.915 3.122 4.726 . 0 0 "[ . 1 . 2]" 1
903 1 53 ILE HA 1 53 ILE MD . . 4.110 3.665 2.221 3.949 . 0 0 "[ . 1 . 2]" 1
904 1 53 ILE HA 1 53 ILE QG . . 3.720 2.474 2.301 3.129 . 0 0 "[ . 1 . 2]" 1
905 1 53 ILE HA 1 53 ILE MG . . 3.220 2.449 2.305 2.578 . 0 0 "[ . 1 . 2]" 1
906 1 53 ILE HA 1 54 LEU H . . 2.860 2.211 2.138 2.461 . 0 0 "[ . 1 . 2]" 1
907 1 53 ILE HB 1 53 ILE MD . . 3.460 2.450 2.229 3.342 . 0 0 "[ . 1 . 2]" 1
908 1 53 ILE HB 1 54 LEU H . . 4.730 4.352 3.634 4.599 . 0 0 "[ . 1 . 2]" 1
909 1 53 ILE MD 1 54 LEU H . . 5.500 5.283 3.879 5.594 0.094 10 0 "[ . 1 . 2]" 1
910 1 53 ILE QG 1 54 LEU H . . 5.020 4.283 4.050 4.565 . 0 0 "[ . 1 . 2]" 1
911 1 53 ILE MG 1 54 LEU H . . 3.640 2.975 2.101 3.667 0.027 10 0 "[ . 1 . 2]" 1
912 1 53 ILE MG 1 55 SER QB . . 5.410 4.907 4.420 5.288 . 0 0 "[ . 1 . 2]" 1
913 1 54 LEU H 1 54 LEU HB2 . . 3.800 2.580 2.418 2.877 . 0 0 "[ . 1 . 2]" 1
914 1 54 LEU H 1 54 LEU QD . . 4.240 2.836 1.911 3.503 . 0 0 "[ . 1 . 2]" 1
915 1 54 LEU H 1 54 LEU HG . . 3.880 2.991 2.123 3.968 0.088 4 0 "[ . 1 . 2]" 1
916 1 54 LEU H 1 55 SER H . . 4.690 4.537 4.243 4.657 . 0 0 "[ . 1 . 2]" 1
917 1 54 LEU HA 1 54 LEU QD . . 3.140 2.198 2.092 2.318 . 0 0 "[ . 1 . 2]" 1
918 1 54 LEU HA 1 54 LEU HG . . 4.090 3.414 2.964 3.792 . 0 0 "[ . 1 . 2]" 1
919 1 54 LEU HA 1 55 SER H . . 2.880 2.276 2.120 2.511 . 0 0 "[ . 1 . 2]" 1
920 1 54 LEU HA 1 58 GLU HB2 . . 4.500 3.156 2.712 3.495 . 0 0 "[ . 1 . 2]" 1
921 1 54 LEU HA 1 58 GLU HB3 . . 4.010 3.734 2.844 4.088 0.078 11 0 "[ . 1 . 2]" 1
922 1 54 LEU HA 1 58 GLU HG2 . . 4.850 4.630 2.799 4.933 0.083 1 0 "[ . 1 . 2]" 1
923 1 54 LEU HA 1 58 GLU HG3 . . 4.780 3.800 2.630 4.865 0.085 20 0 "[ . 1 . 2]" 1
924 1 54 LEU HB2 1 55 SER H . . 5.070 3.755 3.279 4.250 . 0 0 "[ . 1 . 2]" 1
925 1 54 LEU HB3 1 55 SER H . . 4.330 2.741 2.216 3.346 . 0 0 "[ . 1 . 2]" 1
926 1 54 LEU HB3 1 58 GLU HB2 . . 4.400 2.455 2.206 3.476 . 0 0 "[ . 1 . 2]" 1
927 1 54 LEU HB3 1 58 GLU HB3 . . 5.130 2.668 2.312 3.374 . 0 0 "[ . 1 . 2]" 1
928 1 54 LEU HB3 1 58 GLU HG3 . . 5.500 4.247 3.426 5.549 0.049 13 0 "[ . 1 . 2]" 1
929 1 54 LEU QD 1 55 SER H . . 3.880 3.575 3.379 3.811 . 0 0 "[ . 1 . 2]" 1
930 1 54 LEU QD 1 58 GLU H . . 5.160 4.694 4.378 5.047 . 0 0 "[ . 1 . 2]" 1
931 1 54 LEU QD 1 58 GLU HA . . 4.790 4.221 3.856 4.479 . 0 0 "[ . 1 . 2]" 1
932 1 54 LEU QD 1 58 GLU HB2 . . 3.330 2.988 2.653 3.383 0.053 16 0 "[ . 1 . 2]" 1
933 1 54 LEU QD 1 58 GLU HB3 . . 3.420 2.217 2.046 2.433 . 0 0 "[ . 1 . 2]" 1
934 1 54 LEU QD 1 58 GLU HG2 . . 4.390 3.662 2.175 4.149 . 0 0 "[ . 1 . 2]" 1
935 1 54 LEU QD 1 58 GLU HG3 . . 3.720 3.175 2.338 4.321 0.601 20 1 "[ . 1 . +]" 1
936 1 54 LEU HG 1 58 GLU HB2 . . 5.500 4.805 3.696 5.564 0.064 13 0 "[ . 1 . 2]" 1
937 1 55 SER H 1 56 ASP H . . 4.760 4.378 4.250 4.619 . 0 0 "[ . 1 . 2]" 1
938 1 55 SER H 1 57 GLU H . . 4.830 4.664 4.329 4.898 0.068 4 0 "[ . 1 . 2]" 1
939 1 55 SER H 1 58 GLU H . . 3.990 3.227 2.969 3.554 . 0 0 "[ . 1 . 2]" 1
940 1 55 SER H 1 58 GLU HA . . 5.350 5.063 4.737 5.418 0.068 3 0 "[ . 1 . 2]" 1
941 1 55 SER H 1 58 GLU HB2 . . 4.300 2.204 1.862 2.715 . 0 0 "[ . 1 . 2]" 1
942 1 55 SER H 1 58 GLU HB3 . . 4.390 3.666 2.728 4.244 . 0 0 "[ . 1 . 2]" 1
943 1 55 SER H 1 58 GLU HG2 . . 4.680 4.131 2.976 4.812 0.132 10 0 "[ . 1 . 2]" 1
944 1 55 SER H 1 58 GLU HG3 . . 4.730 3.523 2.393 4.296 . 0 0 "[ . 1 . 2]" 1
945 1 55 SER H 1 59 LEU H . . 5.270 4.643 3.666 5.200 . 0 0 "[ . 1 . 2]" 1
946 1 55 SER HA 1 56 ASP H . . 3.080 2.649 2.525 2.840 . 0 0 "[ . 1 . 2]" 1
947 1 55 SER HA 1 56 ASP HA . . 4.290 4.240 4.051 4.364 0.074 2 0 "[ . 1 . 2]" 1
948 1 55 SER HA 1 57 GLU H . . 4.960 4.715 4.297 4.973 0.013 8 0 "[ . 1 . 2]" 1
949 1 55 SER HA 1 59 LEU QD . . 4.760 3.862 2.845 4.695 . 0 0 "[ . 1 . 2]" 1
950 1 55 SER HA 1 59 LEU HG . . 5.320 5.249 4.494 5.403 0.083 16 0 "[ . 1 . 2]" 1
951 1 55 SER QB 1 56 ASP H . . 3.100 2.287 1.970 2.964 . 0 0 "[ . 1 . 2]" 1
952 1 55 SER QB 1 57 GLU H . . 4.220 3.166 2.638 3.741 . 0 0 "[ . 1 . 2]" 1
953 1 55 SER QB 1 57 GLU QB . . 4.870 3.657 2.780 4.283 . 0 0 "[ . 1 . 2]" 1
954 1 55 SER QB 1 58 GLU H . . 5.110 3.747 2.956 4.380 . 0 0 "[ . 1 . 2]" 1
955 1 56 ASP H 1 56 ASP HB2 . . 3.220 3.135 1.990 3.529 0.309 2 0 "[ . 1 . 2]" 1
956 1 56 ASP H 1 56 ASP HB3 . . 3.450 2.481 2.180 3.530 0.080 13 0 "[ . 1 . 2]" 1
957 1 56 ASP H 1 57 GLU QB . . 5.300 4.585 4.081 4.979 . 0 0 "[ . 1 . 2]" 1
958 1 56 ASP H 1 59 LEU H . . 5.460 5.041 4.688 5.493 0.033 1 0 "[ . 1 . 2]" 1
959 1 56 ASP H 1 59 LEU QD . . 5.500 4.345 3.528 4.862 . 0 0 "[ . 1 . 2]" 1
960 1 56 ASP HA 1 59 LEU H . . 3.770 3.581 3.183 3.845 0.075 6 0 "[ . 1 . 2]" 1
961 1 56 ASP HA 1 59 LEU HB2 . . 3.510 2.471 1.978 2.851 . 0 0 "[ . 1 . 2]" 1
962 1 56 ASP HA 1 59 LEU HB3 . . 4.010 3.784 3.040 4.083 0.073 3 0 "[ . 1 . 2]" 1
963 1 56 ASP HA 1 59 LEU QD . . 4.430 3.069 2.259 3.770 . 0 0 "[ . 1 . 2]" 1
964 1 56 ASP HA 1 59 LEU HG . . 4.740 3.834 3.029 4.620 . 0 0 "[ . 1 . 2]" 1
965 1 56 ASP HB2 1 57 GLU H . . 3.740 3.706 2.384 4.046 0.306 12 0 "[ . 1 . 2]" 1
966 1 56 ASP HB2 1 57 GLU HA . . 5.460 4.908 4.090 5.816 0.356 1 0 "[ . 1 . 2]" 1
967 1 56 ASP HB3 1 57 GLU H . . 3.980 3.451 2.620 3.832 . 0 0 "[ . 1 . 2]" 1
968 1 57 GLU H 1 57 GLU QB . . 2.960 2.185 1.836 2.421 . 0 0 "[ . 1 . 2]" 1
969 1 57 GLU H 1 57 GLU QG . . 3.450 2.800 2.289 3.575 0.125 3 0 "[ . 1 . 2]" 1
970 1 57 GLU H 1 58 GLU H . . 3.170 2.757 2.531 2.987 . 0 0 "[ . 1 . 2]" 1
971 1 57 GLU H 1 58 GLU HB2 . . 5.160 4.765 4.431 5.084 . 0 0 "[ . 1 . 2]" 1
972 1 57 GLU H 1 59 LEU H . . 4.590 4.036 3.873 4.347 . 0 0 "[ . 1 . 2]" 1
973 1 57 GLU HA 1 57 GLU QG . . 3.490 2.399 2.130 2.751 . 0 0 "[ . 1 . 2]" 1
974 1 57 GLU HA 1 59 LEU H . . 4.960 3.948 3.497 4.508 . 0 0 "[ . 1 . 2]" 1
975 1 57 GLU HA 1 60 ALA H . . 5.380 4.907 3.897 5.453 0.073 12 0 "[ . 1 . 2]" 1
976 1 57 GLU QB 1 58 GLU H . . 3.470 2.689 2.252 3.053 . 0 0 "[ . 1 . 2]" 1
977 1 57 GLU QB 1 58 GLU HA . . 4.810 4.056 3.873 4.305 . 0 0 "[ . 1 . 2]" 1
978 1 58 GLU H 1 58 GLU HB2 . . 3.170 2.270 2.096 2.509 . 0 0 "[ . 1 . 2]" 1
979 1 58 GLU H 1 58 GLU HB3 . . 3.760 3.529 3.362 3.633 . 0 0 "[ . 1 . 2]" 1
980 1 58 GLU H 1 58 GLU HG2 . . 3.910 3.365 2.298 4.299 0.389 13 0 "[ . 1 . 2]" 1
981 1 58 GLU H 1 58 GLU HG3 . . 4.270 3.489 2.384 4.105 . 0 0 "[ . 1 . 2]" 1
982 1 58 GLU H 1 60 ALA H . . 5.050 4.596 4.176 5.073 0.023 6 0 "[ . 1 . 2]" 1
983 1 58 GLU HA 1 58 GLU HG2 . . 3.110 2.707 2.185 3.625 0.515 9 1 "[ . +1 . 2]" 1
984 1 58 GLU HA 1 58 GLU HG3 . . 3.800 3.328 2.371 3.827 0.027 4 0 "[ . 1 . 2]" 1
985 1 58 GLU HA 1 60 ALA H . . 4.430 3.469 3.056 3.900 . 0 0 "[ . 1 . 2]" 1
986 1 58 GLU HA 1 60 ALA MB . . 5.210 4.044 3.389 4.628 . 0 0 "[ . 1 . 2]" 1
987 1 58 GLU HB2 1 59 LEU H . . 3.910 3.430 2.701 3.958 0.048 1 0 "[ . 1 . 2]" 1
988 1 59 LEU H 1 59 LEU HB2 . . 3.440 2.166 1.960 2.414 . 0 0 "[ . 1 . 2]" 1
989 1 59 LEU H 1 59 LEU HB3 . . 3.870 3.358 3.159 3.638 . 0 0 "[ . 1 . 2]" 1
990 1 59 LEU H 1 59 LEU QD . . 4.300 3.180 2.608 3.782 . 0 0 "[ . 1 . 2]" 1
991 1 59 LEU H 1 60 ALA H . . 3.520 2.846 2.459 3.485 . 0 0 "[ . 1 . 2]" 1
992 1 59 LEU H 1 60 ALA MB . . 4.610 4.167 3.821 4.473 . 0 0 "[ . 1 . 2]" 1
993 1 59 LEU HA 1 59 LEU QD . . 3.140 2.042 1.920 2.341 . 0 0 "[ . 1 . 2]" 1
994 1 59 LEU HA 1 59 LEU HG . . 4.190 3.140 2.368 3.714 . 0 0 "[ . 1 . 2]" 1
995 1 59 LEU HA 1 60 ALA MB . . 5.130 4.704 4.488 4.898 . 0 0 "[ . 1 . 2]" 1
996 1 59 LEU HA 1 61 VAL H . . 3.710 3.340 2.801 3.773 0.063 4 0 "[ . 1 . 2]" 1
997 1 59 LEU HA 1 61 VAL MG1 . . 5.500 4.317 3.793 5.316 . 0 0 "[ . 1 . 2]" 1
998 1 59 LEU HA 1 61 VAL MG2 . . 4.250 2.794 2.252 3.930 . 0 0 "[ . 1 . 2]" 1
999 1 59 LEU HB2 1 60 ALA H . . 5.500 4.099 3.757 4.505 . 0 0 "[ . 1 . 2]" 1
1000 1 59 LEU HB3 1 60 ALA H . . 5.280 4.144 3.726 4.451 . 0 0 "[ . 1 . 2]" 1
1001 1 59 LEU HB3 1 61 VAL H . . 4.660 4.496 3.978 4.734 0.074 18 0 "[ . 1 . 2]" 1
1002 1 59 LEU QD 1 60 ALA H . . 5.030 4.223 3.939 4.537 . 0 0 "[ . 1 . 2]" 1
1003 1 59 LEU QD 1 61 VAL H . . 4.110 3.857 3.353 4.110 . 0 0 "[ . 1 . 2]" 1
1004 1 60 ALA H 1 60 ALA MB . . 2.840 2.234 2.092 2.509 . 0 0 "[ . 1 . 2]" 1
1005 1 60 ALA H 1 61 VAL H . . 3.310 3.104 2.241 3.395 0.085 4 0 "[ . 1 . 2]" 1
1006 1 60 ALA H 1 61 VAL MG1 . . 4.610 3.746 3.230 4.260 . 0 0 "[ . 1 . 2]" 1
1007 1 60 ALA H 1 61 VAL MG2 . . 4.300 3.703 3.043 4.389 0.089 9 0 "[ . 1 . 2]" 1
1008 1 60 ALA MB 1 61 VAL H . . 3.690 3.602 3.223 3.757 0.067 15 0 "[ . 1 . 2]" 1
1009 1 60 ALA MB 1 61 VAL MG1 . . 4.840 3.550 2.983 4.123 . 0 0 "[ . 1 . 2]" 1
1010 1 60 ALA MB 1 61 VAL MG2 . . 5.460 4.364 3.752 4.989 . 0 0 "[ . 1 . 2]" 1
1011 1 61 VAL H 1 61 VAL HB . . 4.010 3.716 3.508 3.837 . 0 0 "[ . 1 . 2]" 1
1012 1 61 VAL H 1 61 VAL MG1 . . 3.510 2.900 2.205 3.415 . 0 0 "[ . 1 . 2]" 1
1013 1 61 VAL H 1 61 VAL MG2 . . 2.890 2.140 1.835 2.524 . 0 0 "[ . 1 . 2]" 1
1014 1 61 VAL H 1 62 GLU H . . 4.890 4.518 4.380 4.725 . 0 0 "[ . 1 . 2]" 1
1015 1 61 VAL HA 1 61 VAL HB . . 3.020 2.502 2.327 2.623 . 0 0 "[ . 1 . 2]" 1
1016 1 61 VAL HA 1 61 VAL MG1 . . 3.080 2.282 2.199 2.350 . 0 0 "[ . 1 . 2]" 1
1017 1 61 VAL HA 1 61 VAL MG2 . . 3.610 3.266 3.243 3.280 . 0 0 "[ . 1 . 2]" 1
1018 1 61 VAL HA 1 62 GLU H . . 2.870 2.371 2.146 2.678 . 0 0 "[ . 1 . 2]" 1
1019 1 61 VAL HA 1 62 GLU HA . . 4.920 4.388 4.234 4.551 . 0 0 "[ . 1 . 2]" 1
1020 1 61 VAL HA 1 62 GLU HG2 . . 5.250 4.283 3.357 5.317 0.067 11 0 "[ . 1 . 2]" 1
1021 1 61 VAL HA 1 62 GLU HG3 . . 4.990 3.969 3.394 5.173 0.183 8 0 "[ . 1 . 2]" 1
1022 1 61 VAL HB 1 62 GLU H . . 3.130 2.616 2.093 3.155 0.025 9 0 "[ . 1 . 2]" 1
1023 1 61 VAL HB 1 63 LYS H . . 3.850 3.720 3.194 3.927 0.077 3 0 "[ . 1 . 2]" 1
1024 1 61 VAL MG1 1 62 GLU H . . 3.940 3.633 3.340 3.951 0.011 17 0 "[ . 1 . 2]" 1
1025 1 61 VAL MG1 1 62 GLU HG3 . . 5.500 5.335 4.820 6.409 0.909 8 1 "[ . + 1 . 2]" 1
1026 1 61 VAL MG2 1 62 GLU H . . 3.860 3.739 3.220 3.962 0.102 9 0 "[ . 1 . 2]" 1
1027 1 61 VAL MG2 1 62 GLU HA . . 5.270 4.526 4.196 4.863 . 0 0 "[ . 1 . 2]" 1
1028 1 62 GLU H 1 62 GLU HB2 . . 3.120 2.600 2.165 3.048 . 0 0 "[ . 1 . 2]" 1
1029 1 62 GLU H 1 62 GLU HG2 . . 3.650 3.219 2.356 3.723 0.073 6 0 "[ . 1 . 2]" 1
1030 1 62 GLU H 1 62 GLU HG3 . . 3.660 2.712 2.214 3.712 0.052 20 0 "[ . 1 . 2]" 1
1031 1 62 GLU H 1 63 LYS H . . 3.350 2.565 1.984 3.078 . 0 0 "[ . 1 . 2]" 1
1032 1 62 GLU HA 1 62 GLU HG2 . . 3.740 2.613 2.302 3.667 . 0 0 "[ . 1 . 2]" 1
1033 1 62 GLU HA 1 62 GLU HG3 . . 3.900 3.422 2.611 3.804 . 0 0 "[ . 1 . 2]" 1
1034 1 62 GLU HB2 1 63 LYS H . . 3.600 2.277 1.912 2.719 . 0 0 "[ . 1 . 2]" 1
1035 1 62 GLU HB2 1 63 LYS HA . . 5.360 4.683 4.371 5.005 . 0 0 "[ . 1 . 2]" 1
1036 1 62 GLU HG2 1 63 LYS H . . 4.500 4.570 4.495 4.590 0.090 11 0 "[ . 1 . 2]" 1
1037 1 62 GLU HG3 1 63 LYS H . . 4.500 4.097 3.605 4.575 0.075 20 0 "[ . 1 . 2]" 1
1038 1 63 LYS H 1 63 LYS HB2 . . 3.210 3.275 2.473 4.025 0.815 7 8 "[* ***-+ 1* * 2]" 1
1039 1 63 LYS H 1 63 LYS QD . . 5.160 3.904 2.123 4.878 . 0 0 "[ . 1 . 2]" 1
1040 1 63 LYS H 1 63 LYS HG3 . . 4.850 4.395 3.809 4.810 . 0 0 "[ . 1 . 2]" 1
1041 1 63 LYS H 1 64 VAL H . . 4.930 4.387 4.096 4.563 . 0 0 "[ . 1 . 2]" 1
1042 1 63 LYS HA 1 63 LYS QD . . 4.640 3.619 2.510 4.527 . 0 0 "[ . 1 . 2]" 1
1043 1 63 LYS HA 1 63 LYS HG3 . . 3.590 2.986 2.090 4.230 0.640 4 4 "[ +*- 1* . 2]" 1
1044 1 63 LYS HA 1 64 VAL H . . 2.860 2.284 2.073 2.476 . 0 0 "[ . 1 . 2]" 1
1045 1 63 LYS HA 1 64 VAL HA . . 4.900 4.431 4.220 4.631 . 0 0 "[ . 1 . 2]" 1
1046 1 63 LYS HA 1 64 VAL QG . . 4.880 3.505 2.718 4.138 . 0 0 "[ . 1 . 2]" 1
1047 1 63 LYS HB2 1 63 LYS QE . . 4.980 3.047 2.004 4.246 . 0 0 "[ . 1 . 2]" 1
1048 1 63 LYS QD 1 64 VAL H . . 5.330 4.834 4.293 5.261 . 0 0 "[ . 1 . 2]" 1
1049 1 63 LYS QE 1 63 LYS HG3 . . 3.800 2.995 2.229 3.598 . 0 0 "[ . 1 . 2]" 1
1050 1 63 LYS HG3 1 64 VAL H . . 3.960 3.519 2.525 4.707 0.747 11 3 "[ *. 1+ -. 2]" 1
1051 1 63 LYS HG3 1 64 VAL HA . . 5.290 4.890 3.687 6.214 0.924 14 1 "[ . 1 +. 2]" 1
1052 1 64 VAL H 1 64 VAL HB . . 3.430 3.319 2.728 3.544 0.114 9 0 "[ . 1 . 2]" 1
1053 1 64 VAL H 1 64 VAL QG . . 4.130 2.700 2.128 3.139 . 0 0 "[ . 1 . 2]" 1
1054 1 64 VAL HA 1 64 VAL QG . . 3.210 2.230 2.063 2.463 . 0 0 "[ . 1 . 2]" 1
1055 1 64 VAL HA 1 65 THR H . . 2.680 2.364 2.170 2.625 . 0 0 "[ . 1 . 2]" 1
1056 1 64 VAL HA 1 65 THR HA . . 4.880 4.535 4.446 4.637 . 0 0 "[ . 1 . 2]" 1
1057 1 64 VAL HA 1 65 THR MG . . 5.500 5.493 5.225 5.601 0.101 10 0 "[ . 1 . 2]" 1
1058 1 64 VAL HB 1 65 THR H . . 4.120 3.827 2.377 4.183 0.063 18 0 "[ . 1 . 2]" 1
1059 1 64 VAL QG 1 65 THR H . . 3.390 2.305 1.898 3.203 . 0 0 "[ . 1 . 2]" 1
1060 1 64 VAL QG 1 65 THR HA . . 4.770 3.564 2.984 4.150 . 0 0 "[ . 1 . 2]" 1
1061 1 64 VAL QG 1 65 THR HB . . 5.270 4.295 3.808 5.001 . 0 0 "[ . 1 . 2]" 1
1062 1 64 VAL QG 1 66 LEU HA . . 4.460 3.913 3.417 4.475 0.015 11 0 "[ . 1 . 2]" 1
1063 1 64 VAL QG 1 66 LEU HB2 . . 4.720 4.000 3.342 4.492 . 0 0 "[ . 1 . 2]" 1
1064 1 64 VAL QG 1 66 LEU HG . . 3.370 2.504 1.916 3.450 0.080 8 0 "[ . 1 . 2]" 1
1065 1 65 THR H 1 65 THR HB . . 3.300 2.682 2.532 2.927 . 0 0 "[ . 1 . 2]" 1
1066 1 65 THR H 1 65 THR MG . . 4.370 3.887 3.786 3.969 . 0 0 "[ . 1 . 2]" 1
1067 1 65 THR HA 1 65 THR MG . . 3.270 2.360 2.279 2.469 . 0 0 "[ . 1 . 2]" 1
1068 1 65 THR HA 1 66 LEU H . . 2.890 2.279 2.143 2.466 . 0 0 "[ . 1 . 2]" 1
1069 1 65 THR HA 1 66 LEU HB2 . . 4.960 4.668 4.273 4.920 . 0 0 "[ . 1 . 2]" 1
1070 1 65 THR HA 1 66 LEU QD . . 5.360 4.033 2.666 4.793 . 0 0 "[ . 1 . 2]" 1
1071 1 65 THR HB 1 66 LEU H . . 4.370 4.349 4.001 4.443 0.073 6 0 "[ . 1 . 2]" 1
1072 1 65 THR HB 1 66 LEU HA . . 4.780 4.838 4.697 4.864 0.084 6 0 "[ . 1 . 2]" 1
1073 1 65 THR MG 1 67 SER QB . . 5.500 3.627 2.944 4.654 . 0 0 "[ . 1 . 2]" 1
1074 1 66 LEU H 1 66 LEU HB2 . . 4.000 2.515 2.340 2.666 . 0 0 "[ . 1 . 2]" 1
1075 1 66 LEU H 1 66 LEU QD . . 3.730 2.925 1.791 3.610 . 0 0 "[ . 1 . 2]" 1
1076 1 66 LEU H 1 66 LEU HG . . 3.750 3.228 2.601 3.848 0.098 18 0 "[ . 1 . 2]" 1
1077 1 66 LEU H 1 67 SER H . . 4.960 4.571 4.395 4.718 . 0 0 "[ . 1 . 2]" 1
1078 1 66 LEU HA 1 66 LEU QD . . 3.220 2.229 2.109 3.041 . 0 0 "[ . 1 . 2]" 1
1079 1 66 LEU HA 1 66 LEU HG . . 3.510 3.157 2.655 3.599 0.089 18 0 "[ . 1 . 2]" 1
1080 1 66 LEU HA 1 67 SER H . . 2.830 2.356 2.214 2.517 . 0 0 "[ . 1 . 2]" 1
1081 1 66 LEU HA 1 67 SER QB . . 4.640 3.964 3.625 4.323 . 0 0 "[ . 1 . 2]" 1
1082 1 66 LEU HB2 1 67 SER H . . 4.670 3.932 3.569 4.299 . 0 0 "[ . 1 . 2]" 1
1083 1 66 LEU HB3 1 66 LEU QD . . 3.150 2.231 2.061 2.479 . 0 0 "[ . 1 . 2]" 1
1084 1 66 LEU HB3 1 67 SER H . . 3.820 2.875 2.557 3.274 . 0 0 "[ . 1 . 2]" 1
1085 1 66 LEU QD 1 67 SER H . . 3.860 3.562 3.264 3.811 . 0 0 "[ . 1 . 2]" 1
1086 1 66 LEU HG 1 67 SER H . . 5.010 4.947 4.674 5.084 0.074 2 0 "[ . 1 . 2]" 1
1087 1 67 SER H 1 67 SER QB . . 3.910 2.774 2.538 3.045 . 0 0 "[ . 1 . 2]" 1
1088 1 67 SER H 1 69 THR MG . . 5.500 5.509 5.280 5.590 0.090 6 0 "[ . 1 . 2]" 1
1089 1 67 SER HA 1 68 THR H . . 2.980 2.314 2.165 2.471 . 0 0 "[ . 1 . 2]" 1
1090 1 67 SER HA 1 68 THR MG . . 4.390 3.659 3.239 4.138 . 0 0 "[ . 1 . 2]" 1
1091 1 67 SER QB 1 68 THR H . . 3.760 3.344 2.941 3.453 . 0 0 "[ . 1 . 2]" 1
1092 1 67 SER QB 1 68 THR MG . . 5.500 4.933 4.559 5.173 . 0 0 "[ . 1 . 2]" 1
1093 1 67 SER QB 1 69 THR MG . . 5.500 5.187 4.598 5.369 . 0 0 "[ . 1 . 2]" 1
1094 1 68 THR H 1 68 THR MG . . 3.350 2.553 2.194 3.069 . 0 0 "[ . 1 . 2]" 1
1095 1 68 THR H 1 69 THR H . . 4.700 4.694 4.565 4.753 0.053 19 0 "[ . 1 . 2]" 1
1096 1 68 THR HA 1 68 THR MG . . 3.600 2.268 2.065 2.429 . 0 0 "[ . 1 . 2]" 1
1097 1 68 THR HA 1 69 THR H . . 2.900 2.316 2.161 2.404 . 0 0 "[ . 1 . 2]" 1
1098 1 68 THR HA 1 69 THR HA . . 4.360 4.407 4.318 4.432 0.072 15 0 "[ . 1 . 2]" 1
1099 1 68 THR HA 1 69 THR MG . . 4.150 3.631 3.300 3.890 . 0 0 "[ . 1 . 2]" 1
1100 1 68 THR HA 1 70 GLY H . . 4.340 4.216 3.654 4.413 0.073 8 0 "[ . 1 . 2]" 1
1101 1 68 THR HB 1 69 THR H . . 4.980 2.997 2.554 3.381 . 0 0 "[ . 1 . 2]" 1
1102 1 68 THR HB 1 70 GLY H . . 3.410 3.088 2.334 3.475 0.065 2 0 "[ . 1 . 2]" 1
1103 1 68 THR HB 1 70 GLY QA . . 5.190 4.365 4.084 4.767 . 0 0 "[ . 1 . 2]" 1
1104 1 68 THR MG 1 69 THR H . . 4.370 3.668 3.285 4.078 . 0 0 "[ . 1 . 2]" 1
1105 1 68 THR MG 1 70 GLY H . . 4.860 4.383 3.796 4.921 0.061 16 0 "[ . 1 . 2]" 1
1106 1 68 THR MG 1 72 ALA HA . . 3.640 3.655 2.698 3.756 0.116 9 0 "[ . 1 . 2]" 1
1107 1 68 THR MG 1 72 ALA MB . . 3.530 2.009 1.893 2.194 . 0 0 "[ . 1 . 2]" 1
1108 1 69 THR H 1 69 THR HB . . 4.110 3.610 3.527 3.701 . 0 0 "[ . 1 . 2]" 1
1109 1 69 THR H 1 69 THR MG . . 3.370 2.361 2.146 2.576 . 0 0 "[ . 1 . 2]" 1
1110 1 69 THR H 1 70 GLY H . . 3.210 2.492 2.298 2.810 . 0 0 "[ . 1 . 2]" 1
1111 1 69 THR H 1 70 GLY QA . . 4.710 4.444 4.231 4.731 0.021 16 0 "[ . 1 . 2]" 1
1112 1 69 THR HA 1 69 THR HB . . 2.980 2.442 2.339 2.533 . 0 0 "[ . 1 . 2]" 1
1113 1 69 THR HA 1 69 THR MG . . 3.160 2.378 2.286 2.516 . 0 0 "[ . 1 . 2]" 1
1114 1 69 THR HB 1 70 GLY H . . 5.090 3.773 3.344 4.410 . 0 0 "[ . 1 . 2]" 1
1115 1 69 THR MG 1 70 GLY H . . 4.500 3.964 3.631 4.268 . 0 0 "[ . 1 . 2]" 1
1116 1 70 GLY H 1 71 LYS H . . 4.520 3.621 2.854 4.262 . 0 0 "[ . 1 . 2]" 1
1117 1 70 GLY QA 1 71 LYS H . . 3.380 2.261 2.128 2.390 . 0 0 "[ . 1 . 2]" 1
1118 1 70 GLY QA 1 71 LYS QD . . 5.490 4.116 3.273 4.808 . 0 0 "[ . 1 . 2]" 1
1119 1 70 GLY QA 1 71 LYS QG . . 5.500 3.834 3.085 5.162 . 0 0 "[ . 1 . 2]" 1
1120 1 71 LYS H 1 71 LYS HB2 . . 3.280 2.567 2.136 2.916 . 0 0 "[ . 1 . 2]" 1
1121 1 71 LYS H 1 71 LYS HB3 . . 3.780 3.668 3.320 3.846 0.066 8 0 "[ . 1 . 2]" 1
1122 1 71 LYS H 1 71 LYS QD . . 4.410 3.880 2.720 4.383 . 0 0 "[ . 1 . 2]" 1
1123 1 71 LYS H 1 71 LYS QE . . 5.500 4.845 3.850 5.600 0.100 9 0 "[ . 1 . 2]" 1
1124 1 71 LYS H 1 71 LYS QG . . 4.260 3.144 2.265 4.342 0.082 12 0 "[ . 1 . 2]" 1
1125 1 71 LYS H 1 72 ALA H . . 4.890 4.381 3.931 4.561 . 0 0 "[ . 1 . 2]" 1
1126 1 71 LYS HA 1 71 LYS QD . . 3.670 2.168 2.000 2.451 . 0 0 "[ . 1 . 2]" 1
1127 1 71 LYS HA 1 71 LYS QG . . 3.650 2.898 2.384 3.141 . 0 0 "[ . 1 . 2]" 1
1128 1 71 LYS HA 1 72 ALA H . . 2.920 2.165 2.047 2.329 . 0 0 "[ . 1 . 2]" 1
1129 1 71 LYS HA 1 72 ALA HA . . 4.460 4.460 4.342 4.525 0.065 18 0 "[ . 1 . 2]" 1
1130 1 71 LYS HA 1 72 ALA MB . . 4.300 4.010 3.841 4.155 . 0 0 "[ . 1 . 2]" 1
1131 1 71 LYS HB2 1 71 LYS QE . . 4.950 4.148 2.293 4.693 . 0 0 "[ . 1 . 2]" 1
1132 1 71 LYS HB2 1 72 ALA H . . 4.670 4.293 3.803 4.695 0.025 12 0 "[ . 1 . 2]" 1
1133 1 71 LYS HB3 1 71 LYS QD . . 3.730 2.684 2.347 3.575 . 0 0 "[ . 1 . 2]" 1
1134 1 71 LYS HB3 1 72 ALA H . . 4.370 3.366 2.902 4.062 . 0 0 "[ . 1 . 2]" 1
1135 1 71 LYS QD 1 72 ALA H . . 5.090 3.700 3.231 3.981 . 0 0 "[ . 1 . 2]" 1
1136 1 71 LYS QE 1 71 LYS QG . . 3.480 2.259 2.002 2.954 . 0 0 "[ . 1 . 2]" 1
1137 1 71 LYS QG 1 72 ALA H . . 4.750 4.450 3.445 4.799 0.049 16 0 "[ . 1 . 2]" 1
1138 1 72 ALA H 1 72 ALA MB . . 3.260 2.253 2.159 2.341 . 0 0 "[ . 1 . 2]" 1
1139 1 72 ALA HA 1 73 ILE H . . 2.910 2.170 2.064 2.395 . 0 0 "[ . 1 . 2]" 1
1140 1 72 ALA HA 1 73 ILE HA . . 4.310 4.378 4.350 4.397 0.087 18 0 "[ . 1 . 2]" 1
1141 1 72 ALA HA 1 73 ILE HB . . 5.000 4.720 4.523 4.947 . 0 0 "[ . 1 . 2]" 1
1142 1 72 ALA HA 1 73 ILE QG . . 5.200 3.417 3.070 3.595 . 0 0 "[ . 1 . 2]" 1
1143 1 72 ALA HA 1 74 GLU H . . 4.100 4.097 3.653 4.188 0.088 15 0 "[ . 1 . 2]" 1
1144 1 72 ALA MB 1 73 ILE H . . 3.620 2.901 2.106 3.302 . 0 0 "[ . 1 . 2]" 1
1145 1 72 ALA MB 1 74 GLU H . . 3.680 3.306 2.606 3.705 0.025 7 0 "[ . 1 . 2]" 1
1146 1 73 ILE H 1 73 ILE HB . . 3.410 2.646 2.489 2.967 . 0 0 "[ . 1 . 2]" 1
1147 1 73 ILE H 1 73 ILE QG . . 3.480 2.088 1.792 2.853 . 0 0 "[ . 1 . 2]" 1
1148 1 73 ILE H 1 73 ILE MG . . 4.740 3.763 3.688 3.944 . 0 0 "[ . 1 . 2]" 1
1149 1 73 ILE H 1 74 GLU H . . 3.090 2.456 1.890 2.812 . 0 0 "[ . 1 . 2]" 1
1150 1 73 ILE HA 1 73 ILE QG . . 3.940 2.731 2.366 3.230 . 0 0 "[ . 1 . 2]" 1
1151 1 73 ILE HA 1 73 ILE MG . . 3.230 2.341 2.225 2.458 . 0 0 "[ . 1 . 2]" 1
1152 1 73 ILE HB 1 74 GLU H . . 3.710 2.395 2.176 2.692 . 0 0 "[ . 1 . 2]" 1
1153 1 73 ILE QG 1 74 GLU H . . 4.260 3.624 3.430 3.811 . 0 0 "[ . 1 . 2]" 1
1154 1 73 ILE QG 1 74 GLU QG . . 5.180 4.384 4.079 4.746 . 0 0 "[ . 1 . 2]" 1
1155 1 73 ILE MG 1 74 GLU H . . 4.040 3.563 3.343 3.860 . 0 0 "[ . 1 . 2]" 1
1156 1 73 ILE MG 1 74 GLU HA . . 4.430 4.182 3.868 4.399 . 0 0 "[ . 1 . 2]" 1
1157 1 73 ILE MG 1 74 GLU QG . . 4.570 2.566 2.211 4.008 . 0 0 "[ . 1 . 2]" 1
1158 1 73 ILE MG 1 129 ASN HB2 . . 5.500 4.264 3.683 5.023 . 0 0 "[ . 1 . 2]" 1
1159 1 74 GLU H 1 74 GLU QG . . 4.530 2.807 2.126 3.113 . 0 0 "[ . 1 . 2]" 1
1160 1 74 GLU H 1 75 PHE H . . 4.990 4.389 4.288 4.522 . 0 0 "[ . 1 . 2]" 1
1161 1 74 GLU HA 1 74 GLU QG . . 3.820 3.099 2.775 3.458 . 0 0 "[ . 1 . 2]" 1
1162 1 74 GLU HA 1 75 PHE H . . 2.900 2.338 2.180 2.452 . 0 0 "[ . 1 . 2]" 1
1163 1 74 GLU HA 1 75 PHE QB . . 4.830 4.192 3.815 4.580 . 0 0 "[ . 1 . 2]" 1
1164 1 74 GLU HA 1 129 ASN HA . . 3.490 2.854 2.022 3.540 0.050 11 0 "[ . 1 . 2]" 1
1165 1 74 GLU HA 1 129 ASN HB2 . . 4.560 3.342 2.399 3.909 . 0 0 "[ . 1 . 2]" 1
1166 1 74 GLU HA 1 129 ASN HB3 . . 4.230 2.764 2.155 3.424 . 0 0 "[ . 1 . 2]" 1
1167 1 74 GLU QB 1 75 PHE H . . 3.970 2.848 2.520 3.153 . 0 0 "[ . 1 . 2]" 1
1168 1 74 GLU QB 1 127 TYR QE . . 3.660 2.920 2.491 3.284 . 0 0 "[ . 1 . 2]" 1
1169 1 74 GLU QB 1 129 ASN HB2 . . 5.100 4.270 2.142 4.880 . 0 0 "[ . 1 . 2]" 1
1170 1 74 GLU QB 1 129 ASN HB3 . . 4.130 3.469 2.186 4.017 . 0 0 "[ . 1 . 2]" 1
1171 1 74 GLU QG 1 75 PHE H . . 5.280 4.603 3.962 4.818 . 0 0 "[ . 1 . 2]" 1
1172 1 74 GLU QG 1 127 TYR QE . . 5.350 4.349 4.013 4.671 . 0 0 "[ . 1 . 2]" 1
1173 1 74 GLU QG 1 129 ASN HB2 . . 4.680 4.176 3.571 4.479 . 0 0 "[ . 1 . 2]" 1
1174 1 75 PHE H 1 75 PHE QB . . 3.600 2.873 2.581 3.313 . 0 0 "[ . 1 . 2]" 1
1175 1 75 PHE H 1 75 PHE QD . . 5.500 3.822 2.160 4.483 . 0 0 "[ . 1 . 2]" 1
1176 1 75 PHE H 1 127 TYR QE . . 5.500 3.580 2.731 4.747 . 0 0 "[ . 1 . 2]" 1
1177 1 75 PHE H 1 128 TYR H . . 3.970 3.311 2.884 3.839 . 0 0 "[ . 1 . 2]" 1
1178 1 75 PHE H 1 128 TYR QB . . 4.270 3.627 3.186 3.929 . 0 0 "[ . 1 . 2]" 1
1179 1 75 PHE H 1 128 TYR QD . . 5.370 5.169 4.785 5.466 0.096 15 0 "[ . 1 . 2]" 1
1180 1 75 PHE H 1 129 ASN H . . 5.420 5.016 4.782 5.324 . 0 0 "[ . 1 . 2]" 1
1181 1 75 PHE H 1 129 ASN HA . . 4.190 3.928 3.187 4.255 0.065 20 0 "[ . 1 . 2]" 1
1182 1 75 PHE H 1 129 ASN HB3 . . 5.420 3.610 2.485 4.263 . 0 0 "[ . 1 . 2]" 1
1183 1 75 PHE HA 1 75 PHE QD . . 3.640 2.797 2.136 3.694 0.054 12 0 "[ . 1 . 2]" 1
1184 1 75 PHE HA 1 76 ALA H . . 2.880 2.476 2.253 2.692 . 0 0 "[ . 1 . 2]" 1
1185 1 75 PHE HA 1 76 ALA MB . . 4.190 4.019 3.716 4.235 0.045 3 0 "[ . 1 . 2]" 1
1186 1 75 PHE QB 1 76 ALA H . . 4.070 3.175 2.178 3.763 . 0 0 "[ . 1 . 2]" 1
1187 1 75 PHE QB 1 128 TYR H . . 5.500 4.068 3.273 5.181 . 0 0 "[ . 1 . 2]" 1
1188 1 75 PHE QB 1 128 TYR QB . . 4.180 2.673 1.952 3.319 . 0 0 "[ . 1 . 2]" 1
1189 1 75 PHE QB 1 128 TYR QD . . 4.580 3.860 2.917 4.532 . 0 0 "[ . 1 . 2]" 1
1190 1 75 PHE QD 1 76 ALA H . . 4.080 2.910 1.990 4.197 0.117 3 0 "[ . 1 . 2]" 1
1191 1 75 PHE QD 1 76 ALA HA . . 4.770 4.507 4.199 4.844 0.074 3 0 "[ . 1 . 2]" 1
1192 1 75 PHE QD 1 76 ALA MB . . 5.500 4.707 4.224 5.442 . 0 0 "[ . 1 . 2]" 1
1193 1 75 PHE QD 1 128 TYR QB . . 5.500 2.574 1.938 3.998 . 0 0 "[ . 1 . 2]" 1
1194 1 76 ALA H 1 76 ALA MB . . 3.440 2.739 2.329 3.045 . 0 0 "[ . 1 . 2]" 1
1195 1 76 ALA H 1 77 VAL H . . 5.460 4.380 4.210 4.765 . 0 0 "[ . 1 . 2]" 1
1196 1 76 ALA H 1 77 VAL QG . . 5.500 3.875 3.495 4.984 . 0 0 "[ . 1 . 2]" 1
1197 1 76 ALA HA 1 77 VAL H . . 2.880 2.378 2.211 2.615 . 0 0 "[ . 1 . 2]" 1
1198 1 76 ALA HA 1 77 VAL HB . . 5.020 4.457 3.989 4.855 . 0 0 "[ . 1 . 2]" 1
1199 1 76 ALA HA 1 77 VAL QG . . 5.230 3.369 3.020 3.942 . 0 0 "[ . 1 . 2]" 1
1200 1 76 ALA HA 1 127 TYR HA . . 3.680 2.176 1.958 2.915 . 0 0 "[ . 1 . 2]" 1
1201 1 76 ALA HA 1 127 TYR HB2 . . 4.790 4.443 3.802 4.861 0.071 15 0 "[ . 1 . 2]" 1
1202 1 76 ALA HA 1 128 TYR H . . 4.850 2.954 2.519 3.365 . 0 0 "[ . 1 . 2]" 1
1203 1 76 ALA HA 1 128 TYR QD . . 4.750 3.006 2.353 3.759 . 0 0 "[ . 1 . 2]" 1
1204 1 76 ALA MB 1 77 VAL H . . 3.440 2.482 2.109 2.727 . 0 0 "[ . 1 . 2]" 1
1205 1 76 ALA MB 1 127 TYR HA . . 3.980 2.736 2.316 3.103 . 0 0 "[ . 1 . 2]" 1
1206 1 76 ALA MB 1 127 TYR HB2 . . 4.480 3.602 2.924 3.979 . 0 0 "[ . 1 . 2]" 1
1207 1 76 ALA MB 1 127 TYR HB3 . . 4.650 4.600 4.345 4.752 0.102 15 0 "[ . 1 . 2]" 1
1208 1 76 ALA MB 1 127 TYR QD . . 2.860 2.500 2.090 2.916 0.056 18 0 "[ . 1 . 2]" 1
1209 1 76 ALA MB 1 127 TYR QE . . 3.880 3.213 2.534 4.007 0.127 6 0 "[ . 1 . 2]" 1
1210 1 76 ALA MB 1 128 TYR H . . 5.020 3.682 3.243 4.022 . 0 0 "[ . 1 . 2]" 1
1211 1 76 ALA MB 1 128 TYR QD . . 5.500 4.532 4.045 5.125 . 0 0 "[ . 1 . 2]" 1
1212 1 77 VAL H 1 77 VAL HB . . 3.710 2.909 2.645 3.402 . 0 0 "[ . 1 . 2]" 1
1213 1 77 VAL H 1 77 VAL QG . . 3.950 2.893 2.612 3.272 . 0 0 "[ . 1 . 2]" 1
1214 1 77 VAL H 1 126 LEU H . . 3.980 3.582 3.041 4.051 0.071 15 0 "[ . 1 . 2]" 1
1215 1 77 VAL H 1 126 LEU HB2 . . 4.530 3.017 2.594 3.616 . 0 0 "[ . 1 . 2]" 1
1216 1 77 VAL H 1 126 LEU HB3 . . 4.740 3.957 2.983 4.780 0.040 15 0 "[ . 1 . 2]" 1
1217 1 77 VAL H 1 126 LEU QD . . 5.180 4.211 3.855 4.635 . 0 0 "[ . 1 . 2]" 1
1218 1 77 VAL H 1 128 TYR QE . . 5.500 4.219 3.206 4.861 . 0 0 "[ . 1 . 2]" 1
1219 1 77 VAL HA 1 77 VAL QG . . 3.300 2.189 2.082 2.262 . 0 0 "[ . 1 . 2]" 1
1220 1 77 VAL HA 1 78 SER H . . 3.090 2.460 2.117 2.680 . 0 0 "[ . 1 . 2]" 1
1221 1 77 VAL HB 1 78 SER H . . 4.670 4.476 4.008 4.700 0.030 17 0 "[ . 1 . 2]" 1
1222 1 77 VAL HB 1 126 LEU QD . . 3.250 2.703 2.119 3.367 0.117 6 0 "[ . 1 . 2]" 1
1223 1 77 VAL HB 1 128 TYR QE . . 2.980 2.659 2.067 3.062 0.082 17 0 "[ . 1 . 2]" 1
1224 1 77 VAL QG 1 78 SER H . . 3.950 3.560 2.470 3.778 . 0 0 "[ . 1 . 2]" 1
1225 1 77 VAL QG 1 99 VAL H . . 4.620 4.361 4.115 4.467 . 0 0 "[ . 1 . 2]" 1
1226 1 77 VAL QG 1 99 VAL QG . . 2.920 1.765 1.629 1.997 . 0 0 "[ . 1 . 2]" 1
1227 1 77 VAL QG 1 126 LEU H . . 5.210 4.479 3.664 4.896 . 0 0 "[ . 1 . 2]" 1
1228 1 77 VAL QG 1 126 LEU HB2 . . 4.820 3.131 1.999 3.527 . 0 0 "[ . 1 . 2]" 1
1229 1 77 VAL QG 1 126 LEU HB3 . . 5.080 3.729 2.026 4.290 . 0 0 "[ . 1 . 2]" 1
1230 1 77 VAL QG 1 126 LEU QD . . 3.400 2.500 1.672 3.129 . 0 0 "[ . 1 . 2]" 1
1231 1 77 VAL QG 1 128 TYR QB . . 5.500 4.263 3.255 5.162 . 0 0 "[ . 1 . 2]" 1
1232 1 77 VAL QG 1 128 TYR QD . . 5.470 2.780 2.144 3.828 . 0 0 "[ . 1 . 2]" 1
1233 1 77 VAL QG 1 128 TYR QE . . 3.150 2.477 2.075 3.110 . 0 0 "[ . 1 . 2]" 1
1234 1 78 SER H 1 79 GLY H . . 5.290 4.459 4.245 4.671 . 0 0 "[ . 1 . 2]" 1
1235 1 78 SER HA 1 79 GLY H . . 3.030 2.411 2.132 2.853 . 0 0 "[ . 1 . 2]" 1
1236 1 78 SER HA 1 79 GLY HA2 . . 5.370 4.519 4.325 4.734 . 0 0 "[ . 1 . 2]" 1
1237 1 78 SER HA 1 124 LEU HB3 . . 5.150 3.384 2.080 5.588 0.438 15 0 "[ . 1 . 2]" 1
1238 1 78 SER HA 1 124 LEU QD . . 4.950 3.758 2.122 4.500 . 0 0 "[ . 1 . 2]" 1
1239 1 78 SER HA 1 125 ASN H . . 5.470 4.364 3.732 5.448 . 0 0 "[ . 1 . 2]" 1
1240 1 78 SER HA 1 125 ASN HA . . 3.530 2.918 2.169 3.587 0.057 11 0 "[ . 1 . 2]" 1
1241 1 78 SER HA 1 126 LEU H . . 3.660 2.825 2.148 3.723 0.063 20 0 "[ . 1 . 2]" 1
1242 1 78 SER QB 1 79 GLY H . . 3.550 2.628 2.118 3.466 . 0 0 "[ . 1 . 2]" 1
1243 1 78 SER QB 1 124 LEU HB3 . . 5.500 4.658 3.552 6.458 0.958 1 2 "[+ . 1 - 2]" 1
1244 1 78 SER QB 1 124 LEU QD . . 5.500 4.744 3.443 5.238 . 0 0 "[ . 1 . 2]" 1
1245 1 78 SER QB 1 125 ASN HA . . 3.830 2.438 1.980 3.002 . 0 0 "[ . 1 . 2]" 1
1246 1 78 SER QB 1 125 ASN HB2 . . 5.010 4.160 2.943 5.078 0.068 18 0 "[ . 1 . 2]" 1
1247 1 78 SER QB 1 125 ASN HB3 . . 5.350 4.886 4.086 5.439 0.089 20 0 "[ . 1 . 2]" 1
1248 1 78 SER QB 1 125 ASN HD21 . . 5.500 3.868 2.221 5.783 0.283 13 0 "[ . 1 . 2]" 1
1249 1 78 SER QB 1 126 LEU H . . 5.360 2.887 2.074 3.956 . 0 0 "[ . 1 . 2]" 1
1250 1 79 GLY H 1 124 LEU HB3 . . 4.070 3.370 2.366 4.482 0.412 1 0 "[ . 1 . 2]" 1
1251 1 79 GLY H 1 124 LEU QD . . 4.420 3.630 2.182 4.193 . 0 0 "[ . 1 . 2]" 1
1252 1 79 GLY HA2 1 80 GLY H . . 3.530 3.049 2.211 3.617 0.087 7 0 "[ . 1 . 2]" 1
1253 1 79 GLY HA2 1 124 LEU QD . . 5.390 4.248 3.342 5.284 . 0 0 "[ . 1 . 2]" 1
1254 1 79 GLY HA3 1 124 LEU QD . . 4.560 3.163 2.323 4.299 . 0 0 "[ . 1 . 2]" 1
1255 1 80 GLY H 1 81 VAL H . . 4.870 4.243 3.047 4.655 . 0 0 "[ . 1 . 2]" 1
1256 1 80 GLY H 1 124 LEU QD . . 5.500 4.682 3.365 5.410 . 0 0 "[ . 1 . 2]" 1
1257 1 80 GLY HA3 1 81 VAL H . . 3.450 2.990 2.434 3.580 0.130 15 0 "[ . 1 . 2]" 1
1258 1 80 GLY HA3 1 81 VAL QG . . 5.500 4.351 3.891 4.834 . 0 0 "[ . 1 . 2]" 1
1259 1 81 VAL H 1 82 VAL H . . 5.180 4.379 4.144 4.540 . 0 0 "[ . 1 . 2]" 1
1260 1 81 VAL HA 1 82 VAL H . . 3.040 2.506 2.241 2.740 . 0 0 "[ . 1 . 2]" 1
1261 1 81 VAL HA 1 82 VAL HA . . 4.360 4.432 4.274 4.450 0.090 1 0 "[ . 1 . 2]" 1
1262 1 81 VAL HA 1 82 VAL QG . . 4.990 3.705 2.868 4.436 . 0 0 "[ . 1 . 2]" 1
1263 1 81 VAL QG 1 82 VAL H . . 4.050 2.053 1.616 2.905 . 0 0 "[ . 1 . 2]" 1
1264 1 81 VAL QG 1 82 VAL HA . . 5.050 3.390 2.678 4.257 . 0 0 "[ . 1 . 2]" 1
1265 1 81 VAL QG 1 82 VAL QG . . 5.500 3.452 2.874 3.924 . 0 0 "[ . 1 . 2]" 1
1266 1 81 VAL QG 1 83 ASP H . . 5.500 4.511 3.923 5.384 . 0 0 "[ . 1 . 2]" 1
1267 1 82 VAL H 1 82 VAL HB . . 4.140 3.326 2.626 3.877 . 0 0 "[ . 1 . 2]" 1
1268 1 82 VAL H 1 82 VAL QG . . 3.720 2.410 2.012 2.714 . 0 0 "[ . 1 . 2]" 1
1269 1 82 VAL HA 1 83 ASP H . . 3.270 2.455 2.254 2.890 . 0 0 "[ . 1 . 2]" 1
1270 1 82 VAL HB 1 83 ASP H . . 3.850 3.576 2.120 3.932 0.082 3 0 "[ . 1 . 2]" 1
1271 1 82 VAL QG 1 83 ASP H . . 3.920 2.259 1.911 3.152 . 0 0 "[ . 1 . 2]" 1
1272 1 82 VAL QG 1 83 ASP HB2 . . 5.500 4.079 3.071 5.280 . 0 0 "[ . 1 . 2]" 1
1273 1 82 VAL QG 1 83 ASP HB3 . . 5.500 4.150 3.302 5.331 . 0 0 "[ . 1 . 2]" 1
1274 1 82 VAL QG 1 84 GLY H . . 5.300 3.650 1.792 5.173 . 0 0 "[ . 1 . 2]" 1
1275 1 82 VAL QG 1 84 GLY HA3 . . 5.490 3.991 3.220 5.265 . 0 0 "[ . 1 . 2]" 1
1276 1 83 ASP H 1 83 ASP HB2 . . 3.530 2.641 2.117 3.635 0.105 19 0 "[ . 1 . 2]" 1
1277 1 83 ASP H 1 83 ASP HB3 . . 3.670 2.948 2.236 3.718 0.048 4 0 "[ . 1 . 2]" 1
1278 1 83 ASP H 1 84 GLY H . . 5.440 4.077 2.531 4.634 . 0 0 "[ . 1 . 2]" 1
1279 1 83 ASP HB3 1 84 GLY H . . 5.500 4.148 3.044 4.570 . 0 0 "[ . 1 . 2]" 1
1280 1 84 GLY H 1 85 GLU H . . 4.390 3.302 2.304 4.463 0.073 10 0 "[ . 1 . 2]" 1
1281 1 85 GLU H 1 85 GLU HB2 . . 4.110 3.023 2.343 3.975 . 0 0 "[ . 1 . 2]" 1
1282 1 85 GLU H 1 85 GLU HB3 . . 3.980 3.611 2.732 4.073 0.093 3 0 "[ . 1 . 2]" 1
1283 1 85 GLU H 1 85 GLU HG2 . . 4.350 3.945 2.396 5.068 0.718 13 2 "[ . 1 + - 2]" 1
1284 1 91 GLU H 1 91 GLU HB3 . . 3.960 3.378 2.440 3.730 . 0 0 "[ . 1 . 2]" 1
1285 1 91 GLU H 1 91 GLU HG2 . . 4.210 3.806 2.171 4.412 0.202 3 0 "[ . 1 . 2]" 1
1286 1 91 GLU H 1 91 GLU HG3 . . 4.350 3.458 2.652 4.307 . 0 0 "[ . 1 . 2]" 1
1287 1 91 GLU HA 1 91 GLU HG2 . . 3.980 2.563 2.097 3.957 . 0 0 "[ . 1 . 2]" 1
1288 1 91 GLU HA 1 91 GLU HG3 . . 3.910 3.028 2.481 3.842 . 0 0 "[ . 1 . 2]" 1
1289 1 91 GLU HA 1 92 PRO QD . . 3.340 2.163 1.903 2.339 . 0 0 "[ . 1 . 2]" 1
1290 1 91 GLU HA 1 92 PRO HG2 . . 5.110 4.624 4.255 4.859 . 0 0 "[ . 1 . 2]" 1
1291 1 91 GLU HB2 1 92 PRO QD . . 4.120 3.523 1.999 4.308 0.188 20 0 "[ . 1 . 2]" 1
1292 1 91 GLU HB3 1 92 PRO QD . . 4.540 2.645 2.115 3.953 . 0 0 "[ . 1 . 2]" 1
1293 1 91 GLU HG2 1 92 PRO QD . . 4.870 2.987 2.100 4.686 . 0 0 "[ . 1 . 2]" 1
1294 1 91 GLU HG3 1 92 PRO QD . . 4.800 3.736 2.040 4.286 . 0 0 "[ . 1 . 2]" 1
1295 1 92 PRO HA 1 114 ARG QB . . 4.160 3.075 2.027 4.151 . 0 0 "[ . 1 . 2]" 1
1296 1 92 PRO HA 1 114 ARG QD . . 4.490 4.084 3.182 4.597 0.107 14 0 "[ . 1 . 2]" 1
1297 1 92 PRO QB 1 112 VAL QG . . 3.910 2.872 2.065 3.817 . 0 0 "[ . 1 . 2]" 1
1298 1 92 PRO QB 1 114 ARG QB . . 2.860 2.128 1.946 2.616 . 0 0 "[ . 1 . 2]" 1
1299 1 92 PRO QB 1 114 ARG QD . . 5.430 2.306 2.040 2.962 . 0 0 "[ . 1 . 2]" 1
1300 1 92 PRO QD 1 114 ARG QB . . 4.220 3.061 2.622 3.416 . 0 0 "[ . 1 . 2]" 1
1301 1 92 PRO HG2 1 112 VAL QG . . 4.910 4.448 3.000 4.985 0.075 4 0 "[ . 1 . 2]" 1
1302 1 92 PRO HG2 1 114 ARG QD . . 5.190 4.212 2.666 5.475 0.285 17 0 "[ . 1 . 2]" 1
1303 1 92 PRO HG3 1 112 VAL QG . . 5.400 4.474 2.905 5.229 . 0 0 "[ . 1 . 2]" 1
1304 1 92 PRO HG3 1 114 ARG QD . . 5.400 3.135 2.305 4.292 . 0 0 "[ . 1 . 2]" 1
1305 1 93 MET H 1 93 MET HG2 . . 5.450 3.273 1.878 4.512 . 0 0 "[ . 1 . 2]" 1
1306 1 93 MET HA 1 94 GLN H . . 3.270 2.200 2.028 2.420 . 0 0 "[ . 1 . 2]" 1
1307 1 93 MET HA 1 94 GLN QG . . 5.500 5.370 4.598 5.608 0.108 1 0 "[ . 1 . 2]" 1
1308 1 93 MET QB 1 94 GLN H . . 4.140 3.412 2.501 3.849 . 0 0 "[ . 1 . 2]" 1
1309 1 93 MET HG2 1 94 GLN H . . 5.500 4.612 2.544 5.848 0.348 17 0 "[ . 1 . 2]" 1
1310 1 94 GLN H 1 94 GLN HB2 . . 3.480 2.649 2.256 3.717 0.237 7 0 "[ . 1 . 2]" 1
1311 1 94 GLN H 1 94 GLN HB3 . . 4.100 2.947 2.543 3.729 . 0 0 "[ . 1 . 2]" 1
1312 1 94 GLN H 1 94 GLN QG . . 4.840 3.770 2.684 4.143 . 0 0 "[ . 1 . 2]" 1
1313 1 94 GLN HA 1 94 GLN HE21 . . 5.270 4.528 3.978 5.363 0.093 7 0 "[ . 1 . 2]" 1
1314 1 94 GLN HA 1 94 GLN QG . . 3.830 2.258 2.009 3.345 . 0 0 "[ . 1 . 2]" 1
1315 1 94 GLN HA 1 95 TRP H . . 2.980 2.268 1.981 2.430 . 0 0 "[ . 1 . 2]" 1
1316 1 94 GLN HA 1 95 TRP HB2 . . 4.880 4.199 3.920 4.607 . 0 0 "[ . 1 . 2]" 1
1317 1 94 GLN HA 1 111 LEU H . . 4.700 4.623 4.238 4.782 0.082 19 0 "[ . 1 . 2]" 1
1318 1 94 GLN HA 1 112 VAL QG . . 4.120 3.243 2.461 3.865 . 0 0 "[ . 1 . 2]" 1
1319 1 94 GLN HA 1 113 PHE H . . 4.900 4.483 3.269 4.975 0.075 18 0 "[ . 1 . 2]" 1
1320 1 94 GLN HB2 1 94 GLN HE22 . . 4.880 4.641 4.092 5.327 0.447 10 0 "[ . 1 . 2]" 1
1321 1 94 GLN HB2 1 95 TRP H . . 4.320 4.141 2.403 4.399 0.079 2 0 "[ . 1 . 2]" 1
1322 1 94 GLN HB3 1 94 GLN HE22 . . 4.960 4.205 3.609 5.281 0.321 16 0 "[ . 1 . 2]" 1
1323 1 94 GLN HB3 1 95 TRP H . . 4.120 3.611 2.523 4.388 0.268 16 0 "[ . 1 . 2]" 1
1324 1 94 GLN HE21 1 96 VAL QG . . 4.900 2.457 1.847 3.917 . 0 0 "[ . 1 . 2]" 1
1325 1 94 GLN HE22 1 96 VAL QG . . 3.840 2.887 1.997 3.637 . 0 0 "[ . 1 . 2]" 1
1326 1 94 GLN HE22 1 110 SER QB . . 5.500 4.641 3.855 5.609 0.109 6 0 "[ . 1 . 2]" 1
1327 1 94 GLN QG 1 95 TRP H . . 3.720 2.634 2.006 3.600 . 0 0 "[ . 1 . 2]" 1
1328 1 94 GLN QG 1 96 VAL QG . . 3.740 3.109 2.229 3.834 0.094 5 0 "[ . 1 . 2]" 1
1329 1 94 GLN QG 1 110 SER HA . . 5.500 5.001 4.264 5.589 0.089 10 0 "[ . 1 . 2]" 1
1330 1 94 GLN QG 1 110 SER QB . . 5.450 4.381 3.210 5.110 . 0 0 "[ . 1 . 2]" 1
1331 1 94 GLN QG 1 111 LEU H . . 4.860 4.064 2.867 4.949 0.089 12 0 "[ . 1 . 2]" 1
1332 1 94 GLN QG 1 112 VAL QG . . 3.690 2.497 1.949 3.741 0.051 7 0 "[ . 1 . 2]" 1
1333 1 95 TRP H 1 95 TRP HB2 . . 3.960 2.656 2.305 3.044 . 0 0 "[ . 1 . 2]" 1
1334 1 95 TRP H 1 96 VAL H . . 4.600 4.154 3.366 4.469 . 0 0 "[ . 1 . 2]" 1
1335 1 95 TRP H 1 96 VAL QG . . 5.330 3.737 3.187 4.139 . 0 0 "[ . 1 . 2]" 1
1336 1 95 TRP H 1 111 LEU H . . 4.380 2.863 2.598 3.397 . 0 0 "[ . 1 . 2]" 1
1337 1 95 TRP H 1 111 LEU QB . . 4.890 3.064 2.114 4.432 . 0 0 "[ . 1 . 2]" 1
1338 1 95 TRP H 1 111 LEU QD . . 5.270 3.777 2.546 4.785 . 0 0 "[ . 1 . 2]" 1
1339 1 95 TRP HA 1 96 VAL H . . 3.060 2.232 1.904 2.371 . 0 0 "[ . 1 . 2]" 1
1340 1 95 TRP HA 1 96 VAL HA . . 4.930 4.469 4.225 4.551 . 0 0 "[ . 1 . 2]" 1
1341 1 95 TRP HA 1 96 VAL HB . . 4.780 4.732 4.197 4.899 0.119 6 0 "[ . 1 . 2]" 1
1342 1 95 TRP HA 1 96 VAL QG . . 5.110 3.711 2.624 4.056 . 0 0 "[ . 1 . 2]" 1
1343 1 95 TRP HA 1 111 LEU H . . 5.350 4.700 4.336 5.087 . 0 0 "[ . 1 . 2]" 1
1344 1 95 TRP HA 1 111 LEU QD . . 5.320 4.690 3.995 5.218 . 0 0 "[ . 1 . 2]" 1
1345 1 95 TRP HB2 1 96 VAL H . . 5.310 4.455 4.004 4.750 . 0 0 "[ . 1 . 2]" 1
1346 1 95 TRP HB2 1 111 LEU H . . 4.780 3.692 3.074 4.449 . 0 0 "[ . 1 . 2]" 1
1347 1 95 TRP HB2 1 111 LEU QB . . 4.180 2.362 1.958 3.790 . 0 0 "[ . 1 . 2]" 1
1348 1 95 TRP HB2 1 111 LEU QD . . 4.440 2.591 1.996 3.197 . 0 0 "[ . 1 . 2]" 1
1349 1 95 TRP HB3 1 96 VAL H . . 4.390 3.516 2.838 4.264 . 0 0 "[ . 1 . 2]" 1
1350 1 95 TRP HB3 1 97 VAL MG2 . . 4.140 3.432 2.499 4.218 0.078 14 0 "[ . 1 . 2]" 1
1351 1 95 TRP HB3 1 111 LEU H . . 5.500 3.606 2.889 4.621 . 0 0 "[ . 1 . 2]" 1
1352 1 95 TRP HB3 1 111 LEU QB . . 4.320 2.822 2.219 4.016 . 0 0 "[ . 1 . 2]" 1
1353 1 95 TRP HB3 1 111 LEU QD . . 4.250 3.078 2.262 3.795 . 0 0 "[ . 1 . 2]" 1
1354 1 95 TRP HE3 1 97 VAL MG2 . . 4.800 3.089 2.238 4.767 . 0 0 "[ . 1 . 2]" 1
1355 1 95 TRP HE3 1 111 LEU QB . . 4.310 3.945 2.934 4.244 . 0 0 "[ . 1 . 2]" 1
1356 1 95 TRP HE3 1 111 LEU QD . . 3.970 3.033 2.039 3.950 . 0 0 "[ . 1 . 2]" 1
1357 1 96 VAL H 1 96 VAL HB . . 3.440 2.811 2.520 3.486 0.046 6 0 "[ . 1 . 2]" 1
1358 1 96 VAL H 1 96 VAL QG . . 3.850 2.768 2.096 3.165 . 0 0 "[ . 1 . 2]" 1
1359 1 96 VAL H 1 97 VAL H . . 4.860 4.277 3.582 4.569 . 0 0 "[ . 1 . 2]" 1
1360 1 96 VAL HA 1 96 VAL QG . . 3.290 2.174 2.097 2.477 . 0 0 "[ . 1 . 2]" 1
1361 1 96 VAL HA 1 97 VAL H . . 2.970 2.244 2.110 2.457 . 0 0 "[ . 1 . 2]" 1
1362 1 96 VAL HA 1 110 SER HA . . 3.340 2.287 2.034 2.537 . 0 0 "[ . 1 . 2]" 1
1363 1 96 VAL HA 1 110 SER QB . . 4.460 3.338 2.557 4.197 . 0 0 "[ . 1 . 2]" 1
1364 1 96 VAL HA 1 111 LEU H . . 4.060 3.637 3.112 4.078 0.018 20 0 "[ . 1 . 2]" 1
1365 1 96 VAL HB 1 110 SER HA . . 5.370 4.904 2.232 5.421 0.051 1 0 "[ . 1 . 2]" 1
1366 1 96 VAL QG 1 97 VAL H . . 4.190 2.651 2.293 3.514 . 0 0 "[ . 1 . 2]" 1
1367 1 96 VAL QG 1 110 SER HA . . 3.920 2.859 2.281 3.302 . 0 0 "[ . 1 . 2]" 1
1368 1 96 VAL QG 1 110 SER QB . . 4.180 2.365 2.007 3.382 . 0 0 "[ . 1 . 2]" 1
1369 1 96 VAL QG 1 111 LEU H . . 4.620 3.755 3.237 4.112 . 0 0 "[ . 1 . 2]" 1
1370 1 97 VAL H 1 97 VAL HB . . 3.440 3.042 2.692 3.537 0.097 14 0 "[ . 1 . 2]" 1
1371 1 97 VAL H 1 97 VAL MG2 . . 3.330 2.548 1.932 2.875 . 0 0 "[ . 1 . 2]" 1
1372 1 97 VAL H 1 98 THR H . . 5.270 4.194 3.840 4.512 . 0 0 "[ . 1 . 2]" 1
1373 1 97 VAL H 1 109 LYS HB2 . . 5.400 4.316 3.815 4.735 . 0 0 "[ . 1 . 2]" 1
1374 1 97 VAL H 1 109 LYS HB3 . . 4.630 4.643 4.225 5.498 0.868 14 3 "[ * - 1 +. 2]" 1
1375 1 97 VAL H 1 110 SER HA . . 3.790 3.598 3.121 3.845 0.055 10 0 "[ . 1 . 2]" 1
1376 1 97 VAL HA 1 98 THR H . . 2.890 2.232 2.115 2.303 . 0 0 "[ . 1 . 2]" 1
1377 1 97 VAL HB 1 98 THR H . . 5.070 3.921 3.023 4.432 . 0 0 "[ . 1 . 2]" 1
1378 1 97 VAL HB 1 109 LYS H . . 4.780 3.566 2.670 4.840 0.060 5 0 "[ . 1 . 2]" 1
1379 1 97 VAL MG1 1 98 THR H . . 4.020 3.065 2.351 3.962 . 0 0 "[ . 1 . 2]" 1
1380 1 97 VAL MG2 1 109 LYS H . . 4.670 3.928 2.292 4.691 0.021 7 0 "[ . 1 . 2]" 1
1381 1 98 THR H 1 98 THR HB . . 3.600 2.859 2.399 3.250 . 0 0 "[ . 1 . 2]" 1
1382 1 98 THR H 1 99 VAL H . . 5.380 4.079 3.556 4.472 . 0 0 "[ . 1 . 2]" 1
1383 1 98 THR HA 1 98 THR MG . . 3.340 2.310 2.135 2.494 . 0 0 "[ . 1 . 2]" 1
1384 1 98 THR HA 1 99 VAL H . . 2.880 2.215 2.112 2.409 . 0 0 "[ . 1 . 2]" 1
1385 1 98 THR HA 1 99 VAL QG . . 5.320 3.594 3.156 4.163 . 0 0 "[ . 1 . 2]" 1
1386 1 98 THR HA 1 105 GLU QG . . 4.740 4.391 3.743 4.819 0.079 18 0 "[ . 1 . 2]" 1
1387 1 98 THR HA 1 108 LYS HA . . 3.450 2.414 2.049 3.028 . 0 0 "[ . 1 . 2]" 1
1388 1 98 THR HA 1 108 LYS HB2 . . 4.190 4.142 2.917 5.034 0.844 15 2 "[ . 1 - + 2]" 1
1389 1 98 THR HA 1 108 LYS HB3 . . 5.050 4.396 3.686 5.128 0.078 1 0 "[ . 1 . 2]" 1
1390 1 98 THR HA 1 109 LYS H . . 4.170 3.749 3.287 4.251 0.081 15 0 "[ . 1 . 2]" 1
1391 1 98 THR HB 1 99 VAL H . . 4.630 4.278 4.064 4.500 . 0 0 "[ . 1 . 2]" 1
1392 1 98 THR HB 1 100 TYR QR . . 4.110 2.862 2.227 3.446 . 0 0 "[ . 1 . 2]" 1
1393 1 98 THR HB 1 100 TYR QE . . 3.420 2.899 2.236 3.494 0.074 7 0 "[ . 1 . 2]" 1
1394 1 98 THR MG 1 99 VAL H . . 3.430 3.076 2.611 3.528 0.098 9 0 "[ . 1 . 2]" 1
1395 1 98 THR MG 1 100 TYR QD . . 4.490 3.798 3.411 4.561 0.071 4 0 "[ . 1 . 2]" 1
1396 1 98 THR MG 1 100 TYR QR . . 3.950 2.809 2.418 3.521 . 0 0 "[ . 1 . 2]" 1
1397 1 98 THR MG 1 100 TYR QE . . 3.560 2.900 2.447 3.663 0.103 4 0 "[ . 1 . 2]" 1
1398 1 98 THR MG 1 105 GLU HA . . 4.630 4.058 3.503 4.716 0.086 14 0 "[ . 1 . 2]" 1
1399 1 98 THR MG 1 105 GLU QB . . 5.000 3.438 2.179 4.374 . 0 0 "[ . 1 . 2]" 1
1400 1 98 THR MG 1 105 GLU QG . . 3.700 2.342 1.991 2.828 . 0 0 "[ . 1 . 2]" 1
1401 1 98 THR MG 1 107 GLU H . . 4.350 3.932 3.417 4.443 0.093 15 0 "[ . 1 . 2]" 1
1402 1 98 THR MG 1 108 LYS HA . . 4.480 3.042 2.250 4.047 . 0 0 "[ . 1 . 2]" 1
1403 1 98 THR MG 1 108 LYS QE . . 4.780 3.973 1.877 4.684 . 0 0 "[ . 1 . 2]" 1
1404 1 99 VAL H 1 99 VAL HB . . 3.510 2.628 2.385 3.343 . 0 0 "[ . 1 . 2]" 1
1405 1 99 VAL H 1 99 VAL QG . . 3.750 2.329 1.759 2.582 . 0 0 "[ . 1 . 2]" 1
1406 1 99 VAL H 1 105 GLU QG . . 5.210 4.177 3.347 5.095 . 0 0 "[ . 1 . 2]" 1
1407 1 99 VAL H 1 107 GLU H . . 4.220 3.311 2.902 3.974 . 0 0 "[ . 1 . 2]" 1
1408 1 99 VAL H 1 107 GLU HB3 . . 4.710 2.690 1.735 4.011 . 0 0 "[ . 1 . 2]" 1
1409 1 99 VAL H 1 107 GLU QG . . 5.500 4.179 3.327 4.911 . 0 0 "[ . 1 . 2]" 1
1410 1 99 VAL HA 1 100 TYR H . . 2.950 2.210 2.081 2.526 . 0 0 "[ . 1 . 2]" 1
1411 1 99 VAL HA 1 100 TYR QR . . 4.810 3.438 2.941 4.459 . 0 0 "[ . 1 . 2]" 1
1412 1 99 VAL HB 1 107 GLU H . . 4.540 3.515 2.731 4.582 0.042 2 0 "[ . 1 . 2]" 1
1413 1 99 VAL HB 1 107 GLU QG . . 4.530 3.992 3.164 4.428 . 0 0 "[ . 1 . 2]" 1
1414 1 99 VAL HB 1 128 TYR QE . . 5.110 4.558 3.837 5.195 0.085 16 0 "[ . 1 . 2]" 1
1415 1 99 VAL QG 1 100 TYR H . . 4.550 2.596 2.277 3.626 . 0 0 "[ . 1 . 2]" 1
1416 1 99 VAL QG 1 107 GLU HB2 . . 4.940 3.245 2.157 4.634 . 0 0 "[ . 1 . 2]" 1
1417 1 99 VAL QG 1 107 GLU QG . . 5.290 3.084 2.238 3.969 . 0 0 "[ . 1 . 2]" 1
1418 1 99 VAL QG 1 128 TYR QD . . 5.500 3.900 3.515 4.313 . 0 0 "[ . 1 . 2]" 1
1419 1 99 VAL QG 1 128 TYR QE . . 3.790 3.015 2.073 3.688 . 0 0 "[ . 1 . 2]" 1
1420 1 100 TYR H 1 100 TYR HB2 . . 3.910 2.624 2.434 2.980 . 0 0 "[ . 1 . 2]" 1
1421 1 100 TYR H 1 100 TYR HB3 . . 4.200 3.730 3.631 3.950 . 0 0 "[ . 1 . 2]" 1
1422 1 100 TYR H 1 100 TYR QD . . 3.310 2.704 2.325 3.262 . 0 0 "[ . 1 . 2]" 1
1423 1 100 TYR H 1 100 TYR QR . . 3.800 2.687 2.318 3.224 . 0 0 "[ . 1 . 2]" 1
1424 1 100 TYR H 1 106 ILE MD . . 5.500 5.321 4.634 5.590 0.090 15 0 "[ . 1 . 2]" 1
1425 1 100 TYR HA 1 100 TYR QR . . 4.250 2.978 2.651 3.335 . 0 0 "[ . 1 . 2]" 1
1426 1 100 TYR HA 1 101 LYS H . . 2.960 2.255 2.059 2.626 . 0 0 "[ . 1 . 2]" 1
1427 1 100 TYR HA 1 101 LYS HB2 . . 4.880 4.261 3.851 4.455 . 0 0 "[ . 1 . 2]" 1
1428 1 100 TYR HA 1 101 LYS HB3 . . 5.320 5.074 4.637 5.358 0.038 14 0 "[ . 1 . 2]" 1
1429 1 100 TYR HA 1 104 LYS H . . 4.580 4.425 4.099 4.658 0.078 19 0 "[ . 1 . 2]" 1
1430 1 100 TYR HA 1 105 GLU HA . . 3.400 2.123 1.934 2.322 . 0 0 "[ . 1 . 2]" 1
1431 1 100 TYR HA 1 105 GLU QG . . 5.220 4.112 3.499 5.172 . 0 0 "[ . 1 . 2]" 1
1432 1 100 TYR HA 1 106 ILE H . . 3.780 2.931 2.468 3.689 . 0 0 "[ . 1 . 2]" 1
1433 1 100 TYR HA 1 106 ILE MD . . 5.310 4.802 4.082 5.293 . 0 0 "[ . 1 . 2]" 1
1434 1 100 TYR HA 1 106 ILE HG13 . . 5.500 4.482 3.742 5.373 . 0 0 "[ . 1 . 2]" 1
1435 1 100 TYR HA 1 106 ILE MG . . 4.530 3.861 2.735 4.596 0.066 15 0 "[ . 1 . 2]" 1
1436 1 100 TYR HB2 1 101 LYS H . . 4.470 3.798 3.041 4.247 . 0 0 "[ . 1 . 2]" 1
1437 1 100 TYR HB2 1 103 GLY H . . 5.330 5.309 4.913 5.409 0.079 9 0 "[ . 1 . 2]" 1
1438 1 100 TYR HB3 1 101 LYS H . . 3.960 2.836 2.103 3.495 . 0 0 "[ . 1 . 2]" 1
1439 1 100 TYR HB3 1 103 GLY H . . 4.450 4.238 3.978 4.477 0.027 17 0 "[ . 1 . 2]" 1
1440 1 100 TYR HB3 1 104 LYS H . . 4.370 3.689 3.124 4.419 0.049 20 0 "[ . 1 . 2]" 1
1441 1 100 TYR HB3 1 105 GLU HA . . 4.670 3.688 3.325 4.116 . 0 0 "[ . 1 . 2]" 1
1442 1 100 TYR QR 1 101 LYS H . . 4.980 4.028 3.722 4.435 . 0 0 "[ . 1 . 2]" 1
1443 1 100 TYR QR 1 103 GLY H . . 5.500 5.467 5.117 5.602 0.102 3 0 "[ . 1 . 2]" 1
1444 1 100 TYR QR 1 104 LYS H . . 4.820 4.207 3.542 4.805 . 0 0 "[ . 1 . 2]" 1
1445 1 100 TYR QR 1 104 LYS HA . . 4.200 3.558 2.437 4.250 0.050 3 0 "[ . 1 . 2]" 1
1446 1 100 TYR QR 1 105 GLU H . . 3.970 3.277 2.506 4.013 0.043 16 0 "[ . 1 . 2]" 1
1447 1 100 TYR QR 1 105 GLU HA . . 4.000 2.702 2.107 3.180 . 0 0 "[ . 1 . 2]" 1
1448 1 100 TYR QR 1 105 GLU QB . . 4.330 2.357 2.095 2.665 . 0 0 "[ . 1 . 2]" 1
1449 1 100 TYR QR 1 105 GLU QG . . 4.820 3.326 2.729 4.149 . 0 0 "[ . 1 . 2]" 1
1450 1 100 TYR QR 1 106 ILE H . . 5.500 4.507 4.046 4.939 . 0 0 "[ . 1 . 2]" 1
1451 1 100 TYR QD 1 105 GLU HA . . 3.750 2.755 2.122 3.283 . 0 0 "[ . 1 . 2]" 1
1452 1 101 LYS H 1 101 LYS HB2 . . 4.010 2.607 2.237 3.213 . 0 0 "[ . 1 . 2]" 1
1453 1 101 LYS H 1 101 LYS QG . . 4.890 4.128 3.839 4.310 . 0 0 "[ . 1 . 2]" 1
1454 1 101 LYS H 1 104 LYS H . . 3.770 3.055 2.558 3.596 . 0 0 "[ . 1 . 2]" 1
1455 1 101 LYS H 1 105 GLU HA . . 4.380 3.546 2.864 4.200 . 0 0 "[ . 1 . 2]" 1
1456 1 101 LYS HA 1 101 LYS HD3 . . 5.230 4.181 3.350 4.650 . 0 0 "[ . 1 . 2]" 1
1457 1 101 LYS HA 1 102 ASN H . . 3.030 2.644 2.421 2.892 . 0 0 "[ . 1 . 2]" 1
1458 1 101 LYS HA 1 103 GLY H . . 5.150 4.749 4.199 5.100 . 0 0 "[ . 1 . 2]" 1
1459 1 101 LYS HB2 1 101 LYS HE3 . . 5.500 4.314 3.919 4.690 . 0 0 "[ . 1 . 2]" 1
1460 1 101 LYS HB2 1 106 ILE HB . . 5.380 4.681 4.081 5.200 . 0 0 "[ . 1 . 2]" 1
1461 1 101 LYS HB2 1 106 ILE MG . . 3.660 2.380 1.998 3.359 . 0 0 "[ . 1 . 2]" 1
1462 1 101 LYS HB3 1 101 LYS HE2 . . 5.080 4.618 2.752 5.073 . 0 0 "[ . 1 . 2]" 1
1463 1 101 LYS HB3 1 102 ASN H . . 5.020 2.672 2.289 3.277 . 0 0 "[ . 1 . 2]" 1
1464 1 101 LYS HD3 1 102 ASN QD . . 5.500 4.049 2.662 4.851 . 0 0 "[ . 1 . 2]" 1
1465 1 101 LYS HD3 1 106 ILE MG . . 5.060 3.245 2.298 4.668 . 0 0 "[ . 1 . 2]" 1
1466 1 101 LYS HE2 1 102 ASN QD . . 5.110 3.520 2.639 4.492 . 0 0 "[ . 1 . 2]" 1
1467 1 101 LYS HE2 1 106 ILE MD . . 5.500 4.187 3.306 5.014 . 0 0 "[ . 1 . 2]" 1
1468 1 101 LYS HE2 1 106 ILE MG . . 5.500 4.948 4.321 5.584 0.084 7 0 "[ . 1 . 2]" 1
1469 1 101 LYS HE3 1 102 ASN QD . . 5.020 3.874 3.011 4.673 . 0 0 "[ . 1 . 2]" 1
1470 1 101 LYS QG 1 102 ASN H . . 4.710 1.970 1.624 2.426 . 0 0 "[ . 1 . 2]" 1
1471 1 101 LYS QG 1 102 ASN QD . . 5.180 2.429 1.934 3.257 . 0 0 "[ . 1 . 2]" 1
1472 1 102 ASN H 1 102 ASN QD . . 4.420 2.404 1.815 3.619 . 0 0 "[ . 1 . 2]" 1
1473 1 102 ASN H 1 103 GLY H . . 3.900 3.809 3.106 3.987 0.087 13 0 "[ . 1 . 2]" 1
1474 1 102 ASN H 1 104 LYS H . . 5.320 4.919 4.522 5.368 0.048 12 0 "[ . 1 . 2]" 1
1475 1 102 ASN HA 1 103 GLY H . . 3.460 2.505 2.099 3.322 . 0 0 "[ . 1 . 2]" 1
1476 1 102 ASN HA 1 104 LYS H . . 5.370 4.803 4.228 5.453 0.083 20 0 "[ . 1 . 2]" 1
1477 1 102 ASN HB2 1 103 GLY H . . 5.290 4.251 3.938 4.588 . 0 0 "[ . 1 . 2]" 1
1478 1 102 ASN HB3 1 103 GLY H . . 5.310 4.568 4.216 4.762 . 0 0 "[ . 1 . 2]" 1
1479 1 103 GLY H 1 104 LYS H . . 3.220 2.599 1.969 3.288 0.068 12 0 "[ . 1 . 2]" 1
1480 1 103 GLY HA3 1 104 LYS HA . . 5.210 4.737 4.562 4.908 . 0 0 "[ . 1 . 2]" 1
1481 1 104 LYS H 1 104 LYS HB2 . . 4.000 4.003 3.301 4.070 0.070 2 0 "[ . 1 . 2]" 1
1482 1 104 LYS H 1 104 LYS HB3 . . 3.490 3.493 3.115 3.585 0.095 8 0 "[ . 1 . 2]" 1
1483 1 104 LYS H 1 104 LYS QD . . 4.940 4.404 2.510 5.018 0.078 14 0 "[ . 1 . 2]" 1
1484 1 104 LYS H 1 104 LYS HG2 . . 4.500 3.030 2.633 4.584 0.084 14 0 "[ . 1 . 2]" 1
1485 1 104 LYS H 1 104 LYS HG3 . . 4.460 3.781 3.274 4.546 0.086 14 0 "[ . 1 . 2]" 1
1486 1 104 LYS H 1 105 GLU H . . 4.890 4.282 4.082 4.437 . 0 0 "[ . 1 . 2]" 1
1487 1 104 LYS H 1 106 ILE MG . . 5.440 4.382 3.340 5.080 . 0 0 "[ . 1 . 2]" 1
1488 1 104 LYS HA 1 104 LYS QD . . 4.380 4.240 3.804 4.471 0.091 11 0 "[ . 1 . 2]" 1
1489 1 104 LYS HA 1 104 LYS HG2 . . 4.140 3.744 3.013 3.920 . 0 0 "[ . 1 . 2]" 1
1490 1 104 LYS HA 1 104 LYS HG3 . . 4.130 3.778 2.229 4.203 0.073 10 0 "[ . 1 . 2]" 1
1491 1 104 LYS HA 1 105 GLU H . . 2.760 2.542 2.352 2.829 0.069 18 0 "[ . 1 . 2]" 1
1492 1 104 LYS HA 1 105 GLU QB . . 4.720 4.212 4.017 4.446 . 0 0 "[ . 1 . 2]" 1
1493 1 104 LYS HB2 1 104 LYS QE . . 4.960 3.862 3.177 4.263 . 0 0 "[ . 1 . 2]" 1
1494 1 104 LYS HB2 1 105 GLU H . . 3.060 2.346 1.944 3.909 0.849 14 1 "[ . 1 +. 2]" 1
1495 1 104 LYS HB3 1 105 GLU H . . 4.590 3.683 3.146 3.876 . 0 0 "[ . 1 . 2]" 1
1496 1 104 LYS QD 1 104 LYS HG2 . . 2.740 2.404 2.166 2.584 . 0 0 "[ . 1 . 2]" 1
1497 1 104 LYS QD 1 105 GLU H . . 4.550 4.217 3.630 4.646 0.096 16 0 "[ . 1 . 2]" 1
1498 1 104 LYS QE 1 104 LYS HG2 . . 3.430 2.489 2.166 3.324 . 0 0 "[ . 1 . 2]" 1
1499 1 104 LYS QE 1 106 ILE MG . . 4.080 3.455 1.825 4.202 0.122 10 0 "[ . 1 . 2]" 1
1500 1 104 LYS HG2 1 105 GLU H . . 4.890 4.107 1.878 4.586 . 0 0 "[ . 1 . 2]" 1
1501 1 104 LYS HG2 1 106 ILE MG . . 3.730 3.373 2.286 3.913 0.183 8 0 "[ . 1 . 2]" 1
1502 1 104 LYS HG3 1 105 GLU H . . 4.500 3.355 2.555 3.992 . 0 0 "[ . 1 . 2]" 1
1503 1 105 GLU H 1 105 GLU QB . . 3.350 2.258 2.020 2.461 . 0 0 "[ . 1 . 2]" 1
1504 1 105 GLU HA 1 105 GLU QG . . 3.440 2.650 2.381 3.437 . 0 0 "[ . 1 . 2]" 1
1505 1 105 GLU HA 1 106 ILE H . . 2.920 2.264 2.159 2.380 . 0 0 "[ . 1 . 2]" 1
1506 1 105 GLU HA 1 106 ILE HA . . 4.740 4.494 4.426 4.576 . 0 0 "[ . 1 . 2]" 1
1507 1 105 GLU HA 1 106 ILE MD . . 5.500 5.485 5.030 5.600 0.100 5 0 "[ . 1 . 2]" 1
1508 1 105 GLU HA 1 106 ILE HG12 . . 4.720 4.118 3.592 4.358 . 0 0 "[ . 1 . 2]" 1
1509 1 105 GLU HA 1 106 ILE HG13 . . 5.500 4.832 4.144 5.280 . 0 0 "[ . 1 . 2]" 1
1510 1 105 GLU HA 1 106 ILE MG . . 4.680 3.796 3.412 4.053 . 0 0 "[ . 1 . 2]" 1
1511 1 105 GLU HA 1 107 GLU H . . 3.960 3.775 3.412 3.996 0.036 4 0 "[ . 1 . 2]" 1
1512 1 105 GLU QG 1 106 ILE H . . 3.750 2.696 2.208 3.741 . 0 0 "[ . 1 . 2]" 1
1513 1 105 GLU QG 1 106 ILE HA . . 3.870 3.835 3.490 3.957 0.087 1 0 "[ . 1 . 2]" 1
1514 1 105 GLU QG 1 107 GLU H . . 3.750 2.582 1.855 3.643 . 0 0 "[ . 1 . 2]" 1
1515 1 106 ILE H 1 106 ILE MD . . 4.130 4.077 3.829 4.201 0.071 10 0 "[ . 1 . 2]" 1
1516 1 106 ILE H 1 106 ILE HG12 . . 3.790 2.670 2.312 3.104 . 0 0 "[ . 1 . 2]" 1
1517 1 106 ILE H 1 106 ILE HG13 . . 4.120 2.769 2.259 3.182 . 0 0 "[ . 1 . 2]" 1
1518 1 106 ILE H 1 106 ILE MG . . 3.570 3.070 2.878 3.238 . 0 0 "[ . 1 . 2]" 1
1519 1 106 ILE H 1 107 GLU H . . 2.940 1.946 1.835 2.174 . 0 0 "[ . 1 . 2]" 1
1520 1 106 ILE H 1 107 GLU HA . . 4.980 4.661 4.573 4.881 . 0 0 "[ . 1 . 2]" 1
1521 1 106 ILE HA 1 106 ILE MD . . 4.400 4.145 4.054 4.220 . 0 0 "[ . 1 . 2]" 1
1522 1 106 ILE HA 1 106 ILE HG13 . . 4.080 3.685 3.644 3.714 . 0 0 "[ . 1 . 2]" 1
1523 1 106 ILE HA 1 106 ILE MG . . 3.070 2.301 2.230 2.394 . 0 0 "[ . 1 . 2]" 1
1524 1 106 ILE HB 1 106 ILE MD . . 3.550 2.288 2.188 2.395 . 0 0 "[ . 1 . 2]" 1
1525 1 106 ILE HB 1 107 GLU H . . 4.550 4.291 4.140 4.441 . 0 0 "[ . 1 . 2]" 1
1526 1 106 ILE MD 1 106 ILE MG . . 3.470 2.229 2.136 2.397 . 0 0 "[ . 1 . 2]" 1
1527 1 106 ILE MD 1 107 GLU H . . 5.050 4.505 4.209 4.858 . 0 0 "[ . 1 . 2]" 1
1528 1 106 ILE MD 1 107 GLU HA . . 5.500 5.227 4.707 5.589 0.089 16 0 "[ . 1 . 2]" 1
1529 1 106 ILE MD 1 107 GLU HB2 . . 5.180 3.687 3.133 4.381 . 0 0 "[ . 1 . 2]" 1
1530 1 106 ILE MD 1 128 TYR QB . . 5.500 4.473 3.840 4.864 . 0 0 "[ . 1 . 2]" 1
1531 1 106 ILE MD 1 128 TYR QD . . 3.490 3.507 3.023 3.627 0.137 16 0 "[ . 1 . 2]" 1
1532 1 106 ILE MD 1 128 TYR QE . . 4.110 2.472 2.080 2.995 . 0 0 "[ . 1 . 2]" 1
1533 1 106 ILE HG12 1 107 GLU H . . 4.740 3.859 3.421 4.118 . 0 0 "[ . 1 . 2]" 1
1534 1 106 ILE HG13 1 106 ILE MG . . 3.670 3.225 3.129 3.282 . 0 0 "[ . 1 . 2]" 1
1535 1 106 ILE HG13 1 107 GLU H . . 4.040 2.978 2.694 3.378 . 0 0 "[ . 1 . 2]" 1
1536 1 106 ILE HG13 1 107 GLU HB2 . . 4.600 2.895 2.367 3.811 . 0 0 "[ . 1 . 2]" 1
1537 1 106 ILE HG13 1 128 TYR QE . . 5.440 4.327 3.421 4.948 . 0 0 "[ . 1 . 2]" 1
1538 1 106 ILE MG 1 107 GLU H . . 4.310 4.350 4.210 4.401 0.091 11 0 "[ . 1 . 2]" 1
1539 1 106 ILE MG 1 128 TYR QE . . 5.460 5.020 4.417 5.551 0.091 11 0 "[ . 1 . 2]" 1
1540 1 107 GLU H 1 107 GLU QG . . 5.040 4.268 4.090 4.420 . 0 0 "[ . 1 . 2]" 1
1541 1 107 GLU H 1 108 LYS H . . 4.880 4.307 4.172 4.405 . 0 0 "[ . 1 . 2]" 1
1542 1 107 GLU HA 1 107 GLU QG . . 3.530 2.466 2.247 2.996 . 0 0 "[ . 1 . 2]" 1
1543 1 107 GLU HA 1 108 LYS H . . 2.690 2.336 2.232 2.612 . 0 0 "[ . 1 . 2]" 1
1544 1 107 GLU HA 1 126 LEU QD . . 5.500 4.692 4.022 5.084 . 0 0 "[ . 1 . 2]" 1
1545 1 107 GLU HB2 1 108 LYS H . . 4.480 4.088 3.827 4.324 . 0 0 "[ . 1 . 2]" 1
1546 1 107 GLU HB2 1 126 LEU QD . . 4.820 3.619 2.789 4.035 . 0 0 "[ . 1 . 2]" 1
1547 1 107 GLU HB2 1 128 TYR QE . . 5.020 4.273 3.649 4.688 . 0 0 "[ . 1 . 2]" 1
1548 1 107 GLU QG 1 108 LYS H . . 3.420 2.181 1.770 3.031 . 0 0 "[ . 1 . 2]" 1
1549 1 107 GLU QG 1 108 LYS HA . . 5.310 4.063 3.565 4.878 . 0 0 "[ . 1 . 2]" 1
1550 1 107 GLU QG 1 109 LYS H . . 5.070 4.280 2.708 4.940 . 0 0 "[ . 1 . 2]" 1
1551 1 107 GLU QG 1 109 LYS HG2 . . 4.700 3.940 2.604 5.485 0.785 3 1 "[ + . 1 . 2]" 1
1552 1 107 GLU QG 1 126 LEU QD . . 3.890 2.269 2.012 2.873 . 0 0 "[ . 1 . 2]" 1
1553 1 107 GLU QG 1 128 TYR QE . . 4.820 4.380 3.638 4.745 . 0 0 "[ . 1 . 2]" 1
1554 1 108 LYS H 1 108 LYS HB2 . . 3.930 3.662 2.850 4.118 0.188 14 0 "[ . 1 . 2]" 1
1555 1 108 LYS H 1 109 LYS H . . 4.470 3.655 2.587 4.225 . 0 0 "[ . 1 . 2]" 1
1556 1 108 LYS HA 1 109 LYS H . . 2.910 2.269 2.142 2.497 . 0 0 "[ . 1 . 2]" 1
1557 1 108 LYS HA 1 109 LYS HA . . 4.940 4.486 4.372 4.613 . 0 0 "[ . 1 . 2]" 1
1558 1 108 LYS HA 1 109 LYS HB2 . . 5.450 4.628 4.058 6.015 0.565 7 1 "[ . + 1 . 2]" 1
1559 1 108 LYS HB2 1 108 LYS QE . . 4.760 3.087 1.948 4.253 . 0 0 "[ . 1 . 2]" 1
1560 1 108 LYS HB3 1 109 LYS HA . . 5.500 5.225 3.678 6.080 0.580 7 3 "[ -. + * . 2]" 1
1561 1 108 LYS QG 1 109 LYS H . . 4.620 3.669 2.610 4.491 . 0 0 "[ . 1 . 2]" 1
1562 1 109 LYS H 1 109 LYS HB2 . . 3.600 2.763 2.219 3.819 0.219 5 0 "[ . 1 . 2]" 1
1563 1 109 LYS H 1 109 LYS HB3 . . 3.730 3.584 3.027 3.738 0.008 12 0 "[ . 1 . 2]" 1
1564 1 109 LYS H 1 109 LYS HG2 . . 4.500 3.671 2.015 4.776 0.276 3 0 "[ . 1 . 2]" 1
1565 1 109 LYS HA 1 109 LYS HG2 . . 3.730 2.627 2.254 3.786 0.056 7 0 "[ . 1 . 2]" 1
1566 1 109 LYS HA 1 110 SER H . . 2.810 2.289 2.134 2.483 . 0 0 "[ . 1 . 2]" 1
1567 1 109 LYS HA 1 110 SER HA . . 4.600 4.477 4.384 4.571 . 0 0 "[ . 1 . 2]" 1
1568 1 109 LYS HB2 1 110 SER H . . 4.600 3.949 2.250 4.654 0.054 9 0 "[ . 1 . 2]" 1
1569 1 109 LYS HB3 1 110 SER H . . 3.850 3.120 2.388 3.906 0.056 7 0 "[ . 1 . 2]" 1
1570 1 109 LYS HB3 1 124 LEU QD . . 4.290 3.293 2.294 5.018 0.728 7 1 "[ . + 1 . 2]" 1
1571 1 109 LYS HG2 1 110 SER H . . 4.220 4.249 3.250 5.127 0.907 7 2 "[ . + 1 -. 2]" 1
1572 1 110 SER H 1 110 SER QB . . 3.380 2.955 2.444 3.093 . 0 0 "[ . 1 . 2]" 1
1573 1 110 SER H 1 111 LEU H . . 4.410 4.232 3.848 4.393 . 0 0 "[ . 1 . 2]" 1
1574 1 110 SER HA 1 111 LEU H . . 2.900 2.232 2.101 2.486 . 0 0 "[ . 1 . 2]" 1
1575 1 110 SER HA 1 111 LEU QB . . 4.660 4.034 3.504 4.367 . 0 0 "[ . 1 . 2]" 1
1576 1 110 SER QB 1 111 LEU H . . 4.180 3.236 2.558 3.823 . 0 0 "[ . 1 . 2]" 1
1577 1 111 LEU H 1 111 LEU QB . . 3.600 2.449 2.108 3.169 . 0 0 "[ . 1 . 2]" 1
1578 1 111 LEU H 1 111 LEU QD . . 4.300 3.482 2.620 3.845 . 0 0 "[ . 1 . 2]" 1
1579 1 111 LEU HA 1 112 VAL H . . 3.040 2.353 2.210 2.935 . 0 0 "[ . 1 . 2]" 1
1580 1 111 LEU QB 1 112 VAL H . . 4.720 3.418 2.527 4.149 . 0 0 "[ . 1 . 2]" 1
1581 1 111 LEU QB 1 112 VAL HA . . 5.440 4.154 3.465 4.860 . 0 0 "[ . 1 . 2]" 1
1582 1 111 LEU QB 1 113 PHE QE . . 4.060 3.484 2.584 3.924 . 0 0 "[ . 1 . 2]" 1
1583 1 111 LEU QD 1 113 PHE H . . 5.500 4.667 2.893 5.370 . 0 0 "[ . 1 . 2]" 1
1584 1 111 LEU QD 1 113 PHE QD . . 3.900 3.117 1.973 3.801 . 0 0 "[ . 1 . 2]" 1
1585 1 112 VAL H 1 112 VAL HB . . 3.670 3.188 2.629 3.693 0.023 18 0 "[ . 1 . 2]" 1
1586 1 112 VAL H 1 112 VAL QG . . 3.970 2.737 1.988 3.148 . 0 0 "[ . 1 . 2]" 1
1587 1 112 VAL QG 1 113 PHE H . . 3.680 2.887 2.478 3.525 . 0 0 "[ . 1 . 2]" 1
1588 1 112 VAL QG 1 114 ARG H . . 5.500 4.431 1.767 5.304 . 0 0 "[ . 1 . 2]" 1
1589 1 112 VAL QG 1 114 ARG QD . . 4.760 3.203 2.071 4.642 . 0 0 "[ . 1 . 2]" 1
1590 1 112 VAL QG 1 114 ARG QG . . 4.910 4.183 3.306 4.933 0.023 3 0 "[ . 1 . 2]" 1
1591 1 112 VAL QG 1 117 LYS QD . . 4.730 3.377 2.245 4.464 . 0 0 "[ . 1 . 2]" 1
1592 1 112 VAL QG 1 117 LYS HE2 . . 3.980 3.169 2.054 4.100 0.120 3 0 "[ . 1 . 2]" 1
1593 1 112 VAL QG 1 117 LYS HE3 . . 4.070 3.100 2.009 4.092 0.022 6 0 "[ . 1 . 2]" 1
1594 1 113 PHE H 1 113 PHE QD . . 4.610 3.247 2.590 3.753 . 0 0 "[ . 1 . 2]" 1
1595 1 113 PHE HA 1 113 PHE QD . . 4.040 2.959 2.308 3.766 . 0 0 "[ . 1 . 2]" 1
1596 1 113 PHE HA 1 114 ARG H . . 3.250 2.487 2.206 3.305 0.055 13 0 "[ . 1 . 2]" 1
1597 1 113 PHE HB2 1 114 ARG H . . 5.340 3.528 2.087 4.470 . 0 0 "[ . 1 . 2]" 1
1598 1 113 PHE HB2 1 117 LYS QD . . 4.720 4.615 2.638 5.174 0.454 16 0 "[ . 1 . 2]" 1
1599 1 113 PHE HB3 1 114 ARG H . . 4.520 3.241 2.266 4.522 0.002 12 0 "[ . 1 . 2]" 1
1600 1 113 PHE HB3 1 117 LYS QD . . 5.080 4.086 2.742 5.114 0.034 6 0 "[ . 1 . 2]" 1
1601 1 113 PHE QD 1 114 ARG H . . 5.190 3.961 3.073 4.937 . 0 0 "[ . 1 . 2]" 1
1602 1 114 ARG H 1 114 ARG QB . . 3.900 3.341 2.764 3.515 . 0 0 "[ . 1 . 2]" 1
1603 1 114 ARG H 1 114 ARG QD . . 5.120 3.650 2.238 4.825 . 0 0 "[ . 1 . 2]" 1
1604 1 114 ARG H 1 114 ARG QG . . 4.460 3.118 2.563 4.431 . 0 0 "[ . 1 . 2]" 1
1605 1 114 ARG H 1 117 LYS QD . . 4.340 2.892 1.940 3.648 . 0 0 "[ . 1 . 2]" 1
1606 1 114 ARG QD 1 115 ASP H . . 5.500 4.875 3.851 5.572 0.072 10 0 "[ . 1 . 2]" 1
1607 1 114 ARG QD 1 117 LYS QD . . 3.310 3.051 2.264 3.416 0.106 13 0 "[ . 1 . 2]" 1
1608 1 114 ARG QG 1 115 ASP HB3 . . 5.500 5.229 3.481 6.000 0.500 20 0 "[ . 1 . 2]" 1
1609 1 117 LYS HB2 1 117 LYS HE3 . . 4.740 4.298 2.945 5.297 0.557 12 1 "[ . 1 + . 2]" 1
1610 1 117 LYS HB3 1 117 LYS HE2 . . 5.500 4.038 2.728 5.543 0.043 7 0 "[ . 1 . 2]" 1
1611 1 117 LYS HB3 1 117 LYS HE3 . . 4.740 4.240 2.213 4.885 0.145 17 0 "[ . 1 . 2]" 1
1612 1 119 ILE H 1 119 ILE HB . . 3.430 3.289 2.542 3.516 0.086 2 0 "[ . 1 . 2]" 1
1613 1 119 ILE H 1 119 ILE MD . . 4.410 3.995 2.303 4.445 0.035 1 0 "[ . 1 . 2]" 1
1614 1 119 ILE H 1 120 SER H . . 4.720 4.310 2.676 4.734 0.014 6 0 "[ . 1 . 2]" 1
1615 1 119 ILE HA 1 119 ILE MD . . 3.920 3.008 2.088 4.028 0.108 13 0 "[ . 1 . 2]" 1
1616 1 119 ILE HB 1 119 ILE MD . . 3.490 2.643 2.143 3.296 . 0 0 "[ . 1 . 2]" 1
1617 1 119 ILE MD 1 120 SER H . . 5.230 2.539 1.716 3.729 . 0 0 "[ . 1 . 2]" 1
1618 1 119 ILE MD 1 120 SER HA . . 4.940 3.607 2.192 4.927 . 0 0 "[ . 1 . 2]" 1
1619 1 119 ILE MD 1 120 SER HB2 . . 4.870 4.058 2.009 4.947 0.077 13 0 "[ . 1 . 2]" 1
1620 1 119 ILE MD 1 120 SER HB3 . . 4.220 4.362 2.451 4.945 0.725 6 4 "[ **-+ 1 . 2]" 1
1621 1 119 ILE MD 1 121 THR H . . 5.500 3.858 1.722 5.559 0.059 8 0 "[ . 1 . 2]" 1
1622 1 119 ILE MD 1 121 THR MG . . 4.540 4.079 2.016 4.672 0.132 12 0 "[ . 1 . 2]" 1
1623 1 120 SER H 1 120 SER HB2 . . 3.430 2.901 2.021 3.530 0.100 9 0 "[ . 1 . 2]" 1
1624 1 120 SER H 1 120 SER HB3 . . 3.590 3.172 2.508 3.660 0.070 2 0 "[ . 1 . 2]" 1
1625 1 120 SER HA 1 121 THR H . . 3.180 2.449 1.924 3.253 0.073 15 0 "[ . 1 . 2]" 1
1626 1 120 SER HA 1 121 THR MG . . 4.850 4.761 4.222 4.975 0.125 14 0 "[ . 1 . 2]" 1
1627 1 121 THR H 1 121 THR MG . . 3.750 3.507 2.843 3.863 0.113 7 0 "[ . 1 . 2]" 1
1628 1 121 THR HA 1 121 THR MG . . 3.470 2.182 2.040 2.357 . 0 0 "[ . 1 . 2]" 1
1629 1 121 THR HA 1 122 ASP H . . 3.200 2.419 2.291 2.657 . 0 0 "[ . 1 . 2]" 1
1630 1 121 THR HB 1 122 ASP H . . 3.580 2.803 2.375 3.464 . 0 0 "[ . 1 . 2]" 1
1631 1 121 THR HB 1 122 ASP HA . . 3.660 3.734 3.687 3.754 0.094 2 0 "[ . 1 . 2]" 1
1632 1 121 THR MG 1 122 ASP H . . 5.400 2.923 2.043 3.744 . 0 0 "[ . 1 . 2]" 1
1633 1 122 ASP H 1 122 ASP HB2 . . 3.940 3.554 2.836 4.073 0.133 18 0 "[ . 1 . 2]" 1
1634 1 122 ASP HA 1 123 ASP H . . 3.530 2.752 2.172 3.504 . 0 0 "[ . 1 . 2]" 1
1635 1 122 ASP HB3 1 123 ASP H . . 4.760 3.805 2.103 4.746 . 0 0 "[ . 1 . 2]" 1
1636 1 123 ASP H 1 124 LEU H . . 4.610 4.222 2.726 4.654 0.044 7 0 "[ . 1 . 2]" 1
1637 1 124 LEU H 1 124 LEU HB2 . . 4.110 2.867 2.236 3.915 . 0 0 "[ . 1 . 2]" 1
1638 1 124 LEU H 1 124 LEU QD . . 5.130 3.384 2.727 4.133 . 0 0 "[ . 1 . 2]" 1
1639 1 124 LEU HA 1 124 LEU QD . . 3.300 2.301 2.041 3.261 . 0 0 "[ . 1 . 2]" 1
1640 1 124 LEU HA 1 125 ASN H . . 3.200 2.241 2.139 2.381 . 0 0 "[ . 1 . 2]" 1
1641 1 124 LEU HA 1 125 ASN HB2 . . 5.360 4.517 3.963 5.445 0.085 3 0 "[ . 1 . 2]" 1
1642 1 124 LEU HA 1 125 ASN HB3 . . 5.310 4.775 4.215 5.262 . 0 0 "[ . 1 . 2]" 1
1643 1 124 LEU HA 1 126 LEU QD . . 5.110 3.781 2.966 4.694 . 0 0 "[ . 1 . 2]" 1
1644 1 124 LEU HB3 1 124 LEU QD . . 3.120 2.190 2.038 2.375 . 0 0 "[ . 1 . 2]" 1
1645 1 124 LEU HB3 1 125 ASN H . . 4.350 3.390 2.435 4.151 . 0 0 "[ . 1 . 2]" 1
1646 1 124 LEU HB3 1 126 LEU QD . . 3.740 3.483 2.109 4.657 0.917 15 2 "[- . 1 + 2]" 1
1647 1 124 LEU QD 1 125 ASN H . . 3.790 3.313 2.744 3.805 0.015 14 0 "[ . 1 . 2]" 1
1648 1 124 LEU QD 1 125 ASN HA . . 5.420 4.660 2.802 5.151 . 0 0 "[ . 1 . 2]" 1
1649 1 125 ASN H 1 125 ASN HB2 . . 3.750 3.219 2.891 3.834 0.084 3 0 "[ . 1 . 2]" 1
1650 1 125 ASN H 1 125 ASN HB3 . . 3.880 3.004 2.616 3.701 . 0 0 "[ . 1 . 2]" 1
1651 1 125 ASN H 1 126 LEU QD . . 3.850 2.846 1.858 3.771 . 0 0 "[ . 1 . 2]" 1
1652 1 125 ASN HA 1 126 LEU H . . 2.890 2.355 2.180 2.695 . 0 0 "[ . 1 . 2]" 1
1653 1 125 ASN HB2 1 125 ASN HD22 . . 4.060 3.685 3.501 4.124 0.064 5 0 "[ . 1 . 2]" 1
1654 1 125 ASN HB3 1 126 LEU H . . 5.160 4.387 3.964 4.614 . 0 0 "[ . 1 . 2]" 1
1655 1 125 ASN HB3 1 126 LEU QD . . 5.500 4.564 4.029 5.276 . 0 0 "[ . 1 . 2]" 1
1656 1 126 LEU H 1 126 LEU HB2 . . 4.170 2.705 2.170 3.136 . 0 0 "[ . 1 . 2]" 1
1657 1 126 LEU H 1 126 LEU QD . . 4.360 3.059 2.584 3.711 . 0 0 "[ . 1 . 2]" 1
1658 1 126 LEU H 1 126 LEU HG . . 5.370 3.622 2.297 4.672 . 0 0 "[ . 1 . 2]" 1
1659 1 126 LEU H 1 127 TYR H . . 4.840 4.400 4.257 4.653 . 0 0 "[ . 1 . 2]" 1
1660 1 126 LEU HA 1 126 LEU QD . . 3.150 2.705 2.293 3.039 . 0 0 "[ . 1 . 2]" 1
1661 1 126 LEU HA 1 127 TYR H . . 2.890 2.331 2.218 2.596 . 0 0 "[ . 1 . 2]" 1
1662 1 126 LEU HA 1 127 TYR HB3 . . 5.140 4.716 4.181 5.198 0.058 17 0 "[ . 1 . 2]" 1
1663 1 126 LEU HB2 1 126 LEU QD . . 3.230 2.224 2.115 2.643 . 0 0 "[ . 1 . 2]" 1
1664 1 126 LEU HB2 1 127 TYR H . . 4.800 3.877 3.300 4.186 . 0 0 "[ . 1 . 2]" 1
1665 1 126 LEU HB2 1 128 TYR QE . . 4.260 3.318 2.369 4.325 0.065 6 0 "[ . 1 . 2]" 1
1666 1 126 LEU HB3 1 127 TYR H . . 4.190 2.872 2.591 3.330 . 0 0 "[ . 1 . 2]" 1
1667 1 126 LEU HB3 1 128 TYR QD . . 5.500 4.034 3.405 4.546 . 0 0 "[ . 1 . 2]" 1
1668 1 126 LEU HB3 1 128 TYR QE . . 4.220 2.838 2.151 3.353 . 0 0 "[ . 1 . 2]" 1
1669 1 126 LEU QD 1 127 TYR H . . 4.140 3.957 3.592 4.245 0.105 16 0 "[ . 1 . 2]" 1
1670 1 126 LEU QD 1 128 TYR QE . . 3.120 2.689 2.104 3.155 0.035 20 0 "[ . 1 . 2]" 1
1671 1 126 LEU HG 1 128 TYR QE . . 5.500 4.700 3.965 5.441 . 0 0 "[ . 1 . 2]" 1
1672 1 127 TYR H 1 127 TYR HB2 . . 4.040 3.198 2.821 3.636 . 0 0 "[ . 1 . 2]" 1
1673 1 127 TYR H 1 127 TYR HB3 . . 3.780 2.984 2.657 3.277 . 0 0 "[ . 1 . 2]" 1
1674 1 127 TYR H 1 128 TYR H . . 5.020 4.289 3.875 4.486 . 0 0 "[ . 1 . 2]" 1
1675 1 127 TYR H 1 128 TYR QD . . 4.540 4.303 4.047 4.507 . 0 0 "[ . 1 . 2]" 1
1676 1 127 TYR H 1 128 TYR QE . . 4.520 4.521 4.254 4.611 0.091 6 0 "[ . 1 . 2]" 1
1677 1 127 TYR HA 1 127 TYR QD . . 3.330 2.883 2.327 3.163 . 0 0 "[ . 1 . 2]" 1
1678 1 127 TYR HA 1 128 TYR H . . 3.160 2.318 2.162 2.519 . 0 0 "[ . 1 . 2]" 1
1679 1 127 TYR HA 1 128 TYR QD . . 3.530 3.509 3.150 3.621 0.091 8 0 "[ . 1 . 2]" 1
1680 1 127 TYR HB2 1 128 TYR H . . 4.560 4.222 3.749 4.505 . 0 0 "[ . 1 . 2]" 1
1681 1 127 TYR HB3 1 128 TYR H . . 4.800 3.872 3.309 4.419 . 0 0 "[ . 1 . 2]" 1
1682 1 127 TYR QD 1 128 TYR H . . 3.980 2.697 1.889 3.753 . 0 0 "[ . 1 . 2]" 1
1683 1 127 TYR QE 1 129 ASN H . . 5.500 5.110 4.596 5.567 0.067 9 0 "[ . 1 . 2]" 1
1684 1 127 TYR QE 1 129 ASN HB2 . . 5.200 4.381 3.638 5.064 . 0 0 "[ . 1 . 2]" 1
1685 1 127 TYR QE 1 129 ASN HB3 . . 3.700 2.967 2.266 3.762 0.062 11 0 "[ . 1 . 2]" 1
1686 1 127 TYR QE 1 129 ASN HD21 . . 4.040 3.047 1.990 4.122 0.082 15 0 "[ . 1 . 2]" 1
1687 1 127 TYR QE 1 129 ASN HD22 . . 4.250 3.626 2.669 4.339 0.089 20 0 "[ . 1 . 2]" 1
1688 1 128 TYR H 1 128 TYR QD . . 3.570 3.206 2.597 3.601 0.031 6 0 "[ . 1 . 2]" 1
1689 1 128 TYR H 1 129 ASN H . . 4.650 4.061 3.727 4.404 . 0 0 "[ . 1 . 2]" 1
1690 1 128 TYR HA 1 128 TYR QD . . 3.500 2.916 2.643 3.162 . 0 0 "[ . 1 . 2]" 1
1691 1 128 TYR HA 1 129 ASN H . . 2.720 2.205 2.092 2.393 . 0 0 "[ . 1 . 2]" 1
1692 1 128 TYR QB 1 129 ASN H . . 3.790 3.332 2.565 3.643 . 0 0 "[ . 1 . 2]" 1
1693 1 128 TYR QD 1 129 ASN H . . 4.660 4.328 3.666 4.757 0.097 16 0 "[ . 1 . 2]" 1
stop_
save_