NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
443756 |
2kfh   |
16181 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kfh
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 2144
_Distance_constraint_stats_list.Viol_count 684
_Distance_constraint_stats_list.Viol_total 1075.722
_Distance_constraint_stats_list.Viol_max 0.964
_Distance_constraint_stats_list.Viol_rms 0.0440
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0050
_Distance_constraint_stats_list.Viol_average_violations_only 0.1573
_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 7 ASP 0.053 0.053 9 0 "[ . 1]"
1 8 VAL 2.318 0.598 6 3 "[ * .+ - 1]"
1 9 GLU 0.014 0.014 7 0 "[ . 1]"
1 10 TRP 2.687 0.804 4 2 "[ - +. 1]"
1 11 VAL 0.914 0.177 5 0 "[ . 1]"
1 12 VAL 5.530 0.902 9 3 "[ * . -+1]"
1 13 GLY 0.000 0.000 . 0 "[ . 1]"
1 14 LYS 4.506 0.902 9 3 "[ * . -+1]"
1 15 ASP 2.345 0.546 1 2 "[+ .- 1]"
1 16 LYS 0.365 0.148 5 0 "[ . 1]"
1 17 PRO 0.200 0.148 5 0 "[ . 1]"
1 18 THR 0.162 0.136 1 0 "[ . 1]"
1 19 TYR 1.913 0.694 8 3 "[* .- + 1]"
1 20 ASP 0.155 0.136 8 0 "[ . 1]"
1 21 GLU 1.304 0.157 5 0 "[ . 1]"
1 22 ILE 2.183 0.694 8 1 "[ . + 1]"
1 23 PHE 0.793 0.201 6 0 "[ . 1]"
1 24 TYR 3.845 0.573 2 1 "[ + . 1]"
1 25 THR 0.520 0.069 3 0 "[ . 1]"
1 26 LEU 1.444 0.201 6 0 "[ . 1]"
1 27 SER 0.000 0.000 . 0 "[ . 1]"
1 28 PRO 2.868 0.573 2 1 "[ + . 1]"
1 29 VAL 0.391 0.049 1 0 "[ . 1]"
1 30 ASN 0.000 0.000 . 0 "[ . 1]"
1 31 GLY 1.758 0.262 3 0 "[ . 1]"
1 32 LYS 6.480 0.908 6 2 "[- .+ 1]"
1 33 ILE 1.868 0.483 1 0 "[ . 1]"
1 34 THR 0.170 0.170 5 0 "[ . 1]"
1 35 GLY 0.651 0.116 1 0 "[ . 1]"
1 36 ALA 1.332 0.161 5 0 "[ . 1]"
1 37 ASN 1.866 0.374 6 0 "[ . 1]"
1 38 ALA 2.110 0.483 1 0 "[ . 1]"
1 39 LYS 0.317 0.099 4 0 "[ . 1]"
1 40 LYS 2.648 0.821 2 1 "[ + . 1]"
1 41 GLU 2.009 0.431 8 0 "[ . 1]"
1 42 MET 5.026 0.653 8 1 "[ . + 1]"
1 43 VAL 0.651 0.176 8 0 "[ . 1]"
1 44 LYS 9.711 0.964 5 6 "[ * *+-* *]"
1 45 SER 0.068 0.034 6 0 "[ . 1]"
1 46 LYS 1.653 0.415 8 0 "[ . 1]"
1 47 LEU 0.487 0.441 9 0 "[ . 1]"
1 48 PRO 0.434 0.127 2 0 "[ . 1]"
1 49 ASN 0.847 0.401 9 0 "[ . 1]"
1 50 THR 1.497 0.826 4 1 "[ +. 1]"
1 51 VAL 2.151 0.448 1 0 "[ . 1]"
1 52 LEU 3.960 0.439 10 0 "[ . 1]"
1 53 GLY 0.880 0.271 5 0 "[ . 1]"
1 54 LYS 3.507 0.826 4 1 "[ +. 1]"
1 55 ILE 1.140 0.110 10 0 "[ . 1]"
1 56 TRP 4.129 0.474 2 0 "[ . 1]"
1 57 LYS 1.913 0.312 2 0 "[ . 1]"
1 58 LEU 2.239 0.495 5 0 "[ . 1]"
1 59 ALA 0.090 0.051 5 0 "[ . 1]"
1 60 ASP 1.374 0.474 2 0 "[ . 1]"
1 61 VAL 1.567 0.798 9 1 "[ . +1]"
1 62 ASP 2.261 0.719 5 3 "[ *+ -1]"
1 63 LYS 1.790 0.719 5 2 "[ -+ 1]"
1 64 ASP 0.000 0.000 . 0 "[ . 1]"
1 65 GLY 0.433 0.086 6 0 "[ . 1]"
1 66 LEU 2.060 0.793 5 1 "[ + 1]"
1 67 LEU 0.325 0.086 6 0 "[ . 1]"
1 68 ASP 2.319 0.368 3 0 "[ . 1]"
1 69 ASP 0.604 0.162 5 0 "[ . 1]"
1 70 GLU 0.582 0.218 8 0 "[ . 1]"
1 71 GLU 0.412 0.212 8 0 "[ . 1]"
1 72 PHE 0.157 0.087 8 0 "[ . 1]"
1 73 ALA 0.000 0.000 . 0 "[ . 1]"
1 74 LEU 7.657 0.711 9 5 "[ * * * +-]"
1 75 ALA 0.258 0.082 2 0 "[ . 1]"
1 76 ASN 2.521 0.446 9 0 "[ . 1]"
1 77 HIS 4.516 0.693 2 3 "[ + . - *1]"
1 78 LEU 3.435 0.711 9 3 "[ . * +-]"
1 79 ILE 1.321 0.410 7 0 "[ . 1]"
1 80 LYS 3.355 0.739 4 2 "[ +.- 1]"
1 81 VAL 0.443 0.262 1 0 "[ . 1]"
1 82 LYS 3.497 0.686 5 1 "[ + 1]"
1 83 LEU 1.000 0.289 4 0 "[ . 1]"
1 84 GLU 1.021 0.407 4 0 "[ . 1]"
1 85 GLY 0.232 0.073 7 0 "[ . 1]"
1 86 HIS 2.063 0.407 4 0 "[ . 1]"
1 87 GLU 1.392 0.340 7 0 "[ . 1]"
1 88 LEU 0.971 0.317 10 0 "[ . 1]"
1 89 PRO 1.661 0.630 2 1 "[ + . 1]"
1 90 ALA 0.751 0.130 9 0 "[ . 1]"
1 91 ASP 0.400 0.144 4 0 "[ . 1]"
1 92 LEU 0.239 0.094 5 0 "[ . 1]"
1 93 PRO 3.921 0.849 6 3 "[ * -.+ 1]"
1 94 PRO 0.266 0.232 3 0 "[ . 1]"
1 95 HIS 1.344 0.273 4 0 "[ . 1]"
1 96 LEU 11.062 0.880 2 3 "[ + *.* 1]"
1 97 VAL 2.808 0.617 9 2 "[ * +1]"
1 98 PRO 0.832 0.471 5 0 "[ . 1]"
1 99 PRO 1.079 0.581 5 1 "[ + 1]"
1 100 SER 0.061 0.034 1 0 "[ . 1]"
1 101 LYS 2.811 0.798 9 1 "[ . +1]"
1 102 ARG 2.355 0.617 9 2 "[ * +1]"
1 103 ARG 0.344 0.292 5 0 "[ . 1]"
1 104 HIS 0.000 0.000 . 0 "[ . 1]"
1 105 GLU 0.000 0.000 . 0 "[ . 1]"
2 2 ASN 0.826 0.396 1 0 "[ . 1]"
2 3 TYR 0.777 0.396 1 0 "[ . 1]"
2 4 GLU 0.555 0.293 4 0 "[ . 1]"
2 5 SER 0.000 0.000 . 0 "[ . 1]"
2 6 THR 0.022 0.022 6 0 "[ . 1]"
2 7 GLY 0.173 0.051 4 0 "[ . 1]"
2 8 PRO 0.619 0.116 1 0 "[ . 1]"
2 9 PHE 2.172 0.159 5 0 "[ . 1]"
2 10 THR 0.000 0.000 . 0 "[ . 1]"
2 11 ALA 0.334 0.251 5 0 "[ . 1]"
2 12 LYS 0.334 0.251 5 0 "[ . 1]"
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 7 ASP H 1 7 ASP HB2 3.500 . 5.100 2.687 2.142 3.212 . 0 0 "[ . 1]" 1
2 1 7 ASP H 1 7 ASP HB3 3.300 . 6.000 2.874 2.407 3.634 . 0 0 "[ . 1]" 1
3 1 7 ASP HA 1 7 ASP HB2 2.600 . 6.000 2.626 2.416 2.997 . 0 0 "[ . 1]" 1
4 1 7 ASP HA 1 8 VAL H 2.500 . 6.000 2.182 2.101 2.276 . 0 0 "[ . 1]" 1
5 1 7 ASP HB2 1 8 VAL H 4.300 . 6.000 4.372 4.047 4.640 . 0 0 "[ . 1]" 1
6 1 7 ASP HB2 1 8 VAL HA 3.200 . 6.000 5.767 5.084 6.053 0.053 9 0 "[ . 1]" 1
7 1 8 VAL H 1 8 VAL HA 2.800 . 3.800 2.907 2.863 2.948 . 0 0 "[ . 1]" 1
8 1 8 VAL H 1 8 VAL HB 2.800 . 3.800 3.234 2.581 3.800 . 0 0 "[ . 1]" 1
9 1 8 VAL H 1 8 VAL MG1 3.000 . 4.100 2.523 1.984 3.783 . 0 0 "[ . 1]" 1
10 1 8 VAL H 1 8 VAL MG2 2.500 . 3.300 2.734 1.910 3.898 0.598 6 3 "[ * .+ - 1]" 1
11 1 8 VAL H 1 9 GLU H 3.900 . 5.800 4.505 4.345 4.607 . 0 0 "[ . 1]" 1
12 1 8 VAL H 1 95 HIS HA 3.200 . 6.000 5.649 5.247 6.057 0.057 3 0 "[ . 1]" 1
13 1 8 VAL HA 1 8 VAL HB 2.600 . 3.400 2.536 2.457 3.027 . 0 0 "[ . 1]" 1
14 1 8 VAL HA 1 8 VAL MG1 2.600 . 6.000 2.679 2.283 3.228 . 0 0 "[ . 1]" 1
15 1 8 VAL HA 1 8 VAL MG2 3.500 . 5.000 2.792 2.339 3.218 . 0 0 "[ . 1]" 1
16 1 8 VAL HA 1 9 GLU H 2.300 . 3.000 2.215 2.134 2.285 . 0 0 "[ . 1]" 1
17 1 8 VAL HB 1 8 VAL MG2 2.300 . 3.000 2.129 2.122 2.134 . 0 0 "[ . 1]" 1
18 1 8 VAL HB 1 9 GLU H 4.200 . 6.000 3.507 2.686 4.209 . 0 0 "[ . 1]" 1
19 1 8 VAL MG1 1 9 GLU H 4.100 . 6.000 3.658 2.839 3.905 . 0 0 "[ . 1]" 1
20 1 8 VAL MG1 1 95 HIS HB3 3.800 . 5.600 3.140 2.066 3.951 . 0 0 "[ . 1]" 1
21 1 8 VAL MG2 1 9 GLU H 3.700 . 5.400 3.245 2.150 4.145 . 0 0 "[ . 1]" 1
22 1 9 GLU H 1 9 GLU HB3 2.800 . 3.800 3.061 2.406 3.616 . 0 0 "[ . 1]" 1
23 1 9 GLU H 1 9 GLU HG2 4.000 . 6.000 3.376 1.986 4.621 0.014 7 0 "[ . 1]" 1
24 1 9 GLU H 1 9 GLU HG3 4.000 . 6.000 3.249 2.088 4.553 . 0 0 "[ . 1]" 1
25 1 9 GLU H 1 10 TRP H 5.400 . 6.000 4.576 4.493 4.640 . 0 0 "[ . 1]" 1
26 1 9 GLU HA 1 9 GLU HB3 2.600 . 3.400 2.617 2.403 3.029 . 0 0 "[ . 1]" 1
27 1 9 GLU HA 1 9 GLU HG3 3.500 . 5.000 3.160 2.459 3.780 . 0 0 "[ . 1]" 1
28 1 9 GLU HA 1 10 TRP H 2.700 . 3.600 2.210 2.142 2.303 . 0 0 "[ . 1]" 1
29 1 9 GLU HB2 1 10 TRP H 4.200 . 6.000 3.826 2.773 4.252 . 0 0 "[ . 1]" 1
30 1 10 TRP H 1 10 TRP HB2 3.900 . 5.800 2.464 2.315 2.527 . 0 0 "[ . 1]" 1
31 1 10 TRP HA 1 10 TRP HD1 2.400 . 3.100 2.140 2.014 2.359 . 0 0 "[ . 1]" 1
32 1 10 TRP HA 1 11 VAL H 2.900 . 4.000 2.147 2.120 2.178 . 0 0 "[ . 1]" 1
33 1 10 TRP HA 1 11 VAL HA 4.600 . 6.000 4.377 4.252 4.429 . 0 0 "[ . 1]" 1
34 1 10 TRP HA 1 11 VAL QG 4.800 . 6.000 3.503 3.277 3.883 . 0 0 "[ . 1]" 1
35 1 10 TRP HD1 1 11 VAL QG 4.200 . 6.000 3.727 3.320 4.169 . 0 0 "[ . 1]" 1
36 1 10 TRP HD1 1 12 VAL HB 4.500 . 6.000 4.757 4.312 5.998 . 0 0 "[ . 1]" 1
37 1 10 TRP HD1 1 12 VAL QG 4.700 . 6.000 3.801 3.470 4.268 . 0 0 "[ . 1]" 1
38 1 10 TRP HD1 1 96 LEU HA 2.500 . 3.300 2.764 2.457 3.398 0.098 6 0 "[ . 1]" 1
39 1 10 TRP HD1 1 96 LEU MD2 3.600 . 5.200 4.220 3.351 6.004 0.804 4 2 "[ - +. 1]" 1
40 1 10 TRP HD1 1 99 PRO HD3 3.800 . 6.000 4.441 3.706 5.231 . 0 0 "[ . 1]" 1
41 1 10 TRP HE1 1 12 VAL QG 4.400 . 6.000 3.111 2.704 3.823 . 0 0 "[ . 1]" 1
42 1 10 TRP HE1 1 74 LEU MD2 4.300 . 6.000 4.223 2.788 5.320 . 0 0 "[ . 1]" 1
43 1 10 TRP HH2 1 12 VAL HB 3.500 . 5.000 4.068 3.608 5.384 0.384 7 0 "[ . 1]" 1
44 1 10 TRP HH2 1 12 VAL QG 4.200 . 6.000 3.236 2.953 3.679 . 0 0 "[ . 1]" 1
45 1 10 TRP HH2 1 70 GLU H 6.000 . 6.000 5.057 4.792 5.266 . 0 0 "[ . 1]" 1
46 1 10 TRP HH2 1 70 GLU HA 3.100 . 4.300 2.633 2.475 2.975 . 0 0 "[ . 1]" 1
47 1 10 TRP HH2 1 70 GLU HB3 2.200 . 2.800 2.639 2.061 3.018 0.218 8 0 "[ . 1]" 1
48 1 10 TRP HH2 1 71 GLU HA 2.700 . 6.000 3.893 3.779 3.936 . 0 0 "[ . 1]" 1
49 1 10 TRP HH2 1 73 ALA H 4.300 . 6.000 4.416 4.121 4.877 . 0 0 "[ . 1]" 1
50 1 10 TRP HH2 1 73 ALA MB 3.100 . 6.000 2.798 2.378 3.470 . 0 0 "[ . 1]" 1
51 1 10 TRP HH2 1 74 LEU H 3.600 . 5.200 3.169 2.754 3.864 . 0 0 "[ . 1]" 1
52 1 10 TRP HH2 1 74 LEU HB2 3.500 . 5.100 2.995 2.567 3.440 . 0 0 "[ . 1]" 1
53 1 10 TRP HZ2 1 12 VAL QG 3.300 . 4.600 3.021 2.830 3.263 . 0 0 "[ . 1]" 1
54 1 10 TRP HZ2 1 70 GLU HA 5.000 . 6.000 5.007 4.742 5.423 . 0 0 "[ . 1]" 1
55 1 10 TRP HZ2 1 70 GLU HB3 4.500 . 6.000 4.150 3.851 4.578 . 0 0 "[ . 1]" 1
56 1 10 TRP HZ2 1 74 LEU HB2 3.000 . 4.100 2.160 1.873 2.562 0.027 10 0 "[ . 1]" 1
57 1 10 TRP HZ2 1 74 LEU HB3 4.600 . 6.000 3.770 3.488 4.185 . 0 0 "[ . 1]" 1
58 1 10 TRP HZ2 1 74 LEU MD1 3.400 . 4.900 2.460 1.964 4.361 . 0 0 "[ . 1]" 1
59 1 10 TRP HZ2 1 74 LEU MD2 3.600 . 5.200 3.442 1.983 4.532 0.017 7 0 "[ . 1]" 1
60 1 10 TRP HZ2 1 98 PRO HA 3.400 . 4.800 3.795 3.420 4.060 . 0 0 "[ . 1]" 1
61 1 10 TRP HZ2 1 99 PRO HD2 3.300 . 6.000 5.469 4.893 6.011 0.011 10 0 "[ . 1]" 1
62 1 10 TRP HZ3 1 13 GLY HA2 4.300 . 6.000 3.991 3.290 5.049 . 0 0 "[ . 1]" 1
63 1 10 TRP HZ3 1 13 GLY HA3 4.800 . 6.000 4.777 3.957 5.793 . 0 0 "[ . 1]" 1
64 1 10 TRP HZ3 1 70 GLU QG 5.000 . 5.400 3.242 2.309 4.569 . 0 0 "[ . 1]" 1
65 1 10 TRP HZ3 1 73 ALA MB 4.100 . 6.000 3.276 2.836 4.008 . 0 0 "[ . 1]" 1
66 1 10 TRP HZ3 1 99 PRO HD3 3.900 . 5.800 4.680 3.326 5.941 0.141 6 0 "[ . 1]" 1
67 1 11 VAL H 1 11 VAL HA 3.000 . 4.100 2.814 2.791 2.845 . 0 0 "[ . 1]" 1
68 1 11 VAL H 1 11 VAL HB 3.200 . 4.500 3.153 2.396 3.639 . 0 0 "[ . 1]" 1
69 1 11 VAL H 1 11 VAL QG 3.800 . 5.600 1.966 1.823 2.225 0.177 5 0 "[ . 1]" 1
70 1 11 VAL HA 1 11 VAL HB 2.300 . 2.900 2.481 2.444 2.518 . 0 0 "[ . 1]" 1
71 1 11 VAL HA 1 11 VAL QG 2.800 . 3.700 2.259 2.227 2.315 . 0 0 "[ . 1]" 1
72 1 11 VAL HA 1 12 VAL H 3.400 . 4.900 3.366 3.213 3.463 . 0 0 "[ . 1]" 1
73 1 11 VAL HA 1 13 GLY H 3.800 . 5.700 3.783 3.584 3.967 . 0 0 "[ . 1]" 1
74 1 11 VAL HB 1 11 VAL QG 2.000 . 2.500 1.894 1.888 1.898 . 0 0 "[ . 1]" 1
75 1 11 VAL QG 1 12 VAL H 2.900 . 5.100 2.706 2.399 3.005 . 0 0 "[ . 1]" 1
76 1 11 VAL QG 1 12 VAL HA 4.000 . 6.000 3.436 3.141 3.850 . 0 0 "[ . 1]" 1
77 1 11 VAL QG 1 12 VAL HB 4.900 . 6.000 4.147 3.197 4.444 . 0 0 "[ . 1]" 1
78 1 11 VAL QG 1 12 VAL QG 3.900 . 4.300 2.510 2.050 3.400 . 0 0 "[ . 1]" 1
79 1 11 VAL QG 1 77 HIS QB 3.400 . 6.000 4.717 3.839 5.034 . 0 0 "[ . 1]" 1
80 1 11 VAL QG 1 77 HIS HE1 3.000 . 6.000 4.253 3.718 4.644 . 0 0 "[ . 1]" 1
81 1 11 VAL QG 1 95 HIS HA 3.800 . 6.000 4.853 4.025 5.382 . 0 0 "[ . 1]" 1
82 1 11 VAL QG 1 95 HIS HB2 3.300 . 6.000 3.610 2.618 4.071 . 0 0 "[ . 1]" 1
83 1 11 VAL QG 1 95 HIS HD2 3.000 . 4.100 2.438 2.067 2.861 . 0 0 "[ . 1]" 1
84 1 12 VAL H 1 12 VAL HA 2.900 . 3.900 2.903 2.875 2.929 . 0 0 "[ . 1]" 1
85 1 12 VAL H 1 12 VAL HB 3.100 . 4.300 2.581 2.512 2.788 . 0 0 "[ . 1]" 1
86 1 12 VAL H 1 12 VAL QG 3.100 . 4.300 2.171 2.054 2.354 . 0 0 "[ . 1]" 1
87 1 12 VAL HA 1 12 VAL QG 2.600 . 3.300 2.145 2.129 2.238 . 0 0 "[ . 1]" 1
88 1 12 VAL HA 1 13 GLY H 3.400 . 4.800 3.411 3.363 3.472 . 0 0 "[ . 1]" 1
89 1 12 VAL HA 1 14 LYS H 3.800 . 5.600 3.760 3.555 4.043 . 0 0 "[ . 1]" 1
90 1 12 VAL HA 1 14 LYS HD3 4.700 . 6.000 6.018 5.192 6.902 0.902 9 3 "[ * . -+1]" 1
91 1 12 VAL HA 1 14 LYS HG3 4.400 . 6.000 4.612 4.157 4.951 . 0 0 "[ . 1]" 1
92 1 12 VAL HA 1 15 ASP HB3 4.900 . 6.000 5.338 4.537 5.794 . 0 0 "[ . 1]" 1
93 1 12 VAL HA 1 16 LYS QG 4.100 . 6.000 5.611 5.160 5.922 . 0 0 "[ . 1]" 1
94 1 12 VAL HA 1 19 TYR QE 4.500 . 6.000 3.866 3.353 5.157 . 0 0 "[ . 1]" 1
95 1 12 VAL HB 1 13 GLY H 3.400 . 4.800 3.252 2.910 4.233 . 0 0 "[ . 1]" 1
96 1 12 VAL HB 1 73 ALA MB 4.100 . 6.000 4.062 3.719 4.262 . 0 0 "[ . 1]" 1
97 1 12 VAL HB 1 96 LEU MD2 3.200 . 6.000 5.119 4.111 6.446 0.446 2 0 "[ . 1]" 1
98 1 12 VAL MG1 1 12 VAL MG2 2.200 . 6.000 2.084 2.077 2.087 . 0 0 "[ . 1]" 1
99 1 12 VAL QG 1 13 GLY H 3.700 . 5.400 3.405 2.723 3.574 . 0 0 "[ . 1]" 1
100 1 12 VAL QG 1 15 ASP H 5.400 . 6.000 4.065 3.634 4.376 . 0 0 "[ . 1]" 1
101 1 12 VAL QG 1 15 ASP HB3 5.200 . 6.000 4.801 4.133 5.566 . 0 0 "[ . 1]" 1
102 1 12 VAL QG 1 16 LYS H 4.800 . 6.000 5.000 4.194 5.268 . 0 0 "[ . 1]" 1
103 1 12 VAL QG 1 16 LYS HB2 4.500 . 6.000 4.993 3.071 5.883 . 0 0 "[ . 1]" 1
104 1 12 VAL QG 1 19 TYR QD 4.200 . 6.000 2.915 2.295 3.496 . 0 0 "[ . 1]" 1
105 1 12 VAL QG 1 19 TYR QE 3.200 . 4.500 2.493 2.049 3.542 . 0 0 "[ . 1]" 1
106 1 12 VAL QG 1 73 ALA H 5.700 . 6.000 4.507 4.289 4.792 . 0 0 "[ . 1]" 1
107 1 12 VAL QG 1 73 ALA HA 4.600 . 6.000 3.708 3.297 3.883 . 0 0 "[ . 1]" 1
108 1 12 VAL QG 1 73 ALA MB 3.000 . 4.100 2.207 2.003 2.403 . 0 0 "[ . 1]" 1
109 1 12 VAL QG 1 74 LEU H 4.300 . 6.000 3.037 2.812 3.383 . 0 0 "[ . 1]" 1
110 1 12 VAL QG 1 74 LEU HA 3.000 . 3.300 1.979 1.820 2.304 0.080 9 0 "[ . 1]" 1
111 1 12 VAL QG 1 74 LEU MD2 3.600 . 4.700 3.455 1.803 4.086 0.097 5 0 "[ . 1]" 1
112 1 12 VAL QG 1 77 HIS H 4.000 . 5.800 3.508 3.082 3.841 . 0 0 "[ . 1]" 1
113 1 12 VAL QG 1 77 HIS HA 4.800 . 6.000 3.977 3.515 4.615 . 0 0 "[ . 1]" 1
114 1 12 VAL QG 1 77 HIS QB 3.400 . 3.800 1.967 1.819 2.428 0.181 5 0 "[ . 1]" 1
115 1 12 VAL QG 1 77 HIS HD2 4.100 . 6.000 3.144 2.540 4.244 . 0 0 "[ . 1]" 1
116 1 12 VAL QG 1 77 HIS HE1 4.200 . 6.000 4.026 3.628 4.990 . 0 0 "[ . 1]" 1
117 1 12 VAL QG 1 78 LEU H 3.200 . 6.000 4.473 4.366 4.568 . 0 0 "[ . 1]" 1
118 1 12 VAL QG 1 96 LEU MD1 2.700 . 6.000 3.652 1.952 5.655 . 0 0 "[ . 1]" 1
119 1 12 VAL QG 1 96 LEU MD2 2.100 . 6.000 3.023 2.129 4.390 . 0 0 "[ . 1]" 1
120 1 13 GLY H 1 13 GLY HA3 2.600 . 3.400 2.303 2.289 2.321 . 0 0 "[ . 1]" 1
121 1 13 GLY HA2 1 14 LYS H 3.400 . 4.900 3.412 3.363 3.484 . 0 0 "[ . 1]" 1
122 1 13 GLY HA2 1 16 LYS HB3 4.300 . 6.000 4.228 3.037 5.324 . 0 0 "[ . 1]" 1
123 1 13 GLY HA3 1 14 LYS H 3.200 . 4.500 3.128 3.010 3.223 . 0 0 "[ . 1]" 1
124 1 13 GLY HA3 1 16 LYS H 5.000 . 6.000 5.022 4.699 5.740 . 0 0 "[ . 1]" 1
125 1 14 LYS H 1 14 LYS HA 2.600 . 3.400 2.876 2.857 2.912 . 0 0 "[ . 1]" 1
126 1 14 LYS H 1 14 LYS HB3 2.600 . 3.400 2.726 2.516 2.887 . 0 0 "[ . 1]" 1
127 1 14 LYS H 1 14 LYS HD3 5.000 . 6.000 4.602 4.286 4.799 . 0 0 "[ . 1]" 1
128 1 14 LYS H 1 14 LYS HG3 3.400 . 4.800 3.040 2.821 3.292 . 0 0 "[ . 1]" 1
129 1 14 LYS H 1 15 ASP H 2.500 . 3.300 2.412 2.286 2.496 . 0 0 "[ . 1]" 1
130 1 14 LYS H 1 15 ASP HB3 5.700 . 6.000 5.835 4.872 6.147 0.147 3 0 "[ . 1]" 1
131 1 14 LYS HA 1 14 LYS HB2 2.600 . 3.500 2.460 2.338 2.506 . 0 0 "[ . 1]" 1
132 1 14 LYS HA 1 14 LYS HB3 2.600 . 3.400 2.430 2.377 2.579 . 0 0 "[ . 1]" 1
133 1 14 LYS HA 1 14 LYS HE3 5.100 . 6.000 4.980 4.304 6.149 0.149 8 0 "[ . 1]" 1
134 1 14 LYS HA 1 14 LYS HG3 4.100 . 6.000 3.729 3.549 3.837 . 0 0 "[ . 1]" 1
135 1 14 LYS HA 1 15 ASP H 3.200 . 4.400 3.464 3.421 3.490 . 0 0 "[ . 1]" 1
136 1 14 LYS HB2 1 15 ASP H 3.500 . 5.000 3.988 3.887 4.121 . 0 0 "[ . 1]" 1
137 1 14 LYS HB3 1 14 LYS HE3 3.700 . 5.400 3.159 2.067 4.637 . 0 0 "[ . 1]" 1
138 1 14 LYS HB3 1 14 LYS HG3 2.800 . 3.800 3.003 2.981 3.014 . 0 0 "[ . 1]" 1
139 1 14 LYS HB3 1 15 ASP H 4.100 . 6.000 4.137 3.878 4.265 . 0 0 "[ . 1]" 1
140 1 14 LYS HD2 1 14 LYS HG2 2.300 . 2.900 2.507 2.377 2.979 0.079 5 0 "[ . 1]" 1
141 1 14 LYS HE2 1 14 LYS HG2 3.500 . 5.000 3.379 2.339 3.828 . 0 0 "[ . 1]" 1
142 1 14 LYS HG2 1 15 ASP H 3.700 . 5.400 3.083 2.859 3.354 . 0 0 "[ . 1]" 1
143 1 14 LYS HG2 1 15 ASP HB3 5.500 . 6.000 5.706 4.617 6.232 0.232 2 0 "[ . 1]" 1
144 1 15 ASP H 1 15 ASP HB3 3.300 . 4.700 3.520 2.704 3.832 . 0 0 "[ . 1]" 1
145 1 15 ASP H 1 16 LYS H 2.300 . 3.000 2.751 2.527 2.961 . 0 0 "[ . 1]" 1
146 1 15 ASP H 1 19 TYR QE 3.900 . 5.800 4.452 3.749 5.275 . 0 0 "[ . 1]" 1
147 1 15 ASP HA 1 77 HIS HE1 2.400 . 6.000 5.840 5.227 6.055 0.055 1 0 "[ . 1]" 1
148 1 15 ASP HB2 1 19 TYR QE 2.700 . 3.600 2.989 2.367 4.146 0.546 1 2 "[+ .- 1]" 1
149 1 15 ASP HB3 1 18 THR HB 3.600 . 5.200 4.027 3.403 4.521 . 0 0 "[ . 1]" 1
150 1 15 ASP HB3 1 19 TYR QE 3.100 . 4.300 3.304 2.530 3.919 . 0 0 "[ . 1]" 1
151 1 16 LYS H 1 16 LYS HA 2.800 . 3.800 2.854 2.820 2.898 . 0 0 "[ . 1]" 1
152 1 16 LYS H 1 16 LYS HB2 2.400 . 3.100 2.370 2.167 2.578 . 0 0 "[ . 1]" 1
153 1 16 LYS H 1 16 LYS HB3 3.500 . 5.000 3.241 2.667 3.638 . 0 0 "[ . 1]" 1
154 1 16 LYS H 1 16 LYS HD3 3.500 . 5.100 4.748 4.139 5.157 0.057 3 0 "[ . 1]" 1
155 1 16 LYS H 1 16 LYS QG 4.000 . 5.000 3.320 2.622 4.003 . 0 0 "[ . 1]" 1
156 1 16 LYS H 1 17 PRO HD2 2.600 . 3.400 2.034 1.652 2.472 0.148 5 0 "[ . 1]" 1
157 1 16 LYS H 1 17 PRO HD3 3.300 . 4.600 2.929 2.441 3.267 . 0 0 "[ . 1]" 1
158 1 16 LYS H 1 19 TYR QE 4.200 . 6.000 5.452 4.863 5.983 . 0 0 "[ . 1]" 1
159 1 16 LYS HA 1 16 LYS HB3 2.900 . 3.900 2.776 2.512 3.011 . 0 0 "[ . 1]" 1
160 1 16 LYS HA 1 16 LYS QG 2.800 . 3.800 2.412 2.153 2.895 . 0 0 "[ . 1]" 1
161 1 16 LYS HA 1 19 TYR H 3.400 . 4.900 3.278 3.129 3.423 . 0 0 "[ . 1]" 1
162 1 16 LYS HA 1 19 TYR QD 2.700 . 6.000 2.925 2.130 3.283 . 0 0 "[ . 1]" 1
163 1 16 LYS HA 1 19 TYR QE 3.400 . 4.900 4.462 3.814 5.008 0.108 8 0 "[ . 1]" 1
164 1 16 LYS HB2 1 17 PRO HD2 3.500 . 5.000 3.310 2.665 4.210 . 0 0 "[ . 1]" 1
165 1 16 LYS HB2 1 17 PRO HD3 2.900 . 3.900 2.900 2.033 3.892 . 0 0 "[ . 1]" 1
166 1 16 LYS QE 1 70 GLU QG 3.300 . 4.700 3.668 2.991 4.341 . 0 0 "[ . 1]" 1
167 1 16 LYS QE 1 73 ALA MB 2.700 . 6.000 2.828 1.908 4.637 . 0 0 "[ . 1]" 1
168 1 16 LYS QG 1 19 TYR QD 3.800 . 6.000 3.884 3.073 4.755 . 0 0 "[ . 1]" 1
169 1 17 PRO HA 1 18 THR H 3.400 . 4.900 3.551 3.529 3.581 . 0 0 "[ . 1]" 1
170 1 17 PRO HA 1 19 TYR H 4.300 . 6.000 4.657 4.531 4.787 . 0 0 "[ . 1]" 1
171 1 17 PRO HA 1 20 ASP QB 2.900 . 3.900 2.639 2.167 3.793 . 0 0 "[ . 1]" 1
172 1 17 PRO HB2 1 17 PRO HD2 4.200 . 6.000 3.530 2.937 4.039 . 0 0 "[ . 1]" 1
173 1 17 PRO HB2 1 17 PRO HD3 4.200 . 6.000 3.866 3.846 3.884 . 0 0 "[ . 1]" 1
174 1 17 PRO HB2 1 18 THR H 4.100 . 6.000 2.702 2.311 2.929 . 0 0 "[ . 1]" 1
175 1 17 PRO HB2 1 18 THR HB 3.100 . 6.000 5.104 4.695 5.452 . 0 0 "[ . 1]" 1
176 1 17 PRO HB3 1 17 PRO HD2 3.900 . 5.800 3.944 3.904 3.995 . 0 0 "[ . 1]" 1
177 1 17 PRO HB3 1 17 PRO HG2 2.700 . 3.600 2.812 2.640 2.973 . 0 0 "[ . 1]" 1
178 1 17 PRO HB3 1 18 THR H 3.000 . 4.100 3.967 3.730 4.089 . 0 0 "[ . 1]" 1
179 1 17 PRO HD2 1 17 PRO HG2 2.600 . 3.500 2.309 2.283 2.330 . 0 0 "[ . 1]" 1
180 1 17 PRO HD2 1 18 THR H 3.600 . 5.200 3.301 2.990 3.473 . 0 0 "[ . 1]" 1
181 1 17 PRO HD3 1 17 PRO HG3 2.700 . 3.600 2.311 2.274 2.336 . 0 0 "[ . 1]" 1
182 1 17 PRO HD3 1 18 THR H 3.900 . 5.800 4.270 4.134 4.440 . 0 0 "[ . 1]" 1
183 1 17 PRO HG2 1 18 THR H 4.600 . 6.000 3.406 2.599 4.246 . 0 0 "[ . 1]" 1
184 1 18 THR H 1 18 THR HA 2.400 . 3.100 2.838 2.831 2.842 . 0 0 "[ . 1]" 1
185 1 18 THR H 1 18 THR MG 3.800 . 5.600 3.713 3.367 3.758 . 0 0 "[ . 1]" 1
186 1 18 THR H 1 19 TYR H 2.500 . 3.300 2.614 2.574 2.634 . 0 0 "[ . 1]" 1
187 1 18 THR H 1 19 TYR QE 4.700 . 6.000 5.696 5.385 6.025 0.025 5 0 "[ . 1]" 1
188 1 18 THR H 1 20 ASP H 4.000 . 6.000 3.807 3.666 3.967 . 0 0 "[ . 1]" 1
189 1 18 THR HA 1 18 THR MG 3.000 . 4.200 2.321 2.148 2.408 . 0 0 "[ . 1]" 1
190 1 18 THR HA 1 19 TYR H 2.900 . 3.900 3.556 3.540 3.564 . 0 0 "[ . 1]" 1
191 1 18 THR HA 1 20 ASP H 4.000 . 6.000 4.174 4.028 4.321 . 0 0 "[ . 1]" 1
192 1 18 THR HA 1 21 GLU HB2 3.700 . 5.400 3.131 2.650 3.480 . 0 0 "[ . 1]" 1
193 1 18 THR HA 1 21 GLU HB3 3.400 . 4.900 3.711 2.807 5.036 0.136 1 0 "[ . 1]" 1
194 1 18 THR HA 1 21 GLU HG2 4.200 . 6.000 4.710 4.005 5.638 . 0 0 "[ . 1]" 1
195 1 18 THR HB 1 19 TYR H 2.700 . 3.600 2.573 2.452 2.825 . 0 0 "[ . 1]" 1
196 1 18 THR HB 1 19 TYR QE 3.700 . 5.400 3.723 3.460 4.322 . 0 0 "[ . 1]" 1
197 1 18 THR MG 1 19 TYR H 3.600 . 5.200 3.656 3.423 4.132 . 0 0 "[ . 1]" 1
198 1 18 THR MG 1 19 TYR QE 2.900 . 6.000 3.619 3.177 4.248 . 0 0 "[ . 1]" 1
199 1 18 THR MG 1 20 ASP H 5.500 . 6.000 4.975 4.816 5.400 . 0 0 "[ . 1]" 1
200 1 18 THR MG 1 21 GLU H 5.300 . 6.000 4.770 4.599 5.027 . 0 0 "[ . 1]" 1
201 1 19 TYR H 1 19 TYR HB2 3.200 . 4.400 2.576 2.481 2.680 . 0 0 "[ . 1]" 1
202 1 19 TYR H 1 19 TYR HB3 3.700 . 5.400 3.624 3.610 3.645 . 0 0 "[ . 1]" 1
203 1 19 TYR H 1 19 TYR QD 3.200 . 4.500 3.040 2.879 3.206 . 0 0 "[ . 1]" 1
204 1 19 TYR H 1 20 ASP H 2.500 . 3.300 2.425 2.326 2.459 . 0 0 "[ . 1]" 1
205 1 19 TYR H 1 73 ALA MB 5.100 . 6.000 4.799 4.566 5.074 . 0 0 "[ . 1]" 1
206 1 19 TYR HA 1 19 TYR QD 2.300 . 6.000 2.091 1.955 2.215 . 0 0 "[ . 1]" 1
207 1 19 TYR HB2 1 19 TYR QD 2.700 . 3.600 2.391 2.286 2.470 . 0 0 "[ . 1]" 1
208 1 19 TYR HB2 1 20 ASP H 3.500 . 5.000 3.020 2.962 3.102 . 0 0 "[ . 1]" 1
209 1 19 TYR HB2 1 22 ILE MD 3.300 . 6.000 5.049 4.591 6.694 0.694 8 1 "[ . + 1]" 1
210 1 19 TYR HB2 1 73 ALA MB 3.500 . 5.000 2.828 2.621 3.048 . 0 0 "[ . 1]" 1
211 1 19 TYR HB3 1 19 TYR QD 3.000 . 4.100 2.755 2.724 2.775 . 0 0 "[ . 1]" 1
212 1 19 TYR HB3 1 20 ASP H 3.600 . 5.300 4.036 3.931 4.146 . 0 0 "[ . 1]" 1
213 1 19 TYR HB3 1 73 ALA MB 3.900 . 5.800 3.256 2.910 3.582 . 0 0 "[ . 1]" 1
214 1 19 TYR QD 1 20 ASP H 4.300 . 6.000 4.473 4.384 4.609 . 0 0 "[ . 1]" 1
215 1 19 TYR QD 1 22 ILE H 4.200 . 6.000 4.928 4.657 5.190 . 0 0 "[ . 1]" 1
216 1 19 TYR QD 1 22 ILE MD 3.200 . 4.500 2.587 2.060 4.526 0.026 8 0 "[ . 1]" 1
217 1 19 TYR QD 1 73 ALA H 5.600 . 6.000 4.916 4.762 5.154 . 0 0 "[ . 1]" 1
218 1 19 TYR QD 1 73 ALA HA 3.300 . 4.700 2.643 2.294 3.030 . 0 0 "[ . 1]" 1
219 1 19 TYR QD 1 73 ALA MB 2.800 . 3.800 2.076 1.873 2.652 . 0 0 "[ . 1]" 1
220 1 19 TYR QD 1 74 LEU H 5.400 . 6.000 5.061 4.917 5.363 . 0 0 "[ . 1]" 1
221 1 19 TYR QD 1 76 ASN HA 4.000 . 6.000 5.351 5.128 5.553 . 0 0 "[ . 1]" 1
222 1 19 TYR QE 1 22 ILE MD 2.400 . 6.000 3.992 3.445 5.565 . 0 0 "[ . 1]" 1
223 1 19 TYR QE 1 73 ALA HA 4.000 . 6.000 4.326 4.072 4.642 . 0 0 "[ . 1]" 1
224 1 19 TYR QE 1 73 ALA MB 3.600 . 5.200 3.719 3.301 4.366 . 0 0 "[ . 1]" 1
225 1 19 TYR QE 1 76 ASN H 5.200 . 6.000 5.413 4.831 5.937 . 0 0 "[ . 1]" 1
226 1 19 TYR QE 1 76 ASN HA 4.500 . 6.000 5.165 4.768 5.629 . 0 0 "[ . 1]" 1
227 1 19 TYR QE 1 76 ASN HB2 3.600 . 5.200 4.168 3.615 5.103 . 0 0 "[ . 1]" 1
228 1 19 TYR QE 1 76 ASN HB3 3.100 . 4.300 3.174 2.876 3.695 . 0 0 "[ . 1]" 1
229 1 19 TYR QE 1 77 HIS H 4.100 . 6.000 3.808 3.034 4.324 . 0 0 "[ . 1]" 1
230 1 19 TYR QE 1 77 HIS QB . . 4.700 2.703 2.282 3.301 . 0 0 "[ . 1]" 1
231 1 20 ASP H 1 20 ASP HA 2.900 . 3.900 2.854 2.824 2.894 . 0 0 "[ . 1]" 1
232 1 20 ASP H 1 20 ASP QB 3.300 . 3.500 2.300 2.183 2.473 . 0 0 "[ . 1]" 1
233 1 20 ASP H 1 21 GLU H 2.500 . 3.300 2.485 2.293 2.641 . 0 0 "[ . 1]" 1
234 1 20 ASP H 1 21 GLU HA 5.100 . 6.000 5.118 4.974 5.234 . 0 0 "[ . 1]" 1
235 1 20 ASP H 1 22 ILE H 4.600 . 6.000 3.936 3.761 4.077 . 0 0 "[ . 1]" 1
236 1 20 ASP H 1 23 PHE H 4.700 . 6.000 4.426 4.291 4.541 . 0 0 "[ . 1]" 1
237 1 20 ASP H 1 73 ALA MB 4.700 . 6.000 4.934 4.542 5.394 . 0 0 "[ . 1]" 1
238 1 20 ASP HA 1 20 ASP QB 3.200 . 4.500 2.391 2.173 2.500 . 0 0 "[ . 1]" 1
239 1 20 ASP HA 1 21 GLU H 3.900 . 5.800 3.518 3.459 3.555 . 0 0 "[ . 1]" 1
240 1 20 ASP HA 1 22 ILE H 4.900 . 6.000 4.286 3.999 4.531 . 0 0 "[ . 1]" 1
241 1 20 ASP HA 1 23 PHE H 3.200 . 4.500 3.219 2.676 3.434 . 0 0 "[ . 1]" 1
242 1 20 ASP HA 1 23 PHE HA 4.400 . 6.000 4.990 4.433 5.311 . 0 0 "[ . 1]" 1
243 1 20 ASP HA 1 23 PHE QB 4.000 . 6.000 2.246 1.864 2.527 0.136 8 0 "[ . 1]" 1
244 1 20 ASP QB 1 21 GLU H 3.500 . 4.300 2.628 2.433 3.559 . 0 0 "[ . 1]" 1
245 1 20 ASP QB 1 24 TYR QE 4.200 . 6.000 3.478 2.285 4.479 . 0 0 "[ . 1]" 1
246 1 21 GLU H 1 21 GLU HA 2.300 . 3.000 2.791 2.758 2.826 . 0 0 "[ . 1]" 1
247 1 21 GLU H 1 21 GLU HB2 2.500 . 6.000 2.368 2.063 2.523 . 0 0 "[ . 1]" 1
248 1 21 GLU H 1 21 GLU HB3 2.700 . 3.600 3.032 2.527 3.609 0.009 1 0 "[ . 1]" 1
249 1 21 GLU H 1 21 GLU HG2 3.800 . 5.600 4.068 3.287 4.582 . 0 0 "[ . 1]" 1
250 1 21 GLU H 1 21 GLU HG3 3.600 . 5.200 3.756 2.081 4.509 . 0 0 "[ . 1]" 1
251 1 21 GLU H 1 23 PHE H 4.300 . 6.000 4.055 3.850 4.280 . 0 0 "[ . 1]" 1
252 1 21 GLU HA 1 21 GLU HB3 2.500 . 3.300 2.828 2.469 3.031 . 0 0 "[ . 1]" 1
253 1 21 GLU HA 1 21 GLU HG2 3.500 . 5.000 3.113 2.380 3.814 . 0 0 "[ . 1]" 1
254 1 21 GLU HA 1 21 GLU HG3 3.300 . 4.600 2.937 2.407 3.574 . 0 0 "[ . 1]" 1
255 1 21 GLU HA 1 22 ILE H 3.800 . 5.600 3.519 3.480 3.545 . 0 0 "[ . 1]" 1
256 1 21 GLU HA 1 22 ILE MD 4.600 . 6.000 5.999 4.829 6.157 0.157 5 0 "[ . 1]" 1
257 1 21 GLU HA 1 24 TYR HB3 4.400 . 6.000 5.029 4.520 5.684 . 0 0 "[ . 1]" 1
258 1 21 GLU HB2 1 21 GLU HG2 2.900 . 4.000 2.732 2.413 3.011 . 0 0 "[ . 1]" 1
259 1 21 GLU HB2 1 22 ILE H 3.400 . 4.900 3.344 2.603 3.802 . 0 0 "[ . 1]" 1
260 1 22 ILE H 1 22 ILE HA 2.800 . 3.800 2.859 2.824 2.896 . 0 0 "[ . 1]" 1
261 1 22 ILE H 1 22 ILE HB 2.300 . 3.000 2.541 2.482 2.652 . 0 0 "[ . 1]" 1
262 1 22 ILE H 1 22 ILE MD 3.300 . 4.700 3.282 3.003 3.408 . 0 0 "[ . 1]" 1
263 1 22 ILE H 1 22 ILE HG12 3.400 . 4.800 3.371 2.047 3.639 . 0 0 "[ . 1]" 1
264 1 22 ILE H 1 22 ILE HG13 2.600 . 3.400 2.231 1.982 3.588 0.188 8 0 "[ . 1]" 1
265 1 22 ILE H 1 22 ILE MG 3.100 . 6.000 3.768 3.745 3.793 . 0 0 "[ . 1]" 1
266 1 22 ILE H 1 23 PHE H 2.300 . 3.000 2.526 2.407 2.708 . 0 0 "[ . 1]" 1
267 1 22 ILE H 1 23 PHE QB 4.800 . 6.000 4.221 4.127 4.369 . 0 0 "[ . 1]" 1
268 1 22 ILE H 1 24 TYR H 4.900 . 6.000 4.110 3.960 4.277 . 0 0 "[ . 1]" 1
269 1 22 ILE H 1 25 THR HG1 5.500 . 6.000 4.772 3.996 5.118 . 0 0 "[ . 1]" 1
270 1 22 ILE HA 1 22 ILE HB 3.000 . 4.200 3.024 3.021 3.028 . 0 0 "[ . 1]" 1
271 1 22 ILE HA 1 22 ILE MD 3.600 . 5.200 3.705 2.137 3.898 . 0 0 "[ . 1]" 1
272 1 22 ILE HA 1 22 ILE HG12 3.000 . 4.100 2.734 2.622 3.246 . 0 0 "[ . 1]" 1
273 1 22 ILE HA 1 22 ILE HG13 3.100 . 4.300 2.958 2.828 3.804 . 0 0 "[ . 1]" 1
274 1 22 ILE HA 1 22 ILE MG 2.500 . 3.300 2.372 2.343 2.409 . 0 0 "[ . 1]" 1
275 1 22 ILE HA 1 23 PHE H 3.600 . 5.200 3.524 3.476 3.556 . 0 0 "[ . 1]" 1
276 1 22 ILE HA 1 25 THR H 3.700 . 5.400 3.575 3.324 3.674 . 0 0 "[ . 1]" 1
277 1 22 ILE HA 1 25 THR HG1 3.400 . 4.800 2.424 1.979 2.716 0.021 1 0 "[ . 1]" 1
278 1 22 ILE HA 1 25 THR MG 2.700 . 3.600 3.344 2.771 3.633 0.033 8 0 "[ . 1]" 1
279 1 22 ILE HA 1 72 PHE QE 2.900 . 6.000 4.852 4.277 5.205 . 0 0 "[ . 1]" 1
280 1 22 ILE HA 1 72 PHE HZ 3.300 . 6.000 5.669 5.395 6.035 0.035 6 0 "[ . 1]" 1
281 1 22 ILE HB 1 22 ILE MD 2.900 . 3.900 2.420 2.308 3.234 . 0 0 "[ . 1]" 1
282 1 22 ILE HB 1 22 ILE HG13 2.900 . 4.000 2.557 2.465 2.577 . 0 0 "[ . 1]" 1
283 1 22 ILE HB 1 22 ILE MG 2.100 . 2.700 2.131 2.127 2.135 . 0 0 "[ . 1]" 1
284 1 22 ILE HB 1 23 PHE H 2.900 . 3.900 2.623 2.387 2.893 . 0 0 "[ . 1]" 1
285 1 22 ILE HB 1 72 PHE QE 2.700 . 3.600 2.601 2.342 2.954 . 0 0 "[ . 1]" 1
286 1 22 ILE HB 1 72 PHE HZ 3.700 . 5.400 3.985 3.640 4.537 . 0 0 "[ . 1]" 1
287 1 22 ILE MD 1 22 ILE HG12 2.300 . 2.900 2.114 2.111 2.117 . 0 0 "[ . 1]" 1
288 1 22 ILE MD 1 22 ILE HG13 2.300 . 2.900 2.113 2.111 2.115 . 0 0 "[ . 1]" 1
289 1 22 ILE MD 1 23 PHE H 3.000 . 6.000 4.387 4.232 4.592 . 0 0 "[ . 1]" 1
290 1 22 ILE MD 1 72 PHE QE 2.800 . 6.000 4.006 3.591 4.821 . 0 0 "[ . 1]" 1
291 1 22 ILE HG12 1 22 ILE MG 3.000 . 4.100 2.377 2.273 3.201 . 0 0 "[ . 1]" 1
292 1 22 ILE HG12 1 23 PHE H 5.200 . 6.000 4.910 4.013 5.112 . 0 0 "[ . 1]" 1
293 1 22 ILE HG13 1 23 PHE H 4.800 . 6.000 4.222 4.070 4.959 . 0 0 "[ . 1]" 1
294 1 22 ILE MG 1 23 PHE H 3.600 . 5.200 3.532 3.273 3.765 . 0 0 "[ . 1]" 1
295 1 22 ILE MG 1 23 PHE HA 3.700 . 5.400 3.574 3.326 3.738 . 0 0 "[ . 1]" 1
296 1 22 ILE MG 1 25 THR H 4.400 . 6.000 4.419 4.163 4.617 . 0 0 "[ . 1]" 1
297 1 22 ILE MG 1 25 THR HB 4.800 . 6.000 5.095 4.801 5.365 . 0 0 "[ . 1]" 1
298 1 22 ILE MG 1 25 THR HG1 3.300 . 4.700 3.371 2.913 3.808 . 0 0 "[ . 1]" 1
299 1 22 ILE MG 1 26 LEU QD 3.500 . 6.000 2.567 2.087 2.992 . 0 0 "[ . 1]" 1
300 1 22 ILE MG 1 26 LEU HG 3.700 . 5.400 3.689 2.972 4.591 . 0 0 "[ . 1]" 1
301 1 22 ILE MG 1 41 GLU HB3 3.100 . 6.000 5.029 4.317 5.387 . 0 0 "[ . 1]" 1
302 1 22 ILE MG 1 41 GLU HG2 3.300 . 6.000 3.659 2.676 4.992 . 0 0 "[ . 1]" 1
303 1 22 ILE MG 1 41 GLU HG3 3.800 . 5.600 4.673 4.077 5.064 . 0 0 "[ . 1]" 1
304 1 22 ILE MG 1 72 PHE QE 2.700 . 6.000 2.674 2.169 3.185 . 0 0 "[ . 1]" 1
305 1 22 ILE MG 1 72 PHE HZ 2.900 . 3.900 2.513 2.227 2.721 . 0 0 "[ . 1]" 1
306 1 23 PHE H 1 23 PHE HA 2.500 . 3.300 2.794 2.760 2.844 . 0 0 "[ . 1]" 1
307 1 23 PHE H 1 23 PHE QB 2.600 . 3.400 2.215 2.190 2.260 . 0 0 "[ . 1]" 1
308 1 23 PHE H 1 23 PHE QD 4.800 . 6.000 4.156 4.120 4.190 . 0 0 "[ . 1]" 1
309 1 23 PHE H 1 24 TYR H 2.700 . 3.600 2.721 2.550 2.840 . 0 0 "[ . 1]" 1
310 1 23 PHE H 1 25 THR H 4.600 . 6.000 4.069 3.894 4.215 . 0 0 "[ . 1]" 1
311 1 23 PHE H 1 26 LEU QD 4.600 . 6.000 4.609 4.070 5.023 . 0 0 "[ . 1]" 1
312 1 23 PHE H 1 72 PHE QD 4.600 . 6.000 4.010 3.781 4.216 . 0 0 "[ . 1]" 1
313 1 23 PHE H 1 72 PHE QE 3.300 . 4.600 3.090 2.912 3.382 . 0 0 "[ . 1]" 1
314 1 23 PHE HA 1 23 PHE QD 3.000 . 4.100 2.668 2.482 2.772 . 0 0 "[ . 1]" 1
315 1 23 PHE HA 1 24 TYR H 3.100 . 4.300 3.527 3.506 3.550 . 0 0 "[ . 1]" 1
316 1 23 PHE HA 1 25 THR H 3.700 . 5.400 4.008 3.834 4.276 . 0 0 "[ . 1]" 1
317 1 23 PHE HA 1 26 LEU QD 2.800 . 6.000 2.985 2.682 3.396 . 0 0 "[ . 1]" 1
318 1 23 PHE HA 1 26 LEU HG 3.600 . 5.200 4.326 3.473 5.401 0.201 6 0 "[ . 1]" 1
319 1 23 PHE HA 1 33 ILE MD 4.100 . 6.000 3.547 2.911 5.165 . 0 0 "[ . 1]" 1
320 1 23 PHE HA 1 72 PHE QD 3.300 . 4.700 3.505 2.875 4.003 . 0 0 "[ . 1]" 1
321 1 23 PHE HA 1 72 PHE QE 3.400 . 4.800 2.914 2.341 3.329 . 0 0 "[ . 1]" 1
322 1 23 PHE QB 1 23 PHE QD 3.200 . 4.100 2.122 2.113 2.127 . 0 0 "[ . 1]" 1
323 1 23 PHE QB 1 24 TYR H 4.600 . 6.000 2.656 2.496 2.794 . 0 0 "[ . 1]" 1
324 1 23 PHE QB 1 33 ILE MD 5.200 . 6.000 4.485 4.054 5.688 . 0 0 "[ . 1]" 1
325 1 23 PHE QB 1 69 ASP QB 4.700 . 6.000 4.209 3.651 4.991 . 0 0 "[ . 1]" 1
326 1 23 PHE QB 1 72 PHE QD 3.100 . 4.300 2.224 2.002 2.481 . 0 0 "[ . 1]" 1
327 1 23 PHE QB 1 72 PHE QE 3.400 . 4.900 2.949 2.746 3.281 . 0 0 "[ . 1]" 1
328 1 23 PHE QD 1 24 TYR H 4.300 . 6.000 3.765 3.569 4.044 . 0 0 "[ . 1]" 1
329 1 23 PHE QD 1 24 TYR QD 3.300 . 6.000 2.073 1.762 2.377 . 0 0 "[ . 1]" 1
330 1 23 PHE QD 1 33 ILE MD 3.400 . 4.900 2.807 2.466 4.007 . 0 0 "[ . 1]" 1
331 1 23 PHE QD 1 69 ASP HA 3.700 . 5.400 3.502 3.126 3.737 . 0 0 "[ . 1]" 1
332 1 23 PHE QD 1 72 PHE QD 3.700 . 5.400 2.401 1.976 3.000 0.024 8 0 "[ . 1]" 1
333 1 23 PHE QE 1 31 GLY HA2 5.100 . 6.000 2.718 2.055 3.295 . 0 0 "[ . 1]" 1
334 1 23 PHE QE 1 31 GLY HA3 3.600 . 6.000 4.131 3.399 4.714 . 0 0 "[ . 1]" 1
335 1 23 PHE QE 1 32 LYS HA 4.200 . 6.000 3.172 2.774 3.419 . 0 0 "[ . 1]" 1
336 1 23 PHE QE 1 33 ILE H 3.900 . 5.800 2.678 2.211 2.950 . 0 0 "[ . 1]" 1
337 1 23 PHE QE 1 33 ILE MD 3.000 . 4.100 3.025 2.786 3.565 . 0 0 "[ . 1]" 1
338 1 23 PHE QE 1 33 ILE HG12 2.600 . 6.000 1.920 1.605 2.823 . 0 0 "[ . 1]" 1
339 1 23 PHE QE 1 33 ILE HG13 4.200 . 6.000 3.381 1.989 3.875 . 0 0 "[ . 1]" 1
340 1 23 PHE QE 1 33 ILE MG 2.700 . 3.600 2.564 2.275 2.801 . 0 0 "[ . 1]" 1
341 1 23 PHE QE 1 68 ASP HA 4.300 . 6.000 3.880 3.274 4.398 . 0 0 "[ . 1]" 1
342 1 23 PHE QE 1 69 ASP HA 3.400 . 4.900 3.340 3.049 3.596 . 0 0 "[ . 1]" 1
343 1 23 PHE QE 1 72 PHE H 4.600 . 6.000 4.416 4.027 4.940 . 0 0 "[ . 1]" 1
344 1 23 PHE QE 1 72 PHE HB2 3.500 . 5.000 2.803 2.630 3.288 . 0 0 "[ . 1]" 1
345 1 23 PHE HZ 1 32 LYS HA 2.800 . 3.800 1.945 1.753 2.192 0.047 5 0 "[ . 1]" 1
346 1 23 PHE HZ 1 33 ILE H 4.000 . 6.000 3.027 2.891 3.280 . 0 0 "[ . 1]" 1
347 1 23 PHE HZ 1 33 ILE MD 4.600 . 6.000 4.790 4.470 5.287 . 0 0 "[ . 1]" 1
348 1 23 PHE HZ 1 33 ILE MG 3.500 . 5.000 2.938 2.647 3.220 . 0 0 "[ . 1]" 1
349 1 23 PHE HZ 1 68 ASP HA 3.400 . 4.900 3.256 2.835 3.846 . 0 0 "[ . 1]" 1
350 1 23 PHE HZ 1 69 ASP H 3.500 . 5.100 3.493 3.269 3.868 . 0 0 "[ . 1]" 1
351 1 24 TYR H 1 24 TYR HA 2.700 . 3.600 2.881 2.861 2.903 . 0 0 "[ . 1]" 1
352 1 24 TYR H 1 24 TYR HB2 2.600 . 3.400 2.383 2.283 2.511 . 0 0 "[ . 1]" 1
353 1 24 TYR H 1 24 TYR HB3 3.600 . 5.200 3.598 3.561 3.636 . 0 0 "[ . 1]" 1
354 1 24 TYR H 1 24 TYR QD 2.800 . 3.800 2.653 2.211 3.298 . 0 0 "[ . 1]" 1
355 1 24 TYR H 1 25 THR H 2.900 . 4.000 2.494 2.437 2.566 . 0 0 "[ . 1]" 1
356 1 24 TYR H 1 25 THR HB 4.900 . 6.000 6.045 6.014 6.069 0.069 3 0 "[ . 1]" 1
357 1 24 TYR H 1 25 THR MG 3.900 . 5.800 3.993 3.666 4.295 . 0 0 "[ . 1]" 1
358 1 24 TYR HA 1 24 TYR HB2 2.700 . 3.600 3.011 2.994 3.026 . 0 0 "[ . 1]" 1
359 1 24 TYR HA 1 24 TYR HB3 2.600 . 3.400 2.540 2.462 2.615 . 0 0 "[ . 1]" 1
360 1 24 TYR HA 1 24 TYR QD 2.500 . 3.300 2.412 1.926 3.053 . 0 0 "[ . 1]" 1
361 1 24 TYR HA 1 25 THR H 2.900 . 3.900 3.368 3.242 3.462 . 0 0 "[ . 1]" 1
362 1 24 TYR HA 1 26 LEU H 3.600 . 5.200 3.633 3.523 3.751 . 0 0 "[ . 1]" 1
363 1 24 TYR HA 1 28 PRO QD 2.800 . 3.800 2.293 1.942 2.716 . 0 0 "[ . 1]" 1
364 1 24 TYR HA 1 28 PRO HG2 2.500 . 3.300 3.120 2.294 3.873 0.573 2 1 "[ + . 1]" 1
365 1 24 TYR HA 1 28 PRO HG3 4.000 . 6.000 1.935 1.758 2.304 0.242 4 0 "[ . 1]" 1
366 1 24 TYR HB2 1 24 TYR QD 2.700 . 3.600 2.604 2.351 2.770 . 0 0 "[ . 1]" 1
367 1 24 TYR HB2 1 25 THR H 4.500 . 6.000 3.393 3.096 3.770 . 0 0 "[ . 1]" 1
368 1 24 TYR HB2 1 25 THR MG 3.900 . 5.800 3.636 3.371 3.880 . 0 0 "[ . 1]" 1
369 1 24 TYR HB3 1 24 TYR QD 2.400 . 3.100 2.502 2.287 2.769 . 0 0 "[ . 1]" 1
370 1 24 TYR HB3 1 25 THR H 4.300 . 6.000 4.089 3.881 4.287 . 0 0 "[ . 1]" 1
371 1 24 TYR HB3 1 25 THR MG 4.300 . 6.000 4.273 3.962 4.571 . 0 0 "[ . 1]" 1
372 1 24 TYR QD 1 28 PRO HB2 4.900 . 6.000 4.533 3.499 5.061 . 0 0 "[ . 1]" 1
373 1 24 TYR QD 1 28 PRO HB3 4.400 . 6.000 4.020 2.620 4.945 . 0 0 "[ . 1]" 1
374 1 24 TYR QD 1 28 PRO QD 2.800 . 6.000 3.888 3.381 4.255 . 0 0 "[ . 1]" 1
375 1 24 TYR QD 1 28 PRO HG2 3.100 . 4.300 3.573 2.305 4.422 0.122 3 0 "[ . 1]" 1
376 1 24 TYR QD 1 28 PRO HG3 3.700 . 5.400 2.788 1.900 3.753 0.100 2 0 "[ . 1]" 1
377 1 24 TYR QE 1 28 PRO HB2 4.400 . 6.000 4.744 4.037 5.314 . 0 0 "[ . 1]" 1
378 1 24 TYR QE 1 28 PRO HB3 4.400 . 6.000 4.702 3.786 5.032 . 0 0 "[ . 1]" 1
379 1 24 TYR QE 1 28 PRO HG2 3.900 . 5.800 4.407 3.702 5.121 . 0 0 "[ . 1]" 1
380 1 24 TYR QE 1 69 ASP H 4.700 . 6.000 5.996 5.765 6.108 0.108 4 0 "[ . 1]" 1
381 1 24 TYR QE 1 69 ASP HA 3.700 . 5.400 4.993 4.589 5.562 0.162 5 0 "[ . 1]" 1
382 1 25 THR H 1 25 THR HA 2.900 . 4.000 2.914 2.875 2.935 . 0 0 "[ . 1]" 1
383 1 25 THR H 1 25 THR HB 3.700 . 5.400 3.664 3.591 3.734 . 0 0 "[ . 1]" 1
384 1 25 THR H 1 25 THR HG1 2.500 . 3.300 2.094 1.929 2.396 . 0 0 "[ . 1]" 1
385 1 25 THR H 1 25 THR MG 2.500 . 6.000 2.637 2.269 2.866 . 0 0 "[ . 1]" 1
386 1 25 THR H 1 26 LEU H 2.100 . 2.700 2.302 2.099 2.494 . 0 0 "[ . 1]" 1
387 1 25 THR H 1 26 LEU QD 5.400 . 6.000 3.977 3.167 4.615 . 0 0 "[ . 1]" 1
388 1 25 THR H 1 26 LEU HG 4.200 . 6.000 4.771 3.733 5.956 . 0 0 "[ . 1]" 1
389 1 25 THR HA 1 25 THR HG1 3.800 . 5.600 3.542 3.420 3.739 . 0 0 "[ . 1]" 1
390 1 25 THR HA 1 25 THR MG 2.500 . 3.300 2.312 2.243 2.415 . 0 0 "[ . 1]" 1
391 1 25 THR HA 1 26 LEU H 3.400 . 4.900 3.320 3.208 3.409 . 0 0 "[ . 1]" 1
392 1 25 THR HB 1 25 THR MG 2.300 . 2.900 2.130 2.127 2.134 . 0 0 "[ . 1]" 1
393 1 25 THR HG1 1 25 THR MG 2.800 . 3.800 2.475 2.068 2.959 . 0 0 "[ . 1]" 1
394 1 25 THR HG1 1 26 LEU H 3.700 . 5.400 3.243 2.643 4.097 . 0 0 "[ . 1]" 1
395 1 25 THR HG1 1 26 LEU HG 3.600 . 6.000 4.263 3.015 5.250 . 0 0 "[ . 1]" 1
396 1 25 THR MG 1 26 LEU H 4.100 . 6.000 4.208 4.031 4.325 . 0 0 "[ . 1]" 1
397 1 26 LEU H 1 26 LEU HA 2.900 . 3.900 2.926 2.909 2.941 . 0 0 "[ . 1]" 1
398 1 26 LEU H 1 26 LEU HB2 2.300 . 3.000 2.380 2.233 2.503 . 0 0 "[ . 1]" 1
399 1 26 LEU H 1 26 LEU HB3 3.800 . 5.600 3.603 3.482 3.690 . 0 0 "[ . 1]" 1
400 1 26 LEU H 1 26 LEU QD 3.200 . 4.500 3.039 2.362 3.466 . 0 0 "[ . 1]" 1
401 1 26 LEU H 1 26 LEU HG 2.800 . 6.000 3.416 2.765 4.340 . 0 0 "[ . 1]" 1
402 1 26 LEU H 1 27 SER H 2.700 . 3.600 2.438 2.214 2.613 . 0 0 "[ . 1]" 1
403 1 26 LEU H 1 28 PRO QD 3.000 . 4.200 3.525 3.044 3.768 . 0 0 "[ . 1]" 1
404 1 26 LEU H 1 33 ILE MG 4.300 . 6.000 4.041 3.778 4.324 . 0 0 "[ . 1]" 1
405 1 26 LEU HA 1 26 LEU HB3 3.000 . 4.100 2.565 2.492 2.683 . 0 0 "[ . 1]" 1
406 1 26 LEU HA 1 26 LEU QD . . 2.800 2.071 1.847 2.534 0.153 10 0 "[ . 1]" 1
407 1 26 LEU HA 1 26 LEU HG 3.400 . 4.800 2.981 2.440 3.663 . 0 0 "[ . 1]" 1
408 1 26 LEU HA 1 27 SER H 3.000 . 4.100 3.125 3.021 3.234 . 0 0 "[ . 1]" 1
409 1 26 LEU HB2 1 26 LEU QD 4.100 . 4.100 2.247 2.119 2.324 . 0 0 "[ . 1]" 1
410 1 26 LEU HB2 1 27 SER H 3.900 . 5.800 3.778 3.566 3.954 . 0 0 "[ . 1]" 1
411 1 26 LEU HB2 1 33 ILE MG 3.000 . 4.100 2.558 2.325 2.740 . 0 0 "[ . 1]" 1
412 1 26 LEU HB2 1 37 ASN HB3 4.500 . 6.000 3.806 3.502 4.374 . 0 0 "[ . 1]" 1
413 1 26 LEU HB3 1 26 LEU QD 2.900 . 3.100 2.187 2.108 2.394 . 0 0 "[ . 1]" 1
414 1 26 LEU HB3 1 33 ILE MD 3.900 . 5.800 3.314 2.909 4.545 . 0 0 "[ . 1]" 1
415 1 26 LEU HB3 1 33 ILE MG 3.500 . 5.000 3.010 2.543 3.501 . 0 0 "[ . 1]" 1
416 1 26 LEU HB3 1 37 ASN HB2 3.600 . 5.300 2.987 2.590 3.883 . 0 0 "[ . 1]" 1
417 1 26 LEU HB3 1 37 ASN HB3 2.600 . 3.500 2.198 1.855 2.679 . 0 0 "[ . 1]" 1
418 1 26 LEU HB3 1 38 ALA H 2.800 . 6.000 5.248 4.916 5.778 . 0 0 "[ . 1]" 1
419 1 26 LEU MD1 1 26 LEU MD2 2.400 . 3.100 2.081 2.071 2.088 . 0 0 "[ . 1]" 1
420 1 26 LEU QD 1 27 SER H 4.900 . 6.000 4.234 3.916 4.351 . 0 0 "[ . 1]" 1
421 1 26 LEU QD 1 33 ILE HB 4.400 . 6.000 3.995 3.604 4.886 . 0 0 "[ . 1]" 1
422 1 26 LEU QD 1 33 ILE MG 3.800 . 5.600 3.229 2.830 3.876 . 0 0 "[ . 1]" 1
423 1 26 LEU QD 1 37 ASN HB2 3.600 . 6.000 2.965 2.374 3.591 . 0 0 "[ . 1]" 1
424 1 26 LEU QD 1 37 ASN HB3 3.400 . 4.900 2.227 1.876 2.768 0.024 1 0 "[ . 1]" 1
425 1 26 LEU QD 1 38 ALA HA 3.500 . 5.000 3.233 2.908 4.523 . 0 0 "[ . 1]" 1
426 1 26 LEU QD 1 40 LYS HB2 3.300 . 6.000 3.855 3.265 4.512 . 0 0 "[ . 1]" 1
427 1 26 LEU QD 1 41 GLU H 3.800 . 5.600 3.665 3.364 4.029 . 0 0 "[ . 1]" 1
428 1 26 LEU QD 1 41 GLU HB2 2.900 . 4.000 2.587 1.947 3.281 . 0 0 "[ . 1]" 1
429 1 26 LEU QD 1 41 GLU HB3 3.900 . 5.800 3.503 3.221 4.429 . 0 0 "[ . 1]" 1
430 1 26 LEU QD 1 41 GLU HG2 4.200 . 6.000 3.776 3.092 4.641 . 0 0 "[ . 1]" 1
431 1 26 LEU QD 1 41 GLU HG3 4.600 . 6.000 4.632 4.068 5.258 . 0 0 "[ . 1]" 1
432 1 26 LEU QD 1 72 PHE HZ 2.800 . 3.800 2.553 2.115 2.967 . 0 0 "[ . 1]" 1
433 1 26 LEU HG 1 38 ALA HA 4.000 . 6.000 5.752 4.315 6.116 0.116 9 0 "[ . 1]" 1
434 1 27 SER H 1 27 SER HA 2.200 . 2.800 2.258 2.253 2.267 . 0 0 "[ . 1]" 1
435 1 27 SER H 1 27 SER HB2 3.300 . 4.700 3.586 3.193 4.037 . 0 0 "[ . 1]" 1
436 1 27 SER H 1 27 SER HB3 3.700 . 5.400 3.873 3.140 4.073 . 0 0 "[ . 1]" 1
437 1 27 SER H 1 28 PRO QD 3.400 . 3.400 2.470 2.331 2.615 . 0 0 "[ . 1]" 1
438 1 27 SER H 1 28 PRO HG2 5.000 . 6.000 5.272 4.974 5.544 . 0 0 "[ . 1]" 1
439 1 27 SER H 1 28 PRO HG3 6.000 . 6.000 4.519 4.078 4.928 . 0 0 "[ . 1]" 1
440 1 27 SER H 1 33 ILE MG 4.700 . 6.000 4.332 4.000 4.597 . 0 0 "[ . 1]" 1
441 1 27 SER HA 1 28 PRO QD . . 3.000 2.066 2.002 2.156 . 0 0 "[ . 1]" 1
442 1 27 SER HA 1 33 ILE MG 3.100 . 6.000 4.674 4.384 4.980 . 0 0 "[ . 1]" 1
443 1 27 SER HB2 1 29 VAL QG 2.800 . 6.000 4.638 3.842 5.361 . 0 0 "[ . 1]" 1
444 1 28 PRO HA 1 28 PRO HB3 2.300 . 3.000 2.289 2.255 2.313 . 0 0 "[ . 1]" 1
445 1 28 PRO HA 1 28 PRO QD 3.700 . 5.500 3.493 3.441 3.530 . 0 0 "[ . 1]" 1
446 1 28 PRO HA 1 28 PRO HG3 3.900 . 5.800 3.828 3.335 4.048 . 0 0 "[ . 1]" 1
447 1 28 PRO HA 1 29 VAL H 2.000 . 2.500 2.173 2.143 2.281 . 0 0 "[ . 1]" 1
448 1 28 PRO HA 1 29 VAL QG 4.000 . 6.000 3.382 3.225 3.597 . 0 0 "[ . 1]" 1
449 1 28 PRO HA 1 32 LYS H 4.300 . 6.000 4.147 3.751 4.524 . 0 0 "[ . 1]" 1
450 1 28 PRO HA 1 33 ILE HA 3.400 . 4.800 3.062 2.821 3.553 . 0 0 "[ . 1]" 1
451 1 28 PRO HA 1 33 ILE MG 2.200 . 2.800 1.981 1.724 2.255 . 0 0 "[ . 1]" 1
452 1 28 PRO HA 1 34 THR H 5.100 . 6.000 4.996 4.730 5.580 . 0 0 "[ . 1]" 1
453 1 28 PRO HB2 1 28 PRO QD 4.300 . 6.000 3.374 2.943 3.550 . 0 0 "[ . 1]" 1
454 1 28 PRO HB2 1 29 VAL H 3.400 . 4.900 3.463 2.883 3.767 . 0 0 "[ . 1]" 1
455 1 28 PRO HB2 1 31 GLY H 3.200 . 4.400 3.225 2.854 3.617 . 0 0 "[ . 1]" 1
456 1 28 PRO HB2 1 31 GLY HA3 3.200 . 6.000 4.922 4.412 5.631 . 0 0 "[ . 1]" 1
457 1 28 PRO HB2 1 32 LYS H 3.600 . 5.200 3.653 3.063 4.239 . 0 0 "[ . 1]" 1
458 1 28 PRO HB2 1 33 ILE MG 4.000 . 6.000 3.683 3.390 4.101 . 0 0 "[ . 1]" 1
459 1 28 PRO HB3 1 28 PRO QD 4.800 . 5.400 3.211 2.907 3.513 . 0 0 "[ . 1]" 1
460 1 28 PRO HB3 1 29 VAL H 4.300 . 6.000 3.861 3.502 4.193 . 0 0 "[ . 1]" 1
461 1 28 PRO HB3 1 31 GLY H 5.100 . 6.000 4.644 4.252 5.142 . 0 0 "[ . 1]" 1
462 1 28 PRO HB3 1 31 GLY HA3 4.500 . 6.000 5.853 5.497 6.031 0.031 3 0 "[ . 1]" 1
463 1 28 PRO HB3 1 33 ILE MG 3.100 . 4.300 2.510 2.025 3.119 . 0 0 "[ . 1]" 1
464 1 28 PRO QD 1 28 PRO HG2 3.000 . 3.300 2.196 2.175 2.222 . 0 0 "[ . 1]" 1
465 1 28 PRO QD 1 28 PRO HG3 2.500 . 3.300 2.198 2.175 2.256 . 0 0 "[ . 1]" 1
466 1 28 PRO QD 1 29 VAL QG 3.800 . 6.000 4.570 4.371 4.824 . 0 0 "[ . 1]" 1
467 1 28 PRO QD 1 33 ILE MG 3.200 . 5.800 3.735 3.587 3.973 . 0 0 "[ . 1]" 1
468 1 28 PRO HG2 1 31 GLY HA2 5.500 . 6.000 4.886 4.195 5.679 . 0 0 "[ . 1]" 1
469 1 28 PRO HG2 1 33 ILE MG 2.100 . 6.000 4.627 4.302 5.200 . 0 0 "[ . 1]" 1
470 1 29 VAL H 1 29 VAL HA 2.300 . 2.900 2.939 2.903 2.949 0.049 1 0 "[ . 1]" 1
471 1 29 VAL H 1 29 VAL HB 2.900 . 3.900 3.523 2.592 3.789 . 0 0 "[ . 1]" 1
472 1 29 VAL H 1 29 VAL QG 2.600 . 6.000 2.122 1.863 2.565 . 0 0 "[ . 1]" 1
473 1 29 VAL H 1 32 LYS H 2.700 . 3.600 3.033 2.880 3.271 . 0 0 "[ . 1]" 1
474 1 29 VAL H 1 32 LYS HA 5.000 . 6.000 4.759 4.601 5.053 . 0 0 "[ . 1]" 1
475 1 29 VAL H 1 32 LYS HB3 4.800 . 6.000 5.304 4.930 5.955 . 0 0 "[ . 1]" 1
476 1 29 VAL H 1 33 ILE HA 3.500 . 5.000 3.138 2.997 3.258 . 0 0 "[ . 1]" 1
477 1 29 VAL H 1 33 ILE MG 3.400 . 4.800 3.432 3.091 3.667 . 0 0 "[ . 1]" 1
478 1 29 VAL H 1 34 THR H 3.700 . 6.000 5.053 4.698 5.248 . 0 0 "[ . 1]" 1
479 1 29 VAL H 1 34 THR MG 3.300 . 6.000 5.015 4.511 5.413 . 0 0 "[ . 1]" 1
480 1 29 VAL HA 1 29 VAL HB 3.000 . 4.100 2.619 2.498 3.026 . 0 0 "[ . 1]" 1
481 1 29 VAL HA 1 29 VAL QG 2.300 . 3.000 2.221 2.134 2.258 . 0 0 "[ . 1]" 1
482 1 29 VAL HA 1 30 ASN H 3.500 . 5.000 2.127 2.101 2.205 . 0 0 "[ . 1]" 1
483 1 29 VAL HB 1 29 VAL QG 2.100 . 2.700 1.898 1.896 1.900 . 0 0 "[ . 1]" 1
484 1 29 VAL HB 1 34 THR MG 4.000 . 6.000 5.310 4.046 6.000 0.000 5 0 "[ . 1]" 1
485 1 29 VAL QG 1 30 ASN HA 5.100 . 6.000 4.744 4.161 4.918 . 0 0 "[ . 1]" 1
486 1 29 VAL QG 1 30 ASN HB2 3.500 . 5.000 3.409 2.822 3.652 . 0 0 "[ . 1]" 1
487 1 29 VAL QG 1 30 ASN HB3 4.300 . 6.000 4.810 4.212 5.011 . 0 0 "[ . 1]" 1
488 1 29 VAL QG 1 30 ASN HD21 2.700 . 6.000 3.898 2.863 5.021 . 0 0 "[ . 1]" 1
489 1 29 VAL QG 1 30 ASN HD22 3.800 . 5.600 4.355 3.318 5.039 . 0 0 "[ . 1]" 1
490 1 29 VAL QG 1 31 GLY H 3.300 . 6.000 4.373 4.278 4.476 . 0 0 "[ . 1]" 1
491 1 30 ASN HA 1 30 ASN HB2 3.000 . 4.100 3.024 3.012 3.031 . 0 0 "[ . 1]" 1
492 1 30 ASN HA 1 30 ASN HB3 2.700 . 3.600 2.511 2.451 2.591 . 0 0 "[ . 1]" 1
493 1 30 ASN HA 1 31 GLY H 3.000 . 4.100 2.960 2.857 3.006 . 0 0 "[ . 1]" 1
494 1 30 ASN HB2 1 30 ASN HD21 3.200 . 4.500 2.488 2.208 3.492 . 0 0 "[ . 1]" 1
495 1 30 ASN HB2 1 31 GLY H 4.200 . 6.000 4.078 3.993 4.191 . 0 0 "[ . 1]" 1
496 1 30 ASN HB3 1 30 ASN HD21 3.200 . 4.500 2.977 2.872 3.446 . 0 0 "[ . 1]" 1
497 1 30 ASN HB3 1 31 GLY H 4.800 . 6.000 4.430 4.391 4.464 . 0 0 "[ . 1]" 1
498 1 31 GLY H 1 31 GLY HA2 2.900 . 3.900 2.334 2.303 2.362 . 0 0 "[ . 1]" 1
499 1 31 GLY H 1 31 GLY HA3 2.400 . 3.100 2.897 2.843 2.925 . 0 0 "[ . 1]" 1
500 1 31 GLY H 1 32 LYS H 2.800 . 3.800 2.410 2.264 2.566 . 0 0 "[ . 1]" 1
501 1 31 GLY H 1 32 LYS HB3 6.000 . 6.000 6.141 5.724 6.262 0.262 3 0 "[ . 1]" 1
502 1 31 GLY HA2 1 32 LYS H 3.800 . 5.600 3.103 2.995 3.272 . 0 0 "[ . 1]" 1
503 1 31 GLY HA2 1 32 LYS HG2 4.300 . 6.000 5.444 4.588 5.967 . 0 0 "[ . 1]" 1
504 1 31 GLY HA3 1 32 LYS H 3.100 . 4.300 3.392 3.320 3.462 . 0 0 "[ . 1]" 1
505 1 32 LYS H 1 32 LYS HB3 3.900 . 5.800 3.819 3.610 3.883 . 0 0 "[ . 1]" 1
506 1 32 LYS H 1 32 LYS HD2 3.600 . 6.000 4.989 4.613 5.512 . 0 0 "[ . 1]" 1
507 1 32 LYS H 1 32 LYS HE3 4.700 . 6.000 5.777 4.871 6.908 0.908 6 2 "[- .+ 1]" 1
508 1 32 LYS H 1 32 LYS HG2 3.600 . 5.300 3.968 2.524 4.460 . 0 0 "[ . 1]" 1
509 1 32 LYS H 1 32 LYS HG3 3.200 . 4.500 3.127 2.928 3.522 . 0 0 "[ . 1]" 1
510 1 32 LYS H 1 33 ILE H 4.700 . 6.000 4.363 4.269 4.432 . 0 0 "[ . 1]" 1
511 1 32 LYS H 1 33 ILE HA 4.000 . 6.000 4.691 4.574 4.809 . 0 0 "[ . 1]" 1
512 1 32 LYS H 1 66 LEU MD2 4.400 . 6.000 5.792 4.585 6.374 0.374 5 0 "[ . 1]" 1
513 1 32 LYS H 1 69 ASP QB 2.900 . 6.000 5.811 5.627 5.942 . 0 0 "[ . 1]" 1
514 1 32 LYS HA 1 32 LYS HB3 2.400 . 3.100 2.457 2.303 2.592 . 0 0 "[ . 1]" 1
515 1 32 LYS HA 1 32 LYS HD3 5.000 . 6.000 4.548 4.256 4.883 . 0 0 "[ . 1]" 1
516 1 32 LYS HA 1 32 LYS HG2 3.000 . 4.100 2.713 2.491 3.597 . 0 0 "[ . 1]" 1
517 1 32 LYS HA 1 32 LYS HG3 3.200 . 4.500 3.192 2.888 3.848 . 0 0 "[ . 1]" 1
518 1 32 LYS HA 1 33 ILE H 2.300 . 2.900 2.284 2.210 2.378 . 0 0 "[ . 1]" 1
519 1 32 LYS HA 1 33 ILE MG 4.000 . 6.000 3.788 3.612 4.009 . 0 0 "[ . 1]" 1
520 1 32 LYS HA 1 68 ASP HA 2.600 . 3.400 2.190 1.690 2.741 0.110 5 0 "[ . 1]" 1
521 1 32 LYS HA 1 68 ASP QB 5.500 . 6.000 4.102 3.237 4.723 . 0 0 "[ . 1]" 1
522 1 32 LYS HA 1 69 ASP H 4.600 . 6.000 3.731 3.490 3.931 . 0 0 "[ . 1]" 1
523 1 32 LYS HB2 1 33 ILE H 4.100 . 6.000 3.798 2.906 4.288 . 0 0 "[ . 1]" 1
524 1 32 LYS HB2 1 66 LEU QB 3.000 . 4.100 3.469 3.055 4.085 . 0 0 "[ . 1]" 1
525 1 32 LYS HB2 1 66 LEU MD2 3.300 . 6.000 3.838 2.679 4.332 . 0 0 "[ . 1]" 1
526 1 32 LYS HB2 1 67 LEU H 5.000 . 6.000 5.125 4.054 5.876 . 0 0 "[ . 1]" 1
527 1 32 LYS HB2 1 68 ASP HA 4.700 . 6.000 4.183 2.836 4.588 . 0 0 "[ . 1]" 1
528 1 32 LYS HB3 1 32 LYS HE3 4.100 . 6.000 3.529 1.990 4.840 0.010 5 0 "[ . 1]" 1
529 1 32 LYS HD2 1 66 LEU MD1 3.000 . 6.000 3.674 2.621 4.698 . 0 0 "[ . 1]" 1
530 1 32 LYS HD2 1 68 ASP QB 3.300 . 6.000 4.872 3.741 6.368 0.368 3 0 "[ . 1]" 1
531 1 32 LYS HD3 1 32 LYS HE3 3.000 . 4.100 2.708 2.422 3.019 . 0 0 "[ . 1]" 1
532 1 32 LYS HD3 1 33 ILE H 5.300 . 6.000 5.510 4.751 6.035 0.035 4 0 "[ . 1]" 1
533 1 32 LYS HE3 1 66 LEU MD1 3.700 . 5.400 3.717 2.365 4.991 . 0 0 "[ . 1]" 1
534 1 32 LYS HG2 1 68 ASP HA 3.000 . 4.100 2.233 1.569 4.208 0.331 8 0 "[ . 1]" 1
535 1 32 LYS HG2 1 68 ASP QB 3.500 . 5.100 3.104 1.566 3.777 0.334 2 0 "[ . 1]" 1
536 1 32 LYS HG3 1 33 ILE H 5.300 . 6.000 4.973 4.563 5.104 . 0 0 "[ . 1]" 1
537 1 32 LYS HG3 1 68 ASP QB 4.700 . 5.800 4.129 2.364 4.888 . 0 0 "[ . 1]" 1
538 1 33 ILE H 1 33 ILE HB 3.300 . 4.700 3.777 3.723 3.846 . 0 0 "[ . 1]" 1
539 1 33 ILE H 1 33 ILE MD 4.300 . 6.000 3.773 3.080 3.971 . 0 0 "[ . 1]" 1
540 1 33 ILE H 1 33 ILE HG13 2.600 . 3.500 2.805 1.966 3.025 . 0 0 "[ . 1]" 1
541 1 33 ILE H 1 33 ILE MG 2.900 . 4.000 2.886 2.795 3.052 . 0 0 "[ . 1]" 1
542 1 33 ILE H 1 34 THR H 4.500 . 6.000 4.492 4.454 4.545 . 0 0 "[ . 1]" 1
543 1 33 ILE H 1 67 LEU H 3.100 . 4.300 3.073 2.800 3.477 . 0 0 "[ . 1]" 1
544 1 33 ILE H 1 67 LEU MD1 5.100 . 6.000 5.285 5.100 5.732 . 0 0 "[ . 1]" 1
545 1 33 ILE H 1 68 ASP HA 4.300 . 6.000 3.731 3.011 4.162 . 0 0 "[ . 1]" 1
546 1 33 ILE HA 1 33 ILE HB 2.600 . 3.400 2.472 2.431 2.513 . 0 0 "[ . 1]" 1
547 1 33 ILE HA 1 33 ILE MD 4.600 . 6.000 4.131 3.702 4.190 . 0 0 "[ . 1]" 1
548 1 33 ILE HA 1 33 ILE HG13 3.500 . 5.000 3.693 3.606 3.732 . 0 0 "[ . 1]" 1
549 1 33 ILE HA 1 33 ILE MG 2.400 . 3.100 2.318 2.284 2.354 . 0 0 "[ . 1]" 1
550 1 33 ILE HA 1 34 THR H 2.400 . 3.100 2.329 2.219 2.407 . 0 0 "[ . 1]" 1
551 1 33 ILE HA 1 34 THR MG 3.800 . 5.600 3.611 3.331 3.850 . 0 0 "[ . 1]" 1
552 1 33 ILE HB 1 33 ILE MD 2.800 . 3.800 2.379 2.296 2.420 . 0 0 "[ . 1]" 1
553 1 33 ILE HB 1 33 ILE HG12 3.000 . 4.100 2.986 2.630 3.028 . 0 0 "[ . 1]" 1
554 1 33 ILE HB 1 34 THR H 2.500 . 3.300 2.488 2.285 2.907 . 0 0 "[ . 1]" 1
555 1 33 ILE HB 1 37 ASN H 3.500 . 5.000 4.406 4.037 4.747 . 0 0 "[ . 1]" 1
556 1 33 ILE HB 1 37 ASN HB2 3.300 . 4.600 2.722 2.146 3.322 . 0 0 "[ . 1]" 1
557 1 33 ILE HB 1 38 ALA H 4.000 . 6.000 4.175 3.792 4.576 . 0 0 "[ . 1]" 1
558 1 33 ILE MD 1 33 ILE HG12 2.000 . 2.500 2.116 2.114 2.118 . 0 0 "[ . 1]" 1
559 1 33 ILE MD 1 33 ILE MG 2.200 . 6.000 2.085 1.917 3.178 . 0 0 "[ . 1]" 1
560 1 33 ILE MD 1 34 THR H 4.900 . 6.000 4.215 3.367 4.729 . 0 0 "[ . 1]" 1
561 1 33 ILE MD 1 37 ASN H 4.800 . 6.000 4.385 3.972 4.843 . 0 0 "[ . 1]" 1
562 1 33 ILE MD 1 37 ASN HB2 3.200 . 4.500 2.719 2.166 3.204 . 0 0 "[ . 1]" 1
563 1 33 ILE MD 1 38 ALA H 3.100 . 4.300 3.012 2.577 3.399 . 0 0 "[ . 1]" 1
564 1 33 ILE MD 1 38 ALA HA 2.700 . 3.600 3.011 2.617 3.382 . 0 0 "[ . 1]" 1
565 1 33 ILE MD 1 38 ALA MB 2.500 . 6.000 2.471 1.971 2.770 . 0 0 "[ . 1]" 1
566 1 33 ILE MD 1 39 LYS H 5.300 . 6.000 5.070 4.654 5.442 . 0 0 "[ . 1]" 1
567 1 33 ILE MD 1 67 LEU H 5.200 . 6.000 4.338 2.646 4.793 . 0 0 "[ . 1]" 1
568 1 33 ILE MD 1 67 LEU MD1 3.700 . 5.400 2.932 2.388 3.588 . 0 0 "[ . 1]" 1
569 1 33 ILE MD 1 72 PHE HB2 3.500 . 5.100 3.059 2.674 3.457 . 0 0 "[ . 1]" 1
570 1 33 ILE MD 1 72 PHE QD 2.500 . 6.000 2.317 2.135 2.679 . 0 0 "[ . 1]" 1
571 1 33 ILE MD 1 72 PHE QE 3.600 . 5.200 2.890 2.588 3.136 . 0 0 "[ . 1]" 1
572 1 33 ILE HG12 1 38 ALA H 4.700 . 6.000 5.436 4.957 5.652 . 0 0 "[ . 1]" 1
573 1 33 ILE HG12 1 38 ALA HA 3.800 . 5.600 5.664 4.920 6.083 0.483 1 0 "[ . 1]" 1
574 1 33 ILE HG12 1 38 ALA MB 3.500 . 5.000 4.186 3.895 4.345 . 0 0 "[ . 1]" 1
575 1 33 ILE HG12 1 67 LEU H 4.100 . 6.000 3.939 3.651 5.058 . 0 0 "[ . 1]" 1
576 1 33 ILE HG12 1 67 LEU MD1 3.800 . 5.600 4.179 3.887 4.777 . 0 0 "[ . 1]" 1
577 1 33 ILE HG13 1 33 ILE MG 3.000 . 4.100 3.154 2.653 3.219 . 0 0 "[ . 1]" 1
578 1 33 ILE HG13 1 34 THR HA 3.000 . 6.000 4.667 4.410 5.587 . 0 0 "[ . 1]" 1
579 1 33 ILE HG13 1 38 ALA H 3.800 . 5.600 4.165 3.643 5.598 . 0 0 "[ . 1]" 1
580 1 33 ILE MG 1 34 THR H 3.800 . 5.600 3.605 3.500 3.763 . 0 0 "[ . 1]" 1
581 1 33 ILE MG 1 37 ASN HB2 4.100 . 6.000 3.745 3.315 4.302 . 0 0 "[ . 1]" 1
582 1 33 ILE MG 1 37 ASN HB3 4.700 . 6.000 4.225 3.624 4.812 . 0 0 "[ . 1]" 1
583 1 33 ILE MG 1 38 ALA H 3.400 . 6.000 5.226 4.929 5.528 . 0 0 "[ . 1]" 1
584 1 34 THR H 1 34 THR HA 2.700 . 3.600 2.867 2.814 2.907 . 0 0 "[ . 1]" 1
585 1 34 THR H 1 34 THR HB 3.300 . 4.600 3.611 3.564 3.670 . 0 0 "[ . 1]" 1
586 1 34 THR H 1 34 THR HG1 4.200 . 6.000 2.628 2.002 3.322 . 0 0 "[ . 1]" 1
587 1 34 THR H 1 34 THR MG 2.300 . 6.000 2.369 2.139 2.512 . 0 0 "[ . 1]" 1
588 1 34 THR H 1 35 GLY H 5.100 . 6.000 4.597 4.546 4.643 . 0 0 "[ . 1]" 1
589 1 34 THR H 1 37 ASN H 3.900 . 5.800 4.069 3.608 4.391 . 0 0 "[ . 1]" 1
590 1 34 THR H 1 37 ASN HB2 3.600 . 5.200 3.800 2.968 4.160 . 0 0 "[ . 1]" 1
591 1 34 THR H 1 37 ASN HB3 5.100 . 6.000 5.272 4.364 5.833 . 0 0 "[ . 1]" 1
592 1 34 THR H 1 37 ASN HD22 4.200 . 6.000 4.434 3.648 4.890 . 0 0 "[ . 1]" 1
593 1 34 THR H 1 66 LEU MD2 4.400 . 6.000 3.780 3.375 4.806 . 0 0 "[ . 1]" 1
594 1 34 THR HA 1 34 THR MG 2.400 . 3.100 2.333 2.269 2.413 . 0 0 "[ . 1]" 1
595 1 34 THR HA 1 35 GLY H 2.500 . 3.300 2.403 2.304 2.494 . 0 0 "[ . 1]" 1
596 1 34 THR HA 1 36 ALA H 4.700 . 6.000 4.006 3.804 4.124 . 0 0 "[ . 1]" 1
597 1 34 THR HA 1 66 LEU HA 3.200 . 4.500 3.181 2.855 3.733 . 0 0 "[ . 1]" 1
598 1 34 THR HA 1 66 LEU MD2 2.300 . 2.900 2.101 1.734 3.070 0.170 5 0 "[ . 1]" 1
599 1 34 THR HB 1 34 THR MG 2.300 . 3.000 2.135 2.133 2.137 . 0 0 "[ . 1]" 1
600 1 34 THR HB 1 35 GLY H 2.400 . 3.100 2.455 2.243 2.747 . 0 0 "[ . 1]" 1
601 1 34 THR HB 1 36 ALA H 2.800 . 3.800 2.550 2.319 2.777 . 0 0 "[ . 1]" 1
602 1 34 THR HG1 1 34 THR MG 3.500 . 5.100 2.211 2.056 2.433 . 0 0 "[ . 1]" 1
603 1 34 THR HG1 1 36 ALA H 3.900 . 5.800 3.625 3.095 4.146 . 0 0 "[ . 1]" 1
604 1 34 THR HG1 1 36 ALA MB 3.800 . 5.600 3.007 2.585 3.403 . 0 0 "[ . 1]" 1
605 1 34 THR HG1 1 37 ASN H 3.700 . 5.400 3.386 2.685 4.098 . 0 0 "[ . 1]" 1
606 1 34 THR HG1 1 37 ASN HD21 4.600 . 6.000 3.234 2.215 4.367 . 0 0 "[ . 1]" 1
607 1 34 THR HG1 1 37 ASN HD22 4.500 . 6.000 3.063 2.891 3.225 . 0 0 "[ . 1]" 1
608 1 34 THR MG 1 35 GLY H 3.900 . 5.800 3.633 3.550 3.745 . 0 0 "[ . 1]" 1
609 1 34 THR MG 1 37 ASN H 4.600 . 6.000 4.706 4.242 4.940 . 0 0 "[ . 1]" 1
610 1 34 THR MG 1 37 ASN HD22 4.500 . 6.000 4.467 4.204 4.674 . 0 0 "[ . 1]" 1
611 1 34 THR MG 1 66 LEU MD2 2.400 . 6.000 2.307 2.083 2.761 . 0 0 "[ . 1]" 1
612 1 35 GLY H 1 35 GLY HA2 2.900 . 3.900 2.823 2.799 2.857 . 0 0 "[ . 1]" 1
613 1 35 GLY H 1 35 GLY HA3 2.400 . 3.100 2.291 2.286 2.300 . 0 0 "[ . 1]" 1
614 1 35 GLY H 1 36 ALA H 2.800 . 3.800 2.629 2.532 2.711 . 0 0 "[ . 1]" 1
615 1 35 GLY H 1 36 ALA MB 5.100 . 6.000 4.279 4.156 4.354 . 0 0 "[ . 1]" 1
616 1 35 GLY H 1 37 ASN H 5.600 . 6.000 4.622 4.276 4.946 . 0 0 "[ . 1]" 1
617 1 35 GLY H 1 38 ALA MB 5.300 . 6.000 4.653 4.418 4.972 . 0 0 "[ . 1]" 1
618 1 35 GLY H 1 56 TRP HH2 4.100 . 6.000 3.684 3.306 4.073 . 0 0 "[ . 1]" 1
619 1 35 GLY H 1 66 LEU HA 4.600 . 6.000 3.704 2.765 4.100 . 0 0 "[ . 1]" 1
620 1 35 GLY H 1 66 LEU MD2 4.100 . 6.000 3.401 2.809 4.371 . 0 0 "[ . 1]" 1
621 1 35 GLY H 2 8 PRO HB2 5.900 . 6.000 6.051 5.947 6.116 0.116 1 0 "[ . 1]" 1
622 1 35 GLY H 2 8 PRO HB3 6.000 . 6.000 4.908 4.761 5.061 . 0 0 "[ . 1]" 1
623 1 35 GLY HA2 1 36 ALA H 3.800 . 5.600 3.412 3.347 3.449 . 0 0 "[ . 1]" 1
624 1 35 GLY HA2 1 38 ALA H 4.100 . 6.000 3.431 3.243 3.692 . 0 0 "[ . 1]" 1
625 1 35 GLY HA2 1 38 ALA MB 2.900 . 4.000 2.350 2.130 2.729 . 0 0 "[ . 1]" 1
626 1 35 GLY HA2 1 56 TRP HH2 2.500 . 3.300 2.501 1.873 2.938 . 0 0 "[ . 1]" 1
627 1 35 GLY HA2 1 56 TRP HZ3 3.100 . 4.300 2.727 2.437 3.203 . 0 0 "[ . 1]" 1
628 1 35 GLY HA2 1 66 LEU MD2 2.700 . 6.000 5.145 4.563 6.036 0.036 5 0 "[ . 1]" 1
629 1 35 GLY HA2 2 8 PRO HB3 5.300 . 6.000 4.552 4.127 5.077 . 0 0 "[ . 1]" 1
630 1 35 GLY HA3 1 36 ALA H 3.100 . 4.300 3.094 3.016 3.149 . 0 0 "[ . 1]" 1
631 1 35 GLY HA3 1 38 ALA H 5.100 . 6.000 4.797 4.644 5.050 . 0 0 "[ . 1]" 1
632 1 35 GLY HA3 1 38 ALA MB 4.700 . 6.000 3.798 3.625 4.192 . 0 0 "[ . 1]" 1
633 1 35 GLY HA3 1 56 TRP HE3 4.500 . 6.000 5.593 5.132 6.023 0.023 6 0 "[ . 1]" 1
634 1 35 GLY HA3 1 56 TRP HH2 3.500 . 5.000 3.091 2.738 3.369 . 0 0 "[ . 1]" 1
635 1 35 GLY HA3 2 8 PRO HB3 3.400 . 4.800 3.100 2.833 3.497 . 0 0 "[ . 1]" 1
636 1 36 ALA H 1 36 ALA HA 2.800 . 3.800 2.822 2.792 2.860 . 0 0 "[ . 1]" 1
637 1 36 ALA H 1 36 ALA MB 2.400 . 3.100 2.230 2.216 2.257 . 0 0 "[ . 1]" 1
638 1 36 ALA H 1 37 ASN H 3.000 . 4.100 2.667 2.474 2.807 . 0 0 "[ . 1]" 1
639 1 36 ALA H 1 38 ALA H 3.700 . 5.500 4.018 3.890 4.160 . 0 0 "[ . 1]" 1
640 1 36 ALA H 1 39 LYS HB2 4.700 . 6.000 5.079 4.758 5.340 . 0 0 "[ . 1]" 1
641 1 36 ALA H 1 66 LEU MD2 3.700 . 6.000 5.236 4.783 6.161 0.161 5 0 "[ . 1]" 1
642 1 36 ALA HA 1 36 ALA MB 2.200 . 2.800 2.124 2.119 2.129 . 0 0 "[ . 1]" 1
643 1 36 ALA HA 1 37 ASN H 3.900 . 5.800 3.532 3.509 3.549 . 0 0 "[ . 1]" 1
644 1 36 ALA HA 1 37 ASN HD21 5.800 . 6.000 5.548 5.178 6.064 0.064 9 0 "[ . 1]" 1
645 1 36 ALA HA 1 37 ASN HD22 3.500 . 6.000 6.101 6.066 6.143 0.143 9 0 "[ . 1]" 1
646 1 36 ALA HA 1 38 ALA H 4.000 . 6.000 4.664 4.580 4.760 . 0 0 "[ . 1]" 1
647 1 36 ALA HA 1 39 LYS H 3.200 . 4.500 3.693 3.346 3.883 . 0 0 "[ . 1]" 1
648 1 36 ALA HA 1 39 LYS HB2 3.300 . 4.700 3.374 2.855 3.821 . 0 0 "[ . 1]" 1
649 1 36 ALA HA 1 39 LYS HB3 2.900 . 4.000 2.884 2.564 3.104 . 0 0 "[ . 1]" 1
650 1 36 ALA HA 1 40 LYS H 3.900 . 5.800 4.356 4.205 4.488 . 0 0 "[ . 1]" 1
651 1 36 ALA MB 1 37 ASN H 2.400 . 3.100 2.427 2.197 2.575 . 0 0 "[ . 1]" 1
652 1 36 ALA MB 1 37 ASN HB2 5.200 . 6.000 4.437 4.215 4.713 . 0 0 "[ . 1]" 1
653 1 36 ALA MB 1 37 ASN HD21 4.300 . 6.000 3.243 2.787 3.809 . 0 0 "[ . 1]" 1
654 1 36 ALA MB 1 37 ASN HD22 4.600 . 6.000 3.318 3.212 3.536 . 0 0 "[ . 1]" 1
655 1 36 ALA MB 1 38 ALA H 4.800 . 6.000 4.424 4.262 4.527 . 0 0 "[ . 1]" 1
656 1 37 ASN H 1 37 ASN HA 2.700 . 3.600 2.867 2.835 2.889 . 0 0 "[ . 1]" 1
657 1 37 ASN H 1 37 ASN HB2 2.400 . 3.100 2.555 2.325 2.853 . 0 0 "[ . 1]" 1
658 1 37 ASN H 1 37 ASN HB3 3.300 . 4.700 3.589 3.550 3.614 . 0 0 "[ . 1]" 1
659 1 37 ASN H 1 37 ASN HD21 3.300 . 4.700 2.733 2.065 3.732 . 0 0 "[ . 1]" 1
660 1 37 ASN H 1 37 ASN HD22 4.800 . 6.000 3.580 3.289 3.759 . 0 0 "[ . 1]" 1
661 1 37 ASN H 1 38 ALA H 2.400 . 3.100 2.457 2.379 2.556 . 0 0 "[ . 1]" 1
662 1 37 ASN H 1 38 ALA MB 3.700 . 5.400 4.124 4.046 4.209 . 0 0 "[ . 1]" 1
663 1 37 ASN H 1 39 LYS H 3.800 . 5.600 3.892 3.739 4.074 . 0 0 "[ . 1]" 1
664 1 37 ASN HA 1 37 ASN HB3 2.500 . 3.300 2.443 2.318 2.566 . 0 0 "[ . 1]" 1
665 1 37 ASN HA 1 38 ALA H 3.600 . 5.200 3.519 3.500 3.530 . 0 0 "[ . 1]" 1
666 1 37 ASN HA 1 39 LYS H 4.500 . 6.000 4.305 4.145 4.450 . 0 0 "[ . 1]" 1
667 1 37 ASN HA 1 40 LYS H 3.400 . 4.800 3.192 2.998 3.355 . 0 0 "[ . 1]" 1
668 1 37 ASN HA 1 40 LYS HD3 2.900 . 3.900 3.343 1.779 4.274 0.374 6 0 "[ . 1]" 1
669 1 37 ASN HB2 1 37 ASN HD21 3.100 . 4.300 2.768 2.233 3.540 . 0 0 "[ . 1]" 1
670 1 37 ASN HB2 1 38 ALA H 2.700 . 3.600 2.668 2.496 2.835 . 0 0 "[ . 1]" 1
671 1 37 ASN HB3 1 37 ASN HD21 3.500 . 5.000 3.090 2.366 3.495 . 0 0 "[ . 1]" 1
672 1 37 ASN HB3 1 38 ALA H 4.300 . 6.000 3.766 3.640 3.924 . 0 0 "[ . 1]" 1
673 1 37 ASN HD21 1 38 ALA H 4.600 . 6.000 4.483 3.808 5.265 . 0 0 "[ . 1]" 1
674 1 38 ALA H 1 38 ALA HA 2.600 . 3.500 2.808 2.792 2.822 . 0 0 "[ . 1]" 1
675 1 38 ALA H 1 38 ALA MB 2.100 . 2.600 2.233 2.219 2.238 . 0 0 "[ . 1]" 1
676 1 38 ALA H 1 40 LYS H 4.000 . 6.000 4.089 3.869 4.278 . 0 0 "[ . 1]" 1
677 1 38 ALA H 1 56 TRP HH2 5.000 . 6.000 5.425 4.779 6.003 0.003 7 0 "[ . 1]" 1
678 1 38 ALA HA 1 38 ALA MB 2.300 . 2.900 2.131 2.127 2.136 . 0 0 "[ . 1]" 1
679 1 38 ALA HA 1 39 LYS H 3.700 . 5.400 3.538 3.509 3.559 . 0 0 "[ . 1]" 1
680 1 38 ALA HA 1 39 LYS HB3 4.300 . 6.000 5.793 5.698 5.928 . 0 0 "[ . 1]" 1
681 1 38 ALA HA 1 41 GLU H 3.300 . 4.700 3.413 3.223 3.559 . 0 0 "[ . 1]" 1
682 1 38 ALA HA 1 41 GLU HB3 3.200 . 4.500 2.989 2.450 3.380 . 0 0 "[ . 1]" 1
683 1 38 ALA HA 1 41 GLU HG3 4.800 . 6.000 5.340 4.663 5.895 . 0 0 "[ . 1]" 1
684 1 38 ALA HA 1 72 PHE QE 3.200 . 4.500 2.722 2.221 3.333 . 0 0 "[ . 1]" 1
685 1 38 ALA MB 1 42 MET HG2 3.800 . 5.600 4.052 3.457 5.058 . 0 0 "[ . 1]" 1
686 1 38 ALA MB 1 56 TRP HE3 3.700 . 5.400 3.416 3.051 3.993 . 0 0 "[ . 1]" 1
687 1 38 ALA MB 1 56 TRP HH2 3.700 . 5.400 3.499 2.723 3.889 . 0 0 "[ . 1]" 1
688 1 38 ALA MB 1 56 TRP HZ3 2.200 . 2.800 2.080 1.794 2.558 . 0 0 "[ . 1]" 1
689 1 38 ALA MB 1 67 LEU MD1 2.700 . 3.600 2.016 1.856 2.111 . 0 0 "[ . 1]" 1
690 1 38 ALA MB 1 67 LEU MD2 3.900 . 6.000 4.064 3.928 4.254 . 0 0 "[ . 1]" 1
691 1 38 ALA MB 1 72 PHE HA 4.200 . 6.000 4.824 4.542 5.383 . 0 0 "[ . 1]" 1
692 1 38 ALA MB 1 72 PHE QD 3.500 . 6.000 3.143 2.926 3.802 . 0 0 "[ . 1]" 1
693 1 39 LYS H 1 39 LYS HA 2.500 . 3.300 2.788 2.759 2.816 . 0 0 "[ . 1]" 1
694 1 39 LYS H 1 39 LYS HB2 2.200 . 2.800 2.440 2.278 2.562 . 0 0 "[ . 1]" 1
695 1 39 LYS H 1 39 LYS HB3 2.400 . 3.100 2.586 2.514 2.678 . 0 0 "[ . 1]" 1
696 1 39 LYS H 1 39 LYS HD3 4.600 . 6.000 5.166 4.849 5.934 . 0 0 "[ . 1]" 1
697 1 39 LYS H 1 39 LYS HG2 3.600 . 5.200 4.496 4.458 4.552 . 0 0 "[ . 1]" 1
698 1 39 LYS H 1 39 LYS HG3 4.800 . 6.000 4.414 4.300 4.499 . 0 0 "[ . 1]" 1
699 1 39 LYS H 1 40 LYS H 2.500 . 3.300 2.737 2.669 2.846 . 0 0 "[ . 1]" 1
700 1 39 LYS H 1 41 GLU H 4.500 . 6.000 4.285 4.037 4.491 . 0 0 "[ . 1]" 1
701 1 39 LYS H 1 56 TRP HH2 5.400 . 6.000 5.799 4.847 6.033 0.033 1 0 "[ . 1]" 1
702 1 39 LYS H 2 8 PRO HB3 6.000 . 6.000 5.672 5.232 6.010 0.010 7 0 "[ . 1]" 1
703 1 39 LYS H 2 9 PHE QE 3.500 . 5.000 4.472 4.112 4.896 . 0 0 "[ . 1]" 1
704 1 39 LYS HA 1 39 LYS HB2 2.300 . 3.000 2.488 2.439 2.547 . 0 0 "[ . 1]" 1
705 1 39 LYS HA 1 39 LYS HB3 3.000 . 4.100 3.023 3.016 3.028 . 0 0 "[ . 1]" 1
706 1 39 LYS HA 1 39 LYS HD2 3.900 . 5.800 4.409 4.188 4.654 . 0 0 "[ . 1]" 1
707 1 39 LYS HA 1 39 LYS HD3 3.600 . 5.200 4.741 4.658 4.946 . 0 0 "[ . 1]" 1
708 1 39 LYS HA 1 39 LYS HG2 3.600 . 5.200 3.096 2.875 3.216 . 0 0 "[ . 1]" 1
709 1 39 LYS HA 1 39 LYS HG3 3.200 . 4.500 2.602 2.413 2.739 . 0 0 "[ . 1]" 1
710 1 39 LYS HA 1 40 LYS H 2.500 . 6.000 3.535 3.513 3.560 . 0 0 "[ . 1]" 1
711 1 39 LYS HA 1 42 MET HB2 2.400 . 3.100 2.623 2.382 2.940 . 0 0 "[ . 1]" 1
712 1 39 LYS HA 1 42 MET HB3 3.600 . 5.300 4.232 3.912 4.631 . 0 0 "[ . 1]" 1
713 1 39 LYS HA 1 43 VAL H 3.000 . 4.100 3.983 3.758 4.123 0.023 8 0 "[ . 1]" 1
714 1 39 LYS HA 1 52 LEU QD 4.200 . 6.000 4.007 3.486 4.360 . 0 0 "[ . 1]" 1
715 1 39 LYS HA 2 9 PHE QD 5.000 . 6.000 4.288 4.116 4.880 . 0 0 "[ . 1]" 1
716 1 39 LYS HA 2 9 PHE QE 3.100 . 4.300 2.136 1.853 2.721 0.047 7 0 "[ . 1]" 1
717 1 39 LYS HB2 1 40 LYS H 3.600 . 5.200 3.785 3.653 3.940 . 0 0 "[ . 1]" 1
718 1 39 LYS HB2 1 41 GLU H 5.300 . 6.000 5.871 5.581 6.099 0.099 4 0 "[ . 1]" 1
719 1 39 LYS HB2 1 42 MET H 5.200 . 6.000 5.788 5.657 5.920 . 0 0 "[ . 1]" 1
720 1 39 LYS HB2 1 43 VAL QG 2.700 . 6.000 4.785 4.209 5.645 . 0 0 "[ . 1]" 1
721 1 39 LYS HB2 2 9 PHE QD 5.300 . 6.000 4.615 4.040 4.954 . 0 0 "[ . 1]" 1
722 1 39 LYS HB2 2 9 PHE QE 4.500 . 6.000 3.430 2.844 3.766 . 0 0 "[ . 1]" 1
723 1 39 LYS HB3 1 39 LYS HG2 2.200 . 2.800 2.452 2.368 2.558 . 0 0 "[ . 1]" 1
724 1 39 LYS HB3 1 40 LYS H 3.200 . 4.500 2.511 2.356 2.671 . 0 0 "[ . 1]" 1
725 1 39 LYS HB3 2 9 PHE QE 5.900 . 6.000 4.290 3.983 4.513 . 0 0 "[ . 1]" 1
726 1 39 LYS HD2 1 39 LYS HE2 2.900 . 4.000 2.715 2.468 3.016 . 0 0 "[ . 1]" 1
727 1 39 LYS HD2 1 40 LYS H 4.400 . 6.000 5.248 4.365 5.684 . 0 0 "[ . 1]" 1
728 1 39 LYS HD2 2 9 PHE QE 3.700 . 6.000 4.439 3.555 5.258 . 0 0 "[ . 1]" 1
729 1 39 LYS HD3 1 39 LYS HE3 2.800 . 3.800 2.716 2.469 3.018 . 0 0 "[ . 1]" 1
730 1 39 LYS HD3 2 9 PHE QE 4.400 . 6.000 4.886 4.406 5.142 . 0 0 "[ . 1]" 1
731 1 39 LYS HE2 1 39 LYS HG2 3.300 . 4.700 3.268 2.535 3.742 . 0 0 "[ . 1]" 1
732 1 39 LYS HE2 1 39 LYS HG3 3.400 . 4.900 3.269 2.720 3.771 . 0 0 "[ . 1]" 1
733 1 39 LYS HE2 2 9 PHE QD 4.000 . 6.000 4.721 4.051 5.632 . 0 0 "[ . 1]" 1
734 1 39 LYS HE2 2 9 PHE QE 5.800 . 6.000 4.931 3.681 5.882 . 0 0 "[ . 1]" 1
735 1 39 LYS HE3 1 39 LYS HG2 3.500 . 5.000 3.085 2.493 4.241 . 0 0 "[ . 1]" 1
736 1 39 LYS HE3 1 39 LYS HG3 2.900 . 4.000 2.876 2.380 3.705 . 0 0 "[ . 1]" 1
737 1 39 LYS HE3 2 9 PHE QE 3.800 . 6.000 4.416 2.791 5.590 . 0 0 "[ . 1]" 1
738 1 39 LYS HG2 1 40 LYS H 3.500 . 5.100 3.829 3.532 4.018 . 0 0 "[ . 1]" 1
739 1 39 LYS HG3 1 40 LYS H 4.500 . 6.000 4.767 4.578 4.892 . 0 0 "[ . 1]" 1
740 1 39 LYS HG3 2 9 PHE QE 2.900 . 6.000 2.106 1.526 2.498 . 0 0 "[ . 1]" 1
741 1 40 LYS H 1 40 LYS HA 2.500 . 3.300 2.791 2.744 2.835 . 0 0 "[ . 1]" 1
742 1 40 LYS H 1 40 LYS HB3 3.000 . 4.100 3.343 2.442 3.615 . 0 0 "[ . 1]" 1
743 1 40 LYS H 1 40 LYS HD3 4.400 . 6.000 4.407 3.651 5.170 . 0 0 "[ . 1]" 1
744 1 40 LYS H 1 40 LYS HE3 2.900 . 6.000 5.324 3.724 6.821 0.821 2 1 "[ + . 1]" 1
745 1 40 LYS H 1 40 LYS HG2 3.400 . 4.900 3.736 3.274 4.521 . 0 0 "[ . 1]" 1
746 1 40 LYS H 1 40 LYS HG3 3.000 . 4.200 2.880 2.081 4.475 0.275 4 0 "[ . 1]" 1
747 1 40 LYS H 1 41 GLU H 2.800 . 3.800 2.784 2.562 2.923 . 0 0 "[ . 1]" 1
748 1 40 LYS H 1 42 MET H 3.800 . 5.600 4.244 4.149 4.428 . 0 0 "[ . 1]" 1
749 1 40 LYS H 1 43 VAL H 4.100 . 6.000 4.724 4.594 4.909 . 0 0 "[ . 1]" 1
750 1 40 LYS HA 1 40 LYS HB3 2.200 . 2.800 2.641 2.446 3.017 0.217 1 0 "[ . 1]" 1
751 1 40 LYS HA 1 40 LYS HD3 3.700 . 5.400 4.400 3.094 4.743 . 0 0 "[ . 1]" 1
752 1 40 LYS HA 1 40 LYS HG2 2.800 . 3.800 2.772 2.440 3.620 . 0 0 "[ . 1]" 1
753 1 40 LYS HA 1 40 LYS HG3 3.200 . 4.500 2.908 2.451 3.218 . 0 0 "[ . 1]" 1
754 1 40 LYS HA 1 41 GLU H 3.000 . 4.100 3.546 3.463 3.579 . 0 0 "[ . 1]" 1
755 1 40 LYS HB2 1 40 LYS HG2 3.000 . 4.100 2.951 2.464 3.013 . 0 0 "[ . 1]" 1
756 1 40 LYS HB2 1 41 GLU H 2.800 . 3.800 2.939 2.315 3.809 0.009 1 0 "[ . 1]" 1
757 1 40 LYS HB2 1 43 VAL QG 2.500 . 6.000 4.544 4.079 5.179 . 0 0 "[ . 1]" 1
758 1 40 LYS HB3 1 41 GLU H 2.900 . 4.000 3.267 2.301 3.846 . 0 0 "[ . 1]" 1
759 1 40 LYS HE3 1 40 LYS HG3 2.900 . 3.900 3.443 2.409 3.774 . 0 0 "[ . 1]" 1
760 1 41 GLU H 1 41 GLU HA 2.900 . 3.900 2.842 2.806 2.893 . 0 0 "[ . 1]" 1
761 1 41 GLU H 1 41 GLU HB3 2.400 . 3.100 2.481 2.197 2.675 . 0 0 "[ . 1]" 1
762 1 41 GLU H 1 41 GLU HG2 5.100 . 6.000 4.588 4.361 4.658 . 0 0 "[ . 1]" 1
763 1 41 GLU H 1 41 GLU HG3 4.200 . 6.000 4.427 4.182 4.573 . 0 0 "[ . 1]" 1
764 1 41 GLU H 1 42 MET H 2.600 . 3.400 2.627 2.472 2.758 . 0 0 "[ . 1]" 1
765 1 41 GLU H 1 42 MET HA 4.300 . 6.000 5.238 5.099 5.349 . 0 0 "[ . 1]" 1
766 1 41 GLU H 1 42 MET HG2 4.700 . 6.000 5.035 4.117 6.431 0.431 8 0 "[ . 1]" 1
767 1 41 GLU H 1 43 VAL H 4.400 . 6.000 4.029 3.591 4.365 . 0 0 "[ . 1]" 1
768 1 41 GLU H 1 43 VAL QG 4.700 . 6.000 4.302 3.929 5.029 . 0 0 "[ . 1]" 1
769 1 41 GLU HA 1 41 GLU HB3 2.800 . 3.800 3.021 2.990 3.028 . 0 0 "[ . 1]" 1
770 1 41 GLU HA 1 41 GLU HG2 4.200 . 6.000 3.737 3.122 3.998 . 0 0 "[ . 1]" 1
771 1 41 GLU HA 1 41 GLU HG3 2.900 . 4.000 3.094 2.611 3.349 . 0 0 "[ . 1]" 1
772 1 41 GLU HA 1 42 MET H 3.800 . 5.600 3.543 3.522 3.565 . 0 0 "[ . 1]" 1
773 1 41 GLU HA 1 43 VAL H 3.700 . 5.400 4.294 3.946 4.577 . 0 0 "[ . 1]" 1
774 1 41 GLU HA 1 44 LYS H 3.700 . 5.400 3.279 3.058 3.493 . 0 0 "[ . 1]" 1
775 1 41 GLU HA 1 44 LYS HB3 4.200 . 6.000 3.992 3.334 4.471 . 0 0 "[ . 1]" 1
776 1 41 GLU HA 1 44 LYS HD2 3.100 . 6.000 5.247 3.957 5.904 . 0 0 "[ . 1]" 1
777 1 41 GLU HA 1 44 LYS HE3 3.900 . 5.800 5.533 4.602 6.183 0.383 5 0 "[ . 1]" 1
778 1 41 GLU HA 1 44 LYS HG2 2.800 . 3.800 3.054 2.334 3.810 0.010 2 0 "[ . 1]" 1
779 1 41 GLU HB2 1 72 PHE HZ 3.300 . 4.700 3.603 3.129 4.420 . 0 0 "[ . 1]" 1
780 1 41 GLU HB3 1 43 VAL H 4.000 . 6.000 4.958 4.664 5.234 . 0 0 "[ . 1]" 1
781 1 41 GLU HG2 1 72 PHE QE 3.900 . 5.800 3.329 2.342 4.988 . 0 0 "[ . 1]" 1
782 1 41 GLU HG2 1 79 ILE HG13 4.400 . 6.000 5.821 4.299 6.103 0.103 5 0 "[ . 1]" 1
783 1 41 GLU HG3 1 79 ILE HG13 4.400 . 6.000 5.428 5.122 5.724 . 0 0 "[ . 1]" 1
784 1 42 MET H 1 42 MET HA 2.800 . 3.800 2.807 2.777 2.849 . 0 0 "[ . 1]" 1
785 1 42 MET H 1 42 MET HB2 2.400 . 6.000 2.439 2.212 2.557 . 0 0 "[ . 1]" 1
786 1 42 MET H 1 42 MET HB3 3.100 . 4.300 3.579 3.508 3.604 . 0 0 "[ . 1]" 1
787 1 42 MET H 1 42 MET HG2 2.600 . 3.500 2.774 2.045 4.153 0.653 8 1 "[ . + 1]" 1
788 1 42 MET H 1 43 VAL QG 4.600 . 6.000 4.007 3.590 4.618 . 0 0 "[ . 1]" 1
789 1 42 MET H 1 44 LYS H 4.400 . 6.000 3.946 3.750 4.080 . 0 0 "[ . 1]" 1
790 1 42 MET H 1 79 ILE MD 4.100 . 6.000 4.209 3.867 5.138 . 0 0 "[ . 1]" 1
791 1 42 MET H 2 9 PHE QE 4.200 . 6.000 4.630 4.378 5.172 . 0 0 "[ . 1]" 1
792 1 42 MET HA 1 42 MET HB3 2.600 . 3.500 2.517 2.465 2.664 . 0 0 "[ . 1]" 1
793 1 42 MET HA 1 42 MET ME 3.100 . 6.000 3.860 3.165 4.559 . 0 0 "[ . 1]" 1
794 1 42 MET HA 1 42 MET HG2 2.800 . 3.800 2.834 2.387 3.491 . 0 0 "[ . 1]" 1
795 1 42 MET HA 1 42 MET HG3 2.800 . 3.800 3.402 2.166 3.832 0.032 7 0 "[ . 1]" 1
796 1 42 MET HA 1 43 VAL H 2.700 . 3.600 3.520 3.467 3.579 . 0 0 "[ . 1]" 1
797 1 42 MET HA 1 45 SER H 3.200 . 4.500 3.390 3.082 3.675 . 0 0 "[ . 1]" 1
798 1 42 MET HA 1 75 ALA MB 3.900 . 6.000 5.922 5.636 6.082 0.082 2 0 "[ . 1]" 1
799 1 42 MET HA 1 79 ILE MD 2.500 . 6.000 2.817 2.546 3.172 . 0 0 "[ . 1]" 1
800 1 42 MET HA 1 79 ILE HG12 2.600 . 6.000 4.174 3.660 5.492 . 0 0 "[ . 1]" 1
801 1 42 MET HA 2 9 PHE QE 5.400 . 6.000 5.421 5.068 5.945 . 0 0 "[ . 1]" 1
802 1 42 MET HB2 1 43 VAL H 2.900 . 4.000 2.785 2.513 3.103 . 0 0 "[ . 1]" 1
803 1 42 MET HB2 1 52 LEU QD 3.500 . 4.900 2.595 2.254 2.886 . 0 0 "[ . 1]" 1
804 1 42 MET HB2 2 9 PHE QE 3.100 . 4.300 2.777 2.486 3.334 . 0 0 "[ . 1]" 1
805 1 42 MET HB3 1 43 VAL H 3.500 . 6.000 3.682 3.373 3.970 . 0 0 "[ . 1]" 1
806 1 42 MET HB3 1 52 LEU QD 3.000 . 4.100 1.621 1.461 2.034 0.439 10 0 "[ . 1]" 1
807 1 42 MET HB3 2 9 PHE QE 3.400 . 4.800 3.618 2.889 4.237 . 0 0 "[ . 1]" 1
808 1 42 MET ME 1 42 MET HG2 3.200 . 4.500 2.860 2.377 3.395 . 0 0 "[ . 1]" 1
809 1 42 MET ME 1 52 LEU HA 3.500 . 5.100 3.256 1.909 4.514 . 0 0 "[ . 1]" 1
810 1 42 MET ME 1 52 LEU QD 4.000 . 6.000 2.740 1.648 4.383 . 0 0 "[ . 1]" 1
811 1 42 MET ME 1 52 LEU HG 3.800 . 6.000 4.911 3.860 6.142 0.142 8 0 "[ . 1]" 1
812 1 42 MET ME 1 55 ILE H 4.100 . 6.000 4.542 3.506 5.465 . 0 0 "[ . 1]" 1
813 1 42 MET ME 1 55 ILE HB 2.700 . 3.600 2.606 1.794 3.359 0.006 1 0 "[ . 1]" 1
814 1 42 MET ME 1 55 ILE MD 2.700 . 6.000 3.372 1.943 4.490 . 0 0 "[ . 1]" 1
815 1 42 MET ME 1 55 ILE MG 2.000 . 6.000 2.120 1.905 2.518 . 0 0 "[ . 1]" 1
816 1 42 MET ME 1 56 TRP H 2.900 . 6.000 3.587 3.117 3.939 . 0 0 "[ . 1]" 1
817 1 42 MET ME 1 56 TRP HA 4.000 . 6.000 3.754 2.896 4.574 . 0 0 "[ . 1]" 1
818 1 42 MET ME 1 56 TRP HB2 3.700 . 5.400 3.608 3.119 3.961 . 0 0 "[ . 1]" 1
819 1 42 MET ME 1 56 TRP HB3 3.700 . 6.000 4.889 4.489 5.217 . 0 0 "[ . 1]" 1
820 1 42 MET ME 1 56 TRP HE3 3.500 . 5.000 3.504 2.680 4.382 . 0 0 "[ . 1]" 1
821 1 42 MET ME 1 56 TRP HZ3 3.800 . 6.000 4.922 3.870 6.046 0.046 4 0 "[ . 1]" 1
822 1 42 MET ME 1 57 LYS H 4.300 . 6.000 5.760 5.420 6.045 0.045 7 0 "[ . 1]" 1
823 1 42 MET ME 1 75 ALA MB 2.300 . 6.000 2.848 2.072 4.249 . 0 0 "[ . 1]" 1
824 1 42 MET ME 1 79 ILE MD 2.700 . 6.000 3.035 2.274 3.562 . 0 0 "[ . 1]" 1
825 1 42 MET ME 2 9 PHE QD 5.300 . 6.000 4.311 3.655 4.773 . 0 0 "[ . 1]" 1
826 1 42 MET ME 2 9 PHE QE 2.900 . 4.000 2.918 2.524 3.310 . 0 0 "[ . 1]" 1
827 1 42 MET HG2 1 43 VAL H 3.500 . 5.100 4.660 4.230 5.276 0.176 8 0 "[ . 1]" 1
828 1 42 MET HG2 1 52 LEU QD 4.800 . 6.000 3.574 2.135 4.105 . 0 0 "[ . 1]" 1
829 1 42 MET HG2 1 75 ALA MB 4.000 . 6.000 4.499 3.639 5.277 . 0 0 "[ . 1]" 1
830 1 42 MET HG2 1 79 ILE MD 3.200 . 6.000 3.186 2.026 4.298 . 0 0 "[ . 1]" 1
831 1 42 MET HG2 2 9 PHE QE 5.800 . 6.000 4.222 3.173 5.076 . 0 0 "[ . 1]" 1
832 1 42 MET HG3 1 43 VAL H 3.800 . 5.600 4.807 4.477 5.085 . 0 0 "[ . 1]" 1
833 1 42 MET HG3 1 52 LEU QD 4.100 . 6.000 3.377 2.174 4.222 . 0 0 "[ . 1]" 1
834 1 42 MET HG3 1 79 ILE MD 2.900 . 6.000 3.829 2.819 4.574 . 0 0 "[ . 1]" 1
835 1 42 MET HG3 2 9 PHE QE 3.700 . 5.400 3.464 2.665 4.428 . 0 0 "[ . 1]" 1
836 1 43 VAL H 1 43 VAL HA 2.700 . 3.600 2.861 2.823 2.893 . 0 0 "[ . 1]" 1
837 1 43 VAL H 1 43 VAL HB 2.600 . 6.000 2.977 2.095 3.674 . 0 0 "[ . 1]" 1
838 1 43 VAL H 1 43 VAL QG 2.400 . 6.000 2.215 1.904 2.880 . 0 0 "[ . 1]" 1
839 1 43 VAL H 1 44 LYS H 2.600 . 3.500 2.468 2.336 2.577 . 0 0 "[ . 1]" 1
840 1 43 VAL H 1 44 LYS HG2 4.900 . 6.000 4.516 4.051 5.391 . 0 0 "[ . 1]" 1
841 1 43 VAL H 1 45 SER H 4.600 . 6.000 3.923 3.711 4.016 . 0 0 "[ . 1]" 1
842 1 43 VAL H 1 52 LEU QD 3.000 . 5.200 3.514 3.210 3.744 . 0 0 "[ . 1]" 1
843 1 43 VAL H 1 79 ILE MD 2.900 . 6.000 5.618 5.344 6.043 0.043 7 0 "[ . 1]" 1
844 1 43 VAL HA 1 43 VAL HB 2.400 . 3.100 2.625 2.393 3.015 . 0 0 "[ . 1]" 1
845 1 43 VAL HA 1 43 VAL QG 2.600 . 6.000 2.221 2.106 2.327 . 0 0 "[ . 1]" 1
846 1 43 VAL HA 1 44 LYS H 3.100 . 4.300 3.471 3.422 3.514 . 0 0 "[ . 1]" 1
847 1 43 VAL HA 1 46 LYS H 3.500 . 5.000 3.444 2.961 3.806 . 0 0 "[ . 1]" 1
848 1 43 VAL HA 1 52 LEU QD 2.600 . 3.400 2.772 2.398 2.983 . 0 0 "[ . 1]" 1
849 1 43 VAL HB 1 43 VAL QG 2.100 . 2.700 1.889 1.880 1.892 . 0 0 "[ . 1]" 1
850 1 43 VAL HB 1 44 LYS H 3.600 . 5.200 3.730 2.817 4.188 . 0 0 "[ . 1]" 1
851 1 43 VAL HB 1 52 LEU QD 3.600 . 5.200 4.121 3.207 4.764 . 0 0 "[ . 1]" 1
852 1 43 VAL HB 2 9 PHE QE 3.200 . 6.000 5.484 4.177 6.100 0.100 8 0 "[ . 1]" 1
853 1 43 VAL QG 1 44 LYS H 3.000 . 4.100 2.692 2.284 3.271 . 0 0 "[ . 1]" 1
854 1 43 VAL QG 1 44 LYS HE2 4.300 . 6.000 4.992 3.835 6.128 0.128 6 0 "[ . 1]" 1
855 1 43 VAL QG 1 45 SER H 3.400 . 6.000 4.248 4.073 4.567 . 0 0 "[ . 1]" 1
856 1 43 VAL QG 1 52 LEU QD 2.200 . 6.000 2.659 2.170 3.351 . 0 0 "[ . 1]" 1
857 1 43 VAL QG 2 9 PHE QD 3.200 . 6.000 4.337 3.399 5.471 . 0 0 "[ . 1]" 1
858 1 43 VAL QG 2 9 PHE QE 2.500 . 6.000 3.412 2.361 4.756 . 0 0 "[ . 1]" 1
859 1 44 LYS H 1 44 LYS HA 2.600 . 3.500 2.861 2.820 2.887 . 0 0 "[ . 1]" 1
860 1 44 LYS H 1 44 LYS HB2 2.300 . 2.900 2.526 2.216 3.636 0.736 7 1 "[ . + 1]" 1
861 1 44 LYS H 1 44 LYS HD3 3.200 . 4.500 4.158 3.466 5.061 0.561 2 1 "[ + . 1]" 1
862 1 44 LYS H 1 44 LYS HE3 5.000 . 6.000 5.440 4.951 6.070 0.070 4 0 "[ . 1]" 1
863 1 44 LYS H 1 44 LYS HG2 2.800 . 3.700 2.648 2.210 3.570 . 0 0 "[ . 1]" 1
864 1 44 LYS H 1 44 LYS HG3 3.400 . 4.900 3.644 2.516 4.014 . 0 0 "[ . 1]" 1
865 1 44 LYS HA 1 44 LYS HD3 2.400 . 3.100 2.855 1.859 4.052 0.952 4 2 "[ +.- 1]" 1
866 1 44 LYS HA 1 44 LYS HG2 3.400 . 4.900 3.083 2.701 4.247 . 0 0 "[ . 1]" 1
867 1 44 LYS HA 1 44 LYS HG3 3.100 . 4.300 3.714 3.646 3.811 . 0 0 "[ . 1]" 1
868 1 44 LYS HA 1 46 LYS H 3.200 . 4.500 3.560 3.075 3.986 . 0 0 "[ . 1]" 1
869 1 44 LYS HB2 1 44 LYS HG2 2.100 . 2.700 2.482 2.348 2.701 0.001 4 0 "[ . 1]" 1
870 1 44 LYS HB2 1 45 SER H 3.100 . 4.300 3.111 2.872 4.323 0.023 7 0 "[ . 1]" 1
871 1 44 LYS HB3 1 44 LYS HG3 2.300 . 6.000 2.477 2.338 2.680 . 0 0 "[ . 1]" 1
872 1 44 LYS HE2 1 44 LYS HG2 3.400 . 4.900 3.272 2.462 3.752 . 0 0 "[ . 1]" 1
873 1 44 LYS HE3 1 44 LYS HG3 2.200 . 2.800 3.119 2.349 3.764 0.964 5 4 "[ *+ - *]" 1
874 1 44 LYS HG2 1 45 SER H 4.400 . 6.000 4.531 4.354 4.800 . 0 0 "[ . 1]" 1
875 1 44 LYS HG3 1 45 SER H 5.100 . 6.000 4.947 2.706 5.339 . 0 0 "[ . 1]" 1
876 1 45 SER H 1 45 SER HA 2.500 . 3.300 2.865 2.825 2.893 . 0 0 "[ . 1]" 1
877 1 45 SER H 1 45 SER HB2 2.800 . 3.700 3.017 2.425 3.608 . 0 0 "[ . 1]" 1
878 1 45 SER H 1 45 SER HB3 3.100 . 4.300 3.229 2.470 3.615 . 0 0 "[ . 1]" 1
879 1 45 SER H 1 46 LYS H 2.700 . 3.600 2.500 2.355 2.592 . 0 0 "[ . 1]" 1
880 1 45 SER H 1 79 ILE MG 4.100 . 6.000 4.491 4.078 4.931 . 0 0 "[ . 1]" 1
881 1 45 SER HA 1 45 SER HB3 2.400 . 3.100 2.408 2.257 2.513 . 0 0 "[ . 1]" 1
882 1 45 SER HA 1 46 LYS H 3.200 . 4.400 3.323 3.222 3.388 . 0 0 "[ . 1]" 1
883 1 45 SER HA 1 47 LEU HG 4.100 . 6.000 4.490 4.129 4.861 . 0 0 "[ . 1]" 1
884 1 45 SER HA 1 79 ILE MG 3.500 . 5.000 3.843 3.298 4.384 . 0 0 "[ . 1]" 1
885 1 45 SER HB2 1 47 LEU H 4.000 . 6.000 3.467 3.010 4.078 . 0 0 "[ . 1]" 1
886 1 45 SER HB2 1 52 LEU QD 2.900 . 6.000 3.975 3.014 4.650 . 0 0 "[ . 1]" 1
887 1 45 SER HB2 1 79 ILE MD 3.600 . 5.200 3.788 3.494 4.079 . 0 0 "[ . 1]" 1
888 1 45 SER HB2 1 79 ILE MG 2.800 . 3.800 2.736 2.111 3.678 . 0 0 "[ . 1]" 1
889 1 45 SER HB2 1 82 LYS QB 2.400 . 6.000 5.711 4.625 6.034 0.034 6 0 "[ . 1]" 1
890 1 45 SER HB3 1 47 LEU MD2 3.700 . 6.000 4.559 3.625 5.571 . 0 0 "[ . 1]" 1
891 1 45 SER HB3 1 47 LEU HG 3.700 . 5.400 3.461 2.674 4.463 . 0 0 "[ . 1]" 1
892 1 45 SER HB3 1 79 ILE MG 2.100 . 6.000 2.357 2.009 2.678 . 0 0 "[ . 1]" 1
893 1 46 LYS H 1 46 LYS HA 2.100 . 2.700 2.262 2.253 2.270 . 0 0 "[ . 1]" 1
894 1 46 LYS H 1 46 LYS HB2 4.000 . 6.000 3.624 3.462 3.989 . 0 0 "[ . 1]" 1
895 1 46 LYS H 1 46 LYS HB3 3.900 . 5.800 3.965 3.022 4.108 . 0 0 "[ . 1]" 1
896 1 46 LYS H 1 46 LYS HD2 4.500 . 6.000 4.899 3.399 5.509 . 0 0 "[ . 1]" 1
897 1 46 LYS H 1 46 LYS HD3 4.700 . 6.000 5.021 3.234 5.506 . 0 0 "[ . 1]" 1
898 1 46 LYS H 1 46 LYS HG3 3.300 . 4.600 3.341 2.661 4.486 . 0 0 "[ . 1]" 1
899 1 46 LYS H 1 47 LEU H 2.600 . 3.500 2.665 2.566 2.890 . 0 0 "[ . 1]" 1
900 1 46 LYS H 1 47 LEU MD2 5.000 . 6.000 5.243 5.121 5.376 . 0 0 "[ . 1]" 1
901 1 46 LYS H 1 47 LEU HG 4.100 . 6.000 4.417 4.182 4.645 . 0 0 "[ . 1]" 1
902 1 46 LYS H 1 52 LEU QD 4.800 . 6.000 4.324 3.911 4.698 . 0 0 "[ . 1]" 1
903 1 46 LYS HA 1 46 LYS HB2 2.900 . 3.900 2.966 2.484 3.027 . 0 0 "[ . 1]" 1
904 1 46 LYS HA 1 46 LYS HB3 2.400 . 3.100 2.462 2.393 2.548 . 0 0 "[ . 1]" 1
905 1 46 LYS HA 1 46 LYS HD3 3.800 . 5.600 4.321 2.127 5.509 . 0 0 "[ . 1]" 1
906 1 46 LYS HA 1 46 LYS HG2 3.000 . 4.100 2.797 2.518 3.681 . 0 0 "[ . 1]" 1
907 1 46 LYS HA 1 46 LYS HG3 3.000 . 4.100 3.253 2.829 3.903 . 0 0 "[ . 1]" 1
908 1 46 LYS HA 1 47 LEU H 2.700 . 3.600 2.950 2.741 3.081 . 0 0 "[ . 1]" 1
909 1 46 LYS HB2 1 46 LYS HD3 3.900 . 6.000 3.211 2.390 4.223 . 0 0 "[ . 1]" 1
910 1 46 LYS HB2 1 47 LEU H 4.400 . 6.000 4.099 3.893 4.471 . 0 0 "[ . 1]" 1
911 1 46 LYS HB3 1 46 LYS HG3 2.900 . 3.900 2.897 2.438 3.016 . 0 0 "[ . 1]" 1
912 1 46 LYS HB3 1 47 LEU H 4.500 . 6.000 4.462 4.375 4.641 . 0 0 "[ . 1]" 1
913 1 46 LYS HD2 1 46 LYS HE2 2.900 . 4.000 2.738 2.441 3.019 . 0 0 "[ . 1]" 1
914 1 46 LYS HD2 1 46 LYS HG2 2.500 . 6.000 2.714 2.419 3.018 . 0 0 "[ . 1]" 1
915 1 46 LYS HD3 1 46 LYS HG3 2.100 . 2.600 2.716 2.415 3.015 0.415 8 0 "[ . 1]" 1
916 1 46 LYS HG3 1 83 LEU QD 2.500 . 6.000 5.014 4.120 5.541 . 0 0 "[ . 1]" 1
917 1 47 LEU H 1 47 LEU HA 2.800 . 3.800 2.908 2.888 2.932 . 0 0 "[ . 1]" 1
918 1 47 LEU H 1 47 LEU HB2 2.700 . 3.600 2.454 2.439 2.478 . 0 0 "[ . 1]" 1
919 1 47 LEU H 1 47 LEU HB3 3.800 . 5.600 3.630 3.601 3.659 . 0 0 "[ . 1]" 1
920 1 47 LEU H 1 47 LEU MD1 3.500 . 6.000 3.804 3.719 3.935 . 0 0 "[ . 1]" 1
921 1 47 LEU H 1 47 LEU MD2 3.600 . 5.200 3.524 3.406 3.674 . 0 0 "[ . 1]" 1
922 1 47 LEU H 1 47 LEU HG 2.300 . 3.000 2.616 2.458 2.847 . 0 0 "[ . 1]" 1
923 1 47 LEU H 1 48 PRO HD3 5.100 . 6.000 4.725 4.619 4.816 . 0 0 "[ . 1]" 1
924 1 47 LEU H 1 52 LEU QD 3.400 . 4.800 2.970 2.662 3.189 . 0 0 "[ . 1]" 1
925 1 47 LEU HA 1 47 LEU HB3 2.800 . 3.800 2.485 2.473 2.497 . 0 0 "[ . 1]" 1
926 1 47 LEU HA 1 47 LEU MD1 3.900 . 5.800 3.852 3.841 3.873 . 0 0 "[ . 1]" 1
927 1 47 LEU HA 1 47 LEU MD2 2.100 . 6.000 1.995 1.959 2.049 . 0 0 "[ . 1]" 1
928 1 47 LEU HA 1 47 LEU HG 3.700 . 5.400 3.122 3.084 3.160 . 0 0 "[ . 1]" 1
929 1 47 LEU HA 1 48 PRO HD2 2.700 . 3.600 2.832 2.622 3.390 . 0 0 "[ . 1]" 1
930 1 47 LEU HA 1 48 PRO HD3 2.100 . 2.700 1.972 1.900 2.091 . 0 0 "[ . 1]" 1
931 1 47 LEU HB2 1 47 LEU MD2 3.000 . 4.200 3.199 3.191 3.207 . 0 0 "[ . 1]" 1
932 1 47 LEU HB2 1 48 PRO HD2 4.300 . 6.000 3.968 3.622 4.330 . 0 0 "[ . 1]" 1
933 1 47 LEU HB2 1 48 PRO HD3 5.000 . 6.000 4.377 3.797 4.612 . 0 0 "[ . 1]" 1
934 1 47 LEU HB2 1 51 VAL MG1 3.100 . 6.000 4.154 3.755 4.637 . 0 0 "[ . 1]" 1
935 1 47 LEU HB2 1 52 LEU QD 2.200 . 2.800 1.711 1.579 1.948 0.021 8 0 "[ . 1]" 1
936 1 47 LEU HB3 1 48 PRO HD2 2.300 . 3.000 2.435 2.093 2.854 . 0 0 "[ . 1]" 1
937 1 47 LEU HB3 1 48 PRO HD3 3.600 . 5.200 3.200 2.355 3.621 . 0 0 "[ . 1]" 1
938 1 47 LEU MD1 1 47 LEU HG 2.000 . 2.500 2.126 2.122 2.130 . 0 0 "[ . 1]" 1
939 1 47 LEU MD1 1 48 PRO HD3 3.700 . 6.000 4.742 4.065 5.036 . 0 0 "[ . 1]" 1
940 1 47 LEU MD1 1 82 LYS HA 3.900 . 6.000 5.254 4.843 5.721 . 0 0 "[ . 1]" 1
941 1 47 LEU MD1 1 82 LYS QB 2.800 . 6.000 2.772 2.272 3.148 . 0 0 "[ . 1]" 1
942 1 47 LEU MD1 1 82 LYS HE2 3.400 . 6.000 4.632 3.604 5.754 . 0 0 "[ . 1]" 1
943 1 47 LEU MD2 1 48 PRO HD2 2.900 . 4.000 3.078 2.959 3.379 . 0 0 "[ . 1]" 1
944 1 47 LEU MD2 1 48 PRO HD3 3.200 . 4.500 2.939 2.630 3.064 . 0 0 "[ . 1]" 1
945 1 47 LEU MD2 1 82 LYS HE2 3.600 . 5.200 4.321 2.878 5.641 0.441 9 0 "[ . 1]" 1
946 1 47 LEU MD2 1 82 LYS HG3 3.200 . 4.500 3.020 2.537 3.456 . 0 0 "[ . 1]" 1
947 1 47 LEU HG 1 79 ILE MG 3.700 . 5.400 3.872 3.161 4.344 . 0 0 "[ . 1]" 1
948 1 48 PRO HA 1 48 PRO HB3 2.600 . 3.400 2.286 2.247 2.301 . 0 0 "[ . 1]" 1
949 1 48 PRO HA 1 48 PRO HG2 4.100 . 6.000 3.961 3.922 4.091 . 0 0 "[ . 1]" 1
950 1 48 PRO HA 1 51 VAL HB 3.800 . 5.600 4.866 4.662 4.954 . 0 0 "[ . 1]" 1
951 1 48 PRO HA 1 51 VAL MG1 4.900 . 6.000 6.001 5.783 6.063 0.063 10 0 "[ . 1]" 1
952 1 48 PRO HB2 1 48 PRO HD2 3.600 . 5.200 3.019 2.907 3.396 . 0 0 "[ . 1]" 1
953 1 48 PRO HB2 1 48 PRO HD3 4.200 . 6.000 3.904 3.859 4.045 . 0 0 "[ . 1]" 1
954 1 48 PRO HB2 1 48 PRO HG2 2.400 . 3.100 2.315 2.248 2.338 . 0 0 "[ . 1]" 1
955 1 48 PRO HB2 1 51 VAL H 2.800 . 3.800 2.514 2.294 2.871 . 0 0 "[ . 1]" 1
956 1 48 PRO HB2 1 51 VAL MG2 3.100 . 4.300 2.237 1.833 3.148 0.067 9 0 "[ . 1]" 1
957 1 48 PRO HB3 1 48 PRO HD2 4.100 . 6.000 3.905 3.876 3.981 . 0 0 "[ . 1]" 1
958 1 48 PRO HB3 1 51 VAL H 4.300 . 6.000 4.070 3.796 4.587 . 0 0 "[ . 1]" 1
959 1 48 PRO HD2 1 48 PRO HG2 2.300 . 3.000 2.308 2.260 2.322 . 0 0 "[ . 1]" 1
960 1 48 PRO HD2 1 48 PRO HG3 3.000 . 4.100 2.985 2.938 2.994 . 0 0 "[ . 1]" 1
961 1 48 PRO HD2 1 51 VAL MG1 3.100 . 6.000 3.176 2.923 3.376 . 0 0 "[ . 1]" 1
962 1 48 PRO HD2 1 52 LEU HG 3.700 . 5.400 4.802 4.307 5.527 0.127 2 0 "[ . 1]" 1
963 1 48 PRO HD3 1 48 PRO HG2 3.000 . 4.100 2.701 2.681 2.767 . 0 0 "[ . 1]" 1
964 1 48 PRO HD3 1 48 PRO HG3 2.400 . 3.100 2.306 2.265 2.318 . 0 0 "[ . 1]" 1
965 1 48 PRO HD3 1 51 VAL H 6.000 . 6.000 5.617 5.163 5.941 . 0 0 "[ . 1]" 1
966 1 48 PRO HD3 1 51 VAL MG1 4.300 . 6.000 4.528 3.995 4.855 . 0 0 "[ . 1]" 1
967 1 48 PRO HD3 1 51 VAL MG2 3.700 . 5.400 3.815 3.371 4.205 . 0 0 "[ . 1]" 1
968 1 48 PRO HG2 1 51 VAL H 4.800 . 6.000 4.291 3.493 4.573 . 0 0 "[ . 1]" 1
969 1 48 PRO HG2 1 51 VAL MG2 2.800 . 3.800 2.443 1.916 2.883 . 0 0 "[ . 1]" 1
970 1 48 PRO HG3 1 51 VAL H 5.700 . 6.000 5.318 4.984 5.456 . 0 0 "[ . 1]" 1
971 1 48 PRO HG3 1 51 VAL MG2 4.200 . 6.000 3.819 3.409 4.263 . 0 0 "[ . 1]" 1
972 1 49 ASN HA 1 49 ASN HB3 2.700 . 3.600 2.467 2.366 2.590 . 0 0 "[ . 1]" 1
973 1 49 ASN HA 1 52 LEU H 3.200 . 4.500 3.358 3.174 3.580 . 0 0 "[ . 1]" 1
974 1 49 ASN HA 1 52 LEU HB2 3.200 . 4.400 2.570 2.395 2.918 . 0 0 "[ . 1]" 1
975 1 49 ASN HA 1 52 LEU HB3 3.800 . 5.600 4.055 3.842 4.487 . 0 0 "[ . 1]" 1
976 1 49 ASN HA 1 52 LEU QD 3.000 . 4.100 2.090 1.778 2.333 0.122 9 0 "[ . 1]" 1
977 1 49 ASN HA 1 52 LEU HG 2.800 . 6.000 2.985 2.354 4.655 . 0 0 "[ . 1]" 1
978 1 49 ASN HA 1 53 GLY H 4.000 . 6.000 4.187 4.028 4.508 . 0 0 "[ . 1]" 1
979 1 49 ASN HA 2 9 PHE QD 3.600 . 6.000 4.264 3.660 4.669 . 0 0 "[ . 1]" 1
980 1 49 ASN HA 2 9 PHE QE 5.500 . 6.000 5.431 4.929 6.009 0.009 1 0 "[ . 1]" 1
981 1 49 ASN HB2 1 49 ASN HD21 3.700 . 5.400 2.739 2.186 3.487 . 0 0 "[ . 1]" 1
982 1 49 ASN HB2 1 50 THR HA 4.300 . 6.000 4.380 4.213 4.930 . 0 0 "[ . 1]" 1
983 1 49 ASN HB2 1 50 THR HB 3.200 . 6.000 5.768 4.400 6.401 0.401 9 0 "[ . 1]" 1
984 1 49 ASN HB2 1 52 LEU HB2 4.100 . 6.000 4.826 3.942 5.562 . 0 0 "[ . 1]" 1
985 1 49 ASN HB2 1 52 LEU QD 3.200 . 6.000 4.274 3.261 4.945 . 0 0 "[ . 1]" 1
986 1 49 ASN HB3 1 49 ASN HD21 3.600 . 5.200 2.813 2.224 3.483 . 0 0 "[ . 1]" 1
987 1 49 ASN HB3 2 9 PHE QD 4.600 . 6.000 4.811 4.118 5.374 . 0 0 "[ . 1]" 1
988 1 50 THR HA 1 50 THR MG 2.700 . 3.600 2.394 2.228 3.217 . 0 0 "[ . 1]" 1
989 1 50 THR HA 1 51 VAL H 3.500 . 5.000 3.535 3.507 3.550 . 0 0 "[ . 1]" 1
990 1 50 THR HA 1 52 LEU H 4.100 . 6.000 4.413 4.284 4.536 . 0 0 "[ . 1]" 1
991 1 50 THR HA 1 53 GLY H 3.400 . 4.800 3.431 3.184 3.678 . 0 0 "[ . 1]" 1
992 1 50 THR HB 1 50 THR MG 2.300 . 3.000 2.138 2.132 2.144 . 0 0 "[ . 1]" 1
993 1 50 THR HB 1 51 VAL H 2.900 . 4.000 3.028 2.441 3.965 . 0 0 "[ . 1]" 1
994 1 50 THR HB 1 51 VAL HA 4.100 . 6.000 4.342 3.894 5.670 . 0 0 "[ . 1]" 1
995 1 50 THR HB 1 51 VAL MG2 3.900 . 5.800 3.554 2.931 4.687 . 0 0 "[ . 1]" 1
996 1 50 THR MG 1 51 VAL H 3.900 . 5.800 3.632 2.216 4.041 . 0 0 "[ . 1]" 1
997 1 50 THR MG 1 54 LYS HE3 3.600 . 6.000 4.947 3.194 6.826 0.826 4 1 "[ +. 1]" 1
998 1 51 VAL H 1 51 VAL HA 2.800 . 3.800 2.835 2.798 2.859 . 0 0 "[ . 1]" 1
999 1 51 VAL H 1 51 VAL HB 2.500 . 3.300 2.520 2.444 2.566 . 0 0 "[ . 1]" 1
1000 1 51 VAL H 1 51 VAL MG1 4.300 . 6.000 3.766 3.756 3.778 . 0 0 "[ . 1]" 1
1001 1 51 VAL H 1 51 VAL MG2 2.400 . 3.100 2.107 2.010 2.266 . 0 0 "[ . 1]" 1
1002 1 51 VAL H 1 52 LEU H 2.400 . 3.100 2.562 2.470 2.703 . 0 0 "[ . 1]" 1
1003 1 51 VAL H 1 52 LEU HG 4.700 . 6.000 4.353 3.988 6.046 0.046 2 0 "[ . 1]" 1
1004 1 51 VAL H 1 53 GLY H 3.800 . 5.600 3.996 3.782 4.239 . 0 0 "[ . 1]" 1
1005 1 51 VAL HA 1 51 VAL HB 2.800 . 3.800 3.028 3.023 3.035 . 0 0 "[ . 1]" 1
1006 1 51 VAL HA 1 51 VAL MG1 2.400 . 3.100 2.418 2.380 2.468 . 0 0 "[ . 1]" 1
1007 1 51 VAL HA 1 51 VAL MG2 2.400 . 3.100 2.379 2.311 2.412 . 0 0 "[ . 1]" 1
1008 1 51 VAL HA 1 52 LEU H 3.700 . 5.400 3.524 3.506 3.549 . 0 0 "[ . 1]" 1
1009 1 51 VAL HA 1 54 LYS H 3.200 . 4.500 3.204 3.085 3.353 . 0 0 "[ . 1]" 1
1010 1 51 VAL HA 1 54 LYS QD 3.700 . 5.400 4.257 2.879 4.646 . 0 0 "[ . 1]" 1
1011 1 51 VAL HA 1 54 LYS HE3 4.100 . 6.000 4.647 2.357 5.943 . 0 0 "[ . 1]" 1
1012 1 51 VAL HA 1 54 LYS HG3 3.700 . 5.400 3.193 2.367 5.330 . 0 0 "[ . 1]" 1
1013 1 51 VAL HB 1 51 VAL MG1 2.300 . 2.900 2.129 2.125 2.132 . 0 0 "[ . 1]" 1
1014 1 51 VAL HB 1 51 VAL MG2 2.100 . 2.600 2.130 2.128 2.132 . 0 0 "[ . 1]" 1
1015 1 51 VAL HB 1 52 LEU H 2.600 . 3.400 2.687 2.599 2.854 . 0 0 "[ . 1]" 1
1016 1 51 VAL MG1 1 52 LEU H 3.400 . 4.900 3.519 3.378 3.658 . 0 0 "[ . 1]" 1
1017 1 51 VAL MG1 1 54 LYS HE2 3.400 . 6.000 5.952 5.413 6.448 0.448 1 0 "[ . 1]" 1
1018 1 51 VAL MG1 1 55 ILE MD 2.500 . 6.000 2.757 2.340 3.154 . 0 0 "[ . 1]" 1
1019 1 51 VAL MG1 1 82 LYS QB 3.300 . 6.000 4.567 3.939 5.044 . 0 0 "[ . 1]" 1
1020 1 51 VAL MG1 1 82 LYS QD 2.900 . 6.000 4.114 3.109 5.166 . 0 0 "[ . 1]" 1
1021 1 51 VAL MG1 1 82 LYS HG2 2.600 . 6.000 4.118 2.783 5.055 . 0 0 "[ . 1]" 1
1022 1 51 VAL MG2 1 52 LEU H 3.900 . 5.800 3.828 3.770 3.964 . 0 0 "[ . 1]" 1
1023 1 51 VAL MG2 1 54 LYS HE3 3.000 . 6.000 5.180 3.555 6.314 0.314 3 0 "[ . 1]" 1
1024 1 52 LEU H 1 52 LEU HA 2.700 . 3.600 2.806 2.768 2.829 . 0 0 "[ . 1]" 1
1025 1 52 LEU H 1 52 LEU HB2 2.900 . 3.900 2.526 2.302 2.615 . 0 0 "[ . 1]" 1
1026 1 52 LEU H 1 52 LEU HB3 4.400 . 6.000 3.586 3.528 3.611 . 0 0 "[ . 1]" 1
1027 1 52 LEU H 1 52 LEU QD 4.000 . 4.600 2.832 1.910 3.086 0.090 2 0 "[ . 1]" 1
1028 1 52 LEU H 1 52 LEU HG 2.500 . 3.300 2.317 2.098 3.595 0.295 2 0 "[ . 1]" 1
1029 1 52 LEU H 1 53 GLY H 2.600 . 3.500 2.663 2.572 2.770 . 0 0 "[ . 1]" 1
1030 1 52 LEU H 1 53 GLY QA 5.400 . 6.000 4.540 4.466 4.621 . 0 0 "[ . 1]" 1
1031 1 52 LEU H 1 54 LYS H 4.200 . 6.000 4.097 3.966 4.210 . 0 0 "[ . 1]" 1
1032 1 52 LEU HA 1 52 LEU QD 2.100 . 6.000 2.088 1.947 2.624 . 0 0 "[ . 1]" 1
1033 1 52 LEU HA 1 52 LEU HG 3.600 . 5.200 3.112 2.450 3.279 . 0 0 "[ . 1]" 1
1034 1 52 LEU HA 1 53 GLY H 3.900 . 5.800 3.521 3.484 3.551 . 0 0 "[ . 1]" 1
1035 1 52 LEU HA 1 54 LYS H 3.700 . 5.400 4.353 4.249 4.454 . 0 0 "[ . 1]" 1
1036 1 52 LEU HA 1 55 ILE H 3.200 . 4.500 3.350 3.055 3.597 . 0 0 "[ . 1]" 1
1037 1 52 LEU HA 1 55 ILE HB 2.600 . 3.400 2.684 2.134 3.186 . 0 0 "[ . 1]" 1
1038 1 52 LEU HA 1 55 ILE MD 2.800 . 6.000 3.737 2.860 4.820 . 0 0 "[ . 1]" 1
1039 1 52 LEU HA 1 55 ILE HG13 3.100 . 4.300 3.324 2.605 3.861 . 0 0 "[ . 1]" 1
1040 1 52 LEU HA 1 55 ILE MG 3.700 . 5.500 4.061 3.522 4.499 . 0 0 "[ . 1]" 1
1041 1 52 LEU HA 1 56 TRP H 3.800 . 5.600 4.002 3.825 4.206 . 0 0 "[ . 1]" 1
1042 1 52 LEU HB2 1 53 GLY H 3.300 . 4.700 2.665 2.452 2.839 . 0 0 "[ . 1]" 1
1043 1 52 LEU HB2 2 9 PHE QE 4.100 . 6.000 4.211 3.782 4.705 . 0 0 "[ . 1]" 1
1044 1 52 LEU HB3 1 53 GLY H 4.400 . 6.000 3.714 3.549 3.864 . 0 0 "[ . 1]" 1
1045 1 52 LEU HB3 2 9 PHE QE 3.300 . 4.700 3.298 3.121 3.585 . 0 0 "[ . 1]" 1
1046 1 52 LEU QD 1 53 GLY H 4.400 . 6.000 4.048 3.812 4.165 . 0 0 "[ . 1]" 1
1047 1 52 LEU QD 1 79 ILE HA 4.200 . 6.000 5.450 4.736 5.893 . 0 0 "[ . 1]" 1
1048 1 52 LEU QD 2 9 PHE QD 4.100 . 6.000 3.113 2.457 3.440 . 0 0 "[ . 1]" 1
1049 1 52 LEU QD 2 9 PHE QE 2.600 . 5.600 2.751 2.614 3.084 . 0 0 "[ . 1]" 1
1050 1 52 LEU HG 2 9 PHE QE 5.600 . 6.000 5.292 4.678 5.687 . 0 0 "[ . 1]" 1
1051 1 53 GLY H 1 53 GLY QA 2.500 . 3.300 2.207 2.203 2.210 . 0 0 "[ . 1]" 1
1052 1 53 GLY H 1 54 LYS H 2.500 . 3.300 2.589 2.556 2.660 . 0 0 "[ . 1]" 1
1053 1 53 GLY H 1 54 LYS HB3 6.000 . 6.000 6.052 5.998 6.100 0.100 10 0 "[ . 1]" 1
1054 1 53 GLY H 2 9 PHE HB2 3.400 . 4.900 3.863 3.592 4.471 . 0 0 "[ . 1]" 1
1055 1 53 GLY H 2 9 PHE HB3 2.700 . 3.600 3.341 3.144 3.525 . 0 0 "[ . 1]" 1
1056 1 53 GLY H 2 9 PHE QD 3.500 . 5.000 4.228 3.980 4.609 . 0 0 "[ . 1]" 1
1057 1 53 GLY QA 1 54 LYS H 3.300 . 4.700 2.702 2.664 2.739 . 0 0 "[ . 1]" 1
1058 1 53 GLY QA 1 54 LYS HG2 5.000 . 6.000 4.572 3.983 6.271 0.271 5 0 "[ . 1]" 1
1059 1 53 GLY QA 1 55 ILE H 4.300 . 6.000 4.123 3.929 4.298 . 0 0 "[ . 1]" 1
1060 1 53 GLY QA 1 56 TRP H 4.800 . 4.800 3.322 3.059 3.487 . 0 0 "[ . 1]" 1
1061 1 53 GLY QA 1 56 TRP HB2 . . 4.300 3.407 2.652 3.863 . 0 0 "[ . 1]" 1
1062 1 53 GLY QA 1 56 TRP HB3 3.100 . 4.300 2.747 2.445 3.191 . 0 0 "[ . 1]" 1
1063 1 53 GLY QA 2 9 PHE HB2 3.000 . 4.100 2.254 1.915 2.502 0.085 2 0 "[ . 1]" 1
1064 1 53 GLY QA 2 9 PHE HB3 3.600 . 5.300 2.984 2.273 3.289 . 0 0 "[ . 1]" 1
1065 1 53 GLY QA 2 9 PHE QD 4.200 . 6.000 2.444 2.029 3.217 . 0 0 "[ . 1]" 1
1066 1 53 GLY QA 2 10 THR MG 4.300 . 6.000 3.553 2.260 5.023 . 0 0 "[ . 1]" 1
1067 1 54 LYS H 1 54 LYS HA 2.700 . 3.600 2.805 2.789 2.848 . 0 0 "[ . 1]" 1
1068 1 54 LYS H 1 54 LYS HB2 2.300 . 3.000 2.416 2.189 2.621 . 0 0 "[ . 1]" 1
1069 1 54 LYS H 1 54 LYS QD 3.000 . 6.000 3.348 2.226 4.019 . 0 0 "[ . 1]" 1
1070 1 54 LYS H 1 54 LYS HG3 4.300 . 6.000 3.593 3.413 4.016 . 0 0 "[ . 1]" 1
1071 1 54 LYS H 1 55 ILE H 2.500 . 3.300 2.715 2.469 2.850 . 0 0 "[ . 1]" 1
1072 1 54 LYS H 1 55 ILE MD 5.300 . 6.000 5.447 5.185 5.632 . 0 0 "[ . 1]" 1
1073 1 54 LYS H 1 55 ILE MG 5.300 . 6.000 5.925 5.698 6.027 0.027 6 0 "[ . 1]" 1
1074 1 54 LYS H 1 56 TRP H 3.400 . 4.800 4.162 3.908 4.319 . 0 0 "[ . 1]" 1
1075 1 54 LYS HA 1 54 LYS HB2 2.600 . 3.500 3.009 2.942 3.029 . 0 0 "[ . 1]" 1
1076 1 54 LYS HA 1 54 LYS HB3 2.300 . 3.000 2.534 2.423 2.725 . 0 0 "[ . 1]" 1
1077 1 54 LYS HA 1 54 LYS QD 2.600 . 3.500 2.285 1.941 2.879 . 0 0 "[ . 1]" 1
1078 1 54 LYS HA 1 54 LYS HG2 3.400 . 4.900 3.045 2.653 3.557 . 0 0 "[ . 1]" 1
1079 1 54 LYS HA 1 54 LYS HG3 3.200 . 4.500 3.467 2.231 3.839 . 0 0 "[ . 1]" 1
1080 1 54 LYS HA 1 55 ILE H 3.400 . 4.800 3.543 3.495 3.560 . 0 0 "[ . 1]" 1
1081 1 54 LYS HA 1 57 LYS H 3.400 . 4.900 3.629 3.178 3.853 . 0 0 "[ . 1]" 1
1082 1 54 LYS HA 1 58 LEU QD 4.100 . 6.000 4.400 3.218 5.537 . 0 0 "[ . 1]" 1
1083 1 54 LYS HB2 1 56 TRP H 3.000 . 6.000 5.006 4.737 5.477 . 0 0 "[ . 1]" 1
1084 1 54 LYS QD 1 54 LYS HE2 2.600 . 3.400 2.305 2.175 2.404 . 0 0 "[ . 1]" 1
1085 1 54 LYS QD 1 57 LYS H 2.800 . 6.000 5.476 5.293 5.730 . 0 0 "[ . 1]" 1
1086 1 54 LYS HE2 1 54 LYS HG2 3.200 . 4.500 3.031 2.479 3.669 . 0 0 "[ . 1]" 1
1087 1 54 LYS HG2 1 55 ILE H 4.900 . 6.000 4.437 3.951 5.361 . 0 0 "[ . 1]" 1
1088 1 55 ILE H 1 55 ILE HA 2.800 . 3.800 2.801 2.773 2.819 . 0 0 "[ . 1]" 1
1089 1 55 ILE H 1 55 ILE HB 2.200 . 2.800 2.517 2.421 2.581 . 0 0 "[ . 1]" 1
1090 1 55 ILE H 1 55 ILE MD 3.400 . 4.800 3.497 3.081 3.796 . 0 0 "[ . 1]" 1
1091 1 55 ILE H 1 55 ILE HG12 2.600 . 3.500 2.748 2.061 3.425 . 0 0 "[ . 1]" 1
1092 1 55 ILE H 1 55 ILE HG13 2.900 . 6.000 2.891 2.160 3.664 . 0 0 "[ . 1]" 1
1093 1 55 ILE H 1 55 ILE MG 3.600 . 5.200 3.767 3.754 3.783 . 0 0 "[ . 1]" 1
1094 1 55 ILE H 1 56 TRP H 2.800 . 3.800 2.760 2.681 2.847 . 0 0 "[ . 1]" 1
1095 1 55 ILE H 1 57 LYS H 4.600 . 6.000 4.271 4.106 4.413 . 0 0 "[ . 1]" 1
1096 1 55 ILE H 1 58 LEU QD 2.600 . 6.000 4.592 4.180 5.170 . 0 0 "[ . 1]" 1
1097 1 55 ILE H 1 88 LEU MD1 3.100 . 6.000 4.789 3.903 6.029 0.029 4 0 "[ . 1]" 1
1098 1 55 ILE H 1 88 LEU MD2 2.800 . 6.000 5.422 4.865 5.921 . 0 0 "[ . 1]" 1
1099 1 55 ILE HA 1 55 ILE HB 2.800 . 3.800 3.023 3.019 3.028 . 0 0 "[ . 1]" 1
1100 1 55 ILE HA 1 55 ILE MD 3.300 . 4.700 2.917 2.050 3.795 . 0 0 "[ . 1]" 1
1101 1 55 ILE HA 1 55 ILE HG12 3.700 . 5.400 2.695 2.363 3.115 . 0 0 "[ . 1]" 1
1102 1 55 ILE HA 1 55 ILE HG13 2.900 . 4.000 3.383 2.954 3.771 . 0 0 "[ . 1]" 1
1103 1 55 ILE HA 1 55 ILE MG 2.500 . 3.300 2.442 2.383 2.527 . 0 0 "[ . 1]" 1
1104 1 55 ILE HA 1 56 TRP H 3.900 . 6.000 3.568 3.545 3.588 . 0 0 "[ . 1]" 1
1105 1 55 ILE HA 1 58 LEU H 3.000 . 4.100 3.461 3.231 3.784 . 0 0 "[ . 1]" 1
1106 1 55 ILE HA 1 58 LEU HA 4.900 . 6.000 5.524 5.101 5.809 . 0 0 "[ . 1]" 1
1107 1 55 ILE HA 1 58 LEU HB2 3.200 . 4.400 3.200 2.578 4.478 0.078 9 0 "[ . 1]" 1
1108 1 55 ILE HA 1 58 LEU HB3 3.400 . 4.900 3.904 2.165 4.670 . 0 0 "[ . 1]" 1
1109 1 55 ILE HA 1 58 LEU QD 3.000 . 4.100 2.925 2.466 3.255 . 0 0 "[ . 1]" 1
1110 1 55 ILE HA 1 58 LEU HG 3.800 . 5.600 3.948 3.140 4.726 . 0 0 "[ . 1]" 1
1111 1 55 ILE HA 1 59 ALA H 3.800 . 5.600 3.990 3.722 4.129 . 0 0 "[ . 1]" 1
1112 1 55 ILE HA 1 59 ALA MB 4.100 . 6.000 4.182 3.846 4.407 . 0 0 "[ . 1]" 1
1113 1 55 ILE HA 1 78 LEU MD1 3.300 . 4.600 3.077 2.693 3.544 . 0 0 "[ . 1]" 1
1114 1 55 ILE HA 1 88 LEU MD2 2.700 . 6.000 4.781 3.951 5.553 . 0 0 "[ . 1]" 1
1115 1 55 ILE HB 1 55 ILE MD 2.800 . 3.800 2.868 2.452 3.240 . 0 0 "[ . 1]" 1
1116 1 55 ILE HB 1 55 ILE MG 2.200 . 2.800 2.129 2.125 2.133 . 0 0 "[ . 1]" 1
1117 1 55 ILE HB 1 56 TRP H 2.600 . 3.500 2.641 2.418 2.830 . 0 0 "[ . 1]" 1
1118 1 55 ILE HB 1 56 TRP HB2 3.900 . 5.800 4.455 4.164 4.726 . 0 0 "[ . 1]" 1
1119 1 55 ILE MD 1 55 ILE HG13 2.100 . 2.600 2.121 2.117 2.125 . 0 0 "[ . 1]" 1
1120 1 55 ILE MD 1 55 ILE MG 2.100 . 6.000 1.934 1.882 1.992 . 0 0 "[ . 1]" 1
1121 1 55 ILE MD 1 56 TRP H 5.000 . 6.000 4.754 4.635 4.892 . 0 0 "[ . 1]" 1
1122 1 55 ILE MD 1 78 LEU H 5.300 . 6.000 4.939 4.626 5.333 . 0 0 "[ . 1]" 1
1123 1 55 ILE MD 1 78 LEU HB3 2.900 . 3.900 2.509 1.962 2.966 . 0 0 "[ . 1]" 1
1124 1 55 ILE MD 1 79 ILE H 3.300 . 6.000 4.029 3.723 4.225 . 0 0 "[ . 1]" 1
1125 1 55 ILE MD 1 79 ILE HA 2.600 . 6.000 3.785 3.568 4.153 . 0 0 "[ . 1]" 1
1126 1 55 ILE MD 1 80 LYS H 4.700 . 6.000 6.030 5.856 6.110 0.110 10 0 "[ . 1]" 1
1127 1 55 ILE MD 1 82 LYS QB 2.400 . 6.000 3.954 3.382 4.544 . 0 0 "[ . 1]" 1
1128 1 55 ILE MD 1 82 LYS HE2 4.100 . 6.000 4.849 3.748 5.783 . 0 0 "[ . 1]" 1
1129 1 55 ILE MD 1 82 LYS HG2 3.200 . 6.000 3.956 3.327 4.707 . 0 0 "[ . 1]" 1
1130 1 55 ILE MD 1 90 ALA HA 4.700 . 6.000 5.813 5.438 6.096 0.096 10 0 "[ . 1]" 1
1131 1 55 ILE HG13 1 56 TRP H 4.400 . 6.000 4.609 4.337 4.879 . 0 0 "[ . 1]" 1
1132 1 55 ILE HG13 1 88 LEU MD2 2.600 . 6.000 4.209 3.170 5.341 . 0 0 "[ . 1]" 1
1133 1 55 ILE MG 1 56 TRP H 3.300 . 4.700 3.362 2.999 3.511 . 0 0 "[ . 1]" 1
1134 1 55 ILE MG 1 56 TRP HA 3.700 . 5.400 3.387 3.114 3.546 . 0 0 "[ . 1]" 1
1135 1 55 ILE MG 1 75 ALA HA 2.400 . 6.000 2.763 2.269 3.393 . 0 0 "[ . 1]" 1
1136 1 55 ILE MG 1 75 ALA MB 2.500 . 6.000 2.762 2.427 3.153 . 0 0 "[ . 1]" 1
1137 1 55 ILE MG 1 78 LEU H 4.100 . 6.000 4.529 4.124 5.176 . 0 0 "[ . 1]" 1
1138 1 56 TRP H 1 56 TRP HA 2.700 . 3.600 2.801 2.776 2.817 . 0 0 "[ . 1]" 1
1139 1 56 TRP H 1 56 TRP HB2 2.500 . 3.300 2.533 2.475 2.593 . 0 0 "[ . 1]" 1
1140 1 56 TRP H 1 56 TRP HB3 2.500 . 3.300 2.568 2.532 2.655 . 0 0 "[ . 1]" 1
1141 1 56 TRP H 1 57 LYS H 2.700 . 3.600 2.751 2.682 2.868 . 0 0 "[ . 1]" 1
1142 1 56 TRP H 1 58 LEU H 4.500 . 6.000 4.036 3.889 4.237 . 0 0 "[ . 1]" 1
1143 1 56 TRP H 1 58 LEU QD 2.600 . 6.000 5.390 4.865 5.806 . 0 0 "[ . 1]" 1
1144 1 56 TRP H 1 59 ALA H 4.400 . 6.000 4.659 4.569 4.778 . 0 0 "[ . 1]" 1
1145 1 56 TRP H 1 59 ALA MB 5.200 . 6.000 4.640 4.515 4.842 . 0 0 "[ . 1]" 1
1146 1 56 TRP H 2 9 PHE QD 2.700 . 3.600 3.699 3.648 3.759 0.159 5 0 "[ . 1]" 1
1147 1 56 TRP HA 1 56 TRP HB2 2.300 . 3.000 2.465 2.446 2.500 . 0 0 "[ . 1]" 1
1148 1 56 TRP HA 1 56 TRP HB3 2.700 . 3.600 3.028 3.023 3.034 . 0 0 "[ . 1]" 1
1149 1 56 TRP HA 1 56 TRP HD1 4.400 . 6.000 4.196 4.086 4.315 . 0 0 "[ . 1]" 1
1150 1 56 TRP HA 1 56 TRP HE1 3.700 . 6.000 5.485 5.424 5.565 . 0 0 "[ . 1]" 1
1151 1 56 TRP HA 1 56 TRP HE3 2.900 . 3.900 3.154 2.800 3.339 . 0 0 "[ . 1]" 1
1152 1 56 TRP HA 1 57 LYS H 3.300 . 4.700 3.547 3.531 3.572 . 0 0 "[ . 1]" 1
1153 1 56 TRP HA 1 57 LYS HB3 3.900 . 5.800 5.880 5.655 6.112 0.312 2 0 "[ . 1]" 1
1154 1 56 TRP HA 1 59 ALA H 3.300 . 4.700 3.412 3.243 3.706 . 0 0 "[ . 1]" 1
1155 1 56 TRP HA 1 59 ALA MB 2.800 . 3.800 2.799 2.522 3.253 . 0 0 "[ . 1]" 1
1156 1 56 TRP HA 1 67 LEU MD2 3.000 . 6.000 3.831 3.339 4.133 . 0 0 "[ . 1]" 1
1157 1 56 TRP HA 2 9 PHE QE 5.700 . 6.000 3.795 3.433 4.127 . 0 0 "[ . 1]" 1
1158 1 56 TRP HB2 1 56 TRP HD1 3.300 . 4.700 3.818 3.764 3.848 . 0 0 "[ . 1]" 1
1159 1 56 TRP HB2 1 57 LYS H 3.600 . 5.200 3.814 3.722 3.890 . 0 0 "[ . 1]" 1
1160 1 56 TRP HB2 2 9 PHE QE 2.600 . 3.400 2.091 1.757 2.451 0.043 9 0 "[ . 1]" 1
1161 1 56 TRP HB3 1 56 TRP HD1 3.100 . 4.300 2.675 2.605 2.725 . 0 0 "[ . 1]" 1
1162 1 56 TRP HB3 1 56 TRP HE3 3.900 . 5.800 4.109 4.058 4.166 . 0 0 "[ . 1]" 1
1163 1 56 TRP HB3 1 57 LYS H 2.700 . 3.600 2.483 2.341 2.569 . 0 0 "[ . 1]" 1
1164 1 56 TRP HB3 1 57 LYS HB3 5.000 . 6.000 4.863 4.624 5.093 . 0 0 "[ . 1]" 1
1165 1 56 TRP HB3 2 9 PHE QD 3.100 . 4.300 2.600 2.378 3.020 . 0 0 "[ . 1]" 1
1166 1 56 TRP HB3 2 9 PHE QE 3.800 . 5.600 3.744 3.264 4.125 . 0 0 "[ . 1]" 1
1167 1 56 TRP HD1 1 57 LYS H 3.000 . 4.200 3.571 3.441 3.647 . 0 0 "[ . 1]" 1
1168 1 56 TRP HD1 1 57 LYS HA 2.500 . 3.300 3.104 2.929 3.311 0.011 5 0 "[ . 1]" 1
1169 1 56 TRP HD1 1 57 LYS HB3 4.600 . 6.000 5.177 4.845 5.373 . 0 0 "[ . 1]" 1
1170 1 56 TRP HD1 1 60 ASP HB3 3.700 . 5.400 3.865 3.493 4.480 . 0 0 "[ . 1]" 1
1171 1 56 TRP HE1 1 57 LYS H 5.700 . 6.000 6.014 5.889 6.111 0.111 1 0 "[ . 1]" 1
1172 1 56 TRP HE1 1 60 ASP HB2 4.100 . 6.000 3.945 3.502 4.605 . 0 0 "[ . 1]" 1
1173 1 56 TRP HE1 1 60 ASP HB3 3.800 . 5.600 3.594 3.214 4.200 . 0 0 "[ . 1]" 1
1174 1 56 TRP HE1 1 65 GLY HA3 5.100 . 6.000 4.930 4.299 5.284 . 0 0 "[ . 1]" 1
1175 1 56 TRP HE1 1 66 LEU H 5.300 . 6.000 5.455 4.582 6.073 0.073 1 0 "[ . 1]" 1
1176 1 56 TRP HE1 2 6 THR HA 4.800 . 6.000 5.546 5.143 6.022 0.022 6 0 "[ . 1]" 1
1177 1 56 TRP HE1 2 7 GLY HA2 4.100 . 6.000 3.012 2.551 3.377 . 0 0 "[ . 1]" 1
1178 1 56 TRP HE1 2 8 PRO HD2 4.800 . 6.000 3.830 3.332 4.200 . 0 0 "[ . 1]" 1
1179 1 56 TRP HE1 2 8 PRO HD3 5.900 . 6.000 3.806 3.361 4.417 . 0 0 "[ . 1]" 1
1180 1 56 TRP HE3 1 60 ASP HB3 4.500 . 6.000 6.049 5.507 6.474 0.474 2 0 "[ . 1]" 1
1181 1 56 TRP HE3 1 67 LEU MD1 3.200 . 4.500 2.987 2.637 3.227 . 0 0 "[ . 1]" 1
1182 1 56 TRP HE3 1 67 LEU MD2 3.200 . 6.000 3.777 3.540 4.157 . 0 0 "[ . 1]" 1
1183 1 56 TRP HH2 1 66 LEU HA 3.500 . 5.000 2.951 2.298 3.426 . 0 0 "[ . 1]" 1
1184 1 56 TRP HH2 1 66 LEU MD2 4.000 . 6.000 4.655 3.636 5.991 . 0 0 "[ . 1]" 1
1185 1 56 TRP HH2 1 67 LEU H 3.900 . 5.800 3.817 3.520 4.213 . 0 0 "[ . 1]" 1
1186 1 56 TRP HH2 1 67 LEU HG 2.900 . 3.900 2.713 2.428 3.062 . 0 0 "[ . 1]" 1
1187 1 56 TRP HZ2 1 65 GLY H 4.300 . 6.000 3.484 2.723 3.995 . 0 0 "[ . 1]" 1
1188 1 56 TRP HZ2 1 65 GLY HA2 4.300 . 6.000 2.085 1.981 2.339 0.019 6 0 "[ . 1]" 1
1189 1 56 TRP HZ2 1 65 GLY HA3 2.600 . 6.000 3.569 3.399 3.681 . 0 0 "[ . 1]" 1
1190 1 56 TRP HZ2 1 66 LEU H 4.400 . 6.000 3.590 2.898 4.056 . 0 0 "[ . 1]" 1
1191 1 56 TRP HZ2 1 67 LEU MD1 3.900 . 5.800 5.167 4.815 5.275 . 0 0 "[ . 1]" 1
1192 1 56 TRP HZ2 1 67 LEU MD2 3.200 . 6.000 4.127 3.817 4.467 . 0 0 "[ . 1]" 1
1193 1 56 TRP HZ3 1 67 LEU HB2 4.100 . 6.000 4.508 4.157 4.813 . 0 0 "[ . 1]" 1
1194 1 56 TRP HZ3 1 67 LEU HB3 4.900 . 6.000 5.355 5.155 5.484 . 0 0 "[ . 1]" 1
1195 1 56 TRP HZ3 1 67 LEU MD1 2.800 . 3.800 2.473 2.160 2.644 . 0 0 "[ . 1]" 1
1196 1 56 TRP HZ3 1 67 LEU MD2 4.200 . 6.000 3.633 3.261 3.946 . 0 0 "[ . 1]" 1
1197 1 56 TRP HZ3 1 67 LEU HG 3.200 . 4.500 2.738 2.499 2.966 . 0 0 "[ . 1]" 1
1198 1 57 LYS H 1 57 LYS HA 2.500 . 3.300 2.812 2.761 2.865 . 0 0 "[ . 1]" 1
1199 1 57 LYS H 1 57 LYS HB2 2.400 . 3.100 2.496 2.337 2.637 . 0 0 "[ . 1]" 1
1200 1 57 LYS H 1 57 LYS HB3 2.300 . 3.000 2.553 2.368 2.754 . 0 0 "[ . 1]" 1
1201 1 57 LYS H 1 57 LYS HD2 2.500 . 6.000 5.203 4.552 5.979 . 0 0 "[ . 1]" 1
1202 1 57 LYS H 1 57 LYS HE3 3.000 . 6.000 5.260 4.137 6.128 0.128 1 0 "[ . 1]" 1
1203 1 57 LYS H 1 57 LYS HG2 4.600 . 6.000 4.491 4.361 4.621 . 0 0 "[ . 1]" 1
1204 1 57 LYS H 1 57 LYS HG3 4.600 . 6.000 4.430 4.309 4.512 . 0 0 "[ . 1]" 1
1205 1 57 LYS H 1 58 LEU QD 5.100 . 6.000 4.849 3.719 5.575 . 0 0 "[ . 1]" 1
1206 1 57 LYS H 1 59 ALA H 4.100 . 6.000 4.164 4.006 4.414 . 0 0 "[ . 1]" 1
1207 1 57 LYS H 1 59 ALA MB 5.300 . 6.000 5.081 4.960 5.321 . 0 0 "[ . 1]" 1
1208 1 57 LYS H 2 9 PHE QD 2.400 . 6.000 4.877 4.694 5.154 . 0 0 "[ . 1]" 1
1209 1 57 LYS HA 1 57 LYS HD3 3.700 . 5.400 4.349 2.072 5.020 . 0 0 "[ . 1]" 1
1210 1 57 LYS HA 1 57 LYS HG2 3.800 . 5.600 3.244 2.788 3.806 . 0 0 "[ . 1]" 1
1211 1 57 LYS HA 1 57 LYS HG3 2.900 . 4.000 2.665 2.290 3.103 . 0 0 "[ . 1]" 1
1212 1 57 LYS HA 1 60 ASP H 3.500 . 5.000 4.091 3.633 4.614 . 0 0 "[ . 1]" 1
1213 1 57 LYS HA 1 60 ASP HB3 3.800 . 6.000 3.835 3.263 4.741 . 0 0 "[ . 1]" 1
1214 1 57 LYS HE2 1 57 LYS HG2 3.700 . 5.400 3.569 2.966 3.790 . 0 0 "[ . 1]" 1
1215 1 57 LYS HE2 1 57 LYS HG3 3.500 . 5.000 3.191 2.418 4.250 . 0 0 "[ . 1]" 1
1216 1 57 LYS HG3 1 58 LEU HA 3.900 . 5.800 5.019 3.909 5.880 0.080 7 0 "[ . 1]" 1
1217 1 58 LEU H 1 58 LEU HA 2.700 . 3.600 2.900 2.852 2.918 . 0 0 "[ . 1]" 1
1218 1 58 LEU H 1 58 LEU HB2 2.400 . 3.100 2.590 2.254 2.953 . 0 0 "[ . 1]" 1
1219 1 58 LEU H 1 58 LEU HB3 3.200 . 4.400 3.188 2.145 3.663 . 0 0 "[ . 1]" 1
1220 1 58 LEU H 1 58 LEU QD 3.200 . 4.500 3.270 2.188 3.742 . 0 0 "[ . 1]" 1
1221 1 58 LEU H 1 58 LEU HG 2.700 . 3.600 3.158 2.470 4.095 0.495 5 0 "[ . 1]" 1
1222 1 58 LEU H 1 59 ALA H 2.100 . 2.700 2.322 2.235 2.525 . 0 0 "[ . 1]" 1
1223 1 58 LEU H 1 78 LEU MD1 2.800 . 6.000 4.740 4.176 5.233 . 0 0 "[ . 1]" 1
1224 1 58 LEU HA 1 58 LEU HB3 2.700 . 3.600 2.640 2.435 2.998 . 0 0 "[ . 1]" 1
1225 1 58 LEU HA 1 58 LEU QD . . 3.100 2.091 1.903 2.380 0.097 6 0 "[ . 1]" 1
1226 1 58 LEU HA 1 58 LEU HG 3.200 . 4.500 3.233 2.978 3.699 . 0 0 "[ . 1]" 1
1227 1 58 LEU HA 1 59 ALA H 3.400 . 4.800 3.511 3.469 3.563 . 0 0 "[ . 1]" 1
1228 1 58 LEU HB2 1 58 LEU QD 2.700 . 3.600 2.229 2.105 2.328 . 0 0 "[ . 1]" 1
1229 1 58 LEU HB2 1 59 ALA H 3.000 . 4.100 3.205 2.400 4.151 0.051 5 0 "[ . 1]" 1
1230 1 58 LEU HB2 1 92 LEU MD2 2.500 . 6.000 4.765 3.366 6.052 0.052 4 0 "[ . 1]" 1
1231 1 58 LEU HB3 1 58 LEU QD 3.000 . 4.000 2.167 2.113 2.317 . 0 0 "[ . 1]" 1
1232 1 58 LEU HB3 1 59 ALA H 4.000 . 6.000 3.484 2.629 3.890 . 0 0 "[ . 1]" 1
1233 1 58 LEU MD1 1 58 LEU MD2 2.500 . 6.000 2.087 2.064 2.098 . 0 0 "[ . 1]" 1
1234 1 58 LEU QD 1 58 LEU HG 2.100 . 2.700 1.895 1.888 1.898 . 0 0 "[ . 1]" 1
1235 1 58 LEU QD 1 59 ALA H 3.100 . 6.000 3.997 3.557 4.211 . 0 0 "[ . 1]" 1
1236 1 58 LEU QD 1 90 ALA H 5.000 . 6.000 3.371 2.613 4.675 . 0 0 "[ . 1]" 1
1237 1 58 LEU QD 1 91 ASP H 3.800 . 5.600 3.245 2.738 3.660 . 0 0 "[ . 1]" 1
1238 1 58 LEU QD 1 91 ASP HA 2.800 . 3.800 2.916 2.167 3.765 . 0 0 "[ . 1]" 1
1239 1 58 LEU QD 1 92 LEU H 3.200 . 4.500 3.589 2.899 4.313 . 0 0 "[ . 1]" 1
1240 1 58 LEU QD 1 92 LEU HB2 3.200 . 6.000 3.388 2.004 4.969 . 0 0 "[ . 1]" 1
1241 1 58 LEU HG 1 59 ALA H 3.900 . 5.800 4.178 3.129 5.410 . 0 0 "[ . 1]" 1
1242 1 59 ALA H 1 59 ALA HA 2.800 . 3.800 2.879 2.815 2.919 . 0 0 "[ . 1]" 1
1243 1 59 ALA H 1 59 ALA MB 2.300 . 3.000 2.268 2.231 2.298 . 0 0 "[ . 1]" 1
1244 1 59 ALA H 1 60 ASP H 2.500 . 3.300 2.474 2.307 2.655 . 0 0 "[ . 1]" 1
1245 1 59 ALA H 1 78 LEU MD1 3.000 . 6.000 3.988 3.424 4.630 . 0 0 "[ . 1]" 1
1246 1 59 ALA H 1 92 LEU MD1 3.000 . 6.000 5.029 4.685 5.457 . 0 0 "[ . 1]" 1
1247 1 59 ALA HA 1 59 ALA MB 2.200 . 2.800 2.125 2.122 2.128 . 0 0 "[ . 1]" 1
1248 1 59 ALA HA 1 60 ASP H 3.700 . 5.400 3.548 3.530 3.558 . 0 0 "[ . 1]" 1
1249 1 59 ALA HA 1 61 VAL MG2 2.900 . 6.000 3.635 3.274 4.339 . 0 0 "[ . 1]" 1
1250 1 59 ALA HA 1 74 LEU MD1 2.700 . 6.000 3.282 1.539 4.722 . 0 0 "[ . 1]" 1
1251 1 59 ALA HA 1 78 LEU MD1 3.700 . 5.400 3.792 2.772 4.488 . 0 0 "[ . 1]" 1
1252 1 59 ALA HA 1 92 LEU MD1 3.200 . 6.000 4.205 3.458 4.693 . 0 0 "[ . 1]" 1
1253 1 59 ALA MB 1 60 ASP H 2.700 . 6.000 2.551 2.508 2.648 . 0 0 "[ . 1]" 1
1254 1 59 ALA MB 1 67 LEU MD2 3.400 . 4.900 2.824 2.390 3.512 . 0 0 "[ . 1]" 1
1255 1 59 ALA MB 1 74 LEU H 4.700 . 6.000 4.664 4.298 4.989 . 0 0 "[ . 1]" 1
1256 1 59 ALA MB 1 74 LEU HB2 4.400 . 6.000 4.409 4.116 4.686 . 0 0 "[ . 1]" 1
1257 1 59 ALA MB 1 74 LEU HB3 3.500 . 5.100 2.934 2.684 3.142 . 0 0 "[ . 1]" 1
1258 1 59 ALA MB 1 75 ALA H 3.100 . 4.300 2.927 2.688 3.177 . 0 0 "[ . 1]" 1
1259 1 59 ALA MB 1 75 ALA HA 2.900 . 4.000 2.658 2.345 2.965 . 0 0 "[ . 1]" 1
1260 1 59 ALA MB 1 76 ASN H 5.000 . 6.000 4.921 4.671 5.235 . 0 0 "[ . 1]" 1
1261 1 59 ALA MB 1 78 LEU MD1 2.800 . 6.000 2.771 1.919 3.420 . 0 0 "[ . 1]" 1
1262 1 59 ALA MB 1 78 LEU HG 3.900 . 6.000 4.442 3.812 4.913 . 0 0 "[ . 1]" 1
1263 1 60 ASP H 1 60 ASP HA 2.800 . 3.800 2.898 2.883 2.938 . 0 0 "[ . 1]" 1
1264 1 60 ASP H 1 60 ASP HB2 2.600 . 3.400 2.634 2.558 2.783 . 0 0 "[ . 1]" 1
1265 1 60 ASP H 1 60 ASP HB3 2.500 . 3.300 2.623 2.402 2.941 . 0 0 "[ . 1]" 1
1266 1 60 ASP H 1 61 VAL H 3.700 . 5.400 4.069 3.817 4.236 . 0 0 "[ . 1]" 1
1267 1 60 ASP H 1 67 LEU MD1 4.500 . 6.000 5.144 4.609 5.766 . 0 0 "[ . 1]" 1
1268 1 60 ASP H 1 67 LEU MD2 3.400 . 4.900 3.504 3.172 4.047 . 0 0 "[ . 1]" 1
1269 1 60 ASP HA 1 60 ASP HB2 2.800 . 3.800 2.524 2.416 2.673 . 0 0 "[ . 1]" 1
1270 1 60 ASP HA 1 60 ASP HB3 3.000 . 4.100 3.023 2.977 3.033 . 0 0 "[ . 1]" 1
1271 1 60 ASP HA 1 61 VAL H 2.200 . 2.800 2.186 2.118 2.293 . 0 0 "[ . 1]" 1
1272 1 60 ASP HA 1 61 VAL MG2 4.500 . 6.000 3.678 3.584 3.824 . 0 0 "[ . 1]" 1
1273 1 60 ASP HA 1 67 LEU MD2 2.800 . 3.800 2.912 2.504 3.699 . 0 0 "[ . 1]" 1
1274 1 60 ASP HB2 1 61 VAL H 4.000 . 6.000 4.534 4.429 4.598 . 0 0 "[ . 1]" 1
1275 1 60 ASP HB2 1 63 LYS HA 4.300 . 6.000 4.502 4.069 4.944 . 0 0 "[ . 1]" 1
1276 1 60 ASP HB2 1 67 LEU MD2 3.300 . 4.700 2.280 1.944 2.617 . 0 0 "[ . 1]" 1
1277 1 60 ASP HB3 1 61 VAL H 4.800 . 6.000 4.398 4.233 4.478 . 0 0 "[ . 1]" 1
1278 1 60 ASP HB3 1 67 LEU MD2 4.100 . 6.000 3.730 3.412 4.010 . 0 0 "[ . 1]" 1
1279 1 61 VAL H 1 61 VAL HA 2.800 . 3.800 2.864 2.815 2.896 . 0 0 "[ . 1]" 1
1280 1 61 VAL H 1 61 VAL HB 2.400 . 3.100 2.569 2.537 2.601 . 0 0 "[ . 1]" 1
1281 1 61 VAL H 1 61 VAL MG1 4.000 . 6.000 3.779 3.761 3.799 . 0 0 "[ . 1]" 1
1282 1 61 VAL H 1 61 VAL MG2 2.100 . 6.000 2.058 1.938 2.165 . 0 0 "[ . 1]" 1
1283 1 61 VAL H 1 62 ASP H 2.500 . 3.300 2.476 2.325 2.666 . 0 0 "[ . 1]" 1
1284 1 61 VAL H 1 67 LEU MD2 4.500 . 6.000 4.560 4.033 5.445 . 0 0 "[ . 1]" 1
1285 1 61 VAL H 1 71 GLU HA 4.600 . 6.000 5.059 4.625 5.625 . 0 0 "[ . 1]" 1
1286 1 61 VAL H 1 71 GLU HG2 3.600 . 5.200 3.644 3.166 4.541 . 0 0 "[ . 1]" 1
1287 1 61 VAL H 1 71 GLU HG3 4.300 . 6.000 4.831 4.497 5.835 . 0 0 "[ . 1]" 1
1288 1 61 VAL HA 1 61 VAL HB 2.900 . 3.900 3.024 3.021 3.028 . 0 0 "[ . 1]" 1
1289 1 61 VAL HA 1 61 VAL MG1 2.400 . 3.100 2.371 2.353 2.403 . 0 0 "[ . 1]" 1
1290 1 61 VAL HA 1 61 VAL MG2 2.500 . 3.300 2.437 2.412 2.464 . 0 0 "[ . 1]" 1
1291 1 61 VAL HA 1 62 ASP H 3.700 . 5.400 3.518 3.499 3.538 . 0 0 "[ . 1]" 1
1292 1 61 VAL HA 1 63 LYS H 4.200 . 6.000 4.023 3.754 4.351 . 0 0 "[ . 1]" 1
1293 1 61 VAL HA 1 92 LEU MD1 2.800 . 6.000 4.318 2.546 5.381 . 0 0 "[ . 1]" 1
1294 1 61 VAL HB 1 61 VAL MG1 2.100 . 2.600 2.128 2.124 2.131 . 0 0 "[ . 1]" 1
1295 1 61 VAL HB 1 62 ASP H 2.700 . 3.600 2.710 2.525 2.865 . 0 0 "[ . 1]" 1
1296 1 61 VAL HB 1 62 ASP HA 4.300 . 6.000 4.240 4.141 4.321 . 0 0 "[ . 1]" 1
1297 1 61 VAL HB 1 63 LYS H 3.500 . 5.000 4.743 4.641 4.867 . 0 0 "[ . 1]" 1
1298 1 61 VAL HB 1 101 LYS HE3 3.300 . 4.700 4.351 3.339 5.498 0.798 9 1 "[ . +1]" 1
1299 1 61 VAL HB 1 101 LYS HG3 3.700 . 5.400 4.830 3.100 5.845 0.445 9 0 "[ . 1]" 1
1300 1 61 VAL MG1 1 62 ASP H 4.000 . 6.000 3.643 3.529 3.788 . 0 0 "[ . 1]" 1
1301 1 61 VAL MG1 1 63 LYS H 3.600 . 6.000 4.828 4.694 5.005 . 0 0 "[ . 1]" 1
1302 1 61 VAL MG1 1 98 PRO HD2 3.600 . 6.000 3.454 2.523 4.801 . 0 0 "[ . 1]" 1
1303 1 61 VAL MG1 1 98 PRO HD3 3.900 . 6.000 4.571 3.597 5.801 . 0 0 "[ . 1]" 1
1304 1 61 VAL MG1 1 101 LYS HB3 3.300 . 4.600 3.032 2.300 3.758 . 0 0 "[ . 1]" 1
1305 1 61 VAL MG2 1 62 ASP H 4.000 . 6.000 3.763 3.678 3.820 . 0 0 "[ . 1]" 1
1306 1 61 VAL MG2 1 62 ASP HA 4.000 . 6.000 5.365 5.315 5.401 . 0 0 "[ . 1]" 1
1307 1 61 VAL MG2 1 63 LYS H 4.700 . 6.000 5.042 4.903 5.163 . 0 0 "[ . 1]" 1
1308 1 61 VAL MG2 1 71 GLU HA 3.000 . 6.000 4.414 3.906 5.233 . 0 0 "[ . 1]" 1
1309 1 61 VAL MG2 1 71 GLU HG3 4.300 . 6.000 5.134 4.851 5.969 . 0 0 "[ . 1]" 1
1310 1 61 VAL MG2 1 97 VAL HA 2.800 . 6.000 3.610 3.018 4.366 . 0 0 "[ . 1]" 1
1311 1 61 VAL MG2 1 98 PRO HD2 2.700 . 6.000 2.487 2.062 3.499 . 0 0 "[ . 1]" 1
1312 1 61 VAL MG2 1 98 PRO HD3 3.100 . 4.300 2.974 2.486 3.990 . 0 0 "[ . 1]" 1
1313 1 62 ASP H 1 62 ASP HA 2.800 . 3.800 2.901 2.887 2.910 . 0 0 "[ . 1]" 1
1314 1 62 ASP H 1 62 ASP HB2 3.600 . 5.200 3.643 3.572 3.680 . 0 0 "[ . 1]" 1
1315 1 62 ASP H 1 62 ASP HB3 3.100 . 4.300 2.848 2.661 3.085 . 0 0 "[ . 1]" 1
1316 1 62 ASP H 1 63 LYS H 2.400 . 3.100 2.338 2.211 2.429 . 0 0 "[ . 1]" 1
1317 1 62 ASP H 1 63 LYS HA 5.000 . 6.000 4.569 4.452 4.665 . 0 0 "[ . 1]" 1
1318 1 62 ASP H 1 63 LYS QG 4.900 . 6.000 4.250 4.037 4.692 . 0 0 "[ . 1]" 1
1319 1 62 ASP H 1 64 ASP H 4.800 . 6.000 4.527 4.067 4.860 . 0 0 "[ . 1]" 1
1320 1 62 ASP H 1 101 LYS HE3 3.700 . 5.400 4.361 2.908 5.950 0.550 9 1 "[ . +1]" 1
1321 1 62 ASP HA 1 62 ASP HB2 2.600 . 3.500 2.491 2.396 2.613 . 0 0 "[ . 1]" 1
1322 1 62 ASP HA 1 62 ASP HB3 2.500 . 3.300 2.411 2.310 2.512 . 0 0 "[ . 1]" 1
1323 1 62 ASP HA 1 63 LYS H 3.400 . 4.900 3.345 3.309 3.414 . 0 0 "[ . 1]" 1
1324 1 62 ASP HA 1 63 LYS HD2 4.000 . 6.000 5.715 4.556 6.719 0.719 5 2 "[ -+ 1]" 1
1325 1 62 ASP HB2 1 63 LYS H 3.800 . 5.600 4.129 3.996 4.299 . 0 0 "[ . 1]" 1
1326 1 62 ASP HB3 1 101 LYS HG2 3.500 . 6.000 3.854 2.952 4.858 . 0 0 "[ . 1]" 1
1327 1 63 LYS H 1 63 LYS HA 2.100 . 2.700 2.265 2.247 2.278 . 0 0 "[ . 1]" 1
1328 1 63 LYS H 1 63 LYS HB3 3.900 . 5.800 4.032 3.970 4.091 . 0 0 "[ . 1]" 1
1329 1 63 LYS H 1 63 LYS HD2 4.900 . 6.000 4.829 2.384 5.476 . 0 0 "[ . 1]" 1
1330 1 63 LYS H 1 63 LYS QG 2.500 . 3.300 2.717 2.504 2.964 . 0 0 "[ . 1]" 1
1331 1 63 LYS H 1 64 ASP H 2.900 . 4.000 2.955 2.646 3.233 . 0 0 "[ . 1]" 1
1332 1 63 LYS H 1 65 GLY H 5.100 . 6.000 4.681 4.449 4.908 . 0 0 "[ . 1]" 1
1333 1 63 LYS H 1 67 LEU MD2 4.000 . 6.000 5.478 4.883 5.789 . 0 0 "[ . 1]" 1
1334 1 63 LYS HA 1 63 LYS HB3 2.500 . 3.300 2.457 2.353 2.553 . 0 0 "[ . 1]" 1
1335 1 63 LYS HA 1 63 LYS HD3 4.000 . 6.000 4.454 3.944 4.852 . 0 0 "[ . 1]" 1
1336 1 63 LYS HA 1 63 LYS QG 2.600 . 3.400 2.533 2.284 3.205 . 0 0 "[ . 1]" 1
1337 1 63 LYS HA 1 64 ASP H 2.500 . 3.300 2.518 2.281 2.846 . 0 0 "[ . 1]" 1
1338 1 63 LYS HA 1 65 GLY H 3.500 . 5.000 3.173 2.961 3.323 . 0 0 "[ . 1]" 1
1339 1 63 LYS HB2 1 64 ASP H 4.400 . 6.000 4.384 4.124 4.500 . 0 0 "[ . 1]" 1
1340 1 63 LYS HB3 1 63 LYS QG 2.500 . 3.300 2.346 2.284 2.488 . 0 0 "[ . 1]" 1
1341 1 63 LYS HD2 1 63 LYS HE2 2.300 . 3.000 2.789 2.389 3.017 0.017 5 0 "[ . 1]" 1
1342 1 63 LYS HD2 1 63 LYS QG 2.400 . 3.100 2.316 2.132 2.439 . 0 0 "[ . 1]" 1
1343 1 63 LYS HD3 1 63 LYS QG 2.100 . 2.700 2.268 2.165 2.398 . 0 0 "[ . 1]" 1
1344 1 63 LYS HE2 1 63 LYS QG 3.300 . 4.700 2.816 2.332 3.563 . 0 0 "[ . 1]" 1
1345 1 63 LYS QG 1 64 ASP H 3.200 . 6.000 4.487 4.312 4.710 . 0 0 "[ . 1]" 1
1346 1 64 ASP H 1 64 ASP HB2 3.800 . 5.600 3.754 3.619 3.872 . 0 0 "[ . 1]" 1
1347 1 64 ASP H 1 64 ASP HB3 3.000 . 4.100 2.942 2.578 3.249 . 0 0 "[ . 1]" 1
1348 1 64 ASP H 1 65 GLY H 2.300 . 3.000 2.206 1.927 2.602 . 0 0 "[ . 1]" 1
1349 1 64 ASP H 1 65 GLY HA2 5.900 . 6.000 4.431 4.178 4.788 . 0 0 "[ . 1]" 1
1350 1 64 ASP H 1 65 GLY HA3 5.300 . 6.000 4.847 4.612 5.173 . 0 0 "[ . 1]" 1
1351 1 64 ASP H 1 66 LEU H 3.600 . 5.200 3.270 3.085 3.824 . 0 0 "[ . 1]" 1
1352 1 64 ASP HA 1 64 ASP HB2 2.600 . 3.400 2.426 2.376 2.515 . 0 0 "[ . 1]" 1
1353 1 64 ASP HA 1 64 ASP HB3 2.600 . 3.500 2.486 2.390 2.535 . 0 0 "[ . 1]" 1
1354 1 64 ASP HA 1 65 GLY H 3.900 . 5.800 3.175 3.145 3.200 . 0 0 "[ . 1]" 1
1355 1 64 ASP HA 1 65 GLY HA2 3.700 . 5.400 5.010 4.968 5.049 . 0 0 "[ . 1]" 1
1356 1 64 ASP HB2 1 65 GLY H 5.300 . 6.000 4.424 4.329 4.465 . 0 0 "[ . 1]" 1
1357 1 64 ASP HB2 1 66 LEU QB 3.200 . 4.500 4.045 3.712 4.477 . 0 0 "[ . 1]" 1
1358 1 64 ASP HB2 1 66 LEU MD1 3.700 . 5.400 3.907 3.305 4.638 . 0 0 "[ . 1]" 1
1359 1 64 ASP HB3 1 65 GLY H 5.500 . 6.000 4.417 4.355 4.509 . 0 0 "[ . 1]" 1
1360 1 65 GLY H 1 65 GLY HA2 2.800 . 3.800 2.306 2.297 2.321 . 0 0 "[ . 1]" 1
1361 1 65 GLY H 1 65 GLY HA3 2.400 . 3.100 2.854 2.829 2.887 . 0 0 "[ . 1]" 1
1362 1 65 GLY H 1 66 LEU H 2.600 . 3.400 2.673 2.584 2.926 . 0 0 "[ . 1]" 1
1363 1 65 GLY H 1 66 LEU HG 4.700 . 6.000 5.263 4.829 6.016 0.016 6 0 "[ . 1]" 1
1364 1 65 GLY H 2 7 GLY HA2 6.000 . 6.000 5.645 4.929 6.045 0.045 10 0 "[ . 1]" 1
1365 1 65 GLY HA2 1 66 LEU H 3.200 . 4.500 3.229 3.053 3.415 . 0 0 "[ . 1]" 1
1366 1 65 GLY HA2 1 67 LEU HG 3.200 . 6.000 6.032 5.998 6.086 0.086 6 0 "[ . 1]" 1
1367 1 65 GLY HA3 1 66 LEU H 3.400 . 4.800 3.275 3.062 3.399 . 0 0 "[ . 1]" 1
1368 1 65 GLY HA3 1 66 LEU HG 4.400 . 6.000 4.064 3.663 5.267 . 0 0 "[ . 1]" 1
1369 1 66 LEU H 1 66 LEU HA 2.900 . 3.900 2.930 2.871 2.943 . 0 0 "[ . 1]" 1
1370 1 66 LEU H 1 66 LEU QB 2.600 . 3.500 2.652 2.466 3.092 . 0 0 "[ . 1]" 1
1371 1 66 LEU H 1 66 LEU MD1 3.900 . 5.800 3.791 2.624 4.175 . 0 0 "[ . 1]" 1
1372 1 66 LEU H 1 66 LEU MD2 3.900 . 5.800 4.024 3.711 4.642 . 0 0 "[ . 1]" 1
1373 1 66 LEU H 1 66 LEU HG 3.000 . 4.100 3.200 2.737 3.923 . 0 0 "[ . 1]" 1
1374 1 66 LEU H 1 67 LEU H 4.600 . 6.000 4.397 4.341 4.475 . 0 0 "[ . 1]" 1
1375 1 66 LEU HA 1 66 LEU MD1 4.300 . 6.000 3.756 3.350 3.909 . 0 0 "[ . 1]" 1
1376 1 66 LEU HA 1 66 LEU MD2 2.500 . 3.300 2.550 2.004 4.093 0.793 5 1 "[ + 1]" 1
1377 1 66 LEU HA 1 66 LEU HG 3.000 . 4.200 2.998 2.338 3.670 . 0 0 "[ . 1]" 1
1378 1 66 LEU HA 1 67 LEU H 2.400 . 3.100 2.332 2.213 2.527 . 0 0 "[ . 1]" 1
1379 1 66 LEU HA 1 67 LEU MD1 2.600 . 6.000 5.133 4.756 5.299 . 0 0 "[ . 1]" 1
1380 1 66 LEU QB 1 66 LEU MD1 . . 2.800 2.093 2.049 2.130 . 0 0 "[ . 1]" 1
1381 1 66 LEU QB 1 66 LEU MD2 2.900 . 3.900 2.213 2.050 2.298 . 0 0 "[ . 1]" 1
1382 1 66 LEU QB 1 67 LEU H 4.100 . 4.700 2.621 2.315 2.986 . 0 0 "[ . 1]" 1
1383 1 66 LEU MD1 1 66 LEU HG 2.100 . 2.700 2.125 2.116 2.132 . 0 0 "[ . 1]" 1
1384 1 66 LEU MD1 1 67 LEU H 5.000 . 6.000 4.477 2.294 4.962 . 0 0 "[ . 1]" 1
1385 1 66 LEU MD2 1 66 LEU HG 2.200 . 2.800 2.128 2.120 2.136 . 0 0 "[ . 1]" 1
1386 1 66 LEU MD2 1 67 LEU H 3.700 . 5.400 3.641 3.353 4.514 . 0 0 "[ . 1]" 1
1387 1 66 LEU HG 1 67 LEU H 4.300 . 6.000 4.687 3.896 5.039 . 0 0 "[ . 1]" 1
1388 1 67 LEU H 1 67 LEU HB2 3.000 . 4.100 2.532 2.433 2.685 . 0 0 "[ . 1]" 1
1389 1 67 LEU H 1 67 LEU HB3 3.200 . 4.400 3.705 3.639 3.801 . 0 0 "[ . 1]" 1
1390 1 67 LEU H 1 67 LEU MD1 3.700 . 5.400 4.060 3.910 4.156 . 0 0 "[ . 1]" 1
1391 1 67 LEU H 1 67 LEU MD2 3.400 . 4.900 3.718 3.580 3.874 . 0 0 "[ . 1]" 1
1392 1 67 LEU H 1 67 LEU HG 3.800 . 5.600 2.994 2.767 3.200 . 0 0 "[ . 1]" 1
1393 1 67 LEU H 1 68 ASP H 3.800 . 5.600 4.279 4.193 4.408 . 0 0 "[ . 1]" 1
1394 1 67 LEU HA 1 67 LEU HB3 2.800 . 3.800 2.503 2.464 2.533 . 0 0 "[ . 1]" 1
1395 1 67 LEU HA 1 67 LEU MD1 4.900 . 6.000 3.832 3.809 3.866 . 0 0 "[ . 1]" 1
1396 1 67 LEU HA 1 67 LEU MD2 2.600 . 3.500 1.957 1.900 2.019 . 0 0 "[ . 1]" 1
1397 1 67 LEU HA 1 67 LEU HG 3.600 . 5.200 3.113 3.049 3.180 . 0 0 "[ . 1]" 1
1398 1 67 LEU HA 1 68 ASP H 2.200 . 2.800 2.138 2.119 2.161 . 0 0 "[ . 1]" 1
1399 1 67 LEU HA 1 71 GLU H 5.500 . 6.000 4.760 4.509 4.937 . 0 0 "[ . 1]" 1
1400 1 67 LEU HA 1 71 GLU HB2 3.800 . 5.600 2.601 2.267 3.911 . 0 0 "[ . 1]" 1
1401 1 67 LEU HA 1 71 GLU HB3 3.900 . 5.800 3.567 3.114 4.978 . 0 0 "[ . 1]" 1
1402 1 67 LEU HA 1 72 PHE H 4.800 . 6.000 4.394 4.258 4.626 . 0 0 "[ . 1]" 1
1403 1 67 LEU HB2 1 67 LEU MD2 3.900 . 5.800 3.199 3.195 3.202 . 0 0 "[ . 1]" 1
1404 1 67 LEU HB2 1 67 LEU HG 2.300 . 3.000 2.446 2.424 2.463 . 0 0 "[ . 1]" 1
1405 1 67 LEU HB2 1 68 ASP H 4.700 . 6.000 4.331 4.267 4.381 . 0 0 "[ . 1]" 1
1406 1 67 LEU HB2 1 72 PHE HB3 5.100 . 6.000 4.576 4.373 4.848 . 0 0 "[ . 1]" 1
1407 1 67 LEU HB3 1 68 ASP H 3.300 . 4.700 3.494 3.334 3.630 . 0 0 "[ . 1]" 1
1408 1 67 LEU HB3 1 72 PHE H 3.100 . 4.300 2.871 2.649 3.115 . 0 0 "[ . 1]" 1
1409 1 67 LEU HB3 1 72 PHE HB2 3.200 . 4.500 2.357 2.141 2.625 . 0 0 "[ . 1]" 1
1410 1 67 LEU HB3 1 72 PHE HB3 4.700 . 6.000 3.831 3.640 4.008 . 0 0 "[ . 1]" 1
1411 1 67 LEU MD1 1 67 LEU MD2 2.500 . 6.000 2.083 2.074 2.091 . 0 0 "[ . 1]" 1
1412 1 67 LEU MD1 1 68 ASP H 6.000 . 6.000 5.146 5.034 5.264 . 0 0 "[ . 1]" 1
1413 1 67 LEU MD1 1 72 PHE H 4.500 . 6.000 4.049 3.843 4.412 . 0 0 "[ . 1]" 1
1414 1 67 LEU MD1 1 72 PHE HA 3.200 . 4.500 2.261 1.979 2.525 . 0 0 "[ . 1]" 1
1415 1 67 LEU MD1 1 72 PHE HB2 4.500 . 6.000 3.124 2.801 3.387 . 0 0 "[ . 1]" 1
1416 1 67 LEU MD1 1 72 PHE HB3 5.200 . 6.000 4.380 4.129 4.611 . 0 0 "[ . 1]" 1
1417 1 67 LEU MD1 1 72 PHE QD 2.800 . 3.800 2.218 1.950 2.538 . 0 0 "[ . 1]" 1
1418 1 67 LEU MD2 1 67 LEU HG 2.200 . 2.800 2.128 2.124 2.131 . 0 0 "[ . 1]" 1
1419 1 67 LEU MD2 1 68 ASP H 3.600 . 5.300 3.564 3.437 3.703 . 0 0 "[ . 1]" 1
1420 1 67 LEU MD2 1 71 GLU HA 4.200 . 6.000 4.021 3.891 4.300 . 0 0 "[ . 1]" 1
1421 1 67 LEU MD2 1 71 GLU HB2 2.800 . 3.800 2.482 2.175 2.666 . 0 0 "[ . 1]" 1
1422 1 67 LEU MD2 1 71 GLU HB3 3.300 . 4.700 2.316 1.982 3.667 . 0 0 "[ . 1]" 1
1423 1 67 LEU MD2 1 71 GLU HG2 4.600 . 6.000 4.221 3.932 4.403 . 0 0 "[ . 1]" 1
1424 1 67 LEU MD2 1 72 PHE H 4.400 . 6.000 3.916 3.733 4.077 . 0 0 "[ . 1]" 1
1425 1 67 LEU MD2 1 72 PHE HA 4.100 . 6.000 3.516 3.270 3.794 . 0 0 "[ . 1]" 1
1426 1 67 LEU MD2 1 72 PHE HB2 3.200 . 6.000 4.228 3.943 4.537 . 0 0 "[ . 1]" 1
1427 1 67 LEU MD2 1 75 ALA MB 2.800 . 6.000 3.384 3.197 3.639 . 0 0 "[ . 1]" 1
1428 1 67 LEU HG 1 68 ASP H 5.200 . 6.000 5.167 5.069 5.240 . 0 0 "[ . 1]" 1
1429 1 67 LEU HG 1 71 GLU HB2 4.700 . 6.000 4.779 4.570 5.166 . 0 0 "[ . 1]" 1
1430 1 68 ASP H 1 68 ASP HA 2.800 . 3.800 2.857 2.844 2.883 . 0 0 "[ . 1]" 1
1431 1 68 ASP H 1 68 ASP QB 3.700 . 4.900 2.538 2.298 2.735 . 0 0 "[ . 1]" 1
1432 1 68 ASP H 1 69 ASP H 4.600 . 6.000 4.570 4.466 4.632 . 0 0 "[ . 1]" 1
1433 1 68 ASP H 1 71 GLU H 3.700 . 5.400 3.364 3.230 3.537 . 0 0 "[ . 1]" 1
1434 1 68 ASP H 1 71 GLU HA 5.900 . 6.000 5.025 4.802 5.371 . 0 0 "[ . 1]" 1
1435 1 68 ASP H 1 71 GLU HB2 2.800 . 3.800 2.438 1.994 4.012 0.212 8 0 "[ . 1]" 1
1436 1 68 ASP H 1 71 GLU HB3 3.900 . 5.800 3.826 3.490 4.416 . 0 0 "[ . 1]" 1
1437 1 68 ASP H 1 71 GLU HG2 4.900 . 6.000 3.922 2.416 4.516 . 0 0 "[ . 1]" 1
1438 1 68 ASP HA 1 68 ASP QB 2.600 . 3.500 2.323 2.174 2.447 . 0 0 "[ . 1]" 1
1439 1 68 ASP HA 1 69 ASP H 2.600 . 3.400 2.534 2.439 2.680 . 0 0 "[ . 1]" 1
1440 1 68 ASP HA 1 70 GLU H 5.000 . 6.000 4.334 3.983 4.614 . 0 0 "[ . 1]" 1
1441 1 68 ASP QB 1 69 ASP H 2.700 . 3.600 2.167 1.852 2.365 . 0 0 "[ . 1]" 1
1442 1 68 ASP QB 1 69 ASP QB 4.900 . 6.000 3.880 3.369 4.290 . 0 0 "[ . 1]" 1
1443 1 68 ASP QB 1 70 GLU H 3.800 . 5.600 2.613 2.183 3.197 . 0 0 "[ . 1]" 1
1444 1 69 ASP H 1 69 ASP HA 3.000 . 4.100 2.789 2.763 2.821 . 0 0 "[ . 1]" 1
1445 1 69 ASP H 1 69 ASP QB 3.600 . 3.600 2.294 2.078 2.488 . 0 0 "[ . 1]" 1
1446 1 69 ASP H 1 70 GLU H 2.700 . 3.600 2.691 2.586 2.798 . 0 0 "[ . 1]" 1
1447 1 69 ASP HA 1 69 ASP QB 2.800 . 3.800 2.224 2.176 2.339 . 0 0 "[ . 1]" 1
1448 1 69 ASP HA 1 70 GLU H 3.500 . 5.100 3.512 3.468 3.555 . 0 0 "[ . 1]" 1
1449 1 69 ASP HA 1 70 GLU HA 3.800 . 5.600 4.782 4.730 4.832 . 0 0 "[ . 1]" 1
1450 1 69 ASP HA 1 72 PHE H 3.700 . 5.400 3.790 3.572 4.058 . 0 0 "[ . 1]" 1
1451 1 69 ASP HA 1 73 ALA H 4.300 . 6.000 3.961 3.766 4.125 . 0 0 "[ . 1]" 1
1452 1 70 GLU H 1 70 GLU HA 3.000 . 4.100 2.837 2.806 2.868 . 0 0 "[ . 1]" 1
1453 1 70 GLU H 1 70 GLU HB2 2.600 . 3.400 2.504 2.313 2.667 . 0 0 "[ . 1]" 1
1454 1 70 GLU H 1 70 GLU HB3 3.700 . 5.400 3.594 3.553 3.626 . 0 0 "[ . 1]" 1
1455 1 70 GLU H 1 70 GLU QG 3.100 . 4.300 2.307 1.963 3.380 0.037 1 0 "[ . 1]" 1
1456 1 70 GLU H 1 71 GLU H 2.600 . 3.400 2.686 2.561 2.862 . 0 0 "[ . 1]" 1
1457 1 70 GLU H 1 72 PHE H 4.000 . 6.000 4.106 3.890 4.330 . 0 0 "[ . 1]" 1
1458 1 70 GLU HA 1 70 GLU HB3 2.500 . 3.300 2.474 2.402 2.621 . 0 0 "[ . 1]" 1
1459 1 70 GLU HA 1 70 GLU QG 2.800 . 3.800 2.545 2.252 3.099 . 0 0 "[ . 1]" 1
1460 1 70 GLU HA 1 73 ALA H 3.200 . 4.500 3.700 3.466 3.862 . 0 0 "[ . 1]" 1
1461 1 70 GLU HA 1 73 ALA MB 2.600 . 3.400 2.740 2.465 2.909 . 0 0 "[ . 1]" 1
1462 1 70 GLU HB2 1 71 GLU H 3.000 . 4.100 2.421 2.225 2.711 . 0 0 "[ . 1]" 1
1463 1 70 GLU HB3 1 71 GLU H 3.700 . 5.500 3.480 3.210 3.783 . 0 0 "[ . 1]" 1
1464 1 71 GLU H 1 71 GLU HA 2.900 . 3.900 2.830 2.809 2.870 . 0 0 "[ . 1]" 1
1465 1 71 GLU H 1 71 GLU HB2 2.800 . 3.800 2.717 2.572 3.542 . 0 0 "[ . 1]" 1
1466 1 71 GLU H 1 71 GLU HB3 3.700 . 5.400 3.573 3.168 3.645 . 0 0 "[ . 1]" 1
1467 1 71 GLU H 1 71 GLU HG2 3.500 . 5.000 2.923 1.887 3.183 0.113 8 0 "[ . 1]" 1
1468 1 71 GLU H 1 71 GLU HG3 2.600 . 3.400 2.230 2.011 2.556 . 0 0 "[ . 1]" 1
1469 1 71 GLU H 1 72 PHE H 2.700 . 3.600 2.625 2.508 2.718 . 0 0 "[ . 1]" 1
1470 1 71 GLU H 1 73 ALA H 4.000 . 6.000 4.091 3.930 4.242 . 0 0 "[ . 1]" 1
1471 1 71 GLU HA 1 71 GLU HG2 3.200 . 4.500 2.634 2.457 3.548 . 0 0 "[ . 1]" 1
1472 1 71 GLU HA 1 71 GLU HG3 3.900 . 5.800 3.399 3.240 3.854 . 0 0 "[ . 1]" 1
1473 1 71 GLU HB2 1 72 PHE H 3.500 . 5.000 2.821 2.547 3.808 . 0 0 "[ . 1]" 1
1474 1 71 GLU HB2 1 72 PHE HB3 4.300 . 6.000 5.125 4.858 6.087 0.087 8 0 "[ . 1]" 1
1475 1 71 GLU HB3 1 72 PHE H 4.000 . 6.000 3.891 3.717 4.456 . 0 0 "[ . 1]" 1
1476 1 71 GLU HG3 1 101 LYS HE3 3.700 . 5.500 3.763 1.949 4.536 . 0 0 "[ . 1]" 1
1477 1 72 PHE H 1 72 PHE HA 3.000 . 4.100 2.845 2.817 2.876 . 0 0 "[ . 1]" 1
1478 1 72 PHE H 1 72 PHE HB2 2.700 . 3.600 2.614 2.519 2.692 . 0 0 "[ . 1]" 1
1479 1 72 PHE H 1 72 PHE HB3 2.700 . 3.600 2.521 2.461 2.620 . 0 0 "[ . 1]" 1
1480 1 72 PHE H 1 72 PHE QD 4.300 . 6.000 4.204 4.173 4.223 . 0 0 "[ . 1]" 1
1481 1 72 PHE H 1 73 ALA H 2.700 . 3.600 2.559 2.409 2.712 . 0 0 "[ . 1]" 1
1482 1 72 PHE H 1 73 ALA MB 4.400 . 6.000 4.224 4.054 4.349 . 0 0 "[ . 1]" 1
1483 1 72 PHE H 1 74 LEU H 4.300 . 6.000 4.023 3.808 4.168 . 0 0 "[ . 1]" 1
1484 1 72 PHE HA 1 72 PHE HB2 3.000 . 4.100 2.459 2.427 2.506 . 0 0 "[ . 1]" 1
1485 1 72 PHE HA 1 72 PHE QD 2.800 . 3.800 2.587 2.352 2.848 . 0 0 "[ . 1]" 1
1486 1 72 PHE HA 1 73 ALA H 3.900 . 5.800 3.536 3.514 3.566 . 0 0 "[ . 1]" 1
1487 1 72 PHE HA 1 75 ALA H 3.300 . 4.600 3.228 2.957 3.570 . 0 0 "[ . 1]" 1
1488 1 72 PHE HA 1 75 ALA MB 2.800 . 3.700 2.447 2.252 2.753 . 0 0 "[ . 1]" 1
1489 1 72 PHE HB2 1 72 PHE QD 2.600 . 3.400 2.527 2.433 2.621 . 0 0 "[ . 1]" 1
1490 1 72 PHE HB2 1 73 ALA H 4.000 . 6.000 3.915 3.795 3.996 . 0 0 "[ . 1]" 1
1491 1 72 PHE HB2 1 73 ALA HA 2.700 . 6.000 5.684 5.602 5.749 . 0 0 "[ . 1]" 1
1492 1 72 PHE HB3 1 72 PHE QD 2.800 . 3.800 2.298 2.268 2.345 . 0 0 "[ . 1]" 1
1493 1 72 PHE HB3 1 73 ALA H 2.800 . 3.800 2.656 2.435 2.756 . 0 0 "[ . 1]" 1
1494 1 72 PHE QD 1 73 ALA H 3.700 . 5.400 3.705 3.253 4.043 . 0 0 "[ . 1]" 1
1495 1 72 PHE QD 1 75 ALA H 5.100 . 6.000 5.173 4.863 5.565 . 0 0 "[ . 1]" 1
1496 1 72 PHE QD 1 75 ALA MB 3.600 . 5.300 3.385 2.850 4.212 . 0 0 "[ . 1]" 1
1497 1 73 ALA H 1 73 ALA HA 2.900 . 4.000 2.796 2.783 2.811 . 0 0 "[ . 1]" 1
1498 1 73 ALA H 1 73 ALA MB 2.400 . 3.100 2.243 2.224 2.260 . 0 0 "[ . 1]" 1
1499 1 73 ALA H 1 74 LEU H 2.700 . 3.600 2.718 2.643 2.802 . 0 0 "[ . 1]" 1
1500 1 73 ALA H 1 75 ALA H 4.300 . 6.000 4.224 4.086 4.336 . 0 0 "[ . 1]" 1
1501 1 73 ALA H 1 75 ALA MB 4.900 . 6.000 4.782 4.655 4.915 . 0 0 "[ . 1]" 1
1502 1 73 ALA HA 1 73 ALA MB 2.400 . 3.100 2.132 2.128 2.134 . 0 0 "[ . 1]" 1
1503 1 73 ALA HA 1 74 LEU H 3.700 . 5.400 3.541 3.522 3.563 . 0 0 "[ . 1]" 1
1504 1 73 ALA HA 1 76 ASN H 3.500 . 5.000 3.594 3.446 3.774 . 0 0 "[ . 1]" 1
1505 1 73 ALA HA 1 76 ASN HB3 4.100 . 6.000 3.980 3.316 4.516 . 0 0 "[ . 1]" 1
1506 1 73 ALA HA 1 76 ASN HD21 4.100 . 6.000 5.248 3.461 5.821 . 0 0 "[ . 1]" 1
1507 1 73 ALA MB 1 74 LEU H 2.800 . 3.800 2.479 2.403 2.563 . 0 0 "[ . 1]" 1
1508 1 73 ALA MB 1 76 ASN H 3.500 . 6.000 4.734 4.624 4.891 . 0 0 "[ . 1]" 1
1509 1 74 LEU H 1 74 LEU HA 2.600 . 3.400 2.810 2.798 2.832 . 0 0 "[ . 1]" 1
1510 1 74 LEU H 1 74 LEU HB2 2.400 . 3.100 2.400 2.242 2.565 . 0 0 "[ . 1]" 1
1511 1 74 LEU H 1 74 LEU HB3 2.400 . 3.100 2.618 2.451 2.777 . 0 0 "[ . 1]" 1
1512 1 74 LEU H 1 74 LEU MD1 3.800 . 5.600 4.138 4.052 4.260 . 0 0 "[ . 1]" 1
1513 1 74 LEU H 1 74 LEU HG 4.400 . 6.000 4.421 4.275 4.518 . 0 0 "[ . 1]" 1
1514 1 74 LEU H 1 75 ALA H 2.800 . 3.700 2.732 2.668 2.775 . 0 0 "[ . 1]" 1
1515 1 74 LEU H 1 75 ALA MB 4.500 . 6.000 4.354 4.291 4.400 . 0 0 "[ . 1]" 1
1516 1 74 LEU H 1 76 ASN H 3.300 . 4.700 4.268 4.152 4.444 . 0 0 "[ . 1]" 1
1517 1 74 LEU HA 1 74 LEU HB2 2.600 . 3.400 2.515 2.425 2.608 . 0 0 "[ . 1]" 1
1518 1 74 LEU HA 1 74 LEU HB3 2.500 . 3.300 3.017 3.006 3.023 . 0 0 "[ . 1]" 1
1519 1 74 LEU HA 1 74 LEU MD1 2.800 . 6.000 2.974 2.024 3.716 . 0 0 "[ . 1]" 1
1520 1 74 LEU HA 1 74 LEU MD2 2.700 . 6.000 3.238 1.899 3.888 . 0 0 "[ . 1]" 1
1521 1 74 LEU HA 1 75 ALA H 3.200 . 4.500 3.554 3.545 3.564 . 0 0 "[ . 1]" 1
1522 1 74 LEU HA 1 76 ASN H 3.400 . 4.800 4.637 4.498 4.815 0.015 9 0 "[ . 1]" 1
1523 1 74 LEU HA 1 77 HIS QB 3.000 . 4.100 2.666 2.464 2.788 . 0 0 "[ . 1]" 1
1524 1 74 LEU HB2 1 74 LEU MD1 2.800 . 3.800 2.382 2.204 3.187 . 0 0 "[ . 1]" 1
1525 1 74 LEU HB2 1 74 LEU MD2 3.000 . 4.100 2.793 2.347 3.197 . 0 0 "[ . 1]" 1
1526 1 74 LEU HB2 1 75 ALA H 3.700 . 5.400 3.699 3.574 3.861 . 0 0 "[ . 1]" 1
1527 1 74 LEU HB3 1 74 LEU MD1 2.700 . 3.600 2.757 2.300 3.202 . 0 0 "[ . 1]" 1
1528 1 74 LEU HB3 1 74 LEU MD2 2.800 . 3.800 2.386 2.259 3.193 . 0 0 "[ . 1]" 1
1529 1 74 LEU HB3 1 75 ALA H 2.600 . 3.500 2.427 2.310 2.541 . 0 0 "[ . 1]" 1
1530 1 74 LEU MD1 1 74 LEU HG 2.300 . 3.000 2.124 2.121 2.128 . 0 0 "[ . 1]" 1
1531 1 74 LEU MD1 1 75 ALA H 4.700 . 6.000 4.348 3.278 4.565 . 0 0 "[ . 1]" 1
1532 1 74 LEU MD1 1 77 HIS QB 4.100 . 6.000 4.084 2.688 5.244 . 0 0 "[ . 1]" 1
1533 1 74 LEU MD1 1 92 LEU MD1 2.800 . 6.000 3.806 2.711 5.476 . 0 0 "[ . 1]" 1
1534 1 74 LEU MD1 1 96 LEU MD1 3.300 . 6.000 3.345 2.292 4.227 . 0 0 "[ . 1]" 1
1535 1 74 LEU MD1 1 97 VAL HA 3.700 . 5.400 4.338 3.403 5.975 0.575 5 1 "[ + 1]" 1
1536 1 74 LEU MD1 1 98 PRO HD2 4.000 . 6.000 4.776 3.513 6.471 0.471 5 0 "[ . 1]" 1
1537 1 74 LEU MD2 1 74 LEU HG 2.400 . 3.100 2.126 2.121 2.131 . 0 0 "[ . 1]" 1
1538 1 74 LEU MD2 1 75 ALA H 4.200 . 6.000 3.791 3.236 4.416 . 0 0 "[ . 1]" 1
1539 1 74 LEU MD2 1 77 HIS H 3.700 . 6.000 5.226 4.492 6.278 0.278 9 0 "[ . 1]" 1
1540 1 74 LEU MD2 1 77 HIS QB 4.500 . 6.000 4.220 3.074 5.182 . 0 0 "[ . 1]" 1
1541 1 74 LEU MD2 1 77 HIS HD2 3.800 . 6.000 5.719 4.317 6.693 0.693 2 3 "[ + . - *1]" 1
1542 1 74 LEU MD2 1 78 LEU HG 2.800 . 3.800 3.237 1.972 4.511 0.711 9 3 "[ . * +-]" 1
1543 1 74 LEU MD2 1 96 LEU HA 4.100 . 6.000 5.017 3.630 5.950 . 0 0 "[ . 1]" 1
1544 1 74 LEU MD2 1 96 LEU HB2 4.000 . 6.000 5.008 3.915 6.046 0.046 2 0 "[ . 1]" 1
1545 1 74 LEU MD2 1 96 LEU HB3 3.500 . 5.100 3.779 2.385 5.145 0.045 2 0 "[ . 1]" 1
1546 1 74 LEU MD2 1 96 LEU MD1 2.900 . 6.000 3.651 2.962 4.653 . 0 0 "[ . 1]" 1
1547 1 74 LEU MD2 1 96 LEU MD2 3.500 . 5.100 3.818 2.610 5.287 0.187 6 0 "[ . 1]" 1
1548 1 74 LEU MD2 1 96 LEU HG 3.200 . 6.000 5.154 3.420 6.365 0.365 9 0 "[ . 1]" 1
1549 1 74 LEU MD2 1 97 VAL HA 2.900 . 6.000 4.905 3.447 5.893 . 0 0 "[ . 1]" 1
1550 1 74 LEU MD2 1 98 PRO HD3 3.400 . 6.000 4.006 2.542 4.996 . 0 0 "[ . 1]" 1
1551 1 74 LEU HG 1 75 ALA H 4.200 . 6.000 4.312 3.553 4.871 . 0 0 "[ . 1]" 1
1552 1 75 ALA H 1 75 ALA HA 2.700 . 3.600 2.785 2.771 2.798 . 0 0 "[ . 1]" 1
1553 1 75 ALA H 1 75 ALA MB 2.200 . 2.800 2.234 2.219 2.248 . 0 0 "[ . 1]" 1
1554 1 75 ALA H 1 76 ASN H 2.600 . 3.500 2.833 2.755 2.907 . 0 0 "[ . 1]" 1
1555 1 75 ALA H 1 78 LEU MD1 4.100 . 6.000 4.610 4.172 5.095 . 0 0 "[ . 1]" 1
1556 1 75 ALA HA 1 75 ALA MB 2.200 . 2.800 2.131 2.126 2.134 . 0 0 "[ . 1]" 1
1557 1 75 ALA HA 1 76 ASN H 3.700 . 5.400 3.559 3.544 3.572 . 0 0 "[ . 1]" 1
1558 1 75 ALA HA 1 78 LEU H 3.500 . 5.000 3.520 3.421 3.616 . 0 0 "[ . 1]" 1
1559 1 75 ALA HA 1 78 LEU HB2 2.800 . 3.800 2.973 2.768 3.181 . 0 0 "[ . 1]" 1
1560 1 75 ALA HA 1 78 LEU HB3 4.300 . 6.000 4.574 4.358 4.810 . 0 0 "[ . 1]" 1
1561 1 75 ALA HA 1 78 LEU MD1 2.800 . 3.800 2.656 2.084 3.286 . 0 0 "[ . 1]" 1
1562 1 75 ALA HA 1 79 ILE H 4.100 . 6.000 4.231 4.105 4.391 . 0 0 "[ . 1]" 1
1563 1 75 ALA MB 1 76 ASN H 2.500 . 6.000 2.356 2.192 2.494 . 0 0 "[ . 1]" 1
1564 1 75 ALA MB 1 76 ASN HD21 3.500 . 5.100 3.533 2.732 4.199 . 0 0 "[ . 1]" 1
1565 1 75 ALA MB 1 77 HIS H 3.900 . 5.800 4.356 4.276 4.435 . 0 0 "[ . 1]" 1
1566 1 75 ALA MB 1 78 LEU HG 4.500 . 6.000 4.938 4.664 5.404 . 0 0 "[ . 1]" 1
1567 1 76 ASN H 1 76 ASN HA 2.800 . 3.800 2.809 2.749 2.848 . 0 0 "[ . 1]" 1
1568 1 76 ASN H 1 76 ASN HB2 2.600 . 3.400 2.214 2.066 2.466 . 0 0 "[ . 1]" 1
1569 1 76 ASN H 1 76 ASN HB3 3.800 . 5.700 3.404 3.069 3.614 . 0 0 "[ . 1]" 1
1570 1 76 ASN H 1 76 ASN HD21 2.400 . 3.100 3.042 2.413 3.546 0.446 9 0 "[ . 1]" 1
1571 1 76 ASN H 1 76 ASN HD22 4.400 . 6.000 4.384 3.896 5.052 . 0 0 "[ . 1]" 1
1572 1 76 ASN H 1 77 HIS H 2.500 . 3.300 2.669 2.571 2.823 . 0 0 "[ . 1]" 1
1573 1 76 ASN H 1 77 HIS QB 5.100 . 6.000 4.443 4.366 4.608 . 0 0 "[ . 1]" 1
1574 1 76 ASN H 1 78 LEU H 4.600 . 6.000 4.218 3.974 4.503 . 0 0 "[ . 1]" 1
1575 1 76 ASN H 1 79 ILE MD 4.600 . 6.000 4.119 3.553 4.897 . 0 0 "[ . 1]" 1
1576 1 76 ASN HA 1 76 ASN HB3 2.800 . 3.700 2.727 2.519 2.946 . 0 0 "[ . 1]" 1
1577 1 76 ASN HA 1 76 ASN HD21 3.200 . 4.500 2.210 1.817 3.593 0.083 6 0 "[ . 1]" 1
1578 1 76 ASN HA 1 77 HIS H 3.300 . 4.600 3.515 3.497 3.545 . 0 0 "[ . 1]" 1
1579 1 76 ASN HA 1 79 ILE H 3.900 . 5.800 3.243 2.947 3.501 . 0 0 "[ . 1]" 1
1580 1 76 ASN HA 1 79 ILE HB 2.500 . 3.300 2.535 2.363 2.739 . 0 0 "[ . 1]" 1
1581 1 76 ASN HA 1 79 ILE MD 2.400 . 3.100 2.231 1.697 3.510 0.410 7 0 "[ . 1]" 1
1582 1 76 ASN HA 1 79 ILE HG13 3.300 . 4.700 2.757 2.314 2.921 . 0 0 "[ . 1]" 1
1583 1 76 ASN HA 1 80 LYS H 4.200 . 6.000 3.964 3.759 4.243 . 0 0 "[ . 1]" 1
1584 1 76 ASN HB2 1 76 ASN HD21 3.300 . 4.700 2.889 2.189 3.522 . 0 0 "[ . 1]" 1
1585 1 76 ASN HB2 1 77 HIS H 3.200 . 4.400 3.094 2.744 3.465 . 0 0 "[ . 1]" 1
1586 1 76 ASN HB3 1 76 ASN HD21 3.800 . 5.600 3.379 2.937 3.527 . 0 0 "[ . 1]" 1
1587 1 76 ASN HB3 1 77 HIS H 4.000 . 6.000 3.312 2.736 3.676 . 0 0 "[ . 1]" 1
1588 1 76 ASN HD21 1 77 HIS H 4.900 . 6.000 4.845 4.514 5.365 . 0 0 "[ . 1]" 1
1589 1 77 HIS H 1 77 HIS HA 2.700 . 3.600 2.827 2.800 2.848 . 0 0 "[ . 1]" 1
1590 1 77 HIS H 1 77 HIS QB 2.400 . 3.100 2.222 2.175 2.258 . 0 0 "[ . 1]" 1
1591 1 77 HIS H 1 77 HIS HD2 5.400 . 6.000 5.409 5.300 5.461 . 0 0 "[ . 1]" 1
1592 1 77 HIS H 1 78 LEU MD1 5.500 . 6.000 5.357 5.082 5.584 . 0 0 "[ . 1]" 1
1593 1 77 HIS H 1 78 LEU HG 4.400 . 6.000 4.457 4.174 4.759 . 0 0 "[ . 1]" 1
1594 1 77 HIS H 1 79 ILE H 4.300 . 6.000 4.034 3.905 4.128 . 0 0 "[ . 1]" 1
1595 1 77 HIS H 1 80 LYS H 4.600 . 6.000 4.705 4.586 4.890 . 0 0 "[ . 1]" 1
1596 1 77 HIS HA 1 77 HIS QB 2.900 . 3.900 2.464 2.431 2.495 . 0 0 "[ . 1]" 1
1597 1 77 HIS HA 1 78 LEU H 3.400 . 4.800 3.533 3.491 3.570 . 0 0 "[ . 1]" 1
1598 1 77 HIS HA 1 78 LEU MD2 4.800 . 6.000 5.388 5.241 5.548 . 0 0 "[ . 1]" 1
1599 1 77 HIS HA 1 79 ILE H 4.400 . 6.000 4.461 4.250 4.560 . 0 0 "[ . 1]" 1
1600 1 77 HIS HA 1 80 LYS H 3.200 . 4.500 3.492 3.268 3.699 . 0 0 "[ . 1]" 1
1601 1 77 HIS HA 1 80 LYS HB2 2.700 . 3.600 3.304 2.294 4.090 0.490 5 0 "[ . 1]" 1
1602 1 77 HIS HA 1 81 VAL H 3.900 . 5.800 4.078 3.834 4.250 . 0 0 "[ . 1]" 1
1603 1 77 HIS QB 1 78 LEU H 3.500 . 3.800 2.551 2.314 2.701 . 0 0 "[ . 1]" 1
1604 1 77 HIS QB 1 81 VAL QG 4.200 . 6.000 4.022 3.554 4.688 . 0 0 "[ . 1]" 1
1605 1 77 HIS QB 1 96 LEU MD2 3.300 . 6.000 4.754 4.257 5.831 . 0 0 "[ . 1]" 1
1606 1 77 HIS HD2 1 78 LEU H 4.200 . 6.000 4.649 4.323 4.846 . 0 0 "[ . 1]" 1
1607 1 77 HIS HD2 1 78 LEU HA 3.700 . 5.500 4.392 4.046 4.610 . 0 0 "[ . 1]" 1
1608 1 77 HIS HD2 1 78 LEU MD2 2.900 . 6.000 3.683 3.342 4.127 . 0 0 "[ . 1]" 1
1609 1 77 HIS HD2 1 81 VAL QG 3.000 . 6.000 3.076 2.667 4.018 . 0 0 "[ . 1]" 1
1610 1 77 HIS HD2 1 96 LEU MD1 2.600 . 6.000 4.405 3.009 5.316 . 0 0 "[ . 1]" 1
1611 1 77 HIS HD2 1 96 LEU MD2 2.300 . 6.000 4.143 3.297 4.686 . 0 0 "[ . 1]" 1
1612 1 77 HIS HE1 1 81 VAL QG 3.600 . 6.000 4.752 3.676 5.919 . 0 0 "[ . 1]" 1
1613 1 78 LEU H 1 78 LEU HA 2.800 . 3.800 2.833 2.784 2.866 . 0 0 "[ . 1]" 1
1614 1 78 LEU H 1 78 LEU HB2 2.800 . 3.800 2.469 2.374 2.515 . 0 0 "[ . 1]" 1
1615 1 78 LEU H 1 78 LEU HB3 3.900 . 5.800 3.594 3.587 3.607 . 0 0 "[ . 1]" 1
1616 1 78 LEU H 1 78 LEU MD1 4.000 . 6.000 3.652 3.542 3.784 . 0 0 "[ . 1]" 1
1617 1 78 LEU H 1 78 LEU MD2 3.500 . 5.000 3.343 3.232 3.529 . 0 0 "[ . 1]" 1
1618 1 78 LEU H 1 78 LEU HG 2.100 . 2.700 2.343 2.187 2.622 . 0 0 "[ . 1]" 1
1619 1 78 LEU H 1 79 ILE H 2.600 . 3.400 2.622 2.504 2.749 . 0 0 "[ . 1]" 1
1620 1 78 LEU H 1 79 ILE MD 3.300 . 6.000 5.186 4.838 5.418 . 0 0 "[ . 1]" 1
1621 1 78 LEU H 1 80 LYS H 4.300 . 6.000 4.166 3.937 4.528 . 0 0 "[ . 1]" 1
1622 1 78 LEU HA 1 78 LEU HB2 2.700 . 3.600 3.019 3.012 3.022 . 0 0 "[ . 1]" 1
1623 1 78 LEU HA 1 78 LEU HB3 2.600 . 3.400 2.487 2.446 2.533 . 0 0 "[ . 1]" 1
1624 1 78 LEU HA 1 78 LEU MD1 4.500 . 6.000 3.847 3.806 3.878 . 0 0 "[ . 1]" 1
1625 1 78 LEU HA 1 78 LEU MD2 2.100 . 6.000 1.996 1.882 2.061 . 0 0 "[ . 1]" 1
1626 1 78 LEU HA 1 78 LEU HG 3.500 . 5.000 3.094 3.027 3.137 . 0 0 "[ . 1]" 1
1627 1 78 LEU HA 1 79 ILE H 3.000 . 4.100 3.538 3.523 3.556 . 0 0 "[ . 1]" 1
1628 1 78 LEU HA 1 81 VAL H 3.200 . 4.500 3.376 3.072 3.770 . 0 0 "[ . 1]" 1
1629 1 78 LEU HA 1 81 VAL QG 2.500 . 6.000 2.758 1.789 3.338 . 0 0 "[ . 1]" 1
1630 1 78 LEU HA 1 82 LYS H 3.200 . 4.500 4.019 3.725 4.330 . 0 0 "[ . 1]" 1
1631 1 78 LEU HA 1 88 LEU MD1 3.800 . 6.000 5.363 4.167 6.317 0.317 10 0 "[ . 1]" 1
1632 1 78 LEU HB2 1 78 LEU MD1 2.600 . 3.400 2.334 2.294 2.369 . 0 0 "[ . 1]" 1
1633 1 78 LEU HB2 1 78 LEU MD2 3.500 . 5.100 3.202 3.199 3.210 . 0 0 "[ . 1]" 1
1634 1 78 LEU HB2 1 79 ILE H 3.200 . 4.500 2.609 2.419 2.793 . 0 0 "[ . 1]" 1
1635 1 78 LEU HB2 1 88 LEU MD1 2.100 . 6.000 5.180 3.965 6.124 0.124 10 0 "[ . 1]" 1
1636 1 78 LEU HB3 1 78 LEU MD2 2.500 . 6.000 2.381 2.350 2.411 . 0 0 "[ . 1]" 1
1637 1 78 LEU HB3 1 78 LEU HG 2.600 . 3.400 3.020 3.017 3.025 . 0 0 "[ . 1]" 1
1638 1 78 LEU HB3 1 79 ILE H 3.900 . 5.800 3.615 3.480 3.746 . 0 0 "[ . 1]" 1
1639 1 78 LEU MD1 1 78 LEU HG 2.200 . 2.800 2.126 2.122 2.129 . 0 0 "[ . 1]" 1
1640 1 78 LEU MD1 1 79 ILE H 3.600 . 6.000 4.519 4.311 4.717 . 0 0 "[ . 1]" 1
1641 1 78 LEU MD2 1 78 LEU HG 2.400 . 3.100 2.130 2.127 2.134 . 0 0 "[ . 1]" 1
1642 1 78 LEU MD2 1 79 ILE H 3.600 . 6.000 4.648 4.624 4.681 . 0 0 "[ . 1]" 1
1643 1 78 LEU MD2 1 89 PRO HD3 3.500 . 6.000 5.344 4.624 6.101 0.101 9 0 "[ . 1]" 1
1644 1 78 LEU MD2 1 92 LEU HA 3.500 . 6.000 5.791 5.127 6.042 0.042 1 0 "[ . 1]" 1
1645 1 78 LEU HG 1 96 LEU MD1 2.400 . 6.000 4.729 3.883 5.594 . 0 0 "[ . 1]" 1
1646 1 79 ILE H 1 79 ILE HA 2.700 . 3.600 2.791 2.781 2.812 . 0 0 "[ . 1]" 1
1647 1 79 ILE H 1 79 ILE HB 2.200 . 2.800 2.581 2.513 2.693 . 0 0 "[ . 1]" 1
1648 1 79 ILE H 1 79 ILE MD 3.400 . 4.800 3.520 2.803 3.737 . 0 0 "[ . 1]" 1
1649 1 79 ILE H 1 79 ILE HG12 3.300 . 4.700 3.184 2.033 3.417 . 0 0 "[ . 1]" 1
1650 1 79 ILE H 1 79 ILE HG13 2.600 . 3.400 2.245 1.938 3.576 0.176 7 0 "[ . 1]" 1
1651 1 79 ILE H 1 79 ILE MG 3.400 . 4.800 3.772 3.743 3.782 . 0 0 "[ . 1]" 1
1652 1 79 ILE H 1 80 LYS H 2.600 . 3.500 2.767 2.691 2.863 . 0 0 "[ . 1]" 1
1653 1 79 ILE HA 1 79 ILE HB 2.900 . 3.900 3.026 3.013 3.034 . 0 0 "[ . 1]" 1
1654 1 79 ILE HA 1 79 ILE MD 3.800 . 5.600 3.655 2.036 3.895 . 0 0 "[ . 1]" 1
1655 1 79 ILE HA 1 79 ILE HG12 3.100 . 4.300 2.610 2.487 3.232 . 0 0 "[ . 1]" 1
1656 1 79 ILE HA 1 79 ILE HG13 2.600 . 3.400 3.122 2.959 3.701 0.301 7 0 "[ . 1]" 1
1657 1 79 ILE HA 1 79 ILE MG 2.400 . 3.100 2.407 2.317 2.463 . 0 0 "[ . 1]" 1
1658 1 79 ILE HA 1 80 LYS H 3.500 . 5.100 3.540 3.520 3.567 . 0 0 "[ . 1]" 1
1659 1 79 ILE HA 1 82 LYS H 3.600 . 5.300 3.670 3.421 3.968 . 0 0 "[ . 1]" 1
1660 1 79 ILE HA 1 82 LYS QB 2.700 . 3.600 2.910 2.669 3.147 . 0 0 "[ . 1]" 1
1661 1 79 ILE HA 1 83 LEU HG 3.300 . 4.700 4.071 3.695 4.482 . 0 0 "[ . 1]" 1
1662 1 79 ILE HB 1 79 ILE HG13 2.200 . 2.800 2.466 2.407 2.502 . 0 0 "[ . 1]" 1
1663 1 79 ILE HB 1 79 ILE MG 2.400 . 3.100 2.126 2.121 2.130 . 0 0 "[ . 1]" 1
1664 1 79 ILE HB 1 80 LYS H 2.100 . 2.600 2.395 2.249 2.534 . 0 0 "[ . 1]" 1
1665 1 79 ILE MD 1 80 LYS H 2.500 . 6.000 4.438 4.208 4.561 . 0 0 "[ . 1]" 1
1666 1 79 ILE HG13 1 80 LYS H 3.800 . 5.600 4.191 3.967 4.656 . 0 0 "[ . 1]" 1
1667 1 79 ILE MG 1 80 LYS H 3.200 . 4.500 3.275 3.101 3.422 . 0 0 "[ . 1]" 1
1668 1 79 ILE MG 1 82 LYS H 3.600 . 6.000 4.745 4.535 5.075 . 0 0 "[ . 1]" 1
1669 1 79 ILE MG 1 83 LEU H 4.100 . 6.000 4.080 3.888 4.242 . 0 0 "[ . 1]" 1
1670 1 80 LYS H 1 80 LYS HA 2.500 . 3.300 2.815 2.787 2.845 . 0 0 "[ . 1]" 1
1671 1 80 LYS H 1 80 LYS HB2 2.400 . 3.100 2.404 2.084 2.601 . 0 0 "[ . 1]" 1
1672 1 80 LYS H 1 80 LYS HB3 2.700 . 3.600 2.902 2.412 3.590 . 0 0 "[ . 1]" 1
1673 1 80 LYS H 1 80 LYS HD3 3.600 . 5.200 4.909 3.033 5.939 0.739 4 2 "[ +.- 1]" 1
1674 1 80 LYS H 1 80 LYS HE2 5.200 . 6.000 4.908 3.620 6.094 0.094 10 0 "[ . 1]" 1
1675 1 80 LYS H 1 80 LYS HG2 3.600 . 5.200 4.007 2.124 4.597 . 0 0 "[ . 1]" 1
1676 1 80 LYS H 1 80 LYS HG3 4.300 . 6.000 4.262 3.640 4.450 . 0 0 "[ . 1]" 1
1677 1 80 LYS H 1 81 VAL H 2.600 . 3.400 2.686 2.520 2.818 . 0 0 "[ . 1]" 1
1678 1 80 LYS H 1 81 VAL QG 4.200 . 6.000 4.182 3.765 4.521 . 0 0 "[ . 1]" 1
1679 1 80 LYS H 1 83 LEU H 4.400 . 6.000 4.721 4.621 4.832 . 0 0 "[ . 1]" 1
1680 1 80 LYS HA 1 80 LYS HB2 2.600 . 3.400 2.657 2.410 3.018 . 0 0 "[ . 1]" 1
1681 1 80 LYS HA 1 80 LYS HB3 2.500 . 3.300 2.884 2.419 3.025 . 0 0 "[ . 1]" 1
1682 1 80 LYS HA 1 80 LYS HG2 2.900 . 4.000 3.275 2.252 3.834 . 0 0 "[ . 1]" 1
1683 1 80 LYS HA 1 80 LYS HG3 3.200 . 4.500 3.153 2.191 3.741 . 0 0 "[ . 1]" 1
1684 1 80 LYS HA 1 81 VAL H 3.500 . 5.000 3.535 3.475 3.556 . 0 0 "[ . 1]" 1
1685 1 80 LYS HA 1 82 LYS H 3.600 . 5.300 4.359 4.102 4.746 . 0 0 "[ . 1]" 1
1686 1 80 LYS HA 1 83 LEU H 3.000 . 4.200 3.379 2.981 3.723 . 0 0 "[ . 1]" 1
1687 1 80 LYS HA 1 83 LEU HB2 2.900 . 3.900 2.714 2.372 3.003 . 0 0 "[ . 1]" 1
1688 1 80 LYS HA 1 83 LEU HB3 4.200 . 6.000 4.353 3.989 4.694 . 0 0 "[ . 1]" 1
1689 1 80 LYS HA 1 83 LEU QD 2.400 . 6.000 2.797 2.142 3.313 . 0 0 "[ . 1]" 1
1690 1 80 LYS HB2 1 80 LYS HE3 4.000 . 6.000 3.828 2.767 4.967 . 0 0 "[ . 1]" 1
1691 1 80 LYS HB2 1 80 LYS HG3 2.900 . 3.900 2.714 2.264 3.015 . 0 0 "[ . 1]" 1
1692 1 80 LYS HB2 1 81 VAL H 3.000 . 4.100 3.484 2.733 3.886 . 0 0 "[ . 1]" 1
1693 1 80 LYS HB3 1 81 VAL H 2.700 . 3.600 2.854 2.464 3.862 0.262 1 0 "[ . 1]" 1
1694 1 80 LYS HD2 1 81 VAL H 3.200 . 6.000 5.276 4.022 6.029 0.029 5 0 "[ . 1]" 1
1695 1 80 LYS HD3 1 80 LYS HG3 2.400 . 3.100 2.615 2.419 3.012 . 0 0 "[ . 1]" 1
1696 1 80 LYS HD3 1 83 LEU QD 2.400 . 6.000 4.284 2.069 6.289 0.289 4 0 "[ . 1]" 1
1697 1 80 LYS HE2 1 80 LYS HG3 3.500 . 5.100 2.930 2.291 3.807 . 0 0 "[ . 1]" 1
1698 1 80 LYS HE2 1 81 VAL H 3.600 . 6.000 5.407 4.342 6.026 0.026 1 0 "[ . 1]" 1
1699 1 80 LYS HG2 1 81 VAL H 4.600 . 6.000 4.581 3.867 5.432 . 0 0 "[ . 1]" 1
1700 1 80 LYS HG3 1 81 VAL H 4.300 . 6.000 4.432 3.412 5.183 . 0 0 "[ . 1]" 1
1701 1 81 VAL H 1 81 VAL HA 2.700 . 3.600 2.814 2.766 2.868 . 0 0 "[ . 1]" 1
1702 1 81 VAL H 1 81 VAL HB 2.400 . 3.100 2.444 2.222 2.834 . 0 0 "[ . 1]" 1
1703 1 81 VAL H 1 81 VAL QG 2.600 . 3.500 2.264 1.863 2.801 . 0 0 "[ . 1]" 1
1704 1 81 VAL H 1 82 LYS H 2.700 . 3.600 2.688 2.476 2.863 . 0 0 "[ . 1]" 1
1705 1 81 VAL H 1 83 LEU H 4.300 . 6.000 4.150 3.872 4.320 . 0 0 "[ . 1]" 1
1706 1 81 VAL HA 1 81 VAL HB 2.800 . 3.800 2.943 2.549 3.025 . 0 0 "[ . 1]" 1
1707 1 81 VAL HA 1 81 VAL QG 2.300 . 3.000 2.132 2.096 2.210 . 0 0 "[ . 1]" 1
1708 1 81 VAL HA 1 82 LYS H 3.000 . 4.100 3.535 3.486 3.577 . 0 0 "[ . 1]" 1
1709 1 81 VAL HA 1 84 GLU H 3.200 . 4.500 3.323 2.995 3.570 . 0 0 "[ . 1]" 1
1710 1 81 VAL HA 1 84 GLU QB 2.800 . 3.800 2.454 2.118 2.767 . 0 0 "[ . 1]" 1
1711 1 81 VAL HA 1 86 HIS HB3 4.900 . 6.000 5.134 4.029 5.554 . 0 0 "[ . 1]" 1
1712 1 81 VAL HA 1 86 HIS HD2 3.100 . 4.300 3.726 2.817 4.413 0.113 7 0 "[ . 1]" 1
1713 1 81 VAL HB 1 81 VAL QG 2.200 . 2.800 1.895 1.891 1.899 . 0 0 "[ . 1]" 1
1714 1 81 VAL HB 1 86 HIS HB3 5.000 . 6.000 5.559 4.304 6.005 0.005 9 0 "[ . 1]" 1
1715 1 81 VAL QG 1 82 LYS H 2.700 . 5.600 2.971 2.243 3.394 . 0 0 "[ . 1]" 1
1716 1 81 VAL QG 1 82 LYS HA 2.700 . 6.000 3.313 3.079 4.215 . 0 0 "[ . 1]" 1
1717 1 81 VAL QG 1 83 LEU H 4.700 . 6.000 4.568 4.244 4.786 . 0 0 "[ . 1]" 1
1718 1 81 VAL QG 1 84 GLU H 4.600 . 6.000 4.206 3.989 4.394 . 0 0 "[ . 1]" 1
1719 1 81 VAL QG 1 84 GLU QB 3.900 . 5.800 3.250 2.705 3.616 . 0 0 "[ . 1]" 1
1720 1 81 VAL QG 1 84 GLU HG2 4.200 . 6.000 4.508 3.313 5.195 . 0 0 "[ . 1]" 1
1721 1 81 VAL QG 1 85 GLY H 5.700 . 6.000 4.635 4.346 4.879 . 0 0 "[ . 1]" 1
1722 1 81 VAL QG 1 86 HIS H 3.900 . 5.800 3.466 3.065 3.913 . 0 0 "[ . 1]" 1
1723 1 81 VAL QG 1 86 HIS HB2 2.800 . 6.000 1.980 1.655 3.409 . 0 0 "[ . 1]" 1
1724 1 81 VAL QG 1 86 HIS HB3 3.400 . 6.000 2.690 2.205 3.025 . 0 0 "[ . 1]" 1
1725 1 81 VAL QG 1 86 HIS HD2 3.500 . 6.000 3.173 1.922 4.067 . 0 0 "[ . 1]" 1
1726 1 81 VAL QG 1 87 GLU H 4.900 . 6.000 4.207 3.334 5.658 . 0 0 "[ . 1]" 1
1727 1 82 LYS H 1 82 LYS HA 2.900 . 3.900 2.824 2.796 2.842 . 0 0 "[ . 1]" 1
1728 1 82 LYS H 1 82 LYS QB 2.300 . 2.900 2.242 2.133 2.414 . 0 0 "[ . 1]" 1
1729 1 82 LYS H 1 82 LYS QD 4.700 . 6.000 3.938 3.270 4.607 . 0 0 "[ . 1]" 1
1730 1 82 LYS H 1 82 LYS HE2 5.900 . 6.000 5.743 4.234 6.686 0.686 5 1 "[ + 1]" 1
1731 1 82 LYS H 1 82 LYS HG2 3.800 . 5.600 3.793 2.364 4.623 . 0 0 "[ . 1]" 1
1732 1 82 LYS H 1 82 LYS HG3 4.800 . 6.000 4.223 3.791 4.524 . 0 0 "[ . 1]" 1
1733 1 82 LYS H 1 83 LEU H 2.300 . 2.900 2.642 2.575 2.745 . 0 0 "[ . 1]" 1
1734 1 82 LYS HA 1 82 LYS QB 2.500 . 3.300 2.405 2.298 2.488 . 0 0 "[ . 1]" 1
1735 1 82 LYS HA 1 82 LYS QD 2.400 . 3.100 1.942 1.664 2.352 0.336 2 0 "[ . 1]" 1
1736 1 82 LYS HA 1 82 LYS HG2 3.800 . 5.600 3.404 2.698 3.895 . 0 0 "[ . 1]" 1
1737 1 82 LYS HA 1 82 LYS HG3 3.300 . 4.700 3.305 2.843 3.720 . 0 0 "[ . 1]" 1
1738 1 82 LYS HA 1 83 LEU H 3.600 . 5.200 3.541 3.521 3.558 . 0 0 "[ . 1]" 1
1739 1 82 LYS HA 1 84 GLU H 4.200 . 6.000 4.060 3.887 4.205 . 0 0 "[ . 1]" 1
1740 1 82 LYS HA 1 85 GLY H 3.400 . 4.900 3.598 3.211 3.921 . 0 0 "[ . 1]" 1
1741 1 82 LYS HA 1 86 HIS H 3.000 . 4.100 3.067 2.807 3.324 . 0 0 "[ . 1]" 1
1742 1 82 LYS QB 1 82 LYS HG3 3.000 . 4.100 2.265 2.157 2.373 . 0 0 "[ . 1]" 1
1743 1 82 LYS QB 1 83 LEU H 3.500 . 4.800 2.559 2.441 2.832 . 0 0 "[ . 1]" 1
1744 1 82 LYS QB 1 84 GLU H 3.600 . 6.000 4.469 4.369 4.618 . 0 0 "[ . 1]" 1
1745 1 82 LYS QD 1 82 LYS HE2 2.700 . 3.600 2.267 2.157 2.347 . 0 0 "[ . 1]" 1
1746 1 82 LYS QD 1 82 LYS HG2 3.000 . 4.100 2.295 2.170 2.480 . 0 0 "[ . 1]" 1
1747 1 82 LYS QD 1 82 LYS HG3 3.100 . 4.300 2.321 2.174 2.436 . 0 0 "[ . 1]" 1
1748 1 82 LYS QD 1 88 LEU H 3.700 . 5.400 3.790 2.663 5.108 . 0 0 "[ . 1]" 1
1749 1 82 LYS QD 1 88 LEU MD2 3.700 . 5.400 2.867 1.975 4.387 0.025 1 0 "[ . 1]" 1
1750 1 82 LYS HE2 1 87 GLU HA 3.900 . 5.800 3.827 2.399 4.986 . 0 0 "[ . 1]" 1
1751 1 82 LYS HE2 1 88 LEU MD1 3.900 . 5.800 4.776 3.261 5.927 0.127 9 0 "[ . 1]" 1
1752 1 83 LEU H 1 83 LEU HA 2.800 . 3.800 2.849 2.830 2.880 . 0 0 "[ . 1]" 1
1753 1 83 LEU H 1 83 LEU HB2 2.300 . 3.000 2.467 2.415 2.526 . 0 0 "[ . 1]" 1
1754 1 83 LEU H 1 83 LEU HB3 3.200 . 4.500 3.596 3.582 3.607 . 0 0 "[ . 1]" 1
1755 1 83 LEU H 1 83 LEU QD 3.600 . 4.700 3.091 2.987 3.167 . 0 0 "[ . 1]" 1
1756 1 83 LEU H 1 83 LEU HG 2.300 . 3.000 2.347 2.238 2.439 . 0 0 "[ . 1]" 1
1757 1 83 LEU H 1 84 GLU H 2.500 . 3.300 2.520 2.462 2.571 . 0 0 "[ . 1]" 1
1758 1 83 LEU H 1 84 GLU HA 5.100 . 6.000 5.148 5.085 5.209 . 0 0 "[ . 1]" 1
1759 1 83 LEU H 1 85 GLY H 4.300 . 6.000 3.964 3.828 4.068 . 0 0 "[ . 1]" 1
1760 1 83 LEU H 1 86 HIS H 3.500 . 5.000 5.021 4.838 5.128 0.128 6 0 "[ . 1]" 1
1761 1 83 LEU HA 1 83 LEU HB3 2.700 . 3.600 2.478 2.454 2.503 . 0 0 "[ . 1]" 1
1762 1 83 LEU HA 1 83 LEU QD 3.600 . 5.200 2.000 1.964 2.077 0.036 4 0 "[ . 1]" 1
1763 1 83 LEU HA 1 83 LEU HG 3.300 . 4.700 3.111 3.027 3.216 . 0 0 "[ . 1]" 1
1764 1 83 LEU HA 1 84 GLU H 3.200 . 4.500 3.443 3.392 3.485 . 0 0 "[ . 1]" 1
1765 1 83 LEU HB2 1 83 LEU QD 3.100 . 4.300 2.273 2.227 2.304 . 0 0 "[ . 1]" 1
1766 1 83 LEU HB2 1 84 GLU H 3.200 . 4.400 2.989 2.773 3.169 . 0 0 "[ . 1]" 1
1767 1 83 LEU HB3 1 83 LEU QD 2.400 . 3.100 2.113 2.100 2.127 . 0 0 "[ . 1]" 1
1768 1 83 LEU HB3 1 84 GLU H 3.800 . 5.600 3.920 3.765 4.080 . 0 0 "[ . 1]" 1
1769 1 83 LEU HB3 1 85 GLY H 3.600 . 5.200 5.114 4.894 5.263 0.063 6 0 "[ . 1]" 1
1770 1 83 LEU QD 1 83 LEU HG 2.200 . 2.800 1.895 1.894 1.898 . 0 0 "[ . 1]" 1
1771 1 83 LEU QD 1 84 GLU H 2.500 . 6.000 4.220 4.139 4.289 . 0 0 "[ . 1]" 1
1772 1 83 LEU QD 1 85 GLY H 3.400 . 6.000 4.870 4.635 5.080 . 0 0 "[ . 1]" 1
1773 1 83 LEU HG 1 84 GLU H 4.800 . 6.000 4.461 4.331 4.570 . 0 0 "[ . 1]" 1
1774 1 84 GLU H 1 84 GLU HA 2.600 . 3.500 2.859 2.813 2.892 . 0 0 "[ . 1]" 1
1775 1 84 GLU H 1 84 GLU QB 2.300 . 3.000 2.271 2.200 2.447 . 0 0 "[ . 1]" 1
1776 1 84 GLU H 1 84 GLU HG2 3.700 . 5.400 4.063 2.184 4.647 . 0 0 "[ . 1]" 1
1777 1 84 GLU H 1 84 GLU HG3 3.900 . 5.800 4.121 2.511 4.533 . 0 0 "[ . 1]" 1
1778 1 84 GLU H 1 86 HIS HD2 4.900 . 6.000 4.419 3.782 5.940 . 0 0 "[ . 1]" 1
1779 1 84 GLU HA 1 84 GLU QB 2.400 . 3.100 2.423 2.370 2.508 . 0 0 "[ . 1]" 1
1780 1 84 GLU HA 1 84 GLU HG2 3.400 . 4.800 3.209 2.481 3.768 . 0 0 "[ . 1]" 1
1781 1 84 GLU HA 1 84 GLU HG3 2.900 . 3.900 2.958 2.490 3.802 . 0 0 "[ . 1]" 1
1782 1 84 GLU HA 1 85 GLY HA3 4.400 . 6.000 4.463 4.357 4.540 . 0 0 "[ . 1]" 1
1783 1 84 GLU QB 1 85 GLY H 3.800 . 5.600 3.124 2.868 3.442 . 0 0 "[ . 1]" 1
1784 1 84 GLU QB 1 86 HIS H 4.300 . 6.000 3.262 2.814 3.889 . 0 0 "[ . 1]" 1
1785 1 84 GLU QB 1 86 HIS HD2 3.200 . 4.500 2.211 1.493 4.605 0.407 4 0 "[ . 1]" 1
1786 1 85 GLY H 1 85 GLY HA2 2.400 . 3.100 2.371 2.331 2.412 . 0 0 "[ . 1]" 1
1787 1 85 GLY H 1 85 GLY HA3 2.900 . 3.900 2.930 2.901 2.945 . 0 0 "[ . 1]" 1
1788 1 85 GLY H 1 86 HIS H 2.600 . 3.400 2.227 2.073 2.385 . 0 0 "[ . 1]" 1
1789 1 85 GLY H 1 86 HIS HB2 5.500 . 6.000 4.615 4.420 5.052 . 0 0 "[ . 1]" 1
1790 1 85 GLY H 1 86 HIS HB3 6.000 . 6.000 5.724 4.068 6.020 0.020 9 0 "[ . 1]" 1
1791 1 85 GLY H 1 86 HIS HD2 4.900 . 6.000 4.147 3.422 6.073 0.073 7 0 "[ . 1]" 1
1792 1 85 GLY HA2 1 86 HIS H 2.900 . 3.900 3.005 2.895 3.178 . 0 0 "[ . 1]" 1
1793 1 85 GLY HA3 1 86 HIS H 2.900 . 4.000 3.465 3.359 3.522 . 0 0 "[ . 1]" 1
1794 1 86 HIS H 1 86 HIS HB2 2.700 . 3.600 2.665 2.439 3.330 . 0 0 "[ . 1]" 1
1795 1 86 HIS H 1 86 HIS HB3 3.300 . 4.700 3.600 2.404 3.827 . 0 0 "[ . 1]" 1
1796 1 86 HIS H 1 86 HIS HD2 3.200 . 4.500 3.159 2.246 4.450 . 0 0 "[ . 1]" 1
1797 1 86 HIS H 1 87 GLU H 4.700 . 6.000 4.475 4.262 4.609 . 0 0 "[ . 1]" 1
1798 1 86 HIS HA 1 86 HIS HB2 2.800 . 3.800 2.953 2.300 3.031 . 0 0 "[ . 1]" 1
1799 1 86 HIS HA 1 86 HIS HB3 2.600 . 3.500 2.535 2.393 2.984 . 0 0 "[ . 1]" 1
1800 1 86 HIS HA 1 87 GLU H 2.500 . 3.300 2.395 2.098 2.651 . 0 0 "[ . 1]" 1
1801 1 86 HIS HB2 1 86 HIS HD2 3.500 . 5.100 2.978 2.703 3.803 . 0 0 "[ . 1]" 1
1802 1 86 HIS HB2 1 87 GLU H 3.700 . 5.400 3.637 3.241 4.047 . 0 0 "[ . 1]" 1
1803 1 86 HIS HB3 1 86 HIS HD2 3.600 . 5.200 3.785 2.708 3.965 . 0 0 "[ . 1]" 1
1804 1 86 HIS HB3 1 87 GLU H 3.000 . 4.100 2.634 2.042 4.440 0.340 7 0 "[ . 1]" 1
1805 1 87 GLU H 1 87 GLU HA 3.000 . 4.100 2.935 2.889 2.950 . 0 0 "[ . 1]" 1
1806 1 87 GLU H 1 87 GLU HB3 2.900 . 3.900 3.001 2.497 3.771 . 0 0 "[ . 1]" 1
1807 1 87 GLU H 1 87 GLU HG2 3.800 . 5.600 3.998 2.130 4.928 . 0 0 "[ . 1]" 1
1808 1 87 GLU H 1 87 GLU HG3 3.700 . 5.400 4.100 2.868 4.601 . 0 0 "[ . 1]" 1
1809 1 87 GLU HA 1 87 GLU HB2 2.900 . 3.900 2.657 2.462 3.027 . 0 0 "[ . 1]" 1
1810 1 87 GLU HA 1 87 GLU HB3 2.800 . 3.800 2.805 2.380 3.029 . 0 0 "[ . 1]" 1
1811 1 87 GLU HA 1 87 GLU HG2 3.700 . 5.400 3.386 2.436 3.762 . 0 0 "[ . 1]" 1
1812 1 87 GLU HA 1 87 GLU HG3 3.300 . 4.700 3.254 2.506 3.795 . 0 0 "[ . 1]" 1
1813 1 87 GLU HA 1 88 LEU H 2.300 . 3.000 2.272 2.121 2.437 . 0 0 "[ . 1]" 1
1814 1 87 GLU HB2 1 87 GLU HG2 3.000 . 4.100 2.596 2.386 3.012 . 0 0 "[ . 1]" 1
1815 1 87 GLU HB2 1 87 GLU HG3 2.200 . 2.800 2.710 2.296 3.014 0.214 5 0 "[ . 1]" 1
1816 1 87 GLU HB3 1 87 GLU HG2 2.700 . 3.600 2.566 2.414 3.012 . 0 0 "[ . 1]" 1
1817 1 87 GLU HG2 1 88 LEU H 4.400 . 6.000 4.135 2.212 5.037 . 0 0 "[ . 1]" 1
1818 1 87 GLU HG3 1 88 LEU H 4.300 . 6.000 3.464 2.259 5.382 . 0 0 "[ . 1]" 1
1819 1 88 LEU H 1 88 LEU HB2 3.700 . 5.400 3.699 3.618 3.807 . 0 0 "[ . 1]" 1
1820 1 88 LEU H 1 88 LEU HB3 3.300 . 4.600 3.091 2.764 3.255 . 0 0 "[ . 1]" 1
1821 1 88 LEU H 1 88 LEU MD1 3.900 . 5.800 3.517 2.884 4.091 . 0 0 "[ . 1]" 1
1822 1 88 LEU H 1 88 LEU HG 2.300 . 3.000 2.323 1.765 2.975 . 0 0 "[ . 1]" 1
1823 1 88 LEU H 1 89 PRO HD2 6.000 . 6.000 5.136 4.841 5.413 . 0 0 "[ . 1]" 1
1824 1 88 LEU H 1 89 PRO HD3 5.700 . 6.000 4.673 4.481 4.921 . 0 0 "[ . 1]" 1
1825 1 88 LEU HA 1 88 LEU HB2 2.700 . 3.600 2.499 2.411 2.558 . 0 0 "[ . 1]" 1
1826 1 88 LEU HA 1 88 LEU HB3 2.900 . 3.900 2.379 2.321 2.464 . 0 0 "[ . 1]" 1
1827 1 88 LEU HA 1 88 LEU MD1 3.300 . 4.600 3.912 3.697 4.113 . 0 0 "[ . 1]" 1
1828 1 88 LEU HA 1 88 LEU HG 3.700 . 5.400 3.684 3.609 3.755 . 0 0 "[ . 1]" 1
1829 1 88 LEU HA 1 89 PRO HD2 2.800 . 3.800 2.600 2.173 2.949 . 0 0 "[ . 1]" 1
1830 1 88 LEU HA 1 89 PRO HD3 2.200 . 2.800 1.987 1.726 2.242 . 0 0 "[ . 1]" 1
1831 1 88 LEU HA 1 89 PRO HG2 4.900 . 6.000 4.412 4.328 4.527 . 0 0 "[ . 1]" 1
1832 1 88 LEU HA 1 89 PRO HG3 5.000 . 6.000 4.100 3.760 4.438 . 0 0 "[ . 1]" 1
1833 1 88 LEU HB2 1 88 LEU MD2 3.000 . 4.100 2.883 2.558 3.184 . 0 0 "[ . 1]" 1
1834 1 88 LEU HB2 1 89 PRO HD2 2.900 . 4.000 2.703 2.417 2.970 . 0 0 "[ . 1]" 1
1835 1 88 LEU HB2 1 89 PRO HD3 3.800 . 5.600 3.548 3.189 3.974 . 0 0 "[ . 1]" 1
1836 1 88 LEU HB3 1 88 LEU MD1 3.000 . 4.100 2.862 2.522 3.183 . 0 0 "[ . 1]" 1
1837 1 88 LEU HB3 1 88 LEU MD2 2.300 . 2.900 2.204 2.134 2.272 . 0 0 "[ . 1]" 1
1838 1 88 LEU HB3 1 89 PRO HD2 3.900 . 5.800 3.798 3.374 4.254 . 0 0 "[ . 1]" 1
1839 1 88 LEU HB3 1 89 PRO HD3 4.500 . 6.000 4.057 3.564 4.476 . 0 0 "[ . 1]" 1
1840 1 88 LEU MD1 1 88 LEU HG 2.000 . 2.500 2.128 2.122 2.132 . 0 0 "[ . 1]" 1
1841 1 88 LEU MD1 1 89 PRO HD2 3.400 . 4.900 4.151 3.859 4.447 . 0 0 "[ . 1]" 1
1842 1 88 LEU MD1 1 89 PRO HD3 3.800 . 5.600 4.893 4.471 5.442 . 0 0 "[ . 1]" 1
1843 1 88 LEU MD2 1 88 LEU HG 2.200 . 2.800 2.128 2.118 2.135 . 0 0 "[ . 1]" 1
1844 1 88 LEU HG 1 89 PRO HD3 5.500 . 6.000 5.268 4.890 5.671 . 0 0 "[ . 1]" 1
1845 1 89 PRO HA 1 89 PRO HB3 2.400 . 3.100 2.280 2.256 2.302 . 0 0 "[ . 1]" 1
1846 1 89 PRO HA 1 90 ALA H 2.600 . 3.400 3.331 3.208 3.425 0.025 5 0 "[ . 1]" 1
1847 1 89 PRO HA 1 90 ALA MB 3.400 . 4.900 4.007 3.904 4.115 . 0 0 "[ . 1]" 1
1848 1 89 PRO HA 1 91 ASP H 4.100 . 6.000 4.314 4.100 4.563 . 0 0 "[ . 1]" 1
1849 1 89 PRO HB2 1 89 PRO HD2 3.600 . 5.200 3.522 3.007 4.041 . 0 0 "[ . 1]" 1
1850 1 89 PRO HB2 1 90 ALA H 2.800 . 3.800 3.706 3.297 3.930 0.130 9 0 "[ . 1]" 1
1851 1 89 PRO HB2 1 90 ALA HA 4.500 . 6.000 5.183 4.883 5.406 . 0 0 "[ . 1]" 1
1852 1 89 PRO HB2 1 90 ALA MB 3.700 . 6.000 4.516 4.423 4.595 . 0 0 "[ . 1]" 1
1853 1 89 PRO HB2 1 93 PRO HD3 3.400 . 6.000 5.071 3.968 6.062 0.062 9 0 "[ . 1]" 1
1854 1 89 PRO HB3 1 89 PRO HD3 3.700 . 5.400 3.522 2.979 4.034 . 0 0 "[ . 1]" 1
1855 1 89 PRO HB3 1 89 PRO HG3 2.400 . 3.100 2.309 2.288 2.335 . 0 0 "[ . 1]" 1
1856 1 89 PRO HD2 1 89 PRO HG2 2.300 . 3.000 2.310 2.281 2.325 . 0 0 "[ . 1]" 1
1857 1 89 PRO HD2 1 96 LEU MD1 3.200 . 6.000 5.166 3.622 6.630 0.630 2 1 "[ + . 1]" 1
1858 1 89 PRO HD3 1 89 PRO HG3 2.600 . 3.400 2.308 2.286 2.322 . 0 0 "[ . 1]" 1
1859 1 89 PRO HG2 1 90 ALA H 4.200 . 6.000 3.801 2.813 4.767 . 0 0 "[ . 1]" 1
1860 1 89 PRO HG2 1 91 ASP H 3.700 . 5.400 3.121 2.098 4.271 . 0 0 "[ . 1]" 1
1861 1 90 ALA H 1 90 ALA HA 2.500 . 3.300 2.267 2.259 2.273 . 0 0 "[ . 1]" 1
1862 1 90 ALA H 1 90 ALA MB 2.600 . 3.500 2.898 2.847 2.943 . 0 0 "[ . 1]" 1
1863 1 90 ALA H 1 91 ASP H 2.500 . 3.300 2.607 2.520 2.701 . 0 0 "[ . 1]" 1
1864 1 90 ALA HA 1 90 ALA MB 2.200 . 2.800 2.128 2.119 2.135 . 0 0 "[ . 1]" 1
1865 1 90 ALA HA 1 91 ASP H 3.000 . 4.200 3.015 2.907 3.066 . 0 0 "[ . 1]" 1
1866 1 90 ALA MB 1 91 ASP H 2.900 . 6.000 3.543 3.499 3.628 . 0 0 "[ . 1]" 1
1867 1 90 ALA MB 1 91 ASP HB2 3.300 . 6.000 4.550 4.115 5.305 . 0 0 "[ . 1]" 1
1868 1 90 ALA MB 1 91 ASP HB3 3.000 . 6.000 5.396 5.037 5.799 . 0 0 "[ . 1]" 1
1869 1 91 ASP H 1 91 ASP HA 2.800 . 3.800 2.937 2.928 2.946 . 0 0 "[ . 1]" 1
1870 1 91 ASP H 1 91 ASP HB2 3.000 . 4.100 2.834 2.472 3.192 . 0 0 "[ . 1]" 1
1871 1 91 ASP H 1 91 ASP HB3 2.700 . 3.600 3.157 2.557 3.744 0.144 4 0 "[ . 1]" 1
1872 1 91 ASP H 1 92 LEU H 4.500 . 6.000 4.442 4.381 4.521 . 0 0 "[ . 1]" 1
1873 1 91 ASP HA 1 91 ASP HB2 2.700 . 3.600 2.736 2.460 3.033 . 0 0 "[ . 1]" 1
1874 1 91 ASP HA 1 91 ASP HB3 2.800 . 3.800 2.838 2.466 3.036 . 0 0 "[ . 1]" 1
1875 1 91 ASP HA 1 92 LEU H 2.600 . 3.400 2.426 2.258 2.590 . 0 0 "[ . 1]" 1
1876 1 91 ASP HA 1 92 LEU HB2 4.900 . 6.000 4.386 4.089 4.619 . 0 0 "[ . 1]" 1
1877 1 91 ASP HB2 1 92 LEU H 3.500 . 5.100 3.858 3.518 4.149 . 0 0 "[ . 1]" 1
1878 1 91 ASP HB3 1 92 LEU H 3.000 . 4.100 3.091 2.126 3.938 . 0 0 "[ . 1]" 1
1879 1 91 ASP HB3 1 93 PRO HD2 3.100 . 6.000 5.268 4.622 5.709 . 0 0 "[ . 1]" 1
1880 1 92 LEU H 1 92 LEU HA 2.900 . 4.000 2.943 2.936 2.953 . 0 0 "[ . 1]" 1
1881 1 92 LEU H 1 92 LEU HB3 2.800 . 3.800 3.268 2.546 3.702 . 0 0 "[ . 1]" 1
1882 1 92 LEU H 1 92 LEU MD1 4.100 . 6.000 4.158 3.931 4.436 . 0 0 "[ . 1]" 1
1883 1 92 LEU H 1 92 LEU MD2 3.800 . 5.600 4.037 3.662 4.472 . 0 0 "[ . 1]" 1
1884 1 92 LEU H 1 92 LEU HG 3.900 . 5.800 3.651 2.823 4.570 . 0 0 "[ . 1]" 1
1885 1 92 LEU H 1 93 PRO HD3 4.200 . 6.000 4.014 3.766 4.231 . 0 0 "[ . 1]" 1
1886 1 92 LEU HA 1 92 LEU HB3 2.500 . 3.300 2.721 2.473 3.020 . 0 0 "[ . 1]" 1
1887 1 92 LEU HA 1 92 LEU MD1 2.900 . 3.900 3.269 2.010 3.851 . 0 0 "[ . 1]" 1
1888 1 92 LEU HA 1 92 LEU MD2 2.800 . 6.000 2.594 1.780 3.882 . 0 0 "[ . 1]" 1
1889 1 92 LEU HA 1 92 LEU HG 3.200 . 4.500 2.976 2.394 3.136 . 0 0 "[ . 1]" 1
1890 1 92 LEU HA 1 93 PRO HD3 2.600 . 3.500 2.585 2.099 2.974 . 0 0 "[ . 1]" 1
1891 1 92 LEU HB2 1 92 LEU MD2 2.800 . 3.800 2.955 2.384 3.200 . 0 0 "[ . 1]" 1
1892 1 92 LEU HB2 1 93 PRO HD3 4.900 . 6.000 5.053 4.795 5.245 . 0 0 "[ . 1]" 1
1893 1 92 LEU MD1 1 92 LEU HG 2.200 . 2.800 2.125 2.117 2.129 . 0 0 "[ . 1]" 1
1894 1 92 LEU MD1 1 97 VAL H 4.200 . 6.000 5.060 3.612 5.820 . 0 0 "[ . 1]" 1
1895 1 92 LEU MD1 1 97 VAL HA 2.900 . 6.000 3.715 2.932 4.314 . 0 0 "[ . 1]" 1
1896 1 92 LEU MD2 1 92 LEU HG 2.200 . 2.800 2.128 2.125 2.131 . 0 0 "[ . 1]" 1
1897 1 92 LEU MD2 1 93 PRO HD2 4.100 . 6.000 3.661 2.972 5.188 . 0 0 "[ . 1]" 1
1898 1 92 LEU MD2 1 93 PRO HD3 4.100 . 6.000 4.519 3.281 6.094 0.094 5 0 "[ . 1]" 1
1899 1 92 LEU MD2 1 97 VAL HA 3.200 . 6.000 3.686 2.477 4.870 . 0 0 "[ . 1]" 1
1900 1 93 PRO HA 1 93 PRO HB3 2.700 . 3.600 2.296 2.271 2.314 . 0 0 "[ . 1]" 1
1901 1 93 PRO HA 1 93 PRO HG2 4.000 . 6.000 3.892 3.853 4.037 . 0 0 "[ . 1]" 1
1902 1 93 PRO HA 1 94 PRO HD2 2.500 . 3.300 2.501 2.223 2.863 . 0 0 "[ . 1]" 1
1903 1 93 PRO HA 1 94 PRO HG2 5.100 . 6.000 4.491 4.396 4.639 . 0 0 "[ . 1]" 1
1904 1 93 PRO HB2 1 93 PRO HD2 3.800 . 5.600 3.823 3.003 4.061 . 0 0 "[ . 1]" 1
1905 1 93 PRO HB2 1 94 PRO HD3 3.600 . 5.200 3.913 3.392 4.553 . 0 0 "[ . 1]" 1
1906 1 93 PRO HB2 1 95 HIS HE1 3.400 . 4.900 3.464 3.239 3.830 . 0 0 "[ . 1]" 1
1907 1 93 PRO HB2 1 96 LEU MD1 4.600 . 6.000 4.438 3.013 5.031 . 0 0 "[ . 1]" 1
1908 1 93 PRO HB3 1 93 PRO HD2 4.100 . 6.000 3.892 3.868 3.931 . 0 0 "[ . 1]" 1
1909 1 93 PRO HB3 1 93 PRO HD3 3.400 . 4.900 3.220 2.916 4.034 . 0 0 "[ . 1]" 1
1910 1 93 PRO HB3 1 94 PRO HD3 3.500 . 5.100 3.873 3.584 4.204 . 0 0 "[ . 1]" 1
1911 1 93 PRO HB3 1 95 HIS HE1 3.300 . 4.700 3.946 3.325 4.390 . 0 0 "[ . 1]" 1
1912 1 93 PRO HD2 1 93 PRO HG2 2.400 . 3.100 2.302 2.286 2.320 . 0 0 "[ . 1]" 1
1913 1 93 PRO HD2 1 96 LEU HB3 3.800 . 5.600 3.469 2.429 4.700 . 0 0 "[ . 1]" 1
1914 1 93 PRO HD2 1 96 LEU MD1 2.600 . 3.500 2.560 1.838 4.215 0.715 2 2 "[ + -. 1]" 1
1915 1 93 PRO HD2 1 96 LEU MD2 4.200 . 6.000 3.804 1.884 4.958 0.116 4 0 "[ . 1]" 1
1916 1 93 PRO HD3 1 93 PRO HG3 2.600 . 3.400 2.303 2.285 2.328 . 0 0 "[ . 1]" 1
1917 1 93 PRO HD3 1 96 LEU H 5.400 . 6.000 5.773 5.461 6.385 0.385 5 0 "[ . 1]" 1
1918 1 93 PRO HD3 1 96 LEU HB3 5.700 . 6.000 5.136 3.945 6.348 0.348 5 0 "[ . 1]" 1
1919 1 93 PRO HD3 1 96 LEU MD1 3.600 . 5.200 3.726 2.789 5.298 0.098 4 0 "[ . 1]" 1
1920 1 93 PRO HD3 1 96 LEU MD2 2.900 . 6.000 5.008 3.150 6.015 0.015 5 0 "[ . 1]" 1
1921 1 93 PRO HD3 1 96 LEU HG 4.500 . 6.000 4.853 3.556 5.899 . 0 0 "[ . 1]" 1
1922 1 93 PRO HG2 1 95 HIS HE1 3.800 . 5.600 4.314 3.452 5.233 . 0 0 "[ . 1]" 1
1923 1 93 PRO HG2 1 96 LEU MD1 2.700 . 3.600 2.775 1.868 4.449 0.849 6 1 "[ .+ 1]" 1
1924 1 93 PRO HG2 1 96 LEU MD2 3.700 . 5.400 3.458 2.205 4.491 . 0 0 "[ . 1]" 1
1925 1 93 PRO HG2 1 96 LEU HG 3.000 . 4.100 2.759 1.915 4.027 . 0 0 "[ . 1]" 1
1926 1 93 PRO HG3 1 95 HIS HE1 3.500 . 5.000 4.183 3.196 4.733 . 0 0 "[ . 1]" 1
1927 1 94 PRO HA 1 94 PRO HB3 2.500 . 3.300 2.285 2.258 2.311 . 0 0 "[ . 1]" 1
1928 1 94 PRO HA 1 94 PRO HD3 2.700 . 3.600 3.485 3.300 3.620 0.020 9 0 "[ . 1]" 1
1929 1 94 PRO HA 1 94 PRO HG2 4.200 . 6.000 3.875 3.846 3.894 . 0 0 "[ . 1]" 1
1930 1 94 PRO HA 1 94 PRO HG3 4.200 . 6.000 3.432 2.861 4.009 . 0 0 "[ . 1]" 1
1931 1 94 PRO HA 1 95 HIS H 3.900 . 5.800 3.532 3.322 3.581 . 0 0 "[ . 1]" 1
1932 1 94 PRO HA 1 96 LEU H 4.000 . 6.000 3.734 3.654 3.799 . 0 0 "[ . 1]" 1
1933 1 94 PRO HA 1 97 VAL H 3.800 . 5.600 3.821 3.318 4.158 . 0 0 "[ . 1]" 1
1934 1 94 PRO HA 1 97 VAL MG2 2.600 . 3.400 2.475 1.925 3.030 . 0 0 "[ . 1]" 1
1935 1 94 PRO HB2 1 94 PRO HD2 4.000 . 6.000 3.515 2.950 4.057 . 0 0 "[ . 1]" 1
1936 1 94 PRO HB2 1 95 HIS H 3.800 . 5.600 3.038 2.611 3.962 . 0 0 "[ . 1]" 1
1937 1 94 PRO HB2 1 97 VAL MG2 5.000 . 6.000 4.641 4.181 5.002 . 0 0 "[ . 1]" 1
1938 1 94 PRO HB3 1 94 PRO HD3 3.000 . 4.100 3.502 2.935 4.050 . 0 0 "[ . 1]" 1
1939 1 94 PRO HB3 1 95 HIS H 4.200 . 6.000 4.153 3.962 4.554 . 0 0 "[ . 1]" 1
1940 1 94 PRO HD2 1 94 PRO HG2 2.500 . 6.000 2.310 2.292 2.324 . 0 0 "[ . 1]" 1
1941 1 94 PRO HD2 1 95 HIS H 3.600 . 5.200 3.128 3.001 3.261 . 0 0 "[ . 1]" 1
1942 1 94 PRO HD3 1 94 PRO HG3 2.400 . 3.100 2.310 2.291 2.327 . 0 0 "[ . 1]" 1
1943 1 94 PRO HG2 1 95 HIS H 3.700 . 5.400 3.530 2.602 4.355 . 0 0 "[ . 1]" 1
1944 1 94 PRO HG3 1 97 VAL MG2 4.600 . 6.000 5.216 4.260 6.232 0.232 3 0 "[ . 1]" 1
1945 1 95 HIS H 1 95 HIS HB2 4.300 . 6.000 3.688 3.652 3.822 . 0 0 "[ . 1]" 1
1946 1 95 HIS H 1 95 HIS HB3 2.600 . 3.400 2.753 2.629 2.931 . 0 0 "[ . 1]" 1
1947 1 95 HIS H 1 95 HIS HD2 3.700 . 5.500 4.401 3.936 4.829 . 0 0 "[ . 1]" 1
1948 1 95 HIS H 1 96 LEU H 3.000 . 4.100 2.587 2.144 2.818 . 0 0 "[ . 1]" 1
1949 1 95 HIS H 1 96 LEU HB3 5.300 . 6.000 5.701 4.519 6.190 0.190 7 0 "[ . 1]" 1
1950 1 95 HIS HA 1 95 HIS HB2 2.500 . 3.300 2.426 2.371 2.479 . 0 0 "[ . 1]" 1
1951 1 95 HIS HA 1 95 HIS HB3 2.800 . 3.800 2.463 2.421 2.537 . 0 0 "[ . 1]" 1
1952 1 95 HIS HA 1 96 LEU H 3.000 . 4.100 3.205 3.136 3.263 . 0 0 "[ . 1]" 1
1953 1 95 HIS HB2 1 95 HIS HD2 2.800 . 3.800 2.898 2.779 3.084 . 0 0 "[ . 1]" 1
1954 1 95 HIS HB2 1 96 LEU H 4.500 . 6.000 4.420 4.340 4.498 . 0 0 "[ . 1]" 1
1955 1 95 HIS HD2 1 96 LEU MD1 4.100 . 6.000 4.103 3.309 4.859 . 0 0 "[ . 1]" 1
1956 1 95 HIS HD2 1 96 LEU MD2 3.200 . 4.500 3.142 2.348 4.773 0.273 4 0 "[ . 1]" 1
1957 1 95 HIS HD2 1 96 LEU HG 3.700 . 5.400 3.746 1.988 5.461 0.061 2 0 "[ . 1]" 1
1958 1 96 LEU H 1 96 LEU HB2 2.900 . 3.900 2.539 2.222 2.829 . 0 0 "[ . 1]" 1
1959 1 96 LEU H 1 96 LEU HB3 3.500 . 5.000 3.437 2.516 3.753 . 0 0 "[ . 1]" 1
1960 1 96 LEU H 1 96 LEU MD1 3.800 . 5.600 4.224 4.146 4.352 . 0 0 "[ . 1]" 1
1961 1 96 LEU H 1 96 LEU MD2 3.900 . 5.800 3.845 3.025 4.431 . 0 0 "[ . 1]" 1
1962 1 96 LEU H 1 96 LEU HG 3.200 . 4.500 3.606 3.119 4.468 . 0 0 "[ . 1]" 1
1963 1 96 LEU H 1 97 VAL H 2.300 . 3.000 2.079 1.970 2.195 . 0 0 "[ . 1]" 1
1964 1 96 LEU H 1 97 VAL HB 4.900 . 6.000 4.638 4.201 5.653 . 0 0 "[ . 1]" 1
1965 1 96 LEU H 1 97 VAL MG2 3.600 . 5.200 3.074 2.871 3.379 . 0 0 "[ . 1]" 1
1966 1 96 LEU HA 1 96 LEU HB2 3.000 . 4.100 2.896 2.474 3.012 . 0 0 "[ . 1]" 1
1967 1 96 LEU HA 1 96 LEU MD1 3.500 . 5.000 3.259 1.989 3.821 0.011 6 0 "[ . 1]" 1
1968 1 96 LEU HA 1 96 LEU MD2 2.300 . 3.000 2.288 1.775 3.880 0.880 2 2 "[ + -. 1]" 1
1969 1 96 LEU HA 1 96 LEU HG 3.100 . 4.300 3.088 2.810 3.640 . 0 0 "[ . 1]" 1
1970 1 96 LEU HB2 1 96 LEU MD1 2.600 . 3.400 2.464 2.273 3.195 . 0 0 "[ . 1]" 1
1971 1 96 LEU HB2 1 96 LEU MD2 3.100 . 4.300 2.969 2.387 3.203 . 0 0 "[ . 1]" 1
1972 1 96 LEU HB2 1 96 LEU HG 2.700 . 3.600 2.531 2.359 2.993 . 0 0 "[ . 1]" 1
1973 1 96 LEU HB3 1 96 LEU MD1 3.100 . 4.300 2.485 2.262 3.190 . 0 0 "[ . 1]" 1
1974 1 96 LEU HB3 1 96 LEU MD2 3.300 . 4.700 2.488 2.255 3.200 . 0 0 "[ . 1]" 1
1975 1 96 LEU HB3 1 96 LEU HG 3.000 . 4.200 2.855 2.431 3.020 . 0 0 "[ . 1]" 1
1976 1 96 LEU MD1 1 96 LEU MD2 2.400 . 6.000 2.083 2.077 2.089 . 0 0 "[ . 1]" 1
1977 1 96 LEU MD1 1 97 VAL H 3.500 . 6.000 5.156 4.690 5.435 . 0 0 "[ . 1]" 1
1978 1 96 LEU HG 1 97 VAL H 4.500 . 6.000 4.915 4.504 5.503 . 0 0 "[ . 1]" 1
1979 1 97 VAL H 1 97 VAL HA 2.900 . 3.900 2.889 2.864 2.926 . 0 0 "[ . 1]" 1
1980 1 97 VAL H 1 97 VAL HB 2.900 . 4.000 2.785 2.487 3.714 . 0 0 "[ . 1]" 1
1981 1 97 VAL H 1 97 VAL MG1 4.100 . 6.000 3.541 2.471 3.801 . 0 0 "[ . 1]" 1
1982 1 97 VAL H 1 97 VAL MG2 3.100 . 4.300 2.119 1.813 2.317 0.087 3 0 "[ . 1]" 1
1983 1 97 VAL H 1 98 PRO HD2 3.300 . 6.000 5.051 4.598 5.186 . 0 0 "[ . 1]" 1
1984 1 97 VAL H 1 98 PRO HD3 4.700 . 6.000 4.581 4.410 5.009 . 0 0 "[ . 1]" 1
1985 1 97 VAL HA 1 97 VAL MG1 2.500 . 3.300 2.363 2.241 2.425 . 0 0 "[ . 1]" 1
1986 1 97 VAL HA 1 97 VAL MG2 2.500 . 3.300 2.590 2.360 3.220 . 0 0 "[ . 1]" 1
1987 1 97 VAL HA 1 98 PRO HD2 2.600 . 3.400 2.323 1.790 2.478 0.010 4 0 "[ . 1]" 1
1988 1 97 VAL HA 1 98 PRO HD3 2.400 . 3.100 2.080 1.891 2.642 . 0 0 "[ . 1]" 1
1989 1 97 VAL HA 1 98 PRO HG3 5.000 . 6.000 4.219 4.100 4.408 . 0 0 "[ . 1]" 1
1990 1 97 VAL HA 1 101 LYS QD 5.100 . 6.000 5.575 5.173 5.876 . 0 0 "[ . 1]" 1
1991 1 97 VAL HB 1 97 VAL MG1 2.400 . 3.100 2.129 2.127 2.133 . 0 0 "[ . 1]" 1
1992 1 97 VAL HB 1 97 VAL MG2 2.200 . 2.800 2.130 2.126 2.136 . 0 0 "[ . 1]" 1
1993 1 97 VAL HB 1 102 ARG HB3 2.700 . 3.600 3.203 2.235 3.616 0.016 6 0 "[ . 1]" 1
1994 1 97 VAL MG1 1 98 PRO HD2 3.000 . 4.100 2.545 2.207 3.418 . 0 0 "[ . 1]" 1
1995 1 97 VAL MG1 1 98 PRO HD3 3.700 . 5.400 3.484 3.229 4.123 . 0 0 "[ . 1]" 1
1996 1 97 VAL MG1 1 101 LYS H 4.300 . 6.000 4.273 3.582 6.295 0.295 9 0 "[ . 1]" 1
1997 1 97 VAL MG1 1 102 ARG H 3.800 . 5.600 4.088 3.494 6.217 0.617 9 1 "[ . +1]" 1
1998 1 97 VAL MG1 1 102 ARG HA 2.900 . 4.000 2.764 2.090 4.516 0.516 9 1 "[ . +1]" 1
1999 1 97 VAL MG1 1 102 ARG HG2 3.600 . 6.000 4.566 3.911 6.400 0.400 9 0 "[ . 1]" 1
2000 1 97 VAL MG2 1 98 PRO HD2 4.100 . 6.000 3.945 3.601 4.533 . 0 0 "[ . 1]" 1
2001 1 97 VAL MG2 1 98 PRO HD3 4.400 . 6.000 4.214 3.827 4.682 . 0 0 "[ . 1]" 1
2002 1 98 PRO HA 1 98 PRO HB3 2.700 . 3.600 2.295 2.262 2.311 . 0 0 "[ . 1]" 1
2003 1 98 PRO HA 1 98 PRO HG3 3.800 . 5.600 3.161 2.931 3.989 . 0 0 "[ . 1]" 1
2004 1 98 PRO HA 1 99 PRO HD2 2.900 . 3.900 2.426 2.006 2.841 . 0 0 "[ . 1]" 1
2005 1 98 PRO HA 1 99 PRO HD3 2.900 . 3.900 2.109 1.844 2.467 0.056 10 0 "[ . 1]" 1
2006 1 98 PRO HB3 1 101 LYS H 4.900 . 6.000 4.319 4.083 4.590 . 0 0 "[ . 1]" 1
2007 1 98 PRO HD2 1 98 PRO HG2 2.700 . 3.600 2.308 2.299 2.315 . 0 0 "[ . 1]" 1
2008 1 98 PRO HD3 1 98 PRO HG3 2.700 . 3.600 2.307 2.296 2.322 . 0 0 "[ . 1]" 1
2009 1 98 PRO HG3 1 101 LYS H 4.700 . 6.000 5.538 4.473 5.940 . 0 0 "[ . 1]" 1
2010 1 99 PRO HA 1 99 PRO HB3 2.600 . 3.400 2.281 2.256 2.301 . 0 0 "[ . 1]" 1
2011 1 99 PRO HA 1 99 PRO HD2 4.400 . 6.000 3.980 3.919 4.077 . 0 0 "[ . 1]" 1
2012 1 99 PRO HA 1 99 PRO HG3 3.800 . 5.600 3.392 2.948 3.986 . 0 0 "[ . 1]" 1
2013 1 99 PRO HA 1 100 SER H 3.600 . 5.200 3.516 3.422 3.603 . 0 0 "[ . 1]" 1
2014 1 99 PRO HA 1 101 LYS H 4.500 . 6.000 3.928 3.816 4.072 . 0 0 "[ . 1]" 1
2015 1 99 PRO HA 1 102 ARG H 4.300 . 6.000 3.975 3.445 4.389 . 0 0 "[ . 1]" 1
2016 1 99 PRO HA 1 102 ARG HD2 3.700 . 5.400 3.511 2.359 4.342 . 0 0 "[ . 1]" 1
2017 1 99 PRO HA 1 102 ARG HD3 2.800 . 3.800 2.793 1.993 4.381 0.581 5 1 "[ + 1]" 1
2018 1 99 PRO HB2 1 100 SER H 3.100 . 4.300 2.990 2.278 3.622 . 0 0 "[ . 1]" 1
2019 1 99 PRO HB3 1 99 PRO HG3 2.500 . 6.000 2.315 2.304 2.324 . 0 0 "[ . 1]" 1
2020 1 99 PRO HB3 1 100 SER H 3.300 . 4.600 4.134 3.746 4.364 . 0 0 "[ . 1]" 1
2021 1 99 PRO HD2 1 100 SER H 3.200 . 4.500 2.923 2.565 3.285 . 0 0 "[ . 1]" 1
2022 1 99 PRO HD3 1 99 PRO HG3 2.700 . 3.600 2.315 2.304 2.327 . 0 0 "[ . 1]" 1
2023 1 99 PRO HG3 1 100 SER H 4.000 . 6.000 4.442 4.064 4.654 . 0 0 "[ . 1]" 1
2024 1 100 SER H 1 100 SER HA 2.900 . 3.900 2.888 2.858 2.905 . 0 0 "[ . 1]" 1
2025 1 100 SER H 1 100 SER HB3 2.700 . 3.600 3.110 2.537 3.634 0.034 1 0 "[ . 1]" 1
2026 1 100 SER H 1 101 LYS H 2.300 . 3.000 2.476 2.305 2.651 . 0 0 "[ . 1]" 1
2027 1 100 SER H 1 102 ARG H 4.400 . 6.000 4.235 3.886 4.528 . 0 0 "[ . 1]" 1
2028 1 100 SER HA 1 101 LYS H 3.600 . 5.200 3.343 3.166 3.448 . 0 0 "[ . 1]" 1
2029 1 100 SER HB2 1 101 LYS H 3.900 . 5.800 3.848 3.249 4.378 . 0 0 "[ . 1]" 1
2030 1 101 LYS H 1 101 LYS HA 2.600 . 3.400 2.948 2.943 2.953 . 0 0 "[ . 1]" 1
2031 1 101 LYS H 1 101 LYS HB2 2.700 . 3.600 2.574 2.398 2.731 . 0 0 "[ . 1]" 1
2032 1 101 LYS H 1 101 LYS QD 4.700 . 6.000 3.905 2.669 4.295 . 0 0 "[ . 1]" 1
2033 1 101 LYS H 1 101 LYS HG2 3.100 . 4.300 4.108 3.657 4.602 0.302 6 0 "[ . 1]" 1
2034 1 101 LYS H 1 101 LYS HG3 3.200 . 4.400 3.128 2.662 4.232 . 0 0 "[ . 1]" 1
2035 1 101 LYS H 1 102 ARG H 2.100 . 2.700 2.271 2.045 2.487 . 0 0 "[ . 1]" 1
2036 1 101 LYS HA 1 101 LYS HB2 2.900 . 3.900 3.016 2.993 3.025 . 0 0 "[ . 1]" 1
2037 1 101 LYS HA 1 101 LYS HB3 2.100 . 2.600 2.501 2.397 2.616 0.016 3 0 "[ . 1]" 1
2038 1 101 LYS HA 1 101 LYS QD 3.700 . 5.400 3.837 2.639 4.060 . 0 0 "[ . 1]" 1
2039 1 101 LYS HA 1 101 LYS HG2 3.200 . 4.500 2.770 2.488 3.641 . 0 0 "[ . 1]" 1
2040 1 101 LYS HA 1 101 LYS HG3 2.500 . 3.300 2.900 2.277 3.279 . 0 0 "[ . 1]" 1
2041 1 101 LYS HA 1 102 ARG H 3.100 . 4.300 3.145 3.006 3.397 . 0 0 "[ . 1]" 1
2042 1 101 LYS HB2 1 101 LYS HG2 2.700 . 3.600 2.927 2.450 3.014 . 0 0 "[ . 1]" 1
2043 1 101 LYS HB2 1 102 ARG H 3.300 . 4.700 3.815 3.340 4.063 . 0 0 "[ . 1]" 1
2044 1 101 LYS QD 1 101 LYS HE3 3.300 . 4.700 2.297 2.161 2.413 . 0 0 "[ . 1]" 1
2045 1 101 LYS HE3 1 101 LYS HG2 2.900 . 3.900 3.095 2.378 3.819 . 0 0 "[ . 1]" 1
2046 1 101 LYS HE3 1 101 LYS HG3 3.400 . 4.800 3.025 2.383 3.660 . 0 0 "[ . 1]" 1
2047 1 102 ARG H 1 102 ARG HA 2.700 . 3.600 2.917 2.862 2.944 . 0 0 "[ . 1]" 1
2048 1 102 ARG H 1 102 ARG HB2 3.700 . 5.400 3.685 3.611 3.754 . 0 0 "[ . 1]" 1
2049 1 102 ARG H 1 102 ARG HB3 2.700 . 3.600 2.884 2.557 2.990 . 0 0 "[ . 1]" 1
2050 1 102 ARG H 1 102 ARG HD2 5.200 . 6.000 4.681 4.397 4.824 . 0 0 "[ . 1]" 1
2051 1 102 ARG H 1 102 ARG HD3 5.000 . 6.000 4.346 4.106 4.898 . 0 0 "[ . 1]" 1
2052 1 102 ARG H 1 102 ARG HG2 2.100 . 2.600 2.075 1.852 2.245 . 0 0 "[ . 1]" 1
2053 1 102 ARG H 1 102 ARG HG3 3.800 . 5.600 3.099 2.828 3.352 . 0 0 "[ . 1]" 1
2054 1 102 ARG H 1 103 ARG H 4.700 . 6.000 4.478 4.206 4.615 . 0 0 "[ . 1]" 1
2055 1 102 ARG HA 1 102 ARG HB2 2.400 . 3.100 2.459 2.396 2.539 . 0 0 "[ . 1]" 1
2056 1 102 ARG HA 1 102 ARG HB3 2.900 . 4.000 2.429 2.359 2.493 . 0 0 "[ . 1]" 1
2057 1 102 ARG HA 1 102 ARG HD2 5.100 . 6.000 4.999 4.631 5.535 . 0 0 "[ . 1]" 1
2058 1 102 ARG HA 1 102 ARG HD3 5.400 . 6.000 4.805 4.616 4.953 . 0 0 "[ . 1]" 1
2059 1 102 ARG HA 1 102 ARG HG2 3.900 . 5.800 3.747 3.680 3.805 . 0 0 "[ . 1]" 1
2060 1 102 ARG HA 1 102 ARG HG3 3.200 . 4.500 3.769 3.702 3.820 . 0 0 "[ . 1]" 1
2061 1 102 ARG HA 1 103 ARG H 2.600 . 3.400 2.202 2.126 2.280 . 0 0 "[ . 1]" 1
2062 1 102 ARG HB2 1 102 ARG HD2 3.000 . 4.100 2.843 2.345 3.745 . 0 0 "[ . 1]" 1
2063 1 102 ARG HB3 1 102 ARG HD2 3.300 . 4.600 3.205 2.908 3.742 . 0 0 "[ . 1]" 1
2064 1 102 ARG HB3 1 102 ARG HD3 3.300 . 4.700 2.697 2.366 3.181 . 0 0 "[ . 1]" 1
2065 1 103 ARG H 1 103 ARG HB2 3.600 . 5.200 2.621 2.314 3.280 . 0 0 "[ . 1]" 1
2066 1 103 ARG H 1 103 ARG HB3 3.100 . 4.300 3.496 2.655 3.839 . 0 0 "[ . 1]" 1
2067 1 103 ARG H 1 103 ARG HG3 3.700 . 5.400 3.425 2.519 4.516 . 0 0 "[ . 1]" 1
2068 1 103 ARG HA 1 103 ARG HB3 2.500 . 3.300 2.624 2.387 3.029 . 0 0 "[ . 1]" 1
2069 1 103 ARG HA 1 103 ARG HD2 4.300 . 6.000 4.169 2.017 4.677 . 0 0 "[ . 1]" 1
2070 1 103 ARG HA 1 103 ARG HG2 2.800 . 3.800 2.720 2.345 3.852 0.052 6 0 "[ . 1]" 1
2071 1 103 ARG HA 1 103 ARG HG3 2.600 . 3.400 3.112 2.599 3.692 0.292 5 0 "[ . 1]" 1
2072 1 103 ARG HB2 1 103 ARG HD3 3.100 . 4.300 3.386 2.635 4.221 . 0 0 "[ . 1]" 1
2073 1 103 ARG HB3 1 103 ARG HD2 3.700 . 5.400 2.983 2.402 4.231 . 0 0 "[ . 1]" 1
2074 1 103 ARG HD2 1 103 ARG HG2 3.000 . 4.100 2.498 2.359 3.012 . 0 0 "[ . 1]" 1
2075 1 103 ARG HD2 1 103 ARG HG3 3.000 . 4.100 2.788 2.315 3.021 . 0 0 "[ . 1]" 1
2076 1 104 HIS HA 1 104 HIS HB3 2.900 . 6.000 2.889 2.548 3.033 . 0 0 "[ . 1]" 1
2077 1 104 HIS HA 1 105 GLU H 2.800 . 3.800 2.175 2.110 2.226 . 0 0 "[ . 1]" 1
2078 1 104 HIS HB2 1 105 GLU H 4.600 . 6.000 4.230 2.909 4.545 . 0 0 "[ . 1]" 1
2079 1 104 HIS HB3 1 105 GLU H 4.900 . 6.000 4.068 3.006 4.468 . 0 0 "[ . 1]" 1
2080 1 105 GLU H 1 105 GLU HB2 4.200 . 6.000 3.246 2.438 3.910 . 0 0 "[ . 1]" 1
2081 1 105 GLU H 1 105 GLU HB3 3.600 . 5.200 3.660 2.957 4.147 . 0 0 "[ . 1]" 1
2082 1 105 GLU HA 1 105 GLU HB2 2.900 . 3.900 2.773 2.453 3.028 . 0 0 "[ . 1]" 1
2083 1 105 GLU HA 1 105 GLU HB3 3.000 . 4.200 2.617 2.370 3.030 . 0 0 "[ . 1]" 1
2084 2 2 ASN HA 2 2 ASN HB2 2.100 . 2.700 2.446 2.353 2.476 . 0 0 "[ . 1]" 1
2085 2 2 ASN HA 2 2 ASN HD21 4.300 . 6.000 3.826 1.952 4.530 0.048 7 0 "[ . 1]" 1
2086 2 2 ASN HA 2 2 ASN HD22 4.700 . 6.000 4.593 3.536 5.356 . 0 0 "[ . 1]" 1
2087 2 2 ASN HB2 2 2 ASN HD21 2.900 . 3.900 2.624 2.187 3.437 . 0 0 "[ . 1]" 1
2088 2 2 ASN HB2 2 2 ASN HD22 3.600 . 5.200 3.657 3.465 4.042 . 0 0 "[ . 1]" 1
2089 2 2 ASN HD21 2 3 TYR HA 3.800 . 5.600 5.152 3.805 5.996 0.396 1 0 "[ . 1]" 1
2090 2 2 ASN HD22 2 3 TYR HA 4.600 . 6.000 5.295 4.465 5.706 . 0 0 "[ . 1]" 1
2091 2 3 TYR HA 2 3 TYR HB2 2.400 . 3.100 2.492 2.369 2.607 . 0 0 "[ . 1]" 1
2092 2 3 TYR HA 2 3 TYR HB3 2.700 . 3.600 2.803 2.334 3.032 . 0 0 "[ . 1]" 1
2093 2 3 TYR HA 2 3 TYR QD 2.800 . 3.800 3.068 2.036 3.742 . 0 0 "[ . 1]" 1
2094 2 3 TYR HA 2 3 TYR QE 4.800 . 6.000 4.979 4.267 5.659 . 0 0 "[ . 1]" 1
2095 2 3 TYR HA 2 4 GLU H 3.000 . 4.100 2.646 2.113 3.472 . 0 0 "[ . 1]" 1
2096 2 3 TYR HB2 2 3 TYR QD 2.300 . 3.000 2.466 2.335 2.736 . 0 0 "[ . 1]" 1
2097 2 3 TYR HB2 2 4 GLU H 5.300 . 6.000 3.706 2.143 4.557 . 0 0 "[ . 1]" 1
2098 2 3 TYR HB3 2 3 TYR QD 2.200 . 2.800 2.369 2.310 2.467 . 0 0 "[ . 1]" 1
2099 2 3 TYR HB3 2 3 TYR QE 4.500 . 6.000 4.409 4.391 4.444 . 0 0 "[ . 1]" 1
2100 2 3 TYR HB3 2 4 GLU H 5.000 . 6.000 3.748 2.412 4.423 . 0 0 "[ . 1]" 1
2101 2 3 TYR QD 2 4 GLU HA 3.800 . 5.600 4.048 3.107 4.765 . 0 0 "[ . 1]" 1
2102 2 3 TYR QD 2 4 GLU QG 5.000 . 6.000 4.420 3.331 5.323 . 0 0 "[ . 1]" 1
2103 2 3 TYR QE 2 4 GLU QG 4.600 . 6.000 5.305 3.957 5.763 . 0 0 "[ . 1]" 1
2104 2 3 TYR QE 2 5 SER QB 3.800 . 6.000 4.702 2.640 5.820 . 0 0 "[ . 1]" 1
2105 2 4 GLU H 2 4 GLU HA 2.900 . 4.000 2.810 2.264 2.941 . 0 0 "[ . 1]" 1
2106 2 4 GLU H 2 4 GLU HB3 4.000 . 6.000 3.430 2.833 4.048 . 0 0 "[ . 1]" 1
2107 2 4 GLU H 2 4 GLU QG 4.300 . 6.000 2.558 1.707 4.218 0.293 4 0 "[ . 1]" 1
2108 2 4 GLU HA 2 4 GLU HB3 2.500 . 3.300 2.478 2.270 3.027 . 0 0 "[ . 1]" 1
2109 2 4 GLU HA 2 4 GLU QG 3.300 . 4.600 2.941 2.344 3.511 . 0 0 "[ . 1]" 1
2110 2 5 SER H 2 5 SER QB 4.600 . 6.000 2.793 2.339 3.205 . 0 0 "[ . 1]" 1
2111 2 5 SER HA 2 5 SER QB 2.500 . 3.300 2.244 2.165 2.397 . 0 0 "[ . 1]" 1
2112 2 6 THR H 2 6 THR MG 4.600 . 6.000 3.295 2.562 3.976 . 0 0 "[ . 1]" 1
2113 2 6 THR HA 2 6 THR MG 3.400 . 4.900 2.260 2.209 2.343 . 0 0 "[ . 1]" 1
2114 2 6 THR HA 2 7 GLY H 3.500 . 5.100 3.258 2.839 3.553 . 0 0 "[ . 1]" 1
2115 2 6 THR HB 2 6 THR MG 2.000 . 2.500 2.137 2.135 2.141 . 0 0 "[ . 1]" 1
2116 2 7 GLY H 2 7 GLY HA3 2.800 . 3.800 2.875 2.700 2.951 . 0 0 "[ . 1]" 1
2117 2 7 GLY HA3 2 8 PRO HD2 3.300 . 4.700 2.561 2.282 2.762 . 0 0 "[ . 1]" 1
2118 2 7 GLY HA3 2 9 PHE QD 3.900 . 5.800 4.306 4.029 4.581 . 0 0 "[ . 1]" 1
2119 2 7 GLY HA3 2 9 PHE QE 3.200 . 6.000 5.784 5.469 6.051 0.051 4 0 "[ . 1]" 1
2120 2 8 PRO HB2 2 9 PHE QD 2.900 . 6.000 4.520 4.303 4.828 . 0 0 "[ . 1]" 1
2121 2 8 PRO HB2 2 9 PHE QE 2.400 . 6.000 4.687 4.294 5.163 . 0 0 "[ . 1]" 1
2122 2 8 PRO HB3 2 8 PRO HD2 2.900 . 6.000 3.860 3.840 3.876 . 0 0 "[ . 1]" 1
2123 2 8 PRO HD2 2 8 PRO HG2 2.000 . 2.500 2.297 2.279 2.305 . 0 0 "[ . 1]" 1
2124 2 8 PRO HD2 2 9 PHE QD 2.700 . 3.600 3.364 3.012 3.627 0.027 6 0 "[ . 1]" 1
2125 2 8 PRO HD2 2 9 PHE QE 2.900 . 6.000 4.015 3.726 4.185 . 0 0 "[ . 1]" 1
2126 2 8 PRO HG2 2 9 PHE QD 2.800 . 3.800 3.492 3.216 3.681 . 0 0 "[ . 1]" 1
2127 2 8 PRO HG2 2 9 PHE QE 2.900 . 4.000 3.453 3.095 3.770 . 0 0 "[ . 1]" 1
2128 2 9 PHE H 2 9 PHE HB2 3.100 . 4.300 2.529 2.418 2.667 . 0 0 "[ . 1]" 1
2129 2 9 PHE H 2 9 PHE HB3 4.100 . 6.000 3.684 3.642 3.735 . 0 0 "[ . 1]" 1
2130 2 9 PHE HA 2 9 PHE HB3 3.000 . 4.100 2.466 2.400 2.551 . 0 0 "[ . 1]" 1
2131 2 9 PHE HA 2 9 PHE QD 2.100 . 2.600 2.323 2.131 2.543 . 0 0 "[ . 1]" 1
2132 2 9 PHE HA 2 9 PHE QE 4.100 . 6.000 4.431 4.321 4.606 . 0 0 "[ . 1]" 1
2133 2 9 PHE HA 2 10 THR H 4.000 . 6.000 3.452 3.260 3.577 . 0 0 "[ . 1]" 1
2134 2 9 PHE HB2 2 9 PHE QD 1.800 . 2.200 2.263 2.245 2.287 0.087 3 0 "[ . 1]" 1
2135 2 9 PHE HB3 2 9 PHE QD 2.100 . 6.000 2.627 2.561 2.693 . 0 0 "[ . 1]" 1
2136 2 10 THR H 2 10 THR HA 2.900 . 4.000 2.841 2.262 2.941 . 0 0 "[ . 1]" 1
2137 2 10 THR H 2 10 THR MG 4.300 . 6.000 2.776 2.049 4.051 . 0 0 "[ . 1]" 1
2138 2 10 THR HA 2 10 THR MG 2.600 . 6.000 2.649 2.198 3.221 . 0 0 "[ . 1]" 1
2139 2 11 ALA H 2 11 ALA HA 3.000 . 4.100 2.777 2.261 2.947 . 0 0 "[ . 1]" 1
2140 2 11 ALA H 2 11 ALA MB 4.300 . 6.000 2.587 2.245 2.927 . 0 0 "[ . 1]" 1
2141 2 11 ALA HA 2 11 ALA MB 3.200 . 4.500 2.129 2.120 2.134 . 0 0 "[ . 1]" 1
2142 2 11 ALA HA 2 12 LYS H 2.700 . 3.600 2.726 2.160 3.557 . 0 0 "[ . 1]" 1
2143 2 11 ALA HA 2 12 LYS HD3 2.800 . 6.000 5.156 2.750 6.251 0.251 5 0 "[ . 1]" 1
2144 2 12 LYS H 2 12 LYS HA 2.600 . 3.400 2.726 2.262 2.947 . 0 0 "[ . 1]" 1
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