NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
401111 |
1va8   |
11200 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1va8
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 2029
_Distance_constraint_stats_list.Viol_count 2715
_Distance_constraint_stats_list.Viol_total 4140.682
_Distance_constraint_stats_list.Viol_max 0.954
_Distance_constraint_stats_list.Viol_rms 0.0364
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0051
_Distance_constraint_stats_list.Viol_average_violations_only 0.0763
_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 6 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 PRO 1.121 0.435 7 0 "[ . 1 . 2]"
1 9 ILE 1.272 0.435 7 0 "[ . 1 . 2]"
1 10 THR 0.514 0.223 9 0 "[ . 1 . 2]"
1 11 ASP 2.137 0.363 2 0 "[ . 1 . 2]"
1 12 GLU 5.614 0.442 10 0 "[ . 1 . 2]"
1 13 ARG 16.583 0.905 14 10 "[ * ***** +* * -2]"
1 14 VAL 9.611 0.509 17 1 "[ . 1 . + 2]"
1 15 TYR 6.957 0.509 17 1 "[ . 1 . + 2]"
1 16 GLU 1.941 0.292 6 0 "[ . 1 . 2]"
1 17 SER 1.656 0.224 2 0 "[ . 1 . 2]"
1 18 ILE 2.167 0.154 13 0 "[ . 1 . 2]"
1 19 GLY 1.114 0.154 13 0 "[ . 1 . 2]"
1 20 HIS 0.553 0.177 12 0 "[ . 1 . 2]"
1 21 TYR 3.790 0.576 1 2 "[+ . 1 . - 2]"
1 22 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 GLY 0.018 0.018 2 0 "[ . 1 . 2]"
1 24 GLU 5.856 0.576 1 2 "[+ . 1 . - 2]"
1 25 THR 4.440 0.140 7 0 "[ . 1 . 2]"
1 26 VAL 3.361 0.278 11 0 "[ . 1 . 2]"
1 27 LYS 3.201 0.954 10 1 "[ . + . 2]"
1 28 ILE 4.373 0.574 6 1 "[ .+ 1 . 2]"
1 29 VAL 0.235 0.165 10 0 "[ . 1 . 2]"
1 30 ARG 3.347 0.574 6 1 "[ .+ 1 . 2]"
1 31 ILE 2.426 0.170 4 0 "[ . 1 . 2]"
1 32 GLU 2.047 0.359 16 0 "[ . 1 . 2]"
1 33 LYS 10.202 0.735 13 1 "[ . 1 + . 2]"
1 34 ALA 4.207 0.238 11 0 "[ . 1 . 2]"
1 35 ARG 13.026 0.898 3 4 "[ +*. 1 * . -]"
1 36 ASP 6.599 0.535 4 2 "[ +. 1 . -]"
1 37 ILE 22.421 0.386 6 0 "[ . 1 . 2]"
1 38 PRO 8.529 0.340 10 0 "[ . 1 . 2]"
1 39 LEU 3.715 0.735 13 1 "[ . 1 + . 2]"
1 40 GLY 0.158 0.084 20 0 "[ . 1 . 2]"
1 41 ALA 0.989 0.058 18 0 "[ . 1 . 2]"
1 42 THR 1.788 0.867 10 1 "[ . + . 2]"
1 43 VAL 3.098 0.331 6 0 "[ . 1 . 2]"
1 44 ARG 3.699 0.940 12 1 "[ . 1 + . 2]"
1 45 ASN 2.517 0.309 12 0 "[ . 1 . 2]"
1 46 GLU 7.087 0.513 19 1 "[ . 1 . +2]"
1 47 MET 6.160 0.513 19 1 "[ . 1 . +2]"
1 48 ASP 0.981 0.061 11 0 "[ . 1 . 2]"
1 49 SER 1.531 0.064 6 0 "[ . 1 . 2]"
1 50 VAL 1.217 0.279 19 0 "[ . 1 . 2]"
1 51 ILE 3.711 0.940 12 1 "[ . 1 + . 2]"
1 52 ILE 3.120 0.139 12 0 "[ . 1 . 2]"
1 53 SER 1.891 0.142 6 0 "[ . 1 . 2]"
1 54 ARG 5.246 0.867 10 1 "[ . + . 2]"
1 55 ILE 3.311 0.138 6 0 "[ . 1 . 2]"
1 56 VAL 2.476 0.296 10 0 "[ . 1 . 2]"
1 57 LYS 4.050 0.795 16 4 "[ . - *1 *.+ 2]"
1 58 GLY 0.011 0.011 20 0 "[ . 1 . 2]"
1 59 GLY 0.367 0.084 20 0 "[ . 1 . 2]"
1 60 ALA 0.341 0.040 10 0 "[ . 1 . 2]"
1 61 ALA 0.674 0.109 6 0 "[ . 1 . 2]"
1 62 GLU 1.360 0.109 20 0 "[ . 1 . 2]"
1 63 LYS 6.420 0.497 4 0 "[ . 1 . 2]"
1 64 SER 2.855 0.605 20 1 "[ . 1 . +]"
1 65 GLY 0.173 0.032 16 0 "[ . 1 . 2]"
1 66 LEU 1.764 0.605 20 1 "[ . 1 . +]"
1 67 LEU 0.662 0.189 15 0 "[ . 1 . 2]"
1 68 HIS 2.313 0.762 15 1 "[ . 1 + 2]"
1 69 GLU 1.899 0.762 15 1 "[ . 1 + 2]"
1 70 GLY 0.284 0.038 7 0 "[ . 1 . 2]"
1 71 ASP 2.336 0.807 17 1 "[ . 1 . + 2]"
1 72 GLU 1.780 0.092 11 0 "[ . 1 . 2]"
1 73 VAL 1.660 0.227 12 0 "[ . 1 . 2]"
1 74 LEU 3.086 0.316 5 0 "[ . 1 . 2]"
1 75 GLU 3.096 0.734 18 2 "[ . - 1 . + 2]"
1 76 ILE 7.147 0.515 18 1 "[ . 1 . + 2]"
1 77 ASN 6.664 0.506 11 1 "[ . 1+ . 2]"
1 78 GLY 0.241 0.077 5 0 "[ . 1 . 2]"
1 79 ILE 5.107 0.276 12 0 "[ . 1 . 2]"
1 80 GLU 3.191 0.734 18 2 "[ . - 1 . + 2]"
1 81 ILE 4.240 0.460 15 0 "[ . 1 . 2]"
1 82 ARG 3.138 0.488 13 0 "[ . 1 . 2]"
1 83 GLY 1.434 0.488 13 0 "[ . 1 . 2]"
1 84 LYS 4.950 0.718 19 2 "[ .- 1 . +2]"
1 85 ASP 1.068 0.250 13 0 "[ . 1 . 2]"
1 86 VAL 1.973 0.331 6 0 "[ . 1 . 2]"
1 87 ASN 13.087 0.544 18 8 "[ .* * *-* *.* + 2]"
1 88 GLU 2.057 0.250 13 0 "[ . 1 . 2]"
1 89 VAL 1.691 0.242 19 0 "[ . 1 . 2]"
1 90 PHE 7.316 0.284 11 0 "[ . 1 . 2]"
1 91 ASP 0.086 0.033 16 0 "[ . 1 . 2]"
1 92 LEU 0.628 0.103 19 0 "[ . 1 . 2]"
1 93 LEU 1.361 0.144 4 0 "[ . 1 . 2]"
1 94 SER 2.058 0.208 4 0 "[ . 1 . 2]"
1 95 ASP 0.975 0.226 8 0 "[ . 1 . 2]"
1 96 MET 7.826 0.506 11 1 "[ . 1+ . 2]"
1 97 HIS 5.741 0.898 3 2 "[ + . 1 - . 2]"
1 98 GLY 2.162 0.626 13 1 "[ . 1 + . 2]"
1 99 THR 1.712 0.104 5 0 "[ . 1 . 2]"
1 100 LEU 0.597 0.225 13 0 "[ . 1 . 2]"
1 101 THR 0.607 0.248 17 0 "[ . 1 . 2]"
1 102 PHE 5.515 0.515 18 1 "[ . 1 . + 2]"
1 103 VAL 0.423 0.037 14 0 "[ . 1 . 2]"
1 104 LEU 2.059 0.147 11 0 "[ . 1 . 2]"
1 105 ILE 2.075 0.192 16 0 "[ . 1 . 2]"
1 106 PRO 3.432 0.954 10 1 "[ . + . 2]"
1 107 SER 2.360 0.807 17 1 "[ . 1 . + 2]"
1 108 SER 0.339 0.064 17 0 "[ . 1 . 2]"
1 109 GLY 1.045 0.253 14 0 "[ . 1 . 2]"
1 110 PRO 0.553 0.253 14 0 "[ . 1 . 2]"
1 111 SER 0.072 0.072 14 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 6 SER HB2 1 7 GLY H . . 5.130 3.858 2.023 4.712 . 0 0 "[ . 1 . 2]" 1
2 1 8 PRO HA 1 9 ILE H . . 3.000 2.464 2.188 2.770 . 0 0 "[ . 1 . 2]" 1
3 1 8 PRO HA 1 9 ILE HG13 . . 4.920 4.161 3.053 5.355 0.435 7 0 "[ . 1 . 2]" 1
4 1 8 PRO HD2 1 9 ILE H . . 5.200 5.025 4.254 5.230 0.030 8 0 "[ . 1 . 2]" 1
5 1 9 ILE H 1 9 ILE HB . . 3.410 2.410 2.284 2.669 . 0 0 "[ . 1 . 2]" 1
6 1 9 ILE H 1 9 ILE MD . . 4.920 3.274 2.349 3.876 . 0 0 "[ . 1 . 2]" 1
7 1 9 ILE H 1 9 ILE HG12 . . 4.100 3.648 2.082 4.135 0.035 8 0 "[ . 1 . 2]" 1
8 1 9 ILE H 1 9 ILE HG13 . . 4.040 2.718 2.214 4.065 0.025 7 0 "[ . 1 . 2]" 1
9 1 9 ILE H 1 9 ILE MG . . 4.270 3.721 3.657 3.859 . 0 0 "[ . 1 . 2]" 1
10 1 9 ILE HA 1 9 ILE MD . . 4.270 3.563 2.017 3.906 . 0 0 "[ . 1 . 2]" 1
11 1 9 ILE HA 1 9 ILE MG . . 3.590 2.431 2.260 2.572 . 0 0 "[ . 1 . 2]" 1
12 1 9 ILE HA 1 10 THR H . . 3.240 2.276 2.194 2.421 . 0 0 "[ . 1 . 2]" 1
13 1 9 ILE HB 1 10 THR H . . 4.220 4.095 3.882 4.223 0.003 1 0 "[ . 1 . 2]" 1
14 1 9 ILE MG 1 10 THR H . . 4.430 2.289 1.956 2.708 . 0 0 "[ . 1 . 2]" 1
15 1 9 ILE MG 1 10 THR HA . . 4.920 3.812 3.257 4.198 . 0 0 "[ . 1 . 2]" 1
16 1 9 ILE MG 1 11 ASP H . . 5.180 4.867 2.038 5.236 0.056 8 0 "[ . 1 . 2]" 1
17 1 10 THR H 1 10 THR MG . . 4.180 3.238 1.945 4.017 . 0 0 "[ . 1 . 2]" 1
18 1 10 THR HA 1 10 THR MG . . 3.480 2.398 2.123 3.225 . 0 0 "[ . 1 . 2]" 1
19 1 10 THR HA 1 11 ASP H . . 3.210 2.541 2.152 3.288 0.078 13 0 "[ . 1 . 2]" 1
20 1 10 THR HB 1 11 ASP H . . 3.960 3.252 1.917 3.923 . 0 0 "[ . 1 . 2]" 1
21 1 10 THR HB 1 12 GLU H . . 5.260 5.071 4.438 5.483 0.223 9 0 "[ . 1 . 2]" 1
22 1 10 THR MG 1 11 ASP H . . 5.200 2.791 1.890 4.277 . 0 0 "[ . 1 . 2]" 1
23 1 11 ASP H 1 11 ASP HB2 . . 4.030 3.060 2.356 3.990 . 0 0 "[ . 1 . 2]" 1
24 1 11 ASP H 1 11 ASP HB3 . . 3.960 3.545 2.768 3.974 0.014 13 0 "[ . 1 . 2]" 1
25 1 11 ASP HA 1 12 GLU H . . 3.120 2.433 2.255 3.162 0.042 20 0 "[ . 1 . 2]" 1
26 1 11 ASP HA 1 12 GLU HA . . 4.520 4.464 4.380 4.724 0.204 10 0 "[ . 1 . 2]" 1
27 1 11 ASP HB2 1 12 GLU H . . 4.480 4.003 1.960 4.537 0.057 10 0 "[ . 1 . 2]" 1
28 1 11 ASP HB2 1 14 VAL QG . . 4.920 3.533 2.448 4.779 . 0 0 "[ . 1 . 2]" 1
29 1 11 ASP HB3 1 12 GLU H . . 4.140 3.866 1.924 4.503 0.363 2 0 "[ . 1 . 2]" 1
30 1 11 ASP HB3 1 14 VAL QG . . 5.260 3.911 2.767 4.829 . 0 0 "[ . 1 . 2]" 1
31 1 12 GLU H 1 12 GLU HB2 . . 3.880 3.322 2.158 4.091 0.211 17 0 "[ . 1 . 2]" 1
32 1 12 GLU H 1 12 GLU HB3 . . 3.460 2.896 2.450 3.902 0.442 10 0 "[ . 1 . 2]" 1
33 1 12 GLU H 1 12 GLU QG . . 4.160 2.818 1.927 3.895 . 0 0 "[ . 1 . 2]" 1
34 1 12 GLU H 1 13 ARG H . . 3.720 3.450 2.559 3.938 0.218 5 0 "[ . 1 . 2]" 1
35 1 12 GLU HA 1 12 GLU QG . . 3.850 2.931 2.128 3.354 . 0 0 "[ . 1 . 2]" 1
36 1 12 GLU HA 1 13 ARG H . . 3.250 2.660 2.204 3.255 0.005 10 0 "[ . 1 . 2]" 1
37 1 12 GLU HA 1 13 ARG QB . . 5.500 4.914 4.170 5.201 . 0 0 "[ . 1 . 2]" 1
38 1 12 GLU HA 1 14 VAL H . . 4.920 3.881 3.234 5.044 0.124 17 0 "[ . 1 . 2]" 1
39 1 12 GLU HA 1 15 TYR QD . . 4.690 4.690 4.353 4.876 0.186 10 0 "[ . 1 . 2]" 1
40 1 12 GLU HB2 1 13 ARG H . . 4.510 4.344 1.909 4.723 0.213 6 0 "[ . 1 . 2]" 1
41 1 12 GLU HB3 1 13 ARG H . . 4.920 4.505 3.316 4.723 . 0 0 "[ . 1 . 2]" 1
42 1 12 GLU QG 1 13 ARG H . . 5.120 3.860 1.940 4.582 . 0 0 "[ . 1 . 2]" 1
43 1 12 GLU QG 1 13 ARG HA . . 4.920 4.336 3.520 4.743 . 0 0 "[ . 1 . 2]" 1
44 1 13 ARG H 1 13 ARG QB . . 3.560 3.071 2.242 3.362 . 0 0 "[ . 1 . 2]" 1
45 1 13 ARG H 1 13 ARG HD3 . . 5.160 4.613 3.401 5.547 0.387 10 0 "[ . 1 . 2]" 1
46 1 13 ARG H 1 13 ARG HG2 . . 3.740 3.100 2.174 4.645 0.905 14 5 "[ * * * +. - 2]" 1
47 1 13 ARG H 1 13 ARG HG3 . . 4.380 3.081 1.920 3.628 . 0 0 "[ . 1 . 2]" 1
48 1 13 ARG H 1 14 VAL H . . 3.650 2.612 1.841 3.734 0.084 7 0 "[ . 1 . 2]" 1
49 1 13 ARG H 1 14 VAL QG . . 5.060 2.889 2.091 4.431 . 0 0 "[ . 1 . 2]" 1
50 1 13 ARG HA 1 13 ARG HD2 . . 4.380 4.498 2.799 5.240 0.860 8 2 "[ . + 1- . 2]" 1
51 1 13 ARG HA 1 13 ARG HG2 . . 3.560 3.276 2.567 4.146 0.586 9 3 "[ . +1 * -2]" 1
52 1 13 ARG HA 1 13 ARG HG3 . . 3.960 3.443 2.185 3.963 0.003 1 0 "[ . 1 . 2]" 1
53 1 13 ARG HA 1 14 VAL H . . 2.980 2.836 2.329 3.444 0.464 16 0 "[ . 1 . 2]" 1
54 1 13 ARG HA 1 14 VAL QG . . 4.380 4.067 3.666 4.318 . 0 0 "[ . 1 . 2]" 1
55 1 13 ARG HA 1 15 TYR H . . 4.980 3.373 2.978 4.678 . 0 0 "[ . 1 . 2]" 1
56 1 13 ARG HA 1 15 TYR QD . . 5.260 2.830 2.158 3.911 . 0 0 "[ . 1 . 2]" 1
57 1 13 ARG HA 1 15 TYR QE . . 4.920 2.950 2.047 3.408 . 0 0 "[ . 1 . 2]" 1
58 1 13 ARG QB 1 13 ARG HE . . 4.860 3.598 2.822 4.223 . 0 0 "[ . 1 . 2]" 1
59 1 13 ARG QB 1 13 ARG HG2 . . 2.610 2.398 2.179 2.529 . 0 0 "[ . 1 . 2]" 1
60 1 13 ARG QB 1 13 ARG HG3 . . 2.640 2.375 2.184 2.555 . 0 0 "[ . 1 . 2]" 1
61 1 13 ARG QB 1 14 VAL H . . 4.100 3.918 3.177 4.038 . 0 0 "[ . 1 . 2]" 1
62 1 13 ARG QB 1 14 VAL QG . . 4.690 3.603 2.636 4.171 . 0 0 "[ . 1 . 2]" 1
63 1 13 ARG QB 1 15 TYR H . . 5.500 4.649 4.130 5.304 . 0 0 "[ . 1 . 2]" 1
64 1 13 ARG QB 1 15 TYR QD . . 5.260 4.535 4.002 5.056 . 0 0 "[ . 1 . 2]" 1
65 1 13 ARG QB 1 15 TYR QE . . 4.920 4.381 3.520 4.726 . 0 0 "[ . 1 . 2]" 1
66 1 13 ARG HD2 1 13 ARG HG3 . . 3.050 2.634 2.269 3.029 . 0 0 "[ . 1 . 2]" 1
67 1 13 ARG HG2 1 14 VAL H . . 4.640 4.616 3.859 5.053 0.413 15 0 "[ . 1 . 2]" 1
68 1 13 ARG HG3 1 14 VAL H . . 4.920 4.449 3.443 5.048 0.128 16 0 "[ . 1 . 2]" 1
69 1 14 VAL H 1 14 VAL HB . . 3.280 2.809 2.507 3.695 0.415 15 0 "[ . 1 . 2]" 1
70 1 14 VAL H 1 14 VAL QG . . 3.380 2.598 1.868 3.086 . 0 0 "[ . 1 . 2]" 1
71 1 14 VAL H 1 15 TYR H . . 3.760 2.273 1.697 3.890 0.130 15 0 "[ . 1 . 2]" 1
72 1 14 VAL HA 1 15 TYR H . . 3.030 3.068 2.306 3.539 0.509 17 1 "[ . 1 . + 2]" 1
73 1 14 VAL HA 1 15 TYR QD . . 5.500 4.531 3.343 5.172 . 0 0 "[ . 1 . 2]" 1
74 1 14 VAL HB 1 15 TYR H . . 3.960 4.036 3.959 4.126 0.166 15 0 "[ . 1 . 2]" 1
75 1 14 VAL HB 1 15 TYR QD . . 5.260 4.980 3.675 5.487 0.227 18 0 "[ . 1 . 2]" 1
76 1 14 VAL QG 1 15 TYR H . . 4.380 3.698 2.308 3.799 . 0 0 "[ . 1 . 2]" 1
77 1 15 TYR H 1 15 TYR HB2 . . 3.740 2.710 2.197 3.499 . 0 0 "[ . 1 . 2]" 1
78 1 15 TYR H 1 15 TYR HB3 . . 3.480 3.394 2.773 3.692 0.212 14 0 "[ . 1 . 2]" 1
79 1 15 TYR H 1 15 TYR QD . . 3.960 2.120 1.884 2.763 . 0 0 "[ . 1 . 2]" 1
80 1 15 TYR H 1 18 ILE MD . . 4.020 4.026 3.701 4.159 0.139 7 0 "[ . 1 . 2]" 1
81 1 15 TYR HA 1 15 TYR QD . . 3.500 3.269 2.766 3.770 0.270 7 0 "[ . 1 . 2]" 1
82 1 15 TYR HA 1 16 GLU H . . 2.850 2.459 2.187 2.832 . 0 0 "[ . 1 . 2]" 1
83 1 15 TYR HB2 1 16 GLU H . . 4.520 3.487 1.940 4.396 . 0 0 "[ . 1 . 2]" 1
84 1 15 TYR HB2 1 18 ILE MD . . 4.690 2.269 1.760 3.605 . 0 0 "[ . 1 . 2]" 1
85 1 15 TYR HB3 1 16 GLU H . . 4.520 3.088 1.974 4.541 0.021 1 0 "[ . 1 . 2]" 1
86 1 15 TYR HB3 1 18 ILE MD . . 4.920 2.960 1.855 4.897 . 0 0 "[ . 1 . 2]" 1
87 1 15 TYR QD 1 16 GLU H . . 4.920 4.066 3.366 4.922 0.002 1 0 "[ . 1 . 2]" 1
88 1 15 TYR QD 1 18 ILE MD . . 4.270 3.192 1.933 4.000 . 0 0 "[ . 1 . 2]" 1
89 1 16 GLU H 1 16 GLU HB2 . . 4.100 2.666 2.192 3.746 . 0 0 "[ . 1 . 2]" 1
90 1 16 GLU H 1 16 GLU HB3 . . 3.940 3.099 2.522 4.076 0.136 1 0 "[ . 1 . 2]" 1
91 1 16 GLU H 1 16 GLU HG3 . . 4.480 3.643 2.116 4.515 0.035 19 0 "[ . 1 . 2]" 1
92 1 16 GLU H 1 17 SER H . . 4.110 4.070 2.384 4.265 0.155 19 0 "[ . 1 . 2]" 1
93 1 16 GLU H 1 18 ILE MD . . 4.980 3.965 3.144 4.651 . 0 0 "[ . 1 . 2]" 1
94 1 16 GLU HA 1 16 GLU HG3 . . 3.810 2.932 2.146 4.102 0.292 6 0 "[ . 1 . 2]" 1
95 1 16 GLU HA 1 17 SER H . . 3.160 3.068 2.294 3.310 0.150 2 0 "[ . 1 . 2]" 1
96 1 16 GLU HB2 1 17 SER H . . 4.280 3.027 1.912 4.504 0.224 2 0 "[ . 1 . 2]" 1
97 1 16 GLU HB3 1 17 SER H . . 4.420 2.301 1.884 4.345 . 0 0 "[ . 1 . 2]" 1
98 1 16 GLU HG2 1 17 SER H . . 4.650 3.043 1.949 4.421 . 0 0 "[ . 1 . 2]" 1
99 1 17 SER H 1 17 SER HB2 . . 3.940 3.271 2.615 3.551 . 0 0 "[ . 1 . 2]" 1
100 1 17 SER H 1 17 SER HB3 . . 3.900 3.017 2.299 3.629 . 0 0 "[ . 1 . 2]" 1
101 1 17 SER H 1 18 ILE MD . . 5.500 4.792 2.682 5.247 . 0 0 "[ . 1 . 2]" 1
102 1 17 SER HA 1 17 SER HB3 . . 3.050 2.367 2.260 2.544 . 0 0 "[ . 1 . 2]" 1
103 1 17 SER HA 1 18 ILE H . . 3.280 2.239 2.215 2.406 . 0 0 "[ . 1 . 2]" 1
104 1 17 SER HA 1 18 ILE HB . . 4.690 4.582 4.446 4.739 0.049 13 0 "[ . 1 . 2]" 1
105 1 17 SER HA 1 18 ILE MD . . 4.690 3.839 2.797 4.591 . 0 0 "[ . 1 . 2]" 1
106 1 17 SER HA 1 21 TYR QE . . 4.180 2.954 2.041 4.069 . 0 0 "[ . 1 . 2]" 1
107 1 17 SER HB2 1 18 ILE H . . 4.270 3.821 2.770 4.293 0.023 8 0 "[ . 1 . 2]" 1
108 1 17 SER HB2 1 21 TYR QE . . 4.380 3.541 2.471 4.367 . 0 0 "[ . 1 . 2]" 1
109 1 17 SER HB2 1 103 VAL MG1 . . 4.520 3.724 2.765 4.529 0.009 18 0 "[ . 1 . 2]" 1
110 1 17 SER HB2 1 103 VAL MG2 . . 4.270 2.973 2.063 4.230 . 0 0 "[ . 1 . 2]" 1
111 1 17 SER HB3 1 18 ILE H . . 4.270 4.061 3.142 4.314 0.044 18 0 "[ . 1 . 2]" 1
112 1 17 SER HB3 1 21 TYR QE . . 4.520 3.615 2.632 4.521 0.001 20 0 "[ . 1 . 2]" 1
113 1 17 SER HB3 1 103 VAL MG1 . . 4.690 3.687 2.876 4.693 0.003 11 0 "[ . 1 . 2]" 1
114 1 17 SER HB3 1 103 VAL MG2 . . 4.270 2.789 2.046 4.088 . 0 0 "[ . 1 . 2]" 1
115 1 18 ILE H 1 18 ILE HB . . 3.720 2.415 2.263 2.563 . 0 0 "[ . 1 . 2]" 1
116 1 18 ILE H 1 18 ILE MD . . 4.520 2.754 1.978 3.446 . 0 0 "[ . 1 . 2]" 1
117 1 18 ILE H 1 18 ILE HG12 . . 4.270 3.599 1.986 4.300 0.030 4 0 "[ . 1 . 2]" 1
118 1 18 ILE H 1 18 ILE HG13 . . 4.100 3.272 2.809 3.939 . 0 0 "[ . 1 . 2]" 1
119 1 18 ILE H 1 18 ILE MG . . 3.900 3.727 3.636 3.806 . 0 0 "[ . 1 . 2]" 1
120 1 18 ILE H 1 21 TYR QE . . 5.500 2.303 1.932 3.107 . 0 0 "[ . 1 . 2]" 1
121 1 18 ILE HA 1 18 ILE MD . . 3.720 3.106 1.948 3.784 0.064 16 0 "[ . 1 . 2]" 1
122 1 18 ILE HA 1 18 ILE HG13 . . 4.100 2.767 2.249 3.770 . 0 0 "[ . 1 . 2]" 1
123 1 18 ILE HA 1 18 ILE MG . . 3.300 2.437 2.265 2.553 . 0 0 "[ . 1 . 2]" 1
124 1 18 ILE HA 1 19 GLY H . . 3.400 2.669 2.258 3.554 0.154 13 0 "[ . 1 . 2]" 1
125 1 18 ILE HA 1 20 HIS H . . 5.060 4.746 4.405 5.071 0.011 20 0 "[ . 1 . 2]" 1
126 1 18 ILE HA 1 21 TYR QD . . 5.260 5.143 4.322 5.330 0.070 12 0 "[ . 1 . 2]" 1
127 1 18 ILE HA 1 21 TYR QE . . 4.690 4.391 4.011 4.698 0.008 1 0 "[ . 1 . 2]" 1
128 1 18 ILE HB 1 18 ILE MD . . 3.500 2.437 1.943 3.217 . 0 0 "[ . 1 . 2]" 1
129 1 18 ILE HB 1 19 GLY H . . 4.140 3.637 1.918 4.151 0.011 15 0 "[ . 1 . 2]" 1
130 1 18 ILE HB 1 21 TYR QD . . 5.260 3.624 2.611 4.574 . 0 0 "[ . 1 . 2]" 1
131 1 18 ILE HB 1 21 TYR QE . . 4.520 3.796 3.090 4.535 0.015 1 0 "[ . 1 . 2]" 1
132 1 18 ILE MD 1 21 TYR QE . . 4.920 4.545 3.586 4.927 0.007 11 0 "[ . 1 . 2]" 1
133 1 18 ILE HG12 1 19 GLY H . . 5.010 4.525 4.176 5.081 0.071 2 0 "[ . 1 . 2]" 1
134 1 18 ILE HG13 1 18 ILE MG . . 3.370 2.770 2.158 3.061 . 0 0 "[ . 1 . 2]" 1
135 1 18 ILE HG13 1 19 GLY H . . 5.200 4.585 4.195 5.244 0.044 13 0 "[ . 1 . 2]" 1
136 1 18 ILE MG 1 19 GLY H . . 3.850 2.478 1.850 3.880 0.030 10 0 "[ . 1 . 2]" 1
137 1 19 GLY H 1 21 TYR QE . . 5.090 4.307 1.983 5.149 0.059 20 0 "[ . 1 . 2]" 1
138 1 19 GLY H 1 26 VAL QG . . 4.690 4.235 3.206 4.666 . 0 0 "[ . 1 . 2]" 1
139 1 19 GLY HA2 1 21 TYR QE . . 4.920 4.259 3.287 4.949 0.029 2 0 "[ . 1 . 2]" 1
140 1 19 GLY HA2 1 26 VAL QG . . 5.260 2.599 1.965 3.868 . 0 0 "[ . 1 . 2]" 1
141 1 19 GLY HA2 1 28 ILE MD . . 4.920 2.638 1.937 3.631 . 0 0 "[ . 1 . 2]" 1
142 1 19 GLY HA3 1 26 VAL QG . . 5.260 3.875 3.389 4.872 . 0 0 "[ . 1 . 2]" 1
143 1 19 GLY HA3 1 28 ILE MD . . 5.260 3.548 1.965 4.642 . 0 0 "[ . 1 . 2]" 1
144 1 20 HIS HA 1 20 HIS HD2 . . 4.690 3.455 2.053 4.647 . 0 0 "[ . 1 . 2]" 1
145 1 20 HIS HA 1 21 TYR H . . 3.460 2.719 2.222 3.637 0.177 12 0 "[ . 1 . 2]" 1
146 1 20 HIS HA 1 26 VAL QG . . 4.520 3.804 2.076 4.210 . 0 0 "[ . 1 . 2]" 1
147 1 20 HIS HB3 1 21 TYR H . . 4.690 4.125 2.378 4.704 0.014 10 0 "[ . 1 . 2]" 1
148 1 20 HIS HD2 1 21 TYR H . . 5.500 4.683 3.074 5.502 0.002 15 0 "[ . 1 . 2]" 1
149 1 21 TYR H 1 21 TYR HB2 . . 3.970 2.316 1.938 3.265 . 0 0 "[ . 1 . 2]" 1
150 1 21 TYR H 1 21 TYR HB3 . . 3.970 3.495 3.228 4.006 0.036 12 0 "[ . 1 . 2]" 1
151 1 21 TYR H 1 21 TYR QD . . 4.240 2.520 1.938 3.339 . 0 0 "[ . 1 . 2]" 1
152 1 21 TYR H 1 21 TYR QE . . 5.500 4.722 4.112 5.505 0.005 19 0 "[ . 1 . 2]" 1
153 1 21 TYR H 1 26 VAL QG . . 4.910 2.850 1.834 4.226 . 0 0 "[ . 1 . 2]" 1
154 1 21 TYR HA 1 21 TYR QD . . 3.320 2.524 1.995 3.155 . 0 0 "[ . 1 . 2]" 1
155 1 21 TYR HA 1 22 GLY H . . 3.500 2.437 2.189 2.947 . 0 0 "[ . 1 . 2]" 1
156 1 21 TYR HA 1 22 GLY HA2 . . 4.690 4.455 4.326 4.670 . 0 0 "[ . 1 . 2]" 1
157 1 21 TYR HB2 1 22 GLY H . . 5.010 4.461 3.449 4.650 . 0 0 "[ . 1 . 2]" 1
158 1 21 TYR HB2 1 24 GLU HB2 . . 5.260 4.766 3.280 5.817 0.557 18 1 "[ . 1 . + 2]" 1
159 1 21 TYR HB2 1 24 GLU HB3 . . 4.920 4.291 3.282 5.496 0.576 1 1 "[+ . 1 . 2]" 1
160 1 21 TYR HB2 1 26 VAL QG . . 4.030 2.166 1.753 2.495 . 0 0 "[ . 1 . 2]" 1
161 1 21 TYR HB2 1 74 LEU QD . . 4.520 4.495 4.277 4.836 0.316 5 0 "[ . 1 . 2]" 1
162 1 21 TYR HB3 1 22 GLY H . . 5.040 3.943 1.950 4.409 . 0 0 "[ . 1 . 2]" 1
163 1 21 TYR HB3 1 26 VAL QG . . 4.100 3.041 2.105 3.475 . 0 0 "[ . 1 . 2]" 1
164 1 21 TYR HB3 1 74 LEU QD . . 4.920 4.359 3.883 4.850 . 0 0 "[ . 1 . 2]" 1
165 1 21 TYR QD 1 22 GLY H . . 5.160 4.422 3.380 4.969 . 0 0 "[ . 1 . 2]" 1
166 1 21 TYR QD 1 26 VAL HB . . 5.260 4.571 4.292 4.999 . 0 0 "[ . 1 . 2]" 1
167 1 21 TYR QD 1 26 VAL QG . . 3.960 2.195 1.903 2.625 . 0 0 "[ . 1 . 2]" 1
168 1 21 TYR QD 1 74 LEU QD . . 4.180 3.046 2.485 3.683 . 0 0 "[ . 1 . 2]" 1
169 1 21 TYR QD 1 103 VAL MG1 . . 4.380 3.724 3.323 4.028 . 0 0 "[ . 1 . 2]" 1
170 1 21 TYR QE 1 26 VAL QG . . 4.030 2.790 2.464 3.257 . 0 0 "[ . 1 . 2]" 1
171 1 21 TYR QE 1 74 LEU HB3 . . 5.260 3.939 2.730 4.842 . 0 0 "[ . 1 . 2]" 1
172 1 21 TYR QE 1 74 LEU QD . . 4.520 3.274 2.290 4.018 . 0 0 "[ . 1 . 2]" 1
173 1 21 TYR QE 1 75 GLU HB3 . . 4.920 4.447 3.769 4.923 0.003 6 0 "[ . 1 . 2]" 1
174 1 21 TYR QE 1 75 GLU HG3 . . 5.260 4.848 3.994 5.248 . 0 0 "[ . 1 . 2]" 1
175 1 21 TYR QE 1 103 VAL MG1 . . 4.380 2.573 2.049 2.966 . 0 0 "[ . 1 . 2]" 1
176 1 21 TYR QE 1 103 VAL MG2 . . 3.810 3.783 3.556 3.827 0.017 13 0 "[ . 1 . 2]" 1
177 1 23 GLY H 1 24 GLU H . . 3.990 2.925 1.886 4.008 0.018 2 0 "[ . 1 . 2]" 1
178 1 24 GLU H 1 24 GLU HB2 . . 4.030 2.601 2.019 4.040 0.010 6 0 "[ . 1 . 2]" 1
179 1 24 GLU H 1 24 GLU HB3 . . 3.600 3.229 2.399 3.847 0.247 13 0 "[ . 1 . 2]" 1
180 1 24 GLU H 1 24 GLU QG . . 4.030 3.546 2.453 3.958 . 0 0 "[ . 1 . 2]" 1
181 1 24 GLU H 1 25 THR H . . 4.430 4.430 4.307 4.532 0.102 11 0 "[ . 1 . 2]" 1
182 1 24 GLU HA 1 24 GLU QG . . 3.530 2.288 1.952 3.334 . 0 0 "[ . 1 . 2]" 1
183 1 24 GLU HA 1 25 THR H . . 3.160 2.778 2.557 2.904 . 0 0 "[ . 1 . 2]" 1
184 1 24 GLU HB2 1 25 THR H . . 4.000 3.369 1.958 3.907 . 0 0 "[ . 1 . 2]" 1
185 1 24 GLU HB2 1 26 VAL QG . . 4.520 4.470 4.014 4.798 0.278 11 0 "[ . 1 . 2]" 1
186 1 24 GLU HB2 1 105 ILE MD . . 4.520 4.379 3.471 4.712 0.192 16 0 "[ . 1 . 2]" 1
187 1 24 GLU HB3 1 25 THR H . . 4.480 2.539 2.124 3.657 . 0 0 "[ . 1 . 2]" 1
188 1 24 GLU HB3 1 105 ILE MD . . 4.690 3.731 3.215 4.698 0.008 6 0 "[ . 1 . 2]" 1
189 1 24 GLU QG 1 25 THR H . . 4.760 2.593 2.096 3.140 . 0 0 "[ . 1 . 2]" 1
190 1 24 GLU QG 1 26 VAL QG . . 4.690 4.045 2.505 4.437 . 0 0 "[ . 1 . 2]" 1
191 1 24 GLU QG 1 105 ILE MD . . 4.380 3.396 2.707 3.871 . 0 0 "[ . 1 . 2]" 1
192 1 25 THR H 1 25 THR HB . . 3.530 3.618 3.561 3.664 0.134 4 0 "[ . 1 . 2]" 1
193 1 25 THR H 1 25 THR MG . . 4.180 3.400 3.299 3.483 . 0 0 "[ . 1 . 2]" 1
194 1 25 THR H 1 26 VAL H . . 4.150 4.218 4.109 4.290 0.140 7 0 "[ . 1 . 2]" 1
195 1 25 THR H 1 26 VAL QG . . 5.040 3.803 3.691 3.882 . 0 0 "[ . 1 . 2]" 1
196 1 25 THR H 1 105 ILE MG . . 5.220 3.861 3.278 4.271 . 0 0 "[ . 1 . 2]" 1
197 1 25 THR HA 1 25 THR MG . . 3.170 2.158 2.109 2.289 . 0 0 "[ . 1 . 2]" 1
198 1 25 THR HA 1 26 VAL H . . 3.160 2.155 2.151 2.165 . 0 0 "[ . 1 . 2]" 1
199 1 25 THR HA 1 26 VAL QG . . 4.520 3.286 3.239 3.318 . 0 0 "[ . 1 . 2]" 1
200 1 25 THR HB 1 26 VAL H . . 4.180 3.640 3.532 3.813 . 0 0 "[ . 1 . 2]" 1
201 1 25 THR HB 1 26 VAL QG . . 4.920 4.534 4.466 4.569 . 0 0 "[ . 1 . 2]" 1
202 1 25 THR HB 1 105 ILE MG . . 4.520 4.491 4.385 4.571 0.051 18 0 "[ . 1 . 2]" 1
203 1 25 THR MG 1 26 VAL H . . 3.720 3.749 3.719 3.783 0.063 13 0 "[ . 1 . 2]" 1
204 1 25 THR MG 1 26 VAL QG . . 4.690 4.346 4.314 4.382 . 0 0 "[ . 1 . 2]" 1
205 1 26 VAL H 1 26 VAL HB . . 4.050 3.606 3.568 3.689 . 0 0 "[ . 1 . 2]" 1
206 1 26 VAL H 1 26 VAL QG . . 3.390 1.869 1.823 1.937 . 0 0 "[ . 1 . 2]" 1
207 1 26 VAL H 1 27 LYS H . . 5.280 4.511 4.463 4.589 . 0 0 "[ . 1 . 2]" 1
208 1 26 VAL HA 1 26 VAL QG . . 3.300 2.227 2.157 2.322 . 0 0 "[ . 1 . 2]" 1
209 1 26 VAL HA 1 27 LYS H . . 3.290 2.292 2.221 2.443 . 0 0 "[ . 1 . 2]" 1
210 1 26 VAL HB 1 27 LYS H . . 3.610 2.980 2.544 3.253 . 0 0 "[ . 1 . 2]" 1
211 1 26 VAL HB 1 104 LEU H . . 4.780 4.167 3.602 4.600 . 0 0 "[ . 1 . 2]" 1
212 1 26 VAL QG 1 27 LYS H . . 3.900 3.423 3.265 3.503 . 0 0 "[ . 1 . 2]" 1
213 1 26 VAL QG 1 28 ILE HG12 . . 4.380 4.229 3.784 4.328 . 0 0 "[ . 1 . 2]" 1
214 1 26 VAL QG 1 28 ILE HG13 . . 4.030 3.517 2.629 3.776 . 0 0 "[ . 1 . 2]" 1
215 1 26 VAL QG 1 104 LEU H . . 4.920 4.462 4.076 4.661 . 0 0 "[ . 1 . 2]" 1
216 1 26 VAL QG 1 105 ILE HG12 . . 3.900 2.253 1.810 2.806 . 0 0 "[ . 1 . 2]" 1
217 1 26 VAL QG 1 105 ILE HG13 . . 3.810 2.317 1.926 2.829 . 0 0 "[ . 1 . 2]" 1
218 1 27 LYS H 1 27 LYS HB3 . . 3.600 2.668 2.367 2.852 . 0 0 "[ . 1 . 2]" 1
219 1 27 LYS H 1 27 LYS HG2 . . 5.090 4.409 4.231 4.503 . 0 0 "[ . 1 . 2]" 1
220 1 27 LYS H 1 27 LYS HG3 . . 5.130 4.635 4.481 4.766 . 0 0 "[ . 1 . 2]" 1
221 1 27 LYS H 1 28 ILE H . . 5.060 4.328 4.192 4.421 . 0 0 "[ . 1 . 2]" 1
222 1 27 LYS H 1 104 LEU H . . 3.880 3.578 3.158 3.881 0.001 12 0 "[ . 1 . 2]" 1
223 1 27 LYS H 1 106 PRO HD2 . . 4.690 4.019 3.672 4.705 0.015 10 0 "[ . 1 . 2]" 1
224 1 27 LYS H 1 106 PRO HD3 . . 4.520 3.058 2.794 3.597 . 0 0 "[ . 1 . 2]" 1
225 1 27 LYS HB2 1 27 LYS HG3 . . 2.810 2.311 2.266 2.388 . 0 0 "[ . 1 . 2]" 1
226 1 27 LYS HB3 1 28 ILE H . . 4.270 4.327 4.258 4.464 0.194 10 0 "[ . 1 . 2]" 1
227 1 27 LYS HB3 1 104 LEU H . . 5.260 4.172 3.738 4.635 . 0 0 "[ . 1 . 2]" 1
228 1 27 LYS HB3 1 105 ILE HA . . 4.520 3.510 2.790 3.961 . 0 0 "[ . 1 . 2]" 1
229 1 27 LYS HB3 1 106 PRO HD2 . . 4.270 3.894 3.586 4.286 0.016 16 0 "[ . 1 . 2]" 1
230 1 27 LYS HB3 1 106 PRO HD3 . . 3.850 2.333 2.027 2.662 . 0 0 "[ . 1 . 2]" 1
231 1 27 LYS HB3 1 106 PRO HG3 . . 4.920 3.081 2.682 3.550 . 0 0 "[ . 1 . 2]" 1
232 1 27 LYS HD2 1 27 LYS HG3 . . 3.020 2.454 2.372 2.647 . 0 0 "[ . 1 . 2]" 1
233 1 27 LYS HD2 1 106 PRO HB3 . . 4.100 3.872 2.909 5.054 0.954 10 1 "[ . + . 2]" 1
234 1 27 LYS HD2 1 106 PRO HD3 . . 5.260 3.755 2.770 5.154 . 0 0 "[ . 1 . 2]" 1
235 1 27 LYS HD2 1 106 PRO HG3 . . 3.850 2.424 2.128 4.215 0.365 10 0 "[ . 1 . 2]" 1
236 1 27 LYS HD3 1 27 LYS HG2 . . 2.990 2.589 2.379 3.056 0.066 10 0 "[ . 1 . 2]" 1
237 1 27 LYS HD3 1 28 ILE H . . 5.500 5.023 4.233 5.778 0.278 10 0 "[ . 1 . 2]" 1
238 1 27 LYS HD3 1 29 VAL QG . . 3.530 2.678 2.152 3.695 0.165 10 0 "[ . 1 . 2]" 1
239 1 27 LYS HE2 1 27 LYS HG2 . . 4.030 3.090 2.851 3.459 . 0 0 "[ . 1 . 2]" 1
240 1 27 LYS HE2 1 27 LYS HG3 . . 4.180 3.591 2.439 3.962 . 0 0 "[ . 1 . 2]" 1
241 1 27 LYS HE2 1 29 VAL QG . . 4.100 2.435 1.883 3.820 . 0 0 "[ . 1 . 2]" 1
242 1 27 LYS HE3 1 27 LYS HG2 . . 4.180 2.524 2.251 3.821 . 0 0 "[ . 1 . 2]" 1
243 1 27 LYS HE3 1 29 VAL QG . . 4.100 3.166 1.911 3.747 . 0 0 "[ . 1 . 2]" 1
244 1 27 LYS HG2 1 28 ILE H . . 4.690 2.988 2.662 3.193 . 0 0 "[ . 1 . 2]" 1
245 1 27 LYS HG2 1 29 VAL QG . . 3.960 3.262 2.329 3.631 . 0 0 "[ . 1 . 2]" 1
246 1 27 LYS HG2 1 106 PRO HD3 . . 4.920 4.829 4.535 4.978 0.058 10 0 "[ . 1 . 2]" 1
247 1 27 LYS HG3 1 28 ILE H . . 4.430 4.217 3.565 4.449 0.019 12 0 "[ . 1 . 2]" 1
248 1 28 ILE H 1 28 ILE HB . . 3.520 2.334 2.183 2.447 . 0 0 "[ . 1 . 2]" 1
249 1 28 ILE H 1 28 ILE MD . . 4.100 2.310 1.853 3.744 . 0 0 "[ . 1 . 2]" 1
250 1 28 ILE H 1 28 ILE HG12 . . 4.520 4.003 3.731 4.182 . 0 0 "[ . 1 . 2]" 1
251 1 28 ILE H 1 28 ILE HG13 . . 4.020 3.205 2.451 3.457 . 0 0 "[ . 1 . 2]" 1
252 1 28 ILE H 1 28 ILE MG . . 4.270 3.701 3.596 3.760 . 0 0 "[ . 1 . 2]" 1
253 1 28 ILE H 1 29 VAL H . . 5.050 4.543 4.341 4.622 . 0 0 "[ . 1 . 2]" 1
254 1 28 ILE HA 1 28 ILE MD . . 3.960 3.377 3.110 3.837 . 0 0 "[ . 1 . 2]" 1
255 1 28 ILE HA 1 28 ILE HG12 . . 3.900 3.334 2.428 3.601 . 0 0 "[ . 1 . 2]" 1
256 1 28 ILE HA 1 28 ILE HG13 . . 3.960 2.370 2.230 2.888 . 0 0 "[ . 1 . 2]" 1
257 1 28 ILE HA 1 28 ILE MG . . 3.280 2.412 2.325 2.570 . 0 0 "[ . 1 . 2]" 1
258 1 28 ILE HA 1 29 VAL H . . 3.120 2.235 2.176 2.362 . 0 0 "[ . 1 . 2]" 1
259 1 28 ILE HA 1 29 VAL QG . . 3.760 3.079 2.937 3.214 . 0 0 "[ . 1 . 2]" 1
260 1 28 ILE HA 1 103 VAL HA . . 3.650 2.443 2.300 2.626 . 0 0 "[ . 1 . 2]" 1
261 1 28 ILE HA 1 103 VAL MG1 . . 4.520 3.645 3.288 4.003 . 0 0 "[ . 1 . 2]" 1
262 1 28 ILE HA 1 103 VAL MG2 . . 4.180 3.241 2.906 3.615 . 0 0 "[ . 1 . 2]" 1
263 1 28 ILE HA 1 104 LEU H . . 4.420 3.516 3.195 3.846 . 0 0 "[ . 1 . 2]" 1
264 1 28 ILE HB 1 28 ILE MD . . 3.300 2.050 1.952 2.343 . 0 0 "[ . 1 . 2]" 1
265 1 28 ILE HB 1 29 VAL H . . 5.030 4.239 3.902 4.505 . 0 0 "[ . 1 . 2]" 1
266 1 28 ILE MD 1 103 VAL HA . . 4.180 4.101 3.891 4.207 0.027 18 0 "[ . 1 . 2]" 1
267 1 28 ILE HG12 1 28 ILE MG . . 3.390 2.104 1.989 2.467 . 0 0 "[ . 1 . 2]" 1
268 1 28 ILE HG12 1 29 VAL H . . 5.260 4.926 4.089 5.285 0.025 10 0 "[ . 1 . 2]" 1
269 1 28 ILE HG12 1 103 VAL HA . . 4.380 4.088 2.501 4.392 0.012 7 0 "[ . 1 . 2]" 1
270 1 28 ILE HG12 1 103 VAL MG2 . . 3.460 2.767 1.838 3.243 . 0 0 "[ . 1 . 2]" 1
271 1 28 ILE HG13 1 28 ILE MG . . 3.460 2.829 2.648 3.231 . 0 0 "[ . 1 . 2]" 1
272 1 28 ILE HG13 1 29 VAL H . . 4.900 4.378 4.149 4.923 0.023 2 0 "[ . 1 . 2]" 1
273 1 28 ILE HG13 1 103 VAL HA . . 4.690 2.864 2.659 3.508 . 0 0 "[ . 1 . 2]" 1
274 1 28 ILE HG13 1 103 VAL MG1 . . 4.100 2.381 1.962 2.832 . 0 0 "[ . 1 . 2]" 1
275 1 28 ILE HG13 1 103 VAL MG2 . . 3.960 2.627 2.067 3.328 . 0 0 "[ . 1 . 2]" 1
276 1 28 ILE MG 1 29 VAL H . . 3.620 2.354 1.911 2.936 . 0 0 "[ . 1 . 2]" 1
277 1 28 ILE MG 1 30 ARG H . . 4.980 3.952 3.801 4.080 . 0 0 "[ . 1 . 2]" 1
278 1 28 ILE MG 1 30 ARG HD2 . . 4.690 4.709 4.078 5.264 0.574 6 1 "[ .+ 1 . 2]" 1
279 1 28 ILE MG 1 30 ARG HD3 . . 5.260 4.737 4.363 5.273 0.013 1 0 "[ . 1 . 2]" 1
280 1 28 ILE MG 1 101 THR HA . . 4.920 3.393 3.196 3.557 . 0 0 "[ . 1 . 2]" 1
281 1 28 ILE MG 1 101 THR HB . . 4.920 4.122 3.808 4.292 . 0 0 "[ . 1 . 2]" 1
282 1 28 ILE MG 1 101 THR MG . . 2.910 1.744 1.635 1.873 . 0 0 "[ . 1 . 2]" 1
283 1 28 ILE MG 1 102 PHE H . . 4.800 3.591 3.257 3.743 . 0 0 "[ . 1 . 2]" 1
284 1 28 ILE MG 1 102 PHE QD . . 5.260 5.283 5.245 5.346 0.086 14 0 "[ . 1 . 2]" 1
285 1 28 ILE MG 1 103 VAL HA . . 4.520 3.843 3.394 4.147 . 0 0 "[ . 1 . 2]" 1
286 1 29 VAL H 1 29 VAL QG . . 3.530 2.014 1.870 2.287 . 0 0 "[ . 1 . 2]" 1
287 1 29 VAL H 1 30 ARG H . . 5.260 4.150 3.997 4.307 . 0 0 "[ . 1 . 2]" 1
288 1 29 VAL H 1 101 THR MG . . 4.520 3.609 3.288 3.964 . 0 0 "[ . 1 . 2]" 1
289 1 29 VAL H 1 102 PHE H . . 4.170 2.993 2.703 3.239 . 0 0 "[ . 1 . 2]" 1
290 1 29 VAL H 1 102 PHE HB2 . . 4.890 3.059 2.840 3.267 . 0 0 "[ . 1 . 2]" 1
291 1 29 VAL H 1 102 PHE HB3 . . 5.260 4.113 3.910 4.283 . 0 0 "[ . 1 . 2]" 1
292 1 29 VAL H 1 103 VAL HA . . 4.640 3.737 3.483 4.037 . 0 0 "[ . 1 . 2]" 1
293 1 29 VAL H 1 104 LEU H . . 5.350 4.403 3.888 4.776 . 0 0 "[ . 1 . 2]" 1
294 1 29 VAL HA 1 29 VAL QG . . 3.120 2.099 1.935 2.150 . 0 0 "[ . 1 . 2]" 1
295 1 29 VAL HA 1 30 ARG H . . 3.300 2.183 2.181 2.186 . 0 0 "[ . 1 . 2]" 1
296 1 29 VAL HB 1 30 ARG H . . 3.960 3.673 3.608 3.762 . 0 0 "[ . 1 . 2]" 1
297 1 29 VAL HB 1 66 LEU HB2 . . 4.690 2.815 2.483 3.059 . 0 0 "[ . 1 . 2]" 1
298 1 29 VAL HB 1 66 LEU HB3 . . 4.270 2.007 1.921 2.141 . 0 0 "[ . 1 . 2]" 1
299 1 29 VAL HB 1 66 LEU QD . . 3.220 2.086 1.872 3.011 . 0 0 "[ . 1 . 2]" 1
300 1 29 VAL HB 1 67 LEU QD . . 4.520 3.971 3.517 4.379 . 0 0 "[ . 1 . 2]" 1
301 1 29 VAL HB 1 102 PHE H . . 5.260 4.435 4.166 4.656 . 0 0 "[ . 1 . 2]" 1
302 1 29 VAL HB 1 102 PHE HB2 . . 4.380 3.402 3.074 3.581 . 0 0 "[ . 1 . 2]" 1
303 1 29 VAL HB 1 102 PHE HB3 . . 4.920 4.740 4.435 4.927 0.007 11 0 "[ . 1 . 2]" 1
304 1 29 VAL QG 1 30 ARG H . . 3.900 3.434 3.359 3.501 . 0 0 "[ . 1 . 2]" 1
305 1 29 VAL QG 1 66 LEU HA . . 3.010 2.964 2.886 3.011 0.001 2 0 "[ . 1 . 2]" 1
306 1 29 VAL QG 1 66 LEU HB2 . . 3.590 3.049 2.859 3.204 . 0 0 "[ . 1 . 2]" 1
307 1 29 VAL QG 1 66 LEU HB3 . . 3.560 1.894 1.825 1.950 . 0 0 "[ . 1 . 2]" 1
308 1 29 VAL QG 1 66 LEU QD . . 3.590 2.114 1.771 2.445 . 0 0 "[ . 1 . 2]" 1
309 1 29 VAL QG 1 67 LEU QD . . 3.500 2.821 2.436 3.118 . 0 0 "[ . 1 . 2]" 1
310 1 29 VAL QG 1 102 PHE H . . 4.140 3.292 3.047 3.529 . 0 0 "[ . 1 . 2]" 1
311 1 29 VAL QG 1 102 PHE HB2 . . 3.390 1.980 1.932 2.213 . 0 0 "[ . 1 . 2]" 1
312 1 29 VAL QG 1 102 PHE HB3 . . 3.810 2.681 2.420 2.897 . 0 0 "[ . 1 . 2]" 1
313 1 29 VAL QG 1 102 PHE QD . . 4.270 3.732 3.617 3.953 . 0 0 "[ . 1 . 2]" 1
314 1 30 ARG H 1 30 ARG HB2 . . 3.900 2.325 2.116 2.550 . 0 0 "[ . 1 . 2]" 1
315 1 30 ARG H 1 30 ARG HB3 . . 4.180 3.536 3.362 3.643 . 0 0 "[ . 1 . 2]" 1
316 1 30 ARG H 1 30 ARG HD2 . . 5.260 4.265 3.713 5.017 . 0 0 "[ . 1 . 2]" 1
317 1 30 ARG H 1 30 ARG HD3 . . 5.220 4.973 4.437 5.282 0.062 4 0 "[ . 1 . 2]" 1
318 1 30 ARG H 1 30 ARG HG3 . . 3.780 2.881 2.316 3.525 . 0 0 "[ . 1 . 2]" 1
319 1 30 ARG H 1 31 ILE H . . 5.110 4.391 4.300 4.502 . 0 0 "[ . 1 . 2]" 1
320 1 30 ARG H 1 99 THR MG . . 4.840 4.878 4.747 4.944 0.104 5 0 "[ . 1 . 2]" 1
321 1 30 ARG H 1 101 THR HA . . 4.920 4.528 4.296 4.794 . 0 0 "[ . 1 . 2]" 1
322 1 30 ARG HA 1 30 ARG HD2 . . 5.260 4.537 4.428 4.739 . 0 0 "[ . 1 . 2]" 1
323 1 30 ARG HA 1 30 ARG HD3 . . 4.920 4.550 4.169 4.757 . 0 0 "[ . 1 . 2]" 1
324 1 30 ARG HA 1 30 ARG HG3 . . 3.330 2.709 2.147 3.291 . 0 0 "[ . 1 . 2]" 1
325 1 30 ARG HA 1 31 ILE H . . 3.100 2.232 2.226 2.254 . 0 0 "[ . 1 . 2]" 1
326 1 30 ARG HA 1 31 ILE HA . . 4.920 4.415 4.410 4.431 . 0 0 "[ . 1 . 2]" 1
327 1 30 ARG HA 1 31 ILE HB . . 4.920 4.487 4.286 4.651 . 0 0 "[ . 1 . 2]" 1
328 1 30 ARG HA 1 31 ILE HG13 . . 5.260 4.059 3.720 4.418 . 0 0 "[ . 1 . 2]" 1
329 1 30 ARG HA 1 99 THR MG . . 4.380 3.585 3.286 3.883 . 0 0 "[ . 1 . 2]" 1
330 1 30 ARG HA 1 101 THR HA . . 3.530 2.375 2.097 2.702 . 0 0 "[ . 1 . 2]" 1
331 1 30 ARG HA 1 101 THR MG . . 4.520 4.015 3.516 4.387 . 0 0 "[ . 1 . 2]" 1
332 1 30 ARG HA 1 102 PHE H . . 4.270 2.984 2.785 3.582 . 0 0 "[ . 1 . 2]" 1
333 1 30 ARG HB2 1 30 ARG HD3 . . 4.180 3.268 2.372 3.702 . 0 0 "[ . 1 . 2]" 1
334 1 30 ARG HB2 1 31 ILE H . . 5.260 4.479 4.200 4.671 . 0 0 "[ . 1 . 2]" 1
335 1 30 ARG HB2 1 99 THR MG . . 4.270 3.286 2.953 3.640 . 0 0 "[ . 1 . 2]" 1
336 1 30 ARG HB3 1 30 ARG HD3 . . 4.100 3.073 2.370 3.877 . 0 0 "[ . 1 . 2]" 1
337 1 30 ARG HB3 1 31 ILE H . . 4.000 3.665 3.379 3.965 . 0 0 "[ . 1 . 2]" 1
338 1 30 ARG HB3 1 99 THR MG . . 3.190 1.966 1.916 2.311 . 0 0 "[ . 1 . 2]" 1
339 1 30 ARG HD2 1 99 THR MG . . 3.960 3.513 2.694 3.973 0.013 1 0 "[ . 1 . 2]" 1
340 1 30 ARG HD3 1 99 THR MG . . 3.760 3.302 2.756 3.791 0.031 12 0 "[ . 1 . 2]" 1
341 1 30 ARG HG2 1 31 ILE H . . 4.690 4.427 3.903 4.719 0.029 11 0 "[ . 1 . 2]" 1
342 1 30 ARG HG3 1 101 THR HA . . 3.960 3.034 2.392 3.969 0.009 16 0 "[ . 1 . 2]" 1
343 1 30 ARG HG3 1 101 THR MG . . 3.850 3.000 1.993 3.811 . 0 0 "[ . 1 . 2]" 1
344 1 30 ARG HG3 1 102 PHE H . . 5.260 4.410 3.943 5.034 . 0 0 "[ . 1 . 2]" 1
345 1 31 ILE H 1 31 ILE HB . . 3.650 2.413 2.319 2.549 . 0 0 "[ . 1 . 2]" 1
346 1 31 ILE H 1 31 ILE MD . . 4.910 3.961 3.680 4.360 . 0 0 "[ . 1 . 2]" 1
347 1 31 ILE H 1 31 ILE HG12 . . 4.300 4.039 3.814 4.268 . 0 0 "[ . 1 . 2]" 1
348 1 31 ILE H 1 31 ILE HG13 . . 4.340 2.942 2.668 3.411 . 0 0 "[ . 1 . 2]" 1
349 1 31 ILE H 1 31 ILE MG . . 4.310 3.699 3.542 3.803 . 0 0 "[ . 1 . 2]" 1
350 1 31 ILE H 1 32 GLU H . . 4.700 4.491 4.413 4.538 . 0 0 "[ . 1 . 2]" 1
351 1 31 ILE H 1 99 THR MG . . 4.270 3.734 3.575 3.911 . 0 0 "[ . 1 . 2]" 1
352 1 31 ILE H 1 100 LEU H . . 4.220 3.142 2.872 3.390 . 0 0 "[ . 1 . 2]" 1
353 1 31 ILE H 1 100 LEU HB2 . . 5.260 3.842 3.787 3.900 . 0 0 "[ . 1 . 2]" 1
354 1 31 ILE H 1 100 LEU HB3 . . 5.260 5.269 5.174 5.317 0.057 8 0 "[ . 1 . 2]" 1
355 1 31 ILE H 1 101 THR HA . . 4.180 3.894 3.686 4.053 . 0 0 "[ . 1 . 2]" 1
356 1 31 ILE H 1 102 PHE H . . 5.040 3.814 3.575 4.102 . 0 0 "[ . 1 . 2]" 1
357 1 31 ILE H 1 102 PHE QD . . 5.200 2.586 2.259 3.228 . 0 0 "[ . 1 . 2]" 1
358 1 31 ILE H 1 102 PHE QE . . 5.500 3.110 2.576 4.173 . 0 0 "[ . 1 . 2]" 1
359 1 31 ILE HA 1 31 ILE MD . . 3.810 3.784 3.625 3.886 0.076 18 0 "[ . 1 . 2]" 1
360 1 31 ILE HA 1 31 ILE HG12 . . 3.960 2.457 2.181 2.701 . 0 0 "[ . 1 . 2]" 1
361 1 31 ILE HA 1 31 ILE HG13 . . 4.100 2.860 2.708 2.986 . 0 0 "[ . 1 . 2]" 1
362 1 31 ILE HA 1 31 ILE MG . . 3.280 2.515 2.416 2.673 . 0 0 "[ . 1 . 2]" 1
363 1 31 ILE HA 1 32 GLU H . . 2.930 2.244 2.214 2.329 . 0 0 "[ . 1 . 2]" 1
364 1 31 ILE HA 1 32 GLU QG . . 4.100 3.742 3.593 3.836 . 0 0 "[ . 1 . 2]" 1
365 1 31 ILE HA 1 66 LEU QD . . 2.800 2.758 2.562 2.920 0.120 20 0 "[ . 1 . 2]" 1
366 1 31 ILE HA 1 66 LEU HG . . 4.520 4.491 4.302 4.565 0.045 3 0 "[ . 1 . 2]" 1
367 1 31 ILE HB 1 31 ILE MD . . 3.460 2.334 2.100 2.491 . 0 0 "[ . 1 . 2]" 1
368 1 31 ILE HB 1 32 GLU H . . 4.380 4.226 3.918 4.401 0.021 4 0 "[ . 1 . 2]" 1
369 1 31 ILE HB 1 64 SER HB3 . . 5.260 5.182 4.434 5.430 0.170 4 0 "[ . 1 . 2]" 1
370 1 31 ILE HB 1 100 LEU H . . 5.260 4.076 3.823 4.208 . 0 0 "[ . 1 . 2]" 1
371 1 31 ILE HB 1 102 PHE QD . . 4.920 3.017 2.655 3.380 . 0 0 "[ . 1 . 2]" 1
372 1 31 ILE HB 1 102 PHE QE . . 4.270 2.255 1.998 2.839 . 0 0 "[ . 1 . 2]" 1
373 1 31 ILE MD 1 31 ILE MG . . 2.920 1.970 1.852 2.264 . 0 0 "[ . 1 . 2]" 1
374 1 31 ILE MD 1 32 GLU H . . 4.890 4.902 4.596 4.955 0.065 11 0 "[ . 1 . 2]" 1
375 1 31 ILE MD 1 60 ALA MB . . 4.270 3.904 3.376 4.259 . 0 0 "[ . 1 . 2]" 1
376 1 31 ILE MD 1 61 ALA H . . 4.940 4.367 4.046 4.799 . 0 0 "[ . 1 . 2]" 1
377 1 31 ILE MD 1 61 ALA HA . . 3.680 2.273 1.968 2.571 . 0 0 "[ . 1 . 2]" 1
378 1 31 ILE MD 1 64 SER H . . 5.070 4.418 3.649 4.871 . 0 0 "[ . 1 . 2]" 1
379 1 31 ILE MD 1 64 SER HB2 . . 4.180 3.457 2.210 3.924 . 0 0 "[ . 1 . 2]" 1
380 1 31 ILE MD 1 64 SER HB3 . . 4.100 3.720 3.118 4.094 . 0 0 "[ . 1 . 2]" 1
381 1 31 ILE MD 1 66 LEU H . . 4.520 2.793 2.345 3.199 . 0 0 "[ . 1 . 2]" 1
382 1 31 ILE MD 1 66 LEU HB2 . . 4.690 1.960 1.816 2.179 . 0 0 "[ . 1 . 2]" 1
383 1 31 ILE MD 1 66 LEU HB3 . . 3.650 3.370 3.018 3.628 . 0 0 "[ . 1 . 2]" 1
384 1 31 ILE MD 1 66 LEU QD . . 3.180 2.893 2.677 3.114 . 0 0 "[ . 1 . 2]" 1
385 1 31 ILE MD 1 66 LEU HG . . 3.900 3.025 2.320 3.963 0.063 20 0 "[ . 1 . 2]" 1
386 1 31 ILE MD 1 67 LEU H . . 4.620 3.446 3.117 3.791 . 0 0 "[ . 1 . 2]" 1
387 1 31 ILE MD 1 67 LEU HB2 . . 4.180 3.761 3.452 4.128 . 0 0 "[ . 1 . 2]" 1
388 1 31 ILE MD 1 67 LEU QD . . 3.060 1.687 1.588 1.854 . 0 0 "[ . 1 . 2]" 1
389 1 31 ILE MD 1 102 PHE QD . . 4.380 3.401 2.982 4.154 . 0 0 "[ . 1 . 2]" 1
390 1 31 ILE MD 1 102 PHE QE . . 3.810 3.400 2.957 3.801 . 0 0 "[ . 1 . 2]" 1
391 1 31 ILE HG12 1 31 ILE MG . . 3.370 2.418 2.307 2.636 . 0 0 "[ . 1 . 2]" 1
392 1 31 ILE HG12 1 32 GLU H . . 5.040 4.129 3.814 4.365 . 0 0 "[ . 1 . 2]" 1
393 1 31 ILE HG12 1 64 SER HB3 . . 5.260 2.916 1.954 3.284 . 0 0 "[ . 1 . 2]" 1
394 1 31 ILE HG12 1 67 LEU QD . . 4.920 3.829 3.494 4.118 . 0 0 "[ . 1 . 2]" 1
395 1 31 ILE HG13 1 31 ILE MG . . 3.680 3.228 3.213 3.240 . 0 0 "[ . 1 . 2]" 1
396 1 31 ILE HG13 1 32 GLU H . . 4.940 4.931 4.786 5.052 0.112 20 0 "[ . 1 . 2]" 1
397 1 31 ILE HG13 1 64 SER HB3 . . 5.260 4.618 3.687 4.981 . 0 0 "[ . 1 . 2]" 1
398 1 31 ILE HG13 1 67 LEU QD . . 4.690 3.616 3.024 3.937 . 0 0 "[ . 1 . 2]" 1
399 1 31 ILE HG13 1 102 PHE QD . . 4.920 3.445 2.890 3.875 . 0 0 "[ . 1 . 2]" 1
400 1 31 ILE HG13 1 102 PHE QE . . 4.690 4.239 3.719 4.707 0.017 12 0 "[ . 1 . 2]" 1
401 1 31 ILE MG 1 32 GLU H . . 3.720 2.304 2.069 2.670 . 0 0 "[ . 1 . 2]" 1
402 1 31 ILE MG 1 60 ALA H . . 5.300 5.018 4.712 5.309 0.009 20 0 "[ . 1 . 2]" 1
403 1 31 ILE MG 1 60 ALA HA . . 5.260 3.979 3.463 4.438 . 0 0 "[ . 1 . 2]" 1
404 1 31 ILE MG 1 60 ALA MB . . 3.370 2.390 1.922 2.717 . 0 0 "[ . 1 . 2]" 1
405 1 31 ILE MG 1 61 ALA HA . . 4.270 3.040 2.588 3.448 . 0 0 "[ . 1 . 2]" 1
406 1 31 ILE MG 1 64 SER H . . 4.920 3.863 3.543 4.420 . 0 0 "[ . 1 . 2]" 1
407 1 31 ILE MG 1 64 SER HB2 . . 4.380 3.489 2.977 3.870 . 0 0 "[ . 1 . 2]" 1
408 1 31 ILE MG 1 64 SER HB3 . . 4.380 2.769 2.083 3.987 . 0 0 "[ . 1 . 2]" 1
409 1 31 ILE MG 1 65 GLY H . . 5.500 4.959 4.523 5.490 . 0 0 "[ . 1 . 2]" 1
410 1 31 ILE MG 1 67 LEU QD . . 3.900 3.378 3.118 3.757 . 0 0 "[ . 1 . 2]" 1
411 1 31 ILE MG 1 102 PHE QD . . 4.920 4.461 4.134 4.785 . 0 0 "[ . 1 . 2]" 1
412 1 31 ILE MG 1 102 PHE QE . . 4.270 3.295 3.007 3.865 . 0 0 "[ . 1 . 2]" 1
413 1 32 GLU H 1 32 GLU HB2 . . 3.270 2.474 2.362 3.629 0.359 16 0 "[ . 1 . 2]" 1
414 1 32 GLU H 1 32 GLU HB3 . . 3.720 3.568 2.976 3.627 . 0 0 "[ . 1 . 2]" 1
415 1 32 GLU H 1 32 GLU QG . . 3.670 2.587 1.987 2.781 . 0 0 "[ . 1 . 2]" 1
416 1 32 GLU H 1 33 LYS H . . 5.130 4.405 4.152 4.544 . 0 0 "[ . 1 . 2]" 1
417 1 32 GLU H 1 100 LEU H . . 5.420 5.024 4.669 5.119 . 0 0 "[ . 1 . 2]" 1
418 1 32 GLU HA 1 32 GLU QG . . 3.720 2.308 2.190 3.323 . 0 0 "[ . 1 . 2]" 1
419 1 32 GLU HA 1 33 LYS H . . 3.090 2.212 2.202 2.263 . 0 0 "[ . 1 . 2]" 1
420 1 32 GLU HA 1 99 THR HA . . 3.410 2.169 1.915 2.279 . 0 0 "[ . 1 . 2]" 1
421 1 32 GLU HA 1 99 THR MG . . 4.100 3.381 3.041 3.496 . 0 0 "[ . 1 . 2]" 1
422 1 32 GLU HA 1 100 LEU H . . 4.380 3.519 3.056 3.645 . 0 0 "[ . 1 . 2]" 1
423 1 32 GLU HB2 1 32 GLU QG . . 2.800 2.280 2.233 2.553 . 0 0 "[ . 1 . 2]" 1
424 1 32 GLU HB2 1 33 LYS H . . 4.690 4.368 3.207 4.594 . 0 0 "[ . 1 . 2]" 1
425 1 32 GLU HB3 1 33 LYS H . . 4.690 3.653 3.299 4.128 . 0 0 "[ . 1 . 2]" 1
426 1 32 GLU HB3 1 99 THR HA . . 4.380 4.335 2.875 4.448 0.068 8 0 "[ . 1 . 2]" 1
427 1 32 GLU HB3 1 99 THR MG . . 4.690 4.423 2.135 4.699 0.009 13 0 "[ . 1 . 2]" 1
428 1 32 GLU QG 1 33 LYS H . . 4.380 4.230 4.116 4.310 . 0 0 "[ . 1 . 2]" 1
429 1 32 GLU QG 1 99 THR HA . . 4.920 2.895 2.575 4.290 . 0 0 "[ . 1 . 2]" 1
430 1 32 GLU QG 1 99 THR MG . . 4.270 2.167 1.891 3.284 . 0 0 "[ . 1 . 2]" 1
431 1 33 LYS H 1 33 LYS HB2 . . 3.720 2.607 2.383 3.175 . 0 0 "[ . 1 . 2]" 1
432 1 33 LYS H 1 33 LYS HB3 . . 4.020 3.197 2.629 3.698 . 0 0 "[ . 1 . 2]" 1
433 1 33 LYS H 1 33 LYS HD2 . . 5.500 5.402 4.714 5.613 0.113 8 0 "[ . 1 . 2]" 1
434 1 33 LYS H 1 33 LYS HG2 . . 5.260 4.569 4.439 4.713 . 0 0 "[ . 1 . 2]" 1
435 1 33 LYS H 1 33 LYS HG3 . . 4.690 4.083 3.537 4.694 0.004 7 0 "[ . 1 . 2]" 1
436 1 33 LYS H 1 34 ALA H . . 4.300 4.397 4.241 4.538 0.238 11 0 "[ . 1 . 2]" 1
437 1 33 LYS H 1 98 GLY HA2 . . 5.500 3.097 2.637 3.754 . 0 0 "[ . 1 . 2]" 1
438 1 33 LYS H 1 98 GLY HA3 . . 5.300 4.217 3.822 4.682 . 0 0 "[ . 1 . 2]" 1
439 1 33 LYS H 1 99 THR H . . 4.700 4.213 3.922 4.684 . 0 0 "[ . 1 . 2]" 1
440 1 33 LYS H 1 99 THR HA . . 4.130 3.422 3.033 3.840 . 0 0 "[ . 1 . 2]" 1
441 1 33 LYS H 1 99 THR MG . . 5.080 5.013 4.672 5.122 0.042 17 0 "[ . 1 . 2]" 1
442 1 33 LYS H 1 100 LEU H . . 5.000 3.864 3.481 4.231 . 0 0 "[ . 1 . 2]" 1
443 1 33 LYS H 1 100 LEU QD . . 4.510 2.804 2.090 3.052 . 0 0 "[ . 1 . 2]" 1
444 1 33 LYS H 1 100 LEU HG . . 4.600 4.120 3.660 4.430 . 0 0 "[ . 1 . 2]" 1
445 1 33 LYS HA 1 33 LYS HD2 . . 4.690 4.466 4.212 4.656 . 0 0 "[ . 1 . 2]" 1
446 1 33 LYS HA 1 33 LYS HG2 . . 4.180 2.629 2.322 3.189 . 0 0 "[ . 1 . 2]" 1
447 1 33 LYS HA 1 33 LYS HG3 . . 3.760 2.416 2.174 2.870 . 0 0 "[ . 1 . 2]" 1
448 1 33 LYS HA 1 34 ALA H . . 3.000 2.256 2.177 2.427 . 0 0 "[ . 1 . 2]" 1
449 1 33 LYS HA 1 37 ILE MD . . 4.690 4.727 4.660 4.777 0.087 8 0 "[ . 1 . 2]" 1
450 1 33 LYS HA 1 37 ILE MG . . 4.520 2.938 2.624 3.377 . 0 0 "[ . 1 . 2]" 1
451 1 33 LYS HA 1 100 LEU QD . . 4.690 4.070 3.748 4.322 . 0 0 "[ . 1 . 2]" 1
452 1 33 LYS HB2 1 33 LYS QE . . 3.900 3.477 2.654 3.937 0.037 19 0 "[ . 1 . 2]" 1
453 1 33 LYS HB2 1 34 ALA H . . 5.020 4.371 3.977 4.610 . 0 0 "[ . 1 . 2]" 1
454 1 33 LYS HB2 1 97 HIS HA . . 4.380 3.864 3.214 4.636 0.256 13 0 "[ . 1 . 2]" 1
455 1 33 LYS HB2 1 98 GLY H . . 4.500 3.687 3.016 5.126 0.626 13 1 "[ . 1 + . 2]" 1
456 1 33 LYS HB2 1 100 LEU QD . . 3.350 1.946 1.756 2.209 . 0 0 "[ . 1 . 2]" 1
457 1 33 LYS HB3 1 33 LYS QE . . 4.690 3.033 2.011 4.193 . 0 0 "[ . 1 . 2]" 1
458 1 33 LYS HB3 1 34 ALA H . . 5.260 3.604 2.945 4.393 . 0 0 "[ . 1 . 2]" 1
459 1 33 LYS HB3 1 97 HIS HA . . 4.690 2.982 2.560 3.757 . 0 0 "[ . 1 . 2]" 1
460 1 33 LYS HB3 1 100 LEU QD . . 4.180 2.574 1.914 3.540 . 0 0 "[ . 1 . 2]" 1
461 1 33 LYS HD2 1 37 ILE MG . . 4.690 4.178 3.689 4.610 . 0 0 "[ . 1 . 2]" 1
462 1 33 LYS HD2 1 39 LEU H . . 5.260 5.260 4.924 5.995 0.735 13 1 "[ . 1 + . 2]" 1
463 1 33 LYS HD2 1 39 LEU HA . . 4.690 3.403 2.799 4.944 0.254 13 0 "[ . 1 . 2]" 1
464 1 33 LYS HD2 1 39 LEU QD . . 4.380 2.466 1.916 3.620 . 0 0 "[ . 1 . 2]" 1
465 1 33 LYS HD2 1 100 LEU QD . . 4.270 3.090 1.947 3.551 . 0 0 "[ . 1 . 2]" 1
466 1 33 LYS HD3 1 39 LEU HA . . 4.920 4.548 4.285 4.930 0.010 19 0 "[ . 1 . 2]" 1
467 1 33 LYS HD3 1 98 GLY H . . 5.260 5.277 4.958 5.559 0.299 13 0 "[ . 1 . 2]" 1
468 1 33 LYS HD3 1 100 LEU QD . . 3.680 2.470 1.907 3.905 0.225 13 0 "[ . 1 . 2]" 1
469 1 33 LYS QE 1 33 LYS HG3 . . 3.850 2.981 1.992 3.520 . 0 0 "[ . 1 . 2]" 1
470 1 33 LYS QE 1 38 PRO HA . . 4.030 3.667 3.294 3.889 . 0 0 "[ . 1 . 2]" 1
471 1 33 LYS QE 1 39 LEU H . . 4.380 3.328 2.647 4.205 . 0 0 "[ . 1 . 2]" 1
472 1 33 LYS QE 1 39 LEU HA . . 4.380 2.562 1.913 3.881 . 0 0 "[ . 1 . 2]" 1
473 1 33 LYS QE 1 39 LEU QD . . 4.380 2.525 1.810 3.841 . 0 0 "[ . 1 . 2]" 1
474 1 33 LYS QE 1 100 LEU QD . . 3.900 3.425 3.296 3.581 . 0 0 "[ . 1 . 2]" 1
475 1 33 LYS HG2 1 34 ALA H . . 4.920 3.218 2.191 4.139 . 0 0 "[ . 1 . 2]" 1
476 1 33 LYS HG2 1 37 ILE HB . . 5.260 3.550 2.817 4.191 . 0 0 "[ . 1 . 2]" 1
477 1 33 LYS HG2 1 39 LEU HA . . 5.500 4.391 3.435 5.512 0.012 2 0 "[ . 1 . 2]" 1
478 1 33 LYS HG2 1 100 LEU QD . . 4.920 3.918 3.492 4.117 . 0 0 "[ . 1 . 2]" 1
479 1 33 LYS HG3 1 34 ALA H . . 4.400 3.895 2.225 4.572 0.172 1 0 "[ . 1 . 2]" 1
480 1 33 LYS HG3 1 37 ILE HB . . 5.260 4.541 3.080 5.288 0.028 17 0 "[ . 1 . 2]" 1
481 1 33 LYS HG3 1 39 LEU HA . . 4.520 4.323 3.181 4.987 0.467 16 0 "[ . 1 . 2]" 1
482 1 33 LYS HG3 1 100 LEU QD . . 4.180 3.563 3.120 3.930 . 0 0 "[ . 1 . 2]" 1
483 1 34 ALA H 1 34 ALA MB . . 2.970 2.187 2.076 2.396 . 0 0 "[ . 1 . 2]" 1
484 1 34 ALA H 1 37 ILE H . . 5.500 3.757 3.355 4.082 . 0 0 "[ . 1 . 2]" 1
485 1 34 ALA H 1 37 ILE HB . . 4.520 1.967 1.889 2.505 . 0 0 "[ . 1 . 2]" 1
486 1 34 ALA H 1 37 ILE MD . . 4.380 3.972 3.832 4.320 . 0 0 "[ . 1 . 2]" 1
487 1 34 ALA H 1 37 ILE HG12 . . 5.260 4.197 3.848 5.283 0.023 19 0 "[ . 1 . 2]" 1
488 1 34 ALA H 1 37 ILE HG13 . . 4.920 3.028 2.546 4.092 . 0 0 "[ . 1 . 2]" 1
489 1 34 ALA H 1 37 ILE MG . . 4.550 2.703 2.382 3.072 . 0 0 "[ . 1 . 2]" 1
490 1 34 ALA HA 1 35 ARG H . . 3.270 2.526 2.225 2.569 . 0 0 "[ . 1 . 2]" 1
491 1 34 ALA HA 1 35 ARG HA . . 4.920 4.257 4.242 4.268 . 0 0 "[ . 1 . 2]" 1
492 1 34 ALA HA 1 37 ILE HB . . 5.260 4.103 3.847 4.650 . 0 0 "[ . 1 . 2]" 1
493 1 34 ALA HA 1 97 HIS HB2 . . 4.920 4.083 3.206 4.944 0.024 4 0 "[ . 1 . 2]" 1
494 1 34 ALA HA 1 97 HIS HB3 . . 4.920 4.658 3.440 4.948 0.028 14 0 "[ . 1 . 2]" 1
495 1 34 ALA HA 1 98 GLY H . . 4.600 3.665 3.042 4.030 . 0 0 "[ . 1 . 2]" 1
496 1 34 ALA MB 1 35 ARG H . . 3.590 2.473 2.342 3.098 . 0 0 "[ . 1 . 2]" 1
497 1 34 ALA MB 1 36 ASP HB2 . . 5.260 4.352 3.528 4.994 . 0 0 "[ . 1 . 2]" 1
498 1 34 ALA MB 1 36 ASP HB3 . . 5.260 4.195 3.657 4.895 . 0 0 "[ . 1 . 2]" 1
499 1 34 ALA MB 1 37 ILE H . . 3.590 2.960 2.483 3.495 . 0 0 "[ . 1 . 2]" 1
500 1 34 ALA MB 1 37 ILE HB . . 3.240 2.176 1.878 2.641 . 0 0 "[ . 1 . 2]" 1
501 1 34 ALA MB 1 37 ILE MD . . 3.460 3.338 3.220 3.495 0.035 11 0 "[ . 1 . 2]" 1
502 1 34 ALA MB 1 37 ILE MG . . 3.650 3.334 3.049 3.600 . 0 0 "[ . 1 . 2]" 1
503 1 34 ALA MB 1 98 GLY H . . 5.040 4.921 4.493 5.155 0.115 1 0 "[ . 1 . 2]" 1
504 1 35 ARG H 1 35 ARG HB2 . . 3.890 2.541 2.326 2.701 . 0 0 "[ . 1 . 2]" 1
505 1 35 ARG H 1 35 ARG HB3 . . 4.070 3.284 2.415 3.598 . 0 0 "[ . 1 . 2]" 1
506 1 35 ARG H 1 35 ARG HD3 . . 5.260 4.734 4.513 5.238 . 0 0 "[ . 1 . 2]" 1
507 1 35 ARG H 1 35 ARG HG2 . . 4.240 3.396 2.693 4.564 0.324 6 0 "[ . 1 . 2]" 1
508 1 35 ARG H 1 35 ARG HG3 . . 4.690 2.844 2.055 4.397 . 0 0 "[ . 1 . 2]" 1
509 1 35 ARG H 1 36 ASP H . . 4.650 2.852 2.606 4.131 . 0 0 "[ . 1 . 2]" 1
510 1 35 ARG H 1 37 ILE H . . 5.500 4.465 4.006 4.950 . 0 0 "[ . 1 . 2]" 1
511 1 35 ARG H 1 97 HIS HB2 . . 5.040 3.991 3.403 4.764 . 0 0 "[ . 1 . 2]" 1
512 1 35 ARG H 1 97 HIS HB3 . . 5.010 4.327 3.671 4.616 . 0 0 "[ . 1 . 2]" 1
513 1 35 ARG HA 1 35 ARG HD2 . . 4.520 4.140 3.642 4.812 0.292 3 0 "[ . 1 . 2]" 1
514 1 35 ARG HA 1 35 ARG HG2 . . 3.650 2.745 2.399 3.617 . 0 0 "[ . 1 . 2]" 1
515 1 35 ARG HA 1 36 ASP H . . 3.280 3.115 2.357 3.366 0.086 13 0 "[ . 1 . 2]" 1
516 1 35 ARG HA 1 36 ASP HA . . 4.690 4.380 4.275 4.475 . 0 0 "[ . 1 . 2]" 1
517 1 35 ARG HA 1 37 ILE H . . 4.380 4.044 3.813 4.214 . 0 0 "[ . 1 . 2]" 1
518 1 35 ARG HA 1 97 HIS HB2 . . 3.680 2.864 2.501 3.676 . 0 0 "[ . 1 . 2]" 1
519 1 35 ARG HA 1 97 HIS HB3 . . 4.180 2.272 2.023 3.023 . 0 0 "[ . 1 . 2]" 1
520 1 35 ARG HB2 1 35 ARG HD2 . . 3.850 2.860 2.178 3.244 . 0 0 "[ . 1 . 2]" 1
521 1 35 ARG HB2 1 36 ASP H . . 4.600 4.074 3.596 4.620 0.020 15 0 "[ . 1 . 2]" 1
522 1 35 ARG HB3 1 35 ARG HD2 . . 3.810 2.713 2.054 3.833 0.023 2 0 "[ . 1 . 2]" 1
523 1 35 ARG HB3 1 36 ASP H . . 4.090 4.330 3.490 4.625 0.535 4 2 "[ +. 1 . -]" 1
524 1 35 ARG HB3 1 97 HIS HB2 . . 5.260 4.489 4.074 5.003 . 0 0 "[ . 1 . 2]" 1
525 1 35 ARG HB3 1 97 HIS HB3 . . 4.920 4.461 4.041 5.262 0.342 2 0 "[ . 1 . 2]" 1
526 1 35 ARG HB3 1 97 HIS HD2 . . 5.260 3.820 2.629 5.250 . 0 0 "[ . 1 . 2]" 1
527 1 35 ARG HD2 1 97 HIS HD2 . . 4.690 3.991 2.636 5.588 0.898 3 1 "[ + . 1 . 2]" 1
528 1 35 ARG HG2 1 36 ASP H . . 4.890 4.888 4.796 4.957 0.067 6 0 "[ . 1 . 2]" 1
529 1 35 ARG HG2 1 97 HIS HB2 . . 5.260 3.294 2.214 6.024 0.764 12 1 "[ . 1 + . 2]" 1
530 1 35 ARG HG2 1 97 HIS HB3 . . 5.260 3.762 2.550 5.592 0.332 2 0 "[ . 1 . 2]" 1
531 1 35 ARG HG2 1 97 HIS HD2 . . 5.260 3.731 2.170 4.591 . 0 0 "[ . 1 . 2]" 1
532 1 35 ARG HG3 1 36 ASP H . . 4.920 4.777 4.493 4.927 0.007 13 0 "[ . 1 . 2]" 1
533 1 36 ASP H 1 36 ASP HB2 . . 4.100 3.365 2.856 4.054 . 0 0 "[ . 1 . 2]" 1
534 1 36 ASP H 1 36 ASP HB3 . . 4.180 3.358 3.034 3.973 . 0 0 "[ . 1 . 2]" 1
535 1 36 ASP H 1 37 ILE H . . 3.530 1.974 1.856 2.264 . 0 0 "[ . 1 . 2]" 1
536 1 36 ASP HB2 1 37 ILE H . . 4.920 4.401 3.205 4.604 . 0 0 "[ . 1 . 2]" 1
537 1 36 ASP HB3 1 37 ILE H . . 5.040 4.279 3.583 4.709 . 0 0 "[ . 1 . 2]" 1
538 1 37 ILE H 1 37 ILE HB . . 3.330 2.367 2.141 2.453 . 0 0 "[ . 1 . 2]" 1
539 1 37 ILE H 1 37 ILE MD . . 4.380 4.456 4.338 4.542 0.162 8 0 "[ . 1 . 2]" 1
540 1 37 ILE H 1 37 ILE HG12 . . 4.100 3.552 3.353 3.734 . 0 0 "[ . 1 . 2]" 1
541 1 37 ILE H 1 37 ILE HG13 . . 3.780 4.073 3.391 4.166 0.386 6 0 "[ . 1 . 2]" 1
542 1 37 ILE H 1 37 ILE MG . . 3.900 3.503 3.408 3.586 . 0 0 "[ . 1 . 2]" 1
543 1 37 ILE H 1 38 PRO HD2 . . 4.920 5.012 4.986 5.050 0.130 19 0 "[ . 1 . 2]" 1
544 1 37 ILE H 1 38 PRO HD3 . . 5.260 4.443 4.359 4.571 . 0 0 "[ . 1 . 2]" 1
545 1 37 ILE HA 1 37 ILE MD . . 3.480 2.526 2.329 3.325 . 0 0 "[ . 1 . 2]" 1
546 1 37 ILE HA 1 37 ILE HG13 . . 4.180 3.521 3.179 3.571 . 0 0 "[ . 1 . 2]" 1
547 1 37 ILE HA 1 37 ILE MG . . 3.250 2.692 2.622 2.760 . 0 0 "[ . 1 . 2]" 1
548 1 37 ILE HA 1 38 PRO HD2 . . 3.070 2.349 2.306 2.391 . 0 0 "[ . 1 . 2]" 1
549 1 37 ILE HA 1 38 PRO HD3 . . 3.160 1.920 1.912 1.935 . 0 0 "[ . 1 . 2]" 1
550 1 37 ILE HA 1 38 PRO HG3 . . 4.100 4.180 4.176 4.188 0.088 10 0 "[ . 1 . 2]" 1
551 1 37 ILE HB 1 37 ILE MD . . 3.620 3.116 2.792 3.157 . 0 0 "[ . 1 . 2]" 1
552 1 37 ILE HB 1 38 PRO HD2 . . 4.830 4.527 4.456 4.611 . 0 0 "[ . 1 . 2]" 1
553 1 37 ILE HB 1 60 ALA MB . . 4.920 4.269 3.967 4.482 . 0 0 "[ . 1 . 2]" 1
554 1 37 ILE MD 1 37 ILE MG . . 2.860 1.808 1.721 1.860 . 0 0 "[ . 1 . 2]" 1
555 1 37 ILE MD 1 38 PRO HD2 . . 4.380 2.303 2.120 3.153 . 0 0 "[ . 1 . 2]" 1
556 1 37 ILE MD 1 38 PRO HD3 . . 4.380 3.269 2.983 4.195 . 0 0 "[ . 1 . 2]" 1
557 1 37 ILE MD 1 38 PRO HG2 . . 4.920 4.238 4.064 4.948 0.028 19 0 "[ . 1 . 2]" 1
558 1 37 ILE MD 1 60 ALA HA . . 4.690 4.546 4.173 4.727 0.037 16 0 "[ . 1 . 2]" 1
559 1 37 ILE HG12 1 37 ILE MG . . 2.880 3.164 2.874 3.203 0.323 13 0 "[ . 1 . 2]" 1
560 1 37 ILE HG12 1 38 PRO HD2 . . 5.260 3.935 3.217 4.111 . 0 0 "[ . 1 . 2]" 1
561 1 37 ILE HG12 1 38 PRO HD3 . . 4.920 3.922 3.393 4.064 . 0 0 "[ . 1 . 2]" 1
562 1 37 ILE HG13 1 37 ILE MG . . 3.530 2.718 2.644 3.089 . 0 0 "[ . 1 . 2]" 1
563 1 37 ILE HG13 1 38 PRO HD2 . . 5.260 4.856 4.705 4.942 . 0 0 "[ . 1 . 2]" 1
564 1 37 ILE HG13 1 38 PRO HD3 . . 5.260 5.280 4.922 5.343 0.083 1 0 "[ . 1 . 2]" 1
565 1 37 ILE MG 1 38 PRO HD2 . . 3.590 2.368 2.149 2.598 . 0 0 "[ . 1 . 2]" 1
566 1 37 ILE MG 1 38 PRO HD3 . . 3.320 3.499 3.334 3.660 0.340 10 0 "[ . 1 . 2]" 1
567 1 37 ILE MG 1 38 PRO HG2 . . 4.380 4.077 3.892 4.270 . 0 0 "[ . 1 . 2]" 1
568 1 37 ILE MG 1 59 GLY HA2 . . 4.270 4.129 3.520 4.286 0.016 16 0 "[ . 1 . 2]" 1
569 1 37 ILE MG 1 60 ALA H . . 3.970 3.220 2.922 3.552 . 0 0 "[ . 1 . 2]" 1
570 1 37 ILE MG 1 60 ALA HA . . 4.180 3.703 3.249 3.862 . 0 0 "[ . 1 . 2]" 1
571 1 37 ILE MG 1 60 ALA MB . . 3.370 2.178 2.008 2.368 . 0 0 "[ . 1 . 2]" 1
572 1 38 PRO HA 1 39 LEU H . . 3.180 2.293 2.170 2.507 . 0 0 "[ . 1 . 2]" 1
573 1 38 PRO HA 1 39 LEU HA . . 4.690 4.218 4.206 4.241 . 0 0 "[ . 1 . 2]" 1
574 1 38 PRO HA 1 39 LEU HB2 . . 4.380 4.378 4.277 4.457 0.077 12 0 "[ . 1 . 2]" 1
575 1 38 PRO HA 1 39 LEU HB3 . . 4.920 4.780 4.645 4.988 0.068 8 0 "[ . 1 . 2]" 1
576 1 38 PRO HA 1 40 GLY H . . 4.920 4.413 3.794 4.806 . 0 0 "[ . 1 . 2]" 1
577 1 38 PRO HB2 1 39 LEU H . . 4.270 3.125 2.540 3.578 . 0 0 "[ . 1 . 2]" 1
578 1 38 PRO HB2 1 40 GLY H . . 4.180 3.174 2.597 3.366 . 0 0 "[ . 1 . 2]" 1
579 1 38 PRO HB2 1 40 GLY HA2 . . 5.260 4.026 3.603 4.329 . 0 0 "[ . 1 . 2]" 1
580 1 38 PRO HB2 1 40 GLY HA3 . . 5.260 4.238 3.997 4.395 . 0 0 "[ . 1 . 2]" 1
581 1 38 PRO HB3 1 39 LEU H . . 4.270 3.633 3.317 3.917 . 0 0 "[ . 1 . 2]" 1
582 1 38 PRO HB3 1 40 GLY H . . 4.690 4.555 3.991 4.711 0.021 9 0 "[ . 1 . 2]" 1
583 1 38 PRO HG2 1 39 LEU H . . 5.260 5.022 4.582 5.303 0.043 2 0 "[ . 1 . 2]" 1
584 1 38 PRO HG2 1 40 GLY H . . 5.260 5.036 4.477 5.273 0.013 20 0 "[ . 1 . 2]" 1
585 1 38 PRO HG2 1 59 GLY HA2 . . 4.520 4.030 3.173 4.521 0.001 2 0 "[ . 1 . 2]" 1
586 1 38 PRO HG2 1 60 ALA H . . 5.260 5.188 4.911 5.300 0.040 10 0 "[ . 1 . 2]" 1
587 1 39 LEU H 1 39 LEU HB2 . . 3.680 2.396 2.222 2.639 . 0 0 "[ . 1 . 2]" 1
588 1 39 LEU H 1 39 LEU HB3 . . 3.820 2.514 2.382 2.676 . 0 0 "[ . 1 . 2]" 1
589 1 39 LEU H 1 39 LEU QD . . 4.520 3.619 3.495 3.701 . 0 0 "[ . 1 . 2]" 1
590 1 39 LEU H 1 39 LEU HG . . 4.920 4.467 4.371 4.564 . 0 0 "[ . 1 . 2]" 1
591 1 39 LEU H 1 40 GLY H . . 4.240 2.741 2.409 3.101 . 0 0 "[ . 1 . 2]" 1
592 1 39 LEU H 1 41 ALA H . . 5.500 4.749 4.530 5.020 . 0 0 "[ . 1 . 2]" 1
593 1 39 LEU HA 1 39 LEU QD . . 3.070 1.990 1.875 2.185 . 0 0 "[ . 1 . 2]" 1
594 1 39 LEU HA 1 41 ALA MB . . 4.920 4.549 4.386 4.697 . 0 0 "[ . 1 . 2]" 1
595 1 39 LEU HA 1 60 ALA H . . 4.180 3.197 2.791 3.738 . 0 0 "[ . 1 . 2]" 1
596 1 39 LEU HA 1 60 ALA MB . . 3.090 2.692 2.398 3.096 0.006 12 0 "[ . 1 . 2]" 1
597 1 39 LEU HA 1 61 ALA H . . 4.520 3.646 3.284 3.946 . 0 0 "[ . 1 . 2]" 1
598 1 39 LEU HB2 1 39 LEU QD . . 2.890 2.141 2.014 2.193 . 0 0 "[ . 1 . 2]" 1
599 1 39 LEU HB2 1 40 GLY H . . 4.880 3.784 3.602 4.071 . 0 0 "[ . 1 . 2]" 1
600 1 39 LEU HB2 1 41 ALA H . . 4.920 4.537 4.409 4.641 . 0 0 "[ . 1 . 2]" 1
601 1 39 LEU HB3 1 40 GLY H . . 4.360 2.462 2.326 2.970 . 0 0 "[ . 1 . 2]" 1
602 1 39 LEU HB3 1 41 ALA H . . 4.490 2.897 2.694 3.067 . 0 0 "[ . 1 . 2]" 1
603 1 39 LEU QD 1 40 GLY H . . 5.260 3.800 3.154 4.171 . 0 0 "[ . 1 . 2]" 1
604 1 39 LEU QD 1 60 ALA H . . 4.730 3.840 3.411 4.350 . 0 0 "[ . 1 . 2]" 1
605 1 39 LEU QD 1 60 ALA MB . . 3.370 2.818 2.606 3.127 . 0 0 "[ . 1 . 2]" 1
606 1 39 LEU QD 1 61 ALA H . . 4.030 2.885 2.158 3.506 . 0 0 "[ . 1 . 2]" 1
607 1 39 LEU QD 1 61 ALA HA . . 4.270 3.572 3.103 4.054 . 0 0 "[ . 1 . 2]" 1
608 1 39 LEU QD 1 61 ALA MB . . 3.280 2.300 1.601 2.755 . 0 0 "[ . 1 . 2]" 1
609 1 39 LEU QD 1 67 LEU QD . . 3.590 2.832 2.232 3.297 . 0 0 "[ . 1 . 2]" 1
610 1 39 LEU QD 1 102 PHE QE . . 4.180 2.876 2.554 3.297 . 0 0 "[ . 1 . 2]" 1
611 1 39 LEU QD 1 102 PHE HZ . . 3.480 2.706 1.955 3.299 . 0 0 "[ . 1 . 2]" 1
612 1 39 LEU HG 1 41 ALA H . . 4.110 2.962 2.449 3.937 . 0 0 "[ . 1 . 2]" 1
613 1 39 LEU HG 1 41 ALA MB . . 3.650 2.229 1.984 3.117 . 0 0 "[ . 1 . 2]" 1
614 1 39 LEU HG 1 61 ALA MB . . 3.680 2.926 2.318 3.789 0.109 6 0 "[ . 1 . 2]" 1
615 1 40 GLY H 1 41 ALA H . . 3.720 2.552 2.407 2.794 . 0 0 "[ . 1 . 2]" 1
616 1 40 GLY H 1 56 VAL HB . . 5.500 4.440 4.206 4.733 . 0 0 "[ . 1 . 2]" 1
617 1 40 GLY H 1 56 VAL QG . . 4.520 3.992 3.828 4.264 . 0 0 "[ . 1 . 2]" 1
618 1 40 GLY HA2 1 56 VAL H . . 5.200 4.034 3.798 4.292 . 0 0 "[ . 1 . 2]" 1
619 1 40 GLY HA2 1 56 VAL HB . . 4.030 2.281 1.997 2.593 . 0 0 "[ . 1 . 2]" 1
620 1 40 GLY HA2 1 56 VAL QG . . 3.810 2.489 2.292 2.728 . 0 0 "[ . 1 . 2]" 1
621 1 40 GLY HA2 1 59 GLY HA2 . . 4.690 4.360 4.071 4.774 0.084 20 0 "[ . 1 . 2]" 1
622 1 40 GLY HA3 1 56 VAL H . . 5.260 4.057 3.905 4.305 . 0 0 "[ . 1 . 2]" 1
623 1 40 GLY HA3 1 56 VAL HB . . 3.620 2.483 2.258 2.716 . 0 0 "[ . 1 . 2]" 1
624 1 40 GLY HA3 1 56 VAL QG . . 4.180 3.226 3.017 3.375 . 0 0 "[ . 1 . 2]" 1
625 1 40 GLY HA3 1 59 GLY HA2 . . 4.920 2.791 2.451 3.289 . 0 0 "[ . 1 . 2]" 1
626 1 41 ALA H 1 41 ALA MB . . 3.460 2.638 2.596 2.663 . 0 0 "[ . 1 . 2]" 1
627 1 41 ALA H 1 42 THR H . . 4.940 4.096 4.036 4.161 . 0 0 "[ . 1 . 2]" 1
628 1 41 ALA H 1 56 VAL HB . . 5.430 4.213 4.024 4.427 . 0 0 "[ . 1 . 2]" 1
629 1 41 ALA H 1 56 VAL QG . . 4.520 3.219 3.064 3.460 . 0 0 "[ . 1 . 2]" 1
630 1 41 ALA H 1 61 ALA MB . . 4.690 4.096 3.957 4.325 . 0 0 "[ . 1 . 2]" 1
631 1 41 ALA HA 1 42 THR H . . 3.100 2.188 2.186 2.194 . 0 0 "[ . 1 . 2]" 1
632 1 41 ALA HA 1 42 THR HA . . 4.920 4.384 4.373 4.393 . 0 0 "[ . 1 . 2]" 1
633 1 41 ALA HA 1 42 THR HB . . 4.920 4.855 4.763 4.928 0.008 10 0 "[ . 1 . 2]" 1
634 1 41 ALA HA 1 52 ILE MG . . 4.520 4.477 4.332 4.578 0.058 18 0 "[ . 1 . 2]" 1
635 1 41 ALA HA 1 54 ARG H . . 5.170 4.986 4.826 5.166 . 0 0 "[ . 1 . 2]" 1
636 1 41 ALA HA 1 54 ARG HB3 . . 5.260 5.224 4.944 5.315 0.055 10 0 "[ . 1 . 2]" 1
637 1 41 ALA HA 1 55 ILE H . . 5.260 4.877 4.805 4.981 . 0 0 "[ . 1 . 2]" 1
638 1 41 ALA HA 1 55 ILE HA . . 3.650 2.187 2.107 2.313 . 0 0 "[ . 1 . 2]" 1
639 1 41 ALA HA 1 55 ILE MD . . 4.030 2.634 2.436 2.796 . 0 0 "[ . 1 . 2]" 1
640 1 41 ALA HA 1 56 VAL H . . 4.270 2.237 2.146 2.377 . 0 0 "[ . 1 . 2]" 1
641 1 41 ALA HA 1 56 VAL HA . . 5.260 5.023 4.930 5.124 . 0 0 "[ . 1 . 2]" 1
642 1 41 ALA HA 1 56 VAL QG . . 4.100 2.879 2.688 3.176 . 0 0 "[ . 1 . 2]" 1
643 1 41 ALA HA 1 61 ALA MB . . 4.380 3.779 3.651 4.002 . 0 0 "[ . 1 . 2]" 1
644 1 41 ALA MB 1 42 THR H . . 3.680 3.311 3.242 3.369 . 0 0 "[ . 1 . 2]" 1
645 1 41 ALA MB 1 52 ILE MD . . 3.190 3.118 2.840 3.224 0.034 14 0 "[ . 1 . 2]" 1
646 1 41 ALA MB 1 52 ILE MG . . 3.280 3.236 2.970 3.336 0.056 19 0 "[ . 1 . 2]" 1
647 1 41 ALA MB 1 54 ARG H . . 5.350 4.966 4.778 5.184 . 0 0 "[ . 1 . 2]" 1
648 1 41 ALA MB 1 55 ILE HA . . 4.180 3.094 2.934 3.239 . 0 0 "[ . 1 . 2]" 1
649 1 41 ALA MB 1 55 ILE MD . . 3.090 1.948 1.792 2.077 . 0 0 "[ . 1 . 2]" 1
650 1 41 ALA MB 1 55 ILE HG13 . . 4.380 4.391 4.325 4.427 0.047 13 0 "[ . 1 . 2]" 1
651 1 41 ALA MB 1 61 ALA MB . . 3.010 1.829 1.739 1.958 . 0 0 "[ . 1 . 2]" 1
652 1 42 THR H 1 42 THR HB . . 3.960 2.673 2.584 2.741 . 0 0 "[ . 1 . 2]" 1
653 1 42 THR H 1 42 THR MG . . 3.850 3.687 3.658 3.712 . 0 0 "[ . 1 . 2]" 1
654 1 42 THR H 1 43 VAL H . . 5.500 4.619 4.606 4.623 . 0 0 "[ . 1 . 2]" 1
655 1 42 THR H 1 52 ILE MG . . 4.180 3.954 3.817 4.049 . 0 0 "[ . 1 . 2]" 1
656 1 42 THR H 1 53 SER H . . 5.490 4.458 4.327 4.611 . 0 0 "[ . 1 . 2]" 1
657 1 42 THR H 1 54 ARG H . . 3.900 3.140 2.999 3.336 . 0 0 "[ . 1 . 2]" 1
658 1 42 THR H 1 54 ARG HB2 . . 4.920 4.915 4.699 4.956 0.036 17 0 "[ . 1 . 2]" 1
659 1 42 THR H 1 54 ARG HB3 . . 4.810 3.387 3.149 3.436 . 0 0 "[ . 1 . 2]" 1
660 1 42 THR H 1 55 ILE HA . . 4.690 2.910 2.815 3.113 . 0 0 "[ . 1 . 2]" 1
661 1 42 THR H 1 55 ILE MD . . 4.690 3.240 2.994 3.624 . 0 0 "[ . 1 . 2]" 1
662 1 42 THR H 1 56 VAL H . . 5.500 3.530 3.328 3.755 . 0 0 "[ . 1 . 2]" 1
663 1 42 THR H 1 56 VAL QG . . 4.840 3.114 2.978 3.246 . 0 0 "[ . 1 . 2]" 1
664 1 42 THR HA 1 42 THR MG . . 3.210 2.206 2.091 2.335 . 0 0 "[ . 1 . 2]" 1
665 1 42 THR HA 1 43 VAL H . . 3.130 2.317 2.272 2.376 . 0 0 "[ . 1 . 2]" 1
666 1 42 THR HA 1 43 VAL MG1 . . 3.960 3.177 2.965 3.505 . 0 0 "[ . 1 . 2]" 1
667 1 42 THR HA 1 43 VAL MG2 . . 4.180 3.961 3.665 4.106 . 0 0 "[ . 1 . 2]" 1
668 1 42 THR HA 1 90 PHE HZ . . 4.380 2.979 1.995 3.804 . 0 0 "[ . 1 . 2]" 1
669 1 42 THR HB 1 43 VAL H . . 3.680 3.682 3.575 3.742 0.062 11 0 "[ . 1 . 2]" 1
670 1 42 THR HB 1 52 ILE MG . . 4.690 4.383 4.234 4.498 . 0 0 "[ . 1 . 2]" 1
671 1 42 THR HB 1 53 SER H . . 5.260 3.660 3.520 3.942 . 0 0 "[ . 1 . 2]" 1
672 1 42 THR HB 1 54 ARG H . . 4.030 2.170 1.930 2.303 . 0 0 "[ . 1 . 2]" 1
673 1 42 THR HB 1 54 ARG HB2 . . 4.270 3.292 3.011 3.430 . 0 0 "[ . 1 . 2]" 1
674 1 42 THR HB 1 54 ARG HB3 . . 3.900 2.019 1.974 2.131 . 0 0 "[ . 1 . 2]" 1
675 1 42 THR HB 1 54 ARG HG3 . . 4.920 4.912 4.844 4.959 0.039 12 0 "[ . 1 . 2]" 1
676 1 42 THR MG 1 43 VAL H . . 3.650 2.334 2.041 2.487 . 0 0 "[ . 1 . 2]" 1
677 1 42 THR MG 1 43 VAL HA . . 4.920 4.164 3.994 4.286 . 0 0 "[ . 1 . 2]" 1
678 1 42 THR MG 1 43 VAL MG1 . . 4.690 4.167 4.039 4.416 . 0 0 "[ . 1 . 2]" 1
679 1 42 THR MG 1 43 VAL MG2 . . 4.690 4.047 3.814 4.204 . 0 0 "[ . 1 . 2]" 1
680 1 42 THR MG 1 53 SER H . . 5.260 4.341 4.112 4.678 . 0 0 "[ . 1 . 2]" 1
681 1 42 THR MG 1 53 SER HB2 . . 4.690 4.166 3.745 4.719 0.029 6 0 "[ . 1 . 2]" 1
682 1 42 THR MG 1 53 SER HB3 . . 4.380 3.476 3.070 4.077 . 0 0 "[ . 1 . 2]" 1
683 1 42 THR MG 1 54 ARG H . . 4.700 3.717 3.514 3.892 . 0 0 "[ . 1 . 2]" 1
684 1 42 THR MG 1 54 ARG HB2 . . 4.380 4.150 3.942 4.362 . 0 0 "[ . 1 . 2]" 1
685 1 42 THR MG 1 54 ARG HD2 . . 4.690 4.619 4.450 5.557 0.867 10 1 "[ . + . 2]" 1
686 1 42 THR MG 1 90 PHE QE . . 5.500 3.835 3.538 4.313 . 0 0 "[ . 1 . 2]" 1
687 1 42 THR MG 1 90 PHE HZ . . 4.100 3.131 2.780 3.652 . 0 0 "[ . 1 . 2]" 1
688 1 43 VAL H 1 43 VAL MG1 . . 3.960 2.808 2.588 3.023 . 0 0 "[ . 1 . 2]" 1
689 1 43 VAL H 1 43 VAL MG2 . . 3.210 2.420 2.081 2.579 . 0 0 "[ . 1 . 2]" 1
690 1 43 VAL H 1 44 ARG H . . 5.420 4.372 4.276 4.432 . 0 0 "[ . 1 . 2]" 1
691 1 43 VAL H 1 53 SER H . . 5.500 4.042 3.928 4.550 . 0 0 "[ . 1 . 2]" 1
692 1 43 VAL H 1 90 PHE HZ . . 4.850 2.074 1.933 2.370 . 0 0 "[ . 1 . 2]" 1
693 1 43 VAL HA 1 43 VAL MG1 . . 3.220 2.461 2.337 2.578 . 0 0 "[ . 1 . 2]" 1
694 1 43 VAL HA 1 44 ARG H . . 3.210 2.327 2.248 2.399 . 0 0 "[ . 1 . 2]" 1
695 1 43 VAL HA 1 44 ARG HA . . 4.920 4.309 4.298 4.321 . 0 0 "[ . 1 . 2]" 1
696 1 43 VAL HA 1 44 ARG QG . . 5.260 3.691 3.109 4.243 . 0 0 "[ . 1 . 2]" 1
697 1 43 VAL HA 1 50 VAL QG . . 4.380 4.305 4.113 4.373 . 0 0 "[ . 1 . 2]" 1
698 1 43 VAL HA 1 51 ILE H . . 5.500 5.306 5.030 5.522 0.022 2 0 "[ . 1 . 2]" 1
699 1 43 VAL HA 1 52 ILE H . . 4.690 4.635 4.540 4.712 0.022 20 0 "[ . 1 . 2]" 1
700 1 43 VAL HA 1 52 ILE HA . . 3.460 2.124 2.009 2.283 . 0 0 "[ . 1 . 2]" 1
701 1 43 VAL HA 1 52 ILE MG . . 4.520 3.389 3.242 3.621 . 0 0 "[ . 1 . 2]" 1
702 1 43 VAL HA 1 53 SER H . . 3.480 1.994 1.933 2.463 . 0 0 "[ . 1 . 2]" 1
703 1 43 VAL HA 1 53 SER HB2 . . 4.520 4.113 3.740 4.439 . 0 0 "[ . 1 . 2]" 1
704 1 43 VAL HA 1 53 SER HB3 . . 4.520 2.504 2.192 2.810 . 0 0 "[ . 1 . 2]" 1
705 1 43 VAL HA 1 54 ARG H . . 4.860 3.634 3.534 3.782 . 0 0 "[ . 1 . 2]" 1
706 1 43 VAL HB 1 44 ARG H . . 3.370 2.908 2.693 3.123 . 0 0 "[ . 1 . 2]" 1
707 1 43 VAL HB 1 50 VAL HA . . 4.920 4.676 4.385 5.008 0.088 15 0 "[ . 1 . 2]" 1
708 1 43 VAL HB 1 50 VAL QG . . 3.020 2.464 2.227 2.629 . 0 0 "[ . 1 . 2]" 1
709 1 43 VAL HB 1 51 ILE H . . 4.690 4.252 3.963 4.521 . 0 0 "[ . 1 . 2]" 1
710 1 43 VAL HB 1 52 ILE HA . . 5.260 2.764 2.427 3.199 . 0 0 "[ . 1 . 2]" 1
711 1 43 VAL HB 1 52 ILE MD . . 4.690 3.143 2.577 3.603 . 0 0 "[ . 1 . 2]" 1
712 1 43 VAL HB 1 53 SER H . . 5.500 4.111 3.996 4.352 . 0 0 "[ . 1 . 2]" 1
713 1 43 VAL HB 1 86 VAL QG . . 4.270 3.924 2.966 4.276 0.006 19 0 "[ . 1 . 2]" 1
714 1 43 VAL MG1 1 44 ARG H . . 4.100 4.092 3.907 4.202 0.102 16 0 "[ . 1 . 2]" 1
715 1 43 VAL MG1 1 52 ILE HA . . 3.370 2.448 2.057 2.805 . 0 0 "[ . 1 . 2]" 1
716 1 43 VAL MG1 1 52 ILE HG12 . . 4.270 3.961 3.577 4.220 . 0 0 "[ . 1 . 2]" 1
717 1 43 VAL MG1 1 53 SER H . . 4.180 3.227 2.908 3.465 . 0 0 "[ . 1 . 2]" 1
718 1 43 VAL MG1 1 90 PHE HZ . . 4.920 3.242 2.360 3.882 . 0 0 "[ . 1 . 2]" 1
719 1 43 VAL MG2 1 44 ARG H . . 3.690 3.438 3.139 3.743 0.053 19 0 "[ . 1 . 2]" 1
720 1 43 VAL MG2 1 51 ILE H . . 4.740 4.579 4.112 4.771 0.031 18 0 "[ . 1 . 2]" 1
721 1 43 VAL MG2 1 86 VAL HA . . 3.850 2.813 2.478 3.125 . 0 0 "[ . 1 . 2]" 1
722 1 43 VAL MG2 1 86 VAL HB . . 3.330 3.023 2.393 3.661 0.331 6 0 "[ . 1 . 2]" 1
723 1 43 VAL MG2 1 86 VAL QG . . 3.090 1.980 1.555 2.591 . 0 0 "[ . 1 . 2]" 1
724 1 43 VAL MG2 1 89 VAL H . . 5.130 5.023 4.610 5.195 0.065 19 0 "[ . 1 . 2]" 1
725 1 43 VAL MG2 1 89 VAL HB . . 4.100 3.392 3.232 3.501 . 0 0 "[ . 1 . 2]" 1
726 1 43 VAL MG2 1 89 VAL MG1 . . 3.050 2.949 2.663 3.083 0.033 18 0 "[ . 1 . 2]" 1
727 1 43 VAL MG2 1 89 VAL MG2 . . 3.730 3.729 3.603 3.796 0.066 11 0 "[ . 1 . 2]" 1
728 1 43 VAL MG2 1 90 PHE H . . 4.870 4.472 4.199 4.810 . 0 0 "[ . 1 . 2]" 1
729 1 43 VAL MG2 1 90 PHE QD . . 4.920 3.786 3.449 4.065 . 0 0 "[ . 1 . 2]" 1
730 1 43 VAL MG2 1 90 PHE QE . . 4.100 2.451 1.889 2.931 . 0 0 "[ . 1 . 2]" 1
731 1 43 VAL MG2 1 90 PHE HZ . . 4.920 2.131 1.965 2.367 . 0 0 "[ . 1 . 2]" 1
732 1 44 ARG H 1 44 ARG QG . . 3.830 2.085 1.819 2.659 . 0 0 "[ . 1 . 2]" 1
733 1 44 ARG H 1 50 VAL HA . . 5.010 4.839 4.531 5.036 0.026 4 0 "[ . 1 . 2]" 1
734 1 44 ARG H 1 50 VAL QG . . 4.220 3.853 3.623 4.102 . 0 0 "[ . 1 . 2]" 1
735 1 44 ARG H 1 51 ILE H . . 3.820 3.560 3.179 3.824 0.004 1 0 "[ . 1 . 2]" 1
736 1 44 ARG H 1 51 ILE HA . . 5.500 4.799 4.580 5.053 . 0 0 "[ . 1 . 2]" 1
737 1 44 ARG H 1 51 ILE HB . . 4.540 4.209 3.935 4.358 . 0 0 "[ . 1 . 2]" 1
738 1 44 ARG H 1 52 ILE HA . . 4.520 3.383 3.191 3.627 . 0 0 "[ . 1 . 2]" 1
739 1 44 ARG H 1 53 SER H . . 4.350 3.648 3.372 4.244 . 0 0 "[ . 1 . 2]" 1
740 1 44 ARG H 1 53 SER HB2 . . 4.920 3.865 3.332 4.329 . 0 0 "[ . 1 . 2]" 1
741 1 44 ARG H 1 53 SER HB3 . . 4.920 2.765 2.570 2.982 . 0 0 "[ . 1 . 2]" 1
742 1 44 ARG H 1 54 ARG H . . 5.500 5.379 5.164 5.571 0.071 18 0 "[ . 1 . 2]" 1
743 1 44 ARG H 1 86 VAL QG . . 4.700 3.990 3.275 4.269 . 0 0 "[ . 1 . 2]" 1
744 1 44 ARG HA 1 45 ASN H . . 3.210 2.493 2.351 2.630 . 0 0 "[ . 1 . 2]" 1
745 1 44 ARG HA 1 45 ASN HA . . 4.690 4.342 4.328 4.398 . 0 0 "[ . 1 . 2]" 1
746 1 44 ARG HB2 1 44 ARG HD2 . . 3.850 3.444 2.994 3.908 0.058 12 0 "[ . 1 . 2]" 1
747 1 44 ARG HB2 1 44 ARG HD3 . . 3.960 3.226 2.374 4.083 0.123 8 0 "[ . 1 . 2]" 1
748 1 44 ARG HB2 1 45 ASN H . . 3.560 2.859 2.257 3.869 0.309 12 0 "[ . 1 . 2]" 1
749 1 44 ARG HB2 1 53 SER HB3 . . 4.690 4.303 3.847 4.720 0.030 15 0 "[ . 1 . 2]" 1
750 1 44 ARG HB3 1 44 ARG HD3 . . 3.900 2.848 2.409 3.380 . 0 0 "[ . 1 . 2]" 1
751 1 44 ARG HB3 1 45 ASN H . . 4.030 3.365 2.213 4.102 0.072 19 0 "[ . 1 . 2]" 1
752 1 44 ARG HB3 1 53 SER HB2 . . 4.380 3.026 1.983 4.518 0.138 18 0 "[ . 1 . 2]" 1
753 1 44 ARG HB3 1 53 SER HB3 . . 4.380 3.336 2.555 4.522 0.142 6 0 "[ . 1 . 2]" 1
754 1 44 ARG HD2 1 51 ILE MG . . 4.920 4.067 2.327 5.860 0.940 12 1 "[ . 1 + . 2]" 1
755 1 44 ARG HD2 1 53 SER HA . . 4.100 2.993 2.283 3.590 . 0 0 "[ . 1 . 2]" 1
756 1 44 ARG HD2 1 53 SER HB2 . . 4.690 2.861 2.093 4.595 . 0 0 "[ . 1 . 2]" 1
757 1 44 ARG HD2 1 53 SER HB3 . . 4.380 3.825 3.239 4.414 0.034 2 0 "[ . 1 . 2]" 1
758 1 44 ARG HD3 1 53 SER HB2 . . 4.520 3.392 2.221 4.541 0.021 17 0 "[ . 1 . 2]" 1
759 1 44 ARG HD3 1 53 SER HB3 . . 4.520 3.850 2.590 4.552 0.032 7 0 "[ . 1 . 2]" 1
760 1 44 ARG HE 1 53 SER HB2 . . 5.500 3.848 1.937 4.940 . 0 0 "[ . 1 . 2]" 1
761 1 44 ARG HE 1 53 SER HB3 . . 5.500 4.608 2.656 5.511 0.011 8 0 "[ . 1 . 2]" 1
762 1 44 ARG QG 1 45 ASN H . . 4.800 3.909 3.474 4.249 . 0 0 "[ . 1 . 2]" 1
763 1 44 ARG QG 1 51 ILE H . . 5.130 3.504 2.540 4.932 . 0 0 "[ . 1 . 2]" 1
764 1 44 ARG QG 1 53 SER HB2 . . 4.270 3.048 1.838 3.915 . 0 0 "[ . 1 . 2]" 1
765 1 44 ARG QG 1 53 SER HB3 . . 4.180 2.945 1.812 4.034 . 0 0 "[ . 1 . 2]" 1
766 1 45 ASN H 1 45 ASN HB2 . . 3.480 2.377 2.152 2.643 . 0 0 "[ . 1 . 2]" 1
767 1 45 ASN H 1 45 ASN HB3 . . 3.800 2.971 2.527 3.326 . 0 0 "[ . 1 . 2]" 1
768 1 45 ASN H 1 45 ASN HD21 . . 5.330 4.407 4.155 4.526 . 0 0 "[ . 1 . 2]" 1
769 1 45 ASN H 1 46 GLU H . . 4.830 4.259 4.034 4.470 . 0 0 "[ . 1 . 2]" 1
770 1 45 ASN H 1 86 VAL QG . . 3.990 3.267 2.296 3.762 . 0 0 "[ . 1 . 2]" 1
771 1 45 ASN HA 1 45 ASN HD21 . . 3.680 1.961 1.907 2.127 . 0 0 "[ . 1 . 2]" 1
772 1 45 ASN HA 1 45 ASN HD22 . . 4.380 3.258 3.160 3.468 . 0 0 "[ . 1 . 2]" 1
773 1 45 ASN HA 1 46 GLU H . . 3.070 2.276 2.253 2.301 . 0 0 "[ . 1 . 2]" 1
774 1 45 ASN HA 1 49 SER H . . 5.200 5.189 4.837 5.264 0.064 6 0 "[ . 1 . 2]" 1
775 1 45 ASN HA 1 50 VAL HA . . 3.760 3.116 1.972 3.442 . 0 0 "[ . 1 . 2]" 1
776 1 45 ASN HA 1 50 VAL QG . . 4.270 3.313 3.027 3.570 . 0 0 "[ . 1 . 2]" 1
777 1 45 ASN HA 1 51 ILE H . . 4.850 3.996 3.274 4.270 . 0 0 "[ . 1 . 2]" 1
778 1 45 ASN HB2 1 46 GLU H . . 4.700 4.631 4.422 4.728 0.028 6 0 "[ . 1 . 2]" 1
779 1 45 ASN HB2 1 86 VAL QG . . 4.520 2.775 1.951 3.272 . 0 0 "[ . 1 . 2]" 1
780 1 45 ASN HB3 1 46 GLU H . . 4.120 4.138 3.943 4.320 0.200 12 0 "[ . 1 . 2]" 1
781 1 45 ASN HB3 1 86 VAL QG . . 4.690 3.907 3.221 4.250 . 0 0 "[ . 1 . 2]" 1
782 1 45 ASN HD21 1 46 GLU H . . 4.510 3.151 2.606 3.787 . 0 0 "[ . 1 . 2]" 1
783 1 45 ASN HD21 1 49 SER H . . 5.450 4.921 4.119 5.478 0.028 15 0 "[ . 1 . 2]" 1
784 1 45 ASN HD21 1 50 VAL HA . . 4.520 3.828 2.601 4.256 . 0 0 "[ . 1 . 2]" 1
785 1 45 ASN HD21 1 50 VAL QG . . 3.650 3.091 2.512 3.514 . 0 0 "[ . 1 . 2]" 1
786 1 45 ASN HD21 1 51 ILE H . . 5.500 5.356 4.610 5.557 0.057 18 0 "[ . 1 . 2]" 1
787 1 45 ASN HD21 1 86 VAL H . . 5.500 4.040 2.621 5.300 . 0 0 "[ . 1 . 2]" 1
788 1 45 ASN HD21 1 86 VAL QG . . 4.380 3.652 2.942 4.124 . 0 0 "[ . 1 . 2]" 1
789 1 45 ASN HD22 1 46 GLU H . . 5.070 4.371 3.801 4.861 . 0 0 "[ . 1 . 2]" 1
790 1 45 ASN HD22 1 50 VAL QG . . 3.560 3.249 2.924 3.518 . 0 0 "[ . 1 . 2]" 1
791 1 45 ASN HD22 1 86 VAL H . . 4.740 3.561 2.196 4.727 . 0 0 "[ . 1 . 2]" 1
792 1 46 GLU H 1 46 GLU HB2 . . 4.040 2.176 2.086 2.355 . 0 0 "[ . 1 . 2]" 1
793 1 46 GLU H 1 46 GLU HB3 . . 4.130 3.202 3.159 3.524 . 0 0 "[ . 1 . 2]" 1
794 1 46 GLU H 1 46 GLU HG2 . . 5.260 3.782 3.100 4.027 . 0 0 "[ . 1 . 2]" 1
795 1 46 GLU H 1 46 GLU HG3 . . 5.260 4.502 4.179 4.710 . 0 0 "[ . 1 . 2]" 1
796 1 46 GLU H 1 47 MET H . . 4.780 4.585 4.528 4.614 . 0 0 "[ . 1 . 2]" 1
797 1 46 GLU H 1 49 SER H . . 3.860 3.320 3.145 3.466 . 0 0 "[ . 1 . 2]" 1
798 1 46 GLU H 1 49 SER HA . . 5.500 4.911 4.638 5.094 . 0 0 "[ . 1 . 2]" 1
799 1 46 GLU H 1 49 SER HB2 . . 4.690 4.509 4.341 4.696 0.006 5 0 "[ . 1 . 2]" 1
800 1 46 GLU H 1 49 SER HB3 . . 5.260 5.153 4.662 5.287 0.027 7 0 "[ . 1 . 2]" 1
801 1 46 GLU H 1 50 VAL HA . . 4.510 2.970 2.485 3.155 . 0 0 "[ . 1 . 2]" 1
802 1 46 GLU H 1 50 VAL QG . . 5.140 3.786 3.549 4.200 . 0 0 "[ . 1 . 2]" 1
803 1 46 GLU H 1 51 ILE H . . 5.200 3.396 3.009 3.833 . 0 0 "[ . 1 . 2]" 1
804 1 46 GLU H 1 51 ILE MD . . 4.920 3.363 2.669 4.857 . 0 0 "[ . 1 . 2]" 1
805 1 46 GLU HA 1 46 GLU HG2 . . 4.030 2.586 2.372 2.869 . 0 0 "[ . 1 . 2]" 1
806 1 46 GLU HA 1 46 GLU HG3 . . 4.030 3.543 3.535 3.603 . 0 0 "[ . 1 . 2]" 1
807 1 46 GLU HA 1 47 MET H . . 3.050 2.517 2.508 2.586 . 0 0 "[ . 1 . 2]" 1
808 1 46 GLU HA 1 47 MET HA . . 4.270 4.281 4.271 4.315 0.045 19 0 "[ . 1 . 2]" 1
809 1 46 GLU HA 1 47 MET HG3 . . 5.260 5.477 5.351 5.773 0.513 19 1 "[ . 1 . +2]" 1
810 1 46 GLU HB2 1 47 MET H . . 4.660 4.034 3.839 4.061 . 0 0 "[ . 1 . 2]" 1
811 1 46 GLU HB2 1 49 SER H . . 4.940 3.193 2.616 3.451 . 0 0 "[ . 1 . 2]" 1
812 1 46 GLU HB2 1 49 SER HB2 . . 4.520 3.096 2.596 3.518 . 0 0 "[ . 1 . 2]" 1
813 1 46 GLU HB2 1 49 SER HB3 . . 5.260 4.004 3.510 4.191 . 0 0 "[ . 1 . 2]" 1
814 1 46 GLU HB2 1 51 ILE MD . . 3.720 2.006 1.876 3.771 0.051 12 0 "[ . 1 . 2]" 1
815 1 46 GLU HB2 1 51 ILE HG12 . . 4.380 4.090 2.775 4.421 0.041 18 0 "[ . 1 . 2]" 1
816 1 46 GLU HB2 1 51 ILE HG13 . . 4.690 4.703 3.875 4.778 0.088 4 0 "[ . 1 . 2]" 1
817 1 46 GLU HB3 1 47 MET H . . 4.670 2.779 2.457 2.833 . 0 0 "[ . 1 . 2]" 1
818 1 46 GLU HB3 1 49 SER H . . 5.000 2.490 2.317 3.075 . 0 0 "[ . 1 . 2]" 1
819 1 46 GLU HB3 1 49 SER HB2 . . 4.270 2.600 2.401 3.074 . 0 0 "[ . 1 . 2]" 1
820 1 46 GLU HB3 1 49 SER HB3 . . 4.520 4.114 3.866 4.466 . 0 0 "[ . 1 . 2]" 1
821 1 46 GLU HG2 1 47 MET H . . 5.260 4.024 3.822 4.686 . 0 0 "[ . 1 . 2]" 1
822 1 46 GLU HG2 1 51 ILE MD . . 4.270 3.150 2.471 4.278 0.008 12 0 "[ . 1 . 2]" 1
823 1 46 GLU HG2 1 51 ILE HG12 . . 4.690 4.184 2.655 4.682 . 0 0 "[ . 1 . 2]" 1
824 1 46 GLU HG3 1 47 MET H . . 5.500 3.934 3.736 4.487 . 0 0 "[ . 1 . 2]" 1
825 1 46 GLU HG3 1 51 ILE MD . . 4.030 2.569 1.965 3.849 . 0 0 "[ . 1 . 2]" 1
826 1 46 GLU HG3 1 51 ILE HG12 . . 4.690 3.466 2.677 4.192 . 0 0 "[ . 1 . 2]" 1
827 1 47 MET H 1 47 MET HB3 . . 4.170 3.625 3.602 3.664 . 0 0 "[ . 1 . 2]" 1
828 1 47 MET H 1 47 MET ME . . 4.860 4.157 3.501 4.706 . 0 0 "[ . 1 . 2]" 1
829 1 47 MET H 1 47 MET HG2 . . 4.180 2.143 1.946 2.214 . 0 0 "[ . 1 . 2]" 1
830 1 47 MET H 1 47 MET HG3 . . 4.130 3.058 2.947 3.258 . 0 0 "[ . 1 . 2]" 1
831 1 47 MET H 1 48 ASP H . . 4.460 3.401 3.345 3.563 . 0 0 "[ . 1 . 2]" 1
832 1 47 MET H 1 49 SER H . . 5.500 4.030 3.975 4.079 . 0 0 "[ . 1 . 2]" 1
833 1 47 MET HA 1 47 MET ME . . 4.380 3.600 2.187 4.378 . 0 0 "[ . 1 . 2]" 1
834 1 47 MET HA 1 47 MET HG2 . . 3.960 2.423 2.366 2.608 . 0 0 "[ . 1 . 2]" 1
835 1 47 MET HA 1 47 MET HG3 . . 3.680 3.668 3.637 3.739 0.059 19 0 "[ . 1 . 2]" 1
836 1 47 MET HB2 1 47 MET ME . . 4.380 3.775 2.915 4.309 . 0 0 "[ . 1 . 2]" 1
837 1 47 MET HB2 1 48 ASP H . . 3.410 2.291 2.129 2.352 . 0 0 "[ . 1 . 2]" 1
838 1 47 MET HB2 1 49 SER H . . 4.270 3.915 3.713 3.974 . 0 0 "[ . 1 . 2]" 1
839 1 47 MET HB3 1 48 ASP H . . 3.370 3.136 3.029 3.181 . 0 0 "[ . 1 . 2]" 1
840 1 47 MET HB3 1 49 SER H . . 4.920 4.950 4.830 4.983 0.063 12 0 "[ . 1 . 2]" 1
841 1 47 MET HG2 1 48 ASP H . . 4.520 4.533 4.404 4.581 0.061 11 0 "[ . 1 . 2]" 1
842 1 47 MET HG3 1 48 ASP H . . 4.520 4.521 4.372 4.560 0.040 17 0 "[ . 1 . 2]" 1
843 1 48 ASP H 1 48 ASP HB2 . . 3.810 2.960 2.778 3.037 . 0 0 "[ . 1 . 2]" 1
844 1 48 ASP H 1 49 SER H . . 3.240 1.884 1.858 1.929 . 0 0 "[ . 1 . 2]" 1
845 1 48 ASP HA 1 83 GLY HA2 . . 4.180 3.157 2.412 3.448 . 0 0 "[ . 1 . 2]" 1
846 1 48 ASP HB2 1 49 SER H . . 4.350 3.990 3.931 4.025 . 0 0 "[ . 1 . 2]" 1
847 1 48 ASP HB2 1 82 ARG HG2 . . 4.920 4.616 3.957 4.936 0.016 3 0 "[ . 1 . 2]" 1
848 1 48 ASP HB3 1 83 GLY H . . 4.460 4.222 3.551 4.499 0.039 19 0 "[ . 1 . 2]" 1
849 1 48 ASP HB3 1 83 GLY HA2 . . 4.100 3.209 2.588 3.641 . 0 0 "[ . 1 . 2]" 1
850 1 48 ASP HB3 1 83 GLY HA3 . . 4.270 4.151 3.433 4.305 0.035 19 0 "[ . 1 . 2]" 1
851 1 49 SER H 1 49 SER HB2 . . 3.340 2.643 2.578 2.723 . 0 0 "[ . 1 . 2]" 1
852 1 49 SER H 1 49 SER HB3 . . 3.930 3.746 3.671 3.807 . 0 0 "[ . 1 . 2]" 1
853 1 49 SER H 1 50 VAL H . . 5.100 4.434 4.331 4.455 . 0 0 "[ . 1 . 2]" 1
854 1 49 SER H 1 51 ILE MD . . 4.920 3.784 3.643 4.939 0.019 12 0 "[ . 1 . 2]" 1
855 1 49 SER HA 1 50 VAL H . . 3.330 2.392 2.262 2.413 . 0 0 "[ . 1 . 2]" 1
856 1 49 SER HA 1 50 VAL HB . . 4.920 4.594 4.323 4.872 . 0 0 "[ . 1 . 2]" 1
857 1 49 SER HA 1 82 ARG QD . . 5.260 3.598 2.758 4.678 . 0 0 "[ . 1 . 2]" 1
858 1 49 SER HA 1 82 ARG HG2 . . 4.920 4.055 1.984 4.948 0.028 17 0 "[ . 1 . 2]" 1
859 1 49 SER HA 1 82 ARG HG3 . . 4.270 3.067 2.562 3.376 . 0 0 "[ . 1 . 2]" 1
860 1 49 SER HA 1 83 GLY H . . 4.650 2.912 2.396 4.182 . 0 0 "[ . 1 . 2]" 1
861 1 49 SER HB2 1 50 VAL H . . 4.520 3.963 3.810 4.346 . 0 0 "[ . 1 . 2]" 1
862 1 49 SER HB2 1 51 ILE MD . . 3.810 2.245 1.981 3.369 . 0 0 "[ . 1 . 2]" 1
863 1 49 SER HB2 1 51 ILE HG12 . . 5.260 4.547 3.811 5.027 . 0 0 "[ . 1 . 2]" 1
864 1 49 SER HB2 1 51 ILE HG13 . . 5.260 4.701 4.419 5.012 . 0 0 "[ . 1 . 2]" 1
865 1 49 SER HB2 1 72 GLU HG3 . . 4.920 3.749 3.530 4.460 . 0 0 "[ . 1 . 2]" 1
866 1 49 SER HB3 1 50 VAL H . . 4.380 2.760 2.689 3.251 . 0 0 "[ . 1 . 2]" 1
867 1 49 SER HB3 1 51 ILE MD . . 3.680 2.053 1.922 2.292 . 0 0 "[ . 1 . 2]" 1
868 1 49 SER HB3 1 51 ILE HG12 . . 4.920 4.531 3.515 4.865 . 0 0 "[ . 1 . 2]" 1
869 1 49 SER HB3 1 51 ILE HG13 . . 5.260 4.070 3.724 4.287 . 0 0 "[ . 1 . 2]" 1
870 1 49 SER HB3 1 72 GLU HG2 . . 5.260 3.420 3.014 4.079 . 0 0 "[ . 1 . 2]" 1
871 1 49 SER HB3 1 72 GLU HG3 . . 4.520 2.194 1.983 2.756 . 0 0 "[ . 1 . 2]" 1
872 1 50 VAL H 1 50 VAL HB . . 3.960 2.483 2.259 2.942 . 0 0 "[ . 1 . 2]" 1
873 1 50 VAL H 1 50 VAL QG . . 3.720 2.530 1.840 2.888 . 0 0 "[ . 1 . 2]" 1
874 1 50 VAL H 1 51 ILE H . . 5.500 4.204 4.040 4.417 . 0 0 "[ . 1 . 2]" 1
875 1 50 VAL H 1 51 ILE MD . . 4.570 3.063 2.871 3.369 . 0 0 "[ . 1 . 2]" 1
876 1 50 VAL H 1 72 GLU HG2 . . 5.120 4.345 3.773 4.915 . 0 0 "[ . 1 . 2]" 1
877 1 50 VAL H 1 72 GLU HG3 . . 4.920 3.208 2.914 3.609 . 0 0 "[ . 1 . 2]" 1
878 1 50 VAL H 1 73 VAL H . . 5.500 3.565 3.118 4.491 . 0 0 "[ . 1 . 2]" 1
879 1 50 VAL H 1 81 ILE MG . . 5.180 3.338 3.094 3.901 . 0 0 "[ . 1 . 2]" 1
880 1 50 VAL HA 1 50 VAL QG . . 3.130 2.114 1.995 2.467 . 0 0 "[ . 1 . 2]" 1
881 1 50 VAL HA 1 51 ILE H . . 3.190 2.215 2.182 2.272 . 0 0 "[ . 1 . 2]" 1
882 1 50 VAL HA 1 51 ILE HB . . 4.920 4.512 4.439 4.788 . 0 0 "[ . 1 . 2]" 1
883 1 50 VAL HA 1 51 ILE MD . . 4.920 3.101 2.864 3.616 . 0 0 "[ . 1 . 2]" 1
884 1 50 VAL HB 1 51 ILE H . . 5.260 4.490 4.287 4.568 . 0 0 "[ . 1 . 2]" 1
885 1 50 VAL HB 1 73 VAL H . . 4.920 3.618 3.110 5.071 0.151 15 0 "[ . 1 . 2]" 1
886 1 50 VAL HB 1 81 ILE MD . . 4.520 4.365 3.831 4.799 0.279 19 0 "[ . 1 . 2]" 1
887 1 50 VAL HB 1 81 ILE MG . . 3.480 2.174 1.894 3.498 0.018 19 0 "[ . 1 . 2]" 1
888 1 50 VAL QG 1 51 ILE H . . 3.850 3.066 2.811 3.254 . 0 0 "[ . 1 . 2]" 1
889 1 50 VAL QG 1 51 ILE HA . . 4.920 3.847 3.475 4.107 . 0 0 "[ . 1 . 2]" 1
890 1 50 VAL QG 1 73 VAL HB . . 3.900 2.983 1.745 4.012 0.112 14 0 "[ . 1 . 2]" 1
891 1 50 VAL QG 1 82 ARG HA . . 4.100 3.410 2.121 4.053 . 0 0 "[ . 1 . 2]" 1
892 1 50 VAL QG 1 83 GLY H . . 4.380 3.360 2.863 4.398 0.018 13 0 "[ . 1 . 2]" 1
893 1 50 VAL QG 1 84 LYS H . . 4.020 3.654 3.202 3.999 . 0 0 "[ . 1 . 2]" 1
894 1 51 ILE H 1 51 ILE HB . . 3.590 2.388 2.257 2.781 . 0 0 "[ . 1 . 2]" 1
895 1 51 ILE H 1 51 ILE MD . . 3.850 2.157 1.977 3.238 . 0 0 "[ . 1 . 2]" 1
896 1 51 ILE H 1 51 ILE HG12 . . 4.270 4.145 2.602 4.354 0.084 18 0 "[ . 1 . 2]" 1
897 1 51 ILE H 1 51 ILE HG13 . . 4.290 3.912 3.699 4.071 . 0 0 "[ . 1 . 2]" 1
898 1 51 ILE HA 1 51 ILE MD . . 3.240 2.842 1.953 3.069 . 0 0 "[ . 1 . 2]" 1
899 1 51 ILE HA 1 51 ILE HG13 . . 4.180 2.407 2.209 3.789 . 0 0 "[ . 1 . 2]" 1
900 1 51 ILE HA 1 51 ILE MG . . 3.320 2.520 2.256 2.587 . 0 0 "[ . 1 . 2]" 1
901 1 51 ILE HA 1 52 ILE H . . 3.160 2.336 2.210 2.408 . 0 0 "[ . 1 . 2]" 1
902 1 51 ILE HA 1 52 ILE HB . . 4.920 4.794 4.636 4.884 . 0 0 "[ . 1 . 2]" 1
903 1 51 ILE HA 1 52 ILE HG12 . . 5.260 3.533 3.455 3.635 . 0 0 "[ . 1 . 2]" 1
904 1 51 ILE HA 1 72 GLU HB2 . . 4.520 3.937 3.690 4.056 . 0 0 "[ . 1 . 2]" 1
905 1 51 ILE HA 1 72 GLU HG3 . . 5.260 3.971 3.811 4.381 . 0 0 "[ . 1 . 2]" 1
906 1 51 ILE HA 1 73 VAL H . . 3.900 3.228 2.922 3.633 . 0 0 "[ . 1 . 2]" 1
907 1 51 ILE HB 1 51 ILE MD . . 3.590 2.251 2.130 3.196 . 0 0 "[ . 1 . 2]" 1
908 1 51 ILE HB 1 70 GLY H . . 5.500 5.429 5.086 5.538 0.038 7 0 "[ . 1 . 2]" 1
909 1 51 ILE HB 1 70 GLY HA2 . . 5.260 4.940 4.474 5.085 . 0 0 "[ . 1 . 2]" 1
910 1 51 ILE HB 1 72 GLU HB2 . . 5.260 4.956 4.888 5.303 0.043 12 0 "[ . 1 . 2]" 1
911 1 51 ILE MD 1 72 GLU H . . 5.000 4.901 3.759 5.047 0.047 18 0 "[ . 1 . 2]" 1
912 1 51 ILE MD 1 72 GLU HA . . 3.810 2.876 1.927 3.266 . 0 0 "[ . 1 . 2]" 1
913 1 51 ILE MD 1 72 GLU HB2 . . 3.170 2.800 1.775 3.045 . 0 0 "[ . 1 . 2]" 1
914 1 51 ILE MD 1 72 GLU HB3 . . 4.100 4.030 3.114 4.175 0.075 14 0 "[ . 1 . 2]" 1
915 1 51 ILE MD 1 72 GLU HG3 . . 3.810 2.129 1.896 3.056 . 0 0 "[ . 1 . 2]" 1
916 1 51 ILE MD 1 73 VAL H . . 4.270 3.595 3.070 4.195 . 0 0 "[ . 1 . 2]" 1
917 1 51 ILE HG12 1 72 GLU HB2 . . 4.690 3.054 2.810 4.533 . 0 0 "[ . 1 . 2]" 1
918 1 51 ILE HG13 1 72 GLU HA . . 4.920 2.173 1.981 4.796 . 0 0 "[ . 1 . 2]" 1
919 1 51 ILE HG13 1 72 GLU HB2 . . 4.690 2.090 1.940 3.957 . 0 0 "[ . 1 . 2]" 1
920 1 51 ILE MG 1 52 ILE H . . 3.390 2.142 1.917 2.656 . 0 0 "[ . 1 . 2]" 1
921 1 51 ILE MG 1 53 SER HA . . 4.520 4.135 3.971 4.652 0.132 12 0 "[ . 1 . 2]" 1
922 1 51 ILE MG 1 69 GLU HA . . 4.520 4.359 4.207 4.604 0.084 12 0 "[ . 1 . 2]" 1
923 1 51 ILE MG 1 70 GLY H . . 3.900 2.671 2.523 2.793 . 0 0 "[ . 1 . 2]" 1
924 1 51 ILE MG 1 70 GLY HA2 . . 3.330 2.279 1.977 2.396 . 0 0 "[ . 1 . 2]" 1
925 1 51 ILE MG 1 70 GLY HA3 . . 3.650 3.584 3.259 3.676 0.026 12 0 "[ . 1 . 2]" 1
926 1 51 ILE MG 1 71 ASP H . . 4.380 3.168 2.165 3.721 . 0 0 "[ . 1 . 2]" 1
927 1 52 ILE H 1 52 ILE HB . . 3.510 2.465 2.406 2.500 . 0 0 "[ . 1 . 2]" 1
928 1 52 ILE H 1 52 ILE MD . . 3.720 3.283 2.951 3.636 . 0 0 "[ . 1 . 2]" 1
929 1 52 ILE H 1 52 ILE HG12 . . 3.680 1.956 1.908 2.114 . 0 0 "[ . 1 . 2]" 1
930 1 52 ILE H 1 52 ILE HG13 . . 3.760 3.351 3.175 3.461 . 0 0 "[ . 1 . 2]" 1
931 1 52 ILE H 1 52 ILE MG . . 3.900 3.713 3.707 3.721 . 0 0 "[ . 1 . 2]" 1
932 1 52 ILE H 1 53 SER H . . 5.220 4.650 4.641 4.662 . 0 0 "[ . 1 . 2]" 1
933 1 52 ILE H 1 69 GLU HA . . 4.920 4.287 4.214 4.362 . 0 0 "[ . 1 . 2]" 1
934 1 52 ILE H 1 70 GLY H . . 4.730 2.969 2.799 3.133 . 0 0 "[ . 1 . 2]" 1
935 1 52 ILE H 1 70 GLY HA2 . . 5.260 4.186 4.041 4.348 . 0 0 "[ . 1 . 2]" 1
936 1 52 ILE H 1 71 ASP H . . 4.630 2.979 2.043 3.342 . 0 0 "[ . 1 . 2]" 1
937 1 52 ILE H 1 71 ASP HA . . 5.500 4.589 4.478 4.697 . 0 0 "[ . 1 . 2]" 1
938 1 52 ILE H 1 71 ASP HB2 . . 4.690 3.713 3.537 3.977 . 0 0 "[ . 1 . 2]" 1
939 1 52 ILE H 1 71 ASP HB3 . . 4.920 4.256 3.835 4.659 . 0 0 "[ . 1 . 2]" 1
940 1 52 ILE H 1 72 GLU HA . . 4.180 3.796 3.700 4.045 . 0 0 "[ . 1 . 2]" 1
941 1 52 ILE H 1 73 VAL QG . . 4.270 4.104 3.903 4.332 0.062 12 0 "[ . 1 . 2]" 1
942 1 52 ILE HA 1 52 ILE MD . . 3.560 2.069 1.948 2.301 . 0 0 "[ . 1 . 2]" 1
943 1 52 ILE HA 1 52 ILE HG12 . . 4.030 3.002 2.766 3.184 . 0 0 "[ . 1 . 2]" 1
944 1 52 ILE HA 1 52 ILE HG13 . . 3.960 3.770 3.738 3.797 . 0 0 "[ . 1 . 2]" 1
945 1 52 ILE HA 1 52 ILE MG . . 3.250 2.404 2.308 2.481 . 0 0 "[ . 1 . 2]" 1
946 1 52 ILE HA 1 53 SER H . . 3.220 2.302 2.263 2.450 . 0 0 "[ . 1 . 2]" 1
947 1 52 ILE HA 1 53 SER HB3 . . 4.690 4.071 3.933 4.177 . 0 0 "[ . 1 . 2]" 1
948 1 52 ILE HB 1 52 ILE MD . . 3.480 3.199 3.172 3.217 . 0 0 "[ . 1 . 2]" 1
949 1 52 ILE HB 1 53 SER H . . 5.500 3.964 3.663 4.090 . 0 0 "[ . 1 . 2]" 1
950 1 52 ILE HB 1 69 GLU HA . . 3.590 1.989 1.966 2.040 . 0 0 "[ . 1 . 2]" 1
951 1 52 ILE HB 1 70 GLY H . . 3.810 1.958 1.921 2.100 . 0 0 "[ . 1 . 2]" 1
952 1 52 ILE HB 1 71 ASP H . . 3.960 2.392 2.173 2.566 . 0 0 "[ . 1 . 2]" 1
953 1 52 ILE HB 1 71 ASP HB2 . . 4.520 3.222 2.979 3.379 . 0 0 "[ . 1 . 2]" 1
954 1 52 ILE MD 1 53 SER H . . 4.690 3.510 3.333 3.682 . 0 0 "[ . 1 . 2]" 1
955 1 52 ILE MD 1 54 ARG H . . 5.260 4.595 4.315 4.811 . 0 0 "[ . 1 . 2]" 1
956 1 52 ILE MD 1 67 LEU HA . . 4.520 4.253 3.993 4.513 . 0 0 "[ . 1 . 2]" 1
957 1 52 ILE MD 1 67 LEU HB3 . . 4.030 2.685 2.219 3.065 . 0 0 "[ . 1 . 2]" 1
958 1 52 ILE MD 1 67 LEU QD . . 3.000 2.607 2.307 2.861 . 0 0 "[ . 1 . 2]" 1
959 1 52 ILE MD 1 68 HIS H . . 4.280 4.293 4.144 4.346 0.066 9 0 "[ . 1 . 2]" 1
960 1 52 ILE MD 1 69 GLU HA . . 5.260 4.402 4.108 4.557 . 0 0 "[ . 1 . 2]" 1
961 1 52 ILE MD 1 71 ASP H . . 4.380 4.402 4.305 4.519 0.139 12 0 "[ . 1 . 2]" 1
962 1 52 ILE MD 1 71 ASP HB2 . . 3.650 3.606 3.387 3.688 0.038 14 0 "[ . 1 . 2]" 1
963 1 52 ILE MD 1 71 ASP HB3 . . 4.380 3.919 3.472 4.376 . 0 0 "[ . 1 . 2]" 1
964 1 52 ILE MD 1 73 VAL QG . . 2.950 2.766 2.496 2.974 0.024 12 0 "[ . 1 . 2]" 1
965 1 52 ILE HG12 1 52 ILE MG . . 3.500 3.227 3.209 3.240 . 0 0 "[ . 1 . 2]" 1
966 1 52 ILE HG12 1 53 SER H . . 5.260 5.026 4.839 5.165 . 0 0 "[ . 1 . 2]" 1
967 1 52 ILE HG12 1 67 LEU QD . . 4.520 3.985 3.555 4.374 . 0 0 "[ . 1 . 2]" 1
968 1 52 ILE HG12 1 68 HIS H . . 5.410 4.712 4.265 5.294 . 0 0 "[ . 1 . 2]" 1
969 1 52 ILE HG12 1 71 ASP H . . 5.500 3.079 2.734 3.493 . 0 0 "[ . 1 . 2]" 1
970 1 52 ILE HG12 1 71 ASP HB2 . . 4.690 2.583 2.081 3.085 . 0 0 "[ . 1 . 2]" 1
971 1 52 ILE HG12 1 71 ASP HB3 . . 4.920 3.086 2.638 3.793 . 0 0 "[ . 1 . 2]" 1
972 1 52 ILE HG12 1 73 VAL QG . . 3.620 3.411 3.133 3.659 0.039 14 0 "[ . 1 . 2]" 1
973 1 52 ILE HG13 1 52 ILE MG . . 3.390 2.515 2.390 2.635 . 0 0 "[ . 1 . 2]" 1
974 1 52 ILE HG13 1 53 SER H . . 5.260 5.275 5.085 5.332 0.072 12 0 "[ . 1 . 2]" 1
975 1 52 ILE HG13 1 68 HIS H . . 4.460 3.179 2.916 3.605 . 0 0 "[ . 1 . 2]" 1
976 1 52 ILE HG13 1 71 ASP H . . 5.340 3.077 2.843 3.339 . 0 0 "[ . 1 . 2]" 1
977 1 52 ILE HG13 1 71 ASP HB2 . . 4.920 2.049 1.966 2.145 . 0 0 "[ . 1 . 2]" 1
978 1 52 ILE HG13 1 71 ASP HB3 . . 5.260 3.170 2.566 3.548 . 0 0 "[ . 1 . 2]" 1
979 1 52 ILE MG 1 53 SER H . . 3.720 2.073 1.854 2.384 . 0 0 "[ . 1 . 2]" 1
980 1 52 ILE MG 1 53 SER HA . . 4.180 3.715 3.587 3.852 . 0 0 "[ . 1 . 2]" 1
981 1 52 ILE MG 1 53 SER HB2 . . 5.260 5.056 4.983 5.136 . 0 0 "[ . 1 . 2]" 1
982 1 52 ILE MG 1 53 SER HB3 . . 5.260 4.317 4.187 4.512 . 0 0 "[ . 1 . 2]" 1
983 1 52 ILE MG 1 54 ARG H . . 3.590 2.659 2.477 2.993 . 0 0 "[ . 1 . 2]" 1
984 1 52 ILE MG 1 54 ARG HB3 . . 4.920 4.944 4.903 5.026 0.106 6 0 "[ . 1 . 2]" 1
985 1 52 ILE MG 1 55 ILE H . . 5.370 4.571 4.506 4.652 . 0 0 "[ . 1 . 2]" 1
986 1 52 ILE MG 1 55 ILE MD . . 3.130 2.070 1.932 2.241 . 0 0 "[ . 1 . 2]" 1
987 1 52 ILE MG 1 55 ILE HG12 . . 3.760 2.752 2.611 2.901 . 0 0 "[ . 1 . 2]" 1
988 1 52 ILE MG 1 55 ILE HG13 . . 3.960 3.475 3.233 3.613 . 0 0 "[ . 1 . 2]" 1
989 1 52 ILE MG 1 68 HIS H . . 4.970 4.015 3.782 4.273 . 0 0 "[ . 1 . 2]" 1
990 1 52 ILE MG 1 69 GLU H . . 4.920 3.216 3.026 3.424 . 0 0 "[ . 1 . 2]" 1
991 1 52 ILE MG 1 69 GLU HA . . 3.190 1.992 1.905 2.154 . 0 0 "[ . 1 . 2]" 1
992 1 52 ILE MG 1 69 GLU QB . . 4.520 3.487 3.243 3.626 . 0 0 "[ . 1 . 2]" 1
993 1 52 ILE MG 1 69 GLU HG2 . . 4.520 2.477 2.193 2.748 . 0 0 "[ . 1 . 2]" 1
994 1 52 ILE MG 1 69 GLU HG3 . . 4.690 2.962 2.707 3.191 . 0 0 "[ . 1 . 2]" 1
995 1 52 ILE MG 1 70 GLY H . . 3.960 3.358 3.239 3.440 . 0 0 "[ . 1 . 2]" 1
996 1 52 ILE MG 1 71 ASP H . . 4.520 3.863 3.694 4.131 . 0 0 "[ . 1 . 2]" 1
997 1 52 ILE MG 1 71 ASP HB2 . . 4.920 3.957 3.745 4.090 . 0 0 "[ . 1 . 2]" 1
998 1 53 SER H 1 53 SER HB2 . . 4.030 3.686 3.587 3.851 . 0 0 "[ . 1 . 2]" 1
999 1 53 SER H 1 53 SER HB3 . . 3.960 2.567 2.408 2.842 . 0 0 "[ . 1 . 2]" 1
1000 1 53 SER H 1 54 ARG H . . 3.430 2.036 1.944 2.211 . 0 0 "[ . 1 . 2]" 1
1001 1 53 SER HA 1 69 GLU QB . . 4.690 4.052 3.524 4.382 . 0 0 "[ . 1 . 2]" 1
1002 1 53 SER HA 1 70 GLY H . . 4.690 4.592 4.238 4.717 0.027 17 0 "[ . 1 . 2]" 1
1003 1 53 SER HB2 1 54 ARG H . . 4.380 4.040 3.885 4.182 . 0 0 "[ . 1 . 2]" 1
1004 1 53 SER HB3 1 54 ARG H . . 4.100 3.362 3.089 3.706 . 0 0 "[ . 1 . 2]" 1
1005 1 54 ARG H 1 54 ARG HB2 . . 3.970 3.368 3.021 3.491 . 0 0 "[ . 1 . 2]" 1
1006 1 54 ARG H 1 54 ARG HB3 . . 4.180 2.881 2.773 2.981 . 0 0 "[ . 1 . 2]" 1
1007 1 54 ARG H 1 54 ARG HD2 . . 5.500 5.401 5.242 6.300 0.800 10 1 "[ . + . 2]" 1
1008 1 54 ARG H 1 54 ARG HG2 . . 4.920 4.464 4.248 4.555 . 0 0 "[ . 1 . 2]" 1
1009 1 54 ARG H 1 54 ARG HG3 . . 4.690 4.706 4.672 4.872 0.182 6 0 "[ . 1 . 2]" 1
1010 1 54 ARG H 1 55 ILE H . . 4.670 4.389 4.367 4.429 . 0 0 "[ . 1 . 2]" 1
1011 1 54 ARG H 1 55 ILE MD . . 5.260 3.817 3.565 4.430 . 0 0 "[ . 1 . 2]" 1
1012 1 54 ARG H 1 69 GLU HA . . 5.260 4.978 4.739 5.268 0.008 6 0 "[ . 1 . 2]" 1
1013 1 54 ARG H 1 69 GLU HG2 . . 5.260 3.581 3.276 3.849 . 0 0 "[ . 1 . 2]" 1
1014 1 54 ARG H 1 69 GLU HG3 . . 5.500 4.976 4.690 5.279 . 0 0 "[ . 1 . 2]" 1
1015 1 54 ARG HA 1 54 ARG HD2 . . 4.270 4.349 4.272 4.859 0.589 10 1 "[ . + . 2]" 1
1016 1 54 ARG HA 1 54 ARG HG2 . . 4.030 3.228 2.421 3.352 . 0 0 "[ . 1 . 2]" 1
1017 1 54 ARG HA 1 54 ARG HG3 . . 3.760 2.536 2.455 3.022 . 0 0 "[ . 1 . 2]" 1
1018 1 54 ARG HA 1 55 ILE H . . 2.990 2.489 2.356 2.518 . 0 0 "[ . 1 . 2]" 1
1019 1 54 ARG HA 1 55 ILE HB . . 4.670 4.494 4.413 4.538 . 0 0 "[ . 1 . 2]" 1
1020 1 54 ARG HA 1 69 GLU HG2 . . 3.720 2.340 2.008 2.857 . 0 0 "[ . 1 . 2]" 1
1021 1 54 ARG HA 1 69 GLU HG3 . . 4.100 3.361 2.866 3.941 . 0 0 "[ . 1 . 2]" 1
1022 1 54 ARG HB2 1 54 ARG HD2 . . 4.180 2.372 2.235 3.599 . 0 0 "[ . 1 . 2]" 1
1023 1 54 ARG HB2 1 55 ILE H . . 4.520 3.874 3.763 4.175 . 0 0 "[ . 1 . 2]" 1
1024 1 54 ARG HB3 1 54 ARG HD2 . . 3.900 2.752 2.657 3.831 . 0 0 "[ . 1 . 2]" 1
1025 1 54 ARG HB3 1 55 ILE H . . 4.290 3.702 3.623 3.875 . 0 0 "[ . 1 . 2]" 1
1026 1 54 ARG HD3 1 55 ILE H . . 4.830 4.267 3.915 4.499 . 0 0 "[ . 1 . 2]" 1
1027 1 54 ARG HD3 1 56 VAL QG . . 4.270 3.569 2.069 4.566 0.296 10 0 "[ . 1 . 2]" 1
1028 1 54 ARG HG2 1 55 ILE H . . 3.880 2.114 1.935 2.327 . 0 0 "[ . 1 . 2]" 1
1029 1 54 ARG HG2 1 55 ILE HA . . 4.520 3.714 3.468 4.224 . 0 0 "[ . 1 . 2]" 1
1030 1 54 ARG HG2 1 56 VAL H . . 5.500 4.159 3.711 4.683 . 0 0 "[ . 1 . 2]" 1
1031 1 54 ARG HG2 1 56 VAL HA . . 4.520 3.966 3.791 4.558 0.038 6 0 "[ . 1 . 2]" 1
1032 1 54 ARG HG2 1 56 VAL QG . . 4.030 3.166 2.775 3.817 . 0 0 "[ . 1 . 2]" 1
1033 1 54 ARG HG3 1 55 ILE H . . 4.180 2.123 1.934 3.580 . 0 0 "[ . 1 . 2]" 1
1034 1 55 ILE H 1 55 ILE HB . . 3.330 2.567 2.465 2.632 . 0 0 "[ . 1 . 2]" 1
1035 1 55 ILE H 1 55 ILE MD . . 4.180 3.761 3.606 4.094 . 0 0 "[ . 1 . 2]" 1
1036 1 55 ILE H 1 55 ILE HG12 . . 3.970 3.024 2.953 3.150 . 0 0 "[ . 1 . 2]" 1
1037 1 55 ILE H 1 55 ILE HG13 . . 4.520 4.273 4.151 4.358 . 0 0 "[ . 1 . 2]" 1
1038 1 55 ILE H 1 55 ILE MG . . 4.180 3.781 3.721 3.819 . 0 0 "[ . 1 . 2]" 1
1039 1 55 ILE H 1 56 VAL H . . 5.100 4.257 4.144 4.331 . 0 0 "[ . 1 . 2]" 1
1040 1 55 ILE H 1 69 GLU HG2 . . 4.170 3.973 3.822 4.179 0.009 13 0 "[ . 1 . 2]" 1
1041 1 55 ILE H 1 69 GLU HG3 . . 4.360 3.958 3.701 4.176 . 0 0 "[ . 1 . 2]" 1
1042 1 55 ILE HA 1 55 ILE MD . . 3.250 1.998 1.935 2.089 . 0 0 "[ . 1 . 2]" 1
1043 1 55 ILE HA 1 55 ILE HG12 . . 4.180 3.049 2.805 3.146 . 0 0 "[ . 1 . 2]" 1
1044 1 55 ILE HA 1 55 ILE MG . . 3.370 2.504 2.480 2.536 . 0 0 "[ . 1 . 2]" 1
1045 1 55 ILE HA 1 56 VAL H . . 3.240 2.179 2.176 2.195 . 0 0 "[ . 1 . 2]" 1
1046 1 55 ILE HA 1 56 VAL HA . . 4.690 4.361 4.351 4.397 . 0 0 "[ . 1 . 2]" 1
1047 1 55 ILE HA 1 56 VAL HB . . 4.690 4.721 4.679 4.748 0.058 10 0 "[ . 1 . 2]" 1
1048 1 55 ILE HA 1 56 VAL QG . . 3.900 3.423 3.379 3.538 . 0 0 "[ . 1 . 2]" 1
1049 1 55 ILE HA 1 61 ALA MB . . 4.690 4.276 4.037 4.605 . 0 0 "[ . 1 . 2]" 1
1050 1 55 ILE HB 1 55 ILE MD . . 3.720 3.205 3.194 3.212 . 0 0 "[ . 1 . 2]" 1
1051 1 55 ILE HB 1 56 VAL H . . 4.690 4.419 4.344 4.561 . 0 0 "[ . 1 . 2]" 1
1052 1 55 ILE MD 1 55 ILE MG . . 3.030 1.962 1.846 2.062 . 0 0 "[ . 1 . 2]" 1
1053 1 55 ILE MD 1 56 VAL H . . 4.380 3.455 3.374 3.567 . 0 0 "[ . 1 . 2]" 1
1054 1 55 ILE MD 1 61 ALA H . . 5.280 5.287 5.189 5.321 0.041 8 0 "[ . 1 . 2]" 1
1055 1 55 ILE MD 1 61 ALA HA . . 5.260 5.088 4.898 5.217 . 0 0 "[ . 1 . 2]" 1
1056 1 55 ILE MD 1 61 ALA MB . . 3.140 2.681 2.559 2.809 . 0 0 "[ . 1 . 2]" 1
1057 1 55 ILE MD 1 62 GLU H . . 5.500 4.317 3.953 4.612 . 0 0 "[ . 1 . 2]" 1
1058 1 55 ILE MD 1 62 GLU HA . . 4.690 4.417 4.027 4.696 0.006 13 0 "[ . 1 . 2]" 1
1059 1 55 ILE MD 1 67 LEU H . . 4.680 4.453 4.205 4.687 0.007 2 0 "[ . 1 . 2]" 1
1060 1 55 ILE MD 1 67 LEU HA . . 4.690 4.359 4.093 4.698 0.008 20 0 "[ . 1 . 2]" 1
1061 1 55 ILE MD 1 67 LEU HB2 . . 4.030 2.838 2.588 3.105 . 0 0 "[ . 1 . 2]" 1
1062 1 55 ILE MD 1 67 LEU HB3 . . 4.030 2.629 2.043 3.372 . 0 0 "[ . 1 . 2]" 1
1063 1 55 ILE MD 1 67 LEU QD . . 4.380 3.610 3.220 3.862 . 0 0 "[ . 1 . 2]" 1
1064 1 55 ILE MD 1 68 HIS H . . 4.520 4.196 3.922 4.488 . 0 0 "[ . 1 . 2]" 1
1065 1 55 ILE MD 1 68 HIS HA . . 3.720 3.510 3.106 3.755 0.035 10 0 "[ . 1 . 2]" 1
1066 1 55 ILE MD 1 69 GLU H . . 4.100 4.125 4.091 4.153 0.053 13 0 "[ . 1 . 2]" 1
1067 1 55 ILE MD 1 69 GLU HA . . 4.690 4.212 4.055 4.320 . 0 0 "[ . 1 . 2]" 1
1068 1 55 ILE MD 1 69 GLU HG2 . . 4.920 3.925 3.718 4.232 . 0 0 "[ . 1 . 2]" 1
1069 1 55 ILE MD 1 69 GLU HG3 . . 4.030 3.751 3.564 4.023 . 0 0 "[ . 1 . 2]" 1
1070 1 55 ILE HG12 1 68 HIS HA . . 4.690 3.790 3.092 4.262 . 0 0 "[ . 1 . 2]" 1
1071 1 55 ILE HG12 1 69 GLU H . . 4.760 3.379 3.182 3.663 . 0 0 "[ . 1 . 2]" 1
1072 1 55 ILE HG12 1 69 GLU HG2 . . 4.520 2.973 2.661 3.135 . 0 0 "[ . 1 . 2]" 1
1073 1 55 ILE HG12 1 69 GLU HG3 . . 4.270 2.272 2.041 2.549 . 0 0 "[ . 1 . 2]" 1
1074 1 55 ILE HG13 1 55 ILE MG . . 3.280 2.408 2.329 2.591 . 0 0 "[ . 1 . 2]" 1
1075 1 55 ILE HG13 1 68 HIS HA . . 4.100 2.844 2.152 3.282 . 0 0 "[ . 1 . 2]" 1
1076 1 55 ILE HG13 1 69 GLU H . . 4.710 3.491 3.155 3.760 . 0 0 "[ . 1 . 2]" 1
1077 1 55 ILE HG13 1 69 GLU HG2 . . 4.690 4.473 4.159 4.710 0.020 20 0 "[ . 1 . 2]" 1
1078 1 55 ILE HG13 1 69 GLU HG3 . . 4.380 3.291 2.704 3.631 . 0 0 "[ . 1 . 2]" 1
1079 1 55 ILE MG 1 56 VAL H . . 3.680 2.779 2.649 3.084 . 0 0 "[ . 1 . 2]" 1
1080 1 55 ILE MG 1 56 VAL HA . . 3.900 3.960 3.898 4.038 0.138 6 0 "[ . 1 . 2]" 1
1081 1 55 ILE MG 1 61 ALA MB . . 3.270 2.867 2.510 3.297 0.027 6 0 "[ . 1 . 2]" 1
1082 1 55 ILE MG 1 62 GLU H . . 3.900 3.166 2.914 3.526 . 0 0 "[ . 1 . 2]" 1
1083 1 55 ILE MG 1 62 GLU HA . . 3.300 2.659 2.437 2.886 . 0 0 "[ . 1 . 2]" 1
1084 1 55 ILE MG 1 62 GLU HB2 . . 3.320 2.064 1.836 2.742 . 0 0 "[ . 1 . 2]" 1
1085 1 55 ILE MG 1 62 GLU HB3 . . 3.900 3.357 3.112 3.946 0.046 20 0 "[ . 1 . 2]" 1
1086 1 55 ILE MG 1 62 GLU HG3 . . 4.180 3.601 3.356 4.169 . 0 0 "[ . 1 . 2]" 1
1087 1 55 ILE MG 1 63 LYS H . . 5.120 4.967 4.758 5.176 0.056 20 0 "[ . 1 . 2]" 1
1088 1 56 VAL H 1 56 VAL HB . . 3.640 2.551 2.511 2.579 . 0 0 "[ . 1 . 2]" 1
1089 1 56 VAL H 1 56 VAL QG . . 3.190 2.186 2.109 2.288 . 0 0 "[ . 1 . 2]" 1
1090 1 56 VAL H 1 57 LYS H . . 5.080 4.611 4.569 4.634 . 0 0 "[ . 1 . 2]" 1
1091 1 56 VAL H 1 61 ALA MB . . 5.410 4.434 4.124 4.769 . 0 0 "[ . 1 . 2]" 1
1092 1 56 VAL HA 1 56 VAL QG . . 2.960 2.144 2.126 2.155 . 0 0 "[ . 1 . 2]" 1
1093 1 56 VAL HA 1 57 LYS H . . 2.850 2.298 2.224 2.351 . 0 0 "[ . 1 . 2]" 1
1094 1 56 VAL HA 1 57 LYS HB2 . . 4.690 4.677 4.468 4.733 0.043 7 0 "[ . 1 . 2]" 1
1095 1 56 VAL HA 1 57 LYS HB3 . . 4.690 4.447 4.375 4.648 . 0 0 "[ . 1 . 2]" 1
1096 1 56 VAL HB 1 57 LYS H . . 4.110 3.865 3.746 4.090 . 0 0 "[ . 1 . 2]" 1
1097 1 56 VAL HB 1 59 GLY H . . 4.900 4.154 3.500 4.406 . 0 0 "[ . 1 . 2]" 1
1098 1 56 VAL QG 1 57 LYS H . . 3.480 2.142 1.935 2.450 . 0 0 "[ . 1 . 2]" 1
1099 1 56 VAL QG 1 57 LYS HA . . 4.690 4.028 3.965 4.098 . 0 0 "[ . 1 . 2]" 1
1100 1 56 VAL QG 1 57 LYS HB2 . . 4.690 4.523 4.377 4.652 . 0 0 "[ . 1 . 2]" 1
1101 1 56 VAL QG 1 57 LYS HB3 . . 4.920 3.670 3.442 3.951 . 0 0 "[ . 1 . 2]" 1
1102 1 56 VAL QG 1 58 GLY H . . 5.500 4.972 4.475 5.093 . 0 0 "[ . 1 . 2]" 1
1103 1 56 VAL QG 1 59 GLY H . . 4.590 4.050 3.550 4.212 . 0 0 "[ . 1 . 2]" 1
1104 1 57 LYS H 1 57 LYS HB2 . . 3.200 2.870 2.540 2.960 . 0 0 "[ . 1 . 2]" 1
1105 1 57 LYS H 1 57 LYS HB3 . . 3.620 2.228 2.187 2.433 . 0 0 "[ . 1 . 2]" 1
1106 1 57 LYS H 1 57 LYS HD3 . . 5.260 4.838 4.350 5.514 0.254 16 0 "[ . 1 . 2]" 1
1107 1 57 LYS H 1 57 LYS QG . . 4.110 3.848 3.791 3.973 . 0 0 "[ . 1 . 2]" 1
1108 1 57 LYS H 1 58 GLY H . . 4.970 4.610 4.419 4.645 . 0 0 "[ . 1 . 2]" 1
1109 1 57 LYS H 1 59 GLY H . . 5.500 4.545 4.429 4.711 . 0 0 "[ . 1 . 2]" 1
1110 1 57 LYS HA 1 57 LYS HD3 . . 4.180 3.378 2.046 4.975 0.795 16 4 "[ . - *1 *.+ 2]" 1
1111 1 57 LYS HA 1 57 LYS QG . . 3.960 2.773 2.330 3.124 . 0 0 "[ . 1 . 2]" 1
1112 1 57 LYS HA 1 58 GLY H . . 2.920 2.301 2.179 2.390 . 0 0 "[ . 1 . 2]" 1
1113 1 57 LYS HA 1 59 GLY H . . 4.110 3.112 2.986 3.708 . 0 0 "[ . 1 . 2]" 1
1114 1 57 LYS HA 1 62 GLU HB2 . . 3.760 3.314 2.589 3.664 . 0 0 "[ . 1 . 2]" 1
1115 1 57 LYS HA 1 62 GLU HB3 . . 4.380 3.201 2.697 3.566 . 0 0 "[ . 1 . 2]" 1
1116 1 57 LYS HA 1 62 GLU HG2 . . 4.100 3.579 2.801 4.129 0.029 20 0 "[ . 1 . 2]" 1
1117 1 57 LYS HA 1 62 GLU HG3 . . 4.520 4.112 2.461 4.521 0.001 15 0 "[ . 1 . 2]" 1
1118 1 57 LYS HB2 1 58 GLY H . . 4.520 3.919 3.767 4.360 . 0 0 "[ . 1 . 2]" 1
1119 1 57 LYS HB3 1 58 GLY H . . 4.520 4.186 4.003 4.531 0.011 20 0 "[ . 1 . 2]" 1
1120 1 57 LYS HD2 1 57 LYS QG . . 2.720 2.249 2.179 2.571 . 0 0 "[ . 1 . 2]" 1
1121 1 57 LYS HD2 1 58 GLY H . . 4.920 3.522 1.951 4.735 . 0 0 "[ . 1 . 2]" 1
1122 1 57 LYS HD3 1 57 LYS HE2 . . 2.870 2.526 2.289 3.057 0.187 3 0 "[ . 1 . 2]" 1
1123 1 57 LYS QG 1 58 GLY H . . 4.520 2.345 1.903 3.005 . 0 0 "[ . 1 . 2]" 1
1124 1 57 LYS QG 1 58 GLY HA2 . . 5.260 3.429 3.252 3.615 . 0 0 "[ . 1 . 2]" 1
1125 1 57 LYS QG 1 58 GLY HA3 . . 5.260 3.279 2.982 3.943 . 0 0 "[ . 1 . 2]" 1
1126 1 57 LYS QG 1 59 GLY H . . 5.240 4.311 4.022 4.910 . 0 0 "[ . 1 . 2]" 1
1127 1 58 GLY H 1 59 GLY H . . 3.550 2.577 2.369 2.677 . 0 0 "[ . 1 . 2]" 1
1128 1 58 GLY H 1 62 GLU HB3 . . 5.100 3.260 2.493 3.688 . 0 0 "[ . 1 . 2]" 1
1129 1 58 GLY H 1 62 GLU HG2 . . 4.200 3.288 2.820 4.195 . 0 0 "[ . 1 . 2]" 1
1130 1 58 GLY H 1 62 GLU HG3 . . 5.100 4.529 2.806 4.880 . 0 0 "[ . 1 . 2]" 1
1131 1 59 GLY H 1 60 ALA H . . 4.700 4.611 4.500 4.650 . 0 0 "[ . 1 . 2]" 1
1132 1 59 GLY H 1 62 GLU H . . 4.350 3.835 3.550 4.076 . 0 0 "[ . 1 . 2]" 1
1133 1 59 GLY H 1 62 GLU HB2 . . 4.000 3.885 3.614 4.080 0.080 16 0 "[ . 1 . 2]" 1
1134 1 59 GLY H 1 62 GLU HB3 . . 4.430 2.653 2.207 3.258 . 0 0 "[ . 1 . 2]" 1
1135 1 59 GLY H 1 63 LYS H . . 5.180 3.971 3.445 5.190 0.010 20 0 "[ . 1 . 2]" 1
1136 1 59 GLY HA2 1 60 ALA H . . 3.360 2.352 2.214 2.691 . 0 0 "[ . 1 . 2]" 1
1137 1 59 GLY HA2 1 60 ALA MB . . 4.520 4.028 3.939 4.145 . 0 0 "[ . 1 . 2]" 1
1138 1 59 GLY HA2 1 61 ALA H . . 4.890 4.023 3.759 4.671 . 0 0 "[ . 1 . 2]" 1
1139 1 59 GLY HA2 1 62 GLU H . . 5.260 4.652 4.262 5.052 . 0 0 "[ . 1 . 2]" 1
1140 1 59 GLY HA3 1 60 ALA H . . 3.410 2.960 2.551 3.210 . 0 0 "[ . 1 . 2]" 1
1141 1 59 GLY HA3 1 60 ALA MB . . 4.690 4.475 4.267 4.564 . 0 0 "[ . 1 . 2]" 1
1142 1 59 GLY HA3 1 61 ALA H . . 3.620 3.266 3.033 3.689 0.069 20 0 "[ . 1 . 2]" 1
1143 1 59 GLY HA3 1 62 GLU H . . 4.770 3.292 2.932 3.668 . 0 0 "[ . 1 . 2]" 1
1144 1 59 GLY HA3 1 62 GLU HB3 . . 4.690 3.598 3.203 4.028 . 0 0 "[ . 1 . 2]" 1
1145 1 60 ALA H 1 60 ALA MB . . 2.990 2.067 1.948 2.178 . 0 0 "[ . 1 . 2]" 1
1146 1 60 ALA H 1 61 ALA H . . 3.570 2.677 2.335 2.930 . 0 0 "[ . 1 . 2]" 1
1147 1 60 ALA H 1 61 ALA MB . . 4.690 4.209 3.871 4.487 . 0 0 "[ . 1 . 2]" 1
1148 1 60 ALA H 1 62 GLU H . . 5.330 4.509 4.134 4.802 . 0 0 "[ . 1 . 2]" 1
1149 1 60 ALA HA 1 62 GLU H . . 5.200 4.743 4.376 4.958 . 0 0 "[ . 1 . 2]" 1
1150 1 60 ALA HA 1 63 LYS H . . 4.100 3.772 3.542 4.024 . 0 0 "[ . 1 . 2]" 1
1151 1 60 ALA HA 1 63 LYS HB2 . . 3.390 2.602 2.203 3.058 . 0 0 "[ . 1 . 2]" 1
1152 1 60 ALA HA 1 63 LYS QD . . 4.270 3.620 2.603 4.127 . 0 0 "[ . 1 . 2]" 1
1153 1 60 ALA HA 1 64 SER H . . 4.920 3.710 3.485 3.994 . 0 0 "[ . 1 . 2]" 1
1154 1 60 ALA MB 1 61 ALA H . . 3.500 2.844 2.514 3.043 . 0 0 "[ . 1 . 2]" 1
1155 1 60 ALA MB 1 61 ALA HA . . 4.100 3.869 3.687 3.974 . 0 0 "[ . 1 . 2]" 1
1156 1 61 ALA H 1 61 ALA MB . . 3.190 2.038 1.940 2.155 . 0 0 "[ . 1 . 2]" 1
1157 1 61 ALA H 1 62 GLU H . . 3.920 2.729 2.435 2.972 . 0 0 "[ . 1 . 2]" 1
1158 1 61 ALA H 1 63 LYS H . . 5.300 4.325 3.996 5.062 . 0 0 "[ . 1 . 2]" 1
1159 1 61 ALA H 1 67 LEU QD . . 5.000 4.146 3.796 4.665 . 0 0 "[ . 1 . 2]" 1
1160 1 61 ALA HA 1 64 SER H . . 4.200 4.112 3.930 4.209 0.009 1 0 "[ . 1 . 2]" 1
1161 1 61 ALA HA 1 64 SER HG . . 4.690 2.927 1.982 3.334 . 0 0 "[ . 1 . 2]" 1
1162 1 61 ALA HA 1 67 LEU HB2 . . 4.520 3.656 3.208 4.245 . 0 0 "[ . 1 . 2]" 1
1163 1 61 ALA HA 1 67 LEU QD . . 3.960 2.213 1.986 2.617 . 0 0 "[ . 1 . 2]" 1
1164 1 61 ALA MB 1 62 GLU H . . 3.650 2.383 2.197 2.559 . 0 0 "[ . 1 . 2]" 1
1165 1 61 ALA MB 1 62 GLU HA . . 4.920 3.671 3.581 3.768 . 0 0 "[ . 1 . 2]" 1
1166 1 61 ALA MB 1 62 GLU HB2 . . 5.260 4.065 3.908 4.376 . 0 0 "[ . 1 . 2]" 1
1167 1 61 ALA MB 1 62 GLU HB3 . . 4.380 4.261 4.126 4.435 0.055 20 0 "[ . 1 . 2]" 1
1168 1 61 ALA MB 1 63 LYS H . . 5.130 4.695 4.482 5.061 . 0 0 "[ . 1 . 2]" 1
1169 1 61 ALA MB 1 64 SER H . . 5.150 5.098 4.952 5.175 0.025 16 0 "[ . 1 . 2]" 1
1170 1 61 ALA MB 1 67 LEU H . . 4.920 3.752 3.449 4.055 . 0 0 "[ . 1 . 2]" 1
1171 1 61 ALA MB 1 67 LEU HA . . 5.260 4.722 4.429 5.280 0.020 20 0 "[ . 1 . 2]" 1
1172 1 61 ALA MB 1 67 LEU HB2 . . 4.270 2.165 1.903 2.741 . 0 0 "[ . 1 . 2]" 1
1173 1 61 ALA MB 1 67 LEU HB3 . . 4.270 3.289 2.895 4.071 . 0 0 "[ . 1 . 2]" 1
1174 1 61 ALA MB 1 67 LEU QD . . 3.270 1.944 1.721 2.374 . 0 0 "[ . 1 . 2]" 1
1175 1 62 GLU H 1 62 GLU HB2 . . 3.770 2.705 2.678 2.742 . 0 0 "[ . 1 . 2]" 1
1176 1 62 GLU H 1 62 GLU HB3 . . 3.890 2.268 2.242 2.295 . 0 0 "[ . 1 . 2]" 1
1177 1 62 GLU H 1 62 GLU HG2 . . 4.270 4.285 4.227 4.353 0.083 20 0 "[ . 1 . 2]" 1
1178 1 62 GLU H 1 62 GLU HG3 . . 4.520 4.428 4.375 4.629 0.109 20 0 "[ . 1 . 2]" 1
1179 1 62 GLU H 1 63 LYS H . . 3.840 2.907 2.659 3.246 . 0 0 "[ . 1 . 2]" 1
1180 1 62 GLU H 1 64 SER H . . 5.330 4.673 4.331 4.913 . 0 0 "[ . 1 . 2]" 1
1181 1 62 GLU HA 1 62 GLU HG2 . . 3.620 3.508 2.724 3.654 0.034 10 0 "[ . 1 . 2]" 1
1182 1 62 GLU HA 1 62 GLU HG3 . . 3.480 2.734 2.584 3.529 0.049 20 0 "[ . 1 . 2]" 1
1183 1 62 GLU HA 1 64 SER H . . 5.040 4.917 4.702 5.084 0.044 20 0 "[ . 1 . 2]" 1
1184 1 62 GLU HA 1 65 GLY H . . 4.530 3.314 3.106 3.626 . 0 0 "[ . 1 . 2]" 1
1185 1 62 GLU HB2 1 63 LYS H . . 4.100 3.882 3.702 4.028 . 0 0 "[ . 1 . 2]" 1
1186 1 62 GLU HB3 1 63 LYS H . . 4.210 2.472 2.291 2.674 . 0 0 "[ . 1 . 2]" 1
1187 1 62 GLU HG2 1 63 LYS H . . 3.520 3.004 2.565 3.353 . 0 0 "[ . 1 . 2]" 1
1188 1 62 GLU HG2 1 63 LYS HA . . 4.520 3.239 3.014 3.491 . 0 0 "[ . 1 . 2]" 1
1189 1 62 GLU HG3 1 63 LYS H . . 4.520 3.896 3.563 4.182 . 0 0 "[ . 1 . 2]" 1
1190 1 62 GLU HG3 1 63 LYS HA . . 4.690 4.145 3.810 4.767 0.077 8 0 "[ . 1 . 2]" 1
1191 1 63 LYS H 1 63 LYS HB2 . . 3.080 2.383 2.130 2.733 . 0 0 "[ . 1 . 2]" 1
1192 1 63 LYS H 1 63 LYS QD . . 4.510 3.433 2.521 4.148 . 0 0 "[ . 1 . 2]" 1
1193 1 63 LYS H 1 63 LYS HG2 . . 3.760 3.270 2.241 4.257 0.497 4 0 "[ . 1 . 2]" 1
1194 1 63 LYS H 1 63 LYS HG3 . . 4.140 2.785 2.028 3.169 . 0 0 "[ . 1 . 2]" 1
1195 1 63 LYS H 1 64 SER H . . 3.440 3.203 3.095 3.286 . 0 0 "[ . 1 . 2]" 1
1196 1 63 LYS H 1 65 GLY H . . 5.060 4.061 3.800 4.406 . 0 0 "[ . 1 . 2]" 1
1197 1 63 LYS HA 1 63 LYS HB2 . . 2.960 2.994 2.934 3.033 0.073 3 0 "[ . 1 . 2]" 1
1198 1 63 LYS HA 1 63 LYS QD . . 3.900 3.510 2.971 3.736 . 0 0 "[ . 1 . 2]" 1
1199 1 63 LYS HA 1 63 LYS HG2 . . 3.810 2.675 2.309 3.068 . 0 0 "[ . 1 . 2]" 1
1200 1 63 LYS HA 1 63 LYS HG3 . . 3.590 2.784 2.014 3.613 0.023 16 0 "[ . 1 . 2]" 1
1201 1 63 LYS HA 1 65 GLY H . . 4.920 4.450 4.123 4.861 . 0 0 "[ . 1 . 2]" 1
1202 1 63 LYS HB3 1 63 LYS QD . . 3.390 2.657 2.135 3.275 . 0 0 "[ . 1 . 2]" 1
1203 1 63 LYS HB3 1 64 SER H . . 3.460 3.017 2.560 3.469 0.009 12 0 "[ . 1 . 2]" 1
1204 1 63 LYS HB3 1 64 SER HA . . 4.690 4.106 3.823 4.487 . 0 0 "[ . 1 . 2]" 1
1205 1 63 LYS HB3 1 64 SER HB3 . . 5.260 4.784 4.278 5.379 0.119 4 0 "[ . 1 . 2]" 1
1206 1 63 LYS HB3 1 65 GLY H . . 5.260 5.223 5.076 5.292 0.032 16 0 "[ . 1 . 2]" 1
1207 1 63 LYS QD 1 63 LYS HG2 . . 2.750 2.352 2.201 2.508 . 0 0 "[ . 1 . 2]" 1
1208 1 63 LYS QD 1 63 LYS HG3 . . 2.600 2.375 2.188 2.523 . 0 0 "[ . 1 . 2]" 1
1209 1 63 LYS HG2 1 64 SER H . . 4.820 4.738 4.527 5.067 0.247 14 0 "[ . 1 . 2]" 1
1210 1 64 SER H 1 64 SER HB2 . . 3.570 3.472 2.898 3.556 . 0 0 "[ . 1 . 2]" 1
1211 1 64 SER H 1 64 SER HB3 . . 3.280 2.602 2.234 3.482 0.202 4 0 "[ . 1 . 2]" 1
1212 1 64 SER H 1 64 SER HG . . 4.220 2.956 1.993 3.957 . 0 0 "[ . 1 . 2]" 1
1213 1 64 SER H 1 65 GLY H . . 3.380 2.732 2.542 2.950 . 0 0 "[ . 1 . 2]" 1
1214 1 64 SER HA 1 66 LEU QD . . 4.520 3.666 2.481 4.035 . 0 0 "[ . 1 . 2]" 1
1215 1 64 SER HA 1 66 LEU HG . . 4.690 4.000 3.605 5.295 0.605 20 1 "[ . 1 . +]" 1
1216 1 64 SER HB2 1 65 GLY H . . 5.260 3.708 2.478 4.225 . 0 0 "[ . 1 . 2]" 1
1217 1 64 SER HB2 1 66 LEU H . . 3.810 3.571 2.012 3.866 0.056 3 0 "[ . 1 . 2]" 1
1218 1 64 SER HB2 1 66 LEU HB2 . . 4.920 3.903 2.713 4.281 . 0 0 "[ . 1 . 2]" 1
1219 1 64 SER HB2 1 66 LEU HB3 . . 5.260 4.827 4.420 4.938 . 0 0 "[ . 1 . 2]" 1
1220 1 64 SER HB2 1 66 LEU QD . . 4.520 2.354 1.861 2.985 . 0 0 "[ . 1 . 2]" 1
1221 1 64 SER HB2 1 66 LEU HG . . 4.180 2.099 1.948 4.347 0.167 20 0 "[ . 1 . 2]" 1
1222 1 64 SER HB3 1 65 GLY H . . 4.920 3.987 3.794 4.136 . 0 0 "[ . 1 . 2]" 1
1223 1 64 SER HB3 1 66 LEU HB2 . . 5.260 4.956 3.551 5.311 0.051 11 0 "[ . 1 . 2]" 1
1224 1 64 SER HB3 1 66 LEU QD . . 4.690 3.322 1.926 3.691 . 0 0 "[ . 1 . 2]" 1
1225 1 64 SER HB3 1 66 LEU HG . . 4.380 3.402 2.061 4.216 . 0 0 "[ . 1 . 2]" 1
1226 1 64 SER HG 1 65 GLY H . . 5.030 2.857 1.959 3.755 . 0 0 "[ . 1 . 2]" 1
1227 1 64 SER HG 1 66 LEU H . . 4.910 2.631 1.939 4.152 . 0 0 "[ . 1 . 2]" 1
1228 1 64 SER HG 1 67 LEU H . . 5.370 4.246 3.602 5.405 0.035 4 0 "[ . 1 . 2]" 1
1229 1 65 GLY H 1 66 LEU H . . 3.180 2.601 2.355 2.771 . 0 0 "[ . 1 . 2]" 1
1230 1 65 GLY H 1 66 LEU HB2 . . 5.500 4.962 4.670 5.265 . 0 0 "[ . 1 . 2]" 1
1231 1 65 GLY H 1 66 LEU QD . . 5.450 4.002 3.453 4.404 . 0 0 "[ . 1 . 2]" 1
1232 1 65 GLY H 1 67 LEU H . . 4.780 3.887 3.458 4.124 . 0 0 "[ . 1 . 2]" 1
1233 1 65 GLY H 1 67 LEU HB2 . . 5.500 5.314 4.862 5.517 0.017 9 0 "[ . 1 . 2]" 1
1234 1 65 GLY HA2 1 66 LEU QD . . 5.260 4.221 3.931 4.661 . 0 0 "[ . 1 . 2]" 1
1235 1 65 GLY HA2 1 67 LEU H . . 5.260 3.269 3.092 3.475 . 0 0 "[ . 1 . 2]" 1
1236 1 65 GLY HA3 1 67 LEU H . . 4.780 4.538 4.265 4.755 . 0 0 "[ . 1 . 2]" 1
1237 1 66 LEU H 1 66 LEU HB2 . . 3.680 2.627 2.263 2.798 . 0 0 "[ . 1 . 2]" 1
1238 1 66 LEU H 1 66 LEU HB3 . . 4.010 3.680 3.513 3.758 . 0 0 "[ . 1 . 2]" 1
1239 1 66 LEU H 1 66 LEU QD . . 3.770 2.921 1.847 3.200 . 0 0 "[ . 1 . 2]" 1
1240 1 66 LEU H 1 66 LEU HG . . 4.320 2.625 2.218 4.060 . 0 0 "[ . 1 . 2]" 1
1241 1 66 LEU H 1 67 LEU H . . 3.110 2.108 1.890 2.431 . 0 0 "[ . 1 . 2]" 1
1242 1 66 LEU H 1 67 LEU QD . . 5.260 3.309 2.744 4.080 . 0 0 "[ . 1 . 2]" 1
1243 1 66 LEU HA 1 66 LEU QD . . 3.810 2.064 1.875 2.224 . 0 0 "[ . 1 . 2]" 1
1244 1 66 LEU HA 1 66 LEU HG . . 4.100 3.417 3.319 3.582 . 0 0 "[ . 1 . 2]" 1
1245 1 66 LEU HB2 1 67 LEU H . . 4.300 3.487 3.193 3.930 . 0 0 "[ . 1 . 2]" 1
1246 1 66 LEU HB2 1 67 LEU QD . . 5.260 2.820 2.081 3.620 . 0 0 "[ . 1 . 2]" 1
1247 1 66 LEU HB3 1 67 LEU H . . 4.610 4.371 3.988 4.599 . 0 0 "[ . 1 . 2]" 1
1248 1 66 LEU HB3 1 67 LEU QD . . 5.260 3.742 3.101 4.468 . 0 0 "[ . 1 . 2]" 1
1249 1 66 LEU QD 1 67 LEU H . . 4.860 4.162 3.767 4.304 . 0 0 "[ . 1 . 2]" 1
1250 1 67 LEU H 1 67 LEU HB2 . . 3.470 2.520 2.332 2.743 . 0 0 "[ . 1 . 2]" 1
1251 1 67 LEU H 1 67 LEU HB3 . . 3.780 3.674 3.560 3.814 0.034 12 0 "[ . 1 . 2]" 1
1252 1 67 LEU H 1 67 LEU QD . . 4.260 2.802 2.184 3.667 . 0 0 "[ . 1 . 2]" 1
1253 1 67 LEU H 1 67 LEU HG . . 4.270 3.708 2.406 4.327 0.057 13 0 "[ . 1 . 2]" 1
1254 1 67 LEU H 1 68 HIS H . . 4.720 4.398 4.190 4.494 . 0 0 "[ . 1 . 2]" 1
1255 1 67 LEU HA 1 67 LEU QD . . 3.220 2.193 1.902 2.745 . 0 0 "[ . 1 . 2]" 1
1256 1 67 LEU HA 1 68 HIS H . . 2.940 2.198 2.180 2.215 . 0 0 "[ . 1 . 2]" 1
1257 1 67 LEU HA 1 68 HIS HB2 . . 5.260 4.482 4.100 5.449 0.189 15 0 "[ . 1 . 2]" 1
1258 1 67 LEU HA 1 68 HIS HD2 . . 5.500 4.762 3.615 5.412 . 0 0 "[ . 1 . 2]" 1
1259 1 67 LEU HA 1 104 LEU MD1 . . 4.100 3.159 2.822 3.415 . 0 0 "[ . 1 . 2]" 1
1260 1 67 LEU HB2 1 67 LEU QD . . 3.180 2.161 1.944 2.283 . 0 0 "[ . 1 . 2]" 1
1261 1 67 LEU HB2 1 68 HIS H . . 5.260 4.297 3.996 4.447 . 0 0 "[ . 1 . 2]" 1
1262 1 67 LEU HB3 1 68 HIS H . . 4.030 3.345 3.254 3.502 . 0 0 "[ . 1 . 2]" 1
1263 1 67 LEU QD 1 68 HIS H . . 4.080 3.416 2.999 4.048 . 0 0 "[ . 1 . 2]" 1
1264 1 67 LEU QD 1 71 ASP HB3 . . 5.260 3.531 3.143 3.956 . 0 0 "[ . 1 . 2]" 1
1265 1 67 LEU QD 1 102 PHE HB2 . . 4.690 3.423 3.162 3.645 . 0 0 "[ . 1 . 2]" 1
1266 1 67 LEU QD 1 102 PHE HB3 . . 4.690 2.955 2.605 3.308 . 0 0 "[ . 1 . 2]" 1
1267 1 67 LEU QD 1 102 PHE QD . . 4.380 2.700 2.282 3.029 . 0 0 "[ . 1 . 2]" 1
1268 1 67 LEU QD 1 102 PHE QE . . 3.960 3.215 2.649 3.592 . 0 0 "[ . 1 . 2]" 1
1269 1 67 LEU QD 1 104 LEU HB3 . . 4.380 4.299 4.134 4.362 . 0 0 "[ . 1 . 2]" 1
1270 1 67 LEU QD 1 104 LEU MD1 . . 3.240 2.366 1.998 2.598 . 0 0 "[ . 1 . 2]" 1
1271 1 67 LEU QD 1 104 LEU MD2 . . 2.790 1.785 1.647 1.951 . 0 0 "[ . 1 . 2]" 1
1272 1 67 LEU QD 1 104 LEU HG . . 4.690 3.583 3.318 3.872 . 0 0 "[ . 1 . 2]" 1
1273 1 68 HIS H 1 68 HIS HB2 . . 3.590 2.751 2.586 3.836 0.246 15 0 "[ . 1 . 2]" 1
1274 1 68 HIS H 1 68 HIS HB3 . . 3.980 3.679 2.784 3.873 . 0 0 "[ . 1 . 2]" 1
1275 1 68 HIS H 1 68 HIS HD2 . . 5.450 4.167 2.724 4.635 . 0 0 "[ . 1 . 2]" 1
1276 1 68 HIS H 1 69 GLU H . . 5.120 4.385 4.296 4.440 . 0 0 "[ . 1 . 2]" 1
1277 1 68 HIS H 1 71 ASP H . . 4.910 4.113 3.831 4.975 0.065 17 0 "[ . 1 . 2]" 1
1278 1 68 HIS H 1 71 ASP HB2 . . 4.420 2.784 2.510 3.059 . 0 0 "[ . 1 . 2]" 1
1279 1 68 HIS H 1 71 ASP HB3 . . 4.890 3.936 3.709 4.200 . 0 0 "[ . 1 . 2]" 1
1280 1 68 HIS HA 1 69 GLU H . . 3.170 2.306 2.211 2.408 . 0 0 "[ . 1 . 2]" 1
1281 1 68 HIS HA 1 69 GLU HA . . 5.260 4.256 4.240 4.280 . 0 0 "[ . 1 . 2]" 1
1282 1 68 HIS HA 1 69 GLU QB . . 4.920 4.560 4.421 4.684 . 0 0 "[ . 1 . 2]" 1
1283 1 68 HIS HB2 1 69 GLU H . . 4.270 4.056 3.045 4.319 0.049 11 0 "[ . 1 . 2]" 1
1284 1 68 HIS HB3 1 69 GLU H . . 3.840 3.080 2.667 4.216 0.376 15 0 "[ . 1 . 2]" 1
1285 1 68 HIS HB3 1 69 GLU QB . . 5.260 4.552 4.249 6.022 0.762 15 1 "[ . 1 + 2]" 1
1286 1 68 HIS HD2 1 69 GLU H . . 5.500 4.773 3.865 5.492 . 0 0 "[ . 1 . 2]" 1
1287 1 69 GLU H 1 69 GLU QB . . 3.510 2.460 2.406 2.512 . 0 0 "[ . 1 . 2]" 1
1288 1 69 GLU H 1 69 GLU HG2 . . 4.100 3.341 3.128 3.580 . 0 0 "[ . 1 . 2]" 1
1289 1 69 GLU H 1 69 GLU HG3 . . 3.680 2.020 1.939 2.149 . 0 0 "[ . 1 . 2]" 1
1290 1 69 GLU H 1 70 GLY H . . 4.940 4.545 4.471 4.622 . 0 0 "[ . 1 . 2]" 1
1291 1 69 GLU HA 1 69 GLU HG2 . . 3.900 2.572 2.381 2.723 . 0 0 "[ . 1 . 2]" 1
1292 1 69 GLU HA 1 69 GLU HG3 . . 4.100 2.895 2.708 3.055 . 0 0 "[ . 1 . 2]" 1
1293 1 69 GLU HA 1 70 GLY H . . 3.030 2.215 2.203 2.252 . 0 0 "[ . 1 . 2]" 1
1294 1 69 GLU HA 1 71 ASP H . . 4.180 3.338 3.220 3.849 . 0 0 "[ . 1 . 2]" 1
1295 1 69 GLU QB 1 70 GLY H . . 4.040 3.320 3.087 3.497 . 0 0 "[ . 1 . 2]" 1
1296 1 69 GLU HG2 1 70 GLY H . . 4.700 4.454 4.296 4.699 . 0 0 "[ . 1 . 2]" 1
1297 1 69 GLU HG3 1 70 GLY H . . 5.260 5.028 4.844 5.193 . 0 0 "[ . 1 . 2]" 1
1298 1 70 GLY H 1 71 ASP H . . 3.540 2.198 1.987 2.415 . 0 0 "[ . 1 . 2]" 1
1299 1 70 GLY H 1 71 ASP HB2 . . 5.500 4.058 3.786 4.295 . 0 0 "[ . 1 . 2]" 1
1300 1 70 GLY HA2 1 107 SER HB2 . . 4.690 4.355 3.798 4.691 0.001 5 0 "[ . 1 . 2]" 1
1301 1 70 GLY HA2 1 107 SER HB3 . . 4.520 3.843 3.609 4.068 . 0 0 "[ . 1 . 2]" 1
1302 1 70 GLY HA3 1 107 SER HB2 . . 4.270 3.819 3.412 4.051 . 0 0 "[ . 1 . 2]" 1
1303 1 70 GLY HA3 1 107 SER HB3 . . 3.760 2.701 2.537 3.282 . 0 0 "[ . 1 . 2]" 1
1304 1 71 ASP H 1 71 ASP HB2 . . 3.720 2.126 2.005 2.480 . 0 0 "[ . 1 . 2]" 1
1305 1 71 ASP H 1 71 ASP HB3 . . 3.900 3.388 3.202 3.521 . 0 0 "[ . 1 . 2]" 1
1306 1 71 ASP H 1 72 GLU H . . 4.910 4.550 4.214 4.645 . 0 0 "[ . 1 . 2]" 1
1307 1 71 ASP H 1 107 SER H . . 5.000 4.576 4.426 4.866 . 0 0 "[ . 1 . 2]" 1
1308 1 71 ASP H 1 107 SER HB3 . . 4.690 4.752 4.691 5.497 0.807 17 1 "[ . 1 . + 2]" 1
1309 1 71 ASP HA 1 72 GLU H . . 3.100 2.284 2.254 2.349 . 0 0 "[ . 1 . 2]" 1
1310 1 71 ASP HA 1 104 LEU MD1 . . 4.520 4.023 3.766 4.208 . 0 0 "[ . 1 . 2]" 1
1311 1 71 ASP HA 1 107 SER H . . 3.470 2.951 2.863 3.115 . 0 0 "[ . 1 . 2]" 1
1312 1 71 ASP HA 1 107 SER HB2 . . 4.690 3.995 3.323 4.499 . 0 0 "[ . 1 . 2]" 1
1313 1 71 ASP HA 1 107 SER HB3 . . 4.690 4.123 3.807 4.737 0.047 17 0 "[ . 1 . 2]" 1
1314 1 71 ASP HB2 1 72 GLU H . . 4.600 4.422 4.293 4.538 . 0 0 "[ . 1 . 2]" 1
1315 1 71 ASP HB2 1 104 LEU HB2 . . 5.260 4.307 3.771 4.686 . 0 0 "[ . 1 . 2]" 1
1316 1 71 ASP HB2 1 104 LEU MD1 . . 4.270 3.233 2.696 3.690 . 0 0 "[ . 1 . 2]" 1
1317 1 71 ASP HB2 1 104 LEU MD2 . . 4.100 3.917 3.459 4.136 0.036 12 0 "[ . 1 . 2]" 1
1318 1 71 ASP HB2 1 106 PRO HA . . 4.920 4.898 4.716 4.964 0.044 14 0 "[ . 1 . 2]" 1
1319 1 71 ASP HB2 1 107 SER H . . 5.500 5.206 5.078 5.381 . 0 0 "[ . 1 . 2]" 1
1320 1 71 ASP HB3 1 72 GLU H . . 4.120 3.388 3.202 3.601 . 0 0 "[ . 1 . 2]" 1
1321 1 71 ASP HB3 1 104 LEU HB2 . . 4.690 2.607 2.053 3.220 . 0 0 "[ . 1 . 2]" 1
1322 1 71 ASP HB3 1 104 LEU HB3 . . 4.920 3.693 3.115 4.074 . 0 0 "[ . 1 . 2]" 1
1323 1 71 ASP HB3 1 104 LEU MD1 . . 4.030 2.275 1.935 3.071 . 0 0 "[ . 1 . 2]" 1
1324 1 71 ASP HB3 1 104 LEU MD2 . . 3.900 2.906 2.488 3.401 . 0 0 "[ . 1 . 2]" 1
1325 1 72 GLU H 1 72 GLU HB2 . . 3.500 2.922 2.789 3.140 . 0 0 "[ . 1 . 2]" 1
1326 1 72 GLU H 1 72 GLU HB3 . . 3.730 2.386 2.280 2.450 . 0 0 "[ . 1 . 2]" 1
1327 1 72 GLU H 1 72 GLU HG2 . . 5.260 4.275 4.155 4.356 . 0 0 "[ . 1 . 2]" 1
1328 1 72 GLU H 1 72 GLU HG3 . . 5.260 4.529 4.473 4.611 . 0 0 "[ . 1 . 2]" 1
1329 1 72 GLU H 1 73 VAL H . . 5.500 4.469 4.158 4.578 . 0 0 "[ . 1 . 2]" 1
1330 1 72 GLU H 1 104 LEU HA . . 5.290 4.484 4.010 4.816 . 0 0 "[ . 1 . 2]" 1
1331 1 72 GLU H 1 104 LEU HB2 . . 5.260 3.192 2.742 3.555 . 0 0 "[ . 1 . 2]" 1
1332 1 72 GLU H 1 104 LEU HB3 . . 5.270 4.273 3.931 4.593 . 0 0 "[ . 1 . 2]" 1
1333 1 72 GLU H 1 104 LEU MD2 . . 5.250 5.003 4.330 5.258 0.008 18 0 "[ . 1 . 2]" 1
1334 1 72 GLU H 1 105 ILE H . . 3.850 2.688 2.267 3.041 . 0 0 "[ . 1 . 2]" 1
1335 1 72 GLU H 1 105 ILE HB . . 4.520 3.709 3.280 3.925 . 0 0 "[ . 1 . 2]" 1
1336 1 72 GLU H 1 105 ILE MG . . 5.000 4.795 4.479 5.020 0.020 13 0 "[ . 1 . 2]" 1
1337 1 72 GLU H 1 106 PRO HA . . 4.520 4.563 4.529 4.612 0.092 11 0 "[ . 1 . 2]" 1
1338 1 72 GLU H 1 107 SER H . . 4.610 4.585 4.372 4.642 0.032 13 0 "[ . 1 . 2]" 1
1339 1 72 GLU HA 1 72 GLU HG2 . . 4.270 3.339 3.098 3.491 . 0 0 "[ . 1 . 2]" 1
1340 1 72 GLU HA 1 72 GLU HG3 . . 3.960 2.562 2.471 2.659 . 0 0 "[ . 1 . 2]" 1
1341 1 72 GLU HA 1 73 VAL H . . 3.330 2.233 2.203 2.270 . 0 0 "[ . 1 . 2]" 1
1342 1 72 GLU HA 1 73 VAL HA . . 5.260 4.379 4.364 4.438 . 0 0 "[ . 1 . 2]" 1
1343 1 72 GLU HA 1 73 VAL HB . . 4.920 4.741 4.643 4.987 0.067 14 0 "[ . 1 . 2]" 1
1344 1 72 GLU HA 1 73 VAL QG . . 4.100 3.351 3.134 3.535 . 0 0 "[ . 1 . 2]" 1
1345 1 72 GLU HB2 1 73 VAL H . . 4.690 4.229 4.079 4.522 . 0 0 "[ . 1 . 2]" 1
1346 1 72 GLU HB3 1 105 ILE H . . 4.430 3.111 2.971 3.305 . 0 0 "[ . 1 . 2]" 1
1347 1 72 GLU HB3 1 105 ILE MD . . 4.520 3.347 2.961 4.205 . 0 0 "[ . 1 . 2]" 1
1348 1 72 GLU HG2 1 73 VAL H . . 4.520 3.351 2.684 3.945 . 0 0 "[ . 1 . 2]" 1
1349 1 72 GLU HG2 1 74 LEU QD . . 3.480 1.989 1.770 2.307 . 0 0 "[ . 1 . 2]" 1
1350 1 72 GLU HG2 1 104 LEU HA . . 4.690 4.592 4.375 4.742 0.052 18 0 "[ . 1 . 2]" 1
1351 1 72 GLU HG3 1 73 VAL H . . 4.270 2.837 2.497 3.669 . 0 0 "[ . 1 . 2]" 1
1352 1 72 GLU HG3 1 74 LEU QD . . 4.520 3.111 2.564 3.577 . 0 0 "[ . 1 . 2]" 1
1353 1 73 VAL H 1 73 VAL HB . . 3.620 2.598 2.460 3.303 . 0 0 "[ . 1 . 2]" 1
1354 1 73 VAL H 1 73 VAL QG . . 3.480 2.173 1.780 2.386 . 0 0 "[ . 1 . 2]" 1
1355 1 73 VAL HA 1 73 VAL QG . . 3.160 2.187 2.078 2.537 . 0 0 "[ . 1 . 2]" 1
1356 1 73 VAL HA 1 74 LEU H . . 3.210 2.237 2.182 2.276 . 0 0 "[ . 1 . 2]" 1
1357 1 73 VAL HA 1 74 LEU HA . . 4.920 4.387 4.372 4.400 . 0 0 "[ . 1 . 2]" 1
1358 1 73 VAL HA 1 74 LEU HB2 . . 5.260 4.795 4.610 5.071 . 0 0 "[ . 1 . 2]" 1
1359 1 73 VAL HA 1 74 LEU QD . . 4.920 3.799 2.157 4.072 . 0 0 "[ . 1 . 2]" 1
1360 1 73 VAL HA 1 74 LEU HG . . 4.920 3.469 3.140 5.040 0.120 18 0 "[ . 1 . 2]" 1
1361 1 73 VAL HA 1 75 GLU H . . 4.220 4.062 3.632 4.224 0.004 1 0 "[ . 1 . 2]" 1
1362 1 73 VAL HA 1 104 LEU HA . . 3.720 2.856 2.012 3.326 . 0 0 "[ . 1 . 2]" 1
1363 1 73 VAL HA 1 104 LEU HB2 . . 4.270 3.494 3.395 3.577 . 0 0 "[ . 1 . 2]" 1
1364 1 73 VAL HA 1 104 LEU HB3 . . 4.690 1.949 1.841 1.988 . 0 0 "[ . 1 . 2]" 1
1365 1 73 VAL HA 1 104 LEU MD2 . . 3.530 2.949 2.677 3.091 . 0 0 "[ . 1 . 2]" 1
1366 1 73 VAL HA 1 105 ILE H . . 4.840 4.438 3.945 4.754 . 0 0 "[ . 1 . 2]" 1
1367 1 73 VAL HB 1 74 LEU H . . 5.010 4.042 3.777 4.262 . 0 0 "[ . 1 . 2]" 1
1368 1 73 VAL HB 1 81 ILE MD . . 3.810 3.835 3.517 4.037 0.227 12 0 "[ . 1 . 2]" 1
1369 1 73 VAL QG 1 74 LEU H . . 3.850 2.402 2.062 2.990 . 0 0 "[ . 1 . 2]" 1
1370 1 73 VAL QG 1 75 GLU H . . 3.600 3.151 2.692 3.583 . 0 0 "[ . 1 . 2]" 1
1371 1 73 VAL QG 1 75 GLU HA . . 5.260 3.976 3.744 4.141 . 0 0 "[ . 1 . 2]" 1
1372 1 73 VAL QG 1 76 ILE HA . . 4.690 4.278 3.752 4.493 . 0 0 "[ . 1 . 2]" 1
1373 1 73 VAL QG 1 76 ILE MD . . 3.300 1.855 1.742 1.948 . 0 0 "[ . 1 . 2]" 1
1374 1 73 VAL QG 1 76 ILE HG13 . . 3.620 2.184 1.827 2.299 . 0 0 "[ . 1 . 2]" 1
1375 1 73 VAL QG 1 81 ILE HB . . 3.960 2.453 2.036 3.076 . 0 0 "[ . 1 . 2]" 1
1376 1 73 VAL QG 1 81 ILE MD . . 3.350 2.233 1.755 2.631 . 0 0 "[ . 1 . 2]" 1
1377 1 73 VAL QG 1 82 ARG H . . 5.080 4.568 4.265 4.949 . 0 0 "[ . 1 . 2]" 1
1378 1 73 VAL QG 1 102 PHE HA . . 4.690 4.061 3.390 4.333 . 0 0 "[ . 1 . 2]" 1
1379 1 73 VAL QG 1 102 PHE HB3 . . 4.920 3.941 3.571 4.553 . 0 0 "[ . 1 . 2]" 1
1380 1 73 VAL QG 1 102 PHE QD . . 3.530 3.162 2.838 3.333 . 0 0 "[ . 1 . 2]" 1
1381 1 73 VAL QG 1 103 VAL H . . 4.690 3.657 2.691 4.060 . 0 0 "[ . 1 . 2]" 1
1382 1 73 VAL QG 1 104 LEU HA . . 4.920 3.991 3.582 4.303 . 0 0 "[ . 1 . 2]" 1
1383 1 74 LEU H 1 74 LEU HB2 . . 3.740 2.823 2.670 3.079 . 0 0 "[ . 1 . 2]" 1
1384 1 74 LEU H 1 74 LEU QD . . 4.380 3.212 1.823 3.446 . 0 0 "[ . 1 . 2]" 1
1385 1 74 LEU H 1 74 LEU HG . . 3.990 2.693 2.186 3.986 . 0 0 "[ . 1 . 2]" 1
1386 1 74 LEU H 1 75 GLU H . . 3.370 2.003 1.853 2.323 . 0 0 "[ . 1 . 2]" 1
1387 1 74 LEU H 1 103 VAL H . . 5.120 4.220 4.050 4.398 . 0 0 "[ . 1 . 2]" 1
1388 1 74 LEU H 1 103 VAL HB . . 4.750 3.782 3.287 4.098 . 0 0 "[ . 1 . 2]" 1
1389 1 74 LEU H 1 103 VAL MG1 . . 4.830 4.291 3.342 4.813 . 0 0 "[ . 1 . 2]" 1
1390 1 74 LEU H 1 104 LEU H . . 5.500 5.144 4.829 5.312 . 0 0 "[ . 1 . 2]" 1
1391 1 74 LEU H 1 104 LEU HA . . 3.810 3.376 2.999 3.564 . 0 0 "[ . 1 . 2]" 1
1392 1 74 LEU H 1 104 LEU HB2 . . 5.260 5.182 4.834 5.385 0.125 12 0 "[ . 1 . 2]" 1
1393 1 74 LEU H 1 104 LEU HB3 . . 4.920 3.677 3.397 4.018 . 0 0 "[ . 1 . 2]" 1
1394 1 74 LEU H 1 104 LEU MD2 . . 4.270 4.304 4.270 4.417 0.147 11 0 "[ . 1 . 2]" 1
1395 1 74 LEU HA 1 74 LEU QD . . 3.070 2.393 2.108 2.820 . 0 0 "[ . 1 . 2]" 1
1396 1 74 LEU HA 1 74 LEU HG . . 3.960 3.201 2.922 3.959 . 0 0 "[ . 1 . 2]" 1
1397 1 74 LEU HA 1 81 ILE H . . 5.500 3.419 3.126 3.722 . 0 0 "[ . 1 . 2]" 1
1398 1 74 LEU HA 1 82 ARG H . . 4.690 2.526 2.088 2.940 . 0 0 "[ . 1 . 2]" 1
1399 1 74 LEU HA 1 82 ARG HB2 . . 4.100 3.045 2.274 3.659 . 0 0 "[ . 1 . 2]" 1
1400 1 74 LEU HA 1 82 ARG HB3 . . 4.920 4.484 3.581 4.978 0.058 15 0 "[ . 1 . 2]" 1
1401 1 74 LEU HB2 1 74 LEU QD . . 3.130 2.123 1.936 2.317 . 0 0 "[ . 1 . 2]" 1
1402 1 74 LEU HB2 1 75 GLU H . . 3.680 2.584 2.369 3.041 . 0 0 "[ . 1 . 2]" 1
1403 1 74 LEU HB2 1 103 VAL HB . . 4.100 3.699 3.377 4.137 0.037 14 0 "[ . 1 . 2]" 1
1404 1 74 LEU HB2 1 103 VAL MG1 . . 3.590 3.363 2.511 3.616 0.026 18 0 "[ . 1 . 2]" 1
1405 1 74 LEU QD 1 75 GLU H . . 4.580 3.767 2.471 4.125 . 0 0 "[ . 1 . 2]" 1
1406 1 74 LEU QD 1 82 ARG H . . 5.460 3.973 3.461 4.464 . 0 0 "[ . 1 . 2]" 1
1407 1 74 LEU QD 1 82 ARG HA . . 5.260 3.999 3.595 4.552 . 0 0 "[ . 1 . 2]" 1
1408 1 74 LEU QD 1 82 ARG QD . . 3.680 2.409 1.784 3.410 . 0 0 "[ . 1 . 2]" 1
1409 1 74 LEU QD 1 82 ARG HE . . 4.520 3.001 2.025 3.883 . 0 0 "[ . 1 . 2]" 1
1410 1 74 LEU QD 1 82 ARG HG3 . . 4.920 3.638 1.982 4.496 . 0 0 "[ . 1 . 2]" 1
1411 1 74 LEU QD 1 82 ARG HH11 . . 4.270 2.979 1.891 4.455 0.185 11 0 "[ . 1 . 2]" 1
1412 1 74 LEU QD 1 104 LEU HA . . 4.690 3.099 1.821 3.862 . 0 0 "[ . 1 . 2]" 1
1413 1 74 LEU QD 1 105 ILE H . . 4.690 3.614 2.878 4.164 . 0 0 "[ . 1 . 2]" 1
1414 1 74 LEU QD 1 105 ILE MD . . 3.100 1.969 1.741 2.334 . 0 0 "[ . 1 . 2]" 1
1415 1 74 LEU QD 1 105 ILE HG13 . . 3.760 2.610 1.952 3.320 . 0 0 "[ . 1 . 2]" 1
1416 1 74 LEU HG 1 75 GLU H . . 4.590 3.996 3.592 4.622 0.032 18 0 "[ . 1 . 2]" 1
1417 1 74 LEU HG 1 104 LEU HA . . 4.270 3.120 2.810 4.403 0.133 18 0 "[ . 1 . 2]" 1
1418 1 75 GLU H 1 75 GLU HB2 . . 3.430 2.706 2.623 2.829 . 0 0 "[ . 1 . 2]" 1
1419 1 75 GLU H 1 75 GLU HB3 . . 4.110 3.387 3.210 3.491 . 0 0 "[ . 1 . 2]" 1
1420 1 75 GLU H 1 75 GLU HG3 . . 4.360 4.236 4.027 4.385 0.025 15 0 "[ . 1 . 2]" 1
1421 1 75 GLU H 1 76 ILE H . . 5.110 4.380 4.301 4.425 . 0 0 "[ . 1 . 2]" 1
1422 1 75 GLU H 1 76 ILE HG13 . . 5.460 3.926 3.697 4.213 . 0 0 "[ . 1 . 2]" 1
1423 1 75 GLU H 1 80 GLU HA . . 5.260 4.986 4.588 5.359 0.099 19 0 "[ . 1 . 2]" 1
1424 1 75 GLU H 1 103 VAL H . . 3.780 3.425 3.170 3.711 . 0 0 "[ . 1 . 2]" 1
1425 1 75 GLU H 1 103 VAL HB . . 3.850 2.380 2.087 2.594 . 0 0 "[ . 1 . 2]" 1
1426 1 75 GLU H 1 103 VAL MG1 . . 4.270 3.549 2.913 3.912 . 0 0 "[ . 1 . 2]" 1
1427 1 75 GLU H 1 103 VAL MG2 . . 4.380 3.784 3.641 3.902 . 0 0 "[ . 1 . 2]" 1
1428 1 75 GLU H 1 104 LEU HA . . 4.690 4.619 4.425 4.722 0.032 14 0 "[ . 1 . 2]" 1
1429 1 75 GLU HA 1 75 GLU HG3 . . 3.810 2.331 2.191 2.499 . 0 0 "[ . 1 . 2]" 1
1430 1 75 GLU HA 1 76 ILE H . . 3.160 2.319 2.261 2.379 . 0 0 "[ . 1 . 2]" 1
1431 1 75 GLU HA 1 79 ILE H . . 5.270 4.957 4.775 5.121 . 0 0 "[ . 1 . 2]" 1
1432 1 75 GLU HA 1 80 GLU HA . . 3.590 2.475 2.136 2.927 . 0 0 "[ . 1 . 2]" 1
1433 1 75 GLU HA 1 81 ILE H . . 4.050 3.229 2.500 3.567 . 0 0 "[ . 1 . 2]" 1
1434 1 75 GLU HA 1 81 ILE HA . . 5.260 5.004 4.729 5.192 . 0 0 "[ . 1 . 2]" 1
1435 1 75 GLU HA 1 81 ILE HB . . 4.920 3.743 2.794 4.250 . 0 0 "[ . 1 . 2]" 1
1436 1 75 GLU HA 1 81 ILE MD . . 4.520 4.403 4.211 4.568 0.048 19 0 "[ . 1 . 2]" 1
1437 1 75 GLU HA 1 81 ILE HG12 . . 3.720 3.072 2.648 4.180 0.460 15 0 "[ . 1 . 2]" 1
1438 1 75 GLU HA 1 81 ILE HG13 . . 4.180 3.250 2.786 3.650 . 0 0 "[ . 1 . 2]" 1
1439 1 75 GLU HA 1 103 VAL MG2 . . 4.690 4.636 4.401 4.712 0.022 19 0 "[ . 1 . 2]" 1
1440 1 75 GLU HB2 1 76 ILE H . . 4.360 4.341 4.241 4.451 0.091 19 0 "[ . 1 . 2]" 1
1441 1 75 GLU HB2 1 80 GLU HA . . 4.380 4.229 3.884 4.394 0.014 16 0 "[ . 1 . 2]" 1
1442 1 75 GLU HB2 1 103 VAL MG1 . . 4.920 3.362 2.691 3.881 . 0 0 "[ . 1 . 2]" 1
1443 1 75 GLU HB2 1 103 VAL MG2 . . 4.030 3.408 3.165 3.657 . 0 0 "[ . 1 . 2]" 1
1444 1 75 GLU HB3 1 76 ILE H . . 4.210 3.302 3.091 3.512 . 0 0 "[ . 1 . 2]" 1
1445 1 75 GLU HB3 1 78 GLY H . . 4.900 3.332 3.102 3.932 . 0 0 "[ . 1 . 2]" 1
1446 1 75 GLU HB3 1 79 ILE H . . 5.130 5.010 4.796 5.143 0.013 3 0 "[ . 1 . 2]" 1
1447 1 75 GLU HB3 1 80 GLU HA . . 5.260 4.562 4.441 4.792 . 0 0 "[ . 1 . 2]" 1
1448 1 75 GLU HB3 1 103 VAL H . . 4.650 4.312 3.809 4.645 . 0 0 "[ . 1 . 2]" 1
1449 1 75 GLU HB3 1 103 VAL MG1 . . 4.180 3.888 3.279 4.189 0.009 1 0 "[ . 1 . 2]" 1
1450 1 75 GLU HB3 1 103 VAL MG2 . . 3.560 2.580 2.220 2.801 . 0 0 "[ . 1 . 2]" 1
1451 1 75 GLU HG2 1 78 GLY H . . 4.130 3.450 2.882 3.751 . 0 0 "[ . 1 . 2]" 1
1452 1 75 GLU HG2 1 78 GLY HA2 . . 4.920 3.270 2.759 3.548 . 0 0 "[ . 1 . 2]" 1
1453 1 75 GLU HG2 1 78 GLY HA3 . . 4.920 4.425 3.986 4.612 . 0 0 "[ . 1 . 2]" 1
1454 1 75 GLU HG3 1 76 ILE H . . 3.960 3.919 3.511 3.994 0.034 14 0 "[ . 1 . 2]" 1
1455 1 75 GLU HG3 1 80 GLU HA . . 3.620 1.996 1.960 2.026 . 0 0 "[ . 1 . 2]" 1
1456 1 75 GLU HG3 1 80 GLU HG2 . . 4.380 3.463 2.368 5.114 0.734 18 2 "[ . - 1 . + 2]" 1
1457 1 75 GLU HG3 1 81 ILE H . . 4.950 3.763 3.424 4.238 . 0 0 "[ . 1 . 2]" 1
1458 1 76 ILE H 1 76 ILE HB . . 3.910 2.658 2.482 2.735 . 0 0 "[ . 1 . 2]" 1
1459 1 76 ILE H 1 76 ILE MD . . 4.380 4.375 4.277 4.483 0.103 14 0 "[ . 1 . 2]" 1
1460 1 76 ILE H 1 76 ILE HG12 . . 4.270 4.200 3.966 4.393 0.123 7 0 "[ . 1 . 2]" 1
1461 1 76 ILE H 1 76 ILE HG13 . . 5.260 3.331 3.124 3.513 . 0 0 "[ . 1 . 2]" 1
1462 1 76 ILE H 1 76 ILE MG . . 4.100 3.769 3.676 3.814 . 0 0 "[ . 1 . 2]" 1
1463 1 76 ILE H 1 77 ASN H . . 4.960 3.978 3.881 4.074 . 0 0 "[ . 1 . 2]" 1
1464 1 76 ILE H 1 78 GLY H . . 5.040 3.000 2.798 3.260 . 0 0 "[ . 1 . 2]" 1
1465 1 76 ILE H 1 79 ILE HA . . 5.330 4.465 4.287 4.973 . 0 0 "[ . 1 . 2]" 1
1466 1 76 ILE H 1 79 ILE HB . . 4.300 3.440 3.212 3.887 . 0 0 "[ . 1 . 2]" 1
1467 1 76 ILE H 1 79 ILE MD . . 4.270 4.185 3.982 4.275 0.005 18 0 "[ . 1 . 2]" 1
1468 1 76 ILE H 1 80 GLU HA . . 4.690 3.927 3.667 4.345 . 0 0 "[ . 1 . 2]" 1
1469 1 76 ILE H 1 81 ILE MD . . 4.100 4.058 3.727 4.150 0.050 19 0 "[ . 1 . 2]" 1
1470 1 76 ILE H 1 81 ILE HG12 . . 4.200 3.388 3.015 4.092 . 0 0 "[ . 1 . 2]" 1
1471 1 76 ILE HA 1 76 ILE MD . . 4.270 3.735 3.609 3.786 . 0 0 "[ . 1 . 2]" 1
1472 1 76 ILE HA 1 76 ILE HG12 . . 4.100 2.365 2.266 2.458 . 0 0 "[ . 1 . 2]" 1
1473 1 76 ILE HA 1 76 ILE HG13 . . 3.270 2.950 2.773 3.168 . 0 0 "[ . 1 . 2]" 1
1474 1 76 ILE HA 1 76 ILE MG . . 3.320 2.515 2.417 2.590 . 0 0 "[ . 1 . 2]" 1
1475 1 76 ILE HA 1 77 ASN H . . 3.240 2.195 2.178 2.209 . 0 0 "[ . 1 . 2]" 1
1476 1 76 ILE HA 1 77 ASN HA . . 4.270 4.290 4.279 4.295 0.025 5 0 "[ . 1 . 2]" 1
1477 1 76 ILE HA 1 78 GLY H . . 4.990 3.520 3.428 3.895 . 0 0 "[ . 1 . 2]" 1
1478 1 76 ILE HA 1 79 ILE H . . 5.500 4.820 4.645 5.284 . 0 0 "[ . 1 . 2]" 1
1479 1 76 ILE HA 1 102 PHE H . . 5.370 4.924 4.657 5.070 . 0 0 "[ . 1 . 2]" 1
1480 1 76 ILE HA 1 102 PHE HA . . 3.590 2.642 2.363 2.828 . 0 0 "[ . 1 . 2]" 1
1481 1 76 ILE HA 1 103 VAL H . . 4.520 3.030 2.864 3.273 . 0 0 "[ . 1 . 2]" 1
1482 1 76 ILE HB 1 76 ILE MD . . 3.240 2.400 2.280 2.515 . 0 0 "[ . 1 . 2]" 1
1483 1 76 ILE HB 1 77 ASN H . . 5.480 4.564 4.498 4.624 . 0 0 "[ . 1 . 2]" 1
1484 1 76 ILE HB 1 79 ILE H . . 5.410 4.488 4.234 4.829 . 0 0 "[ . 1 . 2]" 1
1485 1 76 ILE HB 1 79 ILE HB . . 4.920 3.624 3.224 4.345 . 0 0 "[ . 1 . 2]" 1
1486 1 76 ILE HB 1 81 ILE MD . . 3.900 2.580 2.181 2.885 . 0 0 "[ . 1 . 2]" 1
1487 1 76 ILE HB 1 81 ILE HG12 . . 5.500 3.357 2.969 3.826 . 0 0 "[ . 1 . 2]" 1
1488 1 76 ILE HB 1 96 MET ME . . 3.430 3.418 3.237 3.461 0.031 11 0 "[ . 1 . 2]" 1
1489 1 76 ILE MD 1 76 ILE MG . . 2.730 1.890 1.834 1.937 . 0 0 "[ . 1 . 2]" 1
1490 1 76 ILE MD 1 81 ILE HG12 . . 4.180 3.727 3.291 4.009 . 0 0 "[ . 1 . 2]" 1
1491 1 76 ILE MD 1 93 LEU HA . . 5.260 4.981 4.705 5.246 . 0 0 "[ . 1 . 2]" 1
1492 1 76 ILE MD 1 93 LEU QD . . 2.940 2.048 1.861 2.372 . 0 0 "[ . 1 . 2]" 1
1493 1 76 ILE MD 1 93 LEU HG . . 3.900 3.326 2.934 3.672 . 0 0 "[ . 1 . 2]" 1
1494 1 76 ILE MD 1 96 MET ME . . 3.650 3.609 3.406 3.690 0.040 18 0 "[ . 1 . 2]" 1
1495 1 76 ILE MD 1 102 PHE HA . . 5.260 3.778 3.330 4.457 . 0 0 "[ . 1 . 2]" 1
1496 1 76 ILE MD 1 102 PHE QD . . 4.270 2.443 2.049 3.040 . 0 0 "[ . 1 . 2]" 1
1497 1 76 ILE MD 1 102 PHE QE . . 3.650 2.526 2.032 2.985 . 0 0 "[ . 1 . 2]" 1
1498 1 76 ILE MD 1 102 PHE HZ . . 4.920 4.078 3.178 4.574 . 0 0 "[ . 1 . 2]" 1
1499 1 76 ILE HG12 1 76 ILE MG . . 3.430 2.497 2.409 2.622 . 0 0 "[ . 1 . 2]" 1
1500 1 76 ILE HG12 1 102 PHE HA . . 4.920 2.324 2.057 3.064 . 0 0 "[ . 1 . 2]" 1
1501 1 76 ILE HG12 1 102 PHE QD . . 4.520 2.997 2.674 3.361 . 0 0 "[ . 1 . 2]" 1
1502 1 76 ILE HG13 1 102 PHE HA . . 4.030 3.827 3.407 4.485 0.455 15 0 "[ . 1 . 2]" 1
1503 1 76 ILE HG13 1 102 PHE QD . . 4.180 4.243 3.730 4.531 0.351 18 0 "[ . 1 . 2]" 1
1504 1 76 ILE HG13 1 102 PHE QE . . 5.260 5.245 4.752 5.775 0.515 18 1 "[ . 1 . + 2]" 1
1505 1 76 ILE HG13 1 103 VAL H . . 5.000 3.702 3.274 4.381 . 0 0 "[ . 1 . 2]" 1
1506 1 76 ILE MG 1 77 ASN H . . 3.720 3.072 2.856 3.208 . 0 0 "[ . 1 . 2]" 1
1507 1 76 ILE MG 1 77 ASN HA . . 4.690 4.080 3.987 4.160 . 0 0 "[ . 1 . 2]" 1
1508 1 76 ILE MG 1 77 ASN HB2 . . 4.520 2.557 2.393 2.877 . 0 0 "[ . 1 . 2]" 1
1509 1 76 ILE MG 1 77 ASN HB3 . . 4.030 3.988 3.796 4.214 0.184 3 0 "[ . 1 . 2]" 1
1510 1 76 ILE MG 1 77 ASN HD21 . . 4.920 3.777 3.434 4.523 . 0 0 "[ . 1 . 2]" 1
1511 1 76 ILE MG 1 77 ASN HD22 . . 4.920 4.785 4.278 4.958 0.038 19 0 "[ . 1 . 2]" 1
1512 1 76 ILE MG 1 78 GLY H . . 5.500 4.390 4.169 4.607 . 0 0 "[ . 1 . 2]" 1
1513 1 76 ILE MG 1 79 ILE H . . 5.490 4.457 4.161 4.768 . 0 0 "[ . 1 . 2]" 1
1514 1 76 ILE MG 1 79 ILE HB . . 4.920 4.010 3.533 4.668 . 0 0 "[ . 1 . 2]" 1
1515 1 76 ILE MG 1 81 ILE MD . . 4.180 3.472 3.019 3.715 . 0 0 "[ . 1 . 2]" 1
1516 1 76 ILE MG 1 92 LEU HB3 . . 4.920 4.278 3.870 4.517 . 0 0 "[ . 1 . 2]" 1
1517 1 76 ILE MG 1 92 LEU QD . . 4.270 4.068 3.780 4.194 . 0 0 "[ . 1 . 2]" 1
1518 1 76 ILE MG 1 93 LEU HA . . 5.260 4.119 3.944 4.387 . 0 0 "[ . 1 . 2]" 1
1519 1 76 ILE MG 1 93 LEU HB3 . . 5.180 4.995 4.687 5.220 0.040 3 0 "[ . 1 . 2]" 1
1520 1 76 ILE MG 1 93 LEU QD . . 3.220 1.969 1.681 2.233 . 0 0 "[ . 1 . 2]" 1
1521 1 76 ILE MG 1 93 LEU HG . . 4.380 3.891 3.241 4.351 . 0 0 "[ . 1 . 2]" 1
1522 1 76 ILE MG 1 96 MET ME . . 3.040 1.797 1.715 1.865 . 0 0 "[ . 1 . 2]" 1
1523 1 76 ILE MG 1 100 LEU HB2 . . 4.920 3.471 3.304 3.639 . 0 0 "[ . 1 . 2]" 1
1524 1 76 ILE MG 1 100 LEU HB3 . . 4.520 2.856 2.727 2.989 . 0 0 "[ . 1 . 2]" 1
1525 1 76 ILE MG 1 100 LEU QD . . 3.390 3.020 2.755 3.212 . 0 0 "[ . 1 . 2]" 1
1526 1 76 ILE MG 1 100 LEU HG . . 5.260 5.094 4.949 5.216 . 0 0 "[ . 1 . 2]" 1
1527 1 76 ILE MG 1 101 THR H . . 4.520 3.909 3.634 4.398 . 0 0 "[ . 1 . 2]" 1
1528 1 76 ILE MG 1 102 PHE HA . . 4.520 3.418 3.078 3.733 . 0 0 "[ . 1 . 2]" 1
1529 1 76 ILE MG 1 102 PHE QD . . 4.520 3.582 3.244 3.862 . 0 0 "[ . 1 . 2]" 1
1530 1 76 ILE MG 1 102 PHE QE . . 4.100 3.354 3.004 3.585 . 0 0 "[ . 1 . 2]" 1
1531 1 76 ILE MG 1 102 PHE HZ . . 4.690 3.877 3.654 4.220 . 0 0 "[ . 1 . 2]" 1
1532 1 77 ASN H 1 78 GLY H . . 3.980 2.624 2.493 3.118 . 0 0 "[ . 1 . 2]" 1
1533 1 77 ASN H 1 79 ILE H . . 5.390 4.427 4.234 4.869 . 0 0 "[ . 1 . 2]" 1
1534 1 77 ASN H 1 96 MET ME . . 5.260 4.572 4.375 4.851 . 0 0 "[ . 1 . 2]" 1
1535 1 77 ASN H 1 101 THR H . . 4.130 3.192 2.712 3.456 . 0 0 "[ . 1 . 2]" 1
1536 1 77 ASN H 1 101 THR HB . . 4.180 2.836 2.569 3.258 . 0 0 "[ . 1 . 2]" 1
1537 1 77 ASN H 1 101 THR MG . . 4.920 3.567 2.688 4.093 . 0 0 "[ . 1 . 2]" 1
1538 1 77 ASN H 1 102 PHE HA . . 4.690 3.828 3.238 4.150 . 0 0 "[ . 1 . 2]" 1
1539 1 77 ASN H 1 103 VAL H . . 5.500 4.379 4.034 4.691 . 0 0 "[ . 1 . 2]" 1
1540 1 77 ASN HA 1 77 ASN HD22 . . 5.500 4.347 4.036 4.461 . 0 0 "[ . 1 . 2]" 1
1541 1 77 ASN HA 1 78 GLY H . . 3.620 3.236 3.090 3.597 . 0 0 "[ . 1 . 2]" 1
1542 1 77 ASN HA 1 78 GLY HA3 . . 5.260 4.566 4.497 4.785 . 0 0 "[ . 1 . 2]" 1
1543 1 77 ASN HA 1 79 ILE H . . 5.040 4.613 4.420 5.068 0.028 19 0 "[ . 1 . 2]" 1
1544 1 77 ASN HA 1 101 THR H . . 4.530 2.655 1.955 3.116 . 0 0 "[ . 1 . 2]" 1
1545 1 77 ASN HA 1 101 THR HB . . 3.960 2.391 2.016 2.832 . 0 0 "[ . 1 . 2]" 1
1546 1 77 ASN HA 1 101 THR MG . . 4.920 3.897 3.054 4.452 . 0 0 "[ . 1 . 2]" 1
1547 1 77 ASN HB2 1 77 ASN HD22 . . 3.810 3.540 3.446 3.782 . 0 0 "[ . 1 . 2]" 1
1548 1 77 ASN HB2 1 78 GLY H . . 5.030 4.016 3.523 4.233 . 0 0 "[ . 1 . 2]" 1
1549 1 77 ASN HB2 1 79 ILE MD . . 4.920 2.866 2.215 3.240 . 0 0 "[ . 1 . 2]" 1
1550 1 77 ASN HB2 1 96 MET ME . . 3.680 2.165 1.976 2.449 . 0 0 "[ . 1 . 2]" 1
1551 1 77 ASN HB3 1 77 ASN HD22 . . 3.900 3.771 3.507 4.001 0.101 19 0 "[ . 1 . 2]" 1
1552 1 77 ASN HB3 1 78 GLY H . . 5.500 3.902 2.768 4.394 . 0 0 "[ . 1 . 2]" 1
1553 1 77 ASN HB3 1 79 ILE H . . 5.260 3.403 3.022 3.948 . 0 0 "[ . 1 . 2]" 1
1554 1 77 ASN HB3 1 79 ILE MD . . 4.920 2.333 2.053 2.772 . 0 0 "[ . 1 . 2]" 1
1555 1 77 ASN HB3 1 96 MET ME . . 3.330 3.363 3.044 3.646 0.316 14 0 "[ . 1 . 2]" 1
1556 1 77 ASN HD21 1 96 MET ME . . 4.180 2.426 1.973 3.111 . 0 0 "[ . 1 . 2]" 1
1557 1 77 ASN HD21 1 100 LEU HA . . 4.840 3.373 2.424 4.220 . 0 0 "[ . 1 . 2]" 1
1558 1 77 ASN HD21 1 100 LEU QD . . 3.620 2.489 1.839 3.597 . 0 0 "[ . 1 . 2]" 1
1559 1 77 ASN HD21 1 100 LEU HG . . 5.260 4.068 3.235 5.153 . 0 0 "[ . 1 . 2]" 1
1560 1 77 ASN HD21 1 101 THR H . . 4.590 4.130 3.165 4.838 0.248 17 0 "[ . 1 . 2]" 1
1561 1 77 ASN HD22 1 96 MET ME . . 3.620 3.721 3.067 4.126 0.506 11 1 "[ . 1+ . 2]" 1
1562 1 77 ASN HD22 1 100 LEU HA . . 4.730 2.561 2.058 3.087 . 0 0 "[ . 1 . 2]" 1
1563 1 77 ASN HD22 1 100 LEU QD . . 3.960 2.806 2.191 3.342 . 0 0 "[ . 1 . 2]" 1
1564 1 77 ASN HD22 1 101 THR H . . 5.190 3.835 3.327 4.486 . 0 0 "[ . 1 . 2]" 1
1565 1 78 GLY H 1 79 ILE H . . 3.670 2.532 1.880 2.799 . 0 0 "[ . 1 . 2]" 1
1566 1 78 GLY H 1 79 ILE MD . . 5.430 3.840 3.023 4.055 . 0 0 "[ . 1 . 2]" 1
1567 1 78 GLY H 1 101 THR HB . . 5.260 4.610 3.699 5.280 0.020 19 0 "[ . 1 . 2]" 1
1568 1 78 GLY HA2 1 79 ILE MD . . 4.920 4.846 4.523 4.997 0.077 5 0 "[ . 1 . 2]" 1
1569 1 78 GLY HA3 1 79 ILE MD . . 5.260 3.896 3.444 4.123 . 0 0 "[ . 1 . 2]" 1
1570 1 79 ILE H 1 79 ILE HB . . 3.320 2.363 2.292 2.520 . 0 0 "[ . 1 . 2]" 1
1571 1 79 ILE H 1 79 ILE MD . . 3.840 2.014 1.926 2.104 . 0 0 "[ . 1 . 2]" 1
1572 1 79 ILE H 1 79 ILE HG12 . . 3.660 3.874 3.701 3.936 0.276 12 0 "[ . 1 . 2]" 1
1573 1 79 ILE H 1 79 ILE HG13 . . 3.900 2.829 2.615 3.178 . 0 0 "[ . 1 . 2]" 1
1574 1 79 ILE H 1 79 ILE MG . . 3.680 3.702 3.677 3.733 0.053 19 0 "[ . 1 . 2]" 1
1575 1 79 ILE H 1 80 GLU H . . 4.710 4.606 4.559 4.642 . 0 0 "[ . 1 . 2]" 1
1576 1 79 ILE H 1 96 MET ME . . 4.800 4.616 4.329 4.804 0.004 16 0 "[ . 1 . 2]" 1
1577 1 79 ILE HA 1 79 ILE MD . . 3.650 3.532 3.265 3.614 . 0 0 "[ . 1 . 2]" 1
1578 1 79 ILE HA 1 79 ILE HG12 . . 3.900 3.340 3.250 3.480 . 0 0 "[ . 1 . 2]" 1
1579 1 79 ILE HA 1 79 ILE HG13 . . 3.810 2.322 2.236 2.475 . 0 0 "[ . 1 . 2]" 1
1580 1 79 ILE HA 1 79 ILE MG . . 3.070 2.468 2.246 2.532 . 0 0 "[ . 1 . 2]" 1
1581 1 79 ILE HA 1 80 GLU H . . 2.990 2.233 2.191 2.332 . 0 0 "[ . 1 . 2]" 1
1582 1 79 ILE HA 1 80 GLU HB2 . . 4.690 4.256 4.145 4.727 0.037 7 0 "[ . 1 . 2]" 1
1583 1 79 ILE HB 1 79 ILE MD . . 3.250 2.040 1.954 2.139 . 0 0 "[ . 1 . 2]" 1
1584 1 79 ILE HB 1 80 GLU H . . 4.920 4.193 3.850 4.340 . 0 0 "[ . 1 . 2]" 1
1585 1 79 ILE MD 1 96 MET ME . . 3.270 2.924 2.477 3.232 . 0 0 "[ . 1 . 2]" 1
1586 1 79 ILE HG12 1 80 GLU H . . 5.210 4.891 4.770 5.014 . 0 0 "[ . 1 . 2]" 1
1587 1 79 ILE HG13 1 79 ILE MG . . 3.250 2.861 2.695 2.945 . 0 0 "[ . 1 . 2]" 1
1588 1 79 ILE HG13 1 80 GLU H . . 5.030 4.393 4.211 4.567 . 0 0 "[ . 1 . 2]" 1
1589 1 79 ILE MG 1 80 GLU H . . 3.530 2.417 2.071 2.769 . 0 0 "[ . 1 . 2]" 1
1590 1 79 ILE MG 1 80 GLU HA . . 4.520 3.994 3.902 4.235 . 0 0 "[ . 1 . 2]" 1
1591 1 79 ILE MG 1 80 GLU HB2 . . 4.920 4.061 3.674 4.855 . 0 0 "[ . 1 . 2]" 1
1592 1 79 ILE MG 1 80 GLU HB3 . . 5.260 4.214 3.681 4.501 . 0 0 "[ . 1 . 2]" 1
1593 1 79 ILE MG 1 84 LYS HE2 . . 3.620 3.002 2.291 3.520 . 0 0 "[ . 1 . 2]" 1
1594 1 79 ILE MG 1 84 LYS HE3 . . 3.560 2.511 1.950 3.415 . 0 0 "[ . 1 . 2]" 1
1595 1 80 GLU H 1 80 GLU HB2 . . 3.430 2.183 2.033 2.838 . 0 0 "[ . 1 . 2]" 1
1596 1 80 GLU H 1 80 GLU HB3 . . 3.680 3.010 2.222 3.380 . 0 0 "[ . 1 . 2]" 1
1597 1 80 GLU H 1 80 GLU HG3 . . 4.180 3.844 3.260 4.530 0.350 14 0 "[ . 1 . 2]" 1
1598 1 80 GLU H 1 81 ILE H . . 5.500 4.636 4.485 4.665 . 0 0 "[ . 1 . 2]" 1
1599 1 80 GLU HA 1 80 GLU HG2 . . 3.760 2.576 2.002 3.362 . 0 0 "[ . 1 . 2]" 1
1600 1 80 GLU HA 1 81 ILE H . . 3.090 2.399 2.202 2.557 . 0 0 "[ . 1 . 2]" 1
1601 1 80 GLU HA 1 81 ILE HB . . 4.920 4.451 4.131 4.650 . 0 0 "[ . 1 . 2]" 1
1602 1 80 GLU HA 1 81 ILE HG12 . . 4.380 3.644 3.350 4.376 . 0 0 "[ . 1 . 2]" 1
1603 1 80 GLU HA 1 81 ILE HG13 . . 4.920 4.683 4.020 4.956 0.036 7 0 "[ . 1 . 2]" 1
1604 1 80 GLU HA 1 82 ARG H . . 4.370 4.143 3.533 4.386 0.016 19 0 "[ . 1 . 2]" 1
1605 1 80 GLU HB2 1 81 ILE H . . 4.920 4.161 3.911 4.395 . 0 0 "[ . 1 . 2]" 1
1606 1 80 GLU HB3 1 81 ILE H . . 4.920 3.269 2.777 4.501 . 0 0 "[ . 1 . 2]" 1
1607 1 80 GLU HB3 1 82 ARG H . . 5.270 4.403 4.072 5.373 0.103 18 0 "[ . 1 . 2]" 1
1608 1 80 GLU HG2 1 81 ILE H . . 4.690 2.719 2.125 3.481 . 0 0 "[ . 1 . 2]" 1
1609 1 80 GLU HG2 1 82 ARG H . . 4.410 3.442 2.587 4.284 . 0 0 "[ . 1 . 2]" 1
1610 1 81 ILE H 1 81 ILE HB . . 3.850 2.604 2.471 2.714 . 0 0 "[ . 1 . 2]" 1
1611 1 81 ILE H 1 81 ILE MD . . 4.740 4.254 4.009 4.603 . 0 0 "[ . 1 . 2]" 1
1612 1 81 ILE H 1 81 ILE HG12 . . 4.090 3.094 2.772 3.713 . 0 0 "[ . 1 . 2]" 1
1613 1 81 ILE H 1 81 ILE HG13 . . 4.180 3.855 2.694 4.235 0.055 19 0 "[ . 1 . 2]" 1
1614 1 81 ILE H 1 81 ILE MG . . 4.030 3.793 3.595 3.855 . 0 0 "[ . 1 . 2]" 1
1615 1 81 ILE H 1 82 ARG H . . 3.480 1.928 1.836 2.194 . 0 0 "[ . 1 . 2]" 1
1616 1 81 ILE HA 1 81 ILE MD . . 3.240 2.479 2.193 3.303 0.063 15 0 "[ . 1 . 2]" 1
1617 1 81 ILE HA 1 81 ILE MG . . 3.280 2.408 2.350 2.651 . 0 0 "[ . 1 . 2]" 1
1618 1 81 ILE HA 1 84 LYS H . . 4.920 3.722 3.418 4.231 . 0 0 "[ . 1 . 2]" 1
1619 1 81 ILE HA 1 84 LYS HB2 . . 4.380 2.553 2.006 2.885 . 0 0 "[ . 1 . 2]" 1
1620 1 81 ILE HA 1 84 LYS HB3 . . 5.260 3.765 3.372 4.029 . 0 0 "[ . 1 . 2]" 1
1621 1 81 ILE HA 1 84 LYS HD2 . . 3.760 2.542 1.971 3.750 . 0 0 "[ . 1 . 2]" 1
1622 1 81 ILE HA 1 84 LYS HD3 . . 4.270 3.910 1.997 4.444 0.174 14 0 "[ . 1 . 2]" 1
1623 1 81 ILE HA 1 84 LYS HE2 . . 4.270 3.563 2.621 4.240 . 0 0 "[ . 1 . 2]" 1
1624 1 81 ILE HA 1 84 LYS HE3 . . 4.690 4.070 2.608 4.697 0.007 13 0 "[ . 1 . 2]" 1
1625 1 81 ILE HA 1 84 LYS HG3 . . 3.850 2.409 1.967 3.693 . 0 0 "[ . 1 . 2]" 1
1626 1 81 ILE HA 1 89 VAL MG2 . . 4.520 3.287 2.895 3.963 . 0 0 "[ . 1 . 2]" 1
1627 1 81 ILE HB 1 81 ILE MD . . 3.720 3.105 2.777 3.181 . 0 0 "[ . 1 . 2]" 1
1628 1 81 ILE HB 1 82 ARG H . . 4.520 2.724 2.578 3.176 . 0 0 "[ . 1 . 2]" 1
1629 1 81 ILE HB 1 89 VAL MG2 . . 4.100 4.125 3.961 4.342 0.242 19 0 "[ . 1 . 2]" 1
1630 1 81 ILE MD 1 81 ILE MG . . 2.790 1.812 1.694 1.876 . 0 0 "[ . 1 . 2]" 1
1631 1 81 ILE MD 1 82 ARG H . . 5.120 4.911 4.704 5.189 0.069 14 0 "[ . 1 . 2]" 1
1632 1 81 ILE MD 1 84 LYS H . . 5.450 5.235 4.931 5.549 0.099 14 0 "[ . 1 . 2]" 1
1633 1 81 ILE MD 1 84 LYS HD2 . . 4.690 3.065 2.196 4.336 . 0 0 "[ . 1 . 2]" 1
1634 1 81 ILE MD 1 84 LYS HE2 . . 4.690 4.650 3.446 4.936 0.246 11 0 "[ . 1 . 2]" 1
1635 1 81 ILE MD 1 84 LYS HE3 . . 4.920 4.532 4.163 4.792 . 0 0 "[ . 1 . 2]" 1
1636 1 81 ILE MD 1 89 VAL HA . . 4.690 3.006 2.422 3.463 . 0 0 "[ . 1 . 2]" 1
1637 1 81 ILE MD 1 89 VAL MG2 . . 3.330 1.821 1.682 2.122 . 0 0 "[ . 1 . 2]" 1
1638 1 81 ILE HG12 1 82 ARG H . . 4.800 4.450 4.315 4.774 . 0 0 "[ . 1 . 2]" 1
1639 1 81 ILE HG13 1 82 ARG H . . 5.430 4.767 4.484 5.166 . 0 0 "[ . 1 . 2]" 1
1640 1 81 ILE MG 1 82 ARG H . . 4.460 3.428 2.630 3.895 . 0 0 "[ . 1 . 2]" 1
1641 1 81 ILE MG 1 84 LYS H . . 4.480 3.869 2.915 4.520 0.040 13 0 "[ . 1 . 2]" 1
1642 1 82 ARG H 1 82 ARG HB2 . . 3.540 2.214 2.055 2.562 . 0 0 "[ . 1 . 2]" 1
1643 1 82 ARG H 1 82 ARG HB3 . . 3.510 2.990 2.408 3.547 0.037 13 0 "[ . 1 . 2]" 1
1644 1 82 ARG H 1 82 ARG QD . . 4.690 3.818 3.012 4.489 . 0 0 "[ . 1 . 2]" 1
1645 1 82 ARG H 1 82 ARG HG2 . . 4.450 4.444 4.011 4.629 0.179 14 0 "[ . 1 . 2]" 1
1646 1 82 ARG H 1 82 ARG HG3 . . 4.380 4.038 2.695 4.379 . 0 0 "[ . 1 . 2]" 1
1647 1 82 ARG H 1 83 GLY H . . 5.280 4.439 3.676 4.559 . 0 0 "[ . 1 . 2]" 1
1648 1 82 ARG HA 1 82 ARG QD . . 4.380 3.191 2.196 4.025 . 0 0 "[ . 1 . 2]" 1
1649 1 82 ARG HA 1 82 ARG HG2 . . 3.900 3.285 2.363 3.799 . 0 0 "[ . 1 . 2]" 1
1650 1 82 ARG HA 1 82 ARG HG3 . . 3.350 2.437 2.111 2.657 . 0 0 "[ . 1 . 2]" 1
1651 1 82 ARG HA 1 83 GLY H . . 3.090 2.298 2.225 3.578 0.488 13 0 "[ . 1 . 2]" 1
1652 1 82 ARG HA 1 83 GLY HA2 . . 4.690 4.438 4.392 4.818 0.128 13 0 "[ . 1 . 2]" 1
1653 1 82 ARG HA 1 84 LYS H . . 4.270 3.837 3.472 4.295 0.025 13 0 "[ . 1 . 2]" 1
1654 1 82 ARG HB2 1 82 ARG QD . . 3.480 2.247 2.052 2.603 . 0 0 "[ . 1 . 2]" 1
1655 1 82 ARG HB2 1 82 ARG HE . . 4.680 4.087 3.072 4.728 0.048 7 0 "[ . 1 . 2]" 1
1656 1 82 ARG HB2 1 83 GLY H . . 4.730 4.424 2.216 4.671 . 0 0 "[ . 1 . 2]" 1
1657 1 82 ARG HB3 1 82 ARG QD . . 3.850 2.980 2.233 3.347 . 0 0 "[ . 1 . 2]" 1
1658 1 82 ARG HB3 1 82 ARG HE . . 5.260 4.343 3.010 5.250 . 0 0 "[ . 1 . 2]" 1
1659 1 82 ARG HB3 1 83 GLY H . . 4.690 4.027 1.992 4.538 . 0 0 "[ . 1 . 2]" 1
1660 1 82 ARG QD 1 82 ARG HH11 . . 4.100 1.971 1.893 2.098 . 0 0 "[ . 1 . 2]" 1
1661 1 82 ARG QD 1 82 ARG HH21 . . 4.100 4.000 3.993 4.009 . 0 0 "[ . 1 . 2]" 1
1662 1 82 ARG QD 1 83 GLY H . . 4.920 4.411 3.759 4.696 . 0 0 "[ . 1 . 2]" 1
1663 1 82 ARG HE 1 82 ARG HG2 . . 4.240 2.800 2.142 3.357 . 0 0 "[ . 1 . 2]" 1
1664 1 82 ARG HE 1 82 ARG HG3 . . 4.000 3.063 2.152 3.993 . 0 0 "[ . 1 . 2]" 1
1665 1 82 ARG HG2 1 83 GLY H . . 4.640 4.150 2.872 4.721 0.081 15 0 "[ . 1 . 2]" 1
1666 1 82 ARG HG3 1 83 GLY H . . 4.180 3.421 2.787 4.454 0.274 13 0 "[ . 1 . 2]" 1
1667 1 83 GLY H 1 84 LYS H . . 3.530 2.919 2.185 3.329 . 0 0 "[ . 1 . 2]" 1
1668 1 84 LYS H 1 84 LYS HB2 . . 3.300 2.452 2.267 2.645 . 0 0 "[ . 1 . 2]" 1
1669 1 84 LYS H 1 84 LYS HB3 . . 3.760 3.537 3.503 3.552 . 0 0 "[ . 1 . 2]" 1
1670 1 84 LYS H 1 84 LYS HD2 . . 5.260 4.460 3.623 4.893 . 0 0 "[ . 1 . 2]" 1
1671 1 84 LYS H 1 84 LYS HD3 . . 4.920 4.750 4.040 5.362 0.442 15 0 "[ . 1 . 2]" 1
1672 1 84 LYS H 1 84 LYS HG3 . . 3.640 2.419 2.117 3.298 . 0 0 "[ . 1 . 2]" 1
1673 1 84 LYS H 1 85 ASP H . . 4.620 4.612 4.400 4.675 0.055 4 0 "[ . 1 . 2]" 1
1674 1 84 LYS H 1 89 VAL MG2 . . 4.640 4.487 3.865 4.643 0.003 8 0 "[ . 1 . 2]" 1
1675 1 84 LYS HA 1 84 LYS HD2 . . 4.690 4.441 3.758 4.628 . 0 0 "[ . 1 . 2]" 1
1676 1 84 LYS HA 1 84 LYS HD3 . . 4.270 3.822 3.593 4.442 0.172 19 0 "[ . 1 . 2]" 1
1677 1 84 LYS HA 1 84 LYS HE2 . . 5.260 5.275 4.932 5.978 0.718 19 2 "[ .- 1 . +2]" 1
1678 1 84 LYS HA 1 84 LYS HG2 . . 3.430 2.286 2.086 2.627 . 0 0 "[ . 1 . 2]" 1
1679 1 84 LYS HA 1 85 ASP H . . 3.000 2.387 2.178 2.781 . 0 0 "[ . 1 . 2]" 1
1680 1 84 LYS HA 1 85 ASP QB . . 4.690 4.062 4.009 4.102 . 0 0 "[ . 1 . 2]" 1
1681 1 84 LYS HA 1 89 VAL MG2 . . 4.690 4.588 4.282 4.709 0.019 18 0 "[ . 1 . 2]" 1
1682 1 84 LYS HB2 1 85 ASP H . . 4.520 3.911 3.221 4.492 . 0 0 "[ . 1 . 2]" 1
1683 1 84 LYS HB2 1 89 VAL MG2 . . 3.430 2.580 2.274 2.835 . 0 0 "[ . 1 . 2]" 1
1684 1 84 LYS HB3 1 85 ASP H . . 4.100 2.783 1.928 3.596 . 0 0 "[ . 1 . 2]" 1
1685 1 84 LYS HB3 1 88 GLU H . . 5.500 4.879 4.556 5.129 . 0 0 "[ . 1 . 2]" 1
1686 1 84 LYS HB3 1 88 GLU HB2 . . 4.380 3.158 2.760 3.505 . 0 0 "[ . 1 . 2]" 1
1687 1 84 LYS HB3 1 88 GLU HB3 . . 4.270 2.419 2.000 2.968 . 0 0 "[ . 1 . 2]" 1
1688 1 84 LYS HB3 1 89 VAL MG2 . . 3.650 2.696 2.373 3.009 . 0 0 "[ . 1 . 2]" 1
1689 1 84 LYS HD2 1 88 GLU HB3 . . 5.260 3.889 2.482 5.273 0.013 19 0 "[ . 1 . 2]" 1
1690 1 84 LYS HD2 1 89 VAL MG2 . . 4.100 3.289 2.896 4.097 . 0 0 "[ . 1 . 2]" 1
1691 1 84 LYS HD2 1 92 LEU QD . . 4.180 2.468 1.901 3.641 . 0 0 "[ . 1 . 2]" 1
1692 1 84 LYS HD3 1 88 GLU HB3 . . 4.690 2.964 2.230 3.880 . 0 0 "[ . 1 . 2]" 1
1693 1 84 LYS HD3 1 89 VAL MG2 . . 4.520 3.886 2.874 4.534 0.014 11 0 "[ . 1 . 2]" 1
1694 1 84 LYS HD3 1 92 LEU QD . . 3.900 2.411 1.871 3.077 . 0 0 "[ . 1 . 2]" 1
1695 1 84 LYS HE2 1 84 LYS HG3 . . 4.270 2.697 2.222 3.854 . 0 0 "[ . 1 . 2]" 1
1696 1 84 LYS HE2 1 92 LEU QD . . 4.380 3.465 1.946 4.001 . 0 0 "[ . 1 . 2]" 1
1697 1 84 LYS HE3 1 84 LYS HG3 . . 3.810 3.517 2.151 3.806 . 0 0 "[ . 1 . 2]" 1
1698 1 84 LYS HE3 1 92 LEU QD . . 4.270 2.609 1.912 3.270 . 0 0 "[ . 1 . 2]" 1
1699 1 84 LYS HG2 1 85 ASP H . . 4.850 4.178 3.703 4.608 . 0 0 "[ . 1 . 2]" 1
1700 1 84 LYS HG3 1 89 VAL MG2 . . 4.380 4.232 3.926 4.445 0.065 19 0 "[ . 1 . 2]" 1
1701 1 85 ASP H 1 85 ASP QB . . 3.500 2.223 2.059 2.458 . 0 0 "[ . 1 . 2]" 1
1702 1 85 ASP H 1 86 VAL H . . 5.500 4.584 4.453 4.650 . 0 0 "[ . 1 . 2]" 1
1703 1 85 ASP H 1 88 GLU H . . 5.370 3.625 3.400 4.018 . 0 0 "[ . 1 . 2]" 1
1704 1 85 ASP H 1 88 GLU HB2 . . 4.650 2.094 1.912 2.553 . 0 0 "[ . 1 . 2]" 1
1705 1 85 ASP H 1 88 GLU HB3 . . 4.690 3.033 2.598 3.711 . 0 0 "[ . 1 . 2]" 1
1706 1 85 ASP H 1 88 GLU HG2 . . 4.920 4.295 2.949 4.877 . 0 0 "[ . 1 . 2]" 1
1707 1 85 ASP H 1 88 GLU HG3 . . 5.260 3.363 2.577 4.321 . 0 0 "[ . 1 . 2]" 1
1708 1 85 ASP H 1 89 VAL MG2 . . 5.480 4.208 3.202 4.809 . 0 0 "[ . 1 . 2]" 1
1709 1 85 ASP QB 1 86 VAL H . . 4.100 3.392 2.455 3.659 . 0 0 "[ . 1 . 2]" 1
1710 1 85 ASP QB 1 86 VAL QG . . 5.260 3.889 3.646 4.320 . 0 0 "[ . 1 . 2]" 1
1711 1 85 ASP QB 1 87 ASN H . . 4.240 3.321 2.698 3.792 . 0 0 "[ . 1 . 2]" 1
1712 1 85 ASP QB 1 88 GLU H . . 4.200 2.261 1.906 2.565 . 0 0 "[ . 1 . 2]" 1
1713 1 85 ASP QB 1 88 GLU HB2 . . 4.690 2.220 1.991 2.586 . 0 0 "[ . 1 . 2]" 1
1714 1 85 ASP QB 1 88 GLU HB3 . . 4.690 3.833 3.605 4.171 . 0 0 "[ . 1 . 2]" 1
1715 1 85 ASP QB 1 88 GLU HG2 . . 4.380 3.891 2.621 4.630 0.250 13 0 "[ . 1 . 2]" 1
1716 1 85 ASP QB 1 88 GLU HG3 . . 4.920 3.278 2.392 4.079 . 0 0 "[ . 1 . 2]" 1
1717 1 86 VAL H 1 86 VAL HB . . 3.810 3.059 2.057 3.530 . 0 0 "[ . 1 . 2]" 1
1718 1 86 VAL H 1 86 VAL QG . . 3.140 2.040 1.764 2.893 . 0 0 "[ . 1 . 2]" 1
1719 1 86 VAL H 1 87 ASN H . . 3.690 2.810 2.337 3.017 . 0 0 "[ . 1 . 2]" 1
1720 1 86 VAL H 1 88 GLU H . . 5.500 4.193 3.701 4.293 . 0 0 "[ . 1 . 2]" 1
1721 1 86 VAL HA 1 86 VAL QG . . 3.240 2.212 1.948 2.394 . 0 0 "[ . 1 . 2]" 1
1722 1 86 VAL HA 1 87 ASN HA . . 5.260 4.759 4.690 4.796 . 0 0 "[ . 1 . 2]" 1
1723 1 86 VAL HA 1 88 GLU H . . 4.520 4.542 4.450 4.584 0.064 9 0 "[ . 1 . 2]" 1
1724 1 86 VAL HA 1 89 VAL H . . 3.850 3.549 3.315 3.739 . 0 0 "[ . 1 . 2]" 1
1725 1 86 VAL HA 1 89 VAL HB . . 3.530 2.847 2.508 3.264 . 0 0 "[ . 1 . 2]" 1
1726 1 86 VAL HA 1 90 PHE H . . 4.520 4.098 3.823 4.570 0.050 18 0 "[ . 1 . 2]" 1
1727 1 86 VAL HB 1 87 ASN H . . 4.160 3.665 3.016 4.120 . 0 0 "[ . 1 . 2]" 1
1728 1 86 VAL QG 1 87 ASN H . . 3.650 1.949 1.838 2.479 . 0 0 "[ . 1 . 2]" 1
1729 1 86 VAL QG 1 87 ASN HA . . 4.520 3.124 2.785 3.506 . 0 0 "[ . 1 . 2]" 1
1730 1 86 VAL QG 1 87 ASN QB . . 4.520 3.115 2.908 3.712 . 0 0 "[ . 1 . 2]" 1
1731 1 86 VAL QG 1 87 ASN HD21 . . 4.920 2.826 2.380 4.037 . 0 0 "[ . 1 . 2]" 1
1732 1 86 VAL QG 1 88 GLU H . . 4.410 4.050 3.973 4.327 . 0 0 "[ . 1 . 2]" 1
1733 1 86 VAL QG 1 90 PHE QD . . 4.380 3.182 2.852 3.644 . 0 0 "[ . 1 . 2]" 1
1734 1 86 VAL QG 1 90 PHE QE . . 4.920 2.478 1.852 2.892 . 0 0 "[ . 1 . 2]" 1
1735 1 87 ASN H 1 87 ASN QB . . 3.230 2.117 2.002 2.730 . 0 0 "[ . 1 . 2]" 1
1736 1 87 ASN H 1 87 ASN HD21 . . 4.790 3.173 2.922 3.361 . 0 0 "[ . 1 . 2]" 1
1737 1 87 ASN H 1 87 ASN HD22 . . 4.270 4.550 3.177 4.814 0.544 18 8 "[ .* * *-* *.* + 2]" 1
1738 1 87 ASN H 1 88 GLU H . . 3.170 2.687 2.464 2.815 . 0 0 "[ . 1 . 2]" 1
1739 1 87 ASN H 1 88 GLU HA . . 5.260 5.188 4.991 5.302 0.042 15 0 "[ . 1 . 2]" 1
1740 1 87 ASN H 1 88 GLU HB2 . . 5.150 4.446 4.210 4.602 . 0 0 "[ . 1 . 2]" 1
1741 1 87 ASN H 1 89 VAL H . . 4.340 4.287 3.964 4.362 0.022 11 0 "[ . 1 . 2]" 1
1742 1 87 ASN HA 1 90 PHE H . . 4.100 3.471 3.235 3.713 . 0 0 "[ . 1 . 2]" 1
1743 1 87 ASN HA 1 90 PHE HB2 . . 4.030 2.511 2.374 2.679 . 0 0 "[ . 1 . 2]" 1
1744 1 87 ASN HA 1 90 PHE HB3 . . 3.810 4.016 3.852 4.094 0.284 11 0 "[ . 1 . 2]" 1
1745 1 87 ASN HA 1 90 PHE QD . . 4.380 2.085 1.977 2.877 . 0 0 "[ . 1 . 2]" 1
1746 1 87 ASN HA 1 91 ASP H . . 4.690 3.879 3.554 4.390 . 0 0 "[ . 1 . 2]" 1
1747 1 87 ASN QB 1 88 GLU H . . 3.800 2.545 2.407 2.672 . 0 0 "[ . 1 . 2]" 1
1748 1 87 ASN QB 1 88 GLU HA . . 3.560 3.581 3.568 3.601 0.041 19 0 "[ . 1 . 2]" 1
1749 1 88 GLU H 1 88 GLU HB2 . . 3.400 2.058 2.019 2.173 . 0 0 "[ . 1 . 2]" 1
1750 1 88 GLU H 1 88 GLU HB3 . . 3.550 3.327 3.193 3.463 . 0 0 "[ . 1 . 2]" 1
1751 1 88 GLU H 1 88 GLU HG2 . . 3.860 3.562 2.933 3.954 0.094 4 0 "[ . 1 . 2]" 1
1752 1 88 GLU H 1 88 GLU HG3 . . 4.270 3.677 3.252 4.290 0.020 10 0 "[ . 1 . 2]" 1
1753 1 88 GLU H 1 90 PHE H . . 4.730 4.340 3.946 4.644 . 0 0 "[ . 1 . 2]" 1
1754 1 88 GLU HA 1 88 GLU HG2 . . 3.850 2.226 1.986 3.596 . 0 0 "[ . 1 . 2]" 1
1755 1 88 GLU HA 1 88 GLU HG3 . . 3.760 3.207 2.485 3.565 . 0 0 "[ . 1 . 2]" 1
1756 1 88 GLU HA 1 89 VAL MG2 . . 5.260 5.140 4.969 5.296 0.036 12 0 "[ . 1 . 2]" 1
1757 1 88 GLU HA 1 90 PHE H . . 5.260 4.696 4.176 5.102 . 0 0 "[ . 1 . 2]" 1
1758 1 88 GLU HA 1 91 ASP H . . 3.850 3.581 3.323 3.857 0.007 12 0 "[ . 1 . 2]" 1
1759 1 88 GLU HA 1 91 ASP HB2 . . 3.960 2.922 2.638 3.259 . 0 0 "[ . 1 . 2]" 1
1760 1 88 GLU HA 1 91 ASP HB3 . . 3.900 3.405 2.985 3.795 . 0 0 "[ . 1 . 2]" 1
1761 1 88 GLU HA 1 92 LEU H . . 4.640 4.087 3.818 4.401 . 0 0 "[ . 1 . 2]" 1
1762 1 88 GLU HA 1 92 LEU QD . . 5.260 3.600 3.317 3.942 . 0 0 "[ . 1 . 2]" 1
1763 1 88 GLU HB2 1 89 VAL H . . 4.180 2.997 2.623 3.328 . 0 0 "[ . 1 . 2]" 1
1764 1 88 GLU HB2 1 89 VAL MG2 . . 4.690 4.071 3.837 4.335 . 0 0 "[ . 1 . 2]" 1
1765 1 88 GLU HB3 1 89 VAL H . . 4.030 2.922 2.718 3.322 . 0 0 "[ . 1 . 2]" 1
1766 1 88 GLU HB3 1 89 VAL MG2 . . 4.690 3.485 3.208 3.869 . 0 0 "[ . 1 . 2]" 1
1767 1 88 GLU HB3 1 92 LEU QD . . 4.380 2.710 2.222 3.588 . 0 0 "[ . 1 . 2]" 1
1768 1 88 GLU HG2 1 92 LEU QD . . 5.260 4.037 3.363 4.865 . 0 0 "[ . 1 . 2]" 1
1769 1 88 GLU HG3 1 92 LEU QD . . 4.920 4.442 3.408 4.789 . 0 0 "[ . 1 . 2]" 1
1770 1 89 VAL H 1 89 VAL HB . . 3.330 2.241 2.141 2.359 . 0 0 "[ . 1 . 2]" 1
1771 1 89 VAL H 1 89 VAL MG1 . . 4.100 3.653 3.603 3.692 . 0 0 "[ . 1 . 2]" 1
1772 1 89 VAL H 1 89 VAL MG2 . . 3.110 2.460 2.255 2.661 . 0 0 "[ . 1 . 2]" 1
1773 1 89 VAL H 1 90 PHE H . . 3.470 2.787 2.533 2.939 . 0 0 "[ . 1 . 2]" 1
1774 1 89 VAL H 1 92 LEU HB2 . . 5.180 4.626 4.460 4.939 . 0 0 "[ . 1 . 2]" 1
1775 1 89 VAL HA 1 89 VAL MG1 . . 3.220 2.537 2.397 2.622 . 0 0 "[ . 1 . 2]" 1
1776 1 89 VAL HA 1 89 VAL MG2 . . 3.120 2.178 2.066 2.308 . 0 0 "[ . 1 . 2]" 1
1777 1 89 VAL HA 1 92 LEU H . . 3.900 3.374 3.048 3.877 . 0 0 "[ . 1 . 2]" 1
1778 1 89 VAL HA 1 92 LEU HB2 . . 3.760 2.314 2.076 2.687 . 0 0 "[ . 1 . 2]" 1
1779 1 89 VAL HA 1 92 LEU HB3 . . 4.030 3.745 3.500 4.046 0.016 18 0 "[ . 1 . 2]" 1
1780 1 89 VAL HA 1 92 LEU QD . . 3.650 2.146 1.913 3.460 . 0 0 "[ . 1 . 2]" 1
1781 1 89 VAL HA 1 92 LEU HG . . 4.380 4.321 2.990 4.483 0.103 19 0 "[ . 1 . 2]" 1
1782 1 89 VAL HA 1 93 LEU H . . 4.920 4.029 3.702 4.727 . 0 0 "[ . 1 . 2]" 1
1783 1 89 VAL HB 1 90 PHE H . . 3.520 2.575 2.366 2.846 . 0 0 "[ . 1 . 2]" 1
1784 1 89 VAL MG1 1 90 PHE H . . 4.100 3.038 2.627 3.394 . 0 0 "[ . 1 . 2]" 1
1785 1 89 VAL MG1 1 90 PHE HA . . 3.500 3.220 2.941 3.468 . 0 0 "[ . 1 . 2]" 1
1786 1 89 VAL MG1 1 90 PHE QD . . 4.920 3.123 2.121 3.645 . 0 0 "[ . 1 . 2]" 1
1787 1 89 VAL MG1 1 93 LEU HG . . 3.850 3.136 2.618 3.864 0.014 19 0 "[ . 1 . 2]" 1
1788 1 89 VAL MG2 1 90 PHE H . . 4.180 3.994 3.869 4.127 . 0 0 "[ . 1 . 2]" 1
1789 1 90 PHE H 1 90 PHE HB2 . . 3.490 2.346 2.203 2.488 . 0 0 "[ . 1 . 2]" 1
1790 1 90 PHE H 1 90 PHE HB3 . . 3.310 3.464 3.446 3.490 0.180 14 0 "[ . 1 . 2]" 1
1791 1 90 PHE H 1 90 PHE QD . . 4.750 2.987 2.498 3.224 . 0 0 "[ . 1 . 2]" 1
1792 1 90 PHE H 1 91 ASP H . . 3.520 2.854 2.688 3.022 . 0 0 "[ . 1 . 2]" 1
1793 1 90 PHE H 1 91 ASP HB2 . . 4.970 4.679 4.488 4.876 . 0 0 "[ . 1 . 2]" 1
1794 1 90 PHE H 1 92 LEU H . . 5.110 4.016 3.653 4.493 . 0 0 "[ . 1 . 2]" 1
1795 1 90 PHE H 1 93 LEU H . . 5.380 5.082 4.929 5.332 . 0 0 "[ . 1 . 2]" 1
1796 1 90 PHE HA 1 90 PHE QD . . 3.590 1.976 1.915 2.020 . 0 0 "[ . 1 . 2]" 1
1797 1 90 PHE HA 1 90 PHE QE . . 4.920 4.340 4.291 4.406 . 0 0 "[ . 1 . 2]" 1
1798 1 90 PHE HA 1 93 LEU H . . 4.200 3.849 3.566 4.202 0.002 14 0 "[ . 1 . 2]" 1
1799 1 90 PHE HA 1 93 LEU HB2 . . 3.680 3.272 2.974 3.540 . 0 0 "[ . 1 . 2]" 1
1800 1 90 PHE HA 1 93 LEU QD . . 3.850 3.487 3.123 3.787 . 0 0 "[ . 1 . 2]" 1
1801 1 90 PHE HA 1 93 LEU HG . . 4.380 4.236 3.868 4.390 0.010 13 0 "[ . 1 . 2]" 1
1802 1 90 PHE HB2 1 91 ASP H . . 3.900 2.382 1.996 2.736 . 0 0 "[ . 1 . 2]" 1
1803 1 90 PHE HB3 1 91 ASP H . . 3.900 3.398 2.881 3.785 . 0 0 "[ . 1 . 2]" 1
1804 1 90 PHE QD 1 91 ASP H . . 5.160 4.281 4.043 4.479 . 0 0 "[ . 1 . 2]" 1
1805 1 90 PHE QD 1 93 LEU QD . . 4.520 3.961 3.366 4.409 . 0 0 "[ . 1 . 2]" 1
1806 1 91 ASP H 1 91 ASP HB2 . . 3.280 2.059 2.004 2.174 . 0 0 "[ . 1 . 2]" 1
1807 1 91 ASP H 1 91 ASP HB3 . . 3.920 3.055 2.789 3.286 . 0 0 "[ . 1 . 2]" 1
1808 1 91 ASP HA 1 93 LEU H . . 5.500 5.154 4.947 5.281 . 0 0 "[ . 1 . 2]" 1
1809 1 91 ASP HA 1 94 SER H . . 4.040 3.797 3.334 4.073 0.033 16 0 "[ . 1 . 2]" 1
1810 1 91 ASP HA 1 94 SER HB2 . . 4.030 2.735 2.223 3.878 . 0 0 "[ . 1 . 2]" 1
1811 1 91 ASP HA 1 94 SER HB3 . . 3.850 3.101 2.519 3.661 . 0 0 "[ . 1 . 2]" 1
1812 1 91 ASP HB2 1 92 LEU H . . 3.710 3.401 3.070 3.738 0.028 16 0 "[ . 1 . 2]" 1
1813 1 91 ASP HB3 1 92 LEU H . . 3.270 2.913 2.375 3.169 . 0 0 "[ . 1 . 2]" 1
1814 1 92 LEU H 1 92 LEU HB2 . . 3.210 2.088 2.030 2.203 . 0 0 "[ . 1 . 2]" 1
1815 1 92 LEU H 1 92 LEU HB3 . . 3.500 3.395 3.341 3.478 . 0 0 "[ . 1 . 2]" 1
1816 1 92 LEU H 1 92 LEU QD . . 3.890 3.015 1.979 3.283 . 0 0 "[ . 1 . 2]" 1
1817 1 92 LEU H 1 92 LEU HG . . 3.350 3.257 2.988 3.423 0.073 14 0 "[ . 1 . 2]" 1
1818 1 92 LEU H 1 93 LEU H . . 3.350 2.984 2.743 3.248 . 0 0 "[ . 1 . 2]" 1
1819 1 92 LEU H 1 94 SER H . . 4.270 4.185 3.987 4.317 0.047 3 0 "[ . 1 . 2]" 1
1820 1 92 LEU HA 1 92 LEU QD . . 3.220 2.636 1.918 2.844 . 0 0 "[ . 1 . 2]" 1
1821 1 92 LEU HA 1 94 SER H . . 5.260 4.745 4.434 4.936 . 0 0 "[ . 1 . 2]" 1
1822 1 92 LEU HA 1 95 ASP HB2 . . 4.520 3.377 2.624 3.974 . 0 0 "[ . 1 . 2]" 1
1823 1 92 LEU HA 1 95 ASP HB3 . . 4.690 3.728 2.701 4.629 . 0 0 "[ . 1 . 2]" 1
1824 1 92 LEU HB2 1 93 LEU H . . 3.850 2.575 2.456 2.732 . 0 0 "[ . 1 . 2]" 1
1825 1 92 LEU HB3 1 93 LEU H . . 3.990 2.656 2.534 2.840 . 0 0 "[ . 1 . 2]" 1
1826 1 92 LEU HB3 1 96 MET ME . . 3.350 3.277 3.016 3.363 0.013 3 0 "[ . 1 . 2]" 1
1827 1 92 LEU QD 1 93 LEU H . . 4.690 3.818 3.757 3.899 . 0 0 "[ . 1 . 2]" 1
1828 1 92 LEU HG 1 93 LEU H . . 4.920 4.774 4.634 4.842 . 0 0 "[ . 1 . 2]" 1
1829 1 93 LEU H 1 93 LEU HB2 . . 3.350 2.441 2.347 2.552 . 0 0 "[ . 1 . 2]" 1
1830 1 93 LEU H 1 93 LEU HB3 . . 3.950 3.533 3.520 3.543 . 0 0 "[ . 1 . 2]" 1
1831 1 93 LEU H 1 93 LEU QD . . 4.050 2.491 1.763 3.013 . 0 0 "[ . 1 . 2]" 1
1832 1 93 LEU H 1 93 LEU HG . . 3.520 2.674 1.994 3.594 0.074 4 0 "[ . 1 . 2]" 1
1833 1 93 LEU H 1 94 SER H . . 3.260 2.996 2.823 3.121 . 0 0 "[ . 1 . 2]" 1
1834 1 93 LEU H 1 95 ASP H . . 5.500 4.453 3.920 4.690 . 0 0 "[ . 1 . 2]" 1
1835 1 93 LEU H 1 96 MET ME . . 4.180 4.011 3.833 4.189 0.009 2 0 "[ . 1 . 2]" 1
1836 1 93 LEU HA 1 93 LEU QD . . 2.990 2.035 1.945 2.246 . 0 0 "[ . 1 . 2]" 1
1837 1 93 LEU HA 1 93 LEU HG . . 3.760 3.329 2.956 3.735 . 0 0 "[ . 1 . 2]" 1
1838 1 93 LEU HA 1 96 MET H . . 4.220 3.107 2.916 3.418 . 0 0 "[ . 1 . 2]" 1
1839 1 93 LEU HA 1 96 MET HB2 . . 4.520 2.173 2.008 2.360 . 0 0 "[ . 1 . 2]" 1
1840 1 93 LEU HA 1 96 MET HB3 . . 4.920 3.833 3.620 4.046 . 0 0 "[ . 1 . 2]" 1
1841 1 93 LEU HA 1 96 MET ME . . 3.500 2.531 2.272 2.760 . 0 0 "[ . 1 . 2]" 1
1842 1 93 LEU HA 1 96 MET HG2 . . 4.920 4.323 3.905 4.727 . 0 0 "[ . 1 . 2]" 1
1843 1 93 LEU HA 1 96 MET HG3 . . 4.180 2.818 2.391 3.366 . 0 0 "[ . 1 . 2]" 1
1844 1 93 LEU HA 1 100 LEU QD . . 4.690 3.170 2.989 3.480 . 0 0 "[ . 1 . 2]" 1
1845 1 93 LEU HB2 1 94 SER H . . 3.730 2.505 2.384 2.740 . 0 0 "[ . 1 . 2]" 1
1846 1 93 LEU HB2 1 94 SER HA . . 5.260 4.301 4.157 4.425 . 0 0 "[ . 1 . 2]" 1
1847 1 93 LEU HB3 1 93 LEU QD . . 3.270 2.131 2.070 2.244 . 0 0 "[ . 1 . 2]" 1
1848 1 93 LEU HB3 1 94 SER H . . 4.150 3.411 3.141 3.695 . 0 0 "[ . 1 . 2]" 1
1849 1 93 LEU HB3 1 94 SER HA . . 4.380 4.272 4.087 4.397 0.017 14 0 "[ . 1 . 2]" 1
1850 1 93 LEU HB3 1 96 MET H . . 5.290 4.896 4.671 5.009 . 0 0 "[ . 1 . 2]" 1
1851 1 93 LEU QD 1 94 SER H . . 4.670 3.961 3.798 4.174 . 0 0 "[ . 1 . 2]" 1
1852 1 93 LEU QD 1 96 MET H . . 5.120 4.393 4.189 4.570 . 0 0 "[ . 1 . 2]" 1
1853 1 93 LEU QD 1 96 MET ME . . 2.660 2.083 1.713 2.359 . 0 0 "[ . 1 . 2]" 1
1854 1 93 LEU QD 1 96 MET HG2 . . 5.500 4.863 4.638 5.123 . 0 0 "[ . 1 . 2]" 1
1855 1 93 LEU QD 1 96 MET HG3 . . 4.690 3.655 3.370 4.091 . 0 0 "[ . 1 . 2]" 1
1856 1 93 LEU QD 1 102 PHE QE . . 3.620 2.068 1.841 2.451 . 0 0 "[ . 1 . 2]" 1
1857 1 93 LEU HG 1 94 SER H . . 4.640 4.526 4.252 4.784 0.144 4 0 "[ . 1 . 2]" 1
1858 1 94 SER H 1 94 SER HB2 . . 3.280 2.129 2.031 2.689 . 0 0 "[ . 1 . 2]" 1
1859 1 94 SER H 1 94 SER HB3 . . 3.480 3.075 2.331 3.278 . 0 0 "[ . 1 . 2]" 1
1860 1 94 SER H 1 95 ASP H . . 3.370 3.048 2.687 3.157 . 0 0 "[ . 1 . 2]" 1
1861 1 94 SER H 1 95 ASP HB2 . . 5.290 5.075 4.579 5.498 0.208 4 0 "[ . 1 . 2]" 1
1862 1 94 SER H 1 96 MET H . . 4.990 4.152 4.006 4.276 . 0 0 "[ . 1 . 2]" 1
1863 1 94 SER HA 1 94 SER HB2 . . 2.820 2.725 2.339 2.832 0.012 14 0 "[ . 1 . 2]" 1
1864 1 94 SER HA 1 94 SER HB3 . . 2.990 2.972 2.926 3.050 0.060 12 0 "[ . 1 . 2]" 1
1865 1 94 SER HA 1 96 MET H . . 4.550 4.373 3.571 4.571 0.021 17 0 "[ . 1 . 2]" 1
1866 1 94 SER HB2 1 95 ASP H . . 4.270 3.380 3.072 4.034 . 0 0 "[ . 1 . 2]" 1
1867 1 94 SER HB3 1 95 ASP H . . 4.270 2.600 2.302 3.447 . 0 0 "[ . 1 . 2]" 1
1868 1 95 ASP H 1 95 ASP HB2 . . 3.500 2.224 2.003 2.906 . 0 0 "[ . 1 . 2]" 1
1869 1 95 ASP H 1 95 ASP HB3 . . 3.720 2.923 2.366 3.452 . 0 0 "[ . 1 . 2]" 1
1870 1 95 ASP H 1 96 MET HB2 . . 5.450 4.832 3.896 5.043 . 0 0 "[ . 1 . 2]" 1
1871 1 95 ASP H 1 96 MET HG2 . . 4.920 4.868 4.466 4.952 0.032 19 0 "[ . 1 . 2]" 1
1872 1 95 ASP H 1 96 MET HG3 . . 4.690 4.217 3.520 4.432 . 0 0 "[ . 1 . 2]" 1
1873 1 95 ASP HB2 1 96 MET H . . 4.340 3.497 2.783 4.566 0.226 8 0 "[ . 1 . 2]" 1
1874 1 96 MET H 1 96 MET HB2 . . 3.260 2.514 2.471 2.610 . 0 0 "[ . 1 . 2]" 1
1875 1 96 MET H 1 96 MET HB3 . . 3.670 3.560 3.533 3.733 0.063 8 0 "[ . 1 . 2]" 1
1876 1 96 MET H 1 96 MET HG2 . . 4.020 2.835 2.458 3.890 . 0 0 "[ . 1 . 2]" 1
1877 1 96 MET H 1 96 MET HG3 . . 3.480 2.437 2.180 3.489 0.009 6 0 "[ . 1 . 2]" 1
1878 1 96 MET H 1 97 HIS H . . 4.580 4.603 4.424 4.642 0.062 16 0 "[ . 1 . 2]" 1
1879 1 96 MET H 1 100 LEU QD . . 5.270 4.176 4.037 4.347 . 0 0 "[ . 1 . 2]" 1
1880 1 96 MET HA 1 96 MET ME . . 4.270 4.334 4.263 4.370 0.100 4 0 "[ . 1 . 2]" 1
1881 1 96 MET HA 1 96 MET HG2 . . 3.500 2.442 2.242 2.524 . 0 0 "[ . 1 . 2]" 1
1882 1 96 MET HA 1 96 MET HG3 . . 3.850 3.519 3.296 3.666 . 0 0 "[ . 1 . 2]" 1
1883 1 96 MET HA 1 97 HIS H . . 3.000 2.489 2.332 2.637 . 0 0 "[ . 1 . 2]" 1
1884 1 96 MET HA 1 97 HIS HD2 . . 4.920 4.582 3.941 4.860 . 0 0 "[ . 1 . 2]" 1
1885 1 96 MET HA 1 100 LEU QD . . 4.380 3.780 3.603 3.922 . 0 0 "[ . 1 . 2]" 1
1886 1 96 MET HB2 1 97 HIS H . . 4.730 3.585 3.273 4.075 . 0 0 "[ . 1 . 2]" 1
1887 1 96 MET HB3 1 97 HIS H . . 4.200 2.534 2.239 2.913 . 0 0 "[ . 1 . 2]" 1
1888 1 96 MET HB3 1 100 LEU QD . . 3.330 2.001 1.834 2.138 . 0 0 "[ . 1 . 2]" 1
1889 1 96 MET ME 1 96 MET HG2 . . 3.680 3.372 3.363 3.386 . 0 0 "[ . 1 . 2]" 1
1890 1 96 MET ME 1 96 MET HG3 . . 3.180 2.524 2.479 2.598 . 0 0 "[ . 1 . 2]" 1
1891 1 96 MET ME 1 100 LEU HB3 . . 3.680 2.803 2.508 3.059 . 0 0 "[ . 1 . 2]" 1
1892 1 96 MET ME 1 100 LEU QD . . 3.390 1.812 1.663 1.938 . 0 0 "[ . 1 . 2]" 1
1893 1 96 MET HG2 1 97 HIS H . . 4.920 4.384 4.038 4.530 . 0 0 "[ . 1 . 2]" 1
1894 1 96 MET HG2 1 100 LEU QD . . 4.690 4.095 3.889 4.280 . 0 0 "[ . 1 . 2]" 1
1895 1 96 MET HG3 1 97 HIS H . . 5.170 5.119 4.954 5.197 0.027 8 0 "[ . 1 . 2]" 1
1896 1 96 MET HG3 1 100 LEU QD . . 4.920 3.816 3.615 3.938 . 0 0 "[ . 1 . 2]" 1
1897 1 97 HIS H 1 97 HIS HD2 . . 4.830 4.677 3.785 4.845 0.015 1 0 "[ . 1 . 2]" 1
1898 1 97 HIS H 1 98 GLY H . . 5.040 4.325 4.246 4.378 . 0 0 "[ . 1 . 2]" 1
1899 1 97 HIS H 1 100 LEU QD . . 5.110 2.716 2.220 3.284 . 0 0 "[ . 1 . 2]" 1
1900 1 97 HIS HB2 1 98 GLY H . . 3.870 2.723 2.133 3.574 . 0 0 "[ . 1 . 2]" 1
1901 1 97 HIS HB3 1 98 GLY H . . 3.750 3.416 2.485 3.708 . 0 0 "[ . 1 . 2]" 1
1902 1 98 GLY H 1 99 THR H . . 4.620 4.581 4.509 4.642 0.022 13 0 "[ . 1 . 2]" 1
1903 1 98 GLY H 1 100 LEU QD . . 4.920 3.414 3.209 3.701 . 0 0 "[ . 1 . 2]" 1
1904 1 98 GLY HA2 1 99 THR H . . 3.350 2.786 2.645 2.843 . 0 0 "[ . 1 . 2]" 1
1905 1 98 GLY HA3 1 99 THR H . . 3.350 2.467 2.420 2.593 . 0 0 "[ . 1 . 2]" 1
1906 1 99 THR H 1 99 THR HB . . 3.390 2.591 2.431 2.880 . 0 0 "[ . 1 . 2]" 1
1907 1 99 THR H 1 99 THR MG . . 4.100 3.639 3.495 3.682 . 0 0 "[ . 1 . 2]" 1
1908 1 99 THR H 1 100 LEU H . . 5.140 4.318 4.285 4.424 . 0 0 "[ . 1 . 2]" 1
1909 1 99 THR H 1 100 LEU QD . . 5.500 4.595 4.533 4.684 . 0 0 "[ . 1 . 2]" 1
1910 1 99 THR HA 1 99 THR MG . . 3.240 2.329 2.188 2.430 . 0 0 "[ . 1 . 2]" 1
1911 1 99 THR HA 1 100 LEU H . . 3.120 2.200 2.162 2.211 . 0 0 "[ . 1 . 2]" 1
1912 1 99 THR HA 1 100 LEU HB2 . . 5.260 4.961 4.886 5.038 . 0 0 "[ . 1 . 2]" 1
1913 1 99 THR HA 1 100 LEU QD . . 4.920 3.498 3.320 3.646 . 0 0 "[ . 1 . 2]" 1
1914 1 99 THR HA 1 100 LEU HG . . 4.920 3.879 3.731 3.974 . 0 0 "[ . 1 . 2]" 1
1915 1 99 THR HB 1 100 LEU H . . 5.160 4.482 4.362 4.562 . 0 0 "[ . 1 . 2]" 1
1916 1 99 THR MG 1 100 LEU H . . 3.650 3.443 3.263 3.661 0.011 16 0 "[ . 1 . 2]" 1
1917 1 100 LEU H 1 100 LEU HB2 . . 3.950 2.764 2.692 2.828 . 0 0 "[ . 1 . 2]" 1
1918 1 100 LEU H 1 100 LEU QD . . 4.380 2.187 2.001 2.364 . 0 0 "[ . 1 . 2]" 1
1919 1 100 LEU H 1 100 LEU HG . . 4.080 2.472 2.285 2.672 . 0 0 "[ . 1 . 2]" 1
1920 1 100 LEU H 1 101 THR H . . 5.500 4.548 4.502 4.591 . 0 0 "[ . 1 . 2]" 1
1921 1 100 LEU HA 1 100 LEU QD . . 3.620 3.127 3.062 3.180 . 0 0 "[ . 1 . 2]" 1
1922 1 100 LEU HA 1 100 LEU HG . . 4.180 2.793 2.737 2.872 . 0 0 "[ . 1 . 2]" 1
1923 1 100 LEU HA 1 101 THR H . . 3.050 2.245 2.214 2.329 . 0 0 "[ . 1 . 2]" 1
1924 1 100 LEU HB2 1 101 THR H . . 4.920 3.845 3.682 3.978 . 0 0 "[ . 1 . 2]" 1
1925 1 100 LEU HB2 1 102 PHE QD . . 5.260 3.309 3.121 3.570 . 0 0 "[ . 1 . 2]" 1
1926 1 100 LEU HB2 1 102 PHE QE . . 4.100 2.131 1.992 2.531 . 0 0 "[ . 1 . 2]" 1
1927 1 100 LEU HB2 1 102 PHE HZ . . 5.260 3.500 3.017 4.481 . 0 0 "[ . 1 . 2]" 1
1928 1 100 LEU HB3 1 101 THR H . . 4.160 3.161 2.880 3.292 . 0 0 "[ . 1 . 2]" 1
1929 1 100 LEU HB3 1 102 PHE QD . . 5.260 4.537 4.281 4.764 . 0 0 "[ . 1 . 2]" 1
1930 1 100 LEU HB3 1 102 PHE QE . . 4.100 3.779 3.583 3.986 . 0 0 "[ . 1 . 2]" 1
1931 1 100 LEU QD 1 101 THR H . . 4.560 4.266 4.083 4.302 . 0 0 "[ . 1 . 2]" 1
1932 1 100 LEU QD 1 102 PHE QE . . 3.620 2.192 1.954 2.643 . 0 0 "[ . 1 . 2]" 1
1933 1 100 LEU QD 1 102 PHE HZ . . 4.270 2.595 2.122 3.599 . 0 0 "[ . 1 . 2]" 1
1934 1 100 LEU HG 1 101 THR H . . 5.500 4.892 4.815 4.959 . 0 0 "[ . 1 . 2]" 1
1935 1 100 LEU HG 1 102 PHE QE . . 4.920 4.391 4.131 4.922 0.002 12 0 "[ . 1 . 2]" 1
1936 1 101 THR H 1 101 THR HB . . 3.580 2.346 2.131 2.520 . 0 0 "[ . 1 . 2]" 1
1937 1 101 THR H 1 101 THR MG . . 4.350 3.708 3.526 3.762 . 0 0 "[ . 1 . 2]" 1
1938 1 101 THR H 1 102 PHE H . . 5.260 4.268 4.166 4.400 . 0 0 "[ . 1 . 2]" 1
1939 1 101 THR HA 1 101 THR MG . . 3.330 2.417 2.264 2.666 . 0 0 "[ . 1 . 2]" 1
1940 1 101 THR HA 1 102 PHE H . . 3.140 2.185 2.153 2.200 . 0 0 "[ . 1 . 2]" 1
1941 1 101 THR HA 1 102 PHE HB2 . . 5.260 4.343 4.188 4.428 . 0 0 "[ . 1 . 2]" 1
1942 1 101 THR HA 1 102 PHE QD . . 4.690 3.503 3.231 3.968 . 0 0 "[ . 1 . 2]" 1
1943 1 101 THR HB 1 102 PHE H . . 4.920 4.579 4.438 4.698 . 0 0 "[ . 1 . 2]" 1
1944 1 101 THR MG 1 102 PHE H . . 3.680 3.319 3.119 3.475 . 0 0 "[ . 1 . 2]" 1
1945 1 102 PHE H 1 102 PHE HB2 . . 3.730 2.182 2.037 2.263 . 0 0 "[ . 1 . 2]" 1
1946 1 102 PHE H 1 102 PHE QD . . 4.010 2.199 2.026 2.630 . 0 0 "[ . 1 . 2]" 1
1947 1 102 PHE H 1 102 PHE QE . . 5.490 4.500 4.332 4.918 . 0 0 "[ . 1 . 2]" 1
1948 1 102 PHE H 1 103 VAL H . . 5.280 4.464 4.427 4.522 . 0 0 "[ . 1 . 2]" 1
1949 1 102 PHE HA 1 102 PHE QD . . 4.270 3.128 3.060 3.166 . 0 0 "[ . 1 . 2]" 1
1950 1 102 PHE HA 1 103 VAL H . . 3.080 2.194 2.193 2.198 . 0 0 "[ . 1 . 2]" 1
1951 1 102 PHE HA 1 103 VAL HB . . 4.920 4.699 4.528 4.817 . 0 0 "[ . 1 . 2]" 1
1952 1 102 PHE HA 1 103 VAL MG2 . . 3.960 3.574 3.443 3.832 . 0 0 "[ . 1 . 2]" 1
1953 1 102 PHE HB2 1 103 VAL H . . 4.730 4.459 4.398 4.562 . 0 0 "[ . 1 . 2]" 1
1954 1 102 PHE HB2 1 104 LEU MD1 . . 4.180 4.194 4.179 4.214 0.034 18 0 "[ . 1 . 2]" 1
1955 1 102 PHE HB2 1 104 LEU MD2 . . 3.960 3.321 3.027 3.725 . 0 0 "[ . 1 . 2]" 1
1956 1 102 PHE HB2 1 104 LEU HG . . 4.690 3.976 3.811 4.209 . 0 0 "[ . 1 . 2]" 1
1957 1 102 PHE HB3 1 103 VAL H . . 4.250 3.637 3.528 3.718 . 0 0 "[ . 1 . 2]" 1
1958 1 102 PHE HB3 1 104 LEU MD2 . . 3.560 2.019 1.848 2.275 . 0 0 "[ . 1 . 2]" 1
1959 1 102 PHE HB3 1 104 LEU HG . . 4.520 2.901 2.696 3.076 . 0 0 "[ . 1 . 2]" 1
1960 1 102 PHE QD 1 103 VAL H . . 5.200 4.471 4.215 4.587 . 0 0 "[ . 1 . 2]" 1
1961 1 102 PHE QD 1 104 LEU MD1 . . 5.260 4.651 4.121 4.924 . 0 0 "[ . 1 . 2]" 1
1962 1 102 PHE QD 1 104 LEU MD2 . . 3.900 2.506 1.945 2.856 . 0 0 "[ . 1 . 2]" 1
1963 1 103 VAL H 1 103 VAL HB . . 3.580 2.571 2.434 2.676 . 0 0 "[ . 1 . 2]" 1
1964 1 103 VAL H 1 103 VAL MG1 . . 4.380 3.804 3.756 3.839 . 0 0 "[ . 1 . 2]" 1
1965 1 103 VAL H 1 103 VAL MG2 . . 3.550 2.508 2.350 2.751 . 0 0 "[ . 1 . 2]" 1
1966 1 103 VAL H 1 104 LEU H . . 5.110 4.063 4.017 4.134 . 0 0 "[ . 1 . 2]" 1
1967 1 103 VAL HA 1 103 VAL MG1 . . 3.390 2.290 2.131 2.456 . 0 0 "[ . 1 . 2]" 1
1968 1 103 VAL HA 1 103 VAL MG2 . . 3.330 2.417 2.252 2.506 . 0 0 "[ . 1 . 2]" 1
1969 1 103 VAL HA 1 104 LEU H . . 3.140 2.254 2.224 2.264 . 0 0 "[ . 1 . 2]" 1
1970 1 103 VAL HA 1 104 LEU HB3 . . 5.260 5.159 5.117 5.236 . 0 0 "[ . 1 . 2]" 1
1971 1 103 VAL HA 1 104 LEU HG . . 4.270 3.650 3.574 3.699 . 0 0 "[ . 1 . 2]" 1
1972 1 103 VAL HB 1 104 LEU H . . 5.270 4.484 4.436 4.559 . 0 0 "[ . 1 . 2]" 1
1973 1 103 VAL MG1 1 104 LEU H . . 3.720 3.372 3.223 3.431 . 0 0 "[ . 1 . 2]" 1
1974 1 103 VAL MG2 1 104 LEU H . . 4.380 4.327 4.222 4.383 0.003 1 0 "[ . 1 . 2]" 1
1975 1 104 LEU H 1 104 LEU HB3 . . 4.100 3.577 3.532 3.644 . 0 0 "[ . 1 . 2]" 1
1976 1 104 LEU H 1 104 LEU MD1 . . 3.900 3.052 2.738 3.306 . 0 0 "[ . 1 . 2]" 1
1977 1 104 LEU H 1 104 LEU MD2 . . 3.980 3.666 3.396 3.870 . 0 0 "[ . 1 . 2]" 1
1978 1 104 LEU H 1 104 LEU HG . . 3.430 2.042 1.920 2.197 . 0 0 "[ . 1 . 2]" 1
1979 1 104 LEU HA 1 104 LEU MD1 . . 4.030 3.842 3.697 3.983 . 0 0 "[ . 1 . 2]" 1
1980 1 104 LEU HA 1 105 ILE H . . 3.130 2.446 2.389 2.555 . 0 0 "[ . 1 . 2]" 1
1981 1 104 LEU HB2 1 104 LEU MD1 . . 3.390 2.175 2.027 2.264 . 0 0 "[ . 1 . 2]" 1
1982 1 104 LEU HB2 1 104 LEU MD2 . . 3.560 2.789 2.662 2.909 . 0 0 "[ . 1 . 2]" 1
1983 1 104 LEU HB2 1 105 ILE H . . 4.030 2.589 2.322 2.750 . 0 0 "[ . 1 . 2]" 1
1984 1 104 LEU HB3 1 104 LEU MD2 . . 3.590 2.103 2.033 2.157 . 0 0 "[ . 1 . 2]" 1
1985 1 104 LEU HB3 1 105 ILE H . . 4.140 3.519 3.414 3.580 . 0 0 "[ . 1 . 2]" 1
1986 1 104 LEU MD1 1 106 PRO HA . . 4.270 4.148 3.970 4.295 0.025 12 0 "[ . 1 . 2]" 1
1987 1 104 LEU MD1 1 106 PRO HB3 . . 4.920 4.360 4.089 4.554 . 0 0 "[ . 1 . 2]" 1
1988 1 104 LEU MD1 1 106 PRO HD3 . . 4.520 3.926 3.618 4.269 . 0 0 "[ . 1 . 2]" 1
1989 1 104 LEU MD1 1 106 PRO HG3 . . 4.920 4.739 4.413 4.989 0.069 14 0 "[ . 1 . 2]" 1
1990 1 105 ILE H 1 105 ILE HB . . 3.690 2.592 2.529 2.780 . 0 0 "[ . 1 . 2]" 1
1991 1 105 ILE H 1 105 ILE MD . . 4.050 3.273 2.814 4.021 . 0 0 "[ . 1 . 2]" 1
1992 1 105 ILE H 1 105 ILE HG12 . . 4.100 3.887 3.464 4.129 0.029 18 0 "[ . 1 . 2]" 1
1993 1 105 ILE H 1 105 ILE HG13 . . 4.920 2.537 2.275 2.797 . 0 0 "[ . 1 . 2]" 1
1994 1 105 ILE H 1 105 ILE MG . . 4.380 3.819 3.794 3.894 . 0 0 "[ . 1 . 2]" 1
1995 1 105 ILE H 1 106 PRO HD3 . . 5.340 4.480 4.387 4.549 . 0 0 "[ . 1 . 2]" 1
1996 1 105 ILE HA 1 105 ILE MD . . 3.900 3.886 3.821 3.928 0.028 10 0 "[ . 1 . 2]" 1
1997 1 105 ILE HA 1 105 ILE HG12 . . 4.100 2.916 2.654 3.133 . 0 0 "[ . 1 . 2]" 1
1998 1 105 ILE HA 1 105 ILE HG13 . . 3.960 2.819 2.539 3.347 . 0 0 "[ . 1 . 2]" 1
1999 1 105 ILE HA 1 105 ILE MG . . 3.210 2.391 2.305 2.427 . 0 0 "[ . 1 . 2]" 1
2000 1 105 ILE HA 1 106 PRO HD2 . . 3.210 2.355 2.301 2.413 . 0 0 "[ . 1 . 2]" 1
2001 1 105 ILE HA 1 106 PRO HD3 . . 3.190 1.919 1.909 1.938 . 0 0 "[ . 1 . 2]" 1
2002 1 105 ILE HA 1 106 PRO HG2 . . 4.690 4.400 4.372 4.431 . 0 0 "[ . 1 . 2]" 1
2003 1 105 ILE HA 1 106 PRO HG3 . . 4.920 4.180 4.176 4.189 . 0 0 "[ . 1 . 2]" 1
2004 1 105 ILE HB 1 105 ILE MD . . 3.210 2.154 1.949 2.441 . 0 0 "[ . 1 . 2]" 1
2005 1 105 ILE MD 1 105 ILE MG . . 2.830 2.379 1.888 2.743 . 0 0 "[ . 1 . 2]" 1
2006 1 105 ILE HG12 1 105 ILE MG . . 3.720 2.198 2.021 2.456 . 0 0 "[ . 1 . 2]" 1
2007 1 105 ILE MG 1 106 PRO HD2 . . 3.500 2.106 1.967 2.262 . 0 0 "[ . 1 . 2]" 1
2008 1 105 ILE MG 1 106 PRO HD3 . . 3.850 3.178 3.055 3.306 . 0 0 "[ . 1 . 2]" 1
2009 1 106 PRO HA 1 107 SER H . . 2.950 2.150 2.148 2.159 . 0 0 "[ . 1 . 2]" 1
2010 1 106 PRO HB2 1 107 SER H . . 4.120 3.865 3.818 3.963 . 0 0 "[ . 1 . 2]" 1
2011 1 106 PRO HB2 1 108 SER H . . 4.750 3.618 2.702 3.988 . 0 0 "[ . 1 . 2]" 1
2012 1 106 PRO HB3 1 107 SER H . . 4.100 4.129 4.092 4.206 0.106 11 0 "[ . 1 . 2]" 1
2013 1 106 PRO HB3 1 108 SER H . . 5.500 5.165 4.137 5.528 0.028 11 0 "[ . 1 . 2]" 1
2014 1 107 SER H 1 107 SER HB2 . . 3.480 2.706 2.228 2.884 . 0 0 "[ . 1 . 2]" 1
2015 1 107 SER H 1 107 SER HB3 . . 3.410 2.345 2.168 3.000 . 0 0 "[ . 1 . 2]" 1
2016 1 107 SER H 1 108 SER H . . 4.370 3.831 3.090 4.042 . 0 0 "[ . 1 . 2]" 1
2017 1 107 SER HA 1 108 SER H . . 3.100 2.490 2.366 2.876 . 0 0 "[ . 1 . 2]" 1
2018 1 107 SER HA 1 109 GLY H . . 4.400 4.013 3.798 4.261 . 0 0 "[ . 1 . 2]" 1
2019 1 107 SER HB3 1 108 SER H . . 4.610 4.556 4.279 4.613 0.003 11 0 "[ . 1 . 2]" 1
2020 1 107 SER HB3 1 109 GLY H . . 4.020 3.986 3.335 4.088 0.068 11 0 "[ . 1 . 2]" 1
2021 1 108 SER H 1 108 SER HB2 . . 3.700 2.655 2.116 3.468 . 0 0 "[ . 1 . 2]" 1
2022 1 108 SER H 1 108 SER HB3 . . 4.030 3.530 2.705 3.988 . 0 0 "[ . 1 . 2]" 1
2023 1 108 SER H 1 109 GLY H . . 3.530 3.197 2.614 3.568 0.038 8 0 "[ . 1 . 2]" 1
2024 1 108 SER HA 1 109 GLY H . . 3.410 2.895 2.656 3.474 0.064 17 0 "[ . 1 . 2]" 1
2025 1 108 SER HB2 1 109 GLY H . . 4.690 4.400 3.969 4.703 0.013 8 0 "[ . 1 . 2]" 1
2026 1 109 GLY H 1 110 PRO HD3 . . 4.520 3.881 2.583 4.773 0.253 14 0 "[ . 1 . 2]" 1
2027 1 110 PRO HA 1 111 SER H . . 3.420 2.361 2.148 3.492 0.072 14 0 "[ . 1 . 2]" 1
2028 1 110 PRO HB3 1 111 SER H . . 4.710 4.202 3.339 4.647 . 0 0 "[ . 1 . 2]" 1
2029 1 110 PRO HD2 1 111 SER H . . 5.420 4.923 2.255 5.411 . 0 0 "[ . 1 . 2]" 1
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