NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
499567 |
2l9d   |
17448 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l9d
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 2202
_Distance_constraint_stats_list.Viol_count 3884
_Distance_constraint_stats_list.Viol_total 6324.300
_Distance_constraint_stats_list.Viol_max 0.927
_Distance_constraint_stats_list.Viol_rms 0.0372
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0072
_Distance_constraint_stats_list.Viol_average_violations_only 0.0814
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 GLY 0.166 0.079 12 0 "[ . 1 . 2]"
1 4 THR 0.905 0.093 5 0 "[ . 1 . 2]"
1 5 THR 3.119 0.107 12 0 "[ . 1 . 2]"
1 6 GLU 6.742 0.634 14 1 "[ . 1 +. 2]"
1 7 LYS 2.253 0.371 7 0 "[ . 1 . 2]"
1 8 SER 0.673 0.132 11 0 "[ . 1 . 2]"
1 9 GLY 1.119 0.081 18 0 "[ . 1 . 2]"
1 10 ILE 10.021 0.822 18 4 "[ - . * 1 . *+ 2]"
1 11 LYS 11.514 0.845 18 4 "[ - . * 1 . *+ 2]"
1 12 GLU 6.672 0.133 9 0 "[ . 1 . 2]"
1 13 ILE 7.154 0.402 7 0 "[ . 1 . 2]"
1 14 ILE 12.524 0.496 3 0 "[ . 1 . 2]"
1 15 ILE 5.196 0.101 7 0 "[ . 1 . 2]"
1 16 GLN 6.706 0.496 3 0 "[ . 1 . 2]"
1 17 GLY 4.534 0.721 2 3 "[ + . * - . 2]"
1 18 LEU 4.062 0.213 3 0 "[ . 1 . 2]"
1 19 THR 6.260 0.135 20 0 "[ . 1 . 2]"
1 20 ARG 12.834 0.927 16 3 "[ - 1 .+ *]"
1 21 ALA 3.285 0.105 19 0 "[ . 1 . 2]"
1 22 GLY 1.095 0.075 19 0 "[ . 1 . 2]"
1 23 LYS 7.227 0.144 15 0 "[ . 1 . 2]"
1 24 PRO 2.589 0.082 9 0 "[ . 1 . 2]"
1 25 PHE 6.074 0.836 18 2 "[ . 1 - + 2]"
1 26 ARG 4.756 0.836 18 2 "[ . 1 - + 2]"
1 27 PRO 2.780 0.518 15 1 "[ . 1 + 2]"
1 28 SER 0.811 0.101 4 0 "[ . 1 . 2]"
1 29 ASP 1.404 0.552 14 1 "[ . 1 +. 2]"
1 30 TRP 11.463 0.823 4 1 "[ +. 1 . 2]"
1 31 VAL 4.144 0.111 12 0 "[ . 1 . 2]"
1 32 ASP 10.619 0.750 8 5 "[* .* + 1 *. * 2]"
1 33 ARG 5.582 0.579 6 2 "[ .+ - 1 . 2]"
1 34 MET 11.778 0.750 8 3 "[ .* + 1 . - 2]"
1 35 CYS 3.512 0.692 1 1 "[+ . 1 . 2]"
1 36 SER 6.817 0.645 13 1 "[ . 1 + . 2]"
1 37 THR 5.591 0.645 13 1 "[ . 1 + . 2]"
1 38 TYR 3.919 0.144 13 0 "[ . 1 . 2]"
1 39 ALA 3.413 0.101 4 0 "[ . 1 . 2]"
1 40 SER 3.454 0.089 17 0 "[ . 1 . 2]"
1 41 PHE 2.396 0.098 8 0 "[ . 1 . 2]"
1 42 GLY 2.626 0.770 20 1 "[ . 1 . +]"
1 43 ALA 1.056 0.123 20 0 "[ . 1 . 2]"
1 44 ASP 4.290 0.770 20 1 "[ . 1 . +]"
1 45 ARG 3.267 0.411 3 0 "[ . 1 . 2]"
1 46 LYS 4.325 0.757 18 2 "[ . - 1 . + 2]"
1 47 LEU 3.669 0.757 18 2 "[ . - 1 . + 2]"
1 48 ARG 4.345 0.102 19 0 "[ . 1 . 2]"
1 49 TYR 3.770 0.102 19 0 "[ . 1 . 2]"
1 50 SER 3.429 0.096 15 0 "[ . 1 . 2]"
1 51 PRO 1.905 0.096 15 0 "[ . 1 . 2]"
1 52 TYR 5.845 0.635 15 1 "[ . 1 + 2]"
1 53 LEU 3.432 0.643 2 1 "[ + . 1 . 2]"
1 54 LYS 3.780 0.643 2 1 "[ + . 1 . 2]"
1 55 PRO 1.920 0.183 13 0 "[ . 1 . 2]"
1 56 ARG 3.889 0.109 12 0 "[ . 1 . 2]"
1 57 VAL 9.902 0.771 9 7 "[ *- . *+1* * *]"
1 58 ILE 17.690 0.771 9 12 "[*** .* *+1* *- ***]"
1 59 GLU 2.236 0.373 11 0 "[ . 1 . 2]"
1 60 GLY 0.387 0.074 5 0 "[ . 1 . 2]"
1 61 VAL 2.485 0.102 5 0 "[ . 1 . 2]"
1 62 ARG 4.327 0.333 9 0 "[ . 1 . 2]"
1 63 CYS 7.441 0.585 19 5 "[* .* 1 .- *+2]"
1 64 LEU 2.942 0.111 12 0 "[ . 1 . 2]"
1 65 ALA 8.194 0.887 7 1 "[ . + 1 . 2]"
1 66 VAL 5.089 0.887 7 1 "[ . + 1 . 2]"
1 67 ASP 5.733 0.635 15 1 "[ . 1 + 2]"
1 68 LEU 9.152 0.119 10 0 "[ . 1 . 2]"
1 69 LYS 7.601 0.087 8 0 "[ . 1 . 2]"
1 70 LEU 7.901 0.319 7 0 "[ . 1 . 2]"
1 71 LYS 8.257 0.105 3 0 "[ . 1 . 2]"
1 72 ASP 3.310 0.088 19 0 "[ . 1 . 2]"
1 73 THR 4.222 0.109 7 0 "[ . 1 . 2]"
1 74 ASN 4.272 0.805 7 1 "[ . + 1 . 2]"
1 75 PRO 4.528 0.098 3 0 "[ . 1 . 2]"
1 76 GLU 13.549 0.805 7 7 "[* * + 1 ** - *2]"
1 77 GLY 0.997 0.070 4 0 "[ . 1 . 2]"
1 78 PHE 9.558 0.238 12 0 "[ . 1 . 2]"
1 79 ASN 12.492 0.742 14 6 "[* * 1 +* - *2]"
1 80 GLN 3.723 0.093 5 0 "[ . 1 . 2]"
1 81 LEU 7.062 0.468 13 0 "[ . 1 . 2]"
1 82 MET 14.259 0.501 17 1 "[ . 1 . + 2]"
1 83 HIS 4.177 0.084 13 0 "[ . 1 . 2]"
1 84 PHE 5.135 0.823 4 1 "[ +. 1 . 2]"
1 85 ALA 2.551 0.098 2 0 "[ . 1 . 2]"
1 86 THR 1.229 0.088 6 0 "[ . 1 . 2]"
1 87 GLU 4.270 0.090 4 0 "[ . 1 . 2]"
1 88 ASN 3.463 0.114 10 0 "[ . 1 . 2]"
1 89 GLN 9.497 0.927 16 3 "[ - 1 .+ *]"
1 90 LEU 9.767 0.721 2 3 "[ + . * - . 2]"
1 91 ASN 6.473 0.517 10 1 "[ . + . 2]"
1 92 ILE 5.680 0.122 19 0 "[ . 1 . 2]"
1 93 LEU 5.485 0.098 1 0 "[ . 1 . 2]"
1 94 ASP 1.672 0.096 16 0 "[ . 1 . 2]"
1 95 ALA 2.313 0.382 13 0 "[ . 1 . 2]"
1 96 GLU 4.408 0.099 11 0 "[ . 1 . 2]"
1 97 GLY 3.913 0.100 19 0 "[ . 1 . 2]"
1 98 ASN 3.568 0.086 7 0 "[ . 1 . 2]"
1 99 SER 3.471 0.098 1 0 "[ . 1 . 2]"
1 100 ILE 3.910 0.113 9 0 "[ . 1 . 2]"
1 101 ASP 4.522 0.101 16 0 "[ . 1 . 2]"
1 102 ALA 5.242 0.125 12 0 "[ . 1 . 2]"
1 103 ALA 3.413 0.105 16 0 "[ . 1 . 2]"
1 104 GLN 7.426 0.113 9 0 "[ . 1 . 2]"
1 105 VAL 13.796 0.873 1 3 "[+ . * - . 2]"
1 106 THR 7.530 0.122 13 0 "[ . 1 . 2]"
1 107 GLU 6.421 0.641 17 4 "[ * . -1 * . + 2]"
1 108 ILE 10.770 0.873 1 3 "[+ . * - . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 GLY H 1 4 THR H . . 5.090 3.731 2.155 4.660 . 0 0 "[ . 1 . 2]" 1
2 1 3 GLY QA 1 4 THR H . . 3.380 2.290 2.055 2.744 . 0 0 "[ . 1 . 2]" 1
3 1 3 GLY QA 1 4 THR HA . . 4.140 4.048 3.882 4.212 0.072 4 0 "[ . 1 . 2]" 1
4 1 3 GLY QA 1 4 THR MG . . 5.090 3.613 2.520 4.313 . 0 0 "[ . 1 . 2]" 1
5 1 3 GLY QA 1 5 THR H . . 5.410 3.973 2.825 5.489 0.079 12 0 "[ . 1 . 2]" 1
6 1 4 THR H 1 4 THR HB . . 4.140 3.484 2.343 4.012 . 0 0 "[ . 1 . 2]" 1
7 1 4 THR H 1 4 THR MG . . 4.720 2.735 2.073 3.784 . 0 0 "[ . 1 . 2]" 1
8 1 4 THR H 1 5 THR H . . 3.970 3.035 1.749 4.060 0.090 16 0 "[ . 1 . 2]" 1
9 1 4 THR H 1 6 GLU H . . 5.500 4.952 3.353 5.585 0.085 1 0 "[ . 1 . 2]" 1
10 1 4 THR HA 1 4 THR HB . . 2.640 2.521 2.416 2.728 0.088 8 0 "[ . 1 . 2]" 1
11 1 4 THR HA 1 5 THR H . . 3.360 2.749 2.027 3.453 0.093 5 0 "[ . 1 . 2]" 1
12 1 4 THR HB 1 5 THR H . . 4.830 4.261 3.472 4.570 . 0 0 "[ . 1 . 2]" 1
13 1 5 THR H 1 5 THR HB . . 3.700 3.234 2.286 3.770 0.070 6 0 "[ . 1 . 2]" 1
14 1 5 THR H 1 5 THR MG . . 4.420 3.325 2.006 4.085 . 0 0 "[ . 1 . 2]" 1
15 1 5 THR H 1 6 GLU H . . 3.640 2.750 1.678 3.724 0.084 19 0 "[ . 1 . 2]" 1
16 1 5 THR HA 1 5 THR HB . . 2.910 2.733 2.413 2.992 0.082 5 0 "[ . 1 . 2]" 1
17 1 5 THR HA 1 6 GLU H . . 3.080 2.794 2.162 3.170 0.090 7 0 "[ . 1 . 2]" 1
18 1 5 THR HA 1 6 GLU QG . . 5.070 4.551 3.776 5.174 0.104 14 0 "[ . 1 . 2]" 1
19 1 5 THR HB 1 6 GLU H . . 4.360 4.269 3.601 4.446 0.086 17 0 "[ . 1 . 2]" 1
20 1 5 THR MG 1 6 GLU H . . 4.910 4.062 3.303 4.492 . 0 0 "[ . 1 . 2]" 1
21 1 5 THR MG 1 6 GLU HA . . 5.500 4.858 3.738 5.607 0.107 12 0 "[ . 1 . 2]" 1
22 1 6 GLU H 1 6 GLU HB2 . . 3.410 3.241 2.255 4.044 0.634 14 1 "[ . 1 +. 2]" 1
23 1 6 GLU H 1 6 GLU HB3 . . 4.010 3.349 2.533 4.003 . 0 0 "[ . 1 . 2]" 1
24 1 6 GLU H 1 6 GLU QG . . 4.710 2.612 1.839 3.693 . 0 0 "[ . 1 . 2]" 1
25 1 6 GLU H 1 6 GLU HG3 . . 4.260 3.296 2.473 4.699 0.439 3 0 "[ . 1 . 2]" 1
26 1 6 GLU HA 1 6 GLU QG . . 3.900 2.919 2.177 3.493 . 0 0 "[ . 1 . 2]" 1
27 1 6 GLU HA 1 7 LYS H . . 2.850 2.379 2.117 2.926 0.076 11 0 "[ . 1 . 2]" 1
28 1 6 GLU HB3 1 7 LYS H . . 4.140 3.816 1.994 4.511 0.371 7 0 "[ . 1 . 2]" 1
29 1 7 LYS H 1 7 LYS QB . . 3.370 2.785 2.256 3.237 . 0 0 "[ . 1 . 2]" 1
30 1 7 LYS H 1 7 LYS QG . . 4.660 2.704 1.994 3.889 . 0 0 "[ . 1 . 2]" 1
31 1 7 LYS H 1 7 LYS HG3 . . 4.020 3.369 2.439 4.306 0.286 1 0 "[ . 1 . 2]" 1
32 1 7 LYS HA 1 7 LYS QG . . 3.800 2.942 2.217 3.473 . 0 0 "[ . 1 . 2]" 1
33 1 7 LYS HA 1 8 SER H . . 3.000 2.361 2.166 2.816 . 0 0 "[ . 1 . 2]" 1
34 1 7 LYS HA 1 108 ILE MD . . 5.140 4.783 3.516 5.254 0.114 14 0 "[ . 1 . 2]" 1
35 1 7 LYS QB 1 8 SER H . . 3.870 2.887 1.968 3.736 . 0 0 "[ . 1 . 2]" 1
36 1 7 LYS QB 1 8 SER HA . . 5.060 4.315 3.725 4.858 . 0 0 "[ . 1 . 2]" 1
37 1 7 LYS HG3 1 8 SER H . . 5.500 4.270 2.888 5.632 0.132 11 0 "[ . 1 . 2]" 1
38 1 8 SER H 1 8 SER QB . . 3.320 2.717 2.447 2.971 . 0 0 "[ . 1 . 2]" 1
39 1 8 SER HA 1 8 SER QB . . 2.780 2.397 2.127 2.573 . 0 0 "[ . 1 . 2]" 1
40 1 8 SER HA 1 9 GLY H . . 3.150 2.732 2.355 3.224 0.074 17 0 "[ . 1 . 2]" 1
41 1 8 SER HA 1 10 ILE H . . 4.640 4.478 4.158 4.720 0.080 5 0 "[ . 1 . 2]" 1
42 1 8 SER HA 1 10 ILE MD . . 5.500 4.938 4.455 5.514 0.014 1 0 "[ . 1 . 2]" 1
43 1 8 SER QB 1 10 ILE H . . 5.450 2.986 2.135 3.857 . 0 0 "[ . 1 . 2]" 1
44 1 8 SER QB 1 10 ILE HB . . 5.130 3.893 2.899 5.025 . 0 0 "[ . 1 . 2]" 1
45 1 8 SER QB 1 10 ILE MD . . 5.230 2.570 2.121 3.234 . 0 0 "[ . 1 . 2]" 1
46 1 8 SER QB 1 10 ILE HG12 . . 5.240 3.673 2.422 4.689 . 0 0 "[ . 1 . 2]" 1
47 1 8 SER QB 1 10 ILE HG13 . . 5.310 2.397 2.070 3.300 . 0 0 "[ . 1 . 2]" 1
48 1 8 SER QB 1 10 ILE MG . . 5.070 4.566 4.025 4.975 . 0 0 "[ . 1 . 2]" 1
49 1 9 GLY H 1 10 ILE H . . 3.440 2.708 2.107 3.305 . 0 0 "[ . 1 . 2]" 1
50 1 9 GLY H 1 10 ILE HB . . 5.430 4.916 4.044 5.476 0.046 19 0 "[ . 1 . 2]" 1
51 1 9 GLY H 1 10 ILE MD . . 5.500 4.517 3.933 5.162 . 0 0 "[ . 1 . 2]" 1
52 1 9 GLY H 1 10 ILE HG12 . . 5.340 4.830 4.268 5.358 0.018 20 0 "[ . 1 . 2]" 1
53 1 9 GLY H 1 10 ILE HG13 . . 5.490 3.341 2.701 3.916 . 0 0 "[ . 1 . 2]" 1
54 1 9 GLY HA2 1 10 ILE H . . 2.980 2.963 2.766 3.061 0.081 18 0 "[ . 1 . 2]" 1
55 1 9 GLY HA2 1 10 ILE HB . . 5.500 5.171 4.945 5.547 0.047 7 0 "[ . 1 . 2]" 1
56 1 9 GLY HA2 1 10 ILE HG13 . . 5.070 4.846 4.521 5.111 0.041 8 0 "[ . 1 . 2]" 1
57 1 9 GLY HA2 1 11 LYS QE . . 5.460 4.152 3.309 5.529 0.069 3 0 "[ . 1 . 2]" 1
58 1 9 GLY HA3 1 10 ILE HG13 . . 5.110 4.836 4.587 5.143 0.033 1 0 "[ . 1 . 2]" 1
59 1 9 GLY HA3 1 11 LYS QE . . 5.500 4.354 3.243 5.425 . 0 0 "[ . 1 . 2]" 1
60 1 10 ILE H 1 10 ILE HB . . 2.900 2.416 2.180 2.766 . 0 0 "[ . 1 . 2]" 1
61 1 10 ILE H 1 10 ILE MD . . 3.660 3.369 2.976 3.734 0.074 10 0 "[ . 1 . 2]" 1
62 1 10 ILE H 1 10 ILE HG12 . . 3.530 3.476 3.115 3.609 0.079 9 0 "[ . 1 . 2]" 1
63 1 10 ILE H 1 10 ILE HG13 . . 3.360 2.148 1.809 2.443 . 0 0 "[ . 1 . 2]" 1
64 1 10 ILE H 1 10 ILE MG . . 3.690 3.715 3.614 3.766 0.076 15 0 "[ . 1 . 2]" 1
65 1 10 ILE H 1 11 LYS H . . 4.530 4.566 4.472 4.610 0.080 5 0 "[ . 1 . 2]" 1
66 1 10 ILE H 1 11 LYS QD . . 5.500 5.082 3.659 5.583 0.083 18 0 "[ . 1 . 2]" 1
67 1 10 ILE HA 1 10 ILE HG12 . . 3.640 2.661 2.356 2.953 . 0 0 "[ . 1 . 2]" 1
68 1 10 ILE HA 1 10 ILE HG13 . . 3.670 2.942 2.735 3.285 . 0 0 "[ . 1 . 2]" 1
69 1 10 ILE HA 1 10 ILE MG . . 3.230 2.439 2.138 2.570 . 0 0 "[ . 1 . 2]" 1
70 1 10 ILE HA 1 11 LYS H . . 2.670 2.197 2.147 2.253 . 0 0 "[ . 1 . 2]" 1
71 1 10 ILE HA 1 11 LYS HA . . 4.520 4.468 4.420 4.509 . 0 0 "[ . 1 . 2]" 1
72 1 10 ILE HA 1 11 LYS HB2 . . 4.880 4.853 4.085 5.702 0.822 18 4 "[ - . * 1 . *+ 2]" 1
73 1 10 ILE HA 1 12 GLU H . . 3.940 3.830 3.550 4.026 0.086 7 0 "[ . 1 . 2]" 1
74 1 10 ILE HB 1 10 ILE MD . . 3.190 2.380 2.249 2.544 . 0 0 "[ . 1 . 2]" 1
75 1 10 ILE HB 1 11 LYS H . . 4.410 4.159 3.522 4.410 . 0 0 "[ . 1 . 2]" 1
76 1 10 ILE HB 1 12 GLU H . . 4.870 4.281 3.641 4.776 . 0 0 "[ . 1 . 2]" 1
77 1 10 ILE MD 1 11 LYS H . . 5.290 5.174 4.915 5.390 0.100 4 0 "[ . 1 . 2]" 1
78 1 10 ILE MD 1 94 ASP HA . . 4.660 4.238 3.452 4.749 0.089 3 0 "[ . 1 . 2]" 1
79 1 10 ILE MD 1 94 ASP QB . . 4.300 2.559 2.032 3.356 . 0 0 "[ . 1 . 2]" 1
80 1 10 ILE HG12 1 10 ILE MG . . 3.100 2.323 2.146 2.506 . 0 0 "[ . 1 . 2]" 1
81 1 10 ILE HG12 1 11 LYS H . . 4.710 4.441 4.003 4.703 . 0 0 "[ . 1 . 2]" 1
82 1 10 ILE HG12 1 12 GLU H . . 5.360 5.058 4.570 5.450 0.090 3 0 "[ . 1 . 2]" 1
83 1 10 ILE HG13 1 10 ILE MG . . 3.420 3.209 3.166 3.253 . 0 0 "[ . 1 . 2]" 1
84 1 10 ILE HG13 1 11 LYS H . . 5.020 4.986 4.789 5.095 0.075 15 0 "[ . 1 . 2]" 1
85 1 10 ILE MG 1 11 LYS H . . 3.700 2.605 2.067 3.055 . 0 0 "[ . 1 . 2]" 1
86 1 10 ILE MG 1 11 LYS HA . . 4.510 3.631 3.292 3.953 . 0 0 "[ . 1 . 2]" 1
87 1 10 ILE MG 1 11 LYS QE . . 5.500 5.408 4.849 5.617 0.117 9 0 "[ . 1 . 2]" 1
88 1 10 ILE MG 1 12 GLU H . . 3.570 1.994 1.628 2.376 . 0 0 "[ . 1 . 2]" 1
89 1 10 ILE MG 1 12 GLU HA . . 5.190 4.190 3.909 4.480 . 0 0 "[ . 1 . 2]" 1
90 1 10 ILE MG 1 12 GLU QB . . 4.490 3.836 3.037 4.603 0.113 9 0 "[ . 1 . 2]" 1
91 1 10 ILE MG 1 94 ASP QB . . 4.470 3.077 2.173 4.020 . 0 0 "[ . 1 . 2]" 1
92 1 10 ILE MG 1 95 ALA H . . 4.480 2.465 1.993 3.284 . 0 0 "[ . 1 . 2]" 1
93 1 10 ILE MG 1 95 ALA HA . . 5.240 4.138 3.631 5.204 . 0 0 "[ . 1 . 2]" 1
94 1 10 ILE MG 1 95 ALA MB . . 4.830 2.249 1.859 3.585 . 0 0 "[ . 1 . 2]" 1
95 1 11 LYS H 1 11 LYS HB2 . . 3.090 2.956 2.223 3.935 0.845 18 4 "[ * . - 1 . *+ 2]" 1
96 1 11 LYS H 1 11 LYS QD . . 4.380 3.047 1.949 4.295 . 0 0 "[ . 1 . 2]" 1
97 1 11 LYS H 1 11 LYS QE . . 5.460 4.304 3.521 5.255 . 0 0 "[ . 1 . 2]" 1
98 1 11 LYS H 1 11 LYS QG . . 4.230 3.152 2.641 3.679 . 0 0 "[ . 1 . 2]" 1
99 1 11 LYS H 1 12 GLU H . . 3.090 2.412 2.077 2.728 . 0 0 "[ . 1 . 2]" 1
100 1 11 LYS H 1 12 GLU HA . . 5.470 4.880 4.685 5.117 . 0 0 "[ . 1 . 2]" 1
101 1 11 LYS H 1 68 LEU QD . . 4.870 4.109 3.700 4.409 . 0 0 "[ . 1 . 2]" 1
102 1 11 LYS H 1 95 ALA MB . . 5.460 3.674 2.737 4.255 . 0 0 "[ . 1 . 2]" 1
103 1 11 LYS HA 1 11 LYS QD . . 4.610 3.126 2.071 3.938 . 0 0 "[ . 1 . 2]" 1
104 1 11 LYS HA 1 11 LYS QE . . 4.790 4.319 3.429 4.820 0.030 5 0 "[ . 1 . 2]" 1
105 1 11 LYS HA 1 11 LYS QG . . 3.680 2.878 2.138 3.502 . 0 0 "[ . 1 . 2]" 1
106 1 11 LYS HA 1 12 GLU H . . 2.980 3.030 2.883 3.070 0.090 19 0 "[ . 1 . 2]" 1
107 1 11 LYS HA 1 12 GLU HA . . 5.500 4.306 4.067 4.514 . 0 0 "[ . 1 . 2]" 1
108 1 11 LYS HA 1 68 LEU H . . 5.100 3.859 3.613 4.310 . 0 0 "[ . 1 . 2]" 1
109 1 11 LYS HA 1 68 LEU HB2 . . 4.800 2.301 2.141 2.659 . 0 0 "[ . 1 . 2]" 1
110 1 11 LYS HA 1 68 LEU HB3 . . 3.520 3.280 2.861 3.579 0.059 2 0 "[ . 1 . 2]" 1
111 1 11 LYS HA 1 68 LEU QD . . 3.940 2.215 2.065 2.368 . 0 0 "[ . 1 . 2]" 1
112 1 11 LYS HB2 1 11 LYS QE . . 5.110 3.919 2.222 4.615 . 0 0 "[ . 1 . 2]" 1
113 1 11 LYS HB2 1 68 LEU H . . 5.500 4.590 3.841 5.420 . 0 0 "[ . 1 . 2]" 1
114 1 11 LYS HB2 1 68 LEU QD . . 4.600 4.506 3.785 4.707 0.107 16 0 "[ . 1 . 2]" 1
115 1 11 LYS HB3 1 11 LYS QD . . 3.630 2.828 2.316 3.565 . 0 0 "[ . 1 . 2]" 1
116 1 11 LYS HB3 1 68 LEU QD . . 4.470 4.018 3.340 4.344 . 0 0 "[ . 1 . 2]" 1
117 1 11 LYS QD 1 12 GLU H . . 5.070 4.592 3.462 4.998 . 0 0 "[ . 1 . 2]" 1
118 1 11 LYS QD 1 68 LEU QD . . 5.450 4.055 2.467 5.275 . 0 0 "[ . 1 . 2]" 1
119 1 11 LYS QE 1 11 LYS QG . . 3.110 2.199 2.040 2.441 . 0 0 "[ . 1 . 2]" 1
120 1 11 LYS QG 1 12 GLU H . . 4.970 4.556 3.868 4.803 . 0 0 "[ . 1 . 2]" 1
121 1 12 GLU H 1 12 GLU QB . . 3.230 2.927 2.686 3.322 0.092 2 0 "[ . 1 . 2]" 1
122 1 12 GLU H 1 13 ILE H . . 4.510 4.130 3.788 4.379 . 0 0 "[ . 1 . 2]" 1
123 1 12 GLU H 1 13 ILE MG . . 4.840 3.850 3.404 4.570 . 0 0 "[ . 1 . 2]" 1
124 1 12 GLU H 1 68 LEU H . . 5.480 4.343 4.166 4.618 . 0 0 "[ . 1 . 2]" 1
125 1 12 GLU H 1 68 LEU HB2 . . 3.900 3.914 3.693 3.983 0.083 12 0 "[ . 1 . 2]" 1
126 1 12 GLU H 1 68 LEU QD . . 4.410 3.209 2.719 3.656 . 0 0 "[ . 1 . 2]" 1
127 1 12 GLU H 1 68 LEU HG . . 5.270 4.574 4.052 4.927 . 0 0 "[ . 1 . 2]" 1
128 1 12 GLU H 1 95 ALA H . . 5.500 4.572 4.006 5.296 . 0 0 "[ . 1 . 2]" 1
129 1 12 GLU H 1 95 ALA MB . . 4.120 3.137 2.344 3.633 . 0 0 "[ . 1 . 2]" 1
130 1 12 GLU HA 1 12 GLU QG . . 3.760 2.663 2.324 3.382 . 0 0 "[ . 1 . 2]" 1
131 1 12 GLU HA 1 13 ILE H . . 2.860 2.293 2.140 2.544 . 0 0 "[ . 1 . 2]" 1
132 1 12 GLU HA 1 13 ILE HG12 . . 5.090 4.389 3.876 5.140 0.050 14 0 "[ . 1 . 2]" 1
133 1 12 GLU HA 1 13 ILE HG13 . . 5.360 4.493 4.005 5.455 0.095 17 0 "[ . 1 . 2]" 1
134 1 12 GLU HA 1 13 ILE MG . . 4.820 3.869 3.679 4.413 . 0 0 "[ . 1 . 2]" 1
135 1 12 GLU HA 1 66 VAL H . . 4.760 4.455 3.947 4.742 . 0 0 "[ . 1 . 2]" 1
136 1 12 GLU HA 1 67 ASP HA . . 3.380 2.521 2.041 3.002 . 0 0 "[ . 1 . 2]" 1
137 1 12 GLU HA 1 67 ASP HB2 . . 5.460 5.028 4.612 5.509 0.049 1 0 "[ . 1 . 2]" 1
138 1 12 GLU HA 1 68 LEU H . . 3.570 2.590 2.295 2.881 . 0 0 "[ . 1 . 2]" 1
139 1 12 GLU HA 1 68 LEU HA . . 5.330 4.460 3.849 4.679 . 0 0 "[ . 1 . 2]" 1
140 1 12 GLU HA 1 68 LEU HB2 . . 5.390 3.494 3.167 3.626 . 0 0 "[ . 1 . 2]" 1
141 1 12 GLU HA 1 68 LEU HB3 . . 5.160 5.130 4.687 5.237 0.077 15 0 "[ . 1 . 2]" 1
142 1 12 GLU HA 1 68 LEU QD . . 4.130 3.830 3.214 4.238 0.108 12 0 "[ . 1 . 2]" 1
143 1 12 GLU HA 1 68 LEU HG . . 3.900 3.754 2.778 3.979 0.079 7 0 "[ . 1 . 2]" 1
144 1 12 GLU HA 1 69 LYS H . . 5.500 5.204 4.876 5.539 0.039 7 0 "[ . 1 . 2]" 1
145 1 12 GLU QB 1 13 ILE H . . 3.830 3.547 2.200 3.927 0.097 15 0 "[ . 1 . 2]" 1
146 1 12 GLU QB 1 66 VAL H . . 5.500 4.688 2.939 5.340 . 0 0 "[ . 1 . 2]" 1
147 1 12 GLU QB 1 67 ASP HA . . 3.870 2.733 1.970 3.665 . 0 0 "[ . 1 . 2]" 1
148 1 12 GLU QB 1 68 LEU H . . 4.590 3.529 3.092 3.981 . 0 0 "[ . 1 . 2]" 1
149 1 12 GLU QB 1 95 ALA HA . . 5.420 4.121 3.034 5.300 . 0 0 "[ . 1 . 2]" 1
150 1 12 GLU QB 1 95 ALA MB . . 3.380 2.927 2.168 3.513 0.133 9 0 "[ . 1 . 2]" 1
151 1 12 GLU QG 1 13 ILE H . . 3.820 2.806 2.130 3.383 . 0 0 "[ . 1 . 2]" 1
152 1 12 GLU QG 1 13 ILE HA . . 5.070 3.957 3.414 4.443 . 0 0 "[ . 1 . 2]" 1
153 1 12 GLU QG 1 14 ILE MD . . 5.170 3.814 3.045 4.838 . 0 0 "[ . 1 . 2]" 1
154 1 12 GLU QG 1 65 ALA MB . . 4.530 2.883 2.225 4.245 . 0 0 "[ . 1 . 2]" 1
155 1 12 GLU QG 1 66 VAL H . . 4.620 3.080 2.530 4.635 0.015 2 0 "[ . 1 . 2]" 1
156 1 12 GLU QG 1 67 ASP HA . . 3.950 2.844 2.118 4.048 0.098 9 0 "[ . 1 . 2]" 1
157 1 12 GLU QG 1 67 ASP HB2 . . 5.280 4.202 3.452 5.386 0.106 9 0 "[ . 1 . 2]" 1
158 1 12 GLU QG 1 95 ALA HA . . 5.470 3.710 2.161 5.159 . 0 0 "[ . 1 . 2]" 1
159 1 12 GLU QG 1 95 ALA MB . . 4.500 3.527 1.939 4.595 0.095 19 0 "[ . 1 . 2]" 1
160 1 13 ILE H 1 13 ILE MD . . 3.880 3.611 1.684 3.968 0.088 11 0 "[ . 1 . 2]" 1
161 1 13 ILE H 1 13 ILE HG12 . . 3.660 2.820 2.184 3.524 . 0 0 "[ . 1 . 2]" 1
162 1 13 ILE H 1 13 ILE HG13 . . 3.770 2.481 1.982 3.844 0.074 20 0 "[ . 1 . 2]" 1
163 1 13 ILE H 1 13 ILE MG . . 3.880 3.023 2.541 3.306 . 0 0 "[ . 1 . 2]" 1
164 1 13 ILE H 1 14 ILE H . . 5.100 4.471 4.286 4.641 . 0 0 "[ . 1 . 2]" 1
165 1 13 ILE H 1 14 ILE HG12 . . 5.260 4.966 4.421 5.662 0.402 7 0 "[ . 1 . 2]" 1
166 1 13 ILE H 1 65 ALA HA . . 5.280 4.679 4.253 5.189 . 0 0 "[ . 1 . 2]" 1
167 1 13 ILE H 1 66 VAL H . . 3.720 2.951 2.717 3.373 . 0 0 "[ . 1 . 2]" 1
168 1 13 ILE H 1 66 VAL HB . . 4.110 3.618 3.046 4.187 0.077 7 0 "[ . 1 . 2]" 1
169 1 13 ILE H 1 66 VAL MG1 . . 4.810 4.367 1.966 4.752 . 0 0 "[ . 1 . 2]" 1
170 1 13 ILE H 1 66 VAL MG2 . . 4.910 4.649 4.107 5.011 0.101 3 0 "[ . 1 . 2]" 1
171 1 13 ILE H 1 67 ASP HA . . 4.590 3.947 3.594 4.631 0.041 7 0 "[ . 1 . 2]" 1
172 1 13 ILE H 1 68 LEU HA . . 5.500 5.382 4.906 5.582 0.082 20 0 "[ . 1 . 2]" 1
173 1 13 ILE H 1 68 LEU HG . . 4.720 4.384 3.754 4.777 0.057 12 0 "[ . 1 . 2]" 1
174 1 13 ILE HA 1 13 ILE MD . . 4.370 4.002 3.629 4.177 . 0 0 "[ . 1 . 2]" 1
175 1 13 ILE HA 1 13 ILE MG . . 3.140 2.319 2.222 2.440 . 0 0 "[ . 1 . 2]" 1
176 1 13 ILE HA 1 14 ILE H . . 3.120 2.537 2.312 2.678 . 0 0 "[ . 1 . 2]" 1
177 1 13 ILE HA 1 14 ILE HB . . 4.990 4.526 4.092 5.065 0.075 19 0 "[ . 1 . 2]" 1
178 1 13 ILE HA 1 14 ILE HG12 . . 4.690 4.568 4.081 4.855 0.165 13 0 "[ . 1 . 2]" 1
179 1 13 ILE HA 1 14 ILE HG13 . . 4.930 3.281 2.746 3.547 . 0 0 "[ . 1 . 2]" 1
180 1 13 ILE HB 1 13 ILE MD . . 3.650 2.315 2.152 3.269 . 0 0 "[ . 1 . 2]" 1
181 1 13 ILE HB 1 14 ILE H . . 3.320 2.325 2.089 2.580 . 0 0 "[ . 1 . 2]" 1
182 1 13 ILE HB 1 82 MET ME . . 3.860 3.851 3.354 3.968 0.108 10 0 "[ . 1 . 2]" 1
183 1 13 ILE HB 1 92 ILE MG . . 3.360 3.176 2.729 3.445 0.085 6 0 "[ . 1 . 2]" 1
184 1 13 ILE MD 1 14 ILE H . . 4.160 3.571 2.993 4.275 0.115 20 0 "[ . 1 . 2]" 1
185 1 13 ILE MD 1 14 ILE HA . . 4.340 4.161 3.371 4.449 0.109 9 0 "[ . 1 . 2]" 1
186 1 13 ILE MD 1 66 VAL HB . . 4.310 2.557 1.917 3.689 . 0 0 "[ . 1 . 2]" 1
187 1 13 ILE MD 1 82 MET ME . . 2.970 2.258 1.883 2.834 . 0 0 "[ . 1 . 2]" 1
188 1 13 ILE HG12 1 13 ILE MG . . 3.170 2.371 2.186 3.258 0.088 20 0 "[ . 1 . 2]" 1
189 1 13 ILE HG12 1 14 ILE H . . 5.450 4.691 3.172 5.121 . 0 0 "[ . 1 . 2]" 1
190 1 13 ILE HG12 1 66 VAL H . . 4.700 4.362 3.146 4.777 0.077 14 0 "[ . 1 . 2]" 1
191 1 13 ILE HG12 1 66 VAL HB . . 3.730 3.069 2.350 3.803 0.073 7 0 "[ . 1 . 2]" 1
192 1 13 ILE HG13 1 13 ILE MG . . 3.650 3.058 2.400 3.325 . 0 0 "[ . 1 . 2]" 1
193 1 13 ILE HG13 1 14 ILE H . . 4.330 3.935 3.337 4.365 0.035 14 0 "[ . 1 . 2]" 1
194 1 13 ILE HG13 1 14 ILE HA . . 5.020 4.323 3.483 5.084 0.064 20 0 "[ . 1 . 2]" 1
195 1 13 ILE HG13 1 15 ILE H . . 5.500 4.696 4.112 5.291 . 0 0 "[ . 1 . 2]" 1
196 1 13 ILE HG13 1 66 VAL H . . 4.610 3.233 2.606 4.701 0.091 20 0 "[ . 1 . 2]" 1
197 1 13 ILE HG13 1 66 VAL HB . . 3.500 2.381 2.043 3.584 0.084 17 0 "[ . 1 . 2]" 1
198 1 13 ILE HG13 1 66 VAL MG2 . . 4.350 3.477 2.540 4.398 0.048 17 0 "[ . 1 . 2]" 1
199 1 13 ILE MG 1 14 ILE H . . 3.930 3.628 3.259 3.778 . 0 0 "[ . 1 . 2]" 1
200 1 13 ILE MG 1 82 MET ME . . 4.160 3.060 2.394 3.760 . 0 0 "[ . 1 . 2]" 1
201 1 13 ILE MG 1 94 ASP HA . . 4.330 2.694 2.183 3.394 . 0 0 "[ . 1 . 2]" 1
202 1 13 ILE MG 1 94 ASP QB . . 4.670 3.650 3.092 4.270 . 0 0 "[ . 1 . 2]" 1
203 1 13 ILE MG 1 95 ALA H . . 5.050 3.932 3.431 4.761 . 0 0 "[ . 1 . 2]" 1
204 1 14 ILE H 1 14 ILE HB . . 3.360 2.865 2.700 3.229 . 0 0 "[ . 1 . 2]" 1
205 1 14 ILE H 1 14 ILE HG12 . . 3.910 4.055 3.764 4.169 0.259 16 0 "[ . 1 . 2]" 1
206 1 14 ILE H 1 14 ILE HG13 . . 4.100 3.117 2.918 3.265 . 0 0 "[ . 1 . 2]" 1
207 1 14 ILE H 1 92 ILE MG . . 3.810 3.735 3.199 3.932 0.122 19 0 "[ . 1 . 2]" 1
208 1 14 ILE H 1 95 ALA H . . 5.500 5.096 4.669 5.566 0.066 19 0 "[ . 1 . 2]" 1
209 1 14 ILE HA 1 14 ILE HG12 . . 3.950 2.575 2.229 2.916 . 0 0 "[ . 1 . 2]" 1
210 1 14 ILE HA 1 14 ILE HG13 . . 4.020 3.177 3.001 3.401 . 0 0 "[ . 1 . 2]" 1
211 1 14 ILE HA 1 14 ILE MG . . 3.290 2.394 2.245 2.561 . 0 0 "[ . 1 . 2]" 1
212 1 14 ILE HA 1 15 ILE H . . 3.150 2.160 2.114 2.242 . 0 0 "[ . 1 . 2]" 1
213 1 14 ILE HA 1 15 ILE HA . . 4.780 4.482 4.422 4.558 . 0 0 "[ . 1 . 2]" 1
214 1 14 ILE HA 1 15 ILE HB . . 5.000 4.667 4.369 4.827 . 0 0 "[ . 1 . 2]" 1
215 1 14 ILE HA 1 15 ILE MD . . 5.080 4.486 4.100 5.149 0.069 13 0 "[ . 1 . 2]" 1
216 1 14 ILE HA 1 15 ILE QG . . 5.250 3.966 3.615 4.300 . 0 0 "[ . 1 . 2]" 1
217 1 14 ILE HA 1 65 ALA HA . . 3.360 2.313 2.084 2.748 . 0 0 "[ . 1 . 2]" 1
218 1 14 ILE HB 1 63 CYS QB . . 5.420 4.489 3.685 5.466 0.046 7 0 "[ . 1 . 2]" 1
219 1 14 ILE MD 1 56 ARG HD2 . . 4.840 2.333 2.016 3.488 . 0 0 "[ . 1 . 2]" 1
220 1 14 ILE MD 1 56 ARG HD3 . . 5.110 3.239 2.294 4.491 . 0 0 "[ . 1 . 2]" 1
221 1 14 ILE MD 1 65 ALA HA . . 3.880 3.941 3.639 3.994 0.114 7 0 "[ . 1 . 2]" 1
222 1 14 ILE MD 1 65 ALA MB . . 4.030 3.294 2.704 3.948 . 0 0 "[ . 1 . 2]" 1
223 1 14 ILE MD 1 95 ALA HA . . 3.690 2.775 2.120 3.781 0.091 13 0 "[ . 1 . 2]" 1
224 1 14 ILE MD 1 95 ALA MB . . 4.940 3.942 3.252 4.735 . 0 0 "[ . 1 . 2]" 1
225 1 14 ILE MD 1 97 GLY H . . 4.880 4.017 3.089 4.980 0.100 19 0 "[ . 1 . 2]" 1
226 1 14 ILE MD 1 97 GLY HA2 . . 5.140 3.690 2.786 4.711 . 0 0 "[ . 1 . 2]" 1
227 1 14 ILE HG12 1 14 ILE MG . . 3.590 2.489 2.350 2.645 . 0 0 "[ . 1 . 2]" 1
228 1 14 ILE HG12 1 65 ALA HA . . 4.470 2.386 2.208 2.679 . 0 0 "[ . 1 . 2]" 1
229 1 14 ILE HG12 1 95 ALA HA . . 4.810 4.237 3.760 5.192 0.382 13 0 "[ . 1 . 2]" 1
230 1 14 ILE HG13 1 14 ILE MG . . 3.390 3.258 3.227 3.281 . 0 0 "[ . 1 . 2]" 1
231 1 14 ILE HG13 1 65 ALA HA . . 4.270 3.776 3.321 4.212 . 0 0 "[ . 1 . 2]" 1
232 1 14 ILE HG13 1 65 ALA MB . . 4.220 4.068 3.476 4.696 0.476 7 0 "[ . 1 . 2]" 1
233 1 14 ILE HG13 1 95 ALA HA . . 5.500 2.906 2.436 3.545 . 0 0 "[ . 1 . 2]" 1
234 1 14 ILE MG 1 15 ILE H . . 3.400 3.202 2.859 3.485 0.085 18 0 "[ . 1 . 2]" 1
235 1 14 ILE MG 1 15 ILE HA . . 5.330 4.278 3.873 4.699 . 0 0 "[ . 1 . 2]" 1
236 1 14 ILE MG 1 16 GLN HE21 . . 5.500 5.312 4.410 5.996 0.496 3 0 "[ . 1 . 2]" 1
237 1 14 ILE MG 1 30 TRP HH2 . . 5.500 5.290 4.839 5.572 0.072 2 0 "[ . 1 . 2]" 1
238 1 14 ILE MG 1 63 CYS H . . 5.500 5.349 4.869 5.586 0.086 1 0 "[ . 1 . 2]" 1
239 1 14 ILE MG 1 63 CYS HA . . 4.580 3.854 3.258 4.134 . 0 0 "[ . 1 . 2]" 1
240 1 14 ILE MG 1 63 CYS QB . . 3.110 2.092 1.929 2.549 . 0 0 "[ . 1 . 2]" 1
241 1 14 ILE MG 1 64 LEU H . . 3.970 2.799 2.165 3.559 . 0 0 "[ . 1 . 2]" 1
242 1 14 ILE MG 1 65 ALA HA . . 4.150 3.059 2.320 3.875 . 0 0 "[ . 1 . 2]" 1
243 1 15 ILE H 1 15 ILE HB . . 3.530 2.580 2.294 2.764 . 0 0 "[ . 1 . 2]" 1
244 1 15 ILE H 1 15 ILE MD . . 3.760 3.142 2.670 3.721 . 0 0 "[ . 1 . 2]" 1
245 1 15 ILE H 1 15 ILE QG . . 3.780 2.243 2.031 2.410 . 0 0 "[ . 1 . 2]" 1
246 1 15 ILE H 1 30 TRP HH2 . . 4.680 4.342 4.014 4.669 . 0 0 "[ . 1 . 2]" 1
247 1 15 ILE H 1 63 CYS QB . . 4.870 4.521 4.117 4.879 0.009 4 0 "[ . 1 . 2]" 1
248 1 15 ILE H 1 64 LEU H . . 4.020 3.271 2.987 3.618 . 0 0 "[ . 1 . 2]" 1
249 1 15 ILE H 1 64 LEU HB3 . . 4.920 3.595 3.255 4.322 . 0 0 "[ . 1 . 2]" 1
250 1 15 ILE H 1 65 ALA H . . 5.420 5.130 4.793 5.459 0.039 18 0 "[ . 1 . 2]" 1
251 1 15 ILE H 1 65 ALA HA . . 4.200 3.786 3.505 4.081 . 0 0 "[ . 1 . 2]" 1
252 1 15 ILE HA 1 15 ILE MD . . 3.840 2.652 2.216 3.929 0.089 13 0 "[ . 1 . 2]" 1
253 1 15 ILE HA 1 15 ILE QG . . 3.870 3.044 2.259 3.290 . 0 0 "[ . 1 . 2]" 1
254 1 15 ILE HA 1 15 ILE MG . . 3.330 2.348 2.209 2.664 . 0 0 "[ . 1 . 2]" 1
255 1 15 ILE HA 1 16 GLN H . . 2.990 2.248 2.122 2.325 . 0 0 "[ . 1 . 2]" 1
256 1 15 ILE HA 1 16 GLN HA . . 4.550 4.437 4.337 4.506 . 0 0 "[ . 1 . 2]" 1
257 1 15 ILE HA 1 30 TRP HH2 . . 4.890 4.586 4.366 4.840 . 0 0 "[ . 1 . 2]" 1
258 1 15 ILE HA 1 64 LEU H . . 5.370 4.841 4.665 5.136 . 0 0 "[ . 1 . 2]" 1
259 1 15 ILE HA 1 92 ILE H . . 5.370 5.280 4.976 5.442 0.072 19 0 "[ . 1 . 2]" 1
260 1 15 ILE HA 1 92 ILE HA . . 3.620 2.581 2.365 2.824 . 0 0 "[ . 1 . 2]" 1
261 1 15 ILE HA 1 92 ILE HG12 . . 4.020 3.745 2.960 4.087 0.067 4 0 "[ . 1 . 2]" 1
262 1 15 ILE HA 1 92 ILE MG . . 4.270 3.525 2.383 4.136 . 0 0 "[ . 1 . 2]" 1
263 1 15 ILE HA 1 93 LEU H . . 4.530 3.188 2.758 3.683 . 0 0 "[ . 1 . 2]" 1
264 1 15 ILE HB 1 15 ILE MD . . 3.460 3.097 2.354 3.298 . 0 0 "[ . 1 . 2]" 1
265 1 15 ILE HB 1 30 TRP HH2 . . 3.420 2.139 2.050 2.374 . 0 0 "[ . 1 . 2]" 1
266 1 15 ILE HB 1 30 TRP HZ2 . . 4.170 4.222 4.144 4.249 0.079 15 0 "[ . 1 . 2]" 1
267 1 15 ILE HB 1 30 TRP HZ3 . . 5.500 3.543 3.296 3.986 . 0 0 "[ . 1 . 2]" 1
268 1 15 ILE HB 1 64 LEU H . . 4.340 3.391 3.003 3.647 . 0 0 "[ . 1 . 2]" 1
269 1 15 ILE HB 1 64 LEU HB2 . . 4.230 3.756 2.534 4.308 0.078 5 0 "[ . 1 . 2]" 1
270 1 15 ILE HB 1 85 ALA MB . . 5.500 4.388 4.113 4.916 . 0 0 "[ . 1 . 2]" 1
271 1 15 ILE HB 1 90 LEU QD . . 5.500 4.486 3.926 5.292 . 0 0 "[ . 1 . 2]" 1
272 1 15 ILE MD 1 30 TRP HH2 . . 5.360 4.599 3.418 5.054 . 0 0 "[ . 1 . 2]" 1
273 1 15 ILE MD 1 30 TRP HZ3 . . 5.500 4.978 3.089 5.598 0.098 12 0 "[ . 1 . 2]" 1
274 1 15 ILE MD 1 64 LEU H . . 5.500 5.430 4.910 5.601 0.101 7 0 "[ . 1 . 2]" 1
275 1 15 ILE MD 1 81 LEU HB3 . . 4.170 4.052 2.444 4.270 0.100 18 0 "[ . 1 . 2]" 1
276 1 15 ILE MD 1 82 MET H . . 5.040 4.757 4.230 5.122 0.082 9 0 "[ . 1 . 2]" 1
277 1 15 ILE MD 1 82 MET HA . . 4.620 3.090 2.657 3.518 . 0 0 "[ . 1 . 2]" 1
278 1 15 ILE MD 1 85 ALA H . . 5.500 3.993 3.214 4.562 . 0 0 "[ . 1 . 2]" 1
279 1 15 ILE MD 1 85 ALA HA . . 5.500 4.277 3.809 4.777 . 0 0 "[ . 1 . 2]" 1
280 1 15 ILE MD 1 85 ALA MB . . 3.590 2.184 2.035 2.500 . 0 0 "[ . 1 . 2]" 1
281 1 15 ILE MD 1 90 LEU QD . . 5.260 4.505 3.883 4.926 . 0 0 "[ . 1 . 2]" 1
282 1 15 ILE QG 1 30 TRP HH2 . . 5.180 3.862 3.567 4.531 . 0 0 "[ . 1 . 2]" 1
283 1 15 ILE QG 1 65 ALA HA . . 5.500 5.082 4.543 5.388 . 0 0 "[ . 1 . 2]" 1
284 1 15 ILE MG 1 16 GLN H . . 3.580 3.099 2.708 3.505 . 0 0 "[ . 1 . 2]" 1
285 1 15 ILE MG 1 16 GLN HA . . 5.500 4.348 4.214 4.559 . 0 0 "[ . 1 . 2]" 1
286 1 15 ILE MG 1 30 TRP HH2 . . 3.020 2.421 2.110 3.095 0.075 12 0 "[ . 1 . 2]" 1
287 1 15 ILE MG 1 30 TRP HZ2 . . 3.760 3.438 3.078 3.839 0.079 12 0 "[ . 1 . 2]" 1
288 1 15 ILE MG 1 30 TRP HZ3 . . 5.020 3.266 2.606 4.025 . 0 0 "[ . 1 . 2]" 1
289 1 15 ILE MG 1 64 LEU H . . 5.070 4.428 4.135 4.677 . 0 0 "[ . 1 . 2]" 1
290 1 15 ILE MG 1 84 PHE QD . . 3.970 3.238 2.476 3.836 . 0 0 "[ . 1 . 2]" 1
291 1 15 ILE MG 1 85 ALA H . . 4.890 4.032 3.671 4.412 . 0 0 "[ . 1 . 2]" 1
292 1 15 ILE MG 1 85 ALA HA . . 4.450 2.970 2.503 3.367 . 0 0 "[ . 1 . 2]" 1
293 1 15 ILE MG 1 85 ALA MB . . 3.220 2.077 1.913 2.337 . 0 0 "[ . 1 . 2]" 1
294 1 15 ILE MG 1 90 LEU H . . 5.070 4.783 4.396 5.148 0.078 15 0 "[ . 1 . 2]" 1
295 1 15 ILE MG 1 90 LEU HA . . 5.500 4.844 4.377 5.314 . 0 0 "[ . 1 . 2]" 1
296 1 15 ILE MG 1 90 LEU HB2 . . 3.420 2.859 2.471 3.187 . 0 0 "[ . 1 . 2]" 1
297 1 15 ILE MG 1 90 LEU HB3 . . 3.460 2.845 2.336 3.506 0.046 6 0 "[ . 1 . 2]" 1
298 1 15 ILE MG 1 90 LEU QD . . 3.420 2.444 2.079 3.072 . 0 0 "[ . 1 . 2]" 1
299 1 15 ILE MG 1 90 LEU HG . . 4.800 4.078 3.232 4.689 . 0 0 "[ . 1 . 2]" 1
300 1 15 ILE MG 1 91 ASN H . . 5.290 4.704 4.046 5.208 . 0 0 "[ . 1 . 2]" 1
301 1 15 ILE MG 1 92 ILE HA . . 5.040 3.661 3.252 4.173 . 0 0 "[ . 1 . 2]" 1
302 1 16 GLN H 1 16 GLN HB2 . . 3.530 2.270 2.095 2.452 . 0 0 "[ . 1 . 2]" 1
303 1 16 GLN H 1 16 GLN HB3 . . 3.600 2.869 2.500 3.047 . 0 0 "[ . 1 . 2]" 1
304 1 16 GLN H 1 16 GLN QG . . 4.160 3.837 3.635 3.921 . 0 0 "[ . 1 . 2]" 1
305 1 16 GLN H 1 17 GLY H . . 5.390 4.629 4.314 4.699 . 0 0 "[ . 1 . 2]" 1
306 1 16 GLN H 1 18 LEU H . . 5.270 4.812 4.405 5.317 0.047 17 0 "[ . 1 . 2]" 1
307 1 16 GLN H 1 85 ALA MB . . 5.500 4.838 4.453 5.247 . 0 0 "[ . 1 . 2]" 1
308 1 16 GLN H 1 90 LEU QD . . 5.500 4.780 4.409 5.235 . 0 0 "[ . 1 . 2]" 1
309 1 16 GLN H 1 91 ASN H . . 5.220 4.324 3.758 5.286 0.066 10 0 "[ . 1 . 2]" 1
310 1 16 GLN H 1 91 ASN HB2 . . 5.500 5.190 4.766 5.360 . 0 0 "[ . 1 . 2]" 1
311 1 16 GLN H 1 91 ASN HB3 . . 4.690 3.762 3.381 4.002 . 0 0 "[ . 1 . 2]" 1
312 1 16 GLN H 1 92 ILE HA . . 4.040 3.045 2.356 3.362 . 0 0 "[ . 1 . 2]" 1
313 1 16 GLN H 1 93 LEU HB2 . . 4.430 4.251 3.600 4.512 0.082 16 0 "[ . 1 . 2]" 1
314 1 16 GLN H 1 93 LEU QD . . 4.550 3.645 3.173 4.104 . 0 0 "[ . 1 . 2]" 1
315 1 16 GLN HA 1 17 GLY H . . 3.280 2.366 2.148 2.481 . 0 0 "[ . 1 . 2]" 1
316 1 16 GLN HA 1 30 TRP HZ2 . . 4.100 4.098 3.880 4.180 0.080 14 0 "[ . 1 . 2]" 1
317 1 16 GLN HA 1 63 CYS HA . . 3.900 2.862 2.462 3.383 . 0 0 "[ . 1 . 2]" 1
318 1 16 GLN HA 1 63 CYS QB . . 3.650 2.697 1.975 3.743 0.093 10 0 "[ . 1 . 2]" 1
319 1 16 GLN HB2 1 17 GLY H . . 4.610 4.193 4.073 4.562 . 0 0 "[ . 1 . 2]" 1
320 1 16 GLN HB2 1 18 LEU H . . 4.170 4.078 3.778 4.245 0.075 11 0 "[ . 1 . 2]" 1
321 1 16 GLN HB2 1 61 VAL QG . . 5.500 4.471 3.949 4.990 . 0 0 "[ . 1 . 2]" 1
322 1 16 GLN HB2 1 91 ASN H . . 5.500 4.282 3.820 5.558 0.058 10 0 "[ . 1 . 2]" 1
323 1 16 GLN HB2 1 91 ASN HB2 . . 4.130 4.184 4.112 4.206 0.076 9 0 "[ . 1 . 2]" 1
324 1 16 GLN HB2 1 91 ASN HB3 . . 3.860 2.563 2.379 2.826 . 0 0 "[ . 1 . 2]" 1
325 1 16 GLN HB2 1 93 LEU QD . . 3.910 2.428 1.997 3.027 . 0 0 "[ . 1 . 2]" 1
326 1 16 GLN HB3 1 18 LEU H . . 3.780 2.496 2.126 3.066 . 0 0 "[ . 1 . 2]" 1
327 1 16 GLN HB3 1 91 ASN HB2 . . 3.650 3.389 2.864 3.667 0.017 19 0 "[ . 1 . 2]" 1
328 1 16 GLN HB3 1 91 ASN HB3 . . 4.090 2.330 2.067 2.637 . 0 0 "[ . 1 . 2]" 1
329 1 16 GLN HB3 1 91 ASN HD21 . . 5.060 4.431 3.604 4.952 . 0 0 "[ . 1 . 2]" 1
330 1 16 GLN HB3 1 92 ILE HA . . 5.350 5.238 4.461 5.436 0.086 10 0 "[ . 1 . 2]" 1
331 1 16 GLN HE21 1 18 LEU QB . . 5.500 4.191 3.236 4.711 . 0 0 "[ . 1 . 2]" 1
332 1 16 GLN HE21 1 18 LEU QD . . 4.300 3.493 2.268 4.064 . 0 0 "[ . 1 . 2]" 1
333 1 16 GLN HE21 1 58 ILE HB . . 4.570 3.589 2.741 4.197 . 0 0 "[ . 1 . 2]" 1
334 1 16 GLN HE21 1 58 ILE MD . . 5.180 4.599 3.783 5.280 0.100 7 0 "[ . 1 . 2]" 1
335 1 16 GLN HE21 1 58 ILE MG . . 5.360 3.042 2.136 4.445 . 0 0 "[ . 1 . 2]" 1
336 1 16 GLN HE21 1 61 VAL QG . . 4.730 2.940 1.985 4.060 . 0 0 "[ . 1 . 2]" 1
337 1 16 GLN HE21 1 93 LEU QD . . 4.250 2.694 2.147 3.762 . 0 0 "[ . 1 . 2]" 1
338 1 16 GLN HE22 1 18 LEU QB . . 5.300 4.009 3.096 4.921 . 0 0 "[ . 1 . 2]" 1
339 1 16 GLN HE22 1 18 LEU QD . . 3.930 3.119 2.283 4.143 0.213 3 0 "[ . 1 . 2]" 1
340 1 16 GLN HE22 1 58 ILE HB . . 5.110 4.901 2.404 5.199 0.089 1 0 "[ . 1 . 2]" 1
341 1 16 GLN HE22 1 58 ILE MG . . 4.940 3.725 1.888 4.838 . 0 0 "[ . 1 . 2]" 1
342 1 16 GLN HE22 1 61 VAL QG . . 5.000 3.661 2.684 4.421 . 0 0 "[ . 1 . 2]" 1
343 1 16 GLN HE22 1 93 LEU QD . . 4.140 2.892 2.443 3.864 . 0 0 "[ . 1 . 2]" 1
344 1 16 GLN QG 1 17 GLY H . . 4.220 2.236 1.915 3.111 . 0 0 "[ . 1 . 2]" 1
345 1 16 GLN QG 1 18 LEU H . . 3.750 2.546 1.664 3.096 . 0 0 "[ . 1 . 2]" 1
346 1 16 GLN QG 1 18 LEU QB . . 3.910 2.531 2.023 3.171 . 0 0 "[ . 1 . 2]" 1
347 1 16 GLN QG 1 18 LEU QD . . 4.390 3.002 2.058 3.611 . 0 0 "[ . 1 . 2]" 1
348 1 16 GLN QG 1 58 ILE MD . . 5.500 4.480 3.307 5.345 . 0 0 "[ . 1 . 2]" 1
349 1 16 GLN QG 1 61 VAL QG . . 4.090 2.205 1.822 2.639 . 0 0 "[ . 1 . 2]" 1
350 1 16 GLN QG 1 93 LEU QD . . 4.260 2.598 2.290 3.057 . 0 0 "[ . 1 . 2]" 1
351 1 16 GLN QG 1 93 LEU HG . . 5.500 4.550 2.979 5.385 . 0 0 "[ . 1 . 2]" 1
352 1 17 GLY H 1 18 LEU H . . 4.050 2.696 2.408 3.236 . 0 0 "[ . 1 . 2]" 1
353 1 17 GLY H 1 18 LEU QD . . 5.500 4.013 3.328 5.213 . 0 0 "[ . 1 . 2]" 1
354 1 17 GLY H 1 30 TRP HE1 . . 5.080 4.620 4.215 4.860 . 0 0 "[ . 1 . 2]" 1
355 1 17 GLY H 1 30 TRP HZ2 . . 3.610 3.455 2.273 3.663 0.053 14 0 "[ . 1 . 2]" 1
356 1 17 GLY H 1 61 VAL QG . . 3.480 2.121 1.892 2.772 . 0 0 "[ . 1 . 2]" 1
357 1 17 GLY H 1 63 CYS HA . . 3.730 2.970 2.416 3.454 . 0 0 "[ . 1 . 2]" 1
358 1 17 GLY H 1 63 CYS QB . . 4.500 3.712 2.817 4.605 0.105 10 0 "[ . 1 . 2]" 1
359 1 17 GLY H 1 64 LEU H . . 5.330 5.077 4.339 5.402 0.072 8 0 "[ . 1 . 2]" 1
360 1 17 GLY HA2 1 25 PHE H . . 5.500 4.413 4.145 4.904 . 0 0 "[ . 1 . 2]" 1
361 1 17 GLY HA2 1 25 PHE HB3 . . 5.360 3.685 3.300 4.266 . 0 0 "[ . 1 . 2]" 1
362 1 17 GLY HA2 1 25 PHE QD . . 5.090 4.338 3.811 4.935 . 0 0 "[ . 1 . 2]" 1
363 1 17 GLY HA2 1 30 TRP HE1 . . 4.060 2.682 2.051 3.741 . 0 0 "[ . 1 . 2]" 1
364 1 17 GLY HA2 1 30 TRP HZ2 . . 3.530 2.417 2.110 3.112 . 0 0 "[ . 1 . 2]" 1
365 1 17 GLY HA2 1 61 VAL QG . . 4.740 3.641 3.321 4.183 . 0 0 "[ . 1 . 2]" 1
366 1 17 GLY HA2 1 63 CYS HA . . 4.890 4.268 3.419 4.989 0.099 11 0 "[ . 1 . 2]" 1
367 1 17 GLY HA2 1 90 LEU QD . . 5.300 2.841 1.912 3.687 . 0 0 "[ . 1 . 2]" 1
368 1 17 GLY HA3 1 25 PHE HB3 . . 4.750 4.266 3.541 4.971 0.221 15 0 "[ . 1 . 2]" 1
369 1 17 GLY HA3 1 30 TRP HE1 . . 4.170 2.432 2.031 2.867 . 0 0 "[ . 1 . 2]" 1
370 1 17 GLY HA3 1 30 TRP HZ2 . . 3.370 2.911 2.199 3.432 0.062 14 0 "[ . 1 . 2]" 1
371 1 17 GLY HA3 1 61 VAL QG . . 4.740 2.469 2.139 3.350 . 0 0 "[ . 1 . 2]" 1
372 1 17 GLY HA3 1 90 LEU QD . . 4.170 4.083 2.971 4.891 0.721 2 3 "[ + . * - . 2]" 1
373 1 18 LEU H 1 18 LEU QB . . 3.420 2.251 2.069 2.385 . 0 0 "[ . 1 . 2]" 1
374 1 18 LEU H 1 18 LEU QD . . 3.760 3.253 2.650 3.590 . 0 0 "[ . 1 . 2]" 1
375 1 18 LEU H 1 19 THR H . . 4.810 4.359 4.241 4.490 . 0 0 "[ . 1 . 2]" 1
376 1 18 LEU H 1 30 TRP HZ2 . . 4.930 4.898 4.519 5.020 0.090 15 0 "[ . 1 . 2]" 1
377 1 18 LEU H 1 61 VAL QG . . 3.790 2.936 2.276 3.556 . 0 0 "[ . 1 . 2]" 1
378 1 18 LEU H 1 90 LEU QD . . 4.220 3.578 3.024 4.178 . 0 0 "[ . 1 . 2]" 1
379 1 18 LEU HA 1 18 LEU QD . . 3.350 2.252 1.894 2.661 . 0 0 "[ . 1 . 2]" 1
380 1 18 LEU HA 1 19 THR H . . 2.840 2.269 2.109 2.384 . 0 0 "[ . 1 . 2]" 1
381 1 18 LEU HA 1 23 LYS H . . 4.520 4.324 3.684 4.593 0.073 14 0 "[ . 1 . 2]" 1
382 1 18 LEU HA 1 24 PRO HA . . 3.390 2.262 1.930 2.671 . 0 0 "[ . 1 . 2]" 1
383 1 18 LEU HA 1 24 PRO HB2 . . 5.290 4.899 4.184 5.354 0.064 12 0 "[ . 1 . 2]" 1
384 1 18 LEU HA 1 24 PRO HB3 . . 4.950 4.238 3.472 4.814 . 0 0 "[ . 1 . 2]" 1
385 1 18 LEU HA 1 25 PHE H . . 3.570 3.144 2.608 3.601 0.031 10 0 "[ . 1 . 2]" 1
386 1 18 LEU HA 1 25 PHE HB2 . . 4.370 4.137 3.697 4.428 0.058 1 0 "[ . 1 . 2]" 1
387 1 18 LEU HA 1 61 VAL QG . . 5.500 3.629 3.291 4.218 . 0 0 "[ . 1 . 2]" 1
388 1 18 LEU QB 1 18 LEU QD . . 2.880 1.898 1.813 1.992 . 0 0 "[ . 1 . 2]" 1
389 1 18 LEU QB 1 19 THR H . . 3.710 3.072 2.187 3.656 . 0 0 "[ . 1 . 2]" 1
390 1 18 LEU QB 1 22 GLY H . . 4.860 4.065 3.405 4.874 0.014 1 0 "[ . 1 . 2]" 1
391 1 18 LEU QB 1 22 GLY HA2 . . 4.150 3.206 2.165 3.986 . 0 0 "[ . 1 . 2]" 1
392 1 18 LEU QB 1 22 GLY HA3 . . 5.480 4.796 3.555 5.555 0.075 19 0 "[ . 1 . 2]" 1
393 1 18 LEU QB 1 24 PRO HA . . 5.010 4.192 3.897 4.549 . 0 0 "[ . 1 . 2]" 1
394 1 18 LEU QB 1 61 VAL QG . . 3.460 2.809 2.116 3.305 . 0 0 "[ . 1 . 2]" 1
395 1 18 LEU QB 1 91 ASN H . . 5.250 4.029 3.740 5.324 0.074 10 0 "[ . 1 . 2]" 1
396 1 18 LEU QB 1 91 ASN HB2 . . 4.490 3.504 2.897 3.803 . 0 0 "[ . 1 . 2]" 1
397 1 18 LEU QB 1 91 ASN HB3 . . 4.240 3.838 3.399 4.273 0.033 11 0 "[ . 1 . 2]" 1
398 1 18 LEU QB 1 91 ASN HD21 . . 4.150 4.010 3.098 4.243 0.093 1 0 "[ . 1 . 2]" 1
399 1 18 LEU QD 1 19 THR H . . 4.220 3.460 2.108 3.860 . 0 0 "[ . 1 . 2]" 1
400 1 18 LEU QD 1 19 THR MG . . 5.500 4.547 3.677 4.855 . 0 0 "[ . 1 . 2]" 1
401 1 18 LEU QD 1 22 GLY H . . 5.000 3.991 3.184 4.578 . 0 0 "[ . 1 . 2]" 1
402 1 18 LEU QD 1 22 GLY HA2 . . 3.930 2.462 2.083 3.092 . 0 0 "[ . 1 . 2]" 1
403 1 18 LEU QD 1 22 GLY HA3 . . 4.640 3.524 2.995 4.267 . 0 0 "[ . 1 . 2]" 1
404 1 18 LEU QD 1 23 LYS H . . 4.690 3.687 2.449 4.361 . 0 0 "[ . 1 . 2]" 1
405 1 18 LEU QD 1 24 PRO HA . . 3.180 2.242 2.002 2.680 . 0 0 "[ . 1 . 2]" 1
406 1 18 LEU QD 1 24 PRO HB2 . . 4.140 3.922 3.590 4.177 0.037 15 0 "[ . 1 . 2]" 1
407 1 18 LEU QD 1 24 PRO HB3 . . 3.900 2.734 2.399 3.074 . 0 0 "[ . 1 . 2]" 1
408 1 18 LEU QD 1 24 PRO HD3 . . 4.860 3.100 2.212 3.788 . 0 0 "[ . 1 . 2]" 1
409 1 18 LEU QD 1 24 PRO HG2 . . 5.280 4.662 4.088 5.007 . 0 0 "[ . 1 . 2]" 1
410 1 18 LEU QD 1 24 PRO HG3 . . 4.430 4.111 3.527 4.430 . 0 0 "[ . 1 . 2]" 1
411 1 18 LEU QD 1 25 PHE H . . 4.330 3.804 3.464 4.276 . 0 0 "[ . 1 . 2]" 1
412 1 18 LEU QD 1 25 PHE HB3 . . 5.500 5.291 4.931 5.464 . 0 0 "[ . 1 . 2]" 1
413 1 18 LEU QD 1 61 VAL QG . . 3.650 1.944 1.646 2.327 . 0 0 "[ . 1 . 2]" 1
414 1 18 LEU QD 1 91 ASN HD21 . . 4.910 4.202 3.765 4.724 . 0 0 "[ . 1 . 2]" 1
415 1 18 LEU HG 1 19 THR H . . 5.340 3.556 2.868 4.523 . 0 0 "[ . 1 . 2]" 1
416 1 18 LEU HG 1 22 GLY HA2 . . 5.350 3.565 2.260 5.273 . 0 0 "[ . 1 . 2]" 1
417 1 18 LEU HG 1 23 LYS HA . . 3.770 3.778 3.322 3.896 0.126 16 0 "[ . 1 . 2]" 1
418 1 18 LEU HG 1 24 PRO HD3 . . 4.710 4.130 3.506 4.711 0.001 11 0 "[ . 1 . 2]" 1
419 1 19 THR H 1 19 THR MG . . 3.150 2.359 2.111 2.684 . 0 0 "[ . 1 . 2]" 1
420 1 19 THR H 1 21 ALA H . . 5.150 4.417 4.063 4.801 . 0 0 "[ . 1 . 2]" 1
421 1 19 THR H 1 22 GLY H . . 4.480 3.872 3.527 4.394 . 0 0 "[ . 1 . 2]" 1
422 1 19 THR H 1 23 LYS H . . 3.480 2.777 1.924 3.328 . 0 0 "[ . 1 . 2]" 1
423 1 19 THR H 1 23 LYS HB2 . . 5.060 4.249 3.887 4.873 . 0 0 "[ . 1 . 2]" 1
424 1 19 THR H 1 23 LYS HB3 . . 5.390 4.864 4.542 5.435 0.045 20 0 "[ . 1 . 2]" 1
425 1 19 THR H 1 24 PRO HA . . 4.600 3.717 3.202 4.168 . 0 0 "[ . 1 . 2]" 1
426 1 19 THR H 1 25 PHE H . . 4.550 4.331 3.925 4.622 0.072 12 0 "[ . 1 . 2]" 1
427 1 19 THR H 1 25 PHE HB2 . . 4.870 4.166 3.665 4.514 . 0 0 "[ . 1 . 2]" 1
428 1 19 THR H 1 90 LEU HA . . 4.920 4.519 4.028 4.726 . 0 0 "[ . 1 . 2]" 1
429 1 19 THR H 1 90 LEU QD . . 4.910 3.873 3.509 4.119 . 0 0 "[ . 1 . 2]" 1
430 1 19 THR HA 1 19 THR MG . . 3.220 2.412 2.252 2.553 . 0 0 "[ . 1 . 2]" 1
431 1 19 THR HA 1 20 ARG H . . 3.120 2.419 2.325 2.512 . 0 0 "[ . 1 . 2]" 1
432 1 19 THR HA 1 20 ARG HA . . 4.820 4.478 4.334 4.596 . 0 0 "[ . 1 . 2]" 1
433 1 19 THR HA 1 21 ALA H . . 4.450 4.045 3.893 4.301 . 0 0 "[ . 1 . 2]" 1
434 1 19 THR HA 1 21 ALA MB . . 5.500 5.206 4.981 5.493 . 0 0 "[ . 1 . 2]" 1
435 1 19 THR HA 1 22 GLY H . . 5.180 4.737 4.434 4.983 . 0 0 "[ . 1 . 2]" 1
436 1 19 THR HA 1 89 GLN HB2 . . 5.360 4.143 3.646 4.585 . 0 0 "[ . 1 . 2]" 1
437 1 19 THR HA 1 90 LEU H . . 5.070 4.347 3.983 4.686 . 0 0 "[ . 1 . 2]" 1
438 1 19 THR HA 1 90 LEU HA . . 3.200 2.153 1.958 2.461 . 0 0 "[ . 1 . 2]" 1
439 1 19 THR HA 1 90 LEU HB3 . . 5.260 4.475 4.061 4.941 . 0 0 "[ . 1 . 2]" 1
440 1 19 THR HA 1 90 LEU QD . . 3.630 2.710 2.437 3.038 . 0 0 "[ . 1 . 2]" 1
441 1 19 THR HA 1 91 ASN H . . 3.720 3.359 2.974 3.755 0.035 10 0 "[ . 1 . 2]" 1
442 1 19 THR HA 1 91 ASN HB2 . . 4.730 4.444 3.873 4.783 0.053 18 0 "[ . 1 . 2]" 1
443 1 19 THR HB 1 20 ARG HA . . 4.910 4.844 4.545 4.985 0.075 5 0 "[ . 1 . 2]" 1
444 1 19 THR HB 1 20 ARG HB3 . . 5.020 4.757 4.452 5.080 0.060 10 0 "[ . 1 . 2]" 1
445 1 19 THR HB 1 20 ARG QG . . 5.390 3.130 2.556 4.128 . 0 0 "[ . 1 . 2]" 1
446 1 19 THR HB 1 21 ALA MB . . 3.800 3.568 3.248 3.873 0.073 5 0 "[ . 1 . 2]" 1
447 1 19 THR HB 1 89 GLN HB2 . . 4.510 3.272 2.580 3.849 . 0 0 "[ . 1 . 2]" 1
448 1 19 THR HB 1 89 GLN QG . . 5.030 4.907 4.205 5.122 0.092 20 0 "[ . 1 . 2]" 1
449 1 19 THR HB 1 90 LEU QD . . 5.300 4.143 3.337 4.703 . 0 0 "[ . 1 . 2]" 1
450 1 19 THR MG 1 20 ARG H . . 4.030 3.834 3.483 4.003 . 0 0 "[ . 1 . 2]" 1
451 1 19 THR MG 1 20 ARG QG . . 5.170 4.462 3.784 5.282 0.112 11 0 "[ . 1 . 2]" 1
452 1 19 THR MG 1 21 ALA H . . 4.670 4.070 3.762 4.420 . 0 0 "[ . 1 . 2]" 1
453 1 19 THR MG 1 22 GLY H . . 5.500 4.849 4.220 5.266 . 0 0 "[ . 1 . 2]" 1
454 1 19 THR MG 1 23 LYS H . . 4.310 3.750 3.225 4.249 . 0 0 "[ . 1 . 2]" 1
455 1 19 THR MG 1 23 LYS HB2 . . 3.740 3.758 3.011 3.855 0.115 1 0 "[ . 1 . 2]" 1
456 1 19 THR MG 1 23 LYS HB3 . . 4.200 4.257 3.939 4.335 0.135 20 0 "[ . 1 . 2]" 1
457 1 19 THR MG 1 25 PHE H . . 4.440 3.858 3.277 4.440 . 0 0 "[ . 1 . 2]" 1
458 1 19 THR MG 1 25 PHE HA . . 4.310 3.227 2.767 3.577 . 0 0 "[ . 1 . 2]" 1
459 1 19 THR MG 1 25 PHE HB2 . . 4.130 2.548 2.053 3.345 . 0 0 "[ . 1 . 2]" 1
460 1 19 THR MG 1 25 PHE HB3 . . 5.310 3.943 3.203 4.752 . 0 0 "[ . 1 . 2]" 1
461 1 19 THR MG 1 25 PHE QD . . 3.820 2.938 2.183 3.475 . 0 0 "[ . 1 . 2]" 1
462 1 19 THR MG 1 25 PHE QE . . 5.500 4.507 3.800 5.089 . 0 0 "[ . 1 . 2]" 1
463 1 19 THR MG 1 89 GLN HB2 . . 4.000 3.534 2.827 4.092 0.092 17 0 "[ . 1 . 2]" 1
464 1 19 THR MG 1 89 GLN HB3 . . 5.460 4.682 3.892 5.498 0.038 17 0 "[ . 1 . 2]" 1
465 1 19 THR MG 1 90 LEU HA . . 4.430 3.592 3.226 3.834 . 0 0 "[ . 1 . 2]" 1
466 1 19 THR MG 1 90 LEU QD . . 3.770 2.470 1.974 3.066 . 0 0 "[ . 1 . 2]" 1
467 1 19 THR MG 1 90 LEU HG . . 4.380 4.376 3.749 4.491 0.111 6 0 "[ . 1 . 2]" 1
468 1 20 ARG H 1 20 ARG HB2 . . 3.740 3.565 3.504 3.606 . 0 0 "[ . 1 . 2]" 1
469 1 20 ARG H 1 20 ARG HB3 . . 3.800 2.451 2.267 2.640 . 0 0 "[ . 1 . 2]" 1
470 1 20 ARG H 1 20 ARG HD2 . . 5.240 3.771 1.888 4.706 . 0 0 "[ . 1 . 2]" 1
471 1 20 ARG H 1 20 ARG HG2 . . 3.340 2.319 1.973 3.424 0.084 11 0 "[ . 1 . 2]" 1
472 1 20 ARG H 1 20 ARG QG . . 3.560 2.284 1.960 3.256 . 0 0 "[ . 1 . 2]" 1
473 1 20 ARG H 1 21 ALA H . . 3.550 2.873 2.694 3.066 . 0 0 "[ . 1 . 2]" 1
474 1 20 ARG H 1 21 ALA MB . . 4.980 4.533 4.384 4.693 . 0 0 "[ . 1 . 2]" 1
475 1 20 ARG H 1 22 GLY H . . 4.940 4.351 4.082 4.820 . 0 0 "[ . 1 . 2]" 1
476 1 20 ARG H 1 89 GLN HB2 . . 3.790 3.643 3.034 3.869 0.079 15 0 "[ . 1 . 2]" 1
477 1 20 ARG H 1 89 GLN HB3 . . 4.420 3.349 2.978 4.491 0.071 17 0 "[ . 1 . 2]" 1
478 1 20 ARG H 1 89 GLN QG . . 5.080 5.028 4.614 5.183 0.103 12 0 "[ . 1 . 2]" 1
479 1 20 ARG H 1 90 LEU H . . 5.350 4.913 4.424 5.162 . 0 0 "[ . 1 . 2]" 1
480 1 20 ARG H 1 90 LEU HA . . 4.560 3.624 3.259 4.070 . 0 0 "[ . 1 . 2]" 1
481 1 20 ARG H 1 90 LEU QD . . 5.190 4.485 4.085 4.898 . 0 0 "[ . 1 . 2]" 1
482 1 20 ARG H 1 91 ASN H . . 4.670 4.240 3.585 4.695 0.025 20 0 "[ . 1 . 2]" 1
483 1 20 ARG HA 1 20 ARG HD2 . . 4.450 4.547 4.050 4.876 0.426 20 0 "[ . 1 . 2]" 1
484 1 20 ARG HA 1 20 ARG QG . . 3.380 3.395 3.347 3.465 0.085 11 0 "[ . 1 . 2]" 1
485 1 20 ARG HA 1 21 ALA HA . . 5.420 4.771 4.674 4.839 . 0 0 "[ . 1 . 2]" 1
486 1 20 ARG HA 1 91 ASN HB2 . . 3.860 3.590 3.130 3.912 0.052 11 0 "[ . 1 . 2]" 1
487 1 20 ARG HA 1 91 ASN HB3 . . 5.500 5.246 4.535 5.573 0.073 1 0 "[ . 1 . 2]" 1
488 1 20 ARG HA 1 91 ASN HD21 . . 5.030 4.641 3.708 5.085 0.055 14 0 "[ . 1 . 2]" 1
489 1 20 ARG HA 1 91 ASN HD22 . . 5.020 4.885 3.889 5.098 0.078 10 0 "[ . 1 . 2]" 1
490 1 20 ARG HB2 1 21 ALA H . . 3.960 4.024 3.890 4.045 0.085 8 0 "[ . 1 . 2]" 1
491 1 20 ARG HB2 1 89 GLN HB3 . . 4.970 4.876 4.476 5.052 0.082 11 0 "[ . 1 . 2]" 1
492 1 20 ARG HB3 1 21 ALA H . . 4.750 4.163 3.883 4.364 . 0 0 "[ . 1 . 2]" 1
493 1 20 ARG HB3 1 21 ALA MB . . 5.500 5.431 4.949 5.580 0.080 13 0 "[ . 1 . 2]" 1
494 1 20 ARG HD2 1 89 GLN HA . . 5.160 4.137 3.154 5.918 0.758 20 2 "[ - 1 . +]" 1
495 1 20 ARG HD2 1 89 GLN HB3 . . 4.720 2.843 1.957 4.155 . 0 0 "[ . 1 . 2]" 1
496 1 20 ARG HD2 1 89 GLN QG . . 4.310 4.150 3.198 5.237 0.927 16 2 "[ . 1 .+ -]" 1
497 1 20 ARG QG 1 21 ALA HA . . 4.220 3.725 3.289 3.972 . 0 0 "[ . 1 . 2]" 1
498 1 20 ARG QG 1 21 ALA MB . . 3.640 3.157 2.575 3.421 . 0 0 "[ . 1 . 2]" 1
499 1 20 ARG QG 1 89 GLN HB2 . . 5.120 3.467 2.278 5.065 . 0 0 "[ . 1 . 2]" 1
500 1 20 ARG QG 1 89 GLN HB3 . . 4.930 2.757 2.177 4.049 . 0 0 "[ . 1 . 2]" 1
501 1 20 ARG QG 1 89 GLN QG . . 5.440 4.040 3.391 5.107 . 0 0 "[ . 1 . 2]" 1
502 1 20 ARG HG2 1 21 ALA H . . 4.610 2.809 2.220 3.204 . 0 0 "[ . 1 . 2]" 1
503 1 21 ALA H 1 21 ALA MB . . 3.060 2.278 2.215 2.382 . 0 0 "[ . 1 . 2]" 1
504 1 21 ALA H 1 22 GLY H . . 3.230 2.603 2.355 2.761 . 0 0 "[ . 1 . 2]" 1
505 1 21 ALA H 1 22 GLY HA2 . . 4.790 4.801 4.545 4.863 0.073 10 0 "[ . 1 . 2]" 1
506 1 21 ALA H 1 23 LYS H . . 4.210 3.785 3.539 4.062 . 0 0 "[ . 1 . 2]" 1
507 1 21 ALA HA 1 22 GLY HA3 . . 5.010 4.542 4.242 4.658 . 0 0 "[ . 1 . 2]" 1
508 1 21 ALA HA 1 23 LYS H . . 5.080 4.897 4.424 5.160 0.080 15 0 "[ . 1 . 2]" 1
509 1 21 ALA MB 1 22 GLY H . . 3.950 3.279 2.013 3.566 . 0 0 "[ . 1 . 2]" 1
510 1 21 ALA MB 1 22 GLY HA2 . . 5.500 4.781 4.235 5.023 . 0 0 "[ . 1 . 2]" 1
511 1 21 ALA MB 1 22 GLY HA3 . . 4.660 4.471 3.900 4.623 . 0 0 "[ . 1 . 2]" 1
512 1 21 ALA MB 1 23 LYS H . . 3.740 3.161 2.660 3.727 . 0 0 "[ . 1 . 2]" 1
513 1 21 ALA MB 1 23 LYS QE . . 4.420 3.799 2.119 4.525 0.105 19 0 "[ . 1 . 2]" 1
514 1 22 GLY H 1 23 LYS H . . 3.110 2.640 1.691 3.173 0.063 20 0 "[ . 1 . 2]" 1
515 1 22 GLY H 1 23 LYS QD . . 5.500 4.432 4.007 5.525 0.025 12 0 "[ . 1 . 2]" 1
516 1 22 GLY HA3 1 23 LYS HA . . 5.410 4.586 4.475 4.702 . 0 0 "[ . 1 . 2]" 1
517 1 23 LYS H 1 23 LYS HB2 . . 3.240 2.550 2.267 3.348 0.108 20 0 "[ . 1 . 2]" 1
518 1 23 LYS H 1 23 LYS HB3 . . 3.670 3.597 2.905 3.744 0.074 1 0 "[ . 1 . 2]" 1
519 1 23 LYS H 1 23 LYS QD . . 4.740 3.122 2.050 4.506 . 0 0 "[ . 1 . 2]" 1
520 1 23 LYS H 1 23 LYS QG . . 4.060 3.734 2.167 3.935 . 0 0 "[ . 1 . 2]" 1
521 1 23 LYS H 1 24 PRO HD2 . . 5.500 4.969 4.773 5.118 . 0 0 "[ . 1 . 2]" 1
522 1 23 LYS H 1 24 PRO HD3 . . 5.150 4.933 4.694 5.177 0.027 12 0 "[ . 1 . 2]" 1
523 1 23 LYS HA 1 23 LYS QD . . 3.400 3.251 2.766 3.544 0.144 15 0 "[ . 1 . 2]" 1
524 1 23 LYS HA 1 23 LYS QG . . 3.700 2.323 2.093 3.379 . 0 0 "[ . 1 . 2]" 1
525 1 23 LYS HA 1 24 PRO HD2 . . 3.190 2.603 2.340 2.903 . 0 0 "[ . 1 . 2]" 1
526 1 23 LYS HA 1 24 PRO HD3 . . 3.080 2.298 2.030 2.540 . 0 0 "[ . 1 . 2]" 1
527 1 23 LYS HA 1 24 PRO HG2 . . 4.710 4.657 4.511 4.783 0.073 13 0 "[ . 1 . 2]" 1
528 1 23 LYS HA 1 24 PRO HG3 . . 4.900 4.559 4.330 4.677 . 0 0 "[ . 1 . 2]" 1
529 1 23 LYS HB2 1 24 PRO HD2 . . 4.200 3.874 2.041 4.184 . 0 0 "[ . 1 . 2]" 1
530 1 23 LYS HB2 1 24 PRO HD3 . . 4.870 4.733 3.205 4.952 0.082 9 0 "[ . 1 . 2]" 1
531 1 23 LYS HB3 1 24 PRO HD2 . . 3.500 2.462 2.181 3.316 . 0 0 "[ . 1 . 2]" 1
532 1 23 LYS HB3 1 24 PRO HD3 . . 3.940 3.689 3.326 3.968 0.028 9 0 "[ . 1 . 2]" 1
533 1 23 LYS QD 1 24 PRO HD2 . . 5.060 4.644 3.178 4.988 . 0 0 "[ . 1 . 2]" 1
534 1 23 LYS QD 1 24 PRO HD3 . . 5.500 5.087 4.638 5.503 0.003 8 0 "[ . 1 . 2]" 1
535 1 23 LYS QG 1 24 PRO HD2 . . 4.880 2.981 2.441 3.652 . 0 0 "[ . 1 . 2]" 1
536 1 23 LYS QG 1 24 PRO HD3 . . 5.110 3.647 2.950 4.572 . 0 0 "[ . 1 . 2]" 1
537 1 23 LYS QG 1 24 PRO HG2 . . 5.500 4.951 4.517 5.291 . 0 0 "[ . 1 . 2]" 1
538 1 24 PRO HA 1 25 PHE H . . 2.930 2.197 2.033 2.454 . 0 0 "[ . 1 . 2]" 1
539 1 24 PRO HA 1 25 PHE HB2 . . 4.760 4.354 4.059 4.700 . 0 0 "[ . 1 . 2]" 1
540 1 24 PRO HA 1 25 PHE HB3 . . 4.990 4.352 3.852 4.598 . 0 0 "[ . 1 . 2]" 1
541 1 24 PRO HB2 1 25 PHE H . . 4.200 3.214 2.813 3.502 . 0 0 "[ . 1 . 2]" 1
542 1 24 PRO HB3 1 25 PHE H . . 3.840 3.820 3.457 3.913 0.073 17 0 "[ . 1 . 2]" 1
543 1 24 PRO HG2 1 25 PHE H . . 5.280 4.766 4.516 4.911 . 0 0 "[ . 1 . 2]" 1
544 1 24 PRO HG3 1 25 PHE H . . 5.500 5.496 5.267 5.581 0.081 15 0 "[ . 1 . 2]" 1
545 1 25 PHE H 1 25 PHE HB2 . . 3.690 2.695 2.449 3.075 . 0 0 "[ . 1 . 2]" 1
546 1 25 PHE H 1 25 PHE HB3 . . 3.050 2.273 2.010 2.435 . 0 0 "[ . 1 . 2]" 1
547 1 25 PHE H 1 25 PHE QD . . 4.350 4.105 3.789 4.243 . 0 0 "[ . 1 . 2]" 1
548 1 25 PHE H 1 26 ARG H . . 4.740 4.608 4.491 4.739 . 0 0 "[ . 1 . 2]" 1
549 1 25 PHE H 1 30 TRP HD1 . . 5.220 5.277 5.179 5.304 0.084 10 0 "[ . 1 . 2]" 1
550 1 25 PHE H 1 90 LEU QD . . 5.310 3.925 3.392 4.744 . 0 0 "[ . 1 . 2]" 1
551 1 25 PHE HA 1 25 PHE QD . . 3.400 2.614 2.272 3.177 . 0 0 "[ . 1 . 2]" 1
552 1 25 PHE HA 1 25 PHE QE . . 5.420 4.644 4.445 5.014 . 0 0 "[ . 1 . 2]" 1
553 1 25 PHE HA 1 26 ARG H . . 2.870 2.407 2.141 2.589 . 0 0 "[ . 1 . 2]" 1
554 1 25 PHE HA 1 26 ARG HB2 . . 4.750 4.648 4.210 5.586 0.836 18 2 "[ . 1 - + 2]" 1
555 1 25 PHE HA 1 90 LEU QD . . 5.470 4.201 3.956 4.602 . 0 0 "[ . 1 . 2]" 1
556 1 25 PHE HB2 1 90 LEU QD . . 3.450 2.364 2.066 2.918 . 0 0 "[ . 1 . 2]" 1
557 1 25 PHE HB3 1 26 ARG H . . 4.490 3.940 3.544 4.440 . 0 0 "[ . 1 . 2]" 1
558 1 25 PHE HB3 1 30 TRP HD1 . . 4.580 3.977 3.471 4.611 0.031 17 0 "[ . 1 . 2]" 1
559 1 25 PHE HB3 1 30 TRP HE1 . . 4.850 3.780 3.290 4.323 . 0 0 "[ . 1 . 2]" 1
560 1 25 PHE HB3 1 90 LEU QD . . 4.370 2.696 2.155 3.665 . 0 0 "[ . 1 . 2]" 1
561 1 25 PHE QD 1 26 ARG H . . 3.970 3.060 2.502 3.774 . 0 0 "[ . 1 . 2]" 1
562 1 25 PHE QD 1 26 ARG HA . . 5.310 4.321 3.844 4.634 . 0 0 "[ . 1 . 2]" 1
563 1 25 PHE QD 1 30 TRP H . . 5.500 5.060 4.447 5.548 0.048 5 0 "[ . 1 . 2]" 1
564 1 25 PHE QD 1 30 TRP HB2 . . 4.560 4.203 3.732 4.631 0.071 16 0 "[ . 1 . 2]" 1
565 1 25 PHE QD 1 30 TRP HB3 . . 4.470 3.568 2.984 4.153 . 0 0 "[ . 1 . 2]" 1
566 1 25 PHE QD 1 30 TRP HD1 . . 3.850 2.809 2.424 3.422 . 0 0 "[ . 1 . 2]" 1
567 1 25 PHE QD 1 30 TRP HE1 . . 4.390 3.642 3.059 4.213 . 0 0 "[ . 1 . 2]" 1
568 1 25 PHE QD 1 88 ASN HB3 . . 4.510 3.699 3.105 4.274 . 0 0 "[ . 1 . 2]" 1
569 1 25 PHE QD 1 90 LEU QD . . 3.830 2.720 2.322 2.955 . 0 0 "[ . 1 . 2]" 1
570 1 25 PHE QE 1 27 PRO HD2 . . 4.980 3.179 2.497 3.938 . 0 0 "[ . 1 . 2]" 1
571 1 25 PHE QE 1 30 TRP HD1 . . 5.120 4.176 3.130 5.088 . 0 0 "[ . 1 . 2]" 1
572 1 25 PHE QE 1 88 ASN HA . . 5.440 4.014 3.659 4.515 . 0 0 "[ . 1 . 2]" 1
573 1 25 PHE QE 1 88 ASN HB2 . . 4.540 4.248 3.733 4.618 0.078 13 0 "[ . 1 . 2]" 1
574 1 25 PHE QE 1 88 ASN HB3 . . 4.020 3.058 2.573 3.346 . 0 0 "[ . 1 . 2]" 1
575 1 25 PHE QE 1 90 LEU QD . . 3.660 3.331 2.896 3.475 . 0 0 "[ . 1 . 2]" 1
576 1 25 PHE HZ 1 27 PRO HD2 . . 4.700 3.896 2.864 4.654 . 0 0 "[ . 1 . 2]" 1
577 1 25 PHE HZ 1 27 PRO HD3 . . 5.350 4.921 4.232 5.392 0.042 6 0 "[ . 1 . 2]" 1
578 1 25 PHE HZ 1 88 ASN HB3 . . 4.380 3.354 2.677 3.752 . 0 0 "[ . 1 . 2]" 1
579 1 25 PHE HZ 1 88 ASN HD22 . . 4.790 4.253 3.300 4.859 0.069 17 0 "[ . 1 . 2]" 1
580 1 26 ARG H 1 26 ARG HB2 . . 3.430 2.750 2.383 3.822 0.392 15 0 "[ . 1 . 2]" 1
581 1 26 ARG H 1 26 ARG HB3 . . 4.060 3.635 2.793 3.842 . 0 0 "[ . 1 . 2]" 1
582 1 26 ARG H 1 26 ARG QD . . 5.130 4.330 2.681 4.878 . 0 0 "[ . 1 . 2]" 1
583 1 26 ARG H 1 26 ARG QG . . 4.340 3.497 2.302 4.344 0.004 2 0 "[ . 1 . 2]" 1
584 1 26 ARG H 1 90 LEU QD . . 5.500 4.997 4.666 5.393 . 0 0 "[ . 1 . 2]" 1
585 1 26 ARG HA 1 26 ARG QD . . 3.930 2.768 2.141 3.569 . 0 0 "[ . 1 . 2]" 1
586 1 26 ARG HA 1 27 PRO HA . . 3.090 2.488 2.256 2.767 . 0 0 "[ . 1 . 2]" 1
587 1 26 ARG HA 1 27 PRO QB . . 4.360 4.131 3.983 4.243 . 0 0 "[ . 1 . 2]" 1
588 1 26 ARG HA 1 28 SER H . . 4.460 3.154 2.641 3.579 . 0 0 "[ . 1 . 2]" 1
589 1 26 ARG HA 1 30 TRP HD1 . . 5.480 4.139 3.765 4.600 . 0 0 "[ . 1 . 2]" 1
590 1 26 ARG HB2 1 27 PRO HA . . 3.610 3.551 2.216 3.705 0.095 14 0 "[ . 1 . 2]" 1
591 1 26 ARG HB3 1 27 PRO HA . . 3.250 2.295 2.056 3.693 0.443 15 0 "[ . 1 . 2]" 1
592 1 26 ARG HB3 1 27 PRO QB . . 4.840 3.887 3.618 5.358 0.518 15 1 "[ . 1 + 2]" 1
593 1 26 ARG HB3 1 28 SER H . . 5.280 4.126 3.503 4.586 . 0 0 "[ . 1 . 2]" 1
594 1 26 ARG QD 1 27 PRO HA . . 4.730 2.853 1.909 4.614 . 0 0 "[ . 1 . 2]" 1
595 1 26 ARG QD 1 28 SER H . . 5.500 3.131 2.145 5.190 . 0 0 "[ . 1 . 2]" 1
596 1 26 ARG QD 1 28 SER QB . . 4.770 3.914 2.958 4.593 . 0 0 "[ . 1 . 2]" 1
597 1 27 PRO HA 1 28 SER H . . 3.540 2.395 2.100 2.554 . 0 0 "[ . 1 . 2]" 1
598 1 27 PRO HA 1 29 ASP H . . 4.940 3.979 3.542 4.408 . 0 0 "[ . 1 . 2]" 1
599 1 27 PRO QB 1 28 SER H . . 4.090 2.939 2.612 3.268 . 0 0 "[ . 1 . 2]" 1
600 1 27 PRO QB 1 28 SER QB . . 5.500 4.627 4.275 5.095 . 0 0 "[ . 1 . 2]" 1
601 1 27 PRO QB 1 29 ASP H . . 3.230 2.469 1.984 3.037 . 0 0 "[ . 1 . 2]" 1
602 1 27 PRO QB 1 30 TRP H . . 4.320 3.553 3.137 3.965 . 0 0 "[ . 1 . 2]" 1
603 1 27 PRO QG 1 28 SER H . . 5.500 4.407 4.160 4.646 . 0 0 "[ . 1 . 2]" 1
604 1 27 PRO QG 1 28 SER HA . . 5.260 5.147 4.893 5.312 0.052 4 0 "[ . 1 . 2]" 1
605 1 27 PRO QG 1 29 ASP H . . 4.500 3.758 2.798 4.305 . 0 0 "[ . 1 . 2]" 1
606 1 27 PRO QG 1 30 TRP H . . 4.360 2.943 2.403 3.521 . 0 0 "[ . 1 . 2]" 1
607 1 27 PRO QG 1 30 TRP HA . . 5.500 3.125 2.500 4.061 . 0 0 "[ . 1 . 2]" 1
608 1 27 PRO QG 1 30 TRP HB2 . . 5.500 3.911 3.331 4.659 . 0 0 "[ . 1 . 2]" 1
609 1 27 PRO QG 1 30 TRP HB3 . . 4.010 2.705 2.322 3.405 . 0 0 "[ . 1 . 2]" 1
610 1 28 SER H 1 29 ASP H . . 3.680 2.502 2.287 2.663 . 0 0 "[ . 1 . 2]" 1
611 1 28 SER H 1 30 TRP H . . 5.500 4.332 4.132 4.495 . 0 0 "[ . 1 . 2]" 1
612 1 28 SER HA 1 30 TRP H . . 4.220 3.587 3.172 3.916 . 0 0 "[ . 1 . 2]" 1
613 1 28 SER HA 1 30 TRP HD1 . . 3.310 2.927 2.278 3.383 0.073 2 0 "[ . 1 . 2]" 1
614 1 28 SER HA 1 30 TRP HE1 . . 4.820 4.276 3.579 4.830 0.010 19 0 "[ . 1 . 2]" 1
615 1 28 SER HA 1 62 ARG QD . . 5.040 3.900 2.322 5.141 0.101 4 0 "[ . 1 . 2]" 1
616 1 28 SER HA 1 62 ARG QG . . 5.400 4.500 3.263 5.260 . 0 0 "[ . 1 . 2]" 1
617 1 28 SER QB 1 29 ASP H . . 4.090 3.097 2.653 3.771 . 0 0 "[ . 1 . 2]" 1
618 1 28 SER QB 1 30 TRP H . . 5.500 4.618 4.405 4.882 . 0 0 "[ . 1 . 2]" 1
619 1 28 SER QB 1 62 ARG QD . . 4.590 3.117 2.011 4.481 . 0 0 "[ . 1 . 2]" 1
620 1 28 SER QB 1 62 ARG QG . . 5.500 3.804 3.190 4.734 . 0 0 "[ . 1 . 2]" 1
621 1 29 ASP H 1 29 ASP QB . . 3.520 2.382 2.089 2.655 . 0 0 "[ . 1 . 2]" 1
622 1 29 ASP H 1 30 TRP H . . 2.930 2.868 2.649 2.998 0.068 9 0 "[ . 1 . 2]" 1
623 1 29 ASP H 1 31 VAL H . . 5.140 4.996 4.692 5.213 0.073 10 0 "[ . 1 . 2]" 1
624 1 29 ASP HA 1 30 TRP HA . . 5.390 4.920 4.847 4.996 . 0 0 "[ . 1 . 2]" 1
625 1 29 ASP HA 1 31 VAL H . . 4.430 3.660 3.275 4.263 . 0 0 "[ . 1 . 2]" 1
626 1 29 ASP HA 1 31 VAL HB . . 5.220 4.002 3.417 4.678 . 0 0 "[ . 1 . 2]" 1
627 1 29 ASP HA 1 32 ASP H . . 4.180 3.418 2.996 3.941 . 0 0 "[ . 1 . 2]" 1
628 1 29 ASP HA 1 32 ASP HB3 . . 5.440 4.910 3.476 5.992 0.552 14 1 "[ . 1 +. 2]" 1
629 1 29 ASP HA 1 33 ARG H . . 5.330 4.792 4.156 5.400 0.070 8 0 "[ . 1 . 2]" 1
630 1 29 ASP QB 1 30 TRP H . . 5.030 3.533 3.172 4.074 . 0 0 "[ . 1 . 2]" 1
631 1 29 ASP QB 1 32 ASP H . . 4.670 4.033 3.631 4.544 . 0 0 "[ . 1 . 2]" 1
632 1 29 ASP QB 1 33 ARG QG . . 5.500 3.445 2.537 4.758 . 0 0 "[ . 1 . 2]" 1
633 1 30 TRP H 1 30 TRP HB2 . . 3.730 3.565 3.522 3.598 . 0 0 "[ . 1 . 2]" 1
634 1 30 TRP H 1 30 TRP HB3 . . 3.650 2.380 2.295 2.442 . 0 0 "[ . 1 . 2]" 1
635 1 30 TRP H 1 30 TRP HD1 . . 3.090 2.827 2.547 3.115 0.025 11 0 "[ . 1 . 2]" 1
636 1 30 TRP H 1 30 TRP HE1 . . 5.500 4.915 4.678 5.189 . 0 0 "[ . 1 . 2]" 1
637 1 30 TRP H 1 31 VAL H . . 3.660 2.807 2.590 2.951 . 0 0 "[ . 1 . 2]" 1
638 1 30 TRP H 1 31 VAL HB . . 5.500 4.792 4.447 5.100 . 0 0 "[ . 1 . 2]" 1
639 1 30 TRP H 1 31 VAL MG2 . . 5.420 4.011 3.512 4.459 . 0 0 "[ . 1 . 2]" 1
640 1 30 TRP H 1 32 ASP H . . 4.880 4.476 4.208 4.955 0.075 14 0 "[ . 1 . 2]" 1
641 1 30 TRP HA 1 30 TRP HD1 . . 4.910 4.668 4.542 4.777 . 0 0 "[ . 1 . 2]" 1
642 1 30 TRP HA 1 30 TRP HE3 . . 5.180 4.079 3.912 4.311 . 0 0 "[ . 1 . 2]" 1
643 1 30 TRP HA 1 31 VAL HA . . 5.480 4.913 4.759 5.033 . 0 0 "[ . 1 . 2]" 1
644 1 30 TRP HA 1 32 ASP H . . 4.700 4.280 3.970 4.675 . 0 0 "[ . 1 . 2]" 1
645 1 30 TRP HA 1 33 ARG H . . 3.730 3.399 3.103 3.736 0.006 14 0 "[ . 1 . 2]" 1
646 1 30 TRP HA 1 33 ARG QB . . 3.370 2.650 2.019 3.465 0.095 9 0 "[ . 1 . 2]" 1
647 1 30 TRP HA 1 33 ARG QD . . 4.400 3.556 2.494 4.465 0.065 3 0 "[ . 1 . 2]" 1
648 1 30 TRP HA 1 33 ARG QG . . 4.870 2.813 2.070 3.643 . 0 0 "[ . 1 . 2]" 1
649 1 30 TRP HA 1 34 MET H . . 5.170 4.256 3.862 4.779 . 0 0 "[ . 1 . 2]" 1
650 1 30 TRP HA 1 84 PHE HZ . . 5.160 4.410 3.912 5.236 0.076 4 0 "[ . 1 . 2]" 1
651 1 30 TRP HB2 1 30 TRP HD1 . . 3.850 3.799 3.742 3.856 0.006 3 0 "[ . 1 . 2]" 1
652 1 30 TRP HB2 1 84 PHE HZ . . 5.070 2.595 2.227 3.591 . 0 0 "[ . 1 . 2]" 1
653 1 30 TRP HB3 1 30 TRP HE3 . . 4.180 4.175 4.113 4.239 0.059 5 0 "[ . 1 . 2]" 1
654 1 30 TRP HB3 1 84 PHE HZ . . 4.200 3.949 3.273 5.023 0.823 4 1 "[ +. 1 . 2]" 1
655 1 30 TRP HD1 1 31 VAL H . . 4.330 3.826 3.437 4.144 . 0 0 "[ . 1 . 2]" 1
656 1 30 TRP HD1 1 31 VAL MG2 . . 4.470 3.645 3.161 3.940 . 0 0 "[ . 1 . 2]" 1
657 1 30 TRP HE1 1 31 VAL H . . 5.500 4.511 4.061 4.887 . 0 0 "[ . 1 . 2]" 1
658 1 30 TRP HE1 1 31 VAL MG2 . . 4.760 3.024 2.613 3.390 . 0 0 "[ . 1 . 2]" 1
659 1 30 TRP HE1 1 61 VAL QG . . 5.500 4.142 3.710 4.705 . 0 0 "[ . 1 . 2]" 1
660 1 30 TRP HE1 1 62 ARG HB2 . . 5.430 3.899 3.547 5.101 . 0 0 "[ . 1 . 2]" 1
661 1 30 TRP HE1 1 62 ARG HB3 . . 5.210 5.300 5.190 5.520 0.310 9 0 "[ . 1 . 2]" 1
662 1 30 TRP HE3 1 31 VAL MG2 . . 4.890 3.844 3.505 4.395 . 0 0 "[ . 1 . 2]" 1
663 1 30 TRP HE3 1 34 MET ME . . 4.480 3.924 2.454 4.513 0.033 19 0 "[ . 1 . 2]" 1
664 1 30 TRP HE3 1 34 MET HG2 . . 4.420 3.167 2.271 4.178 . 0 0 "[ . 1 . 2]" 1
665 1 30 TRP HE3 1 34 MET HG3 . . 4.400 2.749 2.232 3.622 . 0 0 "[ . 1 . 2]" 1
666 1 30 TRP HE3 1 64 LEU QD . . 3.800 3.540 3.000 3.852 0.052 2 0 "[ . 1 . 2]" 1
667 1 30 TRP HH2 1 31 VAL MG2 . . 4.280 3.643 2.921 4.327 0.047 14 0 "[ . 1 . 2]" 1
668 1 30 TRP HH2 1 63 CYS HA . . 4.470 3.743 3.173 4.416 . 0 0 "[ . 1 . 2]" 1
669 1 30 TRP HH2 1 64 LEU H . . 3.860 3.341 2.673 3.910 0.050 3 0 "[ . 1 . 2]" 1
670 1 30 TRP HH2 1 64 LEU HA . . 5.170 4.933 4.404 5.239 0.069 10 0 "[ . 1 . 2]" 1
671 1 30 TRP HH2 1 64 LEU HB2 . . 3.950 2.847 2.367 3.352 . 0 0 "[ . 1 . 2]" 1
672 1 30 TRP HH2 1 64 LEU HB3 . . 4.770 2.775 2.177 3.713 . 0 0 "[ . 1 . 2]" 1
673 1 30 TRP HH2 1 64 LEU QD . . 5.080 3.438 3.061 3.689 . 0 0 "[ . 1 . 2]" 1
674 1 30 TRP HH2 1 90 LEU QD . . 4.360 3.799 2.952 4.390 0.030 8 0 "[ . 1 . 2]" 1
675 1 30 TRP HZ2 1 31 VAL MG2 . . 3.690 3.177 2.823 3.787 0.097 14 0 "[ . 1 . 2]" 1
676 1 30 TRP HZ2 1 61 VAL QG . . 5.500 4.274 3.936 4.990 . 0 0 "[ . 1 . 2]" 1
677 1 30 TRP HZ2 1 63 CYS HA . . 3.470 2.753 2.242 3.529 0.059 2 0 "[ . 1 . 2]" 1
678 1 30 TRP HZ2 1 63 CYS QB . . 5.300 4.596 3.863 5.399 0.099 5 0 "[ . 1 . 2]" 1
679 1 30 TRP HZ2 1 64 LEU H . . 4.200 4.039 3.609 4.264 0.064 4 0 "[ . 1 . 2]" 1
680 1 30 TRP HZ2 1 90 LEU QD . . 4.840 3.629 2.898 4.650 . 0 0 "[ . 1 . 2]" 1
681 1 30 TRP HZ3 1 31 VAL HA . . 5.500 3.804 3.415 4.150 . 0 0 "[ . 1 . 2]" 1
682 1 30 TRP HZ3 1 34 MET ME . . 4.600 3.485 2.363 4.384 . 0 0 "[ . 1 . 2]" 1
683 1 30 TRP HZ3 1 34 MET HG2 . . 4.500 4.029 3.190 4.931 0.431 10 0 "[ . 1 . 2]" 1
684 1 30 TRP HZ3 1 34 MET HG3 . . 4.880 2.885 2.318 4.114 . 0 0 "[ . 1 . 2]" 1
685 1 30 TRP HZ3 1 64 LEU HB2 . . 4.360 3.301 2.637 3.787 . 0 0 "[ . 1 . 2]" 1
686 1 30 TRP HZ3 1 64 LEU HB3 . . 4.870 3.332 2.518 4.316 . 0 0 "[ . 1 . 2]" 1
687 1 30 TRP HZ3 1 64 LEU QD . . 3.560 2.334 2.115 2.556 . 0 0 "[ . 1 . 2]" 1
688 1 31 VAL H 1 31 VAL HB . . 3.460 2.336 2.176 2.525 . 0 0 "[ . 1 . 2]" 1
689 1 31 VAL H 1 31 VAL MG1 . . 4.300 3.699 3.637 3.758 . 0 0 "[ . 1 . 2]" 1
690 1 31 VAL H 1 31 VAL MG2 . . 3.380 2.073 1.780 2.350 . 0 0 "[ . 1 . 2]" 1
691 1 31 VAL H 1 32 ASP H . . 3.470 2.782 2.690 3.037 . 0 0 "[ . 1 . 2]" 1
692 1 31 VAL H 1 33 ARG H . . 4.630 4.026 3.725 4.285 . 0 0 "[ . 1 . 2]" 1
693 1 31 VAL HA 1 31 VAL MG1 . . 3.510 2.557 2.438 2.732 . 0 0 "[ . 1 . 2]" 1
694 1 31 VAL HA 1 31 VAL MG2 . . 3.500 2.313 2.165 2.584 . 0 0 "[ . 1 . 2]" 1
695 1 31 VAL HA 1 33 ARG H . . 4.670 4.389 3.967 4.718 0.048 20 0 "[ . 1 . 2]" 1
696 1 31 VAL HA 1 34 MET H . . 4.480 3.734 3.394 4.071 . 0 0 "[ . 1 . 2]" 1
697 1 31 VAL HA 1 64 LEU HB2 . . 5.380 3.339 2.814 4.109 . 0 0 "[ . 1 . 2]" 1
698 1 31 VAL HA 1 64 LEU QD . . 4.730 2.628 1.988 3.248 . 0 0 "[ . 1 . 2]" 1
699 1 31 VAL HB 1 32 ASP H . . 3.320 2.699 2.368 3.357 0.037 4 0 "[ . 1 . 2]" 1
700 1 31 VAL HB 1 33 ARG H . . 5.350 4.838 4.538 5.167 . 0 0 "[ . 1 . 2]" 1
701 1 31 VAL HB 1 62 ARG HB2 . . 5.280 4.232 3.067 5.353 0.073 14 0 "[ . 1 . 2]" 1
702 1 31 VAL HB 1 62 ARG HB3 . . 5.500 3.745 2.306 5.147 . 0 0 "[ . 1 . 2]" 1
703 1 31 VAL MG1 1 32 ASP H . . 4.130 3.433 3.157 3.790 . 0 0 "[ . 1 . 2]" 1
704 1 31 VAL MG1 1 32 ASP HA . . 4.520 3.498 3.208 3.837 . 0 0 "[ . 1 . 2]" 1
705 1 31 VAL MG1 1 33 ARG H . . 4.930 4.988 4.863 5.031 0.101 4 0 "[ . 1 . 2]" 1
706 1 31 VAL MG1 1 35 CYS H . . 5.500 4.468 3.639 4.948 . 0 0 "[ . 1 . 2]" 1
707 1 31 VAL MG1 1 55 PRO HA . . 3.370 2.657 2.211 3.321 . 0 0 "[ . 1 . 2]" 1
708 1 31 VAL MG1 1 55 PRO HB2 . . 3.270 3.222 2.918 3.354 0.084 9 0 "[ . 1 . 2]" 1
709 1 31 VAL MG1 1 55 PRO HB3 . . 3.860 2.105 2.014 2.256 . 0 0 "[ . 1 . 2]" 1
710 1 31 VAL MG1 1 55 PRO QD . . 5.000 3.458 3.210 3.757 . 0 0 "[ . 1 . 2]" 1
711 1 31 VAL MG1 1 55 PRO HG2 . . 4.580 4.560 4.448 4.669 0.089 13 0 "[ . 1 . 2]" 1
712 1 31 VAL MG1 1 55 PRO HG3 . . 3.800 3.785 3.498 3.878 0.078 6 0 "[ . 1 . 2]" 1
713 1 31 VAL MG1 1 56 ARG H . . 4.330 3.761 3.122 4.420 0.090 14 0 "[ . 1 . 2]" 1
714 1 31 VAL MG1 1 62 ARG QG . . 5.270 4.298 3.521 4.732 . 0 0 "[ . 1 . 2]" 1
715 1 31 VAL MG1 1 63 CYS H . . 5.500 4.595 3.991 5.369 . 0 0 "[ . 1 . 2]" 1
716 1 31 VAL MG1 1 64 LEU H . . 5.280 4.709 3.648 5.365 0.085 9 0 "[ . 1 . 2]" 1
717 1 31 VAL MG1 1 64 LEU HA . . 4.900 3.087 2.459 3.873 . 0 0 "[ . 1 . 2]" 1
718 1 31 VAL MG1 1 64 LEU HB2 . . 3.770 2.897 2.093 3.881 0.111 12 0 "[ . 1 . 2]" 1
719 1 31 VAL MG1 1 64 LEU QD . . 3.660 2.328 2.040 2.838 . 0 0 "[ . 1 . 2]" 1
720 1 31 VAL MG2 1 32 ASP H . . 4.560 3.955 3.736 4.262 . 0 0 "[ . 1 . 2]" 1
721 1 31 VAL MG2 1 55 PRO HA . . 5.500 4.225 3.933 4.733 . 0 0 "[ . 1 . 2]" 1
722 1 31 VAL MG2 1 56 ARG H . . 5.500 4.621 4.051 5.188 . 0 0 "[ . 1 . 2]" 1
723 1 31 VAL MG2 1 62 ARG H . . 5.500 4.464 3.895 5.067 . 0 0 "[ . 1 . 2]" 1
724 1 31 VAL MG2 1 62 ARG HB2 . . 3.880 2.325 2.119 2.772 . 0 0 "[ . 1 . 2]" 1
725 1 31 VAL MG2 1 62 ARG HB3 . . 4.160 2.394 2.072 3.934 . 0 0 "[ . 1 . 2]" 1
726 1 31 VAL MG2 1 62 ARG QD . . 5.500 3.468 2.651 4.182 . 0 0 "[ . 1 . 2]" 1
727 1 31 VAL MG2 1 62 ARG QG . . 4.910 3.251 2.002 3.831 . 0 0 "[ . 1 . 2]" 1
728 1 31 VAL MG2 1 63 CYS H . . 4.930 3.079 2.246 3.944 . 0 0 "[ . 1 . 2]" 1
729 1 31 VAL MG2 1 63 CYS HA . . 4.580 3.582 2.817 4.638 0.058 14 0 "[ . 1 . 2]" 1
730 1 31 VAL MG2 1 64 LEU H . . 4.900 4.207 2.869 4.845 . 0 0 "[ . 1 . 2]" 1
731 1 31 VAL MG2 1 64 LEU HA . . 4.970 3.989 3.518 4.615 . 0 0 "[ . 1 . 2]" 1
732 1 31 VAL MG2 1 64 LEU HB2 . . 4.230 2.747 2.183 3.508 . 0 0 "[ . 1 . 2]" 1
733 1 31 VAL MG2 1 64 LEU HB3 . . 5.230 4.090 3.375 4.859 . 0 0 "[ . 1 . 2]" 1
734 1 31 VAL MG2 1 64 LEU QD . . 4.700 3.310 2.847 3.764 . 0 0 "[ . 1 . 2]" 1
735 1 32 ASP H 1 32 ASP HB2 . . 3.170 2.293 2.028 2.522 . 0 0 "[ . 1 . 2]" 1
736 1 32 ASP H 1 32 ASP HB3 . . 3.680 3.219 2.522 3.605 . 0 0 "[ . 1 . 2]" 1
737 1 32 ASP H 1 33 ARG H . . 3.240 2.363 2.164 2.666 . 0 0 "[ . 1 . 2]" 1
738 1 32 ASP H 1 33 ARG QB . . 4.610 4.445 4.078 4.684 0.074 8 0 "[ . 1 . 2]" 1
739 1 32 ASP H 1 34 MET H . . 4.560 4.101 3.747 4.386 . 0 0 "[ . 1 . 2]" 1
740 1 32 ASP H 1 35 CYS H . . 5.490 4.858 4.693 5.229 . 0 0 "[ . 1 . 2]" 1
741 1 32 ASP HA 1 35 CYS HB3 . . 3.890 3.809 2.884 4.582 0.692 1 1 "[+ . 1 . 2]" 1
742 1 32 ASP HA 1 64 LEU QD . . 5.500 4.540 4.160 4.977 . 0 0 "[ . 1 . 2]" 1
743 1 32 ASP HB2 1 33 ARG H . . 3.470 3.329 2.348 4.017 0.547 8 1 "[ . + 1 . 2]" 1
744 1 32 ASP HB2 1 33 ARG QG . . 5.340 4.567 3.826 5.919 0.579 6 1 "[ .+ 1 . 2]" 1
745 1 32 ASP HB2 1 34 MET H . . 5.370 5.522 4.820 6.120 0.750 8 3 "[ .- + 1 . * 2]" 1
746 1 32 ASP HB3 1 33 ARG H . . 3.970 3.365 2.758 3.869 . 0 0 "[ . 1 . 2]" 1
747 1 33 ARG H 1 33 ARG QB . . 3.060 2.450 2.220 2.660 . 0 0 "[ . 1 . 2]" 1
748 1 33 ARG H 1 33 ARG QD . . 5.150 4.301 3.961 4.593 . 0 0 "[ . 1 . 2]" 1
749 1 33 ARG H 1 33 ARG QG . . 3.680 2.591 2.306 3.019 . 0 0 "[ . 1 . 2]" 1
750 1 33 ARG H 1 34 MET H . . 3.070 2.671 2.420 2.925 . 0 0 "[ . 1 . 2]" 1
751 1 33 ARG HA 1 33 ARG QG . . 3.800 2.436 2.171 3.397 . 0 0 "[ . 1 . 2]" 1
752 1 33 ARG QB 1 34 MET H . . 3.210 2.662 2.174 3.326 0.116 9 0 "[ . 1 . 2]" 1
753 1 33 ARG QG 1 34 MET H . . 5.500 4.077 2.008 4.528 . 0 0 "[ . 1 . 2]" 1
754 1 34 MET H 1 34 MET HB2 . . 3.340 2.391 2.085 2.702 . 0 0 "[ . 1 . 2]" 1
755 1 34 MET H 1 34 MET HB3 . . 4.010 3.573 3.393 3.658 . 0 0 "[ . 1 . 2]" 1
756 1 34 MET H 1 34 MET ME . . 5.500 4.828 4.300 5.253 . 0 0 "[ . 1 . 2]" 1
757 1 34 MET H 1 34 MET HG2 . . 4.230 2.825 2.015 3.716 . 0 0 "[ . 1 . 2]" 1
758 1 34 MET H 1 34 MET HG3 . . 3.650 3.507 2.521 4.171 0.521 18 1 "[ . 1 . + 2]" 1
759 1 34 MET H 1 35 CYS H . . 3.510 2.817 2.120 3.016 . 0 0 "[ . 1 . 2]" 1
760 1 34 MET H 1 36 SER H . . 5.300 4.300 3.941 4.538 . 0 0 "[ . 1 . 2]" 1
761 1 34 MET H 1 37 THR HB . . 5.500 5.289 4.942 5.576 0.076 10 0 "[ . 1 . 2]" 1
762 1 34 MET H 1 64 LEU QD . . 5.140 3.867 3.525 4.328 . 0 0 "[ . 1 . 2]" 1
763 1 34 MET HA 1 34 MET ME . . 3.990 3.641 2.984 4.084 0.094 16 0 "[ . 1 . 2]" 1
764 1 34 MET HA 1 37 THR H . . 3.920 3.438 3.049 3.892 . 0 0 "[ . 1 . 2]" 1
765 1 34 MET HA 1 37 THR HB . . 3.580 2.718 2.347 3.033 . 0 0 "[ . 1 . 2]" 1
766 1 34 MET HA 1 37 THR MG . . 4.250 3.941 3.541 4.323 0.073 18 0 "[ . 1 . 2]" 1
767 1 34 MET HA 1 38 TYR QD . . 4.710 3.717 2.665 4.263 . 0 0 "[ . 1 . 2]" 1
768 1 34 MET HA 1 38 TYR QE . . 5.070 4.210 3.315 4.822 . 0 0 "[ . 1 . 2]" 1
769 1 34 MET HA 1 81 LEU QD . . 5.500 4.459 4.017 4.950 . 0 0 "[ . 1 . 2]" 1
770 1 34 MET HB2 1 35 CYS H . . 3.820 2.712 2.387 3.048 . 0 0 "[ . 1 . 2]" 1
771 1 34 MET HB2 1 35 CYS HA . . 5.400 4.536 4.071 4.886 . 0 0 "[ . 1 . 2]" 1
772 1 34 MET HB2 1 64 LEU QD . . 4.250 2.173 1.975 2.647 . 0 0 "[ . 1 . 2]" 1
773 1 34 MET HB3 1 34 MET ME . . 3.820 3.002 2.205 3.926 0.106 18 0 "[ . 1 . 2]" 1
774 1 34 MET HB3 1 35 CYS H . . 3.990 3.428 2.936 4.043 0.053 1 0 "[ . 1 . 2]" 1
775 1 34 MET HB3 1 37 THR HB . . 5.190 4.602 4.183 5.038 . 0 0 "[ . 1 . 2]" 1
776 1 34 MET HB3 1 38 TYR QD . . 4.220 4.049 3.384 4.310 0.090 17 0 "[ . 1 . 2]" 1
777 1 34 MET HB3 1 38 TYR QE . . 5.270 4.544 3.556 5.292 0.022 15 0 "[ . 1 . 2]" 1
778 1 34 MET HB3 1 64 LEU QD . . 4.110 2.349 2.103 2.964 . 0 0 "[ . 1 . 2]" 1
779 1 34 MET HB3 1 81 LEU QD . . 4.540 3.086 2.555 3.753 . 0 0 "[ . 1 . 2]" 1
780 1 34 MET ME 1 34 MET HG3 . . 3.550 2.494 2.160 3.156 . 0 0 "[ . 1 . 2]" 1
781 1 34 MET ME 1 38 TYR QD . . 5.380 4.486 3.478 5.294 . 0 0 "[ . 1 . 2]" 1
782 1 34 MET ME 1 38 TYR QE . . 4.090 3.387 2.472 4.190 0.100 5 0 "[ . 1 . 2]" 1
783 1 34 MET ME 1 64 LEU QD . . 4.040 3.302 1.965 4.080 0.040 4 0 "[ . 1 . 2]" 1
784 1 34 MET ME 1 81 LEU HA . . 3.630 2.743 2.236 3.564 . 0 0 "[ . 1 . 2]" 1
785 1 34 MET ME 1 81 LEU QD . . 3.620 2.475 1.566 3.289 . 0 0 "[ . 1 . 2]" 1
786 1 34 MET ME 1 81 LEU HG . . 2.720 2.390 2.065 2.869 0.149 14 0 "[ . 1 . 2]" 1
787 1 34 MET ME 1 84 PHE HB2 . . 4.100 3.030 2.341 4.185 0.085 12 0 "[ . 1 . 2]" 1
788 1 34 MET ME 1 84 PHE HB3 . . 4.320 2.635 1.988 3.398 . 0 0 "[ . 1 . 2]" 1
789 1 34 MET ME 1 84 PHE QD . . 3.380 2.681 2.405 3.419 0.039 9 0 "[ . 1 . 2]" 1
790 1 34 MET ME 1 84 PHE QE . . 4.270 3.362 2.669 3.938 . 0 0 "[ . 1 . 2]" 1
791 1 34 MET ME 1 84 PHE HZ . . 4.520 4.294 3.015 4.614 0.094 1 0 "[ . 1 . 2]" 1
792 1 34 MET ME 1 85 ALA H . . 4.830 4.673 3.710 4.928 0.098 2 0 "[ . 1 . 2]" 1
793 1 34 MET HG2 1 35 CYS H . . 5.500 4.644 4.064 5.086 . 0 0 "[ . 1 . 2]" 1
794 1 34 MET HG2 1 64 LEU QD . . 4.120 3.540 2.593 4.129 0.009 10 0 "[ . 1 . 2]" 1
795 1 34 MET HG2 1 81 LEU QD . . 5.500 4.445 3.675 5.038 . 0 0 "[ . 1 . 2]" 1
796 1 34 MET HG3 1 35 CYS H . . 5.500 4.930 4.572 5.361 . 0 0 "[ . 1 . 2]" 1
797 1 34 MET HG3 1 64 LEU QD . . 4.580 2.769 2.096 3.851 . 0 0 "[ . 1 . 2]" 1
798 1 34 MET HG3 1 81 LEU QD . . 4.600 3.867 2.922 5.068 0.468 13 0 "[ . 1 . 2]" 1
799 1 35 CYS H 1 35 CYS HB2 . . 4.140 3.249 2.039 3.708 . 0 0 "[ . 1 . 2]" 1
800 1 35 CYS H 1 35 CYS HB3 . . 3.360 2.775 2.296 3.626 0.266 11 0 "[ . 1 . 2]" 1
801 1 35 CYS H 1 64 LEU QD . . 4.880 3.259 2.527 3.684 . 0 0 "[ . 1 . 2]" 1
802 1 35 CYS HA 1 38 TYR H . . 4.560 3.725 3.242 4.518 . 0 0 "[ . 1 . 2]" 1
803 1 35 CYS HA 1 38 TYR HB2 . . 5.190 3.501 2.727 4.152 . 0 0 "[ . 1 . 2]" 1
804 1 35 CYS HA 1 49 TYR QD . . 5.440 4.390 3.613 5.080 . 0 0 "[ . 1 . 2]" 1
805 1 35 CYS HA 1 53 LEU QB . . 4.540 3.013 2.483 3.581 . 0 0 "[ . 1 . 2]" 1
806 1 35 CYS HA 1 53 LEU QD . . 3.770 2.574 1.905 3.468 . 0 0 "[ . 1 . 2]" 1
807 1 35 CYS HA 1 64 LEU QD . . 5.490 3.716 2.495 4.611 . 0 0 "[ . 1 . 2]" 1
808 1 35 CYS HB2 1 36 SER H . . 3.950 3.604 2.467 4.029 0.079 4 0 "[ . 1 . 2]" 1
809 1 35 CYS HB2 1 49 TYR QD . . 4.810 3.476 2.570 4.774 . 0 0 "[ . 1 . 2]" 1
810 1 35 CYS HB2 1 49 TYR QE . . 4.940 4.111 3.140 4.676 . 0 0 "[ . 1 . 2]" 1
811 1 35 CYS HB3 1 36 SER H . . 4.170 3.760 2.413 4.212 0.042 14 0 "[ . 1 . 2]" 1
812 1 35 CYS HB3 1 49 TYR QD . . 4.990 4.098 2.623 4.853 . 0 0 "[ . 1 . 2]" 1
813 1 35 CYS HB3 1 49 TYR QE . . 5.310 4.568 2.610 5.388 0.078 14 0 "[ . 1 . 2]" 1
814 1 35 CYS HB3 1 53 LEU QD . . 5.500 3.800 3.020 5.591 0.091 7 0 "[ . 1 . 2]" 1
815 1 36 SER H 1 36 SER HB2 . . 3.090 2.650 2.022 3.581 0.491 16 0 "[ . 1 . 2]" 1
816 1 36 SER H 1 36 SER HB3 . . 3.550 3.095 2.146 3.601 0.051 2 0 "[ . 1 . 2]" 1
817 1 36 SER H 1 37 THR H . . 3.350 2.729 2.399 2.906 . 0 0 "[ . 1 . 2]" 1
818 1 36 SER H 1 37 THR HB . . 5.340 4.920 4.517 5.149 . 0 0 "[ . 1 . 2]" 1
819 1 36 SER H 1 38 TYR H . . 4.890 4.258 3.685 4.687 . 0 0 "[ . 1 . 2]" 1
820 1 36 SER H 1 39 ALA MB . . 5.500 4.348 4.097 4.518 . 0 0 "[ . 1 . 2]" 1
821 1 36 SER H 1 49 TYR QE . . 4.590 3.605 3.217 3.935 . 0 0 "[ . 1 . 2]" 1
822 1 36 SER HA 1 36 SER HB2 . . 2.910 2.777 2.248 2.996 0.086 20 0 "[ . 1 . 2]" 1
823 1 36 SER HA 1 36 SER HB3 . . 3.010 2.564 2.358 3.045 0.035 18 0 "[ . 1 . 2]" 1
824 1 36 SER HA 1 38 TYR H . . 5.330 4.038 3.553 4.626 . 0 0 "[ . 1 . 2]" 1
825 1 36 SER HA 1 39 ALA H . . 4.290 3.890 3.192 4.355 0.065 7 0 "[ . 1 . 2]" 1
826 1 36 SER HA 1 39 ALA MB . . 3.710 2.306 2.002 2.555 . 0 0 "[ . 1 . 2]" 1
827 1 36 SER HA 1 47 LEU QD . . 5.320 2.729 2.332 3.420 . 0 0 "[ . 1 . 2]" 1
828 1 36 SER HA 1 49 TYR QD . . 3.740 2.917 2.344 3.811 0.071 18 0 "[ . 1 . 2]" 1
829 1 36 SER HA 1 49 TYR QE . . 3.150 2.632 2.115 3.233 0.083 2 0 "[ . 1 . 2]" 1
830 1 36 SER HB2 1 37 THR H . . 3.410 3.279 2.632 4.055 0.645 13 1 "[ . 1 + . 2]" 1
831 1 36 SER HB2 1 39 ALA MB . . 5.500 4.505 3.676 4.965 . 0 0 "[ . 1 . 2]" 1
832 1 36 SER HB2 1 47 LEU QD . . 5.500 3.706 2.179 4.712 . 0 0 "[ . 1 . 2]" 1
833 1 36 SER HB2 1 49 TYR QE . . 4.420 3.788 2.552 4.487 0.067 8 0 "[ . 1 . 2]" 1
834 1 36 SER HB3 1 37 THR H . . 4.120 3.623 2.271 4.177 0.057 10 0 "[ . 1 . 2]" 1
835 1 36 SER HB3 1 39 ALA MB . . 5.500 4.206 3.279 4.988 . 0 0 "[ . 1 . 2]" 1
836 1 36 SER HB3 1 49 TYR QE . . 5.500 3.693 2.321 4.878 . 0 0 "[ . 1 . 2]" 1
837 1 37 THR H 1 37 THR HB . . 2.960 2.507 2.276 2.886 . 0 0 "[ . 1 . 2]" 1
838 1 37 THR H 1 37 THR MG . . 4.110 3.761 3.700 3.836 . 0 0 "[ . 1 . 2]" 1
839 1 37 THR H 1 38 TYR H . . 3.230 2.711 2.337 3.197 . 0 0 "[ . 1 . 2]" 1
840 1 37 THR H 1 38 TYR HB2 . . 5.500 4.816 4.025 5.445 . 0 0 "[ . 1 . 2]" 1
841 1 37 THR H 1 38 TYR QD . . 4.740 4.070 3.278 4.731 . 0 0 "[ . 1 . 2]" 1
842 1 37 THR H 1 39 ALA H . . 4.530 4.434 3.992 4.606 0.076 5 0 "[ . 1 . 2]" 1
843 1 37 THR H 1 39 ALA MB . . 5.500 4.475 4.155 4.713 . 0 0 "[ . 1 . 2]" 1
844 1 37 THR HA 1 37 THR MG . . 3.300 2.431 2.287 2.574 . 0 0 "[ . 1 . 2]" 1
845 1 37 THR HA 1 38 TYR QD . . 5.350 4.769 4.225 5.153 . 0 0 "[ . 1 . 2]" 1
846 1 37 THR HA 1 39 ALA H . . 4.690 3.959 3.762 4.387 . 0 0 "[ . 1 . 2]" 1
847 1 37 THR HB 1 38 TYR H . . 3.560 3.066 2.420 3.591 0.031 2 0 "[ . 1 . 2]" 1
848 1 37 THR HB 1 38 TYR HA . . 5.010 4.790 4.318 5.076 0.066 2 0 "[ . 1 . 2]" 1
849 1 37 THR HB 1 38 TYR QD . . 3.380 2.589 2.138 3.304 . 0 0 "[ . 1 . 2]" 1
850 1 37 THR HB 1 38 TYR QE . . 5.060 3.402 3.053 3.802 . 0 0 "[ . 1 . 2]" 1
851 1 37 THR MG 1 38 TYR H . . 4.550 3.850 3.471 4.242 . 0 0 "[ . 1 . 2]" 1
852 1 37 THR MG 1 38 TYR HA . . 4.680 4.044 3.600 4.425 . 0 0 "[ . 1 . 2]" 1
853 1 37 THR MG 1 38 TYR HB2 . . 5.500 4.882 4.575 5.260 . 0 0 "[ . 1 . 2]" 1
854 1 37 THR MG 1 38 TYR QD . . 4.030 3.192 2.664 3.646 . 0 0 "[ . 1 . 2]" 1
855 1 37 THR MG 1 38 TYR QE . . 3.000 2.958 2.478 3.105 0.105 13 0 "[ . 1 . 2]" 1
856 1 37 THR MG 1 39 ALA H . . 4.990 4.960 4.629 5.091 0.101 4 0 "[ . 1 . 2]" 1
857 1 38 TYR H 1 38 TYR HB2 . . 3.450 2.455 2.271 2.682 . 0 0 "[ . 1 . 2]" 1
858 1 38 TYR H 1 38 TYR HB3 . . 3.860 3.658 3.527 3.823 . 0 0 "[ . 1 . 2]" 1
859 1 38 TYR H 1 38 TYR QE . . 5.500 4.911 4.352 5.365 . 0 0 "[ . 1 . 2]" 1
860 1 38 TYR H 1 39 ALA H . . 3.360 2.706 2.172 3.227 . 0 0 "[ . 1 . 2]" 1
861 1 38 TYR H 1 39 ALA MB . . 4.410 3.607 3.062 4.014 . 0 0 "[ . 1 . 2]" 1
862 1 38 TYR HA 1 38 TYR QD . . 3.150 2.927 2.527 3.211 0.061 16 0 "[ . 1 . 2]" 1
863 1 38 TYR HA 1 39 ALA H . . 3.420 2.949 2.474 3.353 . 0 0 "[ . 1 . 2]" 1
864 1 38 TYR HA 1 39 ALA MB . . 5.500 4.609 4.358 4.879 . 0 0 "[ . 1 . 2]" 1
865 1 38 TYR HB2 1 39 ALA H . . 4.680 4.142 3.582 4.409 . 0 0 "[ . 1 . 2]" 1
866 1 38 TYR HB2 1 53 LEU QD . . 4.060 2.209 2.038 2.452 . 0 0 "[ . 1 . 2]" 1
867 1 38 TYR HB3 1 39 ALA H . . 4.890 4.434 4.154 4.553 . 0 0 "[ . 1 . 2]" 1
868 1 38 TYR HB3 1 53 LEU QD . . 4.150 2.686 2.144 3.264 . 0 0 "[ . 1 . 2]" 1
869 1 38 TYR QD 1 53 LEU QD . . 2.950 2.637 2.105 3.094 0.144 13 0 "[ . 1 . 2]" 1
870 1 38 TYR QD 1 70 LEU QD . . 4.130 3.143 2.284 4.094 . 0 0 "[ . 1 . 2]" 1
871 1 38 TYR QD 1 74 ASN QD . . 4.770 3.863 3.077 4.647 . 0 0 "[ . 1 . 2]" 1
872 1 38 TYR QD 1 77 GLY HA3 . . 5.010 4.062 3.760 4.495 . 0 0 "[ . 1 . 2]" 1
873 1 38 TYR QD 1 81 LEU QD . . 5.500 3.175 2.754 3.590 . 0 0 "[ . 1 . 2]" 1
874 1 38 TYR QE 1 70 LEU QD . . 4.720 3.478 2.192 4.365 . 0 0 "[ . 1 . 2]" 1
875 1 38 TYR QE 1 74 ASN QD . . 4.570 3.537 2.368 4.350 . 0 0 "[ . 1 . 2]" 1
876 1 38 TYR QE 1 77 GLY H . . 5.380 4.570 3.959 5.178 . 0 0 "[ . 1 . 2]" 1
877 1 38 TYR QE 1 77 GLY HA2 . . 4.490 2.910 2.171 3.557 . 0 0 "[ . 1 . 2]" 1
878 1 38 TYR QE 1 77 GLY HA3 . . 3.510 2.486 2.113 3.018 . 0 0 "[ . 1 . 2]" 1
879 1 38 TYR QE 1 78 PHE H . . 4.930 4.531 3.770 5.026 0.096 5 0 "[ . 1 . 2]" 1
880 1 38 TYR QE 1 80 GLN HB3 . . 5.500 4.889 4.278 5.574 0.074 2 0 "[ . 1 . 2]" 1
881 1 38 TYR QE 1 81 LEU HB2 . . 4.700 3.917 3.184 4.762 0.063 10 0 "[ . 1 . 2]" 1
882 1 38 TYR QE 1 81 LEU QD . . 4.260 2.577 2.045 3.145 . 0 0 "[ . 1 . 2]" 1
883 1 38 TYR QE 1 81 LEU HG . . 4.340 4.091 3.276 4.450 0.110 14 0 "[ . 1 . 2]" 1
884 1 39 ALA H 1 39 ALA MB . . 3.100 2.394 2.134 2.637 . 0 0 "[ . 1 . 2]" 1
885 1 39 ALA H 1 40 SER H . . 4.370 4.424 4.357 4.456 0.086 12 0 "[ . 1 . 2]" 1
886 1 39 ALA H 1 47 LEU QD . . 5.500 4.104 3.557 5.007 . 0 0 "[ . 1 . 2]" 1
887 1 39 ALA HA 1 40 SER H . . 2.880 2.519 2.312 2.685 . 0 0 "[ . 1 . 2]" 1
888 1 39 ALA HA 1 40 SER QB . . 4.520 4.347 3.782 4.585 0.065 6 0 "[ . 1 . 2]" 1
889 1 39 ALA HA 1 49 TYR HA . . 3.520 3.215 2.566 3.585 0.065 6 0 "[ . 1 . 2]" 1
890 1 39 ALA HA 1 50 SER H . . 4.110 3.264 2.656 3.721 . 0 0 "[ . 1 . 2]" 1
891 1 39 ALA MB 1 40 SER H . . 3.430 2.246 2.027 2.687 . 0 0 "[ . 1 . 2]" 1
892 1 39 ALA MB 1 40 SER HA . . 5.030 3.877 3.580 4.126 . 0 0 "[ . 1 . 2]" 1
893 1 39 ALA MB 1 40 SER QB . . 5.070 4.481 4.170 4.657 . 0 0 "[ . 1 . 2]" 1
894 1 39 ALA MB 1 41 PHE H . . 5.500 5.295 4.852 5.574 0.074 6 0 "[ . 1 . 2]" 1
895 1 39 ALA MB 1 47 LEU QD . . 3.900 1.960 1.778 2.688 . 0 0 "[ . 1 . 2]" 1
896 1 39 ALA MB 1 48 ARG H . . 4.560 2.991 2.169 3.610 . 0 0 "[ . 1 . 2]" 1
897 1 39 ALA MB 1 49 TYR H . . 5.350 3.759 3.522 4.127 . 0 0 "[ . 1 . 2]" 1
898 1 39 ALA MB 1 49 TYR HA . . 3.630 2.126 1.896 2.733 . 0 0 "[ . 1 . 2]" 1
899 1 39 ALA MB 1 49 TYR HB2 . . 5.500 4.560 4.289 5.094 . 0 0 "[ . 1 . 2]" 1
900 1 39 ALA MB 1 49 TYR HB3 . . 5.410 3.875 3.412 4.411 . 0 0 "[ . 1 . 2]" 1
901 1 39 ALA MB 1 49 TYR QD . . 3.080 2.203 1.982 2.550 . 0 0 "[ . 1 . 2]" 1
902 1 39 ALA MB 1 50 SER H . . 4.820 3.278 2.809 3.998 . 0 0 "[ . 1 . 2]" 1
903 1 40 SER H 1 40 SER QB . . 3.470 3.087 2.624 3.465 . 0 0 "[ . 1 . 2]" 1
904 1 40 SER H 1 41 PHE HA . . 4.990 4.794 4.408 5.042 0.052 7 0 "[ . 1 . 2]" 1
905 1 40 SER H 1 47 LEU HA . . 4.690 4.291 3.467 4.675 . 0 0 "[ . 1 . 2]" 1
906 1 40 SER H 1 47 LEU QD . . 4.810 2.946 2.251 4.177 . 0 0 "[ . 1 . 2]" 1
907 1 40 SER H 1 48 ARG H . . 3.670 2.851 2.272 3.152 . 0 0 "[ . 1 . 2]" 1
908 1 40 SER H 1 48 ARG HA . . 5.160 5.090 4.842 5.245 0.085 11 0 "[ . 1 . 2]" 1
909 1 40 SER H 1 48 ARG HB2 . . 4.910 4.194 3.218 4.973 0.063 10 0 "[ . 1 . 2]" 1
910 1 40 SER H 1 48 ARG HB3 . . 4.420 4.307 3.631 4.509 0.089 17 0 "[ . 1 . 2]" 1
911 1 40 SER H 1 49 TYR HA . . 4.830 4.256 3.872 4.645 . 0 0 "[ . 1 . 2]" 1
912 1 40 SER H 1 50 SER H . . 5.240 5.117 4.490 5.315 0.075 17 0 "[ . 1 . 2]" 1
913 1 40 SER HA 1 41 PHE H . . 2.970 2.327 2.144 2.503 . 0 0 "[ . 1 . 2]" 1
914 1 40 SER HA 1 41 PHE QB . . 4.360 4.290 4.268 4.305 . 0 0 "[ . 1 . 2]" 1
915 1 40 SER HA 1 41 PHE QD . . 4.480 3.863 3.066 4.422 . 0 0 "[ . 1 . 2]" 1
916 1 40 SER HA 1 47 LEU HA . . 5.090 4.634 4.003 5.112 0.022 9 0 "[ . 1 . 2]" 1
917 1 40 SER HA 1 47 LEU QD . . 4.930 3.357 2.405 4.516 . 0 0 "[ . 1 . 2]" 1
918 1 40 SER QB 1 41 PHE H . . 3.280 2.660 2.135 3.229 . 0 0 "[ . 1 . 2]" 1
919 1 40 SER QB 1 41 PHE QB . . 5.500 4.084 3.718 4.829 . 0 0 "[ . 1 . 2]" 1
920 1 40 SER QB 1 41 PHE QD . . 5.500 4.875 4.182 5.219 . 0 0 "[ . 1 . 2]" 1
921 1 41 PHE H 1 41 PHE QB . . 3.350 2.139 2.038 2.320 . 0 0 "[ . 1 . 2]" 1
922 1 41 PHE H 1 41 PHE QD . . 4.300 2.850 2.187 3.235 . 0 0 "[ . 1 . 2]" 1
923 1 41 PHE H 1 41 PHE QE . . 5.010 4.947 4.393 5.108 0.098 8 0 "[ . 1 . 2]" 1
924 1 41 PHE H 1 42 GLY H . . 4.830 4.561 4.380 4.755 . 0 0 "[ . 1 . 2]" 1
925 1 41 PHE H 1 47 LEU QD . . 5.500 3.841 3.058 5.100 . 0 0 "[ . 1 . 2]" 1
926 1 41 PHE HA 1 41 PHE QD . . 3.650 2.438 2.067 3.074 . 0 0 "[ . 1 . 2]" 1
927 1 41 PHE HA 1 42 GLY H . . 2.780 2.179 1.960 2.381 . 0 0 "[ . 1 . 2]" 1
928 1 41 PHE HA 1 42 GLY HA2 . . 4.480 4.446 4.335 4.511 0.031 18 0 "[ . 1 . 2]" 1
929 1 41 PHE HA 1 45 ARG HA . . 5.330 4.336 3.512 5.332 0.002 15 0 "[ . 1 . 2]" 1
930 1 41 PHE HA 1 47 LEU H . . 4.920 3.729 2.310 4.770 . 0 0 "[ . 1 . 2]" 1
931 1 41 PHE HA 1 47 LEU HA . . 4.110 2.215 1.885 2.545 . 0 0 "[ . 1 . 2]" 1
932 1 41 PHE HA 1 48 ARG H . . 4.250 3.522 3.031 4.295 0.045 7 0 "[ . 1 . 2]" 1
933 1 41 PHE QB 1 42 GLY H . . 3.810 3.002 2.614 3.285 . 0 0 "[ . 1 . 2]" 1
934 1 41 PHE QB 1 42 GLY HA3 . . 4.850 4.679 4.536 4.732 . 0 0 "[ . 1 . 2]" 1
935 1 41 PHE QB 1 45 ARG HA . . 4.120 2.673 2.071 3.227 . 0 0 "[ . 1 . 2]" 1
936 1 41 PHE QB 1 45 ARG HG3 . . 5.500 4.160 2.787 5.381 . 0 0 "[ . 1 . 2]" 1
937 1 41 PHE QB 1 46 LYS H . . 4.930 3.824 2.957 4.656 . 0 0 "[ . 1 . 2]" 1
938 1 41 PHE QB 1 47 LEU HA . . 5.170 4.178 3.720 4.450 . 0 0 "[ . 1 . 2]" 1
939 1 41 PHE QD 1 42 GLY H . . 4.930 4.171 3.926 4.462 . 0 0 "[ . 1 . 2]" 1
940 1 41 PHE QD 1 45 ARG HA . . 4.140 2.503 1.860 3.096 . 0 0 "[ . 1 . 2]" 1
941 1 41 PHE QD 1 46 LYS HA . . 4.670 4.328 3.212 4.743 0.073 15 0 "[ . 1 . 2]" 1
942 1 41 PHE QD 1 47 LEU H . . 4.350 3.494 2.122 4.419 0.069 20 0 "[ . 1 . 2]" 1
943 1 41 PHE QD 1 47 LEU HA . . 4.450 2.425 2.080 3.458 . 0 0 "[ . 1 . 2]" 1
944 1 41 PHE QD 1 47 LEU QB . . 5.260 3.456 1.899 3.949 . 0 0 "[ . 1 . 2]" 1
945 1 41 PHE QD 1 47 LEU QD . . 4.110 2.659 1.988 3.604 . 0 0 "[ . 1 . 2]" 1
946 1 41 PHE QD 1 47 LEU HG . . 5.500 2.984 2.217 5.416 . 0 0 "[ . 1 . 2]" 1
947 1 41 PHE QE 1 45 ARG HA . . 4.810 3.883 3.167 4.885 0.075 20 0 "[ . 1 . 2]" 1
948 1 41 PHE QE 1 46 LYS HA . . 4.550 3.969 3.315 4.644 0.094 19 0 "[ . 1 . 2]" 1
949 1 41 PHE QE 1 47 LEU H . . 5.500 3.453 2.698 4.597 . 0 0 "[ . 1 . 2]" 1
950 1 41 PHE QE 1 47 LEU HA . . 4.530 3.714 3.357 4.305 . 0 0 "[ . 1 . 2]" 1
951 1 41 PHE QE 1 47 LEU QB . . 4.290 2.957 2.170 3.483 . 0 0 "[ . 1 . 2]" 1
952 1 41 PHE QE 1 47 LEU QD . . 4.240 2.670 1.924 3.211 . 0 0 "[ . 1 . 2]" 1
953 1 41 PHE QE 1 47 LEU HG . . 5.330 2.701 2.041 5.023 . 0 0 "[ . 1 . 2]" 1
954 1 41 PHE HZ 1 47 LEU QB . . 5.500 4.642 3.450 5.376 . 0 0 "[ . 1 . 2]" 1
955 1 41 PHE HZ 1 47 LEU HG . . 5.280 4.877 4.261 5.372 0.092 17 0 "[ . 1 . 2]" 1
956 1 42 GLY H 1 45 ARG HA . . 4.810 4.083 3.236 4.887 0.077 15 0 "[ . 1 . 2]" 1
957 1 42 GLY H 1 46 LYS H . . 4.060 3.055 2.259 4.115 0.055 9 0 "[ . 1 . 2]" 1
958 1 42 GLY H 1 46 LYS QB . . 4.660 4.376 3.809 4.778 0.118 6 0 "[ . 1 . 2]" 1
959 1 42 GLY H 1 47 LEU HA . . 4.040 3.741 3.006 4.116 0.076 6 0 "[ . 1 . 2]" 1
960 1 42 GLY H 1 48 ARG QG . . 4.990 4.495 3.146 5.071 0.081 20 0 "[ . 1 . 2]" 1
961 1 42 GLY HA2 1 43 ALA HA . . 4.620 4.411 4.131 4.695 0.075 15 0 "[ . 1 . 2]" 1
962 1 42 GLY HA2 1 43 ALA MB . . 5.500 4.217 3.802 5.079 . 0 0 "[ . 1 . 2]" 1
963 1 42 GLY HA3 1 43 ALA MB . . 5.020 4.291 4.006 4.493 . 0 0 "[ . 1 . 2]" 1
964 1 42 GLY HA3 1 44 ASP H . . 4.000 3.628 2.935 4.770 0.770 20 1 "[ . 1 . +]" 1
965 1 42 GLY HA3 1 46 LYS H . . 5.500 4.594 3.433 5.634 0.134 20 0 "[ . 1 . 2]" 1
966 1 43 ALA H 1 44 ASP H . . 4.000 3.056 2.560 3.900 . 0 0 "[ . 1 . 2]" 1
967 1 43 ALA HA 1 44 ASP H . . 3.490 3.412 2.137 3.555 0.065 16 0 "[ . 1 . 2]" 1
968 1 43 ALA HA 1 45 ARG H . . 4.340 3.732 3.377 4.242 . 0 0 "[ . 1 . 2]" 1
969 1 43 ALA HA 1 45 ARG QD . . 5.140 4.604 3.320 5.227 0.087 11 0 "[ . 1 . 2]" 1
970 1 43 ALA MB 1 44 ASP H . . 3.870 2.881 2.271 3.468 . 0 0 "[ . 1 . 2]" 1
971 1 43 ALA MB 1 44 ASP HA . . 4.570 4.022 3.753 4.693 0.123 20 0 "[ . 1 . 2]" 1
972 1 43 ALA MB 1 44 ASP HB2 . . 5.500 3.813 3.277 4.297 . 0 0 "[ . 1 . 2]" 1
973 1 44 ASP H 1 44 ASP HB2 . . 3.820 2.416 1.916 3.363 . 0 0 "[ . 1 . 2]" 1
974 1 44 ASP H 1 44 ASP HB3 . . 3.480 2.817 2.346 3.891 0.411 20 0 "[ . 1 . 2]" 1
975 1 44 ASP H 1 45 ARG HA . . 4.820 4.691 4.199 4.899 0.079 17 0 "[ . 1 . 2]" 1
976 1 44 ASP H 1 46 LYS H . . 4.280 3.871 3.116 4.352 0.072 6 0 "[ . 1 . 2]" 1
977 1 44 ASP H 1 46 LYS QB . . 5.500 4.747 4.266 5.231 . 0 0 "[ . 1 . 2]" 1
978 1 44 ASP HA 1 44 ASP HB2 . . 2.990 2.639 2.475 3.031 0.041 19 0 "[ . 1 . 2]" 1
979 1 44 ASP HA 1 44 ASP HB3 . . 2.990 2.983 2.388 3.045 0.055 6 0 "[ . 1 . 2]" 1
980 1 44 ASP HA 1 45 ARG HB2 . . 5.500 4.553 4.206 4.888 . 0 0 "[ . 1 . 2]" 1
981 1 44 ASP HB2 1 45 ARG H . . 4.340 4.276 3.735 4.554 0.214 20 0 "[ . 1 . 2]" 1
982 1 44 ASP HB2 1 46 LYS H . . 5.330 4.707 2.937 5.566 0.236 3 0 "[ . 1 . 2]" 1
983 1 44 ASP HB3 1 45 ARG H . . 4.860 3.843 3.422 4.415 . 0 0 "[ . 1 . 2]" 1
984 1 44 ASP HB3 1 46 LYS QB . . 5.050 3.092 2.454 4.153 . 0 0 "[ . 1 . 2]" 1
985 1 45 ARG H 1 45 ARG HA . . 2.860 2.245 2.190 2.332 . 0 0 "[ . 1 . 2]" 1
986 1 45 ARG H 1 45 ARG HB2 . . 3.840 3.511 3.125 3.756 . 0 0 "[ . 1 . 2]" 1
987 1 45 ARG H 1 45 ARG QD . . 4.340 2.934 2.224 4.280 . 0 0 "[ . 1 . 2]" 1
988 1 45 ARG H 1 45 ARG HG3 . . 3.890 3.368 2.756 4.301 0.411 3 0 "[ . 1 . 2]" 1
989 1 45 ARG H 1 46 LYS H . . 3.360 2.931 2.707 3.188 . 0 0 "[ . 1 . 2]" 1
990 1 45 ARG H 1 46 LYS QB . . 5.250 4.634 4.235 5.177 . 0 0 "[ . 1 . 2]" 1
991 1 45 ARG HA 1 45 ARG QD . . 3.560 3.204 2.212 3.652 0.092 16 0 "[ . 1 . 2]" 1
992 1 45 ARG HA 1 45 ARG HE . . 5.320 4.864 4.493 5.364 0.044 2 0 "[ . 1 . 2]" 1
993 1 45 ARG HA 1 45 ARG HG2 . . 3.860 3.351 2.357 3.705 . 0 0 "[ . 1 . 2]" 1
994 1 45 ARG HA 1 45 ARG HG3 . . 3.860 2.631 2.161 3.778 . 0 0 "[ . 1 . 2]" 1
995 1 45 ARG HA 1 46 LYS HA . . 5.080 4.390 4.148 4.598 . 0 0 "[ . 1 . 2]" 1
996 1 45 ARG HA 1 46 LYS QB . . 5.490 4.684 4.353 5.204 . 0 0 "[ . 1 . 2]" 1
997 1 45 ARG HB2 1 45 ARG QD . . 3.210 2.613 2.163 3.308 0.098 3 0 "[ . 1 . 2]" 1
998 1 45 ARG HB3 1 45 ARG HG2 . . 2.900 2.399 2.228 2.984 0.084 3 0 "[ . 1 . 2]" 1
999 1 45 ARG HB3 1 45 ARG HG3 . . 2.910 2.637 2.434 2.975 0.065 6 0 "[ . 1 . 2]" 1
1000 1 46 LYS H 1 46 LYS QB . . 3.270 2.530 2.292 2.771 . 0 0 "[ . 1 . 2]" 1
1001 1 46 LYS H 1 46 LYS QD . . 4.930 4.290 3.251 4.728 . 0 0 "[ . 1 . 2]" 1
1002 1 46 LYS H 1 47 LEU H . . 4.490 3.823 2.373 4.563 0.073 9 0 "[ . 1 . 2]" 1
1003 1 46 LYS HA 1 46 LYS HG2 . . 3.860 3.150 2.187 3.956 0.096 6 0 "[ . 1 . 2]" 1
1004 1 46 LYS HA 1 46 LYS HG3 . . 3.650 2.943 2.194 3.761 0.111 12 0 "[ . 1 . 2]" 1
1005 1 46 LYS HA 1 47 LEU H . . 2.810 2.415 2.030 2.886 0.076 15 0 "[ . 1 . 2]" 1
1006 1 46 LYS HA 1 47 LEU QB . . 4.650 4.038 3.604 4.533 . 0 0 "[ . 1 . 2]" 1
1007 1 46 LYS HA 1 47 LEU QD . . 5.410 4.912 2.935 5.186 . 0 0 "[ . 1 . 2]" 1
1008 1 46 LYS QB 1 47 LEU H . . 4.060 3.464 2.290 3.962 . 0 0 "[ . 1 . 2]" 1
1009 1 46 LYS QD 1 47 LEU H . . 5.200 4.297 2.160 5.305 0.105 12 0 "[ . 1 . 2]" 1
1010 1 46 LYS QE 1 46 LYS HG2 . . 3.130 2.488 2.169 3.203 0.073 12 0 "[ . 1 . 2]" 1
1011 1 46 LYS QE 1 46 LYS HG3 . . 3.340 2.593 2.165 3.384 0.044 14 0 "[ . 1 . 2]" 1
1012 1 46 LYS HG2 1 47 LEU H . . 5.030 4.091 2.387 5.787 0.757 18 2 "[ . - 1 . + 2]" 1
1013 1 47 LEU H 1 47 LEU QB . . 3.250 2.392 1.969 2.989 . 0 0 "[ . 1 . 2]" 1
1014 1 47 LEU H 1 47 LEU QD . . 4.330 3.549 1.739 4.037 . 0 0 "[ . 1 . 2]" 1
1015 1 47 LEU H 1 47 LEU HG . . 4.060 3.652 2.401 4.150 0.090 9 0 "[ . 1 . 2]" 1
1016 1 47 LEU HA 1 47 LEU QD . . 3.490 2.375 1.975 3.307 . 0 0 "[ . 1 . 2]" 1
1017 1 47 LEU HA 1 48 ARG H . . 2.800 2.296 2.191 2.659 . 0 0 "[ . 1 . 2]" 1
1018 1 47 LEU HA 1 48 ARG HB2 . . 4.620 4.167 3.800 4.620 . 20 0 "[ . 1 . 2]" 1
1019 1 47 LEU QB 1 48 ARG H . . 3.940 3.157 2.291 3.674 . 0 0 "[ . 1 . 2]" 1
1020 1 47 LEU QB 1 48 ARG HA . . 4.700 4.158 3.802 4.463 . 0 0 "[ . 1 . 2]" 1
1021 1 47 LEU QB 1 49 TYR QE . . 5.460 4.124 3.219 4.546 . 0 0 "[ . 1 . 2]" 1
1022 1 47 LEU QD 1 48 ARG H . . 4.390 2.286 1.694 3.438 . 0 0 "[ . 1 . 2]" 1
1023 1 47 LEU QD 1 49 TYR H . . 5.500 3.892 2.961 4.772 . 0 0 "[ . 1 . 2]" 1
1024 1 47 LEU QD 1 49 TYR QD . . 4.230 3.129 2.309 3.967 . 0 0 "[ . 1 . 2]" 1
1025 1 47 LEU QD 1 49 TYR QE . . 3.490 2.656 1.962 3.491 0.001 4 0 "[ . 1 . 2]" 1
1026 1 47 LEU HG 1 48 ARG H . . 4.500 4.018 2.864 4.571 0.071 12 0 "[ . 1 . 2]" 1
1027 1 48 ARG H 1 48 ARG HB2 . . 3.780 2.717 2.280 3.085 . 0 0 "[ . 1 . 2]" 1
1028 1 48 ARG H 1 48 ARG HB3 . . 3.630 3.438 2.958 3.706 0.076 6 0 "[ . 1 . 2]" 1
1029 1 48 ARG H 1 48 ARG QD . . 4.580 4.266 3.105 4.675 0.095 7 0 "[ . 1 . 2]" 1
1030 1 48 ARG H 1 48 ARG QG . . 4.250 3.972 3.389 4.311 0.061 10 0 "[ . 1 . 2]" 1
1031 1 48 ARG HA 1 48 ARG QD . . 4.080 2.729 2.017 4.042 . 0 0 "[ . 1 . 2]" 1
1032 1 48 ARG HA 1 48 ARG QG . . 3.640 2.397 2.185 2.765 . 0 0 "[ . 1 . 2]" 1
1033 1 48 ARG HA 1 49 TYR H . . 2.900 2.159 2.089 2.214 . 0 0 "[ . 1 . 2]" 1
1034 1 48 ARG HA 1 49 TYR HB2 . . 4.600 4.584 4.371 4.675 0.075 15 0 "[ . 1 . 2]" 1
1035 1 48 ARG HA 1 49 TYR QD . . 4.600 4.568 4.175 4.702 0.102 19 0 "[ . 1 . 2]" 1
1036 1 48 ARG HB2 1 48 ARG QD . . 3.800 3.005 2.164 3.513 . 0 0 "[ . 1 . 2]" 1
1037 1 48 ARG HB2 1 48 ARG QG . . 2.690 2.265 2.148 2.512 . 0 0 "[ . 1 . 2]" 1
1038 1 48 ARG HB3 1 48 ARG QD . . 3.830 2.642 2.211 3.350 . 0 0 "[ . 1 . 2]" 1
1039 1 48 ARG HB3 1 49 TYR H . . 4.170 3.908 3.421 4.251 0.081 1 0 "[ . 1 . 2]" 1
1040 1 48 ARG QD 1 49 TYR H . . 5.500 3.720 2.524 5.589 0.089 6 0 "[ . 1 . 2]" 1
1041 1 48 ARG QG 1 49 TYR H . . 4.760 4.115 3.675 4.532 . 0 0 "[ . 1 . 2]" 1
1042 1 49 TYR H 1 49 TYR HB2 . . 3.370 2.533 2.453 2.648 . 0 0 "[ . 1 . 2]" 1
1043 1 49 TYR H 1 49 TYR HB3 . . 3.830 3.585 3.500 3.637 . 0 0 "[ . 1 . 2]" 1
1044 1 49 TYR H 1 49 TYR QD . . 3.340 3.049 2.803 3.208 . 0 0 "[ . 1 . 2]" 1
1045 1 49 TYR H 1 49 TYR QE . . 4.640 4.460 4.205 4.708 0.068 1 0 "[ . 1 . 2]" 1
1046 1 49 TYR H 1 50 SER H . . 4.960 4.606 4.525 4.693 . 0 0 "[ . 1 . 2]" 1
1047 1 49 TYR HA 1 49 TYR QD . . 3.180 2.287 2.155 2.670 . 0 0 "[ . 1 . 2]" 1
1048 1 49 TYR HA 1 50 SER H . . 3.520 2.239 2.102 2.437 . 0 0 "[ . 1 . 2]" 1
1049 1 49 TYR HA 1 50 SER HA . . 4.420 4.427 4.355 4.486 0.066 7 0 "[ . 1 . 2]" 1
1050 1 49 TYR HB2 1 50 SER H . . 4.740 3.934 3.547 4.252 . 0 0 "[ . 1 . 2]" 1
1051 1 49 TYR HB3 1 50 SER H . . 4.370 2.983 2.492 3.377 . 0 0 "[ . 1 . 2]" 1
1052 1 49 TYR QD 1 50 SER H . . 4.090 4.071 3.679 4.186 0.096 15 0 "[ . 1 . 2]" 1
1053 1 50 SER H 1 50 SER HB3 . . 4.060 3.537 3.372 3.594 . 0 0 "[ . 1 . 2]" 1
1054 1 50 SER HA 1 51 PRO HB3 . . 5.150 4.909 4.720 5.133 . 0 0 "[ . 1 . 2]" 1
1055 1 50 SER HA 1 51 PRO HD2 . . 3.350 2.477 2.294 2.709 . 0 0 "[ . 1 . 2]" 1
1056 1 50 SER HA 1 51 PRO HD3 . . 3.450 2.459 2.351 2.653 . 0 0 "[ . 1 . 2]" 1
1057 1 50 SER HA 1 51 PRO HG2 . . 5.250 4.614 4.475 4.760 . 0 0 "[ . 1 . 2]" 1
1058 1 50 SER HA 1 51 PRO HG3 . . 4.560 4.621 4.558 4.641 0.081 15 0 "[ . 1 . 2]" 1
1059 1 50 SER HA 1 52 TYR H . . 4.540 4.095 3.785 4.400 . 0 0 "[ . 1 . 2]" 1
1060 1 50 SER HB2 1 52 TYR H . . 4.840 3.379 2.709 3.843 . 0 0 "[ . 1 . 2]" 1
1061 1 50 SER HB2 1 53 LEU H . . 5.170 4.273 3.536 5.063 . 0 0 "[ . 1 . 2]" 1
1062 1 50 SER HB2 1 53 LEU QB . . 4.830 3.179 2.225 4.307 . 0 0 "[ . 1 . 2]" 1
1063 1 50 SER HB3 1 51 PRO HG2 . . 4.060 3.934 3.389 4.124 0.064 17 0 "[ . 1 . 2]" 1
1064 1 50 SER HB3 1 52 TYR H . . 3.770 2.643 2.056 3.119 . 0 0 "[ . 1 . 2]" 1
1065 1 50 SER HB3 1 52 TYR QB . . 5.480 3.516 2.828 4.195 . 0 0 "[ . 1 . 2]" 1
1066 1 50 SER HB3 1 53 LEU QB . . 4.690 4.302 3.667 4.636 . 0 0 "[ . 1 . 2]" 1
1067 1 51 PRO HA 1 53 LEU H . . 4.450 3.732 3.492 4.192 . 0 0 "[ . 1 . 2]" 1
1068 1 51 PRO HB2 1 52 TYR HA . . 5.070 4.151 3.764 4.612 . 0 0 "[ . 1 . 2]" 1
1069 1 51 PRO HB2 1 52 TYR QD . . 4.750 4.045 3.161 4.671 . 0 0 "[ . 1 . 2]" 1
1070 1 51 PRO HD2 1 52 TYR H . . 4.160 2.840 2.470 3.225 . 0 0 "[ . 1 . 2]" 1
1071 1 51 PRO HD2 1 52 TYR QE . . 4.450 4.153 3.530 4.546 0.096 15 0 "[ . 1 . 2]" 1
1072 1 51 PRO HD3 1 52 TYR H . . 4.810 3.962 3.759 4.174 . 0 0 "[ . 1 . 2]" 1
1073 1 51 PRO HG2 1 52 TYR H . . 4.170 2.757 2.482 3.531 . 0 0 "[ . 1 . 2]" 1
1074 1 51 PRO HG2 1 52 TYR QD . . 3.610 3.367 3.149 3.673 0.063 17 0 "[ . 1 . 2]" 1
1075 1 51 PRO HG2 1 52 TYR QE . . 3.790 3.356 3.063 3.802 0.012 17 0 "[ . 1 . 2]" 1
1076 1 51 PRO HG3 1 52 TYR H . . 4.990 4.226 3.975 4.834 . 0 0 "[ . 1 . 2]" 1
1077 1 51 PRO HG3 1 52 TYR QD . . 5.500 4.788 4.483 5.102 . 0 0 "[ . 1 . 2]" 1
1078 1 51 PRO HG3 1 52 TYR QE . . 5.500 4.289 3.917 4.748 . 0 0 "[ . 1 . 2]" 1
1079 1 52 TYR H 1 52 TYR QB . . 3.640 2.476 2.362 2.573 . 0 0 "[ . 1 . 2]" 1
1080 1 52 TYR H 1 52 TYR QD . . 3.750 3.137 2.990 3.445 . 0 0 "[ . 1 . 2]" 1
1081 1 52 TYR H 1 52 TYR QE . . 4.940 4.468 4.159 4.934 . 0 0 "[ . 1 . 2]" 1
1082 1 52 TYR H 1 53 LEU H . . 3.250 2.921 2.582 3.081 . 0 0 "[ . 1 . 2]" 1
1083 1 52 TYR H 1 53 LEU QB . . 5.500 3.880 3.525 4.567 . 0 0 "[ . 1 . 2]" 1
1084 1 52 TYR HA 1 52 TYR QD . . 2.620 2.285 2.162 2.443 . 0 0 "[ . 1 . 2]" 1
1085 1 52 TYR HA 1 53 LEU QB . . 4.780 4.690 4.669 4.702 . 0 0 "[ . 1 . 2]" 1
1086 1 52 TYR HA 1 67 ASP HB3 . . 3.350 2.469 2.164 3.985 0.635 15 1 "[ . 1 + 2]" 1
1087 1 52 TYR HA 1 70 LEU H . . 5.500 5.237 4.824 5.556 0.056 15 0 "[ . 1 . 2]" 1
1088 1 52 TYR QB 1 53 LEU H . . 4.570 3.630 3.305 3.795 . 0 0 "[ . 1 . 2]" 1
1089 1 52 TYR QB 1 53 LEU HA . . 5.380 4.372 4.105 4.529 . 0 0 "[ . 1 . 2]" 1
1090 1 52 TYR QB 1 53 LEU QB . . 5.110 3.524 3.080 3.871 . 0 0 "[ . 1 . 2]" 1
1091 1 52 TYR QB 1 53 LEU HG . . 4.890 3.586 3.080 4.279 . 0 0 "[ . 1 . 2]" 1
1092 1 52 TYR QB 1 67 ASP H . . 4.090 2.877 2.557 3.097 . 0 0 "[ . 1 . 2]" 1
1093 1 52 TYR QB 1 67 ASP HB2 . . 4.050 3.475 2.574 3.785 . 0 0 "[ . 1 . 2]" 1
1094 1 52 TYR QB 1 67 ASP HB3 . . 3.990 2.368 2.183 3.790 . 0 0 "[ . 1 . 2]" 1
1095 1 52 TYR QB 1 70 LEU H . . 5.100 3.351 2.923 3.635 . 0 0 "[ . 1 . 2]" 1
1096 1 52 TYR QB 1 70 LEU HA . . 4.840 4.125 3.892 4.265 . 0 0 "[ . 1 . 2]" 1
1097 1 52 TYR QB 1 70 LEU HB3 . . 4.070 3.210 2.930 3.499 . 0 0 "[ . 1 . 2]" 1
1098 1 52 TYR QB 1 70 LEU QD . . 4.860 2.795 2.494 3.479 . 0 0 "[ . 1 . 2]" 1
1099 1 52 TYR QD 1 67 ASP H . . 4.400 4.393 4.180 4.493 0.093 20 0 "[ . 1 . 2]" 1
1100 1 52 TYR QD 1 67 ASP HB2 . . 3.360 3.147 2.406 3.392 0.032 20 0 "[ . 1 . 2]" 1
1101 1 52 TYR QD 1 67 ASP HB3 . . 3.190 2.310 2.126 3.270 0.080 15 0 "[ . 1 . 2]" 1
1102 1 52 TYR QD 1 69 LYS H . . 4.980 4.417 4.141 4.870 . 0 0 "[ . 1 . 2]" 1
1103 1 52 TYR QD 1 69 LYS HB2 . . 4.920 4.297 3.855 4.954 0.034 20 0 "[ . 1 . 2]" 1
1104 1 52 TYR QD 1 69 LYS HB3 . . 4.790 3.186 2.532 3.800 . 0 0 "[ . 1 . 2]" 1
1105 1 52 TYR QD 1 69 LYS QD . . 5.270 4.214 3.635 4.577 . 0 0 "[ . 1 . 2]" 1
1106 1 52 TYR QD 1 69 LYS HG3 . . 5.500 5.015 4.511 5.567 0.067 3 0 "[ . 1 . 2]" 1
1107 1 52 TYR QD 1 70 LEU H . . 4.280 3.844 3.340 4.188 . 0 0 "[ . 1 . 2]" 1
1108 1 52 TYR QD 1 70 LEU HA . . 3.870 3.508 3.084 3.834 . 0 0 "[ . 1 . 2]" 1
1109 1 52 TYR QD 1 70 LEU HB2 . . 4.390 2.710 2.369 3.031 . 0 0 "[ . 1 . 2]" 1
1110 1 52 TYR QD 1 70 LEU HB3 . . 4.240 4.252 4.033 4.341 0.101 14 0 "[ . 1 . 2]" 1
1111 1 52 TYR QD 1 70 LEU QD . . 3.040 2.346 2.112 2.725 . 0 0 "[ . 1 . 2]" 1
1112 1 52 TYR QE 1 67 ASP HB2 . . 5.270 5.232 4.317 5.377 0.107 9 0 "[ . 1 . 2]" 1
1113 1 52 TYR QE 1 69 LYS H . . 5.030 5.026 4.677 5.106 0.076 20 0 "[ . 1 . 2]" 1
1114 1 52 TYR QE 1 69 LYS HB2 . . 4.700 3.844 3.436 4.305 . 0 0 "[ . 1 . 2]" 1
1115 1 52 TYR QE 1 69 LYS HB3 . . 3.140 2.708 2.235 3.134 . 0 0 "[ . 1 . 2]" 1
1116 1 52 TYR QE 1 69 LYS QD . . 3.160 2.819 2.029 3.236 0.076 6 0 "[ . 1 . 2]" 1
1117 1 52 TYR QE 1 69 LYS QE . . 5.200 4.292 3.714 4.825 . 0 0 "[ . 1 . 2]" 1
1118 1 52 TYR QE 1 69 LYS HG2 . . 5.000 4.692 4.214 5.077 0.077 1 0 "[ . 1 . 2]" 1
1119 1 52 TYR QE 1 69 LYS HG3 . . 5.190 3.444 2.887 4.070 . 0 0 "[ . 1 . 2]" 1
1120 1 52 TYR QE 1 70 LEU H . . 4.680 4.582 4.179 4.745 0.065 11 0 "[ . 1 . 2]" 1
1121 1 52 TYR QE 1 70 LEU HA . . 3.800 3.678 3.318 3.899 0.099 1 0 "[ . 1 . 2]" 1
1122 1 52 TYR QE 1 70 LEU QD . . 5.070 3.429 3.037 4.024 . 0 0 "[ . 1 . 2]" 1
1123 1 52 TYR QE 1 73 THR MG . . 3.100 2.749 2.267 3.209 0.109 7 0 "[ . 1 . 2]" 1
1124 1 53 LEU H 1 53 LEU QB . . 3.570 2.540 2.319 3.280 . 0 0 "[ . 1 . 2]" 1
1125 1 53 LEU H 1 53 LEU HG . . 4.370 3.978 2.337 4.380 0.010 15 0 "[ . 1 . 2]" 1
1126 1 53 LEU H 1 54 LYS H . . 4.610 3.902 3.646 4.244 . 0 0 "[ . 1 . 2]" 1
1127 1 53 LEU H 1 54 LYS HG3 . . 5.120 3.538 2.794 5.133 0.013 13 0 "[ . 1 . 2]" 1
1128 1 53 LEU H 1 64 LEU QD . . 5.500 5.048 4.759 5.373 . 0 0 "[ . 1 . 2]" 1
1129 1 53 LEU HA 1 53 LEU QD . . 3.340 2.299 2.043 3.399 0.059 2 0 "[ . 1 . 2]" 1
1130 1 53 LEU HA 1 53 LEU HG . . 3.490 2.517 2.093 3.560 0.070 2 0 "[ . 1 . 2]" 1
1131 1 53 LEU HA 1 54 LYS H . . 2.900 2.245 2.141 2.321 . 0 0 "[ . 1 . 2]" 1
1132 1 53 LEU HA 1 54 LYS HG2 . . 5.500 5.082 3.384 5.876 0.376 11 0 "[ . 1 . 2]" 1
1133 1 53 LEU HA 1 64 LEU QD . . 4.170 3.193 2.831 3.747 . 0 0 "[ . 1 . 2]" 1
1134 1 53 LEU HA 1 65 ALA H . . 5.260 4.728 4.360 5.013 . 0 0 "[ . 1 . 2]" 1
1135 1 53 LEU HA 1 65 ALA MB . . 4.950 4.135 3.047 4.532 . 0 0 "[ . 1 . 2]" 1
1136 1 53 LEU HA 1 66 VAL HA . . 3.780 2.847 2.456 3.219 . 0 0 "[ . 1 . 2]" 1
1137 1 53 LEU HA 1 66 VAL MG2 . . 5.270 3.520 2.722 4.255 . 0 0 "[ . 1 . 2]" 1
1138 1 53 LEU HA 1 67 ASP H . . 4.160 3.871 3.582 4.117 . 0 0 "[ . 1 . 2]" 1
1139 1 53 LEU QB 1 54 LYS H . . 4.250 3.759 2.670 3.937 . 0 0 "[ . 1 . 2]" 1
1140 1 53 LEU QB 1 55 PRO QD . . 5.500 5.245 4.990 5.333 . 0 0 "[ . 1 . 2]" 1
1141 1 53 LEU QB 1 64 LEU QD . . 3.280 3.048 2.280 3.183 . 0 0 "[ . 1 . 2]" 1
1142 1 53 LEU QD 1 54 LYS H . . 4.250 3.427 3.113 4.105 . 0 0 "[ . 1 . 2]" 1
1143 1 53 LEU QD 1 64 LEU QD . . 2.980 1.886 1.717 2.705 . 0 0 "[ . 1 . 2]" 1
1144 1 53 LEU QD 1 65 ALA H . . 5.170 4.547 3.827 5.296 0.126 2 0 "[ . 1 . 2]" 1
1145 1 53 LEU QD 1 65 ALA MB . . 4.740 4.663 4.278 4.867 0.127 20 0 "[ . 1 . 2]" 1
1146 1 53 LEU QD 1 66 VAL H . . 5.200 4.873 4.567 5.300 0.100 2 0 "[ . 1 . 2]" 1
1147 1 53 LEU QD 1 66 VAL HA . . 3.490 3.137 2.721 3.511 0.021 15 0 "[ . 1 . 2]" 1
1148 1 53 LEU MD2 1 54 LYS H . . 4.270 3.520 3.135 4.913 0.643 2 1 "[ + . 1 . 2]" 1
1149 1 53 LEU HG 1 64 LEU QD . . 4.590 3.900 2.905 4.561 . 0 0 "[ . 1 . 2]" 1
1150 1 53 LEU HG 1 66 VAL HA . . 4.550 3.233 2.558 4.649 0.099 2 0 "[ . 1 . 2]" 1
1151 1 53 LEU HG 1 66 VAL MG2 . . 4.380 3.217 2.017 4.452 0.072 2 0 "[ . 1 . 2]" 1
1152 1 54 LYS H 1 54 LYS HB2 . . 3.540 2.835 2.507 3.614 0.074 13 0 "[ . 1 . 2]" 1
1153 1 54 LYS H 1 54 LYS HB3 . . 3.950 3.830 3.537 3.934 . 0 0 "[ . 1 . 2]" 1
1154 1 54 LYS H 1 54 LYS QE . . 5.160 4.731 4.037 5.248 0.088 4 0 "[ . 1 . 2]" 1
1155 1 54 LYS H 1 54 LYS HG2 . . 4.510 3.993 2.700 4.394 . 0 0 "[ . 1 . 2]" 1
1156 1 54 LYS H 1 54 LYS HG3 . . 4.360 3.700 2.877 4.403 0.043 3 0 "[ . 1 . 2]" 1
1157 1 54 LYS H 1 55 PRO QD . . 4.840 4.362 4.298 4.411 . 0 0 "[ . 1 . 2]" 1
1158 1 54 LYS H 1 64 LEU HA . . 5.340 4.519 4.176 4.753 . 0 0 "[ . 1 . 2]" 1
1159 1 54 LYS H 1 64 LEU QD . . 3.740 2.734 2.428 3.000 . 0 0 "[ . 1 . 2]" 1
1160 1 54 LYS H 1 65 ALA H . . 3.740 3.138 2.829 3.353 . 0 0 "[ . 1 . 2]" 1
1161 1 54 LYS H 1 65 ALA MB . . 3.790 2.754 2.305 3.219 . 0 0 "[ . 1 . 2]" 1
1162 1 54 LYS H 1 66 VAL HA . . 4.770 4.146 3.778 4.683 . 0 0 "[ . 1 . 2]" 1
1163 1 54 LYS HA 1 54 LYS HD2 . . 4.840 4.108 3.261 5.131 0.291 13 0 "[ . 1 . 2]" 1
1164 1 54 LYS HA 1 54 LYS HD3 . . 5.060 4.422 3.501 4.675 . 0 0 "[ . 1 . 2]" 1
1165 1 54 LYS HA 1 54 LYS QE . . 4.790 4.182 1.871 4.884 0.094 13 0 "[ . 1 . 2]" 1
1166 1 54 LYS HA 1 54 LYS HG2 . . 3.950 2.412 2.135 3.484 . 0 0 "[ . 1 . 2]" 1
1167 1 54 LYS HA 1 54 LYS HG3 . . 4.000 3.298 2.950 3.948 . 0 0 "[ . 1 . 2]" 1
1168 1 54 LYS HA 1 55 PRO QD . . 2.940 2.122 2.029 2.221 . 0 0 "[ . 1 . 2]" 1
1169 1 54 LYS HA 1 55 PRO HG2 . . 4.800 4.508 4.366 4.583 . 0 0 "[ . 1 . 2]" 1
1170 1 54 LYS HA 1 64 LEU QD . . 5.490 3.422 2.951 3.809 . 0 0 "[ . 1 . 2]" 1
1171 1 54 LYS HA 1 65 ALA H . . 5.040 4.880 4.600 5.009 . 0 0 "[ . 1 . 2]" 1
1172 1 54 LYS HB2 1 55 PRO QD . . 4.510 3.740 3.124 4.066 . 0 0 "[ . 1 . 2]" 1
1173 1 54 LYS HB2 1 65 ALA H . . 5.450 4.434 4.120 4.638 . 0 0 "[ . 1 . 2]" 1
1174 1 54 LYS HB2 1 65 ALA MB . . 3.150 3.037 2.602 3.248 0.098 13 0 "[ . 1 . 2]" 1
1175 1 54 LYS HB3 1 55 PRO QD . . 4.240 2.404 2.205 3.076 . 0 0 "[ . 1 . 2]" 1
1176 1 54 LYS HB3 1 65 ALA H . . 5.120 5.083 4.428 5.223 0.103 13 0 "[ . 1 . 2]" 1
1177 1 54 LYS HD2 1 55 PRO QD . . 5.500 3.799 2.454 5.683 0.183 13 0 "[ . 1 . 2]" 1
1178 1 54 LYS HG2 1 55 PRO QD . . 5.200 3.315 2.581 4.961 . 0 0 "[ . 1 . 2]" 1
1179 1 54 LYS HG3 1 55 PRO QD . . 5.170 4.351 3.952 5.011 . 0 0 "[ . 1 . 2]" 1
1180 1 55 PRO HA 1 56 ARG H . . 2.770 2.410 2.250 2.505 . 0 0 "[ . 1 . 2]" 1
1181 1 55 PRO HA 1 64 LEU QD . . 4.400 2.936 2.298 3.249 . 0 0 "[ . 1 . 2]" 1
1182 1 55 PRO HA 1 65 ALA H . . 4.290 3.489 3.089 3.795 . 0 0 "[ . 1 . 2]" 1
1183 1 55 PRO HA 1 65 ALA MB . . 5.150 4.630 4.339 4.868 . 0 0 "[ . 1 . 2]" 1
1184 1 55 PRO HB2 1 56 ARG H . . 3.920 2.674 2.463 2.912 . 0 0 "[ . 1 . 2]" 1
1185 1 55 PRO HB3 1 56 ARG H . . 4.160 3.583 3.467 3.734 . 0 0 "[ . 1 . 2]" 1
1186 1 55 PRO HB3 1 64 LEU HA . . 4.790 4.550 4.073 4.862 0.072 11 0 "[ . 1 . 2]" 1
1187 1 55 PRO QD 1 56 ARG H . . 5.500 4.927 4.852 4.980 . 0 0 "[ . 1 . 2]" 1
1188 1 55 PRO QD 1 64 LEU QD . . 4.730 3.472 2.767 3.839 . 0 0 "[ . 1 . 2]" 1
1189 1 55 PRO HG2 1 56 ARG H . . 5.310 4.385 4.199 4.574 . 0 0 "[ . 1 . 2]" 1
1190 1 55 PRO HG3 1 64 LEU QD . . 5.490 5.087 4.373 5.439 . 0 0 "[ . 1 . 2]" 1
1191 1 56 ARG H 1 56 ARG HB2 . . 3.490 2.788 2.652 2.925 . 0 0 "[ . 1 . 2]" 1
1192 1 56 ARG H 1 56 ARG HB3 . . 4.160 3.688 3.344 3.882 . 0 0 "[ . 1 . 2]" 1
1193 1 56 ARG H 1 56 ARG QG . . 4.590 3.725 3.423 4.063 . 0 0 "[ . 1 . 2]" 1
1194 1 56 ARG H 1 57 VAL H . . 4.430 4.294 4.170 4.371 . 0 0 "[ . 1 . 2]" 1
1195 1 56 ARG H 1 57 VAL QG . . 5.500 4.280 4.021 4.667 . 0 0 "[ . 1 . 2]" 1
1196 1 56 ARG H 1 62 ARG HA . . 5.010 4.030 3.459 4.503 . 0 0 "[ . 1 . 2]" 1
1197 1 56 ARG H 1 63 CYS QB . . 4.500 3.901 3.282 4.574 0.074 18 0 "[ . 1 . 2]" 1
1198 1 56 ARG H 1 64 LEU QD . . 4.980 4.797 4.326 4.953 . 0 0 "[ . 1 . 2]" 1
1199 1 56 ARG H 1 65 ALA H . . 4.840 4.681 4.355 4.914 0.074 10 0 "[ . 1 . 2]" 1
1200 1 56 ARG H 1 65 ALA MB . . 5.250 5.132 4.868 5.359 0.109 12 0 "[ . 1 . 2]" 1
1201 1 56 ARG HA 1 56 ARG HD2 . . 4.400 4.449 4.130 4.484 0.084 9 0 "[ . 1 . 2]" 1
1202 1 56 ARG HA 1 56 ARG HD3 . . 4.370 4.106 2.991 4.420 0.050 10 0 "[ . 1 . 2]" 1
1203 1 56 ARG HA 1 56 ARG QG . . 3.220 2.160 2.050 2.265 . 0 0 "[ . 1 . 2]" 1
1204 1 56 ARG HA 1 57 VAL H . . 2.900 2.734 2.523 2.851 . 0 0 "[ . 1 . 2]" 1
1205 1 56 ARG HA 1 57 VAL QG . . 4.890 3.804 3.413 4.161 . 0 0 "[ . 1 . 2]" 1
1206 1 56 ARG HB2 1 56 ARG HE . . 5.500 4.533 4.110 5.150 . 0 0 "[ . 1 . 2]" 1
1207 1 56 ARG HB2 1 57 VAL H . . 4.170 3.535 3.182 3.818 . 0 0 "[ . 1 . 2]" 1
1208 1 56 ARG HB2 1 58 ILE H . . 5.500 5.166 4.351 5.575 0.075 8 0 "[ . 1 . 2]" 1
1209 1 56 ARG HB2 1 58 ILE MD . . 4.800 3.853 2.575 4.632 . 0 0 "[ . 1 . 2]" 1
1210 1 56 ARG HB2 1 63 CYS QB . . 4.250 2.966 2.224 3.896 . 0 0 "[ . 1 . 2]" 1
1211 1 56 ARG HB2 1 65 ALA H . . 4.880 4.358 3.422 4.954 0.074 5 0 "[ . 1 . 2]" 1
1212 1 56 ARG HB3 1 57 VAL H . . 4.300 2.084 1.858 2.377 . 0 0 "[ . 1 . 2]" 1
1213 1 56 ARG HB3 1 57 VAL HB . . 5.480 5.013 4.737 5.386 . 0 0 "[ . 1 . 2]" 1
1214 1 56 ARG HB3 1 58 ILE MD . . 4.600 3.347 2.456 3.986 . 0 0 "[ . 1 . 2]" 1
1215 1 56 ARG HB3 1 58 ILE HG13 . . 5.170 3.166 2.350 4.491 . 0 0 "[ . 1 . 2]" 1
1216 1 56 ARG HB3 1 63 CYS QB . . 4.220 3.786 3.126 4.298 0.078 19 0 "[ . 1 . 2]" 1
1217 1 56 ARG HD2 1 57 VAL H . . 5.160 4.655 3.121 5.116 . 0 0 "[ . 1 . 2]" 1
1218 1 56 ARG HD2 1 58 ILE MD . . 4.290 3.030 2.139 3.789 . 0 0 "[ . 1 . 2]" 1
1219 1 56 ARG HD2 1 58 ILE HG13 . . 5.260 4.025 2.805 5.037 . 0 0 "[ . 1 . 2]" 1
1220 1 56 ARG HD2 1 65 ALA MB . . 4.380 3.204 2.281 4.455 0.075 8 0 "[ . 1 . 2]" 1
1221 1 56 ARG HD3 1 56 ARG QG . . 2.790 2.361 2.209 2.479 . 0 0 "[ . 1 . 2]" 1
1222 1 56 ARG HD3 1 57 VAL H . . 5.110 3.733 1.803 4.478 . 0 0 "[ . 1 . 2]" 1
1223 1 56 ARG HD3 1 58 ILE MD . . 4.490 2.898 2.063 4.430 . 0 0 "[ . 1 . 2]" 1
1224 1 56 ARG HD3 1 65 ALA MB . . 4.930 4.470 3.684 5.016 0.086 2 0 "[ . 1 . 2]" 1
1225 1 56 ARG HE 1 65 ALA MB . . 5.500 3.361 2.129 5.114 . 0 0 "[ . 1 . 2]" 1
1226 1 56 ARG QG 1 57 VAL H . . 3.500 3.266 2.535 3.593 0.093 9 0 "[ . 1 . 2]" 1
1227 1 56 ARG QG 1 65 ALA H . . 5.410 4.100 3.319 4.802 . 0 0 "[ . 1 . 2]" 1
1228 1 57 VAL H 1 57 VAL HB . . 3.250 3.037 2.782 3.359 0.109 11 0 "[ . 1 . 2]" 1
1229 1 57 VAL H 1 57 VAL QG . . 3.380 3.064 2.556 3.264 . 0 0 "[ . 1 . 2]" 1
1230 1 57 VAL H 1 58 ILE H . . 4.070 3.869 3.236 4.141 0.071 11 0 "[ . 1 . 2]" 1
1231 1 57 VAL H 1 58 ILE MD . . 4.960 4.338 3.142 5.030 0.070 19 0 "[ . 1 . 2]" 1
1232 1 57 VAL H 1 58 ILE HG12 . . 5.500 4.160 3.426 5.545 0.045 11 0 "[ . 1 . 2]" 1
1233 1 57 VAL H 1 58 ILE HG13 . . 5.500 4.043 3.063 5.555 0.055 12 0 "[ . 1 . 2]" 1
1234 1 57 VAL HA 1 57 VAL QG . . 3.190 2.171 2.084 2.372 . 0 0 "[ . 1 . 2]" 1
1235 1 57 VAL HA 1 58 ILE H . . 2.970 2.216 2.100 2.323 . 0 0 "[ . 1 . 2]" 1
1236 1 57 VAL HA 1 58 ILE HB . . 4.910 4.670 4.276 4.989 0.079 13 0 "[ . 1 . 2]" 1
1237 1 57 VAL HA 1 58 ILE HG12 . . 4.780 4.906 3.847 5.551 0.771 9 7 "[ *- . *+1* * *]" 1
1238 1 57 VAL HA 1 58 ILE HG13 . . 5.480 4.596 3.969 5.549 0.069 17 0 "[ . 1 . 2]" 1
1239 1 57 VAL HA 1 61 VAL H . . 4.590 4.393 3.675 4.658 0.068 10 0 "[ . 1 . 2]" 1
1240 1 57 VAL HA 1 61 VAL QG . . 5.500 4.226 3.359 4.889 . 0 0 "[ . 1 . 2]" 1
1241 1 57 VAL HA 1 62 ARG HA . . 3.410 3.177 2.218 3.501 0.091 18 0 "[ . 1 . 2]" 1
1242 1 57 VAL HB 1 58 ILE H . . 4.830 4.317 4.059 4.608 . 0 0 "[ . 1 . 2]" 1
1243 1 57 VAL QG 1 58 ILE H . . 3.510 2.882 2.486 3.441 . 0 0 "[ . 1 . 2]" 1
1244 1 57 VAL QG 1 58 ILE HA . . 5.360 3.743 3.333 4.145 . 0 0 "[ . 1 . 2]" 1
1245 1 57 VAL QG 1 59 GLU H . . 4.960 3.990 3.505 4.528 . 0 0 "[ . 1 . 2]" 1
1246 1 57 VAL QG 1 59 GLU HA . . 5.020 4.674 4.197 5.044 0.024 20 0 "[ . 1 . 2]" 1
1247 1 57 VAL QG 1 60 GLY H . . 3.260 2.368 1.982 2.782 . 0 0 "[ . 1 . 2]" 1
1248 1 57 VAL QG 1 60 GLY HA2 . . 3.520 2.262 2.038 2.579 . 0 0 "[ . 1 . 2]" 1
1249 1 57 VAL QG 1 60 GLY HA3 . . 3.960 3.579 3.391 3.798 . 0 0 "[ . 1 . 2]" 1
1250 1 57 VAL QG 1 61 VAL H . . 3.660 3.359 2.918 3.673 0.013 7 0 "[ . 1 . 2]" 1
1251 1 57 VAL QG 1 62 ARG H . . 5.400 4.393 2.933 4.903 . 0 0 "[ . 1 . 2]" 1
1252 1 57 VAL QG 1 62 ARG HA . . 3.570 3.009 2.066 3.283 . 0 0 "[ . 1 . 2]" 1
1253 1 57 VAL QG 1 62 ARG HB3 . . 5.140 4.708 3.239 5.019 . 0 0 "[ . 1 . 2]" 1
1254 1 57 VAL QG 1 62 ARG QG . . 4.970 4.111 2.970 4.512 . 0 0 "[ . 1 . 2]" 1
1255 1 58 ILE H 1 58 ILE HB . . 3.520 2.690 2.414 2.931 . 0 0 "[ . 1 . 2]" 1
1256 1 58 ILE H 1 58 ILE MD . . 4.500 4.058 2.517 4.566 0.066 18 0 "[ . 1 . 2]" 1
1257 1 58 ILE H 1 58 ILE HG12 . . 4.210 3.728 2.822 4.364 0.154 11 0 "[ . 1 . 2]" 1
1258 1 58 ILE H 1 58 ILE HG13 . . 4.820 3.450 2.558 4.383 . 0 0 "[ . 1 . 2]" 1
1259 1 58 ILE H 1 58 ILE MG . . 4.000 3.860 3.735 3.936 . 0 0 "[ . 1 . 2]" 1
1260 1 58 ILE H 1 59 GLU H . . 4.830 4.172 4.037 4.357 . 0 0 "[ . 1 . 2]" 1
1261 1 58 ILE H 1 60 GLY H . . 5.490 3.533 2.861 4.074 . 0 0 "[ . 1 . 2]" 1
1262 1 58 ILE H 1 61 VAL H . . 3.510 3.070 2.677 3.461 . 0 0 "[ . 1 . 2]" 1
1263 1 58 ILE H 1 61 VAL HB . . 4.420 3.937 3.004 4.517 0.097 11 0 "[ . 1 . 2]" 1
1264 1 58 ILE H 1 61 VAL QG . . 4.570 3.116 2.079 4.146 . 0 0 "[ . 1 . 2]" 1
1265 1 58 ILE H 1 62 ARG H . . 5.500 5.093 4.441 5.383 . 0 0 "[ . 1 . 2]" 1
1266 1 58 ILE H 1 63 CYS QB . . 5.040 4.117 3.414 4.617 . 0 0 "[ . 1 . 2]" 1
1267 1 58 ILE HA 1 58 ILE MD . . 3.920 3.357 2.174 3.901 . 0 0 "[ . 1 . 2]" 1
1268 1 58 ILE HA 1 58 ILE HG12 . . 4.030 2.771 2.335 3.665 . 0 0 "[ . 1 . 2]" 1
1269 1 58 ILE HA 1 58 ILE HG13 . . 3.880 3.308 2.535 3.906 0.026 7 0 "[ . 1 . 2]" 1
1270 1 58 ILE HA 1 58 ILE MG . . 3.190 2.430 2.258 2.582 . 0 0 "[ . 1 . 2]" 1
1271 1 58 ILE HA 1 59 GLU H . . 2.900 2.216 2.156 2.291 . 0 0 "[ . 1 . 2]" 1
1272 1 58 ILE HA 1 59 GLU HA . . 4.430 4.426 4.353 4.487 0.057 7 0 "[ . 1 . 2]" 1
1273 1 58 ILE HA 1 60 GLY H . . 4.150 3.745 3.431 3.960 . 0 0 "[ . 1 . 2]" 1
1274 1 58 ILE HB 1 58 ILE MD . . 3.300 2.706 2.297 3.277 . 0 0 "[ . 1 . 2]" 1
1275 1 58 ILE HB 1 59 GLU H . . 5.500 4.302 4.069 4.458 . 0 0 "[ . 1 . 2]" 1
1276 1 58 ILE HB 1 61 VAL H . . 4.980 4.253 3.854 4.515 . 0 0 "[ . 1 . 2]" 1
1277 1 58 ILE HB 1 61 VAL HB . . 4.730 4.012 2.820 4.794 0.064 10 0 "[ . 1 . 2]" 1
1278 1 58 ILE MD 1 59 GLU H . . 5.110 4.860 3.880 5.215 0.105 2 0 "[ . 1 . 2]" 1
1279 1 58 ILE MD 1 63 CYS QB . . 3.960 3.470 2.063 4.075 0.115 19 0 "[ . 1 . 2]" 1
1280 1 58 ILE HG12 1 58 ILE MG . . 3.740 2.717 2.164 3.259 . 0 0 "[ . 1 . 2]" 1
1281 1 58 ILE HG12 1 59 GLU H . . 5.310 4.785 4.370 5.683 0.373 11 0 "[ . 1 . 2]" 1
1282 1 58 ILE HG12 1 63 CYS QB . . 4.980 4.475 2.551 5.565 0.585 19 5 "[* .* 1 .- *+2]" 1
1283 1 58 ILE HG13 1 63 CYS QB . . 5.450 3.686 2.939 4.663 . 0 0 "[ . 1 . 2]" 1
1284 1 58 ILE MG 1 59 GLU H . . 3.740 2.897 2.505 3.240 . 0 0 "[ . 1 . 2]" 1
1285 1 58 ILE MG 1 59 GLU HA . . 4.690 4.231 3.968 4.578 . 0 0 "[ . 1 . 2]" 1
1286 1 58 ILE MG 1 59 GLU HB2 . . 3.780 3.068 2.606 3.483 . 0 0 "[ . 1 . 2]" 1
1287 1 58 ILE MG 1 59 GLU HB3 . . 4.710 4.326 4.061 4.637 . 0 0 "[ . 1 . 2]" 1
1288 1 58 ILE MG 1 59 GLU HG2 . . 3.920 3.721 3.091 3.972 0.052 7 0 "[ . 1 . 2]" 1
1289 1 58 ILE MG 1 59 GLU HG3 . . 3.520 2.267 1.958 2.580 . 0 0 "[ . 1 . 2]" 1
1290 1 58 ILE MG 1 60 GLY H . . 5.100 4.653 4.437 4.773 . 0 0 "[ . 1 . 2]" 1
1291 1 58 ILE MG 1 61 VAL H . . 4.580 4.536 4.323 4.680 0.100 1 0 "[ . 1 . 2]" 1
1292 1 59 GLU H 1 59 GLU HA . . 2.930 2.282 2.221 2.322 . 0 0 "[ . 1 . 2]" 1
1293 1 59 GLU H 1 59 GLU HG2 . . 3.940 3.307 2.829 3.619 . 0 0 "[ . 1 . 2]" 1
1294 1 59 GLU H 1 59 GLU HG3 . . 3.670 2.711 2.446 3.175 . 0 0 "[ . 1 . 2]" 1
1295 1 59 GLU H 1 60 GLY H . . 3.500 2.886 2.781 3.027 . 0 0 "[ . 1 . 2]" 1
1296 1 59 GLU H 1 61 VAL H . . 4.880 4.403 4.249 4.551 . 0 0 "[ . 1 . 2]" 1
1297 1 59 GLU HA 1 59 GLU HB3 . . 2.910 2.463 2.352 2.535 . 0 0 "[ . 1 . 2]" 1
1298 1 59 GLU HA 1 59 GLU HG2 . . 3.530 2.525 2.306 2.720 . 0 0 "[ . 1 . 2]" 1
1299 1 59 GLU HA 1 59 GLU HG3 . . 3.620 3.066 2.749 3.489 . 0 0 "[ . 1 . 2]" 1
1300 1 59 GLU HA 1 60 GLY H . . 3.160 2.978 2.757 3.234 0.074 5 0 "[ . 1 . 2]" 1
1301 1 59 GLU HA 1 60 GLY HA2 . . 4.990 4.828 4.703 4.958 . 0 0 "[ . 1 . 2]" 1
1302 1 59 GLU HA 1 61 VAL H . . 4.780 4.464 4.237 4.835 0.055 11 0 "[ . 1 . 2]" 1
1303 1 59 GLU HB2 1 59 GLU HG3 . . 2.940 2.508 2.332 2.617 . 0 0 "[ . 1 . 2]" 1
1304 1 59 GLU HB2 1 60 GLY H . . 4.670 4.117 3.563 4.350 . 0 0 "[ . 1 . 2]" 1
1305 1 59 GLU HB2 1 61 VAL H . . 4.670 3.558 3.227 4.019 . 0 0 "[ . 1 . 2]" 1
1306 1 59 GLU HB2 1 61 VAL QG . . 4.640 3.214 2.387 3.923 . 0 0 "[ . 1 . 2]" 1
1307 1 59 GLU HB3 1 60 GLY H . . 4.620 4.482 4.292 4.569 . 0 0 "[ . 1 . 2]" 1
1308 1 59 GLU HB3 1 61 VAL QG . . 5.500 4.293 3.330 5.245 . 0 0 "[ . 1 . 2]" 1
1309 1 59 GLU HG2 1 60 GLY H . . 5.300 5.192 4.944 5.363 0.063 10 0 "[ . 1 . 2]" 1
1310 1 59 GLU HG3 1 60 GLY H . . 5.220 4.902 4.603 5.208 . 0 0 "[ . 1 . 2]" 1
1311 1 60 GLY H 1 61 VAL H . . 3.500 2.677 2.139 2.893 . 0 0 "[ . 1 . 2]" 1
1312 1 60 GLY H 1 61 VAL QG . . 5.300 4.123 3.738 4.332 . 0 0 "[ . 1 . 2]" 1
1313 1 60 GLY HA2 1 61 VAL QG . . 5.500 4.740 4.313 5.071 . 0 0 "[ . 1 . 2]" 1
1314 1 61 VAL H 1 61 VAL HB . . 3.000 2.477 2.253 2.770 . 0 0 "[ . 1 . 2]" 1
1315 1 61 VAL H 1 61 VAL QG . . 3.130 2.294 1.991 2.624 . 0 0 "[ . 1 . 2]" 1
1316 1 61 VAL H 1 62 ARG H . . 4.570 4.523 4.147 4.637 0.067 20 0 "[ . 1 . 2]" 1
1317 1 61 VAL HA 1 61 VAL QG . . 3.090 2.177 2.093 2.250 . 0 0 "[ . 1 . 2]" 1
1318 1 61 VAL HA 1 62 ARG H . . 2.800 2.297 2.023 2.491 . 0 0 "[ . 1 . 2]" 1
1319 1 61 VAL HA 1 62 ARG QG . . 4.900 4.060 3.426 4.746 . 0 0 "[ . 1 . 2]" 1
1320 1 61 VAL HB 1 62 ARG H . . 4.490 3.988 3.367 4.409 . 0 0 "[ . 1 . 2]" 1
1321 1 61 VAL HB 1 63 CYS QB . . 5.500 4.944 4.369 5.602 0.102 5 0 "[ . 1 . 2]" 1
1322 1 61 VAL QG 1 62 ARG H . . 3.470 2.336 1.877 3.194 . 0 0 "[ . 1 . 2]" 1
1323 1 61 VAL QG 1 62 ARG HE . . 5.500 4.689 3.421 5.447 . 0 0 "[ . 1 . 2]" 1
1324 1 61 VAL QG 1 63 CYS H . . 5.500 2.560 1.923 3.669 . 0 0 "[ . 1 . 2]" 1
1325 1 61 VAL QG 1 63 CYS HA . . 5.500 3.423 2.665 4.456 . 0 0 "[ . 1 . 2]" 1
1326 1 61 VAL QG 1 63 CYS QB . . 5.330 3.249 2.103 4.266 . 0 0 "[ . 1 . 2]" 1
1327 1 62 ARG H 1 62 ARG HB2 . . 3.290 2.643 2.325 3.623 0.333 9 0 "[ . 1 . 2]" 1
1328 1 62 ARG H 1 62 ARG HB3 . . 3.720 3.519 2.572 3.692 . 0 0 "[ . 1 . 2]" 1
1329 1 62 ARG H 1 62 ARG QD . . 4.720 3.256 1.659 4.495 . 0 0 "[ . 1 . 2]" 1
1330 1 62 ARG H 1 62 ARG QG . . 4.130 2.569 1.874 3.421 . 0 0 "[ . 1 . 2]" 1
1331 1 62 ARG H 1 63 CYS H . . 4.780 2.891 2.333 3.564 . 0 0 "[ . 1 . 2]" 1
1332 1 62 ARG HA 1 62 ARG QG . . 3.590 2.662 2.324 3.425 . 0 0 "[ . 1 . 2]" 1
1333 1 62 ARG HA 1 63 CYS HA . . 5.500 5.354 5.232 5.423 . 0 0 "[ . 1 . 2]" 1
1334 1 62 ARG HA 1 63 CYS QB . . 4.950 4.699 4.230 5.052 0.102 3 0 "[ . 1 . 2]" 1
1335 1 62 ARG HB2 1 62 ARG QD . . 3.740 2.728 2.215 3.495 . 0 0 "[ . 1 . 2]" 1
1336 1 62 ARG HB2 1 62 ARG HE . . 5.220 3.918 2.072 4.871 . 0 0 "[ . 1 . 2]" 1
1337 1 62 ARG HB2 1 63 CYS H . . 3.930 2.404 1.961 3.095 . 0 0 "[ . 1 . 2]" 1
1338 1 62 ARG HB3 1 62 ARG HE . . 5.500 4.027 2.708 5.184 . 0 0 "[ . 1 . 2]" 1
1339 1 62 ARG QG 1 63 CYS H . . 4.820 3.891 1.776 4.353 . 0 0 "[ . 1 . 2]" 1
1340 1 63 CYS H 1 63 CYS QB . . 3.560 3.302 2.869 3.547 . 0 0 "[ . 1 . 2]" 1
1341 1 63 CYS HA 1 64 LEU H . . 3.280 2.491 2.079 2.774 . 0 0 "[ . 1 . 2]" 1
1342 1 63 CYS HA 1 64 LEU HB3 . . 5.500 4.682 4.063 5.566 0.066 7 0 "[ . 1 . 2]" 1
1343 1 63 CYS QB 1 64 LEU H . . 3.330 2.401 1.976 3.431 0.101 2 0 "[ . 1 . 2]" 1
1344 1 63 CYS QB 1 65 ALA H . . 5.500 4.765 4.333 5.227 . 0 0 "[ . 1 . 2]" 1
1345 1 63 CYS QB 1 65 ALA MB . . 4.990 4.831 4.434 5.102 0.112 14 0 "[ . 1 . 2]" 1
1346 1 64 LEU H 1 64 LEU HB2 . . 3.840 3.046 2.672 3.431 . 0 0 "[ . 1 . 2]" 1
1347 1 64 LEU H 1 64 LEU HB3 . . 3.610 2.880 2.500 3.430 . 0 0 "[ . 1 . 2]" 1
1348 1 64 LEU H 1 64 LEU HG . . 5.500 4.515 4.305 4.965 . 0 0 "[ . 1 . 2]" 1
1349 1 64 LEU HA 1 64 LEU QD . . 3.070 2.173 2.058 2.331 . 0 0 "[ . 1 . 2]" 1
1350 1 64 LEU HA 1 64 LEU HG . . 3.710 3.075 2.501 3.401 . 0 0 "[ . 1 . 2]" 1
1351 1 64 LEU HA 1 65 ALA H . . 2.950 2.197 2.098 2.270 . 0 0 "[ . 1 . 2]" 1
1352 1 64 LEU HA 1 65 ALA MB . . 4.310 4.034 3.949 4.122 . 0 0 "[ . 1 . 2]" 1
1353 1 64 LEU HB2 1 65 ALA H . . 5.120 4.489 4.352 4.684 . 0 0 "[ . 1 . 2]" 1
1354 1 64 LEU HB3 1 65 ALA H . . 5.150 4.200 3.456 4.470 . 0 0 "[ . 1 . 2]" 1
1355 1 64 LEU QD 1 65 ALA H . . 3.480 2.601 2.180 3.053 . 0 0 "[ . 1 . 2]" 1
1356 1 64 LEU QD 1 66 VAL HA . . 5.500 4.267 3.808 4.628 . 0 0 "[ . 1 . 2]" 1
1357 1 64 LEU HG 1 65 ALA H . . 4.710 4.069 3.292 4.783 0.073 17 0 "[ . 1 . 2]" 1
1358 1 65 ALA H 1 65 ALA MB . . 3.180 2.231 2.125 2.269 . 0 0 "[ . 1 . 2]" 1
1359 1 65 ALA H 1 66 VAL H . . 4.890 4.572 4.449 4.676 . 0 0 "[ . 1 . 2]" 1
1360 1 65 ALA HA 1 66 VAL H . . 2.960 2.307 2.196 2.636 . 0 0 "[ . 1 . 2]" 1
1361 1 65 ALA HA 1 66 VAL HB . . 5.500 4.763 4.352 5.095 . 0 0 "[ . 1 . 2]" 1
1362 1 65 ALA HA 1 66 VAL MG2 . . 4.640 3.693 3.166 5.527 0.887 7 1 "[ . + 1 . 2]" 1
1363 1 65 ALA MB 1 66 VAL H . . 3.710 2.976 2.512 3.267 . 0 0 "[ . 1 . 2]" 1
1364 1 65 ALA MB 1 66 VAL HA . . 4.200 4.081 3.583 4.290 0.090 14 0 "[ . 1 . 2]" 1
1365 1 65 ALA MB 1 66 VAL HB . . 5.500 5.265 4.695 5.458 . 0 0 "[ . 1 . 2]" 1
1366 1 66 VAL H 1 66 VAL HB . . 3.630 2.843 2.336 3.089 . 0 0 "[ . 1 . 2]" 1
1367 1 66 VAL H 1 66 VAL MG1 . . 4.270 3.864 2.752 4.032 . 0 0 "[ . 1 . 2]" 1
1368 1 66 VAL H 1 66 VAL MG2 . . 3.530 2.901 2.566 4.090 0.560 7 1 "[ . + 1 . 2]" 1
1369 1 66 VAL H 1 67 ASP H . . 4.430 4.076 3.737 4.450 0.020 20 0 "[ . 1 . 2]" 1
1370 1 66 VAL HA 1 66 VAL MG1 . . 3.280 2.329 2.096 3.185 . 0 0 "[ . 1 . 2]" 1
1371 1 66 VAL HA 1 66 VAL MG2 . . 3.400 2.411 2.123 2.667 . 0 0 "[ . 1 . 2]" 1
1372 1 66 VAL HA 1 67 ASP H . . 2.960 2.228 2.067 2.429 . 0 0 "[ . 1 . 2]" 1
1373 1 66 VAL HA 1 81 LEU QD . . 4.630 4.287 4.183 4.333 . 0 0 "[ . 1 . 2]" 1
1374 1 66 VAL HB 1 67 ASP H . . 5.150 4.279 3.953 4.446 . 0 0 "[ . 1 . 2]" 1
1375 1 66 VAL MG1 1 67 ASP H . . 3.720 2.982 2.390 3.328 . 0 0 "[ . 1 . 2]" 1
1376 1 66 VAL MG1 1 67 ASP HB2 . . 5.500 4.971 4.326 5.352 . 0 0 "[ . 1 . 2]" 1
1377 1 66 VAL MG1 1 68 LEU HA . . 4.800 4.085 3.237 4.374 . 0 0 "[ . 1 . 2]" 1
1378 1 66 VAL MG1 1 70 LEU H . . 4.770 4.706 4.099 5.089 0.319 7 0 "[ . 1 . 2]" 1
1379 1 66 VAL MG2 1 67 ASP H . . 4.220 4.135 2.466 4.327 0.107 9 0 "[ . 1 . 2]" 1
1380 1 67 ASP H 1 67 ASP HB2 . . 3.440 2.507 2.162 2.887 . 0 0 "[ . 1 . 2]" 1
1381 1 67 ASP H 1 67 ASP HB3 . . 3.440 2.605 2.395 3.495 0.055 15 0 "[ . 1 . 2]" 1
1382 1 67 ASP H 1 68 LEU H . . 4.860 4.598 4.465 4.670 . 0 0 "[ . 1 . 2]" 1
1383 1 67 ASP H 1 70 LEU H . . 5.210 4.891 4.621 5.129 . 0 0 "[ . 1 . 2]" 1
1384 1 67 ASP HA 1 68 LEU H . . 3.130 2.224 2.180 2.292 . 0 0 "[ . 1 . 2]" 1
1385 1 67 ASP HA 1 68 LEU HA . . 5.500 4.380 4.300 4.495 . 0 0 "[ . 1 . 2]" 1
1386 1 67 ASP HA 1 68 LEU HB2 . . 5.500 4.263 4.169 4.345 . 0 0 "[ . 1 . 2]" 1
1387 1 67 ASP HA 1 68 LEU HB3 . . 5.500 5.547 5.491 5.576 0.076 1 0 "[ . 1 . 2]" 1
1388 1 67 ASP HA 1 68 LEU HG . . 5.170 5.013 4.624 5.246 0.076 12 0 "[ . 1 . 2]" 1
1389 1 67 ASP HA 1 69 LYS H . . 4.520 3.830 3.630 4.003 . 0 0 "[ . 1 . 2]" 1
1390 1 67 ASP HB2 1 68 LEU H . . 4.640 4.327 4.156 4.547 . 0 0 "[ . 1 . 2]" 1
1391 1 67 ASP HB2 1 69 LYS H . . 4.810 4.488 3.839 4.708 . 0 0 "[ . 1 . 2]" 1
1392 1 67 ASP HB2 1 69 LYS HB3 . . 5.210 5.080 4.223 5.297 0.087 20 0 "[ . 1 . 2]" 1
1393 1 67 ASP HB3 1 68 LEU H . . 4.980 4.025 2.895 4.219 . 0 0 "[ . 1 . 2]" 1
1394 1 67 ASP HB3 1 69 LYS H . . 4.280 3.419 2.275 3.843 . 0 0 "[ . 1 . 2]" 1
1395 1 67 ASP HB3 1 69 LYS HB3 . . 5.500 3.794 3.298 4.209 . 0 0 "[ . 1 . 2]" 1
1396 1 67 ASP HB3 1 70 LEU H . . 4.830 3.453 3.010 4.037 . 0 0 "[ . 1 . 2]" 1
1397 1 68 LEU H 1 68 LEU HB2 . . 3.610 2.127 2.045 2.161 . 0 0 "[ . 1 . 2]" 1
1398 1 68 LEU H 1 68 LEU HB3 . . 3.370 3.345 3.229 3.426 0.056 9 0 "[ . 1 . 2]" 1
1399 1 68 LEU H 1 68 LEU QD . . 3.930 3.601 3.421 3.715 . 0 0 "[ . 1 . 2]" 1
1400 1 68 LEU H 1 68 LEU HG . . 3.460 3.449 3.239 3.538 0.078 20 0 "[ . 1 . 2]" 1
1401 1 68 LEU H 1 69 LYS H . . 3.390 2.671 2.587 2.753 . 0 0 "[ . 1 . 2]" 1
1402 1 68 LEU H 1 69 LYS HA . . 5.500 5.205 5.095 5.327 . 0 0 "[ . 1 . 2]" 1
1403 1 68 LEU HA 1 68 LEU QD . . 3.150 2.136 2.018 2.265 . 0 0 "[ . 1 . 2]" 1
1404 1 68 LEU HA 1 68 LEU HG . . 3.270 2.431 2.276 2.642 . 0 0 "[ . 1 . 2]" 1
1405 1 68 LEU HA 1 70 LEU H . . 3.830 3.705 3.543 3.874 0.044 10 0 "[ . 1 . 2]" 1
1406 1 68 LEU HA 1 71 LYS H . . 3.760 3.295 2.734 3.686 . 0 0 "[ . 1 . 2]" 1
1407 1 68 LEU HA 1 71 LYS HB2 . . 5.070 3.656 3.170 3.992 . 0 0 "[ . 1 . 2]" 1
1408 1 68 LEU HA 1 71 LYS HB3 . . 4.980 3.899 3.415 4.443 . 0 0 "[ . 1 . 2]" 1
1409 1 68 LEU HA 1 78 PHE QE . . 4.550 2.924 2.289 3.735 . 0 0 "[ . 1 . 2]" 1
1410 1 68 LEU HB2 1 69 LYS H . . 5.080 3.673 3.440 3.927 . 0 0 "[ . 1 . 2]" 1
1411 1 68 LEU HB3 1 69 LYS H . . 3.790 3.702 3.487 3.867 0.077 5 0 "[ . 1 . 2]" 1
1412 1 68 LEU QD 1 69 LYS H . . 5.370 4.414 4.310 4.541 . 0 0 "[ . 1 . 2]" 1
1413 1 68 LEU QD 1 70 LEU H . . 5.500 4.810 4.568 4.980 . 0 0 "[ . 1 . 2]" 1
1414 1 68 LEU QD 1 78 PHE HB3 . . 5.500 4.827 4.429 5.380 . 0 0 "[ . 1 . 2]" 1
1415 1 68 LEU QD 1 78 PHE QE . . 3.110 2.879 2.483 3.208 0.098 2 0 "[ . 1 . 2]" 1
1416 1 68 LEU QD 1 78 PHE HZ . . 3.350 2.844 2.517 3.420 0.070 10 0 "[ . 1 . 2]" 1
1417 1 68 LEU QD 1 105 VAL HA . . 3.750 3.319 2.842 3.842 0.092 12 0 "[ . 1 . 2]" 1
1418 1 68 LEU QD 1 105 VAL HB . . 4.410 4.270 3.949 4.529 0.119 10 0 "[ . 1 . 2]" 1
1419 1 68 LEU QD 1 105 VAL MG1 . . 3.120 2.101 1.915 2.363 . 0 0 "[ . 1 . 2]" 1
1420 1 68 LEU HG 1 69 LYS H . . 5.140 5.191 5.056 5.219 0.079 15 0 "[ . 1 . 2]" 1
1421 1 69 LYS H 1 69 LYS HB2 . . 3.350 2.292 2.161 2.377 . 0 0 "[ . 1 . 2]" 1
1422 1 69 LYS H 1 69 LYS HB3 . . 2.950 2.773 2.573 2.968 0.018 1 0 "[ . 1 . 2]" 1
1423 1 69 LYS H 1 70 LEU H . . 3.240 2.718 2.618 2.832 . 0 0 "[ . 1 . 2]" 1
1424 1 69 LYS H 1 70 LEU HA . . 5.490 5.321 5.230 5.431 . 0 0 "[ . 1 . 2]" 1
1425 1 69 LYS H 1 71 LYS H . . 4.300 4.344 4.168 4.376 0.076 4 0 "[ . 1 . 2]" 1
1426 1 69 LYS HA 1 69 LYS QD . . 3.650 3.332 2.700 3.679 0.029 17 0 "[ . 1 . 2]" 1
1427 1 69 LYS HA 1 69 LYS QE . . 5.080 3.501 2.268 4.632 . 0 0 "[ . 1 . 2]" 1
1428 1 69 LYS HA 1 69 LYS HG2 . . 3.430 2.376 2.189 2.551 . 0 0 "[ . 1 . 2]" 1
1429 1 69 LYS HA 1 69 LYS HG3 . . 3.840 3.612 3.424 3.738 . 0 0 "[ . 1 . 2]" 1
1430 1 69 LYS HA 1 71 LYS H . . 4.140 3.993 3.545 4.205 0.065 6 0 "[ . 1 . 2]" 1
1431 1 69 LYS HA 1 72 ASP H . . 3.640 3.371 2.993 3.605 . 0 0 "[ . 1 . 2]" 1
1432 1 69 LYS HA 1 72 ASP HB2 . . 4.110 3.452 2.651 4.116 0.006 15 0 "[ . 1 . 2]" 1
1433 1 69 LYS HA 1 72 ASP HB3 . . 3.770 3.455 2.681 3.836 0.066 7 0 "[ . 1 . 2]" 1
1434 1 69 LYS HB2 1 70 LEU H . . 4.440 3.908 3.684 4.110 . 0 0 "[ . 1 . 2]" 1
1435 1 69 LYS HB3 1 69 LYS QD . . 3.350 2.410 2.239 2.521 . 0 0 "[ . 1 . 2]" 1
1436 1 69 LYS HB3 1 69 LYS QE . . 4.810 3.939 3.645 4.285 . 0 0 "[ . 1 . 2]" 1
1437 1 69 LYS HB3 1 70 LEU H . . 3.760 2.965 2.798 3.094 . 0 0 "[ . 1 . 2]" 1
1438 1 69 LYS HB3 1 70 LEU HB3 . . 5.180 5.220 4.977 5.263 0.083 3 0 "[ . 1 . 2]" 1
1439 1 69 LYS QD 1 70 LEU H . . 5.500 4.034 3.681 4.319 . 0 0 "[ . 1 . 2]" 1
1440 1 69 LYS QD 1 72 ASP HB2 . . 5.170 4.730 3.554 5.257 0.087 8 0 "[ . 1 . 2]" 1
1441 1 69 LYS QD 1 72 ASP HB3 . . 4.980 3.579 2.126 4.145 . 0 0 "[ . 1 . 2]" 1
1442 1 69 LYS QD 1 73 THR HB . . 3.990 3.732 2.826 4.068 0.078 11 0 "[ . 1 . 2]" 1
1443 1 69 LYS QD 1 73 THR MG . . 4.010 3.110 2.612 3.586 . 0 0 "[ . 1 . 2]" 1
1444 1 69 LYS QE 1 73 THR HB . . 3.050 2.785 2.149 3.095 0.045 1 0 "[ . 1 . 2]" 1
1445 1 69 LYS QE 1 73 THR MG . . 4.540 3.219 2.615 4.084 . 0 0 "[ . 1 . 2]" 1
1446 1 69 LYS HG2 1 70 LEU H . . 5.090 5.101 4.885 5.165 0.075 2 0 "[ . 1 . 2]" 1
1447 1 69 LYS HG3 1 70 LEU H . . 5.500 5.353 5.170 5.527 0.027 19 0 "[ . 1 . 2]" 1
1448 1 70 LEU H 1 70 LEU HB2 . . 3.730 2.664 2.499 2.809 . 0 0 "[ . 1 . 2]" 1
1449 1 70 LEU H 1 70 LEU HB3 . . 2.980 2.396 2.253 2.558 . 0 0 "[ . 1 . 2]" 1
1450 1 70 LEU H 1 70 LEU QD . . 4.220 3.763 3.680 3.839 . 0 0 "[ . 1 . 2]" 1
1451 1 70 LEU H 1 70 LEU HG . . 5.500 4.489 4.358 4.711 . 0 0 "[ . 1 . 2]" 1
1452 1 70 LEU H 1 71 LYS H . . 3.320 2.809 2.698 2.871 . 0 0 "[ . 1 . 2]" 1
1453 1 70 LEU H 1 71 LYS HB2 . . 5.350 5.045 4.760 5.204 . 0 0 "[ . 1 . 2]" 1
1454 1 70 LEU H 1 72 ASP H . . 4.580 4.324 4.108 4.582 0.002 16 0 "[ . 1 . 2]" 1
1455 1 70 LEU H 1 73 THR H . . 5.380 5.211 4.890 5.437 0.057 7 0 "[ . 1 . 2]" 1
1456 1 70 LEU H 1 78 PHE QD . . 5.500 4.658 3.706 5.326 . 0 0 "[ . 1 . 2]" 1
1457 1 70 LEU HA 1 70 LEU QD . . 3.060 2.270 2.140 2.578 . 0 0 "[ . 1 . 2]" 1
1458 1 70 LEU HA 1 70 LEU HG . . 4.090 3.308 3.117 3.869 . 0 0 "[ . 1 . 2]" 1
1459 1 70 LEU HA 1 73 THR H . . 4.000 3.479 3.321 3.638 . 0 0 "[ . 1 . 2]" 1
1460 1 70 LEU HA 1 73 THR HB . . 4.480 4.431 4.103 4.558 0.078 10 0 "[ . 1 . 2]" 1
1461 1 70 LEU HA 1 73 THR MG . . 4.610 2.073 1.960 2.228 . 0 0 "[ . 1 . 2]" 1
1462 1 70 LEU HA 1 74 ASN H . . 4.340 3.828 3.469 4.071 . 0 0 "[ . 1 . 2]" 1
1463 1 70 LEU HB2 1 73 THR MG . . 3.960 3.957 3.739 4.053 0.093 13 0 "[ . 1 . 2]" 1
1464 1 70 LEU HB3 1 70 LEU QD . . 3.270 2.254 2.156 2.391 . 0 0 "[ . 1 . 2]" 1
1465 1 70 LEU HB3 1 71 LYS H . . 4.350 2.967 2.709 3.185 . 0 0 "[ . 1 . 2]" 1
1466 1 70 LEU HB3 1 78 PHE QD . . 4.630 2.935 2.219 3.662 . 0 0 "[ . 1 . 2]" 1
1467 1 70 LEU QD 1 73 THR H . . 5.380 4.098 3.390 4.753 . 0 0 "[ . 1 . 2]" 1
1468 1 70 LEU QD 1 74 ASN H . . 4.290 3.202 2.111 3.949 . 0 0 "[ . 1 . 2]" 1
1469 1 70 LEU QD 1 74 ASN HA . . 5.220 4.422 3.631 5.058 . 0 0 "[ . 1 . 2]" 1
1470 1 70 LEU QD 1 74 ASN HB2 . . 3.670 3.279 2.797 3.705 0.035 7 0 "[ . 1 . 2]" 1
1471 1 70 LEU QD 1 74 ASN HB3 . . 3.590 2.252 1.934 3.657 0.067 7 0 "[ . 1 . 2]" 1
1472 1 70 LEU QD 1 74 ASN QD . . 4.570 2.813 1.667 3.280 . 0 0 "[ . 1 . 2]" 1
1473 1 70 LEU QD 1 75 PRO HA . . 5.500 4.495 2.137 4.997 . 0 0 "[ . 1 . 2]" 1
1474 1 70 LEU QD 1 77 GLY H . . 5.500 4.235 3.061 4.798 . 0 0 "[ . 1 . 2]" 1
1475 1 70 LEU QD 1 78 PHE H . . 4.640 3.165 2.026 3.894 . 0 0 "[ . 1 . 2]" 1
1476 1 70 LEU QD 1 78 PHE HA . . 3.580 3.030 2.555 3.480 . 0 0 "[ . 1 . 2]" 1
1477 1 70 LEU QD 1 78 PHE HB2 . . 3.870 2.684 1.885 3.128 . 0 0 "[ . 1 . 2]" 1
1478 1 70 LEU QD 1 78 PHE HB3 . . 4.520 3.968 2.840 4.399 . 0 0 "[ . 1 . 2]" 1
1479 1 70 LEU QD 1 78 PHE QD . . 3.720 2.626 2.252 3.107 . 0 0 "[ . 1 . 2]" 1
1480 1 70 LEU QD 1 79 ASN H . . 5.500 5.010 4.166 5.379 . 0 0 "[ . 1 . 2]" 1
1481 1 70 LEU HG 1 71 LYS H . . 5.340 3.960 3.589 4.754 . 0 0 "[ . 1 . 2]" 1
1482 1 70 LEU HG 1 71 LYS HA . . 5.500 3.823 3.323 5.040 . 0 0 "[ . 1 . 2]" 1
1483 1 70 LEU HG 1 74 ASN H . . 5.030 4.063 3.533 4.845 . 0 0 "[ . 1 . 2]" 1
1484 1 70 LEU HG 1 74 ASN HB2 . . 5.500 5.074 4.521 5.597 0.097 12 0 "[ . 1 . 2]" 1
1485 1 70 LEU HG 1 74 ASN HB3 . . 4.790 3.498 2.764 4.719 . 0 0 "[ . 1 . 2]" 1
1486 1 70 LEU HG 1 75 PRO HA . . 4.690 4.715 4.329 4.788 0.098 3 0 "[ . 1 . 2]" 1
1487 1 70 LEU HG 1 78 PHE H . . 4.760 3.557 2.839 4.139 . 0 0 "[ . 1 . 2]" 1
1488 1 70 LEU HG 1 78 PHE HA . . 4.540 4.324 3.746 4.612 0.072 7 0 "[ . 1 . 2]" 1
1489 1 70 LEU HG 1 78 PHE HB2 . . 4.190 2.867 2.142 3.599 . 0 0 "[ . 1 . 2]" 1
1490 1 70 LEU HG 1 78 PHE HB3 . . 4.990 4.401 3.750 5.075 0.085 3 0 "[ . 1 . 2]" 1
1491 1 70 LEU HG 1 78 PHE QD . . 4.340 3.790 2.878 4.357 0.017 12 0 "[ . 1 . 2]" 1
1492 1 71 LYS H 1 71 LYS HB2 . . 3.330 2.443 2.348 2.532 . 0 0 "[ . 1 . 2]" 1
1493 1 71 LYS H 1 71 LYS HB3 . . 3.290 2.471 2.308 2.607 . 0 0 "[ . 1 . 2]" 1
1494 1 71 LYS H 1 71 LYS QD . . 4.650 4.281 4.134 4.421 . 0 0 "[ . 1 . 2]" 1
1495 1 71 LYS H 1 71 LYS HG2 . . 4.850 4.522 4.414 4.652 . 0 0 "[ . 1 . 2]" 1
1496 1 71 LYS H 1 71 LYS HG3 . . 5.140 4.488 4.405 4.549 . 0 0 "[ . 1 . 2]" 1
1497 1 71 LYS H 1 72 ASP HB2 . . 5.070 4.934 4.472 5.152 0.082 15 0 "[ . 1 . 2]" 1
1498 1 71 LYS H 1 73 THR H . . 4.610 4.273 4.092 4.419 . 0 0 "[ . 1 . 2]" 1
1499 1 71 LYS H 1 73 THR MG . . 4.530 4.506 4.320 4.616 0.086 18 0 "[ . 1 . 2]" 1
1500 1 71 LYS H 1 78 PHE QD . . 4.380 3.795 3.204 4.453 0.073 9 0 "[ . 1 . 2]" 1
1501 1 71 LYS HA 1 71 LYS QD . . 4.650 2.789 2.323 3.489 . 0 0 "[ . 1 . 2]" 1
1502 1 71 LYS HA 1 71 LYS HG2 . . 4.000 3.843 3.555 3.955 . 0 0 "[ . 1 . 2]" 1
1503 1 71 LYS HA 1 71 LYS HG3 . . 3.570 2.898 2.453 3.344 . 0 0 "[ . 1 . 2]" 1
1504 1 71 LYS HA 1 73 THR H . . 5.500 4.245 3.714 4.703 . 0 0 "[ . 1 . 2]" 1
1505 1 71 LYS HA 1 74 ASN H . . 4.750 3.534 3.276 3.920 . 0 0 "[ . 1 . 2]" 1
1506 1 71 LYS HA 1 75 PRO HA . . 3.210 2.111 2.006 2.250 . 0 0 "[ . 1 . 2]" 1
1507 1 71 LYS HA 1 75 PRO HD2 . . 5.140 5.186 4.879 5.225 0.085 7 0 "[ . 1 . 2]" 1
1508 1 71 LYS HA 1 78 PHE H . . 4.580 4.134 3.706 4.647 0.067 10 0 "[ . 1 . 2]" 1
1509 1 71 LYS HA 1 78 PHE HB2 . . 3.540 3.025 2.675 3.590 0.050 10 0 "[ . 1 . 2]" 1
1510 1 71 LYS HA 1 78 PHE QD . . 4.320 4.219 3.685 4.420 0.100 14 0 "[ . 1 . 2]" 1
1511 1 71 LYS HB2 1 71 LYS QD . . 3.480 2.258 2.123 2.443 . 0 0 "[ . 1 . 2]" 1
1512 1 71 LYS HB2 1 71 LYS QE . . 4.200 3.906 3.528 4.081 . 0 0 "[ . 1 . 2]" 1
1513 1 71 LYS HB2 1 72 ASP H . . 4.200 4.080 3.966 4.255 0.055 10 0 "[ . 1 . 2]" 1
1514 1 71 LYS HB2 1 75 PRO HA . . 5.200 3.991 3.733 4.287 . 0 0 "[ . 1 . 2]" 1
1515 1 71 LYS HB2 1 78 PHE HA . . 5.430 5.401 4.974 5.513 0.083 12 0 "[ . 1 . 2]" 1
1516 1 71 LYS HB2 1 78 PHE HB2 . . 5.190 3.320 2.706 3.598 . 0 0 "[ . 1 . 2]" 1
1517 1 71 LYS HB2 1 78 PHE QD . . 5.230 3.300 2.808 3.705 . 0 0 "[ . 1 . 2]" 1
1518 1 71 LYS HB3 1 71 LYS QE . . 4.420 4.274 4.037 4.514 0.094 3 0 "[ . 1 . 2]" 1
1519 1 71 LYS HB3 1 72 ASP H . . 3.560 2.961 2.708 3.447 . 0 0 "[ . 1 . 2]" 1
1520 1 71 LYS HB3 1 72 ASP HA . . 5.040 4.507 4.272 4.850 . 0 0 "[ . 1 . 2]" 1
1521 1 71 LYS HB3 1 72 ASP HB2 . . 5.200 4.521 4.140 4.956 . 0 0 "[ . 1 . 2]" 1
1522 1 71 LYS QD 1 72 ASP H . . 5.480 5.201 4.877 5.463 . 0 0 "[ . 1 . 2]" 1
1523 1 71 LYS QD 1 75 PRO HA . . 5.500 2.583 1.992 3.315 . 0 0 "[ . 1 . 2]" 1
1524 1 71 LYS QD 1 78 PHE HA . . 4.740 4.797 4.635 4.845 0.105 3 0 "[ . 1 . 2]" 1
1525 1 71 LYS QD 1 78 PHE QD . . 4.220 2.358 2.073 3.004 . 0 0 "[ . 1 . 2]" 1
1526 1 71 LYS QD 1 78 PHE QE . . 4.270 3.433 2.900 4.004 . 0 0 "[ . 1 . 2]" 1
1527 1 71 LYS QE 1 71 LYS HG2 . . 3.180 2.468 2.033 3.044 . 0 0 "[ . 1 . 2]" 1
1528 1 71 LYS QE 1 78 PHE HB3 . . 4.190 4.028 3.584 4.274 0.084 8 0 "[ . 1 . 2]" 1
1529 1 71 LYS QE 1 105 VAL MG1 . . 5.500 4.539 3.865 5.583 0.083 17 0 "[ . 1 . 2]" 1
1530 1 71 LYS QE 1 106 THR HA . . 4.200 2.524 2.042 3.184 . 0 0 "[ . 1 . 2]" 1
1531 1 71 LYS QE 1 106 THR HB . . 5.500 3.201 2.093 4.035 . 0 0 "[ . 1 . 2]" 1
1532 1 71 LYS QE 1 106 THR MG . . 5.500 2.319 1.816 3.128 . 0 0 "[ . 1 . 2]" 1
1533 1 71 LYS QE 1 107 GLU H . . 5.500 5.038 3.323 5.576 0.076 1 0 "[ . 1 . 2]" 1
1534 1 71 LYS HG2 1 72 ASP H . . 5.340 4.763 4.114 5.383 0.043 10 0 "[ . 1 . 2]" 1
1535 1 71 LYS HG2 1 75 PRO HA . . 5.400 4.622 3.789 5.452 0.052 12 0 "[ . 1 . 2]" 1
1536 1 71 LYS HG2 1 78 PHE QD . . 4.950 4.655 4.220 4.987 0.037 16 0 "[ . 1 . 2]" 1
1537 1 71 LYS HG3 1 75 PRO HA . . 4.400 3.312 2.068 4.443 0.043 7 0 "[ . 1 . 2]" 1
1538 1 71 LYS HG3 1 75 PRO HB3 . . 5.500 2.694 2.234 3.681 . 0 0 "[ . 1 . 2]" 1
1539 1 71 LYS HG3 1 78 PHE QD . . 5.460 4.933 4.396 5.288 . 0 0 "[ . 1 . 2]" 1
1540 1 72 ASP H 1 72 ASP HB2 . . 3.320 2.489 2.211 2.815 . 0 0 "[ . 1 . 2]" 1
1541 1 72 ASP H 1 72 ASP HB3 . . 3.090 2.433 2.217 2.871 . 0 0 "[ . 1 . 2]" 1
1542 1 72 ASP H 1 73 THR H . . 3.050 2.546 2.294 2.682 . 0 0 "[ . 1 . 2]" 1
1543 1 72 ASP H 1 73 THR HA . . 5.410 5.227 5.047 5.359 . 0 0 "[ . 1 . 2]" 1
1544 1 72 ASP H 1 74 ASN H . . 4.120 4.078 3.792 4.200 0.080 3 0 "[ . 1 . 2]" 1
1545 1 72 ASP HA 1 72 ASP HB2 . . 2.960 2.491 2.370 2.699 . 0 0 "[ . 1 . 2]" 1
1546 1 72 ASP HB2 1 73 THR H . . 3.770 3.836 3.795 3.858 0.088 19 0 "[ . 1 . 2]" 1
1547 1 72 ASP HB3 1 73 THR H . . 3.410 2.634 2.378 3.221 . 0 0 "[ . 1 . 2]" 1
1548 1 72 ASP HB3 1 73 THR HA . . 4.600 4.363 4.231 4.545 . 0 0 "[ . 1 . 2]" 1
1549 1 72 ASP HB3 1 73 THR MG . . 4.670 3.755 3.048 4.131 . 0 0 "[ . 1 . 2]" 1
1550 1 73 THR H 1 73 THR MG . . 3.310 2.153 1.895 2.323 . 0 0 "[ . 1 . 2]" 1
1551 1 73 THR H 1 74 ASN H . . 2.920 2.415 2.087 2.682 . 0 0 "[ . 1 . 2]" 1
1552 1 73 THR H 1 74 ASN HA . . 5.320 5.069 4.783 5.298 . 0 0 "[ . 1 . 2]" 1
1553 1 73 THR H 1 75 PRO HD3 . . 5.500 4.253 3.379 4.694 . 0 0 "[ . 1 . 2]" 1
1554 1 73 THR HA 1 73 THR MG . . 3.290 3.255 3.205 3.284 . 0 0 "[ . 1 . 2]" 1
1555 1 73 THR HA 1 74 ASN HA . . 5.400 4.596 4.416 4.677 . 0 0 "[ . 1 . 2]" 1
1556 1 73 THR HA 1 75 PRO HD3 . . 5.000 4.343 4.024 4.719 . 0 0 "[ . 1 . 2]" 1
1557 1 73 THR MG 1 74 ASN H . . 4.200 2.585 2.177 3.058 . 0 0 "[ . 1 . 2]" 1
1558 1 73 THR MG 1 74 ASN HB3 . . 5.500 3.209 2.807 3.808 . 0 0 "[ . 1 . 2]" 1
1559 1 73 THR MG 1 75 PRO HD3 . . 5.240 5.020 4.539 5.312 0.072 5 0 "[ . 1 . 2]" 1
1560 1 74 ASN H 1 74 ASN HB2 . . 3.860 3.431 3.083 3.906 0.046 7 0 "[ . 1 . 2]" 1
1561 1 74 ASN H 1 74 ASN HB3 . . 3.610 2.994 2.828 3.234 . 0 0 "[ . 1 . 2]" 1
1562 1 74 ASN H 1 75 PRO HD2 . . 4.630 3.848 3.459 4.166 . 0 0 "[ . 1 . 2]" 1
1563 1 74 ASN H 1 75 PRO HD3 . . 3.930 3.080 2.757 3.374 . 0 0 "[ . 1 . 2]" 1
1564 1 74 ASN H 1 75 PRO QG . . 5.100 4.903 4.653 5.138 0.038 4 0 "[ . 1 . 2]" 1
1565 1 74 ASN HA 1 75 PRO HB3 . . 5.220 5.274 5.173 5.304 0.084 9 0 "[ . 1 . 2]" 1
1566 1 74 ASN HA 1 75 PRO HD2 . . 3.160 2.150 2.052 2.374 . 0 0 "[ . 1 . 2]" 1
1567 1 74 ASN HA 1 75 PRO HD3 . . 3.430 3.010 2.793 3.250 . 0 0 "[ . 1 . 2]" 1
1568 1 74 ASN HA 1 75 PRO QG . . 4.290 3.976 3.862 4.184 . 0 0 "[ . 1 . 2]" 1
1569 1 74 ASN HA 1 76 GLU H . . 4.370 3.537 3.260 3.742 . 0 0 "[ . 1 . 2]" 1
1570 1 74 ASN HA 1 77 GLY H . . 4.810 4.327 4.015 4.779 . 0 0 "[ . 1 . 2]" 1
1571 1 74 ASN HB2 1 75 PRO HD2 . . 5.060 4.616 4.412 4.948 . 0 0 "[ . 1 . 2]" 1
1572 1 74 ASN HB3 1 75 PRO HD2 . . 5.420 4.892 4.717 4.985 . 0 0 "[ . 1 . 2]" 1
1573 1 74 ASN HB3 1 77 GLY H . . 5.230 4.076 3.766 4.905 . 0 0 "[ . 1 . 2]" 1
1574 1 74 ASN QD 1 76 GLU HB2 . . 5.150 4.975 4.178 5.955 0.805 7 1 "[ . + 1 . 2]" 1
1575 1 74 ASN QD 1 77 GLY H . . 4.850 2.649 1.761 3.126 . 0 0 "[ . 1 . 2]" 1
1576 1 74 ASN QD 1 77 GLY HA2 . . 4.530 3.500 3.075 4.217 . 0 0 "[ . 1 . 2]" 1
1577 1 74 ASN QD 1 77 GLY HA3 . . 4.410 2.475 1.851 3.147 . 0 0 "[ . 1 . 2]" 1
1578 1 75 PRO HA 1 78 PHE H . . 3.920 3.432 2.853 3.995 0.075 14 0 "[ . 1 . 2]" 1
1579 1 75 PRO HA 1 78 PHE HB2 . . 3.870 3.549 2.957 3.967 0.097 14 0 "[ . 1 . 2]" 1
1580 1 75 PRO HA 1 78 PHE HB3 . . 4.000 2.860 2.357 3.767 . 0 0 "[ . 1 . 2]" 1
1581 1 75 PRO HA 1 78 PHE QD . . 5.060 4.625 4.304 5.158 0.098 14 0 "[ . 1 . 2]" 1
1582 1 75 PRO HA 1 79 ASN H . . 5.140 3.993 3.783 4.216 . 0 0 "[ . 1 . 2]" 1
1583 1 75 PRO HB2 1 76 GLU H . . 3.790 3.530 3.249 3.854 0.064 14 0 "[ . 1 . 2]" 1
1584 1 75 PRO HB3 1 76 GLU H . . 4.300 4.281 4.121 4.387 0.087 14 0 "[ . 1 . 2]" 1
1585 1 75 PRO HD2 1 76 GLU H . . 3.860 2.960 2.559 3.223 . 0 0 "[ . 1 . 2]" 1
1586 1 75 PRO HD3 1 76 GLU H . . 4.530 4.028 3.804 4.191 . 0 0 "[ . 1 . 2]" 1
1587 1 75 PRO QG 1 76 GLU H . . 3.510 2.589 2.191 2.978 . 0 0 "[ . 1 . 2]" 1
1588 1 75 PRO QG 1 77 GLY H . . 5.500 5.049 4.796 5.354 . 0 0 "[ . 1 . 2]" 1
1589 1 76 GLU H 1 76 GLU HB2 . . 3.310 2.251 1.942 2.504 . 0 0 "[ . 1 . 2]" 1
1590 1 76 GLU H 1 76 GLU HB3 . . 2.870 2.552 2.323 3.100 0.230 16 0 "[ . 1 . 2]" 1
1591 1 76 GLU H 1 77 GLY H . . 3.220 2.694 2.408 2.789 . 0 0 "[ . 1 . 2]" 1
1592 1 76 GLU H 1 77 GLY HA3 . . 5.000 4.976 4.696 5.070 0.070 4 0 "[ . 1 . 2]" 1
1593 1 76 GLU HA 1 76 GLU QG . . 3.220 2.365 2.091 2.553 . 0 0 "[ . 1 . 2]" 1
1594 1 76 GLU HA 1 79 ASN H . . 3.990 3.659 3.330 4.062 0.072 14 0 "[ . 1 . 2]" 1
1595 1 76 GLU HA 1 79 ASN HB2 . . 3.170 2.896 2.351 3.912 0.742 14 4 "[ * 1 +* - 2]" 1
1596 1 76 GLU HA 1 79 ASN HB3 . . 3.870 3.423 2.409 3.958 0.088 4 0 "[ . 1 . 2]" 1
1597 1 76 GLU HA 1 79 ASN HD21 . . 3.920 2.873 2.117 3.755 . 0 0 "[ . 1 . 2]" 1
1598 1 76 GLU HA 1 79 ASN HD22 . . 4.560 4.216 3.702 4.638 0.078 13 0 "[ . 1 . 2]" 1
1599 1 76 GLU HA 1 80 GLN H . . 4.630 4.148 3.859 4.578 . 0 0 "[ . 1 . 2]" 1
1600 1 76 GLU HB2 1 77 GLY H . . 3.820 3.648 3.086 3.695 . 0 0 "[ . 1 . 2]" 1
1601 1 76 GLU HB3 1 76 GLU QG . . 2.750 2.356 2.209 2.492 . 0 0 "[ . 1 . 2]" 1
1602 1 76 GLU HB3 1 77 GLY H . . 3.610 2.440 2.242 2.790 . 0 0 "[ . 1 . 2]" 1
1603 1 76 GLU QG 1 77 GLY H . . 4.240 3.734 3.336 4.255 0.015 16 0 "[ . 1 . 2]" 1
1604 1 76 GLU QG 1 77 GLY HA2 . . 5.180 4.012 3.405 5.131 . 0 0 "[ . 1 . 2]" 1
1605 1 76 GLU QG 1 79 ASN H . . 5.500 5.145 4.828 5.568 0.068 16 0 "[ . 1 . 2]" 1
1606 1 76 GLU QG 1 79 ASN HB2 . . 4.590 4.410 3.612 5.303 0.713 5 6 "[* + 1 ** * -2]" 1
1607 1 76 GLU QG 1 79 ASN HB3 . . 5.220 4.558 3.736 5.210 . 0 0 "[ . 1 . 2]" 1
1608 1 76 GLU QG 1 79 ASN HD22 . . 5.500 5.122 3.815 5.599 0.099 12 0 "[ . 1 . 2]" 1
1609 1 76 GLU QG 1 80 GLN H . . 5.500 4.397 3.982 4.901 . 0 0 "[ . 1 . 2]" 1
1610 1 76 GLU QG 1 80 GLN HE21 . . 4.410 3.418 2.378 4.037 . 0 0 "[ . 1 . 2]" 1
1611 1 76 GLU QG 1 80 GLN HE22 . . 5.170 4.748 2.795 5.251 0.081 4 0 "[ . 1 . 2]" 1
1612 1 76 GLU QG 1 80 GLN QG . . 3.660 3.213 2.684 3.653 . 0 0 "[ . 1 . 2]" 1
1613 1 77 GLY H 1 78 PHE H . . 3.390 2.760 2.424 3.049 . 0 0 "[ . 1 . 2]" 1
1614 1 77 GLY H 1 78 PHE HB2 . . 5.310 5.067 4.668 5.314 0.004 1 0 "[ . 1 . 2]" 1
1615 1 77 GLY H 1 79 ASN H . . 4.660 4.130 3.811 4.330 . 0 0 "[ . 1 . 2]" 1
1616 1 77 GLY H 1 80 GLN H . . 5.500 4.811 4.581 5.019 . 0 0 "[ . 1 . 2]" 1
1617 1 77 GLY HA2 1 80 GLN H . . 4.570 3.540 3.101 3.800 . 0 0 "[ . 1 . 2]" 1
1618 1 77 GLY HA2 1 80 GLN HB2 . . 4.290 2.882 2.356 3.121 . 0 0 "[ . 1 . 2]" 1
1619 1 77 GLY HA2 1 80 GLN HB3 . . 4.700 4.520 3.969 4.768 0.068 13 0 "[ . 1 . 2]" 1
1620 1 77 GLY HA2 1 81 LEU H . . 4.790 4.269 4.036 4.820 0.030 2 0 "[ . 1 . 2]" 1
1621 1 77 GLY HA3 1 80 GLN H . . 5.250 4.774 4.453 4.990 . 0 0 "[ . 1 . 2]" 1
1622 1 77 GLY HA3 1 80 GLN HB2 . . 4.660 4.465 3.910 4.721 0.061 1 0 "[ . 1 . 2]" 1
1623 1 78 PHE H 1 78 PHE HB2 . . 3.330 2.444 2.265 2.657 . 0 0 "[ . 1 . 2]" 1
1624 1 78 PHE H 1 78 PHE HB3 . . 3.280 2.569 2.418 2.812 . 0 0 "[ . 1 . 2]" 1
1625 1 78 PHE H 1 78 PHE QD . . 4.470 4.188 4.103 4.264 . 0 0 "[ . 1 . 2]" 1
1626 1 78 PHE H 1 79 ASN H . . 3.490 2.699 2.360 2.858 . 0 0 "[ . 1 . 2]" 1
1627 1 78 PHE H 1 80 GLN H . . 5.480 4.396 3.966 4.652 . 0 0 "[ . 1 . 2]" 1
1628 1 78 PHE H 1 81 LEU H . . 5.490 4.754 4.565 4.907 . 0 0 "[ . 1 . 2]" 1
1629 1 78 PHE HA 1 78 PHE QD . . 3.690 2.954 2.469 3.162 . 0 0 "[ . 1 . 2]" 1
1630 1 78 PHE HA 1 81 LEU H . . 4.090 3.402 3.183 3.622 . 0 0 "[ . 1 . 2]" 1
1631 1 78 PHE HA 1 81 LEU HB2 . . 3.920 2.630 2.293 2.826 . 0 0 "[ . 1 . 2]" 1
1632 1 78 PHE HA 1 81 LEU HB3 . . 3.910 3.207 2.920 3.849 . 0 0 "[ . 1 . 2]" 1
1633 1 78 PHE HA 1 81 LEU QD . . 4.180 3.438 3.082 3.817 . 0 0 "[ . 1 . 2]" 1
1634 1 78 PHE HA 1 81 LEU HG . . 5.280 5.082 4.023 5.365 0.085 4 0 "[ . 1 . 2]" 1
1635 1 78 PHE HA 1 82 MET H . . 5.500 4.219 4.000 4.515 . 0 0 "[ . 1 . 2]" 1
1636 1 78 PHE HB2 1 79 ASN H . . 3.850 3.801 3.545 3.905 0.055 9 0 "[ . 1 . 2]" 1
1637 1 78 PHE HB3 1 79 ASN H . . 3.400 2.562 2.336 2.889 . 0 0 "[ . 1 . 2]" 1
1638 1 78 PHE HB3 1 79 ASN HA . . 5.230 4.326 3.922 4.495 . 0 0 "[ . 1 . 2]" 1
1639 1 78 PHE QD 1 79 ASN H . . 4.200 3.489 3.118 4.083 . 0 0 "[ . 1 . 2]" 1
1640 1 78 PHE QD 1 79 ASN HA . . 4.860 3.281 2.853 3.840 . 0 0 "[ . 1 . 2]" 1
1641 1 78 PHE QE 1 82 MET ME . . 3.880 3.091 2.228 3.786 . 0 0 "[ . 1 . 2]" 1
1642 1 78 PHE QE 1 82 MET HG3 . . 4.950 2.983 2.491 3.603 . 0 0 "[ . 1 . 2]" 1
1643 1 78 PHE QE 1 106 THR HA . . 4.580 3.842 3.005 4.549 . 0 0 "[ . 1 . 2]" 1
1644 1 78 PHE QE 1 106 THR HB . . 5.500 5.221 4.815 5.574 0.074 8 0 "[ . 1 . 2]" 1
1645 1 78 PHE QE 1 106 THR MG . . 4.030 2.558 2.040 2.894 . 0 0 "[ . 1 . 2]" 1
1646 1 78 PHE HZ 1 82 MET ME . . 3.930 3.422 2.315 4.009 0.079 12 0 "[ . 1 . 2]" 1
1647 1 78 PHE HZ 1 82 MET HG2 . . 4.660 4.588 4.108 4.898 0.238 12 0 "[ . 1 . 2]" 1
1648 1 78 PHE HZ 1 105 VAL HB . . 4.460 4.209 3.537 4.513 0.053 5 0 "[ . 1 . 2]" 1
1649 1 78 PHE HZ 1 105 VAL MG1 . . 3.710 2.057 1.971 2.179 . 0 0 "[ . 1 . 2]" 1
1650 1 78 PHE HZ 1 105 VAL MG2 . . 4.060 4.097 3.787 4.168 0.108 17 0 "[ . 1 . 2]" 1
1651 1 78 PHE HZ 1 106 THR MG . . 4.780 4.570 3.935 4.860 0.080 19 0 "[ . 1 . 2]" 1
1652 1 79 ASN H 1 79 ASN HB2 . . 3.140 2.414 1.978 2.877 . 0 0 "[ . 1 . 2]" 1
1653 1 79 ASN H 1 79 ASN HB3 . . 3.540 3.041 2.085 3.595 0.055 2 0 "[ . 1 . 2]" 1
1654 1 79 ASN H 1 79 ASN HD21 . . 4.800 4.095 3.504 4.842 0.042 13 0 "[ . 1 . 2]" 1
1655 1 79 ASN H 1 79 ASN HD22 . . 5.500 4.875 4.167 5.581 0.081 8 0 "[ . 1 . 2]" 1
1656 1 79 ASN H 1 80 GLN H . . 3.410 2.926 2.745 3.115 . 0 0 "[ . 1 . 2]" 1
1657 1 79 ASN H 1 80 GLN HB2 . . 5.210 4.900 4.598 5.090 . 0 0 "[ . 1 . 2]" 1
1658 1 79 ASN H 1 80 GLN QG . . 5.480 4.952 4.685 5.224 . 0 0 "[ . 1 . 2]" 1
1659 1 79 ASN H 1 81 LEU H . . 4.360 4.098 3.951 4.322 . 0 0 "[ . 1 . 2]" 1
1660 1 79 ASN HA 1 82 MET H . . 3.940 3.635 3.404 4.027 0.087 13 0 "[ . 1 . 2]" 1
1661 1 79 ASN HA 1 82 MET HB2 . . 4.220 3.221 2.843 3.966 . 0 0 "[ . 1 . 2]" 1
1662 1 79 ASN HA 1 82 MET HG3 . . 4.910 3.538 2.769 4.360 . 0 0 "[ . 1 . 2]" 1
1663 1 79 ASN HA 1 106 THR MG . . 5.280 3.230 2.930 4.238 . 0 0 "[ . 1 . 2]" 1
1664 1 79 ASN HB2 1 79 ASN HD21 . . 3.630 2.784 2.281 3.559 . 0 0 "[ . 1 . 2]" 1
1665 1 79 ASN HB2 1 80 GLN H . . 3.790 3.105 2.447 3.883 0.093 5 0 "[ . 1 . 2]" 1
1666 1 79 ASN HB2 1 106 THR MG . . 5.030 4.747 3.813 5.146 0.116 12 0 "[ . 1 . 2]" 1
1667 1 79 ASN HB3 1 80 GLN H . . 3.790 3.034 2.398 3.681 . 0 0 "[ . 1 . 2]" 1
1668 1 80 GLN H 1 80 GLN HB2 . . 3.170 2.358 2.306 2.478 . 0 0 "[ . 1 . 2]" 1
1669 1 80 GLN H 1 80 GLN HB3 . . 3.490 3.556 3.536 3.573 0.083 5 0 "[ . 1 . 2]" 1
1670 1 80 GLN H 1 80 GLN QG . . 3.660 2.564 2.316 2.788 . 0 0 "[ . 1 . 2]" 1
1671 1 80 GLN H 1 81 LEU H . . 3.380 2.773 2.477 2.885 . 0 0 "[ . 1 . 2]" 1
1672 1 80 GLN HA 1 80 GLN HE21 . . 5.260 5.089 3.418 5.325 0.065 17 0 "[ . 1 . 2]" 1
1673 1 80 GLN HA 1 80 GLN QG . . 3.670 2.350 2.169 3.134 . 0 0 "[ . 1 . 2]" 1
1674 1 80 GLN HA 1 83 HIS H . . 3.610 3.374 3.169 3.668 0.058 13 0 "[ . 1 . 2]" 1
1675 1 80 GLN HA 1 83 HIS HB2 . . 3.550 3.241 2.952 3.620 0.070 18 0 "[ . 1 . 2]" 1
1676 1 80 GLN HA 1 83 HIS HB3 . . 3.340 2.918 2.612 3.327 . 0 0 "[ . 1 . 2]" 1
1677 1 80 GLN HB2 1 80 GLN HE21 . . 4.500 3.717 2.863 4.427 . 0 0 "[ . 1 . 2]" 1
1678 1 80 GLN HB2 1 80 GLN HE22 . . 5.140 4.534 4.224 5.233 0.093 3 0 "[ . 1 . 2]" 1
1679 1 80 GLN HB2 1 81 LEU H . . 3.730 2.830 2.574 3.133 . 0 0 "[ . 1 . 2]" 1
1680 1 80 GLN HB2 1 81 LEU HA . . 5.240 4.513 4.194 4.746 . 0 0 "[ . 1 . 2]" 1
1681 1 80 GLN HB3 1 81 LEU H . . 3.870 3.574 3.204 3.793 . 0 0 "[ . 1 . 2]" 1
1682 1 80 GLN HB3 1 81 LEU HA . . 5.370 4.240 3.924 4.522 . 0 0 "[ . 1 . 2]" 1
1683 1 80 GLN QG 1 81 LEU H . . 4.940 4.324 4.161 4.515 . 0 0 "[ . 1 . 2]" 1
1684 1 81 LEU H 1 81 LEU HB2 . . 3.200 2.142 2.080 2.256 . 0 0 "[ . 1 . 2]" 1
1685 1 81 LEU H 1 81 LEU HB3 . . 3.300 3.007 2.842 3.372 0.072 10 0 "[ . 1 . 2]" 1
1686 1 81 LEU H 1 81 LEU QD . . 4.410 3.515 3.005 3.778 . 0 0 "[ . 1 . 2]" 1
1687 1 81 LEU H 1 81 LEU HG . . 4.460 4.201 3.507 4.543 0.083 14 0 "[ . 1 . 2]" 1
1688 1 81 LEU HA 1 81 LEU QD . . 3.490 2.747 1.946 2.978 . 0 0 "[ . 1 . 2]" 1
1689 1 81 LEU HA 1 84 PHE H . . 3.970 3.549 3.319 3.792 . 0 0 "[ . 1 . 2]" 1
1690 1 81 LEU HA 1 84 PHE HB2 . . 3.930 3.565 3.108 3.948 0.018 3 0 "[ . 1 . 2]" 1
1691 1 81 LEU HA 1 84 PHE HB3 . . 3.630 3.018 2.581 3.319 . 0 0 "[ . 1 . 2]" 1
1692 1 81 LEU HA 1 84 PHE QD . . 4.850 4.632 3.978 4.947 0.097 7 0 "[ . 1 . 2]" 1
1693 1 81 LEU HB2 1 82 MET H . . 3.360 3.396 3.007 3.448 0.088 13 0 "[ . 1 . 2]" 1
1694 1 81 LEU HB3 1 82 MET H . . 3.200 2.597 2.306 3.007 . 0 0 "[ . 1 . 2]" 1
1695 1 81 LEU HB3 1 82 MET HA . . 3.870 3.934 3.798 3.956 0.086 1 0 "[ . 1 . 2]" 1
1696 1 81 LEU HB3 1 82 MET HG2 . . 5.340 3.671 3.318 4.143 . 0 0 "[ . 1 . 2]" 1
1697 1 81 LEU QD 1 82 MET HA . . 5.500 3.781 3.168 4.802 . 0 0 "[ . 1 . 2]" 1
1698 1 81 LEU QD 1 84 PHE HB3 . . 5.340 3.825 2.518 4.343 . 0 0 "[ . 1 . 2]" 1
1699 1 82 MET H 1 82 MET ME . . 4.640 4.488 3.784 4.742 0.102 13 0 "[ . 1 . 2]" 1
1700 1 82 MET H 1 82 MET HG2 . . 3.870 2.463 2.086 3.246 . 0 0 "[ . 1 . 2]" 1
1701 1 82 MET H 1 82 MET HG3 . . 3.310 3.384 2.256 3.811 0.501 17 1 "[ . 1 . + 2]" 1
1702 1 82 MET H 1 83 HIS H . . 3.300 2.798 2.637 2.971 . 0 0 "[ . 1 . 2]" 1
1703 1 82 MET H 1 83 HIS HB3 . . 5.500 5.138 4.819 5.524 0.024 9 0 "[ . 1 . 2]" 1
1704 1 82 MET H 1 84 PHE H . . 4.800 4.365 4.248 4.483 . 0 0 "[ . 1 . 2]" 1
1705 1 82 MET H 1 85 ALA H . . 5.350 5.165 4.925 5.414 0.064 6 0 "[ . 1 . 2]" 1
1706 1 82 MET HA 1 82 MET ME . . 3.450 3.055 2.188 3.557 0.107 20 0 "[ . 1 . 2]" 1
1707 1 82 MET HA 1 85 ALA H . . 3.810 3.631 3.287 3.888 0.078 16 0 "[ . 1 . 2]" 1
1708 1 82 MET HA 1 92 ILE MD . . 4.010 3.659 3.030 4.115 0.105 7 0 "[ . 1 . 2]" 1
1709 1 82 MET HA 1 102 ALA MB . . 5.500 4.266 3.687 4.964 . 0 0 "[ . 1 . 2]" 1
1710 1 82 MET HB2 1 83 HIS H . . 3.820 2.617 2.329 2.897 . 0 0 "[ . 1 . 2]" 1
1711 1 82 MET HB2 1 102 ALA MB . . 4.690 3.789 3.155 4.614 . 0 0 "[ . 1 . 2]" 1
1712 1 82 MET HB3 1 83 HIS H . . 4.380 3.626 3.426 3.864 . 0 0 "[ . 1 . 2]" 1
1713 1 82 MET HB3 1 83 HIS HB2 . . 5.260 5.212 4.953 5.337 0.077 13 0 "[ . 1 . 2]" 1
1714 1 82 MET ME 1 102 ALA HA . . 3.900 2.500 1.988 3.990 0.090 17 0 "[ . 1 . 2]" 1
1715 1 82 MET ME 1 102 ALA MB . . 3.660 2.505 1.902 3.722 0.062 7 0 "[ . 1 . 2]" 1
1716 1 82 MET ME 1 105 VAL HA . . 5.300 4.858 4.644 5.409 0.109 12 0 "[ . 1 . 2]" 1
1717 1 82 MET ME 1 105 VAL MG1 . . 3.660 2.509 1.992 3.597 . 0 0 "[ . 1 . 2]" 1
1718 1 82 MET ME 1 105 VAL MG2 . . 4.170 2.341 2.037 3.365 . 0 0 "[ . 1 . 2]" 1
1719 1 82 MET ME 1 106 THR H . . 5.450 4.314 3.782 5.062 . 0 0 "[ . 1 . 2]" 1
1720 1 82 MET ME 1 106 THR MG . . 3.330 3.280 2.840 3.452 0.122 13 0 "[ . 1 . 2]" 1
1721 1 82 MET HG2 1 83 HIS H . . 5.190 4.457 4.123 5.018 . 0 0 "[ . 1 . 2]" 1
1722 1 82 MET HG2 1 106 THR MG . . 5.040 3.676 3.116 4.669 . 0 0 "[ . 1 . 2]" 1
1723 1 82 MET HG3 1 83 HIS H . . 5.420 4.804 4.367 5.234 . 0 0 "[ . 1 . 2]" 1
1724 1 82 MET HG3 1 105 VAL MG1 . . 5.500 4.247 3.574 4.779 . 0 0 "[ . 1 . 2]" 1
1725 1 82 MET HG3 1 106 THR MG . . 5.500 2.622 2.064 3.908 . 0 0 "[ . 1 . 2]" 1
1726 1 83 HIS H 1 83 HIS HB2 . . 3.400 2.353 2.224 2.477 . 0 0 "[ . 1 . 2]" 1
1727 1 83 HIS H 1 83 HIS HB3 . . 2.910 2.666 2.349 2.862 . 0 0 "[ . 1 . 2]" 1
1728 1 83 HIS H 1 83 HIS HD2 . . 4.720 4.741 4.645 4.801 0.081 5 0 "[ . 1 . 2]" 1
1729 1 83 HIS H 1 84 PHE H . . 3.450 2.804 2.577 2.944 . 0 0 "[ . 1 . 2]" 1
1730 1 83 HIS HA 1 83 HIS HD2 . . 4.070 2.218 2.070 2.357 . 0 0 "[ . 1 . 2]" 1
1731 1 83 HIS HA 1 86 THR H . . 3.780 3.437 3.124 3.775 . 0 0 "[ . 1 . 2]" 1
1732 1 83 HIS HA 1 86 THR HB . . 3.510 3.129 2.362 3.576 0.066 18 0 "[ . 1 . 2]" 1
1733 1 83 HIS HA 1 86 THR MG . . 4.770 4.386 3.699 4.847 0.077 14 0 "[ . 1 . 2]" 1
1734 1 83 HIS HA 1 87 GLU H . . 4.330 4.033 3.813 4.390 0.060 18 0 "[ . 1 . 2]" 1
1735 1 83 HIS HB2 1 83 HIS HD2 . . 3.590 3.373 3.157 3.585 . 0 0 "[ . 1 . 2]" 1
1736 1 83 HIS HB2 1 83 HIS HE1 . . 5.200 5.096 4.924 5.250 0.050 13 0 "[ . 1 . 2]" 1
1737 1 83 HIS HB2 1 84 PHE H . . 3.740 3.787 3.730 3.824 0.084 13 0 "[ . 1 . 2]" 1
1738 1 83 HIS HB3 1 84 PHE H . . 3.690 2.584 2.395 2.809 . 0 0 "[ . 1 . 2]" 1
1739 1 83 HIS HB3 1 87 GLU QG . . 5.500 4.254 3.354 5.341 . 0 0 "[ . 1 . 2]" 1
1740 1 83 HIS HD2 1 86 THR HB . . 4.060 2.763 2.189 3.803 . 0 0 "[ . 1 . 2]" 1
1741 1 83 HIS HD2 1 86 THR MG . . 4.830 3.774 2.942 4.577 . 0 0 "[ . 1 . 2]" 1
1742 1 83 HIS HD2 1 87 GLU HB2 . . 5.000 5.003 4.114 5.083 0.083 15 0 "[ . 1 . 2]" 1
1743 1 83 HIS HD2 1 87 GLU QG . . 4.330 3.254 2.732 4.285 . 0 0 "[ . 1 . 2]" 1
1744 1 83 HIS HE1 1 87 GLU QG . . 4.390 3.553 2.915 4.314 . 0 0 "[ . 1 . 2]" 1
1745 1 84 PHE H 1 84 PHE HB2 . . 3.000 2.525 2.341 2.692 . 0 0 "[ . 1 . 2]" 1
1746 1 84 PHE H 1 84 PHE HB3 . . 3.580 2.479 2.280 2.666 . 0 0 "[ . 1 . 2]" 1
1747 1 84 PHE H 1 84 PHE QD . . 4.370 4.201 4.106 4.278 . 0 0 "[ . 1 . 2]" 1
1748 1 84 PHE H 1 85 ALA MB . . 4.690 4.555 4.253 4.687 . 0 0 "[ . 1 . 2]" 1
1749 1 84 PHE HA 1 84 PHE QD . . 3.810 3.103 2.538 3.317 . 0 0 "[ . 1 . 2]" 1
1750 1 84 PHE HA 1 85 ALA MB . . 5.380 5.057 5.000 5.088 . 0 0 "[ . 1 . 2]" 1
1751 1 84 PHE HA 1 87 GLU HB2 . . 4.080 2.410 2.062 2.901 . 0 0 "[ . 1 . 2]" 1
1752 1 84 PHE HA 1 87 GLU HB3 . . 4.130 3.796 3.356 4.186 0.056 10 0 "[ . 1 . 2]" 1
1753 1 84 PHE HA 1 87 GLU QG . . 4.050 3.238 2.375 4.099 0.049 10 0 "[ . 1 . 2]" 1
1754 1 84 PHE HA 1 88 ASN H . . 4.710 4.206 3.739 4.676 . 0 0 "[ . 1 . 2]" 1
1755 1 84 PHE HA 1 88 ASN HD21 . . 4.410 3.336 2.732 3.726 . 0 0 "[ . 1 . 2]" 1
1756 1 84 PHE HA 1 88 ASN HD22 . . 4.420 3.998 3.194 4.502 0.082 10 0 "[ . 1 . 2]" 1
1757 1 84 PHE HB2 1 85 ALA H . . 4.460 4.027 3.791 4.173 . 0 0 "[ . 1 . 2]" 1
1758 1 84 PHE HB2 1 85 ALA MB . . 5.500 5.452 5.281 5.590 0.090 14 0 "[ . 1 . 2]" 1
1759 1 84 PHE HB3 1 85 ALA H . . 3.430 2.775 2.490 2.969 . 0 0 "[ . 1 . 2]" 1
1760 1 84 PHE QD 1 85 ALA H . . 3.910 3.287 2.754 3.790 . 0 0 "[ . 1 . 2]" 1
1761 1 84 PHE QD 1 85 ALA HA . . 4.400 3.070 2.670 3.833 . 0 0 "[ . 1 . 2]" 1
1762 1 84 PHE QD 1 85 ALA MB . . 4.580 3.599 3.041 4.157 . 0 0 "[ . 1 . 2]" 1
1763 1 84 PHE QD 1 87 GLU H . . 5.500 5.495 5.223 5.590 0.090 4 0 "[ . 1 . 2]" 1
1764 1 84 PHE QD 1 88 ASN HD21 . . 4.670 3.453 2.850 4.340 . 0 0 "[ . 1 . 2]" 1
1765 1 84 PHE QD 1 90 LEU QD . . 3.530 2.940 2.236 3.607 0.077 12 0 "[ . 1 . 2]" 1
1766 1 84 PHE QE 1 88 ASN HD21 . . 5.170 3.786 3.095 4.587 . 0 0 "[ . 1 . 2]" 1
1767 1 84 PHE QE 1 90 LEU QD . . 3.660 2.575 2.149 3.401 . 0 0 "[ . 1 . 2]" 1
1768 1 84 PHE HZ 1 88 ASN HD21 . . 5.240 4.541 3.290 5.310 0.070 10 0 "[ . 1 . 2]" 1
1769 1 84 PHE HZ 1 90 LEU QD . . 4.220 4.006 3.556 4.260 0.040 12 0 "[ . 1 . 2]" 1
1770 1 85 ALA H 1 85 ALA MB . . 3.140 2.239 2.016 2.306 . 0 0 "[ . 1 . 2]" 1
1771 1 85 ALA H 1 86 THR H . . 3.370 2.794 2.554 3.097 . 0 0 "[ . 1 . 2]" 1
1772 1 85 ALA H 1 86 THR HB . . 5.500 5.073 4.515 5.312 . 0 0 "[ . 1 . 2]" 1
1773 1 85 ALA H 1 87 GLU H . . 4.900 4.089 3.770 4.376 . 0 0 "[ . 1 . 2]" 1
1774 1 85 ALA H 1 90 LEU QD . . 5.270 4.380 3.907 4.813 . 0 0 "[ . 1 . 2]" 1
1775 1 85 ALA H 1 92 ILE MD . . 5.500 4.542 4.192 4.960 . 0 0 "[ . 1 . 2]" 1
1776 1 85 ALA HA 1 87 GLU H . . 5.320 4.527 4.285 4.712 . 0 0 "[ . 1 . 2]" 1
1777 1 85 ALA HA 1 88 ASN H . . 4.540 3.735 3.411 3.925 . 0 0 "[ . 1 . 2]" 1
1778 1 85 ALA HA 1 88 ASN HB2 . . 5.450 3.671 3.174 4.222 . 0 0 "[ . 1 . 2]" 1
1779 1 85 ALA HA 1 88 ASN HB3 . . 5.500 5.270 4.852 5.590 0.090 10 0 "[ . 1 . 2]" 1
1780 1 85 ALA HA 1 90 LEU H . . 4.020 3.449 3.023 3.899 . 0 0 "[ . 1 . 2]" 1
1781 1 85 ALA HA 1 90 LEU HA . . 5.500 5.284 5.082 5.584 0.084 20 0 "[ . 1 . 2]" 1
1782 1 85 ALA HA 1 90 LEU HB2 . . 3.860 2.470 2.136 2.753 . 0 0 "[ . 1 . 2]" 1
1783 1 85 ALA HA 1 90 LEU HB3 . . 4.330 4.015 3.483 4.389 0.059 6 0 "[ . 1 . 2]" 1
1784 1 85 ALA HA 1 90 LEU QD . . 3.510 2.199 1.817 2.740 . 0 0 "[ . 1 . 2]" 1
1785 1 85 ALA HA 1 90 LEU HG . . 4.020 3.742 3.272 4.070 0.050 6 0 "[ . 1 . 2]" 1
1786 1 85 ALA MB 1 86 THR H . . 3.690 2.357 2.051 2.820 . 0 0 "[ . 1 . 2]" 1
1787 1 85 ALA MB 1 86 THR HA . . 4.840 3.810 3.663 4.067 . 0 0 "[ . 1 . 2]" 1
1788 1 85 ALA MB 1 86 THR HB . . 5.500 4.623 4.127 5.121 . 0 0 "[ . 1 . 2]" 1
1789 1 85 ALA MB 1 86 THR MG . . 5.090 4.691 4.394 5.017 . 0 0 "[ . 1 . 2]" 1
1790 1 85 ALA MB 1 87 GLU H . . 5.060 4.475 4.226 4.845 . 0 0 "[ . 1 . 2]" 1
1791 1 85 ALA MB 1 90 LEU H . . 4.360 3.866 3.553 4.218 . 0 0 "[ . 1 . 2]" 1
1792 1 85 ALA MB 1 90 LEU HB2 . . 3.990 2.666 2.302 2.970 . 0 0 "[ . 1 . 2]" 1
1793 1 85 ALA MB 1 90 LEU QD . . 4.180 3.262 2.949 3.643 . 0 0 "[ . 1 . 2]" 1
1794 1 85 ALA MB 1 92 ILE MD . . 3.330 2.335 2.050 2.655 . 0 0 "[ . 1 . 2]" 1
1795 1 86 THR H 1 86 THR HB . . 3.250 2.659 2.423 2.820 . 0 0 "[ . 1 . 2]" 1
1796 1 86 THR H 1 86 THR MG . . 3.710 3.679 3.571 3.758 0.048 12 0 "[ . 1 . 2]" 1
1797 1 86 THR H 1 87 GLU H . . 3.320 2.786 2.619 2.930 . 0 0 "[ . 1 . 2]" 1
1798 1 86 THR H 1 87 GLU HA . . 5.420 5.367 5.234 5.465 0.045 12 0 "[ . 1 . 2]" 1
1799 1 86 THR H 1 87 GLU HB2 . . 5.500 4.608 4.279 4.809 . 0 0 "[ . 1 . 2]" 1
1800 1 86 THR H 1 88 ASN H . . 4.790 4.451 4.141 4.743 . 0 0 "[ . 1 . 2]" 1
1801 1 86 THR H 1 89 GLN H . . 5.500 4.984 4.719 5.296 . 0 0 "[ . 1 . 2]" 1
1802 1 86 THR HA 1 86 THR MG . . 3.070 2.342 2.221 2.559 . 0 0 "[ . 1 . 2]" 1
1803 1 86 THR HA 1 88 ASN H . . 4.960 4.473 3.620 4.876 . 0 0 "[ . 1 . 2]" 1
1804 1 86 THR HA 1 89 GLN H . . 3.930 3.569 3.045 3.996 0.066 13 0 "[ . 1 . 2]" 1
1805 1 86 THR HA 1 90 LEU H . . 4.610 4.055 3.001 4.691 0.081 8 0 "[ . 1 . 2]" 1
1806 1 86 THR HA 1 92 ILE MD . . 5.450 4.091 3.256 4.657 . 0 0 "[ . 1 . 2]" 1
1807 1 86 THR HB 1 87 GLU H . . 3.280 2.719 2.332 3.145 . 0 0 "[ . 1 . 2]" 1
1808 1 86 THR MG 1 87 GLU H . . 4.120 3.831 3.399 4.208 0.088 6 0 "[ . 1 . 2]" 1
1809 1 86 THR MG 1 87 GLU QG . . 5.140 4.542 3.471 5.139 . 0 0 "[ . 1 . 2]" 1
1810 1 86 THR MG 1 89 GLN H . . 5.250 4.647 4.084 5.116 . 0 0 "[ . 1 . 2]" 1
1811 1 86 THR MG 1 89 GLN HA . . 5.500 4.325 3.666 4.916 . 0 0 "[ . 1 . 2]" 1
1812 1 87 GLU H 1 87 GLU HB2 . . 3.130 2.160 2.059 2.293 . 0 0 "[ . 1 . 2]" 1
1813 1 87 GLU H 1 87 GLU HB3 . . 3.400 3.448 3.351 3.484 0.084 6 0 "[ . 1 . 2]" 1
1814 1 87 GLU H 1 87 GLU QG . . 3.370 2.690 2.275 3.226 . 0 0 "[ . 1 . 2]" 1
1815 1 87 GLU H 1 88 ASN H . . 3.360 2.875 2.667 3.164 . 0 0 "[ . 1 . 2]" 1
1816 1 87 GLU H 1 88 ASN HD21 . . 5.500 4.425 4.035 5.186 . 0 0 "[ . 1 . 2]" 1
1817 1 87 GLU H 1 89 GLN H . . 4.530 3.957 3.794 4.121 . 0 0 "[ . 1 . 2]" 1
1818 1 87 GLU HA 1 87 GLU QG . . 3.300 2.575 2.238 2.815 . 0 0 "[ . 1 . 2]" 1
1819 1 87 GLU HA 1 88 ASN HA . . 5.500 4.622 4.462 4.767 . 0 0 "[ . 1 . 2]" 1
1820 1 87 GLU HA 1 89 GLN H . . 4.380 3.959 3.582 4.359 . 0 0 "[ . 1 . 2]" 1
1821 1 87 GLU HA 1 89 GLN HE21 . . 5.370 3.773 3.068 4.380 . 0 0 "[ . 1 . 2]" 1
1822 1 87 GLU HA 1 89 GLN HE22 . . 5.500 4.767 3.178 5.588 0.088 17 0 "[ . 1 . 2]" 1
1823 1 87 GLU HA 1 89 GLN QG . . 5.500 4.705 3.933 5.392 . 0 0 "[ . 1 . 2]" 1
1824 1 87 GLU HB2 1 87 GLU QG . . 2.630 2.175 2.131 2.304 . 0 0 "[ . 1 . 2]" 1
1825 1 87 GLU HB2 1 88 ASN H . . 4.030 2.829 2.493 3.181 . 0 0 "[ . 1 . 2]" 1
1826 1 87 GLU HB2 1 88 ASN HD21 . . 5.480 3.166 2.219 3.805 . 0 0 "[ . 1 . 2]" 1
1827 1 87 GLU HB2 1 89 GLN H . . 5.500 4.754 4.467 5.070 . 0 0 "[ . 1 . 2]" 1
1828 1 87 GLU HB3 1 88 ASN H . . 3.940 3.275 2.697 3.980 0.040 14 0 "[ . 1 . 2]" 1
1829 1 87 GLU HB3 1 88 ASN HD21 . . 4.850 3.515 2.493 4.419 . 0 0 "[ . 1 . 2]" 1
1830 1 87 GLU QG 1 88 ASN HD21 . . 5.020 4.740 3.940 5.097 0.077 19 0 "[ . 1 . 2]" 1
1831 1 88 ASN H 1 88 ASN HB2 . . 3.530 2.342 2.120 2.626 . 0 0 "[ . 1 . 2]" 1
1832 1 88 ASN H 1 88 ASN HB3 . . 3.730 3.587 3.427 3.778 0.048 14 0 "[ . 1 . 2]" 1
1833 1 88 ASN H 1 88 ASN HD21 . . 4.080 2.628 2.204 3.146 . 0 0 "[ . 1 . 2]" 1
1834 1 88 ASN H 1 89 GLN H . . 3.210 2.394 2.108 2.671 . 0 0 "[ . 1 . 2]" 1
1835 1 88 ASN H 1 89 GLN HA . . 4.530 4.471 4.161 4.607 0.077 15 0 "[ . 1 . 2]" 1
1836 1 88 ASN H 1 90 LEU H . . 4.490 3.574 3.262 4.263 . 0 0 "[ . 1 . 2]" 1
1837 1 88 ASN H 1 90 LEU QD . . 5.500 3.573 2.409 4.441 . 0 0 "[ . 1 . 2]" 1
1838 1 88 ASN H 1 90 LEU HG . . 5.110 4.486 3.650 5.224 0.114 10 0 "[ . 1 . 2]" 1
1839 1 88 ASN HA 1 88 ASN HD22 . . 5.500 4.251 3.805 4.575 . 0 0 "[ . 1 . 2]" 1
1840 1 88 ASN HA 1 89 GLN HE21 . . 5.500 4.091 2.322 5.440 . 0 0 "[ . 1 . 2]" 1
1841 1 88 ASN HA 1 89 GLN QG . . 4.550 3.841 3.227 4.627 0.077 14 0 "[ . 1 . 2]" 1
1842 1 88 ASN HA 1 90 LEU QD . . 5.460 4.177 3.430 4.813 . 0 0 "[ . 1 . 2]" 1
1843 1 88 ASN HB2 1 89 GLN H . . 4.580 3.693 3.314 3.958 . 0 0 "[ . 1 . 2]" 1
1844 1 88 ASN HB2 1 90 LEU H . . 5.140 3.536 3.035 4.092 . 0 0 "[ . 1 . 2]" 1
1845 1 88 ASN HB2 1 90 LEU QD . . 3.700 2.339 1.807 3.006 . 0 0 "[ . 1 . 2]" 1
1846 1 88 ASN HB2 1 90 LEU HG . . 4.180 2.865 2.098 4.071 . 0 0 "[ . 1 . 2]" 1
1847 1 88 ASN HB3 1 89 GLN H . . 4.960 4.292 4.080 4.425 . 0 0 "[ . 1 . 2]" 1
1848 1 88 ASN HB3 1 90 LEU H . . 5.120 4.282 3.828 4.812 . 0 0 "[ . 1 . 2]" 1
1849 1 88 ASN HB3 1 90 LEU QD . . 4.400 2.649 2.029 3.318 . 0 0 "[ . 1 . 2]" 1
1850 1 88 ASN HB3 1 90 LEU HG . . 4.160 3.235 2.331 4.245 0.085 1 0 "[ . 1 . 2]" 1
1851 1 88 ASN HD21 1 89 GLN H . . 5.500 4.892 4.516 5.172 . 0 0 "[ . 1 . 2]" 1
1852 1 88 ASN HD21 1 90 LEU QD . . 5.500 3.450 2.451 4.356 . 0 0 "[ . 1 . 2]" 1
1853 1 88 ASN HD22 1 90 LEU QD . . 5.500 4.471 3.698 5.322 . 0 0 "[ . 1 . 2]" 1
1854 1 89 GLN H 1 89 GLN HA . . 2.860 2.207 2.153 2.284 . 0 0 "[ . 1 . 2]" 1
1855 1 89 GLN H 1 89 GLN QG . . 3.260 2.922 2.627 3.293 0.033 6 0 "[ . 1 . 2]" 1
1856 1 89 GLN H 1 90 LEU H . . 3.460 2.650 2.319 2.953 . 0 0 "[ . 1 . 2]" 1
1857 1 89 GLN H 1 90 LEU HG . . 5.250 4.675 3.813 5.339 0.089 7 0 "[ . 1 . 2]" 1
1858 1 89 GLN HA 1 89 GLN HE21 . . 5.260 3.639 2.555 4.658 . 0 0 "[ . 1 . 2]" 1
1859 1 89 GLN HA 1 89 GLN QG . . 3.160 2.861 2.364 3.242 0.082 17 0 "[ . 1 . 2]" 1
1860 1 89 GLN HA 1 90 LEU H . . 3.430 2.879 2.310 3.135 . 0 0 "[ . 1 . 2]" 1
1861 1 89 GLN HA 1 90 LEU QD . . 5.500 4.598 3.751 5.177 . 0 0 "[ . 1 . 2]" 1
1862 1 89 GLN HB2 1 90 LEU H . . 4.200 4.234 4.084 4.286 0.086 5 0 "[ . 1 . 2]" 1
1863 1 90 LEU H 1 90 LEU HB2 . . 3.380 2.422 2.195 2.549 . 0 0 "[ . 1 . 2]" 1
1864 1 90 LEU H 1 90 LEU HB3 . . 3.780 3.531 3.302 3.667 . 0 0 "[ . 1 . 2]" 1
1865 1 90 LEU H 1 90 LEU QD . . 4.040 2.770 1.789 3.396 . 0 0 "[ . 1 . 2]" 1
1866 1 90 LEU H 1 90 LEU HG . . 3.290 2.835 2.375 3.404 0.114 10 0 "[ . 1 . 2]" 1
1867 1 90 LEU HA 1 90 LEU QD . . 3.140 2.129 2.007 2.266 . 0 0 "[ . 1 . 2]" 1
1868 1 90 LEU HA 1 91 ASN H . . 3.040 2.277 2.070 2.823 . 0 0 "[ . 1 . 2]" 1
1869 1 90 LEU HA 1 91 ASN HB2 . . 4.780 4.271 4.090 4.467 . 0 0 "[ . 1 . 2]" 1
1870 1 90 LEU HB2 1 91 ASN H . . 4.360 3.863 3.518 4.167 . 0 0 "[ . 1 . 2]" 1
1871 1 90 LEU HB3 1 91 ASN H . . 3.740 2.860 2.464 4.257 0.517 10 1 "[ . + . 2]" 1
1872 1 90 LEU HB3 1 91 ASN HA . . 5.500 4.936 4.761 5.842 0.342 10 0 "[ . 1 . 2]" 1
1873 1 90 LEU QD 1 91 ASN H . . 3.930 3.481 3.188 3.886 . 0 0 "[ . 1 . 2]" 1
1874 1 90 LEU QD 1 91 ASN HB2 . . 5.500 5.140 4.644 5.393 . 0 0 "[ . 1 . 2]" 1
1875 1 91 ASN H 1 91 ASN HB2 . . 3.270 2.376 2.217 2.781 . 0 0 "[ . 1 . 2]" 1
1876 1 91 ASN H 1 91 ASN HB3 . . 3.510 2.807 2.536 3.580 0.070 10 0 "[ . 1 . 2]" 1
1877 1 91 ASN H 1 91 ASN HD21 . . 4.930 4.736 4.545 5.005 0.075 10 0 "[ . 1 . 2]" 1
1878 1 91 ASN HA 1 92 ILE H . . 2.820 2.281 2.145 2.455 . 0 0 "[ . 1 . 2]" 1
1879 1 91 ASN HA 1 92 ILE HB . . 5.120 4.742 4.460 4.975 . 0 0 "[ . 1 . 2]" 1
1880 1 91 ASN HB2 1 92 ILE H . . 4.730 4.455 4.015 4.697 . 0 0 "[ . 1 . 2]" 1
1881 1 91 ASN HB2 1 93 LEU QD . . 5.230 3.912 3.425 4.787 . 0 0 "[ . 1 . 2]" 1
1882 1 91 ASN HB2 1 99 SER QB . . 5.470 4.931 4.643 5.280 . 0 0 "[ . 1 . 2]" 1
1883 1 91 ASN HB3 1 92 ILE H . . 4.200 4.004 3.030 4.277 0.077 20 0 "[ . 1 . 2]" 1
1884 1 91 ASN HB3 1 93 LEU H . . 5.500 4.851 4.497 5.334 . 0 0 "[ . 1 . 2]" 1
1885 1 91 ASN HB3 1 93 LEU QD . . 4.150 2.772 2.126 3.718 . 0 0 "[ . 1 . 2]" 1
1886 1 91 ASN HD21 1 93 LEU QD . . 4.010 2.957 2.600 3.582 . 0 0 "[ . 1 . 2]" 1
1887 1 91 ASN HD21 1 93 LEU HG . . 5.500 5.245 4.433 5.586 0.086 4 0 "[ . 1 . 2]" 1
1888 1 91 ASN HD21 1 99 SER HA . . 5.500 5.485 5.207 5.580 0.080 1 0 "[ . 1 . 2]" 1
1889 1 91 ASN HD21 1 99 SER QB . . 5.460 3.724 3.285 4.261 . 0 0 "[ . 1 . 2]" 1
1890 1 91 ASN HD22 1 93 LEU QD . . 3.800 3.006 2.576 3.508 . 0 0 "[ . 1 . 2]" 1
1891 1 91 ASN HD22 1 99 SER HA . . 5.500 4.489 4.055 4.874 . 0 0 "[ . 1 . 2]" 1
1892 1 91 ASN HD22 1 99 SER QB . . 4.240 2.442 2.196 2.777 . 0 0 "[ . 1 . 2]" 1
1893 1 92 ILE H 1 92 ILE HB . . 3.330 2.599 2.347 2.876 . 0 0 "[ . 1 . 2]" 1
1894 1 92 ILE H 1 92 ILE MD . . 4.280 3.862 3.463 4.240 . 0 0 "[ . 1 . 2]" 1
1895 1 92 ILE H 1 92 ILE HG12 . . 4.120 3.758 3.430 4.175 0.055 19 0 "[ . 1 . 2]" 1
1896 1 92 ILE H 1 92 ILE HG13 . . 4.040 2.592 2.329 3.053 . 0 0 "[ . 1 . 2]" 1
1897 1 92 ILE H 1 92 ILE MG . . 4.120 3.860 3.780 3.942 . 0 0 "[ . 1 . 2]" 1
1898 1 92 ILE H 1 93 LEU H . . 4.980 4.280 3.870 4.476 . 0 0 "[ . 1 . 2]" 1
1899 1 92 ILE H 1 93 LEU QD . . 5.500 3.916 2.876 4.438 . 0 0 "[ . 1 . 2]" 1
1900 1 92 ILE H 1 100 ILE H . . 4.750 4.304 3.742 4.826 0.076 18 0 "[ . 1 . 2]" 1
1901 1 92 ILE HA 1 92 ILE MD . . 3.830 3.898 3.839 3.930 0.100 19 0 "[ . 1 . 2]" 1
1902 1 92 ILE HA 1 92 ILE HG12 . . 4.010 2.609 2.522 2.821 . 0 0 "[ . 1 . 2]" 1
1903 1 92 ILE HA 1 92 ILE HG13 . . 4.170 3.116 2.963 3.238 . 0 0 "[ . 1 . 2]" 1
1904 1 92 ILE HA 1 92 ILE MG . . 3.260 2.394 2.107 2.639 . 0 0 "[ . 1 . 2]" 1
1905 1 92 ILE HA 1 93 LEU H . . 3.070 2.215 2.122 2.312 . 0 0 "[ . 1 . 2]" 1
1906 1 92 ILE HB 1 93 LEU H . . 5.120 4.365 4.066 4.536 . 0 0 "[ . 1 . 2]" 1
1907 1 92 ILE HB 1 99 SER HA . . 5.120 5.021 4.750 5.200 0.080 11 0 "[ . 1 . 2]" 1
1908 1 92 ILE HB 1 100 ILE H . . 4.630 3.641 3.330 4.106 . 0 0 "[ . 1 . 2]" 1
1909 1 92 ILE HB 1 100 ILE HG13 . . 4.240 3.372 2.886 3.778 . 0 0 "[ . 1 . 2]" 1
1910 1 92 ILE MD 1 102 ALA H . . 4.200 3.208 2.464 3.826 . 0 0 "[ . 1 . 2]" 1
1911 1 92 ILE MD 1 102 ALA HA . . 3.890 3.284 2.605 3.956 0.066 12 0 "[ . 1 . 2]" 1
1912 1 92 ILE MD 1 102 ALA MB . . 3.820 2.293 1.981 2.692 . 0 0 "[ . 1 . 2]" 1
1913 1 92 ILE MD 1 103 ALA H . . 5.500 5.126 4.558 5.593 0.093 7 0 "[ . 1 . 2]" 1
1914 1 92 ILE HG12 1 93 LEU H . . 5.060 4.722 4.518 4.916 . 0 0 "[ . 1 . 2]" 1
1915 1 92 ILE HG13 1 93 LEU H . . 5.360 5.215 5.032 5.349 . 0 0 "[ . 1 . 2]" 1
1916 1 92 ILE MG 1 93 LEU H . . 3.470 3.040 2.585 3.552 0.082 10 0 "[ . 1 . 2]" 1
1917 1 92 ILE MG 1 93 LEU HA . . 4.980 3.930 3.699 4.193 . 0 0 "[ . 1 . 2]" 1
1918 1 92 ILE MG 1 100 ILE H . . 4.590 3.764 3.502 4.097 . 0 0 "[ . 1 . 2]" 1
1919 1 92 ILE MG 1 100 ILE HG13 . . 3.650 2.476 2.203 2.900 . 0 0 "[ . 1 . 2]" 1
1920 1 92 ILE MG 1 102 ALA HA . . 4.990 3.427 2.798 4.193 . 0 0 "[ . 1 . 2]" 1
1921 1 93 LEU H 1 93 LEU HB2 . . 3.530 2.434 2.282 2.638 . 0 0 "[ . 1 . 2]" 1
1922 1 93 LEU H 1 93 LEU HB3 . . 3.550 3.568 3.448 3.636 0.086 18 0 "[ . 1 . 2]" 1
1923 1 93 LEU H 1 93 LEU QD . . 4.300 3.034 2.709 3.329 . 0 0 "[ . 1 . 2]" 1
1924 1 93 LEU H 1 94 ASP H . . 5.350 4.345 4.196 4.540 . 0 0 "[ . 1 . 2]" 1
1925 1 93 LEU H 1 99 SER QB . . 5.500 5.514 5.190 5.598 0.098 1 0 "[ . 1 . 2]" 1
1926 1 93 LEU H 1 100 ILE H . . 5.500 4.788 4.519 5.036 . 0 0 "[ . 1 . 2]" 1
1927 1 93 LEU HA 1 93 LEU QD . . 3.150 2.322 2.130 2.489 . 0 0 "[ . 1 . 2]" 1
1928 1 93 LEU HA 1 93 LEU HG . . 3.490 2.967 2.493 3.384 . 0 0 "[ . 1 . 2]" 1
1929 1 93 LEU HA 1 94 ASP H . . 2.940 2.314 2.132 2.430 . 0 0 "[ . 1 . 2]" 1
1930 1 93 LEU HA 1 94 ASP QB . . 5.020 4.135 3.865 4.472 . 0 0 "[ . 1 . 2]" 1
1931 1 93 LEU HA 1 97 GLY H . . 5.500 5.156 4.846 5.442 . 0 0 "[ . 1 . 2]" 1
1932 1 93 LEU HA 1 97 GLY HA2 . . 5.070 4.367 4.158 4.610 . 0 0 "[ . 1 . 2]" 1
1933 1 93 LEU HA 1 98 ASN H . . 4.960 4.504 4.110 4.878 . 0 0 "[ . 1 . 2]" 1
1934 1 93 LEU HA 1 99 SER H . . 4.880 4.366 4.145 4.587 . 0 0 "[ . 1 . 2]" 1
1935 1 93 LEU HA 1 99 SER HA . . 3.420 2.211 2.033 2.471 . 0 0 "[ . 1 . 2]" 1
1936 1 93 LEU HA 1 99 SER QB . . 4.530 3.914 3.704 4.185 . 0 0 "[ . 1 . 2]" 1
1937 1 93 LEU HA 1 100 ILE H . . 3.810 2.930 2.471 3.284 . 0 0 "[ . 1 . 2]" 1
1938 1 93 LEU HA 1 100 ILE MD . . 5.070 4.403 4.031 4.712 . 0 0 "[ . 1 . 2]" 1
1939 1 93 LEU HA 1 100 ILE HG12 . . 4.840 3.084 2.628 3.318 . 0 0 "[ . 1 . 2]" 1
1940 1 93 LEU HA 1 100 ILE HG13 . . 4.920 3.970 3.210 4.477 . 0 0 "[ . 1 . 2]" 1
1941 1 93 LEU HA 1 100 ILE MG . . 4.780 4.157 3.816 4.447 . 0 0 "[ . 1 . 2]" 1
1942 1 93 LEU HB2 1 93 LEU QD . . 3.040 2.205 2.100 2.372 . 0 0 "[ . 1 . 2]" 1
1943 1 93 LEU HB2 1 94 ASP H . . 3.920 3.500 2.906 3.989 0.069 14 0 "[ . 1 . 2]" 1
1944 1 93 LEU HB2 1 97 GLY H . . 5.100 4.891 4.324 5.177 0.077 15 0 "[ . 1 . 2]" 1
1945 1 93 LEU HB2 1 97 GLY HA2 . . 4.770 3.334 2.712 3.872 . 0 0 "[ . 1 . 2]" 1
1946 1 93 LEU HB2 1 97 GLY HA3 . . 5.500 4.935 4.293 5.559 0.059 8 0 "[ . 1 . 2]" 1
1947 1 93 LEU HB3 1 94 ASP H . . 3.430 2.303 2.023 2.730 . 0 0 "[ . 1 . 2]" 1
1948 1 93 LEU HB3 1 97 GLY H . . 4.520 3.502 3.338 3.722 . 0 0 "[ . 1 . 2]" 1
1949 1 93 LEU HB3 1 97 GLY HA2 . . 4.060 2.147 2.022 2.510 . 0 0 "[ . 1 . 2]" 1
1950 1 93 LEU HB3 1 97 GLY HA3 . . 4.170 3.786 3.502 4.237 0.067 8 0 "[ . 1 . 2]" 1
1951 1 93 LEU HB3 1 98 ASN H . . 4.590 3.717 3.321 4.182 . 0 0 "[ . 1 . 2]" 1
1952 1 93 LEU QD 1 94 ASP H . . 4.270 3.587 3.270 3.827 . 0 0 "[ . 1 . 2]" 1
1953 1 93 LEU QD 1 97 GLY H . . 4.710 4.136 3.979 4.322 . 0 0 "[ . 1 . 2]" 1
1954 1 93 LEU QD 1 97 GLY HA2 . . 3.680 2.219 2.045 2.545 . 0 0 "[ . 1 . 2]" 1
1955 1 93 LEU QD 1 97 GLY HA3 . . 4.200 2.816 2.550 3.297 . 0 0 "[ . 1 . 2]" 1
1956 1 93 LEU QD 1 98 ASN H . . 4.970 4.059 3.708 4.415 . 0 0 "[ . 1 . 2]" 1
1957 1 93 LEU QD 1 98 ASN HA . . 4.700 3.824 3.052 4.420 . 0 0 "[ . 1 . 2]" 1
1958 1 93 LEU QD 1 99 SER H . . 3.600 3.327 2.848 3.624 0.024 8 0 "[ . 1 . 2]" 1
1959 1 93 LEU QD 1 99 SER HA . . 3.110 2.148 2.019 2.326 . 0 0 "[ . 1 . 2]" 1
1960 1 93 LEU QD 1 99 SER QB . . 3.790 2.397 2.078 3.081 . 0 0 "[ . 1 . 2]" 1
1961 1 93 LEU QD 1 100 ILE H . . 4.480 3.716 3.445 3.918 . 0 0 "[ . 1 . 2]" 1
1962 1 93 LEU QD 1 100 ILE MG . . 5.490 4.919 4.624 5.179 . 0 0 "[ . 1 . 2]" 1
1963 1 93 LEU HG 1 94 ASP H . . 4.530 4.037 3.190 4.626 0.096 16 0 "[ . 1 . 2]" 1
1964 1 93 LEU HG 1 97 GLY HA3 . . 5.500 4.759 3.615 5.586 0.086 13 0 "[ . 1 . 2]" 1
1965 1 93 LEU HG 1 99 SER HA . . 5.500 3.812 2.952 4.596 . 0 0 "[ . 1 . 2]" 1
1966 1 93 LEU HG 1 99 SER QB . . 5.450 4.337 3.552 5.412 . 0 0 "[ . 1 . 2]" 1
1967 1 94 ASP H 1 94 ASP QB . . 3.670 2.597 2.257 2.962 . 0 0 "[ . 1 . 2]" 1
1968 1 94 ASP H 1 97 GLY H . . 4.460 3.193 3.015 3.542 . 0 0 "[ . 1 . 2]" 1
1969 1 94 ASP H 1 97 GLY HA2 . . 3.890 3.392 2.829 3.941 0.051 8 0 "[ . 1 . 2]" 1
1970 1 94 ASP H 1 98 ASN H . . 3.490 2.896 2.469 3.341 . 0 0 "[ . 1 . 2]" 1
1971 1 94 ASP H 1 98 ASN HB2 . . 4.840 3.864 3.474 4.363 . 0 0 "[ . 1 . 2]" 1
1972 1 94 ASP H 1 100 ILE MG . . 4.350 3.814 3.462 4.211 . 0 0 "[ . 1 . 2]" 1
1973 1 94 ASP HA 1 95 ALA H . . 3.360 2.614 2.494 2.714 . 0 0 "[ . 1 . 2]" 1
1974 1 94 ASP HA 1 95 ALA MB . . 4.550 4.329 4.185 4.406 . 0 0 "[ . 1 . 2]" 1
1975 1 94 ASP HA 1 96 GLU H . . 5.000 4.574 4.230 4.898 . 0 0 "[ . 1 . 2]" 1
1976 1 94 ASP HA 1 100 ILE MD . . 3.830 2.842 2.559 3.284 . 0 0 "[ . 1 . 2]" 1
1977 1 94 ASP QB 1 95 ALA H . . 3.040 2.258 1.978 2.698 . 0 0 "[ . 1 . 2]" 1
1978 1 94 ASP QB 1 95 ALA HA . . 4.810 4.612 4.484 4.665 . 0 0 "[ . 1 . 2]" 1
1979 1 94 ASP QB 1 95 ALA MB . . 4.240 3.798 3.596 4.130 . 0 0 "[ . 1 . 2]" 1
1980 1 94 ASP QB 1 96 GLU H . . 3.910 3.150 2.375 3.568 . 0 0 "[ . 1 . 2]" 1
1981 1 94 ASP QB 1 96 GLU HB2 . . 5.060 4.152 3.059 4.712 . 0 0 "[ . 1 . 2]" 1
1982 1 94 ASP QB 1 96 GLU QG . . 5.120 4.626 4.019 5.035 . 0 0 "[ . 1 . 2]" 1
1983 1 94 ASP QB 1 100 ILE MD . . 3.700 2.291 2.058 3.139 . 0 0 "[ . 1 . 2]" 1
1984 1 94 ASP QB 1 100 ILE HG12 . . 4.760 2.533 2.247 3.049 . 0 0 "[ . 1 . 2]" 1
1985 1 94 ASP QB 1 100 ILE HG13 . . 4.770 3.989 3.782 4.331 . 0 0 "[ . 1 . 2]" 1
1986 1 94 ASP QB 1 100 ILE MG . . 3.560 2.521 2.236 3.049 . 0 0 "[ . 1 . 2]" 1
1987 1 95 ALA H 1 95 ALA MB . . 2.910 2.305 2.210 2.471 . 0 0 "[ . 1 . 2]" 1
1988 1 95 ALA H 1 96 GLU H . . 3.460 2.839 2.678 3.041 . 0 0 "[ . 1 . 2]" 1
1989 1 95 ALA H 1 96 GLU HA . . 5.500 5.469 5.351 5.583 0.083 10 0 "[ . 1 . 2]" 1
1990 1 95 ALA H 1 96 GLU QG . . 5.360 4.669 4.192 5.411 0.051 20 0 "[ . 1 . 2]" 1
1991 1 95 ALA H 1 97 GLY H . . 4.320 4.109 3.922 4.370 0.050 8 0 "[ . 1 . 2]" 1
1992 1 95 ALA H 1 100 ILE MD . . 5.020 4.424 4.202 4.728 . 0 0 "[ . 1 . 2]" 1
1993 1 95 ALA HA 1 96 GLU QG . . 5.500 5.214 4.796 5.574 0.074 20 0 "[ . 1 . 2]" 1
1994 1 95 ALA HA 1 97 GLY H . . 4.340 4.148 3.511 4.417 0.077 4 0 "[ . 1 . 2]" 1
1995 1 95 ALA MB 1 96 GLU H . . 3.730 2.850 2.529 3.429 . 0 0 "[ . 1 . 2]" 1
1996 1 95 ALA MB 1 96 GLU HA . . 5.230 4.009 3.817 4.311 . 0 0 "[ . 1 . 2]" 1
1997 1 95 ALA MB 1 96 GLU QG . . 3.980 3.357 2.965 3.757 . 0 0 "[ . 1 . 2]" 1
1998 1 95 ALA MB 1 97 GLY H . . 5.410 4.487 4.211 4.845 . 0 0 "[ . 1 . 2]" 1
1999 1 96 GLU H 1 96 GLU HB2 . . 3.100 2.338 2.213 2.629 . 0 0 "[ . 1 . 2]" 1
2000 1 96 GLU H 1 96 GLU HB3 . . 3.770 3.571 3.490 3.728 . 0 0 "[ . 1 . 2]" 1
2001 1 96 GLU H 1 96 GLU QG . . 3.260 2.642 2.146 3.258 . 0 0 "[ . 1 . 2]" 1
2002 1 96 GLU H 1 97 GLY H . . 2.980 2.375 1.809 2.605 . 0 0 "[ . 1 . 2]" 1
2003 1 96 GLU H 1 97 GLY HA3 . . 5.170 5.115 4.619 5.230 0.060 12 0 "[ . 1 . 2]" 1
2004 1 96 GLU H 1 98 ASN H . . 3.780 3.537 3.222 3.820 0.040 11 0 "[ . 1 . 2]" 1
2005 1 96 GLU H 1 98 ASN HB2 . . 5.500 4.920 4.312 5.421 . 0 0 "[ . 1 . 2]" 1
2006 1 96 GLU H 1 98 ASN HD21 . . 5.330 4.220 3.596 5.060 . 0 0 "[ . 1 . 2]" 1
2007 1 96 GLU H 1 98 ASN HD22 . . 5.330 4.807 4.354 5.406 0.076 13 0 "[ . 1 . 2]" 1
2008 1 96 GLU HA 1 96 GLU QG . . 2.820 2.457 2.129 2.919 0.099 11 0 "[ . 1 . 2]" 1
2009 1 96 GLU HA 1 98 ASN H . . 4.840 4.801 4.408 4.923 0.083 2 0 "[ . 1 . 2]" 1
2010 1 96 GLU HA 1 98 ASN HD22 . . 5.500 5.302 4.948 5.569 0.069 20 0 "[ . 1 . 2]" 1
2011 1 96 GLU HB2 1 96 GLU QG . . 2.790 2.260 2.138 2.380 . 0 0 "[ . 1 . 2]" 1
2012 1 96 GLU HB2 1 97 GLY H . . 4.310 3.042 2.405 3.508 . 0 0 "[ . 1 . 2]" 1
2013 1 96 GLU HB2 1 98 ASN H . . 4.240 2.947 2.538 3.562 . 0 0 "[ . 1 . 2]" 1
2014 1 96 GLU HB2 1 98 ASN HD21 . . 3.980 2.681 2.149 3.198 . 0 0 "[ . 1 . 2]" 1
2015 1 96 GLU HB2 1 98 ASN HD22 . . 4.060 2.682 2.224 3.325 . 0 0 "[ . 1 . 2]" 1
2016 1 96 GLU HB3 1 97 GLY H . . 4.230 3.838 3.482 4.156 . 0 0 "[ . 1 . 2]" 1
2017 1 96 GLU HB3 1 97 GLY HA2 . . 5.500 5.471 5.100 5.587 0.087 16 0 "[ . 1 . 2]" 1
2018 1 96 GLU HB3 1 98 ASN H . . 4.460 3.875 3.378 4.234 . 0 0 "[ . 1 . 2]" 1
2019 1 96 GLU HB3 1 98 ASN HD21 . . 4.140 3.833 3.041 4.214 0.074 8 0 "[ . 1 . 2]" 1
2020 1 96 GLU HB3 1 98 ASN HD22 . . 4.100 3.044 2.431 3.464 . 0 0 "[ . 1 . 2]" 1
2021 1 96 GLU QG 1 97 GLY H . . 4.430 4.292 3.895 4.519 0.089 15 0 "[ . 1 . 2]" 1
2022 1 96 GLU QG 1 98 ASN HD21 . . 4.340 3.792 2.838 4.425 0.085 20 0 "[ . 1 . 2]" 1
2023 1 96 GLU QG 1 98 ASN HD22 . . 4.520 3.497 2.164 4.425 . 0 0 "[ . 1 . 2]" 1
2024 1 97 GLY H 1 98 ASN H . . 3.040 2.162 1.833 2.505 . 0 0 "[ . 1 . 2]" 1
2025 1 97 GLY H 1 98 ASN HB2 . . 5.260 4.495 4.028 4.961 . 0 0 "[ . 1 . 2]" 1
2026 1 97 GLY H 1 98 ASN HD21 . . 5.500 4.643 3.330 5.562 0.062 13 0 "[ . 1 . 2]" 1
2027 1 98 ASN H 1 98 ASN HB2 . . 3.300 2.585 2.451 2.722 . 0 0 "[ . 1 . 2]" 1
2028 1 98 ASN H 1 98 ASN HB3 . . 3.680 3.658 3.578 3.751 0.071 15 0 "[ . 1 . 2]" 1
2029 1 98 ASN H 1 98 ASN HD22 . . 4.590 4.027 3.502 4.641 0.051 7 0 "[ . 1 . 2]" 1
2030 1 98 ASN HA 1 99 SER H . . 2.820 2.297 2.120 2.363 . 0 0 "[ . 1 . 2]" 1
2031 1 98 ASN HB2 1 98 ASN HD21 . . 3.260 2.268 2.146 2.451 . 0 0 "[ . 1 . 2]" 1
2032 1 98 ASN HB2 1 98 ASN HD22 . . 3.860 3.537 3.458 3.626 . 0 0 "[ . 1 . 2]" 1
2033 1 98 ASN HB2 1 99 SER H . . 4.000 4.011 3.836 4.086 0.086 7 0 "[ . 1 . 2]" 1
2034 1 98 ASN HB2 1 100 ILE MG . . 5.340 3.015 2.482 3.932 . 0 0 "[ . 1 . 2]" 1
2035 1 98 ASN HB3 1 98 ASN HD21 . . 3.320 3.228 2.950 3.392 0.072 9 0 "[ . 1 . 2]" 1
2036 1 98 ASN HB3 1 99 SER H . . 3.500 3.184 2.934 3.329 . 0 0 "[ . 1 . 2]" 1
2037 1 98 ASN HB3 1 100 ILE MG . . 5.410 3.667 2.974 4.319 . 0 0 "[ . 1 . 2]" 1
2038 1 99 SER H 1 99 SER QB . . 2.780 2.743 2.566 2.869 0.089 16 0 "[ . 1 . 2]" 1
2039 1 99 SER H 1 100 ILE MG . . 5.500 4.487 4.158 4.909 . 0 0 "[ . 1 . 2]" 1
2040 1 99 SER HA 1 100 ILE H . . 2.920 2.195 2.104 2.299 . 0 0 "[ . 1 . 2]" 1
2041 1 99 SER HA 1 100 ILE HA . . 4.870 4.497 4.434 4.597 . 0 0 "[ . 1 . 2]" 1
2042 1 99 SER HA 1 100 ILE HG12 . . 5.330 3.821 3.570 4.056 . 0 0 "[ . 1 . 2]" 1
2043 1 99 SER HA 1 100 ILE HG13 . . 5.310 4.438 3.833 4.825 . 0 0 "[ . 1 . 2]" 1
2044 1 99 SER QB 1 100 ILE H . . 3.710 3.220 2.792 3.679 . 0 0 "[ . 1 . 2]" 1
2045 1 99 SER QB 1 100 ILE HA . . 4.770 4.426 4.141 4.840 0.070 18 0 "[ . 1 . 2]" 1
2046 1 99 SER QB 1 100 ILE HG12 . . 5.500 5.254 5.030 5.489 . 0 0 "[ . 1 . 2]" 1
2047 1 99 SER QB 1 100 ILE MG . . 5.380 4.743 4.610 5.005 . 0 0 "[ . 1 . 2]" 1
2048 1 100 ILE H 1 100 ILE HB . . 3.760 3.763 3.617 3.813 0.053 14 0 "[ . 1 . 2]" 1
2049 1 100 ILE H 1 100 ILE MD . . 4.280 3.950 3.682 4.094 . 0 0 "[ . 1 . 2]" 1
2050 1 100 ILE H 1 100 ILE HG12 . . 3.640 2.563 1.976 3.108 . 0 0 "[ . 1 . 2]" 1
2051 1 100 ILE H 1 100 ILE HG13 . . 3.820 2.551 2.327 2.825 . 0 0 "[ . 1 . 2]" 1
2052 1 100 ILE H 1 100 ILE MG . . 3.740 3.181 2.605 3.490 . 0 0 "[ . 1 . 2]" 1
2053 1 100 ILE H 1 101 ASP H . . 4.570 4.397 4.242 4.592 0.022 18 0 "[ . 1 . 2]" 1
2054 1 100 ILE HA 1 100 ILE MD . . 4.420 4.187 4.128 4.224 . 0 0 "[ . 1 . 2]" 1
2055 1 100 ILE HA 1 100 ILE HG13 . . 4.200 3.720 3.688 3.792 . 0 0 "[ . 1 . 2]" 1
2056 1 100 ILE HA 1 100 ILE MG . . 3.180 2.259 2.209 2.308 . 0 0 "[ . 1 . 2]" 1
2057 1 100 ILE HA 1 101 ASP H . . 2.830 2.517 2.283 2.817 . 0 0 "[ . 1 . 2]" 1
2058 1 100 ILE HA 1 101 ASP HB2 . . 4.510 4.499 4.263 4.585 0.075 8 0 "[ . 1 . 2]" 1
2059 1 100 ILE HA 1 104 GLN QB . . 5.190 4.783 4.260 5.274 0.084 3 0 "[ . 1 . 2]" 1
2060 1 100 ILE HA 1 104 GLN HE22 . . 5.500 5.179 3.729 5.577 0.077 9 0 "[ . 1 . 2]" 1
2061 1 100 ILE HB 1 100 ILE MD . . 3.410 2.289 2.217 2.340 . 0 0 "[ . 1 . 2]" 1
2062 1 100 ILE HB 1 101 ASP H . . 3.190 2.199 1.828 2.593 . 0 0 "[ . 1 . 2]" 1
2063 1 100 ILE HB 1 104 GLN QB . . 3.960 2.898 2.272 3.491 . 0 0 "[ . 1 . 2]" 1
2064 1 100 ILE HB 1 104 GLN HE21 . . 5.500 3.820 2.343 4.510 . 0 0 "[ . 1 . 2]" 1
2065 1 100 ILE HB 1 104 GLN QG . . 5.090 3.823 2.355 4.445 . 0 0 "[ . 1 . 2]" 1
2066 1 100 ILE MD 1 101 ASP H . . 4.970 3.803 3.207 4.409 . 0 0 "[ . 1 . 2]" 1
2067 1 100 ILE MD 1 104 GLN H . . 5.500 4.521 4.045 5.310 . 0 0 "[ . 1 . 2]" 1
2068 1 100 ILE MD 1 104 GLN QB . . 4.140 2.999 2.354 3.610 . 0 0 "[ . 1 . 2]" 1
2069 1 100 ILE MD 1 105 VAL H . . 5.120 4.577 3.829 4.916 . 0 0 "[ . 1 . 2]" 1
2070 1 100 ILE MD 1 105 VAL HA . . 4.800 4.466 4.028 4.885 0.085 3 0 "[ . 1 . 2]" 1
2071 1 100 ILE MD 1 105 VAL MG2 . . 3.420 2.051 1.881 2.281 . 0 0 "[ . 1 . 2]" 1
2072 1 100 ILE HG12 1 101 ASP H . . 5.320 4.762 4.263 5.106 . 0 0 "[ . 1 . 2]" 1
2073 1 100 ILE HG13 1 100 ILE MG . . 3.610 3.227 3.165 3.258 . 0 0 "[ . 1 . 2]" 1
2074 1 100 ILE HG13 1 101 ASP H . . 4.710 3.801 3.068 4.320 . 0 0 "[ . 1 . 2]" 1
2075 1 100 ILE HG13 1 104 GLN QB . . 5.470 4.695 4.066 5.548 0.078 3 0 "[ . 1 . 2]" 1
2076 1 100 ILE MG 1 101 ASP H . . 3.850 3.465 3.282 3.580 . 0 0 "[ . 1 . 2]" 1
2077 1 100 ILE MG 1 104 GLN QB . . 3.710 3.594 2.787 3.823 0.113 9 0 "[ . 1 . 2]" 1
2078 1 100 ILE MG 1 104 GLN HE21 . . 4.860 3.583 2.648 4.394 . 0 0 "[ . 1 . 2]" 1
2079 1 100 ILE MG 1 104 GLN HE22 . . 4.910 4.017 3.055 4.885 . 0 0 "[ . 1 . 2]" 1
2080 1 100 ILE MG 1 104 GLN QG . . 4.430 4.364 2.725 4.542 0.112 11 0 "[ . 1 . 2]" 1
2081 1 101 ASP H 1 101 ASP HB2 . . 3.080 2.346 2.177 2.546 . 0 0 "[ . 1 . 2]" 1
2082 1 101 ASP H 1 102 ALA H . . 4.610 4.427 4.290 4.559 . 0 0 "[ . 1 . 2]" 1
2083 1 101 ASP H 1 102 ALA HA . . 5.500 5.203 4.759 5.422 . 0 0 "[ . 1 . 2]" 1
2084 1 101 ASP H 1 103 ALA H . . 5.210 5.010 4.463 5.260 0.050 19 0 "[ . 1 . 2]" 1
2085 1 101 ASP H 1 104 GLN QB . . 3.910 3.200 2.492 3.916 0.006 3 0 "[ . 1 . 2]" 1
2086 1 101 ASP H 1 104 GLN HE21 . . 5.500 3.408 2.860 4.038 . 0 0 "[ . 1 . 2]" 1
2087 1 101 ASP H 1 104 GLN HE22 . . 5.500 4.884 3.602 5.505 0.005 8 0 "[ . 1 . 2]" 1
2088 1 101 ASP H 1 104 GLN QG . . 4.280 3.028 1.991 3.788 . 0 0 "[ . 1 . 2]" 1
2089 1 101 ASP H 1 105 VAL MG2 . . 5.500 4.602 3.938 5.186 . 0 0 "[ . 1 . 2]" 1
2090 1 101 ASP HA 1 102 ALA H . . 2.710 2.313 2.162 2.637 . 0 0 "[ . 1 . 2]" 1
2091 1 101 ASP HA 1 102 ALA HA . . 4.460 4.358 4.162 4.542 0.082 3 0 "[ . 1 . 2]" 1
2092 1 101 ASP HA 1 102 ALA MB . . 4.220 4.055 3.890 4.318 0.098 3 0 "[ . 1 . 2]" 1
2093 1 101 ASP HA 1 103 ALA H . . 4.370 4.145 3.786 4.439 0.069 16 0 "[ . 1 . 2]" 1
2094 1 101 ASP HB2 1 102 ALA H . . 3.720 3.803 3.768 3.813 0.093 18 0 "[ . 1 . 2]" 1
2095 1 101 ASP HB2 1 103 ALA H . . 3.890 3.706 3.311 3.956 0.066 20 0 "[ . 1 . 2]" 1
2096 1 101 ASP HB2 1 103 ALA MB . . 4.730 3.561 2.802 4.427 . 0 0 "[ . 1 . 2]" 1
2097 1 101 ASP HB2 1 104 GLN H . . 4.140 3.529 2.871 4.147 0.007 20 0 "[ . 1 . 2]" 1
2098 1 101 ASP HB2 1 104 GLN QB . . 4.450 3.871 3.286 4.535 0.085 3 0 "[ . 1 . 2]" 1
2099 1 101 ASP HB2 1 104 GLN QG . . 3.290 2.638 2.120 3.366 0.076 5 0 "[ . 1 . 2]" 1
2100 1 101 ASP HB3 1 102 ALA H . . 3.840 2.520 2.415 2.673 . 0 0 "[ . 1 . 2]" 1
2101 1 101 ASP HB3 1 103 ALA H . . 3.740 2.284 1.844 2.694 . 0 0 "[ . 1 . 2]" 1
2102 1 101 ASP HB3 1 103 ALA HA . . 5.500 4.888 4.350 5.534 0.034 16 0 "[ . 1 . 2]" 1
2103 1 101 ASP HB3 1 103 ALA MB . . 4.430 2.877 2.236 3.805 . 0 0 "[ . 1 . 2]" 1
2104 1 101 ASP HB3 1 104 GLN H . . 4.030 3.277 2.700 3.698 . 0 0 "[ . 1 . 2]" 1
2105 1 101 ASP HB3 1 104 GLN QB . . 4.470 4.464 3.944 4.571 0.101 16 0 "[ . 1 . 2]" 1
2106 1 101 ASP HB3 1 104 GLN QG . . 4.230 3.559 3.055 4.118 . 0 0 "[ . 1 . 2]" 1
2107 1 102 ALA H 1 102 ALA MB . . 2.880 2.289 2.078 2.431 . 0 0 "[ . 1 . 2]" 1
2108 1 102 ALA H 1 103 ALA H . . 3.340 2.486 1.987 2.931 . 0 0 "[ . 1 . 2]" 1
2109 1 102 ALA H 1 104 GLN H . . 4.910 4.192 3.991 4.482 . 0 0 "[ . 1 . 2]" 1
2110 1 102 ALA H 1 105 VAL H . . 5.500 5.510 5.135 5.585 0.085 6 0 "[ . 1 . 2]" 1
2111 1 102 ALA H 1 105 VAL MG2 . . 5.050 4.679 4.219 4.984 . 0 0 "[ . 1 . 2]" 1
2112 1 102 ALA HA 1 103 ALA HA . . 5.070 4.881 4.737 4.973 . 0 0 "[ . 1 . 2]" 1
2113 1 102 ALA HA 1 103 ALA MB . . 5.450 4.978 4.898 5.120 . 0 0 "[ . 1 . 2]" 1
2114 1 102 ALA HA 1 104 GLN H . . 4.210 3.873 3.476 4.268 0.058 18 0 "[ . 1 . 2]" 1
2115 1 102 ALA HA 1 104 GLN QB . . 5.030 4.717 4.321 5.077 0.047 3 0 "[ . 1 . 2]" 1
2116 1 102 ALA HA 1 105 VAL H . . 3.930 3.674 3.230 3.886 . 0 0 "[ . 1 . 2]" 1
2117 1 102 ALA HA 1 105 VAL HB . . 4.070 3.146 2.771 3.481 . 0 0 "[ . 1 . 2]" 1
2118 1 102 ALA HA 1 105 VAL MG1 . . 4.380 4.327 3.983 4.485 0.105 12 0 "[ . 1 . 2]" 1
2119 1 102 ALA HA 1 105 VAL MG2 . . 3.380 2.568 2.162 2.746 . 0 0 "[ . 1 . 2]" 1
2120 1 102 ALA MB 1 103 ALA H . . 3.350 2.847 2.544 3.137 . 0 0 "[ . 1 . 2]" 1
2121 1 102 ALA MB 1 103 ALA HA . . 4.480 3.968 3.689 4.124 . 0 0 "[ . 1 . 2]" 1
2122 1 102 ALA MB 1 104 GLN H . . 4.820 4.488 4.351 4.819 . 0 0 "[ . 1 . 2]" 1
2123 1 102 ALA MB 1 105 VAL H . . 4.700 4.410 4.213 4.573 . 0 0 "[ . 1 . 2]" 1
2124 1 102 ALA MB 1 105 VAL MG2 . . 3.800 3.853 3.596 3.925 0.125 12 0 "[ . 1 . 2]" 1
2125 1 103 ALA H 1 103 ALA MB . . 2.800 2.219 2.133 2.383 . 0 0 "[ . 1 . 2]" 1
2126 1 103 ALA H 1 104 GLN H . . 3.180 2.715 2.579 2.801 . 0 0 "[ . 1 . 2]" 1
2127 1 103 ALA H 1 104 GLN HA . . 5.380 5.349 5.265 5.430 0.050 12 0 "[ . 1 . 2]" 1
2128 1 103 ALA H 1 104 GLN QB . . 4.700 4.702 4.492 4.785 0.085 3 0 "[ . 1 . 2]" 1
2129 1 103 ALA H 1 104 GLN QG . . 4.900 4.260 3.826 4.693 . 0 0 "[ . 1 . 2]" 1
2130 1 103 ALA H 1 105 VAL H . . 4.630 4.179 3.930 4.272 . 0 0 "[ . 1 . 2]" 1
2131 1 103 ALA H 1 105 VAL MG2 . . 5.230 4.672 4.215 4.938 . 0 0 "[ . 1 . 2]" 1
2132 1 103 ALA H 1 106 THR H . . 5.330 5.030 4.786 5.403 0.073 9 0 "[ . 1 . 2]" 1
2133 1 103 ALA HA 1 105 VAL H . . 3.670 3.561 3.127 3.748 0.078 9 0 "[ . 1 . 2]" 1
2134 1 103 ALA MB 1 104 GLN H . . 3.540 2.759 2.369 3.223 . 0 0 "[ . 1 . 2]" 1
2135 1 103 ALA MB 1 104 GLN HA . . 4.700 3.951 3.732 4.287 . 0 0 "[ . 1 . 2]" 1
2136 1 103 ALA MB 1 104 GLN QB . . 4.900 4.317 4.028 4.694 . 0 0 "[ . 1 . 2]" 1
2137 1 103 ALA MB 1 104 GLN HE21 . . 5.500 5.502 4.837 5.605 0.105 16 0 "[ . 1 . 2]" 1
2138 1 103 ALA MB 1 104 GLN QG . . 4.430 3.116 2.506 3.657 . 0 0 "[ . 1 . 2]" 1
2139 1 104 GLN H 1 104 GLN QB . . 2.890 2.384 2.222 2.583 . 0 0 "[ . 1 . 2]" 1
2140 1 104 GLN H 1 104 GLN QG . . 3.190 2.496 2.047 2.751 . 0 0 "[ . 1 . 2]" 1
2141 1 104 GLN H 1 105 VAL H . . 2.910 2.667 2.307 2.909 . 0 0 "[ . 1 . 2]" 1
2142 1 104 GLN H 1 105 VAL MG2 . . 4.020 3.414 2.852 4.026 0.006 18 0 "[ . 1 . 2]" 1
2143 1 104 GLN HA 1 104 GLN QG . . 3.050 2.406 2.172 3.100 0.050 6 0 "[ . 1 . 2]" 1
2144 1 104 GLN HA 1 105 VAL H . . 3.520 3.285 3.118 3.494 . 0 0 "[ . 1 . 2]" 1
2145 1 104 GLN HA 1 105 VAL MG2 . . 5.500 4.412 4.198 4.770 . 0 0 "[ . 1 . 2]" 1
2146 1 104 GLN HA 1 108 ILE MD . . 5.500 4.147 2.272 5.194 . 0 0 "[ . 1 . 2]" 1
2147 1 104 GLN QB 1 104 GLN HE21 . . 4.180 3.146 2.437 3.736 . 0 0 "[ . 1 . 2]" 1
2148 1 104 GLN QB 1 104 GLN QG . . 2.440 2.074 2.011 2.123 . 0 0 "[ . 1 . 2]" 1
2149 1 104 GLN QB 1 105 VAL H . . 3.560 3.504 3.060 3.653 0.093 3 0 "[ . 1 . 2]" 1
2150 1 104 GLN QB 1 105 VAL HA . . 4.400 4.357 4.061 4.483 0.083 16 0 "[ . 1 . 2]" 1
2151 1 104 GLN QB 1 105 VAL MG2 . . 3.860 3.005 2.656 3.225 . 0 0 "[ . 1 . 2]" 1
2152 1 104 GLN QG 1 105 VAL MG2 . . 5.060 4.515 4.057 4.833 . 0 0 "[ . 1 . 2]" 1
2153 1 105 VAL H 1 105 VAL HB . . 3.260 2.678 2.447 2.943 . 0 0 "[ . 1 . 2]" 1
2154 1 105 VAL H 1 105 VAL MG2 . . 2.920 2.562 2.259 2.767 . 0 0 "[ . 1 . 2]" 1
2155 1 105 VAL H 1 106 THR MG . . 5.500 4.204 3.442 4.865 . 0 0 "[ . 1 . 2]" 1
2156 1 105 VAL H 1 108 ILE MD . . 4.660 4.532 3.288 4.761 0.101 14 0 "[ . 1 . 2]" 1
2157 1 105 VAL HA 1 105 VAL MG1 . . 3.180 2.341 2.083 2.480 . 0 0 "[ . 1 . 2]" 1
2158 1 105 VAL HA 1 105 VAL MG2 . . 3.300 2.537 2.395 2.634 . 0 0 "[ . 1 . 2]" 1
2159 1 105 VAL HA 1 106 THR H . . 3.560 3.609 3.462 3.640 0.080 7 0 "[ . 1 . 2]" 1
2160 1 105 VAL HA 1 108 ILE H . . 4.760 4.405 3.789 4.838 0.078 5 0 "[ . 1 . 2]" 1
2161 1 105 VAL HA 1 108 ILE MD . . 3.690 2.797 2.222 3.759 0.069 2 0 "[ . 1 . 2]" 1
2162 1 105 VAL HA 1 108 ILE HG12 . . 4.140 3.621 2.163 5.013 0.873 1 3 "[+ . * - . 2]" 1
2163 1 105 VAL HA 1 108 ILE HG13 . . 4.960 3.276 2.286 4.208 . 0 0 "[ . 1 . 2]" 1
2164 1 105 VAL HB 1 106 THR H . . 3.130 2.648 2.227 3.199 0.069 6 0 "[ . 1 . 2]" 1
2165 1 105 VAL HB 1 106 THR MG . . 5.020 3.045 2.632 3.476 . 0 0 "[ . 1 . 2]" 1
2166 1 105 VAL MG1 1 106 THR H . . 4.000 3.676 3.394 4.066 0.066 6 0 "[ . 1 . 2]" 1
2167 1 105 VAL MG1 1 106 THR HA . . 4.880 3.658 3.392 4.013 . 0 0 "[ . 1 . 2]" 1
2168 1 105 VAL MG1 1 106 THR HB . . 5.500 5.470 5.087 5.607 0.107 12 0 "[ . 1 . 2]" 1
2169 1 105 VAL MG1 1 106 THR MG . . 3.850 3.333 2.588 3.630 . 0 0 "[ . 1 . 2]" 1
2170 1 105 VAL MG1 1 107 GLU H . . 5.500 4.732 4.227 5.082 . 0 0 "[ . 1 . 2]" 1
2171 1 106 THR H 1 106 THR HB . . 3.750 3.573 3.464 3.692 . 0 0 "[ . 1 . 2]" 1
2172 1 106 THR H 1 106 THR MG . . 3.260 2.675 2.382 3.182 . 0 0 "[ . 1 . 2]" 1
2173 1 106 THR H 1 107 GLU H . . 3.140 2.826 2.558 3.238 0.098 8 0 "[ . 1 . 2]" 1
2174 1 106 THR H 1 107 GLU QG . . 5.500 4.050 3.456 5.227 . 0 0 "[ . 1 . 2]" 1
2175 1 106 THR H 1 108 ILE H . . 4.650 4.547 3.879 4.733 0.083 15 0 "[ . 1 . 2]" 1
2176 1 106 THR HA 1 106 THR MG . . 3.330 2.245 2.132 2.391 . 0 0 "[ . 1 . 2]" 1
2177 1 106 THR HA 1 107 GLU H . . 3.280 3.166 2.304 3.359 0.079 16 0 "[ . 1 . 2]" 1
2178 1 106 THR HA 1 108 ILE H . . 5.250 3.835 2.870 4.613 . 0 0 "[ . 1 . 2]" 1
2179 1 106 THR MG 1 107 GLU H . . 4.470 4.386 4.039 4.537 0.067 15 0 "[ . 1 . 2]" 1
2180 1 106 THR MG 1 108 ILE H . . 5.500 5.364 4.595 5.618 0.118 6 0 "[ . 1 . 2]" 1
2181 1 107 GLU H 1 107 GLU HB2 . . 3.120 2.896 2.281 3.761 0.641 17 4 "[ * . -1 * . + 2]" 1
2182 1 107 GLU H 1 107 GLU HB3 . . 3.690 3.477 2.631 3.795 0.105 8 0 "[ . 1 . 2]" 1
2183 1 107 GLU H 1 107 GLU QG . . 3.670 2.647 1.864 3.408 . 0 0 "[ . 1 . 2]" 1
2184 1 107 GLU H 1 108 ILE H . . 3.180 2.405 1.991 2.744 . 0 0 "[ . 1 . 2]" 1
2185 1 107 GLU H 1 108 ILE HA . . 5.500 4.664 4.352 5.181 . 0 0 "[ . 1 . 2]" 1
2186 1 107 GLU H 1 108 ILE HG12 . . 5.500 4.012 2.956 5.268 . 0 0 "[ . 1 . 2]" 1
2187 1 107 GLU H 1 108 ILE MG . . 5.500 5.459 5.153 5.596 0.096 13 0 "[ . 1 . 2]" 1
2188 1 107 GLU HA 1 107 GLU QG . . 3.730 2.659 2.225 3.400 . 0 0 "[ . 1 . 2]" 1
2189 1 107 GLU HA 1 108 ILE H . . 3.120 3.054 2.365 3.205 0.085 12 0 "[ . 1 . 2]" 1
2190 1 107 GLU HB2 1 108 ILE H . . 4.640 4.081 3.592 4.512 . 0 0 "[ . 1 . 2]" 1
2191 1 107 GLU HB3 1 107 GLU QG . . 2.790 2.409 2.271 2.530 . 0 0 "[ . 1 . 2]" 1
2192 1 107 GLU HB3 1 108 ILE H . . 4.630 4.403 4.211 4.535 . 0 0 "[ . 1 . 2]" 1
2193 1 108 ILE H 1 108 ILE HB . . 3.240 2.616 2.305 3.192 . 0 0 "[ . 1 . 2]" 1
2194 1 108 ILE H 1 108 ILE HG12 . . 3.610 2.868 2.004 3.837 0.227 10 0 "[ . 1 . 2]" 1
2195 1 108 ILE H 1 108 ILE HG13 . . 3.870 2.900 1.832 3.837 . 0 0 "[ . 1 . 2]" 1
2196 1 108 ILE H 1 108 ILE MG . . 4.080 3.773 3.484 3.892 . 0 0 "[ . 1 . 2]" 1
2197 1 108 ILE HA 1 108 ILE MD . . 4.290 3.126 2.086 4.111 . 0 0 "[ . 1 . 2]" 1
2198 1 108 ILE HA 1 108 ILE HG12 . . 4.000 2.964 2.500 3.660 . 0 0 "[ . 1 . 2]" 1
2199 1 108 ILE HA 1 108 ILE HG13 . . 3.570 3.410 2.824 3.663 0.093 5 0 "[ . 1 . 2]" 1
2200 1 108 ILE HA 1 108 ILE MG . . 3.360 2.384 2.140 2.576 . 0 0 "[ . 1 . 2]" 1
2201 1 108 ILE HG12 1 108 ILE MG . . 3.750 2.748 2.114 3.221 . 0 0 "[ . 1 . 2]" 1
2202 1 108 ILE HG13 1 108 ILE MG . . 3.030 2.760 2.204 3.248 0.218 1 0 "[ . 1 . 2]" 1
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