NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
602443 |
2n23   |
25584 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2n23
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 2208
_Distance_constraint_stats_list.Viol_count 6375
_Distance_constraint_stats_list.Viol_total 15357.684
_Distance_constraint_stats_list.Viol_max 1.889
_Distance_constraint_stats_list.Viol_rms 0.0668
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0174
_Distance_constraint_stats_list.Viol_average_violations_only 0.1205
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 0.966 0.313 17 0 "[ . 1 . 2]"
1 3 HIS 3.804 0.206 2 0 "[ . 1 . 2]"
1 4 SER 16.217 0.261 7 0 "[ . 1 . 2]"
1 5 GLY 13.405 0.359 4 0 "[ . 1 . 2]"
1 6 ALA 10.176 0.873 1 1 "[+ . 1 . 2]"
1 7 ALA 11.168 0.243 10 0 "[ . 1 . 2]"
1 8 ILE 25.716 0.480 13 0 "[ . 1 . 2]"
1 9 PHE 1.634 0.108 16 0 "[ . 1 . 2]"
1 10 GLU 11.359 0.534 16 1 "[ . 1 .+ 2]"
1 11 LYS 16.313 0.834 12 10 "[****. * 1 +* ** *2]"
1 12 VAL 9.990 0.534 16 1 "[ . 1 .+ 2]"
1 13 SER 9.302 0.291 15 0 "[ . 1 . 2]"
1 14 GLY 3.461 0.176 2 0 "[ . 1 . 2]"
1 15 ILE 23.778 0.359 4 0 "[ . 1 . 2]"
1 16 ILE 19.305 1.587 20 1 "[ . 1 . +]"
1 17 ALA 9.796 0.278 15 0 "[ . 1 . 2]"
1 18 ILE 22.227 0.371 20 0 "[ . 1 . 2]"
1 19 ASN 5.213 0.139 10 0 "[ . 1 . 2]"
1 20 GLU 21.450 0.718 15 5 "[ . 1 * +* -*]"
1 21 ASP 19.803 0.454 20 0 "[ . 1 . 2]"
1 22 VAL 39.541 0.910 20 9 "[- *. ** * * ** +]"
1 23 SER 8.144 0.353 2 0 "[ . 1 . 2]"
1 24 PRO 7.773 0.399 2 0 "[ . 1 . 2]"
1 25 ALA 11.928 0.718 15 7 "[ . -* * +* **]"
1 26 GLU 18.531 0.910 20 9 "[- *. ** * * ** +]"
1 27 LEU 11.478 1.587 20 1 "[ . 1 . +]"
1 28 THR 10.089 1.458 20 1 "[ . 1 . +]"
1 29 TRP 18.239 0.341 14 0 "[ . 1 . 2]"
1 30 ARG 3.411 0.271 2 0 "[ . 1 . 2]"
1 31 SER 5.892 0.346 12 0 "[ . 1 . 2]"
1 32 THR 5.623 0.283 4 0 "[ . 1 . 2]"
1 33 ASP 1.984 0.199 3 0 "[ . 1 . 2]"
1 34 GLY 1.894 0.568 18 2 "[ -. 1 . + 2]"
1 35 ASP 6.122 0.568 18 2 "[ -. 1 . + 2]"
1 36 LYS 8.418 0.706 12 4 "[ .*- 1 + . *]"
1 37 VAL 8.694 0.462 13 0 "[ . 1 . 2]"
1 38 HIS 7.038 0.258 2 0 "[ . 1 . 2]"
1 39 THR 3.989 0.156 16 0 "[ . 1 . 2]"
1 40 VAL 6.334 0.181 11 0 "[ . 1 . 2]"
1 41 VAL 8.022 0.306 19 0 "[ . 1 . 2]"
1 42 LEU 9.144 0.476 7 0 "[ . 1 . 2]"
1 43 SER 0.892 0.074 6 0 "[ . 1 . 2]"
1 44 THR 1.339 0.094 7 0 "[ . 1 . 2]"
1 45 ILE 12.274 0.219 19 0 "[ . 1 . 2]"
1 46 ASP 2.162 0.105 17 0 "[ . 1 . 2]"
1 47 LYS 30.722 0.951 16 13 "[ *- ** *** ***+ **]"
1 48 LEU 8.828 0.524 3 1 "[ + . 1 . 2]"
1 49 GLN 5.780 0.409 17 0 "[ . 1 . 2]"
1 50 ALA 11.089 0.353 17 0 "[ . 1 . 2]"
1 51 THR 4.159 0.921 19 3 "[ - . 1 . +*]"
1 52 PRO 3.035 0.203 3 0 "[ . 1 . 2]"
1 53 ALA 1.461 0.106 3 0 "[ . 1 . 2]"
1 54 SER 1.464 0.106 3 0 "[ . 1 . 2]"
1 55 SER 5.531 0.921 19 3 "[ - . 1 . +*]"
1 56 GLU 4.968 0.192 7 0 "[ . 1 . 2]"
1 57 LYS 11.950 0.854 13 5 "[ . -* 1 + * *]"
1 58 MET 7.618 0.498 2 0 "[ . 1 . 2]"
1 59 MET 14.455 0.871 13 9 "[** . * -**+ .* *2]"
1 60 LEU 9.425 0.193 6 0 "[ . 1 . 2]"
1 61 ARG 11.332 0.970 5 4 "[ + 1 -* *]"
1 62 LEU 13.491 0.432 17 0 "[ . 1 . 2]"
1 63 ILE 11.960 0.303 14 0 "[ . 1 . 2]"
1 64 GLY 3.781 0.192 7 0 "[ . 1 . 2]"
1 65 LYS 35.080 0.744 13 17 "[*-**.****1* +*******]"
1 66 VAL 9.558 0.744 13 4 "[ - .* 1 + . * 2]"
1 67 ASP 2.239 0.198 20 0 "[ . 1 . 2]"
1 68 GLU 16.702 0.902 5 8 "[ * + *1* *-* * 2]"
1 69 SER 3.043 0.342 17 0 "[ . 1 . 2]"
1 70 LYS 17.324 0.746 19 6 "[ .* 1* **.* +2]"
1 71 LYS 10.670 0.837 20 2 "[ . 1 . - +]"
1 72 ARG 6.248 0.960 17 2 "[ . 1 *. + 2]"
1 73 LYS 9.282 0.952 14 4 "[ .* 1 +. -* 2]"
1 74 ASP 7.076 1.889 17 1 "[ . 1 . + 2]"
1 75 ASN 3.653 0.527 8 5 "[ .-*+ * . * 2]"
1 76 GLU 1.291 0.239 1 0 "[ . 1 . 2]"
1 77 GLY 1.449 0.262 3 0 "[ . 1 . 2]"
1 78 ASN 9.187 0.807 5 3 "[ + * 1 - 2]"
1 79 GLU 17.697 0.986 17 7 "[ *** 1 *- +* 2]"
1 80 VAL 7.212 1.889 17 1 "[ . 1 . + 2]"
1 81 VAL 5.392 0.581 14 1 "[ . 1 +. 2]"
1 82 PRO 11.515 0.581 14 1 "[ . 1 +. 2]"
1 83 LYS 21.230 0.604 17 5 "[ . - * . +* *]"
1 84 PRO 14.063 0.376 15 0 "[ . 1 . 2]"
1 85 GLN 11.913 0.621 17 3 "[- . * 1 . + 2]"
1 86 ARG 9.567 0.621 17 3 "[- . * 1 . + 2]"
1 87 HIS 7.550 0.374 19 0 "[ . 1 . 2]"
1 88 MET 17.874 1.446 11 10 "[* * 1+**-* ** *]"
1 89 PHE 3.892 0.336 20 0 "[ . 1 . 2]"
1 90 SER 15.939 0.871 13 9 "[** . * -**+ .* *2]"
1 91 PHE 17.535 0.301 1 0 "[ . 1 . 2]"
1 92 ASN 6.010 0.873 1 1 "[+ . 1 . 2]"
1 93 ASN 5.107 0.229 3 0 "[ . 1 . 2]"
1 94 ARG 9.820 0.483 10 0 "[ . 1 . 2]"
1 95 THR 6.806 0.172 19 0 "[ . 1 . 2]"
1 96 VAL 17.388 0.301 1 0 "[ . 1 . 2]"
1 97 MET 11.295 0.376 5 0 "[ . 1 . 2]"
1 98 ASP 8.961 0.376 5 0 "[ . 1 . 2]"
1 99 ASN 3.600 0.166 7 0 "[ . 1 . 2]"
1 100 ILE 11.496 0.291 18 0 "[ . 1 . 2]"
1 101 LYS 19.766 0.797 3 7 "[ + . * -* * .* *]"
1 102 MET 11.123 0.407 11 0 "[ . 1 . 2]"
1 103 THR 6.967 0.153 10 0 "[ . 1 . 2]"
1 104 LEU 6.263 0.284 14 0 "[ . 1 . 2]"
1 105 GLN 18.367 0.503 15 1 "[ . 1 + 2]"
1 106 GLN 13.531 0.621 18 9 "[* *** * - ** + 2]"
1 107 ILE 6.769 0.531 10 2 "[ . -+ . 2]"
1 108 ILE 7.582 0.717 2 4 "[ + . * 1 * - 2]"
1 109 SER 2.619 0.374 10 0 "[ . 1 . 2]"
1 110 ARG 10.361 0.776 15 5 "[ . * * + * -]"
1 111 TYR 12.643 0.717 2 4 "[ + . * 1 - * 2]"
1 112 LYS 3.918 0.696 10 1 "[ . + . 2]"
1 113 ASP 3.775 0.470 10 0 "[ . 1 . 2]"
1 114 ALA 3.558 0.195 20 0 "[ . 1 . 2]"
1 115 ASP 6.164 0.231 10 0 "[ . 1 . 2]"
2 1 ASP 0.039 0.028 15 0 "[ . 1 . 2]"
2 2 THR 3.159 0.307 17 0 "[ . 1 . 2]"
2 3 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
2 4 ASP 3.434 0.516 19 1 "[ . 1 . +2]"
2 5 ASP 0.394 0.110 7 0 "[ . 1 . 2]"
2 6 PHE 10.598 1.446 11 6 "[* . 1+** . *- 2]"
2 7 LEU 1.936 0.516 19 1 "[ . 1 . +2]"
2 8 LYS 0.791 0.110 7 0 "[ . 1 . 2]"
2 9 TRP 4.751 0.251 3 0 "[ . 1 . 2]"
2 10 TRP 12.979 0.455 7 0 "[ . 1 . 2]"
2 11 ARG 0.406 0.113 19 0 "[ . 1 . 2]"
2 12 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 13 GLU 0.015 0.015 12 0 "[ . 1 . 2]"
2 14 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 15 ALA 0.009 0.009 3 0 "[ . 1 . 2]"
2 16 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
2 17 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 18 MET 0.028 0.011 17 0 "[ . 1 . 2]"
2 19 GLY 0.019 0.011 17 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 SER HA 1 2 SER HB2 2.116 . 2.676 2.550 2.398 2.989 0.313 17 0 "[ . 1 . 2]" 1
2 1 2 SER HA 1 2 SER HB3 2.111 . 2.668 2.418 2.354 2.508 . 0 0 "[ . 1 . 2]" 1
3 1 2 SER HA 1 99 ASN HB2 3.056 . 4.224 3.988 3.277 4.286 0.062 8 0 "[ . 1 . 2]" 1
4 1 2 SER HA 1 99 ASN HB3 2.598 . 3.441 2.664 1.894 3.538 0.097 11 0 "[ . 1 . 2]" 1
5 1 3 HIS HA 1 3 HIS HB2 2.743 . 3.684 3.002 2.983 3.017 . 0 0 "[ . 1 . 2]" 1
6 1 3 HIS HA 1 3 HIS HB3 2.638 . 3.508 2.565 2.497 2.634 . 0 0 "[ . 1 . 2]" 1
7 1 3 HIS HA 1 3 HIS HD2 2.969 . 4.071 3.177 2.805 3.680 . 0 0 "[ . 1 . 2]" 1
8 1 3 HIS HA 1 4 SER H 2.526 . 3.323 3.352 3.185 3.529 0.206 2 0 "[ . 1 . 2]" 1
9 1 3 HIS HA 1 18 ILE H 3.319 . 4.696 3.618 3.213 3.828 . 0 0 "[ . 1 . 2]" 1
10 1 3 HIS HA 1 18 ILE HB 2.845 . 3.857 2.805 2.303 3.012 . 0 0 "[ . 1 . 2]" 1
11 1 3 HIS HA 1 18 ILE MD 2.449 . 3.199 3.084 2.703 3.282 0.083 1 0 "[ . 1 . 2]" 1
12 1 3 HIS HA 1 18 ILE MG 2.982 . 4.094 4.103 3.737 4.220 0.126 15 0 "[ . 1 . 2]" 1
13 1 3 HIS HA 1 100 ILE MD 3.037 . 4.190 3.365 3.241 3.579 . 0 0 "[ . 1 . 2]" 1
14 1 3 HIS HA 1 103 THR MG 2.445 . 3.192 1.918 1.799 2.026 . 0 0 "[ . 1 . 2]" 1
15 1 3 HIS HB2 1 3 HIS HD2 3.008 . 4.139 3.904 3.784 3.962 . 0 0 "[ . 1 . 2]" 1
16 1 3 HIS HB2 1 18 ILE H 3.339 . 4.733 4.353 4.062 4.624 . 0 0 "[ . 1 . 2]" 1
17 1 3 HIS HB2 1 18 ILE HB 3.235 . 4.543 4.505 4.237 4.636 0.093 9 0 "[ . 1 . 2]" 1
18 1 3 HIS HB2 1 18 ILE MD 3.733 . 5.475 5.069 4.924 5.146 . 0 0 "[ . 1 . 2]" 1
19 1 3 HIS HB3 1 3 HIS HD2 2.690 . 3.594 2.850 2.702 3.001 . 0 0 "[ . 1 . 2]" 1
20 1 3 HIS HB3 1 4 SER H 3.612 . 5.242 4.022 3.593 4.305 . 0 0 "[ . 1 . 2]" 1
21 1 3 HIS HB3 1 18 ILE H 3.162 . 4.412 2.886 2.640 3.149 . 0 0 "[ . 1 . 2]" 1
22 1 3 HIS HB3 1 18 ILE HB 3.217 . 4.511 2.952 2.538 3.172 . 0 0 "[ . 1 . 2]" 1
23 1 3 HIS HB3 1 18 ILE MD 2.897 . 3.946 3.985 3.760 4.092 0.146 2 0 "[ . 1 . 2]" 1
24 1 3 HIS HD2 1 18 ILE HB 2.567 . 3.391 2.506 2.239 2.790 . 0 0 "[ . 1 . 2]" 1
25 1 3 HIS HD2 1 18 ILE MD 3.163 . 4.414 4.373 4.179 4.535 0.121 19 0 "[ . 1 . 2]" 1
26 1 3 HIS HD2 1 18 ILE MG 2.403 . 3.125 2.320 2.050 2.787 . 0 0 "[ . 1 . 2]" 1
27 1 3 HIS HD2 1 20 GLU HG2 3.494 . 5.020 4.533 3.870 5.011 . 0 0 "[ . 1 . 2]" 1
28 1 3 HIS HD2 1 20 GLU HG3 3.157 . 4.403 3.319 2.912 3.886 . 0 0 "[ . 1 . 2]" 1
29 1 3 HIS HD2 1 103 THR MG 2.647 . 3.523 2.488 2.021 3.161 . 0 0 "[ . 1 . 2]" 1
30 1 3 HIS HD2 1 107 ILE MD 3.469 . 4.973 3.301 3.017 3.518 . 0 0 "[ . 1 . 2]" 1
31 1 4 SER H 1 4 SER HA 2.790 . 3.763 2.895 2.841 2.925 . 0 0 "[ . 1 . 2]" 1
32 1 4 SER H 1 4 SER HB3 2.729 . 3.660 3.488 3.403 3.623 . 0 0 "[ . 1 . 2]" 1
33 1 4 SER H 1 5 GLY H 3.486 . 5.005 4.366 4.319 4.412 . 0 0 "[ . 1 . 2]" 1
34 1 4 SER H 1 100 ILE MD 3.030 . 4.178 2.942 2.675 3.124 . 0 0 "[ . 1 . 2]" 1
35 1 4 SER H 1 103 THR MG 3.382 . 4.812 4.848 4.720 4.922 0.110 11 0 "[ . 1 . 2]" 1
36 1 4 SER HA 1 4 SER HB2 2.056 . 2.584 2.511 2.480 2.541 . 0 0 "[ . 1 . 2]" 1
37 1 4 SER HA 1 4 SER HB3 2.044 . 2.566 2.346 2.307 2.373 . 0 0 "[ . 1 . 2]" 1
38 1 4 SER HA 1 5 GLY H 2.217 . 2.831 2.321 2.224 2.437 . 0 0 "[ . 1 . 2]" 1
39 1 4 SER HA 1 15 ILE MG 2.492 . 3.268 3.491 3.459 3.529 0.261 7 0 "[ . 1 . 2]" 1
40 1 4 SER HA 1 16 ILE H 3.568 . 5.160 4.387 4.308 4.473 . 0 0 "[ . 1 . 2]" 1
41 1 4 SER HA 1 16 ILE MG 2.703 . 3.617 2.762 2.674 2.881 . 0 0 "[ . 1 . 2]" 1
42 1 4 SER HA 1 17 ALA HA 2.173 . 2.763 2.450 2.385 2.538 . 0 0 "[ . 1 . 2]" 1
43 1 4 SER HA 1 18 ILE H 3.120 . 4.336 3.434 3.246 3.595 . 0 0 "[ . 1 . 2]" 1
44 1 4 SER HA 1 100 ILE MD 2.681 . 3.580 2.381 2.338 2.418 . 0 0 "[ . 1 . 2]" 1
45 1 4 SER HB2 1 5 GLY H 2.495 . 3.273 2.308 2.133 2.470 . 0 0 "[ . 1 . 2]" 1
46 1 4 SER HB2 1 15 ILE MG 2.037 . 2.556 2.327 2.211 2.436 . 0 0 "[ . 1 . 2]" 1
47 1 4 SER HB2 1 17 ALA HA 2.446 . 3.194 3.203 3.155 3.237 0.043 12 0 "[ . 1 . 2]" 1
48 1 4 SER HB2 1 17 ALA MB 2.331 . 3.010 3.113 3.072 3.150 0.140 12 0 "[ . 1 . 2]" 1
49 1 4 SER HB2 1 18 ILE H 3.427 . 4.895 4.911 4.871 4.976 0.081 4 0 "[ . 1 . 2]" 1
50 1 4 SER HB2 1 100 ILE MD 3.021 . 4.162 4.271 4.237 4.320 0.158 2 0 "[ . 1 . 2]" 1
51 1 4 SER HB3 1 5 GLY H 2.573 . 3.400 3.521 3.474 3.555 0.155 19 0 "[ . 1 . 2]" 1
52 1 4 SER HB3 1 15 ILE MG 2.524 . 3.320 3.357 3.275 3.423 0.103 4 0 "[ . 1 . 2]" 1
53 1 4 SER HB3 1 17 ALA HA 2.426 . 3.162 2.130 1.968 2.256 . 0 0 "[ . 1 . 2]" 1
54 1 4 SER HB3 1 17 ALA MB 2.307 . 2.972 2.628 2.510 2.724 . 0 0 "[ . 1 . 2]" 1
55 1 4 SER HB3 1 18 ILE H 3.390 . 4.826 3.452 3.323 3.585 . 0 0 "[ . 1 . 2]" 1
56 1 4 SER HB3 1 100 ILE MD 3.043 . 4.200 4.285 4.241 4.346 0.146 8 0 "[ . 1 . 2]" 1
57 1 5 GLY H 1 5 GLY HA2 2.837 . 3.843 2.748 2.714 2.785 . 0 0 "[ . 1 . 2]" 1
58 1 5 GLY H 1 5 GLY HA3 2.946 . 4.031 2.840 2.810 2.865 . 0 0 "[ . 1 . 2]" 1
59 1 5 GLY H 1 6 ALA H 2.987 . 4.102 4.190 4.148 4.222 0.120 20 0 "[ . 1 . 2]" 1
60 1 5 GLY H 1 15 ILE MG 2.459 . 3.215 2.014 1.886 2.093 . 0 0 "[ . 1 . 2]" 1
61 1 5 GLY H 1 16 ILE H 2.741 . 3.680 2.816 2.776 2.875 . 0 0 "[ . 1 . 2]" 1
62 1 5 GLY H 1 17 ALA HA 3.060 . 4.231 3.934 3.866 3.985 . 0 0 "[ . 1 . 2]" 1
63 1 5 GLY H 1 100 ILE MD 3.277 . 4.619 3.175 3.046 3.274 . 0 0 "[ . 1 . 2]" 1
64 1 5 GLY HA2 1 6 ALA H 2.268 . 2.911 2.273 2.240 2.315 . 0 0 "[ . 1 . 2]" 1
65 1 5 GLY HA2 1 15 ILE MD 3.379 . 4.806 5.089 5.030 5.165 0.359 4 0 "[ . 1 . 2]" 1
66 1 5 GLY HA2 1 15 ILE MG 3.161 . 4.410 3.552 3.331 3.667 . 0 0 "[ . 1 . 2]" 1
67 1 5 GLY HA2 1 96 VAL MG1 2.534 . 3.337 3.432 3.355 3.505 0.168 10 0 "[ . 1 . 2]" 1
68 1 5 GLY HA2 1 100 ILE MD 3.053 . 4.218 4.296 4.247 4.327 0.109 11 0 "[ . 1 . 2]" 1
69 1 5 GLY HA3 1 6 ALA H 2.363 . 3.061 2.875 2.822 2.921 . 0 0 "[ . 1 . 2]" 1
70 1 5 GLY HA3 1 15 ILE MG 3.058 . 4.227 4.190 4.077 4.254 0.027 11 0 "[ . 1 . 2]" 1
71 1 5 GLY HA3 1 96 VAL MG1 2.441 . 3.186 2.093 1.981 2.172 . 0 0 "[ . 1 . 2]" 1
72 1 5 GLY HA3 1 100 ILE MD 3.079 . 4.264 3.208 3.154 3.250 . 0 0 "[ . 1 . 2]" 1
73 1 6 ALA H 1 6 ALA HA 2.643 . 3.516 2.815 2.808 2.827 . 0 0 "[ . 1 . 2]" 1
74 1 6 ALA H 1 6 ALA MB 2.130 . 2.697 2.242 2.232 2.251 . 0 0 "[ . 1 . 2]" 1
75 1 6 ALA H 1 15 ILE HA 3.444 . 4.926 4.194 4.133 4.237 . 0 0 "[ . 1 . 2]" 1
76 1 6 ALA H 1 96 VAL MG1 2.695 . 3.603 3.337 3.071 3.494 . 0 0 "[ . 1 . 2]" 1
77 1 6 ALA H 1 96 VAL MG2 2.625 . 3.486 3.118 2.789 3.497 0.011 3 0 "[ . 1 . 2]" 1
78 1 6 ALA HA 1 6 ALA MB 1.927 . 2.391 2.106 2.104 2.109 . 0 0 "[ . 1 . 2]" 1
79 1 6 ALA HA 1 7 ALA H 2.096 . 2.645 2.087 2.075 2.099 . 0 0 "[ . 1 . 2]" 1
80 1 6 ALA HA 1 15 ILE HA 2.126 . 2.691 1.732 1.716 1.750 . 0 0 "[ . 1 . 2]" 1
81 1 6 ALA HA 1 15 ILE MD 2.306 . 2.971 2.597 2.458 2.799 . 0 0 "[ . 1 . 2]" 1
82 1 6 ALA HA 1 15 ILE HG12 3.019 . 4.158 3.786 3.695 3.956 . 0 0 "[ . 1 . 2]" 1
83 1 6 ALA HA 1 15 ILE HG13 3.203 . 4.486 2.072 1.997 2.232 . 0 0 "[ . 1 . 2]" 1
84 1 6 ALA HA 1 15 ILE MG 2.541 . 3.348 3.443 3.405 3.489 0.141 17 0 "[ . 1 . 2]" 1
85 1 6 ALA MB 1 7 ALA H 2.442 . 3.188 3.171 3.073 3.211 0.023 17 0 "[ . 1 . 2]" 1
86 1 6 ALA MB 1 7 ALA HA 3.086 . 4.276 4.171 4.120 4.197 . 0 0 "[ . 1 . 2]" 1
87 1 6 ALA MB 1 15 ILE HA 2.481 . 3.251 3.427 3.406 3.450 0.199 10 0 "[ . 1 . 2]" 1
88 1 6 ALA MB 1 15 ILE MD 2.317 . 2.988 2.548 2.441 2.738 . 0 0 "[ . 1 . 2]" 1
89 1 6 ALA MB 1 15 ILE HG12 2.921 . 3.988 3.908 3.859 3.998 0.010 4 0 "[ . 1 . 2]" 1
90 1 6 ALA MB 1 15 ILE HG13 2.076 . 2.614 2.692 2.666 2.710 0.096 18 0 "[ . 1 . 2]" 1
91 1 6 ALA MB 1 92 ASN HD21 3.646 . 5.307 4.391 3.105 6.180 0.873 1 1 "[+ . 1 . 2]" 1
92 1 7 ALA H 1 7 ALA HA 2.634 . 3.501 2.938 2.929 2.943 . 0 0 "[ . 1 . 2]" 1
93 1 7 ALA H 1 7 ALA MB 2.676 . 3.571 2.484 2.453 2.545 . 0 0 "[ . 1 . 2]" 1
94 1 7 ALA H 1 14 GLY H 2.570 . 3.395 3.425 3.329 3.486 0.091 12 0 "[ . 1 . 2]" 1
95 1 7 ALA H 1 16 ILE H 2.805 . 3.788 3.019 2.941 3.122 . 0 0 "[ . 1 . 2]" 1
96 1 7 ALA HA 1 7 ALA MB 2.058 . 2.587 2.130 2.125 2.137 . 0 0 "[ . 1 . 2]" 1
97 1 7 ALA HA 1 8 ILE H 2.370 . 3.072 2.505 2.382 2.562 . 0 0 "[ . 1 . 2]" 1
98 1 7 ALA HA 1 8 ILE MD 2.589 . 3.427 2.945 2.813 3.217 . 0 0 "[ . 1 . 2]" 1
99 1 7 ALA HA 1 91 PHE HA 2.639 . 3.509 2.341 2.022 2.578 . 0 0 "[ . 1 . 2]" 1
100 1 7 ALA MB 1 8 ILE H 2.582 . 3.415 2.156 2.081 2.371 . 0 0 "[ . 1 . 2]" 1
101 1 7 ALA MB 1 15 ILE HA 3.124 . 4.344 3.471 3.366 3.584 . 0 0 "[ . 1 . 2]" 1
102 1 7 ALA MB 1 16 ILE H 3.397 . 4.840 2.823 2.764 2.908 . 0 0 "[ . 1 . 2]" 1
103 1 7 ALA MB 1 16 ILE HA 2.582 . 3.415 3.597 3.561 3.644 0.229 1 0 "[ . 1 . 2]" 1
104 1 7 ALA MB 1 16 ILE HB 2.499 . 3.279 2.034 1.982 2.114 . 0 0 "[ . 1 . 2]" 1
105 1 7 ALA MB 1 16 ILE MD 2.194 . 2.796 2.597 2.359 2.829 0.033 20 0 "[ . 1 . 2]" 1
106 1 7 ALA MB 1 16 ILE HG12 3.305 . 4.671 3.974 3.852 4.124 . 0 0 "[ . 1 . 2]" 1
107 1 7 ALA MB 1 16 ILE HG13 2.558 . 3.376 2.729 2.591 2.912 . 0 0 "[ . 1 . 2]" 1
108 1 7 ALA MB 1 16 ILE MG 2.399 . 3.118 3.245 3.195 3.332 0.214 12 0 "[ . 1 . 2]" 1
109 1 7 ALA MB 1 29 TRP HD1 2.546 . 3.356 1.903 1.800 2.079 . 0 0 "[ . 1 . 2]" 1
110 1 7 ALA MB 1 29 TRP HE1 2.855 . 3.874 2.629 2.500 2.751 . 0 0 "[ . 1 . 2]" 1
111 1 7 ALA MB 1 89 PHE HA 3.027 . 4.172 3.846 3.383 4.186 0.014 10 0 "[ . 1 . 2]" 1
112 1 7 ALA MB 1 89 PHE QB 2.660 . 3.399 2.115 1.846 2.421 . 0 0 "[ . 1 . 2]" 1
113 1 7 ALA MB 1 90 SER H 3.088 . 4.280 3.353 3.138 3.654 . 0 0 "[ . 1 . 2]" 1
114 1 7 ALA MB 1 91 PHE H 3.183 . 4.449 4.640 4.575 4.692 0.243 10 0 "[ . 1 . 2]" 1
115 1 7 ALA MB 1 91 PHE HA 2.809 . 3.796 3.641 3.403 3.854 0.058 1 0 "[ . 1 . 2]" 1
116 1 7 ALA MB 1 91 PHE HD2 3.257 . 4.583 4.499 4.250 4.645 0.062 6 0 "[ . 1 . 2]" 1
117 1 7 ALA MB 1 91 PHE HE2 3.253 . 4.576 4.206 3.826 4.559 . 0 0 "[ . 1 . 2]" 1
118 1 7 ALA MB 1 91 PHE HZ 2.686 . 3.588 3.162 2.823 3.580 . 0 0 "[ . 1 . 2]" 1
119 1 8 ILE H 1 8 ILE HB 2.529 . 3.328 2.555 2.438 2.598 . 0 0 "[ . 1 . 2]" 1
120 1 8 ILE H 1 8 ILE MD 3.063 . 4.236 2.985 2.881 3.172 . 0 0 "[ . 1 . 2]" 1
121 1 8 ILE H 1 8 ILE HG13 2.746 . 3.688 3.671 3.599 3.714 0.026 10 0 "[ . 1 . 2]" 1
122 1 8 ILE H 1 8 ILE MG 3.134 . 4.362 3.728 3.656 3.769 . 0 0 "[ . 1 . 2]" 1
123 1 8 ILE H 1 90 SER H 2.848 . 3.862 2.307 2.052 2.844 . 0 0 "[ . 1 . 2]" 1
124 1 8 ILE H 1 90 SER HB2 3.731 . 5.471 3.758 2.935 4.477 . 0 0 "[ . 1 . 2]" 1
125 1 8 ILE H 1 90 SER HB3 3.356 . 4.764 3.819 3.284 4.462 . 0 0 "[ . 1 . 2]" 1
126 1 8 ILE HA 1 8 ILE HB 2.582 . 3.415 2.993 2.982 3.004 . 0 0 "[ . 1 . 2]" 1
127 1 8 ILE HA 1 8 ILE MD 2.496 . 3.275 3.371 3.316 3.445 0.170 3 0 "[ . 1 . 2]" 1
128 1 8 ILE HA 1 8 ILE HG12 2.593 . 3.433 3.223 3.116 3.273 . 0 0 "[ . 1 . 2]" 1
129 1 8 ILE HA 1 8 ILE HG13 2.647 . 3.523 2.090 2.053 2.119 . 0 0 "[ . 1 . 2]" 1
130 1 8 ILE HA 1 8 ILE MG 2.265 . 2.906 2.596 2.560 2.650 . 0 0 "[ . 1 . 2]" 1
131 1 8 ILE HA 1 9 PHE H 2.289 . 2.944 2.206 2.176 2.243 . 0 0 "[ . 1 . 2]" 1
132 1 8 ILE HA 1 13 SER HA 2.284 . 2.936 2.086 2.043 2.125 . 0 0 "[ . 1 . 2]" 1
133 1 8 ILE HA 1 13 SER QB 2.833 . 3.836 3.911 3.865 3.946 0.110 3 0 "[ . 1 . 2]" 1
134 1 8 ILE HA 1 14 GLY H 2.738 . 3.675 2.930 2.840 3.010 . 0 0 "[ . 1 . 2]" 1
135 1 8 ILE HA 1 29 TRP HE1 2.836 . 3.841 2.392 2.296 2.532 . 0 0 "[ . 1 . 2]" 1
136 1 8 ILE HA 1 29 TRP HH2 3.279 . 4.623 4.718 4.673 4.789 0.166 12 0 "[ . 1 . 2]" 1
137 1 8 ILE HB 1 8 ILE MD 2.282 . 2.933 2.209 2.196 2.223 . 0 0 "[ . 1 . 2]" 1
138 1 8 ILE HB 1 8 ILE HG12 2.610 . 3.462 2.789 2.765 2.836 . 0 0 "[ . 1 . 2]" 1
139 1 8 ILE HB 1 8 ILE HG13 2.814 . 3.804 2.876 2.835 2.898 . 0 0 "[ . 1 . 2]" 1
140 1 8 ILE HB 1 8 ILE MG 2.140 . 2.713 2.125 2.118 2.130 . 0 0 "[ . 1 . 2]" 1
141 1 8 ILE HB 1 9 PHE H 3.346 . 4.745 4.193 4.136 4.307 . 0 0 "[ . 1 . 2]" 1
142 1 8 ILE HB 1 29 TRP HE1 3.282 . 4.629 4.731 4.669 4.803 0.174 1 0 "[ . 1 . 2]" 1
143 1 8 ILE HB 1 90 SER H 2.873 . 3.905 3.030 2.469 3.599 . 0 0 "[ . 1 . 2]" 1
144 1 8 ILE HB 1 90 SER HB2 2.433 . 3.173 2.575 1.748 3.214 0.041 7 0 "[ . 1 . 2]" 1
145 1 8 ILE HB 1 90 SER HB3 2.301 . 2.963 2.506 1.854 3.240 0.277 1 0 "[ . 1 . 2]" 1
146 1 8 ILE MD 1 8 ILE HG12 2.057 . 2.586 2.110 2.103 2.114 . 0 0 "[ . 1 . 2]" 1
147 1 8 ILE MD 1 8 ILE HG13 1.988 . 2.482 2.088 2.086 2.091 . 0 0 "[ . 1 . 2]" 1
148 1 8 ILE MD 1 13 SER HA 2.426 . 3.162 3.430 3.400 3.453 0.291 15 0 "[ . 1 . 2]" 1
149 1 8 ILE MD 1 13 SER QB 2.795 . 3.771 2.876 2.733 2.951 . 0 0 "[ . 1 . 2]" 1
150 1 8 ILE MD 1 14 GLY H 3.075 . 4.257 3.754 3.571 3.934 . 0 0 "[ . 1 . 2]" 1
151 1 8 ILE MD 1 29 TRP HE1 3.272 . 4.610 4.475 4.359 4.638 0.028 3 0 "[ . 1 . 2]" 1
152 1 8 ILE MD 1 90 SER HB2 2.887 . 3.929 3.634 3.134 4.016 0.087 14 0 "[ . 1 . 2]" 1
153 1 8 ILE MD 1 90 SER HB3 2.690 . 3.595 2.999 2.275 3.744 0.149 10 0 "[ . 1 . 2]" 1
154 1 8 ILE MD 1 92 ASN HD21 3.383 . 4.814 4.022 2.679 5.133 0.319 2 0 "[ . 1 . 2]" 1
155 1 8 ILE HG12 1 8 ILE MG 2.383 . 3.093 2.159 2.150 2.172 . 0 0 "[ . 1 . 2]" 1
156 1 8 ILE HG12 1 9 PHE H 3.218 . 4.512 4.547 4.407 4.581 0.069 15 0 "[ . 1 . 2]" 1
157 1 8 ILE HG12 1 13 SER HA 2.689 . 3.593 2.659 2.486 2.766 . 0 0 "[ . 1 . 2]" 1
158 1 8 ILE HG12 1 14 GLY H 3.040 . 4.195 4.326 4.278 4.371 0.176 2 0 "[ . 1 . 2]" 1
159 1 8 ILE HG13 1 8 ILE MG 2.330 . 3.008 2.870 2.830 2.943 . 0 0 "[ . 1 . 2]" 1
160 1 8 ILE HG13 1 9 PHE H 3.198 . 4.476 4.027 3.974 4.079 . 0 0 "[ . 1 . 2]" 1
161 1 8 ILE HG13 1 13 SER HA 2.515 . 3.305 1.715 1.698 1.742 0.027 1 0 "[ . 1 . 2]" 1
162 1 8 ILE HG13 1 14 GLY H 3.096 . 4.294 2.709 2.638 2.778 . 0 0 "[ . 1 . 2]" 1
163 1 8 ILE MG 1 9 PHE H 2.589 . 3.427 2.494 2.435 2.679 . 0 0 "[ . 1 . 2]" 1
164 1 8 ILE MG 1 12 VAL H 2.502 . 3.284 3.241 3.018 3.359 0.075 18 0 "[ . 1 . 2]" 1
165 1 8 ILE MG 1 12 VAL HA 3.129 . 4.353 3.817 3.604 4.129 . 0 0 "[ . 1 . 2]" 1
166 1 8 ILE MG 1 13 SER H 3.550 . 5.126 4.079 3.930 4.233 . 0 0 "[ . 1 . 2]" 1
167 1 8 ILE MG 1 13 SER HA 2.505 . 3.289 2.945 2.819 3.137 . 0 0 "[ . 1 . 2]" 1
168 1 8 ILE MG 1 14 GLY H 3.431 . 4.902 4.673 4.595 4.802 . 0 0 "[ . 1 . 2]" 1
169 1 8 ILE MG 1 29 TRP HE1 3.777 . 5.560 4.516 4.428 4.629 . 0 0 "[ . 1 . 2]" 1
170 1 8 ILE MG 1 90 SER HB2 2.792 . 3.766 3.301 2.640 3.820 0.054 18 0 "[ . 1 . 2]" 1
171 1 8 ILE MG 1 90 SER HB3 2.594 . 3.435 3.547 3.184 3.915 0.480 13 0 "[ . 1 . 2]" 1
172 1 9 PHE H 1 9 PHE HB2 2.888 . 3.931 3.229 3.136 3.291 . 0 0 "[ . 1 . 2]" 1
173 1 9 PHE H 1 9 PHE HB3 2.880 . 3.917 2.944 2.873 2.983 . 0 0 "[ . 1 . 2]" 1
174 1 9 PHE H 1 12 VAL H 2.737 . 3.673 3.394 3.129 3.592 . 0 0 "[ . 1 . 2]" 1
175 1 9 PHE H 1 29 TRP HE1 3.099 . 4.300 3.480 3.383 3.589 . 0 0 "[ . 1 . 2]" 1
176 1 9 PHE H 1 29 TRP HH2 2.922 . 3.989 3.773 3.695 3.921 . 0 0 "[ . 1 . 2]" 1
177 1 9 PHE HA 1 9 PHE HB2 2.790 . 3.763 2.535 2.501 2.555 . 0 0 "[ . 1 . 2]" 1
178 1 9 PHE HA 1 9 PHE HB3 2.636 . 3.505 3.026 3.007 3.033 . 0 0 "[ . 1 . 2]" 1
179 1 9 PHE HA 1 9 PHE QD 2.506 . 3.291 2.910 2.798 3.017 . 0 0 "[ . 1 . 2]" 1
180 1 9 PHE HA 1 10 GLU H 2.371 . 3.074 2.186 2.095 2.236 . 0 0 "[ . 1 . 2]" 1
181 1 9 PHE HA 1 11 LYS H 3.716 . 5.442 3.656 3.345 4.405 . 0 0 "[ . 1 . 2]" 1
182 1 9 PHE HA 1 89 PHE HA 2.991 . 4.109 3.687 3.407 3.840 . 0 0 "[ . 1 . 2]" 1
183 1 9 PHE HB2 1 9 PHE QD 2.666 . 3.554 2.373 2.343 2.424 . 0 0 "[ . 1 . 2]" 1
184 1 9 PHE HB2 1 10 GLU H 3.572 . 5.167 4.303 4.232 4.397 . 0 0 "[ . 1 . 2]" 1
185 1 9 PHE HB2 1 29 TRP HE1 3.379 . 4.806 3.761 3.405 3.944 . 0 0 "[ . 1 . 2]" 1
186 1 9 PHE HB3 1 9 PHE QD 2.695 . 3.603 2.378 2.339 2.417 . 0 0 "[ . 1 . 2]" 1
187 1 9 PHE HB3 1 10 GLU H 2.974 . 4.080 4.072 4.002 4.188 0.108 16 0 "[ . 1 . 2]" 1
188 1 9 PHE HB3 1 29 TRP HE1 3.480 . 4.994 4.275 4.075 4.493 . 0 0 "[ . 1 . 2]" 1
189 1 9 PHE QD 1 10 GLU H 3.110 . 4.319 3.568 3.410 3.823 . 0 0 "[ . 1 . 2]" 1
190 1 9 PHE QD 1 29 TRP HB3 3.370 . 4.789 4.358 4.095 4.521 . 0 0 "[ . 1 . 2]" 1
191 1 9 PHE QD 1 88 MET H 3.391 . 4.828 3.935 3.051 4.374 . 0 0 "[ . 1 . 2]" 1
192 1 9 PHE QD 1 89 PHE HD1 2.960 . 4.055 3.706 1.975 4.147 0.092 17 0 "[ . 1 . 2]" 1
193 1 9 PHE QE 1 88 MET H 2.724 . 3.651 2.684 1.791 3.446 0.006 20 0 "[ . 1 . 2]" 1
194 1 10 GLU H 1 10 GLU HA 2.281 . 2.931 2.272 2.258 2.279 . 0 0 "[ . 1 . 2]" 1
195 1 10 GLU H 1 10 GLU HB2 3.078 . 4.262 3.532 3.447 3.592 . 0 0 "[ . 1 . 2]" 1
196 1 10 GLU H 1 10 GLU HB3 2.953 . 4.043 4.088 3.991 4.122 0.079 17 0 "[ . 1 . 2]" 1
197 1 10 GLU H 1 10 GLU HG2 2.836 . 3.842 3.591 3.258 3.758 . 0 0 "[ . 1 . 2]" 1
198 1 10 GLU H 1 10 GLU HG3 2.777 . 3.741 2.933 2.744 3.080 . 0 0 "[ . 1 . 2]" 1
199 1 10 GLU H 1 11 LYS H 2.808 . 3.793 2.598 2.449 3.018 . 0 0 "[ . 1 . 2]" 1
200 1 10 GLU H 1 11 LYS HA 3.609 . 5.237 4.829 4.673 5.260 0.023 12 0 "[ . 1 . 2]" 1
201 1 10 GLU HA 1 10 GLU HB2 2.277 . 2.925 3.014 2.996 3.023 0.098 2 0 "[ . 1 . 2]" 1
202 1 10 GLU HA 1 10 GLU HB3 2.512 . 3.300 2.500 2.464 2.560 . 0 0 "[ . 1 . 2]" 1
203 1 10 GLU HA 1 10 GLU HG2 2.659 . 3.542 2.475 2.407 2.530 . 0 0 "[ . 1 . 2]" 1
204 1 10 GLU HA 1 10 GLU HG3 2.406 . 3.129 2.986 2.908 3.109 . 0 0 "[ . 1 . 2]" 1
205 1 10 GLU HA 1 11 LYS H 2.471 . 3.235 2.735 2.453 2.833 . 0 0 "[ . 1 . 2]" 1
206 1 10 GLU HB2 1 10 GLU HG2 2.664 . 3.551 2.997 2.992 3.006 . 0 0 "[ . 1 . 2]" 1
207 1 10 GLU HB2 1 10 GLU HG3 2.554 . 3.369 2.436 2.394 2.471 . 0 0 "[ . 1 . 2]" 1
208 1 10 GLU HB3 1 10 GLU HG2 2.565 . 3.388 2.423 2.384 2.485 . 0 0 "[ . 1 . 2]" 1
209 1 10 GLU HB3 1 10 GLU HG3 2.391 . 3.106 3.001 2.998 3.006 . 0 0 "[ . 1 . 2]" 1
210 1 10 GLU HB3 1 11 LYS H 3.032 . 4.181 4.369 4.259 4.397 0.216 18 0 "[ . 1 . 2]" 1
211 1 10 GLU HB3 1 12 VAL H 3.159 . 4.407 4.158 3.775 4.941 0.534 16 1 "[ . 1 .+ 2]" 1
212 1 10 GLU HG2 1 11 LYS H 3.437 . 4.914 5.064 4.872 5.133 0.219 8 0 "[ . 1 . 2]" 1
213 1 10 GLU HG3 1 11 LYS H 3.423 . 4.887 4.895 4.758 5.043 0.156 12 0 "[ . 1 . 2]" 1
214 1 11 LYS H 1 11 LYS HA 2.188 . 2.786 2.251 2.243 2.258 . 0 0 "[ . 1 . 2]" 1
215 1 11 LYS H 1 11 LYS QB 2.953 . 4.043 3.301 3.212 3.362 . 0 0 "[ . 1 . 2]" 1
216 1 11 LYS H 1 11 LYS HD2 3.109 . 4.317 3.236 2.179 4.382 0.065 9 0 "[ . 1 . 2]" 1
217 1 11 LYS H 1 11 LYS HD3 2.993 . 4.112 3.531 2.768 4.323 0.211 12 0 "[ . 1 . 2]" 1
218 1 11 LYS H 1 11 LYS QG 2.543 . 3.351 3.181 2.929 3.408 0.057 4 0 "[ . 1 . 2]" 1
219 1 11 LYS HA 1 11 LYS QB 2.398 . 3.117 2.398 2.340 2.439 . 0 0 "[ . 1 . 2]" 1
220 1 11 LYS HA 1 11 LYS HD2 3.314 . 4.687 2.963 2.596 3.323 . 0 0 "[ . 1 . 2]" 1
221 1 11 LYS HA 1 11 LYS HD3 3.120 . 4.337 3.237 1.816 4.313 0.087 8 0 "[ . 1 . 2]" 1
222 1 11 LYS HA 1 11 LYS HE2 3.204 . 4.487 4.474 4.092 5.321 0.834 12 1 "[ . 1 + . 2]" 1
223 1 11 LYS HA 1 11 LYS QG 2.310 . 2.977 2.467 2.145 2.915 . 0 0 "[ . 1 . 2]" 1
224 1 11 LYS QB 1 11 LYS HD2 2.316 . 2.987 2.618 2.447 2.861 . 0 0 "[ . 1 . 2]" 1
225 1 11 LYS QB 1 11 LYS HD3 2.713 . 3.442 2.635 2.233 3.021 . 0 0 "[ . 1 . 2]" 1
226 1 11 LYS QB 1 11 LYS HE2 3.698 . 5.186 4.148 3.961 4.465 . 0 0 "[ . 1 . 2]" 1
227 1 11 LYS QB 1 12 VAL H 3.412 . 4.867 3.444 3.291 3.633 . 0 0 "[ . 1 . 2]" 1
228 1 11 LYS HD2 1 11 LYS HE2 1.963 . 2.445 2.683 2.447 3.001 0.556 3 8 "[**+ . * 1 * -* *2]" 1
229 1 11 LYS HD2 1 11 LYS QG 2.131 . 2.699 2.322 2.241 2.438 . 0 0 "[ . 1 . 2]" 1
230 1 11 LYS HD3 1 11 LYS HE2 2.315 . 2.985 2.701 2.307 2.996 0.011 10 0 "[ . 1 . 2]" 1
231 1 11 LYS HD3 1 11 LYS QG 2.191 . 2.756 2.300 2.201 2.368 . 0 0 "[ . 1 . 2]" 1
232 1 11 LYS HE2 1 11 LYS QG 2.237 . 2.734 2.449 2.266 3.272 0.538 4 2 "[ +. 1 - . 2]" 1
233 1 12 VAL H 1 12 VAL HB 2.538 . 3.343 3.190 3.063 3.374 0.031 16 0 "[ . 1 . 2]" 1
234 1 12 VAL H 1 12 VAL QG 2.799 . 2.994 2.078 1.992 2.242 . 0 0 "[ . 1 . 2]" 1
235 1 12 VAL H 1 13 SER H 3.167 . 4.421 4.470 4.399 4.503 0.082 18 0 "[ . 1 . 2]" 1
236 1 12 VAL H 1 29 TRP HH2 3.237 . 4.546 4.307 4.149 4.536 . 0 0 "[ . 1 . 2]" 1
237 1 12 VAL HA 1 12 VAL HB 2.649 . 3.526 2.366 2.352 2.386 . 0 0 "[ . 1 . 2]" 1
238 1 12 VAL HA 1 12 VAL QG 2.115 . 2.674 2.420 2.383 2.462 . 0 0 "[ . 1 . 2]" 1
239 1 12 VAL HA 1 13 SER H 2.045 . 2.568 2.255 2.213 2.280 . 0 0 "[ . 1 . 2]" 1
240 1 12 VAL HB 1 12 VAL QG 2.120 . 2.645 1.884 1.875 1.890 . 0 0 "[ . 1 . 2]" 1
241 1 12 VAL HB 1 13 SER H 3.542 . 5.110 3.765 3.714 3.834 . 0 0 "[ . 1 . 2]" 1
242 1 12 VAL HB 1 29 TRP HH2 2.914 . 3.976 4.121 4.078 4.159 0.183 11 0 "[ . 1 . 2]" 1
243 1 12 VAL MG1 1 12 VAL MG2 1.820 . 2.234 2.065 2.020 2.099 . 0 0 "[ . 1 . 2]" 1
244 1 12 VAL QG 1 13 SER H 2.828 . 3.115 2.043 1.963 2.106 . 0 0 "[ . 1 . 2]" 1
245 1 12 VAL QG 1 13 SER QB 2.612 . 3.465 3.523 3.463 3.597 0.132 18 0 "[ . 1 . 2]" 1
246 1 12 VAL QG 1 29 TRP HH2 2.813 . 3.802 1.772 1.718 1.806 0.237 19 0 "[ . 1 . 2]" 1
247 1 12 VAL QG 1 29 TRP HZ2 3.028 . 3.434 2.840 2.772 2.933 . 0 0 "[ . 1 . 2]" 1
248 1 12 VAL QG 1 31 SER HA 2.503 . 3.286 3.198 2.997 3.259 . 0 0 "[ . 1 . 2]" 1
249 1 12 VAL QG 1 31 SER HB2 2.550 . 3.363 2.180 2.092 2.292 . 0 0 "[ . 1 . 2]" 1
250 1 12 VAL QG 1 31 SER HB3 2.575 . 3.404 2.601 2.415 2.749 . 0 0 "[ . 1 . 2]" 1
251 1 12 VAL QG 1 32 THR H 3.150 . 4.390 3.436 3.241 3.733 . 0 0 "[ . 1 . 2]" 1
252 1 12 VAL QG 1 33 ASP H 3.541 . 5.108 4.158 3.397 4.520 . 0 0 "[ . 1 . 2]" 1
253 1 12 VAL QG 1 34 GLY H 3.780 . 5.566 5.325 5.042 5.433 . 0 0 "[ . 1 . 2]" 1
254 1 12 VAL QG 1 36 LYS H 3.603 . 5.226 4.497 4.361 4.797 . 0 0 "[ . 1 . 2]" 1
255 1 12 VAL QG 1 36 LYS QB 2.920 . 3.986 3.062 2.911 3.197 . 0 0 "[ . 1 . 2]" 1
256 1 12 VAL QG 1 36 LYS HD3 2.620 . 3.204 2.124 1.953 2.754 . 0 0 "[ . 1 . 2]" 1
257 1 12 VAL QG 1 36 LYS QE 2.654 . 3.534 2.641 2.350 3.171 . 0 0 "[ . 1 . 2]" 1
258 1 13 SER H 1 13 SER HA 2.794 . 3.769 2.912 2.898 2.920 . 0 0 "[ . 1 . 2]" 1
259 1 13 SER H 1 13 SER QB 2.291 . 2.947 2.357 2.197 2.512 . 0 0 "[ . 1 . 2]" 1
260 1 13 SER H 1 14 GLY H 3.238 . 4.549 4.532 4.506 4.557 0.008 11 0 "[ . 1 . 2]" 1
261 1 13 SER HA 1 13 SER QB 2.487 . 2.745 2.268 2.234 2.298 . 0 0 "[ . 1 . 2]" 1
262 1 13 SER HA 1 14 GLY H 2.143 . 2.717 2.275 2.237 2.343 . 0 0 "[ . 1 . 2]" 1
263 1 13 SER HA 1 29 TRP HE1 3.125 . 4.346 3.766 3.625 3.991 . 0 0 "[ . 1 . 2]" 1
264 1 13 SER HA 1 29 TRP HH2 3.206 . 4.491 4.409 4.308 4.495 0.004 6 0 "[ . 1 . 2]" 1
265 1 13 SER QB 1 14 GLY H 2.719 . 3.643 2.990 2.545 3.394 . 0 0 "[ . 1 . 2]" 1
266 1 13 SER QB 1 32 THR MG 2.769 . 3.728 2.803 2.404 2.996 . 0 0 "[ . 1 . 2]" 1
267 1 14 GLY H 1 14 GLY HA2 2.761 . 3.714 2.840 2.825 2.867 . 0 0 "[ . 1 . 2]" 1
268 1 14 GLY H 1 14 GLY HA3 2.669 . 3.559 2.776 2.740 2.795 . 0 0 "[ . 1 . 2]" 1
269 1 14 GLY H 1 15 ILE HA 3.264 . 4.596 4.537 4.502 4.595 . 0 0 "[ . 1 . 2]" 1
270 1 14 GLY H 1 29 TRP HE1 2.562 . 3.382 2.983 2.820 3.240 . 0 0 "[ . 1 . 2]" 1
271 1 14 GLY HA2 1 15 ILE H 2.505 . 3.290 2.906 2.824 2.975 . 0 0 "[ . 1 . 2]" 1
272 1 14 GLY HA2 1 32 THR H 2.847 . 3.860 2.225 1.748 2.461 0.086 18 0 "[ . 1 . 2]" 1
273 1 14 GLY HA2 1 32 THR MG 2.673 . 3.566 1.966 1.848 2.388 . 0 0 "[ . 1 . 2]" 1
274 1 14 GLY HA3 1 15 ILE H 2.349 . 3.039 2.248 2.176 2.319 . 0 0 "[ . 1 . 2]" 1
275 1 14 GLY HA3 1 29 TRP HE1 2.831 . 3.833 3.660 3.487 3.833 0.000 16 0 "[ . 1 . 2]" 1
276 1 14 GLY HA3 1 32 THR MG 3.291 . 4.645 3.365 3.236 3.669 . 0 0 "[ . 1 . 2]" 1
277 1 15 ILE H 1 15 ILE HA 2.841 . 3.850 2.942 2.938 2.947 . 0 0 "[ . 1 . 2]" 1
278 1 15 ILE H 1 15 ILE HB 2.506 . 3.291 2.513 2.486 2.544 . 0 0 "[ . 1 . 2]" 1
279 1 15 ILE H 1 15 ILE MD 2.816 . 3.808 2.860 2.734 2.924 . 0 0 "[ . 1 . 2]" 1
280 1 15 ILE H 1 15 ILE HG12 3.188 . 4.459 4.553 4.501 4.578 0.119 16 0 "[ . 1 . 2]" 1
281 1 15 ILE H 1 15 ILE HG13 3.128 . 4.351 4.287 4.201 4.336 . 0 0 "[ . 1 . 2]" 1
282 1 15 ILE H 1 15 ILE MG 2.816 . 3.808 3.666 3.620 3.732 . 0 0 "[ . 1 . 2]" 1
283 1 15 ILE H 1 29 TRP HE1 3.208 . 4.495 4.436 4.336 4.515 0.020 14 0 "[ . 1 . 2]" 1
284 1 15 ILE H 1 30 ARG H 2.626 . 3.488 2.857 2.715 3.010 . 0 0 "[ . 1 . 2]" 1
285 1 15 ILE HA 1 15 ILE HB 2.567 . 3.391 3.001 2.990 3.012 . 0 0 "[ . 1 . 2]" 1
286 1 15 ILE HA 1 15 ILE MD 2.137 . 2.708 2.676 2.613 2.747 0.039 4 0 "[ . 1 . 2]" 1
287 1 15 ILE HA 1 15 ILE HG12 2.738 . 3.675 3.614 3.600 3.632 . 0 0 "[ . 1 . 2]" 1
288 1 15 ILE HA 1 15 ILE HG13 2.842 . 3.851 2.358 2.334 2.384 . 0 0 "[ . 1 . 2]" 1
289 1 15 ILE HA 1 15 ILE MG 2.137 . 2.708 2.644 2.582 2.677 . 0 0 "[ . 1 . 2]" 1
290 1 15 ILE HA 1 16 ILE H 2.334 . 3.015 2.229 2.204 2.254 . 0 0 "[ . 1 . 2]" 1
291 1 15 ILE HB 1 15 ILE MD 1.981 . 2.471 2.352 2.329 2.378 . 0 0 "[ . 1 . 2]" 1
292 1 15 ILE HB 1 15 ILE HG12 2.427 . 3.163 2.504 2.488 2.517 . 0 0 "[ . 1 . 2]" 1
293 1 15 ILE HB 1 15 ILE HG13 2.375 . 3.080 3.024 3.020 3.026 . 0 0 "[ . 1 . 2]" 1
294 1 15 ILE HB 1 15 ILE MG 1.928 . 2.393 2.121 2.116 2.127 . 0 0 "[ . 1 . 2]" 1
295 1 15 ILE HB 1 30 ARG H 2.913 . 3.974 3.947 3.841 4.050 0.076 20 0 "[ . 1 . 2]" 1
296 1 15 ILE MD 1 15 ILE HG12 2.110 . 2.666 2.105 2.102 2.113 . 0 0 "[ . 1 . 2]" 1
297 1 15 ILE MD 1 15 ILE HG13 2.057 . 2.586 2.109 2.106 2.112 . 0 0 "[ . 1 . 2]" 1
298 1 15 ILE MD 1 30 ARG QG 3.052 . 4.216 4.080 3.795 4.259 0.043 1 0 "[ . 1 . 2]" 1
299 1 15 ILE MD 1 32 THR HA 2.337 . 3.020 3.141 3.062 3.303 0.283 4 0 "[ . 1 . 2]" 1
300 1 15 ILE MD 1 32 THR HB 3.168 . 4.422 4.237 2.397 4.523 0.101 5 0 "[ . 1 . 2]" 1
301 1 15 ILE MD 1 32 THR MG 2.610 . 3.461 2.773 2.222 3.557 0.096 4 0 "[ . 1 . 2]" 1
302 1 15 ILE HG12 1 15 ILE MG 2.110 . 2.666 2.220 2.200 2.243 . 0 0 "[ . 1 . 2]" 1
303 1 15 ILE HG12 1 16 ILE H 3.550 . 5.125 4.866 4.821 4.944 . 0 0 "[ . 1 . 2]" 1
304 1 15 ILE HG13 1 15 ILE MG 2.057 . 2.586 2.502 2.471 2.535 . 0 0 "[ . 1 . 2]" 1
305 1 15 ILE HG13 1 16 ILE H 3.574 . 5.171 3.786 3.726 3.901 . 0 0 "[ . 1 . 2]" 1
306 1 15 ILE MG 1 16 ILE H 2.366 . 3.066 2.324 2.296 2.354 . 0 0 "[ . 1 . 2]" 1
307 1 15 ILE MG 1 17 ALA MB 2.282 . 2.933 2.300 2.192 2.434 . 0 0 "[ . 1 . 2]" 1
308 1 15 ILE MG 1 30 ARG H 3.086 . 4.277 3.881 3.817 3.943 . 0 0 "[ . 1 . 2]" 1
309 1 15 ILE MG 1 30 ARG QG 2.493 . 3.270 3.235 3.163 3.297 0.027 17 0 "[ . 1 . 2]" 1
310 1 16 ILE H 1 16 ILE HA 2.640 . 3.511 2.929 2.924 2.934 . 0 0 "[ . 1 . 2]" 1
311 1 16 ILE H 1 16 ILE HB 2.578 . 3.409 2.320 2.285 2.354 . 0 0 "[ . 1 . 2]" 1
312 1 16 ILE H 1 16 ILE MD 3.439 . 4.917 4.406 4.349 4.461 . 0 0 "[ . 1 . 2]" 1
313 1 16 ILE H 1 16 ILE HG13 2.945 . 4.029 4.029 3.991 4.072 0.043 1 0 "[ . 1 . 2]" 1
314 1 16 ILE H 1 16 ILE MG 2.435 . 3.176 2.978 2.939 3.019 . 0 0 "[ . 1 . 2]" 1
315 1 16 ILE H 1 17 ALA H 3.358 . 4.768 4.474 4.430 4.495 . 0 0 "[ . 1 . 2]" 1
316 1 16 ILE HA 1 16 ILE HB 2.540 . 3.346 2.803 2.785 2.819 . 0 0 "[ . 1 . 2]" 1
317 1 16 ILE HA 1 16 ILE MD 2.892 . 3.937 3.704 3.681 3.721 . 0 0 "[ . 1 . 2]" 1
318 1 16 ILE HA 1 16 ILE HG12 2.210 . 2.820 2.425 2.341 2.480 . 0 0 "[ . 1 . 2]" 1
319 1 16 ILE HA 1 16 ILE HG13 2.477 . 3.244 2.453 2.416 2.489 . 0 0 "[ . 1 . 2]" 1
320 1 16 ILE HA 1 16 ILE MG 2.273 . 2.919 3.020 3.005 3.035 0.116 1 0 "[ . 1 . 2]" 1
321 1 16 ILE HA 1 17 ALA H 2.227 . 2.847 2.247 2.200 2.267 . 0 0 "[ . 1 . 2]" 1
322 1 16 ILE HA 1 29 TRP HA 2.263 . 2.903 2.047 1.953 2.151 . 0 0 "[ . 1 . 2]" 1
323 1 16 ILE HA 1 29 TRP HB3 3.247 . 4.565 4.633 4.582 4.906 0.341 14 0 "[ . 1 . 2]" 1
324 1 16 ILE HA 1 29 TRP HD1 2.967 . 4.067 3.272 3.197 3.416 . 0 0 "[ . 1 . 2]" 1
325 1 16 ILE HA 1 30 ARG H 3.167 . 4.421 3.481 3.336 3.587 . 0 0 "[ . 1 . 2]" 1
326 1 16 ILE HB 1 16 ILE MD 2.252 . 2.886 2.470 2.425 2.509 . 0 0 "[ . 1 . 2]" 1
327 1 16 ILE HB 1 16 ILE HG12 2.607 . 3.456 3.011 3.007 3.013 . 0 0 "[ . 1 . 2]" 1
328 1 16 ILE HB 1 16 ILE HG13 1.989 . 2.483 2.406 2.374 2.425 . 0 0 "[ . 1 . 2]" 1
329 1 16 ILE HB 1 16 ILE MG 1.981 . 2.471 2.117 2.115 2.120 . 0 0 "[ . 1 . 2]" 1
330 1 16 ILE HB 1 17 ALA H 3.136 . 4.365 4.427 4.407 4.447 0.082 14 0 "[ . 1 . 2]" 1
331 1 16 ILE HB 1 29 TRP HA 3.154 . 4.397 4.455 4.323 4.522 0.125 9 0 "[ . 1 . 2]" 1
332 1 16 ILE HB 1 29 TRP HD1 2.651 . 3.529 3.131 2.989 3.326 . 0 0 "[ . 1 . 2]" 1
333 1 16 ILE MD 1 16 ILE HG12 1.999 . 2.499 2.120 2.114 2.125 . 0 0 "[ . 1 . 2]" 1
334 1 16 ILE MD 1 16 ILE HG13 2.192 . 2.793 2.116 2.109 2.123 . 0 0 "[ . 1 . 2]" 1
335 1 16 ILE MD 1 16 ILE MG 1.999 . 2.499 1.769 1.690 1.854 . 0 0 "[ . 1 . 2]" 1
336 1 16 ILE MD 1 18 ILE MD 3.240 . 4.552 3.376 3.253 3.552 . 0 0 "[ . 1 . 2]" 1
337 1 16 ILE MD 1 27 LEU QD 2.343 . 3.029 1.789 1.723 1.871 . 0 0 "[ . 1 . 2]" 1
338 1 16 ILE MD 1 27 LEU HG 3.242 . 4.556 3.412 3.280 3.614 . 0 0 "[ . 1 . 2]" 1
339 1 16 ILE MD 1 29 TRP HB3 3.411 . 4.865 4.821 4.642 5.163 0.298 14 0 "[ . 1 . 2]" 1
340 1 16 ILE MD 1 29 TRP HD1 2.906 . 3.961 3.295 3.210 3.387 . 0 0 "[ . 1 . 2]" 1
341 1 16 ILE MD 1 60 LEU QD 3.240 . 4.552 4.245 4.079 4.366 . 0 0 "[ . 1 . 2]" 1
342 1 16 ILE MD 1 89 PHE QB 2.888 . 3.930 2.159 2.019 2.342 . 0 0 "[ . 1 . 2]" 1
343 1 16 ILE MD 1 91 PHE HE2 2.874 . 3.907 3.716 3.462 4.027 0.120 18 0 "[ . 1 . 2]" 1
344 1 16 ILE MD 1 91 PHE HZ 2.577 . 3.407 2.324 2.142 2.450 . 0 0 "[ . 1 . 2]" 1
345 1 16 ILE MD 1 100 ILE MG 2.322 . 2.996 2.610 2.488 2.761 . 0 0 "[ . 1 . 2]" 1
346 1 16 ILE HG12 1 17 ALA H 2.553 . 3.368 3.044 2.924 3.182 . 0 0 "[ . 1 . 2]" 1
347 1 16 ILE HG12 1 27 LEU QD 2.299 . 2.506 2.216 2.125 2.330 . 0 0 "[ . 1 . 2]" 1
348 1 16 ILE HG12 1 29 TRP HA 2.878 . 3.914 3.484 3.165 3.626 . 0 0 "[ . 1 . 2]" 1
349 1 16 ILE HG12 1 29 TRP HD1 2.719 . 3.643 3.714 3.664 3.734 0.091 5 0 "[ . 1 . 2]" 1
350 1 16 ILE HG13 1 16 ILE MG 2.382 . 3.091 3.168 3.160 3.176 0.085 6 0 "[ . 1 . 2]" 1
351 1 16 ILE HG13 1 17 ALA H 3.004 . 4.132 4.131 4.034 4.158 0.026 9 0 "[ . 1 . 2]" 1
352 1 16 ILE HG13 1 27 LEU QD 2.687 . 3.589 3.138 3.043 3.262 . 0 0 "[ . 1 . 2]" 1
353 1 16 ILE HG13 1 29 TRP HA 3.088 . 4.280 3.145 2.980 3.270 . 0 0 "[ . 1 . 2]" 1
354 1 16 ILE HG13 1 29 TRP HD1 2.654 . 3.535 2.020 1.948 2.065 . 0 0 "[ . 1 . 2]" 1
355 1 16 ILE MG 1 17 ALA H 2.553 . 3.368 2.997 2.913 3.078 . 0 0 "[ . 1 . 2]" 1
356 1 16 ILE MG 1 17 ALA HA 2.628 . 3.492 3.414 3.369 3.466 . 0 0 "[ . 1 . 2]" 1
357 1 16 ILE MG 1 27 LEU QD 2.020 . 2.530 2.552 2.440 2.588 0.058 17 0 "[ . 1 . 2]" 1
358 1 16 ILE MG 1 27 LEU HG 2.448 . 3.197 3.296 3.150 4.784 1.587 20 1 "[ . 1 . +]" 1
359 1 16 ILE MG 1 100 ILE MD 2.040 . 2.560 2.028 1.974 2.108 . 0 0 "[ . 1 . 2]" 1
360 1 16 ILE MG 1 100 ILE HG12 2.827 . 3.826 3.838 3.758 3.900 0.074 3 0 "[ . 1 . 2]" 1
361 1 16 ILE MG 1 100 ILE HG13 2.432 . 3.172 2.615 2.507 2.714 . 0 0 "[ . 1 . 2]" 1
362 1 17 ALA H 1 17 ALA HA 2.756 . 3.705 2.933 2.927 2.942 . 0 0 "[ . 1 . 2]" 1
363 1 17 ALA H 1 17 ALA MB 2.511 . 3.299 2.589 2.568 2.605 . 0 0 "[ . 1 . 2]" 1
364 1 17 ALA H 1 18 ILE H 3.461 . 4.958 4.040 3.946 4.227 . 0 0 "[ . 1 . 2]" 1
365 1 17 ALA H 1 18 ILE MD 2.553 . 3.368 3.444 3.405 3.474 0.106 6 0 "[ . 1 . 2]" 1
366 1 17 ALA H 1 27 LEU QD 3.429 . 4.899 3.700 3.152 3.849 . 0 0 "[ . 1 . 2]" 1
367 1 17 ALA H 1 28 THR H 2.841 . 3.850 2.547 2.362 2.788 . 0 0 "[ . 1 . 2]" 1
368 1 17 ALA H 1 28 THR HB 3.458 . 4.953 3.395 3.194 3.624 . 0 0 "[ . 1 . 2]" 1
369 1 17 ALA H 1 29 TRP HA 2.876 . 3.910 3.314 3.204 3.460 . 0 0 "[ . 1 . 2]" 1
370 1 17 ALA HA 1 17 ALA MB 1.954 . 2.431 2.126 2.124 2.128 . 0 0 "[ . 1 . 2]" 1
371 1 17 ALA HA 1 18 ILE H 2.266 . 2.908 2.155 2.136 2.179 . 0 0 "[ . 1 . 2]" 1
372 1 17 ALA HA 1 100 ILE MD 3.397 . 4.839 4.051 3.958 4.118 . 0 0 "[ . 1 . 2]" 1
373 1 17 ALA MB 1 18 ILE H 2.660 . 3.544 3.335 3.172 3.421 . 0 0 "[ . 1 . 2]" 1
374 1 17 ALA MB 1 18 ILE HA 3.544 . 5.114 4.293 4.251 4.318 . 0 0 "[ . 1 . 2]" 1
375 1 17 ALA MB 1 28 THR H 2.814 . 3.804 3.328 3.072 3.516 . 0 0 "[ . 1 . 2]" 1
376 1 17 ALA MB 1 28 THR HB 2.522 . 3.317 2.247 2.142 2.372 . 0 0 "[ . 1 . 2]" 1
377 1 17 ALA MB 1 28 THR MG 2.507 . 3.293 3.517 3.455 3.571 0.278 15 0 "[ . 1 . 2]" 1
378 1 18 ILE H 1 18 ILE HB 2.587 . 3.423 2.489 2.448 2.539 . 0 0 "[ . 1 . 2]" 1
379 1 18 ILE H 1 18 ILE MD 2.671 . 3.563 2.025 1.912 2.183 . 0 0 "[ . 1 . 2]" 1
380 1 18 ILE H 1 18 ILE HG13 2.902 . 3.955 3.666 3.551 3.874 . 0 0 "[ . 1 . 2]" 1
381 1 18 ILE H 1 18 ILE MG 2.949 . 4.036 3.780 3.749 3.803 . 0 0 "[ . 1 . 2]" 1
382 1 18 ILE H 1 19 ASN H 3.646 . 5.308 4.444 4.358 4.492 . 0 0 "[ . 1 . 2]" 1
383 1 18 ILE HA 1 18 ILE HB 2.980 . 4.090 3.023 3.009 3.032 . 0 0 "[ . 1 . 2]" 1
384 1 18 ILE HA 1 18 ILE MD 2.426 . 3.162 2.979 2.826 3.112 . 0 0 "[ . 1 . 2]" 1
385 1 18 ILE HA 1 18 ILE HG12 3.028 . 4.174 3.601 3.541 3.676 . 0 0 "[ . 1 . 2]" 1
386 1 18 ILE HA 1 18 ILE HG13 2.840 . 3.849 2.343 2.255 2.451 . 0 0 "[ . 1 . 2]" 1
387 1 18 ILE HA 1 18 ILE MG 2.312 . 2.980 2.448 2.382 2.510 . 0 0 "[ . 1 . 2]" 1
388 1 18 ILE HA 1 19 ASN H 2.278 . 2.926 2.091 1.997 2.143 . 0 0 "[ . 1 . 2]" 1
389 1 18 ILE HA 1 27 LEU HA 2.308 . 2.974 1.972 1.922 2.120 . 0 0 "[ . 1 . 2]" 1
390 1 18 ILE HA 1 27 LEU HB2 3.181 . 4.446 3.539 3.272 3.843 . 0 0 "[ . 1 . 2]" 1
391 1 18 ILE HA 1 28 THR H 2.944 . 4.028 3.079 2.880 3.263 . 0 0 "[ . 1 . 2]" 1
392 1 18 ILE HB 1 18 ILE MD 2.236 . 2.861 2.397 2.329 2.448 . 0 0 "[ . 1 . 2]" 1
393 1 18 ILE HB 1 18 ILE HG12 2.527 . 3.325 2.544 2.514 2.582 . 0 0 "[ . 1 . 2]" 1
394 1 18 ILE HB 1 18 ILE HG13 2.797 . 3.775 3.012 3.002 3.025 . 0 0 "[ . 1 . 2]" 1
395 1 18 ILE HB 1 18 ILE MG 2.199 . 2.804 2.123 2.117 2.130 . 0 0 "[ . 1 . 2]" 1
396 1 18 ILE HB 1 19 ASN H 3.506 . 5.042 4.210 4.146 4.268 . 0 0 "[ . 1 . 2]" 1
397 1 18 ILE HB 1 103 THR MG 2.955 . 4.046 2.382 2.077 2.815 . 0 0 "[ . 1 . 2]" 1
398 1 18 ILE HB 1 107 ILE MD 2.801 . 3.782 3.878 3.789 3.969 0.187 18 0 "[ . 1 . 2]" 1
399 1 18 ILE MD 1 18 ILE HG13 1.995 . 2.493 2.110 2.091 2.118 . 0 0 "[ . 1 . 2]" 1
400 1 18 ILE MD 1 27 LEU HA 2.606 . 3.455 3.385 3.243 3.503 0.048 15 0 "[ . 1 . 2]" 1
401 1 18 ILE MD 1 27 LEU HB2 2.705 . 3.620 3.088 3.016 3.360 . 0 0 "[ . 1 . 2]" 1
402 1 18 ILE MD 1 27 LEU HB3 3.076 . 4.259 4.394 4.316 4.630 0.371 20 0 "[ . 1 . 2]" 1
403 1 18 ILE MD 1 27 LEU QD 1.970 . 2.455 1.855 1.697 1.968 . 0 0 "[ . 1 . 2]" 1
404 1 18 ILE MD 1 27 LEU HG 2.825 . 3.823 3.035 2.858 3.857 0.034 20 0 "[ . 1 . 2]" 1
405 1 18 ILE MD 1 100 ILE HA 2.441 . 3.186 3.362 3.199 3.477 0.291 18 0 "[ . 1 . 2]" 1
406 1 18 ILE MD 1 100 ILE MD 2.052 . 2.578 2.329 2.179 2.438 . 0 0 "[ . 1 . 2]" 1
407 1 18 ILE MD 1 103 THR HB 2.529 . 3.329 3.373 3.261 3.482 0.153 10 0 "[ . 1 . 2]" 1
408 1 18 ILE MD 1 104 LEU HG 2.351 . 3.042 3.127 2.521 3.326 0.284 14 0 "[ . 1 . 2]" 1
409 1 18 ILE HG12 1 18 ILE MG 1.742 . 2.122 2.177 2.151 2.207 0.085 6 0 "[ . 1 . 2]" 1
410 1 18 ILE HG12 1 27 LEU QD 2.640 . 3.511 3.131 2.987 3.479 . 0 0 "[ . 1 . 2]" 1
411 1 18 ILE HG12 1 107 ILE MD 2.658 . 3.541 3.524 3.371 3.607 0.066 5 0 "[ . 1 . 2]" 1
412 1 18 ILE HG13 1 18 ILE MG 2.338 . 3.021 2.485 2.417 2.537 . 0 0 "[ . 1 . 2]" 1
413 1 18 ILE HG13 1 19 ASN H 3.320 . 4.698 4.113 3.824 4.319 . 0 0 "[ . 1 . 2]" 1
414 1 18 ILE HG13 1 27 LEU QD 2.544 . 3.353 2.551 2.386 2.791 . 0 0 "[ . 1 . 2]" 1
415 1 18 ILE MG 1 19 ASN H 2.610 . 3.462 2.624 2.538 2.735 . 0 0 "[ . 1 . 2]" 1
416 1 18 ILE MG 1 19 ASN HA 2.783 . 3.751 3.764 3.643 3.828 0.077 5 0 "[ . 1 . 2]" 1
417 1 18 ILE MG 1 20 GLU H 3.633 . 5.283 4.177 3.913 4.549 . 0 0 "[ . 1 . 2]" 1
418 1 18 ILE MG 1 20 GLU HG2 2.769 . 3.728 3.435 3.125 3.733 0.005 16 0 "[ . 1 . 2]" 1
419 1 18 ILE MG 1 20 GLU HG3 2.682 . 3.581 2.855 2.579 3.174 . 0 0 "[ . 1 . 2]" 1
420 1 18 ILE MG 1 27 LEU HA 2.581 . 3.414 3.374 3.248 3.481 0.067 13 0 "[ . 1 . 2]" 1
421 1 18 ILE MG 1 27 LEU HB2 2.629 . 3.493 3.542 3.514 3.613 0.120 20 0 "[ . 1 . 2]" 1
422 1 18 ILE MG 1 104 LEU HA 2.696 . 3.605 3.690 3.562 3.771 0.166 1 0 "[ . 1 . 2]" 1
423 1 19 ASN H 1 19 ASN HA 2.684 . 3.585 2.937 2.874 2.955 . 0 0 "[ . 1 . 2]" 1
424 1 19 ASN H 1 19 ASN HB2 2.769 . 3.727 2.777 2.250 2.987 . 0 0 "[ . 1 . 2]" 1
425 1 19 ASN H 1 19 ASN HB3 2.707 . 3.623 2.740 2.499 3.625 0.002 19 0 "[ . 1 . 2]" 1
426 1 19 ASN H 1 26 GLU H 3.117 . 4.331 3.079 2.904 3.223 . 0 0 "[ . 1 . 2]" 1
427 1 19 ASN HA 1 19 ASN HB2 2.371 . 3.074 2.589 2.466 3.020 . 0 0 "[ . 1 . 2]" 1
428 1 19 ASN HA 1 19 ASN HB3 2.493 . 3.270 2.953 2.534 3.029 . 0 0 "[ . 1 . 2]" 1
429 1 19 ASN HA 1 20 GLU H 2.189 . 2.788 2.199 2.096 2.259 . 0 0 "[ . 1 . 2]" 1
430 1 19 ASN HA 1 20 GLU HA 3.077 . 4.260 4.349 4.308 4.370 0.110 3 0 "[ . 1 . 2]" 1
431 1 19 ASN HB2 1 19 ASN HD21 3.066 . 4.241 2.719 2.221 2.944 . 0 0 "[ . 1 . 2]" 1
432 1 19 ASN HB2 1 20 GLU H 3.293 . 4.648 4.289 3.814 4.497 . 0 0 "[ . 1 . 2]" 1
433 1 19 ASN HB2 1 22 VAL MG2 3.100 . 4.301 4.136 2.584 4.437 0.136 4 0 "[ . 1 . 2]" 1
434 1 19 ASN HB2 1 26 GLU H 3.292 . 4.646 4.288 1.868 4.785 0.139 10 0 "[ . 1 . 2]" 1
435 1 19 ASN HB3 1 20 GLU H 3.504 . 5.038 3.957 2.582 4.326 . 0 0 "[ . 1 . 2]" 1
436 1 19 ASN HB3 1 22 VAL MG2 2.808 . 3.793 2.873 1.909 3.144 . 0 0 "[ . 1 . 2]" 1
437 1 19 ASN HB3 1 26 GLU H 3.120 . 4.337 3.137 2.336 3.860 . 0 0 "[ . 1 . 2]" 1
438 1 19 ASN HD21 1 22 VAL MG1 2.995 . 4.116 3.146 2.302 4.141 0.025 18 0 "[ . 1 . 2]" 1
439 1 19 ASN HD22 1 22 VAL MG1 2.937 . 4.015 2.887 1.836 4.144 0.129 12 0 "[ . 1 . 2]" 1
440 1 20 GLU H 1 20 GLU HA 2.795 . 3.771 2.921 2.864 2.946 . 0 0 "[ . 1 . 2]" 1
441 1 20 GLU H 1 20 GLU HB2 2.943 . 4.026 2.675 2.452 2.849 . 0 0 "[ . 1 . 2]" 1
442 1 20 GLU H 1 20 GLU HB3 2.695 . 3.603 3.729 3.616 3.802 0.199 3 0 "[ . 1 . 2]" 1
443 1 20 GLU H 1 20 GLU HG2 2.939 . 4.019 3.859 3.553 4.260 0.241 12 0 "[ . 1 . 2]" 1
444 1 20 GLU H 1 20 GLU HG3 3.029 . 4.176 2.704 2.365 3.251 . 0 0 "[ . 1 . 2]" 1
445 1 20 GLU H 1 21 ASP H 2.408 . 3.133 3.296 3.183 3.587 0.454 20 0 "[ . 1 . 2]" 1
446 1 20 GLU H 1 21 ASP HA 3.614 . 5.247 5.015 4.808 5.527 0.280 20 0 "[ . 1 . 2]" 1
447 1 20 GLU H 1 22 VAL H 3.255 . 4.579 4.509 3.463 4.755 0.176 11 0 "[ . 1 . 2]" 1
448 1 20 GLU H 1 22 VAL MG2 3.464 . 4.964 4.361 2.774 4.787 . 0 0 "[ . 1 . 2]" 1
449 1 20 GLU HA 1 20 GLU HB2 2.549 . 3.361 3.016 2.986 3.030 . 0 0 "[ . 1 . 2]" 1
450 1 20 GLU HA 1 20 GLU HB3 2.620 . 3.478 2.424 2.343 2.570 . 0 0 "[ . 1 . 2]" 1
451 1 20 GLU HA 1 20 GLU HG2 2.550 . 3.363 2.717 2.313 2.922 . 0 0 "[ . 1 . 2]" 1
452 1 20 GLU HA 1 20 GLU HG3 2.681 . 3.580 3.113 2.619 3.329 . 0 0 "[ . 1 . 2]" 1
453 1 20 GLU HA 1 21 ASP H 2.785 . 3.754 2.673 2.469 3.249 . 0 0 "[ . 1 . 2]" 1
454 1 20 GLU HA 1 22 VAL H 2.826 . 3.824 3.060 2.740 3.907 0.083 16 0 "[ . 1 . 2]" 1
455 1 20 GLU HA 1 22 VAL MG2 2.863 . 3.888 3.317 2.993 3.834 . 0 0 "[ . 1 . 2]" 1
456 1 20 GLU HA 1 25 ALA HA 2.420 . 3.152 2.896 2.765 3.174 0.022 12 0 "[ . 1 . 2]" 1
457 1 20 GLU HA 1 25 ALA MB 2.241 . 2.869 2.936 2.388 3.167 0.298 7 0 "[ . 1 . 2]" 1
458 1 20 GLU HA 1 26 GLU H 3.360 . 4.771 4.083 3.919 4.445 . 0 0 "[ . 1 . 2]" 1
459 1 20 GLU HB2 1 20 GLU HG2 2.263 . 2.903 2.992 2.939 3.012 0.109 20 0 "[ . 1 . 2]" 1
460 1 20 GLU HB2 1 20 GLU HG3 2.323 . 2.998 2.484 2.378 2.566 . 0 0 "[ . 1 . 2]" 1
461 1 20 GLU HB2 1 21 ASP H 3.579 . 5.180 3.826 2.270 4.333 . 0 0 "[ . 1 . 2]" 1
462 1 20 GLU HB2 1 25 ALA MB 3.103 . 4.306 4.385 4.081 5.024 0.718 15 5 "[ . 1 * +* -*]" 1
463 1 20 GLU HB3 1 20 GLU HG2 1.984 . 2.476 2.382 2.297 2.514 0.038 19 0 "[ . 1 . 2]" 1
464 1 20 GLU HB3 1 20 GLU HG3 2.511 . 3.299 2.994 2.965 3.002 . 0 0 "[ . 1 . 2]" 1
465 1 20 GLU HB3 1 21 ASP H 3.089 . 4.282 3.729 1.830 4.436 0.154 1 0 "[ . 1 . 2]" 1
466 1 20 GLU HG2 1 25 ALA MB 2.653 . 3.533 2.210 1.751 3.820 0.287 12 0 "[ . 1 . 2]" 1
467 1 20 GLU HG2 1 107 ILE MD 2.800 . 3.780 2.773 2.442 3.316 . 0 0 "[ . 1 . 2]" 1
468 1 20 GLU HG3 1 25 ALA MB 2.924 . 3.993 3.169 2.671 4.118 0.125 16 0 "[ . 1 . 2]" 1
469 1 20 GLU HG3 1 107 ILE MD 2.794 . 3.770 3.234 2.866 3.869 0.099 16 0 "[ . 1 . 2]" 1
470 1 21 ASP H 1 21 ASP HA 2.539 . 3.345 2.873 2.584 2.950 . 0 0 "[ . 1 . 2]" 1
471 1 21 ASP H 1 21 ASP HB2 2.403 . 3.125 2.703 2.152 2.999 . 0 0 "[ . 1 . 2]" 1
472 1 21 ASP H 1 21 ASP HB3 2.544 . 3.353 2.835 2.452 3.570 0.217 1 0 "[ . 1 . 2]" 1
473 1 21 ASP H 1 22 VAL H 2.174 . 2.765 2.110 1.742 3.218 0.453 19 0 "[ . 1 . 2]" 1
474 1 21 ASP H 1 22 VAL MG1 3.046 . 4.206 3.454 3.022 4.215 0.009 19 0 "[ . 1 . 2]" 1
475 1 21 ASP H 1 22 VAL MG2 2.910 . 3.969 2.955 2.427 4.381 0.412 15 0 "[ . 1 . 2]" 1
476 1 21 ASP HA 1 21 ASP HB2 2.406 . 3.130 2.629 2.433 3.011 . 0 0 "[ . 1 . 2]" 1
477 1 21 ASP HA 1 21 ASP HB3 2.202 . 2.808 2.900 2.558 3.034 0.226 4 0 "[ . 1 . 2]" 1
478 1 21 ASP HA 1 22 VAL H 2.574 . 3.402 3.188 2.842 3.313 . 0 0 "[ . 1 . 2]" 1
479 1 21 ASP HB2 1 22 VAL H 2.751 . 3.697 3.933 3.275 4.043 0.346 10 0 "[ . 1 . 2]" 1
480 1 21 ASP HB2 1 22 VAL MG1 3.263 . 4.594 3.927 2.613 4.314 . 0 0 "[ . 1 . 2]" 1
481 1 21 ASP HB3 1 22 VAL H 2.876 . 3.910 3.381 3.029 4.104 0.194 16 0 "[ . 1 . 2]" 1
482 1 21 ASP HB3 1 22 VAL MG1 3.135 . 4.364 2.958 2.287 4.594 0.230 19 0 "[ . 1 . 2]" 1
483 1 22 VAL H 1 22 VAL HA 2.428 . 3.165 2.913 2.908 2.918 . 0 0 "[ . 1 . 2]" 1
484 1 22 VAL H 1 22 VAL HB 2.706 . 3.621 3.647 3.633 3.661 0.040 9 0 "[ . 1 . 2]" 1
485 1 22 VAL H 1 22 VAL MG1 2.246 . 2.877 2.677 2.340 2.873 . 0 0 "[ . 1 . 2]" 1
486 1 22 VAL H 1 22 VAL MG2 2.108 . 2.663 1.952 1.885 2.027 . 0 0 "[ . 1 . 2]" 1
487 1 22 VAL H 1 23 SER H 3.004 . 4.132 4.316 4.304 4.341 0.209 15 0 "[ . 1 . 2]" 1
488 1 22 VAL H 1 25 ALA HA 3.106 . 4.312 4.235 4.041 4.322 0.010 5 0 "[ . 1 . 2]" 1
489 1 22 VAL HA 1 22 VAL HB 2.071 . 2.607 2.504 2.447 2.553 . 0 0 "[ . 1 . 2]" 1
490 1 22 VAL HA 1 22 VAL MG1 1.945 . 2.418 2.320 2.239 2.445 0.027 12 0 "[ . 1 . 2]" 1
491 1 22 VAL HA 1 22 VAL MG2 2.401 . 3.122 3.211 3.199 3.236 0.114 16 0 "[ . 1 . 2]" 1
492 1 22 VAL HB 1 22 VAL MG1 1.788 . 2.188 2.124 2.114 2.129 . 0 0 "[ . 1 . 2]" 1
493 1 22 VAL HB 1 22 VAL MG2 1.961 . 2.442 2.135 2.126 2.150 . 0 0 "[ . 1 . 2]" 1
494 1 22 VAL HB 1 23 SER H 2.236 . 2.861 1.840 1.766 2.037 . 0 0 "[ . 1 . 2]" 1
495 1 22 VAL MG1 1 22 VAL MG2 1.503 . 1.785 2.037 2.017 2.047 0.262 18 0 "[ . 1 . 2]" 1
496 1 22 VAL MG2 1 23 SER H 2.498 . 3.278 2.938 2.559 3.148 . 0 0 "[ . 1 . 2]" 1
497 1 22 VAL MG2 1 25 ALA H 3.306 . 4.672 4.458 4.258 4.550 . 0 0 "[ . 1 . 2]" 1
498 1 22 VAL MG2 1 25 ALA HA 2.264 . 2.905 2.919 2.842 3.028 0.123 20 0 "[ . 1 . 2]" 1
499 1 22 VAL MG2 1 25 ALA MB 3.211 . 4.500 4.111 3.966 4.181 . 0 0 "[ . 1 . 2]" 1
500 1 22 VAL MG2 1 26 GLU H 2.594 . 3.435 3.089 2.914 3.276 . 0 0 "[ . 1 . 2]" 1
501 1 22 VAL MG2 1 26 GLU HB2 2.877 . 3.912 3.865 3.443 4.191 0.279 19 0 "[ . 1 . 2]" 1
502 1 22 VAL MG2 1 26 GLU HB3 3.089 . 4.282 4.449 4.341 4.727 0.445 15 0 "[ . 1 . 2]" 1
503 1 22 VAL MG2 1 26 GLU HG2 2.052 . 2.578 3.010 2.631 3.488 0.910 20 9 "[- *. ** * * ** +]" 1
504 1 22 VAL MG2 1 26 GLU HG3 2.536 . 3.340 2.151 1.995 2.437 . 0 0 "[ . 1 . 2]" 1
505 1 23 SER H 1 23 SER HA 2.606 . 3.455 2.861 2.855 2.865 . 0 0 "[ . 1 . 2]" 1
506 1 23 SER H 1 23 SER HB2 2.453 . 3.205 2.932 2.202 3.558 0.353 2 0 "[ . 1 . 2]" 1
507 1 23 SER HA 1 23 SER HB2 2.253 . 2.888 2.795 2.525 3.025 0.137 14 0 "[ . 1 . 2]" 1
508 1 23 SER HA 1 23 SER HB3 2.190 . 2.790 2.484 2.397 3.024 0.234 12 0 "[ . 1 . 2]" 1
509 1 24 PRO HA 1 24 PRO HB2 2.449 . 3.198 2.957 2.947 2.977 . 0 0 "[ . 1 . 2]" 1
510 1 24 PRO HA 1 24 PRO HB3 2.400 . 3.120 2.279 2.263 2.306 . 0 0 "[ . 1 . 2]" 1
511 1 24 PRO HA 1 24 PRO HD2 3.151 . 4.392 3.905 3.885 3.917 . 0 0 "[ . 1 . 2]" 1
512 1 24 PRO HA 1 24 PRO HD3 3.248 . 4.567 3.192 3.090 3.325 . 0 0 "[ . 1 . 2]" 1
513 1 24 PRO HA 1 24 PRO HG2 2.721 . 3.646 3.867 3.828 3.884 0.238 9 0 "[ . 1 . 2]" 1
514 1 24 PRO HA 1 41 VAL QG 3.139 . 4.371 4.186 3.955 4.308 . 0 0 "[ . 1 . 2]" 1
515 1 24 PRO HB2 1 24 PRO HD2 2.905 . 3.960 3.442 3.194 3.530 . 0 0 "[ . 1 . 2]" 1
516 1 24 PRO HB2 1 24 PRO HG2 1.962 . 2.443 2.244 2.231 2.283 . 0 0 "[ . 1 . 2]" 1
517 1 24 PRO HB2 1 41 VAL QG 2.092 . 2.639 1.951 1.734 2.131 . 0 0 "[ . 1 . 2]" 1
518 1 24 PRO HB2 1 43 SER H 3.282 . 4.629 2.740 2.361 3.574 . 0 0 "[ . 1 . 2]" 1
519 1 24 PRO HB2 1 43 SER HB2 3.084 . 4.273 2.497 2.022 4.016 . 0 0 "[ . 1 . 2]" 1
520 1 24 PRO HB2 1 43 SER HB3 3.448 . 4.934 3.227 2.522 4.324 . 0 0 "[ . 1 . 2]" 1
521 1 24 PRO HB3 1 24 PRO HD2 2.993 . 4.113 4.074 4.018 4.094 . 0 0 "[ . 1 . 2]" 1
522 1 24 PRO HB3 1 24 PRO HD3 3.206 . 4.490 3.783 3.709 3.945 . 0 0 "[ . 1 . 2]" 1
523 1 24 PRO HB3 1 24 PRO HG2 2.222 . 2.839 2.741 2.670 2.766 . 0 0 "[ . 1 . 2]" 1
524 1 24 PRO HB3 1 25 ALA H 2.824 . 3.821 3.424 3.377 3.457 . 0 0 "[ . 1 . 2]" 1
525 1 24 PRO HB3 1 41 VAL QG 2.593 . 3.434 3.397 2.896 3.518 0.084 18 0 "[ . 1 . 2]" 1
526 1 24 PRO HB3 1 43 SER H 3.202 . 4.483 3.464 2.687 3.849 . 0 0 "[ . 1 . 2]" 1
527 1 24 PRO HB3 1 111 TYR QE 3.532 2.832 4.232 3.428 2.898 4.631 0.399 2 0 "[ . 1 . 2]" 1
528 1 24 PRO HD2 1 24 PRO HG2 2.279 . 2.928 2.241 2.231 2.264 . 0 0 "[ . 1 . 2]" 1
529 1 24 PRO HD2 1 24 PRO HG3 2.297 . 2.957 2.869 2.841 2.935 . 0 0 "[ . 1 . 2]" 1
530 1 24 PRO HD2 1 41 VAL QG 2.749 . 3.694 3.610 3.167 3.723 0.029 6 0 "[ . 1 . 2]" 1
531 1 24 PRO HD3 1 24 PRO HG2 2.483 . 3.254 2.854 2.791 2.881 . 0 0 "[ . 1 . 2]" 1
532 1 24 PRO HD3 1 24 PRO HG3 2.452 . 3.204 2.262 2.258 2.272 . 0 0 "[ . 1 . 2]" 1
533 1 24 PRO HG2 1 41 VAL QG 2.232 . 2.855 2.956 2.899 3.008 0.153 7 0 "[ . 1 . 2]" 1
534 1 25 ALA H 1 25 ALA HA 2.689 . 3.593 2.666 2.598 2.694 . 0 0 "[ . 1 . 2]" 1
535 1 25 ALA H 1 25 ALA MB 2.289 . 2.944 2.191 2.144 2.215 . 0 0 "[ . 1 . 2]" 1
536 1 25 ALA H 1 107 ILE MG 3.165 . 4.417 3.496 3.194 3.960 . 0 0 "[ . 1 . 2]" 1
537 1 25 ALA H 1 111 TYR HE2 3.321 . 4.699 3.758 2.982 4.960 0.261 2 0 "[ . 1 . 2]" 1
538 1 25 ALA HA 1 25 ALA MB 2.057 . 2.586 2.120 2.110 2.129 . 0 0 "[ . 1 . 2]" 1
539 1 25 ALA HA 1 26 GLU H 2.170 . 2.759 2.160 2.118 2.198 . 0 0 "[ . 1 . 2]" 1
540 1 25 ALA MB 1 26 GLU H 2.465 . 3.225 2.981 2.820 3.117 . 0 0 "[ . 1 . 2]" 1
541 1 25 ALA MB 1 26 GLU HA 3.315 . 4.689 4.107 4.037 4.242 . 0 0 "[ . 1 . 2]" 1
542 1 25 ALA MB 1 42 LEU QB 2.826 . 3.042 2.792 2.666 2.904 . 0 0 "[ . 1 . 2]" 1
543 1 25 ALA MB 1 42 LEU QD 2.346 . 3.034 2.196 1.795 3.054 0.020 16 0 "[ . 1 . 2]" 1
544 1 25 ALA MB 1 42 LEU HG 2.856 . 3.875 3.570 2.633 4.170 0.295 7 0 "[ . 1 . 2]" 1
545 1 25 ALA MB 1 107 ILE MD 2.298 . 2.958 2.083 1.939 2.473 . 0 0 "[ . 1 . 2]" 1
546 1 25 ALA MB 1 107 ILE HG13 3.082 . 4.269 4.439 4.308 4.800 0.531 10 2 "[ . -+ . 2]" 1
547 1 25 ALA MB 1 107 ILE MG 2.120 . 2.682 1.761 1.681 1.871 . 0 0 "[ . 1 . 2]" 1
548 1 25 ALA MB 1 111 TYR HE2 2.649 . 3.526 3.125 2.167 3.773 0.247 2 0 "[ . 1 . 2]" 1
549 1 26 GLU H 1 26 GLU HA 2.907 . 3.963 2.934 2.930 2.939 . 0 0 "[ . 1 . 2]" 1
550 1 26 GLU H 1 26 GLU HB2 2.666 . 3.554 3.110 2.747 3.379 . 0 0 "[ . 1 . 2]" 1
551 1 26 GLU H 1 26 GLU HB3 2.749 . 3.694 3.725 3.651 3.791 0.097 14 0 "[ . 1 . 2]" 1
552 1 26 GLU H 1 26 GLU HG2 3.090 . 4.283 3.096 2.698 3.741 . 0 0 "[ . 1 . 2]" 1
553 1 26 GLU H 1 26 GLU HG3 3.061 . 4.233 2.128 1.873 2.447 0.016 16 0 "[ . 1 . 2]" 1
554 1 26 GLU H 1 27 LEU H 3.767 . 5.541 4.423 4.367 4.451 . 0 0 "[ . 1 . 2]" 1
555 1 26 GLU HA 1 26 GLU HB2 2.368 . 3.069 2.921 2.828 2.996 . 0 0 "[ . 1 . 2]" 1
556 1 26 GLU HA 1 26 GLU HB3 2.527 . 3.325 2.273 2.238 2.352 . 0 0 "[ . 1 . 2]" 1
557 1 26 GLU HA 1 26 GLU HG2 2.592 . 3.432 3.103 2.832 3.391 . 0 0 "[ . 1 . 2]" 1
558 1 26 GLU HA 1 26 GLU HG3 2.869 . 3.898 3.485 3.196 3.681 . 0 0 "[ . 1 . 2]" 1
559 1 26 GLU HA 1 27 LEU H 2.255 . 2.891 2.201 2.158 2.233 . 0 0 "[ . 1 . 2]" 1
560 1 26 GLU HA 1 40 VAL H 3.505 . 5.040 4.394 4.117 4.636 . 0 0 "[ . 1 . 2]" 1
561 1 26 GLU HA 1 41 VAL HA 2.293 . 2.950 1.927 1.786 2.292 . 0 0 "[ . 1 . 2]" 1
562 1 26 GLU HA 1 41 VAL QG 2.994 . 4.115 3.760 3.573 3.845 . 0 0 "[ . 1 . 2]" 1
563 1 26 GLU HA 1 42 LEU H 2.828 . 3.828 2.420 2.241 2.580 . 0 0 "[ . 1 . 2]" 1
564 1 26 GLU HA 1 42 LEU QD 2.768 . 3.726 3.144 2.250 3.609 . 0 0 "[ . 1 . 2]" 1
565 1 26 GLU HB2 1 26 GLU HG2 2.374 . 3.078 2.998 2.977 3.009 . 0 0 "[ . 1 . 2]" 1
566 1 26 GLU HB2 1 26 GLU HG3 2.469 . 3.231 2.482 2.414 2.586 . 0 0 "[ . 1 . 2]" 1
567 1 26 GLU HB2 1 27 LEU H 2.664 . 3.551 3.395 3.100 3.645 0.094 12 0 "[ . 1 . 2]" 1
568 1 26 GLU HB2 1 39 THR MG 2.862 . 3.886 2.066 1.830 2.607 0.008 9 0 "[ . 1 . 2]" 1
569 1 26 GLU HB2 1 41 VAL HA 3.077 . 4.261 3.765 3.561 4.361 0.100 4 0 "[ . 1 . 2]" 1
570 1 26 GLU HB3 1 26 GLU HG2 2.656 . 3.538 2.386 2.290 2.459 . 0 0 "[ . 1 . 2]" 1
571 1 26 GLU HB3 1 26 GLU HG3 2.709 . 3.626 2.991 2.959 3.007 . 0 0 "[ . 1 . 2]" 1
572 1 26 GLU HB3 1 27 LEU H 2.669 . 3.559 3.134 2.814 3.453 . 0 0 "[ . 1 . 2]" 1
573 1 26 GLU HB3 1 39 THR MG 2.326 . 3.002 2.366 1.888 2.761 . 0 0 "[ . 1 . 2]" 1
574 1 26 GLU HB3 1 41 VAL QG 2.604 . 3.451 3.446 3.362 3.565 0.114 10 0 "[ . 1 . 2]" 1
575 1 26 GLU HG2 1 41 VAL HA 2.599 . 3.443 2.780 2.099 3.517 0.074 19 0 "[ . 1 . 2]" 1
576 1 26 GLU HG3 1 41 VAL HA 3.006 . 4.135 3.997 3.572 4.441 0.306 19 0 "[ . 1 . 2]" 1
577 1 27 LEU H 1 27 LEU HB2 2.631 . 3.496 3.129 3.081 3.199 . 0 0 "[ . 1 . 2]" 1
578 1 27 LEU H 1 27 LEU HB3 2.583 . 3.417 2.296 2.211 2.343 . 0 0 "[ . 1 . 2]" 1
579 1 27 LEU H 1 27 LEU QD 3.607 . 5.233 3.474 3.443 3.506 . 0 0 "[ . 1 . 2]" 1
580 1 27 LEU H 1 28 THR H 3.254 . 4.577 4.403 4.274 4.430 . 0 0 "[ . 1 . 2]" 1
581 1 27 LEU H 1 39 THR MG 3.163 . 4.413 3.558 3.270 3.694 . 0 0 "[ . 1 . 2]" 1
582 1 27 LEU H 1 40 VAL H 3.028 . 4.174 2.718 2.477 2.930 . 0 0 "[ . 1 . 2]" 1
583 1 27 LEU H 1 41 VAL HA 3.389 . 4.824 3.478 3.352 3.855 . 0 0 "[ . 1 . 2]" 1
584 1 27 LEU HA 1 27 LEU HB2 2.403 . 3.125 2.321 2.303 2.339 . 0 0 "[ . 1 . 2]" 1
585 1 27 LEU HA 1 27 LEU HB3 2.770 . 3.729 2.986 2.978 2.994 . 0 0 "[ . 1 . 2]" 1
586 1 27 LEU HA 1 27 LEU QD 2.592 . 3.432 3.152 2.386 3.208 . 0 0 "[ . 1 . 2]" 1
587 1 27 LEU HA 1 28 THR H 2.233 . 2.857 2.142 2.094 2.163 . 0 0 "[ . 1 . 2]" 1
588 1 27 LEU HA 1 28 THR HA 3.195 . 4.471 4.346 4.325 4.367 . 0 0 "[ . 1 . 2]" 1
589 1 27 LEU HB2 1 27 LEU QD 2.455 . 3.180 2.083 2.041 2.304 . 0 0 "[ . 1 . 2]" 1
590 1 27 LEU HB2 1 40 VAL H 3.827 . 5.658 4.859 4.660 5.026 . 0 0 "[ . 1 . 2]" 1
591 1 27 LEU HB3 1 27 LEU QD 2.523 . 3.318 2.081 2.041 2.415 . 0 0 "[ . 1 . 2]" 1
592 1 27 LEU HB3 1 27 LEU HG 2.402 . 3.123 2.947 2.379 2.984 . 0 0 "[ . 1 . 2]" 1
593 1 27 LEU HB3 1 28 THR H 3.333 . 4.722 4.301 4.269 4.482 . 0 0 "[ . 1 . 2]" 1
594 1 27 LEU HB3 1 40 VAL H 3.869 . 5.740 3.468 3.255 3.676 . 0 0 "[ . 1 . 2]" 1
595 1 27 LEU HB3 1 40 VAL HB 2.439 . 3.182 2.105 1.888 2.176 . 0 0 "[ . 1 . 2]" 1
596 1 27 LEU MD1 1 27 LEU MD2 2.007 . 2.510 2.067 2.011 2.079 . 0 0 "[ . 1 . 2]" 1
597 1 27 LEU QD 1 28 THR H 2.984 . 4.097 3.280 2.665 3.386 . 0 0 "[ . 1 . 2]" 1
598 1 27 LEU QD 1 28 THR HA 2.801 . 3.781 3.204 3.125 3.267 . 0 0 "[ . 1 . 2]" 1
599 1 27 LEU QD 1 28 THR HB 3.473 . 4.981 4.909 4.489 4.961 . 0 0 "[ . 1 . 2]" 1
600 1 27 LEU QD 1 29 TRP H 3.458 . 4.952 2.903 2.795 3.037 . 0 0 "[ . 1 . 2]" 1
601 1 27 LEU QD 1 29 TRP HB2 3.233 . 4.540 3.123 2.982 3.307 . 0 0 "[ . 1 . 2]" 1
602 1 27 LEU QD 1 29 TRP HB3 3.066 . 4.241 3.922 3.774 4.117 . 0 0 "[ . 1 . 2]" 1
603 1 27 LEU QD 1 38 HIS HB2 3.142 . 4.376 4.419 4.350 4.546 0.170 18 0 "[ . 1 . 2]" 1
604 1 27 LEU QD 1 39 THR HA 3.102 . 4.305 3.724 3.552 4.019 . 0 0 "[ . 1 . 2]" 1
605 1 27 LEU QD 1 40 VAL H 3.528 . 5.083 2.952 2.746 3.179 . 0 0 "[ . 1 . 2]" 1
606 1 27 LEU QD 1 40 VAL HB 2.731 . 3.663 2.051 1.980 2.144 . 0 0 "[ . 1 . 2]" 1
607 1 27 LEU QD 1 40 VAL MG1 2.153 . 2.733 2.818 2.751 2.871 0.138 1 0 "[ . 1 . 2]" 1
608 1 27 LEU QD 1 40 VAL MG2 . . 2.932 2.294 1.896 2.375 . 0 0 "[ . 1 . 2]" 1
609 1 27 LEU QD 1 62 LEU QD 2.696 . 2.916 1.952 1.679 2.174 0.109 1 0 "[ . 1 . 2]" 1
610 1 27 LEU QD 1 89 PHE HZ 3.515 . 5.059 2.759 2.597 2.915 . 0 0 "[ . 1 . 2]" 1
611 1 27 LEU QD 1 104 LEU HG 3.123 . 4.342 2.699 2.233 3.373 . 0 0 "[ . 1 . 2]" 1
612 1 27 LEU HG 1 28 THR H 2.733 . 3.667 2.776 2.602 5.125 1.458 20 1 "[ . 1 . +]" 1
613 1 28 THR H 1 28 THR HA 2.860 . 3.882 2.945 2.941 2.948 . 0 0 "[ . 1 . 2]" 1
614 1 28 THR H 1 28 THR HB 2.653 . 3.533 2.712 2.647 2.751 . 0 0 "[ . 1 . 2]" 1
615 1 28 THR H 1 28 THR MG 3.079 . 4.264 3.862 3.836 3.884 . 0 0 "[ . 1 . 2]" 1
616 1 28 THR H 1 29 TRP H 3.202 . 4.483 4.090 4.066 4.122 . 0 0 "[ . 1 . 2]" 1
617 1 28 THR HA 1 28 THR HB 2.327 . 3.004 3.002 2.997 3.014 0.010 20 0 "[ . 1 . 2]" 1
618 1 28 THR HA 1 28 THR MG 2.164 . 2.749 2.304 2.279 2.349 . 0 0 "[ . 1 . 2]" 1
619 1 28 THR HA 1 29 TRP H 2.326 . 3.002 2.233 2.205 2.259 . 0 0 "[ . 1 . 2]" 1
620 1 28 THR HA 1 39 THR HA 1.960 . 2.440 2.173 2.113 2.229 . 0 0 "[ . 1 . 2]" 1
621 1 28 THR HA 1 39 THR MG 2.449 . 3.199 2.966 2.702 3.218 0.019 20 0 "[ . 1 . 2]" 1
622 1 28 THR HA 1 40 VAL H 3.162 . 4.412 3.333 3.064 3.447 . 0 0 "[ . 1 . 2]" 1
623 1 28 THR HB 1 28 THR MG 1.944 . 2.417 2.130 2.124 2.134 . 0 0 "[ . 1 . 2]" 1
624 1 28 THR HB 1 29 TRP H 3.148 . 4.386 4.303 4.280 4.338 . 0 0 "[ . 1 . 2]" 1
625 1 28 THR HB 1 39 THR HA 3.928 2.856 5.000 4.799 4.546 4.940 . 0 0 "[ . 1 . 2]" 1
626 1 28 THR HB 1 39 THR MG 3.008 . 4.139 3.938 3.810 4.062 . 0 0 "[ . 1 . 2]" 1
627 1 28 THR MG 1 29 TRP H 2.846 . 3.859 3.287 3.253 3.328 . 0 0 "[ . 1 . 2]" 1
628 1 28 THR MG 1 30 ARG H 3.484 . 5.001 4.144 3.827 4.378 . 0 0 "[ . 1 . 2]" 1
629 1 28 THR MG 1 30 ARG QB 2.936 . 4.013 2.932 2.422 3.505 . 0 0 "[ . 1 . 2]" 1
630 1 28 THR MG 1 37 VAL QG 2.118 . 2.679 1.962 1.804 2.835 0.156 20 0 "[ . 1 . 2]" 1
631 1 28 THR MG 1 38 HIS H 3.428 . 4.897 3.122 2.752 3.403 . 0 0 "[ . 1 . 2]" 1
632 1 28 THR MG 1 39 THR HA 2.505 . 3.290 3.009 2.770 3.202 . 0 0 "[ . 1 . 2]" 1
633 1 28 THR MG 1 39 THR HB 3.043 . 4.200 4.301 4.239 4.356 0.156 16 0 "[ . 1 . 2]" 1
634 1 28 THR MG 1 39 THR MG 1.955 . 2.433 2.528 2.496 2.571 0.138 20 0 "[ . 1 . 2]" 1
635 1 29 TRP H 1 29 TRP HB2 2.902 . 3.954 2.848 2.734 2.882 . 0 0 "[ . 1 . 2]" 1
636 1 29 TRP H 1 29 TRP HB3 2.818 . 3.810 2.587 2.542 2.635 . 0 0 "[ . 1 . 2]" 1
637 1 29 TRP H 1 38 HIS H 2.947 . 4.032 3.118 2.933 3.317 . 0 0 "[ . 1 . 2]" 1
638 1 29 TRP H 1 38 HIS HD2 3.600 . 5.220 4.716 4.446 4.931 . 0 0 "[ . 1 . 2]" 1
639 1 29 TRP H 1 39 THR HA 2.824 . 3.821 3.661 3.423 3.865 0.044 20 0 "[ . 1 . 2]" 1
640 1 29 TRP HA 1 29 TRP HB2 2.835 . 3.840 2.464 2.448 2.513 . 0 0 "[ . 1 . 2]" 1
641 1 29 TRP HA 1 29 TRP HB3 2.596 . 3.438 3.036 3.024 3.041 . 0 0 "[ . 1 . 2]" 1
642 1 29 TRP HA 1 29 TRP HD1 3.065 . 4.239 3.262 3.031 3.347 . 0 0 "[ . 1 . 2]" 1
643 1 29 TRP HA 1 30 ARG H 2.274 . 2.920 2.112 2.074 2.162 . 0 0 "[ . 1 . 2]" 1
644 1 29 TRP HB2 1 29 TRP HD1 3.323 . 4.703 2.618 2.592 2.728 . 0 0 "[ . 1 . 2]" 1
645 1 29 TRP HB2 1 30 ARG H 3.279 . 4.623 4.240 4.168 4.347 . 0 0 "[ . 1 . 2]" 1
646 1 29 TRP HB3 1 29 TRP HD1 2.940 . 4.021 3.776 3.755 3.842 . 0 0 "[ . 1 . 2]" 1
647 1 29 TRP HB3 1 30 ARG H 3.126 . 4.348 4.211 4.121 4.271 . 0 0 "[ . 1 . 2]" 1
648 1 29 TRP HB3 1 38 HIS H 2.973 . 4.078 3.601 2.933 3.951 . 0 0 "[ . 1 . 2]" 1
649 1 29 TRP HB3 1 38 HIS HD2 3.430 . 4.901 2.756 2.489 3.029 . 0 0 "[ . 1 . 2]" 1
650 1 29 TRP HH2 1 31 SER HA 2.655 . 3.536 2.908 2.741 3.057 . 0 0 "[ . 1 . 2]" 1
651 1 29 TRP HZ2 1 31 SER HA 3.042 . 4.199 3.142 3.016 3.230 . 0 0 "[ . 1 . 2]" 1
652 1 29 TRP HZ2 1 31 SER HB2 3.067 . 4.242 4.396 4.292 4.504 0.262 12 0 "[ . 1 . 2]" 1
653 1 29 TRP HZ2 1 31 SER HB3 3.098 . 4.298 4.262 4.037 4.348 0.050 16 0 "[ . 1 . 2]" 1
654 1 30 ARG H 1 30 ARG QB 2.810 . 3.586 3.069 2.834 3.201 . 0 0 "[ . 1 . 2]" 1
655 1 30 ARG H 1 30 ARG QG 2.793 . 3.704 2.114 1.925 2.275 . 0 0 "[ . 1 . 2]" 1
656 1 30 ARG HA 1 30 ARG QB 2.505 . 3.289 2.139 2.122 2.157 . 0 0 "[ . 1 . 2]" 1
657 1 30 ARG HA 1 30 ARG HD2 3.399 . 4.843 4.671 4.511 4.840 . 0 0 "[ . 1 . 2]" 1
658 1 30 ARG HA 1 30 ARG HD3 3.238 . 4.549 4.571 4.233 4.820 0.271 2 0 "[ . 1 . 2]" 1
659 1 30 ARG HA 1 30 ARG QG 2.511 . 3.299 3.236 3.145 3.313 0.014 11 0 "[ . 1 . 2]" 1
660 1 30 ARG HA 1 31 SER H 2.172 . 2.762 2.115 1.992 2.180 . 0 0 "[ . 1 . 2]" 1
661 1 30 ARG HA 1 37 VAL HA 2.155 . 2.735 2.159 2.008 2.293 . 0 0 "[ . 1 . 2]" 1
662 1 30 ARG HA 1 37 VAL QG 2.238 . 2.864 2.836 2.652 2.929 0.065 13 0 "[ . 1 . 2]" 1
663 1 30 ARG HA 1 38 HIS H 3.058 . 4.227 3.512 3.290 3.734 . 0 0 "[ . 1 . 2]" 1
664 1 30 ARG QB 1 30 ARG HD2 2.290 . 2.595 2.268 2.119 2.485 . 0 0 "[ . 1 . 2]" 1
665 1 30 ARG QB 1 30 ARG HD3 2.863 . 2.897 2.371 2.100 2.499 . 0 0 "[ . 1 . 2]" 1
666 1 30 ARG QB 1 30 ARG QG 2.137 . 2.708 2.017 1.976 2.056 . 0 0 "[ . 1 . 2]" 1
667 1 30 ARG QB 1 31 SER H 2.820 . 3.814 3.045 2.840 3.202 . 0 0 "[ . 1 . 2]" 1
668 1 30 ARG QB 1 37 VAL HA 3.046 . 4.197 2.637 2.366 2.928 . 0 0 "[ . 1 . 2]" 1
669 1 30 ARG QB 1 37 VAL QG 2.360 . 3.056 1.657 1.597 1.713 0.082 18 0 "[ . 1 . 2]" 1
670 1 30 ARG HD2 1 30 ARG QG 2.186 . 2.784 2.350 2.254 2.397 . 0 0 "[ . 1 . 2]" 1
671 1 30 ARG HD2 1 37 VAL QG 2.860 . 3.883 3.130 2.360 3.917 0.034 2 0 "[ . 1 . 2]" 1
672 1 30 ARG HD3 1 30 ARG QG 2.297 . 2.847 2.321 2.263 2.414 . 0 0 "[ . 1 . 2]" 1
673 1 30 ARG HD3 1 37 VAL QG 2.874 . 3.907 3.070 2.750 3.407 . 0 0 "[ . 1 . 2]" 1
674 1 30 ARG QG 1 37 VAL HA 3.397 . 4.829 4.311 3.960 4.485 . 0 0 "[ . 1 . 2]" 1
675 1 30 ARG QG 1 37 VAL QG 2.432 . 3.171 3.101 2.871 3.213 0.042 8 0 "[ . 1 . 2]" 1
676 1 31 SER H 1 31 SER HA 2.907 . 3.963 2.803 2.775 2.838 . 0 0 "[ . 1 . 2]" 1
677 1 31 SER H 1 31 SER HB2 2.615 . 3.470 3.537 3.506 3.566 0.096 17 0 "[ . 1 . 2]" 1
678 1 31 SER H 1 31 SER HB3 2.649 . 3.526 2.400 2.324 2.478 . 0 0 "[ . 1 . 2]" 1
679 1 31 SER H 1 36 LYS H 3.660 . 5.335 3.276 2.198 3.629 . 0 0 "[ . 1 . 2]" 1
680 1 31 SER H 1 36 LYS QB 3.341 . 4.259 2.769 2.481 3.065 . 0 0 "[ . 1 . 2]" 1
681 1 31 SER H 1 37 VAL HA 2.871 . 3.901 3.713 3.429 3.935 0.034 5 0 "[ . 1 . 2]" 1
682 1 31 SER H 1 37 VAL QG 3.218 . 4.513 3.643 3.342 3.987 . 0 0 "[ . 1 . 2]" 1
683 1 31 SER HA 1 31 SER HB2 2.390 . 3.104 2.407 2.371 2.434 . 0 0 "[ . 1 . 2]" 1
684 1 31 SER HA 1 31 SER HB3 2.454 . 3.207 2.489 2.463 2.528 . 0 0 "[ . 1 . 2]" 1
685 1 31 SER HA 1 32 THR H 2.099 . 2.650 2.337 2.180 2.460 . 0 0 "[ . 1 . 2]" 1
686 1 31 SER HB2 1 32 THR H 2.732 . 3.665 2.724 2.477 2.970 . 0 0 "[ . 1 . 2]" 1
687 1 31 SER HB2 1 33 ASP H 3.008 . 4.139 3.089 2.254 3.385 . 0 0 "[ . 1 . 2]" 1
688 1 31 SER HB2 1 36 LYS QB 3.021 . 4.161 3.342 3.156 3.642 . 0 0 "[ . 1 . 2]" 1
689 1 31 SER HB2 1 36 LYS HD3 3.184 . 4.452 4.385 4.116 4.798 0.346 12 0 "[ . 1 . 2]" 1
690 1 31 SER HB3 1 33 ASP H 3.300 . 4.661 4.503 3.799 4.730 0.069 16 0 "[ . 1 . 2]" 1
691 1 31 SER HB3 1 36 LYS QB 2.814 . 3.804 2.047 1.859 2.287 0.029 7 0 "[ . 1 . 2]" 1
692 1 31 SER HB3 1 36 LYS HD3 2.820 . 3.814 3.141 2.947 3.448 . 0 0 "[ . 1 . 2]" 1
693 1 32 THR H 1 32 THR HA 2.394 . 3.110 2.793 2.753 2.879 . 0 0 "[ . 1 . 2]" 1
694 1 32 THR H 1 32 THR MG 2.871 . 3.902 2.251 1.864 2.457 . 0 0 "[ . 1 . 2]" 1
695 1 32 THR H 1 33 ASP H 2.732 . 3.665 2.693 2.215 2.857 . 0 0 "[ . 1 . 2]" 1
696 1 32 THR HA 1 32 THR HB 1.956 . 2.434 2.503 2.400 2.546 0.112 11 0 "[ . 1 . 2]" 1
697 1 32 THR HA 1 32 THR MG 2.285 . 2.938 2.362 2.222 3.188 0.250 4 0 "[ . 1 . 2]" 1
698 1 32 THR HA 1 34 GLY H 3.323 . 4.704 3.959 3.359 4.206 . 0 0 "[ . 1 . 2]" 1
699 1 32 THR HB 1 32 THR MG 2.009 . 2.514 2.130 2.113 2.135 . 0 0 "[ . 1 . 2]" 1
700 1 32 THR HB 1 33 ASP H 2.950 . 4.038 3.822 3.648 4.196 0.158 4 0 "[ . 1 . 2]" 1
701 1 32 THR MG 1 33 ASP H 3.115 . 4.328 3.949 2.743 4.210 . 0 0 "[ . 1 . 2]" 1
702 1 32 THR MG 1 33 ASP HA 3.734 . 5.477 5.250 3.301 5.504 0.027 15 0 "[ . 1 . 2]" 1
703 1 33 ASP H 1 33 ASP HA 2.489 . 3.263 2.853 2.805 2.901 . 0 0 "[ . 1 . 2]" 1
704 1 33 ASP H 1 33 ASP HB2 2.535 . 3.338 2.590 2.173 3.537 0.199 3 0 "[ . 1 . 2]" 1
705 1 33 ASP H 1 33 ASP HB3 2.595 . 3.437 2.865 2.394 3.562 0.125 2 0 "[ . 1 . 2]" 1
706 1 33 ASP H 1 34 GLY H 2.623 . 3.483 2.525 2.281 2.922 . 0 0 "[ . 1 . 2]" 1
707 1 33 ASP HA 1 33 ASP HB2 2.342 . 3.028 2.654 2.405 3.028 0.000 17 0 "[ . 1 . 2]" 1
708 1 33 ASP HA 1 33 ASP HB3 2.327 . 3.004 2.817 2.344 3.028 0.024 9 0 "[ . 1 . 2]" 1
709 1 33 ASP HA 1 34 GLY H 2.658 . 3.541 3.423 3.025 3.488 . 0 0 "[ . 1 . 2]" 1
710 1 33 ASP HB2 1 34 GLY H 3.151 . 4.392 3.752 2.816 4.450 0.058 18 0 "[ . 1 . 2]" 1
711 1 33 ASP HB3 1 34 GLY H 3.030 . 4.177 3.396 2.846 4.296 0.119 3 0 "[ . 1 . 2]" 1
712 1 34 GLY H 1 34 GLY HA2 2.375 . 3.080 2.372 2.345 2.444 . 0 0 "[ . 1 . 2]" 1
713 1 34 GLY H 1 34 GLY HA3 2.313 . 2.982 2.930 2.915 2.952 . 0 0 "[ . 1 . 2]" 1
714 1 34 GLY H 1 35 ASP H 2.381 . 3.090 2.290 2.055 2.445 . 0 0 "[ . 1 . 2]" 1
715 1 34 GLY H 1 35 ASP HB3 3.177 . 4.439 4.509 4.314 5.007 0.568 18 2 "[ -. 1 . + 2]" 1
716 1 34 GLY H 1 36 LYS H 3.649 . 5.313 3.973 3.577 4.563 . 0 0 "[ . 1 . 2]" 1
717 1 34 GLY HA2 1 35 ASP H 2.906 . 3.961 3.205 3.080 3.344 . 0 0 "[ . 1 . 2]" 1
718 1 34 GLY HA3 1 35 ASP H 2.894 . 3.941 3.307 3.190 3.421 . 0 0 "[ . 1 . 2]" 1
719 1 35 ASP H 1 35 ASP HA 2.459 . 3.215 2.810 2.238 2.929 . 0 0 "[ . 1 . 2]" 1
720 1 35 ASP H 1 35 ASP HB2 2.459 . 3.215 2.781 2.526 3.171 . 0 0 "[ . 1 . 2]" 1
721 1 35 ASP H 1 35 ASP HB3 2.508 . 3.295 2.525 2.268 3.529 0.234 18 0 "[ . 1 . 2]" 1
722 1 35 ASP H 1 36 LYS H 2.116 . 2.676 2.583 2.360 2.756 0.080 4 0 "[ . 1 . 2]" 1
723 1 35 ASP HA 1 35 ASP HB2 2.115 . 2.674 2.411 2.333 2.491 . 0 0 "[ . 1 . 2]" 1
724 1 35 ASP HA 1 35 ASP HB3 2.199 . 2.803 2.991 2.960 2.999 0.196 15 0 "[ . 1 . 2]" 1
725 1 35 ASP HA 1 37 VAL QG 3.454 . 4.946 4.527 3.304 4.877 . 0 0 "[ . 1 . 2]" 1
726 1 36 LYS H 1 36 LYS HA 2.408 . 3.133 2.882 2.839 2.914 . 0 0 "[ . 1 . 2]" 1
727 1 36 LYS H 1 36 LYS QB 2.807 . 3.409 2.147 2.064 2.255 . 0 0 "[ . 1 . 2]" 1
728 1 36 LYS H 1 36 LYS HG2 3.153 . 4.395 4.431 4.304 4.561 0.166 13 0 "[ . 1 . 2]" 1
729 1 36 LYS H 1 36 LYS HG3 3.026 . 4.171 3.902 3.406 4.515 0.344 7 0 "[ . 1 . 2]" 1
730 1 36 LYS H 1 37 VAL H 3.640 . 5.297 4.433 4.357 4.512 . 0 0 "[ . 1 . 2]" 1
731 1 36 LYS H 1 37 VAL QG 3.474 . 4.983 4.283 4.040 4.511 . 0 0 "[ . 1 . 2]" 1
732 1 36 LYS HA 1 36 LYS QB 2.468 . 3.229 2.466 2.297 2.533 . 0 0 "[ . 1 . 2]" 1
733 1 36 LYS HA 1 36 LYS HG2 2.677 . 3.573 2.853 2.605 3.233 . 0 0 "[ . 1 . 2]" 1
734 1 36 LYS HA 1 36 LYS HG3 2.685 . 3.586 2.468 2.283 2.727 . 0 0 "[ . 1 . 2]" 1
735 1 36 LYS HA 1 37 VAL H 1.967 . 2.451 2.115 2.054 2.180 . 0 0 "[ . 1 . 2]" 1
736 1 36 LYS HA 1 37 VAL QG 3.298 . 4.657 3.941 3.333 4.138 . 0 0 "[ . 1 . 2]" 1
737 1 36 LYS QB 1 36 LYS HD3 1.832 . 2.061 2.202 1.985 2.767 0.706 12 4 "[ .*- 1 + . *]" 1
738 1 36 LYS QB 1 36 LYS QE 3.253 . 4.576 3.286 2.978 3.531 . 0 0 "[ . 1 . 2]" 1
739 1 36 LYS QB 1 36 LYS HG2 2.650 . 3.249 2.257 2.179 2.342 . 0 0 "[ . 1 . 2]" 1
740 1 36 LYS QB 1 36 LYS HG3 2.594 . 3.080 2.356 2.229 2.418 . 0 0 "[ . 1 . 2]" 1
741 1 36 LYS QB 1 37 VAL H 2.852 . 3.869 3.536 3.174 3.805 . 0 0 "[ . 1 . 2]" 1
742 1 36 LYS QB 1 38 HIS HE1 2.896 . 3.945 3.584 3.291 3.924 . 0 0 "[ . 1 . 2]" 1
743 1 36 LYS HD3 1 36 LYS QE 2.092 . 2.639 2.216 2.129 2.329 . 0 0 "[ . 1 . 2]" 1
744 1 36 LYS HD3 1 36 LYS HG2 2.094 . 2.642 2.552 2.243 2.753 0.111 18 0 "[ . 1 . 2]" 1
745 1 36 LYS QE 1 36 LYS HG2 2.521 . 3.316 2.404 2.184 2.873 . 0 0 "[ . 1 . 2]" 1
746 1 36 LYS QE 1 36 LYS HG3 2.663 . 3.550 2.876 2.153 3.268 . 0 0 "[ . 1 . 2]" 1
747 1 36 LYS QE 1 38 HIS HD2 3.272 . 4.610 4.523 4.394 4.602 . 0 0 "[ . 1 . 2]" 1
748 1 36 LYS QE 1 38 HIS HE1 3.310 . 4.680 2.544 2.179 2.896 . 0 0 "[ . 1 . 2]" 1
749 1 36 LYS HG2 1 37 VAL H 3.039 . 4.194 3.552 2.976 3.835 . 0 0 "[ . 1 . 2]" 1
750 1 36 LYS HG2 1 38 HIS HE1 3.052 . 4.216 1.972 1.813 2.358 0.075 18 0 "[ . 1 . 2]" 1
751 1 36 LYS HG3 1 37 VAL H 3.025 . 4.169 3.923 3.170 4.270 0.101 8 0 "[ . 1 . 2]" 1
752 1 36 LYS HG3 1 38 HIS HE1 3.363 . 4.777 3.022 1.947 3.680 0.002 12 0 "[ . 1 . 2]" 1
753 1 37 VAL H 1 37 VAL HA 2.671 . 3.563 2.950 2.935 2.972 . 0 0 "[ . 1 . 2]" 1
754 1 37 VAL H 1 37 VAL HB 2.490 . 3.265 2.766 2.477 3.727 0.462 13 0 "[ . 1 . 2]" 1
755 1 37 VAL H 1 38 HIS H 3.368 . 4.786 4.211 4.041 4.379 . 0 0 "[ . 1 . 2]" 1
756 1 37 VAL HA 1 37 VAL HB 2.438 . 3.181 2.968 2.448 3.035 . 0 0 "[ . 1 . 2]" 1
757 1 37 VAL HA 1 37 VAL QG 2.050 . 2.575 2.174 2.141 2.324 . 0 0 "[ . 1 . 2]" 1
758 1 37 VAL HA 1 38 HIS H 2.261 . 2.900 2.166 2.106 2.244 . 0 0 "[ . 1 . 2]" 1
759 1 37 VAL HA 1 38 HIS HA 3.113 . 4.324 4.407 4.375 4.460 0.136 20 0 "[ . 1 . 2]" 1
760 1 37 VAL HA 1 38 HIS HD2 3.296 . 4.654 4.847 4.803 4.912 0.258 2 0 "[ . 1 . 2]" 1
761 1 37 VAL HB 1 37 VAL QG 1.649 . 1.989 1.884 1.856 1.891 . 0 0 "[ . 1 . 2]" 1
762 1 37 VAL QG 1 38 HIS H 2.589 . 3.427 2.792 2.538 3.333 . 0 0 "[ . 1 . 2]" 1
763 1 38 HIS H 1 38 HIS HA 2.861 . 3.884 2.940 2.911 2.953 . 0 0 "[ . 1 . 2]" 1
764 1 38 HIS H 1 38 HIS HB2 2.719 . 3.643 2.910 2.829 3.046 . 0 0 "[ . 1 . 2]" 1
765 1 38 HIS H 1 39 THR H 3.245 . 4.561 4.260 4.131 4.380 . 0 0 "[ . 1 . 2]" 1
766 1 38 HIS HA 1 38 HIS HB2 2.320 . 2.993 3.009 3.000 3.016 0.023 13 0 "[ . 1 . 2]" 1
767 1 38 HIS HA 1 38 HIS HD2 3.624 . 5.265 4.813 4.771 4.855 . 0 0 "[ . 1 . 2]" 1
768 1 38 HIS HA 1 39 THR H 2.097 . 2.647 2.178 2.141 2.235 . 0 0 "[ . 1 . 2]" 1
769 1 38 HIS HB2 1 38 HIS HD2 3.297 . 4.656 2.670 2.655 2.687 . 0 0 "[ . 1 . 2]" 1
770 1 38 HIS HB2 1 39 THR H 3.210 . 4.498 4.031 3.827 4.147 . 0 0 "[ . 1 . 2]" 1
771 1 38 HIS HB3 1 39 THR H 2.989 . 4.106 3.403 3.151 3.548 . 0 0 "[ . 1 . 2]" 1
772 1 39 THR H 1 39 THR HA 2.685 . 3.586 2.937 2.926 2.945 . 0 0 "[ . 1 . 2]" 1
773 1 39 THR H 1 39 THR HB 2.402 . 3.123 2.893 2.831 2.957 . 0 0 "[ . 1 . 2]" 1
774 1 39 THR H 1 39 THR MG 2.872 . 3.903 3.855 3.800 3.904 0.001 17 0 "[ . 1 . 2]" 1
775 1 39 THR HA 1 39 THR HB 2.462 . 3.220 2.984 2.962 2.995 . 0 0 "[ . 1 . 2]" 1
776 1 39 THR HA 1 39 THR MG 2.172 . 2.761 2.213 2.167 2.236 . 0 0 "[ . 1 . 2]" 1
777 1 39 THR HA 1 40 VAL H 2.508 . 3.295 2.087 2.063 2.137 . 0 0 "[ . 1 . 2]" 1
778 1 39 THR HA 1 40 VAL MG2 3.106 . 4.312 3.783 3.638 3.912 . 0 0 "[ . 1 . 2]" 1
779 1 39 THR HB 1 39 THR MG 1.903 . 2.356 2.134 2.130 2.137 . 0 0 "[ . 1 . 2]" 1
780 1 39 THR HB 1 40 VAL H 3.767 . 5.541 3.972 3.829 4.079 . 0 0 "[ . 1 . 2]" 1
781 1 39 THR MG 1 40 VAL H 2.872 . 3.903 2.755 2.451 2.943 . 0 0 "[ . 1 . 2]" 1
782 1 40 VAL H 1 40 VAL HB 2.951 . 4.040 2.384 2.310 2.497 . 0 0 "[ . 1 . 2]" 1
783 1 40 VAL H 1 40 VAL MG1 3.471 . 4.977 3.713 3.688 3.757 . 0 0 "[ . 1 . 2]" 1
784 1 40 VAL H 1 40 VAL MG2 3.038 . 4.191 2.795 2.584 2.949 . 0 0 "[ . 1 . 2]" 1
785 1 40 VAL H 1 41 VAL H 3.260 . 4.589 4.102 4.033 4.168 . 0 0 "[ . 1 . 2]" 1
786 1 40 VAL HA 1 40 VAL HB 2.824 . 3.821 3.023 3.017 3.029 . 0 0 "[ . 1 . 2]" 1
787 1 40 VAL HA 1 40 VAL MG1 2.116 . 2.676 2.578 2.510 2.621 . 0 0 "[ . 1 . 2]" 1
788 1 40 VAL HA 1 40 VAL MG2 2.214 . 2.827 2.329 2.311 2.370 . 0 0 "[ . 1 . 2]" 1
789 1 40 VAL HA 1 41 VAL H 2.138 . 2.709 2.270 2.246 2.301 . 0 0 "[ . 1 . 2]" 1
790 1 40 VAL HB 1 40 VAL MG1 2.220 . 2.836 2.118 2.115 2.123 . 0 0 "[ . 1 . 2]" 1
791 1 40 VAL HB 1 40 VAL MG2 2.220 . 2.836 2.118 2.110 2.122 . 0 0 "[ . 1 . 2]" 1
792 1 40 VAL HB 1 41 VAL H 3.329 . 4.714 4.529 4.478 4.558 . 0 0 "[ . 1 . 2]" 1
793 1 40 VAL MG1 1 40 VAL MG2 1.903 . 2.356 2.058 2.048 2.067 . 0 0 "[ . 1 . 2]" 1
794 1 40 VAL MG1 1 41 VAL H 2.674 . 3.567 3.414 3.352 3.480 . 0 0 "[ . 1 . 2]" 1
795 1 40 VAL MG1 1 42 LEU HA 2.278 . 2.927 2.966 2.640 3.108 0.181 11 0 "[ . 1 . 2]" 1
796 1 40 VAL MG1 1 42 LEU QD 2.330 . 3.008 2.556 2.125 2.831 . 0 0 "[ . 1 . 2]" 1
797 1 40 VAL MG1 1 45 ILE MD 2.153 . 2.733 1.841 1.753 1.937 . 0 0 "[ . 1 . 2]" 1
798 1 40 VAL MG1 1 45 ILE MG 2.928 . 4.000 3.894 3.731 4.070 0.070 15 0 "[ . 1 . 2]" 1
799 1 40 VAL MG1 1 62 LEU QD 2.390 . 3.104 2.549 2.205 2.690 . 0 0 "[ . 1 . 2]" 1
800 1 40 VAL MG1 1 87 HIS HD2 2.852 . 3.869 3.407 2.990 3.882 0.013 18 0 "[ . 1 . 2]" 1
801 1 40 VAL MG2 1 41 VAL H 3.033 . 4.183 4.208 4.167 4.257 0.074 20 0 "[ . 1 . 2]" 1
802 1 40 VAL MG2 1 45 ILE MD 2.514 . 3.304 3.412 3.369 3.475 0.171 17 0 "[ . 1 . 2]" 1
803 1 40 VAL MG2 1 62 LEU QD 2.916 . 3.714 3.431 3.257 3.472 . 0 0 "[ . 1 . 2]" 1
804 1 40 VAL MG2 1 87 HIS HB2 3.152 . 4.394 3.719 3.307 4.055 . 0 0 "[ . 1 . 2]" 1
805 1 40 VAL MG2 1 87 HIS HB3 2.949 . 4.036 3.894 3.438 4.184 0.148 2 0 "[ . 1 . 2]" 1
806 1 40 VAL MG2 1 87 HIS HD2 3.225 . 4.525 3.481 2.877 4.100 . 0 0 "[ . 1 . 2]" 1
807 1 41 VAL H 1 41 VAL HA 2.666 . 3.554 2.861 2.847 2.876 . 0 0 "[ . 1 . 2]" 1
808 1 41 VAL H 1 41 VAL HB 2.368 . 3.069 3.007 2.568 3.113 0.044 20 0 "[ . 1 . 2]" 1
809 1 41 VAL H 1 41 VAL QG 2.723 . 3.117 1.710 1.654 2.037 0.142 20 0 "[ . 1 . 2]" 1
810 1 41 VAL H 1 44 THR MG 3.154 . 4.398 4.359 4.154 4.471 0.073 15 0 "[ . 1 . 2]" 1
811 1 41 VAL HA 1 41 VAL HB 2.639 . 3.510 2.326 2.242 3.038 . 0 0 "[ . 1 . 2]" 1
812 1 41 VAL HA 1 41 VAL QG 2.207 . 2.816 2.491 2.141 2.559 . 0 0 "[ . 1 . 2]" 1
813 1 41 VAL HA 1 42 LEU H 2.404 . 3.126 2.102 2.060 2.159 . 0 0 "[ . 1 . 2]" 1
814 1 41 VAL HB 1 41 VAL QG . . 2.106 1.890 1.886 1.897 . 0 0 "[ . 1 . 2]" 1
815 1 41 VAL HB 1 42 LEU H 3.326 . 4.709 4.019 3.939 4.244 . 0 0 "[ . 1 . 2]" 1
816 1 41 VAL MG1 1 41 VAL MG2 1.731 . 2.106 2.093 2.086 2.102 . 0 0 "[ . 1 . 2]" 1
817 1 41 VAL QG 1 42 LEU H 3.043 . 3.798 2.838 2.680 3.024 . 0 0 "[ . 1 . 2]" 1
818 1 41 VAL QG 1 43 SER H 2.338 . 3.021 2.093 1.972 2.561 . 0 0 "[ . 1 . 2]" 1
819 1 41 VAL QG 1 44 THR H 2.842 . 3.852 2.763 2.595 3.186 . 0 0 "[ . 1 . 2]" 1
820 1 41 VAL QG 1 44 THR MG 2.141 . 2.714 2.217 2.072 2.664 . 0 0 "[ . 1 . 2]" 1
821 1 42 LEU H 1 42 LEU HA 2.573 . 3.401 2.777 2.682 2.820 . 0 0 "[ . 1 . 2]" 1
822 1 42 LEU H 1 42 LEU QB 2.660 . 3.544 2.191 2.080 2.261 . 0 0 "[ . 1 . 2]" 1
823 1 42 LEU H 1 42 LEU QD 2.984 . 3.955 2.800 1.945 3.233 . 0 0 "[ . 1 . 2]" 1
824 1 42 LEU H 1 42 LEU HG 2.587 . 3.424 2.946 2.385 3.900 0.476 7 0 "[ . 1 . 2]" 1
825 1 42 LEU H 1 43 SER H 2.977 . 4.085 2.786 2.680 3.054 . 0 0 "[ . 1 . 2]" 1
826 1 42 LEU HA 1 42 LEU QB 2.862 . 3.886 2.445 2.417 2.475 . 0 0 "[ . 1 . 2]" 1
827 1 42 LEU HA 1 42 LEU QD 2.228 . 2.709 1.930 1.792 2.066 0.034 14 0 "[ . 1 . 2]" 1
828 1 42 LEU HA 1 42 LEU HG 2.505 . 3.289 3.034 2.713 3.594 0.305 11 0 "[ . 1 . 2]" 1
829 1 42 LEU HA 1 43 SER H 2.667 . 3.556 3.457 3.396 3.556 . 0 0 "[ . 1 . 2]" 1
830 1 42 LEU HA 1 45 ILE H 2.918 . 3.982 3.430 3.217 3.665 . 0 0 "[ . 1 . 2]" 1
831 1 42 LEU HA 1 45 ILE MD 2.954 . 4.045 3.637 3.283 3.871 . 0 0 "[ . 1 . 2]" 1
832 1 42 LEU QB 1 42 LEU QD 2.443 . 3.189 1.951 1.904 2.021 . 0 0 "[ . 1 . 2]" 1
833 1 42 LEU QB 1 43 SER H 3.591 . 5.052 3.022 2.895 3.155 . 0 0 "[ . 1 . 2]" 1
834 1 42 LEU QB 1 107 ILE MG 2.586 . 3.422 2.515 2.017 2.944 . 0 0 "[ . 1 . 2]" 1
835 1 42 LEU QB 1 111 TYR HE2 2.904 . 3.958 1.958 1.696 2.188 0.154 20 0 "[ . 1 . 2]" 1
836 1 42 LEU QD 1 42 LEU HG 2.218 . 2.833 1.886 1.871 1.893 . 0 0 "[ . 1 . 2]" 1
837 1 42 LEU QD 1 43 SER H 3.422 . 4.886 4.224 3.907 4.390 . 0 0 "[ . 1 . 2]" 1
838 1 42 LEU QD 1 44 THR H 3.501 . 5.033 4.687 4.460 4.878 . 0 0 "[ . 1 . 2]" 1
839 1 42 LEU QD 1 45 ILE H 3.164 . 4.415 4.306 4.102 4.502 0.087 7 0 "[ . 1 . 2]" 1
840 1 42 LEU QD 1 104 LEU HA 2.673 . 3.566 2.673 2.377 3.170 . 0 0 "[ . 1 . 2]" 1
841 1 42 LEU QD 1 111 TYR HE2 2.376 . 3.082 3.176 2.797 3.365 0.283 13 0 "[ . 1 . 2]" 1
842 1 43 SER H 1 43 SER HA 2.518 . 3.311 2.820 2.770 2.850 . 0 0 "[ . 1 . 2]" 1
843 1 43 SER H 1 43 SER HB2 2.785 . 3.754 2.576 2.329 3.606 . 0 0 "[ . 1 . 2]" 1
844 1 43 SER H 1 43 SER HB3 2.984 . 4.097 2.866 2.552 3.607 . 0 0 "[ . 1 . 2]" 1
845 1 43 SER H 1 44 THR H 2.712 . 3.631 2.665 2.564 2.889 . 0 0 "[ . 1 . 2]" 1
846 1 43 SER H 1 44 THR MG 3.055 . 4.221 3.981 3.787 4.158 . 0 0 "[ . 1 . 2]" 1
847 1 43 SER HA 1 43 SER HB2 2.429 . 3.167 2.625 2.450 3.027 . 0 0 "[ . 1 . 2]" 1
848 1 43 SER HA 1 43 SER HB3 2.320 . 2.993 2.841 2.403 3.033 0.040 2 0 "[ . 1 . 2]" 1
849 1 43 SER HA 1 44 THR H 3.390 . 4.826 3.395 3.256 3.473 . 0 0 "[ . 1 . 2]" 1
850 1 43 SER HA 1 111 TYR HB2 3.061 . 4.232 3.509 2.704 4.208 . 0 0 "[ . 1 . 2]" 1
851 1 43 SER HA 1 111 TYR HB3 3.184 . 4.451 3.398 2.293 4.389 . 0 0 "[ . 1 . 2]" 1
852 1 43 SER HA 1 111 TYR HD2 2.836 . 3.842 3.034 2.492 3.907 0.065 7 0 "[ . 1 . 2]" 1
853 1 43 SER HA 1 111 TYR HE2 3.049 . 4.211 4.054 3.666 4.285 0.074 6 0 "[ . 1 . 2]" 1
854 1 44 THR H 1 44 THR MG 2.397 . 3.115 2.514 2.401 2.605 . 0 0 "[ . 1 . 2]" 1
855 1 44 THR H 1 45 ILE H 2.611 . 3.463 2.299 2.094 2.395 . 0 0 "[ . 1 . 2]" 1
856 1 44 THR H 1 45 ILE HG13 3.229 . 4.533 4.571 4.534 4.627 0.094 7 0 "[ . 1 . 2]" 1
857 1 44 THR HA 1 44 THR HB 2.040 . 2.560 2.460 2.430 2.487 . 0 0 "[ . 1 . 2]" 1
858 1 44 THR HA 1 44 THR MG 2.116 . 2.676 2.378 2.340 2.424 . 0 0 "[ . 1 . 2]" 1
859 1 44 THR HA 1 45 ILE H 3.098 . 4.298 3.243 3.188 3.321 . 0 0 "[ . 1 . 2]" 1
860 1 44 THR HA 1 65 LYS HD2 2.742 . 3.682 2.536 2.109 3.691 0.009 13 0 "[ . 1 . 2]" 1
861 1 44 THR HA 1 65 LYS HD3 2.949 . 4.036 3.910 3.517 4.063 0.027 16 0 "[ . 1 . 2]" 1
862 1 44 THR HB 1 44 THR MG 1.979 . 2.468 2.133 2.131 2.136 . 0 0 "[ . 1 . 2]" 1
863 1 44 THR MG 1 45 ILE H 3.036 . 4.188 4.170 4.081 4.222 0.034 20 0 "[ . 1 . 2]" 1
864 1 45 ILE H 1 45 ILE HB 2.347 . 3.035 2.518 2.426 2.607 . 0 0 "[ . 1 . 2]" 1
865 1 45 ILE H 1 45 ILE MD 2.803 . 3.785 3.451 3.287 3.589 . 0 0 "[ . 1 . 2]" 1
866 1 45 ILE H 1 45 ILE HG12 2.820 . 3.814 2.218 2.058 2.315 . 0 0 "[ . 1 . 2]" 1
867 1 45 ILE H 1 45 ILE HG13 2.602 . 3.448 3.591 3.498 3.667 0.219 19 0 "[ . 1 . 2]" 1
868 1 45 ILE H 1 45 ILE MG 2.715 . 3.637 3.763 3.738 3.789 0.152 19 0 "[ . 1 . 2]" 1
869 1 45 ILE HA 1 45 ILE MD 2.203 . 2.810 2.190 2.094 2.302 . 0 0 "[ . 1 . 2]" 1
870 1 45 ILE HA 1 45 ILE HG12 3.406 . 4.856 3.026 2.958 3.127 . 0 0 "[ . 1 . 2]" 1
871 1 45 ILE HA 1 45 ILE HG13 4.151 . 6.305 3.779 3.714 3.852 . 0 0 "[ . 1 . 2]" 1
872 1 45 ILE HA 1 45 ILE MG 2.497 . 3.276 2.340 2.295 2.401 . 0 0 "[ . 1 . 2]" 1
873 1 45 ILE HA 1 46 ASP H 2.631 . 3.497 2.211 2.146 2.264 . 0 0 "[ . 1 . 2]" 1
874 1 45 ILE HA 1 64 GLY HA2 2.589 . 3.427 1.821 1.765 1.878 . 0 0 "[ . 1 . 2]" 1
875 1 45 ILE HA 1 64 GLY HA3 2.577 . 3.407 3.523 3.420 3.599 0.192 7 0 "[ . 1 . 2]" 1
876 1 45 ILE HB 1 45 ILE MD 2.780 . 3.746 3.235 3.229 3.246 . 0 0 "[ . 1 . 2]" 1
877 1 45 ILE HB 1 45 ILE HG13 2.621 . 3.480 2.402 2.362 2.421 . 0 0 "[ . 1 . 2]" 1
878 1 45 ILE HB 1 45 ILE MG 2.332 . 3.012 2.122 2.114 2.126 . 0 0 "[ . 1 . 2]" 1
879 1 45 ILE HB 1 108 ILE MG 2.615 . 3.470 3.501 3.260 3.665 0.195 2 0 "[ . 1 . 2]" 1
880 1 45 ILE MD 1 45 ILE HG12 2.456 . 3.210 2.118 2.115 2.120 . 0 0 "[ . 1 . 2]" 1
881 1 45 ILE MD 1 45 ILE HG13 2.282 . 2.933 2.124 2.123 2.125 . 0 0 "[ . 1 . 2]" 1
882 1 45 ILE MD 1 45 ILE MG 2.024 . 2.536 1.881 1.841 1.910 . 0 0 "[ . 1 . 2]" 1
883 1 45 ILE MD 1 46 ASP H 2.968 . 4.069 3.765 3.575 3.964 . 0 0 "[ . 1 . 2]" 1
884 1 45 ILE MD 1 62 LEU HA 3.136 . 4.366 3.594 3.336 4.007 . 0 0 "[ . 1 . 2]" 1
885 1 45 ILE MD 1 62 LEU HB3 2.786 . 3.756 2.146 1.950 2.619 . 0 0 "[ . 1 . 2]" 1
886 1 45 ILE MD 1 62 LEU QD 2.129 . 2.696 2.252 1.920 2.627 . 0 0 "[ . 1 . 2]" 1
887 1 45 ILE MD 1 62 LEU HG 2.944 . 4.028 3.213 2.934 4.090 0.062 17 0 "[ . 1 . 2]" 1
888 1 45 ILE MD 1 64 GLY HA2 2.490 . 3.265 2.248 2.024 2.495 . 0 0 "[ . 1 . 2]" 1
889 1 45 ILE MD 1 64 GLY HA3 2.697 . 3.607 3.104 2.914 3.327 . 0 0 "[ . 1 . 2]" 1
890 1 45 ILE MD 1 65 LYS H 3.206 . 4.490 3.733 3.457 4.090 . 0 0 "[ . 1 . 2]" 1
891 1 45 ILE MD 1 87 HIS HD2 2.357 . 3.051 2.747 2.418 3.083 0.032 1 0 "[ . 1 . 2]" 1
892 1 45 ILE HG12 1 45 ILE MG 2.584 . 3.418 3.194 3.182 3.206 . 0 0 "[ . 1 . 2]" 1
893 1 45 ILE HG13 1 45 ILE MG 2.087 . 2.631 2.439 2.391 2.515 . 0 0 "[ . 1 . 2]" 1
894 1 45 ILE MG 1 46 ASP H 2.738 . 3.675 2.364 2.194 2.586 . 0 0 "[ . 1 . 2]" 1
895 1 45 ILE MG 1 47 LYS H 2.484 . 3.255 2.550 2.380 2.659 . 0 0 "[ . 1 . 2]" 1
896 1 45 ILE MG 1 62 LEU HA 2.847 . 3.860 3.020 2.763 3.461 . 0 0 "[ . 1 . 2]" 1
897 1 45 ILE MG 1 63 ILE H 2.711 . 3.630 2.630 2.434 2.842 . 0 0 "[ . 1 . 2]" 1
898 1 45 ILE MG 1 64 GLY HA2 2.699 . 3.610 2.928 2.591 3.129 . 0 0 "[ . 1 . 2]" 1
899 1 45 ILE MG 1 65 LYS H 3.477 . 4.988 4.452 4.032 4.895 . 0 0 "[ . 1 . 2]" 1
900 1 46 ASP H 1 46 ASP HB2 2.886 . 3.927 2.837 2.678 3.010 . 0 0 "[ . 1 . 2]" 1
901 1 46 ASP H 1 46 ASP HB3 2.871 . 3.901 2.552 2.399 2.657 . 0 0 "[ . 1 . 2]" 1
902 1 46 ASP H 1 47 LYS H 2.471 . 3.235 2.176 2.047 2.317 . 0 0 "[ . 1 . 2]" 1
903 1 46 ASP H 1 63 ILE MG 3.254 . 4.577 3.733 3.472 4.109 . 0 0 "[ . 1 . 2]" 1
904 1 46 ASP H 1 65 LYS H 2.893 . 3.939 3.421 2.940 3.960 0.021 15 0 "[ . 1 . 2]" 1
905 1 46 ASP HA 1 46 ASP HB2 2.483 . 3.253 2.484 2.398 2.553 . 0 0 "[ . 1 . 2]" 1
906 1 46 ASP HA 1 46 ASP HB3 2.501 . 3.283 3.025 3.017 3.030 . 0 0 "[ . 1 . 2]" 1
907 1 46 ASP HA 1 47 LYS H 2.891 . 3.936 3.556 3.531 3.570 . 0 0 "[ . 1 . 2]" 1
908 1 46 ASP HA 1 65 LYS HA 3.139 . 4.371 4.331 3.969 4.462 0.091 5 0 "[ . 1 . 2]" 1
909 1 46 ASP HA 1 65 LYS HE2 2.973 . 4.078 3.505 2.482 4.119 0.041 6 0 "[ . 1 . 2]" 1
910 1 46 ASP HA 1 65 LYS HE3 2.873 . 3.905 3.245 2.694 3.948 0.043 8 0 "[ . 1 . 2]" 1
911 1 46 ASP HB2 1 47 LYS H 2.806 . 3.790 3.810 3.690 3.878 0.088 15 0 "[ . 1 . 2]" 1
912 1 46 ASP HB2 1 63 ILE MG 3.021 . 4.162 4.145 3.860 4.267 0.105 17 0 "[ . 1 . 2]" 1
913 1 46 ASP HB2 1 65 LYS H 3.518 . 5.065 3.811 3.459 4.321 . 0 0 "[ . 1 . 2]" 1
914 1 46 ASP HB2 1 65 LYS HA 2.474 . 3.239 2.059 1.822 2.284 . 0 0 "[ . 1 . 2]" 1
915 1 46 ASP HB2 1 65 LYS HG2 3.111 . 4.320 2.213 1.819 2.708 0.083 6 0 "[ . 1 . 2]" 1
916 1 46 ASP HB2 1 66 VAL H 3.260 . 4.588 3.870 3.190 4.411 . 0 0 "[ . 1 . 2]" 1
917 1 46 ASP HB3 1 47 LYS H 2.676 . 3.571 2.521 2.367 2.625 . 0 0 "[ . 1 . 2]" 1
918 1 46 ASP HB3 1 63 ILE MG 3.035 . 4.186 2.834 2.477 3.067 . 0 0 "[ . 1 . 2]" 1
919 1 46 ASP HB3 1 65 LYS HA 2.608 . 3.458 3.179 2.891 3.504 0.046 17 0 "[ . 1 . 2]" 1
920 1 46 ASP HB3 1 65 LYS HG2 3.147 . 4.385 3.923 3.355 4.458 0.073 11 0 "[ . 1 . 2]" 1
921 1 47 LYS H 1 47 LYS QB 3.013 . 3.702 2.589 2.512 2.676 . 0 0 "[ . 1 . 2]" 1
922 1 47 LYS H 1 48 LEU H 3.397 . 4.840 4.392 4.366 4.430 . 0 0 "[ . 1 . 2]" 1
923 1 47 LYS H 1 63 ILE H 3.019 . 4.158 3.444 3.127 3.675 . 0 0 "[ . 1 . 2]" 1
924 1 47 LYS H 1 63 ILE HB 2.725 . 3.653 1.846 1.772 2.010 0.025 13 0 "[ . 1 . 2]" 1
925 1 47 LYS H 1 63 ILE MD 3.219 . 4.514 4.677 4.614 4.757 0.243 16 0 "[ . 1 . 2]" 1
926 1 47 LYS H 1 63 ILE HG12 3.023 . 4.165 4.121 3.640 4.272 0.107 12 0 "[ . 1 . 2]" 1
927 1 47 LYS H 1 63 ILE MG 3.023 . 4.165 3.063 2.780 3.582 . 0 0 "[ . 1 . 2]" 1
928 1 47 LYS H 1 108 ILE MD 3.430 . 4.901 3.993 3.683 4.171 . 0 0 "[ . 1 . 2]" 1
929 1 47 LYS HA 1 47 LYS QB 2.404 . 3.126 2.463 2.385 2.533 . 0 0 "[ . 1 . 2]" 1
930 1 47 LYS HA 1 47 LYS HD2 2.412 . 3.139 2.702 1.904 4.069 0.930 16 2 "[ - . 1 .+ 2]" 1
931 1 47 LYS HA 1 47 LYS HD3 2.949 . 4.036 2.688 1.945 3.345 . 0 0 "[ . 1 . 2]" 1
932 1 47 LYS HA 1 47 LYS HE2 2.956 . 4.048 4.407 3.939 4.999 0.951 16 8 "[ ** *** - .+ *]" 1
933 1 47 LYS HA 1 47 LYS HG2 2.744 . 3.685 3.204 2.373 3.777 0.092 7 0 "[ . 1 . 2]" 1
934 1 47 LYS HA 1 47 LYS HG3 2.835 . 3.839 3.214 2.626 3.632 . 0 0 "[ . 1 . 2]" 1
935 1 47 LYS HA 1 48 LEU H 2.080 . 2.621 2.433 2.353 2.475 . 0 0 "[ . 1 . 2]" 1
936 1 47 LYS HA 1 108 ILE MD 2.719 . 3.643 3.464 2.955 3.737 0.094 6 0 "[ . 1 . 2]" 1
937 1 47 LYS HA 1 108 ILE MG 2.687 . 3.589 2.955 2.177 3.568 . 0 0 "[ . 1 . 2]" 1
938 1 47 LYS QB 1 47 LYS HD2 2.154 . 2.734 2.658 2.403 3.229 0.495 3 0 "[ . 1 . 2]" 1
939 1 47 LYS QB 1 47 LYS HD3 2.371 . 3.074 2.653 2.307 2.983 . 0 0 "[ . 1 . 2]" 1
940 1 47 LYS QB 1 47 LYS HG2 2.540 . 2.836 2.218 2.093 2.404 . 0 0 "[ . 1 . 2]" 1
941 1 47 LYS QB 1 48 LEU H 2.709 . 3.626 2.904 2.366 3.342 . 0 0 "[ . 1 . 2]" 1
942 1 47 LYS QB 1 63 ILE HB 3.297 . 3.420 2.068 1.900 2.248 0.039 10 0 "[ . 1 . 2]" 1
943 1 47 LYS QB 1 63 ILE MD 3.093 . 4.289 3.234 3.124 3.360 . 0 0 "[ . 1 . 2]" 1
944 1 47 LYS QB 1 63 ILE MG 2.908 . 3.965 2.351 2.002 2.922 . 0 0 "[ . 1 . 2]" 1
945 1 47 LYS HD2 1 47 LYS HE2 2.255 . 2.891 2.775 2.403 3.008 0.117 20 0 "[ . 1 . 2]" 1
946 1 47 LYS HD2 1 47 LYS HG2 2.225 . 2.844 2.946 2.399 2.998 0.154 13 0 "[ . 1 . 2]" 1
947 1 47 LYS HD2 1 47 LYS HG3 2.272 . 2.917 2.441 2.324 2.518 . 0 0 "[ . 1 . 2]" 1
948 1 47 LYS HD2 1 48 LEU H 2.477 . 3.244 2.427 1.771 3.768 0.524 3 1 "[ + . 1 . 2]" 1
949 1 47 LYS HD3 1 47 LYS HE2 2.304 . 2.968 2.542 2.368 3.006 0.038 18 0 "[ . 1 . 2]" 1
950 1 47 LYS HD3 1 47 LYS HG2 2.026 . 2.539 2.430 2.344 2.984 0.445 3 0 "[ . 1 . 2]" 1
951 1 47 LYS HD3 1 47 LYS HG3 2.549 . 3.361 2.967 2.425 3.003 . 0 0 "[ . 1 . 2]" 1
952 1 47 LYS HD3 1 48 LEU H 2.911 . 3.970 2.980 1.664 4.107 0.188 16 0 "[ . 1 . 2]" 1
953 1 47 LYS HE2 1 47 LYS HG2 2.467 . 3.228 2.877 2.273 3.686 0.458 2 0 "[ . 1 . 2]" 1
954 1 47 LYS HE2 1 47 LYS HG3 2.388 . 3.101 3.117 2.391 3.779 0.678 19 5 "[ - . 1 *** +2]" 1
955 1 47 LYS HG2 1 48 LEU H 2.664 . 3.551 3.511 3.234 3.780 0.229 8 0 "[ . 1 . 2]" 1
956 1 47 LYS HG3 1 63 ILE MD 3.225 . 4.525 4.502 4.011 4.828 0.303 14 0 "[ . 1 . 2]" 1
957 1 48 LEU H 1 48 LEU HA 2.776 . 3.739 2.914 2.868 2.958 . 0 0 "[ . 1 . 2]" 1
958 1 48 LEU H 1 48 LEU QB 2.392 . 3.107 2.826 2.538 3.123 0.016 1 0 "[ . 1 . 2]" 1
959 1 48 LEU H 1 49 GLN H 3.373 . 4.795 4.301 4.208 4.384 . 0 0 "[ . 1 . 2]" 1
960 1 48 LEU H 1 108 ILE MD 3.147 . 4.385 3.704 3.202 4.450 0.065 6 0 "[ . 1 . 2]" 1
961 1 48 LEU HA 1 48 LEU QB 2.525 . 3.317 2.287 2.116 2.418 . 0 0 "[ . 1 . 2]" 1
962 1 48 LEU HA 1 48 LEU QD 2.656 . 3.114 3.025 2.884 3.307 0.193 3 0 "[ . 1 . 2]" 1
963 1 48 LEU HA 1 48 LEU HG 2.732 . 4.232 2.996 2.325 4.234 0.002 5 0 "[ . 1 . 2]" 1
964 1 48 LEU HA 1 49 GLN H 2.241 . 2.869 2.249 2.125 2.384 . 0 0 "[ . 1 . 2]" 1
965 1 48 LEU HA 1 62 LEU HA 2.378 . 3.085 3.162 2.451 3.278 0.193 9 0 "[ . 1 . 2]" 1
966 1 48 LEU HA 1 62 LEU QD 3.402 . 4.849 3.805 3.553 4.347 . 0 0 "[ . 1 . 2]" 1
967 1 48 LEU HA 1 63 ILE H 3.090 . 4.283 2.708 2.536 2.918 . 0 0 "[ . 1 . 2]" 1
968 1 48 LEU HA 1 108 ILE MD 3.650 . 5.315 3.720 3.395 4.382 . 0 0 "[ . 1 . 2]" 1
969 1 48 LEU QB 1 48 LEU QD 2.313 . 2.607 1.870 1.810 2.050 . 0 0 "[ . 1 . 2]" 1
970 1 48 LEU QB 1 48 LEU HG 2.301 . 2.841 2.416 2.102 2.530 . 0 0 "[ . 1 . 2]" 1
971 1 48 LEU QB 1 49 GLN H 2.969 . 4.008 3.125 2.353 3.646 . 0 0 "[ . 1 . 2]" 1
972 1 48 LEU QB 1 62 LEU HA 3.101 . 4.303 3.778 2.834 4.308 0.005 6 0 "[ . 1 . 2]" 1
973 1 48 LEU QD 1 49 GLN H 2.778 . 3.742 3.206 2.687 3.763 0.021 6 0 "[ . 1 . 2]" 1
974 1 48 LEU QD 1 60 LEU HB3 2.923 . 3.991 3.862 3.559 4.130 0.139 11 0 "[ . 1 . 2]" 1
975 1 48 LEU QD 1 101 LYS HA 2.394 . 3.111 2.334 2.147 2.566 . 0 0 "[ . 1 . 2]" 1
976 1 48 LEU QD 1 104 LEU H 2.989 . 4.105 3.722 3.599 4.038 . 0 0 "[ . 1 . 2]" 1
977 1 48 LEU QD 1 104 LEU HB2 2.532 . 3.334 2.154 1.820 2.744 . 0 0 "[ . 1 . 2]" 1
978 1 48 LEU QD 1 104 LEU HB3 2.718 . 3.578 2.251 1.852 3.245 . 0 0 "[ . 1 . 2]" 1
979 1 48 LEU QD 1 105 GLN H 2.737 . 3.673 2.516 2.338 2.718 . 0 0 "[ . 1 . 2]" 1
980 1 48 LEU QD 1 105 GLN HA 2.489 . 3.263 2.242 1.749 2.631 0.054 5 0 "[ . 1 . 2]" 1
981 1 48 LEU QD 1 105 GLN HB2 2.867 . 3.429 2.242 2.139 2.348 . 0 0 "[ . 1 . 2]" 1
982 1 48 LEU QD 1 105 GLN HB3 2.736 . 3.671 3.493 3.293 3.623 . 0 0 "[ . 1 . 2]" 1
983 1 48 LEU QD 1 105 GLN HE21 3.564 . 5.152 4.041 2.806 4.791 . 0 0 "[ . 1 . 2]" 1
984 1 48 LEU QD 1 105 GLN HG2 2.694 . 3.601 2.304 1.702 3.380 0.085 6 0 "[ . 1 . 2]" 1
985 1 48 LEU QD 1 105 GLN HG3 2.632 . 3.498 2.680 1.985 3.194 . 0 0 "[ . 1 . 2]" 1
986 1 48 LEU HG 1 49 GLN H 3.088 . 4.280 3.143 2.307 4.689 0.409 17 0 "[ . 1 . 2]" 1
987 1 48 LEU HG 1 108 ILE MD 2.843 . 3.853 3.511 2.168 4.019 0.166 3 0 "[ . 1 . 2]" 1
988 1 49 GLN H 1 49 GLN HA 2.953 . 4.043 2.931 2.882 2.949 . 0 0 "[ . 1 . 2]" 1
989 1 49 GLN H 1 49 GLN HG2 3.317 . 4.692 3.827 2.895 4.777 0.085 6 0 "[ . 1 . 2]" 1
990 1 49 GLN H 1 49 GLN HG3 3.000 . 4.125 3.690 3.081 4.534 0.409 11 0 "[ . 1 . 2]" 1
991 1 49 GLN H 1 50 ALA H 3.264 . 4.595 4.382 4.266 4.453 . 0 0 "[ . 1 . 2]" 1
992 1 49 GLN H 1 61 ARG H 2.882 . 3.920 2.709 2.447 3.057 . 0 0 "[ . 1 . 2]" 1
993 1 49 GLN H 1 61 ARG QB 2.846 . 3.858 2.580 2.242 2.987 . 0 0 "[ . 1 . 2]" 1
994 1 49 GLN H 1 62 LEU HA 3.132 . 4.358 4.281 3.850 4.430 0.072 2 0 "[ . 1 . 2]" 1
995 1 49 GLN H 1 63 ILE HG12 3.234 . 4.541 3.587 3.119 4.131 . 0 0 "[ . 1 . 2]" 1
996 1 49 GLN H 1 63 ILE HG13 3.663 . 5.340 4.451 4.007 5.362 0.022 17 0 "[ . 1 . 2]" 1
997 1 49 GLN HA 1 49 GLN HB2 2.866 . 3.893 3.008 2.797 3.029 . 0 0 "[ . 1 . 2]" 1
998 1 49 GLN HA 1 49 GLN HB3 2.716 . 3.638 2.508 2.418 2.877 . 0 0 "[ . 1 . 2]" 1
999 1 49 GLN HA 1 49 GLN HG2 2.692 . 3.598 2.693 2.375 3.109 . 0 0 "[ . 1 . 2]" 1
1000 1 49 GLN HA 1 49 GLN HG3 2.817 . 3.809 3.282 2.250 3.814 0.005 20 0 "[ . 1 . 2]" 1
1001 1 49 GLN HA 1 50 ALA H 3.319 . 4.696 2.264 2.138 2.453 . 0 0 "[ . 1 . 2]" 1
1002 1 49 GLN HA 1 61 ARG QB 3.190 . 4.462 4.219 3.897 4.397 . 0 0 "[ . 1 . 2]" 1
1003 1 49 GLN HA 2 10 TRP HZ2 6.000 . 6.000 4.967 4.382 5.661 . 0 0 "[ . 1 . 2]" 1
1004 1 49 GLN HB2 1 49 GLN HG2 2.568 . 3.392 2.823 2.406 3.004 . 0 0 "[ . 1 . 2]" 1
1005 1 49 GLN HB2 1 49 GLN HG3 1.948 . 2.422 2.390 2.287 2.485 0.063 6 0 "[ . 1 . 2]" 1
1006 1 49 GLN HB2 1 50 ALA H 3.032 . 4.181 3.881 3.376 4.310 0.129 6 0 "[ . 1 . 2]" 1
1007 1 49 GLN HB2 2 10 TRP HZ2 3.600 . 4.300 3.742 2.963 4.364 0.064 9 0 "[ . 1 . 2]" 1
1008 1 49 GLN HB3 1 49 GLN HG2 2.291 . 2.947 2.637 2.342 3.003 0.056 20 0 "[ . 1 . 2]" 1
1009 1 49 GLN HB3 1 49 GLN HG3 2.225 . 2.844 2.813 2.393 3.001 0.157 14 0 "[ . 1 . 2]" 1
1010 1 49 GLN HB3 1 50 ALA H 3.096 . 4.294 2.785 2.299 3.397 . 0 0 "[ . 1 . 2]" 1
1011 1 49 GLN HB3 2 10 TRP HZ2 3.700 . 4.400 3.438 2.535 4.471 0.071 5 0 "[ . 1 . 2]" 1
1012 1 49 GLN HE21 1 49 GLN HG2 3.134 . 4.361 2.721 2.216 3.505 . 0 0 "[ . 1 . 2]" 1
1013 1 49 GLN HE21 1 49 GLN HG3 3.419 . 4.880 2.788 2.204 3.506 . 0 0 "[ . 1 . 2]" 1
1014 1 49 GLN HE21 1 63 ILE MD 3.765 . 5.537 3.847 2.235 5.567 0.030 9 0 "[ . 1 . 2]" 1
1015 1 49 GLN HE22 1 63 ILE MD 3.687 . 5.386 4.164 2.672 5.565 0.179 15 0 "[ . 1 . 2]" 1
1016 1 49 GLN HG2 1 50 ALA H 3.475 . 4.985 4.287 3.006 4.991 0.006 20 0 "[ . 1 . 2]" 1
1017 1 49 GLN HG3 1 50 ALA H 3.585 . 5.191 4.908 3.716 5.261 0.070 7 0 "[ . 1 . 2]" 1
1018 1 50 ALA H 1 50 ALA MB 2.582 . 3.415 2.569 2.402 2.661 . 0 0 "[ . 1 . 2]" 1
1019 1 50 ALA H 1 51 THR H 3.558 . 5.140 4.390 4.254 4.502 . 0 0 "[ . 1 . 2]" 1
1020 1 50 ALA HA 1 50 ALA MB 2.066 . 2.600 2.122 2.112 2.133 . 0 0 "[ . 1 . 2]" 1
1021 1 50 ALA HA 1 51 THR H 2.296 . 2.955 2.326 2.150 2.472 . 0 0 "[ . 1 . 2]" 1
1022 1 50 ALA HA 1 60 LEU HA 2.292 . 2.949 2.467 2.109 2.634 . 0 0 "[ . 1 . 2]" 1
1023 1 50 ALA HA 1 60 LEU QD 2.358 . 3.053 2.327 2.114 2.573 . 0 0 "[ . 1 . 2]" 1
1024 1 50 ALA HA 1 61 ARG H 3.043 . 4.200 3.487 3.139 3.826 . 0 0 "[ . 1 . 2]" 1
1025 1 50 ALA HA 1 97 MET ME 2.827 . 3.826 3.183 2.902 3.540 . 0 0 "[ . 1 . 2]" 1
1026 1 50 ALA HA 2 10 TRP HH2 3.600 3.000 4.200 4.104 3.709 4.288 0.088 12 0 "[ . 1 . 2]" 1
1027 1 50 ALA HA 2 10 TRP HZ2 3.600 3.000 4.200 2.868 2.780 2.927 0.220 6 0 "[ . 1 . 2]" 1
1028 1 50 ALA MB 1 51 THR H 2.485 . 3.257 2.618 2.347 2.994 . 0 0 "[ . 1 . 2]" 1
1029 1 50 ALA MB 1 60 LEU HA 2.594 . 3.435 3.343 3.175 3.461 0.026 7 0 "[ . 1 . 2]" 1
1030 1 50 ALA MB 1 60 LEU QD 2.011 . 2.517 1.898 1.773 2.268 . 0 0 "[ . 1 . 2]" 1
1031 1 50 ALA MB 1 61 ARG H 2.897 . 3.946 4.161 4.045 4.299 0.353 17 0 "[ . 1 . 2]" 1
1032 1 50 ALA MB 1 97 MET ME 2.019 . 2.529 2.067 1.750 2.429 . 0 0 "[ . 1 . 2]" 1
1033 1 50 ALA MB 1 101 LYS HD2 2.483 . 3.253 2.672 1.747 3.478 0.225 4 0 "[ . 1 . 2]" 1
1034 1 50 ALA MB 1 101 LYS HD3 2.374 . 3.078 2.338 1.695 3.430 0.352 12 0 "[ . 1 . 2]" 1
1035 1 50 ALA MB 1 101 LYS QE 2.281 . 2.931 2.745 1.786 3.121 0.190 1 0 "[ . 1 . 2]" 1
1036 1 51 THR H 1 51 THR HA 2.952 . 4.041 2.828 2.778 2.882 . 0 0 "[ . 1 . 2]" 1
1037 1 51 THR H 1 51 THR HB 3.238 . 4.549 3.534 3.446 3.591 . 0 0 "[ . 1 . 2]" 1
1038 1 51 THR H 1 51 THR MG 2.564 . 3.386 2.708 2.375 2.984 . 0 0 "[ . 1 . 2]" 1
1039 1 51 THR H 1 59 MET H 2.620 . 3.478 3.056 2.689 3.470 . 0 0 "[ . 1 . 2]" 1
1040 1 51 THR H 1 60 LEU HA 2.957 . 4.050 3.991 3.797 4.089 0.039 1 0 "[ . 1 . 2]" 1
1041 1 51 THR H 1 60 LEU QD 3.111 . 4.321 3.499 3.233 3.669 . 0 0 "[ . 1 . 2]" 1
1042 1 51 THR H 1 97 MET ME 2.680 . 3.577 2.160 1.969 2.500 . 0 0 "[ . 1 . 2]" 1
1043 1 51 THR HA 1 51 THR HB 2.656 . 3.538 2.623 2.542 2.742 . 0 0 "[ . 1 . 2]" 1
1044 1 51 THR HA 1 51 THR MG 2.515 . 3.306 2.214 2.154 2.279 . 0 0 "[ . 1 . 2]" 1
1045 1 51 THR HA 1 52 PRO HD3 3.186 . 4.455 2.462 2.389 2.545 . 0 0 "[ . 1 . 2]" 1
1046 1 51 THR HB 1 51 THR MG 2.395 . 3.112 2.128 2.125 2.133 . 0 0 "[ . 1 . 2]" 1
1047 1 51 THR MG 1 55 SER HB2 3.335 . 4.725 4.562 3.565 5.646 0.921 19 3 "[ - . 1 . +*]" 1
1048 1 51 THR MG 1 57 LYS H 3.682 . 5.377 4.866 4.093 5.399 0.022 13 0 "[ . 1 . 2]" 1
1049 1 51 THR MG 1 59 MET H 2.707 . 3.623 3.051 2.556 3.512 . 0 0 "[ . 1 . 2]" 1
1050 1 51 THR MG 1 59 MET HB3 2.750 . 3.695 2.028 1.852 2.283 . 0 0 "[ . 1 . 2]" 1
1051 1 51 THR MG 1 59 MET ME 2.413 . 3.141 3.074 2.748 3.204 0.063 9 0 "[ . 1 . 2]" 1
1052 1 51 THR MG 1 59 MET HG2 2.829 . 3.829 3.470 3.214 3.719 . 0 0 "[ . 1 . 2]" 1
1053 1 51 THR MG 2 9 TRP HH2 6.000 . 6.000 2.067 1.846 2.394 . 0 0 "[ . 1 . 2]" 1
1054 1 51 THR MG 2 10 TRP HH2 6.000 . 6.000 3.108 2.776 3.731 . 0 0 "[ . 1 . 2]" 1
1055 1 51 THR MG 2 10 TRP HZ2 6.000 . 6.000 3.196 2.811 3.870 . 0 0 "[ . 1 . 2]" 1
1056 1 52 PRO HA 1 52 PRO HB3 2.188 . 2.786 2.275 2.259 2.313 . 0 0 "[ . 1 . 2]" 1
1057 1 52 PRO HA 1 52 PRO HG2 2.954 . 4.045 3.862 3.784 3.905 . 0 0 "[ . 1 . 2]" 1
1058 1 52 PRO HA 1 52 PRO HG3 2.843 . 3.853 3.956 3.886 4.056 0.203 3 0 "[ . 1 . 2]" 1
1059 1 52 PRO HA 1 53 ALA HA 3.151 . 4.392 4.326 4.267 4.405 0.013 2 0 "[ . 1 . 2]" 1
1060 1 52 PRO HA 1 53 ALA MB 3.032 . 4.181 4.008 3.979 4.083 . 0 0 "[ . 1 . 2]" 1
1061 1 52 PRO HB2 1 52 PRO HD2 3.291 . 4.645 4.044 4.004 4.091 . 0 0 "[ . 1 . 2]" 1
1062 1 52 PRO HB2 1 52 PRO HG2 2.035 . 2.553 2.310 2.289 2.344 . 0 0 "[ . 1 . 2]" 1
1063 1 52 PRO HB2 1 55 SER H 2.871 . 3.901 3.105 2.513 3.485 . 0 0 "[ . 1 . 2]" 1
1064 1 52 PRO HB3 1 52 PRO HG2 2.801 . 3.781 2.985 2.967 3.004 . 0 0 "[ . 1 . 2]" 1
1065 1 52 PRO HB3 1 52 PRO HG3 2.373 . 3.077 2.309 2.285 2.351 . 0 0 "[ . 1 . 2]" 1
1066 1 52 PRO HB3 1 55 SER H 3.552 . 5.129 4.749 4.251 5.111 . 0 0 "[ . 1 . 2]" 1
1067 1 52 PRO HG2 1 55 SER H 2.977 . 4.085 3.298 2.587 3.693 . 0 0 "[ . 1 . 2]" 1
1068 1 52 PRO HG2 1 55 SER HB2 3.109 . 4.317 2.467 2.068 2.915 . 0 0 "[ . 1 . 2]" 1
1069 1 52 PRO HG2 1 55 SER HB3 3.237 . 4.547 3.008 2.265 3.674 . 0 0 "[ . 1 . 2]" 1
1070 1 52 PRO HG2 2 9 TRP HE3 6.000 . 6.000 5.763 5.517 6.057 0.057 10 0 "[ . 1 . 2]" 1
1071 1 52 PRO HG3 2 9 TRP HE3 6.000 . 6.000 6.039 5.969 6.078 0.078 11 0 "[ . 1 . 2]" 1
1072 1 52 PRO HG3 2 13 GLU HB2 6.000 . 6.000 3.340 2.476 4.675 . 0 0 "[ . 1 . 2]" 1
1073 1 52 PRO HG3 2 13 GLU HB3 6.000 . 6.000 2.590 1.934 4.047 . 0 0 "[ . 1 . 2]" 1
1074 1 52 PRO HG3 2 13 GLU QG 6.000 . 6.000 3.056 1.858 5.129 . 0 0 "[ . 1 . 2]" 1
1075 1 53 ALA HA 1 53 ALA MB 1.835 . 2.256 2.126 2.120 2.132 . 0 0 "[ . 1 . 2]" 1
1076 1 53 ALA MB 1 54 SER HA 2.847 . 3.860 3.932 3.899 3.966 0.106 3 0 "[ . 1 . 2]" 1
1077 1 54 SER H 1 55 SER H 2.596 . 3.438 2.486 2.424 2.546 . 0 0 "[ . 1 . 2]" 1
1078 1 54 SER HA 1 54 SER HB2 2.093 . 2.641 2.558 2.502 2.637 . 0 0 "[ . 1 . 2]" 1
1079 1 54 SER HA 1 54 SER HB3 1.973 . 2.460 2.377 2.315 2.426 . 0 0 "[ . 1 . 2]" 1
1080 1 54 SER HA 1 55 SER H 2.906 . 3.961 3.403 3.269 3.497 . 0 0 "[ . 1 . 2]" 1
1081 1 54 SER HB2 1 55 SER H 3.075 . 4.257 3.935 3.700 4.208 . 0 0 "[ . 1 . 2]" 1
1082 1 54 SER HB3 1 55 SER H 3.161 . 4.410 4.249 4.028 4.418 0.008 17 0 "[ . 1 . 2]" 1
1083 1 55 SER H 1 55 SER HA 2.574 . 3.402 2.913 2.861 2.946 . 0 0 "[ . 1 . 2]" 1
1084 1 55 SER H 1 55 SER HB2 2.469 . 3.231 2.681 2.258 2.900 . 0 0 "[ . 1 . 2]" 1
1085 1 55 SER H 1 55 SER HB3 2.394 . 3.110 2.718 2.499 3.534 0.424 8 0 "[ . 1 . 2]" 1
1086 1 55 SER HA 1 55 SER HB2 2.287 . 2.941 2.589 2.448 3.023 0.082 8 0 "[ . 1 . 2]" 1
1087 1 55 SER HA 1 55 SER HB3 2.391 . 3.106 2.941 2.411 3.033 . 0 0 "[ . 1 . 2]" 1
1088 1 55 SER HA 1 56 GLU H 2.741 . 3.680 2.239 2.127 2.425 . 0 0 "[ . 1 . 2]" 1
1089 1 55 SER HA 1 57 LYS H 3.010 . 4.143 3.930 3.595 4.212 0.069 18 0 "[ . 1 . 2]" 1
1090 1 55 SER HB2 1 56 GLU H 3.550 . 5.126 4.096 3.785 4.313 . 0 0 "[ . 1 . 2]" 1
1091 1 55 SER HB2 1 57 LYS H 3.320 . 4.698 4.442 4.133 4.801 0.103 13 0 "[ . 1 . 2]" 1
1092 1 55 SER HB3 1 57 LYS H 3.025 . 4.169 3.523 2.896 4.202 0.033 12 0 "[ . 1 . 2]" 1
1093 1 56 GLU H 1 56 GLU HB2 3.180 . 4.444 2.873 2.553 3.213 . 0 0 "[ . 1 . 2]" 1
1094 1 56 GLU H 1 56 GLU HB3 3.219 . 4.514 2.314 2.085 2.564 . 0 0 "[ . 1 . 2]" 1
1095 1 56 GLU H 1 56 GLU QG 4.222 . 5.313 3.821 3.530 4.026 . 0 0 "[ . 1 . 2]" 1
1096 1 56 GLU H 1 57 LYS H 2.742 . 3.682 2.458 2.266 2.692 . 0 0 "[ . 1 . 2]" 1
1097 1 56 GLU HA 1 56 GLU HB2 2.218 . 2.833 2.344 2.220 2.464 . 0 0 "[ . 1 . 2]" 1
1098 1 56 GLU HA 1 56 GLU HB3 2.225 . 2.844 2.960 2.889 2.997 0.153 6 0 "[ . 1 . 2]" 1
1099 1 56 GLU HA 1 56 GLU QG 2.527 . 3.144 2.691 2.469 2.924 . 0 0 "[ . 1 . 2]" 1
1100 1 56 GLU HA 1 57 LYS H 2.877 . 3.911 3.474 3.365 3.523 . 0 0 "[ . 1 . 2]" 1
1101 1 56 GLU HB2 1 56 GLU QG 2.274 . 2.319 2.341 2.310 2.392 0.073 11 0 "[ . 1 . 2]" 1
1102 1 56 GLU HB2 1 57 LYS H 2.955 . 4.047 4.084 3.860 4.239 0.192 7 0 "[ . 1 . 2]" 1
1103 1 56 GLU HB3 1 56 GLU QG 2.071 . 2.607 2.276 2.130 2.344 . 0 0 "[ . 1 . 2]" 1
1104 1 56 GLU HB3 1 57 LYS H 3.052 . 4.216 2.920 2.616 3.215 . 0 0 "[ . 1 . 2]" 1
1105 1 56 GLU QG 1 57 LYS H 3.297 . 4.656 3.317 2.547 3.882 . 0 0 "[ . 1 . 2]" 1
1106 1 56 GLU QG 1 57 LYS HA 2.514 . 3.304 3.070 2.480 3.451 0.147 7 0 "[ . 1 . 2]" 1
1107 1 56 GLU QG 1 58 MET ME 2.226 . 2.845 2.727 2.475 2.869 0.024 9 0 "[ . 1 . 2]" 1
1108 1 57 LYS H 1 57 LYS HA 2.623 . 3.483 2.821 2.776 2.868 . 0 0 "[ . 1 . 2]" 1
1109 1 57 LYS H 1 57 LYS QB 2.271 . 2.916 2.468 2.329 2.681 . 0 0 "[ . 1 . 2]" 1
1110 1 57 LYS H 1 57 LYS HE3 3.872 . 5.746 4.889 3.792 5.581 . 0 0 "[ . 1 . 2]" 1
1111 1 57 LYS H 1 57 LYS QG 2.670 . 3.561 2.177 1.900 2.596 . 0 0 "[ . 1 . 2]" 1
1112 1 57 LYS HA 1 57 LYS QB 2.299 . 2.960 2.335 2.162 2.430 . 0 0 "[ . 1 . 2]" 1
1113 1 57 LYS HA 1 57 LYS QG 2.623 . 3.358 2.699 2.318 3.268 . 0 0 "[ . 1 . 2]" 1
1114 1 57 LYS HA 1 58 MET H 2.660 . 3.545 2.172 2.074 2.339 . 0 0 "[ . 1 . 2]" 1
1115 1 57 LYS HA 1 58 MET ME 2.400 . 3.120 3.199 3.073 3.290 0.170 5 0 "[ . 1 . 2]" 1
1116 1 57 LYS QB 1 57 LYS HD3 2.595 . 3.437 2.821 2.266 3.491 0.054 19 0 "[ . 1 . 2]" 1
1117 1 57 LYS QB 1 57 LYS HE3 1.913 . 2.370 2.370 1.798 3.224 0.854 13 4 "[ . * 1 + * -]" 1
1118 1 57 LYS QB 1 58 MET H 2.717 . 3.640 3.041 2.535 3.550 . 0 0 "[ . 1 . 2]" 1
1119 1 57 LYS QB 2 9 TRP HZ3 6.000 . 6.000 3.390 1.999 5.330 . 0 0 "[ . 1 . 2]" 1
1120 1 57 LYS HD2 1 57 LYS HE3 1.994 . 2.491 2.508 2.334 3.006 0.515 7 1 "[ . + 1 . 2]" 1
1121 1 57 LYS HD2 1 57 LYS QG 1.828 . 2.246 2.228 2.148 2.378 0.132 2 0 "[ . 1 . 2]" 1
1122 1 57 LYS HD2 2 9 TRP HZ3 6.000 . 6.000 4.767 2.760 5.944 . 0 0 "[ . 1 . 2]" 1
1123 1 57 LYS QE 2 9 TRP HZ2 4.200 3.400 5.000 4.233 3.354 5.054 0.054 1 0 "[ . 1 . 2]" 1
1124 1 57 LYS QE 2 9 TRP HZ3 3.400 2.700 4.900 3.985 2.606 4.966 0.094 15 0 "[ . 1 . 2]" 1
1125 1 57 LYS HE3 1 57 LYS QG 2.242 . 2.871 2.732 2.364 3.522 0.651 13 2 "[ . 1 + - 2]" 1
1126 1 57 LYS QG 2 9 TRP HZ3 6.000 . 6.000 3.998 3.097 5.343 . 0 0 "[ . 1 . 2]" 1
1127 1 58 MET H 1 58 MET HB2 3.155 . 4.400 2.787 2.236 3.627 . 0 0 "[ . 1 . 2]" 1
1128 1 58 MET H 1 58 MET ME 3.154 . 4.397 2.923 1.921 3.854 . 0 0 "[ . 1 . 2]" 1
1129 1 58 MET H 1 58 MET QG 3.232 . 4.538 2.749 1.824 3.574 0.102 8 0 "[ . 1 . 2]" 1
1130 1 58 MET H 1 59 MET ME 3.179 . 4.442 3.927 3.188 4.444 0.002 5 0 "[ . 1 . 2]" 1
1131 1 58 MET HA 1 58 MET HB2 2.600 . 3.445 2.911 2.483 3.022 . 0 0 "[ . 1 . 2]" 1
1132 1 58 MET HA 1 58 MET HB3 2.245 . 2.875 2.431 2.243 2.624 . 0 0 "[ . 1 . 2]" 1
1133 1 58 MET HA 1 59 MET H 2.387 . 3.100 2.132 2.104 2.158 . 0 0 "[ . 1 . 2]" 1
1134 1 58 MET HB2 1 58 MET ME 1.800 . 3.800 3.222 2.011 4.298 0.498 2 0 "[ . 1 . 2]" 1
1135 1 58 MET HB2 1 58 MET QG 2.165 . 2.751 2.327 2.129 2.484 . 0 0 "[ . 1 . 2]" 1
1136 1 58 MET ME 1 58 MET QG 1.902 . 2.354 2.273 2.157 2.440 0.086 6 0 "[ . 1 . 2]" 1
1137 1 58 MET ME 1 92 ASN HA 2.223 . 2.840 2.315 1.926 2.765 . 0 0 "[ . 1 . 2]" 1
1138 1 58 MET ME 1 92 ASN HB2 2.830 . 3.831 3.686 3.406 3.830 . 0 0 "[ . 1 . 2]" 1
1139 1 58 MET ME 1 92 ASN HB3 2.973 . 4.078 4.126 3.947 4.261 0.183 8 0 "[ . 1 . 2]" 1
1140 1 58 MET ME 1 93 ASN H 3.220 . 4.516 3.555 2.968 3.902 . 0 0 "[ . 1 . 2]" 1
1141 1 58 MET ME 1 93 ASN HA 2.697 . 3.607 3.581 2.608 3.754 0.147 14 0 "[ . 1 . 2]" 1
1142 1 58 MET ME 1 94 ARG QD 3.150 . 3.711 3.215 2.291 3.568 . 0 0 "[ . 1 . 2]" 1
1143 1 58 MET QG 1 59 MET H 3.876 2.615 5.137 4.311 3.890 4.808 . 0 0 "[ . 1 . 2]" 1
1144 1 59 MET H 1 59 MET HB2 3.010 . 4.142 2.894 2.657 3.087 . 0 0 "[ . 1 . 2]" 1
1145 1 59 MET H 1 59 MET HG2 3.514 . 5.057 5.024 4.880 5.108 0.051 6 0 "[ . 1 . 2]" 1
1146 1 59 MET H 1 97 MET ME 2.772 . 3.733 2.508 2.140 2.938 . 0 0 "[ . 1 . 2]" 1
1147 1 59 MET HA 1 59 MET HB3 2.869 . 3.898 2.950 2.908 2.983 . 0 0 "[ . 1 . 2]" 1
1148 1 59 MET HA 1 59 MET ME 2.875 . 3.908 3.537 3.302 3.774 . 0 0 "[ . 1 . 2]" 1
1149 1 59 MET HA 1 59 MET HG2 2.655 . 3.536 3.617 3.588 3.672 0.136 17 0 "[ . 1 . 2]" 1
1150 1 59 MET HA 1 59 MET HG3 2.423 . 3.157 2.522 2.426 2.607 . 0 0 "[ . 1 . 2]" 1
1151 1 59 MET HA 1 60 LEU H 2.384 . 3.095 2.184 2.133 2.258 . 0 0 "[ . 1 . 2]" 1
1152 1 59 MET HA 1 90 SER HA 2.239 . 2.866 2.444 2.101 2.666 . 0 0 "[ . 1 . 2]" 1
1153 1 59 MET HA 1 90 SER HB2 3.377 . 4.802 4.976 4.192 5.673 0.871 13 9 "[** . * -**+ .* *2]" 1
1154 1 59 MET HA 1 90 SER HB3 3.802 . 5.609 5.072 4.593 5.622 0.013 3 0 "[ . 1 . 2]" 1
1155 1 59 MET HA 1 91 PHE H 3.050 . 4.213 3.128 2.797 3.552 . 0 0 "[ . 1 . 2]" 1
1156 1 59 MET HA 1 91 PHE HD2 3.083 . 4.271 3.562 3.243 3.890 . 0 0 "[ . 1 . 2]" 1
1157 1 59 MET HA 1 91 PHE HE2 3.191 . 4.464 4.513 4.380 4.572 0.108 12 0 "[ . 1 . 2]" 1
1158 1 59 MET HB2 1 59 MET HG2 2.233 . 2.856 2.520 2.453 2.607 . 0 0 "[ . 1 . 2]" 1
1159 1 59 MET HB2 1 60 LEU H 3.096 . 4.294 4.340 4.294 4.378 0.084 11 0 "[ . 1 . 2]" 1
1160 1 59 MET HB2 2 10 TRP HZ2 5.000 . 5.000 5.111 5.024 5.204 0.204 8 0 "[ . 1 . 2]" 1
1161 1 59 MET HB2 2 10 TRP HZ3 5.000 . 5.000 4.018 3.618 4.415 . 0 0 "[ . 1 . 2]" 1
1162 1 59 MET HB3 1 59 MET HG2 2.188 . 2.786 2.316 2.257 2.371 . 0 0 "[ . 1 . 2]" 1
1163 1 59 MET HB3 1 60 LEU H 2.783 . 3.751 3.688 3.501 3.846 0.095 14 0 "[ . 1 . 2]" 1
1164 1 59 MET HB3 2 9 TRP HH2 5.000 . 5.000 3.956 3.393 5.019 0.019 8 0 "[ . 1 . 2]" 1
1165 1 59 MET HB3 2 10 TRP HZ2 5.000 . 5.000 3.453 3.333 3.549 . 0 0 "[ . 1 . 2]" 1
1166 1 59 MET ME 1 59 MET HG2 2.800 . 3.780 2.479 2.445 2.530 . 0 0 "[ . 1 . 2]" 1
1167 1 59 MET ME 2 6 PHE HZ 5.000 . 5.000 4.521 2.594 5.031 0.031 9 0 "[ . 1 . 2]" 1
1168 1 59 MET ME 2 9 TRP HH2 5.000 . 5.000 2.780 2.095 3.883 . 0 0 "[ . 1 . 2]" 1
1169 1 59 MET ME 2 9 TRP HZ2 5.000 . 5.000 2.319 2.032 3.091 . 0 0 "[ . 1 . 2]" 1
1170 1 59 MET HG2 1 60 LEU H 3.349 . 4.751 4.300 4.074 4.462 . 0 0 "[ . 1 . 2]" 1
1171 1 59 MET HG2 1 88 MET QG 2.713 . 3.633 2.743 2.344 3.368 . 0 0 "[ . 1 . 2]" 1
1172 1 59 MET HG2 2 10 TRP HZ2 5.000 . 5.000 4.787 4.535 5.020 0.020 12 0 "[ . 1 . 2]" 1
1173 1 59 MET HG2 2 10 TRP HZ3 5.000 . 5.000 1.979 1.821 2.321 . 0 0 "[ . 1 . 2]" 1
1174 1 59 MET HG3 1 90 SER HA 2.916 . 3.979 3.642 3.050 3.919 . 0 0 "[ . 1 . 2]" 1
1175 1 59 MET HG3 2 10 TRP HZ2 5.000 . 5.000 4.986 4.827 5.095 0.095 19 0 "[ . 1 . 2]" 1
1176 1 59 MET HG3 2 10 TRP HZ3 5.000 . 5.000 3.294 2.981 3.715 . 0 0 "[ . 1 . 2]" 1
1177 1 60 LEU H 1 60 LEU HB2 2.825 . 3.823 2.495 2.414 2.575 . 0 0 "[ . 1 . 2]" 1
1178 1 60 LEU H 1 60 LEU HB3 3.190 . 4.462 3.549 3.381 3.643 . 0 0 "[ . 1 . 2]" 1
1179 1 60 LEU H 1 60 LEU QD 3.349 . 4.751 3.092 2.826 3.399 . 0 0 "[ . 1 . 2]" 1
1180 1 60 LEU H 1 89 PHE H 2.345 . 3.032 2.997 2.872 3.107 0.075 19 0 "[ . 1 . 2]" 1
1181 1 60 LEU H 1 90 SER HA 2.915 . 3.977 3.709 3.425 3.960 . 0 0 "[ . 1 . 2]" 1
1182 1 60 LEU H 1 91 PHE HD2 3.162 . 4.411 3.819 3.412 4.246 . 0 0 "[ . 1 . 2]" 1
1183 1 60 LEU H 1 91 PHE HE2 2.985 . 4.099 3.416 3.248 3.617 . 0 0 "[ . 1 . 2]" 1
1184 1 60 LEU HA 1 60 LEU HB2 2.606 . 3.455 2.953 2.878 2.996 . 0 0 "[ . 1 . 2]" 1
1185 1 60 LEU HA 1 60 LEU HB3 2.743 . 3.683 2.707 2.603 2.822 . 0 0 "[ . 1 . 2]" 1
1186 1 60 LEU HA 1 60 LEU QD 2.863 . 2.917 1.871 1.797 1.966 0.041 9 0 "[ . 1 . 2]" 1
1187 1 60 LEU HA 1 60 LEU HG 2.684 . 3.584 3.638 3.575 3.733 0.149 10 0 "[ . 1 . 2]" 1
1188 1 60 LEU HA 1 61 ARG H 2.349 . 3.039 2.215 2.166 2.280 . 0 0 "[ . 1 . 2]" 1
1189 1 60 LEU HA 1 97 MET ME 3.107 . 4.314 3.688 3.460 4.085 . 0 0 "[ . 1 . 2]" 1
1190 1 60 LEU HA 2 10 TRP HH2 3.200 2.600 3.800 3.821 3.567 3.944 0.144 18 0 "[ . 1 . 2]" 1
1191 1 60 LEU HA 2 10 TRP HZ2 3.600 2.900 4.300 3.929 3.444 4.317 0.017 1 0 "[ . 1 . 2]" 1
1192 1 60 LEU HB2 1 60 LEU QD . . 2.642 2.333 2.227 2.552 . 0 0 "[ . 1 . 2]" 1
1193 1 60 LEU HB2 1 61 ARG H 2.986 . 4.101 4.151 4.072 4.222 0.121 5 0 "[ . 1 . 2]" 1
1194 1 60 LEU HB2 1 89 PHE H 3.505 . 5.040 4.027 3.436 4.305 . 0 0 "[ . 1 . 2]" 1
1195 1 60 LEU HB3 1 60 LEU QD 2.354 . 3.046 2.293 2.006 2.469 . 0 0 "[ . 1 . 2]" 1
1196 1 60 LEU HB3 1 60 LEU HG 2.185 . 2.782 2.396 2.276 2.638 . 0 0 "[ . 1 . 2]" 1
1197 1 60 LEU HB3 1 61 ARG H 3.095 . 4.293 2.952 2.794 3.099 . 0 0 "[ . 1 . 2]" 1
1198 1 60 LEU MD1 1 60 LEU MD2 1.838 . 2.260 2.059 2.023 2.081 . 0 0 "[ . 1 . 2]" 1
1199 1 60 LEU QD 1 60 LEU HG 2.079 . 2.583 1.878 1.871 1.885 . 0 0 "[ . 1 . 2]" 1
1200 1 60 LEU QD 1 61 ARG H 2.795 . 3.772 2.478 1.968 2.986 . 0 0 "[ . 1 . 2]" 1
1201 1 60 LEU QD 1 91 PHE HE2 2.727 . 3.657 1.858 1.782 1.978 0.110 13 0 "[ . 1 . 2]" 1
1202 1 60 LEU QD 1 91 PHE HZ 2.807 . 3.792 3.572 3.422 3.681 . 0 0 "[ . 1 . 2]" 1
1203 1 60 LEU QD 1 97 MET ME 2.647 . 2.817 1.975 1.846 2.125 . 0 0 "[ . 1 . 2]" 1
1204 1 60 LEU QD 1 100 ILE MG 2.247 . 2.878 2.781 2.459 2.889 0.011 4 0 "[ . 1 . 2]" 1
1205 1 60 LEU QD 1 101 LYS H 3.102 . 4.305 2.905 2.552 3.118 . 0 0 "[ . 1 . 2]" 1
1206 1 60 LEU QD 1 101 LYS HA 2.587 . 3.424 2.144 1.867 2.440 . 0 0 "[ . 1 . 2]" 1
1207 1 60 LEU QD 1 101 LYS QG . . 2.663 1.714 1.620 1.884 0.174 20 0 "[ . 1 . 2]" 1
1208 1 60 LEU HG 1 91 PHE HE2 2.690 . 3.594 2.928 1.841 3.518 . 0 0 "[ . 1 . 2]" 1
1209 1 60 LEU HG 1 91 PHE HZ 3.103 . 4.307 4.011 2.683 4.387 0.080 20 0 "[ . 1 . 2]" 1
1210 1 60 LEU HG 1 104 LEU QD 2.401 . 3.122 2.870 2.496 3.315 0.193 6 0 "[ . 1 . 2]" 1
1211 1 61 ARG H 1 61 ARG QB 3.028 . 3.927 2.515 2.389 2.633 . 0 0 "[ . 1 . 2]" 1
1212 1 61 ARG H 1 62 LEU H 3.354 . 4.760 4.414 4.308 4.480 . 0 0 "[ . 1 . 2]" 1
1213 1 61 ARG HA 1 61 ARG QB 3.008 . 3.535 2.428 2.361 2.485 . 0 0 "[ . 1 . 2]" 1
1214 1 61 ARG HA 1 61 ARG HG2 2.626 . 3.488 2.500 2.361 2.728 . 0 0 "[ . 1 . 2]" 1
1215 1 61 ARG HA 1 61 ARG HG3 2.633 . 3.500 2.909 2.635 3.067 . 0 0 "[ . 1 . 2]" 1
1216 1 61 ARG HA 1 62 LEU H 2.404 . 3.127 2.152 2.073 2.242 . 0 0 "[ . 1 . 2]" 1
1217 1 61 ARG HA 1 62 LEU QD 3.023 . 4.165 3.441 3.174 3.904 . 0 0 "[ . 1 . 2]" 1
1218 1 61 ARG HA 1 87 HIS H 3.678 . 5.369 4.349 3.975 4.723 . 0 0 "[ . 1 . 2]" 1
1219 1 61 ARG HA 1 88 MET HA 2.122 . 2.685 2.362 2.246 2.520 . 0 0 "[ . 1 . 2]" 1
1220 1 61 ARG HA 1 88 MET HB2 3.063 . 4.236 4.203 3.888 5.206 0.970 5 1 "[ + 1 . 2]" 1
1221 1 61 ARG HA 1 88 MET QG 3.063 . 4.090 3.407 3.103 3.667 . 0 0 "[ . 1 . 2]" 1
1222 1 61 ARG HA 1 89 PHE H 2.992 . 4.111 3.491 3.344 3.759 . 0 0 "[ . 1 . 2]" 1
1223 1 61 ARG QB 1 61 ARG HD2 3.219 . 3.951 2.562 2.279 3.299 . 0 0 "[ . 1 . 2]" 1
1224 1 61 ARG QB 1 61 ARG HD3 2.999 . 4.123 2.471 2.200 3.305 . 0 0 "[ . 1 . 2]" 1
1225 1 61 ARG QB 1 61 ARG HG2 2.642 . 3.136 2.336 2.231 2.377 . 0 0 "[ . 1 . 2]" 1
1226 1 61 ARG QB 1 62 LEU H 3.059 . 4.229 2.792 2.623 3.026 . 0 0 "[ . 1 . 2]" 1
1227 1 61 ARG QB 1 62 LEU HB2 3.371 . 4.792 4.774 4.736 4.834 0.042 20 0 "[ . 1 . 2]" 1
1228 1 61 ARG QB 1 63 ILE HA 3.113 . 4.324 4.280 4.125 4.412 0.088 17 0 "[ . 1 . 2]" 1
1229 1 61 ARG QB 1 86 ARG QD 3.012 . 4.146 3.671 3.064 3.942 . 0 0 "[ . 1 . 2]" 1
1230 1 61 ARG QB 2 10 TRP HH2 4.000 2.200 4.800 4.297 3.823 4.504 . 0 0 "[ . 1 . 2]" 1
1231 1 61 ARG HD2 1 61 ARG HG2 2.918 . 3.982 2.831 2.416 3.018 . 0 0 "[ . 1 . 2]" 1
1232 1 61 ARG HD2 2 10 TRP HE3 6.000 . 6.000 4.819 3.581 5.438 . 0 0 "[ . 1 . 2]" 1
1233 1 61 ARG HD3 1 61 ARG HG2 2.863 . 3.887 2.572 2.370 3.013 . 0 0 "[ . 1 . 2]" 1
1234 1 61 ARG HD3 1 61 ARG HG3 2.608 . 3.458 2.831 2.413 3.019 . 0 0 "[ . 1 . 2]" 1
1235 1 61 ARG HD3 2 10 TRP HE3 6.000 . 6.000 5.380 3.507 6.080 0.080 3 0 "[ . 1 . 2]" 1
1236 1 61 ARG HD3 2 10 TRP HZ3 6.000 . 6.000 5.218 3.428 5.959 . 0 0 "[ . 1 . 2]" 1
1237 1 61 ARG HG2 1 88 MET HA 3.012 . 4.146 2.996 2.560 3.666 . 0 0 "[ . 1 . 2]" 1
1238 1 61 ARG HG2 2 10 TRP HZ2 4.300 2.400 5.200 4.874 4.429 5.371 0.171 7 0 "[ . 1 . 2]" 1
1239 1 61 ARG HG3 1 88 MET ME 2.658 . 3.541 3.733 3.387 4.148 0.607 15 3 "[ . 1 -+ *]" 1
1240 1 62 LEU H 1 62 LEU HB2 2.991 . 4.110 2.248 2.105 2.342 . 0 0 "[ . 1 . 2]" 1
1241 1 62 LEU H 1 62 LEU HB3 2.871 . 3.902 3.464 3.291 3.531 . 0 0 "[ . 1 . 2]" 1
1242 1 62 LEU H 1 62 LEU QD 2.727 . 3.657 2.775 2.545 3.153 . 0 0 "[ . 1 . 2]" 1
1243 1 62 LEU H 1 63 ILE H 3.077 . 4.260 4.161 4.093 4.261 0.001 20 0 "[ . 1 . 2]" 1
1244 1 62 LEU H 1 63 ILE MD 3.268 . 4.603 4.418 3.825 4.639 0.036 10 0 "[ . 1 . 2]" 1
1245 1 62 LEU H 1 86 ARG QG 3.482 . 4.997 4.446 3.288 4.924 . 0 0 "[ . 1 . 2]" 1
1246 1 62 LEU H 1 87 HIS H 2.812 . 3.801 2.602 2.261 2.905 . 0 0 "[ . 1 . 2]" 1
1247 1 62 LEU H 1 87 HIS HB2 3.708 . 5.427 3.039 2.715 3.446 . 0 0 "[ . 1 . 2]" 1
1248 1 62 LEU H 1 87 HIS HB3 4.196 . 6.396 4.447 4.120 4.814 . 0 0 "[ . 1 . 2]" 1
1249 1 62 LEU H 1 88 MET HA 3.034 . 4.185 3.547 3.364 3.746 . 0 0 "[ . 1 . 2]" 1
1250 1 62 LEU H 1 89 PHE HE1 3.699 . 5.409 4.369 3.667 5.520 0.111 20 0 "[ . 1 . 2]" 1
1251 1 62 LEU HA 1 62 LEU HB2 2.421 . 3.154 2.954 2.886 2.978 . 0 0 "[ . 1 . 2]" 1
1252 1 62 LEU HA 1 62 LEU HB3 2.752 . 3.699 2.682 2.626 2.798 . 0 0 "[ . 1 . 2]" 1
1253 1 62 LEU HA 1 62 LEU QD 2.339 . 3.023 1.942 1.809 2.887 . 0 0 "[ . 1 . 2]" 1
1254 1 62 LEU HA 1 62 LEU HG 2.642 . 3.514 3.598 2.190 3.706 0.192 19 0 "[ . 1 . 2]" 1
1255 1 62 LEU HA 1 63 ILE H 2.358 . 3.053 2.215 2.158 2.283 . 0 0 "[ . 1 . 2]" 1
1256 1 62 LEU HB2 1 62 LEU QD 2.742 . 2.976 2.212 2.033 2.268 . 0 0 "[ . 1 . 2]" 1
1257 1 62 LEU HB2 1 62 LEU HG 1.905 . 2.358 2.472 2.434 2.790 0.432 17 0 "[ . 1 . 2]" 1
1258 1 62 LEU HB2 1 87 HIS H 3.192 . 4.465 2.758 2.416 3.413 . 0 0 "[ . 1 . 2]" 1
1259 1 62 LEU HB2 1 87 HIS HD2 2.797 . 3.775 2.620 2.391 3.231 . 0 0 "[ . 1 . 2]" 1
1260 1 62 LEU HB3 1 62 LEU QD 2.915 . 3.263 2.356 2.060 2.430 . 0 0 "[ . 1 . 2]" 1
1261 1 62 LEU HB3 1 62 LEU HG 2.255 . 2.891 2.373 2.335 2.779 . 0 0 "[ . 1 . 2]" 1
1262 1 62 LEU HB3 1 87 HIS H 3.147 . 4.385 3.406 3.135 3.814 . 0 0 "[ . 1 . 2]" 1
1263 1 62 LEU HB3 1 87 HIS HB2 3.291 . 4.645 3.093 2.857 3.213 . 0 0 "[ . 1 . 2]" 1
1264 1 62 LEU HB3 1 87 HIS HB3 3.199 . 4.478 4.723 4.509 4.796 0.318 19 0 "[ . 1 . 2]" 1
1265 1 62 LEU HB3 1 87 HIS HD2 2.856 . 3.876 2.078 1.854 2.881 . 0 0 "[ . 1 . 2]" 1
1266 1 62 LEU MD1 1 62 LEU MD2 1.784 . 2.182 2.081 2.016 2.102 . 0 0 "[ . 1 . 2]" 1
1267 1 62 LEU QD 1 62 LEU HG 2.040 . 2.560 1.876 1.865 1.882 . 0 0 "[ . 1 . 2]" 1
1268 1 62 LEU QD 1 87 HIS HB2 2.797 . 3.775 2.818 2.428 3.381 . 0 0 "[ . 1 . 2]" 1
1269 1 62 LEU QD 1 87 HIS HB3 3.122 . 4.340 3.851 3.180 4.347 0.007 1 0 "[ . 1 . 2]" 1
1270 1 62 LEU QD 1 87 HIS HD2 2.993 . 4.067 3.653 3.486 3.710 . 0 0 "[ . 1 . 2]" 1
1271 1 62 LEU QD 1 89 PHE HE1 2.993 . 4.113 2.377 1.912 4.053 . 0 0 "[ . 1 . 2]" 1
1272 1 62 LEU QD 1 104 LEU QD 2.127 . 2.693 2.126 1.783 2.446 . 0 0 "[ . 1 . 2]" 1
1273 1 63 ILE H 1 63 ILE HB 2.535 . 3.339 2.635 2.528 2.798 . 0 0 "[ . 1 . 2]" 1
1274 1 63 ILE H 1 63 ILE MD 3.029 . 4.176 3.483 3.018 3.647 . 0 0 "[ . 1 . 2]" 1
1275 1 63 ILE H 1 63 ILE HG12 2.652 . 3.531 2.130 1.899 2.264 . 0 0 "[ . 1 . 2]" 1
1276 1 63 ILE H 1 63 ILE HG13 2.819 . 3.812 3.480 3.251 3.617 . 0 0 "[ . 1 . 2]" 1
1277 1 63 ILE HA 1 63 ILE HB 2.911 . 3.970 3.011 2.998 3.020 . 0 0 "[ . 1 . 2]" 1
1278 1 63 ILE HA 1 63 ILE MD 2.421 . 3.154 2.333 2.204 2.473 . 0 0 "[ . 1 . 2]" 1
1279 1 63 ILE HA 1 63 ILE HG12 2.371 . 3.073 3.008 2.896 3.252 0.179 17 0 "[ . 1 . 2]" 1
1280 1 63 ILE HA 1 63 ILE HG13 2.900 . 3.951 3.854 3.809 3.923 . 0 0 "[ . 1 . 2]" 1
1281 1 63 ILE HA 1 63 ILE MG 2.200 . 2.805 2.292 2.191 2.357 . 0 0 "[ . 1 . 2]" 1
1282 1 63 ILE HA 1 64 GLY H 2.303 . 2.966 2.217 2.178 2.248 . 0 0 "[ . 1 . 2]" 1
1283 1 63 ILE HA 1 86 ARG HA 2.389 . 3.102 2.589 2.340 2.778 . 0 0 "[ . 1 . 2]" 1
1284 1 63 ILE HA 1 87 HIS H 3.315 . 4.688 3.817 3.583 4.063 . 0 0 "[ . 1 . 2]" 1
1285 1 63 ILE HB 1 63 ILE MD 2.536 . 3.340 3.190 3.156 3.213 . 0 0 "[ . 1 . 2]" 1
1286 1 63 ILE HB 1 63 ILE HG12 2.449 . 3.199 2.569 2.479 2.639 . 0 0 "[ . 1 . 2]" 1
1287 1 63 ILE HB 1 63 ILE HG13 2.569 . 3.394 2.362 2.322 2.429 . 0 0 "[ . 1 . 2]" 1
1288 1 63 ILE HB 1 63 ILE MG 2.004 . 2.506 2.127 2.121 2.132 . 0 0 "[ . 1 . 2]" 1
1289 1 63 ILE HB 1 64 GLY H 3.078 . 4.262 4.320 4.265 4.360 0.098 2 0 "[ . 1 . 2]" 1
1290 1 63 ILE MD 1 63 ILE HG12 2.045 . 2.568 2.104 2.083 2.114 . 0 0 "[ . 1 . 2]" 1
1291 1 63 ILE MD 1 63 ILE HG13 2.274 . 2.920 2.099 2.084 2.106 . 0 0 "[ . 1 . 2]" 1
1292 1 63 ILE MD 1 63 ILE MG 2.011 . 2.516 1.882 1.823 1.946 . 0 0 "[ . 1 . 2]" 1
1293 1 63 ILE MD 1 64 GLY H 3.109 . 4.317 4.220 4.053 4.405 0.088 11 0 "[ . 1 . 2]" 1
1294 1 63 ILE MD 1 86 ARG HA 2.803 . 3.785 3.749 3.553 3.916 0.131 16 0 "[ . 1 . 2]" 1
1295 1 63 ILE MD 1 86 ARG HB3 3.425 . 4.891 2.733 1.961 3.859 . 0 0 "[ . 1 . 2]" 1
1296 1 63 ILE MD 1 86 ARG QD 2.621 . 3.479 2.168 1.785 2.935 . 0 0 "[ . 1 . 2]" 1
1297 1 63 ILE MD 1 86 ARG QG 2.684 . 3.584 2.665 1.776 3.405 0.083 7 0 "[ . 1 . 2]" 1
1298 1 63 ILE MD 1 87 HIS H 3.381 . 4.810 4.409 4.028 4.902 0.092 7 0 "[ . 1 . 2]" 1
1299 1 63 ILE HG13 1 63 ILE MG 2.125 . 2.690 2.525 2.385 2.625 . 0 0 "[ . 1 . 2]" 1
1300 1 63 ILE MG 1 64 GLY H 2.662 . 3.548 3.278 3.218 3.334 . 0 0 "[ . 1 . 2]" 1
1301 1 63 ILE MG 1 84 PRO HA 3.050 . 4.213 4.161 3.798 4.331 0.118 19 0 "[ . 1 . 2]" 1
1302 1 63 ILE MG 1 84 PRO HB2 2.436 . 3.178 2.178 1.841 2.562 . 0 0 "[ . 1 . 2]" 1
1303 1 63 ILE MG 1 84 PRO HB3 2.809 . 3.795 2.364 2.080 2.613 . 0 0 "[ . 1 . 2]" 1
1304 1 63 ILE MG 1 84 PRO HG2 2.502 . 3.285 2.794 2.167 3.429 0.144 15 0 "[ . 1 . 2]" 1
1305 1 63 ILE MG 1 86 ARG HA 2.949 . 4.036 4.080 3.927 4.188 0.152 6 0 "[ . 1 . 2]" 1
1306 1 63 ILE MG 1 86 ARG QD 2.873 . 3.904 3.260 2.477 3.815 . 0 0 "[ . 1 . 2]" 1
1307 1 64 GLY H 1 64 GLY HA2 2.721 . 3.646 2.845 2.792 2.877 . 0 0 "[ . 1 . 2]" 1
1308 1 64 GLY H 1 64 GLY HA3 2.560 . 3.379 2.304 2.289 2.322 . 0 0 "[ . 1 . 2]" 1
1309 1 64 GLY H 1 65 LYS H 3.389 . 4.824 4.611 4.575 4.645 . 0 0 "[ . 1 . 2]" 1
1310 1 64 GLY H 1 84 PRO HB2 3.238 . 4.549 4.219 3.653 4.577 0.028 8 0 "[ . 1 . 2]" 1
1311 1 64 GLY H 1 84 PRO HB3 3.437 . 4.913 4.177 3.601 4.800 . 0 0 "[ . 1 . 2]" 1
1312 1 64 GLY H 1 85 GLN H 3.465 . 4.966 4.109 3.401 4.413 . 0 0 "[ . 1 . 2]" 1
1313 1 64 GLY H 1 86 ARG HA 3.065 . 4.239 2.415 2.105 2.904 . 0 0 "[ . 1 . 2]" 1
1314 1 64 GLY HA2 1 65 LYS H 2.509 . 3.296 2.282 2.184 2.461 . 0 0 "[ . 1 . 2]" 1
1315 1 64 GLY HA3 1 65 LYS H 2.766 . 3.722 2.870 2.615 3.052 . 0 0 "[ . 1 . 2]" 1
1316 1 64 GLY HA3 1 85 GLN H 3.183 . 4.449 3.955 2.526 4.471 0.022 5 0 "[ . 1 . 2]" 1
1317 1 65 LYS H 1 65 LYS HA 2.641 . 3.513 2.812 2.779 2.855 . 0 0 "[ . 1 . 2]" 1
1318 1 65 LYS H 1 65 LYS HB2 2.557 . 3.374 2.365 2.113 2.651 . 0 0 "[ . 1 . 2]" 1
1319 1 65 LYS H 1 65 LYS HB3 2.738 . 3.675 3.539 3.428 3.625 . 0 0 "[ . 1 . 2]" 1
1320 1 65 LYS H 1 65 LYS HD3 3.256 . 4.581 4.579 4.330 4.865 0.284 4 0 "[ . 1 . 2]" 1
1321 1 65 LYS H 1 65 LYS HG2 2.689 . 3.593 3.654 3.196 4.071 0.478 15 0 "[ . 1 . 2]" 1
1322 1 65 LYS H 1 65 LYS HG3 2.938 . 4.017 2.440 2.021 2.965 . 0 0 "[ . 1 . 2]" 1
1323 1 65 LYS H 1 66 VAL H 3.218 . 4.513 4.535 4.484 4.583 0.070 6 0 "[ . 1 . 2]" 1
1324 1 65 LYS HA 1 65 LYS HB2 2.545 . 3.355 2.983 2.916 3.021 . 0 0 "[ . 1 . 2]" 1
1325 1 65 LYS HA 1 65 LYS HB3 2.426 . 3.162 2.525 2.418 2.692 . 0 0 "[ . 1 . 2]" 1
1326 1 65 LYS HA 1 65 LYS HD3 3.121 . 4.338 4.355 4.263 4.435 0.097 9 0 "[ . 1 . 2]" 1
1327 1 65 LYS HA 1 65 LYS HE2 3.198 . 4.477 4.581 3.859 4.975 0.498 11 0 "[ . 1 . 2]" 1
1328 1 65 LYS HA 1 65 LYS HE3 3.580 . 5.182 4.990 4.609 5.245 0.063 17 0 "[ . 1 . 2]" 1
1329 1 65 LYS HA 1 65 LYS HG2 2.709 . 3.626 2.506 2.354 2.644 . 0 0 "[ . 1 . 2]" 1
1330 1 65 LYS HA 1 65 LYS HG3 2.585 . 3.420 2.825 2.424 3.297 . 0 0 "[ . 1 . 2]" 1
1331 1 65 LYS HA 1 66 VAL H 2.098 . 2.648 2.268 2.128 2.463 . 0 0 "[ . 1 . 2]" 1
1332 1 65 LYS HB2 1 65 LYS HD3 1.902 . 2.354 2.683 2.337 2.935 0.581 17 7 "[ *. * *1* * + -2]" 1
1333 1 65 LYS HB2 1 65 LYS HE2 3.242 2.614 3.870 4.288 3.760 4.552 0.682 16 9 "[*- . ** 1* **+ *]" 1
1334 1 65 LYS HB2 1 65 LYS HG2 2.303 . 2.966 2.972 2.949 2.989 0.023 6 0 "[ . 1 . 2]" 1
1335 1 65 LYS HB2 1 65 LYS HG3 2.471 . 3.234 2.445 2.350 2.489 . 0 0 "[ . 1 . 2]" 1
1336 1 65 LYS HB2 1 66 VAL H 2.827 . 3.826 3.738 3.472 3.944 0.118 13 0 "[ . 1 . 2]" 1
1337 1 65 LYS HB3 1 65 LYS HD2 2.508 . 3.294 3.280 2.970 3.569 0.275 3 0 "[ . 1 . 2]" 1
1338 1 65 LYS HB3 1 65 LYS HD3 2.333 . 3.013 2.443 2.263 2.620 . 0 0 "[ . 1 . 2]" 1
1339 1 65 LYS HB3 1 65 LYS HE2 3.025 . 4.169 3.742 2.449 4.319 0.150 11 0 "[ . 1 . 2]" 1
1340 1 65 LYS HB3 1 65 LYS HE3 3.424 . 4.890 4.426 3.748 4.679 . 0 0 "[ . 1 . 2]" 1
1341 1 65 LYS HB3 1 65 LYS HG2 2.997 . 4.120 2.370 2.310 2.503 . 0 0 "[ . 1 . 2]" 1
1342 1 65 LYS HB3 1 65 LYS HG3 2.696 . 3.604 2.972 2.955 2.985 . 0 0 "[ . 1 . 2]" 1
1343 1 65 LYS HB3 1 66 VAL H 2.524 . 3.320 2.521 2.193 3.055 . 0 0 "[ . 1 . 2]" 1
1344 1 65 LYS HD2 1 65 LYS HE2 2.423 . 3.157 2.974 2.927 3.003 . 0 0 "[ . 1 . 2]" 1
1345 1 65 LYS HD2 1 65 LYS HE3 2.426 . 3.162 2.384 2.286 2.560 . 0 0 "[ . 1 . 2]" 1
1346 1 65 LYS HD2 1 65 LYS HG2 2.317 . 2.988 2.935 2.673 2.996 0.008 1 0 "[ . 1 . 2]" 1
1347 1 65 LYS HD2 1 65 LYS HG3 2.070 . 2.605 2.341 2.190 2.472 . 0 0 "[ . 1 . 2]" 1
1348 1 65 LYS HD3 1 65 LYS HE2 2.409 . 3.135 2.463 2.289 2.574 . 0 0 "[ . 1 . 2]" 1
1349 1 65 LYS HD3 1 65 LYS HE3 2.626 . 3.488 2.987 2.930 3.009 . 0 0 "[ . 1 . 2]" 1
1350 1 65 LYS HD3 1 65 LYS HG2 2.527 . 3.325 2.572 2.376 2.920 . 0 0 "[ . 1 . 2]" 1
1351 1 65 LYS HD3 1 65 LYS HG3 2.522 . 3.317 2.941 2.682 3.003 . 0 0 "[ . 1 . 2]" 1
1352 1 65 LYS HD3 1 66 VAL H 3.569 . 5.161 4.793 4.312 5.332 0.171 13 0 "[ . 1 . 2]" 1
1353 1 65 LYS HE2 1 65 LYS HG2 2.621 . 3.480 2.298 2.114 2.592 . 0 0 "[ . 1 . 2]" 1
1354 1 65 LYS HE2 1 65 LYS HG3 2.442 . 3.188 3.105 2.490 3.617 0.429 3 0 "[ . 1 . 2]" 1
1355 1 65 LYS HE3 1 65 LYS HG2 2.554 . 3.369 2.835 2.333 3.391 0.022 17 0 "[ . 1 . 2]" 1
1356 1 65 LYS HE3 1 65 LYS HG3 2.854 . 3.872 2.731 2.194 3.449 . 0 0 "[ . 1 . 2]" 1
1357 1 65 LYS HG2 1 66 VAL H 3.497 . 5.025 3.706 2.888 4.443 . 0 0 "[ . 1 . 2]" 1
1358 1 65 LYS HG3 1 66 VAL H 3.148 . 4.387 4.576 4.037 5.131 0.744 13 4 "[ - .* 1 + . * 2]" 1
1359 1 66 VAL H 1 66 VAL HA 2.632 . 3.498 2.927 2.897 2.939 . 0 0 "[ . 1 . 2]" 1
1360 1 66 VAL H 1 66 VAL QG 2.464 . 3.223 2.013 1.799 2.403 . 0 0 "[ . 1 . 2]" 1
1361 1 66 VAL H 1 67 ASP H 3.103 . 4.306 4.340 4.026 4.504 0.198 20 0 "[ . 1 . 2]" 1
1362 1 66 VAL HA 1 66 VAL HB 2.306 . 2.971 2.491 2.192 3.008 0.037 7 0 "[ . 1 . 2]" 1
1363 1 66 VAL HA 1 66 VAL QG 2.108 . 2.664 2.279 2.124 2.602 . 0 0 "[ . 1 . 2]" 1
1364 1 66 VAL HA 1 67 ASP H 2.286 . 2.939 2.227 2.075 2.629 . 0 0 "[ . 1 . 2]" 1
1365 1 66 VAL HB 1 66 VAL QG 1.714 . 2.081 1.891 1.883 1.897 . 0 0 "[ . 1 . 2]" 1
1366 1 66 VAL HB 1 67 ASP H 3.008 . 4.139 3.007 1.850 4.320 0.181 13 0 "[ . 1 . 2]" 1
1367 1 66 VAL QG 1 67 ASP H 3.017 . 4.155 3.288 2.872 3.671 . 0 0 "[ . 1 . 2]" 1
1368 1 66 VAL QG 1 68 GLU H 3.508 . 5.047 4.051 2.368 4.979 . 0 0 "[ . 1 . 2]" 1
1369 1 66 VAL QG 1 68 GLU HA 3.054 . 4.220 4.135 3.714 4.347 0.127 18 0 "[ . 1 . 2]" 1
1370 1 66 VAL QG 1 83 LYS HA 2.965 . 4.064 3.779 3.199 4.147 0.083 15 0 "[ . 1 . 2]" 1
1371 1 66 VAL QG 1 84 PRO HA 2.869 . 3.165 1.962 1.706 3.353 0.188 15 0 "[ . 1 . 2]" 1
1372 1 66 VAL QG 1 84 PRO HB2 2.935 . 4.011 3.743 3.387 3.927 . 0 0 "[ . 1 . 2]" 1
1373 1 66 VAL QG 1 84 PRO HB3 2.519 . 3.312 2.646 2.172 3.012 . 0 0 "[ . 1 . 2]" 1
1374 1 66 VAL QG 1 84 PRO QD 3.125 . 3.847 3.042 2.604 3.445 . 0 0 "[ . 1 . 2]" 1
1375 1 66 VAL QG 1 84 PRO HG2 2.833 . 3.837 3.589 2.778 4.040 0.203 18 0 "[ . 1 . 2]" 1
1376 1 66 VAL QG 1 84 PRO HG3 2.471 . 3.234 2.326 1.663 2.916 0.045 15 0 "[ . 1 . 2]" 1
1377 1 67 ASP H 1 67 ASP HB2 3.052 . 4.216 2.703 2.284 3.765 . 0 0 "[ . 1 . 2]" 1
1378 1 67 ASP H 1 67 ASP HB3 2.956 . 4.048 3.148 2.394 3.732 . 0 0 "[ . 1 . 2]" 1
1379 1 67 ASP H 1 68 GLU H 3.376 . 4.801 4.257 3.609 4.632 . 0 0 "[ . 1 . 2]" 1
1380 1 67 ASP HA 1 67 ASP HB2 2.346 . 3.034 2.745 2.393 3.030 . 0 0 "[ . 1 . 2]" 1
1381 1 67 ASP HA 1 67 ASP HB3 2.323 . 2.998 2.684 2.418 3.028 0.030 9 0 "[ . 1 . 2]" 1
1382 1 67 ASP HA 1 68 GLU H 2.007 . 2.510 2.238 2.116 2.464 . 0 0 "[ . 1 . 2]" 1
1383 1 68 GLU H 1 68 GLU HA 2.478 . 3.245 2.805 2.723 2.878 . 0 0 "[ . 1 . 2]" 1
1384 1 68 GLU H 1 68 GLU HB2 2.406 . 3.130 2.530 2.005 3.602 0.472 5 0 "[ . 1 . 2]" 1
1385 1 68 GLU H 1 68 GLU HB3 2.684 . 3.584 3.411 2.522 3.629 0.045 18 0 "[ . 1 . 2]" 1
1386 1 68 GLU H 1 68 GLU HG2 2.841 . 3.850 3.268 2.131 3.959 0.109 18 0 "[ . 1 . 2]" 1
1387 1 68 GLU H 1 68 GLU HG3 2.926 . 3.996 3.390 1.768 4.055 0.088 4 0 "[ . 1 . 2]" 1
1388 1 68 GLU H 1 69 SER H 2.650 . 3.527 2.692 2.310 3.156 . 0 0 "[ . 1 . 2]" 1
1389 1 68 GLU HA 1 68 GLU HB2 2.214 . 2.827 2.911 2.391 3.003 0.176 9 0 "[ . 1 . 2]" 1
1390 1 68 GLU HA 1 68 GLU HB3 2.249 . 2.881 2.504 2.229 2.832 . 0 0 "[ . 1 . 2]" 1
1391 1 68 GLU HA 1 68 GLU HG3 2.510 . 3.297 3.103 2.382 4.199 0.902 5 1 "[ + 1 . 2]" 1
1392 1 68 GLU HA 1 69 SER H 2.871 . 3.901 3.424 3.179 3.676 . 0 0 "[ . 1 . 2]" 1
1393 1 68 GLU HB2 1 68 GLU HG2 1.868 . 2.304 2.425 2.352 2.569 0.265 14 0 "[ . 1 . 2]" 1
1394 1 68 GLU HB2 1 68 GLU HG3 2.205 . 2.813 2.730 2.224 2.978 0.165 2 0 "[ . 1 . 2]" 1
1395 1 68 GLU HB2 1 69 SER H 3.382 . 4.812 3.201 2.167 4.106 . 0 0 "[ . 1 . 2]" 1
1396 1 68 GLU HB3 1 68 GLU HG2 1.934 . 2.402 2.611 2.221 2.975 0.573 15 8 "[ * * *1* *-+ * 2]" 1
1397 1 68 GLU HB3 1 68 GLU HG3 2.012 . 2.518 2.436 2.361 2.599 0.081 18 0 "[ . 1 . 2]" 1
1398 1 68 GLU HB3 1 69 SER H 3.467 . 4.969 3.884 3.169 4.273 . 0 0 "[ . 1 . 2]" 1
1399 1 69 SER H 1 69 SER HA 2.596 . 3.439 2.858 2.733 2.940 . 0 0 "[ . 1 . 2]" 1
1400 1 69 SER H 1 69 SER HB2 2.861 . 3.884 3.274 2.504 3.663 . 0 0 "[ . 1 . 2]" 1
1401 1 69 SER H 1 69 SER HB3 2.533 . 3.335 3.042 2.578 3.639 0.304 3 0 "[ . 1 . 2]" 1
1402 1 69 SER H 1 70 LYS H 3.147 . 4.385 2.561 2.266 2.994 . 0 0 "[ . 1 . 2]" 1
1403 1 69 SER HA 1 69 SER HB2 2.114 . 2.672 2.667 2.475 2.979 0.307 9 0 "[ . 1 . 2]" 1
1404 1 69 SER HA 1 69 SER HB3 2.093 . 2.640 2.391 2.296 2.982 0.342 17 0 "[ . 1 . 2]" 1
1405 1 70 LYS H 1 70 LYS QB 2.793 . 3.208 2.349 2.073 2.632 . 0 0 "[ . 1 . 2]" 1
1406 1 70 LYS H 1 70 LYS HD3 3.401 . 4.847 4.429 2.163 5.301 0.454 4 0 "[ . 1 . 2]" 1
1407 1 70 LYS H 1 70 LYS HG2 3.057 . 4.225 3.924 2.871 4.433 0.208 2 0 "[ . 1 . 2]" 1
1408 1 70 LYS H 1 70 LYS HG3 3.097 . 4.296 3.544 1.847 4.565 0.269 18 0 "[ . 1 . 2]" 1
1409 1 70 LYS HA 1 70 LYS QB 2.415 . 2.746 2.403 2.293 2.510 . 0 0 "[ . 1 . 2]" 1
1410 1 70 LYS HA 1 70 LYS HG2 2.334 . 3.015 2.861 2.354 3.641 0.626 6 3 "[ .+ 1 -*. 2]" 1
1411 1 70 LYS HA 1 70 LYS HG3 2.691 . 3.596 2.927 2.406 3.637 0.041 19 0 "[ . 1 . 2]" 1
1412 1 70 LYS QB 1 70 LYS HD3 1.906 . 2.360 2.474 2.164 3.106 0.746 19 3 "[ . 1- .* +2]" 1
1413 1 70 LYS QB 1 70 LYS HE2 2.708 . 3.624 3.835 3.466 4.151 0.527 16 2 "[ . 1 .+ -2]" 1
1414 1 70 LYS QB 1 70 LYS HG2 2.618 . 3.171 2.296 2.135 2.403 . 0 0 "[ . 1 . 2]" 1
1415 1 70 LYS QB 1 70 LYS HG3 . . 2.406 2.295 2.108 2.429 0.023 15 0 "[ . 1 . 2]" 1
1416 1 70 LYS QB 1 71 LYS H 2.232 . 3.232 3.001 2.532 3.359 0.127 13 0 "[ . 1 . 2]" 1
1417 1 70 LYS HD3 1 70 LYS HE2 1.973 . 2.460 2.423 2.361 2.487 0.027 6 0 "[ . 1 . 2]" 1
1418 1 70 LYS HE2 1 70 LYS HG2 2.435 . 3.176 2.499 2.159 2.893 . 0 0 "[ . 1 . 2]" 1
1419 1 70 LYS HE2 1 70 LYS HG3 2.371 . 3.074 3.044 2.753 3.431 0.357 17 0 "[ . 1 . 2]" 1
1420 1 70 LYS HE3 1 70 LYS HG2 2.411 . 3.137 2.988 2.455 3.264 0.127 4 0 "[ . 1 . 2]" 1
1421 1 70 LYS HE3 1 70 LYS HG3 2.362 . 3.059 2.518 2.161 3.230 0.171 17 0 "[ . 1 . 2]" 1
1422 1 71 LYS H 1 71 LYS QB 2.510 . 3.297 2.262 2.095 2.421 . 0 0 "[ . 1 . 2]" 1
1423 1 71 LYS H 1 72 ARG H 3.512 . 5.053 4.564 4.388 4.637 . 0 0 "[ . 1 . 2]" 1
1424 1 71 LYS HA 1 71 LYS QB 2.325 . 3.001 2.381 2.309 2.498 . 0 0 "[ . 1 . 2]" 1
1425 1 71 LYS HA 1 71 LYS HD2 2.672 . 3.564 3.629 2.144 4.401 0.837 20 2 "[ . 1 . - +]" 1
1426 1 71 LYS HA 1 71 LYS HG2 2.458 . 3.213 3.154 2.251 3.501 0.288 9 0 "[ . 1 . 2]" 1
1427 1 71 LYS HA 1 71 LYS HG3 2.458 . 3.213 2.501 2.170 3.606 0.393 15 0 "[ . 1 . 2]" 1
1428 1 71 LYS HA 1 72 ARG H 2.154 . 2.734 2.325 2.058 2.543 . 0 0 "[ . 1 . 2]" 1
1429 1 71 LYS QB 1 71 LYS HD2 1.920 . 2.381 2.368 2.262 2.631 0.250 9 0 "[ . 1 . 2]" 1
1430 1 71 LYS QB 1 71 LYS HD3 1.979 . 2.468 2.347 2.146 2.546 0.078 12 0 "[ . 1 . 2]" 1
1431 1 71 LYS QB 1 71 LYS HE2 3.039 . 4.194 3.879 3.759 4.051 . 0 0 "[ . 1 . 2]" 1
1432 1 71 LYS QB 1 71 LYS HE3 3.276 . 4.618 3.957 3.720 4.016 . 0 0 "[ . 1 . 2]" 1
1433 1 71 LYS QB 1 71 LYS HG2 2.534 . 2.907 2.228 2.102 2.424 . 0 0 "[ . 1 . 2]" 1
1434 1 71 LYS QB 1 71 LYS HG3 1.971 . 2.456 2.364 2.101 2.450 . 0 0 "[ . 1 . 2]" 1
1435 1 71 LYS QB 1 72 ARG H 2.706 . 3.622 3.045 2.471 3.441 . 0 0 "[ . 1 . 2]" 1
1436 1 71 LYS HD2 1 71 LYS HE3 2.222 . 2.839 2.465 2.378 2.526 . 0 0 "[ . 1 . 2]" 1
1437 1 71 LYS HD3 1 71 LYS HE2 1.843 . 2.268 2.393 2.353 2.497 0.229 20 0 "[ . 1 . 2]" 1
1438 1 71 LYS HE2 1 71 LYS HG2 2.260 . 2.898 2.502 2.222 2.709 . 0 0 "[ . 1 . 2]" 1
1439 1 71 LYS HE2 1 71 LYS HG3 2.522 . 3.317 3.160 2.800 3.323 0.006 6 0 "[ . 1 . 2]" 1
1440 1 71 LYS HE3 1 71 LYS HG2 2.410 . 3.136 2.898 2.756 3.279 0.143 20 0 "[ . 1 . 2]" 1
1441 1 71 LYS HE3 1 71 LYS HG3 2.533 . 3.335 2.492 2.183 2.621 . 0 0 "[ . 1 . 2]" 1
1442 1 72 ARG H 1 72 ARG HA 2.614 . 3.468 2.864 2.747 2.944 . 0 0 "[ . 1 . 2]" 1
1443 1 72 ARG H 1 72 ARG QG 2.844 . 3.855 2.904 1.925 3.799 . 0 0 "[ . 1 . 2]" 1
1444 1 72 ARG HA 1 72 ARG HB2 2.300 . 2.961 2.811 2.292 3.017 0.056 4 0 "[ . 1 . 2]" 1
1445 1 72 ARG HA 1 72 ARG HB3 2.416 . 3.146 2.557 2.410 2.998 . 0 0 "[ . 1 . 2]" 1
1446 1 72 ARG HA 1 72 ARG HD2 3.207 . 4.493 4.422 3.186 5.453 0.960 17 1 "[ . 1 . + 2]" 1
1447 1 72 ARG HA 1 72 ARG QG 2.614 . 3.468 2.636 2.231 3.414 . 0 0 "[ . 1 . 2]" 1
1448 1 72 ARG HA 1 73 LYS H 2.194 . 2.795 2.364 2.129 2.596 . 0 0 "[ . 1 . 2]" 1
1449 1 72 ARG HB2 1 72 ARG HD2 2.909 . 3.967 3.171 2.327 4.166 0.199 18 0 "[ . 1 . 2]" 1
1450 1 72 ARG HB2 1 73 LYS H 2.755 . 3.704 3.441 2.332 4.394 0.690 14 1 "[ . 1 +. 2]" 1
1451 1 72 ARG HB3 1 72 ARG HD2 2.940 . 4.021 3.029 2.477 3.761 . 0 0 "[ . 1 . 2]" 1
1452 1 72 ARG HB3 1 72 ARG QG 1.899 . 2.350 2.314 2.116 2.380 0.030 18 0 "[ . 1 . 2]" 1
1453 1 72 ARG HB3 1 73 LYS H 3.144 . 4.380 2.888 2.060 4.441 0.061 17 0 "[ . 1 . 2]" 1
1454 1 72 ARG HD2 1 72 ARG QG 2.246 . 2.877 2.292 2.152 2.385 . 0 0 "[ . 1 . 2]" 1
1455 1 72 ARG HD2 1 73 LYS H 4.103 . 6.208 5.077 2.997 6.832 0.624 14 2 "[ . 1 +. - 2]" 1
1456 1 72 ARG QG 1 73 LYS H 2.992 . 4.111 3.484 2.319 4.191 0.080 17 0 "[ . 1 . 2]" 1
1457 1 73 LYS H 1 73 LYS HA 2.673 . 3.566 2.867 2.810 2.946 . 0 0 "[ . 1 . 2]" 1
1458 1 73 LYS H 1 73 LYS HG2 3.145 . 4.382 3.543 3.178 4.197 . 0 0 "[ . 1 . 2]" 1
1459 1 73 LYS H 1 73 LYS HG3 3.343 . 4.740 2.539 1.810 4.509 0.136 16 0 "[ . 1 . 2]" 1
1460 1 73 LYS HA 1 73 LYS QB 2.245 . 2.875 2.292 2.081 2.451 . 0 0 "[ . 1 . 2]" 1
1461 1 73 LYS HA 1 73 LYS QD 2.991 . 4.110 3.744 2.324 4.029 . 0 0 "[ . 1 . 2]" 1
1462 1 73 LYS HA 1 73 LYS HG2 2.958 . 4.052 3.001 2.283 4.198 0.146 10 0 "[ . 1 . 2]" 1
1463 1 73 LYS HA 1 73 LYS HG3 2.729 . 3.660 3.290 2.927 3.833 0.173 14 0 "[ . 1 . 2]" 1
1464 1 73 LYS HA 1 74 ASP H 1.985 . 2.477 2.316 2.024 2.544 0.067 18 0 "[ . 1 . 2]" 1
1465 1 73 LYS QB 1 73 LYS QD 2.222 . 2.839 2.215 2.070 2.389 . 0 0 "[ . 1 . 2]" 1
1466 1 73 LYS QB 1 73 LYS HG2 1.986 . 2.479 2.304 2.130 2.435 . 0 0 "[ . 1 . 2]" 1
1467 1 73 LYS QB 1 73 LYS HG3 2.330 . 3.009 2.316 2.131 2.486 . 0 0 "[ . 1 . 2]" 1
1468 1 73 LYS QB 1 74 ASP H 2.474 . 3.239 2.532 2.103 3.483 0.244 17 0 "[ . 1 . 2]" 1
1469 1 73 LYS QB 1 77 GLY H 3.576 . 5.175 3.841 3.449 4.757 . 0 0 "[ . 1 . 2]" 1
1470 1 73 LYS QB 1 77 GLY QA 2.685 . 3.586 2.221 1.821 2.960 . 0 0 "[ . 1 . 2]" 1
1471 1 73 LYS QD 1 74 ASP H 3.355 . 4.762 4.211 3.698 4.645 . 0 0 "[ . 1 . 2]" 1
1472 1 73 LYS QD 1 77 GLY QA 3.027 . 4.172 2.787 1.762 3.530 0.141 16 0 "[ . 1 . 2]" 1
1473 1 73 LYS HG2 1 79 GLU HA 3.308 . 4.676 2.991 1.981 4.781 0.105 17 0 "[ . 1 . 2]" 1
1474 1 73 LYS HG3 1 74 ASP H 3.860 . 5.722 4.842 3.341 5.510 . 0 0 "[ . 1 . 2]" 1
1475 1 73 LYS HG3 1 79 GLU HA 2.809 . 3.795 3.943 3.179 4.747 0.952 14 3 "[ .- 1 +. * 2]" 1
1476 1 74 ASP H 1 74 ASP HA 2.535 . 3.339 2.884 2.802 2.947 . 0 0 "[ . 1 . 2]" 1
1477 1 74 ASP H 1 74 ASP HB2 2.546 . 3.356 2.580 2.359 3.830 0.474 17 0 "[ . 1 . 2]" 1
1478 1 74 ASP H 1 74 ASP HB3 2.827 . 3.826 2.651 2.338 3.047 . 0 0 "[ . 1 . 2]" 1
1479 1 74 ASP H 1 76 GLU H 3.487 . 5.007 4.642 3.946 5.011 0.004 18 0 "[ . 1 . 2]" 1
1480 1 74 ASP H 1 77 GLY H 3.370 . 4.789 3.769 2.215 4.297 . 0 0 "[ . 1 . 2]" 1
1481 1 74 ASP H 1 77 GLY QA 3.651 . 5.317 3.392 1.990 3.834 . 0 0 "[ . 1 . 2]" 1
1482 1 74 ASP H 1 78 ASN HB2 3.383 . 4.813 2.872 1.994 4.113 . 0 0 "[ . 1 . 2]" 1
1483 1 74 ASP H 1 79 GLU HA 3.165 . 4.418 4.228 3.161 4.821 0.403 19 0 "[ . 1 . 2]" 1
1484 1 74 ASP H 1 80 VAL QG 2.690 . 3.595 3.260 2.376 5.484 1.889 17 1 "[ . 1 . + 2]" 1
1485 1 74 ASP HA 1 74 ASP HB2 2.151 . 2.729 2.534 2.404 2.632 . 0 0 "[ . 1 . 2]" 1
1486 1 74 ASP HA 1 74 ASP HB3 2.238 . 2.864 2.974 2.518 3.010 0.146 7 0 "[ . 1 . 2]" 1
1487 1 74 ASP HA 1 75 ASN H 3.064 . 4.237 2.726 2.515 2.945 . 0 0 "[ . 1 . 2]" 1
1488 1 74 ASP HB2 1 75 ASN H 3.475 . 4.985 3.602 1.906 3.832 0.059 17 0 "[ . 1 . 2]" 1
1489 1 74 ASP HB2 1 80 VAL QG 2.500 . 3.281 2.851 1.937 3.991 0.710 17 1 "[ . 1 . + 2]" 1
1490 1 74 ASP HB3 1 75 ASN H 2.973 . 4.078 2.978 2.334 3.643 . 0 0 "[ . 1 . 2]" 1
1491 1 74 ASP HB3 1 76 GLU H 3.266 . 4.599 2.972 2.659 4.298 . 0 0 "[ . 1 . 2]" 1
1492 1 74 ASP HB3 1 80 VAL QG 2.931 . 4.005 3.635 2.767 4.032 0.027 13 0 "[ . 1 . 2]" 1
1493 1 75 ASN H 1 75 ASN HB3 3.184 . 4.451 2.831 2.398 3.610 . 0 0 "[ . 1 . 2]" 1
1494 1 75 ASN HA 1 75 ASN HB3 2.003 . 2.504 2.636 2.395 3.031 0.527 8 5 "[ .-*+ * . * 2]" 1
1495 1 75 ASN HA 1 76 GLU H 2.748 . 3.692 3.498 3.402 3.539 . 0 0 "[ . 1 . 2]" 1
1496 1 75 ASN HA 1 77 GLY H 3.249 . 4.569 3.648 3.429 4.689 0.120 17 0 "[ . 1 . 2]" 1
1497 1 75 ASN HB3 1 76 GLU H 2.969 . 4.071 3.645 2.794 4.283 0.212 11 0 "[ . 1 . 2]" 1
1498 1 76 GLU H 1 76 GLU HA 2.485 . 3.257 2.920 2.867 2.946 . 0 0 "[ . 1 . 2]" 1
1499 1 76 GLU H 1 76 GLU QB 2.355 . 3.048 2.525 2.372 2.732 . 0 0 "[ . 1 . 2]" 1
1500 1 76 GLU H 1 76 GLU QG 2.382 . 3.091 2.363 1.894 2.819 . 0 0 "[ . 1 . 2]" 1
1501 1 76 GLU H 1 78 ASN H 2.833 . 3.836 3.605 2.779 4.075 0.239 1 0 "[ . 1 . 2]" 1
1502 1 76 GLU HA 1 76 GLU QB 2.424 . 3.111 2.291 2.166 2.414 . 0 0 "[ . 1 . 2]" 1
1503 1 76 GLU HA 1 77 GLY H 2.606 . 3.455 3.129 2.983 3.506 0.051 17 0 "[ . 1 . 2]" 1
1504 1 76 GLU QB 1 77 GLY H 3.463 . 4.962 3.663 2.582 4.009 . 0 0 "[ . 1 . 2]" 1
1505 1 76 GLU QB 1 78 ASN H 3.181 . 4.445 3.607 2.679 4.160 . 0 0 "[ . 1 . 2]" 1
1506 1 77 GLY H 1 77 GLY QA 2.431 . 2.942 2.219 2.173 2.365 . 0 0 "[ . 1 . 2]" 1
1507 1 77 GLY H 1 78 ASN H 2.380 . 3.088 2.782 1.974 3.350 0.262 3 0 "[ . 1 . 2]" 1
1508 1 77 GLY QA 1 78 ASN H 2.184 . 2.780 2.653 2.407 2.841 0.061 7 0 "[ . 1 . 2]" 1
1509 1 78 ASN H 1 78 ASN HB2 2.388 . 3.101 2.605 2.186 3.275 0.174 3 0 "[ . 1 . 2]" 1
1510 1 78 ASN H 1 78 ASN HB3 2.820 . 3.814 3.660 2.964 4.008 0.194 20 0 "[ . 1 . 2]" 1
1511 1 78 ASN H 1 78 ASN HD21 3.463 . 4.962 3.884 1.955 4.972 0.010 7 0 "[ . 1 . 2]" 1
1512 1 78 ASN H 1 79 GLU H 2.715 . 3.637 3.348 2.231 4.444 0.807 5 3 "[ + * 1 - 2]" 1
1513 1 78 ASN HA 1 78 ASN HB2 2.330 . 3.009 2.949 2.687 3.028 0.019 17 0 "[ . 1 . 2]" 1
1514 1 78 ASN HA 1 78 ASN HB3 2.134 . 2.703 2.630 2.475 2.936 0.233 14 0 "[ . 1 . 2]" 1
1515 1 78 ASN HB2 1 79 GLU H 3.057 . 4.225 3.318 2.109 4.393 0.168 7 0 "[ . 1 . 2]" 1
1516 1 78 ASN HB2 1 80 VAL QG 3.233 . 4.540 2.637 2.133 4.336 . 0 0 "[ . 1 . 2]" 1
1517 1 78 ASN HB3 1 79 GLU H 2.631 . 3.497 3.426 2.924 3.654 0.157 8 0 "[ . 1 . 2]" 1
1518 1 78 ASN HB3 1 80 VAL QG 3.203 . 4.485 2.154 1.715 4.506 0.206 18 0 "[ . 1 . 2]" 1
1519 1 79 GLU H 1 79 GLU HA 2.559 . 3.378 2.422 2.240 2.844 . 0 0 "[ . 1 . 2]" 1
1520 1 79 GLU H 1 79 GLU HG2 2.951 . 4.040 3.440 1.945 4.418 0.378 17 0 "[ . 1 . 2]" 1
1521 1 79 GLU H 1 79 GLU HG3 3.508 . 5.046 3.627 2.547 5.025 . 0 0 "[ . 1 . 2]" 1
1522 1 79 GLU H 1 80 VAL H 2.772 . 3.732 3.234 2.509 3.839 0.107 8 0 "[ . 1 . 2]" 1
1523 1 79 GLU HA 1 79 GLU HB2 2.176 . 2.768 2.752 2.416 3.032 0.264 20 0 "[ . 1 . 2]" 1
1524 1 79 GLU HA 1 79 GLU HG2 2.942 . 4.024 2.929 2.300 3.814 . 0 0 "[ . 1 . 2]" 1
1525 1 79 GLU HA 1 79 GLU HG3 2.711 . 3.629 3.323 2.620 3.801 0.172 18 0 "[ . 1 . 2]" 1
1526 1 79 GLU HA 1 80 VAL H 1.969 . 2.454 2.431 2.265 3.440 0.986 17 1 "[ . 1 . + 2]" 1
1527 1 79 GLU HA 1 80 VAL QG 2.948 . 4.034 3.590 3.381 3.814 . 0 0 "[ . 1 . 2]" 1
1528 1 79 GLU HB2 1 79 GLU HG2 2.359 . 3.055 2.875 2.461 3.002 . 0 0 "[ . 1 . 2]" 1
1529 1 79 GLU HB2 1 79 GLU HG3 1.885 . 2.329 2.443 2.255 2.968 0.639 15 1 "[ . 1 + 2]" 1
1530 1 79 GLU HG2 1 80 VAL H 3.786 . 5.577 4.774 3.201 5.922 0.345 15 0 "[ . 1 . 2]" 1
1531 1 79 GLU HG3 1 80 VAL H 3.966 . 5.932 5.003 4.348 5.784 . 0 0 "[ . 1 . 2]" 1
1532 1 80 VAL H 1 80 VAL HA 2.651 . 3.529 2.885 2.855 2.935 . 0 0 "[ . 1 . 2]" 1
1533 1 80 VAL H 1 80 VAL QG 2.443 . 3.186 1.920 1.821 2.147 . 0 0 "[ . 1 . 2]" 1
1534 1 80 VAL HA 1 80 VAL HB 2.376 . 3.082 2.393 2.223 2.512 . 0 0 "[ . 1 . 2]" 1
1535 1 80 VAL HA 1 80 VAL QG 2.043 . 2.565 2.362 2.165 2.591 0.026 14 0 "[ . 1 . 2]" 1
1536 1 80 VAL HA 1 81 VAL H 2.134 . 2.703 2.218 2.110 2.362 . 0 0 "[ . 1 . 2]" 1
1537 1 80 VAL HB 1 80 VAL QG 1.888 . 2.154 1.894 1.884 1.901 . 0 0 "[ . 1 . 2]" 1
1538 1 80 VAL HB 1 81 VAL H 2.773 . 3.734 2.975 2.694 3.691 . 0 0 "[ . 1 . 2]" 1
1539 1 80 VAL QG 1 81 VAL H 2.903 . 3.956 3.310 2.858 3.502 . 0 0 "[ . 1 . 2]" 1
1540 1 80 VAL QG 1 82 PRO HA 2.901 . 3.953 3.822 2.978 4.037 0.084 14 0 "[ . 1 . 2]" 1
1541 1 80 VAL QG 1 83 LYS H 3.678 . 5.369 5.368 4.551 5.670 0.301 18 0 "[ . 1 . 2]" 1
1542 1 81 VAL H 1 81 VAL HA 2.783 . 3.751 2.878 2.715 2.936 . 0 0 "[ . 1 . 2]" 1
1543 1 81 VAL H 1 81 VAL HB 2.562 . 3.382 2.779 2.383 3.206 . 0 0 "[ . 1 . 2]" 1
1544 1 81 VAL H 1 81 VAL MG1 2.578 . 3.409 2.454 1.871 3.912 0.503 14 1 "[ . 1 +. 2]" 1
1545 1 81 VAL H 1 81 VAL MG2 2.737 . 3.673 3.444 1.976 3.821 0.148 20 0 "[ . 1 . 2]" 1
1546 1 81 VAL HA 1 81 VAL HB 2.379 . 3.087 2.576 2.392 3.030 . 0 0 "[ . 1 . 2]" 1
1547 1 81 VAL HA 1 81 VAL MG1 2.457 . 3.212 2.989 2.157 3.223 0.011 5 0 "[ . 1 . 2]" 1
1548 1 81 VAL HA 1 81 VAL MG2 2.079 . 2.619 2.365 2.252 2.480 . 0 0 "[ . 1 . 2]" 1
1549 1 81 VAL HA 1 82 PRO QD 2.030 . 2.545 1.941 1.809 2.003 . 0 0 "[ . 1 . 2]" 1
1550 1 81 VAL HB 1 81 VAL MG2 1.993 . 2.489 2.122 2.112 2.132 . 0 0 "[ . 1 . 2]" 1
1551 1 81 VAL MG2 1 82 PRO QD 2.630 . 3.223 2.501 1.879 3.804 0.581 14 1 "[ . 1 +. 2]" 1
1552 1 82 PRO HA 1 82 PRO HB2 2.074 . 2.612 2.685 2.608 2.739 0.127 19 0 "[ . 1 . 2]" 1
1553 1 82 PRO HA 1 82 PRO HB3 2.270 . 2.914 2.275 2.234 2.323 . 0 0 "[ . 1 . 2]" 1
1554 1 82 PRO HA 1 82 PRO QD 3.333 . 4.722 3.422 3.217 3.526 . 0 0 "[ . 1 . 2]" 1
1555 1 82 PRO HA 1 82 PRO HG2 2.744 . 3.685 3.846 3.797 3.957 0.272 15 0 "[ . 1 . 2]" 1
1556 1 82 PRO HA 1 82 PRO HG3 2.858 . 3.879 3.937 3.795 4.004 0.125 17 0 "[ . 1 . 2]" 1
1557 1 82 PRO HA 1 83 LYS H 1.954 . 2.431 2.206 2.025 2.482 0.051 18 0 "[ . 1 . 2]" 1
1558 1 82 PRO HB2 1 82 PRO QD 3.040 . 4.045 3.511 3.401 3.538 . 0 0 "[ . 1 . 2]" 1
1559 1 82 PRO HB2 1 82 PRO HG2 1.934 . 2.401 2.257 2.202 2.280 . 0 0 "[ . 1 . 2]" 1
1560 1 82 PRO HB2 1 83 LYS H 2.866 . 3.893 3.238 2.418 3.846 . 0 0 "[ . 1 . 2]" 1
1561 1 82 PRO HB3 1 82 PRO QD 3.005 . 3.528 3.010 2.842 3.316 . 0 0 "[ . 1 . 2]" 1
1562 1 82 PRO HB3 1 82 PRO HG2 2.208 . 2.817 2.930 2.860 2.949 0.132 17 0 "[ . 1 . 2]" 1
1563 1 82 PRO HB3 1 83 LYS H 2.833 . 3.837 3.814 3.164 4.133 0.296 14 0 "[ . 1 . 2]" 1
1564 1 82 PRO QD 1 82 PRO HG2 2.303 . 2.802 2.206 2.170 2.240 . 0 0 "[ . 1 . 2]" 1
1565 1 82 PRO QD 1 82 PRO HG3 2.510 . 3.031 2.186 2.180 2.204 . 0 0 "[ . 1 . 2]" 1
1566 1 83 LYS H 1 83 LYS HA 2.548 . 3.359 2.858 2.687 2.956 . 0 0 "[ . 1 . 2]" 1
1567 1 83 LYS H 1 83 LYS HB2 2.359 . 3.055 2.781 2.273 3.659 0.604 17 5 "[ . - * . +* *]" 1
1568 1 83 LYS H 1 83 LYS HB3 2.626 . 3.488 3.414 2.702 3.740 0.252 14 0 "[ . 1 . 2]" 1
1569 1 83 LYS H 1 83 LYS HG2 2.960 . 4.055 2.915 1.944 3.973 . 0 0 "[ . 1 . 2]" 1
1570 1 83 LYS H 1 83 LYS HG3 2.713 . 3.633 2.896 2.035 3.725 0.092 7 0 "[ . 1 . 2]" 1
1571 1 83 LYS HA 1 83 LYS HB2 2.474 . 3.239 2.878 2.425 3.039 . 0 0 "[ . 1 . 2]" 1
1572 1 83 LYS HA 1 83 LYS HB3 2.428 . 3.165 2.435 2.345 2.607 . 0 0 "[ . 1 . 2]" 1
1573 1 83 LYS HA 1 83 LYS HG2 2.697 . 3.606 3.069 2.504 3.744 0.138 12 0 "[ . 1 . 2]" 1
1574 1 83 LYS HA 1 83 LYS HG3 2.711 . 3.630 3.325 2.364 3.746 0.116 17 0 "[ . 1 . 2]" 1
1575 1 83 LYS HA 1 84 PRO QD 2.209 . 2.819 1.718 1.640 1.827 . 0 0 "[ . 1 . 2]" 1
1576 1 83 LYS HA 1 84 PRO HG2 2.950 . 4.038 4.224 4.134 4.414 0.376 15 0 "[ . 1 . 2]" 1
1577 1 83 LYS HA 1 84 PRO HG3 2.814 . 3.804 3.897 3.731 3.957 0.153 19 0 "[ . 1 . 2]" 1
1578 1 83 LYS HB2 1 83 LYS HG2 2.298 . 2.958 2.827 2.404 3.001 0.043 8 0 "[ . 1 . 2]" 1
1579 1 83 LYS HB2 1 83 LYS HG3 2.293 . 2.950 2.487 2.372 3.002 0.052 9 0 "[ . 1 . 2]" 1
1580 1 83 LYS HB2 1 84 PRO QD 3.285 . 4.554 3.837 3.138 4.133 . 0 0 "[ . 1 . 2]" 1
1581 1 83 LYS HB3 1 83 LYS HG2 2.234 . 2.858 2.527 2.357 2.990 0.132 1 0 "[ . 1 . 2]" 1
1582 1 83 LYS HB3 1 83 LYS HG3 2.141 . 2.714 2.823 2.392 2.996 0.282 18 0 "[ . 1 . 2]" 1
1583 1 83 LYS HB3 1 84 PRO QD 2.840 . 3.417 3.201 2.309 3.769 0.352 12 0 "[ . 1 . 2]" 1
1584 1 84 PRO HA 1 84 PRO HB2 2.331 . 3.010 2.947 2.853 2.977 . 0 0 "[ . 1 . 2]" 1
1585 1 84 PRO HA 1 84 PRO HB3 2.144 . 2.718 2.282 2.235 2.314 . 0 0 "[ . 1 . 2]" 1
1586 1 84 PRO HA 1 84 PRO QD 3.081 . 4.268 3.402 3.269 3.466 . 0 0 "[ . 1 . 2]" 1
1587 1 84 PRO HA 1 84 PRO HG2 2.781 . 3.748 3.910 3.811 4.004 0.256 18 0 "[ . 1 . 2]" 1
1588 1 84 PRO HA 1 85 GLN H 2.062 . 2.593 2.192 2.128 2.285 . 0 0 "[ . 1 . 2]" 1
1589 1 84 PRO HB2 1 84 PRO QD 2.583 . 3.417 2.764 2.686 2.917 . 0 0 "[ . 1 . 2]" 1
1590 1 84 PRO HB2 1 84 PRO HG2 1.847 . 2.274 2.310 2.242 2.336 0.062 19 0 "[ . 1 . 2]" 1
1591 1 84 PRO HB2 1 85 GLN H 2.793 . 3.768 3.748 3.297 3.932 0.164 15 0 "[ . 1 . 2]" 1
1592 1 84 PRO HB3 1 84 PRO QD 3.330 . 4.716 3.499 3.488 3.521 . 0 0 "[ . 1 . 2]" 1
1593 1 84 PRO HB3 1 84 PRO HG2 2.181 . 2.775 2.638 2.612 2.694 . 0 0 "[ . 1 . 2]" 1
1594 1 84 PRO HB3 1 84 PRO HG3 2.025 . 2.538 2.330 2.276 2.347 . 0 0 "[ . 1 . 2]" 1
1595 1 84 PRO HB3 1 85 GLN H 2.674 . 3.568 3.428 3.135 3.680 0.112 15 0 "[ . 1 . 2]" 1
1596 1 84 PRO QD 1 84 PRO HG2 2.313 . 2.982 2.165 2.151 2.186 . 0 0 "[ . 1 . 2]" 1
1597 1 84 PRO QD 1 84 PRO HG3 2.269 . 2.912 2.218 2.193 2.239 . 0 0 "[ . 1 . 2]" 1
1598 1 85 GLN H 1 85 GLN HA 2.587 . 3.423 2.885 2.840 2.930 . 0 0 "[ . 1 . 2]" 1
1599 1 85 GLN H 1 85 GLN HB2 2.350 . 3.040 2.644 2.392 3.601 0.561 1 3 "[+ . * 1 . - 2]" 1
1600 1 85 GLN H 1 85 GLN HG2 2.855 . 3.874 3.319 1.687 3.784 0.149 17 0 "[ . 1 . 2]" 1
1601 1 85 GLN H 1 85 GLN HG3 2.674 . 3.568 2.420 2.159 2.810 . 0 0 "[ . 1 . 2]" 1
1602 1 85 GLN H 1 86 ARG H 3.144 . 4.380 4.406 4.341 4.466 0.086 13 0 "[ . 1 . 2]" 1
1603 1 85 GLN HA 1 85 GLN HB2 2.296 . 2.955 2.944 2.524 3.022 0.067 13 0 "[ . 1 . 2]" 1
1604 1 85 GLN HA 1 85 GLN HB3 2.235 . 2.859 2.448 2.319 2.520 . 0 0 "[ . 1 . 2]" 1
1605 1 85 GLN HA 1 85 GLN HG2 2.603 . 3.450 2.733 2.447 3.580 0.130 1 0 "[ . 1 . 2]" 1
1606 1 85 GLN HA 1 85 GLN HG3 2.472 . 3.236 3.157 2.997 3.714 0.478 17 0 "[ . 1 . 2]" 1
1607 1 85 GLN HA 1 86 ARG H 2.028 . 2.542 2.154 2.086 2.220 . 0 0 "[ . 1 . 2]" 1
1608 1 85 GLN HB2 1 85 GLN HG2 2.241 . 2.869 2.987 2.974 2.992 0.123 6 0 "[ . 1 . 2]" 1
1609 1 85 GLN HB2 1 85 GLN HG3 2.373 . 3.077 2.446 2.375 2.506 . 0 0 "[ . 1 . 2]" 1
1610 1 85 GLN HB3 1 85 GLN HG2 2.374 . 3.078 2.407 2.357 2.459 . 0 0 "[ . 1 . 2]" 1
1611 1 85 GLN HB3 1 85 GLN HG3 2.422 . 3.155 2.999 2.968 3.009 . 0 0 "[ . 1 . 2]" 1
1612 1 85 GLN HB3 1 86 ARG H 2.698 . 3.608 3.617 3.322 4.229 0.621 17 3 "[* . - 1 . + 2]" 1
1613 1 85 GLN HG2 1 86 ARG H 3.316 . 4.691 4.633 4.206 5.237 0.546 8 2 "[- . + 1 . 2]" 1
1614 1 86 ARG H 1 86 ARG HA 2.799 . 3.778 2.918 2.904 2.933 . 0 0 "[ . 1 . 2]" 1
1615 1 86 ARG H 1 86 ARG HB2 2.702 . 3.614 3.134 2.233 3.791 0.177 6 0 "[ . 1 . 2]" 1
1616 1 86 ARG H 1 86 ARG HB3 2.817 . 3.809 3.161 2.126 3.623 . 0 0 "[ . 1 . 2]" 1
1617 1 86 ARG H 1 86 ARG QD 3.294 . 4.651 3.779 3.089 4.561 . 0 0 "[ . 1 . 2]" 1
1618 1 86 ARG H 1 86 ARG QG 3.120 . 3.773 2.482 1.836 3.639 0.067 5 0 "[ . 1 . 2]" 1
1619 1 86 ARG H 1 87 HIS H 3.467 . 4.970 4.453 4.426 4.477 . 0 0 "[ . 1 . 2]" 1
1620 1 86 ARG HA 1 86 ARG HB2 2.544 . 3.353 2.613 2.261 3.001 . 0 0 "[ . 1 . 2]" 1
1621 1 86 ARG HA 1 86 ARG HB3 2.299 . 2.960 2.507 2.341 2.937 . 0 0 "[ . 1 . 2]" 1
1622 1 86 ARG HA 1 86 ARG QD 3.092 . 4.287 4.032 3.826 4.310 0.023 2 0 "[ . 1 . 2]" 1
1623 1 86 ARG HA 1 86 ARG QG 2.575 . 3.404 2.810 2.079 3.272 . 0 0 "[ . 1 . 2]" 1
1624 1 86 ARG HA 1 87 HIS H 2.290 . 2.946 2.200 2.079 2.312 . 0 0 "[ . 1 . 2]" 1
1625 1 86 ARG HA 1 87 HIS HA 3.157 . 4.403 4.388 4.338 4.429 0.026 3 0 "[ . 1 . 2]" 1
1626 1 86 ARG HA 1 87 HIS HD2 2.947 . 4.032 3.856 3.594 4.048 0.016 1 0 "[ . 1 . 2]" 1
1627 1 86 ARG HB2 1 86 ARG QD 2.239 . 2.866 2.516 2.079 2.778 . 0 0 "[ . 1 . 2]" 1
1628 1 86 ARG HB2 1 86 ARG QG 1.994 . 2.491 2.264 2.098 2.439 . 0 0 "[ . 1 . 2]" 1
1629 1 86 ARG HB2 1 87 HIS H 3.081 . 4.268 3.249 2.428 4.282 0.014 7 0 "[ . 1 . 2]" 1
1630 1 86 ARG HB3 1 86 ARG QD 2.063 . 2.595 2.343 2.024 2.728 0.133 7 0 "[ . 1 . 2]" 1
1631 1 86 ARG HB3 1 86 ARG QG 1.886 . 2.331 2.317 2.142 2.452 0.121 5 0 "[ . 1 . 2]" 1
1632 1 86 ARG HB3 1 87 HIS H 2.881 . 3.918 3.496 2.356 4.292 0.374 19 0 "[ . 1 . 2]" 1
1633 1 86 ARG QG 1 87 HIS H 3.110 . 3.918 3.534 2.781 3.744 . 0 0 "[ . 1 . 2]" 1
1634 1 87 HIS H 1 87 HIS HB2 2.954 . 4.045 2.701 2.588 2.808 . 0 0 "[ . 1 . 2]" 1
1635 1 87 HIS H 1 87 HIS HB3 3.050 . 4.213 3.762 3.711 3.867 . 0 0 "[ . 1 . 2]" 1
1636 1 87 HIS H 1 87 HIS HD2 2.767 . 3.724 3.040 2.527 3.569 . 0 0 "[ . 1 . 2]" 1
1637 1 87 HIS HA 1 87 HIS HB2 2.692 . 3.598 3.019 3.009 3.030 . 0 0 "[ . 1 . 2]" 1
1638 1 87 HIS HA 1 87 HIS HB3 2.422 . 3.155 2.415 2.377 2.476 . 0 0 "[ . 1 . 2]" 1
1639 1 87 HIS HA 1 87 HIS HD2 3.167 . 4.420 4.492 4.357 4.566 0.146 3 0 "[ . 1 . 2]" 1
1640 1 87 HIS HA 1 88 MET H 2.375 . 3.080 2.304 2.199 2.393 . 0 0 "[ . 1 . 2]" 1
1641 1 87 HIS HB2 1 87 HIS HD2 2.896 . 3.945 2.730 2.657 2.859 . 0 0 "[ . 1 . 2]" 1
1642 1 87 HIS HB2 1 88 MET H 3.458 . 4.953 3.876 3.562 4.206 . 0 0 "[ . 1 . 2]" 1
1643 1 87 HIS HB2 1 89 PHE HE1 2.896 . 3.945 2.361 1.923 3.626 . 0 0 "[ . 1 . 2]" 1
1644 1 87 HIS HB3 1 87 HIS HD2 3.040 . 4.195 3.829 3.758 3.919 . 0 0 "[ . 1 . 2]" 1
1645 1 87 HIS HB3 1 88 MET H 3.148 . 4.387 3.056 2.687 3.621 . 0 0 "[ . 1 . 2]" 1
1646 1 87 HIS HB3 1 89 PHE HE1 3.040 . 4.195 2.394 1.924 2.767 . 0 0 "[ . 1 . 2]" 1
1647 1 88 MET H 1 88 MET HA 2.947 . 4.033 2.943 2.935 2.951 . 0 0 "[ . 1 . 2]" 1
1648 1 88 MET H 1 88 MET HB2 2.694 . 3.602 2.926 2.603 3.131 . 0 0 "[ . 1 . 2]" 1
1649 1 88 MET H 1 88 MET HB3 2.676 . 3.571 2.896 2.716 3.726 0.155 5 0 "[ . 1 . 2]" 1
1650 1 88 MET H 1 88 MET QG 3.908 . 5.271 4.058 2.753 4.177 . 0 0 "[ . 1 . 2]" 1
1651 1 88 MET H 1 89 PHE H 3.285 . 4.634 4.338 4.258 4.424 . 0 0 "[ . 1 . 2]" 1
1652 1 88 MET HA 1 88 MET HB2 2.503 . 3.286 2.583 2.532 3.013 . 0 0 "[ . 1 . 2]" 1
1653 1 88 MET HA 1 88 MET HB3 2.569 . 3.394 2.978 2.425 3.021 . 0 0 "[ . 1 . 2]" 1
1654 1 88 MET HA 1 88 MET ME 3.164 . 4.415 4.161 4.003 4.593 0.178 5 0 "[ . 1 . 2]" 1
1655 1 88 MET HA 1 88 MET QG 2.687 . 3.475 2.359 2.311 2.440 . 0 0 "[ . 1 . 2]" 1
1656 1 88 MET HA 1 89 PHE H 2.314 . 2.983 2.152 2.114 2.199 . 0 0 "[ . 1 . 2]" 1
1657 1 88 MET HA 1 89 PHE HA 3.178 . 4.441 4.392 4.369 4.410 . 0 0 "[ . 1 . 2]" 1
1658 1 88 MET HB2 1 88 MET QG 2.575 . 3.369 2.264 2.217 2.401 . 0 0 "[ . 1 . 2]" 1
1659 1 88 MET HB2 1 89 PHE H 3.141 . 4.374 4.293 4.178 4.373 . 0 0 "[ . 1 . 2]" 1
1660 1 88 MET HB3 1 88 MET QG 2.066 . 2.600 2.409 2.255 2.453 . 0 0 "[ . 1 . 2]" 1
1661 1 88 MET HB3 1 89 PHE H 3.173 . 4.431 3.955 3.319 4.063 . 0 0 "[ . 1 . 2]" 1
1662 1 88 MET ME 1 88 MET QG 2.254 . 2.889 2.447 2.195 2.539 . 0 0 "[ . 1 . 2]" 1
1663 1 88 MET ME 2 6 PHE HA 6.000 . 6.000 4.183 3.253 5.214 . 0 0 "[ . 1 . 2]" 1
1664 1 88 MET ME 2 6 PHE QD 6.000 . 6.000 2.824 2.073 4.210 . 0 0 "[ . 1 . 2]" 1
1665 1 88 MET ME 2 6 PHE QE 6.000 . 6.000 3.936 2.532 5.148 . 0 0 "[ . 1 . 2]" 1
1666 1 88 MET ME 2 6 PHE HZ 5.000 . 5.000 5.171 3.455 6.446 1.446 11 6 "[* . 1+** . *- 2]" 1
1667 1 88 MET ME 2 9 TRP HE1 3.800 . 3.800 3.668 2.874 3.885 0.085 20 0 "[ . 1 . 2]" 1
1668 1 88 MET ME 2 10 TRP HE3 5.000 . 5.000 3.127 2.613 3.609 . 0 0 "[ . 1 . 2]" 1
1669 1 88 MET ME 2 10 TRP HZ3 5.000 . 5.000 2.839 2.374 3.345 . 0 0 "[ . 1 . 2]" 1
1670 1 88 MET QG 1 89 PHE H 3.162 . 4.412 2.638 2.273 4.127 . 0 0 "[ . 1 . 2]" 1
1671 1 88 MET QG 2 10 TRP HH2 5.000 . 5.000 2.920 2.570 3.332 . 0 0 "[ . 1 . 2]" 1
1672 1 88 MET QG 2 10 TRP HZ3 3.600 2.900 4.000 2.702 2.445 3.081 0.455 7 0 "[ . 1 . 2]" 1
1673 1 89 PHE H 1 89 PHE QB 2.994 . 4.114 2.666 2.593 2.754 . 0 0 "[ . 1 . 2]" 1
1674 1 89 PHE H 1 89 PHE HD1 2.894 . 3.941 2.826 2.323 4.277 0.336 20 0 "[ . 1 . 2]" 1
1675 1 89 PHE H 1 90 SER H 3.286 . 4.636 4.375 4.300 4.444 . 0 0 "[ . 1 . 2]" 1
1676 1 89 PHE HA 1 89 PHE QB 2.400 . 3.120 2.331 2.247 2.366 . 0 0 "[ . 1 . 2]" 1
1677 1 89 PHE HA 1 89 PHE HD1 2.714 . 3.635 3.544 2.736 3.781 0.146 6 0 "[ . 1 . 2]" 1
1678 1 89 PHE HA 1 90 SER H 2.251 . 2.884 2.192 2.127 2.251 . 0 0 "[ . 1 . 2]" 1
1679 1 89 PHE QB 1 89 PHE HD1 2.922 . 3.989 2.528 2.451 2.606 . 0 0 "[ . 1 . 2]" 1
1680 1 89 PHE QB 1 89 PHE HE1 3.349 . 4.751 4.459 4.404 4.497 . 0 0 "[ . 1 . 2]" 1
1681 1 89 PHE QB 1 90 SER H 2.919 . 3.984 2.977 2.713 3.237 . 0 0 "[ . 1 . 2]" 1
1682 1 89 PHE QB 1 91 PHE HE2 3.043 . 4.201 3.623 2.902 4.015 . 0 0 "[ . 1 . 2]" 1
1683 1 89 PHE QB 1 91 PHE HZ 3.077 . 4.260 3.630 3.436 3.955 . 0 0 "[ . 1 . 2]" 1
1684 1 90 SER H 1 90 SER HB2 3.112 . 4.323 2.604 2.410 2.794 . 0 0 "[ . 1 . 2]" 1
1685 1 90 SER H 1 90 SER HB3 2.956 . 4.049 3.130 2.625 3.680 . 0 0 "[ . 1 . 2]" 1
1686 1 90 SER HA 1 90 SER HB2 2.345 . 3.032 2.775 2.526 3.033 0.001 10 0 "[ . 1 . 2]" 1
1687 1 90 SER HA 1 90 SER HB3 2.550 . 3.363 2.772 2.452 3.025 . 0 0 "[ . 1 . 2]" 1
1688 1 90 SER HA 1 91 PHE H 2.422 . 3.155 2.188 2.143 2.312 . 0 0 "[ . 1 . 2]" 1
1689 1 90 SER HA 1 91 PHE HD2 3.030 . 4.178 4.170 4.044 4.310 0.132 11 0 "[ . 1 . 2]" 1
1690 1 90 SER HB2 1 91 PHE H 3.087 . 4.278 4.259 3.913 4.347 0.069 20 0 "[ . 1 . 2]" 1
1691 1 90 SER HB3 1 91 PHE H 3.321 . 4.699 3.706 3.002 4.107 . 0 0 "[ . 1 . 2]" 1
1692 1 91 PHE H 1 91 PHE HA 2.973 . 4.078 2.947 2.942 2.953 . 0 0 "[ . 1 . 2]" 1
1693 1 91 PHE H 1 91 PHE HB2 2.820 . 3.814 2.652 2.524 2.807 . 0 0 "[ . 1 . 2]" 1
1694 1 91 PHE H 1 91 PHE HB3 3.116 . 4.330 3.766 3.705 3.862 . 0 0 "[ . 1 . 2]" 1
1695 1 91 PHE H 1 91 PHE HD2 2.625 . 3.487 2.887 2.712 3.042 . 0 0 "[ . 1 . 2]" 1
1696 1 91 PHE H 1 91 PHE HE2 3.487 . 5.007 4.865 4.663 5.064 0.057 2 0 "[ . 1 . 2]" 1
1697 1 91 PHE H 1 92 ASN H 3.312 . 4.683 4.426 4.397 4.442 . 0 0 "[ . 1 . 2]" 1
1698 1 91 PHE HA 1 91 PHE HB2 2.863 . 3.888 3.026 3.019 3.031 . 0 0 "[ . 1 . 2]" 1
1699 1 91 PHE HA 1 91 PHE HB3 2.738 . 3.675 2.445 2.406 2.506 . 0 0 "[ . 1 . 2]" 1
1700 1 91 PHE HA 1 91 PHE HD2 3.144 . 4.379 4.214 4.135 4.274 . 0 0 "[ . 1 . 2]" 1
1701 1 91 PHE HA 1 92 ASN H 3.648 . 5.312 2.532 2.499 2.569 . 0 0 "[ . 1 . 2]" 1
1702 1 91 PHE HB2 1 91 PHE HD2 2.784 . 3.753 2.287 2.250 2.318 . 0 0 "[ . 1 . 2]" 1
1703 1 91 PHE HB2 1 93 ASN H 2.604 . 3.451 2.924 2.675 3.292 . 0 0 "[ . 1 . 2]" 1
1704 1 91 PHE HB3 1 91 PHE HD2 2.705 . 3.620 3.542 3.497 3.572 . 0 0 "[ . 1 . 2]" 1
1705 1 91 PHE HB3 1 93 ASN H 2.737 . 3.674 2.568 2.432 2.837 . 0 0 "[ . 1 . 2]" 1
1706 1 91 PHE HD2 1 92 ASN H 3.573 . 5.169 5.278 5.239 5.309 0.140 20 0 "[ . 1 . 2]" 1
1707 1 91 PHE HD2 1 96 VAL MG1 2.641 . 3.513 3.726 3.655 3.814 0.301 1 0 "[ . 1 . 2]" 1
1708 1 91 PHE HE2 1 96 VAL MG1 2.909 . 3.967 4.123 4.029 4.219 0.252 10 0 "[ . 1 . 2]" 1
1709 1 91 PHE HZ 1 96 VAL MG1 3.202 . 4.484 3.833 3.618 4.011 . 0 0 "[ . 1 . 2]" 1
1710 1 92 ASN H 1 93 ASN H 2.890 . 3.934 2.276 2.016 2.457 . 0 0 "[ . 1 . 2]" 1
1711 1 92 ASN HA 1 92 ASN HB2 2.166 . 2.753 2.498 2.448 2.544 . 0 0 "[ . 1 . 2]" 1
1712 1 92 ASN HA 1 92 ASN HB3 2.018 . 2.527 2.403 2.336 2.465 . 0 0 "[ . 1 . 2]" 1
1713 1 92 ASN HA 1 93 ASN H 3.046 . 4.206 2.959 2.797 3.197 . 0 0 "[ . 1 . 2]" 1
1714 1 92 ASN HB3 1 92 ASN HD21 2.953 . 4.043 2.500 2.202 3.464 . 0 0 "[ . 1 . 2]" 1
1715 1 92 ASN HB3 1 92 ASN HD22 2.884 . 3.924 3.602 3.467 4.051 0.127 10 0 "[ . 1 . 2]" 1
1716 1 93 ASN H 1 93 ASN HA 2.625 . 3.486 2.895 2.849 2.921 . 0 0 "[ . 1 . 2]" 1
1717 1 93 ASN H 1 93 ASN HB2 2.604 . 3.451 3.206 2.634 3.497 0.046 3 0 "[ . 1 . 2]" 1
1718 1 93 ASN H 1 93 ASN HB3 2.672 . 3.565 3.076 2.810 3.751 0.186 7 0 "[ . 1 . 2]" 1
1719 1 93 ASN H 1 96 VAL H 3.844 . 5.691 4.959 4.673 5.149 . 0 0 "[ . 1 . 2]" 1
1720 1 93 ASN H 1 96 VAL HB 3.238 . 4.549 3.444 3.124 3.741 . 0 0 "[ . 1 . 2]" 1
1721 1 93 ASN H 1 96 VAL QG 3.403 . 4.851 3.725 3.447 3.993 . 0 0 "[ . 1 . 2]" 1
1722 1 93 ASN H 1 97 MET H 3.015 . 4.151 4.252 4.205 4.380 0.229 3 0 "[ . 1 . 2]" 1
1723 1 93 ASN HA 1 93 ASN HB2 2.535 . 3.338 2.579 2.424 3.012 . 0 0 "[ . 1 . 2]" 1
1724 1 93 ASN HA 1 93 ASN HB3 2.385 . 3.096 2.948 2.555 3.034 . 0 0 "[ . 1 . 2]" 1
1725 1 93 ASN HA 1 94 ARG H 2.630 . 3.495 2.175 2.135 2.237 . 0 0 "[ . 1 . 2]" 1
1726 1 93 ASN HA 1 95 THR H 3.194 . 4.469 4.067 3.857 4.389 . 0 0 "[ . 1 . 2]" 1
1727 1 93 ASN HB2 1 95 THR H 3.528 . 5.083 4.886 4.305 5.141 0.058 13 0 "[ . 1 . 2]" 1
1728 1 93 ASN HB2 1 96 VAL H 3.079 . 4.264 4.125 2.889 4.446 0.182 1 0 "[ . 1 . 2]" 1
1729 1 93 ASN HB3 1 93 ASN HD21 3.198 . 4.476 3.262 2.252 3.486 . 0 0 "[ . 1 . 2]" 1
1730 1 94 ARG H 1 94 ARG HB2 3.110 . 4.319 2.414 2.176 2.640 . 0 0 "[ . 1 . 2]" 1
1731 1 94 ARG H 1 94 ARG HB3 3.031 . 4.179 3.421 2.687 3.625 . 0 0 "[ . 1 . 2]" 1
1732 1 94 ARG H 1 95 THR H 2.878 . 3.913 2.564 2.408 2.714 . 0 0 "[ . 1 . 2]" 1
1733 1 94 ARG HA 1 94 ARG HB2 2.438 . 3.181 2.924 2.539 3.021 . 0 0 "[ . 1 . 2]" 1
1734 1 94 ARG HA 1 94 ARG HB3 2.511 . 3.299 2.615 2.395 3.013 . 0 0 "[ . 1 . 2]" 1
1735 1 94 ARG HA 1 94 ARG QD 2.944 . 3.910 2.444 1.823 3.473 0.038 4 0 "[ . 1 . 2]" 1
1736 1 94 ARG HA 1 94 ARG HG2 2.527 . 3.325 3.424 3.069 3.688 0.363 15 0 "[ . 1 . 2]" 1
1737 1 94 ARG HA 1 94 ARG HG3 2.747 . 3.690 2.990 2.084 3.787 0.097 7 0 "[ . 1 . 2]" 1
1738 1 94 ARG HA 1 95 THR H 3.045 . 4.204 3.515 3.477 3.543 . 0 0 "[ . 1 . 2]" 1
1739 1 94 ARG HB2 1 94 ARG QD 2.801 . 3.781 2.778 2.030 3.532 . 0 0 "[ . 1 . 2]" 1
1740 1 94 ARG HB2 1 94 ARG HG2 2.012 . 2.518 2.479 2.377 2.918 0.400 10 0 "[ . 1 . 2]" 1
1741 1 94 ARG HB2 1 94 ARG HG3 2.196 . 2.799 2.749 2.378 3.013 0.214 4 0 "[ . 1 . 2]" 1
1742 1 94 ARG HB2 1 95 THR H 3.054 . 4.220 2.955 2.433 3.817 . 0 0 "[ . 1 . 2]" 1
1743 1 94 ARG HB3 1 94 ARG QD 2.497 . 3.170 3.005 2.347 3.531 0.361 14 0 "[ . 1 . 2]" 1
1744 1 94 ARG HB3 1 94 ARG HG3 1.952 . 2.428 2.484 2.365 2.911 0.483 10 0 "[ . 1 . 2]" 1
1745 1 94 ARG QD 1 94 ARG HE 3.544 . 5.114 2.435 2.187 2.491 . 0 0 "[ . 1 . 2]" 1
1746 1 94 ARG QD 1 94 ARG HG2 2.408 . 3.133 2.319 2.157 2.436 . 0 0 "[ . 1 . 2]" 1
1747 1 94 ARG QD 1 94 ARG HG3 2.632 . 3.456 2.312 2.139 2.415 . 0 0 "[ . 1 . 2]" 1
1748 1 94 ARG HG3 1 95 THR H 3.786 . 5.577 4.893 4.091 5.151 . 0 0 "[ . 1 . 2]" 1
1749 1 95 THR H 1 95 THR HA 2.551 . 3.364 2.811 2.779 2.840 . 0 0 "[ . 1 . 2]" 1
1750 1 95 THR H 1 95 THR HB 2.267 . 2.909 2.419 2.352 2.485 . 0 0 "[ . 1 . 2]" 1
1751 1 95 THR H 1 96 VAL H 2.414 . 3.142 2.732 2.642 2.822 . 0 0 "[ . 1 . 2]" 1
1752 1 95 THR H 1 96 VAL HB 3.410 . 4.864 4.659 4.542 4.796 . 0 0 "[ . 1 . 2]" 1
1753 1 95 THR H 1 97 MET H 3.564 . 5.152 4.272 4.038 4.514 . 0 0 "[ . 1 . 2]" 1
1754 1 95 THR HA 1 95 THR HB 2.219 . 2.835 3.000 2.994 3.007 0.172 19 0 "[ . 1 . 2]" 1
1755 1 95 THR HA 1 95 THR MG 2.018 . 2.527 2.468 2.405 2.520 . 0 0 "[ . 1 . 2]" 1
1756 1 95 THR HA 1 96 VAL H 3.282 . 4.628 3.549 3.533 3.563 . 0 0 "[ . 1 . 2]" 1
1757 1 95 THR HA 1 98 ASP HB2 2.828 . 3.828 3.866 3.731 3.915 0.087 18 0 "[ . 1 . 2]" 1
1758 1 95 THR HA 1 98 ASP HB3 2.543 . 3.352 3.087 2.849 3.375 0.023 12 0 "[ . 1 . 2]" 1
1759 1 95 THR HB 1 95 THR MG 1.867 . 2.303 2.127 2.121 2.132 . 0 0 "[ . 1 . 2]" 1
1760 1 95 THR HB 1 96 VAL H 2.642 . 3.515 2.397 2.245 2.514 . 0 0 "[ . 1 . 2]" 1
1761 1 95 THR MG 1 96 VAL H 2.309 . 2.976 3.088 3.044 3.133 0.157 15 0 "[ . 1 . 2]" 1
1762 1 95 THR MG 1 99 ASN HD21 3.117 . 4.332 2.844 2.204 3.799 . 0 0 "[ . 1 . 2]" 1
1763 1 95 THR MG 1 99 ASN HD22 3.096 . 4.294 3.131 2.150 4.389 0.095 11 0 "[ . 1 . 2]" 1
1764 1 96 VAL H 1 96 VAL HA 2.677 . 3.573 2.742 2.717 2.765 . 0 0 "[ . 1 . 2]" 1
1765 1 96 VAL H 1 96 VAL HB 2.403 . 3.125 2.505 2.419 2.573 . 0 0 "[ . 1 . 2]" 1
1766 1 96 VAL H 1 96 VAL MG2 2.247 . 2.878 2.201 2.071 2.326 . 0 0 "[ . 1 . 2]" 1
1767 1 96 VAL H 1 97 MET H 2.657 . 3.540 3.018 2.905 3.096 . 0 0 "[ . 1 . 2]" 1
1768 1 96 VAL HA 1 96 VAL HB 2.796 . 3.773 3.020 3.008 3.029 . 0 0 "[ . 1 . 2]" 1
1769 1 96 VAL HA 1 96 VAL MG1 2.149 . 2.726 2.460 2.387 2.540 . 0 0 "[ . 1 . 2]" 1
1770 1 96 VAL HA 1 96 VAL MG2 2.123 . 2.686 2.277 2.229 2.346 . 0 0 "[ . 1 . 2]" 1
1771 1 96 VAL HA 1 97 MET H 2.968 . 4.069 3.588 3.567 3.597 . 0 0 "[ . 1 . 2]" 1
1772 1 96 VAL HA 1 99 ASN HB2 2.758 . 3.709 2.874 2.427 3.638 . 0 0 "[ . 1 . 2]" 1
1773 1 96 VAL HA 1 99 ASN HB3 2.908 . 3.965 3.762 2.775 4.080 0.115 18 0 "[ . 1 . 2]" 1
1774 1 96 VAL HB 1 96 VAL MG1 2.127 . 2.692 2.125 2.116 2.132 . 0 0 "[ . 1 . 2]" 1
1775 1 96 VAL HB 1 96 VAL MG2 2.123 . 2.686 2.122 2.119 2.126 . 0 0 "[ . 1 . 2]" 1
1776 1 96 VAL HB 1 97 MET H 2.343 . 3.029 2.392 2.314 2.485 . 0 0 "[ . 1 . 2]" 1
1777 1 96 VAL MG1 1 96 VAL MG2 1.564 . 1.870 2.029 2.016 2.036 0.166 17 0 "[ . 1 . 2]" 1
1778 1 96 VAL MG1 1 97 MET H 2.709 . 3.627 2.946 2.764 3.182 . 0 0 "[ . 1 . 2]" 1
1779 1 96 VAL MG2 1 97 MET H 2.832 . 3.834 3.854 3.789 3.899 0.065 10 0 "[ . 1 . 2]" 1
1780 1 97 MET H 1 97 MET QB 2.585 . 3.420 2.373 2.299 2.434 . 0 0 "[ . 1 . 2]" 1
1781 1 97 MET H 1 97 MET ME 3.313 . 4.685 4.683 4.537 4.742 0.057 3 0 "[ . 1 . 2]" 1
1782 1 97 MET H 1 97 MET HG2 2.430 . 3.168 2.904 2.165 3.368 0.200 16 0 "[ . 1 . 2]" 1
1783 1 97 MET H 1 97 MET HG3 2.456 . 3.210 2.976 2.493 3.495 0.285 7 0 "[ . 1 . 2]" 1
1784 1 97 MET H 1 98 ASP H 2.748 . 3.692 3.005 2.697 3.228 . 0 0 "[ . 1 . 2]" 1
1785 1 97 MET HA 1 97 MET QB 2.292 . 2.949 2.348 2.129 2.468 . 0 0 "[ . 1 . 2]" 1
1786 1 97 MET HA 1 97 MET ME 2.115 . 3.615 3.405 2.985 3.782 0.167 2 0 "[ . 1 . 2]" 1
1787 1 97 MET HA 1 97 MET HG2 2.663 . 3.549 2.768 2.127 3.885 0.336 4 0 "[ . 1 . 2]" 1
1788 1 97 MET HA 1 97 MET HG3 2.671 . 3.563 3.373 3.124 3.655 0.092 14 0 "[ . 1 . 2]" 1
1789 1 97 MET HA 1 98 ASP H 2.748 . 3.692 3.542 3.470 3.587 . 0 0 "[ . 1 . 2]" 1
1790 1 97 MET QB 1 97 MET ME 2.025 . 2.538 1.828 1.768 1.895 . 0 0 "[ . 1 . 2]" 1
1791 1 97 MET QB 1 97 MET HG2 2.362 . 3.059 2.368 2.181 2.488 . 0 0 "[ . 1 . 2]" 1
1792 1 97 MET QB 1 98 ASP H 2.550 . 3.363 2.591 2.126 3.297 . 0 0 "[ . 1 . 2]" 1
1793 1 97 MET ME 1 97 MET HG2 2.911 . 3.970 2.922 2.499 3.413 . 0 0 "[ . 1 . 2]" 1
1794 1 97 MET HG2 1 98 ASP H 3.219 . 4.514 4.066 2.593 4.890 0.376 5 0 "[ . 1 . 2]" 1
1795 1 98 ASP H 1 98 ASP HA 2.852 . 3.869 2.814 2.779 2.851 . 0 0 "[ . 1 . 2]" 1
1796 1 98 ASP H 1 98 ASP HB2 2.958 . 4.052 2.461 2.390 2.587 . 0 0 "[ . 1 . 2]" 1
1797 1 98 ASP H 1 98 ASP HB3 2.676 . 3.571 2.605 2.465 2.701 . 0 0 "[ . 1 . 2]" 1
1798 1 98 ASP H 1 99 ASN H 2.603 . 3.450 2.704 2.560 2.839 . 0 0 "[ . 1 . 2]" 1
1799 1 98 ASP H 1 101 LYS H 3.302 . 4.665 4.523 4.401 4.666 0.001 9 0 "[ . 1 . 2]" 1
1800 1 98 ASP HA 1 98 ASP HB2 2.416 . 3.146 2.499 2.429 2.562 . 0 0 "[ . 1 . 2]" 1
1801 1 98 ASP HA 1 98 ASP HB3 2.535 . 3.338 3.028 3.014 3.035 . 0 0 "[ . 1 . 2]" 1
1802 1 98 ASP HA 1 101 LYS H 3.232 . 4.538 3.568 3.262 3.873 . 0 0 "[ . 1 . 2]" 1
1803 1 98 ASP HA 1 101 LYS HB2 2.500 . 3.282 2.228 2.011 3.101 . 0 0 "[ . 1 . 2]" 1
1804 1 98 ASP HA 1 101 LYS HB3 2.645 . 3.519 3.417 2.448 3.665 0.146 2 0 "[ . 1 . 2]" 1
1805 1 98 ASP HA 1 101 LYS HD2 2.901 . 3.953 3.771 3.040 4.300 0.347 9 0 "[ . 1 . 2]" 1
1806 1 98 ASP HA 1 101 LYS HD3 2.948 . 4.034 3.435 1.823 4.359 0.325 19 0 "[ . 1 . 2]" 1
1807 1 98 ASP HA 1 101 LYS QE 2.693 . 3.599 2.104 1.656 3.645 0.131 8 0 "[ . 1 . 2]" 1
1808 1 98 ASP HB2 1 99 ASN H 3.653 . 5.321 3.880 3.775 3.975 . 0 0 "[ . 1 . 2]" 1
1809 1 98 ASP HB3 1 99 ASN H 2.713 . 3.633 2.669 2.513 2.785 . 0 0 "[ . 1 . 2]" 1
1810 1 99 ASN H 1 99 ASN HA 2.606 . 3.455 2.839 2.810 2.872 . 0 0 "[ . 1 . 2]" 1
1811 1 99 ASN H 1 99 ASN HB2 2.537 . 3.342 2.223 2.121 2.387 . 0 0 "[ . 1 . 2]" 1
1812 1 99 ASN H 1 99 ASN HB3 2.548 . 3.359 3.293 2.779 3.525 0.166 7 0 "[ . 1 . 2]" 1
1813 1 99 ASN H 1 99 ASN HD21 3.414 . 4.871 3.542 2.159 4.722 . 0 0 "[ . 1 . 2]" 1
1814 1 99 ASN H 1 100 ILE HG12 3.150 . 4.390 4.385 4.263 4.445 0.055 8 0 "[ . 1 . 2]" 1
1815 1 99 ASN HA 1 99 ASN HB2 2.486 . 3.258 2.886 2.587 3.009 . 0 0 "[ . 1 . 2]" 1
1816 1 99 ASN HA 1 99 ASN HB3 2.383 . 3.093 2.748 2.584 3.012 . 0 0 "[ . 1 . 2]" 1
1817 1 99 ASN HA 1 100 ILE H 3.405 . 4.854 3.563 3.549 3.576 . 0 0 "[ . 1 . 2]" 1
1818 1 99 ASN HA 1 102 MET QB 2.876 . 3.111 2.954 2.505 3.089 . 0 0 "[ . 1 . 2]" 1
1819 1 99 ASN HA 1 102 MET ME 2.870 . 3.900 2.737 2.006 3.169 . 0 0 "[ . 1 . 2]" 1
1820 1 99 ASN HB2 1 99 ASN HD21 3.331 . 4.718 2.437 2.181 2.981 . 0 0 "[ . 1 . 2]" 1
1821 1 99 ASN HB2 1 100 ILE H 2.947 . 4.033 2.786 2.358 3.573 . 0 0 "[ . 1 . 2]" 1
1822 1 99 ASN HB3 1 99 ASN HD21 3.427 . 4.895 3.088 2.281 3.500 . 0 0 "[ . 1 . 2]" 1
1823 1 99 ASN HB3 1 100 ILE H 2.956 . 4.048 2.820 2.233 3.251 . 0 0 "[ . 1 . 2]" 1
1824 1 100 ILE H 1 100 ILE HA 2.742 . 3.682 2.814 2.784 2.832 . 0 0 "[ . 1 . 2]" 1
1825 1 100 ILE H 1 100 ILE HB 2.421 . 3.154 2.527 2.460 2.564 . 0 0 "[ . 1 . 2]" 1
1826 1 100 ILE H 1 100 ILE MD 3.208 . 4.495 3.141 3.044 3.271 . 0 0 "[ . 1 . 2]" 1
1827 1 100 ILE H 1 100 ILE HG12 2.792 . 3.767 2.080 2.002 2.162 . 0 0 "[ . 1 . 2]" 1
1828 1 100 ILE H 1 100 ILE HG13 2.686 . 3.587 3.569 3.517 3.606 0.019 13 0 "[ . 1 . 2]" 1
1829 1 100 ILE H 1 100 ILE MG 2.895 . 3.943 3.749 3.730 3.762 . 0 0 "[ . 1 . 2]" 1
1830 1 100 ILE H 1 101 LYS H 2.684 . 3.585 2.753 2.680 2.856 . 0 0 "[ . 1 . 2]" 1
1831 1 100 ILE HA 1 100 ILE HB 2.656 . 3.538 3.025 3.019 3.031 . 0 0 "[ . 1 . 2]" 1
1832 1 100 ILE HA 1 100 ILE MD 2.224 . 2.842 2.076 2.032 2.117 . 0 0 "[ . 1 . 2]" 1
1833 1 100 ILE HA 1 100 ILE HG12 3.003 . 4.131 3.094 3.020 3.141 . 0 0 "[ . 1 . 2]" 1
1834 1 100 ILE HA 1 100 ILE HG13 2.807 . 3.792 3.732 3.706 3.758 . 0 0 "[ . 1 . 2]" 1
1835 1 100 ILE HA 1 100 ILE MG 2.277 . 2.925 2.376 2.343 2.424 . 0 0 "[ . 1 . 2]" 1
1836 1 100 ILE HA 1 103 THR HB 2.421 . 3.154 2.442 2.331 2.617 . 0 0 "[ . 1 . 2]" 1
1837 1 100 ILE HA 1 103 THR MG 3.122 . 4.341 3.740 3.593 3.887 . 0 0 "[ . 1 . 2]" 1
1838 1 100 ILE HA 1 104 LEU H 3.142 . 4.376 3.763 3.604 3.912 . 0 0 "[ . 1 . 2]" 1
1839 1 100 ILE HA 1 104 LEU QD 2.788 . 3.759 2.768 2.427 3.834 0.075 11 0 "[ . 1 . 2]" 1
1840 1 100 ILE HB 1 100 ILE MD 2.552 . 3.366 3.255 3.248 3.263 . 0 0 "[ . 1 . 2]" 1
1841 1 100 ILE HB 1 100 ILE HG12 2.718 . 3.641 2.446 2.424 2.478 . 0 0 "[ . 1 . 2]" 1
1842 1 100 ILE HB 1 100 ILE HG13 2.572 . 3.399 2.465 2.437 2.481 . 0 0 "[ . 1 . 2]" 1
1843 1 100 ILE HB 1 100 ILE MG 2.071 . 2.607 2.117 2.108 2.123 . 0 0 "[ . 1 . 2]" 1
1844 1 100 ILE HB 1 101 LYS H 2.662 . 3.548 2.538 2.357 2.683 . 0 0 "[ . 1 . 2]" 1
1845 1 100 ILE MD 1 100 ILE HG12 2.223 . 2.841 2.121 2.117 2.124 . 0 0 "[ . 1 . 2]" 1
1846 1 100 ILE MD 1 100 ILE HG13 2.294 . 2.952 2.124 2.119 2.127 . 0 0 "[ . 1 . 2]" 1
1847 1 100 ILE MD 1 100 ILE MG 2.008 . 2.512 2.057 2.024 2.098 . 0 0 "[ . 1 . 2]" 1
1848 1 100 ILE HG12 1 100 ILE MG 2.498 . 3.278 3.199 3.189 3.205 . 0 0 "[ . 1 . 2]" 1
1849 1 100 ILE HG12 1 101 LYS H 3.232 . 4.537 4.206 4.087 4.352 . 0 0 "[ . 1 . 2]" 1
1850 1 100 ILE HG13 1 100 ILE MG 2.359 . 3.054 2.319 2.287 2.341 . 0 0 "[ . 1 . 2]" 1
1851 1 100 ILE MG 1 101 LYS H 3.143 . 4.378 3.363 3.178 3.505 . 0 0 "[ . 1 . 2]" 1
1852 1 100 ILE MG 1 103 THR HB 2.697 . 3.606 3.674 3.529 3.746 0.140 20 0 "[ . 1 . 2]" 1
1853 1 101 LYS H 1 101 LYS HA 2.805 . 3.788 2.742 2.703 2.764 . 0 0 "[ . 1 . 2]" 1
1854 1 101 LYS H 1 101 LYS HB2 2.809 . 3.795 2.263 2.073 2.627 . 0 0 "[ . 1 . 2]" 1
1855 1 101 LYS H 1 101 LYS HB3 2.689 . 3.593 3.448 2.676 3.616 0.023 2 0 "[ . 1 . 2]" 1
1856 1 101 LYS H 1 102 MET H 2.643 . 3.516 3.021 2.923 3.132 . 0 0 "[ . 1 . 2]" 1
1857 1 101 LYS HA 1 101 LYS HB2 2.608 . 3.458 2.924 2.515 3.019 . 0 0 "[ . 1 . 2]" 1
1858 1 101 LYS HA 1 101 LYS HB3 2.609 . 3.460 2.727 2.468 3.014 . 0 0 "[ . 1 . 2]" 1
1859 1 101 LYS HA 1 101 LYS HD2 3.554 . 5.133 4.395 4.063 4.824 . 0 0 "[ . 1 . 2]" 1
1860 1 101 LYS HA 1 101 LYS HD3 3.345 . 4.744 4.564 4.468 4.909 0.165 2 0 "[ . 1 . 2]" 1
1861 1 101 LYS HA 1 101 LYS QG 2.697 . 3.606 2.273 2.186 2.460 . 0 0 "[ . 1 . 2]" 1
1862 1 101 LYS HA 1 102 MET H 3.391 . 4.828 3.527 3.512 3.563 . 0 0 "[ . 1 . 2]" 1
1863 1 101 LYS HA 1 104 LEU HB2 2.677 . 3.573 3.499 3.123 3.645 0.072 20 0 "[ . 1 . 2]" 1
1864 1 101 LYS HA 1 104 LEU QD 2.630 . 3.495 3.255 2.828 3.368 . 0 0 "[ . 1 . 2]" 1
1865 1 101 LYS HB2 1 101 LYS HD2 2.664 . 3.551 3.308 2.779 3.722 0.171 9 0 "[ . 1 . 2]" 1
1866 1 101 LYS HB2 1 101 LYS HD3 2.645 . 3.520 3.286 2.378 3.762 0.242 18 0 "[ . 1 . 2]" 1
1867 1 101 LYS HB2 1 101 LYS QE 2.542 . 3.350 2.258 1.972 2.875 . 0 0 "[ . 1 . 2]" 1
1868 1 101 LYS HB2 1 101 LYS QG 2.907 . 3.963 2.278 2.195 2.380 . 0 0 "[ . 1 . 2]" 1
1869 1 101 LYS HB2 1 102 MET H 2.627 . 3.489 2.473 2.027 3.593 0.104 9 0 "[ . 1 . 2]" 1
1870 1 101 LYS HB3 1 101 LYS HD2 2.253 . 2.888 2.798 2.160 3.685 0.797 3 7 "[ + . * -* * .* *]" 1
1871 1 101 LYS HB3 1 101 LYS HD3 2.697 . 3.606 3.415 2.948 3.597 . 0 0 "[ . 1 . 2]" 1
1872 1 101 LYS HB3 1 101 LYS QE 2.802 . 3.784 2.407 1.761 3.301 0.059 2 0 "[ . 1 . 2]" 1
1873 1 101 LYS HB3 1 101 LYS QG 2.584 . 3.418 2.354 2.258 2.432 . 0 0 "[ . 1 . 2]" 1
1874 1 101 LYS HB3 1 102 MET H 2.861 . 3.884 2.569 1.864 3.138 . 0 0 "[ . 1 . 2]" 1
1875 1 101 LYS HD2 1 101 LYS QE 2.278 . 2.927 2.314 2.134 2.460 . 0 0 "[ . 1 . 2]" 1
1876 1 101 LYS HD2 1 101 LYS QG 2.198 . 2.333 2.262 2.123 2.421 0.088 11 0 "[ . 1 . 2]" 1
1877 1 101 LYS HD3 1 101 LYS QE 2.524 . 3.320 2.310 2.129 2.414 . 0 0 "[ . 1 . 2]" 1
1878 1 101 LYS HD3 1 101 LYS QG 2.235 . 2.859 2.188 2.130 2.330 . 0 0 "[ . 1 . 2]" 1
1879 1 101 LYS QE 1 101 LYS QG 3.021 . 3.327 2.395 2.187 2.889 . 0 0 "[ . 1 . 2]" 1
1880 1 101 LYS QG 1 102 MET H 3.195 . 4.471 3.997 3.458 4.120 . 0 0 "[ . 1 . 2]" 1
1881 1 102 MET H 1 102 MET HA 2.642 . 3.514 2.760 2.730 2.804 . 0 0 "[ . 1 . 2]" 1
1882 1 102 MET H 1 102 MET QB 2.414 . 3.143 2.059 1.970 2.161 . 0 0 "[ . 1 . 2]" 1
1883 1 102 MET H 1 102 MET HG2 2.923 . 3.991 4.239 3.639 4.398 0.407 11 0 "[ . 1 . 2]" 1
1884 1 102 MET H 1 102 MET HG3 3.026 . 4.170 3.724 2.581 4.353 0.183 18 0 "[ . 1 . 2]" 1
1885 1 102 MET H 1 103 THR H 3.205 . 4.489 2.810 2.717 2.872 . 0 0 "[ . 1 . 2]" 1
1886 1 102 MET HA 1 102 MET QB 2.187 . 2.785 2.453 2.323 2.537 . 0 0 "[ . 1 . 2]" 1
1887 1 102 MET HA 1 102 MET ME 3.557 . 5.139 4.242 4.020 4.414 . 0 0 "[ . 1 . 2]" 1
1888 1 102 MET HA 1 102 MET HG2 2.726 . 3.655 2.630 2.349 3.021 . 0 0 "[ . 1 . 2]" 1
1889 1 102 MET HA 1 102 MET HG3 2.733 . 3.667 2.610 2.457 2.940 . 0 0 "[ . 1 . 2]" 1
1890 1 102 MET HA 1 105 GLN HB2 2.257 . 2.894 3.106 2.975 3.240 0.346 14 0 "[ . 1 . 2]" 1
1891 1 102 MET HA 1 105 GLN HB3 2.352 . 3.044 2.889 2.634 3.139 0.095 15 0 "[ . 1 . 2]" 1
1892 1 102 MET QB 1 102 MET ME 2.351 . 2.694 1.975 1.920 2.021 . 0 0 "[ . 1 . 2]" 1
1893 1 102 MET QB 1 102 MET HG2 2.495 . 3.273 2.364 2.308 2.390 . 0 0 "[ . 1 . 2]" 1
1894 1 102 MET QB 1 102 MET HG3 2.486 . 3.259 2.287 2.238 2.324 . 0 0 "[ . 1 . 2]" 1
1895 1 102 MET QB 1 103 THR H 2.746 . 3.601 2.410 2.202 2.623 . 0 0 "[ . 1 . 2]" 1
1896 1 102 MET ME 1 102 MET HG2 2.921 . 3.987 3.130 2.488 3.408 . 0 0 "[ . 1 . 2]" 1
1897 1 102 MET ME 1 102 MET HG3 2.901 . 3.953 2.817 2.513 3.406 . 0 0 "[ . 1 . 2]" 1
1898 1 102 MET ME 1 103 THR H 3.115 . 4.328 4.039 2.998 4.406 0.078 20 0 "[ . 1 . 2]" 1
1899 1 103 THR H 1 103 THR HB 3.489 . 5.011 2.581 2.465 2.702 . 0 0 "[ . 1 . 2]" 1
1900 1 103 THR H 1 103 THR MG 2.721 . 3.647 3.745 3.732 3.759 0.112 16 0 "[ . 1 . 2]" 1
1901 1 103 THR H 1 104 LEU H 3.512 . 5.054 2.880 2.819 3.008 . 0 0 "[ . 1 . 2]" 1
1902 1 103 THR HA 1 103 THR HB 2.305 . 2.969 3.025 3.019 3.030 0.061 20 0 "[ . 1 . 2]" 1
1903 1 103 THR HA 1 103 THR MG 2.032 . 2.548 2.409 2.341 2.479 . 0 0 "[ . 1 . 2]" 1
1904 1 103 THR HA 1 104 LEU H 2.736 . 3.672 3.544 3.530 3.568 . 0 0 "[ . 1 . 2]" 1
1905 1 103 THR HA 1 106 GLN HB2 2.871 . 3.901 3.597 3.235 3.929 0.028 2 0 "[ . 1 . 2]" 1
1906 1 103 THR HA 1 107 ILE H 3.334 . 4.724 4.431 4.225 4.644 . 0 0 "[ . 1 . 2]" 1
1907 1 103 THR HB 1 103 THR MG 2.087 . 2.631 2.129 2.125 2.133 . 0 0 "[ . 1 . 2]" 1
1908 1 103 THR HB 1 104 LEU H 2.542 . 3.350 2.407 2.210 2.579 . 0 0 "[ . 1 . 2]" 1
1909 1 103 THR MG 1 104 LEU H 2.597 . 3.440 3.279 3.106 3.475 0.035 18 0 "[ . 1 . 2]" 1
1910 1 104 LEU H 1 104 LEU HA 2.807 . 3.792 2.850 2.799 2.886 . 0 0 "[ . 1 . 2]" 1
1911 1 104 LEU H 1 104 LEU HB2 2.603 . 3.450 2.301 2.228 2.366 . 0 0 "[ . 1 . 2]" 1
1912 1 104 LEU H 1 104 LEU HB3 2.866 . 3.892 3.534 3.482 3.568 . 0 0 "[ . 1 . 2]" 1
1913 1 104 LEU H 1 104 LEU QD 2.652 . 3.531 2.203 1.864 3.097 . 0 0 "[ . 1 . 2]" 1
1914 1 104 LEU H 1 105 GLN H 2.764 . 3.719 2.546 2.380 2.796 . 0 0 "[ . 1 . 2]" 1
1915 1 104 LEU HA 1 104 LEU QD 2.219 . 2.835 2.291 2.033 2.378 . 0 0 "[ . 1 . 2]" 1
1916 1 104 LEU HA 1 104 LEU HG 3.120 . 4.337 2.807 2.755 2.872 . 0 0 "[ . 1 . 2]" 1
1917 1 104 LEU HA 1 107 ILE HB 2.847 . 3.860 3.135 2.924 3.493 . 0 0 "[ . 1 . 2]" 1
1918 1 104 LEU HA 1 107 ILE MD 2.579 . 3.410 3.009 2.678 3.337 . 0 0 "[ . 1 . 2]" 1
1919 1 104 LEU HB2 1 104 LEU QD 2.589 . 3.427 2.113 2.073 2.222 . 0 0 "[ . 1 . 2]" 1
1920 1 104 LEU HB3 1 104 LEU QD 2.584 . 3.419 2.324 2.067 2.412 . 0 0 "[ . 1 . 2]" 1
1921 1 104 LEU HB3 1 105 GLN H 2.951 . 4.040 3.233 3.117 3.344 . 0 0 "[ . 1 . 2]" 1
1922 1 104 LEU MD1 1 104 LEU MD2 1.801 . 2.206 2.058 2.045 2.089 . 0 0 "[ . 1 . 2]" 1
1923 1 104 LEU QD 1 105 GLN H 3.010 . 4.143 3.601 3.532 3.840 . 0 0 "[ . 1 . 2]" 1
1924 1 105 GLN H 1 105 GLN HA 2.689 . 3.593 2.736 2.693 2.769 . 0 0 "[ . 1 . 2]" 1
1925 1 105 GLN H 1 105 GLN HB2 2.396 . 3.114 2.055 1.982 2.119 . 0 0 "[ . 1 . 2]" 1
1926 1 105 GLN H 1 105 GLN HB3 2.450 . 3.200 2.936 2.813 3.114 . 0 0 "[ . 1 . 2]" 1
1927 1 105 GLN H 1 105 GLN HG2 2.873 . 3.905 3.992 3.706 4.294 0.389 15 0 "[ . 1 . 2]" 1
1928 1 105 GLN H 1 105 GLN HG3 3.032 . 4.181 4.197 3.585 4.303 0.122 10 0 "[ . 1 . 2]" 1
1929 1 105 GLN H 1 106 GLN H 2.699 . 3.609 2.939 2.824 3.089 . 0 0 "[ . 1 . 2]" 1
1930 1 105 GLN HA 1 105 GLN HB2 2.434 . 3.174 2.677 2.594 2.777 . 0 0 "[ . 1 . 2]" 1
1931 1 105 GLN HA 1 105 GLN HB3 2.422 . 3.155 2.946 2.884 2.985 . 0 0 "[ . 1 . 2]" 1
1932 1 105 GLN HA 1 105 GLN HG2 2.730 . 3.662 2.231 2.118 2.464 . 0 0 "[ . 1 . 2]" 1
1933 1 105 GLN HA 1 105 GLN HG3 2.554 . 3.369 3.385 2.453 3.561 0.192 19 0 "[ . 1 . 2]" 1
1934 1 105 GLN HA 1 108 ILE H 3.013 . 4.148 3.786 3.482 4.165 0.017 2 0 "[ . 1 . 2]" 1
1935 1 105 GLN HA 1 108 ILE HB 2.631 . 3.496 2.641 2.415 2.909 . 0 0 "[ . 1 . 2]" 1
1936 1 105 GLN HA 1 108 ILE MD 2.500 . 3.281 2.496 2.006 3.087 . 0 0 "[ . 1 . 2]" 1
1937 1 105 GLN HA 1 108 ILE MG 2.736 . 3.672 3.745 3.477 3.845 0.173 2 0 "[ . 1 . 2]" 1
1938 1 105 GLN HA 1 109 SER H 3.251 . 4.572 3.974 3.731 4.161 . 0 0 "[ . 1 . 2]" 1
1939 1 105 GLN HB2 1 105 GLN HG2 2.302 . 2.964 2.616 2.414 2.955 . 0 0 "[ . 1 . 2]" 1
1940 1 105 GLN HB2 1 105 GLN HG3 2.109 . 2.665 2.280 2.206 2.404 . 0 0 "[ . 1 . 2]" 1
1941 1 105 GLN HB3 1 105 GLN HG2 2.163 . 2.748 2.891 2.423 2.966 0.218 19 0 "[ . 1 . 2]" 1
1942 1 105 GLN HB3 1 105 GLN HG3 1.971 . 2.457 2.595 2.391 2.960 0.503 15 1 "[ . 1 + 2]" 1
1943 1 105 GLN HE22 1 105 GLN HG2 3.017 . 4.155 3.754 3.443 4.065 . 0 0 "[ . 1 . 2]" 1
1944 1 105 GLN HE22 1 105 GLN HG3 3.080 . 4.266 3.759 3.469 4.061 . 0 0 "[ . 1 . 2]" 1
1945 1 106 GLN H 1 106 GLN HA 2.790 . 3.763 2.817 2.798 2.841 . 0 0 "[ . 1 . 2]" 1
1946 1 106 GLN H 1 106 GLN HB2 2.437 . 3.180 2.352 2.224 2.499 . 0 0 "[ . 1 . 2]" 1
1947 1 106 GLN H 1 106 GLN HB3 2.576 . 3.405 3.546 3.509 3.567 0.162 13 0 "[ . 1 . 2]" 1
1948 1 106 GLN H 1 106 GLN HG2 3.245 . 4.561 3.063 2.384 3.633 . 0 0 "[ . 1 . 2]" 1
1949 1 106 GLN H 1 106 GLN HG3 2.789 . 3.761 2.973 2.084 3.826 0.065 12 0 "[ . 1 . 2]" 1
1950 1 106 GLN H 1 107 ILE H 3.058 . 4.227 2.724 2.664 2.782 . 0 0 "[ . 1 . 2]" 1
1951 1 106 GLN HA 1 106 GLN HB2 2.276 . 2.924 3.000 2.981 3.011 0.087 11 0 "[ . 1 . 2]" 1
1952 1 106 GLN HA 1 106 GLN HB3 2.241 . 2.869 2.529 2.448 2.618 . 0 0 "[ . 1 . 2]" 1
1953 1 106 GLN HA 1 106 GLN HG2 2.699 . 3.610 2.679 2.459 3.012 . 0 0 "[ . 1 . 2]" 1
1954 1 106 GLN HA 1 106 GLN HG3 2.366 . 3.065 3.304 2.940 3.686 0.621 18 9 "[* *** * - ** + 2]" 1
1955 1 106 GLN HA 1 109 SER H 3.244 . 4.559 3.371 3.223 3.600 . 0 0 "[ . 1 . 2]" 1
1956 1 106 GLN HA 1 109 SER QB 1.899 . 2.350 2.438 2.350 2.539 0.189 17 0 "[ . 1 . 2]" 1
1957 1 106 GLN HB2 1 106 GLN HG2 2.238 . 2.864 2.742 2.412 2.991 0.127 9 0 "[ . 1 . 2]" 1
1958 1 106 GLN HB2 1 106 GLN HG3 2.165 . 2.751 2.421 2.379 2.452 . 0 0 "[ . 1 . 2]" 1
1959 1 106 GLN HB2 1 107 ILE H 2.878 . 3.913 2.581 2.422 2.775 . 0 0 "[ . 1 . 2]" 1
1960 1 106 GLN HB3 1 106 GLN HG2 2.451 . 3.202 2.688 2.405 3.007 . 0 0 "[ . 1 . 2]" 1
1961 1 106 GLN HB3 1 107 ILE H 2.846 . 3.858 3.439 3.232 3.615 . 0 0 "[ . 1 . 2]" 1
1962 1 106 GLN HE21 1 106 GLN HG2 4.066 . 6.132 2.708 2.225 3.501 . 0 0 "[ . 1 . 2]" 1
1963 1 106 GLN HE22 1 106 GLN HG2 3.530 . 5.087 3.700 3.475 4.066 . 0 0 "[ . 1 . 2]" 1
1964 1 106 GLN HE22 1 106 GLN HG3 3.477 . 4.988 3.819 3.488 4.058 . 0 0 "[ . 1 . 2]" 1
1965 1 106 GLN HG3 1 107 ILE H 3.459 . 4.955 4.646 4.187 5.091 0.136 12 0 "[ . 1 . 2]" 1
1966 1 107 ILE H 1 107 ILE HA 2.812 . 3.801 2.817 2.784 2.844 . 0 0 "[ . 1 . 2]" 1
1967 1 107 ILE H 1 107 ILE HB 2.381 . 3.090 2.587 2.452 2.705 . 0 0 "[ . 1 . 2]" 1
1968 1 107 ILE H 1 107 ILE MD 2.766 . 3.722 3.562 3.469 3.679 . 0 0 "[ . 1 . 2]" 1
1969 1 107 ILE H 1 107 ILE HG12 2.554 . 3.369 3.344 3.221 3.414 0.045 19 0 "[ . 1 . 2]" 1
1970 1 107 ILE H 1 107 ILE HG13 2.486 . 3.259 2.079 1.941 2.210 . 0 0 "[ . 1 . 2]" 1
1971 1 107 ILE H 1 108 ILE H 2.641 . 3.513 2.689 2.588 2.795 . 0 0 "[ . 1 . 2]" 1
1972 1 107 ILE HA 1 107 ILE HB 2.353 . 3.045 3.025 3.019 3.033 . 0 0 "[ . 1 . 2]" 1
1973 1 107 ILE HA 1 107 ILE HG12 2.406 . 3.130 2.572 2.469 2.707 . 0 0 "[ . 1 . 2]" 1
1974 1 107 ILE HA 1 107 ILE HG13 2.621 . 3.480 3.034 2.948 3.112 . 0 0 "[ . 1 . 2]" 1
1975 1 107 ILE HA 1 107 ILE MG 2.166 . 2.752 2.372 2.255 2.465 . 0 0 "[ . 1 . 2]" 1
1976 1 107 ILE HA 1 108 ILE H 3.412 . 4.867 3.540 3.516 3.553 . 0 0 "[ . 1 . 2]" 1
1977 1 107 ILE HA 1 110 ARG H 3.099 . 4.300 3.259 3.075 3.489 . 0 0 "[ . 1 . 2]" 1
1978 1 107 ILE HA 1 110 ARG QB 2.386 . 3.098 2.533 2.189 2.783 . 0 0 "[ . 1 . 2]" 1
1979 1 107 ILE HA 1 110 ARG HD2 2.771 . 3.731 2.271 1.805 3.818 0.087 10 0 "[ . 1 . 2]" 1
1980 1 107 ILE HA 1 110 ARG HD3 2.989 . 4.106 3.364 2.123 3.701 . 0 0 "[ . 1 . 2]" 1
1981 1 107 ILE HB 1 107 ILE MD 2.332 . 3.012 2.421 2.390 2.467 . 0 0 "[ . 1 . 2]" 1
1982 1 107 ILE HB 1 107 ILE HG12 2.797 . 3.775 3.027 3.021 3.032 . 0 0 "[ . 1 . 2]" 1
1983 1 107 ILE HB 1 107 ILE HG13 2.410 . 3.136 2.483 2.452 2.518 . 0 0 "[ . 1 . 2]" 1
1984 1 107 ILE HB 1 107 ILE MG 2.013 . 2.520 2.122 2.115 2.127 . 0 0 "[ . 1 . 2]" 1
1985 1 107 ILE HB 1 108 ILE H 2.376 . 3.082 2.527 2.322 2.695 . 0 0 "[ . 1 . 2]" 1
1986 1 107 ILE MD 1 107 ILE HG12 2.076 . 2.615 2.120 2.117 2.124 . 0 0 "[ . 1 . 2]" 1
1987 1 107 ILE MD 1 107 ILE HG13 2.210 . 2.820 2.118 2.114 2.125 . 0 0 "[ . 1 . 2]" 1
1988 1 107 ILE MD 1 107 ILE MG 1.903 . 2.356 1.950 1.819 2.084 . 0 0 "[ . 1 . 2]" 1
1989 1 107 ILE MD 1 111 TYR HE2 3.416 . 4.874 4.514 4.219 4.777 . 0 0 "[ . 1 . 2]" 1
1990 1 107 ILE HG12 1 107 ILE MG 2.197 . 2.800 2.348 2.286 2.416 . 0 0 "[ . 1 . 2]" 1
1991 1 107 ILE HG13 1 107 ILE MG 2.450 . 3.200 3.183 3.147 3.199 . 0 0 "[ . 1 . 2]" 1
1992 1 107 ILE MG 1 108 ILE H 2.793 . 3.768 3.409 3.189 3.563 . 0 0 "[ . 1 . 2]" 1
1993 1 107 ILE MG 1 108 ILE HA 2.808 . 3.794 3.613 3.349 3.816 0.022 6 0 "[ . 1 . 2]" 1
1994 1 107 ILE MG 1 111 TYR HD2 3.021 . 4.162 3.003 2.564 3.604 . 0 0 "[ . 1 . 2]" 1
1995 1 107 ILE MG 1 111 TYR HE2 2.267 . 2.910 2.042 1.897 2.171 . 0 0 "[ . 1 . 2]" 1
1996 1 108 ILE H 1 108 ILE HA 2.776 . 3.739 2.793 2.773 2.837 . 0 0 "[ . 1 . 2]" 1
1997 1 108 ILE H 1 108 ILE HB 2.445 . 3.192 2.417 2.302 2.540 . 0 0 "[ . 1 . 2]" 1
1998 1 108 ILE H 1 108 ILE MD 2.745 . 3.687 3.568 3.513 3.633 . 0 0 "[ . 1 . 2]" 1
1999 1 108 ILE H 1 108 ILE HG13 2.819 . 3.813 2.256 2.051 2.468 . 0 0 "[ . 1 . 2]" 1
2000 1 108 ILE H 1 109 SER H 2.609 . 3.460 2.798 2.700 2.894 . 0 0 "[ . 1 . 2]" 1
2001 1 108 ILE HA 1 108 ILE HB 2.642 . 3.514 3.023 2.997 3.061 . 0 0 "[ . 1 . 2]" 1
2002 1 108 ILE HA 1 108 ILE HG12 2.665 . 3.553 2.504 2.450 2.606 . 0 0 "[ . 1 . 2]" 1
2003 1 108 ILE HA 1 108 ILE HG13 2.968 . 4.069 2.887 2.690 3.136 . 0 0 "[ . 1 . 2]" 1
2004 1 108 ILE HA 1 108 ILE MG 2.251 . 2.884 2.540 2.451 2.621 . 0 0 "[ . 1 . 2]" 1
2005 1 108 ILE HA 1 109 SER H 3.004 . 4.132 3.550 3.533 3.581 . 0 0 "[ . 1 . 2]" 1
2006 1 108 ILE HA 1 111 TYR H 3.294 . 4.651 3.454 3.268 3.672 . 0 0 "[ . 1 . 2]" 1
2007 1 108 ILE HA 1 111 TYR HB2 3.175 . 4.435 3.569 3.074 5.152 0.717 2 4 "[ + . * 1 * - 2]" 1
2008 1 108 ILE HA 1 111 TYR HB3 3.398 . 4.841 4.873 4.783 4.953 0.112 11 0 "[ . 1 . 2]" 1
2009 1 108 ILE HA 1 111 TYR HD2 2.797 . 3.775 2.899 2.229 3.837 0.062 18 0 "[ . 1 . 2]" 1
2010 1 108 ILE HA 1 111 TYR HE2 3.348 . 4.749 4.113 2.766 4.784 0.035 19 0 "[ . 1 . 2]" 1
2011 1 108 ILE HB 1 108 ILE MD 2.323 . 2.997 2.406 2.377 2.463 . 0 0 "[ . 1 . 2]" 1
2012 1 108 ILE HB 1 108 ILE HG12 2.395 . 3.112 3.021 3.019 3.025 . 0 0 "[ . 1 . 2]" 1
2013 1 108 ILE HB 1 108 ILE HG13 2.625 . 3.486 2.474 2.442 2.509 . 0 0 "[ . 1 . 2]" 1
2014 1 108 ILE HB 1 108 ILE MG 2.114 . 2.673 2.120 2.108 2.126 . 0 0 "[ . 1 . 2]" 1
2015 1 108 ILE HB 1 109 SER H 2.592 . 3.432 2.422 2.216 2.549 . 0 0 "[ . 1 . 2]" 1
2016 1 108 ILE MD 1 108 ILE HG12 2.163 . 2.748 2.117 2.114 2.121 . 0 0 "[ . 1 . 2]" 1
2017 1 108 ILE MD 1 108 ILE HG13 2.382 . 3.091 2.117 2.110 2.123 . 0 0 "[ . 1 . 2]" 1
2018 1 108 ILE MD 1 108 ILE MG 1.860 . 2.292 1.944 1.894 2.010 . 0 0 "[ . 1 . 2]" 1
2019 1 108 ILE MD 1 109 SER H 3.200 . 4.480 4.438 4.287 4.534 0.054 14 0 "[ . 1 . 2]" 1
2020 1 108 ILE HG12 1 108 ILE MG 2.402 . 3.123 2.370 2.335 2.420 . 0 0 "[ . 1 . 2]" 1
2021 1 108 ILE HG13 1 108 ILE MG 2.535 . 3.338 3.202 3.190 3.214 . 0 0 "[ . 1 . 2]" 1
2022 1 108 ILE HG13 1 109 SER H 3.464 . 4.964 4.307 4.086 4.497 . 0 0 "[ . 1 . 2]" 1
2023 1 108 ILE MG 1 109 SER H 2.827 . 3.826 3.010 2.743 3.366 . 0 0 "[ . 1 . 2]" 1
2024 1 108 ILE MG 1 109 SER HA 2.849 . 3.864 3.096 2.852 3.492 . 0 0 "[ . 1 . 2]" 1
2025 1 108 ILE MG 1 109 SER QB 3.194 . 4.469 4.055 3.875 4.269 . 0 0 "[ . 1 . 2]" 1
2026 1 108 ILE MG 1 112 LYS QE 2.538 . 3.343 2.649 2.075 3.365 0.022 17 0 "[ . 1 . 2]" 1
2027 1 109 SER H 1 109 SER HA 2.444 . 3.191 2.796 2.769 2.849 . 0 0 "[ . 1 . 2]" 1
2028 1 109 SER H 1 109 SER QB 2.242 . 3.242 2.316 2.223 2.472 . 0 0 "[ . 1 . 2]" 1
2029 1 109 SER H 1 110 ARG H 2.554 . 3.369 2.677 2.577 2.759 . 0 0 "[ . 1 . 2]" 1
2030 1 109 SER HA 1 109 SER QB 1.985 . 2.478 2.345 2.310 2.372 . 0 0 "[ . 1 . 2]" 1
2031 1 109 SER HA 1 110 ARG H 2.986 . 4.100 3.510 3.445 3.556 . 0 0 "[ . 1 . 2]" 1
2032 1 109 SER HA 1 112 LYS QB 2.412 . 3.139 1.905 1.794 1.962 . 0 0 "[ . 1 . 2]" 1
2033 1 109 SER HA 1 112 LYS HD2 2.916 . 3.979 2.291 1.902 3.001 . 0 0 "[ . 1 . 2]" 1
2034 1 109 SER HA 1 112 LYS QE 3.213 . 4.504 4.007 2.626 4.350 . 0 0 "[ . 1 . 2]" 1
2035 1 109 SER HA 1 112 LYS HG2 3.162 . 4.412 4.198 3.476 4.379 . 0 0 "[ . 1 . 2]" 1
2036 1 109 SER HA 1 112 LYS HG3 2.994 . 4.115 3.602 2.968 4.489 0.374 10 0 "[ . 1 . 2]" 1
2037 1 109 SER QB 1 110 ARG H 2.654 . 3.534 2.827 2.654 3.027 . 0 0 "[ . 1 . 2]" 1
2038 1 110 ARG H 1 110 ARG HA 2.383 . 3.093 2.812 2.714 2.863 . 0 0 "[ . 1 . 2]" 1
2039 1 110 ARG H 1 110 ARG QB 2.082 . 2.624 2.317 1.966 2.479 . 0 0 "[ . 1 . 2]" 1
2040 1 110 ARG H 1 110 ARG HD2 3.397 . 4.840 4.074 3.637 4.880 0.040 17 0 "[ . 1 . 2]" 1
2041 1 110 ARG H 1 110 ARG HG2 2.783 . 3.751 3.676 3.240 4.349 0.598 8 2 "[ . + 1 . -]" 1
2042 1 110 ARG H 1 110 ARG HG3 2.040 . 3.560 2.804 2.235 4.336 0.776 15 4 "[ . * + * -]" 1
2043 1 110 ARG H 1 111 TYR H 2.407 . 3.131 2.607 2.280 2.802 . 0 0 "[ . 1 . 2]" 1
2044 1 110 ARG HA 1 110 ARG QB 2.253 . 2.496 2.343 2.120 2.429 . 0 0 "[ . 1 . 2]" 1
2045 1 110 ARG HA 1 110 ARG HD2 3.194 . 4.469 4.519 4.303 4.595 0.126 19 0 "[ . 1 . 2]" 1
2046 1 110 ARG HA 1 110 ARG HD3 3.208 . 4.494 4.458 4.349 4.759 0.265 10 0 "[ . 1 . 2]" 1
2047 1 110 ARG HA 1 110 ARG HG2 2.381 . 3.090 2.756 2.536 3.710 0.620 17 2 "[ . - . + 2]" 1
2048 1 110 ARG HA 1 111 TYR H 3.049 . 4.211 3.511 3.441 3.587 . 0 0 "[ . 1 . 2]" 1
2049 1 110 ARG HA 1 113 ASP HB2 3.205 . 4.489 4.241 3.157 4.550 0.061 2 0 "[ . 1 . 2]" 1
2050 1 110 ARG HA 1 113 ASP HB3 3.054 . 4.220 3.663 3.115 4.607 0.387 16 0 "[ . 1 . 2]" 1
2051 1 110 ARG QB 1 110 ARG HD2 2.502 . 2.697 2.254 2.169 2.426 . 0 0 "[ . 1 . 2]" 1
2052 1 110 ARG QB 1 110 ARG HD3 2.184 . 2.780 2.363 2.259 2.435 . 0 0 "[ . 1 . 2]" 1
2053 1 110 ARG QB 1 110 ARG HG2 1.814 . 2.226 2.286 2.244 2.377 0.151 20 0 "[ . 1 . 2]" 1
2054 1 110 ARG QB 1 111 TYR H 2.430 . 3.168 2.761 2.417 3.206 0.038 17 0 "[ . 1 . 2]" 1
2055 1 110 ARG HD2 1 110 ARG HG2 2.382 . 3.092 3.000 2.993 3.012 . 0 0 "[ . 1 . 2]" 1
2056 1 110 ARG HD2 1 110 ARG HG3 2.130 . 2.697 2.461 2.419 2.498 . 0 0 "[ . 1 . 2]" 1
2057 1 110 ARG HD3 1 110 ARG HG2 2.452 . 3.204 2.405 2.369 2.464 . 0 0 "[ . 1 . 2]" 1
2058 1 110 ARG HD3 1 110 ARG HG3 2.662 . 3.548 3.001 2.978 3.010 . 0 0 "[ . 1 . 2]" 1
2059 1 111 TYR H 1 111 TYR HB2 2.448 . 3.197 2.730 2.429 3.706 0.509 15 1 "[ . 1 + 2]" 1
2060 1 111 TYR H 1 112 LYS H 2.597 . 3.440 2.245 2.100 2.458 . 0 0 "[ . 1 . 2]" 1
2061 1 111 TYR H 1 112 LYS QB 3.249 . 4.568 4.000 3.695 4.272 . 0 0 "[ . 1 . 2]" 1
2062 1 111 TYR HA 1 111 TYR HB2 2.600 . 3.445 2.925 2.488 3.032 . 0 0 "[ . 1 . 2]" 1
2063 1 111 TYR HA 1 111 TYR HB3 2.529 . 3.329 2.447 2.334 2.502 . 0 0 "[ . 1 . 2]" 1
2064 1 111 TYR HA 1 114 ALA MB 2.661 . 3.546 3.508 3.179 3.653 0.107 20 0 "[ . 1 . 2]" 1
2065 1 111 TYR HB2 1 111 TYR HD2 2.616 . 3.471 2.527 2.271 3.412 . 0 0 "[ . 1 . 2]" 1
2066 1 111 TYR HB2 1 111 TYR HE2 3.703 . 5.417 4.720 4.570 5.226 . 0 0 "[ . 1 . 2]" 1
2067 1 111 TYR HB3 1 111 TYR HD2 2.704 . 3.618 3.061 2.176 3.331 . 0 0 "[ . 1 . 2]" 1
2068 1 111 TYR HB3 1 111 TYR HE2 3.534 . 5.096 5.029 4.464 5.191 0.095 3 0 "[ . 1 . 2]" 1
2069 1 112 LYS H 1 112 LYS QB 2.136 . 2.707 2.192 2.123 2.270 . 0 0 "[ . 1 . 2]" 1
2070 1 112 LYS H 1 113 ASP H 2.768 . 3.726 2.522 2.301 2.661 . 0 0 "[ . 1 . 2]" 1
2071 1 112 LYS HA 1 112 LYS QB 2.117 . 2.677 2.449 2.367 2.515 . 0 0 "[ . 1 . 2]" 1
2072 1 112 LYS HA 1 112 LYS HD2 3.557 2.740 4.374 4.376 3.210 4.569 0.195 10 0 "[ . 1 . 2]" 1
2073 1 112 LYS HA 1 112 LYS QE 3.258 . 4.585 4.291 2.344 4.607 0.022 1 0 "[ . 1 . 2]" 1
2074 1 112 LYS HA 1 112 LYS HG2 2.567 . 3.391 2.611 2.323 3.556 0.165 5 0 "[ . 1 . 2]" 1
2075 1 112 LYS HA 1 112 LYS HG3 2.670 . 3.561 2.603 2.139 2.798 . 0 0 "[ . 1 . 2]" 1
2076 1 112 LYS QB 1 112 LYS HD2 2.062 . 2.593 2.309 2.003 2.473 . 0 0 "[ . 1 . 2]" 1
2077 1 112 LYS QB 1 112 LYS HD3 2.036 . 2.554 2.391 2.104 3.250 0.696 10 1 "[ . + . 2]" 1
2078 1 112 LYS QB 1 112 LYS QE 2.911 . 3.970 3.285 1.926 3.504 . 0 0 "[ . 1 . 2]" 1
2079 1 112 LYS QB 1 112 LYS HG2 2.316 . 2.974 2.282 2.126 2.350 . 0 0 "[ . 1 . 2]" 1
2080 1 112 LYS QB 1 112 LYS HG3 2.131 . 2.699 2.295 2.243 2.478 . 0 0 "[ . 1 . 2]" 1
2081 1 112 LYS QB 1 113 ASP H 2.475 . 3.240 2.373 2.005 2.720 . 0 0 "[ . 1 . 2]" 1
2082 1 112 LYS HD2 1 112 LYS QE 2.216 . 2.830 2.215 2.130 2.397 . 0 0 "[ . 1 . 2]" 1
2083 1 112 LYS HD3 1 112 LYS QE 2.307 . 2.816 2.340 2.138 2.441 . 0 0 "[ . 1 . 2]" 1
2084 1 112 LYS QE 1 112 LYS HG2 2.718 . 3.427 2.621 2.115 3.255 . 0 0 "[ . 1 . 2]" 1
2085 1 112 LYS QE 1 112 LYS HG3 2.729 . 3.591 2.321 2.102 2.828 . 0 0 "[ . 1 . 2]" 1
2086 1 112 LYS HG2 1 113 ASP H 3.631 . 5.279 4.545 3.305 5.017 . 0 0 "[ . 1 . 2]" 1
2087 1 112 LYS HG3 1 113 ASP H 3.412 . 4.867 4.615 4.356 4.823 . 0 0 "[ . 1 . 2]" 1
2088 1 113 ASP H 1 113 ASP HA 2.366 . 3.066 2.866 2.821 2.895 . 0 0 "[ . 1 . 2]" 1
2089 1 113 ASP H 1 113 ASP HB2 2.469 . 3.231 2.394 2.090 2.609 . 0 0 "[ . 1 . 2]" 1
2090 1 113 ASP H 1 113 ASP HB3 2.319 . 2.991 2.730 2.488 3.461 0.470 10 0 "[ . 1 . 2]" 1
2091 1 113 ASP H 1 114 ALA H 2.383 . 3.093 2.369 2.225 2.520 . 0 0 "[ . 1 . 2]" 1
2092 1 113 ASP HA 1 113 ASP HB2 2.261 . 2.900 2.600 2.485 2.985 0.085 10 0 "[ . 1 . 2]" 1
2093 1 113 ASP HA 1 113 ASP HB3 2.381 . 3.089 2.977 2.619 3.022 . 0 0 "[ . 1 . 2]" 1
2094 1 113 ASP HA 1 114 ALA MB 3.025 . 4.169 4.019 3.967 4.125 . 0 0 "[ . 1 . 2]" 1
2095 1 113 ASP HB2 1 114 ALA H 2.680 . 3.578 3.615 2.927 3.773 0.195 20 0 "[ . 1 . 2]" 1
2096 1 113 ASP HB3 1 114 ALA H 2.680 . 3.578 2.717 2.467 3.568 . 0 0 "[ . 1 . 2]" 1
2097 1 113 ASP HB3 1 115 ASP H 2.297 . 2.957 2.719 2.344 2.975 0.018 4 0 "[ . 1 . 2]" 1
2098 1 114 ALA H 1 114 ALA HA 2.380 . 3.088 2.259 2.251 2.276 . 0 0 "[ . 1 . 2]" 1
2099 1 114 ALA H 1 115 ASP H 2.452 . 3.204 2.621 2.515 2.807 . 0 0 "[ . 1 . 2]" 1
2100 1 114 ALA HA 1 114 ALA MB 1.986 . 2.479 2.121 2.117 2.125 . 0 0 "[ . 1 . 2]" 1
2101 1 114 ALA HA 1 115 ASP H 2.351 . 3.042 2.977 2.598 3.084 0.042 11 0 "[ . 1 . 2]" 1
2102 1 114 ALA MB 1 115 ASP H 2.645 . 3.519 3.565 3.509 3.677 0.158 7 0 "[ . 1 . 2]" 1
2103 1 115 ASP H 1 115 ASP HA 2.421 . 3.154 2.919 2.804 2.943 . 0 0 "[ . 1 . 2]" 1
2104 1 115 ASP H 1 115 ASP HB2 2.297 . 2.957 2.876 2.406 3.057 0.100 2 0 "[ . 1 . 2]" 1
2105 1 115 ASP H 1 115 ASP HB3 2.297 . 2.957 2.581 2.481 2.708 . 0 0 "[ . 1 . 2]" 1
2106 1 115 ASP HA 1 115 ASP HB3 2.195 . 2.797 3.025 3.019 3.028 0.231 10 0 "[ . 1 . 2]" 1
2107 2 1 ASP HA 2 2 THR H 5.000 . 5.000 3.517 3.232 3.576 . 0 0 "[ . 1 . 2]" 1
2108 2 1 ASP HA 2 4 ASP QB 6.500 2.300 6.500 2.696 2.272 3.635 0.028 15 0 "[ . 1 . 2]" 1
2109 2 2 THR HA 2 2 THR HB 2.500 . 2.500 2.547 2.452 2.593 0.093 20 0 "[ . 1 . 2]" 1
2110 2 2 THR HA 2 3 GLN H 5.000 . 5.000 3.545 3.433 3.578 . 0 0 "[ . 1 . 2]" 1
2111 2 2 THR HA 2 5 ASP QB 6.735 . 6.735 2.908 2.087 3.430 . 0 0 "[ . 1 . 2]" 1
2112 2 2 THR HB 2 3 GLN H 5.000 . 5.000 3.392 3.123 4.007 . 0 0 "[ . 1 . 2]" 1
2113 2 2 THR HB 2 4 ASP H 5.000 . 5.000 5.108 5.041 5.307 0.307 17 0 "[ . 1 . 2]" 1
2114 2 3 GLN H 2 4 ASP H 4.000 . 4.000 2.543 2.415 2.658 . 0 0 "[ . 1 . 2]" 1
2115 2 3 GLN HA 2 4 ASP H 4.000 . 4.000 3.446 3.404 3.478 . 0 0 "[ . 1 . 2]" 1
2116 2 3 GLN HA 2 6 PHE QB 6.000 . 6.000 2.785 2.001 3.671 . 0 0 "[ . 1 . 2]" 1
2117 2 3 GLN HA 2 6 PHE QD 6.000 . 6.000 2.578 1.911 4.478 . 0 0 "[ . 1 . 2]" 1
2118 2 4 ASP H 2 5 ASP H 4.000 . 4.000 2.500 2.296 2.689 . 0 0 "[ . 1 . 2]" 1
2119 2 4 ASP HA 2 5 ASP H 4.000 . 4.000 3.510 3.451 3.564 . 0 0 "[ . 1 . 2]" 1
2120 2 4 ASP HA 2 6 PHE QD 6.000 . 6.000 5.747 5.046 6.100 0.100 7 0 "[ . 1 . 2]" 1
2121 2 4 ASP HA 2 7 LEU HB2 7.000 2.800 7.000 3.884 2.817 5.577 . 0 0 "[ . 1 . 2]" 1
2122 2 4 ASP HA 2 7 LEU HB3 5.000 2.800 5.000 4.378 2.733 5.516 0.516 19 1 "[ . 1 . +2]" 1
2123 2 4 ASP HA 2 7 LEU MD2 7.206 . 7.206 3.791 2.091 5.181 . 0 0 "[ . 1 . 2]" 1
2124 2 5 ASP H 2 6 PHE H 4.000 . 4.000 2.591 2.439 2.787 . 0 0 "[ . 1 . 2]" 1
2125 2 5 ASP HA 2 6 PHE H 4.000 . 4.000 3.481 3.377 3.544 . 0 0 "[ . 1 . 2]" 1
2126 2 5 ASP HA 2 8 LYS QD 6.000 . 6.000 3.131 1.827 4.518 . 0 0 "[ . 1 . 2]" 1
2127 2 5 ASP HA 2 8 LYS QE 5.000 2.800 5.000 4.199 2.690 5.020 0.110 7 0 "[ . 1 . 2]" 1
2128 2 5 ASP HA 2 8 LYS HG2 5.000 . 5.000 3.185 1.850 5.011 0.011 18 0 "[ . 1 . 2]" 1
2129 2 5 ASP HA 2 8 LYS HG3 5.000 . 5.000 3.378 2.186 5.050 0.050 9 0 "[ . 1 . 2]" 1
2130 2 5 ASP QB 2 6 PHE H 4.000 . 4.000 2.769 2.357 3.640 . 0 0 "[ . 1 . 2]" 1
2131 2 6 PHE H 2 7 LEU H 4.000 . 4.000 2.644 2.549 2.736 . 0 0 "[ . 1 . 2]" 1
2132 2 6 PHE HA 2 7 LEU H 4.000 . 4.000 3.439 3.381 3.526 . 0 0 "[ . 1 . 2]" 1
2133 2 6 PHE HA 2 8 LYS H 6.000 . 6.000 4.344 3.806 4.813 . 0 0 "[ . 1 . 2]" 1
2134 2 6 PHE HA 2 9 TRP QB 4.000 . 4.000 4.114 3.876 4.251 0.251 3 0 "[ . 1 . 2]" 1
2135 2 6 PHE HA 2 9 TRP HD1 . . 5.000 2.002 1.784 2.464 0.016 3 0 "[ . 1 . 2]" 1
2136 2 6 PHE QB 2 7 LEU H 4.000 . 4.000 3.035 2.645 3.210 . 0 0 "[ . 1 . 2]" 1
2137 2 6 PHE QD 2 9 TRP HE1 3.000 . 3.400 2.419 1.955 3.383 0.045 20 0 "[ . 1 . 2]" 1
2138 2 6 PHE QD 2 9 TRP HZ2 6.000 . 6.000 3.498 2.389 5.286 . 0 0 "[ . 1 . 2]" 1
2139 2 6 PHE QE 2 9 TRP HZ2 6.000 . 6.000 3.922 3.230 4.944 . 0 0 "[ . 1 . 2]" 1
2140 2 7 LEU H 2 7 LEU HB2 4.000 . 4.000 2.802 2.277 3.752 . 0 0 "[ . 1 . 2]" 1
2141 2 7 LEU H 2 7 LEU HB3 4.000 . 4.000 3.137 2.244 3.689 . 0 0 "[ . 1 . 2]" 1
2142 2 7 LEU H 2 7 LEU HG 4.000 . 4.000 3.120 2.043 4.255 0.255 6 0 "[ . 1 . 2]" 1
2143 2 7 LEU H 2 8 LYS H 4.000 . 4.000 2.298 1.988 2.570 . 0 0 "[ . 1 . 2]" 1
2144 2 7 LEU H 2 9 TRP H 6.000 . 6.000 4.070 3.720 4.473 . 0 0 "[ . 1 . 2]" 1
2145 2 7 LEU HA 2 7 LEU HG 4.000 . 4.000 3.139 2.416 3.708 . 0 0 "[ . 1 . 2]" 1
2146 2 7 LEU HA 2 8 LYS H 4.000 . 4.000 3.492 3.373 3.580 . 0 0 "[ . 1 . 2]" 1
2147 2 7 LEU HA 2 10 TRP QB 5.000 . 5.000 3.224 2.717 3.845 . 0 0 "[ . 1 . 2]" 1
2148 2 7 LEU QB 2 7 LEU HG 2.800 . 2.800 2.391 2.338 2.486 . 0 0 "[ . 1 . 2]" 1
2149 2 7 LEU HB2 2 8 LYS H 5.000 . 5.000 3.331 2.347 4.169 . 0 0 "[ . 1 . 2]" 1
2150 2 7 LEU HB3 2 8 LYS H 5.000 . 5.000 3.532 2.535 4.255 . 0 0 "[ . 1 . 2]" 1
2151 2 8 LYS H 2 8 LYS HB2 4.000 . 4.000 3.015 2.404 3.672 . 0 0 "[ . 1 . 2]" 1
2152 2 8 LYS H 2 8 LYS HB3 4.000 . 4.000 2.958 2.304 3.626 . 0 0 "[ . 1 . 2]" 1
2153 2 8 LYS H 2 8 LYS HD2 5.000 . 5.000 4.513 3.548 5.063 0.063 9 0 "[ . 1 . 2]" 1
2154 2 8 LYS H 2 8 LYS HD3 5.000 . 5.000 4.523 3.576 4.996 . 0 0 "[ . 1 . 2]" 1
2155 2 8 LYS H 2 8 LYS QG 5.000 . 5.000 2.555 1.834 3.998 . 0 0 "[ . 1 . 2]" 1
2156 2 8 LYS H 2 9 TRP H 4.000 . 4.000 2.609 2.372 2.772 . 0 0 "[ . 1 . 2]" 1
2157 2 8 LYS HA 2 8 LYS QE 6.000 . 6.000 4.202 1.816 5.769 . 0 0 "[ . 1 . 2]" 1
2158 2 8 LYS HA 2 9 TRP H 5.000 . 5.000 3.561 3.484 3.596 . 0 0 "[ . 1 . 2]" 1
2159 2 8 LYS HA 2 11 ARG QD 6.735 . 6.735 5.090 3.221 6.610 . 0 0 "[ . 1 . 2]" 1
2160 2 8 LYS HA 2 11 ARG QG 6.735 . 6.735 3.943 2.717 5.391 . 0 0 "[ . 1 . 2]" 1
2161 2 8 LYS QE 2 9 TRP H 5.000 . 5.000 4.779 4.166 5.062 0.062 9 0 "[ . 1 . 2]" 1
2162 2 8 LYS QG 2 9 TRP H 6.000 . 6.000 3.152 2.004 4.325 . 0 0 "[ . 1 . 2]" 1
2163 2 9 TRP H 2 11 ARG H 5.000 . 5.000 4.310 3.992 4.530 . 0 0 "[ . 1 . 2]" 1
2164 2 9 TRP HA 2 12 SER QB 4.000 . 4.000 2.851 1.966 3.860 . 0 0 "[ . 1 . 2]" 1
2165 2 10 TRP HA 2 10 TRP HE3 3.900 3.400 4.400 4.033 3.839 4.137 . 0 0 "[ . 1 . 2]" 1
2166 2 10 TRP HA 2 10 TRP HZ3 4.500 3.600 6.000 6.016 5.832 6.116 0.116 20 0 "[ . 1 . 2]" 1
2167 2 10 TRP HA 2 11 ARG H 5.000 . 5.000 3.532 3.402 3.561 . 0 0 "[ . 1 . 2]" 1
2168 2 10 TRP HA 2 13 GLU QB 4.000 . 4.000 3.281 2.619 4.015 0.015 12 0 "[ . 1 . 2]" 1
2169 2 10 TRP QB 2 11 ARG H 6.000 . 6.000 2.500 2.379 3.080 . 0 0 "[ . 1 . 2]" 1
2170 2 10 TRP HD1 2 11 ARG HA 3.500 2.600 4.400 3.891 3.309 4.474 0.074 12 0 "[ . 1 . 2]" 1
2171 2 10 TRP HD1 2 11 ARG QD 6.000 . 6.000 4.712 3.041 6.113 0.113 19 0 "[ . 1 . 2]" 1
2172 2 10 TRP HD1 2 11 ARG QG 6.000 . 6.000 4.929 3.850 6.044 0.044 9 0 "[ . 1 . 2]" 1
2173 2 11 ARG H 2 12 SER H 5.000 . 5.000 2.473 2.155 2.680 . 0 0 "[ . 1 . 2]" 1
2174 2 11 ARG HA 2 12 SER H 5.000 . 5.000 3.483 3.368 3.550 . 0 0 "[ . 1 . 2]" 1
2175 2 11 ARG HA 2 14 GLU QB 5.000 . 5.000 2.434 1.875 2.898 . 0 0 "[ . 1 . 2]" 1
2176 2 11 ARG QB 2 12 SER HA 6.000 . 6.000 4.019 3.813 4.652 . 0 0 "[ . 1 . 2]" 1
2177 2 12 SER H 2 13 GLU H 5.000 . 5.000 2.626 2.448 2.803 . 0 0 "[ . 1 . 2]" 1
2178 2 12 SER H 2 14 GLU H 6.000 . 6.000 3.985 3.641 4.356 . 0 0 "[ . 1 . 2]" 1
2179 2 12 SER HA 2 13 GLU H 4.000 . 4.000 3.532 3.480 3.572 . 0 0 "[ . 1 . 2]" 1
2180 2 12 SER HA 2 15 ALA MB 7.206 . 7.206 2.763 2.318 3.832 . 0 0 "[ . 1 . 2]" 1
2181 2 13 GLU H 2 14 GLU H 5.000 . 5.000 2.545 2.443 2.713 . 0 0 "[ . 1 . 2]" 1
2182 2 13 GLU HA 2 14 GLU H 4.000 . 4.000 3.520 3.464 3.562 . 0 0 "[ . 1 . 2]" 1
2183 2 13 GLU HA 2 16 GLN QB 4.000 . 4.000 3.075 2.108 3.746 . 0 0 "[ . 1 . 2]" 1
2184 2 13 GLU HA 2 16 GLN QG 5.612 . 5.612 3.687 1.888 5.294 . 0 0 "[ . 1 . 2]" 1
2185 2 14 GLU H 2 14 GLU QG 5.000 . 5.000 3.262 2.081 4.076 . 0 0 "[ . 1 . 2]" 1
2186 2 14 GLU H 2 15 ALA H 4.000 . 4.000 2.582 2.408 2.724 . 0 0 "[ . 1 . 2]" 1
2187 2 14 GLU HA 2 15 ALA H 4.000 . 4.000 3.501 3.447 3.561 . 0 0 "[ . 1 . 2]" 1
2188 2 14 GLU HA 2 16 GLN H 6.000 . 6.000 3.921 3.601 4.582 . 0 0 "[ . 1 . 2]" 1
2189 2 14 GLU HA 2 17 ASP QB 6.000 . 6.000 3.418 2.380 4.968 . 0 0 "[ . 1 . 2]" 1
2190 2 14 GLU QB 2 15 ALA H 5.000 . 5.000 2.723 2.440 2.922 . 0 0 "[ . 1 . 2]" 1
2191 2 14 GLU QG 2 17 ASP QB 6.735 . 6.735 4.483 3.094 6.350 . 0 0 "[ . 1 . 2]" 1
2192 2 15 ALA H 2 16 GLN H 4.000 . 4.000 2.589 2.477 2.800 . 0 0 "[ . 1 . 2]" 1
2193 2 15 ALA HA 2 16 GLN H 4.000 . 4.000 3.447 3.335 3.555 . 0 0 "[ . 1 . 2]" 1
2194 2 15 ALA HA 2 18 MET QB 5.000 . 5.000 3.223 2.063 4.721 . 0 0 "[ . 1 . 2]" 1
2195 2 15 ALA HA 2 18 MET ME 6.000 . 6.000 4.507 1.988 6.009 0.009 3 0 "[ . 1 . 2]" 1
2196 2 15 ALA HA 2 18 MET QG 6.000 . 6.000 3.892 2.528 5.672 . 0 0 "[ . 1 . 2]" 1
2197 2 15 ALA MB 2 16 GLN H 7.206 . 7.206 2.872 2.372 3.151 . 0 0 "[ . 1 . 2]" 1
2198 2 16 GLN H 2 16 GLN QG 5.000 . 5.000 3.172 2.027 4.070 . 0 0 "[ . 1 . 2]" 1
2199 2 16 GLN H 2 17 ASP H 4.000 . 4.000 2.551 2.274 2.704 . 0 0 "[ . 1 . 2]" 1
2200 2 16 GLN HA 2 17 ASP H 4.000 . 4.000 3.503 3.411 3.565 . 0 0 "[ . 1 . 2]" 1
2201 2 16 GLN QB 2 17 ASP H 5.000 . 5.000 2.736 2.375 3.612 . 0 0 "[ . 1 . 2]" 1
2202 2 17 ASP H 2 18 MET H 4.000 . 4.000 2.408 2.035 2.655 . 0 0 "[ . 1 . 2]" 1
2203 2 17 ASP HA 2 18 MET H 4.000 . 4.000 3.487 3.314 3.568 . 0 0 "[ . 1 . 2]" 1
2204 2 18 MET H 2 18 MET QG 5.000 . 5.000 3.244 1.999 4.524 . 0 0 "[ . 1 . 2]" 1
2205 2 18 MET H 2 19 GLY H 4.000 . 4.000 3.021 2.278 4.011 0.011 17 0 "[ . 1 . 2]" 1
2206 2 18 MET HA 2 18 MET QG 4.000 . 4.000 2.784 2.406 3.349 . 0 0 "[ . 1 . 2]" 1
2207 2 18 MET HA 2 19 GLY H 4.000 . 4.000 2.953 2.156 3.573 . 0 0 "[ . 1 . 2]" 1
2208 2 18 MET QB 2 19 GLY H 5.000 . 5.000 3.307 2.234 4.035 . 0 0 "[ . 1 . 2]" 1
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