NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
549150 |
2llu   |
18089 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2llu
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 2591
_Distance_constraint_stats_list.Viol_count 2558
_Distance_constraint_stats_list.Viol_total 18374.244
_Distance_constraint_stats_list.Viol_max 2.091
_Distance_constraint_stats_list.Viol_rms 0.1102
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0177
_Distance_constraint_stats_list.Viol_average_violations_only 0.3592
_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 1 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 SER 0.210 0.076 6 0 "[ . 1 . 2]"
1 3 GLU 11.523 0.753 20 11 "[* . -*1*** ** **+]"
1 4 LEU 23.399 0.772 5 16 "[*** + **-1****** ***]"
1 5 GLU 1.419 0.359 6 0 "[ . 1 . 2]"
1 6 THR 5.872 0.323 11 0 "[ . 1 . 2]"
1 7 ALA 5.188 0.359 6 0 "[ . 1 . 2]"
1 8 MET 6.456 0.508 11 1 "[ . 1+ . 2]"
1 9 GLU 6.119 0.323 11 0 "[ . 1 . 2]"
1 10 THR 6.059 0.380 4 0 "[ . 1 . 2]"
1 11 LEU 1.677 0.144 9 0 "[ . 1 . 2]"
1 12 ILE 0.834 0.098 17 0 "[ . 1 . 2]"
1 13 ASN 6.487 0.380 4 0 "[ . 1 . 2]"
1 14 VAL 17.055 0.815 9 19 "[ *******+********-**]"
1 15 PHE 0.376 0.104 15 0 "[ . 1 . 2]"
1 16 HIS 0.299 0.082 8 0 "[ . 1 . 2]"
1 17 ALA 0.268 0.082 8 0 "[ . 1 . 2]"
1 18 HIS 15.662 0.815 9 19 "[ *******+********-**]"
1 19 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 GLY 11.010 1.462 16 8 "[* *- * 1 * .+ * *]"
1 21 LYS 11.010 1.462 16 8 "[* *- * 1 * .+ * *]"
1 22 GLU 0.032 0.032 9 0 "[ . 1 . 2]"
1 23 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 ASP 0.032 0.032 9 0 "[ . 1 . 2]"
1 25 LYS 0.606 0.178 7 0 "[ . 1 . 2]"
1 26 TYR 0.198 0.198 5 0 "[ . 1 . 2]"
1 27 LYS 4.971 0.587 2 1 "[ + . 1 . 2]"
1 28 LEU 29.437 0.765 8 17 "[**-****+** *** ****]"
1 29 SER 8.525 0.626 13 2 "[ . - 1 + . 2]"
1 30 LYS 0.632 0.152 17 0 "[ . 1 . 2]"
1 31 LYS 19.552 0.748 14 5 "[ * * 1 +. * -]"
1 32 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 LEU 0.826 0.076 10 0 "[ . 1 . 2]"
1 34 LYS 15.008 0.623 6 2 "[ .+ 1 . -2]"
1 35 GLU 17.648 0.923 20 20 [**************-****+]
1 36 LEU 24.251 0.756 15 19 [****.*********+***-*]
1 37 LEU 64.068 1.016 5 20 [****+*************-*]
1 38 GLN 47.513 1.819 2 18 [*+**.**************2]
1 39 THR 4.129 0.242 14 0 "[ . 1 . 2]"
1 40 GLU 12.749 0.512 11 8 "[** . **1+ -* * 2]"
1 41 LEU 53.632 1.250 15 20 [*************-+*****]
1 42 SER 21.657 0.833 18 19 "[***-*********** *+**]"
1 43 GLY 4.545 0.517 10 1 "[ . + . 2]"
1 44 PHE 25.428 1.502 1 20 [+********-**********]
1 45 LEU 48.366 1.819 2 20 [*+*-****************]
1 46 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 ALA 5.024 0.484 1 0 "[ . 1 . 2]"
1 48 GLN 10.212 0.612 20 3 "[* .- 1 . +]"
1 49 LYS 0.259 0.169 16 0 "[ . 1 . 2]"
1 50 ASP 8.234 0.428 11 0 "[ . 1 . 2]"
1 51 VAL 5.288 0.511 18 1 "[ . 1 . + 2]"
1 52 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 ALA 28.631 1.334 18 20 [*************-***+**]
1 54 VAL 60.264 1.482 5 20 [****+************-**]
1 55 ASP 5.939 0.428 20 0 "[ . 1 . 2]"
1 56 LYS 8.805 0.397 9 0 "[ . 1 . 2]"
1 57 VAL 11.239 1.644 16 8 "[ *-** 1 .+***2]"
1 58 MET 15.270 1.644 16 8 "[ *-** 1 .+***2]"
1 59 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 GLU 0.345 0.133 8 0 "[ . 1 . 2]"
1 61 LEU 20.899 0.874 9 16 "[******* +** **- ***2]"
1 62 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 GLU 16.044 0.874 9 16 "[******* +** **- ***2]"
1 64 ASN 4.510 0.398 12 0 "[ . 1 . 2]"
1 65 GLY 19.755 0.748 14 5 "[ * * 1 +. * -]"
1 66 ASP 0.632 0.152 17 0 "[ . 1 . 2]"
1 67 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 VAL 13.926 0.831 12 18 "[* -********+*** ****]"
1 70 ASP 3.494 0.311 11 0 "[ . 1 . 2]"
1 71 PHE 2.973 0.941 17 2 "[- . 1 . + 2]"
1 72 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 GLU 1.799 0.831 12 2 "[ . 1-+ . 2]"
1 74 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 VAL 8.596 0.517 9 13 "[ * ** +** ****- **]"
1 76 VAL 8.000 0.513 4 3 "[- +. * 1 . 2]"
1 77 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 VAL 19.710 1.250 15 19 [*********1*-**+*****]
1 79 ALA 0.235 0.131 10 0 "[ . 1 . 2]"
1 80 ALA 4.342 0.351 8 0 "[ . 1 . 2]"
1 81 LEU 9.868 0.554 2 3 "[ +- . 1 .* 2]"
1 82 THR 32.397 1.502 1 20 [+*******-***********]
1 83 VAL 0.020 0.020 17 0 "[ . 1 . 2]"
1 84 ALA 31.746 1.482 5 20 [****+************-**]
1 85 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 ASN 8.598 0.481 18 0 "[ . 1 . 2]"
1 87 ASN 23.069 2.091 10 17 "[ ****** *+** ******-]"
1 88 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 PHE 0.327 0.093 9 0 "[ . 1 . 2]"
1 90 TRP 8.738 0.428 11 0 "[ . 1 . 2]"
1 91 GLU 0.275 0.067 1 0 "[ . 1 . 2]"
1 92 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 1 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 2 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 3 GLU 6.778 0.456 17 0 "[ . 1 . 2]"
2 4 LEU 17.849 0.623 8 11 "[ *** + 1* ***** -]"
2 5 GLU 0.500 0.216 10 0 "[ . 1 . 2]"
2 6 THR 4.545 0.265 15 0 "[ . 1 . 2]"
2 7 ALA 4.460 0.442 9 0 "[ . 1 . 2]"
2 8 MET 5.933 0.453 9 0 "[ . 1 . 2]"
2 9 GLU 4.623 0.265 15 0 "[ . 1 . 2]"
2 10 THR 6.403 0.509 5 1 "[ + 1 . 2]"
2 11 LEU 2.254 0.173 16 0 "[ . 1 . 2]"
2 12 ILE 2.355 0.190 17 0 "[ . 1 . 2]"
2 13 ASN 7.062 0.509 5 1 "[ + 1 . 2]"
2 14 VAL 15.630 0.919 7 14 "[ **** + ** * -.*****]"
2 15 PHE 1.856 0.190 17 0 "[ . 1 . 2]"
2 16 HIS 0.604 0.086 20 0 "[ . 1 . 2]"
2 17 ALA 0.602 0.086 20 0 "[ . 1 . 2]"
2 18 HIS 13.879 0.919 7 14 "[ **** + ** * -.*****]"
2 19 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 20 GLY 14.449 1.470 16 11 "[* -.* * * * .+****]"
2 21 LYS 14.455 1.470 16 11 "[* -.* * * * .+****]"
2 22 GLU 0.013 0.013 3 0 "[ . 1 . 2]"
2 23 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 24 ASP 0.013 0.013 3 0 "[ . 1 . 2]"
2 25 LYS 0.367 0.155 6 0 "[ . 1 . 2]"
2 26 TYR 0.088 0.088 1 0 "[ . 1 . 2]"
2 27 LYS 1.360 0.158 3 0 "[ . 1 . 2]"
2 28 LEU 5.265 0.303 8 0 "[ . 1 . 2]"
2 29 SER 0.765 0.084 16 0 "[ . 1 . 2]"
2 30 LYS 0.927 0.158 3 0 "[ . 1 . 2]"
2 31 LYS 19.381 0.725 13 9 "[ **** ** +*. *2]"
2 32 GLU 0.075 0.049 13 0 "[ . 1 . 2]"
2 33 LEU 1.193 0.098 17 0 "[ . 1 . 2]"
2 34 LYS 11.779 0.459 3 0 "[ . 1 . 2]"
2 35 GLU 17.662 0.883 20 20 [***********-*******+]
2 36 LEU 23.662 0.577 2 17 "[*+**. * ***-********]"
2 37 LEU 56.281 1.077 19 20 [***********-******+*]
2 38 GLN 47.471 2.054 15 18 "[***** ***-* **+*****]"
2 39 THR 3.760 0.242 3 0 "[ . 1 . 2]"
2 40 GLU 12.811 0.513 13 11 "[* - . **1**+ * ***]"
2 41 LEU 51.568 1.203 13 20 [*****-******+*******]
2 42 SER 21.638 0.904 12 18 "[* - *******+********]"
2 43 GLY 3.666 0.514 10 2 "[ . + . - 2]"
2 44 PHE 25.124 1.545 1 20 [+***************-***]
2 45 LEU 57.364 2.054 15 20 [*********-****+*****]
2 46 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 47 ALA 4.442 0.492 15 0 "[ . 1 . 2]"
2 48 GLN 8.334 0.498 16 0 "[ . 1 . 2]"
2 49 LYS 0.776 0.271 17 0 "[ . 1 . 2]"
2 50 ASP 8.425 0.433 15 0 "[ . 1 . 2]"
2 51 VAL 4.245 0.508 12 4 "[ . 1 +* . -*2]"
2 52 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 53 ALA 29.034 1.306 12 20 [***********+*-******]
2 54 VAL 60.150 1.342 5 20 [****+******-********]
2 55 ASP 5.290 0.653 12 1 "[ . 1 + . 2]"
2 56 LYS 10.185 0.404 12 0 "[ . 1 . 2]"
2 57 VAL 13.959 1.729 1 10 "[+ *** * 1* **. - *]"
2 58 MET 17.723 1.729 1 11 "[+ *** * 1****. - *]"
2 59 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 60 GLU 0.311 0.110 14 0 "[ . 1 . 2]"
2 61 LEU 21.808 0.800 15 16 "[************ +* * -]"
2 62 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 63 GLU 16.462 0.800 15 16 "[************ +* * -]"
2 64 ASN 5.035 0.447 7 0 "[ . 1 . 2]"
2 65 GLY 26.737 0.725 13 9 "[ **** ** +*. *2]"
2 66 ASP 0.927 0.158 3 0 "[ . 1 . 2]"
2 67 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 68 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 69 VAL 10.691 0.784 16 3 "[ . 1 .+* -2]"
2 70 ASP 3.140 0.303 8 0 "[ . 1 . 2]"
2 71 PHE 1.870 0.932 10 2 "[ . + - 2]"
2 72 GLN 21.199 2.091 10 17 "[ ****** *+** ******-]"
2 73 GLU 2.755 0.784 16 2 "[ . 1 .+- 2]"
2 74 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
2 75 VAL 2.736 0.513 4 3 "[- +. * 1 . 2]"
2 76 VAL 13.564 0.517 9 13 "[ * ** +** ****- **]"
2 77 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 78 VAL 19.156 1.203 13 19 "[*****-******+*** ***]"
2 79 ALA 0.405 0.182 17 0 "[ . 1 . 2]"
2 80 ALA 5.971 0.334 20 0 "[ . 1 . 2]"
2 81 LEU 13.997 0.836 13 10 "[* . *-1* + **** *]"
2 82 THR 33.419 1.545 1 20 [+*****************-*]
2 83 VAL 0.006 0.006 17 0 "[ . 1 . 2]"
2 84 ALA 28.997 1.342 5 20 [****+************-**]
2 85 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 86 ASN 8.385 0.472 2 0 "[ . 1 . 2]"
2 87 ASN 2.973 0.941 17 2 "[- . 1 . + 2]"
2 88 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
2 89 PHE 0.540 0.198 5 0 "[ . 1 . 2]"
2 90 TRP 8.800 0.433 15 0 "[ . 1 . 2]"
2 91 GLU 0.082 0.042 16 0 "[ . 1 . 2]"
2 92 ASN 0.028 0.017 13 0 "[ . 1 . 2]"
2 93 SER 0.000 0.000 . 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 1 GLY QA 1 2 SER H 3.500 . 3.800 2.375 2.132 2.698 . 0 0 "[ . 1 . 2]" 1
2 1 1 GLY QA 1 2 SER HA 4.500 . 5.000 4.037 3.954 4.110 . 0 0 "[ . 1 . 2]" 1
3 1 2 SER H 1 5 GLU H 4.500 . 5.000 3.824 3.425 4.349 . 0 0 "[ . 1 . 2]" 1
4 1 2 SER H 1 5 GLU HG2 4.500 . 5.000 3.171 2.429 3.529 . 0 0 "[ . 1 . 2]" 1
5 1 2 SER H 1 5 GLU HG3 4.500 . 5.000 4.454 3.371 4.714 . 0 0 "[ . 1 . 2]" 1
6 1 2 SER H 1 6 THR H 5.200 . 5.700 5.218 4.898 5.356 . 0 0 "[ . 1 . 2]" 1
7 1 2 SER HA 1 3 GLU H 3.500 . 3.800 2.449 2.293 2.646 . 0 0 "[ . 1 . 2]" 1
8 1 2 SER HA 1 3 GLU HA 5.200 . 5.700 4.403 4.175 4.474 . 0 0 "[ . 1 . 2]" 1
9 1 2 SER HA 1 5 GLU H 4.500 . 5.000 4.856 4.569 5.076 0.076 6 0 "[ . 1 . 2]" 1
10 1 2 SER QB 1 3 GLU H 3.500 . 3.800 2.799 2.099 3.542 . 0 0 "[ . 1 . 2]" 1
11 1 3 GLU H 1 3 GLU QG 4.500 . 5.000 3.882 3.603 4.092 . 0 0 "[ . 1 . 2]" 1
12 1 3 GLU H 1 4 LEU H 4.500 . 5.000 2.580 2.294 3.047 . 0 0 "[ . 1 . 2]" 1
13 1 3 GLU H 1 4 LEU QB 5.200 . 5.700 4.367 4.005 4.920 . 0 0 "[ . 1 . 2]" 1
14 1 3 GLU H 1 5 GLU H 5.200 . 5.700 4.394 4.247 4.677 . 0 0 "[ . 1 . 2]" 1
15 1 3 GLU H 1 6 THR H 5.200 . 5.700 5.254 4.921 5.443 . 0 0 "[ . 1 . 2]" 1
16 1 3 GLU H 2 10 THR MG 5.200 . 5.700 5.297 5.079 5.527 . 0 0 "[ . 1 . 2]" 1
17 1 3 GLU HA 1 3 GLU QG 3.500 . 3.800 2.363 2.210 2.556 . 0 0 "[ . 1 . 2]" 1
18 1 3 GLU HA 1 6 THR HB 3.500 . 3.800 3.594 2.900 3.715 . 0 0 "[ . 1 . 2]" 1
19 1 3 GLU HA 2 10 THR MG 4.500 . 5.000 3.846 3.437 3.948 . 0 0 "[ . 1 . 2]" 1
20 1 3 GLU QG 1 4 LEU H 4.500 . 5.000 4.489 4.305 4.671 . 0 0 "[ . 1 . 2]" 1
21 1 3 GLU QG 1 4 LEU HA 4.500 . 5.000 4.924 4.658 5.248 0.248 20 0 "[ . 1 . 2]" 1
22 1 3 GLU QG 1 4 LEU QB 4.500 . 5.000 5.539 5.326 5.753 0.753 20 11 "[* . -*1*** ** **+]" 1
23 1 3 GLU QG 1 6 THR HB 4.500 . 5.000 3.712 3.192 4.143 . 0 0 "[ . 1 . 2]" 1
24 1 3 GLU QG 2 10 THR MG 3.500 . 3.800 2.223 2.052 2.481 . 0 0 "[ . 1 . 2]" 1
25 1 3 GLU QG 2 13 ASN HD21 4.500 . 5.000 4.392 3.821 4.565 . 0 0 "[ . 1 . 2]" 1
26 1 3 GLU QG 2 13 ASN HD22 4.500 . 5.000 4.767 4.117 4.999 . 0 0 "[ . 1 . 2]" 1
27 1 4 LEU H 1 4 LEU QB 3.500 . 3.800 2.159 2.097 2.383 . 0 0 "[ . 1 . 2]" 1
28 1 4 LEU H 1 4 LEU QD 4.500 . 5.000 3.122 1.940 3.298 . 0 0 "[ . 1 . 2]" 1
29 1 4 LEU H 1 5 GLU H 4.500 . 5.000 2.771 2.665 2.869 . 0 0 "[ . 1 . 2]" 1
30 1 4 LEU H 1 6 THR H 4.500 . 5.000 4.226 4.086 4.318 . 0 0 "[ . 1 . 2]" 1
31 1 4 LEU H 2 14 VAL QG 4.500 . 5.000 3.357 3.182 3.447 . 0 0 "[ . 1 . 2]" 1
32 1 4 LEU HA 2 11 LEU MD1 3.500 . 3.800 2.443 2.305 2.583 . 0 0 "[ . 1 . 2]" 1
33 1 4 LEU HA 2 11 LEU MD2 3.500 . 3.800 3.887 3.593 3.941 0.141 7 0 "[ . 1 . 2]" 1
34 1 4 LEU QB 2 11 LEU MD1 3.500 . 3.800 2.169 2.078 2.273 . 0 0 "[ . 1 . 2]" 1
35 1 4 LEU QB 2 14 VAL H 5.200 . 5.700 4.196 4.013 4.260 . 0 0 "[ . 1 . 2]" 1
36 1 4 LEU QD 1 5 GLU H 5.200 . 5.700 3.283 2.400 3.487 . 0 0 "[ . 1 . 2]" 1
37 1 4 LEU QD 2 14 VAL H 4.500 . 5.000 4.663 4.565 4.716 . 0 0 "[ . 1 . 2]" 1
38 1 4 LEU QD 2 14 VAL QG 3.500 . 3.800 1.851 1.831 1.879 . 0 0 "[ . 1 . 2]" 1
39 1 4 LEU QD 2 15 PHE H 5.200 . 5.700 5.233 5.180 5.282 . 0 0 "[ . 1 . 2]" 1
40 1 4 LEU QD 2 41 LEU HB2 3.500 . 3.800 2.434 2.261 2.649 . 0 0 "[ . 1 . 2]" 1
41 1 4 LEU QD 2 41 LEU HB3 3.500 . 3.800 3.557 3.338 3.735 . 0 0 "[ . 1 . 2]" 1
42 1 4 LEU QD 2 41 LEU HG 3.500 . 3.800 4.257 3.034 4.572 0.772 5 11 "[*** + **-1* ** *]" 1
43 1 5 GLU H 1 5 GLU QB 3.500 . 3.800 2.474 2.262 2.713 . 0 0 "[ . 1 . 2]" 1
44 1 5 GLU H 1 5 GLU HG2 4.500 . 5.000 2.423 1.959 2.831 . 0 0 "[ . 1 . 2]" 1
45 1 5 GLU H 1 5 GLU HG3 4.500 . 5.000 3.673 3.183 4.030 . 0 0 "[ . 1 . 2]" 1
46 1 5 GLU H 1 6 THR H 4.500 . 5.000 2.455 2.406 2.536 . 0 0 "[ . 1 . 2]" 1
47 1 5 GLU H 1 7 ALA H 5.200 . 5.700 3.894 3.680 4.063 . 0 0 "[ . 1 . 2]" 1
48 1 5 GLU H 2 14 VAL QG 5.200 . 5.700 5.030 4.972 5.088 . 0 0 "[ . 1 . 2]" 1
49 1 5 GLU H 2 41 LEU QD 4.500 . 5.000 3.547 3.248 4.014 . 0 0 "[ . 1 . 2]" 1
50 1 5 GLU HA 1 7 ALA H 4.500 . 5.000 3.711 3.538 3.862 . 0 0 "[ . 1 . 2]" 1
51 1 5 GLU HA 1 8 MET H 4.500 . 5.000 3.914 3.617 4.200 . 0 0 "[ . 1 . 2]" 1
52 1 5 GLU HA 1 8 MET ME 4.500 . 5.000 3.327 2.925 3.707 . 0 0 "[ . 1 . 2]" 1
53 1 5 GLU QB 1 6 THR H 4.500 . 5.000 3.607 3.461 3.714 . 0 0 "[ . 1 . 2]" 1
54 1 5 GLU HG2 1 6 THR H 4.500 . 5.000 2.589 2.196 3.336 . 0 0 "[ . 1 . 2]" 1
55 1 5 GLU HG2 2 41 LEU QD 4.500 . 5.000 3.546 2.738 4.308 . 0 0 "[ . 1 . 2]" 1
56 1 5 GLU HG3 1 6 THR H 4.500 . 5.000 3.098 2.772 3.440 . 0 0 "[ . 1 . 2]" 1
57 1 5 GLU HG3 1 7 ALA H 4.500 . 5.000 4.981 4.793 5.359 0.359 6 0 "[ . 1 . 2]" 1
58 1 6 THR H 1 6 THR HB 3.500 . 3.800 2.864 2.603 3.033 . 0 0 "[ . 1 . 2]" 1
59 1 6 THR H 1 6 THR MG 4.500 . 5.000 3.662 3.558 3.800 . 0 0 "[ . 1 . 2]" 1
60 1 6 THR H 1 7 ALA H 4.500 . 5.000 2.421 2.196 2.537 . 0 0 "[ . 1 . 2]" 1
61 1 6 THR H 1 8 MET H 5.200 . 5.700 4.870 4.691 5.006 . 0 0 "[ . 1 . 2]" 1
62 1 6 THR H 1 9 GLU HG3 4.500 . 5.000 5.232 5.073 5.323 0.323 11 0 "[ . 1 . 2]" 1
63 1 6 THR HA 1 6 THR MG 3.500 . 3.800 2.224 2.178 2.323 . 0 0 "[ . 1 . 2]" 1
64 1 6 THR HA 1 7 ALA H 3.500 . 3.800 3.425 3.299 3.508 . 0 0 "[ . 1 . 2]" 1
65 1 6 THR HA 1 8 MET H 4.500 . 5.000 4.610 4.479 4.718 . 0 0 "[ . 1 . 2]" 1
66 1 6 THR HA 1 9 GLU H 4.500 . 5.000 3.571 3.396 3.687 . 0 0 "[ . 1 . 2]" 1
67 1 6 THR HA 1 9 GLU HG2 4.500 . 5.000 2.735 2.513 2.897 . 0 0 "[ . 1 . 2]" 1
68 1 6 THR HA 1 9 GLU HG3 3.500 . 3.800 2.404 2.285 2.493 . 0 0 "[ . 1 . 2]" 1
69 1 6 THR HB 1 9 GLU HG3 4.500 . 5.000 5.062 5.047 5.084 0.084 12 0 "[ . 1 . 2]" 1
70 1 6 THR MG 1 7 ALA H 4.500 . 5.000 4.160 3.995 4.251 . 0 0 "[ . 1 . 2]" 1
71 1 6 THR MG 1 9 GLU HB2 3.500 . 3.800 3.092 2.960 3.263 . 0 0 "[ . 1 . 2]" 1
72 1 6 THR MG 1 9 GLU HB3 4.500 . 5.000 4.187 4.066 4.351 . 0 0 "[ . 1 . 2]" 1
73 1 7 ALA H 1 8 MET H 3.500 . 3.800 3.030 2.940 3.110 . 0 0 "[ . 1 . 2]" 1
74 1 7 ALA H 1 8 MET ME 4.500 . 5.000 5.133 4.931 5.358 0.358 9 0 "[ . 1 . 2]" 1
75 1 7 ALA H 1 8 MET HG3 5.200 . 5.700 5.438 5.106 5.911 0.211 11 0 "[ . 1 . 2]" 1
76 1 7 ALA H 1 9 GLU H 4.500 . 5.000 4.185 4.093 4.275 . 0 0 "[ . 1 . 2]" 1
77 1 7 ALA H 1 9 GLU HG2 5.200 . 5.700 4.772 4.383 5.047 . 0 0 "[ . 1 . 2]" 1
78 1 7 ALA H 1 9 GLU HG3 5.200 . 5.700 5.450 5.334 5.543 . 0 0 "[ . 1 . 2]" 1
79 1 7 ALA H 2 10 THR HB 4.500 . 5.000 4.559 4.389 4.711 . 0 0 "[ . 1 . 2]" 1
80 1 7 ALA H 2 10 THR MG 4.500 . 5.000 3.831 3.663 4.074 . 0 0 "[ . 1 . 2]" 1
81 1 7 ALA H 2 11 LEU MD2 4.500 . 5.000 4.654 4.390 4.919 . 0 0 "[ . 1 . 2]" 1
82 1 7 ALA HA 1 10 THR H 4.500 . 5.000 3.745 3.652 3.793 . 0 0 "[ . 1 . 2]" 1
83 1 7 ALA HA 1 10 THR MG 4.500 . 5.000 2.956 2.766 3.048 . 0 0 "[ . 1 . 2]" 1
84 1 7 ALA HA 1 11 LEU H 4.500 . 5.000 4.977 4.909 4.997 . 0 0 "[ . 1 . 2]" 1
85 1 7 ALA MB 1 8 MET H 3.500 . 3.800 2.266 2.200 2.354 . 0 0 "[ . 1 . 2]" 1
86 1 7 ALA MB 1 8 MET ME 4.500 . 5.000 3.887 3.660 4.055 . 0 0 "[ . 1 . 2]" 1
87 1 7 ALA MB 2 10 THR H 4.500 . 5.000 3.949 3.820 3.979 . 0 0 "[ . 1 . 2]" 1
88 1 7 ALA MB 2 10 THR HB 3.500 . 3.800 3.582 3.441 4.002 0.202 16 0 "[ . 1 . 2]" 1
89 1 7 ALA MB 2 10 THR MG 3.500 . 3.800 3.116 3.058 3.146 . 0 0 "[ . 1 . 2]" 1
90 1 7 ALA MB 2 11 LEU H 3.500 . 3.800 3.522 3.492 3.553 . 0 0 "[ . 1 . 2]" 1
91 1 7 ALA MB 2 11 LEU MD2 3.500 . 3.800 2.086 2.039 2.135 . 0 0 "[ . 1 . 2]" 1
92 1 7 ALA MB 2 78 VAL MG2 4.500 . 5.000 3.649 3.567 3.774 . 0 0 "[ . 1 . 2]" 1
93 1 8 MET H 1 8 MET ME 3.500 . 3.800 3.297 3.141 3.502 . 0 0 "[ . 1 . 2]" 1
94 1 8 MET H 1 8 MET HG2 3.500 . 3.800 1.944 1.695 2.373 0.105 4 0 "[ . 1 . 2]" 1
95 1 8 MET H 1 8 MET HG3 3.500 . 3.800 3.169 2.975 3.500 . 0 0 "[ . 1 . 2]" 1
96 1 8 MET H 1 9 GLU H 3.500 . 3.800 2.789 2.740 2.850 . 0 0 "[ . 1 . 2]" 1
97 1 8 MET H 1 10 THR H 4.500 . 5.000 4.435 4.345 4.492 . 0 0 "[ . 1 . 2]" 1
98 1 8 MET H 1 11 LEU MD2 4.500 . 5.000 3.969 3.898 4.045 . 0 0 "[ . 1 . 2]" 1
99 1 8 MET H 2 11 LEU MD1 4.500 . 5.000 4.520 4.398 4.764 . 0 0 "[ . 1 . 2]" 1
100 1 8 MET H 2 11 LEU MD2 5.200 . 5.700 4.446 4.360 4.506 . 0 0 "[ . 1 . 2]" 1
101 1 8 MET H 2 78 VAL MG2 4.500 . 5.000 4.416 4.387 4.445 . 0 0 "[ . 1 . 2]" 1
102 1 8 MET HA 1 11 LEU H 4.500 . 5.000 3.318 3.191 3.470 . 0 0 "[ . 1 . 2]" 1
103 1 8 MET HA 1 12 ILE H 4.500 . 5.000 4.175 4.094 4.281 . 0 0 "[ . 1 . 2]" 1
104 1 8 MET HB2 1 9 GLU HG2 4.500 . 5.000 4.736 4.448 4.962 . 0 0 "[ . 1 . 2]" 1
105 1 8 MET ME 1 71 PHE QD 5.200 . 5.700 5.408 5.376 5.441 . 0 0 "[ . 1 . 2]" 1
106 1 8 MET ME 1 71 PHE QE 3.500 . 3.800 3.705 3.607 3.797 . 0 0 "[ . 1 . 2]" 1
107 1 8 MET ME 1 75 VAL QG 4.500 . 5.000 4.106 3.886 4.265 . 0 0 "[ . 1 . 2]" 1
108 1 8 MET ME 2 78 VAL HA 4.500 . 5.000 3.566 3.476 3.642 . 0 0 "[ . 1 . 2]" 1
109 1 8 MET ME 2 78 VAL MG2 2.700 . 3.000 2.217 2.143 2.292 . 0 0 "[ . 1 . 2]" 1
110 1 8 MET ME 2 79 ALA H 4.500 . 5.000 3.897 3.801 3.968 . 0 0 "[ . 1 . 2]" 1
111 1 8 MET ME 2 79 ALA HA 3.500 . 3.800 2.673 2.546 2.777 . 0 0 "[ . 1 . 2]" 1
112 1 8 MET ME 2 79 ALA MB 3.500 . 3.800 3.604 3.503 3.676 . 0 0 "[ . 1 . 2]" 1
113 1 8 MET ME 2 82 THR H 4.500 . 5.000 3.342 3.220 3.449 . 0 0 "[ . 1 . 2]" 1
114 1 8 MET ME 2 82 THR MG 3.500 . 3.800 3.478 3.423 3.515 . 0 0 "[ . 1 . 2]" 1
115 1 8 MET HG2 1 9 GLU H 3.500 . 3.800 2.918 2.210 3.239 . 0 0 "[ . 1 . 2]" 1
116 1 8 MET HG2 2 78 VAL MG2 4.500 . 5.000 4.713 4.391 5.508 0.508 11 1 "[ . 1+ . 2]" 1
117 1 8 MET HG3 1 9 GLU H 4.500 . 5.000 3.019 2.666 3.837 . 0 0 "[ . 1 . 2]" 1
118 1 8 MET HG3 1 9 GLU HA 4.500 . 5.000 4.141 3.623 5.057 0.057 9 0 "[ . 1 . 2]" 1
119 1 9 GLU H 1 9 GLU HG2 4.500 . 5.000 1.948 1.734 2.089 0.066 9 0 "[ . 1 . 2]" 1
120 1 9 GLU H 1 9 GLU HG3 3.500 . 3.800 3.336 3.298 3.377 . 0 0 "[ . 1 . 2]" 1
121 1 9 GLU H 1 10 THR H 3.500 . 3.800 2.660 2.586 2.786 . 0 0 "[ . 1 . 2]" 1
122 1 9 GLU H 1 11 LEU H 4.500 . 5.000 4.315 4.270 4.395 . 0 0 "[ . 1 . 2]" 1
123 1 9 GLU H 1 11 LEU MD2 4.500 . 5.000 4.490 4.460 4.516 . 0 0 "[ . 1 . 2]" 1
124 1 9 GLU H 1 12 ILE MD 4.500 . 5.000 3.864 3.714 3.982 . 0 0 "[ . 1 . 2]" 1
125 1 9 GLU HA 1 12 ILE HB 4.500 . 5.000 2.535 2.367 2.670 . 0 0 "[ . 1 . 2]" 1
126 1 9 GLU HA 1 12 ILE MD 3.500 . 3.800 2.013 1.952 2.070 . 0 0 "[ . 1 . 2]" 1
127 1 9 GLU HA 1 12 ILE MG 4.500 . 5.000 3.854 3.620 4.006 . 0 0 "[ . 1 . 2]" 1
128 1 9 GLU HB2 1 10 THR H 4.500 . 5.000 2.767 2.692 2.846 . 0 0 "[ . 1 . 2]" 1
129 1 9 GLU HB3 1 10 THR H 4.500 . 5.000 3.911 3.858 4.000 . 0 0 "[ . 1 . 2]" 1
130 1 9 GLU HB3 1 10 THR MG 5.200 . 5.700 4.367 4.240 4.496 . 0 0 "[ . 1 . 2]" 1
131 1 9 GLU HB3 1 12 ILE MD 4.500 . 5.000 4.024 3.879 4.104 . 0 0 "[ . 1 . 2]" 1
132 1 9 GLU HG2 1 10 THR MG 5.200 . 5.700 4.943 4.757 5.159 . 0 0 "[ . 1 . 2]" 1
133 1 9 GLU HG2 1 12 ILE MD 4.500 . 5.000 3.971 3.843 4.144 . 0 0 "[ . 1 . 2]" 1
134 1 10 THR H 1 10 THR MG 3.500 . 3.800 2.098 2.065 2.177 . 0 0 "[ . 1 . 2]" 1
135 1 10 THR H 1 11 LEU H 4.500 . 5.000 2.582 2.544 2.610 . 0 0 "[ . 1 . 2]" 1
136 1 10 THR H 1 11 LEU MD2 4.500 . 5.000 3.632 3.609 3.668 . 0 0 "[ . 1 . 2]" 1
137 1 10 THR H 1 12 ILE HB 5.200 . 5.700 4.871 4.673 5.000 . 0 0 "[ . 1 . 2]" 1
138 1 10 THR H 1 12 ILE MD 4.500 . 5.000 4.879 4.859 4.891 . 0 0 "[ . 1 . 2]" 1
139 1 10 THR H 2 7 ALA MB 4.500 . 5.000 3.953 3.922 3.974 . 0 0 "[ . 1 . 2]" 1
140 1 10 THR HA 1 10 THR MG 3.500 . 3.800 2.436 2.399 2.455 . 0 0 "[ . 1 . 2]" 1
141 1 10 THR HA 1 13 ASN HB2 4.500 . 5.000 3.843 3.725 3.954 . 0 0 "[ . 1 . 2]" 1
142 1 10 THR HA 1 13 ASN HB3 4.500 . 5.000 2.367 2.272 2.445 . 0 0 "[ . 1 . 2]" 1
143 1 10 THR HA 1 13 ASN HD21 4.500 . 5.000 2.737 2.654 2.827 . 0 0 "[ . 1 . 2]" 1
144 1 10 THR HA 1 13 ASN HD22 4.500 . 5.000 4.394 4.315 4.466 . 0 0 "[ . 1 . 2]" 1
145 1 10 THR HB 1 11 LEU H 3.500 . 3.800 3.772 3.723 3.832 0.032 6 0 "[ . 1 . 2]" 1
146 1 10 THR HB 1 11 LEU MD1 4.500 . 5.000 4.126 3.990 4.329 . 0 0 "[ . 1 . 2]" 1
147 1 10 THR HB 1 12 ILE H 5.200 . 5.700 5.511 5.503 5.520 . 0 0 "[ . 1 . 2]" 1
148 1 10 THR HB 1 13 ASN H 5.200 . 5.700 5.032 4.956 5.092 . 0 0 "[ . 1 . 2]" 1
149 1 10 THR HB 1 14 VAL QG 4.500 . 5.000 4.226 4.109 4.304 . 0 0 "[ . 1 . 2]" 1
150 1 10 THR HB 2 7 ALA H 4.500 . 5.000 4.570 4.384 4.721 . 0 0 "[ . 1 . 2]" 1
151 1 10 THR HB 2 7 ALA MB 3.500 . 3.800 3.572 3.415 3.701 . 0 0 "[ . 1 . 2]" 1
152 1 10 THR MG 1 11 LEU H 4.500 . 5.000 3.736 3.708 3.759 . 0 0 "[ . 1 . 2]" 1
153 1 10 THR MG 1 11 LEU MD2 4.500 . 5.000 4.059 4.020 4.108 . 0 0 "[ . 1 . 2]" 1
154 1 10 THR MG 1 13 ASN HD22 4.500 . 5.000 5.299 5.232 5.380 0.380 4 0 "[ . 1 . 2]" 1
155 1 10 THR MG 2 3 GLU H 5.200 . 5.700 5.503 5.434 5.542 . 0 0 "[ . 1 . 2]" 1
156 1 10 THR MG 2 3 GLU HA 4.500 . 5.000 3.789 3.573 3.972 . 0 0 "[ . 1 . 2]" 1
157 1 10 THR MG 2 3 GLU QG 3.500 . 3.800 2.136 2.037 2.183 . 0 0 "[ . 1 . 2]" 1
158 1 10 THR MG 2 7 ALA H 4.500 . 5.000 3.879 3.681 4.112 . 0 0 "[ . 1 . 2]" 1
159 1 10 THR MG 2 7 ALA MB 3.500 . 3.800 3.129 3.094 3.184 . 0 0 "[ . 1 . 2]" 1
160 1 11 LEU H 1 11 LEU QB 3.500 . 3.800 2.364 2.339 2.390 . 0 0 "[ . 1 . 2]" 1
161 1 11 LEU H 1 11 LEU MD1 4.500 . 5.000 2.994 2.879 3.147 . 0 0 "[ . 1 . 2]" 1
162 1 11 LEU H 1 11 LEU MD2 3.500 . 3.800 2.100 2.067 2.153 . 0 0 "[ . 1 . 2]" 1
163 1 11 LEU H 1 11 LEU HG 4.500 . 5.000 4.065 4.048 4.076 . 0 0 "[ . 1 . 2]" 1
164 1 11 LEU H 1 12 ILE H 4.500 . 5.000 2.590 2.561 2.627 . 0 0 "[ . 1 . 2]" 1
165 1 11 LEU H 1 12 ILE MD 5.200 . 5.700 5.035 5.005 5.072 . 0 0 "[ . 1 . 2]" 1
166 1 11 LEU H 1 12 ILE HG13 4.500 . 5.000 4.601 4.502 4.687 . 0 0 "[ . 1 . 2]" 1
167 1 11 LEU H 1 13 ASN H 5.200 . 5.700 4.077 4.043 4.117 . 0 0 "[ . 1 . 2]" 1
168 1 11 LEU H 1 71 PHE QE 4.500 . 5.000 4.142 4.052 4.197 . 0 0 "[ . 1 . 2]" 1
169 1 11 LEU H 1 74 TYR QE 5.200 . 5.700 5.182 5.098 5.291 . 0 0 "[ . 1 . 2]" 1
170 1 11 LEU H 2 7 ALA MB 3.500 . 3.800 3.522 3.507 3.534 . 0 0 "[ . 1 . 2]" 1
171 1 11 LEU QB 1 12 ILE H 4.500 . 5.000 2.629 2.575 2.673 . 0 0 "[ . 1 . 2]" 1
172 1 11 LEU QB 1 78 VAL MG2 5.200 . 5.700 4.445 4.301 4.570 . 0 0 "[ . 1 . 2]" 1
173 1 11 LEU MD1 1 74 TYR QD 4.500 . 5.000 3.841 3.680 3.972 . 0 0 "[ . 1 . 2]" 1
174 1 11 LEU MD1 1 74 TYR QE 4.500 . 5.000 2.503 2.314 2.675 . 0 0 "[ . 1 . 2]" 1
175 1 11 LEU MD1 1 78 VAL MG1 2.700 . 3.000 2.430 2.309 2.627 . 0 0 "[ . 1 . 2]" 1
176 1 11 LEU MD1 2 4 LEU HA 3.500 . 3.800 2.480 2.314 2.613 . 0 0 "[ . 1 . 2]" 1
177 1 11 LEU MD1 2 4 LEU QB 3.500 . 3.800 2.147 2.089 2.223 . 0 0 "[ . 1 . 2]" 1
178 1 11 LEU MD1 2 8 MET H 4.500 . 5.000 4.539 4.409 4.659 . 0 0 "[ . 1 . 2]" 1
179 1 11 LEU MD2 1 12 ILE H 4.500 . 5.000 3.954 3.902 3.991 . 0 0 "[ . 1 . 2]" 1
180 1 11 LEU MD2 1 71 PHE QD 5.200 . 5.700 5.301 5.207 5.382 . 0 0 "[ . 1 . 2]" 1
181 1 11 LEU MD2 1 71 PHE QE 4.500 . 5.000 3.680 3.565 3.785 . 0 0 "[ . 1 . 2]" 1
182 1 11 LEU MD2 1 75 VAL QG 4.500 . 5.000 2.455 2.285 2.753 . 0 0 "[ . 1 . 2]" 1
183 1 11 LEU MD2 2 4 LEU HA 3.500 . 3.800 3.864 3.616 3.944 0.144 9 0 "[ . 1 . 2]" 1
184 1 11 LEU MD2 2 7 ALA H 4.500 . 5.000 4.607 4.492 4.737 . 0 0 "[ . 1 . 2]" 1
185 1 11 LEU MD2 2 7 ALA MB 3.500 . 3.800 2.079 2.022 2.125 . 0 0 "[ . 1 . 2]" 1
186 1 11 LEU MD2 2 8 MET H 5.200 . 5.700 4.431 4.376 4.514 . 0 0 "[ . 1 . 2]" 1
187 1 11 LEU HG 1 71 PHE QE 5.200 . 5.700 4.093 3.990 4.279 . 0 0 "[ . 1 . 2]" 1
188 1 11 LEU HG 1 75 VAL H 5.200 . 5.700 4.864 4.804 4.887 . 0 0 "[ . 1 . 2]" 1
189 1 11 LEU HG 1 75 VAL HA 4.500 . 5.000 3.062 2.918 3.203 . 0 0 "[ . 1 . 2]" 1
190 1 11 LEU HG 1 78 VAL MG2 3.500 . 3.800 3.127 2.953 3.324 . 0 0 "[ . 1 . 2]" 1
191 1 12 ILE H 1 12 ILE HB 3.500 . 3.800 2.418 2.240 2.491 . 0 0 "[ . 1 . 2]" 1
192 1 12 ILE H 1 12 ILE MD 3.500 . 3.800 3.425 3.382 3.453 . 0 0 "[ . 1 . 2]" 1
193 1 12 ILE H 1 12 ILE HG13 3.500 . 3.800 2.428 2.369 2.518 . 0 0 "[ . 1 . 2]" 1
194 1 12 ILE H 1 12 ILE MG 4.500 . 5.000 3.804 3.718 3.839 . 0 0 "[ . 1 . 2]" 1
195 1 12 ILE H 1 13 ASN H 3.500 . 3.800 2.651 2.609 2.693 . 0 0 "[ . 1 . 2]" 1
196 1 12 ILE H 1 13 ASN HA 5.200 . 5.700 5.252 5.214 5.285 . 0 0 "[ . 1 . 2]" 1
197 1 12 ILE H 1 13 ASN HB3 4.500 . 5.000 4.410 4.351 4.470 . 0 0 "[ . 1 . 2]" 1
198 1 12 ILE H 1 14 VAL QG 4.500 . 5.000 4.410 4.368 4.431 . 0 0 "[ . 1 . 2]" 1
199 1 12 ILE H 1 15 PHE HB3 4.500 . 5.000 4.621 4.572 4.671 . 0 0 "[ . 1 . 2]" 1
200 1 12 ILE H 1 71 PHE QD 4.500 . 5.000 4.785 4.707 4.820 . 0 0 "[ . 1 . 2]" 1
201 1 12 ILE H 1 71 PHE QE 4.500 . 5.000 2.727 2.690 2.768 . 0 0 "[ . 1 . 2]" 1
202 1 12 ILE HA 1 12 ILE MD 4.500 . 5.000 3.894 3.833 3.921 . 0 0 "[ . 1 . 2]" 1
203 1 12 ILE HA 1 14 VAL H 4.500 . 5.000 4.504 4.471 4.519 . 0 0 "[ . 1 . 2]" 1
204 1 12 ILE HA 1 15 PHE H 3.500 . 3.800 3.317 3.287 3.388 . 0 0 "[ . 1 . 2]" 1
205 1 12 ILE HA 1 15 PHE HB2 4.500 . 5.000 3.385 3.243 3.650 . 0 0 "[ . 1 . 2]" 1
206 1 12 ILE HA 1 16 HIS H 4.500 . 5.000 3.037 2.991 3.074 . 0 0 "[ . 1 . 2]" 1
207 1 12 ILE HA 1 17 ALA H 5.200 . 5.700 5.410 5.400 5.420 . 0 0 "[ . 1 . 2]" 1
208 1 12 ILE HA 1 71 PHE QE 4.500 . 5.000 2.843 2.678 2.957 . 0 0 "[ . 1 . 2]" 1
209 1 12 ILE HB 1 12 ILE MD 3.500 . 3.800 2.371 2.341 2.404 . 0 0 "[ . 1 . 2]" 1
210 1 12 ILE HB 1 13 ASN H 3.500 . 3.800 2.730 2.675 2.760 . 0 0 "[ . 1 . 2]" 1
211 1 12 ILE HB 1 15 PHE H 5.200 . 5.700 5.509 5.502 5.515 . 0 0 "[ . 1 . 2]" 1
212 1 12 ILE MD 1 12 ILE MG 3.500 . 3.800 2.120 2.086 2.153 . 0 0 "[ . 1 . 2]" 1
213 1 12 ILE MD 1 16 HIS HB2 5.200 . 5.700 5.378 5.169 5.526 . 0 0 "[ . 1 . 2]" 1
214 1 12 ILE MD 2 82 THR MG 3.500 . 3.800 2.303 2.182 2.492 . 0 0 "[ . 1 . 2]" 1
215 1 12 ILE HG12 1 71 PHE QE 5.200 . 5.700 3.237 3.138 3.306 . 0 0 "[ . 1 . 2]" 1
216 1 12 ILE HG13 1 13 ASN H 4.500 . 5.000 4.479 4.414 4.550 . 0 0 "[ . 1 . 2]" 1
217 1 12 ILE MG 1 13 ASN H 3.500 . 3.800 3.329 3.023 3.452 . 0 0 "[ . 1 . 2]" 1
218 1 12 ILE MG 1 14 VAL H 4.500 . 5.000 5.024 4.862 5.098 0.098 17 0 "[ . 1 . 2]" 1
219 1 12 ILE MG 1 14 VAL QG 5.200 . 5.700 5.188 5.128 5.224 . 0 0 "[ . 1 . 2]" 1
220 1 12 ILE MG 1 15 PHE H 4.500 . 5.000 4.644 4.602 4.702 . 0 0 "[ . 1 . 2]" 1
221 1 12 ILE MG 1 16 HIS H 4.500 . 5.000 3.419 3.333 3.615 . 0 0 "[ . 1 . 2]" 1
222 1 12 ILE MG 1 16 HIS HB2 4.500 . 5.000 2.426 2.253 2.622 . 0 0 "[ . 1 . 2]" 1
223 1 12 ILE MG 1 17 ALA H 5.200 . 5.700 4.995 4.945 5.053 . 0 0 "[ . 1 . 2]" 1
224 1 12 ILE MG 2 82 THR MG 5.200 . 5.700 4.706 4.530 4.949 . 0 0 "[ . 1 . 2]" 1
225 1 13 ASN H 1 13 ASN HB3 3.500 . 3.800 2.034 2.023 2.050 . 0 0 "[ . 1 . 2]" 1
226 1 13 ASN H 1 13 ASN HD21 4.500 . 5.000 3.549 3.494 3.562 . 0 0 "[ . 1 . 2]" 1
227 1 13 ASN H 1 13 ASN HD22 4.500 . 5.000 4.990 4.947 4.997 . 0 0 "[ . 1 . 2]" 1
228 1 13 ASN H 1 14 VAL H 3.500 . 3.800 2.926 2.893 2.950 . 0 0 "[ . 1 . 2]" 1
229 1 13 ASN H 1 14 VAL QG 4.500 . 5.000 3.828 3.788 3.857 . 0 0 "[ . 1 . 2]" 1
230 1 13 ASN H 1 15 PHE H 4.500 . 5.000 4.060 4.022 4.093 . 0 0 "[ . 1 . 2]" 1
231 1 13 ASN HA 1 13 ASN HD21 4.500 . 5.000 4.477 4.463 4.487 . 0 0 "[ . 1 . 2]" 1
232 1 13 ASN HA 1 14 VAL QG 5.200 . 5.700 4.437 4.426 4.456 . 0 0 "[ . 1 . 2]" 1
233 1 13 ASN HA 1 15 PHE H 4.500 . 5.000 4.605 4.553 4.636 . 0 0 "[ . 1 . 2]" 1
234 1 13 ASN HA 1 16 HIS H 4.500 . 5.000 4.484 4.418 4.611 . 0 0 "[ . 1 . 2]" 1
235 1 13 ASN HA 1 16 HIS HB2 4.500 . 5.000 4.541 4.092 4.968 . 0 0 "[ . 1 . 2]" 1
236 1 13 ASN HA 1 17 ALA H 4.500 . 5.000 4.544 4.461 4.625 . 0 0 "[ . 1 . 2]" 1
237 1 13 ASN HA 1 17 ALA MB 5.200 . 5.700 4.278 4.212 4.356 . 0 0 "[ . 1 . 2]" 1
238 1 13 ASN HB2 1 14 VAL H 4.500 . 5.000 4.134 4.127 4.139 . 0 0 "[ . 1 . 2]" 1
239 1 13 ASN HB3 1 13 ASN HD22 3.500 . 3.800 3.435 3.427 3.445 . 0 0 "[ . 1 . 2]" 1
240 1 13 ASN HB3 1 14 VAL H 3.500 . 3.800 3.171 3.135 3.207 . 0 0 "[ . 1 . 2]" 1
241 1 13 ASN HB3 1 14 VAL QG 4.500 . 5.000 3.723 3.687 3.765 . 0 0 "[ . 1 . 2]" 1
242 1 13 ASN HD21 1 14 VAL H 5.200 . 5.700 2.992 2.920 3.036 . 0 0 "[ . 1 . 2]" 1
243 1 13 ASN HD21 1 14 VAL QG 4.500 . 5.000 2.533 2.502 2.600 . 0 0 "[ . 1 . 2]" 1
244 1 13 ASN HD21 2 3 GLU QG 4.500 . 5.000 4.204 3.563 4.439 . 0 0 "[ . 1 . 2]" 1
245 1 13 ASN HD22 1 14 VAL H 4.500 . 5.000 3.647 3.608 3.693 . 0 0 "[ . 1 . 2]" 1
246 1 13 ASN HD22 1 14 VAL HB 4.500 . 5.000 5.023 4.978 5.067 0.067 18 0 "[ . 1 . 2]" 1
247 1 13 ASN HD22 2 3 GLU QG 4.500 . 5.000 4.595 3.958 4.813 . 0 0 "[ . 1 . 2]" 1
248 1 14 VAL H 1 14 VAL HB 3.500 . 3.800 3.671 3.653 3.686 . 0 0 "[ . 1 . 2]" 1
249 1 14 VAL H 1 14 VAL QG 3.500 . 3.800 1.857 1.833 1.874 . 0 0 "[ . 1 . 2]" 1
250 1 14 VAL H 1 15 PHE H 3.500 . 3.800 2.431 2.404 2.441 . 0 0 "[ . 1 . 2]" 1
251 1 14 VAL H 1 15 PHE HA 5.200 . 5.700 5.095 5.091 5.099 . 0 0 "[ . 1 . 2]" 1
252 1 14 VAL H 1 15 PHE HB2 4.500 . 5.000 4.750 4.704 4.812 . 0 0 "[ . 1 . 2]" 1
253 1 14 VAL H 1 15 PHE HB3 5.200 . 5.700 4.585 4.521 4.634 . 0 0 "[ . 1 . 2]" 1
254 1 14 VAL H 1 16 HIS H 4.500 . 5.000 4.454 4.392 4.501 . 0 0 "[ . 1 . 2]" 1
255 1 14 VAL H 1 17 ALA H 4.500 . 5.000 4.700 4.630 4.770 . 0 0 "[ . 1 . 2]" 1
256 1 14 VAL H 2 4 LEU QB 5.200 . 5.700 4.193 4.130 4.253 . 0 0 "[ . 1 . 2]" 1
257 1 14 VAL H 2 4 LEU QD 4.500 . 5.000 4.655 4.475 4.719 . 0 0 "[ . 1 . 2]" 1
258 1 14 VAL HA 1 17 ALA MB 3.500 . 3.800 2.412 2.305 2.568 . 0 0 "[ . 1 . 2]" 1
259 1 14 VAL HB 1 15 PHE H 4.500 . 5.000 3.925 3.900 3.951 . 0 0 "[ . 1 . 2]" 1
260 1 14 VAL QG 1 15 PHE H 3.500 . 3.800 2.267 2.237 2.296 . 0 0 "[ . 1 . 2]" 1
261 1 14 VAL QG 1 15 PHE HA 4.500 . 5.000 3.181 3.106 3.260 . 0 0 "[ . 1 . 2]" 1
262 1 14 VAL QG 1 15 PHE HB3 4.500 . 5.000 3.933 3.824 4.004 . 0 0 "[ . 1 . 2]" 1
263 1 14 VAL QG 1 16 HIS H 4.500 . 5.000 4.373 4.302 4.413 . 0 0 "[ . 1 . 2]" 1
264 1 14 VAL QG 1 17 ALA H 5.200 . 5.700 4.461 4.427 4.513 . 0 0 "[ . 1 . 2]" 1
265 1 14 VAL QG 1 18 HIS H 4.500 . 5.000 5.090 5.024 5.142 0.142 9 0 "[ . 1 . 2]" 1
266 1 14 VAL QG 1 18 HIS HD2 3.500 . 3.800 4.493 4.215 4.615 0.815 9 19 "[ *******+********-**]" 1
267 1 14 VAL QG 1 36 LEU MD2 3.500 . 3.800 3.599 3.507 3.686 . 0 0 "[ . 1 . 2]" 1
268 1 14 VAL QG 1 40 GLU HG2 5.200 . 5.700 3.960 3.937 3.987 . 0 0 "[ . 1 . 2]" 1
269 1 14 VAL QG 1 40 GLU HG3 4.500 . 5.000 2.777 2.651 2.981 . 0 0 "[ . 1 . 2]" 1
270 1 14 VAL QG 2 4 LEU H 4.500 . 5.000 3.368 3.279 3.495 . 0 0 "[ . 1 . 2]" 1
271 1 14 VAL QG 2 4 LEU QD 3.500 . 3.800 1.841 1.746 1.886 0.054 6 0 "[ . 1 . 2]" 1
272 1 14 VAL QG 2 5 GLU H 5.200 . 5.700 5.029 4.952 5.117 . 0 0 "[ . 1 . 2]" 1
273 1 15 PHE H 1 15 PHE HB2 3.500 . 3.800 2.556 2.506 2.617 . 0 0 "[ . 1 . 2]" 1
274 1 15 PHE H 1 15 PHE HB3 3.500 . 3.800 2.414 2.379 2.450 . 0 0 "[ . 1 . 2]" 1
275 1 15 PHE H 1 16 HIS H 3.500 . 3.800 2.683 2.626 2.732 . 0 0 "[ . 1 . 2]" 1
276 1 15 PHE H 1 16 HIS HB2 5.200 . 5.700 4.686 4.581 4.833 . 0 0 "[ . 1 . 2]" 1
277 1 15 PHE H 1 17 ALA H 4.500 . 5.000 3.660 3.635 3.690 . 0 0 "[ . 1 . 2]" 1
278 1 15 PHE H 1 17 ALA MB 4.500 . 5.000 4.401 4.359 4.430 . 0 0 "[ . 1 . 2]" 1
279 1 15 PHE H 1 36 LEU MD2 5.200 . 5.700 4.739 4.591 4.936 . 0 0 "[ . 1 . 2]" 1
280 1 15 PHE H 1 74 TYR QD 5.200 . 5.700 4.714 4.603 4.847 . 0 0 "[ . 1 . 2]" 1
281 1 15 PHE H 2 4 LEU QD 5.200 . 5.700 5.237 5.178 5.291 . 0 0 "[ . 1 . 2]" 1
282 1 15 PHE HA 1 36 LEU MD2 4.500 . 5.000 2.902 2.732 3.126 . 0 0 "[ . 1 . 2]" 1
283 1 15 PHE HA 1 74 TYR QD 4.500 . 5.000 4.451 4.350 4.586 . 0 0 "[ . 1 . 2]" 1
284 1 15 PHE HB2 1 16 HIS H 4.500 . 5.000 3.544 3.501 3.584 . 0 0 "[ . 1 . 2]" 1
285 1 15 PHE HB2 1 74 TYR QD 4.500 . 5.000 2.640 2.474 2.774 . 0 0 "[ . 1 . 2]" 1
286 1 15 PHE HB2 1 74 TYR QE 4.500 . 5.000 3.030 2.821 3.422 . 0 0 "[ . 1 . 2]" 1
287 1 15 PHE HB3 1 16 HIS H 3.500 . 3.800 2.076 2.020 2.124 . 0 0 "[ . 1 . 2]" 1
288 1 15 PHE QD 1 16 HIS H 5.200 . 5.700 3.134 2.982 3.262 . 0 0 "[ . 1 . 2]" 1
289 1 15 PHE QE 1 28 LEU MD1 5.200 . 5.700 3.759 2.603 4.867 . 0 0 "[ . 1 . 2]" 1
290 1 15 PHE HZ 1 27 LYS H 4.500 . 5.000 4.357 4.060 4.886 . 0 0 "[ . 1 . 2]" 1
291 1 15 PHE HZ 1 27 LYS HA 4.500 . 5.000 2.914 2.533 3.260 . 0 0 "[ . 1 . 2]" 1
292 1 15 PHE HZ 1 28 LEU H 4.500 . 5.000 3.859 3.580 4.053 . 0 0 "[ . 1 . 2]" 1
293 1 15 PHE HZ 1 28 LEU HB2 4.500 . 5.000 3.570 3.251 3.821 . 0 0 "[ . 1 . 2]" 1
294 1 15 PHE HZ 1 28 LEU MD1 5.200 . 5.700 4.941 4.023 5.783 0.083 10 0 "[ . 1 . 2]" 1
295 1 15 PHE HZ 1 28 LEU MD2 5.200 . 5.700 5.082 4.213 5.804 0.104 15 0 "[ . 1 . 2]" 1
296 1 15 PHE HZ 1 70 ASP HA 4.500 . 5.000 2.515 2.291 2.672 . 0 0 "[ . 1 . 2]" 1
297 1 15 PHE HZ 1 71 PHE H 4.500 . 5.000 2.931 2.816 3.106 . 0 0 "[ . 1 . 2]" 1
298 1 15 PHE HZ 1 72 GLN H 5.200 . 5.700 5.508 5.502 5.513 . 0 0 "[ . 1 . 2]" 1
299 1 16 HIS H 1 16 HIS HB2 3.500 . 3.800 2.218 2.146 2.275 . 0 0 "[ . 1 . 2]" 1
300 1 16 HIS H 1 16 HIS HD2 5.200 . 5.700 4.249 3.298 4.826 . 0 0 "[ . 1 . 2]" 1
301 1 16 HIS H 1 17 ALA H 3.500 . 3.800 2.590 2.552 2.638 . 0 0 "[ . 1 . 2]" 1
302 1 16 HIS H 1 17 ALA MB 4.500 . 5.000 4.305 4.287 4.325 . 0 0 "[ . 1 . 2]" 1
303 1 16 HIS H 1 18 HIS H 4.500 . 5.000 4.313 4.112 4.440 . 0 0 "[ . 1 . 2]" 1
304 1 16 HIS H 1 36 LEU MD2 5.200 . 5.700 5.533 5.379 5.731 0.031 11 0 "[ . 1 . 2]" 1
305 1 16 HIS HB2 1 17 ALA H 4.500 . 5.000 3.691 3.297 3.982 . 0 0 "[ . 1 . 2]" 1
306 1 16 HIS HB3 1 17 ALA H 3.500 . 3.800 3.558 3.243 3.882 0.082 8 0 "[ . 1 . 2]" 1
307 1 17 ALA H 1 17 ALA MB 2.700 . 3.000 2.228 2.198 2.248 . 0 0 "[ . 1 . 2]" 1
308 1 17 ALA H 1 18 HIS H 3.500 . 3.800 2.531 2.448 2.631 . 0 0 "[ . 1 . 2]" 1
309 1 17 ALA H 1 36 LEU MD2 5.200 . 5.700 4.895 4.823 5.003 . 0 0 "[ . 1 . 2]" 1
310 1 17 ALA MB 1 18 HIS H 3.500 . 3.800 2.643 2.563 2.747 . 0 0 "[ . 1 . 2]" 1
311 1 17 ALA MB 1 18 HIS HA 5.200 . 5.700 3.986 3.930 4.044 . 0 0 "[ . 1 . 2]" 1
312 1 17 ALA MB 1 18 HIS HD2 3.500 . 3.800 2.303 2.144 2.463 . 0 0 "[ . 1 . 2]" 1
313 1 18 HIS H 1 18 HIS HB2 3.500 . 3.800 2.349 2.291 2.427 . 0 0 "[ . 1 . 2]" 1
314 1 18 HIS H 1 18 HIS HB3 3.500 . 3.800 3.614 3.571 3.668 . 0 0 "[ . 1 . 2]" 1
315 1 18 HIS H 1 18 HIS HD2 4.500 . 5.000 2.786 2.609 2.923 . 0 0 "[ . 1 . 2]" 1
316 1 18 HIS H 1 36 LEU MD2 3.500 . 3.800 3.550 3.435 3.634 . 0 0 "[ . 1 . 2]" 1
317 1 18 HIS HA 1 28 LEU MD1 4.500 . 5.000 4.353 4.085 4.663 . 0 0 "[ . 1 . 2]" 1
318 1 18 HIS HA 1 28 LEU MD2 4.500 . 5.000 4.351 4.092 4.650 . 0 0 "[ . 1 . 2]" 1
319 1 18 HIS HA 1 36 LEU MD2 5.200 . 5.700 4.524 4.465 4.592 . 0 0 "[ . 1 . 2]" 1
320 1 18 HIS HB2 1 28 LEU MD1 4.500 . 5.000 3.014 2.322 4.074 . 0 0 "[ . 1 . 2]" 1
321 1 18 HIS HB2 1 28 LEU MD2 4.500 . 5.000 2.995 2.113 3.888 . 0 0 "[ . 1 . 2]" 1
322 1 18 HIS HB2 1 32 GLU QG 4.500 . 5.000 3.175 3.054 3.296 . 0 0 "[ . 1 . 2]" 1
323 1 18 HIS HB2 1 36 LEU MD2 4.500 . 5.000 2.201 2.080 2.318 . 0 0 "[ . 1 . 2]" 1
324 1 18 HIS HB3 1 28 LEU MD1 4.500 . 5.000 2.867 2.389 3.276 . 0 0 "[ . 1 . 2]" 1
325 1 18 HIS HB3 1 28 LEU MD2 4.500 . 5.000 2.862 2.480 3.394 . 0 0 "[ . 1 . 2]" 1
326 1 18 HIS HB3 1 32 GLU QG 4.500 . 5.000 2.232 2.030 2.459 . 0 0 "[ . 1 . 2]" 1
327 1 18 HIS HB3 1 36 LEU MD2 4.500 . 5.000 2.975 2.839 3.050 . 0 0 "[ . 1 . 2]" 1
328 1 18 HIS HD2 1 36 LEU MD2 4.500 . 5.000 2.952 2.752 3.134 . 0 0 "[ . 1 . 2]" 1
329 1 19 SER HA 1 28 LEU HA 5.200 . 5.700 3.843 3.161 4.372 . 0 0 "[ . 1 . 2]" 1
330 1 19 SER HA 1 28 LEU HB3 4.500 . 5.000 4.534 4.148 4.763 . 0 0 "[ . 1 . 2]" 1
331 1 19 SER HA 1 28 LEU MD1 . . 3.800 2.279 1.949 2.977 . 0 0 "[ . 1 . 2]" 1
332 1 19 SER HA 1 28 LEU MD2 . . 3.800 2.304 2.120 2.588 . 0 0 "[ . 1 . 2]" 1
333 1 19 SER QB 1 25 LYS H 5.200 . 5.700 5.189 4.934 5.381 . 0 0 "[ . 1 . 2]" 1
334 1 19 SER QB 1 25 LYS HA 3.500 . 3.800 2.857 2.315 3.396 . 0 0 "[ . 1 . 2]" 1
335 1 19 SER QB 1 27 LYS H 4.500 . 5.000 3.444 2.933 4.098 . 0 0 "[ . 1 . 2]" 1
336 1 19 SER QB 1 28 LEU MD1 4.500 . 5.000 3.503 2.875 3.982 . 0 0 "[ . 1 . 2]" 1
337 1 19 SER QB 1 28 LEU MD2 4.500 . 5.000 3.473 2.640 4.142 . 0 0 "[ . 1 . 2]" 1
338 1 20 GLY H 1 21 LYS H 4.500 . 5.000 2.440 2.239 2.611 . 0 0 "[ . 1 . 2]" 1
339 1 20 GLY H 1 21 LYS HB2 4.500 . 5.000 4.418 4.317 4.446 . 0 0 "[ . 1 . 2]" 1
340 1 20 GLY H 1 21 LYS QG 4.500 . 5.000 4.273 3.813 4.718 . 0 0 "[ . 1 . 2]" 1
341 1 20 GLY H 1 22 GLU H 4.500 . 5.000 3.253 2.940 3.548 . 0 0 "[ . 1 . 2]" 1
342 1 20 GLY H 1 27 LYS H 5.200 . 5.700 4.049 3.602 4.677 . 0 0 "[ . 1 . 2]" 1
343 1 20 GLY H 1 28 LEU HA 4.500 . 5.000 3.611 2.977 3.887 . 0 0 "[ . 1 . 2]" 1
344 1 20 GLY H 1 28 LEU HB2 5.200 . 5.700 4.520 3.833 5.190 . 0 0 "[ . 1 . 2]" 1
345 1 20 GLY H 1 28 LEU HB3 5.200 . 5.700 5.510 5.435 5.529 . 0 0 "[ . 1 . 2]" 1
346 1 20 GLY H 1 28 LEU MD1 4.500 . 5.000 3.618 2.563 4.690 . 0 0 "[ . 1 . 2]" 1
347 1 20 GLY H 1 28 LEU MD2 4.500 . 5.000 3.569 2.618 4.595 . 0 0 "[ . 1 . 2]" 1
348 1 20 GLY QA 1 21 LYS QE 4.500 . 5.000 5.371 4.302 6.462 1.462 16 8 "[* *- * 1 * .+ * *]" 1
349 1 21 LYS H 1 21 LYS QD 5.200 . 5.700 3.867 3.320 4.263 . 0 0 "[ . 1 . 2]" 1
350 1 21 LYS H 1 21 LYS QG 4.500 . 5.000 2.219 2.071 2.399 . 0 0 "[ . 1 . 2]" 1
351 1 21 LYS H 1 22 GLU H 4.500 . 5.000 2.536 2.319 2.628 . 0 0 "[ . 1 . 2]" 1
352 1 21 LYS HA 1 21 LYS QD 3.500 . 3.800 2.319 2.163 3.720 . 0 0 "[ . 1 . 2]" 1
353 1 21 LYS HA 1 21 LYS QE 3.500 . 3.800 3.189 2.499 3.254 . 0 0 "[ . 1 . 2]" 1
354 1 21 LYS HA 1 21 LYS QG 3.500 . 3.800 2.808 2.562 3.094 . 0 0 "[ . 1 . 2]" 1
355 1 21 LYS HB2 1 22 GLU H 4.500 . 5.000 2.749 2.393 2.950 . 0 0 "[ . 1 . 2]" 1
356 1 22 GLU H 1 22 GLU QG 4.500 . 5.000 3.926 2.988 4.064 . 0 0 "[ . 1 . 2]" 1
357 1 22 GLU H 1 23 GLY H 4.500 . 5.000 2.472 2.134 2.998 . 0 0 "[ . 1 . 2]" 1
358 1 22 GLU H 1 24 ASP H 4.500 . 5.000 3.909 3.607 4.144 . 0 0 "[ . 1 . 2]" 1
359 1 22 GLU HA 1 22 GLU QG 3.500 . 3.800 2.657 2.130 3.325 . 0 0 "[ . 1 . 2]" 1
360 1 22 GLU HA 1 23 GLY HA2 5.200 . 5.700 4.822 4.367 5.033 . 0 0 "[ . 1 . 2]" 1
361 1 22 GLU HA 1 23 GLY HA3 4.500 . 5.000 4.418 4.030 4.562 . 0 0 "[ . 1 . 2]" 1
362 1 22 GLU HA 1 24 ASP H 4.500 . 5.000 4.734 4.504 5.032 0.032 9 0 "[ . 1 . 2]" 1
363 1 22 GLU HB2 1 29 SER HA 4.500 . 5.000 3.949 3.138 4.057 . 0 0 "[ . 1 . 2]" 1
364 1 22 GLU HB2 1 29 SER QB 4.500 . 5.000 3.271 2.677 3.799 . 0 0 "[ . 1 . 2]" 1
365 1 22 GLU HB3 1 23 GLY H 4.500 . 5.000 3.296 2.844 4.015 . 0 0 "[ . 1 . 2]" 1
366 1 22 GLU HB3 1 24 ASP H 4.500 . 5.000 3.202 2.481 4.895 . 0 0 "[ . 1 . 2]" 1
367 1 22 GLU HB3 1 29 SER QB 5.200 . 5.700 4.470 2.000 5.349 . 0 0 "[ . 1 . 2]" 1
368 1 22 GLU QG 1 23 GLY H 4.500 . 5.000 3.898 2.892 4.023 . 0 0 "[ . 1 . 2]" 1
369 1 22 GLU QG 1 23 GLY HA3 4.500 . 5.000 3.880 3.845 3.936 . 0 0 "[ . 1 . 2]" 1
370 1 22 GLU QG 1 24 ASP H 4.500 . 5.000 3.634 2.544 4.482 . 0 0 "[ . 1 . 2]" 1
371 1 22 GLU QG 1 69 VAL H 5.200 . 5.700 4.589 3.783 5.046 . 0 0 "[ . 1 . 2]" 1
372 1 23 GLY HA2 1 24 ASP HA 4.500 . 5.000 4.537 4.464 4.574 . 0 0 "[ . 1 . 2]" 1
373 1 23 GLY HA3 1 24 ASP HA 4.500 . 5.000 4.522 4.442 4.613 . 0 0 "[ . 1 . 2]" 1
374 1 24 ASP H 1 25 LYS H 4.500 . 5.000 4.504 4.396 4.564 . 0 0 "[ . 1 . 2]" 1
375 1 24 ASP H 1 27 LYS H 5.200 . 5.700 4.496 4.038 4.770 . 0 0 "[ . 1 . 2]" 1
376 1 24 ASP H 1 27 LYS HB2 4.500 . 5.000 3.149 2.641 3.476 . 0 0 "[ . 1 . 2]" 1
377 1 24 ASP H 1 27 LYS HB3 5.200 . 5.700 4.605 4.128 5.012 . 0 0 "[ . 1 . 2]" 1
378 1 24 ASP H 1 27 LYS HG2 5.200 . 5.700 4.915 4.472 5.232 . 0 0 "[ . 1 . 2]" 1
379 1 24 ASP QB 1 27 LYS H 4.500 . 5.000 3.299 2.927 3.582 . 0 0 "[ . 1 . 2]" 1
380 1 24 ASP QB 1 27 LYS HG3 4.500 . 5.000 2.568 2.285 2.978 . 0 0 "[ . 1 . 2]" 1
381 1 25 LYS H 1 25 LYS QD 4.500 . 5.000 2.866 1.622 4.303 0.178 7 0 "[ . 1 . 2]" 1
382 1 25 LYS H 1 25 LYS QE 5.200 . 5.700 3.755 1.894 4.689 . 0 0 "[ . 1 . 2]" 1
383 1 25 LYS H 1 25 LYS QG 3.500 . 3.800 2.219 1.804 2.745 . 0 0 "[ . 1 . 2]" 1
384 1 25 LYS H 1 27 LYS H 4.500 . 5.000 3.972 3.616 4.221 . 0 0 "[ . 1 . 2]" 1
385 1 25 LYS QG 1 26 TYR H 4.500 . 5.000 3.040 2.365 4.015 . 0 0 "[ . 1 . 2]" 1
386 1 26 TYR H 1 26 TYR HB2 3.500 . 3.800 2.531 2.312 2.613 . 0 0 "[ . 1 . 2]" 1
387 1 26 TYR H 1 26 TYR QD 3.500 . 3.800 3.217 2.909 3.474 . 0 0 "[ . 1 . 2]" 1
388 1 26 TYR H 1 26 TYR QE 5.200 . 5.700 4.639 4.299 4.886 . 0 0 "[ . 1 . 2]" 1
389 1 26 TYR H 1 27 LYS H 3.500 . 3.800 2.273 2.058 2.477 . 0 0 "[ . 1 . 2]" 1
390 1 26 TYR H 1 27 LYS HG2 3.500 . 3.800 3.211 3.045 3.492 . 0 0 "[ . 1 . 2]" 1
391 1 26 TYR H 1 27 LYS HG3 5.200 . 5.700 4.736 4.389 5.074 . 0 0 "[ . 1 . 2]" 1
392 1 26 TYR HA 1 26 TYR QD 3.500 . 3.800 2.173 1.993 2.288 . 0 0 "[ . 1 . 2]" 1
393 1 26 TYR HA 1 26 TYR QE 4.500 . 5.000 4.402 4.194 4.477 . 0 0 "[ . 1 . 2]" 1
394 1 26 TYR HB2 1 26 TYR QE 4.500 . 5.000 4.436 4.412 4.450 . 0 0 "[ . 1 . 2]" 1
395 1 26 TYR HB2 1 27 LYS H 4.500 . 5.000 3.621 3.129 3.851 . 0 0 "[ . 1 . 2]" 1
396 1 26 TYR HB3 1 27 LYS H 4.500 . 5.000 4.356 4.052 4.442 . 0 0 "[ . 1 . 2]" 1
397 1 26 TYR QD 1 27 LYS H 4.500 . 5.000 4.624 4.471 4.744 . 0 0 "[ . 1 . 2]" 1
398 1 26 TYR QE 2 89 PHE H 4.500 . 5.000 3.788 2.586 4.555 . 0 0 "[ . 1 . 2]" 1
399 1 26 TYR QE 2 89 PHE HA 4.500 . 5.000 4.384 3.911 5.198 0.198 5 0 "[ . 1 . 2]" 1
400 1 26 TYR QE 2 89 PHE QB 4.500 . 5.000 2.155 1.946 2.477 . 0 0 "[ . 1 . 2]" 1
401 1 26 TYR QE 2 89 PHE QD 4.500 . 5.000 3.618 3.022 4.300 . 0 0 "[ . 1 . 2]" 1
402 1 27 LYS H 1 27 LYS HB2 3.500 . 3.800 2.668 2.553 2.744 . 0 0 "[ . 1 . 2]" 1
403 1 27 LYS H 1 27 LYS HG2 3.500 . 3.800 2.882 2.558 3.014 . 0 0 "[ . 1 . 2]" 1
404 1 27 LYS H 1 27 LYS HG3 4.500 . 5.000 4.151 3.943 4.266 . 0 0 "[ . 1 . 2]" 1
405 1 27 LYS H 1 28 LEU H 4.500 . 5.000 4.431 4.376 4.500 . 0 0 "[ . 1 . 2]" 1
406 1 27 LYS H 1 28 LEU HA 5.200 . 5.700 4.913 4.780 5.113 . 0 0 "[ . 1 . 2]" 1
407 1 27 LYS H 1 28 LEU HB2 4.500 . 5.000 4.991 4.636 5.158 0.158 1 0 "[ . 1 . 2]" 1
408 1 27 LYS H 1 28 LEU MD1 5.200 . 5.700 5.586 5.233 5.875 0.175 12 0 "[ . 1 . 2]" 1
409 1 27 LYS H 1 28 LEU MD2 5.200 . 5.700 5.636 5.010 6.287 0.587 2 1 "[ + . 1 . 2]" 1
410 1 27 LYS HA 1 27 LYS HD2 3.500 . 3.800 2.290 2.211 2.376 . 0 0 "[ . 1 . 2]" 1
411 1 27 LYS HA 1 27 LYS HD3 4.500 . 5.000 3.881 3.803 3.952 . 0 0 "[ . 1 . 2]" 1
412 1 27 LYS HA 1 27 LYS HE3 4.500 . 5.000 4.110 3.863 4.341 . 0 0 "[ . 1 . 2]" 1
413 1 27 LYS HA 1 69 VAL H 5.200 . 5.700 4.613 4.428 4.795 . 0 0 "[ . 1 . 2]" 1
414 1 27 LYS HA 1 70 ASP HB3 4.500 . 5.000 4.086 3.799 4.419 . 0 0 "[ . 1 . 2]" 1
415 1 27 LYS HB2 1 28 LEU H 4.500 . 5.000 3.667 3.318 3.805 . 0 0 "[ . 1 . 2]" 1
416 1 27 LYS HD2 1 28 LEU H 4.500 . 5.000 4.119 3.881 4.301 . 0 0 "[ . 1 . 2]" 1
417 1 27 LYS HD2 1 70 ASP HA 4.500 . 5.000 2.899 2.672 3.174 . 0 0 "[ . 1 . 2]" 1
418 1 27 LYS HD2 1 70 ASP HB2 4.500 . 5.000 2.797 2.593 3.054 . 0 0 "[ . 1 . 2]" 1
419 1 27 LYS HD3 1 70 ASP HA 4.500 . 5.000 4.587 4.301 4.920 . 0 0 "[ . 1 . 2]" 1
420 1 27 LYS HD3 1 70 ASP HB2 4.500 . 5.000 3.887 3.555 4.334 . 0 0 "[ . 1 . 2]" 1
421 1 27 LYS HE2 1 28 LEU H 4.500 . 5.000 3.481 3.254 3.871 . 0 0 "[ . 1 . 2]" 1
422 1 27 LYS HE2 1 70 ASP HB2 5.200 . 5.700 4.467 4.234 4.546 . 0 0 "[ . 1 . 2]" 1
423 1 27 LYS HE3 1 70 ASP HB2 4.500 . 5.000 3.804 3.387 4.259 . 0 0 "[ . 1 . 2]" 1
424 1 27 LYS HG3 1 28 LEU H 5.200 . 5.700 5.009 4.782 5.046 . 0 0 "[ . 1 . 2]" 1
425 1 28 LEU H 1 28 LEU HB2 3.500 . 3.800 3.037 2.696 3.386 . 0 0 "[ . 1 . 2]" 1
426 1 28 LEU H 1 28 LEU MD1 4.500 . 5.000 4.517 4.307 4.754 . 0 0 "[ . 1 . 2]" 1
427 1 28 LEU H 1 28 LEU MD2 4.500 . 5.000 4.552 4.290 4.828 . 0 0 "[ . 1 . 2]" 1
428 1 28 LEU H 1 68 GLU HA 5.200 . 5.700 4.505 4.393 4.627 . 0 0 "[ . 1 . 2]" 1
429 1 28 LEU H 1 69 VAL H 3.500 . 3.800 2.871 2.781 3.028 . 0 0 "[ . 1 . 2]" 1
430 1 28 LEU H 1 69 VAL HA 4.500 . 5.000 4.832 4.728 4.965 . 0 0 "[ . 1 . 2]" 1
431 1 28 LEU H 1 70 ASP H 5.200 . 5.700 4.926 4.824 5.056 . 0 0 "[ . 1 . 2]" 1
432 1 28 LEU H 1 70 ASP HB2 5.200 . 5.700 5.424 5.285 5.514 . 0 0 "[ . 1 . 2]" 1
433 1 28 LEU H 1 70 ASP HB3 4.500 . 5.000 5.175 5.049 5.311 0.311 11 0 "[ . 1 . 2]" 1
434 1 28 LEU HA 1 28 LEU MD1 . . 3.800 2.945 1.984 3.824 0.024 15 0 "[ . 1 . 2]" 1
435 1 28 LEU HA 1 28 LEU MD2 . . 3.800 2.867 1.985 3.815 0.015 17 0 "[ . 1 . 2]" 1
436 1 28 LEU HA 1 29 SER H 3.500 . 3.800 2.385 2.228 2.564 . 0 0 "[ . 1 . 2]" 1
437 1 28 LEU HB2 1 29 SER H 4.500 . 5.000 4.105 3.956 4.195 . 0 0 "[ . 1 . 2]" 1
438 1 28 LEU HB3 1 29 SER H 3.500 . 3.800 3.278 2.556 3.887 0.087 8 0 "[ . 1 . 2]" 1
439 1 28 LEU HB3 1 69 VAL H 4.500 . 5.000 4.714 4.112 4.996 . 0 0 "[ . 1 . 2]" 1
440 1 28 LEU MD1 1 29 SER H 3.500 . 3.800 3.009 1.727 4.426 0.626 13 1 "[ . 1 + . 2]" 1
441 1 28 LEU MD1 1 32 GLU HB3 3.500 . 3.800 2.676 2.462 2.925 . 0 0 "[ . 1 . 2]" 1
442 1 28 LEU MD1 1 32 GLU QG 3.500 . 3.800 2.297 1.989 2.732 . 0 0 "[ . 1 . 2]" 1
443 1 28 LEU MD1 1 33 LEU H 4.500 . 5.000 4.304 3.791 4.722 . 0 0 "[ . 1 . 2]" 1
444 1 28 LEU MD1 1 69 VAL H 5.200 . 5.700 5.943 5.508 6.409 0.709 15 9 "[* - .** 1 * + ***]" 1
445 1 28 LEU MD2 1 29 SER H 3.500 . 3.800 3.266 2.063 4.330 0.530 8 1 "[ . + 1 . 2]" 1
446 1 28 LEU MD2 1 32 GLU HB3 3.500 . 3.800 2.697 2.346 3.194 . 0 0 "[ . 1 . 2]" 1
447 1 28 LEU MD2 1 32 GLU QG 3.500 . 3.800 2.247 2.034 2.777 . 0 0 "[ . 1 . 2]" 1
448 1 28 LEU MD2 1 33 LEU H 4.500 . 5.000 4.374 4.106 4.724 . 0 0 "[ . 1 . 2]" 1
449 1 28 LEU MD2 1 69 VAL H 5.200 . 5.700 6.003 5.461 6.465 0.765 8 7 "[ ** +*- *. * 2]" 1
450 1 29 SER H 1 29 SER HB2 3.500 . 3.800 3.569 3.407 3.636 . 0 0 "[ . 1 . 2]" 1
451 1 29 SER H 1 29 SER QB 3.500 . 3.800 2.694 2.516 2.944 . 0 0 "[ . 1 . 2]" 1
452 1 29 SER H 1 29 SER HB3 3.500 . 3.800 2.800 2.566 3.220 . 0 0 "[ . 1 . 2]" 1
453 1 29 SER H 1 32 GLU HB3 3.500 . 3.800 3.579 3.310 3.702 . 0 0 "[ . 1 . 2]" 1
454 1 29 SER H 1 68 GLU HA 4.500 . 5.000 4.597 4.453 4.697 . 0 0 "[ . 1 . 2]" 1
455 1 29 SER H 1 68 GLU QB 5.200 . 5.700 5.111 4.548 5.317 . 0 0 "[ . 1 . 2]" 1
456 1 29 SER HA 1 68 GLU H 5.200 . 5.700 4.630 4.564 4.743 . 0 0 "[ . 1 . 2]" 1
457 1 29 SER HA 1 68 GLU QB 4.500 . 5.000 3.456 2.929 3.719 . 0 0 "[ . 1 . 2]" 1
458 1 29 SER QB 1 30 LYS H 3.500 . 3.800 2.670 2.566 2.772 . 0 0 "[ . 1 . 2]" 1
459 1 29 SER QB 1 30 LYS HB2 5.200 . 5.700 4.237 4.066 4.431 . 0 0 "[ . 1 . 2]" 1
460 1 29 SER QB 1 31 LYS H 4.500 . 5.000 2.922 2.645 3.137 . 0 0 "[ . 1 . 2]" 1
461 1 29 SER QB 1 31 LYS QG 4.500 . 5.000 2.410 2.046 2.621 . 0 0 "[ . 1 . 2]" 1
462 1 29 SER QB 1 32 GLU H 4.500 . 5.000 3.559 3.229 3.735 . 0 0 "[ . 1 . 2]" 1
463 1 29 SER QB 1 68 GLU HA 4.500 . 5.000 3.481 3.187 3.658 . 0 0 "[ . 1 . 2]" 1
464 1 29 SER QB 1 68 GLU QB 5.200 . 5.700 4.021 3.549 4.340 . 0 0 "[ . 1 . 2]" 1
465 1 29 SER HB2 1 30 LYS H 4.500 . 5.000 2.724 2.603 2.827 . 0 0 "[ . 1 . 2]" 1
466 1 29 SER HB2 1 68 GLU HA 4.500 . 5.000 4.056 3.865 4.277 . 0 0 "[ . 1 . 2]" 1
467 1 29 SER HB2 1 69 VAL H 5.200 . 5.700 5.517 5.503 5.533 . 0 0 "[ . 1 . 2]" 1
468 1 29 SER HB3 1 30 LYS H 4.500 . 5.000 3.868 3.418 4.072 . 0 0 "[ . 1 . 2]" 1
469 1 29 SER HB3 1 68 GLU HA 4.500 . 5.000 3.832 3.297 4.137 . 0 0 "[ . 1 . 2]" 1
470 1 29 SER HB3 1 69 VAL H 5.200 . 5.700 5.215 4.816 5.453 . 0 0 "[ . 1 . 2]" 1
471 1 30 LYS H 1 30 LYS HB2 3.500 . 3.800 2.233 2.161 2.332 . 0 0 "[ . 1 . 2]" 1
472 1 30 LYS H 1 30 LYS HB3 3.500 . 3.800 3.530 3.488 3.576 . 0 0 "[ . 1 . 2]" 1
473 1 30 LYS H 1 30 LYS HD2 4.500 . 5.000 4.108 3.917 4.307 . 0 0 "[ . 1 . 2]" 1
474 1 30 LYS H 1 32 GLU H 4.500 . 5.000 4.447 4.363 4.528 . 0 0 "[ . 1 . 2]" 1
475 1 30 LYS H 1 61 LEU MD1 4.500 . 5.000 4.803 4.688 4.929 . 0 0 "[ . 1 . 2]" 1
476 1 30 LYS H 1 61 LEU MD2 5.200 . 5.700 5.030 4.969 5.053 . 0 0 "[ . 1 . 2]" 1
477 1 30 LYS H 1 67 GLY H 4.500 . 5.000 3.803 3.638 4.032 . 0 0 "[ . 1 . 2]" 1
478 1 30 LYS H 1 68 GLU H 5.200 . 5.700 4.574 4.018 4.954 . 0 0 "[ . 1 . 2]" 1
479 1 30 LYS H 1 68 GLU HA 4.500 . 5.000 3.147 2.639 3.494 . 0 0 "[ . 1 . 2]" 1
480 1 30 LYS H 1 69 VAL H 4.500 . 5.000 4.207 4.022 4.363 . 0 0 "[ . 1 . 2]" 1
481 1 30 LYS H 1 69 VAL QG 4.500 . 5.000 2.876 2.686 3.111 . 0 0 "[ . 1 . 2]" 1
482 1 30 LYS HA 1 61 LEU MD1 4.500 . 5.000 3.729 3.602 3.821 . 0 0 "[ . 1 . 2]" 1
483 1 30 LYS HA 1 69 VAL H 5.200 . 5.700 5.104 4.655 5.415 . 0 0 "[ . 1 . 2]" 1
484 1 30 LYS HB2 1 31 LYS H 3.500 . 3.800 2.828 2.632 2.920 . 0 0 "[ . 1 . 2]" 1
485 1 30 LYS HB2 1 31 LYS HB3 4.500 . 5.000 4.728 4.493 4.887 . 0 0 "[ . 1 . 2]" 1
486 1 30 LYS HB2 1 65 GLY H 4.500 . 5.000 4.383 4.374 4.396 . 0 0 "[ . 1 . 2]" 1
487 1 30 LYS HB2 1 65 GLY QA 4.500 . 5.000 2.150 2.062 2.203 . 0 0 "[ . 1 . 2]" 1
488 1 30 LYS HB2 1 66 ASP H 5.200 . 5.700 4.639 4.404 4.789 . 0 0 "[ . 1 . 2]" 1
489 1 30 LYS HB2 1 67 GLY H 4.500 . 5.000 3.338 2.869 3.621 . 0 0 "[ . 1 . 2]" 1
490 1 30 LYS HB3 1 31 LYS H 3.500 . 3.800 3.284 3.191 3.345 . 0 0 "[ . 1 . 2]" 1
491 1 30 LYS HB3 1 61 LEU MD1 3.500 . 3.800 2.103 2.009 2.245 . 0 0 "[ . 1 . 2]" 1
492 1 30 LYS HB3 1 61 LEU MD2 3.500 . 3.800 2.208 2.162 2.262 . 0 0 "[ . 1 . 2]" 1
493 1 30 LYS HB3 1 64 ASN H 5.200 . 5.700 5.489 5.321 5.514 . 0 0 "[ . 1 . 2]" 1
494 1 30 LYS HB3 1 65 GLY H 4.500 . 5.000 4.571 4.418 4.683 . 0 0 "[ . 1 . 2]" 1
495 1 30 LYS HB3 1 65 GLY QA 4.500 . 5.000 2.369 2.194 2.501 . 0 0 "[ . 1 . 2]" 1
496 1 30 LYS HD2 1 61 LEU MD2 4.500 . 5.000 3.705 3.635 3.901 . 0 0 "[ . 1 . 2]" 1
497 1 30 LYS HD2 1 64 ASN H 5.200 . 5.700 5.165 5.067 5.328 . 0 0 "[ . 1 . 2]" 1
498 1 30 LYS HD2 1 65 GLY H 5.200 . 5.700 5.040 4.845 5.229 . 0 0 "[ . 1 . 2]" 1
499 1 30 LYS HD2 1 66 ASP H 5.200 . 5.700 5.677 5.399 5.852 0.152 17 0 "[ . 1 . 2]" 1
500 1 30 LYS HD2 1 67 GLY H 4.500 . 5.000 4.002 3.413 4.317 . 0 0 "[ . 1 . 2]" 1
501 1 30 LYS HD3 1 65 GLY QA 5.200 . 5.700 3.763 3.561 3.947 . 0 0 "[ . 1 . 2]" 1
502 1 30 LYS HD3 1 67 GLY H 5.200 . 5.700 5.138 4.485 5.335 . 0 0 "[ . 1 . 2]" 1
503 1 31 LYS H 1 31 LYS HB3 3.500 . 3.800 2.526 2.499 2.555 . 0 0 "[ . 1 . 2]" 1
504 1 31 LYS H 1 31 LYS QE 4.500 . 5.000 3.959 3.516 4.549 . 0 0 "[ . 1 . 2]" 1
505 1 31 LYS H 1 31 LYS QG 3.500 . 3.800 2.133 2.062 2.286 . 0 0 "[ . 1 . 2]" 1
506 1 31 LYS H 1 32 GLU H 3.500 . 3.800 2.907 2.837 2.972 . 0 0 "[ . 1 . 2]" 1
507 1 31 LYS H 1 61 LEU MD2 4.500 . 5.000 4.784 4.667 4.883 . 0 0 "[ . 1 . 2]" 1
508 1 31 LYS H 1 65 GLY H 4.500 . 5.000 5.107 5.063 5.118 0.118 9 0 "[ . 1 . 2]" 1
509 1 31 LYS H 1 65 GLY QA 3.500 . 3.800 2.429 2.370 2.461 . 0 0 "[ . 1 . 2]" 1
510 1 31 LYS H 1 69 VAL QG 4.500 . 5.000 4.675 4.519 4.785 . 0 0 "[ . 1 . 2]" 1
511 1 31 LYS HA 1 31 LYS QG 3.500 . 3.800 3.384 3.368 3.404 . 0 0 "[ . 1 . 2]" 1
512 1 31 LYS HA 1 65 GLY H 5.200 . 5.700 5.447 5.232 5.508 . 0 0 "[ . 1 . 2]" 1
513 1 31 LYS HB3 1 32 GLU H 4.500 . 5.000 4.062 4.011 4.118 . 0 0 "[ . 1 . 2]" 1
514 1 31 LYS QD 1 65 GLY H 4.500 . 5.000 5.463 5.297 5.748 0.748 14 5 "[ * * 1 +. * -]" 1
515 1 31 LYS QD 1 65 GLY QA 3.500 . 3.800 3.518 3.344 3.824 0.024 14 0 "[ . 1 . 2]" 1
516 1 31 LYS QD 1 66 ASP H 4.500 . 5.000 4.097 3.821 4.290 . 0 0 "[ . 1 . 2]" 1
517 1 31 LYS QG 1 32 GLU H 3.500 . 3.800 2.266 2.149 2.381 . 0 0 "[ . 1 . 2]" 1
518 1 31 LYS QG 1 32 GLU HA 3.500 . 3.800 3.417 3.300 3.446 . 0 0 "[ . 1 . 2]" 1
519 1 31 LYS QG 1 32 GLU HB2 4.500 . 5.000 3.223 3.082 3.310 . 0 0 "[ . 1 . 2]" 1
520 1 31 LYS QG 1 32 GLU HB3 4.500 . 5.000 4.276 4.103 4.425 . 0 0 "[ . 1 . 2]" 1
521 1 31 LYS QG 1 65 GLY H 5.200 . 5.700 6.106 5.955 6.327 0.627 14 2 "[ . 1 +. - 2]" 1
522 1 31 LYS QG 1 66 ASP H 5.200 . 5.700 5.217 5.029 5.438 . 0 0 "[ . 1 . 2]" 1
523 1 32 GLU H 1 32 GLU HB3 3.500 . 3.800 2.666 2.611 2.729 . 0 0 "[ . 1 . 2]" 1
524 1 32 GLU H 1 33 LEU H 3.500 . 3.800 2.594 2.531 2.690 . 0 0 "[ . 1 . 2]" 1
525 1 32 GLU H 1 33 LEU HG 5.200 . 5.700 4.303 4.090 4.451 . 0 0 "[ . 1 . 2]" 1
526 1 32 GLU H 1 34 LYS H 4.500 . 5.000 4.177 4.096 4.288 . 0 0 "[ . 1 . 2]" 1
527 1 32 GLU H 1 35 GLU H 5.200 . 5.700 4.906 4.753 5.021 . 0 0 "[ . 1 . 2]" 1
528 1 32 GLU HA 1 34 LYS H 4.500 . 5.000 4.374 4.266 4.479 . 0 0 "[ . 1 . 2]" 1
529 1 32 GLU HB3 1 33 LEU H 3.500 . 3.800 2.546 2.484 2.591 . 0 0 "[ . 1 . 2]" 1
530 1 32 GLU HB3 1 33 LEU HB2 4.500 . 5.000 4.869 4.806 4.958 . 0 0 "[ . 1 . 2]" 1
531 1 32 GLU HB3 1 33 LEU HG 3.500 . 3.800 3.428 3.292 3.572 . 0 0 "[ . 1 . 2]" 1
532 1 33 LEU H 1 33 LEU HB2 3.500 . 3.800 2.515 2.470 2.555 . 0 0 "[ . 1 . 2]" 1
533 1 33 LEU H 1 33 LEU MD1 4.500 . 5.000 3.666 3.572 3.735 . 0 0 "[ . 1 . 2]" 1
534 1 33 LEU H 1 33 LEU HG 4.500 . 5.000 2.305 2.178 2.416 . 0 0 "[ . 1 . 2]" 1
535 1 33 LEU H 1 34 LYS H 3.500 . 3.800 2.663 2.635 2.705 . 0 0 "[ . 1 . 2]" 1
536 1 33 LEU H 1 34 LYS HA 5.200 . 5.700 5.317 5.295 5.359 . 0 0 "[ . 1 . 2]" 1
537 1 33 LEU H 1 34 LYS QB 4.500 . 5.000 4.374 4.260 4.448 . 0 0 "[ . 1 . 2]" 1
538 1 33 LEU H 1 35 GLU H 4.500 . 5.000 4.065 3.946 4.195 . 0 0 "[ . 1 . 2]" 1
539 1 33 LEU H 1 36 LEU MD2 4.500 . 5.000 4.149 3.996 4.232 . 0 0 "[ . 1 . 2]" 1
540 1 33 LEU H 1 61 LEU MD1 5.200 . 5.700 4.453 4.005 4.712 . 0 0 "[ . 1 . 2]" 1
541 1 33 LEU HA 1 33 LEU MD1 4.500 . 5.000 3.841 3.810 3.868 . 0 0 "[ . 1 . 2]" 1
542 1 33 LEU HA 1 36 LEU H 3.500 . 3.800 3.469 3.407 3.514 . 0 0 "[ . 1 . 2]" 1
543 1 33 LEU HA 1 37 LEU H 4.500 . 5.000 3.850 3.682 3.955 . 0 0 "[ . 1 . 2]" 1
544 1 33 LEU HA 1 37 LEU QD 5.200 . 5.700 5.496 4.881 5.644 . 0 0 "[ . 1 . 2]" 1
545 1 33 LEU HB2 1 34 LYS H 3.500 . 3.800 2.651 2.562 2.714 . 0 0 "[ . 1 . 2]" 1
546 1 33 LEU HB2 1 35 GLU H 4.500 . 5.000 4.946 4.867 5.050 0.050 19 0 "[ . 1 . 2]" 1
547 1 33 LEU HB2 1 36 LEU H 5.200 . 5.700 5.733 5.689 5.776 0.076 10 0 "[ . 1 . 2]" 1
548 1 33 LEU HB3 1 34 LYS H 3.500 . 3.800 3.684 3.585 3.787 . 0 0 "[ . 1 . 2]" 1
549 1 33 LEU HG 1 34 LYS H 4.500 . 5.000 4.361 4.259 4.461 . 0 0 "[ . 1 . 2]" 1
550 1 34 LYS H 1 35 GLU H 3.500 . 3.800 2.633 2.550 2.757 . 0 0 "[ . 1 . 2]" 1
551 1 34 LYS H 1 36 LEU MD2 4.500 . 5.000 5.236 5.111 5.310 0.310 10 0 "[ . 1 . 2]" 1
552 1 34 LYS H 1 61 LEU MD1 4.500 . 5.000 3.070 2.739 3.233 . 0 0 "[ . 1 . 2]" 1
553 1 34 LYS HA 1 37 LEU QB 4.500 . 5.000 2.920 2.756 3.298 . 0 0 "[ . 1 . 2]" 1
554 1 34 LYS HA 1 37 LEU QD 3.500 . 3.800 3.937 3.442 4.156 0.356 6 0 "[ . 1 . 2]" 1
555 1 34 LYS HA 1 38 GLN HB3 4.500 . 5.000 5.351 5.117 5.623 0.623 6 2 "[ .+ 1 . -2]" 1
556 1 34 LYS QB 1 35 GLU H 3.500 . 3.800 2.726 2.525 3.137 . 0 0 "[ . 1 . 2]" 1
557 1 34 LYS QD 1 61 LEU HG 3.500 . 3.800 2.728 2.302 3.405 . 0 0 "[ . 1 . 2]" 1
558 1 34 LYS QE 1 61 LEU MD1 4.500 . 5.000 3.225 2.225 4.097 . 0 0 "[ . 1 . 2]" 1
559 1 34 LYS QG 1 37 LEU QD 4.500 . 5.000 4.379 4.081 4.960 . 0 0 "[ . 1 . 2]" 1
560 1 34 LYS QG 1 38 GLN HE21 4.500 . 5.000 2.459 2.200 2.703 . 0 0 "[ . 1 . 2]" 1
561 1 34 LYS QG 1 38 GLN HE22 4.500 . 5.000 2.812 2.663 3.113 . 0 0 "[ . 1 . 2]" 1
562 1 34 LYS QG 1 38 GLN QG 4.500 . 5.000 4.119 3.878 4.377 . 0 0 "[ . 1 . 2]" 1
563 1 35 GLU H 1 35 GLU QB 2.700 . 3.000 2.262 2.027 2.502 . 0 0 "[ . 1 . 2]" 1
564 1 35 GLU H 1 36 LEU H 3.500 . 3.800 2.590 2.513 2.676 . 0 0 "[ . 1 . 2]" 1
565 1 35 GLU H 1 36 LEU HA 5.200 . 5.700 5.218 5.153 5.284 . 0 0 "[ . 1 . 2]" 1
566 1 35 GLU H 1 36 LEU MD2 4.500 . 5.000 4.900 4.862 4.939 . 0 0 "[ . 1 . 2]" 1
567 1 35 GLU H 1 36 LEU HG 4.500 . 5.000 4.305 4.279 4.347 . 0 0 "[ . 1 . 2]" 1
568 1 35 GLU H 1 37 LEU H 4.500 . 5.000 3.899 3.808 3.997 . 0 0 "[ . 1 . 2]" 1
569 1 35 GLU H 1 37 LEU QD 4.500 . 5.000 5.830 5.582 5.923 0.923 20 20 [**************-****+] 1
570 1 35 GLU HA 1 35 GLU HG3 3.500 . 3.800 2.870 2.272 3.715 . 0 0 "[ . 1 . 2]" 1
571 1 35 GLU HA 1 36 LEU HA 5.200 . 5.700 4.701 4.675 4.729 . 0 0 "[ . 1 . 2]" 1
572 1 35 GLU HA 1 38 GLN H 4.500 . 5.000 3.558 3.369 3.735 . 0 0 "[ . 1 . 2]" 1
573 1 35 GLU HA 1 38 GLN HE21 4.500 . 5.000 2.840 2.527 2.984 . 0 0 "[ . 1 . 2]" 1
574 1 35 GLU HA 1 38 GLN HE22 4.500 . 5.000 3.748 3.517 3.889 . 0 0 "[ . 1 . 2]" 1
575 1 35 GLU HA 1 38 GLN QG 4.500 . 5.000 2.319 2.142 2.489 . 0 0 "[ . 1 . 2]" 1
576 1 35 GLU HA 1 39 THR H 4.500 . 5.000 4.368 4.163 4.517 . 0 0 "[ . 1 . 2]" 1
577 1 35 GLU QB 1 36 LEU H 3.500 . 3.800 2.592 2.436 2.729 . 0 0 "[ . 1 . 2]" 1
578 1 35 GLU HG2 1 36 LEU H 4.500 . 5.000 4.706 3.741 5.143 0.143 4 0 "[ . 1 . 2]" 1
579 1 36 LEU H 1 36 LEU HB2 3.500 . 3.800 3.651 3.634 3.668 . 0 0 "[ . 1 . 2]" 1
580 1 36 LEU H 1 36 LEU MD1 4.500 . 5.000 3.820 3.751 3.891 . 0 0 "[ . 1 . 2]" 1
581 1 36 LEU H 1 36 LEU MD2 3.500 . 3.800 3.297 3.227 3.375 . 0 0 "[ . 1 . 2]" 1
582 1 36 LEU H 1 36 LEU HG 3.500 . 3.800 2.421 2.311 2.525 . 0 0 "[ . 1 . 2]" 1
583 1 36 LEU H 1 37 LEU H 3.500 . 3.800 2.627 2.574 2.691 . 0 0 "[ . 1 . 2]" 1
584 1 36 LEU H 1 37 LEU QD 4.500 . 5.000 5.531 5.448 5.581 0.581 1 17 "[+***.***** ***.***-*]" 1
585 1 36 LEU H 1 39 THR H 5.200 . 5.700 4.833 4.777 4.972 . 0 0 "[ . 1 . 2]" 1
586 1 36 LEU HA 1 39 THR H 4.500 . 5.000 3.264 3.150 3.552 . 0 0 "[ . 1 . 2]" 1
587 1 36 LEU HA 1 39 THR HB 4.500 . 5.000 2.821 2.535 3.082 . 0 0 "[ . 1 . 2]" 1
588 1 36 LEU HB2 1 37 LEU HA 4.500 . 5.000 4.774 4.661 4.845 . 0 0 "[ . 1 . 2]" 1
589 1 36 LEU MD1 1 37 LEU H 3.500 . 3.800 2.837 2.779 2.899 . 0 0 "[ . 1 . 2]" 1
590 1 36 LEU MD1 1 37 LEU HA 3.500 . 3.800 2.603 2.495 2.690 . 0 0 "[ . 1 . 2]" 1
591 1 36 LEU MD1 1 37 LEU QB 3.500 . 3.800 3.102 2.921 3.178 . 0 0 "[ . 1 . 2]" 1
592 1 36 LEU MD1 1 39 THR MG 4.500 . 5.000 4.267 4.132 4.401 . 0 0 "[ . 1 . 2]" 1
593 1 36 LEU MD1 1 40 GLU H 4.500 . 5.000 4.645 4.326 4.906 . 0 0 "[ . 1 . 2]" 1
594 1 36 LEU MD1 1 40 GLU HG3 4.500 . 5.000 3.431 2.646 3.819 . 0 0 "[ . 1 . 2]" 1
595 1 36 LEU MD1 1 41 LEU H 4.500 . 5.000 5.364 5.051 5.756 0.756 15 5 "[ * . 1* -+ * 2]" 1
596 1 36 LEU MD1 1 74 TYR QD 4.500 . 5.000 4.178 3.935 4.412 . 0 0 "[ . 1 . 2]" 1
597 1 36 LEU MD1 1 74 TYR QE 4.500 . 5.000 2.903 2.772 3.121 . 0 0 "[ . 1 . 2]" 1
598 1 36 LEU HG 1 37 LEU H 3.500 . 3.800 2.589 2.442 2.663 . 0 0 "[ . 1 . 2]" 1
599 1 36 LEU HG 1 74 TYR QE 4.500 . 5.000 4.260 4.004 4.554 . 0 0 "[ . 1 . 2]" 1
600 1 37 LEU H 1 37 LEU QB 3.500 . 3.800 2.155 2.143 2.166 . 0 0 "[ . 1 . 2]" 1
601 1 37 LEU H 1 37 LEU QD 3.500 . 3.800 3.672 3.652 3.681 . 0 0 "[ . 1 . 2]" 1
602 1 37 LEU H 1 38 GLN H 3.500 . 3.800 2.744 2.717 2.809 . 0 0 "[ . 1 . 2]" 1
603 1 37 LEU H 1 38 GLN QG 4.500 . 5.000 4.074 4.027 4.132 . 0 0 "[ . 1 . 2]" 1
604 1 37 LEU H 1 39 THR H 4.500 . 5.000 3.978 3.947 4.062 . 0 0 "[ . 1 . 2]" 1
605 1 37 LEU HA 1 40 GLU H 4.500 . 5.000 3.761 3.563 3.912 . 0 0 "[ . 1 . 2]" 1
606 1 37 LEU HA 1 41 LEU H 4.500 . 5.000 3.742 3.464 3.952 . 0 0 "[ . 1 . 2]" 1
607 1 37 LEU HA 1 41 LEU HB2 4.500 . 5.000 4.028 3.513 4.237 . 0 0 "[ . 1 . 2]" 1
608 1 37 LEU HA 1 41 LEU QD 4.500 . 5.000 4.402 4.232 4.542 . 0 0 "[ . 1 . 2]" 1
609 1 37 LEU QB 1 38 GLN H 3.500 . 3.800 2.560 2.464 2.628 . 0 0 "[ . 1 . 2]" 1
610 1 37 LEU QB 1 40 GLU H 5.200 . 5.700 5.172 5.007 5.240 . 0 0 "[ . 1 . 2]" 1
611 1 37 LEU QB 1 41 LEU QD 3.500 . 3.800 4.685 4.384 4.816 1.016 5 20 [****+****-**********] 1
612 1 37 LEU QD 1 38 GLN H 3.500 . 3.800 3.095 3.028 3.163 . 0 0 "[ . 1 . 2]" 1
613 1 37 LEU QD 1 38 GLN HB3 3.500 . 3.800 3.053 3.005 3.096 . 0 0 "[ . 1 . 2]" 1
614 1 37 LEU QD 1 38 GLN HE21 4.500 . 5.000 4.261 4.158 4.446 . 0 0 "[ . 1 . 2]" 1
615 1 37 LEU QD 1 38 GLN HE22 4.500 . 5.000 5.469 5.364 5.654 0.654 11 6 "[** . - 1+** . 2]" 1
616 1 37 LEU QD 1 38 GLN QG 4.500 . 5.000 4.064 4.004 4.121 . 0 0 "[ . 1 . 2]" 1
617 1 37 LEU QD 1 39 THR H 4.500 . 5.000 4.463 4.387 4.547 . 0 0 "[ . 1 . 2]" 1
618 1 37 LEU QD 1 81 LEU H 4.500 . 5.000 5.319 4.906 5.554 0.554 2 3 "[ +- . 1 .* 2]" 1
619 1 38 GLN H 1 38 GLN HB3 3.500 . 3.800 2.687 2.629 2.746 . 0 0 "[ . 1 . 2]" 1
620 1 38 GLN H 1 38 GLN HE21 4.500 . 5.000 3.366 3.263 3.468 . 0 0 "[ . 1 . 2]" 1
621 1 38 GLN H 1 38 GLN QG 3.500 . 3.800 1.980 1.943 2.034 . 0 0 "[ . 1 . 2]" 1
622 1 38 GLN H 1 39 THR H 3.500 . 3.800 2.455 2.348 2.533 . 0 0 "[ . 1 . 2]" 1
623 1 38 GLN H 1 39 THR HB 4.500 . 5.000 4.344 4.122 4.471 . 0 0 "[ . 1 . 2]" 1
624 1 38 GLN H 1 39 THR MG 4.500 . 5.000 4.765 4.747 4.823 . 0 0 "[ . 1 . 2]" 1
625 1 38 GLN H 1 40 GLU H 4.500 . 5.000 4.158 4.080 4.264 . 0 0 "[ . 1 . 2]" 1
626 1 38 GLN HA 1 38 GLN HE21 4.500 . 5.000 4.813 4.804 4.826 . 0 0 "[ . 1 . 2]" 1
627 1 38 GLN HA 1 38 GLN QG . . 3.800 3.332 3.313 3.345 . 0 0 "[ . 1 . 2]" 1
628 1 38 GLN HA 1 42 SER QB 5.200 . 5.700 4.781 3.559 5.360 . 0 0 "[ . 1 . 2]" 1
629 1 38 GLN HA 1 45 LEU QD 3.500 . 3.800 4.242 3.746 4.739 0.939 8 10 "[****. + -* *** 2]" 1
630 1 38 GLN HB2 1 45 LEU QD 4.500 . 5.000 4.470 3.938 5.106 0.106 2 0 "[ . 1 . 2]" 1
631 1 38 GLN HB3 1 38 GLN HE21 3.500 . 3.800 2.617 2.549 2.688 . 0 0 "[ . 1 . 2]" 1
632 1 38 GLN HB3 1 38 GLN HE22 4.500 . 5.000 3.669 3.645 3.694 . 0 0 "[ . 1 . 2]" 1
633 1 38 GLN HB3 1 39 THR H 4.500 . 5.000 4.212 4.161 4.247 . 0 0 "[ . 1 . 2]" 1
634 1 38 GLN QG 1 39 THR H . . 3.800 2.643 2.576 2.681 . 0 0 "[ . 1 . 2]" 1
635 1 38 GLN QG 1 39 THR HA 4.500 . 5.000 3.579 3.473 3.639 . 0 0 "[ . 1 . 2]" 1
636 1 38 GLN QG 1 45 LEU QD 5.200 . 5.700 5.650 5.147 6.202 0.502 2 1 "[ + . 1 . 2]" 1
637 1 38 GLN QG 1 45 LEU HG 4.500 . 5.000 5.991 5.287 6.819 1.819 2 16 "[*+**.- *********** 2]" 1
638 1 39 THR H 1 39 THR HB 3.500 . 3.800 2.219 2.101 2.292 . 0 0 "[ . 1 . 2]" 1
639 1 39 THR H 1 39 THR MG 3.500 . 3.800 2.906 2.819 3.041 . 0 0 "[ . 1 . 2]" 1
640 1 39 THR H 1 40 GLU H 3.500 . 3.800 2.519 2.433 2.567 . 0 0 "[ . 1 . 2]" 1
641 1 39 THR H 1 40 GLU HA 4.500 . 5.000 5.206 5.118 5.242 0.242 14 0 "[ . 1 . 2]" 1
642 1 39 THR H 1 40 GLU HB2 4.500 . 5.000 4.626 4.471 4.815 . 0 0 "[ . 1 . 2]" 1
643 1 39 THR HA 1 39 THR HB 2.700 . 3.000 2.756 2.717 2.809 . 0 0 "[ . 1 . 2]" 1
644 1 39 THR HA 1 39 THR MG 3.500 . 3.800 3.134 3.056 3.158 . 0 0 "[ . 1 . 2]" 1
645 1 39 THR HB 1 40 GLU H 4.500 . 5.000 3.699 3.446 3.838 . 0 0 "[ . 1 . 2]" 1
646 1 39 THR HB 1 40 GLU HG3 5.200 . 5.700 5.512 5.502 5.523 . 0 0 "[ . 1 . 2]" 1
647 1 39 THR MG 1 40 GLU H 4.500 . 5.000 2.524 2.450 2.595 . 0 0 "[ . 1 . 2]" 1
648 1 39 THR MG 1 40 GLU HG2 3.500 . 3.800 2.163 2.033 2.245 . 0 0 "[ . 1 . 2]" 1
649 1 39 THR MG 1 41 LEU H 4.500 . 5.000 4.518 4.467 4.558 . 0 0 "[ . 1 . 2]" 1
650 1 40 GLU H 1 40 GLU HB2 3.500 . 3.800 2.331 2.271 2.558 . 0 0 "[ . 1 . 2]" 1
651 1 40 GLU H 1 40 GLU HG2 3.500 . 3.800 2.961 2.552 3.110 . 0 0 "[ . 1 . 2]" 1
652 1 40 GLU H 1 40 GLU HG3 3.500 . 3.800 3.404 3.156 3.523 . 0 0 "[ . 1 . 2]" 1
653 1 40 GLU H 1 41 LEU H 3.500 . 3.800 2.322 2.270 2.410 . 0 0 "[ . 1 . 2]" 1
654 1 40 GLU H 1 41 LEU HB2 5.200 . 5.700 4.623 4.363 4.839 . 0 0 "[ . 1 . 2]" 1
655 1 40 GLU H 1 42 SER H 4.500 . 5.000 4.275 4.056 4.529 . 0 0 "[ . 1 . 2]" 1
656 1 40 GLU HA 1 42 SER H 4.500 . 5.000 5.431 5.164 5.512 0.512 11 8 "[** . **1+ -* * 2]" 1
657 1 40 GLU HB2 1 41 LEU H 4.500 . 5.000 2.515 2.445 2.721 . 0 0 "[ . 1 . 2]" 1
658 1 40 GLU HG2 1 41 LEU H 4.500 . 5.000 4.543 4.415 4.590 . 0 0 "[ . 1 . 2]" 1
659 1 40 GLU HG3 1 41 LEU H 4.500 . 5.000 4.601 4.463 4.626 . 0 0 "[ . 1 . 2]" 1
660 1 41 LEU H 1 41 LEU HB2 3.500 . 3.800 2.496 2.256 2.623 . 0 0 "[ . 1 . 2]" 1
661 1 41 LEU H 1 41 LEU QD 4.500 . 5.000 3.730 3.671 3.797 . 0 0 "[ . 1 . 2]" 1
662 1 41 LEU H 1 41 LEU HG 4.500 . 5.000 4.485 4.263 4.557 . 0 0 "[ . 1 . 2]" 1
663 1 41 LEU H 1 42 SER H 3.500 . 3.800 2.690 2.551 2.884 . 0 0 "[ . 1 . 2]" 1
664 1 41 LEU H 1 42 SER HA 4.500 . 5.000 4.954 4.781 5.165 0.165 3 0 "[ . 1 . 2]" 1
665 1 41 LEU H 1 43 GLY H 5.200 . 5.700 5.102 4.937 5.341 . 0 0 "[ . 1 . 2]" 1
666 1 41 LEU HA 1 41 LEU QD . . 3.800 2.239 2.118 3.012 . 0 0 "[ . 1 . 2]" 1
667 1 41 LEU HA 1 43 GLY H 5.200 . 5.700 4.088 3.955 4.264 . 0 0 "[ . 1 . 2]" 1
668 1 41 LEU HB2 1 42 SER H 4.500 . 5.000 3.590 3.357 3.710 . 0 0 "[ . 1 . 2]" 1
669 1 41 LEU HB2 2 4 LEU QD 3.500 . 3.800 2.458 2.243 2.613 . 0 0 "[ . 1 . 2]" 1
670 1 41 LEU HB3 1 42 SER H 4.500 . 5.000 2.172 2.127 2.260 . 0 0 "[ . 1 . 2]" 1
671 1 41 LEU HB3 2 4 LEU QD 3.500 . 3.800 3.606 3.395 3.829 0.029 8 0 "[ . 1 . 2]" 1
672 1 41 LEU QD 1 42 SER H 4.500 . 5.000 3.528 2.619 3.664 . 0 0 "[ . 1 . 2]" 1
673 1 41 LEU QD 1 43 GLY H 4.500 . 5.000 2.210 1.739 2.448 0.061 6 0 "[ . 1 . 2]" 1
674 1 41 LEU QD 1 43 GLY HA3 4.500 . 5.000 2.675 2.562 3.713 . 0 0 "[ . 1 . 2]" 1
675 1 41 LEU QD 1 44 PHE H 4.500 . 5.000 2.075 1.590 2.373 0.210 6 0 "[ . 1 . 2]" 1
676 1 41 LEU QD 1 44 PHE HB3 5.200 . 5.700 3.005 2.843 3.232 . 0 0 "[ . 1 . 2]" 1
677 1 41 LEU QD 1 44 PHE QD 4.500 . 5.000 2.152 1.908 2.327 . 0 0 "[ . 1 . 2]" 1
678 1 41 LEU QD 1 44 PHE QE . . 5.000 3.855 3.500 4.020 . 0 0 "[ . 1 . 2]" 1
679 1 41 LEU QD 1 78 VAL HA 3.500 . 3.800 4.703 4.198 5.050 1.250 15 19 [*********1*-**+*****] 1
680 1 41 LEU QD 2 5 GLU H 4.500 . 5.000 3.481 3.296 3.914 . 0 0 "[ . 1 . 2]" 1
681 1 41 LEU QD 2 5 GLU HG2 4.500 . 5.000 3.403 2.882 4.329 . 0 0 "[ . 1 . 2]" 1
682 1 41 LEU HG 1 42 SER H 5.200 . 5.700 3.644 3.387 4.849 . 0 0 "[ . 1 . 2]" 1
683 1 41 LEU HG 1 43 GLY H 5.200 . 5.700 2.501 2.172 4.555 . 0 0 "[ . 1 . 2]" 1
684 1 41 LEU HG 1 44 PHE H 4.500 . 5.000 2.305 1.898 4.378 . 0 0 "[ . 1 . 2]" 1
685 1 41 LEU HG 2 4 LEU QD 3.500 . 3.800 4.166 2.741 4.423 0.623 8 11 "[ *** + 1* ***** -]" 1
686 1 42 SER H 1 43 GLY H 3.500 . 3.800 3.076 3.015 3.265 . 0 0 "[ . 1 . 2]" 1
687 1 42 SER H 1 45 LEU QD 5.200 . 5.700 3.551 3.325 3.898 . 0 0 "[ . 1 . 2]" 1
688 1 42 SER HA 1 45 LEU H 4.500 . 5.000 4.425 4.333 4.476 . 0 0 "[ . 1 . 2]" 1
689 1 42 SER HA 1 45 LEU QB 4.500 . 5.000 4.018 3.931 4.087 . 0 0 "[ . 1 . 2]" 1
690 1 42 SER QB 1 45 LEU QB 4.500 . 5.000 5.618 5.349 5.833 0.833 18 18 "[* *-*********** *+**]" 1
691 1 42 SER QB 1 45 LEU QD 4.500 . 5.000 3.391 3.321 3.713 . 0 0 "[ . 1 . 2]" 1
692 1 43 GLY H 1 44 PHE H 3.500 . 3.800 2.164 2.017 2.230 . 0 0 "[ . 1 . 2]" 1
693 1 43 GLY H 1 44 PHE HA 5.200 . 5.700 4.739 4.657 4.779 . 0 0 "[ . 1 . 2]" 1
694 1 43 GLY H 1 44 PHE HB3 4.500 . 5.000 5.117 4.855 5.517 0.517 10 1 "[ . + . 2]" 1
695 1 43 GLY H 1 44 PHE QD 4.500 . 5.000 5.016 4.187 5.265 0.265 9 0 "[ . 1 . 2]" 1
696 1 43 GLY H 1 45 LEU H 4.500 . 5.000 3.032 2.902 3.120 . 0 0 "[ . 1 . 2]" 1
697 1 43 GLY H 1 45 LEU QB 4.500 . 5.000 4.116 3.981 4.202 . 0 0 "[ . 1 . 2]" 1
698 1 43 GLY H 1 46 ASP H 5.200 . 5.700 4.674 4.666 4.690 . 0 0 "[ . 1 . 2]" 1
699 1 44 PHE H 1 44 PHE HB2 3.500 . 3.800 1.998 1.931 2.297 . 0 0 "[ . 1 . 2]" 1
700 1 44 PHE H 1 44 PHE HB3 3.500 . 3.800 3.288 3.178 3.542 . 0 0 "[ . 1 . 2]" 1
701 1 44 PHE H 1 44 PHE QD 4.500 . 5.000 3.213 2.606 3.412 . 0 0 "[ . 1 . 2]" 1
702 1 44 PHE H 1 45 LEU H 3.500 . 3.800 2.591 2.542 2.618 . 0 0 "[ . 1 . 2]" 1
703 1 44 PHE H 1 45 LEU QB 4.500 . 5.000 4.382 4.375 4.388 . 0 0 "[ . 1 . 2]" 1
704 1 44 PHE H 1 45 LEU QD 4.500 . 5.000 3.318 3.276 3.347 . 0 0 "[ . 1 . 2]" 1
705 1 44 PHE H 1 46 ASP H 4.500 . 5.000 4.213 4.155 4.232 . 0 0 "[ . 1 . 2]" 1
706 1 44 PHE HA 1 44 PHE QD 3.500 . 3.800 2.942 2.568 3.021 . 0 0 "[ . 1 . 2]" 1
707 1 44 PHE HA 1 45 LEU QD 4.500 . 5.000 4.161 4.118 4.216 . 0 0 "[ . 1 . 2]" 1
708 1 44 PHE HA 1 82 THR HA 5.200 . 5.700 6.731 6.271 7.202 1.502 1 20 [+*******-***********] 1
709 1 44 PHE HB2 1 45 LEU H 4.500 . 5.000 3.366 3.199 3.470 . 0 0 "[ . 1 . 2]" 1
710 1 44 PHE HB2 1 45 LEU QD 4.500 . 5.000 4.466 4.430 4.508 . 0 0 "[ . 1 . 2]" 1
711 1 44 PHE HB2 1 46 ASP H 5.200 . 5.700 5.167 5.097 5.180 . 0 0 "[ . 1 . 2]" 1
712 1 44 PHE HB3 1 45 LEU H 4.500 . 5.000 3.427 3.210 3.861 . 0 0 "[ . 1 . 2]" 1
713 1 44 PHE HB3 1 45 LEU QD 5.200 . 5.700 4.690 4.566 5.032 . 0 0 "[ . 1 . 2]" 1
714 1 44 PHE QD 1 45 LEU H 4.500 . 5.000 4.782 4.541 4.865 . 0 0 "[ . 1 . 2]" 1
715 1 44 PHE QD 1 47 ALA MB 4.500 . 5.000 2.626 2.261 2.852 . 0 0 "[ . 1 . 2]" 1
716 1 44 PHE QD 1 85 CYS HB2 4.500 . 5.000 3.274 2.853 3.857 . 0 0 "[ . 1 . 2]" 1
717 1 44 PHE QD 1 85 CYS HB3 4.500 . 5.000 4.075 3.431 4.690 . 0 0 "[ . 1 . 2]" 1
718 1 44 PHE QE 1 82 THR HA 4.500 . 5.000 2.366 2.102 4.493 . 0 0 "[ . 1 . 2]" 1
719 1 44 PHE QE 1 82 THR MG 4.500 . 5.000 3.204 2.849 3.824 . 0 0 "[ . 1 . 2]" 1
720 1 45 LEU H 1 45 LEU QB 3.500 . 3.800 2.229 2.172 2.307 . 0 0 "[ . 1 . 2]" 1
721 1 45 LEU H 1 45 LEU QD 3.500 . 3.800 1.964 1.909 2.017 . 0 0 "[ . 1 . 2]" 1
722 1 45 LEU H 1 46 ASP H 3.500 . 3.800 2.542 2.460 2.611 . 0 0 "[ . 1 . 2]" 1
723 1 45 LEU H 1 47 ALA H 4.500 . 5.000 3.762 3.708 3.843 . 0 0 "[ . 1 . 2]" 1
724 1 45 LEU H 1 48 GLN HG2 5.200 . 5.700 5.888 5.197 6.312 0.612 20 3 "[* .- 1 . +]" 1
725 1 45 LEU HA 1 45 LEU QD 3.500 . 3.800 3.138 3.115 3.153 . 0 0 "[ . 1 . 2]" 1
726 1 45 LEU HA 1 48 GLN HE21 4.500 . 5.000 2.538 2.171 2.979 . 0 0 "[ . 1 . 2]" 1
727 1 45 LEU HA 1 48 GLN HE22 4.500 . 5.000 3.310 2.633 3.529 . 0 0 "[ . 1 . 2]" 1
728 1 45 LEU QB 1 46 ASP H . . 3.800 3.641 3.617 3.666 . 0 0 "[ . 1 . 2]" 1
729 1 45 LEU QB 1 47 ALA H 5.200 . 5.700 4.966 4.901 5.088 . 0 0 "[ . 1 . 2]" 1
730 1 45 LEU QB 1 48 GLN HE21 4.500 . 5.000 3.612 3.268 4.112 . 0 0 "[ . 1 . 2]" 1
731 1 45 LEU QB 1 48 GLN HE22 4.500 . 5.000 3.797 3.415 4.247 . 0 0 "[ . 1 . 2]" 1
732 1 45 LEU QD 1 48 GLN HE22 4.500 . 5.000 4.545 4.132 5.006 0.006 16 0 "[ . 1 . 2]" 1
733 1 46 ASP H 1 47 ALA MB 4.500 . 5.000 3.744 3.688 3.817 . 0 0 "[ . 1 . 2]" 1
734 1 46 ASP QB 1 47 ALA MB 4.500 . 5.000 3.836 3.632 4.037 . 0 0 "[ . 1 . 2]" 1
735 1 47 ALA H 1 47 ALA MB 2.700 . 3.000 2.247 2.203 2.318 . 0 0 "[ . 1 . 2]" 1
736 1 47 ALA H 1 48 GLN HA 4.500 . 5.000 5.142 5.027 5.309 0.309 16 0 "[ . 1 . 2]" 1
737 1 47 ALA H 1 48 GLN HG2 4.500 . 5.000 5.008 3.666 5.484 0.484 1 0 "[ . 1 . 2]" 1
738 1 47 ALA H 1 48 GLN HG3 4.500 . 5.000 3.819 3.536 5.195 0.195 4 0 "[ . 1 . 2]" 1
739 1 47 ALA HA 1 48 GLN H 3.500 . 3.800 3.332 3.111 3.364 . 0 0 "[ . 1 . 2]" 1
740 1 47 ALA MB 1 48 GLN H 3.500 . 3.800 3.169 3.057 3.441 . 0 0 "[ . 1 . 2]" 1
741 1 47 ALA MB 1 85 CYS H 5.200 . 5.700 5.044 4.880 5.350 . 0 0 "[ . 1 . 2]" 1
742 1 47 ALA MB 1 85 CYS HB2 4.500 . 5.000 2.869 2.624 3.115 . 0 0 "[ . 1 . 2]" 1
743 1 48 GLN H 1 48 GLN HB2 3.500 . 3.800 2.683 2.448 3.434 . 0 0 "[ . 1 . 2]" 1
744 1 48 GLN H 1 48 GLN HE21 4.500 . 5.000 3.995 3.386 4.872 . 0 0 "[ . 1 . 2]" 1
745 1 48 GLN H 1 48 GLN HG2 3.500 . 3.800 3.147 1.843 3.540 . 0 0 "[ . 1 . 2]" 1
746 1 48 GLN H 1 48 GLN HG3 3.500 . 3.800 2.087 1.782 3.065 0.018 3 0 "[ . 1 . 2]" 1
747 1 48 GLN H 1 49 LYS H 4.500 . 5.000 4.607 4.454 4.688 . 0 0 "[ . 1 . 2]" 1
748 1 48 GLN H 1 85 CYS HB2 5.200 . 5.700 4.540 4.122 5.193 . 0 0 "[ . 1 . 2]" 1
749 1 48 GLN HA 1 49 LYS H 3.500 . 3.800 2.208 2.054 2.271 . 0 0 "[ . 1 . 2]" 1
750 1 48 GLN HA 1 49 LYS HG2 3.500 . 3.800 3.639 3.401 3.778 . 0 0 "[ . 1 . 2]" 1
751 1 48 GLN HA 1 54 VAL QG 4.500 . 5.000 4.043 3.715 4.270 . 0 0 "[ . 1 . 2]" 1
752 1 48 GLN HA 1 85 CYS HA 4.500 . 5.000 3.184 2.765 3.564 . 0 0 "[ . 1 . 2]" 1
753 1 48 GLN HB2 1 48 GLN HE21 4.500 . 5.000 3.258 2.179 4.454 . 0 0 "[ . 1 . 2]" 1
754 1 48 GLN HB2 1 54 VAL QG 4.500 . 5.000 2.651 2.214 2.903 . 0 0 "[ . 1 . 2]" 1
755 1 48 GLN HB3 1 49 LYS H 4.500 . 5.000 3.305 2.997 3.884 . 0 0 "[ . 1 . 2]" 1
756 1 48 GLN HB3 1 84 ALA MB 4.500 . 5.000 2.476 2.221 3.174 . 0 0 "[ . 1 . 2]" 1
757 1 48 GLN HE21 1 54 VAL QG 4.500 . 5.000 3.188 2.992 3.406 . 0 0 "[ . 1 . 2]" 1
758 1 48 GLN HE22 1 54 VAL QG 3.500 . 3.800 2.901 2.558 3.217 . 0 0 "[ . 1 . 2]" 1
759 1 48 GLN HG2 1 49 LYS H 4.500 . 5.000 4.660 4.301 5.169 0.169 16 0 "[ . 1 . 2]" 1
760 1 48 GLN HG2 1 54 VAL QG 4.500 . 5.000 3.316 2.645 3.777 . 0 0 "[ . 1 . 2]" 1
761 1 48 GLN HG3 1 54 VAL QG 4.500 . 5.000 3.728 3.179 3.889 . 0 0 "[ . 1 . 2]" 1
762 1 49 LYS H 1 49 LYS HG2 4.500 . 5.000 2.609 2.031 2.811 . 0 0 "[ . 1 . 2]" 1
763 1 49 LYS H 1 50 ASP H 3.500 . 3.800 1.990 1.853 2.249 . 0 0 "[ . 1 . 2]" 1
764 1 49 LYS H 1 50 ASP HB2 4.500 . 5.000 4.324 4.142 4.514 . 0 0 "[ . 1 . 2]" 1
765 1 49 LYS H 1 84 ALA HA 4.500 . 5.000 3.714 3.504 3.965 . 0 0 "[ . 1 . 2]" 1
766 1 49 LYS H 1 84 ALA MB 3.500 . 3.800 2.461 2.281 2.858 . 0 0 "[ . 1 . 2]" 1
767 1 49 LYS H 1 85 CYS H 4.500 . 5.000 3.984 3.844 4.180 . 0 0 "[ . 1 . 2]" 1
768 1 49 LYS HA 1 49 LYS HD2 4.500 . 5.000 3.289 2.907 3.615 . 0 0 "[ . 1 . 2]" 1
769 1 49 LYS HA 1 49 LYS QD 3.500 . 3.800 2.167 2.057 2.465 . 0 0 "[ . 1 . 2]" 1
770 1 49 LYS HA 1 49 LYS HD3 4.500 . 5.000 2.211 2.072 2.607 . 0 0 "[ . 1 . 2]" 1
771 1 49 LYS QB 1 50 ASP H 3.500 . 3.800 2.973 2.830 3.136 . 0 0 "[ . 1 . 2]" 1
772 1 49 LYS QD 1 85 CYS HA 4.500 . 5.000 4.258 3.908 4.437 . 0 0 "[ . 1 . 2]" 1
773 1 49 LYS HG2 1 50 ASP H 4.500 . 5.000 4.229 3.921 4.306 . 0 0 "[ . 1 . 2]" 1
774 1 49 LYS HG2 1 85 CYS H 4.500 . 5.000 4.815 4.717 4.842 . 0 0 "[ . 1 . 2]" 1
775 1 49 LYS HG2 1 85 CYS HA 4.500 . 5.000 2.096 2.039 2.181 . 0 0 "[ . 1 . 2]" 1
776 1 49 LYS HG2 1 85 CYS HB2 4.500 . 5.000 4.186 3.885 4.497 . 0 0 "[ . 1 . 2]" 1
777 1 49 LYS HG2 1 86 ASN H 5.200 . 5.700 5.496 5.313 5.530 . 0 0 "[ . 1 . 2]" 1
778 1 49 LYS HG3 1 85 CYS HA 4.500 . 5.000 3.351 3.092 3.525 . 0 0 "[ . 1 . 2]" 1
779 1 50 ASP H 1 50 ASP HB2 3.500 . 3.800 2.571 2.501 2.657 . 0 0 "[ . 1 . 2]" 1
780 1 50 ASP H 1 50 ASP HB3 3.500 . 3.800 2.605 2.568 2.682 . 0 0 "[ . 1 . 2]" 1
781 1 50 ASP H 1 51 VAL H 4.500 . 5.000 4.146 3.941 4.288 . 0 0 "[ . 1 . 2]" 1
782 1 50 ASP H 1 53 ALA MB 4.500 . 5.000 4.348 4.277 4.416 . 0 0 "[ . 1 . 2]" 1
783 1 50 ASP H 1 54 VAL QG 5.200 . 5.700 3.824 3.691 3.998 . 0 0 "[ . 1 . 2]" 1
784 1 50 ASP H 1 84 ALA H 5.200 . 5.700 5.024 4.910 5.202 . 0 0 "[ . 1 . 2]" 1
785 1 50 ASP H 1 84 ALA HA 3.500 . 3.800 2.852 2.693 3.002 . 0 0 "[ . 1 . 2]" 1
786 1 50 ASP H 1 84 ALA MB 3.500 . 3.800 1.951 1.828 2.070 . 0 0 "[ . 1 . 2]" 1
787 1 50 ASP HA 1 51 VAL H 3.500 . 3.800 2.231 2.165 2.307 . 0 0 "[ . 1 . 2]" 1
788 1 50 ASP HA 1 52 ASP H 3.500 . 3.800 3.540 3.427 3.625 . 0 0 "[ . 1 . 2]" 1
789 1 50 ASP HA 1 53 ALA H 4.500 . 5.000 4.158 4.017 4.271 . 0 0 "[ . 1 . 2]" 1
790 1 50 ASP HA 1 90 TRP HH2 4.500 . 5.000 5.412 5.267 5.428 0.428 11 0 "[ . 1 . 2]" 1
791 1 50 ASP HA 1 90 TRP HZ2 4.500 . 5.000 3.777 3.460 4.084 . 0 0 "[ . 1 . 2]" 1
792 1 50 ASP HB2 1 53 ALA MB 3.500 . 3.800 3.518 3.447 3.599 . 0 0 "[ . 1 . 2]" 1
793 1 50 ASP HB2 1 84 ALA H 5.200 . 5.700 4.994 4.985 5.009 . 0 0 "[ . 1 . 2]" 1
794 1 50 ASP HB2 1 84 ALA MB 4.500 . 5.000 3.022 2.931 3.134 . 0 0 "[ . 1 . 2]" 1
795 1 50 ASP HB2 1 90 TRP HH2 4.500 . 5.000 3.113 3.010 3.267 . 0 0 "[ . 1 . 2]" 1
796 1 50 ASP HB2 1 90 TRP HZ2 4.500 . 5.000 2.298 2.093 2.429 . 0 0 "[ . 1 . 2]" 1
797 1 50 ASP HB2 1 90 TRP HZ3 5.200 . 5.700 5.465 5.353 5.615 . 0 0 "[ . 1 . 2]" 1
798 1 50 ASP HB3 1 51 VAL H 4.500 . 5.000 4.409 4.363 4.432 . 0 0 "[ . 1 . 2]" 1
799 1 50 ASP HB3 1 53 ALA H 4.500 . 5.000 3.359 3.239 3.538 . 0 0 "[ . 1 . 2]" 1
800 1 50 ASP HB3 1 53 ALA MB 4.500 . 5.000 2.192 2.115 2.300 . 0 0 "[ . 1 . 2]" 1
801 1 50 ASP HB3 1 54 VAL H 4.500 . 5.000 3.753 3.641 3.950 . 0 0 "[ . 1 . 2]" 1
802 1 50 ASP HB3 1 84 ALA HA 4.500 . 5.000 2.656 2.460 2.897 . 0 0 "[ . 1 . 2]" 1
803 1 50 ASP HB3 1 84 ALA MB 4.500 . 5.000 2.252 2.172 2.344 . 0 0 "[ . 1 . 2]" 1
804 1 50 ASP HB3 1 90 TRP HH2 4.500 . 5.000 3.760 3.458 4.027 . 0 0 "[ . 1 . 2]" 1
805 1 51 VAL H 1 51 VAL HB 3.500 . 3.800 2.532 2.502 2.562 . 0 0 "[ . 1 . 2]" 1
806 1 51 VAL H 1 51 VAL MG2 2.700 . 3.000 2.049 2.036 2.071 . 0 0 "[ . 1 . 2]" 1
807 1 51 VAL H 1 52 ASP H 3.500 . 3.800 2.739 2.646 2.797 . 0 0 "[ . 1 . 2]" 1
808 1 51 VAL H 1 52 ASP HA 5.200 . 5.700 5.301 5.253 5.334 . 0 0 "[ . 1 . 2]" 1
809 1 51 VAL H 1 53 ALA MB 5.200 . 5.700 5.065 4.964 5.124 . 0 0 "[ . 1 . 2]" 1
810 1 51 VAL H 1 84 ALA MB 5.200 . 5.700 5.123 4.871 5.254 . 0 0 "[ . 1 . 2]" 1
811 1 51 VAL HA 1 51 VAL MG1 3.500 . 3.800 2.415 2.407 2.422 . 0 0 "[ . 1 . 2]" 1
812 1 51 VAL HA 1 51 VAL MG2 3.500 . 3.800 2.411 2.406 2.414 . 0 0 "[ . 1 . 2]" 1
813 1 51 VAL HA 1 54 VAL H 3.500 . 3.800 3.549 3.438 3.605 . 0 0 "[ . 1 . 2]" 1
814 1 51 VAL HA 1 54 VAL HB 4.500 . 5.000 4.755 4.747 4.763 . 0 0 "[ . 1 . 2]" 1
815 1 51 VAL HA 1 55 ASP H 4.500 . 5.000 3.819 3.701 3.982 . 0 0 "[ . 1 . 2]" 1
816 1 51 VAL HA 1 55 ASP QB 4.500 . 5.000 4.287 4.193 4.321 . 0 0 "[ . 1 . 2]" 1
817 1 51 VAL HA 1 84 ALA MB 4.500 . 5.000 5.251 4.869 5.511 0.511 18 1 "[ . 1 . + 2]" 1
818 1 51 VAL HB 1 52 ASP H 3.500 . 3.800 2.872 2.812 2.912 . 0 0 "[ . 1 . 2]" 1
819 1 51 VAL HB 1 52 ASP HB2 4.500 . 5.000 4.296 4.209 4.382 . 0 0 "[ . 1 . 2]" 1
820 1 51 VAL MG1 1 52 ASP HA 4.500 . 5.000 3.468 3.395 3.582 . 0 0 "[ . 1 . 2]" 1
821 1 51 VAL MG1 1 55 ASP QB 3.500 . 3.800 2.949 2.693 3.074 . 0 0 "[ . 1 . 2]" 1
822 1 52 ASP H 1 52 ASP HB3 3.500 . 3.800 2.740 2.663 2.813 . 0 0 "[ . 1 . 2]" 1
823 1 52 ASP H 1 53 ALA H 3.500 . 3.800 2.546 2.489 2.596 . 0 0 "[ . 1 . 2]" 1
824 1 52 ASP H 1 53 ALA MB 4.500 . 5.000 4.266 4.240 4.301 . 0 0 "[ . 1 . 2]" 1
825 1 52 ASP H 1 54 VAL H 4.500 . 5.000 4.317 4.256 4.416 . 0 0 "[ . 1 . 2]" 1
826 1 52 ASP HA 1 52 ASP HB2 2.700 . 3.000 2.572 2.537 2.608 . 0 0 "[ . 1 . 2]" 1
827 1 52 ASP HA 1 53 ALA H 3.500 . 3.800 3.510 3.500 3.519 . 0 0 "[ . 1 . 2]" 1
828 1 52 ASP HB3 1 53 ALA H 3.500 . 3.800 2.764 2.634 2.866 . 0 0 "[ . 1 . 2]" 1
829 1 52 ASP HB3 1 53 ALA HA 4.500 . 5.000 4.124 4.033 4.284 . 0 0 "[ . 1 . 2]" 1
830 1 52 ASP HB3 1 53 ALA MB 4.500 . 5.000 4.000 3.860 4.143 . 0 0 "[ . 1 . 2]" 1
831 1 52 ASP HB3 1 54 VAL H 5.200 . 5.700 5.296 5.188 5.412 . 0 0 "[ . 1 . 2]" 1
832 1 53 ALA H 1 53 ALA MB 2.700 . 3.000 2.253 2.224 2.277 . 0 0 "[ . 1 . 2]" 1
833 1 53 ALA H 1 54 VAL H 3.500 . 3.800 2.667 2.595 2.731 . 0 0 "[ . 1 . 2]" 1
834 1 53 ALA H 1 54 VAL HA 5.200 . 5.700 5.267 5.194 5.335 . 0 0 "[ . 1 . 2]" 1
835 1 53 ALA H 1 54 VAL HB 4.500 . 5.000 6.261 6.187 6.334 1.334 18 20 [*************-***+**] 1
836 1 53 ALA H 1 54 VAL QG 4.500 . 5.000 3.521 3.474 3.560 . 0 0 "[ . 1 . 2]" 1
837 1 53 ALA H 1 55 ASP H 4.500 . 5.000 4.005 3.959 4.021 . 0 0 "[ . 1 . 2]" 1
838 1 53 ALA H 1 56 LYS QB 4.500 . 5.000 5.161 4.915 5.223 0.223 20 0 "[ . 1 . 2]" 1
839 1 53 ALA H 1 84 ALA MB 4.500 . 5.000 4.711 4.520 4.908 . 0 0 "[ . 1 . 2]" 1
840 1 53 ALA HA 1 54 VAL HA 4.500 . 5.000 4.697 4.644 4.730 . 0 0 "[ . 1 . 2]" 1
841 1 53 ALA HA 1 56 LYS QB 3.500 . 3.800 3.111 2.760 3.265 . 0 0 "[ . 1 . 2]" 1
842 1 53 ALA MB 1 54 VAL H 3.500 . 3.800 2.341 2.224 2.432 . 0 0 "[ . 1 . 2]" 1
843 1 53 ALA MB 1 54 VAL QG 3.500 . 3.800 2.829 2.692 2.972 . 0 0 "[ . 1 . 2]" 1
844 1 53 ALA MB 1 55 ASP H 4.500 . 5.000 4.398 4.348 4.454 . 0 0 "[ . 1 . 2]" 1
845 1 53 ALA MB 1 84 ALA H 4.500 . 5.000 4.754 4.471 5.000 . 0 0 "[ . 1 . 2]" 1
846 1 53 ALA MB 1 84 ALA MB 3.500 . 3.800 2.804 2.595 3.113 . 0 0 "[ . 1 . 2]" 1
847 1 54 VAL H 1 54 VAL HB 3.500 . 3.800 3.638 3.605 3.661 . 0 0 "[ . 1 . 2]" 1
848 1 54 VAL H 1 54 VAL QG 2.700 . 3.000 1.843 1.796 1.882 0.004 17 0 "[ . 1 . 2]" 1
849 1 54 VAL H 1 55 ASP H 3.500 . 3.800 2.714 2.662 2.790 . 0 0 "[ . 1 . 2]" 1
850 1 54 VAL H 1 55 ASP QB . . 5.000 4.436 4.385 4.515 . 0 0 "[ . 1 . 2]" 1
851 1 54 VAL H 1 56 LYS H 4.500 . 5.000 4.310 4.122 4.410 . 0 0 "[ . 1 . 2]" 1
852 1 54 VAL H 1 56 LYS QB 4.500 . 5.000 5.268 5.045 5.397 0.397 9 0 "[ . 1 . 2]" 1
853 1 54 VAL H 1 84 ALA HA 4.500 . 5.000 6.132 5.856 6.482 1.482 5 20 [****+**-************] 1
854 1 54 VAL H 1 84 ALA MB 4.500 . 5.000 4.035 3.719 4.246 . 0 0 "[ . 1 . 2]" 1
855 1 54 VAL HA 1 56 LYS H 4.500 . 5.000 4.326 4.038 4.485 . 0 0 "[ . 1 . 2]" 1
856 1 54 VAL HA 1 57 VAL H 4.500 . 5.000 3.348 3.029 3.572 . 0 0 "[ . 1 . 2]" 1
857 1 54 VAL HA 1 58 MET H 4.500 . 5.000 3.523 3.284 3.721 . 0 0 "[ . 1 . 2]" 1
858 1 54 VAL HB 1 55 ASP H 3.500 . 3.800 3.868 3.823 3.933 0.133 18 0 "[ . 1 . 2]" 1
859 1 54 VAL HB 1 55 ASP QB 4.500 . 5.000 5.089 4.984 5.119 0.119 3 0 "[ . 1 . 2]" 1
860 1 54 VAL HB 1 58 MET QG 4.500 . 5.000 3.060 2.679 3.390 . 0 0 "[ . 1 . 2]" 1
861 1 54 VAL QG 1 55 ASP H 3.500 . 3.800 2.302 2.240 2.357 . 0 0 "[ . 1 . 2]" 1
862 1 54 VAL QG 1 55 ASP HA 4.500 . 5.000 3.379 3.303 3.473 . 0 0 "[ . 1 . 2]" 1
863 1 54 VAL QG 1 56 LYS H 5.200 . 5.700 4.273 4.170 4.324 . 0 0 "[ . 1 . 2]" 1
864 1 54 VAL QG 1 58 MET QG 3.500 . 3.800 3.579 3.265 3.834 0.034 19 0 "[ . 1 . 2]" 1
865 1 54 VAL QG 1 84 ALA H 4.500 . 5.000 5.046 4.477 5.547 0.547 18 1 "[ . 1 . + 2]" 1
866 1 54 VAL QG 1 84 ALA HA 4.500 . 5.000 4.749 4.414 5.112 0.112 18 0 "[ . 1 . 2]" 1
867 1 54 VAL QG 1 84 ALA MB 3.500 . 3.800 2.659 2.309 2.993 . 0 0 "[ . 1 . 2]" 1
868 1 55 ASP H 1 55 ASP QB 3.500 . 3.800 2.196 2.177 2.231 . 0 0 "[ . 1 . 2]" 1
869 1 55 ASP H 1 56 LYS H 3.500 . 3.800 2.636 2.500 2.700 . 0 0 "[ . 1 . 2]" 1
870 1 55 ASP H 1 56 LYS QB 4.500 . 5.000 4.449 4.225 4.567 . 0 0 "[ . 1 . 2]" 1
871 1 55 ASP H 1 56 LYS QD 5.200 . 5.700 4.108 3.837 4.721 . 0 0 "[ . 1 . 2]" 1
872 1 55 ASP HA 1 56 LYS H 3.500 . 3.800 3.554 3.480 3.567 . 0 0 "[ . 1 . 2]" 1
873 1 55 ASP HA 1 57 VAL H 4.500 . 5.000 4.428 4.148 4.589 . 0 0 "[ . 1 . 2]" 1
874 1 55 ASP HA 1 58 MET H 4.500 . 5.000 3.852 3.603 3.963 . 0 0 "[ . 1 . 2]" 1
875 1 55 ASP HA 1 58 MET HB3 4.500 . 5.000 5.081 4.615 5.428 0.428 20 0 "[ . 1 . 2]" 1
876 1 55 ASP HA 1 59 LYS H 4.500 . 5.000 4.128 3.886 4.302 . 0 0 "[ . 1 . 2]" 1
877 1 55 ASP QB 1 56 LYS H . . 3.800 2.578 2.426 2.892 . 0 0 "[ . 1 . 2]" 1
878 1 55 ASP QB 1 56 LYS QB 4.500 . 5.000 4.137 4.010 4.228 . 0 0 "[ . 1 . 2]" 1
879 1 55 ASP QB 1 57 VAL H 5.200 . 5.700 4.677 4.486 4.910 . 0 0 "[ . 1 . 2]" 1
880 1 56 LYS H 1 56 LYS QB 2.700 . 3.000 2.154 2.095 2.215 . 0 0 "[ . 1 . 2]" 1
881 1 56 LYS H 1 56 LYS QG 4.500 . 5.000 3.657 3.590 3.837 . 0 0 "[ . 1 . 2]" 1
882 1 56 LYS H 1 57 VAL H 3.500 . 3.800 2.517 2.359 2.578 . 0 0 "[ . 1 . 2]" 1
883 1 56 LYS H 1 57 VAL HA 5.200 . 5.700 5.209 5.063 5.260 . 0 0 "[ . 1 . 2]" 1
884 1 56 LYS H 1 57 VAL HB 5.200 . 5.700 4.713 4.572 4.735 . 0 0 "[ . 1 . 2]" 1
885 1 56 LYS H 1 57 VAL QG 4.500 . 5.000 4.024 3.836 4.111 . 0 0 "[ . 1 . 2]" 1
886 1 56 LYS H 1 58 MET H 4.500 . 5.000 4.233 4.039 4.335 . 0 0 "[ . 1 . 2]" 1
887 1 56 LYS H 1 59 LYS H 5.200 . 5.700 4.960 4.823 5.111 . 0 0 "[ . 1 . 2]" 1
888 1 56 LYS HA 1 56 LYS QG 3.500 . 3.800 2.303 2.173 2.593 . 0 0 "[ . 1 . 2]" 1
889 1 56 LYS QB 1 57 VAL H 3.500 . 3.800 2.835 2.622 2.969 . 0 0 "[ . 1 . 2]" 1
890 1 56 LYS QB 1 57 VAL HB 4.500 . 5.000 4.692 4.434 4.832 . 0 0 "[ . 1 . 2]" 1
891 1 56 LYS QB 1 58 MET H 4.500 . 5.000 4.916 4.783 5.024 0.024 17 0 "[ . 1 . 2]" 1
892 1 56 LYS QG 1 57 VAL H 4.500 . 5.000 4.645 4.466 4.713 . 0 0 "[ . 1 . 2]" 1
893 1 57 VAL H 1 57 VAL HB 3.500 . 3.800 2.434 2.386 2.459 . 0 0 "[ . 1 . 2]" 1
894 1 57 VAL H 1 57 VAL QG 3.500 . 3.800 2.412 2.284 2.509 . 0 0 "[ . 1 . 2]" 1
895 1 57 VAL H 1 58 MET H 3.500 . 3.800 2.558 2.412 2.672 . 0 0 "[ . 1 . 2]" 1
896 1 57 VAL H 1 58 MET QG 4.500 . 5.000 4.379 4.206 4.513 . 0 0 "[ . 1 . 2]" 1
897 1 57 VAL H 1 59 LYS H 4.500 . 5.000 4.050 3.764 4.320 . 0 0 "[ . 1 . 2]" 1
898 1 57 VAL H 1 59 LYS HG2 5.200 . 5.700 4.443 4.420 4.461 . 0 0 "[ . 1 . 2]" 1
899 1 57 VAL HA 1 59 LYS H 4.500 . 5.000 4.444 4.351 4.623 . 0 0 "[ . 1 . 2]" 1
900 1 57 VAL HA 1 60 GLU H 4.500 . 5.000 3.189 3.072 3.356 . 0 0 "[ . 1 . 2]" 1
901 1 57 VAL HA 1 60 GLU HA 5.200 . 5.700 5.086 4.899 5.346 . 0 0 "[ . 1 . 2]" 1
902 1 57 VAL HA 1 60 GLU HB2 4.500 . 5.000 3.140 2.841 3.412 . 0 0 "[ . 1 . 2]" 1
903 1 57 VAL HA 1 60 GLU HB3 3.500 . 3.800 2.436 2.226 2.845 . 0 0 "[ . 1 . 2]" 1
904 1 57 VAL HA 1 60 GLU QG 4.500 . 5.000 4.100 3.889 4.476 . 0 0 "[ . 1 . 2]" 1
905 1 57 VAL HA 1 61 LEU H 4.500 . 5.000 3.849 3.784 3.961 . 0 0 "[ . 1 . 2]" 1
906 1 57 VAL HA 1 61 LEU QB 4.500 . 5.000 4.537 4.438 4.557 . 0 0 "[ . 1 . 2]" 1
907 1 57 VAL QG 1 58 MET H 4.500 . 5.000 3.250 3.167 3.364 . 0 0 "[ . 1 . 2]" 1
908 1 57 VAL QG 1 58 MET ME 3.500 . 3.800 3.670 2.128 5.444 1.644 16 8 "[ *-** 1 .+***2]" 1
909 1 57 VAL QG 1 58 MET QG 4.500 . 5.000 3.541 3.435 3.721 . 0 0 "[ . 1 . 2]" 1
910 1 57 VAL QG 1 60 GLU HB3 4.500 . 5.000 3.350 3.155 3.639 . 0 0 "[ . 1 . 2]" 1
911 1 57 VAL QG 1 61 LEU QB 3.500 . 3.800 3.228 3.158 3.297 . 0 0 "[ . 1 . 2]" 1
912 1 58 MET H 1 58 MET QG 3.500 . 3.800 2.362 2.260 2.499 . 0 0 "[ . 1 . 2]" 1
913 1 58 MET H 1 59 LYS H 3.500 . 3.800 2.664 2.594 2.723 . 0 0 "[ . 1 . 2]" 1
914 1 58 MET H 1 59 LYS HG2 5.200 . 5.700 4.462 4.069 4.791 . 0 0 "[ . 1 . 2]" 1
915 1 58 MET H 1 59 LYS HG3 5.200 . 5.700 5.393 4.958 5.501 . 0 0 "[ . 1 . 2]" 1
916 1 58 MET H 1 60 GLU H 4.500 . 5.000 3.891 3.824 3.966 . 0 0 "[ . 1 . 2]" 1
917 1 58 MET H 1 60 GLU HB3 5.200 . 5.700 5.118 4.954 5.496 . 0 0 "[ . 1 . 2]" 1
918 1 58 MET H 1 61 LEU QB 5.200 . 5.700 4.927 4.739 5.101 . 0 0 "[ . 1 . 2]" 1
919 1 58 MET HA 1 58 MET ME 3.500 . 3.800 3.372 2.146 4.089 0.289 6 0 "[ . 1 . 2]" 1
920 1 58 MET HA 1 58 MET QG 3.500 . 3.800 2.643 2.143 2.875 . 0 0 "[ . 1 . 2]" 1
921 1 58 MET HB2 1 59 LYS H 3.500 . 3.800 2.732 2.591 2.807 . 0 0 "[ . 1 . 2]" 1
922 1 58 MET HB2 1 59 LYS HB3 4.500 . 5.000 4.380 4.274 4.446 . 0 0 "[ . 1 . 2]" 1
923 1 58 MET QG 1 59 LYS H 4.500 . 5.000 4.184 4.114 4.271 . 0 0 "[ . 1 . 2]" 1
924 1 58 MET QG 1 60 GLU H 5.200 . 5.700 5.509 5.352 5.545 . 0 0 "[ . 1 . 2]" 1
925 1 59 LYS H 1 59 LYS HB3 2.700 . 3.000 2.528 2.444 2.671 . 0 0 "[ . 1 . 2]" 1
926 1 59 LYS H 1 59 LYS HG2 4.500 . 5.000 2.501 2.080 2.839 . 0 0 "[ . 1 . 2]" 1
927 1 59 LYS H 1 59 LYS HG3 3.500 . 3.800 3.262 2.921 3.352 . 0 0 "[ . 1 . 2]" 1
928 1 59 LYS H 1 60 GLU H 3.500 . 3.800 2.582 2.475 2.651 . 0 0 "[ . 1 . 2]" 1
929 1 59 LYS H 1 61 LEU H 4.500 . 5.000 4.286 4.175 4.450 . 0 0 "[ . 1 . 2]" 1
930 1 59 LYS H 1 62 ASP H 4.500 . 5.000 4.712 4.543 4.883 . 0 0 "[ . 1 . 2]" 1
931 1 59 LYS HA 1 62 ASP H 3.500 . 3.800 3.162 2.877 3.477 . 0 0 "[ . 1 . 2]" 1
932 1 59 LYS HA 1 62 ASP QB 3.500 . 3.800 2.382 2.039 2.615 . 0 0 "[ . 1 . 2]" 1
933 1 59 LYS HB2 1 60 GLU H 4.500 . 5.000 4.158 4.043 4.270 . 0 0 "[ . 1 . 2]" 1
934 1 59 LYS HB2 1 63 GLU H 5.200 . 5.700 5.198 4.831 5.466 . 0 0 "[ . 1 . 2]" 1
935 1 59 LYS QE 1 59 LYS HG2 3.500 . 3.800 2.994 2.322 3.617 . 0 0 "[ . 1 . 2]" 1
936 1 59 LYS HG2 1 60 GLU H 4.500 . 5.000 3.181 2.894 3.645 . 0 0 "[ . 1 . 2]" 1
937 1 59 LYS HG3 1 60 GLU H 4.500 . 5.000 2.612 2.360 2.744 . 0 0 "[ . 1 . 2]" 1
938 1 59 LYS HG3 1 60 GLU HA 3.500 . 3.800 3.229 3.075 3.461 . 0 0 "[ . 1 . 2]" 1
939 1 59 LYS HG3 1 60 GLU HB3 4.500 . 5.000 4.400 4.147 4.583 . 0 0 "[ . 1 . 2]" 1
940 1 60 GLU H 1 60 GLU HB2 3.500 . 3.800 2.693 2.418 2.849 . 0 0 "[ . 1 . 2]" 1
941 1 60 GLU H 1 60 GLU HB3 3.500 . 3.800 2.444 2.318 2.692 . 0 0 "[ . 1 . 2]" 1
942 1 60 GLU H 1 61 LEU H 3.500 . 3.800 2.418 2.286 2.557 . 0 0 "[ . 1 . 2]" 1
943 1 60 GLU H 1 62 ASP QB 4.500 . 5.000 4.695 4.659 4.719 . 0 0 "[ . 1 . 2]" 1
944 1 60 GLU H 1 63 GLU H 5.200 . 5.700 4.888 4.771 4.954 . 0 0 "[ . 1 . 2]" 1
945 1 60 GLU HA 1 60 GLU QG 3.500 . 3.800 2.475 2.214 2.603 . 0 0 "[ . 1 . 2]" 1
946 1 60 GLU HA 1 64 ASN QD 4.500 . 5.000 2.756 2.634 2.929 . 0 0 "[ . 1 . 2]" 1
947 1 60 GLU HB3 1 61 LEU H 3.500 . 3.800 2.419 2.348 2.552 . 0 0 "[ . 1 . 2]" 1
948 1 60 GLU QG 1 61 LEU QB 4.500 . 5.000 4.981 4.874 5.133 0.133 8 0 "[ . 1 . 2]" 1
949 1 60 GLU QG 1 64 ASN HB3 5.200 . 5.700 4.460 4.276 4.529 . 0 0 "[ . 1 . 2]" 1
950 1 60 GLU QG 1 64 ASN QD 3.500 . 3.800 2.182 2.010 2.387 . 0 0 "[ . 1 . 2]" 1
951 1 61 LEU H 1 61 LEU QB 3.500 . 3.800 2.000 1.951 2.066 . 0 0 "[ . 1 . 2]" 1
952 1 61 LEU H 1 61 LEU MD2 4.500 . 5.000 3.572 3.448 3.743 . 0 0 "[ . 1 . 2]" 1
953 1 61 LEU H 1 62 ASP HA 5.200 . 5.700 5.300 5.269 5.313 . 0 0 "[ . 1 . 2]" 1
954 1 61 LEU H 1 62 ASP QB 4.500 . 5.000 4.513 4.395 4.601 . 0 0 "[ . 1 . 2]" 1
955 1 61 LEU H 1 63 GLU H 4.500 . 5.000 4.347 4.244 4.411 . 0 0 "[ . 1 . 2]" 1
956 1 61 LEU H 1 63 GLU QG 4.500 . 5.000 5.556 4.679 5.874 0.874 9 16 "[******* +** **- ***2]" 1
957 1 61 LEU H 1 64 ASN HB2 5.200 . 5.700 4.827 4.737 4.874 . 0 0 "[ . 1 . 2]" 1
958 1 61 LEU HA 1 61 LEU MD2 3.500 . 3.800 2.058 2.025 2.098 . 0 0 "[ . 1 . 2]" 1
959 1 61 LEU HA 1 62 ASP QB 5.200 . 5.700 5.272 5.166 5.348 . 0 0 "[ . 1 . 2]" 1
960 1 61 LEU HA 1 64 ASN HA 5.200 . 5.700 5.384 5.312 5.467 . 0 0 "[ . 1 . 2]" 1
961 1 61 LEU HA 1 64 ASN HB3 4.500 . 5.000 4.371 4.246 4.402 . 0 0 "[ . 1 . 2]" 1
962 1 61 LEU QB 1 62 ASP H . . 3.800 2.783 2.672 2.881 . 0 0 "[ . 1 . 2]" 1
963 1 61 LEU QB 1 63 GLU H 5.200 . 5.700 4.816 4.744 4.888 . 0 0 "[ . 1 . 2]" 1
964 1 61 LEU MD1 1 62 ASP H 4.500 . 5.000 4.064 3.884 4.194 . 0 0 "[ . 1 . 2]" 1
965 1 61 LEU MD1 1 63 GLU H 4.500 . 5.000 5.218 5.095 5.306 0.306 15 0 "[ . 1 . 2]" 1
966 1 61 LEU MD1 1 64 ASN H 4.500 . 5.000 4.489 4.322 4.678 . 0 0 "[ . 1 . 2]" 1
967 1 61 LEU MD1 1 64 ASN HB3 4.500 . 5.000 5.225 5.085 5.398 0.398 12 0 "[ . 1 . 2]" 1
968 1 61 LEU MD1 1 65 GLY H 5.200 . 5.700 3.714 3.392 3.989 . 0 0 "[ . 1 . 2]" 1
969 1 61 LEU MD2 1 64 ASN H 5.200 . 5.700 4.842 4.791 4.904 . 0 0 "[ . 1 . 2]" 1
970 1 61 LEU MD2 1 64 ASN HB2 4.500 . 5.000 3.912 3.854 3.990 . 0 0 "[ . 1 . 2]" 1
971 1 61 LEU MD2 1 64 ASN HB3 4.500 . 5.000 4.605 4.589 4.628 . 0 0 "[ . 1 . 2]" 1
972 1 61 LEU MD2 1 65 GLY QA 4.500 . 5.000 3.705 3.536 3.819 . 0 0 "[ . 1 . 2]" 1
973 1 61 LEU HG 1 65 GLY QA 5.200 . 5.700 5.171 4.932 5.307 . 0 0 "[ . 1 . 2]" 1
974 1 62 ASP H 1 62 ASP QB 2.700 . 3.000 2.173 2.078 2.282 . 0 0 "[ . 1 . 2]" 1
975 1 62 ASP H 1 63 GLU H 3.500 . 3.800 2.689 2.608 2.769 . 0 0 "[ . 1 . 2]" 1
976 1 62 ASP HA 1 63 GLU H 3.500 . 3.800 3.568 3.538 3.580 . 0 0 "[ . 1 . 2]" 1
977 1 62 ASP HA 1 64 ASN H 4.500 . 5.000 4.369 4.169 4.395 . 0 0 "[ . 1 . 2]" 1
978 1 62 ASP HA 1 65 GLY H 4.500 . 5.000 3.955 3.759 4.099 . 0 0 "[ . 1 . 2]" 1
979 1 62 ASP QB 1 63 GLU H 3.500 . 3.800 2.758 2.617 2.866 . 0 0 "[ . 1 . 2]" 1
980 1 63 GLU H 1 63 GLU QB 3.500 . 3.800 2.426 2.333 2.701 . 0 0 "[ . 1 . 2]" 1
981 1 63 GLU H 1 63 GLU QG 3.500 . 3.800 2.282 2.076 2.611 . 0 0 "[ . 1 . 2]" 1
982 1 63 GLU H 1 64 ASN H 3.500 . 3.800 2.287 2.244 2.342 . 0 0 "[ . 1 . 2]" 1
983 1 63 GLU H 1 64 ASN HA 5.200 . 5.700 5.025 5.015 5.037 . 0 0 "[ . 1 . 2]" 1
984 1 63 GLU H 1 64 ASN HB2 4.500 . 5.000 4.348 4.260 4.437 . 0 0 "[ . 1 . 2]" 1
985 1 63 GLU H 1 65 GLY H 4.500 . 5.000 3.973 3.859 4.032 . 0 0 "[ . 1 . 2]" 1
986 1 63 GLU HA 1 64 ASN H 3.500 . 3.800 3.468 3.408 3.520 . 0 0 "[ . 1 . 2]" 1
987 1 63 GLU QB 1 64 ASN QD 4.500 . 5.000 2.574 2.289 3.717 . 0 0 "[ . 1 . 2]" 1
988 1 63 GLU QB 1 65 GLY H 5.200 . 5.700 4.616 4.458 5.093 . 0 0 "[ . 1 . 2]" 1
989 1 63 GLU QG 1 64 ASN H 4.500 . 5.000 3.844 2.855 4.176 . 0 0 "[ . 1 . 2]" 1
990 1 63 GLU QG 1 64 ASN QD 4.500 . 5.000 3.880 1.936 4.162 . 0 0 "[ . 1 . 2]" 1
991 1 64 ASN H 1 64 ASN HB2 3.500 . 3.800 2.385 2.304 2.462 . 0 0 "[ . 1 . 2]" 1
992 1 64 ASN H 1 64 ASN HB3 3.500 . 3.800 3.644 3.598 3.685 . 0 0 "[ . 1 . 2]" 1
993 1 64 ASN H 1 64 ASN QD . . 5.000 2.642 2.542 2.809 . 0 0 "[ . 1 . 2]" 1
994 1 64 ASN H 1 66 ASP H 5.200 . 5.700 4.850 4.672 5.069 . 0 0 "[ . 1 . 2]" 1
995 1 64 ASN HA 1 65 GLY H 3.500 . 3.800 3.207 3.145 3.251 . 0 0 "[ . 1 . 2]" 1
996 1 64 ASN HA 1 65 GLY QA 5.200 . 5.700 4.415 4.405 4.435 . 0 0 "[ . 1 . 2]" 1
997 1 64 ASN HA 1 66 ASP H 3.500 . 3.800 3.630 3.503 3.712 . 0 0 "[ . 1 . 2]" 1
998 1 64 ASN HA 1 67 GLY H 4.500 . 5.000 3.759 3.640 3.989 . 0 0 "[ . 1 . 2]" 1
999 1 64 ASN HB2 1 65 GLY H 4.500 . 5.000 3.729 3.613 3.801 . 0 0 "[ . 1 . 2]" 1
1000 1 64 ASN HB3 1 65 GLY H 4.500 . 5.000 4.258 4.195 4.287 . 0 0 "[ . 1 . 2]" 1
1001 1 65 GLY H 1 66 ASP H 3.500 . 3.800 2.815 2.715 2.946 . 0 0 "[ . 1 . 2]" 1
1002 1 65 GLY H 1 67 GLY H 4.500 . 5.000 4.226 4.193 4.233 . 0 0 "[ . 1 . 2]" 1
1003 1 65 GLY QA 1 66 ASP H 3.500 . 3.800 2.816 2.800 2.848 . 0 0 "[ . 1 . 2]" 1
1004 1 65 GLY QA 1 69 VAL QG 4.500 . 5.000 4.926 4.783 5.123 0.123 11 0 "[ . 1 . 2]" 1
1005 1 66 ASP H 1 66 ASP QB 3.500 . 3.800 2.195 2.080 2.277 . 0 0 "[ . 1 . 2]" 1
1006 1 66 ASP H 1 67 GLY QA 4.500 . 5.000 4.380 4.363 4.394 . 0 0 "[ . 1 . 2]" 1
1007 1 66 ASP QB 1 67 GLY H 3.500 . 3.800 3.492 3.292 3.568 . 0 0 "[ . 1 . 2]" 1
1008 1 66 ASP QB 1 67 GLY QA 4.500 . 5.000 3.938 3.848 4.020 . 0 0 "[ . 1 . 2]" 1
1009 1 67 GLY H 1 68 GLU H 4.500 . 5.000 4.231 4.203 4.264 . 0 0 "[ . 1 . 2]" 1
1010 1 67 GLY QA 1 68 GLU H 2.700 . 3.000 2.180 2.151 2.215 . 0 0 "[ . 1 . 2]" 1
1011 1 67 GLY QA 1 68 GLU QB 4.500 . 5.000 3.690 3.600 3.753 . 0 0 "[ . 1 . 2]" 1
1012 1 67 GLY QA 1 68 GLU QG 4.500 . 5.000 3.640 3.481 3.751 . 0 0 "[ . 1 . 2]" 1
1013 1 67 GLY HA2 1 68 GLU H 3.500 . 3.800 2.666 2.478 2.839 . 0 0 "[ . 1 . 2]" 1
1014 1 67 GLY HA2 1 68 GLU QB 4.500 . 5.000 3.894 3.765 3.988 . 0 0 "[ . 1 . 2]" 1
1015 1 67 GLY HA3 1 68 GLU H 3.500 . 3.800 2.321 2.247 2.398 . 0 0 "[ . 1 . 2]" 1
1016 1 67 GLY HA3 1 68 GLU QB 4.500 . 5.000 4.576 4.557 4.611 . 0 0 "[ . 1 . 2]" 1
1017 1 68 GLU H 1 68 GLU QB 3.500 . 3.800 2.933 2.793 3.061 . 0 0 "[ . 1 . 2]" 1
1018 1 68 GLU H 1 68 GLU QG 3.500 . 3.800 2.305 2.147 2.478 . 0 0 "[ . 1 . 2]" 1
1019 1 68 GLU H 1 69 VAL H 4.500 . 5.000 4.468 4.391 4.489 . 0 0 "[ . 1 . 2]" 1
1020 1 68 GLU H 1 69 VAL HA 5.200 . 5.700 5.137 5.001 5.243 . 0 0 "[ . 1 . 2]" 1
1021 1 68 GLU H 1 69 VAL QG 4.500 . 5.000 3.875 3.641 4.053 . 0 0 "[ . 1 . 2]" 1
1022 1 68 GLU HA 1 69 VAL H 3.500 . 3.800 2.183 2.138 2.275 . 0 0 "[ . 1 . 2]" 1
1023 1 68 GLU HA 1 69 VAL QG 4.500 . 5.000 3.051 2.885 3.210 . 0 0 "[ . 1 . 2]" 1
1024 1 68 GLU QB 1 69 VAL H 3.500 . 3.800 2.698 2.365 2.880 . 0 0 "[ . 1 . 2]" 1
1025 1 68 GLU QB 1 69 VAL HA 4.500 . 5.000 4.379 4.237 4.494 . 0 0 "[ . 1 . 2]" 1
1026 1 68 GLU QB 1 69 VAL QG 4.500 . 5.000 3.957 3.786 4.075 . 0 0 "[ . 1 . 2]" 1
1027 1 68 GLU QG 1 69 VAL H 4.500 . 5.000 3.839 3.473 4.086 . 0 0 "[ . 1 . 2]" 1
1028 1 69 VAL H 1 70 ASP H 4.500 . 5.000 4.431 4.405 4.491 . 0 0 "[ . 1 . 2]" 1
1029 1 69 VAL H 1 70 ASP HB3 5.200 . 5.700 5.502 5.437 5.513 . 0 0 "[ . 1 . 2]" 1
1030 1 69 VAL HA 1 70 ASP H 3.500 . 3.800 2.618 2.380 2.730 . 0 0 "[ . 1 . 2]" 1
1031 1 69 VAL HA 1 73 GLU H 5.200 . 5.700 5.381 4.981 5.649 . 0 0 "[ . 1 . 2]" 1
1032 1 69 VAL HB 1 73 GLU H 4.500 . 5.000 4.151 4.080 4.337 . 0 0 "[ . 1 . 2]" 1
1033 1 69 VAL HB 1 73 GLU HG3 3.500 . 3.800 3.315 2.743 4.631 0.831 12 2 "[ . 1-+ . 2]" 1
1034 1 69 VAL QG 1 70 ASP H 3.500 . 3.800 3.006 2.957 3.152 . 0 0 "[ . 1 . 2]" 1
1035 1 69 VAL QG 1 73 GLU H 4.500 . 5.000 4.526 4.456 4.715 . 0 0 "[ . 1 . 2]" 1
1036 1 69 VAL QG 1 73 GLU QB 3.500 . 3.800 2.484 2.344 2.873 . 0 0 "[ . 1 . 2]" 1
1037 1 69 VAL QG 1 73 GLU HG3 3.500 . 3.800 2.501 2.120 3.926 0.126 12 0 "[ . 1 . 2]" 1
1038 1 70 ASP H 1 70 ASP HB3 3.500 . 3.800 2.915 2.798 2.966 . 0 0 "[ . 1 . 2]" 1
1039 1 70 ASP H 1 71 PHE H 4.500 . 5.000 4.407 4.325 4.440 . 0 0 "[ . 1 . 2]" 1
1040 1 70 ASP H 1 73 GLU HA 5.200 . 5.700 4.796 4.758 4.817 . 0 0 "[ . 1 . 2]" 1
1041 1 70 ASP H 1 73 GLU QB 3.500 . 3.800 2.032 1.856 2.309 . 0 0 "[ . 1 . 2]" 1
1042 1 70 ASP HA 1 72 GLN H 4.500 . 5.000 4.621 4.566 4.673 . 0 0 "[ . 1 . 2]" 1
1043 1 70 ASP HB2 1 71 PHE H 3.500 . 3.800 2.265 2.178 2.446 . 0 0 "[ . 1 . 2]" 1
1044 1 70 ASP HB3 1 73 GLU H 5.200 . 5.700 4.484 4.366 4.573 . 0 0 "[ . 1 . 2]" 1
1045 1 71 PHE H 1 71 PHE HB3 3.500 . 3.800 2.509 2.475 2.537 . 0 0 "[ . 1 . 2]" 1
1046 1 71 PHE H 1 72 GLN H 3.500 . 3.800 2.809 2.768 2.828 . 0 0 "[ . 1 . 2]" 1
1047 1 71 PHE H 1 72 GLN QB 4.500 . 5.000 4.555 4.506 4.597 . 0 0 "[ . 1 . 2]" 1
1048 1 71 PHE H 1 73 GLU H 4.500 . 5.000 4.371 4.277 4.437 . 0 0 "[ . 1 . 2]" 1
1049 1 71 PHE H 2 83 VAL MG1 4.500 . 5.000 3.846 3.636 4.120 . 0 0 "[ . 1 . 2]" 1
1050 1 71 PHE H 2 87 ASN QD 4.500 . 5.000 4.734 3.307 5.941 0.941 17 2 "[- . 1 . + 2]" 1
1051 1 71 PHE HA 1 72 GLN HA 5.200 . 5.700 4.766 4.745 4.799 . 0 0 "[ . 1 . 2]" 1
1052 1 71 PHE HA 2 83 VAL MG1 5.200 . 5.700 5.042 4.826 5.294 . 0 0 "[ . 1 . 2]" 1
1053 1 71 PHE HB3 1 72 GLN H 3.500 . 3.800 2.653 2.595 2.742 . 0 0 "[ . 1 . 2]" 1
1054 1 71 PHE HB3 1 73 GLU H 5.200 . 5.700 5.074 4.961 5.142 . 0 0 "[ . 1 . 2]" 1
1055 1 71 PHE QD 1 72 GLN H 4.500 . 5.000 3.369 3.255 3.467 . 0 0 "[ . 1 . 2]" 1
1056 1 71 PHE QD 1 74 TYR H 5.200 . 5.700 5.085 5.002 5.126 . 0 0 "[ . 1 . 2]" 1
1057 1 71 PHE QD 1 75 VAL H 4.500 . 5.000 4.450 4.360 4.640 . 0 0 "[ . 1 . 2]" 1
1058 1 71 PHE QD 1 75 VAL QG 4.500 . 5.000 3.539 3.084 3.697 . 0 0 "[ . 1 . 2]" 1
1059 1 71 PHE QD 2 83 VAL MG1 3.500 . 3.800 2.901 2.743 3.069 . 0 0 "[ . 1 . 2]" 1
1060 1 71 PHE QD 2 83 VAL MG2 5.200 . 5.700 4.982 4.840 5.094 . 0 0 "[ . 1 . 2]" 1
1061 1 71 PHE QE 1 75 VAL QG 4.500 . 5.000 2.779 2.321 3.096 . 0 0 "[ . 1 . 2]" 1
1062 1 71 PHE QE 2 79 ALA H 5.200 . 5.700 5.080 4.859 5.408 . 0 0 "[ . 1 . 2]" 1
1063 1 71 PHE QE 2 79 ALA HA 4.500 . 5.000 3.020 2.847 3.163 . 0 0 "[ . 1 . 2]" 1
1064 1 71 PHE QE 2 79 ALA MB 4.500 . 5.000 2.518 2.359 2.853 . 0 0 "[ . 1 . 2]" 1
1065 1 71 PHE QE 2 82 THR MG 3.500 . 3.800 2.940 2.631 3.192 . 0 0 "[ . 1 . 2]" 1
1066 1 71 PHE QE 2 83 VAL MG1 4.500 . 5.000 4.485 4.353 4.638 . 0 0 "[ . 1 . 2]" 1
1067 1 72 GLN H 1 72 GLN QB 2.700 . 3.000 2.203 2.176 2.239 . 0 0 "[ . 1 . 2]" 1
1068 1 72 GLN H 1 72 GLN QE 5.200 . 5.700 4.547 4.298 4.772 . 0 0 "[ . 1 . 2]" 1
1069 1 72 GLN H 1 73 GLU HA 5.200 . 5.700 5.279 5.205 5.339 . 0 0 "[ . 1 . 2]" 1
1070 1 72 GLN H 1 75 VAL HB 5.200 . 5.700 5.320 4.716 5.510 . 0 0 "[ . 1 . 2]" 1
1071 1 72 GLN H 1 75 VAL QG 4.500 . 5.000 4.657 4.606 4.784 . 0 0 "[ . 1 . 2]" 1
1072 1 72 GLN H 2 79 ALA MB 4.500 . 5.000 4.497 4.389 4.645 . 0 0 "[ . 1 . 2]" 1
1073 1 72 GLN H 2 83 VAL MG1 3.500 . 3.800 2.828 2.664 3.004 . 0 0 "[ . 1 . 2]" 1
1074 1 72 GLN HA 1 72 GLN QE . . 5.000 3.967 3.942 3.998 . 0 0 "[ . 1 . 2]" 1
1075 1 72 GLN HA 1 72 GLN HG3 3.500 . 3.800 2.392 2.345 2.453 . 0 0 "[ . 1 . 2]" 1
1076 1 72 GLN HA 1 75 VAL QG 3.500 . 3.800 2.450 2.175 3.064 . 0 0 "[ . 1 . 2]" 1
1077 1 72 GLN HA 2 83 VAL MG1 4.500 . 5.000 3.616 3.448 3.724 . 0 0 "[ . 1 . 2]" 1
1078 1 72 GLN QB 1 72 GLN QE 3.500 . 3.800 2.376 2.135 2.632 . 0 0 "[ . 1 . 2]" 1
1079 1 72 GLN QB 1 73 GLU H 3.500 . 3.800 2.611 2.518 2.668 . 0 0 "[ . 1 . 2]" 1
1080 1 72 GLN QB 2 79 ALA MB 4.500 . 5.000 3.391 3.292 3.543 . 0 0 "[ . 1 . 2]" 1
1081 1 72 GLN QB 2 83 VAL MG1 3.500 . 3.800 2.019 1.934 2.081 . 0 0 "[ . 1 . 2]" 1
1082 1 72 GLN QB 2 83 VAL MG2 4.500 . 5.000 3.459 3.245 3.579 . 0 0 "[ . 1 . 2]" 1
1083 1 72 GLN QE 2 76 VAL QG 4.500 . 5.000 3.625 3.370 3.820 . 0 0 "[ . 1 . 2]" 1
1084 1 72 GLN QE 2 79 ALA MB 4.500 . 5.000 3.223 3.062 3.517 . 0 0 "[ . 1 . 2]" 1
1085 1 72 GLN QE 2 80 ALA H . . 5.000 3.792 3.585 3.979 . 0 0 "[ . 1 . 2]" 1
1086 1 72 GLN QE 2 80 ALA HA . . 3.800 2.225 2.114 2.343 . 0 0 "[ . 1 . 2]" 1
1087 1 72 GLN QE 2 80 ALA MB 3.500 . 3.800 3.153 3.035 3.261 . 0 0 "[ . 1 . 2]" 1
1088 1 72 GLN QE 2 83 VAL HB 4.500 . 5.000 4.135 4.007 4.292 . 0 0 "[ . 1 . 2]" 1
1089 1 72 GLN QE 2 83 VAL MG1 3.500 . 3.800 2.370 2.189 2.541 . 0 0 "[ . 1 . 2]" 1
1090 1 72 GLN QE 2 83 VAL MG2 3.500 . 3.800 2.150 2.035 2.219 . 0 0 "[ . 1 . 2]" 1
1091 1 72 GLN HG2 2 79 ALA MB 5.200 . 5.700 3.525 3.357 3.683 . 0 0 "[ . 1 . 2]" 1
1092 1 72 GLN HG2 2 83 VAL MG1 4.500 . 5.000 4.428 4.394 4.457 . 0 0 "[ . 1 . 2]" 1
1093 1 72 GLN HG3 2 76 VAL QG 3.500 . 3.800 2.940 2.546 3.088 . 0 0 "[ . 1 . 2]" 1
1094 1 72 GLN HG3 2 79 ALA H 5.200 . 5.700 4.715 4.590 4.861 . 0 0 "[ . 1 . 2]" 1
1095 1 72 GLN HG3 2 80 ALA H 4.500 . 5.000 4.327 4.044 4.506 . 0 0 "[ . 1 . 2]" 1
1096 1 72 GLN HG3 2 80 ALA MB 4.500 . 5.000 4.705 4.462 4.799 . 0 0 "[ . 1 . 2]" 1
1097 1 72 GLN HG3 2 83 VAL MG1 4.500 . 5.000 3.531 3.381 3.611 . 0 0 "[ . 1 . 2]" 1
1098 1 73 GLU H 1 73 GLU QB 3.500 . 3.800 2.103 2.033 2.295 . 0 0 "[ . 1 . 2]" 1
1099 1 73 GLU H 1 74 TYR HA 5.200 . 5.700 5.238 5.205 5.275 . 0 0 "[ . 1 . 2]" 1
1100 1 73 GLU H 1 74 TYR HB2 5.200 . 5.700 5.070 5.018 5.076 . 0 0 "[ . 1 . 2]" 1
1101 1 73 GLU H 1 75 VAL QG 4.500 . 5.000 4.713 4.595 5.005 0.005 8 0 "[ . 1 . 2]" 1
1102 1 73 GLU H 1 76 VAL H 5.200 . 5.700 4.950 4.803 5.053 . 0 0 "[ . 1 . 2]" 1
1103 1 73 GLU H 2 83 VAL MG1 5.200 . 5.700 4.752 4.602 4.865 . 0 0 "[ . 1 . 2]" 1
1104 1 73 GLU HA 1 75 VAL H 4.500 . 5.000 4.476 4.299 4.621 . 0 0 "[ . 1 . 2]" 1
1105 1 73 GLU HA 1 76 VAL H 3.500 . 3.800 3.406 3.163 3.652 . 0 0 "[ . 1 . 2]" 1
1106 1 73 GLU HA 1 76 VAL QG 3.500 . 3.800 2.616 2.151 3.145 . 0 0 "[ . 1 . 2]" 1
1107 1 73 GLU QB 1 75 VAL H 5.200 . 5.700 4.852 4.719 4.948 . 0 0 "[ . 1 . 2]" 1
1108 1 73 GLU HB2 1 74 TYR H 4.500 . 5.000 3.373 2.754 3.903 . 0 0 "[ . 1 . 2]" 1
1109 1 73 GLU HB3 1 74 TYR H 4.500 . 5.000 3.151 2.644 3.528 . 0 0 "[ . 1 . 2]" 1
1110 1 74 TYR H 1 74 TYR HB2 3.500 . 3.800 2.639 2.604 2.676 . 0 0 "[ . 1 . 2]" 1
1111 1 74 TYR H 1 74 TYR HB3 3.500 . 3.800 2.489 2.434 2.548 . 0 0 "[ . 1 . 2]" 1
1112 1 74 TYR H 1 74 TYR QD 4.500 . 5.000 4.253 4.234 4.268 . 0 0 "[ . 1 . 2]" 1
1113 1 74 TYR H 1 75 VAL H 3.500 . 3.800 2.633 2.514 2.741 . 0 0 "[ . 1 . 2]" 1
1114 1 74 TYR H 1 75 VAL HB 5.200 . 5.700 4.619 4.140 4.840 . 0 0 "[ . 1 . 2]" 1
1115 1 74 TYR H 1 75 VAL QG 4.500 . 5.000 4.326 4.012 4.464 . 0 0 "[ . 1 . 2]" 1
1116 1 74 TYR H 1 76 VAL H 4.500 . 5.000 4.079 3.980 4.171 . 0 0 "[ . 1 . 2]" 1
1117 1 74 TYR H 1 77 LEU MD1 4.500 . 5.000 4.266 4.238 4.280 . 0 0 "[ . 1 . 2]" 1
1118 1 74 TYR HA 1 76 VAL H 4.500 . 5.000 4.196 4.027 4.367 . 0 0 "[ . 1 . 2]" 1
1119 1 74 TYR HA 1 77 LEU H 4.500 . 5.000 3.315 3.222 3.438 . 0 0 "[ . 1 . 2]" 1
1120 1 74 TYR HA 1 77 LEU HB2 4.500 . 5.000 2.495 2.376 2.655 . 0 0 "[ . 1 . 2]" 1
1121 1 74 TYR HA 1 77 LEU MD1 3.500 . 3.800 2.276 2.122 2.388 . 0 0 "[ . 1 . 2]" 1
1122 1 74 TYR HA 1 78 VAL H 4.500 . 5.000 4.414 4.289 4.567 . 0 0 "[ . 1 . 2]" 1
1123 1 74 TYR HB2 1 75 VAL H 4.500 . 5.000 3.904 3.844 3.958 . 0 0 "[ . 1 . 2]" 1
1124 1 74 TYR HB2 1 77 LEU MD1 4.500 . 5.000 3.980 3.764 4.096 . 0 0 "[ . 1 . 2]" 1
1125 1 74 TYR HB3 1 75 VAL H 3.500 . 3.800 2.579 2.525 2.615 . 0 0 "[ . 1 . 2]" 1
1126 1 74 TYR QD 1 75 VAL H 4.500 . 5.000 3.947 3.824 4.030 . 0 0 "[ . 1 . 2]" 1
1127 1 74 TYR QD 1 77 LEU MD1 4.500 . 5.000 2.933 2.661 3.034 . 0 0 "[ . 1 . 2]" 1
1128 1 74 TYR QD 1 78 VAL MG1 4.500 . 5.000 3.319 3.172 3.417 . 0 0 "[ . 1 . 2]" 1
1129 1 74 TYR QE 1 77 LEU MD1 4.500 . 5.000 4.429 4.250 4.475 . 0 0 "[ . 1 . 2]" 1
1130 1 74 TYR QE 1 78 VAL MG1 4.500 . 5.000 2.742 2.604 2.881 . 0 0 "[ . 1 . 2]" 1
1131 1 75 VAL H 1 75 VAL HB 3.500 . 3.800 2.218 1.956 2.400 . 0 0 "[ . 1 . 2]" 1
1132 1 75 VAL H 1 75 VAL QG . . 3.800 2.617 2.152 2.833 . 0 0 "[ . 1 . 2]" 1
1133 1 75 VAL H 1 76 VAL H 3.500 . 3.800 2.777 2.699 2.864 . 0 0 "[ . 1 . 2]" 1
1134 1 75 VAL H 1 76 VAL QG 4.500 . 5.000 4.269 4.078 4.482 . 0 0 "[ . 1 . 2]" 1
1135 1 75 VAL H 1 77 LEU HB2 5.200 . 5.700 5.018 4.917 5.153 . 0 0 "[ . 1 . 2]" 1
1136 1 75 VAL H 1 78 VAL H 5.200 . 5.700 4.927 4.877 4.980 . 0 0 "[ . 1 . 2]" 1
1137 1 75 VAL H 1 78 VAL MG1 5.200 . 5.700 4.684 4.669 4.699 . 0 0 "[ . 1 . 2]" 1
1138 1 75 VAL H 2 79 ALA MB 4.500 . 5.000 4.527 4.299 4.664 . 0 0 "[ . 1 . 2]" 1
1139 1 75 VAL HA 1 77 LEU H 4.500 . 5.000 4.288 4.209 4.359 . 0 0 "[ . 1 . 2]" 1
1140 1 75 VAL HA 1 78 VAL H 4.500 . 5.000 3.407 3.305 3.549 . 0 0 "[ . 1 . 2]" 1
1141 1 75 VAL HA 1 78 VAL MG1 4.500 . 5.000 3.090 2.934 3.333 . 0 0 "[ . 1 . 2]" 1
1142 1 75 VAL HA 1 78 VAL MG2 4.500 . 5.000 2.296 2.159 2.409 . 0 0 "[ . 1 . 2]" 1
1143 1 75 VAL HB 1 76 VAL H 3.500 . 3.800 3.657 2.794 3.968 0.168 9 0 "[ . 1 . 2]" 1
1144 1 75 VAL HB 2 76 VAL HA 4.500 . 5.000 5.206 4.117 5.517 0.517 9 13 "[ * ** +** ****- **]" 1
1145 1 75 VAL QG 1 76 VAL H . . 3.800 2.619 2.423 3.250 . 0 0 "[ . 1 . 2]" 1
1146 1 75 VAL QG 1 76 VAL QG 4.500 . 5.000 2.884 2.376 3.792 . 0 0 "[ . 1 . 2]" 1
1147 1 75 VAL QG 1 77 LEU H 5.200 . 5.700 4.313 4.206 4.567 . 0 0 "[ . 1 . 2]" 1
1148 1 75 VAL QG 2 76 VAL H 4.500 . 5.000 4.045 3.695 4.247 . 0 0 "[ . 1 . 2]" 1
1149 1 75 VAL QG 2 76 VAL HA 3.500 . 3.800 2.749 2.334 3.264 . 0 0 "[ . 1 . 2]" 1
1150 1 75 VAL QG 2 76 VAL QG 5.200 . 5.700 3.018 2.605 3.779 . 0 0 "[ . 1 . 2]" 1
1151 1 75 VAL QG 2 77 LEU H 5.200 . 5.700 5.119 4.810 5.418 . 0 0 "[ . 1 . 2]" 1
1152 1 75 VAL QG 2 78 VAL H 4.500 . 5.000 4.792 4.655 4.915 . 0 0 "[ . 1 . 2]" 1
1153 1 75 VAL QG 2 78 VAL MG2 3.500 . 3.800 3.290 3.202 3.388 . 0 0 "[ . 1 . 2]" 1
1154 1 75 VAL QG 2 79 ALA H . . 3.800 3.553 3.409 3.665 . 0 0 "[ . 1 . 2]" 1
1155 1 75 VAL QG 2 79 ALA HA 4.500 . 5.000 3.767 3.494 3.919 . 0 0 "[ . 1 . 2]" 1
1156 1 75 VAL QG 2 79 ALA MB 3.500 . 3.800 1.901 1.802 1.978 . 0 0 "[ . 1 . 2]" 1
1157 1 75 VAL QG 2 80 ALA H 5.200 . 5.700 4.951 4.719 5.208 . 0 0 "[ . 1 . 2]" 1
1158 1 76 VAL H 1 76 VAL HB 3.500 . 3.800 2.482 2.375 2.637 . 0 0 "[ . 1 . 2]" 1
1159 1 76 VAL H 1 76 VAL QG . . 3.800 2.303 2.210 2.440 . 0 0 "[ . 1 . 2]" 1
1160 1 76 VAL H 1 77 LEU H 3.500 . 3.800 2.443 2.381 2.497 . 0 0 "[ . 1 . 2]" 1
1161 1 76 VAL H 1 77 LEU HB2 4.500 . 5.000 4.359 4.351 4.368 . 0 0 "[ . 1 . 2]" 1
1162 1 76 VAL H 1 77 LEU HG 4.500 . 5.000 4.706 4.334 4.773 . 0 0 "[ . 1 . 2]" 1
1163 1 76 VAL H 1 78 VAL H 4.500 . 5.000 4.049 3.868 4.201 . 0 0 "[ . 1 . 2]" 1
1164 1 76 VAL H 1 79 ALA H 5.200 . 5.700 4.691 4.577 4.789 . 0 0 "[ . 1 . 2]" 1
1165 1 76 VAL H 2 75 VAL QG 4.500 . 5.000 4.184 3.862 4.497 . 0 0 "[ . 1 . 2]" 1
1166 1 76 VAL HA 1 76 VAL QG . . 3.000 2.174 2.131 2.197 . 0 0 "[ . 1 . 2]" 1
1167 1 76 VAL HA 1 79 ALA H 3.500 . 3.800 3.234 2.848 3.521 . 0 0 "[ . 1 . 2]" 1
1168 1 76 VAL HA 1 79 ALA MB 3.500 . 3.800 2.395 2.215 2.593 . 0 0 "[ . 1 . 2]" 1
1169 1 76 VAL HA 1 80 ALA H 4.500 . 5.000 4.231 4.000 4.474 . 0 0 "[ . 1 . 2]" 1
1170 1 76 VAL HA 1 80 ALA MB 4.500 . 5.000 4.954 4.785 5.206 0.206 8 0 "[ . 1 . 2]" 1
1171 1 76 VAL HA 2 75 VAL HB 4.500 . 5.000 4.568 4.113 5.513 0.513 4 3 "[- +. * 1 . 2]" 1
1172 1 76 VAL HA 2 75 VAL QG 3.500 . 3.800 3.158 2.712 3.712 . 0 0 "[ . 1 . 2]" 1
1173 1 76 VAL HB 1 78 VAL H 5.200 . 5.700 5.273 5.038 5.533 . 0 0 "[ . 1 . 2]" 1
1174 1 76 VAL HB 1 79 ALA H 5.200 . 5.700 5.437 5.268 5.505 . 0 0 "[ . 1 . 2]" 1
1175 1 76 VAL QG 1 79 ALA MB 3.500 . 3.800 3.175 2.765 3.465 . 0 0 "[ . 1 . 2]" 1
1176 1 76 VAL QG 1 80 ALA H 3.500 . 3.800 3.990 3.880 4.151 0.351 8 0 "[ . 1 . 2]" 1
1177 1 76 VAL QG 1 80 ALA HA 4.500 . 5.000 4.627 4.487 4.796 . 0 0 "[ . 1 . 2]" 1
1178 1 76 VAL QG 2 72 GLN QE 4.500 . 5.000 3.559 3.327 3.788 . 0 0 "[ . 1 . 2]" 1
1179 1 76 VAL QG 2 72 GLN HG3 3.500 . 3.800 2.869 2.480 3.094 . 0 0 "[ . 1 . 2]" 1
1180 1 76 VAL QG 2 75 VAL QG 5.200 . 5.700 3.463 2.941 4.079 . 0 0 "[ . 1 . 2]" 1
1181 1 77 LEU H 1 77 LEU HB3 3.500 . 3.800 3.519 3.491 3.548 . 0 0 "[ . 1 . 2]" 1
1182 1 77 LEU H 1 77 LEU MD1 4.500 . 5.000 3.499 3.389 3.624 . 0 0 "[ . 1 . 2]" 1
1183 1 77 LEU H 1 77 LEU HG 3.500 . 3.800 2.738 2.440 2.864 . 0 0 "[ . 1 . 2]" 1
1184 1 77 LEU H 1 78 VAL H 3.500 . 3.800 2.704 2.578 2.788 . 0 0 "[ . 1 . 2]" 1
1185 1 77 LEU H 1 78 VAL MG1 4.500 . 5.000 4.141 4.112 4.169 . 0 0 "[ . 1 . 2]" 1
1186 1 77 LEU H 1 79 ALA H 4.500 . 5.000 4.038 3.959 4.107 . 0 0 "[ . 1 . 2]" 1
1187 1 77 LEU H 2 75 VAL QG 5.200 . 5.700 5.305 5.011 5.489 . 0 0 "[ . 1 . 2]" 1
1188 1 77 LEU HA 1 80 ALA H 3.500 . 3.800 3.449 3.331 3.585 . 0 0 "[ . 1 . 2]" 1
1189 1 77 LEU HB2 1 78 VAL H 4.500 . 5.000 2.947 2.836 3.046 . 0 0 "[ . 1 . 2]" 1
1190 1 77 LEU HB2 1 78 VAL HA 5.200 . 5.700 4.736 4.599 4.795 . 0 0 "[ . 1 . 2]" 1
1191 1 77 LEU HB3 1 78 VAL H 4.500 . 5.000 3.596 3.479 3.718 . 0 0 "[ . 1 . 2]" 1
1192 1 78 VAL H 1 78 VAL MG1 3.500 . 3.800 2.236 2.135 2.420 . 0 0 "[ . 1 . 2]" 1
1193 1 78 VAL H 1 78 VAL MG2 3.500 . 3.800 2.489 2.377 2.583 . 0 0 "[ . 1 . 2]" 1
1194 1 78 VAL H 1 79 ALA H 3.500 . 3.800 2.400 2.287 2.446 . 0 0 "[ . 1 . 2]" 1
1195 1 78 VAL H 1 79 ALA MB 4.500 . 5.000 4.089 3.993 4.125 . 0 0 "[ . 1 . 2]" 1
1196 1 78 VAL H 1 81 LEU H 5.200 . 5.700 5.245 5.130 5.345 . 0 0 "[ . 1 . 2]" 1
1197 1 78 VAL H 2 75 VAL QG 4.500 . 5.000 4.798 4.652 4.926 . 0 0 "[ . 1 . 2]" 1
1198 1 78 VAL HA 1 78 VAL MG1 3.500 . 3.800 2.462 2.423 2.499 . 0 0 "[ . 1 . 2]" 1
1199 1 78 VAL HA 1 78 VAL MG2 3.500 . 3.800 3.270 3.264 3.277 . 0 0 "[ . 1 . 2]" 1
1200 1 78 VAL HA 1 79 ALA MB 5.200 . 5.700 4.981 4.953 4.993 . 0 0 "[ . 1 . 2]" 1
1201 1 78 VAL HA 1 81 LEU H 4.500 . 5.000 3.516 3.392 3.593 . 0 0 "[ . 1 . 2]" 1
1202 1 78 VAL HA 1 81 LEU MD2 4.500 . 5.000 3.901 3.730 4.193 . 0 0 "[ . 1 . 2]" 1
1203 1 78 VAL HA 1 82 THR H 5.200 . 5.700 5.060 4.964 5.152 . 0 0 "[ . 1 . 2]" 1
1204 1 78 VAL HA 2 8 MET ME 4.500 . 5.000 3.521 3.359 3.604 . 0 0 "[ . 1 . 2]" 1
1205 1 78 VAL HB 1 79 ALA H 4.500 . 5.000 4.136 4.094 4.172 . 0 0 "[ . 1 . 2]" 1
1206 1 78 VAL MG1 1 79 ALA H 4.500 . 5.000 3.848 3.779 3.946 . 0 0 "[ . 1 . 2]" 1
1207 1 78 VAL MG1 1 79 ALA HA 5.200 . 5.700 5.462 5.428 5.520 . 0 0 "[ . 1 . 2]" 1
1208 1 78 VAL MG1 1 80 ALA H 5.200 . 5.700 5.173 5.141 5.221 . 0 0 "[ . 1 . 2]" 1
1209 1 78 VAL MG2 1 79 ALA H 3.500 . 3.800 2.474 2.410 2.561 . 0 0 "[ . 1 . 2]" 1
1210 1 78 VAL MG2 1 79 ALA MB 3.500 . 3.800 3.065 2.987 3.167 . 0 0 "[ . 1 . 2]" 1
1211 1 78 VAL MG2 1 81 LEU H 5.200 . 5.700 4.902 4.843 4.976 . 0 0 "[ . 1 . 2]" 1
1212 1 78 VAL MG2 2 7 ALA MB 4.500 . 5.000 3.639 3.524 3.818 . 0 0 "[ . 1 . 2]" 1
1213 1 78 VAL MG2 2 8 MET H 4.500 . 5.000 4.418 4.390 4.446 . 0 0 "[ . 1 . 2]" 1
1214 1 78 VAL MG2 2 8 MET ME 2.700 . 3.000 2.225 2.156 2.309 . 0 0 "[ . 1 . 2]" 1
1215 1 78 VAL MG2 2 8 MET HG2 4.500 . 5.000 4.622 4.324 5.453 0.453 9 0 "[ . 1 . 2]" 1
1216 1 78 VAL MG2 2 75 VAL QG 3.500 . 3.800 3.220 3.031 3.352 . 0 0 "[ . 1 . 2]" 1
1217 1 79 ALA H 1 80 ALA H 3.500 . 3.800 2.590 2.551 2.632 . 0 0 "[ . 1 . 2]" 1
1218 1 79 ALA H 1 80 ALA MB 4.500 . 5.000 4.266 4.230 4.298 . 0 0 "[ . 1 . 2]" 1
1219 1 79 ALA H 1 81 LEU H 4.500 . 5.000 4.207 4.150 4.282 . 0 0 "[ . 1 . 2]" 1
1220 1 79 ALA H 1 82 THR H 4.500 . 5.000 4.931 4.815 5.004 0.004 10 0 "[ . 1 . 2]" 1
1221 1 79 ALA H 2 8 MET ME 4.500 . 5.000 3.869 3.759 3.938 . 0 0 "[ . 1 . 2]" 1
1222 1 79 ALA H 2 71 PHE QE 5.200 . 5.700 5.181 4.927 5.357 . 0 0 "[ . 1 . 2]" 1
1223 1 79 ALA H 2 72 GLN HG3 5.200 . 5.700 4.651 4.535 4.750 . 0 0 "[ . 1 . 2]" 1
1224 1 79 ALA H 2 75 VAL QG . . 3.800 3.579 3.466 3.681 . 0 0 "[ . 1 . 2]" 1
1225 1 79 ALA HA 1 82 THR H 3.500 . 3.800 2.862 2.721 2.934 . 0 0 "[ . 1 . 2]" 1
1226 1 79 ALA HA 1 83 VAL MG2 4.500 . 5.000 4.916 4.803 5.020 0.020 17 0 "[ . 1 . 2]" 1
1227 1 79 ALA HA 2 8 MET ME 3.500 . 3.800 2.606 2.495 2.734 . 0 0 "[ . 1 . 2]" 1
1228 1 79 ALA HA 2 71 PHE QE 4.500 . 5.000 2.927 2.794 3.011 . 0 0 "[ . 1 . 2]" 1
1229 1 79 ALA HA 2 75 VAL QG 4.500 . 5.000 3.610 3.478 3.905 . 0 0 "[ . 1 . 2]" 1
1230 1 79 ALA MB 1 80 ALA H 3.500 . 3.800 2.949 2.932 2.966 . 0 0 "[ . 1 . 2]" 1
1231 1 79 ALA MB 1 81 LEU HG 5.200 . 5.700 5.665 5.570 5.831 0.131 10 0 "[ . 1 . 2]" 1
1232 1 79 ALA MB 1 83 VAL H 4.500 . 5.000 4.199 4.031 4.303 . 0 0 "[ . 1 . 2]" 1
1233 1 79 ALA MB 2 8 MET ME 3.500 . 3.800 3.612 3.522 3.676 . 0 0 "[ . 1 . 2]" 1
1234 1 79 ALA MB 2 71 PHE QE 4.500 . 5.000 2.650 2.415 2.856 . 0 0 "[ . 1 . 2]" 1
1235 1 79 ALA MB 2 72 GLN H 4.500 . 5.000 4.453 4.345 4.592 . 0 0 "[ . 1 . 2]" 1
1236 1 79 ALA MB 2 72 GLN QB 4.500 . 5.000 3.290 3.108 3.437 . 0 0 "[ . 1 . 2]" 1
1237 1 79 ALA MB 2 72 GLN QE 4.500 . 5.000 3.233 2.965 3.511 . 0 0 "[ . 1 . 2]" 1
1238 1 79 ALA MB 2 72 GLN HG2 5.200 . 5.700 3.486 3.342 3.589 . 0 0 "[ . 1 . 2]" 1
1239 1 79 ALA MB 2 75 VAL H 4.500 . 5.000 4.445 4.278 4.571 . 0 0 "[ . 1 . 2]" 1
1240 1 79 ALA MB 2 75 VAL QG 3.500 . 3.800 1.945 1.865 2.003 . 0 0 "[ . 1 . 2]" 1
1241 1 80 ALA H 1 80 ALA MB 2.700 . 3.000 2.226 2.218 2.233 . 0 0 "[ . 1 . 2]" 1
1242 1 80 ALA H 1 81 LEU H 3.500 . 3.800 2.627 2.601 2.674 . 0 0 "[ . 1 . 2]" 1
1243 1 80 ALA H 1 81 LEU HG 4.500 . 5.000 3.946 3.872 4.152 . 0 0 "[ . 1 . 2]" 1
1244 1 80 ALA H 1 83 VAL MG2 5.200 . 5.700 4.336 4.260 4.443 . 0 0 "[ . 1 . 2]" 1
1245 1 80 ALA H 2 72 GLN QE . . 5.000 3.752 3.484 3.981 . 0 0 "[ . 1 . 2]" 1
1246 1 80 ALA H 2 72 GLN HG3 4.500 . 5.000 4.265 4.063 4.402 . 0 0 "[ . 1 . 2]" 1
1247 1 80 ALA H 2 75 VAL QG 5.200 . 5.700 5.103 4.918 5.205 . 0 0 "[ . 1 . 2]" 1
1248 1 80 ALA HA 1 83 VAL MG1 4.500 . 5.000 3.666 3.577 3.778 . 0 0 "[ . 1 . 2]" 1
1249 1 80 ALA HA 1 83 VAL MG2 4.500 . 5.000 2.137 2.063 2.225 . 0 0 "[ . 1 . 2]" 1
1250 1 80 ALA HA 2 72 GLN QE . . 3.800 2.194 2.088 2.372 . 0 0 "[ . 1 . 2]" 1
1251 1 80 ALA MB 1 81 LEU H 3.500 . 3.800 2.691 2.646 2.741 . 0 0 "[ . 1 . 2]" 1
1252 1 80 ALA MB 1 81 LEU HG 4.500 . 5.000 3.356 3.199 3.464 . 0 0 "[ . 1 . 2]" 1
1253 1 80 ALA MB 1 83 VAL MG2 4.500 . 5.000 3.457 3.392 3.520 . 0 0 "[ . 1 . 2]" 1
1254 1 80 ALA MB 2 72 GLN QE 3.500 . 3.800 3.118 2.999 3.243 . 0 0 "[ . 1 . 2]" 1
1255 1 80 ALA MB 2 72 GLN HG3 4.500 . 5.000 4.663 4.426 4.802 . 0 0 "[ . 1 . 2]" 1
1256 1 81 LEU H 1 81 LEU HB3 3.500 . 3.800 3.601 3.585 3.615 . 0 0 "[ . 1 . 2]" 1
1257 1 81 LEU H 1 81 LEU MD1 4.500 . 5.000 3.599 3.557 3.713 . 0 0 "[ . 1 . 2]" 1
1258 1 81 LEU H 1 81 LEU MD2 3.500 . 3.800 2.986 2.942 3.043 . 0 0 "[ . 1 . 2]" 1
1259 1 81 LEU H 1 81 LEU HG 3.500 . 3.800 2.049 1.984 2.190 . 0 0 "[ . 1 . 2]" 1
1260 1 81 LEU H 1 82 THR H 3.500 . 3.800 2.450 2.426 2.469 . 0 0 "[ . 1 . 2]" 1
1261 1 81 LEU H 1 82 THR HA 5.200 . 5.700 5.097 5.090 5.106 . 0 0 "[ . 1 . 2]" 1
1262 1 81 LEU H 1 83 VAL MG2 4.500 . 5.000 4.326 4.260 4.381 . 0 0 "[ . 1 . 2]" 1
1263 1 81 LEU H 1 84 ALA H 5.200 . 5.700 4.831 4.791 4.901 . 0 0 "[ . 1 . 2]" 1
1264 1 81 LEU H 1 84 ALA MB 5.200 . 5.700 4.852 4.713 4.936 . 0 0 "[ . 1 . 2]" 1
1265 1 81 LEU HA 1 84 ALA H 4.500 . 5.000 3.622 3.532 3.648 . 0 0 "[ . 1 . 2]" 1
1266 1 81 LEU HA 1 84 ALA MB 3.500 . 3.800 2.794 2.628 2.909 . 0 0 "[ . 1 . 2]" 1
1267 1 81 LEU HB2 1 84 ALA H 5.200 . 5.700 5.550 5.487 5.595 . 0 0 "[ . 1 . 2]" 1
1268 1 81 LEU HB3 1 82 THR H 4.500 . 5.000 3.898 3.859 3.943 . 0 0 "[ . 1 . 2]" 1
1269 1 81 LEU MD1 1 82 THR H 4.500 . 5.000 4.424 4.284 4.557 . 0 0 "[ . 1 . 2]" 1
1270 1 81 LEU MD1 1 82 THR HA 5.200 . 5.700 5.599 5.450 5.740 0.040 3 0 "[ . 1 . 2]" 1
1271 1 81 LEU MD2 1 82 THR H 4.500 . 5.000 4.585 4.556 4.609 . 0 0 "[ . 1 . 2]" 1
1272 1 81 LEU HG 1 82 THR H 3.500 . 3.800 3.955 3.836 4.079 0.279 10 0 "[ . 1 . 2]" 1
1273 1 82 THR H 1 82 THR MG 4.500 . 5.000 3.673 3.626 3.769 . 0 0 "[ . 1 . 2]" 1
1274 1 82 THR H 1 83 VAL H 3.500 . 3.800 2.714 2.669 2.749 . 0 0 "[ . 1 . 2]" 1
1275 1 82 THR H 1 83 VAL HA 5.200 . 5.700 5.285 5.199 5.330 . 0 0 "[ . 1 . 2]" 1
1276 1 82 THR H 1 83 VAL MG1 5.200 . 5.700 4.324 4.253 4.386 . 0 0 "[ . 1 . 2]" 1
1277 1 82 THR H 1 83 VAL MG2 4.500 . 5.000 3.998 3.992 4.005 . 0 0 "[ . 1 . 2]" 1
1278 1 82 THR H 1 84 ALA H 4.500 . 5.000 4.062 4.005 4.109 . 0 0 "[ . 1 . 2]" 1
1279 1 82 THR H 1 84 ALA MB 4.500 . 5.000 4.843 4.685 4.931 . 0 0 "[ . 1 . 2]" 1
1280 1 82 THR H 2 8 MET ME 4.500 . 5.000 3.299 3.162 3.405 . 0 0 "[ . 1 . 2]" 1
1281 1 82 THR HA 1 84 ALA H 4.500 . 5.000 4.355 4.349 4.361 . 0 0 "[ . 1 . 2]" 1
1282 1 82 THR HA 1 85 CYS H 4.500 . 5.000 3.459 3.292 3.558 . 0 0 "[ . 1 . 2]" 1
1283 1 82 THR HA 1 86 ASN H 4.500 . 5.000 3.770 3.621 3.935 . 0 0 "[ . 1 . 2]" 1
1284 1 82 THR MG 1 83 VAL H 4.500 . 5.000 3.855 3.646 3.998 . 0 0 "[ . 1 . 2]" 1
1285 1 82 THR MG 1 85 CYS H 4.500 . 5.000 4.665 4.547 4.800 . 0 0 "[ . 1 . 2]" 1
1286 1 82 THR MG 1 86 ASN H 4.500 . 5.000 3.867 3.731 4.007 . 0 0 "[ . 1 . 2]" 1
1287 1 82 THR MG 1 86 ASN HA 4.500 . 5.000 5.430 5.242 5.481 0.481 18 0 "[ . 1 . 2]" 1
1288 1 82 THR MG 1 86 ASN QB 3.500 . 3.800 2.880 2.708 2.996 . 0 0 "[ . 1 . 2]" 1
1289 1 82 THR MG 2 8 MET ME 3.500 . 3.800 3.459 3.348 3.509 . 0 0 "[ . 1 . 2]" 1
1290 1 82 THR MG 2 12 ILE MD 3.500 . 3.800 2.285 2.121 2.544 . 0 0 "[ . 1 . 2]" 1
1291 1 82 THR MG 2 12 ILE MG 5.200 . 5.700 4.676 4.505 5.034 . 0 0 "[ . 1 . 2]" 1
1292 1 82 THR MG 2 71 PHE QE 3.500 . 3.800 2.840 2.703 3.012 . 0 0 "[ . 1 . 2]" 1
1293 1 83 VAL H 1 83 VAL MG1 4.500 . 5.000 2.292 2.242 2.358 . 0 0 "[ . 1 . 2]" 1
1294 1 83 VAL H 1 83 VAL MG2 3.500 . 3.800 2.097 2.050 2.136 . 0 0 "[ . 1 . 2]" 1
1295 1 83 VAL H 1 84 ALA H 3.500 . 3.800 2.632 2.606 2.666 . 0 0 "[ . 1 . 2]" 1
1296 1 83 VAL H 1 86 ASN H 5.200 . 5.700 4.823 4.767 4.873 . 0 0 "[ . 1 . 2]" 1
1297 1 83 VAL HA 1 83 VAL MG1 3.500 . 3.800 2.343 2.283 2.376 . 0 0 "[ . 1 . 2]" 1
1298 1 83 VAL HA 1 83 VAL MG2 3.500 . 3.800 3.234 3.160 3.251 . 0 0 "[ . 1 . 2]" 1
1299 1 83 VAL HA 1 84 ALA H 3.500 . 3.800 3.537 3.501 3.548 . 0 0 "[ . 1 . 2]" 1
1300 1 83 VAL HA 1 86 ASN H 3.500 . 3.800 3.492 3.293 3.706 . 0 0 "[ . 1 . 2]" 1
1301 1 83 VAL HA 1 87 ASN HB2 4.500 . 5.000 2.118 1.897 2.723 . 0 0 "[ . 1 . 2]" 1
1302 1 83 VAL HB 1 84 ALA HA 4.500 . 5.000 4.503 4.483 4.509 . 0 0 "[ . 1 . 2]" 1
1303 1 83 VAL HB 2 72 GLN QE 4.500 . 5.000 4.124 3.956 4.279 . 0 0 "[ . 1 . 2]" 1
1304 1 83 VAL MG1 1 86 ASN H 5.200 . 5.700 5.217 5.080 5.376 . 0 0 "[ . 1 . 2]" 1
1305 1 83 VAL MG1 2 71 PHE H 4.500 . 5.000 3.835 3.538 4.079 . 0 0 "[ . 1 . 2]" 1
1306 1 83 VAL MG1 2 71 PHE HA 5.200 . 5.700 4.994 4.679 5.232 . 0 0 "[ . 1 . 2]" 1
1307 1 83 VAL MG1 2 71 PHE QD 3.500 . 3.800 2.756 2.615 3.081 . 0 0 "[ . 1 . 2]" 1
1308 1 83 VAL MG1 2 71 PHE QE 4.500 . 5.000 4.315 4.125 4.638 . 0 0 "[ . 1 . 2]" 1
1309 1 83 VAL MG1 2 72 GLN H 3.500 . 3.800 2.733 2.548 2.949 . 0 0 "[ . 1 . 2]" 1
1310 1 83 VAL MG1 2 72 GLN HA 4.500 . 5.000 3.515 3.419 3.672 . 0 0 "[ . 1 . 2]" 1
1311 1 83 VAL MG1 2 72 GLN QB 3.500 . 3.800 1.967 1.920 2.040 . 0 0 "[ . 1 . 2]" 1
1312 1 83 VAL MG1 2 72 GLN QE 3.500 . 3.800 2.449 2.216 2.690 . 0 0 "[ . 1 . 2]" 1
1313 1 83 VAL MG1 2 72 GLN HG2 4.500 . 5.000 4.427 4.399 4.459 . 0 0 "[ . 1 . 2]" 1
1314 1 83 VAL MG1 2 72 GLN HG3 4.500 . 5.000 3.594 3.440 3.769 . 0 0 "[ . 1 . 2]" 1
1315 1 83 VAL MG1 2 73 GLU H 5.200 . 5.700 4.663 4.530 4.832 . 0 0 "[ . 1 . 2]" 1
1316 1 83 VAL MG2 1 84 ALA H 3.500 . 3.800 2.351 2.297 2.407 . 0 0 "[ . 1 . 2]" 1
1317 1 83 VAL MG2 1 84 ALA MB 4.500 . 5.000 3.030 2.944 3.133 . 0 0 "[ . 1 . 2]" 1
1318 1 83 VAL MG2 1 85 CYS H 4.500 . 5.000 4.355 4.330 4.371 . 0 0 "[ . 1 . 2]" 1
1319 1 83 VAL MG2 1 86 ASN H 5.200 . 5.700 5.330 5.254 5.430 . 0 0 "[ . 1 . 2]" 1
1320 1 83 VAL MG2 1 87 ASN HB2 4.500 . 5.000 4.176 3.956 4.316 . 0 0 "[ . 1 . 2]" 1
1321 1 83 VAL MG2 2 71 PHE QD 5.200 . 5.700 4.850 4.718 5.103 . 0 0 "[ . 1 . 2]" 1
1322 1 83 VAL MG2 2 72 GLN QB 4.500 . 5.000 3.288 3.120 3.504 . 0 0 "[ . 1 . 2]" 1
1323 1 83 VAL MG2 2 72 GLN QE 3.500 . 3.800 2.098 1.997 2.202 . 0 0 "[ . 1 . 2]" 1
1324 1 84 ALA H 1 85 CYS H 3.500 . 3.800 2.528 2.459 2.606 . 0 0 "[ . 1 . 2]" 1
1325 1 84 ALA H 1 85 CYS HB3 5.200 . 5.700 4.746 4.512 4.902 . 0 0 "[ . 1 . 2]" 1
1326 1 84 ALA H 1 86 ASN H 4.500 . 5.000 4.342 4.272 4.353 . 0 0 "[ . 1 . 2]" 1
1327 1 84 ALA MB 1 85 CYS H 3.500 . 3.800 2.840 2.706 2.956 . 0 0 "[ . 1 . 2]" 1
1328 1 84 ALA MB 1 85 CYS HA 4.500 . 5.000 3.991 3.929 4.043 . 0 0 "[ . 1 . 2]" 1
1329 1 84 ALA MB 1 85 CYS HB2 4.500 . 5.000 4.038 3.919 4.110 . 0 0 "[ . 1 . 2]" 1
1330 1 84 ALA MB 1 86 ASN H 4.500 . 5.000 4.871 4.787 4.908 . 0 0 "[ . 1 . 2]" 1
1331 1 85 CYS H 1 85 CYS HB2 3.500 . 3.800 2.617 2.539 2.714 . 0 0 "[ . 1 . 2]" 1
1332 1 85 CYS H 1 85 CYS HB3 3.500 . 3.800 2.431 2.290 2.557 . 0 0 "[ . 1 . 2]" 1
1333 1 85 CYS H 1 86 ASN H 3.500 . 3.800 2.490 2.346 2.592 . 0 0 "[ . 1 . 2]" 1
1334 1 85 CYS H 1 86 ASN QB 4.500 . 5.000 4.342 4.073 4.408 . 0 0 "[ . 1 . 2]" 1
1335 1 85 CYS HB3 1 86 ASN H 4.500 . 5.000 2.314 2.178 2.473 . 0 0 "[ . 1 . 2]" 1
1336 1 86 ASN H 1 86 ASN HD21 5.200 . 5.700 4.628 4.215 4.896 . 0 0 "[ . 1 . 2]" 1
1337 1 87 ASN H 1 88 PHE H 4.500 . 5.000 2.500 2.325 2.643 . 0 0 "[ . 1 . 2]" 1
1338 1 87 ASN HA 1 87 ASN HD22 5.200 . 5.700 3.532 3.457 3.653 . 0 0 "[ . 1 . 2]" 1
1339 1 87 ASN HA 1 89 PHE H 4.500 . 5.000 3.487 3.270 3.610 . 0 0 "[ . 1 . 2]" 1
1340 1 87 ASN HA 1 90 TRP H 4.500 . 5.000 4.385 4.338 4.400 . 0 0 "[ . 1 . 2]" 1
1341 1 87 ASN HA 1 90 TRP HB3 4.500 . 5.000 4.703 4.419 4.794 . 0 0 "[ . 1 . 2]" 1
1342 1 87 ASN QD 2 71 PHE H 4.500 . 5.000 4.658 3.642 5.932 0.932 10 2 "[ . + - 2]" 1
1343 1 87 ASN QD 2 72 GLN H 4.500 . 5.000 6.060 5.199 7.091 2.091 10 17 "[ ****** *+** ******-]" 1
1344 1 88 PHE H 1 88 PHE QB 3.500 . 3.800 2.129 2.045 2.242 . 0 0 "[ . 1 . 2]" 1
1345 1 88 PHE H 1 88 PHE QD 5.200 . 5.700 3.983 2.188 4.140 . 0 0 "[ . 1 . 2]" 1
1346 1 88 PHE H 1 89 PHE H 3.500 . 3.800 3.070 2.910 3.180 . 0 0 "[ . 1 . 2]" 1
1347 1 88 PHE H 1 90 TRP H 4.500 . 5.000 4.480 4.432 4.549 . 0 0 "[ . 1 . 2]" 1
1348 1 88 PHE HA 1 89 PHE HA 5.200 . 5.700 4.703 4.654 4.739 . 0 0 "[ . 1 . 2]" 1
1349 1 88 PHE HA 1 90 TRP H 4.500 . 5.000 3.357 3.217 3.440 . 0 0 "[ . 1 . 2]" 1
1350 1 88 PHE HA 1 90 TRP HE1 4.500 . 5.000 2.919 2.592 3.203 . 0 0 "[ . 1 . 2]" 1
1351 1 88 PHE QB 1 89 PHE H 4.500 . 5.000 3.030 2.850 3.699 . 0 0 "[ . 1 . 2]" 1
1352 1 88 PHE QD 1 89 PHE H 5.200 . 5.700 3.986 3.309 4.525 . 0 0 "[ . 1 . 2]" 1
1353 1 89 PHE H 1 90 TRP HA 4.500 . 5.000 4.904 4.667 5.093 0.093 9 0 "[ . 1 . 2]" 1
1354 1 89 PHE H 1 90 TRP HB3 5.200 . 5.700 4.966 4.728 5.150 . 0 0 "[ . 1 . 2]" 1
1355 1 89 PHE H 1 90 TRP HE1 5.200 . 5.700 5.508 5.408 5.525 . 0 0 "[ . 1 . 2]" 1
1356 1 89 PHE H 1 91 GLU H 4.500 . 5.000 4.735 4.449 4.867 . 0 0 "[ . 1 . 2]" 1
1357 1 89 PHE H 2 26 TYR QE 4.500 . 5.000 3.611 2.571 4.625 . 0 0 "[ . 1 . 2]" 1
1358 1 89 PHE HA 1 90 TRP HE1 5.200 . 5.700 5.318 5.047 5.521 . 0 0 "[ . 1 . 2]" 1
1359 1 89 PHE HA 1 91 GLU H 4.500 . 5.000 3.087 2.914 3.222 . 0 0 "[ . 1 . 2]" 1
1360 1 89 PHE HA 2 26 TYR QE 4.500 . 5.000 4.291 3.927 5.088 0.088 1 0 "[ . 1 . 2]" 1
1361 1 89 PHE QB 2 26 TYR QE 4.500 . 5.000 2.103 1.969 2.502 . 0 0 "[ . 1 . 2]" 1
1362 1 89 PHE QD 2 26 TYR QE 4.500 . 5.000 3.660 2.954 4.199 . 0 0 "[ . 1 . 2]" 1
1363 1 90 TRP H 1 90 TRP HB2 3.500 . 3.800 3.547 3.517 3.569 . 0 0 "[ . 1 . 2]" 1
1364 1 90 TRP H 1 90 TRP HB3 3.500 . 3.800 2.795 2.727 2.870 . 0 0 "[ . 1 . 2]" 1
1365 1 90 TRP H 1 90 TRP HE1 4.500 . 5.000 4.064 3.990 4.143 . 0 0 "[ . 1 . 2]" 1
1366 1 90 TRP H 1 91 GLU H 3.500 . 3.800 2.758 2.499 2.903 . 0 0 "[ . 1 . 2]" 1
1367 1 90 TRP H 1 91 GLU QG 4.500 . 5.000 4.583 3.862 5.067 0.067 1 0 "[ . 1 . 2]" 1
1368 1 90 TRP HA 1 90 TRP HD1 4.500 . 5.000 4.045 4.027 4.062 . 0 0 "[ . 1 . 2]" 1
1369 1 90 TRP HA 1 90 TRP HE3 4.500 . 5.000 4.782 4.771 4.796 . 0 0 "[ . 1 . 2]" 1
1370 1 90 TRP HA 1 91 GLU H 3.500 . 3.800 3.402 3.292 3.462 . 0 0 "[ . 1 . 2]" 1
1371 1 90 TRP HB2 1 90 TRP HE1 5.200 . 5.700 5.062 5.038 5.088 . 0 0 "[ . 1 . 2]" 1
1372 1 90 TRP HB2 1 91 GLU H 4.500 . 5.000 3.942 3.790 4.016 . 0 0 "[ . 1 . 2]" 1
1373 1 90 TRP HB2 1 91 GLU HA 4.500 . 5.000 4.437 4.318 4.602 . 0 0 "[ . 1 . 2]" 1
1374 1 90 TRP HB3 1 90 TRP HE1 5.200 . 5.700 5.275 5.269 5.281 . 0 0 "[ . 1 . 2]" 1
1375 1 90 TRP HB3 1 91 GLU H 4.500 . 5.000 4.382 4.289 4.466 . 0 0 "[ . 1 . 2]" 1
1376 1 90 TRP HD1 1 91 GLU HA 3.500 . 3.800 3.399 2.902 3.766 . 0 0 "[ . 1 . 2]" 1
1377 1 91 GLU H 1 91 GLU QB 3.500 . 3.800 2.352 2.053 2.709 . 0 0 "[ . 1 . 2]" 1
1378 1 91 GLU H 1 91 GLU QG 3.500 . 3.800 2.663 1.790 3.585 0.010 20 0 "[ . 1 . 2]" 1
1379 1 91 GLU H 1 92 ASN H 4.500 . 5.000 4.557 4.399 4.679 . 0 0 "[ . 1 . 2]" 1
1380 1 91 GLU H 1 92 ASN HA 5.200 . 5.700 5.331 5.055 5.512 . 0 0 "[ . 1 . 2]" 1
1381 1 91 GLU HA 1 92 ASN H 3.500 . 3.800 2.274 2.090 2.619 . 0 0 "[ . 1 . 2]" 1
1382 1 91 GLU QB 1 92 ASN H 4.500 . 5.000 2.968 2.111 3.574 . 0 0 "[ . 1 . 2]" 1
1383 1 91 GLU QG 1 92 ASN H 4.500 . 5.000 4.098 3.472 4.576 . 0 0 "[ . 1 . 2]" 1
1384 1 92 ASN H 1 92 ASN QB 3.500 . 3.800 2.295 2.190 2.515 . 0 0 "[ . 1 . 2]" 1
1385 1 92 ASN H 1 93 SER H 4.500 . 5.000 4.260 3.556 4.612 . 0 0 "[ . 1 . 2]" 1
1386 1 92 ASN HA 1 92 ASN HD21 4.500 . 5.000 2.962 1.990 3.500 . 0 0 "[ . 1 . 2]" 1
1387 1 92 ASN HA 1 92 ASN QD 3.500 . 3.800 2.841 1.981 3.291 . 0 0 "[ . 1 . 2]" 1
1388 1 92 ASN HA 1 92 ASN HD22 4.500 . 5.000 3.827 3.481 4.003 . 0 0 "[ . 1 . 2]" 1
1389 1 92 ASN HA 1 93 SER H 2.700 . 3.000 2.102 1.984 2.221 . 0 0 "[ . 1 . 2]" 1
1390 1 92 ASN QB 1 93 SER H 3.500 . 3.800 3.659 3.209 3.786 . 0 0 "[ . 1 . 2]" 1
1391 1 92 ASN HB2 1 93 SER H 4.500 . 5.000 4.276 4.202 4.319 . 0 0 "[ . 1 . 2]" 1
1392 1 92 ASN HB3 1 93 SER H 4.500 . 5.000 3.992 3.315 4.216 . 0 0 "[ . 1 . 2]" 1
1393 1 93 SER H 1 93 SER QB 3.500 . 3.800 2.650 2.249 3.095 . 0 0 "[ . 1 . 2]" 1
1394 2 1 GLY QA 2 2 SER H 3.500 . 3.800 2.768 2.185 2.953 . 0 0 "[ . 1 . 2]" 1
1395 2 1 GLY QA 2 2 SER HA 4.500 . 5.000 4.102 3.994 4.151 . 0 0 "[ . 1 . 2]" 1
1396 2 2 SER H 2 5 GLU H 4.500 . 5.000 4.253 4.063 4.459 . 0 0 "[ . 1 . 2]" 1
1397 2 2 SER H 2 5 GLU HG2 4.500 . 5.000 2.921 2.417 3.297 . 0 0 "[ . 1 . 2]" 1
1398 2 2 SER H 2 5 GLU HG3 4.500 . 5.000 4.200 3.834 4.545 . 0 0 "[ . 1 . 2]" 1
1399 2 2 SER H 2 6 THR H 5.200 . 5.700 5.050 4.445 5.349 . 0 0 "[ . 1 . 2]" 1
1400 2 2 SER HA 2 3 GLU H 3.500 . 3.800 2.315 2.243 2.421 . 0 0 "[ . 1 . 2]" 1
1401 2 2 SER HA 2 3 GLU HA 5.200 . 5.700 4.363 4.297 4.460 . 0 0 "[ . 1 . 2]" 1
1402 2 2 SER HA 2 5 GLU H 4.500 . 5.000 4.677 4.369 4.933 . 0 0 "[ . 1 . 2]" 1
1403 2 2 SER QB 2 3 GLU H 3.500 . 3.800 3.060 2.502 3.640 . 0 0 "[ . 1 . 2]" 1
1404 2 3 GLU H 2 3 GLU QG 4.500 . 5.000 3.781 3.590 4.042 . 0 0 "[ . 1 . 2]" 1
1405 2 3 GLU H 2 4 LEU H 4.500 . 5.000 2.585 2.254 2.773 . 0 0 "[ . 1 . 2]" 1
1406 2 3 GLU H 2 4 LEU QB 5.200 . 5.700 4.461 4.015 4.906 . 0 0 "[ . 1 . 2]" 1
1407 2 3 GLU H 2 5 GLU H 5.200 . 5.700 4.263 4.096 4.362 . 0 0 "[ . 1 . 2]" 1
1408 2 3 GLU H 2 6 THR H 5.200 . 5.700 5.088 4.848 5.332 . 0 0 "[ . 1 . 2]" 1
1409 2 3 GLU HA 2 3 GLU QG 3.500 . 3.800 2.294 2.219 2.521 . 0 0 "[ . 1 . 2]" 1
1410 2 3 GLU HA 2 6 THR HB 3.500 . 3.800 3.363 3.007 3.708 . 0 0 "[ . 1 . 2]" 1
1411 2 3 GLU QG 2 4 LEU H 4.500 . 5.000 4.316 4.206 4.398 . 0 0 "[ . 1 . 2]" 1
1412 2 3 GLU QG 2 4 LEU HA 4.500 . 5.000 4.699 4.485 4.949 . 0 0 "[ . 1 . 2]" 1
1413 2 3 GLU QG 2 4 LEU QB 4.500 . 5.000 5.339 5.175 5.456 0.456 17 0 "[ . 1 . 2]" 1
1414 2 3 GLU QG 2 6 THR HB 4.500 . 5.000 3.916 3.600 4.155 . 0 0 "[ . 1 . 2]" 1
1415 2 4 LEU H 2 4 LEU QB 3.500 . 3.800 2.216 2.107 2.498 . 0 0 "[ . 1 . 2]" 1
1416 2 4 LEU H 2 4 LEU QD 4.500 . 5.000 3.038 1.784 3.259 0.016 6 0 "[ . 1 . 2]" 1
1417 2 4 LEU H 2 5 GLU H 4.500 . 5.000 2.754 2.653 2.835 . 0 0 "[ . 1 . 2]" 1
1418 2 4 LEU H 2 6 THR H 4.500 . 5.000 4.197 4.090 4.354 . 0 0 "[ . 1 . 2]" 1
1419 2 4 LEU QD 2 5 GLU H 5.200 . 5.700 3.229 2.749 3.393 . 0 0 "[ . 1 . 2]" 1
1420 2 5 GLU H 2 5 GLU QB 3.500 . 3.800 2.453 2.272 2.626 . 0 0 "[ . 1 . 2]" 1
1421 2 5 GLU H 2 5 GLU HG2 4.500 . 5.000 2.511 2.218 3.059 . 0 0 "[ . 1 . 2]" 1
1422 2 5 GLU H 2 5 GLU HG3 4.500 . 5.000 3.763 3.427 4.096 . 0 0 "[ . 1 . 2]" 1
1423 2 5 GLU H 2 6 THR H 4.500 . 5.000 2.450 2.383 2.561 . 0 0 "[ . 1 . 2]" 1
1424 2 5 GLU H 2 7 ALA H 5.200 . 5.700 3.875 3.712 4.044 . 0 0 "[ . 1 . 2]" 1
1425 2 5 GLU HA 2 7 ALA H 4.500 . 5.000 3.653 3.571 3.763 . 0 0 "[ . 1 . 2]" 1
1426 2 5 GLU HA 2 8 MET H 4.500 . 5.000 3.718 3.501 3.968 . 0 0 "[ . 1 . 2]" 1
1427 2 5 GLU HA 2 8 MET ME 4.500 . 5.000 3.202 2.838 3.628 . 0 0 "[ . 1 . 2]" 1
1428 2 5 GLU QB 2 6 THR H 4.500 . 5.000 3.605 3.505 3.715 . 0 0 "[ . 1 . 2]" 1
1429 2 5 GLU HG2 2 6 THR H 4.500 . 5.000 2.592 2.298 3.307 . 0 0 "[ . 1 . 2]" 1
1430 2 5 GLU HG3 2 6 THR H 4.500 . 5.000 3.115 2.836 3.421 . 0 0 "[ . 1 . 2]" 1
1431 2 5 GLU HG3 2 7 ALA H 4.500 . 5.000 4.944 4.805 5.216 0.216 10 0 "[ . 1 . 2]" 1
1432 2 6 THR H 2 6 THR HB 3.500 . 3.800 2.719 2.619 2.997 . 0 0 "[ . 1 . 2]" 1
1433 2 6 THR H 2 6 THR MG 4.500 . 5.000 3.743 3.555 3.790 . 0 0 "[ . 1 . 2]" 1
1434 2 6 THR H 2 7 ALA H 4.500 . 5.000 2.464 2.377 2.607 . 0 0 "[ . 1 . 2]" 1
1435 2 6 THR H 2 8 MET H 5.200 . 5.700 4.819 4.710 4.908 . 0 0 "[ . 1 . 2]" 1
1436 2 6 THR H 2 9 GLU HG3 4.500 . 5.000 5.162 5.015 5.265 0.265 15 0 "[ . 1 . 2]" 1
1437 2 6 THR HA 2 6 THR MG 3.500 . 3.800 2.281 2.176 2.335 . 0 0 "[ . 1 . 2]" 1
1438 2 6 THR HA 2 7 ALA H 3.500 . 3.800 3.457 3.428 3.527 . 0 0 "[ . 1 . 2]" 1
1439 2 6 THR HA 2 8 MET H 4.500 . 5.000 4.562 4.452 4.678 . 0 0 "[ . 1 . 2]" 1
1440 2 6 THR HA 2 9 GLU H 4.500 . 5.000 3.480 3.392 3.569 . 0 0 "[ . 1 . 2]" 1
1441 2 6 THR HA 2 9 GLU HG2 4.500 . 5.000 2.693 2.442 2.919 . 0 0 "[ . 1 . 2]" 1
1442 2 6 THR HA 2 9 GLU HG3 3.500 . 3.800 2.340 2.236 2.427 . 0 0 "[ . 1 . 2]" 1
1443 2 6 THR HB 2 9 GLU HG3 4.500 . 5.000 5.065 5.054 5.080 0.080 9 0 "[ . 1 . 2]" 1
1444 2 6 THR MG 2 7 ALA H 4.500 . 5.000 4.095 3.993 4.259 . 0 0 "[ . 1 . 2]" 1
1445 2 6 THR MG 2 9 GLU HB2 3.500 . 3.800 3.020 2.898 3.145 . 0 0 "[ . 1 . 2]" 1
1446 2 6 THR MG 2 9 GLU HB3 4.500 . 5.000 4.084 3.943 4.221 . 0 0 "[ . 1 . 2]" 1
1447 2 7 ALA H 2 8 MET H 3.500 . 3.800 2.994 2.896 3.082 . 0 0 "[ . 1 . 2]" 1
1448 2 7 ALA H 2 8 MET ME 4.500 . 5.000 5.130 4.843 5.442 0.442 9 0 "[ . 1 . 2]" 1
1449 2 7 ALA H 2 8 MET HG3 5.200 . 5.700 5.393 5.101 6.002 0.302 9 0 "[ . 1 . 2]" 1
1450 2 7 ALA H 2 9 GLU H 4.500 . 5.000 4.152 4.071 4.238 . 0 0 "[ . 1 . 2]" 1
1451 2 7 ALA H 2 9 GLU HG2 5.200 . 5.700 4.846 4.574 5.051 . 0 0 "[ . 1 . 2]" 1
1452 2 7 ALA H 2 9 GLU HG3 5.200 . 5.700 5.469 5.403 5.528 . 0 0 "[ . 1 . 2]" 1
1453 2 7 ALA HA 2 10 THR H 4.500 . 5.000 3.718 3.649 3.780 . 0 0 "[ . 1 . 2]" 1
1454 2 7 ALA HA 2 10 THR MG 4.500 . 5.000 2.925 2.769 3.032 . 0 0 "[ . 1 . 2]" 1
1455 2 7 ALA HA 2 11 LEU H 4.500 . 5.000 4.976 4.900 4.993 . 0 0 "[ . 1 . 2]" 1
1456 2 7 ALA MB 2 8 MET H 3.500 . 3.800 2.270 2.207 2.384 . 0 0 "[ . 1 . 2]" 1
1457 2 7 ALA MB 2 8 MET ME 4.500 . 5.000 3.897 3.657 4.161 . 0 0 "[ . 1 . 2]" 1
1458 2 8 MET H 2 8 MET ME 3.500 . 3.800 3.303 3.122 3.558 . 0 0 "[ . 1 . 2]" 1
1459 2 8 MET H 2 8 MET HG2 3.500 . 3.800 1.907 1.732 2.354 0.068 8 0 "[ . 1 . 2]" 1
1460 2 8 MET H 2 8 MET HG3 3.500 . 3.800 3.133 2.996 3.540 . 0 0 "[ . 1 . 2]" 1
1461 2 8 MET H 2 9 GLU H 3.500 . 3.800 2.773 2.709 2.830 . 0 0 "[ . 1 . 2]" 1
1462 2 8 MET H 2 10 THR H 4.500 . 5.000 4.406 4.365 4.464 . 0 0 "[ . 1 . 2]" 1
1463 2 8 MET H 2 11 LEU MD2 4.500 . 5.000 3.968 3.895 4.056 . 0 0 "[ . 1 . 2]" 1
1464 2 8 MET HA 2 11 LEU H 4.500 . 5.000 3.264 3.176 3.363 . 0 0 "[ . 1 . 2]" 1
1465 2 8 MET HA 2 12 ILE H 4.500 . 5.000 4.138 4.058 4.277 . 0 0 "[ . 1 . 2]" 1
1466 2 8 MET HB2 2 9 GLU HG2 4.500 . 5.000 4.797 4.539 4.933 . 0 0 "[ . 1 . 2]" 1
1467 2 8 MET ME 2 71 PHE QD 5.200 . 5.700 5.407 5.386 5.426 . 0 0 "[ . 1 . 2]" 1
1468 2 8 MET ME 2 71 PHE QE 3.500 . 3.800 3.632 3.574 3.723 . 0 0 "[ . 1 . 2]" 1
1469 2 8 MET ME 2 75 VAL QG 4.500 . 5.000 4.017 3.825 4.298 . 0 0 "[ . 1 . 2]" 1
1470 2 8 MET HG2 2 9 GLU H 3.500 . 3.800 3.000 2.219 3.254 . 0 0 "[ . 1 . 2]" 1
1471 2 8 MET HG3 2 9 GLU H 4.500 . 5.000 2.982 2.687 3.836 . 0 0 "[ . 1 . 2]" 1
1472 2 8 MET HG3 2 9 GLU HA 4.500 . 5.000 4.121 3.782 5.061 0.061 15 0 "[ . 1 . 2]" 1
1473 2 9 GLU H 2 9 GLU HG2 4.500 . 5.000 2.002 1.819 2.153 . 0 0 "[ . 1 . 2]" 1
1474 2 9 GLU H 2 9 GLU HG3 3.500 . 3.800 3.354 3.318 3.396 . 0 0 "[ . 1 . 2]" 1
1475 2 9 GLU H 2 10 THR H 3.500 . 3.800 2.658 2.593 2.772 . 0 0 "[ . 1 . 2]" 1
1476 2 9 GLU H 2 11 LEU H 4.500 . 5.000 4.319 4.283 4.388 . 0 0 "[ . 1 . 2]" 1
1477 2 9 GLU H 2 11 LEU MD2 4.500 . 5.000 4.497 4.465 4.554 . 0 0 "[ . 1 . 2]" 1
1478 2 9 GLU H 2 12 ILE MD 4.500 . 5.000 3.853 3.686 3.920 . 0 0 "[ . 1 . 2]" 1
1479 2 9 GLU HA 2 12 ILE HB 4.500 . 5.000 2.523 2.341 2.775 . 0 0 "[ . 1 . 2]" 1
1480 2 9 GLU HA 2 12 ILE MD 3.500 . 3.800 2.009 1.966 2.062 . 0 0 "[ . 1 . 2]" 1
1481 2 9 GLU HA 2 12 ILE MG 4.500 . 5.000 3.846 3.564 4.101 . 0 0 "[ . 1 . 2]" 1
1482 2 9 GLU HB2 2 10 THR H 4.500 . 5.000 2.772 2.681 2.886 . 0 0 "[ . 1 . 2]" 1
1483 2 9 GLU HB3 2 10 THR H 4.500 . 5.000 3.891 3.797 4.033 . 0 0 "[ . 1 . 2]" 1
1484 2 9 GLU HB3 2 10 THR MG 5.200 . 5.700 4.334 4.221 4.455 . 0 0 "[ . 1 . 2]" 1
1485 2 9 GLU HB3 2 12 ILE MD 4.500 . 5.000 4.037 3.922 4.123 . 0 0 "[ . 1 . 2]" 1
1486 2 9 GLU HG2 2 10 THR MG 5.200 . 5.700 5.001 4.780 5.130 . 0 0 "[ . 1 . 2]" 1
1487 2 9 GLU HG2 2 12 ILE MD 4.500 . 5.000 3.890 3.744 4.037 . 0 0 "[ . 1 . 2]" 1
1488 2 10 THR H 2 10 THR MG 3.500 . 3.800 2.103 2.066 2.130 . 0 0 "[ . 1 . 2]" 1
1489 2 10 THR H 2 11 LEU H 4.500 . 5.000 2.578 2.495 2.614 . 0 0 "[ . 1 . 2]" 1
1490 2 10 THR H 2 11 LEU MD2 4.500 . 5.000 3.625 3.530 3.685 . 0 0 "[ . 1 . 2]" 1
1491 2 10 THR H 2 12 ILE HB 5.200 . 5.700 4.872 4.598 5.041 . 0 0 "[ . 1 . 2]" 1
1492 2 10 THR H 2 12 ILE MD 4.500 . 5.000 4.877 4.860 4.889 . 0 0 "[ . 1 . 2]" 1
1493 2 10 THR HA 2 10 THR MG 3.500 . 3.800 2.438 2.408 2.509 . 0 0 "[ . 1 . 2]" 1
1494 2 10 THR HA 2 13 ASN HB2 4.500 . 5.000 3.853 3.716 3.980 . 0 0 "[ . 1 . 2]" 1
1495 2 10 THR HA 2 13 ASN HB3 4.500 . 5.000 2.386 2.270 2.484 . 0 0 "[ . 1 . 2]" 1
1496 2 10 THR HA 2 13 ASN HD21 4.500 . 5.000 2.732 2.634 2.855 . 0 0 "[ . 1 . 2]" 1
1497 2 10 THR HA 2 13 ASN HD22 4.500 . 5.000 4.370 4.279 4.492 . 0 0 "[ . 1 . 2]" 1
1498 2 10 THR HB 2 11 LEU H 3.500 . 3.800 3.767 3.680 3.973 0.173 16 0 "[ . 1 . 2]" 1
1499 2 10 THR HB 2 11 LEU MD1 4.500 . 5.000 4.063 3.894 4.450 . 0 0 "[ . 1 . 2]" 1
1500 2 10 THR HB 2 12 ILE H 5.200 . 5.700 5.512 5.502 5.519 . 0 0 "[ . 1 . 2]" 1
1501 2 10 THR HB 2 13 ASN H 5.200 . 5.700 5.053 4.938 5.120 . 0 0 "[ . 1 . 2]" 1
1502 2 10 THR HB 2 14 VAL QG 4.500 . 5.000 4.246 4.109 4.491 . 0 0 "[ . 1 . 2]" 1
1503 2 10 THR MG 2 11 LEU H 4.500 . 5.000 3.737 3.692 3.754 . 0 0 "[ . 1 . 2]" 1
1504 2 10 THR MG 2 11 LEU MD2 4.500 . 5.000 4.065 3.990 4.133 . 0 0 "[ . 1 . 2]" 1
1505 2 10 THR MG 2 13 ASN HD22 4.500 . 5.000 5.290 5.146 5.509 0.509 5 1 "[ + 1 . 2]" 1
1506 2 11 LEU H 2 11 LEU QB 3.500 . 3.800 2.376 2.350 2.408 . 0 0 "[ . 1 . 2]" 1
1507 2 11 LEU H 2 11 LEU MD1 4.500 . 5.000 2.955 2.872 3.125 . 0 0 "[ . 1 . 2]" 1
1508 2 11 LEU H 2 11 LEU MD2 3.500 . 3.800 2.102 2.045 2.157 . 0 0 "[ . 1 . 2]" 1
1509 2 11 LEU H 2 11 LEU HG 4.500 . 5.000 4.063 4.047 4.074 . 0 0 "[ . 1 . 2]" 1
1510 2 11 LEU H 2 12 ILE H 4.500 . 5.000 2.594 2.490 2.650 . 0 0 "[ . 1 . 2]" 1
1511 2 11 LEU H 2 12 ILE MD 5.200 . 5.700 5.050 5.001 5.103 . 0 0 "[ . 1 . 2]" 1
1512 2 11 LEU H 2 12 ILE HG13 4.500 . 5.000 4.609 4.506 4.688 . 0 0 "[ . 1 . 2]" 1
1513 2 11 LEU H 2 13 ASN H 5.200 . 5.700 4.080 4.040 4.109 . 0 0 "[ . 1 . 2]" 1
1514 2 11 LEU H 2 71 PHE QE 4.500 . 5.000 4.179 4.076 4.250 . 0 0 "[ . 1 . 2]" 1
1515 2 11 LEU H 2 74 TYR QE 5.200 . 5.700 5.231 5.112 5.367 . 0 0 "[ . 1 . 2]" 1
1516 2 11 LEU QB 2 12 ILE H 4.500 . 5.000 2.639 2.609 2.677 . 0 0 "[ . 1 . 2]" 1
1517 2 11 LEU QB 2 78 VAL MG2 5.200 . 5.700 4.488 4.332 4.620 . 0 0 "[ . 1 . 2]" 1
1518 2 11 LEU MD1 2 74 TYR QD 4.500 . 5.000 3.806 3.605 3.963 . 0 0 "[ . 1 . 2]" 1
1519 2 11 LEU MD1 2 74 TYR QE 4.500 . 5.000 2.524 2.325 2.704 . 0 0 "[ . 1 . 2]" 1
1520 2 11 LEU MD1 2 78 VAL MG1 2.700 . 3.000 2.517 2.364 2.716 . 0 0 "[ . 1 . 2]" 1
1521 2 11 LEU MD2 2 12 ILE H 4.500 . 5.000 3.954 3.893 4.005 . 0 0 "[ . 1 . 2]" 1
1522 2 11 LEU MD2 2 71 PHE QD 5.200 . 5.700 5.321 5.168 5.416 . 0 0 "[ . 1 . 2]" 1
1523 2 11 LEU MD2 2 71 PHE QE 4.500 . 5.000 3.740 3.582 3.829 . 0 0 "[ . 1 . 2]" 1
1524 2 11 LEU MD2 2 75 VAL QG 4.500 . 5.000 2.501 2.288 2.705 . 0 0 "[ . 1 . 2]" 1
1525 2 11 LEU HG 2 71 PHE QE 5.200 . 5.700 4.195 3.999 4.301 . 0 0 "[ . 1 . 2]" 1
1526 2 11 LEU HG 2 75 VAL H 5.200 . 5.700 4.803 4.699 4.878 . 0 0 "[ . 1 . 2]" 1
1527 2 11 LEU HG 2 75 VAL HA 4.500 . 5.000 3.063 2.985 3.240 . 0 0 "[ . 1 . 2]" 1
1528 2 11 LEU HG 2 78 VAL MG2 3.500 . 3.800 3.169 2.980 3.325 . 0 0 "[ . 1 . 2]" 1
1529 2 12 ILE H 2 12 ILE HB 3.500 . 3.800 2.426 2.267 2.532 . 0 0 "[ . 1 . 2]" 1
1530 2 12 ILE H 2 12 ILE MD 3.500 . 3.800 3.439 3.404 3.508 . 0 0 "[ . 1 . 2]" 1
1531 2 12 ILE H 2 12 ILE HG13 3.500 . 3.800 2.435 2.334 2.599 . 0 0 "[ . 1 . 2]" 1
1532 2 12 ILE H 2 12 ILE MG 4.500 . 5.000 3.809 3.734 3.852 . 0 0 "[ . 1 . 2]" 1
1533 2 12 ILE H 2 13 ASN H 3.500 . 3.800 2.639 2.595 2.690 . 0 0 "[ . 1 . 2]" 1
1534 2 12 ILE H 2 13 ASN HA 5.200 . 5.700 5.242 5.206 5.286 . 0 0 "[ . 1 . 2]" 1
1535 2 12 ILE H 2 13 ASN HB3 4.500 . 5.000 4.381 4.332 4.418 . 0 0 "[ . 1 . 2]" 1
1536 2 12 ILE H 2 14 VAL QG 4.500 . 5.000 4.416 4.364 4.469 . 0 0 "[ . 1 . 2]" 1
1537 2 12 ILE H 2 15 PHE HB2 4.500 . 5.000 5.091 4.970 5.190 0.190 17 0 "[ . 1 . 2]" 1
1538 2 12 ILE H 2 71 PHE QD 4.500 . 5.000 4.807 4.751 4.821 . 0 0 "[ . 1 . 2]" 1
1539 2 12 ILE H 2 71 PHE QE 4.500 . 5.000 2.716 2.691 2.755 . 0 0 "[ . 1 . 2]" 1
1540 2 12 ILE HA 2 12 ILE MD 4.500 . 5.000 3.897 3.850 3.938 . 0 0 "[ . 1 . 2]" 1
1541 2 12 ILE HA 2 14 VAL H 4.500 . 5.000 4.499 4.449 4.515 . 0 0 "[ . 1 . 2]" 1
1542 2 12 ILE HA 2 15 PHE H 3.500 . 3.800 3.322 3.259 3.408 . 0 0 "[ . 1 . 2]" 1
1543 2 12 ILE HA 2 15 PHE HB3 4.500 . 5.000 2.187 2.124 2.295 . 0 0 "[ . 1 . 2]" 1
1544 2 12 ILE HA 2 16 HIS H 4.500 . 5.000 3.047 2.962 3.102 . 0 0 "[ . 1 . 2]" 1
1545 2 12 ILE HA 2 17 ALA H 5.200 . 5.700 5.410 5.402 5.422 . 0 0 "[ . 1 . 2]" 1
1546 2 12 ILE HA 2 71 PHE QE 4.500 . 5.000 2.750 2.657 2.878 . 0 0 "[ . 1 . 2]" 1
1547 2 12 ILE HB 2 12 ILE MD 3.500 . 3.800 2.370 2.339 2.390 . 0 0 "[ . 1 . 2]" 1
1548 2 12 ILE HB 2 13 ASN H 3.500 . 3.800 2.707 2.646 2.757 . 0 0 "[ . 1 . 2]" 1
1549 2 12 ILE HB 2 15 PHE H 5.200 . 5.700 5.505 5.476 5.519 . 0 0 "[ . 1 . 2]" 1
1550 2 12 ILE MD 2 12 ILE MG 3.500 . 3.800 2.110 2.075 2.158 . 0 0 "[ . 1 . 2]" 1
1551 2 12 ILE MD 2 16 HIS HB2 5.200 . 5.700 5.442 5.120 5.530 . 0 0 "[ . 1 . 2]" 1
1552 2 12 ILE HG12 2 71 PHE QE 5.200 . 5.700 3.207 3.089 3.309 . 0 0 "[ . 1 . 2]" 1
1553 2 12 ILE HG13 2 13 ASN H 4.500 . 5.000 4.463 4.373 4.566 . 0 0 "[ . 1 . 2]" 1
1554 2 12 ILE MG 2 13 ASN H 3.500 . 3.800 3.318 3.060 3.455 . 0 0 "[ . 1 . 2]" 1
1555 2 12 ILE MG 2 14 VAL H 4.500 . 5.000 4.996 4.867 5.085 0.085 8 0 "[ . 1 . 2]" 1
1556 2 12 ILE MG 2 14 VAL QG 5.200 . 5.700 5.177 5.128 5.216 . 0 0 "[ . 1 . 2]" 1
1557 2 12 ILE MG 2 15 PHE H 4.500 . 5.000 4.635 4.582 4.710 . 0 0 "[ . 1 . 2]" 1
1558 2 12 ILE MG 2 16 HIS H 4.500 . 5.000 3.430 3.318 3.602 . 0 0 "[ . 1 . 2]" 1
1559 2 12 ILE MG 2 16 HIS HB2 4.500 . 5.000 2.487 2.204 2.610 . 0 0 "[ . 1 . 2]" 1
1560 2 12 ILE MG 2 17 ALA H 5.200 . 5.700 4.977 4.902 5.061 . 0 0 "[ . 1 . 2]" 1
1561 2 13 ASN H 2 13 ASN HB3 3.500 . 3.800 2.021 2.003 2.038 . 0 0 "[ . 1 . 2]" 1
1562 2 13 ASN H 2 13 ASN HD21 4.500 . 5.000 3.541 3.459 3.576 . 0 0 "[ . 1 . 2]" 1
1563 2 13 ASN H 2 13 ASN HD22 4.500 . 5.000 4.987 4.923 5.002 0.002 12 0 "[ . 1 . 2]" 1
1564 2 13 ASN H 2 14 VAL H 3.500 . 3.800 2.909 2.860 2.959 . 0 0 "[ . 1 . 2]" 1
1565 2 13 ASN H 2 14 VAL QG 4.500 . 5.000 3.819 3.778 3.851 . 0 0 "[ . 1 . 2]" 1
1566 2 13 ASN H 2 15 PHE H 4.500 . 5.000 4.053 4.014 4.100 . 0 0 "[ . 1 . 2]" 1
1567 2 13 ASN HA 2 13 ASN HD21 4.500 . 5.000 4.476 4.453 4.506 . 0 0 "[ . 1 . 2]" 1
1568 2 13 ASN HA 2 14 VAL QG 5.200 . 5.700 4.427 4.407 4.441 . 0 0 "[ . 1 . 2]" 1
1569 2 13 ASN HA 2 15 PHE H 4.500 . 5.000 4.606 4.547 4.650 . 0 0 "[ . 1 . 2]" 1
1570 2 13 ASN HA 2 16 HIS H 4.500 . 5.000 4.538 4.376 4.612 . 0 0 "[ . 1 . 2]" 1
1571 2 13 ASN HA 2 16 HIS HB2 4.500 . 5.000 4.432 4.115 4.979 . 0 0 "[ . 1 . 2]" 1
1572 2 13 ASN HA 2 17 ALA H 4.500 . 5.000 4.581 4.379 4.682 . 0 0 "[ . 1 . 2]" 1
1573 2 13 ASN HA 2 17 ALA MB 5.200 . 5.700 4.289 4.214 4.384 . 0 0 "[ . 1 . 2]" 1
1574 2 13 ASN HB2 2 14 VAL H 4.500 . 5.000 4.138 4.130 4.144 . 0 0 "[ . 1 . 2]" 1
1575 2 13 ASN HB3 2 13 ASN HD22 3.500 . 3.800 3.437 3.426 3.450 . 0 0 "[ . 1 . 2]" 1
1576 2 13 ASN HB3 2 14 VAL H 3.500 . 3.800 3.170 3.135 3.234 . 0 0 "[ . 1 . 2]" 1
1577 2 13 ASN HB3 2 14 VAL QG 4.500 . 5.000 3.713 3.666 3.780 . 0 0 "[ . 1 . 2]" 1
1578 2 13 ASN HD21 2 14 VAL H 5.200 . 5.700 2.995 2.918 3.068 . 0 0 "[ . 1 . 2]" 1
1579 2 13 ASN HD21 2 14 VAL QG 4.500 . 5.000 2.511 2.417 2.558 . 0 0 "[ . 1 . 2]" 1
1580 2 13 ASN HD22 2 14 VAL H 4.500 . 5.000 3.685 3.592 3.758 . 0 0 "[ . 1 . 2]" 1
1581 2 13 ASN HD22 2 14 VAL HB 4.500 . 5.000 5.063 5.000 5.091 0.091 13 0 "[ . 1 . 2]" 1
1582 2 14 VAL H 2 14 VAL HB 3.500 . 3.800 3.679 3.662 3.689 . 0 0 "[ . 1 . 2]" 1
1583 2 14 VAL H 2 14 VAL QG 3.500 . 3.800 1.864 1.845 1.883 . 0 0 "[ . 1 . 2]" 1
1584 2 14 VAL H 2 15 PHE H 3.500 . 3.800 2.433 2.416 2.451 . 0 0 "[ . 1 . 2]" 1
1585 2 14 VAL H 2 15 PHE HA 5.200 . 5.700 5.090 5.063 5.096 . 0 0 "[ . 1 . 2]" 1
1586 2 14 VAL H 2 15 PHE HB2 5.200 . 5.700 4.750 4.683 4.812 . 0 0 "[ . 1 . 2]" 1
1587 2 14 VAL H 2 15 PHE HB3 4.500 . 5.000 4.596 4.553 4.646 . 0 0 "[ . 1 . 2]" 1
1588 2 14 VAL H 2 16 HIS H 4.500 . 5.000 4.482 4.378 4.560 . 0 0 "[ . 1 . 2]" 1
1589 2 14 VAL H 2 17 ALA H 4.500 . 5.000 4.721 4.630 4.823 . 0 0 "[ . 1 . 2]" 1
1590 2 14 VAL HA 2 17 ALA MB 3.500 . 3.800 2.424 2.303 2.690 . 0 0 "[ . 1 . 2]" 1
1591 2 14 VAL HB 2 15 PHE H 4.500 . 5.000 3.942 3.901 4.005 . 0 0 "[ . 1 . 2]" 1
1592 2 14 VAL QG 2 15 PHE H 3.500 . 3.800 2.269 2.219 2.303 . 0 0 "[ . 1 . 2]" 1
1593 2 14 VAL QG 2 15 PHE HA 4.500 . 5.000 3.146 3.038 3.228 . 0 0 "[ . 1 . 2]" 1
1594 2 14 VAL QG 2 15 PHE HB2 4.500 . 5.000 3.204 3.101 3.263 . 0 0 "[ . 1 . 2]" 1
1595 2 14 VAL QG 2 16 HIS H 4.500 . 5.000 4.379 4.317 4.424 . 0 0 "[ . 1 . 2]" 1
1596 2 14 VAL QG 2 17 ALA H 5.200 . 5.700 4.467 4.428 4.531 . 0 0 "[ . 1 . 2]" 1
1597 2 14 VAL QG 2 18 HIS H 4.500 . 5.000 5.111 5.034 5.166 0.166 7 0 "[ . 1 . 2]" 1
1598 2 14 VAL QG 2 18 HIS HD2 3.500 . 3.800 4.383 3.985 4.719 0.919 7 14 "[ **** + ** * -.*****]" 1
1599 2 14 VAL QG 2 36 LEU MD2 3.500 . 3.800 3.568 3.367 3.698 . 0 0 "[ . 1 . 2]" 1
1600 2 14 VAL QG 2 40 GLU HG2 5.200 . 5.700 3.941 3.833 3.977 . 0 0 "[ . 1 . 2]" 1
1601 2 14 VAL QG 2 40 GLU HG3 4.500 . 5.000 2.733 2.595 3.000 . 0 0 "[ . 1 . 2]" 1
1602 2 15 PHE H 2 15 PHE HB2 3.500 . 3.800 2.558 2.509 2.615 . 0 0 "[ . 1 . 2]" 1
1603 2 15 PHE H 2 15 PHE HB3 3.500 . 3.800 2.417 2.359 2.441 . 0 0 "[ . 1 . 2]" 1
1604 2 15 PHE H 2 16 HIS H 3.500 . 3.800 2.692 2.627 2.760 . 0 0 "[ . 1 . 2]" 1
1605 2 15 PHE H 2 16 HIS HB2 5.200 . 5.700 4.664 4.550 4.937 . 0 0 "[ . 1 . 2]" 1
1606 2 15 PHE H 2 17 ALA H 4.500 . 5.000 3.662 3.612 3.738 . 0 0 "[ . 1 . 2]" 1
1607 2 15 PHE H 2 17 ALA MB 4.500 . 5.000 4.389 4.299 4.487 . 0 0 "[ . 1 . 2]" 1
1608 2 15 PHE H 2 36 LEU MD2 5.200 . 5.700 4.756 4.625 4.926 . 0 0 "[ . 1 . 2]" 1
1609 2 15 PHE H 2 74 TYR QD 5.200 . 5.700 4.702 4.549 4.935 . 0 0 "[ . 1 . 2]" 1
1610 2 15 PHE HA 2 36 LEU MD2 4.500 . 5.000 2.939 2.781 3.134 . 0 0 "[ . 1 . 2]" 1
1611 2 15 PHE HA 2 74 TYR QD 4.500 . 5.000 4.465 4.364 4.641 . 0 0 "[ . 1 . 2]" 1
1612 2 15 PHE HB2 2 16 HIS H 3.500 . 3.800 3.542 3.464 3.574 . 0 0 "[ . 1 . 2]" 1
1613 2 15 PHE HB3 2 16 HIS H 4.500 . 5.000 2.069 1.975 2.120 . 0 0 "[ . 1 . 2]" 1
1614 2 15 PHE HB3 2 74 TYR QD 4.500 . 5.000 4.168 3.903 4.482 . 0 0 "[ . 1 . 2]" 1
1615 2 15 PHE HB3 2 74 TYR QE 4.500 . 5.000 4.572 4.245 4.884 . 0 0 "[ . 1 . 2]" 1
1616 2 15 PHE QD 2 16 HIS H 5.200 . 5.700 3.111 2.970 3.284 . 0 0 "[ . 1 . 2]" 1
1617 2 15 PHE QE 2 28 LEU QD 5.200 . 5.700 2.881 2.620 3.088 . 0 0 "[ . 1 . 2]" 1
1618 2 15 PHE HZ 2 27 LYS H 4.500 . 5.000 4.255 3.879 4.741 . 0 0 "[ . 1 . 2]" 1
1619 2 15 PHE HZ 2 27 LYS HA 4.500 . 5.000 2.888 2.621 3.130 . 0 0 "[ . 1 . 2]" 1
1620 2 15 PHE HZ 2 28 LEU H 4.500 . 5.000 3.820 3.513 4.141 . 0 0 "[ . 1 . 2]" 1
1621 2 15 PHE HZ 2 28 LEU HB2 4.500 . 5.000 3.590 3.248 3.906 . 0 0 "[ . 1 . 2]" 1
1622 2 15 PHE HZ 2 28 LEU QD 5.200 . 5.700 4.273 4.020 4.530 . 0 0 "[ . 1 . 2]" 1
1623 2 15 PHE HZ 2 70 ASP HA 4.500 . 5.000 2.563 2.366 2.737 . 0 0 "[ . 1 . 2]" 1
1624 2 15 PHE HZ 2 71 PHE H 4.500 . 5.000 2.898 2.822 2.982 . 0 0 "[ . 1 . 2]" 1
1625 2 15 PHE HZ 2 72 GLN H 5.200 . 5.700 5.508 5.500 5.513 . 0 0 "[ . 1 . 2]" 1
1626 2 16 HIS H 2 16 HIS HB2 3.500 . 3.800 2.222 2.116 2.431 . 0 0 "[ . 1 . 2]" 1
1627 2 16 HIS H 2 16 HIS HD2 5.200 . 5.700 4.070 3.283 4.872 . 0 0 "[ . 1 . 2]" 1
1628 2 16 HIS H 2 17 ALA H 3.500 . 3.800 2.594 2.534 2.635 . 0 0 "[ . 1 . 2]" 1
1629 2 16 HIS H 2 17 ALA MB 4.500 . 5.000 4.304 4.287 4.323 . 0 0 "[ . 1 . 2]" 1
1630 2 16 HIS H 2 18 HIS H 4.500 . 5.000 4.328 4.249 4.475 . 0 0 "[ . 1 . 2]" 1
1631 2 16 HIS H 2 36 LEU MD2 5.200 . 5.700 5.557 5.429 5.702 0.002 17 0 "[ . 1 . 2]" 1
1632 2 16 HIS HB2 2 17 ALA H 4.500 . 5.000 3.557 3.338 3.993 . 0 0 "[ . 1 . 2]" 1
1633 2 16 HIS HB3 2 17 ALA H 3.500 . 3.800 3.629 2.810 3.886 0.086 20 0 "[ . 1 . 2]" 1
1634 2 17 ALA H 2 17 ALA MB 2.700 . 3.000 2.229 2.200 2.267 . 0 0 "[ . 1 . 2]" 1
1635 2 17 ALA H 2 18 HIS H 3.500 . 3.800 2.565 2.485 2.714 . 0 0 "[ . 1 . 2]" 1
1636 2 17 ALA H 2 36 LEU MD2 5.200 . 5.700 4.888 4.843 4.938 . 0 0 "[ . 1 . 2]" 1
1637 2 17 ALA MB 2 18 HIS H 3.500 . 3.800 2.670 2.582 2.792 . 0 0 "[ . 1 . 2]" 1
1638 2 17 ALA MB 2 18 HIS HA 5.200 . 5.700 4.012 3.972 4.048 . 0 0 "[ . 1 . 2]" 1
1639 2 17 ALA MB 2 18 HIS HD2 3.500 . 3.800 2.442 2.122 3.066 . 0 0 "[ . 1 . 2]" 1
1640 2 18 HIS H 2 18 HIS HB2 3.500 . 3.800 2.425 2.302 2.671 . 0 0 "[ . 1 . 2]" 1
1641 2 18 HIS H 2 18 HIS HB3 3.500 . 3.800 3.660 3.584 3.790 . 0 0 "[ . 1 . 2]" 1
1642 2 18 HIS H 2 18 HIS HD2 4.500 . 5.000 2.892 2.657 3.384 . 0 0 "[ . 1 . 2]" 1
1643 2 18 HIS H 2 36 LEU MD2 3.500 . 3.800 3.552 3.434 3.627 . 0 0 "[ . 1 . 2]" 1
1644 2 18 HIS HA 2 28 LEU QD 4.500 . 5.000 3.883 3.641 4.153 . 0 0 "[ . 1 . 2]" 1
1645 2 18 HIS HA 2 36 LEU MD2 5.200 . 5.700 4.566 4.484 4.677 . 0 0 "[ . 1 . 2]" 1
1646 2 18 HIS HB2 2 28 LEU QD 4.500 . 5.000 2.346 2.080 2.693 . 0 0 "[ . 1 . 2]" 1
1647 2 18 HIS HB2 2 32 GLU QG 4.500 . 5.000 3.371 2.999 4.406 . 0 0 "[ . 1 . 2]" 1
1648 2 18 HIS HB2 2 36 LEU MD2 4.500 . 5.000 2.227 2.115 2.410 . 0 0 "[ . 1 . 2]" 1
1649 2 18 HIS HB3 2 28 LEU QD 4.500 . 5.000 2.659 2.170 3.287 . 0 0 "[ . 1 . 2]" 1
1650 2 18 HIS HB3 2 32 GLU QG 4.500 . 5.000 2.515 2.049 3.666 . 0 0 "[ . 1 . 2]" 1
1651 2 18 HIS HB3 2 36 LEU MD2 4.500 . 5.000 3.060 2.933 3.202 . 0 0 "[ . 1 . 2]" 1
1652 2 18 HIS HD2 2 36 LEU MD2 4.500 . 5.000 2.633 1.950 2.975 . 0 0 "[ . 1 . 2]" 1
1653 2 19 SER HA 2 28 LEU HA 5.200 . 5.700 3.864 3.152 4.348 . 0 0 "[ . 1 . 2]" 1
1654 2 19 SER HA 2 28 LEU HB3 4.500 . 5.000 4.515 4.185 4.782 . 0 0 "[ . 1 . 2]" 1
1655 2 19 SER HA 2 28 LEU QD . . 3.800 2.033 1.807 2.224 . 0 0 "[ . 1 . 2]" 1
1656 2 19 SER QB 2 25 LYS H 5.200 . 5.700 5.219 4.721 5.373 . 0 0 "[ . 1 . 2]" 1
1657 2 19 SER QB 2 25 LYS HA 3.500 . 3.800 2.900 2.035 3.450 . 0 0 "[ . 1 . 2]" 1
1658 2 19 SER QB 2 27 LYS H 4.500 . 5.000 3.364 2.884 3.988 . 0 0 "[ . 1 . 2]" 1
1659 2 19 SER QB 2 28 LEU QD 4.500 . 5.000 3.116 2.499 3.536 . 0 0 "[ . 1 . 2]" 1
1660 2 20 GLY H 2 21 LYS H 4.500 . 5.000 2.463 2.222 2.668 . 0 0 "[ . 1 . 2]" 1
1661 2 20 GLY H 2 21 LYS HB2 4.500 . 5.000 4.401 4.212 4.444 . 0 0 "[ . 1 . 2]" 1
1662 2 20 GLY H 2 21 LYS QG 4.500 . 5.000 4.326 3.917 4.723 . 0 0 "[ . 1 . 2]" 1
1663 2 20 GLY H 2 22 GLU H 4.500 . 5.000 3.242 2.935 3.477 . 0 0 "[ . 1 . 2]" 1
1664 2 20 GLY H 2 27 LYS H 5.200 . 5.700 3.894 3.411 4.336 . 0 0 "[ . 1 . 2]" 1
1665 2 20 GLY H 2 28 LEU HA 4.500 . 5.000 3.655 3.060 3.858 . 0 0 "[ . 1 . 2]" 1
1666 2 20 GLY H 2 28 LEU HB2 5.200 . 5.700 4.427 3.838 5.173 . 0 0 "[ . 1 . 2]" 1
1667 2 20 GLY H 2 28 LEU HB3 5.200 . 5.700 5.512 5.502 5.526 . 0 0 "[ . 1 . 2]" 1
1668 2 20 GLY H 2 28 LEU QD 4.500 . 5.000 2.862 2.565 3.235 . 0 0 "[ . 1 . 2]" 1
1669 2 20 GLY QA 2 21 LYS QE 4.500 . 5.000 5.472 3.462 6.470 1.470 16 11 "[* -.* * * * .+****]" 1
1670 2 21 LYS H 2 21 LYS QD 5.200 . 5.700 3.846 3.545 4.253 . 0 0 "[ . 1 . 2]" 1
1671 2 21 LYS H 2 21 LYS QG 4.500 . 5.000 2.255 2.039 2.469 . 0 0 "[ . 1 . 2]" 1
1672 2 21 LYS H 2 22 GLU H 4.500 . 5.000 2.553 2.250 2.719 . 0 0 "[ . 1 . 2]" 1
1673 2 21 LYS HA 2 21 LYS QD 3.500 . 3.800 2.389 2.057 3.807 0.007 10 0 "[ . 1 . 2]" 1
1674 2 21 LYS HA 2 21 LYS QE 3.500 . 3.800 3.199 2.787 3.286 . 0 0 "[ . 1 . 2]" 1
1675 2 21 LYS HA 2 21 LYS QG 3.500 . 3.800 2.772 1.989 3.071 . 0 0 "[ . 1 . 2]" 1
1676 2 21 LYS HB2 2 22 GLU H 4.500 . 5.000 2.811 2.462 3.168 . 0 0 "[ . 1 . 2]" 1
1677 2 22 GLU H 2 22 GLU QG 4.500 . 5.000 3.906 3.065 4.053 . 0 0 "[ . 1 . 2]" 1
1678 2 22 GLU H 2 23 GLY H 4.500 . 5.000 2.492 2.143 3.050 . 0 0 "[ . 1 . 2]" 1
1679 2 22 GLU H 2 24 ASP H 4.500 . 5.000 3.860 3.631 4.074 . 0 0 "[ . 1 . 2]" 1
1680 2 22 GLU HA 2 22 GLU QG 3.500 . 3.800 2.587 2.222 3.350 . 0 0 "[ . 1 . 2]" 1
1681 2 22 GLU HA 2 23 GLY HA2 5.200 . 5.700 4.827 4.367 5.018 . 0 0 "[ . 1 . 2]" 1
1682 2 22 GLU HA 2 23 GLY HA3 4.500 . 5.000 4.428 4.062 4.565 . 0 0 "[ . 1 . 2]" 1
1683 2 22 GLU HA 2 24 ASP H 4.500 . 5.000 4.710 4.516 5.013 0.013 3 0 "[ . 1 . 2]" 1
1684 2 22 GLU HB2 2 29 SER HA 4.500 . 5.000 3.983 3.731 4.052 . 0 0 "[ . 1 . 2]" 1
1685 2 22 GLU HB2 2 29 SER QB 4.500 . 5.000 3.317 2.871 3.750 . 0 0 "[ . 1 . 2]" 1
1686 2 22 GLU HB3 2 23 GLY H 4.500 . 5.000 3.286 2.856 4.014 . 0 0 "[ . 1 . 2]" 1
1687 2 22 GLU HB3 2 24 ASP H 4.500 . 5.000 3.159 2.468 4.909 . 0 0 "[ . 1 . 2]" 1
1688 2 22 GLU HB3 2 29 SER QB 5.200 . 5.700 4.544 2.191 5.344 . 0 0 "[ . 1 . 2]" 1
1689 2 22 GLU QG 2 23 GLY H 4.500 . 5.000 3.875 3.028 4.022 . 0 0 "[ . 1 . 2]" 1
1690 2 22 GLU QG 2 23 GLY HA3 4.500 . 5.000 3.872 3.841 3.933 . 0 0 "[ . 1 . 2]" 1
1691 2 22 GLU QG 2 24 ASP H 4.500 . 5.000 3.624 2.691 4.475 . 0 0 "[ . 1 . 2]" 1
1692 2 22 GLU QG 2 69 VAL H 5.200 . 5.700 4.678 3.960 5.261 . 0 0 "[ . 1 . 2]" 1
1693 2 23 GLY HA2 2 24 ASP HA 4.500 . 5.000 4.512 4.406 4.579 . 0 0 "[ . 1 . 2]" 1
1694 2 23 GLY HA3 2 24 ASP HA 4.500 . 5.000 4.543 4.436 4.611 . 0 0 "[ . 1 . 2]" 1
1695 2 24 ASP H 2 25 LYS H 4.500 . 5.000 4.488 4.403 4.561 . 0 0 "[ . 1 . 2]" 1
1696 2 24 ASP H 2 27 LYS H 5.200 . 5.700 4.479 4.096 4.948 . 0 0 "[ . 1 . 2]" 1
1697 2 24 ASP H 2 27 LYS HB2 4.500 . 5.000 3.085 2.495 3.496 . 0 0 "[ . 1 . 2]" 1
1698 2 24 ASP H 2 27 LYS HB3 5.200 . 5.700 4.542 3.969 4.934 . 0 0 "[ . 1 . 2]" 1
1699 2 24 ASP H 2 27 LYS HG2 5.200 . 5.700 4.824 4.173 5.165 . 0 0 "[ . 1 . 2]" 1
1700 2 24 ASP QB 2 27 LYS H 4.500 . 5.000 3.381 3.030 3.711 . 0 0 "[ . 1 . 2]" 1
1701 2 24 ASP QB 2 27 LYS HG3 4.500 . 5.000 2.525 2.291 2.996 . 0 0 "[ . 1 . 2]" 1
1702 2 25 LYS H 2 25 LYS QD 4.500 . 5.000 2.628 1.684 3.939 0.116 13 0 "[ . 1 . 2]" 1
1703 2 25 LYS H 2 25 LYS QE 5.200 . 5.700 3.953 3.114 4.564 . 0 0 "[ . 1 . 2]" 1
1704 2 25 LYS H 2 25 LYS QG 3.500 . 3.800 2.175 1.645 2.526 0.155 6 0 "[ . 1 . 2]" 1
1705 2 25 LYS H 2 27 LYS H 4.500 . 5.000 4.041 3.750 4.332 . 0 0 "[ . 1 . 2]" 1
1706 2 25 LYS QG 2 26 TYR H 4.500 . 5.000 2.731 2.256 3.978 . 0 0 "[ . 1 . 2]" 1
1707 2 26 TYR H 2 26 TYR HB2 3.500 . 3.800 2.542 2.383 2.618 . 0 0 "[ . 1 . 2]" 1
1708 2 26 TYR H 2 26 TYR QD 3.500 . 3.800 3.256 2.968 3.429 . 0 0 "[ . 1 . 2]" 1
1709 2 26 TYR H 2 26 TYR QE 5.200 . 5.700 4.689 4.511 4.858 . 0 0 "[ . 1 . 2]" 1
1710 2 26 TYR H 2 27 LYS H 3.500 . 3.800 2.307 1.955 2.516 . 0 0 "[ . 1 . 2]" 1
1711 2 26 TYR H 2 27 LYS HG2 3.500 . 3.800 3.158 2.965 3.381 . 0 0 "[ . 1 . 2]" 1
1712 2 26 TYR H 2 27 LYS HG3 5.200 . 5.700 4.680 4.391 4.912 . 0 0 "[ . 1 . 2]" 1
1713 2 26 TYR HA 2 26 TYR QD 3.500 . 3.800 2.177 2.074 2.280 . 0 0 "[ . 1 . 2]" 1
1714 2 26 TYR HA 2 26 TYR QE 4.500 . 5.000 4.414 4.274 4.476 . 0 0 "[ . 1 . 2]" 1
1715 2 26 TYR HB2 2 26 TYR QE 4.500 . 5.000 4.433 4.406 4.469 . 0 0 "[ . 1 . 2]" 1
1716 2 26 TYR HB2 2 27 LYS H 4.500 . 5.000 3.679 3.291 3.928 . 0 0 "[ . 1 . 2]" 1
1717 2 26 TYR HB3 2 27 LYS H 4.500 . 5.000 4.377 4.218 4.448 . 0 0 "[ . 1 . 2]" 1
1718 2 26 TYR QD 2 27 LYS H 4.500 . 5.000 4.656 4.445 4.746 . 0 0 "[ . 1 . 2]" 1
1719 2 27 LYS H 2 27 LYS HB2 3.500 . 3.800 2.658 2.577 2.723 . 0 0 "[ . 1 . 2]" 1
1720 2 27 LYS H 2 27 LYS HG2 3.500 . 3.800 2.907 2.672 3.055 . 0 0 "[ . 1 . 2]" 1
1721 2 27 LYS H 2 27 LYS HG3 4.500 . 5.000 4.162 4.042 4.289 . 0 0 "[ . 1 . 2]" 1
1722 2 27 LYS H 2 28 LEU H 4.500 . 5.000 4.432 4.379 4.484 . 0 0 "[ . 1 . 2]" 1
1723 2 27 LYS H 2 28 LEU HA 5.200 . 5.700 4.910 4.740 5.101 . 0 0 "[ . 1 . 2]" 1
1724 2 27 LYS H 2 28 LEU HB2 4.500 . 5.000 4.931 4.598 5.158 0.158 3 0 "[ . 1 . 2]" 1
1725 2 27 LYS H 2 28 LEU QD 5.200 . 5.700 4.941 4.600 5.207 . 0 0 "[ . 1 . 2]" 1
1726 2 27 LYS HA 2 27 LYS HD2 3.500 . 3.800 2.297 2.217 2.421 . 0 0 "[ . 1 . 2]" 1
1727 2 27 LYS HA 2 27 LYS HD3 4.500 . 5.000 3.886 3.820 3.992 . 0 0 "[ . 1 . 2]" 1
1728 2 27 LYS HA 2 27 LYS HE3 4.500 . 5.000 4.114 3.867 4.383 . 0 0 "[ . 1 . 2]" 1
1729 2 27 LYS HA 2 69 VAL H 5.200 . 5.700 4.634 4.496 4.743 . 0 0 "[ . 1 . 2]" 1
1730 2 27 LYS HA 2 70 ASP HB3 4.500 . 5.000 4.069 3.815 4.398 . 0 0 "[ . 1 . 2]" 1
1731 2 27 LYS HB2 2 28 LEU H 4.500 . 5.000 3.694 3.494 3.802 . 0 0 "[ . 1 . 2]" 1
1732 2 27 LYS HD2 2 28 LEU H 4.500 . 5.000 4.124 3.935 4.304 . 0 0 "[ . 1 . 2]" 1
1733 2 27 LYS HD2 2 70 ASP HA 4.500 . 5.000 2.935 2.654 3.222 . 0 0 "[ . 1 . 2]" 1
1734 2 27 LYS HD2 2 70 ASP HB2 4.500 . 5.000 2.819 2.611 3.142 . 0 0 "[ . 1 . 2]" 1
1735 2 27 LYS HD3 2 70 ASP HA 4.500 . 5.000 4.629 4.321 4.907 . 0 0 "[ . 1 . 2]" 1
1736 2 27 LYS HD3 2 70 ASP HB2 4.500 . 5.000 3.961 3.627 4.246 . 0 0 "[ . 1 . 2]" 1
1737 2 27 LYS HE2 2 28 LEU H 4.500 . 5.000 3.424 3.140 3.670 . 0 0 "[ . 1 . 2]" 1
1738 2 27 LYS HE2 2 70 ASP HB2 5.200 . 5.700 4.465 4.194 4.542 . 0 0 "[ . 1 . 2]" 1
1739 2 27 LYS HE3 2 70 ASP HB2 4.500 . 5.000 3.909 3.403 4.346 . 0 0 "[ . 1 . 2]" 1
1740 2 27 LYS HG3 2 28 LEU H 5.200 . 5.700 5.020 4.907 5.047 . 0 0 "[ . 1 . 2]" 1
1741 2 28 LEU H 2 28 LEU HB2 3.500 . 3.800 3.080 2.729 3.377 . 0 0 "[ . 1 . 2]" 1
1742 2 28 LEU H 2 28 LEU QD 4.500 . 5.000 4.016 3.969 4.054 . 0 0 "[ . 1 . 2]" 1
1743 2 28 LEU H 2 68 GLU HA 5.200 . 5.700 4.515 4.377 4.658 . 0 0 "[ . 1 . 2]" 1
1744 2 28 LEU H 2 69 VAL H 3.500 . 3.800 2.903 2.805 3.028 . 0 0 "[ . 1 . 2]" 1
1745 2 28 LEU H 2 69 VAL HA 4.500 . 5.000 4.859 4.733 4.988 . 0 0 "[ . 1 . 2]" 1
1746 2 28 LEU H 2 70 ASP H 5.200 . 5.700 4.937 4.788 5.111 . 0 0 "[ . 1 . 2]" 1
1747 2 28 LEU H 2 70 ASP HB2 5.200 . 5.700 5.380 5.219 5.507 . 0 0 "[ . 1 . 2]" 1
1748 2 28 LEU H 2 70 ASP HB3 4.500 . 5.000 5.157 5.030 5.303 0.303 8 0 "[ . 1 . 2]" 1
1749 2 28 LEU HA 2 28 LEU QD . . 3.800 2.031 1.962 2.151 . 0 0 "[ . 1 . 2]" 1
1750 2 28 LEU HA 2 29 SER H 3.500 . 3.800 2.325 2.244 2.436 . 0 0 "[ . 1 . 2]" 1
1751 2 28 LEU HB2 2 29 SER H 4.500 . 5.000 4.162 4.031 4.196 . 0 0 "[ . 1 . 2]" 1
1752 2 28 LEU HB3 2 29 SER H 3.500 . 3.800 3.425 2.686 3.884 0.084 16 0 "[ . 1 . 2]" 1
1753 2 28 LEU HB3 2 69 VAL H 4.500 . 5.000 4.773 4.414 4.995 . 0 0 "[ . 1 . 2]" 1
1754 2 28 LEU QD 2 29 SER H 3.500 . 3.800 2.085 1.770 2.548 0.030 5 0 "[ . 1 . 2]" 1
1755 2 28 LEU QD 2 32 GLU HB3 3.500 . 3.800 2.325 2.128 2.559 . 0 0 "[ . 1 . 2]" 1
1756 2 28 LEU QD 2 32 GLU QG 3.500 . 3.800 1.974 1.869 2.086 . 0 0 "[ . 1 . 2]" 1
1757 2 28 LEU QD 2 33 LEU H 4.500 . 5.000 3.807 3.598 3.952 . 0 0 "[ . 1 . 2]" 1
1758 2 28 LEU QD 2 69 VAL H 5.200 . 5.700 5.306 5.219 5.388 . 0 0 "[ . 1 . 2]" 1
1759 2 29 SER H 2 29 SER HB2 3.500 . 3.800 3.513 2.338 3.633 . 0 0 "[ . 1 . 2]" 1
1760 2 29 SER H 2 29 SER QB 3.500 . 3.800 2.623 2.310 2.851 . 0 0 "[ . 1 . 2]" 1
1761 2 29 SER H 2 29 SER HB3 3.500 . 3.800 2.767 2.570 3.591 . 0 0 "[ . 1 . 2]" 1
1762 2 29 SER H 2 32 GLU HB3 3.500 . 3.800 3.658 3.419 3.708 . 0 0 "[ . 1 . 2]" 1
1763 2 29 SER H 2 68 GLU HA 4.500 . 5.000 4.577 4.378 4.674 . 0 0 "[ . 1 . 2]" 1
1764 2 29 SER H 2 68 GLU QB 5.200 . 5.700 5.096 4.520 5.303 . 0 0 "[ . 1 . 2]" 1
1765 2 29 SER HA 2 68 GLU H 5.200 . 5.700 4.623 4.382 4.705 . 0 0 "[ . 1 . 2]" 1
1766 2 29 SER HA 2 68 GLU QB 4.500 . 5.000 3.487 2.875 3.747 . 0 0 "[ . 1 . 2]" 1
1767 2 29 SER QB 2 30 LYS H 3.500 . 3.800 2.672 2.550 2.811 . 0 0 "[ . 1 . 2]" 1
1768 2 29 SER QB 2 30 LYS HB2 5.200 . 5.700 4.231 4.088 4.428 . 0 0 "[ . 1 . 2]" 1
1769 2 29 SER QB 2 31 LYS H 4.500 . 5.000 2.935 2.553 3.110 . 0 0 "[ . 1 . 2]" 1
1770 2 29 SER QB 2 31 LYS QG 4.500 . 5.000 2.441 2.043 2.632 . 0 0 "[ . 1 . 2]" 1
1771 2 29 SER QB 2 32 GLU H 4.500 . 5.000 3.519 2.956 3.725 . 0 0 "[ . 1 . 2]" 1
1772 2 29 SER QB 2 68 GLU HA 4.500 . 5.000 3.503 3.189 3.712 . 0 0 "[ . 1 . 2]" 1
1773 2 29 SER QB 2 68 GLU QB 5.200 . 5.700 4.059 3.609 4.488 . 0 0 "[ . 1 . 2]" 1
1774 2 29 SER HB2 2 30 LYS H 4.500 . 5.000 2.779 2.583 3.797 . 0 0 "[ . 1 . 2]" 1
1775 2 29 SER HB2 2 68 GLU HA 4.500 . 5.000 4.073 3.819 4.421 . 0 0 "[ . 1 . 2]" 1
1776 2 29 SER HB2 2 69 VAL H 5.200 . 5.700 5.515 5.505 5.529 . 0 0 "[ . 1 . 2]" 1
1777 2 29 SER HB3 2 30 LYS H 4.500 . 5.000 3.833 2.683 4.069 . 0 0 "[ . 1 . 2]" 1
1778 2 29 SER HB3 2 68 GLU HA 4.500 . 5.000 3.860 3.308 4.125 . 0 0 "[ . 1 . 2]" 1
1779 2 29 SER HB3 2 69 VAL H 5.200 . 5.700 5.244 4.881 5.466 . 0 0 "[ . 1 . 2]" 1
1780 2 30 LYS H 2 30 LYS HB2 3.500 . 3.800 2.235 2.145 2.306 . 0 0 "[ . 1 . 2]" 1
1781 2 30 LYS H 2 30 LYS HB3 3.500 . 3.800 3.531 3.477 3.572 . 0 0 "[ . 1 . 2]" 1
1782 2 30 LYS H 2 30 LYS HD2 4.500 . 5.000 4.073 3.865 4.383 . 0 0 "[ . 1 . 2]" 1
1783 2 30 LYS H 2 32 GLU H 4.500 . 5.000 4.428 4.214 4.523 . 0 0 "[ . 1 . 2]" 1
1784 2 30 LYS H 2 61 LEU MD1 4.500 . 5.000 4.804 4.722 4.905 . 0 0 "[ . 1 . 2]" 1
1785 2 30 LYS H 2 61 LEU MD2 5.200 . 5.700 5.027 4.972 5.045 . 0 0 "[ . 1 . 2]" 1
1786 2 30 LYS H 2 67 GLY H 4.500 . 5.000 3.831 3.589 3.961 . 0 0 "[ . 1 . 2]" 1
1787 2 30 LYS H 2 68 GLU H 5.200 . 5.700 4.567 4.358 4.895 . 0 0 "[ . 1 . 2]" 1
1788 2 30 LYS H 2 68 GLU HA 4.500 . 5.000 3.175 2.682 3.508 . 0 0 "[ . 1 . 2]" 1
1789 2 30 LYS H 2 69 VAL H 4.500 . 5.000 4.179 4.012 4.369 . 0 0 "[ . 1 . 2]" 1
1790 2 30 LYS H 2 69 VAL MG2 4.500 . 5.000 2.952 2.717 3.178 . 0 0 "[ . 1 . 2]" 1
1791 2 30 LYS HA 2 61 LEU MD1 4.500 . 5.000 3.706 3.572 3.816 . 0 0 "[ . 1 . 2]" 1
1792 2 30 LYS HA 2 69 VAL H 5.200 . 5.700 5.095 4.849 5.413 . 0 0 "[ . 1 . 2]" 1
1793 2 30 LYS HB2 2 31 LYS H 3.500 . 3.800 2.828 2.715 2.965 . 0 0 "[ . 1 . 2]" 1
1794 2 30 LYS HB2 2 31 LYS HB3 4.500 . 5.000 4.723 4.598 4.878 . 0 0 "[ . 1 . 2]" 1
1795 2 30 LYS HB2 2 65 GLY H 4.500 . 5.000 4.382 4.373 4.391 . 0 0 "[ . 1 . 2]" 1
1796 2 30 LYS HB2 2 65 GLY QA 4.500 . 5.000 2.141 2.070 2.209 . 0 0 "[ . 1 . 2]" 1
1797 2 30 LYS HB2 2 66 ASP H 5.200 . 5.700 4.681 4.552 4.813 . 0 0 "[ . 1 . 2]" 1
1798 2 30 LYS HB2 2 67 GLY H 4.500 . 5.000 3.398 3.206 3.615 . 0 0 "[ . 1 . 2]" 1
1799 2 30 LYS HB3 2 31 LYS H 3.500 . 3.800 3.307 3.237 3.367 . 0 0 "[ . 1 . 2]" 1
1800 2 30 LYS HB3 2 61 LEU MD1 3.500 . 3.800 2.095 2.020 2.193 . 0 0 "[ . 1 . 2]" 1
1801 2 30 LYS HB3 2 61 LEU MD2 3.500 . 3.800 2.195 2.113 2.255 . 0 0 "[ . 1 . 2]" 1
1802 2 30 LYS HB3 2 64 ASN H 5.200 . 5.700 5.497 5.334 5.512 . 0 0 "[ . 1 . 2]" 1
1803 2 30 LYS HB3 2 65 GLY H 4.500 . 5.000 4.604 4.414 4.682 . 0 0 "[ . 1 . 2]" 1
1804 2 30 LYS HB3 2 65 GLY QA 4.500 . 5.000 2.414 2.246 2.516 . 0 0 "[ . 1 . 2]" 1
1805 2 30 LYS HD2 2 61 LEU MD2 4.500 . 5.000 3.686 3.632 3.795 . 0 0 "[ . 1 . 2]" 1
1806 2 30 LYS HD2 2 64 ASN H 5.200 . 5.700 5.130 5.055 5.255 . 0 0 "[ . 1 . 2]" 1
1807 2 30 LYS HD2 2 65 GLY H 5.200 . 5.700 5.024 4.936 5.116 . 0 0 "[ . 1 . 2]" 1
1808 2 30 LYS HD2 2 66 ASP H 5.200 . 5.700 5.699 5.498 5.858 0.158 3 0 "[ . 1 . 2]" 1
1809 2 30 LYS HD2 2 67 GLY H 4.500 . 5.000 4.041 3.776 4.337 . 0 0 "[ . 1 . 2]" 1
1810 2 30 LYS HD3 2 65 GLY QA 5.200 . 5.700 3.796 3.621 3.983 . 0 0 "[ . 1 . 2]" 1
1811 2 30 LYS HD3 2 67 GLY H 5.200 . 5.700 5.210 4.932 5.332 . 0 0 "[ . 1 . 2]" 1
1812 2 31 LYS H 2 31 LYS HB3 3.500 . 3.800 2.525 2.490 2.546 . 0 0 "[ . 1 . 2]" 1
1813 2 31 LYS H 2 31 LYS QE 4.500 . 5.000 4.029 3.472 4.832 . 0 0 "[ . 1 . 2]" 1
1814 2 31 LYS H 2 31 LYS QG 3.500 . 3.800 2.142 2.081 2.273 . 0 0 "[ . 1 . 2]" 1
1815 2 31 LYS H 2 32 GLU H 3.500 . 3.800 2.877 2.748 2.958 . 0 0 "[ . 1 . 2]" 1
1816 2 31 LYS H 2 61 LEU MD2 4.500 . 5.000 4.813 4.701 4.888 . 0 0 "[ . 1 . 2]" 1
1817 2 31 LYS H 2 65 GLY H 4.500 . 5.000 5.100 5.045 5.120 0.120 9 0 "[ . 1 . 2]" 1
1818 2 31 LYS H 2 65 GLY QA 3.500 . 3.800 2.416 2.375 2.455 . 0 0 "[ . 1 . 2]" 1
1819 2 31 LYS H 2 69 VAL MG2 4.500 . 5.000 4.916 4.711 5.133 0.133 5 0 "[ . 1 . 2]" 1
1820 2 31 LYS HA 2 31 LYS QG 3.500 . 3.800 3.383 3.370 3.394 . 0 0 "[ . 1 . 2]" 1
1821 2 31 LYS HA 2 65 GLY H 5.200 . 5.700 5.467 5.364 5.510 . 0 0 "[ . 1 . 2]" 1
1822 2 31 LYS HB3 2 32 GLU H 4.500 . 5.000 4.039 3.976 4.117 . 0 0 "[ . 1 . 2]" 1
1823 2 31 LYS QD 2 65 GLY H 4.500 . 5.000 5.470 5.302 5.725 0.725 13 9 "[ -*** ** +*. *2]" 1
1824 2 31 LYS QD 2 65 GLY QA 3.500 . 3.800 3.523 3.342 3.803 0.003 13 0 "[ . 1 . 2]" 1
1825 2 31 LYS QD 2 66 ASP H 4.500 . 5.000 4.088 3.862 4.477 . 0 0 "[ . 1 . 2]" 1
1826 2 31 LYS QG 2 32 GLU H 3.500 . 3.800 2.239 2.125 2.370 . 0 0 "[ . 1 . 2]" 1
1827 2 31 LYS QG 2 32 GLU HA 3.500 . 3.800 3.359 3.126 3.442 . 0 0 "[ . 1 . 2]" 1
1828 2 31 LYS QG 2 32 GLU HB2 4.500 . 5.000 3.177 3.064 3.287 . 0 0 "[ . 1 . 2]" 1
1829 2 31 LYS QG 2 32 GLU HB3 4.500 . 5.000 4.304 4.186 4.452 . 0 0 "[ . 1 . 2]" 1
1830 2 31 LYS QG 2 65 GLY H 5.200 . 5.700 6.083 5.931 6.235 0.535 4 4 "[ +. * - . *2]" 1
1831 2 31 LYS QG 2 66 ASP H 5.200 . 5.700 5.183 4.945 5.352 . 0 0 "[ . 1 . 2]" 1
1832 2 32 GLU H 2 32 GLU HB3 3.500 . 3.800 2.755 2.615 3.118 . 0 0 "[ . 1 . 2]" 1
1833 2 32 GLU H 2 33 LEU H 3.500 . 3.800 2.583 2.491 2.685 . 0 0 "[ . 1 . 2]" 1
1834 2 32 GLU H 2 33 LEU HG 5.200 . 5.700 4.313 4.159 4.508 . 0 0 "[ . 1 . 2]" 1
1835 2 32 GLU H 2 34 LYS H 4.500 . 5.000 4.126 3.933 4.221 . 0 0 "[ . 1 . 2]" 1
1836 2 32 GLU H 2 35 GLU H 5.200 . 5.700 4.872 4.736 5.017 . 0 0 "[ . 1 . 2]" 1
1837 2 32 GLU HA 2 34 LYS H 4.500 . 5.000 4.324 4.243 4.370 . 0 0 "[ . 1 . 2]" 1
1838 2 32 GLU HB3 2 33 LEU H 3.500 . 3.800 2.591 2.492 2.797 . 0 0 "[ . 1 . 2]" 1
1839 2 32 GLU HB3 2 33 LEU HB2 4.500 . 5.000 4.880 4.763 5.049 0.049 13 0 "[ . 1 . 2]" 1
1840 2 32 GLU HB3 2 33 LEU HG 3.500 . 3.800 3.433 3.292 3.573 . 0 0 "[ . 1 . 2]" 1
1841 2 33 LEU H 2 33 LEU HB2 3.500 . 3.800 2.494 2.445 2.531 . 0 0 "[ . 1 . 2]" 1
1842 2 33 LEU H 2 33 LEU MD1 4.500 . 5.000 3.633 3.577 3.708 . 0 0 "[ . 1 . 2]" 1
1843 2 33 LEU H 2 33 LEU HG 4.500 . 5.000 2.315 2.210 2.463 . 0 0 "[ . 1 . 2]" 1
1844 2 33 LEU H 2 34 LYS H 3.500 . 3.800 2.647 2.570 2.710 . 0 0 "[ . 1 . 2]" 1
1845 2 33 LEU H 2 34 LYS HA 5.200 . 5.700 5.300 5.244 5.338 . 0 0 "[ . 1 . 2]" 1
1846 2 33 LEU H 2 34 LYS QB 4.500 . 5.000 4.368 4.228 4.470 . 0 0 "[ . 1 . 2]" 1
1847 2 33 LEU H 2 35 GLU H 4.500 . 5.000 4.065 3.951 4.165 . 0 0 "[ . 1 . 2]" 1
1848 2 33 LEU H 2 36 LEU MD2 4.500 . 5.000 4.213 4.077 4.280 . 0 0 "[ . 1 . 2]" 1
1849 2 33 LEU H 2 61 LEU MD1 5.200 . 5.700 4.471 4.238 4.708 . 0 0 "[ . 1 . 2]" 1
1850 2 33 LEU HA 2 33 LEU MD1 4.500 . 5.000 3.852 3.828 3.879 . 0 0 "[ . 1 . 2]" 1
1851 2 33 LEU HA 2 36 LEU H 3.500 . 3.800 3.461 3.406 3.508 . 0 0 "[ . 1 . 2]" 1
1852 2 33 LEU HA 2 37 LEU H 4.500 . 5.000 3.872 3.808 3.935 . 0 0 "[ . 1 . 2]" 1
1853 2 33 LEU HA 2 37 LEU QD 5.200 . 5.700 5.557 5.445 5.647 . 0 0 "[ . 1 . 2]" 1
1854 2 33 LEU HB2 2 34 LYS H 3.500 . 3.800 2.683 2.626 2.741 . 0 0 "[ . 1 . 2]" 1
1855 2 33 LEU HB2 2 35 GLU H 4.500 . 5.000 4.978 4.896 5.062 0.062 20 0 "[ . 1 . 2]" 1
1856 2 33 LEU HB2 2 36 LEU H 5.200 . 5.700 5.742 5.668 5.798 0.098 17 0 "[ . 1 . 2]" 1
1857 2 33 LEU HB3 2 34 LYS H 3.500 . 3.800 3.701 3.611 3.788 . 0 0 "[ . 1 . 2]" 1
1858 2 33 LEU HG 2 34 LYS H 4.500 . 5.000 4.393 4.300 4.534 . 0 0 "[ . 1 . 2]" 1
1859 2 34 LYS H 2 35 GLU H 3.500 . 3.800 2.631 2.532 2.713 . 0 0 "[ . 1 . 2]" 1
1860 2 34 LYS H 2 36 LEU MD2 4.500 . 5.000 5.259 5.176 5.349 0.349 10 0 "[ . 1 . 2]" 1
1861 2 34 LYS H 2 61 LEU MD1 4.500 . 5.000 3.094 2.919 3.268 . 0 0 "[ . 1 . 2]" 1
1862 2 34 LYS HA 2 37 LEU QB 4.500 . 5.000 2.760 2.536 3.014 . 0 0 "[ . 1 . 2]" 1
1863 2 34 LYS HA 2 37 LEU QD 3.500 . 3.800 3.869 3.765 3.965 0.165 1 0 "[ . 1 . 2]" 1
1864 2 34 LYS HA 2 38 GLN HB3 4.500 . 5.000 5.256 5.120 5.459 0.459 3 0 "[ . 1 . 2]" 1
1865 2 34 LYS QB 2 35 GLU H 3.500 . 3.800 2.769 2.557 3.168 . 0 0 "[ . 1 . 2]" 1
1866 2 34 LYS QD 2 61 LEU HG 3.500 . 3.800 2.809 2.344 3.398 . 0 0 "[ . 1 . 2]" 1
1867 2 34 LYS QE 2 61 LEU MD1 4.500 . 5.000 3.749 2.316 4.087 . 0 0 "[ . 1 . 2]" 1
1868 2 34 LYS QG 2 37 LEU QD 4.500 . 5.000 4.260 3.895 4.971 . 0 0 "[ . 1 . 2]" 1
1869 2 34 LYS QG 2 38 GLN QE 4.500 . 5.000 2.301 2.148 2.528 . 0 0 "[ . 1 . 2]" 1
1870 2 34 LYS QG 2 38 GLN QG 4.500 . 5.000 4.141 3.906 4.395 . 0 0 "[ . 1 . 2]" 1
1871 2 35 GLU H 2 35 GLU QB 2.700 . 3.000 2.307 2.017 2.528 . 0 0 "[ . 1 . 2]" 1
1872 2 35 GLU H 2 36 LEU H 3.500 . 3.800 2.627 2.529 2.692 . 0 0 "[ . 1 . 2]" 1
1873 2 35 GLU H 2 36 LEU HA 5.200 . 5.700 5.250 5.169 5.309 . 0 0 "[ . 1 . 2]" 1
1874 2 35 GLU H 2 36 LEU MD2 4.500 . 5.000 4.913 4.879 5.002 0.002 19 0 "[ . 1 . 2]" 1
1875 2 35 GLU H 2 36 LEU HG 4.500 . 5.000 4.298 4.270 4.320 . 0 0 "[ . 1 . 2]" 1
1876 2 35 GLU H 2 37 LEU H 4.500 . 5.000 3.899 3.826 3.963 . 0 0 "[ . 1 . 2]" 1
1877 2 35 GLU H 2 37 LEU QD 4.500 . 5.000 5.829 5.778 5.883 0.883 20 20 [***********-*******+] 1
1878 2 35 GLU HA 2 35 GLU HG3 3.500 . 3.800 3.002 2.328 3.754 . 0 0 "[ . 1 . 2]" 1
1879 2 35 GLU HA 2 36 LEU HA 5.200 . 5.700 4.690 4.659 4.715 . 0 0 "[ . 1 . 2]" 1
1880 2 35 GLU HA 2 38 GLN H 4.500 . 5.000 3.563 3.343 3.787 . 0 0 "[ . 1 . 2]" 1
1881 2 35 GLU HA 2 38 GLN QE 4.500 . 5.000 2.653 2.452 2.850 . 0 0 "[ . 1 . 2]" 1
1882 2 35 GLU HA 2 38 GLN QG 4.500 . 5.000 2.336 2.122 2.617 . 0 0 "[ . 1 . 2]" 1
1883 2 35 GLU HA 2 39 THR H 4.500 . 5.000 4.437 4.275 4.676 . 0 0 "[ . 1 . 2]" 1
1884 2 35 GLU QB 2 36 LEU H 3.500 . 3.800 2.585 2.394 2.747 . 0 0 "[ . 1 . 2]" 1
1885 2 35 GLU HG2 2 36 LEU H 4.500 . 5.000 4.575 3.877 5.200 0.200 6 0 "[ . 1 . 2]" 1
1886 2 36 LEU H 2 36 LEU HB2 3.500 . 3.800 3.661 3.646 3.679 . 0 0 "[ . 1 . 2]" 1
1887 2 36 LEU H 2 36 LEU MD1 4.500 . 5.000 3.785 3.678 3.831 . 0 0 "[ . 1 . 2]" 1
1888 2 36 LEU H 2 36 LEU MD2 3.500 . 3.800 3.273 3.223 3.346 . 0 0 "[ . 1 . 2]" 1
1889 2 36 LEU H 2 36 LEU HG 3.500 . 3.800 2.363 2.284 2.440 . 0 0 "[ . 1 . 2]" 1
1890 2 36 LEU H 2 37 LEU H 3.500 . 3.800 2.605 2.553 2.668 . 0 0 "[ . 1 . 2]" 1
1891 2 36 LEU H 2 37 LEU QD 4.500 . 5.000 5.525 5.478 5.577 0.577 2 16 "[*+**. * ***-* ******]" 1
1892 2 36 LEU H 2 39 THR H 5.200 . 5.700 4.874 4.762 5.010 . 0 0 "[ . 1 . 2]" 1
1893 2 36 LEU HA 2 39 THR H 4.500 . 5.000 3.273 3.137 3.387 . 0 0 "[ . 1 . 2]" 1
1894 2 36 LEU HA 2 39 THR HB 4.500 . 5.000 2.795 2.550 3.010 . 0 0 "[ . 1 . 2]" 1
1895 2 36 LEU HB2 2 37 LEU HA 4.500 . 5.000 4.769 4.725 4.814 . 0 0 "[ . 1 . 2]" 1
1896 2 36 LEU MD1 2 37 LEU H 3.500 . 3.800 2.837 2.715 2.926 . 0 0 "[ . 1 . 2]" 1
1897 2 36 LEU MD1 2 37 LEU HA 3.500 . 3.800 2.658 2.581 2.743 . 0 0 "[ . 1 . 2]" 1
1898 2 36 LEU MD1 2 37 LEU QB 3.500 . 3.800 3.115 3.019 3.184 . 0 0 "[ . 1 . 2]" 1
1899 2 36 LEU MD1 2 39 THR MG 4.500 . 5.000 4.308 4.168 4.444 . 0 0 "[ . 1 . 2]" 1
1900 2 36 LEU MD1 2 40 GLU H 4.500 . 5.000 4.660 4.368 4.879 . 0 0 "[ . 1 . 2]" 1
1901 2 36 LEU MD1 2 40 GLU HG3 4.500 . 5.000 3.521 2.988 3.838 . 0 0 "[ . 1 . 2]" 1
1902 2 36 LEU MD1 2 41 LEU H 4.500 . 5.000 5.312 5.039 5.571 0.571 14 1 "[ . 1 +. 2]" 1
1903 2 36 LEU MD1 2 74 TYR QD 4.500 . 5.000 4.204 3.935 4.334 . 0 0 "[ . 1 . 2]" 1
1904 2 36 LEU MD1 2 74 TYR QE 4.500 . 5.000 2.945 2.741 3.049 . 0 0 "[ . 1 . 2]" 1
1905 2 36 LEU HG 2 37 LEU H 3.500 . 3.800 2.613 2.527 2.753 . 0 0 "[ . 1 . 2]" 1
1906 2 36 LEU HG 2 74 TYR QE 4.500 . 5.000 4.370 3.896 4.569 . 0 0 "[ . 1 . 2]" 1
1907 2 37 LEU H 2 37 LEU QB 3.500 . 3.800 2.149 2.136 2.171 . 0 0 "[ . 1 . 2]" 1
1908 2 37 LEU H 2 37 LEU QD 3.500 . 3.800 3.675 3.662 3.684 . 0 0 "[ . 1 . 2]" 1
1909 2 37 LEU H 2 38 GLN H 3.500 . 3.800 2.745 2.719 2.780 . 0 0 "[ . 1 . 2]" 1
1910 2 37 LEU H 2 38 GLN QG 4.500 . 5.000 4.079 4.039 4.122 . 0 0 "[ . 1 . 2]" 1
1911 2 37 LEU H 2 39 THR H 4.500 . 5.000 3.998 3.937 4.050 . 0 0 "[ . 1 . 2]" 1
1912 2 37 LEU HA 2 40 GLU H 4.500 . 5.000 3.729 3.636 3.829 . 0 0 "[ . 1 . 2]" 1
1913 2 37 LEU HA 2 41 LEU H 4.500 . 5.000 3.614 3.376 3.774 . 0 0 "[ . 1 . 2]" 1
1914 2 37 LEU HA 2 41 LEU HB2 4.500 . 5.000 3.997 3.709 4.186 . 0 0 "[ . 1 . 2]" 1
1915 2 37 LEU HA 2 41 LEU QD 4.500 . 5.000 4.422 4.330 4.531 . 0 0 "[ . 1 . 2]" 1
1916 2 37 LEU QB 2 38 GLN H 3.500 . 3.800 2.589 2.519 2.625 . 0 0 "[ . 1 . 2]" 1
1917 2 37 LEU QB 2 40 GLU H 5.200 . 5.700 5.156 5.097 5.210 . 0 0 "[ . 1 . 2]" 1
1918 2 37 LEU QB 2 41 LEU QD 3.500 . 3.800 4.695 4.355 4.877 1.077 19 20 [****************-*+*] 1
1919 2 37 LEU QD 2 38 GLN H 3.500 . 3.800 3.115 3.024 3.159 . 0 0 "[ . 1 . 2]" 1
1920 2 37 LEU QD 2 38 GLN HB3 3.500 . 3.800 3.058 3.029 3.080 . 0 0 "[ . 1 . 2]" 1
1921 2 37 LEU QD 2 38 GLN QE 4.500 . 5.000 4.156 4.035 4.252 . 0 0 "[ . 1 . 2]" 1
1922 2 37 LEU QD 2 38 GLN QG 4.500 . 5.000 4.081 4.027 4.118 . 0 0 "[ . 1 . 2]" 1
1923 2 37 LEU QD 2 39 THR H 4.500 . 5.000 4.452 4.395 4.505 . 0 0 "[ . 1 . 2]" 1
1924 2 37 LEU QD 2 81 LEU H 4.500 . 5.000 5.491 5.140 5.836 0.836 13 10 "[* . *-1* + **** *]" 1
1925 2 38 GLN H 2 38 GLN HB3 3.500 . 3.800 2.684 2.634 2.733 . 0 0 "[ . 1 . 2]" 1
1926 2 38 GLN H 2 38 GLN QE 4.500 . 5.000 3.307 3.223 3.383 . 0 0 "[ . 1 . 2]" 1
1927 2 38 GLN H 2 38 GLN QG 3.500 . 3.800 1.977 1.934 2.003 . 0 0 "[ . 1 . 2]" 1
1928 2 38 GLN H 2 39 THR H 3.500 . 3.800 2.435 2.325 2.514 . 0 0 "[ . 1 . 2]" 1
1929 2 38 GLN H 2 39 THR HB 4.500 . 5.000 4.283 4.088 4.456 . 0 0 "[ . 1 . 2]" 1
1930 2 38 GLN H 2 39 THR MG 4.500 . 5.000 4.770 4.751 4.795 . 0 0 "[ . 1 . 2]" 1
1931 2 38 GLN H 2 40 GLU H 4.500 . 5.000 4.134 4.061 4.218 . 0 0 "[ . 1 . 2]" 1
1932 2 38 GLN HA 2 38 GLN QE 4.500 . 5.000 4.628 4.618 4.636 . 0 0 "[ . 1 . 2]" 1
1933 2 38 GLN HA 2 38 GLN QG . . 3.800 3.328 3.306 3.341 . 0 0 "[ . 1 . 2]" 1
1934 2 38 GLN HA 2 42 SER QB 5.200 . 5.700 4.540 3.898 5.347 . 0 0 "[ . 1 . 2]" 1
1935 2 38 GLN HA 2 45 LEU QD 3.500 . 3.800 4.361 3.653 4.905 1.105 11 12 "[** *. -***+ * * * *]" 1
1936 2 38 GLN HB2 2 45 LEU QD 4.500 . 5.000 4.683 3.869 5.189 0.189 20 0 "[ . 1 . 2]" 1
1937 2 38 GLN HB3 2 38 GLN QE . . 3.800 2.565 2.516 2.599 . 0 0 "[ . 1 . 2]" 1
1938 2 38 GLN HB3 2 39 THR H 4.500 . 5.000 4.200 4.162 4.239 . 0 0 "[ . 1 . 2]" 1
1939 2 38 GLN QG 2 39 THR H . . 3.800 2.636 2.605 2.677 . 0 0 "[ . 1 . 2]" 1
1940 2 38 GLN QG 2 39 THR HA 4.500 . 5.000 3.574 3.498 3.647 . 0 0 "[ . 1 . 2]" 1
1941 2 38 GLN QG 2 45 LEU QD 5.200 . 5.700 5.829 5.065 6.313 0.613 11 4 "[ . -+ * *]" 1
1942 2 38 GLN QG 2 45 LEU HG 4.500 . 5.000 6.285 5.264 7.054 2.054 15 18 "[**-** ***** **+*****]" 1
1943 2 39 THR H 2 39 THR HB 3.500 . 3.800 2.191 2.103 2.268 . 0 0 "[ . 1 . 2]" 1
1944 2 39 THR H 2 39 THR MG 3.500 . 3.800 2.927 2.841 3.051 . 0 0 "[ . 1 . 2]" 1
1945 2 39 THR H 2 40 GLU H 3.500 . 3.800 2.493 2.417 2.569 . 0 0 "[ . 1 . 2]" 1
1946 2 39 THR H 2 40 GLU HA 4.500 . 5.000 5.188 5.119 5.242 0.242 3 0 "[ . 1 . 2]" 1
1947 2 39 THR H 2 40 GLU HB2 4.500 . 5.000 4.510 4.383 4.630 . 0 0 "[ . 1 . 2]" 1
1948 2 39 THR HA 2 39 THR HB 2.700 . 3.000 2.774 2.721 2.805 . 0 0 "[ . 1 . 2]" 1
1949 2 39 THR HA 2 39 THR MG 3.500 . 3.800 3.124 3.074 3.152 . 0 0 "[ . 1 . 2]" 1
1950 2 39 THR HB 2 40 GLU H 4.500 . 5.000 3.644 3.484 3.842 . 0 0 "[ . 1 . 2]" 1
1951 2 39 THR HB 2 40 GLU HG3 5.200 . 5.700 5.510 5.499 5.521 . 0 0 "[ . 1 . 2]" 1
1952 2 39 THR MG 2 40 GLU H 4.500 . 5.000 2.506 2.432 2.621 . 0 0 "[ . 1 . 2]" 1
1953 2 39 THR MG 2 40 GLU HG2 3.500 . 3.800 2.183 2.053 2.287 . 0 0 "[ . 1 . 2]" 1
1954 2 39 THR MG 2 41 LEU H 4.500 . 5.000 4.524 4.460 4.587 . 0 0 "[ . 1 . 2]" 1
1955 2 40 GLU H 2 40 GLU HB2 3.500 . 3.800 2.256 2.167 2.340 . 0 0 "[ . 1 . 2]" 1
1956 2 40 GLU H 2 40 GLU HG2 3.500 . 3.800 3.021 2.825 3.148 . 0 0 "[ . 1 . 2]" 1
1957 2 40 GLU H 2 40 GLU HG3 3.500 . 3.800 3.468 3.240 3.562 . 0 0 "[ . 1 . 2]" 1
1958 2 40 GLU H 2 41 LEU H 3.500 . 3.800 2.354 2.270 2.419 . 0 0 "[ . 1 . 2]" 1
1959 2 40 GLU H 2 41 LEU HB2 5.200 . 5.700 4.747 4.420 4.895 . 0 0 "[ . 1 . 2]" 1
1960 2 40 GLU H 2 42 SER H 4.500 . 5.000 4.293 4.114 4.407 . 0 0 "[ . 1 . 2]" 1
1961 2 40 GLU HA 2 42 SER H 4.500 . 5.000 5.453 5.119 5.513 0.513 13 11 "[* - . **1**+ * ***]" 1
1962 2 40 GLU HB2 2 41 LEU H 4.500 . 5.000 2.489 2.442 2.596 . 0 0 "[ . 1 . 2]" 1
1963 2 40 GLU HG2 2 41 LEU H 4.500 . 5.000 4.569 4.506 4.588 . 0 0 "[ . 1 . 2]" 1
1964 2 40 GLU HG3 2 41 LEU H 4.500 . 5.000 4.619 4.591 4.630 . 0 0 "[ . 1 . 2]" 1
1965 2 41 LEU H 2 41 LEU HB2 3.500 . 3.800 2.569 2.270 2.710 . 0 0 "[ . 1 . 2]" 1
1966 2 41 LEU H 2 41 LEU QD 4.500 . 5.000 3.763 3.711 3.823 . 0 0 "[ . 1 . 2]" 1
1967 2 41 LEU H 2 41 LEU HG 4.500 . 5.000 4.506 4.269 4.557 . 0 0 "[ . 1 . 2]" 1
1968 2 41 LEU H 2 42 SER H 3.500 . 3.800 2.693 2.534 2.879 . 0 0 "[ . 1 . 2]" 1
1969 2 41 LEU H 2 42 SER HA 4.500 . 5.000 4.956 4.777 5.173 0.173 10 0 "[ . 1 . 2]" 1
1970 2 41 LEU H 2 43 GLY H 5.200 . 5.700 5.165 4.980 5.420 . 0 0 "[ . 1 . 2]" 1
1971 2 41 LEU HA 2 41 LEU QD . . 3.800 2.278 2.118 3.006 . 0 0 "[ . 1 . 2]" 1
1972 2 41 LEU HA 2 43 GLY H 5.200 . 5.700 4.159 4.043 4.242 . 0 0 "[ . 1 . 2]" 1
1973 2 41 LEU HB2 2 42 SER H 4.500 . 5.000 3.596 3.319 3.660 . 0 0 "[ . 1 . 2]" 1
1974 2 41 LEU HB3 2 42 SER H 4.500 . 5.000 2.148 2.089 2.215 . 0 0 "[ . 1 . 2]" 1
1975 2 41 LEU QD 2 42 SER H 4.500 . 5.000 3.455 2.550 3.631 . 0 0 "[ . 1 . 2]" 1
1976 2 41 LEU QD 2 43 GLY H 4.500 . 5.000 2.235 1.755 2.438 0.045 6 0 "[ . 1 . 2]" 1
1977 2 41 LEU QD 2 43 GLY HA3 4.500 . 5.000 2.698 2.471 3.725 . 0 0 "[ . 1 . 2]" 1
1978 2 41 LEU QD 2 44 PHE H 4.500 . 5.000 2.124 1.561 2.310 0.239 6 0 "[ . 1 . 2]" 1
1979 2 41 LEU QD 2 44 PHE HB3 5.200 . 5.700 3.132 2.893 3.285 . 0 0 "[ . 1 . 2]" 1
1980 2 41 LEU QD 2 44 PHE QD 4.500 . 5.000 2.038 1.837 2.313 . 0 0 "[ . 1 . 2]" 1
1981 2 41 LEU QD 2 44 PHE QE . . 5.000 3.705 3.445 4.011 . 0 0 "[ . 1 . 2]" 1
1982 2 41 LEU QD 2 78 VAL HA 3.500 . 3.800 4.639 4.035 5.003 1.203 13 19 "[*****-******+*** ***]" 1
1983 2 41 LEU HG 2 42 SER H 5.200 . 5.700 3.525 3.345 4.802 . 0 0 "[ . 1 . 2]" 1
1984 2 41 LEU HG 2 43 GLY H 5.200 . 5.700 2.406 2.018 4.479 . 0 0 "[ . 1 . 2]" 1
1985 2 41 LEU HG 2 44 PHE H 4.500 . 5.000 2.240 1.922 4.359 . 0 0 "[ . 1 . 2]" 1
1986 2 42 SER H 2 43 GLY H 3.500 . 3.800 3.081 2.970 3.279 . 0 0 "[ . 1 . 2]" 1
1987 2 42 SER H 2 45 LEU QD 5.200 . 5.700 3.626 3.221 3.970 . 0 0 "[ . 1 . 2]" 1
1988 2 42 SER HA 2 45 LEU H 4.500 . 5.000 4.372 4.246 4.474 . 0 0 "[ . 1 . 2]" 1
1989 2 42 SER HA 2 45 LEU QB 4.500 . 5.000 3.997 3.894 4.131 . 0 0 "[ . 1 . 2]" 1
1990 2 42 SER QB 2 45 LEU QB 4.500 . 5.000 5.607 5.277 5.904 0.904 12 15 "[ * ***-** +*******2]" 1
1991 2 42 SER QB 2 45 LEU QD 4.500 . 5.000 3.416 3.253 3.824 . 0 0 "[ . 1 . 2]" 1
1992 2 43 GLY H 2 44 PHE H 3.500 . 3.800 2.108 1.931 2.238 . 0 0 "[ . 1 . 2]" 1
1993 2 43 GLY H 2 44 PHE HA 5.200 . 5.700 4.701 4.591 4.780 . 0 0 "[ . 1 . 2]" 1
1994 2 43 GLY H 2 44 PHE HB3 4.500 . 5.000 5.144 4.874 5.514 0.514 10 2 "[ . + . - 2]" 1
1995 2 43 GLY H 2 44 PHE QD 4.500 . 5.000 4.861 4.203 5.231 0.231 16 0 "[ . 1 . 2]" 1
1996 2 43 GLY H 2 45 LEU H 4.500 . 5.000 3.010 2.915 3.111 . 0 0 "[ . 1 . 2]" 1
1997 2 43 GLY H 2 45 LEU QB 4.500 . 5.000 4.120 3.957 4.179 . 0 0 "[ . 1 . 2]" 1
1998 2 43 GLY H 2 46 ASP H 5.200 . 5.700 4.674 4.662 4.691 . 0 0 "[ . 1 . 2]" 1
1999 2 44 PHE H 2 44 PHE HB2 3.500 . 3.800 2.045 1.963 2.288 . 0 0 "[ . 1 . 2]" 1
2000 2 44 PHE H 2 44 PHE HB3 3.500 . 3.800 3.335 3.227 3.533 . 0 0 "[ . 1 . 2]" 1
2001 2 44 PHE H 2 44 PHE QD 4.500 . 5.000 3.136 2.572 3.364 . 0 0 "[ . 1 . 2]" 1
2002 2 44 PHE H 2 45 LEU H 3.500 . 3.800 2.560 2.156 2.617 . 0 0 "[ . 1 . 2]" 1
2003 2 44 PHE H 2 45 LEU QB 4.500 . 5.000 4.361 3.990 4.387 . 0 0 "[ . 1 . 2]" 1
2004 2 44 PHE H 2 45 LEU QD 4.500 . 5.000 3.289 2.925 3.358 . 0 0 "[ . 1 . 2]" 1
2005 2 44 PHE H 2 46 ASP H 4.500 . 5.000 4.202 4.084 4.233 . 0 0 "[ . 1 . 2]" 1
2006 2 44 PHE HA 2 44 PHE QD 3.500 . 3.800 2.945 2.546 3.049 . 0 0 "[ . 1 . 2]" 1
2007 2 44 PHE HA 2 45 LEU QD 4.500 . 5.000 4.165 4.104 4.214 . 0 0 "[ . 1 . 2]" 1
2008 2 44 PHE HA 2 82 THR HA 5.200 . 5.700 6.763 6.333 7.245 1.545 1 20 [+*****************-*] 1
2009 2 44 PHE HB2 2 45 LEU H 4.500 . 5.000 3.325 3.002 3.490 . 0 0 "[ . 1 . 2]" 1
2010 2 44 PHE HB2 2 45 LEU QD 4.500 . 5.000 4.450 4.294 4.503 . 0 0 "[ . 1 . 2]" 1
2011 2 44 PHE HB2 2 46 ASP H 5.200 . 5.700 5.158 5.019 5.187 . 0 0 "[ . 1 . 2]" 1
2012 2 44 PHE HB3 2 45 LEU H 4.500 . 5.000 3.466 3.232 3.866 . 0 0 "[ . 1 . 2]" 1
2013 2 44 PHE HB3 2 45 LEU QD 5.200 . 5.700 4.729 4.566 5.020 . 0 0 "[ . 1 . 2]" 1
2014 2 44 PHE QD 2 45 LEU H 4.500 . 5.000 4.772 4.474 4.885 . 0 0 "[ . 1 . 2]" 1
2015 2 44 PHE QD 2 47 ALA MB 4.500 . 5.000 2.814 2.200 3.643 . 0 0 "[ . 1 . 2]" 1
2016 2 44 PHE QD 2 85 CYS HB2 4.500 . 5.000 3.067 2.696 3.377 . 0 0 "[ . 1 . 2]" 1
2017 2 44 PHE QD 2 85 CYS HB3 4.500 . 5.000 3.897 3.143 4.446 . 0 0 "[ . 1 . 2]" 1
2018 2 44 PHE QE 2 82 THR HA 4.500 . 5.000 2.493 2.054 4.526 . 0 0 "[ . 1 . 2]" 1
2019 2 44 PHE QE 2 82 THR MG 4.500 . 5.000 3.337 2.884 3.920 . 0 0 "[ . 1 . 2]" 1
2020 2 45 LEU H 2 45 LEU QB 3.500 . 3.800 2.232 2.168 2.311 . 0 0 "[ . 1 . 2]" 1
2021 2 45 LEU H 2 45 LEU QD 3.500 . 3.800 1.980 1.904 2.121 . 0 0 "[ . 1 . 2]" 1
2022 2 45 LEU H 2 46 ASP H 3.500 . 3.800 2.573 2.458 2.702 . 0 0 "[ . 1 . 2]" 1
2023 2 45 LEU H 2 47 ALA H 4.500 . 5.000 3.800 3.711 3.967 . 0 0 "[ . 1 . 2]" 1
2024 2 45 LEU H 2 48 GLN HG2 5.200 . 5.700 5.589 4.815 6.198 0.498 16 0 "[ . 1 . 2]" 1
2025 2 45 LEU HA 2 45 LEU QD 3.500 . 3.800 3.139 3.115 3.156 . 0 0 "[ . 1 . 2]" 1
2026 2 45 LEU HA 2 48 GLN HE21 4.500 . 5.000 2.792 2.200 3.776 . 0 0 "[ . 1 . 2]" 1
2027 2 45 LEU HA 2 48 GLN HE22 4.500 . 5.000 3.283 2.657 3.549 . 0 0 "[ . 1 . 2]" 1
2028 2 45 LEU QB 2 46 ASP H . . 3.800 3.663 3.625 3.688 . 0 0 "[ . 1 . 2]" 1
2029 2 45 LEU QB 2 47 ALA H 5.200 . 5.700 4.961 4.768 5.172 . 0 0 "[ . 1 . 2]" 1
2030 2 45 LEU QB 2 48 GLN HE21 4.500 . 5.000 3.825 3.272 4.384 . 0 0 "[ . 1 . 2]" 1
2031 2 45 LEU QB 2 48 GLN HE22 4.500 . 5.000 3.840 3.285 4.182 . 0 0 "[ . 1 . 2]" 1
2032 2 45 LEU QD 2 48 GLN HE22 4.500 . 5.000 4.605 4.103 5.127 0.127 9 0 "[ . 1 . 2]" 1
2033 2 46 ASP H 2 47 ALA MB 4.500 . 5.000 3.700 3.538 3.794 . 0 0 "[ . 1 . 2]" 1
2034 2 46 ASP QB 2 47 ALA MB 4.500 . 5.000 3.897 3.581 4.741 . 0 0 "[ . 1 . 2]" 1
2035 2 47 ALA H 2 47 ALA MB 2.700 . 3.000 2.282 2.219 2.428 . 0 0 "[ . 1 . 2]" 1
2036 2 47 ALA H 2 48 GLN HA 4.500 . 5.000 5.022 4.496 5.345 0.345 2 0 "[ . 1 . 2]" 1
2037 2 47 ALA H 2 48 GLN HG2 4.500 . 5.000 4.459 3.575 5.216 0.216 14 0 "[ . 1 . 2]" 1
2038 2 47 ALA H 2 48 GLN HG3 4.500 . 5.000 4.031 2.827 5.492 0.492 15 0 "[ . 1 . 2]" 1
2039 2 47 ALA HA 2 48 GLN H 3.500 . 3.800 3.304 3.140 3.361 . 0 0 "[ . 1 . 2]" 1
2040 2 47 ALA MB 2 48 GLN H 3.500 . 3.800 3.182 2.770 3.493 . 0 0 "[ . 1 . 2]" 1
2041 2 47 ALA MB 2 85 CYS H 5.200 . 5.700 5.218 4.903 5.443 . 0 0 "[ . 1 . 2]" 1
2042 2 47 ALA MB 2 85 CYS HB2 4.500 . 5.000 3.043 2.712 3.278 . 0 0 "[ . 1 . 2]" 1
2043 2 48 GLN H 2 48 GLN HB2 3.500 . 3.800 2.883 2.436 3.782 . 0 0 "[ . 1 . 2]" 1
2044 2 48 GLN H 2 48 GLN HE21 4.500 . 5.000 4.168 3.437 4.933 . 0 0 "[ . 1 . 2]" 1
2045 2 48 GLN H 2 48 GLN HG2 3.500 . 3.800 2.828 1.575 3.462 0.225 17 0 "[ . 1 . 2]" 1
2046 2 48 GLN H 2 48 GLN HG3 3.500 . 3.800 2.396 1.805 3.448 . 0 0 "[ . 1 . 2]" 1
2047 2 48 GLN H 2 49 LYS H 4.500 . 5.000 4.636 4.498 4.779 . 0 0 "[ . 1 . 2]" 1
2048 2 48 GLN H 2 85 CYS HB2 5.200 . 5.700 4.570 4.106 4.934 . 0 0 "[ . 1 . 2]" 1
2049 2 48 GLN HA 2 49 LYS H 3.500 . 3.800 2.206 2.100 2.275 . 0 0 "[ . 1 . 2]" 1
2050 2 48 GLN HA 2 49 LYS HG2 3.500 . 3.800 3.537 3.350 3.772 . 0 0 "[ . 1 . 2]" 1
2051 2 48 GLN HA 2 54 VAL QG 4.500 . 5.000 4.071 3.673 4.307 . 0 0 "[ . 1 . 2]" 1
2052 2 48 GLN HA 2 85 CYS HA 4.500 . 5.000 2.958 2.555 3.481 . 0 0 "[ . 1 . 2]" 1
2053 2 48 GLN HB2 2 48 GLN HE21 4.500 . 5.000 3.503 2.245 4.456 . 0 0 "[ . 1 . 2]" 1
2054 2 48 GLN HB2 2 54 VAL QG 4.500 . 5.000 2.479 2.069 2.876 . 0 0 "[ . 1 . 2]" 1
2055 2 48 GLN HB3 2 49 LYS H 4.500 . 5.000 3.479 2.951 4.206 . 0 0 "[ . 1 . 2]" 1
2056 2 48 GLN HB3 2 84 ALA MB 4.500 . 5.000 2.564 2.171 3.128 . 0 0 "[ . 1 . 2]" 1
2057 2 48 GLN HE21 2 54 VAL QG 4.500 . 5.000 3.045 2.741 3.243 . 0 0 "[ . 1 . 2]" 1
2058 2 48 GLN HE22 2 54 VAL QG 3.500 . 3.800 2.840 2.463 3.162 . 0 0 "[ . 1 . 2]" 1
2059 2 48 GLN HG2 2 49 LYS H 4.500 . 5.000 4.745 4.276 5.271 0.271 17 0 "[ . 1 . 2]" 1
2060 2 48 GLN HG2 2 54 VAL QG 4.500 . 5.000 3.455 2.715 3.800 . 0 0 "[ . 1 . 2]" 1
2061 2 48 GLN HG3 2 54 VAL QG 4.500 . 5.000 3.459 2.684 3.849 . 0 0 "[ . 1 . 2]" 1
2062 2 49 LYS H 2 49 LYS HG2 4.500 . 5.000 2.556 2.047 2.787 . 0 0 "[ . 1 . 2]" 1
2063 2 49 LYS H 2 50 ASP H 3.500 . 3.800 2.003 1.845 2.217 . 0 0 "[ . 1 . 2]" 1
2064 2 49 LYS H 2 50 ASP HB2 4.500 . 5.000 4.345 4.161 4.503 . 0 0 "[ . 1 . 2]" 1
2065 2 49 LYS H 2 84 ALA HA 4.500 . 5.000 3.675 3.480 3.997 . 0 0 "[ . 1 . 2]" 1
2066 2 49 LYS H 2 84 ALA MB 3.500 . 3.800 2.464 2.090 2.923 . 0 0 "[ . 1 . 2]" 1
2067 2 49 LYS H 2 85 CYS H 4.500 . 5.000 4.012 3.756 4.226 . 0 0 "[ . 1 . 2]" 1
2068 2 49 LYS HA 2 49 LYS HD2 4.500 . 5.000 3.313 3.018 3.637 . 0 0 "[ . 1 . 2]" 1
2069 2 49 LYS HA 2 49 LYS QD 3.500 . 3.800 2.232 2.069 2.552 . 0 0 "[ . 1 . 2]" 1
2070 2 49 LYS HA 2 49 LYS HD3 4.500 . 5.000 2.280 2.083 2.754 . 0 0 "[ . 1 . 2]" 1
2071 2 49 LYS QB 2 50 ASP H 3.500 . 3.800 2.893 2.748 3.030 . 0 0 "[ . 1 . 2]" 1
2072 2 49 LYS QD 2 85 CYS HA 4.500 . 5.000 4.230 3.725 4.478 . 0 0 "[ . 1 . 2]" 1
2073 2 49 LYS HG2 2 50 ASP H 4.500 . 5.000 4.157 3.889 4.333 . 0 0 "[ . 1 . 2]" 1
2074 2 49 LYS HG2 2 85 CYS H 4.500 . 5.000 4.820 4.734 4.846 . 0 0 "[ . 1 . 2]" 1
2075 2 49 LYS HG2 2 85 CYS HA 4.500 . 5.000 2.162 2.044 2.299 . 0 0 "[ . 1 . 2]" 1
2076 2 49 LYS HG2 2 85 CYS HB2 4.500 . 5.000 4.361 4.066 4.554 . 0 0 "[ . 1 . 2]" 1
2077 2 49 LYS HG2 2 86 ASN H 5.200 . 5.700 5.433 5.210 5.519 . 0 0 "[ . 1 . 2]" 1
2078 2 49 LYS HG3 2 85 CYS HA 4.500 . 5.000 3.468 3.246 3.747 . 0 0 "[ . 1 . 2]" 1
2079 2 50 ASP H 2 50 ASP HB2 3.500 . 3.800 2.560 2.500 2.642 . 0 0 "[ . 1 . 2]" 1
2080 2 50 ASP H 2 50 ASP HB3 3.500 . 3.800 2.594 2.556 2.659 . 0 0 "[ . 1 . 2]" 1
2081 2 50 ASP H 2 51 VAL H 4.500 . 5.000 4.168 3.988 4.335 . 0 0 "[ . 1 . 2]" 1
2082 2 50 ASP H 2 53 ALA MB 4.500 . 5.000 4.348 4.162 4.428 . 0 0 "[ . 1 . 2]" 1
2083 2 50 ASP H 2 54 VAL QG 5.200 . 5.700 3.820 3.635 3.977 . 0 0 "[ . 1 . 2]" 1
2084 2 50 ASP H 2 84 ALA H 5.200 . 5.700 5.019 4.807 5.230 . 0 0 "[ . 1 . 2]" 1
2085 2 50 ASP H 2 84 ALA HA 3.500 . 3.800 2.800 2.598 3.034 . 0 0 "[ . 1 . 2]" 1
2086 2 50 ASP H 2 84 ALA MB 3.500 . 3.800 1.972 1.752 2.141 0.048 14 0 "[ . 1 . 2]" 1
2087 2 50 ASP HA 2 51 VAL H 3.500 . 3.800 2.227 2.123 2.283 . 0 0 "[ . 1 . 2]" 1
2088 2 50 ASP HA 2 52 ASP H 3.500 . 3.800 3.575 3.477 3.707 . 0 0 "[ . 1 . 2]" 1
2089 2 50 ASP HA 2 53 ALA H 4.500 . 5.000 4.184 4.116 4.249 . 0 0 "[ . 1 . 2]" 1
2090 2 50 ASP HA 2 90 TRP HH2 4.500 . 5.000 5.419 5.411 5.433 0.433 15 0 "[ . 1 . 2]" 1
2091 2 50 ASP HA 2 90 TRP HZ2 4.500 . 5.000 3.751 3.657 3.922 . 0 0 "[ . 1 . 2]" 1
2092 2 50 ASP HB2 2 53 ALA MB 3.500 . 3.800 3.517 3.447 3.607 . 0 0 "[ . 1 . 2]" 1
2093 2 50 ASP HB2 2 84 ALA H 5.200 . 5.700 4.993 4.984 5.007 . 0 0 "[ . 1 . 2]" 1
2094 2 50 ASP HB2 2 84 ALA MB 4.500 . 5.000 3.047 2.900 3.198 . 0 0 "[ . 1 . 2]" 1
2095 2 50 ASP HB2 2 90 TRP HH2 4.500 . 5.000 3.116 3.021 3.215 . 0 0 "[ . 1 . 2]" 1
2096 2 50 ASP HB2 2 90 TRP HZ2 4.500 . 5.000 2.254 2.086 2.440 . 0 0 "[ . 1 . 2]" 1
2097 2 50 ASP HB2 2 90 TRP HZ3 5.200 . 5.700 5.477 5.395 5.570 . 0 0 "[ . 1 . 2]" 1
2098 2 50 ASP HB3 2 51 VAL H 4.500 . 5.000 4.410 4.320 4.431 . 0 0 "[ . 1 . 2]" 1
2099 2 50 ASP HB3 2 53 ALA H 4.500 . 5.000 3.390 3.142 3.550 . 0 0 "[ . 1 . 2]" 1
2100 2 50 ASP HB3 2 53 ALA MB 4.500 . 5.000 2.200 2.135 2.274 . 0 0 "[ . 1 . 2]" 1
2101 2 50 ASP HB3 2 54 VAL H 4.500 . 5.000 3.756 3.639 3.870 . 0 0 "[ . 1 . 2]" 1
2102 2 50 ASP HB3 2 84 ALA HA 4.500 . 5.000 2.628 2.461 2.845 . 0 0 "[ . 1 . 2]" 1
2103 2 50 ASP HB3 2 84 ALA MB 4.500 . 5.000 2.226 2.133 2.308 . 0 0 "[ . 1 . 2]" 1
2104 2 50 ASP HB3 2 90 TRP HH2 4.500 . 5.000 3.789 3.569 3.954 . 0 0 "[ . 1 . 2]" 1
2105 2 51 VAL H 2 51 VAL HB 3.500 . 3.800 2.531 2.505 2.563 . 0 0 "[ . 1 . 2]" 1
2106 2 51 VAL H 2 51 VAL MG2 2.700 . 3.000 2.050 2.015 2.078 . 0 0 "[ . 1 . 2]" 1
2107 2 51 VAL H 2 52 ASP H 3.500 . 3.800 2.747 2.670 2.831 . 0 0 "[ . 1 . 2]" 1
2108 2 51 VAL H 2 52 ASP HA 5.200 . 5.700 5.308 5.270 5.366 . 0 0 "[ . 1 . 2]" 1
2109 2 51 VAL H 2 53 ALA MB 5.200 . 5.700 5.058 5.012 5.112 . 0 0 "[ . 1 . 2]" 1
2110 2 51 VAL H 2 84 ALA MB 5.200 . 5.700 5.105 4.936 5.266 . 0 0 "[ . 1 . 2]" 1
2111 2 51 VAL HA 2 51 VAL MG1 3.500 . 3.800 2.416 2.409 2.424 . 0 0 "[ . 1 . 2]" 1
2112 2 51 VAL HA 2 51 VAL MG2 3.500 . 3.800 2.411 2.407 2.416 . 0 0 "[ . 1 . 2]" 1
2113 2 51 VAL HA 2 54 VAL H 3.500 . 3.800 3.563 3.490 3.638 . 0 0 "[ . 1 . 2]" 1
2114 2 51 VAL HA 2 54 VAL HB 4.500 . 5.000 4.755 4.745 4.765 . 0 0 "[ . 1 . 2]" 1
2115 2 51 VAL HA 2 55 ASP H 4.500 . 5.000 3.820 3.681 3.997 . 0 0 "[ . 1 . 2]" 1
2116 2 51 VAL HA 2 55 ASP QB 4.500 . 5.000 4.290 4.213 4.317 . 0 0 "[ . 1 . 2]" 1
2117 2 51 VAL HA 2 84 ALA MB 4.500 . 5.000 5.201 4.902 5.508 0.508 12 4 "[ . 1 +* . -*2]" 1
2118 2 51 VAL HB 2 52 ASP H 3.500 . 3.800 2.876 2.818 2.908 . 0 0 "[ . 1 . 2]" 1
2119 2 51 VAL HB 2 52 ASP HB2 4.500 . 5.000 4.308 4.257 4.403 . 0 0 "[ . 1 . 2]" 1
2120 2 51 VAL MG1 2 52 ASP HA 4.500 . 5.000 3.467 3.399 3.582 . 0 0 "[ . 1 . 2]" 1
2121 2 51 VAL MG1 2 55 ASP QB 3.500 . 3.800 2.956 2.814 3.031 . 0 0 "[ . 1 . 2]" 1
2122 2 52 ASP H 2 52 ASP HB3 3.500 . 3.800 2.737 2.561 2.810 . 0 0 "[ . 1 . 2]" 1
2123 2 52 ASP H 2 53 ALA H 3.500 . 3.800 2.538 2.494 2.627 . 0 0 "[ . 1 . 2]" 1
2124 2 52 ASP H 2 53 ALA MB 4.500 . 5.000 4.256 4.229 4.299 . 0 0 "[ . 1 . 2]" 1
2125 2 52 ASP H 2 54 VAL H 4.500 . 5.000 4.298 4.230 4.381 . 0 0 "[ . 1 . 2]" 1
2126 2 52 ASP HA 2 52 ASP HB2 2.700 . 3.000 2.571 2.508 2.607 . 0 0 "[ . 1 . 2]" 1
2127 2 52 ASP HA 2 53 ALA H 3.500 . 3.800 3.512 3.502 3.522 . 0 0 "[ . 1 . 2]" 1
2128 2 52 ASP HB3 2 53 ALA H 3.500 . 3.800 2.723 2.488 2.832 . 0 0 "[ . 1 . 2]" 1
2129 2 52 ASP HB3 2 53 ALA HA 4.500 . 5.000 4.091 4.015 4.271 . 0 0 "[ . 1 . 2]" 1
2130 2 52 ASP HB3 2 53 ALA MB 4.500 . 5.000 3.979 3.846 4.048 . 0 0 "[ . 1 . 2]" 1
2131 2 52 ASP HB3 2 54 VAL H 5.200 . 5.700 5.257 5.109 5.351 . 0 0 "[ . 1 . 2]" 1
2132 2 53 ALA H 2 53 ALA MB 2.700 . 3.000 2.256 2.222 2.280 . 0 0 "[ . 1 . 2]" 1
2133 2 53 ALA H 2 54 VAL H 3.500 . 3.800 2.677 2.590 2.728 . 0 0 "[ . 1 . 2]" 1
2134 2 53 ALA H 2 54 VAL HA 5.200 . 5.700 5.276 5.181 5.321 . 0 0 "[ . 1 . 2]" 1
2135 2 53 ALA H 2 54 VAL HB 4.500 . 5.000 6.271 6.169 6.306 1.306 12 20 [***********+*-******] 1
2136 2 53 ALA H 2 54 VAL QG 4.500 . 5.000 3.526 3.471 3.557 . 0 0 "[ . 1 . 2]" 1
2137 2 53 ALA H 2 55 ASP H 4.500 . 5.000 4.015 4.003 4.021 . 0 0 "[ . 1 . 2]" 1
2138 2 53 ALA H 2 56 LYS QB 4.500 . 5.000 5.181 5.072 5.253 0.253 9 0 "[ . 1 . 2]" 1
2139 2 53 ALA H 2 84 ALA MB 4.500 . 5.000 4.677 4.471 4.897 . 0 0 "[ . 1 . 2]" 1
2140 2 53 ALA HA 2 54 VAL HA 4.500 . 5.000 4.691 4.652 4.722 . 0 0 "[ . 1 . 2]" 1
2141 2 53 ALA HA 2 56 LYS QB 3.500 . 3.800 3.180 3.015 3.315 . 0 0 "[ . 1 . 2]" 1
2142 2 53 ALA MB 2 54 VAL H 3.500 . 3.800 2.338 2.253 2.420 . 0 0 "[ . 1 . 2]" 1
2143 2 53 ALA MB 2 54 VAL QG 3.500 . 3.800 2.815 2.684 2.956 . 0 0 "[ . 1 . 2]" 1
2144 2 53 ALA MB 2 55 ASP H 4.500 . 5.000 4.404 4.319 4.459 . 0 0 "[ . 1 . 2]" 1
2145 2 53 ALA MB 2 84 ALA H 4.500 . 5.000 4.633 4.390 4.835 . 0 0 "[ . 1 . 2]" 1
2146 2 53 ALA MB 2 84 ALA MB 3.500 . 3.800 2.744 2.452 3.047 . 0 0 "[ . 1 . 2]" 1
2147 2 54 VAL H 2 54 VAL HB 3.500 . 3.800 3.636 3.605 3.663 . 0 0 "[ . 1 . 2]" 1
2148 2 54 VAL H 2 54 VAL QG 2.700 . 3.000 1.837 1.798 1.864 0.002 8 0 "[ . 1 . 2]" 1
2149 2 54 VAL H 2 55 ASP H 3.500 . 3.800 2.708 2.676 2.775 . 0 0 "[ . 1 . 2]" 1
2150 2 54 VAL H 2 55 ASP QB . . 5.000 4.439 4.353 4.515 . 0 0 "[ . 1 . 2]" 1
2151 2 54 VAL H 2 56 LYS H 4.500 . 5.000 4.348 4.267 4.415 . 0 0 "[ . 1 . 2]" 1
2152 2 54 VAL H 2 56 LYS QB 4.500 . 5.000 5.328 5.158 5.404 0.404 12 0 "[ . 1 . 2]" 1
2153 2 54 VAL H 2 84 ALA HA 4.500 . 5.000 6.090 5.834 6.342 1.342 5 20 [****+**************-] 1
2154 2 54 VAL H 2 84 ALA MB 4.500 . 5.000 3.961 3.727 4.211 . 0 0 "[ . 1 . 2]" 1
2155 2 54 VAL HA 2 56 LYS H 4.500 . 5.000 4.419 4.292 4.553 . 0 0 "[ . 1 . 2]" 1
2156 2 54 VAL HA 2 57 VAL H 4.500 . 5.000 3.407 3.139 3.666 . 0 0 "[ . 1 . 2]" 1
2157 2 54 VAL HA 2 58 MET H 4.500 . 5.000 3.566 3.108 3.768 . 0 0 "[ . 1 . 2]" 1
2158 2 54 VAL HB 2 55 ASP H 3.500 . 3.800 3.862 3.808 4.006 0.206 9 0 "[ . 1 . 2]" 1
2159 2 54 VAL HB 2 55 ASP QB 4.500 . 5.000 5.086 4.981 5.122 0.122 20 0 "[ . 1 . 2]" 1
2160 2 54 VAL HB 2 58 MET QG 4.500 . 5.000 3.134 2.545 3.800 . 0 0 "[ . 1 . 2]" 1
2161 2 54 VAL QG 2 55 ASP H 3.500 . 3.800 2.298 2.237 2.498 . 0 0 "[ . 1 . 2]" 1
2162 2 54 VAL QG 2 55 ASP HA 4.500 . 5.000 3.375 3.321 3.438 . 0 0 "[ . 1 . 2]" 1
2163 2 54 VAL QG 2 56 LYS H 5.200 . 5.700 4.295 4.258 4.315 . 0 0 "[ . 1 . 2]" 1
2164 2 54 VAL QG 2 58 MET QG 3.500 . 3.800 3.624 2.961 4.178 0.378 17 0 "[ . 1 . 2]" 1
2165 2 54 VAL QG 2 84 ALA H 4.500 . 5.000 4.925 4.453 5.601 0.601 19 2 "[ . 1 - . +2]" 1
2166 2 54 VAL QG 2 84 ALA HA 4.500 . 5.000 4.682 4.430 5.075 0.075 19 0 "[ . 1 . 2]" 1
2167 2 54 VAL QG 2 84 ALA MB 3.500 . 3.800 2.581 2.308 2.962 . 0 0 "[ . 1 . 2]" 1
2168 2 55 ASP H 2 55 ASP QB 3.500 . 3.800 2.201 2.162 2.223 . 0 0 "[ . 1 . 2]" 1
2169 2 55 ASP H 2 56 LYS H 3.500 . 3.800 2.647 2.394 2.700 . 0 0 "[ . 1 . 2]" 1
2170 2 55 ASP H 2 56 LYS QB 4.500 . 5.000 4.485 4.155 4.564 . 0 0 "[ . 1 . 2]" 1
2171 2 55 ASP H 2 56 LYS QD 5.200 . 5.700 4.035 3.917 4.763 . 0 0 "[ . 1 . 2]" 1
2172 2 55 ASP HA 2 56 LYS H 3.500 . 3.800 3.557 3.506 3.569 . 0 0 "[ . 1 . 2]" 1
2173 2 55 ASP HA 2 57 VAL H 4.500 . 5.000 4.398 4.256 4.587 . 0 0 "[ . 1 . 2]" 1
2174 2 55 ASP HA 2 58 MET H 4.500 . 5.000 3.779 3.559 3.985 . 0 0 "[ . 1 . 2]" 1
2175 2 55 ASP HA 2 58 MET HB3 4.500 . 5.000 4.971 4.543 5.653 0.653 12 1 "[ . 1 + . 2]" 1
2176 2 55 ASP HA 2 59 LYS H 4.500 . 5.000 4.108 3.948 4.295 . 0 0 "[ . 1 . 2]" 1
2177 2 55 ASP QB 2 56 LYS H . . 3.800 2.514 2.422 2.755 . 0 0 "[ . 1 . 2]" 1
2178 2 55 ASP QB 2 56 LYS QB 4.500 . 5.000 4.124 4.023 4.226 . 0 0 "[ . 1 . 2]" 1
2179 2 55 ASP QB 2 57 VAL H 5.200 . 5.700 4.628 4.527 4.817 . 0 0 "[ . 1 . 2]" 1
2180 2 56 LYS H 2 56 LYS QB 2.700 . 3.000 2.182 2.110 2.224 . 0 0 "[ . 1 . 2]" 1
2181 2 56 LYS H 2 56 LYS QG 4.500 . 5.000 3.545 2.384 3.687 . 0 0 "[ . 1 . 2]" 1
2182 2 56 LYS H 2 57 VAL H 3.500 . 3.800 2.539 2.382 2.581 . 0 0 "[ . 1 . 2]" 1
2183 2 56 LYS H 2 57 VAL HA 5.200 . 5.700 5.232 5.094 5.270 . 0 0 "[ . 1 . 2]" 1
2184 2 56 LYS H 2 57 VAL HB 5.200 . 5.700 4.729 4.633 4.744 . 0 0 "[ . 1 . 2]" 1
2185 2 56 LYS H 2 57 VAL QG 4.500 . 5.000 4.062 3.854 4.113 . 0 0 "[ . 1 . 2]" 1
2186 2 56 LYS H 2 58 MET H 4.500 . 5.000 4.225 4.074 4.300 . 0 0 "[ . 1 . 2]" 1
2187 2 56 LYS H 2 59 LYS H 5.200 . 5.700 4.945 4.810 5.117 . 0 0 "[ . 1 . 2]" 1
2188 2 56 LYS HA 2 56 LYS QG 3.500 . 3.800 2.272 2.172 2.520 . 0 0 "[ . 1 . 2]" 1
2189 2 56 LYS QB 2 57 VAL H 3.500 . 3.800 2.872 2.731 3.004 . 0 0 "[ . 1 . 2]" 1
2190 2 56 LYS QB 2 57 VAL HB 4.500 . 5.000 4.743 4.577 4.893 . 0 0 "[ . 1 . 2]" 1
2191 2 56 LYS QB 2 58 MET H 4.500 . 5.000 4.934 4.876 5.003 0.003 5 0 "[ . 1 . 2]" 1
2192 2 56 LYS QG 2 57 VAL H 4.500 . 5.000 4.649 4.243 4.723 . 0 0 "[ . 1 . 2]" 1
2193 2 57 VAL H 2 57 VAL HB 3.500 . 3.800 2.426 2.394 2.475 . 0 0 "[ . 1 . 2]" 1
2194 2 57 VAL H 2 57 VAL QG 3.500 . 3.800 2.425 2.326 2.535 . 0 0 "[ . 1 . 2]" 1
2195 2 57 VAL H 2 58 MET H 3.500 . 3.800 2.545 2.446 2.668 . 0 0 "[ . 1 . 2]" 1
2196 2 57 VAL H 2 58 MET QG 4.500 . 5.000 4.426 4.295 4.733 . 0 0 "[ . 1 . 2]" 1
2197 2 57 VAL H 2 59 LYS H 4.500 . 5.000 4.047 3.855 4.225 . 0 0 "[ . 1 . 2]" 1
2198 2 57 VAL H 2 59 LYS HG2 5.200 . 5.700 4.434 4.329 4.460 . 0 0 "[ . 1 . 2]" 1
2199 2 57 VAL HA 2 59 LYS H 4.500 . 5.000 4.451 4.230 4.569 . 0 0 "[ . 1 . 2]" 1
2200 2 57 VAL HA 2 60 GLU H 4.500 . 5.000 3.187 3.001 3.375 . 0 0 "[ . 1 . 2]" 1
2201 2 57 VAL HA 2 60 GLU HA 5.200 . 5.700 5.057 4.783 5.344 . 0 0 "[ . 1 . 2]" 1
2202 2 57 VAL HA 2 60 GLU HB2 4.500 . 5.000 3.135 2.800 3.433 . 0 0 "[ . 1 . 2]" 1
2203 2 57 VAL HA 2 60 GLU HB3 3.500 . 3.800 2.375 2.160 2.651 . 0 0 "[ . 1 . 2]" 1
2204 2 57 VAL HA 2 60 GLU QG 4.500 . 5.000 4.022 3.810 4.274 . 0 0 "[ . 1 . 2]" 1
2205 2 57 VAL HA 2 61 LEU H 4.500 . 5.000 3.841 3.734 3.922 . 0 0 "[ . 1 . 2]" 1
2206 2 57 VAL HA 2 61 LEU QB 4.500 . 5.000 4.543 4.519 4.560 . 0 0 "[ . 1 . 2]" 1
2207 2 57 VAL QG 2 58 MET H 4.500 . 5.000 3.249 3.153 3.404 . 0 0 "[ . 1 . 2]" 1
2208 2 57 VAL QG 2 58 MET ME 3.500 . 3.800 3.763 2.130 5.529 1.729 1 10 "[+ *** * 1* **. - *]" 1
2209 2 57 VAL QG 2 58 MET QG 4.500 . 5.000 3.530 3.334 3.801 . 0 0 "[ . 1 . 2]" 1
2210 2 57 VAL QG 2 60 GLU HB3 4.500 . 5.000 3.320 3.023 3.574 . 0 0 "[ . 1 . 2]" 1
2211 2 57 VAL QG 2 61 LEU QB 3.500 . 3.800 3.240 3.117 3.295 . 0 0 "[ . 1 . 2]" 1
2212 2 58 MET H 2 58 MET QG 3.500 . 3.800 2.416 2.327 2.667 . 0 0 "[ . 1 . 2]" 1
2213 2 58 MET H 2 59 LYS H 3.500 . 3.800 2.668 2.548 2.745 . 0 0 "[ . 1 . 2]" 1
2214 2 58 MET H 2 59 LYS HG2 5.200 . 5.700 4.436 4.002 4.652 . 0 0 "[ . 1 . 2]" 1
2215 2 58 MET H 2 59 LYS HG3 5.200 . 5.700 5.395 5.051 5.496 . 0 0 "[ . 1 . 2]" 1
2216 2 58 MET H 2 60 GLU H 4.500 . 5.000 3.892 3.787 3.985 . 0 0 "[ . 1 . 2]" 1
2217 2 58 MET H 2 60 GLU HB3 5.200 . 5.700 5.054 4.906 5.206 . 0 0 "[ . 1 . 2]" 1
2218 2 58 MET H 2 61 LEU QB 5.200 . 5.700 4.922 4.752 5.138 . 0 0 "[ . 1 . 2]" 1
2219 2 58 MET HA 2 58 MET ME 3.500 . 3.800 3.129 2.137 4.082 0.282 6 0 "[ . 1 . 2]" 1
2220 2 58 MET HA 2 58 MET QG 3.500 . 3.800 2.567 2.024 2.900 . 0 0 "[ . 1 . 2]" 1
2221 2 58 MET HB2 2 59 LYS H 3.500 . 3.800 2.733 2.622 2.896 . 0 0 "[ . 1 . 2]" 1
2222 2 58 MET HB2 2 59 LYS HB3 4.500 . 5.000 4.381 4.235 4.444 . 0 0 "[ . 1 . 2]" 1
2223 2 58 MET QG 2 59 LYS H 4.500 . 5.000 4.204 4.105 4.274 . 0 0 "[ . 1 . 2]" 1
2224 2 58 MET QG 2 60 GLU H 5.200 . 5.700 5.516 5.499 5.546 . 0 0 "[ . 1 . 2]" 1
2225 2 59 LYS H 2 59 LYS HB3 2.700 . 3.000 2.531 2.415 2.655 . 0 0 "[ . 1 . 2]" 1
2226 2 59 LYS H 2 59 LYS HG2 4.500 . 5.000 2.469 2.098 2.717 . 0 0 "[ . 1 . 2]" 1
2227 2 59 LYS H 2 59 LYS HG3 3.500 . 3.800 3.261 3.029 3.374 . 0 0 "[ . 1 . 2]" 1
2228 2 59 LYS H 2 60 GLU H 3.500 . 3.800 2.578 2.457 2.634 . 0 0 "[ . 1 . 2]" 1
2229 2 59 LYS H 2 61 LEU H 4.500 . 5.000 4.282 4.099 4.463 . 0 0 "[ . 1 . 2]" 1
2230 2 59 LYS H 2 62 ASP H 4.500 . 5.000 4.714 4.553 4.859 . 0 0 "[ . 1 . 2]" 1
2231 2 59 LYS HA 2 62 ASP H 3.500 . 3.800 3.138 2.882 3.352 . 0 0 "[ . 1 . 2]" 1
2232 2 59 LYS HA 2 62 ASP QB 3.500 . 3.800 2.332 2.064 2.646 . 0 0 "[ . 1 . 2]" 1
2233 2 59 LYS HB2 2 60 GLU H 4.500 . 5.000 4.146 4.027 4.262 . 0 0 "[ . 1 . 2]" 1
2234 2 59 LYS HB2 2 63 GLU H 5.200 . 5.700 5.166 4.883 5.374 . 0 0 "[ . 1 . 2]" 1
2235 2 59 LYS QE 2 59 LYS HG2 3.500 . 3.800 3.096 2.240 3.620 . 0 0 "[ . 1 . 2]" 1
2236 2 59 LYS HG2 2 60 GLU H 4.500 . 5.000 3.156 2.840 3.510 . 0 0 "[ . 1 . 2]" 1
2237 2 59 LYS HG3 2 60 GLU H 4.500 . 5.000 2.612 2.403 2.791 . 0 0 "[ . 1 . 2]" 1
2238 2 59 LYS HG3 2 60 GLU HA 3.500 . 3.800 3.259 3.102 3.483 . 0 0 "[ . 1 . 2]" 1
2239 2 59 LYS HG3 2 60 GLU HB3 4.500 . 5.000 4.402 4.126 4.581 . 0 0 "[ . 1 . 2]" 1
2240 2 60 GLU H 2 60 GLU HB2 3.500 . 3.800 2.715 2.629 2.831 . 0 0 "[ . 1 . 2]" 1
2241 2 60 GLU H 2 60 GLU HB3 3.500 . 3.800 2.412 2.330 2.484 . 0 0 "[ . 1 . 2]" 1
2242 2 60 GLU H 2 61 LEU H 3.500 . 3.800 2.439 2.300 2.636 . 0 0 "[ . 1 . 2]" 1
2243 2 60 GLU H 2 62 ASP QB 4.500 . 5.000 4.704 4.693 4.724 . 0 0 "[ . 1 . 2]" 1
2244 2 60 GLU H 2 63 GLU H 5.200 . 5.700 4.887 4.774 4.956 . 0 0 "[ . 1 . 2]" 1
2245 2 60 GLU HA 2 60 GLU QG 3.500 . 3.800 2.517 2.449 2.600 . 0 0 "[ . 1 . 2]" 1
2246 2 60 GLU HA 2 64 ASN QD 4.500 . 5.000 2.730 2.609 2.888 . 0 0 "[ . 1 . 2]" 1
2247 2 60 GLU HB3 2 61 LEU H 3.500 . 3.800 2.409 2.322 2.518 . 0 0 "[ . 1 . 2]" 1
2248 2 60 GLU QG 2 61 LEU QB 4.500 . 5.000 4.967 4.842 5.110 0.110 14 0 "[ . 1 . 2]" 1
2249 2 60 GLU QG 2 64 ASN HB3 5.200 . 5.700 4.453 4.322 4.517 . 0 0 "[ . 1 . 2]" 1
2250 2 60 GLU QG 2 64 ASN QD 3.500 . 3.800 2.201 2.069 2.404 . 0 0 "[ . 1 . 2]" 1
2251 2 61 LEU H 2 61 LEU QB 3.500 . 3.800 1.995 1.958 2.036 . 0 0 "[ . 1 . 2]" 1
2252 2 61 LEU H 2 61 LEU MD2 4.500 . 5.000 3.554 3.463 3.721 . 0 0 "[ . 1 . 2]" 1
2253 2 61 LEU H 2 62 ASP HA 5.200 . 5.700 5.308 5.288 5.321 . 0 0 "[ . 1 . 2]" 1
2254 2 61 LEU H 2 62 ASP QB 4.500 . 5.000 4.523 4.373 4.600 . 0 0 "[ . 1 . 2]" 1
2255 2 61 LEU H 2 63 GLU H 4.500 . 5.000 4.350 4.244 4.462 . 0 0 "[ . 1 . 2]" 1
2256 2 61 LEU H 2 63 GLU QG 4.500 . 5.000 5.567 4.725 5.800 0.800 15 16 "[************ +* * -]" 1
2257 2 61 LEU H 2 64 ASN HB2 5.200 . 5.700 4.829 4.752 4.895 . 0 0 "[ . 1 . 2]" 1
2258 2 61 LEU HA 2 61 LEU MD2 3.500 . 3.800 2.043 2.007 2.088 . 0 0 "[ . 1 . 2]" 1
2259 2 61 LEU HA 2 62 ASP QB 5.200 . 5.700 5.285 5.144 5.351 . 0 0 "[ . 1 . 2]" 1
2260 2 61 LEU HA 2 64 ASN HA 5.200 . 5.700 5.418 5.372 5.492 . 0 0 "[ . 1 . 2]" 1
2261 2 61 LEU HA 2 64 ASN HB3 4.500 . 5.000 4.379 4.321 4.400 . 0 0 "[ . 1 . 2]" 1
2262 2 61 LEU QB 2 62 ASP H . . 3.800 2.771 2.658 2.893 . 0 0 "[ . 1 . 2]" 1
2263 2 61 LEU QB 2 63 GLU H 5.200 . 5.700 4.811 4.737 4.887 . 0 0 "[ . 1 . 2]" 1
2264 2 61 LEU MD1 2 62 ASP H 4.500 . 5.000 4.058 3.891 4.199 . 0 0 "[ . 1 . 2]" 1
2265 2 61 LEU MD1 2 63 GLU H 4.500 . 5.000 5.229 5.112 5.352 0.352 20 0 "[ . 1 . 2]" 1
2266 2 61 LEU MD1 2 64 ASN H 4.500 . 5.000 4.535 4.355 4.731 . 0 0 "[ . 1 . 2]" 1
2267 2 61 LEU MD1 2 64 ASN HB3 4.500 . 5.000 5.252 5.147 5.447 0.447 7 0 "[ . 1 . 2]" 1
2268 2 61 LEU MD1 2 65 GLY H 5.200 . 5.700 3.774 3.603 3.953 . 0 0 "[ . 1 . 2]" 1
2269 2 61 LEU MD2 2 64 ASN H 5.200 . 5.700 4.854 4.753 4.912 . 0 0 "[ . 1 . 2]" 1
2270 2 61 LEU MD2 2 64 ASN HB2 4.500 . 5.000 3.916 3.877 3.979 . 0 0 "[ . 1 . 2]" 1
2271 2 61 LEU MD2 2 64 ASN HB3 4.500 . 5.000 4.609 4.588 4.630 . 0 0 "[ . 1 . 2]" 1
2272 2 61 LEU MD2 2 65 GLY QA 4.500 . 5.000 3.739 3.629 3.800 . 0 0 "[ . 1 . 2]" 1
2273 2 61 LEU HG 2 65 GLY QA 5.200 . 5.700 5.231 5.093 5.302 . 0 0 "[ . 1 . 2]" 1
2274 2 62 ASP H 2 62 ASP QB 2.700 . 3.000 2.165 2.059 2.241 . 0 0 "[ . 1 . 2]" 1
2275 2 62 ASP H 2 63 GLU H 3.500 . 3.800 2.689 2.564 2.763 . 0 0 "[ . 1 . 2]" 1
2276 2 62 ASP HA 2 63 GLU H 3.500 . 3.800 3.568 3.552 3.576 . 0 0 "[ . 1 . 2]" 1
2277 2 62 ASP HA 2 64 ASN H 4.500 . 5.000 4.376 4.198 4.396 . 0 0 "[ . 1 . 2]" 1
2278 2 62 ASP HA 2 65 GLY H 4.500 . 5.000 3.916 3.786 4.002 . 0 0 "[ . 1 . 2]" 1
2279 2 62 ASP QB 2 63 GLU H 3.500 . 3.800 2.798 2.573 2.919 . 0 0 "[ . 1 . 2]" 1
2280 2 63 GLU H 2 63 GLU QB 3.500 . 3.800 2.437 2.319 2.729 . 0 0 "[ . 1 . 2]" 1
2281 2 63 GLU H 2 63 GLU QG 3.500 . 3.800 2.299 2.076 2.572 . 0 0 "[ . 1 . 2]" 1
2282 2 63 GLU H 2 64 ASN H 3.500 . 3.800 2.282 2.247 2.338 . 0 0 "[ . 1 . 2]" 1
2283 2 63 GLU H 2 64 ASN HA 5.200 . 5.700 5.023 5.011 5.039 . 0 0 "[ . 1 . 2]" 1
2284 2 63 GLU H 2 64 ASN HB2 4.500 . 5.000 4.336 4.243 4.408 . 0 0 "[ . 1 . 2]" 1
2285 2 63 GLU H 2 65 GLY H 4.500 . 5.000 3.944 3.868 4.017 . 0 0 "[ . 1 . 2]" 1
2286 2 63 GLU HA 2 64 ASN H 3.500 . 3.800 3.473 3.386 3.529 . 0 0 "[ . 1 . 2]" 1
2287 2 63 GLU QB 2 64 ASN QD 4.500 . 5.000 2.601 2.282 3.702 . 0 0 "[ . 1 . 2]" 1
2288 2 63 GLU QB 2 65 GLY H 5.200 . 5.700 4.599 4.486 5.077 . 0 0 "[ . 1 . 2]" 1
2289 2 63 GLU QG 2 64 ASN H 4.500 . 5.000 3.838 2.639 4.163 . 0 0 "[ . 1 . 2]" 1
2290 2 63 GLU QG 2 64 ASN QD 4.500 . 5.000 3.889 1.929 4.167 . 0 0 "[ . 1 . 2]" 1
2291 2 64 ASN H 2 64 ASN HB2 3.500 . 3.800 2.367 2.327 2.434 . 0 0 "[ . 1 . 2]" 1
2292 2 64 ASN H 2 64 ASN HB3 3.500 . 3.800 3.631 3.603 3.664 . 0 0 "[ . 1 . 2]" 1
2293 2 64 ASN H 2 64 ASN QD . . 5.000 2.622 2.514 2.845 . 0 0 "[ . 1 . 2]" 1
2294 2 64 ASN H 2 66 ASP H 5.200 . 5.700 4.863 4.727 5.006 . 0 0 "[ . 1 . 2]" 1
2295 2 64 ASN HA 2 65 GLY H 3.500 . 3.800 3.212 3.171 3.262 . 0 0 "[ . 1 . 2]" 1
2296 2 64 ASN HA 2 65 GLY QA 5.200 . 5.700 4.415 4.402 4.423 . 0 0 "[ . 1 . 2]" 1
2297 2 64 ASN HA 2 66 ASP H 3.500 . 3.800 3.648 3.545 3.715 . 0 0 "[ . 1 . 2]" 1
2298 2 64 ASN HA 2 67 GLY H 4.500 . 5.000 3.758 3.593 3.886 . 0 0 "[ . 1 . 2]" 1
2299 2 64 ASN HB2 2 65 GLY H 4.500 . 5.000 3.720 3.650 3.791 . 0 0 "[ . 1 . 2]" 1
2300 2 64 ASN HB3 2 65 GLY H 4.500 . 5.000 4.259 4.215 4.283 . 0 0 "[ . 1 . 2]" 1
2301 2 65 GLY H 2 66 ASP H 3.500 . 3.800 2.820 2.720 2.903 . 0 0 "[ . 1 . 2]" 1
2302 2 65 GLY H 2 67 GLY H 4.500 . 5.000 4.224 4.205 4.240 . 0 0 "[ . 1 . 2]" 1
2303 2 65 GLY QA 2 66 ASP H 3.500 . 3.800 2.813 2.791 2.829 . 0 0 "[ . 1 . 2]" 1
2304 2 65 GLY QA 2 69 VAL MG2 4.500 . 5.000 5.384 5.199 5.518 0.518 19 1 "[ . 1 . +2]" 1
2305 2 66 ASP H 2 66 ASP QB 3.500 . 3.800 2.199 2.077 2.279 . 0 0 "[ . 1 . 2]" 1
2306 2 66 ASP H 2 67 GLY QA 4.500 . 5.000 4.379 4.354 4.394 . 0 0 "[ . 1 . 2]" 1
2307 2 66 ASP QB 2 67 GLY H 3.500 . 3.800 3.484 3.414 3.544 . 0 0 "[ . 1 . 2]" 1
2308 2 66 ASP QB 2 67 GLY QA 4.500 . 5.000 3.931 3.871 3.994 . 0 0 "[ . 1 . 2]" 1
2309 2 67 GLY H 2 68 GLU H 4.500 . 5.000 4.224 4.192 4.255 . 0 0 "[ . 1 . 2]" 1
2310 2 67 GLY QA 2 68 GLU H 2.700 . 3.000 2.182 2.154 2.209 . 0 0 "[ . 1 . 2]" 1
2311 2 67 GLY QA 2 68 GLU QB 4.500 . 5.000 3.722 3.625 3.847 . 0 0 "[ . 1 . 2]" 1
2312 2 67 GLY QA 2 68 GLU QG 4.500 . 5.000 3.580 3.351 3.748 . 0 0 "[ . 1 . 2]" 1
2313 2 67 GLY HA2 2 68 GLU H 3.500 . 3.800 2.730 2.475 3.013 . 0 0 "[ . 1 . 2]" 1
2314 2 67 GLY HA2 2 68 GLU QB 4.500 . 5.000 3.942 3.797 4.140 . 0 0 "[ . 1 . 2]" 1
2315 2 67 GLY HA3 2 68 GLU H 3.500 . 3.800 2.303 2.253 2.369 . 0 0 "[ . 1 . 2]" 1
2316 2 67 GLY HA3 2 68 GLU QB 4.500 . 5.000 4.575 4.558 4.598 . 0 0 "[ . 1 . 2]" 1
2317 2 68 GLU H 2 68 GLU QB 3.500 . 3.800 2.986 2.786 3.156 . 0 0 "[ . 1 . 2]" 1
2318 2 68 GLU H 2 68 GLU QG 3.500 . 3.800 2.296 2.119 2.508 . 0 0 "[ . 1 . 2]" 1
2319 2 68 GLU H 2 69 VAL H 4.500 . 5.000 4.458 4.358 4.492 . 0 0 "[ . 1 . 2]" 1
2320 2 68 GLU H 2 69 VAL HA 5.200 . 5.700 5.105 4.830 5.325 . 0 0 "[ . 1 . 2]" 1
2321 2 68 GLU H 2 69 VAL MG1 4.500 . 5.000 4.025 3.466 4.156 . 0 0 "[ . 1 . 2]" 1
2322 2 68 GLU HA 2 69 VAL H 3.500 . 3.800 2.188 2.107 2.308 . 0 0 "[ . 1 . 2]" 1
2323 2 68 GLU HA 2 69 VAL MG1 4.500 . 5.000 3.927 3.703 4.164 . 0 0 "[ . 1 . 2]" 1
2324 2 68 GLU QB 2 69 VAL H 3.500 . 3.800 2.746 2.499 2.983 . 0 0 "[ . 1 . 2]" 1
2325 2 68 GLU QB 2 69 VAL HA 4.500 . 5.000 4.331 4.181 4.470 . 0 0 "[ . 1 . 2]" 1
2326 2 68 GLU QB 2 69 VAL MG2 4.500 . 5.000 4.359 4.040 4.587 . 0 0 "[ . 1 . 2]" 1
2327 2 68 GLU QG 2 69 VAL H 4.500 . 5.000 3.918 3.716 4.101 . 0 0 "[ . 1 . 2]" 1
2328 2 69 VAL H 2 70 ASP H 4.500 . 5.000 4.432 4.388 4.487 . 0 0 "[ . 1 . 2]" 1
2329 2 69 VAL H 2 70 ASP HB3 5.200 . 5.700 5.496 5.431 5.511 . 0 0 "[ . 1 . 2]" 1
2330 2 69 VAL HA 2 69 VAL MG1 3.500 . 3.800 2.225 2.162 2.271 . 0 0 "[ . 1 . 2]" 1
2331 2 69 VAL HA 2 70 ASP H 3.500 . 3.800 2.657 2.560 2.743 . 0 0 "[ . 1 . 2]" 1
2332 2 69 VAL HA 2 73 GLU H 5.200 . 5.700 5.458 5.251 5.654 . 0 0 "[ . 1 . 2]" 1
2333 2 69 VAL HB 2 73 GLU H 4.500 . 5.000 4.168 4.058 4.341 . 0 0 "[ . 1 . 2]" 1
2334 2 69 VAL HB 2 73 GLU HG3 3.500 . 3.800 3.300 2.680 4.584 0.784 16 2 "[ . 1 .+- 2]" 1
2335 2 69 VAL MG1 2 70 ASP H 3.500 . 3.800 3.362 3.248 3.493 . 0 0 "[ . 1 . 2]" 1
2336 2 69 VAL MG1 2 73 GLU H 4.500 . 5.000 4.980 4.808 5.253 0.253 5 0 "[ . 1 . 2]" 1
2337 2 69 VAL MG1 2 73 GLU QB 3.500 . 3.800 2.624 2.362 2.991 . 0 0 "[ . 1 . 2]" 1
2338 2 69 VAL MG1 2 73 GLU HG3 3.500 . 3.800 2.495 2.106 3.873 0.073 16 0 "[ . 1 . 2]" 1
2339 2 69 VAL MG2 2 70 ASP H 4.500 . 5.000 3.384 3.173 3.587 . 0 0 "[ . 1 . 2]" 1
2340 2 69 VAL MG2 2 73 GLU QB 3.500 . 3.800 3.103 2.728 3.460 . 0 0 "[ . 1 . 2]" 1
2341 2 70 ASP H 2 70 ASP HB3 3.500 . 3.800 2.923 2.864 2.984 . 0 0 "[ . 1 . 2]" 1
2342 2 70 ASP H 2 71 PHE H 4.500 . 5.000 4.410 4.381 4.431 . 0 0 "[ . 1 . 2]" 1
2343 2 70 ASP H 2 73 GLU HA 5.200 . 5.700 4.803 4.792 4.814 . 0 0 "[ . 1 . 2]" 1
2344 2 70 ASP H 2 73 GLU QB 3.500 . 3.800 2.042 1.864 2.292 . 0 0 "[ . 1 . 2]" 1
2345 2 70 ASP HA 2 72 GLN H 4.500 . 5.000 4.631 4.592 4.702 . 0 0 "[ . 1 . 2]" 1
2346 2 70 ASP HB2 2 71 PHE H 3.500 . 3.800 2.234 2.187 2.270 . 0 0 "[ . 1 . 2]" 1
2347 2 70 ASP HB3 2 73 GLU H 5.200 . 5.700 4.493 4.432 4.564 . 0 0 "[ . 1 . 2]" 1
2348 2 71 PHE H 2 71 PHE HB3 3.500 . 3.800 2.481 2.459 2.517 . 0 0 "[ . 1 . 2]" 1
2349 2 71 PHE H 2 72 GLN H 3.500 . 3.800 2.811 2.776 2.841 . 0 0 "[ . 1 . 2]" 1
2350 2 71 PHE H 2 72 GLN QB 4.500 . 5.000 4.569 4.514 4.604 . 0 0 "[ . 1 . 2]" 1
2351 2 71 PHE H 2 73 GLU H 4.500 . 5.000 4.375 4.312 4.434 . 0 0 "[ . 1 . 2]" 1
2352 2 71 PHE HA 2 72 GLN HA 5.200 . 5.700 4.777 4.745 4.803 . 0 0 "[ . 1 . 2]" 1
2353 2 71 PHE HB3 2 72 GLN H 3.500 . 3.800 2.630 2.578 2.696 . 0 0 "[ . 1 . 2]" 1
2354 2 71 PHE HB3 2 73 GLU H 5.200 . 5.700 5.070 4.996 5.144 . 0 0 "[ . 1 . 2]" 1
2355 2 71 PHE QD 2 72 GLN H 4.500 . 5.000 3.297 3.238 3.438 . 0 0 "[ . 1 . 2]" 1
2356 2 71 PHE QD 2 74 TYR H 5.200 . 5.700 5.075 5.010 5.150 . 0 0 "[ . 1 . 2]" 1
2357 2 71 PHE QD 2 75 VAL H 4.500 . 5.000 4.582 4.418 4.667 . 0 0 "[ . 1 . 2]" 1
2358 2 71 PHE QD 2 75 VAL QG 4.500 . 5.000 3.212 3.057 3.705 . 0 0 "[ . 1 . 2]" 1
2359 2 71 PHE QE 2 75 VAL QG 4.500 . 5.000 2.474 2.289 3.208 . 0 0 "[ . 1 . 2]" 1
2360 2 72 GLN H 2 72 GLN QB 2.700 . 3.000 2.224 2.204 2.245 . 0 0 "[ . 1 . 2]" 1
2361 2 72 GLN H 2 72 GLN QE 5.200 . 5.700 4.551 4.310 4.771 . 0 0 "[ . 1 . 2]" 1
2362 2 72 GLN H 2 73 GLU HA 5.200 . 5.700 5.284 5.239 5.321 . 0 0 "[ . 1 . 2]" 1
2363 2 72 GLN H 2 75 VAL HB 5.200 . 5.700 5.364 4.774 5.519 . 0 0 "[ . 1 . 2]" 1
2364 2 72 GLN H 2 75 VAL QG 4.500 . 5.000 4.606 4.492 4.716 . 0 0 "[ . 1 . 2]" 1
2365 2 72 GLN HA 2 72 GLN QE . . 5.000 3.948 3.915 3.975 . 0 0 "[ . 1 . 2]" 1
2366 2 72 GLN HA 2 72 GLN HG3 3.500 . 3.800 2.437 2.389 2.517 . 0 0 "[ . 1 . 2]" 1
2367 2 72 GLN HA 2 75 VAL QG 3.500 . 3.800 2.830 2.140 3.065 . 0 0 "[ . 1 . 2]" 1
2368 2 72 GLN QB 2 72 GLN QE 3.500 . 3.800 2.310 2.129 2.590 . 0 0 "[ . 1 . 2]" 1
2369 2 72 GLN QB 2 73 GLU H 3.500 . 3.800 2.567 2.500 2.626 . 0 0 "[ . 1 . 2]" 1
2370 2 73 GLU H 2 73 GLU QB 3.500 . 3.800 2.104 2.032 2.301 . 0 0 "[ . 1 . 2]" 1
2371 2 73 GLU H 2 74 TYR HA 5.200 . 5.700 5.238 5.207 5.267 . 0 0 "[ . 1 . 2]" 1
2372 2 73 GLU H 2 74 TYR HB2 5.200 . 5.700 5.071 5.048 5.078 . 0 0 "[ . 1 . 2]" 1
2373 2 73 GLU H 2 75 VAL QG 4.500 . 5.000 4.909 4.595 5.046 0.046 10 0 "[ . 1 . 2]" 1
2374 2 73 GLU H 2 76 VAL H 5.200 . 5.700 4.876 4.747 5.001 . 0 0 "[ . 1 . 2]" 1
2375 2 73 GLU HA 2 75 VAL H 4.500 . 5.000 4.368 4.281 4.514 . 0 0 "[ . 1 . 2]" 1
2376 2 73 GLU HA 2 76 VAL H 3.500 . 3.800 3.227 3.046 3.478 . 0 0 "[ . 1 . 2]" 1
2377 2 73 GLU HA 2 76 VAL QG 3.500 . 3.800 2.678 2.170 2.989 . 0 0 "[ . 1 . 2]" 1
2378 2 73 GLU QB 2 75 VAL H 5.200 . 5.700 4.818 4.731 4.931 . 0 0 "[ . 1 . 2]" 1
2379 2 73 GLU HB2 2 74 TYR H 4.500 . 5.000 3.427 2.993 3.901 . 0 0 "[ . 1 . 2]" 1
2380 2 73 GLU HB3 2 74 TYR H 4.500 . 5.000 3.193 2.656 3.506 . 0 0 "[ . 1 . 2]" 1
2381 2 74 TYR H 2 74 TYR HB2 3.500 . 3.800 2.645 2.606 2.678 . 0 0 "[ . 1 . 2]" 1
2382 2 74 TYR H 2 74 TYR HB3 3.500 . 3.800 2.487 2.442 2.560 . 0 0 "[ . 1 . 2]" 1
2383 2 74 TYR H 2 74 TYR QD 4.500 . 5.000 4.254 4.240 4.276 . 0 0 "[ . 1 . 2]" 1
2384 2 74 TYR H 2 75 VAL H 3.500 . 3.800 2.578 2.496 2.700 . 0 0 "[ . 1 . 2]" 1
2385 2 74 TYR H 2 75 VAL HB 5.200 . 5.700 4.565 4.093 4.833 . 0 0 "[ . 1 . 2]" 1
2386 2 74 TYR H 2 75 VAL QG 4.500 . 5.000 4.101 3.872 4.370 . 0 0 "[ . 1 . 2]" 1
2387 2 74 TYR H 2 76 VAL H 4.500 . 5.000 4.043 3.919 4.230 . 0 0 "[ . 1 . 2]" 1
2388 2 74 TYR H 2 77 LEU MD1 4.500 . 5.000 4.256 4.173 4.274 . 0 0 "[ . 1 . 2]" 1
2389 2 74 TYR HA 2 76 VAL H 4.500 . 5.000 4.235 4.092 4.408 . 0 0 "[ . 1 . 2]" 1
2390 2 74 TYR HA 2 77 LEU H 4.500 . 5.000 3.307 3.225 3.450 . 0 0 "[ . 1 . 2]" 1
2391 2 74 TYR HA 2 77 LEU HB2 4.500 . 5.000 2.446 2.380 2.587 . 0 0 "[ . 1 . 2]" 1
2392 2 74 TYR HA 2 77 LEU MD1 3.500 . 3.800 2.271 2.197 2.396 . 0 0 "[ . 1 . 2]" 1
2393 2 74 TYR HA 2 78 VAL H 4.500 . 5.000 4.359 4.245 4.601 . 0 0 "[ . 1 . 2]" 1
2394 2 74 TYR HB2 2 75 VAL H 4.500 . 5.000 3.891 3.842 3.969 . 0 0 "[ . 1 . 2]" 1
2395 2 74 TYR HB2 2 77 LEU MD1 4.500 . 5.000 3.959 3.858 4.077 . 0 0 "[ . 1 . 2]" 1
2396 2 74 TYR HB3 2 75 VAL H 3.500 . 3.800 2.584 2.547 2.654 . 0 0 "[ . 1 . 2]" 1
2397 2 74 TYR QD 2 75 VAL H 4.500 . 5.000 3.974 3.915 4.030 . 0 0 "[ . 1 . 2]" 1
2398 2 74 TYR QD 2 77 LEU MD1 4.500 . 5.000 2.936 2.809 3.014 . 0 0 "[ . 1 . 2]" 1
2399 2 74 TYR QD 2 78 VAL MG1 4.500 . 5.000 3.295 3.209 3.413 . 0 0 "[ . 1 . 2]" 1
2400 2 74 TYR QE 2 77 LEU MD1 4.500 . 5.000 4.439 4.301 4.461 . 0 0 "[ . 1 . 2]" 1
2401 2 74 TYR QE 2 78 VAL MG1 4.500 . 5.000 2.756 2.653 2.893 . 0 0 "[ . 1 . 2]" 1
2402 2 75 VAL H 2 75 VAL HB 3.500 . 3.800 2.336 2.008 2.493 . 0 0 "[ . 1 . 2]" 1
2403 2 75 VAL H 2 75 VAL QG . . 3.800 2.284 2.054 2.655 . 0 0 "[ . 1 . 2]" 1
2404 2 75 VAL H 2 76 VAL H 3.500 . 3.800 2.783 2.683 2.903 . 0 0 "[ . 1 . 2]" 1
2405 2 75 VAL H 2 76 VAL QG 4.500 . 5.000 4.256 4.146 4.492 . 0 0 "[ . 1 . 2]" 1
2406 2 75 VAL H 2 77 LEU HB2 5.200 . 5.700 4.952 4.900 5.038 . 0 0 "[ . 1 . 2]" 1
2407 2 75 VAL H 2 78 VAL H 5.200 . 5.700 4.902 4.867 4.931 . 0 0 "[ . 1 . 2]" 1
2408 2 75 VAL H 2 78 VAL MG1 5.200 . 5.700 4.689 4.672 4.709 . 0 0 "[ . 1 . 2]" 1
2409 2 75 VAL HA 2 77 LEU H 4.500 . 5.000 4.320 4.231 4.396 . 0 0 "[ . 1 . 2]" 1
2410 2 75 VAL HA 2 78 VAL H 4.500 . 5.000 3.450 3.279 3.537 . 0 0 "[ . 1 . 2]" 1
2411 2 75 VAL HA 2 78 VAL MG1 4.500 . 5.000 3.200 2.939 3.366 . 0 0 "[ . 1 . 2]" 1
2412 2 75 VAL HA 2 78 VAL MG2 4.500 . 5.000 2.273 2.180 2.380 . 0 0 "[ . 1 . 2]" 1
2413 2 75 VAL HB 2 76 VAL H 3.500 . 3.800 3.070 2.745 4.013 0.213 2 0 "[ . 1 . 2]" 1
2414 2 75 VAL QG 2 76 VAL H . . 3.800 3.054 2.496 3.401 . 0 0 "[ . 1 . 2]" 1
2415 2 75 VAL QG 2 76 VAL QG 4.500 . 5.000 3.242 2.461 3.692 . 0 0 "[ . 1 . 2]" 1
2416 2 75 VAL QG 2 77 LEU H 5.200 . 5.700 4.494 4.218 4.674 . 0 0 "[ . 1 . 2]" 1
2417 2 76 VAL H 2 76 VAL HB 3.500 . 3.800 2.475 2.373 2.499 . 0 0 "[ . 1 . 2]" 1
2418 2 76 VAL H 2 76 VAL QG . . 3.800 2.269 2.199 2.435 . 0 0 "[ . 1 . 2]" 1
2419 2 76 VAL H 2 77 LEU H 3.500 . 3.800 2.466 2.394 2.507 . 0 0 "[ . 1 . 2]" 1
2420 2 76 VAL H 2 77 LEU HB2 4.500 . 5.000 4.360 4.351 4.368 . 0 0 "[ . 1 . 2]" 1
2421 2 76 VAL H 2 77 LEU HG 4.500 . 5.000 4.732 4.616 4.772 . 0 0 "[ . 1 . 2]" 1
2422 2 76 VAL H 2 78 VAL H 4.500 . 5.000 4.120 3.882 4.221 . 0 0 "[ . 1 . 2]" 1
2423 2 76 VAL H 2 79 ALA H 5.200 . 5.700 4.734 4.568 4.799 . 0 0 "[ . 1 . 2]" 1
2424 2 76 VAL HA 2 76 VAL QG . . 3.000 2.171 2.149 2.196 . 0 0 "[ . 1 . 2]" 1
2425 2 76 VAL HA 2 79 ALA H 3.500 . 3.800 3.312 2.877 3.495 . 0 0 "[ . 1 . 2]" 1
2426 2 76 VAL HA 2 79 ALA MB 3.500 . 3.800 2.426 2.190 2.538 . 0 0 "[ . 1 . 2]" 1
2427 2 76 VAL HA 2 80 ALA H 4.500 . 5.000 4.325 4.068 4.460 . 0 0 "[ . 1 . 2]" 1
2428 2 76 VAL HA 2 80 ALA MB 4.500 . 5.000 5.045 4.822 5.154 0.154 20 0 "[ . 1 . 2]" 1
2429 2 76 VAL HB 2 78 VAL H 5.200 . 5.700 5.247 5.138 5.526 . 0 0 "[ . 1 . 2]" 1
2430 2 76 VAL HB 2 79 ALA H 5.200 . 5.700 5.459 5.285 5.502 . 0 0 "[ . 1 . 2]" 1
2431 2 76 VAL QG 2 79 ALA MB 3.500 . 3.800 3.227 2.790 3.392 . 0 0 "[ . 1 . 2]" 1
2432 2 76 VAL QG 2 80 ALA H 3.500 . 3.800 4.032 3.920 4.134 0.334 20 0 "[ . 1 . 2]" 1
2433 2 76 VAL QG 2 80 ALA HA 4.500 . 5.000 4.681 4.523 4.815 . 0 0 "[ . 1 . 2]" 1
2434 2 77 LEU H 2 77 LEU HB3 3.500 . 3.800 3.507 3.488 3.540 . 0 0 "[ . 1 . 2]" 1
2435 2 77 LEU H 2 77 LEU MD1 4.500 . 5.000 3.511 3.448 3.603 . 0 0 "[ . 1 . 2]" 1
2436 2 77 LEU H 2 77 LEU HG 3.500 . 3.800 2.750 2.646 2.873 . 0 0 "[ . 1 . 2]" 1
2437 2 77 LEU H 2 78 VAL H 3.500 . 3.800 2.726 2.578 2.782 . 0 0 "[ . 1 . 2]" 1
2438 2 77 LEU H 2 78 VAL MG1 4.500 . 5.000 4.153 4.120 4.177 . 0 0 "[ . 1 . 2]" 1
2439 2 77 LEU H 2 79 ALA H 4.500 . 5.000 4.011 3.955 4.079 . 0 0 "[ . 1 . 2]" 1
2440 2 77 LEU HA 2 80 ALA H 3.500 . 3.800 3.414 3.247 3.562 . 0 0 "[ . 1 . 2]" 1
2441 2 77 LEU HB2 2 78 VAL H 4.500 . 5.000 2.917 2.849 3.048 . 0 0 "[ . 1 . 2]" 1
2442 2 77 LEU HB2 2 78 VAL HA 5.200 . 5.700 4.739 4.702 4.785 . 0 0 "[ . 1 . 2]" 1
2443 2 77 LEU HB3 2 78 VAL H 4.500 . 5.000 3.540 3.454 3.732 . 0 0 "[ . 1 . 2]" 1
2444 2 78 VAL H 2 78 VAL MG1 3.500 . 3.800 2.211 2.142 2.418 . 0 0 "[ . 1 . 2]" 1
2445 2 78 VAL H 2 78 VAL MG2 3.500 . 3.800 2.439 2.341 2.608 . 0 0 "[ . 1 . 2]" 1
2446 2 78 VAL H 2 79 ALA H 3.500 . 3.800 2.408 2.297 2.440 . 0 0 "[ . 1 . 2]" 1
2447 2 78 VAL H 2 79 ALA MB 4.500 . 5.000 4.093 3.979 4.121 . 0 0 "[ . 1 . 2]" 1
2448 2 78 VAL H 2 81 LEU H 5.200 . 5.700 5.252 5.182 5.385 . 0 0 "[ . 1 . 2]" 1
2449 2 78 VAL HA 2 78 VAL MG1 3.500 . 3.800 2.450 2.426 2.482 . 0 0 "[ . 1 . 2]" 1
2450 2 78 VAL HA 2 78 VAL MG2 3.500 . 3.800 3.272 3.265 3.284 . 0 0 "[ . 1 . 2]" 1
2451 2 78 VAL HA 2 79 ALA MB 5.200 . 5.700 4.967 4.953 4.984 . 0 0 "[ . 1 . 2]" 1
2452 2 78 VAL HA 2 81 LEU H 4.500 . 5.000 3.526 3.407 3.656 . 0 0 "[ . 1 . 2]" 1
2453 2 78 VAL HA 2 81 LEU MD2 4.500 . 5.000 3.969 3.672 4.379 . 0 0 "[ . 1 . 2]" 1
2454 2 78 VAL HA 2 82 THR H 5.200 . 5.700 5.023 4.900 5.242 . 0 0 "[ . 1 . 2]" 1
2455 2 78 VAL HB 2 79 ALA H 4.500 . 5.000 4.143 4.112 4.171 . 0 0 "[ . 1 . 2]" 1
2456 2 78 VAL MG1 2 79 ALA H 4.500 . 5.000 3.868 3.819 3.934 . 0 0 "[ . 1 . 2]" 1
2457 2 78 VAL MG1 2 79 ALA HA 5.200 . 5.700 5.474 5.444 5.511 . 0 0 "[ . 1 . 2]" 1
2458 2 78 VAL MG1 2 80 ALA H 5.200 . 5.700 5.190 5.150 5.217 . 0 0 "[ . 1 . 2]" 1
2459 2 78 VAL MG2 2 79 ALA H 3.500 . 3.800 2.501 2.442 2.555 . 0 0 "[ . 1 . 2]" 1
2460 2 78 VAL MG2 2 79 ALA MB 3.500 . 3.800 3.070 2.995 3.137 . 0 0 "[ . 1 . 2]" 1
2461 2 78 VAL MG2 2 81 LEU H 5.200 . 5.700 4.921 4.799 4.988 . 0 0 "[ . 1 . 2]" 1
2462 2 79 ALA H 2 80 ALA H 3.500 . 3.800 2.582 2.548 2.649 . 0 0 "[ . 1 . 2]" 1
2463 2 79 ALA H 2 80 ALA MB 4.500 . 5.000 4.267 4.238 4.314 . 0 0 "[ . 1 . 2]" 1
2464 2 79 ALA H 2 81 LEU H 4.500 . 5.000 4.168 4.106 4.284 . 0 0 "[ . 1 . 2]" 1
2465 2 79 ALA H 2 82 THR H 4.500 . 5.000 4.832 4.738 4.944 . 0 0 "[ . 1 . 2]" 1
2466 2 79 ALA HA 2 82 THR H 3.500 . 3.800 2.745 2.639 2.857 . 0 0 "[ . 1 . 2]" 1
2467 2 79 ALA HA 2 83 VAL MG2 4.500 . 5.000 4.927 4.857 5.006 0.006 17 0 "[ . 1 . 2]" 1
2468 2 79 ALA MB 2 80 ALA H 3.500 . 3.800 2.950 2.925 2.975 . 0 0 "[ . 1 . 2]" 1
2469 2 79 ALA MB 2 81 LEU HG 5.200 . 5.700 5.657 5.534 5.882 0.182 17 0 "[ . 1 . 2]" 1
2470 2 79 ALA MB 2 83 VAL H 4.500 . 5.000 4.124 4.018 4.301 . 0 0 "[ . 1 . 2]" 1
2471 2 80 ALA H 2 80 ALA MB 2.700 . 3.000 2.231 2.219 2.238 . 0 0 "[ . 1 . 2]" 1
2472 2 80 ALA H 2 81 LEU H 3.500 . 3.800 2.603 2.571 2.672 . 0 0 "[ . 1 . 2]" 1
2473 2 80 ALA H 2 81 LEU HG 4.500 . 5.000 3.933 3.849 4.162 . 0 0 "[ . 1 . 2]" 1
2474 2 80 ALA H 2 83 VAL MG2 5.200 . 5.700 4.379 4.277 4.542 . 0 0 "[ . 1 . 2]" 1
2475 2 80 ALA HA 2 83 VAL MG1 4.500 . 5.000 3.647 3.526 3.828 . 0 0 "[ . 1 . 2]" 1
2476 2 80 ALA HA 2 83 VAL MG2 4.500 . 5.000 2.178 2.087 2.402 . 0 0 "[ . 1 . 2]" 1
2477 2 80 ALA MB 2 81 LEU H 3.500 . 3.800 2.695 2.634 2.764 . 0 0 "[ . 1 . 2]" 1
2478 2 80 ALA MB 2 81 LEU HG 4.500 . 5.000 3.334 3.221 3.472 . 0 0 "[ . 1 . 2]" 1
2479 2 80 ALA MB 2 83 VAL MG2 4.500 . 5.000 3.481 3.400 3.649 . 0 0 "[ . 1 . 2]" 1
2480 2 81 LEU H 2 81 LEU HB3 3.500 . 3.800 3.605 3.583 3.624 . 0 0 "[ . 1 . 2]" 1
2481 2 81 LEU H 2 81 LEU MD1 4.500 . 5.000 3.607 3.559 3.721 . 0 0 "[ . 1 . 2]" 1
2482 2 81 LEU H 2 81 LEU MD2 3.500 . 3.800 2.993 2.894 3.046 . 0 0 "[ . 1 . 2]" 1
2483 2 81 LEU H 2 81 LEU HG 3.500 . 3.800 2.057 1.987 2.222 . 0 0 "[ . 1 . 2]" 1
2484 2 81 LEU H 2 82 THR H 3.500 . 3.800 2.441 2.412 2.469 . 0 0 "[ . 1 . 2]" 1
2485 2 81 LEU H 2 82 THR HA 5.200 . 5.700 5.095 5.090 5.101 . 0 0 "[ . 1 . 2]" 1
2486 2 81 LEU H 2 83 VAL MG2 4.500 . 5.000 4.332 4.257 4.388 . 0 0 "[ . 1 . 2]" 1
2487 2 81 LEU H 2 84 ALA H 5.200 . 5.700 4.847 4.733 4.918 . 0 0 "[ . 1 . 2]" 1
2488 2 81 LEU H 2 84 ALA MB 5.200 . 5.700 4.858 4.679 4.982 . 0 0 "[ . 1 . 2]" 1
2489 2 81 LEU HA 2 84 ALA H 4.500 . 5.000 3.605 3.490 3.643 . 0 0 "[ . 1 . 2]" 1
2490 2 81 LEU HA 2 84 ALA MB 3.500 . 3.800 2.755 2.568 2.884 . 0 0 "[ . 1 . 2]" 1
2491 2 81 LEU HB2 2 84 ALA H 5.200 . 5.700 5.558 5.511 5.628 . 0 0 "[ . 1 . 2]" 1
2492 2 81 LEU HB3 2 82 THR H 4.500 . 5.000 3.936 3.891 3.966 . 0 0 "[ . 1 . 2]" 1
2493 2 81 LEU MD1 2 82 THR H 4.500 . 5.000 4.464 4.348 4.650 . 0 0 "[ . 1 . 2]" 1
2494 2 81 LEU MD1 2 82 THR HA 5.200 . 5.700 5.637 5.476 5.765 0.065 15 0 "[ . 1 . 2]" 1
2495 2 81 LEU MD2 2 82 THR H 4.500 . 5.000 4.595 4.549 4.619 . 0 0 "[ . 1 . 2]" 1
2496 2 81 LEU HG 2 82 THR H 3.500 . 3.800 3.974 3.834 4.173 0.373 17 0 "[ . 1 . 2]" 1
2497 2 82 THR H 2 82 THR MG 4.500 . 5.000 3.713 3.662 3.785 . 0 0 "[ . 1 . 2]" 1
2498 2 82 THR H 2 83 VAL H 3.500 . 3.800 2.724 2.696 2.759 . 0 0 "[ . 1 . 2]" 1
2499 2 82 THR H 2 83 VAL HA 5.200 . 5.700 5.298 5.251 5.347 . 0 0 "[ . 1 . 2]" 1
2500 2 82 THR H 2 83 VAL MG1 5.200 . 5.700 4.337 4.228 4.388 . 0 0 "[ . 1 . 2]" 1
2501 2 82 THR H 2 83 VAL MG2 4.500 . 5.000 3.999 3.989 4.018 . 0 0 "[ . 1 . 2]" 1
2502 2 82 THR H 2 84 ALA H 4.500 . 5.000 4.061 3.990 4.121 . 0 0 "[ . 1 . 2]" 1
2503 2 82 THR H 2 84 ALA MB 4.500 . 5.000 4.823 4.686 4.927 . 0 0 "[ . 1 . 2]" 1
2504 2 82 THR HA 2 84 ALA H 4.500 . 5.000 4.353 4.338 4.364 . 0 0 "[ . 1 . 2]" 1
2505 2 82 THR HA 2 85 CYS H 4.500 . 5.000 3.389 3.294 3.517 . 0 0 "[ . 1 . 2]" 1
2506 2 82 THR HA 2 86 ASN H 4.500 . 5.000 3.788 3.606 3.960 . 0 0 "[ . 1 . 2]" 1
2507 2 82 THR MG 2 83 VAL H 4.500 . 5.000 3.787 3.537 3.960 . 0 0 "[ . 1 . 2]" 1
2508 2 82 THR MG 2 85 CYS H 4.500 . 5.000 4.599 4.503 4.684 . 0 0 "[ . 1 . 2]" 1
2509 2 82 THR MG 2 86 ASN H 4.500 . 5.000 3.830 3.754 3.982 . 0 0 "[ . 1 . 2]" 1
2510 2 82 THR MG 2 86 ASN HA 4.500 . 5.000 5.419 5.301 5.472 0.472 2 0 "[ . 1 . 2]" 1
2511 2 82 THR MG 2 86 ASN QB 3.500 . 3.800 2.886 2.777 2.978 . 0 0 "[ . 1 . 2]" 1
2512 2 83 VAL H 2 83 VAL MG1 4.500 . 5.000 2.288 2.206 2.341 . 0 0 "[ . 1 . 2]" 1
2513 2 83 VAL H 2 83 VAL MG2 3.500 . 3.800 2.104 2.061 2.149 . 0 0 "[ . 1 . 2]" 1
2514 2 83 VAL H 2 84 ALA H 3.500 . 3.800 2.624 2.585 2.649 . 0 0 "[ . 1 . 2]" 1
2515 2 83 VAL H 2 86 ASN H 5.200 . 5.700 4.823 4.749 4.881 . 0 0 "[ . 1 . 2]" 1
2516 2 83 VAL HA 2 83 VAL MG1 3.500 . 3.800 2.368 2.323 2.409 . 0 0 "[ . 1 . 2]" 1
2517 2 83 VAL HA 2 83 VAL MG2 3.500 . 3.800 3.241 3.227 3.258 . 0 0 "[ . 1 . 2]" 1
2518 2 83 VAL HA 2 84 ALA H 3.500 . 3.800 3.538 3.522 3.547 . 0 0 "[ . 1 . 2]" 1
2519 2 83 VAL HA 2 86 ASN H 3.500 . 3.800 3.502 3.255 3.721 . 0 0 "[ . 1 . 2]" 1
2520 2 83 VAL HA 2 87 ASN HB2 4.500 . 5.000 2.102 1.865 2.448 . 0 0 "[ . 1 . 2]" 1
2521 2 83 VAL HB 2 84 ALA HA 4.500 . 5.000 4.506 4.500 4.514 . 0 0 "[ . 1 . 2]" 1
2522 2 83 VAL MG1 2 86 ASN H 5.200 . 5.700 5.250 5.055 5.424 . 0 0 "[ . 1 . 2]" 1
2523 2 83 VAL MG2 2 84 ALA H 3.500 . 3.800 2.320 2.232 2.374 . 0 0 "[ . 1 . 2]" 1
2524 2 83 VAL MG2 2 84 ALA MB 4.500 . 5.000 3.008 2.883 3.085 . 0 0 "[ . 1 . 2]" 1
2525 2 83 VAL MG2 2 85 CYS H 4.500 . 5.000 4.356 4.344 4.373 . 0 0 "[ . 1 . 2]" 1
2526 2 83 VAL MG2 2 86 ASN H 5.200 . 5.700 5.313 5.174 5.404 . 0 0 "[ . 1 . 2]" 1
2527 2 83 VAL MG2 2 87 ASN HB2 4.500 . 5.000 4.205 3.895 4.420 . 0 0 "[ . 1 . 2]" 1
2528 2 84 ALA H 2 85 CYS H 3.500 . 3.800 2.548 2.499 2.626 . 0 0 "[ . 1 . 2]" 1
2529 2 84 ALA H 2 85 CYS HB3 5.200 . 5.700 4.772 4.647 4.864 . 0 0 "[ . 1 . 2]" 1
2530 2 84 ALA H 2 86 ASN H 4.500 . 5.000 4.332 4.259 4.354 . 0 0 "[ . 1 . 2]" 1
2531 2 84 ALA MB 2 85 CYS H 3.500 . 3.800 2.820 2.712 2.908 . 0 0 "[ . 1 . 2]" 1
2532 2 84 ALA MB 2 85 CYS HA 4.500 . 5.000 3.963 3.915 4.013 . 0 0 "[ . 1 . 2]" 1
2533 2 84 ALA MB 2 85 CYS HB2 4.500 . 5.000 3.996 3.921 4.064 . 0 0 "[ . 1 . 2]" 1
2534 2 84 ALA MB 2 86 ASN H 4.500 . 5.000 4.839 4.766 4.902 . 0 0 "[ . 1 . 2]" 1
2535 2 85 CYS H 2 85 CYS HB2 3.500 . 3.800 2.599 2.506 2.692 . 0 0 "[ . 1 . 2]" 1
2536 2 85 CYS H 2 85 CYS HB3 3.500 . 3.800 2.436 2.365 2.529 . 0 0 "[ . 1 . 2]" 1
2537 2 85 CYS H 2 86 ASN H 3.500 . 3.800 2.511 2.437 2.595 . 0 0 "[ . 1 . 2]" 1
2538 2 85 CYS H 2 86 ASN QB 4.500 . 5.000 4.395 4.321 4.421 . 0 0 "[ . 1 . 2]" 1
2539 2 85 CYS HB3 2 86 ASN H 4.500 . 5.000 2.448 2.240 2.623 . 0 0 "[ . 1 . 2]" 1
2540 2 86 ASN H 2 86 ASN HD21 5.200 . 5.700 4.567 3.664 4.902 . 0 0 "[ . 1 . 2]" 1
2541 2 87 ASN H 2 88 PHE H 4.500 . 5.000 2.480 2.299 2.700 . 0 0 "[ . 1 . 2]" 1
2542 2 87 ASN HA 2 87 ASN HD22 5.200 . 5.700 3.531 3.445 3.646 . 0 0 "[ . 1 . 2]" 1
2543 2 87 ASN HA 2 89 PHE H 4.500 . 5.000 3.464 3.313 3.591 . 0 0 "[ . 1 . 2]" 1
2544 2 87 ASN HA 2 90 TRP H 4.500 . 5.000 4.393 4.372 4.401 . 0 0 "[ . 1 . 2]" 1
2545 2 87 ASN HA 2 90 TRP HB3 4.500 . 5.000 4.774 4.754 4.786 . 0 0 "[ . 1 . 2]" 1
2546 2 88 PHE H 2 88 PHE QB 3.500 . 3.800 2.132 1.986 2.187 . 0 0 "[ . 1 . 2]" 1
2547 2 88 PHE H 2 88 PHE QD 5.200 . 5.700 3.231 2.317 4.140 . 0 0 "[ . 1 . 2]" 1
2548 2 88 PHE H 2 89 PHE H 3.500 . 3.800 3.067 2.954 3.216 . 0 0 "[ . 1 . 2]" 1
2549 2 88 PHE H 2 90 TRP H 4.500 . 5.000 4.477 4.440 4.581 . 0 0 "[ . 1 . 2]" 1
2550 2 88 PHE HA 2 89 PHE HA 5.200 . 5.700 4.726 4.666 4.775 . 0 0 "[ . 1 . 2]" 1
2551 2 88 PHE HA 2 90 TRP H 4.500 . 5.000 3.265 3.113 3.480 . 0 0 "[ . 1 . 2]" 1
2552 2 88 PHE HA 2 90 TRP HE1 4.500 . 5.000 2.833 2.668 3.105 . 0 0 "[ . 1 . 2]" 1
2553 2 88 PHE QB 2 89 PHE H 4.500 . 5.000 3.375 2.860 3.848 . 0 0 "[ . 1 . 2]" 1
2554 2 88 PHE QD 2 89 PHE H 5.200 . 5.700 3.570 3.133 4.232 . 0 0 "[ . 1 . 2]" 1
2555 2 89 PHE H 2 90 TRP HA 4.500 . 5.000 4.955 4.780 5.095 0.095 1 0 "[ . 1 . 2]" 1
2556 2 89 PHE H 2 90 TRP HB3 5.200 . 5.700 4.989 4.776 5.151 . 0 0 "[ . 1 . 2]" 1
2557 2 89 PHE H 2 90 TRP HE1 5.200 . 5.700 5.518 5.504 5.537 . 0 0 "[ . 1 . 2]" 1
2558 2 89 PHE H 2 91 GLU H 4.500 . 5.000 4.706 4.560 4.863 . 0 0 "[ . 1 . 2]" 1
2559 2 89 PHE HA 2 90 TRP HE1 5.200 . 5.700 5.451 5.195 5.518 . 0 0 "[ . 1 . 2]" 1
2560 2 89 PHE HA 2 91 GLU H 4.500 . 5.000 3.099 2.904 3.247 . 0 0 "[ . 1 . 2]" 1
2561 2 90 TRP H 2 90 TRP HB2 3.500 . 3.800 3.553 3.516 3.570 . 0 0 "[ . 1 . 2]" 1
2562 2 90 TRP H 2 90 TRP HB3 3.500 . 3.800 2.787 2.678 2.870 . 0 0 "[ . 1 . 2]" 1
2563 2 90 TRP H 2 90 TRP HE1 4.500 . 5.000 4.075 4.009 4.163 . 0 0 "[ . 1 . 2]" 1
2564 2 90 TRP H 2 91 GLU H 3.500 . 3.800 2.731 2.559 2.876 . 0 0 "[ . 1 . 2]" 1
2565 2 90 TRP H 2 91 GLU QG 4.500 . 5.000 4.453 3.762 5.042 0.042 16 0 "[ . 1 . 2]" 1
2566 2 90 TRP HA 2 90 TRP HD1 4.500 . 5.000 4.039 4.008 4.057 . 0 0 "[ . 1 . 2]" 1
2567 2 90 TRP HA 2 90 TRP HE3 4.500 . 5.000 4.783 4.770 4.792 . 0 0 "[ . 1 . 2]" 1
2568 2 90 TRP HA 2 91 GLU H 3.500 . 3.800 3.427 3.353 3.461 . 0 0 "[ . 1 . 2]" 1
2569 2 90 TRP HB2 2 90 TRP HE1 5.200 . 5.700 5.054 5.035 5.075 . 0 0 "[ . 1 . 2]" 1
2570 2 90 TRP HB2 2 91 GLU H 4.500 . 5.000 3.954 3.785 4.008 . 0 0 "[ . 1 . 2]" 1
2571 2 90 TRP HB2 2 91 GLU HA 4.500 . 5.000 4.472 4.221 4.597 . 0 0 "[ . 1 . 2]" 1
2572 2 90 TRP HB3 2 90 TRP HE1 5.200 . 5.700 5.273 5.267 5.282 . 0 0 "[ . 1 . 2]" 1
2573 2 90 TRP HB3 2 91 GLU H 4.500 . 5.000 4.377 4.316 4.461 . 0 0 "[ . 1 . 2]" 1
2574 2 90 TRP HD1 2 91 GLU HA 3.500 . 3.800 3.398 2.962 3.714 . 0 0 "[ . 1 . 2]" 1
2575 2 91 GLU H 2 91 GLU QB 3.500 . 3.800 2.381 2.091 2.959 . 0 0 "[ . 1 . 2]" 1
2576 2 91 GLU H 2 91 GLU QG 3.500 . 3.800 2.613 1.846 3.543 . 0 0 "[ . 1 . 2]" 1
2577 2 91 GLU H 2 92 ASN H 4.500 . 5.000 4.518 4.201 4.653 . 0 0 "[ . 1 . 2]" 1
2578 2 91 GLU H 2 92 ASN HA 5.200 . 5.700 5.293 4.657 5.523 . 0 0 "[ . 1 . 2]" 1
2579 2 91 GLU HA 2 92 ASN H 3.500 . 3.800 2.276 2.124 2.487 . 0 0 "[ . 1 . 2]" 1
2580 2 91 GLU QB 2 92 ASN H 4.500 . 5.000 2.924 2.376 3.632 . 0 0 "[ . 1 . 2]" 1
2581 2 91 GLU QG 2 92 ASN H 4.500 . 5.000 4.228 3.704 4.622 . 0 0 "[ . 1 . 2]" 1
2582 2 92 ASN H 2 92 ASN QB 3.500 . 3.800 2.318 2.161 2.479 . 0 0 "[ . 1 . 2]" 1
2583 2 92 ASN H 2 93 SER H 4.500 . 5.000 4.567 4.498 4.651 . 0 0 "[ . 1 . 2]" 1
2584 2 92 ASN HA 2 92 ASN HD21 4.500 . 5.000 2.404 1.790 3.604 0.010 13 0 "[ . 1 . 2]" 1
2585 2 92 ASN HA 2 92 ASN QD 3.500 . 3.800 2.345 1.783 3.358 0.017 13 0 "[ . 1 . 2]" 1
2586 2 92 ASN HA 2 92 ASN HD22 4.500 . 5.000 3.625 3.334 4.009 . 0 0 "[ . 1 . 2]" 1
2587 2 92 ASN HA 2 93 SER H 2.700 . 3.000 2.181 2.032 2.376 . 0 0 "[ . 1 . 2]" 1
2588 2 92 ASN QB 2 93 SER H 3.500 . 3.800 3.230 2.489 3.715 . 0 0 "[ . 1 . 2]" 1
2589 2 92 ASN HB2 2 93 SER H 4.500 . 5.000 4.154 3.841 4.280 . 0 0 "[ . 1 . 2]" 1
2590 2 92 ASN HB3 2 93 SER H 4.500 . 5.000 3.427 2.521 4.092 . 0 0 "[ . 1 . 2]" 1
2591 2 93 SER H 2 93 SER QB 3.500 . 3.800 2.699 2.500 2.854 . 0 0 "[ . 1 . 2]" 1
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