NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
622777 |
5wyo   |
36045 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5wyo
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 1917
_Distance_constraint_stats_list.Viol_count 8102
_Distance_constraint_stats_list.Viol_total 16775.813
_Distance_constraint_stats_list.Viol_max 0.988
_Distance_constraint_stats_list.Viol_rms 0.0706
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0219
_Distance_constraint_stats_list.Viol_average_violations_only 0.1035
_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 ALA 0.194 0.101 13 0 "[ . 1 . 2]"
1 2 ASP 0.424 0.101 13 0 "[ . 1 . 2]"
1 3 ALA 0.250 0.071 19 0 "[ . 1 . 2]"
1 4 GLN 0.271 0.086 1 0 "[ . 1 . 2]"
1 5 LYS 7.809 0.720 20 3 "[- . 1 * +]"
1 6 ALA 0.163 0.086 1 0 "[ . 1 . 2]"
1 7 ALA 1.227 0.169 6 0 "[ . 1 . 2]"
1 8 ASP 0.924 0.241 9 0 "[ . 1 . 2]"
1 9 ASN 0.398 0.152 1 0 "[ . 1 . 2]"
1 10 LYS 10.430 0.535 7 3 "[ . + - . * 2]"
1 11 LYS 0.762 0.384 6 0 "[ . 1 . 2]"
1 12 PRO 1.097 0.155 5 0 "[ . 1 . 2]"
1 13 VAL 2.828 0.904 16 1 "[ . 1 .+ 2]"
1 14 ASN 1.799 0.904 16 1 "[ . 1 .+ 2]"
1 15 SER 3.952 0.164 7 0 "[ . 1 . 2]"
1 16 TRP 2.931 0.148 11 0 "[ . 1 . 2]"
1 17 THR 2.928 0.186 5 0 "[ . 1 . 2]"
1 18 CYS 6.691 0.402 1 0 "[ . 1 . 2]"
1 19 GLU 1.866 0.452 15 0 "[ . 1 . 2]"
1 20 ASP 1.947 0.136 7 0 "[ . 1 . 2]"
1 21 PHE 1.729 0.114 5 0 "[ . 1 . 2]"
1 22 LEU 7.808 0.637 20 3 "[ . * 1 . *+]"
1 23 ALA 3.638 0.222 3 0 "[ . 1 . 2]"
1 24 VAL 4.542 0.214 4 0 "[ . 1 . 2]"
1 25 ASP 7.197 0.278 15 0 "[ . 1 . 2]"
1 26 GLU 16.326 0.692 9 2 "[ . - +1 . 2]"
1 27 SER 14.180 0.610 10 2 "[ . -+ . 2]"
1 28 PHE 13.829 0.610 10 2 "[ . -+ . 2]"
1 29 GLN 9.314 0.692 9 2 "[ . - +1 . 2]"
1 30 PRO 11.943 0.406 20 0 "[ . 1 . 2]"
1 31 THR 13.097 0.505 10 1 "[ . + . 2]"
1 32 ALA 4.683 0.205 2 0 "[ . 1 . 2]"
1 33 VAL 2.898 0.143 7 0 "[ . 1 . 2]"
1 34 GLY 4.259 0.505 10 1 "[ . + . 2]"
1 35 PHE 1.494 0.166 1 0 "[ . 1 . 2]"
1 36 ALA 2.971 0.205 2 0 "[ . 1 . 2]"
1 37 GLU 1.368 0.100 5 0 "[ . 1 . 2]"
1 38 ALA 2.346 0.090 9 0 "[ . 1 . 2]"
1 39 LEU 10.824 0.393 16 0 "[ . 1 . 2]"
1 40 ASN 1.558 0.813 2 1 "[ + . 1 . 2]"
1 41 ASN 5.512 0.154 9 0 "[ . 1 . 2]"
1 42 LYS 20.436 0.678 1 9 "[+ *. *1*- .*** *]"
1 43 ASP 4.969 0.314 16 0 "[ . 1 . 2]"
1 44 LYS 17.233 0.661 7 9 "[ * .*+ * **** -]"
1 45 PRO 14.715 0.661 7 9 "[ * .*+ * **** -]"
1 46 GLU 2.822 0.749 19 2 "[- . 1 . +2]"
1 47 ASP 2.270 0.343 3 0 "[ . 1 . 2]"
1 48 ALA 2.676 0.143 12 0 "[ . 1 . 2]"
1 49 VAL 2.142 0.197 4 0 "[ . 1 . 2]"
1 50 LEU 1.553 0.197 4 0 "[ . 1 . 2]"
1 51 ASP 2.468 0.164 19 0 "[ . 1 . 2]"
1 52 VAL 2.754 0.164 19 0 "[ . 1 . 2]"
1 53 GLN 11.533 0.968 16 6 "[* * . * 1 .+ *-2]"
1 54 GLY 5.338 0.516 1 1 "[+ . 1 . 2]"
1 55 ILE 4.635 0.306 20 0 "[ . 1 . 2]"
1 56 ALA 0.783 0.054 1 0 "[ . 1 . 2]"
1 57 THR 5.839 0.200 4 0 "[ . 1 . 2]"
1 58 VAL 6.181 0.179 13 0 "[ . 1 . 2]"
1 59 THR 10.100 0.245 2 0 "[ . 1 . 2]"
1 60 PRO 1.299 0.120 1 0 "[ . 1 . 2]"
1 61 ALA 13.605 0.329 9 0 "[ . 1 . 2]"
1 62 ILE 10.609 0.442 10 0 "[ . 1 . 2]"
1 63 VAL 5.970 0.143 11 0 "[ . 1 . 2]"
1 64 GLN 11.079 0.473 18 0 "[ . 1 . 2]"
1 65 ALA 6.871 0.303 9 0 "[ . 1 . 2]"
1 66 CYS 5.525 0.637 20 1 "[ . 1 . +]"
1 67 THR 10.367 0.200 9 0 "[ . 1 . 2]"
1 68 GLN 15.183 0.858 3 3 "[ +*. -1 . 2]"
1 69 ASP 6.656 0.513 9 1 "[ . +1 . 2]"
1 70 LYS 19.270 0.568 7 3 "[ . + 1 . *-]"
1 71 GLN 9.576 0.239 12 0 "[ . 1 . 2]"
1 72 ALA 2.313 0.125 10 0 "[ . 1 . 2]"
1 73 ASN 7.228 0.607 16 3 "[* . -1 .+ 2]"
1 74 PHE 3.905 0.777 5 2 "[ - + 1 . 2]"
1 75 LYS 15.110 0.699 16 8 "[* - * **1 *.+ *]"
1 76 ASP 12.517 0.988 5 8 "[* - + **1 *.* *]"
1 77 LYS 11.522 0.868 7 4 "[ - * + * . 2]"
1 78 VAL 3.807 0.195 1 0 "[ . 1 . 2]"
1 79 LYS 4.602 0.988 5 1 "[ + 1 . 2]"
1 80 GLY 0.193 0.096 5 0 "[ . 1 . 2]"
1 81 GLU 15.247 0.442 10 0 "[ . 1 . 2]"
1 82 TRP 7.560 0.241 12 0 "[ . 1 . 2]"
1 83 ASP 3.985 0.081 2 0 "[ . 1 . 2]"
1 84 LYS 15.435 0.670 3 2 "[ + . 1 - . 2]"
1 85 ILE 25.789 0.470 19 0 "[ . 1 . 2]"
1 86 LYS 15.293 0.341 1 0 "[ . 1 . 2]"
1 87 LYS 21.017 0.413 4 0 "[ . 1 . 2]"
1 88 ASP 4.476 0.198 5 0 "[ . 1 . 2]"
1 89 MET 1.143 0.198 5 0 "[ . 1 . 2]"
2 1 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 2 ASP 0.339 0.092 14 0 "[ . 1 . 2]"
2 3 ALA 0.402 0.092 14 0 "[ . 1 . 2]"
2 4 GLN 0.507 0.091 10 0 "[ . 1 . 2]"
2 5 LYS 3.733 0.546 20 1 "[ . 1 . +]"
2 6 ALA 0.485 0.089 16 0 "[ . 1 . 2]"
2 7 ALA 1.664 0.155 7 0 "[ . 1 . 2]"
2 8 ASP 1.509 0.226 16 0 "[ . 1 . 2]"
2 9 ASN 0.314 0.100 18 0 "[ . 1 . 2]"
2 10 LYS 10.102 0.446 9 0 "[ . 1 . 2]"
2 11 LYS 11.069 0.814 13 7 "[* * * 1 + . *-*]"
2 12 PRO 15.227 0.814 13 7 "[* * * 1 + . *-*]"
2 13 VAL 4.487 0.882 1 2 "[+ -. 1 . 2]"
2 14 ASN 2.598 0.882 1 2 "[+ -. 1 . 2]"
2 15 SER 4.510 0.302 19 0 "[ . 1 . 2]"
2 16 TRP 2.978 0.168 14 0 "[ . 1 . 2]"
2 17 THR 3.486 0.128 16 0 "[ . 1 . 2]"
2 18 CYS 6.414 0.958 11 3 "[ - . 1+ . * 2]"
2 19 GLU 1.097 0.149 12 0 "[ . 1 . 2]"
2 20 ASP 1.899 0.107 1 0 "[ . 1 . 2]"
2 21 PHE 4.597 0.830 3 1 "[ + . 1 . 2]"
2 22 LEU 10.241 0.966 7 3 "[ - . + 1 . * 2]"
2 23 ALA 4.104 0.623 3 1 "[ + . 1 . 2]"
2 24 VAL 4.673 0.205 17 0 "[ . 1 . 2]"
2 25 ASP 6.529 0.256 7 0 "[ . 1 . 2]"
2 26 GLU 15.460 0.449 9 0 "[ . 1 . 2]"
2 27 SER 14.879 0.571 15 5 "[ - 1 *+ * *]"
2 28 PHE 15.050 0.571 15 5 "[ - 1 *+ * *]"
2 29 GLN 8.003 0.449 9 0 "[ . 1 . 2]"
2 30 PRO 11.236 0.267 14 0 "[ . 1 . 2]"
2 31 THR 14.579 0.433 17 0 "[ . 1 . 2]"
2 32 ALA 4.744 0.179 13 0 "[ . 1 . 2]"
2 33 VAL 1.915 0.095 5 0 "[ . 1 . 2]"
2 34 GLY 6.959 0.444 2 0 "[ . 1 . 2]"
2 35 PHE 2.320 0.166 13 0 "[ . 1 . 2]"
2 36 ALA 3.047 0.179 13 0 "[ . 1 . 2]"
2 37 GLU 2.339 0.183 15 0 "[ . 1 . 2]"
2 38 ALA 3.838 0.166 13 0 "[ . 1 . 2]"
2 39 LEU 11.021 0.875 11 1 "[ . 1+ . 2]"
2 40 ASN 3.071 0.913 10 2 "[ . + . -2]"
2 41 ASN 5.097 0.144 7 0 "[ . 1 . 2]"
2 42 LYS 18.128 0.875 11 7 "[* * ** 1+* . - 2]"
2 43 ASP 3.354 0.224 5 0 "[ . 1 . 2]"
2 44 LYS 16.141 0.544 12 8 "[ * .** -1 + *.* * 2]"
2 45 PRO 13.565 0.544 12 8 "[ * .** -1 + *.* * 2]"
2 46 GLU 2.875 0.777 17 2 "[ . 1 - . + 2]"
2 47 ASP 2.101 0.325 19 0 "[ . 1 . 2]"
2 48 ALA 2.679 0.134 13 0 "[ . 1 . 2]"
2 49 VAL 2.048 0.179 15 0 "[ . 1 . 2]"
2 50 LEU 1.198 0.179 15 0 "[ . 1 . 2]"
2 51 ASP 2.499 0.170 20 0 "[ . 1 . 2]"
2 52 VAL 2.846 0.170 20 0 "[ . 1 . 2]"
2 53 GLN 10.682 0.934 7 4 "[- * + 1 . * 2]"
2 54 GLY 5.577 0.531 1 1 "[+ . 1 . 2]"
2 55 ILE 15.884 0.666 15 10 "[ **. **** * + -*]"
2 56 ALA 0.690 0.053 2 0 "[ . 1 . 2]"
2 57 THR 6.221 0.188 7 0 "[ . 1 . 2]"
2 58 VAL 22.566 0.709 4 10 "[ *+. **** * * -*]"
2 59 THR 11.658 0.267 14 0 "[ . 1 . 2]"
2 60 PRO 0.075 0.034 17 0 "[ . 1 . 2]"
2 61 ALA 19.240 0.709 4 2 "[ +. 1 - . 2]"
2 62 ILE 13.723 0.480 6 0 "[ . 1 . 2]"
2 63 VAL 6.331 0.172 17 0 "[ . 1 . 2]"
2 64 GLN 13.667 0.973 9 2 "[ . +1 . - 2]"
2 65 ALA 7.057 0.331 9 0 "[ . 1 . 2]"
2 66 CYS 6.155 0.958 11 3 "[ - . 1+ . * 2]"
2 67 THR 10.726 0.183 14 0 "[ . 1 . 2]"
2 68 GLN 14.785 0.879 15 2 "[ . 1- + 2]"
2 69 ASP 6.003 0.347 15 0 "[ . 1 . 2]"
2 70 LYS 20.415 0.966 7 3 "[ - . + 1 . * 2]"
2 71 GLN 9.527 0.244 2 0 "[ . 1 . 2]"
2 72 ALA 2.686 0.156 9 0 "[ . 1 . 2]"
2 73 ASN 8.324 0.607 18 5 "[ . ** 1 * -. + 2]"
2 74 PHE 3.685 0.624 2 3 "[ + . 1-* . 2]"
2 75 LYS 14.414 0.771 4 9 "[ * +* ***1- . * *]"
2 76 ASP 11.961 0.771 4 9 "[ * +* ***1- . * *]"
2 77 LYS 11.815 0.795 3 5 "[ *+ . *-* . 2]"
2 78 VAL 4.660 0.486 4 0 "[ . 1 . 2]"
2 79 LYS 5.146 0.579 13 3 "[ *. -1 + . 2]"
2 80 GLY 0.096 0.021 14 0 "[ . 1 . 2]"
2 81 GLU 16.953 0.480 6 0 "[ . 1 . 2]"
2 82 TRP 16.170 0.809 14 5 "[ *. -* *+. 2]"
2 83 ASP 6.936 0.719 14 1 "[ . 1 +. 2]"
2 84 LYS 13.928 0.315 4 0 "[ . 1 . 2]"
2 85 ILE 25.757 0.458 13 0 "[ . 1 . 2]"
2 86 LYS 15.364 0.333 4 0 "[ . 1 . 2]"
2 87 LYS 20.947 0.670 16 2 "[ . 1 -.+ 2]"
2 88 ASP 3.722 0.127 12 0 "[ . 1 . 2]"
2 89 MET 0.773 0.123 15 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 71 GLN H 1 71 GLN QG . . 2.800 2.316 2.200 2.553 . 0 0 "[ . 1 . 2]" 1
2 1 4 GLN H 1 4 GLN QG . . 2.800 2.587 1.837 2.848 0.048 15 0 "[ . 1 . 2]" 1
3 1 11 LYS H 1 11 LYS HB2 . . 3.500 3.026 2.610 3.884 0.384 6 0 "[ . 1 . 2]" 1
4 1 79 LYS H 1 79 LYS HB2 . . 2.800 2.396 2.281 2.454 . 0 0 "[ . 1 . 2]" 1
5 1 64 GLN QB 1 65 ALA H . . 2.800 2.449 2.320 2.547 . 0 0 "[ . 1 . 2]" 1
6 1 26 GLU H 1 26 GLU HB2 . . 2.800 2.807 2.774 2.881 0.081 10 0 "[ . 1 . 2]" 1
7 1 53 GLN H 1 53 GLN QB . . 2.800 2.246 2.137 2.358 . 0 0 "[ . 1 . 2]" 1
8 1 33 VAL H 1 33 VAL QG . . 2.800 2.047 1.965 2.142 . 0 0 "[ . 1 . 2]" 1
9 1 13 VAL H 1 13 VAL QG . . 2.800 1.922 1.883 2.009 . 0 0 "[ . 1 . 2]" 1
10 1 24 VAL H 1 24 VAL QG . . 2.800 2.038 1.932 2.237 . 0 0 "[ . 1 . 2]" 1
11 1 78 VAL H 1 78 VAL QG . . 2.800 2.087 1.974 2.265 . 0 0 "[ . 1 . 2]" 1
12 1 63 VAL H 1 63 VAL QG . . 2.800 2.259 1.911 2.504 . 0 0 "[ . 1 . 2]" 1
13 1 58 VAL H 1 58 VAL QG . . 2.800 2.268 1.994 2.594 . 0 0 "[ . 1 . 2]" 1
14 1 24 VAL QG 1 25 ASP H . . 2.800 2.533 2.414 2.834 0.034 4 0 "[ . 1 . 2]" 1
15 1 52 VAL QG 1 53 GLN H . . 3.500 2.842 2.429 3.503 0.003 15 0 "[ . 1 . 2]" 1
16 1 49 VAL H 1 49 VAL QG . . 2.800 2.367 2.116 2.715 . 0 0 "[ . 1 . 2]" 1
17 1 13 VAL QG 1 14 ASN HD22 . . 3.500 2.902 2.413 4.404 0.904 16 1 "[ . 1 .+ 2]" 1
18 1 72 ALA MB 1 73 ASN H . . 2.800 2.570 2.201 2.820 0.020 20 0 "[ . 1 . 2]" 1
19 1 72 ALA H 1 72 ALA MB . . 2.800 2.225 2.187 2.284 . 0 0 "[ . 1 . 2]" 1
20 1 48 ALA H 1 48 ALA MB . . 2.800 2.256 2.163 2.328 . 0 0 "[ . 1 . 2]" 1
21 1 3 ALA H 1 3 ALA MB . . 2.800 2.546 2.201 2.813 0.013 3 0 "[ . 1 . 2]" 1
22 1 23 ALA MB 1 24 VAL H . . 2.800 2.736 2.537 2.822 0.022 1 0 "[ . 1 . 2]" 1
23 1 23 ALA H 1 23 ALA MB . . 2.800 2.239 2.154 2.301 . 0 0 "[ . 1 . 2]" 1
24 1 65 ALA MB 1 66 CYS H . . 2.800 2.751 2.547 2.816 0.016 1 0 "[ . 1 . 2]" 1
25 1 65 ALA H 1 65 ALA MB . . 2.800 2.173 2.135 2.218 . 0 0 "[ . 1 . 2]" 1
26 1 56 ALA MB 1 57 THR H . . 2.800 2.780 2.675 2.824 0.024 19 0 "[ . 1 . 2]" 1
27 1 65 ALA MB 1 68 GLN H . . 4.500 4.514 4.431 4.675 0.175 4 0 "[ . 1 . 2]" 1
28 1 32 ALA H 1 32 ALA MB . . 2.800 2.197 2.123 2.229 . 0 0 "[ . 1 . 2]" 1
29 1 36 ALA H 1 36 ALA MB . . 2.800 2.243 2.178 2.317 . 0 0 "[ . 1 . 2]" 1
30 1 38 ALA H 1 38 ALA MB . . 2.800 2.192 2.154 2.220 . 0 0 "[ . 1 . 2]" 1
31 1 38 ALA MB 1 39 LEU H . . 2.800 2.392 2.142 2.603 . 0 0 "[ . 1 . 2]" 1
32 1 61 ALA MB 1 62 ILE H . . 2.800 2.346 2.215 2.511 . 0 0 "[ . 1 . 2]" 1
33 1 61 ALA H 1 61 ALA MB . . 2.800 2.331 2.176 2.379 . 0 0 "[ . 1 . 2]" 1
34 1 85 ILE H 1 85 ILE MG . . 3.500 3.551 3.492 3.582 0.082 14 0 "[ . 1 . 2]" 1
35 1 57 THR H 1 57 THR HB . . 2.800 2.191 2.101 2.479 . 0 0 "[ . 1 . 2]" 1
36 1 27 SER H 1 27 SER QB . . 2.800 2.391 2.209 2.478 . 0 0 "[ . 1 . 2]" 1
37 1 85 ILE HA 1 86 LYS H . . 3.500 3.522 3.491 3.538 0.038 15 0 "[ . 1 . 2]" 1
38 1 26 GLU H 1 26 GLU HA . . 2.800 2.828 2.805 2.848 0.048 13 0 "[ . 1 . 2]" 1
39 1 53 GLN H 1 53 GLN HA . . 2.800 2.841 2.816 2.885 0.085 18 0 "[ . 1 . 2]" 1
40 1 86 LYS HA 1 87 LYS H . . 3.500 3.504 3.485 3.514 0.014 7 0 "[ . 1 . 2]" 1
41 1 83 ASP HA 1 87 LYS H . . 2.800 2.610 2.469 2.772 . 0 0 "[ . 1 . 2]" 1
42 1 65 ALA H 1 65 ALA HA . . 2.800 2.821 2.812 2.838 0.038 4 0 "[ . 1 . 2]" 1
43 1 25 ASP HA 1 26 GLU H . . 2.800 2.382 2.312 2.443 . 0 0 "[ . 1 . 2]" 1
44 1 25 ASP H 1 25 ASP HA . . 2.800 2.809 2.297 2.849 0.049 13 0 "[ . 1 . 2]" 1
45 1 48 ALA HA 1 49 VAL H . . 2.800 2.135 2.063 2.221 . 0 0 "[ . 1 . 2]" 1
46 1 25 ASP H 1 25 ASP QB . . 2.800 2.282 2.097 2.846 0.046 4 0 "[ . 1 . 2]" 1
47 1 43 ASP H 1 43 ASP QB . . 2.800 2.687 2.212 2.861 0.061 14 0 "[ . 1 . 2]" 1
48 1 83 ASP H 1 83 ASP QB . . 2.800 2.216 2.173 2.490 . 0 0 "[ . 1 . 2]" 1
49 1 88 ASP H 1 88 ASP QB . . 2.800 2.378 2.176 2.815 0.015 5 0 "[ . 1 . 2]" 1
50 1 69 ASP HA 1 70 LYS H . . 2.800 2.455 2.231 2.724 . 0 0 "[ . 1 . 2]" 1
51 1 51 ASP HA 1 52 VAL H . . 2.800 2.599 2.448 2.742 . 0 0 "[ . 1 . 2]" 1
52 1 63 VAL HA 1 63 VAL QG . . 2.800 2.186 2.119 2.277 . 0 0 "[ . 1 . 2]" 1
53 1 33 VAL HA 1 36 ALA MB . . 3.500 3.045 2.462 3.409 . 0 0 "[ . 1 . 2]" 1
54 1 67 THR HA 1 67 THR MG . . 3.500 3.141 3.091 3.189 . 0 0 "[ . 1 . 2]" 1
55 1 22 LEU QD 1 67 THR HA . . 2.800 2.161 2.021 2.610 . 0 0 "[ . 1 . 2]" 1
56 1 78 VAL HA 1 78 VAL QG . . 2.800 2.308 2.124 2.522 . 0 0 "[ . 1 . 2]" 1
57 1 60 PRO HA 1 60 PRO HB3 . . 2.800 2.313 2.287 2.335 . 0 0 "[ . 1 . 2]" 1
58 1 62 ILE HA 1 65 ALA MB . . 2.800 2.130 2.007 2.235 . 0 0 "[ . 1 . 2]" 1
59 1 62 ILE HA 1 62 ILE MG . . 2.800 2.216 2.098 2.525 . 0 0 "[ . 1 . 2]" 1
60 1 85 ILE HA 1 85 ILE HB . . 2.800 2.891 2.872 2.914 0.114 3 0 "[ . 1 . 2]" 1
61 1 85 ILE HA 1 85 ILE MG . . 2.800 2.706 2.629 2.799 . 0 0 "[ . 1 . 2]" 1
62 1 35 PHE HA 1 38 ALA MB . . 2.800 2.757 2.469 2.889 0.089 2 0 "[ . 1 . 2]" 1
63 1 26 GLU HA 1 26 GLU HB2 . . 2.800 3.030 3.020 3.037 0.237 8 0 "[ . 1 . 2]" 1
64 1 64 GLN HA 1 64 GLN QB . . 2.800 2.309 2.285 2.365 . 0 0 "[ . 1 . 2]" 1
65 1 19 GLU HA 1 70 LYS QD . . 4.500 4.531 4.372 4.647 0.147 9 0 "[ . 1 . 2]" 1
66 1 53 GLN HA 1 53 GLN HG2 . . 2.800 3.089 2.409 3.768 0.968 16 6 "[* * . * 1 .+ *-2]" 1
67 1 53 GLN HA 1 53 GLN QB . . 2.800 2.354 2.299 2.412 . 0 0 "[ . 1 . 2]" 1
68 1 46 GLU HA 1 46 GLU QB . . 2.800 2.321 2.164 2.387 . 0 0 "[ . 1 . 2]" 1
69 1 42 LYS HA 1 42 LYS QB . . 2.800 2.169 2.131 2.208 . 0 0 "[ . 1 . 2]" 1
70 1 87 LYS HA 1 87 LYS HB2 . . 2.800 3.042 3.024 3.060 0.260 2 0 "[ . 1 . 2]" 1
71 1 39 LEU HA 1 39 LEU HB2 . . 2.800 3.038 3.024 3.050 0.250 2 0 "[ . 1 . 2]" 1
72 1 39 LEU HA 1 39 LEU HG . . 4.500 3.957 3.889 4.038 . 0 0 "[ . 1 . 2]" 1
73 1 87 LYS HA 1 87 LYS HG2 . . 2.800 2.849 2.424 2.970 0.170 2 0 "[ . 1 . 2]" 1
74 1 76 ASP HA 1 76 ASP QB . . 2.800 2.368 2.314 2.403 . 0 0 "[ . 1 . 2]" 1
75 1 68 GLN HA 1 68 GLN HG2 . . 3.500 3.197 2.566 3.671 0.171 3 0 "[ . 1 . 2]" 1
76 1 68 GLN HA 1 68 GLN HB2 . . 2.800 2.982 2.419 3.049 0.249 6 0 "[ . 1 . 2]" 1
77 1 22 LEU HA 1 22 LEU QD . . 2.800 2.241 2.114 2.635 . 0 0 "[ . 1 . 2]" 1
78 1 83 ASP HA 1 83 ASP QB . . 2.800 2.351 2.331 2.407 . 0 0 "[ . 1 . 2]" 1
79 1 10 LYS HA 1 10 LYS HB2 . . 2.800 2.749 2.303 3.070 0.270 14 0 "[ . 1 . 2]" 1
80 1 10 LYS HA 1 10 LYS QG . . 3.500 3.175 2.224 3.527 0.027 10 0 "[ . 1 . 2]" 1
81 1 25 ASP HA 1 25 ASP QB . . 2.800 2.436 2.364 2.526 . 0 0 "[ . 1 . 2]" 1
82 1 71 GLN HA 1 71 GLN QG . . 2.800 2.458 2.362 2.841 0.041 15 0 "[ . 1 . 2]" 1
83 1 26 GLU HA 1 26 GLU QB . . 2.800 2.280 2.264 2.294 . 0 0 "[ . 1 . 2]" 1
84 1 33 VAL HA 1 33 VAL QG . . 2.800 2.281 2.174 2.367 . 0 0 "[ . 1 . 2]" 1
85 1 39 LEU HA 1 39 LEU QD . . 3.500 2.347 2.238 2.456 . 0 0 "[ . 1 . 2]" 1
86 1 31 THR HA 1 31 THR MG . . 2.800 2.491 2.393 2.559 . 0 0 "[ . 1 . 2]" 1
87 1 60 PRO HA 1 63 VAL QG . . 3.500 2.698 2.033 3.286 . 0 0 "[ . 1 . 2]" 1
88 1 17 THR HA 1 17 THR MG . . 2.800 2.317 2.203 2.381 . 0 0 "[ . 1 . 2]" 1
89 1 17 THR MG 1 73 ASN HA . . 3.500 2.923 2.200 3.519 0.019 14 0 "[ . 1 . 2]" 1
90 1 59 THR HA 1 59 THR MG . . 2.800 2.472 2.402 2.536 . 0 0 "[ . 1 . 2]" 1
91 1 55 ILE HA 1 58 VAL QG . . 3.500 3.063 2.032 3.554 0.054 11 0 "[ . 1 . 2]" 1
92 1 57 THR HA 1 57 THR MG . . 2.800 2.539 2.307 2.686 . 0 0 "[ . 1 . 2]" 1
93 1 20 ASP HA 1 23 ALA MB . . 2.800 2.446 2.112 2.845 0.045 7 0 "[ . 1 . 2]" 1
94 1 53 GLN HA 1 56 ALA MB . . 4.500 3.030 2.225 3.899 . 0 0 "[ . 1 . 2]" 1
95 1 58 VAL HA 1 61 ALA MB . . 2.800 2.551 2.387 2.790 . 0 0 "[ . 1 . 2]" 1
96 1 34 GLY HA2 1 55 ILE MD . . 2.800 2.816 2.561 3.106 0.306 20 0 "[ . 1 . 2]" 1
97 1 34 GLY QA 1 55 ILE MD . . 3.500 2.703 2.443 2.887 . 0 0 "[ . 1 . 2]" 1
98 1 13 VAL HA 1 13 VAL QG . . 2.800 2.321 2.258 2.406 . 0 0 "[ . 1 . 2]" 1
99 1 33 VAL QG 1 55 ILE QG . . 3.500 2.446 2.159 2.663 . 0 0 "[ . 1 . 2]" 1
100 1 52 VAL HA 1 52 VAL QG . . 2.800 2.426 2.172 2.544 . 0 0 "[ . 1 . 2]" 1
101 1 62 ILE QG 1 62 ILE MG . . 2.800 2.372 2.087 2.584 . 0 0 "[ . 1 . 2]" 1
102 1 30 PRO HB3 1 55 ILE MG . . 3.500 2.085 2.020 2.180 . 0 0 "[ . 1 . 2]" 1
103 1 62 ILE MD 1 78 VAL HA . . 3.500 2.728 2.198 3.494 . 0 0 "[ . 1 . 2]" 1
104 1 85 ILE HB 1 85 ILE MD . . 3.500 2.379 2.256 2.532 . 0 0 "[ . 1 . 2]" 1
105 1 22 LEU QD 1 67 THR MG . . 3.500 3.525 3.466 3.565 0.065 5 0 "[ . 1 . 2]" 1
106 1 36 ALA MB 1 78 VAL QG . . 2.800 2.574 2.126 2.815 0.015 16 0 "[ . 1 . 2]" 1
107 1 13 VAL QG 1 36 ALA MB . . 2.800 2.356 2.155 2.534 . 0 0 "[ . 1 . 2]" 1
108 1 62 ILE MG 1 78 VAL QG . . 2.800 2.333 2.077 2.842 0.042 7 0 "[ . 1 . 2]" 1
109 1 62 ILE MD 1 78 VAL QG . . 3.500 2.458 1.994 3.180 . 0 0 "[ . 1 . 2]" 1
110 1 33 VAL QG 1 78 VAL QG . . 2.800 2.310 1.982 2.796 . 0 0 "[ . 1 . 2]" 1
111 1 50 LEU QD 1 55 ILE MD . . 2.800 2.406 2.035 2.807 0.007 16 0 "[ . 1 . 2]" 1
112 1 38 ALA MB 1 39 LEU HG . . 4.500 4.536 4.471 4.579 0.079 3 0 "[ . 1 . 2]" 1
113 1 33 VAL QG 1 58 VAL HB . . 3.500 3.348 2.737 3.643 0.143 7 0 "[ . 1 . 2]" 1
114 1 59 THR HA 1 62 ILE MD . . 3.500 3.277 2.226 3.560 0.060 6 0 "[ . 1 . 2]" 1
115 1 30 PRO HG3 1 59 THR HA . . 3.500 3.711 3.662 3.745 0.245 2 0 "[ . 1 . 2]" 1
116 1 59 THR HA 1 62 ILE H . . 4.500 4.031 3.813 4.250 . 0 0 "[ . 1 . 2]" 1
117 1 57 THR HB 1 58 VAL H . . 2.800 2.666 2.423 2.821 0.021 8 0 "[ . 1 . 2]" 1
118 1 64 GLN HA 1 67 THR HB . . 3.500 3.222 2.859 3.501 0.001 7 0 "[ . 1 . 2]" 1
119 1 67 THR HB 1 68 GLN H . . 3.500 3.568 3.552 3.589 0.089 5 0 "[ . 1 . 2]" 1
120 1 67 THR H 1 67 THR HB . . 2.800 2.292 2.205 2.408 . 0 0 "[ . 1 . 2]" 1
121 1 57 THR HA 1 57 THR HB . . 2.800 2.976 2.952 3.000 0.200 4 0 "[ . 1 . 2]" 1
122 1 63 VAL H 1 63 VAL HA . . 2.800 2.852 2.834 2.870 0.070 10 0 "[ . 1 . 2]" 1
123 1 33 VAL HA 1 78 VAL QG . . 3.500 2.813 2.418 3.336 . 0 0 "[ . 1 . 2]" 1
124 1 67 THR HA 1 70 LYS HE3 . . 2.800 2.432 2.058 2.680 . 0 0 "[ . 1 . 2]" 1
125 1 67 THR HA 1 68 GLN H . . 4.500 3.526 3.501 3.562 . 0 0 "[ . 1 . 2]" 1
126 1 67 THR H 1 67 THR HA . . 2.800 2.926 2.907 2.938 0.138 7 0 "[ . 1 . 2]" 1
127 1 52 VAL HA 1 55 ILE QG . . 4.500 4.194 3.867 4.521 0.021 1 0 "[ . 1 . 2]" 1
128 1 52 VAL HA 1 55 ILE HB . . 3.500 2.292 2.031 2.746 . 0 0 "[ . 1 . 2]" 1
129 1 51 ASP H 1 52 VAL HA . . 4.500 4.582 4.247 4.664 0.164 19 0 "[ . 1 . 2]" 1
130 1 55 ILE MG 1 59 THR HB . . 4.500 4.382 4.157 4.503 0.003 12 0 "[ . 1 . 2]" 1
131 1 59 THR HB 1 60 PRO QD . . 2.800 2.107 2.070 2.211 . 0 0 "[ . 1 . 2]" 1
132 1 59 THR H 1 59 THR HB . . 2.800 2.507 2.460 2.549 . 0 0 "[ . 1 . 2]" 1
133 1 60 PRO HA 1 63 VAL H . . 4.500 3.827 3.562 4.061 . 0 0 "[ . 1 . 2]" 1
134 1 45 PRO HA 1 48 ALA MB . . 3.500 2.107 1.929 2.350 . 0 0 "[ . 1 . 2]" 1
135 1 57 THR HA 1 58 VAL H . . 4.500 3.602 3.557 3.662 . 0 0 "[ . 1 . 2]" 1
136 1 55 ILE HA 1 55 ILE QG . . 3.500 2.247 2.168 2.361 . 0 0 "[ . 1 . 2]" 1
137 1 55 ILE HA 1 55 ILE MD . . 4.500 3.694 3.385 3.856 . 0 0 "[ . 1 . 2]" 1
138 1 62 ILE HA 1 62 ILE QG . . 3.500 3.044 2.278 3.512 0.012 1 0 "[ . 1 . 2]" 1
139 1 15 SER H 1 15 SER QB . . 2.800 2.639 2.303 2.851 0.051 20 0 "[ . 1 . 2]" 1
140 1 12 PRO QB 1 15 SER QB . . 4.500 4.185 2.218 4.556 0.056 13 0 "[ . 1 . 2]" 1
141 1 58 VAL HA 1 85 ILE MD . . 3.500 2.512 2.101 2.814 . 0 0 "[ . 1 . 2]" 1
142 1 58 VAL HA 1 61 ALA H . . 4.500 3.502 3.334 3.674 . 0 0 "[ . 1 . 2]" 1
143 1 58 VAL H 1 58 VAL HA . . 2.800 2.900 2.878 2.930 0.130 2 0 "[ . 1 . 2]" 1
144 1 12 PRO HA 1 13 VAL QG . . 4.500 3.365 3.253 3.450 . 0 0 "[ . 1 . 2]" 1
145 1 12 PRO HA 1 13 VAL H . . 2.800 2.282 2.180 2.439 . 0 0 "[ . 1 . 2]" 1
146 1 27 SER QB 1 28 PHE HB3 . . 4.500 4.919 4.764 5.110 0.610 10 2 "[ . -+ . 2]" 1
147 1 27 SER HA 1 27 SER QB . . 2.800 2.395 2.366 2.434 . 0 0 "[ . 1 . 2]" 1
148 1 24 VAL HA 1 25 ASP H . . 2.800 2.215 2.148 3.014 0.214 4 0 "[ . 1 . 2]" 1
149 1 27 SER QB 1 28 PHE H . . 4.500 2.902 2.758 3.031 . 0 0 "[ . 1 . 2]" 1
150 1 24 VAL H 1 24 VAL HA . . 2.800 2.867 2.802 2.898 0.098 3 0 "[ . 1 . 2]" 1
151 1 85 ILE HA 1 85 ILE MD . . 3.500 3.602 3.569 3.616 0.116 11 0 "[ . 1 . 2]" 1
152 1 85 ILE HA 1 86 LYS QG . . 4.500 4.659 4.623 4.683 0.183 9 0 "[ . 1 . 2]" 1
153 1 85 ILE H 1 85 ILE HA . . 2.800 2.852 2.826 2.902 0.102 20 0 "[ . 1 . 2]" 1
154 1 24 VAL QG 1 29 GLN HA . . 3.500 2.368 2.112 2.862 . 0 0 "[ . 1 . 2]" 1
155 1 29 GLN HA 1 29 GLN QG . . 3.500 2.300 2.183 2.611 . 0 0 "[ . 1 . 2]" 1
156 1 29 GLN HA 1 29 GLN QB . . 2.800 2.507 2.415 2.545 . 0 0 "[ . 1 . 2]" 1
157 1 29 GLN HA 1 29 GLN HG2 . . 3.500 2.473 2.206 2.665 . 0 0 "[ . 1 . 2]" 1
158 1 29 GLN HA 1 31 THR H . . 4.500 3.950 3.826 4.069 . 0 0 "[ . 1 . 2]" 1
159 1 49 VAL HA 1 50 LEU H . . 3.500 2.773 2.206 3.382 . 0 0 "[ . 1 . 2]" 1
160 1 27 SER HA 1 28 PHE H . . 3.500 3.508 3.478 3.531 0.031 1 0 "[ . 1 . 2]" 1
161 1 26 GLU HA 1 27 SER HA . . 5.500 4.930 4.842 4.967 . 0 0 "[ . 1 . 2]" 1
162 1 22 LEU QD 1 70 LYS HA . . 4.500 3.864 3.394 4.067 . 0 0 "[ . 1 . 2]" 1
163 1 70 LYS HA 1 70 LYS QG . . 3.500 2.439 2.334 2.518 . 0 0 "[ . 1 . 2]" 1
164 1 19 GLU HB2 1 70 LYS HA . . 4.500 3.764 3.506 4.158 . 0 0 "[ . 1 . 2]" 1
165 1 18 CYS QB 1 70 LYS HA . . 3.500 2.170 2.085 2.265 . 0 0 "[ . 1 . 2]" 1
166 1 18 CYS HB2 1 70 LYS HA . . 2.800 2.855 2.371 3.100 0.300 20 0 "[ . 1 . 2]" 1
167 1 70 LYS HA 1 71 GLN H . . 4.500 3.529 3.504 3.568 . 0 0 "[ . 1 . 2]" 1
168 1 70 LYS H 1 70 LYS HA . . 2.800 2.832 2.808 2.860 0.060 9 0 "[ . 1 . 2]" 1
169 1 17 THR HA 1 73 ASN HA . . 4.500 2.587 2.092 4.015 . 0 0 "[ . 1 . 2]" 1
170 1 17 THR HA 1 74 PHE H . . 3.500 3.065 2.597 3.686 0.186 5 0 "[ . 1 . 2]" 1
171 1 17 THR HA 1 18 CYS H . . 2.800 2.324 2.174 2.479 . 0 0 "[ . 1 . 2]" 1
172 1 82 TRP HA 1 86 LYS QG . . 4.500 3.540 3.266 3.880 . 0 0 "[ . 1 . 2]" 1
173 1 82 TRP HA 1 82 TRP HB3 . . 2.800 3.036 3.028 3.041 0.241 12 0 "[ . 1 . 2]" 1
174 1 82 TRP HA 1 83 ASP H . . 3.500 3.557 3.546 3.566 0.066 7 0 "[ . 1 . 2]" 1
175 1 82 TRP H 1 82 TRP HA . . 2.800 2.862 2.849 2.894 0.094 19 0 "[ . 1 . 2]" 1
176 1 74 PHE HA 1 74 PHE QB . . 2.800 2.297 2.162 2.438 . 0 0 "[ . 1 . 2]" 1
177 1 26 GLU HA 1 26 GLU QG . . 2.800 2.631 2.581 2.689 . 0 0 "[ . 1 . 2]" 1
178 1 25 ASP HA 1 26 GLU HA . . 4.500 4.389 4.305 4.466 . 0 0 "[ . 1 . 2]" 1
179 1 26 GLU HA 1 29 GLN H . . 3.500 3.334 3.249 3.446 . 0 0 "[ . 1 . 2]" 1
180 1 26 GLU HA 1 27 SER H . . 3.500 3.498 3.484 3.532 0.032 10 0 "[ . 1 . 2]" 1
181 1 18 CYS HA 1 70 LYS HA . . 4.500 4.492 4.349 4.595 0.095 1 0 "[ . 1 . 2]" 1
182 1 18 CYS HA 1 66 CYS HB2 . . 4.500 4.625 4.237 4.902 0.402 1 0 "[ . 1 . 2]" 1
183 1 18 CYS HA 1 21 PHE QB . . 4.500 2.587 1.949 3.776 . 0 0 "[ . 1 . 2]" 1
184 1 36 ALA MB 1 75 LYS HA . . 4.500 3.965 3.556 4.517 0.017 20 0 "[ . 1 . 2]" 1
185 1 75 LYS HA 1 78 VAL QG . . 3.500 2.433 2.033 3.022 . 0 0 "[ . 1 . 2]" 1
186 1 75 LYS HA 1 78 VAL H . . 3.500 3.143 2.959 3.506 0.006 18 0 "[ . 1 . 2]" 1
187 1 75 LYS HA 1 76 ASP H . . 4.500 3.536 3.451 3.575 . 0 0 "[ . 1 . 2]" 1
188 1 19 GLU HA 1 19 GLU HG3 . . 3.500 2.481 2.335 3.024 . 0 0 "[ . 1 . 2]" 1
189 1 79 LYS HA 1 82 TRP HB3 . . 3.500 2.767 2.562 2.969 . 0 0 "[ . 1 . 2]" 1
190 1 79 LYS HA 1 79 LYS HG2 . . 2.800 2.590 2.460 2.704 . 0 0 "[ . 1 . 2]" 1
191 1 19 GLU HA 1 22 LEU QD . . 3.500 2.948 2.297 3.222 . 0 0 "[ . 1 . 2]" 1
192 1 79 LYS H 1 79 LYS HA . . 2.800 2.867 2.847 2.896 0.096 5 0 "[ . 1 . 2]" 1
193 1 64 GLN HA 1 67 THR MG . . 3.500 2.859 2.669 3.177 . 0 0 "[ . 1 . 2]" 1
194 1 63 VAL QG 1 64 GLN HA . . 4.500 3.449 3.249 3.708 . 0 0 "[ . 1 . 2]" 1
195 1 64 GLN H 1 64 GLN HA . . 2.800 2.912 2.877 2.939 0.139 18 0 "[ . 1 . 2]" 1
196 1 64 GLN HA 1 65 ALA H . . 4.500 3.546 3.532 3.558 . 0 0 "[ . 1 . 2]" 1
197 1 53 GLN HA 1 54 GLY H . . 3.500 3.552 3.526 3.574 0.074 20 0 "[ . 1 . 2]" 1
198 1 84 LYS HA 1 85 ILE H . . 4.500 3.501 3.449 3.540 . 0 0 "[ . 1 . 2]" 1
199 1 84 LYS HA 1 84 LYS QG . . 3.500 3.304 2.340 3.544 0.044 3 0 "[ . 1 . 2]" 1
200 1 37 GLU HA 1 78 VAL QG . . 4.500 4.477 3.988 4.600 0.100 5 0 "[ . 1 . 2]" 1
201 1 37 GLU HA 1 37 GLU QG . . 3.500 2.583 2.231 3.166 . 0 0 "[ . 1 . 2]" 1
202 1 37 GLU HA 1 37 GLU QB . . 2.800 2.414 2.325 2.542 . 0 0 "[ . 1 . 2]" 1
203 1 37 GLU HA 1 40 ASN H . . 4.500 3.522 3.193 3.716 . 0 0 "[ . 1 . 2]" 1
204 1 37 GLU HA 1 38 ALA H . . 4.500 3.558 3.469 3.629 . 0 0 "[ . 1 . 2]" 1
205 1 46 GLU HA 1 46 GLU QG . . 3.500 2.775 2.384 3.386 . 0 0 "[ . 1 . 2]" 1
206 1 46 GLU HA 1 47 ASP H . . 3.500 3.489 3.391 3.536 0.036 3 0 "[ . 1 . 2]" 1
207 1 46 GLU H 1 46 GLU HA . . 2.800 2.832 2.791 2.893 0.093 11 0 "[ . 1 . 2]" 1
208 1 42 LYS H 1 42 LYS HA . . 2.800 2.827 2.703 2.892 0.092 2 0 "[ . 1 . 2]" 1
209 1 42 LYS HA 1 43 ASP H . . 3.500 2.784 1.948 3.337 . 0 0 "[ . 1 . 2]" 1
210 1 81 GLU H 1 81 GLU HA . . 2.800 2.871 2.843 2.892 0.092 4 0 "[ . 1 . 2]" 1
211 1 81 GLU HA 1 84 LYS H . . 3.500 3.081 2.961 3.196 . 0 0 "[ . 1 . 2]" 1
212 1 81 GLU HA 1 81 GLU HG2 . . 3.500 3.410 3.237 3.643 0.143 1 0 "[ . 1 . 2]" 1
213 1 77 LYS HA 1 77 LYS HG3 . . 2.800 2.595 2.295 3.668 0.868 7 2 "[ . + - . 2]" 1
214 1 77 LYS HA 1 79 LYS HB2 . . 5.500 5.253 4.929 5.772 0.272 5 0 "[ . 1 . 2]" 1
215 1 77 LYS HA 1 77 LYS QE . . 3.500 3.207 1.981 3.742 0.242 18 0 "[ . 1 . 2]" 1
216 1 16 TRP HA 1 17 THR MG . . 3.500 3.346 3.129 3.600 0.100 7 0 "[ . 1 . 2]" 1
217 1 16 TRP HA 1 17 THR H . . 2.800 2.382 2.126 2.667 . 0 0 "[ . 1 . 2]" 1
218 1 20 ASP HA 1 21 PHE H . . 4.500 3.533 3.330 3.626 . 0 0 "[ . 1 . 2]" 1
219 1 20 ASP H 1 20 ASP HA . . 2.800 2.866 2.777 2.936 0.136 7 0 "[ . 1 . 2]" 1
220 1 38 ALA MB 1 39 LEU HA . . 4.500 3.869 3.790 3.980 . 0 0 "[ . 1 . 2]" 1
221 1 39 LEU HA 1 40 ASN H . . 4.500 3.529 3.430 3.586 . 0 0 "[ . 1 . 2]" 1
222 1 87 LYS HA 1 87 LYS HD2 . . 2.800 2.839 2.224 3.213 0.413 4 0 "[ . 1 . 2]" 1
223 1 86 LYS HA 1 87 LYS HA . . 5.500 4.737 4.705 4.765 . 0 0 "[ . 1 . 2]" 1
224 1 76 ASP H 1 76 ASP HA . . 2.800 2.844 2.816 2.890 0.090 12 0 "[ . 1 . 2]" 1
225 1 76 ASP HA 1 79 LYS HB2 . . 2.800 2.584 2.260 2.832 0.032 10 0 "[ . 1 . 2]" 1
226 1 76 ASP HA 1 79 LYS HD3 . . 3.500 2.868 2.250 4.488 0.988 5 1 "[ + 1 . 2]" 1
227 1 68 GLN H 1 68 GLN HA . . 2.800 2.838 2.812 2.898 0.098 4 0 "[ . 1 . 2]" 1
228 1 4 GLN HA 1 4 GLN QG . . 3.500 3.094 2.323 3.527 0.027 13 0 "[ . 1 . 2]" 1
229 1 22 LEU HA 1 22 LEU HG . . 3.500 3.272 2.477 3.640 0.140 20 0 "[ . 1 . 2]" 1
230 1 22 LEU HA 1 23 ALA H . . 4.500 3.442 3.307 3.540 . 0 0 "[ . 1 . 2]" 1
231 1 83 ASP HA 1 86 LYS QG . . 4.500 4.486 4.161 4.527 0.027 15 0 "[ . 1 . 2]" 1
232 1 83 ASP HA 1 84 LYS H . . 3.500 3.565 3.541 3.581 0.081 2 0 "[ . 1 . 2]" 1
233 1 32 ALA HA 1 35 PHE QB . . 4.500 2.940 2.562 3.564 . 0 0 "[ . 1 . 2]" 1
234 1 32 ALA HA 1 35 PHE HB2 . . 4.500 2.992 2.585 3.936 . 0 0 "[ . 1 . 2]" 1
235 1 31 THR MG 1 32 ALA HA . . 4.500 3.912 3.631 4.101 . 0 0 "[ . 1 . 2]" 1
236 1 32 ALA H 1 32 ALA HA . . 2.800 2.848 2.802 2.872 0.072 2 0 "[ . 1 . 2]" 1
237 1 17 THR MG 1 71 GLN HA . . 3.500 3.098 2.716 3.512 0.012 7 0 "[ . 1 . 2]" 1
238 1 17 THR HB 1 71 GLN HA . . 3.500 2.927 2.445 3.460 . 0 0 "[ . 1 . 2]" 1
239 1 71 GLN H 1 71 GLN HA . . 2.800 2.904 2.884 2.924 0.124 7 0 "[ . 1 . 2]" 1
240 1 13 VAL QG 1 36 ALA HA . . 2.800 2.757 2.471 2.892 0.092 7 0 "[ . 1 . 2]" 1
241 1 65 ALA HA 1 66 CYS H . . 4.500 3.555 3.538 3.592 . 0 0 "[ . 1 . 2]" 1
242 1 65 ALA HA 1 68 GLN H . . 3.500 3.166 3.015 3.468 . 0 0 "[ . 1 . 2]" 1
243 1 65 ALA HA 1 68 GLN HG2 . . 3.500 2.626 2.064 3.803 0.303 9 0 "[ . 1 . 2]" 1
244 1 65 ALA HA 1 68 GLN QB . . 4.000 2.606 2.225 4.078 0.078 4 0 "[ . 1 . 2]" 1
245 1 38 ALA HA 1 41 ASN QD . . 4.500 3.116 2.206 4.246 . 0 0 "[ . 1 . 2]" 1
246 1 61 ALA HA 1 62 ILE H . . 3.500 3.612 3.582 3.630 0.130 12 0 "[ . 1 . 2]" 1
247 1 61 ALA HA 1 64 GLN H . . 5.500 4.066 3.833 4.351 . 0 0 "[ . 1 . 2]" 1
248 1 61 ALA H 1 61 ALA HA . . 2.800 2.931 2.867 2.954 0.154 5 0 "[ . 1 . 2]" 1
249 1 11 LYS HA 1 12 PRO QD . . 3.500 2.521 2.200 3.080 . 0 0 "[ . 1 . 2]" 1
250 1 44 LYS HA 1 44 LYS HG2 . . 2.800 2.516 2.253 3.021 0.221 7 0 "[ . 1 . 2]" 1
251 1 48 ALA HA 1 49 VAL QG . . 3.500 3.441 2.978 3.552 0.052 8 0 "[ . 1 . 2]" 1
252 1 48 ALA H 1 48 ALA HA . . 2.800 2.899 2.807 2.943 0.143 12 0 "[ . 1 . 2]" 1
253 1 50 LEU HA 1 51 ASP H . . 2.800 2.212 2.133 2.341 . 0 0 "[ . 1 . 2]" 1
254 1 23 ALA H 1 23 ALA HA . . 2.800 2.888 2.849 2.917 0.117 4 0 "[ . 1 . 2]" 1
255 1 23 ALA HA 1 24 VAL H . . 3.500 3.508 3.462 3.538 0.038 15 0 "[ . 1 . 2]" 1
256 1 7 ALA HA 1 8 ASP H . . 3.500 3.175 2.215 3.531 0.031 4 0 "[ . 1 . 2]" 1
257 1 10 LYS QD 1 12 PRO QD . . 4.500 4.281 2.527 4.655 0.155 5 0 "[ . 1 . 2]" 1
258 1 12 PRO QD 1 12 PRO HG2 . . 2.800 2.280 2.228 2.310 . 0 0 "[ . 1 . 2]" 1
259 1 69 ASP HA 1 71 GLN H . . 3.500 3.417 3.299 3.523 0.023 4 0 "[ . 1 . 2]" 1
260 1 69 ASP HA 1 69 ASP HB2 . . 2.800 2.642 2.467 3.043 0.243 16 0 "[ . 1 . 2]" 1
261 1 69 ASP HA 1 69 ASP QB . . 2.800 2.394 2.364 2.428 . 0 0 "[ . 1 . 2]" 1
262 1 69 ASP HA 1 70 LYS QB . . 5.500 4.342 4.094 4.544 . 0 0 "[ . 1 . 2]" 1
263 1 66 CYS HA 1 77 LYS QD . . 4.500 3.672 3.251 4.427 . 0 0 "[ . 1 . 2]" 1
264 1 60 PRO HB3 1 60 PRO QD . . 2.800 2.671 2.623 2.713 . 0 0 "[ . 1 . 2]" 1
265 1 60 PRO HA 1 60 PRO QD . . 3.500 3.303 3.256 3.334 . 0 0 "[ . 1 . 2]" 1
266 1 60 PRO QD 1 61 ALA H . . 3.500 3.095 2.933 3.206 . 0 0 "[ . 1 . 2]" 1
267 1 29 GLN H 1 30 PRO HD2 . . 2.800 2.968 2.788 3.206 0.406 20 0 "[ . 1 . 2]" 1
268 1 59 THR H 1 60 PRO QD . . 3.500 2.648 2.577 2.738 . 0 0 "[ . 1 . 2]" 1
269 1 60 PRO QB 1 60 PRO QD . . 2.800 2.596 2.556 2.632 . 0 0 "[ . 1 . 2]" 1
270 1 59 THR MG 1 60 PRO QD . . 3.500 2.610 2.512 2.720 . 0 0 "[ . 1 . 2]" 1
271 1 44 LYS HG2 1 45 PRO HD3 . . 4.500 4.119 3.362 5.161 0.661 7 2 "[ . + 1 - . 2]" 1
272 1 45 PRO HD3 1 45 PRO HG2 . . 2.800 2.967 2.909 2.998 0.198 18 0 "[ . 1 . 2]" 1
273 1 44 LYS HA 1 45 PRO HD3 . . 2.800 2.318 2.236 2.390 . 0 0 "[ . 1 . 2]" 1
274 1 54 GLY H 1 54 GLY HA2 . . 2.800 2.898 2.854 2.957 0.157 19 0 "[ . 1 . 2]" 1
275 1 34 GLY H 1 34 GLY QA . . 2.800 2.187 2.173 2.198 . 0 0 "[ . 1 . 2]" 1
276 1 54 GLY H 1 54 GLY QA . . 2.800 2.230 2.190 2.264 . 0 0 "[ . 1 . 2]" 1
277 1 54 GLY QA 1 55 ILE H . . 3.500 2.625 2.568 2.858 . 0 0 "[ . 1 . 2]" 1
278 1 34 GLY H 1 34 GLY HA2 . . 2.800 2.778 2.729 2.829 0.029 20 0 "[ . 1 . 2]" 1
279 1 39 LEU H 1 39 LEU QB . . 2.800 2.370 2.293 2.501 . 0 0 "[ . 1 . 2]" 1
280 1 50 LEU HB2 1 50 LEU HG . . 2.800 2.355 2.299 2.409 . 0 0 "[ . 1 . 2]" 1
281 1 39 LEU HB2 1 39 LEU HG . . 2.800 2.274 2.220 2.336 . 0 0 "[ . 1 . 2]" 1
282 1 39 LEU H 1 39 LEU HB2 . . 2.800 2.405 2.322 2.553 . 0 0 "[ . 1 . 2]" 1
283 1 22 LEU QD 1 70 LYS HE3 . . 2.800 3.020 2.162 3.368 0.568 7 3 "[ . + 1 . *-]" 1
284 1 84 LYS QE 1 85 ILE HA . . 3.500 3.320 2.781 3.627 0.127 3 0 "[ . 1 . 2]" 1
285 1 14 ASN QD 1 75 LYS QE . . 3.500 3.188 2.549 3.622 0.122 12 0 "[ . 1 . 2]" 1
286 1 86 LYS HE2 1 86 LYS QG . . 3.500 2.487 2.408 2.524 . 0 0 "[ . 1 . 2]" 1
287 1 24 VAL QG 1 28 PHE QB . . 2.800 2.069 1.972 2.262 . 0 0 "[ . 1 . 2]" 1
288 1 28 PHE H 1 28 PHE QB . . 3.500 2.747 2.677 2.833 . 0 0 "[ . 1 . 2]" 1
289 1 25 ASP QB 1 26 GLU H . . 3.500 3.033 2.483 3.385 . 0 0 "[ . 1 . 2]" 1
290 1 25 ASP QB 1 28 PHE H . . 3.500 3.012 2.834 3.254 . 0 0 "[ . 1 . 2]" 1
291 1 25 ASP QB 1 27 SER QB . . 3.500 2.770 2.507 3.055 . 0 0 "[ . 1 . 2]" 1
292 1 24 VAL QG 1 25 ASP QB . . 3.500 3.538 3.508 3.653 0.153 4 0 "[ . 1 . 2]" 1
293 1 35 PHE HB2 1 36 ALA H . . 3.500 3.155 2.685 3.666 0.166 1 0 "[ . 1 . 2]" 1
294 1 35 PHE H 1 35 PHE HB2 . . 2.800 2.281 2.138 2.590 . 0 0 "[ . 1 . 2]" 1
295 1 35 PHE QB 1 36 ALA H . . 3.500 2.892 2.483 3.296 . 0 0 "[ . 1 . 2]" 1
296 1 35 PHE H 1 35 PHE QB . . 2.800 2.252 2.084 2.533 . 0 0 "[ . 1 . 2]" 1
297 1 47 ASP H 1 47 ASP HB2 . . 3.500 3.085 2.589 3.843 0.343 3 0 "[ . 1 . 2]" 1
298 1 47 ASP H 1 47 ASP QB . . 2.800 2.502 2.078 2.877 0.077 3 0 "[ . 1 . 2]" 1
299 1 73 ASN HB2 1 73 ASN HD21 . . 3.500 3.666 3.500 4.107 0.607 16 3 "[- . *1 .+ 2]" 1
300 1 73 ASN H 1 73 ASN HB2 . . 3.500 2.629 2.354 3.647 0.147 3 0 "[ . 1 . 2]" 1
301 1 51 ASP H 1 51 ASP HB2 . . 3.500 2.662 2.292 3.578 0.078 2 0 "[ . 1 . 2]" 1
302 1 20 ASP QB 1 21 PHE H . . 3.500 3.067 2.668 3.479 . 0 0 "[ . 1 . 2]" 1
303 1 20 ASP H 1 20 ASP QB . . 2.800 2.279 2.133 2.616 . 0 0 "[ . 1 . 2]" 1
304 1 41 ASN HA 1 41 ASN QB . . 2.800 2.335 2.131 2.482 . 0 0 "[ . 1 . 2]" 1
305 1 43 ASP HA 1 43 ASP QB . . 2.800 2.389 2.155 2.534 . 0 0 "[ . 1 . 2]" 1
306 1 21 PHE QB 1 70 LYS HA . . 5.500 5.383 5.196 5.582 0.082 7 0 "[ . 1 . 2]" 1
307 1 21 PHE H 1 21 PHE QB . . 2.800 2.265 2.146 2.341 . 0 0 "[ . 1 . 2]" 1
308 1 76 ASP H 1 76 ASP HB2 . . 3.500 2.456 2.369 2.636 . 0 0 "[ . 1 . 2]" 1
309 1 88 ASP HA 1 88 ASP QB . . 2.800 2.362 2.295 2.400 . 0 0 "[ . 1 . 2]" 1
310 1 85 ILE HA 1 88 ASP QB . . 4.500 4.417 3.770 4.569 0.069 11 0 "[ . 1 . 2]" 1
311 1 88 ASP QB 1 89 MET H . . 4.500 3.157 2.298 3.994 . 0 0 "[ . 1 . 2]" 1
312 1 76 ASP H 1 76 ASP QB . . 2.800 2.219 2.161 2.407 . 0 0 "[ . 1 . 2]" 1
313 1 76 ASP QB 1 77 LYS H . . 3.500 2.771 2.633 2.970 . 0 0 "[ . 1 . 2]" 1
314 1 85 ILE H 1 85 ILE HB . . 2.800 2.118 2.092 2.200 . 0 0 "[ . 1 . 2]" 1
315 1 85 ILE HB 1 86 LYS H . . 3.500 2.899 2.727 3.071 . 0 0 "[ . 1 . 2]" 1
316 1 85 ILE HB 1 85 ILE QG . . 2.800 2.423 2.328 2.548 . 0 0 "[ . 1 . 2]" 1
317 1 62 ILE HB 1 63 VAL H . . 4.500 3.259 2.834 3.658 . 0 0 "[ . 1 . 2]" 1
318 1 62 ILE H 1 62 ILE HB . . 3.500 3.083 2.176 3.638 0.138 12 0 "[ . 1 . 2]" 1
319 1 62 ILE HB 1 62 ILE MD . . 3.500 2.767 2.090 3.212 . 0 0 "[ . 1 . 2]" 1
320 1 55 ILE H 1 55 ILE HB . . 2.800 2.284 2.178 2.413 . 0 0 "[ . 1 . 2]" 1
321 1 24 VAL QG 1 29 GLN HG2 . . 3.500 2.561 2.053 3.366 . 0 0 "[ . 1 . 2]" 1
322 1 26 GLU HA 1 29 GLN HG2 . . 4.500 4.580 3.048 5.192 0.692 9 2 "[ . - +1 . 2]" 1
323 1 29 GLN H 1 29 GLN HG2 . . 4.500 3.860 2.599 4.078 . 0 0 "[ . 1 . 2]" 1
324 1 24 VAL QG 1 29 GLN QG . . 3.500 2.111 1.886 2.552 . 0 0 "[ . 1 . 2]" 1
325 1 49 VAL H 1 49 VAL HB . . 3.500 2.911 2.548 3.511 0.011 12 0 "[ . 1 . 2]" 1
326 1 49 VAL HB 1 50 LEU H . . 4.500 3.802 3.295 4.356 . 0 0 "[ . 1 . 2]" 1
327 1 71 GLN QE 1 71 GLN QG . . 2.800 2.324 2.270 2.396 . 0 0 "[ . 1 . 2]" 1
328 1 46 GLU H 1 46 GLU QG . . 3.500 1.985 1.859 2.311 . 0 0 "[ . 1 . 2]" 1
329 1 53 GLN HG2 1 54 GLY H . . 4.500 4.286 3.460 5.016 0.516 1 1 "[+ . 1 . 2]" 1
330 1 68 GLN H 1 68 GLN QG . . 3.500 2.173 1.930 2.270 . 0 0 "[ . 1 . 2]" 1
331 1 68 GLN H 1 68 GLN HG2 . . 2.800 2.234 1.946 3.118 0.318 9 0 "[ . 1 . 2]" 1
332 1 64 GLN H 1 64 GLN QG . . 3.500 2.060 1.932 2.162 . 0 0 "[ . 1 . 2]" 1
333 1 68 GLN HB2 1 68 GLN QG . . 2.800 2.195 2.158 2.346 . 0 0 "[ . 1 . 2]" 1
334 1 11 LYS HB2 1 12 PRO QD . . 4.500 4.385 4.192 4.466 . 0 0 "[ . 1 . 2]" 1
335 1 64 GLN H 1 64 GLN HG2 . . 2.800 3.033 2.154 3.273 0.473 18 0 "[ . 1 . 2]" 1
336 1 18 CYS QB 1 66 CYS HB2 . . 4.500 3.845 3.675 3.981 . 0 0 "[ . 1 . 2]" 1
337 1 18 CYS QB 1 66 CYS HA . . 4.500 2.366 2.153 2.681 . 0 0 "[ . 1 . 2]" 1
338 1 18 CYS H 1 18 CYS QB . . 3.500 2.035 1.981 2.137 . 0 0 "[ . 1 . 2]" 1
339 1 18 CYS H 1 18 CYS HB2 . . 2.800 2.052 1.995 2.157 . 0 0 "[ . 1 . 2]" 1
340 1 81 GLU H 1 81 GLU QG . . 3.500 2.604 2.418 2.844 . 0 0 "[ . 1 . 2]" 1
341 1 61 ALA MB 1 81 GLU QG . . 3.500 2.324 2.183 2.524 . 0 0 "[ . 1 . 2]" 1
342 1 61 ALA HA 1 81 GLU QG . . 3.500 3.608 3.538 3.657 0.157 13 0 "[ . 1 . 2]" 1
343 1 26 GLU HA 1 26 GLU HG3 . . 3.500 3.443 3.401 3.497 . 0 0 "[ . 1 . 2]" 1
344 1 26 GLU HG3 1 27 SER H . . 4.500 3.776 3.749 3.805 . 0 0 "[ . 1 . 2]" 1
345 1 26 GLU H 1 26 GLU HG3 . . 3.500 1.855 1.816 1.918 . 0 0 "[ . 1 . 2]" 1
346 1 26 GLU H 1 26 GLU QG . . 3.500 1.824 1.780 1.887 . 0 0 "[ . 1 . 2]" 1
347 1 26 GLU QG 1 27 SER H . . 3.500 3.625 3.602 3.646 0.146 13 0 "[ . 1 . 2]" 1
348 1 25 ASP HA 1 26 GLU QG . . 4.500 3.603 3.540 3.654 . 0 0 "[ . 1 . 2]" 1
349 1 81 GLU H 1 81 GLU HG2 . . 2.800 2.641 2.445 2.909 0.109 19 0 "[ . 1 . 2]" 1
350 1 61 ALA MB 1 81 GLU HG2 . . 3.500 3.676 3.558 3.829 0.329 9 0 "[ . 1 . 2]" 1
351 1 70 LYS H 1 70 LYS QB . . 2.800 2.376 2.245 2.456 . 0 0 "[ . 1 . 2]" 1
352 1 70 LYS HA 1 70 LYS QB . . 2.800 2.440 2.401 2.491 . 0 0 "[ . 1 . 2]" 1
353 1 19 GLU QG 1 70 LYS QB . . 4.500 3.067 2.444 4.155 . 0 0 "[ . 1 . 2]" 1
354 1 84 LYS QB 1 85 ILE H . . 4.500 3.477 2.423 3.683 . 0 0 "[ . 1 . 2]" 1
355 1 81 GLU HA 1 84 LYS QB . . 2.800 2.771 1.992 2.931 0.131 6 0 "[ . 1 . 2]" 1
356 1 12 PRO QB 1 12 PRO QD . . 3.500 2.641 2.551 2.732 . 0 0 "[ . 1 . 2]" 1
357 1 84 LYS QB 1 84 LYS QE . . 3.500 2.717 2.099 3.695 0.195 15 0 "[ . 1 . 2]" 1
358 1 84 LYS QB 1 84 LYS HD2 . . 2.800 2.628 2.319 3.470 0.670 3 2 "[ + . 1 - . 2]" 1
359 1 5 LYS HA 1 5 LYS HB2 . . 2.800 2.804 2.340 3.052 0.252 8 0 "[ . 1 . 2]" 1
360 1 10 LYS HA 1 10 LYS QB . . 2.800 2.265 2.098 2.497 . 0 0 "[ . 1 . 2]" 1
361 1 87 LYS QB 1 88 ASP H . . 3.500 2.764 2.503 2.834 . 0 0 "[ . 1 . 2]" 1
362 1 83 ASP HA 1 87 LYS QB . . 3.500 2.278 2.099 2.864 . 0 0 "[ . 1 . 2]" 1
363 1 58 VAL HB 1 85 ILE MD . . 4.500 4.125 3.153 4.469 . 0 0 "[ . 1 . 2]" 1
364 1 58 VAL H 1 58 VAL HB . . 3.500 2.739 2.206 3.602 0.102 15 0 "[ . 1 . 2]" 1
365 1 58 VAL HB 1 59 THR H . . 4.500 3.518 3.087 4.209 . 0 0 "[ . 1 . 2]" 1
366 1 42 LYS QB 1 42 LYS QE . . 3.500 2.658 1.987 3.202 . 0 0 "[ . 1 . 2]" 1
367 1 87 LYS HB2 1 88 ASP H . . 2.800 2.858 2.565 2.936 0.136 13 0 "[ . 1 . 2]" 1
368 1 79 LYS HB2 1 80 GLY H . . 2.800 2.564 2.430 2.896 0.096 5 0 "[ . 1 . 2]" 1
369 1 24 VAL H 1 24 VAL HB . . 2.800 2.571 2.268 2.733 . 0 0 "[ . 1 . 2]" 1
370 1 63 VAL HB 1 64 GLN H . . 3.500 2.941 2.508 3.575 0.075 14 0 "[ . 1 . 2]" 1
371 1 63 VAL H 1 63 VAL HB . . 3.500 2.759 2.286 3.597 0.097 5 0 "[ . 1 . 2]" 1
372 1 33 VAL H 1 33 VAL HB . . 2.800 2.701 2.434 2.826 0.026 18 0 "[ . 1 . 2]" 1
373 1 30 PRO HA 1 33 VAL HB . . 4.500 3.839 2.328 4.540 0.040 7 0 "[ . 1 . 2]" 1
374 1 33 VAL HB 1 34 GLY H . . 4.500 3.537 2.347 4.231 . 0 0 "[ . 1 . 2]" 1
375 1 66 CYS H 1 66 CYS QB . . 3.500 2.305 2.239 2.364 . 0 0 "[ . 1 . 2]" 1
376 1 66 CYS H 1 66 CYS HB2 . . 2.800 2.333 2.264 2.395 . 0 0 "[ . 1 . 2]" 1
377 1 22 LEU QD 1 66 CYS HB2 . . 3.500 3.091 2.631 3.610 0.110 15 0 "[ . 1 . 2]" 1
378 1 22 LEU QD 1 66 CYS QB . . 4.500 2.716 2.263 3.163 . 0 0 "[ . 1 . 2]" 1
379 1 86 LYS HA 1 86 LYS QB . . 2.800 2.360 2.338 2.378 . 0 0 "[ . 1 . 2]" 1
380 1 86 LYS H 1 86 LYS QB . . 2.800 2.534 2.480 2.588 . 0 0 "[ . 1 . 2]" 1
381 1 44 LYS QB 1 44 LYS HE2 . . 4.500 4.026 2.213 4.499 . 0 0 "[ . 1 . 2]" 1
382 1 44 LYS QB 1 47 ASP H . . 5.500 4.360 3.995 4.645 . 0 0 "[ . 1 . 2]" 1
383 1 44 LYS H 1 44 LYS QB . . 3.500 2.684 2.419 3.442 . 0 0 "[ . 1 . 2]" 1
384 1 77 LYS H 1 77 LYS QB . . 3.500 2.206 2.080 2.424 . 0 0 "[ . 1 . 2]" 1
385 1 77 LYS QB 1 78 VAL H . . 2.800 2.813 2.651 2.865 0.065 14 0 "[ . 1 . 2]" 1
386 1 44 LYS HB2 1 46 GLU H . . 3.500 3.255 2.845 3.643 0.143 19 0 "[ . 1 . 2]" 1
387 1 44 LYS HA 1 44 LYS HB2 . . 2.800 3.039 3.016 3.057 0.257 5 0 "[ . 1 . 2]" 1
388 1 78 VAL H 1 78 VAL HB . . 3.500 3.161 2.433 3.695 0.195 1 0 "[ . 1 . 2]" 1
389 1 60 PRO QB 1 61 ALA H . . 4.500 3.803 3.517 3.885 . 0 0 "[ . 1 . 2]" 1
390 1 30 PRO QB 1 31 THR H . . 4.500 3.086 2.911 3.323 . 0 0 "[ . 1 . 2]" 1
391 1 30 PRO QB 1 59 THR MG . . 3.500 3.510 3.490 3.527 0.027 18 0 "[ . 1 . 2]" 1
392 1 30 PRO QB 1 55 ILE MG . . 3.500 2.053 1.995 2.146 . 0 0 "[ . 1 . 2]" 1
393 1 77 LYS H 1 77 LYS HB2 . . 2.800 2.271 2.103 2.461 . 0 0 "[ . 1 . 2]" 1
394 1 77 LYS HB2 1 78 VAL H . . 4.500 3.613 2.744 4.041 . 0 0 "[ . 1 . 2]" 1
395 1 60 PRO HB3 1 61 ALA H . . 4.500 4.552 4.364 4.620 0.120 1 0 "[ . 1 . 2]" 1
396 1 30 PRO HB3 1 59 THR MG . . 3.500 3.671 3.650 3.690 0.190 10 0 "[ . 1 . 2]" 1
397 1 13 VAL H 1 13 VAL HB . . 3.500 3.570 3.553 3.597 0.097 1 0 "[ . 1 . 2]" 1
398 1 62 ILE H 1 62 ILE QG . . 2.800 2.229 2.003 2.511 . 0 0 "[ . 1 . 2]" 1
399 1 75 LYS H 1 75 LYS HB2 . . 2.800 2.470 2.176 2.962 0.162 6 0 "[ . 1 . 2]" 1
400 1 75 LYS HB2 1 76 ASP H . . 3.500 3.889 3.455 4.199 0.699 16 6 "[ - * **1 .+ *]" 1
401 1 75 LYS H 1 75 LYS QB . . 3.500 2.327 2.063 2.863 . 0 0 "[ . 1 . 2]" 1
402 1 75 LYS QB 1 75 LYS HG2 . . 2.800 2.347 2.134 2.486 . 0 0 "[ . 1 . 2]" 1
403 1 55 ILE QG 1 55 ILE MG . . 2.800 2.207 2.051 2.320 . 0 0 "[ . 1 . 2]" 1
404 1 55 ILE H 1 55 ILE QG . . 3.500 2.646 2.261 3.280 . 0 0 "[ . 1 . 2]" 1
405 1 68 GLN HB2 1 68 GLN HG2 . . 2.800 2.593 2.380 3.048 0.248 9 0 "[ . 1 . 2]" 1
406 1 68 GLN H 1 68 GLN HB2 . . 2.800 2.736 2.554 3.658 0.858 3 2 "[ +-. 1 . 2]" 1
407 1 68 GLN H 1 68 GLN QB . . 2.800 2.582 2.506 2.711 . 0 0 "[ . 1 . 2]" 1
408 1 4 GLN HA 1 4 GLN QB . . 2.800 2.212 2.040 2.541 . 0 0 "[ . 1 . 2]" 1
409 1 82 TRP H 1 82 TRP HB3 . . 2.800 2.479 2.416 2.568 . 0 0 "[ . 1 . 2]" 1
410 1 82 TRP HB3 1 83 ASP H . . 2.800 2.640 2.524 2.730 . 0 0 "[ . 1 . 2]" 1
411 1 60 PRO HG2 1 61 ALA H . . 3.500 3.209 2.753 3.404 . 0 0 "[ . 1 . 2]" 1
412 1 60 PRO QD 1 60 PRO HG2 . . 2.800 2.279 2.272 2.293 . 0 0 "[ . 1 . 2]" 1
413 1 30 PRO QG 1 59 THR MG . . 2.800 1.992 1.958 2.030 . 0 0 "[ . 1 . 2]" 1
414 1 77 LYS HA 1 77 LYS QD . . 2.800 2.353 2.110 2.800 . 0 0 "[ . 1 . 2]" 1
415 1 77 LYS QD 1 77 LYS HG3 . . 2.800 2.464 2.144 2.593 . 0 0 "[ . 1 . 2]" 1
416 1 81 GLU HA 1 81 GLU HB2 . . 2.800 3.039 2.995 3.054 0.254 18 0 "[ . 1 . 2]" 1
417 1 53 GLN QB 1 54 GLY H . . 2.800 2.700 2.465 2.824 0.024 1 0 "[ . 1 . 2]" 1
418 1 19 GLU H 1 19 GLU HB2 . . 2.800 2.326 2.212 2.410 . 0 0 "[ . 1 . 2]" 1
419 1 46 GLU H 1 46 GLU QB . . 2.800 2.497 2.371 2.587 . 0 0 "[ . 1 . 2]" 1
420 1 46 GLU H 1 46 GLU HB2 . . 2.800 2.651 2.407 3.549 0.749 19 2 "[- . 1 . +2]" 1
421 1 85 ILE QG 1 85 ILE MG . . 2.800 2.341 2.204 2.473 . 0 0 "[ . 1 . 2]" 1
422 1 85 ILE HG13 1 85 ILE MG . . 2.800 3.241 3.162 3.270 0.470 19 0 "[ . 1 . 2]" 1
423 1 85 ILE HA 1 85 ILE QG . . 3.500 2.073 2.051 2.090 . 0 0 "[ . 1 . 2]" 1
424 1 85 ILE HA 1 85 ILE HG13 . . 3.500 2.394 2.122 2.731 . 0 0 "[ . 1 . 2]" 1
425 1 85 ILE H 1 85 ILE QG . . 3.500 2.847 2.599 3.301 . 0 0 "[ . 1 . 2]" 1
426 1 85 ILE H 1 85 ILE HG13 . . 3.500 2.908 2.651 3.399 . 0 0 "[ . 1 . 2]" 1
427 1 85 ILE QG 1 86 LYS H . . 4.500 4.355 4.253 4.453 . 0 0 "[ . 1 . 2]" 1
428 1 85 ILE HG13 1 86 LYS H . . 4.500 4.720 4.609 4.841 0.341 1 0 "[ . 1 . 2]" 1
429 1 71 GLN H 1 71 GLN HB2 . . 3.500 2.450 2.316 2.498 . 0 0 "[ . 1 . 2]" 1
430 1 71 GLN HA 1 71 GLN HB2 . . 2.800 3.033 3.020 3.039 0.239 12 0 "[ . 1 . 2]" 1
431 1 37 GLU H 1 37 GLU QB . . 2.800 2.299 2.123 2.491 . 0 0 "[ . 1 . 2]" 1
432 1 37 GLU H 1 37 GLU HB2 . . 3.500 2.406 2.213 2.580 . 0 0 "[ . 1 . 2]" 1
433 1 37 GLU HB2 1 38 ALA H . . 4.500 3.413 2.753 4.254 . 0 0 "[ . 1 . 2]" 1
434 1 37 GLU QB 1 38 ALA H . . 4.500 2.885 2.634 3.167 . 0 0 "[ . 1 . 2]" 1
435 1 50 LEU HA 1 50 LEU HG . . 4.500 3.476 2.850 3.740 . 0 0 "[ . 1 . 2]" 1
436 1 22 LEU QD 1 70 LYS QG . . 3.500 2.262 2.035 2.661 . 0 0 "[ . 1 . 2]" 1
437 1 70 LYS HE3 1 70 LYS QG . . 3.500 2.571 2.373 3.370 . 0 0 "[ . 1 . 2]" 1
438 1 70 LYS H 1 70 LYS QG . . 3.500 2.440 2.074 3.411 . 0 0 "[ . 1 . 2]" 1
439 1 22 LEU H 1 22 LEU HG . . 4.500 2.674 2.086 4.232 . 0 0 "[ . 1 . 2]" 1
440 1 22 LEU H 1 22 LEU QD . . 3.500 3.124 2.410 3.341 . 0 0 "[ . 1 . 2]" 1
441 1 26 GLU HA 1 29 GLN QB . . 3.500 2.652 2.519 2.897 . 0 0 "[ . 1 . 2]" 1
442 1 29 GLN QB 1 30 PRO HD2 . . 3.500 3.299 3.121 3.460 . 0 0 "[ . 1 . 2]" 1
443 1 29 GLN H 1 29 GLN QB . . 2.800 2.190 2.027 2.413 . 0 0 "[ . 1 . 2]" 1
444 1 29 GLN QB 1 63 VAL QG . . 3.500 2.592 2.243 3.046 . 0 0 "[ . 1 . 2]" 1
445 1 87 LYS H 1 87 LYS HG2 . . 2.800 2.434 2.279 2.939 0.139 11 0 "[ . 1 . 2]" 1
446 1 5 LYS H 1 5 LYS QG . . 2.800 2.391 2.044 2.780 . 0 0 "[ . 1 . 2]" 1
447 1 33 VAL QG 1 55 ILE MG . . 2.800 2.683 2.244 2.839 0.039 9 0 "[ . 1 . 2]" 1
448 1 30 PRO HA 1 33 VAL QG . . 3.500 2.210 2.053 2.598 . 0 0 "[ . 1 . 2]" 1
449 1 31 THR H 1 33 VAL QG . . 4.500 4.370 4.201 4.576 0.076 4 0 "[ . 1 . 2]" 1
450 1 33 VAL QG 1 34 GLY H . . 3.500 2.632 2.305 3.207 . 0 0 "[ . 1 . 2]" 1
451 1 84 LYS H 1 84 LYS QG . . 2.800 2.978 2.922 3.080 0.280 7 0 "[ . 1 . 2]" 1
452 1 44 LYS QG 1 45 PRO HD3 . . 4.500 3.926 3.283 4.684 0.184 7 0 "[ . 1 . 2]" 1
453 1 44 LYS HB2 1 44 LYS QG . . 2.800 2.306 2.151 2.419 . 0 0 "[ . 1 . 2]" 1
454 1 86 LYS H 1 86 LYS QG . . 2.800 2.230 2.135 2.275 . 0 0 "[ . 1 . 2]" 1
455 1 86 LYS HA 1 86 LYS QG . . 3.500 3.038 2.924 3.091 . 0 0 "[ . 1 . 2]" 1
456 1 85 ILE HB 1 86 LYS QG . . 3.500 3.209 2.974 3.461 . 0 0 "[ . 1 . 2]" 1
457 1 77 LYS HA 1 77 LYS QG . . 3.500 2.462 2.265 2.959 . 0 0 "[ . 1 . 2]" 1
458 1 42 LYS H 1 42 LYS QG . . 2.800 2.454 2.293 2.619 . 0 0 "[ . 1 . 2]" 1
459 1 42 LYS QG 1 43 ASP H . . 3.500 2.542 1.861 3.624 0.124 11 0 "[ . 1 . 2]" 1
460 1 79 LYS H 1 79 LYS HG2 . . 4.500 3.662 3.529 3.808 . 0 0 "[ . 1 . 2]" 1
461 1 10 LYS H 1 10 LYS QG . . 2.800 2.488 2.109 2.878 0.078 14 0 "[ . 1 . 2]" 1
462 1 39 LEU HA 1 42 LYS QG . . 4.500 3.582 3.403 3.740 . 0 0 "[ . 1 . 2]" 1
463 1 39 LEU QD 1 42 LYS QG . . 4.500 4.273 4.012 4.513 0.013 8 0 "[ . 1 . 2]" 1
464 1 39 LEU H 1 39 LEU HG . . 4.500 3.644 3.529 3.805 . 0 0 "[ . 1 . 2]" 1
465 1 78 VAL QG 1 79 LYS H . . 3.500 2.766 2.308 3.247 . 0 0 "[ . 1 . 2]" 1
466 1 13 VAL QG 1 78 VAL QG . . 5.500 4.335 3.906 4.753 . 0 0 "[ . 1 . 2]" 1
467 1 39 LEU H 1 39 LEU QD . . 3.500 2.121 1.873 2.248 . 0 0 "[ . 1 . 2]" 1
468 1 39 LEU HB2 1 39 LEU QD . . 2.800 2.530 2.398 2.614 . 0 0 "[ . 1 . 2]" 1
469 1 38 ALA MB 1 39 LEU QD . . 2.800 2.149 2.002 2.261 . 0 0 "[ . 1 . 2]" 1
470 1 24 VAL QG 1 29 GLN QB . . 4.500 3.440 2.569 3.794 . 0 0 "[ . 1 . 2]" 1
471 1 75 LYS QG 1 79 LYS QD . . 2.800 2.765 2.595 2.830 0.030 12 0 "[ . 1 . 2]" 1
472 1 75 LYS H 1 75 LYS QG . . 4.500 3.983 3.675 4.353 . 0 0 "[ . 1 . 2]" 1
473 1 31 THR MG 1 34 GLY HA2 . . 5.500 5.612 5.323 6.005 0.505 10 1 "[ . + . 2]" 1
474 1 31 THR H 1 31 THR MG . . 4.500 3.747 3.714 3.778 . 0 0 "[ . 1 . 2]" 1
475 1 31 THR MG 1 32 ALA H . . 3.500 3.537 3.519 3.571 0.071 19 0 "[ . 1 . 2]" 1
476 1 31 THR MG 1 34 GLY H . . 5.500 4.715 4.483 4.979 . 0 0 "[ . 1 . 2]" 1
477 1 63 VAL QG 1 64 GLN H . . 2.800 2.609 2.100 2.881 0.081 20 0 "[ . 1 . 2]" 1
478 1 29 GLN QG 1 63 VAL QG . . 4.500 3.294 2.494 3.677 . 0 0 "[ . 1 . 2]" 1
479 1 59 THR MG 1 63 VAL QG . . 2.800 2.478 2.119 2.779 . 0 0 "[ . 1 . 2]" 1
480 1 58 VAL QG 1 82 TRP H . . 4.500 3.512 2.949 4.098 . 0 0 "[ . 1 . 2]" 1
481 1 58 VAL QG 1 62 ILE QG . . 3.500 3.233 2.079 3.615 0.115 10 0 "[ . 1 . 2]" 1
482 1 58 VAL QG 1 61 ALA MB . . 3.500 2.683 2.175 3.444 . 0 0 "[ . 1 . 2]" 1
483 1 58 VAL QG 1 62 ILE MG . . 4.000 3.807 2.946 4.179 0.179 13 0 "[ . 1 . 2]" 1
484 1 58 VAL QG 1 85 ILE MD . . 2.800 2.184 2.032 2.476 . 0 0 "[ . 1 . 2]" 1
485 1 22 LEU QD 1 63 VAL HA . . 4.500 3.608 2.937 4.173 . 0 0 "[ . 1 . 2]" 1
486 1 22 LEU QD 1 29 GLN QG . . 4.500 4.450 3.958 4.530 0.030 6 0 "[ . 1 . 2]" 1
487 1 22 LEU QD 1 23 ALA H . . 4.500 4.361 3.868 4.509 0.009 5 0 "[ . 1 . 2]" 1
488 1 17 THR MG 1 74 PHE H . . 4.500 4.265 3.755 4.539 0.039 5 0 "[ . 1 . 2]" 1
489 1 17 THR MG 1 19 GLU H . . 4.500 4.297 3.906 4.544 0.044 7 0 "[ . 1 . 2]" 1
490 1 17 THR MG 1 18 CYS H . . 3.500 3.524 3.441 3.554 0.054 10 0 "[ . 1 . 2]" 1
491 1 17 THR H 1 17 THR MG . . 2.800 2.574 2.355 2.828 0.028 19 0 "[ . 1 . 2]" 1
492 1 29 GLN QB 1 59 THR MG . . 3.500 3.467 3.195 3.574 0.074 7 0 "[ . 1 . 2]" 1
493 1 29 GLN H 1 59 THR MG . . 5.500 5.518 5.386 5.571 0.071 4 0 "[ . 1 . 2]" 1
494 1 52 VAL QG 1 53 GLN HA . . 4.500 3.522 3.127 3.932 . 0 0 "[ . 1 . 2]" 1
495 1 49 VAL QG 1 50 LEU H . . 3.500 3.207 2.184 3.697 0.197 4 0 "[ . 1 . 2]" 1
496 1 33 VAL QG 1 59 THR HA . . 5.500 3.193 2.705 3.431 . 0 0 "[ . 1 . 2]" 1
497 1 33 VAL QG 1 37 GLU QG . . 3.500 2.997 2.373 3.571 0.071 7 0 "[ . 1 . 2]" 1
498 1 33 VAL QG 1 55 ILE MD . . 4.500 3.623 3.367 3.905 . 0 0 "[ . 1 . 2]" 1
499 1 67 THR MG 1 70 LYS HE3 . . 3.500 3.635 3.438 3.700 0.200 9 0 "[ . 1 . 2]" 1
500 1 67 THR MG 1 68 GLN HG2 . . 3.500 3.065 2.809 3.669 0.169 4 0 "[ . 1 . 2]" 1
501 1 67 THR MG 1 68 GLN H . . 3.500 2.449 2.357 2.552 . 0 0 "[ . 1 . 2]" 1
502 1 67 THR H 1 67 THR MG . . 2.800 2.898 2.864 2.943 0.143 9 0 "[ . 1 . 2]" 1
503 1 67 THR MG 1 68 GLN HA . . 3.500 3.415 3.252 3.505 0.005 5 0 "[ . 1 . 2]" 1
504 1 64 GLN QB 1 67 THR MG . . 3.500 3.528 3.504 3.557 0.057 11 0 "[ . 1 . 2]" 1
505 1 78 VAL QG 1 79 LYS HA . . 4.500 3.562 3.328 3.773 . 0 0 "[ . 1 . 2]" 1
506 1 37 GLU H 1 78 VAL QG . . 4.500 4.082 3.628 4.484 . 0 0 "[ . 1 . 2]" 1
507 1 13 VAL QG 1 36 ALA H . . 4.500 3.423 3.223 3.716 . 0 0 "[ . 1 . 2]" 1
508 1 13 VAL QG 1 14 ASN H . . 3.500 2.816 2.480 3.258 . 0 0 "[ . 1 . 2]" 1
509 1 48 ALA MB 1 49 VAL H . . 3.500 3.165 2.668 3.472 . 0 0 "[ . 1 . 2]" 1
510 1 71 GLN H 1 72 ALA MB . . 4.500 4.255 4.151 4.323 . 0 0 "[ . 1 . 2]" 1
511 1 18 CYS QB 1 72 ALA MB . . 4.500 3.009 2.379 3.627 . 0 0 "[ . 1 . 2]" 1
512 1 69 ASP QB 1 72 ALA MB . . 3.500 2.612 1.988 3.304 . 0 0 "[ . 1 . 2]" 1
513 1 72 ALA MB 1 77 LYS QD . . 3.500 2.790 2.130 3.607 0.107 2 0 "[ . 1 . 2]" 1
514 1 7 ALA MB 1 10 LYS QD . . 3.500 3.291 2.231 3.669 0.169 6 0 "[ . 1 . 2]" 1
515 1 22 LEU H 1 23 ALA MB . . 4.500 3.995 3.732 4.360 . 0 0 "[ . 1 . 2]" 1
516 1 23 ALA MB 1 24 VAL HA . . 4.500 4.111 4.003 4.161 . 0 0 "[ . 1 . 2]" 1
517 1 23 ALA MB 1 24 VAL QG . . 5.500 3.614 2.856 4.120 . 0 0 "[ . 1 . 2]" 1
518 1 62 ILE MG 1 78 VAL HA . . 4.500 2.928 2.011 4.039 . 0 0 "[ . 1 . 2]" 1
519 1 62 ILE MG 1 78 VAL H . . 4.500 3.781 3.283 4.524 0.024 5 0 "[ . 1 . 2]" 1
520 1 62 ILE H 1 62 ILE MG . . 3.500 3.334 2.617 3.661 0.161 16 0 "[ . 1 . 2]" 1
521 1 62 ILE MG 1 63 VAL H . . 4.500 4.043 3.481 4.435 . 0 0 "[ . 1 . 2]" 1
522 1 33 VAL QG 1 62 ILE MG . . 3.500 3.464 3.267 3.587 0.087 7 0 "[ . 1 . 2]" 1
523 1 52 VAL HA 1 55 ILE MG . . 4.500 3.561 3.309 3.994 . 0 0 "[ . 1 . 2]" 1
524 1 34 GLY H 1 55 ILE MG . . 4.500 3.942 3.598 4.286 . 0 0 "[ . 1 . 2]" 1
525 1 55 ILE MG 1 56 ALA MB . . 3.500 3.533 3.505 3.554 0.054 1 0 "[ . 1 . 2]" 1
526 1 55 ILE MD 1 55 ILE MG . . 2.800 2.453 2.180 2.852 0.052 15 0 "[ . 1 . 2]" 1
527 1 65 ALA MB 1 77 LYS QE . . 3.500 2.465 1.940 3.612 0.112 5 0 "[ . 1 . 2]" 1
528 1 65 ALA MB 1 68 GLN QG . . 3.500 3.575 3.465 3.636 0.136 9 0 "[ . 1 . 2]" 1
529 1 52 VAL QG 1 56 ALA MB . . 4.500 2.383 2.078 2.912 . 0 0 "[ . 1 . 2]" 1
530 1 62 ILE MG 1 65 ALA MB . . 3.500 3.317 2.902 3.557 0.057 7 0 "[ . 1 . 2]" 1
531 1 32 ALA MB 1 33 VAL H . . 3.500 2.508 2.337 2.675 . 0 0 "[ . 1 . 2]" 1
532 1 36 ALA MB 1 75 LYS QB . . 4.500 4.055 3.260 4.625 0.125 14 0 "[ . 1 . 2]" 1
533 1 33 VAL QG 1 36 ALA MB . . 4.500 3.649 3.192 4.156 . 0 0 "[ . 1 . 2]" 1
534 1 38 ALA MB 1 40 ASN H . . 4.500 4.367 4.172 4.543 0.043 2 0 "[ . 1 . 2]" 1
535 1 61 ALA MB 1 62 ILE HA . . 4.500 3.941 3.775 4.074 . 0 0 "[ . 1 . 2]" 1
536 1 61 ALA MB 1 85 ILE MD . . 5.500 2.283 2.139 2.708 . 0 0 "[ . 1 . 2]" 1
537 1 61 ALA MB 1 84 LYS QG . . 3.500 3.516 3.192 3.616 0.116 12 0 "[ . 1 . 2]" 1
538 1 85 ILE MG 1 86 LYS H . . 2.800 2.879 2.850 2.918 0.118 7 0 "[ . 1 . 2]" 1
539 1 85 ILE MG 1 86 LYS HG2 . . 3.500 2.146 2.098 2.192 . 0 0 "[ . 1 . 2]" 1
540 1 58 VAL QG 1 85 ILE MG . . 3.500 3.062 2.155 3.523 0.023 7 0 "[ . 1 . 2]" 1
541 1 85 ILE MD 1 85 ILE MG . . 2.800 2.147 2.069 2.456 . 0 0 "[ . 1 . 2]" 1
542 1 62 ILE HA 1 62 ILE MD . . 3.500 3.557 3.159 3.764 0.264 17 0 "[ . 1 . 2]" 1
543 1 62 ILE H 1 62 ILE MD . . 2.800 2.349 1.791 2.898 0.098 13 0 "[ . 1 . 2]" 1
544 1 61 ALA MB 1 62 ILE MD . . 3.500 3.099 2.605 3.558 0.058 16 0 "[ . 1 . 2]" 1
545 1 33 VAL QG 1 62 ILE MD . . 2.800 2.085 1.954 2.367 . 0 0 "[ . 1 . 2]" 1
546 1 62 ILE MD 1 62 ILE MG . . 2.800 2.059 1.953 2.143 . 0 0 "[ . 1 . 2]" 1
547 1 85 ILE H 1 85 ILE MD . . 4.500 3.641 3.409 3.839 . 0 0 "[ . 1 . 2]" 1
548 1 85 ILE MD 1 86 LYS H . . 5.500 4.817 4.662 4.897 . 0 0 "[ . 1 . 2]" 1
549 1 58 VAL H 1 85 ILE MD . . 4.500 4.081 3.508 4.351 . 0 0 "[ . 1 . 2]" 1
550 1 41 ASN QD 1 55 ILE MD . . 5.500 5.502 4.892 5.582 0.082 5 0 "[ . 1 . 2]" 1
551 1 51 ASP H 1 55 ILE MD . . 3.500 3.037 2.673 3.363 . 0 0 "[ . 1 . 2]" 1
552 1 34 GLY H 1 55 ILE MD . . 4.500 4.171 3.792 4.535 0.035 15 0 "[ . 1 . 2]" 1
553 1 52 VAL HA 1 55 ILE MD . . 3.500 2.886 2.447 3.506 0.006 1 0 "[ . 1 . 2]" 1
554 1 55 ILE HB 1 55 ILE MD . . 3.500 2.258 2.129 2.367 . 0 0 "[ . 1 . 2]" 1
555 1 64 GLN HA 1 64 GLN HG2 . . 2.800 2.643 2.536 2.988 0.188 11 0 "[ . 1 . 2]" 1
556 1 32 ALA HA 1 33 VAL H . . 5.500 3.609 3.572 3.642 . 0 0 "[ . 1 . 2]" 1
557 1 32 ALA HA 1 36 ALA H . . 4.500 4.448 3.855 4.705 0.205 2 0 "[ . 1 . 2]" 1
558 1 33 VAL HA 1 34 GLY H . . 4.500 3.577 3.547 3.604 . 0 0 "[ . 1 . 2]" 1
559 1 33 VAL HA 1 36 ALA H . . 4.500 3.652 3.232 3.925 . 0 0 "[ . 1 . 2]" 1
560 1 33 VAL HA 1 37 GLU H . . 5.500 3.979 3.054 4.533 . 0 0 "[ . 1 . 2]" 1
561 1 35 PHE HA 1 36 ALA H . . 4.500 3.534 3.411 3.647 . 0 0 "[ . 1 . 2]" 1
562 1 35 PHE HA 1 38 ALA H . . 4.500 3.704 3.527 3.852 . 0 0 "[ . 1 . 2]" 1
563 1 35 PHE HA 1 39 LEU H . . 5.500 3.883 3.488 4.432 . 0 0 "[ . 1 . 2]" 1
564 1 36 ALA HA 1 37 GLU H . . 4.500 3.602 3.529 3.662 . 0 0 "[ . 1 . 2]" 1
565 1 36 ALA HA 1 38 ALA H . . 5.500 4.713 4.477 4.980 . 0 0 "[ . 1 . 2]" 1
566 1 36 ALA HA 1 40 ASN H . . 5.500 4.707 4.087 5.067 . 0 0 "[ . 1 . 2]" 1
567 1 35 PHE HB2 1 36 ALA HA . . 5.500 5.138 4.790 5.621 0.121 1 0 "[ . 1 . 2]" 1
568 1 38 ALA HA 1 41 ASN QB . . 5.500 4.194 2.938 5.497 . 0 0 "[ . 1 . 2]" 1
569 1 38 ALA HA 1 51 ASP QB . . 5.500 5.197 4.555 5.589 0.089 18 0 "[ . 1 . 2]" 1
570 1 39 LEU HA 1 42 LYS QB . . 5.500 5.473 5.277 5.531 0.031 2 0 "[ . 1 . 2]" 1
571 1 39 LEU HA 1 42 LYS QE . . 5.500 5.507 5.085 5.608 0.108 5 0 "[ . 1 . 2]" 1
572 1 26 GLU HA 1 28 PHE H . . 4.500 3.939 3.851 4.117 . 0 0 "[ . 1 . 2]" 1
573 1 25 ASP HA 1 28 PHE H . . 5.500 4.694 4.606 4.784 . 0 0 "[ . 1 . 2]" 1
574 1 59 THR HA 1 61 ALA H . . 5.500 3.925 3.827 4.143 . 0 0 "[ . 1 . 2]" 1
575 1 59 THR HA 1 63 VAL H . . 5.500 4.139 3.752 4.386 . 0 0 "[ . 1 . 2]" 1
576 1 63 VAL HA 1 64 GLN H . . 4.500 3.568 3.541 3.612 . 0 0 "[ . 1 . 2]" 1
577 1 63 VAL HA 1 66 CYS H . . 5.500 4.068 3.573 4.412 . 0 0 "[ . 1 . 2]" 1
578 1 64 GLN HA 1 67 THR H . . 3.500 3.482 3.283 3.552 0.052 11 0 "[ . 1 . 2]" 1
579 1 65 ALA HA 1 67 THR H . . 5.500 3.920 3.839 4.083 . 0 0 "[ . 1 . 2]" 1
580 1 74 PHE HA 1 75 LYS H . . 5.500 3.108 2.072 3.653 . 0 0 "[ . 1 . 2]" 1
581 1 74 PHE HA 1 77 LYS H . . 4.500 3.816 3.243 4.652 0.152 5 0 "[ . 1 . 2]" 1
582 1 67 THR MG 1 68 GLN QB . . 4.500 4.070 2.983 4.318 . 0 0 "[ . 1 . 2]" 1
583 1 4 GLN QB 1 6 ALA MB . . 6.000 5.353 3.477 6.086 0.086 1 0 "[ . 1 . 2]" 1
584 1 8 ASP HA 1 8 ASP HB2 . . 2.800 2.526 2.372 3.041 0.241 9 0 "[ . 1 . 2]" 1
585 1 10 LYS H 1 10 LYS HB2 . . 3.500 3.314 2.363 4.035 0.535 7 3 "[ . + - . * 2]" 1
586 1 10 LYS H 1 10 LYS QE . . 4.500 4.330 3.662 4.576 0.076 5 0 "[ . 1 . 2]" 1
587 1 12 PRO HB2 1 13 VAL H . . 4.500 2.874 2.587 3.796 . 0 0 "[ . 1 . 2]" 1
588 1 35 PHE HB2 1 39 LEU QD . . 5.500 4.628 4.281 4.982 . 0 0 "[ . 1 . 2]" 1
589 1 38 ALA H 1 39 LEU QD . . 5.500 3.655 3.297 3.920 . 0 0 "[ . 1 . 2]" 1
590 1 14 ASN QB 1 14 ASN HD22 . . 3.500 2.341 2.218 2.506 . 0 0 "[ . 1 . 2]" 1
591 1 14 ASN H 1 14 ASN QB . . 3.500 2.516 2.154 3.060 . 0 0 "[ . 1 . 2]" 1
592 1 14 ASN QB 1 75 LYS QD . . 5.500 3.828 2.082 5.256 . 0 0 "[ . 1 . 2]" 1
593 1 12 PRO HG2 1 15 SER QB . . 4.500 2.535 2.194 3.089 . 0 0 "[ . 1 . 2]" 1
594 1 16 TRP QB 1 17 THR H . . 4.500 3.010 2.246 3.864 . 0 0 "[ . 1 . 2]" 1
595 1 16 TRP H 1 16 TRP HB2 . . 3.500 2.887 2.190 3.634 0.134 19 0 "[ . 1 . 2]" 1
596 1 16 TRP QB 1 20 ASP QB . . 5.500 3.604 2.167 5.444 . 0 0 "[ . 1 . 2]" 1
597 1 17 THR HA 1 19 GLU H . . 4.500 4.280 4.106 4.421 . 0 0 "[ . 1 . 2]" 1
598 1 18 CYS HB2 1 19 GLU H . . 4.500 3.369 3.138 3.526 . 0 0 "[ . 1 . 2]" 1
599 1 18 CYS QB 1 19 GLU H . . 4.500 3.062 2.940 3.151 . 0 0 "[ . 1 . 2]" 1
600 1 18 CYS HB2 1 66 CYS HA . . 4.500 3.486 3.150 3.806 . 0 0 "[ . 1 . 2]" 1
601 1 19 GLU HA 1 20 ASP H . . 4.500 3.591 3.549 3.646 . 0 0 "[ . 1 . 2]" 1
602 1 79 LYS HA 1 82 TRP H . . 4.500 3.642 3.364 3.889 . 0 0 "[ . 1 . 2]" 1
603 1 19 GLU H 1 19 GLU QB . . 3.500 2.188 2.138 2.216 . 0 0 "[ . 1 . 2]" 1
604 1 20 ASP HA 1 23 ALA H . . 4.500 3.110 2.781 3.561 . 0 0 "[ . 1 . 2]" 1
605 1 20 ASP HA 1 22 LEU H . . 5.500 3.788 3.502 4.215 . 0 0 "[ . 1 . 2]" 1
606 1 17 THR H 1 20 ASP QB . . 4.500 3.709 2.466 4.505 0.005 14 0 "[ . 1 . 2]" 1
607 1 21 PHE QB 1 22 LEU H . . 3.500 3.156 2.717 3.458 . 0 0 "[ . 1 . 2]" 1
608 1 22 LEU H 1 22 LEU HB2 . . 3.500 2.544 2.314 2.644 . 0 0 "[ . 1 . 2]" 1
609 1 22 LEU H 1 22 LEU QB . . 3.500 2.500 2.286 2.591 . 0 0 "[ . 1 . 2]" 1
610 1 22 LEU HB2 1 23 ALA H . . 3.500 3.396 2.965 3.722 0.222 3 0 "[ . 1 . 2]" 1
611 1 22 LEU QB 1 23 ALA H . . 3.500 3.264 2.894 3.533 0.033 3 0 "[ . 1 . 2]" 1
612 1 19 GLU HA 1 22 LEU QB . . 4.500 3.406 3.034 3.825 . 0 0 "[ . 1 . 2]" 1
613 1 19 GLU HA 1 22 LEU HB2 . . 4.500 3.465 3.069 3.928 . 0 0 "[ . 1 . 2]" 1
614 1 22 LEU HG 1 23 ALA H . . 5.500 4.707 4.344 5.505 0.005 20 0 "[ . 1 . 2]" 1
615 1 67 THR HA 1 70 LYS QG . . 4.500 2.542 2.135 3.617 . 0 0 "[ . 1 . 2]" 1
616 1 22 LEU QD 1 66 CYS H . . 5.500 4.188 3.794 4.660 . 0 0 "[ . 1 . 2]" 1
617 1 24 VAL HB 1 25 ASP H . . 4.500 4.112 4.030 4.217 . 0 0 "[ . 1 . 2]" 1
618 1 24 VAL QG 1 28 PHE H . . 3.500 3.258 3.160 3.490 . 0 0 "[ . 1 . 2]" 1
619 1 26 GLU HA 1 29 GLN QG . . 4.500 3.292 2.364 3.980 . 0 0 "[ . 1 . 2]" 1
620 1 24 VAL QG 1 26 GLU HA . . 5.500 4.582 4.362 4.891 . 0 0 "[ . 1 . 2]" 1
621 1 25 ASP QB 1 26 GLU HB2 . . 5.500 4.819 4.335 5.104 . 0 0 "[ . 1 . 2]" 1
622 1 25 ASP QB 1 26 GLU HG3 . . 4.500 4.502 3.889 4.778 0.278 15 0 "[ . 1 . 2]" 1
623 1 28 PHE QB 1 31 THR HA . . 5.500 5.500 5.314 5.538 0.038 7 0 "[ . 1 . 2]" 1
624 1 28 PHE HB3 1 31 THR HA . . 5.500 5.739 5.527 5.784 0.284 7 0 "[ . 1 . 2]" 1
625 1 26 GLU HA 1 29 GLN HA . . 5.500 5.229 5.017 5.534 0.034 7 0 "[ . 1 . 2]" 1
626 1 29 GLN QB 1 31 THR H . . 4.500 4.519 4.420 4.570 0.070 7 0 "[ . 1 . 2]" 1
627 1 29 GLN QG 1 31 THR H . . 5.500 5.490 5.363 5.606 0.106 3 0 "[ . 1 . 2]" 1
628 1 29 GLN H 1 29 GLN QG . . 4.500 2.727 2.476 3.688 . 0 0 "[ . 1 . 2]" 1
629 1 30 PRO HB3 1 31 THR H . . 4.500 4.325 4.197 4.477 . 0 0 "[ . 1 . 2]" 1
630 1 30 PRO QG 1 55 ILE MG . . 3.500 3.503 3.360 3.546 0.046 7 0 "[ . 1 . 2]" 1
631 1 45 PRO HD3 1 46 GLU H . . 4.500 4.042 3.915 4.180 . 0 0 "[ . 1 . 2]" 1
632 1 30 PRO HD2 1 31 THR H . . 4.500 2.872 2.660 3.067 . 0 0 "[ . 1 . 2]" 1
633 1 28 PHE H 1 30 PRO HD2 . . 4.500 3.917 3.454 4.222 . 0 0 "[ . 1 . 2]" 1
634 1 32 ALA MB 1 33 VAL HB . . 4.500 4.400 4.183 4.613 0.113 11 0 "[ . 1 . 2]" 1
635 1 31 THR MG 1 34 GLY QA . . 5.500 4.013 3.795 4.395 . 0 0 "[ . 1 . 2]" 1
636 1 34 GLY QA 1 55 ILE QG . . 4.500 3.113 2.476 3.793 . 0 0 "[ . 1 . 2]" 1
637 1 34 GLY QA 1 55 ILE MG . . 4.500 3.998 3.732 4.266 . 0 0 "[ . 1 . 2]" 1
638 1 33 VAL QG 1 34 GLY QA . . 5.500 3.353 3.146 3.730 . 0 0 "[ . 1 . 2]" 1
639 1 36 ALA MB 1 38 ALA H . . 5.500 4.647 4.487 4.859 . 0 0 "[ . 1 . 2]" 1
640 1 33 VAL QG 1 37 GLU QB . . 5.500 3.017 2.372 3.719 . 0 0 "[ . 1 . 2]" 1
641 1 33 VAL QG 1 37 GLU HB2 . . 5.500 3.175 2.442 3.875 . 0 0 "[ . 1 . 2]" 1
642 1 37 GLU QG 1 40 ASN H . . 5.500 5.439 5.009 5.580 0.080 1 0 "[ . 1 . 2]" 1
643 1 37 GLU H 1 37 GLU QG . . 4.500 3.166 2.281 4.128 . 0 0 "[ . 1 . 2]" 1
644 1 35 PHE H 1 38 ALA MB . . 5.500 4.356 3.653 4.602 . 0 0 "[ . 1 . 2]" 1
645 1 39 LEU HA 1 42 LYS H . . 5.500 3.728 3.376 4.050 . 0 0 "[ . 1 . 2]" 1
646 1 39 LEU HB2 1 40 ASN H . . 3.500 2.992 2.622 3.298 . 0 0 "[ . 1 . 2]" 1
647 1 39 LEU QB 1 40 ASN H . . 3.500 2.899 2.569 3.171 . 0 0 "[ . 1 . 2]" 1
648 1 38 ALA MB 1 39 LEU QB . . 5.500 4.080 3.965 4.155 . 0 0 "[ . 1 . 2]" 1
649 1 40 ASN H 1 40 ASN QB . . 2.800 2.206 2.143 2.483 . 0 0 "[ . 1 . 2]" 1
650 1 41 ASN H 1 41 ASN QB . . 3.500 2.463 2.220 2.958 . 0 0 "[ . 1 . 2]" 1
651 1 41 ASN QB 1 42 LYS H . . 4.500 3.592 3.078 4.134 . 0 0 "[ . 1 . 2]" 1
652 1 40 ASN HA 1 40 ASN QB . . 2.800 2.391 2.176 2.499 . 0 0 "[ . 1 . 2]" 1
653 1 42 LYS H 1 42 LYS HD2 . . 4.500 4.992 4.809 5.178 0.678 1 9 "[+ *. *1*- .*** *]" 1
654 1 14 ASN QD 1 75 LYS QD . . 4.500 3.803 2.569 4.553 0.053 8 0 "[ . 1 . 2]" 1
655 1 39 LEU HA 1 42 LYS HD2 . . 5.500 5.428 4.841 5.893 0.393 16 0 "[ . 1 . 2]" 1
656 1 42 LYS HA 1 42 LYS HD2 . . 5.500 5.538 5.503 5.587 0.087 8 0 "[ . 1 . 2]" 1
657 1 14 ASN HA 1 75 LYS QD . . 4.500 3.356 2.274 4.526 0.026 9 0 "[ . 1 . 2]" 1
658 1 13 VAL QG 1 75 LYS QD . . 4.500 3.351 2.422 4.520 0.020 19 0 "[ . 1 . 2]" 1
659 1 41 ASN QD 1 42 LYS QE . . 5.500 3.765 2.084 4.743 . 0 0 "[ . 1 . 2]" 1
660 1 45 PRO HA 1 48 ALA H . . 4.500 2.984 2.718 3.197 . 0 0 "[ . 1 . 2]" 1
661 1 45 PRO HA 1 47 ASP H . . 5.500 3.531 3.235 3.942 . 0 0 "[ . 1 . 2]" 1
662 1 45 PRO HA 1 46 GLU H . . 4.500 3.272 3.134 3.417 . 0 0 "[ . 1 . 2]" 1
663 1 45 PRO HB2 1 46 GLU H . . 5.500 4.260 3.956 4.396 . 0 0 "[ . 1 . 2]" 1
664 1 44 LYS H 1 45 PRO HD3 . . 4.500 4.939 4.456 5.072 0.572 12 8 "[ * .* * +*** -]" 1
665 1 63 VAL QG 1 64 GLN HG2 . . 4.500 2.955 2.786 3.226 . 0 0 "[ . 1 . 2]" 1
666 1 44 LYS QG 1 46 GLU QG . . 4.500 4.250 3.403 4.544 0.044 13 0 "[ . 1 . 2]" 1
667 1 47 ASP QB 1 48 ALA H . . 4.500 3.808 3.267 4.152 . 0 0 "[ . 1 . 2]" 1
668 1 47 ASP QB 1 49 VAL QG . . 5.500 4.716 3.895 5.523 0.023 11 0 "[ . 1 . 2]" 1
669 1 50 LEU HA 1 51 ASP HB2 . . 5.500 4.472 4.212 5.638 0.138 2 0 "[ . 1 . 2]" 1
670 1 50 LEU QD 1 51 ASP H . . 2.800 2.319 1.761 2.516 . 0 0 "[ . 1 . 2]" 1
671 1 50 LEU QD 1 52 VAL HA . . 4.500 2.731 2.461 2.971 . 0 0 "[ . 1 . 2]" 1
672 1 51 ASP H 1 51 ASP QB . . 3.500 2.317 2.218 2.574 . 0 0 "[ . 1 . 2]" 1
673 1 52 VAL HA 1 55 ILE HA . . 5.500 5.094 4.828 5.582 0.082 1 0 "[ . 1 . 2]" 1
674 1 51 ASP HA 1 52 VAL HB . . 5.500 5.327 4.775 5.520 0.020 5 0 "[ . 1 . 2]" 1
675 1 50 LEU QD 1 52 VAL QG . . 4.500 2.183 1.778 2.301 . 0 0 "[ . 1 . 2]" 1
676 1 54 GLY QA 1 55 ILE QG . . 5.500 4.089 3.828 4.373 . 0 0 "[ . 1 . 2]" 1
677 1 52 VAL QG 1 54 GLY QA . . 5.500 5.354 5.245 5.518 0.018 15 0 "[ . 1 . 2]" 1
678 1 54 GLY QA 1 55 ILE MD . . 5.500 4.455 3.567 4.927 . 0 0 "[ . 1 . 2]" 1
679 1 54 GLY H 1 55 ILE HB . . 5.500 4.548 4.441 4.774 . 0 0 "[ . 1 . 2]" 1
680 1 55 ILE HB 1 56 ALA MB . . 5.500 4.130 3.906 4.378 . 0 0 "[ . 1 . 2]" 1
681 1 51 ASP H 1 55 ILE QG . . 5.500 5.002 4.339 5.519 0.019 2 0 "[ . 1 . 2]" 1
682 1 63 VAL H 1 65 ALA MB . . 4.500 4.602 4.549 4.643 0.143 11 0 "[ . 1 . 2]" 1
683 1 65 ALA MB 1 68 GLN QE . . 5.500 5.004 3.885 5.311 . 0 0 "[ . 1 . 2]" 1
684 1 65 ALA MB 1 66 CYS HA . . 4.500 4.142 4.020 4.197 . 0 0 "[ . 1 . 2]" 1
685 1 57 THR HB 1 58 VAL HB . . 5.500 4.894 3.609 5.623 0.123 3 0 "[ . 1 . 2]" 1
686 1 57 THR HB 1 85 ILE MD . . 4.500 4.228 3.467 4.500 0.000 14 0 "[ . 1 . 2]" 1
687 1 57 THR HB 1 85 ILE MG . . 5.500 4.217 3.109 4.722 . 0 0 "[ . 1 . 2]" 1
688 1 57 THR MG 1 58 VAL H . . 3.500 3.180 2.924 3.543 0.043 7 0 "[ . 1 . 2]" 1
689 1 57 THR MG 1 58 VAL HB . . 4.500 4.511 4.163 4.602 0.102 3 0 "[ . 1 . 2]" 1
690 1 57 THR MG 1 85 ILE MD . . 3.500 2.189 2.049 2.329 . 0 0 "[ . 1 . 2]" 1
691 1 57 THR MG 1 85 ILE MG . . 3.500 2.283 2.054 2.690 . 0 0 "[ . 1 . 2]" 1
692 1 58 VAL HA 1 85 ILE MG . . 5.500 4.554 4.116 4.902 . 0 0 "[ . 1 . 2]" 1
693 1 58 VAL QG 1 61 ALA H . . 5.500 4.053 3.693 4.524 . 0 0 "[ . 1 . 2]" 1
694 1 58 VAL QG 1 62 ILE H . . 5.500 3.459 2.825 4.162 . 0 0 "[ . 1 . 2]" 1
695 1 59 THR HA 1 60 PRO QD . . 5.500 3.670 3.661 3.681 . 0 0 "[ . 1 . 2]" 1
696 1 59 THR HA 1 62 ILE QG . . 5.500 3.754 2.535 5.036 . 0 0 "[ . 1 . 2]" 1
697 1 59 THR MG 1 63 VAL H . . 4.500 4.425 4.053 4.594 0.094 3 0 "[ . 1 . 2]" 1
698 1 59 THR MG 1 62 ILE H . . 5.500 5.316 5.126 5.503 0.003 1 0 "[ . 1 . 2]" 1
699 1 59 THR MG 1 61 ALA H . . 4.500 4.531 4.480 4.604 0.104 10 0 "[ . 1 . 2]" 1
700 1 60 PRO HA 1 61 ALA H . . 4.500 3.358 3.306 3.475 . 0 0 "[ . 1 . 2]" 1
701 1 59 THR MG 1 60 PRO HA . . 4.500 3.330 3.190 3.422 . 0 0 "[ . 1 . 2]" 1
702 1 60 PRO QG 1 61 ALA H . . 4.500 3.153 2.721 3.336 . 0 0 "[ . 1 . 2]" 1
703 1 61 ALA MB 1 63 VAL H . . 4.500 4.429 4.271 4.538 0.038 3 0 "[ . 1 . 2]" 1
704 1 58 VAL H 1 61 ALA MB . . 5.500 4.950 4.725 5.244 . 0 0 "[ . 1 . 2]" 1
705 1 62 ILE HA 1 63 VAL H . . 5.500 3.537 3.452 3.608 . 0 0 "[ . 1 . 2]" 1
706 1 62 ILE HA 1 81 GLU HG2 . . 4.500 3.206 2.756 3.621 . 0 0 "[ . 1 . 2]" 1
707 1 62 ILE MD 1 63 VAL H . . 4.500 4.152 3.572 4.532 0.032 5 0 "[ . 1 . 2]" 1
708 1 61 ALA H 1 62 ILE MD . . 5.500 3.988 3.523 4.495 . 0 0 "[ . 1 . 2]" 1
709 1 33 VAL HA 1 62 ILE MD . . 5.500 4.329 3.996 4.653 . 0 0 "[ . 1 . 2]" 1
710 1 62 ILE MD 1 81 GLU HG2 . . 4.500 4.107 3.054 4.942 0.442 10 0 "[ . 1 . 2]" 1
711 1 62 ILE MG 1 81 GLU HG2 . . 5.500 3.279 2.294 4.435 . 0 0 "[ . 1 . 2]" 1
712 1 22 LEU HG 1 66 CYS HB2 . . 5.500 4.273 3.664 6.137 0.637 20 1 "[ . 1 . +]" 1
713 1 22 LEU HG 1 66 CYS QB . . 5.500 3.223 2.394 5.136 . 0 0 "[ . 1 . 2]" 1
714 1 67 THR HA 1 68 GLN HA . . 5.500 4.840 4.637 4.908 . 0 0 "[ . 1 . 2]" 1
715 1 22 LEU QD 1 67 THR HB . . 5.500 2.544 2.424 2.745 . 0 0 "[ . 1 . 2]" 1
716 1 67 THR MG 1 68 GLN QG . . 5.500 3.001 2.777 3.577 . 0 0 "[ . 1 . 2]" 1
717 1 18 CYS H 1 70 LYS HA . . 4.500 4.190 3.659 4.355 . 0 0 "[ . 1 . 2]" 1
718 1 70 LYS QB 1 70 LYS HE3 . . 4.500 4.173 4.068 4.580 0.080 10 0 "[ . 1 . 2]" 1
719 1 22 LEU QD 1 70 LYS QB . . 5.500 3.864 3.592 4.291 . 0 0 "[ . 1 . 2]" 1
720 1 70 LYS H 1 70 LYS QD . . 2.800 2.698 1.943 2.883 0.083 15 0 "[ . 1 . 2]" 1
721 1 19 GLU HG3 1 70 LYS QD . . 5.500 4.205 3.130 5.952 0.452 15 0 "[ . 1 . 2]" 1
722 1 22 LEU QD 1 70 LYS QD . . 4.500 3.469 2.905 4.108 . 0 0 "[ . 1 . 2]" 1
723 1 70 LYS H 1 70 LYS HE3 . . 4.500 4.210 3.935 4.430 . 0 0 "[ . 1 . 2]" 1
724 1 71 GLN QB 1 72 ALA H . . 3.500 3.474 3.302 3.556 0.056 5 0 "[ . 1 . 2]" 1
725 1 70 LYS QG 1 71 GLN QG . . 4.500 4.591 4.519 4.645 0.145 16 0 "[ . 1 . 2]" 1
726 1 18 CYS H 1 72 ALA MB . . 5.500 3.828 3.354 4.207 . 0 0 "[ . 1 . 2]" 1
727 1 71 GLN HA 1 72 ALA MB . . 5.500 4.881 4.718 4.939 . 0 0 "[ . 1 . 2]" 1
728 1 18 CYS HB2 1 72 ALA MB . . 4.500 3.074 2.412 3.723 . 0 0 "[ . 1 . 2]" 1
729 1 73 ASN H 1 73 ASN QB . . 2.800 2.322 2.149 2.807 0.007 5 0 "[ . 1 . 2]" 1
730 1 74 PHE HA 1 77 LYS HB2 . . 4.500 3.779 2.514 5.277 0.777 5 2 "[ - + 1 . 2]" 1
731 1 74 PHE HA 1 78 VAL QG . . 5.500 4.511 3.960 5.549 0.049 20 0 "[ . 1 . 2]" 1
732 1 75 LYS H 1 75 LYS HG2 . . 4.500 4.645 4.404 5.072 0.572 1 2 "[+ - . 1 . 2]" 1
733 1 75 LYS HG2 1 76 ASP H . . 4.500 4.435 3.957 5.112 0.612 1 2 "[+ . 1 -. 2]" 1
734 1 81 GLU HA 1 82 TRP H . . 4.500 3.600 3.548 3.629 . 0 0 "[ . 1 . 2]" 1
735 1 77 LYS H 1 77 LYS QD . . 4.500 3.644 2.745 4.559 0.059 5 0 "[ . 1 . 2]" 1
736 1 78 VAL HA 1 79 LYS H . . 4.500 3.590 3.557 3.624 . 0 0 "[ . 1 . 2]" 1
737 1 78 VAL QG 1 81 GLU HB2 . . 5.500 4.551 3.997 5.614 0.114 5 0 "[ . 1 . 2]" 1
738 1 81 GLU H 1 81 GLU QB . . 2.800 2.442 2.358 2.535 . 0 0 "[ . 1 . 2]" 1
739 1 81 GLU QB 1 82 TRP H . . 3.500 2.846 2.737 2.998 . 0 0 "[ . 1 . 2]" 1
740 1 62 ILE HA 1 81 GLU QG . . 4.500 2.605 2.427 2.890 . 0 0 "[ . 1 . 2]" 1
741 1 82 TRP HA 1 85 ILE MD . . 4.500 3.383 2.997 4.082 . 0 0 "[ . 1 . 2]" 1
742 1 82 TRP HA 1 85 ILE MG . . 4.500 3.587 3.353 4.138 . 0 0 "[ . 1 . 2]" 1
743 1 82 TRP HA 1 85 ILE H . . 4.500 3.456 3.308 3.805 . 0 0 "[ . 1 . 2]" 1
744 1 78 VAL QG 1 82 TRP HB3 . . 5.500 4.677 4.012 5.487 . 0 0 "[ . 1 . 2]" 1
745 1 83 ASP HA 1 85 ILE H . . 4.500 4.136 3.958 4.264 . 0 0 "[ . 1 . 2]" 1
746 1 82 TRP HB3 1 83 ASP HA . . 4.500 4.500 4.307 4.555 0.055 9 0 "[ . 1 . 2]" 1
747 1 83 ASP QB 1 87 LYS HG2 . . 5.500 4.326 3.923 5.155 . 0 0 "[ . 1 . 2]" 1
748 1 83 ASP QB 1 84 LYS QB . . 4.500 4.008 3.899 4.207 . 0 0 "[ . 1 . 2]" 1
749 1 83 ASP QB 1 84 LYS H . . 2.800 2.567 2.490 2.650 . 0 0 "[ . 1 . 2]" 1
750 1 84 LYS HA 1 88 ASP QB . . 4.500 3.016 2.164 4.534 0.034 6 0 "[ . 1 . 2]" 1
751 1 84 LYS QB 1 85 ILE QG . . 5.500 4.021 2.358 4.404 . 0 0 "[ . 1 . 2]" 1
752 1 5 LYS H 1 5 LYS HD2 . . 4.500 4.455 3.205 5.220 0.720 20 3 "[- . 1 * +]" 1
753 1 86 LYS HA 1 88 ASP H . . 4.500 4.558 4.507 4.630 0.130 11 0 "[ . 1 . 2]" 1
754 1 85 ILE H 1 86 LYS HA . . 5.500 5.257 5.053 5.329 . 0 0 "[ . 1 . 2]" 1
755 1 85 ILE MG 1 86 LYS HA . . 4.500 3.430 3.253 3.636 . 0 0 "[ . 1 . 2]" 1
756 1 83 ASP HA 1 86 LYS QB . . 4.500 3.542 3.286 3.648 . 0 0 "[ . 1 . 2]" 1
757 1 83 ASP QB 1 86 LYS QB . . 5.500 5.289 5.061 5.362 . 0 0 "[ . 1 . 2]" 1
758 1 77 LYS H 1 77 LYS QG . . 4.500 3.907 2.540 4.135 . 0 0 "[ . 1 . 2]" 1
759 1 85 ILE H 1 86 LYS QG . . 4.500 4.034 3.763 4.133 . 0 0 "[ . 1 . 2]" 1
760 1 85 ILE MG 1 86 LYS QG . . 4.500 2.129 2.081 2.173 . 0 0 "[ . 1 . 2]" 1
761 1 86 LYS HA 1 86 LYS HD2 . . 3.500 2.561 2.327 3.180 . 0 0 "[ . 1 . 2]" 1
762 1 69 ASP HA 1 77 LYS QE . . 5.500 5.437 4.765 5.563 0.063 20 0 "[ . 1 . 2]" 1
763 1 86 LYS QG 1 87 LYS HA . . 5.500 5.572 5.532 5.640 0.140 2 0 "[ . 1 . 2]" 1
764 1 21 PHE H 1 70 LYS HA . . 5.500 5.581 5.562 5.614 0.114 5 0 "[ . 1 . 2]" 1
765 1 26 GLU QB 1 29 GLN QB . . 5.500 4.244 4.110 4.533 . 0 0 "[ . 1 . 2]" 1
766 1 58 VAL HB 1 61 ALA MB . . 5.500 4.195 2.984 4.724 . 0 0 "[ . 1 . 2]" 1
767 1 14 ASN HA 1 75 LYS HB2 . . 4.500 3.030 2.306 4.644 0.144 14 0 "[ . 1 . 2]" 1
768 1 52 VAL QG 1 55 ILE MD . . 4.500 3.983 3.549 4.428 . 0 0 "[ . 1 . 2]" 1
769 1 71 GLN QG 1 72 ALA H . . 4.500 4.426 4.345 4.521 0.021 7 0 "[ . 1 . 2]" 1
770 1 13 VAL QG 1 35 PHE HB2 . . 5.500 3.376 2.538 4.728 . 0 0 "[ . 1 . 2]" 1
771 1 13 VAL HA 1 15 SER H . . 5.500 3.916 3.610 4.340 . 0 0 "[ . 1 . 2]" 1
772 1 18 CYS H 1 19 GLU H . . 3.500 2.897 2.601 3.085 . 0 0 "[ . 1 . 2]" 1
773 1 17 THR HB 1 18 CYS H . . 2.800 2.338 2.165 2.708 . 0 0 "[ . 1 . 2]" 1
774 1 14 ASN H 1 15 SER H . . 3.500 2.494 2.207 2.741 . 0 0 "[ . 1 . 2]" 1
775 1 65 ALA H 1 66 CYS H . . 2.800 2.862 2.842 2.878 0.078 1 0 "[ . 1 . 2]" 1
776 1 66 CYS H 1 67 THR H . . 2.800 2.730 2.676 2.823 0.023 7 0 "[ . 1 . 2]" 1
777 1 26 GLU H 1 26 GLU QB . . 2.800 2.711 2.689 2.764 . 0 0 "[ . 1 . 2]" 1
778 1 63 VAL H 1 64 GLN H . . 2.800 2.821 2.756 2.849 0.049 11 0 "[ . 1 . 2]" 1
779 1 82 TRP H 1 83 ASP H . . 2.800 2.709 2.590 2.767 . 0 0 "[ . 1 . 2]" 1
780 1 81 GLU H 1 82 TRP H . . 2.800 2.786 2.712 2.822 0.022 18 0 "[ . 1 . 2]" 1
781 1 1 ALA HA 1 2 ASP H . . 3.500 2.501 2.176 3.601 0.101 13 0 "[ . 1 . 2]" 1
782 1 2 ASP H 1 2 ASP QB . . 3.500 2.566 2.174 3.327 . 0 0 "[ . 1 . 2]" 1
783 1 46 GLU H 1 47 ASP H . . 2.800 2.729 2.492 2.814 0.014 19 0 "[ . 1 . 2]" 1
784 1 33 VAL H 1 34 GLY H . . 3.500 2.686 2.553 2.826 . 0 0 "[ . 1 . 2]" 1
785 1 64 GLN H 1 66 CYS H . . 4.500 4.235 4.077 4.335 . 0 0 "[ . 1 . 2]" 1
786 1 66 CYS H 1 68 GLN H . . 5.500 4.168 4.093 4.341 . 0 0 "[ . 1 . 2]" 1
787 1 26 GLU H 1 27 SER H . . 2.800 2.661 2.591 2.795 . 0 0 "[ . 1 . 2]" 1
788 1 2 ASP HA 1 3 ALA H . . 3.500 3.057 2.199 3.571 0.071 19 0 "[ . 1 . 2]" 1
789 1 6 ALA H 1 6 ALA MB . . 2.800 2.369 2.106 2.785 . 0 0 "[ . 1 . 2]" 1
790 1 5 LYS HB2 1 6 ALA H . . 4.500 3.885 2.289 4.528 0.028 5 0 "[ . 1 . 2]" 1
791 1 31 THR HA 1 32 ALA H . . 3.500 3.555 3.537 3.567 0.067 9 0 "[ . 1 . 2]" 1
792 1 31 THR H 1 32 ALA H . . 2.800 2.490 2.336 2.627 . 0 0 "[ . 1 . 2]" 1
793 1 15 SER HA 1 16 TRP H . . 3.500 3.487 2.659 3.595 0.095 9 0 "[ . 1 . 2]" 1
794 1 15 SER H 1 16 TRP H . . 2.800 2.139 1.945 2.629 . 0 0 "[ . 1 . 2]" 1
795 1 52 VAL H 1 52 VAL QG . . 3.500 1.992 1.895 2.171 . 0 0 "[ . 1 . 2]" 1
796 1 52 VAL H 1 52 VAL HB . . 3.500 2.874 2.501 2.992 . 0 0 "[ . 1 . 2]" 1
797 1 52 VAL H 1 52 VAL HA . . 2.800 2.811 2.739 2.868 0.068 20 0 "[ . 1 . 2]" 1
798 1 88 ASP H 1 89 MET H . . 2.800 2.857 2.802 2.998 0.198 5 0 "[ . 1 . 2]" 1
799 1 28 PHE H 1 29 GLN H . . 2.800 2.113 2.073 2.166 . 0 0 "[ . 1 . 2]" 1
800 1 47 ASP HA 1 48 ALA H . . 3.500 3.212 2.985 3.500 . 0 0 "[ . 1 . 2]" 1
801 1 47 ASP H 1 48 ALA H . . 2.800 2.549 2.113 2.725 . 0 0 "[ . 1 . 2]" 1
802 1 34 GLY HA2 1 35 PHE H . . 4.500 3.607 3.128 3.697 . 0 0 "[ . 1 . 2]" 1
803 1 32 ALA HA 1 35 PHE H . . 4.500 3.365 3.067 3.852 . 0 0 "[ . 1 . 2]" 1
804 1 35 PHE H 1 36 ALA H . . 2.800 2.754 2.274 2.869 0.069 15 0 "[ . 1 . 2]" 1
805 1 34 GLY H 1 35 PHE H . . 3.500 3.159 3.064 3.269 . 0 0 "[ . 1 . 2]" 1
806 1 55 ILE H 1 55 ILE MD . . 3.500 2.900 1.963 3.475 . 0 0 "[ . 1 . 2]" 1
807 1 52 VAL HA 1 55 ILE H . . 3.500 3.156 2.918 3.559 0.059 1 0 "[ . 1 . 2]" 1
808 1 54 GLY H 1 55 ILE H . . 2.800 2.666 2.517 2.810 0.010 1 0 "[ . 1 . 2]" 1
809 1 62 ILE HA 1 65 ALA H . . 3.500 3.375 3.178 3.538 0.038 4 0 "[ . 1 . 2]" 1
810 1 64 GLN H 1 65 ALA H . . 2.800 2.550 2.445 2.653 . 0 0 "[ . 1 . 2]" 1
811 1 5 LYS H 1 5 LYS QB . . 3.500 2.786 2.478 3.453 . 0 0 "[ . 1 . 2]" 1
812 1 10 LYS HA 1 11 LYS H . . 3.500 2.881 2.064 3.549 0.049 14 0 "[ . 1 . 2]" 1
813 1 62 ILE H 1 63 VAL H . . 2.800 2.746 2.602 2.826 0.026 14 0 "[ . 1 . 2]" 1
814 1 77 LYS H 1 77 LYS HG3 . . 4.500 4.409 3.629 4.595 0.095 2 0 "[ . 1 . 2]" 1
815 1 77 LYS H 1 77 LYS HA . . 2.800 2.881 2.847 2.891 0.091 2 0 "[ . 1 . 2]" 1
816 1 76 ASP HA 1 77 LYS H . . 4.500 3.588 3.553 3.615 . 0 0 "[ . 1 . 2]" 1
817 1 77 LYS H 1 78 VAL H . . 2.800 2.763 2.586 2.837 0.037 5 0 "[ . 1 . 2]" 1
818 1 76 ASP H 1 77 LYS H . . 2.800 2.796 2.688 2.829 0.029 20 0 "[ . 1 . 2]" 1
819 1 85 ILE H 1 86 LYS H . . 2.800 2.524 2.285 2.620 . 0 0 "[ . 1 . 2]" 1
820 1 37 GLU H 1 38 ALA H . . 2.800 2.596 2.339 2.802 0.002 8 0 "[ . 1 . 2]" 1
821 1 61 ALA H 1 62 ILE H . . 2.800 2.532 2.321 2.803 0.003 10 0 "[ . 1 . 2]" 1
822 1 70 LYS H 1 71 GLN H . . 2.800 2.826 2.771 2.875 0.075 8 0 "[ . 1 . 2]" 1
823 1 24 VAL H 1 25 ASP H . . 4.500 4.479 2.878 4.580 0.080 9 0 "[ . 1 . 2]" 1
824 1 23 ALA H 1 24 VAL H . . 2.800 2.373 2.197 2.597 . 0 0 "[ . 1 . 2]" 1
825 1 71 GLN H 1 72 ALA H . . 2.800 2.662 2.523 2.727 . 0 0 "[ . 1 . 2]" 1
826 1 71 GLN HA 1 72 ALA H . . 3.500 3.356 3.266 3.437 . 0 0 "[ . 1 . 2]" 1
827 1 18 CYS HB2 1 72 ALA H . . 4.500 3.060 2.822 3.381 . 0 0 "[ . 1 . 2]" 1
828 1 10 LYS H 1 10 LYS QB . . 3.500 2.851 2.330 3.389 . 0 0 "[ . 1 . 2]" 1
829 1 10 LYS H 1 10 LYS HA . . 2.800 2.783 2.238 2.955 0.155 11 0 "[ . 1 . 2]" 1
830 1 9 ASN HA 1 10 LYS H . . 3.500 3.244 2.433 3.591 0.091 14 0 "[ . 1 . 2]" 1
831 1 10 LYS H 1 11 LYS H . . 4.500 3.548 2.499 4.510 0.010 19 0 "[ . 1 . 2]" 1
832 1 19 GLU H 1 70 LYS QB . . 3.500 3.394 3.103 3.517 0.017 13 0 "[ . 1 . 2]" 1
833 1 17 THR HB 1 19 GLU H . . 3.500 2.795 2.333 3.105 . 0 0 "[ . 1 . 2]" 1
834 1 19 GLU H 1 20 ASP H . . 2.800 2.813 2.723 2.846 0.046 14 0 "[ . 1 . 2]" 1
835 1 43 ASP QB 1 44 LYS H . . 4.500 2.605 1.996 3.842 . 0 0 "[ . 1 . 2]" 1
836 1 75 LYS H 1 76 ASP H . . 3.500 2.940 2.270 3.575 0.075 6 0 "[ . 1 . 2]" 1
837 1 42 LYS H 1 42 LYS QB . . 3.500 3.270 3.113 3.383 . 0 0 "[ . 1 . 2]" 1
838 1 41 ASN H 1 42 LYS H . . 2.800 2.544 2.305 2.740 . 0 0 "[ . 1 . 2]" 1
839 1 42 LYS H 1 43 ASP H . . 3.500 3.689 3.585 3.814 0.314 16 0 "[ . 1 . 2]" 1
840 1 64 GLN H 1 64 GLN QB . . 2.800 2.641 2.550 2.682 . 0 0 "[ . 1 . 2]" 1
841 1 86 LYS QG 1 87 LYS H . . 3.500 3.628 3.601 3.668 0.168 14 0 "[ . 1 . 2]" 1
842 1 86 LYS QB 1 87 LYS H . . 2.800 2.106 2.044 2.149 . 0 0 "[ . 1 . 2]" 1
843 1 87 LYS H 1 87 LYS HB2 . . 2.800 2.391 2.201 2.466 . 0 0 "[ . 1 . 2]" 1
844 1 87 LYS H 1 87 LYS HA . . 2.800 2.847 2.834 2.863 0.063 2 0 "[ . 1 . 2]" 1
845 1 7 ALA MB 1 9 ASN H . . 4.500 3.528 2.609 4.652 0.152 1 0 "[ . 1 . 2]" 1
846 1 53 GLN H 1 54 GLY H . . 2.800 2.790 2.711 2.844 0.044 3 0 "[ . 1 . 2]" 1
847 1 52 VAL HB 1 53 GLN H . . 4.500 4.293 2.468 4.547 0.047 18 0 "[ . 1 . 2]" 1
848 1 41 ASN H 1 42 LYS QG . . 3.500 3.561 3.511 3.597 0.097 17 0 "[ . 1 . 2]" 1
849 1 19 GLU QB 1 20 ASP H . . 2.800 2.623 2.450 2.804 0.004 20 0 "[ . 1 . 2]" 1
850 1 41 ASN H 1 41 ASN HA . . 2.800 2.932 2.904 2.954 0.154 9 0 "[ . 1 . 2]" 1
851 1 41 ASN H 1 41 ASN QD . . 2.800 2.675 2.477 2.818 0.018 13 0 "[ . 1 . 2]" 1
852 1 69 ASP H 1 70 LYS H . . 3.500 3.340 3.134 3.548 0.048 9 0 "[ . 1 . 2]" 1
853 1 21 PHE H 1 22 LEU H . . 3.500 2.522 2.335 2.679 . 0 0 "[ . 1 . 2]" 1
854 1 20 ASP H 1 21 PHE H . . 3.500 2.707 2.428 3.006 . 0 0 "[ . 1 . 2]" 1
855 1 68 GLN HA 1 69 ASP H . . 3.500 3.567 3.472 3.605 0.105 1 0 "[ . 1 . 2]" 1
856 1 69 ASP H 1 69 ASP QB . . 2.800 2.614 2.407 2.788 . 0 0 "[ . 1 . 2]" 1
857 1 68 GLN HG2 1 69 ASP H . . 4.500 4.237 2.719 5.013 0.513 9 1 "[ . +1 . 2]" 1
858 1 68 GLN HB2 1 69 ASP H . . 3.500 2.772 2.547 3.951 0.451 4 0 "[ . 1 . 2]" 1
859 1 68 GLN QB 1 69 ASP H . . 3.500 2.688 2.497 3.579 0.079 4 0 "[ . 1 . 2]" 1
860 1 69 ASP H 1 77 LYS QD . . 4.500 4.518 4.022 4.603 0.103 5 0 "[ . 1 . 2]" 1
861 1 18 CYS HA 1 21 PHE H . . 4.500 2.998 2.525 3.402 . 0 0 "[ . 1 . 2]" 1
862 1 69 ASP H 1 70 LYS HA . . 4.500 4.547 4.486 4.617 0.117 3 0 "[ . 1 . 2]" 1
863 1 23 ALA H 1 24 VAL QG . . 3.500 3.477 3.208 3.575 0.075 2 0 "[ . 1 . 2]" 1
864 1 22 LEU H 1 23 ALA H . . 2.800 2.390 2.035 2.812 0.012 7 0 "[ . 1 . 2]" 1
865 1 81 GLU H 1 81 GLU HB2 . . 2.800 2.483 2.394 2.586 . 0 0 "[ . 1 . 2]" 1
866 1 58 VAL H 1 59 THR H . . 3.500 2.585 2.372 2.700 . 0 0 "[ . 1 . 2]" 1
867 1 87 LYS HA 1 88 ASP H . . 3.500 3.483 3.465 3.500 0.000 17 0 "[ . 1 . 2]" 1
868 1 7 ALA MB 1 8 ASP H . . 3.500 3.002 2.164 3.598 0.098 20 0 "[ . 1 . 2]" 1
869 1 8 ASP H 1 8 ASP HA . . 2.800 2.429 2.124 2.883 0.083 1 0 "[ . 1 . 2]" 1
870 1 27 SER H 1 28 PHE H . . 2.800 2.796 2.717 2.826 0.026 17 0 "[ . 1 . 2]" 1
871 1 78 VAL H 1 79 LYS H . . 2.800 2.741 2.598 2.839 0.039 7 0 "[ . 1 . 2]" 1
872 1 79 LYS H 1 80 GLY H . . 2.800 2.788 2.682 2.823 0.023 12 0 "[ . 1 . 2]" 1
873 1 76 ASP HA 1 79 LYS H . . 4.500 3.542 3.117 3.787 . 0 0 "[ . 1 . 2]" 1
874 1 79 LYS H 1 79 LYS QD . . 3.500 3.532 3.386 3.588 0.088 5 0 "[ . 1 . 2]" 1
875 1 84 LYS H 1 84 LYS QB . . 2.800 2.198 1.932 2.321 . 0 0 "[ . 1 . 2]" 1
876 1 84 LYS H 1 84 LYS HA . . 2.800 2.836 2.768 2.856 0.056 8 0 "[ . 1 . 2]" 1
877 1 83 ASP H 1 84 LYS H . . 2.800 2.817 2.808 2.830 0.030 5 0 "[ . 1 . 2]" 1
878 1 84 LYS H 1 86 LYS H . . 4.500 4.497 4.458 4.530 0.030 19 0 "[ . 1 . 2]" 1
879 1 36 ALA H 1 37 GLU H . . 2.800 2.653 2.392 2.816 0.016 20 0 "[ . 1 . 2]" 1
880 1 67 THR H 1 68 GLN H . . 2.800 2.262 2.207 2.419 . 0 0 "[ . 1 . 2]" 1
881 1 36 ALA MB 1 37 GLU H . . 2.800 2.614 2.354 2.827 0.027 1 0 "[ . 1 . 2]" 1
882 1 84 LYS QG 1 85 ILE H . . 4.500 2.826 2.472 4.404 . 0 0 "[ . 1 . 2]" 1
883 1 84 LYS H 1 85 ILE H . . 2.800 2.753 2.692 2.842 0.042 12 0 "[ . 1 . 2]" 1
884 1 66 CYS HA 1 67 THR H . . 4.500 3.493 3.437 3.530 . 0 0 "[ . 1 . 2]" 1
885 1 22 LEU QD 1 67 THR H . . 4.500 3.154 2.882 3.448 . 0 0 "[ . 1 . 2]" 1
886 1 46 GLU QB 1 47 ASP H . . 3.500 2.974 2.648 3.580 0.080 1 0 "[ . 1 . 2]" 1
887 1 79 LYS HA 1 83 ASP H . . 4.500 4.035 3.878 4.262 . 0 0 "[ . 1 . 2]" 1
888 1 83 ASP H 1 83 ASP HA . . 2.800 2.829 2.799 2.851 0.051 2 0 "[ . 1 . 2]" 1
889 1 38 ALA H 1 39 LEU H . . 2.800 2.773 2.507 2.845 0.045 15 0 "[ . 1 . 2]" 1
890 1 39 LEU H 1 40 ASN H . . 2.800 2.585 2.436 2.730 . 0 0 "[ . 1 . 2]" 1
891 1 39 LEU H 1 39 LEU HA . . 2.800 2.896 2.847 2.929 0.129 2 0 "[ . 1 . 2]" 1
892 1 40 ASN H 1 40 ASN HB2 . . 2.800 2.512 2.247 3.613 0.813 2 1 "[ + . 1 . 2]" 1
893 1 15 SER H 1 15 SER HA . . 2.800 2.949 2.908 2.964 0.164 7 0 "[ . 1 . 2]" 1
894 1 31 THR H 1 31 THR HA . . 2.800 2.907 2.861 2.924 0.124 3 0 "[ . 1 . 2]" 1
895 1 31 THR H 1 31 THR HB . . 2.800 2.393 2.302 2.513 . 0 0 "[ . 1 . 2]" 1
896 1 70 LYS QB 1 71 GLN H . . 3.500 2.649 2.544 2.814 . 0 0 "[ . 1 . 2]" 1
897 1 71 GLN H 1 71 GLN QB . . 2.800 2.411 2.288 2.455 . 0 0 "[ . 1 . 2]" 1
898 1 57 THR H 1 57 THR HA . . 2.800 2.845 2.819 2.872 0.072 20 0 "[ . 1 . 2]" 1
899 1 57 THR H 1 58 VAL H . . 2.800 2.695 2.540 2.807 0.007 6 0 "[ . 1 . 2]" 1
900 1 27 SER H 1 29 GLN H . . 4.500 4.196 4.064 4.333 . 0 0 "[ . 1 . 2]" 1
901 1 25 ASP HA 1 27 SER H . . 4.500 4.240 4.057 4.415 . 0 0 "[ . 1 . 2]" 1
902 1 27 SER H 1 27 SER HA . . 2.800 2.837 2.818 2.860 0.060 7 0 "[ . 1 . 2]" 1
903 1 25 ASP QB 1 27 SER H . . 2.800 2.842 2.759 2.902 0.102 4 0 "[ . 1 . 2]" 1
904 1 26 GLU QB 1 27 SER H . . 2.800 2.635 2.534 2.783 . 0 0 "[ . 1 . 2]" 1
905 1 70 LYS QB 1 71 GLN QE . . 5.500 4.458 3.258 5.364 . 0 0 "[ . 1 . 2]" 1
906 1 73 ASN HB2 1 73 ASN QD . . 2.800 2.540 2.183 3.377 0.577 16 3 "[* . -1 .+ 2]" 1
907 1 13 VAL H 1 14 ASN H . . 4.500 2.952 2.704 3.136 . 0 0 "[ . 1 . 2]" 1
908 1 12 PRO QB 1 13 VAL H . . 4.500 2.751 2.529 3.114 . 0 0 "[ . 1 . 2]" 1
909 1 51 ASP HA 1 53 GLN H . . 4.500 3.843 3.287 4.543 0.043 12 0 "[ . 1 . 2]" 1
910 1 1 ALA MB 1 2 ASP H . . 4.500 2.699 2.044 3.634 . 0 0 "[ . 1 . 2]" 1
911 1 14 ASN HA 1 15 SER H . . 4.500 3.380 3.073 3.564 . 0 0 "[ . 1 . 2]" 1
912 1 16 TRP H 1 17 THR H . . 4.500 4.575 4.427 4.648 0.148 11 0 "[ . 1 . 2]" 1
913 1 18 CYS H 1 72 ALA H . . 4.500 3.765 3.575 4.020 . 0 0 "[ . 1 . 2]" 1
914 1 19 GLU H 1 21 PHE H . . 5.500 4.029 3.638 4.480 . 0 0 "[ . 1 . 2]" 1
915 1 17 THR H 1 20 ASP H . . 4.500 4.199 3.429 4.566 0.066 9 0 "[ . 1 . 2]" 1
916 1 21 PHE H 1 23 ALA H . . 4.500 3.976 3.812 4.177 . 0 0 "[ . 1 . 2]" 1
917 1 22 LEU HA 1 24 VAL H . . 4.500 4.166 3.654 4.503 0.003 20 0 "[ . 1 . 2]" 1
918 1 22 LEU H 1 24 VAL H . . 5.500 4.137 3.808 4.765 . 0 0 "[ . 1 . 2]" 1
919 1 26 GLU H 1 27 SER QB . . 4.500 4.561 4.508 4.586 0.086 3 0 "[ . 1 . 2]" 1
920 1 26 GLU H 1 28 PHE H . . 4.500 4.220 4.126 4.329 . 0 0 "[ . 1 . 2]" 1
921 1 33 VAL H 1 55 ILE QG . . 5.500 5.390 5.081 5.544 0.044 1 0 "[ . 1 . 2]" 1
922 1 36 ALA H 1 38 ALA H . . 4.500 4.106 3.738 4.440 . 0 0 "[ . 1 . 2]" 1
923 1 37 GLU H 1 38 ALA MB . . 5.500 4.215 3.975 4.427 . 0 0 "[ . 1 . 2]" 1
924 1 38 ALA H 1 41 ASN QD . . 4.500 4.408 3.972 4.590 0.090 9 0 "[ . 1 . 2]" 1
925 1 38 ALA H 1 40 ASN H . . 4.500 4.028 3.834 4.240 . 0 0 "[ . 1 . 2]" 1
926 1 43 ASP H 1 44 LYS QG . . 5.500 4.807 4.408 5.166 . 0 0 "[ . 1 . 2]" 1
927 1 42 LYS QB 1 43 ASP H . . 4.500 2.216 1.774 2.654 . 0 0 "[ . 1 . 2]" 1
928 1 44 LYS HA 1 46 GLU H . . 4.500 4.223 4.053 4.336 . 0 0 "[ . 1 . 2]" 1
929 1 46 GLU QG 1 47 ASP H . . 4.500 3.936 2.352 4.313 . 0 0 "[ . 1 . 2]" 1
930 1 48 ALA H 1 49 VAL H . . 4.500 4.486 4.333 4.596 0.096 11 0 "[ . 1 . 2]" 1
931 1 50 LEU H 1 51 ASP H . . 5.500 4.180 3.643 4.692 . 0 0 "[ . 1 . 2]" 1
932 1 54 GLY HA2 1 55 ILE H . . 4.500 3.593 3.514 3.625 . 0 0 "[ . 1 . 2]" 1
933 1 30 PRO HB3 1 59 THR H . . 5.500 5.184 4.956 5.438 . 0 0 "[ . 1 . 2]" 1
934 1 61 ALA H 1 63 VAL H . . 4.500 3.575 3.364 3.858 . 0 0 "[ . 1 . 2]" 1
935 1 61 ALA H 1 62 ILE QG . . 5.500 4.057 3.579 4.441 . 0 0 "[ . 1 . 2]" 1
936 1 61 ALA HA 1 65 ALA H . . 5.500 4.016 3.786 4.316 . 0 0 "[ . 1 . 2]" 1
937 1 66 CYS HB2 1 67 THR H . . 4.500 3.531 3.397 3.694 . 0 0 "[ . 1 . 2]" 1
938 1 67 THR H 1 69 ASP H . . 4.500 3.857 3.703 4.095 . 0 0 "[ . 1 . 2]" 1
939 1 18 CYS QB 1 72 ALA H . . 4.500 3.007 2.773 3.319 . 0 0 "[ . 1 . 2]" 1
940 1 69 ASP HA 1 72 ALA H . . 5.500 4.228 3.953 4.446 . 0 0 "[ . 1 . 2]" 1
941 1 70 LYS H 1 72 ALA H . . 4.500 4.429 4.274 4.560 0.060 6 0 "[ . 1 . 2]" 1
942 1 72 ALA H 1 73 ASN H . . 4.500 4.514 3.089 4.625 0.125 10 0 "[ . 1 . 2]" 1
943 1 74 PHE H 1 75 LYS H . . 4.500 3.559 2.798 4.619 0.119 6 0 "[ . 1 . 2]" 1
944 1 18 CYS H 1 74 PHE H . . 5.500 4.252 3.177 5.313 . 0 0 "[ . 1 . 2]" 1
945 1 74 PHE H 1 74 PHE QB . . 3.500 2.372 2.041 3.384 . 0 0 "[ . 1 . 2]" 1
946 1 74 PHE QB 1 75 LYS H . . 4.500 2.675 1.665 3.856 . 0 0 "[ . 1 . 2]" 1
947 1 77 LYS H 1 78 VAL QG . . 4.500 3.999 3.766 4.319 . 0 0 "[ . 1 . 2]" 1
948 1 75 LYS HA 1 77 LYS H . . 4.500 4.100 3.630 4.469 . 0 0 "[ . 1 . 2]" 1
949 1 81 GLU HB2 1 82 TRP H . . 4.500 2.941 2.816 3.110 . 0 0 "[ . 1 . 2]" 1
950 1 82 TRP H 1 84 LYS H . . 4.500 4.247 4.104 4.300 . 0 0 "[ . 1 . 2]" 1
951 1 84 LYS H 1 87 LYS QB . . 4.500 4.668 4.640 4.689 0.189 16 0 "[ . 1 . 2]" 1
952 1 84 LYS H 1 85 ILE QG . . 5.500 4.810 4.586 5.238 . 0 0 "[ . 1 . 2]" 1
953 1 83 ASP H 1 85 ILE H . . 5.500 4.089 3.995 4.289 . 0 0 "[ . 1 . 2]" 1
954 1 86 LYS H 1 88 ASP H . . 4.500 3.798 3.615 3.915 . 0 0 "[ . 1 . 2]" 1
955 1 83 ASP HA 1 86 LYS H . . 4.500 3.587 3.453 3.677 . 0 0 "[ . 1 . 2]" 1
956 1 83 ASP HA 1 88 ASP H . . 4.500 4.106 3.960 4.199 . 0 0 "[ . 1 . 2]" 1
957 1 40 ASN HA 1 41 ASN H . . 3.500 3.516 3.465 3.555 0.055 8 0 "[ . 1 . 2]" 1
958 1 41 ASN QD 1 42 LYS QG . . 5.500 4.494 3.163 5.113 . 0 0 "[ . 1 . 2]" 1
959 1 24 VAL H 1 29 GLN HG2 . . 5.500 4.904 4.521 5.307 . 0 0 "[ . 1 . 2]" 1
960 2 71 GLN H 2 71 GLN QG . . 2.800 2.286 2.191 2.381 . 0 0 "[ . 1 . 2]" 1
961 2 4 GLN H 2 4 GLN QG . . 2.800 2.658 2.115 2.891 0.091 10 0 "[ . 1 . 2]" 1
962 2 11 LYS H 2 11 LYS HB2 . . 3.500 3.149 2.458 3.903 0.403 13 0 "[ . 1 . 2]" 1
963 2 79 LYS H 2 79 LYS HB2 . . 2.800 2.401 2.357 2.489 . 0 0 "[ . 1 . 2]" 1
964 2 64 GLN QB 2 65 ALA H . . 2.800 2.519 2.424 2.603 . 0 0 "[ . 1 . 2]" 1
965 2 26 GLU H 2 26 GLU HB2 . . 2.800 2.802 2.768 2.851 0.051 15 0 "[ . 1 . 2]" 1
966 2 53 GLN H 2 53 GLN QB . . 2.800 2.227 2.127 2.382 . 0 0 "[ . 1 . 2]" 1
967 2 33 VAL H 2 33 VAL QG . . 2.800 2.142 2.032 2.503 . 0 0 "[ . 1 . 2]" 1
968 2 13 VAL H 2 13 VAL QG . . 2.800 1.933 1.898 1.979 . 0 0 "[ . 1 . 2]" 1
969 2 24 VAL H 2 24 VAL QG . . 2.800 1.971 1.863 2.152 . 0 0 "[ . 1 . 2]" 1
970 2 78 VAL H 2 78 VAL QG . . 2.800 2.151 1.956 2.336 . 0 0 "[ . 1 . 2]" 1
971 2 63 VAL H 2 63 VAL QG . . 2.800 2.306 1.937 2.520 . 0 0 "[ . 1 . 2]" 1
972 2 58 VAL H 2 58 VAL MG1 . . 4.500 3.690 3.648 3.849 . 0 0 "[ . 1 . 2]" 1
973 2 24 VAL QG 2 25 ASP H . . 2.800 2.474 2.352 2.847 0.047 17 0 "[ . 1 . 2]" 1
974 2 58 VAL H 2 58 VAL MG2 . . 2.800 2.469 2.104 2.558 . 0 0 "[ . 1 . 2]" 1
975 2 52 VAL QG 2 53 GLN H . . 3.500 2.837 2.516 3.198 . 0 0 "[ . 1 . 2]" 1
976 2 49 VAL H 2 49 VAL QG . . 2.800 2.416 2.106 2.642 . 0 0 "[ . 1 . 2]" 1
977 2 13 VAL QG 2 14 ASN HD22 . . 3.500 2.858 2.346 4.382 0.882 1 2 "[+ -. 1 . 2]" 1
978 2 72 ALA MB 2 73 ASN H . . 2.800 2.577 2.330 2.838 0.038 2 0 "[ . 1 . 2]" 1
979 2 72 ALA H 2 72 ALA MB . . 2.800 2.214 2.175 2.248 . 0 0 "[ . 1 . 2]" 1
980 2 48 ALA H 2 48 ALA MB . . 2.800 2.255 2.176 2.344 . 0 0 "[ . 1 . 2]" 1
981 2 3 ALA H 2 3 ALA MB . . 2.800 2.522 2.183 2.858 0.058 3 0 "[ . 1 . 2]" 1
982 2 23 ALA MB 2 24 VAL H . . 2.800 2.760 2.528 2.817 0.017 14 0 "[ . 1 . 2]" 1
983 2 23 ALA H 2 23 ALA MB . . 2.800 2.241 2.174 2.310 . 0 0 "[ . 1 . 2]" 1
984 2 65 ALA MB 2 66 CYS H . . 2.800 2.780 2.647 2.829 0.029 7 0 "[ . 1 . 2]" 1
985 2 65 ALA H 2 65 ALA MB . . 2.800 2.169 2.129 2.223 . 0 0 "[ . 1 . 2]" 1
986 2 56 ALA MB 2 57 THR H . . 2.800 2.720 2.584 2.822 0.022 5 0 "[ . 1 . 2]" 1
987 2 65 ALA MB 2 68 GLN H . . 4.500 4.499 4.415 4.644 0.144 15 0 "[ . 1 . 2]" 1
988 2 32 ALA H 2 32 ALA MB . . 2.800 2.204 2.171 2.227 . 0 0 "[ . 1 . 2]" 1
989 2 36 ALA H 2 36 ALA MB . . 2.800 2.275 2.167 2.357 . 0 0 "[ . 1 . 2]" 1
990 2 38 ALA H 2 38 ALA MB . . 2.800 2.178 2.107 2.244 . 0 0 "[ . 1 . 2]" 1
991 2 38 ALA MB 2 39 LEU H . . 2.800 2.461 2.307 2.571 . 0 0 "[ . 1 . 2]" 1
992 2 61 ALA MB 2 62 ILE H . . 2.800 2.381 2.307 2.480 . 0 0 "[ . 1 . 2]" 1
993 2 61 ALA H 2 61 ALA MB . . 2.800 2.253 2.210 2.289 . 0 0 "[ . 1 . 2]" 1
994 2 85 ILE H 2 85 ILE MG . . 3.500 3.556 3.501 3.587 0.087 1 0 "[ . 1 . 2]" 1
995 2 57 THR H 2 57 THR HB . . 2.800 2.335 2.156 2.459 . 0 0 "[ . 1 . 2]" 1
996 2 27 SER H 2 27 SER QB . . 2.800 2.368 2.200 2.446 . 0 0 "[ . 1 . 2]" 1
997 2 85 ILE HA 2 86 LYS H . . 3.500 3.537 3.512 3.569 0.069 12 0 "[ . 1 . 2]" 1
998 2 26 GLU H 2 26 GLU HA . . 2.800 2.827 2.804 2.847 0.047 20 0 "[ . 1 . 2]" 1
999 2 53 GLN H 2 53 GLN HA . . 2.800 2.844 2.809 2.874 0.074 19 0 "[ . 1 . 2]" 1
1000 2 86 LYS HA 2 87 LYS H . . 3.500 3.502 3.489 3.513 0.013 5 0 "[ . 1 . 2]" 1
1001 2 83 ASP HA 2 87 LYS H . . 2.800 2.631 2.481 2.808 0.008 14 0 "[ . 1 . 2]" 1
1002 2 65 ALA H 2 65 ALA HA . . 2.800 2.820 2.812 2.828 0.028 6 0 "[ . 1 . 2]" 1
1003 2 25 ASP HA 2 26 GLU H . . 2.800 2.376 2.339 2.432 . 0 0 "[ . 1 . 2]" 1
1004 2 25 ASP H 2 25 ASP HA . . 2.800 2.803 2.307 2.841 0.041 19 0 "[ . 1 . 2]" 1
1005 2 48 ALA HA 2 49 VAL H . . 2.800 2.113 2.055 2.186 . 0 0 "[ . 1 . 2]" 1
1006 2 25 ASP H 2 25 ASP QB . . 2.800 2.288 2.089 2.850 0.050 17 0 "[ . 1 . 2]" 1
1007 2 43 ASP H 2 43 ASP QB . . 2.800 2.822 2.723 2.881 0.081 11 0 "[ . 1 . 2]" 1
1008 2 83 ASP H 2 83 ASP QB . . 2.800 2.286 2.174 2.512 . 0 0 "[ . 1 . 2]" 1
1009 2 88 ASP H 2 88 ASP QB . . 2.800 2.430 2.173 2.820 0.020 4 0 "[ . 1 . 2]" 1
1010 2 69 ASP HA 2 70 LYS H . . 2.800 2.445 2.242 2.761 . 0 0 "[ . 1 . 2]" 1
1011 2 51 ASP HA 2 52 VAL H . . 2.800 2.595 2.344 2.825 0.025 5 0 "[ . 1 . 2]" 1
1012 2 63 VAL HA 2 63 VAL QG . . 2.800 2.180 2.124 2.287 . 0 0 "[ . 1 . 2]" 1
1013 2 33 VAL HA 2 36 ALA MB . . 3.500 2.980 2.563 3.507 0.007 2 0 "[ . 1 . 2]" 1
1014 2 67 THR HA 2 67 THR MG . . 3.500 3.158 3.096 3.205 . 0 0 "[ . 1 . 2]" 1
1015 2 22 LEU QD 2 67 THR HA . . 2.800 2.222 2.043 2.629 . 0 0 "[ . 1 . 2]" 1
1016 2 78 VAL HA 2 78 VAL QG . . 2.800 2.278 2.147 2.571 . 0 0 "[ . 1 . 2]" 1
1017 2 60 PRO HA 2 60 PRO HB3 . . 2.800 2.294 2.279 2.305 . 0 0 "[ . 1 . 2]" 1
1018 2 62 ILE HA 2 65 ALA MB . . 2.800 2.125 1.984 2.302 . 0 0 "[ . 1 . 2]" 1
1019 2 62 ILE HA 2 62 ILE MG . . 2.800 2.236 2.127 2.479 . 0 0 "[ . 1 . 2]" 1
1020 2 85 ILE HA 2 85 ILE HB . . 2.800 2.894 2.881 2.906 0.106 17 0 "[ . 1 . 2]" 1
1021 2 85 ILE HA 2 85 ILE MG . . 2.800 2.662 2.581 2.813 0.013 4 0 "[ . 1 . 2]" 1
1022 2 35 PHE HA 2 38 ALA MB . . 2.800 2.821 2.265 2.966 0.166 13 0 "[ . 1 . 2]" 1
1023 2 26 GLU HA 2 26 GLU HB2 . . 2.800 3.031 3.023 3.039 0.239 2 0 "[ . 1 . 2]" 1
1024 2 64 GLN HA 2 64 GLN QB . . 2.800 2.350 2.324 2.376 . 0 0 "[ . 1 . 2]" 1
1025 2 19 GLU HA 2 70 LYS QD . . 4.500 4.501 4.317 4.565 0.065 14 0 "[ . 1 . 2]" 1
1026 2 53 GLN HA 2 53 GLN HG2 . . 2.800 3.009 2.387 3.734 0.934 7 4 "[* - + 1 . * 2]" 1
1027 2 53 GLN HA 2 53 GLN QB . . 2.800 2.364 2.252 2.459 . 0 0 "[ . 1 . 2]" 1
1028 2 46 GLU HA 2 46 GLU QB . . 2.800 2.324 2.150 2.373 . 0 0 "[ . 1 . 2]" 1
1029 2 42 LYS HA 2 42 LYS QB . . 2.800 2.171 2.140 2.391 . 0 0 "[ . 1 . 2]" 1
1030 2 87 LYS HA 2 87 LYS HB2 . . 2.800 3.045 3.029 3.058 0.258 10 0 "[ . 1 . 2]" 1
1031 2 39 LEU HA 2 39 LEU HB2 . . 2.800 3.039 3.021 3.075 0.275 11 0 "[ . 1 . 2]" 1
1032 2 39 LEU HA 2 39 LEU HG . . 4.500 3.939 3.879 3.997 . 0 0 "[ . 1 . 2]" 1
1033 2 87 LYS HA 2 87 LYS HG2 . . 2.800 2.912 2.677 3.013 0.213 16 0 "[ . 1 . 2]" 1
1034 2 76 ASP HA 2 76 ASP QB . . 2.800 2.374 2.335 2.406 . 0 0 "[ . 1 . 2]" 1
1035 2 68 GLN HA 2 68 GLN HG2 . . 3.500 3.167 2.608 3.827 0.327 11 0 "[ . 1 . 2]" 1
1036 2 68 GLN HA 2 68 GLN HB2 . . 2.800 2.986 2.445 3.055 0.255 14 0 "[ . 1 . 2]" 1
1037 2 22 LEU HA 2 22 LEU QD . . 2.800 2.237 2.069 2.524 . 0 0 "[ . 1 . 2]" 1
1038 2 83 ASP HA 2 83 ASP QB . . 2.800 2.372 2.338 2.422 . 0 0 "[ . 1 . 2]" 1
1039 2 10 LYS HA 2 10 LYS HB2 . . 2.800 2.896 2.408 3.051 0.251 15 0 "[ . 1 . 2]" 1
1040 2 10 LYS HA 2 10 LYS QG . . 3.500 3.070 2.443 3.500 . 0 0 "[ . 1 . 2]" 1
1041 2 25 ASP HA 2 25 ASP QB . . 2.800 2.438 2.354 2.525 . 0 0 "[ . 1 . 2]" 1
1042 2 71 GLN HA 2 71 GLN QG . . 2.800 2.421 2.331 2.840 0.040 12 0 "[ . 1 . 2]" 1
1043 2 26 GLU HA 2 26 GLU QB . . 2.800 2.281 2.270 2.292 . 0 0 "[ . 1 . 2]" 1
1044 2 33 VAL HA 2 33 VAL QG . . 2.800 2.257 2.168 2.339 . 0 0 "[ . 1 . 2]" 1
1045 2 39 LEU HA 2 39 LEU QD . . 3.500 2.322 2.204 2.437 . 0 0 "[ . 1 . 2]" 1
1046 2 31 THR HA 2 31 THR MG . . 2.800 2.488 2.363 2.591 . 0 0 "[ . 1 . 2]" 1
1047 2 60 PRO HA 2 63 VAL QG . . 3.500 2.661 2.034 3.020 . 0 0 "[ . 1 . 2]" 1
1048 2 17 THR HA 2 17 THR MG . . 2.800 2.318 2.248 2.385 . 0 0 "[ . 1 . 2]" 1
1049 2 17 THR MG 2 73 ASN HA . . 3.500 3.089 2.196 3.502 0.002 20 0 "[ . 1 . 2]" 1
1050 2 59 THR HA 2 59 THR MG . . 2.800 2.466 2.381 2.529 . 0 0 "[ . 1 . 2]" 1
1051 2 55 ILE HA 2 58 VAL MG2 . . 3.500 3.943 3.601 4.166 0.666 15 8 "[ * . **** + -*]" 1
1052 2 57 THR HA 2 57 THR MG . . 2.800 2.525 2.429 2.694 . 0 0 "[ . 1 . 2]" 1
1053 2 20 ASP HA 2 23 ALA MB . . 2.800 2.540 2.297 2.818 0.018 15 0 "[ . 1 . 2]" 1
1054 2 53 GLN HA 2 56 ALA MB . . 4.500 3.084 2.407 4.255 . 0 0 "[ . 1 . 2]" 1
1055 2 58 VAL HA 2 61 ALA MB . . 2.800 2.771 2.619 2.882 0.082 10 0 "[ . 1 . 2]" 1
1056 2 34 GLY HA2 2 55 ILE MD . . 2.800 2.932 2.705 3.244 0.444 2 0 "[ . 1 . 2]" 1
1057 2 34 GLY QA 2 55 ILE MD . . 3.500 2.780 2.624 2.873 . 0 0 "[ . 1 . 2]" 1
1058 2 13 VAL HA 2 13 VAL QG . . 2.800 2.320 2.264 2.402 . 0 0 "[ . 1 . 2]" 1
1059 2 33 VAL QG 2 55 ILE QG . . 3.500 2.489 2.234 2.684 . 0 0 "[ . 1 . 2]" 1
1060 2 52 VAL HA 2 52 VAL QG . . 2.800 2.369 2.081 2.523 . 0 0 "[ . 1 . 2]" 1
1061 2 62 ILE QG 2 62 ILE MG . . 2.800 2.418 2.164 2.537 . 0 0 "[ . 1 . 2]" 1
1062 2 30 PRO HB3 2 55 ILE MG . . 3.500 2.105 2.066 2.153 . 0 0 "[ . 1 . 2]" 1
1063 2 62 ILE MD 2 78 VAL HA . . 3.500 3.111 2.177 3.556 0.056 2 0 "[ . 1 . 2]" 1
1064 2 85 ILE HB 2 85 ILE MD . . 3.500 2.356 2.255 2.444 . 0 0 "[ . 1 . 2]" 1
1065 2 22 LEU QD 2 67 THR MG . . 3.500 3.526 3.443 3.559 0.059 19 0 "[ . 1 . 2]" 1
1066 2 36 ALA MB 2 78 VAL QG . . 2.800 2.691 2.347 2.803 0.003 19 0 "[ . 1 . 2]" 1
1067 2 13 VAL QG 2 36 ALA MB . . 2.800 2.293 2.106 2.452 . 0 0 "[ . 1 . 2]" 1
1068 2 62 ILE MG 2 78 VAL QG . . 2.800 2.359 2.150 2.808 0.008 18 0 "[ . 1 . 2]" 1
1069 2 62 ILE MD 2 78 VAL QG . . 3.500 2.679 2.004 3.509 0.009 8 0 "[ . 1 . 2]" 1
1070 2 33 VAL QG 2 78 VAL QG . . 2.800 2.215 1.939 2.805 0.005 10 0 "[ . 1 . 2]" 1
1071 2 50 LEU QD 2 55 ILE MD . . 2.800 2.467 2.024 2.827 0.027 6 0 "[ . 1 . 2]" 1
1072 2 38 ALA MB 2 39 LEU HG . . 4.500 4.572 4.541 4.623 0.123 2 0 "[ . 1 . 2]" 1
1073 2 33 VAL QG 2 58 VAL HB . . 3.500 3.404 2.965 3.519 0.019 1 0 "[ . 1 . 2]" 1
1074 2 59 THR HA 2 62 ILE MD . . 3.500 3.034 2.544 3.589 0.089 16 0 "[ . 1 . 2]" 1
1075 2 30 PRO HG3 2 59 THR HA . . 3.500 3.710 3.669 3.767 0.267 14 0 "[ . 1 . 2]" 1
1076 2 59 THR HA 2 62 ILE H . . 4.500 4.071 3.745 4.360 . 0 0 "[ . 1 . 2]" 1
1077 2 57 THR HB 2 58 VAL H . . 2.800 2.643 2.491 2.837 0.037 4 0 "[ . 1 . 2]" 1
1078 2 64 GLN HA 2 67 THR HB . . 3.500 3.286 3.043 3.471 . 0 0 "[ . 1 . 2]" 1
1079 2 67 THR HB 2 68 GLN H . . 3.500 3.574 3.561 3.600 0.100 16 0 "[ . 1 . 2]" 1
1080 2 67 THR H 2 67 THR HB . . 2.800 2.345 2.235 2.452 . 0 0 "[ . 1 . 2]" 1
1081 2 57 THR HA 2 57 THR HB . . 2.800 2.981 2.947 2.988 0.188 7 0 "[ . 1 . 2]" 1
1082 2 63 VAL H 2 63 VAL HA . . 2.800 2.870 2.850 2.886 0.086 9 0 "[ . 1 . 2]" 1
1083 2 33 VAL HA 2 78 VAL QG . . 3.500 3.059 2.736 3.510 0.010 10 0 "[ . 1 . 2]" 1
1084 2 67 THR HA 2 70 LYS HE3 . . 2.800 2.403 2.297 2.541 . 0 0 "[ . 1 . 2]" 1
1085 2 67 THR HA 2 68 GLN H . . 4.500 3.529 3.507 3.587 . 0 0 "[ . 1 . 2]" 1
1086 2 67 THR H 2 67 THR HA . . 2.800 2.930 2.912 2.939 0.139 3 0 "[ . 1 . 2]" 1
1087 2 52 VAL HA 2 55 ILE QG . . 4.500 4.160 3.670 4.474 . 0 0 "[ . 1 . 2]" 1
1088 2 52 VAL HA 2 55 ILE HB . . 3.500 2.218 2.029 2.571 . 0 0 "[ . 1 . 2]" 1
1089 2 51 ASP H 2 52 VAL HA . . 4.500 4.607 4.525 4.670 0.170 20 0 "[ . 1 . 2]" 1
1090 2 55 ILE MG 2 59 THR HB . . 4.500 4.395 4.223 4.511 0.011 3 0 "[ . 1 . 2]" 1
1091 2 59 THR HB 2 60 PRO QD . . 2.800 2.140 2.078 2.188 . 0 0 "[ . 1 . 2]" 1
1092 2 59 THR H 2 59 THR HB . . 2.800 2.505 2.402 2.582 . 0 0 "[ . 1 . 2]" 1
1093 2 60 PRO HA 2 63 VAL H . . 4.500 3.685 3.476 4.069 . 0 0 "[ . 1 . 2]" 1
1094 2 45 PRO HA 2 48 ALA MB . . 3.500 2.088 1.924 2.290 . 0 0 "[ . 1 . 2]" 1
1095 2 57 THR HA 2 58 VAL H . . 4.500 3.566 3.537 3.599 . 0 0 "[ . 1 . 2]" 1
1096 2 55 ILE HA 2 55 ILE QG . . 3.500 2.234 2.126 2.330 . 0 0 "[ . 1 . 2]" 1
1097 2 55 ILE HA 2 55 ILE MD . . 4.500 3.695 3.139 3.822 . 0 0 "[ . 1 . 2]" 1
1098 2 62 ILE HA 2 62 ILE QG . . 3.500 3.194 2.277 3.503 0.003 8 0 "[ . 1 . 2]" 1
1099 2 15 SER H 2 15 SER QB . . 2.800 2.673 2.363 2.931 0.131 7 0 "[ . 1 . 2]" 1
1100 2 12 PRO QB 2 15 SER QB . . 4.500 4.239 3.605 4.539 0.039 8 0 "[ . 1 . 2]" 1
1101 2 58 VAL HA 2 85 ILE MD . . 3.500 2.433 2.177 2.665 . 0 0 "[ . 1 . 2]" 1
1102 2 58 VAL HA 2 61 ALA H . . 4.500 3.598 3.372 3.708 . 0 0 "[ . 1 . 2]" 1
1103 2 58 VAL H 2 58 VAL HA . . 2.800 2.899 2.876 2.929 0.129 4 0 "[ . 1 . 2]" 1
1104 2 12 PRO HA 2 13 VAL QG . . 4.500 3.487 3.201 3.705 . 0 0 "[ . 1 . 2]" 1
1105 2 12 PRO HA 2 13 VAL H . . 2.800 2.369 2.090 2.600 . 0 0 "[ . 1 . 2]" 1
1106 2 27 SER QB 2 28 PHE HB3 . . 4.500 4.957 4.827 5.071 0.571 15 5 "[ - 1 *+ * *]" 1
1107 2 27 SER HA 2 27 SER QB . . 2.800 2.405 2.375 2.438 . 0 0 "[ . 1 . 2]" 1
1108 2 24 VAL HA 2 25 ASP H . . 2.800 2.212 2.127 3.005 0.205 17 0 "[ . 1 . 2]" 1
1109 2 27 SER QB 2 28 PHE H . . 4.500 2.934 2.794 3.044 . 0 0 "[ . 1 . 2]" 1
1110 2 24 VAL H 2 24 VAL HA . . 2.800 2.873 2.815 2.903 0.103 10 0 "[ . 1 . 2]" 1
1111 2 85 ILE HA 2 85 ILE MD . . 3.500 3.609 3.574 3.624 0.124 1 0 "[ . 1 . 2]" 1
1112 2 85 ILE HA 2 86 LYS QG . . 4.500 4.636 4.559 4.676 0.176 11 0 "[ . 1 . 2]" 1
1113 2 85 ILE H 2 85 ILE HA . . 2.800 2.872 2.845 2.933 0.133 14 0 "[ . 1 . 2]" 1
1114 2 24 VAL QG 2 29 GLN HA . . 3.500 2.569 2.222 2.725 . 0 0 "[ . 1 . 2]" 1
1115 2 29 GLN HA 2 29 GLN QG . . 3.500 2.289 2.238 2.545 . 0 0 "[ . 1 . 2]" 1
1116 2 29 GLN HA 2 29 GLN QB . . 2.800 2.503 2.471 2.533 . 0 0 "[ . 1 . 2]" 1
1117 2 29 GLN HA 2 29 GLN HG2 . . 3.500 2.496 2.433 2.595 . 0 0 "[ . 1 . 2]" 1
1118 2 29 GLN HA 2 31 THR H . . 4.500 3.982 3.843 4.072 . 0 0 "[ . 1 . 2]" 1
1119 2 49 VAL HA 2 50 LEU H . . 3.500 2.719 2.218 3.368 . 0 0 "[ . 1 . 2]" 1
1120 2 27 SER HA 2 28 PHE H . . 3.500 3.504 3.487 3.528 0.028 6 0 "[ . 1 . 2]" 1
1121 2 26 GLU HA 2 27 SER HA . . 5.500 4.919 4.812 4.980 . 0 0 "[ . 1 . 2]" 1
1122 2 22 LEU QD 2 70 LYS HA . . 4.500 3.881 3.432 4.201 . 0 0 "[ . 1 . 2]" 1
1123 2 70 LYS HA 2 70 LYS QG . . 3.500 2.459 2.352 2.646 . 0 0 "[ . 1 . 2]" 1
1124 2 19 GLU HB2 2 70 LYS HA . . 4.500 3.731 3.515 4.023 . 0 0 "[ . 1 . 2]" 1
1125 2 18 CYS QB 2 70 LYS HA . . 2.800 2.256 2.077 2.829 0.029 11 0 "[ . 1 . 2]" 1
1126 2 70 LYS HA 2 71 GLN H . . 4.500 3.530 3.493 3.576 . 0 0 "[ . 1 . 2]" 1
1127 2 70 LYS H 2 70 LYS HA . . 2.800 2.836 2.819 2.862 0.062 8 0 "[ . 1 . 2]" 1
1128 2 17 THR HA 2 73 ASN HA . . 4.500 2.806 2.067 4.176 . 0 0 "[ . 1 . 2]" 1
1129 2 17 THR HA 2 74 PHE H . . 3.500 3.040 2.721 3.612 0.112 2 0 "[ . 1 . 2]" 1
1130 2 17 THR HA 2 18 CYS H . . 2.800 2.329 2.171 2.459 . 0 0 "[ . 1 . 2]" 1
1131 2 82 TRP HA 2 86 LYS QG . . 4.500 3.593 2.415 4.058 . 0 0 "[ . 1 . 2]" 1
1132 2 82 TRP HA 2 82 TRP HB3 . . 2.800 2.942 2.551 3.040 0.240 15 0 "[ . 1 . 2]" 1
1133 2 82 TRP HA 2 83 ASP H . . 3.500 3.559 3.548 3.569 0.069 14 0 "[ . 1 . 2]" 1
1134 2 82 TRP H 2 82 TRP HA . . 2.800 2.853 2.839 2.877 0.077 10 0 "[ . 1 . 2]" 1
1135 2 74 PHE HA 2 74 PHE QB . . 2.800 2.267 2.093 2.377 . 0 0 "[ . 1 . 2]" 1
1136 2 26 GLU HA 2 26 GLU QG . . 2.800 2.625 2.577 2.659 . 0 0 "[ . 1 . 2]" 1
1137 2 25 ASP HA 2 26 GLU HA . . 4.500 4.384 4.271 4.482 . 0 0 "[ . 1 . 2]" 1
1138 2 26 GLU HA 2 29 GLN H . . 3.500 3.335 3.165 3.504 0.004 17 0 "[ . 1 . 2]" 1
1139 2 26 GLU HA 2 27 SER H . . 3.500 3.501 3.479 3.531 0.031 14 0 "[ . 1 . 2]" 1
1140 2 18 CYS HA 2 70 LYS HA . . 4.500 4.533 4.334 4.699 0.199 11 0 "[ . 1 . 2]" 1
1141 2 18 CYS HA 2 66 CYS HB2 . . 4.500 4.680 4.226 5.458 0.958 11 3 "[ - . 1+ . * 2]" 1
1142 2 18 CYS HA 2 21 PHE QB . . 4.500 2.596 2.042 3.256 . 0 0 "[ . 1 . 2]" 1
1143 2 36 ALA MB 2 75 LYS HA . . 4.500 4.098 3.701 4.516 0.016 8 0 "[ . 1 . 2]" 1
1144 2 75 LYS HA 2 78 VAL QG . . 3.500 2.518 2.103 3.265 . 0 0 "[ . 1 . 2]" 1
1145 2 75 LYS HA 2 78 VAL H . . 3.500 3.254 2.832 3.573 0.073 5 0 "[ . 1 . 2]" 1
1146 2 75 LYS HA 2 76 ASP H . . 4.500 3.542 3.474 3.573 . 0 0 "[ . 1 . 2]" 1
1147 2 19 GLU HA 2 19 GLU HG3 . . 3.500 2.477 2.380 3.039 . 0 0 "[ . 1 . 2]" 1
1148 2 79 LYS HA 2 82 TRP HB3 . . 3.500 2.971 2.389 4.079 0.579 13 3 "[ *. -1 + . 2]" 1
1149 2 79 LYS HA 2 79 LYS HG2 . . 2.800 2.593 2.565 2.721 . 0 0 "[ . 1 . 2]" 1
1150 2 19 GLU HA 2 22 LEU QD . . 3.500 3.040 2.331 3.511 0.011 3 0 "[ . 1 . 2]" 1
1151 2 79 LYS H 2 79 LYS HA . . 2.800 2.863 2.845 2.874 0.074 4 0 "[ . 1 . 2]" 1
1152 2 64 GLN HA 2 67 THR MG . . 3.500 2.808 2.612 3.055 . 0 0 "[ . 1 . 2]" 1
1153 2 63 VAL QG 2 64 GLN HA . . 4.500 3.473 3.329 3.787 . 0 0 "[ . 1 . 2]" 1
1154 2 64 GLN H 2 64 GLN HA . . 2.800 2.896 2.872 2.923 0.123 15 0 "[ . 1 . 2]" 1
1155 2 64 GLN HA 2 65 ALA H . . 4.500 3.602 3.582 3.621 . 0 0 "[ . 1 . 2]" 1
1156 2 53 GLN HA 2 54 GLY H . . 3.500 3.548 3.513 3.575 0.075 14 0 "[ . 1 . 2]" 1
1157 2 84 LYS HA 2 85 ILE H . . 4.500 3.491 3.426 3.531 . 0 0 "[ . 1 . 2]" 1
1158 2 84 LYS HA 2 84 LYS QG . . 3.500 3.353 2.574 3.475 . 0 0 "[ . 1 . 2]" 1
1159 2 37 GLU HA 2 78 VAL QG . . 4.500 4.564 4.517 4.611 0.111 4 0 "[ . 1 . 2]" 1
1160 2 37 GLU HA 2 37 GLU QG . . 3.500 2.747 2.250 3.403 . 0 0 "[ . 1 . 2]" 1
1161 2 37 GLU HA 2 37 GLU QB . . 2.800 2.399 2.120 2.554 . 0 0 "[ . 1 . 2]" 1
1162 2 37 GLU HA 2 40 ASN H . . 4.500 3.485 3.105 3.994 . 0 0 "[ . 1 . 2]" 1
1163 2 37 GLU HA 2 38 ALA H . . 4.500 3.541 3.461 3.605 . 0 0 "[ . 1 . 2]" 1
1164 2 46 GLU HA 2 46 GLU QG . . 3.500 2.748 2.335 3.389 . 0 0 "[ . 1 . 2]" 1
1165 2 46 GLU HA 2 47 ASP H . . 3.500 3.504 3.433 3.530 0.030 20 0 "[ . 1 . 2]" 1
1166 2 46 GLU H 2 46 GLU HA . . 2.800 2.833 2.805 2.900 0.100 20 0 "[ . 1 . 2]" 1
1167 2 42 LYS H 2 42 LYS HA . . 2.800 2.882 2.865 2.910 0.110 8 0 "[ . 1 . 2]" 1
1168 2 42 LYS HA 2 43 ASP H . . 3.500 3.228 2.818 3.540 0.040 4 0 "[ . 1 . 2]" 1
1169 2 81 GLU H 2 81 GLU HA . . 2.800 2.881 2.864 2.908 0.108 14 0 "[ . 1 . 2]" 1
1170 2 81 GLU HA 2 84 LYS H . . 3.500 3.097 3.002 3.258 . 0 0 "[ . 1 . 2]" 1
1171 2 81 GLU HA 2 81 GLU HG2 . . 3.500 3.369 3.251 3.623 0.123 11 0 "[ . 1 . 2]" 1
1172 2 77 LYS HA 2 77 LYS HG3 . . 2.800 2.744 2.359 3.595 0.795 3 2 "[ + . - . 2]" 1
1173 2 77 LYS HA 2 79 LYS HB2 . . 5.500 5.178 4.962 5.633 0.133 11 0 "[ . 1 . 2]" 1
1174 2 77 LYS HA 2 77 LYS QE . . 3.500 3.045 1.909 3.524 0.024 13 0 "[ . 1 . 2]" 1
1175 2 16 TRP HA 2 17 THR MG . . 3.500 3.410 3.172 3.623 0.123 20 0 "[ . 1 . 2]" 1
1176 2 16 TRP HA 2 17 THR H . . 2.800 2.347 2.056 2.703 . 0 0 "[ . 1 . 2]" 1
1177 2 20 ASP HA 2 21 PHE H . . 4.500 3.545 3.403 3.593 . 0 0 "[ . 1 . 2]" 1
1178 2 20 ASP H 2 20 ASP HA . . 2.800 2.863 2.812 2.907 0.107 1 0 "[ . 1 . 2]" 1
1179 2 38 ALA MB 2 39 LEU HA . . 4.500 3.884 3.786 3.963 . 0 0 "[ . 1 . 2]" 1
1180 2 39 LEU HA 2 40 ASN H . . 4.500 3.564 3.466 3.643 . 0 0 "[ . 1 . 2]" 1
1181 2 87 LYS HA 2 87 LYS HD2 . . 2.800 2.667 2.195 3.470 0.670 16 2 "[ . 1 -.+ 2]" 1
1182 2 86 LYS HA 2 87 LYS HA . . 5.500 4.739 4.696 4.783 . 0 0 "[ . 1 . 2]" 1
1183 2 76 ASP H 2 76 ASP HA . . 2.800 2.848 2.815 2.884 0.084 14 0 "[ . 1 . 2]" 1
1184 2 76 ASP HA 2 79 LYS HB2 . . 2.800 2.588 2.144 2.816 0.016 6 0 "[ . 1 . 2]" 1
1185 2 76 ASP HA 2 79 LYS HD3 . . 3.500 2.694 2.291 3.312 . 0 0 "[ . 1 . 2]" 1
1186 2 68 GLN H 2 68 GLN HA . . 2.800 2.833 2.817 2.891 0.091 11 0 "[ . 1 . 2]" 1
1187 2 4 GLN HA 2 4 GLN QG . . 3.500 3.025 2.176 3.532 0.032 8 0 "[ . 1 . 2]" 1
1188 2 22 LEU HA 2 22 LEU HG . . 3.500 3.138 2.401 3.611 0.111 7 0 "[ . 1 . 2]" 1
1189 2 22 LEU HA 2 23 ALA H . . 4.500 3.464 3.378 3.500 . 0 0 "[ . 1 . 2]" 1
1190 2 83 ASP HA 2 86 LYS QG . . 4.500 4.395 3.774 4.565 0.065 14 0 "[ . 1 . 2]" 1
1191 2 83 ASP HA 2 84 LYS H . . 3.500 3.556 3.401 3.580 0.080 16 0 "[ . 1 . 2]" 1
1192 2 32 ALA HA 2 35 PHE QB . . 4.500 2.895 2.452 3.869 . 0 0 "[ . 1 . 2]" 1
1193 2 31 THR MG 2 32 ALA HA . . 4.500 3.959 3.769 4.175 . 0 0 "[ . 1 . 2]" 1
1194 2 32 ALA H 2 32 ALA HA . . 2.800 2.845 2.822 2.864 0.064 5 0 "[ . 1 . 2]" 1
1195 2 17 THR MG 2 71 GLN HA . . 3.500 3.176 2.587 3.517 0.017 20 0 "[ . 1 . 2]" 1
1196 2 17 THR HB 2 71 GLN HA . . 3.500 2.959 2.333 3.479 . 0 0 "[ . 1 . 2]" 1
1197 2 71 GLN H 2 71 GLN HA . . 2.800 2.902 2.869 2.921 0.121 4 0 "[ . 1 . 2]" 1
1198 2 13 VAL QG 2 36 ALA HA . . 2.800 2.666 2.264 2.898 0.098 3 0 "[ . 1 . 2]" 1
1199 2 65 ALA HA 2 66 CYS H . . 4.500 3.565 3.548 3.596 . 0 0 "[ . 1 . 2]" 1
1200 2 65 ALA HA 2 68 GLN H . . 3.500 3.124 2.975 3.344 . 0 0 "[ . 1 . 2]" 1
1201 2 65 ALA HA 2 68 GLN HG2 . . 3.500 2.703 2.072 3.831 0.331 9 0 "[ . 1 . 2]" 1
1202 2 65 ALA HA 2 68 GLN QB . . 4.000 2.510 2.170 4.070 0.070 15 0 "[ . 1 . 2]" 1
1203 2 38 ALA HA 2 41 ASN QD . . 4.500 2.943 2.318 3.919 . 0 0 "[ . 1 . 2]" 1
1204 2 61 ALA HA 2 62 ILE H . . 3.500 3.615 3.601 3.625 0.125 12 0 "[ . 1 . 2]" 1
1205 2 61 ALA HA 2 64 GLN H . . 5.500 4.124 3.855 4.374 . 0 0 "[ . 1 . 2]" 1
1206 2 61 ALA H 2 61 ALA HA . . 2.800 2.899 2.877 2.925 0.125 4 0 "[ . 1 . 2]" 1
1207 2 11 LYS HA 2 12 PRO HD3 . . 3.500 3.339 2.192 3.798 0.298 17 0 "[ . 1 . 2]" 1
1208 2 44 LYS HA 2 44 LYS HG2 . . 2.800 2.549 2.370 2.958 0.158 15 0 "[ . 1 . 2]" 1
1209 2 48 ALA HA 2 49 VAL QG . . 3.500 3.412 3.119 3.550 0.050 7 0 "[ . 1 . 2]" 1
1210 2 48 ALA H 2 48 ALA HA . . 2.800 2.890 2.831 2.934 0.134 13 0 "[ . 1 . 2]" 1
1211 2 50 LEU HA 2 51 ASP H . . 2.800 2.231 2.159 2.337 . 0 0 "[ . 1 . 2]" 1
1212 2 23 ALA H 2 23 ALA HA . . 2.800 2.883 2.852 2.919 0.119 2 0 "[ . 1 . 2]" 1
1213 2 23 ALA HA 2 24 VAL H . . 3.500 3.516 3.483 3.537 0.037 18 0 "[ . 1 . 2]" 1
1214 2 7 ALA HA 2 8 ASP H . . 3.500 3.032 2.166 3.518 0.018 4 0 "[ . 1 . 2]" 1
1215 2 10 LYS QD 2 12 PRO HD3 . . 5.500 4.704 3.481 5.088 . 0 0 "[ . 1 . 2]" 1
1216 2 12 PRO HD3 2 12 PRO HG2 . . 2.800 2.985 2.761 3.048 0.248 12 0 "[ . 1 . 2]" 1
1217 2 10 LYS QD 2 12 PRO QD . . 4.500 4.432 3.394 4.693 0.193 12 0 "[ . 1 . 2]" 1
1218 2 69 ASP HA 2 71 GLN H . . 3.500 3.404 3.165 3.538 0.038 20 0 "[ . 1 . 2]" 1
1219 2 69 ASP HA 2 69 ASP HB2 . . 2.800 2.612 2.448 3.036 0.236 5 0 "[ . 1 . 2]" 1
1220 2 69 ASP HA 2 69 ASP QB . . 2.800 2.384 2.301 2.417 . 0 0 "[ . 1 . 2]" 1
1221 2 69 ASP HA 2 70 LYS QB . . 5.500 4.331 4.169 4.494 . 0 0 "[ . 1 . 2]" 1
1222 2 66 CYS HA 2 77 LYS QD . . 4.500 4.058 3.536 4.561 0.061 2 0 "[ . 1 . 2]" 1
1223 2 60 PRO HB3 2 60 PRO QD . . 2.800 2.691 2.669 2.713 . 0 0 "[ . 1 . 2]" 1
1224 2 60 PRO HA 2 60 PRO QD . . 3.500 3.260 3.215 3.289 . 0 0 "[ . 1 . 2]" 1
1225 2 60 PRO QD 2 61 ALA H . . 3.500 2.979 2.834 3.160 . 0 0 "[ . 1 . 2]" 1
1226 2 29 GLN H 2 30 PRO HD2 . . 2.800 2.927 2.837 3.020 0.220 17 0 "[ . 1 . 2]" 1
1227 2 59 THR H 2 60 PRO QD . . 3.500 2.681 2.526 2.818 . 0 0 "[ . 1 . 2]" 1
1228 2 60 PRO QB 2 60 PRO QD . . 2.800 2.613 2.594 2.631 . 0 0 "[ . 1 . 2]" 1
1229 2 59 THR MG 2 60 PRO QD . . 3.500 2.632 2.491 2.901 . 0 0 "[ . 1 . 2]" 1
1230 2 44 LYS HG2 2 45 PRO HD3 . . 4.500 3.934 3.458 4.970 0.470 7 0 "[ . 1 . 2]" 1
1231 2 45 PRO HD3 2 45 PRO HG2 . . 2.800 2.959 2.936 2.987 0.187 6 0 "[ . 1 . 2]" 1
1232 2 44 LYS HA 2 45 PRO HD3 . . 2.800 2.327 2.173 2.453 . 0 0 "[ . 1 . 2]" 1
1233 2 54 GLY H 2 54 GLY HA2 . . 2.800 2.903 2.839 2.992 0.192 5 0 "[ . 1 . 2]" 1
1234 2 34 GLY H 2 34 GLY QA . . 2.800 2.188 2.165 2.205 . 0 0 "[ . 1 . 2]" 1
1235 2 54 GLY H 2 54 GLY QA . . 2.800 2.235 2.172 2.312 . 0 0 "[ . 1 . 2]" 1
1236 2 54 GLY QA 2 55 ILE H . . 3.500 2.626 2.546 2.730 . 0 0 "[ . 1 . 2]" 1
1237 2 34 GLY H 2 34 GLY HA2 . . 2.800 2.795 2.759 2.863 0.063 1 0 "[ . 1 . 2]" 1
1238 2 39 LEU H 2 39 LEU QB . . 2.800 2.370 2.267 2.462 . 0 0 "[ . 1 . 2]" 1
1239 2 50 LEU HB2 2 50 LEU HG . . 2.800 2.361 2.286 2.528 . 0 0 "[ . 1 . 2]" 1
1240 2 39 LEU HB2 2 39 LEU HG . . 2.800 2.289 2.224 2.345 . 0 0 "[ . 1 . 2]" 1
1241 2 39 LEU H 2 39 LEU HB2 . . 2.800 2.405 2.294 2.505 . 0 0 "[ . 1 . 2]" 1
1242 2 22 LEU QD 2 70 LYS HE3 . . 2.800 3.145 2.710 3.766 0.966 7 3 "[ - . + 1 . * 2]" 1
1243 2 84 LYS QE 2 85 ILE HA . . 3.500 3.434 3.055 3.621 0.121 10 0 "[ . 1 . 2]" 1
1244 2 14 ASN QD 2 75 LYS QE . . 3.500 3.218 2.369 3.574 0.074 8 0 "[ . 1 . 2]" 1
1245 2 86 LYS HE2 2 86 LYS QG . . 3.500 2.499 2.347 3.026 . 0 0 "[ . 1 . 2]" 1
1246 2 24 VAL QG 2 28 PHE QB . . 2.800 2.062 1.979 2.148 . 0 0 "[ . 1 . 2]" 1
1247 2 28 PHE H 2 28 PHE QB . . 3.500 2.756 2.658 2.851 . 0 0 "[ . 1 . 2]" 1
1248 2 25 ASP QB 2 26 GLU H . . 3.500 3.010 2.461 3.377 . 0 0 "[ . 1 . 2]" 1
1249 2 25 ASP QB 2 28 PHE H . . 3.500 3.054 2.720 3.366 . 0 0 "[ . 1 . 2]" 1
1250 2 25 ASP QB 2 27 SER QB . . 3.500 2.801 2.513 3.022 . 0 0 "[ . 1 . 2]" 1
1251 2 24 VAL QG 2 25 ASP QB . . 3.500 3.527 3.454 3.663 0.163 17 0 "[ . 1 . 2]" 1
1252 2 35 PHE QB 2 36 ALA H . . 3.500 3.065 2.638 3.343 . 0 0 "[ . 1 . 2]" 1
1253 2 35 PHE H 2 35 PHE QB . . 2.800 2.272 2.099 2.846 0.046 2 0 "[ . 1 . 2]" 1
1254 2 47 ASP H 2 47 ASP HB2 . . 3.500 3.068 2.460 3.825 0.325 19 0 "[ . 1 . 2]" 1
1255 2 47 ASP H 2 47 ASP QB . . 2.800 2.501 2.164 2.852 0.052 9 0 "[ . 1 . 2]" 1
1256 2 73 ASN HB2 2 73 ASN HD21 . . 3.500 3.699 3.493 4.107 0.607 18 5 "[ . ** 1 * -. + 2]" 1
1257 2 73 ASN H 2 73 ASN HB2 . . 3.500 2.488 2.309 2.883 . 0 0 "[ . 1 . 2]" 1
1258 2 51 ASP H 2 51 ASP HB2 . . 3.500 2.556 2.315 2.884 . 0 0 "[ . 1 . 2]" 1
1259 2 20 ASP QB 2 21 PHE H . . 3.500 3.016 2.714 3.319 . 0 0 "[ . 1 . 2]" 1
1260 2 20 ASP H 2 20 ASP QB . . 2.800 2.302 2.134 2.589 . 0 0 "[ . 1 . 2]" 1
1261 2 41 ASN HA 2 41 ASN QB . . 2.800 2.260 2.129 2.503 . 0 0 "[ . 1 . 2]" 1
1262 2 43 ASP HA 2 43 ASP QB . . 2.800 2.374 2.078 2.469 . 0 0 "[ . 1 . 2]" 1
1263 2 21 PHE QB 2 70 LYS HA . . 5.500 5.435 5.298 5.655 0.155 3 0 "[ . 1 . 2]" 1
1264 2 21 PHE H 2 21 PHE QB . . 2.800 2.260 2.187 2.349 . 0 0 "[ . 1 . 2]" 1
1265 2 76 ASP H 2 76 ASP HB2 . . 3.500 2.446 2.354 2.550 . 0 0 "[ . 1 . 2]" 1
1266 2 88 ASP HA 2 88 ASP QB . . 2.800 2.363 2.321 2.394 . 0 0 "[ . 1 . 2]" 1
1267 2 85 ILE HA 2 88 ASP QB . . 4.500 4.469 3.752 4.551 0.051 2 0 "[ . 1 . 2]" 1
1268 2 88 ASP QB 2 89 MET H . . 4.500 3.450 2.960 4.012 . 0 0 "[ . 1 . 2]" 1
1269 2 76 ASP H 2 76 ASP QB . . 2.800 2.235 2.166 2.409 . 0 0 "[ . 1 . 2]" 1
1270 2 76 ASP QB 2 77 LYS H . . 3.500 2.752 2.639 3.001 . 0 0 "[ . 1 . 2]" 1
1271 2 85 ILE H 2 85 ILE HB . . 2.800 2.108 2.073 2.211 . 0 0 "[ . 1 . 2]" 1
1272 2 85 ILE HB 2 86 LYS H . . 3.500 2.856 2.696 3.081 . 0 0 "[ . 1 . 2]" 1
1273 2 85 ILE HB 2 85 ILE QG . . 2.800 2.435 2.367 2.503 . 0 0 "[ . 1 . 2]" 1
1274 2 62 ILE HB 2 63 VAL H . . 4.500 3.574 2.883 3.959 . 0 0 "[ . 1 . 2]" 1
1275 2 62 ILE H 2 62 ILE HB . . 3.500 3.278 2.181 3.683 0.183 3 0 "[ . 1 . 2]" 1
1276 2 62 ILE HB 2 62 ILE MD . . 3.500 2.922 2.090 3.233 . 0 0 "[ . 1 . 2]" 1
1277 2 55 ILE H 2 55 ILE HB . . 2.800 2.273 2.173 2.440 . 0 0 "[ . 1 . 2]" 1
1278 2 24 VAL QG 2 29 GLN HG2 . . 3.500 2.720 2.280 3.491 . 0 0 "[ . 1 . 2]" 1
1279 2 26 GLU HA 2 29 GLN HG2 . . 4.500 4.567 3.018 4.949 0.449 9 0 "[ . 1 . 2]" 1
1280 2 29 GLN H 2 29 GLN HG2 . . 4.500 3.878 2.647 4.066 . 0 0 "[ . 1 . 2]" 1
1281 2 24 VAL QG 2 29 GLN QG . . 3.500 2.202 1.972 2.600 . 0 0 "[ . 1 . 2]" 1
1282 2 49 VAL H 2 49 VAL HB . . 3.500 2.831 2.508 3.122 . 0 0 "[ . 1 . 2]" 1
1283 2 49 VAL HB 2 50 LEU H . . 4.500 3.896 3.303 4.447 . 0 0 "[ . 1 . 2]" 1
1284 2 71 GLN QE 2 71 GLN QG . . 2.800 2.309 2.274 2.402 . 0 0 "[ . 1 . 2]" 1
1285 2 46 GLU H 2 46 GLU QG . . 3.500 2.009 1.838 2.282 . 0 0 "[ . 1 . 2]" 1
1286 2 53 GLN HG2 2 54 GLY H . . 4.500 4.349 3.600 5.031 0.531 1 1 "[+ . 1 . 2]" 1
1287 2 68 GLN H 2 68 GLN QG . . 3.500 2.222 2.165 2.271 . 0 0 "[ . 1 . 2]" 1
1288 2 68 GLN H 2 68 GLN HG2 . . 2.800 2.282 2.198 2.954 0.154 9 0 "[ . 1 . 2]" 1
1289 2 64 GLN H 2 64 GLN QG . . 3.500 2.231 2.180 2.272 . 0 0 "[ . 1 . 2]" 1
1290 2 68 GLN HB2 2 68 GLN QG . . 2.800 2.207 2.159 2.451 . 0 0 "[ . 1 . 2]" 1
1291 2 11 LYS HB2 2 12 PRO HD3 . . 4.500 4.933 4.569 5.314 0.814 13 7 "[* * * 1 + . *-*]" 1
1292 2 64 GLN H 2 64 GLN HG3 . . 2.800 2.390 2.203 3.614 0.814 9 2 "[ . +1 . - 2]" 1
1293 2 18 CYS QB 2 66 CYS HB2 . . 4.500 3.849 3.746 3.980 . 0 0 "[ . 1 . 2]" 1
1294 2 18 CYS QB 2 66 CYS HA . . 4.500 2.315 2.173 2.589 . 0 0 "[ . 1 . 2]" 1
1295 2 18 CYS H 2 18 CYS QB . . 2.800 2.074 1.995 2.337 . 0 0 "[ . 1 . 2]" 1
1296 2 81 GLU H 2 81 GLU QG . . 3.500 2.602 2.510 2.824 . 0 0 "[ . 1 . 2]" 1
1297 2 61 ALA MB 2 81 GLU QG . . 3.500 2.367 2.232 2.514 . 0 0 "[ . 1 . 2]" 1
1298 2 61 ALA HA 2 81 GLU QG . . 3.500 3.611 3.576 3.650 0.150 5 0 "[ . 1 . 2]" 1
1299 2 26 GLU HA 2 26 GLU HG3 . . 3.500 3.438 3.402 3.474 . 0 0 "[ . 1 . 2]" 1
1300 2 26 GLU HG3 2 27 SER H . . 4.500 3.782 3.758 3.809 . 0 0 "[ . 1 . 2]" 1
1301 2 26 GLU H 2 26 GLU HG3 . . 3.500 1.855 1.821 1.914 . 0 0 "[ . 1 . 2]" 1
1302 2 26 GLU H 2 26 GLU QG . . 3.500 1.825 1.786 1.884 . 0 0 "[ . 1 . 2]" 1
1303 2 26 GLU QG 2 27 SER H . . 3.500 3.630 3.611 3.651 0.151 20 0 "[ . 1 . 2]" 1
1304 2 25 ASP HA 2 26 GLU QG . . 4.500 3.597 3.536 3.640 . 0 0 "[ . 1 . 2]" 1
1305 2 81 GLU H 2 81 GLU HG2 . . 2.800 2.638 2.541 2.879 0.079 4 0 "[ . 1 . 2]" 1
1306 2 61 ALA MB 2 81 GLU HG2 . . 3.500 3.724 3.603 3.819 0.319 6 0 "[ . 1 . 2]" 1
1307 2 70 LYS H 2 70 LYS QB . . 2.800 2.372 2.279 2.486 . 0 0 "[ . 1 . 2]" 1
1308 2 70 LYS HA 2 70 LYS QB . . 2.800 2.442 2.411 2.503 . 0 0 "[ . 1 . 2]" 1
1309 2 19 GLU QG 2 70 LYS QB . . 4.500 2.972 2.541 3.813 . 0 0 "[ . 1 . 2]" 1
1310 2 84 LYS QB 2 85 ILE H . . 4.500 3.568 2.613 3.739 . 0 0 "[ . 1 . 2]" 1
1311 2 81 GLU HA 2 84 LYS QB . . 2.800 2.809 2.110 2.921 0.121 11 0 "[ . 1 . 2]" 1
1312 2 12 PRO QB 2 12 PRO HD3 . . 3.500 2.844 2.613 3.521 0.021 16 0 "[ . 1 . 2]" 1
1313 2 84 LYS QB 2 84 LYS QE . . 3.500 2.861 2.044 3.606 0.106 6 0 "[ . 1 . 2]" 1
1314 2 84 LYS QB 2 84 LYS HD2 . . 2.800 2.529 2.305 3.115 0.315 4 0 "[ . 1 . 2]" 1
1315 2 5 LYS HA 2 5 LYS HB2 . . 2.800 2.658 2.355 3.057 0.257 8 0 "[ . 1 . 2]" 1
1316 2 10 LYS HA 2 10 LYS QB . . 2.800 2.318 2.127 2.536 . 0 0 "[ . 1 . 2]" 1
1317 2 87 LYS QB 2 88 ASP H . . 3.500 2.769 2.625 2.830 . 0 0 "[ . 1 . 2]" 1
1318 2 83 ASP HA 2 87 LYS QB . . 3.500 2.448 2.204 3.131 . 0 0 "[ . 1 . 2]" 1
1319 2 58 VAL HB 2 85 ILE MD . . 4.500 4.348 4.036 4.503 0.003 1 0 "[ . 1 . 2]" 1
1320 2 58 VAL H 2 58 VAL HB . . 3.500 2.259 2.145 2.862 . 0 0 "[ . 1 . 2]" 1
1321 2 58 VAL HB 2 59 THR H . . 4.500 3.139 3.035 3.421 . 0 0 "[ . 1 . 2]" 1
1322 2 42 LYS QB 2 42 LYS QE . . 3.500 2.974 2.019 3.616 0.116 5 0 "[ . 1 . 2]" 1
1323 2 87 LYS HB2 2 88 ASP H . . 2.800 2.857 2.683 2.927 0.127 12 0 "[ . 1 . 2]" 1
1324 2 79 LYS HB2 2 80 GLY H . . 2.800 2.603 2.490 2.777 . 0 0 "[ . 1 . 2]" 1
1325 2 24 VAL H 2 24 VAL HB . . 2.800 2.691 2.292 2.823 0.023 5 0 "[ . 1 . 2]" 1
1326 2 63 VAL HB 2 64 GLN H . . 3.500 2.872 2.519 3.577 0.077 12 0 "[ . 1 . 2]" 1
1327 2 63 VAL H 2 63 VAL HB . . 3.500 2.711 2.295 3.659 0.159 17 0 "[ . 1 . 2]" 1
1328 2 33 VAL H 2 33 VAL HB . . 2.800 2.714 2.438 2.850 0.050 2 0 "[ . 1 . 2]" 1
1329 2 30 PRO HA 2 33 VAL HB . . 4.500 4.115 2.290 4.527 0.027 3 0 "[ . 1 . 2]" 1
1330 2 33 VAL HB 2 34 GLY H . . 4.500 3.856 2.380 4.187 . 0 0 "[ . 1 . 2]" 1
1331 2 66 CYS H 2 66 CYS QB . . 3.500 2.340 2.279 2.436 . 0 0 "[ . 1 . 2]" 1
1332 2 66 CYS H 2 66 CYS HB2 . . 2.800 2.370 2.306 2.474 . 0 0 "[ . 1 . 2]" 1
1333 2 22 LEU QD 2 66 CYS HB2 . . 3.500 2.930 2.374 3.492 . 0 0 "[ . 1 . 2]" 1
1334 2 22 LEU QD 2 66 CYS QB . . 4.500 2.580 1.994 3.097 . 0 0 "[ . 1 . 2]" 1
1335 2 86 LYS HA 2 86 LYS QB . . 2.800 2.340 2.266 2.370 . 0 0 "[ . 1 . 2]" 1
1336 2 86 LYS H 2 86 LYS QB . . 2.800 2.559 2.499 2.665 . 0 0 "[ . 1 . 2]" 1
1337 2 44 LYS QB 2 44 LYS HE2 . . 4.500 3.848 2.131 4.362 . 0 0 "[ . 1 . 2]" 1
1338 2 44 LYS QB 2 47 ASP H . . 5.500 4.344 3.907 4.984 . 0 0 "[ . 1 . 2]" 1
1339 2 44 LYS H 2 44 LYS QB . . 3.500 2.596 2.449 3.430 . 0 0 "[ . 1 . 2]" 1
1340 2 77 LYS H 2 77 LYS QB . . 3.500 2.205 2.116 2.277 . 0 0 "[ . 1 . 2]" 1
1341 2 77 LYS QB 2 78 VAL H . . 2.800 2.815 2.698 2.867 0.067 6 0 "[ . 1 . 2]" 1
1342 2 44 LYS HB2 2 46 GLU H . . 3.500 3.299 3.100 3.584 0.084 13 0 "[ . 1 . 2]" 1
1343 2 44 LYS HA 2 44 LYS HB2 . . 2.800 3.050 3.025 3.063 0.263 3 0 "[ . 1 . 2]" 1
1344 2 78 VAL H 2 78 VAL HB . . 3.500 2.994 2.452 3.703 0.203 15 0 "[ . 1 . 2]" 1
1345 2 60 PRO QB 2 61 ALA H . . 4.500 3.610 3.440 3.747 . 0 0 "[ . 1 . 2]" 1
1346 2 30 PRO QB 2 31 THR H . . 4.500 3.024 2.924 3.200 . 0 0 "[ . 1 . 2]" 1
1347 2 30 PRO QB 2 59 THR MG . . 3.500 3.517 3.487 3.532 0.032 17 0 "[ . 1 . 2]" 1
1348 2 30 PRO QB 2 55 ILE MG . . 3.500 2.072 2.029 2.118 . 0 0 "[ . 1 . 2]" 1
1349 2 77 LYS H 2 77 LYS HB2 . . 2.800 2.296 2.137 2.429 . 0 0 "[ . 1 . 2]" 1
1350 2 77 LYS HB2 2 78 VAL H . . 4.500 3.680 3.049 4.036 . 0 0 "[ . 1 . 2]" 1
1351 2 60 PRO HB3 2 61 ALA H . . 4.500 4.433 4.308 4.534 0.034 17 0 "[ . 1 . 2]" 1
1352 2 30 PRO HB3 2 59 THR MG . . 3.500 3.677 3.640 3.693 0.193 12 0 "[ . 1 . 2]" 1
1353 2 13 VAL H 2 13 VAL HB . . 3.500 3.617 3.596 3.640 0.140 12 0 "[ . 1 . 2]" 1
1354 2 62 ILE H 2 62 ILE QG . . 2.800 2.426 1.995 2.720 . 0 0 "[ . 1 . 2]" 1
1355 2 75 LYS H 2 75 LYS HB2 . . 2.800 2.407 2.084 2.891 0.091 12 0 "[ . 1 . 2]" 1
1356 2 75 LYS HB2 2 76 ASP H . . 3.500 3.911 3.277 4.142 0.642 7 8 "[ * *- +**1 . * *]" 1
1357 2 75 LYS H 2 75 LYS QB . . 3.500 2.249 2.031 2.801 . 0 0 "[ . 1 . 2]" 1
1358 2 75 LYS QB 2 75 LYS HG2 . . 2.800 2.351 2.151 2.457 . 0 0 "[ . 1 . 2]" 1
1359 2 55 ILE QG 2 55 ILE MG . . 2.800 2.210 2.023 2.299 . 0 0 "[ . 1 . 2]" 1
1360 2 55 ILE H 2 55 ILE QG . . 3.500 2.639 2.308 3.337 . 0 0 "[ . 1 . 2]" 1
1361 2 68 GLN HB2 2 68 GLN HG2 . . 2.800 2.612 2.508 3.034 0.234 9 0 "[ . 1 . 2]" 1
1362 2 68 GLN H 2 68 GLN HB2 . . 2.800 2.721 2.564 3.679 0.879 15 2 "[ . 1- + 2]" 1
1363 2 68 GLN H 2 68 GLN QB . . 2.800 2.579 2.515 2.771 . 0 0 "[ . 1 . 2]" 1
1364 2 4 GLN HA 2 4 GLN QB . . 2.800 2.254 2.048 2.567 . 0 0 "[ . 1 . 2]" 1
1365 2 82 TRP H 2 82 TRP HB3 . . 2.800 2.756 2.389 3.609 0.809 14 5 "[ *. *- *+. 2]" 1
1366 2 82 TRP HB3 2 83 ASP H . . 2.800 2.837 2.602 3.519 0.719 14 1 "[ . 1 +. 2]" 1
1367 2 60 PRO HG2 2 61 ALA H . . 3.500 2.878 2.615 3.151 . 0 0 "[ . 1 . 2]" 1
1368 2 60 PRO QD 2 60 PRO HG2 . . 2.800 2.279 2.268 2.288 . 0 0 "[ . 1 . 2]" 1
1369 2 30 PRO QG 2 59 THR MG . . 2.800 1.996 1.967 2.026 . 0 0 "[ . 1 . 2]" 1
1370 2 77 LYS HA 2 77 LYS QD . . 2.800 2.330 2.102 2.815 0.015 17 0 "[ . 1 . 2]" 1
1371 2 77 LYS QD 2 77 LYS HG3 . . 2.800 2.406 2.095 2.586 . 0 0 "[ . 1 . 2]" 1
1372 2 81 GLU HA 2 81 GLU HB2 . . 2.800 3.042 3.028 3.049 0.249 12 0 "[ . 1 . 2]" 1
1373 2 53 GLN QB 2 54 GLY H . . 2.800 2.722 2.380 2.811 0.011 8 0 "[ . 1 . 2]" 1
1374 2 19 GLU H 2 19 GLU HB2 . . 2.800 2.328 2.289 2.397 . 0 0 "[ . 1 . 2]" 1
1375 2 46 GLU H 2 46 GLU QB . . 2.800 2.496 2.414 2.613 . 0 0 "[ . 1 . 2]" 1
1376 2 46 GLU H 2 46 GLU HB2 . . 2.800 2.652 2.453 3.577 0.777 17 2 "[ . 1 - . + 2]" 1
1377 2 85 ILE QG 2 85 ILE MG . . 2.800 2.326 2.247 2.425 . 0 0 "[ . 1 . 2]" 1
1378 2 85 ILE HG13 2 85 ILE MG . . 2.800 3.244 3.204 3.258 0.458 13 0 "[ . 1 . 2]" 1
1379 2 85 ILE HA 2 85 ILE QG . . 3.500 2.089 2.031 2.113 . 0 0 "[ . 1 . 2]" 1
1380 2 85 ILE HA 2 85 ILE HG13 . . 3.500 2.394 2.150 2.643 . 0 0 "[ . 1 . 2]" 1
1381 2 85 ILE H 2 85 ILE QG . . 3.500 2.808 2.603 3.282 . 0 0 "[ . 1 . 2]" 1
1382 2 85 ILE H 2 85 ILE HG13 . . 3.500 2.865 2.645 3.378 . 0 0 "[ . 1 . 2]" 1
1383 2 85 ILE QG 2 86 LYS H . . 4.500 4.346 4.267 4.450 . 0 0 "[ . 1 . 2]" 1
1384 2 85 ILE HG13 2 86 LYS H . . 4.500 4.705 4.608 4.833 0.333 4 0 "[ . 1 . 2]" 1
1385 2 71 GLN H 2 71 GLN HB2 . . 3.500 2.464 2.368 2.504 . 0 0 "[ . 1 . 2]" 1
1386 2 71 GLN HA 2 71 GLN HB2 . . 2.800 3.035 3.024 3.044 0.244 2 0 "[ . 1 . 2]" 1
1387 2 37 GLU H 2 37 GLU QB . . 2.800 2.288 2.083 2.536 . 0 0 "[ . 1 . 2]" 1
1388 2 37 GLU H 2 37 GLU HB2 . . 3.500 2.446 2.116 3.683 0.183 15 0 "[ . 1 . 2]" 1
1389 2 37 GLU HB2 2 38 ALA H . . 4.500 3.385 2.863 4.105 . 0 0 "[ . 1 . 2]" 1
1390 2 37 GLU QB 2 38 ALA H . . 4.500 2.862 2.470 3.654 . 0 0 "[ . 1 . 2]" 1
1391 2 50 LEU HA 2 50 LEU HG . . 4.500 3.428 2.883 3.752 . 0 0 "[ . 1 . 2]" 1
1392 2 22 LEU QD 2 70 LYS QG . . 3.500 2.314 2.051 2.742 . 0 0 "[ . 1 . 2]" 1
1393 2 70 LYS HE3 2 70 LYS QG . . 3.500 2.605 2.386 3.368 . 0 0 "[ . 1 . 2]" 1
1394 2 70 LYS H 2 70 LYS QG . . 3.500 2.412 2.019 3.454 . 0 0 "[ . 1 . 2]" 1
1395 2 22 LEU H 2 22 LEU HG . . 4.500 2.963 2.227 4.453 . 0 0 "[ . 1 . 2]" 1
1396 2 22 LEU H 2 22 LEU QD . . 3.500 3.011 2.132 3.545 0.045 3 0 "[ . 1 . 2]" 1
1397 2 26 GLU HA 2 29 GLN QB . . 3.500 2.590 2.406 2.827 . 0 0 "[ . 1 . 2]" 1
1398 2 29 GLN QB 2 30 PRO HD2 . . 3.500 3.268 3.176 3.361 . 0 0 "[ . 1 . 2]" 1
1399 2 29 GLN H 2 29 GLN QB . . 2.800 2.166 2.076 2.238 . 0 0 "[ . 1 . 2]" 1
1400 2 29 GLN QB 2 63 VAL QG . . 3.500 2.619 2.194 2.968 . 0 0 "[ . 1 . 2]" 1
1401 2 87 LYS H 2 87 LYS HG2 . . 2.800 2.379 2.202 2.501 . 0 0 "[ . 1 . 2]" 1
1402 2 5 LYS H 2 5 LYS QG . . 2.800 2.254 1.970 2.728 . 0 0 "[ . 1 . 2]" 1
1403 2 33 VAL QG 2 55 ILE MG . . 2.800 2.767 2.469 2.834 0.034 11 0 "[ . 1 . 2]" 1
1404 2 30 PRO HA 2 33 VAL QG . . 3.500 2.165 2.028 2.559 . 0 0 "[ . 1 . 2]" 1
1405 2 31 THR H 2 33 VAL QG . . 4.500 4.396 4.248 4.579 0.079 5 0 "[ . 1 . 2]" 1
1406 2 33 VAL QG 2 34 GLY H . . 3.500 2.489 2.315 3.115 . 0 0 "[ . 1 . 2]" 1
1407 2 84 LYS H 2 84 LYS QG . . 2.800 2.974 2.888 3.041 0.241 10 0 "[ . 1 . 2]" 1
1408 2 44 LYS QG 2 45 PRO HD3 . . 4.500 3.779 3.382 4.533 0.033 7 0 "[ . 1 . 2]" 1
1409 2 44 LYS HB2 2 44 LYS QG . . 2.800 2.377 2.159 2.458 . 0 0 "[ . 1 . 2]" 1
1410 2 86 LYS H 2 86 LYS QG . . 2.800 2.258 2.146 2.457 . 0 0 "[ . 1 . 2]" 1
1411 2 86 LYS HA 2 86 LYS QG . . 3.500 2.866 2.299 3.073 . 0 0 "[ . 1 . 2]" 1
1412 2 85 ILE HB 2 86 LYS QG . . 3.500 3.245 3.028 3.550 0.050 10 0 "[ . 1 . 2]" 1
1413 2 77 LYS HA 2 77 LYS QG . . 3.500 2.566 2.328 2.997 . 0 0 "[ . 1 . 2]" 1
1414 2 42 LYS H 2 42 LYS QG . . 2.800 2.453 2.339 2.826 0.026 11 0 "[ . 1 . 2]" 1
1415 2 42 LYS QG 2 43 ASP H . . 3.500 2.136 1.830 3.571 0.071 11 0 "[ . 1 . 2]" 1
1416 2 79 LYS H 2 79 LYS HG2 . . 4.500 3.673 3.555 3.825 . 0 0 "[ . 1 . 2]" 1
1417 2 10 LYS H 2 10 LYS QG . . 2.800 2.507 2.025 2.808 0.008 19 0 "[ . 1 . 2]" 1
1418 2 39 LEU HA 2 42 LYS QG . . 4.500 3.486 3.274 3.749 . 0 0 "[ . 1 . 2]" 1
1419 2 39 LEU QD 2 42 LYS QG . . 4.500 4.265 4.054 4.510 0.010 12 0 "[ . 1 . 2]" 1
1420 2 39 LEU H 2 39 LEU HG . . 4.500 3.707 3.556 3.833 . 0 0 "[ . 1 . 2]" 1
1421 2 78 VAL QG 2 79 LYS H . . 3.500 2.860 2.370 3.286 . 0 0 "[ . 1 . 2]" 1
1422 2 13 VAL QG 2 78 VAL QG . . 5.500 4.305 3.866 4.738 . 0 0 "[ . 1 . 2]" 1
1423 2 39 LEU H 2 39 LEU QD . . 3.500 2.130 1.922 2.339 . 0 0 "[ . 1 . 2]" 1
1424 2 39 LEU HB2 2 39 LEU QD . . 2.800 2.505 2.396 2.611 . 0 0 "[ . 1 . 2]" 1
1425 2 38 ALA MB 2 39 LEU QD . . 2.800 2.151 2.036 2.363 . 0 0 "[ . 1 . 2]" 1
1426 2 24 VAL QG 2 29 GLN QB . . 4.500 3.605 3.396 3.829 . 0 0 "[ . 1 . 2]" 1
1427 2 75 LYS QG 2 79 LYS QD . . 2.800 2.716 2.468 2.829 0.029 9 0 "[ . 1 . 2]" 1
1428 2 75 LYS H 2 75 LYS QG . . 4.500 3.949 3.693 4.180 . 0 0 "[ . 1 . 2]" 1
1429 2 31 THR MG 2 34 GLY HA2 . . 5.500 5.684 5.317 5.933 0.433 17 0 "[ . 1 . 2]" 1
1430 2 31 THR H 2 31 THR MG . . 4.500 3.747 3.704 3.766 . 0 0 "[ . 1 . 2]" 1
1431 2 31 THR MG 2 32 ALA H . . 3.500 3.543 3.508 3.577 0.077 13 0 "[ . 1 . 2]" 1
1432 2 31 THR MG 2 34 GLY H . . 5.500 4.776 4.510 4.931 . 0 0 "[ . 1 . 2]" 1
1433 2 63 VAL QG 2 64 GLN H . . 2.800 2.634 2.109 2.857 0.057 14 0 "[ . 1 . 2]" 1
1434 2 29 GLN QG 2 63 VAL QG . . 4.500 3.451 2.530 3.814 . 0 0 "[ . 1 . 2]" 1
1435 2 59 THR MG 2 63 VAL QG . . 2.800 2.446 2.123 2.659 . 0 0 "[ . 1 . 2]" 1
1436 2 58 VAL MG1 2 82 TRP H . . 4.500 4.339 3.364 4.740 0.240 6 0 "[ . 1 . 2]" 1
1437 2 55 ILE HA 2 58 VAL MG1 . . 4.500 3.844 3.420 5.136 0.636 13 2 "[ -. 1 + . 2]" 1
1438 2 58 VAL MG1 2 62 ILE QG . . 3.500 3.447 2.926 3.630 0.130 3 0 "[ . 1 . 2]" 1
1439 2 58 VAL MG1 2 61 ALA MB . . 3.500 2.942 2.150 3.357 . 0 0 "[ . 1 . 2]" 1
1440 2 58 VAL MG1 2 62 ILE MG . . 4.000 3.614 3.076 4.180 0.180 18 0 "[ . 1 . 2]" 1
1441 2 58 VAL MG1 2 85 ILE MD . . 3.500 3.278 2.162 3.593 0.093 14 0 "[ . 1 . 2]" 1
1442 2 22 LEU QD 2 63 VAL HA . . 4.500 3.547 3.188 3.950 . 0 0 "[ . 1 . 2]" 1
1443 2 22 LEU QD 2 29 GLN QG . . 4.500 4.422 3.923 4.569 0.069 3 0 "[ . 1 . 2]" 1
1444 2 22 LEU QD 2 23 ALA H . . 4.500 4.339 3.909 4.508 0.008 14 0 "[ . 1 . 2]" 1
1445 2 17 THR MG 2 74 PHE H . . 4.500 4.262 3.718 4.510 0.010 3 0 "[ . 1 . 2]" 1
1446 2 17 THR MG 2 19 GLU H . . 4.500 4.280 3.928 4.531 0.031 3 0 "[ . 1 . 2]" 1
1447 2 17 THR MG 2 18 CYS H . . 3.500 3.548 3.506 3.626 0.126 20 0 "[ . 1 . 2]" 1
1448 2 17 THR H 2 17 THR MG . . 2.800 2.580 2.213 2.835 0.035 12 0 "[ . 1 . 2]" 1
1449 2 29 GLN QB 2 59 THR MG . . 3.500 3.502 3.329 3.570 0.070 1 0 "[ . 1 . 2]" 1
1450 2 29 GLN H 2 59 THR MG . . 5.500 5.533 5.465 5.569 0.069 17 0 "[ . 1 . 2]" 1
1451 2 52 VAL QG 2 53 GLN HA . . 4.500 3.482 3.145 3.824 . 0 0 "[ . 1 . 2]" 1
1452 2 49 VAL QG 2 50 LEU H . . 3.500 3.163 2.455 3.679 0.179 15 0 "[ . 1 . 2]" 1
1453 2 33 VAL QG 2 59 THR HA . . 5.500 3.269 3.060 3.471 . 0 0 "[ . 1 . 2]" 1
1454 2 33 VAL QG 2 37 GLU QG . . 3.500 3.008 2.282 3.555 0.055 20 0 "[ . 1 . 2]" 1
1455 2 33 VAL QG 2 55 ILE MD . . 4.500 3.669 3.446 3.857 . 0 0 "[ . 1 . 2]" 1
1456 2 67 THR MG 2 70 LYS HE3 . . 3.500 3.652 3.557 3.683 0.183 14 0 "[ . 1 . 2]" 1
1457 2 67 THR MG 2 68 GLN HG2 . . 3.500 3.014 2.765 3.633 0.133 15 0 "[ . 1 . 2]" 1
1458 2 67 THR MG 2 68 GLN H . . 3.500 2.421 2.324 2.494 . 0 0 "[ . 1 . 2]" 1
1459 2 67 THR H 2 67 THR MG . . 2.800 2.885 2.853 2.920 0.120 7 0 "[ . 1 . 2]" 1
1460 2 67 THR MG 2 68 GLN HA . . 3.500 3.408 3.273 3.499 . 0 0 "[ . 1 . 2]" 1
1461 2 64 GLN QB 2 67 THR MG . . 3.500 3.546 3.525 3.566 0.066 17 0 "[ . 1 . 2]" 1
1462 2 78 VAL QG 2 79 LYS HA . . 4.500 3.520 3.351 3.758 . 0 0 "[ . 1 . 2]" 1
1463 2 37 GLU H 2 78 VAL QG . . 4.500 4.110 3.688 4.503 0.003 9 0 "[ . 1 . 2]" 1
1464 2 13 VAL QG 2 36 ALA H . . 4.500 3.463 3.051 3.778 . 0 0 "[ . 1 . 2]" 1
1465 2 13 VAL QG 2 14 ASN H . . 3.500 2.792 2.524 3.451 . 0 0 "[ . 1 . 2]" 1
1466 2 48 ALA MB 2 49 VAL H . . 3.500 3.087 2.857 3.374 . 0 0 "[ . 1 . 2]" 1
1467 2 71 GLN H 2 72 ALA MB . . 4.500 4.257 4.093 4.412 . 0 0 "[ . 1 . 2]" 1
1468 2 18 CYS QB 2 72 ALA MB . . 4.500 2.938 2.324 3.958 . 0 0 "[ . 1 . 2]" 1
1469 2 69 ASP QB 2 72 ALA MB . . 3.500 2.701 2.053 3.338 . 0 0 "[ . 1 . 2]" 1
1470 2 72 ALA MB 2 77 LYS QD . . 3.500 2.849 2.103 3.656 0.156 9 0 "[ . 1 . 2]" 1
1471 2 7 ALA MB 2 10 LYS QD . . 3.500 3.417 2.279 3.655 0.155 7 0 "[ . 1 . 2]" 1
1472 2 22 LEU H 2 23 ALA MB . . 4.500 4.120 3.850 4.350 . 0 0 "[ . 1 . 2]" 1
1473 2 23 ALA MB 2 24 VAL HA . . 4.500 4.126 3.950 4.173 . 0 0 "[ . 1 . 2]" 1
1474 2 23 ALA MB 2 24 VAL QG . . 5.500 3.556 3.004 3.997 . 0 0 "[ . 1 . 2]" 1
1475 2 62 ILE MG 2 78 VAL HA . . 4.500 2.758 2.146 3.892 . 0 0 "[ . 1 . 2]" 1
1476 2 62 ILE MG 2 78 VAL H . . 4.500 3.810 3.222 4.514 0.014 1 0 "[ . 1 . 2]" 1
1477 2 62 ILE H 2 62 ILE MG . . 3.500 3.103 2.651 3.643 0.143 18 0 "[ . 1 . 2]" 1
1478 2 62 ILE MG 2 63 VAL H . . 4.500 4.166 3.472 4.496 . 0 0 "[ . 1 . 2]" 1
1479 2 33 VAL QG 2 62 ILE MG . . 3.500 3.439 2.673 3.554 0.054 1 0 "[ . 1 . 2]" 1
1480 2 52 VAL HA 2 55 ILE MG . . 4.500 3.460 3.277 3.730 . 0 0 "[ . 1 . 2]" 1
1481 2 34 GLY H 2 55 ILE MG . . 4.500 4.116 3.833 4.346 . 0 0 "[ . 1 . 2]" 1
1482 2 55 ILE MG 2 56 ALA MB . . 3.500 3.531 3.512 3.553 0.053 2 0 "[ . 1 . 2]" 1
1483 2 55 ILE MD 2 55 ILE MG . . 2.800 2.407 2.221 2.895 0.095 20 0 "[ . 1 . 2]" 1
1484 2 65 ALA MB 2 77 LYS QE . . 3.500 2.809 1.942 3.679 0.179 9 0 "[ . 1 . 2]" 1
1485 2 65 ALA MB 2 68 GLN QG . . 3.500 3.562 3.280 3.635 0.135 9 0 "[ . 1 . 2]" 1
1486 2 52 VAL QG 2 56 ALA MB . . 4.500 2.493 2.011 3.053 . 0 0 "[ . 1 . 2]" 1
1487 2 62 ILE MG 2 65 ALA MB . . 3.500 3.254 2.757 3.566 0.066 1 0 "[ . 1 . 2]" 1
1488 2 32 ALA MB 2 33 VAL H . . 3.500 2.599 2.396 3.120 . 0 0 "[ . 1 . 2]" 1
1489 2 36 ALA MB 2 75 LYS QB . . 4.500 4.210 3.432 4.609 0.109 11 0 "[ . 1 . 2]" 1
1490 2 33 VAL QG 2 36 ALA MB . . 4.500 3.437 3.079 4.183 . 0 0 "[ . 1 . 2]" 1
1491 2 38 ALA MB 2 40 ASN H . . 4.500 4.466 4.348 4.564 0.064 10 0 "[ . 1 . 2]" 1
1492 2 61 ALA MB 2 62 ILE HA . . 4.500 3.976 3.816 4.081 . 0 0 "[ . 1 . 2]" 1
1493 2 61 ALA MB 2 85 ILE MD . . 5.500 2.320 2.105 2.805 . 0 0 "[ . 1 . 2]" 1
1494 2 61 ALA MB 2 84 LYS QG . . 3.500 3.514 3.252 3.617 0.117 10 0 "[ . 1 . 2]" 1
1495 2 85 ILE MG 2 86 LYS H . . 2.800 2.861 2.833 2.897 0.097 19 0 "[ . 1 . 2]" 1
1496 2 85 ILE MG 2 86 LYS HG2 . . 3.500 2.172 2.108 2.292 . 0 0 "[ . 1 . 2]" 1
1497 2 58 VAL MG2 2 85 ILE MG . . 3.500 2.930 2.191 3.335 . 0 0 "[ . 1 . 2]" 1
1498 2 85 ILE MD 2 85 ILE MG . . 2.800 2.133 2.085 2.246 . 0 0 "[ . 1 . 2]" 1
1499 2 62 ILE HA 2 62 ILE MD . . 3.500 3.552 3.059 3.704 0.204 16 0 "[ . 1 . 2]" 1
1500 2 62 ILE H 2 62 ILE MD . . 2.800 2.100 1.669 2.877 0.077 16 0 "[ . 1 . 2]" 1
1501 2 61 ALA MB 2 62 ILE MD . . 3.500 2.958 2.487 3.528 0.028 18 0 "[ . 1 . 2]" 1
1502 2 33 VAL QG 2 62 ILE MD . . 2.800 2.113 2.004 2.365 . 0 0 "[ . 1 . 2]" 1
1503 2 62 ILE MD 2 62 ILE MG . . 2.800 2.043 1.999 2.083 . 0 0 "[ . 1 . 2]" 1
1504 2 85 ILE H 2 85 ILE MD . . 4.500 3.571 3.458 3.810 . 0 0 "[ . 1 . 2]" 1
1505 2 58 VAL MG2 2 85 ILE MD . . 2.800 2.192 2.009 2.451 . 0 0 "[ . 1 . 2]" 1
1506 2 85 ILE MD 2 86 LYS H . . 5.500 4.764 4.665 4.885 . 0 0 "[ . 1 . 2]" 1
1507 2 58 VAL H 2 85 ILE MD . . 4.500 4.075 3.660 4.272 . 0 0 "[ . 1 . 2]" 1
1508 2 41 ASN QD 2 55 ILE MD . . 5.500 5.484 4.867 5.593 0.093 3 0 "[ . 1 . 2]" 1
1509 2 51 ASP H 2 55 ILE MD . . 3.500 2.991 2.555 3.472 . 0 0 "[ . 1 . 2]" 1
1510 2 34 GLY H 2 55 ILE MD . . 4.500 4.268 3.832 4.516 0.016 20 0 "[ . 1 . 2]" 1
1511 2 52 VAL HA 2 55 ILE MD . . 3.500 2.889 2.403 3.376 . 0 0 "[ . 1 . 2]" 1
1512 2 55 ILE HB 2 55 ILE MD . . 3.500 2.261 2.112 2.361 . 0 0 "[ . 1 . 2]" 1
1513 2 64 GLN HA 2 64 GLN HG3 . . 2.800 3.183 2.987 3.773 0.973 9 2 "[ . +1 . - 2]" 1
1514 2 32 ALA HA 2 33 VAL H . . 5.500 3.628 3.568 3.665 . 0 0 "[ . 1 . 2]" 1
1515 2 32 ALA HA 2 36 ALA H . . 4.500 4.581 4.453 4.679 0.179 13 0 "[ . 1 . 2]" 1
1516 2 33 VAL HA 2 34 GLY H . . 4.500 3.562 3.538 3.590 . 0 0 "[ . 1 . 2]" 1
1517 2 33 VAL HA 2 36 ALA H . . 4.500 3.503 3.083 4.052 . 0 0 "[ . 1 . 2]" 1
1518 2 33 VAL HA 2 37 GLU H . . 5.500 3.965 3.421 4.655 . 0 0 "[ . 1 . 2]" 1
1519 2 35 PHE HA 2 36 ALA H . . 4.500 3.513 3.407 3.664 . 0 0 "[ . 1 . 2]" 1
1520 2 35 PHE HA 2 38 ALA H . . 4.500 3.959 3.340 4.379 . 0 0 "[ . 1 . 2]" 1
1521 2 35 PHE HA 2 39 LEU H . . 5.500 4.039 3.509 4.539 . 0 0 "[ . 1 . 2]" 1
1522 2 36 ALA HA 2 37 GLU H . . 4.500 3.610 3.538 3.654 . 0 0 "[ . 1 . 2]" 1
1523 2 36 ALA HA 2 38 ALA H . . 5.500 4.772 4.477 5.069 . 0 0 "[ . 1 . 2]" 1
1524 2 36 ALA HA 2 40 ASN H . . 5.500 4.629 4.079 5.363 . 0 0 "[ . 1 . 2]" 1
1525 2 35 PHE QB 2 36 ALA HA . . 5.500 4.272 3.920 4.862 . 0 0 "[ . 1 . 2]" 1
1526 2 38 ALA HA 2 41 ASN QB . . 5.500 4.557 3.196 5.404 . 0 0 "[ . 1 . 2]" 1
1527 2 38 ALA HA 2 51 ASP QB . . 5.500 5.159 4.502 5.576 0.076 9 0 "[ . 1 . 2]" 1
1528 2 39 LEU HA 2 42 LYS QB . . 5.500 5.321 2.701 5.534 0.034 4 0 "[ . 1 . 2]" 1
1529 2 39 LEU HA 2 42 LYS QE . . 5.500 5.450 4.647 5.689 0.189 11 0 "[ . 1 . 2]" 1
1530 2 26 GLU HA 2 28 PHE H . . 4.500 3.942 3.852 4.119 . 0 0 "[ . 1 . 2]" 1
1531 2 25 ASP HA 2 28 PHE H . . 5.500 4.712 4.582 4.818 . 0 0 "[ . 1 . 2]" 1
1532 2 59 THR HA 2 61 ALA H . . 5.500 4.127 3.935 4.323 . 0 0 "[ . 1 . 2]" 1
1533 2 59 THR HA 2 63 VAL H . . 5.500 4.312 3.980 4.566 . 0 0 "[ . 1 . 2]" 1
1534 2 63 VAL HA 2 64 GLN H . . 4.500 3.577 3.534 3.610 . 0 0 "[ . 1 . 2]" 1
1535 2 63 VAL HA 2 66 CYS H . . 5.500 4.064 3.820 4.345 . 0 0 "[ . 1 . 2]" 1
1536 2 64 GLN HA 2 67 THR H . . 3.500 3.493 3.413 3.536 0.036 10 0 "[ . 1 . 2]" 1
1537 2 65 ALA HA 2 67 THR H . . 5.500 3.867 3.770 3.983 . 0 0 "[ . 1 . 2]" 1
1538 2 74 PHE HA 2 75 LYS H . . 5.500 3.285 2.061 3.678 . 0 0 "[ . 1 . 2]" 1
1539 2 74 PHE HA 2 77 LYS H . . 4.500 3.766 3.150 4.561 0.061 4 0 "[ . 1 . 2]" 1
1540 2 67 THR MG 2 68 GLN QB . . 4.500 4.071 3.276 4.244 . 0 0 "[ . 1 . 2]" 1
1541 2 4 GLN QB 2 6 ALA MB . . 6.000 5.530 4.764 6.068 0.068 15 0 "[ . 1 . 2]" 1
1542 2 8 ASP HA 2 8 ASP HB2 . . 2.800 2.551 2.335 3.026 0.226 16 0 "[ . 1 . 2]" 1
1543 2 10 LYS H 2 10 LYS HB2 . . 3.500 3.003 2.119 3.946 0.446 9 0 "[ . 1 . 2]" 1
1544 2 10 LYS H 2 10 LYS QE . . 4.500 4.368 3.742 4.594 0.094 19 0 "[ . 1 . 2]" 1
1545 2 12 PRO HB2 2 13 VAL H . . 4.500 2.887 2.359 3.562 . 0 0 "[ . 1 . 2]" 1
1546 2 35 PHE QB 2 39 LEU QD . . 5.500 3.597 3.007 4.025 . 0 0 "[ . 1 . 2]" 1
1547 2 38 ALA H 2 39 LEU QD . . 5.500 3.643 3.410 3.983 . 0 0 "[ . 1 . 2]" 1
1548 2 14 ASN QB 2 14 ASN HD22 . . 3.500 2.344 2.165 2.464 . 0 0 "[ . 1 . 2]" 1
1549 2 14 ASN H 2 14 ASN QB . . 3.500 2.463 2.218 3.277 . 0 0 "[ . 1 . 2]" 1
1550 2 14 ASN QB 2 75 LYS QD . . 5.500 4.219 2.302 5.504 0.004 5 0 "[ . 1 . 2]" 1
1551 2 12 PRO HG2 2 15 SER QB . . 4.500 2.958 2.210 4.802 0.302 19 0 "[ . 1 . 2]" 1
1552 2 16 TRP QB 2 17 THR H . . 4.500 3.056 2.213 3.729 . 0 0 "[ . 1 . 2]" 1
1553 2 16 TRP H 2 16 TRP HB2 . . 3.500 2.751 2.178 3.668 0.168 14 0 "[ . 1 . 2]" 1
1554 2 16 TRP QB 2 20 ASP QB . . 5.500 3.556 2.405 5.193 . 0 0 "[ . 1 . 2]" 1
1555 2 17 THR HA 2 19 GLU H . . 4.500 4.260 4.028 4.476 . 0 0 "[ . 1 . 2]" 1
1556 2 18 CYS QB 2 19 GLU H . . 4.500 3.105 2.947 3.609 . 0 0 "[ . 1 . 2]" 1
1557 2 19 GLU HA 2 20 ASP H . . 4.500 3.586 3.545 3.621 . 0 0 "[ . 1 . 2]" 1
1558 2 79 LYS HA 2 82 TRP H . . 4.500 3.519 3.350 3.760 . 0 0 "[ . 1 . 2]" 1
1559 2 19 GLU H 2 19 GLU QB . . 3.500 2.184 2.138 2.215 . 0 0 "[ . 1 . 2]" 1
1560 2 20 ASP HA 2 23 ALA H . . 4.500 3.138 2.796 3.557 . 0 0 "[ . 1 . 2]" 1
1561 2 20 ASP HA 2 22 LEU H . . 5.500 3.934 3.572 4.381 . 0 0 "[ . 1 . 2]" 1
1562 2 17 THR H 2 20 ASP QB . . 4.500 3.567 2.490 4.436 . 0 0 "[ . 1 . 2]" 1
1563 2 18 CYS HA 2 21 PHE HB3 . . 4.500 3.230 2.261 4.246 . 0 0 "[ . 1 . 2]" 1
1564 2 21 PHE H 2 21 PHE HB3 . . 2.800 2.694 2.480 3.630 0.830 3 1 "[ + . 1 . 2]" 1
1565 2 21 PHE HB3 2 22 LEU H . . 3.500 3.153 2.770 3.961 0.461 3 0 "[ . 1 . 2]" 1
1566 2 22 LEU H 2 22 LEU HB2 . . 3.500 2.457 2.167 2.595 . 0 0 "[ . 1 . 2]" 1
1567 2 22 LEU H 2 22 LEU QB . . 3.500 2.410 2.087 2.544 . 0 0 "[ . 1 . 2]" 1
1568 2 22 LEU HB2 2 23 ALA H . . 3.500 3.430 3.127 4.123 0.623 3 1 "[ + . 1 . 2]" 1
1569 2 22 LEU QB 2 23 ALA H . . 3.500 3.234 3.041 3.472 . 0 0 "[ . 1 . 2]" 1
1570 2 19 GLU HA 2 22 LEU QB . . 4.500 3.352 2.611 4.026 . 0 0 "[ . 1 . 2]" 1
1571 2 19 GLU HA 2 22 LEU HB2 . . 4.500 3.435 2.640 4.116 . 0 0 "[ . 1 . 2]" 1
1572 2 22 LEU HG 2 23 ALA H . . 5.500 4.807 4.383 5.554 0.054 7 0 "[ . 1 . 2]" 1
1573 2 67 THR HA 2 70 LYS QG . . 4.500 2.557 2.169 3.628 . 0 0 "[ . 1 . 2]" 1
1574 2 22 LEU QD 2 66 CYS H . . 5.500 4.100 3.797 4.542 . 0 0 "[ . 1 . 2]" 1
1575 2 24 VAL HB 2 25 ASP H . . 4.500 4.020 3.938 4.200 . 0 0 "[ . 1 . 2]" 1
1576 2 24 VAL QG 2 28 PHE H . . 3.500 3.308 3.187 3.506 0.006 17 0 "[ . 1 . 2]" 1
1577 2 26 GLU HA 2 29 GLN QG . . 4.500 3.371 2.413 3.736 . 0 0 "[ . 1 . 2]" 1
1578 2 24 VAL QG 2 26 GLU HA . . 5.500 4.719 4.487 4.935 . 0 0 "[ . 1 . 2]" 1
1579 2 25 ASP QB 2 26 GLU HB2 . . 5.500 4.784 4.304 5.036 . 0 0 "[ . 1 . 2]" 1
1580 2 25 ASP QB 2 26 GLU HG3 . . 4.500 4.473 3.854 4.756 0.256 7 0 "[ . 1 . 2]" 1
1581 2 28 PHE QB 2 31 THR HA . . 5.500 5.518 5.485 5.539 0.039 8 0 "[ . 1 . 2]" 1
1582 2 28 PHE HB3 2 31 THR HA . . 5.500 5.762 5.719 5.785 0.285 8 0 "[ . 1 . 2]" 1
1583 2 26 GLU HA 2 29 GLN HA . . 5.500 5.230 4.901 5.476 . 0 0 "[ . 1 . 2]" 1
1584 2 29 GLN QB 2 31 THR H . . 4.500 4.531 4.471 4.563 0.063 15 0 "[ . 1 . 2]" 1
1585 2 29 GLN QG 2 31 THR H . . 5.500 5.483 5.384 5.621 0.121 3 0 "[ . 1 . 2]" 1
1586 2 29 GLN H 2 29 GLN QG . . 4.500 2.677 2.565 2.877 . 0 0 "[ . 1 . 2]" 1
1587 2 30 PRO HB3 2 31 THR H . . 4.500 4.288 4.211 4.401 . 0 0 "[ . 1 . 2]" 1
1588 2 30 PRO QG 2 55 ILE MG . . 3.500 3.521 3.446 3.554 0.054 2 0 "[ . 1 . 2]" 1
1589 2 45 PRO HD3 2 46 GLU H . . 4.500 4.029 3.845 4.472 . 0 0 "[ . 1 . 2]" 1
1590 2 30 PRO HD2 2 31 THR H . . 4.500 2.848 2.733 3.015 . 0 0 "[ . 1 . 2]" 1
1591 2 28 PHE H 2 30 PRO HD2 . . 4.500 3.895 3.693 4.218 . 0 0 "[ . 1 . 2]" 1
1592 2 32 ALA MB 2 33 VAL HB . . 4.500 4.338 4.119 4.595 0.095 5 0 "[ . 1 . 2]" 1
1593 2 31 THR MG 2 34 GLY QA . . 5.500 4.092 3.818 4.304 . 0 0 "[ . 1 . 2]" 1
1594 2 34 GLY QA 2 55 ILE QG . . 4.500 3.220 2.677 3.611 . 0 0 "[ . 1 . 2]" 1
1595 2 34 GLY QA 2 55 ILE MG . . 4.500 4.086 3.769 4.337 . 0 0 "[ . 1 . 2]" 1
1596 2 33 VAL QG 2 34 GLY QA . . 5.500 3.279 3.094 3.559 . 0 0 "[ . 1 . 2]" 1
1597 2 36 ALA MB 2 38 ALA H . . 5.500 4.568 4.183 4.782 . 0 0 "[ . 1 . 2]" 1
1598 2 33 VAL QG 2 37 GLU QB . . 5.500 2.962 2.491 3.603 . 0 0 "[ . 1 . 2]" 1
1599 2 33 VAL QG 2 37 GLU HB2 . . 5.500 3.131 2.572 4.391 . 0 0 "[ . 1 . 2]" 1
1600 2 37 GLU QG 2 40 ASN H . . 5.500 5.483 5.206 5.588 0.088 7 0 "[ . 1 . 2]" 1
1601 2 37 GLU H 2 37 GLU QG . . 4.500 3.044 2.169 4.071 . 0 0 "[ . 1 . 2]" 1
1602 2 35 PHE H 2 38 ALA MB . . 5.500 4.254 3.765 4.570 . 0 0 "[ . 1 . 2]" 1
1603 2 39 LEU HA 2 42 LYS H . . 5.500 3.832 3.179 4.167 . 0 0 "[ . 1 . 2]" 1
1604 2 39 LEU HB2 2 40 ASN H . . 3.500 2.797 2.575 3.200 . 0 0 "[ . 1 . 2]" 1
1605 2 39 LEU QB 2 40 ASN H . . 3.500 2.722 2.518 3.096 . 0 0 "[ . 1 . 2]" 1
1606 2 38 ALA MB 2 39 LEU QB . . 5.500 4.103 4.018 4.166 . 0 0 "[ . 1 . 2]" 1
1607 2 40 ASN H 2 40 ASN QB . . 2.800 2.211 2.105 2.660 . 0 0 "[ . 1 . 2]" 1
1608 2 41 ASN H 2 41 ASN QB . . 3.500 2.479 2.185 2.739 . 0 0 "[ . 1 . 2]" 1
1609 2 41 ASN QB 2 42 LYS H . . 4.500 3.760 3.221 4.064 . 0 0 "[ . 1 . 2]" 1
1610 2 40 ASN HA 2 40 ASN QB . . 2.800 2.375 2.142 2.528 . 0 0 "[ . 1 . 2]" 1
1611 2 42 LYS H 2 42 LYS HD2 . . 4.500 4.983 4.848 5.286 0.786 11 7 "[* * ** 1+* . - 2]" 1
1612 2 14 ASN QD 2 75 LYS QD . . 4.500 3.691 2.330 4.540 0.040 3 0 "[ . 1 . 2]" 1
1613 2 39 LEU HA 2 42 LYS HD2 . . 5.500 5.169 4.627 6.375 0.875 11 1 "[ . 1+ . 2]" 1
1614 2 42 LYS HA 2 42 LYS HD2 . . 5.500 5.421 3.724 5.584 0.084 15 0 "[ . 1 . 2]" 1
1615 2 14 ASN HA 2 75 LYS QD . . 4.500 3.688 2.342 4.540 0.040 5 0 "[ . 1 . 2]" 1
1616 2 13 VAL QG 2 75 LYS QD . . 4.500 3.732 2.349 4.565 0.065 18 0 "[ . 1 . 2]" 1
1617 2 41 ASN QD 2 42 LYS QE . . 5.500 3.440 2.417 4.793 . 0 0 "[ . 1 . 2]" 1
1618 2 45 PRO HA 2 48 ALA H . . 4.500 2.901 2.622 3.122 . 0 0 "[ . 1 . 2]" 1
1619 2 45 PRO HA 2 47 ASP H . . 5.500 3.543 3.204 3.861 . 0 0 "[ . 1 . 2]" 1
1620 2 45 PRO HA 2 46 GLU H . . 4.500 3.278 2.867 3.368 . 0 0 "[ . 1 . 2]" 1
1621 2 45 PRO HB2 2 46 GLU H . . 5.500 4.256 4.099 4.530 . 0 0 "[ . 1 . 2]" 1
1622 2 44 LYS H 2 45 PRO HD3 . . 4.500 4.949 4.082 5.044 0.544 12 8 "[ * .** -1 + *.* * 2]" 1
1623 2 63 VAL QG 2 64 GLN HG3 . . 4.500 2.901 2.178 4.449 . 0 0 "[ . 1 . 2]" 1
1624 2 44 LYS QG 2 46 GLU QG . . 4.500 4.310 3.647 4.554 0.054 2 0 "[ . 1 . 2]" 1
1625 2 47 ASP QB 2 48 ALA H . . 4.500 3.776 3.193 4.135 . 0 0 "[ . 1 . 2]" 1
1626 2 47 ASP QB 2 49 VAL QG . . 5.500 4.794 4.124 5.276 . 0 0 "[ . 1 . 2]" 1
1627 2 50 LEU HA 2 51 ASP HB2 . . 5.500 4.469 4.159 4.682 . 0 0 "[ . 1 . 2]" 1
1628 2 50 LEU QD 2 51 ASP H . . 2.800 2.394 2.119 2.597 . 0 0 "[ . 1 . 2]" 1
1629 2 50 LEU QD 2 52 VAL HA . . 4.500 2.897 2.436 3.919 . 0 0 "[ . 1 . 2]" 1
1630 2 51 ASP H 2 51 ASP QB . . 3.500 2.305 2.198 2.449 . 0 0 "[ . 1 . 2]" 1
1631 2 52 VAL HA 2 55 ILE HA . . 5.500 5.025 4.673 5.504 0.004 1 0 "[ . 1 . 2]" 1
1632 2 51 ASP HA 2 52 VAL HB . . 5.500 5.242 4.742 5.481 . 0 0 "[ . 1 . 2]" 1
1633 2 50 LEU QD 2 52 VAL QG . . 4.500 2.292 2.030 3.061 . 0 0 "[ . 1 . 2]" 1
1634 2 54 GLY QA 2 55 ILE QG . . 5.500 4.121 3.896 4.636 . 0 0 "[ . 1 . 2]" 1
1635 2 52 VAL QG 2 54 GLY QA . . 5.500 5.327 5.019 5.511 0.011 1 0 "[ . 1 . 2]" 1
1636 2 54 GLY QA 2 55 ILE MD . . 5.500 4.547 3.459 4.980 . 0 0 "[ . 1 . 2]" 1
1637 2 54 GLY H 2 55 ILE HB . . 5.500 4.512 4.300 4.650 . 0 0 "[ . 1 . 2]" 1
1638 2 55 ILE HB 2 56 ALA MB . . 5.500 4.205 4.026 4.391 . 0 0 "[ . 1 . 2]" 1
1639 2 51 ASP H 2 55 ILE QG . . 5.500 4.981 4.401 5.537 0.037 15 0 "[ . 1 . 2]" 1
1640 2 63 VAL H 2 65 ALA MB . . 4.500 4.613 4.569 4.672 0.172 17 0 "[ . 1 . 2]" 1
1641 2 65 ALA MB 2 68 GLN QE . . 5.500 5.195 3.413 5.505 0.005 12 0 "[ . 1 . 2]" 1
1642 2 65 ALA MB 2 66 CYS HA . . 4.500 4.133 4.053 4.191 . 0 0 "[ . 1 . 2]" 1
1643 2 57 THR HB 2 58 VAL HB . . 5.500 4.445 4.140 5.381 . 0 0 "[ . 1 . 2]" 1
1644 2 57 THR HB 2 85 ILE MD . . 4.500 4.216 3.859 4.369 . 0 0 "[ . 1 . 2]" 1
1645 2 57 THR HB 2 85 ILE MG . . 5.500 4.319 3.645 4.719 . 0 0 "[ . 1 . 2]" 1
1646 2 57 THR MG 2 58 VAL H . . 3.500 3.284 2.971 3.468 . 0 0 "[ . 1 . 2]" 1
1647 2 57 THR MG 2 58 VAL HB . . 4.500 4.557 4.538 4.593 0.093 13 0 "[ . 1 . 2]" 1
1648 2 57 THR MG 2 85 ILE MD . . 3.500 2.231 2.080 2.351 . 0 0 "[ . 1 . 2]" 1
1649 2 57 THR MG 2 85 ILE MG . . 3.500 2.470 2.099 3.029 . 0 0 "[ . 1 . 2]" 1
1650 2 58 VAL HA 2 85 ILE MG . . 5.500 4.482 3.847 5.162 . 0 0 "[ . 1 . 2]" 1
1651 2 58 VAL MG1 2 61 ALA H . . 5.500 4.284 3.824 4.709 . 0 0 "[ . 1 . 2]" 1
1652 2 58 VAL MG1 2 62 ILE H . . 5.500 3.546 3.167 3.764 . 0 0 "[ . 1 . 2]" 1
1653 2 58 VAL MG2 2 62 ILE H . . 5.500 5.452 5.304 5.714 0.214 4 0 "[ . 1 . 2]" 1
1654 2 58 VAL MG2 2 61 ALA MB . . 3.500 3.755 3.546 4.209 0.709 4 2 "[ +. 1 - . 2]" 1
1655 2 59 THR HA 2 60 PRO QD . . 5.500 3.678 3.670 3.697 . 0 0 "[ . 1 . 2]" 1
1656 2 59 THR HA 2 62 ILE QG . . 5.500 3.656 2.457 5.102 . 0 0 "[ . 1 . 2]" 1
1657 2 59 THR MG 2 63 VAL H . . 4.500 4.393 4.053 4.541 0.041 3 0 "[ . 1 . 2]" 1
1658 2 59 THR MG 2 62 ILE H . . 5.500 5.245 5.007 5.492 . 0 0 "[ . 1 . 2]" 1
1659 2 59 THR MG 2 61 ALA H . . 4.500 4.589 4.555 4.617 0.117 1 0 "[ . 1 . 2]" 1
1660 2 60 PRO HA 2 61 ALA H . . 4.500 3.469 3.407 3.504 . 0 0 "[ . 1 . 2]" 1
1661 2 59 THR MG 2 60 PRO HA . . 4.500 3.192 3.046 3.380 . 0 0 "[ . 1 . 2]" 1
1662 2 60 PRO QG 2 61 ALA H . . 4.500 2.840 2.589 3.099 . 0 0 "[ . 1 . 2]" 1
1663 2 61 ALA MB 2 63 VAL H . . 4.500 4.404 4.303 4.565 0.065 4 0 "[ . 1 . 2]" 1
1664 2 58 VAL H 2 61 ALA MB . . 5.500 5.125 4.946 5.276 . 0 0 "[ . 1 . 2]" 1
1665 2 62 ILE HA 2 63 VAL H . . 5.500 3.503 3.450 3.577 . 0 0 "[ . 1 . 2]" 1
1666 2 62 ILE HA 2 81 GLU HG2 . . 4.500 3.443 2.916 3.935 . 0 0 "[ . 1 . 2]" 1
1667 2 62 ILE MD 2 63 VAL H . . 4.500 3.992 3.528 4.547 0.047 5 0 "[ . 1 . 2]" 1
1668 2 61 ALA H 2 62 ILE MD . . 5.500 3.916 3.479 4.740 . 0 0 "[ . 1 . 2]" 1
1669 2 33 VAL HA 2 62 ILE MD . . 5.500 4.475 4.059 4.657 . 0 0 "[ . 1 . 2]" 1
1670 2 62 ILE MD 2 81 GLU HG2 . . 4.500 4.405 3.371 4.980 0.480 6 0 "[ . 1 . 2]" 1
1671 2 62 ILE MG 2 81 GLU HG2 . . 5.500 3.205 2.304 4.469 . 0 0 "[ . 1 . 2]" 1
1672 2 22 LEU HG 2 66 CYS HB2 . . 5.500 4.397 3.353 5.765 0.265 7 0 "[ . 1 . 2]" 1
1673 2 22 LEU HG 2 66 CYS QB . . 5.500 3.528 2.461 4.883 . 0 0 "[ . 1 . 2]" 1
1674 2 67 THR HA 2 68 GLN HA . . 5.500 4.852 4.644 4.909 . 0 0 "[ . 1 . 2]" 1
1675 2 22 LEU QD 2 67 THR HB . . 5.500 2.498 2.268 2.675 . 0 0 "[ . 1 . 2]" 1
1676 2 67 THR MG 2 68 GLN QG . . 5.500 2.957 2.734 3.525 . 0 0 "[ . 1 . 2]" 1
1677 2 18 CYS H 2 70 LYS HA . . 4.500 4.197 3.947 4.426 . 0 0 "[ . 1 . 2]" 1
1678 2 70 LYS QB 2 70 LYS HE3 . . 4.500 4.186 4.076 4.580 0.080 19 0 "[ . 1 . 2]" 1
1679 2 22 LEU QD 2 70 LYS QB . . 5.500 3.911 3.584 4.384 . 0 0 "[ . 1 . 2]" 1
1680 2 70 LYS H 2 70 LYS QD . . 2.800 2.714 2.118 2.875 0.075 20 0 "[ . 1 . 2]" 1
1681 2 19 GLU HG3 2 70 LYS QD . . 5.500 4.084 3.425 5.649 0.149 12 0 "[ . 1 . 2]" 1
1682 2 22 LEU QD 2 70 LYS QD . . 4.500 3.511 3.032 4.054 . 0 0 "[ . 1 . 2]" 1
1683 2 70 LYS H 2 70 LYS HE3 . . 4.500 4.195 3.993 4.532 0.032 6 0 "[ . 1 . 2]" 1
1684 2 71 GLN QB 2 72 ALA H . . 3.500 3.460 3.258 3.539 0.039 4 0 "[ . 1 . 2]" 1
1685 2 70 LYS QG 2 71 GLN QG . . 4.500 4.593 4.527 4.646 0.146 18 0 "[ . 1 . 2]" 1
1686 2 18 CYS H 2 72 ALA MB . . 5.500 3.756 3.269 4.254 . 0 0 "[ . 1 . 2]" 1
1687 2 71 GLN HA 2 72 ALA MB . . 5.500 4.881 4.779 4.965 . 0 0 "[ . 1 . 2]" 1
1688 2 73 ASN H 2 73 ASN QB . . 2.800 2.265 2.139 2.426 . 0 0 "[ . 1 . 2]" 1
1689 2 74 PHE HA 2 77 LYS HB2 . . 4.500 3.790 2.380 5.124 0.624 2 3 "[ + . 1-* . 2]" 1
1690 2 74 PHE HA 2 78 VAL QG . . 5.500 4.380 3.736 5.562 0.062 8 0 "[ . 1 . 2]" 1
1691 2 75 LYS H 2 75 LYS HG2 . . 4.500 4.582 4.423 4.993 0.493 7 0 "[ . 1 . 2]" 1
1692 2 75 LYS HG2 2 76 ASP H . . 4.500 4.457 3.943 5.271 0.771 4 2 "[ +. 1- . 2]" 1
1693 2 81 GLU HA 2 82 TRP H . . 4.500 3.605 3.575 3.634 . 0 0 "[ . 1 . 2]" 1
1694 2 77 LYS H 2 77 LYS QD . . 4.500 3.884 2.638 4.602 0.102 11 0 "[ . 1 . 2]" 1
1695 2 78 VAL HA 2 79 LYS H . . 4.500 3.598 3.571 3.620 . 0 0 "[ . 1 . 2]" 1
1696 2 78 VAL QG 2 81 GLU HB2 . . 5.500 4.477 4.119 4.811 . 0 0 "[ . 1 . 2]" 1
1697 2 81 GLU H 2 81 GLU QB . . 2.800 2.458 2.364 2.515 . 0 0 "[ . 1 . 2]" 1
1698 2 81 GLU QB 2 82 TRP H . . 3.500 2.856 2.767 2.975 . 0 0 "[ . 1 . 2]" 1
1699 2 62 ILE HA 2 81 GLU QG . . 4.500 2.728 2.382 3.001 . 0 0 "[ . 1 . 2]" 1
1700 2 82 TRP HA 2 85 ILE MD . . 4.500 3.109 2.690 3.927 . 0 0 "[ . 1 . 2]" 1
1701 2 82 TRP HA 2 85 ILE MG . . 4.500 3.493 3.348 3.641 . 0 0 "[ . 1 . 2]" 1
1702 2 82 TRP HA 2 85 ILE H . . 4.500 3.397 3.256 3.520 . 0 0 "[ . 1 . 2]" 1
1703 2 78 VAL QG 2 82 TRP HB3 . . 5.500 4.764 4.099 5.986 0.486 4 0 "[ . 1 . 2]" 1
1704 2 83 ASP HA 2 85 ILE H . . 4.500 4.104 3.867 4.308 . 0 0 "[ . 1 . 2]" 1
1705 2 82 TRP HB3 2 83 ASP HA . . 4.500 4.439 4.072 4.590 0.090 12 0 "[ . 1 . 2]" 1
1706 2 83 ASP QB 2 87 LYS HG2 . . 5.500 4.145 3.435 4.619 . 0 0 "[ . 1 . 2]" 1
1707 2 83 ASP QB 2 84 LYS QB . . 4.500 3.907 3.787 4.288 . 0 0 "[ . 1 . 2]" 1
1708 2 83 ASP QB 2 84 LYS H . . 2.800 2.572 2.454 2.966 0.166 14 0 "[ . 1 . 2]" 1
1709 2 84 LYS HA 2 88 ASP QB . . 4.500 3.179 2.113 4.521 0.021 8 0 "[ . 1 . 2]" 1
1710 2 84 LYS QB 2 85 ILE QG . . 5.500 4.231 2.851 4.561 . 0 0 "[ . 1 . 2]" 1
1711 2 5 LYS H 2 5 LYS HD2 . . 4.500 4.063 2.631 5.046 0.546 20 1 "[ . 1 . +]" 1
1712 2 86 LYS HA 2 88 ASP H . . 4.500 4.547 4.474 4.603 0.103 11 0 "[ . 1 . 2]" 1
1713 2 85 ILE H 2 86 LYS HA . . 5.500 5.272 5.071 5.365 . 0 0 "[ . 1 . 2]" 1
1714 2 85 ILE MG 2 86 LYS HA . . 4.500 3.417 3.296 3.619 . 0 0 "[ . 1 . 2]" 1
1715 2 83 ASP HA 2 86 LYS QB . . 4.500 3.505 3.187 3.734 . 0 0 "[ . 1 . 2]" 1
1716 2 83 ASP QB 2 86 LYS QB . . 5.500 5.268 4.916 5.549 0.049 14 0 "[ . 1 . 2]" 1
1717 2 77 LYS H 2 77 LYS QG . . 4.500 3.948 2.888 4.144 . 0 0 "[ . 1 . 2]" 1
1718 2 85 ILE H 2 86 LYS QG . . 4.500 4.099 3.710 4.365 . 0 0 "[ . 1 . 2]" 1
1719 2 85 ILE MG 2 86 LYS QG . . 4.500 2.128 2.056 2.174 . 0 0 "[ . 1 . 2]" 1
1720 2 86 LYS HA 2 86 LYS QD . . 3.500 2.657 2.270 3.649 0.149 14 0 "[ . 1 . 2]" 1
1721 2 69 ASP HA 2 77 LYS QE . . 5.500 5.297 4.679 5.549 0.049 12 0 "[ . 1 . 2]" 1
1722 2 86 LYS QG 2 87 LYS HA . . 5.500 5.581 5.531 5.652 0.152 4 0 "[ . 1 . 2]" 1
1723 2 21 PHE H 2 70 LYS HA . . 5.500 5.650 5.566 5.741 0.241 14 0 "[ . 1 . 2]" 1
1724 2 26 GLU QB 2 29 GLN QB . . 5.500 4.201 3.941 4.444 . 0 0 "[ . 1 . 2]" 1
1725 2 58 VAL HB 2 61 ALA MB . . 5.500 4.914 4.256 5.115 . 0 0 "[ . 1 . 2]" 1
1726 2 14 ASN HA 2 75 LYS HB2 . . 4.500 3.088 2.188 4.733 0.233 7 0 "[ . 1 . 2]" 1
1727 2 52 VAL QG 2 55 ILE MD . . 4.500 3.867 2.979 4.453 . 0 0 "[ . 1 . 2]" 1
1728 2 71 GLN QG 2 72 ALA H . . 4.500 4.407 4.345 4.501 0.001 12 0 "[ . 1 . 2]" 1
1729 2 13 VAL QG 2 35 PHE QB . . 5.500 2.990 2.512 4.731 . 0 0 "[ . 1 . 2]" 1
1730 2 13 VAL HA 2 15 SER H . . 5.500 3.907 3.450 4.401 . 0 0 "[ . 1 . 2]" 1
1731 2 18 CYS H 2 19 GLU H . . 3.500 2.862 2.618 3.063 . 0 0 "[ . 1 . 2]" 1
1732 2 17 THR HB 2 18 CYS H . . 2.800 2.364 2.169 2.681 . 0 0 "[ . 1 . 2]" 1
1733 2 14 ASN H 2 15 SER H . . 3.500 2.492 2.100 2.750 . 0 0 "[ . 1 . 2]" 1
1734 2 65 ALA H 2 66 CYS H . . 2.800 2.851 2.840 2.868 0.068 7 0 "[ . 1 . 2]" 1
1735 2 66 CYS H 2 67 THR H . . 2.800 2.744 2.676 2.824 0.024 3 0 "[ . 1 . 2]" 1
1736 2 26 GLU H 2 26 GLU QB . . 2.800 2.707 2.683 2.742 . 0 0 "[ . 1 . 2]" 1
1737 2 63 VAL H 2 64 GLN H . . 2.800 2.807 2.714 2.834 0.034 1 0 "[ . 1 . 2]" 1
1738 2 82 TRP H 2 83 ASP H . . 2.800 2.750 2.615 2.812 0.012 14 0 "[ . 1 . 2]" 1
1739 2 81 GLU H 2 82 TRP H . . 2.800 2.767 2.678 2.814 0.014 4 0 "[ . 1 . 2]" 1
1740 2 1 ALA HA 2 2 ASP H . . 3.500 2.341 2.160 2.656 . 0 0 "[ . 1 . 2]" 1
1741 2 2 ASP H 2 2 ASP QB . . 3.500 2.589 2.157 3.209 . 0 0 "[ . 1 . 2]" 1
1742 2 46 GLU H 2 47 ASP H . . 2.800 2.740 2.472 2.814 0.014 4 0 "[ . 1 . 2]" 1
1743 2 33 VAL H 2 34 GLY H . . 3.500 2.619 2.299 2.804 . 0 0 "[ . 1 . 2]" 1
1744 2 64 GLN H 2 66 CYS H . . 4.500 4.318 4.198 4.385 . 0 0 "[ . 1 . 2]" 1
1745 2 66 CYS H 2 68 GLN H . . 5.500 4.201 4.107 4.405 . 0 0 "[ . 1 . 2]" 1
1746 2 26 GLU H 2 27 SER H . . 2.800 2.670 2.606 2.790 . 0 0 "[ . 1 . 2]" 1
1747 2 2 ASP HA 2 3 ALA H . . 3.500 2.806 2.090 3.592 0.092 14 0 "[ . 1 . 2]" 1
1748 2 6 ALA H 2 6 ALA MB . . 2.800 2.346 2.158 2.837 0.037 15 0 "[ . 1 . 2]" 1
1749 2 5 LYS HB2 2 6 ALA H . . 4.500 4.280 3.195 4.589 0.089 16 0 "[ . 1 . 2]" 1
1750 2 31 THR HA 2 32 ALA H . . 3.500 3.554 3.540 3.567 0.067 5 0 "[ . 1 . 2]" 1
1751 2 31 THR H 2 32 ALA H . . 2.800 2.517 2.384 2.591 . 0 0 "[ . 1 . 2]" 1
1752 2 15 SER HA 2 16 TRP H . . 3.500 3.442 2.624 3.611 0.111 10 0 "[ . 1 . 2]" 1
1753 2 15 SER H 2 16 TRP H . . 2.800 2.152 1.877 2.767 . 0 0 "[ . 1 . 2]" 1
1754 2 52 VAL H 2 52 VAL QG . . 3.500 2.134 1.900 2.948 . 0 0 "[ . 1 . 2]" 1
1755 2 52 VAL H 2 52 VAL HB . . 3.500 2.772 2.174 3.016 . 0 0 "[ . 1 . 2]" 1
1756 2 52 VAL H 2 52 VAL HA . . 2.800 2.819 2.780 2.849 0.049 5 0 "[ . 1 . 2]" 1
1757 2 88 ASP H 2 89 MET H . . 2.800 2.835 2.764 2.923 0.123 15 0 "[ . 1 . 2]" 1
1758 2 28 PHE H 2 29 GLN H . . 2.800 2.106 2.056 2.201 . 0 0 "[ . 1 . 2]" 1
1759 2 47 ASP HA 2 48 ALA H . . 3.500 3.258 3.018 3.483 . 0 0 "[ . 1 . 2]" 1
1760 2 47 ASP H 2 48 ALA H . . 2.800 2.495 2.271 2.721 . 0 0 "[ . 1 . 2]" 1
1761 2 34 GLY HA2 2 35 PHE H . . 4.500 3.571 3.158 3.680 . 0 0 "[ . 1 . 2]" 1
1762 2 32 ALA HA 2 35 PHE H . . 4.500 3.382 3.129 4.177 . 0 0 "[ . 1 . 2]" 1
1763 2 35 PHE H 2 36 ALA H . . 2.800 2.677 1.986 2.901 0.101 4 0 "[ . 1 . 2]" 1
1764 2 34 GLY H 2 35 PHE H . . 3.500 3.131 2.936 3.265 . 0 0 "[ . 1 . 2]" 1
1765 2 55 ILE H 2 55 ILE MD . . 3.500 2.960 1.985 3.357 . 0 0 "[ . 1 . 2]" 1
1766 2 52 VAL HA 2 55 ILE H . . 3.500 3.133 2.735 3.616 0.116 1 0 "[ . 1 . 2]" 1
1767 2 54 GLY H 2 55 ILE H . . 2.800 2.652 2.417 2.787 . 0 0 "[ . 1 . 2]" 1
1768 2 62 ILE HA 2 65 ALA H . . 3.500 3.259 2.929 3.505 0.005 13 0 "[ . 1 . 2]" 1
1769 2 64 GLN H 2 65 ALA H . . 2.800 2.661 2.564 2.767 . 0 0 "[ . 1 . 2]" 1
1770 2 5 LYS H 2 5 LYS QB . . 3.500 2.767 2.338 3.332 . 0 0 "[ . 1 . 2]" 1
1771 2 10 LYS HA 2 11 LYS H . . 3.500 2.608 1.996 3.540 0.040 11 0 "[ . 1 . 2]" 1
1772 2 62 ILE H 2 63 VAL H . . 2.800 2.719 2.649 2.824 0.024 13 0 "[ . 1 . 2]" 1
1773 2 77 LYS H 2 77 LYS HG3 . . 4.500 4.442 3.839 4.601 0.101 9 0 "[ . 1 . 2]" 1
1774 2 77 LYS H 2 77 LYS HA . . 2.800 2.885 2.869 2.910 0.110 16 0 "[ . 1 . 2]" 1
1775 2 76 ASP HA 2 77 LYS H . . 4.500 3.592 3.527 3.620 . 0 0 "[ . 1 . 2]" 1
1776 2 77 LYS H 2 78 VAL H . . 2.800 2.725 2.554 2.823 0.023 15 0 "[ . 1 . 2]" 1
1777 2 76 ASP H 2 77 LYS H . . 2.800 2.789 2.670 2.833 0.033 11 0 "[ . 1 . 2]" 1
1778 2 85 ILE H 2 86 LYS H . . 2.800 2.553 2.284 2.670 . 0 0 "[ . 1 . 2]" 1
1779 2 37 GLU H 2 38 ALA H . . 2.800 2.623 2.253 2.820 0.020 14 0 "[ . 1 . 2]" 1
1780 2 61 ALA H 2 62 ILE H . . 2.800 2.770 2.638 2.829 0.029 3 0 "[ . 1 . 2]" 1
1781 2 70 LYS H 2 71 GLN H . . 2.800 2.821 2.747 2.859 0.059 5 0 "[ . 1 . 2]" 1
1782 2 24 VAL H 2 25 ASP H . . 4.500 4.473 2.813 4.581 0.081 14 0 "[ . 1 . 2]" 1
1783 2 23 ALA H 2 24 VAL H . . 2.800 2.445 2.091 2.638 . 0 0 "[ . 1 . 2]" 1
1784 2 71 GLN H 2 72 ALA H . . 2.800 2.672 2.550 2.784 . 0 0 "[ . 1 . 2]" 1
1785 2 71 GLN HA 2 72 ALA H . . 3.500 3.361 3.292 3.466 . 0 0 "[ . 1 . 2]" 1
1786 2 18 CYS QB 2 72 ALA H . . 4.500 3.096 2.673 4.282 . 0 0 "[ . 1 . 2]" 1
1787 2 10 LYS H 2 10 LYS QB . . 3.500 2.732 2.101 3.377 . 0 0 "[ . 1 . 2]" 1
1788 2 10 LYS H 2 10 LYS HA . . 2.800 2.810 2.252 2.962 0.162 15 0 "[ . 1 . 2]" 1
1789 2 9 ASN HA 2 10 LYS H . . 3.500 3.223 2.524 3.532 0.032 13 0 "[ . 1 . 2]" 1
1790 2 10 LYS H 2 11 LYS H . . 4.500 4.025 2.571 4.543 0.043 5 0 "[ . 1 . 2]" 1
1791 2 19 GLU H 2 70 LYS QB . . 3.500 3.393 3.288 3.505 0.005 7 0 "[ . 1 . 2]" 1
1792 2 17 THR HB 2 19 GLU H . . 3.500 2.772 2.410 3.128 . 0 0 "[ . 1 . 2]" 1
1793 2 19 GLU H 2 20 ASP H . . 2.800 2.801 2.709 2.853 0.053 7 0 "[ . 1 . 2]" 1
1794 2 43 ASP QB 2 44 LYS H . . 4.500 2.321 2.055 3.755 . 0 0 "[ . 1 . 2]" 1
1795 2 75 LYS H 2 76 ASP H . . 3.500 2.832 2.251 3.550 0.050 12 0 "[ . 1 . 2]" 1
1796 2 42 LYS H 2 42 LYS QB . . 3.500 3.214 2.561 3.292 . 0 0 "[ . 1 . 2]" 1
1797 2 41 ASN H 2 42 LYS H . . 2.800 2.657 2.496 2.792 . 0 0 "[ . 1 . 2]" 1
1798 2 42 LYS H 2 43 ASP H . . 3.500 3.482 1.906 3.724 0.224 5 0 "[ . 1 . 2]" 1
1799 2 64 GLN H 2 64 GLN QB . . 2.800 2.504 2.448 2.549 . 0 0 "[ . 1 . 2]" 1
1800 2 86 LYS QG 2 87 LYS H . . 3.500 3.639 3.565 3.670 0.170 12 0 "[ . 1 . 2]" 1
1801 2 86 LYS QB 2 87 LYS H . . 2.800 2.161 2.053 2.315 . 0 0 "[ . 1 . 2]" 1
1802 2 87 LYS H 2 87 LYS HB2 . . 2.800 2.428 2.349 2.637 . 0 0 "[ . 1 . 2]" 1
1803 2 87 LYS H 2 87 LYS HA . . 2.800 2.854 2.834 2.889 0.089 4 0 "[ . 1 . 2]" 1
1804 2 7 ALA MB 2 9 ASN H . . 4.500 3.403 2.582 4.600 0.100 18 0 "[ . 1 . 2]" 1
1805 2 53 GLN H 2 54 GLY H . . 2.800 2.754 2.597 2.838 0.038 5 0 "[ . 1 . 2]" 1
1806 2 52 VAL HB 2 53 GLN H . . 4.500 4.247 2.552 4.545 0.045 19 0 "[ . 1 . 2]" 1
1807 2 41 ASN H 2 42 LYS QG . . 3.500 3.545 3.489 3.602 0.102 3 0 "[ . 1 . 2]" 1
1808 2 19 GLU QB 2 20 ASP H . . 2.800 2.611 2.443 2.782 . 0 0 "[ . 1 . 2]" 1
1809 2 41 ASN H 2 41 ASN HA . . 2.800 2.920 2.899 2.944 0.144 7 0 "[ . 1 . 2]" 1
1810 2 41 ASN H 2 41 ASN QD . . 2.800 2.653 2.363 2.863 0.063 8 0 "[ . 1 . 2]" 1
1811 2 69 ASP H 2 70 LYS H . . 3.500 3.356 3.066 3.547 0.047 19 0 "[ . 1 . 2]" 1
1812 2 21 PHE H 2 22 LEU H . . 3.500 2.538 2.294 2.641 . 0 0 "[ . 1 . 2]" 1
1813 2 20 ASP H 2 21 PHE H . . 3.500 2.706 2.478 2.852 . 0 0 "[ . 1 . 2]" 1
1814 2 68 GLN HA 2 69 ASP H . . 3.500 3.570 3.507 3.601 0.101 2 0 "[ . 1 . 2]" 1
1815 2 69 ASP H 2 69 ASP QB . . 2.800 2.608 2.435 2.803 0.003 2 0 "[ . 1 . 2]" 1
1816 2 68 GLN HG2 2 69 ASP H . . 4.500 4.337 3.407 4.800 0.300 9 0 "[ . 1 . 2]" 1
1817 2 68 GLN HB2 2 69 ASP H . . 3.500 2.727 2.456 3.847 0.347 15 0 "[ . 1 . 2]" 1
1818 2 68 GLN QB 2 69 ASP H . . 3.500 2.650 2.410 3.562 0.062 15 0 "[ . 1 . 2]" 1
1819 2 69 ASP H 2 77 LYS QD . . 4.500 4.550 4.389 4.623 0.123 14 0 "[ . 1 . 2]" 1
1820 2 18 CYS HA 2 21 PHE H . . 4.500 2.988 2.747 3.351 . 0 0 "[ . 1 . 2]" 1
1821 2 69 ASP H 2 70 LYS HA . . 4.500 4.549 4.488 4.593 0.093 14 0 "[ . 1 . 2]" 1
1822 2 23 ALA H 2 24 VAL QG . . 3.500 3.537 3.503 3.598 0.098 2 0 "[ . 1 . 2]" 1
1823 2 22 LEU H 2 23 ALA H . . 2.800 2.505 2.260 2.727 . 0 0 "[ . 1 . 2]" 1
1824 2 81 GLU H 2 81 GLU HB2 . . 2.800 2.500 2.399 2.562 . 0 0 "[ . 1 . 2]" 1
1825 2 58 VAL H 2 59 THR H . . 3.500 2.623 2.554 2.670 . 0 0 "[ . 1 . 2]" 1
1826 2 87 LYS HA 2 88 ASP H . . 3.500 3.485 3.460 3.505 0.005 15 0 "[ . 1 . 2]" 1
1827 2 7 ALA MB 2 8 ASP H . . 3.500 3.088 1.973 3.596 0.096 17 0 "[ . 1 . 2]" 1
1828 2 8 ASP H 2 8 ASP HA . . 2.800 2.509 2.173 2.934 0.134 1 0 "[ . 1 . 2]" 1
1829 2 27 SER H 2 28 PHE H . . 2.800 2.801 2.716 2.828 0.028 1 0 "[ . 1 . 2]" 1
1830 2 78 VAL H 2 79 LYS H . . 2.800 2.779 2.584 2.862 0.062 6 0 "[ . 1 . 2]" 1
1831 2 79 LYS H 2 80 GLY H . . 2.800 2.801 2.764 2.821 0.021 14 0 "[ . 1 . 2]" 1
1832 2 76 ASP HA 2 79 LYS H . . 4.500 3.531 2.986 3.802 . 0 0 "[ . 1 . 2]" 1
1833 2 79 LYS H 2 79 LYS QD . . 3.500 3.525 3.403 3.568 0.068 8 0 "[ . 1 . 2]" 1
1834 2 84 LYS H 2 84 LYS QB . . 2.800 2.178 2.033 2.428 . 0 0 "[ . 1 . 2]" 1
1835 2 84 LYS H 2 84 LYS HA . . 2.800 2.843 2.760 2.926 0.126 14 0 "[ . 1 . 2]" 1
1836 2 83 ASP H 2 84 LYS H . . 2.800 2.811 2.750 2.826 0.026 4 0 "[ . 1 . 2]" 1
1837 2 84 LYS H 2 86 LYS H . . 4.500 4.482 4.192 4.530 0.030 10 0 "[ . 1 . 2]" 1
1838 2 36 ALA H 2 37 GLU H . . 2.800 2.643 2.340 2.827 0.027 11 0 "[ . 1 . 2]" 1
1839 2 67 THR H 2 68 GLN H . . 2.800 2.242 2.183 2.330 . 0 0 "[ . 1 . 2]" 1
1840 2 36 ALA MB 2 37 GLU H . . 2.800 2.484 2.184 2.825 0.025 7 0 "[ . 1 . 2]" 1
1841 2 84 LYS QG 2 85 ILE H . . 4.500 2.803 2.499 4.390 . 0 0 "[ . 1 . 2]" 1
1842 2 84 LYS H 2 85 ILE H . . 2.800 2.735 2.401 2.850 0.050 4 0 "[ . 1 . 2]" 1
1843 2 66 CYS HA 2 67 THR H . . 4.500 3.477 3.402 3.547 . 0 0 "[ . 1 . 2]" 1
1844 2 22 LEU QD 2 67 THR H . . 4.500 3.142 2.983 3.425 . 0 0 "[ . 1 . 2]" 1
1845 2 46 GLU QB 2 47 ASP H . . 3.500 2.949 2.653 3.558 0.058 13 0 "[ . 1 . 2]" 1
1846 2 79 LYS HA 2 83 ASP H . . 4.500 4.019 3.887 4.242 . 0 0 "[ . 1 . 2]" 1
1847 2 83 ASP H 2 83 ASP HA . . 2.800 2.837 2.821 2.858 0.058 12 0 "[ . 1 . 2]" 1
1848 2 38 ALA H 2 39 LEU H . . 2.800 2.798 2.619 2.858 0.058 6 0 "[ . 1 . 2]" 1
1849 2 39 LEU H 2 40 ASN H . . 2.800 2.515 2.342 2.672 . 0 0 "[ . 1 . 2]" 1
1850 2 39 LEU H 2 39 LEU HA . . 2.800 2.911 2.875 2.934 0.134 8 0 "[ . 1 . 2]" 1
1851 2 40 ASN H 2 40 ASN HB2 . . 2.800 2.538 2.159 3.713 0.913 10 2 "[ . + . -2]" 1
1852 2 15 SER H 2 15 SER HA . . 2.800 2.946 2.912 2.967 0.167 9 0 "[ . 1 . 2]" 1
1853 2 31 THR H 2 31 THR HA . . 2.800 2.900 2.874 2.930 0.130 10 0 "[ . 1 . 2]" 1
1854 2 31 THR H 2 31 THR HB . . 2.800 2.391 2.247 2.509 . 0 0 "[ . 1 . 2]" 1
1855 2 70 LYS QB 2 71 GLN H . . 3.500 2.654 2.508 2.850 . 0 0 "[ . 1 . 2]" 1
1856 2 71 GLN H 2 71 GLN QB . . 2.800 2.424 2.337 2.461 . 0 0 "[ . 1 . 2]" 1
1857 2 57 THR H 2 57 THR HA . . 2.800 2.867 2.841 2.897 0.097 5 0 "[ . 1 . 2]" 1
1858 2 57 THR H 2 58 VAL H . . 2.800 2.686 2.511 2.774 . 0 0 "[ . 1 . 2]" 1
1859 2 27 SER H 2 29 GLN H . . 4.500 4.192 4.100 4.276 . 0 0 "[ . 1 . 2]" 1
1860 2 25 ASP HA 2 27 SER H . . 4.500 4.255 4.094 4.401 . 0 0 "[ . 1 . 2]" 1
1861 2 27 SER H 2 27 SER HA . . 2.800 2.838 2.812 2.863 0.063 17 0 "[ . 1 . 2]" 1
1862 2 25 ASP QB 2 27 SER H . . 2.800 2.838 2.743 2.898 0.098 17 0 "[ . 1 . 2]" 1
1863 2 26 GLU QB 2 27 SER H . . 2.800 2.620 2.558 2.685 . 0 0 "[ . 1 . 2]" 1
1864 2 70 LYS QB 2 71 GLN QE . . 5.500 4.294 3.700 5.249 . 0 0 "[ . 1 . 2]" 1
1865 2 73 ASN HB2 2 73 ASN QD . . 2.800 2.602 2.174 3.377 0.577 7 3 "[ . + 1 * . - 2]" 1
1866 2 13 VAL H 2 14 ASN H . . 4.500 3.004 2.877 3.286 . 0 0 "[ . 1 . 2]" 1
1867 2 12 PRO QB 2 13 VAL H . . 4.500 2.694 2.325 2.936 . 0 0 "[ . 1 . 2]" 1
1868 2 51 ASP HA 2 53 GLN H . . 4.500 3.793 3.233 4.506 0.006 17 0 "[ . 1 . 2]" 1
1869 2 1 ALA MB 2 2 ASP H . . 4.500 2.753 2.235 3.629 . 0 0 "[ . 1 . 2]" 1
1870 2 14 ASN HA 2 15 SER H . . 4.500 3.350 2.848 3.587 . 0 0 "[ . 1 . 2]" 1
1871 2 16 TRP H 2 17 THR H . . 4.500 4.564 4.420 4.628 0.128 16 0 "[ . 1 . 2]" 1
1872 2 18 CYS H 2 72 ALA H . . 4.500 3.754 3.436 4.017 . 0 0 "[ . 1 . 2]" 1
1873 2 19 GLU H 2 21 PHE H . . 5.500 4.059 3.847 4.283 . 0 0 "[ . 1 . 2]" 1
1874 2 17 THR H 2 20 ASP H . . 4.500 4.144 3.267 4.566 0.066 4 0 "[ . 1 . 2]" 1
1875 2 21 PHE H 2 23 ALA H . . 4.500 3.992 3.780 4.145 . 0 0 "[ . 1 . 2]" 1
1876 2 22 LEU HA 2 24 VAL H . . 4.500 4.212 3.892 4.444 . 0 0 "[ . 1 . 2]" 1
1877 2 22 LEU H 2 24 VAL H . . 5.500 4.284 3.958 4.710 . 0 0 "[ . 1 . 2]" 1
1878 2 26 GLU H 2 27 SER QB . . 4.500 4.556 4.498 4.587 0.087 4 0 "[ . 1 . 2]" 1
1879 2 26 GLU H 2 28 PHE H . . 4.500 4.227 4.133 4.310 . 0 0 "[ . 1 . 2]" 1
1880 2 33 VAL H 2 55 ILE QG . . 5.500 5.475 5.079 5.568 0.068 8 0 "[ . 1 . 2]" 1
1881 2 36 ALA H 2 38 ALA H . . 4.500 4.006 3.502 4.341 . 0 0 "[ . 1 . 2]" 1
1882 2 37 GLU H 2 38 ALA MB . . 5.500 4.203 3.825 4.409 . 0 0 "[ . 1 . 2]" 1
1883 2 38 ALA H 2 41 ASN QD . . 4.500 4.361 4.078 4.578 0.078 13 0 "[ . 1 . 2]" 1
1884 2 38 ALA H 2 40 ASN H . . 4.500 4.161 4.037 4.355 . 0 0 "[ . 1 . 2]" 1
1885 2 43 ASP H 2 44 LYS QG . . 5.500 4.959 4.679 5.610 0.110 4 0 "[ . 1 . 2]" 1
1886 2 42 LYS QB 2 43 ASP H . . 4.500 2.154 1.619 3.862 . 0 0 "[ . 1 . 2]" 1
1887 2 44 LYS HA 2 46 GLU H . . 4.500 4.255 4.104 4.375 . 0 0 "[ . 1 . 2]" 1
1888 2 46 GLU QG 2 47 ASP H . . 4.500 3.937 2.359 4.343 . 0 0 "[ . 1 . 2]" 1
1889 2 48 ALA H 2 49 VAL H . . 4.500 4.522 4.436 4.589 0.089 1 0 "[ . 1 . 2]" 1
1890 2 50 LEU H 2 51 ASP H . . 5.500 4.183 3.485 4.693 . 0 0 "[ . 1 . 2]" 1
1891 2 54 GLY HA2 2 55 ILE H . . 4.500 3.599 3.584 3.617 . 0 0 "[ . 1 . 2]" 1
1892 2 30 PRO HB3 2 59 THR H . . 5.500 5.132 4.940 5.238 . 0 0 "[ . 1 . 2]" 1
1893 2 61 ALA H 2 63 VAL H . . 4.500 3.807 3.670 4.013 . 0 0 "[ . 1 . 2]" 1
1894 2 61 ALA H 2 62 ILE QG . . 5.500 4.451 3.828 4.729 . 0 0 "[ . 1 . 2]" 1
1895 2 61 ALA HA 2 65 ALA H . . 5.500 4.001 3.843 4.180 . 0 0 "[ . 1 . 2]" 1
1896 2 66 CYS HB2 2 67 THR H . . 4.500 3.551 3.376 3.701 . 0 0 "[ . 1 . 2]" 1
1897 2 67 THR H 2 69 ASP H . . 4.500 3.834 3.576 4.004 . 0 0 "[ . 1 . 2]" 1
1898 2 69 ASP HA 2 72 ALA H . . 5.500 4.259 3.975 4.507 . 0 0 "[ . 1 . 2]" 1
1899 2 70 LYS H 2 72 ALA H . . 4.500 4.437 4.326 4.559 0.059 6 0 "[ . 1 . 2]" 1
1900 2 72 ALA H 2 73 ASN H . . 4.500 4.585 4.544 4.618 0.118 6 0 "[ . 1 . 2]" 1
1901 2 74 PHE H 2 75 LYS H . . 4.500 3.558 2.819 4.605 0.105 7 0 "[ . 1 . 2]" 1
1902 2 18 CYS H 2 74 PHE H . . 5.500 4.103 2.986 5.124 . 0 0 "[ . 1 . 2]" 1
1903 2 74 PHE H 2 74 PHE QB . . 3.500 2.424 2.132 2.934 . 0 0 "[ . 1 . 2]" 1
1904 2 74 PHE QB 2 75 LYS H . . 4.500 2.623 1.865 3.454 . 0 0 "[ . 1 . 2]" 1
1905 2 77 LYS H 2 78 VAL QG . . 4.500 4.064 3.726 4.403 . 0 0 "[ . 1 . 2]" 1
1906 2 75 LYS HA 2 77 LYS H . . 4.500 4.201 3.747 4.454 . 0 0 "[ . 1 . 2]" 1
1907 2 81 GLU HB2 2 82 TRP H . . 4.500 2.952 2.850 3.097 . 0 0 "[ . 1 . 2]" 1
1908 2 82 TRP H 2 84 LYS H . . 4.500 4.286 4.125 4.396 . 0 0 "[ . 1 . 2]" 1
1909 2 84 LYS H 2 87 LYS QB . . 4.500 4.656 4.621 4.686 0.186 9 0 "[ . 1 . 2]" 1
1910 2 84 LYS H 2 85 ILE QG . . 5.500 4.783 4.606 5.240 . 0 0 "[ . 1 . 2]" 1
1911 2 83 ASP H 2 85 ILE H . . 5.500 4.066 4.006 4.189 . 0 0 "[ . 1 . 2]" 1
1912 2 86 LYS H 2 88 ASP H . . 4.500 3.780 3.548 3.910 . 0 0 "[ . 1 . 2]" 1
1913 2 83 ASP HA 2 86 LYS H . . 4.500 3.518 3.217 3.892 . 0 0 "[ . 1 . 2]" 1
1914 2 83 ASP HA 2 88 ASP H . . 4.500 4.178 3.979 4.549 0.049 14 0 "[ . 1 . 2]" 1
1915 2 40 ASN HA 2 41 ASN H . . 3.500 3.523 3.414 3.598 0.098 8 0 "[ . 1 . 2]" 1
1916 2 41 ASN QD 2 42 LYS QG . . 5.500 3.926 2.962 5.010 . 0 0 "[ . 1 . 2]" 1
1917 2 24 VAL H 2 29 GLN HG2 . . 5.500 4.916 4.628 5.246 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 169
_Distance_constraint_stats_list.Viol_count 602
_Distance_constraint_stats_list.Viol_total 904.234
_Distance_constraint_stats_list.Viol_max 0.276
_Distance_constraint_stats_list.Viol_rms 0.0373
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0134
_Distance_constraint_stats_list.Viol_average_violations_only 0.0751
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 ALA 1.563 0.215 20 0 "[ . 1 . 2]"
1 2 ASP 0.066 0.046 1 0 "[ . 1 . 2]"
1 3 ALA 2.601 0.276 3 0 "[ . 1 . 2]"
1 4 GLN 0.997 0.199 20 0 "[ . 1 . 2]"
1 5 LYS 1.094 0.169 17 0 "[ . 1 . 2]"
1 8 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 PRO 1.247 0.130 15 0 "[ . 1 . 2]"
1 13 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 PHE 2.231 0.172 3 0 "[ . 1 . 2]"
1 31 THR 3.231 0.208 6 0 "[ . 1 . 2]"
1 32 ALA 0.919 0.212 1 0 "[ . 1 . 2]"
1 35 PHE 2.331 0.238 10 0 "[ . 1 . 2]"
1 36 ALA 1.496 0.107 3 0 "[ . 1 . 2]"
1 38 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 LEU 7.819 0.237 16 0 "[ . 1 . 2]"
1 42 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 PRO 1.567 0.103 7 0 "[ . 1 . 2]"
1 46 GLU 1.168 0.087 9 0 "[ . 1 . 2]"
1 47 ASP 0.044 0.044 2 0 "[ . 1 . 2]"
1 48 ALA 1.167 0.125 4 0 "[ . 1 . 2]"
1 49 VAL 1.177 0.146 17 0 "[ . 1 . 2]"
1 50 LEU 5.236 0.195 14 0 "[ . 1 . 2]"
1 51 ASP 0.798 0.230 6 0 "[ . 1 . 2]"
1 52 VAL 1.747 0.190 5 0 "[ . 1 . 2]"
1 53 GLN 0.689 0.086 20 0 "[ . 1 . 2]"
1 54 GLY 2.298 0.248 12 0 "[ . 1 . 2]"
1 55 ILE 3.726 0.184 8 0 "[ . 1 . 2]"
2 1 ALA 1.565 0.176 3 0 "[ . 1 . 2]"
2 2 ASP 0.180 0.047 1 0 "[ . 1 . 2]"
2 3 ALA 2.433 0.248 12 0 "[ . 1 . 2]"
2 4 GLN 0.931 0.230 6 0 "[ . 1 . 2]"
2 5 LYS 1.614 0.190 5 0 "[ . 1 . 2]"
2 8 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 10 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 11 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 12 PRO 1.194 0.146 17 0 "[ . 1 . 2]"
2 13 VAL 0.026 0.010 13 0 "[ . 1 . 2]"
2 14 ASN 0.100 0.065 2 0 "[ . 1 . 2]"
2 24 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 28 PHE 2.138 0.184 8 0 "[ . 1 . 2]"
2 31 THR 3.566 0.159 1 0 "[ . 1 . 2]"
2 32 ALA 0.386 0.119 2 0 "[ . 1 . 2]"
2 35 PHE 1.784 0.195 14 0 "[ . 1 . 2]"
2 36 ALA 1.490 0.103 7 0 "[ . 1 . 2]"
2 38 ALA 0.011 0.007 11 0 "[ . 1 . 2]"
2 39 LEU 7.612 0.237 16 0 "[ . 1 . 2]"
2 42 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 45 PRO 1.498 0.107 3 0 "[ . 1 . 2]"
2 46 GLU 1.068 0.092 3 0 "[ . 1 . 2]"
2 47 ASP 0.082 0.035 11 0 "[ . 1 . 2]"
2 48 ALA 1.436 0.209 1 0 "[ . 1 . 2]"
2 49 VAL 1.134 0.130 15 0 "[ . 1 . 2]"
2 50 LEU 6.024 0.238 10 0 "[ . 1 . 2]"
2 51 ASP 0.926 0.199 20 0 "[ . 1 . 2]"
2 52 VAL 1.165 0.169 17 0 "[ . 1 . 2]"
2 53 GLN 0.469 0.060 15 0 "[ . 1 . 2]"
2 54 GLY 2.484 0.276 3 0 "[ . 1 . 2]"
2 55 ILE 3.894 0.215 20 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 14 ASN QD 2 46 GLU HA . . 2.800 2.349 2.127 2.749 . 0 0 "[ . 1 . 2]" 2
2 1 39 LEU QB 2 45 PRO HA . . 4.500 3.440 3.242 3.893 . 0 0 "[ . 1 . 2]" 2
3 1 1 ALA MB 2 53 GLN HA . . 4.500 3.065 2.112 4.551 0.051 9 0 "[ . 1 . 2]" 2
4 1 36 ALA HA 2 45 PRO QG . . 2.800 2.875 2.845 2.907 0.107 3 0 "[ . 1 . 2]" 2
5 1 12 PRO HA 2 49 VAL QG . . 2.800 2.220 2.095 2.401 . 0 0 "[ . 1 . 2]" 2
6 1 12 PRO QB 2 49 VAL QG . . 4.000 2.435 2.176 3.045 . 0 0 "[ . 1 . 2]" 2
7 1 55 ILE MD 2 31 THR MG . . 2.800 2.173 1.934 2.626 . 0 0 "[ . 1 . 2]" 2
8 1 50 LEU QD 2 31 THR MG . . 2.800 1.908 1.854 1.991 . 0 0 "[ . 1 . 2]" 2
9 1 13 VAL QG 2 48 ALA MB . . 3.500 2.280 2.081 2.561 . 0 0 "[ . 1 . 2]" 2
10 1 31 THR MG 2 50 LEU QD . . 2.800 1.908 1.849 1.972 . 0 0 "[ . 1 . 2]" 2
11 1 39 LEU QD 2 45 PRO HA . . 4.500 3.514 3.366 3.779 . 0 0 "[ . 1 . 2]" 2
12 1 39 LEU HG 2 45 PRO HA . . 3.500 3.000 2.628 3.503 0.003 5 0 "[ . 1 . 2]" 2
13 1 49 VAL QG 2 12 PRO HA . . 2.800 2.240 2.014 2.720 . 0 0 "[ . 1 . 2]" 2
14 1 49 VAL HA 2 12 PRO HA . . 2.800 2.425 2.035 2.790 . 0 0 "[ . 1 . 2]" 2
15 1 13 VAL H 2 49 VAL HA . . 3.500 3.107 2.625 3.478 . 0 0 "[ . 1 . 2]" 2
16 1 13 VAL QG 2 49 VAL HA . . 3.500 2.929 2.137 3.237 . 0 0 "[ . 1 . 2]" 2
17 1 12 PRO HA 2 49 VAL HA . . 2.800 2.325 2.026 2.686 . 0 0 "[ . 1 . 2]" 2
18 1 50 LEU QD 2 32 ALA HA . . 4.500 2.393 1.963 2.707 . 0 0 "[ . 1 . 2]" 2
19 1 52 VAL QG 2 28 PHE QB . . 3.500 2.310 2.103 2.802 . 0 0 "[ . 1 . 2]" 2
20 1 50 LEU HA 2 35 PHE QB . . 3.500 3.579 3.362 3.695 0.195 14 0 "[ . 1 . 2]" 2
21 1 12 PRO HA 2 49 VAL HB . . 4.500 4.430 1.971 4.630 0.130 15 0 "[ . 1 . 2]" 2
22 1 1 ALA MB 2 53 GLN QG . . 3.500 3.339 2.873 3.560 0.060 15 0 "[ . 1 . 2]" 2
23 1 52 VAL QG 2 4 GLN QG . . 4.500 3.080 2.004 4.358 . 0 0 "[ . 1 . 2]" 2
24 1 36 ALA HA 2 45 PRO QB . . 3.500 2.358 2.150 2.755 . 0 0 "[ . 1 . 2]" 2
25 1 13 VAL QG 2 45 PRO QB . . 4.500 2.394 2.145 2.642 . 0 0 "[ . 1 . 2]" 2
26 1 39 LEU QB 2 45 PRO QB . . 2.800 2.275 2.153 2.604 . 0 0 "[ . 1 . 2]" 2
27 1 3 ALA H 2 53 GLN QB . . 3.500 2.816 1.783 3.520 0.020 7 0 "[ . 1 . 2]" 2
28 1 3 ALA MB 2 53 GLN QB . . 4.500 3.444 2.108 4.551 0.051 8 0 "[ . 1 . 2]" 2
29 1 32 ALA HA 2 50 LEU HG . . 3.500 2.295 2.093 2.542 . 0 0 "[ . 1 . 2]" 2
30 1 45 PRO HA 2 39 LEU HG . . 3.500 2.903 2.579 3.511 0.011 11 0 "[ . 1 . 2]" 2
31 1 45 PRO QB 2 39 LEU HG . . 4.500 2.699 2.379 3.043 . 0 0 "[ . 1 . 2]" 2
32 1 49 VAL HA 2 13 VAL QG . . 3.500 3.111 2.387 3.509 0.009 2 0 "[ . 1 . 2]" 2
33 1 45 PRO QB 2 13 VAL QG . . 4.500 2.320 2.062 2.657 . 0 0 "[ . 1 . 2]" 2
34 1 45 PRO HA 2 39 LEU QD . . 4.500 3.511 3.276 3.758 . 0 0 "[ . 1 . 2]" 2
35 1 45 PRO QB 2 39 LEU QD . . 4.000 3.110 2.640 3.581 . 0 0 "[ . 1 . 2]" 2
36 1 55 ILE QG 2 31 THR MG . . 3.500 3.289 2.548 3.550 0.050 1 0 "[ . 1 . 2]" 2
37 1 52 VAL QG 2 31 THR MG . . 4.500 4.182 3.971 4.236 . 0 0 "[ . 1 . 2]" 2
38 1 50 LEU HG 2 31 THR MG . . 3.500 3.246 2.459 3.563 0.063 11 0 "[ . 1 . 2]" 2
39 1 28 PHE QB 2 52 VAL QG . . 3.500 2.190 1.936 2.598 . 0 0 "[ . 1 . 2]" 2
40 1 4 GLN QB 2 52 VAL QG . . 3.500 3.136 2.356 3.535 0.035 13 0 "[ . 1 . 2]" 2
41 1 1 ALA MB 2 52 VAL QG . . 5.300 3.383 1.874 5.049 . 0 0 "[ . 1 . 2]" 2
42 1 31 THR MG 2 52 VAL QG . . 4.500 3.970 2.726 4.233 . 0 0 "[ . 1 . 2]" 2
43 1 13 VAL H 2 49 VAL QG . . 4.500 3.780 3.510 4.011 . 0 0 "[ . 1 . 2]" 2
44 1 11 LYS H 2 49 VAL QG . . 4.500 3.228 2.357 4.320 . 0 0 "[ . 1 . 2]" 2
45 1 8 ASP H 2 49 VAL QG . . 4.800 4.210 3.130 4.689 . 0 0 "[ . 1 . 2]" 2
46 1 5 LYS QB 2 49 VAL QG . . 4.500 2.757 2.050 4.039 . 0 0 "[ . 1 . 2]" 2
47 1 13 VAL H 2 48 ALA MB . . 4.500 3.717 3.404 4.090 . 0 0 "[ . 1 . 2]" 2
48 1 28 PHE HA 2 55 ILE MG . . 4.000 4.112 4.075 4.172 0.172 3 0 "[ . 1 . 2]" 2
49 1 50 LEU QD 2 32 ALA MB . . 4.500 2.663 1.957 3.078 . 0 0 "[ . 1 . 2]" 2
50 1 31 THR MG 2 55 ILE MD . . 2.800 2.165 1.986 2.809 0.009 20 0 "[ . 1 . 2]" 2
51 1 3 ALA H 2 54 GLY QA . . 6.500 6.624 6.505 6.776 0.276 3 0 "[ . 1 . 2]" 2
52 1 49 VAL QG 2 5 LYS QB . . 4.500 2.563 1.888 3.650 . 0 0 "[ . 1 . 2]" 2
53 1 50 LEU H 2 12 PRO HA . . 5.500 4.874 3.945 5.448 . 0 0 "[ . 1 . 2]" 2
54 1 47 ASP HA 2 12 PRO QB . . 4.500 3.202 2.584 3.797 . 0 0 "[ . 1 . 2]" 2
55 1 47 ASP HA 2 12 PRO QG . . 4.500 3.782 2.777 4.544 0.044 2 0 "[ . 1 . 2]" 2
56 1 49 VAL QG 2 12 PRO QD . . 5.500 3.002 2.449 3.550 . 0 0 "[ . 1 . 2]" 2
57 1 46 GLU HA 2 14 ASN QB . . 4.500 3.430 2.673 4.401 . 0 0 "[ . 1 . 2]" 2
58 1 14 ASN QD 2 45 PRO QB . . 4.500 3.434 2.425 4.423 . 0 0 "[ . 1 . 2]" 2
59 1 2 ASP QB 2 53 GLN QB . . 5.500 4.991 4.557 5.546 0.046 1 0 "[ . 1 . 2]" 2
60 1 12 PRO QB 2 49 VAL HA . . 5.500 3.817 3.514 4.144 . 0 0 "[ . 1 . 2]" 2
61 1 50 LEU HA 2 32 ALA HA . . 4.800 4.764 4.550 4.919 0.119 2 0 "[ . 1 . 2]" 2
62 1 45 PRO QD 2 39 LEU QB . . 4.500 2.069 1.997 2.195 . 0 0 "[ . 1 . 2]" 2
63 1 48 ALA H 2 39 LEU HG . . 5.500 5.548 5.346 5.625 0.125 4 0 "[ . 1 . 2]" 2
64 1 12 PRO QB 2 47 ASP QB . . 5.500 4.707 3.812 5.214 . 0 0 "[ . 1 . 2]" 2
65 1 45 PRO QB 2 35 PHE QB . . 5.500 4.265 3.574 5.088 . 0 0 "[ . 1 . 2]" 2
66 1 35 PHE QB 2 48 ALA MB . . 5.500 2.831 2.301 3.675 . 0 0 "[ . 1 . 2]" 2
67 1 32 ALA H 2 50 LEU HG . . 4.500 3.557 3.305 3.910 . 0 0 "[ . 1 . 2]" 2
68 1 31 THR HB 2 50 LEU QD . . 3.500 2.890 2.397 3.521 0.021 1 0 "[ . 1 . 2]" 2
69 1 4 GLN QE 2 51 ASP QB . . 6.300 5.704 2.978 6.499 0.199 20 0 "[ . 1 . 2]" 2
70 1 4 GLN HA 2 52 VAL QG . . 5.500 4.621 2.185 5.447 . 0 0 "[ . 1 . 2]" 2
71 1 4 GLN QG 2 52 VAL QG . . 4.500 2.888 2.002 4.358 . 0 0 "[ . 1 . 2]" 2
72 1 1 ALA MB 2 55 ILE MD . . 6.000 5.958 5.457 6.215 0.215 20 0 "[ . 1 . 2]" 2
73 1 31 THR MG 2 55 ILE QG . . 3.500 3.376 2.607 3.533 0.033 10 0 "[ . 1 . 2]" 2
74 1 39 LEU QB 2 46 GLU QG . . 5.500 5.549 5.429 5.592 0.092 3 0 "[ . 1 . 2]" 2
75 1 13 VAL QG 2 50 LEU H . . 4.500 3.275 2.739 3.843 . 0 0 "[ . 1 . 2]" 2
76 1 49 VAL HA 2 13 VAL H . . 3.500 3.203 2.588 3.510 0.010 13 0 "[ . 1 . 2]" 2
77 1 50 LEU HG 2 32 ALA H . . 4.500 3.535 3.296 3.867 . 0 0 "[ . 1 . 2]" 2
78 1 49 VAL QG 2 11 LYS H . . 4.500 3.655 2.230 4.402 . 0 0 "[ . 1 . 2]" 2
79 1 50 LEU HG 2 31 THR HB . . 4.500 4.308 3.871 4.607 0.107 8 0 "[ . 1 . 2]" 2
80 1 50 LEU HG 2 32 ALA MB . . 3.500 2.671 2.160 3.553 0.053 15 0 "[ . 1 . 2]" 2
81 1 50 LEU HG 2 32 ALA HA . . 3.500 2.352 2.047 3.220 . 0 0 "[ . 1 . 2]" 2
82 1 50 LEU HG 2 31 THR H . . 5.500 5.612 5.535 5.659 0.159 1 0 "[ . 1 . 2]" 2
83 1 31 THR MG 2 50 LEU HG . . 3.500 3.185 2.407 3.569 0.069 5 0 "[ . 1 . 2]" 2
84 1 32 ALA MB 2 50 LEU HG . . 3.500 2.754 2.216 3.572 0.072 20 0 "[ . 1 . 2]" 2
85 1 39 LEU HG 2 39 LEU QB . . 6.000 6.124 6.043 6.234 0.234 6 0 "[ . 1 . 2]" 2
86 1 39 LEU HG 2 42 LYS QG . . 6.000 3.891 3.409 4.181 . 0 0 "[ . 1 . 2]" 2
87 1 39 LEU QD 2 38 ALA MB . . 4.500 2.161 1.987 2.409 . 0 0 "[ . 1 . 2]" 2
88 1 39 LEU QD 2 39 LEU QB . . 3.500 3.307 3.253 3.371 . 0 0 "[ . 1 . 2]" 2
89 1 31 THR MG 2 31 THR HB . . 5.500 5.286 4.949 5.507 0.007 14 0 "[ . 1 . 2]" 2
90 1 31 THR MG 2 55 ILE MG . . 4.500 2.277 2.118 2.475 . 0 0 "[ . 1 . 2]" 2
91 1 31 THR MG 2 55 ILE HA . . 5.500 5.436 5.231 5.558 0.058 14 0 "[ . 1 . 2]" 2
92 1 5 LYS QG 2 52 VAL HA . . 6.000 6.017 5.628 6.169 0.169 17 0 "[ . 1 . 2]" 2
93 1 24 VAL QG 2 50 LEU HG . . 4.500 3.817 3.111 4.422 . 0 0 "[ . 1 . 2]" 2
94 1 24 VAL QG 2 52 VAL QG . . 4.500 2.182 1.933 2.542 . 0 0 "[ . 1 . 2]" 2
95 1 52 VAL QG 2 24 VAL QG . . 4.500 2.185 2.041 2.480 . 0 0 "[ . 1 . 2]" 2
96 1 52 VAL QG 2 24 VAL H . . 5.500 5.084 4.571 5.292 . 0 0 "[ . 1 . 2]" 2
97 1 49 VAL QG 2 10 LYS HA . . 5.500 4.135 2.772 5.251 . 0 0 "[ . 1 . 2]" 2
98 1 49 VAL QG 2 10 LYS QB . . 5.500 3.723 2.009 4.566 . 0 0 "[ . 1 . 2]" 2
99 1 49 VAL QG 2 12 PRO QG . . 4.500 3.567 2.135 4.162 . 0 0 "[ . 1 . 2]" 2
100 1 49 VAL QG 2 12 PRO QB . . 4.000 2.498 2.179 3.165 . 0 0 "[ . 1 . 2]" 2
101 1 49 VAL QG 2 11 LYS QB . . 5.500 3.289 2.278 4.312 . 0 0 "[ . 1 . 2]" 2
102 1 49 VAL QG 2 13 VAL QG . . 6.500 3.835 3.432 4.073 . 0 0 "[ . 1 . 2]" 2
103 1 48 ALA MB 2 13 VAL QG . . 3.500 2.201 2.075 2.446 . 0 0 "[ . 1 . 2]" 2
104 1 48 ALA MB 2 14 ASN QD . . 5.500 4.318 3.593 5.514 0.014 2 0 "[ . 1 . 2]" 2
105 1 55 ILE MG 2 31 THR MG . . 4.500 2.306 2.118 2.635 . 0 0 "[ . 1 . 2]" 2
106 1 46 GLU HA 2 14 ASN QD . . 2.800 2.312 1.958 2.821 0.021 4 0 "[ . 1 . 2]" 2
107 1 45 PRO HA 2 39 LEU QB . . 4.500 3.430 3.264 3.696 . 0 0 "[ . 1 . 2]" 2
108 1 53 GLN HA 2 1 ALA MB . . 4.500 3.035 2.061 4.535 0.035 18 0 "[ . 1 . 2]" 2
109 1 45 PRO QG 2 36 ALA HA . . 2.800 2.875 2.844 2.903 0.103 7 0 "[ . 1 . 2]" 2
110 1 32 ALA HA 2 50 LEU QD . . 4.500 2.340 1.885 2.882 . 0 0 "[ . 1 . 2]" 2
111 1 35 PHE QB 2 50 LEU HA . . 3.500 3.609 3.401 3.738 0.238 10 0 "[ . 1 . 2]" 2
112 1 49 VAL HB 2 12 PRO HA . . 4.500 4.303 1.944 4.646 0.146 17 0 "[ . 1 . 2]" 2
113 1 53 GLN QG 2 1 ALA MB . . 3.500 3.274 2.281 3.586 0.086 20 0 "[ . 1 . 2]" 2
114 1 45 PRO QB 2 36 ALA HA . . 3.500 2.277 2.119 2.541 . 0 0 "[ . 1 . 2]" 2
115 1 45 PRO QB 2 39 LEU QB . . 2.800 2.269 2.148 2.384 . 0 0 "[ . 1 . 2]" 2
116 1 53 GLN QB 2 3 ALA H . . 3.500 2.805 1.803 3.534 0.034 1 0 "[ . 1 . 2]" 2
117 1 53 GLN QB 2 3 ALA MB . . 4.500 3.538 2.066 4.532 0.032 11 0 "[ . 1 . 2]" 2
118 1 39 LEU HG 2 45 PRO QB . . 4.500 2.745 2.494 3.059 . 0 0 "[ . 1 . 2]" 2
119 1 39 LEU QD 2 45 PRO QB . . 4.000 3.169 2.459 3.587 . 0 0 "[ . 1 . 2]" 2
120 1 52 VAL QG 2 4 GLN QB . . 3.500 3.044 2.380 3.615 0.115 19 0 "[ . 1 . 2]" 2
121 1 52 VAL QG 2 1 ALA MB . . 5.300 3.427 1.878 5.039 . 0 0 "[ . 1 . 2]" 2
122 1 49 VAL QG 2 13 VAL H . . 4.500 3.813 3.505 4.058 . 0 0 "[ . 1 . 2]" 2
123 1 49 VAL QG 2 8 ASP H . . 4.800 4.286 3.837 4.745 . 0 0 "[ . 1 . 2]" 2
124 1 48 ALA MB 2 13 VAL H . . 4.500 3.602 3.336 3.859 . 0 0 "[ . 1 . 2]" 2
125 1 55 ILE MG 2 28 PHE HA . . 4.000 4.099 3.851 4.184 0.184 8 0 "[ . 1 . 2]" 2
126 1 32 ALA MB 2 50 LEU QD . . 4.500 2.626 1.991 3.115 . 0 0 "[ . 1 . 2]" 2
127 1 54 GLY QA 2 3 ALA H . . 6.500 6.610 6.403 6.748 0.248 12 0 "[ . 1 . 2]" 2
128 1 12 PRO HA 2 50 LEU H . . 5.500 4.753 3.960 5.531 0.031 17 0 "[ . 1 . 2]" 2
129 1 12 PRO QB 2 47 ASP HA . . 4.500 3.241 2.447 3.831 . 0 0 "[ . 1 . 2]" 2
130 1 12 PRO QG 2 47 ASP HA . . 4.500 3.929 2.974 4.535 0.035 11 0 "[ . 1 . 2]" 2
131 1 12 PRO QD 2 49 VAL QG . . 5.500 3.006 2.620 3.351 . 0 0 "[ . 1 . 2]" 2
132 1 14 ASN QB 2 46 GLU HA . . 4.500 3.399 2.315 4.415 . 0 0 "[ . 1 . 2]" 2
133 1 45 PRO QB 2 14 ASN QD . . 4.500 3.472 2.718 4.565 0.065 2 0 "[ . 1 . 2]" 2
134 1 53 GLN QB 2 2 ASP QB . . 5.500 5.049 4.144 5.547 0.047 1 0 "[ . 1 . 2]" 2
135 1 49 VAL HA 2 12 PRO QB . . 5.500 3.879 3.506 4.181 . 0 0 "[ . 1 . 2]" 2
136 1 32 ALA HA 2 50 LEU HA . . 4.800 4.771 4.497 5.012 0.212 1 0 "[ . 1 . 2]" 2
137 1 39 LEU QB 2 45 PRO QD . . 4.500 2.053 1.975 2.123 . 0 0 "[ . 1 . 2]" 2
138 1 39 LEU HG 2 48 ALA H . . 5.500 5.549 5.230 5.709 0.209 1 0 "[ . 1 . 2]" 2
139 1 47 ASP QB 2 12 PRO QB . . 5.500 4.661 3.910 5.461 . 0 0 "[ . 1 . 2]" 2
140 1 35 PHE QB 2 45 PRO QB . . 5.500 4.091 3.569 4.440 . 0 0 "[ . 1 . 2]" 2
141 1 48 ALA MB 2 35 PHE QB . . 5.500 2.703 2.201 3.788 . 0 0 "[ . 1 . 2]" 2
142 1 50 LEU QD 2 31 THR HB . . 3.500 2.871 2.454 3.098 . 0 0 "[ . 1 . 2]" 2
143 1 51 ASP QB 2 4 GLN QE . . 6.300 5.391 3.248 6.530 0.230 6 0 "[ . 1 . 2]" 2
144 1 52 VAL QG 2 4 GLN HA . . 5.500 4.726 3.056 5.430 . 0 0 "[ . 1 . 2]" 2
145 1 55 ILE MD 2 1 ALA MB . . 6.000 5.979 5.424 6.176 0.176 3 0 "[ . 1 . 2]" 2
146 1 46 GLU QG 2 39 LEU QB . . 5.500 5.557 5.515 5.587 0.087 9 0 "[ . 1 . 2]" 2
147 1 50 LEU H 2 13 VAL QG . . 4.500 3.572 3.038 4.209 . 0 0 "[ . 1 . 2]" 2
148 1 31 THR HB 2 50 LEU HG . . 4.500 4.325 3.798 4.570 0.070 3 0 "[ . 1 . 2]" 2
149 1 31 THR H 2 50 LEU HG . . 5.500 5.595 5.526 5.708 0.208 6 0 "[ . 1 . 2]" 2
150 1 39 LEU QB 2 39 LEU HG . . 6.000 6.141 6.019 6.237 0.237 16 0 "[ . 1 . 2]" 2
151 1 42 LYS QG 2 39 LEU HG . . 6.000 3.627 3.084 4.464 . 0 0 "[ . 1 . 2]" 2
152 1 38 ALA MB 2 39 LEU QD . . 4.500 2.103 1.975 2.340 . 0 0 "[ . 1 . 2]" 2
153 1 39 LEU QB 2 39 LEU QD . . 3.500 3.302 3.225 3.368 . 0 0 "[ . 1 . 2]" 2
154 1 31 THR HB 2 31 THR MG . . 5.500 5.301 4.929 5.543 0.043 8 0 "[ . 1 . 2]" 2
155 1 55 ILE HA 2 31 THR MG . . 5.500 5.409 5.267 5.563 0.063 12 0 "[ . 1 . 2]" 2
156 1 52 VAL HA 2 5 LYS QG . . 6.000 6.045 5.543 6.190 0.190 5 0 "[ . 1 . 2]" 2
157 1 50 LEU HG 2 24 VAL QG . . 4.500 3.704 2.586 4.364 . 0 0 "[ . 1 . 2]" 2
158 1 24 VAL H 2 52 VAL QG . . 5.500 5.057 4.502 5.282 . 0 0 "[ . 1 . 2]" 2
159 1 10 LYS HA 2 49 VAL QG . . 5.500 4.140 2.796 5.303 . 0 0 "[ . 1 . 2]" 2
160 1 10 LYS QB 2 49 VAL QG . . 5.500 4.363 3.685 4.944 . 0 0 "[ . 1 . 2]" 2
161 1 12 PRO QG 2 49 VAL QG . . 4.500 3.719 2.358 4.145 . 0 0 "[ . 1 . 2]" 2
162 1 11 LYS QB 2 49 VAL QG . . 5.500 2.910 2.195 3.793 . 0 0 "[ . 1 . 2]" 2
163 1 13 VAL QG 2 49 VAL QG . . 6.500 3.734 3.248 3.906 . 0 0 "[ . 1 . 2]" 2
164 1 14 ASN QD 2 48 ALA MB . . 5.500 4.168 3.429 5.451 . 0 0 "[ . 1 . 2]" 2
165 1 38 ALA MB 2 39 LEU HG . . 4.500 4.079 3.821 4.362 . 0 0 "[ . 1 . 2]" 2
166 1 38 ALA MB 2 38 ALA MB . . 4.500 3.297 2.874 3.664 . 0 0 "[ . 1 . 2]" 2
167 1 38 ALA MB 2 39 LEU QB . . 5.500 4.952 4.651 5.222 . 0 0 "[ . 1 . 2]" 2
168 1 39 LEU HG 2 38 ALA MB . . 4.500 4.172 3.958 4.507 0.007 11 0 "[ . 1 . 2]" 2
169 1 39 LEU QB 2 38 ALA MB . . 5.500 5.033 4.772 5.365 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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