NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
623572 |
6bnh   |
30373 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6bnh
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 1682
_Distance_constraint_stats_list.Viol_count 12140
_Distance_constraint_stats_list.Viol_total 102356.016
_Distance_constraint_stats_list.Viol_max 2.575
_Distance_constraint_stats_list.Viol_rms 0.3547
_Distance_constraint_stats_list.Viol_average_all_restraints 0.1521
_Distance_constraint_stats_list.Viol_average_violations_only 0.4216
_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 SER 19.938 1.361 9 7 "[* . * +1 *-.* *2]"
1 2 GLU 42.712 1.361 9 16 "[** *****+* *-*** **]"
1 3 GLU 25.361 1.275 9 20 [-*******+***********]
1 4 GLU 40.010 1.347 12 20 [****-******+********]
1 5 ASP 44.842 1.241 6 20 [*****+**********-***]
1 6 LYS 21.859 0.685 6 6 "[* * .+ 1* * . - 2]"
1 7 CYS 10.852 0.685 6 5 "[* * .+ 1* - . 2]"
1 8 LYS 51.780 1.158 20 19 "[************* *****+]"
1 9 PRO 31.022 1.158 20 11 "[ ***-* ** .** *+]"
1 10 MET 241.763 2.219 8 20 [*******+*-**********]
1 11 SER 26.092 1.295 1 12 "[+ * * *** * ** *-*]"
1 12 TYR 191.051 2.502 4 20 [***+**********-*****]
1 13 GLU 140.957 2.502 4 20 [***+-***************]
1 14 GLU 174.822 2.219 8 20 [*******+-***********]
1 15 LYS 412.561 2.202 16 20 [**************-+****]
1 16 ARG 103.171 1.570 7 20 [-*****+*************]
1 17 GLN 19.166 0.421 18 0 "[ . 1 . 2]"
1 18 LEU 287.704 2.463 3 20 [**+************-****]
1 19 SER 55.908 1.242 16 20 [***************+**-*]
1 20 LEU 30.199 0.850 20 11 "[ * ** ** *-*.** +]"
1 21 ASP 47.877 0.803 4 20 [-**+****************]
1 22 ILE 118.099 1.665 9 20 [********+******-****]
1 23 ASN 37.382 1.002 6 20 [*****+******-*******]
1 24 LYS 90.597 1.796 11 20 [**-*******+*********]
1 25 LEU 262.605 2.144 13 20 [************+****-**]
1 26 PRO 188.030 2.144 13 20 [*****-******+*******]
1 27 GLY 11.721 1.070 7 14 "[* ***+* -** *.****2]"
1 28 GLU 3.386 0.509 3 1 "[ + . 1 . 2]"
1 29 LYS 288.568 2.387 1 20 [+****************-**]
1 30 LEU 226.738 1.845 14 20 [**-**********+******]
1 31 GLY 45.631 1.123 2 20 [*+***********-******]
1 32 ARG 294.205 1.843 4 20 [***+******-*********]
1 33 VAL 167.285 2.392 13 20 [**-*********+*******]
1 34 VAL 168.447 1.769 11 20 [**********+*****-***]
1 35 HIS 47.295 1.172 20 20 [*******************+]
1 36 ILE 265.555 1.927 4 20 [*-*+****************]
1 37 ILE 87.854 1.649 13 20 [************+*-*****]
1 38 GLN 74.222 1.528 6 20 [*****+**************]
1 39 SER 6.086 0.119 6 0 "[ . 1 . 2]"
1 40 ARG 223.562 1.927 4 20 [***+*******-********]
1 41 GLU 72.980 1.033 17 20 [***********-****+***]
1 42 PRO 15.138 1.059 4 8 "[ * +. 1* * .** -*]"
1 43 SER 9.806 0.698 17 4 "[ * . 1- . + *2]"
1 44 LEU 123.910 1.862 19 20 [*************-****+*]
1 45 LYS 59.009 1.878 7 20 [******+*************]
1 46 ASN 78.999 1.878 7 20 [-*****+*************]
1 47 SER 69.992 0.988 15 20 [*************-+*****]
1 48 ASN 74.166 0.936 6 20 [*****+**************]
1 49 PRO 146.888 1.678 11 20 [**********+*****-***]
1 50 ASP 42.400 1.531 6 20 [*****+********-*****]
1 51 GLU 105.395 2.575 14 20 [*****-*******+******]
1 52 ILE 117.998 1.528 6 20 [*****+*************-]
1 53 GLU 66.384 2.098 13 20 [*-**********+*******]
1 54 ILE 106.796 0.846 19 20 [***-**************+*]
1 55 ASP 61.846 1.462 7 20 [******+***-*********]
1 56 PHE 352.967 2.463 3 20 [**+*-***************]
1 57 GLU 24.827 0.818 8 20 [*******+******-*****]
1 58 THR 38.810 1.046 8 20 [*******+**-*********]
1 59 LEU 311.786 2.318 8 20 [*******+******-*****]
1 60 LYS 54.531 1.209 15 12 "[* * . *******+** 2]"
1 61 PRO 43.907 0.986 19 20 [-*****************+*]
1 62 SER 3.453 0.149 7 0 "[ . 1 . 2]"
1 63 THR 169.339 1.846 6 20 [-****+**************]
1 64 LEU 409.547 2.318 8 20 [*******+*******-****]
1 65 ARG 76.037 1.135 8 20 [*******+****-*******]
1 66 GLU 141.674 0.998 4 20 [***+-***************]
1 67 LEU 277.598 1.716 10 20 [*-*******+**********]
1 68 GLU 109.674 1.135 8 20 [*******+*-**********]
1 69 ARG 69.998 1.534 1 20 [+*******-***********]
1 70 TYR 348.530 2.392 13 20 [************+******-]
1 71 VAL 235.453 2.122 7 20 [*****-+*************]
1 72 THR 39.304 0.849 13 7 "[* * . *-1* + . *]"
1 73 SER 22.772 0.436 9 0 "[ . 1 . 2]"
1 74 CYS 98.534 2.122 7 20 [**-***+*************]
1 75 LEU 185.148 1.796 11 20 [-*********+*********]
1 76 ARG 41.028 1.168 11 20 [**********+*-*******]
1 77 LYS 58.286 1.762 3 20 [**+-****************]
1 78 LYS 5.304 0.353 12 0 "[ . 1 . 2]"
1 79 ARG 38.521 1.609 16 20 [******-********+****]
1 80 LYS 32.554 1.474 17 19 "[******-******** +***]"
1 81 PRO 26.601 1.345 7 13 "[ ***+ 1***-**** *]"
1 82 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 ALA 13.432 1.345 7 8 "[ * - +* 1 * *.* * 2]"
2 1 LYS 1.098 0.749 2 1 "[ + . 1 . 2]"
2 2 TRP 73.115 1.737 8 20 [*-*****+************]
2 3 THR 0.000 0.000 . 0 "[ . 1 . 2]"
2 7 LEU 22.328 0.576 9 6 "[ *.-* +1** . 2]"
2 8 LYS 62.838 2.575 14 20 [************-+******]
2 9 ARG 6.351 0.858 10 7 "[ *.* * + * . -*2]"
2 11 TYR 80.721 1.639 7 20 [*****-+*************]
2 12 ARG 3.572 0.822 8 2 "[ . + - . 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 70 TYR HA 1 70 TYR QD 4.084 3.574 4.594 2.558 2.533 2.606 1.041 7 20 [******+*****-*******] 1
2 1 70 TYR QB 1 70 TYR QD 3.121 2.786 3.456 2.099 2.076 2.108 0.710 14 20 [*************+-*****] 1
3 1 25 LEU QD 1 70 TYR QD . 4.079 4.539 3.368 3.336 3.430 0.743 16 20 [*************-*+****] 1
4 1 35 HIS HA 1 35 HIS HD2 4.004 3.499 4.509 4.446 4.374 4.538 0.029 4 0 "[ . 1 . 2]" 1
5 1 32 ARG HA 1 35 HIS HD2 4.622 3.892 5.352 4.373 4.235 4.510 . 0 0 "[ . 1 . 2]" 1
6 1 70 TYR QB 1 70 TYR QE 4.351 3.812 4.919 3.888 3.878 3.893 . 0 0 "[ . 1 . 2]" 1
7 1 12 TYR QD 1 13 GLU QG . 4.888 5.446 2.724 2.386 3.213 2.502 4 20 [*-*+****************] 1
8 1 12 TYR QD 1 13 GLU QB 6.513 5.818 7.476 4.582 4.336 4.929 1.482 4 20 [*-*+****************] 1
9 1 33 VAL QG 1 70 TYR QE 5.097 4.327 5.867 1.965 1.935 2.046 2.392 13 20 [************+******-] 1
10 1 35 HIS HD2 1 36 ILE HA 4.174 3.459 4.889 3.467 3.420 3.586 0.039 16 0 "[ . 1 . 2]" 1
11 1 32 ARG QD 1 70 TYR QE . 4.822 5.401 3.734 3.132 3.928 1.690 19 20 [********-*********+*] 1
12 1 70 TYR QE 1 71 VAL QG 4.879 4.196 5.562 2.415 2.353 2.519 1.843 5 20 [*-**+***************] 1
13 1 56 PHE HA 1 56 PHE QE 3.829 3.343 4.315 4.186 4.122 4.213 . 0 0 "[ . 1 . 2]" 1
14 1 56 PHE HD1 1 67 LEU QD 4.675 3.921 5.429 3.594 3.525 3.711 0.396 15 0 "[ . 1 . 2]" 1
15 1 18 LEU QB 1 56 PHE HD1 4.327 3.734 4.920 4.838 4.763 4.984 0.064 10 0 "[ . 1 . 2]" 1
16 1 56 PHE QE 1 65 ARG QD 5.047 4.321 5.773 5.638 5.493 5.683 . 0 0 "[ . 1 . 2]" 1
17 1 18 LEU HG 1 56 PHE QE 4.697 4.089 5.305 3.590 3.395 3.720 0.694 3 8 "[ *+*- ** * . * 2]" 1
18 1 18 LEU QD 1 56 PHE HZ 3.925 3.406 4.444 1.651 1.604 1.715 1.802 6 20 [*****+***-**********] 1
19 1 18 LEU HG 1 56 PHE HZ 3.943 3.291 4.595 3.244 2.985 3.392 0.306 13 0 "[ . 1 . 2]" 1
20 1 19 SER HA 1 56 PHE HZ 4.226 3.539 4.913 4.983 4.894 5.043 0.130 19 0 "[ . 1 . 2]" 1
21 1 67 LEU QD 1 70 TYR QD 4.305 3.772 4.838 3.976 3.928 4.029 . 0 0 "[ . 1 . 2]" 1
22 1 35 HIS HD2 1 36 ILE QG 4.461 3.734 5.188 3.107 2.988 3.184 0.746 4 20 [***+********-*******] 1
23 1 12 TYR HA 1 12 TYR HE1 4.769 4.122 5.416 4.786 4.672 4.863 . 0 0 "[ . 1 . 2]" 1
24 1 12 TYR QB 1 12 TYR HE1 5.017 4.334 5.740 4.604 4.577 4.643 . 0 0 "[ . 1 . 2]" 1
25 1 12 TYR HE1 1 15 LYS QB 4.788 4.359 5.505 4.840 4.782 4.909 . 0 0 "[ . 1 . 2]" 1
26 1 56 PHE HD2 1 64 LEU HA 6.201 5.009 7.393 5.990 5.913 6.076 . 0 0 "[ . 1 . 2]" 1
27 1 56 PHE QE 1 64 LEU HA 4.579 3.882 5.276 3.772 3.707 3.812 0.175 8 0 "[ . 1 . 2]" 1
28 1 19 SER HB3 1 56 PHE HZ 5.932 4.916 6.948 6.255 5.216 6.639 . 0 0 "[ . 1 . 2]" 1
29 1 52 ILE HG12 2 11 TYR QE 6.266 . 11.481 4.591 4.422 4.739 . 0 0 "[ . 1 . 2]" 1
30 1 56 PHE HD1 2 2 TRP HZ2 7.720 . 15.538 5.378 5.133 5.523 . 0 0 "[ . 1 . 2]" 1
31 1 25 LEU QD 1 71 VAL HA 2.805 2.412 3.048 2.438 2.355 2.497 0.057 13 0 "[ . 1 . 2]" 1
32 1 40 ARG QB 1 63 THR HB 3.868 3.371 4.365 3.835 3.801 3.877 . 0 0 "[ . 1 . 2]" 1
33 1 63 THR HB 1 63 THR MG 1.894 . 2.138 2.096 2.092 2.100 . 0 0 "[ . 1 . 2]" 1
34 1 59 LEU QD 1 63 THR HB 3.594 3.317 4.098 3.076 3.031 3.119 0.286 20 0 "[ . 1 . 2]" 1
35 1 33 VAL HA 1 33 VAL HB 2.556 2.185 2.927 2.584 2.570 2.603 . 0 0 "[ . 1 . 2]" 1
36 1 37 ILE HA 1 37 ILE MG 2.215 . 2.503 2.483 2.465 2.499 . 0 0 "[ . 1 . 2]" 1
37 1 61 PRO HA 1 61 PRO HB3 2.245 . 2.518 2.306 2.293 2.317 . 0 0 "[ . 1 . 2]" 1
38 1 61 PRO HA 1 61 PRO HB2 2.650 2.353 2.947 2.985 2.976 2.992 0.045 14 0 "[ . 1 . 2]" 1
39 1 40 ARG QD 1 63 THR HA 2.123 . 2.447 1.936 1.795 2.154 0.004 17 0 "[ . 1 . 2]" 1
40 1 63 THR HA 1 66 GLU HB3 4.065 3.631 4.499 4.111 4.002 4.208 . 0 0 "[ . 1 . 2]" 1
41 1 63 THR HA 1 66 GLU HB2 2.345 2.005 2.685 2.524 2.479 2.612 . 0 0 "[ . 1 . 2]" 1
42 1 22 ILE HA 1 25 LEU HG 2.164 . 2.474 2.417 2.348 2.491 0.017 13 0 "[ . 1 . 2]" 1
43 1 22 ILE HA 1 22 ILE HG13 2.451 2.128 2.774 2.725 2.653 2.766 . 0 0 "[ . 1 . 2]" 1
44 1 36 ILE HA 1 36 ILE QG 2.612 2.309 2.682 2.418 2.397 2.433 . 0 0 "[ . 1 . 2]" 1
45 1 34 VAL QG 1 49 PRO HA 3.613 3.080 4.146 2.587 2.433 2.738 0.647 11 9 "[ * . * *1+ **-* *]" 1
46 1 44 LEU HB2 1 47 SER QB 4.881 4.115 5.647 3.537 3.310 3.921 0.805 6 16 "[****.+ ******-**** 2]" 1
47 1 47 SER QB 1 52 ILE HG13 4.024 3.442 4.606 3.767 3.629 4.069 . 0 0 "[ . 1 . 2]" 1
48 1 9 PRO HA 1 9 PRO HB2 2.496 2.211 2.781 2.733 2.696 2.767 . 0 0 "[ . 1 . 2]" 1
49 1 81 PRO HA 1 81 PRO QB 2.621 2.323 2.919 2.198 2.180 2.228 0.143 10 0 "[ . 1 . 2]" 1
50 1 9 PRO HA 1 9 PRO HB3 2.432 2.111 2.753 2.293 2.281 2.314 . 0 0 "[ . 1 . 2]" 1
51 1 12 TYR HA 1 15 LYS QB 2.934 2.465 3.403 2.455 2.406 2.531 0.059 10 0 "[ . 1 . 2]" 1
52 1 74 CYS HA 1 74 CYS QB . 2.605 2.694 2.360 2.348 2.380 0.257 15 0 "[ . 1 . 2]" 1
53 1 73 SER HA 1 76 ARG QB 3.517 2.904 4.130 3.312 2.986 3.489 . 0 0 "[ . 1 . 2]" 1
54 1 62 SER HA 1 65 ARG HB2 2.899 2.477 3.321 2.798 2.616 2.957 . 0 0 "[ . 1 . 2]" 1
55 1 15 LYS HA 1 15 LYS QD 4.519 4.055 4.984 3.824 3.797 3.854 0.258 9 0 "[ . 1 . 2]" 1
56 1 15 LYS HA 1 15 LYS QG 2.300 . 2.624 2.242 2.212 2.272 . 0 0 "[ . 1 . 2]" 1
57 1 69 ARG HA 1 69 ARG HD2 5.371 4.721 6.021 4.870 4.839 4.909 . 0 0 "[ . 1 . 2]" 1
58 1 38 GLN HA 1 38 GLN HG3 2.565 2.233 2.897 2.733 2.690 2.851 . 0 0 "[ . 1 . 2]" 1
59 1 68 GLU HA 1 68 GLU QB . 2.537 2.594 2.341 2.324 2.357 0.213 17 0 "[ . 1 . 2]" 1
60 1 38 GLN HA 1 38 GLN HB2 3.051 2.677 3.425 3.011 2.995 3.018 . 0 0 "[ . 1 . 2]" 1
61 1 69 ARG HA 1 69 ARG HB3 2.733 2.449 3.017 3.026 3.021 3.031 0.014 6 0 "[ . 1 . 2]" 1
62 1 38 GLN HA 1 38 GLN HB3 2.259 . 2.527 2.576 2.562 2.602 0.075 20 0 "[ . 1 . 2]" 1
63 1 14 GLU HA 1 14 GLU QB 2.856 2.537 3.122 2.413 2.396 2.433 0.141 9 0 "[ . 1 . 2]" 1
64 1 14 GLU HA 1 17 GLN HB3 2.556 2.230 2.882 2.865 2.697 2.953 0.071 8 0 "[ . 1 . 2]" 1
65 1 66 GLU HA 1 66 GLU HB3 2.614 2.303 2.925 2.590 2.541 2.714 . 0 0 "[ . 1 . 2]" 1
66 1 66 GLU HA 1 66 GLU HB2 2.845 2.536 3.154 3.011 2.973 3.023 . 0 0 "[ . 1 . 2]" 1
67 1 28 GLU HA 1 28 GLU HB3 2.705 2.411 2.999 3.002 2.615 3.024 0.025 12 0 "[ . 1 . 2]" 1
68 1 64 LEU HA 1 64 LEU HG 2.473 2.138 2.808 2.807 2.795 2.817 0.009 2 0 "[ . 1 . 2]" 1
69 1 16 ARG HA 1 16 ARG HG2 3.681 3.273 4.089 3.592 3.443 3.864 . 0 0 "[ . 1 . 2]" 1
70 1 17 GLN HA 1 17 GLN HG3 2.749 2.412 3.086 3.006 2.796 3.062 . 0 0 "[ . 1 . 2]" 1
71 1 17 GLN HA 1 17 GLN HB3 2.830 2.530 3.130 3.028 3.005 3.035 . 0 0 "[ . 1 . 2]" 1
72 1 17 GLN HA 1 17 GLN HB2 2.521 2.206 2.836 2.499 2.457 2.619 . 0 0 "[ . 1 . 2]" 1
73 1 17 GLN HA 1 20 LEU HB2 2.221 . 2.502 2.435 2.399 2.480 . 0 0 "[ . 1 . 2]" 1
74 1 17 GLN HA 1 20 LEU HB3 3.575 3.250 3.900 3.993 3.965 4.028 0.128 6 0 "[ . 1 . 2]" 1
75 1 17 GLN HA 1 20 LEU MD1 2.337 2.056 2.618 2.086 2.027 2.159 0.029 13 0 "[ . 1 . 2]" 1
76 1 18 LEU HA 1 18 LEU QB 2.545 2.202 2.759 2.517 2.502 2.525 . 0 0 "[ . 1 . 2]" 1
77 1 21 ASP HA 1 21 ASP QB 2.110 . 2.370 2.158 2.146 2.164 . 0 0 "[ . 1 . 2]" 1
78 1 20 LEU HA 1 20 LEU HB2 2.729 2.438 3.020 3.013 3.010 3.018 . 0 0 "[ . 1 . 2]" 1
79 1 20 LEU HA 1 20 LEU HG 2.675 2.345 3.005 2.997 2.961 3.033 0.028 2 0 "[ . 1 . 2]" 1
80 1 21 ASP HA 1 24 LYS QD 2.488 2.181 2.795 2.087 1.646 2.171 0.535 3 2 "[ + .- 1 . 2]" 1
81 1 20 LEU HA 1 20 LEU HB3 2.304 2.034 2.574 2.503 2.491 2.521 . 0 0 "[ . 1 . 2]" 1
82 1 21 ASP HA 1 75 LEU QD 2.402 2.070 2.734 2.495 2.382 2.542 . 0 0 "[ . 1 . 2]" 1
83 1 65 ARG HA 1 65 ARG QD 2.735 2.358 3.093 2.040 1.986 2.129 0.372 15 0 "[ . 1 . 2]" 1
84 1 32 ARG HA 1 32 ARG QB . 2.537 2.670 2.259 2.242 2.271 0.295 20 0 "[ . 1 . 2]" 1
85 1 76 ARG HA 1 76 ARG QD 4.270 3.849 4.691 4.172 3.864 4.221 . 0 0 "[ . 1 . 2]" 1
86 1 76 ARG HA 1 76 ARG QB 2.641 2.391 2.891 2.376 2.360 2.403 0.031 12 0 "[ . 1 . 2]" 1
87 1 76 ARG HA 1 76 ARG HG3 2.950 2.681 3.219 3.224 3.185 3.276 0.057 2 0 "[ . 1 . 2]" 1
88 1 10 MET HA 1 10 MET QB . 2.373 2.482 2.401 2.384 2.422 . 0 0 "[ . 1 . 2]" 1
89 1 29 LYS HA 1 29 LYS QB 2.331 2.218 2.629 2.459 2.450 2.474 . 0 0 "[ . 1 . 2]" 1
90 1 29 LYS HA 1 29 LYS HG3 3.201 2.840 3.562 3.506 3.485 3.527 . 0 0 "[ . 1 . 2]" 1
91 1 29 LYS HA 1 29 LYS HG2 3.072 2.729 3.415 3.285 3.240 3.325 . 0 0 "[ . 1 . 2]" 1
92 1 78 LYS HA 1 78 LYS HG3 2.726 2.382 3.070 2.852 2.474 3.151 0.081 19 0 "[ . 1 . 2]" 1
93 1 77 LYS HA 1 77 LYS HG3 2.360 2.107 2.613 2.766 2.601 3.381 0.768 15 1 "[ . 1 + 2]" 1
94 1 75 LEU HA 1 75 LEU QB . 2.619 2.680 2.317 2.307 2.324 0.312 6 0 "[ . 1 . 2]" 1
95 1 23 ASN HA 1 23 ASN HB3 2.584 2.316 2.852 2.688 2.664 2.715 . 0 0 "[ . 1 . 2]" 1
96 1 8 LYS HA 1 9 PRO HG2 4.773 4.286 5.260 4.401 4.252 4.615 0.034 8 0 "[ . 1 . 2]" 1
97 1 25 LEU HA 1 26 PRO QD 2.285 2.006 2.370 1.949 1.928 1.967 0.078 18 0 "[ . 1 . 2]" 1
98 1 25 LEU HA 1 26 PRO HG3 4.283 3.863 4.703 4.275 4.254 4.311 . 0 0 "[ . 1 . 2]" 1
99 1 25 LEU HA 1 25 LEU HB2 2.795 2.452 3.138 2.999 2.989 3.005 . 0 0 "[ . 1 . 2]" 1
100 1 25 LEU HA 1 25 LEU HB3 2.226 . 2.537 2.369 2.356 2.377 . 0 0 "[ . 1 . 2]" 1
101 1 41 GLU HA 1 41 GLU QG 3.839 3.350 4.328 3.022 2.973 3.076 0.377 6 0 "[ . 1 . 2]" 1
102 1 41 GLU HA 1 41 GLU HB2 2.915 2.591 3.239 3.013 3.007 3.019 . 0 0 "[ . 1 . 2]" 1
103 1 41 GLU HA 1 41 GLU HB3 2.756 2.356 3.156 2.387 2.366 2.407 . 0 0 "[ . 1 . 2]" 1
104 1 61 PRO HD2 1 61 PRO HG3 2.995 2.657 3.333 2.889 2.856 2.918 . 0 0 "[ . 1 . 2]" 1
105 1 26 PRO QD 1 26 PRO HG3 . 2.577 2.597 2.200 2.194 2.207 0.383 12 0 "[ . 1 . 2]" 1
106 1 69 ARG HB3 1 69 ARG HD3 2.442 2.123 2.761 2.780 2.697 2.894 0.133 20 0 "[ . 1 . 2]" 1
107 1 69 ARG HD3 1 69 ARG HG3 2.184 . 2.417 2.399 2.357 2.423 0.006 1 0 "[ . 1 . 2]" 1
108 1 69 ARG HB3 1 69 ARG HD2 3.313 2.990 3.636 3.536 3.503 3.562 . 0 0 "[ . 1 . 2]" 1
109 1 59 LEU QB 1 59 LEU HG 2.716 2.360 2.770 2.362 2.352 2.370 0.008 8 0 "[ . 1 . 2]" 1
110 1 76 ARG QD 1 76 ARG HG3 2.269 2.005 2.533 2.181 2.164 2.440 . 0 0 "[ . 1 . 2]" 1
111 1 16 ARG QD 1 16 ARG HG3 . 2.663 2.736 2.311 2.258 2.384 0.405 19 0 "[ . 1 . 2]" 1
112 1 16 ARG QD 1 16 ARG HG2 2.579 2.521 2.912 2.295 2.172 2.416 0.349 10 0 "[ . 1 . 2]" 1
113 1 59 LEU QB 1 59 LEU QD . 2.117 2.463 1.948 1.943 1.955 0.174 15 0 "[ . 1 . 2]" 1
114 1 67 LEU QB 1 67 LEU HG 2.558 2.368 2.871 2.309 2.304 2.314 0.064 13 0 "[ . 1 . 2]" 1
115 1 29 LYS QE 1 29 LYS HG3 3.231 2.881 3.259 3.030 2.989 3.092 . 0 0 "[ . 1 . 2]" 1
116 1 24 LYS QE 1 75 LEU QD . 3.492 3.843 3.305 3.034 3.360 0.458 18 0 "[ . 1 . 2]" 1
117 1 15 LYS QE 1 64 LEU QB 3.873 3.277 4.469 3.577 3.492 3.651 . 0 0 "[ . 1 . 2]" 1
118 1 20 LEU HB2 1 20 LEU HG 2.345 2.031 2.659 2.487 2.476 2.507 . 0 0 "[ . 1 . 2]" 1
119 1 20 LEU HB3 1 20 LEU HG 2.715 2.409 3.021 3.015 3.012 3.017 . 0 0 "[ . 1 . 2]" 1
120 1 15 LYS QE 1 15 LYS QG . 2.654 3.030 2.166 2.151 2.179 0.503 16 1 "[ . 1 .+ 2]" 1
121 1 25 LEU HB3 1 25 LEU HG 2.823 2.429 3.217 3.009 3.006 3.012 . 0 0 "[ . 1 . 2]" 1
122 1 36 ILE MD 1 70 TYR QB 3.403 2.854 3.952 2.734 2.546 2.825 0.308 20 0 "[ . 1 . 2]" 1
123 1 33 VAL HA 1 36 ILE HB 2.059 . 2.317 2.448 2.404 2.482 0.165 14 0 "[ . 1 . 2]" 1
124 1 37 ILE HB 1 63 THR MG 3.917 3.427 4.407 3.977 3.966 3.993 . 0 0 "[ . 1 . 2]" 1
125 1 36 ILE HB 1 36 ILE MG 2.045 . 2.349 2.131 2.127 2.135 . 0 0 "[ . 1 . 2]" 1
126 1 40 ARG QD 1 66 GLU QG 3.927 3.359 4.495 2.701 2.394 3.061 0.965 17 16 "[* ********- **+***]" 1
127 1 10 MET QB 1 10 MET QG 2.411 2.172 2.727 2.009 2.005 2.016 0.167 1 0 "[ . 1 . 2]" 1
128 1 38 GLN HB2 1 38 GLN HG3 2.521 2.191 2.851 2.539 2.451 2.566 . 0 0 "[ . 1 . 2]" 1
129 1 38 GLN HB3 1 38 GLN HG3 2.806 2.503 3.109 3.000 2.994 3.011 . 0 0 "[ . 1 . 2]" 1
130 1 38 GLN HG3 1 52 ILE MD 2.901 2.520 3.282 2.942 2.877 2.991 . 0 0 "[ . 1 . 2]" 1
131 1 24 LYS QB 1 24 LYS QD 2.165 . 2.475 2.082 1.997 2.100 . 0 0 "[ . 1 . 2]" 1
132 1 24 LYS QB 1 75 LEU QD 3.545 2.974 3.705 2.048 1.979 2.151 0.995 13 20 [*****-******+*******] 1
133 1 17 GLN HB2 1 17 GLN HG3 3.221 2.885 3.557 3.007 3.004 3.009 . 0 0 "[ . 1 . 2]" 1
134 1 40 ARG QB 1 40 ARG HG2 2.599 2.299 2.899 2.512 2.488 2.529 . 0 0 "[ . 1 . 2]" 1
135 1 40 ARG QB 1 40 ARG QD 2.670 2.437 2.991 2.366 2.087 2.472 0.350 3 0 "[ . 1 . 2]" 1
136 1 29 LYS QB 1 29 LYS HG2 2.903 2.531 3.275 2.185 2.173 2.197 0.358 3 0 "[ . 1 . 2]" 1
137 1 60 LYS HB3 1 60 LYS HG2 2.091 . 2.368 2.411 2.396 2.425 0.057 14 0 "[ . 1 . 2]" 1
138 1 71 VAL HA 1 71 VAL HB 2.309 2.004 2.614 2.426 2.412 2.452 . 0 0 "[ . 1 . 2]" 1
139 1 22 ILE HG12 1 71 VAL QG 2.497 2.060 2.934 1.958 1.874 2.104 0.186 8 0 "[ . 1 . 2]" 1
140 1 71 VAL HB 1 75 LEU QD 3.171 2.693 3.649 2.271 2.114 2.450 0.579 2 1 "[ + . 1 . 2]" 1
141 1 69 ARG HB2 1 69 ARG HD3 2.977 2.640 3.314 2.827 2.735 2.887 . 0 0 "[ . 1 . 2]" 1
142 1 68 GLU QB 1 68 GLU QG . 2.170 2.483 2.018 1.984 2.075 0.186 5 0 "[ . 1 . 2]" 1
143 1 69 ARG HB3 1 69 ARG HG2 2.900 2.563 3.237 2.629 2.559 2.675 0.004 20 0 "[ . 1 . 2]" 1
144 1 69 ARG HB2 1 69 ARG HG2 2.582 2.325 2.839 2.951 2.940 2.966 0.127 20 0 "[ . 1 . 2]" 1
145 1 37 ILE HA 1 37 ILE HG13 2.421 . 2.855 2.196 2.161 2.217 . 0 0 "[ . 1 . 2]" 1
146 1 37 ILE HA 1 37 ILE HG12 3.077 2.645 3.509 2.966 2.928 3.036 . 0 0 "[ . 1 . 2]" 1
147 1 76 ARG QB 1 76 ARG HG3 2.080 . 2.329 2.273 2.251 2.299 . 0 0 "[ . 1 . 2]" 1
148 1 37 ILE MD 1 37 ILE HG13 1.893 . 2.155 2.058 2.055 2.063 . 0 0 "[ . 1 . 2]" 1
149 1 16 ARG QB 1 16 ARG QD . 3.269 3.370 2.231 2.123 2.368 1.146 19 20 [********-*********+*] 1
150 1 16 ARG QB 1 16 ARG HG2 2.537 2.171 2.903 2.266 2.151 2.313 0.020 20 0 "[ . 1 . 2]" 1
151 1 36 ILE HB 1 36 ILE QG 2.975 2.561 3.389 2.413 2.402 2.435 0.159 19 0 "[ . 1 . 2]" 1
152 1 28 GLU HB3 1 28 GLU QG 2.191 2.026 2.419 2.165 2.148 2.348 . 0 0 "[ . 1 . 2]" 1
153 1 69 ARG HD3 1 69 ARG HG2 2.895 2.618 3.172 3.009 3.002 3.013 . 0 0 "[ . 1 . 2]" 1
154 1 69 ARG HD2 1 69 ARG HG2 2.420 2.132 2.708 2.407 2.375 2.424 . 0 0 "[ . 1 . 2]" 1
155 1 69 ARG HD2 1 69 ARG HG3 2.424 2.144 2.704 2.470 2.441 2.523 . 0 0 "[ . 1 . 2]" 1
156 1 29 LYS QD 1 29 LYS HG3 . 2.641 2.749 2.339 2.321 2.354 0.320 3 0 "[ . 1 . 2]" 1
157 1 26 PRO QD 1 26 PRO HG2 . 2.496 2.575 2.177 2.171 2.183 0.325 9 0 "[ . 1 . 2]" 1
158 1 26 PRO QD 1 29 LYS QD 4.474 4.320 5.038 4.470 4.422 4.494 . 0 0 "[ . 1 . 2]" 1
159 1 26 PRO QB 1 26 PRO HG2 2.232 . 2.514 2.176 2.171 2.180 . 0 0 "[ . 1 . 2]" 1
160 1 52 ILE MD 1 52 ILE HG12 2.034 . 2.330 2.102 2.096 2.109 . 0 0 "[ . 1 . 2]" 1
161 1 52 ILE HG13 1 52 ILE MG 1.911 . 2.173 2.257 2.209 2.286 0.113 16 0 "[ . 1 . 2]" 1
162 1 9 PRO HB2 1 9 PRO HG2 2.139 . 2.371 2.313 2.308 2.324 . 0 0 "[ . 1 . 2]" 1
163 1 30 LEU QD 1 30 LEU HG 2.427 2.038 2.695 1.885 1.877 1.887 0.161 8 0 "[ . 1 . 2]" 1
164 1 25 LEU MD1 1 25 LEU MD2 1.843 . 2.085 1.958 1.936 1.972 . 0 0 "[ . 1 . 2]" 1
165 1 32 ARG QB 1 32 ARG HG3 2.808 2.583 3.132 2.512 2.495 2.520 0.088 9 0 "[ . 1 . 2]" 1
166 1 65 ARG HB2 1 65 ARG HG3 2.815 2.449 3.181 2.482 2.451 2.511 . 0 0 "[ . 1 . 2]" 1
167 1 21 ASP QB 1 75 LEU QD 2.774 2.461 3.087 1.985 1.952 2.033 0.509 11 2 "[- . 1+ . 2]" 1
168 1 29 LYS QB 1 29 LYS HG3 . 2.567 2.575 2.163 2.146 2.168 0.421 3 0 "[ . 1 . 2]" 1
169 1 60 LYS HB2 1 60 LYS HG3 2.316 2.017 2.615 2.457 2.448 2.468 . 0 0 "[ . 1 . 2]" 1
170 1 60 LYS HB2 1 60 LYS HG2 3.120 2.735 3.505 3.006 3.003 3.008 . 0 0 "[ . 1 . 2]" 1
171 1 60 LYS HD2 1 60 LYS HG3 2.535 2.174 2.896 2.358 2.269 2.481 . 0 0 "[ . 1 . 2]" 1
172 1 20 LEU HB2 1 20 LEU MD1 2.232 . 2.496 2.313 2.272 2.355 . 0 0 "[ . 1 . 2]" 1
173 1 33 VAL HA 1 67 LEU QD 2.271 . 2.542 2.496 2.468 2.525 . 0 0 "[ . 1 . 2]" 1
174 1 67 LEU QB 1 67 LEU QD . 2.153 2.393 1.916 1.912 1.922 0.241 1 0 "[ . 1 . 2]" 1
175 1 37 ILE HA 1 63 THR MG 1.937 . 2.201 1.785 1.771 1.814 . 0 0 "[ . 1 . 2]" 1
176 1 59 LEU HG 1 64 LEU QD 3.639 3.045 4.233 3.066 3.015 3.128 0.030 11 0 "[ . 1 . 2]" 1
177 1 15 LYS QG 1 64 LEU QD . 3.769 4.074 2.420 2.376 2.445 1.393 8 20 [*-*****+************] 1
178 1 59 LEU QD 1 63 THR MG 2.561 2.464 2.841 2.505 2.470 2.531 . 0 0 "[ . 1 . 2]" 1
179 1 22 ILE HG13 1 71 VAL QG 2.344 2.045 2.643 2.192 2.101 2.249 . 0 0 "[ . 1 . 2]" 1
180 1 33 VAL HA 1 33 VAL QG 2.079 . 2.326 2.155 2.109 2.169 . 0 0 "[ . 1 . 2]" 1
181 1 25 LEU HB3 1 25 LEU QD 2.274 . 2.601 2.120 2.104 2.132 . 0 0 "[ . 1 . 2]" 1
182 1 33 VAL QG 1 36 ILE MD 2.630 2.263 2.997 2.729 2.623 2.775 . 0 0 "[ . 1 . 2]" 1
183 1 20 LEU MD2 1 20 LEU HG 2.087 . 2.358 2.114 2.110 2.117 . 0 0 "[ . 1 . 2]" 1
184 1 71 VAL MG1 1 71 VAL MG2 1.921 . 2.183 1.987 1.978 1.991 . 0 0 "[ . 1 . 2]" 1
185 1 57 GLU HB2 1 58 THR MG 2.997 2.530 3.464 3.103 2.978 3.190 . 0 0 "[ . 1 . 2]" 1
186 1 33 VAL HB 1 33 VAL QG 2.012 . 2.290 1.893 1.891 1.897 . 0 0 "[ . 1 . 2]" 1
187 1 30 LEU QB 1 33 VAL QG 2.610 2.216 3.004 2.706 2.649 2.766 . 0 0 "[ . 1 . 2]" 1
188 1 37 ILE MG 1 41 GLU QG 2.100 . 2.378 2.271 2.244 2.311 . 0 0 "[ . 1 . 2]" 1
189 1 37 ILE MG 1 41 GLU HB2 2.433 2.100 2.766 2.521 2.477 2.552 . 0 0 "[ . 1 . 2]" 1
190 1 22 ILE HB 1 22 ILE MG 2.205 . 2.516 2.121 2.115 2.123 . 0 0 "[ . 1 . 2]" 1
191 1 36 ILE MG 1 66 GLU HB2 2.521 2.170 2.872 2.556 2.439 2.681 . 0 0 "[ . 1 . 2]" 1
192 1 37 ILE MD 1 63 THR MG 3.429 3.026 3.832 3.323 3.301 3.340 . 0 0 "[ . 1 . 2]" 1
193 1 37 ILE MD 1 67 LEU QD 2.365 . 2.753 1.637 1.614 1.649 0.363 15 0 "[ . 1 . 2]" 1
194 1 22 ILE MD 1 22 ILE HG13 2.175 . 2.474 2.119 2.116 2.122 . 0 0 "[ . 1 . 2]" 1
195 1 22 ILE HB 1 22 ILE MD 2.168 . 2.429 2.320 2.302 2.340 . 0 0 "[ . 1 . 2]" 1
196 1 33 VAL HA 1 36 ILE MD 2.193 . 2.444 2.317 2.255 2.439 . 0 0 "[ . 1 . 2]" 1
197 1 36 ILE HB 1 36 ILE MD 2.036 . 2.286 2.305 2.286 2.322 0.036 19 0 "[ . 1 . 2]" 1
198 1 36 ILE MD 1 36 ILE QG 2.169 2.161 2.441 1.884 1.882 1.886 0.279 2 0 "[ . 1 . 2]" 1
199 1 32 ARG HG3 1 36 ILE MD 2.469 2.121 2.817 2.399 2.346 2.492 . 0 0 "[ . 1 . 2]" 1
200 1 32 ARG HG2 1 36 ILE MD 3.154 2.734 3.574 2.985 2.947 3.048 . 0 0 "[ . 1 . 2]" 1
201 1 52 ILE MD 1 52 ILE HG13 2.133 . 2.455 2.114 2.105 2.119 . 0 0 "[ . 1 . 2]" 1
202 1 12 TYR HE1 1 16 ARG QD 3.861 3.671 4.342 3.431 3.113 3.623 0.558 20 2 "[ . 1 - +]" 1
203 1 35 HIS HB3 1 35 HIS HD2 2.932 2.526 3.338 2.774 2.605 2.810 . 0 0 "[ . 1 . 2]" 1
204 1 32 ARG QB 1 70 TYR QE . 4.194 4.253 2.915 2.890 2.941 1.304 3 20 [**+***-*************] 1
205 1 32 ARG HG2 1 70 TYR QE 3.853 3.288 4.418 2.837 2.753 2.893 0.535 20 1 "[ . 1 . +]" 1
206 1 67 LEU QD 2 2 TRP HH2 3.539 2.913 4.165 3.699 3.570 3.794 . 0 0 "[ . 1 . 2]" 1
207 1 33 VAL QG 1 70 TYR QD 2.463 2.243 2.683 2.125 2.053 2.190 0.190 13 0 "[ . 1 . 2]" 1
208 1 25 LEU QD 1 70 TYR QE 3.858 3.382 4.334 2.056 2.001 2.150 1.381 5 20 [****+********-******] 1
209 1 22 ILE MD 1 56 PHE QE 3.130 2.781 3.479 2.423 2.362 2.502 0.419 6 0 "[ . 1 . 2]" 1
210 1 36 ILE MD 1 70 TYR QD 3.315 2.959 3.671 3.274 3.185 3.324 . 0 0 "[ . 1 . 2]" 1
211 1 36 ILE MD 1 70 TYR QE 4.347 3.848 4.846 4.236 4.173 4.288 . 0 0 "[ . 1 . 2]" 1
212 1 70 TYR HA 1 73 SER HB3 2.651 2.307 2.995 3.092 3.059 3.130 0.135 5 0 "[ . 1 . 2]" 1
213 1 73 SER HA 1 73 SER HB3 2.355 2.145 2.565 2.631 2.612 2.657 0.092 7 0 "[ . 1 . 2]" 1
214 1 43 SER HA 1 43 SER HB2 2.889 2.602 3.176 2.864 2.512 3.040 0.090 18 0 "[ . 1 . 2]" 1
215 1 11 SER HA 1 11 SER QB 2.819 2.526 2.875 2.263 2.196 2.338 0.330 14 0 "[ . 1 . 2]" 1
216 1 60 LYS HA 1 61 PRO HD3 2.531 2.239 2.823 2.430 2.391 2.468 . 0 0 "[ . 1 . 2]" 1
217 1 59 LEU HA 1 59 LEU QB . 2.360 2.622 2.282 2.269 2.290 0.091 15 0 "[ . 1 . 2]" 1
218 1 61 PRO HA 1 64 LEU QB . 3.825 3.842 2.947 2.839 3.046 0.986 19 20 [*******-**********+*] 1
219 1 20 LEU HA 1 23 ASN HB3 2.575 2.245 2.905 3.034 2.965 3.084 0.179 14 0 "[ . 1 . 2]" 1
220 1 14 GLU HA 1 14 GLU QG 2.772 2.464 3.015 2.416 2.281 2.746 0.183 19 0 "[ . 1 . 2]" 1
221 1 42 PRO HB3 1 42 PRO HD2 4.417 3.922 4.912 3.895 3.868 3.910 0.054 17 0 "[ . 1 . 2]" 1
222 1 9 PRO HB2 1 9 PRO HD2 4.224 3.725 4.723 4.036 4.021 4.052 . 0 0 "[ . 1 . 2]" 1
223 1 60 LYS HB2 1 61 PRO HD3 3.996 3.577 4.415 3.848 3.774 3.905 . 0 0 "[ . 1 . 2]" 1
224 1 60 LYS HA 1 60 LYS HB3 2.611 2.287 2.935 2.540 2.512 2.564 . 0 0 "[ . 1 . 2]" 1
225 1 69 ARG HA 1 69 ARG HB2 2.415 2.112 2.718 2.442 2.421 2.459 . 0 0 "[ . 1 . 2]" 1
226 1 35 HIS HA 1 35 HIS HB3 2.718 2.472 2.964 3.019 3.013 3.034 0.070 20 0 "[ . 1 . 2]" 1
227 1 32 ARG HA 1 35 HIS HB3 2.191 . 2.442 2.476 2.428 2.512 0.070 20 0 "[ . 1 . 2]" 1
228 1 12 TYR HA 1 15 LYS QD 4.134 3.685 4.432 3.169 3.084 3.310 0.601 16 14 "[ * ** *** ** -+****]" 1
229 1 60 LYS HA 1 60 LYS HD3 4.641 4.101 5.181 4.645 4.539 4.811 . 0 0 "[ . 1 . 2]" 1
230 1 60 LYS HA 1 60 LYS HD2 4.898 4.349 5.447 5.457 5.027 5.529 0.082 4 0 "[ . 1 . 2]" 1
231 1 69 ARG HA 1 69 ARG HG2 2.364 2.084 2.644 2.768 2.704 2.872 0.228 19 0 "[ . 1 . 2]" 1
232 1 61 PRO HD3 1 61 PRO HG3 2.686 2.310 3.062 2.263 2.256 2.273 0.054 6 0 "[ . 1 . 2]" 1
233 1 9 PRO HA 1 61 PRO HG2 4.002 3.603 4.401 4.292 4.209 4.407 0.006 13 0 "[ . 1 . 2]" 1
234 1 40 ARG HA 1 40 ARG HG2 2.522 2.203 2.841 2.471 2.444 2.511 . 0 0 "[ . 1 . 2]" 1
235 1 61 PRO HA 1 61 PRO HG3 3.454 2.950 3.958 3.031 2.940 3.152 0.010 11 0 "[ . 1 . 2]" 1
236 1 49 PRO QD 1 49 PRO HG3 2.105 . 2.327 2.242 2.155 2.255 . 0 0 "[ . 1 . 2]" 1
237 1 79 ARG HA 1 79 ARG QG 3.685 3.318 4.052 2.976 2.810 3.108 0.508 6 1 "[ .+ 1 . 2]" 1
238 1 30 LEU HA 1 30 LEU HG 2.332 2.006 2.658 2.408 2.380 2.519 . 0 0 "[ . 1 . 2]" 1
239 1 32 ARG HA 1 32 ARG HG2 3.770 3.379 4.161 3.919 3.906 3.933 . 0 0 "[ . 1 . 2]" 1
240 1 59 LEU HA 1 59 LEU HG 3.084 2.660 3.508 3.316 3.295 3.336 . 0 0 "[ . 1 . 2]" 1
241 1 56 PHE HA 1 59 LEU HG 2.369 2.019 2.719 2.219 2.136 2.271 . 0 0 "[ . 1 . 2]" 1
242 1 59 LEU QD 1 64 LEU HA 3.546 2.906 4.186 3.334 3.295 3.370 . 0 0 "[ . 1 . 2]" 1
243 1 24 LYS HA 1 24 LYS QG 2.561 2.280 2.749 2.408 2.384 2.444 . 0 0 "[ . 1 . 2]" 1
244 1 67 LEU HA 1 67 LEU QD 2.192 . 2.453 2.144 2.123 2.173 . 0 0 "[ . 1 . 2]" 1
245 1 33 VAL QG 1 67 LEU HA 2.312 2.030 2.594 2.451 2.278 2.545 . 0 0 "[ . 1 . 2]" 1
246 1 20 LEU HA 1 20 LEU MD2 2.089 . 2.312 1.955 1.934 1.988 . 0 0 "[ . 1 . 2]" 1
247 1 74 CYS HA 1 75 LEU QD 5.005 4.303 5.707 4.851 4.767 4.893 . 0 0 "[ . 1 . 2]" 1
248 1 30 LEU HA 1 33 VAL QG 2.784 2.300 3.268 1.771 1.744 1.799 0.556 18 20 [**-**************+**] 1
249 1 36 ILE MD 1 67 LEU HA 2.382 2.064 2.700 2.653 2.594 2.690 . 0 0 "[ . 1 . 2]" 1
250 1 47 SER QB 1 52 ILE MD 3.087 2.575 3.583 1.746 1.713 1.782 0.862 13 20 [************+***-***] 1
251 1 22 ILE HA 1 22 ILE HG12 2.822 2.320 3.324 2.566 2.477 2.607 . 0 0 "[ . 1 . 2]" 1
252 1 10 MET HA 1 10 MET ME 4.007 3.430 4.584 3.945 3.751 4.081 . 0 0 "[ . 1 . 2]" 1
253 1 54 ILE MD 2 2 TRP HH2 3.042 2.523 3.561 2.370 2.083 2.510 0.440 14 0 "[ . 1 . 2]" 1
254 1 19 SER HA 1 22 ILE MD 3.125 2.647 3.603 2.567 2.544 2.591 0.103 8 0 "[ . 1 . 2]" 1
255 1 36 ILE MG 1 63 THR HA 3.292 2.778 3.806 3.005 2.933 3.075 . 0 0 "[ . 1 . 2]" 1
256 1 36 ILE MG 1 67 LEU HA 3.293 2.829 3.757 3.694 3.656 3.727 . 0 0 "[ . 1 . 2]" 1
257 1 22 ILE HA 1 22 ILE MG 3.058 2.505 3.611 2.476 2.448 2.507 0.057 8 0 "[ . 1 . 2]" 1
258 1 22 ILE MG 1 23 ASN HA 4.020 3.248 4.792 3.214 2.971 3.290 0.277 13 0 "[ . 1 . 2]" 1
259 1 37 ILE MG 1 38 GLN HA 3.064 2.593 3.535 3.058 2.935 3.113 . 0 0 "[ . 1 . 2]" 1
260 1 26 PRO QD 1 75 LEU QD 3.868 3.666 4.474 3.774 3.735 3.849 . 0 0 "[ . 1 . 2]" 1
261 1 44 LEU QD 1 58 THR HB 4.155 3.544 4.766 4.215 3.868 4.391 . 0 0 "[ . 1 . 2]" 1
262 1 18 LEU QD 1 56 PHE QE 5.278 4.636 5.920 2.694 2.641 2.741 1.995 13 20 [************+******-] 1
263 1 22 ILE HA 1 71 VAL QG 2.604 2.155 3.053 1.669 1.631 1.720 0.524 2 6 "[ + .- ** * * 2]" 1
264 1 56 PHE HD1 1 64 LEU QD 4.588 3.794 5.382 3.598 3.534 3.662 0.260 2 0 "[ . 1 . 2]" 1
265 1 60 LYS HG3 1 61 PRO HD2 4.322 3.628 5.016 3.932 3.781 4.067 . 0 0 "[ . 1 . 2]" 1
266 1 60 LYS HG2 1 61 PRO HD2 5.090 4.429 5.751 4.904 4.815 4.985 . 0 0 "[ . 1 . 2]" 1
267 1 60 LYS HG2 1 61 PRO HD3 5.903 5.157 6.649 5.775 5.739 5.814 . 0 0 "[ . 1 . 2]" 1
268 1 60 LYS HG3 1 61 PRO HD3 5.191 4.455 5.927 5.025 4.916 5.118 . 0 0 "[ . 1 . 2]" 1
269 1 32 ARG HA 1 32 ARG HG3 3.104 2.636 3.572 2.893 2.859 2.928 . 0 0 "[ . 1 . 2]" 1
270 1 26 PRO HA 1 26 PRO HG2 4.106 3.658 4.554 4.018 4.006 4.027 . 0 0 "[ . 1 . 2]" 1
271 1 60 LYS HA 1 61 PRO HG3 5.129 4.576 5.682 4.543 4.519 4.560 0.057 11 0 "[ . 1 . 2]" 1
272 1 26 PRO HA 1 26 PRO HG3 3.685 3.202 4.168 3.305 3.271 3.345 . 0 0 "[ . 1 . 2]" 1
273 1 8 LYS HA 1 8 LYS HD2 3.991 3.576 4.406 4.361 2.939 5.174 0.768 4 4 "[ +- * 1 . *]" 1
274 1 9 PRO HB2 1 9 PRO HD3 4.463 3.934 4.992 3.921 3.898 3.941 0.036 6 0 "[ . 1 . 2]" 1
275 1 78 LYS HB3 1 81 PRO QD 5.781 4.753 6.809 6.308 5.317 6.648 . 0 0 "[ . 1 . 2]" 1
276 1 40 ARG QB 1 63 THR MG . 3.688 3.814 1.872 1.842 1.903 1.846 6 20 [*****+****-*********] 1
277 1 38 GLN HG2 1 44 LEU QD 2.919 2.404 3.434 1.984 1.854 2.096 0.550 14 3 "[ .- 1 +. *2]" 1
278 1 38 GLN HA 1 38 GLN HG2 2.839 2.423 3.255 2.617 2.456 2.673 . 0 0 "[ . 1 . 2]" 1
279 1 66 GLU HA 1 66 GLU QG 3.854 3.440 4.268 2.819 2.548 3.007 0.892 14 19 "[*** ****-****+******]" 1
280 1 48 ASN HA 1 48 ASN HB2 2.757 2.417 3.097 2.811 2.750 2.933 . 0 0 "[ . 1 . 2]" 1
281 1 64 LEU HA 1 64 LEU QB 3.018 2.656 3.436 2.335 2.329 2.340 0.327 20 0 "[ . 1 . 2]" 1
282 1 29 LYS QE 1 29 LYS HG2 . 3.146 3.400 2.610 2.548 2.732 0.598 11 18 "[** *** -**+*********]" 1
283 1 64 LEU HA 1 67 LEU QB . 3.624 3.772 2.870 2.823 2.912 0.801 18 20 [****-************+**] 1
284 1 16 ARG HA 1 16 ARG QD 4.780 4.256 5.304 4.092 3.795 4.328 0.461 15 0 "[ . 1 . 2]" 1
285 1 69 ARG HA 1 69 ARG HD3 5.044 4.447 5.641 4.628 4.540 4.672 . 0 0 "[ . 1 . 2]" 1
286 1 66 GLU HA 1 69 ARG HD3 4.095 3.439 4.751 4.758 4.613 4.804 0.053 3 0 "[ . 1 . 2]" 1
287 1 8 LYS HA 1 9 PRO HD2 2.454 2.123 2.785 2.262 2.045 2.569 0.078 8 0 "[ . 1 . 2]" 1
288 1 48 ASN HA 1 49 PRO HG3 4.518 4.064 4.972 4.177 4.040 4.703 0.024 4 0 "[ . 1 . 2]" 1
289 1 8 LYS HA 1 9 PRO HD3 2.151 . 2.383 2.303 2.185 2.417 0.034 7 0 "[ . 1 . 2]" 1
290 1 80 LYS HA 1 81 PRO QD 2.471 2.187 2.755 2.003 1.926 2.262 0.261 12 0 "[ . 1 . 2]" 1
291 1 60 LYS HA 1 61 PRO HD2 2.411 2.122 2.700 2.294 2.269 2.334 . 0 0 "[ . 1 . 2]" 1
292 1 67 LEU HA 1 70 TYR QE 5.668 4.703 6.633 5.071 4.983 5.156 . 0 0 "[ . 1 . 2]" 1
293 1 43 SER HA 1 43 SER HB3 2.939 2.566 3.312 2.535 2.394 3.033 0.172 12 0 "[ . 1 . 2]" 1
294 1 19 SER HA 1 19 SER HB3 2.683 2.332 3.034 2.404 2.363 2.491 . 0 0 "[ . 1 . 2]" 1
295 1 8 LYS HA 1 9 PRO HA 4.149 3.487 4.811 4.396 4.347 4.476 . 0 0 "[ . 1 . 2]" 1
296 1 9 PRO HA 1 9 PRO HD2 3.818 3.248 4.388 4.091 4.077 4.100 . 0 0 "[ . 1 . 2]" 1
297 1 22 ILE HA 1 25 LEU HA 5.132 4.406 5.858 5.664 5.621 5.707 . 0 0 "[ . 1 . 2]" 1
298 1 63 THR HA 1 63 THR HB 2.794 2.378 3.210 3.010 3.005 3.015 . 0 0 "[ . 1 . 2]" 1
299 1 40 ARG HG3 1 63 THR HA 4.161 3.603 4.719 3.841 3.702 4.066 . 0 0 "[ . 1 . 2]" 1
300 1 63 THR HA 1 66 GLU QG 3.995 3.399 4.591 3.164 2.939 3.730 0.460 17 0 "[ . 1 . 2]" 1
301 1 70 TYR QD 1 71 VAL HA 4.629 3.919 5.339 3.717 3.699 3.735 0.220 17 0 "[ . 1 . 2]" 1
302 1 61 PRO HB2 1 61 PRO HG3 3.196 2.848 3.544 2.946 2.926 2.963 . 0 0 "[ . 1 . 2]" 1
303 1 65 ARG HB3 1 65 ARG QD 2.887 2.417 3.357 2.457 2.366 3.060 0.051 10 0 "[ . 1 . 2]" 1
304 1 65 ARG HA 1 65 ARG HB3 2.483 2.130 2.836 2.485 2.408 2.504 . 0 0 "[ . 1 . 2]" 1
305 1 16 ARG HA 1 16 ARG HG3 3.503 2.941 4.065 2.807 2.724 2.901 0.217 2 0 "[ . 1 . 2]" 1
306 1 20 LEU HB2 1 20 LEU MD2 3.223 2.860 3.586 3.179 3.172 3.183 . 0 0 "[ . 1 . 2]" 1
307 1 33 VAL QG 1 67 LEU QD 2.419 2.083 2.755 2.022 1.985 2.063 0.098 13 0 "[ . 1 . 2]" 1
308 1 75 LEU QD 1 75 LEU HG 1.964 . 2.239 1.879 1.876 1.883 . 0 0 "[ . 1 . 2]" 1
309 1 75 LEU HA 1 75 LEU HG 3.208 2.788 3.628 3.106 3.081 3.143 . 0 0 "[ . 1 . 2]" 1
310 1 56 PHE QE 1 64 LEU HG 4.838 4.121 5.555 4.735 4.675 4.770 . 0 0 "[ . 1 . 2]" 1
311 1 77 LYS HA 1 77 LYS HG2 2.604 2.306 2.902 2.539 2.081 2.719 0.225 15 0 "[ . 1 . 2]" 1
312 1 61 PRO HA 1 65 ARG HG3 4.945 4.211 5.679 5.055 4.817 5.219 . 0 0 "[ . 1 . 2]" 1
313 1 12 TYR QD 1 15 LYS QD 6.063 5.199 6.172 4.235 4.200 4.278 0.999 11 20 [**********+**-******] 1
314 1 12 TYR QD 1 15 LYS HA 6.023 5.103 6.943 6.163 6.019 6.299 . 0 0 "[ . 1 . 2]" 1
315 1 56 PHE HA 1 64 LEU QD 3.742 2.985 4.499 2.873 2.785 2.969 0.200 4 0 "[ . 1 . 2]" 1
316 1 26 PRO QD 1 29 LYS HG3 3.738 3.114 4.362 3.010 2.986 3.046 0.128 12 0 "[ . 1 . 2]" 1
317 1 25 LEU QD 1 29 LYS HG3 3.660 3.591 4.269 3.096 2.922 3.177 0.669 3 5 "[*-+ . 1 **. 2]" 1
318 1 35 HIS HA 1 38 GLN HB3 4.014 3.577 4.451 4.455 4.253 4.562 0.111 20 0 "[ . 1 . 2]" 1
319 1 32 ARG QD 1 36 ILE MD 4.411 3.804 5.018 2.698 2.524 3.503 1.280 7 18 "[** -**+*********** *]" 1
320 1 63 THR MG 1 67 LEU QD 2.892 2.425 3.359 2.140 2.101 2.184 0.324 11 0 "[ . 1 . 2]" 1
321 1 44 LEU HA 1 52 ILE MD 5.546 4.636 6.456 5.568 5.390 5.713 . 0 0 "[ . 1 . 2]" 1
322 1 10 MET ME 1 15 LYS QG 4.543 3.887 5.199 4.197 4.145 4.293 . 0 0 "[ . 1 . 2]" 1
323 1 9 PRO HA 1 61 PRO HG3 3.564 3.060 4.068 3.044 3.002 3.104 0.058 6 0 "[ . 1 . 2]" 1
324 1 62 SER HA 1 65 ARG HB3 4.890 4.307 5.473 4.470 4.297 4.625 0.010 14 0 "[ . 1 . 2]" 1
325 1 18 LEU QD 1 22 ILE HG13 2.829 2.372 3.286 2.782 2.530 2.934 . 0 0 "[ . 1 . 2]" 1
326 1 17 GLN HA 1 20 LEU HG 3.822 3.194 4.450 3.231 3.126 3.313 0.068 6 0 "[ . 1 . 2]" 1
327 1 71 VAL QG 1 72 THR HB 4.263 3.564 4.962 3.209 3.124 3.271 0.440 2 0 "[ . 1 . 2]" 1
328 1 16 ARG QD 1 20 LEU MD1 4.930 4.253 5.070 3.718 3.403 3.996 0.850 20 11 "[ * ** ** *-*.** +]" 1
329 1 22 ILE MD 1 67 LEU QB 4.379 3.521 5.237 1.909 1.856 1.962 1.665 9 20 [********+******-****] 1
330 1 40 ARG HA 1 40 ARG QB . 2.568 2.658 2.357 2.349 2.366 0.219 8 0 "[ . 1 . 2]" 1
331 1 41 GLU HB2 1 44 LEU HG 2.459 2.070 2.848 2.362 2.234 2.550 . 0 0 "[ . 1 . 2]" 1
332 1 77 LYS QB 1 77 LYS QE 4.370 3.898 4.842 3.272 2.136 3.792 1.762 3 6 "[-*+ . ** . *2]" 1
333 1 36 ILE MG 1 66 GLU HB3 3.113 2.609 3.617 2.633 2.403 2.778 0.206 14 0 "[ . 1 . 2]" 1
334 1 59 LEU QB 1 64 LEU QD . 4.055 4.111 1.752 1.737 1.771 2.318 8 20 [*******+***-********] 1
335 1 25 LEU HB2 1 30 LEU QD 2.955 2.340 3.570 2.352 2.144 2.699 0.196 9 0 "[ . 1 . 2]" 1
336 1 48 ASN HA 1 49 PRO QD 3.146 2.826 3.466 1.978 1.890 2.266 0.936 6 20 [*****+****-*********] 1
337 1 10 MET QG 1 15 LYS QG . 3.179 3.680 2.324 2.258 2.408 0.921 16 20 [*****-*********+****] 1
338 1 10 MET ME 1 68 GLU HA 4.378 3.823 4.933 3.858 3.719 4.049 0.104 16 0 "[ . 1 . 2]" 1
339 1 17 GLN HG3 1 18 LEU HA 4.345 3.439 5.251 4.112 3.913 4.611 . 0 0 "[ . 1 . 2]" 1
340 1 17 GLN HB3 1 17 GLN HG3 2.702 2.355 3.049 2.445 2.423 2.462 . 0 0 "[ . 1 . 2]" 1
341 1 18 LEU HA 1 18 LEU HG 3.040 2.617 3.463 3.341 3.257 3.483 0.020 9 0 "[ . 1 . 2]" 1
342 1 19 SER HB3 1 56 PHE QE 5.929 5.076 6.782 5.120 4.202 5.441 0.874 9 5 "[* *. +1 . * -2]" 1
343 1 18 LEU HA 1 21 ASP QB 3.786 3.317 4.255 3.019 2.977 3.056 0.340 6 0 "[ . 1 . 2]" 1
344 1 36 ILE QG 1 36 ILE MG 3.397 2.971 3.398 2.182 2.149 2.205 0.822 4 20 [***+*-**************] 1
345 1 44 LEU HA 1 44 LEU QD 4.042 3.561 4.523 3.399 3.384 3.414 0.177 8 0 "[ . 1 . 2]" 1
346 1 25 LEU HA 1 75 LEU QD 3.565 2.868 4.262 3.059 2.990 3.177 . 0 0 "[ . 1 . 2]" 1
347 1 25 LEU HB2 1 25 LEU HG 2.871 2.344 3.398 2.493 2.480 2.510 . 0 0 "[ . 1 . 2]" 1
348 1 25 LEU HA 1 26 PRO HG2 4.025 3.660 4.390 4.396 4.368 4.422 0.032 1 0 "[ . 1 . 2]" 1
349 1 25 LEU HB3 1 26 PRO QD 2.879 2.375 3.383 2.523 2.435 2.582 . 0 0 "[ . 1 . 2]" 1
350 1 26 PRO QD 1 29 LYS HG2 3.261 2.579 3.943 2.691 2.596 2.742 . 0 0 "[ . 1 . 2]" 1
351 1 29 LYS HA 1 70 TYR QE 5.638 4.830 6.446 4.494 4.340 4.553 0.490 14 0 "[ . 1 . 2]" 1
352 1 36 ILE HA 1 39 SER HB3 4.077 3.521 4.633 4.274 4.209 4.338 . 0 0 "[ . 1 . 2]" 1
353 1 39 SER HA 1 39 SER HB2 2.749 2.425 3.073 2.452 2.434 2.466 . 0 0 "[ . 1 . 2]" 1
354 1 39 SER HA 1 39 SER HB3 2.686 2.389 2.983 2.454 2.437 2.475 . 0 0 "[ . 1 . 2]" 1
355 1 36 ILE HA 1 39 SER HB2 5.405 4.709 6.101 4.838 4.787 4.922 . 0 0 "[ . 1 . 2]" 1
356 1 39 SER HB3 1 40 ARG HG3 6.026 5.174 6.878 5.428 5.284 5.537 . 0 0 "[ . 1 . 2]" 1
357 1 38 GLN HB2 1 38 GLN HG2 3.184 2.799 3.569 2.990 2.981 3.003 . 0 0 "[ . 1 . 2]" 1
358 1 38 GLN HB3 1 38 GLN HG2 2.792 2.318 3.266 2.349 2.326 2.428 . 0 0 "[ . 1 . 2]" 1
359 1 63 THR MG 1 66 GLU HB2 4.098 3.378 4.818 3.443 3.272 3.569 0.106 17 0 "[ . 1 . 2]" 1
360 1 42 PRO HB2 1 42 PRO HD3 4.386 3.888 4.884 3.890 3.874 3.907 0.014 4 0 "[ . 1 . 2]" 1
361 1 42 PRO HB2 1 42 PRO HD2 3.142 2.732 3.552 3.192 2.952 4.071 0.519 2 4 "[ + . 1* . * -2]" 1
362 1 44 LEU HA 1 44 LEU HG 3.426 3.001 3.851 3.646 3.629 3.688 . 0 0 "[ . 1 . 2]" 1
363 1 45 LYS HA 1 45 LYS HB3 2.738 2.375 3.101 2.401 2.306 2.521 0.069 17 0 "[ . 1 . 2]" 1
364 1 67 LEU HA 1 67 LEU HG 2.934 2.591 3.277 3.298 3.285 3.314 0.037 14 0 "[ . 1 . 2]" 1
365 1 61 PRO HA 1 61 PRO HG2 4.338 3.800 4.876 3.863 3.836 3.897 . 0 0 "[ . 1 . 2]" 1
366 1 39 SER HA 1 45 LYS QD 4.664 3.648 5.680 5.014 4.032 5.583 . 0 0 "[ . 1 . 2]" 1
367 1 62 SER HA 1 62 SER HB2 2.884 2.513 3.255 2.541 2.490 2.602 0.023 8 0 "[ . 1 . 2]" 1
368 1 65 ARG HA 1 65 ARG HB2 3.088 2.698 3.478 3.017 3.010 3.022 . 0 0 "[ . 1 . 2]" 1
369 1 69 ARG HB2 1 69 ARG HD2 4.388 3.928 4.848 3.877 3.826 3.910 0.102 20 0 "[ . 1 . 2]" 1
370 1 66 GLU HA 1 69 ARG HB3 2.793 2.406 3.180 3.173 2.926 3.289 0.109 13 0 "[ . 1 . 2]" 1
371 1 70 TYR QE 1 71 VAL HA 4.935 4.105 5.765 3.856 3.822 3.907 0.283 2 0 "[ . 1 . 2]" 1
372 1 72 THR HA 1 75 LEU HG 3.451 2.942 3.960 3.602 3.441 3.766 . 0 0 "[ . 1 . 2]" 1
373 1 72 THR HA 1 72 THR HB 2.526 2.230 2.822 2.647 2.517 2.930 0.108 1 0 "[ . 1 . 2]" 1
374 1 69 ARG HA 1 72 THR MG 2.774 2.334 3.214 2.212 1.927 2.934 0.407 9 0 "[ . 1 . 2]" 1
375 1 73 SER HA 1 76 ARG HG3 4.310 3.553 5.067 4.328 4.066 4.482 . 0 0 "[ . 1 . 2]" 1
376 1 72 THR MG 1 73 SER HB3 4.513 3.645 5.381 3.348 3.209 3.624 0.436 9 0 "[ . 1 . 2]" 1
377 1 72 THR MG 1 76 ARG HG3 3.129 2.662 3.596 3.235 2.216 3.581 0.446 13 0 "[ . 1 . 2]" 1
378 1 78 LYS HA 1 78 LYS QD 2.094 . 2.361 2.078 1.865 2.344 . 0 0 "[ . 1 . 2]" 1
379 1 78 LYS HA 1 78 LYS HB3 2.835 2.500 3.170 2.994 2.675 3.030 . 0 0 "[ . 1 . 2]" 1
380 1 9 PRO HA 1 9 PRO HG3 4.007 3.563 4.451 4.006 3.976 4.045 . 0 0 "[ . 1 . 2]" 1
381 1 8 LYS HA 1 9 PRO HG3 4.616 4.172 5.060 4.418 4.364 4.480 . 0 0 "[ . 1 . 2]" 1
382 1 9 PRO HD3 1 9 PRO HG2 3.230 2.880 3.580 2.984 2.973 2.994 . 0 0 "[ . 1 . 2]" 1
383 1 9 PRO HD2 1 9 PRO HG2 2.647 2.237 3.057 2.304 2.293 2.319 . 0 0 "[ . 1 . 2]" 1
384 1 9 PRO HB3 1 9 PRO HG3 2.265 2.002 2.528 2.318 2.312 2.328 . 0 0 "[ . 1 . 2]" 1
385 1 8 LYS QG 1 9 PRO HD3 5.022 4.526 5.518 4.038 3.368 4.739 1.158 20 10 "[ *** - ** .** *+]" 1
386 1 9 PRO HB3 1 9 PRO HD3 3.297 2.824 3.770 3.004 2.973 3.028 . 0 0 "[ . 1 . 2]" 1
387 1 9 PRO HD3 1 9 PRO HG3 2.705 2.310 3.100 2.308 2.296 2.321 0.014 3 0 "[ . 1 . 2]" 1
388 1 9 PRO HD2 1 9 PRO HG3 3.013 2.635 3.391 2.711 2.693 2.728 . 0 0 "[ . 1 . 2]" 1
389 1 8 LYS HA 1 8 LYS HB3 2.789 2.459 3.119 2.749 2.418 3.011 0.041 9 0 "[ . 1 . 2]" 1
390 1 8 LYS HB3 1 9 PRO HD2 3.508 3.195 3.821 3.777 3.396 4.463 0.642 7 1 "[ . + 1 . 2]" 1
391 1 8 LYS HA 1 8 LYS QG 3.372 3.027 3.717 2.962 2.270 3.349 0.757 10 3 "[ . * + . -2]" 1
392 1 8 LYS HE2 1 8 LYS QG 2.379 2.076 2.682 2.506 2.340 2.982 0.300 20 0 "[ . 1 . 2]" 1
393 1 8 LYS HD2 1 9 PRO HD3 4.982 4.477 5.487 5.296 3.632 5.974 0.845 10 3 "[ . -* + . 2]" 1
394 1 7 CYS HA 1 7 CYS HB2 3.157 2.705 3.609 2.745 2.575 3.021 0.130 12 0 "[ . 1 . 2]" 1
395 1 7 CYS HB3 1 62 SER HA 3.969 3.262 4.676 3.630 3.257 3.929 0.005 1 0 "[ . 1 . 2]" 1
396 1 7 CYS HB3 1 62 SER HB3 4.191 3.529 4.853 4.555 4.147 4.890 0.037 8 0 "[ . 1 . 2]" 1
397 1 7 CYS HB3 1 62 SER HB2 4.893 4.122 5.664 5.552 5.076 5.764 0.100 8 0 "[ . 1 . 2]" 1
398 1 7 CYS HB3 1 61 PRO HB3 3.934 3.224 4.644 4.440 3.412 4.673 0.029 3 0 "[ . 1 . 2]" 1
399 1 7 CYS HB3 1 65 ARG HG3 3.524 2.915 4.133 3.127 2.842 3.386 0.073 10 0 "[ . 1 . 2]" 1
400 1 7 CYS HB3 1 65 ARG HG2 3.821 3.292 4.350 4.154 3.970 4.371 0.021 6 0 "[ . 1 . 2]" 1
401 1 6 LYS HB2 1 6 LYS HG3 2.590 2.254 2.926 2.652 2.344 3.022 0.096 11 0 "[ . 1 . 2]" 1
402 1 65 ARG HA 1 68 GLU QB 2.717 2.325 3.109 2.524 2.395 2.640 . 0 0 "[ . 1 . 2]" 1
403 1 54 ILE HB 1 54 ILE MD 2.594 2.205 2.983 2.392 2.353 2.418 . 0 0 "[ . 1 . 2]" 1
404 1 41 GLU HA 1 42 PRO HD3 2.728 2.372 3.084 2.421 2.304 2.792 0.068 15 0 "[ . 1 . 2]" 1
405 1 26 PRO HA 1 26 PRO QD . 4.005 4.640 3.396 3.378 3.409 0.627 10 20 [-********+**********] 1
406 1 42 PRO HA 1 42 PRO HB2 2.703 2.405 3.001 2.912 2.723 2.971 . 0 0 "[ . 1 . 2]" 1
407 1 42 PRO HA 1 42 PRO HB3 2.446 2.154 2.738 2.284 2.269 2.305 . 0 0 "[ . 1 . 2]" 1
408 1 42 PRO HA 1 45 LYS HB2 5.749 5.110 6.388 5.106 5.050 5.342 0.060 20 0 "[ . 1 . 2]" 1
409 1 66 GLU HA 1 69 ARG HG2 5.915 5.044 6.786 5.695 5.377 5.860 . 0 0 "[ . 1 . 2]" 1
410 1 3 GLU HA 1 3 GLU HB3 3.229 2.858 3.600 2.983 2.731 3.042 0.127 13 0 "[ . 1 . 2]" 1
411 1 3 GLU HA 1 3 GLU HB2 3.061 2.644 3.478 2.615 2.487 2.949 0.157 12 0 "[ . 1 . 2]" 1
412 1 60 LYS HA 1 61 PRO HA 4.897 4.070 5.724 4.425 4.407 4.441 . 0 0 "[ . 1 . 2]" 1
413 1 49 PRO QB 1 49 PRO HG3 2.118 . 2.355 2.252 2.187 2.271 . 0 0 "[ . 1 . 2]" 1
414 1 52 ILE HA 1 52 ILE HG12 3.230 2.800 3.660 3.670 3.637 3.695 0.035 14 0 "[ . 1 . 2]" 1
415 1 52 ILE HA 1 52 ILE HG13 2.948 2.490 3.406 3.013 2.952 3.099 . 0 0 "[ . 1 . 2]" 1
416 1 37 ILE MG 1 59 LEU HA 4.822 4.060 5.584 4.370 4.280 4.462 . 0 0 "[ . 1 . 2]" 1
417 1 37 ILE MG 1 38 GLN HG3 3.791 3.063 4.519 3.123 2.957 3.303 0.106 20 0 "[ . 1 . 2]" 1
418 1 37 ILE HB 1 37 ILE MG 2.735 2.228 3.242 2.089 2.084 2.093 0.144 15 0 "[ . 1 . 2]" 1
419 1 37 ILE HA 1 37 ILE HB 2.759 2.348 3.170 2.984 2.975 2.988 . 0 0 "[ . 1 . 2]" 1
420 1 37 ILE HA 1 41 GLU QG 3.142 2.612 3.672 2.864 2.795 2.939 . 0 0 "[ . 1 . 2]" 1
421 1 19 SER HA 1 22 ILE HB 3.274 2.722 3.826 2.656 2.619 2.713 0.103 20 0 "[ . 1 . 2]" 1
422 1 57 GLU HG2 1 58 THR MG 4.782 4.127 5.437 5.120 4.954 5.163 . 0 0 "[ . 1 . 2]" 1
423 1 69 ARG HG3 1 72 THR MG 4.918 4.184 5.652 3.886 3.665 4.297 0.519 20 2 "[ . -1 . +]" 1
424 1 44 LEU QD 1 47 SER QB 4.589 3.963 5.215 3.357 3.216 3.702 0.747 20 18 "[** **********-** **+]" 1
425 1 16 ARG HG2 1 20 LEU MD1 3.129 2.665 3.593 2.843 2.470 3.268 0.195 13 0 "[ . 1 . 2]" 1
426 1 25 LEU QD 1 29 LYS HA 5.369 4.615 5.871 3.970 3.850 4.069 0.765 14 20 [*****-*******+******] 1
427 1 8 LYS HB3 1 8 LYS QG 2.619 2.300 2.938 2.282 2.133 2.419 0.167 7 0 "[ . 1 . 2]" 1
428 1 45 LYS HA 1 45 LYS QG 4.100 3.666 4.534 3.337 3.296 3.357 0.370 20 0 "[ . 1 . 2]" 1
429 1 42 PRO HD3 1 42 PRO HG2 3.081 2.727 3.435 2.751 2.687 2.988 0.040 12 0 "[ . 1 . 2]" 1
430 1 54 ILE MD 1 54 ILE QG 2.295 2.221 2.675 1.876 1.870 1.880 0.351 3 0 "[ . 1 . 2]" 1
431 1 39 SER HB2 1 40 ARG HG3 5.906 5.064 6.748 5.104 5.013 5.263 0.051 8 0 "[ . 1 . 2]" 1
432 1 72 THR HA 1 76 ARG HG3 3.036 2.552 3.520 2.972 2.803 3.263 . 0 0 "[ . 1 . 2]" 1
433 1 47 SER QB 1 52 ILE HG12 4.691 4.018 5.364 4.319 4.234 4.441 . 0 0 "[ . 1 . 2]" 1
434 1 36 ILE MD 1 66 GLU HB3 3.686 2.876 4.496 2.525 2.140 2.719 0.736 14 2 "[ -. 1 +. 2]" 1
435 1 1 SER QB 1 2 GLU QG . 4.265 4.811 4.010 3.084 4.377 1.181 9 3 "[ . +1 -.* 2]" 1
436 1 3 GLU HA 1 3 GLU QG 3.941 3.550 4.332 2.727 2.353 2.999 1.197 15 20 [-*************+*****] 1
437 1 18 LEU HG 1 68 GLU HA 5.055 4.074 6.036 3.993 3.844 4.098 0.230 13 0 "[ . 1 . 2]" 1
438 1 65 ARG HA 1 68 GLU QG 4.809 4.187 5.431 4.297 4.084 4.568 0.103 2 0 "[ . 1 . 2]" 1
439 1 29 LYS HA 1 29 LYS QD . 2.482 2.621 1.870 1.843 1.912 0.639 13 20 [************+******-] 1
440 1 77 LYS QB 1 77 LYS HG2 2.255 . 2.541 2.293 2.247 2.478 . 0 0 "[ . 1 . 2]" 1
441 1 48 ASN HA 1 48 ASN HB3 3.272 2.824 3.720 2.903 2.791 2.937 0.033 5 0 "[ . 1 . 2]" 1
442 1 48 ASN HB2 1 51 GLU QB 4.065 3.840 4.768 3.272 3.166 3.368 0.674 10 17 "[*********+ ***.* **-]" 1
443 1 41 GLU HA 1 60 LYS QE 5.980 4.825 6.001 4.277 3.792 5.033 1.033 17 11 "[* * . -******.*+ 2]" 1
444 1 32 ARG QD 1 32 ARG HG3 2.912 2.464 3.214 2.186 2.154 2.395 0.310 9 0 "[ . 1 . 2]" 1
445 1 32 ARG QD 1 32 ARG HG2 2.897 2.431 3.363 2.309 2.297 2.327 0.134 4 0 "[ . 1 . 2]" 1
446 1 81 PRO HA 1 81 PRO QD 4.549 3.955 5.281 3.461 3.398 3.533 0.557 11 9 "[ ** * 1+ -*** *]" 1
447 1 48 ASN HB2 1 49 PRO QD 5.000 4.320 5.053 4.092 4.003 4.180 0.317 18 0 "[ . 1 . 2]" 1
448 1 65 ARG HA 1 65 ARG HG2 3.228 2.821 3.635 3.137 3.060 3.232 . 0 0 "[ . 1 . 2]" 1
449 1 7 CYS HA 1 65 ARG HG2 5.749 4.964 6.534 6.227 5.734 6.517 . 0 0 "[ . 1 . 2]" 1
450 1 28 GLU HA 1 28 GLU HB2 2.860 2.504 3.216 2.461 2.314 2.488 0.190 3 0 "[ . 1 . 2]" 1
451 1 7 CYS HB2 1 62 SER HA 5.367 4.405 6.329 4.512 4.330 4.857 0.075 3 0 "[ . 1 . 2]" 1
452 1 54 ILE QG 1 54 ILE MG . 2.939 3.081 2.240 2.200 2.280 0.739 15 20 [**-***********+*****] 1
453 1 52 ILE HB 1 52 ILE HG13 3.042 2.573 3.511 3.012 3.007 3.018 . 0 0 "[ . 1 . 2]" 1
454 1 38 GLN HG2 1 52 ILE MD 4.395 3.679 5.111 3.310 3.246 3.430 0.433 13 0 "[ . 1 . 2]" 1
455 1 38 GLN HB2 1 52 ILE MD 4.861 4.200 5.522 4.917 4.862 4.982 . 0 0 "[ . 1 . 2]" 1
456 1 36 ILE MD 1 66 GLU HB2 4.300 3.629 4.971 3.497 3.384 3.626 0.245 17 0 "[ . 1 . 2]" 1
457 1 36 ILE MD 1 63 THR HA 5.430 4.468 6.392 5.073 4.997 5.130 . 0 0 "[ . 1 . 2]" 1
458 1 37 ILE MD 1 67 LEU HA 4.398 3.692 5.104 4.575 4.486 4.647 . 0 0 "[ . 1 . 2]" 1
459 1 37 ILE MD 1 54 ILE MG 2.875 2.283 3.467 1.821 1.786 1.853 0.497 15 0 "[ . 1 . 2]" 1
460 1 18 LEU HA 1 22 ILE MD 4.583 3.683 5.483 4.039 3.824 4.358 . 0 0 "[ . 1 . 2]" 1
461 1 36 ILE MG 1 70 TYR QD 6.221 5.157 7.285 5.512 5.437 5.568 . 0 0 "[ . 1 . 2]" 1
462 1 19 SER HA 1 22 ILE MG 4.518 3.825 5.211 3.829 3.778 3.903 0.047 1 0 "[ . 1 . 2]" 1
463 1 22 ILE MG 1 70 TYR QD 5.523 4.604 6.442 4.587 4.484 5.069 0.120 17 0 "[ . 1 . 2]" 1
464 1 37 ILE MG 1 63 THR HB 5.568 4.457 6.679 4.887 4.836 4.945 . 0 0 "[ . 1 . 2]" 1
465 1 10 MET ME 1 56 PHE QE 6.057 5.094 7.020 3.583 3.463 3.730 1.631 3 20 [**+****************-] 1
466 1 25 LEU QD 1 74 CYS HA 4.693 4.159 5.227 4.497 4.429 4.531 . 0 0 "[ . 1 . 2]" 1
467 1 42 PRO HA 1 45 LYS QG 4.852 4.047 5.657 3.722 2.988 4.317 1.059 4 5 "[ +. 1 - .** *]" 1
468 1 45 LYS HA 1 45 LYS QD 4.617 4.111 5.123 4.314 4.197 4.381 . 0 0 "[ . 1 . 2]" 1
469 1 33 VAL HB 1 67 LEU QD 3.341 2.888 3.963 2.630 2.558 2.695 0.330 13 0 "[ . 1 . 2]" 1
470 1 67 LEU QD 1 70 TYR QE 5.326 4.511 6.141 4.997 4.950 5.053 . 0 0 "[ . 1 . 2]" 1
471 1 24 LYS QG 1 75 LEU QD 5.844 5.043 5.856 3.408 3.247 3.488 1.796 11 20 [*****-****+*********] 1
472 1 37 ILE HA 1 67 LEU QD 3.980 3.422 4.538 3.218 3.166 3.265 0.256 20 0 "[ . 1 . 2]" 1
473 1 29 LYS HG3 1 70 TYR QE 5.909 4.822 6.996 4.553 4.383 4.707 0.439 5 0 "[ . 1 . 2]" 1
474 1 59 LEU HA 1 59 LEU QD 4.012 3.485 4.539 2.129 2.111 2.153 1.374 13 20 [************+*-*****] 1
475 1 41 GLU QG 1 44 LEU HB3 5.614 4.667 6.561 5.473 5.365 5.557 . 0 0 "[ . 1 . 2]" 1
476 1 41 GLU QG 1 44 LEU HB2 5.931 4.992 6.870 6.028 5.884 6.205 . 0 0 "[ . 1 . 2]" 1
477 1 41 GLU HB2 1 44 LEU HB2 5.083 4.356 5.810 5.074 4.942 5.263 . 0 0 "[ . 1 . 2]" 1
478 1 41 GLU HB2 1 44 LEU HB3 4.607 3.898 5.316 4.559 4.480 4.622 . 0 0 "[ . 1 . 2]" 1
479 1 35 HIS HA 1 38 GLN HG3 4.618 3.911 5.325 4.662 4.482 4.927 . 0 0 "[ . 1 . 2]" 1
480 1 34 VAL HA 1 38 GLN HG3 4.639 3.514 5.764 3.547 3.440 3.690 0.074 20 0 "[ . 1 . 2]" 1
481 1 38 GLN HG3 1 44 LEU HB3 5.926 5.062 6.790 6.233 6.089 6.351 . 0 0 "[ . 1 . 2]" 1
482 1 40 ARG HA 1 41 GLU HA 5.126 4.152 6.100 4.576 4.553 4.609 . 0 0 "[ . 1 . 2]" 1
483 1 45 LYS HB2 1 46 ASN HA 4.418 3.638 5.198 4.821 4.632 4.954 . 0 0 "[ . 1 . 2]" 1
484 1 40 ARG HG2 1 41 GLU HA 6.169 5.131 7.207 6.523 6.497 6.573 . 0 0 "[ . 1 . 2]" 1
485 1 45 LYS HA 1 46 ASN HA 5.663 4.509 6.817 4.676 4.627 4.733 . 0 0 "[ . 1 . 2]" 1
486 1 62 SER HA 1 65 ARG HG2 4.101 3.375 4.827 3.781 3.424 3.917 . 0 0 "[ . 1 . 2]" 1
487 1 7 CYS HA 1 65 ARG HB2 7.160 5.860 8.460 6.139 5.758 6.568 0.102 20 0 "[ . 1 . 2]" 1
488 1 7 CYS HA 1 61 PRO HB3 5.973 4.754 7.192 6.458 5.582 6.789 . 0 0 "[ . 1 . 2]" 1
489 1 7 CYS HA 1 65 ARG HB3 5.485 4.678 6.292 5.997 5.577 6.315 0.023 18 0 "[ . 1 . 2]" 1
490 1 7 CYS HA 1 65 ARG HG3 5.427 4.463 6.391 4.696 4.349 4.981 0.114 6 0 "[ . 1 . 2]" 1
491 1 6 LYS HG2 1 7 CYS HA 5.583 4.192 6.974 5.335 4.334 6.676 . 0 0 "[ . 1 . 2]" 1
492 1 7 CYS HB3 1 65 ARG HB2 4.035 3.404 4.666 3.970 3.492 4.413 . 0 0 "[ . 1 . 2]" 1
493 1 7 CYS HB3 1 61 PRO HG3 5.758 4.724 6.792 6.536 5.474 6.820 0.028 1 0 "[ . 1 . 2]" 1
494 1 61 PRO HD3 1 64 LEU QD 3.904 3.138 4.670 3.126 2.987 3.215 0.151 15 0 "[ . 1 . 2]" 1
495 1 25 LEU HG 1 26 PRO QD 6.191 5.267 6.489 4.602 4.557 4.637 0.710 13 20 [************+**-****] 1
496 1 25 LEU HG 1 71 VAL QG 4.006 3.197 4.815 2.854 2.784 2.922 0.413 20 0 "[ . 1 . 2]" 1
497 1 25 LEU HG 1 30 LEU QD 4.317 3.703 4.931 3.903 3.678 3.973 0.025 7 0 "[ . 1 . 2]" 1
498 1 25 LEU HG 1 75 LEU QD 3.691 3.014 4.368 3.134 3.036 3.228 . 0 0 "[ . 1 . 2]" 1
499 1 36 ILE MD 1 67 LEU HG 4.449 3.700 5.198 4.257 4.185 4.293 . 0 0 "[ . 1 . 2]" 1
500 1 49 PRO HA 1 49 PRO HG3 3.447 2.992 3.902 3.011 2.901 3.875 0.091 5 0 "[ . 1 . 2]" 1
501 1 74 CYS QB 1 75 LEU HG 3.556 2.932 4.180 2.806 2.774 2.841 0.158 16 0 "[ . 1 . 2]" 1
502 1 25 LEU QD 1 26 PRO QD . 5.059 5.200 2.955 2.915 3.002 2.144 13 20 [************+****-**] 1
503 1 71 VAL QG 1 74 CYS QB . 5.829 6.585 3.768 3.707 3.896 2.122 7 20 [******+*****-*******] 1
504 1 40 ARG HG2 1 63 THR HA 5.444 4.823 6.065 4.860 4.767 4.948 0.056 20 0 "[ . 1 . 2]" 1
505 1 40 ARG HG3 1 63 THR MG 3.533 2.823 4.243 2.577 2.458 2.646 0.365 14 0 "[ . 1 . 2]" 1
506 1 36 ILE MG 1 40 ARG HG3 2.967 2.355 3.579 2.102 2.048 2.144 0.307 14 0 "[ . 1 . 2]" 1
507 1 36 ILE MG 1 40 ARG HG2 4.511 3.866 5.156 3.403 3.370 3.427 0.496 17 0 "[ . 1 . 2]" 1
508 1 37 ILE MG 1 40 ARG HG2 6.019 5.057 6.981 6.408 6.307 6.452 . 0 0 "[ . 1 . 2]" 1
509 1 25 LEU QD 1 29 LYS QD 5.369 5.202 6.069 3.904 3.792 3.972 1.410 1 20 [+*********-*********] 1
510 1 52 ILE HG13 1 54 ILE MD 4.008 3.410 4.606 3.277 3.165 3.395 0.245 19 0 "[ . 1 . 2]" 1
511 1 12 TYR HA 1 15 LYS QG 4.106 3.397 4.815 3.403 3.324 3.474 0.073 5 0 "[ . 1 . 2]" 1
512 1 12 TYR QD 1 15 LYS QG 7.339 6.220 8.458 4.965 4.908 5.040 1.312 9 20 [********+*********-*] 1
513 1 26 PRO HG3 1 29 LYS QE 7.699 6.278 8.260 6.100 5.950 6.222 0.328 12 0 "[ . 1 . 2]" 1
514 1 26 PRO HG2 1 29 LYS HG2 3.135 2.465 3.805 2.948 2.802 3.038 . 0 0 "[ . 1 . 2]" 1
515 1 26 PRO HG3 1 29 LYS HG3 6.141 5.405 6.877 5.513 5.411 5.585 . 0 0 "[ . 1 . 2]" 1
516 1 40 ARG QD 1 66 GLU HB3 5.454 4.647 6.261 4.027 3.753 4.538 0.894 17 16 "[** *******- **+***]" 1
517 1 32 ARG QB 1 70 TYR QD 6.697 5.691 7.703 4.149 4.102 4.192 1.589 3 20 [**+*********-*******] 1
518 1 8 LYS HD2 1 9 PRO HD2 3.374 2.935 3.813 3.669 2.081 4.275 0.854 7 3 "[ . +- * . 2]" 1
519 1 60 LYS HD2 1 61 PRO HD2 5.592 4.799 6.385 5.622 4.788 5.960 0.011 15 0 "[ . 1 . 2]" 1
520 1 60 LYS HD3 1 61 PRO HD2 4.943 4.190 5.696 4.591 4.395 4.898 . 0 0 "[ . 1 . 2]" 1
521 1 32 ARG QD 1 36 ILE QG 5.553 4.598 6.508 3.171 2.896 3.641 1.702 20 20 [**-****************+] 1
522 1 4 GLU QB 1 5 ASP HA . 4.264 4.737 4.170 3.824 4.472 0.440 3 0 "[ . 1 . 2]" 1
523 1 65 ARG QD 1 68 GLU QB 4.804 4.300 5.652 3.306 3.165 3.709 1.135 8 20 [*******+***********-] 1
524 1 72 THR HA 1 76 ARG QB 4.353 3.771 4.935 4.455 4.266 4.672 . 0 0 "[ . 1 . 2]" 1
525 1 1 SER QB 1 2 GLU QB . 5.510 5.873 4.992 4.206 5.117 1.304 9 6 "[* . * +1 *-. *2]" 1
526 1 10 MET ME 1 68 GLU QB 2.720 2.134 3.306 1.985 1.828 2.200 0.306 14 0 "[ . 1 . 2]" 1
527 1 21 ASP QB 1 71 VAL HB 3.073 2.411 3.735 3.137 2.928 3.233 . 0 0 "[ . 1 . 2]" 1
528 1 70 TYR QD 1 71 VAL HB 5.530 4.667 6.393 4.812 4.768 4.920 . 0 0 "[ . 1 . 2]" 1
529 1 48 ASN HA 1 49 PRO QB 6.422 5.543 7.301 4.765 4.730 4.897 0.813 17 20 [**********-*****+***] 1
530 1 9 PRO HB2 1 61 PRO HA 6.010 5.052 6.968 5.330 5.037 5.734 0.015 14 0 "[ . 1 . 2]" 1
531 1 36 ILE MG 1 40 ARG QB . 5.145 5.567 3.280 3.218 3.361 1.927 4 20 [***+**********-*****] 1
532 1 40 ARG QB 1 59 LEU QD 6.862 5.661 8.063 4.219 4.163 4.284 1.498 14 20 [**-**********+******] 1
533 1 25 LEU HA 1 26 PRO QB 5.380 4.703 6.057 4.719 4.695 4.740 0.008 18 0 "[ . 1 . 2]" 1
534 1 26 PRO QB 1 29 LYS HG3 . 6.125 6.689 4.834 4.792 4.906 1.333 10 20 [*********+*****-****] 1
535 1 26 PRO QB 1 29 LYS HG2 . 4.234 4.532 3.397 3.314 3.502 0.920 10 20 [*********+*****-****] 1
536 1 17 GLN HG3 1 20 LEU MD1 4.669 3.978 5.360 4.291 4.054 4.424 . 0 0 "[ . 1 . 2]" 1
537 1 37 ILE HA 1 40 ARG QB 5.271 4.413 6.129 2.815 2.764 2.874 1.649 13 20 [************+***-***] 1
538 1 10 MET QB 1 15 LYS QG 3.536 2.880 4.192 2.485 2.336 2.626 0.544 8 3 "[ .- + 1 * . 2]" 1
539 1 10 MET QB 1 64 LEU QB 3.449 2.870 4.028 2.359 2.277 2.417 0.593 12 12 "[***** *-*+ *** 2]" 1
540 1 10 MET QB 1 61 PRO HA 5.214 4.196 6.232 3.785 3.704 3.890 0.492 3 0 "[ . 1 . 2]" 1
541 1 68 GLU QG 1 69 ARG HA 5.392 4.435 5.926 3.900 3.346 4.287 1.089 16 7 "[ . - 1 * *.+** *]" 1
542 1 28 GLU QG 1 29 LYS HG2 4.714 4.213 5.509 4.293 3.704 4.532 0.509 3 1 "[ + . 1 . 2]" 1
543 1 28 GLU QG 1 29 LYS HG3 6.048 5.265 6.847 5.385 4.901 5.605 0.364 3 0 "[ . 1 . 2]" 1
544 1 50 ASP QB 1 51 GLU QG 4.705 4.457 5.372 3.634 2.926 4.667 1.531 6 14 "[** *.+*-******. ** 2]" 1
545 1 24 LYS HA 1 75 LEU QD 4.856 4.242 5.470 4.248 4.204 4.322 0.038 1 0 "[ . 1 . 2]" 1
546 1 22 ILE HB 1 56 PHE HZ 5.091 4.112 6.070 6.017 5.921 6.101 0.031 14 0 "[ . 1 . 2]" 1
547 1 22 ILE HB 2 11 TYR QD 7.063 5.626 8.500 7.467 7.222 7.730 . 0 0 "[ . 1 . 2]" 1
548 1 22 ILE HB 1 22 ILE HG12 2.936 2.532 3.340 3.015 3.011 3.019 . 0 0 "[ . 1 . 2]" 1
549 1 22 ILE HB 1 71 VAL QG 5.136 4.315 5.957 3.685 3.577 3.748 0.738 2 20 [*+***********-******] 1
550 1 67 LEU QD 1 70 TYR QB . 4.386 5.169 3.995 3.941 4.069 0.445 20 0 "[ . 1 . 2]" 1
551 1 20 LEU MD2 1 23 ASN HB3 3.570 3.058 4.082 3.890 3.828 3.962 . 0 0 "[ . 1 . 2]" 1
552 1 48 ASN HB2 1 52 ILE MG 7.415 6.009 8.821 7.132 7.066 7.235 . 0 0 "[ . 1 . 2]" 1
553 1 20 LEU HB2 1 23 ASN HB3 5.345 4.530 6.160 5.943 5.868 6.004 . 0 0 "[ . 1 . 2]" 1
554 1 48 ASN HB3 1 49 PRO QD 4.151 3.532 4.840 3.345 3.112 3.567 0.420 5 0 "[ . 1 . 2]" 1
555 1 52 ILE HB 1 54 ILE MD 5.406 4.530 6.282 4.699 4.547 4.811 . 0 0 "[ . 1 . 2]" 1
556 1 5 ASP QB 1 6 LYS HB2 5.750 4.653 5.822 4.613 4.122 5.117 0.531 17 1 "[ . 1 . + 2]" 1
557 1 5 ASP QB 1 6 LYS HD2 6.317 5.203 7.431 6.828 5.661 7.790 0.359 8 0 "[ . 1 . 2]" 1
558 1 25 LEU HB2 1 30 LEU HA 4.887 3.916 5.858 3.891 3.851 3.927 0.065 8 0 "[ . 1 . 2]" 1
559 1 25 LEU HB3 1 30 LEU HA 4.963 4.054 5.872 4.635 4.576 4.696 . 0 0 "[ . 1 . 2]" 1
560 1 22 ILE HA 1 25 LEU HB2 4.355 3.555 5.155 4.220 4.101 4.285 . 0 0 "[ . 1 . 2]" 1
561 1 8 LYS HA 1 8 LYS HE2 6.091 5.403 6.779 5.635 4.648 6.216 0.755 19 4 "[ ** 1 . +-]" 1
562 1 15 LYS HA 1 15 LYS QE 5.618 4.751 6.485 4.341 4.305 4.374 0.446 14 0 "[ . 1 . 2]" 1
563 1 12 TYR QD 1 15 LYS QE 6.788 5.631 7.799 6.232 6.189 6.266 . 0 0 "[ . 1 . 2]" 1
564 1 13 GLU HA 1 16 ARG QD 5.456 4.723 6.189 3.734 3.153 4.404 1.570 7 19 [******+*-**********2] 1
565 1 27 GLY QA 1 30 LEU HG . 5.345 5.439 4.759 4.275 4.977 1.070 7 14 "[* ***+* -** *.****2]" 1
566 1 61 PRO HA 1 61 PRO HD3 3.828 3.165 4.491 3.161 3.134 3.179 0.031 15 0 "[ . 1 . 2]" 1
567 1 80 LYS QB 1 81 PRO QD 4.032 3.533 4.531 3.366 2.328 3.765 1.205 14 4 "[ .* 1 -+. * 2]" 1
568 1 48 ASN HA 1 49 PRO HA 5.184 4.252 6.116 4.417 4.351 4.479 . 0 0 "[ . 1 . 2]" 1
569 1 59 LEU HA 1 63 THR MG 4.679 4.023 5.335 4.327 4.227 4.403 . 0 0 "[ . 1 . 2]" 1
570 1 59 LEU HA 1 60 LYS HG3 6.299 5.324 7.274 5.588 5.475 5.717 . 0 0 "[ . 1 . 2]" 1
571 1 74 CYS QB 1 75 LEU HA 4.899 4.827 5.774 4.114 4.066 4.165 0.761 13 20 [************+**-****] 1
572 1 72 THR MG 1 76 ARG HA 6.572 5.591 7.553 5.932 5.043 6.258 0.548 13 1 "[ . 1 + . 2]" 1
573 1 2 GLU HA 1 5 ASP QB . 4.303 4.574 3.619 3.062 4.439 1.241 6 11 "[*- **+* 1 **** *]" 1
574 1 49 PRO HA 1 52 ILE HG13 5.751 4.829 6.673 4.875 4.800 4.991 0.029 5 0 "[ . 1 . 2]" 1
575 1 49 PRO HA 1 49 PRO QD 4.603 3.838 5.056 3.381 3.207 3.424 0.631 11 1 "[ . 1+ . 2]" 1
576 1 63 THR MG 1 64 LEU HA 4.569 3.726 5.412 3.970 3.927 4.035 . 0 0 "[ . 1 . 2]" 1
577 1 64 LEU HA 1 67 LEU QD 4.433 3.785 5.081 2.113 2.069 2.179 1.716 10 20 [*********+*********-] 1
578 1 43 SER HB2 1 44 LEU QD 4.731 3.812 5.650 4.109 3.572 5.075 0.240 20 0 "[ . 1 . 2]" 1
579 1 46 ASN QB 1 47 SER HA 5.107 4.399 6.043 4.215 3.976 4.688 0.423 13 0 "[ . 1 . 2]" 1
580 1 38 GLN HA 1 45 LYS HB3 4.950 4.053 5.847 4.188 3.988 4.373 0.065 20 0 "[ . 1 . 2]" 1
581 1 38 GLN HA 1 44 LEU HB3 4.578 4.002 5.154 5.369 5.317 5.414 0.260 2 0 "[ . 1 . 2]" 1
582 1 35 HIS HA 1 38 GLN HG2 5.165 4.459 5.871 5.561 5.363 5.887 0.016 20 0 "[ . 1 . 2]" 1
583 1 35 HIS HA 1 38 GLN HB2 3.330 2.779 3.881 2.902 2.745 3.082 0.034 19 0 "[ . 1 . 2]" 1
584 1 36 ILE MD 1 66 GLU HA 5.668 4.561 6.775 4.362 4.198 4.475 0.363 14 0 "[ . 1 . 2]" 1
585 1 66 GLU HA 1 69 ARG HD2 5.814 4.955 6.673 5.887 5.621 6.035 . 0 0 "[ . 1 . 2]" 1
586 1 15 LYS HA 1 18 LEU HA 6.066 5.095 7.037 5.148 5.102 5.194 . 0 0 "[ . 1 . 2]" 1
587 1 73 SER HA 1 76 ARG QD 5.070 3.959 6.181 4.087 3.816 4.452 0.143 10 0 "[ . 1 . 2]" 1
588 1 7 CYS HB2 1 62 SER HB3 5.938 4.775 7.101 4.896 4.626 5.390 0.149 7 0 "[ . 1 . 2]" 1
589 1 70 TYR HA 1 71 VAL HA 5.021 4.041 6.001 4.680 4.652 4.722 . 0 0 "[ . 1 . 2]" 1
590 1 71 VAL HA 1 74 CYS HA 5.911 5.030 6.792 5.183 5.103 5.340 . 0 0 "[ . 1 . 2]" 1
591 1 29 LYS QE 1 74 CYS HA 5.963 4.882 7.044 5.973 5.667 6.169 . 0 0 "[ . 1 . 2]" 1
592 1 69 ARG HG3 1 73 SER HB3 6.033 4.926 7.140 5.167 4.932 5.473 . 0 0 "[ . 1 . 2]" 1
593 1 70 TYR QE 1 73 SER HB3 5.684 4.541 6.827 6.114 5.969 6.240 . 0 0 "[ . 1 . 2]" 1
594 1 9 PRO HA 1 9 PRO HD3 3.995 3.314 4.676 3.562 3.444 3.677 . 0 0 "[ . 1 . 2]" 1
595 1 39 SER HB3 1 40 ARG QD 7.110 6.054 8.166 6.551 6.446 6.754 . 0 0 "[ . 1 . 2]" 1
596 1 39 SER HB2 1 40 ARG QD 6.491 5.540 7.442 5.947 5.776 6.082 . 0 0 "[ . 1 . 2]" 1
597 1 39 SER HB3 1 40 ARG HG2 5.733 4.893 6.573 5.116 4.918 5.359 . 0 0 "[ . 1 . 2]" 1
598 1 22 ILE HA 1 25 LEU HB3 5.293 4.399 6.187 5.103 5.008 5.165 . 0 0 "[ . 1 . 2]" 1
599 1 36 ILE HA 1 39 SER HA 6.597 5.570 7.624 5.925 5.872 6.015 . 0 0 "[ . 1 . 2]" 1
600 1 36 ILE HA 1 40 ARG QD 5.130 4.325 5.935 4.381 4.213 4.970 0.112 17 0 "[ . 1 . 2]" 1
601 1 71 VAL HA 1 72 THR HA 5.189 4.180 6.198 4.727 4.671 4.818 . 0 0 "[ . 1 . 2]" 1
602 1 71 VAL HB 1 72 THR HA 4.951 3.890 6.012 4.459 4.376 4.573 . 0 0 "[ . 1 . 2]" 1
603 1 72 THR HA 1 77 LYS QB 6.388 5.191 7.585 7.175 6.839 7.391 . 0 0 "[ . 1 . 2]" 1
604 1 33 VAL HA 1 36 ILE QG 3.912 3.207 4.617 3.222 3.155 3.339 0.052 15 0 "[ . 1 . 2]" 1
605 1 33 VAL HA 1 67 LEU HA 4.194 3.384 5.004 3.953 3.850 4.039 . 0 0 "[ . 1 . 2]" 1
606 1 63 THR HB 1 67 LEU QD 4.409 3.860 5.312 3.265 3.202 3.318 0.658 6 20 [*****+*******-******] 1
607 1 55 ASP HA 1 57 GLU HA 5.524 4.759 6.289 6.292 6.088 6.387 0.098 3 0 "[ . 1 . 2]" 1
608 1 44 LEU QD 1 54 ILE HA 3.274 2.758 3.790 3.017 2.743 3.127 0.015 20 0 "[ . 1 . 2]" 1
609 1 54 ILE HA 1 54 ILE QG 2.787 2.460 3.219 2.463 2.413 2.511 0.047 15 0 "[ . 1 . 2]" 1
610 1 54 ILE HA 1 54 ILE HB 3.163 2.675 3.651 3.030 3.023 3.035 . 0 0 "[ . 1 . 2]" 1
611 1 54 ILE HB 1 54 ILE MG 2.718 2.244 3.192 2.137 2.131 2.141 0.113 9 0 "[ . 1 . 2]" 1
612 1 54 ILE HB 1 54 ILE QG 3.015 2.576 3.454 2.418 2.395 2.440 0.181 3 0 "[ . 1 . 2]" 1
613 1 54 ILE MD 1 54 ILE MG 3.095 2.514 3.676 1.989 1.898 2.073 0.616 3 16 "[**+-* *******.****2]" 1
614 1 22 ILE MD 1 54 ILE MG 5.173 3.969 6.377 4.350 4.218 4.444 . 0 0 "[ . 1 . 2]" 1
615 1 54 ILE HA 1 54 ILE MG 3.732 3.049 4.415 2.409 2.345 2.450 0.704 3 20 [**+***********-*****] 1
616 1 54 ILE MG 1 56 PHE HZ 5.249 4.051 6.447 5.881 5.799 5.936 . 0 0 "[ . 1 . 2]" 1
617 1 52 ILE HA 1 52 ILE HB 2.899 2.407 3.391 2.526 2.483 2.543 . 0 0 "[ . 1 . 2]" 1
618 1 48 ASN HB3 1 52 ILE HB 5.470 4.519 6.421 5.758 5.479 6.055 . 0 0 "[ . 1 . 2]" 1
619 1 52 ILE HA 1 52 ILE MG 3.503 2.959 4.047 3.163 3.149 3.172 . 0 0 "[ . 1 . 2]" 1
620 1 52 ILE HB 1 52 ILE HG12 2.269 . 2.632 2.440 2.409 2.459 . 0 0 "[ . 1 . 2]" 1
621 1 44 LEU HB3 1 52 ILE MD 5.194 4.430 5.958 5.323 5.197 5.425 . 0 0 "[ . 1 . 2]" 1
622 1 9 PRO HA 1 64 LEU QB 6.018 4.921 7.115 5.030 4.817 5.207 0.104 16 0 "[ . 1 . 2]" 1
623 1 9 PRO HB3 1 9 PRO HD2 4.277 3.736 4.818 3.890 3.861 3.909 . 0 0 "[ . 1 . 2]" 1
624 1 10 MET HA 1 15 LYS QE 6.349 5.461 7.587 4.906 4.788 5.067 0.673 13 15 "[ ***.*-*****+ .* ***]" 1
625 1 10 MET HA 1 14 GLU QB 4.522 3.874 5.170 3.378 3.210 3.711 0.664 1 11 "[+*-*. * ** **** 2]" 1
626 1 10 MET HA 1 15 LYS QG . 4.740 5.129 4.297 4.182 4.421 0.558 8 4 "[ .- + 1 * . * 2]" 1
627 1 10 MET ME 1 15 LYS HA 4.289 3.670 4.908 4.024 3.746 4.161 . 0 0 "[ . 1 . 2]" 1
628 1 18 LEU HA 1 68 GLU HA 5.164 4.273 6.055 4.522 4.422 4.658 . 0 0 "[ . 1 . 2]" 1
629 1 12 TYR HE1 1 13 GLU QG 5.721 4.752 6.622 5.547 5.227 5.799 . 0 0 "[ . 1 . 2]" 1
630 1 57 GLU HG3 2 2 TRP HE3 7.090 5.975 8.205 7.773 7.592 7.947 . 0 0 "[ . 1 . 2]" 1
631 1 12 TYR QD 1 13 GLU HA 4.395 3.816 4.974 3.961 3.838 4.111 . 0 0 "[ . 1 . 2]" 1
632 1 12 TYR HE1 1 13 GLU HA 5.224 4.393 6.055 4.965 4.742 5.153 . 0 0 "[ . 1 . 2]" 1
633 1 14 GLU HA 1 17 GLN HG3 4.755 4.206 5.304 5.204 5.022 5.314 0.010 8 0 "[ . 1 . 2]" 1
634 1 10 MET QB 1 14 GLU QB 5.656 4.899 6.413 3.873 3.699 4.237 1.200 1 20 [+****-**************] 1
635 1 10 MET ME 1 14 GLU QB 5.394 4.526 6.262 3.393 2.792 4.450 1.734 10 15 "[***** * *+* **-* **]" 1
636 1 10 MET ME 1 14 GLU QG 5.973 4.970 6.976 4.135 2.751 4.745 2.219 8 10 "[ * .* +-* ** . ***]" 1
637 1 15 LYS HA 1 64 LEU QB 3.861 3.243 4.479 4.440 4.373 4.500 0.021 16 0 "[ . 1 . 2]" 1
638 1 78 LYS HB3 1 78 LYS HG3 2.606 2.272 2.940 2.489 2.427 2.562 . 0 0 "[ . 1 . 2]" 1
639 1 15 LYS QB 1 64 LEU QD 7.012 5.828 7.360 3.800 3.742 3.849 2.086 13 20 [************+**-****] 1
640 1 16 ARG HG2 1 17 GLN HA 4.099 3.279 4.919 3.375 3.173 3.907 0.106 13 0 "[ . 1 . 2]" 1
641 1 17 GLN HA 1 20 LEU HA 6.060 5.193 6.927 5.163 5.105 5.201 0.088 13 0 "[ . 1 . 2]" 1
642 1 18 LEU QB 1 19 SER HA 5.874 4.867 6.881 3.695 3.625 3.837 1.242 16 20 [**-************+****] 1
643 1 34 VAL HA 1 34 VAL QG . 3.118 3.615 2.311 2.003 2.353 1.115 14 20 [*************+*****-] 1
644 1 16 ARG HG2 1 20 LEU HG 4.205 3.547 4.863 3.994 3.545 4.565 0.002 13 0 "[ . 1 . 2]" 1
645 1 22 ILE HG13 1 56 PHE HZ 4.757 3.752 5.762 5.139 5.039 5.223 . 0 0 "[ . 1 . 2]" 1
646 1 22 ILE HG12 1 56 PHE HZ 5.412 4.325 6.499 5.848 5.704 6.055 . 0 0 "[ . 1 . 2]" 1
647 1 22 ILE MD 1 67 LEU HA 5.328 4.464 6.192 3.917 3.865 4.013 0.599 20 18 "[ *********** **-***+]" 1
648 1 22 ILE MG 2 2 TRP HH2 3.680 3.055 4.305 2.496 2.160 2.917 0.895 8 14 "[ * -**+**** *****2]" 1
649 1 25 LEU HA 1 26 PRO HA 5.206 4.245 6.167 4.490 4.476 4.509 . 0 0 "[ . 1 . 2]" 1
650 1 27 GLY QA 1 28 GLU HA 4.747 3.964 5.530 4.064 3.962 4.091 0.002 3 0 "[ . 1 . 2]" 1
651 1 38 GLN HB3 1 45 LYS HA 3.519 2.974 4.064 3.206 2.889 3.697 0.085 19 0 "[ . 1 . 2]" 1
652 1 25 LEU HB3 1 29 LYS QD 5.801 5.021 6.581 4.541 4.514 4.594 0.507 3 2 "[ + . 1 . - 2]" 1
653 1 26 PRO QD 1 29 LYS QE 6.142 5.335 6.949 4.763 4.679 4.824 0.656 10 20 [*****-***+**********] 1
654 1 33 VAL HB 1 37 ILE MD 3.062 2.405 3.719 2.286 2.220 2.414 0.185 15 0 "[ . 1 . 2]" 1
655 1 33 VAL HB 1 54 ILE MD 4.201 3.103 5.299 3.154 3.051 3.331 0.052 9 0 "[ . 1 . 2]" 1
656 1 30 LEU QB 1 33 VAL HB . 5.380 6.248 5.215 5.168 5.269 0.212 18 0 "[ . 1 . 2]" 1
657 1 25 LEU QD 1 30 LEU QB . 5.773 6.375 3.978 3.928 4.017 1.845 14 20 [*-***********+******] 1
658 1 32 ARG HA 1 70 TYR QE 6.604 5.736 7.472 5.336 5.286 5.375 0.450 20 0 "[ . 1 . 2]" 1
659 1 32 ARG HA 1 35 HIS HA 5.692 4.997 6.387 5.259 4.897 5.308 0.100 20 0 "[ . 1 . 2]" 1
660 1 32 ARG QB 1 35 HIS HB3 5.628 4.750 6.506 4.381 4.217 4.415 0.533 20 1 "[ . 1 . +]" 1
661 1 32 ARG HG3 1 33 VAL HA 4.283 3.310 5.256 3.246 3.183 3.289 0.127 9 0 "[ . 1 . 2]" 1
662 1 32 ARG HG3 1 35 HIS HB3 4.027 3.328 4.726 4.010 3.558 4.096 . 0 0 "[ . 1 . 2]" 1
663 1 32 ARG HG2 1 35 HIS HB3 5.952 5.064 6.840 5.601 5.162 5.679 . 0 0 "[ . 1 . 2]" 1
664 1 32 ARG HG3 1 35 HIS HD2 4.866 3.946 5.786 4.710 4.490 4.839 . 0 0 "[ . 1 . 2]" 1
665 1 32 ARG HG2 1 35 HIS HD2 6.483 5.444 7.522 6.256 6.067 6.383 . 0 0 "[ . 1 . 2]" 1
666 1 32 ARG QD 1 35 HIS HD2 . 4.563 5.039 3.841 3.391 4.211 1.172 20 19 "[** *******-********+]" 1
667 1 34 VAL HA 1 35 HIS HA 5.626 4.422 6.830 4.786 4.766 4.866 . 0 0 "[ . 1 . 2]" 1
668 1 34 VAL HA 1 54 ILE MD 3.495 2.802 4.188 2.175 2.058 2.291 0.744 20 20 [*******-***********+] 1
669 1 34 VAL QG 1 38 GLN HG3 4.423 3.659 5.187 3.922 2.203 4.059 1.456 14 1 "[ . 1 +. 2]" 1
670 1 34 VAL QG 1 49 PRO QD 6.702 5.598 7.806 4.281 3.920 4.444 1.678 11 20 [*****-****+*********] 1
671 1 34 VAL QG 1 38 GLN HG2 5.412 4.529 6.295 4.855 3.326 5.119 1.203 14 1 "[ . 1 +. 2]" 1
672 1 35 HIS HB3 1 36 ILE HA 5.645 4.523 6.767 4.464 4.017 4.514 0.506 20 1 "[ . 1 . +]" 1
673 1 32 ARG HA 1 36 ILE MD 5.343 4.566 6.120 4.680 4.622 4.800 . 0 0 "[ . 1 . 2]" 1
674 1 35 HIS HD2 1 36 ILE MD 5.023 4.317 5.729 4.628 4.509 4.696 . 0 0 "[ . 1 . 2]" 1
675 1 35 HIS HD2 1 36 ILE MG 6.413 5.218 7.608 4.948 4.900 5.065 0.318 12 0 "[ . 1 . 2]" 1
676 1 36 ILE MG 1 66 GLU HA 5.101 4.395 5.807 4.677 4.574 4.762 . 0 0 "[ . 1 . 2]" 1
677 1 36 ILE MG 1 67 LEU QB 4.435 3.706 5.164 4.396 4.363 4.430 . 0 0 "[ . 1 . 2]" 1
678 1 37 ILE HA 1 59 LEU QD 4.421 3.769 5.073 3.108 3.049 3.157 0.720 14 20 [*************+-*****] 1
679 1 37 ILE HB 1 59 LEU QD 4.319 3.689 4.949 3.651 3.616 3.693 0.073 8 0 "[ . 1 . 2]" 1
680 1 37 ILE MD 1 56 PHE QE 4.413 3.764 5.062 3.415 3.308 3.525 0.456 13 0 "[ . 1 . 2]" 1
681 1 37 ILE MD 1 67 LEU QB 4.147 3.181 5.113 3.464 3.405 3.521 . 0 0 "[ . 1 . 2]" 1
682 1 37 ILE MG 1 44 LEU HG 3.541 2.932 4.150 3.339 2.993 3.442 . 0 0 "[ . 1 . 2]" 1
683 1 37 ILE MG 1 44 LEU HB2 4.596 3.774 5.418 4.198 4.107 4.278 . 0 0 "[ . 1 . 2]" 1
684 1 38 GLN HA 1 45 LYS HA 4.532 3.784 5.280 4.046 3.748 4.389 0.036 19 0 "[ . 1 . 2]" 1
685 1 38 GLN HA 1 44 LEU HB2 4.877 4.103 5.651 4.794 4.630 4.982 . 0 0 "[ . 1 . 2]" 1
686 1 39 SER HA 1 40 ARG HA 4.683 3.901 5.465 4.709 4.672 4.725 . 0 0 "[ . 1 . 2]" 1
687 1 39 SER HB2 1 41 GLU H 6.248 5.189 7.307 5.495 5.383 5.627 . 0 0 "[ . 1 . 2]" 1
688 1 39 SER HB2 1 40 ARG HA 4.746 3.937 5.555 4.506 4.454 4.549 . 0 0 "[ . 1 . 2]" 1
689 1 40 ARG HA 1 63 THR MG 6.483 5.522 7.444 4.573 4.514 4.629 1.008 6 20 [*****+****-*********] 1
690 1 37 ILE HA 1 41 GLU HB2 5.634 4.323 6.945 4.294 4.249 4.366 0.074 10 0 "[ . 1 . 2]" 1
691 1 37 ILE HA 1 41 GLU HB3 6.667 5.478 7.856 5.548 5.524 5.570 . 0 0 "[ . 1 . 2]" 1
692 1 54 ILE MG 1 67 LEU QD 3.187 2.619 3.755 3.252 3.206 3.286 . 0 0 "[ . 1 . 2]" 1
693 1 45 LYS HB3 1 45 LYS QG 2.558 2.269 2.847 2.424 2.340 2.476 . 0 0 "[ . 1 . 2]" 1
694 1 6 LYS HB3 1 6 LYS HG3 3.113 2.743 3.483 2.724 2.388 3.013 0.355 1 0 "[ . 1 . 2]" 1
695 1 6 LYS HB3 1 6 LYS HD2 3.328 2.950 3.706 3.481 2.490 4.258 0.552 11 3 "[ * .- 1+ . 2]" 1
696 1 45 LYS HE2 1 45 LYS QG 2.409 2.096 2.722 2.665 2.334 3.426 0.704 19 3 "[ . 1 - .* +2]" 1
697 1 46 ASN HA 1 47 SER HA 5.201 4.219 6.183 4.733 4.673 4.801 . 0 0 "[ . 1 . 2]" 1
698 1 44 LEU HA 1 47 SER QB 4.929 4.035 5.823 4.621 4.413 4.922 . 0 0 "[ . 1 . 2]" 1
699 1 34 VAL QG 1 49 PRO QB . 3.369 3.720 1.981 1.805 3.067 1.564 11 19 "[**********+** ****-*]" 1
700 1 44 LEU HA 1 46 ASN QB 5.532 4.931 6.133 4.182 3.609 4.931 1.322 13 11 "[-* *.*** * + ** * 2]" 1
701 1 51 GLU HA 1 51 GLU QG 3.251 2.915 3.587 2.513 2.191 2.842 0.724 5 7 "[ - + 1 *** **]" 1
702 1 34 VAL HA 1 52 ILE MG 5.195 4.332 6.058 4.697 4.497 4.832 . 0 0 "[ . 1 . 2]" 1
703 1 47 SER QB 1 52 ILE MG 4.652 4.042 5.262 4.534 4.472 4.713 . 0 0 "[ . 1 . 2]" 1
704 1 53 GLU QG 1 54 ILE QG 7.807 6.025 8.083 5.307 5.179 5.588 0.846 19 18 "[*-************* **+2]" 1
705 1 57 GLU HB3 1 58 THR MG 4.393 3.771 5.015 3.874 3.622 4.055 0.149 8 0 "[ . 1 . 2]" 1
706 1 59 LEU HG 1 63 THR HB 5.881 4.960 6.802 5.173 5.123 5.223 . 0 0 "[ . 1 . 2]" 1
707 1 54 ILE MG 1 59 LEU QD 2.954 2.283 3.625 1.869 1.802 1.913 0.481 3 0 "[ . 1 . 2]" 1
708 1 59 LEU QD 1 64 LEU QD 2.653 2.145 3.161 1.872 1.846 1.905 0.299 7 0 "[ . 1 . 2]" 1
709 1 60 LYS HB3 1 61 PRO HD2 4.468 3.901 5.035 3.812 3.753 3.877 0.148 15 0 "[ . 1 . 2]" 1
710 1 60 LYS HB3 1 61 PRO HD3 5.508 4.874 6.142 4.777 4.751 4.802 0.123 15 0 "[ . 1 . 2]" 1
711 1 63 THR MG 1 67 LEU HA 5.049 4.174 5.924 5.043 4.918 5.149 . 0 0 "[ . 1 . 2]" 1
712 1 10 MET ME 1 64 LEU HA 3.729 3.151 4.307 4.018 3.772 4.209 . 0 0 "[ . 1 . 2]" 1
713 1 64 LEU HA 1 67 LEU HA 5.018 4.369 5.667 5.356 5.316 5.385 . 0 0 "[ . 1 . 2]" 1
714 1 56 PHE HB3 1 64 LEU QD 4.746 3.807 5.685 3.730 3.619 3.845 0.188 2 0 "[ . 1 . 2]" 1
715 1 7 CYS HB2 1 65 ARG HG2 6.590 5.540 7.640 5.582 5.456 5.873 0.084 18 0 "[ . 1 . 2]" 1
716 1 65 ARG HB2 1 65 ARG QD 3.862 3.413 4.311 3.317 3.299 3.467 0.114 18 0 "[ . 1 . 2]" 1
717 1 72 THR HA 1 75 LEU QB 3.010 2.532 3.488 2.584 2.470 2.752 0.062 17 0 "[ . 1 . 2]" 1
718 1 36 ILE MD 1 67 LEU QB . 5.347 6.292 4.060 4.018 4.103 1.329 9 20 [********+*********-*] 1
719 1 59 LEU QD 1 67 LEU QB 4.660 3.783 5.319 4.174 4.160 4.193 . 0 0 "[ . 1 . 2]" 1
720 1 63 THR MG 1 67 LEU HG 3.240 2.600 3.880 2.970 2.875 3.049 . 0 0 "[ . 1 . 2]" 1
721 1 70 TYR HA 1 71 VAL QG 5.332 4.459 6.205 4.457 4.442 4.496 0.017 20 0 "[ . 1 . 2]" 1
722 1 68 GLU HA 1 71 VAL QG 3.296 2.619 3.973 2.349 2.239 2.504 0.380 1 0 "[ . 1 . 2]" 1
723 1 67 LEU QB 1 71 VAL QG 4.357 3.626 5.088 3.397 3.348 3.441 0.278 3 0 "[ . 1 . 2]" 1
724 1 33 VAL QG 1 36 ILE HB 4.412 3.712 5.112 3.670 3.584 3.710 0.128 13 0 "[ . 1 . 2]" 1
725 1 32 ARG QB 1 33 VAL QG 6.067 5.056 7.078 3.255 3.213 3.381 1.843 4 20 [***+***************-] 1
726 1 33 VAL QG 1 70 TYR QB 4.277 3.369 5.185 3.472 3.380 3.550 . 0 0 "[ . 1 . 2]" 1
727 1 74 CYS HA 1 78 LYS HB3 6.278 5.319 7.237 6.695 5.687 7.307 0.070 4 0 "[ . 1 . 2]" 1
728 1 25 LEU HA 1 74 CYS QB 6.057 5.069 7.045 4.879 4.721 4.980 0.348 13 0 "[ . 1 . 2]" 1
729 1 33 VAL QG 2 2 TRP HH2 4.405 3.509 5.301 3.395 3.165 3.804 0.344 8 0 "[ . 1 . 2]" 1
730 1 25 LEU HB3 1 75 LEU QD 4.533 3.747 5.319 4.226 4.154 4.351 . 0 0 "[ . 1 . 2]" 1
731 1 71 VAL HA 1 75 LEU QD 5.081 4.216 5.946 3.673 3.577 3.770 0.639 2 16 "[*+ ** ****** ***-**]" 1
732 1 33 VAL QG 1 34 VAL QG 2.403 2.062 2.744 2.438 2.373 2.519 . 0 0 "[ . 1 . 2]" 1
733 1 44 LEU QD 1 55 ASP QB 5.294 4.141 6.447 3.769 3.462 4.026 0.679 14 2 "[ . 1 +. -]" 1
734 1 30 LEU QD 2 11 TYR QE 5.696 4.825 6.567 3.346 3.186 3.456 1.639 7 20 [-*****+*************] 1
735 1 29 LYS HG2 1 74 CYS QB 5.456 4.571 6.117 5.124 4.962 5.228 . 0 0 "[ . 1 . 2]" 1
736 1 29 LYS QD 1 70 TYR QE 6.523 5.628 7.418 3.436 3.241 3.622 2.387 1 20 [+******************-] 1
737 1 69 ARG HB2 1 72 THR MG 5.004 4.308 5.700 4.197 3.967 4.816 0.341 9 0 "[ . 1 . 2]" 1
738 1 1 SER HA 1 2 GLU QG 5.071 4.297 5.845 5.108 4.509 5.639 . 0 0 "[ . 1 . 2]" 1
739 1 44 LEU HA 1 53 GLU QG 8.992 5.816 12.168 8.790 8.285 9.258 . 0 0 "[ . 1 . 2]" 1
740 1 37 ILE HB 1 38 GLN HA 5.328 4.383 6.273 4.489 4.450 4.540 . 0 0 "[ . 1 . 2]" 1
741 1 45 LYS HB2 1 45 LYS HE2 2.887 2.548 3.226 3.190 2.391 4.214 0.988 19 3 "[ . 1 * .- +2]" 1
742 1 60 LYS HA 1 60 LYS HG2 4.269 3.654 4.884 3.815 3.791 3.834 . 0 0 "[ . 1 . 2]" 1
743 1 72 THR HA 1 73 SER HB3 5.126 4.380 5.872 5.619 5.595 5.646 . 0 0 "[ . 1 . 2]" 1
744 1 35 HIS HB3 1 36 ILE MD 5.862 4.847 6.877 4.842 4.438 4.918 0.409 20 0 "[ . 1 . 2]" 1
745 1 36 ILE MG 1 63 THR HB 5.059 4.078 6.040 4.409 4.342 4.495 . 0 0 "[ . 1 . 2]" 1
746 1 47 SER HA 1 52 ILE MD 5.692 4.889 6.495 3.961 3.901 4.011 0.988 15 20 [**************+****-] 1
747 1 5 ASP QB 1 6 LYS HA 4.828 4.072 5.584 4.375 4.075 4.686 . 0 0 "[ . 1 . 2]" 1
748 1 18 LEU HA 1 56 PHE QE 6.794 5.742 7.846 5.160 5.102 5.218 0.640 4 20 [***+********-*******] 1
749 1 4 GLU HA 1 4 GLU QB 2.479 2.202 2.756 2.248 2.161 2.400 0.041 5 0 "[ . 1 . 2]" 1
750 1 9 PRO HA 1 64 LEU HG 6.183 5.117 7.249 7.051 6.825 7.214 . 0 0 "[ . 1 . 2]" 1
751 1 9 PRO HA 1 9 PRO HG2 3.886 3.400 4.372 3.868 3.842 3.886 . 0 0 "[ . 1 . 2]" 1
752 1 10 MET HA 1 14 GLU QG 4.953 4.202 5.704 4.414 3.712 4.873 0.490 8 0 "[ . 1 . 2]" 1
753 1 8 LYS HE2 1 10 MET HA 5.207 4.573 5.841 5.869 4.550 6.812 0.971 4 8 "[- *+* *1 * . * *]" 1
754 1 10 MET QB 1 64 LEU HG 4.301 3.884 4.949 4.515 4.442 4.567 . 0 0 "[ . 1 . 2]" 1
755 1 10 MET ME 1 18 LEU HA 5.319 4.501 6.137 4.453 4.176 4.600 0.325 8 0 "[ . 1 . 2]" 1
756 1 12 TYR HA 1 15 LYS QE 5.313 5.071 6.133 4.946 4.854 5.045 0.217 5 0 "[ . 1 . 2]" 1
757 1 13 GLU HA 1 16 ARG HG2 4.177 3.541 4.813 4.246 3.758 4.726 . 0 0 "[ . 1 . 2]" 1
758 1 13 GLU HA 1 16 ARG HG3 5.658 4.902 6.414 5.458 5.004 5.905 . 0 0 "[ . 1 . 2]" 1
759 1 12 TYR HE1 1 13 GLU QB 8.930 7.179 10.681 6.684 6.482 6.828 0.697 8 10 "[ * -* + 1 ** *** *]" 1
760 1 14 GLU QB 1 15 LYS HA 4.933 4.177 5.689 3.956 3.857 4.182 0.320 16 0 "[ . 1 . 2]" 1
761 1 15 LYS HA 1 18 LEU QD 4.283 3.728 4.838 3.818 3.731 4.021 . 0 0 "[ . 1 . 2]" 1
762 1 15 LYS HA 1 56 PHE QE 4.723 3.947 5.499 1.818 1.784 1.867 2.163 15 20 [**-***********+*****] 1
763 1 15 LYS HA 1 56 PHE HZ 4.621 3.809 5.433 3.754 3.699 3.889 0.110 16 0 "[ . 1 . 2]" 1
764 1 15 LYS QD 1 64 LEU QD 4.696 4.093 5.299 3.072 2.999 3.155 1.094 6 20 [*****+*********-****] 1
765 1 15 LYS QD 1 56 PHE HZ 4.965 4.097 5.833 5.691 5.650 5.741 . 0 0 "[ . 1 . 2]" 1
766 1 12 TYR HE1 1 15 LYS QD 5.702 4.604 6.699 6.017 5.946 6.072 . 0 0 "[ . 1 . 2]" 1
767 1 15 LYS QE 1 56 PHE QE 5.736 4.654 6.818 3.614 3.536 3.712 1.118 17 20 [**-*************+***] 1
768 1 10 MET QB 1 15 LYS QE 4.681 4.020 5.342 2.569 2.425 2.715 1.595 8 20 [*******+******-*****] 1
769 1 15 LYS QG 1 56 PHE QE 5.038 4.115 5.961 1.982 1.913 2.098 2.202 16 20 [**-************+****] 1
770 1 16 ARG HA 1 20 LEU MD1 4.944 4.206 5.682 4.623 4.440 4.784 . 0 0 "[ . 1 . 2]" 1
771 1 16 ARG HA 1 16 ARG QB 2.652 2.277 3.027 2.255 2.215 2.296 0.062 4 0 "[ . 1 . 2]" 1
772 1 12 TYR QD 1 16 ARG HA 5.783 4.805 6.761 5.056 4.863 5.254 . 0 0 "[ . 1 . 2]" 1
773 1 12 TYR QD 1 16 ARG QB 4.896 4.131 5.661 3.426 3.241 3.638 0.890 2 18 "[*+*****-*** *******]" 1
774 1 72 THR MG 1 76 ARG QD 3.234 2.727 3.741 2.840 1.878 3.515 0.849 13 5 "[* - . * 1* + . 2]" 1
775 1 12 TYR QD 1 16 ARG QD 5.551 5.172 6.507 4.650 4.325 4.804 0.847 19 10 "[-***. ** * * *+2]" 1
776 1 17 GLN HB3 1 20 LEU MD1 5.155 4.481 5.829 4.737 4.666 4.832 . 0 0 "[ . 1 . 2]" 1
777 1 17 GLN HB2 1 20 LEU MD1 3.912 3.391 4.433 3.821 3.706 4.000 . 0 0 "[ . 1 . 2]" 1
778 1 57 GLU HA 1 58 THR MG 4.236 3.644 4.828 4.556 4.449 4.623 . 0 0 "[ . 1 . 2]" 1
779 1 18 LEU QB 1 56 PHE QE 6.000 5.027 6.973 2.637 2.564 2.690 2.463 3 20 [**+************-****] 1
780 1 12 TYR QD 1 16 ARG HG2 6.793 5.665 7.921 6.035 5.686 6.322 . 0 0 "[ . 1 . 2]" 1
781 1 12 TYR QD 1 16 ARG HG3 6.242 5.309 7.175 6.098 5.876 6.400 . 0 0 "[ . 1 . 2]" 1
782 1 64 LEU QD 1 64 LEU HG 2.512 2.063 2.961 1.887 1.884 1.889 0.179 20 0 "[ . 1 . 2]" 1
783 1 18 LEU QD 1 64 LEU QB 4.426 3.407 5.445 3.075 2.887 3.527 0.520 17 6 "[* .* 1 *.-+* 2]" 1
784 1 18 LEU QD 1 18 LEU HG 2.706 2.200 3.212 1.872 1.868 1.875 0.332 8 0 "[ . 1 . 2]" 1
785 1 18 LEU MD1 1 18 LEU MD2 2.876 2.335 3.417 2.000 1.903 2.032 0.432 9 0 "[ . 1 . 2]" 1
786 1 19 SER HB3 1 22 ILE MD 5.535 4.577 6.493 4.516 4.211 4.651 0.366 9 0 "[ . 1 . 2]" 1
787 1 19 SER HB3 1 22 ILE MG 5.142 4.299 5.985 5.331 5.117 5.724 . 0 0 "[ . 1 . 2]" 1
788 1 20 LEU HB3 1 23 ASN HB3 4.656 3.977 5.335 5.412 5.362 5.437 0.102 8 0 "[ . 1 . 2]" 1
789 1 21 ASP HA 1 24 LYS QB 3.699 3.070 4.328 2.953 2.898 3.015 0.172 18 0 "[ . 1 . 2]" 1
790 1 21 ASP QB 1 75 LEU QB 5.829 4.864 6.741 4.148 4.061 4.257 0.803 4 20 [***+*-**************] 1
791 1 21 ASP QB 1 75 LEU HG . 4.768 5.300 4.247 4.208 4.290 0.560 3 18 "[*-+**** **** *******]" 1
792 1 22 ILE HA 1 22 ILE HB 2.968 2.520 3.416 3.000 2.984 3.008 . 0 0 "[ . 1 . 2]" 1
793 1 22 ILE HG12 1 71 VAL HB 4.350 3.610 5.090 4.360 4.239 4.538 . 0 0 "[ . 1 . 2]" 1
794 1 22 ILE HG12 1 22 ILE MG 3.056 2.415 3.697 2.286 2.267 2.346 0.148 8 0 "[ . 1 . 2]" 1
795 1 22 ILE MD 2 2 TRP HZ2 4.464 3.579 5.349 3.564 3.028 3.866 0.551 13 1 "[ . 1 + . 2]" 1
796 1 22 ILE MG 2 11 TYR QE 5.434 4.590 6.278 5.241 5.135 5.377 . 0 0 "[ . 1 . 2]" 1
797 1 23 ASN HB3 2 2 TRP HZ2 4.907 3.948 5.866 4.264 4.005 4.638 . 0 0 "[ . 1 . 2]" 1
798 1 23 ASN HB3 2 11 TYR QD 6.147 5.252 7.042 7.056 7.000 7.113 0.071 2 0 "[ . 1 . 2]" 1
799 1 24 LYS HA 1 24 LYS QE . 5.578 6.029 4.969 4.787 5.079 0.791 11 19 "[**-** ****+*********]" 1
800 1 25 LEU HA 1 25 LEU HG 3.561 2.990 4.132 3.259 3.230 3.296 . 0 0 "[ . 1 . 2]" 1
801 1 25 LEU HB2 1 26 PRO HA 5.614 4.406 6.822 5.047 5.010 5.090 . 0 0 "[ . 1 . 2]" 1
802 1 25 LEU HB3 1 26 PRO HA 4.669 3.861 5.477 5.005 4.944 5.059 . 0 0 "[ . 1 . 2]" 1
803 1 25 LEU QD 1 26 PRO QB 6.328 5.331 7.325 5.084 5.032 5.119 0.299 3 0 "[ . 1 . 2]" 1
804 1 26 PRO HG2 1 29 LYS QE 5.929 4.965 6.430 4.476 4.335 4.595 0.630 12 8 "[ * . ***+ *. * -]" 1
805 1 41 GLU HB2 1 44 LEU QD 2.561 2.174 2.948 2.100 2.034 2.246 0.140 19 0 "[ . 1 . 2]" 1
806 1 29 LYS HG2 1 70 TYR QE 6.508 5.621 7.395 5.724 5.586 5.852 0.035 5 0 "[ . 1 . 2]" 1
807 1 26 PRO HG2 1 29 LYS HG3 3.914 3.441 4.387 4.063 3.941 4.148 . 0 0 "[ . 1 . 2]" 1
808 1 36 ILE QG 1 40 ARG QD 4.841 4.010 5.672 4.501 4.302 5.197 . 0 0 "[ . 1 . 2]" 1
809 1 30 LEU QD 2 2 TRP HZ2 . 4.673 4.895 3.082 2.936 3.325 1.737 8 20 [*******+****-*******] 1
810 1 23 ASN HA 1 30 LEU QD . 2.828 3.385 1.884 1.826 2.079 1.002 6 20 [*****+-*************] 1
811 1 25 LEU HA 1 30 LEU QD 4.448 3.795 5.101 4.230 4.138 4.465 . 0 0 "[ . 1 . 2]" 1
812 1 30 LEU QD 2 11 TYR QB 4.071 3.394 4.748 2.685 2.474 2.994 0.920 2 18 "[*+***- ************]" 1
813 1 23 ASN HB3 1 30 LEU QD 4.810 4.162 5.458 3.728 3.653 3.921 0.509 13 1 "[ . 1 + . 2]" 1
814 1 31 GLY QA 1 34 VAL HB 5.332 4.302 6.362 4.551 3.954 4.685 0.348 14 0 "[ . 1 . 2]" 1
815 1 29 LYS HA 1 32 ARG HG3 6.027 5.131 6.923 6.325 6.215 6.430 . 0 0 "[ . 1 . 2]" 1
816 1 29 LYS HA 1 32 ARG HG2 5.848 4.862 6.834 5.481 5.358 5.581 . 0 0 "[ . 1 . 2]" 1
817 1 32 ARG HG3 1 36 ILE QG . 3.930 4.042 2.564 2.527 2.667 1.403 19 20 [***-**************+*] 1
818 1 32 ARG HG2 1 36 ILE QG 6.093 5.274 6.912 4.031 3.997 4.115 1.277 20 20 [***-***************+] 1
819 1 45 LYS QD 1 45 LYS HE2 2.255 . 2.531 2.311 2.169 2.366 . 0 0 "[ . 1 . 2]" 1
820 1 33 VAL HB 1 36 ILE MD 5.424 4.384 6.464 4.359 4.310 4.442 0.074 3 0 "[ . 1 . 2]" 1
821 1 35 HIS HA 1 36 ILE HA 5.049 4.116 5.982 4.789 4.763 4.816 . 0 0 "[ . 1 . 2]" 1
822 1 36 ILE QG 1 66 GLU QG 4.406 3.554 5.258 4.756 3.978 4.926 . 0 0 "[ . 1 . 2]" 1
823 1 36 ILE MG 1 70 TYR QE 7.356 5.844 8.868 6.638 6.580 6.689 . 0 0 "[ . 1 . 2]" 1
824 1 37 ILE HA 1 63 THR HB 4.859 3.879 5.839 4.194 4.159 4.228 . 0 0 "[ . 1 . 2]" 1
825 1 37 ILE HA 1 40 ARG QD 4.892 4.081 5.703 4.463 4.035 4.745 0.046 15 0 "[ . 1 . 2]" 1
826 1 37 ILE HA 1 59 LEU HA 5.633 4.677 6.589 5.593 5.494 5.738 . 0 0 "[ . 1 . 2]" 1
827 1 37 ILE MD 2 2 TRP HH2 3.975 3.104 4.846 2.879 2.724 2.993 0.380 1 0 "[ . 1 . 2]" 1
828 1 38 GLN HA 1 42 PRO HA 4.883 4.008 5.758 4.863 4.560 5.251 . 0 0 "[ . 1 . 2]" 1
829 1 38 GLN HG3 1 44 LEU HB2 4.281 3.645 4.917 4.976 4.917 5.021 0.104 16 0 "[ . 1 . 2]" 1
830 1 38 GLN HB2 1 45 LYS HA 5.199 4.572 5.826 4.711 4.481 5.037 0.091 19 0 "[ . 1 . 2]" 1
831 1 37 ILE MG 1 41 GLU HB3 3.892 3.423 4.361 3.731 3.707 3.755 . 0 0 "[ . 1 . 2]" 1
832 1 65 ARG HB2 1 65 ARG HG2 2.870 2.442 3.298 2.405 2.379 2.429 0.063 20 0 "[ . 1 . 2]" 1
833 1 38 GLN HB2 1 39 SER HA 5.222 4.333 6.111 4.521 4.444 4.630 . 0 0 "[ . 1 . 2]" 1
834 1 38 GLN HB3 1 39 SER HA 4.680 3.805 5.555 4.192 4.133 4.250 . 0 0 "[ . 1 . 2]" 1
835 1 36 ILE MG 1 39 SER HB3 6.557 5.399 7.715 5.646 5.584 5.691 . 0 0 "[ . 1 . 2]" 1
836 1 39 SER HB3 1 40 ARG HA 5.315 4.592 6.038 5.623 5.591 5.644 . 0 0 "[ . 1 . 2]" 1
837 1 36 ILE HA 1 40 ARG HG2 4.116 3.475 4.757 4.167 3.968 4.361 . 0 0 "[ . 1 . 2]" 1
838 1 40 ARG QD 1 63 THR HB 4.227 3.583 4.871 3.968 3.711 4.191 . 0 0 "[ . 1 . 2]" 1
839 1 45 LYS QG 1 46 ASN HA 5.084 4.102 6.066 3.985 3.469 4.398 0.633 19 1 "[ . 1 . +2]" 1
840 1 37 ILE MG 1 41 GLU HA 4.566 4.002 5.130 4.916 4.893 4.937 . 0 0 "[ . 1 . 2]" 1
841 1 40 ARG QB 1 41 GLU QG 3.433 2.973 3.893 2.522 2.383 2.602 0.590 15 3 "[ . * 1 - + 2]" 1
842 1 41 GLU HB3 1 41 GLU QG 2.795 2.426 3.164 2.378 2.360 2.390 0.066 17 0 "[ . 1 . 2]" 1
843 1 41 GLU QG 1 44 LEU HG 4.951 4.277 5.594 4.031 3.896 4.147 0.381 6 0 "[ . 1 . 2]" 1
844 1 42 PRO HA 1 42 PRO HD3 4.208 3.567 4.849 3.705 3.572 3.773 . 0 0 "[ . 1 . 2]" 1
845 1 41 GLU HA 1 42 PRO HA 4.645 3.906 5.384 4.643 4.588 4.663 . 0 0 "[ . 1 . 2]" 1
846 1 42 PRO HA 1 42 PRO HD2 4.304 3.660 4.948 3.972 3.928 4.134 . 0 0 "[ . 1 . 2]" 1
847 1 43 SER HB2 1 44 LEU HG 4.690 3.886 5.494 4.652 4.008 5.505 0.011 5 0 "[ . 1 . 2]" 1
848 1 38 GLN HG2 1 44 LEU HB3 5.206 4.440 5.972 5.629 5.299 5.764 . 0 0 "[ . 1 . 2]" 1
849 1 38 GLN HG2 1 44 LEU HB2 4.138 3.390 4.886 4.339 4.157 4.548 . 0 0 "[ . 1 . 2]" 1
850 1 41 GLU HB3 1 44 LEU HB3 4.132 3.536 4.728 4.666 4.515 4.769 0.041 11 0 "[ . 1 . 2]" 1
851 1 41 GLU HB3 1 44 LEU HB2 5.349 4.642 6.056 5.715 5.516 5.896 . 0 0 "[ . 1 . 2]" 1
852 1 38 GLN HG2 1 44 LEU HG 4.326 3.562 5.090 4.281 3.498 4.477 0.064 20 0 "[ . 1 . 2]" 1
853 1 38 GLN HG2 1 45 LYS HA 3.166 2.587 3.745 2.554 2.465 2.638 0.122 20 0 "[ . 1 . 2]" 1
854 1 42 PRO HA 1 45 LYS HB3 3.997 3.476 4.518 3.560 3.438 4.030 0.038 5 0 "[ . 1 . 2]" 1
855 1 47 SER QB 1 52 ILE HB 5.207 4.362 6.052 4.096 3.983 4.199 0.379 14 0 "[ . 1 . 2]" 1
856 1 47 SER QB 1 51 GLU QB 5.224 4.157 6.164 4.862 4.552 4.954 . 0 0 "[ . 1 . 2]" 1
857 1 48 ASN HB2 1 51 GLU QG 5.912 4.932 6.892 4.792 4.426 5.313 0.506 6 1 "[ .+ 1 . 2]" 1
858 1 49 PRO HA 1 52 ILE MD 4.520 3.784 5.256 2.960 2.690 3.294 1.094 8 19 "[*******+********-* *]" 1
859 1 41 GLU HA 1 42 PRO HB2 5.839 4.988 6.690 5.184 4.975 5.671 0.013 6 0 "[ . 1 . 2]" 1
860 1 15 LYS QD 1 57 GLU HA 4.555 3.616 5.494 3.480 3.367 3.732 0.249 13 0 "[ . 1 . 2]" 1
861 1 48 ASN HA 1 51 GLU QG 7.181 5.908 8.454 6.672 6.065 7.294 . 0 0 "[ . 1 . 2]" 1
862 1 51 GLU QG 2 8 LYS QG . 5.478 6.295 4.189 2.903 4.881 2.575 14 20 [*********-***+******] 1
863 1 47 SER HA 1 52 ILE HG12 6.116 5.227 7.005 7.077 7.041 7.124 0.119 16 0 "[ . 1 . 2]" 1
864 1 52 ILE MG 2 11 TYR QB 3.841 3.164 4.518 3.231 3.088 3.406 0.076 13 0 "[ . 1 . 2]" 1
865 1 47 SER HA 1 52 ILE MG 6.882 5.730 8.034 6.606 6.508 6.775 . 0 0 "[ . 1 . 2]" 1
866 1 53 GLU HA 1 53 GLU HB3 3.364 2.905 3.823 2.981 2.908 3.018 . 0 0 "[ . 1 . 2]" 1
867 1 53 GLU HB3 1 53 GLU QG 2.526 2.202 2.850 2.348 2.168 2.411 0.034 7 0 "[ . 1 . 2]" 1
868 1 53 GLU QG 2 8 LYS QG 7.707 7.019 7.734 5.308 4.921 6.021 2.098 13 20 [***-********+*******] 1
869 1 52 ILE MG 1 53 GLU QG 5.771 5.252 6.733 4.855 4.606 5.071 0.646 17 4 "[ * 1 * . + -]" 1
870 1 54 ILE HB 2 2 TRP HB3 4.885 3.975 5.795 4.943 4.405 5.266 . 0 0 "[ . 1 . 2]" 1
871 1 30 LEU HA 1 54 ILE MD 5.060 4.052 6.068 5.343 5.266 5.394 . 0 0 "[ . 1 . 2]" 1
872 1 54 ILE HB 1 55 ASP HA 5.096 4.038 6.154 4.834 4.609 5.038 . 0 0 "[ . 1 . 2]" 1
873 1 55 ASP HA 1 58 THR MG 5.839 4.977 6.701 4.526 4.453 4.586 0.524 11 1 "[ . 1+ . 2]" 1
874 1 54 ILE QG 1 55 ASP HA 6.350 5.144 7.556 5.849 5.784 5.890 . 0 0 "[ . 1 . 2]" 1
875 1 39 SER HA 1 40 ARG QD 7.171 5.959 8.383 6.962 6.844 7.000 . 0 0 "[ . 1 . 2]" 1
876 1 57 GLU HB2 2 2 TRP HE3 6.869 5.689 8.049 7.268 7.153 7.436 . 0 0 "[ . 1 . 2]" 1
877 1 57 GLU HB3 2 2 TRP HE3 7.207 6.060 8.354 8.519 8.443 8.602 0.248 8 0 "[ . 1 . 2]" 1
878 1 57 GLU HB2 1 58 THR HA 4.915 3.985 5.845 4.654 4.545 4.787 . 0 0 "[ . 1 . 2]" 1
879 1 57 GLU HB3 1 58 THR HA 5.329 4.349 6.309 4.574 4.464 4.713 . 0 0 "[ . 1 . 2]" 1
880 1 59 LEU HA 1 63 THR HB 3.905 3.410 4.400 4.017 3.946 4.081 . 0 0 "[ . 1 . 2]" 1
881 1 41 GLU HB2 1 59 LEU QB 6.453 5.465 7.361 5.621 5.558 5.709 . 0 0 "[ . 1 . 2]" 1
882 1 41 GLU QG 1 59 LEU QB 4.368 3.430 5.306 3.276 3.211 3.354 0.219 7 0 "[ . 1 . 2]" 1
883 1 59 LEU QB 1 64 LEU HA 5.048 4.158 5.918 3.972 3.941 3.998 0.217 1 0 "[ . 1 . 2]" 1
884 1 64 LEU HA 1 67 LEU HG 2.853 2.323 3.383 2.515 2.441 2.575 . 0 0 "[ . 1 . 2]" 1
885 1 56 PHE HA 1 59 LEU QD . 3.714 3.887 2.099 2.044 2.186 1.670 11 20 [********-*+*********] 1
886 1 54 ILE HA 1 59 LEU QD 4.895 3.979 5.811 3.862 3.695 3.927 0.284 3 0 "[ . 1 . 2]" 1
887 1 41 GLU HB2 1 59 LEU QD 3.863 3.328 4.398 3.433 3.370 3.506 . 0 0 "[ . 1 . 2]" 1
888 1 60 LYS HA 1 61 PRO HG2 4.980 4.456 5.504 4.467 4.446 4.498 0.010 2 0 "[ . 1 . 2]" 1
889 1 61 PRO HB2 1 61 PRO HD3 4.390 3.841 4.939 3.925 3.908 3.946 . 0 0 "[ . 1 . 2]" 1
890 1 62 SER HA 1 65 ARG HG3 4.591 3.852 5.330 4.144 3.965 4.382 . 0 0 "[ . 1 . 2]" 1
891 1 7 CYS HB2 1 62 SER HB2 5.859 4.778 6.940 5.893 5.530 6.157 . 0 0 "[ . 1 . 2]" 1
892 1 62 SER HB3 1 65 ARG HB2 5.531 4.688 6.374 5.101 4.881 5.341 . 0 0 "[ . 1 . 2]" 1
893 1 62 SER HB2 1 65 ARG HB2 5.003 4.159 5.847 4.886 4.664 5.034 . 0 0 "[ . 1 . 2]" 1
894 1 37 ILE HA 1 63 THR HA 6.092 4.904 7.280 4.892 4.825 4.975 0.079 20 0 "[ . 1 . 2]" 1
895 1 63 THR HA 1 67 LEU HG 3.814 3.114 4.514 3.755 3.693 3.835 . 0 0 "[ . 1 . 2]" 1
896 1 59 LEU QD 1 63 THR HA 5.688 4.593 6.783 4.952 4.888 4.996 . 0 0 "[ . 1 . 2]" 1
897 1 63 THR HA 1 67 LEU QD 5.081 4.096 6.066 3.636 3.589 3.666 0.507 1 1 "[+ . 1 . 2]" 1
898 1 41 GLU QG 1 63 THR HB 4.511 3.649 5.373 3.864 3.809 3.950 . 0 0 "[ . 1 . 2]" 1
899 1 40 ARG HG2 1 63 THR HB 5.933 5.121 6.745 6.367 6.278 6.408 . 0 0 "[ . 1 . 2]" 1
900 1 63 THR HB 1 64 LEU QD 5.047 4.352 5.742 3.653 3.623 3.688 0.729 8 20 [*******+**********-*] 1
901 1 63 THR HA 1 66 GLU HA 6.316 5.321 7.311 5.313 5.237 5.393 0.084 17 0 "[ . 1 . 2]" 1
902 1 64 LEU QB 1 64 LEU HG 3.168 2.661 3.675 2.499 2.488 2.505 0.173 19 0 "[ . 1 . 2]" 1
903 1 9 PRO HA 1 64 LEU QD 5.272 4.430 6.114 4.122 3.932 4.237 0.498 12 0 "[ . 1 . 2]" 1
904 1 59 LEU HA 1 64 LEU QD 5.691 5.515 6.688 4.042 4.017 4.067 1.498 8 20 [*******+*-**********] 1
905 1 60 LYS HA 1 64 LEU QD 4.930 3.880 5.980 3.503 3.351 3.581 0.529 15 1 "[ . 1 + 2]" 1
906 1 10 MET HA 1 64 LEU QD 5.113 4.342 5.884 4.545 4.441 4.617 . 0 0 "[ . 1 . 2]" 1
907 1 61 PRO HD2 1 64 LEU QD 5.465 4.553 6.377 4.056 3.931 4.133 0.622 15 9 "[- **.* *1 + ***2]" 1
908 1 10 MET ME 1 64 LEU QD 4.964 4.054 5.874 3.798 3.667 3.947 0.387 16 0 "[ . 1 . 2]" 1
909 1 7 CYS HB3 1 65 ARG HA 5.794 4.906 6.682 6.461 6.111 6.744 0.062 6 0 "[ . 1 . 2]" 1
910 1 36 ILE QG 1 66 GLU HA 6.093 4.894 7.292 6.103 5.830 6.222 . 0 0 "[ . 1 . 2]" 1
911 1 63 THR MG 1 66 GLU HB3 5.471 4.574 6.368 4.518 4.333 4.669 0.241 14 0 "[ . 1 . 2]" 1
912 1 64 LEU QB 1 67 LEU QB 5.253 4.369 6.137 4.265 4.211 4.319 0.158 16 0 "[ . 1 . 2]" 1
913 1 66 GLU HB3 1 67 LEU QD 5.036 4.024 6.048 3.556 3.164 3.760 0.860 14 6 "[ * *- 1 +. **2]" 1
914 1 66 GLU HB2 1 67 LEU QD 4.556 3.657 5.455 3.236 3.103 3.422 0.554 1 3 "[+ . 1 . *- 2]" 1
915 1 36 ILE HB 1 67 LEU QD 2.940 2.323 3.557 2.223 2.187 2.260 0.136 1 0 "[ . 1 . 2]" 1
916 1 36 ILE QG 1 67 LEU QD 4.813 4.021 5.605 3.508 3.475 3.542 0.546 9 17 "[*-******+1******** 2]" 1
917 1 69 ARG HA 1 70 TYR HA 5.213 4.238 6.188 4.681 4.635 4.710 . 0 0 "[ . 1 . 2]" 1
918 1 36 ILE MG 1 70 TYR QB 5.635 4.413 6.623 4.743 4.583 4.829 . 0 0 "[ . 1 . 2]" 1
919 1 22 ILE HA 1 71 VAL HB 4.313 3.350 5.276 3.251 3.181 3.345 0.169 8 0 "[ . 1 . 2]" 1
920 1 68 GLU QG 1 71 VAL QG 4.927 4.200 5.654 3.359 3.216 3.575 0.984 13 20 [************+******-] 1
921 1 22 ILE HA 1 75 LEU QD 4.766 3.912 5.620 3.834 3.751 3.952 0.161 12 0 "[ . 1 . 2]" 1
922 1 75 LEU QD 1 76 ARG HA 6.057 5.041 7.073 5.187 5.125 5.280 . 0 0 "[ . 1 . 2]" 1
923 1 77 LYS HA 1 77 LYS QE 5.958 5.263 6.653 4.649 4.017 4.981 1.246 15 9 "[***-.* ** + *2]" 1
924 1 52 ILE MG 2 11 TYR QD 3.646 3.169 4.123 2.821 2.742 2.916 0.427 7 0 "[ . 1 . 2]" 1
925 1 57 GLU HA 1 57 GLU HG2 3.143 2.736 3.550 2.898 2.800 3.067 . 0 0 "[ . 1 . 2]" 1
926 1 57 GLU HA 1 57 GLU HG3 3.910 3.501 4.319 3.722 3.678 3.788 . 0 0 "[ . 1 . 2]" 1
927 1 57 GLU HG3 1 58 THR MG 6.195 5.135 7.255 5.167 5.004 5.288 0.131 8 0 "[ . 1 . 2]" 1
928 1 5 ASP QB 1 6 LYS HB3 5.928 5.143 6.828 5.511 5.132 5.818 0.011 7 0 "[ . 1 . 2]" 1
929 1 33 VAL QG 2 2 TRP HZ2 4.869 4.512 5.973 3.855 3.627 4.050 0.885 8 19 "[*-*****+***** ******]" 1
930 1 51 GLU QB 2 12 ARG HD2 5.567 4.647 6.487 5.813 4.378 7.309 0.822 8 1 "[ . + 1 . 2]" 1
931 1 53 GLU HB2 2 8 LYS QG . 5.384 6.276 5.488 4.803 5.970 0.581 19 2 "[ . 1 - . +2]" 1
932 1 33 VAL QG 2 7 LEU HG 4.584 2.233 6.935 5.937 5.822 6.061 . 0 0 "[ . 1 . 2]" 1
933 1 53 GLU QG 2 3 THR MG 3.872 2.213 4.794 3.007 2.581 3.512 . 0 0 "[ . 1 . 2]" 1
934 1 53 GLU QG 2 7 LEU HB2 4.115 . 5.613 5.027 4.138 5.602 . 0 0 "[ . 1 . 2]" 1
935 1 54 ILE MD 2 7 LEU HG 3.811 2.192 5.430 4.257 4.142 4.357 . 0 0 "[ . 1 . 2]" 1
936 1 54 ILE MD 2 7 LEU HB2 4.425 2.247 6.603 4.645 4.495 4.828 . 0 0 "[ . 1 . 2]" 1
937 1 54 ILE MD 2 7 LEU MD1 4.864 3.011 6.717 2.890 2.739 3.213 0.272 5 0 "[ . 1 . 2]" 1
938 1 54 ILE MD 2 11 TYR QE 3.812 2.522 5.102 4.415 4.268 4.516 . 0 0 "[ . 1 . 2]" 1
939 1 54 ILE MD 2 11 TYR QD 5.263 2.802 7.724 4.491 4.312 4.598 . 0 0 "[ . 1 . 2]" 1
940 1 54 ILE MD 2 2 TRP HZ2 4.314 2.230 6.398 3.568 3.308 3.689 . 0 0 "[ . 1 . 2]" 1
941 1 54 ILE MD 2 2 TRP HE3 4.401 2.243 6.559 4.665 4.346 4.877 . 0 0 "[ . 1 . 2]" 1
942 1 22 ILE MD 2 2 TRP HZ3 4.084 2.215 5.953 3.722 3.395 3.971 . 0 0 "[ . 1 . 2]" 1
943 1 22 ILE MD 2 2 TRP HH2 3.762 2.173 5.351 2.603 2.290 2.839 . 0 0 "[ . 1 . 2]" 1
944 1 22 ILE MD 2 7 LEU MD2 5.463 3.128 7.798 5.285 4.896 5.422 . 0 0 "[ . 1 . 2]" 1
945 1 37 ILE MD 2 2 TRP HZ2 4.850 2.231 7.469 4.887 4.713 5.013 . 0 0 "[ . 1 . 2]" 1
946 1 52 ILE MD 2 11 TYR QD 5.262 2.808 7.716 6.057 5.950 6.123 . 0 0 "[ . 1 . 2]" 1
947 1 54 ILE MG 2 2 TRP HZ2 5.378 2.161 8.595 4.938 4.768 5.089 . 0 0 "[ . 1 . 2]" 1
948 1 54 ILE MG 2 2 TRP HH2 4.145 2.223 6.067 3.143 2.830 3.354 . 0 0 "[ . 1 . 2]" 1
949 1 54 ILE MG 2 2 TRP HE3 5.420 2.148 8.692 3.005 2.857 3.291 . 0 0 "[ . 1 . 2]" 1
950 1 52 ILE MG 2 11 TYR QE 4.522 2.703 6.341 2.876 2.727 3.037 . 0 0 "[ . 1 . 2]" 1
951 1 22 ILE MG 2 2 TRP HZ2 4.147 2.216 6.078 2.321 2.072 2.652 0.144 8 0 "[ . 1 . 2]" 1
952 1 34 VAL QG 2 11 TYR QE 5.517 2.818 8.216 2.040 1.912 2.218 0.906 1 20 [+*****-*************] 1
953 1 33 VAL QG 2 11 TYR QD 5.453 2.813 8.093 4.288 4.083 4.550 . 0 0 "[ . 1 . 2]" 1
954 1 34 VAL QG 2 11 TYR QD 4.766 2.746 6.786 3.391 3.196 3.583 . 0 0 "[ . 1 . 2]" 1
955 1 30 LEU QD 2 11 TYR QD 4.955 2.772 7.138 2.079 1.975 2.421 0.797 15 18 "[****** *-****+*****]" 1
956 1 30 LEU QD 2 2 TRP HH2 4.057 2.221 5.893 4.294 4.063 4.699 . 0 0 "[ . 1 . 2]" 1
957 1 30 LEU QD 2 7 LEU MD1 3.589 2.578 4.600 2.108 2.002 2.302 0.576 9 6 "[ *.-* +1** . 2]" 1
958 1 30 LEU QD 2 7 LEU MD2 3.857 2.697 5.017 3.859 3.697 3.987 . 0 0 "[ . 1 . 2]" 1
959 1 54 ILE QG 2 11 TYR QE 4.204 . 6.443 5.656 5.460 5.803 . 0 0 "[ . 1 . 2]" 1
960 1 54 ILE QG 2 11 TYR QD 4.354 . 6.760 5.642 5.485 5.773 . 0 0 "[ . 1 . 2]" 1
961 1 54 ILE QG 2 7 LEU MD2 3.646 2.146 5.146 2.119 2.008 2.232 0.138 16 0 "[ . 1 . 2]" 1
962 1 54 ILE QG 2 7 LEU MD1 3.765 2.186 5.344 3.974 3.811 4.209 . 0 0 "[ . 1 . 2]" 1
963 1 53 GLU QG 2 8 LYS HE2 3.692 . 5.880 4.708 3.792 5.560 . 0 0 "[ . 1 . 2]" 1
964 1 51 GLU QG 2 8 LYS HE2 3.641 . 5.719 4.184 2.345 5.307 . 0 0 "[ . 1 . 2]" 1
965 1 54 ILE HB 2 2 TRP HZ2 4.490 . 7.720 4.454 4.186 4.645 . 0 0 "[ . 1 . 2]" 1
966 1 54 ILE HB 2 2 TRP HE3 4.337 . 7.355 3.398 3.119 3.726 . 0 0 "[ . 1 . 2]" 1
967 1 23 ASN HB3 2 7 LEU HB2 4.386 . 7.455 5.760 5.293 6.865 . 0 0 "[ . 1 . 2]" 1
968 1 23 ASN HB3 2 7 LEU MD1 4.294 2.233 6.355 4.286 4.057 4.614 . 0 0 "[ . 1 . 2]" 1
969 1 23 ASN HA 2 7 LEU MD1 4.681 2.230 7.132 4.002 3.615 4.412 . 0 0 "[ . 1 . 2]" 1
970 1 38 GLN QE 1 51 GLU HA 4.693 . 8.370 7.654 7.462 7.816 . 0 0 "[ . 1 . 2]" 1
971 1 19 SER HA 2 2 TRP HH2 3.784 . 6.081 4.180 3.997 4.387 . 0 0 "[ . 1 . 2]" 1
972 1 19 SER HA 2 2 TRP HZ2 4.245 . 7.138 3.620 3.286 3.944 . 0 0 "[ . 1 . 2]" 1
973 1 19 SER HA 2 2 TRP HZ3 4.109 . 6.817 4.715 4.477 4.917 . 0 0 "[ . 1 . 2]" 1
974 1 19 SER HB3 2 2 TRP HH2 3.405 . 5.264 5.309 5.066 5.590 0.326 19 0 "[ . 1 . 2]" 1
975 1 19 SER HB3 2 2 TRP HZ2 4.217 . 7.074 4.491 4.096 5.259 . 0 0 "[ . 1 . 2]" 1
976 1 19 SER HB3 2 7 LEU HB2 4.431 . 7.586 5.533 4.857 6.482 . 0 0 "[ . 1 . 2]" 1
977 1 19 SER HB3 2 7 LEU MD2 4.809 2.215 7.403 5.787 5.286 6.398 . 0 0 "[ . 1 . 2]" 1
978 1 19 SER HB3 2 7 LEU MD1 4.072 2.218 5.926 5.428 5.021 6.254 0.328 1 0 "[ . 1 . 2]" 1
979 1 50 ASP HA 2 12 ARG HD2 3.671 . 5.832 5.110 4.258 6.421 0.589 10 1 "[ . + . 2]" 1
980 1 19 SER HA 2 7 LEU MD1 4.582 2.238 6.926 5.201 4.966 5.360 . 0 0 "[ . 1 . 2]" 1
981 1 54 ILE MD 2 2 TRP HZ3 4.792 2.230 7.354 2.976 2.777 3.155 . 0 0 "[ . 1 . 2]" 1
982 1 52 ILE MD 2 11 TYR QE 5.138 2.799 7.477 5.467 5.304 5.582 . 0 0 "[ . 1 . 2]" 1
983 1 52 ILE MG 2 7 LEU HG 3.145 2.033 4.257 2.310 2.234 2.363 . 0 0 "[ . 1 . 2]" 1
984 1 52 ILE MG 2 7 LEU HB2 4.535 2.265 6.805 4.585 4.497 4.678 . 0 0 "[ . 1 . 2]" 1
985 1 54 ILE MG 2 7 LEU MD2 4.360 2.887 5.833 3.569 3.485 3.684 . 0 0 "[ . 1 . 2]" 1
986 1 50 ASP HA 2 11 TYR QD 4.626 . 7.350 3.800 2.949 4.438 . 0 0 "[ . 1 . 2]" 1
987 1 50 ASP HA 2 11 TYR QE 4.813 . 7.761 2.607 2.017 3.221 . 0 0 "[ . 1 . 2]" 1
988 1 30 LEU QD 2 7 LEU HA 3.941 2.210 5.672 3.908 3.633 4.259 . 0 0 "[ . 1 . 2]" 1
989 1 52 ILE MG 2 7 LEU MD2 3.053 2.323 3.783 2.033 1.836 2.136 0.487 7 0 "[ . 1 . 2]" 1
990 1 57 GLU HG2 2 1 LYS HB2 3.601 . 5.683 3.936 2.579 5.034 . 0 0 "[ . 1 . 2]" 1
991 1 57 GLU HG3 2 1 LYS HB2 3.596 . 5.670 4.084 2.623 4.969 . 0 0 "[ . 1 . 2]" 1
992 1 57 GLU HG2 2 1 LYS HD3 3.482 . 5.420 3.860 2.706 5.026 . 0 0 "[ . 1 . 2]" 1
993 1 57 GLU HG2 2 1 LYS HD2 3.488 . 5.433 3.394 2.298 5.424 . 0 0 "[ . 1 . 2]" 1
994 1 55 ASP HA 2 1 LYS HB2 4.164 . 6.949 5.765 3.777 7.698 0.749 2 1 "[ + . 1 . 2]" 1
995 1 53 GLU QG 2 3 THR HA 3.521 . 5.516 2.770 2.208 3.970 . 0 0 "[ . 1 . 2]" 1
996 1 55 ASP HA 2 1 LYS HD3 5.059 . 9.167 7.245 5.189 8.713 . 0 0 "[ . 1 . 2]" 1
997 1 55 ASP HA 2 1 LYS HD2 5.064 . 9.159 6.747 4.403 8.929 . 0 0 "[ . 1 . 2]" 1
998 1 52 ILE MD 2 7 LEU HG 4.639 2.250 7.028 5.601 5.451 5.690 . 0 0 "[ . 1 . 2]" 1
999 1 54 ILE MG 2 7 LEU HB2 4.821 2.227 7.415 5.609 5.385 5.981 . 0 0 "[ . 1 . 2]" 1
1000 1 22 ILE MG 2 7 LEU MD1 3.937 2.724 5.150 3.198 2.899 3.509 . 0 0 "[ . 1 . 2]" 1
1001 1 22 ILE MD 2 7 LEU MD1 4.690 2.973 6.407 4.810 4.384 5.027 . 0 0 "[ . 1 . 2]" 1
1002 1 33 VAL QG 2 7 LEU MD1 4.426 2.892 5.960 3.709 3.570 3.914 . 0 0 "[ . 1 . 2]" 1
1003 1 33 VAL QG 2 7 LEU MD2 4.693 2.968 6.418 4.343 4.175 4.581 . 0 0 "[ . 1 . 2]" 1
1004 1 34 VAL QG 2 2 TRP HZ2 4.414 2.233 6.595 5.290 5.077 5.465 . 0 0 "[ . 1 . 2]" 1
1005 1 34 VAL QG 2 2 TRP HH2 4.206 2.234 6.178 4.769 4.558 4.919 . 0 0 "[ . 1 . 2]" 1
1006 1 30 LEU QD 2 2 TRP HD1 4.919 2.218 7.620 6.170 5.992 6.405 . 0 0 "[ . 1 . 2]" 1
1007 1 54 ILE QG 2 2 TRP HH2 3.197 . 4.825 4.330 3.976 4.455 . 0 0 "[ . 1 . 2]" 1
1008 1 54 ILE QG 2 2 TRP HZ2 3.645 . 5.769 5.355 5.041 5.467 . 0 0 "[ . 1 . 2]" 1
1009 1 54 ILE QG 2 2 TRP HE3 4.496 . 7.716 5.360 5.117 5.608 . 0 0 "[ . 1 . 2]" 1
1010 1 18 LEU QD 2 2 TRP HZ2 5.049 2.202 7.896 6.018 5.340 6.450 . 0 0 "[ . 1 . 2]" 1
1011 1 57 GLU HG2 2 2 TRP HE3 3.911 . 6.346 6.211 6.037 6.361 0.015 3 0 "[ . 1 . 2]" 1
1012 1 57 GLU HG3 2 1 LYS HD2 3.938 . 6.428 3.335 2.191 5.539 . 0 0 "[ . 1 . 2]" 1
1013 1 53 GLU QG 2 9 ARG HD2 3.942 . 6.443 6.702 6.231 7.301 0.858 10 7 "[ *.* * + * . -*2]" 1
1014 1 51 GLU QG 2 12 ARG HD2 4.222 . 7.059 4.361 2.533 6.132 . 0 0 "[ . 1 . 2]" 1
1015 1 54 ILE HB 2 7 LEU MD1 3.508 2.136 4.880 4.023 3.951 4.178 . 0 0 "[ . 1 . 2]" 1
1016 1 54 ILE HB 2 7 LEU MD2 3.689 2.160 5.218 2.212 2.078 2.401 0.082 18 0 "[ . 1 . 2]" 1
1017 1 52 ILE HB 2 7 LEU MD1 4.664 2.245 7.083 5.269 5.176 5.417 . 0 0 "[ . 1 . 2]" 1
1018 1 52 ILE HB 2 7 LEU MD2 4.145 2.238 6.052 4.316 4.122 4.463 . 0 0 "[ . 1 . 2]" 1
1019 1 52 ILE HB 2 7 LEU HG 3.378 . 5.163 5.270 5.206 5.334 0.171 18 0 "[ . 1 . 2]" 1
1020 1 22 ILE HB 2 7 LEU MD1 4.269 2.233 6.305 4.753 4.555 5.053 . 0 0 "[ . 1 . 2]" 1
1021 1 30 LEU QB 2 7 LEU MD2 4.781 2.213 7.349 4.710 4.487 4.931 . 0 0 "[ . 1 . 2]" 1
1022 1 51 GLU QB 2 8 LYS HE2 3.922 . 6.386 3.229 2.220 4.376 . 0 0 "[ . 1 . 2]" 1
1023 1 53 GLU HB2 2 8 LYS HE2 3.124 . 4.696 4.070 2.661 4.930 0.234 20 0 "[ . 1 . 2]" 1
1024 1 53 GLU HB3 2 3 THR MG 3.641 2.159 5.123 4.755 4.475 4.924 . 0 0 "[ . 1 . 2]" 1
1025 1 53 GLU HB3 2 3 THR HA 3.833 . 6.156 5.075 4.571 5.551 . 0 0 "[ . 1 . 2]" 1
1026 1 18 LEU QD 2 2 TRP HH2 4.220 2.231 6.209 5.237 4.762 5.543 . 0 0 "[ . 1 . 2]" 1
1027 1 52 ILE HB 2 11 TYR QD 5.336 . 8.954 5.026 4.866 5.151 . 0 0 "[ . 1 . 2]" 1
1028 1 30 LEU QB 2 7 LEU MD1 4.510 2.237 6.023 3.227 3.092 3.359 . 0 0 "[ . 1 . 2]" 1
1029 1 30 LEU QB 2 11 TYR QD 4.474 . 7.021 2.334 2.146 2.661 . 0 0 "[ . 1 . 2]" 1
1030 1 30 LEU QB 2 11 TYR QE 5.117 . 8.082 2.117 2.003 2.188 . 0 0 "[ . 1 . 2]" 1
1031 1 54 ILE H 1 54 ILE HA 3.497 2.852 4.142 2.919 2.901 2.957 . 0 0 "[ . 1 . 2]" 1
1032 1 53 GLU HB3 1 54 ILE H 4.289 3.630 4.948 4.213 3.819 4.338 . 0 0 "[ . 1 . 2]" 1
1033 1 54 ILE H 1 54 ILE HB 3.094 2.528 3.660 2.548 2.503 2.646 0.025 7 0 "[ . 1 . 2]" 1
1034 1 66 GLU H 1 66 GLU HB2 1.946 . 2.164 2.278 2.193 2.320 0.156 9 0 "[ . 1 . 2]" 1
1035 1 60 LYS H 1 60 LYS HB3 2.057 . 2.306 2.420 2.396 2.456 0.150 19 0 "[ . 1 . 2]" 1
1036 1 60 LYS H 1 60 LYS HG2 2.274 . 2.584 2.312 2.204 2.404 . 0 0 "[ . 1 . 2]" 1
1037 1 78 LYS H 1 78 LYS HB3 2.942 2.560 3.324 2.722 2.440 3.522 0.198 3 0 "[ . 1 . 2]" 1
1038 1 78 LYS H 1 78 LYS HB2 2.407 2.088 2.726 2.536 2.150 2.932 0.206 3 0 "[ . 1 . 2]" 1
1039 1 78 LYS H 1 78 LYS HG3 4.023 3.618 4.428 4.454 4.054 4.631 0.203 3 0 "[ . 1 . 2]" 1
1040 1 58 THR H 1 59 LEU HG 3.548 3.109 3.987 3.109 3.087 3.134 0.022 11 0 "[ . 1 . 2]" 1
1041 1 58 THR H 1 58 THR HB 3.251 2.855 3.647 3.711 3.696 3.729 0.082 13 0 "[ . 1 . 2]" 1
1042 1 57 GLU HA 1 58 THR H 2.919 2.548 3.290 3.341 3.298 3.403 0.113 8 0 "[ . 1 . 2]" 1
1043 1 56 PHE HA 1 58 THR H 4.198 3.560 4.836 3.747 3.634 3.822 . 0 0 "[ . 1 . 2]" 1
1044 1 58 THR H 1 58 THR MG 2.342 2.072 2.612 2.560 2.533 2.577 . 0 0 "[ . 1 . 2]" 1
1045 1 47 SER HA 1 48 ASN H 2.405 2.125 2.685 2.142 2.102 2.184 0.023 6 0 "[ . 1 . 2]" 1
1046 1 48 ASN H 1 48 ASN HB3 3.405 3.039 3.771 3.132 3.023 3.374 0.016 17 0 "[ . 1 . 2]" 1
1047 1 48 ASN H 1 48 ASN HB2 2.600 2.239 2.961 2.178 2.134 2.275 0.105 6 0 "[ . 1 . 2]" 1
1048 1 62 SER HA 1 63 THR H 3.104 2.692 3.516 3.548 3.534 3.559 0.043 5 0 "[ . 1 . 2]" 1
1049 1 62 SER HB2 1 63 THR H 3.442 3.026 3.858 3.578 3.475 3.689 . 0 0 "[ . 1 . 2]" 1
1050 1 10 MET H 1 10 MET HA 2.378 2.098 2.658 2.843 2.823 2.866 0.208 15 0 "[ . 1 . 2]" 1
1051 1 9 PRO HA 1 10 MET H 1.857 . 2.057 2.149 2.133 2.169 0.112 9 0 "[ . 1 . 2]" 1
1052 1 10 MET H 1 10 MET QB . 2.397 2.594 2.262 2.230 2.290 0.167 10 0 "[ . 1 . 2]" 1
1053 1 10 MET H 1 64 LEU QD 3.095 2.670 3.520 2.958 2.810 3.066 . 0 0 "[ . 1 . 2]" 1
1054 1 71 VAL H 1 71 VAL HA 2.521 2.206 2.836 2.833 2.821 2.840 0.004 20 0 "[ . 1 . 2]" 1
1055 1 71 VAL H 1 71 VAL QG 2.262 . 2.542 1.947 1.925 1.988 0.057 6 0 "[ . 1 . 2]" 1
1056 1 11 SER HA 1 12 TYR H 2.562 2.269 2.855 2.544 2.467 2.626 . 0 0 "[ . 1 . 2]" 1
1057 1 12 TYR H 1 12 TYR QB 2.676 2.303 3.049 2.226 2.205 2.249 0.098 5 0 "[ . 1 . 2]" 1
1058 1 20 LEU HB2 1 21 ASP H 2.188 . 2.454 2.471 2.422 2.544 0.090 13 0 "[ . 1 . 2]" 1
1059 1 32 ARG H 1 32 ARG HA 2.804 2.451 3.157 2.880 2.871 2.892 . 0 0 "[ . 1 . 2]" 1
1060 1 31 GLY QA 1 32 ARG H 2.934 2.891 3.286 2.828 2.731 2.849 0.160 14 0 "[ . 1 . 2]" 1
1061 1 32 ARG H 1 32 ARG QB . 2.316 2.497 2.187 2.149 2.231 0.167 14 0 "[ . 1 . 2]" 1
1062 1 32 ARG H 1 32 ARG HG3 3.989 3.524 4.454 4.260 4.197 4.296 . 0 0 "[ . 1 . 2]" 1
1063 1 29 LYS HA 1 32 ARG H 3.336 2.801 3.871 3.416 3.334 3.514 . 0 0 "[ . 1 . 2]" 1
1064 1 36 ILE H 1 36 ILE HA 2.644 2.324 2.964 2.812 2.790 2.828 . 0 0 "[ . 1 . 2]" 1
1065 1 36 ILE H 1 36 ILE QG 2.091 . 2.339 2.241 2.199 2.317 . 0 0 "[ . 1 . 2]" 1
1066 1 30 LEU HA 1 33 VAL H 2.744 2.354 3.134 2.977 2.934 3.024 . 0 0 "[ . 1 . 2]" 1
1067 1 56 PHE HA 1 59 LEU H 3.314 2.940 3.688 3.471 3.370 3.549 . 0 0 "[ . 1 . 2]" 1
1068 1 58 THR MG 1 59 LEU H 3.830 3.381 4.279 3.993 3.967 4.029 . 0 0 "[ . 1 . 2]" 1
1069 1 59 LEU H 1 59 LEU HG 2.015 . 2.285 1.951 1.903 1.996 . 0 0 "[ . 1 . 2]" 1
1070 1 59 LEU H 1 59 LEU QB 2.383 2.067 2.699 2.638 2.629 2.650 . 0 0 "[ . 1 . 2]" 1
1071 1 14 GLU H 1 14 GLU QB 2.047 . 2.279 2.274 2.111 2.343 0.064 10 0 "[ . 1 . 2]" 1
1072 1 11 SER HA 1 14 GLU H 4.340 3.763 4.917 4.704 4.565 4.866 . 0 0 "[ . 1 . 2]" 1
1073 1 12 TYR HA 1 15 LYS H 3.111 2.726 3.496 3.510 3.470 3.554 0.058 19 0 "[ . 1 . 2]" 1
1074 1 14 GLU HA 1 15 LYS H 3.253 2.837 3.669 3.555 3.544 3.586 . 0 0 "[ . 1 . 2]" 1
1075 1 15 LYS H 1 15 LYS QG 2.984 2.661 3.307 2.431 2.392 2.466 0.269 10 0 "[ . 1 . 2]" 1
1076 1 15 LYS H 1 15 LYS HA 2.333 2.056 2.610 2.725 2.712 2.738 0.128 8 0 "[ . 1 . 2]" 1
1077 1 10 MET QG 1 15 LYS H 2.499 2.164 2.834 2.578 2.427 2.778 . 0 0 "[ . 1 . 2]" 1
1078 1 21 ASP HA 1 22 ILE H 2.934 2.508 3.360 3.472 3.466 3.485 0.125 13 0 "[ . 1 . 2]" 1
1079 1 22 ILE H 1 22 ILE HA 2.570 2.234 2.906 2.827 2.801 2.841 . 0 0 "[ . 1 . 2]" 1
1080 1 19 SER HA 1 22 ILE H 3.379 2.940 3.818 3.763 3.696 3.844 0.026 14 0 "[ . 1 . 2]" 1
1081 1 25 LEU H 1 25 LEU HG 1.857 . 2.086 1.914 1.890 1.945 . 0 0 "[ . 1 . 2]" 1
1082 1 64 LEU HA 1 67 LEU H 3.140 2.816 3.464 3.555 3.518 3.608 0.144 8 0 "[ . 1 . 2]" 1
1083 1 14 GLU HA 1 17 GLN H 2.947 2.579 3.315 3.422 3.239 3.509 0.194 10 0 "[ . 1 . 2]" 1
1084 1 17 GLN H 1 17 GLN HA 2.614 2.303 2.925 2.829 2.813 2.842 . 0 0 "[ . 1 . 2]" 1
1085 1 16 ARG HG2 1 17 GLN H 3.185 2.664 3.706 3.231 2.878 3.559 . 0 0 "[ . 1 . 2]" 1
1086 1 30 LEU H 1 31 GLY QA 5.309 4.570 5.611 4.363 4.300 4.387 0.270 14 0 "[ . 1 . 2]" 1
1087 1 40 ARG H 1 40 ARG HA 2.583 2.284 2.882 2.870 2.858 2.888 0.006 6 0 "[ . 1 . 2]" 1
1088 1 39 SER HB2 1 40 ARG H 3.290 2.918 3.662 3.727 3.685 3.781 0.119 6 0 "[ . 1 . 2]" 1
1089 1 67 LEU H 1 67 LEU HA 2.395 2.091 2.699 2.755 2.742 2.760 0.061 20 0 "[ . 1 . 2]" 1
1090 1 67 LEU H 1 67 LEU HG 1.860 . 2.124 1.850 1.812 1.880 . 0 0 "[ . 1 . 2]" 1
1091 1 63 THR MG 1 67 LEU H 4.212 3.540 4.884 3.965 3.846 4.071 . 0 0 "[ . 1 . 2]" 1
1092 1 29 LYS QB 1 30 LEU H 3.228 2.762 3.694 2.930 2.863 2.970 . 0 0 "[ . 1 . 2]" 1
1093 1 41 GLU H 1 41 GLU HB2 2.454 2.143 2.765 2.693 2.609 2.750 . 0 0 "[ . 1 . 2]" 1
1094 1 71 VAL HA 1 72 THR H 3.182 2.718 3.646 3.507 3.462 3.524 . 0 0 "[ . 1 . 2]" 1
1095 1 29 LYS H 1 29 LYS HA 2.468 2.169 2.767 2.850 2.844 2.863 0.096 1 0 "[ . 1 . 2]" 1
1096 1 28 GLU HB3 1 29 LYS H 3.042 2.585 3.499 2.754 2.608 3.770 0.271 3 0 "[ . 1 . 2]" 1
1097 1 29 LYS H 1 29 LYS QB 2.060 . 2.329 2.207 2.186 2.232 . 0 0 "[ . 1 . 2]" 1
1098 1 29 LYS H 1 29 LYS QD 3.087 2.680 3.494 3.304 3.221 3.401 . 0 0 "[ . 1 . 2]" 1
1099 1 29 LYS H 1 29 LYS HG2 2.967 2.612 3.322 3.033 2.943 3.191 . 0 0 "[ . 1 . 2]" 1
1100 1 28 GLU HA 1 29 LYS H 3.573 3.052 4.094 3.513 3.490 3.527 . 0 0 "[ . 1 . 2]" 1
1101 1 74 CYS H 1 74 CYS QB . 2.197 2.407 2.265 2.248 2.274 . 0 0 "[ . 1 . 2]" 1
1102 1 74 CYS H 1 75 LEU HG 3.423 3.068 3.778 3.686 3.620 3.750 . 0 0 "[ . 1 . 2]" 1
1103 1 24 LYS H 1 24 LYS QB 2.113 . 2.362 2.377 2.304 2.410 0.048 2 0 "[ . 1 . 2]" 1
1104 1 24 LYS H 1 24 LYS QG 3.486 3.156 3.816 2.362 2.251 2.523 0.905 2 20 [*+***-**************] 1
1105 1 48 ASN HB3 1 51 GLU H 3.269 2.735 3.803 2.864 2.672 3.342 0.063 16 0 "[ . 1 . 2]" 1
1106 1 50 ASP QB 1 51 GLU H 4.374 3.791 4.560 3.166 3.072 3.300 0.719 19 19 "[***********-* ****+*]" 1
1107 1 17 GLN HE21 1 17 GLN HG3 2.180 . 2.446 2.200 2.174 2.262 . 0 0 "[ . 1 . 2]" 1
1108 1 22 ILE HA 1 23 ASN H 3.764 3.105 4.423 3.531 3.514 3.551 . 0 0 "[ . 1 . 2]" 1
1109 1 17 GLN HE22 1 17 GLN HG3 3.390 3.090 3.690 3.468 3.458 3.491 . 0 0 "[ . 1 . 2]" 1
1110 1 17 GLN HE22 1 20 LEU MD1 3.088 2.635 3.541 3.128 2.864 3.255 . 0 0 "[ . 1 . 2]" 1
1111 1 23 ASN H 1 23 ASN HA 2.642 2.328 2.956 2.867 2.841 2.887 . 0 0 "[ . 1 . 2]" 1
1112 1 22 ILE HB 1 23 ASN H 2.627 2.277 2.977 2.788 2.638 2.875 . 0 0 "[ . 1 . 2]" 1
1113 1 23 ASN H 1 23 ASN HB3 2.118 . 2.362 2.266 2.213 2.312 . 0 0 "[ . 1 . 2]" 1
1114 1 48 ASN HB3 1 50 ASP H 2.840 2.414 3.266 2.917 2.399 3.206 0.015 10 0 "[ . 1 . 2]" 1
1115 1 50 ASP H 1 50 ASP HA 2.593 2.302 2.884 2.889 2.855 2.922 0.038 10 0 "[ . 1 . 2]" 1
1116 1 56 PHE HA 1 57 GLU H 3.018 2.599 3.437 3.354 3.297 3.380 . 0 0 "[ . 1 . 2]" 1
1117 1 56 PHE HB2 1 57 GLU H 3.711 3.213 4.209 3.829 3.721 3.898 . 0 0 "[ . 1 . 2]" 1
1118 1 57 GLU H 1 57 GLU HA 2.554 2.265 2.843 2.887 2.873 2.906 0.063 9 0 "[ . 1 . 2]" 1
1119 1 57 GLU H 1 57 GLU HG2 2.461 2.147 2.775 2.564 2.387 2.643 . 0 0 "[ . 1 . 2]" 1
1120 1 57 GLU H 1 57 GLU HG3 3.440 3.136 3.744 3.770 3.684 3.828 0.084 1 0 "[ . 1 . 2]" 1
1121 1 57 GLU H 1 58 THR MG 3.764 3.248 4.280 3.603 3.446 3.745 . 0 0 "[ . 1 . 2]" 1
1122 1 71 VAL HA 1 73 SER H 4.019 3.336 4.702 3.811 3.746 3.867 . 0 0 "[ . 1 . 2]" 1
1123 1 73 SER H 1 73 SER HB3 1.969 . 2.177 2.280 2.261 2.305 0.128 15 0 "[ . 1 . 2]" 1
1124 1 72 THR HA 1 73 SER H 3.339 2.843 3.835 3.499 3.480 3.526 . 0 0 "[ . 1 . 2]" 1
1125 1 72 THR MG 1 73 SER H 2.547 2.215 2.879 2.569 2.425 2.891 0.012 11 0 "[ . 1 . 2]" 1
1126 1 39 SER H 1 39 SER HA 2.481 2.223 2.739 2.830 2.816 2.840 0.101 2 0 "[ . 1 . 2]" 1
1127 1 39 SER H 1 39 SER HB3 2.290 2.029 2.551 2.576 2.552 2.598 0.047 17 0 "[ . 1 . 2]" 1
1128 1 39 SER H 1 39 SER HB2 3.201 2.919 3.483 3.575 3.565 3.588 0.105 10 0 "[ . 1 . 2]" 1
1129 1 38 GLN HB2 1 39 SER H 2.433 2.137 2.729 2.742 2.640 2.815 0.086 20 0 "[ . 1 . 2]" 1
1130 1 52 ILE HA 1 53 GLU H 1.960 . 2.183 2.212 2.190 2.249 0.066 7 0 "[ . 1 . 2]" 1
1131 1 53 GLU H 1 53 GLU HA 2.806 2.394 3.218 2.918 2.906 2.929 . 0 0 "[ . 1 . 2]" 1
1132 1 53 GLU H 1 53 GLU QG 4.064 3.883 4.575 4.152 4.049 4.330 . 0 0 "[ . 1 . 2]" 1
1133 1 54 ILE HA 1 55 ASP H 2.513 2.201 2.825 2.168 2.115 2.216 0.086 15 0 "[ . 1 . 2]" 1
1134 1 55 ASP H 1 55 ASP QB 2.860 2.678 3.244 2.578 2.413 2.769 0.265 20 0 "[ . 1 . 2]" 1
1135 1 54 ILE MD 1 55 ASP H 5.431 4.633 6.229 5.105 4.996 5.226 . 0 0 "[ . 1 . 2]" 1
1136 1 8 LYS H 1 8 LYS HA 2.572 2.266 2.878 2.821 2.735 2.919 0.041 20 0 "[ . 1 . 2]" 1
1137 1 7 CYS HA 1 8 LYS H 1.999 . 2.201 2.165 2.117 2.222 0.021 15 0 "[ . 1 . 2]" 1
1138 1 79 ARG HA 1 80 LYS H 2.110 . 2.353 2.284 2.154 2.484 0.131 16 0 "[ . 1 . 2]" 1
1139 1 63 THR H 1 64 LEU H 2.456 2.115 2.797 2.677 2.611 2.728 . 0 0 "[ . 1 . 2]" 1
1140 1 60 LYS H 1 60 LYS HA 3.168 2.685 3.651 2.862 2.853 2.867 . 0 0 "[ . 1 . 2]" 1
1141 1 58 THR H 1 58 THR HA 2.900 2.511 3.289 2.936 2.933 2.939 . 0 0 "[ . 1 . 2]" 1
1142 1 67 LEU HA 1 71 VAL H 4.583 3.774 5.392 4.275 4.202 4.328 . 0 0 "[ . 1 . 2]" 1
1143 1 70 TYR HA 1 71 VAL H 4.225 3.525 4.925 3.598 3.589 3.607 . 0 0 "[ . 1 . 2]" 1
1144 1 35 HIS H 1 36 ILE H 3.155 2.664 3.646 2.707 2.653 2.822 0.011 14 0 "[ . 1 . 2]" 1
1145 1 57 GLU H 1 58 THR H 2.175 . 2.431 2.354 2.235 2.448 0.017 12 0 "[ . 1 . 2]" 1
1146 1 62 SER H 1 63 THR H 2.522 2.210 2.834 2.792 2.726 2.852 0.018 7 0 "[ . 1 . 2]" 1
1147 1 70 TYR H 1 71 VAL H 2.470 2.187 2.753 2.713 2.668 2.758 0.005 13 0 "[ . 1 . 2]" 1
1148 1 70 TYR H 1 70 TYR QD 3.828 3.486 4.170 4.006 3.990 4.026 . 0 0 "[ . 1 . 2]" 1
1149 1 31 GLY H 1 32 ARG H 2.626 2.286 2.966 2.550 2.490 2.632 . 0 0 "[ . 1 . 2]" 1
1150 1 58 THR H 1 59 LEU H 1.977 . 2.212 2.021 1.969 2.065 . 0 0 "[ . 1 . 2]" 1
1151 1 14 GLU H 1 15 LYS H 2.225 . 2.478 2.399 2.327 2.463 . 0 0 "[ . 1 . 2]" 1
1152 1 30 LEU H 1 31 GLY H 2.637 2.291 2.983 2.474 2.415 2.508 . 0 0 "[ . 1 . 2]" 1
1153 1 44 LEU H 1 45 LYS H 2.305 2.025 2.585 2.415 2.220 2.584 . 0 0 "[ . 1 . 2]" 1
1154 1 40 ARG H 1 41 GLU H 2.264 2.011 2.517 2.399 2.327 2.458 . 0 0 "[ . 1 . 2]" 1
1155 1 66 GLU H 1 67 LEU H 2.218 . 2.488 2.418 2.390 2.489 0.001 14 0 "[ . 1 . 2]" 1
1156 1 71 VAL H 1 72 THR H 2.348 2.063 2.633 2.611 2.548 2.655 0.022 2 0 "[ . 1 . 2]" 1
1157 1 29 LYS H 1 31 GLY H 4.162 3.490 4.834 3.752 3.544 3.826 . 0 0 "[ . 1 . 2]" 1
1158 1 22 ILE H 1 24 LYS H 3.556 3.060 4.052 3.918 3.893 3.966 . 0 0 "[ . 1 . 2]" 1
1159 1 22 ILE H 1 23 ASN H 2.547 2.228 2.866 2.647 2.602 2.758 . 0 0 "[ . 1 . 2]" 1
1160 1 50 ASP H 1 51 GLU H 2.067 . 2.289 2.351 2.182 2.448 0.159 5 0 "[ . 1 . 2]" 1
1161 1 56 PHE H 1 57 GLU H 2.765 2.375 3.155 2.612 2.547 2.655 . 0 0 "[ . 1 . 2]" 1
1162 1 39 SER H 1 40 ARG H 2.290 2.034 2.546 2.531 2.489 2.556 0.010 18 0 "[ . 1 . 2]" 1
1163 1 70 TYR H 1 70 TYR HA 3.113 2.696 3.530 2.864 2.854 2.876 . 0 0 "[ . 1 . 2]" 1
1164 1 49 PRO QD 1 50 ASP H 3.838 3.319 4.070 2.881 2.813 3.164 0.506 15 1 "[ . 1 + 2]" 1
1165 1 49 PRO HA 1 50 ASP H 3.053 2.631 3.475 3.520 3.421 3.564 0.089 13 0 "[ . 1 . 2]" 1
1166 1 51 GLU H 1 52 ILE HG12 5.570 4.707 6.433 6.239 6.037 6.414 . 0 0 "[ . 1 . 2]" 1
1167 1 53 GLU H 1 53 GLU HB2 2.893 2.455 3.331 2.887 2.696 3.048 . 0 0 "[ . 1 . 2]" 1
1168 1 38 GLN H 1 39 SER H 2.839 2.459 3.219 2.795 2.740 2.829 . 0 0 "[ . 1 . 2]" 1
1169 1 63 THR H 1 65 ARG H 3.985 3.246 4.724 4.019 3.939 4.093 . 0 0 "[ . 1 . 2]" 1
1170 1 12 TYR H 1 12 TYR HA 3.322 2.830 3.814 2.787 2.776 2.803 0.054 1 0 "[ . 1 . 2]" 1
1171 1 9 PRO HB2 1 10 MET H 3.729 3.214 4.244 3.300 3.164 3.439 0.050 15 0 "[ . 1 . 2]" 1
1172 1 23 ASN H 1 24 LYS QG 5.083 4.187 5.979 4.107 4.042 4.267 0.145 15 0 "[ . 1 . 2]" 1
1173 1 38 GLN HA 1 41 GLU H 3.451 2.880 4.022 3.571 3.473 3.720 . 0 0 "[ . 1 . 2]" 1
1174 1 40 ARG HA 1 41 GLU H 3.609 3.073 4.145 3.457 3.417 3.496 . 0 0 "[ . 1 . 2]" 1
1175 1 52 ILE HG13 1 53 GLU H 3.172 2.489 3.855 2.530 2.460 2.631 0.029 11 0 "[ . 1 . 2]" 1
1176 1 54 ILE HB 1 55 ASP H 4.704 3.867 5.541 4.110 4.000 4.263 . 0 0 "[ . 1 . 2]" 1
1177 1 44 LEU QD 1 55 ASP H 4.488 3.685 5.291 2.936 2.736 3.200 0.949 20 19 "[** ***************-+]" 1
1178 1 58 THR H 1 59 LEU QB 5.332 4.695 5.969 4.348 4.297 4.406 0.398 13 0 "[ . 1 . 2]" 1
1179 1 55 ASP QB 1 59 LEU H 6.291 5.497 7.085 4.220 4.035 4.484 1.462 7 20 [**-***+*************] 1
1180 1 66 GLU HB3 1 67 LEU H 3.656 3.099 4.213 3.329 3.081 3.450 0.018 14 0 "[ . 1 . 2]" 1
1181 1 68 GLU HA 1 71 VAL H 3.584 2.950 4.218 3.577 3.455 3.718 . 0 0 "[ . 1 . 2]" 1
1182 1 72 THR H 1 72 THR HA 2.832 2.446 3.218 2.802 2.745 2.829 . 0 0 "[ . 1 . 2]" 1
1183 1 66 GLU H 1 66 GLU QG 3.753 3.374 4.132 2.715 2.468 3.728 0.906 9 17 "[* * ****+-*** ******]" 1
1184 1 17 GLN HE22 1 20 LEU HB2 4.228 3.447 5.009 3.485 3.396 4.128 0.051 3 0 "[ . 1 . 2]" 1
1185 1 17 GLN HE21 1 20 LEU MD1 5.013 4.185 5.841 4.006 3.764 4.102 0.421 18 0 "[ . 1 . 2]" 1
1186 1 17 GLN HA 1 17 GLN HE22 4.662 3.812 5.512 3.891 3.822 3.980 . 0 0 "[ . 1 . 2]" 1
1187 1 25 LEU H 1 25 LEU QD 4.099 3.628 4.570 2.839 2.795 2.878 0.833 16 20 [-**************+****] 1
1188 1 59 LEU QB 1 60 LYS H . 3.241 3.645 2.962 2.922 3.005 0.319 19 0 "[ . 1 . 2]" 1
1189 1 9 PRO HG3 1 10 MET H 5.294 4.633 5.955 5.515 5.438 5.591 . 0 0 "[ . 1 . 2]" 1
1190 1 33 VAL H 1 33 VAL HA 3.210 2.670 3.750 2.817 2.804 2.830 . 0 0 "[ . 1 . 2]" 1
1191 1 22 ILE H 1 71 VAL QG 4.410 3.717 5.103 3.151 3.015 3.190 0.702 2 20 [*+-*****************] 1
1192 1 39 SER HA 1 40 ARG H 3.870 3.268 4.472 3.510 3.486 3.530 . 0 0 "[ . 1 . 2]" 1
1193 1 37 ILE HA 1 40 ARG H 3.380 2.840 3.920 3.630 3.578 3.683 . 0 0 "[ . 1 . 2]" 1
1194 1 40 ARG H 1 40 ARG QD 4.684 4.092 5.276 4.239 4.160 4.316 . 0 0 "[ . 1 . 2]" 1
1195 1 41 GLU H 1 41 GLU QG 3.739 3.298 4.180 2.498 2.355 2.659 0.943 15 20 [*****-********+*****] 1
1196 1 74 CYS HA 1 75 LEU H 3.795 3.196 4.394 3.489 3.467 3.514 . 0 0 "[ . 1 . 2]" 1
1197 1 23 ASN H 1 24 LYS H 2.418 2.128 2.708 2.485 2.386 2.577 . 0 0 "[ . 1 . 2]" 1
1198 1 49 PRO HA 1 51 GLU H 4.004 3.371 4.637 3.945 3.767 4.103 . 0 0 "[ . 1 . 2]" 1
1199 1 17 GLN HA 1 17 GLN HE21 4.740 3.901 5.579 3.856 3.805 3.899 0.096 1 0 "[ . 1 . 2]" 1
1200 1 20 LEU HA 1 23 ASN H 3.936 3.234 4.638 3.146 3.119 3.178 0.115 13 0 "[ . 1 . 2]" 1
1201 1 56 PHE HB3 1 57 GLU H 3.738 3.192 4.284 3.412 3.279 3.596 . 0 0 "[ . 1 . 2]" 1
1202 1 73 SER H 1 73 SER HA 2.489 2.227 2.751 2.848 2.840 2.854 0.103 14 0 "[ . 1 . 2]" 1
1203 1 21 ASP HA 1 23 ASN H 4.374 3.571 5.177 4.392 4.313 4.528 . 0 0 "[ . 1 . 2]" 1
1204 1 22 ILE HA 1 24 LYS H 3.992 3.335 4.649 4.039 3.926 4.139 . 0 0 "[ . 1 . 2]" 1
1205 1 65 ARG H 1 66 GLU H 2.787 2.389 3.185 2.464 2.411 2.520 . 0 0 "[ . 1 . 2]" 1
1206 1 64 LEU HA 1 65 ARG H 3.542 2.980 4.104 3.512 3.488 3.530 . 0 0 "[ . 1 . 2]" 1
1207 1 65 ARG H 1 65 ARG QD . 3.957 4.293 3.359 3.020 3.475 0.937 20 18 "[*** ***-*1*********+]" 1
1208 1 62 SER HA 1 65 ARG H 3.389 2.901 3.877 3.507 3.342 3.636 . 0 0 "[ . 1 . 2]" 1
1209 1 65 ARG H 1 65 ARG HA 2.799 2.388 3.210 2.875 2.864 2.883 . 0 0 "[ . 1 . 2]" 1
1210 1 65 ARG H 1 65 ARG HB2 2.439 2.131 2.747 2.445 2.408 2.522 . 0 0 "[ . 1 . 2]" 1
1211 1 65 ARG H 1 65 ARG HG2 2.319 2.007 2.631 2.463 2.290 2.560 . 0 0 "[ . 1 . 2]" 1
1212 1 64 LEU HG 1 65 ARG H 3.706 3.256 4.156 4.213 4.199 4.226 0.070 11 0 "[ . 1 . 2]" 1
1213 1 11 SER H 1 11 SER QB 3.105 2.676 3.534 2.588 2.519 2.637 0.157 19 0 "[ . 1 . 2]" 1
1214 1 60 LYS H 1 61 PRO HD3 5.371 4.579 6.163 5.100 5.034 5.134 . 0 0 "[ . 1 . 2]" 1
1215 1 58 THR H 1 59 LEU QD 5.355 4.677 6.033 3.690 3.631 3.744 1.046 8 20 [*****-*+************] 1
1216 1 22 ILE HA 1 25 LEU H 4.328 3.708 4.948 3.658 3.610 3.680 0.098 8 0 "[ . 1 . 2]" 1
1217 1 25 LEU H 1 25 LEU HB3 3.172 2.807 3.537 3.553 3.547 3.560 0.023 6 0 "[ . 1 . 2]" 1
1218 1 23 ASN HA 1 25 LEU H 3.695 3.062 4.328 3.773 3.696 3.861 . 0 0 "[ . 1 . 2]" 1
1219 1 67 LEU HA 1 70 TYR H 4.039 3.451 4.627 4.020 3.934 4.107 . 0 0 "[ . 1 . 2]" 1
1220 1 69 ARG HA 1 72 THR H 3.502 2.960 4.044 3.932 3.795 4.012 . 0 0 "[ . 1 . 2]" 1
1221 1 74 CYS H 1 74 CYS HA 3.024 2.621 3.427 2.892 2.878 2.908 . 0 0 "[ . 1 . 2]" 1
1222 1 73 SER HB3 1 74 CYS H 3.312 2.911 3.713 3.745 3.721 3.768 0.055 14 0 "[ . 1 . 2]" 1
1223 1 71 VAL HA 1 74 CYS H 3.194 2.717 3.671 3.043 2.996 3.154 . 0 0 "[ . 1 . 2]" 1
1224 1 11 SER H 1 14 GLU H 4.336 3.773 4.899 4.157 3.985 4.375 . 0 0 "[ . 1 . 2]" 1
1225 1 14 GLU H 1 14 GLU QG 4.042 3.619 4.465 2.961 2.494 3.971 1.125 9 14 "[***** - +** **** *]" 1
1226 1 17 GLN H 1 17 GLN HG3 4.295 3.817 4.773 4.504 4.458 4.567 . 0 0 "[ . 1 . 2]" 1
1227 1 17 GLN H 1 17 GLN HB2 2.572 2.247 2.897 2.543 2.323 2.636 . 0 0 "[ . 1 . 2]" 1
1228 1 17 GLN H 1 17 GLN HB3 2.620 2.316 2.924 2.659 2.567 2.879 . 0 0 "[ . 1 . 2]" 1
1229 1 35 HIS HA 1 39 SER H 3.817 3.210 4.424 3.934 3.823 4.031 . 0 0 "[ . 1 . 2]" 1
1230 1 36 ILE HA 1 39 SER H 3.784 3.193 4.375 3.865 3.799 3.944 . 0 0 "[ . 1 . 2]" 1
1231 1 11 SER H 1 14 GLU QG 3.989 3.382 4.596 3.497 3.285 3.748 0.097 1 0 "[ . 1 . 2]" 1
1232 1 8 LYS H 1 8 LYS HB3 2.197 . 2.461 2.380 2.042 2.798 0.337 10 0 "[ . 1 . 2]" 1
1233 1 41 GLU H 1 41 GLU HA 3.414 2.887 3.941 2.946 2.938 2.950 . 0 0 "[ . 1 . 2]" 1
1234 1 38 GLN H 1 38 GLN HA 2.752 2.378 3.126 2.801 2.788 2.812 . 0 0 "[ . 1 . 2]" 1
1235 1 37 ILE HA 1 38 GLN H 3.179 2.697 3.661 3.607 3.587 3.617 . 0 0 "[ . 1 . 2]" 1
1236 1 35 HIS HA 1 38 GLN H 3.774 3.214 4.334 3.871 3.752 3.985 . 0 0 "[ . 1 . 2]" 1
1237 1 37 ILE H 1 38 GLN H 3.150 2.688 3.612 3.024 2.958 3.073 . 0 0 "[ . 1 . 2]" 1
1238 1 48 ASN HA 1 50 ASP H 4.509 3.837 5.181 4.230 3.842 4.453 . 0 0 "[ . 1 . 2]" 1
1239 1 37 ILE H 1 67 LEU QD 3.157 2.689 3.625 2.726 2.693 2.757 . 0 0 "[ . 1 . 2]" 1
1240 1 37 ILE H 1 37 ILE HB 2.309 . 2.621 2.389 2.374 2.412 . 0 0 "[ . 1 . 2]" 1
1241 1 37 ILE H 1 37 ILE HA 2.465 2.124 2.806 2.745 2.736 2.761 . 0 0 "[ . 1 . 2]" 1
1242 1 38 GLN H 1 38 GLN HG3 2.426 2.088 2.764 2.497 2.442 2.604 . 0 0 "[ . 1 . 2]" 1
1243 1 38 GLN H 1 38 GLN HB3 3.682 3.293 4.071 3.574 3.543 3.589 . 0 0 "[ . 1 . 2]" 1
1244 1 30 LEU HA 1 31 GLY H 3.948 3.239 4.657 3.377 3.343 3.401 . 0 0 "[ . 1 . 2]" 1
1245 1 30 LEU QB 1 31 GLY H . 3.987 4.575 3.148 3.085 3.187 0.902 13 20 [************+******-] 1
1246 1 30 LEU H 1 30 LEU HA 2.796 2.410 3.182 2.866 2.860 2.884 . 0 0 "[ . 1 . 2]" 1
1247 1 30 LEU H 1 30 LEU QB . 3.100 3.271 2.439 2.376 2.482 0.724 7 20 [******+************-] 1
1248 1 18 LEU H 1 18 LEU HA 2.978 2.548 3.408 2.759 2.749 2.771 . 0 0 "[ . 1 . 2]" 1
1249 1 14 GLU HA 1 18 LEU H 4.304 3.578 5.030 3.891 3.774 4.007 . 0 0 "[ . 1 . 2]" 1
1250 1 17 GLN HA 1 18 LEU H 2.918 2.535 3.301 3.481 3.465 3.493 0.192 18 0 "[ . 1 . 2]" 1
1251 1 17 GLN HG3 1 18 LEU H 3.820 3.263 4.377 4.083 3.929 4.395 0.018 18 0 "[ . 1 . 2]" 1
1252 1 17 GLN HB2 1 18 LEU H 3.953 3.473 4.433 3.931 3.713 3.991 . 0 0 "[ . 1 . 2]" 1
1253 1 18 LEU H 1 18 LEU QD . 4.416 4.604 3.240 3.165 3.350 1.251 7 20 [*****-+*************] 1
1254 1 67 LEU HA 1 68 GLU H 3.045 2.639 3.451 3.521 3.503 3.538 0.087 14 0 "[ . 1 . 2]" 1
1255 1 68 GLU H 1 68 GLU HA 2.967 2.535 3.399 2.794 2.781 2.808 . 0 0 "[ . 1 . 2]" 1
1256 1 68 GLU H 1 68 GLU QB . 2.235 2.424 2.204 2.149 2.229 0.086 7 0 "[ . 1 . 2]" 1
1257 1 67 LEU QB 1 68 GLU H 3.962 3.459 4.465 2.429 2.345 2.467 1.114 1 20 [+******************-] 1
1258 1 18 LEU QD 1 68 GLU H 3.261 2.744 3.778 2.448 2.286 2.846 0.458 1 0 "[ . 1 . 2]" 1
1259 1 17 GLN HA 1 21 ASP H 4.723 3.943 5.503 3.909 3.872 3.945 0.071 7 0 "[ . 1 . 2]" 1
1260 1 20 LEU HA 1 21 ASP H 4.005 3.383 4.627 3.631 3.615 3.637 . 0 0 "[ . 1 . 2]" 1
1261 1 21 ASP H 1 21 ASP HA 2.476 2.153 2.799 2.745 2.735 2.765 . 0 0 "[ . 1 . 2]" 1
1262 1 20 LEU HG 1 21 ASP H 4.506 3.922 5.090 4.438 4.405 4.481 . 0 0 "[ . 1 . 2]" 1
1263 1 20 LEU H 1 20 LEU MD2 3.605 3.206 4.004 3.521 3.449 3.577 . 0 0 "[ . 1 . 2]" 1
1264 1 20 LEU H 1 20 LEU HB3 4.128 3.641 4.615 3.587 3.579 3.594 0.062 8 0 "[ . 1 . 2]" 1
1265 1 20 LEU H 1 20 LEU HG 2.489 2.168 2.810 2.448 2.381 2.516 . 0 0 "[ . 1 . 2]" 1
1266 1 20 LEU H 1 20 LEU HB2 2.546 2.187 2.905 2.401 2.378 2.429 . 0 0 "[ . 1 . 2]" 1
1267 1 17 GLN HA 1 20 LEU H 3.612 3.102 4.122 3.290 3.202 3.346 . 0 0 "[ . 1 . 2]" 1
1268 1 20 LEU H 1 20 LEU HA 3.079 2.647 3.511 2.872 2.859 2.885 . 0 0 "[ . 1 . 2]" 1
1269 1 20 LEU H 1 21 ASP H 2.856 2.467 3.245 2.735 2.661 2.793 . 0 0 "[ . 1 . 2]" 1
1270 1 18 LEU HA 1 19 SER H 3.953 3.266 4.640 3.530 3.506 3.548 . 0 0 "[ . 1 . 2]" 1
1271 1 19 SER H 1 19 SER HA 3.011 2.606 3.416 2.787 2.766 2.807 . 0 0 "[ . 1 . 2]" 1
1272 1 18 LEU QB 1 19 SER H 3.105 2.787 3.607 2.496 2.437 2.539 0.350 7 0 "[ . 1 . 2]" 1
1273 1 19 SER H 1 22 ILE MD 3.886 3.301 4.471 3.992 3.804 4.188 . 0 0 "[ . 1 . 2]" 1
1274 1 18 LEU QD 1 19 SER H 5.327 4.551 6.103 3.826 3.629 3.907 0.922 9 20 [********+**********-] 1
1275 1 19 SER H 1 20 LEU HG 4.462 3.753 5.171 4.446 4.313 4.569 . 0 0 "[ . 1 . 2]" 1
1276 1 10 MET QB 1 11 SER H 4.824 4.043 5.605 3.829 3.767 3.866 0.276 20 0 "[ . 1 . 2]" 1
1277 1 10 MET H 1 11 SER H 4.927 4.177 5.677 4.442 4.407 4.494 . 0 0 "[ . 1 . 2]" 1
1278 1 33 VAL QG 1 34 VAL H 4.554 3.777 5.331 2.063 2.008 2.140 1.769 11 20 [-*********+*********] 1
1279 1 33 VAL HB 1 34 VAL H 3.246 2.712 3.780 3.470 3.412 3.532 . 0 0 "[ . 1 . 2]" 1
1280 1 30 LEU HA 1 34 VAL H 4.598 3.738 5.458 4.008 3.918 4.087 . 0 0 "[ . 1 . 2]" 1
1281 1 31 GLY QA 1 34 VAL H 5.717 4.713 6.721 3.676 3.590 4.128 1.123 2 20 [*+***********-******] 1
1282 1 34 VAL H 1 35 HIS HB3 5.448 4.543 6.353 4.732 4.691 4.848 . 0 0 "[ . 1 . 2]" 1
1283 1 34 VAL HB 1 35 HIS H 3.339 2.847 3.831 3.775 2.727 3.860 0.120 14 0 "[ . 1 . 2]" 1
1284 1 35 HIS H 1 35 HIS HB3 2.313 2.038 2.588 2.408 2.374 2.632 0.044 20 0 "[ . 1 . 2]" 1
1285 1 34 VAL HA 1 35 HIS H 3.851 3.171 4.531 3.525 3.506 3.542 . 0 0 "[ . 1 . 2]" 1
1286 1 31 GLY QA 1 35 HIS H 5.167 4.019 6.315 3.923 3.847 4.305 0.172 19 0 "[ . 1 . 2]" 1
1287 1 32 ARG HA 1 35 HIS H 3.596 3.081 4.111 3.434 3.201 3.489 . 0 0 "[ . 1 . 2]" 1
1288 1 35 HIS H 1 35 HIS HA 3.314 2.834 3.794 2.815 2.804 2.826 0.030 20 0 "[ . 1 . 2]" 1
1289 1 38 GLN H 1 38 GLN HB2 2.622 2.247 2.997 2.354 2.279 2.391 . 0 0 "[ . 1 . 2]" 1
1290 1 43 SER H 1 43 SER HA 3.096 2.702 3.490 2.907 2.874 2.933 . 0 0 "[ . 1 . 2]" 1
1291 1 43 SER H 1 43 SER HB2 3.103 2.651 3.555 2.766 2.449 3.594 0.202 10 0 "[ . 1 . 2]" 1
1292 1 42 PRO HG2 1 43 SER H 5.098 4.318 5.878 4.547 3.620 4.841 0.698 17 4 "[ * . 1- . + *2]" 1
1293 1 63 THR HB 1 64 LEU H 2.670 2.234 3.106 2.372 2.336 2.444 . 0 0 "[ . 1 . 2]" 1
1294 1 61 PRO HA 1 64 LEU H 3.522 2.961 4.083 3.797 3.712 3.857 . 0 0 "[ . 1 . 2]" 1
1295 1 64 LEU H 1 64 LEU HA 3.051 2.558 3.544 2.789 2.780 2.797 . 0 0 "[ . 1 . 2]" 1
1296 1 64 LEU H 1 65 ARG H 3.132 2.605 3.659 2.719 2.696 2.755 . 0 0 "[ . 1 . 2]" 1
1297 1 64 LEU H 1 64 LEU QB 3.490 3.070 3.910 2.572 2.559 2.586 0.511 11 7 "[ * * ***+- . 2]" 1
1298 1 64 LEU H 1 64 LEU HG 2.244 . 2.608 1.947 1.921 1.969 . 0 0 "[ . 1 . 2]" 1
1299 1 64 LEU H 1 64 LEU QD 3.939 3.716 4.507 2.698 2.645 2.744 1.071 8 20 [*******+**********-*] 1
1300 1 63 THR MG 1 64 LEU H 4.074 3.510 4.638 3.676 3.635 3.728 . 0 0 "[ . 1 . 2]" 1
1301 1 60 LYS QE 1 63 THR H 5.726 4.989 6.463 4.931 3.780 5.439 1.209 15 1 "[ . 1 + 2]" 1
1302 1 60 LYS HA 1 62 SER H 4.123 3.544 4.702 4.530 4.451 4.616 . 0 0 "[ . 1 . 2]" 1
1303 1 62 SER H 1 62 SER HB3 3.058 2.583 3.533 2.695 2.601 2.817 . 0 0 "[ . 1 . 2]" 1
1304 1 45 LYS HA 1 46 ASN H 3.724 3.078 4.370 3.226 3.163 3.305 . 0 0 "[ . 1 . 2]" 1
1305 1 67 LEU H 1 68 GLU H 3.452 2.801 4.103 2.731 2.707 2.753 0.094 10 0 "[ . 1 . 2]" 1
1306 1 68 GLU H 1 69 ARG H 3.424 2.937 3.911 2.926 2.894 2.986 0.043 13 0 "[ . 1 . 2]" 1
1307 1 69 ARG H 1 69 ARG HB3 2.915 2.482 3.348 2.538 2.507 2.574 . 0 0 "[ . 1 . 2]" 1
1308 1 69 ARG H 1 69 ARG HA 2.797 2.404 3.190 2.788 2.763 2.821 . 0 0 "[ . 1 . 2]" 1
1309 1 66 GLU HA 1 69 ARG H 3.386 2.878 3.894 3.782 3.532 3.908 0.014 7 0 "[ . 1 . 2]" 1
1310 1 69 ARG H 1 69 ARG HB2 2.792 2.372 3.212 2.485 2.436 2.541 . 0 0 "[ . 1 . 2]" 1
1311 1 76 ARG H 1 76 ARG HA 2.378 2.124 2.632 2.801 2.778 2.826 0.194 3 0 "[ . 1 . 2]" 1
1312 1 76 ARG H 1 76 ARG QB 2.381 2.083 2.679 2.464 2.384 2.530 . 0 0 "[ . 1 . 2]" 1
1313 1 76 ARG H 1 76 ARG HG3 2.356 2.051 2.661 2.417 2.213 2.550 . 0 0 "[ . 1 . 2]" 1
1314 1 44 LEU HA 1 45 LYS H 3.533 2.954 4.112 3.018 2.929 3.109 0.025 20 0 "[ . 1 . 2]" 1
1315 1 43 SER HA 1 45 LYS H 4.544 3.728 5.360 4.010 3.877 4.164 . 0 0 "[ . 1 . 2]" 1
1316 1 45 LYS H 1 45 LYS HA 3.284 2.783 3.785 2.880 2.861 2.902 . 0 0 "[ . 1 . 2]" 1
1317 1 45 LYS H 1 45 LYS HB2 4.197 3.669 4.725 3.645 3.621 3.665 0.048 17 0 "[ . 1 . 2]" 1
1318 1 45 LYS H 1 45 LYS HB3 3.144 2.651 3.637 2.816 2.615 3.088 0.036 19 0 "[ . 1 . 2]" 1
1319 1 44 LEU HB3 1 45 LYS H 4.893 4.157 5.629 4.601 4.566 4.637 . 0 0 "[ . 1 . 2]" 1
1320 1 82 GLN H 1 82 GLN HA 3.111 2.691 3.531 2.906 2.785 2.946 . 0 0 "[ . 1 . 2]" 1
1321 1 38 GLN QE 1 52 ILE MD . 3.216 3.718 2.022 1.688 2.154 1.528 6 20 [*****+*******-******] 1
1322 1 38 GLN HB3 1 38 GLN QE 4.725 4.042 5.408 3.830 3.786 4.061 0.256 20 0 "[ . 1 . 2]" 1
1323 1 38 GLN HA 1 38 GLN QE 5.328 4.704 5.572 4.630 4.491 4.719 0.213 20 0 "[ . 1 . 2]" 1
1324 1 23 ASN HB3 1 23 ASN HD22 4.486 3.960 5.012 4.043 3.837 4.072 0.123 5 0 "[ . 1 . 2]" 1
1325 1 48 ASN HB3 1 48 ASN HD21 3.443 2.881 4.005 3.037 2.854 3.389 0.027 3 0 "[ . 1 . 2]" 1
1326 1 3 GLU H 1 3 GLU HB3 2.925 2.565 3.285 2.764 2.499 3.427 0.142 20 0 "[ . 1 . 2]" 1
1327 1 3 GLU H 1 3 GLU HB2 2.494 2.191 2.797 2.386 2.103 2.585 0.088 14 0 "[ . 1 . 2]" 1
1328 1 3 GLU H 1 3 GLU QG 4.509 4.056 4.962 3.893 3.035 4.085 1.021 20 3 "[ . 1 *-. +]" 1
1329 1 1 SER QB 1 3 GLU H 4.715 3.973 5.457 4.556 2.698 4.911 1.275 9 1 "[ . +1 . 2]" 1
1330 1 27 GLY QA 1 29 LYS H 4.317 3.679 4.836 3.853 3.776 3.907 . 0 0 "[ . 1 . 2]" 1
1331 1 26 PRO QD 1 29 LYS H . 5.304 5.691 3.963 3.933 4.031 1.371 16 20 [**-************+****] 1
1332 1 7 CYS H 1 7 CYS HB3 3.207 2.848 3.566 3.053 2.676 3.653 0.172 10 0 "[ . 1 . 2]" 1
1333 1 6 LYS HA 1 7 CYS H 3.070 2.672 3.468 3.238 3.038 3.389 . 0 0 "[ . 1 . 2]" 1
1334 1 44 LEU H 1 44 LEU QD 3.980 3.509 4.451 3.036 2.946 3.202 0.563 2 7 "[ + .* *-* *. * 2]" 1
1335 1 43 SER HB2 1 44 LEU H 4.017 3.409 4.625 3.673 3.017 4.264 0.392 10 0 "[ . 1 . 2]" 1
1336 1 43 SER HA 1 44 LEU H 3.170 2.740 3.600 3.369 3.232 3.491 . 0 0 "[ . 1 . 2]" 1
1337 1 44 LEU H 1 44 LEU HA 3.049 2.623 3.475 2.937 2.924 2.943 . 0 0 "[ . 1 . 2]" 1
1338 1 44 LEU H 1 44 LEU HB3 3.474 2.965 3.983 3.206 3.063 3.366 . 0 0 "[ . 1 . 2]" 1
1339 1 77 LYS H 1 77 LYS HG2 4.671 4.097 5.245 4.136 3.112 4.398 0.985 15 1 "[ . 1 + 2]" 1
1340 1 7 CYS HB3 1 8 LYS H 3.699 3.239 4.159 3.717 3.154 4.021 0.085 20 0 "[ . 1 . 2]" 1
1341 1 7 CYS H 1 7 CYS HA 3.210 2.757 3.663 2.828 2.765 2.935 . 0 0 "[ . 1 . 2]" 1
1342 1 79 ARG H 1 79 ARG HA 2.559 2.173 2.945 2.505 2.245 2.935 . 0 0 "[ . 1 . 2]" 1
1343 1 79 ARG H 1 79 ARG QB 3.272 3.117 3.795 2.914 2.667 3.371 0.450 18 0 "[ . 1 . 2]" 1
1344 1 48 ASN HD21 1 51 GLU QB 5.520 4.719 6.321 4.697 4.418 5.169 0.301 3 0 "[ . 1 . 2]" 1
1345 1 83 ALA H 1 83 ALA HA 2.783 2.432 3.134 2.890 2.299 2.945 0.133 6 0 "[ . 1 . 2]" 1
1346 1 83 ALA H 1 83 ALA MB 3.448 2.885 4.011 2.521 2.237 2.774 0.648 14 5 "[ * - * 1 +.* 2]" 1
1347 1 3 GLU H 1 3 GLU HA 3.245 2.794 3.696 2.841 2.762 2.910 0.032 14 0 "[ . 1 . 2]" 1
1348 1 10 MET H 1 15 LYS QE 3.803 3.189 4.417 3.893 3.684 4.082 . 0 0 "[ . 1 . 2]" 1
1349 1 13 GLU HA 1 14 GLU H 3.630 3.063 4.197 3.407 3.301 3.461 . 0 0 "[ . 1 . 2]" 1
1350 1 11 SER QB 1 14 GLU H 4.721 4.024 5.418 3.302 2.729 3.919 1.295 1 12 "[+ * * *** * ** *-*]" 1
1351 1 14 GLU H 1 15 LYS QG 3.957 3.469 4.445 4.336 4.305 4.357 . 0 0 "[ . 1 . 2]" 1
1352 1 14 GLU H 1 15 LYS QB 5.465 4.799 6.131 4.028 3.872 4.107 0.927 6 20 [*****+*********-****] 1
1353 1 12 TYR QB 1 14 GLU H 5.539 5.298 6.492 4.421 4.321 4.516 0.977 8 20 [*******+*-**********] 1
1354 1 14 GLU QG 1 15 LYS H 4.921 4.308 5.534 3.998 3.682 4.374 0.626 6 3 "[ .+ * 1 - . 2]" 1
1355 1 25 LEU H 1 25 LEU HA 2.429 2.113 2.745 2.768 2.755 2.780 0.035 12 0 "[ . 1 . 2]" 1
1356 1 25 LEU QD 1 29 LYS H 5.901 5.069 6.305 4.448 4.320 4.523 0.749 1 20 [+****-**************] 1
1357 1 34 VAL H 1 35 HIS H 3.189 2.663 3.715 2.657 2.628 2.677 0.035 14 0 "[ . 1 . 2]" 1
1358 1 6 LYS HB3 1 7 CYS H 3.900 3.302 4.498 3.534 3.192 4.052 0.110 6 0 "[ . 1 . 2]" 1
1359 1 6 LYS HB2 1 7 CYS H 4.418 3.855 4.981 4.195 3.817 4.397 0.038 2 0 "[ . 1 . 2]" 1
1360 1 6 LYS HG2 1 7 CYS H 5.029 4.164 5.894 5.042 4.485 5.717 . 0 0 "[ . 1 . 2]" 1
1361 1 38 GLN HB3 1 39 SER H 3.684 3.186 4.182 3.500 3.428 3.567 . 0 0 "[ . 1 . 2]" 1
1362 1 38 GLN HG3 1 39 SER H 4.716 4.033 5.399 4.612 4.569 4.667 . 0 0 "[ . 1 . 2]" 1
1363 1 40 ARG H 1 40 ARG HG2 2.561 2.225 2.897 2.781 2.639 2.915 0.018 15 0 "[ . 1 . 2]" 1
1364 1 62 SER H 1 62 SER HB2 4.126 3.622 4.630 3.584 3.558 3.602 0.064 12 0 "[ . 1 . 2]" 1
1365 1 61 PRO HA 1 62 SER H 4.211 3.521 4.901 3.580 3.567 3.592 . 0 0 "[ . 1 . 2]" 1
1366 1 10 MET QB 1 64 LEU H 5.079 4.280 5.878 4.946 4.878 5.024 . 0 0 "[ . 1 . 2]" 1
1367 1 64 LEU QD 1 65 ARG H 4.648 4.480 5.315 3.820 3.773 3.871 0.707 12 20 [*********-*+********] 1
1368 1 71 VAL HB 1 73 SER H 4.517 3.769 5.265 5.255 5.204 5.312 0.047 11 0 "[ . 1 . 2]" 1
1369 1 69 ARG HG2 1 73 SER H 4.455 3.625 5.285 4.757 4.577 4.881 . 0 0 "[ . 1 . 2]" 1
1370 1 69 ARG HG3 1 73 SER H 5.359 4.473 6.245 6.008 5.859 6.164 . 0 0 "[ . 1 . 2]" 1
1371 1 69 ARG HB2 1 73 SER H 5.629 4.683 6.575 6.468 6.340 6.593 0.018 7 0 "[ . 1 . 2]" 1
1372 1 73 SER HA 1 74 CYS H 3.215 2.794 3.636 3.464 3.443 3.487 . 0 0 "[ . 1 . 2]" 1
1373 1 76 ARG H 1 76 ARG QD 4.396 3.871 4.921 4.044 3.906 4.205 . 0 0 "[ . 1 . 2]" 1
1374 1 75 LEU QB 1 76 ARG H 4.036 3.590 4.482 2.544 2.422 2.786 1.168 11 20 [*********-+*********] 1
1375 1 80 LYS H 1 80 LYS HA 3.371 2.829 3.913 2.870 2.729 2.941 0.100 11 0 "[ . 1 . 2]" 1
1376 1 17 GLN H 1 20 LEU MD1 4.741 4.000 5.482 4.203 4.030 4.299 . 0 0 "[ . 1 . 2]" 1
1377 1 15 LYS H 1 15 LYS QE 5.663 4.803 6.523 4.750 4.697 4.806 0.106 3 0 "[ . 1 . 2]" 1
1378 1 1 SER HA 1 2 GLU H 2.876 2.488 3.264 3.068 2.635 3.270 0.006 19 0 "[ . 1 . 2]" 1
1379 1 2 GLU H 1 2 GLU HA 3.336 2.822 3.850 2.900 2.834 2.929 . 0 0 "[ . 1 . 2]" 1
1380 1 1 SER QB 1 2 GLU H 4.062 3.463 4.661 3.566 2.102 3.849 1.361 9 1 "[ . +1 . 2]" 1
1381 1 2 GLU H 1 2 GLU QG 3.886 3.307 4.465 2.823 2.209 3.340 1.098 9 9 "[ ** *+- *** *]" 1
1382 1 2 GLU H 1 2 GLU QB 2.704 2.298 3.110 2.402 2.231 2.488 0.067 13 0 "[ . 1 . 2]" 1
1383 1 17 GLN HE21 1 20 LEU HB3 4.724 3.935 5.513 4.134 3.984 4.389 . 0 0 "[ . 1 . 2]" 1
1384 1 5 ASP H 1 5 ASP HA 3.120 2.710 3.530 2.905 2.863 2.935 . 0 0 "[ . 1 . 2]" 1
1385 1 2 GLU H 1 3 GLU H 3.067 2.582 3.552 2.495 2.441 2.630 0.141 19 0 "[ . 1 . 2]" 1
1386 1 4 GLU H 1 4 GLU HA 2.744 2.404 3.084 2.832 2.786 2.920 . 0 0 "[ . 1 . 2]" 1
1387 1 1 SER QB 1 4 GLU H 5.996 4.864 7.128 4.999 4.283 5.383 0.581 9 1 "[ . +1 . 2]" 1
1388 1 4 GLU H 1 4 GLU QG 3.542 3.208 3.876 2.201 1.861 3.267 1.347 12 19 "[ *****-****+********]" 1
1389 1 4 GLU H 1 4 GLU QB . 3.287 3.382 2.548 2.411 2.788 0.876 1 19 "[+***-******* *******]" 1
1390 1 5 ASP H 1 6 LYS H 2.678 2.320 3.036 2.385 2.246 2.524 0.074 9 0 "[ . 1 . 2]" 1
1391 1 5 ASP H 1 5 ASP QB 3.839 3.449 4.229 2.458 2.245 2.652 1.204 4 20 [***+*************-**] 1
1392 1 6 LYS H 1 6 LYS HA 3.090 2.668 3.512 2.924 2.870 2.949 . 0 0 "[ . 1 . 2]" 1
1393 1 5 ASP QB 1 6 LYS H 4.479 3.773 4.840 3.559 3.423 3.777 0.350 16 0 "[ . 1 . 2]" 1
1394 1 6 LYS H 1 6 LYS HB3 2.789 2.411 3.167 2.662 2.507 3.376 0.209 14 0 "[ . 1 . 2]" 1
1395 1 6 LYS H 1 6 LYS HB2 2.592 2.269 2.915 2.662 2.260 2.898 0.009 14 0 "[ . 1 . 2]" 1
1396 1 6 LYS H 1 6 LYS HD2 5.122 4.463 5.781 5.364 4.600 6.125 0.344 16 0 "[ . 1 . 2]" 1
1397 1 6 LYS H 1 6 LYS HG2 4.168 3.702 4.634 4.502 3.670 4.730 0.096 1 0 "[ . 1 . 2]" 1
1398 1 6 LYS H 1 6 LYS HG3 4.216 3.746 4.686 4.545 4.423 4.687 0.001 2 0 "[ . 1 . 2]" 1
1399 1 4 GLU HA 1 6 LYS H 3.688 3.175 4.201 3.924 3.477 4.262 0.061 10 0 "[ . 1 . 2]" 1
1400 1 5 ASP HA 1 7 CYS H 3.475 2.981 3.969 3.585 3.185 3.946 . 0 0 "[ . 1 . 2]" 1
1401 1 6 LYS HG3 1 7 CYS H 6.158 5.121 7.195 5.026 4.436 5.900 0.685 6 5 "[* * .+ 1* - . 2]" 1
1402 1 8 LYS H 1 8 LYS QG 3.427 3.038 3.816 3.075 2.056 3.778 0.982 9 8 "[*-* . +1 ** * * 2]" 1
1403 1 8 LYS H 1 65 ARG HE 4.863 4.080 5.646 4.627 4.072 5.695 0.049 20 0 "[ . 1 . 2]" 1
1404 1 7 CYS H 1 8 LYS H 4.070 3.587 4.553 4.532 4.344 4.598 0.045 2 0 "[ . 1 . 2]" 1
1405 1 10 MET H 1 15 LYS QG 5.896 4.925 6.867 4.594 4.452 4.707 0.473 18 0 "[ . 1 . 2]" 1
1406 1 10 MET H 1 61 PRO HA 3.699 3.059 4.339 3.188 3.057 3.413 0.002 3 0 "[ . 1 . 2]" 1
1407 1 10 MET H 1 61 PRO HD3 4.900 4.145 5.655 5.196 5.039 5.328 . 0 0 "[ . 1 . 2]" 1
1408 1 10 MET H 1 15 LYS HA 6.090 5.203 6.977 6.883 6.742 7.022 0.045 20 0 "[ . 1 . 2]" 1
1409 1 11 SER H 1 14 GLU HA 5.344 4.629 6.059 5.458 5.331 5.676 . 0 0 "[ . 1 . 2]" 1
1410 1 11 SER H 1 15 LYS QG 4.488 3.622 5.354 4.185 4.047 4.325 . 0 0 "[ . 1 . 2]" 1
1411 1 12 TYR H 1 13 GLU H 3.386 2.847 3.925 2.921 2.872 2.969 . 0 0 "[ . 1 . 2]" 1
1412 1 13 GLU H 1 14 GLU H 2.752 2.360 3.144 2.567 2.359 2.681 0.001 13 0 "[ . 1 . 2]" 1
1413 1 12 TYR QD 1 13 GLU H 4.106 3.584 4.628 3.462 3.249 3.700 0.335 20 0 "[ . 1 . 2]" 1
1414 1 12 TYR HE1 1 13 GLU H 7.472 5.846 9.098 6.087 5.978 6.256 . 0 0 "[ . 1 . 2]" 1
1415 1 11 SER QB 1 13 GLU H 3.326 2.900 3.752 3.317 3.102 3.521 . 0 0 "[ . 1 . 2]" 1
1416 1 12 TYR HA 1 13 GLU H 3.228 2.811 3.645 3.566 3.548 3.589 . 0 0 "[ . 1 . 2]" 1
1417 1 13 GLU H 1 13 GLU HA 3.029 2.624 3.434 2.822 2.788 2.868 . 0 0 "[ . 1 . 2]" 1
1418 1 13 GLU H 1 14 GLU HA 5.611 4.664 6.558 5.174 4.968 5.278 . 0 0 "[ . 1 . 2]" 1
1419 1 12 TYR QB 1 13 GLU H 2.750 2.340 3.160 2.482 2.385 2.625 . 0 0 "[ . 1 . 2]" 1
1420 1 13 GLU H 1 14 GLU QG . 5.888 6.223 4.780 4.279 5.863 1.609 20 14 "[***** * *** ***- +]" 1
1421 1 13 GLU H 1 16 ARG QB 4.974 4.090 5.858 4.791 4.535 4.995 . 0 0 "[ . 1 . 2]" 1
1422 1 13 GLU H 1 15 LYS QG 5.636 4.544 6.728 5.588 5.491 5.650 . 0 0 "[ . 1 . 2]" 1
1423 1 13 GLU H 1 15 LYS QB 7.111 5.796 8.426 4.875 4.792 4.943 1.004 18 20 [*************-***+**] 1
1424 1 70 TYR H 1 70 TYR QE 6.408 5.405 7.411 5.975 5.956 5.996 . 0 0 "[ . 1 . 2]" 1
1425 1 14 GLU H 1 15 LYS HA 5.552 4.711 6.393 4.986 4.906 5.044 . 0 0 "[ . 1 . 2]" 1
1426 1 12 TYR HA 1 14 GLU H 3.439 2.952 3.926 3.989 3.863 4.056 0.130 10 0 "[ . 1 . 2]" 1
1427 1 15 LYS H 1 16 ARG H 3.516 2.932 4.100 2.929 2.897 2.973 0.035 7 0 "[ . 1 . 2]" 1
1428 1 13 GLU H 1 15 LYS H 5.055 4.210 5.900 4.337 4.192 4.406 0.018 18 0 "[ . 1 . 2]" 1
1429 1 11 SER H 1 15 LYS H 4.556 3.854 5.258 4.210 4.090 4.326 . 0 0 "[ . 1 . 2]" 1
1430 1 15 LYS H 1 56 PHE HZ 6.892 5.498 8.286 6.346 6.248 6.478 . 0 0 "[ . 1 . 2]" 1
1431 1 10 MET HA 1 15 LYS H 4.672 4.024 5.320 5.033 4.927 5.179 . 0 0 "[ . 1 . 2]" 1
1432 1 13 GLU HA 1 15 LYS H 4.630 3.864 5.396 4.726 4.650 4.814 . 0 0 "[ . 1 . 2]" 1
1433 1 15 LYS H 1 64 LEU QD 6.093 5.110 7.076 5.110 5.067 5.169 0.043 3 0 "[ . 1 . 2]" 1
1434 1 13 GLU HA 1 16 ARG H 4.036 3.395 4.677 3.567 3.397 3.718 . 0 0 "[ . 1 . 2]" 1
1435 1 15 LYS HA 1 16 ARG H 4.015 3.324 4.706 3.559 3.542 3.582 . 0 0 "[ . 1 . 2]" 1
1436 1 16 ARG H 1 16 ARG HA 3.049 2.642 3.456 2.802 2.779 2.821 . 0 0 "[ . 1 . 2]" 1
1437 1 16 ARG H 1 16 ARG HG3 4.737 4.156 5.318 4.520 4.390 4.578 . 0 0 "[ . 1 . 2]" 1
1438 1 14 GLU HA 1 16 ARG H 4.414 3.657 5.171 4.575 4.499 4.627 . 0 0 "[ . 1 . 2]" 1
1439 1 17 GLN H 1 18 LEU H 2.671 2.316 3.026 2.545 2.504 2.601 . 0 0 "[ . 1 . 2]" 1
1440 1 13 GLU HA 1 17 GLN H 4.236 3.500 4.972 3.905 3.727 4.048 . 0 0 "[ . 1 . 2]" 1
1441 1 16 ARG HA 1 17 GLN H 3.605 3.090 4.120 3.565 3.553 3.576 . 0 0 "[ . 1 . 2]" 1
1442 1 16 ARG HG3 1 17 GLN H 4.090 3.542 4.638 4.158 3.749 4.509 . 0 0 "[ . 1 . 2]" 1
1443 1 16 ARG H 1 18 LEU H 4.210 3.465 4.955 4.017 3.921 4.099 . 0 0 "[ . 1 . 2]" 1
1444 1 13 GLU HA 1 18 LEU H 5.634 4.626 6.642 6.231 6.068 6.374 . 0 0 "[ . 1 . 2]" 1
1445 1 18 LEU H 1 21 ASP QB 5.367 4.391 6.343 5.361 5.329 5.417 . 0 0 "[ . 1 . 2]" 1
1446 1 17 GLN HB3 1 18 LEU H 3.673 3.037 4.309 2.833 2.783 2.863 0.254 18 0 "[ . 1 . 2]" 1
1447 1 10 MET ME 1 18 LEU H 5.689 4.884 6.494 4.704 4.280 4.943 0.604 8 3 "[ - . + * . 2]" 1
1448 1 18 LEU H 1 20 LEU MD1 4.742 4.002 5.482 5.091 4.998 5.144 . 0 0 "[ . 1 . 2]" 1
1449 1 19 SER H 1 20 LEU MD1 5.531 4.650 6.412 5.235 5.064 5.328 . 0 0 "[ . 1 . 2]" 1
1450 1 19 SER H 1 56 PHE QE 4.776 4.106 5.446 4.256 4.187 4.356 . 0 0 "[ . 1 . 2]" 1
1451 1 19 SER H 1 56 PHE HZ 5.162 4.318 6.006 4.535 4.456 4.629 . 0 0 "[ . 1 . 2]" 1
1452 1 20 LEU H 1 21 ASP QB 5.861 4.937 6.203 4.953 4.897 5.003 0.040 12 0 "[ . 1 . 2]" 1
1453 1 20 LEU H 1 23 ASN HB3 4.681 3.847 5.515 5.027 4.924 5.126 . 0 0 "[ . 1 . 2]" 1
1454 1 18 LEU HA 1 20 LEU H 4.039 3.304 4.774 4.022 3.960 4.106 . 0 0 "[ . 1 . 2]" 1
1455 1 19 SER HA 1 20 LEU H 3.940 3.278 4.602 3.473 3.455 3.496 . 0 0 "[ . 1 . 2]" 1
1456 1 16 ARG HA 1 20 LEU H 3.674 3.152 4.196 4.350 4.295 4.427 0.231 1 0 "[ . 1 . 2]" 1
1457 1 19 SER H 1 20 LEU H 3.012 2.546 3.478 2.606 2.560 2.669 . 0 0 "[ . 1 . 2]" 1
1458 1 19 SER HA 1 21 ASP H 5.197 4.250 6.144 4.938 4.869 4.989 . 0 0 "[ . 1 . 2]" 1
1459 1 21 ASP H 1 22 ILE HA 4.991 4.188 5.794 5.339 5.300 5.375 . 0 0 "[ . 1 . 2]" 1
1460 1 19 SER H 1 21 ASP H 4.353 3.730 4.976 4.441 4.361 4.509 . 0 0 "[ . 1 . 2]" 1
1461 1 22 ILE H 1 22 ILE MG 4.062 3.564 4.560 3.724 3.680 3.740 . 0 0 "[ . 1 . 2]" 1
1462 1 22 ILE H 1 22 ILE HG12 4.396 3.812 4.980 3.766 3.744 3.800 0.068 8 0 "[ . 1 . 2]" 1
1463 1 68 GLU H 1 68 GLU QG 3.918 3.491 4.345 3.923 3.869 3.948 . 0 0 "[ . 1 . 2]" 1
1464 1 22 ILE H 1 23 ASN HB3 5.382 4.580 6.184 4.693 4.581 4.787 . 0 0 "[ . 1 . 2]" 1
1465 1 22 ILE MG 1 23 ASN H 3.783 3.192 4.374 3.289 2.948 3.393 0.244 13 0 "[ . 1 . 2]" 1
1466 1 19 SER HA 1 23 ASN H 4.683 3.841 5.525 4.217 4.145 4.324 . 0 0 "[ . 1 . 2]" 1
1467 1 23 ASN H 1 23 ASN HD21 5.352 4.582 6.122 4.855 4.791 4.981 . 0 0 "[ . 1 . 2]" 1
1468 1 20 LEU HA 1 24 LYS H 4.646 3.733 5.559 4.204 4.070 4.301 . 0 0 "[ . 1 . 2]" 1
1469 1 24 LYS H 1 25 LEU HB3 5.554 4.742 6.366 6.073 6.045 6.116 . 0 0 "[ . 1 . 2]" 1
1470 1 25 LEU H 1 26 PRO QD 4.876 4.474 5.544 4.278 4.246 4.303 0.228 18 0 "[ . 1 . 2]" 1
1471 1 23 ASN HB3 1 25 LEU H 5.087 4.276 5.898 5.581 5.530 5.649 . 0 0 "[ . 1 . 2]" 1
1472 1 24 LYS QG 1 25 LEU H 4.785 4.073 5.497 4.174 4.104 4.282 . 0 0 "[ . 1 . 2]" 1
1473 1 25 LEU H 1 30 LEU QD 3.999 3.389 4.609 3.579 3.502 3.657 . 0 0 "[ . 1 . 2]" 1
1474 1 25 LEU H 1 71 VAL QG 6.297 5.231 7.363 4.292 4.257 4.323 0.974 20 20 [*****-*************+] 1
1475 1 24 LYS H 1 25 LEU H 3.092 2.601 3.583 2.554 2.529 2.602 0.072 8 0 "[ . 1 . 2]" 1
1476 1 26 PRO HA 1 28 GLU H 5.437 4.552 6.322 4.567 4.535 4.641 0.017 15 0 "[ . 1 . 2]" 1
1477 1 28 GLU H 1 29 LYS H 3.299 2.783 3.815 2.774 2.681 2.828 0.102 3 0 "[ . 1 . 2]" 1
1478 1 29 LYS H 1 29 LYS QE . 5.540 6.375 4.633 4.508 4.766 1.032 7 20 [******+********-****] 1
1479 1 29 LYS H 1 29 LYS HG3 4.819 4.223 5.415 4.242 4.190 4.338 0.033 7 0 "[ . 1 . 2]" 1
1480 1 28 GLU QG 1 29 LYS H 3.653 3.056 4.250 3.673 2.909 3.860 0.147 3 0 "[ . 1 . 2]" 1
1481 1 30 LEU H 1 30 LEU HG 3.070 2.650 3.490 3.137 2.772 3.276 . 0 0 "[ . 1 . 2]" 1
1482 1 25 LEU HB3 1 30 LEU H 3.934 3.284 4.584 3.813 3.669 3.859 . 0 0 "[ . 1 . 2]" 1
1483 1 28 GLU HB3 1 30 LEU H 4.834 4.112 5.556 5.060 4.948 5.643 0.087 3 0 "[ . 1 . 2]" 1
1484 1 29 LYS HA 1 31 GLY H 4.146 3.311 4.981 3.516 3.437 3.601 . 0 0 "[ . 1 . 2]" 1
1485 1 28 GLU HA 1 31 GLY H 4.500 3.609 5.391 3.682 3.468 3.842 0.141 3 0 "[ . 1 . 2]" 1
1486 1 30 LEU HG 1 31 GLY H 5.149 4.312 5.986 4.899 4.701 4.991 . 0 0 "[ . 1 . 2]" 1
1487 1 30 LEU H 1 32 ARG H 4.350 3.712 4.988 4.125 4.040 4.218 . 0 0 "[ . 1 . 2]" 1
1488 1 32 ARG H 1 33 VAL H 3.133 2.646 3.620 2.602 2.557 2.628 0.089 20 0 "[ . 1 . 2]" 1
1489 1 32 ARG H 1 70 TYR QD 7.458 6.172 8.744 6.099 5.990 6.153 0.182 14 0 "[ . 1 . 2]" 1
1490 1 32 ARG H 1 33 VAL HA 5.920 4.858 6.982 5.211 5.176 5.235 . 0 0 "[ . 1 . 2]" 1
1491 1 32 ARG H 1 32 ARG QD 6.316 5.460 7.172 4.804 4.551 4.853 0.909 19 20 [-*****************+*] 1
1492 1 32 ARG H 1 32 ARG HG2 4.791 4.205 5.377 4.403 4.338 4.480 . 0 0 "[ . 1 . 2]" 1
1493 1 32 ARG H 1 33 VAL QG 4.007 3.452 4.562 3.354 3.316 3.390 0.136 14 0 "[ . 1 . 2]" 1
1494 1 34 VAL H 1 34 VAL HB 3.128 2.704 3.552 3.601 2.848 3.647 0.095 19 0 "[ . 1 . 2]" 1
1495 1 35 HIS H 1 37 ILE HB 4.572 3.757 5.387 5.236 5.128 5.300 . 0 0 "[ . 1 . 2]" 1
1496 1 35 HIS H 1 36 ILE QG 4.994 4.186 5.802 4.484 4.406 4.612 . 0 0 "[ . 1 . 2]" 1
1497 1 36 ILE H 1 37 ILE H 2.952 2.544 3.360 2.910 2.840 2.952 . 0 0 "[ . 1 . 2]" 1
1498 1 34 VAL H 1 36 ILE H 4.287 3.545 5.029 4.173 4.091 4.290 . 0 0 "[ . 1 . 2]" 1
1499 1 36 ILE H 1 38 GLN H 4.255 3.484 5.026 4.336 4.261 4.402 . 0 0 "[ . 1 . 2]" 1
1500 1 35 HIS HA 1 36 ILE H 4.187 3.482 4.892 3.563 3.546 3.576 . 0 0 "[ . 1 . 2]" 1
1501 1 32 ARG HA 1 36 ILE H 4.289 3.620 4.958 3.996 3.905 4.079 . 0 0 "[ . 1 . 2]" 1
1502 1 33 VAL HA 1 36 ILE H 3.674 3.057 4.291 3.137 3.069 3.249 . 0 0 "[ . 1 . 2]" 1
1503 1 36 ILE MD 1 37 ILE H 4.950 4.272 5.628 4.150 4.110 4.219 0.162 15 0 "[ . 1 . 2]" 1
1504 1 37 ILE H 1 63 THR MG 4.159 3.435 4.883 3.391 3.347 3.434 0.088 17 0 "[ . 1 . 2]" 1
1505 1 37 ILE H 1 63 THR HA 5.169 4.274 6.064 6.089 6.061 6.122 0.058 11 0 "[ . 1 . 2]" 1
1506 1 38 GLN H 1 40 ARG H 4.472 3.672 5.272 4.209 4.111 4.277 . 0 0 "[ . 1 . 2]" 1
1507 1 38 GLN H 1 38 GLN QE 7.014 5.752 8.276 4.911 4.411 5.062 1.341 6 20 [*****+*************-] 1
1508 1 38 GLN H 1 41 GLU H 4.559 3.724 5.394 4.562 4.511 4.614 . 0 0 "[ . 1 . 2]" 1
1509 1 38 GLN H 1 39 SER HA 5.055 4.290 5.820 5.361 5.320 5.387 . 0 0 "[ . 1 . 2]" 1
1510 1 38 GLN H 1 39 SER HB2 6.308 5.361 7.255 6.353 6.305 6.390 . 0 0 "[ . 1 . 2]" 1
1511 1 37 ILE HB 1 38 GLN H 2.687 2.276 3.098 2.585 2.549 2.647 . 0 0 "[ . 1 . 2]" 1
1512 1 38 GLN H 1 63 THR MG 5.772 4.755 6.789 4.749 4.716 4.774 0.039 19 0 "[ . 1 . 2]" 1
1513 1 37 ILE H 1 39 SER H 4.161 3.416 4.906 4.432 4.371 4.484 . 0 0 "[ . 1 . 2]" 1
1514 1 39 SER H 1 40 ARG HG2 4.926 4.209 5.643 4.856 4.628 5.036 . 0 0 "[ . 1 . 2]" 1
1515 1 40 ARG H 1 63 THR MG 4.896 4.112 5.680 3.676 3.633 3.733 0.479 1 0 "[ . 1 . 2]" 1
1516 1 39 SER H 1 41 GLU H 4.433 3.713 5.153 3.818 3.726 3.967 . 0 0 "[ . 1 . 2]" 1
1517 1 39 SER HA 1 41 GLU H 5.137 4.080 6.194 4.255 4.102 4.413 . 0 0 "[ . 1 . 2]" 1
1518 1 41 GLU H 1 42 PRO HD2 5.128 4.315 5.941 4.708 4.618 4.827 . 0 0 "[ . 1 . 2]" 1
1519 1 37 ILE HA 1 41 GLU H 4.687 3.741 5.633 3.800 3.706 3.970 0.035 17 0 "[ . 1 . 2]" 1
1520 1 41 GLU H 1 63 THR MG 5.665 4.690 6.640 3.918 3.739 4.079 0.951 20 20 [*******-***********+] 1
1521 1 41 GLU H 1 41 GLU HB3 4.230 3.691 4.769 3.752 3.700 3.798 . 0 0 "[ . 1 . 2]" 1
1522 1 40 ARG HG2 1 41 GLU H 4.233 3.725 4.741 4.619 4.510 4.691 . 0 0 "[ . 1 . 2]" 1
1523 1 40 ARG QD 1 41 GLU H 6.018 5.079 6.957 5.434 5.283 5.590 . 0 0 "[ . 1 . 2]" 1
1524 1 41 GLU HA 1 43 SER H 3.888 3.235 4.541 3.439 3.301 3.658 . 0 0 "[ . 1 . 2]" 1
1525 1 42 PRO HD2 1 43 SER H 3.990 3.283 4.697 3.274 3.187 3.478 0.096 6 0 "[ . 1 . 2]" 1
1526 1 42 PRO HD3 1 43 SER H 4.505 3.703 5.307 4.150 4.064 4.359 . 0 0 "[ . 1 . 2]" 1
1527 1 42 PRO HB3 1 43 SER H 4.947 4.126 5.768 4.528 4.402 4.656 . 0 0 "[ . 1 . 2]" 1
1528 1 43 SER H 1 44 LEU HB2 5.997 5.066 6.928 5.832 5.628 5.991 . 0 0 "[ . 1 . 2]" 1
1529 1 44 LEU H 1 45 LYS HA 5.232 4.326 6.138 4.502 4.301 4.688 0.025 19 0 "[ . 1 . 2]" 1
1530 1 38 GLN HA 1 44 LEU H 4.454 3.723 5.185 4.159 3.928 4.294 . 0 0 "[ . 1 . 2]" 1
1531 1 41 GLU HA 1 44 LEU H 4.938 4.176 5.700 4.984 4.768 5.282 . 0 0 "[ . 1 . 2]" 1
1532 1 41 GLU QG 1 44 LEU H 6.610 5.515 7.705 5.387 5.157 5.607 0.358 6 0 "[ . 1 . 2]" 1
1533 1 41 GLU HB2 1 44 LEU H 4.226 3.610 4.842 3.785 3.583 4.010 0.027 6 0 "[ . 1 . 2]" 1
1534 1 41 GLU HB3 1 44 LEU H 4.019 3.465 4.573 4.020 3.645 4.314 . 0 0 "[ . 1 . 2]" 1
1535 1 44 LEU H 1 44 LEU HB2 3.639 3.195 4.083 3.780 3.703 3.878 . 0 0 "[ . 1 . 2]" 1
1536 1 45 LYS HB3 1 46 ASN H 5.350 4.310 6.390 4.433 4.229 4.544 0.081 19 0 "[ . 1 . 2]" 1
1537 1 45 LYS HB2 1 46 ASN H 4.845 3.996 5.694 4.290 4.212 4.368 . 0 0 "[ . 1 . 2]" 1
1538 1 46 ASN HA 1 47 SER H 3.963 3.345 4.581 3.442 3.334 3.492 0.011 19 0 "[ . 1 . 2]" 1
1539 1 48 ASN H 1 51 GLU H 4.575 3.805 5.345 4.290 4.124 4.443 . 0 0 "[ . 1 . 2]" 1
1540 1 48 ASN H 1 51 GLU QB 5.122 4.168 5.704 3.551 3.462 3.645 0.706 5 20 [****+*********-*****] 1
1541 1 48 ASN H 1 52 ILE MG 6.322 5.047 7.597 6.226 6.070 6.365 . 0 0 "[ . 1 . 2]" 1
1542 1 50 ASP H 1 51 GLU QB 4.922 4.168 5.676 4.262 4.036 4.492 0.132 10 0 "[ . 1 . 2]" 1
1543 1 48 ASN HD22 1 50 ASP H 6.024 5.022 7.026 5.855 5.157 6.403 . 0 0 "[ . 1 . 2]" 1
1544 1 51 GLU H 1 52 ILE HG13 5.776 4.799 6.753 6.350 6.176 6.559 . 0 0 "[ . 1 . 2]" 1
1545 1 49 PRO QD 1 51 GLU H 5.617 4.706 6.528 4.406 4.340 4.482 0.366 14 0 "[ . 1 . 2]" 1
1546 1 48 ASN HA 1 51 GLU H 5.781 4.671 6.891 4.648 4.596 4.710 0.075 12 0 "[ . 1 . 2]" 1
1547 1 56 PHE H 1 56 PHE QE 7.240 5.897 8.583 5.774 5.705 5.848 0.192 9 0 "[ . 1 . 2]" 1
1548 1 57 GLU H 2 2 TRP HB3 5.505 4.514 6.496 5.325 4.797 5.746 . 0 0 "[ . 1 . 2]" 1
1549 1 57 GLU H 1 58 THR HA 5.477 4.643 6.311 4.944 4.834 5.034 . 0 0 "[ . 1 . 2]" 1
1550 1 57 GLU HG3 1 58 THR H 5.460 4.816 6.104 5.457 5.364 5.538 . 0 0 "[ . 1 . 2]" 1
1551 1 59 LEU H 1 59 LEU HA 2.664 2.283 3.045 2.827 2.803 2.859 . 0 0 "[ . 1 . 2]" 1
1552 1 57 GLU HA 1 59 LEU H 4.325 3.638 5.012 4.118 3.971 4.263 . 0 0 "[ . 1 . 2]" 1
1553 1 59 LEU H 1 64 LEU QD 5.142 4.119 6.165 3.350 3.327 3.391 0.792 19 20 [*****************-+*] 1
1554 1 59 LEU HA 1 60 LYS H 2.392 2.074 2.710 2.180 2.156 2.209 . 0 0 "[ . 1 . 2]" 1
1555 1 60 LYS H 1 61 PRO HD2 5.509 4.690 6.328 4.859 4.838 4.882 . 0 0 "[ . 1 . 2]" 1
1556 1 60 LYS H 1 63 THR HA 6.198 5.218 7.178 5.919 5.869 6.048 . 0 0 "[ . 1 . 2]" 1
1557 1 60 LYS H 1 60 LYS QE 5.235 4.419 6.051 4.141 3.982 4.460 0.437 18 0 "[ . 1 . 2]" 1
1558 1 59 LEU QD 1 60 LYS H 4.832 4.175 5.489 3.716 3.693 3.762 0.482 19 0 "[ . 1 . 2]" 1
1559 1 60 LYS H 1 64 LEU QD 5.265 4.179 6.351 4.070 4.010 4.107 0.169 6 0 "[ . 1 . 2]" 1
1560 1 62 SER H 1 62 SER HA 3.025 2.619 3.431 2.788 2.768 2.808 . 0 0 "[ . 1 . 2]" 1
1561 1 62 SER H 1 63 THR HA 5.557 4.582 6.532 5.384 5.325 5.428 . 0 0 "[ . 1 . 2]" 1
1562 1 61 PRO HG3 1 62 SER H 5.142 4.389 5.895 4.658 4.623 4.704 . 0 0 "[ . 1 . 2]" 1
1563 1 60 LYS HB2 1 62 SER H 4.111 3.357 4.865 3.727 3.666 3.844 . 0 0 "[ . 1 . 2]" 1
1564 1 60 LYS HD3 1 62 SER H 5.027 4.105 5.949 4.318 4.050 5.037 0.055 7 0 "[ . 1 . 2]" 1
1565 1 61 PRO HA 1 63 THR H 4.854 3.804 5.904 4.599 4.486 4.662 . 0 0 "[ . 1 . 2]" 1
1566 1 62 SER HB3 1 63 THR H 4.358 3.640 5.076 4.044 3.910 4.181 . 0 0 "[ . 1 . 2]" 1
1567 1 61 PRO HG3 1 63 THR H 5.714 4.780 6.648 6.685 6.602 6.743 0.095 6 0 "[ . 1 . 2]" 1
1568 1 59 LEU QB 1 63 THR H . 4.622 5.182 4.414 4.374 4.461 0.248 15 0 "[ . 1 . 2]" 1
1569 1 63 THR H 1 64 LEU QD 5.968 5.051 6.885 4.057 3.976 4.137 1.075 8 20 [*******+**********-*] 1
1570 1 62 SER H 1 64 LEU H 4.738 3.820 5.656 4.355 4.283 4.428 . 0 0 "[ . 1 . 2]" 1
1571 1 63 THR HB 1 65 ARG H 5.179 4.327 6.031 4.819 4.747 4.877 . 0 0 "[ . 1 . 2]" 1
1572 1 65 ARG H 1 66 GLU QG 5.732 4.902 6.562 4.483 4.148 5.776 0.754 9 13 "[* * .***+1**- **** 2]" 1
1573 1 65 ARG H 1 65 ARG HB3 3.291 2.978 3.604 3.612 3.602 3.622 0.018 16 0 "[ . 1 . 2]" 1
1574 1 64 LEU QD 1 66 GLU H 6.080 5.047 7.113 5.293 5.260 5.327 . 0 0 "[ . 1 . 2]" 1
1575 1 66 GLU H 1 67 LEU QD 5.843 5.033 6.807 4.061 4.035 4.090 0.998 4 20 [***+*********-******] 1
1576 1 36 ILE MG 1 66 GLU H 4.647 4.001 5.293 4.334 4.225 4.402 . 0 0 "[ . 1 . 2]" 1
1577 1 63 THR MG 1 66 GLU H 4.731 3.975 5.487 4.489 4.357 4.574 . 0 0 "[ . 1 . 2]" 1
1578 1 66 GLU H 1 67 LEU QB 5.990 5.103 6.877 4.459 4.400 4.589 0.703 9 20 [********+****-******] 1
1579 1 64 LEU HG 1 66 GLU H 4.929 4.197 5.661 5.700 5.662 5.742 0.081 14 0 "[ . 1 . 2]" 1
1580 1 66 GLU H 1 66 GLU HB3 3.560 3.219 3.901 3.547 3.473 3.569 . 0 0 "[ . 1 . 2]" 1
1581 1 65 ARG HB3 1 66 GLU H 3.735 3.270 4.200 3.975 3.923 4.058 . 0 0 "[ . 1 . 2]" 1
1582 1 65 ARG QD 1 66 GLU H 4.962 4.624 5.736 4.761 4.657 4.844 . 0 0 "[ . 1 . 2]" 1
1583 1 62 SER HA 1 66 GLU H 3.916 3.295 4.537 4.214 4.047 4.302 . 0 0 "[ . 1 . 2]" 1
1584 1 66 GLU H 1 68 GLU H 3.718 3.143 4.293 3.849 3.773 3.982 . 0 0 "[ . 1 . 2]" 1
1585 1 63 THR H 1 66 GLU H 4.698 3.775 5.621 4.607 4.559 4.667 . 0 0 "[ . 1 . 2]" 1
1586 1 63 THR HB 1 66 GLU H 5.326 4.286 6.366 5.180 5.145 5.204 . 0 0 "[ . 1 . 2]" 1
1587 1 62 SER HB3 1 65 ARG H 5.432 4.536 6.328 5.723 5.578 5.835 . 0 0 "[ . 1 . 2]" 1
1588 1 62 SER HB3 1 66 GLU H 6.125 4.987 7.263 6.161 5.980 6.266 . 0 0 "[ . 1 . 2]" 1
1589 1 62 SER HB2 1 66 GLU H 5.034 4.038 6.030 5.129 4.931 5.230 . 0 0 "[ . 1 . 2]" 1
1590 1 62 SER HB2 1 65 ARG H 5.407 4.409 6.405 5.362 5.233 5.421 . 0 0 "[ . 1 . 2]" 1
1591 1 66 GLU HB2 1 67 LEU H 2.804 2.345 3.263 2.514 2.440 2.730 . 0 0 "[ . 1 . 2]" 1
1592 1 36 ILE MD 1 67 LEU H 4.579 3.650 5.508 3.762 3.632 3.819 0.018 4 0 "[ . 1 . 2]" 1
1593 1 36 ILE MD 1 66 GLU H 6.536 5.338 7.734 5.103 4.961 5.175 0.377 4 0 "[ . 1 . 2]" 1
1594 1 66 GLU HA 1 67 LEU H 3.702 3.114 4.290 3.520 3.511 3.528 . 0 0 "[ . 1 . 2]" 1
1595 1 10 MET ME 1 68 GLU H 4.504 3.823 5.185 3.655 3.425 3.911 0.398 12 0 "[ . 1 . 2]" 1
1596 1 65 ARG QD 1 68 GLU H 6.226 5.163 6.642 4.707 4.572 4.847 0.591 14 7 "[ . * - +**** 2]" 1
1597 1 68 GLU H 1 69 ARG HA 5.609 4.709 6.509 5.485 5.432 5.537 . 0 0 "[ . 1 . 2]" 1
1598 1 68 GLU HA 1 69 ARG H 3.582 3.100 4.064 3.566 3.550 3.590 . 0 0 "[ . 1 . 2]" 1
1599 1 68 GLU QG 1 69 ARG H 3.837 3.257 4.417 3.417 3.069 3.670 0.188 8 0 "[ . 1 . 2]" 1
1600 1 69 ARG H 1 69 ARG HG2 5.243 4.468 6.018 4.405 4.391 4.418 0.077 19 0 "[ . 1 . 2]" 1
1601 1 69 ARG H 1 71 VAL QG 5.671 4.582 6.760 4.473 4.369 4.587 0.213 1 0 "[ . 1 . 2]" 1
1602 1 18 LEU QD 1 69 ARG H 6.472 5.503 7.441 4.080 3.969 4.273 1.534 1 20 [+******-************] 1
1603 1 70 TYR H 1 73 SER H 5.292 4.165 6.419 4.590 4.481 4.706 . 0 0 "[ . 1 . 2]" 1
1604 1 66 GLU HA 1 70 TYR H 3.727 3.147 4.307 4.227 4.012 4.331 0.024 12 0 "[ . 1 . 2]" 1
1605 1 68 GLU HA 1 70 TYR H 4.139 3.344 4.934 3.943 3.868 3.986 . 0 0 "[ . 1 . 2]" 1
1606 1 69 ARG HD2 1 70 TYR H 5.046 4.373 5.719 5.837 5.764 5.943 0.224 20 0 "[ . 1 . 2]" 1
1607 1 68 GLU QG 1 70 TYR H 5.075 4.233 5.223 4.830 4.525 5.034 . 0 0 "[ . 1 . 2]" 1
1608 1 69 ARG HB3 1 70 TYR H 2.969 2.525 3.413 2.924 2.863 2.984 . 0 0 "[ . 1 . 2]" 1
1609 1 69 ARG HB2 1 70 TYR H 4.015 3.518 4.512 4.018 3.975 4.082 . 0 0 "[ . 1 . 2]" 1
1610 1 69 ARG HG2 1 70 TYR H 4.258 3.599 4.917 4.054 3.950 4.152 . 0 0 "[ . 1 . 2]" 1
1611 1 67 LEU QB 1 70 TYR H 5.798 4.687 6.909 4.930 4.898 4.973 . 0 0 "[ . 1 . 2]" 1
1612 1 70 TYR H 1 71 VAL QG 4.576 3.925 5.227 3.626 3.585 3.668 0.340 17 0 "[ . 1 . 2]" 1
1613 1 36 ILE MG 1 70 TYR H 5.860 4.665 7.055 6.279 6.116 6.373 . 0 0 "[ . 1 . 2]" 1
1614 1 70 TYR H 1 72 THR H 3.780 3.169 4.391 3.909 3.787 4.004 . 0 0 "[ . 1 . 2]" 1
1615 1 70 TYR QD 1 72 THR H 6.270 5.186 7.354 5.145 5.032 5.201 0.154 11 0 "[ . 1 . 2]" 1
1616 1 72 THR H 1 75 LEU HG 4.240 3.467 5.013 4.661 4.568 4.707 . 0 0 "[ . 1 . 2]" 1
1617 1 70 TYR QB 1 72 THR H 5.324 4.426 6.222 4.621 4.526 4.701 . 0 0 "[ . 1 . 2]" 1
1618 1 70 TYR HA 1 72 THR H 4.262 3.548 4.976 4.569 4.492 4.626 . 0 0 "[ . 1 . 2]" 1
1619 1 71 VAL QG 1 73 SER H 5.036 4.194 5.878 3.975 3.932 3.994 0.262 3 0 "[ . 1 . 2]" 1
1620 1 73 SER H 1 74 CYS QB 4.948 4.263 5.633 4.193 4.152 4.238 0.111 7 0 "[ . 1 . 2]" 1
1621 1 70 TYR QB 1 73 SER H 6.035 4.947 7.123 4.897 4.833 4.941 0.114 1 0 "[ . 1 . 2]" 1
1622 1 73 SER H 1 74 CYS HA 4.467 3.911 5.023 5.095 5.080 5.112 0.089 20 0 "[ . 1 . 2]" 1
1623 1 70 TYR HA 1 73 SER H 3.759 3.159 4.359 3.574 3.481 3.646 . 0 0 "[ . 1 . 2]" 1
1624 1 70 TYR QD 1 73 SER H 5.927 4.868 6.986 4.909 4.808 4.966 0.060 11 0 "[ . 1 . 2]" 1
1625 1 71 VAL H 1 74 CYS H 5.443 4.360 6.526 4.807 4.723 4.901 . 0 0 "[ . 1 . 2]" 1
1626 1 72 THR H 1 74 CYS H 4.366 3.646 5.086 4.028 3.982 4.112 . 0 0 "[ . 1 . 2]" 1
1627 1 70 TYR QD 1 74 CYS H 5.849 4.804 6.894 4.992 4.827 5.113 . 0 0 "[ . 1 . 2]" 1
1628 1 70 TYR QE 1 74 CYS H 6.726 5.379 8.073 5.252 5.085 5.389 0.294 15 0 "[ . 1 . 2]" 1
1629 1 72 THR HA 1 74 CYS H 3.952 3.311 4.593 3.998 3.887 4.163 . 0 0 "[ . 1 . 2]" 1
1630 1 71 VAL HB 1 74 CYS H 5.450 4.434 6.466 4.722 4.651 4.836 . 0 0 "[ . 1 . 2]" 1
1631 1 74 CYS H 1 75 LEU QB 6.026 5.227 6.825 4.455 4.362 4.570 0.865 9 20 [**-*****+***********] 1
1632 1 72 THR MG 1 74 CYS H 5.337 4.451 6.223 4.409 4.318 4.591 0.133 6 0 "[ . 1 . 2]" 1
1633 1 71 VAL QG 1 74 CYS H 5.332 4.467 6.197 4.273 4.239 4.358 0.228 3 0 "[ . 1 . 2]" 1
1634 1 72 THR MG 1 75 LEU H 5.080 4.205 5.955 4.984 4.843 5.045 . 0 0 "[ . 1 . 2]" 1
1635 1 71 VAL QG 1 75 LEU H 6.178 5.128 7.228 4.357 4.284 4.436 0.844 11 20 [**********+****-****] 1
1636 1 75 LEU H 1 76 ARG QB 4.510 3.799 5.221 4.671 4.526 4.745 . 0 0 "[ . 1 . 2]" 1
1637 1 71 VAL HA 1 75 LEU H 3.954 3.342 4.566 3.843 3.790 3.934 . 0 0 "[ . 1 . 2]" 1
1638 1 73 SER HB3 1 75 LEU H 5.516 4.679 6.353 5.724 5.665 5.778 . 0 0 "[ . 1 . 2]" 1
1639 1 74 CYS H 1 75 LEU H 2.312 2.017 2.607 2.305 2.212 2.395 . 0 0 "[ . 1 . 2]" 1
1640 1 72 THR H 1 75 LEU H 5.164 4.117 6.211 4.597 4.558 4.635 . 0 0 "[ . 1 . 2]" 1
1641 1 74 CYS HA 1 76 ARG H 4.329 3.612 5.046 4.841 4.589 5.013 . 0 0 "[ . 1 . 2]" 1
1642 1 73 SER HB3 1 76 ARG H 5.378 4.482 6.274 6.110 5.943 6.217 . 0 0 "[ . 1 . 2]" 1
1643 1 74 CYS QB 1 76 ARG H 5.611 5.098 6.563 4.871 4.767 4.959 0.331 10 0 "[ . 1 . 2]" 1
1644 1 72 THR MG 1 76 ARG H 4.471 3.800 5.142 4.420 3.822 4.644 . 0 0 "[ . 1 . 2]" 1
1645 1 74 CYS H 1 76 ARG H 3.733 3.189 4.277 3.994 3.900 4.139 . 0 0 "[ . 1 . 2]" 1
1646 1 77 LYS H 1 78 LYS H 4.607 3.947 5.267 3.904 3.594 4.461 0.353 12 0 "[ . 1 . 2]" 1
1647 1 76 ARG H 1 77 LYS H 3.013 2.605 3.421 2.635 2.564 2.757 0.041 3 0 "[ . 1 . 2]" 1
1648 1 77 LYS H 1 77 LYS HD2 4.190 3.667 4.713 4.535 4.067 5.435 0.722 15 2 "[ . -1 + 2]" 1
1649 1 76 ARG QD 1 77 LYS H 6.069 5.110 7.028 4.987 4.843 5.503 0.267 11 0 "[ . 1 . 2]" 1
1650 1 77 LYS H 1 77 LYS QE 7.541 6.291 8.791 5.280 4.840 5.671 1.451 12 20 [***********+*******-] 1
1651 1 74 CYS HA 1 77 LYS H 4.987 3.917 6.057 4.004 3.812 4.347 0.105 15 0 "[ . 1 . 2]" 1
1652 1 72 THR HA 1 77 LYS H 6.734 5.427 8.041 5.569 5.319 5.882 0.108 4 0 "[ . 1 . 2]" 1
1653 1 79 ARG H 1 79 ARG QG 4.986 4.356 5.616 4.225 2.747 4.518 1.609 16 2 "[ . - 1 .+ 2]" 1
1654 1 79 ARG QB 1 80 LYS H 3.918 3.425 4.411 3.935 2.922 4.020 0.503 7 1 "[ . + 1 . 2]" 1
1655 1 79 ARG QG 1 80 LYS H 6.148 5.221 7.075 4.097 3.747 4.870 1.474 17 19 "[******-******** +***]" 1
1656 1 78 LYS HG3 1 80 LYS H 4.595 3.818 5.372 4.549 3.771 5.501 0.129 4 0 "[ . 1 . 2]" 1
1657 1 81 PRO QG 1 83 ALA H 6.776 5.730 7.822 5.638 4.385 6.908 1.345 7 4 "[ . + 1 * -. * 2]" 1
1658 1 60 LYS H 1 63 THR H 4.936 4.197 5.675 4.176 4.161 4.192 0.036 10 0 "[ . 1 . 2]" 1
1659 1 59 LEU H 1 60 LYS H 5.221 4.346 6.096 4.582 4.556 4.611 . 0 0 "[ . 1 . 2]" 1
1660 1 60 LYS H 1 64 LEU H 5.613 4.513 6.713 4.767 4.730 4.797 . 0 0 "[ . 1 . 2]" 1
1661 1 36 ILE MD 1 71 VAL H 5.511 4.524 6.498 5.185 5.035 5.265 . 0 0 "[ . 1 . 2]" 1
1662 1 71 VAL H 1 73 SER HB3 4.895 4.025 5.765 5.323 5.261 5.429 . 0 0 "[ . 1 . 2]" 1
1663 1 71 VAL H 1 73 SER H 4.251 3.495 5.007 3.918 3.867 3.971 . 0 0 "[ . 1 . 2]" 1
1664 1 17 GLN HE22 1 20 LEU HB3 4.367 3.536 5.198 3.613 3.509 4.310 0.027 4 0 "[ . 1 . 2]" 1
1665 1 48 ASN HD22 1 51 GLU QB 7.282 5.958 8.606 5.938 5.739 6.118 0.219 17 0 "[ . 1 . 2]" 1
1666 1 48 ASN HD21 1 50 ASP QB 5.022 3.935 6.109 5.620 4.469 6.002 . 0 0 "[ . 1 . 2]" 1
1667 1 48 ASN HD22 1 50 ASP QB 5.522 4.527 6.517 5.865 4.586 6.323 . 0 0 "[ . 1 . 2]" 1
1668 1 45 LYS QG 1 46 ASN QD 6.443 5.385 7.032 3.936 3.507 4.467 1.878 7 20 [******+***********-*] 1
1669 1 44 LEU QD 1 46 ASN QD 6.171 6.047 7.185 4.827 4.185 5.183 1.862 19 20 [*************-****+*] 1
1670 1 45 LYS QD 1 46 ASN QD 6.530 5.428 7.632 5.473 4.831 6.272 0.597 6 2 "[ .+- 1 . 2]" 1
1671 1 20 LEU MD2 1 23 ASN HD22 3.825 3.079 4.571 3.964 3.514 4.103 . 0 0 "[ . 1 . 2]" 1
1672 1 20 LEU MD2 1 23 ASN HD21 4.524 3.719 5.329 4.838 4.134 4.932 . 0 0 "[ . 1 . 2]" 1
1673 1 20 LEU HA 1 23 ASN HD22 5.083 3.994 6.172 4.458 4.273 4.610 . 0 0 "[ . 1 . 2]" 1
1674 1 15 LYS H 1 15 LYS QD 4.255 3.760 4.750 4.050 4.005 4.083 . 0 0 "[ . 1 . 2]" 1
1675 1 16 ARG H 1 16 ARG HG2 4.600 4.003 5.197 4.234 4.080 4.331 . 0 0 "[ . 1 . 2]" 1
1676 1 72 THR MG 1 77 LYS H 5.579 4.582 6.576 5.698 5.000 6.064 . 0 0 "[ . 1 . 2]" 1
1677 1 57 GLU H 1 59 LEU QD 5.804 5.153 6.765 4.417 4.335 4.451 0.818 8 20 [*******+******-*****] 1
1678 1 22 ILE MD 1 23 ASN H 5.396 4.564 6.228 4.648 4.566 4.724 . 0 0 "[ . 1 . 2]" 1
1679 1 12 TYR QE 1 20 LEU QD 5.434 4.683 6.185 6.258 6.138 6.342 0.157 1 0 "[ . 1 . 2]" 1
1680 1 33 VAL QG 2 11 TYR QE 5.017 2.694 7.340 3.282 3.188 3.404 . 0 0 "[ . 1 . 2]" 1
1681 1 16 ARG HA 1 18 LEU QD 4.309 . 7.129 5.350 5.229 5.468 . 0 0 "[ . 1 . 2]" 1
1682 1 16 ARG HA 1 20 LEU QD 3.733 2.140 5.326 4.340 4.198 4.462 . 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 94
_Distance_constraint_stats_list.Viol_count 367
_Distance_constraint_stats_list.Viol_total 371.846
_Distance_constraint_stats_list.Viol_max 0.235
_Distance_constraint_stats_list.Viol_rms 0.0270
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0099
_Distance_constraint_stats_list.Viol_average_violations_only 0.0507
_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 2 GLU 0.250 0.078 6 0 "[ . 1 . 2]"
1 6 LYS 0.250 0.078 6 0 "[ . 1 . 2]"
1 11 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 GLU 0.765 0.077 17 0 "[ . 1 . 2]"
1 14 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 LYS 0.068 0.029 8 0 "[ . 1 . 2]"
1 16 ARG 0.485 0.073 5 0 "[ . 1 . 2]"
1 17 GLN 0.765 0.077 17 0 "[ . 1 . 2]"
1 18 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 SER 0.013 0.009 15 0 "[ . 1 . 2]"
1 20 LEU 0.485 0.073 5 0 "[ . 1 . 2]"
1 21 ASP 2.145 0.101 8 0 "[ . 1 . 2]"
1 22 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 ASN 0.013 0.009 15 0 "[ . 1 . 2]"
1 24 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 LEU 2.145 0.101 8 0 "[ . 1 . 2]"
1 26 PRO 0.780 0.059 13 0 "[ . 1 . 2]"
1 27 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 GLU 1.093 0.100 6 0 "[ . 1 . 2]"
1 29 LYS 0.034 0.029 20 0 "[ . 1 . 2]"
1 30 LEU 0.790 0.059 13 0 "[ . 1 . 2]"
1 31 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 ARG 1.093 0.100 6 0 "[ . 1 . 2]"
1 33 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 VAL 0.010 0.010 14 0 "[ . 1 . 2]"
1 35 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 GLU 0.402 0.123 12 0 "[ . 1 . 2]"
1 47 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ASP 3.469 0.108 15 0 "[ . 1 . 2]"
1 57 GLU 0.068 0.029 8 0 "[ . 1 . 2]"
1 58 THR 0.933 0.105 19 0 "[ . 1 . 2]"
1 59 LEU 2.536 0.108 15 0 "[ . 1 . 2]"
1 60 LYS 1.234 0.123 12 0 "[ . 1 . 2]"
1 61 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 LEU 1.049 0.052 20 0 "[ . 1 . 2]"
1 65 ARG 0.229 0.066 12 0 "[ . 1 . 2]"
1 66 GLU 0.379 0.047 3 0 "[ . 1 . 2]"
1 67 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 GLU 0.217 0.036 8 0 "[ . 1 . 2]"
1 69 ARG 1.106 0.106 20 0 "[ . 1 . 2]"
1 70 TYR 0.379 0.047 3 0 "[ . 1 . 2]"
1 71 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 SER 0.877 0.106 20 0 "[ . 1 . 2]"
1 74 CYS 0.034 0.029 20 0 "[ . 1 . 2]"
1 75 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
2 4 LEU 0.794 0.151 7 0 "[ . 1 . 2]"
2 5 GLU 3.355 0.235 10 0 "[ . 1 . 2]"
2 6 ARG 2.232 0.219 7 0 "[ . 1 . 2]"
2 7 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 8 LYS 0.956 0.151 7 0 "[ . 1 . 2]"
2 9 ARG 3.355 0.235 10 0 "[ . 1 . 2]"
2 10 LYS 2.232 0.219 7 0 "[ . 1 . 2]"
2 11 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
2 12 ARG 0.162 0.042 11 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 11 SER O 1 15 LYS H 1.800 . 2.300 1.684 1.611 1.737 . 0 0 "[ . 1 . 2]" 2
2 1 11 SER O 1 15 LYS N 2.800 2.300 3.300 2.659 2.584 2.712 . 0 0 "[ . 1 . 2]" 2
3 1 12 TYR O 1 16 ARG H 1.800 . 2.300 1.782 1.675 1.856 . 0 0 "[ . 1 . 2]" 2
4 1 12 TYR O 1 16 ARG N 2.800 2.300 3.300 2.765 2.659 2.842 . 0 0 "[ . 1 . 2]" 2
5 1 13 GLU O 1 17 GLN H 1.800 . 2.300 2.329 2.158 2.377 0.077 17 0 "[ . 1 . 2]" 2
6 1 13 GLU O 1 17 GLN N 2.800 2.300 3.300 3.209 3.048 3.274 . 0 0 "[ . 1 . 2]" 2
7 1 14 GLU O 1 18 LEU H 1.800 . 2.300 1.793 1.713 1.981 . 0 0 "[ . 1 . 2]" 2
8 1 14 GLU O 1 18 LEU N 2.800 2.300 3.300 2.661 2.607 2.843 . 0 0 "[ . 1 . 2]" 2
9 1 15 LYS O 1 19 SER H 1.800 . 2.300 1.851 1.798 1.907 . 0 0 "[ . 1 . 2]" 2
10 1 15 LYS O 1 19 SER N 2.800 2.300 3.300 2.810 2.742 2.873 . 0 0 "[ . 1 . 2]" 2
11 1 16 ARG O 1 20 LEU H 1.800 . 2.300 2.308 2.200 2.373 0.073 5 0 "[ . 1 . 2]" 2
12 1 16 ARG O 1 20 LEU N 2.800 2.300 3.300 3.153 3.015 3.227 . 0 0 "[ . 1 . 2]" 2
13 1 17 GLN O 1 21 ASP H 1.800 . 2.300 1.656 1.625 1.697 . 0 0 "[ . 1 . 2]" 2
14 1 17 GLN O 1 21 ASP N 2.800 2.300 3.300 2.617 2.581 2.660 . 0 0 "[ . 1 . 2]" 2
15 1 18 LEU O 1 22 ILE H 1.800 . 2.300 1.820 1.749 1.929 . 0 0 "[ . 1 . 2]" 2
16 1 18 LEU O 1 22 ILE N 2.800 2.300 3.300 2.764 2.701 2.850 . 0 0 "[ . 1 . 2]" 2
17 1 19 SER O 1 23 ASN H 1.800 . 2.400 2.278 2.079 2.409 0.009 15 0 "[ . 1 . 2]" 2
18 1 19 SER O 1 23 ASN N 2.800 2.300 3.300 3.062 2.922 3.179 . 0 0 "[ . 1 . 2]" 2
19 1 20 LEU O 1 24 LYS H 2.000 . 2.800 2.061 1.958 2.180 . 0 0 "[ . 1 . 2]" 2
20 1 20 LEU O 1 24 LYS N 2.800 2.300 3.500 2.842 2.787 2.935 . 0 0 "[ . 1 . 2]" 2
21 1 21 ASP O 1 25 LEU H 2.000 . 2.800 2.863 2.832 2.901 0.101 8 0 "[ . 1 . 2]" 2
22 1 21 ASP O 1 25 LEU N 2.800 2.300 3.600 3.644 3.617 3.672 0.072 6 0 "[ . 1 . 2]" 2
23 1 26 PRO O 1 30 LEU H 1.800 . 2.400 2.433 2.399 2.459 0.059 13 0 "[ . 1 . 2]" 2
24 1 26 PRO O 1 30 LEU N 2.800 2.300 3.300 3.297 3.261 3.332 0.032 20 0 "[ . 1 . 2]" 2
25 1 27 GLY O 1 31 GLY H 2.000 . 3.000 2.716 2.533 2.863 . 0 0 "[ . 1 . 2]" 2
26 1 27 GLY O 1 31 GLY N 3.000 2.500 4.000 3.429 3.226 3.535 . 0 0 "[ . 1 . 2]" 2
27 1 28 GLU O 1 32 ARG H 2.300 . 3.300 3.355 3.301 3.400 0.100 6 0 "[ . 1 . 2]" 2
28 1 28 GLU O 1 32 ARG N 3.100 2.600 4.100 3.966 3.883 4.036 . 0 0 "[ . 1 . 2]" 2
29 1 29 LYS O 1 33 VAL H 2.300 . 3.300 2.879 2.818 2.954 . 0 0 "[ . 1 . 2]" 2
30 1 29 LYS O 1 33 VAL N 3.000 2.500 4.000 3.795 3.741 3.872 . 0 0 "[ . 1 . 2]" 2
31 1 30 LEU O 1 34 VAL H 1.800 . 2.300 2.094 1.993 2.310 0.010 14 0 "[ . 1 . 2]" 2
32 1 30 LEU O 1 34 VAL N 2.800 2.300 3.300 3.066 2.969 3.287 . 0 0 "[ . 1 . 2]" 2
33 1 31 GLY O 1 35 HIS H 2.000 . 2.700 2.542 2.398 2.637 . 0 0 "[ . 1 . 2]" 2
34 1 31 GLY O 1 35 HIS N 2.900 2.400 3.500 3.369 3.237 3.450 . 0 0 "[ . 1 . 2]" 2
35 1 32 ARG O 1 36 ILE H 1.800 . 2.300 1.739 1.700 1.797 . 0 0 "[ . 1 . 2]" 2
36 1 32 ARG O 1 36 ILE N 2.800 2.300 3.300 2.686 2.669 2.718 . 0 0 "[ . 1 . 2]" 2
37 1 33 VAL O 1 37 ILE H 1.800 . 2.300 1.748 1.723 1.800 . 0 0 "[ . 1 . 2]" 2
38 1 33 VAL O 1 37 ILE N 2.800 2.300 3.300 2.698 2.677 2.739 . 0 0 "[ . 1 . 2]" 2
39 1 34 VAL O 1 38 GLN H 1.800 . 2.300 1.801 1.703 1.977 . 0 0 "[ . 1 . 2]" 2
40 1 34 VAL O 1 38 GLN N 2.800 2.300 3.500 2.742 2.659 2.900 . 0 0 "[ . 1 . 2]" 2
41 1 35 HIS O 1 39 SER H 2.000 . 2.500 2.188 2.016 2.306 . 0 0 "[ . 1 . 2]" 2
42 1 35 HIS O 1 39 SER N 2.800 2.300 3.300 3.086 2.935 3.191 . 0 0 "[ . 1 . 2]" 2
43 1 36 ILE O 1 40 ARG H 1.800 . 2.300 1.879 1.836 1.932 . 0 0 "[ . 1 . 2]" 2
44 1 36 ILE O 1 40 ARG N 2.800 2.300 3.300 2.821 2.780 2.862 . 0 0 "[ . 1 . 2]" 2
45 1 37 ILE O 1 41 GLU H 1.800 . 2.300 1.717 1.649 1.842 . 0 0 "[ . 1 . 2]" 2
46 1 37 ILE O 1 41 GLU N 2.800 2.300 3.300 2.560 2.528 2.602 . 0 0 "[ . 1 . 2]" 2
47 1 55 ASP O 1 59 LEU H 2.000 . 2.500 2.570 2.525 2.608 0.108 15 0 "[ . 1 . 2]" 2
48 1 55 ASP O 1 59 LEU N 2.800 2.300 3.300 3.356 3.326 3.393 0.093 8 0 "[ . 1 . 2]" 2
49 1 60 LYS O 1 64 LEU H 1.800 . 2.300 2.338 2.305 2.352 0.052 20 0 "[ . 1 . 2]" 2
50 1 60 LYS O 1 64 LEU N 2.800 2.300 3.300 3.298 3.267 3.313 0.013 20 0 "[ . 1 . 2]" 2
51 1 61 PRO O 1 65 ARG H 1.800 . 2.300 1.990 1.889 2.110 . 0 0 "[ . 1 . 2]" 2
52 1 61 PRO O 1 65 ARG N 2.800 2.300 3.300 2.889 2.811 2.983 . 0 0 "[ . 1 . 2]" 2
53 1 62 SER O 1 66 GLU H 1.800 . 2.300 2.089 1.929 2.177 . 0 0 "[ . 1 . 2]" 2
54 1 62 SER O 1 66 GLU N 2.800 2.300 3.300 2.869 2.772 2.946 . 0 0 "[ . 1 . 2]" 2
55 1 63 THR O 1 67 LEU H 1.800 . 2.300 1.775 1.738 1.814 . 0 0 "[ . 1 . 2]" 2
56 1 63 THR O 1 67 LEU N 2.800 2.300 3.300 2.752 2.724 2.790 . 0 0 "[ . 1 . 2]" 2
57 1 64 LEU O 1 68 GLU H 1.800 . 2.300 2.277 2.183 2.336 0.036 8 0 "[ . 1 . 2]" 2
58 1 64 LEU O 1 68 GLU N 2.800 2.300 3.300 3.139 3.074 3.200 . 0 0 "[ . 1 . 2]" 2
59 1 65 ARG O 1 69 ARG H 2.000 . 2.500 2.297 2.101 2.384 . 0 0 "[ . 1 . 2]" 2
60 1 65 ARG O 1 69 ARG N 2.800 2.300 3.300 3.267 3.067 3.366 0.066 12 0 "[ . 1 . 2]" 2
61 1 66 GLU O 1 70 TYR H 1.800 . 2.300 2.295 2.085 2.347 0.047 3 0 "[ . 1 . 2]" 2
62 1 66 GLU O 1 70 TYR N 2.800 2.300 3.300 3.061 2.882 3.136 . 0 0 "[ . 1 . 2]" 2
63 1 67 LEU O 1 71 VAL H 1.800 . 2.300 2.037 1.970 2.088 . 0 0 "[ . 1 . 2]" 2
64 1 67 LEU O 1 71 VAL N 2.800 2.300 3.300 3.001 2.943 3.046 . 0 0 "[ . 1 . 2]" 2
65 1 68 GLU O 1 72 THR H 1.800 . 2.300 1.903 1.740 2.090 . 0 0 "[ . 1 . 2]" 2
66 1 68 GLU O 1 72 THR N 2.800 2.300 3.300 2.880 2.707 3.070 . 0 0 "[ . 1 . 2]" 2
67 1 69 ARG O 1 73 SER H 1.900 . 2.600 2.632 2.502 2.706 0.106 20 0 "[ . 1 . 2]" 2
68 1 69 ARG O 1 73 SER N 2.900 2.400 3.600 3.315 3.188 3.386 . 0 0 "[ . 1 . 2]" 2
69 1 70 TYR O 1 74 CYS H 2.000 . 2.800 2.446 2.342 2.544 . 0 0 "[ . 1 . 2]" 2
70 1 70 TYR O 1 74 CYS N 2.900 2.400 3.600 3.217 3.132 3.345 . 0 0 "[ . 1 . 2]" 2
71 1 71 VAL O 1 75 LEU H 1.800 . 2.300 1.689 1.654 1.761 . 0 0 "[ . 1 . 2]" 2
72 1 71 VAL O 1 75 LEU N 2.800 2.300 3.300 2.650 2.614 2.716 . 0 0 "[ . 1 . 2]" 2
73 1 72 THR O 1 76 ARG H 1.800 . 2.300 1.973 1.863 2.098 . 0 0 "[ . 1 . 2]" 2
74 1 72 THR O 1 76 ARG N 2.800 2.300 3.300 2.869 2.774 2.985 . 0 0 "[ . 1 . 2]" 2
75 1 2 GLU O 1 6 LYS H 2.000 . 2.700 2.562 2.104 2.778 0.078 6 0 "[ . 1 . 2]" 2
76 1 2 GLU O 1 6 LYS N 3.000 2.500 3.600 3.109 2.787 3.523 . 0 0 "[ . 1 . 2]" 2
77 1 38 GLN NE2 1 47 SER O 2.900 2.400 3.600 2.753 2.667 3.076 . 0 0 "[ . 1 . 2]" 2
78 1 15 LYS NZ 1 57 GLU OE1 3.000 2.500 3.500 3.070 2.694 3.529 0.029 8 0 "[ . 1 . 2]" 2
79 1 40 ARG O 1 60 LYS NZ 2.900 2.400 3.600 2.861 2.606 3.179 . 0 0 "[ . 1 . 2]" 2
80 1 41 GLU OE2 1 60 LYS NZ 2.800 2.300 3.500 3.053 2.659 3.502 0.002 13 0 "[ . 1 . 2]" 2
81 1 41 GLU OE1 1 60 LYS N 2.800 2.300 3.300 2.974 2.714 3.423 0.123 12 0 "[ . 1 . 2]" 2
82 1 29 LYS O 1 70 TYR OH 2.800 2.300 3.300 2.617 2.588 2.655 . 0 0 "[ . 1 . 2]" 2
83 1 29 LYS NZ 1 74 CYS SG 2.800 2.300 3.500 3.392 3.245 3.529 0.029 20 0 "[ . 1 . 2]" 2
84 1 55 ASP OD2 1 58 THR OG1 2.800 2.300 3.700 3.738 3.599 3.805 0.105 19 0 "[ . 1 . 2]" 2
85 2 4 LEU O 2 8 LYS H 1.800 . 2.300 2.335 2.223 2.451 0.151 7 0 "[ . 1 . 2]" 2
86 2 4 LEU O 2 8 LYS N 2.800 2.300 3.300 2.942 2.812 3.096 . 0 0 "[ . 1 . 2]" 2
87 2 5 GLU O 2 9 ARG H 1.800 . 2.300 2.460 2.375 2.535 0.235 10 0 "[ . 1 . 2]" 2
88 2 5 GLU O 2 9 ARG N 2.800 2.300 3.300 3.281 3.164 3.340 0.040 10 0 "[ . 1 . 2]" 2
89 2 6 ARG O 2 10 LYS H 1.800 . 2.300 2.402 2.344 2.519 0.219 7 0 "[ . 1 . 2]" 2
90 2 6 ARG O 2 10 LYS N 2.800 2.300 3.300 3.267 3.122 3.355 0.055 7 0 "[ . 1 . 2]" 2
91 2 7 LEU O 2 11 TYR H 1.800 . 2.300 1.840 1.674 2.072 . 0 0 "[ . 1 . 2]" 2
92 2 7 LEU O 2 11 TYR N 2.800 2.300 3.300 2.679 2.599 2.754 . 0 0 "[ . 1 . 2]" 2
93 2 8 LYS O 2 12 ARG H 1.800 . 2.300 2.083 1.780 2.342 0.042 11 0 "[ . 1 . 2]" 2
94 2 8 LYS O 2 12 ARG N 2.800 2.300 3.300 2.998 2.755 3.291 . 0 0 "[ . 1 . 2]" 2
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