NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
621817 |
5o2y   |
26919 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5o2y
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 1789
_Distance_constraint_stats_list.Viol_count 1473
_Distance_constraint_stats_list.Viol_total 9193.635
_Distance_constraint_stats_list.Viol_max 2.540
_Distance_constraint_stats_list.Viol_rms 0.1511
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0228
_Distance_constraint_stats_list.Viol_average_violations_only 0.4161
_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 5 GLU 4.622 0.654 2 4 "[ + . * 1- *]"
1 6 LYS 3.462 0.654 2 3 "[ + . 1- *]"
1 7 ALA 0.059 0.034 4 0 "[ . 1 .]"
1 8 ASP 35.971 1.680 13 15 [***-********+**]
1 9 ARG 6.217 0.468 14 0 "[ . 1 .]"
1 10 GLN 26.840 1.680 13 15 [************+-*]
1 11 LYS 3.156 0.433 5 0 "[ . 1 .]"
1 12 VAL 4.541 0.717 7 1 "[ . + 1 .]"
1 13 VAL 19.536 0.763 3 9 "[**+-. *** * *]"
1 14 SER 12.818 0.918 5 6 "[* * +* * -.]"
1 15 ASP 16.407 1.024 5 15 [****+***-******]
1 16 LEU 18.620 0.828 6 11 "[** **+***1* * -]"
1 17 VAL 19.306 1.864 12 15 [******-****+***]
1 18 ALA 1.909 0.445 11 0 "[ . 1 .]"
1 19 LEU 8.263 0.458 5 0 "[ . 1 .]"
1 20 GLU 4.831 0.758 2 3 "[ +-*. 1 .]"
1 21 GLY 0.124 0.072 7 0 "[ . 1 .]"
1 22 ALA 51.652 1.834 9 15 [********+*****-]
1 23 LEU 15.969 1.220 7 14 [****.*+-*******]
1 24 ASP 0.873 0.399 10 0 "[ . 1 .]"
1 25 MET 6.690 1.337 13 4 "[ . -* +*.]"
1 26 TYR 3.361 0.669 13 3 "[ - . * 1 + .]"
1 27 LYS 20.670 0.719 9 5 "[ * . *+1 -* .]"
1 28 LEU 1.370 0.610 9 1 "[ . +1 .]"
1 29 ASP 0.110 0.110 9 0 "[ . 1 .]"
1 30 ASN 1.177 1.177 14 1 "[ . 1 +.]"
1 31 SER 8.845 0.873 2 11 "[*+**** * ** * -]"
1 32 ARG 5.967 1.294 10 5 "[ .* *+ - *.]"
1 33 TYR 35.116 1.834 9 15 [********+*****-]
1 34 PRO 2.825 0.756 9 2 "[ . -+1 .]"
1 35 THR 0.756 0.201 13 0 "[ . 1 .]"
1 36 THR 6.273 1.542 15 2 "[ . -1 +]"
1 37 GLU 3.556 0.845 13 2 "[ -. 1 + .]"
1 38 GLN 5.638 0.684 6 2 "[ -.+ 1 .]"
1 39 GLY 1.332 0.275 2 0 "[ . 1 .]"
1 40 LEU 39.288 2.149 10 15 [********-+*****]
1 41 GLN 14.385 0.885 5 7 "[ +* *1***-.]"
1 42 ALA 26.313 1.585 9 15 [********+*-****]
1 43 LEU 10.400 0.756 9 2 "[ . -+1 .]"
1 44 VAL 50.787 2.192 2 15 [*+***********-*]
1 45 SER 4.795 0.755 11 3 "[ *. 1+- .]"
1 46 ALA 0.049 0.042 15 0 "[ . 1 .]"
1 47 PRO 0.446 0.093 9 0 "[ . 1 .]"
1 48 SER 0.350 0.141 12 0 "[ . 1 .]"
1 49 ALA 35.156 1.585 9 15 [********+*****-]
1 50 GLU 0.000 0.000 . 0 "[ . 1 .]"
1 51 PRO 34.457 1.963 2 15 [*+************-]
1 52 HIS 1.541 0.890 7 1 "[ . + 1 .]"
1 53 ALA 0.496 0.093 9 0 "[ . 1 .]"
1 54 ARG 9.499 1.177 14 8 "[* **. - *1** +.]"
1 55 ASN 0.574 0.355 8 0 "[ . 1 .]"
1 56 TYR 32.884 1.963 2 15 [*+****-********]
1 57 PRO 5.246 1.337 13 4 "[ . ** +-.]"
1 58 GLU 0.913 0.698 5 1 "[ + 1 .]"
1 59 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 60 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 61 TYR 21.232 1.603 14 15 [****-********+*]
1 62 ILE 2.237 0.352 7 0 "[ . 1 .]"
1 63 ARG 9.266 0.744 4 4 "[ *+.- 1 *]"
1 64 ARG 25.974 1.850 7 15 [******+******-*]
1 65 LEU 30.025 2.192 2 13 "[*+* *****-*** *]"
1 66 PRO 1.341 0.445 11 0 "[ . 1 .]"
1 67 GLN 2.400 0.531 7 1 "[ . + 1 .]"
1 68 ASP 1.300 0.425 3 0 "[ . 1 .]"
1 69 PRO 5.819 0.777 12 3 "[* . - 1 + .]"
1 70 TRP 4.626 0.777 12 2 "[- . 1 + .]"
1 71 GLY 8.897 1.027 12 5 "[ *.* * + -]"
1 72 SER 1.671 0.706 14 2 "[ . - +.]"
1 73 ASP 2.437 0.706 14 3 "[ . - * +.]"
1 74 TYR 49.188 2.539 2 15 [*+*******-*****]
1 75 GLN 0.365 0.150 13 0 "[ . 1 .]"
1 76 LEU 0.771 0.106 10 0 "[ . 1 .]"
1 77 LEU 22.339 1.250 8 14 "[****** +*-*****]"
1 78 SER 1.964 1.542 15 1 "[ . 1 +]"
1 79 PRO 0.325 0.133 5 0 "[ . 1 .]"
1 80 GLY 11.035 1.250 8 11 "[*** ** +**-* *]"
1 81 GLN 28.553 2.540 14 15 [***********-*+*]
1 82 HIS 14.417 1.294 1 14 "[+***** **-*****]"
1 83 GLY 0.325 0.133 5 0 "[ . 1 .]"
1 84 GLN 3.422 1.294 10 3 "[ .- + *.]"
1 85 VAL 12.662 1.080 7 11 "[***** +-*1** *]"
1 86 ASP 1.194 0.329 10 0 "[ . 1 .]"
1 87 ILE 26.092 1.080 7 15 [******+-*******]
1 88 PHE 2.878 0.561 7 1 "[ . + 1 .]"
1 89 SER 26.163 2.149 10 15 [*******-*+*****]
1 90 LEU 27.442 2.315 7 15 [-*****+********]
1 91 GLY 12.641 1.358 11 12 "[* *** ****+ *-*]"
1 92 PRO 1.721 0.954 15 1 "[ . 1 +]"
1 93 ASP 0.192 0.115 4 0 "[ . 1 .]"
1 94 GLY 6.402 1.027 12 5 "[ *.* * + -]"
1 95 VAL 0.000 0.000 . 0 "[ . 1 .]"
1 96 PRO 48.381 2.539 2 15 [*+************-]
1 97 GLU 0.757 0.491 5 0 "[ . 1 .]"
1 98 SER 0.000 0.000 . 0 "[ . 1 .]"
1 99 ASN 0.394 0.102 13 0 "[ . 1 .]"
1 100 ASP 2.090 0.954 15 1 "[ . 1 +]"
1 101 ASP 13.554 1.358 11 12 "[* *** ****+ *-*]"
1 102 ILE 60.502 2.315 7 15 [****-*+********]
1 103 GLY 13.134 1.312 15 9 "[*-*** *1 * *+]"
1 104 ASN 1.105 0.321 12 0 "[ . 1 .]"
1 105 TRP 4.743 1.294 1 2 "[+ . 1 -]"
1 106 THR 28.715 2.540 14 15 [***********-*+*]
1 107 ILE 13.555 1.312 15 10 "[***** - *1 * *+]"
1 108 GLY 9.144 1.035 4 10 "[ **+-* * *** *]"
1 109 PHE 1.399 0.458 12 0 "[ . 1 .]"
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 96 PRO QB 1 97 GLU H 3.272 . 4.610 2.871 2.667 3.075 . 0 0 "[ . 1 .]" 1
2 1 97 GLU H 1 97 GLU HB3 3.772 . 5.550 3.946 3.074 4.133 . 0 0 "[ . 1 .]" 1
3 1 90 LEU H 1 90 LEU HB3 3.234 . 4.294 3.571 3.213 3.656 . 0 0 "[ . 1 .]" 1
4 1 81 GLN HA 1 82 HIS H 3.648 . 4.518 3.475 3.368 3.537 . 0 0 "[ . 1 .]" 1
5 1 80 GLY QA 1 82 HIS H 3.734 . 5.477 3.230 2.854 3.489 . 0 0 "[ . 1 .]" 1
6 1 81 GLN QB 1 82 HIS H . . 4.442 2.792 2.496 3.169 . 0 0 "[ . 1 .]" 1
7 1 77 LEU MD1 1 82 HIS H 4.962 . 8.039 5.673 5.323 6.005 . 0 0 "[ . 1 .]" 1
8 1 92 PRO HA 1 93 ASP H . . 3.785 3.478 3.389 3.548 . 0 0 "[ . 1 .]" 1
9 1 92 PRO HB3 1 93 ASP H 4.651 . 7.354 4.259 4.097 4.396 . 0 0 "[ . 1 .]" 1
10 1 88 PHE HA 1 104 ASN H 4.117 . 6.236 3.812 3.385 4.368 . 0 0 "[ . 1 .]" 1
11 1 77 LEU H 1 87 ILE MG 4.534 . 7.103 4.185 4.090 4.332 . 0 0 "[ . 1 .]" 1
12 1 77 LEU H 1 87 ILE HA 3.873 . 5.748 3.824 3.659 4.104 . 0 0 "[ . 1 .]" 1
13 1 52 HIS HA 1 53 ALA H 2.542 . 3.350 2.156 2.132 2.203 . 0 0 "[ . 1 .]" 1
14 1 76 LEU QD 1 77 LEU H . . 3.025 2.164 2.025 2.391 . 0 0 "[ . 1 .]" 1
15 1 53 ALA H 1 53 ALA HA 3.076 . 3.120 2.807 2.779 2.864 . 0 0 "[ . 1 .]" 1
16 1 77 LEU H 1 77 LEU MD2 4.368 . 6.753 4.195 4.091 4.274 . 0 0 "[ . 1 .]" 1
17 1 73 ASP HA 1 74 TYR H 2.547 . 3.358 2.182 2.136 2.259 . 0 0 "[ . 1 .]" 1
18 1 80 GLY QA 1 81 GLN H 2.622 . 3.481 2.177 2.105 2.258 . 0 0 "[ . 1 .]" 1
19 1 81 GLN H 1 81 GLN QB 2.925 . 3.501 2.267 2.201 2.335 . 0 0 "[ . 1 .]" 1
20 1 77 LEU MD1 1 81 GLN H 2.765 . 3.720 3.716 3.470 3.798 0.078 10 0 "[ . 1 .]" 1
21 1 19 LEU QD 1 74 TYR H 5.014 . 8.157 4.433 4.093 4.767 . 0 0 "[ . 1 .]" 1
22 1 65 LEU H 1 65 LEU QB . . 2.974 2.288 2.160 2.372 . 0 0 "[ . 1 .]" 1
23 1 64 ARG QB 1 65 LEU H 3.020 . 4.102 2.518 2.148 3.578 . 0 0 "[ . 1 .]" 1
24 1 64 ARG QG 1 65 LEU H 4.929 . 7.965 3.758 2.282 4.227 . 0 0 "[ . 1 .]" 1
25 1 44 VAL QG 1 65 LEU H 3.206 . 3.972 3.046 2.560 3.300 . 0 0 "[ . 1 .]" 1
26 1 62 ILE MG 1 65 LEU H 4.169 . 6.341 4.981 4.575 5.402 . 0 0 "[ . 1 .]" 1
27 1 53 ALA MB 1 54 ARG H 2.977 . 3.141 3.111 2.992 3.171 0.030 13 0 "[ . 1 .]" 1
28 1 54 ARG H 1 54 ARG HB3 3.134 . 4.362 3.550 2.418 3.760 . 0 0 "[ . 1 .]" 1
29 1 54 ARG H 1 54 ARG QG 2.895 . 3.943 2.926 2.522 3.970 0.027 14 0 "[ . 1 .]" 1
30 1 46 ALA MB 1 54 ARG H 3.954 . 5.909 5.260 4.923 5.470 . 0 0 "[ . 1 .]" 1
31 1 91 GLY H 1 92 PRO HD2 5.493 . 9.264 5.242 4.885 5.350 . 0 0 "[ . 1 .]" 1
32 1 30 ASN QB 1 31 SER H 4.769 . 5.652 3.437 3.281 3.684 . 0 0 "[ . 1 .]" 1
33 1 87 ILE HG13 1 88 PHE H 4.264 . 6.537 4.557 4.445 4.619 . 0 0 "[ . 1 .]" 1
34 1 31 SER H 1 31 SER QB 3.832 . 5.668 3.363 3.003 3.432 . 0 0 "[ . 1 .]" 1
35 1 27 LYS HA 1 31 SER H 3.656 . 5.327 3.319 2.996 3.584 . 0 0 "[ . 1 .]" 1
36 1 34 PRO HB3 1 35 THR H 4.261 . 6.530 3.685 3.187 3.869 . 0 0 "[ . 1 .]" 1
37 1 87 ILE MG 1 88 PHE H 3.092 . 4.287 3.728 3.634 3.805 . 0 0 "[ . 1 .]" 1
38 1 54 ARG HA 1 55 ASN H 2.730 . 3.662 2.374 2.255 2.431 . 0 0 "[ . 1 .]" 1
39 1 85 VAL HA 1 86 ASP H 2.236 . 2.861 2.215 2.138 2.329 . 0 0 "[ . 1 .]" 1
40 1 86 ASP H 1 86 ASP HA 2.936 . 4.014 2.940 2.916 2.952 . 0 0 "[ . 1 .]" 1
41 1 85 VAL QG 1 86 ASP H 3.762 . 4.711 3.389 3.262 3.522 . 0 0 "[ . 1 .]" 1
42 1 58 GLU HA 1 59 GLY H 2.988 . 4.104 2.141 2.125 2.157 . 0 0 "[ . 1 .]" 1
43 1 8 ASP H 1 9 ARG QG 4.225 . 6.456 4.051 3.915 4.328 . 0 0 "[ . 1 .]" 1
44 1 12 VAL QG 1 16 LEU H 3.517 . 5.063 3.871 3.785 4.022 . 0 0 "[ . 1 .]" 1
45 1 41 GLN H 1 42 ALA MB 4.443 . 6.911 4.197 4.159 4.245 . 0 0 "[ . 1 .]" 1
46 1 13 VAL HA 1 16 LEU H 3.459 . 4.955 3.319 3.241 3.386 . 0 0 "[ . 1 .]" 1
47 1 40 LEU HA 1 41 GLN H 3.639 . 5.294 3.507 3.469 3.555 . 0 0 "[ . 1 .]" 1
48 1 19 LEU QB 1 20 GLU H 2.738 . 3.675 2.385 2.302 2.548 . 0 0 "[ . 1 .]" 1
49 1 12 VAL HA 1 15 ASP H 3.358 . 4.768 3.585 3.403 3.786 . 0 0 "[ . 1 .]" 1
50 1 5 GLU HA 1 8 ASP H 3.304 . 3.510 3.483 3.058 4.051 0.541 7 1 "[ . + 1 .]" 1
51 1 20 GLU H 1 20 GLU QG 3.607 . 5.233 3.474 2.282 3.968 . 0 0 "[ . 1 .]" 1
52 1 41 GLN H 1 41 GLN HB3 3.572 . 5.167 3.573 3.516 3.604 . 0 0 "[ . 1 .]" 1
53 1 14 SER HA 1 15 ASP H 3.746 . 5.501 3.570 3.557 3.582 . 0 0 "[ . 1 .]" 1
54 1 22 ALA HA 1 23 LEU H 3.397 . 4.840 3.528 3.514 3.544 . 0 0 "[ . 1 .]" 1
55 1 77 LEU HG 1 78 SER H 3.710 . 5.430 4.999 4.263 5.129 . 0 0 "[ . 1 .]" 1
56 1 17 VAL HA 1 19 LEU H 3.351 . 4.755 4.245 4.139 4.342 . 0 0 "[ . 1 .]" 1
57 1 44 VAL HA 1 61 TYR H 4.052 . 6.104 3.566 3.031 3.966 . 0 0 "[ . 1 .]" 1
58 1 19 LEU H 1 19 LEU HA 2.605 . 3.453 2.809 2.799 2.821 . 0 0 "[ . 1 .]" 1
59 1 18 ALA HA 1 19 LEU H 3.387 . 4.821 3.540 3.526 3.550 . 0 0 "[ . 1 .]" 1
60 1 77 LEU QB 1 78 SER H . . 4.315 3.889 3.842 3.911 . 0 0 "[ . 1 .]" 1
61 1 60 GLY HA2 1 61 TYR H 3.071 . 4.250 2.913 2.620 3.283 . 0 0 "[ . 1 .]" 1
62 1 19 LEU H 1 19 LEU QB . . 2.953 2.365 2.157 2.458 . 0 0 "[ . 1 .]" 1
63 1 61 TYR H 1 61 TYR HB2 3.039 . 3.383 2.497 2.360 2.718 . 0 0 "[ . 1 .]" 1
64 1 77 LEU MD1 1 78 SER H 3.753 . 5.514 3.153 2.810 4.977 . 0 0 "[ . 1 .]" 1
65 1 19 LEU H 1 19 LEU QD 3.576 . 3.630 2.950 2.304 3.194 . 0 0 "[ . 1 .]" 1
66 1 26 TYR HA 1 27 LYS H 3.820 . 5.644 3.544 3.527 3.575 . 0 0 "[ . 1 .]" 1
67 1 75 GLN H 1 75 GLN QG . . 4.015 3.088 2.687 3.728 . 0 0 "[ . 1 .]" 1
68 1 58 GLU H 1 58 GLU HB3 3.749 . 5.506 3.602 3.580 3.622 . 0 0 "[ . 1 .]" 1
69 1 27 LYS H 1 27 LYS HG2 4.250 . 6.508 4.452 4.419 4.505 . 0 0 "[ . 1 .]" 1
70 1 37 GLU H 1 37 GLU HA 2.739 . 3.677 2.867 2.852 2.883 . 0 0 "[ . 1 .]" 1
71 1 23 LEU HA 1 24 ASP H 3.460 . 4.957 3.543 3.523 3.557 . 0 0 "[ . 1 .]" 1
72 1 24 ASP H 1 24 ASP HA 2.974 . 4.079 2.819 2.805 2.852 . 0 0 "[ . 1 .]" 1
73 1 23 LEU HB2 1 24 ASP H 3.276 . 4.617 2.640 2.325 2.821 . 0 0 "[ . 1 .]" 1
74 1 37 GLU H 1 37 GLU QG 4.433 . 6.889 3.782 2.290 4.057 . 0 0 "[ . 1 .]" 1
75 1 20 GLU HA 1 24 ASP H 4.312 . 6.636 4.030 3.829 4.381 . 0 0 "[ . 1 .]" 1
76 1 21 GLY QA 1 24 ASP H . . 3.503 3.341 3.185 3.537 0.034 7 0 "[ . 1 .]" 1
77 1 49 ALA H 1 49 ALA MB 2.105 . 2.659 2.262 2.222 2.571 . 0 0 "[ . 1 .]" 1
78 1 47 PRO HA 1 48 SER H 2.748 . 3.692 2.159 2.137 2.210 . 0 0 "[ . 1 .]" 1
79 1 38 GLN HA 1 39 GLY H 3.506 . 5.042 3.505 3.472 3.547 . 0 0 "[ . 1 .]" 1
80 1 39 GLY H 1 76 LEU QD 2.608 . 3.458 2.893 2.552 3.194 . 0 0 "[ . 1 .]" 1
81 1 36 THR H 1 77 LEU MD2 4.067 . 6.134 4.918 4.318 5.646 . 0 0 "[ . 1 .]" 1
82 1 108 GLY H 1 108 GLY QA 3.831 . 5.666 2.347 2.186 2.491 . 0 0 "[ . 1 .]" 1
83 1 16 LEU HA 1 17 VAL H . . 3.301 3.569 3.551 3.580 0.279 9 0 "[ . 1 .]" 1
84 1 68 ASP H 1 73 ASP HA 4.134 . 6.270 3.717 3.171 4.316 . 0 0 "[ . 1 .]" 1
85 1 32 ARG HA 1 33 TYR H 2.297 . 2.957 2.347 2.241 2.527 . 0 0 "[ . 1 .]" 1
86 1 94 GLY HA2 1 95 VAL H 3.899 . 4.884 3.226 3.124 3.432 . 0 0 "[ . 1 .]" 1
87 1 43 LEU H 1 43 LEU QB . . 3.396 2.691 2.159 3.053 . 0 0 "[ . 1 .]" 1
88 1 16 LEU QB 1 17 VAL H 4.008 . 6.016 2.426 2.358 2.520 . 0 0 "[ . 1 .]" 1
89 1 17 VAL H 1 19 LEU QB 3.973 . 5.946 4.879 4.781 5.031 . 0 0 "[ . 1 .]" 1
90 1 43 LEU H 1 44 VAL HB 4.592 . 7.228 4.642 4.140 4.877 . 0 0 "[ . 1 .]" 1
91 1 90 LEU QD 1 95 VAL H 3.607 . 5.233 4.106 3.720 4.438 . 0 0 "[ . 1 .]" 1
92 1 13 VAL QG 1 17 VAL H 2.965 . 4.064 3.629 3.533 3.754 . 0 0 "[ . 1 .]" 1
93 1 62 ILE MD 1 63 ARG H 4.353 . 6.721 4.145 3.988 4.389 . 0 0 "[ . 1 .]" 1
94 1 17 VAL H 1 18 ALA HA 4.816 . 7.715 5.269 5.242 5.309 . 0 0 "[ . 1 .]" 1
95 1 27 LYS QE 1 33 TYR H 4.110 . 6.222 4.269 3.738 4.713 . 0 0 "[ . 1 .]" 1
96 1 5 GLU H 1 5 GLU QG 4.326 . 5.861 3.997 3.947 4.048 . 0 0 "[ . 1 .]" 1
97 1 5 GLU H 1 5 GLU HB3 . . 2.991 2.595 2.431 2.844 . 0 0 "[ . 1 .]" 1
98 1 62 ILE HG13 1 63 ARG H 3.774 . 5.554 2.755 2.650 2.990 . 0 0 "[ . 1 .]" 1
99 1 63 ARG H 1 63 ARG HG3 3.630 . 5.277 3.184 2.098 4.493 . 0 0 "[ . 1 .]" 1
100 1 87 ILE H 1 87 ILE MG 3.734 . 5.477 3.013 2.911 3.118 . 0 0 "[ . 1 .]" 1
101 1 87 ILE H 1 87 ILE MD 4.483 . 5.193 3.673 3.607 3.746 . 0 0 "[ . 1 .]" 1
102 1 62 ILE HB 1 63 ARG H 4.756 . 7.584 4.095 4.032 4.183 . 0 0 "[ . 1 .]" 1
103 1 53 ALA MB 1 56 TYR H 4.061 . 6.122 4.817 4.619 5.041 . 0 0 "[ . 1 .]" 1
104 1 29 ASP HA 1 30 ASN H 3.806 . 5.617 3.557 3.535 3.577 . 0 0 "[ . 1 .]" 1
105 1 30 ASN H 1 30 ASN QB 3.321 . 3.823 2.461 2.340 2.551 . 0 0 "[ . 1 .]" 1
106 1 67 GLN H 1 67 GLN HG3 3.599 . 4.036 3.209 2.953 3.583 . 0 0 "[ . 1 .]" 1
107 1 66 PRO HB2 1 67 GLN H 3.842 . 5.687 3.421 3.073 3.667 . 0 0 "[ . 1 .]" 1
108 1 12 VAL QG 1 13 VAL H . . 3.944 3.051 2.911 3.201 . 0 0 "[ . 1 .]" 1
109 1 13 VAL H 1 13 VAL QG 2.856 . 3.133 2.034 1.910 2.175 . 0 0 "[ . 1 .]" 1
110 1 28 LEU H 1 28 LEU HG 4.105 . 6.212 4.475 4.430 4.503 . 0 0 "[ . 1 .]" 1
111 1 20 GLU HA 1 21 GLY H 3.707 . 5.425 3.524 3.490 3.549 . 0 0 "[ . 1 .]" 1
112 1 17 VAL QG 1 21 GLY H 4.718 . 7.501 4.338 3.735 4.640 . 0 0 "[ . 1 .]" 1
113 1 18 ALA MB 1 21 GLY H 4.116 . 6.016 4.517 4.257 4.689 . 0 0 "[ . 1 .]" 1
114 1 67 GLN HA 1 72 SER H 4.240 . 6.488 4.851 4.147 5.301 . 0 0 "[ . 1 .]" 1
115 1 5 GLU QG 1 6 LYS H 3.887 . 5.776 3.762 3.466 4.090 . 0 0 "[ . 1 .]" 1
116 1 105 TRP HB3 1 109 PHE H 4.498 . 7.027 6.709 5.812 7.485 0.458 12 0 "[ . 1 .]" 1
117 1 10 GLN H 1 11 LYS QG 4.565 . 7.170 5.432 4.003 6.362 . 0 0 "[ . 1 .]" 1
118 1 11 LYS HA 1 14 SER H 3.649 . 3.962 3.361 3.255 3.627 . 0 0 "[ . 1 .]" 1
119 1 10 GLN H 1 10 GLN HG3 3.226 . 4.527 3.093 2.354 3.833 . 0 0 "[ . 1 .]" 1
120 1 10 GLN H 1 10 GLN HB3 3.513 . 5.055 3.591 3.566 3.616 . 0 0 "[ . 1 .]" 1
121 1 10 GLN H 1 10 GLN HB2 2.610 . 3.461 2.392 2.322 2.533 . 0 0 "[ . 1 .]" 1
122 1 22 ALA MB 1 62 ILE H 4.358 . 6.732 6.168 5.871 6.666 . 0 0 "[ . 1 .]" 1
123 1 61 TYR HA 1 62 ILE H 3.335 . 4.725 3.417 3.292 3.512 . 0 0 "[ . 1 .]" 1
124 1 14 SER H 1 14 SER HA 2.988 . 4.104 2.806 2.798 2.812 . 0 0 "[ . 1 .]" 1
125 1 62 ILE H 1 62 ILE HB 3.347 . 4.747 3.310 3.188 3.444 . 0 0 "[ . 1 .]" 1
126 1 61 TYR HB2 1 62 ILE H 4.060 . 6.120 2.992 2.645 3.523 . 0 0 "[ . 1 .]" 1
127 1 62 ILE H 1 62 ILE HG13 4.315 . 6.643 4.737 4.691 4.764 . 0 0 "[ . 1 .]" 1
128 1 62 ILE H 1 62 ILE MG 2.328 . 3.005 2.259 2.130 2.370 . 0 0 "[ . 1 .]" 1
129 1 43 LEU HA 1 44 VAL H 2.896 . 3.944 3.313 3.222 3.468 . 0 0 "[ . 1 .]" 1
130 1 43 LEU QB 1 44 VAL H . . 3.792 3.649 3.059 3.934 0.142 5 0 "[ . 1 .]" 1
131 1 77 LEU HG 1 88 PHE QE 4.236 . 6.479 3.853 3.198 4.724 . 0 0 "[ . 1 .]" 1
132 1 62 ILE H 1 62 ILE MD 4.422 . 6.867 4.768 4.690 4.835 . 0 0 "[ . 1 .]" 1
133 1 70 TRP HA 1 71 GLY H 3.571 . 5.165 3.422 3.320 3.495 . 0 0 "[ . 1 .]" 1
134 1 88 PHE QE 1 90 LEU QD 5.238 . 8.667 2.796 2.140 3.732 . 0 0 "[ . 1 .]" 1
135 1 46 ALA H 1 46 ALA MB 2.106 . 2.661 2.233 2.217 2.272 . 0 0 "[ . 1 .]" 1
136 1 15 ASP HA 1 18 ALA H 3.194 . 4.469 3.338 3.176 3.477 . 0 0 "[ . 1 .]" 1
137 1 59 GLY HA2 1 60 GLY H 3.980 . 4.928 3.245 3.156 3.358 . 0 0 "[ . 1 .]" 1
138 1 11 LYS H 1 11 LYS QB . . 2.715 2.356 2.215 2.591 . 0 0 "[ . 1 .]" 1
139 1 11 LYS H 1 11 LYS QG 4.426 . 6.875 3.226 1.934 4.031 0.043 8 0 "[ . 1 .]" 1
140 1 59 GLY HA3 1 60 GLY H 3.946 . 5.892 3.275 3.138 3.362 . 0 0 "[ . 1 .]" 1
141 1 76 LEU H 1 76 LEU QD 3.949 . 5.898 3.747 3.662 3.954 . 0 0 "[ . 1 .]" 1
142 1 76 LEU H 1 87 ILE MG 4.446 . 6.917 4.663 4.297 4.800 . 0 0 "[ . 1 .]" 1
143 1 19 LEU QD 1 22 ALA H 4.376 . 5.059 4.828 4.577 5.023 . 0 0 "[ . 1 .]" 1
144 1 12 VAL H 1 12 VAL QG . . 2.743 2.145 1.941 2.328 0.040 4 0 "[ . 1 .]" 1
145 1 85 VAL H 1 85 VAL QG 2.947 . 3.066 2.156 2.014 2.273 . 0 0 "[ . 1 .]" 1
146 1 69 PRO HA 1 70 TRP H 3.770 . 5.547 3.466 3.433 3.527 . 0 0 "[ . 1 .]" 1
147 1 19 LEU HA 1 22 ALA H 3.228 . 4.530 3.452 3.228 3.586 . 0 0 "[ . 1 .]" 1
148 1 22 ALA H 1 22 ALA HA 2.614 . 3.468 2.812 2.798 2.837 . 0 0 "[ . 1 .]" 1
149 1 25 MET H 1 25 MET QG . . 3.465 2.439 2.187 3.496 0.031 15 0 "[ . 1 .]" 1
150 1 25 MET H 1 28 LEU QD 4.898 . 7.897 5.239 4.945 5.496 . 0 0 "[ . 1 .]" 1
151 1 93 ASP HA 1 94 GLY H 3.718 . 5.446 3.388 3.350 3.418 . 0 0 "[ . 1 .]" 1
152 1 37 GLU HA 1 38 GLN H 3.765 . 5.537 3.517 3.483 3.539 . 0 0 "[ . 1 .]" 1
153 1 30 ASN QB 1 30 ASN QD . . 3.881 2.176 2.143 2.198 . 0 0 "[ . 1 .]" 1
154 1 30 ASN QD 1 53 ALA MB 3.573 . 5.169 3.034 2.468 4.063 . 0 0 "[ . 1 .]" 1
155 1 99 ASN HA 1 100 ASP H 3.695 . 4.053 3.457 3.255 3.518 . 0 0 "[ . 1 .]" 1
156 1 41 GLN HE22 1 41 GLN HG3 2.970 . 4.073 2.928 2.241 3.477 . 0 0 "[ . 1 .]" 1
157 1 41 GLN HE22 1 41 GLN HG2 3.446 . 3.605 2.643 2.180 3.510 . 0 0 "[ . 1 .]" 1
158 1 40 LEU HA 1 42 ALA H 3.727 . 5.464 4.003 3.818 4.151 . 0 0 "[ . 1 .]" 1
159 1 41 GLN HB2 1 42 ALA H 3.437 . 4.913 3.169 3.015 3.287 . 0 0 "[ . 1 .]" 1
160 1 41 GLN HB3 1 42 ALA H 3.774 . 4.190 3.897 3.729 3.973 . 0 0 "[ . 1 .]" 1
161 1 40 LEU QD 1 42 ALA H 4.155 . 6.313 4.992 4.568 5.199 . 0 0 "[ . 1 .]" 1
162 1 42 ALA H 1 44 VAL QG 4.492 . 7.014 4.358 4.031 4.807 . 0 0 "[ . 1 .]" 1
163 1 104 ASN HB3 1 107 ILE H 4.684 . 7.426 5.813 5.523 6.300 . 0 0 "[ . 1 .]" 1
164 1 62 ILE HA 1 64 ARG H 4.546 . 7.130 4.039 3.885 4.150 . 0 0 "[ . 1 .]" 1
165 1 63 ARG HA 1 64 ARG H 3.383 . 4.813 3.444 3.394 3.481 . 0 0 "[ . 1 .]" 1
166 1 64 ARG H 1 64 ARG QB . . 3.268 2.649 2.497 3.044 . 0 0 "[ . 1 .]" 1
167 1 63 ARG HB3 1 64 ARG H 2.822 . 3.818 3.596 2.915 4.074 0.256 8 0 "[ . 1 .]" 1
168 1 62 ILE HG13 1 64 ARG H 4.371 . 6.760 3.228 3.070 3.452 . 0 0 "[ . 1 .]" 1
169 1 63 ARG HG3 1 64 ARG H 4.220 . 6.446 4.696 4.306 5.047 . 0 0 "[ . 1 .]" 1
170 1 64 ARG H 1 64 ARG QG 3.683 . 5.379 3.120 2.234 4.222 . 0 0 "[ . 1 .]" 1
171 1 44 VAL QG 1 64 ARG H 3.508 . 5.046 3.507 3.228 3.903 . 0 0 "[ . 1 .]" 1
172 1 62 ILE MD 1 64 ARG H 3.929 . 5.859 3.428 3.287 3.571 . 0 0 "[ . 1 .]" 1
173 1 70 TRP HH2 1 102 ILE MG 4.442 . 6.908 4.960 3.760 6.305 . 0 0 "[ . 1 .]" 1
174 1 99 ASN HA 1 101 ASP H 4.118 . 4.516 3.789 3.557 4.263 . 0 0 "[ . 1 .]" 1
175 1 100 ASP HA 1 101 ASP H 3.624 . 5.266 3.006 2.311 3.436 . 0 0 "[ . 1 .]" 1
176 1 70 TRP HB2 1 70 TRP HH2 4.201 . 6.407 6.257 6.225 6.296 . 0 0 "[ . 1 .]" 1
177 1 12 VAL QG 1 70 TRP HH2 . . 3.491 2.736 2.310 3.222 . 0 0 "[ . 1 .]" 1
178 1 26 TYR QD 1 38 GLN HA 5.190 . 8.132 6.094 5.687 6.676 . 0 0 "[ . 1 .]" 1
179 1 26 TYR QD 1 34 PRO HB3 3.926 . 5.853 3.108 2.739 3.622 . 0 0 "[ . 1 .]" 1
180 1 26 TYR HA 1 26 TYR QD 3.860 . 5.723 2.904 2.460 3.028 . 0 0 "[ . 1 .]" 1
181 1 26 TYR QD 1 51 PRO QD 5.065 . 8.271 5.354 4.427 5.875 . 0 0 "[ . 1 .]" 1
182 1 26 TYR QD 1 38 GLN HG3 4.873 . 7.842 6.762 5.555 7.135 . 0 0 "[ . 1 .]" 1
183 1 26 TYR QD 1 47 PRO HB2 4.549 . 7.136 5.378 4.299 6.049 . 0 0 "[ . 1 .]" 1
184 1 26 TYR QD 1 34 PRO QG 4.779 . 7.634 3.444 2.218 3.637 . 0 0 "[ . 1 .]" 1
185 1 26 TYR QD 1 42 ALA MB 3.490 . 5.012 3.067 2.006 4.006 . 0 0 "[ . 1 .]" 1
186 1 26 TYR QD 1 49 ALA MB 4.556 . 7.151 6.963 6.550 7.237 0.086 13 0 "[ . 1 .]" 1
187 1 56 TYR QB 1 56 TYR QD 3.140 . 4.373 2.139 2.136 2.142 . 0 0 "[ . 1 .]" 1
188 1 45 SER HA 1 56 TYR QD 4.161 . 6.325 4.463 3.777 5.147 . 0 0 "[ . 1 .]" 1
189 1 46 ALA MB 1 56 TYR QD 3.355 . 4.762 2.767 2.657 2.880 . 0 0 "[ . 1 .]" 1
190 1 33 TYR HA 1 33 TYR HD1 3.029 . 4.176 3.216 2.268 4.301 0.125 5 0 "[ . 1 .]" 1
191 1 23 LEU HB2 1 33 TYR HD1 5.319 . 8.855 5.818 3.682 8.798 . 0 0 "[ . 1 .]" 1
192 1 73 ASP QB 1 75 GLN HE22 3.327 . 4.711 3.481 2.407 4.603 . 0 0 "[ . 1 .]" 1
193 1 33 TYR QB 1 33 TYR HD1 3.280 . 4.250 2.465 2.265 2.712 . 0 0 "[ . 1 .]" 1
194 1 75 GLN HB3 1 75 GLN HE22 4.798 . 7.675 4.418 4.279 4.529 . 0 0 "[ . 1 .]" 1
195 1 27 LYS HD2 1 33 TYR HD1 4.024 . 6.049 3.931 3.240 4.805 . 0 0 "[ . 1 .]" 1
196 1 33 TYR HD1 1 85 VAL QG 3.753 . 4.747 2.946 2.178 3.743 . 0 0 "[ . 1 .]" 1
197 1 27 LYS QE 1 33 TYR HD1 4.206 . 6.417 4.989 3.565 6.573 0.156 13 0 "[ . 1 .]" 1
198 1 75 GLN QG 1 88 PHE QD 3.736 . 5.481 4.200 3.806 4.823 . 0 0 "[ . 1 .]" 1
199 1 106 THR H 1 106 THR HB 3.380 . 4.808 2.845 2.489 3.646 . 0 0 "[ . 1 .]" 1
200 1 88 PHE HA 1 88 PHE QD 4.437 . 6.897 3.719 3.686 3.737 . 0 0 "[ . 1 .]" 1
201 1 88 PHE HZ 1 96 PRO QB 4.885 . 7.868 3.511 2.564 4.049 . 0 0 "[ . 1 .]" 1
202 1 8 ASP HB2 1 70 TRP HZ3 4.438 . 6.900 6.034 5.356 6.677 . 0 0 "[ . 1 .]" 1
203 1 12 VAL QG 1 70 TRP HZ3 2.415 . 3.144 2.124 1.957 2.326 . 0 0 "[ . 1 .]" 1
204 1 74 TYR QD 1 87 ILE MG 3.851 . 5.705 5.162 4.283 5.763 0.058 14 0 "[ . 1 .]" 1
205 1 74 TYR QD 1 89 SER HB3 4.099 . 6.199 3.542 1.988 4.757 0.011 7 0 "[ . 1 .]" 1
206 1 74 TYR HA 1 74 TYR QD 3.615 . 5.249 2.837 2.340 3.141 . 0 0 "[ . 1 .]" 1
207 1 17 VAL QG 1 74 TYR QD 5.162 . 8.493 7.258 6.484 7.865 . 0 0 "[ . 1 .]" 1
208 1 41 GLN HE21 1 41 GLN HG2 4.602 . 5.815 3.670 3.448 4.068 . 0 0 "[ . 1 .]" 1
209 1 41 GLN HE21 1 44 VAL QG 3.776 . 3.930 3.370 2.583 4.815 0.885 5 2 "[ + -1 .]" 1
210 1 27 LYS QE 1 33 TYR QE 3.960 . 5.300 3.175 2.636 3.991 . 0 0 "[ . 1 .]" 1
211 1 27 LYS HD3 1 33 TYR QE 4.679 . 7.416 3.691 3.364 4.032 . 0 0 "[ . 1 .]" 1
212 1 23 LEU HB2 1 33 TYR QE 5.287 . 8.781 3.914 2.901 5.559 . 0 0 "[ . 1 .]" 1
213 1 33 TYR QE 1 84 GLN QB 4.062 . 4.971 3.277 2.699 3.692 . 0 0 "[ . 1 .]" 1
214 1 66 PRO HB2 1 74 TYR QE 3.779 . 5.564 2.783 2.127 3.517 . 0 0 "[ . 1 .]" 1
215 1 66 PRO QG 1 74 TYR QE 4.267 . 6.543 4.277 3.844 4.839 . 0 0 "[ . 1 .]" 1
216 1 19 LEU QD 1 74 TYR QE 4.316 . 6.645 3.525 2.912 4.003 . 0 0 "[ . 1 .]" 1
217 1 26 TYR HA 1 30 ASN QD 3.635 . 5.287 2.929 2.197 4.722 . 0 0 "[ . 1 .]" 1
218 1 88 PHE HA 1 89 SER HB3 4.687 . 7.433 5.078 4.358 5.655 . 0 0 "[ . 1 .]" 1
219 1 74 TYR HA 1 88 PHE HA 4.583 . 7.209 5.967 5.517 6.618 . 0 0 "[ . 1 .]" 1
220 1 87 ILE HA 1 87 ILE MG 2.026 . 2.539 2.238 2.187 2.274 . 0 0 "[ . 1 .]" 1
221 1 87 ILE HA 1 87 ILE MD 4.052 . 6.104 4.187 4.173 4.197 . 0 0 "[ . 1 .]" 1
222 1 76 LEU HA 1 76 LEU QD . . 2.751 2.128 2.020 2.347 . 0 0 "[ . 1 .]" 1
223 1 79 PRO HA 1 84 GLN HA 3.788 . 5.581 4.258 3.284 4.872 . 0 0 "[ . 1 .]" 1
224 1 34 PRO HA 1 35 THR HA 4.220 . 6.446 4.373 4.327 4.404 . 0 0 "[ . 1 .]" 1
225 1 35 THR HA 1 37 GLU HB3 4.836 . 7.759 6.693 6.197 7.960 0.201 13 0 "[ . 1 .]" 1
226 1 35 THR HA 1 85 VAL QG 3.187 . 4.456 3.799 3.303 4.372 . 0 0 "[ . 1 .]" 1
227 1 77 LEU HA 1 77 LEU QB 3.133 . 3.463 2.427 2.400 2.495 . 0 0 "[ . 1 .]" 1
228 1 30 ASN HA 1 30 ASN QB 3.077 . 4.261 2.392 2.355 2.513 . 0 0 "[ . 1 .]" 1
229 1 76 LEU QD 1 77 LEU HA 3.066 . 4.241 3.346 2.969 3.981 . 0 0 "[ . 1 .]" 1
230 1 77 LEU HA 1 77 LEU MD1 3.025 . 4.169 3.081 2.833 3.817 . 0 0 "[ . 1 .]" 1
231 1 77 LEU HA 1 77 LEU MD2 2.130 . 2.697 1.958 1.894 2.329 . 0 0 "[ . 1 .]" 1
232 1 88 PHE HA 1 103 GLY QA 3.927 . 4.007 2.073 1.867 2.371 0.133 2 0 "[ . 1 .]" 1
233 1 77 LEU HA 1 80 GLY QA 4.107 . 6.216 5.101 4.775 5.465 . 0 0 "[ . 1 .]" 1
234 1 88 PHE HB3 1 103 GLY QA 3.677 . 5.367 2.600 2.137 3.013 . 0 0 "[ . 1 .]" 1
235 1 88 PHE HB2 1 103 GLY QA 4.212 . 6.430 3.264 2.740 3.890 . 0 0 "[ . 1 .]" 1
236 1 77 LEU HA 1 77 LEU HG 3.488 . 5.009 3.613 2.590 3.716 . 0 0 "[ . 1 .]" 1
237 1 16 LEU QD 1 103 GLY QA . . 4.666 2.559 2.068 3.099 . 0 0 "[ . 1 .]" 1
238 1 105 TRP HA 1 106 THR HA 3.795 . 5.595 4.740 4.599 4.866 . 0 0 "[ . 1 .]" 1
239 1 90 LEU HA 1 96 PRO HA 3.181 . 4.446 3.124 2.568 3.957 . 0 0 "[ . 1 .]" 1
240 1 96 PRO HA 1 97 GLU HA 4.602 . 7.249 4.420 4.365 4.486 . 0 0 "[ . 1 .]" 1
241 1 71 GLY HA2 1 72 SER HA 3.554 . 5.133 4.545 4.505 4.584 . 0 0 "[ . 1 .]" 1
242 1 105 TRP HA 1 108 GLY QA 4.157 . 5.065 3.833 2.680 4.830 . 0 0 "[ . 1 .]" 1
243 1 67 GLN HB2 1 72 SER HA 4.802 . 7.684 6.427 5.949 6.728 . 0 0 "[ . 1 .]" 1
244 1 90 LEU QD 1 96 PRO HA 2.234 . 2.858 2.426 2.014 2.876 0.018 8 0 "[ . 1 .]" 1
245 1 102 ILE MG 1 103 GLY QA 4.457 . 6.940 3.569 3.416 3.786 . 0 0 "[ . 1 .]" 1
246 1 72 SER HA 1 72 SER HB3 2.364 . 3.062 2.396 2.285 2.482 . 0 0 "[ . 1 .]" 1
247 1 90 LEU HB2 1 96 PRO HA 4.524 . 7.083 5.561 5.025 6.173 . 0 0 "[ . 1 .]" 1
248 1 42 ALA HA 1 53 ALA MB 3.983 . 5.966 4.128 3.658 4.619 . 0 0 "[ . 1 .]" 1
249 1 42 ALA HA 1 46 ALA MB 4.562 . 7.164 5.074 4.693 5.353 . 0 0 "[ . 1 .]" 1
250 1 67 GLN HA 1 73 ASP HA 2.822 . 3.817 2.635 2.261 3.292 . 0 0 "[ . 1 .]" 1
251 1 49 ALA HA 1 51 PRO HA 5.505 . 9.294 6.481 6.276 6.646 . 0 0 "[ . 1 .]" 1
252 1 42 ALA HA 1 46 ALA HA 3.872 . 5.746 3.703 3.253 3.993 . 0 0 "[ . 1 .]" 1
253 1 42 ALA HA 1 42 ALA MB 2.044 . 2.566 2.122 2.119 2.126 . 0 0 "[ . 1 .]" 1
254 1 44 VAL HA 1 65 LEU HA 4.147 . 6.297 5.649 5.188 5.882 . 0 0 "[ . 1 .]" 1
255 1 73 ASP HA 1 73 ASP QB 3.538 . 3.675 2.326 2.178 2.393 . 0 0 "[ . 1 .]" 1
256 1 67 GLN HB2 1 73 ASP HA 4.684 . 7.427 4.754 4.318 5.260 . 0 0 "[ . 1 .]" 1
257 1 44 VAL HA 1 44 VAL HB 2.729 . 3.660 2.573 2.365 3.024 . 0 0 "[ . 1 .]" 1
258 1 44 VAL HA 1 44 VAL QG 2.182 . 2.777 2.289 2.130 2.394 . 0 0 "[ . 1 .]" 1
259 1 44 VAL HA 1 60 GLY HA2 4.705 . 6.568 4.454 3.968 5.202 . 0 0 "[ . 1 .]" 1
260 1 66 PRO HA 1 66 PRO HB3 2.694 . 3.601 2.283 2.257 2.303 . 0 0 "[ . 1 .]" 1
261 1 27 LYS HA 1 33 TYR HA 3.688 . 5.388 3.837 3.549 4.314 . 0 0 "[ . 1 .]" 1
262 1 29 ASP HA 1 30 ASN HA 4.106 . 6.213 4.568 4.517 4.622 . 0 0 "[ . 1 .]" 1
263 1 22 ALA HA 1 43 LEU HA 3.750 . 5.507 4.749 4.464 5.067 . 0 0 "[ . 1 .]" 1
264 1 22 ALA MB 1 43 LEU HA 3.749 . 5.506 3.148 2.778 3.358 . 0 0 "[ . 1 .]" 1
265 1 68 ASP HA 1 69 PRO HA 4.254 . 6.516 4.382 4.267 4.487 . 0 0 "[ . 1 .]" 1
266 1 43 LEU HA 1 61 TYR HA 4.918 . 7.942 5.451 4.914 5.696 . 0 0 "[ . 1 .]" 1
267 1 43 LEU HA 1 61 TYR HB2 3.952 . 5.904 3.374 2.294 4.048 . 0 0 "[ . 1 .]" 1
268 1 28 LEU HG 1 29 ASP HA 3.831 . 5.665 3.918 3.558 5.775 0.110 9 0 "[ . 1 .]" 1
269 1 28 LEU QD 1 29 ASP HA 4.076 . 5.582 4.111 2.623 4.341 . 0 0 "[ . 1 .]" 1
270 1 45 SER HA 1 46 ALA HA 4.044 . 5.116 4.317 4.252 4.425 . 0 0 "[ . 1 .]" 1
271 1 45 SER HA 1 59 GLY HA2 3.865 . 5.732 4.953 3.660 5.562 . 0 0 "[ . 1 .]" 1
272 1 48 SER HA 1 49 ALA HA 3.654 . 5.323 4.735 4.353 4.832 . 0 0 "[ . 1 .]" 1
273 1 28 LEU HA 1 29 ASP HA 4.138 . 6.279 4.691 4.652 4.723 . 0 0 "[ . 1 .]" 1
274 1 70 TRP HA 1 71 GLY HA2 4.283 . 6.576 4.974 4.878 5.049 . 0 0 "[ . 1 .]" 1
275 1 32 ARG HA 1 32 ARG HG3 4.384 . 6.786 3.623 3.587 3.666 . 0 0 "[ . 1 .]" 1
276 1 27 LYS QE 1 32 ARG HA 2.647 . 3.523 3.381 3.148 3.509 . 0 0 "[ . 1 .]" 1
277 1 67 GLN HA 1 67 GLN HB3 2.827 . 3.826 2.512 2.446 2.594 . 0 0 "[ . 1 .]" 1
278 1 54 ARG HA 1 54 ARG QG 3.006 . 4.135 2.956 2.817 3.124 . 0 0 "[ . 1 .]" 1
279 1 49 ALA HA 1 49 ALA MB 2.020 . 2.530 2.131 2.128 2.135 . 0 0 "[ . 1 .]" 1
280 1 42 ALA MB 1 47 PRO HA 4.169 . 6.342 6.134 5.378 6.384 0.042 3 0 "[ . 1 .]" 1
281 1 67 GLN HA 1 69 PRO HD3 4.918 . 7.942 6.372 6.002 6.671 . 0 0 "[ . 1 .]" 1
282 1 56 TYR HA 1 56 TYR QB 3.085 . 3.975 2.191 2.182 2.199 . 0 0 "[ . 1 .]" 1
283 1 89 SER HA 1 89 SER HB3 2.853 . 3.871 2.493 2.355 3.028 . 0 0 "[ . 1 .]" 1
284 1 31 SER QB 1 32 ARG HA 3.998 . 5.469 4.432 3.962 4.696 . 0 0 "[ . 1 .]" 1
285 1 61 TYR HA 1 62 ILE HA 3.672 . 5.358 4.477 4.381 4.539 . 0 0 "[ . 1 .]" 1
286 1 62 ILE HA 1 63 ARG HA 4.060 . 5.405 4.240 4.202 4.279 . 0 0 "[ . 1 .]" 1
287 1 12 VAL QG 1 89 SER HA 3.876 . 5.754 4.341 3.983 4.900 . 0 0 "[ . 1 .]" 1
288 1 62 ILE HA 1 62 ILE MD 3.631 . 5.279 3.812 3.780 3.856 . 0 0 "[ . 1 .]" 1
289 1 79 PRO HA 1 85 VAL HA 4.000 . 6.000 3.646 3.346 3.969 . 0 0 "[ . 1 .]" 1
290 1 84 GLN HA 1 85 VAL HA 3.644 . 5.304 4.528 4.486 4.570 . 0 0 "[ . 1 .]" 1
291 1 85 VAL HA 1 85 VAL HB 2.459 . 3.215 2.567 2.480 2.664 . 0 0 "[ . 1 .]" 1
292 1 85 VAL HA 1 85 VAL QG 2.383 . 3.093 2.210 2.150 2.292 . 0 0 "[ . 1 .]" 1
293 1 22 ALA HA 1 22 ALA MB 2.022 . 2.533 2.127 2.119 2.133 . 0 0 "[ . 1 .]" 1
294 1 62 ILE HA 1 62 ILE MG 2.994 . 4.115 3.216 3.208 3.221 . 0 0 "[ . 1 .]" 1
295 1 21 GLY QA 1 22 ALA HA 4.310 . 6.632 4.049 4.005 4.074 . 0 0 "[ . 1 .]" 1
296 1 64 ARG HA 1 64 ARG QB 2.559 . 2.924 2.373 2.185 2.427 . 0 0 "[ . 1 .]" 1
297 1 64 ARG HA 1 64 ARG QG 3.514 . 5.057 2.503 2.334 3.338 . 0 0 "[ . 1 .]" 1
298 1 19 LEU QD 1 74 TYR HA 4.331 . 6.676 4.218 4.057 4.598 . 0 0 "[ . 1 .]" 1
299 1 44 VAL QG 1 64 ARG HA 2.429 . 3.167 2.580 2.066 2.916 . 0 0 "[ . 1 .]" 1
300 1 53 ALA HA 1 53 ALA MB 1.992 . 2.488 2.127 2.125 2.130 . 0 0 "[ . 1 .]" 1
301 1 11 LYS HA 1 15 ASP HA 4.376 . 6.770 6.774 6.405 6.884 0.114 5 0 "[ . 1 .]" 1
302 1 44 VAL HA 1 60 GLY HA3 2.928 . 4.000 2.799 2.312 3.457 . 0 0 "[ . 1 .]" 1
303 1 75 GLN HA 1 75 GLN QG 4.064 . 5.235 2.790 2.445 2.979 . 0 0 "[ . 1 .]" 1
304 1 106 THR HA 1 108 GLY QA 5.215 . 8.614 5.167 4.843 5.529 . 0 0 "[ . 1 .]" 1
305 1 39 GLY HA3 1 76 LEU QD 2.949 . 4.036 2.432 1.840 2.991 0.022 14 0 "[ . 1 .]" 1
306 1 48 SER HA 1 49 ALA MB 4.650 . 7.353 4.891 4.534 4.994 . 0 0 "[ . 1 .]" 1
307 1 39 GLY HA3 1 40 LEU HA 3.836 . 5.675 4.307 4.285 4.322 . 0 0 "[ . 1 .]" 1
308 1 12 VAL HA 1 12 VAL QG 2.210 . 2.821 2.132 2.110 2.153 . 0 0 "[ . 1 .]" 1
309 1 5 GLU HA 1 5 GLU QG 2.785 . 3.755 2.663 2.447 2.892 . 0 0 "[ . 1 .]" 1
310 1 8 ASP HA 1 69 PRO HB3 4.120 . 6.242 4.142 3.525 4.611 . 0 0 "[ . 1 .]" 1
311 1 63 ARG HA 1 63 ARG HG3 2.521 . 3.315 2.867 2.420 3.268 . 0 0 "[ . 1 .]" 1
312 1 77 LEU MD1 1 81 GLN HA 3.682 . 5.377 4.789 4.405 5.319 . 0 0 "[ . 1 .]" 1
313 1 36 THR HA 1 77 LEU MD2 4.068 . 6.136 4.732 4.244 5.435 . 0 0 "[ . 1 .]" 1
314 1 27 LYS QE 1 31 SER HA 3.843 . 5.689 4.629 3.884 5.395 . 0 0 "[ . 1 .]" 1
315 1 102 ILE HA 1 102 ILE MG 2.420 . 3.152 2.417 2.311 2.505 . 0 0 "[ . 1 .]" 1
316 1 7 ALA HA 1 7 ALA MB 1.807 . 2.215 2.128 2.125 2.131 . 0 0 "[ . 1 .]" 1
317 1 11 LYS HA 1 69 PRO HA 5.063 . 8.267 8.061 7.529 8.305 0.038 10 0 "[ . 1 .]" 1
318 1 100 ASP HA 1 101 ASP HA 4.085 . 6.171 4.630 4.194 4.944 . 0 0 "[ . 1 .]" 1
319 1 6 LYS HA 1 6 LYS QB 2.611 . 3.463 2.367 2.344 2.409 . 0 0 "[ . 1 .]" 1
320 1 11 LYS HA 1 11 LYS QB 2.541 . 2.740 2.346 2.261 2.399 . 0 0 "[ . 1 .]" 1
321 1 82 HIS HA 1 83 GLY HA3 4.165 . 6.333 4.885 4.567 5.205 . 0 0 "[ . 1 .]" 1
322 1 14 SER HA 1 17 VAL QG 2.616 . 3.472 2.406 2.107 3.193 . 0 0 "[ . 1 .]" 1
323 1 8 ASP HA 1 9 ARG HA 3.646 . 5.308 4.684 4.639 4.738 . 0 0 "[ . 1 .]" 1
324 1 9 ARG HA 1 9 ARG QD 4.002 . 6.004 4.367 4.212 4.507 . 0 0 "[ . 1 .]" 1
325 1 10 GLN HA 1 13 VAL HB 2.456 . 2.811 2.694 2.346 2.950 0.139 9 0 "[ . 1 .]" 1
326 1 87 ILE HG13 1 104 ASN HA 3.512 . 5.054 4.138 3.750 4.555 . 0 0 "[ . 1 .]" 1
327 1 104 ASN HA 1 107 ILE MG 2.388 . 3.101 2.220 1.902 2.998 . 0 0 "[ . 1 .]" 1
328 1 5 GLU HA 1 9 ARG HA 4.095 . 6.191 6.110 5.536 6.285 0.094 10 0 "[ . 1 .]" 1
329 1 10 GLN HA 1 10 GLN HB2 2.813 . 3.802 3.009 3.000 3.021 . 0 0 "[ . 1 .]" 1
330 1 28 LEU HA 1 28 LEU HG 2.943 . 4.025 3.108 2.503 3.641 . 0 0 "[ . 1 .]" 1
331 1 27 LYS HA 1 27 LYS HG2 2.147 . 2.723 3.081 2.935 3.218 0.495 8 0 "[ . 1 .]" 1
332 1 9 ARG HA 1 12 VAL QG 2.654 . 3.535 2.330 2.071 2.659 . 0 0 "[ . 1 .]" 1
333 1 27 LYS HA 1 32 ARG HA 4.526 . 7.087 3.900 3.419 4.226 . 0 0 "[ . 1 .]" 1
334 1 27 LYS HA 1 27 LYS QE 4.768 . 7.609 4.744 4.536 4.919 . 0 0 "[ . 1 .]" 1
335 1 41 GLN HA 1 41 GLN HG3 2.992 . 4.087 3.603 2.948 3.728 . 0 0 "[ . 1 .]" 1
336 1 41 GLN HA 1 44 VAL HB 3.357 . 4.765 4.023 2.279 4.802 0.037 13 0 "[ . 1 .]" 1
337 1 27 LYS HA 1 27 LYS HD2 4.929 . 7.965 4.365 4.218 4.437 . 0 0 "[ . 1 .]" 1
338 1 41 GLN HA 1 41 GLN HB3 2.565 . 3.388 2.552 2.501 2.654 . 0 0 "[ . 1 .]" 1
339 1 27 LYS HA 1 29 ASP HA 4.587 . 7.218 6.472 6.409 6.644 . 0 0 "[ . 1 .]" 1
340 1 37 GLU HA 1 37 GLU QG 3.052 . 4.216 2.731 2.428 3.015 . 0 0 "[ . 1 .]" 1
341 1 16 LEU QD 1 19 LEU HA 4.687 . 7.433 5.570 5.326 5.837 . 0 0 "[ . 1 .]" 1
342 1 18 ALA MB 1 19 LEU HA 3.213 . 4.503 3.894 3.864 3.930 . 0 0 "[ . 1 .]" 1
343 1 47 PRO HA 1 48 SER HB3 4.778 . 7.631 5.232 4.663 5.694 . 0 0 "[ . 1 .]" 1
344 1 19 LEU HA 1 19 LEU QB 3.026 . 3.113 2.416 2.370 2.507 . 0 0 "[ . 1 .]" 1
345 1 21 GLY QA 1 24 ASP HB3 4.370 . 6.757 3.303 2.483 4.309 . 0 0 "[ . 1 .]" 1
346 1 19 LEU HA 1 22 ALA MB 2.275 . 2.922 2.818 2.650 2.957 0.035 11 0 "[ . 1 .]" 1
347 1 48 SER HA 1 48 SER HB3 2.277 . 2.925 2.441 2.320 3.030 0.105 12 0 "[ . 1 .]" 1
348 1 23 LEU HA 1 25 MET HA 4.284 . 6.578 6.634 6.593 6.688 0.110 14 0 "[ . 1 .]" 1
349 1 40 LEU HA 1 40 LEU QD 2.005 . 2.507 2.028 1.796 2.476 . 0 0 "[ . 1 .]" 1
350 1 19 LEU HA 1 19 LEU QD . . 2.262 2.067 1.946 2.330 0.068 8 0 "[ . 1 .]" 1
351 1 23 LEU HA 1 26 TYR HA 4.800 . 7.680 5.495 5.242 5.824 . 0 0 "[ . 1 .]" 1
352 1 48 SER HB3 1 52 HIS HA 4.344 . 6.702 6.511 6.138 6.843 0.141 12 0 "[ . 1 .]" 1
353 1 80 GLY QA 1 81 GLN HA 4.243 . 6.494 3.969 3.933 4.012 . 0 0 "[ . 1 .]" 1
354 1 77 LEU QB 1 80 GLY QA 2.938 . 4.017 3.098 2.512 3.525 . 0 0 "[ . 1 .]" 1
355 1 39 GLY HA2 1 76 LEU QD 3.140 . 4.372 3.633 3.169 4.029 . 0 0 "[ . 1 .]" 1
356 1 77 LEU MD1 1 80 GLY QA 2.519 . 3.312 2.850 2.216 3.260 . 0 0 "[ . 1 .]" 1
357 1 12 VAL QG 1 89 SER HB3 2.864 . 3.889 2.702 2.180 3.139 . 0 0 "[ . 1 .]" 1
358 1 107 ILE HA 1 108 GLY QA 4.523 . 7.080 4.196 4.126 4.321 . 0 0 "[ . 1 .]" 1
359 1 80 GLY QA 1 85 VAL HA 3.141 . 4.374 2.768 2.481 3.157 . 0 0 "[ . 1 .]" 1
360 1 20 GLU HA 1 20 GLU QG 2.781 . 3.748 2.473 2.330 2.715 . 0 0 "[ . 1 .]" 1
361 1 20 GLU HA 1 20 GLU HB3 2.701 . 3.613 2.884 2.539 3.026 . 0 0 "[ . 1 .]" 1
362 1 20 GLU HA 1 87 ILE MD 2.405 . 3.128 2.850 2.606 3.184 0.056 9 0 "[ . 1 .]" 1
363 1 79 PRO HA 1 80 GLY QA 4.064 . 6.128 3.857 3.824 3.883 . 0 0 "[ . 1 .]" 1
364 1 97 GLU HA 1 101 ASP HA 4.473 . 6.974 6.413 6.001 6.980 0.006 13 0 "[ . 1 .]" 1
365 1 45 SER HA 1 45 SER HB3 2.630 . 3.495 2.665 2.308 3.036 . 0 0 "[ . 1 .]" 1
366 1 16 LEU HA 1 19 LEU QB . . 2.709 2.645 2.517 2.706 . 0 0 "[ . 1 .]" 1
367 1 36 THR HB 1 77 LEU MD2 3.188 . 4.459 3.404 2.631 4.502 0.043 15 0 "[ . 1 .]" 1
368 1 17 VAL HA 1 17 VAL QG 2.133 . 2.702 2.261 2.132 2.317 . 0 0 "[ . 1 .]" 1
369 1 16 LEU HA 1 87 ILE MG 3.495 . 5.022 4.735 4.379 4.970 . 0 0 "[ . 1 .]" 1
370 1 16 LEU HA 1 16 LEU QB 2.964 . 4.062 2.402 2.357 2.428 . 0 0 "[ . 1 .]" 1
371 1 17 VAL HA 1 17 VAL HB 2.816 . 3.807 2.588 2.420 3.028 . 0 0 "[ . 1 .]" 1
372 1 36 THR HB 1 76 LEU QD 3.267 . 4.601 3.687 3.365 4.514 . 0 0 "[ . 1 .]" 1
373 1 16 LEU HA 1 19 LEU QD 2.414 . 3.142 2.177 1.986 2.563 . 0 0 "[ . 1 .]" 1
374 1 16 LEU HA 1 16 LEU QD 1.889 . 2.335 2.056 1.971 2.127 . 0 0 "[ . 1 .]" 1
375 1 96 PRO QB 1 97 GLU HA 4.152 . 6.307 4.400 4.230 4.523 . 0 0 "[ . 1 .]" 1
376 1 51 PRO HA 1 51 PRO QD 4.171 . 6.346 3.454 3.377 3.495 . 0 0 "[ . 1 .]" 1
377 1 51 PRO QB 1 51 PRO QD 4.223 . 6.452 2.782 2.740 2.841 . 0 0 "[ . 1 .]" 1
378 1 51 PRO QD 1 51 PRO QG 2.672 . 3.372 1.968 1.953 1.977 0.001 9 0 "[ . 1 .]" 1
379 1 88 PHE HA 1 88 PHE HB3 2.943 . 4.025 2.382 2.328 2.427 . 0 0 "[ . 1 .]" 1
380 1 90 LEU HB3 1 94 GLY HA2 3.893 . 5.787 2.134 1.897 2.500 0.102 4 0 "[ . 1 .]" 1
381 1 13 VAL HA 1 17 VAL HA 4.279 . 6.568 5.970 5.840 6.176 . 0 0 "[ . 1 .]" 1
382 1 13 VAL HA 1 16 LEU QB 3.389 . 3.396 2.138 2.038 2.218 . 0 0 "[ . 1 .]" 1
383 1 13 VAL HA 1 19 LEU QB 4.844 . 7.777 7.001 6.892 7.074 . 0 0 "[ . 1 .]" 1
384 1 13 VAL HA 1 13 VAL HB 2.903 . 3.957 3.025 3.019 3.027 . 0 0 "[ . 1 .]" 1
385 1 82 HIS HB3 1 105 TRP HB3 3.515 . 5.059 3.851 1.937 5.134 0.075 1 0 "[ . 1 .]" 1
386 1 82 HIS HB2 1 105 TRP HB3 3.574 . 5.171 4.046 2.847 4.939 . 0 0 "[ . 1 .]" 1
387 1 13 VAL HA 1 17 VAL QG 3.551 . 5.127 3.656 3.490 3.915 . 0 0 "[ . 1 .]" 1
388 1 12 VAL QG 1 13 VAL HA 2.844 . 3.855 3.294 3.087 3.579 . 0 0 "[ . 1 .]" 1
389 1 13 VAL HA 1 13 VAL QG 2.032 . 2.548 2.131 2.120 2.140 . 0 0 "[ . 1 .]" 1
390 1 13 VAL HA 1 107 ILE MG 3.667 . 5.348 4.063 3.826 4.347 . 0 0 "[ . 1 .]" 1
391 1 57 PRO HG2 1 60 GLY HA2 2.259 . 2.897 2.199 1.945 2.595 . 0 0 "[ . 1 .]" 1
392 1 46 ALA HA 1 53 ALA MB 2.756 . 3.705 2.752 2.369 2.999 . 0 0 "[ . 1 .]" 1
393 1 46 ALA HA 1 46 ALA MB 1.969 . 2.454 2.126 2.124 2.130 . 0 0 "[ . 1 .]" 1
394 1 6 LYS HA 1 9 ARG QD 4.515 . 7.063 2.659 2.018 4.050 . 0 0 "[ . 1 .]" 1
395 1 104 ASN HA 1 104 ASN HB2 2.897 . 3.946 2.509 2.425 2.670 . 0 0 "[ . 1 .]" 1
396 1 85 VAL HA 1 86 ASP QB 4.661 . 7.337 4.002 3.869 4.192 . 0 0 "[ . 1 .]" 1
397 1 63 ARG HA 1 63 ARG QD 4.041 . 6.082 4.056 3.845 4.237 . 0 0 "[ . 1 .]" 1
398 1 54 ARG HA 1 54 ARG QD 2.786 . 3.756 2.068 1.942 2.295 . 0 0 "[ . 1 .]" 1
399 1 43 LEU QB 1 61 TYR HB2 . . 3.369 2.728 2.188 3.442 0.073 14 0 "[ . 1 .]" 1
400 1 54 ARG HB3 1 54 ARG QD 3.667 . 5.348 2.808 2.379 3.278 . 0 0 "[ . 1 .]" 1
401 1 52 HIS HB3 1 54 ARG QD 3.784 . 5.574 3.818 2.819 4.980 . 0 0 "[ . 1 .]" 1
402 1 57 PRO QB 1 61 TYR HB2 4.395 . 6.809 6.304 5.893 6.455 . 0 0 "[ . 1 .]" 1
403 1 63 ARG HB3 1 63 ARG QD 3.044 . 4.203 2.609 2.300 2.965 . 0 0 "[ . 1 .]" 1
404 1 9 ARG QD 1 9 ARG QG . . 2.448 2.037 1.999 2.092 . 0 0 "[ . 1 .]" 1
405 1 63 ARG QD 1 63 ARG HG3 2.186 . 2.783 2.278 2.171 2.380 . 0 0 "[ . 1 .]" 1
406 1 54 ARG QD 1 54 ARG QG 2.137 . 2.708 2.041 1.993 2.092 . 0 0 "[ . 1 .]" 1
407 1 23 LEU HA 1 32 ARG QD 4.911 . 7.926 7.434 7.104 7.608 . 0 0 "[ . 1 .]" 1
408 1 32 ARG HA 1 32 ARG QD 4.107 . 6.216 3.809 3.704 3.979 . 0 0 "[ . 1 .]" 1
409 1 77 LEU QB 1 86 ASP QB 2.549 . 3.361 2.666 2.142 3.222 . 0 0 "[ . 1 .]" 1
410 1 77 LEU MD1 1 86 ASP QB 3.654 . 5.323 3.649 2.964 4.059 . 0 0 "[ . 1 .]" 1
411 1 32 ARG QD 1 33 TYR QB 3.620 . 5.258 4.167 3.729 4.723 . 0 0 "[ . 1 .]" 1
412 1 32 ARG QD 1 34 PRO HB3 4.060 . 6.120 5.057 4.664 5.294 . 0 0 "[ . 1 .]" 1
413 1 77 LEU MD2 1 86 ASP QB 4.897 . 7.895 5.043 3.935 5.597 . 0 0 "[ . 1 .]" 1
414 1 64 ARG QB 1 64 ARG HD3 3.705 . 5.071 2.719 2.380 3.461 . 0 0 "[ . 1 .]" 1
415 1 64 ARG HD3 1 64 ARG QG 2.535 . 3.338 2.284 2.169 2.363 . 0 0 "[ . 1 .]" 1
416 1 12 VAL HA 1 15 ASP QB 3.280 . 4.625 3.099 2.879 3.342 . 0 0 "[ . 1 .]" 1
417 1 15 ASP HA 1 15 ASP QB 3.377 . 3.450 2.414 2.370 2.474 . 0 0 "[ . 1 .]" 1
418 1 15 ASP QB 1 19 LEU QD 3.992 . 5.984 3.329 2.713 3.638 . 0 0 "[ . 1 .]" 1
419 1 92 PRO HD3 1 101 ASP HA 4.446 . 6.917 5.851 4.677 6.919 0.002 10 0 "[ . 1 .]" 1
420 1 108 GLY QA 1 109 PHE HB3 4.662 . 7.379 5.546 4.752 5.721 . 0 0 "[ . 1 .]" 1
421 1 90 LEU HB2 1 92 PRO HD3 4.495 . 7.021 6.897 6.531 7.257 0.236 7 0 "[ . 1 .]" 1
422 1 61 TYR HB3 1 62 ILE HB 3.297 . 4.656 4.511 4.238 4.659 0.003 12 0 "[ . 1 .]" 1
423 1 12 VAL QG 1 92 PRO HD3 4.208 . 6.421 5.066 4.562 5.331 . 0 0 "[ . 1 .]" 1
424 1 43 LEU QD 1 61 TYR HB3 3.692 . 5.395 3.913 2.724 4.682 . 0 0 "[ . 1 .]" 1
425 1 107 ILE MG 1 109 PHE HB3 4.365 . 6.746 4.246 2.326 5.125 . 0 0 "[ . 1 .]" 1
426 1 92 PRO HA 1 92 PRO HD3 4.044 . 6.088 3.826 3.603 3.882 . 0 0 "[ . 1 .]" 1
427 1 61 TYR HA 1 61 TYR HB3 2.849 . 3.863 2.508 2.429 2.592 . 0 0 "[ . 1 .]" 1
428 1 21 GLY QA 1 24 ASP HB2 2.958 . 4.052 3.169 2.451 4.124 0.072 7 0 "[ . 1 .]" 1
429 1 92 PRO HD3 1 92 PRO HG3 2.691 . 3.596 2.318 2.301 2.330 . 0 0 "[ . 1 .]" 1
430 1 61 TYR HB3 1 62 ILE MG 4.484 . 6.997 4.316 3.775 4.819 . 0 0 "[ . 1 .]" 1
431 1 33 TYR HA 1 33 TYR QB 2.798 . 3.776 2.454 2.397 2.488 . 0 0 "[ . 1 .]" 1
432 1 22 ALA HA 1 25 MET QG 2.970 . 4.073 3.405 2.350 3.988 . 0 0 "[ . 1 .]" 1
433 1 33 TYR QB 1 85 VAL QG 2.543 . 3.351 1.985 1.789 2.113 0.169 10 0 "[ . 1 .]" 1
434 1 5 GLU HA 1 8 ASP HB2 2.720 . 3.645 2.690 2.135 3.516 . 0 0 "[ . 1 .]" 1
435 1 93 ASP HA 1 93 ASP HB2 2.676 . 3.571 2.470 2.241 2.621 . 0 0 "[ . 1 .]" 1
436 1 8 ASP HB2 1 9 ARG QD 4.067 . 6.135 5.557 5.314 5.828 . 0 0 "[ . 1 .]" 1
437 1 25 MET QB 1 25 MET QG 2.837 . 3.843 2.036 1.979 2.088 . 0 0 "[ . 1 .]" 1
438 1 8 ASP HB2 1 69 PRO HG3 4.505 . 7.042 5.320 4.176 6.365 . 0 0 "[ . 1 .]" 1
439 1 53 ALA MB 1 56 TYR QB . . 3.088 2.959 2.722 3.073 . 0 0 "[ . 1 .]" 1
440 1 7 ALA MB 1 8 ASP HB2 4.241 . 6.490 4.467 4.283 4.653 . 0 0 "[ . 1 .]" 1
441 1 46 ALA MB 1 56 TYR QB 3.017 . 4.155 2.785 2.300 3.126 . 0 0 "[ . 1 .]" 1
442 1 99 ASN HA 1 99 ASN HB3 2.280 . 2.930 2.645 2.464 3.032 0.102 13 0 "[ . 1 .]" 1
443 1 100 ASP HA 1 100 ASP HB3 2.599 . 3.444 2.549 2.387 3.031 . 0 0 "[ . 1 .]" 1
444 1 27 LYS QE 1 33 TYR QB 7.156 . 13.556 4.998 4.490 5.665 . 0 0 "[ . 1 .]" 1
445 1 25 MET HA 1 25 MET QG 3.191 . 4.464 2.673 2.301 3.328 . 0 0 "[ . 1 .]" 1
446 1 54 ARG QD 1 56 TYR QB 4.432 . 6.695 5.618 5.353 5.916 . 0 0 "[ . 1 .]" 1
447 1 82 HIS HA 1 82 HIS HB3 2.882 . 3.920 2.439 2.378 2.479 . 0 0 "[ . 1 .]" 1
448 1 30 ASN QB 1 32 ARG HG3 3.179 . 4.442 2.825 2.331 3.484 . 0 0 "[ . 1 .]" 1
449 1 24 ASP HA 1 24 ASP HB3 2.837 . 3.843 2.860 2.555 3.031 . 0 0 "[ . 1 .]" 1
450 1 29 ASP HA 1 29 ASP HB3 2.621 . 3.480 2.932 2.538 3.025 . 0 0 "[ . 1 .]" 1
451 1 100 ASP HB2 1 101 ASP HB2 4.469 . 6.966 6.158 5.550 6.472 . 0 0 "[ . 1 .]" 1
452 1 27 LYS QE 1 27 LYS HG2 2.609 . 3.460 2.724 2.364 2.957 . 0 0 "[ . 1 .]" 1
453 1 79 PRO HA 1 79 PRO HB3 2.330 . 3.009 2.290 2.260 2.326 . 0 0 "[ . 1 .]" 1
454 1 79 PRO HB3 1 79 PRO HG3 2.419 . 3.151 2.300 2.267 2.323 . 0 0 "[ . 1 .]" 1
455 1 79 PRO HB3 1 85 VAL QG 4.741 . 7.551 5.083 4.717 5.604 . 0 0 "[ . 1 .]" 1
456 1 41 GLN HG3 1 44 VAL QG 4.483 . 6.995 4.696 3.826 5.503 . 0 0 "[ . 1 .]" 1
457 1 54 ARG HA 1 55 ASN QB 4.235 . 6.477 4.643 4.365 4.855 . 0 0 "[ . 1 .]" 1
458 1 54 ARG HB3 1 55 ASN QB 4.188 . 6.380 4.076 3.574 4.383 . 0 0 "[ . 1 .]" 1
459 1 92 PRO HA 1 92 PRO HB3 2.752 . 3.698 2.272 2.264 2.297 . 0 0 "[ . 1 .]" 1
460 1 38 GLN HG3 1 49 ALA MB 2.325 . 3.001 2.866 2.527 3.216 0.215 12 0 "[ . 1 .]" 1
461 1 84 GLN HA 1 84 GLN QG 2.692 . 3.598 2.834 2.360 3.020 . 0 0 "[ . 1 .]" 1
462 1 104 ASN HA 1 104 ASN HB3 2.712 . 3.631 2.658 2.354 3.027 . 0 0 "[ . 1 .]" 1
463 1 74 TYR HA 1 74 TYR HB3 2.625 . 3.486 2.539 2.420 2.608 . 0 0 "[ . 1 .]" 1
464 1 73 ASP HA 1 74 TYR HB3 5.047 . 8.232 5.722 5.664 5.816 . 0 0 "[ . 1 .]" 1
465 1 93 ASP HA 1 93 ASP HB3 2.609 . 3.460 2.459 2.318 2.894 . 0 0 "[ . 1 .]" 1
466 1 84 GLN QB 1 84 GLN QG 2.771 . 3.731 1.993 1.973 2.014 . 0 0 "[ . 1 .]" 1
467 1 25 MET HA 1 25 MET QB 3.181 . 4.445 2.382 2.177 2.423 . 0 0 "[ . 1 .]" 1
468 1 22 ALA HA 1 25 MET QB 2.746 . 3.689 2.611 2.350 2.844 . 0 0 "[ . 1 .]" 1
469 1 5 GLU QG 1 9 ARG QD 3.088 . 4.280 2.840 2.229 3.915 . 0 0 "[ . 1 .]" 1
470 1 10 GLN HB3 1 10 GLN HG3 2.981 . 4.092 2.736 2.373 3.011 . 0 0 "[ . 1 .]" 1
471 1 22 ALA MB 1 25 MET QB 4.016 . 6.032 3.980 3.499 4.265 . 0 0 "[ . 1 .]" 1
472 1 7 ALA MB 1 10 GLN HG3 4.500 . 7.031 5.086 4.741 5.439 . 0 0 "[ . 1 .]" 1
473 1 24 ASP HB2 1 25 MET QB 4.618 . 7.284 5.430 4.566 6.140 . 0 0 "[ . 1 .]" 1
474 1 12 VAL HA 1 12 VAL HB 2.907 . 3.963 3.021 3.009 3.029 . 0 0 "[ . 1 .]" 1
475 1 9 ARG HA 1 12 VAL HB 2.218 . 2.833 2.352 2.085 2.514 . 0 0 "[ . 1 .]" 1
476 1 47 PRO HB2 1 48 SER HA 4.135 . 6.272 4.698 4.620 4.786 . 0 0 "[ . 1 .]" 1
477 1 10 GLN HA 1 10 GLN HG3 2.870 . 3.900 3.271 2.755 3.739 . 0 0 "[ . 1 .]" 1
478 1 9 ARG QG 1 10 GLN HG3 4.088 . 6.177 3.567 2.692 4.552 . 0 0 "[ . 1 .]" 1
479 1 33 TYR QB 1 76 LEU QD 4.399 . 5.850 4.226 3.924 4.477 . 0 0 "[ . 1 .]" 1
480 1 12 VAL HB 1 12 VAL QG 1.899 . 2.235 1.892 1.887 1.896 . 0 0 "[ . 1 .]" 1
481 1 47 PRO HB2 1 52 HIS HA 3.242 . 4.556 3.829 3.567 4.087 . 0 0 "[ . 1 .]" 1
482 1 46 ALA HA 1 47 PRO HB2 3.917 . 5.835 4.950 4.843 5.038 . 0 0 "[ . 1 .]" 1
483 1 34 PRO HB2 1 38 GLN HB3 3.666 . 5.346 3.065 2.737 3.474 . 0 0 "[ . 1 .]" 1
484 1 47 PRO HB2 1 53 ALA MB 2.800 . 3.780 3.791 3.692 3.873 0.093 9 0 "[ . 1 .]" 1
485 1 46 ALA MB 1 47 PRO HB2 3.679 . 5.371 4.922 4.786 5.051 . 0 0 "[ . 1 .]" 1
486 1 38 GLN HB3 1 38 GLN HG3 2.381 . 3.090 2.968 2.414 3.011 . 0 0 "[ . 1 .]" 1
487 1 57 PRO HA 1 58 GLU HG3 5.200 . 8.580 4.309 3.745 5.656 . 0 0 "[ . 1 .]" 1
488 1 8 ASP HA 1 8 ASP HB3 2.746 . 3.689 2.563 2.498 2.615 . 0 0 "[ . 1 .]" 1
489 1 73 ASP QB 1 74 TYR HB3 4.839 . 7.766 6.057 5.571 6.574 . 0 0 "[ . 1 .]" 1
490 1 73 ASP QB 1 75 GLN QG 4.061 . 6.123 4.522 3.905 5.238 . 0 0 "[ . 1 .]" 1
491 1 75 GLN QG 1 96 PRO QG . . 5.013 4.229 3.367 4.749 . 0 0 "[ . 1 .]" 1
492 1 8 ASP HB3 1 69 PRO HB3 3.479 . 4.992 4.486 3.713 5.184 0.192 5 0 "[ . 1 .]" 1
493 1 8 ASP HB3 1 69 PRO HG3 3.606 . 5.232 3.782 2.504 4.850 . 0 0 "[ . 1 .]" 1
494 1 58 GLU HA 1 58 GLU HG3 2.624 . 3.485 2.960 2.421 3.700 0.215 5 0 "[ . 1 .]" 1
495 1 44 VAL HB 1 45 SER HA 4.357 . 6.730 5.614 4.594 6.009 . 0 0 "[ . 1 .]" 1
496 1 67 GLN HG3 1 73 ASP HA 2.843 . 3.853 3.755 3.004 4.384 0.531 7 1 "[ . + 1 .]" 1
497 1 58 GLU HB3 1 58 GLU HG3 2.548 . 3.360 2.828 2.430 3.009 . 0 0 "[ . 1 .]" 1
498 1 20 GLU HA 1 23 LEU HB2 1.973 . 2.460 2.447 2.270 2.567 0.107 2 0 "[ . 1 .]" 1
499 1 22 ALA HA 1 23 LEU HB2 3.958 . 5.916 5.648 5.533 5.850 . 0 0 "[ . 1 .]" 1
500 1 21 GLY QA 1 23 LEU HB2 3.965 . 5.930 4.815 4.665 5.024 . 0 0 "[ . 1 .]" 1
501 1 23 LEU HB2 1 24 ASP HB2 4.375 . 6.768 4.579 3.979 4.929 . 0 0 "[ . 1 .]" 1
502 1 44 VAL HB 1 44 VAL QG 1.869 . 2.306 1.892 1.888 1.896 . 0 0 "[ . 1 .]" 1
503 1 66 PRO HA 1 66 PRO HB2 2.571 . 3.397 2.749 2.712 2.803 . 0 0 "[ . 1 .]" 1
504 1 84 GLN HA 1 84 GLN QB 2.629 . 3.493 2.406 2.336 2.499 . 0 0 "[ . 1 .]" 1
505 1 67 GLN HA 1 67 GLN HG3 2.590 . 3.428 3.040 2.911 3.161 . 0 0 "[ . 1 .]" 1
506 1 67 GLN HB3 1 67 GLN HG3 2.808 . 3.794 3.009 3.000 3.015 . 0 0 "[ . 1 .]" 1
507 1 84 GLN QB 1 85 VAL QG 2.811 . 3.799 2.601 2.422 2.711 . 0 0 "[ . 1 .]" 1
508 1 10 GLN HB2 1 10 GLN HG3 2.298 . 2.958 2.437 2.351 2.525 . 0 0 "[ . 1 .]" 1
509 1 22 ALA MB 1 43 LEU QB 2.529 . 3.328 2.346 1.759 3.353 0.025 14 0 "[ . 1 .]" 1
510 1 90 LEU HA 1 90 LEU HB2 2.661 . 3.546 2.998 2.852 3.023 . 0 0 "[ . 1 .]" 1
511 1 43 LEU HA 1 43 LEU QB 2.996 . 3.556 2.259 2.128 2.511 . 0 0 "[ . 1 .]" 1
512 1 7 ALA HA 1 10 GLN HB2 2.437 . 3.179 2.812 2.251 3.213 0.034 4 0 "[ . 1 .]" 1
513 1 90 LEU HB2 1 94 GLY HA3 4.731 . 7.529 4.563 4.044 5.285 . 0 0 "[ . 1 .]" 1
514 1 90 LEU HB2 1 94 GLY HA2 3.208 . 4.494 2.863 2.389 3.639 . 0 0 "[ . 1 .]" 1
515 1 7 ALA MB 1 10 GLN HB2 3.684 . 5.380 4.210 3.788 4.625 . 0 0 "[ . 1 .]" 1
516 1 43 LEU QB 1 62 ILE MG 3.389 . 4.620 2.271 1.770 2.744 0.184 13 0 "[ . 1 .]" 1
517 1 5 GLU HA 1 5 GLU HB3 2.885 . 3.925 3.019 2.998 3.028 . 0 0 "[ . 1 .]" 1
518 1 27 LYS QE 1 32 ARG QB 3.857 . 5.716 4.869 4.556 5.015 . 0 0 "[ . 1 .]" 1
519 1 11 LYS HA 1 13 VAL HB 4.162 . 6.327 5.178 4.982 5.467 . 0 0 "[ . 1 .]" 1
520 1 65 LEU HA 1 66 PRO HB3 4.425 . 6.872 4.970 4.839 5.112 . 0 0 "[ . 1 .]" 1
521 1 17 VAL HB 1 21 GLY QA 4.340 . 6.695 5.521 5.042 6.307 . 0 0 "[ . 1 .]" 1
522 1 5 GLU HB3 1 5 GLU QG 2.149 . 2.726 2.265 2.157 2.441 . 0 0 "[ . 1 .]" 1
523 1 17 VAL HB 1 17 VAL QG 1.933 . 2.154 1.893 1.891 1.898 . 0 0 "[ . 1 .]" 1
524 1 13 VAL HB 1 13 VAL QG 1.810 . 2.219 1.897 1.893 1.899 . 0 0 "[ . 1 .]" 1
525 1 37 GLU HA 1 37 GLU HB3 2.689 . 3.593 2.948 2.465 3.026 . 0 0 "[ . 1 .]" 1
526 1 32 ARG HA 1 32 ARG QB 2.463 . 3.128 2.178 2.168 2.189 . 0 0 "[ . 1 .]" 1
527 1 32 ARG QB 1 32 ARG QD . . 3.452 2.284 2.069 2.686 . 0 0 "[ . 1 .]" 1
528 1 51 PRO QB 1 52 HIS HB3 4.538 . 7.113 5.048 4.616 5.236 . 0 0 "[ . 1 .]" 1
529 1 8 ASP HB2 1 9 ARG QB 4.133 . 6.268 4.281 4.088 4.492 . 0 0 "[ . 1 .]" 1
530 1 11 LYS QB 1 12 VAL QG 2.955 . 4.047 3.214 2.945 3.414 . 0 0 "[ . 1 .]" 1
531 1 9 ARG HA 1 9 ARG QB 2.172 . 2.762 2.163 2.156 2.171 . 0 0 "[ . 1 .]" 1
532 1 8 ASP HA 1 11 LYS QB 2.768 . 3.726 3.031 2.688 3.352 . 0 0 "[ . 1 .]" 1
533 1 9 ARG QB 1 9 ARG QD 2.170 . 2.758 2.200 2.025 2.315 . 0 0 "[ . 1 .]" 1
534 1 9 ARG QB 1 9 ARG QG 2.294 . 2.952 2.083 2.080 2.087 . 0 0 "[ . 1 .]" 1
535 1 9 ARG QB 1 102 ILE MG 3.739 . 5.487 3.296 2.598 3.899 . 0 0 "[ . 1 .]" 1
536 1 26 TYR HA 1 26 TYR HB3 2.886 . 3.927 3.015 2.955 3.029 . 0 0 "[ . 1 .]" 1
537 1 23 LEU HA 1 26 TYR HB3 3.394 . 4.834 2.913 2.653 3.278 . 0 0 "[ . 1 .]" 1
538 1 77 LEU QB 1 77 LEU HG 2.327 . 3.004 2.173 2.154 2.328 . 0 0 "[ . 1 .]" 1
539 1 81 GLN HA 1 81 GLN HG3 2.904 . 3.958 2.871 2.444 3.636 . 0 0 "[ . 1 .]" 1
540 1 77 LEU QB 1 77 LEU MD1 1.912 . 2.369 2.220 2.075 2.272 . 0 0 "[ . 1 .]" 1
541 1 19 LEU QB 1 87 ILE MG 2.062 . 2.593 2.135 1.967 2.355 . 0 0 "[ . 1 .]" 1
542 1 107 ILE HA 1 107 ILE HB 2.590 . 3.429 2.435 2.378 2.502 . 0 0 "[ . 1 .]" 1
543 1 81 GLN QB 1 81 GLN HG3 3.043 . 3.767 2.308 2.129 2.432 . 0 0 "[ . 1 .]" 1
544 1 19 LEU QB 1 19 LEU QD 1.836 . 2.257 1.935 1.926 1.947 . 0 0 "[ . 1 .]" 1
545 1 107 ILE HB 1 107 ILE MG 1.944 . 2.416 2.121 2.116 2.125 . 0 0 "[ . 1 .]" 1
546 1 62 ILE MD 1 66 PRO QG 3.173 . 4.431 3.544 3.246 4.061 . 0 0 "[ . 1 .]" 1
547 1 6 LYS QB 1 7 ALA HA 3.569 . 5.161 3.921 3.732 4.223 . 0 0 "[ . 1 .]" 1
548 1 6 LYS QB 1 10 GLN HG3 3.858 . 5.718 4.217 3.523 5.580 . 0 0 "[ . 1 .]" 1
549 1 11 LYS QB 1 11 LYS QG 2.585 . 3.420 2.057 1.987 2.088 . 0 0 "[ . 1 .]" 1
550 1 5 GLU HA 1 6 LYS QB 4.140 . 6.282 5.404 5.131 5.524 . 0 0 "[ . 1 .]" 1
551 1 67 GLN HA 1 67 GLN HB2 2.913 . 3.369 3.020 3.001 3.029 . 0 0 "[ . 1 .]" 1
552 1 34 PRO HB2 1 38 GLN HG3 5.025 . 8.181 4.723 4.254 5.036 . 0 0 "[ . 1 .]" 1
553 1 34 PRO HB2 1 49 ALA MB 4.316 . 6.644 6.565 6.303 6.742 0.098 6 0 "[ . 1 .]" 1
554 1 63 ARG HA 1 63 ARG HB3 2.625 . 3.486 2.698 2.418 3.019 . 0 0 "[ . 1 .]" 1
555 1 28 LEU HA 1 28 LEU HB3 2.420 . 3.152 3.012 2.897 3.022 . 0 0 "[ . 1 .]" 1
556 1 5 GLU QG 1 9 ARG QG 2.819 . 3.812 3.479 2.887 3.697 . 0 0 "[ . 1 .]" 1
557 1 67 GLN HB2 1 67 GLN HG3 2.596 . 3.438 2.442 2.400 2.490 . 0 0 "[ . 1 .]" 1
558 1 25 MET QB 1 28 LEU HB3 4.527 . 7.089 4.205 3.684 4.769 . 0 0 "[ . 1 .]" 1
559 1 25 MET HA 1 28 LEU HB3 2.210 . 2.821 2.683 2.310 3.383 0.562 9 1 "[ . +1 .]" 1
560 1 56 TYR HA 1 57 PRO QB 3.427 . 4.895 4.597 4.558 4.635 . 0 0 "[ . 1 .]" 1
561 1 76 LEU QB 1 87 ILE MG 2.150 . 2.728 2.553 2.185 2.761 0.033 3 0 "[ . 1 .]" 1
562 1 89 SER HB3 1 102 ILE HB 3.108 . 4.316 3.579 2.197 4.150 . 0 0 "[ . 1 .]" 1
563 1 102 ILE HA 1 102 ILE HB 2.707 . 3.623 3.022 3.015 3.028 . 0 0 "[ . 1 .]" 1
564 1 9 ARG HA 1 9 ARG QG 3.109 . 4.317 3.358 3.347 3.383 . 0 0 "[ . 1 .]" 1
565 1 40 LEU HA 1 40 LEU QB 2.589 . 3.427 2.504 2.389 2.535 . 0 0 "[ . 1 .]" 1
566 1 101 ASP HA 1 102 ILE HB 4.414 . 6.850 4.661 4.538 4.831 . 0 0 "[ . 1 .]" 1
567 1 76 LEU HA 1 76 LEU QB 2.384 . 3.094 2.360 2.294 2.393 . 0 0 "[ . 1 .]" 1
568 1 68 ASP HA 1 68 ASP HB3 2.722 . 3.648 2.436 2.406 2.490 . 0 0 "[ . 1 .]" 1
569 1 68 ASP HB3 1 69 PRO HD2 2.533 . 3.335 2.847 2.070 3.760 0.425 3 0 "[ . 1 .]" 1
570 1 29 ASP HB3 1 53 ALA MB 3.711 . 5.433 4.667 3.750 5.369 . 0 0 "[ . 1 .]" 1
571 1 40 LEU QB 1 41 GLN HG2 4.735 . 6.412 3.577 3.158 4.630 . 0 0 "[ . 1 .]" 1
572 1 12 VAL QG 1 102 ILE HB 1.894 . 2.343 2.075 1.833 2.270 . 0 0 "[ . 1 .]" 1
573 1 102 ILE HB 1 102 ILE MG 1.765 . 2.154 2.125 2.117 2.130 . 0 0 "[ . 1 .]" 1
574 1 52 HIS HA 1 53 ALA MB 4.193 . 6.391 4.004 3.974 4.033 . 0 0 "[ . 1 .]" 1
575 1 40 LEU QB 1 41 GLN HG3 3.885 . 5.772 4.849 3.539 5.153 . 0 0 "[ . 1 .]" 1
576 1 9 ARG QG 1 10 GLN HB2 4.557 . 7.153 4.151 4.015 4.370 . 0 0 "[ . 1 .]" 1
577 1 77 LEU MD1 1 77 LEU HG 1.890 . 2.336 2.121 2.117 2.123 . 0 0 "[ . 1 .]" 1
578 1 77 LEU MD2 1 77 LEU HG 1.914 . 2.372 2.125 2.123 2.130 . 0 0 "[ . 1 .]" 1
579 1 12 VAL QG 1 68 ASP HB3 2.395 . 3.112 2.813 2.216 3.178 0.066 13 0 "[ . 1 .]" 1
580 1 69 PRO HA 1 69 PRO HB3 2.955 . 4.047 2.283 2.260 2.315 . 0 0 "[ . 1 .]" 1
581 1 65 LEU QB 1 73 ASP QB 4.409 . 5.169 4.330 3.140 4.957 . 0 0 "[ . 1 .]" 1
582 1 62 ILE HA 1 62 ILE HB 2.298 . 2.958 2.431 2.372 2.487 . 0 0 "[ . 1 .]" 1
583 1 65 LEU HA 1 65 LEU QB 2.552 . 3.366 2.427 2.143 2.485 . 0 0 "[ . 1 .]" 1
584 1 6 LYS QB 1 6 LYS HG3 2.195 . 2.797 2.289 2.160 2.377 . 0 0 "[ . 1 .]" 1
585 1 43 LEU QB 1 44 VAL HA 3.600 . 5.220 4.286 3.821 4.578 . 0 0 "[ . 1 .]" 1
586 1 67 GLN HB3 1 73 ASP HA 4.120 . 6.242 3.722 3.096 4.551 . 0 0 "[ . 1 .]" 1
587 1 67 GLN HB3 1 71 GLY HA3 3.546 . 5.117 5.009 4.400 5.462 0.345 13 0 "[ . 1 .]" 1
588 1 43 LEU QB 1 44 VAL HB 3.934 . 5.868 4.682 3.662 5.621 . 0 0 "[ . 1 .]" 1
589 1 15 ASP HA 1 18 ALA MB 2.397 . 3.115 2.466 2.385 2.613 . 0 0 "[ . 1 .]" 1
590 1 62 ILE HA 1 62 ILE HG13 2.228 . 2.848 2.512 2.442 2.608 . 0 0 "[ . 1 .]" 1
591 1 11 LYS HA 1 11 LYS QG 2.520 . 3.314 2.674 2.425 3.140 . 0 0 "[ . 1 .]" 1
592 1 32 ARG QB 1 32 ARG HG3 3.033 . 4.183 2.490 2.411 2.526 . 0 0 "[ . 1 .]" 1
593 1 17 VAL QG 1 18 ALA MB 5.112 . 8.379 3.374 3.066 4.075 . 0 0 "[ . 1 .]" 1
594 1 62 ILE MD 1 62 ILE HG13 1.732 . 2.107 2.119 2.118 2.120 0.013 13 0 "[ . 1 .]" 1
595 1 23 LEU HA 1 23 LEU HG 2.599 . 3.443 2.841 2.620 3.341 . 0 0 "[ . 1 .]" 1
596 1 16 LEU HA 1 87 ILE HG13 4.399 . 6.817 5.032 4.812 5.294 . 0 0 "[ . 1 .]" 1
597 1 87 ILE MD 1 87 ILE HG13 1.718 . 2.087 2.116 2.113 2.119 0.032 7 0 "[ . 1 .]" 1
598 1 5 GLU HA 1 7 ALA MB 3.728 . 5.465 5.016 4.789 5.328 . 0 0 "[ . 1 .]" 1
599 1 87 ILE HA 1 87 ILE HG13 3.068 . 4.244 3.759 3.732 3.792 . 0 0 "[ . 1 .]" 1
600 1 23 LEU HB2 1 23 LEU HG 2.662 . 3.548 2.846 2.374 3.020 . 0 0 "[ . 1 .]" 1
601 1 5 GLU QG 1 7 ALA MB 4.451 . 6.927 6.176 5.931 6.466 . 0 0 "[ . 1 .]" 1
602 1 87 ILE HG13 1 104 ASN HB2 4.093 . 6.187 3.246 1.856 4.600 0.143 5 0 "[ . 1 .]" 1
603 1 87 ILE HG13 1 104 ASN HB3 2.682 . 3.581 2.728 1.977 3.690 0.109 12 0 "[ . 1 .]" 1
604 1 7 ALA MB 1 10 GLN HG2 5.324 . 8.867 5.687 4.509 6.632 . 0 0 "[ . 1 .]" 1
605 1 7 ALA MB 1 10 GLN HB3 5.265 . 8.729 5.493 4.985 5.967 . 0 0 "[ . 1 .]" 1
606 1 40 LEU QD 1 40 LEU HG 1.834 . 2.254 1.892 1.884 1.898 . 0 0 "[ . 1 .]" 1
607 1 16 LEU QD 1 87 ILE HG13 1.891 . 2.338 2.221 2.074 2.344 0.006 13 0 "[ . 1 .]" 1
608 1 85 VAL HB 1 85 VAL QG 1.702 . 2.064 1.893 1.891 1.895 . 0 0 "[ . 1 .]" 1
609 1 40 LEU HA 1 40 LEU HG 2.516 . 3.307 2.858 2.343 3.576 0.269 14 0 "[ . 1 .]" 1
610 1 40 LEU QB 1 40 LEU HG 2.621 . 3.480 2.288 2.128 2.404 . 0 0 "[ . 1 .]" 1
611 1 64 ARG QB 1 64 ARG QG 2.973 . 3.705 2.073 2.001 2.087 . 0 0 "[ . 1 .]" 1
612 1 34 PRO HA 1 34 PRO HB3 2.433 . 3.173 2.299 2.256 2.314 . 0 0 "[ . 1 .]" 1
613 1 75 GLN HA 1 75 GLN HB3 2.638 . 3.508 2.480 2.380 2.592 . 0 0 "[ . 1 .]" 1
614 1 42 ALA MB 1 46 ALA HA 4.333 . 6.177 4.901 4.280 5.194 . 0 0 "[ . 1 .]" 1
615 1 81 GLN QB 1 86 ASP QB 3.441 . 4.921 3.631 2.961 4.127 . 0 0 "[ . 1 .]" 1
616 1 41 GLN HB2 1 42 ALA MB 4.504 . 7.040 4.364 4.248 4.546 . 0 0 "[ . 1 .]" 1
617 1 34 PRO HB3 1 34 PRO QG 2.203 . 2.810 2.245 2.165 2.266 . 0 0 "[ . 1 .]" 1
618 1 57 PRO QB 1 57 PRO HG2 2.238 . 2.864 2.239 2.226 2.246 . 0 0 "[ . 1 .]" 1
619 1 9 ARG QB 1 12 VAL QG 4.569 . 4.688 3.415 3.284 3.597 . 0 0 "[ . 1 .]" 1
620 1 42 ALA MB 1 53 ALA MB 3.853 . 5.709 4.027 3.643 4.393 . 0 0 "[ . 1 .]" 1
621 1 32 ARG HA 1 32 ARG HG2 4.628 . 7.305 4.207 4.159 4.238 . 0 0 "[ . 1 .]" 1
622 1 12 VAL QG 1 68 ASP HA 3.169 . 4.424 2.830 2.452 3.284 . 0 0 "[ . 1 .]" 1
623 1 32 ARG QD 1 32 ARG HG2 3.124 . 4.344 2.367 2.324 2.441 . 0 0 "[ . 1 .]" 1
624 1 38 GLN HA 1 49 ALA MB 3.669 . 5.352 4.354 3.808 4.885 . 0 0 "[ . 1 .]" 1
625 1 32 ARG HG2 1 51 PRO QG 3.575 . 5.173 3.142 2.345 4.184 . 0 0 "[ . 1 .]" 1
626 1 37 GLU QG 1 49 ALA MB 3.403 . 4.851 4.047 3.291 4.692 . 0 0 "[ . 1 .]" 1
627 1 69 PRO HA 1 69 PRO HG3 3.797 . 5.599 3.443 2.894 3.986 . 0 0 "[ . 1 .]" 1
628 1 92 PRO HA 1 92 PRO HG3 3.757 . 5.522 3.308 3.131 4.013 . 0 0 "[ . 1 .]" 1
629 1 12 VAL QG 1 102 ILE HA 4.170 . 6.344 4.387 4.176 4.556 . 0 0 "[ . 1 .]" 1
630 1 8 ASP HA 1 69 PRO HG3 2.836 . 3.842 3.384 2.499 4.368 0.526 7 1 "[ . + 1 .]" 1
631 1 11 LYS QB 1 69 PRO HG3 2.550 . 3.363 2.524 2.169 3.019 . 0 0 "[ . 1 .]" 1
632 1 12 VAL QG 1 16 LEU QD 2.808 . 3.794 2.850 2.557 3.188 . 0 0 "[ . 1 .]" 1
633 1 12 VAL QG 1 13 VAL QG 3.038 . 4.192 3.252 3.002 3.511 . 0 0 "[ . 1 .]" 1
634 1 40 LEU HA 1 76 LEU QB 4.479 . 6.987 4.281 3.821 4.792 . 0 0 "[ . 1 .]" 1
635 1 12 VAL QG 1 101 ASP HA 5.118 . 8.393 5.439 4.835 5.750 . 0 0 "[ . 1 .]" 1
636 1 75 GLN HA 1 76 LEU QB 4.675 . 6.147 4.024 3.941 4.115 . 0 0 "[ . 1 .]" 1
637 1 12 VAL QG 1 16 LEU QB 3.311 . 4.681 2.880 2.702 3.184 . 0 0 "[ . 1 .]" 1
638 1 23 LEU QD 1 34 PRO QG 1.874 . 2.313 2.104 1.890 2.205 . 0 0 "[ . 1 .]" 1
639 1 40 LEU QD 1 76 LEU QB 2.275 . 2.922 2.152 1.768 2.535 . 0 0 "[ . 1 .]" 1
640 1 90 LEU MD1 1 90 LEU MD2 2.601 . 3.447 2.083 2.063 2.101 . 0 0 "[ . 1 .]" 1
641 1 62 ILE MD 1 62 ILE HG12 1.832 . 2.252 2.119 2.117 2.123 . 0 0 "[ . 1 .]" 1
642 1 62 ILE HA 1 62 ILE HG12 3.188 . 4.458 3.139 3.044 3.243 . 0 0 "[ . 1 .]" 1
643 1 77 LEU MD2 1 85 VAL QG 3.942 . 5.884 5.663 5.067 5.746 . 0 0 "[ . 1 .]" 1
644 1 62 ILE HG12 1 63 ARG HG3 4.137 . 6.276 5.663 4.854 6.628 0.352 7 0 "[ . 1 .]" 1
645 1 62 ILE HG12 1 62 ILE MG 2.193 . 2.794 2.409 2.346 2.458 . 0 0 "[ . 1 .]" 1
646 1 75 GLN QG 1 90 LEU QD 2.937 . 3.568 2.146 1.749 3.071 0.150 13 0 "[ . 1 .]" 1
647 1 77 LEU MD1 1 81 GLN QB 3.226 . 4.526 3.896 3.509 4.289 . 0 0 "[ . 1 .]" 1
648 1 12 VAL HB 1 13 VAL QG 4.472 . 5.853 3.216 3.159 3.295 . 0 0 "[ . 1 .]" 1
649 1 19 LEU QB 1 87 ILE MD 2.034 . 2.551 2.216 1.929 2.348 . 0 0 "[ . 1 .]" 1
650 1 27 LYS HG2 1 31 SER HA 3.077 . 4.261 3.470 2.886 3.914 . 0 0 "[ . 1 .]" 1
651 1 44 VAL QG 1 63 ARG HA 3.166 . 4.419 3.243 2.771 3.741 . 0 0 "[ . 1 .]" 1
652 1 25 MET HA 1 28 LEU QD 2.836 . 3.842 3.245 2.911 3.727 . 0 0 "[ . 1 .]" 1
653 1 27 LYS HG2 1 32 ARG HA 3.037 . 4.190 4.245 3.954 4.543 0.353 8 0 "[ . 1 .]" 1
654 1 25 MET QG 1 28 LEU QD 4.140 . 6.282 4.214 3.141 5.297 . 0 0 "[ . 1 .]" 1
655 1 43 LEU HA 1 43 LEU QD 3.884 . 5.770 2.876 1.850 3.369 0.148 9 0 "[ . 1 .]" 1
656 1 18 ALA HA 1 43 LEU QD 2.967 . 4.067 3.727 3.270 4.004 . 0 0 "[ . 1 .]" 1
657 1 43 LEU QB 1 43 LEU QD 2.269 . 2.913 1.919 1.866 1.956 . 0 0 "[ . 1 .]" 1
658 1 28 LEU HB3 1 28 LEU QD 2.066 . 2.600 2.249 2.099 2.360 . 0 0 "[ . 1 .]" 1
659 1 44 VAL QG 1 64 ARG QB 4.268 . 6.545 4.005 3.671 4.312 . 0 0 "[ . 1 .]" 1
660 1 28 LEU QD 1 28 LEU HG 1.865 . 2.300 1.894 1.892 1.897 . 0 0 "[ . 1 .]" 1
661 1 43 LEU QD 1 62 ILE MG 1.733 . 2.108 2.040 1.765 2.173 0.065 9 0 "[ . 1 .]" 1
662 1 90 LEU QD 1 94 GLY HA2 3.393 . 4.832 3.306 2.684 3.913 . 0 0 "[ . 1 .]" 1
663 1 27 LYS HD3 1 27 LYS QE 2.664 . 3.551 2.357 2.324 2.388 . 0 0 "[ . 1 .]" 1
664 1 90 LEU HB2 1 90 LEU QD 2.138 . 2.710 2.190 2.106 2.310 . 0 0 "[ . 1 .]" 1
665 1 44 VAL QG 1 64 ARG QG 4.520 . 7.073 4.095 3.595 4.457 . 0 0 "[ . 1 .]" 1
666 1 65 LEU QD 1 73 ASP HA 4.047 . 6.094 5.117 2.824 5.893 . 0 0 "[ . 1 .]" 1
667 1 90 LEU QD 1 94 GLY HA3 4.174 . 6.351 4.192 3.375 4.842 . 0 0 "[ . 1 .]" 1
668 1 90 LEU HB3 1 90 LEU QD 3.168 . 4.423 2.368 2.109 2.525 . 0 0 "[ . 1 .]" 1
669 1 65 LEU QB 1 65 LEU QD 2.049 . 2.574 1.995 1.909 2.071 . 0 0 "[ . 1 .]" 1
670 1 10 GLN HG2 1 13 VAL QG 4.248 . 6.504 4.153 3.383 4.591 . 0 0 "[ . 1 .]" 1
671 1 107 ILE HA 1 107 ILE MG 2.826 . 3.824 3.210 3.202 3.220 . 0 0 "[ . 1 .]" 1
672 1 90 LEU HA 1 90 LEU QD 2.100 . 2.651 2.061 1.826 2.409 0.042 7 0 "[ . 1 .]" 1
673 1 40 LEU QD 1 75 GLN HA 3.274 . 4.614 2.678 2.029 3.125 . 0 0 "[ . 1 .]" 1
674 1 65 LEU HA 1 65 LEU QD 2.228 . 2.849 2.086 1.885 3.006 0.157 14 0 "[ . 1 .]" 1
675 1 107 ILE MG 1 108 GLY QA 4.640 . 6.933 3.502 3.260 3.697 . 0 0 "[ . 1 .]" 1
676 1 40 LEU QB 1 40 LEU QD . . 2.053 1.974 1.928 2.069 0.016 9 0 "[ . 1 .]" 1
677 1 65 LEU QD 1 73 ASP QB 3.692 . 5.396 4.215 2.215 4.970 . 0 0 "[ . 1 .]" 1
678 1 90 LEU QD 1 96 PRO QG . . 2.691 2.860 2.032 3.398 0.707 13 2 "[- . 1 + .]" 1
679 1 39 GLY HA3 1 40 LEU QD 3.486 . 5.005 3.756 3.136 4.293 . 0 0 "[ . 1 .]" 1
680 1 40 LEU QD 1 74 TYR HB3 2.209 . 2.819 2.917 2.627 3.356 0.537 11 1 "[ . 1+ .]" 1
681 1 20 GLU HB3 1 87 ILE MD 3.655 . 5.324 3.754 3.227 4.410 . 0 0 "[ . 1 .]" 1
682 1 89 SER HB3 1 102 ILE MG 4.660 . 7.374 4.688 3.772 5.228 . 0 0 "[ . 1 .]" 1
683 1 76 LEU QB 1 76 LEU QD 3.039 . 3.371 2.019 1.907 2.066 0.011 14 0 "[ . 1 .]" 1
684 1 9 ARG QD 1 102 ILE MG 3.737 . 5.483 4.746 3.877 5.193 . 0 0 "[ . 1 .]" 1
685 1 20 GLU QG 1 87 ILE MD 2.479 . 3.247 2.658 1.774 3.205 0.214 3 0 "[ . 1 .]" 1
686 1 12 VAL HB 1 102 ILE MG 2.872 . 3.903 2.924 2.295 3.502 . 0 0 "[ . 1 .]" 1
687 1 45 SER HA 1 46 ALA MB 3.902 . 5.660 4.051 3.980 4.175 . 0 0 "[ . 1 .]" 1
688 1 62 ILE HB 1 62 ILE MG 2.031 . 2.546 2.122 2.117 2.125 . 0 0 "[ . 1 .]" 1
689 1 23 LEU QD 1 23 LEU HG 1.716 . 2.084 1.891 1.887 1.893 . 0 0 "[ . 1 .]" 1
690 1 12 VAL QG 1 102 ILE MG . . 1.912 1.988 1.930 2.040 0.128 1 0 "[ . 1 .]" 1
691 1 46 ALA MB 1 53 ALA MB 1.979 . 2.469 2.311 2.085 2.511 0.042 15 0 "[ . 1 .]" 1
692 1 44 VAL HA 1 62 ILE MG 2.912 . 3.972 3.148 2.805 3.686 . 0 0 "[ . 1 .]" 1
693 1 20 GLU HA 1 23 LEU QD 2.874 . 3.907 2.359 2.048 2.734 . 0 0 "[ . 1 .]" 1
694 1 23 LEU HA 1 23 LEU QD 1.939 . 2.409 2.132 2.045 2.257 . 0 0 "[ . 1 .]" 1
695 1 23 LEU HB2 1 23 LEU QD 2.564 . 3.386 2.167 2.100 2.359 . 0 0 "[ . 1 .]" 1
696 1 23 LEU QD 1 26 TYR HB3 3.542 . 5.110 4.194 3.890 4.504 . 0 0 "[ . 1 .]" 1
697 1 76 LEU QD 1 85 VAL HB 1.819 . 2.233 1.827 1.752 1.996 . 0 0 "[ . 1 .]" 1
698 1 76 LEU QD 1 77 LEU MD1 3.745 . 5.498 4.560 4.320 4.997 . 0 0 "[ . 1 .]" 1
699 1 27 LYS HD2 1 27 LYS HG2 2.036 . 2.554 3.013 3.009 3.015 0.461 3 0 "[ . 1 .]" 1
700 1 23 LEU QD 1 42 ALA MB 2.889 . 3.933 3.289 2.758 3.870 . 0 0 "[ . 1 .]" 1
701 1 43 LEU HA 1 62 ILE MG 3.316 . 4.690 4.030 3.609 4.307 . 0 0 "[ . 1 .]" 1
702 1 61 TYR HB2 1 62 ILE MG 3.481 . 4.996 3.335 2.927 3.854 . 0 0 "[ . 1 .]" 1
703 1 56 TYR HA 1 57 PRO HG3 4.906 . 7.915 4.427 4.370 4.500 . 0 0 "[ . 1 .]" 1
704 1 27 LYS HD2 1 32 ARG HA 3.845 . 5.693 4.233 3.869 4.618 . 0 0 "[ . 1 .]" 1
705 1 27 LYS HD2 1 27 LYS QE 2.262 . 2.901 2.230 2.169 2.367 . 0 0 "[ . 1 .]" 1
706 1 13 VAL HA 1 16 LEU QD 3.430 . 4.900 2.743 2.552 2.869 . 0 0 "[ . 1 .]" 1
707 1 16 LEU QD 1 87 ILE HA 4.321 . 6.655 4.093 3.674 4.464 . 0 0 "[ . 1 .]" 1
708 1 16 LEU QD 1 88 PHE HA 2.604 . 3.451 2.921 2.523 3.257 . 0 0 "[ . 1 .]" 1
709 1 16 LEU QD 1 104 ASN HA 3.483 . 5.000 2.069 1.892 2.386 0.074 12 0 "[ . 1 .]" 1
710 1 16 LEU QB 1 16 LEU QD 2.377 . 3.083 1.922 1.902 1.935 . 0 0 "[ . 1 .]" 1
711 1 16 LEU QD 1 19 LEU QB 2.615 . 3.470 2.984 2.715 3.262 . 0 0 "[ . 1 .]" 1
712 1 16 LEU QD 1 104 ASN HB2 4.719 . 7.502 3.281 2.141 4.028 . 0 0 "[ . 1 .]" 1
713 1 34 PRO HB2 1 76 LEU QD 3.199 . 4.479 3.634 3.397 3.946 . 0 0 "[ . 1 .]" 1
714 1 27 LYS HG3 1 31 SER HA 3.241 . 4.554 3.765 3.339 4.299 . 0 0 "[ . 1 .]" 1
715 1 27 LYS HD3 1 27 LYS HG3 2.802 . 3.783 3.015 3.010 3.020 . 0 0 "[ . 1 .]" 1
716 1 27 LYS HA 1 27 LYS HG3 3.270 . 4.607 2.565 2.498 2.627 . 0 0 "[ . 1 .]" 1
717 1 27 LYS HG3 1 32 ARG HA 4.154 . 6.310 2.655 2.350 2.975 . 0 0 "[ . 1 .]" 1
718 1 27 LYS QE 1 27 LYS HG3 2.734 . 3.669 2.423 2.367 2.511 . 0 0 "[ . 1 .]" 1
719 1 77 LEU MD1 1 85 VAL QG 4.446 . 6.916 5.098 4.798 5.956 . 0 0 "[ . 1 .]" 1
720 1 34 PRO HA 1 85 VAL QG 3.599 . 5.218 4.707 4.442 5.069 . 0 0 "[ . 1 .]" 1
721 1 23 LEU HA 1 85 VAL QG 4.158 . 6.319 4.512 4.112 4.696 . 0 0 "[ . 1 .]" 1
722 1 34 PRO HB2 1 85 VAL QG 3.342 . 4.738 4.578 4.470 4.689 . 0 0 "[ . 1 .]" 1
723 1 19 LEU QD 1 66 PRO QG 3.023 . 4.165 2.041 1.841 2.464 0.040 4 0 "[ . 1 .]" 1
724 1 19 LEU QD 1 22 ALA MB 4.016 . 6.032 3.655 3.290 4.183 . 0 0 "[ . 1 .]" 1
725 1 18 ALA MB 1 19 LEU QD 4.074 . 6.149 3.499 2.859 3.851 . 0 0 "[ . 1 .]" 1
726 1 79 PRO HA 1 85 VAL QG 4.180 . 6.364 3.608 3.224 4.102 . 0 0 "[ . 1 .]" 1
727 1 62 ILE MD 1 66 PRO HB3 2.239 . 2.866 2.539 2.263 2.886 0.020 15 0 "[ . 1 .]" 1
728 1 18 ALA MB 1 43 LEU QD 1.797 . 2.201 2.207 1.956 2.361 0.160 8 0 "[ . 1 .]" 1
729 1 76 LEU QB 1 77 LEU H 4.670 . 7.397 3.774 3.610 3.858 . 0 0 "[ . 1 .]" 1
730 1 92 PRO HD2 1 100 ASP HB2 3.890 . 5.781 3.193 2.082 5.159 . 0 0 "[ . 1 .]" 1
731 1 68 ASP H 1 69 PRO HD2 5.246 . 8.686 4.944 4.663 5.215 . 0 0 "[ . 1 .]" 1
732 1 51 PRO HA 1 52 HIS HB3 6.037 . 10.593 4.773 4.656 4.870 . 0 0 "[ . 1 .]" 1
733 1 92 PRO HA 1 94 GLY H 4.243 . 6.494 4.108 3.964 4.262 . 0 0 "[ . 1 .]" 1
734 1 13 VAL HA 1 17 VAL H 4.218 . 6.442 3.832 3.737 3.991 . 0 0 "[ . 1 .]" 1
735 1 12 VAL HB 1 13 VAL HA 4.505 . 7.042 4.356 4.210 4.506 . 0 0 "[ . 1 .]" 1
736 1 76 LEU HA 1 77 LEU QB 4.750 . 7.570 3.977 3.880 4.047 . 0 0 "[ . 1 .]" 1
737 1 19 LEU HA 1 87 ILE MD 3.791 . 5.587 4.455 4.220 4.624 . 0 0 "[ . 1 .]" 1
738 1 27 LYS H 1 27 LYS HD2 5.542 . 9.382 5.002 4.941 5.117 . 0 0 "[ . 1 .]" 1
739 1 27 LYS H 1 27 LYS HD3 5.584 . 9.482 4.966 4.858 5.109 . 0 0 "[ . 1 .]" 1
740 1 70 TRP HE1 1 92 PRO HB2 5.845 . 10.115 5.215 4.568 5.929 . 0 0 "[ . 1 .]" 1
741 1 16 LEU QB 1 87 ILE MD 3.313 . 4.685 3.930 3.778 4.179 . 0 0 "[ . 1 .]" 1
742 1 16 LEU QD 1 87 ILE MD 1.741 . 2.120 2.118 2.078 2.139 0.019 8 0 "[ . 1 .]" 1
743 1 13 VAL HA 1 102 ILE MG 3.735 . 5.478 3.801 3.220 4.570 . 0 0 "[ . 1 .]" 1
744 1 44 VAL QG 1 66 PRO HD3 4.505 . 7.042 3.672 2.412 4.553 . 0 0 "[ . 1 .]" 1
745 1 65 LEU QB 1 66 PRO HD3 3.555 . 5.135 4.148 3.760 4.535 . 0 0 "[ . 1 .]" 1
746 1 85 VAL QG 1 87 ILE MG 3.581 . 5.184 3.703 3.312 3.990 . 0 0 "[ . 1 .]" 1
747 1 77 LEU H 1 85 VAL QG 4.975 . 8.068 4.568 4.335 4.814 . 0 0 "[ . 1 .]" 1
748 1 103 GLY QA 1 106 THR HB 3.419 . 4.880 4.043 3.424 4.821 . 0 0 "[ . 1 .]" 1
749 1 103 GLY H 1 106 THR HB 3.940 . 5.880 2.654 1.994 3.831 0.006 9 0 "[ . 1 .]" 1
750 1 10 GLN HA 1 10 GLN HG2 2.710 . 3.501 2.701 2.368 3.170 . 0 0 "[ . 1 .]" 1
751 1 13 VAL HB 1 107 ILE HB 4.022 . 6.044 5.876 5.402 6.186 0.142 3 0 "[ . 1 .]" 1
752 1 15 ASP QB 1 18 ALA MB 4.235 . 6.477 3.737 3.550 3.905 . 0 0 "[ . 1 .]" 1
753 1 13 VAL QG 1 107 ILE HB 3.051 . 4.215 2.875 2.491 3.079 . 0 0 "[ . 1 .]" 1
754 1 90 LEU QD 1 96 PRO QB . . 2.309 2.085 1.832 2.322 0.155 6 0 "[ . 1 .]" 1
755 1 88 PHE QD 1 90 LEU QD 3.640 . 5.296 2.856 2.328 3.671 . 0 0 "[ . 1 .]" 1
756 1 84 GLN HA 1 85 VAL H 3.290 . 4.643 3.506 3.456 3.535 . 0 0 "[ . 1 .]" 1
757 1 30 ASN HA 1 30 ASN QD 4.797 . 7.673 3.597 3.253 3.949 . 0 0 "[ . 1 .]" 1
758 1 54 ARG HB3 1 55 ASN QD 4.048 . 6.096 3.248 2.481 5.076 . 0 0 "[ . 1 .]" 1
759 1 67 GLN HB3 1 67 GLN HE22 5.284 . 8.774 4.051 1.788 4.472 0.006 11 0 "[ . 1 .]" 1
760 1 93 ASP H 1 93 ASP HB3 3.521 . 5.071 2.776 2.181 3.073 . 0 0 "[ . 1 .]" 1
761 1 33 TYR H 1 85 VAL QG 5.339 . 7.981 4.496 4.306 4.758 . 0 0 "[ . 1 .]" 1
762 1 12 VAL QG 1 74 TYR QE 2.673 . 3.566 2.196 1.821 2.889 0.179 7 0 "[ . 1 .]" 1
763 1 41 GLN H 1 41 GLN HG2 4.315 . 6.643 2.698 2.442 3.847 . 0 0 "[ . 1 .]" 1
764 1 15 ASP QB 1 74 TYR QE 4.883 . 5.101 2.708 2.227 3.020 . 0 0 "[ . 1 .]" 1
765 1 41 GLN H 1 41 GLN HG3 3.395 . 4.836 3.686 2.813 3.904 . 0 0 "[ . 1 .]" 1
766 1 16 LEU QD 1 104 ASN HB3 2.905 . 3.960 3.194 2.623 3.964 0.004 12 0 "[ . 1 .]" 1
767 1 33 TYR QE 1 85 VAL QG 3.858 . 5.719 3.292 2.844 4.116 . 0 0 "[ . 1 .]" 1
768 1 19 LEU QD 1 74 TYR HB3 2.314 . 2.984 2.281 2.065 2.732 . 0 0 "[ . 1 .]" 1
769 1 87 ILE MD 1 104 ASN HB3 2.907 . 3.963 2.844 1.974 4.284 0.321 12 0 "[ . 1 .]" 1
770 1 90 LEU QD 1 97 GLU H 4.231 . 6.468 4.007 3.512 4.484 . 0 0 "[ . 1 .]" 1
771 1 70 TRP HD1 1 92 PRO HA 3.858 . 5.718 3.800 3.266 4.405 . 0 0 "[ . 1 .]" 1
772 1 70 TRP HD1 1 92 PRO HB3 3.865 . 5.733 3.372 2.922 3.931 . 0 0 "[ . 1 .]" 1
773 1 74 TYR H 1 74 TYR QD 3.314 . 4.687 2.395 1.926 2.998 0.015 8 0 "[ . 1 .]" 1
774 1 24 ASP H 1 33 TYR QE 4.177 . 6.358 4.327 3.332 6.113 . 0 0 "[ . 1 .]" 1
775 1 108 GLY H 1 109 PHE QD 3.485 . 5.003 4.125 3.340 4.781 . 0 0 "[ . 1 .]" 1
776 1 52 HIS HD2 1 56 TYR QD 4.104 . 6.209 4.482 4.124 5.107 . 0 0 "[ . 1 .]" 1
777 1 26 TYR QD 1 33 TYR QE 4.473 . 6.974 6.531 6.010 7.037 0.063 5 0 "[ . 1 .]" 1
778 1 26 TYR QE 1 33 TYR QE 5.407 . 9.062 8.079 7.277 8.846 . 0 0 "[ . 1 .]" 1
779 1 74 TYR QD 1 88 PHE HA 3.609 . 5.237 4.590 3.782 5.246 0.009 14 0 "[ . 1 .]" 1
780 1 87 ILE HA 1 88 PHE QD 3.546 . 5.118 3.497 3.153 3.967 . 0 0 "[ . 1 .]" 1
781 1 88 PHE QD 1 96 PRO HA 4.241 . 6.489 3.437 2.942 3.794 . 0 0 "[ . 1 .]" 1
782 1 105 TRP HA 1 105 TRP HD1 3.912 . 5.825 3.421 2.891 4.143 . 0 0 "[ . 1 .]" 1
783 1 73 ASP HA 1 74 TYR QD 3.926 . 5.853 3.849 3.124 4.593 . 0 0 "[ . 1 .]" 1
784 1 26 TYR QD 1 33 TYR HA 3.405 . 4.854 3.251 2.725 4.168 . 0 0 "[ . 1 .]" 1
785 1 43 LEU HA 1 61 TYR QD 3.299 . 4.659 2.401 1.932 3.459 0.007 8 0 "[ . 1 .]" 1
786 1 70 TRP HA 1 70 TRP HD1 3.203 . 4.485 2.858 2.647 3.098 . 0 0 "[ . 1 .]" 1
787 1 32 ARG HA 1 33 TYR HD1 4.223 . 6.453 5.602 4.316 6.482 0.029 9 0 "[ . 1 .]" 1
788 1 52 HIS HD2 1 54 ARG HA 3.568 . 5.159 3.861 3.609 4.336 . 0 0 "[ . 1 .]" 1
789 1 67 GLN HA 1 74 TYR QE 3.282 . 4.628 3.159 2.521 3.751 . 0 0 "[ . 1 .]" 1
790 1 61 TYR HA 1 61 TYR QD 3.443 . 4.925 2.710 2.428 3.079 . 0 0 "[ . 1 .]" 1
791 1 88 PHE QD 1 90 LEU HA 3.857 . 5.717 3.883 3.490 4.475 . 0 0 "[ . 1 .]" 1
792 1 26 TYR QD 1 27 LYS HA 3.816 . 5.636 3.494 2.991 4.011 . 0 0 "[ . 1 .]" 1
793 1 108 GLY QA 1 109 PHE QD 4.401 . 6.822 4.540 4.113 4.941 . 0 0 "[ . 1 .]" 1
794 1 23 LEU HA 1 33 TYR QE 4.301 . 6.613 4.793 4.357 6.102 . 0 0 "[ . 1 .]" 1
795 1 88 PHE HB3 1 88 PHE QD 3.262 . 4.592 2.408 2.305 2.514 . 0 0 "[ . 1 .]" 1
796 1 105 TRP HB3 1 105 TRP HD1 3.016 . 4.153 3.444 2.626 3.868 . 0 0 "[ . 1 .]" 1
797 1 26 TYR QD 1 46 ALA HA 4.434 . 6.892 5.681 5.178 6.083 . 0 0 "[ . 1 .]" 1
798 1 61 TYR HB2 1 61 TYR QD 3.010 . 4.143 2.344 2.305 2.488 . 0 0 "[ . 1 .]" 1
799 1 26 TYR QE 1 46 ALA HA 4.774 . 7.623 5.526 4.220 6.293 . 0 0 "[ . 1 .]" 1
800 1 26 TYR QD 1 32 ARG QD 3.768 . 5.542 3.745 3.191 4.325 . 0 0 "[ . 1 .]" 1
801 1 86 ASP QB 1 88 PHE QD 3.875 . 5.752 2.748 2.136 3.429 . 0 0 "[ . 1 .]" 1
802 1 32 ARG QD 1 33 TYR QE 4.832 . 7.750 7.085 6.590 7.295 . 0 0 "[ . 1 .]" 1
803 1 52 HIS HB3 1 52 HIS HD2 2.514 . 3.304 2.970 2.726 3.117 . 0 0 "[ . 1 .]" 1
804 1 61 TYR HB3 1 61 TYR QD 3.209 . 4.496 2.487 2.329 2.570 . 0 0 "[ . 1 .]" 1
805 1 70 TRP HZ3 1 92 PRO HD3 3.688 . 5.388 3.937 3.305 4.259 . 0 0 "[ . 1 .]" 1
806 1 8 ASP HB2 1 70 TRP HZ2 3.252 . 4.574 2.988 2.372 4.035 . 0 0 "[ . 1 .]" 1
807 1 88 PHE HB2 1 88 PHE QD 3.158 . 4.405 2.373 2.292 2.486 . 0 0 "[ . 1 .]" 1
808 1 26 TYR QE 1 30 ASN QB 4.616 . 7.279 3.208 2.967 3.496 . 0 0 "[ . 1 .]" 1
809 1 74 TYR HB3 1 74 TYR QD 2.688 . 3.591 2.429 2.283 2.649 . 0 0 "[ . 1 .]" 1
810 1 74 TYR HB3 1 74 TYR QE 4.845 . 7.779 4.425 4.385 4.485 . 0 0 "[ . 1 .]" 1
811 1 25 MET QB 1 61 TYR QD 3.788 . 5.582 5.203 5.067 5.302 . 0 0 "[ . 1 .]" 1
812 1 56 TYR QD 1 58 GLU HG3 3.850 . 5.703 5.275 4.497 6.401 0.698 5 1 "[ + 1 .]" 1
813 1 26 TYR QE 1 38 GLN HB3 3.319 . 4.696 3.674 3.015 4.421 . 0 0 "[ . 1 .]" 1
814 1 8 ASP HB3 1 70 TRP HZ2 3.622 . 5.262 3.000 2.498 3.852 . 0 0 "[ . 1 .]" 1
815 1 17 VAL HB 1 109 PHE HZ 3.873 . 5.748 5.104 3.703 5.762 0.014 1 0 "[ . 1 .]" 1
816 1 26 TYR HB3 1 26 TYR QD 3.476 . 4.986 2.390 2.294 2.456 . 0 0 "[ . 1 .]" 1
817 1 66 PRO QG 1 74 TYR QD 3.151 . 4.392 2.995 2.336 3.815 . 0 0 "[ . 1 .]" 1
818 1 26 TYR QD 1 53 ALA MB 3.843 . 4.381 2.723 2.097 3.414 . 0 0 "[ . 1 .]" 1
819 1 53 ALA MB 1 56 TYR QD 4.368 . 6.753 3.708 3.336 4.205 . 0 0 "[ . 1 .]" 1
820 1 70 TRP HZ3 1 92 PRO HD2 4.626 . 7.301 5.532 5.016 5.982 . 0 0 "[ . 1 .]" 1
821 1 23 LEU HG 1 33 TYR QE 3.688 . 5.388 4.786 4.001 5.429 0.041 10 0 "[ . 1 .]" 1
822 1 40 LEU HG 1 74 TYR QD 4.723 . 7.511 5.214 4.306 5.846 . 0 0 "[ . 1 .]" 1
823 1 12 VAL QG 1 74 TYR QD 4.651 . 7.354 3.859 3.238 4.259 . 0 0 "[ . 1 .]" 1
824 1 70 TRP HZ2 1 92 PRO HG3 3.082 . 4.270 3.520 2.602 4.297 0.027 11 0 "[ . 1 .]" 1
825 1 13 VAL QG 1 109 PHE QD 3.874 . 5.750 3.675 2.275 4.701 . 0 0 "[ . 1 .]" 1
826 1 17 VAL QG 1 109 PHE QE 3.739 . 5.486 2.635 2.358 3.108 . 0 0 "[ . 1 .]" 1
827 1 17 VAL QG 1 109 PHE HZ 2.983 . 4.095 2.884 2.294 3.558 . 0 0 "[ . 1 .]" 1
828 1 27 LYS HD2 1 33 TYR QE 3.118 . 4.333 2.929 2.666 3.120 . 0 0 "[ . 1 .]" 1
829 1 61 TYR QD 1 62 ILE MG 4.402 . 6.824 4.625 4.149 5.188 . 0 0 "[ . 1 .]" 1
830 1 26 TYR QE 1 76 LEU QD 4.488 . 7.006 6.525 6.246 6.737 . 0 0 "[ . 1 .]" 1
831 1 16 LEU QD 1 74 TYR QE 3.204 . 4.487 3.260 2.386 4.340 . 0 0 "[ . 1 .]" 1
832 1 16 LEU QD 1 74 TYR QD 2.950 . 4.038 3.256 2.170 3.985 . 0 0 "[ . 1 .]" 1
833 1 26 TYR QD 1 85 VAL QG 4.996 . 8.116 5.495 5.178 5.954 . 0 0 "[ . 1 .]" 1
834 1 82 HIS HB3 1 105 TRP HZ2 4.017 . 6.034 5.658 3.898 6.081 0.047 6 0 "[ . 1 .]" 1
835 1 8 ASP HB3 1 70 TRP HZ3 4.166 . 6.335 4.918 3.995 5.961 . 0 0 "[ . 1 .]" 1
836 1 70 TRP HD1 1 92 PRO HG3 4.412 . 6.845 4.012 2.996 5.492 . 0 0 "[ . 1 .]" 1
837 1 17 VAL HA 1 109 PHE HZ 4.158 . 6.319 5.237 2.718 6.340 0.021 10 0 "[ . 1 .]" 1
838 1 107 ILE MG 1 109 PHE HZ 4.353 . 6.722 4.661 2.845 5.404 . 0 0 "[ . 1 .]" 1
839 1 19 LEU QD 1 74 TYR QD 3.129 . 4.353 2.526 1.878 2.978 0.027 5 0 "[ . 1 .]" 1
840 1 26 TYR HA 1 26 TYR QE 4.384 . 6.786 4.624 4.479 4.768 . 0 0 "[ . 1 .]" 1
841 1 68 ASP HA 1 74 TYR QE 3.628 . 5.274 3.151 2.418 3.784 . 0 0 "[ . 1 .]" 1
842 1 16 LEU HA 1 74 TYR QD 4.219 . 6.444 4.419 3.062 5.247 . 0 0 "[ . 1 .]" 1
843 1 27 LYS HG2 1 33 TYR HD1 4.187 . 6.378 6.240 5.807 6.678 0.300 9 0 "[ . 1 .]" 1
844 1 27 LYS HG2 1 33 TYR QE 4.561 . 7.162 5.281 5.103 5.509 . 0 0 "[ . 1 .]" 1
845 1 12 VAL HA 1 74 TYR QE 4.621 . 7.290 3.488 2.933 3.847 . 0 0 "[ . 1 .]" 1
846 1 74 TYR QE 1 89 SER HB3 3.645 . 5.306 3.075 2.032 4.746 . 0 0 "[ . 1 .]" 1
847 1 97 GLU H 1 98 SER H 2.526 . 3.323 2.549 2.418 2.689 . 0 0 "[ . 1 .]" 1
848 1 90 LEU H 1 94 GLY H 5.169 . 8.509 5.896 5.662 6.208 . 0 0 "[ . 1 .]" 1
849 1 90 LEU H 1 91 GLY H 3.229 . 4.532 2.453 2.059 2.671 . 0 0 "[ . 1 .]" 1
850 1 80 GLY H 1 82 HIS H 5.402 . 9.049 5.467 4.869 5.861 . 0 0 "[ . 1 .]" 1
851 1 82 HIS H 1 83 GLY H 2.501 . 3.283 2.339 1.856 2.735 . 0 0 "[ . 1 .]" 1
852 1 87 ILE H 1 104 ASN H 3.363 . 4.777 3.788 3.340 4.148 . 0 0 "[ . 1 .]" 1
853 1 104 ASN H 1 105 TRP H 3.244 . 4.559 2.620 2.483 2.741 . 0 0 "[ . 1 .]" 1
854 1 89 SER H 1 104 ASN H 5.390 . 9.021 5.748 5.247 6.409 . 0 0 "[ . 1 .]" 1
855 1 103 GLY H 1 104 ASN H 4.621 . 7.291 4.454 4.229 4.560 . 0 0 "[ . 1 .]" 1
856 1 76 LEU H 1 77 LEU H 4.470 . 6.967 4.303 4.190 4.418 . 0 0 "[ . 1 .]" 1
857 1 77 LEU H 1 78 SER H 4.327 . 6.668 4.138 4.034 4.259 . 0 0 "[ . 1 .]" 1
858 1 77 LEU H 1 88 PHE H 5.269 . 8.740 5.146 4.997 5.529 . 0 0 "[ . 1 .]" 1
859 1 77 LEU H 1 86 ASP H 2.985 . 4.099 2.814 2.452 3.182 . 0 0 "[ . 1 .]" 1
860 1 81 GLN H 1 82 HIS H 2.472 . 3.236 2.321 2.076 2.707 . 0 0 "[ . 1 .]" 1
861 1 81 GLN H 1 83 GLY H 3.671 . 5.356 3.786 3.204 4.524 . 0 0 "[ . 1 .]" 1
862 1 80 GLY H 1 81 GLN H 4.782 . 7.641 4.595 4.566 4.611 . 0 0 "[ . 1 .]" 1
863 1 73 ASP H 1 74 TYR H 4.485 . 6.999 4.497 4.380 4.582 . 0 0 "[ . 1 .]" 1
864 1 74 TYR H 1 75 GLN H 4.840 . 6.919 4.625 4.602 4.654 . 0 0 "[ . 1 .]" 1
865 1 89 SER H 1 102 ILE H 3.242 . 4.556 3.070 2.668 3.725 . 0 0 "[ . 1 .]" 1
866 1 88 PHE H 1 89 SER H 4.497 . 7.025 4.355 4.289 4.391 . 0 0 "[ . 1 .]" 1
867 1 64 ARG H 1 65 LEU H 4.278 . 6.565 4.429 4.396 4.447 . 0 0 "[ . 1 .]" 1
868 1 53 ALA H 1 54 ARG H 4.858 . 7.809 4.521 4.494 4.562 . 0 0 "[ . 1 .]" 1
869 1 29 ASP H 1 31 SER H 4.150 . 6.303 3.840 3.761 3.979 . 0 0 "[ . 1 .]" 1
870 1 87 ILE H 1 88 PHE H 4.075 . 6.151 4.396 4.317 4.459 . 0 0 "[ . 1 .]" 1
871 1 31 SER H 1 32 ARG H 2.896 . 3.944 2.840 2.646 3.376 . 0 0 "[ . 1 .]" 1
872 1 30 ASN H 1 31 SER H 2.745 . 3.687 2.311 2.196 2.443 . 0 0 "[ . 1 .]" 1
873 1 35 THR H 1 38 GLN H 3.546 . 5.118 3.631 3.350 3.857 . 0 0 "[ . 1 .]" 1
874 1 75 GLN H 1 88 PHE H 3.000 . 4.125 3.105 2.747 3.459 . 0 0 "[ . 1 .]" 1
875 1 35 THR H 1 36 THR H 4.650 . 7.353 4.525 4.483 4.561 . 0 0 "[ . 1 .]" 1
876 1 85 VAL H 1 86 ASP H 4.102 . 6.205 4.297 4.202 4.411 . 0 0 "[ . 1 .]" 1
877 1 80 GLY H 1 86 ASP H 4.434 . 6.891 3.862 3.411 4.552 . 0 0 "[ . 1 .]" 1
878 1 52 HIS H 1 53 ALA H 4.850 . 7.791 4.521 4.477 4.551 . 0 0 "[ . 1 .]" 1
879 1 7 ALA H 1 8 ASP H 2.891 . 3.935 2.608 2.529 2.768 . 0 0 "[ . 1 .]" 1
880 1 16 LEU H 1 17 VAL H 2.646 . 3.521 2.770 2.720 2.806 . 0 0 "[ . 1 .]" 1
881 1 8 ASP H 1 9 ARG H 2.952 . 3.366 2.706 2.640 2.785 . 0 0 "[ . 1 .]" 1
882 1 8 ASP H 1 10 GLN H 4.429 . 6.881 4.105 3.989 4.202 . 0 0 "[ . 1 .]" 1
883 1 41 GLN H 1 42 ALA H 2.618 . 3.475 2.559 2.535 2.593 . 0 0 "[ . 1 .]" 1
884 1 22 ALA H 1 23 LEU H 2.385 . 3.096 2.671 2.551 2.736 . 0 0 "[ . 1 .]" 1
885 1 23 LEU H 1 24 ASP H 2.557 . 3.374 2.726 2.660 2.793 . 0 0 "[ . 1 .]" 1
886 1 14 SER H 1 15 ASP H 2.650 . 3.528 2.773 2.727 2.800 . 0 0 "[ . 1 .]" 1
887 1 61 TYR H 1 62 ILE H 2.301 . 2.963 1.988 1.692 2.205 . 0 0 "[ . 1 .]" 1
888 1 84 GLN H 1 85 VAL H 3.807 . 5.619 2.505 2.422 2.692 . 0 0 "[ . 1 .]" 1
889 1 60 GLY H 1 61 TYR H 4.732 . 7.531 4.552 4.428 4.613 . 0 0 "[ . 1 .]" 1
890 1 18 ALA H 1 19 LEU H 2.436 . 3.178 2.692 2.650 2.737 . 0 0 "[ . 1 .]" 1
891 1 27 LYS H 1 29 ASP H 4.626 . 7.300 4.249 3.940 4.448 . 0 0 "[ . 1 .]" 1
892 1 26 TYR H 1 27 LYS H 2.803 . 3.785 2.668 2.625 2.745 . 0 0 "[ . 1 .]" 1
893 1 75 GLN H 1 87 ILE H 5.302 . 8.207 7.322 6.928 7.746 . 0 0 "[ . 1 .]" 1
894 1 50 GLU H 1 52 HIS H 5.218 . 8.622 5.263 5.053 5.680 . 0 0 "[ . 1 .]" 1
895 1 40 LEU H 1 42 ALA H 4.014 . 6.028 4.025 3.925 4.129 . 0 0 "[ . 1 .]" 1
896 1 40 LEU H 1 41 GLN H 2.593 . 3.434 2.574 2.492 2.706 . 0 0 "[ . 1 .]" 1
897 1 38 GLN H 1 39 GLY H 2.472 . 3.236 2.577 2.524 2.696 . 0 0 "[ . 1 .]" 1
898 1 68 ASP H 1 74 TYR H 4.900 . 7.902 4.083 3.642 5.112 . 0 0 "[ . 1 .]" 1
899 1 17 VAL H 1 19 LEU H 3.304 . 4.668 4.090 4.026 4.150 . 0 0 "[ . 1 .]" 1
900 1 67 GLN H 1 68 ASP H 4.503 . 7.037 4.354 4.262 4.417 . 0 0 "[ . 1 .]" 1
901 1 15 ASP H 1 17 VAL H 3.868 . 5.738 4.287 4.158 4.345 . 0 0 "[ . 1 .]" 1
902 1 68 ASP H 1 73 ASP H 4.108 . 6.217 4.925 4.523 5.509 . 0 0 "[ . 1 .]" 1
903 1 5 GLU H 1 7 ALA H 4.563 . 7.166 4.323 4.172 4.629 . 0 0 "[ . 1 .]" 1
904 1 42 ALA H 1 43 LEU H 2.695 . 3.603 2.771 2.703 2.842 . 0 0 "[ . 1 .]" 1
905 1 17 VAL H 1 20 GLU H 3.955 . 5.911 4.730 4.584 4.839 . 0 0 "[ . 1 .]" 1
906 1 41 GLN H 1 43 LEU H 4.355 . 6.725 4.606 4.399 4.832 . 0 0 "[ . 1 .]" 1
907 1 68 ASP H 1 72 SER H 3.205 . 4.489 3.318 2.791 3.617 . 0 0 "[ . 1 .]" 1
908 1 93 ASP H 1 95 VAL H 4.211 . 6.428 3.885 3.643 4.287 . 0 0 "[ . 1 .]" 1
909 1 68 ASP H 1 71 GLY H 4.179 . 6.362 4.212 3.907 4.611 . 0 0 "[ . 1 .]" 1
910 1 86 ASP H 1 87 ILE H 4.756 . 7.584 4.298 4.222 4.370 . 0 0 "[ . 1 .]" 1
911 1 17 VAL H 1 18 ALA H 2.392 . 3.107 2.649 2.616 2.695 . 0 0 "[ . 1 .]" 1
912 1 27 LYS H 1 33 TYR H 4.433 . 6.889 6.319 5.717 6.900 0.011 9 0 "[ . 1 .]" 1
913 1 43 LEU H 1 45 SER H 4.086 . 6.172 4.149 3.808 4.499 . 0 0 "[ . 1 .]" 1
914 1 63 ARG H 1 64 ARG H 3.013 . 4.148 2.598 2.496 2.713 . 0 0 "[ . 1 .]" 1
915 1 26 TYR H 1 30 ASN H 4.446 . 6.917 5.868 5.726 5.984 . 0 0 "[ . 1 .]" 1
916 1 55 ASN H 1 56 TYR H 3.529 . 5.086 2.677 2.512 2.835 . 0 0 "[ . 1 .]" 1
917 1 13 VAL H 1 15 ASP H 4.057 . 6.114 4.417 4.304 4.511 . 0 0 "[ . 1 .]" 1
918 1 12 VAL H 1 13 VAL H 2.539 . 3.345 2.721 2.676 2.757 . 0 0 "[ . 1 .]" 1
919 1 26 TYR H 1 28 LEU H 3.677 . 5.367 3.965 3.869 4.083 . 0 0 "[ . 1 .]" 1
920 1 25 MET H 1 28 LEU H 4.234 . 6.475 4.580 4.468 4.696 . 0 0 "[ . 1 .]" 1
921 1 27 LYS H 1 28 LEU H 2.806 . 3.790 2.583 2.532 2.649 . 0 0 "[ . 1 .]" 1
922 1 21 GLY H 1 22 ALA H 2.575 . 3.404 2.734 2.688 2.805 . 0 0 "[ . 1 .]" 1
923 1 18 ALA H 1 21 GLY H 3.490 . 5.012 4.596 4.433 4.708 . 0 0 "[ . 1 .]" 1
924 1 19 LEU H 1 21 GLY H 3.794 . 5.593 3.999 3.794 4.153 . 0 0 "[ . 1 .]" 1
925 1 5 GLU H 1 6 LYS H 2.885 . 3.925 2.739 2.662 2.832 . 0 0 "[ . 1 .]" 1
926 1 104 ASN H 1 109 PHE H 4.798 . 7.675 6.347 5.782 7.186 . 0 0 "[ . 1 .]" 1
927 1 72 SER H 1 73 ASP H 4.575 . 7.191 4.524 4.459 4.561 . 0 0 "[ . 1 .]" 1
928 1 13 VAL H 1 14 SER H 2.617 . 3.473 2.716 2.671 2.740 . 0 0 "[ . 1 .]" 1
929 1 88 PHE QE 1 98 SER H 5.131 . 8.422 5.708 5.110 6.614 . 0 0 "[ . 1 .]" 1
930 1 102 ILE H 1 103 GLY H 4.348 . 6.712 4.250 4.133 4.367 . 0 0 "[ . 1 .]" 1
931 1 101 ASP H 1 102 ILE H 4.768 . 7.601 4.257 3.717 4.599 . 0 0 "[ . 1 .]" 1
932 1 43 LEU H 1 44 VAL H 2.583 . 3.417 2.346 2.222 2.454 . 0 0 "[ . 1 .]" 1
933 1 62 ILE H 1 64 ARG H 4.630 . 7.310 5.170 5.016 5.401 . 0 0 "[ . 1 .]" 1
934 1 67 GLN H 1 71 GLY H 4.582 . 7.206 7.000 6.734 7.237 0.031 5 0 "[ . 1 .]" 1
935 1 75 GLN H 1 76 LEU H 4.520 . 6.144 4.398 4.309 4.464 . 0 0 "[ . 1 .]" 1
936 1 80 GLY H 1 85 VAL H 3.614 . 5.247 3.896 3.652 4.202 . 0 0 "[ . 1 .]" 1
937 1 12 VAL H 1 14 SER H 3.825 . 5.654 4.063 3.962 4.116 . 0 0 "[ . 1 .]" 1
938 1 98 SER H 1 101 ASP H 3.701 . 5.413 4.191 3.681 4.963 . 0 0 "[ . 1 .]" 1
939 1 24 ASP H 1 25 MET H 2.654 . 3.535 2.664 2.523 2.727 . 0 0 "[ . 1 .]" 1
940 1 98 SER H 1 100 ASP H 4.104 . 6.209 4.853 4.295 5.098 . 0 0 "[ . 1 .]" 1
941 1 94 GLY H 1 95 VAL H 2.971 . 4.075 2.666 2.563 2.953 . 0 0 "[ . 1 .]" 1
942 1 93 ASP H 1 94 GLY H 2.816 . 3.808 2.321 2.205 2.458 . 0 0 "[ . 1 .]" 1
943 1 80 GLY H 1 84 GLN HE22 2.942 . 4.024 3.795 3.146 4.165 0.141 10 0 "[ . 1 .]" 1
944 1 67 GLN HE22 1 73 ASP H 4.384 . 6.786 5.799 4.579 6.797 0.011 5 0 "[ . 1 .]" 1
945 1 37 GLU H 1 38 GLN H 2.780 . 3.746 2.474 2.428 2.548 . 0 0 "[ . 1 .]" 1
946 1 80 GLY H 1 83 GLY H 4.112 . 6.225 4.709 4.360 5.188 . 0 0 "[ . 1 .]" 1
947 1 100 ASP H 1 101 ASP H 2.486 . 3.258 2.807 2.036 3.505 0.247 13 0 "[ . 1 .]" 1
948 1 42 ALA H 1 44 VAL H 4.473 . 6.973 4.130 3.952 4.237 . 0 0 "[ . 1 .]" 1
949 1 28 LEU H 1 29 ASP H 2.848 . 3.862 2.674 2.545 2.787 . 0 0 "[ . 1 .]" 1
950 1 29 ASP H 1 30 ASN H 2.863 . 3.888 2.579 2.533 2.634 . 0 0 "[ . 1 .]" 1
951 1 70 TRP HH2 1 71 GLY H 5.332 . 8.885 8.180 7.987 8.430 . 0 0 "[ . 1 .]" 1
952 1 26 TYR QD 1 38 GLN H 6.236 . 11.098 7.297 6.919 7.543 . 0 0 "[ . 1 .]" 1
953 1 26 TYR QD 1 49 ALA H 5.894 . 10.236 8.253 7.701 8.740 . 0 0 "[ . 1 .]" 1
954 1 26 TYR QD 1 27 LYS H 4.038 . 6.076 3.643 3.127 4.238 . 0 0 "[ . 1 .]" 1
955 1 26 TYR QD 1 42 ALA H 5.015 . 8.159 5.782 4.906 6.638 . 0 0 "[ . 1 .]" 1
956 1 26 TYR QD 1 29 ASP H 5.025 . 8.181 5.481 4.948 5.723 . 0 0 "[ . 1 .]" 1
957 1 26 TYR QD 1 30 ASN QD 5.511 . 7.050 3.084 2.857 3.862 . 0 0 "[ . 1 .]" 1
958 1 26 TYR H 1 26 TYR QD 4.779 . 7.634 4.134 3.825 4.220 . 0 0 "[ . 1 .]" 1
959 1 61 TYR H 1 61 TYR QD 3.663 . 5.340 2.931 2.332 3.516 . 0 0 "[ . 1 .]" 1
960 1 56 TYR H 1 56 TYR QD 3.405 . 4.854 2.104 1.921 2.331 0.035 14 0 "[ . 1 .]" 1
961 1 56 TYR QD 1 60 GLY H 4.489 . 5.725 3.940 3.560 4.770 . 0 0 "[ . 1 .]" 1
962 1 73 ASP H 1 75 GLN HE22 4.143 . 6.289 4.474 3.899 5.413 . 0 0 "[ . 1 .]" 1
963 1 75 GLN HE22 1 76 LEU H 5.365 . 8.963 5.854 5.553 6.094 . 0 0 "[ . 1 .]" 1
964 1 23 LEU H 1 33 TYR HD1 6.322 . 11.317 7.470 5.326 10.521 . 0 0 "[ . 1 .]" 1
965 1 24 ASP H 1 33 TYR HD1 5.406 . 9.059 6.737 4.599 9.458 0.399 10 0 "[ . 1 .]" 1
966 1 33 TYR H 1 33 TYR HD1 3.531 . 5.090 4.068 2.841 4.946 . 0 0 "[ . 1 .]" 1
967 1 88 PHE H 1 88 PHE QD 3.486 . 5.005 3.036 2.709 3.311 . 0 0 "[ . 1 .]" 1
968 1 32 ARG H 1 33 TYR HD1 5.295 . 8.800 6.967 6.509 7.898 . 0 0 "[ . 1 .]" 1
969 1 103 GLY H 1 106 THR H 3.993 . 5.986 3.422 3.080 3.904 . 0 0 "[ . 1 .]" 1
970 1 87 ILE H 1 88 PHE QD 3.789 . 5.584 4.049 3.813 4.303 . 0 0 "[ . 1 .]" 1
971 1 104 ASN H 1 106 THR H 4.144 . 6.291 3.962 3.785 4.299 . 0 0 "[ . 1 .]" 1
972 1 88 PHE QD 1 101 ASP H 5.192 . 8.562 6.631 5.908 7.495 . 0 0 "[ . 1 .]" 1
973 1 106 THR H 1 107 ILE H 3.275 . 3.541 2.526 2.329 2.829 . 0 0 "[ . 1 .]" 1
974 1 105 TRP H 1 106 THR H 2.945 . 4.029 2.460 2.369 2.583 . 0 0 "[ . 1 .]" 1
975 1 74 TYR QD 1 75 GLN H 3.948 . 5.897 3.676 3.439 4.061 . 0 0 "[ . 1 .]" 1
976 1 88 PHE QD 1 89 SER H 4.608 . 7.263 3.811 3.555 4.162 . 0 0 "[ . 1 .]" 1
977 1 68 ASP H 1 74 TYR QD 4.676 . 7.410 3.777 3.057 4.315 . 0 0 "[ . 1 .]" 1
978 1 70 TRP HZ3 1 91 GLY H 3.029 . 4.176 3.962 3.047 4.203 0.027 5 0 "[ . 1 .]" 1
979 1 27 LYS H 1 33 TYR QE 4.780 . 7.636 5.116 4.600 6.237 . 0 0 "[ . 1 .]" 1
980 1 33 TYR H 1 33 TYR QE 5.624 . 9.578 4.929 4.612 5.223 . 0 0 "[ . 1 .]" 1
981 1 67 GLN H 1 74 TYR QE 4.710 . 7.484 3.218 2.919 3.873 . 0 0 "[ . 1 .]" 1
982 1 74 TYR H 1 74 TYR QE 5.780 . 9.956 4.363 4.215 4.564 . 0 0 "[ . 1 .]" 1
983 1 68 ASP H 1 74 TYR QE 4.374 . 6.766 3.296 2.439 3.905 . 0 0 "[ . 1 .]" 1
984 1 29 ASP H 1 30 ASN QD 4.756 . 7.583 4.064 3.628 5.584 . 0 0 "[ . 1 .]" 1
985 1 30 ASN H 1 30 ASN QD 3.306 . 4.672 2.629 2.253 3.915 . 0 0 "[ . 1 .]" 1
986 1 88 PHE HA 1 102 ILE H 4.763 . 7.599 4.949 4.632 5.505 . 0 0 "[ . 1 .]" 1
987 1 88 PHE HA 1 89 SER H 2.583 . 3.417 2.285 2.156 2.402 . 0 0 "[ . 1 .]" 1
988 1 88 PHE HA 1 103 GLY H 4.928 . 7.964 4.432 4.167 5.009 . 0 0 "[ . 1 .]" 1
989 1 88 PHE HA 1 91 GLY H 4.840 . 7.768 7.416 7.029 7.704 . 0 0 "[ . 1 .]" 1
990 1 87 ILE HA 1 88 PHE H 2.262 . 2.902 2.155 2.123 2.198 . 0 0 "[ . 1 .]" 1
991 1 76 LEU H 1 76 LEU HA 2.902 . 3.955 2.943 2.934 2.948 . 0 0 "[ . 1 .]" 1
992 1 79 PRO HA 1 80 GLY H 2.229 . 2.850 2.225 2.158 2.349 . 0 0 "[ . 1 .]" 1
993 1 35 THR HA 1 37 GLU H 3.359 . 4.770 4.721 4.513 4.835 0.065 1 0 "[ . 1 .]" 1
994 1 35 THR HA 1 38 GLN H 3.819 . 5.642 4.754 4.592 4.905 . 0 0 "[ . 1 .]" 1
995 1 35 THR HA 1 36 THR H 2.365 . 3.064 2.616 2.577 2.651 . 0 0 "[ . 1 .]" 1
996 1 77 LEU HA 1 78 SER H 2.156 . 2.737 2.131 2.112 2.174 . 0 0 "[ . 1 .]" 1
997 1 103 GLY QA 1 104 ASN H 3.333 . 3.926 2.241 2.170 2.293 . 0 0 "[ . 1 .]" 1
998 1 96 PRO HA 1 101 ASP H 4.590 . 7.223 6.252 5.707 7.057 . 0 0 "[ . 1 .]" 1
999 1 29 ASP H 1 30 ASN HA 5.183 . 8.541 5.209 5.188 5.231 . 0 0 "[ . 1 .]" 1
1000 1 30 ASN HA 1 31 SER H 3.464 . 4.964 3.220 3.045 3.316 . 0 0 "[ . 1 .]" 1
1001 1 30 ASN HA 1 32 ARG H 4.164 . 6.332 4.502 4.271 4.807 . 0 0 "[ . 1 .]" 1
1002 1 89 SER H 1 103 GLY QA 4.862 . 7.817 3.376 3.027 3.828 . 0 0 "[ . 1 .]" 1
1003 1 96 PRO HA 1 97 GLU H 2.412 . 3.139 2.226 2.164 2.330 . 0 0 "[ . 1 .]" 1
1004 1 70 TRP H 1 72 SER HA 5.594 . 9.505 6.550 6.340 6.742 . 0 0 "[ . 1 .]" 1
1005 1 96 PRO HA 1 98 SER H 3.205 . 4.489 3.339 3.046 3.640 . 0 0 "[ . 1 .]" 1
1006 1 42 ALA HA 1 53 ALA H 4.457 . 6.940 6.653 6.155 6.942 0.002 1 0 "[ . 1 .]" 1
1007 1 105 TRP HA 1 109 PHE H 3.338 . 4.731 4.017 3.083 4.685 . 0 0 "[ . 1 .]" 1
1008 1 105 TRP HA 1 107 ILE H 3.780 . 5.566 4.363 4.090 4.537 . 0 0 "[ . 1 .]" 1
1009 1 72 SER H 1 72 SER HA 2.836 . 3.841 2.932 2.919 2.940 . 0 0 "[ . 1 .]" 1
1010 1 72 SER HA 1 75 GLN HE22 5.270 . 8.742 6.430 5.831 7.549 . 0 0 "[ . 1 .]" 1
1011 1 105 TRP HA 1 106 THR H 3.020 . 4.160 3.465 3.422 3.521 . 0 0 "[ . 1 .]" 1
1012 1 105 TRP HA 1 108 GLY H 3.403 . 4.851 3.495 3.199 3.792 . 0 0 "[ . 1 .]" 1
1013 1 71 GLY H 1 72 SER HA 5.432 . 9.121 4.806 4.675 4.931 . 0 0 "[ . 1 .]" 1
1014 1 72 SER HA 1 94 GLY H 5.093 . 8.336 6.837 6.044 7.821 . 0 0 "[ . 1 .]" 1
1015 1 72 SER HA 1 73 ASP H 2.223 . 2.841 2.272 2.147 2.409 . 0 0 "[ . 1 .]" 1
1016 1 50 GLU H 1 51 PRO HA 4.733 . 7.533 4.800 4.704 4.933 . 0 0 "[ . 1 .]" 1
1017 1 42 ALA H 1 42 ALA HA 2.674 . 3.568 2.791 2.783 2.800 . 0 0 "[ . 1 .]" 1
1018 1 41 GLN H 1 42 ALA HA 5.017 . 8.163 5.008 4.927 5.087 . 0 0 "[ . 1 .]" 1
1019 1 51 PRO HA 1 52 HIS H 2.529 . 3.329 2.152 2.088 2.219 . 0 0 "[ . 1 .]" 1
1020 1 44 VAL H 1 44 VAL HA 2.881 . 3.919 2.946 2.939 2.950 . 0 0 "[ . 1 .]" 1
1021 1 34 PRO HA 1 35 THR H 2.441 . 3.186 2.223 2.176 2.313 . 0 0 "[ . 1 .]" 1
1022 1 24 ASP HA 1 25 MET H 3.937 . 5.874 3.532 3.504 3.541 . 0 0 "[ . 1 .]" 1
1023 1 66 PRO HA 1 67 GLN H 2.285 . 2.937 2.159 2.085 2.238 . 0 0 "[ . 1 .]" 1
1024 1 43 LEU HA 1 61 TYR H 3.212 . 4.501 3.035 2.620 3.393 . 0 0 "[ . 1 .]" 1
1025 1 24 ASP HA 1 28 LEU H 3.996 . 5.992 4.129 4.011 4.325 . 0 0 "[ . 1 .]" 1
1026 1 24 ASP HA 1 26 TYR H 4.601 . 7.247 4.498 4.352 4.606 . 0 0 "[ . 1 .]" 1
1027 1 45 SER H 1 45 SER HA 2.838 . 3.845 2.893 2.877 2.923 . 0 0 "[ . 1 .]" 1
1028 1 29 ASP HA 1 31 SER H 4.346 . 6.707 4.291 4.077 4.471 . 0 0 "[ . 1 .]" 1
1029 1 54 ARG HA 1 55 ASN QD 3.896 . 5.793 4.622 3.814 5.588 . 0 0 "[ . 1 .]" 1
1030 1 49 ALA HA 1 50 GLU H 2.267 . 2.910 2.188 2.114 2.270 . 0 0 "[ . 1 .]" 1
1031 1 67 GLN HA 1 68 ASP H 2.309 . 2.976 2.204 2.111 2.276 . 0 0 "[ . 1 .]" 1
1032 1 32 ARG H 1 32 ARG HA 2.875 . 3.908 2.885 2.834 2.945 . 0 0 "[ . 1 .]" 1
1033 1 55 ASN H 1 56 TYR HA 3.879 . 5.760 5.208 5.116 5.338 . 0 0 "[ . 1 .]" 1
1034 1 56 TYR H 1 56 TYR HA 2.387 . 3.099 2.909 2.848 2.941 . 0 0 "[ . 1 .]" 1
1035 1 89 SER HA 1 102 ILE H 4.530 . 7.096 4.885 4.615 5.477 . 0 0 "[ . 1 .]" 1
1036 1 89 SER HA 1 91 GLY H 4.786 . 7.650 3.955 3.735 4.161 . 0 0 "[ . 1 .]" 1
1037 1 89 SER HA 1 90 LEU H 3.553 . 5.131 2.246 2.125 2.394 . 0 0 "[ . 1 .]" 1
1038 1 53 ALA HA 1 54 ARG H 2.369 . 3.071 2.135 2.117 2.156 . 0 0 "[ . 1 .]" 1
1039 1 62 ILE HA 1 63 ARG H 2.517 . 3.309 2.210 2.156 2.237 . 0 0 "[ . 1 .]" 1
1040 1 85 VAL H 1 85 VAL HA 2.803 . 3.785 2.929 2.916 2.942 . 0 0 "[ . 1 .]" 1
1041 1 80 GLY H 1 85 VAL HA 2.900 . 3.951 2.582 2.266 3.086 . 0 0 "[ . 1 .]" 1
1042 1 64 ARG HA 1 65 LEU H 2.169 . 2.757 2.375 2.264 2.494 . 0 0 "[ . 1 .]" 1
1043 1 74 TYR HA 1 88 PHE H 5.189 . 8.554 4.970 4.456 5.576 . 0 0 "[ . 1 .]" 1
1044 1 62 ILE H 1 62 ILE HA 2.684 . 3.584 2.923 2.907 2.938 . 0 0 "[ . 1 .]" 1
1045 1 74 TYR HA 1 75 GLN H 2.555 . 3.371 2.294 2.192 2.447 . 0 0 "[ . 1 .]" 1
1046 1 64 ARG H 1 64 ARG HA 2.749 . 3.694 2.938 2.930 2.943 . 0 0 "[ . 1 .]" 1
1047 1 84 GLN HE22 1 85 VAL HA 4.237 . 6.481 4.870 4.173 5.724 . 0 0 "[ . 1 .]" 1
1048 1 75 GLN HA 1 75 GLN HE22 3.933 . 5.867 3.906 3.558 4.077 . 0 0 "[ . 1 .]" 1
1049 1 75 GLN HA 1 76 LEU H 2.248 . 2.880 2.163 2.114 2.240 . 0 0 "[ . 1 .]" 1
1050 1 60 GLY HA3 1 61 TYR H 2.626 . 3.488 2.264 2.092 2.490 . 0 0 "[ . 1 .]" 1
1051 1 35 THR H 1 35 THR HB 3.507 . 5.044 3.371 2.801 3.633 . 0 0 "[ . 1 .]" 1
1052 1 15 ASP H 1 15 ASP HA 2.694 . 3.601 2.846 2.840 2.851 . 0 0 "[ . 1 .]" 1
1053 1 25 MET HA 1 26 TYR H 3.425 . 4.891 3.532 3.505 3.547 . 0 0 "[ . 1 .]" 1
1054 1 25 MET H 1 25 MET HA 2.753 . 3.700 2.830 2.797 2.846 . 0 0 "[ . 1 .]" 1
1055 1 39 GLY HA3 1 42 ALA H 4.315 . 6.643 4.734 4.603 4.863 . 0 0 "[ . 1 .]" 1
1056 1 38 GLN H 1 39 GLY HA3 4.465 . 6.957 4.866 4.803 5.008 . 0 0 "[ . 1 .]" 1
1057 1 39 GLY HA3 1 41 GLN H 3.577 . 5.177 4.597 4.455 4.846 . 0 0 "[ . 1 .]" 1
1058 1 12 VAL HA 1 13 VAL H 3.544 . 5.114 3.547 3.534 3.560 . 0 0 "[ . 1 .]" 1
1059 1 35 THR HB 1 36 THR H 2.182 . 2.777 2.272 1.969 2.908 0.131 3 0 "[ . 1 .]" 1
1060 1 39 GLY HA3 1 40 LEU H 2.331 . 3.010 2.714 2.688 2.756 . 0 0 "[ . 1 .]" 1
1061 1 45 SER H 1 60 GLY HA3 3.992 . 5.984 4.564 3.874 4.896 . 0 0 "[ . 1 .]" 1
1062 1 106 THR H 1 106 THR HA 2.956 . 4.048 2.852 2.779 2.903 . 0 0 "[ . 1 .]" 1
1063 1 25 MET HA 1 28 LEU H 3.287 . 4.638 3.297 2.992 3.566 . 0 0 "[ . 1 .]" 1
1064 1 12 VAL HA 1 68 ASP H 4.955 . 8.023 6.123 5.635 6.460 . 0 0 "[ . 1 .]" 1
1065 1 25 MET HA 1 27 LYS H 4.639 . 7.330 4.414 4.234 4.661 . 0 0 "[ . 1 .]" 1
1066 1 12 VAL H 1 12 VAL HA 2.672 . 3.565 2.800 2.795 2.807 . 0 0 "[ . 1 .]" 1
1067 1 25 MET HA 1 29 ASP H 4.441 . 6.906 4.161 3.909 4.366 . 0 0 "[ . 1 .]" 1
1068 1 82 HIS HA 1 83 GLY H 3.298 . 4.658 3.239 2.731 3.559 . 0 0 "[ . 1 .]" 1
1069 1 57 PRO HA 1 58 GLU H 2.395 . 3.112 2.197 2.172 2.221 . 0 0 "[ . 1 .]" 1
1070 1 18 ALA H 1 18 ALA HA 2.544 . 3.353 2.812 2.807 2.826 . 0 0 "[ . 1 .]" 1
1071 1 5 GLU H 1 5 GLU HA 2.867 . 3.895 2.783 2.753 2.804 . 0 0 "[ . 1 .]" 1
1072 1 70 TRP H 1 71 GLY HA2 5.353 . 8.935 4.756 4.660 4.895 . 0 0 "[ . 1 .]" 1
1073 1 18 ALA HA 1 22 ALA H 3.688 . 5.389 4.094 3.872 4.498 . 0 0 "[ . 1 .]" 1
1074 1 18 ALA HA 1 20 GLU H 4.472 . 6.971 4.555 4.427 4.680 . 0 0 "[ . 1 .]" 1
1075 1 71 GLY HA2 1 72 SER H 3.847 . 5.697 3.082 2.898 3.245 . 0 0 "[ . 1 .]" 1
1076 1 31 SER H 1 31 SER HA 2.356 . 3.050 2.262 2.257 2.266 . 0 0 "[ . 1 .]" 1
1077 1 31 SER HA 1 32 ARG H 3.059 . 4.229 3.147 2.870 3.558 . 0 0 "[ . 1 .]" 1
1078 1 30 ASN H 1 31 SER HA 4.838 . 7.764 4.508 4.403 4.673 . 0 0 "[ . 1 .]" 1
1079 1 102 ILE HA 1 103 GLY H 2.417 . 3.147 2.152 2.120 2.177 . 0 0 "[ . 1 .]" 1
1080 1 7 ALA H 1 7 ALA HA 2.521 . 3.316 2.833 2.799 2.851 . 0 0 "[ . 1 .]" 1
1081 1 101 ASP HA 1 102 ILE H 2.418 . 3.149 2.168 2.088 2.235 . 0 0 "[ . 1 .]" 1
1082 1 93 ASP H 1 93 ASP HA 2.957 . 4.050 2.908 2.884 2.929 . 0 0 "[ . 1 .]" 1
1083 1 101 ASP H 1 101 ASP HA 2.849 . 3.864 2.856 2.729 2.948 . 0 0 "[ . 1 .]" 1
1084 1 100 ASP H 1 101 ASP HA 5.057 . 8.253 5.007 4.526 5.252 . 0 0 "[ . 1 .]" 1
1085 1 6 LYS H 1 6 LYS HA 2.913 . 3.974 2.810 2.777 2.845 . 0 0 "[ . 1 .]" 1
1086 1 10 GLN HA 1 11 LYS H 2.731 . 3.663 3.529 3.512 3.551 . 0 0 "[ . 1 .]" 1
1087 1 83 GLY H 1 83 GLY HA3 2.758 . 3.709 2.739 2.496 2.937 . 0 0 "[ . 1 .]" 1
1088 1 14 SER HB3 1 15 ASP H 2.425 . 3.160 2.932 2.431 3.658 0.498 14 0 "[ . 1 .]" 1
1089 1 14 SER HA 1 17 VAL H 2.862 . 3.886 3.637 3.460 3.718 . 0 0 "[ . 1 .]" 1
1090 1 9 ARG H 1 9 ARG HA 2.620 . 3.478 2.828 2.810 2.841 . 0 0 "[ . 1 .]" 1
1091 1 9 ARG HA 1 12 VAL H 2.983 . 4.095 3.006 2.910 3.091 . 0 0 "[ . 1 .]" 1
1092 1 35 THR H 1 38 GLN HA 5.313 . 6.928 5.121 4.868 5.390 . 0 0 "[ . 1 .]" 1
1093 1 14 SER H 1 14 SER HB3 2.115 . 2.674 2.980 2.528 3.592 0.918 5 6 "[* * +* * -.]" 1
1094 1 41 GLN HA 1 41 GLN HE21 4.569 . 7.178 3.867 3.113 5.570 . 0 0 "[ . 1 .]" 1
1095 1 90 LEU HA 1 91 GLY H 3.679 . 5.371 3.446 3.378 3.515 . 0 0 "[ . 1 .]" 1
1096 1 38 GLN H 1 38 GLN HA 2.857 . 3.878 2.838 2.807 2.852 . 0 0 "[ . 1 .]" 1
1097 1 104 ASN HA 1 106 THR H 3.532 . 5.092 4.075 3.827 4.514 . 0 0 "[ . 1 .]" 1
1098 1 94 GLY HA3 1 95 VAL H 3.122 . 4.340 3.364 3.259 3.440 . 0 0 "[ . 1 .]" 1
1099 1 41 GLN HA 1 44 VAL H 3.451 . 4.940 3.417 3.153 3.647 . 0 0 "[ . 1 .]" 1
1100 1 41 GLN H 1 41 GLN HA 2.702 . 3.614 2.847 2.834 2.853 . 0 0 "[ . 1 .]" 1
1101 1 104 ASN HA 1 105 TRP H 4.014 . 5.327 3.493 3.453 3.531 . 0 0 "[ . 1 .]" 1
1102 1 27 LYS HA 1 32 ARG H 2.616 . 3.472 2.314 1.865 3.484 0.012 9 0 "[ . 1 .]" 1
1103 1 27 LYS HA 1 30 ASN H 3.253 . 4.576 3.478 3.361 3.753 . 0 0 "[ . 1 .]" 1
1104 1 41 GLN HA 1 45 SER H 3.952 . 5.904 3.367 2.977 4.039 . 0 0 "[ . 1 .]" 1
1105 1 27 LYS H 1 27 LYS HA 2.880 . 3.917 2.839 2.821 2.850 . 0 0 "[ . 1 .]" 1
1106 1 40 LEU HA 1 43 LEU H 3.262 . 4.592 4.411 4.176 4.642 0.050 8 0 "[ . 1 .]" 1
1107 1 23 LEU HA 1 26 TYR H 3.118 . 4.333 3.542 3.414 3.675 . 0 0 "[ . 1 .]" 1
1108 1 48 SER H 1 48 SER HB3 4.396 . 5.966 3.273 2.542 3.644 . 0 0 "[ . 1 .]" 1
1109 1 40 LEU H 1 40 LEU HA 2.574 . 3.402 2.835 2.796 2.853 . 0 0 "[ . 1 .]" 1
1110 1 23 LEU H 1 23 LEU HA 2.497 . 3.276 2.805 2.786 2.824 . 0 0 "[ . 1 .]" 1
1111 1 108 GLY QA 1 109 PHE H 4.035 . 6.070 2.793 2.311 2.945 . 0 0 "[ . 1 .]" 1
1112 1 89 SER HB3 1 102 ILE H 3.758 . 5.523 4.173 2.592 5.055 . 0 0 "[ . 1 .]" 1
1113 1 89 SER H 1 89 SER HB3 3.426 . 4.893 3.300 2.314 3.807 . 0 0 "[ . 1 .]" 1
1114 1 69 PRO HD2 1 71 GLY H 4.248 . 6.504 4.859 4.733 4.958 . 0 0 "[ . 1 .]" 1
1115 1 80 GLY QA 1 86 ASP H 3.321 . 4.691 2.551 2.244 2.912 . 0 0 "[ . 1 .]" 1
1116 1 68 ASP H 1 72 SER HB3 4.644 . 7.340 4.990 4.414 5.572 . 0 0 "[ . 1 .]" 1
1117 1 80 GLY QA 1 83 GLY H 2.994 . 4.114 3.148 2.661 3.724 . 0 0 "[ . 1 .]" 1
1118 1 72 SER HB3 1 73 ASP H 2.423 . 3.157 2.967 2.443 3.863 0.706 14 2 "[ . - +.]" 1
1119 1 72 SER H 1 72 SER HB3 3.248 . 4.567 3.608 3.105 3.709 . 0 0 "[ . 1 .]" 1
1120 1 80 GLY QA 1 85 VAL H 3.916 . 5.833 3.700 3.165 4.148 . 0 0 "[ . 1 .]" 1
1121 1 20 GLU H 1 20 GLU HA 2.466 . 3.226 2.805 2.773 2.841 . 0 0 "[ . 1 .]" 1
1122 1 72 SER HB3 1 93 ASP H 4.767 . 7.607 7.040 6.417 7.722 0.115 4 0 "[ . 1 .]" 1
1123 1 41 GLN HE22 1 45 SER HB3 4.473 . 6.974 5.621 2.565 7.729 0.755 11 2 "[ . 1+- .]" 1
1124 1 97 GLU HA 1 101 ASP H 4.445 . 6.915 6.061 5.344 6.649 . 0 0 "[ . 1 .]" 1
1125 1 16 LEU H 1 16 LEU HA 2.758 . 3.709 2.798 2.788 2.815 . 0 0 "[ . 1 .]" 1
1126 1 97 GLU H 1 97 GLU HA 2.411 . 3.138 2.265 2.240 2.275 . 0 0 "[ . 1 .]" 1
1127 1 44 VAL H 1 45 SER HB3 5.045 . 8.226 5.407 4.787 6.219 . 0 0 "[ . 1 .]" 1
1128 1 45 SER H 1 45 SER HB3 2.792 . 3.766 3.405 2.883 3.975 0.209 11 0 "[ . 1 .]" 1
1129 1 36 THR HB 1 37 GLU H 3.511 . 5.052 3.808 2.488 4.031 . 0 0 "[ . 1 .]" 1
1130 1 36 THR HB 1 38 GLN H 4.771 . 7.617 5.805 4.844 6.007 . 0 0 "[ . 1 .]" 1
1131 1 36 THR H 1 36 THR HB 2.458 . 3.213 2.540 2.474 2.637 . 0 0 "[ . 1 .]" 1
1132 1 97 GLU HA 1 98 SER H 2.728 . 3.658 2.953 2.720 3.075 . 0 0 "[ . 1 .]" 1
1133 1 71 GLY HA3 1 72 SER H 3.572 . 5.167 3.443 3.350 3.518 . 0 0 "[ . 1 .]" 1
1134 1 71 GLY H 1 71 GLY HA3 2.596 . 3.438 2.949 2.929 2.961 . 0 0 "[ . 1 .]" 1
1135 1 51 PRO QD 1 52 HIS H 5.410 . 9.069 4.919 4.838 4.983 . 0 0 "[ . 1 .]" 1
1136 1 26 TYR HA 1 29 ASP H 3.841 . 5.685 3.532 3.132 3.721 . 0 0 "[ . 1 .]" 1
1137 1 93 ASP H 1 94 GLY HA2 5.011 . 8.149 4.613 4.472 4.754 . 0 0 "[ . 1 .]" 1
1138 1 88 PHE HB3 1 89 SER H 4.433 . 6.890 3.733 3.587 3.924 . 0 0 "[ . 1 .]" 1
1139 1 94 GLY H 1 94 GLY HA2 2.638 . 3.508 2.303 2.294 2.313 . 0 0 "[ . 1 .]" 1
1140 1 87 ILE H 1 88 PHE HB3 4.051 . 6.103 4.899 4.627 5.198 . 0 0 "[ . 1 .]" 1
1141 1 88 PHE H 1 88 PHE HB3 4.081 . 6.163 3.479 3.405 3.553 . 0 0 "[ . 1 .]" 1
1142 1 26 TYR HA 1 30 ASN H 4.311 . 6.634 3.822 3.603 3.971 . 0 0 "[ . 1 .]" 1
1143 1 13 VAL H 1 13 VAL HA 2.659 . 3.543 2.798 2.790 2.810 . 0 0 "[ . 1 .]" 1
1144 1 105 TRP H 1 105 TRP HB3 3.231 . 4.536 2.556 2.369 2.743 . 0 0 "[ . 1 .]" 1
1145 1 13 VAL HA 1 14 SER H 3.381 . 4.810 3.532 3.519 3.544 . 0 0 "[ . 1 .]" 1
1146 1 105 TRP HB3 1 106 THR H 4.559 . 7.157 2.962 2.838 3.148 . 0 0 "[ . 1 .]" 1
1147 1 82 HIS H 1 105 TRP HB3 4.863 . 7.819 6.166 5.352 6.992 . 0 0 "[ . 1 .]" 1
1148 1 12 VAL H 1 13 VAL HA 4.681 . 7.420 5.317 5.285 5.347 . 0 0 "[ . 1 .]" 1
1149 1 70 TRP H 1 70 TRP HB2 2.902 . 3.955 2.492 2.385 2.582 . 0 0 "[ . 1 .]" 1
1150 1 60 GLY H 1 60 GLY HA2 2.601 . 3.446 2.294 2.282 2.313 . 0 0 "[ . 1 .]" 1
1151 1 104 ASN H 1 104 ASN HB2 3.804 . 5.613 3.120 2.264 3.634 . 0 0 "[ . 1 .]" 1
1152 1 54 ARG QD 1 56 TYR H 4.664 . 7.384 5.047 4.444 5.664 . 0 0 "[ . 1 .]" 1
1153 1 9 ARG H 1 9 ARG QD 4.548 . 7.134 3.830 3.696 4.088 . 0 0 "[ . 1 .]" 1
1154 1 9 ARG QD 1 10 GLN H 5.574 . 7.012 4.356 4.116 4.521 . 0 0 "[ . 1 .]" 1
1155 1 54 ARG H 1 54 ARG QD 4.231 . 6.468 3.850 3.370 4.370 . 0 0 "[ . 1 .]" 1
1156 1 63 ARG H 1 63 ARG QD 5.322 . 8.862 4.271 3.736 4.749 . 0 0 "[ . 1 .]" 1
1157 1 86 ASP QB 1 87 ILE H 4.294 . 6.098 3.579 3.161 3.817 . 0 0 "[ . 1 .]" 1
1158 1 86 ASP H 1 86 ASP QB 2.880 . 3.917 2.400 2.247 2.591 . 0 0 "[ . 1 .]" 1
1159 1 32 ARG QD 1 33 TYR H 3.221 . 4.518 3.249 2.666 3.679 . 0 0 "[ . 1 .]" 1
1160 1 65 LEU H 1 66 PRO HD3 5.279 . 8.763 4.823 4.717 4.915 . 0 0 "[ . 1 .]" 1
1161 1 15 ASP H 1 15 ASP QB 2.600 . 3.445 2.365 2.242 2.491 . 0 0 "[ . 1 .]" 1
1162 1 15 ASP QB 1 16 LEU H 2.986 . 4.101 2.710 2.613 2.808 . 0 0 "[ . 1 .]" 1
1163 1 14 SER H 1 15 ASP QB 4.868 . 7.830 4.726 4.637 4.814 . 0 0 "[ . 1 .]" 1
1164 1 91 GLY H 1 92 PRO HD3 3.921 . 5.843 4.607 4.505 4.916 . 0 0 "[ . 1 .]" 1
1165 1 109 PHE H 1 109 PHE HB3 3.752 . 5.512 3.499 2.542 3.800 . 0 0 "[ . 1 .]" 1
1166 1 24 ASP H 1 24 ASP HB2 2.453 . 3.205 2.452 2.228 2.711 . 0 0 "[ . 1 .]" 1
1167 1 61 TYR HB3 1 62 ILE H 3.877 . 5.756 3.907 3.550 4.140 . 0 0 "[ . 1 .]" 1
1168 1 70 TRP H 1 92 PRO HD3 4.419 . 6.860 6.332 5.702 6.906 0.046 2 0 "[ . 1 .]" 1
1169 1 61 TYR H 1 61 TYR HB3 3.844 . 5.691 3.672 3.601 3.809 . 0 0 "[ . 1 .]" 1
1170 1 52 HIS H 1 52 HIS HB3 3.199 . 4.478 2.642 2.449 2.786 . 0 0 "[ . 1 .]" 1
1171 1 52 HIS HB3 1 53 ALA H 3.541 . 5.108 4.085 3.924 4.208 . 0 0 "[ . 1 .]" 1
1172 1 8 ASP HB2 1 10 GLN H 5.206 . 8.593 5.031 4.898 5.148 . 0 0 "[ . 1 .]" 1
1173 1 33 TYR H 1 33 TYR QB . . 3.256 2.246 2.173 2.357 . 0 0 "[ . 1 .]" 1
1174 1 93 ASP H 1 93 ASP HB2 3.357 . 4.766 3.599 3.374 3.686 . 0 0 "[ . 1 .]" 1
1175 1 73 ASP QB 1 74 TYR H 3.094 . 4.291 3.362 2.826 3.783 . 0 0 "[ . 1 .]" 1
1176 1 73 ASP H 1 73 ASP QB . . 3.167 2.394 2.176 2.648 . 0 0 "[ . 1 .]" 1
1177 1 7 ALA H 1 8 ASP HB2 4.661 . 7.376 4.689 4.585 4.867 . 0 0 "[ . 1 .]" 1
1178 1 56 TYR H 1 56 TYR QB . . 2.850 2.683 2.594 2.768 . 0 0 "[ . 1 .]" 1
1179 1 8 ASP H 1 8 ASP HB2 2.651 . 3.530 2.370 2.280 2.497 . 0 0 "[ . 1 .]" 1
1180 1 6 LYS H 1 8 ASP HB2 4.724 . 7.514 5.175 4.836 5.580 . 0 0 "[ . 1 .]" 1
1181 1 93 ASP HB2 1 95 VAL H 3.727 . 5.463 3.521 3.077 4.500 . 0 0 "[ . 1 .]" 1
1182 1 8 ASP HB2 1 9 ARG H 2.809 . 3.795 2.644 2.442 2.819 . 0 0 "[ . 1 .]" 1
1183 1 55 ASN H 1 55 ASN QB 5.034 . 6.829 3.248 2.965 3.379 . 0 0 "[ . 1 .]" 1
1184 1 88 PHE HB2 1 89 SER H 3.204 . 4.487 2.599 2.401 2.874 . 0 0 "[ . 1 .]" 1
1185 1 55 ASN QB 1 55 ASN QD . . 3.394 2.188 2.086 2.680 . 0 0 "[ . 1 .]" 1
1186 1 82 HIS H 1 82 HIS HB3 4.004 . 6.008 3.725 3.622 3.863 . 0 0 "[ . 1 .]" 1
1187 1 82 HIS HB3 1 83 GLY H 4.320 . 6.653 4.161 3.330 4.505 . 0 0 "[ . 1 .]" 1
1188 1 101 ASP H 1 101 ASP HB2 2.488 . 3.261 2.377 2.207 2.760 . 0 0 "[ . 1 .]" 1
1189 1 24 ASP H 1 24 ASP HB3 3.422 . 4.886 2.936 2.355 3.605 . 0 0 "[ . 1 .]" 1
1190 1 101 ASP HB3 1 102 ILE H 3.125 . 4.345 3.573 2.947 4.018 . 0 0 "[ . 1 .]" 1
1191 1 29 ASP H 1 29 ASP HB3 2.757 . 3.707 2.714 2.333 3.601 . 0 0 "[ . 1 .]" 1
1192 1 30 ASN QB 1 32 ARG H 2.979 . 4.089 3.052 2.770 3.338 . 0 0 "[ . 1 .]" 1
1193 1 79 PRO HB3 1 84 GLN HE22 3.483 . 4.999 3.380 2.637 4.477 . 0 0 "[ . 1 .]" 1
1194 1 79 PRO HB3 1 80 GLY H 3.428 . 4.817 3.600 3.240 3.894 . 0 0 "[ . 1 .]" 1
1195 1 104 ASN H 1 104 ASN HB3 3.027 . 4.172 2.668 2.502 2.946 . 0 0 "[ . 1 .]" 1
1196 1 38 GLN H 1 38 GLN HG3 3.434 . 4.908 2.289 2.000 3.821 . 0 0 "[ . 1 .]" 1
1197 1 81 GLN H 1 82 HIS HB2 5.145 . 8.454 4.683 4.323 5.221 . 0 0 "[ . 1 .]" 1
1198 1 74 TYR H 1 74 TYR HB3 3.456 . 4.949 3.595 3.553 3.646 . 0 0 "[ . 1 .]" 1
1199 1 82 HIS H 1 82 HIS HB2 3.057 . 4.225 2.613 2.483 2.859 . 0 0 "[ . 1 .]" 1
1200 1 87 ILE H 1 104 ASN HB3 4.379 . 6.776 4.030 3.386 4.662 . 0 0 "[ . 1 .]" 1
1201 1 74 TYR HB3 1 75 GLN H 2.552 . 3.366 2.693 2.179 2.998 . 0 0 "[ . 1 .]" 1
1202 1 84 GLN QG 1 85 VAL H 4.289 . 6.588 3.956 3.400 4.423 . 0 0 "[ . 1 .]" 1
1203 1 82 HIS HB2 1 83 GLY H 3.688 . 5.388 3.392 2.227 4.249 . 0 0 "[ . 1 .]" 1
1204 1 10 GLN H 1 10 GLN HG2 3.588 . 5.197 3.103 2.234 3.767 . 0 0 "[ . 1 .]" 1
1205 1 25 MET QB 1 26 TYR H 2.758 . 3.709 2.620 2.469 2.935 . 0 0 "[ . 1 .]" 1
1206 1 25 MET H 1 25 MET QB 2.504 . 3.288 2.376 2.024 2.482 . 0 0 "[ . 1 .]" 1
1207 1 12 VAL HB 1 13 VAL H 2.355 . 3.048 2.511 2.455 2.576 . 0 0 "[ . 1 .]" 1
1208 1 12 VAL HB 1 14 SER H 4.594 . 7.232 4.944 4.876 5.014 . 0 0 "[ . 1 .]" 1
1209 1 12 VAL H 1 12 VAL HB 2.129 . 2.696 2.447 2.331 2.611 . 0 0 "[ . 1 .]" 1
1210 1 47 PRO HB2 1 49 ALA H 2.794 . 3.770 3.243 2.759 3.720 . 0 0 "[ . 1 .]" 1
1211 1 47 PRO HB2 1 53 ALA H 2.883 . 3.922 3.526 3.307 3.676 . 0 0 "[ . 1 .]" 1
1212 1 100 ASP HB2 1 101 ASP H 3.795 . 5.596 4.268 4.022 4.541 . 0 0 "[ . 1 .]" 1
1213 1 100 ASP H 1 100 ASP HB2 2.986 . 4.101 3.254 2.453 3.687 . 0 0 "[ . 1 .]" 1
1214 1 47 PRO HB2 1 48 SER H 4.499 . 7.029 3.789 3.665 3.909 . 0 0 "[ . 1 .]" 1
1215 1 51 PRO QB 1 52 HIS H 4.127 . 5.552 3.188 2.977 3.287 . 0 0 "[ . 1 .]" 1
1216 1 8 ASP H 1 8 ASP HB3 3.595 . 5.211 3.588 3.552 3.613 . 0 0 "[ . 1 .]" 1
1217 1 58 GLU H 1 58 GLU HG3 3.530 . 5.088 2.634 2.115 3.749 . 0 0 "[ . 1 .]" 1
1218 1 23 LEU HB2 1 25 MET H 4.974 . 8.067 5.029 4.823 5.188 . 0 0 "[ . 1 .]" 1
1219 1 8 ASP HB3 1 9 ARG H 3.976 . 5.952 3.439 3.299 3.583 . 0 0 "[ . 1 .]" 1
1220 1 44 VAL H 1 44 VAL HB 2.501 . 3.101 3.003 2.486 3.305 0.204 14 0 "[ . 1 .]" 1
1221 1 22 ALA H 1 23 LEU HB2 4.008 . 6.016 4.606 4.387 4.933 . 0 0 "[ . 1 .]" 1
1222 1 23 LEU H 1 23 LEU HB2 2.002 . 2.503 2.283 2.134 2.586 0.083 11 0 "[ . 1 .]" 1
1223 1 67 GLN HG3 1 68 ASP H 4.087 . 6.175 4.966 4.820 5.061 . 0 0 "[ . 1 .]" 1
1224 1 41 GLN H 1 41 GLN HB2 2.369 . 3.070 2.345 2.222 2.431 . 0 0 "[ . 1 .]" 1
1225 1 67 GLN HE21 1 67 GLN HG3 3.897 . 5.795 3.637 3.470 4.049 . 0 0 "[ . 1 .]" 1
1226 1 84 GLN QB 1 85 VAL H 2.475 . 3.240 2.578 2.376 2.828 . 0 0 "[ . 1 .]" 1
1227 1 41 GLN HB2 1 41 GLN HE21 5.203 . 8.587 5.093 4.826 5.359 . 0 0 "[ . 1 .]" 1
1228 1 43 LEU QB 1 61 TYR H . . 4.301 3.325 2.771 4.178 . 0 0 "[ . 1 .]" 1
1229 1 90 LEU HB2 1 91 GLY H 4.490 . 7.010 2.998 2.666 3.239 . 0 0 "[ . 1 .]" 1
1230 1 90 LEU H 1 90 LEU HB2 3.873 . 5.748 2.416 2.005 2.584 . 0 0 "[ . 1 .]" 1
1231 1 10 GLN HB2 1 11 LYS H 3.871 . 5.744 2.785 2.662 2.883 . 0 0 "[ . 1 .]" 1
1232 1 97 GLU HB3 1 98 SER H 3.292 . 4.646 4.342 3.983 4.532 . 0 0 "[ . 1 .]" 1
1233 1 41 GLN HB3 1 41 GLN HE22 4.577 . 7.196 3.603 1.836 4.464 0.122 15 0 "[ . 1 .]" 1
1234 1 90 LEU HB2 1 94 GLY H 3.826 . 5.656 4.126 3.379 5.083 . 0 0 "[ . 1 .]" 1
1235 1 5 GLU HB3 1 6 LYS H 2.926 . 3.996 2.643 2.508 2.828 . 0 0 "[ . 1 .]" 1
1236 1 13 VAL H 1 13 VAL HB 2.187 . 2.785 2.563 2.466 2.658 . 0 0 "[ . 1 .]" 1
1237 1 13 VAL HB 1 14 SER H 2.358 . 3.053 2.711 2.662 2.767 . 0 0 "[ . 1 .]" 1
1238 1 20 GLU HB3 1 25 MET H 4.900 . 7.901 7.348 6.669 7.836 . 0 0 "[ . 1 .]" 1
1239 1 20 GLU H 1 20 GLU HB3 3.002 . 4.129 2.924 2.535 3.580 . 0 0 "[ . 1 .]" 1
1240 1 37 GLU H 1 37 GLU HB3 2.178 . 2.771 2.656 2.367 3.616 0.845 13 2 "[ -. 1 + .]" 1
1241 1 37 GLU HB3 1 38 GLN H 2.669 . 3.559 2.748 2.476 3.703 0.144 4 0 "[ . 1 .]" 1
1242 1 32 ARG QB 1 33 TYR H . . 3.434 2.563 2.080 2.861 . 0 0 "[ . 1 .]" 1
1243 1 32 ARG H 1 32 ARG QB 3.578 . 5.178 3.176 2.985 3.346 . 0 0 "[ . 1 .]" 1
1244 1 16 LEU H 1 16 LEU QB 2.235 . 2.859 2.167 2.140 2.194 . 0 0 "[ . 1 .]" 1
1245 1 9 ARG QB 1 102 ILE H 4.713 . 7.489 6.319 5.464 6.705 . 0 0 "[ . 1 .]" 1
1246 1 36 THR H 1 37 GLU HB3 4.834 . 7.755 5.402 5.091 6.536 . 0 0 "[ . 1 .]" 1
1247 1 26 TYR H 1 26 TYR HB3 2.580 . 3.412 2.631 2.455 2.993 . 0 0 "[ . 1 .]" 1
1248 1 26 TYR HB3 1 27 LYS H 4.066 . 6.133 2.613 2.501 2.739 . 0 0 "[ . 1 .]" 1
1249 1 9 ARG H 1 9 ARG QB 2.251 . 2.884 2.591 2.506 2.690 . 0 0 "[ . 1 .]" 1
1250 1 11 LYS QB 1 12 VAL H 2.449 . 3.199 2.538 2.378 2.693 . 0 0 "[ . 1 .]" 1
1251 1 58 GLU H 1 58 GLU HB2 2.402 . 3.123 2.509 2.397 2.668 . 0 0 "[ . 1 .]" 1
1252 1 73 ASP H 1 75 GLN QG 4.744 . 7.557 5.336 4.925 6.414 . 0 0 "[ . 1 .]" 1
1253 1 81 GLN HG3 1 82 HIS H 4.040 . 6.080 4.739 3.837 5.255 . 0 0 "[ . 1 .]" 1
1254 1 75 GLN HE22 1 75 GLN QG 2.545 . 3.355 2.155 2.120 2.193 . 0 0 "[ . 1 .]" 1
1255 1 66 PRO QG 1 74 TYR H 3.996 . 5.992 4.221 3.592 4.793 . 0 0 "[ . 1 .]" 1
1256 1 107 ILE H 1 107 ILE HB 3.447 . 4.932 2.764 2.561 2.997 . 0 0 "[ . 1 .]" 1
1257 1 6 LYS QB 1 7 ALA H 2.350 . 3.041 2.550 2.355 2.735 . 0 0 "[ . 1 .]" 1
1258 1 6 LYS H 1 6 LYS QB 2.412 . 3.139 2.420 2.235 2.536 . 0 0 "[ . 1 .]" 1
1259 1 34 PRO HB2 1 38 GLN H 3.002 . 4.128 4.079 3.961 4.150 0.022 11 0 "[ . 1 .]" 1
1260 1 34 PRO HB2 1 35 THR H 2.805 . 3.789 3.076 2.797 3.280 . 0 0 "[ . 1 .]" 1
1261 1 11 LYS QB 1 14 SER H 4.719 . 7.502 4.855 4.690 4.974 . 0 0 "[ . 1 .]" 1
1262 1 63 ARG H 1 63 ARG HB3 2.393 . 3.109 3.171 2.431 3.613 0.504 15 3 "[ * .- 1 +]" 1
1263 1 36 THR H 1 36 THR HG1 4.427 . 6.876 4.120 2.933 4.367 . 0 0 "[ . 1 .]" 1
1264 1 7 ALA H 1 9 ARG QG 4.182 . 6.368 4.283 4.097 4.709 . 0 0 "[ . 1 .]" 1
1265 1 28 LEU H 1 28 LEU HB3 2.013 . 2.520 2.553 2.431 3.130 0.610 9 1 "[ . +1 .]" 1
1266 1 25 MET H 1 28 LEU HB3 4.602 . 7.249 5.257 5.018 5.992 . 0 0 "[ . 1 .]" 1
1267 1 67 GLN H 1 67 GLN HB2 2.585 . 3.420 2.679 2.565 2.747 . 0 0 "[ . 1 .]" 1
1268 1 28 LEU HB3 1 29 ASP H 2.356 . 3.050 2.506 2.345 2.729 . 0 0 "[ . 1 .]" 1
1269 1 67 GLN HB2 1 67 GLN HE21 5.089 . 8.326 4.459 3.658 4.739 . 0 0 "[ . 1 .]" 1
1270 1 15 ASP QB 1 18 ALA H 4.188 . 6.381 4.753 4.615 4.876 . 0 0 "[ . 1 .]" 1
1271 1 40 LEU QB 1 42 ALA H 3.869 . 5.740 4.539 4.441 4.660 . 0 0 "[ . 1 .]" 1
1272 1 76 LEU H 1 76 LEU QB 2.755 . 3.213 2.464 2.379 2.556 . 0 0 "[ . 1 .]" 1
1273 1 40 LEU QB 1 41 GLN H 2.792 . 3.767 2.776 2.635 2.891 . 0 0 "[ . 1 .]" 1
1274 1 68 ASP HB3 1 72 SER H 4.349 . 6.713 4.129 3.443 4.657 . 0 0 "[ . 1 .]" 1
1275 1 40 LEU H 1 40 LEU QB 1.996 . 2.494 2.094 1.979 2.372 . 0 0 "[ . 1 .]" 1
1276 1 28 LEU HB3 1 31 SER H 4.924 . 7.954 5.631 5.469 5.774 . 0 0 "[ . 1 .]" 1
1277 1 57 PRO QB 1 60 GLY H 5.421 . 5.853 3.641 3.347 3.842 . 0 0 "[ . 1 .]" 1
1278 1 54 ARG HB3 1 55 ASN H 4.072 . 6.144 2.651 2.374 3.898 . 0 0 "[ . 1 .]" 1
1279 1 102 ILE H 1 102 ILE HB 2.396 . 3.114 2.550 2.432 2.671 . 0 0 "[ . 1 .]" 1
1280 1 89 SER H 1 102 ILE HB 3.216 . 4.509 3.443 2.815 4.092 . 0 0 "[ . 1 .]" 1
1281 1 102 ILE HB 1 103 GLY H 3.571 . 5.165 4.369 4.303 4.417 . 0 0 "[ . 1 .]" 1
1282 1 53 ALA H 1 53 ALA MB 2.257 . 2.894 2.234 2.220 2.264 . 0 0 "[ . 1 .]" 1
1283 1 69 PRO HB3 1 70 TRP H 3.357 . 4.766 4.277 4.056 4.394 . 0 0 "[ . 1 .]" 1
1284 1 92 PRO HG2 1 93 ASP H 3.824 . 5.652 3.917 2.930 4.187 . 0 0 "[ . 1 .]" 1
1285 1 77 LEU QB 1 86 ASP H 4.650 . 4.926 3.501 2.831 4.009 . 0 0 "[ . 1 .]" 1
1286 1 54 ARG QG 1 55 ASN QD . . 5.241 4.167 2.322 5.596 0.355 8 0 "[ . 1 .]" 1
1287 1 67 GLN HB3 1 67 GLN HE21 4.877 . 7.850 4.481 3.453 4.736 . 0 0 "[ . 1 .]" 1
1288 1 67 GLN HB3 1 71 GLY H 4.104 . 6.209 4.167 3.779 4.557 . 0 0 "[ . 1 .]" 1
1289 1 67 GLN HB3 1 68 ASP H 2.657 . 3.540 2.975 2.796 3.089 . 0 0 "[ . 1 .]" 1
1290 1 67 GLN H 1 67 GLN HB3 3.922 . 5.844 3.787 3.717 3.834 . 0 0 "[ . 1 .]" 1
1291 1 67 GLN HB3 1 72 SER H 3.686 . 5.384 3.759 3.240 4.045 . 0 0 "[ . 1 .]" 1
1292 1 27 LYS HB3 1 31 SER H 5.288 . 8.783 5.464 5.173 5.660 . 0 0 "[ . 1 .]" 1
1293 1 18 ALA H 1 18 ALA MB 1.980 . 2.470 2.242 2.235 2.248 . 0 0 "[ . 1 .]" 1
1294 1 22 ALA MB 1 26 TYR H 3.663 . 5.340 4.450 4.363 4.554 . 0 0 "[ . 1 .]" 1
1295 1 16 LEU H 1 18 ALA MB 4.560 . 7.159 4.591 4.502 4.657 . 0 0 "[ . 1 .]" 1
1296 1 18 ALA MB 1 19 LEU H 2.279 . 2.928 2.554 2.465 2.634 . 0 0 "[ . 1 .]" 1
1297 1 22 ALA H 1 22 ALA MB 1.953 . 2.430 2.217 2.127 2.245 . 0 0 "[ . 1 .]" 1
1298 1 22 ALA MB 1 25 MET H 4.242 . 6.491 4.594 4.372 4.816 . 0 0 "[ . 1 .]" 1
1299 1 22 ALA MB 1 23 LEU H 2.227 . 2.847 2.507 2.402 2.598 . 0 0 "[ . 1 .]" 1
1300 1 6 LYS H 1 7 ALA MB 3.935 . 5.870 4.365 4.215 4.500 . 0 0 "[ . 1 .]" 1
1301 1 32 ARG H 1 32 ARG HG3 2.615 . 3.470 2.473 1.840 2.817 . 0 0 "[ . 1 .]" 1
1302 1 7 ALA H 1 7 ALA MB 2.015 . 2.523 2.240 2.222 2.261 . 0 0 "[ . 1 .]" 1
1303 1 7 ALA MB 1 8 ASP H 2.348 . 3.037 2.535 2.436 2.663 . 0 0 "[ . 1 .]" 1
1304 1 87 ILE H 1 87 ILE HG13 2.619 . 3.476 2.661 2.554 2.796 . 0 0 "[ . 1 .]" 1
1305 1 7 ALA MB 1 10 GLN H 4.288 . 6.587 4.715 4.525 4.896 . 0 0 "[ . 1 .]" 1
1306 1 32 ARG HG3 1 33 TYR H 4.593 . 7.230 4.356 3.919 4.765 . 0 0 "[ . 1 .]" 1
1307 1 85 VAL HB 1 86 ASP H 2.835 . 3.840 3.079 2.672 3.414 . 0 0 "[ . 1 .]" 1
1308 1 7 ALA MB 1 9 ARG H 4.447 . 6.919 4.634 4.542 4.736 . 0 0 "[ . 1 .]" 1
1309 1 85 VAL H 1 85 VAL HB 3.311 . 4.681 3.779 3.612 3.870 . 0 0 "[ . 1 .]" 1
1310 1 75 GLN HB3 1 76 LEU H 3.004 . 4.132 2.989 2.702 3.136 . 0 0 "[ . 1 .]" 1
1311 1 92 PRO HB2 1 93 ASP H 3.114 . 4.326 3.159 2.857 3.723 . 0 0 "[ . 1 .]" 1
1312 1 42 ALA MB 1 43 LEU H 2.800 . 3.780 2.893 2.766 3.007 . 0 0 "[ . 1 .]" 1
1313 1 42 ALA MB 1 45 SER H 4.814 . 5.950 5.249 4.774 5.451 . 0 0 "[ . 1 .]" 1
1314 1 42 ALA H 1 42 ALA MB 2.069 . 2.604 2.226 2.219 2.237 . 0 0 "[ . 1 .]" 1
1315 1 75 GLN H 1 75 GLN HB3 3.923 . 5.847 3.762 3.628 3.881 . 0 0 "[ . 1 .]" 1
1316 1 57 PRO QB 1 58 GLU H 3.564 . 5.152 3.141 3.054 3.194 . 0 0 "[ . 1 .]" 1
1317 1 32 ARG HG2 1 33 TYR H 4.984 . 8.088 4.935 4.549 5.217 . 0 0 "[ . 1 .]" 1
1318 1 38 GLN H 1 49 ALA MB 4.077 . 6.155 4.534 4.217 5.086 . 0 0 "[ . 1 .]" 1
1319 1 12 VAL QG 1 70 TRP H 4.497 . 7.025 4.386 4.026 4.716 . 0 0 "[ . 1 .]" 1
1320 1 49 ALA MB 1 50 GLU H 2.750 . 3.695 2.913 2.700 3.135 . 0 0 "[ . 1 .]" 1
1321 1 103 GLY QA 1 105 TRP H 4.732 . 7.531 3.285 3.116 3.495 . 0 0 "[ . 1 .]" 1
1322 1 12 VAL QG 1 15 ASP H 4.344 . 6.703 4.434 4.298 4.571 . 0 0 "[ . 1 .]" 1
1323 1 8 ASP H 1 69 PRO HG3 4.895 . 7.890 6.078 5.107 7.111 . 0 0 "[ . 1 .]" 1
1324 1 12 VAL QG 1 89 SER H 3.848 . 5.699 3.997 3.591 4.357 . 0 0 "[ . 1 .]" 1
1325 1 12 VAL QG 1 102 ILE H 3.854 . 5.711 3.969 3.453 4.272 . 0 0 "[ . 1 .]" 1
1326 1 40 LEU H 1 76 LEU QB 3.192 . 4.466 3.379 3.009 3.764 . 0 0 "[ . 1 .]" 1
1327 1 92 PRO HG3 1 93 ASP H 4.703 . 7.467 4.510 4.261 4.615 . 0 0 "[ . 1 .]" 1
1328 1 12 VAL QG 1 14 SER H 4.703 . 7.468 4.513 4.437 4.584 . 0 0 "[ . 1 .]" 1
1329 1 12 VAL QG 1 91 GLY H 4.611 . 7.269 4.466 4.003 4.844 . 0 0 "[ . 1 .]" 1
1330 1 62 ILE HG12 1 63 ARG H 3.596 . 5.213 2.792 2.505 3.117 . 0 0 "[ . 1 .]" 1
1331 1 62 ILE H 1 62 ILE HG12 3.854 . 5.710 4.437 4.338 4.528 . 0 0 "[ . 1 .]" 1
1332 1 62 ILE HG12 1 64 ARG H 2.491 . 3.266 1.900 1.707 2.023 0.009 15 0 "[ . 1 .]" 1
1333 1 77 LEU MD2 1 78 SER H 3.172 . 4.113 2.636 2.460 2.878 . 0 0 "[ . 1 .]" 1
1334 1 90 LEU HB3 1 94 GLY H 4.285 . 6.580 3.323 2.825 3.707 . 0 0 "[ . 1 .]" 1
1335 1 77 LEU MD1 1 80 GLY H 4.722 . 7.510 4.379 3.873 5.612 . 0 0 "[ . 1 .]" 1
1336 1 12 VAL H 1 13 VAL QG 4.662 . 7.379 4.049 3.919 4.187 . 0 0 "[ . 1 .]" 1
1337 1 10 GLN H 1 13 VAL QG 5.246 . 8.686 4.167 3.907 4.394 . 0 0 "[ . 1 .]" 1
1338 1 27 LYS HG2 1 31 SER H 4.154 . 6.311 4.377 4.020 4.601 . 0 0 "[ . 1 .]" 1
1339 1 27 LYS HG2 1 32 ARG H 3.111 . 4.320 4.109 3.409 5.039 0.719 9 2 "[ . +1 - .]" 1
1340 1 17 VAL QG 1 18 ALA H 3.147 . 4.385 2.478 2.162 3.286 . 0 0 "[ . 1 .]" 1
1341 1 17 VAL H 1 17 VAL QG 1.769 . 2.160 1.966 1.930 2.149 . 0 0 "[ . 1 .]" 1
1342 1 44 VAL H 1 44 VAL QG 2.349 . 2.801 2.235 1.996 2.626 . 0 0 "[ . 1 .]" 1
1343 1 27 LYS HG2 1 33 TYR H 4.302 . 6.616 5.467 5.012 6.032 . 0 0 "[ . 1 .]" 1
1344 1 28 LEU QD 1 29 ASP H 4.035 . 6.070 3.790 3.040 3.969 . 0 0 "[ . 1 .]" 1
1345 1 44 VAL QG 1 45 SER H 2.727 . 3.657 2.299 1.833 3.013 . 0 0 "[ . 1 .]" 1
1346 1 22 ALA H 1 43 LEU QD 2.957 . 4.050 3.508 2.505 4.003 . 0 0 "[ . 1 .]" 1
1347 1 13 VAL QG 1 15 ASP H 4.648 . 7.348 4.756 4.718 4.810 . 0 0 "[ . 1 .]" 1
1348 1 13 VAL QG 1 14 SER H 3.505 . 5.041 3.260 3.200 3.311 . 0 0 "[ . 1 .]" 1
1349 1 90 LEU H 1 90 LEU QD 3.503 . 5.037 2.176 1.827 2.956 0.142 6 0 "[ . 1 .]" 1
1350 1 73 ASP H 1 90 LEU QD 4.542 . 7.120 3.170 2.487 3.933 . 0 0 "[ . 1 .]" 1
1351 1 75 GLN HE22 1 90 LEU QD 2.971 . 4.074 2.676 2.157 3.346 . 0 0 "[ . 1 .]" 1
1352 1 41 GLN HE22 1 44 VAL QG 3.410 . 4.864 3.749 2.643 4.502 . 0 0 "[ . 1 .]" 1
1353 1 90 LEU QD 1 91 GLY H 4.882 . 7.862 3.791 3.515 4.217 . 0 0 "[ . 1 .]" 1
1354 1 90 LEU QD 1 94 GLY H 4.181 . 6.366 4.593 4.320 4.845 . 0 0 "[ . 1 .]" 1
1355 1 40 LEU QD 1 75 GLN H 3.370 . 4.790 3.618 3.461 3.825 . 0 0 "[ . 1 .]" 1
1356 1 90 LEU QD 1 93 ASP H 4.576 . 7.193 6.003 5.770 6.175 . 0 0 "[ . 1 .]" 1
1357 1 90 LEU QD 1 98 SER H 4.633 . 7.316 4.991 4.520 5.382 . 0 0 "[ . 1 .]" 1
1358 1 65 LEU QD 1 67 GLN HE21 5.248 . 8.691 5.562 2.918 7.165 . 0 0 "[ . 1 .]" 1
1359 1 107 ILE H 1 107 ILE MG 3.054 . 4.220 1.973 1.897 2.136 . 0 0 "[ . 1 .]" 1
1360 1 90 LEU QD 1 100 ASP H 4.941 . 7.993 7.420 6.735 7.645 . 0 0 "[ . 1 .]" 1
1361 1 40 LEU H 1 40 LEU QD 2.318 . 2.990 2.702 1.980 3.029 0.039 8 0 "[ . 1 .]" 1
1362 1 40 LEU QD 1 76 LEU H 3.021 . 4.162 2.577 1.882 3.070 . 0 0 "[ . 1 .]" 1
1363 1 105 TRP H 1 107 ILE MG 4.019 . 6.038 4.310 4.137 4.806 . 0 0 "[ . 1 .]" 1
1364 1 46 ALA MB 1 53 ALA H 3.619 . 5.256 3.574 3.213 3.944 . 0 0 "[ . 1 .]" 1
1365 1 20 GLU H 1 87 ILE MD 2.566 . 3.389 2.787 2.588 3.157 . 0 0 "[ . 1 .]" 1
1366 1 102 ILE H 1 102 ILE MG 3.921 . 5.843 3.792 3.756 3.839 . 0 0 "[ . 1 .]" 1
1367 1 12 VAL H 1 102 ILE MG 4.691 . 7.441 5.029 4.593 5.487 . 0 0 "[ . 1 .]" 1
1368 1 89 SER H 1 102 ILE MG 4.172 . 6.348 4.205 3.767 4.768 . 0 0 "[ . 1 .]" 1
1369 1 76 LEU QD 1 85 VAL H 4.632 . 6.383 4.692 4.444 4.904 . 0 0 "[ . 1 .]" 1
1370 1 102 ILE MG 1 103 GLY H 2.386 . 3.097 3.134 2.874 3.234 0.137 4 0 "[ . 1 .]" 1
1371 1 76 LEU QD 1 86 ASP H 3.214 . 4.506 2.646 2.342 2.959 . 0 0 "[ . 1 .]" 1
1372 1 46 ALA MB 1 56 TYR H 4.674 . 7.405 4.530 4.213 4.855 . 0 0 "[ . 1 .]" 1
1373 1 23 LEU H 1 23 LEU QD 2.155 . 2.735 2.400 2.226 2.719 . 0 0 "[ . 1 .]" 1
1374 1 62 ILE MG 1 64 ARG H 2.921 . 3.987 3.355 3.045 3.663 . 0 0 "[ . 1 .]" 1
1375 1 23 LEU QD 1 26 TYR H 3.800 . 5.605 4.824 4.692 4.947 . 0 0 "[ . 1 .]" 1
1376 1 23 LEU QD 1 25 MET H 4.797 . 7.673 5.207 5.100 5.334 . 0 0 "[ . 1 .]" 1
1377 1 23 LEU QD 1 24 ASP H 3.870 . 5.742 3.906 3.852 3.995 . 0 0 "[ . 1 .]" 1
1378 1 61 TYR H 1 62 ILE MG 3.724 . 5.457 3.479 3.102 3.773 . 0 0 "[ . 1 .]" 1
1379 1 27 LYS HD2 1 32 ARG H 5.099 . 8.350 5.480 4.936 6.374 . 0 0 "[ . 1 .]" 1
1380 1 57 PRO HG3 1 58 GLU H 5.744 . 9.868 5.551 5.484 5.587 . 0 0 "[ . 1 .]" 1
1381 1 16 LEU QD 1 75 GLN H 4.706 . 7.475 5.119 4.297 5.840 . 0 0 "[ . 1 .]" 1
1382 1 15 ASP H 1 16 LEU QD 5.457 . 9.179 5.294 5.220 5.357 . 0 0 "[ . 1 .]" 1
1383 1 16 LEU QD 1 104 ASN H 3.051 . 4.214 2.586 2.188 3.064 . 0 0 "[ . 1 .]" 1
1384 1 16 LEU H 1 16 LEU QD 3.368 . 4.786 3.594 3.550 3.650 . 0 0 "[ . 1 .]" 1
1385 1 16 LEU QD 1 17 VAL H 3.944 . 5.888 3.899 3.797 4.015 . 0 0 "[ . 1 .]" 1
1386 1 36 THR H 1 76 LEU QD 3.962 . 5.924 3.396 3.156 3.820 . 0 0 "[ . 1 .]" 1
1387 1 40 LEU H 1 76 LEU QD 3.189 . 4.460 3.703 2.658 4.315 . 0 0 "[ . 1 .]" 1
1388 1 16 LEU QD 1 89 SER H 3.423 . 4.888 3.809 3.242 4.292 . 0 0 "[ . 1 .]" 1
1389 1 16 LEU QD 1 103 GLY H 4.007 . 6.014 3.997 3.760 4.417 . 0 0 "[ . 1 .]" 1
1390 1 38 GLN H 1 76 LEU QD 4.394 . 6.807 4.334 3.953 4.560 . 0 0 "[ . 1 .]" 1
1391 1 16 LEU QD 1 88 PHE H 3.892 . 5.786 3.858 3.364 4.328 . 0 0 "[ . 1 .]" 1
1392 1 41 GLN H 1 76 LEU QD 4.821 . 7.726 5.560 4.769 6.150 . 0 0 "[ . 1 .]" 1
1393 1 57 PRO HG2 1 60 GLY H 3.655 . 5.325 3.441 3.264 3.581 . 0 0 "[ . 1 .]" 1
1394 1 27 LYS HG3 1 28 LEU H 4.278 . 6.566 4.871 4.758 5.003 . 0 0 "[ . 1 .]" 1
1395 1 16 LEU QD 1 87 ILE H 4.617 . 7.093 4.178 4.079 4.302 . 0 0 "[ . 1 .]" 1
1396 1 27 LYS H 1 27 LYS HG3 4.729 . 7.524 4.485 4.451 4.511 . 0 0 "[ . 1 .]" 1
1397 1 27 LYS HG3 1 31 SER H 4.251 . 6.509 4.578 4.324 4.903 . 0 0 "[ . 1 .]" 1
1398 1 27 LYS HG3 1 32 ARG H 3.887 . 5.776 3.182 2.729 4.058 . 0 0 "[ . 1 .]" 1
1399 1 19 LEU QD 1 20 GLU H 4.594 . 7.232 3.949 3.830 4.035 . 0 0 "[ . 1 .]" 1
1400 1 80 GLY H 1 85 VAL QG 4.320 . 6.652 3.621 3.379 4.033 . 0 0 "[ . 1 .]" 1
1401 1 70 TRP HA 1 70 TRP HE1 5.320 . 8.857 4.940 4.854 5.002 . 0 0 "[ . 1 .]" 1
1402 1 8 ASP HB3 1 70 TRP HE1 4.348 . 6.712 3.992 3.078 4.931 . 0 0 "[ . 1 .]" 1
1403 1 70 TRP HE1 1 92 PRO HB3 3.612 . 5.243 3.759 2.955 4.804 . 0 0 "[ . 1 .]" 1
1404 1 70 TRP HE1 1 92 PRO HA 4.202 . 6.409 4.906 3.918 5.956 . 0 0 "[ . 1 .]" 1
1405 1 70 TRP HE1 1 92 PRO HG3 3.338 . 4.730 3.167 2.572 4.174 . 0 0 "[ . 1 .]" 1
1406 1 105 TRP HA 1 105 TRP HE1 3.624 . 5.266 5.139 4.832 5.353 0.087 14 0 "[ . 1 .]" 1
1407 1 82 HIS HA 1 105 TRP HE1 5.143 . 8.449 5.973 4.810 7.735 . 0 0 "[ . 1 .]" 1
1408 1 105 TRP HB3 1 105 TRP HE1 5.080 . 8.306 5.098 4.772 5.270 . 0 0 "[ . 1 .]" 1
1409 1 77 LEU H 1 82 HIS H 5.552 . 9.405 7.299 6.913 7.700 . 0 0 "[ . 1 .]" 1
1410 1 76 LEU HA 1 77 LEU H 2.183 . 2.779 2.190 2.132 2.241 . 0 0 "[ . 1 .]" 1
1411 1 77 LEU H 1 77 LEU HA 2.983 . 4.095 2.941 2.926 2.948 . 0 0 "[ . 1 .]" 1
1412 1 77 LEU H 1 86 ASP QB 3.524 . 5.076 3.248 2.838 3.769 . 0 0 "[ . 1 .]" 1
1413 1 77 LEU H 1 77 LEU QB 2.885 . 3.925 2.492 2.305 2.620 . 0 0 "[ . 1 .]" 1
1414 1 21 GLY H 1 22 ALA HA 5.207 . 8.596 5.331 5.293 5.383 . 0 0 "[ . 1 .]" 1
1415 1 18 ALA HA 1 21 GLY H 3.239 . 4.550 3.362 3.062 3.588 . 0 0 "[ . 1 .]" 1
1416 1 21 GLY H 1 21 GLY QA 2.549 . 3.361 2.196 2.182 2.201 . 0 0 "[ . 1 .]" 1
1417 1 20 GLU H 1 21 GLY H 2.658 . 3.541 2.664 2.504 2.786 . 0 0 "[ . 1 .]" 1
1418 1 17 VAL H 1 21 GLY H 4.545 . 7.127 5.926 5.678 6.134 . 0 0 "[ . 1 .]" 1
1419 1 20 GLU HB3 1 21 GLY H 3.194 . 4.469 2.897 2.531 3.594 . 0 0 "[ . 1 .]" 1
1420 1 21 GLY H 1 43 LEU QD 3.913 . 5.827 4.756 3.942 5.229 . 0 0 "[ . 1 .]" 1
1421 1 46 ALA H 1 56 TYR QD 4.231 . 6.468 3.697 3.143 4.153 . 0 0 "[ . 1 .]" 1
1422 1 80 GLY H 1 84 GLN HA 3.131 . 4.356 3.254 2.641 3.576 . 0 0 "[ . 1 .]" 1
1423 1 77 LEU MD1 1 83 GLY H 5.506 . 9.295 6.459 6.117 6.801 . 0 0 "[ . 1 .]" 1
1424 1 70 TRP H 1 71 GLY H 2.531 . 3.332 2.402 2.342 2.500 . 0 0 "[ . 1 .]" 1
1425 1 34 PRO HB2 1 39 GLY H 2.680 . 3.578 2.649 2.415 2.885 . 0 0 "[ . 1 .]" 1
1426 1 37 GLU HB3 1 39 GLY H 4.414 . 6.849 5.051 4.821 5.647 . 0 0 "[ . 1 .]" 1
1427 1 39 GLY H 1 39 GLY HA2 2.761 . 3.714 2.820 2.784 2.869 . 0 0 "[ . 1 .]" 1
1428 1 36 THR HB 1 39 GLY H 4.394 . 6.808 6.039 5.751 6.287 . 0 0 "[ . 1 .]" 1
1429 1 39 GLY H 1 39 GLY HA3 2.423 . 3.157 2.297 2.292 2.312 . 0 0 "[ . 1 .]" 1
1430 1 35 THR H 1 39 GLY H 4.452 . 5.843 4.090 3.744 4.320 . 0 0 "[ . 1 .]" 1
1431 1 30 ASN H 1 32 ARG H 3.581 . 5.184 3.776 3.593 4.368 . 0 0 "[ . 1 .]" 1
1432 1 34 PRO HA 1 38 GLN H 5.229 . 8.646 5.279 4.980 5.491 . 0 0 "[ . 1 .]" 1
1433 1 36 THR H 1 78 SER H 2.841 . 3.850 3.546 3.205 3.900 0.050 5 0 "[ . 1 .]" 1
1434 1 69 PRO HG3 1 70 TRP H 4.751 . 7.572 4.536 4.226 4.783 . 0 0 "[ . 1 .]" 1
1435 1 46 ALA H 1 56 TYR H 5.499 . 9.279 7.052 6.505 7.625 . 0 0 "[ . 1 .]" 1
1436 1 44 VAL QG 1 46 ALA H 4.979 . 8.078 5.148 4.876 5.523 . 0 0 "[ . 1 .]" 1
1437 1 87 ILE HG13 1 104 ASN H 3.004 . 4.132 2.767 2.273 3.369 . 0 0 "[ . 1 .]" 1
1438 1 58 GLU H 1 58 GLU HA 2.910 . 3.969 2.825 2.816 2.831 . 0 0 "[ . 1 .]" 1
1439 1 46 ALA H 1 46 ALA HA 2.826 . 3.824 2.790 2.767 2.871 . 0 0 "[ . 1 .]" 1
1440 1 45 SER HB3 1 46 ALA H 3.215 . 4.507 3.739 2.953 4.147 . 0 0 "[ . 1 .]" 1
1441 1 45 SER HA 1 46 ALA H 2.249 . 2.866 2.231 2.153 2.402 . 0 0 "[ . 1 .]" 1
1442 1 32 ARG H 1 33 TYR H 4.485 . 6.999 4.355 4.225 4.498 . 0 0 "[ . 1 .]" 1
1443 1 27 LYS HD2 1 33 TYR H 3.665 . 5.344 4.173 3.531 4.979 . 0 0 "[ . 1 .]" 1
1444 1 97 GLU H 1 97 GLU QG 3.639 . 4.028 3.216 2.750 4.519 0.491 5 0 "[ . 1 .]" 1
1445 1 74 TYR H 1 89 SER HA 4.312 . 6.636 5.335 4.935 5.976 . 0 0 "[ . 1 .]" 1
1446 1 74 TYR H 1 75 GLN QG 4.333 . 6.679 5.193 4.893 5.824 . 0 0 "[ . 1 .]" 1
1447 1 76 LEU HA 1 88 PHE H 4.245 . 6.498 3.854 3.464 4.231 . 0 0 "[ . 1 .]" 1
1448 1 7 ALA HA 1 8 ASP H 3.715 . 5.440 3.539 3.527 3.558 . 0 0 "[ . 1 .]" 1
1449 1 13 VAL QG 1 16 LEU H 4.432 . 6.888 4.250 4.191 4.313 . 0 0 "[ . 1 .]" 1
1450 1 17 VAL HB 1 20 GLU H 4.322 . 6.656 5.273 5.024 5.710 . 0 0 "[ . 1 .]" 1
1451 1 15 ASP H 1 17 VAL QG 4.140 . 6.282 4.327 4.113 4.986 . 0 0 "[ . 1 .]" 1
1452 1 20 GLU HA 1 23 LEU H 2.732 . 3.665 3.356 3.150 3.710 0.045 2 0 "[ . 1 .]" 1
1453 1 20 GLU H 1 21 GLY QA 4.244 . 6.496 4.527 4.378 4.635 . 0 0 "[ . 1 .]" 1
1454 1 43 LEU QD 1 61 TYR H 3.604 . 5.228 3.989 3.083 4.469 . 0 0 "[ . 1 .]" 1
1455 1 75 GLN H 1 87 ILE MG 3.680 . 5.373 4.987 4.726 5.242 . 0 0 "[ . 1 .]" 1
1456 1 48 SER HA 1 49 ALA H 2.950 . 4.038 3.327 2.716 3.481 . 0 0 "[ . 1 .]" 1
1457 1 38 GLN HG3 1 39 GLY H 4.259 . 6.526 4.362 3.983 5.169 . 0 0 "[ . 1 .]" 1
1458 1 27 LYS HA 1 33 TYR H 3.711 . 5.433 4.659 4.247 5.071 . 0 0 "[ . 1 .]" 1
1459 1 76 LEU QD 1 87 ILE H 3.664 . 5.342 3.633 3.503 3.891 . 0 0 "[ . 1 .]" 1
1460 1 43 LEU H 1 62 ILE MG 3.883 . 4.607 4.552 4.388 4.788 0.181 12 0 "[ . 1 .]" 1
1461 1 29 ASP HB3 1 30 ASN H 4.058 . 6.116 2.796 2.539 3.529 . 0 0 "[ . 1 .]" 1
1462 1 27 LYS HB3 1 28 LEU H 3.504 . 5.039 2.811 2.725 2.856 . 0 0 "[ . 1 .]" 1
1463 1 28 LEU H 1 28 LEU HA 2.584 . 3.418 2.816 2.792 2.836 . 0 0 "[ . 1 .]" 1
1464 1 5 GLU HA 1 7 ALA H 3.361 . 4.773 4.416 4.225 4.692 . 0 0 "[ . 1 .]" 1
1465 1 9 ARG HA 1 10 GLN H 2.668 . 3.419 3.528 3.515 3.543 0.124 5 0 "[ . 1 .]" 1
1466 1 9 ARG QG 1 10 GLN H 3.157 . 4.403 2.353 2.200 2.460 . 0 0 "[ . 1 .]" 1
1467 1 44 VAL HA 1 45 SER H 2.756 . 3.705 3.544 3.441 3.574 . 0 0 "[ . 1 .]" 1
1468 1 21 GLY QA 1 22 ALA H 3.300 . 3.489 2.671 2.617 2.730 . 0 0 "[ . 1 .]" 1
1469 1 79 PRO HB3 1 83 GLY H 5.131 . 8.422 7.423 6.249 8.555 0.133 5 0 "[ . 1 .]" 1
1470 1 24 ASP HB3 1 25 MET H 4.003 . 6.006 2.941 2.498 3.541 . 0 0 "[ . 1 .]" 1
1471 1 29 ASP HA 1 30 ASN QD 4.600 . 7.245 4.833 4.594 6.197 . 0 0 "[ . 1 .]" 1
1472 1 41 GLN HA 1 42 ALA H 3.351 . 4.755 3.439 3.417 3.476 . 0 0 "[ . 1 .]" 1
1473 1 28 LEU HA 1 29 ASP H 3.517 . 5.063 3.538 3.496 3.565 . 0 0 "[ . 1 .]" 1
1474 1 105 TRP H 1 106 THR HB 4.237 . 6.481 5.111 4.654 6.127 . 0 0 "[ . 1 .]" 1
1475 1 107 ILE MG 1 109 PHE QE 3.195 . 4.471 2.962 2.445 3.531 . 0 0 "[ . 1 .]" 1
1476 1 13 VAL QG 1 109 PHE HZ 3.688 . 5.388 3.922 2.171 5.406 0.018 15 0 "[ . 1 .]" 1
1477 1 13 VAL QG 1 109 PHE QE 3.978 . 5.956 2.719 2.131 4.500 . 0 0 "[ . 1 .]" 1
1478 1 92 PRO HD2 1 101 ASP H 5.053 . 8.245 6.398 5.388 7.353 . 0 0 "[ . 1 .]" 1
1479 1 56 TYR QD 1 60 GLY HA3 5.438 . 9.135 5.500 4.958 6.402 . 0 0 "[ . 1 .]" 1
1480 1 22 ALA MB 1 26 TYR QD 4.193 . 6.390 5.207 3.932 5.915 . 0 0 "[ . 1 .]" 1
1481 1 56 TYR QD 1 60 GLY HA2 4.624 . 7.297 4.340 3.668 5.128 . 0 0 "[ . 1 .]" 1
1482 1 23 LEU QD 1 33 TYR HD1 3.940 . 5.881 4.401 2.990 6.567 0.686 10 1 "[ . + .]" 1
1483 1 88 PHE QD 1 103 GLY QA 4.697 . 7.454 4.178 3.781 4.448 . 0 0 "[ . 1 .]" 1
1484 1 70 TRP HZ3 1 102 ILE MG 4.453 . 6.932 5.032 3.970 6.098 . 0 0 "[ . 1 .]" 1
1485 1 67 GLN HA 1 74 TYR QD 4.032 . 6.064 2.816 2.176 3.590 . 0 0 "[ . 1 .]" 1
1486 1 68 ASP HA 1 74 TYR QD 4.956 . 8.026 4.918 4.569 5.688 . 0 0 "[ . 1 .]" 1
1487 1 27 LYS HB3 1 33 TYR QE 4.519 . 7.072 4.222 3.790 4.946 . 0 0 "[ . 1 .]" 1
1488 1 23 LEU QD 1 33 TYR QE 5.290 . 8.788 3.753 3.268 4.570 . 0 0 "[ . 1 .]" 1
1489 1 26 TYR QE 1 32 ARG QB 5.262 . 8.723 4.851 4.207 5.929 . 0 0 "[ . 1 .]" 1
1490 1 29 ASP HB3 1 30 ASN QD 4.252 . 6.512 2.770 2.253 3.990 . 0 0 "[ . 1 .]" 1
1491 1 102 ILE HA 1 103 GLY QA 4.290 . 6.590 3.922 3.877 3.938 . 0 0 "[ . 1 .]" 1
1492 1 103 GLY QA 1 107 ILE HA 4.054 . 6.109 6.824 6.404 7.421 1.312 15 9 "[***-* *1 * *+]" 1
1493 1 72 SER HA 1 90 LEU HB3 4.865 . 7.824 5.826 4.544 6.956 . 0 0 "[ . 1 .]" 1
1494 1 103 GLY QA 1 107 ILE MG 3.777 . 5.560 4.447 4.183 4.711 . 0 0 "[ . 1 .]" 1
1495 1 42 ALA HA 1 49 ALA MB 4.397 . 6.813 8.026 7.698 8.398 1.585 9 15 [*******-+******] 1
1496 1 24 ASP HA 1 27 LYS HA 4.087 . 6.175 5.534 5.035 5.904 . 0 0 "[ . 1 .]" 1
1497 1 27 LYS HB3 1 33 TYR HA 3.240 . 4.552 4.537 4.094 4.961 0.409 9 0 "[ . 1 .]" 1
1498 1 24 ASP HA 1 27 LYS HD3 4.344 . 6.703 4.014 3.533 4.567 . 0 0 "[ . 1 .]" 1
1499 1 23 LEU QD 1 43 LEU HA 4.368 . 6.753 6.541 6.182 7.084 0.331 14 0 "[ . 1 .]" 1
1500 1 31 SER QB 1 33 TYR HA 4.496 . 7.023 7.613 7.179 7.896 0.873 2 11 "[*+**** * ** * -]" 1
1501 1 41 GLN HA 1 65 LEU HA 4.159 . 6.321 5.451 4.874 6.048 . 0 0 "[ . 1 .]" 1
1502 1 89 SER HA 1 101 ASP HA 4.415 . 6.851 5.469 5.039 6.002 . 0 0 "[ . 1 .]" 1
1503 1 54 ARG QD 1 56 TYR HA 4.381 . 6.780 7.258 6.898 7.663 0.883 4 7 "[* *+. - *1** .]" 1
1504 1 65 LEU HA 1 66 PRO QG 4.464 . 6.955 3.816 3.760 3.857 . 0 0 "[ . 1 .]" 1
1505 1 40 LEU QD 1 89 SER HA 3.063 . 4.236 5.961 5.689 6.385 2.149 10 15 [*******-*+*****] 1
1506 1 19 LEU QD 1 65 LEU HA 4.186 . 6.376 5.279 4.899 5.823 . 0 0 "[ . 1 .]" 1
1507 1 22 ALA HA 1 33 TYR HA 4.810 . 7.703 9.099 8.597 9.537 1.834 9 15 [********+***-**] 1
1508 1 89 SER HA 1 102 ILE HB 4.422 . 6.866 5.143 4.749 5.605 . 0 0 "[ . 1 .]" 1
1509 1 76 LEU QD 1 85 VAL HA . . 4.174 3.262 2.894 3.417 . 0 0 "[ . 1 .]" 1
1510 1 61 TYR HB2 1 62 ILE HA 4.111 . 6.223 4.929 4.676 5.180 . 0 0 "[ . 1 .]" 1
1511 1 85 VAL QG 1 86 ASP HA 2.985 . 4.099 4.100 3.808 4.428 0.329 10 0 "[ . 1 .]" 1
1512 1 74 TYR HA 1 102 ILE MG 4.920 . 7.946 7.785 7.197 8.116 0.170 13 0 "[ . 1 .]" 1
1513 1 75 GLN HA 1 76 LEU QD 3.979 . 5.958 5.141 5.076 5.290 . 0 0 "[ . 1 .]" 1
1514 1 86 ASP HA 1 87 ILE MG 4.474 . 6.976 4.170 4.027 4.374 . 0 0 "[ . 1 .]" 1
1515 1 5 GLU HA 1 6 LYS HA 3.504 . 5.038 4.790 4.724 4.876 . 0 0 "[ . 1 .]" 1
1516 1 80 GLY QA 1 82 HIS HA 4.389 . 6.797 5.531 5.248 5.716 . 0 0 "[ . 1 .]" 1
1517 1 12 VAL HA 1 69 PRO HA 5.121 . 8.400 7.095 6.762 7.394 . 0 0 "[ . 1 .]" 1
1518 1 11 LYS QG 1 12 VAL HA 4.163 . 6.329 4.502 3.146 5.798 . 0 0 "[ . 1 .]" 1
1519 1 8 ASP HA 1 10 GLN HA 3.554 . 5.133 6.633 6.447 6.813 1.680 13 15 [************+-*] 1
1520 1 45 SER HA 1 63 ARG HA 4.537 . 7.110 7.048 5.911 7.854 0.744 4 1 "[ +. 1 .]" 1
1521 1 18 ALA HA 1 18 ALA MB 1.908 . 2.363 2.130 2.127 2.133 . 0 0 "[ . 1 .]" 1
1522 1 36 THR HA 1 37 GLU HA 3.306 . 4.672 4.700 4.659 4.731 0.059 10 0 "[ . 1 .]" 1
1523 1 14 SER HB3 1 15 ASP HA 3.749 . 5.506 4.400 4.268 4.560 . 0 0 "[ . 1 .]" 1
1524 1 11 LYS QB 1 14 SER HB3 3.852 . 5.707 5.042 4.107 6.140 0.433 5 0 "[ . 1 .]" 1
1525 1 13 VAL HA 1 14 SER HB3 4.408 . 6.837 6.155 5.789 6.631 . 0 0 "[ . 1 .]" 1
1526 1 9 ARG HA 1 12 VAL HA 4.498 . 7.027 4.837 4.681 5.017 . 0 0 "[ . 1 .]" 1
1527 1 25 MET HA 1 28 LEU HA 4.193 . 6.390 5.151 4.716 5.449 . 0 0 "[ . 1 .]" 1
1528 1 9 ARG HA 1 13 VAL QG 2.796 . 3.773 4.052 3.849 4.241 0.468 14 0 "[ . 1 .]" 1
1529 1 38 GLN HA 1 41 GLN HB2 2.559 . 3.377 2.710 2.402 3.333 . 0 0 "[ . 1 .]" 1
1530 1 10 GLN HA 1 13 VAL QG . . 2.552 2.599 2.286 2.924 0.372 3 0 "[ . 1 .]" 1
1531 1 106 THR HB 1 108 GLY QA 4.415 . 6.852 6.401 5.945 7.310 0.458 3 0 "[ . 1 .]" 1
1532 1 25 MET QB 1 57 PRO HD3 3.939 . 5.879 5.580 4.872 6.317 0.438 13 0 "[ . 1 .]" 1
1533 1 27 LYS HD3 1 28 LEU HA 5.138 . 8.437 5.425 5.232 5.729 . 0 0 "[ . 1 .]" 1
1534 1 21 GLY QA 1 24 ASP HA 4.142 . 6.287 5.237 5.056 5.609 . 0 0 "[ . 1 .]" 1
1535 1 18 ALA HA 1 21 GLY QA 3.816 . 5.636 3.499 3.128 3.792 . 0 0 "[ . 1 .]" 1
1536 1 45 SER HA 1 59 GLY HA3 4.558 . 7.155 6.363 5.338 6.916 . 0 0 "[ . 1 .]" 1
1537 1 77 LEU HG 1 80 GLY QA 3.047 . 4.208 4.905 4.189 5.458 1.250 8 11 "[*** ** +**-* *]" 1
1538 1 40 LEU HA 1 87 ILE MG 3.832 . 5.668 5.134 4.684 5.715 0.047 15 0 "[ . 1 .]" 1
1539 1 19 LEU HA 1 22 ALA HA 3.699 . 5.410 5.494 5.283 5.646 0.236 7 0 "[ . 1 .]" 1
1540 1 34 PRO QG 1 39 GLY HA2 3.216 . 4.509 2.310 2.159 2.459 . 0 0 "[ . 1 .]" 1
1541 1 39 GLY HA2 1 76 LEU QB 4.586 . 7.215 4.710 4.270 5.466 . 0 0 "[ . 1 .]" 1
1542 1 17 VAL HA 1 19 LEU HA 4.866 . 7.826 6.356 6.239 6.535 . 0 0 "[ . 1 .]" 1
1543 1 17 VAL HA 1 18 ALA MB 4.013 . 6.026 5.014 5.000 5.034 . 0 0 "[ . 1 .]" 1
1544 1 97 GLU HA 1 97 GLU QG 2.985 . 3.280 2.669 2.371 3.358 0.078 2 0 "[ . 1 .]" 1
1545 1 36 THR HB 1 40 LEU QD 3.827 . 5.658 5.745 5.050 6.160 0.502 9 1 "[ . +1 .]" 1
1546 1 16 LEU QD 1 88 PHE HB3 4.137 . 6.276 4.441 4.028 4.734 . 0 0 "[ . 1 .]" 1
1547 1 31 SER QB 1 32 ARG QD 4.630 . 7.310 5.644 4.596 6.520 . 0 0 "[ . 1 .]" 1
1548 1 64 ARG HA 1 64 ARG HD3 4.781 . 7.638 4.656 3.608 5.536 . 0 0 "[ . 1 .]" 1
1549 1 24 ASP HA 1 24 ASP HB2 2.980 . 4.090 2.675 2.380 3.019 . 0 0 "[ . 1 .]" 1
1550 1 8 ASP HB2 1 12 VAL QG 3.267 . 4.601 4.682 4.263 5.318 0.717 7 1 "[ . + 1 .]" 1
1551 1 22 ALA MB 1 61 TYR HB3 3.669 . 5.352 5.636 5.254 6.210 0.858 14 4 "[ - 1* +*]" 1
1552 1 92 PRO HB2 1 93 ASP HB2 4.626 . 7.301 5.445 4.456 6.079 . 0 0 "[ . 1 .]" 1
1553 1 54 ARG QG 1 56 TYR QB 4.703 . 7.468 6.162 5.815 6.326 . 0 0 "[ . 1 .]" 1
1554 1 26 TYR HA 1 29 ASP HB3 4.053 . 6.106 3.463 2.318 5.002 . 0 0 "[ . 1 .]" 1
1555 1 101 ASP HB2 1 102 ILE HA 3.903 . 5.807 5.308 5.039 5.520 . 0 0 "[ . 1 .]" 1
1556 1 101 ASP HA 1 101 ASP HB3 2.784 . 3.753 2.652 2.557 2.747 . 0 0 "[ . 1 .]" 1
1557 1 29 ASP HB3 1 53 ALA HA 4.286 . 6.582 4.421 3.570 5.563 . 0 0 "[ . 1 .]" 1
1558 1 41 GLN HG2 1 44 VAL HB 4.420 . 6.863 6.532 5.094 7.551 0.688 6 3 "[ .+ 1 *-.]" 1
1559 1 30 ASN QB 1 32 ARG QB 4.525 . 7.084 4.435 4.052 5.022 . 0 0 "[ . 1 .]" 1
1560 1 27 LYS HB3 1 27 LYS QE 4.696 . 6.111 4.114 3.939 4.231 . 0 0 "[ . 1 .]" 1
1561 1 41 GLN HB2 1 41 GLN HG2 2.528 . 3.327 2.521 2.348 2.995 . 0 0 "[ . 1 .]" 1
1562 1 41 GLN HB3 1 41 GLN HG3 2.717 . 3.640 2.515 2.340 2.993 . 0 0 "[ . 1 .]" 1
1563 1 30 ASN QB 1 54 ARG QG 4.613 . 7.273 6.316 5.291 8.450 1.177 14 1 "[ . 1 +.]" 1
1564 1 32 ARG QB 1 84 GLN QG 4.222 . 6.450 6.067 4.707 7.744 1.294 10 3 "[ .- + *.]" 1
1565 1 32 ARG QB 1 33 TYR QB 4.040 . 6.080 4.240 3.898 4.468 . 0 0 "[ . 1 .]" 1
1566 1 33 TYR QB 1 34 PRO HB3 4.421 . 6.864 5.425 5.303 5.653 . 0 0 "[ . 1 .]" 1
1567 1 38 GLN HB3 1 49 ALA MB 2.956 . 4.048 4.379 4.020 4.732 0.684 6 2 "[ -.+ 1 .]" 1
1568 1 51 PRO QB 1 56 TYR QB 4.634 . 7.319 8.956 8.540 9.282 1.963 2 15 [*+*-***********] 1
1569 1 44 VAL HB 1 65 LEU QB 2.992 . 4.111 5.280 3.943 6.303 2.192 2 13 "[*+* ***-***** *]" 1
1570 1 41 GLN HA 1 41 GLN HB2 2.380 . 3.088 3.006 2.968 3.017 . 0 0 "[ . 1 .]" 1
1571 1 37 GLU QG 1 40 LEU QB 4.190 . 6.385 5.282 4.437 6.719 0.334 13 0 "[ . 1 .]" 1
1572 1 41 GLN HB3 1 41 GLN HG2 2.352 . 3.044 2.950 2.552 3.012 . 0 0 "[ . 1 .]" 1
1573 1 40 LEU HA 1 41 GLN HB3 4.136 . 6.275 6.600 6.553 6.641 0.366 6 0 "[ . 1 .]" 1
1574 1 31 SER QB 1 32 ARG QB 3.986 . 5.972 3.763 3.539 4.231 . 0 0 "[ . 1 .]" 1
1575 1 13 VAL HB 1 14 SER HA 2.956 . 4.048 4.262 4.176 4.387 0.339 3 0 "[ . 1 .]" 1
1576 1 18 ALA MB 1 66 PRO HB3 3.377 . 4.803 4.528 4.313 4.891 0.088 2 0 "[ . 1 .]" 1
1577 1 9 ARG QB 1 102 ILE HB 3.980 . 5.960 4.920 4.153 5.272 . 0 0 "[ . 1 .]" 1
1578 1 16 LEU QB 1 19 LEU QB 3.149 . 4.389 4.440 4.341 4.518 0.129 7 0 "[ . 1 .]" 1
1579 1 11 LYS QB 1 12 VAL HB 4.116 . 6.233 4.721 4.436 5.012 . 0 0 "[ . 1 .]" 1
1580 1 19 LEU QB 1 87 ILE HG13 3.298 . 4.657 4.404 4.217 4.621 . 0 0 "[ . 1 .]" 1
1581 1 18 ALA MB 1 66 PRO QG 3.217 . 4.510 4.314 3.538 4.955 0.445 11 0 "[ . 1 .]" 1
1582 1 62 ILE HB 1 66 PRO QG 4.788 . 7.654 5.423 5.124 5.986 . 0 0 "[ . 1 .]" 1
1583 1 6 LYS QB 1 10 GLN HG2 4.383 . 6.784 4.656 3.302 6.241 . 0 0 "[ . 1 .]" 1
1584 1 6 LYS QB 1 10 GLN HB3 4.472 . 6.972 6.320 5.825 7.176 0.204 11 0 "[ . 1 .]" 1
1585 1 10 GLN HB2 1 11 LYS QB 4.154 . 6.311 4.578 4.128 5.090 . 0 0 "[ . 1 .]" 1
1586 1 68 ASP HB3 1 73 ASP HA 4.996 . 8.116 6.535 5.640 7.523 . 0 0 "[ . 1 .]" 1
1587 1 39 GLY HA3 1 40 LEU QB 3.593 . 5.207 4.527 4.398 4.816 . 0 0 "[ . 1 .]" 1
1588 1 25 MET QG 1 57 PRO QB 4.690 . 7.439 7.366 6.192 8.776 1.337 13 4 "[ . ** +-.]" 1
1589 1 76 LEU QB 1 85 VAL QG 4.192 . 6.388 4.684 4.444 4.958 . 0 0 "[ . 1 .]" 1
1590 1 39 GLY HA2 1 40 LEU QB 3.592 . 5.205 5.290 5.181 5.480 0.275 2 0 "[ . 1 .]" 1
1591 1 92 PRO HG2 1 93 ASP HB3 3.986 . 5.972 5.080 3.544 5.589 . 0 0 "[ . 1 .]" 1
1592 1 12 VAL HB 1 102 ILE HB 3.866 . 5.734 4.164 3.590 4.469 . 0 0 "[ . 1 .]" 1
1593 1 68 ASP HB3 1 69 PRO HD3 4.181 . 6.366 3.770 3.178 4.423 . 0 0 "[ . 1 .]" 1
1594 1 5 GLU HA 1 6 LYS HG3 4.303 . 6.618 6.245 5.367 7.272 0.654 2 3 "[ + . 1- *]" 1
1595 1 24 ASP HA 1 27 LYS HB2 3.026 . 4.171 3.774 3.097 4.383 0.212 4 0 "[ . 1 .]" 1
1596 1 27 LYS HB3 1 27 LYS HD3 3.376 . 4.801 2.501 2.405 2.581 . 0 0 "[ . 1 .]" 1
1597 1 27 LYS HB2 1 27 LYS HD2 3.504 . 5.039 2.532 2.449 2.594 . 0 0 "[ . 1 .]" 1
1598 1 31 SER QB 1 32 ARG HG3 4.077 . 6.155 4.394 3.082 5.634 . 0 0 "[ . 1 .]" 1
1599 1 22 ALA MB 1 61 TYR HA 3.894 . 5.790 6.890 6.505 7.393 1.603 14 15 [******-******+*] 1
1600 1 18 ALA MB 1 21 GLY QA 4.829 . 7.744 4.702 4.389 4.982 . 0 0 "[ . 1 .]" 1
1601 1 19 LEU QB 1 22 ALA MB 3.924 . 5.848 4.216 3.990 4.375 . 0 0 "[ . 1 .]" 1
1602 1 20 GLU HA 1 23 LEU HG 3.644 . 5.304 4.245 2.307 5.171 . 0 0 "[ . 1 .]" 1
1603 1 20 GLU QG 1 23 LEU HG 4.091 . 6.183 5.683 4.149 6.941 0.758 2 3 "[ +-*. 1 .]" 1
1604 1 85 VAL HB 1 87 ILE MG 2.384 . 3.094 3.833 3.464 4.174 1.080 7 11 "[***** +-*1** *]" 1
1605 1 76 LEU HA 1 87 ILE HG13 4.053 . 6.106 6.122 5.946 6.212 0.106 10 0 "[ . 1 .]" 1
1606 1 80 GLY QA 1 85 VAL HB 4.966 . 8.049 4.713 4.327 5.122 . 0 0 "[ . 1 .]" 1
1607 1 40 LEU HG 1 41 GLN HG2 5.174 . 8.520 6.186 5.592 7.241 . 0 0 "[ . 1 .]" 1
1608 1 41 GLN HA 1 42 ALA MB 3.895 . 5.335 4.964 4.948 4.990 . 0 0 "[ . 1 .]" 1
1609 1 92 PRO HB2 1 92 PRO HD2 4.143 . 6.288 3.132 2.942 4.021 . 0 0 "[ . 1 .]" 1
1610 1 42 ALA MB 1 76 LEU QB 4.616 . 7.280 6.237 5.951 6.793 . 0 0 "[ . 1 .]" 1
1611 1 77 LEU QB 1 81 GLN QB 4.103 . 6.207 4.623 4.108 5.079 . 0 0 "[ . 1 .]" 1
1612 1 75 GLN HB3 1 77 LEU QB 3.695 . 5.402 4.279 3.946 4.787 . 0 0 "[ . 1 .]" 1
1613 1 39 GLY HA3 1 42 ALA MB 4.841 . 7.770 4.334 4.073 4.569 . 0 0 "[ . 1 .]" 1
1614 1 39 GLY HA2 1 42 ALA MB 3.595 . 5.210 2.983 2.696 3.256 . 0 0 "[ . 1 .]" 1
1615 1 56 TYR QB 1 57 PRO QB 4.501 . 7.034 4.897 4.792 4.985 . 0 0 "[ . 1 .]" 1
1616 1 63 ARG QD 1 64 ARG QG 4.337 . 6.688 4.591 3.700 7.114 0.426 13 0 "[ . 1 .]" 1
1617 1 42 ALA MB 1 47 PRO HB2 4.078 . 6.156 5.491 4.816 5.833 . 0 0 "[ . 1 .]" 1
1618 1 49 ALA MB 1 51 PRO QD 3.217 . 4.511 4.850 4.727 5.015 0.504 15 1 "[ . 1 +]" 1
1619 1 32 ARG HG2 1 51 PRO QD 3.079 . 4.264 3.791 3.351 4.183 . 0 0 "[ . 1 .]" 1
1620 1 49 ALA MB 1 51 PRO QG 3.951 . 5.903 6.220 5.843 6.555 0.652 15 4 "[ . * *- +]" 1
1621 1 11 LYS HA 1 12 VAL QG 4.204 . 6.414 4.818 4.727 4.901 . 0 0 "[ . 1 .]" 1
1622 1 12 VAL QG 1 17 VAL QG 3.788 . 5.582 5.390 5.204 5.798 0.216 3 0 "[ . 1 .]" 1
1623 1 16 LEU QB 1 17 VAL QG 3.167 . 4.421 3.051 2.961 3.152 . 0 0 "[ . 1 .]" 1
1624 1 34 PRO QG 1 43 LEU QD 4.039 . 6.078 5.892 4.863 6.834 0.756 9 2 "[ . -+1 .]" 1
1625 1 13 VAL QG 1 107 ILE HA 3.321 . 4.699 4.403 4.002 4.791 0.092 15 0 "[ . 1 .]" 1
1626 1 8 ASP HA 1 13 VAL QG 4.191 . 6.386 6.939 6.792 7.149 0.763 3 9 "[**+-. *** * *]" 1
1627 1 21 GLY QA 1 28 LEU QD 4.663 . 7.381 6.640 6.168 7.002 . 0 0 "[ . 1 .]" 1
1628 1 88 PHE HA 1 107 ILE MG 4.148 . 6.299 6.443 6.131 6.860 0.561 7 1 "[ . + 1 .]" 1
1629 1 39 GLY HA2 1 40 LEU QD 4.463 . 6.953 4.713 4.114 5.180 . 0 0 "[ . 1 .]" 1
1630 1 104 ASN HB2 1 107 ILE MG 3.886 . 5.774 4.084 3.594 4.731 . 0 0 "[ . 1 .]" 1
1631 1 65 LEU QD 1 66 PRO QG 3.340 . 4.734 3.648 2.496 4.047 . 0 0 "[ . 1 .]" 1
1632 1 90 LEU QD 1 102 ILE MG 3.722 . 5.454 6.878 6.375 7.769 2.315 7 15 [-*****+********] 1
1633 1 17 VAL HA 1 102 ILE MG 4.496 . 7.022 8.010 7.539 8.886 1.864 12 15 [******-****+***] 1
1634 1 23 LEU QD 1 34 PRO HB3 4.183 . 6.371 4.194 4.051 4.354 . 0 0 "[ . 1 .]" 1
1635 1 23 LEU QD 1 33 TYR HA 4.361 . 6.738 4.713 4.386 4.915 . 0 0 "[ . 1 .]" 1
1636 1 22 ALA HA 1 23 LEU QD 3.867 . 5.736 4.658 4.465 4.902 . 0 0 "[ . 1 .]" 1
1637 1 23 LEU QD 1 26 TYR HA 4.585 . 7.213 6.276 6.086 6.545 . 0 0 "[ . 1 .]" 1
1638 1 57 PRO HG3 1 61 TYR HA 3.997 . 5.994 4.489 3.485 5.289 . 0 0 "[ . 1 .]" 1
1639 1 40 LEU QB 1 76 LEU QD 4.016 . 6.032 4.629 3.528 5.240 . 0 0 "[ . 1 .]" 1
1640 1 20 GLU HA 1 85 VAL QG 4.476 . 6.980 4.900 4.409 5.545 . 0 0 "[ . 1 .]" 1
1641 1 33 TYR HA 1 85 VAL QG 4.239 . 6.485 3.759 3.440 3.943 . 0 0 "[ . 1 .]" 1
1642 1 20 GLU QG 1 85 VAL QG 4.061 . 6.123 4.839 3.728 5.935 . 0 0 "[ . 1 .]" 1
1643 1 13 VAL QG 1 19 LEU QD 4.395 . 6.809 5.919 5.835 6.090 . 0 0 "[ . 1 .]" 1
1644 1 39 GLY HA3 1 76 LEU QB 4.446 . 6.916 3.221 2.768 3.989 . 0 0 "[ . 1 .]" 1
1645 1 75 GLN H 1 76 LEU QB 4.067 . 6.135 5.179 4.941 5.281 . 0 0 "[ . 1 .]" 1
1646 1 92 PRO HA 1 92 PRO HD2 4.411 . 6.843 3.939 3.902 4.095 . 0 0 "[ . 1 .]" 1
1647 1 92 PRO HA 1 100 ASP HB2 4.949 . 8.011 6.966 5.922 8.965 0.954 15 1 "[ . 1 +]" 1
1648 1 15 ASP QB 1 87 ILE MD 3.647 . 5.309 6.119 5.933 6.333 1.024 5 15 [****+***-******] 1
1649 1 102 ILE MG 1 108 GLY QA 4.294 . 6.599 7.178 6.791 7.634 1.035 4 10 "[ **+-* * *** *]" 1
1650 1 62 ILE MG 1 66 PRO HD3 3.575 . 5.173 2.392 2.099 2.684 . 0 0 "[ . 1 .]" 1
1651 1 97 GLU QG 1 98 SER H 5.108 . 8.369 4.449 3.735 4.759 . 0 0 "[ . 1 .]" 1
1652 1 96 PRO HA 1 97 GLU QG 5.094 . 8.337 4.566 3.941 6.031 . 0 0 "[ . 1 .]" 1
1653 1 90 LEU QD 1 97 GLU QG 5.466 . 9.200 5.417 4.587 6.840 . 0 0 "[ . 1 .]" 1
1654 1 41 GLN HA 1 41 GLN HG2 3.689 . 5.390 2.842 2.205 3.197 . 0 0 "[ . 1 .]" 1
1655 1 105 TRP HA 1 107 ILE HB 4.597 . 7.239 6.887 6.613 7.038 . 0 0 "[ . 1 .]" 1
1656 1 41 GLN HG2 1 45 SER H 5.117 . 8.390 5.639 4.081 6.519 . 0 0 "[ . 1 .]" 1
1657 1 41 GLN HG3 1 44 VAL H 5.059 . 8.258 6.651 6.043 6.923 . 0 0 "[ . 1 .]" 1
1658 1 13 VAL QG 1 74 TYR QD 4.885 . 7.867 6.933 6.410 7.126 . 0 0 "[ . 1 .]" 1
1659 1 67 GLN HA 1 67 GLN HE22 5.122 . 8.401 4.876 4.117 5.177 . 0 0 "[ . 1 .]" 1
1660 1 49 ALA H 1 52 HIS HE1 4.030 . 6.061 5.977 5.343 6.951 0.890 7 1 "[ . + 1 .]" 1
1661 1 26 TYR QE 1 32 ARG HA 5.087 . 8.321 5.972 5.148 7.423 . 0 0 "[ . 1 .]" 1
1662 1 24 ASP HA 1 33 TYR QE 3.329 . 4.714 3.453 2.174 4.853 0.139 6 0 "[ . 1 .]" 1
1663 1 74 TYR QD 1 89 SER HA 3.238 . 4.548 3.225 2.051 4.829 0.281 4 0 "[ . 1 .]" 1
1664 1 82 HIS HA 1 105 TRP HD1 4.334 . 6.682 5.848 4.716 7.976 1.294 1 2 "[+ . 1 -]" 1
1665 1 26 TYR QE 1 33 TYR QB 4.337 . 6.688 5.639 4.828 6.872 0.184 8 0 "[ . 1 .]" 1
1666 1 26 TYR QD 1 29 ASP HB3 5.162 . 8.492 5.030 3.388 6.444 . 0 0 "[ . 1 .]" 1
1667 1 88 PHE QD 1 102 ILE HB 4.666 . 7.388 6.750 6.221 7.399 0.011 7 0 "[ . 1 .]" 1
1668 1 70 TRP HZ3 1 102 ILE HB 3.788 . 5.582 4.429 3.163 5.873 0.291 1 0 "[ . 1 .]" 1
1669 1 69 PRO HB3 1 70 TRP HZ2 4.610 . 7.267 6.986 6.321 7.481 0.214 12 0 "[ . 1 .]" 1
1670 1 22 ALA MB 1 61 TYR QD 3.937 . 5.875 3.587 2.905 4.420 . 0 0 "[ . 1 .]" 1
1671 1 26 TYR QD 1 32 ARG HG3 4.672 . 7.401 4.320 3.617 5.716 . 0 0 "[ . 1 .]" 1
1672 1 87 ILE HG13 1 88 PHE QD 4.790 . 7.658 5.446 5.276 5.634 . 0 0 "[ . 1 .]" 1
1673 1 12 VAL QG 1 70 TRP HZ2 4.196 . 6.396 4.371 3.955 5.044 . 0 0 "[ . 1 .]" 1
1674 1 40 LEU QD 1 74 TYR QD 3.902 . 5.806 3.856 2.953 4.274 . 0 0 "[ . 1 .]" 1
1675 1 26 TYR QD 1 27 LYS HD2 4.220 . 6.446 6.374 5.805 7.115 0.669 13 3 "[ - . * 1 + .]" 1
1676 1 5 GLU HA 1 70 TRP HZ2 4.287 . 6.585 3.730 2.460 4.672 . 0 0 "[ . 1 .]" 1
1677 1 70 TRP HD1 1 71 GLY HA2 4.771 . 7.616 7.694 7.491 7.853 0.237 1 0 "[ . 1 .]" 1
1678 1 74 TYR QD 1 96 PRO QG 4.742 . 7.552 9.640 9.069 10.091 2.539 2 15 [-+*************] 1
1679 1 89 SER H 1 91 GLY H 4.525 . 7.085 5.226 4.806 5.522 . 0 0 "[ . 1 .]" 1
1680 1 8 ASP H 1 11 LYS H 4.501 . 7.034 4.877 4.642 5.143 . 0 0 "[ . 1 .]" 1
1681 1 41 GLN H 1 45 SER H 4.886 . 7.870 5.734 5.520 6.061 . 0 0 "[ . 1 .]" 1
1682 1 24 ASP H 1 28 LEU H 4.053 . 6.106 5.962 5.851 6.084 . 0 0 "[ . 1 .]" 1
1683 1 42 ALA H 1 45 SER H 3.793 . 5.592 4.874 4.709 5.006 . 0 0 "[ . 1 .]" 1
1684 1 71 GLY H 1 94 GLY H 4.879 . 7.854 8.161 7.181 8.881 1.027 12 5 "[ *.* * + -]" 1
1685 1 91 GLY H 1 101 ASP H 4.115 . 6.232 7.069 6.475 7.590 1.358 11 12 "[* *** ****+ *-*]" 1
1686 1 53 ALA H 1 56 TYR QD 5.240 . 8.672 5.731 5.429 6.187 . 0 0 "[ . 1 .]" 1
1687 1 25 MET H 1 26 TYR QD 5.621 . 9.571 6.255 5.912 6.464 . 0 0 "[ . 1 .]" 1
1688 1 61 TYR QD 1 62 ILE H 5.194 . 8.566 4.309 3.870 4.776 . 0 0 "[ . 1 .]" 1
1689 1 43 LEU H 1 61 TYR QD 5.505 . 9.293 5.043 4.583 5.999 . 0 0 "[ . 1 .]" 1
1690 1 88 PHE QD 1 102 ILE H 4.393 . 6.805 5.379 4.716 6.047 . 0 0 "[ . 1 .]" 1
1691 1 74 TYR QD 1 90 LEU H 4.422 . 6.866 4.936 3.597 6.028 . 0 0 "[ . 1 .]" 1
1692 1 23 LEU H 1 74 TYR QD 5.572 . 9.453 10.127 9.320 10.673 1.220 7 13 "[*** .*+-*******]" 1
1693 1 77 LEU HA 1 82 HIS H 4.992 . 8.107 8.861 8.454 9.172 1.065 5 13 "[****+* **-****.]" 1
1694 1 96 PRO HA 1 102 ILE H 4.006 . 6.012 6.711 6.088 7.171 1.159 15 10 "[****. * -1*** +]" 1
1695 1 72 SER HA 1 91 GLY H 4.727 . 7.520 6.225 5.532 7.351 . 0 0 "[ . 1 .]" 1
1696 1 72 SER HA 1 90 LEU H 4.442 . 6.909 5.872 5.129 6.768 . 0 0 "[ . 1 .]" 1
1697 1 24 ASP HA 1 27 LYS H 3.276 . 4.618 3.534 3.201 3.766 . 0 0 "[ . 1 .]" 1
1698 1 42 ALA H 1 65 LEU HA 4.588 . 7.219 7.732 7.034 8.109 0.890 6 9 "[ ** *+** 1-** .]" 1
1699 1 49 ALA H 1 49 ALA HA 2.887 . 3.929 2.852 2.816 2.923 . 0 0 "[ . 1 .]" 1
1700 1 65 LEU HA 1 67 GLN HE21 6.158 . 10.898 7.743 6.996 8.875 . 0 0 "[ . 1 .]" 1
1701 1 12 VAL HA 1 16 LEU H 3.474 . 4.983 4.073 3.985 4.193 . 0 0 "[ . 1 .]" 1
1702 1 12 VAL HA 1 14 SER H 3.870 . 5.742 4.322 4.246 4.376 . 0 0 "[ . 1 .]" 1
1703 1 5 GLU HA 1 9 ARG H 3.297 . 4.655 3.905 3.337 4.119 . 0 0 "[ . 1 .]" 1
1704 1 36 THR HA 1 78 SER H 3.181 . 4.446 3.719 3.053 4.460 0.014 15 0 "[ . 1 .]" 1
1705 1 83 GLY HA3 1 84 GLN H 4.134 . 6.270 2.323 2.208 2.468 . 0 0 "[ . 1 .]" 1
1706 1 14 SER HA 1 16 LEU H 4.441 . 6.906 4.345 4.292 4.389 . 0 0 "[ . 1 .]" 1
1707 1 10 GLN HA 1 13 VAL H 3.178 . 4.441 3.209 2.976 3.493 . 0 0 "[ . 1 .]" 1
1708 1 27 LYS HA 1 28 LEU H 2.667 . 3.556 3.509 3.492 3.520 . 0 0 "[ . 1 .]" 1
1709 1 27 LYS HA 1 29 ASP H 3.432 . 4.905 4.406 4.165 4.671 . 0 0 "[ . 1 .]" 1
1710 1 21 GLY QA 1 25 MET H 3.693 . 5.398 3.847 3.704 4.150 . 0 0 "[ . 1 .]" 1
1711 1 69 PRO HD2 1 70 TRP H 3.594 . 5.209 3.029 2.767 3.243 . 0 0 "[ . 1 .]" 1
1712 1 76 LEU H 1 80 GLY QA 5.466 . 9.200 8.139 7.846 8.625 . 0 0 "[ . 1 .]" 1
1713 1 16 LEU HA 1 18 ALA H 3.226 . 4.527 4.365 4.290 4.426 . 0 0 "[ . 1 .]" 1
1714 1 36 THR HB 1 78 SER H 2.830 . 3.831 3.088 2.331 5.373 1.542 15 1 "[ . 1 +]" 1
1715 1 13 VAL HA 1 103 GLY H 4.800 . 7.680 7.561 7.173 8.327 0.647 2 1 "[ + . 1 .]" 1
1716 1 45 SER H 1 60 GLY HA2 4.408 . 6.837 5.419 4.745 5.891 . 0 0 "[ . 1 .]" 1
1717 1 60 GLY HA2 1 62 ILE H 3.538 . 5.103 4.498 4.235 5.019 . 0 0 "[ . 1 .]" 1
1718 1 64 ARG H 1 64 ARG HD3 4.899 . 7.899 5.011 4.414 5.824 . 0 0 "[ . 1 .]" 1
1719 1 23 LEU H 1 25 MET QG 4.948 . 8.008 5.399 4.737 5.761 . 0 0 "[ . 1 .]" 1
1720 1 22 ALA H 1 25 MET QG 4.453 . 6.931 4.813 4.070 5.830 . 0 0 "[ . 1 .]" 1
1721 1 24 ASP HB2 1 26 TYR H 4.280 . 6.570 5.585 4.967 6.023 . 0 0 "[ . 1 .]" 1
1722 1 99 ASN HB3 1 100 ASP H 3.574 . 5.171 3.543 2.521 4.343 . 0 0 "[ . 1 .]" 1
1723 1 24 ASP HB3 1 28 LEU H 4.470 . 6.968 5.424 4.939 5.844 . 0 0 "[ . 1 .]" 1
1724 1 54 ARG H 1 56 TYR QB 3.819 . 5.642 4.743 4.458 5.012 . 0 0 "[ . 1 .]" 1
1725 1 98 SER H 1 101 ASP HB3 4.096 . 6.193 3.866 3.542 4.202 . 0 0 "[ . 1 .]" 1
1726 1 27 LYS H 1 27 LYS QE 4.995 . 8.114 6.049 5.923 6.124 . 0 0 "[ . 1 .]" 1
1727 1 41 GLN HG3 1 42 ALA H 4.453 . 6.932 5.326 4.917 5.441 . 0 0 "[ . 1 .]" 1
1728 1 40 LEU H 1 41 GLN HG2 5.352 . 8.933 4.708 4.269 6.164 . 0 0 "[ . 1 .]" 1
1729 1 79 PRO HB3 1 84 GLN HE21 3.956 . 5.913 3.320 2.243 4.720 . 0 0 "[ . 1 .]" 1
1730 1 93 ASP HB3 1 94 GLY H 4.654 . 7.362 4.206 3.474 4.393 . 0 0 "[ . 1 .]" 1
1731 1 82 HIS HB2 1 105 TRP H 4.483 . 6.995 4.711 3.958 5.384 . 0 0 "[ . 1 .]" 1
1732 1 11 LYS H 1 12 VAL HB 3.970 . 5.940 4.639 4.463 4.842 . 0 0 "[ . 1 .]" 1
1733 1 50 GLU H 1 51 PRO QB 5.382 . 9.002 6.174 6.101 6.246 . 0 0 "[ . 1 .]" 1
1734 1 96 PRO QB 1 102 ILE H 4.829 . 7.743 7.720 7.007 8.290 0.547 15 1 "[ . 1 +]" 1
1735 1 65 LEU H 1 67 GLN HG3 4.533 . 7.101 5.444 4.921 5.878 . 0 0 "[ . 1 .]" 1
1736 1 41 GLN HE22 1 44 VAL HB 4.530 . 7.095 6.102 3.915 7.657 0.562 14 1 "[ . 1 +.]" 1
1737 1 40 LEU H 1 41 GLN HB2 4.759 . 7.590 4.672 4.527 4.842 . 0 0 "[ . 1 .]" 1
1738 1 7 ALA H 1 10 GLN HB2 4.295 . 6.601 5.186 4.778 5.569 . 0 0 "[ . 1 .]" 1
1739 1 15 ASP H 1 16 LEU QB 4.092 . 6.185 4.166 4.090 4.210 . 0 0 "[ . 1 .]" 1
1740 1 8 ASP H 1 9 ARG QB 4.132 . 6.267 4.999 4.849 5.100 . 0 0 "[ . 1 .]" 1
1741 1 81 GLN H 1 81 GLN HG3 3.525 . 5.079 4.507 4.407 4.718 . 0 0 "[ . 1 .]" 1
1742 1 77 LEU QB 1 83 GLY H 5.127 . 8.413 6.967 6.517 7.666 . 0 0 "[ . 1 .]" 1
1743 1 19 LEU QB 1 88 PHE H 5.107 . 8.368 5.917 5.673 6.261 . 0 0 "[ . 1 .]" 1
1744 1 75 GLN QG 1 88 PHE H 4.897 . 7.895 5.173 4.746 5.658 . 0 0 "[ . 1 .]" 1
1745 1 9 ARG H 1 9 ARG QG 2.560 . 3.379 2.158 2.044 2.335 . 0 0 "[ . 1 .]" 1
1746 1 9 ARG QG 1 13 VAL H 5.037 . 8.209 4.983 4.619 5.254 . 0 0 "[ . 1 .]" 1
1747 1 28 LEU HB3 1 30 ASN H 4.276 . 6.561 4.984 4.790 5.276 . 0 0 "[ . 1 .]" 1
1748 1 54 ARG HB3 1 56 TYR H 3.707 . 5.424 4.999 4.663 5.815 0.391 13 0 "[ . 1 .]" 1
1749 1 44 VAL H 1 64 ARG QB 4.311 . 6.634 8.233 7.732 8.484 1.850 7 15 [******+******-*] 1
1750 1 27 LYS H 1 27 LYS HB2 2.681 . 3.579 2.585 2.509 2.643 . 0 0 "[ . 1 .]" 1
1751 1 22 ALA MB 1 44 VAL H 3.673 . 5.359 4.951 4.737 5.127 . 0 0 "[ . 1 .]" 1
1752 1 11 LYS QG 1 15 ASP H 4.028 . 6.056 5.053 3.788 6.319 0.263 11 0 "[ . 1 .]" 1
1753 1 7 ALA MB 1 11 LYS H 3.713 . 5.437 4.876 4.484 5.211 . 0 0 "[ . 1 .]" 1
1754 1 5 GLU H 1 7 ALA MB 3.782 . 5.570 5.082 4.875 5.422 . 0 0 "[ . 1 .]" 1
1755 1 11 LYS QG 1 14 SER H 4.721 . 7.507 5.072 4.562 5.619 . 0 0 "[ . 1 .]" 1
1756 1 16 LEU H 1 22 ALA MB 5.010 . 8.147 8.680 8.448 8.975 0.828 6 11 "[** **+***1* * -]" 1
1757 1 80 GLY H 1 81 GLN QB 5.070 . 8.284 6.064 5.976 6.141 . 0 0 "[ . 1 .]" 1
1758 1 75 GLN HB3 1 88 PHE H 3.970 . 5.940 4.788 4.462 5.243 . 0 0 "[ . 1 .]" 1
1759 1 40 LEU HG 1 41 GLN H 3.917 . 5.835 5.099 4.805 5.336 . 0 0 "[ . 1 .]" 1
1760 1 40 LEU H 1 42 ALA MB 3.460 . 4.957 4.810 4.674 4.949 . 0 0 "[ . 1 .]" 1
1761 1 81 GLN QB 1 106 THR H 4.390 . 6.799 8.682 7.783 9.339 2.540 14 15 [***********-*+*] 1
1762 1 81 GLN QB 1 83 GLY H 4.943 . 7.998 4.650 4.357 4.992 . 0 0 "[ . 1 .]" 1
1763 1 11 LYS H 1 69 PRO HG3 3.933 . 5.867 4.793 4.439 5.287 . 0 0 "[ . 1 .]" 1
1764 1 42 ALA H 1 76 LEU QB 4.476 . 6.980 6.568 6.229 7.061 0.081 14 0 "[ . 1 .]" 1
1765 1 37 GLU H 1 77 LEU MD2 4.633 . 7.316 6.596 6.001 7.533 0.217 2 0 "[ . 1 .]" 1
1766 1 77 LEU MD1 1 86 ASP H 4.646 . 7.344 4.353 4.047 4.662 . 0 0 "[ . 1 .]" 1
1767 1 16 LEU H 1 19 LEU QB 3.307 . 4.674 5.038 4.826 5.132 0.458 5 0 "[ . 1 .]" 1
1768 1 27 LYS HG2 1 28 LEU H 3.697 . 5.406 3.940 3.862 4.130 . 0 0 "[ . 1 .]" 1
1769 1 26 TYR H 1 27 LYS HG2 4.821 . 7.726 6.998 6.911 7.134 . 0 0 "[ . 1 .]" 1
1770 1 25 MET H 1 43 LEU QD 4.981 . 8.082 6.559 5.672 7.419 . 0 0 "[ . 1 .]" 1
1771 1 20 GLU H 1 43 LEU QD 3.337 . 4.729 4.766 4.462 4.939 0.210 9 0 "[ . 1 .]" 1
1772 1 24 ASP H 1 87 ILE MG 4.618 . 7.283 6.810 6.535 7.204 . 0 0 "[ . 1 .]" 1
1773 1 28 LEU QD 1 30 ASN H 5.077 . 8.299 5.368 4.803 5.491 . 0 0 "[ . 1 .]" 1
1774 1 43 LEU H 1 43 LEU QD 3.183 . 4.450 2.341 1.552 3.581 0.364 3 0 "[ . 1 .]" 1
1775 1 40 LEU QD 1 41 GLN H 3.501 . 5.033 4.033 3.646 4.199 . 0 0 "[ . 1 .]" 1
1776 1 65 LEU QD 1 74 TYR H 3.404 . 4.852 4.900 3.271 5.650 0.798 11 4 "[* . -+ *]" 1
1777 1 87 ILE MD 1 104 ASN H 4.181 . 6.366 4.069 3.526 4.673 . 0 0 "[ . 1 .]" 1
1778 1 23 LEU QD 1 27 LYS H 4.340 . 6.695 5.318 5.006 5.528 . 0 0 "[ . 1 .]" 1
1779 1 27 LYS HG3 1 33 TYR H 5.053 . 8.244 3.732 3.295 4.271 . 0 0 "[ . 1 .]" 1
1780 1 37 GLU HB3 1 49 ALA H 4.347 . 6.709 5.974 5.486 6.657 . 0 0 "[ . 1 .]" 1
1781 1 8 ASP HB2 1 70 TRP HE1 4.311 . 6.634 4.194 3.060 5.397 . 0 0 "[ . 1 .]" 1
1782 1 69 PRO HB3 1 70 TRP HE1 4.310 . 6.632 6.669 5.823 7.409 0.777 12 2 "[- . 1 + .]" 1
1783 1 77 LEU H 1 86 ASP HA 4.994 . 8.112 4.610 4.351 4.895 . 0 0 "[ . 1 .]" 1
1784 1 75 GLN HB3 1 77 LEU H 3.876 . 5.754 5.164 4.861 5.580 . 0 0 "[ . 1 .]" 1
1785 1 19 LEU QD 1 21 GLY H 4.317 . 6.647 5.292 5.110 5.463 . 0 0 "[ . 1 .]" 1
1786 1 46 ALA MB 1 49 ALA H 4.593 . 7.230 6.389 5.719 6.669 . 0 0 "[ . 1 .]" 1
1787 1 34 PRO HB3 1 39 GLY H 4.012 . 6.024 4.228 3.863 4.506 . 0 0 "[ . 1 .]" 1
1788 1 30 ASN QD 1 55 ASN QD 5.675 . 9.701 6.029 4.736 7.715 . 0 0 "[ . 1 .]" 1
1789 1 30 ASN QD 1 31 SER H 5.566 . 9.439 4.590 4.319 5.597 . 0 0 "[ . 1 .]" 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 44
_Distance_constraint_stats_list.Viol_count 134
_Distance_constraint_stats_list.Viol_total 73.386
_Distance_constraint_stats_list.Viol_max 0.143
_Distance_constraint_stats_list.Viol_rms 0.0200
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0074
_Distance_constraint_stats_list.Viol_average_violations_only 0.0365
_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 9 ARG 0.476 0.083 3 0 "[ . 1 .]"
1 10 GLN 0.059 0.019 2 0 "[ . 1 .]"
1 11 LYS 0.041 0.025 5 0 "[ . 1 .]"
1 12 VAL 0.627 0.103 14 0 "[ . 1 .]"
1 13 VAL 0.853 0.083 3 0 "[ . 1 .]"
1 14 SER 1.331 0.130 8 0 "[ . 1 .]"
1 15 ASP 0.132 0.042 1 0 "[ . 1 .]"
1 16 LEU 0.643 0.103 14 0 "[ . 1 .]"
1 17 VAL 0.772 0.143 11 0 "[ . 1 .]"
1 18 ALA 1.294 0.130 8 0 "[ . 1 .]"
1 19 LEU 0.126 0.042 1 0 "[ . 1 .]"
1 20 GLU 0.366 0.063 11 0 "[ . 1 .]"
1 21 GLY 0.464 0.143 11 0 "[ . 1 .]"
1 22 ALA 0.280 0.045 10 0 "[ . 1 .]"
1 23 LEU 0.035 0.023 4 0 "[ . 1 .]"
1 24 ASP 0.372 0.063 11 0 "[ . 1 .]"
1 25 MET 0.069 0.020 2 0 "[ . 1 .]"
1 26 TYR 0.706 0.070 10 0 "[ . 1 .]"
1 27 LYS 0.000 0.000 . 0 "[ . 1 .]"
1 28 LEU 0.021 0.016 14 0 "[ . 1 .]"
1 29 ASP 0.000 0.000 . 0 "[ . 1 .]"
1 30 ASN 0.448 0.070 10 0 "[ . 1 .]"
1 75 GLN 0.167 0.085 10 0 "[ . 1 .]"
1 77 LEU 0.169 0.040 2 0 "[ . 1 .]"
1 86 ASP 0.169 0.040 2 0 "[ . 1 .]"
1 88 PHE 0.167 0.085 10 0 "[ . 1 .]"
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 9 ARG O 1 13 VAL H 1.900 . 2.250 1.849 1.760 1.984 . 0 0 "[ . 1 .]" 2
2 1 9 ARG O 1 13 VAL N 2.800 2.800 3.300 2.785 2.717 2.907 0.083 3 0 "[ . 1 .]" 2
3 1 10 GLN O 1 14 SER H 1.900 . 2.250 2.146 1.985 2.269 0.019 2 0 "[ . 1 .]" 2
4 1 10 GLN O 1 14 SER N 2.800 2.800 3.300 3.021 2.862 3.151 . 0 0 "[ . 1 .]" 2
5 1 11 LYS O 1 15 ASP H 1.900 . 2.250 2.187 1.880 2.275 0.025 5 0 "[ . 1 .]" 2
6 1 11 LYS O 1 15 ASP N 2.800 2.800 3.300 3.139 2.835 3.235 . 0 0 "[ . 1 .]" 2
7 1 12 VAL O 1 16 LEU H 1.900 . 2.250 1.872 1.792 2.001 . 0 0 "[ . 1 .]" 2
8 1 12 VAL O 1 16 LEU N 2.800 2.800 3.300 2.764 2.697 2.881 0.103 14 0 "[ . 1 .]" 2
9 1 13 VAL O 1 17 VAL H 1.900 . 2.250 1.837 1.780 1.941 . 0 0 "[ . 1 .]" 2
10 1 13 VAL O 1 17 VAL N 2.800 2.800 3.300 2.786 2.737 2.876 0.063 10 0 "[ . 1 .]" 2
11 1 14 SER O 1 18 ALA H 1.900 . 2.250 2.334 2.268 2.380 0.130 8 0 "[ . 1 .]" 2
12 1 14 SER O 1 18 ALA N 2.800 2.800 3.300 3.254 3.186 3.312 0.012 5 0 "[ . 1 .]" 2
13 1 15 ASP O 1 19 LEU H 1.900 . 2.250 1.972 1.856 2.153 . 0 0 "[ . 1 .]" 2
14 1 15 ASP O 1 19 LEU N 2.800 2.800 3.300 2.863 2.758 3.011 0.042 1 0 "[ . 1 .]" 2
15 1 16 LEU O 1 20 GLU H 1.900 . 2.250 2.003 1.821 2.165 . 0 0 "[ . 1 .]" 2
16 1 16 LEU O 1 20 GLU N 2.800 2.800 3.300 2.957 2.790 3.108 0.010 3 0 "[ . 1 .]" 2
17 1 17 VAL O 1 21 GLY H 1.900 . 2.250 1.902 1.795 2.045 . 0 0 "[ . 1 .]" 2
18 1 17 VAL O 1 21 GLY N 2.800 2.800 3.300 2.799 2.657 2.941 0.143 11 0 "[ . 1 .]" 2
19 1 18 ALA O 1 22 ALA H 1.900 . 2.250 1.999 1.858 2.249 . 0 0 "[ . 1 .]" 2
20 1 18 ALA O 1 22 ALA N 2.800 2.800 3.300 2.924 2.778 3.135 0.022 14 0 "[ . 1 .]" 2
21 1 19 LEU O 1 23 LEU H 1.900 . 2.250 1.993 1.801 2.145 . 0 0 "[ . 1 .]" 2
22 1 19 LEU O 1 23 LEU N 2.800 2.800 3.300 2.932 2.777 3.087 0.023 4 0 "[ . 1 .]" 2
23 1 20 GLU O 1 24 ASP H 1.900 . 2.250 1.911 1.776 2.303 0.053 7 0 "[ . 1 .]" 2
24 1 20 GLU O 1 24 ASP N 2.800 2.800 3.300 2.847 2.737 3.237 0.063 11 0 "[ . 1 .]" 2
25 1 21 GLY O 1 25 MET H 1.900 . 2.250 1.948 1.834 2.143 . 0 0 "[ . 1 .]" 2
26 1 21 GLY O 1 25 MET N 2.800 2.800 3.300 2.871 2.780 3.071 0.020 2 0 "[ . 1 .]" 2
27 1 22 ALA O 1 26 TYR H 1.900 . 2.250 1.884 1.817 1.989 . 0 0 "[ . 1 .]" 2
28 1 22 ALA O 1 26 TYR N 2.800 2.800 3.300 2.812 2.755 2.917 0.045 10 0 "[ . 1 .]" 2
29 1 23 LEU O 1 27 LYS H 1.900 . 2.250 1.996 1.874 2.210 . 0 0 "[ . 1 .]" 2
30 1 23 LEU O 1 27 LYS N 2.800 2.800 3.300 2.928 2.805 3.115 . 0 0 "[ . 1 .]" 2
31 1 24 ASP O 1 28 LEU H 1.900 . 2.250 2.029 1.892 2.216 . 0 0 "[ . 1 .]" 2
32 1 24 ASP O 1 28 LEU N 2.800 2.800 3.300 2.871 2.784 3.039 0.016 14 0 "[ . 1 .]" 2
33 1 25 MET O 1 29 ASP H 1.900 . 2.250 2.102 1.938 2.221 . 0 0 "[ . 1 .]" 2
34 1 25 MET O 1 29 ASP N 2.800 2.800 3.300 3.030 2.909 3.115 . 0 0 "[ . 1 .]" 2
35 1 26 TYR O 1 30 ASN H 1.900 . 2.250 1.840 1.777 1.925 . 0 0 "[ . 1 .]" 2
36 1 26 TYR O 1 30 ASN N 2.800 2.800 3.300 2.775 2.730 2.864 0.070 10 0 "[ . 1 .]" 2
37 1 75 GLN H 1 88 PHE O 1.900 . 2.250 2.090 1.836 2.273 0.023 14 0 "[ . 1 .]" 2
38 1 75 GLN N 1 88 PHE O 2.800 2.800 3.300 3.041 2.820 3.231 . 0 0 "[ . 1 .]" 2
39 1 75 GLN O 1 88 PHE H 1.900 . 2.250 2.126 1.821 2.335 0.085 10 0 "[ . 1 .]" 2
40 1 75 GLN O 1 88 PHE N 2.800 2.800 3.300 3.077 2.794 3.243 0.006 8 0 "[ . 1 .]" 2
41 1 77 LEU H 1 86 ASP O 1.900 . 2.250 1.922 1.827 2.077 . 0 0 "[ . 1 .]" 2
42 1 77 LEU N 1 86 ASP O 2.800 2.800 3.300 2.861 2.760 2.981 0.040 2 0 "[ . 1 .]" 2
43 1 77 LEU O 1 86 ASP H 1.900 . 2.250 2.181 1.981 2.274 0.024 12 0 "[ . 1 .]" 2
44 1 77 LEU O 1 86 ASP N 2.800 2.800 3.300 3.113 2.939 3.253 . 0 0 "[ . 1 .]" 2
stop_
save_
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