NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
574628 |
2mgs   |
19601 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mgs
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 1233
_Distance_constraint_stats_list.Viol_count 6106
_Distance_constraint_stats_list.Viol_total 50141.695
_Distance_constraint_stats_list.Viol_max 2.799
_Distance_constraint_stats_list.Viol_rms 0.2912
_Distance_constraint_stats_list.Viol_average_all_restraints 0.1017
_Distance_constraint_stats_list.Viol_average_violations_only 0.4106
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 LEU 6.039 0.303 18 0 "[ . 1 . 2]"
1 2 ARG 16.915 0.847 18 20 [*-***************+**]
1 3 GLU 24.961 0.847 18 20 [*-***************+**]
1 4 LEU 15.901 0.387 15 0 "[ . 1 . 2]"
1 5 ARG 19.363 0.584 11 20 [-*********+*********]
1 6 CYS 26.373 0.584 11 20 [-*********+*********]
1 7 VAL 2.546 0.128 14 0 "[ . 1 . 2]"
1 8 CYS 49.991 1.559 20 20 [********-**********+]
1 9 LEU 6.516 0.267 4 0 "[ . 1 . 2]"
1 10 GLN 77.663 1.930 1 20 [+***************-***]
1 11 THR 287.746 2.024 11 20 [**********+*****-***]
1 12 THR 41.067 0.865 12 20 [*********-*+********]
1 13 GLN 46.602 1.573 18 20 [*****-***********+**]
1 14 GLY 43.187 1.665 5 20 [****+**-************]
1 15 VAL 70.078 1.665 5 20 [****+***-***********]
1 16 HIS 45.986 1.177 5 20 [****+-**************]
1 17 PRO 16.276 1.493 8 9 "[ * ** + *- .** *]"
1 18 LYS 5.408 0.262 16 0 "[ . 1 . 2]"
1 19 MET 28.446 0.905 12 20 [********-**+********]
1 20 ILE 39.416 2.217 8 20 [*******+******-*****]
1 21 SER 46.498 1.402 9 19 "[********+***-*** ***]"
1 22 ASN 71.727 1.975 9 20 [********+*-*********]
1 23 LEU 30.208 0.911 4 19 "[*-*+** *************]"
1 24 GLN 39.360 1.060 2 17 "[*+ ***-* ******** **]"
1 25 VAL 30.240 1.057 7 11 "[** ** +*** * .* *]"
1 26 PHE 30.396 1.262 20 12 "[***** *-*** * +]"
1 27 ALA 38.590 1.299 20 14 "[*-*** ******* * +]"
1 28 ILE 125.421 2.746 20 20 [*-*****************+]
1 29 GLY 38.715 1.848 4 20 [***+***************-]
1 30 PRO 9.908 0.428 12 0 "[ . 1 . 2]"
1 31 GLN 55.346 1.848 4 20 [***+-***************]
1 32 CYS 33.475 1.537 20 20 [*-*****************+]
1 33 SER 5.555 0.606 10 2 "[ . + . - 2]"
1 34 LYS 11.450 0.687 17 3 "[ . *- . + 2]"
1 35 VAL 88.986 2.746 20 20 [************-******+]
1 36 GLU 51.932 2.409 20 20 [*-*****************+]
1 37 VAL 29.350 0.995 11 20 [****-*****+*********]
1 38 VAL 59.676 1.262 20 20 [***-***************+]
1 39 ALA 17.473 0.626 3 9 "[ *+*.** *- .** 2]"
1 40 SER 23.538 0.904 2 14 "[ + *****-1******* 2]"
1 41 LEU 50.449 1.124 9 20 [********+***-*******]
1 42 LYS 66.204 1.975 9 20 [******-*+***********]
1 43 ASN 11.251 0.330 8 0 "[ . 1 . 2]"
1 44 GLY 5.916 0.692 1 4 "[+ . - 1 *. * 2]"
1 45 LYS 3.093 0.681 7 1 "[ . + 1 . 2]"
1 46 GLU 15.528 0.962 18 19 "[* ****-**********+**]"
1 47 ILE 11.409 0.511 10 1 "[ . + . 2]"
1 48 CYS 118.382 0.906 8 20 [**-****+************]
1 49 LEU 86.904 2.024 11 20 [*********-+*********]
1 50 ASP 64.237 1.573 18 20 [************-****+**]
1 51 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 GLU 5.172 0.177 6 0 "[ . 1 . 2]"
1 53 ALA 4.029 0.117 1 0 "[ . 1 . 2]"
1 54 PRO 4.462 0.407 2 0 "[ . 1 . 2]"
1 55 PHE 20.177 1.304 8 17 "[ *****+-****** ****]"
1 56 LEU 51.622 2.254 15 20 [**************+****-]
1 57 LYS 6.641 0.407 2 0 "[ . 1 . 2]"
1 58 LYS 17.538 0.945 8 6 "[ * *- + 1 * * 2]"
1 59 VAL 134.650 2.254 15 20 [**********-***+*****]
1 60 ILE 64.426 1.369 15 20 [**************+****-]
1 61 GLN 30.961 1.369 15 20 [**************+****-]
1 62 LYS 13.186 0.945 8 7 "[ * *- + 1 * * *]"
1 63 ILE 10.056 0.726 15 2 "[ . 1 + -]"
1 64 LEU 20.707 1.428 1 7 "[+** . * 1 ** - 2]"
1 65 ASP 17.774 0.791 15 7 "[ ** . * 1 +* - *]"
1 66 GLY 4.636 0.726 15 2 "[ . 1 + -]"
1 67 GLY 5.882 0.994 15 1 "[ . 1 + 2]"
1 68 ASN 6.638 1.428 1 4 "[+- . * 1 . * 2]"
1 69 LYS 1.908 0.117 9 0 "[ . 1 . 2]"
1 70 GLU 1.800 0.126 4 0 "[ . 1 . 2]"
2 1 LEU 6.037 0.303 10 0 "[ . 1 . 2]"
2 2 ARG 16.906 0.847 8 20 [*******+-***********]
2 3 GLU 17.346 0.847 8 20 [*******+-***********]
2 4 LEU 0.554 0.029 7 0 "[ . 1 . 2]"
2 5 ARG 0.141 0.141 12 0 "[ . 1 . 2]"
2 6 CYS 7.183 0.245 9 0 "[ . 1 . 2]"
2 7 VAL 2.533 0.129 12 0 "[ . 1 . 2]"
2 8 CYS 42.110 1.559 8 20 [-******+************]
2 9 LEU 1.185 0.060 6 0 "[ . 1 . 2]"
2 10 GLN 58.652 1.929 14 20 [***-*********+******]
2 11 THR 213.209 2.024 10 20 [***-*****+**********]
2 12 THR 27.927 0.866 1 20 [+******************-]
2 13 GLN 5.450 0.274 19 0 "[ . 1 . 2]"
2 14 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 15 VAL 18.271 1.485 13 17 "[*** *****1**+**- ***]"
2 16 HIS 40.012 1.047 7 20 [****-*+*************]
2 17 PRO 16.425 1.565 13 10 "[ -* .** *1* +*. **2]"
2 18 LYS 5.377 0.263 18 0 "[ . 1 . 2]"
2 19 MET 29.321 1.152 6 20 [*****+****-*********]
2 20 ILE 10.091 0.543 6 2 "[ .+ 1 - . 2]"
2 21 SER 28.691 1.159 8 18 "[***** +********-***]"
2 22 ASN 63.103 1.861 8 20 [*******+****-*******]
2 23 LEU 29.909 0.855 16 20 [************-**+****]
2 24 GLN 22.145 1.022 14 17 "[******** *-* +** ***]"
2 25 VAL 20.983 1.082 8 9 "[ *.* +***- . **]"
2 26 PHE 33.586 1.222 17 17 "[*******-**** ** +**2]"
2 27 ALA 42.335 1.378 12 15 "[****** ** + ** -***]"
2 28 ILE 151.638 2.799 12 20 [***********+*****-**]
2 29 GLY 37.932 1.815 11 20 [**********+**-******]
2 30 PRO 9.608 0.443 19 0 "[ . 1 . 2]"
2 31 GLN 55.107 1.815 11 20 [********-*+*********]
2 32 CYS 33.965 1.230 12 20 [***********+*****-**]
2 33 SER 6.124 0.576 12 5 "[ . - 1 + ** *2]"
2 34 LYS 14.390 1.372 12 6 "[ . -* 1 + ** *2]"
2 35 VAL 113.574 2.799 12 20 [***********+****-***]
2 36 GLU 52.853 2.369 12 20 [*****-*****+********]
2 37 VAL 29.227 0.933 1 20 [+******-************]
2 38 VAL 53.741 1.222 17 20 [*******-********+***]
2 39 ALA 10.776 0.852 8 4 "[ .- +*1 *. 2]"
2 40 SER 23.610 0.831 7 17 "[***-**+* *** **** **]"
2 41 LEU 39.234 0.912 9 20 [********+**-********]
2 42 LYS 63.738 1.861 8 20 [*******+*-**********]
2 43 ASN 11.260 0.329 13 0 "[ . 1 . 2]"
2 44 GLY 6.919 0.673 19 4 "[ . - * *. +2]"
2 45 LYS 3.199 0.496 16 0 "[ . 1 . 2]"
2 46 GLU 15.180 0.912 9 20 [***-****+***********]
2 47 ILE 11.285 0.535 6 1 "[ .+ 1 . 2]"
2 48 CYS 72.741 0.898 7 20 [*****-+*************]
2 49 LEU 50.883 2.024 10 20 [******-**+**********]
2 50 ASP 28.070 1.399 3 20 [**+*****-***********]
2 51 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
2 52 GLU 5.132 0.188 15 0 "[ . 1 . 2]"
2 53 ALA 3.778 0.117 5 0 "[ . 1 . 2]"
2 54 PRO 4.431 0.396 8 0 "[ . 1 . 2]"
2 55 PHE 20.385 1.485 13 17 "[*** *****1**+**- ***]"
2 56 LEU 51.233 2.413 12 20 [***********+****-***]
2 57 LYS 6.880 0.396 8 0 "[ . 1 . 2]"
2 58 LYS 17.318 1.093 13 4 "[ * .* 1 +-. 2]"
2 59 VAL 112.547 2.413 12 20 [*-*********+********]
2 60 ILE 64.511 1.365 17 20 [*-**************+***]
2 61 GLN 31.599 1.365 17 20 [*-**************+***]
2 62 LYS 12.234 1.093 13 7 "[ *-.* 1 +*. * *2]"
2 63 ILE 9.445 0.578 10 1 "[ . + . 2]"
2 64 LEU 19.885 0.791 20 8 "[ - .* *1 * * ** +]"
2 65 ASP 15.256 0.922 2 10 "[ +*-.* *1 * * ***2]"
2 66 GLY 3.967 0.578 10 1 "[ . + . 2]"
2 67 GLY 5.877 0.670 9 2 "[ . +1 . - 2]"
2 68 ASN 5.865 0.922 2 4 "[ +- .* 1 . *]"
2 69 LYS 1.891 0.117 7 0 "[ . 1 . 2]"
2 70 GLU 1.612 0.108 3 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 LEU HA 1 1 LEU HB3 2.500 . 2.700 3.002 3.001 3.003 0.303 18 0 "[ . 1 . 2]" 1
2 1 1 LEU HA 1 1 LEU HB2 4.000 2.200 5.000 2.572 2.570 2.573 . 0 0 "[ . 1 . 2]" 1
3 1 2 ARG HA 1 3 GLU H 2.500 . 2.700 3.546 3.544 3.547 0.847 18 20 [*-***************+**] 1
4 1 2 ARG H 1 2 ARG HB2 4.000 2.200 5.000 3.890 3.889 3.891 . 0 0 "[ . 1 . 2]" 1
5 1 2 ARG H 1 2 ARG HB3 3.000 . 3.500 3.337 3.336 3.338 . 0 0 "[ . 1 . 2]" 1
6 1 2 ARG H 1 2 ARG QD 3.000 . 4.500 4.410 4.409 4.410 . 0 0 "[ . 1 . 2]" 1
7 1 2 ARG HA 1 2 ARG HB2 3.000 . 3.300 2.476 2.475 2.478 . 0 0 "[ . 1 . 2]" 1
8 1 2 ARG HA 1 2 ARG HB3 4.000 2.200 5.000 2.393 2.391 2.395 . 0 0 "[ . 1 . 2]" 1
9 1 3 GLU HA 1 4 LEU H 2.500 . 2.700 2.072 2.070 2.074 . 0 0 "[ . 1 . 2]" 1
10 1 3 GLU H 1 3 GLU HA 4.000 2.200 5.000 2.903 2.902 2.904 . 0 0 "[ . 1 . 2]" 1
11 1 3 GLU H 1 3 GLU QB . 2.200 2.770 2.791 2.790 2.792 0.022 18 0 "[ . 1 . 2]" 1
12 1 3 GLU HA 1 3 GLU QB 2.500 2.200 2.700 2.394 2.392 2.395 . 0 0 "[ . 1 . 2]" 1
13 1 4 LEU HA 1 5 ARG H 2.500 . 2.560 2.147 2.145 2.148 . 0 0 "[ . 1 . 2]" 1
14 1 4 LEU H 1 4 LEU HA . 2.200 2.930 2.958 2.957 2.959 0.029 13 0 "[ . 1 . 2]" 1
15 1 4 LEU H 1 4 LEU HB2 2.500 . 2.900 2.613 2.611 2.615 . 0 0 "[ . 1 . 2]" 1
16 1 4 LEU H 1 4 LEU HB3 4.000 2.200 5.000 3.767 3.765 3.769 . 0 0 "[ . 1 . 2]" 1
17 1 4 LEU HA 1 4 LEU HB2 4.000 2.200 5.000 3.029 3.027 3.030 . 0 0 "[ . 1 . 2]" 1
18 1 4 LEU HA 1 4 LEU HB3 2.500 . 2.700 2.494 2.490 2.495 . 0 0 "[ . 1 . 2]" 1
19 1 4 LEU HG 1 31 GLN QB 4.000 2.300 6.000 4.520 4.293 4.739 . 0 0 "[ . 1 . 2]" 1
20 1 5 ARG HA 1 6 CYS H 2.500 . 2.700 2.243 2.242 2.244 . 0 0 "[ . 1 . 2]" 1
21 1 5 ARG HA 1 31 GLN HA 4.800 3.100 5.800 5.268 4.733 5.768 . 0 0 "[ . 1 . 2]" 1
22 1 5 ARG HA 1 31 GLN QB 4.000 3.000 4.660 4.247 3.931 4.602 . 0 0 "[ . 1 . 2]" 1
23 1 5 ARG H 1 5 ARG QB . 2.200 3.270 2.632 2.631 2.633 . 0 0 "[ . 1 . 2]" 1
24 1 5 ARG H 1 5 ARG QD 3.000 . 4.500 3.109 3.108 3.110 . 0 0 "[ . 1 . 2]" 1
25 1 5 ARG HA 1 5 ARG QB 3.000 2.200 3.020 2.304 2.303 2.305 . 0 0 "[ . 1 . 2]" 1
26 1 6 CYS HA 1 7 VAL H 2.500 . 2.700 2.288 2.287 2.290 . 0 0 "[ . 1 . 2]" 1
27 1 6 CYS HB3 1 7 VAL H 3.000 . 3.300 2.819 2.816 2.822 . 0 0 "[ . 1 . 2]" 1
28 1 6 CYS HB2 1 7 VAL H 4.000 2.800 4.420 4.021 4.020 4.023 . 0 0 "[ . 1 . 2]" 1
29 1 6 CYS HA 1 8 CYS H 4.000 2.200 4.010 4.032 4.030 4.034 0.024 13 0 "[ . 1 . 2]" 1
30 1 6 CYS HB3 1 8 CYS H 3.000 2.300 3.020 2.487 2.486 2.489 . 0 0 "[ . 1 . 2]" 1
31 1 6 CYS HB3 1 32 CYS QB 4.000 3.500 6.000 3.355 3.217 3.490 0.283 10 0 "[ . 1 . 2]" 1
32 1 6 CYS HB2 1 32 CYS QB 4.000 3.500 24.000 4.275 4.137 4.398 . 0 0 "[ . 1 . 2]" 1
33 1 6 CYS HA 1 32 CYS QB 2.500 2.200 2.700 2.108 1.949 2.260 0.251 10 0 "[ . 1 . 2]" 1
34 1 6 CYS H 1 6 CYS HB3 . 2.200 3.480 3.567 3.565 3.568 0.088 16 0 "[ . 1 . 2]" 1
35 1 6 CYS H 1 6 CYS HB2 2.500 . 2.900 2.352 2.351 2.354 . 0 0 "[ . 1 . 2]" 1
36 1 6 CYS HA 1 6 CYS HB3 2.500 . 2.700 2.582 2.580 2.583 . 0 0 "[ . 1 . 2]" 1
37 1 6 CYS HA 1 6 CYS HB2 4.000 2.200 5.000 3.017 3.016 3.019 . 0 0 "[ . 1 . 2]" 1
38 1 7 VAL HA 1 8 CYS H . 2.200 3.300 3.427 3.426 3.428 0.128 14 0 "[ . 1 . 2]" 1
39 1 7 VAL H 1 8 CYS H 2.500 . 2.650 2.631 2.629 2.633 . 0 0 "[ . 1 . 2]" 1
40 1 7 VAL MG1 1 38 VAL MG2 4.000 2.300 6.500 3.918 3.541 4.255 . 0 0 "[ . 1 . 2]" 1
41 1 8 CYS HA 1 9 LEU H 2.500 . 2.700 2.155 2.154 2.156 . 0 0 "[ . 1 . 2]" 1
42 1 8 CYS QB 1 9 LEU H . 2.200 3.890 3.602 3.601 3.604 . 0 0 "[ . 1 . 2]" 1
43 1 8 CYS HA 1 10 GLN H . 2.200 3.580 3.535 3.534 3.536 . 0 0 "[ . 1 . 2]" 1
44 1 8 CYS QB 1 10 GLN H 4.000 2.200 5.000 3.725 3.724 3.726 . 0 0 "[ . 1 . 2]" 1
45 1 8 CYS QB 1 48 CYS QB 4.000 2.800 5.000 2.401 2.400 2.402 0.400 2 0 "[ . 1 . 2]" 1
46 1 8 CYS H 1 8 CYS HA 3.000 . 3.500 2.954 2.953 2.956 . 0 0 "[ . 1 . 2]" 1
47 1 8 CYS H 1 8 CYS QB 2.500 2.200 2.740 2.421 2.419 2.422 . 0 0 "[ . 1 . 2]" 1
48 1 8 CYS QB 1 37 VAL MG2 4.000 2.300 6.500 6.031 5.725 6.638 0.138 10 0 "[ . 1 . 2]" 1
49 1 8 CYS HA 1 8 CYS QB . 2.200 2.700 2.427 2.426 2.428 . 0 0 "[ . 1 . 2]" 1
50 1 9 LEU HA 1 10 GLN H . 2.200 3.480 3.445 3.443 3.446 . 0 0 "[ . 1 . 2]" 1
51 1 9 LEU H 1 10 GLN H 2.500 . 2.650 2.423 2.421 2.424 . 0 0 "[ . 1 . 2]" 1
52 1 9 LEU H 1 9 LEU HA . 2.200 2.830 2.890 2.889 2.891 0.061 6 0 "[ . 1 . 2]" 1
53 1 10 GLN HA 1 11 THR H 2.500 . 2.700 2.539 2.537 2.540 . 0 0 "[ . 1 . 2]" 1
54 1 10 GLN H 1 11 THR H 4.000 2.200 4.690 4.376 4.375 4.377 . 0 0 "[ . 1 . 2]" 1
55 1 10 GLN QB 1 11 THR H 3.000 . 4.300 2.080 2.078 2.081 . 0 0 "[ . 1 . 2]" 1
56 1 10 GLN H 1 11 THR HA 4.000 2.200 5.000 5.023 5.021 5.024 0.024 8 0 "[ . 1 . 2]" 1
57 1 10 GLN H 1 11 THR HB 2.500 . 3.900 5.829 5.828 5.830 1.930 1 20 [+***********-*******] 1
58 1 10 GLN HA 1 11 THR HB 2.500 . 3.700 4.214 4.213 4.215 0.515 20 20 [****************-**+] 1
59 1 10 GLN QG 1 48 CYS QB 2.500 . 3.900 3.126 3.125 3.128 . 0 0 "[ . 1 . 2]" 1
60 1 10 GLN QG 1 48 CYS H 2.500 . 3.700 4.170 4.169 4.172 0.472 8 0 "[ . 1 . 2]" 1
61 1 11 THR HA 1 12 THR H . . 2.520 2.658 2.657 2.659 0.139 15 0 "[ . 1 . 2]" 1
62 1 11 THR H 1 12 THR H 4.000 2.200 5.000 4.335 4.333 4.336 . 0 0 "[ . 1 . 2]" 1
63 1 11 THR HB 1 12 THR H . . 2.680 3.544 3.542 3.545 0.865 12 20 [******-****+********] 1
64 1 8 CYS QB 1 11 THR MG 4.000 3.000 4.640 6.199 6.198 6.199 1.559 20 20 [********-**********+] 1
65 1 10 GLN HA 1 11 THR MG 4.000 3.000 6.400 3.697 3.695 3.698 . 0 0 "[ . 1 . 2]" 1
66 1 11 THR MG 1 12 THR H 4.000 2.300 4.640 2.901 2.900 2.902 . 0 0 "[ . 1 . 2]" 1
67 1 11 THR HB 1 50 ASP QB . 2.200 3.670 3.074 2.853 3.314 . 0 0 "[ . 1 . 2]" 1
68 1 11 THR HB 1 50 ASP H 3.000 . 3.500 4.829 4.782 4.880 1.380 3 20 [**+*********-*******] 1
69 1 11 THR MG 1 50 ASP H 3.000 . 4.800 4.857 4.824 4.896 0.096 3 0 "[ . 1 . 2]" 1
70 1 11 THR MG 1 48 CYS HA 4.000 . 6.530 7.427 7.426 7.428 0.898 8 20 [*******+*********-**] 1
71 1 11 THR MG 1 48 CYS QB 3.000 2.300 4.390 5.221 5.220 5.221 0.831 15 20 [-*************+*****] 1
72 1 11 THR HA 1 49 LEU HA 3.000 . 4.800 3.901 3.900 3.902 . 0 0 "[ . 1 . 2]" 1
73 1 11 THR MG 1 49 LEU HA 3.000 2.300 4.800 5.280 5.280 5.281 0.481 8 0 "[ . 1 . 2]" 1
74 1 11 THR H 1 11 THR HA 4.000 2.200 5.000 2.946 2.945 2.947 . 0 0 "[ . 1 . 2]" 1
75 1 11 THR H 1 11 THR HB 4.000 2.200 5.000 3.110 3.108 3.111 . 0 0 "[ . 1 . 2]" 1
76 1 11 THR HA 1 11 THR HB 2.500 . 2.650 2.426 2.425 2.428 . 0 0 "[ . 1 . 2]" 1
77 1 12 THR HA 1 13 GLN H 3.000 . 3.080 2.193 2.192 2.195 . 0 0 "[ . 1 . 2]" 1
78 1 12 THR HB 1 13 GLN H 4.000 2.300 4.080 3.799 3.797 3.799 . 0 0 "[ . 1 . 2]" 1
79 1 12 THR HB 1 13 GLN HA 4.000 3.000 6.000 4.732 4.731 4.734 . 0 0 "[ . 1 . 2]" 1
80 1 12 THR H 1 48 CYS H 4.000 2.200 5.000 5.391 5.390 5.392 0.392 8 0 "[ . 1 . 2]" 1
81 1 12 THR HG1 1 47 ILE MD 4.000 2.300 6.500 4.073 4.049 4.092 . 0 0 "[ . 1 . 2]" 1
82 1 12 THR H 1 12 THR HA 4.000 2.200 5.000 2.881 2.880 2.883 . 0 0 "[ . 1 . 2]" 1
83 1 12 THR H 1 12 THR HB 2.500 . 3.710 2.956 2.954 2.957 . 0 0 "[ . 1 . 2]" 1
84 1 12 THR HA 1 12 THR HB 2.500 . 3.700 3.028 3.026 3.029 . 0 0 "[ . 1 . 2]" 1
85 1 13 GLN HA 1 14 GLY H 3.000 . 3.420 2.328 2.327 2.330 . 0 0 "[ . 1 . 2]" 1
86 1 13 GLN H 1 14 GLY H 3.000 . 3.500 3.337 3.336 3.338 . 0 0 "[ . 1 . 2]" 1
87 1 13 GLN QB 1 14 GLY H 4.000 2.300 6.000 3.899 3.898 3.900 . 0 0 "[ . 1 . 2]" 1
88 1 13 GLN H 1 13 GLN HA 4.000 2.200 5.000 2.917 2.913 2.919 . 0 0 "[ . 1 . 2]" 1
89 1 13 GLN H 1 13 GLN QB . . 2.770 3.042 3.041 3.043 0.273 2 0 "[ . 1 . 2]" 1
90 1 13 GLN HA 1 13 GLN QB 2.500 . 2.700 2.155 2.152 2.156 . 0 0 "[ . 1 . 2]" 1
91 1 15 VAL HA 1 16 HIS H 2.500 . 2.700 2.739 2.737 2.740 0.040 11 0 "[ . 1 . 2]" 1
92 1 15 VAL H 1 15 VAL HA 3.000 . 3.500 2.459 2.457 2.460 . 0 0 "[ . 1 . 2]" 1
93 1 16 HIS HA 1 17 PRO QD 2.500 . 2.700 1.971 1.970 1.972 . 0 0 "[ . 1 . 2]" 1
94 1 16 HIS H 1 17 PRO QD 4.000 2.300 7.000 4.326 4.325 4.327 . 0 0 "[ . 1 . 2]" 1
95 1 16 HIS H 1 19 MET H 4.000 2.800 6.000 4.378 4.374 4.406 . 0 0 "[ . 1 . 2]" 1
96 1 16 HIS HD2 1 17 PRO QD 4.000 2.200 5.000 3.380 3.378 3.382 . 0 0 "[ . 1 . 2]" 1
97 1 16 HIS HD2 1 18 LYS HB2 4.000 2.300 6.000 4.881 4.880 4.883 . 0 0 "[ . 1 . 2]" 1
98 1 16 HIS HE1 1 17 PRO QD 4.000 2.200 5.000 3.359 3.358 3.361 . 0 0 "[ . 1 . 2]" 1
99 1 16 HIS HE1 1 17 PRO HG2 4.000 2.200 5.000 4.203 4.203 4.205 . 0 0 "[ . 1 . 2]" 1
100 1 16 HIS HE1 1 18 LYS HB2 3.000 . 3.300 3.154 3.152 3.156 . 0 0 "[ . 1 . 2]" 1
101 1 16 HIS HE1 1 18 LYS HB3 4.000 3.000 6.000 4.899 4.898 4.901 . 0 0 "[ . 1 . 2]" 1
102 1 16 HIS HE1 1 18 LYS H 3.000 . 3.300 3.295 3.293 3.297 . 0 0 "[ . 1 . 2]" 1
103 1 16 HIS HE1 1 18 LYS HA 4.000 2.200 5.000 4.117 4.116 4.119 . 0 0 "[ . 1 . 2]" 1
104 1 16 HIS HE1 1 18 LYS QD 4.000 2.300 6.000 3.949 3.948 3.950 . 0 0 "[ . 1 . 2]" 1
105 1 16 HIS HE1 1 18 LYS QE 4.000 3.000 7.000 5.525 5.524 5.526 . 0 0 "[ . 1 . 2]" 1
106 1 16 HIS HA 1 17 PRO QG 4.000 2.300 6.000 3.899 3.898 3.900 . 0 0 "[ . 1 . 2]" 1
107 1 16 HIS HA 1 59 VAL HB 3.000 . 3.300 4.140 3.773 4.477 1.177 5 19 "[****+-********* ****]" 1
108 1 16 HIS HA 1 59 VAL QG 4.000 2.300 7.500 2.970 2.834 3.105 . 0 0 "[ . 1 . 2]" 1
109 1 16 HIS H 1 16 HIS QB 2.500 . 2.900 2.481 2.480 2.482 . 0 0 "[ . 1 . 2]" 1
110 1 16 HIS HA 1 16 HIS QB 2.500 2.200 2.700 2.407 2.406 2.409 . 0 0 "[ . 1 . 2]" 1
111 1 16 HIS HA 1 16 HIS HD2 3.000 . 3.300 3.477 3.476 3.479 0.179 12 0 "[ . 1 . 2]" 1
112 1 16 HIS QB 1 16 HIS HD2 . 2.800 3.300 2.590 2.589 2.591 0.211 9 0 "[ . 1 . 2]" 1
113 1 17 PRO HA 1 18 LYS H 4.000 2.200 5.000 3.488 3.487 3.489 . 0 0 "[ . 1 . 2]" 1
114 1 17 PRO HA 1 19 MET H 4.000 2.200 5.000 3.853 3.829 3.884 . 0 0 "[ . 1 . 2]" 1
115 1 17 PRO HA 1 20 ILE H 4.000 2.200 5.000 3.077 3.044 3.173 . 0 0 "[ . 1 . 2]" 1
116 1 17 PRO HA 1 20 ILE QG 3.000 . 4.300 2.351 2.099 2.583 . 0 0 "[ . 1 . 2]" 1
117 1 17 PRO HA 1 59 VAL HB 4.000 2.200 5.000 3.825 3.379 4.592 . 0 0 "[ . 1 . 2]" 1
118 1 17 PRO HA 1 59 VAL QG 4.000 2.300 4.260 4.255 3.960 4.713 0.453 8 0 "[ . 1 . 2]" 1
119 1 17 PRO QD 1 59 VAL QG 4.000 2.300 6.500 2.206 2.003 2.635 0.297 1 0 "[ . 1 . 2]" 1
120 1 18 LYS HA 1 19 MET H . 2.200 3.480 3.489 3.483 3.519 0.039 1 0 "[ . 1 . 2]" 1
121 1 18 LYS H 1 19 MET H 3.000 . 3.500 2.808 2.797 2.853 . 0 0 "[ . 1 . 2]" 1
122 1 18 LYS H 1 18 LYS HA 4.000 2.200 5.000 2.749 2.748 2.750 . 0 0 "[ . 1 . 2]" 1
123 1 18 LYS HA 1 18 LYS HB3 2.500 . 2.700 2.961 2.960 2.962 0.262 16 0 "[ . 1 . 2]" 1
124 1 18 LYS HA 1 18 LYS HB2 3.000 . 3.300 2.699 2.697 2.699 . 0 0 "[ . 1 . 2]" 1
125 1 19 MET HA 1 20 ILE H 4.000 2.200 5.000 3.419 3.407 3.441 . 0 0 "[ . 1 . 2]" 1
126 1 19 MET QB 1 20 ILE H 4.000 2.200 4.140 3.104 3.024 3.171 . 0 0 "[ . 1 . 2]" 1
127 1 16 HIS H 1 19 MET QB 3.000 . 3.300 4.142 3.904 4.205 0.905 12 20 [********-**+********] 1
128 1 16 HIS QB 1 19 MET QB 4.000 2.200 5.000 4.629 4.293 4.691 . 0 0 "[ . 1 . 2]" 1
129 1 18 LYS QD 1 19 MET H 4.000 2.300 6.000 5.424 5.416 5.473 . 0 0 "[ . 1 . 2]" 1
130 1 19 MET HA 1 42 LYS H 4.000 2.200 4.070 4.225 3.685 4.908 0.838 2 3 "[ + .* 1 - 2]" 1
131 1 19 MET QB 1 42 LYS H 4.000 2.800 4.260 4.398 3.920 5.016 0.756 6 3 "[ * .+ 1 - 2]" 1
132 1 19 MET H 1 19 MET QB . 2.200 2.900 2.347 2.144 2.399 0.056 9 0 "[ . 1 . 2]" 1
133 1 20 ILE HA 1 21 SER H . . 2.400 2.245 2.188 2.291 . 0 0 "[ . 1 . 2]" 1
134 1 20 ILE HB 1 21 SER H 4.000 2.200 5.000 3.839 3.667 4.026 . 0 0 "[ . 1 . 2]" 1
135 1 20 ILE HA 1 22 ASN H 3.000 . 3.500 3.725 3.597 4.066 0.566 3 1 "[ + . 1 . 2]" 1
136 1 17 PRO HA 1 20 ILE MG 4.000 . 4.360 4.068 3.905 4.215 . 0 0 "[ . 1 . 2]" 1
137 1 20 ILE MG 1 23 LEU HB2 4.000 2.200 5.000 3.599 3.207 4.119 . 0 0 "[ . 1 . 2]" 1
138 1 20 ILE MG 1 23 LEU HG 4.000 2.300 6.500 5.684 5.093 6.162 . 0 0 "[ . 1 . 2]" 1
139 1 19 MET QB 1 20 ILE MD 3.000 2.300 4.800 3.097 2.865 3.220 . 0 0 "[ . 1 . 2]" 1
140 1 20 ILE HA 1 41 LEU HA . . 2.460 2.565 2.223 2.839 0.379 15 0 "[ . 1 . 2]" 1
141 1 20 ILE HA 1 40 SER H 4.000 2.200 5.000 4.948 4.395 5.554 0.554 2 1 "[ + . 1 . 2]" 1
142 1 20 ILE HA 1 42 LYS H 4.000 2.200 5.000 4.200 3.752 4.591 . 0 0 "[ . 1 . 2]" 1
143 1 20 ILE MG 1 40 SER H 4.000 2.300 6.500 3.278 2.741 3.702 . 0 0 "[ . 1 . 2]" 1
144 1 20 ILE MG 1 39 ALA HA 4.000 2.300 6.500 3.865 3.399 4.194 . 0 0 "[ . 1 . 2]" 1
145 1 20 ILE MG 1 41 LEU HA 4.000 2.300 6.500 3.914 3.652 4.305 . 0 0 "[ . 1 . 2]" 1
146 1 20 ILE MG 1 41 LEU QD 4.000 2.300 8.000 4.010 3.738 4.229 . 0 0 "[ . 1 . 2]" 1
147 1 20 ILE MD 1 40 SER H 4.000 2.300 7.500 4.235 3.797 4.815 . 0 0 "[ . 1 . 2]" 1
148 1 20 ILE H 1 20 ILE HA 2.500 . 2.800 2.913 2.889 2.936 0.136 2 0 "[ . 1 . 2]" 1
149 1 20 ILE H 1 20 ILE HB 2.500 . 2.740 2.646 2.563 2.739 . 0 0 "[ . 1 . 2]" 1
150 1 20 ILE HA 1 20 ILE HB 4.000 2.200 5.000 3.018 3.009 3.022 . 0 0 "[ . 1 . 2]" 1
151 1 20 ILE HA 1 20 ILE QG 3.000 . 3.520 3.052 3.022 3.100 . 0 0 "[ . 1 . 2]" 1
152 1 20 ILE HA 1 20 ILE MG 2.500 . 4.200 2.319 2.277 2.358 . 0 0 "[ . 1 . 2]" 1
153 1 20 ILE HA 1 20 ILE MD 2.500 . 4.200 2.179 2.084 2.278 . 0 0 "[ . 1 . 2]" 1
154 1 20 ILE HB 1 20 ILE MD 4.000 2.300 6.500 3.241 3.235 3.246 . 0 0 "[ . 1 . 2]" 1
155 1 21 SER HA 1 22 ASN H . 2.200 3.450 3.312 2.973 3.551 0.101 3 0 "[ . 1 . 2]" 1
156 1 21 SER H 1 22 ASN H 2.500 . 2.560 1.778 1.599 2.107 0.201 12 0 "[ . 1 . 2]" 1
157 1 21 SER QB 1 22 ASN H 3.000 2.200 3.830 3.257 2.446 3.779 . 0 0 "[ . 1 . 2]" 1
158 1 21 SER H 1 42 LYS H . 2.200 3.860 4.612 4.350 5.262 1.402 9 19 "[******-*+******* ***]" 1
159 1 21 SER H 1 21 SER HA 2.500 . 2.700 2.922 2.901 2.938 0.238 20 0 "[ . 1 . 2]" 1
160 1 21 SER H 1 21 SER QB . 2.200 2.930 2.723 2.637 2.783 . 0 0 "[ . 1 . 2]" 1
161 1 21 SER HA 1 21 SER QB 2.500 2.200 2.700 2.384 2.343 2.429 . 0 0 "[ . 1 . 2]" 1
162 1 22 ASN HA 1 23 LEU H . . 2.460 2.191 2.159 2.297 . 0 0 "[ . 1 . 2]" 1
163 1 22 ASN H 1 23 LEU H 4.000 2.200 5.000 4.257 4.065 4.451 . 0 0 "[ . 1 . 2]" 1
164 1 22 ASN QB 1 23 LEU H . 2.200 3.060 3.676 3.488 3.798 0.738 1 19 "[+***** **********-**]" 1
165 1 22 ASN H 1 40 SER H . . 2.870 3.449 3.119 3.774 0.904 2 14 "[ + *****-1******* 2]" 1
166 1 22 ASN H 1 42 LYS H 4.000 2.200 5.000 6.085 5.603 6.975 1.975 9 20 [*****-**+***********] 1
167 1 22 ASN H 1 22 ASN HA 4.000 2.200 5.000 2.913 2.852 2.954 . 0 0 "[ . 1 . 2]" 1
168 1 22 ASN H 1 22 ASN QB . 2.200 3.800 2.689 2.414 2.871 . 0 0 "[ . 1 . 2]" 1
169 1 22 ASN HA 1 22 ASN QB 2.500 2.200 2.700 2.340 2.288 2.383 . 0 0 "[ . 1 . 2]" 1
170 1 23 LEU HA 1 24 GLN H 2.500 . 2.700 2.219 2.132 2.298 . 0 0 "[ . 1 . 2]" 1
171 1 23 LEU HB3 1 24 GLN H 4.000 2.200 5.000 4.012 3.788 4.349 . 0 0 "[ . 1 . 2]" 1
172 1 23 LEU HA 1 39 ALA HA 2.500 . 2.700 2.618 2.340 3.220 0.520 2 1 "[ + . 1 . 2]" 1
173 1 23 LEU HA 1 40 SER H 4.000 2.200 5.000 3.826 3.389 4.366 . 0 0 "[ . 1 . 2]" 1
174 1 23 LEU H 1 23 LEU HA 2.500 . 2.900 2.941 2.894 2.949 0.049 1 0 "[ . 1 . 2]" 1
175 1 23 LEU H 1 23 LEU HB3 3.000 . 3.500 2.659 2.511 2.986 . 0 0 "[ . 1 . 2]" 1
176 1 23 LEU H 1 23 LEU HB2 2.500 . 2.900 3.093 2.957 3.293 0.393 7 0 "[ . 1 . 2]" 1
177 1 23 LEU HA 1 23 LEU HB2 3.000 . 3.300 2.455 2.399 2.508 . 0 0 "[ . 1 . 2]" 1
178 1 24 GLN HA 1 25 VAL H . . 2.460 2.153 2.121 2.206 . 0 0 "[ . 1 . 2]" 1
179 1 24 GLN HB3 1 25 VAL H 4.000 2.200 5.000 3.485 3.061 3.881 . 0 0 "[ . 1 . 2]" 1
180 1 24 GLN HB2 1 25 VAL H 4.000 2.200 5.000 4.331 4.120 4.488 . 0 0 "[ . 1 . 2]" 1
181 1 23 LEU MD1 1 24 GLN HA 4.000 2.300 6.500 4.697 4.387 5.264 . 0 0 "[ . 1 . 2]" 1
182 1 24 GLN HA 1 25 VAL HB 4.000 2.200 5.000 4.762 4.662 4.845 . 0 0 "[ . 1 . 2]" 1
183 1 24 GLN HA 1 25 VAL MG2 4.000 2.300 6.500 3.520 3.363 3.777 . 0 0 "[ . 1 . 2]" 1
184 1 24 GLN H 1 38 VAL H . 2.200 3.270 3.896 3.204 4.330 1.060 2 15 "[*+ *** ******** *-]" 1
185 1 24 GLN H 1 24 GLN HA . . 2.900 2.935 2.919 2.949 0.049 8 0 "[ . 1 . 2]" 1
186 1 24 GLN H 1 24 GLN HB3 4.000 2.200 5.000 3.792 3.714 3.853 . 0 0 "[ . 1 . 2]" 1
187 1 24 GLN H 1 24 GLN HB2 2.500 . 2.900 2.686 2.537 2.780 . 0 0 "[ . 1 . 2]" 1
188 1 24 GLN HA 1 24 GLN HB3 3.000 . 3.300 2.519 2.388 2.586 . 0 0 "[ . 1 . 2]" 1
189 1 24 GLN HA 1 24 GLN HB2 2.500 . 2.700 3.017 3.005 3.025 0.325 18 0 "[ . 1 . 2]" 1
190 1 25 VAL HA 1 26 PHE H 2.500 . 2.700 2.149 2.124 2.207 . 0 0 "[ . 1 . 2]" 1
191 1 25 VAL HB 1 26 PHE H 4.000 2.200 4.720 4.236 4.009 4.379 . 0 0 "[ . 1 . 2]" 1
192 1 24 GLN QB 1 25 VAL HA 4.000 2.300 7.000 4.307 4.114 4.425 . 0 0 "[ . 1 . 2]" 1
193 1 25 VAL HA 1 37 VAL HA 2.500 . 2.700 2.880 2.551 3.297 0.597 20 2 "[ - 1 . +]" 1
194 1 25 VAL HA 1 38 VAL H . 2.200 3.270 3.733 3.244 4.327 1.057 7 7 "[ * -* + *1 * . *]" 1
195 1 25 VAL HA 1 38 VAL MG1 4.000 2.300 6.000 4.718 3.768 5.285 . 0 0 "[ . 1 . 2]" 1
196 1 25 VAL H 1 25 VAL HA 4.000 2.200 5.000 2.934 2.910 2.946 . 0 0 "[ . 1 . 2]" 1
197 1 25 VAL H 1 25 VAL HB 2.500 . 2.680 2.679 2.588 2.820 0.140 11 0 "[ . 1 . 2]" 1
198 1 25 VAL HA 1 25 VAL HB . 2.200 2.870 3.017 3.009 3.022 0.152 1 0 "[ . 1 . 2]" 1
199 1 26 PHE HA 1 27 ALA H 2.500 . 2.700 2.174 2.152 2.220 . 0 0 "[ . 1 . 2]" 1
200 1 26 PHE H 1 27 ALA H 4.000 2.800 5.000 4.419 4.245 4.548 . 0 0 "[ . 1 . 2]" 1
201 1 26 PHE H 1 36 GLU H 3.000 . 3.500 3.822 3.238 4.200 0.700 15 3 "[ *- 1 + 2]" 1
202 1 26 PHE H 1 38 VAL H 3.000 . 3.500 4.081 3.559 4.762 1.262 20 11 "[*** * ***** - +]" 1
203 1 27 ALA HA 1 28 ILE H 2.500 . 2.700 2.910 2.780 3.541 0.841 20 1 "[ . 1 . +]" 1
204 1 27 ALA H 1 28 ILE H 4.000 2.800 5.000 4.224 2.934 4.406 . 0 0 "[ . 1 . 2]" 1
205 1 27 ALA MB 1 28 ILE H 4.000 2.200 5.000 1.787 1.741 1.880 0.459 9 0 "[ . 1 . 2]" 1
206 1 27 ALA HA 1 35 VAL HA . . 2.930 3.260 2.723 3.957 1.027 20 6 "[* **. 1 - * +]" 1
207 1 27 ALA HA 1 36 GLU H . 2.200 3.860 4.422 3.938 5.159 1.299 20 13 "[*-*** * ***** * +]" 1
208 1 27 ALA HA 1 35 VAL QG 3.000 . 4.800 2.081 1.860 2.565 . 0 0 "[ . 1 . 2]" 1
209 1 27 ALA H 1 27 ALA HA 4.000 2.200 5.000 2.909 2.887 2.935 . 0 0 "[ . 1 . 2]" 1
210 1 27 ALA H 1 27 ALA MB 2.500 . 2.900 2.306 2.280 2.355 . 0 0 "[ . 1 . 2]" 1
211 1 27 ALA HA 1 27 ALA MB . . 2.700 2.127 2.124 2.129 . 0 0 "[ . 1 . 2]" 1
212 1 28 ILE HA 1 29 GLY H 2.500 . 2.680 2.163 2.136 2.378 . 0 0 "[ . 1 . 2]" 1
213 1 28 ILE H 1 29 GLY H 4.000 2.200 5.000 4.521 4.467 4.559 . 0 0 "[ . 1 . 2]" 1
214 1 28 ILE HA 1 32 CYS H 4.000 2.200 4.480 5.074 4.834 6.017 1.537 20 12 "[*-**** ** * * * +]" 1
215 1 28 ILE H 1 36 GLU H 4.000 2.200 5.000 6.676 6.173 7.409 2.409 20 20 [*************-*****+] 1
216 1 28 ILE HA 1 34 LYS H 4.000 2.200 5.000 4.284 3.329 5.467 0.467 17 0 "[ . 1 . 2]" 1
217 1 28 ILE HA 1 35 VAL H 4.000 2.200 5.000 5.667 5.287 6.422 1.422 20 12 "[ * * ***** ** *-+]" 1
218 1 28 ILE H 1 28 ILE HA 4.000 2.200 5.000 2.852 2.829 2.948 . 0 0 "[ . 1 . 2]" 1
219 1 29 GLY QA 1 30 PRO HD3 . 2.200 2.440 2.084 1.895 2.112 0.305 20 0 "[ . 1 . 2]" 1
220 1 29 GLY QA 1 30 PRO HD2 . . 2.880 2.716 2.677 2.853 . 0 0 "[ . 1 . 2]" 1
221 1 29 GLY H 1 30 PRO QD 4.000 2.800 6.000 4.275 4.223 4.348 . 0 0 "[ . 1 . 2]" 1
222 1 29 GLY H 1 32 CYS H . 2.200 3.730 3.237 3.044 4.272 0.542 20 1 "[ . 1 . +]" 1
223 1 30 PRO QD 1 31 GLN H 4.000 2.800 6.000 2.420 2.372 2.477 0.428 12 0 "[ . 1 . 2]" 1
224 1 30 PRO HA 1 30 PRO HB3 2.500 . 2.700 2.271 2.268 2.276 . 0 0 "[ . 1 . 2]" 1
225 1 31 GLN HA 1 32 CYS H 4.000 2.200 5.000 3.429 3.422 3.440 . 0 0 "[ . 1 . 2]" 1
226 1 31 GLN H 1 32 CYS H 2.500 . 2.700 2.051 2.001 2.096 . 0 0 "[ . 1 . 2]" 1
227 1 29 GLY QA 1 31 GLN QB 3.000 3.000 3.300 5.093 5.018 5.148 1.848 4 20 [***+*-**************] 1
228 1 30 PRO HD2 1 31 GLN QB 4.000 3.000 5.000 3.877 3.774 4.024 . 0 0 "[ . 1 . 2]" 1
229 1 31 GLN QB 1 32 CYS HA 4.000 3.000 6.000 4.718 4.609 4.818 . 0 0 "[ . 1 . 2]" 1
230 1 31 GLN QB 1 32 CYS QB 3.000 . 3.300 3.895 3.748 4.040 0.740 20 18 "[****-*** 1*********+]" 1
231 1 5 ARG H 1 31 GLN QB 4.000 2.800 4.630 3.368 3.143 3.725 . 0 0 "[ . 1 . 2]" 1
232 1 6 CYS HA 1 31 GLN QB 4.000 2.200 5.000 3.466 3.293 3.872 . 0 0 "[ . 1 . 2]" 1
233 1 31 GLN H 1 31 GLN HA 4.000 2.200 5.000 2.947 2.943 2.950 . 0 0 "[ . 1 . 2]" 1
234 1 31 GLN H 1 31 GLN QB . 2.300 3.420 2.857 2.831 2.913 . 0 0 "[ . 1 . 2]" 1
235 1 31 GLN HA 1 31 GLN QB 2.500 . 2.700 2.172 2.168 2.174 . 0 0 "[ . 1 . 2]" 1
236 1 32 CYS HA 1 33 SER H 2.500 . 2.700 2.206 2.154 2.351 . 0 0 "[ . 1 . 2]" 1
237 1 32 CYS QB 1 33 SER H 4.000 2.200 5.000 3.572 3.214 3.782 . 0 0 "[ . 1 . 2]" 1
238 1 32 CYS HA 1 34 LYS H . 2.200 3.610 3.813 3.461 4.297 0.687 17 3 "[ . *- . + 2]" 1
239 1 6 CYS H 1 32 CYS HA 4.000 2.200 5.000 4.724 4.376 5.021 0.021 1 0 "[ . 1 . 2]" 1
240 1 6 CYS H 1 32 CYS QB 4.000 2.200 5.000 4.374 4.246 4.507 . 0 0 "[ . 1 . 2]" 1
241 1 32 CYS H 1 32 CYS HA 3.000 . 3.500 2.923 2.894 2.943 . 0 0 "[ . 1 . 2]" 1
242 1 32 CYS H 1 32 CYS QB 3.000 . 3.500 2.685 2.597 2.789 . 0 0 "[ . 1 . 2]" 1
243 1 32 CYS HA 1 32 CYS QB 3.000 . 3.300 2.473 2.454 2.489 . 0 0 "[ . 1 . 2]" 1
244 1 33 SER HA 1 34 LYS H . 2.200 2.990 3.130 2.586 3.562 0.572 17 1 "[ . 1 . + 2]" 1
245 1 33 SER H 1 34 LYS H 2.500 . 2.700 2.487 1.826 3.306 0.606 10 1 "[ . + . 2]" 1
246 1 33 SER QB 1 34 LYS H 3.000 . 4.170 3.462 2.353 4.001 . 0 0 "[ . 1 . 2]" 1
247 1 33 SER H 1 33 SER HA 2.500 . 2.900 2.928 2.900 2.946 0.046 20 0 "[ . 1 . 2]" 1
248 1 33 SER H 1 33 SER QB 2.500 . 3.430 2.407 2.316 2.577 . 0 0 "[ . 1 . 2]" 1
249 1 34 LYS HA 1 35 VAL H 2.500 . 2.700 2.276 2.186 2.373 . 0 0 "[ . 1 . 2]" 1
250 1 34 LYS H 1 35 VAL H 4.000 2.200 5.000 4.448 4.312 4.616 . 0 0 "[ . 1 . 2]" 1
251 1 34 LYS QB 1 35 VAL H 3.000 2.200 3.500 3.453 2.575 3.676 0.176 12 0 "[ . 1 . 2]" 1
252 1 28 ILE HA 1 34 LYS HA 4.000 2.800 6.000 5.086 4.586 6.209 0.209 20 0 "[ . 1 . 2]" 1
253 1 34 LYS H 1 34 LYS HA 3.000 . 3.500 2.926 2.882 2.948 . 0 0 "[ . 1 . 2]" 1
254 1 34 LYS H 1 34 LYS QB . 2.200 2.930 2.538 2.269 2.734 . 0 0 "[ . 1 . 2]" 1
255 1 34 LYS HA 1 34 LYS QB 2.500 2.200 2.700 2.382 2.328 2.447 . 0 0 "[ . 1 . 2]" 1
256 1 35 VAL HA 1 36 GLU H 2.500 . 2.700 2.178 2.131 2.252 . 0 0 "[ . 1 . 2]" 1
257 1 35 VAL HB 1 36 GLU H . 2.200 3.610 3.228 2.786 3.956 0.346 11 0 "[ . 1 . 2]" 1
258 1 28 ILE H 1 35 VAL HA 3.000 . 3.500 5.052 4.467 6.246 2.746 20 20 [*************-*****+] 1
259 1 28 ILE H 1 35 VAL HB 4.000 2.200 5.000 6.090 5.048 7.308 2.308 20 17 "[*-*** ******* ** **+]" 1
260 1 35 VAL H 1 35 VAL HA 4.000 2.200 5.000 2.884 2.860 2.925 . 0 0 "[ . 1 . 2]" 1
261 1 35 VAL H 1 35 VAL HB 2.500 . 2.900 3.630 3.564 3.671 0.771 6 20 [*****+****-*********] 1
262 1 35 VAL HA 1 35 VAL HB 2.500 . 2.700 2.504 2.345 2.619 . 0 0 "[ . 1 . 2]" 1
263 1 36 GLU HA 1 37 VAL H 2.500 . 2.700 2.185 2.156 2.238 . 0 0 "[ . 1 . 2]" 1
264 1 36 GLU QB 1 37 VAL H 4.000 2.300 6.000 3.089 2.868 3.172 . 0 0 "[ . 1 . 2]" 1
265 1 36 GLU H 1 36 GLU HA 4.000 2.200 5.000 2.940 2.917 2.947 . 0 0 "[ . 1 . 2]" 1
266 1 37 VAL HA 1 38 VAL H . . 2.400 2.100 2.083 2.118 . 0 0 "[ . 1 . 2]" 1
267 1 37 VAL MG2 1 38 VAL H 3.000 . 4.800 4.282 4.205 4.326 . 0 0 "[ . 1 . 2]" 1
268 1 37 VAL H 1 49 LEU H 4.000 2.200 4.910 4.222 3.925 4.732 . 0 0 "[ . 1 . 2]" 1
269 1 26 PHE H 1 37 VAL HA . 2.200 3.110 3.439 2.973 4.074 0.964 10 6 "[* * . * -+ . *]" 1
270 1 25 VAL MG2 1 37 VAL HA 3.000 . 4.800 3.865 3.010 4.485 . 0 0 "[ . 1 . 2]" 1
271 1 25 VAL MG1 1 37 VAL HA 4.000 2.300 6.500 3.778 3.024 4.568 . 0 0 "[ . 1 . 2]" 1
272 1 25 VAL HA 1 37 VAL MG2 4.000 2.300 6.500 5.134 4.811 5.549 . 0 0 "[ . 1 . 2]" 1
273 1 37 VAL MG2 1 49 LEU HB2 2.500 . 4.200 2.216 1.939 2.836 . 0 0 "[ . 1 . 2]" 1
274 1 25 VAL MG2 1 37 VAL MG2 3.000 . 6.300 4.639 4.412 5.249 . 0 0 "[ . 1 . 2]" 1
275 1 37 VAL MG2 1 49 LEU H 4.000 2.300 6.500 3.498 3.138 4.171 . 0 0 "[ . 1 . 2]" 1
276 1 25 VAL MG1 1 37 VAL MG1 3.000 . 6.300 2.352 2.064 3.013 . 0 0 "[ . 1 . 2]" 1
277 1 37 VAL H 1 37 VAL HA 4.000 2.200 5.000 2.931 2.927 2.941 . 0 0 "[ . 1 . 2]" 1
278 1 37 VAL H 1 37 VAL HB . . 2.740 3.656 3.614 3.735 0.995 11 20 [**********+****-****] 1
279 1 37 VAL HA 1 37 VAL HB 4.000 2.200 5.000 2.577 2.510 2.614 . 0 0 "[ . 1 . 2]" 1
280 1 37 VAL HA 1 37 VAL MG2 2.500 . 4.200 3.177 3.158 3.196 . 0 0 "[ . 1 . 2]" 1
281 1 37 VAL HA 1 37 VAL MG1 3.000 . 3.300 2.221 2.183 2.267 . 0 0 "[ . 1 . 2]" 1
282 1 38 VAL HA 1 39 ALA H 2.500 . 2.700 2.258 2.250 2.376 . 0 0 "[ . 1 . 2]" 1
283 1 38 VAL HB 1 39 ALA H 4.000 2.200 4.420 2.808 2.657 2.924 . 0 0 "[ . 1 . 2]" 1
284 1 38 VAL MG2 1 39 ALA H 3.000 . 4.050 3.299 3.046 3.715 . 0 0 "[ . 1 . 2]" 1
285 1 38 VAL HA 1 48 CYS HA 2.500 . 2.700 2.661 2.416 2.912 0.212 2 0 "[ . 1 . 2]" 1
286 1 38 VAL HA 1 49 LEU H 3.000 . 3.500 3.316 2.986 3.711 0.211 2 0 "[ . 1 . 2]" 1
287 1 38 VAL HA 1 47 ILE H 4.000 . 6.000 5.049 4.791 5.536 . 0 0 "[ . 1 . 2]" 1
288 1 38 VAL H 1 38 VAL HA 4.000 2.200 5.000 2.925 2.921 2.939 . 0 0 "[ . 1 . 2]" 1
289 1 38 VAL H 1 38 VAL HB 2.500 . 2.900 3.749 3.702 3.805 0.905 3 20 [**+***************-*] 1
290 1 38 VAL HA 1 38 VAL HB 4.000 2.200 5.000 2.329 2.274 2.453 . 0 0 "[ . 1 . 2]" 1
291 1 39 ALA HA 1 40 SER H . . 2.400 2.256 2.252 2.298 . 0 0 "[ . 1 . 2]" 1
292 1 38 VAL MG2 1 39 ALA HA 4.000 2.300 6.500 3.601 3.370 4.041 . 0 0 "[ . 1 . 2]" 1
293 1 39 ALA HA 1 40 SER QB 4.000 2.200 5.000 4.458 4.420 4.462 . 0 0 "[ . 1 . 2]" 1
294 1 39 ALA H 1 47 ILE H 3.000 . 3.240 3.300 3.027 3.751 0.511 10 1 "[ . + . 2]" 1
295 1 39 ALA H 1 49 LEU H 4.000 2.200 5.000 4.812 4.445 5.094 0.094 6 0 "[ . 1 . 2]" 1
296 1 24 GLN H 1 39 ALA HA 3.000 . 3.500 3.312 2.873 4.076 0.576 7 1 "[ . + 1 . 2]" 1
297 1 23 LEU MD1 1 39 ALA HA 3.000 . 4.800 3.272 2.643 4.114 . 0 0 "[ . 1 . 2]" 1
298 1 39 ALA H 1 39 ALA HA 2.500 . 2.900 2.943 2.912 2.946 0.046 10 0 "[ . 1 . 2]" 1
299 1 40 SER HA 1 41 LEU H 2.500 . 2.650 2.142 2.111 2.213 . 0 0 "[ . 1 . 2]" 1
300 1 40 SER H 1 41 LEU H 4.000 2.200 5.000 4.364 4.350 4.443 . 0 0 "[ . 1 . 2]" 1
301 1 40 SER QB 1 41 LEU H 4.000 2.300 6.000 3.023 2.874 3.052 . 0 0 "[ . 1 . 2]" 1
302 1 40 SER HA 1 46 GLU HA 2.500 . 2.700 2.327 1.934 2.486 . 0 0 "[ . 1 . 2]" 1
303 1 40 SER HA 1 47 ILE H 3.000 . 3.500 3.607 3.054 3.889 0.389 2 0 "[ . 1 . 2]" 1
304 1 40 SER HA 1 46 GLU QB 4.000 2.300 5.000 3.478 3.039 3.727 . 0 0 "[ . 1 . 2]" 1
305 1 40 SER H 1 40 SER HA 3.000 . 3.500 2.956 2.947 2.958 . 0 0 "[ . 1 . 2]" 1
306 1 40 SER H 1 40 SER HB3 3.000 . 3.500 3.821 3.775 3.825 0.325 5 0 "[ . 1 . 2]" 1
307 1 40 SER H 1 40 SER HB2 3.000 . 3.500 2.723 2.659 2.729 . 0 0 "[ . 1 . 2]" 1
308 1 40 SER HA 1 40 SER HB3 3.000 . 3.300 2.435 2.434 2.439 . 0 0 "[ . 1 . 2]" 1
309 1 40 SER HA 1 40 SER HB2 3.000 . 3.300 3.031 3.025 3.032 . 0 0 "[ . 1 . 2]" 1
310 1 41 LEU HA 1 42 LYS H 2.500 . 2.620 2.484 2.399 2.564 . 0 0 "[ . 1 . 2]" 1
311 1 41 LEU H 1 42 LYS H 4.000 2.200 5.000 4.569 4.524 4.613 . 0 0 "[ . 1 . 2]" 1
312 1 41 LEU HB3 1 42 LYS H 3.000 . 3.500 2.251 2.087 2.504 . 0 0 "[ . 1 . 2]" 1
313 1 41 LEU HB2 1 42 LYS H 4.000 2.200 5.000 3.630 3.431 3.871 . 0 0 "[ . 1 . 2]" 1
314 1 41 LEU H 1 45 LYS H . 2.200 3.920 2.871 2.665 3.275 . 0 0 "[ . 1 . 2]" 1
315 1 41 LEU HA 1 43 ASN H . 2.200 3.920 4.076 3.940 4.246 0.326 15 0 "[ . 1 . 2]" 1
316 1 41 LEU HB2 1 45 LYS H 3.000 . 3.500 2.615 2.354 2.949 . 0 0 "[ . 1 . 2]" 1
317 1 41 LEU HB3 1 45 LYS H 4.000 2.200 5.000 3.933 3.545 4.120 . 0 0 "[ . 1 . 2]" 1
318 1 41 LEU QD 1 42 LYS H . 2.300 3.950 3.589 3.490 3.678 . 0 0 "[ . 1 . 2]" 1
319 1 41 LEU QD 1 45 LYS H 4.000 2.300 4.330 3.629 3.468 4.026 . 0 0 "[ . 1 . 2]" 1
320 1 21 SER H 1 41 LEU HA . . 2.870 3.249 2.966 3.852 0.982 9 2 "[ . -+1 . 2]" 1
321 1 22 ASN H 1 41 LEU HA 4.000 2.200 4.660 4.563 4.091 5.368 0.708 9 1 "[ . +1 . 2]" 1
322 1 19 MET QB 1 41 LEU HA 4.000 2.200 5.000 4.273 3.712 5.054 0.054 2 0 "[ . 1 . 2]" 1
323 1 19 MET QB 1 41 LEU QD 4.000 2.300 4.610 2.172 2.069 2.419 0.231 11 0 "[ . 1 . 2]" 1
324 1 41 LEU H 1 41 LEU HA 4.000 2.200 5.000 2.879 2.856 2.914 . 0 0 "[ . 1 . 2]" 1
325 1 41 LEU H 1 41 LEU HB2 3.000 . 3.420 2.278 2.194 2.371 . 0 0 "[ . 1 . 2]" 1
326 1 41 LEU H 1 41 LEU HB3 . 2.200 3.420 3.544 3.492 3.597 0.177 2 0 "[ . 1 . 2]" 1
327 1 41 LEU HA 1 41 LEU HB2 4.000 2.200 5.000 3.003 2.984 3.014 . 0 0 "[ . 1 . 2]" 1
328 1 41 LEU HA 1 41 LEU HB3 2.500 . 2.700 2.590 2.525 2.655 . 0 0 "[ . 1 . 2]" 1
329 1 41 LEU H 1 41 LEU QD 4.000 2.300 5.010 2.178 2.031 2.470 0.269 2 0 "[ . 1 . 2]" 1
330 1 42 LYS HA 1 43 ASN H 3.000 . 3.330 3.391 3.315 3.441 0.111 15 0 "[ . 1 . 2]" 1
331 1 42 LYS H 1 43 ASN H 3.000 . 3.240 2.438 2.375 2.516 . 0 0 "[ . 1 . 2]" 1
332 1 42 LYS HB3 1 43 ASN H 4.000 2.200 5.000 3.206 3.057 3.435 . 0 0 "[ . 1 . 2]" 1
333 1 42 LYS HB2 1 43 ASN H 4.000 2.200 5.000 4.130 4.075 4.192 . 0 0 "[ . 1 . 2]" 1
334 1 42 LYS HA 1 44 GLY H . 2.200 3.450 3.723 3.372 4.142 0.692 1 4 "[+ . - 1 *. * 2]" 1
335 1 42 LYS H 1 42 LYS HA 2.500 . 2.830 2.872 2.846 2.885 0.055 2 0 "[ . 1 . 2]" 1
336 1 42 LYS H 1 42 LYS HB2 4.000 2.200 5.000 2.543 2.423 2.631 . 0 0 "[ . 1 . 2]" 1
337 1 42 LYS H 1 42 LYS HB3 2.500 . 2.900 2.559 2.459 2.702 . 0 0 "[ . 1 . 2]" 1
338 1 42 LYS HA 1 42 LYS HB3 2.500 . 2.700 3.024 3.012 3.029 0.329 7 0 "[ . 1 . 2]" 1
339 1 42 LYS HA 1 42 LYS HB2 2.500 . 2.700 2.505 2.451 2.574 . 0 0 "[ . 1 . 2]" 1
340 1 43 ASN HA 1 44 GLY H . 3.000 3.420 3.396 3.268 3.510 0.090 1 0 "[ . 1 . 2]" 1
341 1 43 ASN H 1 44 GLY H 2.500 . 2.700 2.445 2.340 2.525 . 0 0 "[ . 1 . 2]" 1
342 1 43 ASN HB3 1 44 GLY H 4.000 2.200 5.000 4.110 3.864 4.311 . 0 0 "[ . 1 . 2]" 1
343 1 43 ASN HB2 1 44 GLY H 4.000 2.200 5.000 3.218 2.793 3.568 . 0 0 "[ . 1 . 2]" 1
344 1 43 ASN H 1 45 LYS H 4.000 2.200 5.000 3.864 3.601 4.108 . 0 0 "[ . 1 . 2]" 1
345 1 43 ASN HA 1 43 ASN HB3 2.500 . 2.700 2.467 2.451 2.479 . 0 0 "[ . 1 . 2]" 1
346 1 43 ASN HA 1 43 ASN HB2 2.500 . 2.700 3.027 3.026 3.030 0.330 8 0 "[ . 1 . 2]" 1
347 1 44 GLY HA3 1 45 LYS H . 2.200 3.610 3.536 3.469 3.560 . 0 0 "[ . 1 . 2]" 1
348 1 44 GLY HA2 1 45 LYS H . 2.200 3.610 2.816 2.720 2.999 . 0 0 "[ . 1 . 2]" 1
349 1 44 GLY H 1 45 LYS H . . 2.520 2.230 2.095 2.452 . 0 0 "[ . 1 . 2]" 1
350 1 45 LYS HA 1 46 GLU H 2.500 . 2.700 2.322 2.158 2.417 . 0 0 "[ . 1 . 2]" 1
351 1 45 LYS QB 1 46 GLU H . 2.200 2.870 2.600 2.370 3.551 0.681 7 1 "[ . + 1 . 2]" 1
352 1 45 LYS H 1 45 LYS HA . . 2.900 2.945 2.936 2.949 0.049 16 0 "[ . 1 . 2]" 1
353 1 45 LYS H 1 45 LYS QB 2.500 2.200 2.900 2.562 2.439 2.633 . 0 0 "[ . 1 . 2]" 1
354 1 45 LYS H 1 45 LYS QD 3.000 . 4.300 4.320 4.037 4.620 0.320 18 0 "[ . 1 . 2]" 1
355 1 45 LYS HA 1 45 LYS QB . . 2.700 2.398 2.366 2.422 . 0 0 "[ . 1 . 2]" 1
356 1 46 GLU HA 1 47 ILE H 2.500 . 2.560 2.111 2.107 2.135 . 0 0 "[ . 1 . 2]" 1
357 1 46 GLU H 1 47 ILE H 4.000 2.200 4.350 4.257 4.203 4.478 0.128 7 0 "[ . 1 . 2]" 1
358 1 46 GLU QB 1 47 ILE H 3.000 . 3.520 3.173 3.092 3.301 . 0 0 "[ . 1 . 2]" 1
359 1 41 LEU H 1 46 GLU HA . . 2.870 3.601 3.346 3.832 0.962 18 19 "[* ****-**********+**]" 1
360 1 46 GLU HA 1 46 GLU QB 2.500 . 2.560 2.192 2.172 2.195 . 0 0 "[ . 1 . 2]" 1
361 1 47 ILE H 1 48 CYS H 4.000 2.200 4.070 4.401 4.399 4.406 0.336 16 0 "[ . 1 . 2]" 1
362 1 47 ILE MD 1 48 CYS H 4.000 2.300 6.500 3.813 3.810 3.816 . 0 0 "[ . 1 . 2]" 1
363 1 48 CYS HA 1 49 LEU H . . 2.400 2.132 2.131 2.133 . 0 0 "[ . 1 . 2]" 1
364 1 48 CYS H 1 49 LEU H 4.000 2.200 5.000 4.336 4.334 4.337 . 0 0 "[ . 1 . 2]" 1
365 1 48 CYS QB 1 49 LEU H . 2.200 3.270 2.937 2.935 2.939 . 0 0 "[ . 1 . 2]" 1
366 1 48 CYS HA 1 49 LEU HB2 4.000 2.200 5.000 4.312 4.307 4.316 . 0 0 "[ . 1 . 2]" 1
367 1 48 CYS HA 1 49 LEU MD2 4.000 2.300 6.500 4.050 4.048 4.051 . 0 0 "[ . 1 . 2]" 1
368 1 39 ALA H 1 48 CYS HA 3.000 . 3.500 3.752 3.377 3.975 0.475 18 0 "[ . 1 . 2]" 1
369 1 38 VAL H 1 48 CYS HA 4.000 . 6.000 5.192 5.029 5.485 . 0 0 "[ . 1 . 2]" 1
370 1 38 VAL MG1 1 48 CYS HA 4.000 2.300 5.500 3.415 2.924 3.961 . 0 0 "[ . 1 . 2]" 1
371 1 48 CYS H 1 48 CYS QB 2.500 2.200 2.870 2.534 2.533 2.535 . 0 0 "[ . 1 . 2]" 1
372 1 48 CYS HA 1 48 CYS QB . . 2.700 2.406 2.405 2.407 . 0 0 "[ . 1 . 2]" 1
373 1 49 LEU HA 1 50 ASP H . . 2.520 2.350 2.303 2.378 . 0 0 "[ . 1 . 2]" 1
374 1 49 LEU HB3 1 50 ASP H 4.000 2.200 5.000 2.968 2.924 3.018 . 0 0 "[ . 1 . 2]" 1
375 1 49 LEU HB2 1 50 ASP H 4.000 2.200 5.000 3.962 3.929 3.999 . 0 0 "[ . 1 . 2]" 1
376 1 11 THR HB 1 49 LEU HA 3.000 . 3.300 5.323 5.322 5.324 2.024 11 20 [*****-****+*********] 1
377 1 49 LEU H 1 49 LEU HA 4.000 2.200 5.000 2.957 2.956 2.958 . 0 0 "[ . 1 . 2]" 1
378 1 49 LEU H 1 49 LEU HB3 4.000 2.200 5.000 3.626 3.624 3.628 . 0 0 "[ . 1 . 2]" 1
379 1 49 LEU H 1 49 LEU HB2 2.500 . 2.900 2.426 2.420 2.429 . 0 0 "[ . 1 . 2]" 1
380 1 50 ASP HA 1 51 PRO QD 2.500 . 2.700 1.944 1.863 2.026 . 0 0 "[ . 1 . 2]" 1
381 1 50 ASP HA 1 52 GLU H 4.000 2.200 5.000 3.483 3.423 3.570 . 0 0 "[ . 1 . 2]" 1
382 1 50 ASP H 1 50 ASP QB . . 2.770 2.363 2.296 2.427 . 0 0 "[ . 1 . 2]" 1
383 1 50 ASP HA 1 50 ASP QB 2.500 2.200 2.700 2.500 2.474 2.517 . 0 0 "[ . 1 . 2]" 1
384 1 51 PRO QD 1 52 GLU H 4.000 2.200 4.350 2.736 2.511 2.867 . 0 0 "[ . 1 . 2]" 1
385 1 51 PRO HA 1 53 ALA H . 2.200 3.830 3.624 3.525 3.652 . 0 0 "[ . 1 . 2]" 1
386 1 51 PRO HA 1 51 PRO HB3 2.500 . 2.700 2.291 2.274 2.300 . 0 0 "[ . 1 . 2]" 1
387 1 51 PRO HA 1 51 PRO HB2 4.000 2.200 5.000 2.964 2.933 2.981 . 0 0 "[ . 1 . 2]" 1
388 1 52 GLU HA 1 53 ALA H . 2.800 3.300 3.412 3.370 3.417 0.117 1 0 "[ . 1 . 2]" 1
389 1 52 GLU H 1 53 ALA H 2.500 . 2.700 2.695 2.479 2.741 0.041 14 0 "[ . 1 . 2]" 1
390 1 52 GLU H 1 52 GLU HA 2.500 . 2.700 2.821 2.808 2.877 0.177 6 0 "[ . 1 . 2]" 1
391 1 52 GLU H 1 52 GLU QB 2.500 . 3.520 2.174 2.053 2.262 . 0 0 "[ . 1 . 2]" 1
392 1 53 ALA MB 1 56 LEU H 4.000 2.800 4.210 2.835 2.805 2.866 . 0 0 "[ . 1 . 2]" 1
393 1 53 ALA H 1 53 ALA HA 4.000 2.200 5.000 2.940 2.938 2.944 . 0 0 "[ . 1 . 2]" 1
394 1 53 ALA H 1 53 ALA MB . 2.200 3.000 2.280 2.273 2.297 . 0 0 "[ . 1 . 2]" 1
395 1 53 ALA HA 1 53 ALA MB 2.500 2.200 2.700 2.136 2.135 2.137 0.065 11 0 "[ . 1 . 2]" 1
396 1 54 PRO HA 1 55 PHE H . 2.200 3.420 3.556 3.555 3.557 0.137 2 0 "[ . 1 . 2]" 1
397 1 54 PRO QB 1 55 PHE H 3.000 . 4.300 3.072 3.071 3.072 . 0 0 "[ . 1 . 2]" 1
398 1 54 PRO HA 1 57 LYS H . 2.200 3.670 3.311 3.172 3.462 . 0 0 "[ . 1 . 2]" 1
399 1 54 PRO HA 1 58 LYS H 4.000 2.200 5.000 4.819 4.575 5.111 0.111 14 0 "[ . 1 . 2]" 1
400 1 54 PRO HA 1 57 LYS HB2 3.000 . 3.300 3.340 3.091 3.707 0.407 2 0 "[ . 1 . 2]" 1
401 1 54 PRO HA 1 57 LYS HB3 4.000 2.200 5.000 3.082 2.529 3.552 . 0 0 "[ . 1 . 2]" 1
402 1 55 PHE HA 1 56 LEU H . 2.200 3.520 3.442 3.412 3.464 . 0 0 "[ . 1 . 2]" 1
403 1 55 PHE H 1 56 LEU H . . 2.900 2.650 2.623 2.678 . 0 0 "[ . 1 . 2]" 1
404 1 55 PHE HB3 1 56 LEU H 4.000 2.200 5.000 4.066 4.048 4.089 . 0 0 "[ . 1 . 2]" 1
405 1 55 PHE HB2 1 56 LEU H 4.000 2.200 5.000 3.980 3.956 3.999 . 0 0 "[ . 1 . 2]" 1
406 1 55 PHE H 1 57 LYS H 4.000 2.200 5.000 4.158 4.018 4.327 . 0 0 "[ . 1 . 2]" 1
407 1 55 PHE H 1 58 LYS H 4.000 2.800 6.000 5.006 4.835 5.118 . 0 0 "[ . 1 . 2]" 1
408 1 55 PHE HA 1 58 LYS H . 2.200 3.520 3.426 3.164 3.616 0.096 5 0 "[ . 1 . 2]" 1
409 1 55 PHE HA 1 59 VAL H 4.000 2.200 5.000 4.476 3.994 4.813 . 0 0 "[ . 1 . 2]" 1
410 1 54 PRO QB 1 55 PHE QD 4.000 2.800 7.000 4.633 4.632 4.634 . 0 0 "[ . 1 . 2]" 1
411 1 53 ALA MB 1 55 PHE HE2 3.000 . 3.300 2.256 2.242 2.265 . 0 0 "[ . 1 . 2]" 1
412 1 15 VAL HA 1 55 PHE QD 4.000 2.800 6.000 6.863 6.273 7.304 1.304 8 17 "[ *****+-****** ****]" 1
413 1 55 PHE H 1 55 PHE HB2 4.000 2.200 5.000 3.626 3.624 3.627 . 0 0 "[ . 1 . 2]" 1
414 1 55 PHE H 1 55 PHE HB3 2.500 . 2.900 2.548 2.547 2.550 . 0 0 "[ . 1 . 2]" 1
415 1 55 PHE HA 1 55 PHE HB2 2.500 . 2.700 2.438 2.437 2.440 . 0 0 "[ . 1 . 2]" 1
416 1 55 PHE HA 1 55 PHE HB3 2.500 . 2.700 2.464 2.463 2.465 . 0 0 "[ . 1 . 2]" 1
417 1 55 PHE HA 1 55 PHE QD 4.000 2.200 5.000 3.736 3.735 3.737 . 0 0 "[ . 1 . 2]" 1
418 1 55 PHE HB3 1 55 PHE QD 3.000 . 3.300 2.372 2.370 2.373 . 0 0 "[ . 1 . 2]" 1
419 1 55 PHE HB2 1 55 PHE QD 4.000 2.200 5.000 2.416 2.414 2.417 . 0 0 "[ . 1 . 2]" 1
420 1 56 LEU HA 1 57 LYS H . 2.200 3.420 3.501 3.457 3.530 0.110 2 0 "[ . 1 . 2]" 1
421 1 56 LEU H 1 57 LYS H 2.500 . 2.650 2.449 2.307 2.592 . 0 0 "[ . 1 . 2]" 1
422 1 56 LEU H 1 58 LYS H 4.000 2.200 5.000 3.826 3.739 3.970 . 0 0 "[ . 1 . 2]" 1
423 1 56 LEU HA 1 59 VAL H 3.000 . 3.500 3.712 3.570 3.963 0.463 13 0 "[ . 1 . 2]" 1
424 1 56 LEU HA 1 60 ILE H 4.000 2.200 4.420 4.427 4.245 4.907 0.487 13 0 "[ . 1 . 2]" 1
425 1 56 LEU HA 1 59 VAL HB . 2.200 3.210 5.292 5.044 5.464 2.254 15 20 [**************+****-] 1
426 1 56 LEU HA 1 59 VAL QG 2.500 . 4.200 2.304 2.092 2.478 . 0 0 "[ . 1 . 2]" 1
427 1 56 LEU HA 1 60 ILE QG 4.000 2.300 7.400 3.708 3.514 4.040 . 0 0 "[ . 1 . 2]" 1
428 1 49 LEU MD1 1 56 LEU HA 4.000 2.300 6.500 3.983 3.453 4.550 . 0 0 "[ . 1 . 2]" 1
429 1 56 LEU H 1 56 LEU HA 2.500 . 2.710 2.853 2.821 2.888 0.178 8 0 "[ . 1 . 2]" 1
430 1 57 LYS HA 1 58 LYS H . 2.200 3.240 3.392 3.318 3.441 0.201 1 0 "[ . 1 . 2]" 1
431 1 57 LYS H 1 58 LYS H . . 2.490 2.471 2.301 2.601 0.111 14 0 "[ . 1 . 2]" 1
432 1 57 LYS HB3 1 58 LYS H 3.000 . 3.500 3.120 2.948 3.380 . 0 0 "[ . 1 . 2]" 1
433 1 57 LYS HB2 1 58 LYS H 4.000 2.200 5.000 4.067 3.905 4.215 . 0 0 "[ . 1 . 2]" 1
434 1 57 LYS H 1 57 LYS HA 2.500 . 2.900 2.854 2.824 2.908 0.008 13 0 "[ . 1 . 2]" 1
435 1 57 LYS H 1 57 LYS HB3 2.500 . 2.900 2.560 2.392 2.742 . 0 0 "[ . 1 . 2]" 1
436 1 57 LYS H 1 57 LYS HB2 2.500 . 2.900 2.493 2.347 2.639 . 0 0 "[ . 1 . 2]" 1
437 1 57 LYS HA 1 57 LYS HB3 4.000 2.200 5.000 3.019 3.004 3.026 . 0 0 "[ . 1 . 2]" 1
438 1 57 LYS HA 1 57 LYS HB2 2.500 . 2.700 2.502 2.407 2.603 . 0 0 "[ . 1 . 2]" 1
439 1 58 LYS HA 1 59 VAL H . 2.200 3.390 3.563 3.545 3.576 0.186 7 0 "[ . 1 . 2]" 1
440 1 58 LYS H 1 59 VAL H 2.500 . 2.700 2.672 2.569 2.750 0.050 10 0 "[ . 1 . 2]" 1
441 1 58 LYS QB 1 59 VAL H 4.000 2.300 6.000 2.235 2.187 2.263 0.113 4 0 "[ . 1 . 2]" 1
442 1 58 LYS H 1 60 ILE H 4.000 2.200 4.260 3.740 3.639 3.859 . 0 0 "[ . 1 . 2]" 1
443 1 58 LYS HA 1 60 ILE H 4.000 2.200 5.000 4.205 4.007 4.259 . 0 0 "[ . 1 . 2]" 1
444 1 58 LYS HA 1 61 GLN H 3.000 . 3.500 3.404 3.351 3.591 0.091 5 0 "[ . 1 . 2]" 1
445 1 58 LYS HA 1 62 LYS H 4.000 2.200 4.010 4.320 4.046 4.955 0.945 8 6 "[ * *- + 1 * * 2]" 1
446 1 58 LYS HA 1 61 GLN HB3 3.000 . 3.300 2.936 2.690 3.542 0.242 5 0 "[ . 1 . 2]" 1
447 1 58 LYS HA 1 61 GLN HB2 3.000 . 3.300 3.275 3.077 3.769 0.469 5 0 "[ . 1 . 2]" 1
448 1 58 LYS H 1 58 LYS HA 2.500 . 2.830 2.875 2.854 2.896 0.066 13 0 "[ . 1 . 2]" 1
449 1 59 VAL HA 1 60 ILE H . 2.200 3.390 3.527 3.508 3.539 0.149 10 0 "[ . 1 . 2]" 1
450 1 59 VAL H 1 60 ILE H . . 2.590 2.733 2.688 2.783 0.193 15 0 "[ . 1 . 2]" 1
451 1 59 VAL H 1 61 GLN H 4.000 2.200 5.000 4.058 3.967 4.269 . 0 0 "[ . 1 . 2]" 1
452 1 59 VAL HA 1 62 LYS H 3.000 . 3.500 3.518 3.255 3.678 0.178 2 0 "[ . 1 . 2]" 1
453 1 59 VAL HA 1 62 LYS HB2 3.000 . 4.300 2.959 2.504 3.309 . 0 0 "[ . 1 . 2]" 1
454 1 59 VAL HA 1 62 LYS HB3 4.000 2.200 5.000 4.557 4.136 4.941 . 0 0 "[ . 1 . 2]" 1
455 1 17 PRO QB 1 59 VAL HA 4.000 2.200 4.010 4.488 4.003 5.503 1.493 8 9 "[ * ** + *- .** *]" 1
456 1 17 PRO QG 1 59 VAL HA 3.000 . 4.300 2.474 1.964 3.487 . 0 0 "[ . 1 . 2]" 1
457 1 17 PRO QD 1 59 VAL HA 4.000 2.200 5.000 3.064 2.697 3.623 . 0 0 "[ . 1 . 2]" 1
458 1 59 VAL H 1 59 VAL HB . . 2.400 3.619 3.604 3.633 1.233 14 20 [*******-*****+******] 1
459 1 59 VAL HA 1 59 VAL HB 2.500 . 2.700 2.446 2.406 2.526 . 0 0 "[ . 1 . 2]" 1
460 1 60 ILE HA 1 61 GLN H . 2.200 3.610 3.459 3.368 3.532 . 0 0 "[ . 1 . 2]" 1
461 1 60 ILE H 1 61 GLN H 2.500 . 2.700 2.372 2.287 2.532 . 0 0 "[ . 1 . 2]" 1
462 1 60 ILE HB 1 61 GLN H . . 2.800 4.079 3.913 4.169 1.369 15 20 [**************+****-] 1
463 1 60 ILE HA 1 63 ILE H 3.000 . 3.170 3.457 3.268 3.605 0.435 15 0 "[ . 1 . 2]" 1
464 1 60 ILE H 1 60 ILE HA 3.000 . 3.500 2.892 2.858 2.908 . 0 0 "[ . 1 . 2]" 1
465 1 60 ILE H 1 60 ILE HB . . 2.400 3.711 3.685 3.734 1.334 16 20 [**************-+****] 1
466 1 60 ILE HA 1 60 ILE HB . . 2.830 2.417 2.390 2.448 . 0 0 "[ . 1 . 2]" 1
467 1 61 GLN H 1 62 LYS H 2.500 . 2.700 2.541 2.162 2.667 . 0 0 "[ . 1 . 2]" 1
468 1 61 GLN HB3 1 62 LYS H 4.000 2.200 5.000 2.564 2.484 3.098 . 0 0 "[ . 1 . 2]" 1
469 1 61 GLN HB2 1 62 LYS H 4.000 2.200 5.000 3.808 3.689 4.124 . 0 0 "[ . 1 . 2]" 1
470 1 61 GLN H 1 63 ILE H 4.000 2.200 5.000 4.087 3.877 4.207 . 0 0 "[ . 1 . 2]" 1
471 1 61 GLN HA 1 64 LEU H 3.000 . 3.500 3.676 3.444 3.956 0.456 2 0 "[ . 1 . 2]" 1
472 1 61 GLN HA 1 64 LEU QB 3.000 2.300 4.200 3.050 2.653 3.760 . 0 0 "[ . 1 . 2]" 1
473 1 61 GLN H 1 61 GLN HA 3.000 . 3.500 2.870 2.841 2.919 . 0 0 "[ . 1 . 2]" 1
474 1 62 LYS HA 1 63 ILE H 4.000 2.200 5.000 3.535 3.485 3.562 . 0 0 "[ . 1 . 2]" 1
475 1 62 LYS H 1 63 ILE H 3.000 . 3.500 2.764 2.413 2.842 . 0 0 "[ . 1 . 2]" 1
476 1 62 LYS HB2 1 63 ILE H 3.000 . 3.500 2.947 2.767 3.114 . 0 0 "[ . 1 . 2]" 1
477 1 62 LYS HB3 1 63 ILE H 4.000 2.200 5.000 3.714 3.477 3.944 . 0 0 "[ . 1 . 2]" 1
478 1 62 LYS H 1 64 LEU H 4.000 2.200 5.000 4.122 3.860 4.253 . 0 0 "[ . 1 . 2]" 1
479 1 62 LYS HA 1 64 LEU H 4.000 2.200 5.000 3.863 3.645 4.142 . 0 0 "[ . 1 . 2]" 1
480 1 62 LYS HA 1 65 ASP H 3.000 . 3.210 3.508 3.175 3.835 0.625 15 2 "[ . 1 + -]" 1
481 1 62 LYS H 1 62 LYS HA 2.500 . 2.900 2.803 2.784 2.882 . 0 0 "[ . 1 . 2]" 1
482 1 62 LYS H 1 62 LYS HB2 2.500 . 2.900 2.369 2.187 2.502 . 0 0 "[ . 1 . 2]" 1
483 1 62 LYS HA 1 62 LYS HB3 4.000 2.200 5.000 2.549 2.476 2.664 . 0 0 "[ . 1 . 2]" 1
484 1 63 ILE HA 1 64 LEU H 4.000 2.200 5.000 3.356 3.081 3.458 . 0 0 "[ . 1 . 2]" 1
485 1 63 ILE H 1 64 LEU H 3.000 . 3.110 2.507 2.367 2.673 . 0 0 "[ . 1 . 2]" 1
486 1 63 ILE HA 1 66 GLY H 3.000 . 3.500 3.699 3.289 4.226 0.726 15 2 "[ . 1 + -]" 1
487 1 63 ILE HA 1 67 GLY H 4.000 2.200 5.000 3.934 3.295 4.825 . 0 0 "[ . 1 . 2]" 1
488 1 63 ILE H 1 63 ILE HA 2.500 . 2.900 2.881 2.851 2.918 0.018 20 0 "[ . 1 . 2]" 1
489 1 64 LEU HA 1 65 ASP H . 2.200 3.420 3.440 2.995 3.555 0.135 20 0 "[ . 1 . 2]" 1
490 1 64 LEU H 1 65 ASP H 2.500 . 2.700 2.227 2.053 2.577 . 0 0 "[ . 1 . 2]" 1
491 1 64 LEU HB3 1 65 ASP H 3.000 . 3.500 3.831 3.298 4.291 0.791 15 6 "[ ** . * 1 +* - 2]" 1
492 1 64 LEU HB2 1 65 ASP H 3.000 . 3.500 2.967 2.478 3.999 0.499 15 0 "[ . 1 . 2]" 1
493 1 64 LEU H 1 66 GLY H 4.000 2.200 5.000 3.804 2.910 4.549 . 0 0 "[ . 1 . 2]" 1
494 1 64 LEU HA 1 67 GLY H 3.000 . 3.500 3.754 3.442 4.494 0.994 15 1 "[ . 1 + 2]" 1
495 1 64 LEU HA 1 68 ASN H 4.000 2.200 5.000 4.818 3.926 6.428 1.428 1 2 "[+ . 1 . - 2]" 1
496 1 64 LEU H 1 64 LEU HA 2.500 . 2.900 2.919 2.880 2.946 0.046 20 0 "[ . 1 . 2]" 1
497 1 64 LEU H 1 64 LEU QB 2.500 . 4.400 2.407 2.233 2.528 . 0 0 "[ . 1 . 2]" 1
498 1 65 ASP HA 1 66 GLY H . 2.200 3.520 3.533 3.492 3.575 0.055 8 0 "[ . 1 . 2]" 1
499 1 65 ASP H 1 66 GLY H 2.500 . 2.700 2.382 2.196 2.545 . 0 0 "[ . 1 . 2]" 1
500 1 65 ASP HA 1 67 GLY H 4.000 2.200 4.350 4.157 3.819 4.555 0.205 15 0 "[ . 1 . 2]" 1
501 1 65 ASP HA 1 68 ASN H 4.000 2.200 5.000 3.848 3.469 4.759 . 0 0 "[ . 1 . 2]" 1
502 1 65 ASP HA 1 68 ASN QB 3.000 2.200 3.300 3.294 2.702 4.022 0.722 8 2 "[ - . + 1 . 2]" 1
503 1 65 ASP H 1 65 ASP HA 2.500 . 2.900 2.895 2.855 2.936 0.036 15 0 "[ . 1 . 2]" 1
504 1 66 GLY H 1 67 GLY H 2.500 . 2.700 2.527 2.348 2.704 0.004 11 0 "[ . 1 . 2]" 1
505 1 66 GLY HA2 1 67 GLY H 4.000 2.200 5.000 3.463 3.402 3.519 . 0 0 "[ . 1 . 2]" 1
506 1 66 GLY H 1 66 GLY HA3 3.000 . 3.500 2.307 2.292 2.334 . 0 0 "[ . 1 . 2]" 1
507 1 67 GLY H 1 68 ASN H 2.500 . 2.700 2.552 2.301 2.983 0.283 1 0 "[ . 1 . 2]" 1
508 1 68 ASN HA 1 69 LYS H 4.000 2.200 5.000 3.431 3.305 3.528 . 0 0 "[ . 1 . 2]" 1
509 1 68 ASN H 1 69 LYS H 2.500 . 2.700 2.186 1.602 2.531 0.098 3 0 "[ . 1 . 2]" 1
510 1 68 ASN QB 1 69 LYS H . 2.200 3.480 2.961 2.572 3.312 . 0 0 "[ . 1 . 2]" 1
511 1 68 ASN HA 1 70 GLU H 4.000 2.200 5.000 4.029 3.549 4.447 . 0 0 "[ . 1 . 2]" 1
512 1 68 ASN H 1 68 ASN HA 2.500 . 2.900 2.899 2.840 2.948 0.048 2 0 "[ . 1 . 2]" 1
513 1 68 ASN H 1 68 ASN QB . . 2.900 2.374 2.188 2.747 . 0 0 "[ . 1 . 2]" 1
514 1 69 LYS HA 1 70 GLU H 3.000 . 3.500 3.447 3.252 3.539 0.039 14 0 "[ . 1 . 2]" 1
515 1 69 LYS H 1 70 GLU H 2.500 . 2.700 2.406 2.238 2.596 . 0 0 "[ . 1 . 2]" 1
516 1 69 LYS HB3 1 70 GLU H 4.000 2.200 5.000 3.030 2.648 3.575 . 0 0 "[ . 1 . 2]" 1
517 1 69 LYS HB2 1 70 GLU H 4.000 2.200 5.000 4.067 3.857 4.259 . 0 0 "[ . 1 . 2]" 1
518 1 69 LYS H 1 69 LYS HA . . 2.800 2.881 2.839 2.917 0.117 9 0 "[ . 1 . 2]" 1
519 1 69 LYS H 1 69 LYS HB2 3.000 . 3.500 2.605 2.417 2.747 . 0 0 "[ . 1 . 2]" 1
520 1 69 LYS H 1 69 LYS HB3 2.500 . 2.900 2.525 2.380 2.669 . 0 0 "[ . 1 . 2]" 1
521 1 69 LYS HA 1 69 LYS HB2 2.500 . 2.700 2.488 2.410 2.564 . 0 0 "[ . 1 . 2]" 1
522 1 69 LYS HA 1 69 LYS HB3 4.000 2.200 5.000 3.023 3.015 3.028 . 0 0 "[ . 1 . 2]" 1
523 1 70 GLU H 1 70 GLU HA 2.500 . 2.770 2.854 2.816 2.896 0.126 4 0 "[ . 1 . 2]" 1
524 1 70 GLU H 1 70 GLU QB 3.000 . 4.500 2.211 2.057 2.500 . 0 0 "[ . 1 . 2]" 1
525 1 70 GLU HA 1 70 GLU QB 2.500 . 3.400 2.462 2.341 2.542 . 0 0 "[ . 1 . 2]" 1
526 2 1 LEU HA 2 1 LEU HB3 2.500 . 2.700 3.002 3.001 3.003 0.303 10 0 "[ . 1 . 2]" 1
527 2 1 LEU HA 2 1 LEU HB2 4.000 2.200 5.000 2.571 2.571 2.572 . 0 0 "[ . 1 . 2]" 1
528 2 2 ARG HA 2 3 GLU H 2.500 . 2.700 3.545 3.544 3.547 0.847 8 20 [*******+-***********] 1
529 2 2 ARG H 2 2 ARG HB2 4.000 2.200 5.000 3.889 3.888 3.891 . 0 0 "[ . 1 . 2]" 1
530 2 2 ARG H 2 2 ARG HB3 3.000 . 3.500 3.336 3.335 3.338 . 0 0 "[ . 1 . 2]" 1
531 2 2 ARG H 2 2 ARG QD 3.000 . 4.500 4.410 4.408 4.411 . 0 0 "[ . 1 . 2]" 1
532 2 2 ARG HA 2 2 ARG HB2 3.000 . 3.300 2.476 2.475 2.478 . 0 0 "[ . 1 . 2]" 1
533 2 2 ARG HA 2 2 ARG HB3 4.000 2.200 5.000 2.392 2.391 2.393 . 0 0 "[ . 1 . 2]" 1
534 2 3 GLU HA 2 4 LEU H 2.500 . 2.700 2.073 2.071 2.075 . 0 0 "[ . 1 . 2]" 1
535 2 3 GLU H 2 3 GLU HA 4.000 2.200 5.000 2.903 2.902 2.904 . 0 0 "[ . 1 . 2]" 1
536 2 3 GLU H 2 3 GLU QB . 2.200 2.770 2.792 2.791 2.793 0.023 20 0 "[ . 1 . 2]" 1
537 2 3 GLU HA 2 3 GLU QB 2.500 2.200 2.700 2.394 2.393 2.394 . 0 0 "[ . 1 . 2]" 1
538 2 4 LEU HA 2 5 ARG H 2.500 . 2.560 2.146 2.145 2.147 . 0 0 "[ . 1 . 2]" 1
539 2 4 LEU H 2 4 LEU HA . 2.200 2.930 2.958 2.957 2.959 0.029 7 0 "[ . 1 . 2]" 1
540 2 4 LEU H 2 4 LEU HB2 2.500 . 2.900 2.612 2.611 2.614 . 0 0 "[ . 1 . 2]" 1
541 2 4 LEU H 2 4 LEU HB3 4.000 2.200 5.000 3.767 3.765 3.769 . 0 0 "[ . 1 . 2]" 1
542 2 4 LEU HA 2 4 LEU HB2 4.000 2.200 5.000 3.029 3.027 3.030 . 0 0 "[ . 1 . 2]" 1
543 2 4 LEU HA 2 4 LEU HB3 2.500 . 2.700 2.495 2.494 2.496 . 0 0 "[ . 1 . 2]" 1
544 2 4 LEU HG 2 31 GLN QB 4.000 2.300 6.000 4.504 4.389 4.662 . 0 0 "[ . 1 . 2]" 1
545 2 5 ARG HA 2 6 CYS H 2.500 . 2.700 2.246 2.244 2.247 . 0 0 "[ . 1 . 2]" 1
546 2 5 ARG HA 2 31 GLN HA 4.800 3.100 5.800 5.328 4.900 5.941 0.141 12 0 "[ . 1 . 2]" 1
547 2 5 ARG HA 2 31 GLN QB 4.000 3.000 4.660 4.252 3.969 4.526 . 0 0 "[ . 1 . 2]" 1
548 2 5 ARG H 2 5 ARG QB . 2.200 3.270 2.632 2.630 2.634 . 0 0 "[ . 1 . 2]" 1
549 2 5 ARG H 2 5 ARG QD 3.000 . 4.500 3.110 3.108 3.110 . 0 0 "[ . 1 . 2]" 1
550 2 5 ARG HA 2 5 ARG QB 3.000 2.200 3.020 2.304 2.303 2.306 . 0 0 "[ . 1 . 2]" 1
551 2 6 CYS HA 2 7 VAL H 2.500 . 2.700 2.287 2.285 2.288 . 0 0 "[ . 1 . 2]" 1
552 2 6 CYS HB3 2 7 VAL H 3.000 . 3.300 2.818 2.816 2.820 . 0 0 "[ . 1 . 2]" 1
553 2 6 CYS HB2 2 7 VAL H 4.000 2.800 4.420 4.020 4.019 4.021 . 0 0 "[ . 1 . 2]" 1
554 2 6 CYS HA 2 8 CYS H 4.000 2.200 4.010 4.030 4.028 4.033 0.023 7 0 "[ . 1 . 2]" 1
555 2 6 CYS HB3 2 8 CYS H 3.000 2.300 3.020 2.488 2.486 2.489 . 0 0 "[ . 1 . 2]" 1
556 2 6 CYS HB3 2 32 CYS QB 4.000 3.500 6.000 3.350 3.255 3.445 0.245 9 0 "[ . 1 . 2]" 1
557 2 6 CYS HB2 2 32 CYS QB 4.000 3.500 24.000 4.267 4.151 4.360 . 0 0 "[ . 1 . 2]" 1
558 2 6 CYS HA 2 32 CYS QB 2.500 2.200 2.700 2.098 1.967 2.207 0.233 9 0 "[ . 1 . 2]" 1
559 2 6 CYS H 2 6 CYS HB3 . 2.200 3.480 3.565 3.564 3.567 0.087 9 0 "[ . 1 . 2]" 1
560 2 6 CYS H 2 6 CYS HB2 2.500 . 2.900 2.351 2.349 2.352 . 0 0 "[ . 1 . 2]" 1
561 2 6 CYS HA 2 6 CYS HB3 2.500 . 2.700 2.581 2.579 2.582 . 0 0 "[ . 1 . 2]" 1
562 2 6 CYS HA 2 6 CYS HB2 4.000 2.200 5.000 3.017 3.015 3.018 . 0 0 "[ . 1 . 2]" 1
563 2 7 VAL HA 2 8 CYS H . 2.200 3.300 3.427 3.425 3.429 0.129 12 0 "[ . 1 . 2]" 1
564 2 7 VAL H 2 8 CYS H 2.500 . 2.650 2.629 2.627 2.630 . 0 0 "[ . 1 . 2]" 1
565 2 7 VAL MG1 2 38 VAL MG2 4.000 2.300 6.500 3.932 3.734 4.130 . 0 0 "[ . 1 . 2]" 1
566 2 8 CYS HA 2 9 LEU H 2.500 . 2.700 2.157 2.156 2.159 . 0 0 "[ . 1 . 2]" 1
567 2 8 CYS QB 2 9 LEU H . 2.200 3.890 3.602 3.601 3.603 . 0 0 "[ . 1 . 2]" 1
568 2 8 CYS HA 2 10 GLN H . 2.200 3.580 3.536 3.533 3.537 . 0 0 "[ . 1 . 2]" 1
569 2 8 CYS QB 2 10 GLN H 4.000 2.200 5.000 3.722 3.721 3.723 . 0 0 "[ . 1 . 2]" 1
570 2 8 CYS QB 2 48 CYS QB 4.000 2.800 5.000 2.401 2.400 2.402 0.400 14 0 "[ . 1 . 2]" 1
571 2 8 CYS H 2 8 CYS HA 3.000 . 3.500 2.953 2.952 2.954 . 0 0 "[ . 1 . 2]" 1
572 2 8 CYS H 2 8 CYS QB 2.500 2.200 2.740 2.421 2.420 2.423 . 0 0 "[ . 1 . 2]" 1
573 2 8 CYS QB 2 37 VAL MG2 4.000 2.300 6.500 5.996 5.724 6.526 0.026 3 0 "[ . 1 . 2]" 1
574 2 8 CYS HA 2 8 CYS QB . 2.200 2.700 2.426 2.425 2.427 . 0 0 "[ . 1 . 2]" 1
575 2 9 LEU HA 2 10 GLN H . 2.200 3.480 3.444 3.444 3.446 . 0 0 "[ . 1 . 2]" 1
576 2 9 LEU H 2 10 GLN H 2.500 . 2.650 2.425 2.422 2.427 . 0 0 "[ . 1 . 2]" 1
577 2 9 LEU H 2 9 LEU HA . 2.200 2.830 2.889 2.888 2.890 0.060 6 0 "[ . 1 . 2]" 1
578 2 10 GLN HA 2 11 THR H 2.500 . 2.700 2.540 2.538 2.541 . 0 0 "[ . 1 . 2]" 1
579 2 10 GLN H 2 11 THR H 4.000 2.200 4.690 4.375 4.374 4.377 . 0 0 "[ . 1 . 2]" 1
580 2 10 GLN QB 2 11 THR H 3.000 . 4.300 2.079 2.078 2.081 . 0 0 "[ . 1 . 2]" 1
581 2 10 GLN H 2 11 THR HA 4.000 2.200 5.000 5.020 5.018 5.022 0.022 14 0 "[ . 1 . 2]" 1
582 2 10 GLN H 2 11 THR HB 2.500 . 3.900 5.827 5.826 5.829 1.929 14 20 [********-****+******] 1
583 2 10 GLN HA 2 11 THR HB 2.500 . 3.700 4.215 4.214 4.216 0.516 20 20 [***-***************+] 1
584 2 10 GLN QG 2 48 CYS QB 2.500 . 3.900 3.125 3.124 3.128 . 0 0 "[ . 1 . 2]" 1
585 2 10 GLN QG 2 48 CYS H 2.500 . 3.700 4.170 4.168 4.172 0.472 8 0 "[ . 1 . 2]" 1
586 2 11 THR HA 2 12 THR H . . 2.520 2.660 2.658 2.662 0.142 3 0 "[ . 1 . 2]" 1
587 2 11 THR H 2 12 THR H 4.000 2.200 5.000 4.335 4.334 4.337 . 0 0 "[ . 1 . 2]" 1
588 2 11 THR HB 2 12 THR H . . 2.680 3.544 3.543 3.546 0.866 1 20 [+******************-] 1
589 2 8 CYS QB 2 11 THR MG 4.000 3.000 4.640 6.198 6.198 6.199 1.559 8 20 [-******+************] 1
590 2 10 GLN HA 2 11 THR MG 4.000 3.000 6.400 3.698 3.696 3.699 . 0 0 "[ . 1 . 2]" 1
591 2 11 THR MG 2 12 THR H 4.000 2.300 4.640 2.900 2.899 2.901 . 0 0 "[ . 1 . 2]" 1
592 2 11 THR HB 2 50 ASP QB . 2.200 3.670 3.039 2.864 3.224 . 0 0 "[ . 1 . 2]" 1
593 2 11 THR HB 2 50 ASP H 3.000 . 3.500 4.839 4.790 4.899 1.399 3 20 [**+*****-***********] 1
594 2 11 THR MG 2 50 ASP H 3.000 . 4.800 4.865 4.830 4.911 0.111 3 0 "[ . 1 . 2]" 1
595 2 11 THR MG 2 48 CYS HA 4.000 . 6.530 7.427 7.426 7.428 0.898 7 20 [******+****-********] 1
596 2 11 THR MG 2 48 CYS QB 3.000 2.300 4.390 5.221 5.220 5.222 0.832 13 20 [***-********+*******] 1
597 2 11 THR HA 2 49 LEU HA 3.000 . 4.800 3.901 3.900 3.903 . 0 0 "[ . 1 . 2]" 1
598 2 11 THR MG 2 49 LEU HA 3.000 2.300 4.800 5.281 5.280 5.282 0.482 10 0 "[ . 1 . 2]" 1
599 2 11 THR H 2 11 THR HA 4.000 2.200 5.000 2.946 2.944 2.948 . 0 0 "[ . 1 . 2]" 1
600 2 11 THR H 2 11 THR HB 4.000 2.200 5.000 3.110 3.108 3.112 . 0 0 "[ . 1 . 2]" 1
601 2 11 THR HA 2 11 THR HB 2.500 . 2.650 2.426 2.425 2.427 . 0 0 "[ . 1 . 2]" 1
602 2 12 THR HA 2 13 GLN H 3.000 . 3.080 2.193 2.192 2.194 . 0 0 "[ . 1 . 2]" 1
603 2 12 THR HB 2 13 GLN H 4.000 2.300 4.080 3.798 3.797 3.799 . 0 0 "[ . 1 . 2]" 1
604 2 12 THR HB 2 13 GLN HA 4.000 3.000 6.000 4.732 4.730 4.733 . 0 0 "[ . 1 . 2]" 1
605 2 12 THR H 2 48 CYS H 4.000 2.200 5.000 5.392 5.390 5.393 0.393 10 0 "[ . 1 . 2]" 1
606 2 12 THR HG1 2 47 ILE MD 4.000 2.300 6.500 3.850 3.786 3.898 . 0 0 "[ . 1 . 2]" 1
607 2 12 THR H 2 12 THR HA 4.000 2.200 5.000 2.880 2.879 2.881 . 0 0 "[ . 1 . 2]" 1
608 2 12 THR H 2 12 THR HB 2.500 . 3.710 2.957 2.955 2.958 . 0 0 "[ . 1 . 2]" 1
609 2 12 THR HA 2 12 THR HB 2.500 . 3.700 3.027 3.026 3.028 . 0 0 "[ . 1 . 2]" 1
610 2 13 GLN HA 2 14 GLY H 3.000 . 3.420 2.326 2.324 2.328 . 0 0 "[ . 1 . 2]" 1
611 2 13 GLN H 2 14 GLY H 3.000 . 3.500 3.339 3.337 3.341 . 0 0 "[ . 1 . 2]" 1
612 2 13 GLN QB 2 14 GLY H 4.000 2.300 6.000 3.899 3.897 3.900 . 0 0 "[ . 1 . 2]" 1
613 2 13 GLN H 2 13 GLN HA 4.000 2.200 5.000 2.916 2.912 2.918 . 0 0 "[ . 1 . 2]" 1
614 2 13 GLN H 2 13 GLN QB . . 2.770 3.042 3.041 3.044 0.274 19 0 "[ . 1 . 2]" 1
615 2 13 GLN HA 2 13 GLN QB 2.500 . 2.700 2.156 2.154 2.157 . 0 0 "[ . 1 . 2]" 1
616 2 15 VAL HA 2 16 HIS H 2.500 . 2.700 2.738 2.736 2.739 0.039 3 0 "[ . 1 . 2]" 1
617 2 15 VAL H 2 15 VAL HA 3.000 . 3.500 2.460 2.458 2.461 . 0 0 "[ . 1 . 2]" 1
618 2 16 HIS HA 2 17 PRO QD 2.500 . 2.700 1.970 1.969 1.972 . 0 0 "[ . 1 . 2]" 1
619 2 16 HIS H 2 17 PRO QD 4.000 2.300 7.000 4.326 4.325 4.328 . 0 0 "[ . 1 . 2]" 1
620 2 16 HIS H 2 19 MET H 4.000 2.800 6.000 4.377 4.373 4.404 . 0 0 "[ . 1 . 2]" 1
621 2 16 HIS HD2 2 17 PRO QD 4.000 2.200 5.000 3.379 3.378 3.381 . 0 0 "[ . 1 . 2]" 1
622 2 16 HIS HD2 2 18 LYS HB2 4.000 2.300 6.000 4.882 4.880 4.884 . 0 0 "[ . 1 . 2]" 1
623 2 16 HIS HE1 2 17 PRO QD 4.000 2.200 5.000 3.358 3.356 3.360 . 0 0 "[ . 1 . 2]" 1
624 2 16 HIS HE1 2 17 PRO HG2 4.000 2.200 5.000 4.201 4.199 4.204 . 0 0 "[ . 1 . 2]" 1
625 2 16 HIS HE1 2 18 LYS HB2 3.000 . 3.300 3.155 3.153 3.157 . 0 0 "[ . 1 . 2]" 1
626 2 16 HIS HE1 2 18 LYS HB3 4.000 3.000 6.000 4.900 4.898 4.903 . 0 0 "[ . 1 . 2]" 1
627 2 16 HIS HE1 2 18 LYS H 3.000 . 3.300 3.295 3.294 3.296 . 0 0 "[ . 1 . 2]" 1
628 2 16 HIS HE1 2 18 LYS HA 4.000 2.200 5.000 4.118 4.116 4.119 . 0 0 "[ . 1 . 2]" 1
629 2 16 HIS HE1 2 18 LYS QD 4.000 2.300 6.000 3.950 3.948 3.952 . 0 0 "[ . 1 . 2]" 1
630 2 16 HIS HE1 2 18 LYS QE 4.000 3.000 7.000 5.526 5.524 5.527 . 0 0 "[ . 1 . 2]" 1
631 2 16 HIS HA 2 17 PRO QG 4.000 2.300 6.000 3.899 3.898 3.900 . 0 0 "[ . 1 . 2]" 1
632 2 16 HIS HA 2 59 VAL HB 3.000 . 3.300 4.055 3.769 4.347 1.047 7 17 "[****-*+* *** **** **]" 1
633 2 16 HIS HA 2 59 VAL QG 4.000 2.300 7.500 2.930 2.796 3.324 . 0 0 "[ . 1 . 2]" 1
634 2 16 HIS H 2 16 HIS QB 2.500 . 2.900 2.483 2.481 2.484 . 0 0 "[ . 1 . 2]" 1
635 2 16 HIS HA 2 16 HIS QB 2.500 2.200 2.700 2.408 2.407 2.409 . 0 0 "[ . 1 . 2]" 1
636 2 16 HIS HA 2 16 HIS HD2 3.000 . 3.300 3.477 3.476 3.479 0.179 9 0 "[ . 1 . 2]" 1
637 2 16 HIS QB 2 16 HIS HD2 . 2.800 3.300 2.591 2.589 2.592 0.211 6 0 "[ . 1 . 2]" 1
638 2 17 PRO HA 2 18 LYS H 4.000 2.200 5.000 3.488 3.487 3.489 . 0 0 "[ . 1 . 2]" 1
639 2 17 PRO HA 2 19 MET H 4.000 2.200 5.000 3.853 3.836 3.881 . 0 0 "[ . 1 . 2]" 1
640 2 17 PRO HA 2 20 ILE H 4.000 2.200 5.000 3.120 3.059 3.944 . 0 0 "[ . 1 . 2]" 1
641 2 17 PRO HA 2 20 ILE QG 3.000 . 4.300 2.342 2.151 2.693 . 0 0 "[ . 1 . 2]" 1
642 2 17 PRO HA 2 59 VAL HB 4.000 2.200 5.000 3.899 3.441 4.879 . 0 0 "[ . 1 . 2]" 1
643 2 17 PRO HA 2 59 VAL QG 4.000 2.300 4.260 4.307 4.003 5.018 0.758 13 1 "[ . 1 + . 2]" 1
644 2 17 PRO QD 2 59 VAL QG 4.000 2.300 6.500 2.239 2.015 2.975 0.285 8 0 "[ . 1 . 2]" 1
645 2 18 LYS HA 2 19 MET H . 2.200 3.480 3.488 3.482 3.522 0.042 20 0 "[ . 1 . 2]" 1
646 2 18 LYS H 2 19 MET H 3.000 . 3.500 2.806 2.798 2.859 . 0 0 "[ . 1 . 2]" 1
647 2 18 LYS H 2 18 LYS HA 4.000 2.200 5.000 2.749 2.748 2.751 . 0 0 "[ . 1 . 2]" 1
648 2 18 LYS HA 2 18 LYS HB3 2.500 . 2.700 2.961 2.960 2.963 0.263 18 0 "[ . 1 . 2]" 1
649 2 18 LYS HA 2 18 LYS HB2 3.000 . 3.300 2.698 2.697 2.700 . 0 0 "[ . 1 . 2]" 1
650 2 19 MET HA 2 20 ILE H 4.000 2.200 5.000 3.394 2.947 3.437 . 0 0 "[ . 1 . 2]" 1
651 2 19 MET QB 2 20 ILE H 4.000 2.200 4.140 3.148 3.034 3.775 . 0 0 "[ . 1 . 2]" 1
652 2 16 HIS H 2 19 MET QB 3.000 . 3.300 4.121 3.950 4.235 0.935 20 20 [********-**********+] 1
653 2 16 HIS QB 2 19 MET QB 4.000 2.200 5.000 4.608 4.390 4.697 . 0 0 "[ . 1 . 2]" 1
654 2 18 LYS QD 2 19 MET H 4.000 2.300 6.000 5.423 5.414 5.467 . 0 0 "[ . 1 . 2]" 1
655 2 19 MET HA 2 42 LYS H 4.000 2.200 4.070 4.231 3.574 5.181 1.111 6 5 "[ .+ 1-* . **]" 1
656 2 19 MET QB 2 42 LYS H 4.000 2.800 4.260 4.405 3.603 5.412 1.152 6 3 "[ .+ 1 * . -2]" 1
657 2 19 MET H 2 19 MET QB . 2.200 2.900 2.334 2.186 2.384 0.014 9 0 "[ . 1 . 2]" 1
658 2 20 ILE HA 2 21 SER H . . 2.400 2.241 2.183 2.307 . 0 0 "[ . 1 . 2]" 1
659 2 20 ILE HB 2 21 SER H 4.000 2.200 5.000 3.865 3.654 4.056 . 0 0 "[ . 1 . 2]" 1
660 2 20 ILE HA 2 22 ASN H 3.000 . 3.500 3.655 3.566 3.792 0.292 20 0 "[ . 1 . 2]" 1
661 2 17 PRO HA 2 20 ILE MG 4.000 . 4.360 4.067 3.907 4.182 . 0 0 "[ . 1 . 2]" 1
662 2 20 ILE MG 2 23 LEU HB2 4.000 2.200 5.000 3.591 3.243 4.135 . 0 0 "[ . 1 . 2]" 1
663 2 20 ILE MG 2 23 LEU HG 4.000 2.300 6.500 5.731 5.435 6.080 . 0 0 "[ . 1 . 2]" 1
664 2 19 MET QB 2 20 ILE MD 3.000 2.300 4.800 3.135 2.922 3.522 . 0 0 "[ . 1 . 2]" 1
665 2 20 ILE HA 2 41 LEU HA . . 2.460 2.600 2.169 3.003 0.543 6 2 "[ .+ 1 - . 2]" 1
666 2 20 ILE HA 2 40 SER H 4.000 2.200 5.000 4.945 4.548 5.473 0.473 6 0 "[ . 1 . 2]" 1
667 2 20 ILE HA 2 42 LYS H 4.000 2.200 5.000 4.233 3.729 4.728 . 0 0 "[ . 1 . 2]" 1
668 2 20 ILE MG 2 40 SER H 4.000 2.300 6.500 3.289 2.788 3.751 . 0 0 "[ . 1 . 2]" 1
669 2 20 ILE MG 2 39 ALA HA 4.000 2.300 6.500 3.879 3.463 4.309 . 0 0 "[ . 1 . 2]" 1
670 2 20 ILE MG 2 41 LEU HA 4.000 2.300 6.500 3.953 3.656 4.386 . 0 0 "[ . 1 . 2]" 1
671 2 20 ILE MG 2 41 LEU QD 4.000 2.300 8.000 4.080 3.856 4.530 . 0 0 "[ . 1 . 2]" 1
672 2 20 ILE MD 2 40 SER H 4.000 2.300 7.500 4.193 3.583 4.737 . 0 0 "[ . 1 . 2]" 1
673 2 20 ILE H 2 20 ILE HA 2.500 . 2.800 2.916 2.870 2.956 0.156 4 0 "[ . 1 . 2]" 1
674 2 20 ILE H 2 20 ILE HB 2.500 . 2.740 2.646 2.586 2.739 . 0 0 "[ . 1 . 2]" 1
675 2 20 ILE HA 2 20 ILE HB 4.000 2.200 5.000 3.018 3.010 3.029 . 0 0 "[ . 1 . 2]" 1
676 2 20 ILE HA 2 20 ILE QG 3.000 . 3.520 3.041 2.949 3.094 . 0 0 "[ . 1 . 2]" 1
677 2 20 ILE HA 2 20 ILE MG 2.500 . 4.200 2.326 2.263 2.406 . 0 0 "[ . 1 . 2]" 1
678 2 20 ILE HA 2 20 ILE MD 2.500 . 4.200 2.171 2.119 2.245 . 0 0 "[ . 1 . 2]" 1
679 2 20 ILE HB 2 20 ILE MD 4.000 2.300 6.500 3.240 3.233 3.243 . 0 0 "[ . 1 . 2]" 1
680 2 21 SER HA 2 22 ASN H . 2.200 3.450 3.262 3.127 3.452 0.002 20 0 "[ . 1 . 2]" 1
681 2 21 SER H 2 22 ASN H 2.500 . 2.560 1.763 1.631 1.920 0.169 5 0 "[ . 1 . 2]" 1
682 2 21 SER QB 2 22 ASN H 3.000 2.200 3.830 3.405 2.962 3.595 . 0 0 "[ . 1 . 2]" 1
683 2 21 SER H 2 42 LYS H . 2.200 3.860 4.616 4.109 5.019 1.159 8 18 "[***** +**********-*]" 1
684 2 21 SER H 2 21 SER HA 2.500 . 2.700 2.922 2.910 2.932 0.232 13 0 "[ . 1 . 2]" 1
685 2 21 SER H 2 21 SER QB . 2.200 2.930 2.725 2.679 2.780 . 0 0 "[ . 1 . 2]" 1
686 2 21 SER HA 2 21 SER QB 2.500 2.200 2.700 2.383 2.367 2.411 . 0 0 "[ . 1 . 2]" 1
687 2 22 ASN HA 2 23 LEU H . . 2.460 2.194 2.150 2.243 . 0 0 "[ . 1 . 2]" 1
688 2 22 ASN H 2 23 LEU H 4.000 2.200 5.000 4.224 4.100 4.357 . 0 0 "[ . 1 . 2]" 1
689 2 22 ASN QB 2 23 LEU H . 2.200 3.060 3.675 3.569 3.810 0.750 8 20 [*******+****-*******] 1
690 2 22 ASN H 2 40 SER H . . 2.870 3.493 3.334 3.701 0.831 7 17 "[***-**+* *** **** **]" 1
691 2 22 ASN H 2 42 LYS H 4.000 2.200 5.000 6.189 5.647 6.861 1.861 8 20 [*****-*+************] 1
692 2 22 ASN H 2 22 ASN HA 4.000 2.200 5.000 2.898 2.852 2.940 . 0 0 "[ . 1 . 2]" 1
693 2 22 ASN H 2 22 ASN QB . 2.200 3.800 2.752 2.589 2.882 . 0 0 "[ . 1 . 2]" 1
694 2 22 ASN HA 2 22 ASN QB 2.500 2.200 2.700 2.339 2.270 2.395 . 0 0 "[ . 1 . 2]" 1
695 2 23 LEU HA 2 24 GLN H 2.500 . 2.700 2.186 2.134 2.280 . 0 0 "[ . 1 . 2]" 1
696 2 23 LEU HB3 2 24 GLN H 4.000 2.200 5.000 4.148 3.817 4.388 . 0 0 "[ . 1 . 2]" 1
697 2 23 LEU HA 2 39 ALA HA 2.500 . 2.700 2.703 2.436 3.552 0.852 8 2 "[ . + 1 -. 2]" 1
698 2 23 LEU HA 2 40 SER H 4.000 2.200 5.000 3.914 3.414 4.680 . 0 0 "[ . 1 . 2]" 1
699 2 23 LEU H 2 23 LEU HA 2.500 . 2.900 2.941 2.927 2.947 0.047 2 0 "[ . 1 . 2]" 1
700 2 23 LEU H 2 23 LEU HB3 3.000 . 3.500 2.650 2.458 2.800 . 0 0 "[ . 1 . 2]" 1
701 2 23 LEU H 2 23 LEU HB2 2.500 . 2.900 3.129 2.991 3.265 0.365 3 0 "[ . 1 . 2]" 1
702 2 23 LEU HA 2 23 LEU HB2 3.000 . 3.300 2.441 2.378 2.513 . 0 0 "[ . 1 . 2]" 1
703 2 24 GLN HA 2 25 VAL H . . 2.460 2.143 2.124 2.169 . 0 0 "[ . 1 . 2]" 1
704 2 24 GLN HB3 2 25 VAL H 4.000 2.200 5.000 3.504 3.275 3.771 . 0 0 "[ . 1 . 2]" 1
705 2 24 GLN HB2 2 25 VAL H 4.000 2.200 5.000 4.324 4.201 4.513 . 0 0 "[ . 1 . 2]" 1
706 2 23 LEU MD1 2 24 GLN HA 4.000 2.300 6.500 4.662 4.387 5.141 . 0 0 "[ . 1 . 2]" 1
707 2 24 GLN HA 2 25 VAL HB 4.000 2.200 5.000 4.775 4.703 4.842 . 0 0 "[ . 1 . 2]" 1
708 2 24 GLN HA 2 25 VAL MG2 4.000 2.300 6.500 3.508 3.363 3.647 . 0 0 "[ . 1 . 2]" 1
709 2 24 GLN H 2 38 VAL H . 2.200 3.270 3.979 3.582 4.292 1.022 14 17 "[******** *-* +** ***]" 1
710 2 24 GLN H 2 24 GLN HA . . 2.900 2.939 2.926 2.949 0.049 10 0 "[ . 1 . 2]" 1
711 2 24 GLN H 2 24 GLN HB3 4.000 2.200 5.000 3.762 3.672 3.860 . 0 0 "[ . 1 . 2]" 1
712 2 24 GLN H 2 24 GLN HB2 2.500 . 2.900 2.640 2.469 2.805 . 0 0 "[ . 1 . 2]" 1
713 2 24 GLN HA 2 24 GLN HB3 3.000 . 3.300 2.499 2.371 2.631 . 0 0 "[ . 1 . 2]" 1
714 2 24 GLN HA 2 24 GLN HB2 2.500 . 2.700 3.018 2.991 3.027 0.327 14 0 "[ . 1 . 2]" 1
715 2 25 VAL HA 2 26 PHE H 2.500 . 2.700 2.154 2.116 2.229 . 0 0 "[ . 1 . 2]" 1
716 2 25 VAL HB 2 26 PHE H 4.000 2.200 4.720 4.173 3.734 4.368 . 0 0 "[ . 1 . 2]" 1
717 2 24 GLN QB 2 25 VAL HA 4.000 2.300 7.000 4.317 4.229 4.421 . 0 0 "[ . 1 . 2]" 1
718 2 25 VAL HA 2 37 VAL HA 2.500 . 2.700 2.888 2.493 3.288 0.588 8 1 "[ . + 1 . 2]" 1
719 2 25 VAL HA 2 38 VAL H . 2.200 3.270 3.688 3.234 4.352 1.082 8 8 "[ .* +***- . **]" 1
720 2 25 VAL HA 2 38 VAL MG1 4.000 2.300 6.000 4.706 4.108 5.366 . 0 0 "[ . 1 . 2]" 1
721 2 25 VAL H 2 25 VAL HA 4.000 2.200 5.000 2.935 2.921 2.947 . 0 0 "[ . 1 . 2]" 1
722 2 25 VAL H 2 25 VAL HB 2.500 . 2.680 2.686 2.629 2.780 0.100 17 0 "[ . 1 . 2]" 1
723 2 25 VAL HA 2 25 VAL HB . 2.200 2.870 3.016 3.005 3.022 0.152 6 0 "[ . 1 . 2]" 1
724 2 26 PHE HA 2 27 ALA H 2.500 . 2.700 2.187 2.132 2.259 . 0 0 "[ . 1 . 2]" 1
725 2 26 PHE H 2 27 ALA H 4.000 2.800 5.000 4.419 4.260 4.558 . 0 0 "[ . 1 . 2]" 1
726 2 26 PHE H 2 36 GLU H 3.000 . 3.500 3.841 3.340 4.172 0.672 2 5 "[ +**.- 1 . * 2]" 1
727 2 26 PHE H 2 38 VAL H 3.000 . 3.500 4.142 3.706 4.722 1.222 17 14 "[*** * -**** ** +**2]" 1
728 2 27 ALA HA 2 28 ILE H 2.500 . 2.700 2.923 2.780 3.504 0.804 12 1 "[ . 1 + . 2]" 1
729 2 27 ALA H 2 28 ILE H 4.000 2.800 5.000 4.218 3.182 4.389 . 0 0 "[ . 1 . 2]" 1
730 2 27 ALA MB 2 28 ILE H 4.000 2.200 5.000 1.784 1.752 1.831 0.448 19 0 "[ . 1 . 2]" 1
731 2 27 ALA HA 2 35 VAL HA . . 2.930 3.345 2.761 4.215 1.285 12 8 "[ * ** 1 + ** -* 2]" 1
732 2 27 ALA HA 2 36 GLU H . 2.200 3.860 4.458 3.993 5.238 1.378 12 13 "[-** ** ** + ** ***2]" 1
733 2 27 ALA HA 2 35 VAL QG 3.000 . 4.800 2.086 1.929 2.419 . 0 0 "[ . 1 . 2]" 1
734 2 27 ALA H 2 27 ALA HA 4.000 2.200 5.000 2.913 2.891 2.950 . 0 0 "[ . 1 . 2]" 1
735 2 27 ALA H 2 27 ALA MB 2.500 . 2.900 2.316 2.277 2.426 . 0 0 "[ . 1 . 2]" 1
736 2 27 ALA HA 2 27 ALA MB . . 2.700 2.127 2.124 2.129 . 0 0 "[ . 1 . 2]" 1
737 2 28 ILE HA 2 29 GLY H 2.500 . 2.680 2.154 2.133 2.222 . 0 0 "[ . 1 . 2]" 1
738 2 28 ILE H 2 29 GLY H 4.000 2.200 5.000 4.503 4.307 4.604 . 0 0 "[ . 1 . 2]" 1
739 2 28 ILE HA 2 32 CYS H 4.000 2.200 4.480 5.088 4.762 5.710 1.230 12 13 "[ * ****** +*** -*2]" 1
740 2 28 ILE H 2 35 VAL H 4.000 2.200 5.000 6.268 5.535 7.799 2.799 12 20 [*******-***+********] 1
741 2 28 ILE H 2 36 GLU H 4.000 2.200 5.000 6.696 6.216 7.369 2.369 12 20 [***********+-*******] 1
742 2 28 ILE HA 2 34 LYS H 4.000 2.200 5.000 4.395 3.077 6.372 1.372 12 2 "[ . 1 + -. 2]" 1
743 2 28 ILE HA 2 35 VAL H 4.000 2.200 5.000 5.610 5.116 6.185 1.185 17 12 "[*** - ** * *.*+ **]" 1
744 2 28 ILE H 2 28 ILE HA 4.000 2.200 5.000 2.857 2.831 2.949 . 0 0 "[ . 1 . 2]" 1
745 2 29 GLY QA 2 30 PRO HD3 . 2.200 2.440 2.086 1.978 2.118 0.222 12 0 "[ . 1 . 2]" 1
746 2 29 GLY QA 2 30 PRO HD2 . . 2.880 2.717 2.679 2.819 . 0 0 "[ . 1 . 2]" 1
747 2 29 GLY H 2 30 PRO QD 4.000 2.800 6.000 4.288 4.237 4.390 . 0 0 "[ . 1 . 2]" 1
748 2 29 GLY H 2 32 CYS H . 2.200 3.730 3.235 2.969 3.698 . 0 0 "[ . 1 . 2]" 1
749 2 30 PRO QD 2 31 GLN H 4.000 2.800 6.000 2.433 2.357 2.480 0.443 19 0 "[ . 1 . 2]" 1
750 2 30 PRO HA 2 30 PRO HB3 2.500 . 2.700 2.272 2.269 2.276 . 0 0 "[ . 1 . 2]" 1
751 2 31 GLN HA 2 32 CYS H 4.000 2.200 5.000 3.431 3.426 3.443 . 0 0 "[ . 1 . 2]" 1
752 2 31 GLN H 2 32 CYS H 2.500 . 2.700 2.058 2.025 2.112 . 0 0 "[ . 1 . 2]" 1
753 2 29 GLY QA 2 31 GLN QB 3.000 3.000 3.300 5.083 5.009 5.115 1.815 11 20 [**********+**-******] 1
754 2 30 PRO HD2 2 31 GLN QB 4.000 3.000 5.000 3.893 3.804 3.948 . 0 0 "[ . 1 . 2]" 1
755 2 31 GLN QB 2 32 CYS HA 4.000 3.000 6.000 4.722 4.642 4.790 . 0 0 "[ . 1 . 2]" 1
756 2 31 GLN QB 2 32 CYS QB 3.000 . 3.300 3.899 3.785 4.010 0.710 12 19 [****.***-**+********] 1
757 2 5 ARG H 2 31 GLN QB 4.000 2.800 4.630 3.382 3.151 3.657 . 0 0 "[ . 1 . 2]" 1
758 2 6 CYS HA 2 31 GLN QB 4.000 2.200 5.000 3.501 3.278 3.859 . 0 0 "[ . 1 . 2]" 1
759 2 31 GLN H 2 31 GLN HA 4.000 2.200 5.000 2.947 2.942 2.950 . 0 0 "[ . 1 . 2]" 1
760 2 31 GLN H 2 31 GLN QB . 2.300 3.420 2.850 2.812 2.873 . 0 0 "[ . 1 . 2]" 1
761 2 31 GLN HA 2 31 GLN QB 2.500 . 2.700 2.174 2.173 2.175 . 0 0 "[ . 1 . 2]" 1
762 2 32 CYS HA 2 33 SER H 2.500 . 2.700 2.192 2.130 2.372 . 0 0 "[ . 1 . 2]" 1
763 2 32 CYS QB 2 33 SER H 4.000 2.200 5.000 3.620 3.175 3.822 . 0 0 "[ . 1 . 2]" 1
764 2 32 CYS HA 2 34 LYS H . 2.200 3.610 3.832 3.423 4.473 0.863 12 3 "[ . - 1 + . *2]" 1
765 2 6 CYS H 2 32 CYS HA 4.000 2.200 5.000 4.767 4.341 5.020 0.020 9 0 "[ . 1 . 2]" 1
766 2 6 CYS H 2 32 CYS QB 4.000 2.200 5.000 4.362 4.232 4.474 . 0 0 "[ . 1 . 2]" 1
767 2 32 CYS H 2 32 CYS HA 3.000 . 3.500 2.923 2.903 2.938 . 0 0 "[ . 1 . 2]" 1
768 2 32 CYS H 2 32 CYS QB 3.000 . 3.500 2.687 2.618 2.756 . 0 0 "[ . 1 . 2]" 1
769 2 32 CYS HA 2 32 CYS QB 3.000 . 3.300 2.471 2.451 2.490 . 0 0 "[ . 1 . 2]" 1
770 2 33 SER HA 2 34 LYS H . 2.200 2.990 3.168 2.731 3.566 0.576 12 5 "[ . - 1 + ** *2]" 1
771 2 33 SER H 2 34 LYS H 2.500 . 2.700 2.538 2.078 3.121 0.421 8 0 "[ . 1 . 2]" 1
772 2 33 SER QB 2 34 LYS H 3.000 . 4.170 3.351 2.286 3.945 . 0 0 "[ . 1 . 2]" 1
773 2 33 SER H 2 33 SER HA 2.500 . 2.900 2.922 2.868 2.946 0.046 19 0 "[ . 1 . 2]" 1
774 2 33 SER H 2 33 SER QB 2.500 . 3.430 2.383 2.291 2.578 . 0 0 "[ . 1 . 2]" 1
775 2 34 LYS HA 2 35 VAL H 2.500 . 2.700 2.269 2.230 2.350 . 0 0 "[ . 1 . 2]" 1
776 2 34 LYS H 2 35 VAL H 4.000 2.200 5.000 4.465 4.296 4.620 . 0 0 "[ . 1 . 2]" 1
777 2 34 LYS QB 2 35 VAL H 3.000 2.200 3.500 3.514 3.368 3.607 0.107 15 0 "[ . 1 . 2]" 1
778 2 28 ILE HA 2 34 LYS HA 4.000 2.800 6.000 5.101 4.527 6.070 0.070 12 0 "[ . 1 . 2]" 1
779 2 34 LYS H 2 34 LYS HA 3.000 . 3.500 2.917 2.850 2.949 . 0 0 "[ . 1 . 2]" 1
780 2 34 LYS H 2 34 LYS QB . 2.200 2.930 2.505 2.255 2.847 . 0 0 "[ . 1 . 2]" 1
781 2 34 LYS HA 2 34 LYS QB 2.500 2.200 2.700 2.386 2.342 2.432 . 0 0 "[ . 1 . 2]" 1
782 2 35 VAL HA 2 36 GLU H 2.500 . 2.700 2.171 2.119 2.217 . 0 0 "[ . 1 . 2]" 1
783 2 35 VAL HB 2 36 GLU H . 2.200 3.610 3.149 2.912 3.509 . 0 0 "[ . 1 . 2]" 1
784 2 28 ILE H 2 35 VAL HA 3.000 . 3.500 5.080 4.458 6.192 2.692 12 20 [*******-***+********] 1
785 2 28 ILE H 2 35 VAL HB 4.000 2.200 5.000 6.018 5.071 7.018 2.018 17 16 "[***-** **** *.*+***]" 1
786 2 35 VAL H 2 35 VAL HA 4.000 2.200 5.000 2.881 2.853 2.912 . 0 0 "[ . 1 . 2]" 1
787 2 35 VAL H 2 35 VAL HB 2.500 . 2.900 3.639 3.606 3.664 0.764 8 20 [*******+-***********] 1
788 2 35 VAL HA 2 35 VAL HB 2.500 . 2.700 2.488 2.398 2.565 . 0 0 "[ . 1 . 2]" 1
789 2 36 GLU HA 2 37 VAL H 2.500 . 2.700 2.186 2.175 2.216 . 0 0 "[ . 1 . 2]" 1
790 2 36 GLU QB 2 37 VAL H 4.000 2.300 6.000 3.074 2.943 3.146 . 0 0 "[ . 1 . 2]" 1
791 2 36 GLU H 2 36 GLU HA 4.000 2.200 5.000 2.942 2.935 2.949 . 0 0 "[ . 1 . 2]" 1
792 2 37 VAL HA 2 38 VAL H . . 2.400 2.100 2.080 2.126 . 0 0 "[ . 1 . 2]" 1
793 2 37 VAL MG2 2 38 VAL H 3.000 . 4.800 4.291 4.243 4.325 . 0 0 "[ . 1 . 2]" 1
794 2 37 VAL H 2 49 LEU H 4.000 2.200 4.910 4.202 3.925 4.496 . 0 0 "[ . 1 . 2]" 1
795 2 26 PHE H 2 37 VAL HA . 2.200 3.110 3.459 3.013 3.946 0.836 17 6 "[ **-. ** . + 2]" 1
796 2 25 VAL MG2 2 37 VAL HA 3.000 . 4.800 3.907 3.414 4.630 . 0 0 "[ . 1 . 2]" 1
797 2 25 VAL MG1 2 37 VAL HA 4.000 2.300 6.500 3.734 3.154 4.480 . 0 0 "[ . 1 . 2]" 1
798 2 25 VAL HA 2 37 VAL MG2 4.000 2.300 6.500 5.159 4.898 5.563 . 0 0 "[ . 1 . 2]" 1
799 2 37 VAL MG2 2 49 LEU HB2 2.500 . 4.200 2.212 1.857 2.764 . 0 0 "[ . 1 . 2]" 1
800 2 25 VAL MG2 2 37 VAL MG2 3.000 . 6.300 4.701 4.431 5.247 . 0 0 "[ . 1 . 2]" 1
801 2 37 VAL MG2 2 49 LEU H 4.000 2.300 6.500 3.465 3.145 4.104 . 0 0 "[ . 1 . 2]" 1
802 2 25 VAL MG1 2 37 VAL MG1 3.000 . 6.300 2.316 1.980 2.853 . 0 0 "[ . 1 . 2]" 1
803 2 37 VAL H 2 37 VAL HA 4.000 2.200 5.000 2.932 2.926 2.942 . 0 0 "[ . 1 . 2]" 1
804 2 37 VAL H 2 37 VAL HB . . 2.740 3.649 3.613 3.673 0.933 1 20 [+*******-***********] 1
805 2 37 VAL HA 2 37 VAL HB 4.000 2.200 5.000 2.588 2.557 2.615 . 0 0 "[ . 1 . 2]" 1
806 2 37 VAL HA 2 37 VAL MG2 2.500 . 4.200 3.175 3.159 3.187 . 0 0 "[ . 1 . 2]" 1
807 2 37 VAL HA 2 37 VAL MG1 3.000 . 3.300 2.210 2.187 2.229 . 0 0 "[ . 1 . 2]" 1
808 2 38 VAL HA 2 39 ALA H 2.500 . 2.700 2.258 2.251 2.349 . 0 0 "[ . 1 . 2]" 1
809 2 38 VAL HB 2 39 ALA H 4.000 2.200 4.420 2.800 2.698 2.877 . 0 0 "[ . 1 . 2]" 1
810 2 38 VAL MG2 2 39 ALA H 3.000 . 4.050 3.316 3.137 3.714 . 0 0 "[ . 1 . 2]" 1
811 2 38 VAL HA 2 48 CYS HA 2.500 . 2.700 2.675 2.363 2.833 0.133 13 0 "[ . 1 . 2]" 1
812 2 38 VAL HA 2 49 LEU H 3.000 . 3.500 3.349 2.988 3.629 0.129 13 0 "[ . 1 . 2]" 1
813 2 38 VAL HA 2 47 ILE H 4.000 . 6.000 5.032 4.790 5.333 . 0 0 "[ . 1 . 2]" 1
814 2 38 VAL H 2 38 VAL HA 4.000 2.200 5.000 2.927 2.921 2.938 . 0 0 "[ . 1 . 2]" 1
815 2 38 VAL H 2 38 VAL HB 2.500 . 2.900 3.760 3.727 3.810 0.910 18 20 [***-*************+**] 1
816 2 38 VAL HA 2 38 VAL HB 4.000 2.200 5.000 2.333 2.290 2.455 . 0 0 "[ . 1 . 2]" 1
817 2 39 ALA HA 2 40 SER H . . 2.400 2.255 2.252 2.297 . 0 0 "[ . 1 . 2]" 1
818 2 38 VAL MG2 2 39 ALA HA 4.000 2.300 6.500 3.614 3.451 4.043 . 0 0 "[ . 1 . 2]" 1
819 2 39 ALA HA 2 40 SER QB 4.000 2.200 5.000 4.446 4.361 4.462 . 0 0 "[ . 1 . 2]" 1
820 2 39 ALA H 2 47 ILE H 3.000 . 3.240 3.288 3.126 3.560 0.320 3 0 "[ . 1 . 2]" 1
821 2 39 ALA H 2 49 LEU H 4.000 2.200 5.000 4.840 4.399 5.249 0.249 6 0 "[ . 1 . 2]" 1
822 2 24 GLN H 2 39 ALA HA 3.000 . 3.500 3.206 2.860 3.875 0.375 8 0 "[ . 1 . 2]" 1
823 2 23 LEU MD1 2 39 ALA HA 3.000 . 4.800 3.380 2.710 4.390 . 0 0 "[ . 1 . 2]" 1
824 2 39 ALA H 2 39 ALA HA 2.500 . 2.900 2.942 2.913 2.945 0.045 16 0 "[ . 1 . 2]" 1
825 2 40 SER HA 2 41 LEU H 2.500 . 2.650 2.137 2.118 2.157 . 0 0 "[ . 1 . 2]" 1
826 2 40 SER H 2 41 LEU H 4.000 2.200 5.000 4.359 4.350 4.368 . 0 0 "[ . 1 . 2]" 1
827 2 40 SER QB 2 41 LEU H 4.000 2.300 6.000 3.035 2.997 3.103 . 0 0 "[ . 1 . 2]" 1
828 2 40 SER HA 2 46 GLU HA 2.500 . 2.700 2.333 2.125 2.542 . 0 0 "[ . 1 . 2]" 1
829 2 40 SER HA 2 47 ILE H 3.000 . 3.500 3.629 3.281 4.035 0.535 6 1 "[ .+ 1 . 2]" 1
830 2 40 SER HA 2 46 GLU QB 4.000 2.300 5.000 3.456 3.211 3.670 . 0 0 "[ . 1 . 2]" 1
831 2 40 SER H 2 40 SER HA 3.000 . 3.500 2.956 2.945 2.957 . 0 0 "[ . 1 . 2]" 1
832 2 40 SER H 2 40 SER HB3 3.000 . 3.500 3.819 3.788 3.825 0.325 1 0 "[ . 1 . 2]" 1
833 2 40 SER H 2 40 SER HB2 3.000 . 3.500 2.716 2.639 2.729 . 0 0 "[ . 1 . 2]" 1
834 2 40 SER HA 2 40 SER HB3 3.000 . 3.300 2.443 2.434 2.502 . 0 0 "[ . 1 . 2]" 1
835 2 40 SER HA 2 40 SER HB2 3.000 . 3.300 3.031 3.029 3.033 . 0 0 "[ . 1 . 2]" 1
836 2 41 LEU HA 2 42 LYS H 2.500 . 2.620 2.487 2.419 2.546 . 0 0 "[ . 1 . 2]" 1
837 2 41 LEU H 2 42 LYS H 4.000 2.200 5.000 4.570 4.537 4.599 . 0 0 "[ . 1 . 2]" 1
838 2 41 LEU HB3 2 42 LYS H 3.000 . 3.500 2.245 2.108 2.420 . 0 0 "[ . 1 . 2]" 1
839 2 41 LEU HB2 2 42 LYS H 4.000 2.200 5.000 3.621 3.392 3.800 . 0 0 "[ . 1 . 2]" 1
840 2 41 LEU H 2 45 LYS H . 2.200 3.920 2.900 2.598 3.495 . 0 0 "[ . 1 . 2]" 1
841 2 41 LEU HA 2 43 ASN H . 2.200 3.920 4.072 3.969 4.197 0.277 4 0 "[ . 1 . 2]" 1
842 2 41 LEU HB2 2 45 LYS H 3.000 . 3.500 2.597 2.252 2.909 . 0 0 "[ . 1 . 2]" 1
843 2 41 LEU HB3 2 45 LYS H 4.000 2.200 5.000 3.935 3.505 4.219 . 0 0 "[ . 1 . 2]" 1
844 2 41 LEU QD 2 42 LYS H . 2.300 3.950 3.588 3.512 3.727 . 0 0 "[ . 1 . 2]" 1
845 2 41 LEU QD 2 45 LYS H 4.000 2.300 4.330 3.600 3.417 3.918 . 0 0 "[ . 1 . 2]" 1
846 2 21 SER H 2 41 LEU HA . . 2.870 3.261 2.813 3.711 0.841 5 6 "[ *+ * * .*- 2]" 1
847 2 22 ASN H 2 41 LEU HA 4.000 2.200 4.660 4.643 4.148 5.244 0.584 8 1 "[ . + 1 . 2]" 1
848 2 19 MET QB 2 41 LEU HA 4.000 2.200 5.000 4.276 3.822 5.139 0.139 6 0 "[ . 1 . 2]" 1
849 2 19 MET QB 2 41 LEU QD 4.000 2.300 4.610 2.184 2.021 2.497 0.279 13 0 "[ . 1 . 2]" 1
850 2 41 LEU H 2 41 LEU HA 4.000 2.200 5.000 2.877 2.853 2.892 . 0 0 "[ . 1 . 2]" 1
851 2 41 LEU H 2 41 LEU HB2 3.000 . 3.420 2.283 2.212 2.390 . 0 0 "[ . 1 . 2]" 1
852 2 41 LEU H 2 41 LEU HB3 . 2.200 3.420 3.546 3.503 3.588 0.168 4 0 "[ . 1 . 2]" 1
853 2 41 LEU HA 2 41 LEU HB2 4.000 2.200 5.000 3.005 2.987 3.018 . 0 0 "[ . 1 . 2]" 1
854 2 41 LEU HA 2 41 LEU HB3 2.500 . 2.700 2.585 2.506 2.639 . 0 0 "[ . 1 . 2]" 1
855 2 41 LEU H 2 41 LEU QD 4.000 2.300 5.010 2.160 1.962 2.371 0.338 4 0 "[ . 1 . 2]" 1
856 2 42 LYS HA 2 43 ASN H 3.000 . 3.330 3.390 3.341 3.433 0.103 4 0 "[ . 1 . 2]" 1
857 2 42 LYS H 2 43 ASN H 3.000 . 3.240 2.438 2.388 2.478 . 0 0 "[ . 1 . 2]" 1
858 2 42 LYS HB3 2 43 ASN H 4.000 2.200 5.000 3.214 3.087 3.367 . 0 0 "[ . 1 . 2]" 1
859 2 42 LYS HB2 2 43 ASN H 4.000 2.200 5.000 4.114 4.056 4.182 . 0 0 "[ . 1 . 2]" 1
860 2 42 LYS HA 2 44 GLY H . 2.200 3.450 3.770 3.409 4.123 0.673 19 4 "[ . - * *. +2]" 1
861 2 42 LYS H 2 42 LYS HA 2.500 . 2.830 2.872 2.857 2.878 0.048 15 0 "[ . 1 . 2]" 1
862 2 42 LYS H 2 42 LYS HB2 4.000 2.200 5.000 2.515 2.398 2.711 . 0 0 "[ . 1 . 2]" 1
863 2 42 LYS H 2 42 LYS HB3 2.500 . 2.900 2.588 2.383 2.698 . 0 0 "[ . 1 . 2]" 1
864 2 42 LYS HA 2 42 LYS HB3 2.500 . 2.700 3.022 3.014 3.027 0.327 3 0 "[ . 1 . 2]" 1
865 2 42 LYS HA 2 42 LYS HB2 2.500 . 2.700 2.519 2.420 2.575 . 0 0 "[ . 1 . 2]" 1
866 2 43 ASN HA 2 44 GLY H . 3.000 3.420 3.413 3.279 3.507 0.087 19 0 "[ . 1 . 2]" 1
867 2 43 ASN H 2 44 GLY H 2.500 . 2.700 2.436 2.369 2.551 . 0 0 "[ . 1 . 2]" 1
868 2 43 ASN HB3 2 44 GLY H 4.000 2.200 5.000 4.074 3.856 4.286 . 0 0 "[ . 1 . 2]" 1
869 2 43 ASN HB2 2 44 GLY H 4.000 2.200 5.000 3.166 2.840 3.537 . 0 0 "[ . 1 . 2]" 1
870 2 43 ASN H 2 45 LYS H 4.000 2.200 5.000 3.841 3.607 4.021 . 0 0 "[ . 1 . 2]" 1
871 2 43 ASN HA 2 43 ASN HB3 2.500 . 2.700 2.469 2.449 2.491 . 0 0 "[ . 1 . 2]" 1
872 2 43 ASN HA 2 43 ASN HB2 2.500 . 2.700 3.027 3.024 3.029 0.329 13 0 "[ . 1 . 2]" 1
873 2 44 GLY HA3 2 45 LYS H . 2.200 3.610 3.526 3.386 3.559 . 0 0 "[ . 1 . 2]" 1
874 2 44 GLY HA2 2 45 LYS H . 2.200 3.610 2.847 2.710 3.158 . 0 0 "[ . 1 . 2]" 1
875 2 44 GLY H 2 45 LYS H . . 2.520 2.182 1.971 2.382 . 0 0 "[ . 1 . 2]" 1
876 2 45 LYS HA 2 46 GLU H 2.500 . 2.700 2.318 2.141 2.417 . 0 0 "[ . 1 . 2]" 1
877 2 45 LYS QB 2 46 GLU H . 2.200 2.870 2.589 2.341 3.366 0.496 16 0 "[ . 1 . 2]" 1
878 2 45 LYS H 2 45 LYS HA . . 2.900 2.945 2.935 2.951 0.051 17 0 "[ . 1 . 2]" 1
879 2 45 LYS H 2 45 LYS QB 2.500 2.200 2.900 2.546 2.456 2.610 . 0 0 "[ . 1 . 2]" 1
880 2 45 LYS H 2 45 LYS QD 3.000 . 4.300 4.323 3.926 4.626 0.326 14 0 "[ . 1 . 2]" 1
881 2 45 LYS HA 2 45 LYS QB . . 2.700 2.399 2.371 2.426 . 0 0 "[ . 1 . 2]" 1
882 2 46 GLU HA 2 47 ILE H 2.500 . 2.560 2.114 2.108 2.143 . 0 0 "[ . 1 . 2]" 1
883 2 46 GLU H 2 47 ILE H 4.000 2.200 4.350 4.262 4.167 4.462 0.112 16 0 "[ . 1 . 2]" 1
884 2 46 GLU QB 2 47 ILE H 3.000 . 3.520 3.163 3.082 3.230 . 0 0 "[ . 1 . 2]" 1
885 2 41 LEU H 2 46 GLU HA . . 2.870 3.592 3.410 3.782 0.912 9 20 [***-****+***********] 1
886 2 46 GLU HA 2 46 GLU QB 2.500 . 2.560 2.190 2.173 2.195 . 0 0 "[ . 1 . 2]" 1
887 2 47 ILE H 2 48 CYS H 4.000 2.200 4.070 4.401 4.399 4.404 0.334 11 0 "[ . 1 . 2]" 1
888 2 47 ILE MD 2 48 CYS H 4.000 2.300 6.500 3.812 3.809 3.816 . 0 0 "[ . 1 . 2]" 1
889 2 48 CYS HA 2 49 LEU H . . 2.400 2.131 2.130 2.132 . 0 0 "[ . 1 . 2]" 1
890 2 48 CYS H 2 49 LEU H 4.000 2.200 5.000 4.334 4.333 4.335 . 0 0 "[ . 1 . 2]" 1
891 2 48 CYS QB 2 49 LEU H . 2.200 3.270 2.937 2.935 2.939 . 0 0 "[ . 1 . 2]" 1
892 2 48 CYS HA 2 49 LEU HB2 4.000 2.200 5.000 4.312 4.306 4.315 . 0 0 "[ . 1 . 2]" 1
893 2 48 CYS HA 2 49 LEU MD2 4.000 2.300 6.500 4.048 4.047 4.050 . 0 0 "[ . 1 . 2]" 1
894 2 39 ALA H 2 48 CYS HA 3.000 . 3.500 3.771 3.351 4.050 0.550 9 2 "[ .- +1 . 2]" 1
895 2 38 VAL H 2 48 CYS HA 4.000 . 6.000 5.219 4.977 5.448 . 0 0 "[ . 1 . 2]" 1
896 2 38 VAL MG1 2 48 CYS HA 4.000 2.300 5.500 3.423 2.925 3.735 . 0 0 "[ . 1 . 2]" 1
897 2 48 CYS H 2 48 CYS QB 2.500 2.200 2.870 2.535 2.533 2.537 . 0 0 "[ . 1 . 2]" 1
898 2 48 CYS HA 2 48 CYS QB . . 2.700 2.407 2.406 2.409 . 0 0 "[ . 1 . 2]" 1
899 2 49 LEU HA 2 50 ASP H . . 2.520 2.348 2.319 2.380 . 0 0 "[ . 1 . 2]" 1
900 2 49 LEU HB3 2 50 ASP H 4.000 2.200 5.000 2.961 2.905 3.015 . 0 0 "[ . 1 . 2]" 1
901 2 49 LEU HB2 2 50 ASP H 4.000 2.200 5.000 3.956 3.914 3.997 . 0 0 "[ . 1 . 2]" 1
902 2 11 THR HB 2 49 LEU HA 3.000 . 3.300 5.323 5.322 5.324 2.024 10 20 [******-**+**********] 1
903 2 49 LEU H 2 49 LEU HA 4.000 2.200 5.000 2.957 2.955 2.959 . 0 0 "[ . 1 . 2]" 1
904 2 49 LEU H 2 49 LEU HB3 4.000 2.200 5.000 3.626 3.623 3.628 . 0 0 "[ . 1 . 2]" 1
905 2 49 LEU H 2 49 LEU HB2 2.500 . 2.900 2.426 2.421 2.429 . 0 0 "[ . 1 . 2]" 1
906 2 50 ASP HA 2 51 PRO QD 2.500 . 2.700 1.927 1.868 2.010 . 0 0 "[ . 1 . 2]" 1
907 2 50 ASP HA 2 52 GLU H 4.000 2.200 5.000 3.480 3.373 3.572 . 0 0 "[ . 1 . 2]" 1
908 2 50 ASP H 2 50 ASP QB . . 2.770 2.376 2.338 2.431 . 0 0 "[ . 1 . 2]" 1
909 2 50 ASP HA 2 50 ASP QB 2.500 2.200 2.700 2.500 2.485 2.513 . 0 0 "[ . 1 . 2]" 1
910 2 51 PRO QD 2 52 GLU H 4.000 2.200 4.350 2.720 2.577 2.862 . 0 0 "[ . 1 . 2]" 1
911 2 51 PRO HA 2 53 ALA H . 2.200 3.830 3.615 3.469 3.649 . 0 0 "[ . 1 . 2]" 1
912 2 51 PRO HA 2 51 PRO HB3 2.500 . 2.700 2.288 2.273 2.300 . 0 0 "[ . 1 . 2]" 1
913 2 51 PRO HA 2 51 PRO HB2 4.000 2.200 5.000 2.957 2.922 2.977 . 0 0 "[ . 1 . 2]" 1
914 2 52 GLU HA 2 53 ALA H . 2.800 3.300 3.410 3.366 3.417 0.117 5 0 "[ . 1 . 2]" 1
915 2 52 GLU H 2 53 ALA H 2.500 . 2.700 2.660 2.427 2.741 0.041 17 0 "[ . 1 . 2]" 1
916 2 52 GLU H 2 52 GLU HA 2.500 . 2.700 2.831 2.808 2.888 0.188 15 0 "[ . 1 . 2]" 1
917 2 52 GLU H 2 52 GLU QB 2.500 . 3.520 2.197 2.083 2.267 . 0 0 "[ . 1 . 2]" 1
918 2 53 ALA MB 2 56 LEU H 4.000 2.800 4.210 2.831 2.807 2.847 . 0 0 "[ . 1 . 2]" 1
919 2 53 ALA H 2 53 ALA HA 4.000 2.200 5.000 2.941 2.939 2.946 . 0 0 "[ . 1 . 2]" 1
920 2 53 ALA H 2 53 ALA MB . 2.200 3.000 2.281 2.272 2.305 . 0 0 "[ . 1 . 2]" 1
921 2 53 ALA HA 2 53 ALA MB 2.500 2.200 2.700 2.137 2.136 2.138 0.064 15 0 "[ . 1 . 2]" 1
922 2 54 PRO HA 2 55 PHE H . 2.200 3.420 3.556 3.555 3.557 0.137 14 0 "[ . 1 . 2]" 1
923 2 54 PRO QB 2 55 PHE H 3.000 . 4.300 3.072 3.069 3.073 . 0 0 "[ . 1 . 2]" 1
924 2 54 PRO HA 2 57 LYS H . 2.200 3.670 3.312 3.192 3.435 . 0 0 "[ . 1 . 2]" 1
925 2 54 PRO HA 2 58 LYS H 4.000 2.200 5.000 4.819 4.597 5.076 0.076 12 0 "[ . 1 . 2]" 1
926 2 54 PRO HA 2 57 LYS HB2 3.000 . 3.300 3.335 3.063 3.696 0.396 8 0 "[ . 1 . 2]" 1
927 2 54 PRO HA 2 57 LYS HB3 4.000 2.200 5.000 3.039 2.629 3.361 . 0 0 "[ . 1 . 2]" 1
928 2 55 PHE HA 2 56 LEU H . 2.200 3.520 3.447 3.432 3.471 . 0 0 "[ . 1 . 2]" 1
929 2 55 PHE H 2 56 LEU H . . 2.900 2.655 2.635 2.688 . 0 0 "[ . 1 . 2]" 1
930 2 55 PHE HB3 2 56 LEU H 4.000 2.200 5.000 4.073 4.045 4.190 . 0 0 "[ . 1 . 2]" 1
931 2 55 PHE HB2 2 56 LEU H 4.000 2.200 5.000 3.971 3.828 4.000 . 0 0 "[ . 1 . 2]" 1
932 2 55 PHE H 2 57 LYS H 4.000 2.200 5.000 4.156 4.024 4.342 . 0 0 "[ . 1 . 2]" 1
933 2 55 PHE H 2 58 LYS H 4.000 2.800 6.000 5.016 4.863 5.131 . 0 0 "[ . 1 . 2]" 1
934 2 55 PHE HA 2 58 LYS H . 2.200 3.520 3.437 3.215 3.565 0.045 13 0 "[ . 1 . 2]" 1
935 2 55 PHE HA 2 59 VAL H 4.000 2.200 5.000 4.514 4.124 4.871 . 0 0 "[ . 1 . 2]" 1
936 2 54 PRO QB 2 55 PHE QD 4.000 2.800 7.000 4.627 4.502 4.634 . 0 0 "[ . 1 . 2]" 1
937 2 53 ALA MB 2 55 PHE HE2 3.000 . 3.300 2.287 2.243 2.889 . 0 0 "[ . 1 . 2]" 1
938 2 15 VAL HA 2 55 PHE QD 4.000 2.800 6.000 6.876 6.274 7.485 1.485 13 17 "[*** *****1**+**- ***]" 1
939 2 55 PHE H 2 55 PHE HB2 4.000 2.200 5.000 3.626 3.612 3.628 . 0 0 "[ . 1 . 2]" 1
940 2 55 PHE H 2 55 PHE HB3 2.500 . 2.900 2.559 2.547 2.754 . 0 0 "[ . 1 . 2]" 1
941 2 55 PHE HA 2 55 PHE HB2 2.500 . 2.700 2.444 2.437 2.544 . 0 0 "[ . 1 . 2]" 1
942 2 55 PHE HA 2 55 PHE HB3 2.500 . 2.700 2.459 2.367 2.465 . 0 0 "[ . 1 . 2]" 1
943 2 55 PHE HA 2 55 PHE QD 4.000 2.200 5.000 3.736 3.726 3.738 . 0 0 "[ . 1 . 2]" 1
944 2 55 PHE HB3 2 55 PHE QD 3.000 . 3.300 2.369 2.339 2.373 . 0 0 "[ . 1 . 2]" 1
945 2 55 PHE HB2 2 55 PHE QD 4.000 2.200 5.000 2.419 2.415 2.456 . 0 0 "[ . 1 . 2]" 1
946 2 56 LEU HA 2 57 LYS H . 2.200 3.420 3.500 3.453 3.538 0.118 17 0 "[ . 1 . 2]" 1
947 2 56 LEU H 2 57 LYS H 2.500 . 2.650 2.448 2.327 2.591 . 0 0 "[ . 1 . 2]" 1
948 2 56 LEU H 2 58 LYS H 4.000 2.200 5.000 3.841 3.743 3.940 . 0 0 "[ . 1 . 2]" 1
949 2 56 LEU HA 2 59 VAL H 3.000 . 3.500 3.696 3.578 3.950 0.450 8 0 "[ . 1 . 2]" 1
950 2 56 LEU HA 2 60 ILE H 4.000 2.200 4.420 4.395 4.037 4.806 0.386 12 0 "[ . 1 . 2]" 1
951 2 56 LEU HA 2 59 VAL HB . 2.200 3.210 5.293 5.035 5.623 2.413 12 20 [***********+****-***] 1
952 2 56 LEU HA 2 59 VAL QG 2.500 . 4.200 2.298 2.065 2.608 . 0 0 "[ . 1 . 2]" 1
953 2 56 LEU HA 2 60 ILE QG 4.000 2.300 7.400 3.688 3.261 4.040 . 0 0 "[ . 1 . 2]" 1
954 2 49 LEU MD1 2 56 LEU HA 4.000 2.300 6.500 4.054 3.554 4.668 . 0 0 "[ . 1 . 2]" 1
955 2 56 LEU H 2 56 LEU HA 2.500 . 2.710 2.855 2.824 2.890 0.180 13 0 "[ . 1 . 2]" 1
956 2 57 LYS HA 2 58 LYS H . 2.200 3.240 3.397 3.333 3.460 0.220 17 0 "[ . 1 . 2]" 1
957 2 57 LYS H 2 58 LYS H . . 2.490 2.483 2.362 2.664 0.174 17 0 "[ . 1 . 2]" 1
958 2 57 LYS HB3 2 58 LYS H 3.000 . 3.500 3.094 2.881 3.322 . 0 0 "[ . 1 . 2]" 1
959 2 57 LYS HB2 2 58 LYS H 4.000 2.200 5.000 4.072 3.933 4.235 . 0 0 "[ . 1 . 2]" 1
960 2 57 LYS H 2 57 LYS HA 2.500 . 2.900 2.850 2.794 2.886 . 0 0 "[ . 1 . 2]" 1
961 2 57 LYS H 2 57 LYS HB3 2.500 . 2.900 2.538 2.390 2.630 . 0 0 "[ . 1 . 2]" 1
962 2 57 LYS H 2 57 LYS HB2 2.500 . 2.900 2.508 2.379 2.695 . 0 0 "[ . 1 . 2]" 1
963 2 57 LYS HA 2 57 LYS HB3 4.000 2.200 5.000 3.022 3.016 3.025 . 0 0 "[ . 1 . 2]" 1
964 2 57 LYS HA 2 57 LYS HB2 2.500 . 2.700 2.489 2.426 2.541 . 0 0 "[ . 1 . 2]" 1
965 2 58 LYS HA 2 59 VAL H . 2.200 3.390 3.563 3.543 3.576 0.186 7 0 "[ . 1 . 2]" 1
966 2 58 LYS H 2 59 VAL H 2.500 . 2.700 2.678 2.600 2.751 0.051 9 0 "[ . 1 . 2]" 1
967 2 58 LYS QB 2 59 VAL H 4.000 2.300 6.000 2.243 2.206 2.260 0.094 13 0 "[ . 1 . 2]" 1
968 2 58 LYS H 2 60 ILE H 4.000 2.200 4.260 3.743 3.666 3.801 . 0 0 "[ . 1 . 2]" 1
969 2 58 LYS HA 2 60 ILE H 4.000 2.200 5.000 4.226 4.133 4.353 . 0 0 "[ . 1 . 2]" 1
970 2 58 LYS HA 2 61 GLN H 3.000 . 3.500 3.414 3.351 3.582 0.082 3 0 "[ . 1 . 2]" 1
971 2 58 LYS HA 2 62 LYS H 4.000 2.200 4.010 4.319 4.062 5.103 1.093 13 4 "[ * .* 1 +-. 2]" 1
972 2 58 LYS HA 2 61 GLN HB3 3.000 . 3.300 2.954 2.590 3.573 0.273 13 0 "[ . 1 . 2]" 1
973 2 58 LYS HA 2 61 GLN HB2 3.000 . 3.300 3.292 3.183 3.548 0.248 2 0 "[ . 1 . 2]" 1
974 2 58 LYS H 2 58 LYS HA 2.500 . 2.830 2.872 2.852 2.887 0.057 2 0 "[ . 1 . 2]" 1
975 2 59 VAL HA 2 60 ILE H . 2.200 3.390 3.532 3.518 3.556 0.166 7 0 "[ . 1 . 2]" 1
976 2 59 VAL H 2 60 ILE H . . 2.590 2.723 2.694 2.769 0.179 18 0 "[ . 1 . 2]" 1
977 2 59 VAL H 2 61 GLN H 4.000 2.200 5.000 4.043 3.964 4.159 . 0 0 "[ . 1 . 2]" 1
978 2 59 VAL HA 2 62 LYS H 3.000 . 3.500 3.476 3.254 3.668 0.168 8 0 "[ . 1 . 2]" 1
979 2 59 VAL HA 2 62 LYS HB2 3.000 . 4.300 2.911 2.433 3.226 . 0 0 "[ . 1 . 2]" 1
980 2 59 VAL HA 2 62 LYS HB3 4.000 2.200 5.000 4.523 4.053 4.889 . 0 0 "[ . 1 . 2]" 1
981 2 17 PRO QB 2 59 VAL HA 4.000 2.200 4.010 4.588 4.066 5.575 1.565 13 10 "[ -* .** *1* +*. **2]" 1
982 2 17 PRO QG 2 59 VAL HA 3.000 . 4.300 2.562 2.041 3.549 . 0 0 "[ . 1 . 2]" 1
983 2 17 PRO QD 2 59 VAL HA 4.000 2.200 5.000 3.018 2.794 3.468 . 0 0 "[ . 1 . 2]" 1
984 2 59 VAL H 2 59 VAL HB . . 2.400 3.621 3.607 3.632 1.232 10 20 [*******-*+**********] 1
985 2 59 VAL HA 2 59 VAL HB 2.500 . 2.700 2.445 2.406 2.490 . 0 0 "[ . 1 . 2]" 1
986 2 60 ILE HA 2 61 GLN H . 2.200 3.610 3.457 3.437 3.500 . 0 0 "[ . 1 . 2]" 1
987 2 60 ILE H 2 61 GLN H 2.500 . 2.700 2.381 2.286 2.504 . 0 0 "[ . 1 . 2]" 1
988 2 60 ILE HB 2 61 GLN H . . 2.800 4.091 3.960 4.165 1.365 17 20 [*-**************+***] 1
989 2 60 ILE HA 2 63 ILE H 3.000 . 3.170 3.456 3.135 3.580 0.410 5 0 "[ . 1 . 2]" 1
990 2 60 ILE H 2 60 ILE HA 3.000 . 3.500 2.889 2.856 2.909 . 0 0 "[ . 1 . 2]" 1
991 2 60 ILE H 2 60 ILE HB . . 2.400 3.714 3.693 3.735 1.335 17 20 [************-***+***] 1
992 2 60 ILE HA 2 60 ILE HB . . 2.830 2.413 2.381 2.445 . 0 0 "[ . 1 . 2]" 1
993 2 61 GLN H 2 62 LYS H 2.500 . 2.700 2.538 2.478 2.613 . 0 0 "[ . 1 . 2]" 1
994 2 61 GLN HB3 2 62 LYS H 4.000 2.200 5.000 2.548 2.528 2.590 . 0 0 "[ . 1 . 2]" 1
995 2 61 GLN HB2 2 62 LYS H 4.000 2.200 5.000 3.799 3.663 3.873 . 0 0 "[ . 1 . 2]" 1
996 2 61 GLN H 2 63 ILE H 4.000 2.200 5.000 4.075 3.971 4.221 . 0 0 "[ . 1 . 2]" 1
997 2 61 GLN HA 2 64 LEU H 3.000 . 3.500 3.704 3.416 3.992 0.492 13 0 "[ . 1 . 2]" 1
998 2 61 GLN HA 2 64 LEU QB 3.000 2.300 4.200 3.162 2.631 3.839 . 0 0 "[ . 1 . 2]" 1
999 2 61 GLN H 2 61 GLN HA 3.000 . 3.500 2.874 2.847 2.883 . 0 0 "[ . 1 . 2]" 1
1000 2 62 LYS HA 2 63 ILE H 4.000 2.200 5.000 3.533 3.501 3.557 . 0 0 "[ . 1 . 2]" 1
1001 2 62 LYS H 2 63 ILE H 3.000 . 3.500 2.778 2.667 2.861 . 0 0 "[ . 1 . 2]" 1
1002 2 62 LYS HB2 2 63 ILE H 3.000 . 3.500 2.983 2.866 3.194 . 0 0 "[ . 1 . 2]" 1
1003 2 62 LYS HB3 2 63 ILE H 4.000 2.200 5.000 3.757 3.605 3.949 . 0 0 "[ . 1 . 2]" 1
1004 2 62 LYS H 2 64 LEU H 4.000 2.200 5.000 4.161 4.094 4.302 . 0 0 "[ . 1 . 2]" 1
1005 2 62 LYS HA 2 64 LEU H 4.000 2.200 5.000 3.865 3.593 4.220 . 0 0 "[ . 1 . 2]" 1
1006 2 62 LYS HA 2 65 ASP H 3.000 . 3.210 3.469 3.113 4.011 0.801 17 4 "[ -.* 1 . + *2]" 1
1007 2 62 LYS H 2 62 LYS HA 2.500 . 2.900 2.802 2.778 2.842 . 0 0 "[ . 1 . 2]" 1
1008 2 62 LYS H 2 62 LYS HB2 2.500 . 2.900 2.372 2.209 2.487 . 0 0 "[ . 1 . 2]" 1
1009 2 62 LYS HA 2 62 LYS HB3 4.000 2.200 5.000 2.544 2.484 2.629 . 0 0 "[ . 1 . 2]" 1
1010 2 63 ILE HA 2 64 LEU H 4.000 2.200 5.000 3.364 3.175 3.470 . 0 0 "[ . 1 . 2]" 1
1011 2 63 ILE H 2 64 LEU H 3.000 . 3.110 2.500 2.377 2.594 . 0 0 "[ . 1 . 2]" 1
1012 2 63 ILE HA 2 66 GLY H 3.000 . 3.500 3.639 3.208 4.078 0.578 10 1 "[ . + . 2]" 1
1013 2 63 ILE HA 2 67 GLY H 4.000 2.200 5.000 3.841 2.956 4.739 . 0 0 "[ . 1 . 2]" 1
1014 2 63 ILE H 2 63 ILE HA 2.500 . 2.900 2.882 2.857 2.923 0.023 17 0 "[ . 1 . 2]" 1
1015 2 64 LEU HA 2 65 ASP H . 2.200 3.420 3.468 3.263 3.566 0.146 19 0 "[ . 1 . 2]" 1
1016 2 64 LEU H 2 65 ASP H 2.500 . 2.700 2.237 1.947 2.456 . 0 0 "[ . 1 . 2]" 1
1017 2 64 LEU HB3 2 65 ASP H 3.000 . 3.500 3.799 3.217 4.270 0.770 13 5 "[ * . *1 + * - 2]" 1
1018 2 64 LEU HB2 2 65 ASP H 3.000 . 3.500 2.887 2.277 3.535 0.035 13 0 "[ . 1 . 2]" 1
1019 2 64 LEU H 2 66 GLY H 4.000 2.200 5.000 3.732 2.995 4.159 . 0 0 "[ . 1 . 2]" 1
1020 2 64 LEU HA 2 67 GLY H 3.000 . 3.500 3.741 3.445 4.170 0.670 9 2 "[ . +1 . - 2]" 1
1021 2 64 LEU HA 2 68 ASN H 4.000 2.200 5.000 4.864 4.042 5.791 0.791 20 3 "[ - .* 1 . +]" 1
1022 2 64 LEU H 2 64 LEU HA 2.500 . 2.900 2.915 2.864 2.948 0.048 10 0 "[ . 1 . 2]" 1
1023 2 64 LEU H 2 64 LEU QB 2.500 . 4.400 2.419 2.214 2.549 . 0 0 "[ . 1 . 2]" 1
1024 2 65 ASP HA 2 66 GLY H . 2.200 3.520 3.525 3.449 3.569 0.049 9 0 "[ . 1 . 2]" 1
1025 2 65 ASP H 2 66 GLY H 2.500 . 2.700 2.345 2.098 2.505 . 0 0 "[ . 1 . 2]" 1
1026 2 65 ASP HA 2 67 GLY H 4.000 2.200 4.350 4.150 3.978 4.393 0.043 3 0 "[ . 1 . 2]" 1
1027 2 65 ASP HA 2 68 ASN H 4.000 2.200 5.000 3.821 3.250 4.932 . 0 0 "[ . 1 . 2]" 1
1028 2 65 ASP HA 2 68 ASN QB 3.000 2.200 3.300 3.191 2.679 4.222 0.922 2 1 "[ + . 1 . 2]" 1
1029 2 65 ASP H 2 65 ASP HA 2.500 . 2.900 2.898 2.867 2.940 0.040 9 0 "[ . 1 . 2]" 1
1030 2 66 GLY H 2 67 GLY H 2.500 . 2.700 2.496 2.332 2.603 . 0 0 "[ . 1 . 2]" 1
1031 2 66 GLY HA2 2 67 GLY H 4.000 2.200 5.000 3.464 3.363 3.506 . 0 0 "[ . 1 . 2]" 1
1032 2 66 GLY H 2 66 GLY HA3 3.000 . 3.500 2.310 2.297 2.358 . 0 0 "[ . 1 . 2]" 1
1033 2 67 GLY H 2 68 ASN H 2.500 . 2.700 2.545 2.315 3.187 0.487 3 0 "[ . 1 . 2]" 1
1034 2 68 ASN HA 2 69 LYS H 4.000 2.200 5.000 3.426 3.165 3.503 . 0 0 "[ . 1 . 2]" 1
1035 2 68 ASN H 2 69 LYS H 2.500 . 2.700 2.156 1.593 2.621 0.107 3 0 "[ . 1 . 2]" 1
1036 2 68 ASN QB 2 69 LYS H . 2.200 3.480 2.965 2.716 3.540 0.060 2 0 "[ . 1 . 2]" 1
1037 2 68 ASN HA 2 70 GLU H 4.000 2.200 5.000 3.944 3.476 4.365 . 0 0 "[ . 1 . 2]" 1
1038 2 68 ASN H 2 68 ASN HA 2.500 . 2.900 2.903 2.818 2.945 0.045 12 0 "[ . 1 . 2]" 1
1039 2 68 ASN H 2 68 ASN QB . . 2.900 2.405 2.180 2.883 . 0 0 "[ . 1 . 2]" 1
1040 2 69 LYS HA 2 70 GLU H 3.000 . 3.500 3.430 3.245 3.522 0.022 4 0 "[ . 1 . 2]" 1
1041 2 69 LYS H 2 70 GLU H 2.500 . 2.700 2.409 2.272 2.497 . 0 0 "[ . 1 . 2]" 1
1042 2 69 LYS HB3 2 70 GLU H 4.000 2.200 5.000 3.092 2.701 3.611 . 0 0 "[ . 1 . 2]" 1
1043 2 69 LYS HB2 2 70 GLU H 4.000 2.200 5.000 4.082 3.935 4.276 . 0 0 "[ . 1 . 2]" 1
1044 2 69 LYS H 2 69 LYS HA . . 2.800 2.880 2.858 2.917 0.117 7 0 "[ . 1 . 2]" 1
1045 2 69 LYS H 2 69 LYS HB2 3.000 . 3.500 2.579 2.426 2.764 . 0 0 "[ . 1 . 2]" 1
1046 2 69 LYS H 2 69 LYS HB3 2.500 . 2.900 2.552 2.335 2.718 . 0 0 "[ . 1 . 2]" 1
1047 2 69 LYS HA 2 69 LYS HB2 2.500 . 2.700 2.501 2.396 2.590 . 0 0 "[ . 1 . 2]" 1
1048 2 69 LYS HA 2 69 LYS HB3 4.000 2.200 5.000 3.022 3.007 3.027 . 0 0 "[ . 1 . 2]" 1
1049 2 70 GLU H 2 70 GLU HA 2.500 . 2.770 2.848 2.812 2.878 0.108 3 0 "[ . 1 . 2]" 1
1050 2 70 GLU H 2 70 GLU QB 3.000 . 4.500 2.202 2.047 2.472 . 0 0 "[ . 1 . 2]" 1
1051 2 70 GLU HA 2 70 GLU QB 2.500 . 3.400 2.460 2.344 2.542 . 0 0 "[ . 1 . 2]" 1
1052 1 23 LEU H 2 25 VAL H 3.000 . 3.360 2.967 2.481 3.410 0.050 17 0 "[ . 1 . 2]" 1
1053 1 25 VAL H 2 23 LEU H 3.000 . 3.360 2.875 2.348 3.366 0.006 17 0 "[ . 1 . 2]" 1
1054 1 23 LEU H 2 27 ALA H 4.000 2.800 5.000 5.248 4.426 5.614 0.614 20 3 "[ -. 1 . *+]" 1
1055 1 27 ALA H 2 23 LEU H 4.000 2.800 5.000 5.226 4.588 5.642 0.642 20 4 "[ * . * 1 - +]" 1
1056 1 22 ASN HA 2 26 PHE HA 2.500 . 2.700 2.909 2.606 3.149 0.449 19 0 "[ . 1 . 2]" 1
1057 1 26 PHE HA 2 22 ASN HA 2.500 . 2.700 2.957 2.739 3.230 0.530 8 1 "[ . + 1 . 2]" 1
1058 1 21 SER HA 2 27 ALA H 4.000 2.300 5.000 4.486 3.815 5.199 0.199 11 0 "[ . 1 . 2]" 1
1059 1 27 ALA H 2 21 SER HA 4.000 2.300 5.000 4.454 3.981 5.109 0.109 8 0 "[ . 1 . 2]" 1
1060 1 22 ASN HA 2 25 VAL H 4.000 2.300 5.000 4.769 4.142 5.299 0.299 16 0 "[ . 1 . 2]" 1
1061 1 25 VAL H 2 22 ASN HA 4.000 2.300 5.000 4.670 4.052 5.243 0.243 17 0 "[ . 1 . 2]" 1
1062 1 22 ASN HA 2 27 ALA H . 2.300 3.450 3.517 2.752 3.883 0.433 20 0 "[ . 1 . 2]" 1
1063 1 27 ALA H 2 22 ASN HA . 2.300 3.450 3.482 2.885 3.929 0.479 20 0 "[ . 1 . 2]" 1
1064 1 24 GLN HA 2 23 LEU H 4.000 2.300 5.000 4.566 4.108 5.108 0.108 10 0 "[ . 1 . 2]" 1
1065 1 23 LEU H 2 24 GLN HA 4.000 2.300 5.000 4.626 4.152 5.285 0.285 17 0 "[ . 1 . 2]" 1
1066 1 23 LEU H 2 25 VAL HB 3.000 . 3.500 2.769 2.249 3.459 . 0 0 "[ . 1 . 2]" 1
1067 1 25 VAL HB 2 23 LEU H 3.000 . 3.500 2.666 2.187 3.219 . 0 0 "[ . 1 . 2]" 1
1068 1 21 SER HA 2 27 ALA MB 3.000 . 3.300 2.848 2.411 3.440 0.140 4 0 "[ . 1 . 2]" 1
1069 1 27 ALA MB 2 21 SER HA 3.000 . 3.300 2.815 2.223 3.206 . 0 0 "[ . 1 . 2]" 1
1070 1 25 VAL HB 2 23 LEU HB3 3.000 . 3.300 2.165 1.962 2.566 . 0 0 "[ . 1 . 2]" 1
1071 1 23 LEU HB3 2 25 VAL HB 3.000 . 3.300 2.185 1.958 2.829 . 0 0 "[ . 1 . 2]" 1
1072 1 25 VAL HB 2 23 LEU HB2 3.000 . 3.300 3.445 2.913 4.155 0.855 16 3 "[ . -* .+ 2]" 1
1073 1 23 LEU HB2 2 25 VAL HB 3.000 . 3.300 3.442 2.762 4.211 0.911 4 1 "[ +. 1 . 2]" 1
1074 1 25 VAL HB 2 23 LEU MD2 3.000 . 4.800 3.482 3.132 3.894 . 0 0 "[ . 1 . 2]" 1
1075 1 23 LEU MD2 2 25 VAL HB 3.000 . 4.800 3.450 2.800 4.242 . 0 0 "[ . 1 . 2]" 1
1076 1 2 ARG HG2 1 4 LEU H 4.165 . 6.530 6.518 6.516 6.520 . 0 0 "[ . 1 . 2]" 1
1077 1 3 GLU H 1 3 GLU QG 3.545 . 5.290 3.243 3.242 3.244 . 0 0 "[ . 1 . 2]" 1
1078 1 3 GLU H 1 4 LEU H 2.815 . 3.830 3.901 3.898 3.902 0.072 7 0 "[ . 1 . 2]" 1
1079 1 3 GLU HA 1 4 LEU HG 3.650 . 5.500 4.219 4.218 4.220 . 0 0 "[ . 1 . 2]" 1
1080 1 3 GLU QG 1 4 LEU HA 3.670 . 5.540 5.851 5.850 5.852 0.312 13 0 "[ . 1 . 2]" 1
1081 1 4 LEU H 1 4 LEU QB 2.840 . 3.880 2.567 2.566 2.569 . 0 0 "[ . 1 . 2]" 1
1082 1 4 LEU H 1 4 LEU HG 3.000 . 4.200 3.212 3.211 3.213 . 0 0 "[ . 1 . 2]" 1
1083 1 4 LEU H 1 4 LEU MD1 3.000 . 4.200 3.025 3.023 3.026 . 0 0 "[ . 1 . 2]" 1
1084 1 4 LEU H 1 4 LEU MD2 3.480 . 5.160 4.414 4.412 4.414 . 0 0 "[ . 1 . 2]" 1
1085 1 4 LEU H 1 5 ARG H 3.155 . 4.510 4.376 4.375 4.377 . 0 0 "[ . 1 . 2]" 1
1086 1 4 LEU HA 1 4 LEU MD1 3.590 . 5.380 3.735 3.734 3.736 . 0 0 "[ . 1 . 2]" 1
1087 1 4 LEU HA 1 4 LEU MD2 3.000 . 4.200 2.816 2.815 2.817 . 0 0 "[ . 1 . 2]" 1
1088 1 4 LEU HA 1 31 GLN QB 3.200 . 4.600 4.038 3.848 4.279 . 0 0 "[ . 1 . 2]" 1
1089 1 4 LEU HB2 1 5 ARG H 2.705 . 3.610 3.996 3.994 3.997 0.387 15 0 "[ . 1 . 2]" 1
1090 1 4 LEU HB3 1 5 ARG H 2.705 . 3.610 2.947 2.944 2.948 . 0 0 "[ . 1 . 2]" 1
1091 1 4 LEU MD1 1 5 ARG H 4.010 . 6.220 5.049 5.048 5.051 . 0 0 "[ . 1 . 2]" 1
1092 1 4 LEU MD1 1 31 GLN QB 4.165 . 6.530 3.506 3.132 3.803 . 0 0 "[ . 1 . 2]" 1
1093 1 4 LEU MD2 1 5 ARG H 3.545 . 5.290 3.707 3.705 3.708 . 0 0 "[ . 1 . 2]" 1
1094 1 5 ARG H 1 5 ARG QG 2.990 . 4.180 2.419 2.417 2.420 . 0 0 "[ . 1 . 2]" 1
1095 1 5 ARG H 1 6 CYS H 2.860 . 3.920 4.503 4.501 4.504 0.584 11 20 [-*********+*********] 1
1096 1 5 ARG HA 1 5 ARG QD 4.090 . 6.380 2.267 2.266 2.268 . 0 0 "[ . 1 . 2]" 1
1097 1 5 ARG QB 1 5 ARG HE 3.650 . 5.500 4.394 4.394 4.395 . 0 0 "[ . 1 . 2]" 1
1098 1 5 ARG QB 1 6 CYS H 2.380 . 2.960 2.916 2.916 2.918 . 0 0 "[ . 1 . 2]" 1
1099 1 5 ARG QG 1 6 CYS H 3.455 . 5.110 4.702 4.701 4.703 . 0 0 "[ . 1 . 2]" 1
1100 1 5 ARG QD 1 6 CYS H 4.090 . 6.380 4.014 4.013 4.015 . 0 0 "[ . 1 . 2]" 1
1101 1 6 CYS H 1 7 VAL H 3.650 . 5.500 4.655 4.654 4.657 . 0 0 "[ . 1 . 2]" 1
1102 1 6 CYS CB 1 32 CYS SG 2.450 . 3.100 3.068 3.062 3.074 . 0 0 "[ . 1 . 2]" 1
1103 1 6 CYS HB2 1 8 CYS H 2.520 . 3.240 3.623 3.621 3.625 0.385 13 0 "[ . 1 . 2]" 1
1104 1 6 CYS SG 1 32 CYS CB 2.450 . 3.100 3.038 3.021 3.048 . 0 0 "[ . 1 . 2]" 1
1105 1 6 CYS SG 1 32 CYS SG 1.950 . 2.100 2.030 2.027 2.033 . 0 0 "[ . 1 . 2]" 1
1106 1 7 VAL H 1 7 VAL HB 2.550 . 3.300 2.535 2.533 2.537 . 0 0 "[ . 1 . 2]" 1
1107 1 7 VAL H 1 7 VAL QG 3.190 . 4.580 2.225 2.222 2.227 . 0 0 "[ . 1 . 2]" 1
1108 1 7 VAL HB 1 8 CYS H 3.015 . 4.230 4.034 4.033 4.035 . 0 0 "[ . 1 . 2]" 1
1109 1 7 VAL QG 1 8 CYS H 3.590 . 5.380 2.482 2.480 2.483 . 0 0 "[ . 1 . 2]" 1
1110 1 8 CYS H 1 9 LEU H 3.110 . 4.420 4.029 4.028 4.031 . 0 0 "[ . 1 . 2]" 1
1111 1 8 CYS CB 1 48 CYS SG 2.450 . 3.100 3.047 3.045 3.048 . 0 0 "[ . 1 . 2]" 1
1112 1 8 CYS SG 1 48 CYS CB 2.450 . 3.100 2.984 2.983 2.985 . 0 0 "[ . 1 . 2]" 1
1113 1 8 CYS SG 1 48 CYS SG 1.950 . 2.100 2.036 2.035 2.038 . 0 0 "[ . 1 . 2]" 1
1114 1 9 LEU H 1 9 LEU QB 2.725 . 3.650 2.403 2.401 2.404 . 0 0 "[ . 1 . 2]" 1
1115 1 9 LEU H 1 9 LEU HG 2.410 . 3.020 2.566 2.565 2.568 . 0 0 "[ . 1 . 2]" 1
1116 1 9 LEU H 1 9 LEU MD1 3.650 . 5.500 3.744 3.743 3.745 . 0 0 "[ . 1 . 2]" 1
1117 1 9 LEU H 1 9 LEU MD2 3.805 . 5.810 3.577 3.576 3.579 . 0 0 "[ . 1 . 2]" 1
1118 1 9 LEU HA 1 9 LEU HG 2.425 . 3.050 2.979 2.977 2.981 . 0 0 "[ . 1 . 2]" 1
1119 1 9 LEU HA 1 9 LEU MD1 3.805 . 5.810 3.798 3.797 3.799 . 0 0 "[ . 1 . 2]" 1
1120 1 9 LEU HA 1 9 LEU MD2 2.770 . 3.740 2.007 1.994 2.024 . 0 0 "[ . 1 . 2]" 1
1121 1 9 LEU QB 1 10 GLN H 2.800 . 3.800 2.802 2.801 2.803 . 0 0 "[ . 1 . 2]" 1
1122 1 9 LEU HG 1 10 GLN H 3.015 . 4.230 4.496 4.494 4.497 0.267 4 0 "[ . 1 . 2]" 1
1123 1 10 GLN H 1 10 GLN HB2 2.580 . 3.360 3.750 3.749 3.751 0.391 2 0 "[ . 1 . 2]" 1
1124 1 10 GLN H 1 10 GLN HB3 2.425 . 3.050 2.909 2.908 2.910 . 0 0 "[ . 1 . 2]" 1
1125 1 10 GLN H 1 10 GLN QG 3.250 . 4.700 3.044 3.043 3.045 . 0 0 "[ . 1 . 2]" 1
1126 1 10 GLN H 1 11 THR MG 3.730 . 5.660 5.760 5.759 5.761 0.101 9 0 "[ . 1 . 2]" 1
1127 1 10 GLN HA 1 10 GLN HB2 2.410 . 3.020 2.401 2.400 2.403 . 0 0 "[ . 1 . 2]" 1
1128 1 10 GLN HB2 1 11 THR H 2.845 . 3.890 2.094 2.092 2.095 . 0 0 "[ . 1 . 2]" 1
1129 1 10 GLN HB3 1 11 THR H 2.595 . 3.390 3.581 3.580 3.582 0.192 10 0 "[ . 1 . 2]" 1
1130 1 10 GLN QG 1 11 THR H 3.610 . 5.420 2.936 2.935 2.938 . 0 0 "[ . 1 . 2]" 1
1131 1 11 THR H 1 11 THR MG 3.000 . 4.200 2.217 2.216 2.219 . 0 0 "[ . 1 . 2]" 1
1132 1 11 THR HA 1 48 CYS H 3.015 . 4.230 4.626 4.624 4.627 0.397 12 0 "[ . 1 . 2]" 1
1133 1 11 THR HA 1 48 CYS HA 3.015 . 4.230 5.135 5.133 5.136 0.906 8 20 [******-+************] 1
1134 1 11 THR HA 1 48 CYS QB 3.060 . 3.980 2.932 2.931 2.933 . 0 0 "[ . 1 . 2]" 1
1135 1 11 THR HB 1 48 CYS QB 3.000 . 4.200 4.767 4.766 4.769 0.569 18 20 [**-**************+**] 1
1136 1 11 THR MG 1 48 CYS H 3.980 . 6.160 6.589 6.588 6.590 0.430 13 0 "[ . 1 . 2]" 1
1137 1 11 THR MG 1 49 LEU H 3.775 . 5.750 6.905 6.903 6.906 1.156 14 20 [*************+***-**] 1
1138 1 11 THR MG 1 50 ASP QB 4.055 . 6.310 3.317 3.273 3.407 . 0 0 "[ . 1 . 2]" 1
1139 1 11 THR MG 1 51 PRO QD 4.165 . 6.530 6.315 6.198 6.458 . 0 0 "[ . 1 . 2]" 1
1140 1 12 THR H 1 13 GLN H 3.125 . 4.450 4.242 4.240 4.243 . 0 0 "[ . 1 . 2]" 1
1141 1 12 THR H 1 47 ILE HB 4.165 . 6.530 6.091 6.090 6.092 . 0 0 "[ . 1 . 2]" 1
1142 1 12 THR H 1 48 CYS QB 3.650 . 5.500 4.684 4.683 4.685 . 0 0 "[ . 1 . 2]" 1
1143 1 12 THR H 1 49 LEU H 3.280 . 4.760 5.364 5.363 5.365 0.605 14 20 [*********-***+******] 1
1144 1 12 THR H 1 49 LEU HA 2.350 . 2.900 2.956 2.955 2.958 0.058 9 0 "[ . 1 . 2]" 1
1145 1 12 THR H 1 49 LEU MD1 4.150 . 6.500 6.017 6.016 6.018 . 0 0 "[ . 1 . 2]" 1
1146 1 12 THR H 1 49 LEU MD2 3.360 . 4.920 3.798 3.797 3.799 . 0 0 "[ . 1 . 2]" 1
1147 1 12 THR H 1 50 ASP H 2.935 . 4.070 3.349 3.307 3.384 . 0 0 "[ . 1 . 2]" 1
1148 1 13 GLN H 1 13 GLN QG 3.145 . 4.490 3.135 3.134 3.135 . 0 0 "[ . 1 . 2]" 1
1149 1 13 GLN H 1 49 LEU MD2 4.165 . 6.530 4.521 4.520 4.522 . 0 0 "[ . 1 . 2]" 1
1150 1 13 GLN HA 1 13 GLN HE21 3.650 . 5.500 5.733 5.728 5.735 0.235 1 0 "[ . 1 . 2]" 1
1151 1 13 GLN HA 1 49 LEU MD2 4.165 . 6.530 4.192 4.191 4.193 . 0 0 "[ . 1 . 2]" 1
1152 1 13 GLN HA 1 50 ASP H 2.795 . 3.790 5.338 5.309 5.363 1.573 18 20 [*****-***********+**] 1
1153 1 13 GLN HA 1 50 ASP QB 3.650 . 5.500 5.777 5.656 5.914 0.414 8 0 "[ . 1 . 2]" 1
1154 1 13 GLN HA 1 53 ALA MB 3.920 . 6.040 4.926 4.398 5.284 . 0 0 "[ . 1 . 2]" 1
1155 1 13 GLN QB 1 13 GLN HE22 3.650 . 5.500 4.442 4.440 4.443 . 0 0 "[ . 1 . 2]" 1
1156 1 14 GLY H 1 15 VAL H 2.535 . 3.270 4.934 4.932 4.935 1.665 5 20 [****+**-************] 1
1157 1 14 GLY H 1 49 LEU MD2 3.620 . 5.440 3.178 3.176 3.178 . 0 0 "[ . 1 . 2]" 1
1158 1 14 GLY HA2 1 15 VAL H 2.640 . 3.480 3.679 3.678 3.680 0.200 2 0 "[ . 1 . 2]" 1
1159 1 14 GLY HA3 1 15 VAL H 2.640 . 3.480 3.714 3.713 3.715 0.235 15 0 "[ . 1 . 2]" 1
1160 1 14 GLY QA 1 15 VAL H 2.515 . 3.230 3.293 3.292 3.294 0.064 19 0 "[ . 1 . 2]" 1
1161 1 14 GLY QA 1 49 LEU MD2 3.810 . 5.820 3.863 3.863 3.864 . 0 0 "[ . 1 . 2]" 1
1162 1 14 GLY QA 1 59 VAL QG 4.215 . 6.630 4.149 3.867 4.463 . 0 0 "[ . 1 . 2]" 1
1163 1 15 VAL H 1 15 VAL HB 2.580 . 3.360 3.610 3.609 3.611 0.251 15 0 "[ . 1 . 2]" 1
1164 1 15 VAL H 1 15 VAL MG2 3.265 . 4.730 4.127 4.125 4.128 . 0 0 "[ . 1 . 2]" 1
1165 1 15 VAL H 1 15 VAL MG1 3.110 . 3.840 3.442 3.441 3.444 . 0 0 "[ . 1 . 2]" 1
1166 1 15 VAL H 1 16 HIS H 3.245 . 4.690 4.303 4.301 4.304 . 0 0 "[ . 1 . 2]" 1
1167 1 15 VAL HA 1 15 VAL HB 2.350 . 2.900 2.522 2.520 2.523 . 0 0 "[ . 1 . 2]" 1
1168 1 15 VAL HA 1 15 VAL MG1 2.855 . 3.910 3.273 3.272 3.274 . 0 0 "[ . 1 . 2]" 1
1169 1 15 VAL HB 1 16 HIS H 2.970 . 4.140 3.655 3.654 3.658 . 0 0 "[ . 1 . 2]" 1
1170 1 15 VAL MG2 1 16 HIS H 3.155 . 4.510 1.608 1.593 1.626 0.207 20 0 "[ . 1 . 2]" 1
1171 1 15 VAL MG1 1 16 HIS H 3.355 . 4.710 2.605 2.604 2.607 . 0 0 "[ . 1 . 2]" 1
1172 1 16 HIS H 1 16 HIS HD2 3.650 . 5.500 5.350 5.348 5.352 . 0 0 "[ . 1 . 2]" 1
1173 1 16 HIS QB 1 18 LYS H 2.890 . 3.980 2.944 2.943 2.945 . 0 0 "[ . 1 . 2]" 1
1174 1 16 HIS QB 1 18 LYS QG 3.935 . 6.070 4.717 4.716 4.718 . 0 0 "[ . 1 . 2]" 1
1175 1 16 HIS QB 1 19 MET H 3.650 . 5.500 3.732 3.723 3.784 . 0 0 "[ . 1 . 2]" 1
1176 1 17 PRO HA 1 17 PRO QD 2.970 . 4.140 3.316 3.314 3.317 . 0 0 "[ . 1 . 2]" 1
1177 1 17 PRO HA 1 20 ILE MD 2.925 . 4.050 4.041 3.787 4.270 0.220 13 0 "[ . 1 . 2]" 1
1178 1 17 PRO QD 1 20 ILE H 3.635 . 5.470 5.530 5.451 5.588 0.118 1 0 "[ . 1 . 2]" 1
1179 1 17 PRO QD 1 63 ILE QG 3.545 . 5.290 4.242 3.984 4.486 . 0 0 "[ . 1 . 2]" 1
1180 1 18 LYS H 1 18 LYS QG 3.330 . 4.860 3.638 3.637 3.639 . 0 0 "[ . 1 . 2]" 1
1181 1 18 LYS HA 1 18 LYS QD 3.345 . 4.890 3.930 3.929 3.931 . 0 0 "[ . 1 . 2]" 1
1182 1 18 LYS QB 1 19 MET H 3.005 . 4.210 2.816 2.806 2.866 . 0 0 "[ . 1 . 2]" 1
1183 1 18 LYS QG 1 19 MET H 3.825 . 5.850 4.297 4.291 4.330 . 0 0 "[ . 1 . 2]" 1
1184 1 19 MET H 1 20 ILE H 2.115 . 2.430 2.370 2.188 2.411 . 0 0 "[ . 1 . 2]" 1
1185 1 19 MET H 1 20 ILE MD 3.495 . 5.190 4.387 4.239 4.515 . 0 0 "[ . 1 . 2]" 1
1186 1 19 MET HA 1 41 LEU QD 4.165 . 6.530 3.874 3.713 4.118 . 0 0 "[ . 1 . 2]" 1
1187 1 20 ILE H 1 20 ILE MG 3.015 . 4.230 3.816 3.790 3.848 . 0 0 "[ . 1 . 2]" 1
1188 1 20 ILE H 1 20 ILE QG 2.755 . 3.710 2.146 2.019 2.288 . 0 0 "[ . 1 . 2]" 1
1189 1 20 ILE H 1 20 ILE MD 2.755 . 3.710 3.188 3.081 3.285 . 0 0 "[ . 1 . 2]" 1
1190 1 20 ILE H 1 21 SER H 3.200 . 4.600 4.588 4.555 4.618 0.018 1 0 "[ . 1 . 2]" 1
1191 1 20 ILE H 1 41 LEU HA 3.280 . 4.760 4.933 4.600 5.490 0.730 2 3 "[ + .* 1 - 2]" 1
1192 1 20 ILE HA 1 41 LEU QD 4.165 . 4.760 3.735 3.497 4.114 . 0 0 "[ . 1 . 2]" 1
1193 1 20 ILE MG 1 21 SER H 2.940 . 4.080 2.287 2.104 2.506 . 0 0 "[ . 1 . 2]" 1
1194 1 20 ILE MG 1 21 SER HA 4.085 . 6.370 3.579 3.498 3.668 . 0 0 "[ . 1 . 2]" 1
1195 1 20 ILE MG 1 22 ASN H 3.250 . 4.700 2.323 1.947 3.287 . 0 0 "[ . 1 . 2]" 1
1196 1 20 ILE MG 1 22 ASN QB 4.600 . 7.400 4.164 3.845 4.741 . 0 0 "[ . 1 . 2]" 1
1197 1 20 ILE QG 1 21 SER H 3.280 . 4.760 4.613 4.542 4.693 . 0 0 "[ . 1 . 2]" 1
1198 1 20 ILE MD 1 59 VAL HA 3.995 . 6.190 7.299 6.802 8.407 2.217 8 20 [-******+************] 1
1199 1 21 SER H 1 21 SER HG 3.420 . 5.040 3.383 3.198 3.564 . 0 0 "[ . 1 . 2]" 1
1200 1 21 SER H 1 40 SER H 3.045 . 4.290 4.192 3.810 4.657 0.367 2 0 "[ . 1 . 2]" 1
1201 1 21 SER HA 1 42 LYS QG 4.090 . 6.380 6.525 6.156 7.327 0.947 9 2 "[ - . +1 . 2]" 1
1202 1 21 SER QB 1 41 LEU HA 2.735 . 3.670 4.122 3.496 4.794 1.124 9 6 "[ *. **+1 -*. 2]" 1
1203 1 21 SER HG 1 22 ASN H 3.640 . 5.480 4.580 4.327 4.684 . 0 0 "[ . 1 . 2]" 1
1204 1 21 SER HG 1 22 ASN HA 4.090 . 6.380 6.399 6.320 6.481 0.101 5 0 "[ . 1 . 2]" 1
1205 1 21 SER HG 1 42 LYS HA 3.330 . 4.860 4.815 3.958 5.876 1.016 2 1 "[ + . 1 . 2]" 1
1206 1 22 ASN H 1 39 ALA HA 3.185 . 4.570 4.957 4.526 5.196 0.626 3 7 "[ *+*.* 1- .** 2]" 1
1207 1 22 ASN H 1 39 ALA MB 3.900 . 6.000 4.103 3.542 4.778 . 0 0 "[ . 1 . 2]" 1
1208 1 22 ASN HA 2 26 PHE H 3.650 . 5.500 5.055 4.941 5.141 . 0 0 "[ . 1 . 2]" 1
1209 1 22 ASN HA 2 27 ALA MB 3.715 . 5.630 4.206 3.625 4.586 . 0 0 "[ . 1 . 2]" 1
1210 1 22 ASN QB 2 26 PHE HA 2.845 . 3.440 3.487 2.633 3.994 0.554 7 1 "[ . + 1 . 2]" 1
1211 1 22 ASN QB 1 23 LEU HA 3.455 . 5.110 4.598 4.374 4.696 . 0 0 "[ . 1 . 2]" 1
1212 1 22 ASN QB 2 27 ALA H 3.145 . 4.490 3.949 3.216 4.403 . 0 0 "[ . 1 . 2]" 1
1213 1 23 LEU H 1 24 GLN H 3.060 . 4.320 4.399 4.264 4.503 0.183 11 0 "[ . 1 . 2]" 1
1214 1 23 LEU HA 1 39 ALA MB 3.095 . 4.390 3.189 3.007 3.550 . 0 0 "[ . 1 . 2]" 1
1215 1 24 GLN H 1 24 GLN QG 3.980 . 6.160 3.151 2.663 3.375 . 0 0 "[ . 1 . 2]" 1
1216 1 24 GLN H 1 25 VAL H 3.030 . 4.260 4.158 3.808 4.404 0.144 20 0 "[ . 1 . 2]" 1
1217 1 24 GLN H 1 38 VAL HB 3.495 . 5.190 5.587 5.238 6.152 0.962 2 4 "[ + .* 1- * . 2]" 1
1218 1 24 GLN H 1 39 ALA MB 3.390 . 4.980 4.045 3.787 4.476 . 0 0 "[ . 1 . 2]" 1
1219 1 24 GLN HA 1 24 GLN HG2 2.660 . 3.520 2.645 2.375 3.513 . 0 0 "[ . 1 . 2]" 1
1220 1 24 GLN HA 1 24 GLN HG3 2.660 . 3.520 2.896 2.586 3.210 . 0 0 "[ . 1 . 2]" 1
1221 1 24 GLN HA 1 24 GLN QG 2.570 . 3.340 2.419 2.305 2.533 . 0 0 "[ . 1 . 2]" 1
1222 1 24 GLN HA 1 25 VAL QG 3.920 . 6.040 3.480 3.333 3.718 . 0 0 "[ . 1 . 2]" 1
1223 1 24 GLN HA 2 25 VAL H 2.970 . 4.140 3.532 3.076 4.122 . 0 0 "[ . 1 . 2]" 1
1224 1 24 GLN QB 1 25 VAL H 2.970 . 4.140 3.345 2.983 3.661 . 0 0 "[ . 1 . 2]" 1
1225 1 24 GLN QB 1 38 VAL H 3.530 . 5.260 3.569 3.076 4.087 . 0 0 "[ . 1 . 2]" 1
1226 1 24 GLN HG2 1 25 VAL H 3.200 . 4.600 4.458 4.026 5.247 0.647 4 1 "[ +. 1 . 2]" 1
1227 1 24 GLN HG3 1 25 VAL H 3.200 . 4.600 4.970 4.682 5.193 0.593 8 3 "[* . -+ 1 . 2]" 1
1228 1 24 GLN QG 1 25 VAL H 3.045 . 4.290 4.140 3.872 4.374 0.084 4 0 "[ . 1 . 2]" 1
1229 1 25 VAL H 1 25 VAL MG1 3.065 . 4.330 3.857 3.816 3.932 . 0 0 "[ . 1 . 2]" 1
1230 1 25 VAL H 1 25 VAL MG2 3.065 . 4.330 2.359 2.213 2.675 . 0 0 "[ . 1 . 2]" 1
1231 1 25 VAL H 1 25 VAL QG 2.710 . 3.620 2.338 2.200 2.633 . 0 0 "[ . 1 . 2]" 1
1232 1 25 VAL H 1 26 PHE H 3.340 . 4.880 4.276 4.028 4.395 . 0 0 "[ . 1 . 2]" 1
1233 1 25 VAL H 2 24 GLN HA 2.970 . 4.140 3.546 3.067 4.046 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 642
_Distance_constraint_stats_list.Viol_count 2431
_Distance_constraint_stats_list.Viol_total 21683.330
_Distance_constraint_stats_list.Viol_max 2.799
_Distance_constraint_stats_list.Viol_rms 0.2599
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0844
_Distance_constraint_stats_list.Viol_average_violations_only 0.4460
_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 25 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 PHE 8.470 0.622 14 4 "[ - 1 * +. * 2]"
1 27 ALA 0.099 0.084 20 0 "[ . 1 . 2]"
1 28 ILE 0.327 0.327 20 0 "[ . 1 . 2]"
1 29 GLY 24.113 1.576 17 20 [**********-*****+***]
1 30 PRO 5.700 0.291 3 0 "[ . 1 . 2]"
1 31 GLN 18.920 1.309 20 20 [**********-********+]
1 32 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 LYS 14.448 1.576 17 9 "[- **.* 1 ** * + *]"
1 35 VAL 6.821 0.622 14 4 "[ - 1 * +. * 2]"
1 36 GLU 1.746 0.094 5 0 "[ . 1 . 2]"
1 37 VAL 68.975 2.593 10 20 [*********+*****-****]
1 38 VAL 13.496 0.880 17 6 "[ * .- *1 * .*+ 2]"
1 39 ALA 19.208 0.890 2 10 "[ + .* * * *** **-2]"
1 40 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 LEU 9.615 0.474 18 0 "[ . 1 . 2]"
1 42 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 ASN 8.909 0.432 8 0 "[ . 1 . 2]"
1 44 GLY 3.319 0.187 1 0 "[ . 1 . 2]"
1 45 LYS 3.244 0.432 8 0 "[ . 1 . 2]"
1 46 GLU 18.080 0.523 16 2 "[ . - 1 .+ 2]"
1 47 ILE 41.842 0.890 2 13 "[ + .***** ******-2]"
1 48 CYS 1.203 0.282 2 0 "[ . 1 . 2]"
1 49 LEU 82.577 2.593 10 20 [*****-***+**********]
1 50 ASP 8.234 0.453 18 0 "[ . 1 . 2]"
1 51 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 GLU 2.591 0.164 13 0 "[ . 1 . 2]"
1 53 ALA 2.591 0.164 13 0 "[ . 1 . 2]"
1 54 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 PHE 6.213 0.424 16 0 "[ . 1 . 2]"
1 56 LEU 29.960 1.417 2 20 [*+******-***********]
1 57 LYS 61.224 1.417 2 20 [*+*********-********]
1 58 LYS 7.402 0.834 5 2 "[ + - 1 . 2]"
1 59 VAL 19.034 0.826 6 14 "[**- .+**** **** **2]"
1 60 ILE 71.173 0.959 8 20 [**-****+************]
1 61 GLN 70.557 0.959 8 20 [*******+************]
1 62 LYS 3.644 0.262 5 0 "[ . 1 . 2]"
1 63 ILE 8.912 0.826 6 5 "[ - .+ * 1 * . *2]"
1 64 LEU 52.721 2.799 8 20 [*******+**-*********]
1 65 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 GLY 0.575 0.090 14 0 "[ . 1 . 2]"
1 68 ASN 0.575 0.090 14 0 "[ . 1 . 2]"
1 70 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 2 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
2 3 GLU 7.676 0.312 16 0 "[ . 1 . 2]"
2 4 LEU 15.393 0.387 6 0 "[ . 1 . 2]"
2 5 ARG 19.409 0.586 4 20 [***+********-*******]
2 6 CYS 19.359 0.586 4 20 [***+********-*******]
2 7 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 8 CYS 7.668 0.385 15 0 "[ . 1 . 2]"
2 9 LEU 5.338 0.268 2 0 "[ . 1 . 2]"
2 10 GLN 18.930 0.392 13 0 "[ . 1 . 2]"
2 11 THR 74.827 1.155 18 20 [*****************+*-]
2 12 THR 13.277 0.608 15 20 [***********-**+*****]
2 13 GLN 41.291 1.571 10 20 [*********+**-*******]
2 14 GLY 43.200 1.663 7 20 [***-**+*************]
2 15 VAL 52.064 1.663 7 20 [***-**+*************]
2 16 HIS 3.852 0.207 20 0 "[ . 1 . 2]"
2 17 PRO 2.879 0.731 4 1 "[ +. 1 . 2]"
2 18 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 19 MET 0.349 0.349 4 0 "[ . 1 . 2]"
2 20 ILE 30.754 1.860 14 20 [*************+****-*]
2 21 SER 17.375 1.163 8 10 "[*- *** + * .*** 2]"
2 22 ASN 10.174 0.651 7 3 "[ * .-+ 1 . 2]"
2 23 LEU 1.054 0.173 8 0 "[ . 1 . 2]"
2 24 GLN 17.570 1.004 8 9 "[ .* +*1* *-* **]"
2 25 VAL 9.358 0.659 9 4 "[ . +1 -* *]"
2 26 PHE 5.743 0.749 4 3 "[ +. 1 . - *]"
2 27 ALA 37.390 2.799 8 20 [*******+******-*****]
2 28 ILE 31.324 2.510 12 19 "[***********+*** *-**]"
2 29 GLY 25.945 2.024 12 19 "[-** *******+********]"
2 30 PRO 5.664 0.300 5 0 "[ . 1 . 2]"
2 31 GLN 19.264 1.031 12 19 "[-** *******+********]"
2 32 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 33 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 34 LYS 15.976 2.024 12 8 "[ - * * 1 +*** *2]"
2 35 VAL 37.027 2.510 12 19 "[***********+*** *-**]"
2 36 GLU 1.812 0.098 16 0 "[ . 1 . 2]"
2 37 VAL 67.019 2.368 3 20 [**+-****************]
2 38 VAL 22.065 1.004 8 14 "[* ** +******* -**]"
2 39 ALA 27.136 0.826 6 13 "[** *+* *1***** *-]"
2 40 SER 0.736 0.249 6 0 "[ . 1 . 2]"
2 41 LEU 23.351 1.163 8 13 "[** *** +** * .***-2]"
2 42 LYS 6.040 0.764 8 2 "[ .- + 1 . 2]"
2 43 ASN 8.953 0.452 4 0 "[ . 1 . 2]"
2 44 GLY 3.390 0.187 19 0 "[ . 1 . 2]"
2 45 LYS 3.167 0.452 4 0 "[ . 1 . 2]"
2 46 GLU 17.679 0.508 17 1 "[ . 1 . + 2]"
2 47 ILE 42.833 0.826 9 14 "[* ** +****** *-**]"
2 48 CYS 47.432 0.906 17 20 [****************+**-]
2 49 LEU 117.782 2.368 3 20 [**+**********-******]
2 50 ASP 44.793 1.571 10 20 [*********+**-*******]
2 51 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
2 52 GLU 2.155 0.164 6 0 "[ . 1 . 2]"
2 53 ALA 2.155 0.164 6 0 "[ . 1 . 2]"
2 54 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
2 55 PHE 6.301 0.486 17 0 "[ . 1 . 2]"
2 56 LEU 30.122 1.435 16 20 [*************-*+****]
2 57 LYS 63.091 1.435 16 20 [***************+***-]
2 58 LYS 7.469 0.580 13 4 "[ ** .- 1 + . 2]"
2 59 VAL 41.893 1.860 14 20 [*************+-*****]
2 60 ILE 71.535 0.964 13 20 [***-********+*******]
2 61 GLN 72.119 0.964 13 20 [***-********+*******]
2 62 LYS 3.764 0.257 7 0 "[ . 1 . 2]"
2 63 ILE 8.793 0.733 19 6 "[ * - 1 **. *+2]"
2 64 LEU 12.651 1.052 5 9 "[ **+* ** .-* *2]"
2 65 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 66 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 67 GLY 0.441 0.091 3 0 "[ . 1 . 2]"
2 68 ASN 0.441 0.091 3 0 "[ . 1 . 2]"
2 70 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 25 VAL QG 1 26 PHE H 3.595 . 5.390 2.918 2.533 3.281 . 0 0 "[ . 1 . 2]" 2
2 1 25 VAL QG 1 26 PHE HA 4.945 . 8.090 3.890 3.686 4.148 . 0 0 "[ . 1 . 2]" 2
3 1 25 VAL QG 1 38 VAL H 4.370 . 6.940 4.402 3.601 4.947 . 0 0 "[ . 1 . 2]" 2
4 1 26 PHE H 1 26 PHE QB 2.380 . 2.730 2.371 2.252 2.515 . 0 0 "[ . 1 . 2]" 2
5 1 26 PHE H 1 26 PHE QD 3.640 . 5.480 2.915 2.460 3.407 . 0 0 "[ . 1 . 2]" 2
6 1 26 PHE H 1 35 VAL QG 3.265 . 4.730 5.031 4.519 5.352 0.622 14 4 "[ - 1 * +. * 2]" 2
7 1 26 PHE H 1 36 GLU QG 4.090 . 6.380 5.809 5.088 6.308 . 0 0 "[ . 1 . 2]" 2
8 1 26 PHE H 2 22 ASN HA 3.650 . 5.500 5.043 4.843 5.131 . 0 0 "[ . 1 . 2]" 2
9 1 26 PHE HA 2 22 ASN QB 2.845 . 3.440 3.453 2.981 3.761 0.321 19 0 "[ . 1 . 2]" 2
10 1 26 PHE QD 1 27 ALA H 2.990 . 4.180 3.927 3.395 4.194 0.014 3 0 "[ . 1 . 2]" 2
11 1 27 ALA H 2 22 ASN QB 3.145 . 4.490 3.905 3.383 4.574 0.084 20 0 "[ . 1 . 2]" 2
12 1 27 ALA MB 1 28 ILE MD 3.240 . 4.680 4.081 2.995 4.364 . 0 0 "[ . 1 . 2]" 2
13 1 27 ALA MB 1 35 VAL QG 3.810 . 5.820 3.028 2.676 3.464 . 0 0 "[ . 1 . 2]" 2
14 1 27 ALA MB 2 22 ASN HA 3.715 . 5.630 4.163 3.681 4.751 . 0 0 "[ . 1 . 2]" 2
15 1 28 ILE QG 1 29 GLY H 3.655 . 5.510 2.685 2.408 2.974 . 0 0 "[ . 1 . 2]" 2
16 1 28 ILE MD 1 29 GLY H 3.695 . 5.590 5.112 3.926 5.314 . 0 0 "[ . 1 . 2]" 2
17 1 28 ILE MD 1 35 VAL QG 3.655 . 5.510 3.798 3.143 5.837 0.327 20 0 "[ . 1 . 2]" 2
18 1 29 GLY H 1 30 PRO HD2 3.510 . 5.220 5.010 4.900 5.354 0.134 20 0 "[ . 1 . 2]" 2
19 1 29 GLY H 1 30 PRO HD3 3.480 . 5.160 4.640 4.562 4.692 . 0 0 "[ . 1 . 2]" 2
20 1 29 GLY H 1 31 GLN H 2.640 . 3.480 4.148 3.983 4.789 1.309 20 20 [**********-********+] 2
21 1 29 GLY H 1 32 CYS QB 3.575 . 5.350 3.540 3.084 4.589 . 0 0 "[ . 1 . 2]" 2
22 1 29 GLY H 1 33 SER QB 4.165 . 6.530 5.323 4.472 5.807 . 0 0 "[ . 1 . 2]" 2
23 1 29 GLY H 1 34 LYS H 3.075 . 4.350 4.843 4.044 5.926 1.576 17 9 "[- **.* 1 ** * + *]" 2
24 1 29 GLY QA 1 31 GLN H 3.005 . 4.210 3.062 3.002 3.093 . 0 0 "[ . 1 . 2]" 2
25 1 30 PRO HA 1 31 GLN H 2.455 . 3.110 3.388 3.371 3.401 0.291 3 0 "[ . 1 . 2]" 2
26 1 30 PRO HG2 1 31 GLN H 3.650 . 5.500 4.267 4.216 4.333 . 0 0 "[ . 1 . 2]" 2
27 1 30 PRO HG3 1 31 GLN H 3.650 . 5.500 4.619 4.588 4.658 . 0 0 "[ . 1 . 2]" 2
28 1 30 PRO HD2 1 31 GLN H 2.955 . 4.110 2.458 2.407 2.520 . 0 0 "[ . 1 . 2]" 2
29 1 30 PRO HD2 1 32 CYS H 3.155 . 4.510 4.274 4.200 4.323 . 0 0 "[ . 1 . 2]" 2
30 1 30 PRO HD3 1 31 GLN H 3.245 . 4.690 3.623 3.584 3.657 . 0 0 "[ . 1 . 2]" 2
31 1 30 PRO HD3 1 32 CYS H 3.650 . 5.500 5.038 5.003 5.080 . 0 0 "[ . 1 . 2]" 2
32 1 31 GLN QB 1 32 CYS H 2.955 . 4.110 3.680 3.661 3.690 . 0 0 "[ . 1 . 2]" 2
33 1 32 CYS QB 1 34 LYS H 3.590 . 5.380 3.302 2.879 4.379 . 0 0 "[ . 1 . 2]" 2
34 1 34 LYS H 1 34 LYS QG 2.850 . 3.900 4.035 2.776 4.213 0.313 8 0 "[ . 1 . 2]" 2
35 1 35 VAL QG 1 36 GLU H 2.770 . 3.740 3.486 3.173 3.700 . 0 0 "[ . 1 . 2]" 2
36 1 35 VAL QG 1 36 GLU HA 4.165 . 6.530 3.910 3.373 4.314 . 0 0 "[ . 1 . 2]" 2
37 1 35 VAL QG 1 37 VAL HA 4.165 . 6.530 5.741 5.045 6.031 . 0 0 "[ . 1 . 2]" 2
38 1 35 VAL QG 1 51 PRO QB 4.460 . 7.120 3.495 2.824 3.800 . 0 0 "[ . 1 . 2]" 2
39 1 35 VAL QG 1 51 PRO HG2 3.205 . 4.610 3.001 2.378 3.846 . 0 0 "[ . 1 . 2]" 2
40 1 36 GLU H 1 36 GLU HB2 2.920 . 4.040 2.842 2.654 3.093 . 0 0 "[ . 1 . 2]" 2
41 1 36 GLU H 1 36 GLU HB3 2.920 . 4.040 3.850 3.660 3.914 . 0 0 "[ . 1 . 2]" 2
42 1 36 GLU H 1 36 GLU QG 3.995 . 6.190 2.660 2.223 2.775 . 0 0 "[ . 1 . 2]" 2
43 1 36 GLU HA 1 36 GLU HB2 2.365 . 2.930 3.017 2.968 3.024 0.094 5 0 "[ . 1 . 2]" 2
44 1 36 GLU HA 1 36 GLU HB3 2.365 . 2.930 2.386 2.288 2.421 . 0 0 "[ . 1 . 2]" 2
45 1 36 GLU HA 1 36 GLU QB 2.240 . 2.680 2.300 2.216 2.329 . 0 0 "[ . 1 . 2]" 2
46 1 36 GLU HA 1 37 VAL MG2 3.870 . 5.940 3.445 3.350 3.640 . 0 0 "[ . 1 . 2]" 2
47 1 36 GLU HA 1 51 PRO HG3 3.400 . 5.000 3.315 2.635 3.963 . 0 0 "[ . 1 . 2]" 2
48 1 36 GLU HA 1 51 PRO QD 3.650 . 5.500 3.177 2.667 3.574 . 0 0 "[ . 1 . 2]" 2
49 1 36 GLU QG 1 37 VAL H 4.090 . 6.380 4.324 4.189 4.539 . 0 0 "[ . 1 . 2]" 2
50 1 37 VAL H 1 37 VAL MG1 3.265 . 4.730 3.000 2.835 3.075 . 0 0 "[ . 1 . 2]" 2
51 1 37 VAL H 1 37 VAL MG2 2.800 . 3.800 1.848 1.678 2.027 0.122 8 0 "[ . 1 . 2]" 2
52 1 37 VAL H 1 38 VAL MG1 3.855 . 5.910 4.342 4.167 4.410 . 0 0 "[ . 1 . 2]" 2
53 1 37 VAL H 1 51 PRO QD 3.650 . 5.500 3.059 2.762 3.388 . 0 0 "[ . 1 . 2]" 2
54 1 37 VAL HA 1 38 VAL MG1 4.090 . 6.380 3.508 3.414 3.799 . 0 0 "[ . 1 . 2]" 2
55 1 37 VAL HB 1 38 VAL H 3.245 . 4.690 3.668 3.491 3.751 . 0 0 "[ . 1 . 2]" 2
56 1 37 VAL HB 1 49 LEU H 2.535 . 3.270 5.174 4.791 5.863 2.593 10 20 [**-******+**********] 2
57 1 37 VAL HB 1 49 LEU HA 3.650 . 5.500 7.029 6.585 7.560 2.060 10 20 [*********+*****-****] 2
58 1 37 VAL MG2 1 50 ASP H 4.165 . 6.530 4.720 4.359 5.196 . 0 0 "[ . 1 . 2]" 2
59 1 38 VAL H 1 38 VAL MG2 3.295 . 4.790 2.520 2.108 2.795 . 0 0 "[ . 1 . 2]" 2
60 1 38 VAL H 1 38 VAL MG1 3.090 . 3.980 2.087 1.904 2.438 . 0 0 "[ . 1 . 2]" 2
61 1 38 VAL H 1 39 ALA MB 4.165 . 6.530 5.099 4.948 5.125 . 0 0 "[ . 1 . 2]" 2
62 1 38 VAL H 1 49 LEU H 3.355 . 4.910 5.194 4.934 5.548 0.638 2 2 "[ + .- 1 . 2]" 2
63 1 38 VAL HA 1 38 VAL MG1 2.860 . 3.710 2.642 2.430 2.773 . 0 0 "[ . 1 . 2]" 2
64 1 38 VAL MG2 1 47 ILE H 3.310 . 4.820 5.207 4.747 5.700 0.880 17 6 "[ * .- *1 * .*+ 2]" 2
65 1 38 VAL MG2 1 48 CYS HA 4.070 . 6.340 4.934 4.559 5.359 . 0 0 "[ . 1 . 2]" 2
66 1 38 VAL MG1 1 39 ALA H 3.650 . 5.500 4.076 3.834 4.171 . 0 0 "[ . 1 . 2]" 2
67 1 39 ALA H 1 46 GLU HA 3.385 . 4.970 4.561 4.326 5.108 0.138 10 0 "[ . 1 . 2]" 2
68 1 39 ALA H 1 47 ILE HB 3.465 . 5.130 5.616 5.331 6.020 0.890 2 10 "[ + .* * * *** **-2]" 2
69 1 39 ALA H 1 48 CYS H 3.540 . 5.280 5.288 4.939 5.562 0.282 2 0 "[ . 1 . 2]" 2
70 1 39 ALA H 1 49 LEU HG 3.260 . 4.720 4.112 3.613 4.641 . 0 0 "[ . 1 . 2]" 2
71 1 39 ALA H 1 49 LEU MD1 3.480 . 5.160 4.699 4.200 5.155 . 0 0 "[ . 1 . 2]" 2
72 1 39 ALA HA 1 40 SER HA 3.245 . 4.690 4.452 4.409 4.456 . 0 0 "[ . 1 . 2]" 2
73 1 39 ALA HA 1 47 ILE H 3.280 . 4.760 5.168 4.854 5.391 0.631 2 4 "[ + .- * . * 2]" 2
74 1 39 ALA MB 1 40 SER H 2.940 . 4.080 2.613 2.547 2.623 . 0 0 "[ . 1 . 2]" 2
75 1 39 ALA MB 1 47 ILE H 3.310 . 4.820 3.945 3.743 4.394 . 0 0 "[ . 1 . 2]" 2
76 1 39 ALA MB 1 48 CYS HA 4.165 . 6.530 5.009 4.804 5.399 . 0 0 "[ . 1 . 2]" 2
77 1 40 SER HA 1 46 GLU QG 4.025 . 6.250 5.126 4.832 5.348 . 0 0 "[ . 1 . 2]" 2
78 1 41 LEU H 1 41 LEU HG 2.970 . 4.140 3.727 3.504 3.923 . 0 0 "[ . 1 . 2]" 2
79 1 41 LEU H 1 46 GLU QB 3.215 . 4.630 4.767 4.270 5.020 0.390 18 0 "[ . 1 . 2]" 2
80 1 41 LEU H 1 46 GLU QG 4.090 . 6.380 5.944 5.565 6.236 . 0 0 "[ . 1 . 2]" 2
81 1 41 LEU H 1 47 ILE H 3.170 . 4.540 4.853 4.460 5.014 0.474 18 0 "[ . 1 . 2]" 2
82 1 41 LEU HA 1 41 LEU HG 2.690 . 3.580 2.377 2.328 2.417 . 0 0 "[ . 1 . 2]" 2
83 1 41 LEU HA 1 41 LEU QD . . 3.430 2.827 2.675 2.982 . 0 0 "[ . 1 . 2]" 2
84 1 41 LEU HA 1 42 LYS QG 4.090 . 6.380 6.040 5.877 6.097 . 0 0 "[ . 1 . 2]" 2
85 1 41 LEU HB2 1 43 ASN QD 3.650 . 5.500 4.252 4.085 4.583 . 0 0 "[ . 1 . 2]" 2
86 1 41 LEU HB3 1 43 ASN QD 3.650 . 5.500 3.583 3.385 3.911 . 0 0 "[ . 1 . 2]" 2
87 1 41 LEU QB 1 42 LYS H 3.065 . 4.330 2.230 2.072 2.475 . 0 0 "[ . 1 . 2]" 2
88 1 41 LEU QB 1 43 ASN H 2.880 . 3.960 2.214 2.110 2.327 . 0 0 "[ . 1 . 2]" 2
89 1 41 LEU QB 1 43 ASN QD 3.385 . 4.970 3.404 3.238 3.673 . 0 0 "[ . 1 . 2]" 2
90 1 41 LEU QB 1 45 LYS H 2.680 . 3.560 2.578 2.322 2.878 . 0 0 "[ . 1 . 2]" 2
91 1 41 LEU QB 1 46 GLU HA 4.090 . 6.380 5.128 4.760 5.377 . 0 0 "[ . 1 . 2]" 2
92 1 41 LEU QD 1 43 ASN QD 3.635 . 5.070 2.786 2.493 3.160 . 0 0 "[ . 1 . 2]" 2
93 1 41 LEU QD 1 47 ILE H 3.700 . 5.600 3.772 3.286 4.028 . 0 0 "[ . 1 . 2]" 2
94 1 41 LEU QD 1 43 ASN H 3.325 . 4.850 3.635 3.559 3.702 . 0 0 "[ . 1 . 2]" 2
95 1 42 LYS H 1 42 LYS QB 2.620 . 3.440 2.269 2.250 2.285 . 0 0 "[ . 1 . 2]" 2
96 1 42 LYS H 1 42 LYS QG 3.280 . 4.760 4.051 3.974 4.081 . 0 0 "[ . 1 . 2]" 2
97 1 42 LYS H 1 42 LYS QD 3.780 . 5.760 4.177 4.014 4.394 . 0 0 "[ . 1 . 2]" 2
98 1 42 LYS HA 1 42 LYS QG 2.880 . 3.960 2.871 2.418 3.023 . 0 0 "[ . 1 . 2]" 2
99 1 42 LYS HA 1 42 LYS QD 2.835 . 3.870 2.091 1.941 3.798 . 0 0 "[ . 1 . 2]" 2
100 1 42 LYS QG 1 43 ASN H 4.090 . 6.380 4.193 3.983 4.432 . 0 0 "[ . 1 . 2]" 2
101 1 42 LYS QD 1 43 ASN H 3.590 . 5.380 4.859 4.725 5.317 . 0 0 "[ . 1 . 2]" 2
102 1 43 ASN H 1 43 ASN HB2 2.565 . 3.330 2.480 2.459 2.520 . 0 0 "[ . 1 . 2]" 2
103 1 43 ASN H 1 43 ASN HB3 2.565 . 3.330 3.613 3.600 3.635 0.305 8 0 "[ . 1 . 2]" 2
104 1 43 ASN H 1 43 ASN QB 2.450 . 3.100 2.439 2.420 2.474 . 0 0 "[ . 1 . 2]" 2
105 1 43 ASN H 1 43 ASN QD 3.650 . 5.500 3.479 3.414 3.559 . 0 0 "[ . 1 . 2]" 2
106 1 43 ASN HA 1 43 ASN QD 3.480 . 5.160 4.083 4.072 4.100 . 0 0 "[ . 1 . 2]" 2
107 1 43 ASN HB2 1 43 ASN QD 2.470 . 3.140 2.195 2.179 2.207 . 0 0 "[ . 1 . 2]" 2
108 1 43 ASN HB3 1 43 ASN QD 2.470 . 3.140 2.841 2.829 2.867 . 0 0 "[ . 1 . 2]" 2
109 1 43 ASN QB 1 43 ASN QD 2.340 . 2.880 2.126 2.116 2.135 . 0 0 "[ . 1 . 2]" 2
110 1 43 ASN QD 1 45 LYS QB 3.310 . 4.510 4.533 4.305 4.687 0.177 16 0 "[ . 1 . 2]" 2
111 1 43 ASN QD 1 45 LYS QG 3.045 . 4.260 4.346 3.889 4.692 0.432 8 0 "[ . 1 . 2]" 2
112 1 44 GLY H 1 44 GLY HA2 2.285 . 2.770 2.394 2.328 2.475 . 0 0 "[ . 1 . 2]" 2
113 1 44 GLY H 1 44 GLY HA3 2.285 . 2.770 2.936 2.897 2.957 0.187 1 0 "[ . 1 . 2]" 2
114 1 44 GLY H 1 44 GLY QA 2.185 . 2.570 2.293 2.237 2.356 . 0 0 "[ . 1 . 2]" 2
115 1 45 LYS H 1 45 LYS QG 3.185 . 3.270 3.034 2.681 3.206 . 0 0 "[ . 1 . 2]" 2
116 1 45 LYS H 1 46 GLU H 3.230 . 4.660 4.443 4.035 4.553 . 0 0 "[ . 1 . 2]" 2
117 1 45 LYS HA 1 45 LYS QG 2.365 . 2.930 2.402 2.297 2.475 . 0 0 "[ . 1 . 2]" 2
118 1 45 LYS QB 1 46 GLU HA 3.650 . 5.500 4.058 3.964 4.454 . 0 0 "[ . 1 . 2]" 2
119 1 45 LYS QG 1 46 GLU H 3.215 . 4.630 3.824 3.704 4.172 . 0 0 "[ . 1 . 2]" 2
120 1 46 GLU H 1 46 GLU HA 2.335 . 2.870 2.944 2.898 2.954 0.084 18 0 "[ . 1 . 2]" 2
121 1 46 GLU H 1 46 GLU QB 2.335 . 2.870 3.034 2.807 3.182 0.312 2 0 "[ . 1 . 2]" 2
122 1 46 GLU H 1 46 GLU QG 3.020 . 4.240 2.166 1.752 2.329 0.048 7 0 "[ . 1 . 2]" 2
123 1 46 GLU HA 1 47 ILE HB 3.495 . 5.190 5.680 5.670 5.713 0.523 16 2 "[ . - 1 .+ 2]" 2
124 1 46 GLU QG 1 47 ILE H 3.375 . 4.950 4.076 4.012 4.392 . 0 0 "[ . 1 . 2]" 2
125 1 47 ILE HA 1 48 CYS H 2.440 . 3.080 2.541 2.540 2.542 . 0 0 "[ . 1 . 2]" 2
126 1 47 ILE HB 1 48 CYS H 2.955 . 4.110 2.062 2.061 2.064 . 0 0 "[ . 1 . 2]" 2
127 1 47 ILE HB 1 48 CYS HA 4.165 . 6.530 4.517 4.516 4.519 . 0 0 "[ . 1 . 2]" 2
128 1 48 CYS H 1 49 LEU HG 3.620 . 5.440 4.748 4.747 4.749 . 0 0 "[ . 1 . 2]" 2
129 1 48 CYS HA 1 49 LEU HA 3.295 . 4.790 4.383 4.382 4.384 . 0 0 "[ . 1 . 2]" 2
130 1 48 CYS HA 1 49 LEU QB 4.090 . 6.380 4.162 4.158 4.164 . 0 0 "[ . 1 . 2]" 2
131 1 48 CYS HA 1 49 LEU HG 3.370 . 4.940 3.595 3.594 3.597 . 0 0 "[ . 1 . 2]" 2
132 1 48 CYS HA 1 49 LEU MD1 4.165 . 6.530 4.997 4.996 4.998 . 0 0 "[ . 1 . 2]" 2
133 1 49 LEU H 1 49 LEU QB 2.725 . 3.650 2.391 2.386 2.395 . 0 0 "[ . 1 . 2]" 2
134 1 49 LEU H 1 49 LEU HG 2.485 . 3.170 2.828 2.827 2.830 . 0 0 "[ . 1 . 2]" 2
135 1 49 LEU H 1 49 LEU MD1 3.155 . 4.510 4.011 4.009 4.012 . 0 0 "[ . 1 . 2]" 2
136 1 49 LEU H 1 49 LEU MD2 3.250 . 4.700 3.502 3.501 3.503 . 0 0 "[ . 1 . 2]" 2
137 1 49 LEU HA 1 49 LEU HG 2.795 . 3.790 3.339 3.337 3.340 . 0 0 "[ . 1 . 2]" 2
138 1 49 LEU HA 1 49 LEU MD1 3.155 . 4.510 3.816 3.815 3.817 . 0 0 "[ . 1 . 2]" 2
139 1 49 LEU HA 1 49 LEU MD2 2.770 . 3.740 2.203 2.201 2.205 . 0 0 "[ . 1 . 2]" 2
140 1 49 LEU QB 1 50 ASP H 2.850 . 3.900 2.889 2.848 2.934 . 0 0 "[ . 1 . 2]" 2
141 1 49 LEU HG 1 50 ASP H 3.325 . 4.850 5.262 5.223 5.303 0.453 18 0 "[ . 1 . 2]" 2
142 1 49 LEU MD1 1 50 ASP H 4.165 . 6.530 4.690 4.653 4.735 . 0 0 "[ . 1 . 2]" 2
143 1 49 LEU MD2 1 50 ASP H 3.250 . 4.700 3.726 3.684 3.763 . 0 0 "[ . 1 . 2]" 2
144 1 49 LEU MD2 1 56 LEU HA 3.805 . 5.810 4.980 4.679 5.250 . 0 0 "[ . 1 . 2]" 2
145 1 50 ASP H 1 53 ALA MB 3.340 . 4.740 4.197 3.983 4.327 . 0 0 "[ . 1 . 2]" 2
146 1 50 ASP QB 1 53 ALA H 3.650 . 4.290 3.258 3.138 3.376 . 0 0 "[ . 1 . 2]" 2
147 1 50 ASP QB 1 53 ALA MB 3.030 . 3.580 3.104 2.924 3.262 . 0 0 "[ . 1 . 2]" 2
148 1 51 PRO HG2 1 52 GLU H 3.355 . 4.910 4.309 4.191 4.481 . 0 0 "[ . 1 . 2]" 2
149 1 51 PRO HG3 1 52 GLU H 3.650 . 5.500 4.649 4.552 4.745 . 0 0 "[ . 1 . 2]" 2
150 1 52 GLU H 1 53 ALA MB 3.125 . 4.170 4.291 4.086 4.334 0.164 13 0 "[ . 1 . 2]" 2
151 1 52 GLU QB 1 53 ALA H 3.080 . 4.360 3.156 3.141 3.270 . 0 0 "[ . 1 . 2]" 2
152 1 52 GLU QB 1 53 ALA HA 4.165 . 6.530 4.288 4.126 4.364 . 0 0 "[ . 1 . 2]" 2
153 1 53 ALA HA 1 54 PRO HD2 2.315 . 2.830 2.184 2.182 2.186 . 0 0 "[ . 1 . 2]" 2
154 1 53 ALA HA 1 54 PRO HD3 2.315 . 2.830 2.352 2.351 2.354 . 0 0 "[ . 1 . 2]" 2
155 1 53 ALA HA 1 54 PRO QD 2.185 . 2.570 2.011 2.010 2.013 . 0 0 "[ . 1 . 2]" 2
156 1 53 ALA HA 1 55 PHE H 3.245 . 4.690 4.266 4.264 4.268 . 0 0 "[ . 1 . 2]" 2
157 1 53 ALA MB 1 55 PHE H 3.235 . 4.670 3.233 3.225 3.244 . 0 0 "[ . 1 . 2]" 2
158 1 54 PRO HA 1 56 LEU H 3.075 . 4.350 3.990 3.930 4.053 . 0 0 "[ . 1 . 2]" 2
159 1 54 PRO HA 1 57 LYS QB 3.080 . 4.360 2.835 2.451 3.229 . 0 0 "[ . 1 . 2]" 2
160 1 54 PRO QD 1 55 PHE H 3.425 . 5.050 2.732 2.731 2.733 . 0 0 "[ . 1 . 2]" 2
161 1 55 PHE H 1 55 PHE HA 2.350 . 2.900 2.811 2.810 2.813 . 0 0 "[ . 1 . 2]" 2
162 1 55 PHE H 1 55 PHE QB 2.670 . 3.540 2.500 2.499 2.502 . 0 0 "[ . 1 . 2]" 2
163 1 55 PHE H 1 55 PHE QE 3.125 . 4.450 4.162 4.161 4.163 . 0 0 "[ . 1 . 2]" 2
164 1 55 PHE HA 1 56 LEU HA 3.245 . 4.690 4.735 4.675 4.812 0.122 2 0 "[ . 1 . 2]" 2
165 1 55 PHE HA 1 57 LYS H 2.845 . 3.890 4.154 3.960 4.314 0.424 16 0 "[ . 1 . 2]" 2
166 1 55 PHE QB 1 56 LEU H 3.175 . 4.550 3.583 3.565 3.599 . 0 0 "[ . 1 . 2]" 2
167 1 56 LEU H 1 57 LYS QD 3.545 . 5.290 6.564 6.443 6.707 1.417 2 20 [*+******-***********] 2
168 1 56 LEU HA 1 57 LYS HA 3.200 . 4.600 4.776 4.689 4.820 0.220 10 0 "[ . 1 . 2]" 2
169 1 56 LEU HA 1 58 LYS H 2.905 . 4.010 3.852 3.708 4.031 0.021 1 0 "[ . 1 . 2]" 2
170 1 57 LYS H 1 57 LYS QB 2.570 . 3.340 2.242 2.216 2.295 . 0 0 "[ . 1 . 2]" 2
171 1 57 LYS H 1 57 LYS QG 2.815 . 3.630 3.974 3.948 3.995 0.365 13 0 "[ . 1 . 2]" 2
172 1 57 LYS H 1 57 LYS QD 3.405 . 5.010 4.616 4.433 4.661 . 0 0 "[ . 1 . 2]" 2
173 1 57 LYS H 1 59 VAL H 3.420 . 5.040 4.626 4.515 4.756 . 0 0 "[ . 1 . 2]" 2
174 1 57 LYS HA 1 57 LYS QG 3.000 . 3.730 2.437 2.200 2.599 . 0 0 "[ . 1 . 2]" 2
175 1 57 LYS HA 1 57 LYS QD 2.875 . 3.950 4.064 3.548 4.229 0.279 10 0 "[ . 1 . 2]" 2
176 1 57 LYS HA 1 60 ILE H 2.845 . 3.890 3.726 3.672 3.812 . 0 0 "[ . 1 . 2]" 2
177 1 57 LYS HA 1 60 ILE MG 4.165 . 6.530 3.559 3.117 3.732 . 0 0 "[ . 1 . 2]" 2
178 1 57 LYS HA 1 60 ILE QG 4.090 . 6.380 1.935 1.818 2.080 . 0 0 "[ . 1 . 2]" 2
179 1 57 LYS HA 1 60 ILE MD 3.080 . 4.360 2.173 2.024 2.420 . 0 0 "[ . 1 . 2]" 2
180 1 57 LYS HA 1 61 GLN H 2.860 . 3.920 4.329 4.064 4.847 0.927 13 7 "[ * ** * 1 -+ * 2]" 2
181 1 57 LYS HA 2 64 LEU QD 4.165 . 6.530 6.904 5.865 7.582 1.052 5 9 "[ **+* *- .** *2]" 2
182 1 58 LYS H 1 58 LYS QB 2.570 . 3.340 2.359 2.353 2.362 . 0 0 "[ . 1 . 2]" 2
183 1 58 LYS H 1 58 LYS HG2 2.610 . 3.420 3.526 3.463 3.590 0.170 5 0 "[ . 1 . 2]" 2
184 1 58 LYS H 1 58 LYS HG3 2.610 . 3.420 2.396 2.323 2.472 . 0 0 "[ . 1 . 2]" 2
185 1 58 LYS H 1 58 LYS QD 3.500 . 5.200 3.882 3.841 3.927 . 0 0 "[ . 1 . 2]" 2
186 1 58 LYS HA 1 58 LYS QG 2.820 . 3.840 2.332 2.331 2.334 . 0 0 "[ . 1 . 2]" 2
187 1 58 LYS HA 1 58 LYS QD 3.020 . 4.240 4.164 4.163 4.165 . 0 0 "[ . 1 . 2]" 2
188 1 58 LYS HA 1 61 GLN QB 2.755 . 3.710 2.724 2.559 3.246 . 0 0 "[ . 1 . 2]" 2
189 1 58 LYS HA 1 61 GLN QG 3.140 . 4.480 4.743 4.571 5.314 0.834 5 2 "[ + - 1 . 2]" 2
190 1 58 LYS HG2 1 59 VAL H 3.650 . 5.500 4.819 4.789 4.841 . 0 0 "[ . 1 . 2]" 2
191 1 58 LYS HG3 1 59 VAL H 3.650 . 5.500 4.240 4.217 4.264 . 0 0 "[ . 1 . 2]" 2
192 1 58 LYS QG 1 59 VAL H 3.545 . 5.290 3.979 3.957 4.000 . 0 0 "[ . 1 . 2]" 2
193 1 59 VAL H 1 59 VAL HA 2.335 . 2.870 2.799 2.772 2.817 . 0 0 "[ . 1 . 2]" 2
194 1 59 VAL H 1 59 VAL QG 3.220 . 3.690 1.871 1.816 1.920 . 0 0 "[ . 1 . 2]" 2
195 1 59 VAL H 1 60 ILE QG 4.090 . 6.380 4.217 4.122 4.307 . 0 0 "[ . 1 . 2]" 2
196 1 59 VAL HA 1 59 VAL QG . . 2.720 2.283 2.219 2.327 . 0 0 "[ . 1 . 2]" 2
197 1 59 VAL HA 1 63 ILE H 3.015 . 4.230 4.676 4.257 5.056 0.826 6 5 "[ - .+ * 1 * . *2]" 2
198 1 59 VAL HA 1 63 ILE QG 4.090 . 6.380 4.146 3.970 4.472 . 0 0 "[ . 1 . 2]" 2
199 1 59 VAL HB 1 60 ILE H 2.640 . 3.480 3.986 3.849 4.048 0.568 18 12 "[**- .** ** *** +*2]" 2
200 1 59 VAL QG 1 60 ILE H 3.420 . 5.040 2.361 2.311 2.407 . 0 0 "[ . 1 . 2]" 2
201 1 59 VAL QG 1 63 ILE QG 3.625 . 5.450 3.905 3.631 4.099 . 0 0 "[ . 1 . 2]" 2
202 1 60 ILE H 1 60 ILE MG 3.015 . 4.230 2.356 2.242 2.430 . 0 0 "[ . 1 . 2]" 2
203 1 60 ILE H 1 60 ILE QG 2.660 . 3.520 2.186 2.134 2.276 . 0 0 "[ . 1 . 2]" 2
204 1 60 ILE H 1 60 ILE MD 3.030 . 4.260 3.825 3.787 3.903 . 0 0 "[ . 1 . 2]" 2
205 1 60 ILE H 1 61 GLN QG 3.650 . 5.500 6.045 5.970 6.195 0.695 5 15 "[* **+* *******.- * *]" 2
206 1 60 ILE HA 1 60 ILE MG 2.645 . 3.490 2.375 2.334 2.410 . 0 0 "[ . 1 . 2]" 2
207 1 60 ILE HA 1 60 ILE QG 2.240 . 2.680 3.322 3.316 3.329 0.649 7 20 [*-****+*************] 2
208 1 60 ILE HA 1 60 ILE MD 3.080 . 4.360 4.176 4.165 4.184 . 0 0 "[ . 1 . 2]" 2
209 1 60 ILE HA 1 62 LYS H 2.985 . 4.170 4.342 3.975 4.432 0.262 5 0 "[ . 1 . 2]" 2
210 1 60 ILE HA 1 63 ILE QG 2.830 . 3.860 2.130 1.996 2.416 . 0 0 "[ . 1 . 2]" 2
211 1 60 ILE MG 1 61 GLN H 3.360 . 4.920 4.019 3.980 4.061 . 0 0 "[ . 1 . 2]" 2
212 1 60 ILE MG 1 61 GLN HA 3.185 . 4.570 5.507 5.494 5.529 0.959 8 20 [*******+**********-*] 2
213 1 60 ILE MG 1 61 GLN QG 3.825 . 5.850 6.597 6.559 6.642 0.792 8 20 [*******+*********-**] 2
214 1 60 ILE QG 1 61 GLN H 4.090 . 6.380 2.486 2.217 2.661 . 0 0 "[ . 1 . 2]" 2
215 1 60 ILE MD 1 61 GLN H 4.055 . 6.310 4.179 3.936 4.343 . 0 0 "[ . 1 . 2]" 2
216 1 61 GLN H 1 61 GLN QB 2.685 . 3.570 2.274 2.259 2.306 . 0 0 "[ . 1 . 2]" 2
217 1 61 GLN H 1 61 GLN QG 2.660 . 3.520 3.971 3.962 3.995 0.475 15 0 "[ . 1 . 2]" 2
218 1 61 GLN H 2 64 LEU QD 4.165 . 6.530 6.597 5.879 7.389 0.859 10 2 "[ . + .- 2]" 2
219 1 61 GLN HA 1 61 GLN QG 2.225 . 2.650 2.360 2.259 2.494 . 0 0 "[ . 1 . 2]" 2
220 1 61 GLN HA 1 63 ILE H 3.260 . 4.720 4.240 4.061 4.402 . 0 0 "[ . 1 . 2]" 2
221 1 61 GLN HA 1 64 LEU QD 3.480 . 5.160 2.582 2.141 3.644 . 0 0 "[ . 1 . 2]" 2
222 1 61 GLN QG 1 62 LYS H 3.400 . 5.000 3.717 3.626 4.017 . 0 0 "[ . 1 . 2]" 2
223 1 61 GLN QG 1 64 LEU QD 3.870 . 5.940 3.686 3.036 4.707 . 0 0 "[ . 1 . 2]" 2
224 1 62 LYS H 1 62 LYS QB 2.785 . 3.770 2.335 2.166 2.457 . 0 0 "[ . 1 . 2]" 2
225 1 62 LYS H 1 62 LYS HG2 3.125 . 4.450 3.529 2.819 3.836 . 0 0 "[ . 1 . 2]" 2
226 1 62 LYS H 1 62 LYS HG3 3.125 . 4.450 2.504 2.157 3.767 . 0 0 "[ . 1 . 2]" 2
227 1 62 LYS H 1 62 LYS QG 2.780 . 3.760 2.414 2.137 2.769 . 0 0 "[ . 1 . 2]" 2
228 1 63 ILE H 1 63 ILE QG 2.815 . 3.830 1.871 1.808 1.943 . 0 0 "[ . 1 . 2]" 2
229 1 63 ILE HA 1 63 ILE QG 2.615 . 3.430 2.270 2.171 2.375 . 0 0 "[ . 1 . 2]" 2
230 1 64 LEU H 1 64 LEU HB2 2.505 . 3.210 2.443 2.258 2.577 . 0 0 "[ . 1 . 2]" 2
231 1 64 LEU H 1 64 LEU HB3 2.795 . 3.790 3.627 3.537 3.663 . 0 0 "[ . 1 . 2]" 2
232 1 64 LEU H 1 64 LEU HG 2.795 . 3.790 2.758 2.341 3.416 . 0 0 "[ . 1 . 2]" 2
233 1 64 LEU H 1 64 LEU QD 3.465 . 5.130 3.337 3.128 3.658 . 0 0 "[ . 1 . 2]" 2
234 1 64 LEU HA 1 64 LEU QD 3.310 . 4.820 2.087 2.013 2.230 . 0 0 "[ . 1 . 2]" 2
235 1 64 LEU QD 1 65 ASP H 4.165 . 6.530 4.206 3.912 4.430 . 0 0 "[ . 1 . 2]" 2
236 1 64 LEU QD 2 27 ALA H 4.025 . 6.250 8.117 6.986 9.049 2.799 8 20 [*******+******-*****] 2
237 1 64 LEU QD 2 57 LYS HA 4.165 . 6.530 7.025 5.887 7.673 1.143 14 11 "[ *-.** *** +. ***2]" 2
238 1 64 LEU QD 2 61 GLN H 4.165 . 6.530 6.723 6.155 7.402 0.872 14 4 "[ . *1- *+. 2]" 2
239 1 65 ASP H 1 65 ASP HB2 2.640 . 3.480 2.649 2.375 3.070 . 0 0 "[ . 1 . 2]" 2
240 1 65 ASP H 1 65 ASP HB3 2.640 . 3.480 2.579 2.382 2.823 . 0 0 "[ . 1 . 2]" 2
241 1 65 ASP H 1 65 ASP QB 2.545 . 3.290 2.307 2.249 2.609 . 0 0 "[ . 1 . 2]" 2
242 1 65 ASP HB2 1 66 GLY H 3.340 . 4.880 3.798 3.477 3.999 . 0 0 "[ . 1 . 2]" 2
243 1 65 ASP HB3 1 66 GLY H 3.340 . 4.880 2.579 1.998 2.858 . 0 0 "[ . 1 . 2]" 2
244 1 65 ASP QB 1 66 GLY H 2.940 . 4.080 2.536 1.986 2.797 . 0 0 "[ . 1 . 2]" 2
245 1 67 GLY HA2 1 68 ASN H 2.625 . 3.450 3.368 2.920 3.540 0.090 14 0 "[ . 1 . 2]" 2
246 1 67 GLY HA3 1 68 ASN H 2.625 . 3.450 3.093 2.819 3.500 0.050 1 0 "[ . 1 . 2]" 2
247 1 67 GLY QA 1 68 ASN H 2.510 . 3.220 2.824 2.714 2.923 . 0 0 "[ . 1 . 2]" 2
248 1 70 GLU H 1 70 GLU HB2 2.830 . 3.860 2.294 2.085 2.550 . 0 0 "[ . 1 . 2]" 2
249 1 70 GLU H 1 70 GLU HB3 2.830 . 3.860 3.109 2.568 3.613 . 0 0 "[ . 1 . 2]" 2
250 2 2 ARG HG2 2 4 LEU H 4.165 . 6.530 6.520 6.518 6.521 . 0 0 "[ . 1 . 2]" 2
251 2 3 GLU H 2 3 GLU QG 3.545 . 5.290 3.244 3.242 3.245 . 0 0 "[ . 1 . 2]" 2
252 2 3 GLU H 2 4 LEU H 2.815 . 3.830 3.903 3.901 3.905 0.075 5 0 "[ . 1 . 2]" 2
253 2 3 GLU HA 2 4 LEU HG 3.650 . 5.500 4.219 4.217 4.220 . 0 0 "[ . 1 . 2]" 2
254 2 3 GLU QG 2 4 LEU HA 3.670 . 5.540 5.851 5.850 5.852 0.312 16 0 "[ . 1 . 2]" 2
255 2 4 LEU H 2 4 LEU QB 2.840 . 3.880 2.567 2.565 2.569 . 0 0 "[ . 1 . 2]" 2
256 2 4 LEU H 2 4 LEU HG 3.000 . 4.200 3.212 3.211 3.214 . 0 0 "[ . 1 . 2]" 2
257 2 4 LEU H 2 4 LEU MD1 3.000 . 4.200 3.025 3.024 3.027 . 0 0 "[ . 1 . 2]" 2
258 2 4 LEU H 2 4 LEU MD2 3.480 . 5.160 4.414 4.413 4.415 . 0 0 "[ . 1 . 2]" 2
259 2 4 LEU H 2 5 ARG H 3.155 . 4.510 4.376 4.374 4.377 . 0 0 "[ . 1 . 2]" 2
260 2 4 LEU HA 2 4 LEU MD1 3.590 . 5.380 3.735 3.734 3.736 . 0 0 "[ . 1 . 2]" 2
261 2 4 LEU HA 2 4 LEU MD2 3.000 . 4.200 2.816 2.815 2.818 . 0 0 "[ . 1 . 2]" 2
262 2 4 LEU HA 2 31 GLN QB 3.200 . 4.600 4.033 3.873 4.198 . 0 0 "[ . 1 . 2]" 2
263 2 4 LEU HB2 2 5 ARG H 2.705 . 3.610 3.996 3.994 3.997 0.387 6 0 "[ . 1 . 2]" 2
264 2 4 LEU HB3 2 5 ARG H 2.705 . 3.610 2.948 2.946 2.948 . 0 0 "[ . 1 . 2]" 2
265 2 4 LEU MD1 2 5 ARG H 4.010 . 6.220 5.049 5.048 5.050 . 0 0 "[ . 1 . 2]" 2
266 2 4 LEU MD1 2 31 GLN QB 4.165 . 6.530 3.473 3.223 3.713 . 0 0 "[ . 1 . 2]" 2
267 2 4 LEU MD2 2 5 ARG H 3.545 . 5.290 3.706 3.705 3.708 . 0 0 "[ . 1 . 2]" 2
268 2 5 ARG H 2 5 ARG QG 2.990 . 4.180 2.418 2.416 2.419 . 0 0 "[ . 1 . 2]" 2
269 2 5 ARG H 2 6 CYS H 2.860 . 3.920 4.505 4.503 4.506 0.586 4 20 [***+********-*******] 2
270 2 5 ARG HA 2 5 ARG QD 4.090 . 6.380 2.266 2.264 2.267 . 0 0 "[ . 1 . 2]" 2
271 2 5 ARG QB 2 5 ARG HE 3.650 . 5.500 4.394 4.394 4.396 . 0 0 "[ . 1 . 2]" 2
272 2 5 ARG QB 2 6 CYS H 2.380 . 2.960 2.917 2.916 2.918 . 0 0 "[ . 1 . 2]" 2
273 2 5 ARG QG 2 6 CYS H 3.455 . 5.110 4.703 4.701 4.704 . 0 0 "[ . 1 . 2]" 2
274 2 5 ARG QD 2 6 CYS H 4.090 . 6.380 4.015 4.014 4.017 . 0 0 "[ . 1 . 2]" 2
275 2 6 CYS H 2 7 VAL H 3.650 . 5.500 4.654 4.652 4.655 . 0 0 "[ . 1 . 2]" 2
276 2 6 CYS CB 2 32 CYS SG 2.450 . 3.100 3.067 3.061 3.074 . 0 0 "[ . 1 . 2]" 2
277 2 6 CYS HB2 2 8 CYS H 2.520 . 3.240 3.623 3.622 3.625 0.385 15 0 "[ . 1 . 2]" 2
278 2 6 CYS SG 2 32 CYS CB 2.450 . 3.100 3.042 3.022 3.055 . 0 0 "[ . 1 . 2]" 2
279 2 6 CYS SG 2 32 CYS SG 1.950 . 2.100 2.031 2.026 2.034 . 0 0 "[ . 1 . 2]" 2
280 2 7 VAL H 2 7 VAL HB 2.550 . 3.300 2.536 2.535 2.538 . 0 0 "[ . 1 . 2]" 2
281 2 7 VAL H 2 7 VAL QG 3.190 . 4.580 2.224 2.222 2.226 . 0 0 "[ . 1 . 2]" 2
282 2 7 VAL HB 2 8 CYS H 3.015 . 4.230 4.034 4.033 4.035 . 0 0 "[ . 1 . 2]" 2
283 2 7 VAL QG 2 8 CYS H 3.590 . 5.380 2.481 2.479 2.482 . 0 0 "[ . 1 . 2]" 2
284 2 8 CYS H 2 9 LEU H 3.110 . 4.420 4.030 4.027 4.032 . 0 0 "[ . 1 . 2]" 2
285 2 8 CYS CB 2 48 CYS SG 2.450 . 3.100 3.047 3.045 3.047 . 0 0 "[ . 1 . 2]" 2
286 2 8 CYS SG 2 48 CYS CB 2.450 . 3.100 2.983 2.982 2.984 . 0 0 "[ . 1 . 2]" 2
287 2 8 CYS SG 2 48 CYS SG 1.950 . 2.100 2.035 2.034 2.037 . 0 0 "[ . 1 . 2]" 2
288 2 9 LEU H 2 9 LEU QB 2.725 . 3.650 2.401 2.400 2.403 . 0 0 "[ . 1 . 2]" 2
289 2 9 LEU H 2 9 LEU HG 2.410 . 3.020 2.564 2.562 2.566 . 0 0 "[ . 1 . 2]" 2
290 2 9 LEU H 2 9 LEU MD1 3.650 . 5.500 3.742 3.741 3.743 . 0 0 "[ . 1 . 2]" 2
291 2 9 LEU H 2 9 LEU MD2 3.805 . 5.810 3.576 3.574 3.577 . 0 0 "[ . 1 . 2]" 2
292 2 9 LEU HA 2 9 LEU HG 2.425 . 3.050 2.979 2.977 2.980 . 0 0 "[ . 1 . 2]" 2
293 2 9 LEU HA 2 9 LEU MD1 3.805 . 5.810 3.798 3.797 3.798 . 0 0 "[ . 1 . 2]" 2
294 2 9 LEU HA 2 9 LEU MD2 2.770 . 3.740 2.007 1.994 2.025 . 0 0 "[ . 1 . 2]" 2
295 2 9 LEU QB 2 10 GLN H 2.800 . 3.800 2.804 2.803 2.805 . 0 0 "[ . 1 . 2]" 2
296 2 9 LEU HG 2 10 GLN H 3.015 . 4.230 4.497 4.496 4.498 0.268 2 0 "[ . 1 . 2]" 2
297 2 10 GLN H 2 10 GLN HB2 2.580 . 3.360 3.750 3.749 3.752 0.392 13 0 "[ . 1 . 2]" 2
298 2 10 GLN H 2 10 GLN HB3 2.425 . 3.050 2.911 2.910 2.912 . 0 0 "[ . 1 . 2]" 2
299 2 10 GLN H 2 10 GLN QG 3.250 . 4.700 3.043 3.042 3.045 . 0 0 "[ . 1 . 2]" 2
300 2 10 GLN H 2 11 THR MG 3.730 . 5.660 5.759 5.758 5.761 0.101 13 0 "[ . 1 . 2]" 2
301 2 10 GLN HA 2 10 GLN HB2 2.410 . 3.020 2.402 2.400 2.404 . 0 0 "[ . 1 . 2]" 2
302 2 10 GLN HB2 2 11 THR H 2.845 . 3.890 2.093 2.092 2.095 . 0 0 "[ . 1 . 2]" 2
303 2 10 GLN HB3 2 11 THR H 2.595 . 3.390 3.581 3.579 3.582 0.192 16 0 "[ . 1 . 2]" 2
304 2 10 GLN QG 2 11 THR H 3.610 . 5.420 2.937 2.935 2.938 . 0 0 "[ . 1 . 2]" 2
305 2 11 THR H 2 11 THR MG 3.000 . 4.200 2.217 2.216 2.219 . 0 0 "[ . 1 . 2]" 2
306 2 11 THR HA 2 48 CYS H 3.015 . 4.230 4.626 4.624 4.627 0.397 8 0 "[ . 1 . 2]" 2
307 2 11 THR HA 2 48 CYS HA 3.015 . 4.230 5.135 5.134 5.136 0.906 17 20 [****-***********+***] 2
308 2 11 THR HA 2 48 CYS QB 3.060 . 3.980 2.932 2.931 2.933 . 0 0 "[ . 1 . 2]" 2
309 2 11 THR HB 2 48 CYS QB 3.000 . 4.200 4.768 4.766 4.769 0.569 12 20 [***********+*******-] 2
310 2 11 THR MG 2 48 CYS H 3.980 . 6.160 6.588 6.587 6.590 0.430 10 0 "[ . 1 . 2]" 2
311 2 11 THR MG 2 49 LEU H 3.775 . 5.750 6.905 6.904 6.905 1.155 18 20 [******-**********+**] 2
312 2 11 THR MG 2 50 ASP QB 4.055 . 6.310 3.305 3.262 3.370 . 0 0 "[ . 1 . 2]" 2
313 2 11 THR MG 2 51 PRO QD 4.165 . 6.530 6.324 6.214 6.419 . 0 0 "[ . 1 . 2]" 2
314 2 12 THR H 2 13 GLN H 3.125 . 4.450 4.239 4.238 4.240 . 0 0 "[ . 1 . 2]" 2
315 2 12 THR H 2 47 ILE HB 4.165 . 6.530 6.091 6.090 6.093 . 0 0 "[ . 1 . 2]" 2
316 2 12 THR H 2 48 CYS QB 3.650 . 5.500 4.687 4.685 4.688 . 0 0 "[ . 1 . 2]" 2
317 2 12 THR H 2 49 LEU H 3.280 . 4.760 5.366 5.365 5.368 0.608 15 20 [***********-**+*****] 2
318 2 12 THR H 2 49 LEU HA 2.350 . 2.900 2.958 2.956 2.959 0.059 2 0 "[ . 1 . 2]" 2
319 2 12 THR H 2 49 LEU MD1 4.150 . 6.500 6.018 6.017 6.019 . 0 0 "[ . 1 . 2]" 2
320 2 12 THR H 2 49 LEU MD2 3.360 . 4.920 3.798 3.797 3.799 . 0 0 "[ . 1 . 2]" 2
321 2 12 THR H 2 50 ASP H 2.935 . 4.070 3.355 3.306 3.390 . 0 0 "[ . 1 . 2]" 2
322 2 13 GLN H 2 13 GLN QG 3.145 . 4.490 3.135 3.133 3.137 . 0 0 "[ . 1 . 2]" 2
323 2 13 GLN H 2 49 LEU MD2 4.165 . 6.530 4.521 4.519 4.521 . 0 0 "[ . 1 . 2]" 2
324 2 13 GLN HA 2 13 GLN HE21 3.650 . 5.500 5.732 5.728 5.734 0.234 1 0 "[ . 1 . 2]" 2
325 2 13 GLN HA 2 49 LEU MD2 4.165 . 6.530 4.191 4.190 4.192 . 0 0 "[ . 1 . 2]" 2
326 2 13 GLN HA 2 50 ASP H 2.795 . 3.790 5.336 5.316 5.361 1.571 10 20 [*********+**-*******] 2
327 2 13 GLN HA 2 50 ASP QB 3.650 . 5.500 5.786 5.680 5.917 0.417 17 0 "[ . 1 . 2]" 2
328 2 13 GLN HA 2 53 ALA MB 3.920 . 6.040 4.878 4.397 5.238 . 0 0 "[ . 1 . 2]" 2
329 2 13 GLN QB 2 13 GLN HE22 3.650 . 5.500 4.442 4.442 4.443 . 0 0 "[ . 1 . 2]" 2
330 2 14 GLY H 2 15 VAL H 2.535 . 3.270 4.931 4.930 4.933 1.663 7 20 [***-**+*************] 2
331 2 14 GLY H 2 49 LEU MD2 3.620 . 5.440 3.178 3.177 3.179 . 0 0 "[ . 1 . 2]" 2
332 2 14 GLY HA2 2 15 VAL H 2.640 . 3.480 3.681 3.679 3.682 0.202 17 0 "[ . 1 . 2]" 2
333 2 14 GLY HA3 2 15 VAL H 2.640 . 3.480 3.714 3.712 3.716 0.236 13 0 "[ . 1 . 2]" 2
334 2 14 GLY QA 2 15 VAL H 2.515 . 3.230 3.294 3.293 3.295 0.065 11 0 "[ . 1 . 2]" 2
335 2 14 GLY QA 2 49 LEU MD2 3.810 . 5.820 3.863 3.862 3.864 . 0 0 "[ . 1 . 2]" 2
336 2 14 GLY QA 2 59 VAL QG 4.215 . 6.630 4.084 3.886 4.326 . 0 0 "[ . 1 . 2]" 2
337 2 15 VAL H 2 15 VAL HB 2.580 . 3.360 3.611 3.610 3.612 0.252 11 0 "[ . 1 . 2]" 2
338 2 15 VAL H 2 15 VAL MG2 3.265 . 4.730 4.126 4.125 4.127 . 0 0 "[ . 1 . 2]" 2
339 2 15 VAL H 2 15 VAL MG1 3.110 . 3.840 3.442 3.441 3.444 . 0 0 "[ . 1 . 2]" 2
340 2 15 VAL H 2 16 HIS H 3.245 . 4.690 4.302 4.301 4.305 . 0 0 "[ . 1 . 2]" 2
341 2 15 VAL HA 2 15 VAL HB 2.350 . 2.900 2.523 2.522 2.525 . 0 0 "[ . 1 . 2]" 2
342 2 15 VAL HA 2 15 VAL MG1 2.855 . 3.910 3.273 3.271 3.274 . 0 0 "[ . 1 . 2]" 2
343 2 15 VAL HB 2 16 HIS H 2.970 . 4.140 3.655 3.654 3.657 . 0 0 "[ . 1 . 2]" 2
344 2 15 VAL MG2 2 16 HIS H 3.155 . 4.510 1.607 1.593 1.624 0.207 20 0 "[ . 1 . 2]" 2
345 2 15 VAL MG1 2 16 HIS H 3.355 . 4.710 2.603 2.602 2.604 . 0 0 "[ . 1 . 2]" 2
346 2 16 HIS H 2 16 HIS HD2 3.650 . 5.500 5.352 5.349 5.355 . 0 0 "[ . 1 . 2]" 2
347 2 16 HIS QB 2 18 LYS H 2.890 . 3.980 2.944 2.942 2.945 . 0 0 "[ . 1 . 2]" 2
348 2 16 HIS QB 2 18 LYS QG 3.935 . 6.070 4.716 4.715 4.717 . 0 0 "[ . 1 . 2]" 2
349 2 16 HIS QB 2 19 MET H 3.650 . 5.500 3.731 3.723 3.780 . 0 0 "[ . 1 . 2]" 2
350 2 17 PRO HA 2 17 PRO QD 2.970 . 4.140 3.315 3.314 3.316 . 0 0 "[ . 1 . 2]" 2
351 2 17 PRO HA 2 20 ILE MD 2.925 . 4.050 4.032 3.802 4.375 0.325 8 0 "[ . 1 . 2]" 2
352 2 17 PRO QD 2 20 ILE H 3.635 . 5.470 5.567 5.519 6.201 0.731 4 1 "[ +. 1 . 2]" 2
353 2 17 PRO QD 2 63 ILE QG 3.545 . 5.290 4.162 3.617 4.455 . 0 0 "[ . 1 . 2]" 2
354 2 18 LYS H 2 18 LYS QG 3.330 . 4.860 3.639 3.638 3.641 . 0 0 "[ . 1 . 2]" 2
355 2 18 LYS HA 2 18 LYS QD 3.345 . 4.890 3.929 3.928 3.930 . 0 0 "[ . 1 . 2]" 2
356 2 18 LYS QB 2 19 MET H 3.005 . 4.210 2.814 2.806 2.860 . 0 0 "[ . 1 . 2]" 2
357 2 18 LYS QG 2 19 MET H 3.825 . 5.850 4.296 4.290 4.327 . 0 0 "[ . 1 . 2]" 2
358 2 19 MET H 2 20 ILE H 2.115 . 2.430 2.406 2.291 2.779 0.349 4 0 "[ . 1 . 2]" 2
359 2 19 MET H 2 20 ILE MD 3.495 . 5.190 4.406 4.243 4.520 . 0 0 "[ . 1 . 2]" 2
360 2 19 MET HA 2 41 LEU QD 4.165 . 6.530 3.895 3.648 4.289 . 0 0 "[ . 1 . 2]" 2
361 2 20 ILE H 2 20 ILE MG 3.015 . 4.230 3.820 3.780 3.905 . 0 0 "[ . 1 . 2]" 2
362 2 20 ILE H 2 20 ILE QG 2.755 . 3.710 2.188 2.050 2.872 . 0 0 "[ . 1 . 2]" 2
363 2 20 ILE H 2 20 ILE MD 2.755 . 3.710 3.227 3.101 3.798 0.088 4 0 "[ . 1 . 2]" 2
364 2 20 ILE H 2 21 SER H 3.200 . 4.600 4.578 4.465 4.626 0.026 11 0 "[ . 1 . 2]" 2
365 2 20 ILE H 2 41 LEU HA 3.280 . 4.760 4.957 4.546 5.567 0.807 6 3 "[ .+ 1 * . -2]" 2
366 2 20 ILE HA 2 41 LEU QD 4.165 . 4.760 3.792 3.452 4.206 . 0 0 "[ . 1 . 2]" 2
367 2 20 ILE MG 2 21 SER H 2.940 . 4.080 2.312 2.092 2.538 . 0 0 "[ . 1 . 2]" 2
368 2 20 ILE MG 2 21 SER HA 4.085 . 6.370 3.561 3.385 3.640 . 0 0 "[ . 1 . 2]" 2
369 2 20 ILE MG 2 22 ASN H 3.250 . 4.700 2.166 1.949 2.424 . 0 0 "[ . 1 . 2]" 2
370 2 20 ILE MG 2 22 ASN QB 4.600 . 7.400 4.102 3.804 4.253 . 0 0 "[ . 1 . 2]" 2
371 2 20 ILE QG 2 21 SER H 3.280 . 4.760 4.619 4.540 4.678 . 0 0 "[ . 1 . 2]" 2
372 2 20 ILE MD 2 59 VAL HA 3.995 . 6.190 7.347 6.711 8.050 1.860 14 20 [*************+*-****] 2
373 2 21 SER H 2 21 SER HG 3.420 . 5.040 3.405 3.291 3.634 . 0 0 "[ . 1 . 2]" 2
374 2 21 SER H 2 40 SER H 3.045 . 4.290 4.212 3.862 4.539 0.249 6 0 "[ . 1 . 2]" 2
375 2 21 SER HA 2 42 LYS QG 4.090 . 6.380 6.503 6.136 7.144 0.764 8 1 "[ . + 1 . 2]" 2
376 2 21 SER QB 2 41 LEU HA 2.735 . 3.670 4.129 3.310 4.833 1.163 8 9 "[*- ** + * .*** 2]" 2
377 2 21 SER HG 2 22 ASN H 3.640 . 5.480 4.621 4.500 4.793 . 0 0 "[ . 1 . 2]" 2
378 2 21 SER HG 2 22 ASN HA 4.090 . 6.380 6.418 6.369 6.484 0.104 11 0 "[ . 1 . 2]" 2
379 2 21 SER HG 2 42 LYS HA 3.330 . 4.860 4.861 4.025 5.533 0.673 8 2 "[ .- + 1 . 2]" 2
380 2 22 ASN H 2 39 ALA HA 3.185 . 4.570 4.937 4.613 5.221 0.651 7 3 "[ * .-+ 1 . 2]" 2
381 2 22 ASN H 2 39 ALA MB 3.900 . 6.000 4.060 3.779 4.452 . 0 0 "[ . 1 . 2]" 2
382 2 22 ASN QB 2 23 LEU HA 3.455 . 5.110 4.598 4.452 4.732 . 0 0 "[ . 1 . 2]" 2
383 2 23 LEU H 2 24 GLN H 3.060 . 4.320 4.317 4.001 4.493 0.173 8 0 "[ . 1 . 2]" 2
384 2 23 LEU HA 2 39 ALA MB 3.095 . 4.390 3.221 2.820 3.841 . 0 0 "[ . 1 . 2]" 2
385 2 24 GLN H 2 24 GLN QG 3.980 . 6.160 2.993 2.355 3.521 . 0 0 "[ . 1 . 2]" 2
386 2 24 GLN H 2 25 VAL H 3.030 . 4.260 4.209 3.913 4.423 0.163 14 0 "[ . 1 . 2]" 2
387 2 24 GLN H 2 38 VAL HB 3.495 . 5.190 5.545 5.128 6.194 1.004 8 5 "[ .- + 1* *. *2]" 2
388 2 24 GLN H 2 39 ALA MB 3.390 . 4.980 4.031 3.423 4.448 . 0 0 "[ . 1 . 2]" 2
389 2 24 GLN HA 2 24 GLN HG2 2.660 . 3.520 2.697 2.501 3.492 . 0 0 "[ . 1 . 2]" 2
390 2 24 GLN HA 2 24 GLN HG3 2.660 . 3.520 2.891 2.518 3.213 . 0 0 "[ . 1 . 2]" 2
391 2 24 GLN HA 2 24 GLN QG 2.570 . 3.340 2.451 2.340 2.633 . 0 0 "[ . 1 . 2]" 2
392 2 24 GLN HA 2 25 VAL QG 3.920 . 6.040 3.469 3.332 3.598 . 0 0 "[ . 1 . 2]" 2
393 2 24 GLN QB 2 25 VAL H 2.970 . 4.140 3.360 3.176 3.579 . 0 0 "[ . 1 . 2]" 2
394 2 24 GLN QB 2 38 VAL H 3.530 . 5.260 3.590 3.199 3.990 . 0 0 "[ . 1 . 2]" 2
395 2 24 GLN HG2 2 25 VAL H 3.200 . 4.600 4.533 4.182 5.259 0.659 9 1 "[ . +1 . 2]" 2
396 2 24 GLN HG3 2 25 VAL H 3.200 . 4.600 4.967 4.614 5.200 0.600 16 3 "[ . 1 -+ *]" 2
397 2 24 GLN QG 2 25 VAL H 3.045 . 4.290 4.188 3.954 4.450 0.160 16 0 "[ . 1 . 2]" 2
398 2 25 VAL H 2 25 VAL MG1 3.065 . 4.330 3.858 3.825 3.888 . 0 0 "[ . 1 . 2]" 2
399 2 25 VAL H 2 25 VAL MG2 3.065 . 4.330 2.328 2.173 2.509 . 0 0 "[ . 1 . 2]" 2
400 2 25 VAL H 2 25 VAL QG 2.710 . 3.620 2.310 2.161 2.479 . 0 0 "[ . 1 . 2]" 2
401 2 25 VAL H 2 26 PHE H 3.340 . 4.880 4.317 4.080 4.533 . 0 0 "[ . 1 . 2]" 2
402 2 25 VAL QG 2 26 PHE H 3.595 . 5.390 2.828 2.240 3.225 . 0 0 "[ . 1 . 2]" 2
403 2 25 VAL QG 2 26 PHE HA 4.945 . 8.090 3.864 3.681 4.057 . 0 0 "[ . 1 . 2]" 2
404 2 25 VAL QG 2 38 VAL H 4.370 . 6.940 4.377 4.002 5.029 . 0 0 "[ . 1 . 2]" 2
405 2 26 PHE H 2 26 PHE QB 2.380 . 2.730 2.389 2.221 2.591 . 0 0 "[ . 1 . 2]" 2
406 2 26 PHE H 2 26 PHE QD 3.640 . 5.480 2.970 2.352 3.698 . 0 0 "[ . 1 . 2]" 2
407 2 26 PHE H 2 35 VAL QG 3.265 . 4.730 4.994 4.445 5.479 0.749 4 3 "[ +. 1 . - *]" 2
408 2 26 PHE H 2 36 GLU QG 4.090 . 6.380 5.897 5.498 6.133 . 0 0 "[ . 1 . 2]" 2
409 2 26 PHE QD 2 27 ALA H 2.990 . 4.180 3.856 3.296 4.220 0.040 18 0 "[ . 1 . 2]" 2
410 2 27 ALA MB 2 28 ILE MD 3.240 . 4.680 4.063 2.494 4.410 . 0 0 "[ . 1 . 2]" 2
411 2 27 ALA MB 2 35 VAL QG 3.810 . 5.820 3.046 2.739 3.520 . 0 0 "[ . 1 . 2]" 2
412 2 28 ILE QG 2 29 GLY H 3.655 . 5.510 2.696 2.316 2.854 . 0 0 "[ . 1 . 2]" 2
413 2 28 ILE MD 2 29 GLY H 3.695 . 5.590 5.174 5.043 5.299 . 0 0 "[ . 1 . 2]" 2
414 2 28 ILE MD 2 35 VAL HA 3.050 . 4.300 5.866 4.460 6.810 2.510 12 19 "[***********+*** *-**]" 2
415 2 28 ILE MD 2 35 VAL QG 3.655 . 5.510 3.659 2.522 4.445 . 0 0 "[ . 1 . 2]" 2
416 2 29 GLY H 2 30 PRO HD2 3.510 . 5.220 5.022 4.905 5.263 0.043 12 0 "[ . 1 . 2]" 2
417 2 29 GLY H 2 30 PRO HD3 3.480 . 5.160 4.655 4.625 4.701 . 0 0 "[ . 1 . 2]" 2
418 2 29 GLY H 2 31 GLN H 2.640 . 3.480 4.162 3.940 4.511 1.031 12 19 "[-** *******+********]" 2
419 2 29 GLY H 2 32 CYS QB 3.575 . 5.350 3.508 2.990 3.931 . 0 0 "[ . 1 . 2]" 2
420 2 29 GLY H 2 33 SER QB 4.165 . 6.530 5.376 4.893 5.816 . 0 0 "[ . 1 . 2]" 2
421 2 29 GLY H 2 34 LYS H 3.075 . 4.350 4.908 3.873 6.374 2.024 12 8 "[ - * * 1 +*** *2]" 2
422 2 29 GLY QA 2 31 GLN H 3.005 . 4.210 3.055 2.997 3.079 . 0 0 "[ . 1 . 2]" 2
423 2 30 PRO HA 2 31 GLN H 2.455 . 3.110 3.391 3.380 3.410 0.300 5 0 "[ . 1 . 2]" 2
424 2 30 PRO HG2 2 31 GLN H 3.650 . 5.500 4.278 4.218 4.322 . 0 0 "[ . 1 . 2]" 2
425 2 30 PRO HG3 2 31 GLN H 3.650 . 5.500 4.622 4.575 4.652 . 0 0 "[ . 1 . 2]" 2
426 2 30 PRO HD2 2 31 GLN H 2.955 . 4.110 2.472 2.391 2.522 . 0 0 "[ . 1 . 2]" 2
427 2 30 PRO HD2 2 32 CYS H 3.155 . 4.510 4.290 4.237 4.331 . 0 0 "[ . 1 . 2]" 2
428 2 30 PRO HD3 2 31 GLN H 3.245 . 4.690 3.633 3.571 3.664 . 0 0 "[ . 1 . 2]" 2
429 2 30 PRO HD3 2 32 CYS H 3.650 . 5.500 5.046 5.003 5.080 . 0 0 "[ . 1 . 2]" 2
430 2 31 GLN QB 2 32 CYS H 2.955 . 4.110 3.683 3.667 3.692 . 0 0 "[ . 1 . 2]" 2
431 2 32 CYS QB 2 34 LYS H 3.590 . 5.380 3.434 2.932 4.569 . 0 0 "[ . 1 . 2]" 2
432 2 34 LYS H 2 34 LYS QG 2.850 . 3.900 4.086 3.978 4.241 0.341 8 0 "[ . 1 . 2]" 2
433 2 35 VAL QG 2 36 GLU H 2.770 . 3.740 3.465 3.376 3.580 . 0 0 "[ . 1 . 2]" 2
434 2 35 VAL QG 2 36 GLU HA 4.165 . 6.530 3.870 3.574 4.098 . 0 0 "[ . 1 . 2]" 2
435 2 35 VAL QG 2 37 VAL HA 4.165 . 6.530 5.709 5.403 5.960 . 0 0 "[ . 1 . 2]" 2
436 2 35 VAL QG 2 51 PRO QB 4.460 . 7.120 3.560 2.993 4.032 . 0 0 "[ . 1 . 2]" 2
437 2 35 VAL QG 2 51 PRO HG2 3.205 . 4.610 2.971 2.166 3.520 . 0 0 "[ . 1 . 2]" 2
438 2 36 GLU H 2 36 GLU HB2 2.920 . 4.040 2.820 2.693 2.911 . 0 0 "[ . 1 . 2]" 2
439 2 36 GLU H 2 36 GLU HB3 2.920 . 4.040 3.852 3.788 3.890 . 0 0 "[ . 1 . 2]" 2
440 2 36 GLU H 2 36 GLU QG 3.995 . 6.190 2.720 2.565 2.869 . 0 0 "[ . 1 . 2]" 2
441 2 36 GLU HA 2 36 GLU HB2 2.365 . 2.930 3.021 3.013 3.028 0.098 16 0 "[ . 1 . 2]" 2
442 2 36 GLU HA 2 36 GLU HB3 2.365 . 2.930 2.398 2.367 2.442 . 0 0 "[ . 1 . 2]" 2
443 2 36 GLU HA 2 36 GLU QB 2.240 . 2.680 2.310 2.286 2.345 . 0 0 "[ . 1 . 2]" 2
444 2 36 GLU HA 2 37 VAL MG2 3.870 . 5.940 3.422 3.345 3.578 . 0 0 "[ . 1 . 2]" 2
445 2 36 GLU HA 2 51 PRO HG3 3.400 . 5.000 3.443 2.717 3.974 . 0 0 "[ . 1 . 2]" 2
446 2 36 GLU HA 2 51 PRO QD 3.650 . 5.500 3.249 2.777 3.715 . 0 0 "[ . 1 . 2]" 2
447 2 36 GLU QG 2 37 VAL H 4.090 . 6.380 4.292 4.180 4.394 . 0 0 "[ . 1 . 2]" 2
448 2 37 VAL H 2 37 VAL MG1 3.265 . 4.730 3.029 2.925 3.142 . 0 0 "[ . 1 . 2]" 2
449 2 37 VAL H 2 37 VAL MG2 2.800 . 3.800 1.856 1.689 2.024 0.111 19 0 "[ . 1 . 2]" 2
450 2 37 VAL H 2 38 VAL MG1 3.855 . 5.910 4.330 4.229 4.412 . 0 0 "[ . 1 . 2]" 2
451 2 37 VAL H 2 51 PRO QD 3.650 . 5.500 3.123 2.731 3.543 . 0 0 "[ . 1 . 2]" 2
452 2 37 VAL HA 2 38 VAL MG1 4.090 . 6.380 3.506 3.412 3.800 . 0 0 "[ . 1 . 2]" 2
453 2 37 VAL HB 2 38 VAL H 3.245 . 4.690 3.656 3.482 3.710 . 0 0 "[ . 1 . 2]" 2
454 2 37 VAL HB 2 49 LEU H 2.535 . 3.270 5.127 4.727 5.638 2.368 3 20 [**+-****************] 2
455 2 37 VAL HB 2 49 LEU HA 3.650 . 5.500 6.982 6.460 7.387 1.887 3 20 [**+-****************] 2
456 2 37 VAL MG2 2 50 ASP H 4.165 . 6.530 4.700 4.202 5.056 . 0 0 "[ . 1 . 2]" 2
457 2 38 VAL H 2 38 VAL MG2 3.295 . 4.790 2.504 2.101 2.690 . 0 0 "[ . 1 . 2]" 2
458 2 38 VAL H 2 38 VAL MG1 3.090 . 3.980 2.109 1.968 2.440 . 0 0 "[ . 1 . 2]" 2
459 2 38 VAL H 2 39 ALA MB 4.165 . 6.530 5.092 5.012 5.125 . 0 0 "[ . 1 . 2]" 2
460 2 38 VAL H 2 49 LEU H 3.355 . 4.910 5.226 4.841 5.540 0.630 13 5 "[ * 1* +-* 2]" 2
461 2 38 VAL HA 2 38 VAL MG1 2.860 . 3.710 2.632 2.427 2.724 . 0 0 "[ . 1 . 2]" 2
462 2 38 VAL MG2 2 47 ILE H 3.310 . 4.820 5.245 4.938 5.646 0.826 9 8 "[* ** +* * . - *]" 2
463 2 38 VAL MG2 2 48 CYS HA 4.070 . 6.340 4.979 4.649 5.178 . 0 0 "[ . 1 . 2]" 2
464 2 38 VAL MG1 2 39 ALA H 3.650 . 5.500 4.072 3.836 4.145 . 0 0 "[ . 1 . 2]" 2
465 2 39 ALA H 2 46 GLU HA 3.385 . 4.970 4.542 4.285 4.929 . 0 0 "[ . 1 . 2]" 2
466 2 39 ALA H 2 47 ILE HB 3.465 . 5.130 5.631 5.398 5.956 0.826 6 11 "[* *+ -1***** **]" 2
467 2 39 ALA H 2 48 CYS H 3.540 . 5.280 5.304 4.979 5.583 0.303 6 0 "[ . 1 . 2]" 2
468 2 39 ALA H 2 49 LEU HG 3.260 . 4.720 4.147 3.655 4.741 0.021 6 0 "[ . 1 . 2]" 2
469 2 39 ALA H 2 49 LEU MD1 3.480 . 5.160 4.729 4.265 5.223 0.063 6 0 "[ . 1 . 2]" 2
470 2 39 ALA HA 2 40 SER HA 3.245 . 4.690 4.452 4.418 4.455 . 0 0 "[ . 1 . 2]" 2
471 2 39 ALA HA 2 47 ILE H 3.280 . 4.760 5.170 5.036 5.350 0.590 6 2 "[ .+ 1 . -]" 2
472 2 39 ALA MB 2 40 SER H 2.940 . 4.080 2.611 2.562 2.616 . 0 0 "[ . 1 . 2]" 2
473 2 39 ALA MB 2 47 ILE H 3.310 . 4.820 3.922 3.684 4.323 . 0 0 "[ . 1 . 2]" 2
474 2 39 ALA MB 2 48 CYS HA 4.165 . 6.530 5.006 4.618 5.213 . 0 0 "[ . 1 . 2]" 2
475 2 40 SER HA 2 46 GLU QG 4.025 . 6.250 5.111 4.912 5.293 . 0 0 "[ . 1 . 2]" 2
476 2 41 LEU H 2 41 LEU HG 2.970 . 4.140 3.703 3.338 3.973 . 0 0 "[ . 1 . 2]" 2
477 2 41 LEU H 2 46 GLU QB 3.215 . 4.630 4.755 4.406 4.942 0.312 8 0 "[ . 1 . 2]" 2
478 2 41 LEU H 2 46 GLU QG 4.090 . 6.380 5.929 5.639 6.127 . 0 0 "[ . 1 . 2]" 2
479 2 41 LEU H 2 47 ILE H 3.170 . 4.540 4.856 4.532 5.131 0.591 9 3 "[ .* +1 - . 2]" 2
480 2 41 LEU HA 2 41 LEU HG 2.690 . 3.580 2.378 2.331 2.410 . 0 0 "[ . 1 . 2]" 2
481 2 41 LEU HA 2 41 LEU QD . . 3.430 2.840 2.620 3.026 . 0 0 "[ . 1 . 2]" 2
482 2 41 LEU HA 2 42 LYS QG 4.090 . 6.380 6.046 6.014 6.076 . 0 0 "[ . 1 . 2]" 2
483 2 41 LEU HB2 2 43 ASN QD 3.650 . 5.500 4.176 3.001 4.627 . 0 0 "[ . 1 . 2]" 2
484 2 41 LEU HB3 2 43 ASN QD 3.650 . 5.500 3.513 2.278 3.811 . 0 0 "[ . 1 . 2]" 2
485 2 41 LEU QB 2 42 LYS H 3.065 . 4.330 2.224 2.089 2.391 . 0 0 "[ . 1 . 2]" 2
486 2 41 LEU QB 2 43 ASN H 2.880 . 3.960 2.217 2.133 2.368 . 0 0 "[ . 1 . 2]" 2
487 2 41 LEU QB 2 43 ASN QD 3.385 . 4.970 3.338 2.212 3.630 . 0 0 "[ . 1 . 2]" 2
488 2 41 LEU QB 2 45 LYS H 2.680 . 3.560 2.562 2.227 2.853 . 0 0 "[ . 1 . 2]" 2
489 2 41 LEU QB 2 46 GLU HA 4.090 . 6.380 5.126 4.865 5.296 . 0 0 "[ . 1 . 2]" 2
490 2 41 LEU QD 2 43 ASN QD 3.635 . 5.070 2.770 2.481 3.018 . 0 0 "[ . 1 . 2]" 2
491 2 41 LEU QD 2 47 ILE H 3.700 . 5.600 3.752 3.346 4.034 . 0 0 "[ . 1 . 2]" 2
492 2 41 LEU QD 2 43 ASN H 3.325 . 4.850 3.639 3.589 3.709 . 0 0 "[ . 1 . 2]" 2
493 2 42 LYS H 2 42 LYS QB 2.620 . 3.440 2.267 2.237 2.279 . 0 0 "[ . 1 . 2]" 2
494 2 42 LYS H 2 42 LYS QG 3.280 . 4.760 4.059 3.980 4.079 . 0 0 "[ . 1 . 2]" 2
495 2 42 LYS H 2 42 LYS QD 3.780 . 5.760 4.141 4.023 4.323 . 0 0 "[ . 1 . 2]" 2
496 2 42 LYS HA 2 42 LYS QG 2.880 . 3.960 2.874 2.751 3.035 . 0 0 "[ . 1 . 2]" 2
497 2 42 LYS HA 2 42 LYS QD 2.835 . 3.870 2.003 1.940 2.177 . 0 0 "[ . 1 . 2]" 2
498 2 42 LYS QG 2 43 ASN H 4.090 . 6.380 4.233 3.901 4.398 . 0 0 "[ . 1 . 2]" 2
499 2 42 LYS QD 2 43 ASN H 3.590 . 5.380 4.848 4.744 4.957 . 0 0 "[ . 1 . 2]" 2
500 2 43 ASN H 2 43 ASN HB2 2.565 . 3.330 2.476 2.436 2.510 . 0 0 "[ . 1 . 2]" 2
501 2 43 ASN H 2 43 ASN HB3 2.565 . 3.330 3.613 3.598 3.636 0.306 5 0 "[ . 1 . 2]" 2
502 2 43 ASN H 2 43 ASN QB 2.450 . 3.100 2.436 2.400 2.465 . 0 0 "[ . 1 . 2]" 2
503 2 43 ASN H 2 43 ASN QD 3.650 . 5.500 3.418 2.147 3.548 . 0 0 "[ . 1 . 2]" 2
504 2 43 ASN HA 2 43 ASN QD 3.480 . 5.160 4.060 3.677 4.102 . 0 0 "[ . 1 . 2]" 2
505 2 43 ASN HB2 2 43 ASN QD 2.470 . 3.140 2.196 2.190 2.206 . 0 0 "[ . 1 . 2]" 2
506 2 43 ASN HB3 2 43 ASN QD 2.470 . 3.140 2.862 2.829 3.269 0.129 4 0 "[ . 1 . 2]" 2
507 2 43 ASN QB 2 43 ASN QD 2.340 . 2.880 2.128 2.122 2.162 . 0 0 "[ . 1 . 2]" 2
508 2 43 ASN QD 2 45 LYS QB 3.310 . 4.510 4.511 4.340 4.779 0.269 17 0 "[ . 1 . 2]" 2
509 2 43 ASN QD 2 45 LYS QG 3.045 . 4.260 4.361 4.178 4.712 0.452 4 0 "[ . 1 . 2]" 2
510 2 44 GLY H 2 44 GLY HA2 2.285 . 2.770 2.406 2.335 2.492 . 0 0 "[ . 1 . 2]" 2
511 2 44 GLY H 2 44 GLY HA3 2.285 . 2.770 2.939 2.904 2.957 0.187 19 0 "[ . 1 . 2]" 2
512 2 44 GLY H 2 44 GLY QA 2.185 . 2.570 2.302 2.244 2.368 . 0 0 "[ . 1 . 2]" 2
513 2 45 LYS H 2 45 LYS QG 3.185 . 3.270 3.025 2.643 3.233 . 0 0 "[ . 1 . 2]" 2
514 2 45 LYS H 2 46 GLU H 3.230 . 4.660 4.456 4.196 4.549 . 0 0 "[ . 1 . 2]" 2
515 2 45 LYS HA 2 45 LYS QG 2.365 . 2.930 2.392 2.299 2.490 . 0 0 "[ . 1 . 2]" 2
516 2 45 LYS QB 2 46 GLU HA 3.650 . 5.500 4.051 3.936 4.385 . 0 0 "[ . 1 . 2]" 2
517 2 45 LYS QG 2 46 GLU H 3.215 . 4.630 3.809 3.655 4.160 . 0 0 "[ . 1 . 2]" 2
518 2 46 GLU H 2 46 GLU HA 2.335 . 2.870 2.942 2.919 2.953 0.083 3 0 "[ . 1 . 2]" 2
519 2 46 GLU H 2 46 GLU QB 2.335 . 2.870 3.041 2.833 3.221 0.351 17 0 "[ . 1 . 2]" 2
520 2 46 GLU H 2 46 GLU QG 3.020 . 4.240 2.159 1.792 2.313 0.008 16 0 "[ . 1 . 2]" 2
521 2 46 GLU HA 2 47 ILE HB 3.495 . 5.190 5.679 5.666 5.698 0.508 17 1 "[ . 1 . + 2]" 2
522 2 46 GLU QG 2 47 ILE H 3.375 . 4.950 4.091 4.013 4.356 . 0 0 "[ . 1 . 2]" 2
523 2 47 ILE HA 2 48 CYS H 2.440 . 3.080 2.543 2.541 2.544 . 0 0 "[ . 1 . 2]" 2
524 2 47 ILE HB 2 48 CYS H 2.955 . 4.110 2.061 2.059 2.064 . 0 0 "[ . 1 . 2]" 2
525 2 47 ILE HB 2 48 CYS HA 4.165 . 6.530 4.516 4.515 4.518 . 0 0 "[ . 1 . 2]" 2
526 2 48 CYS H 2 49 LEU HG 3.620 . 5.440 4.748 4.747 4.749 . 0 0 "[ . 1 . 2]" 2
527 2 48 CYS HA 2 49 LEU HA 3.295 . 4.790 4.383 4.381 4.384 . 0 0 "[ . 1 . 2]" 2
528 2 48 CYS HA 2 49 LEU QB 4.090 . 6.380 4.161 4.157 4.163 . 0 0 "[ . 1 . 2]" 2
529 2 48 CYS HA 2 49 LEU HG 3.370 . 4.940 3.596 3.594 3.597 . 0 0 "[ . 1 . 2]" 2
530 2 48 CYS HA 2 49 LEU MD1 4.165 . 6.530 4.997 4.996 4.998 . 0 0 "[ . 1 . 2]" 2
531 2 49 LEU H 2 49 LEU QB 2.725 . 3.650 2.392 2.387 2.394 . 0 0 "[ . 1 . 2]" 2
532 2 49 LEU H 2 49 LEU HG 2.485 . 3.170 2.830 2.828 2.831 . 0 0 "[ . 1 . 2]" 2
533 2 49 LEU H 2 49 LEU MD1 3.155 . 4.510 4.011 4.010 4.012 . 0 0 "[ . 1 . 2]" 2
534 2 49 LEU H 2 49 LEU MD2 3.250 . 4.700 3.501 3.499 3.501 . 0 0 "[ . 1 . 2]" 2
535 2 49 LEU HA 2 49 LEU HG 2.795 . 3.790 3.340 3.339 3.342 . 0 0 "[ . 1 . 2]" 2
536 2 49 LEU HA 2 49 LEU MD1 3.155 . 4.510 3.816 3.815 3.817 . 0 0 "[ . 1 . 2]" 2
537 2 49 LEU HA 2 49 LEU MD2 2.770 . 3.740 2.204 2.202 2.205 . 0 0 "[ . 1 . 2]" 2
538 2 49 LEU QB 2 50 ASP H 2.850 . 3.900 2.882 2.831 2.931 . 0 0 "[ . 1 . 2]" 2
539 2 49 LEU HG 2 50 ASP H 3.325 . 4.850 5.258 5.222 5.303 0.453 6 0 "[ . 1 . 2]" 2
540 2 49 LEU MD1 2 50 ASP H 4.165 . 6.530 4.683 4.635 4.731 . 0 0 "[ . 1 . 2]" 2
541 2 49 LEU MD2 2 50 ASP H 3.250 . 4.700 3.720 3.689 3.764 . 0 0 "[ . 1 . 2]" 2
542 2 49 LEU MD2 2 56 LEU HA 3.805 . 5.810 4.981 4.720 5.334 . 0 0 "[ . 1 . 2]" 2
543 2 50 ASP H 2 53 ALA MB 3.340 . 4.740 4.187 3.985 4.381 . 0 0 "[ . 1 . 2]" 2
544 2 50 ASP QB 2 53 ALA H 3.650 . 4.290 3.247 3.136 3.350 . 0 0 "[ . 1 . 2]" 2
545 2 50 ASP QB 2 53 ALA MB 3.030 . 3.580 3.091 2.938 3.307 . 0 0 "[ . 1 . 2]" 2
546 2 51 PRO HG2 2 52 GLU H 3.355 . 4.910 4.323 4.224 4.563 . 0 0 "[ . 1 . 2]" 2
547 2 51 PRO HG3 2 52 GLU H 3.650 . 5.500 4.655 4.581 4.773 . 0 0 "[ . 1 . 2]" 2
548 2 52 GLU H 2 53 ALA MB 3.125 . 4.170 4.258 4.025 4.334 0.164 6 0 "[ . 1 . 2]" 2
549 2 52 GLU QB 2 53 ALA H 3.080 . 4.360 3.166 3.141 3.271 . 0 0 "[ . 1 . 2]" 2
550 2 52 GLU QB 2 53 ALA HA 4.165 . 6.530 4.304 4.167 4.365 . 0 0 "[ . 1 . 2]" 2
551 2 53 ALA HA 2 54 PRO HD2 2.315 . 2.830 2.182 2.181 2.183 . 0 0 "[ . 1 . 2]" 2
552 2 53 ALA HA 2 54 PRO HD3 2.315 . 2.830 2.353 2.351 2.354 . 0 0 "[ . 1 . 2]" 2
553 2 53 ALA HA 2 54 PRO QD 2.185 . 2.570 2.010 2.009 2.011 . 0 0 "[ . 1 . 2]" 2
554 2 53 ALA HA 2 55 PHE H 3.245 . 4.690 4.264 4.263 4.266 . 0 0 "[ . 1 . 2]" 2
555 2 53 ALA MB 2 55 PHE H 3.235 . 4.670 3.232 3.224 3.242 . 0 0 "[ . 1 . 2]" 2
556 2 54 PRO HA 2 56 LEU H 3.075 . 4.350 4.000 3.962 4.052 . 0 0 "[ . 1 . 2]" 2
557 2 54 PRO HA 2 57 LYS QB 3.080 . 4.360 2.811 2.527 3.119 . 0 0 "[ . 1 . 2]" 2
558 2 54 PRO QD 2 55 PHE H 3.425 . 5.050 2.733 2.731 2.734 . 0 0 "[ . 1 . 2]" 2
559 2 55 PHE H 2 55 PHE HA 2.350 . 2.900 2.811 2.810 2.813 . 0 0 "[ . 1 . 2]" 2
560 2 55 PHE H 2 55 PHE QB 2.670 . 3.540 2.509 2.499 2.673 . 0 0 "[ . 1 . 2]" 2
561 2 55 PHE H 2 55 PHE QE 3.125 . 4.450 4.151 3.969 4.163 . 0 0 "[ . 1 . 2]" 2
562 2 55 PHE HA 2 56 LEU HA 3.245 . 4.690 4.733 4.659 4.804 0.114 10 0 "[ . 1 . 2]" 2
563 2 55 PHE HA 2 57 LYS H 2.845 . 3.890 4.160 3.979 4.376 0.486 17 0 "[ . 1 . 2]" 2
564 2 55 PHE QB 2 56 LEU H 3.175 . 4.550 3.581 3.547 3.600 . 0 0 "[ . 1 . 2]" 2
565 2 56 LEU H 2 57 LYS QD 3.545 . 5.290 6.566 6.423 6.725 1.435 16 20 [*************-*+****] 2
566 2 56 LEU HA 2 57 LYS HA 3.200 . 4.600 4.784 4.720 4.856 0.256 17 0 "[ . 1 . 2]" 2
567 2 56 LEU HA 2 58 LYS H 2.905 . 4.010 3.856 3.684 4.020 0.010 10 0 "[ . 1 . 2]" 2
568 2 57 LYS H 2 57 LYS QB 2.570 . 3.340 2.241 2.210 2.273 . 0 0 "[ . 1 . 2]" 2
569 2 57 LYS H 2 57 LYS QG 2.815 . 3.630 3.974 3.948 3.993 0.363 12 0 "[ . 1 . 2]" 2
570 2 57 LYS H 2 57 LYS QD 3.405 . 5.010 4.620 4.563 4.677 . 0 0 "[ . 1 . 2]" 2
571 2 57 LYS H 2 59 VAL H 3.420 . 5.040 4.627 4.554 4.692 . 0 0 "[ . 1 . 2]" 2
572 2 57 LYS HA 2 57 LYS QG 3.000 . 3.730 2.463 2.327 2.589 . 0 0 "[ . 1 . 2]" 2
573 2 57 LYS HA 2 57 LYS QD 2.875 . 3.950 4.104 3.909 4.245 0.295 14 0 "[ . 1 . 2]" 2
574 2 57 LYS HA 2 60 ILE H 2.845 . 3.890 3.708 3.609 3.799 . 0 0 "[ . 1 . 2]" 2
575 2 57 LYS HA 2 60 ILE MG 4.165 . 6.530 3.526 3.128 3.736 . 0 0 "[ . 1 . 2]" 2
576 2 57 LYS HA 2 60 ILE QG 4.090 . 6.380 1.909 1.844 1.983 . 0 0 "[ . 1 . 2]" 2
577 2 57 LYS HA 2 60 ILE MD 3.080 . 4.360 2.160 2.055 2.379 . 0 0 "[ . 1 . 2]" 2
578 2 57 LYS HA 2 61 GLN H 2.860 . 3.920 4.316 4.129 4.718 0.798 13 8 "[ ** .* 1 *+** -]" 2
579 2 58 LYS H 2 58 LYS QB 2.570 . 3.340 2.359 2.354 2.363 . 0 0 "[ . 1 . 2]" 2
580 2 58 LYS H 2 58 LYS HG2 2.610 . 3.420 3.516 3.460 3.559 0.139 2 0 "[ . 1 . 2]" 2
581 2 58 LYS H 2 58 LYS HG3 2.610 . 3.420 2.384 2.321 2.435 . 0 0 "[ . 1 . 2]" 2
582 2 58 LYS H 2 58 LYS QD 3.500 . 5.200 3.876 3.840 3.906 . 0 0 "[ . 1 . 2]" 2
583 2 58 LYS HA 2 58 LYS QG 2.820 . 3.840 2.332 2.331 2.333 . 0 0 "[ . 1 . 2]" 2
584 2 58 LYS HA 2 58 LYS QD 3.020 . 4.240 4.163 4.162 4.164 . 0 0 "[ . 1 . 2]" 2
585 2 58 LYS HA 2 61 GLN QB 2.755 . 3.710 2.739 2.505 3.043 . 0 0 "[ . 1 . 2]" 2
586 2 58 LYS HA 2 61 GLN QG 3.140 . 4.480 4.757 4.518 5.060 0.580 13 4 "[ ** .- 1 + . 2]" 2
587 2 58 LYS HG2 2 59 VAL H 3.650 . 5.500 4.822 4.794 4.839 . 0 0 "[ . 1 . 2]" 2
588 2 58 LYS HG3 2 59 VAL H 3.650 . 5.500 4.242 4.215 4.261 . 0 0 "[ . 1 . 2]" 2
589 2 58 LYS QG 2 59 VAL H 3.545 . 5.290 3.981 3.958 3.998 . 0 0 "[ . 1 . 2]" 2
590 2 59 VAL H 2 59 VAL HA 2.335 . 2.870 2.804 2.787 2.812 . 0 0 "[ . 1 . 2]" 2
591 2 59 VAL H 2 59 VAL QG 3.220 . 3.690 1.870 1.849 1.901 . 0 0 "[ . 1 . 2]" 2
592 2 59 VAL H 2 60 ILE QG 4.090 . 6.380 4.227 4.111 4.365 . 0 0 "[ . 1 . 2]" 2
593 2 59 VAL HA 2 59 VAL QG . . 2.720 2.283 2.233 2.329 . 0 0 "[ . 1 . 2]" 2
594 2 59 VAL HA 2 63 ILE H 3.015 . 4.230 4.666 4.239 4.963 0.733 19 6 "[ * - 1 **. *+2]" 2
595 2 59 VAL HA 2 63 ILE QG 4.090 . 6.380 4.158 3.914 4.445 . 0 0 "[ . 1 . 2]" 2
596 2 59 VAL HB 2 60 ILE H 2.640 . 3.480 3.982 3.857 4.034 0.554 9 12 "[** ** +*** -** *]" 2
597 2 59 VAL QG 2 60 ILE H 3.420 . 5.040 2.354 2.259 2.400 . 0 0 "[ . 1 . 2]" 2
598 2 59 VAL QG 2 63 ILE QG 3.625 . 5.450 3.895 3.617 4.162 . 0 0 "[ . 1 . 2]" 2
599 2 60 ILE H 2 60 ILE MG 3.015 . 4.230 2.343 2.217 2.448 . 0 0 "[ . 1 . 2]" 2
600 2 60 ILE H 2 60 ILE QG 2.660 . 3.520 2.201 2.129 2.345 . 0 0 "[ . 1 . 2]" 2
601 2 60 ILE H 2 60 ILE MD 3.030 . 4.260 3.826 3.781 3.960 . 0 0 "[ . 1 . 2]" 2
602 2 60 ILE H 2 61 GLN QG 3.650 . 5.500 6.055 5.967 6.175 0.675 7 18 "[***-**+ ******** ***]" 2
603 2 60 ILE HA 2 60 ILE MG 2.645 . 3.490 2.379 2.332 2.426 . 0 0 "[ . 1 . 2]" 2
604 2 60 ILE HA 2 60 ILE QG 2.240 . 2.680 3.323 3.316 3.329 0.649 1 20 [+**********-********] 2
605 2 60 ILE HA 2 60 ILE MD 3.080 . 4.360 4.175 4.148 4.184 . 0 0 "[ . 1 . 2]" 2
606 2 60 ILE HA 2 62 LYS H 2.985 . 4.170 4.357 4.150 4.427 0.257 7 0 "[ . 1 . 2]" 2
607 2 60 ILE HA 2 63 ILE QG 2.830 . 3.860 2.125 2.043 2.272 . 0 0 "[ . 1 . 2]" 2
608 2 60 ILE MG 2 61 GLN H 3.360 . 4.920 4.017 3.939 4.110 . 0 0 "[ . 1 . 2]" 2
609 2 60 ILE MG 2 61 GLN HA 3.185 . 4.570 5.510 5.497 5.534 0.964 13 20 [************+***-***] 2
610 2 60 ILE MG 2 61 GLN QG 3.825 . 5.850 6.598 6.548 6.668 0.818 13 20 [**-*********+*******] 2
611 2 60 ILE QG 2 61 GLN H 4.090 . 6.380 2.507 2.327 2.600 . 0 0 "[ . 1 . 2]" 2
612 2 60 ILE MD 2 61 GLN H 4.055 . 6.310 4.197 4.036 4.277 . 0 0 "[ . 1 . 2]" 2
613 2 61 GLN H 2 61 GLN QB 2.685 . 3.570 2.274 2.240 2.282 . 0 0 "[ . 1 . 2]" 2
614 2 61 GLN H 2 61 GLN QG 2.660 . 3.520 3.969 3.941 3.975 0.455 1 0 "[ . 1 . 2]" 2
615 2 61 GLN HA 2 61 GLN QG 2.225 . 2.650 2.357 2.256 2.447 . 0 0 "[ . 1 . 2]" 2
616 2 61 GLN HA 2 63 ILE H 3.260 . 4.720 4.212 4.100 4.303 . 0 0 "[ . 1 . 2]" 2
617 2 61 GLN HA 2 64 LEU QD 3.480 . 5.160 2.579 2.051 4.002 . 0 0 "[ . 1 . 2]" 2
618 2 61 GLN QG 2 62 LYS H 3.400 . 5.000 3.698 3.497 3.885 . 0 0 "[ . 1 . 2]" 2
619 2 61 GLN QG 2 64 LEU QD 3.870 . 5.940 3.612 2.807 4.815 . 0 0 "[ . 1 . 2]" 2
620 2 62 LYS H 2 62 LYS QB 2.785 . 3.770 2.339 2.187 2.444 . 0 0 "[ . 1 . 2]" 2
621 2 62 LYS H 2 62 LYS HG2 3.125 . 4.450 3.540 3.320 3.831 . 0 0 "[ . 1 . 2]" 2
622 2 62 LYS H 2 62 LYS HG3 3.125 . 4.450 2.444 2.230 2.838 . 0 0 "[ . 1 . 2]" 2
623 2 62 LYS H 2 62 LYS QG 2.780 . 3.760 2.402 2.202 2.766 . 0 0 "[ . 1 . 2]" 2
624 2 63 ILE H 2 63 ILE QG 2.815 . 3.830 1.854 1.760 1.922 0.040 18 0 "[ . 1 . 2]" 2
625 2 63 ILE HA 2 63 ILE QG 2.615 . 3.430 2.256 2.072 2.424 . 0 0 "[ . 1 . 2]" 2
626 2 64 LEU H 2 64 LEU HB2 2.505 . 3.210 2.457 2.238 2.599 . 0 0 "[ . 1 . 2]" 2
627 2 64 LEU H 2 64 LEU HB3 2.795 . 3.790 3.633 3.516 3.695 . 0 0 "[ . 1 . 2]" 2
628 2 64 LEU H 2 64 LEU HG 2.795 . 3.790 2.693 2.297 3.183 . 0 0 "[ . 1 . 2]" 2
629 2 64 LEU H 2 64 LEU QD 3.465 . 5.130 3.303 3.076 3.553 . 0 0 "[ . 1 . 2]" 2
630 2 64 LEU HA 2 64 LEU QD 3.310 . 4.820 2.097 1.987 2.214 . 0 0 "[ . 1 . 2]" 2
631 2 64 LEU QD 2 65 ASP H 4.165 . 6.530 4.177 3.861 4.396 . 0 0 "[ . 1 . 2]" 2
632 2 65 ASP H 2 65 ASP HB2 2.640 . 3.480 2.670 2.363 2.983 . 0 0 "[ . 1 . 2]" 2
633 2 65 ASP H 2 65 ASP HB3 2.640 . 3.480 2.541 2.375 2.789 . 0 0 "[ . 1 . 2]" 2
634 2 65 ASP H 2 65 ASP QB 2.545 . 3.290 2.299 2.242 2.382 . 0 0 "[ . 1 . 2]" 2
635 2 65 ASP HB2 2 66 GLY H 3.340 . 4.880 3.862 3.621 4.035 . 0 0 "[ . 1 . 2]" 2
636 2 65 ASP HB3 2 66 GLY H 3.340 . 4.880 2.654 2.322 3.055 . 0 0 "[ . 1 . 2]" 2
637 2 65 ASP QB 2 66 GLY H 2.940 . 4.080 2.607 2.301 2.968 . 0 0 "[ . 1 . 2]" 2
638 2 67 GLY HA2 2 68 ASN H 2.625 . 3.450 3.327 2.741 3.515 0.065 2 0 "[ . 1 . 2]" 2
639 2 67 GLY HA3 2 68 ASN H 2.625 . 3.450 3.143 2.910 3.541 0.091 3 0 "[ . 1 . 2]" 2
640 2 67 GLY QA 2 68 ASN H 2.510 . 3.220 2.833 2.653 2.927 . 0 0 "[ . 1 . 2]" 2
641 2 70 GLU H 2 70 GLU HB2 2.830 . 3.860 2.291 2.072 2.594 . 0 0 "[ . 1 . 2]" 2
642 2 70 GLU H 2 70 GLU HB3 2.830 . 3.860 3.082 2.425 3.621 . 0 0 "[ . 1 . 2]" 2
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