Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
563177 | 2lxt RC | 18695 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lxt
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 857
_Distance_constraint_stats_list.Viol_count 2367
_Distance_constraint_stats_list.Viol_total 10772.291
_Distance_constraint_stats_list.Viol_max 1.634
_Distance_constraint_stats_list.Viol_rms 0.1337
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0314
_Distance_constraint_stats_list.Viol_average_violations_only 0.2276
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 GLY 22.106 1.287 18 20 [*-***************+**]
1 2 VAL 23.730 1.287 18 20 [*-***************+**]
1 3 ARG 3.774 0.390 4 0 "[ . 1 . 2]"
1 4 LYS 19.849 1.453 7 7 "[ .-+* ** .* *2]"
1 5 GLY 4.987 1.372 11 2 "[ . 1+ . -2]"
1 6 TRP 9.326 1.453 7 5 "[ .-+* * .* 2]"
1 7 HIS 1.148 0.168 19 0 "[ . 1 . 2]"
1 8 GLU 1.253 0.257 20 0 "[ . 1 . 2]"
1 9 HIS 2.766 0.777 8 2 "[ - + 1 . 2]"
1 10 VAL 3.246 0.777 8 2 "[ - + 1 . 2]"
1 11 THR 0.012 0.008 6 0 "[ . 1 . 2]"
1 12 GLN 11.270 0.949 20 1 "[ . 1 . +]"
1 13 ASP 0.012 0.008 6 0 "[ . 1 . 2]"
1 14 LEU 5.536 0.801 15 5 "[ * - * 1 * + 2]"
1 15 ARG 1.194 1.116 2 1 "[ + . 1 . 2]"
1 16 SER 1.194 1.116 2 1 "[ + . 1 . 2]"
1 17 HIS 0.069 0.021 20 0 "[ . 1 . 2]"
1 18 LEU 11.723 0.626 5 18 "[****+****** *****-*]"
1 19 VAL 11.937 0.484 10 0 "[ . 1 . 2]"
1 20 HIS 1.155 0.137 5 0 "[ . 1 . 2]"
1 21 LYS 0.104 0.025 8 0 "[ . 1 . 2]"
1 22 LEU 8.548 0.245 13 0 "[ . 1 . 2]"
1 23 VAL 2.386 0.245 13 0 "[ . 1 . 2]"
1 24 GLN 13.395 0.625 15 8 "[- * **** 1 + *]"
1 25 ALA 0.031 0.020 9 0 "[ . 1 . 2]"
1 26 ILE 4.277 0.198 8 0 "[ . 1 . 2]"
1 27 PHE 12.582 1.354 17 4 "[* -. 1 . + *]"
1 28 PRO 0.880 0.053 17 0 "[ . 1 . 2]"
1 29 THR 0.034 0.019 20 0 "[ . 1 . 2]"
1 30 PRO 2.675 0.552 3 1 "[ + . 1 . 2]"
1 31 ASP 4.708 0.552 3 1 "[ + . 1 . 2]"
1 33 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 ALA 2.319 0.148 16 0 "[ . 1 . 2]"
1 35 LEU 2.368 0.148 16 0 "[ . 1 . 2]"
1 36 LYS 0.212 0.079 19 0 "[ . 1 . 2]"
1 37 ASP 0.154 0.127 19 0 "[ . 1 . 2]"
1 38 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ARG 33.212 1.306 10 19 "[*-*** ***+**********]"
1 40 MET 0.211 0.172 20 0 "[ . 1 . 2]"
1 41 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 LEU 3.589 0.187 20 0 "[ . 1 . 2]"
1 44 VAL 19.323 1.049 9 20 [********+***********]
1 45 ALA 4.130 1.049 9 1 "[ . +1 . 2]"
1 46 TYR 29.511 1.274 8 16 "[*******+*1* -** ***2]"
1 47 ALA 3.007 0.150 16 0 "[ . 1 . 2]"
1 48 LYS 1.217 0.144 15 0 "[ . 1 . 2]"
1 49 LYS 0.934 0.161 10 0 "[ . 1 . 2]"
1 50 VAL 2.301 0.221 19 0 "[ . 1 . 2]"
1 51 GLU 0.484 0.484 10 0 "[ . 1 . 2]"
1 52 GLY 0.786 0.161 10 0 "[ . 1 . 2]"
1 53 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 MET 26.244 1.176 10 18 "[*** .****+*********-]"
1 55 TYR 26.256 1.201 6 20 [****-+**************]
1 56 GLU 23.012 1.201 6 20 [****-+**************]
1 57 SER 0.235 0.153 9 0 "[ . 1 . 2]"
1 58 ALA 3.473 0.180 4 0 "[ . 1 . 2]"
1 59 ASN 1.073 0.464 15 0 "[ . 1 . 2]"
1 60 SER 4.256 0.464 15 0 "[ . 1 . 2]"
1 61 ARG 2.749 0.463 13 0 "[ . 1 . 2]"
1 62 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 GLU 0.648 0.094 18 0 "[ . 1 . 2]"
1 64 TYR 3.368 0.180 4 0 "[ . 1 . 2]"
1 65 TYR 20.796 1.634 7 16 "[** ***+ ******* *-*]"
1 66 HIS 0.727 0.055 16 0 "[ . 1 . 2]"
1 67 LEU 16.048 0.812 9 20 [-*******+***********]
1 68 LEU 36.172 1.176 10 18 "[*** .****+*********-]"
1 69 ALA 0.953 0.199 20 0 "[ . 1 . 2]"
1 70 GLU 2.766 0.411 20 0 "[ . 1 . 2]"
1 71 LYS 2.382 0.160 19 0 "[ . 1 . 2]"
1 72 ILE 22.054 0.738 6 1 "[ .+ 1 . 2]"
1 73 TYR 30.914 0.777 19 16 "[* *******- * *****+2]"
1 74 LYS 15.128 1.579 17 6 "[ - .*** 1 *. + 2]"
1 75 ILE 2.701 0.331 4 0 "[ . 1 . 2]"
1 76 GLN 0.184 0.097 10 0 "[ . 1 . 2]"
1 77 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 LEU 0.386 0.047 18 0 "[ . 1 . 2]"
1 80 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 GLU 0.828 0.098 19 0 "[ . 1 . 2]"
1 82 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 SER 0.789 0.789 1 1 "[+ . 1 . 2]"
1 86 ARG 1.156 0.789 1 1 "[+ . 1 . 2]"
1 87 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 1 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 2 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 3 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 4 ASN 2.232 0.616 11 1 "[ . 1+ . 2]"
2 5 ILE 16.574 1.579 17 6 "[ - .*** 1 *. + 2]"
2 6 LEU 30.918 1.274 8 16 "[*******+*1* -** ***2]"
2 8 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 9 ASP 0.395 0.285 8 0 "[ . 1 . 2]"
2 10 ILE 2.980 0.132 7 0 "[ . 1 . 2]"
2 11 MET 0.000 0.000 . 0 "[ . 1 . 2]"
2 12 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 13 PHE 11.527 1.306 10 11 "[*** * * +** *- * 2]"
2 14 VAL 38.131 1.354 17 20 [***-************+***]
2 15 LEU 9.179 0.557 11 4 "[ . -1+ . **2]"
2 16 LYS 11.583 1.032 17 11 "[ * **** * ***. + -]"
2 17 ASN 9.684 1.032 17 11 "[ * **** * ***. + -]"
2 18 THR 0.000 0.000 . 0 "[ . 1 . 2]"
3 2 SER 3.305 0.358 2 0 "[ . 1 . 2]"
3 3 VAL 0.043 0.026 14 0 "[ . 1 . 2]"
3 4 THR 1.613 0.143 14 0 "[ . 1 . 2]"
3 5 ASP 0.811 0.391 9 0 "[ . 1 . 2]"
3 6 SER 3.236 0.391 9 0 "[ . 1 . 2]"
3 7 GLN 2.529 0.246 13 0 "[ . 1 . 2]"
3 8 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
3 9 ARG 9.218 0.944 10 3 "[ .- + . * 2]"
3 10 ARG 0.040 0.031 19 0 "[ . 1 . 2]"
3 11 GLU 3.768 0.806 3 1 "[ + . 1 . 2]"
3 12 ILE 11.922 0.502 10 1 "[ . + . 2]"
3 13 LEU 33.613 0.944 10 18 "[*****-***+ * *******]"
3 14 SER 4.267 0.270 5 0 "[ . 1 . 2]"
3 15 ARG 0.959 0.167 14 0 "[ . 1 . 2]"
3 16 ARG 0.131 0.076 15 0 "[ . 1 . 2]"
3 19 TYR 1.565 0.203 20 0 "[ . 1 . 2]"
3 20 ARG 0.159 0.029 9 0 "[ . 1 . 2]"
3 21 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
3 22 ILE 3.769 0.738 6 1 "[ .+ 1 . 2]"
3 23 LEU 7.133 0.680 20 2 "[ . 1 . -+]"
3 24 ASN 1.650 0.320 20 0 "[ . 1 . 2]"
3 25 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
3 26 LEU 48.840 1.634 7 20 [***-**+*************]
3 27 SER 23.855 1.321 20 20 [*****************-*+]
3 28 SER 1.962 1.095 2 2 "[ + . 1 . - 2]"
3 29 ASP 2.531 1.095 2 2 "[ + . 1 . - 2]"
3 30 ALA 7.183 0.801 15 5 "[ * - * 1 * + 2]"
3 32 GLY 3.043 0.287 2 0 "[ . 1 . 2]"
3 33 VAL 6.016 0.337 15 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 GLY H1 1 1 GLY QA 2.228 . 2.661 2.250 2.184 2.459 . 0 0 "[ . 1 . 2]" 1
2 1 1 GLY H1 1 2 VAL H 2.614 2.119 3.109 2.765 2.274 3.056 . 0 0 "[ . 1 . 2]" 1
3 1 1 GLY QA 1 2 VAL H . 3.719 4.065 2.614 2.432 2.950 1.287 18 20 [*-***************+**] 1
4 1 2 VAL H 1 2 VAL HA 3.710 2.851 4.569 2.899 2.796 2.938 0.055 14 0 "[ . 1 . 2]" 1
5 1 2 VAL HA 1 3 ARG H 1.938 . 2.128 2.202 2.088 2.440 0.312 7 0 "[ . 1 . 2]" 1
6 1 3 ARG H 1 3 ARG HA 2.622 2.016 3.228 2.766 2.272 2.952 . 0 0 "[ . 1 . 2]" 1
7 1 3 ARG H 1 3 ARG QB 3.188 2.753 3.623 2.746 2.363 3.079 0.390 4 0 "[ . 1 . 2]" 1
8 1 3 ARG H 1 3 ARG QD 4.549 3.816 5.282 4.399 3.775 4.703 0.041 6 0 "[ . 1 . 2]" 1
9 1 3 ARG H 1 3 ARG QG 4.325 3.533 5.117 4.037 3.558 4.528 . 0 0 "[ . 1 . 2]" 1
10 1 4 LYS H 1 4 LYS QB 3.906 3.104 4.649 2.950 2.766 3.302 0.338 5 0 "[ . 1 . 2]" 1
11 1 4 LYS HA 1 4 LYS QB 3.306 2.561 4.051 2.332 2.168 2.500 0.393 11 0 "[ . 1 . 2]" 1
12 1 4 LYS HA 1 5 GLY H 2.232 . 2.699 2.317 2.130 2.595 . 0 0 "[ . 1 . 2]" 1
13 1 4 LYS HA 1 6 TRP HE1 3.400 2.960 3.840 3.314 2.804 3.898 0.156 9 0 "[ . 1 . 2]" 1
14 1 4 LYS QB 1 5 GLY H 4.523 3.818 5.228 3.693 2.446 4.037 1.372 11 2 "[ . 1+ . -2]" 1
15 1 4 LYS QB 1 6 TRP HE1 4.886 4.122 5.650 3.879 2.669 4.940 1.453 7 5 "[ .-+* * .* 2]" 1
16 1 5 GLY H 1 5 GLY QA 2.424 . 2.910 2.297 2.190 2.484 . 0 0 "[ . 1 . 2]" 1
17 1 5 GLY H 1 6 TRP H 2.710 2.104 3.316 2.521 2.216 2.950 . 0 0 "[ . 1 . 2]" 1
18 1 5 GLY H 1 7 HIS H 4.677 3.921 5.433 4.697 3.760 5.251 0.161 19 0 "[ . 1 . 2]" 1
19 1 5 GLY QA 1 6 TRP H 3.409 2.771 4.047 2.805 2.462 2.920 0.309 2 0 "[ . 1 . 2]" 1
20 1 6 TRP H 1 6 TRP HA 2.938 2.288 3.588 2.769 2.707 2.888 . 0 0 "[ . 1 . 2]" 1
21 1 6 TRP H 1 6 TRP QB 2.852 2.207 3.497 2.738 2.516 2.873 . 0 0 "[ . 1 . 2]" 1
22 1 6 TRP H 1 6 TRP HD1 2.880 2.212 3.548 2.858 2.312 3.330 . 0 0 "[ . 1 . 2]" 1
23 1 6 TRP H 1 6 TRP HE1 3.916 3.478 4.354 4.180 3.798 4.516 0.162 11 0 "[ . 1 . 2]" 1
24 1 6 TRP H 1 7 HIS H 2.641 2.018 3.264 2.832 2.293 3.103 . 0 0 "[ . 1 . 2]" 1
25 1 6 TRP HA 1 7 HIS H 3.917 3.209 4.625 3.523 3.367 3.585 . 0 0 "[ . 1 . 2]" 1
26 1 6 TRP HA 1 8 GLU H 3.442 3.001 3.883 3.723 3.262 4.140 0.257 20 0 "[ . 1 . 2]" 1
27 1 7 HIS H 1 7 HIS HA 2.929 2.278 3.580 2.829 2.789 2.908 . 0 0 "[ . 1 . 2]" 1
28 1 7 HIS H 1 8 GLU H 2.465 . 3.082 2.641 2.276 2.820 . 0 0 "[ . 1 . 2]" 1
29 1 7 HIS H 1 8 GLU HA 4.601 4.118 5.084 5.076 4.711 5.252 0.168 19 0 "[ . 1 . 2]" 1
30 1 7 HIS HA 1 10 VAL H 3.520 3.058 3.982 3.411 3.010 3.891 0.048 19 0 "[ . 1 . 2]" 1
31 1 7 HIS HA 1 10 VAL MG2 3.961 3.096 4.826 3.463 3.031 4.657 0.065 11 0 "[ . 1 . 2]" 1
32 1 8 GLU H 1 8 GLU HA 2.628 2.148 3.108 2.854 2.767 2.918 . 0 0 "[ . 1 . 2]" 1
33 1 8 GLU H 1 8 GLU QB 2.334 . 2.770 2.418 2.241 2.519 . 0 0 "[ . 1 . 2]" 1
34 1 8 GLU H 1 9 HIS H 2.607 . 3.231 2.527 2.265 2.873 . 0 0 "[ . 1 . 2]" 1
35 1 8 GLU HA 1 9 HIS H 3.365 2.954 3.776 3.468 3.372 3.554 . 0 0 "[ . 1 . 2]" 1
36 1 8 GLU HA 1 10 VAL H 3.667 2.957 4.377 3.782 3.389 4.172 . 0 0 "[ . 1 . 2]" 1
37 1 9 HIS H 1 9 HIS HA 3.112 2.450 3.774 2.909 2.871 2.941 . 0 0 "[ . 1 . 2]" 1
38 1 9 HIS H 1 9 HIS HB3 2.858 2.212 3.504 2.692 2.474 3.704 0.200 8 0 "[ . 1 . 2]" 1
39 1 9 HIS H 1 10 VAL MG2 3.776 3.297 4.255 3.702 3.340 4.063 . 0 0 "[ . 1 . 2]" 1
40 1 9 HIS HA 1 10 VAL H 3.220 2.556 3.884 3.324 3.174 3.418 . 0 0 "[ . 1 . 2]" 1
41 1 9 HIS HB2 1 10 VAL H 4.935 4.197 5.673 4.217 3.420 4.387 0.777 8 2 "[ - + 1 . 2]" 1
42 1 9 HIS HB3 1 10 VAL H 3.900 3.403 4.397 3.555 3.293 4.299 0.110 6 0 "[ . 1 . 2]" 1
43 1 9 HIS HB3 1 10 VAL MG2 3.243 2.528 3.958 3.302 2.696 4.492 0.534 5 1 "[ + 1 . 2]" 1
44 1 10 VAL H 1 10 VAL HA 2.920 2.262 3.578 2.931 2.862 2.950 . 0 0 "[ . 1 . 2]" 1
45 1 10 VAL H 1 10 VAL HB 2.554 2.058 3.050 2.581 2.310 3.071 0.021 20 0 "[ . 1 . 2]" 1
46 1 10 VAL H 1 10 VAL MG1 3.817 3.370 4.264 3.820 3.704 3.988 . 0 0 "[ . 1 . 2]" 1
47 1 10 VAL H 1 10 VAL MG2 2.601 2.107 3.095 2.678 2.486 3.026 . 0 0 "[ . 1 . 2]" 1
48 1 10 VAL HA 1 10 VAL MG1 2.837 2.392 3.282 2.438 2.338 2.593 0.054 20 0 "[ . 1 . 2]" 1
49 1 10 VAL HA 1 10 VAL MG2 2.827 2.389 3.265 2.394 2.316 2.515 0.073 6 0 "[ . 1 . 2]" 1
50 1 10 VAL HA 1 11 THR H 2.346 . 2.806 2.200 2.123 2.502 . 0 0 "[ . 1 . 2]" 1
51 1 10 VAL HB 1 10 VAL MG1 2.197 . 2.825 2.128 2.125 2.132 . 0 0 "[ . 1 . 2]" 1
52 1 10 VAL HB 1 10 VAL MG2 2.406 . 3.096 2.130 2.124 2.135 . 0 0 "[ . 1 . 2]" 1
53 1 10 VAL MG1 1 11 THR H 3.069 2.378 3.760 2.831 2.527 3.661 . 0 0 "[ . 1 . 2]" 1
54 1 10 VAL MG1 1 14 LEU MD2 2.500 . 4.000 2.092 1.859 4.066 0.066 20 0 "[ . 1 . 2]" 1
55 1 10 VAL MG2 1 14 LEU MD2 3.000 . 4.500 2.795 1.953 4.380 . 0 0 "[ . 1 . 2]" 1
56 1 10 VAL MG2 1 55 TYR QE 3.690 3.203 4.177 3.454 3.170 4.195 0.033 12 0 "[ . 1 . 2]" 1
57 1 11 THR H 1 11 THR MG 2.765 2.097 3.433 2.647 2.442 2.821 . 0 0 "[ . 1 . 2]" 1
58 1 11 THR H 1 12 GLN H 4.551 3.792 5.310 4.533 4.493 4.570 . 0 0 "[ . 1 . 2]" 1
59 1 11 THR H 1 14 LEU HB2 3.140 2.734 3.546 3.157 2.796 3.527 . 0 0 "[ . 1 . 2]" 1
60 1 11 THR H 1 14 LEU MD2 3.239 2.757 3.721 3.133 2.757 3.632 . 0 0 "[ . 1 . 2]" 1
61 1 11 THR HA 1 11 THR MG 2.446 . 3.061 2.333 2.249 2.374 . 0 0 "[ . 1 . 2]" 1
62 1 11 THR MG 1 12 GLN H 3.638 2.956 4.320 3.608 3.453 3.751 . 0 0 "[ . 1 . 2]" 1
63 1 11 THR MG 1 13 ASP H 3.950 3.537 4.363 4.193 3.870 4.371 0.008 6 0 "[ . 1 . 2]" 1
64 1 12 GLN H 1 12 GLN HA 2.928 2.259 3.597 2.819 2.792 2.841 . 0 0 "[ . 1 . 2]" 1
65 1 12 GLN H 1 12 GLN HB2 4.352 3.864 4.840 3.667 3.659 3.685 0.205 6 0 "[ . 1 . 2]" 1
66 1 12 GLN H 1 12 GLN HB3 2.336 . 2.804 2.584 2.523 2.637 . 0 0 "[ . 1 . 2]" 1
67 1 12 GLN H 1 12 GLN QG 3.842 3.162 4.522 3.131 2.213 3.277 0.949 20 1 "[ . 1 . +]" 1
68 1 12 GLN H 1 13 ASP H 2.636 . 3.281 2.660 2.541 2.794 . 0 0 "[ . 1 . 2]" 1
69 1 12 GLN HA 1 13 ASP H 3.714 3.249 4.179 3.510 3.469 3.530 . 0 0 "[ . 1 . 2]" 1
70 1 12 GLN HA 1 15 ARG H 3.838 3.025 4.651 3.463 3.220 3.716 . 0 0 "[ . 1 . 2]" 1
71 1 12 GLN HE21 1 12 GLN QG 2.981 2.379 3.583 2.314 2.122 2.776 0.257 11 0 "[ . 1 . 2]" 1
72 1 12 GLN HE22 1 12 GLN QG 4.114 3.439 4.789 3.297 3.208 3.479 0.231 9 0 "[ . 1 . 2]" 1
73 1 13 ASP H 1 13 ASP HA 2.579 . 3.188 2.795 2.777 2.818 . 0 0 "[ . 1 . 2]" 1
74 1 13 ASP H 1 13 ASP QB 2.143 . 2.592 2.229 2.207 2.248 . 0 0 "[ . 1 . 2]" 1
75 1 13 ASP H 1 14 LEU H 2.501 . 3.146 2.784 2.714 2.848 . 0 0 "[ . 1 . 2]" 1
76 1 13 ASP HA 1 14 LEU H 3.383 2.965 3.801 3.564 3.546 3.584 . 0 0 "[ . 1 . 2]" 1
77 1 13 ASP HA 1 16 SER H 3.503 3.035 3.971 3.471 3.148 3.856 . 0 0 "[ . 1 . 2]" 1
78 1 13 ASP QB 1 14 LEU H 2.693 2.044 3.342 2.443 2.342 2.593 . 0 0 "[ . 1 . 2]" 1
79 1 14 LEU H 1 14 LEU HA 2.789 2.124 3.454 2.792 2.778 2.815 . 0 0 "[ . 1 . 2]" 1
80 1 14 LEU H 1 14 LEU HB2 2.467 . 3.069 2.482 2.398 2.540 . 0 0 "[ . 1 . 2]" 1
81 1 14 LEU H 1 14 LEU HB3 2.667 2.033 3.301 2.589 2.527 2.664 . 0 0 "[ . 1 . 2]" 1
82 1 14 LEU H 1 14 LEU MD1 4.351 3.617 5.085 4.058 3.982 4.111 . 0 0 "[ . 1 . 2]" 1
83 1 14 LEU H 1 14 LEU MD2 3.910 3.223 4.597 4.286 4.254 4.318 . 0 0 "[ . 1 . 2]" 1
84 1 14 LEU HA 1 14 LEU MD1 2.519 . 3.199 2.117 2.084 2.144 . 0 0 "[ . 1 . 2]" 1
85 1 14 LEU HA 1 14 LEU MD2 4.228 3.466 4.990 3.895 3.873 3.918 . 0 0 "[ . 1 . 2]" 1
86 1 14 LEU HB3 1 14 LEU MD1 3.435 2.995 3.875 3.210 3.200 3.216 . 0 0 "[ . 1 . 2]" 1
87 1 14 LEU HB3 1 14 LEU MD2 2.832 2.373 3.291 2.330 2.300 2.359 0.073 20 0 "[ . 1 . 2]" 1
88 1 14 LEU HB3 3 30 ALA MB 4.510 3.664 5.356 5.541 4.980 6.157 0.801 15 5 "[ * - * 1 * + 2]" 1
89 1 14 LEU MD1 1 14 LEU HG 2.706 . 3.427 2.129 2.126 2.132 . 0 0 "[ . 1 . 2]" 1
90 1 14 LEU MD1 1 15 ARG H 4.162 3.686 4.638 4.521 4.390 4.620 . 0 0 "[ . 1 . 2]" 1
91 1 14 LEU MD1 1 17 HIS HB2 3.330 2.619 4.041 3.414 3.053 3.797 . 0 0 "[ . 1 . 2]" 1
92 1 14 LEU MD2 1 18 LEU QD 3.418 2.635 4.201 3.500 3.053 3.807 . 0 0 "[ . 1 . 2]" 1
93 1 14 LEU MD2 1 64 TYR QE 3.127 2.383 3.871 3.642 3.297 3.746 . 0 0 "[ . 1 . 2]" 1
94 1 14 LEU HG 1 18 LEU QD 3.476 2.671 4.281 3.084 2.736 3.416 . 0 0 "[ . 1 . 2]" 1
95 1 14 LEU HG 1 64 TYR QE 4.682 3.966 5.398 4.334 4.121 5.230 . 0 0 "[ . 1 . 2]" 1
96 1 15 ARG H 1 16 SER H 2.822 2.127 3.517 2.677 2.613 2.753 . 0 0 "[ . 1 . 2]" 1
97 1 15 ARG QB 1 16 SER H 2.782 2.374 3.190 2.501 2.338 3.144 0.036 9 0 "[ . 1 . 2]" 1
98 1 15 ARG QG 1 16 SER H 3.776 3.356 4.196 3.801 2.240 4.032 1.116 2 1 "[ + . 1 . 2]" 1
99 1 16 SER H 1 16 SER HA 2.712 2.108 3.316 2.786 2.777 2.807 . 0 0 "[ . 1 . 2]" 1
100 1 16 SER H 1 17 HIS H 2.414 . 2.889 2.728 2.702 2.757 . 0 0 "[ . 1 . 2]" 1
101 1 16 SER QB 1 17 HIS H 2.566 . 3.192 2.593 2.490 2.690 . 0 0 "[ . 1 . 2]" 1
102 1 17 HIS H 1 17 HIS HA 2.913 2.263 3.563 2.837 2.827 2.852 . 0 0 "[ . 1 . 2]" 1
103 1 17 HIS H 1 17 HIS HB2 2.366 . 2.851 2.349 2.239 2.432 . 0 0 "[ . 1 . 2]" 1
104 1 17 HIS H 1 18 LEU QB 4.544 3.811 5.277 4.488 4.411 4.552 . 0 0 "[ . 1 . 2]" 1
105 1 17 HIS HB3 1 18 LEU H 3.861 3.420 4.302 3.511 3.399 3.624 0.021 20 0 "[ . 1 . 2]" 1
106 1 18 LEU H 1 18 LEU HA 2.911 2.510 3.312 2.840 2.831 2.849 . 0 0 "[ . 1 . 2]" 1
107 1 18 LEU H 1 18 LEU QB 2.586 . 3.268 2.306 2.246 2.342 . 0 0 "[ . 1 . 2]" 1
108 1 18 LEU H 1 18 LEU QD 4.049 3.894 4.774 3.328 3.268 3.433 0.626 5 18 "[****+****** *****-*]" 1
109 1 18 LEU H 1 18 LEU HG 3.494 2.701 4.287 2.803 2.751 2.925 . 0 0 "[ . 1 . 2]" 1
110 1 18 LEU HA 1 18 LEU QD 2.418 . 3.111 1.975 1.952 2.032 . 0 0 "[ . 1 . 2]" 1
111 1 18 LEU HA 1 19 VAL H 3.232 2.821 3.643 3.544 3.526 3.558 . 0 0 "[ . 1 . 2]" 1
112 1 18 LEU QD 1 68 LEU QD 1.997 . 2.490 1.848 1.670 2.035 0.130 12 0 "[ . 1 . 2]" 1
113 1 19 VAL H 1 19 VAL HA 2.806 2.131 3.481 2.819 2.796 2.840 . 0 0 "[ . 1 . 2]" 1
114 1 19 VAL H 1 19 VAL HB 3.914 3.126 4.702 3.021 2.988 3.065 0.138 13 0 "[ . 1 . 2]" 1
115 1 19 VAL H 1 19 VAL MG1 3.420 2.758 4.082 3.796 3.746 3.830 . 0 0 "[ . 1 . 2]" 1
116 1 19 VAL H 1 19 VAL MG2 2.324 . 2.931 1.936 1.919 1.949 . 0 0 "[ . 1 . 2]" 1
117 1 19 VAL H 1 20 HIS H 2.683 2.023 3.343 2.736 2.654 2.811 . 0 0 "[ . 1 . 2]" 1
118 1 19 VAL HA 1 19 VAL MG1 2.926 2.485 3.367 2.295 2.259 2.324 0.226 5 0 "[ . 1 . 2]" 1
119 1 19 VAL HA 1 19 VAL MG2 3.151 2.471 3.831 2.661 2.625 2.709 . 0 0 "[ . 1 . 2]" 1
120 1 19 VAL HA 1 22 LEU H 3.366 2.875 3.857 3.243 3.050 3.477 . 0 0 "[ . 1 . 2]" 1
121 1 19 VAL HA 1 22 LEU MD1 3.560 2.756 4.364 2.601 2.565 2.710 0.191 11 0 "[ . 1 . 2]" 1
122 1 19 VAL HB 1 19 VAL MG1 2.363 . 3.050 2.103 2.096 2.109 . 0 0 "[ . 1 . 2]" 1
123 1 19 VAL HB 1 19 VAL MG2 2.174 . 2.810 2.130 2.126 2.135 . 0 0 "[ . 1 . 2]" 1
124 1 19 VAL HB 1 22 LEU MD1 4.242 3.468 5.016 5.001 4.901 5.045 0.029 18 0 "[ . 1 . 2]" 1
125 1 19 VAL MG1 1 20 HIS H 3.367 2.946 3.788 3.846 3.785 3.925 0.137 5 0 "[ . 1 . 2]" 1
126 1 19 VAL MG1 1 47 ALA MB 3.000 . 4.500 2.058 1.933 2.230 . 0 0 "[ . 1 . 2]" 1
127 1 19 VAL MG1 1 48 LYS HA 2.991 2.513 3.469 2.464 2.369 2.680 0.144 15 0 "[ . 1 . 2]" 1
128 1 19 VAL MG1 1 51 GLU HB3 2.827 2.166 3.488 3.291 3.122 3.972 0.484 10 0 "[ . 1 . 2]" 1
129 1 19 VAL MG2 1 20 HIS H 3.574 3.150 3.998 3.447 3.304 3.588 . 0 0 "[ . 1 . 2]" 1
130 1 19 VAL MG2 1 22 LEU MD1 4.000 2.500 5.500 3.744 3.601 3.917 . 0 0 "[ . 1 . 2]" 1
131 1 20 HIS H 1 20 HIS HA 2.979 2.313 3.645 2.801 2.786 2.816 . 0 0 "[ . 1 . 2]" 1
132 1 20 HIS H 1 21 LYS H 2.783 2.103 3.463 2.726 2.656 2.829 . 0 0 "[ . 1 . 2]" 1
133 1 20 HIS HA 1 21 LYS H 3.462 3.033 3.891 3.540 3.511 3.575 . 0 0 "[ . 1 . 2]" 1
134 1 20 HIS HA 1 23 VAL H 3.506 3.009 4.003 3.463 3.349 3.609 . 0 0 "[ . 1 . 2]" 1
135 1 20 HIS HA 1 23 VAL MG2 3.504 2.758 4.250 3.090 2.920 3.328 . 0 0 "[ . 1 . 2]" 1
136 1 20 HIS HA 1 24 GLN H 4.001 3.226 4.776 4.150 3.878 4.474 . 0 0 "[ . 1 . 2]" 1
137 1 21 LYS H 1 21 LYS HA 2.515 . 3.121 2.805 2.780 2.822 . 0 0 "[ . 1 . 2]" 1
138 1 21 LYS H 1 21 LYS QB 2.600 . 3.224 2.380 2.292 2.460 . 0 0 "[ . 1 . 2]" 1
139 1 21 LYS H 1 22 LEU H 3.151 2.666 3.636 2.688 2.641 2.757 0.025 8 0 "[ . 1 . 2]" 1
140 1 21 LYS HA 1 24 GLN H 3.108 2.443 3.773 3.175 3.049 3.494 . 0 0 "[ . 1 . 2]" 1
141 1 22 LEU H 1 22 LEU HA 3.018 2.614 3.422 2.798 2.781 2.818 . 0 0 "[ . 1 . 2]" 1
142 1 22 LEU H 1 22 LEU HB2 2.416 . 3.076 2.117 2.063 2.271 . 0 0 "[ . 1 . 2]" 1
143 1 22 LEU H 1 22 LEU HB3 3.553 2.905 4.201 3.363 3.155 3.548 . 0 0 "[ . 1 . 2]" 1
144 1 22 LEU H 1 22 LEU MD1 4.204 3.503 4.905 3.606 3.517 3.812 . 0 0 "[ . 1 . 2]" 1
145 1 22 LEU H 1 22 LEU MD2 4.380 3.670 5.090 4.389 4.161 4.433 . 0 0 "[ . 1 . 2]" 1
146 1 22 LEU H 1 23 VAL H 2.851 2.164 3.538 2.766 2.657 2.856 . 0 0 "[ . 1 . 2]" 1
147 1 22 LEU H 1 23 VAL MG2 3.992 3.513 4.471 4.291 4.117 4.383 . 0 0 "[ . 1 . 2]" 1
148 1 22 LEU HA 1 22 LEU MD1 4.024 3.573 4.475 3.722 3.652 3.872 . 0 0 "[ . 1 . 2]" 1
149 1 22 LEU HA 1 22 LEU MD2 3.283 2.587 3.979 2.697 2.574 2.815 0.013 10 0 "[ . 1 . 2]" 1
150 1 22 LEU HA 1 23 VAL H 3.539 3.082 3.996 3.565 3.546 3.590 . 0 0 "[ . 1 . 2]" 1
151 1 22 LEU HA 1 25 ALA MB 2.745 2.321 3.169 2.912 2.600 3.180 0.011 7 0 "[ . 1 . 2]" 1
152 1 22 LEU HA 1 72 ILE MG 3.092 2.612 3.572 3.128 2.577 3.614 0.042 10 0 "[ . 1 . 2]" 1
153 1 22 LEU HB3 1 22 LEU MD1 3.176 2.755 3.597 2.640 2.598 2.660 0.157 10 0 "[ . 1 . 2]" 1
154 1 22 LEU HB3 1 22 LEU MD2 2.521 2.081 2.961 2.180 2.099 2.211 . 0 0 "[ . 1 . 2]" 1
155 1 22 LEU HB3 1 23 VAL H 3.337 2.925 3.749 2.840 2.680 3.005 0.245 13 0 "[ . 1 . 2]" 1
156 1 22 LEU MD1 1 22 LEU HG 2.341 . 2.750 2.129 2.091 2.134 . 0 0 "[ . 1 . 2]" 1
157 1 22 LEU MD1 1 23 VAL H 4.665 3.851 5.479 4.582 4.260 4.714 . 0 0 "[ . 1 . 2]" 1
158 1 22 LEU MD1 1 47 ALA HA 2.905 2.458 3.352 3.066 2.646 3.315 . 0 0 "[ . 1 . 2]" 1
159 1 22 LEU MD1 1 47 ALA MB 2.436 . 3.301 2.828 2.022 3.107 . 0 0 "[ . 1 . 2]" 1
160 1 22 LEU MD1 1 68 LEU QD 4.000 . 5.500 2.194 1.845 3.645 . 0 0 "[ . 1 . 2]" 1
161 1 22 LEU MD2 1 22 LEU HG 2.236 . 2.906 2.135 2.109 2.140 . 0 0 "[ . 1 . 2]" 1
162 1 22 LEU MD2 1 46 TYR QD 3.678 3.225 4.131 3.886 3.280 4.297 0.166 2 0 "[ . 1 . 2]" 1
163 1 22 LEU MD2 1 47 ALA HA 2.864 2.420 3.308 2.851 2.653 3.367 0.059 10 0 "[ . 1 . 2]" 1
164 1 22 LEU MD2 1 47 ALA MB 4.000 . 5.500 3.133 2.801 3.372 . 0 0 "[ . 1 . 2]" 1
165 1 22 LEU MD2 1 50 VAL MG1 3.000 . 4.500 2.600 2.095 3.458 . 0 0 "[ . 1 . 2]" 1
166 1 22 LEU MD2 1 50 VAL MG2 4.000 . 5.500 3.331 2.831 4.142 . 0 0 "[ . 1 . 2]" 1
167 1 22 LEU MD2 1 68 LEU QD 3.000 . 4.500 3.243 2.677 4.236 . 0 0 "[ . 1 . 2]" 1
168 1 22 LEU MD2 1 72 ILE MD 4.000 . 5.500 5.285 4.664 5.618 0.118 10 0 "[ . 1 . 2]" 1
169 1 23 VAL H 1 23 VAL HA 2.918 2.226 3.610 2.803 2.754 2.826 . 0 0 "[ . 1 . 2]" 1
170 1 23 VAL H 1 23 VAL HB 2.504 . 3.139 2.493 2.438 2.562 . 0 0 "[ . 1 . 2]" 1
171 1 23 VAL H 1 23 VAL MG2 2.312 . 2.811 2.113 1.976 2.216 . 0 0 "[ . 1 . 2]" 1
172 1 23 VAL H 1 47 ALA MB 2.829 2.144 3.514 3.341 3.236 3.487 . 0 0 "[ . 1 . 2]" 1
173 1 23 VAL HA 1 23 VAL MG1 2.679 2.279 3.079 2.436 2.373 2.480 . 0 0 "[ . 1 . 2]" 1
174 1 23 VAL HA 1 24 GLN H 3.582 2.874 4.290 3.546 3.533 3.565 . 0 0 "[ . 1 . 2]" 1
175 1 23 VAL HA 1 26 ILE H 3.226 2.772 3.680 3.514 3.343 3.659 . 0 0 "[ . 1 . 2]" 1
176 1 23 VAL HB 1 23 VAL MG1 2.620 . 3.337 2.127 2.126 2.129 . 0 0 "[ . 1 . 2]" 1
177 1 23 VAL HB 1 23 VAL MG2 2.625 . 3.328 2.129 2.123 2.132 . 0 0 "[ . 1 . 2]" 1
178 1 23 VAL MG1 1 24 GLN H 3.080 2.402 3.758 3.263 3.154 3.406 . 0 0 "[ . 1 . 2]" 1
179 1 23 VAL MG1 1 40 MET ME 3.000 . 4.500 2.492 2.004 4.539 0.039 20 0 "[ . 1 . 2]" 1
180 1 23 VAL MG1 1 43 LEU MD2 3.000 . 4.500 2.354 1.893 3.207 . 0 0 "[ . 1 . 2]" 1
181 1 23 VAL MG2 1 43 LEU MD2 4.000 . 5.500 3.457 2.122 4.199 . 0 0 "[ . 1 . 2]" 1
182 1 23 VAL MG2 1 44 VAL HA 2.928 2.457 3.399 2.517 2.244 3.059 0.213 13 0 "[ . 1 . 2]" 1
183 1 23 VAL MG2 1 44 VAL QG 2.500 . 4.000 2.261 1.828 2.850 . 0 0 "[ . 1 . 2]" 1
184 1 23 VAL MG2 1 47 ALA MB 2.500 . 4.000 2.282 2.176 2.605 . 0 0 "[ . 1 . 2]" 1
185 1 24 GLN H 1 24 GLN HA 2.820 2.185 3.455 2.794 2.784 2.807 . 0 0 "[ . 1 . 2]" 1
186 1 24 GLN H 1 24 GLN HB2 2.237 . 2.724 2.481 2.448 2.509 . 0 0 "[ . 1 . 2]" 1
187 1 24 GLN H 1 24 GLN HB3 4.264 3.796 4.732 3.644 3.635 3.654 0.161 17 0 "[ . 1 . 2]" 1
188 1 24 GLN H 1 24 GLN QG 2.481 . 3.083 2.325 2.271 2.401 . 0 0 "[ . 1 . 2]" 1
189 1 24 GLN H 1 25 ALA H 2.726 2.080 3.372 2.710 2.668 2.739 . 0 0 "[ . 1 . 2]" 1
190 1 24 GLN H 1 25 ALA MB 4.224 3.522 4.926 4.359 4.323 4.399 . 0 0 "[ . 1 . 2]" 1
191 1 24 GLN HA 1 24 GLN HB3 3.283 2.801 3.765 2.575 2.558 2.593 0.243 14 0 "[ . 1 . 2]" 1
192 1 24 GLN HA 1 24 GLN QG 3.417 2.981 3.853 2.689 2.356 2.966 0.625 15 8 "[- * **** 1 + *]" 1
193 1 24 GLN HA 1 25 ALA H 3.079 2.434 3.724 3.486 3.470 3.502 . 0 0 "[ . 1 . 2]" 1
194 1 24 GLN HB2 1 25 ALA H 2.684 2.064 3.304 2.710 2.613 2.778 . 0 0 "[ . 1 . 2]" 1
195 1 24 GLN QG 1 25 ALA H 4.317 3.875 4.759 4.159 4.108 4.226 . 0 0 "[ . 1 . 2]" 1
196 1 25 ALA H 1 25 ALA HA 2.804 2.174 3.434 2.798 2.777 2.834 . 0 0 "[ . 1 . 2]" 1
197 1 25 ALA H 1 25 ALA MB 2.217 . 2.689 2.237 2.230 2.244 . 0 0 "[ . 1 . 2]" 1
198 1 25 ALA H 1 26 ILE H 2.745 2.078 3.412 2.668 2.548 2.763 . 0 0 "[ . 1 . 2]" 1
199 1 25 ALA H 1 27 PHE H 3.927 3.445 4.409 4.057 3.856 4.234 . 0 0 "[ . 1 . 2]" 1
200 1 25 ALA HA 1 25 ALA MB 2.535 . 3.182 2.134 2.132 2.137 . 0 0 "[ . 1 . 2]" 1
201 1 25 ALA HA 1 26 ILE H 3.620 2.902 4.338 3.501 3.470 3.529 . 0 0 "[ . 1 . 2]" 1
202 1 25 ALA MB 1 26 ILE H 2.831 2.399 3.263 2.624 2.551 2.707 . 0 0 "[ . 1 . 2]" 1
203 1 25 ALA MB 1 72 ILE MD 4.000 . 5.500 3.496 2.838 4.385 . 0 0 "[ . 1 . 2]" 1
204 1 25 ALA MB 1 72 ILE MG 3.000 2.300 4.500 2.826 2.280 3.834 0.020 9 0 "[ . 1 . 2]" 1
205 1 26 ILE H 1 26 ILE HA 3.222 2.791 3.653 2.920 2.889 2.938 . 0 0 "[ . 1 . 2]" 1
206 1 26 ILE H 1 26 ILE HB 2.577 . 3.206 2.618 2.577 2.716 . 0 0 "[ . 1 . 2]" 1
207 1 26 ILE H 1 26 ILE QG 2.490 . 3.174 2.303 2.077 2.542 . 0 0 "[ . 1 . 2]" 1
208 1 26 ILE H 1 26 ILE MG 4.664 3.834 5.494 3.852 3.835 3.868 . 0 0 "[ . 1 . 2]" 1
209 1 26 ILE H 1 27 PHE H 2.607 . 3.240 2.272 2.214 2.440 . 0 0 "[ . 1 . 2]" 1
210 1 26 ILE HA 1 26 ILE MD 4.555 3.797 5.313 3.881 3.833 3.937 . 0 0 "[ . 1 . 2]" 1
211 1 26 ILE HA 1 26 ILE MG 2.920 2.233 3.607 2.413 2.352 2.449 . 0 0 "[ . 1 . 2]" 1
212 1 26 ILE HA 1 27 PHE H 3.532 2.839 4.225 3.517 3.471 3.561 . 0 0 "[ . 1 . 2]" 1
213 1 26 ILE HA 1 79 LEU MD1 3.523 2.688 4.358 3.223 2.739 4.150 . 0 0 "[ . 1 . 2]" 1
214 1 26 ILE HA 2 14 VAL QG 4.012 3.250 4.774 3.734 3.368 3.991 . 0 0 "[ . 1 . 2]" 1
215 1 26 ILE HB 1 26 ILE MD 2.787 2.334 3.240 2.501 2.445 2.534 . 0 0 "[ . 1 . 2]" 1
216 1 26 ILE HB 1 43 LEU MD2 2.411 2.010 2.812 2.690 2.361 2.976 0.164 20 0 "[ . 1 . 2]" 1
217 1 26 ILE MD 1 26 ILE QG 2.523 2.089 2.957 1.895 1.891 1.898 0.198 8 0 "[ . 1 . 2]" 1
218 1 26 ILE MD 1 26 ILE MG 3.000 . 4.500 1.967 1.921 2.042 . 0 0 "[ . 1 . 2]" 1
219 1 26 ILE MD 1 43 LEU MD1 4.000 . 5.500 2.005 1.781 2.473 0.019 17 0 "[ . 1 . 2]" 1
220 1 26 ILE MG 1 27 PHE H 4.124 3.382 4.866 3.693 3.543 3.899 . 0 0 "[ . 1 . 2]" 1
221 1 26 ILE MG 1 27 PHE QD 4.056 3.345 4.767 4.025 3.450 4.453 . 0 0 "[ . 1 . 2]" 1
222 1 26 ILE MG 1 43 LEU MD1 4.000 . 5.500 2.152 1.825 3.009 . 0 0 "[ . 1 . 2]" 1
223 1 26 ILE MG 1 43 LEU MD2 4.000 . 5.500 2.915 2.343 3.598 . 0 0 "[ . 1 . 2]" 1
224 1 27 PHE H 1 27 PHE HA 3.235 2.771 3.699 2.934 2.856 2.951 . 0 0 "[ . 1 . 2]" 1
225 1 27 PHE H 1 27 PHE QD 4.619 3.874 5.364 4.263 3.655 4.428 0.219 17 0 "[ . 1 . 2]" 1
226 1 27 PHE HA 2 14 VAL QG 4.187 3.450 4.782 3.064 2.930 3.512 0.520 1 2 "[+ -. 1 . 2]" 1
227 1 27 PHE QB 2 14 VAL QG 4.479 3.547 5.411 3.666 2.193 4.619 1.354 17 2 "[ . 1 . + -]" 1
228 1 27 PHE QE 1 43 LEU MD1 4.797 4.031 5.563 5.487 4.319 5.750 0.187 20 0 "[ . 1 . 2]" 1
229 1 27 PHE QE 2 14 VAL HA 4.244 3.510 4.978 4.068 3.738 5.274 0.296 17 0 "[ . 1 . 2]" 1
230 1 28 PRO HA 1 29 THR H 3.146 2.508 3.784 3.541 3.510 3.617 . 0 0 "[ . 1 . 2]" 1
231 1 28 PRO HB2 1 28 PRO HD2 4.923 4.160 5.686 4.118 4.107 4.126 0.053 17 0 "[ . 1 . 2]" 1
232 1 28 PRO HB2 1 28 PRO HD3 4.216 3.476 4.956 3.879 3.861 3.912 . 0 0 "[ . 1 . 2]" 1
233 1 28 PRO HB2 1 29 THR H 2.848 2.217 3.479 3.135 3.020 3.308 . 0 0 "[ . 1 . 2]" 1
234 1 28 PRO HB2 1 29 THR MG 2.886 2.426 3.346 2.674 2.407 3.345 0.019 20 0 "[ . 1 . 2]" 1
235 1 28 PRO HB3 1 29 THR H 4.441 3.999 4.883 4.067 3.985 4.204 0.014 15 0 "[ . 1 . 2]" 1
236 1 28 PRO HD3 1 29 THR H 3.650 2.915 4.385 4.019 3.900 4.123 . 0 0 "[ . 1 . 2]" 1
237 1 29 THR H 1 29 THR HA 2.711 2.084 3.338 2.885 2.807 2.946 . 0 0 "[ . 1 . 2]" 1
238 1 29 THR H 1 29 THR HB 3.611 3.203 4.019 3.550 3.330 3.791 . 0 0 "[ . 1 . 2]" 1
239 1 29 THR H 1 29 THR MG 2.669 2.006 3.332 2.526 2.291 3.048 . 0 0 "[ . 1 . 2]" 1
240 1 29 THR HB 1 29 THR MG 2.371 . 2.998 2.132 2.130 2.140 . 0 0 "[ . 1 . 2]" 1
241 1 30 PRO HA 1 31 ASP H 2.182 . 2.637 2.220 2.112 2.364 . 0 0 "[ . 1 . 2]" 1
242 1 30 PRO QB 1 31 ASP H 3.596 3.179 4.013 3.070 2.627 3.418 0.552 3 1 "[ + . 1 . 2]" 1
243 1 31 ASP H 1 31 ASP HA 3.002 2.585 3.419 2.890 2.754 2.944 . 0 0 "[ . 1 . 2]" 1
244 1 31 ASP H 1 31 ASP HB2 3.467 2.775 4.159 3.382 2.429 3.659 0.346 17 0 "[ . 1 . 2]" 1
245 1 31 ASP H 1 31 ASP HB3 2.567 . 3.225 2.744 2.315 3.599 0.374 2 0 "[ . 1 . 2]" 1
246 1 31 ASP HA 1 33 ALA H 4.587 3.833 5.341 4.451 4.120 4.607 . 0 0 "[ . 1 . 2]" 1
247 1 33 ALA H 1 33 ALA MB 1.944 . 2.361 2.235 2.209 2.251 . 0 0 "[ . 1 . 2]" 1
248 1 33 ALA HA 1 33 ALA MB 2.130 . 2.627 2.126 2.122 2.128 . 0 0 "[ . 1 . 2]" 1
249 1 33 ALA MB 1 35 LEU H 4.713 3.905 5.521 4.628 4.447 4.764 . 0 0 "[ . 1 . 2]" 1
250 1 33 ALA MB 1 36 LYS H 4.699 3.831 5.567 4.675 4.542 4.834 . 0 0 "[ . 1 . 2]" 1
251 1 34 ALA H 1 34 ALA HA 2.810 2.163 3.457 2.864 2.855 2.868 . 0 0 "[ . 1 . 2]" 1
252 1 34 ALA H 1 34 ALA MB 1.965 . 2.385 2.239 2.213 2.251 . 0 0 "[ . 1 . 2]" 1
253 1 34 ALA H 1 35 LEU H 2.478 . 3.083 2.436 2.354 2.561 . 0 0 "[ . 1 . 2]" 1
254 1 34 ALA H 1 35 LEU MD1 3.498 3.087 3.909 4.016 3.922 4.057 0.148 16 0 "[ . 1 . 2]" 1
255 1 34 ALA H 1 36 LYS H 3.698 3.219 4.177 4.053 3.926 4.256 0.079 19 0 "[ . 1 . 2]" 1
256 1 34 ALA HA 1 34 ALA MB 2.506 . 3.169 2.132 2.130 2.133 . 0 0 "[ . 1 . 2]" 1
257 1 34 ALA HA 1 35 LEU H 3.367 2.914 3.820 3.491 3.401 3.544 . 0 0 "[ . 1 . 2]" 1
258 1 34 ALA MB 1 35 LEU H 2.252 . 2.699 2.538 2.300 2.719 0.020 20 0 "[ . 1 . 2]" 1
259 1 34 ALA MB 1 35 LEU HA 4.380 3.568 5.192 3.749 3.659 3.825 . 0 0 "[ . 1 . 2]" 1
260 1 34 ALA MB 1 35 LEU MD1 3.491 3.027 3.955 3.839 3.669 4.000 0.045 19 0 "[ . 1 . 2]" 1
261 1 35 LEU H 1 35 LEU HA 2.593 . 3.220 2.809 2.737 2.880 . 0 0 "[ . 1 . 2]" 1
262 1 35 LEU H 1 35 LEU QB 2.441 . 3.049 2.384 2.328 2.443 . 0 0 "[ . 1 . 2]" 1
263 1 35 LEU H 1 35 LEU MD1 2.704 2.076 3.332 2.829 2.695 3.055 . 0 0 "[ . 1 . 2]" 1
264 1 35 LEU H 1 35 LEU MD2 4.368 3.650 5.086 3.880 3.789 3.992 . 0 0 "[ . 1 . 2]" 1
265 1 35 LEU H 1 36 LYS H 2.549 . 3.184 2.690 2.511 2.935 . 0 0 "[ . 1 . 2]" 1
266 1 35 LEU HA 1 35 LEU MD1 3.519 3.081 3.957 3.834 3.785 3.887 . 0 0 "[ . 1 . 2]" 1
267 1 35 LEU HA 1 37 ASP H 3.369 2.878 3.860 3.721 3.592 3.987 0.127 19 0 "[ . 1 . 2]" 1
268 1 35 LEU MD1 1 40 MET ME 4.000 . 5.500 4.440 3.586 5.012 . 0 0 "[ . 1 . 2]" 1
269 1 35 LEU MD2 1 40 MET ME 3.000 . 4.500 2.388 1.997 3.037 . 0 0 "[ . 1 . 2]" 1
270 1 36 LYS H 1 36 LYS HA 2.733 2.131 3.335 2.906 2.878 2.923 . 0 0 "[ . 1 . 2]" 1
271 1 36 LYS H 1 36 LYS HB2 3.488 2.864 4.112 3.620 3.569 3.660 . 0 0 "[ . 1 . 2]" 1
272 1 36 LYS H 1 36 LYS HB3 2.270 . 2.737 2.703 2.594 2.773 0.036 13 0 "[ . 1 . 2]" 1
273 1 36 LYS H 1 36 LYS QG 2.244 . 2.714 2.036 1.902 2.176 . 0 0 "[ . 1 . 2]" 1
274 1 36 LYS H 1 37 ASP H 2.374 . 2.853 2.532 2.338 2.682 . 0 0 "[ . 1 . 2]" 1
275 1 36 LYS H 1 37 ASP HB2 4.461 3.986 4.936 4.215 3.989 4.747 . 0 0 "[ . 1 . 2]" 1
276 1 36 LYS HB2 1 37 ASP H 4.343 3.859 4.827 4.402 4.117 4.487 . 0 0 "[ . 1 . 2]" 1
277 1 36 LYS HB3 1 37 ASP H 4.081 3.643 4.519 4.413 4.130 4.517 . 0 0 "[ . 1 . 2]" 1
278 1 36 LYS QG 1 37 ASP H 3.003 2.599 3.407 3.249 2.679 3.429 0.022 14 0 "[ . 1 . 2]" 1
279 1 37 ASP H 1 37 ASP HA 2.857 2.218 3.496 2.921 2.847 2.939 . 0 0 "[ . 1 . 2]" 1
280 1 37 ASP H 1 37 ASP HB2 2.577 2.093 3.061 2.719 2.564 2.890 . 0 0 "[ . 1 . 2]" 1
281 1 37 ASP H 1 37 ASP HB3 2.534 2.041 3.027 2.599 2.402 2.700 . 0 0 "[ . 1 . 2]" 1
282 1 37 ASP H 1 38 ARG H 4.419 3.937 4.901 4.528 4.471 4.635 . 0 0 "[ . 1 . 2]" 1
283 1 37 ASP HA 1 38 ARG H 2.218 . 2.672 2.222 2.129 2.316 . 0 0 "[ . 1 . 2]" 1
284 1 37 ASP HB2 1 38 ARG H 3.987 3.511 4.463 4.058 3.858 4.294 . 0 0 "[ . 1 . 2]" 1
285 1 37 ASP HB3 1 38 ARG H 4.215 3.510 4.920 3.825 3.539 4.128 . 0 0 "[ . 1 . 2]" 1
286 1 38 ARG H 1 38 ARG HA 2.806 2.172 3.440 2.798 2.776 2.834 . 0 0 "[ . 1 . 2]" 1
287 1 38 ARG H 1 39 ARG H 2.899 2.490 3.308 2.699 2.630 2.763 . 0 0 "[ . 1 . 2]" 1
288 1 38 ARG H 1 40 MET H 4.376 3.526 5.226 4.317 4.188 4.475 . 0 0 "[ . 1 . 2]" 1
289 1 38 ARG HA 1 39 ARG H 3.853 3.126 4.580 3.521 3.496 3.548 . 0 0 "[ . 1 . 2]" 1
290 1 39 ARG H 1 39 ARG HA 2.986 2.557 3.415 2.820 2.782 2.868 . 0 0 "[ . 1 . 2]" 1
291 1 39 ARG H 1 39 ARG HD2 5.038 4.547 5.529 4.763 4.045 5.671 0.502 2 1 "[ + . 1 . 2]" 1
292 1 39 ARG H 1 39 ARG HD3 4.365 3.898 4.832 4.428 3.822 5.671 0.839 5 2 "[ + - . 2]" 1
293 1 39 ARG H 1 40 MET H 2.797 2.394 3.200 2.659 2.507 2.815 . 0 0 "[ . 1 . 2]" 1
294 1 39 ARG H 2 13 PHE QD 5.055 4.486 5.624 6.200 5.644 6.930 1.306 10 11 "[*** * * +** *- * 2]" 1
295 1 39 ARG HA 1 39 ARG QG 4.205 3.750 4.660 2.819 2.474 3.357 1.276 10 17 "[ **** ***+******- **]" 1
296 1 39 ARG HA 1 40 MET H 3.683 2.928 4.438 3.527 3.440 3.565 . 0 0 "[ . 1 . 2]" 1
297 1 39 ARG HA 1 41 GLU H 3.904 3.088 4.720 4.406 4.114 4.552 . 0 0 "[ . 1 . 2]" 1
298 1 40 MET H 1 40 MET HA 3.100 2.690 3.510 2.826 2.739 2.845 . 0 0 "[ . 1 . 2]" 1
299 1 40 MET H 1 41 GLU H 2.553 . 3.174 2.604 2.537 2.826 . 0 0 "[ . 1 . 2]" 1
300 1 40 MET HA 1 41 GLU H 3.688 3.224 4.152 3.524 3.495 3.550 . 0 0 "[ . 1 . 2]" 1
301 1 40 MET QB 1 41 GLU H 2.257 . 2.733 2.541 2.485 2.638 . 0 0 "[ . 1 . 2]" 1
302 1 40 MET ME 1 43 LEU MD2 2.500 . 4.000 2.760 2.132 4.172 0.172 20 0 "[ . 1 . 2]" 1
303 1 40 MET ME 1 44 VAL QG 3.000 . 4.500 2.456 1.912 3.156 . 0 0 "[ . 1 . 2]" 1
304 1 41 GLU H 1 41 GLU HA 2.740 2.115 3.365 2.784 2.743 2.821 . 0 0 "[ . 1 . 2]" 1
305 1 41 GLU HA 1 42 ASN H 3.438 3.010 3.866 3.544 3.529 3.575 . 0 0 "[ . 1 . 2]" 1
306 1 41 GLU HA 1 44 VAL H 3.370 2.915 3.825 3.378 3.273 3.763 . 0 0 "[ . 1 . 2]" 1
307 1 42 ASN H 1 42 ASN HA 2.981 2.338 3.624 2.801 2.784 2.822 . 0 0 "[ . 1 . 2]" 1
308 1 42 ASN H 1 43 LEU H 2.679 2.054 3.304 2.707 2.644 2.807 . 0 0 "[ . 1 . 2]" 1
309 1 42 ASN H 1 44 VAL H 4.343 3.549 5.137 4.331 4.221 4.462 . 0 0 "[ . 1 . 2]" 1
310 1 42 ASN HA 1 43 LEU H 3.445 3.027 3.863 3.527 3.493 3.543 . 0 0 "[ . 1 . 2]" 1
311 1 42 ASN HA 1 45 ALA H 3.260 2.807 3.713 3.302 3.143 3.635 . 0 0 "[ . 1 . 2]" 1
312 1 42 ASN HA 1 45 ALA MB 2.670 . 3.355 2.344 2.227 2.543 . 0 0 "[ . 1 . 2]" 1
313 1 43 LEU H 1 43 LEU HA 3.047 2.358 3.736 2.812 2.800 2.825 . 0 0 "[ . 1 . 2]" 1
314 1 43 LEU H 1 43 LEU HB2 2.870 2.210 3.530 2.606 2.462 2.736 . 0 0 "[ . 1 . 2]" 1
315 1 43 LEU H 1 43 LEU MD1 4.763 3.963 5.563 4.204 4.154 4.259 . 0 0 "[ . 1 . 2]" 1
316 1 43 LEU H 1 43 LEU MD2 4.733 3.934 5.532 4.255 4.226 4.294 . 0 0 "[ . 1 . 2]" 1
317 1 43 LEU H 1 44 VAL H 3.097 2.675 3.519 2.736 2.675 2.840 . 0 0 "[ . 1 . 2]" 1
318 1 43 LEU H 2 10 ILE MD 4.666 3.860 5.472 4.430 3.860 5.051 . 0 0 "[ . 1 . 2]" 1
319 1 43 LEU H 2 10 ILE MG 4.352 3.587 5.117 4.517 4.154 4.846 . 0 0 "[ . 1 . 2]" 1
320 1 43 LEU HA 1 43 LEU MD1 2.887 2.438 3.336 2.387 2.303 3.439 0.135 11 0 "[ . 1 . 2]" 1
321 1 43 LEU HA 1 44 VAL H 3.813 3.088 4.538 3.555 3.533 3.576 . 0 0 "[ . 1 . 2]" 1
322 1 43 LEU HB2 1 44 VAL H 4.020 3.605 4.435 3.852 3.753 3.987 . 0 0 "[ . 1 . 2]" 1
323 1 43 LEU HB3 1 43 LEU MD1 3.237 2.770 3.704 3.178 2.704 3.220 0.066 20 0 "[ . 1 . 2]" 1
324 1 43 LEU HB3 1 44 VAL H 2.761 2.320 3.202 2.492 2.356 2.655 . 0 0 "[ . 1 . 2]" 1
325 1 43 LEU MD1 1 43 LEU HG 2.309 . 2.716 2.131 2.125 2.134 . 0 0 "[ . 1 . 2]" 1
326 1 43 LEU MD1 1 46 TYR QD 4.386 3.604 5.168 4.088 3.738 5.023 . 0 0 "[ . 1 . 2]" 1
327 1 43 LEU MD2 1 43 LEU HG 2.278 . 2.967 2.133 2.131 2.135 . 0 0 "[ . 1 . 2]" 1
328 1 43 LEU MD2 1 44 VAL QG 4.000 . 5.500 3.564 2.921 3.838 . 0 0 "[ . 1 . 2]" 1
329 1 43 LEU MD2 2 13 PHE QE 4.331 3.696 4.966 4.341 3.714 4.809 . 0 0 "[ . 1 . 2]" 1
330 1 44 VAL H 1 44 VAL HA 2.946 2.520 3.372 2.834 2.806 2.855 . 0 0 "[ . 1 . 2]" 1
331 1 44 VAL H 1 44 VAL HB 3.824 3.050 4.598 3.022 2.958 3.591 0.092 16 0 "[ . 1 . 2]" 1
332 1 44 VAL H 1 45 ALA MB 3.947 3.480 4.414 4.322 4.204 4.431 0.017 16 0 "[ . 1 . 2]" 1
333 1 44 VAL HA 1 44 VAL QG . 2.804 3.132 2.129 2.116 2.148 0.688 3 20 [**+*****-***********] 1
334 1 44 VAL HA 1 45 ALA H 3.463 2.763 4.163 3.493 3.454 3.507 . 0 0 "[ . 1 . 2]" 1
335 1 44 VAL HA 1 47 ALA H 3.176 2.711 3.641 3.273 3.134 3.468 . 0 0 "[ . 1 . 2]" 1
336 1 44 VAL HA 1 47 ALA MB 2.896 2.410 3.382 2.624 2.377 3.107 0.033 8 0 "[ . 1 . 2]" 1
337 1 44 VAL HB 1 45 ALA H 3.908 3.055 4.761 2.912 2.869 3.259 0.186 20 0 "[ . 1 . 2]" 1
338 1 44 VAL QG 1 45 ALA H . 3.252 3.902 3.258 2.203 3.376 1.049 9 1 "[ . +1 . 2]" 1
339 1 44 VAL QG 1 45 ALA HA 3.616 2.899 4.333 3.863 3.693 3.951 . 0 0 "[ . 1 . 2]" 1
340 1 45 ALA H 1 45 ALA HA 2.606 . 3.216 2.818 2.798 2.833 . 0 0 "[ . 1 . 2]" 1
341 1 45 ALA H 1 45 ALA MB 2.028 . 2.471 2.244 2.233 2.257 . 0 0 "[ . 1 . 2]" 1
342 1 45 ALA HA 1 45 ALA MB 2.309 . 2.919 2.131 2.125 2.134 . 0 0 "[ . 1 . 2]" 1
343 1 46 TYR H 1 47 ALA H 2.706 2.080 3.332 2.652 2.571 2.747 . 0 0 "[ . 1 . 2]" 1
344 1 46 TYR HA 1 47 ALA H 3.585 3.151 4.019 3.540 3.526 3.556 . 0 0 "[ . 1 . 2]" 1
345 1 46 TYR HA 1 49 LYS H 3.317 2.877 3.757 3.535 3.196 3.811 0.054 10 0 "[ . 1 . 2]" 1
346 1 46 TYR QD 2 6 LEU QD 4.657 3.801 5.513 3.180 2.527 5.101 1.274 8 15 "[-******+*1* *** * *2]" 1
347 1 46 TYR QD 2 10 ILE MD 4.125 3.279 4.971 4.307 3.785 4.706 . 0 0 "[ . 1 . 2]" 1
348 1 46 TYR QD 2 10 ILE HG13 4.424 3.693 5.155 4.142 3.566 4.874 0.127 10 0 "[ . 1 . 2]" 1
349 1 46 TYR QD 2 10 ILE MG 4.475 3.733 5.217 4.481 3.936 4.901 . 0 0 "[ . 1 . 2]" 1
350 1 46 TYR QE 2 6 LEU QD 4.425 3.710 5.140 3.068 2.451 3.749 1.259 6 14 "[* ***+ **1* -** ***2]" 1
351 1 46 TYR QE 2 10 ILE MD 4.791 3.981 5.601 5.285 4.637 5.718 0.117 1 0 "[ . 1 . 2]" 1
352 1 46 TYR QE 2 10 ILE MG 4.874 4.218 5.530 5.194 4.575 5.662 0.132 7 0 "[ . 1 . 2]" 1
353 1 47 ALA H 1 47 ALA HA 2.888 2.213 3.563 2.815 2.795 2.831 . 0 0 "[ . 1 . 2]" 1
354 1 47 ALA H 1 47 ALA MB 2.224 . 2.708 2.257 2.243 2.273 . 0 0 "[ . 1 . 2]" 1
355 1 47 ALA HA 1 47 ALA MB 2.734 2.288 3.180 2.142 2.138 2.146 0.150 16 0 "[ . 1 . 2]" 1
356 1 47 ALA HA 1 48 LYS H 3.593 2.872 4.314 3.524 3.495 3.587 . 0 0 "[ . 1 . 2]" 1
357 1 47 ALA HA 1 50 VAL H 4.376 3.520 5.232 3.706 3.560 3.817 . 0 0 "[ . 1 . 2]" 1
358 1 47 ALA HA 1 50 VAL HB 3.599 2.740 4.458 2.856 2.776 2.961 . 0 0 "[ . 1 . 2]" 1
359 1 47 ALA HA 1 50 VAL MG2 4.046 3.229 4.863 3.342 3.236 3.743 . 0 0 "[ . 1 . 2]" 1
360 1 47 ALA MB 1 48 LYS H 3.154 2.427 3.881 2.551 2.510 2.598 . 0 0 "[ . 1 . 2]" 1
361 1 48 LYS H 1 48 LYS HA 2.865 2.232 3.498 2.815 2.790 2.845 . 0 0 "[ . 1 . 2]" 1
362 1 48 LYS H 1 49 LYS H 2.713 2.060 3.366 2.728 2.586 2.851 . 0 0 "[ . 1 . 2]" 1
363 1 49 LYS H 1 49 LYS HA 2.613 2.116 3.110 2.813 2.782 2.834 . 0 0 "[ . 1 . 2]" 1
364 1 49 LYS H 1 50 VAL H 2.562 . 3.181 2.753 2.674 2.885 . 0 0 "[ . 1 . 2]" 1
365 1 49 LYS H 1 50 VAL MG2 4.124 3.408 4.840 4.332 4.181 4.492 . 0 0 "[ . 1 . 2]" 1
366 1 49 LYS HA 1 52 GLY H 2.974 2.573 3.375 3.378 3.203 3.536 0.161 10 0 "[ . 1 . 2]" 1
367 1 50 VAL H 1 50 VAL HA 2.756 2.119 3.393 2.783 2.767 2.812 . 0 0 "[ . 1 . 2]" 1
368 1 50 VAL H 1 50 VAL HB 3.025 2.537 3.513 2.489 2.452 2.532 0.085 11 0 "[ . 1 . 2]" 1
369 1 50 VAL H 1 50 VAL MG1 3.335 2.682 3.988 3.750 3.737 3.761 . 0 0 "[ . 1 . 2]" 1
370 1 50 VAL H 1 50 VAL MG2 2.395 . 2.996 2.176 2.097 2.320 . 0 0 "[ . 1 . 2]" 1
371 1 50 VAL H 1 51 GLU H 2.891 2.208 3.574 2.781 2.706 2.849 . 0 0 "[ . 1 . 2]" 1
372 1 50 VAL HA 1 50 VAL HB 3.589 2.818 4.360 3.015 3.004 3.023 . 0 0 "[ . 1 . 2]" 1
373 1 50 VAL HA 1 50 VAL MG1 2.848 2.418 3.278 2.465 2.422 2.499 . 0 0 "[ . 1 . 2]" 1
374 1 50 VAL HA 1 50 VAL MG2 2.585 . 3.244 2.313 2.265 2.348 . 0 0 "[ . 1 . 2]" 1
375 1 50 VAL HA 1 51 GLU H 3.320 2.899 3.741 3.547 3.526 3.565 . 0 0 "[ . 1 . 2]" 1
376 1 50 VAL HA 1 53 ASP HB3 3.703 2.910 4.496 3.088 2.979 3.437 . 0 0 "[ . 1 . 2]" 1
377 1 50 VAL HB 1 50 VAL MG1 2.269 . 2.959 2.119 2.114 2.124 . 0 0 "[ . 1 . 2]" 1
378 1 50 VAL HB 1 50 VAL MG2 2.235 . 2.898 2.132 2.129 2.136 . 0 0 "[ . 1 . 2]" 1
379 1 50 VAL HB 1 51 GLU H 2.569 . 3.208 2.575 2.475 2.726 . 0 0 "[ . 1 . 2]" 1
380 1 50 VAL HB 1 52 GLY H 4.509 3.771 5.247 4.971 4.887 5.063 . 0 0 "[ . 1 . 2]" 1
381 1 50 VAL MG1 1 51 GLU H 3.565 2.840 4.290 3.212 3.040 3.353 . 0 0 "[ . 1 . 2]" 1
382 1 50 VAL MG1 1 52 GLY H 4.111 3.367 4.855 4.778 4.742 4.828 . 0 0 "[ . 1 . 2]" 1
383 1 50 VAL MG1 1 54 MET ME 2.500 . 4.000 2.025 1.827 3.263 . 0 0 "[ . 1 . 2]" 1
384 1 50 VAL MG1 1 68 LEU QD 4.000 2.800 5.500 3.042 2.579 4.048 0.221 19 0 "[ . 1 . 2]" 1
385 1 50 VAL MG2 1 51 GLU H 3.802 3.367 4.237 3.892 3.823 3.966 . 0 0 "[ . 1 . 2]" 1
386 1 50 VAL MG2 1 53 ASP H 4.719 3.881 5.557 5.173 4.982 5.384 . 0 0 "[ . 1 . 2]" 1
387 1 50 VAL MG2 1 54 MET ME 4.000 . 5.500 4.027 3.586 5.545 0.045 5 0 "[ . 1 . 2]" 1
388 1 51 GLU H 1 51 GLU HA 2.880 2.228 3.532 2.795 2.779 2.832 . 0 0 "[ . 1 . 2]" 1
389 1 51 GLU H 1 51 GLU HB2 2.775 2.120 3.430 2.640 2.234 2.780 . 0 0 "[ . 1 . 2]" 1
390 1 51 GLU H 1 52 GLY H 2.628 2.021 3.235 2.716 2.604 2.779 . 0 0 "[ . 1 . 2]" 1
391 1 52 GLY H 1 52 GLY HA2 3.063 2.461 3.665 2.822 2.792 2.850 . 0 0 "[ . 1 . 2]" 1
392 1 52 GLY H 1 52 GLY HA3 2.687 2.052 3.322 2.302 2.297 2.309 . 0 0 "[ . 1 . 2]" 1
393 1 52 GLY H 1 53 ASP H 2.801 2.161 3.441 2.704 2.625 2.802 . 0 0 "[ . 1 . 2]" 1
394 1 52 GLY HA2 1 53 ASP H 3.711 3.019 4.403 3.538 3.480 3.561 . 0 0 "[ . 1 . 2]" 1
395 1 52 GLY HA2 1 55 TYR H 3.671 2.923 4.419 3.789 3.319 4.219 . 0 0 "[ . 1 . 2]" 1
396 1 52 GLY HA3 1 53 ASP H 2.872 2.219 3.525 2.778 2.690 2.852 . 0 0 "[ . 1 . 2]" 1
397 1 53 ASP H 1 53 ASP HA 2.992 2.354 3.630 2.827 2.800 2.863 . 0 0 "[ . 1 . 2]" 1
398 1 53 ASP H 1 53 ASP HB2 2.991 2.345 3.637 2.608 2.553 2.694 . 0 0 "[ . 1 . 2]" 1
399 1 53 ASP H 1 53 ASP HB3 2.689 2.083 3.295 2.521 2.393 2.657 . 0 0 "[ . 1 . 2]" 1
400 1 53 ASP H 1 55 TYR H 4.450 3.611 5.289 4.367 4.025 4.689 . 0 0 "[ . 1 . 2]" 1
401 1 53 ASP HB3 1 54 MET H 2.535 . 3.175 2.727 2.511 2.861 . 0 0 "[ . 1 . 2]" 1
402 1 54 MET H 1 54 MET HA 3.106 2.696 3.516 2.824 2.781 2.844 . 0 0 "[ . 1 . 2]" 1
403 1 54 MET H 1 54 MET ME 3.431 2.749 4.113 3.817 3.412 4.017 . 0 0 "[ . 1 . 2]" 1
404 1 54 MET H 1 55 TYR H 2.785 2.090 3.480 2.666 2.554 2.817 . 0 0 "[ . 1 . 2]" 1
405 1 54 MET HA 1 54 MET ME 3.968 3.471 4.465 4.027 3.360 4.684 0.219 2 0 "[ . 1 . 2]" 1
406 1 54 MET HA 1 55 TYR H 3.887 3.155 4.619 3.542 3.505 3.567 . 0 0 "[ . 1 . 2]" 1
407 1 54 MET ME 1 68 LEU QD 3.562 2.704 4.420 2.045 1.878 2.508 0.826 2 17 "[*+* .***** ********-]" 1
408 1 54 MET QG 1 68 LEU QD 3.499 3.021 3.977 2.581 1.845 3.707 1.176 10 12 "[* * .***-+* *.* * *]" 1
409 1 55 TYR H 1 55 TYR HA 3.216 2.780 3.652 2.793 2.750 2.828 0.030 10 0 "[ . 1 . 2]" 1
410 1 55 TYR H 1 55 TYR QB 2.736 2.429 3.419 2.262 2.162 2.514 0.267 4 0 "[ . 1 . 2]" 1
411 1 55 TYR H 1 56 GLU H 2.917 2.505 3.329 2.724 2.629 2.839 . 0 0 "[ . 1 . 2]" 1
412 1 55 TYR QB 1 56 GLU H 4.117 3.674 4.560 2.638 2.473 3.043 1.201 6 20 [****-+**************] 1
413 1 55 TYR QD 1 56 GLU H 4.768 4.273 5.263 4.201 4.122 4.644 0.151 13 0 "[ . 1 . 2]" 1
414 1 56 GLU H 1 56 GLU HA 2.985 2.341 3.629 2.829 2.801 2.855 . 0 0 "[ . 1 . 2]" 1
415 1 56 GLU H 1 56 GLU QB 2.746 2.138 3.354 2.412 2.371 2.570 . 0 0 "[ . 1 . 2]" 1
416 1 56 GLU H 1 56 GLU QG 2.644 2.001 3.287 2.281 1.840 2.465 0.161 18 0 "[ . 1 . 2]" 1
417 1 56 GLU QG 1 57 SER H 4.658 3.958 5.358 4.118 3.805 4.223 0.153 9 0 "[ . 1 . 2]" 1
418 1 57 SER H 1 57 SER HA 2.758 2.271 3.245 2.907 2.859 2.923 . 0 0 "[ . 1 . 2]" 1
419 1 57 SER H 1 58 ALA H 2.429 . 2.917 2.321 2.158 2.630 . 0 0 "[ . 1 . 2]" 1
420 1 57 SER H 1 58 ALA MB 4.354 3.650 5.058 3.973 3.834 4.240 . 0 0 "[ . 1 . 2]" 1
421 1 57 SER H 1 67 LEU MD1 4.627 3.776 5.478 4.356 3.898 5.007 . 0 0 "[ . 1 . 2]" 1
422 1 57 SER HA 1 58 ALA H 3.296 2.644 3.948 3.498 3.440 3.572 . 0 0 "[ . 1 . 2]" 1
423 1 58 ALA H 1 58 ALA HA 2.703 2.054 3.352 2.771 2.735 2.835 . 0 0 "[ . 1 . 2]" 1
424 1 58 ALA H 1 58 ALA MB 2.153 . 2.624 2.201 2.151 2.226 . 0 0 "[ . 1 . 2]" 1
425 1 58 ALA H 1 59 ASN H 3.215 2.754 3.676 3.002 2.728 3.193 0.026 6 0 "[ . 1 . 2]" 1
426 1 58 ALA H 1 67 LEU MD1 2.954 2.526 3.382 3.250 2.891 3.460 0.078 16 0 "[ . 1 . 2]" 1
427 1 58 ALA HA 1 58 ALA MB 2.504 . 3.195 2.125 2.110 2.130 . 0 0 "[ . 1 . 2]" 1
428 1 58 ALA HA 1 60 SER H 3.263 2.849 3.677 3.687 3.575 3.793 0.116 9 0 "[ . 1 . 2]" 1
429 1 58 ALA HA 1 67 LEU MD1 2.890 2.182 3.598 2.601 2.353 3.128 . 0 0 "[ . 1 . 2]" 1
430 1 58 ALA MB 1 60 SER H 2.595 . 3.219 2.526 2.277 2.808 . 0 0 "[ . 1 . 2]" 1
431 1 58 ALA MB 1 63 GLU H 4.824 4.047 5.601 4.581 4.347 4.845 . 0 0 "[ . 1 . 2]" 1
432 1 58 ALA MB 1 64 TYR H 3.269 2.863 3.675 2.955 2.835 3.138 0.028 8 0 "[ . 1 . 2]" 1
433 1 58 ALA MB 1 64 TYR HA 2.779 2.359 3.199 2.270 2.179 2.349 0.180 4 0 "[ . 1 . 2]" 1
434 1 58 ALA MB 1 64 TYR HB3 4.284 3.789 4.779 3.796 3.694 4.167 0.095 3 0 "[ . 1 . 2]" 1
435 1 58 ALA MB 1 65 TYR H 4.639 3.925 5.353 4.813 4.684 4.976 . 0 0 "[ . 1 . 2]" 1
436 1 58 ALA MB 1 67 LEU MD1 2.542 . 3.227 2.394 2.082 2.811 . 0 0 "[ . 1 . 2]" 1
437 1 59 ASN H 1 59 ASN HB2 3.288 2.589 3.987 3.196 2.883 3.977 . 0 0 "[ . 1 . 2]" 1
438 1 59 ASN H 1 59 ASN HB3 3.894 3.475 4.313 3.621 3.047 3.844 0.428 15 0 "[ . 1 . 2]" 1
439 1 59 ASN H 1 59 ASN HD21 4.978 4.273 5.683 5.234 4.453 5.625 . 0 0 "[ . 1 . 2]" 1
440 1 59 ASN H 1 60 SER H 2.783 2.164 3.402 2.924 2.732 3.117 . 0 0 "[ . 1 . 2]" 1
441 1 59 ASN HA 1 60 SER H 3.494 3.068 3.920 3.313 3.014 3.504 0.054 15 0 "[ . 1 . 2]" 1
442 1 59 ASN HB2 1 60 SER H 4.379 3.674 5.084 4.359 4.121 4.545 . 0 0 "[ . 1 . 2]" 1
443 1 59 ASN HB3 1 60 SER H 3.657 3.176 4.138 3.595 3.128 4.602 0.464 15 0 "[ . 1 . 2]" 1
444 1 60 SER H 1 60 SER HA 3.093 2.405 3.781 2.905 2.871 2.951 . 0 0 "[ . 1 . 2]" 1
445 1 60 SER H 1 60 SER QB 2.961 2.272 3.650 2.870 2.756 2.944 . 0 0 "[ . 1 . 2]" 1
446 1 60 SER H 1 61 ARG H 4.647 3.828 5.466 4.370 4.289 4.480 . 0 0 "[ . 1 . 2]" 1
447 1 60 SER H 1 63 GLU H 4.140 3.691 4.589 4.490 4.172 4.683 0.094 18 0 "[ . 1 . 2]" 1
448 1 60 SER H 1 64 TYR H 3.577 3.110 4.044 3.929 3.696 4.096 0.052 8 0 "[ . 1 . 2]" 1
449 1 60 SER HA 1 61 ARG H 2.597 . 3.240 2.391 2.322 2.498 . 0 0 "[ . 1 . 2]" 1
450 1 60 SER QB 1 61 ARG H 3.413 2.756 4.070 2.623 2.293 2.827 0.463 13 0 "[ . 1 . 2]" 1
451 1 60 SER QB 1 62 ASP H 3.392 2.738 4.046 3.150 3.026 3.307 . 0 0 "[ . 1 . 2]" 1
452 1 61 ARG H 1 61 ARG HA 3.132 2.722 3.542 2.830 2.812 2.841 . 0 0 "[ . 1 . 2]" 1
453 1 61 ARG H 1 62 ASP H 2.940 2.252 3.628 2.694 2.654 2.739 . 0 0 "[ . 1 . 2]" 1
454 1 61 ARG HA 1 62 ASP H 3.922 3.442 4.402 3.554 3.519 3.574 . 0 0 "[ . 1 . 2]" 1
455 1 61 ARG HA 1 64 TYR H 3.723 3.019 4.427 3.542 3.283 3.728 . 0 0 "[ . 1 . 2]" 1
456 1 62 ASP H 1 62 ASP HA 2.960 2.304 3.616 2.819 2.794 2.833 . 0 0 "[ . 1 . 2]" 1
457 1 62 ASP H 1 62 ASP HB2 3.429 2.822 4.036 3.615 3.603 3.629 . 0 0 "[ . 1 . 2]" 1
458 1 62 ASP H 1 62 ASP HB3 2.616 2.004 3.228 2.553 2.462 2.724 . 0 0 "[ . 1 . 2]" 1
459 1 62 ASP H 1 63 GLU H 2.881 2.473 3.289 2.701 2.626 2.814 . 0 0 "[ . 1 . 2]" 1
460 1 62 ASP HA 1 65 TYR H 3.657 2.924 4.390 3.608 3.434 3.921 . 0 0 "[ . 1 . 2]" 1
461 1 62 ASP HB2 1 63 GLU H 4.035 3.181 4.889 3.683 3.513 3.827 . 0 0 "[ . 1 . 2]" 1
462 1 62 ASP HB3 1 63 GLU H 4.511 3.654 5.368 3.854 3.746 3.954 . 0 0 "[ . 1 . 2]" 1
463 1 63 GLU H 1 63 GLU HA 3.168 2.755 3.581 2.811 2.741 2.828 0.014 5 0 "[ . 1 . 2]" 1
464 1 63 GLU H 1 64 TYR H 3.101 2.637 3.565 2.643 2.584 2.953 0.053 20 0 "[ . 1 . 2]" 1
465 1 63 GLU HA 1 66 HIS H 3.354 2.940 3.768 3.306 3.081 3.526 . 0 0 "[ . 1 . 2]" 1
466 1 64 TYR H 1 64 TYR HA 3.132 2.728 3.536 2.812 2.794 2.836 . 0 0 "[ . 1 . 2]" 1
467 1 64 TYR H 1 64 TYR HB2 2.919 2.236 3.602 2.449 2.363 2.584 . 0 0 "[ . 1 . 2]" 1
468 1 64 TYR H 1 64 TYR HB3 2.972 2.283 3.661 2.618 2.480 3.599 . 0 0 "[ . 1 . 2]" 1
469 1 64 TYR H 1 65 TYR H 2.884 2.226 3.542 2.762 2.685 2.818 . 0 0 "[ . 1 . 2]" 1
470 1 64 TYR H 1 67 LEU MD1 4.497 3.637 5.357 4.859 4.578 5.179 . 0 0 "[ . 1 . 2]" 1
471 1 64 TYR HA 1 65 TYR H 3.438 3.033 3.843 3.564 3.539 3.594 . 0 0 "[ . 1 . 2]" 1
472 1 64 TYR QD 1 65 TYR H 4.475 4.028 4.922 4.065 3.900 4.363 0.128 10 0 "[ . 1 . 2]" 1
473 1 65 TYR H 1 65 TYR HA 3.110 2.432 3.788 2.841 2.828 2.856 . 0 0 "[ . 1 . 2]" 1
474 1 65 TYR H 1 65 TYR QB 2.673 2.050 3.296 2.292 2.256 2.316 . 0 0 "[ . 1 . 2]" 1
475 1 65 TYR H 1 66 HIS H 2.973 2.275 3.671 2.622 2.564 2.678 . 0 0 "[ . 1 . 2]" 1
476 1 65 TYR HA 1 65 TYR QE 4.688 3.954 5.422 4.643 4.491 4.702 . 0 0 "[ . 1 . 2]" 1
477 1 65 TYR HA 3 23 LEU QD 4.598 3.729 5.467 5.492 5.312 6.147 0.680 20 2 "[ . 1 . -+]" 1
478 1 65 TYR QB 1 66 HIS H 2.941 2.499 3.383 2.595 2.521 2.685 . 0 0 "[ . 1 . 2]" 1
479 1 65 TYR QB 3 23 LEU QD 4.342 3.536 5.148 4.245 3.637 4.829 . 0 0 "[ . 1 . 2]" 1
480 1 65 TYR QD 3 26 LEU QD 4.190 3.290 4.871 4.045 3.378 4.882 0.011 3 0 "[ . 1 . 2]" 1
481 1 65 TYR QE 3 26 LEU QD 4.518 3.583 5.477 2.732 1.949 3.712 1.634 7 16 "[** -**+ ******* ***]" 1
482 1 65 TYR QE 3 30 ALA MB 4.034 3.181 4.887 4.866 4.048 5.198 0.311 15 0 "[ . 1 . 2]" 1
483 1 66 HIS H 1 66 HIS HA 3.263 2.838 3.688 2.802 2.783 2.827 0.055 16 0 "[ . 1 . 2]" 1
484 1 66 HIS H 1 67 LEU H 2.968 2.567 3.369 2.753 2.644 2.819 . 0 0 "[ . 1 . 2]" 1
485 1 66 HIS HA 1 67 LEU H 3.870 3.166 4.574 3.541 3.524 3.565 . 0 0 "[ . 1 . 2]" 1
486 1 66 HIS HA 1 69 ALA H 3.564 2.850 4.278 3.563 3.331 3.811 . 0 0 "[ . 1 . 2]" 1
487 1 66 HIS HA 1 69 ALA MB 3.335 2.574 4.096 2.776 2.704 3.026 . 0 0 "[ . 1 . 2]" 1
488 1 67 LEU H 1 67 LEU HA 3.303 2.832 3.774 2.834 2.814 2.840 0.018 11 0 "[ . 1 . 2]" 1
489 1 67 LEU H 1 67 LEU QB 3.784 3.117 4.451 2.336 2.305 2.363 0.812 9 20 [-*******+***********] 1
490 1 67 LEU H 1 67 LEU MD1 4.341 3.598 5.084 3.725 3.681 3.766 . 0 0 "[ . 1 . 2]" 1
491 1 67 LEU H 1 67 LEU MD2 4.250 3.541 4.959 3.678 3.643 3.714 . 0 0 "[ . 1 . 2]" 1
492 1 67 LEU H 1 68 LEU H 3.037 2.612 3.462 2.636 2.573 2.839 0.039 12 0 "[ . 1 . 2]" 1
493 1 67 LEU HA 1 67 LEU MD2 2.573 . 3.239 2.113 2.096 2.135 . 0 0 "[ . 1 . 2]" 1
494 1 67 LEU HA 1 68 LEU H 3.734 3.011 4.457 3.530 3.505 3.576 . 0 0 "[ . 1 . 2]" 1
495 1 67 LEU QB 1 67 LEU MD2 2.676 2.263 3.089 2.274 2.252 2.290 0.011 7 0 "[ . 1 . 2]" 1
496 1 67 LEU MD1 1 68 LEU H 4.729 3.945 5.513 4.627 4.422 4.747 . 0 0 "[ . 1 . 2]" 1
497 1 68 LEU H 1 68 LEU HA 3.016 2.324 3.708 2.822 2.782 2.844 . 0 0 "[ . 1 . 2]" 1
498 1 68 LEU H 1 68 LEU QB 2.585 . 3.249 2.323 2.184 2.433 . 0 0 "[ . 1 . 2]" 1
499 1 68 LEU H 1 68 LEU QD 3.882 3.512 4.313 3.228 3.095 3.380 0.417 10 0 "[ . 1 . 2]" 1
500 1 68 LEU H 1 68 LEU HG 2.776 2.373 3.179 2.565 2.332 2.968 0.041 12 0 "[ . 1 . 2]" 1
501 1 68 LEU H 1 69 ALA H 2.915 2.230 3.600 2.654 2.567 2.777 . 0 0 "[ . 1 . 2]" 1
502 1 68 LEU HA 1 71 LYS H 3.496 3.007 3.985 3.447 3.082 3.824 . 0 0 "[ . 1 . 2]" 1
503 1 68 LEU QB 1 69 ALA MB 4.296 3.496 5.096 3.832 3.694 3.975 . 0 0 "[ . 1 . 2]" 1
504 1 68 LEU MD1 1 68 LEU MD2 2.065 . 2.722 2.037 2.016 2.061 . 0 0 "[ . 1 . 2]" 1
505 1 68 LEU QD 1 68 LEU HG 2.310 2.042 2.713 1.892 1.885 1.897 0.157 6 0 "[ . 1 . 2]" 1
506 1 69 ALA H 1 69 ALA HA 2.661 2.027 3.295 2.812 2.785 2.827 . 0 0 "[ . 1 . 2]" 1
507 1 69 ALA H 1 69 ALA MB 2.256 . 2.741 2.234 2.222 2.251 . 0 0 "[ . 1 . 2]" 1
508 1 69 ALA HA 1 69 ALA MB 2.774 2.068 3.480 2.139 2.136 2.142 . 0 0 "[ . 1 . 2]" 1
509 1 69 ALA HA 1 70 GLU H 3.438 2.693 4.183 3.535 3.513 3.558 . 0 0 "[ . 1 . 2]" 1
510 1 69 ALA HA 1 72 ILE H 4.067 3.582 4.552 3.717 3.526 3.957 0.056 18 0 "[ . 1 . 2]" 1
511 1 69 ALA HA 3 22 ILE MD 3.931 3.098 4.764 3.665 3.097 4.189 0.001 4 0 "[ . 1 . 2]" 1
512 1 69 ALA HA 3 26 LEU QD 4.181 3.355 5.007 3.713 3.195 4.512 0.160 4 0 "[ . 1 . 2]" 1
513 1 69 ALA MB 1 70 GLU H 2.646 2.229 3.063 2.475 2.366 2.571 . 0 0 "[ . 1 . 2]" 1
514 1 69 ALA MB 3 23 LEU H 4.169 3.335 5.003 4.838 4.487 5.202 0.199 20 0 "[ . 1 . 2]" 1
515 1 69 ALA MB 3 23 LEU QD 2.718 . 3.478 2.371 2.028 3.404 . 0 0 "[ . 1 . 2]" 1
516 1 69 ALA MB 3 26 LEU QD 3.027 2.224 3.830 3.540 2.959 4.027 0.197 10 0 "[ . 1 . 2]" 1
517 1 70 GLU H 1 70 GLU HA 3.319 2.881 3.757 2.823 2.806 2.834 0.075 10 0 "[ . 1 . 2]" 1
518 1 70 GLU H 1 71 LYS H 2.740 2.067 3.413 2.658 2.593 2.784 . 0 0 "[ . 1 . 2]" 1
519 1 70 GLU H 3 19 TYR QD 4.393 3.584 5.202 5.117 4.570 5.393 0.191 2 0 "[ . 1 . 2]" 1
520 1 70 GLU HB2 3 13 LEU QD 3.685 2.802 4.466 3.676 2.995 4.877 0.411 20 0 "[ . 1 . 2]" 1
521 1 70 GLU HB3 3 13 LEU QD 4.212 3.384 5.014 4.208 3.237 4.782 0.147 14 0 "[ . 1 . 2]" 1
522 1 71 LYS H 1 71 LYS HA 2.795 2.126 3.464 2.828 2.819 2.836 . 0 0 "[ . 1 . 2]" 1
523 1 71 LYS H 1 71 LYS QB 2.294 . 2.771 2.235 2.167 2.426 . 0 0 "[ . 1 . 2]" 1
524 1 71 LYS H 1 72 ILE H 2.823 2.133 3.513 2.639 2.604 2.676 . 0 0 "[ . 1 . 2]" 1
525 1 71 LYS H 1 72 ILE MG 3.785 3.355 4.215 4.334 4.300 4.375 0.160 19 0 "[ . 1 . 2]" 1
526 1 71 LYS H 1 73 TYR H 4.120 3.316 4.924 4.147 3.894 4.385 . 0 0 "[ . 1 . 2]" 1
527 1 71 LYS HA 1 74 LYS H 3.668 2.903 4.433 3.754 3.185 4.177 . 0 0 "[ . 1 . 2]" 1
528 1 71 LYS QB 1 72 ILE H 2.351 . 2.849 2.424 2.248 2.634 . 0 0 "[ . 1 . 2]" 1
529 1 72 ILE H 1 72 ILE HA 3.125 2.671 3.579 2.817 2.802 2.829 . 0 0 "[ . 1 . 2]" 1
530 1 72 ILE H 1 72 ILE MD 4.693 4.203 5.183 3.927 3.873 3.967 0.330 18 0 "[ . 1 . 2]" 1
531 1 72 ILE H 1 72 ILE QG 2.260 . 2.903 2.278 2.205 2.343 . 0 0 "[ . 1 . 2]" 1
532 1 72 ILE H 1 72 ILE MG 2.873 2.383 3.363 2.339 2.316 2.361 0.067 9 0 "[ . 1 . 2]" 1
533 1 72 ILE HA 1 73 TYR H 3.593 3.096 4.090 3.556 3.523 3.589 . 0 0 "[ . 1 . 2]" 1
534 1 72 ILE HA 1 75 ILE H 3.559 2.821 4.297 3.576 3.122 3.904 . 0 0 "[ . 1 . 2]" 1
535 1 72 ILE HA 1 75 ILE MD 3.497 2.717 4.277 2.812 2.701 2.904 0.016 12 0 "[ . 1 . 2]" 1
536 1 72 ILE HB 1 72 ILE MG 2.555 2.137 2.973 2.128 2.124 2.130 0.013 1 0 "[ . 1 . 2]" 1
537 1 72 ILE HB 3 22 ILE MD 3.425 2.554 4.296 4.391 3.901 5.034 0.738 6 1 "[ .+ 1 . 2]" 1
538 1 72 ILE MD 1 72 ILE QG 2.820 2.061 3.579 1.905 1.903 1.906 0.158 7 0 "[ . 1 . 2]" 1
539 1 72 ILE QG 1 72 ILE MG 2.743 2.290 3.196 2.285 2.267 2.300 0.023 20 0 "[ . 1 . 2]" 1
540 1 72 ILE MG 1 73 TYR H 4.880 4.433 5.327 4.101 4.074 4.132 0.359 13 0 "[ . 1 . 2]" 1
541 1 73 TYR H 1 73 TYR QB 3.453 2.691 4.215 2.255 2.186 2.322 0.505 17 1 "[ . 1 . + 2]" 1
542 1 73 TYR H 1 74 LYS H 3.150 2.664 3.636 2.652 2.608 2.752 0.056 3 0 "[ . 1 . 2]" 1
543 1 73 TYR H 3 22 ILE MD 4.062 3.208 4.916 4.017 3.447 4.480 . 0 0 "[ . 1 . 2]" 1
544 1 73 TYR QD 3 13 LEU QD 4.883 4.078 5.294 3.493 3.301 4.280 0.777 19 16 "[* ******-* * *****+2]" 1
545 1 73 TYR QD 3 22 ILE MD 3.889 2.996 4.782 3.209 2.865 3.844 0.131 20 0 "[ . 1 . 2]" 1
546 1 73 TYR QD 3 22 ILE MG 4.699 3.841 5.557 4.635 4.003 5.286 . 0 0 "[ . 1 . 2]" 1
547 1 73 TYR QE 3 12 ILE MG 4.604 3.670 5.538 5.297 4.018 6.040 0.502 10 1 "[ . + . 2]" 1
548 1 73 TYR QE 3 13 LEU QD 3.905 3.556 4.789 4.109 3.462 4.443 0.094 17 0 "[ . 1 . 2]" 1
549 1 74 LYS H 1 74 LYS HA 3.041 2.626 3.456 2.786 2.755 2.822 . 0 0 "[ . 1 . 2]" 1
550 1 74 LYS HA 2 5 ILE MD 5.100 4.523 5.677 5.852 4.681 6.169 0.492 10 0 "[ . 1 . 2]" 1
551 1 74 LYS HA 2 5 ILE MG 4.612 3.778 5.446 5.476 4.883 5.837 0.391 20 0 "[ . 1 . 2]" 1
552 1 74 LYS QD 2 5 ILE MD 2.852 2.209 3.495 2.609 2.200 3.110 0.009 4 0 "[ . 1 . 2]" 1
553 1 74 LYS QE 2 5 ILE MD 4.452 3.625 5.279 3.426 2.046 4.227 1.579 17 6 "[ - .*** 1 *. + 2]" 1
554 1 75 ILE H 1 75 ILE HA 2.965 2.530 3.400 2.842 2.822 2.861 . 0 0 "[ . 1 . 2]" 1
555 1 75 ILE H 1 75 ILE MD 4.003 3.207 4.799 3.428 3.225 3.708 . 0 0 "[ . 1 . 2]" 1
556 1 75 ILE H 1 75 ILE MG 4.303 3.507 5.099 3.797 3.775 3.820 . 0 0 "[ . 1 . 2]" 1
557 1 75 ILE H 1 76 GLN H 2.833 2.419 3.247 2.588 2.511 2.677 . 0 0 "[ . 1 . 2]" 1
558 1 75 ILE H 2 5 ILE MG 4.892 4.098 5.686 4.785 4.228 6.017 0.331 4 0 "[ . 1 . 2]" 1
559 1 75 ILE HA 1 75 ILE HB 3.494 2.739 4.249 3.027 3.003 3.037 . 0 0 "[ . 1 . 2]" 1
560 1 75 ILE HA 1 75 ILE MG 3.009 2.524 3.494 2.432 2.352 2.494 0.172 20 0 "[ . 1 . 2]" 1
561 1 75 ILE HA 1 78 GLU H 3.634 2.906 4.362 3.398 3.098 3.628 . 0 0 "[ . 1 . 2]" 1
562 1 75 ILE HB 1 75 ILE MD 2.536 . 3.214 2.250 2.149 2.382 . 0 0 "[ . 1 . 2]" 1
563 1 75 ILE HB 1 75 ILE MG 2.244 . 2.917 2.119 2.089 2.132 . 0 0 "[ . 1 . 2]" 1
564 1 75 ILE HB 1 76 GLN H 2.581 . 3.210 2.363 2.210 2.517 . 0 0 "[ . 1 . 2]" 1
565 1 75 ILE MD 1 75 ILE MG 3.000 . 4.500 2.186 1.928 2.428 . 0 0 "[ . 1 . 2]" 1
566 1 75 ILE MD 1 76 GLN H 3.528 2.863 4.193 4.157 4.064 4.290 0.097 10 0 "[ . 1 . 2]" 1
567 1 75 ILE MG 1 76 GLN H 3.843 3.021 4.665 3.404 3.192 3.618 . 0 0 "[ . 1 . 2]" 1
568 1 75 ILE MG 1 79 LEU MD1 4.000 . 5.500 2.524 2.028 3.173 . 0 0 "[ . 1 . 2]" 1
569 1 76 GLN H 1 76 GLN HA 2.994 2.592 3.396 2.772 2.752 2.784 . 0 0 "[ . 1 . 2]" 1
570 1 76 GLN H 1 77 LYS H 3.156 2.712 3.600 2.848 2.781 2.932 . 0 0 "[ . 1 . 2]" 1
571 1 78 GLU H 1 78 GLU HA 2.696 2.088 3.304 2.815 2.789 2.832 . 0 0 "[ . 1 . 2]" 1
572 1 78 GLU H 1 79 LEU H 2.728 2.072 3.384 2.678 2.640 2.747 . 0 0 "[ . 1 . 2]" 1
573 1 78 GLU HA 1 80 GLU H 3.742 3.033 4.451 4.296 4.212 4.361 . 0 0 "[ . 1 . 2]" 1
574 1 78 GLU QG 1 79 LEU MD2 4.120 3.377 4.863 4.167 3.809 4.522 . 0 0 "[ . 1 . 2]" 1
575 1 79 LEU H 1 79 LEU HA 2.906 2.230 3.582 2.800 2.779 2.819 . 0 0 "[ . 1 . 2]" 1
576 1 79 LEU H 1 79 LEU HB2 2.557 . 3.207 2.490 2.328 2.584 . 0 0 "[ . 1 . 2]" 1
577 1 79 LEU H 1 79 LEU HB3 3.965 3.543 4.387 3.595 3.564 3.618 . 0 0 "[ . 1 . 2]" 1
578 1 79 LEU H 1 79 LEU MD1 3.545 2.864 4.226 3.529 3.383 3.640 . 0 0 "[ . 1 . 2]" 1
579 1 79 LEU H 1 79 LEU MD2 3.795 3.350 4.240 3.453 3.306 3.781 0.044 1 0 "[ . 1 . 2]" 1
580 1 79 LEU H 1 79 LEU HG 2.517 . 3.191 2.301 2.134 2.648 . 0 0 "[ . 1 . 2]" 1
581 1 79 LEU H 1 80 GLU H 2.568 . 3.196 2.700 2.621 2.810 . 0 0 "[ . 1 . 2]" 1
582 1 79 LEU HA 1 79 LEU MD1 4.179 3.470 4.888 3.892 3.851 3.924 . 0 0 "[ . 1 . 2]" 1
583 1 79 LEU HA 1 79 LEU MD2 2.663 . 3.352 2.188 2.153 2.232 . 0 0 "[ . 1 . 2]" 1
584 1 79 LEU HB2 1 79 LEU MD1 2.705 2.283 3.127 2.273 2.236 2.314 0.047 18 0 "[ . 1 . 2]" 1
585 1 79 LEU HB2 1 79 LEU MD2 3.190 2.524 3.856 3.196 3.175 3.208 . 0 0 "[ . 1 . 2]" 1
586 1 79 LEU HB3 1 80 GLU H 3.696 3.272 4.120 3.583 3.366 3.705 . 0 0 "[ . 1 . 2]" 1
587 1 79 LEU MD1 1 79 LEU HG 2.391 . 2.835 2.127 2.123 2.130 . 0 0 "[ . 1 . 2]" 1
588 1 79 LEU MD1 1 80 GLU H 4.398 3.696 5.100 4.423 4.198 4.526 . 0 0 "[ . 1 . 2]" 1
589 1 79 LEU MD2 1 79 LEU HG 2.262 . 2.667 2.129 2.123 2.132 . 0 0 "[ . 1 . 2]" 1
590 1 80 GLU H 1 80 GLU HA 2.721 2.222 3.220 2.822 2.799 2.835 . 0 0 "[ . 1 . 2]" 1
591 1 80 GLU H 1 80 GLU QB 2.388 . 2.862 2.287 2.179 2.532 . 0 0 "[ . 1 . 2]" 1
592 1 81 GLU H 1 81 GLU HA 2.674 2.179 3.169 2.818 2.785 2.835 . 0 0 "[ . 1 . 2]" 1
593 1 81 GLU H 1 81 GLU QB 2.360 . 2.803 2.273 2.152 2.396 . 0 0 "[ . 1 . 2]" 1
594 1 81 GLU H 1 81 GLU HG2 4.680 3.944 5.416 3.904 3.846 3.969 0.098 19 0 "[ . 1 . 2]" 1
595 1 81 GLU H 1 81 GLU HG3 2.682 2.047 3.317 2.984 2.770 3.163 . 0 0 "[ . 1 . 2]" 1
596 1 81 GLU HA 1 81 GLU HG2 3.933 3.493 4.373 4.284 4.251 4.296 . 0 0 "[ . 1 . 2]" 1
597 1 81 GLU HA 1 81 GLU HG3 4.187 3.733 4.641 3.780 3.725 3.819 0.008 3 0 "[ . 1 . 2]" 1
598 1 82 LYS H 1 82 LYS HA 2.757 2.130 3.384 2.799 2.768 2.824 . 0 0 "[ . 1 . 2]" 1
599 1 83 ARG H 1 83 ARG HA 3.585 2.853 4.317 2.889 2.856 2.905 . 0 0 "[ . 1 . 2]" 1
600 1 83 ARG H 1 84 ARG H 2.564 . 3.195 2.433 2.355 2.590 . 0 0 "[ . 1 . 2]" 1
601 1 84 ARG H 1 84 ARG HA 2.544 2.051 3.037 2.851 2.750 2.890 . 0 0 "[ . 1 . 2]" 1
602 1 85 SER H 1 85 SER HA 2.754 2.274 3.234 2.904 2.807 2.936 . 0 0 "[ . 1 . 2]" 1
603 1 85 SER QB 1 86 ARG H 3.579 2.917 4.241 3.393 2.128 3.764 0.789 1 1 "[+ . 1 . 2]" 1
604 1 86 ARG H 1 86 ARG HA 2.289 . 2.733 2.554 2.254 2.870 0.137 20 0 "[ . 1 . 2]" 1
605 1 86 ARG HA 1 87 LEU H 2.123 . 2.566 2.266 2.103 2.516 . 0 0 "[ . 1 . 2]" 1
606 1 87 LEU H 1 87 LEU HA 2.660 2.169 3.151 2.824 2.734 2.948 . 0 0 "[ . 1 . 2]" 1
607 2 1 ASP H1 2 1 ASP HA 2.525 2.066 2.984 2.710 2.258 2.934 . 0 0 "[ . 1 . 2]" 1
608 2 1 ASP H1 2 1 ASP HB2 2.847 2.267 3.427 2.773 2.491 3.369 . 0 0 "[ . 1 . 2]" 1
609 2 1 ASP H1 2 1 ASP HB3 4.184 3.505 4.863 3.789 3.648 4.091 . 0 0 "[ . 1 . 2]" 1
610 2 2 ALA H 2 2 ALA MB 2.321 . 2.845 2.366 2.204 2.739 . 0 0 "[ . 1 . 2]" 1
611 2 2 ALA MB 2 3 GLY H 3.442 2.791 4.093 3.469 2.993 3.718 . 0 0 "[ . 1 . 2]" 1
612 2 3 GLY H 2 3 GLY QA 1.968 . 2.421 2.251 2.174 2.393 . 0 0 "[ . 1 . 2]" 1
613 2 3 GLY QA 2 4 ASN H 1.913 . 2.443 2.212 2.098 2.377 . 0 0 "[ . 1 . 2]" 1
614 2 4 ASN H 2 4 ASN HB2 2.278 . 2.807 2.419 2.212 2.892 0.085 11 0 "[ . 1 . 2]" 1
615 2 4 ASN H 2 4 ASN HB3 3.525 3.012 4.038 3.471 2.698 3.735 0.314 11 0 "[ . 1 . 2]" 1
616 2 4 ASN H 2 5 ILE H 3.013 2.421 3.605 2.756 2.340 3.541 0.081 20 0 "[ . 1 . 2]" 1
617 2 4 ASN HA 2 4 ASN HB2 3.523 2.889 4.157 2.949 2.561 3.032 0.328 11 0 "[ . 1 . 2]" 1
618 2 4 ASN HA 2 4 ASN HB3 2.841 2.221 3.461 2.652 2.454 3.033 . 0 0 "[ . 1 . 2]" 1
619 2 4 ASN HA 2 5 ILE H 3.102 2.420 3.784 3.177 2.588 3.559 . 0 0 "[ . 1 . 2]" 1
620 2 4 ASN HB2 2 4 ASN HD21 3.520 2.894 4.146 3.157 2.278 3.520 0.616 11 1 "[ . 1+ . 2]" 1
621 2 4 ASN HB2 2 4 ASN HD22 3.984 3.356 4.612 3.901 3.520 4.093 . 0 0 "[ . 1 . 2]" 1
622 2 4 ASN HB3 2 4 ASN HD22 4.243 3.701 4.785 3.890 3.555 4.091 0.146 3 0 "[ . 1 . 2]" 1
623 2 5 ILE H 2 5 ILE HA 3.383 2.620 4.146 2.930 2.855 2.950 . 0 0 "[ . 1 . 2]" 1
624 2 5 ILE H 2 5 ILE HB 3.436 2.723 4.149 3.208 2.770 3.876 . 0 0 "[ . 1 . 2]" 1
625 2 5 ILE H 2 5 ILE MD 4.484 3.699 5.269 3.903 3.766 4.208 . 0 0 "[ . 1 . 2]" 1
626 2 5 ILE HA 2 5 ILE HB 3.256 2.492 4.020 2.792 2.460 3.028 0.032 13 0 "[ . 1 . 2]" 1
627 2 5 ILE HA 2 5 ILE HG12 3.200 2.476 3.924 3.179 2.619 3.795 . 0 0 "[ . 1 . 2]" 1
628 2 5 ILE HA 2 5 ILE HG13 3.689 2.946 4.432 3.423 2.601 3.775 0.345 2 0 "[ . 1 . 2]" 1
629 2 5 ILE HA 2 5 ILE MG 2.327 . 3.019 2.371 2.193 3.171 0.152 4 0 "[ . 1 . 2]" 1
630 2 5 ILE HA 2 6 LEU H 2.739 . 3.497 2.333 2.206 2.443 . 0 0 "[ . 1 . 2]" 1
631 2 5 ILE HB 2 5 ILE MD 2.151 . 2.694 2.445 2.363 2.540 . 0 0 "[ . 1 . 2]" 1
632 2 5 ILE HB 2 5 ILE HG12 3.312 2.680 3.944 2.969 2.406 3.035 0.274 4 0 "[ . 1 . 2]" 1
633 2 5 ILE HB 2 5 ILE HG13 3.001 2.410 3.592 2.526 2.412 3.026 . 0 0 "[ . 1 . 2]" 1
634 2 5 ILE MD 2 5 ILE HG12 2.123 . 2.435 2.120 2.114 2.129 . 0 0 "[ . 1 . 2]" 1
635 2 5 ILE HG12 2 5 ILE MG 2.536 . 3.175 2.370 2.317 2.471 . 0 0 "[ . 1 . 2]" 1
636 2 6 LEU H 2 6 LEU HA 3.069 2.367 3.771 2.882 2.859 2.922 . 0 0 "[ . 1 . 2]" 1
637 2 6 LEU H 2 6 LEU QB 2.484 . 3.157 2.480 2.252 2.903 . 0 0 "[ . 1 . 2]" 1
638 2 6 LEU H 2 6 LEU QD 2.314 . 2.938 2.406 1.658 2.961 0.032 16 0 "[ . 1 . 2]" 1
639 2 6 LEU H 2 6 LEU HG 3.201 2.512 3.890 2.920 2.551 3.720 . 0 0 "[ . 1 . 2]" 1
640 2 6 LEU HA 2 6 LEU QD 3.434 2.692 4.176 2.854 2.485 3.225 0.207 19 0 "[ . 1 . 2]" 1
641 2 6 LEU QB 2 6 LEU QD 2.269 . 2.595 1.865 1.816 1.972 0.127 9 0 "[ . 1 . 2]" 1
642 2 6 LEU QD 2 6 LEU HG 2.441 . 3.075 1.892 1.875 1.899 . 0 0 "[ . 1 . 2]" 1
643 2 8 SER H 2 8 SER HA 2.447 . 2.932 2.774 2.764 2.814 . 0 0 "[ . 1 . 2]" 1
644 2 9 ASP H 2 9 ASP HB2 2.683 2.108 3.258 2.548 2.425 3.543 0.285 8 0 "[ . 1 . 2]" 1
645 2 9 ASP H 2 9 ASP HB3 3.021 2.442 3.600 2.630 2.552 2.745 . 0 0 "[ . 1 . 2]" 1
646 2 9 ASP H 2 10 ILE H 2.715 2.083 3.347 2.918 2.747 3.086 . 0 0 "[ . 1 . 2]" 1
647 2 9 ASP H 2 11 MET H 3.781 3.059 4.503 4.236 4.076 4.384 . 0 0 "[ . 1 . 2]" 1
648 2 9 ASP HA 2 10 ILE H 3.526 2.842 4.210 3.568 3.535 3.618 . 0 0 "[ . 1 . 2]" 1
649 2 9 ASP HB2 2 10 ILE H 4.073 3.423 4.723 3.808 3.313 3.962 0.110 8 0 "[ . 1 . 2]" 1
650 2 10 ILE H 2 10 ILE HA 2.947 2.255 3.639 2.832 2.823 2.853 . 0 0 "[ . 1 . 2]" 1
651 2 10 ILE H 2 10 ILE HB 2.637 . 3.320 2.742 2.612 2.921 . 0 0 "[ . 1 . 2]" 1
652 2 10 ILE H 2 10 ILE HG12 2.009 . 2.682 1.931 1.732 2.088 . 0 0 "[ . 1 . 2]" 1
653 2 10 ILE H 2 10 ILE MG 3.645 3.225 4.065 3.779 3.750 3.845 . 0 0 "[ . 1 . 2]" 1
654 2 10 ILE H 2 11 MET H 2.549 . 3.130 2.604 2.557 2.651 . 0 0 "[ . 1 . 2]" 1
655 2 10 ILE HA 2 10 ILE MG 2.589 . 3.232 2.289 2.225 2.375 . 0 0 "[ . 1 . 2]" 1
656 2 10 ILE HA 2 13 PHE H 3.448 2.796 4.100 3.587 3.337 3.887 . 0 0 "[ . 1 . 2]" 1
657 2 10 ILE HB 2 10 ILE MD 4.085 3.360 4.810 3.253 3.247 3.257 0.113 13 0 "[ . 1 . 2]" 1
658 2 10 ILE HB 2 11 MET H 2.814 2.168 3.460 2.605 2.473 2.769 . 0 0 "[ . 1 . 2]" 1
659 2 10 ILE MD 2 10 ILE HG12 2.513 . 3.164 2.119 2.115 2.122 . 0 0 "[ . 1 . 2]" 1
660 2 10 ILE MG 2 11 MET H 3.389 2.735 4.043 3.688 3.520 3.842 . 0 0 "[ . 1 . 2]" 1
661 2 11 MET H 2 11 MET HA 2.913 2.221 3.605 2.813 2.762 2.830 . 0 0 "[ . 1 . 2]" 1
662 2 11 MET H 2 11 MET HB2 2.726 2.097 3.355 2.452 2.320 2.567 . 0 0 "[ . 1 . 2]" 1
663 2 11 MET H 2 11 MET HB3 3.882 3.250 4.514 3.587 3.562 3.605 . 0 0 "[ . 1 . 2]" 1
664 2 11 MET H 2 11 MET ME 3.277 2.673 3.881 3.115 2.785 3.613 . 0 0 "[ . 1 . 2]" 1
665 2 11 MET H 2 12 ASP H 3.084 2.478 3.490 2.662 2.583 2.796 . 0 0 "[ . 1 . 2]" 1
666 2 11 MET HA 2 11 MET HB3 2.978 2.247 3.709 2.517 2.460 2.600 . 0 0 "[ . 1 . 2]" 1
667 2 11 MET HA 2 11 MET ME 1.977 . 2.719 1.855 1.812 1.920 . 0 0 "[ . 1 . 2]" 1
668 2 11 MET HB2 2 12 ASP H 2.869 2.186 3.552 2.617 2.480 2.742 . 0 0 "[ . 1 . 2]" 1
669 2 11 MET HB3 2 12 ASP H 3.825 3.172 4.478 3.582 3.365 3.755 . 0 0 "[ . 1 . 2]" 1
670 2 11 MET QG 2 12 ASP H 4.433 3.754 5.112 4.125 3.865 4.480 . 0 0 "[ . 1 . 2]" 1
671 2 12 ASP H 2 12 ASP HA 2.843 2.208 3.478 2.793 2.765 2.822 . 0 0 "[ . 1 . 2]" 1
672 2 12 ASP H 2 12 ASP HB2 2.437 . 3.006 2.349 2.217 2.490 . 0 0 "[ . 1 . 2]" 1
673 2 12 ASP H 2 12 ASP HB3 3.878 3.244 4.512 3.576 3.507 3.617 . 0 0 "[ . 1 . 2]" 1
674 2 12 ASP H 2 13 PHE H 3.163 2.561 3.765 2.765 2.677 2.909 . 0 0 "[ . 1 . 2]" 1
675 2 12 ASP HA 2 12 ASP HB3 3.034 2.357 3.711 2.619 2.551 2.711 . 0 0 "[ . 1 . 2]" 1
676 2 12 ASP HA 2 15 LEU H 3.832 3.120 4.544 3.695 3.423 4.202 . 0 0 "[ . 1 . 2]" 1
677 2 12 ASP HB2 2 13 PHE H 3.256 2.621 3.891 2.843 2.761 2.990 . 0 0 "[ . 1 . 2]" 1
678 2 12 ASP HB3 2 13 PHE H 3.574 2.935 4.213 3.502 3.208 3.684 . 0 0 "[ . 1 . 2]" 1
679 2 13 PHE H 2 13 PHE HA 3.021 2.449 3.593 2.809 2.786 2.829 . 0 0 "[ . 1 . 2]" 1
680 2 13 PHE H 2 13 PHE QB 2.831 2.210 3.452 2.301 2.244 2.601 . 0 0 "[ . 1 . 2]" 1
681 2 13 PHE H 2 14 VAL H 3.078 2.504 3.652 2.808 2.754 2.889 . 0 0 "[ . 1 . 2]" 1
682 2 13 PHE H 2 14 VAL QG 4.028 3.404 4.652 4.120 3.885 4.344 . 0 0 "[ . 1 . 2]" 1
683 2 13 PHE HA 2 14 VAL H 4.142 3.384 4.900 3.584 3.567 3.597 . 0 0 "[ . 1 . 2]" 1
684 2 13 PHE HA 2 14 VAL QG 4.909 4.260 5.558 4.959 4.835 5.049 . 0 0 "[ . 1 . 2]" 1
685 2 13 PHE QB 2 14 VAL H 2.963 2.311 3.615 2.492 2.365 2.762 . 0 0 "[ . 1 . 2]" 1
686 2 14 VAL H 2 14 VAL HB 2.946 2.327 3.565 2.577 2.479 2.729 . 0 0 "[ . 1 . 2]" 1
687 2 14 VAL H 2 14 VAL QG 3.739 3.114 4.364 2.243 1.945 2.433 1.169 11 20 [-*********+*********] 1
688 2 14 VAL H 2 15 LEU H 2.984 2.323 3.645 2.670 2.597 2.717 . 0 0 "[ . 1 . 2]" 1
689 2 14 VAL H 2 15 LEU MD2 4.092 3.493 4.691 4.074 3.902 4.191 . 0 0 "[ . 1 . 2]" 1
690 2 14 VAL MG1 2 14 VAL MG2 2.122 . 2.789 2.076 2.050 2.088 . 0 0 "[ . 1 . 2]" 1
691 2 14 VAL QG 2 15 LEU H 3.269 2.626 3.912 2.167 2.069 2.249 0.557 11 4 "[ . -1+ . **2]" 1
692 2 15 LEU H 2 15 LEU HA 3.231 2.597 3.865 2.814 2.781 2.829 . 0 0 "[ . 1 . 2]" 1
693 2 15 LEU H 2 15 LEU MD1 4.456 3.694 5.218 4.049 3.904 4.115 . 0 0 "[ . 1 . 2]" 1
694 2 15 LEU H 2 15 LEU MD2 2.445 . 3.060 2.337 2.222 2.444 . 0 0 "[ . 1 . 2]" 1
695 2 15 LEU H 2 15 LEU HG 3.801 3.178 4.424 3.944 3.887 4.021 . 0 0 "[ . 1 . 2]" 1
696 2 15 LEU H 2 16 LYS H 2.895 2.491 3.299 2.674 2.599 2.749 . 0 0 "[ . 1 . 2]" 1
697 2 15 LEU HA 2 15 LEU MD1 2.490 . 3.053 2.236 2.177 2.263 . 0 0 "[ . 1 . 2]" 1
698 2 15 LEU HA 2 15 LEU MD2 2.233 . 2.757 2.273 2.172 2.504 . 0 0 "[ . 1 . 2]" 1
699 2 15 LEU HA 2 16 LYS H 3.843 3.097 4.589 3.529 3.510 3.575 . 0 0 "[ . 1 . 2]" 1
700 2 15 LEU MD1 2 15 LEU HG 1.998 . 2.563 2.122 2.117 2.126 . 0 0 "[ . 1 . 2]" 1
701 2 15 LEU MD2 2 15 LEU HG 2.241 . 2.755 2.120 2.115 2.126 . 0 0 "[ . 1 . 2]" 1
702 2 15 LEU MD2 2 16 LYS H 4.526 3.628 5.424 4.270 4.191 4.356 . 0 0 "[ . 1 . 2]" 1
703 2 16 LYS H 2 16 LYS HA 2.868 2.240 3.496 2.879 2.822 2.949 . 0 0 "[ . 1 . 2]" 1
704 2 16 LYS H 2 17 ASN H 2.970 2.595 3.345 2.624 2.494 2.964 0.101 16 0 "[ . 1 . 2]" 1
705 2 16 LYS HA 2 16 LYS QG 3.598 2.848 4.348 2.810 2.515 3.038 0.333 8 0 "[ . 1 . 2]" 1
706 2 16 LYS HA 2 17 ASN H 3.413 2.937 3.889 3.378 2.885 3.594 0.052 15 0 "[ . 1 . 2]" 1
707 2 16 LYS QB 2 17 ASN H 4.111 3.390 4.832 3.017 2.358 3.874 1.032 17 11 "[ * **** * ***. + -]" 1
708 2 17 ASN H 2 17 ASN HA 3.525 2.879 4.171 2.933 2.852 2.953 0.027 17 0 "[ . 1 . 2]" 1
709 2 18 THR H 2 18 THR HA 2.645 2.047 3.243 2.915 2.872 2.936 . 0 0 "[ . 1 . 2]" 1
710 2 18 THR H 2 18 THR HB 2.775 2.448 3.102 2.759 2.566 3.001 . 0 0 "[ . 1 . 2]" 1
711 2 18 THR H 2 18 THR MG 3.983 3.540 4.426 3.893 3.773 3.987 . 0 0 "[ . 1 . 2]" 1
712 3 2 SER H 3 2 SER HB2 3.358 2.937 3.779 2.870 2.724 3.574 0.213 3 0 "[ . 1 . 2]" 1
713 3 2 SER H 3 2 SER HB3 3.513 3.088 3.938 3.488 2.730 3.662 0.358 2 0 "[ . 1 . 2]" 1
714 3 2 SER H 3 3 VAL MG2 4.008 3.552 4.464 3.955 3.561 4.167 . 0 0 "[ . 1 . 2]" 1
715 3 2 SER HA 3 2 SER HB3 2.770 2.151 3.389 2.404 2.340 3.043 . 0 0 "[ . 1 . 2]" 1
716 3 3 VAL H 3 3 VAL HB 2.512 . 3.133 2.540 2.478 2.619 . 0 0 "[ . 1 . 2]" 1
717 3 3 VAL H 3 3 VAL MG2 2.093 . 2.510 2.152 1.986 2.307 . 0 0 "[ . 1 . 2]" 1
718 3 3 VAL HA 3 3 VAL HB 3.062 2.659 3.465 3.026 3.023 3.030 . 0 0 "[ . 1 . 2]" 1
719 3 3 VAL HA 3 4 THR H 3.741 3.261 4.221 3.560 3.531 3.589 . 0 0 "[ . 1 . 2]" 1
720 3 3 VAL HB 3 4 THR H 2.218 . 2.692 2.340 2.081 2.501 . 0 0 "[ . 1 . 2]" 1
721 3 3 VAL HB 3 4 THR HG1 4.873 4.146 5.600 4.617 4.270 5.144 . 0 0 "[ . 1 . 2]" 1
722 3 3 VAL HB 3 5 ASP H 4.470 3.745 5.195 4.723 4.454 4.950 . 0 0 "[ . 1 . 2]" 1
723 3 3 VAL MG1 3 5 ASP H 4.051 3.554 4.548 4.422 4.164 4.574 0.026 14 0 "[ . 1 . 2]" 1
724 3 4 THR H 3 4 THR HG1 2.465 . 2.933 2.418 2.170 2.774 . 0 0 "[ . 1 . 2]" 1
725 3 4 THR HA 3 6 SER H 3.313 2.910 3.716 3.778 3.506 3.859 0.143 14 0 "[ . 1 . 2]" 1
726 3 4 THR HG1 3 5 ASP H 3.206 2.522 3.890 3.464 2.839 3.822 . 0 0 "[ . 1 . 2]" 1
727 3 4 THR HG1 3 5 ASP HA 3.727 3.019 4.435 3.876 3.648 4.042 . 0 0 "[ . 1 . 2]" 1
728 3 5 ASP H 3 5 ASP HA 2.676 2.196 3.156 2.793 2.762 2.831 . 0 0 "[ . 1 . 2]" 1
729 3 5 ASP HA 3 5 ASP HB2 2.363 . 2.812 2.487 2.381 2.994 0.182 8 0 "[ . 1 . 2]" 1
730 3 5 ASP HB3 3 6 SER H 2.707 2.098 3.316 2.601 2.363 3.707 0.391 9 0 "[ . 1 . 2]" 1
731 3 6 SER H 3 6 SER HA 2.766 2.162 3.370 2.781 2.756 2.808 . 0 0 "[ . 1 . 2]" 1
732 3 6 SER H 3 6 SER HB3 2.769 2.308 3.230 2.767 2.522 3.580 0.350 11 0 "[ . 1 . 2]" 1
733 3 6 SER H 3 7 GLN H 2.644 2.030 3.258 2.892 2.691 2.995 . 0 0 "[ . 1 . 2]" 1
734 3 6 SER H 3 7 GLN HB2 4.628 3.890 5.366 4.999 4.892 5.128 . 0 0 "[ . 1 . 2]" 1
735 3 6 SER HA 3 6 SER HB2 2.977 2.346 3.608 2.563 2.447 3.041 . 0 0 "[ . 1 . 2]" 1
736 3 7 GLN H 3 7 GLN HA 2.506 2.035 2.977 2.796 2.746 2.835 . 0 0 "[ . 1 . 2]" 1
737 3 7 GLN H 3 7 GLN HB2 2.259 . 2.699 2.502 2.454 2.603 . 0 0 "[ . 1 . 2]" 1
738 3 7 GLN H 3 7 GLN HB3 3.650 2.997 4.303 3.601 3.583 3.639 . 0 0 "[ . 1 . 2]" 1
739 3 7 GLN H 3 7 GLN HG2 4.238 3.544 4.932 3.799 3.755 3.857 . 0 0 "[ . 1 . 2]" 1
740 3 7 GLN H 3 7 GLN HG3 2.733 2.125 3.341 2.519 2.316 3.216 . 0 0 "[ . 1 . 2]" 1
741 3 7 GLN HA 3 7 GLN HB3 2.995 2.579 3.411 2.524 2.495 2.556 0.084 4 0 "[ . 1 . 2]" 1
742 3 7 GLN HA 3 7 GLN HG2 3.633 2.938 4.328 3.121 2.847 3.752 0.091 15 0 "[ . 1 . 2]" 1
743 3 7 GLN HA 3 7 GLN HG3 3.155 2.752 3.558 2.743 2.506 2.974 0.246 13 0 "[ . 1 . 2]" 1
744 3 8 LYS H 3 8 LYS HA 2.438 . 2.900 2.790 2.734 2.816 . 0 0 "[ . 1 . 2]" 1
745 3 9 ARG H 3 9 ARG HA 2.611 2.121 3.101 2.773 2.719 2.836 . 0 0 "[ . 1 . 2]" 1
746 3 9 ARG H 3 9 ARG QB 3.068 2.379 3.757 2.180 2.104 2.295 0.275 8 0 "[ . 1 . 2]" 1
747 3 9 ARG H 3 9 ARG HG3 3.995 3.326 4.664 4.444 4.180 4.595 . 0 0 "[ . 1 . 2]" 1
748 3 9 ARG H 3 10 ARG H 2.461 . 2.945 2.786 2.558 2.976 0.031 19 0 "[ . 1 . 2]" 1
749 3 9 ARG HA 3 9 ARG HG3 2.967 2.551 3.383 3.042 2.421 3.711 0.328 4 0 "[ . 1 . 2]" 1
750 3 9 ARG HA 3 12 ILE MD 2.866 2.190 3.542 2.828 2.451 3.261 . 0 0 "[ . 1 . 2]" 1
751 3 9 ARG HA 3 12 ILE MG 2.801 2.348 3.254 2.521 2.285 3.205 0.063 5 0 "[ . 1 . 2]" 1
752 3 9 ARG HG3 3 10 ARG H 4.340 3.600 5.080 4.763 4.154 5.089 0.009 5 0 "[ . 1 . 2]" 1
753 3 9 ARG HG3 3 13 LEU QD 3.939 3.093 4.785 3.688 2.149 4.928 0.944 10 3 "[ .- + . * 2]" 1
754 3 10 ARG H 3 10 ARG HA 2.463 . 3.067 2.802 2.779 2.837 . 0 0 "[ . 1 . 2]" 1
755 3 10 ARG H 3 11 GLU H 2.640 2.009 3.271 2.696 2.610 2.808 . 0 0 "[ . 1 . 2]" 1
756 3 11 GLU H 3 11 GLU HA 2.644 2.158 3.130 2.760 2.734 2.799 . 0 0 "[ . 1 . 2]" 1
757 3 11 GLU H 3 11 GLU HG2 4.377 3.699 5.055 4.557 4.352 4.624 . 0 0 "[ . 1 . 2]" 1
758 3 11 GLU H 3 11 GLU HG3 4.905 4.437 5.373 4.508 4.449 4.558 . 0 0 "[ . 1 . 2]" 1
759 3 11 GLU H 3 12 ILE H 2.957 2.552 3.362 2.864 2.765 3.032 . 0 0 "[ . 1 . 2]" 1
760 3 11 GLU H 3 12 ILE MG 3.902 3.421 4.383 4.052 3.914 4.240 . 0 0 "[ . 1 . 2]" 1
761 3 11 GLU HA 3 11 GLU HB2 2.903 2.218 3.588 2.488 2.377 2.583 . 0 0 "[ . 1 . 2]" 1
762 3 11 GLU HA 3 11 GLU HB3 3.363 2.691 4.035 3.024 3.007 3.036 . 0 0 "[ . 1 . 2]" 1
763 3 11 GLU HA 3 11 GLU HG2 3.914 3.483 4.345 3.646 2.677 3.842 0.806 3 1 "[ + . 1 . 2]" 1
764 3 11 GLU HA 3 11 GLU HG3 3.355 2.917 3.793 3.032 2.758 3.724 0.159 10 0 "[ . 1 . 2]" 1
765 3 11 GLU HA 3 12 ILE H 3.221 2.534 3.908 3.557 3.514 3.614 . 0 0 "[ . 1 . 2]" 1
766 3 11 GLU HA 3 12 ILE MG 4.390 3.688 5.092 4.924 4.873 4.992 . 0 0 "[ . 1 . 2]" 1
767 3 11 GLU HB2 3 12 ILE H 3.627 2.950 4.304 3.960 3.788 4.090 . 0 0 "[ . 1 . 2]" 1
768 3 11 GLU HB3 3 12 ILE H 3.391 2.899 3.883 2.777 2.721 2.834 0.178 6 0 "[ . 1 . 2]" 1
769 3 12 ILE H 3 12 ILE HA 3.042 2.633 3.451 2.827 2.797 2.851 . 0 0 "[ . 1 . 2]" 1
770 3 12 ILE H 3 12 ILE HB 3.854 3.150 4.558 3.661 3.631 3.684 . 0 0 "[ . 1 . 2]" 1
771 3 12 ILE H 3 12 ILE MD 3.562 3.153 3.971 3.800 3.624 3.971 0.000 10 0 "[ . 1 . 2]" 1
772 3 12 ILE H 3 12 ILE HG12 2.622 2.198 3.046 2.682 2.406 2.935 . 0 0 "[ . 1 . 2]" 1
773 3 12 ILE H 3 12 ILE HG13 3.661 2.962 4.360 3.882 3.679 4.044 . 0 0 "[ . 1 . 2]" 1
774 3 12 ILE H 3 12 ILE MG 2.482 . 3.164 1.995 1.959 2.040 . 0 0 "[ . 1 . 2]" 1
775 3 12 ILE HA 3 12 ILE MD 3.893 3.203 4.583 4.191 4.164 4.203 . 0 0 "[ . 1 . 2]" 1
776 3 12 ILE HA 3 12 ILE HG12 3.768 3.288 4.248 3.758 3.722 3.798 . 0 0 "[ . 1 . 2]" 1
777 3 12 ILE HA 3 12 ILE HG13 3.912 3.210 4.614 3.646 3.539 3.755 . 0 0 "[ . 1 . 2]" 1
778 3 12 ILE HA 3 12 ILE MG 2.633 2.029 3.237 2.523 2.398 2.635 . 0 0 "[ . 1 . 2]" 1
779 3 12 ILE HA 3 13 LEU H 3.094 2.415 3.773 3.495 3.431 3.526 . 0 0 "[ . 1 . 2]" 1
780 3 12 ILE HB 3 12 ILE MD 2.326 . 2.813 2.515 2.467 2.564 . 0 0 "[ . 1 . 2]" 1
781 3 12 ILE HB 3 12 ILE HG12 3.363 2.867 3.859 3.024 3.020 3.028 . 0 0 "[ . 1 . 2]" 1
782 3 12 ILE HB 3 12 ILE HG13 2.931 2.190 3.672 2.402 2.372 2.434 . 0 0 "[ . 1 . 2]" 1
783 3 12 ILE HB 3 12 ILE MG 2.010 . 2.473 2.119 2.113 2.124 . 0 0 "[ . 1 . 2]" 1
784 3 12 ILE MD 3 12 ILE HG12 1.951 . 2.450 2.122 2.118 2.125 . 0 0 "[ . 1 . 2]" 1
785 3 12 ILE MD 3 12 ILE HG13 1.876 . 2.344 2.117 2.114 2.119 . 0 0 "[ . 1 . 2]" 1
786 3 12 ILE HG12 3 12 ILE MG 2.221 . 2.827 2.482 2.421 2.541 . 0 0 "[ . 1 . 2]" 1
787 3 12 ILE HG12 3 13 LEU H 2.299 . 2.699 2.324 2.191 2.460 . 0 0 "[ . 1 . 2]" 1
788 3 12 ILE HG12 3 13 LEU QD . 2.170 2.784 1.890 1.761 2.149 0.409 18 0 "[ . 1 . 2]" 1
789 3 12 ILE HG12 3 14 SER H 4.330 3.854 4.806 4.832 4.692 4.914 0.108 5 0 "[ . 1 . 2]" 1
790 3 12 ILE HG13 3 13 LEU H 3.232 2.466 3.998 2.895 2.621 3.223 . 0 0 "[ . 1 . 2]" 1
791 3 12 ILE MG 3 13 LEU H 3.357 2.686 4.028 3.672 3.495 3.817 . 0 0 "[ . 1 . 2]" 1
792 3 12 ILE MG 3 13 LEU QD 3.738 3.262 4.214 3.651 3.436 3.849 . 0 0 "[ . 1 . 2]" 1
793 3 13 LEU H 3 13 LEU HA 2.812 2.392 3.232 2.847 2.784 2.899 . 0 0 "[ . 1 . 2]" 1
794 3 13 LEU H 3 13 LEU QD 3.168 2.730 3.606 2.254 1.869 2.584 0.861 5 7 "[*** + * 1 . - *]" 1
795 3 13 LEU H 3 14 SER H 2.790 2.376 3.204 2.539 2.351 2.694 0.025 12 0 "[ . 1 . 2]" 1
796 3 13 LEU QD 3 14 SER H 4.676 3.915 5.106 3.786 3.645 3.900 0.270 5 0 "[ . 1 . 2]" 1
797 3 13 LEU QD 3 16 ARG HA 4.896 4.094 5.698 5.306 4.948 5.774 0.076 15 0 "[ . 1 . 2]" 1
798 3 14 SER H 3 14 SER HA 2.775 2.280 3.270 2.781 2.744 2.828 . 0 0 "[ . 1 . 2]" 1
799 3 14 SER H 3 15 ARG H 3.276 2.820 3.732 2.776 2.653 2.849 0.167 14 0 "[ . 1 . 2]" 1
800 3 14 SER HA 3 15 ARG H 3.771 3.065 4.477 3.487 3.408 3.547 . 0 0 "[ . 1 . 2]" 1
801 3 15 ARG H 3 16 ARG H 3.005 2.341 3.669 2.942 2.537 3.446 . 0 0 "[ . 1 . 2]" 1
802 3 16 ARG H 3 16 ARG HA 3.121 2.691 3.551 2.944 2.925 2.955 . 0 0 "[ . 1 . 2]" 1
803 3 16 ARG H 3 19 TYR H 4.972 4.106 5.838 5.171 4.311 5.893 0.055 14 0 "[ . 1 . 2]" 1
804 3 19 TYR H 3 20 ARG H 3.201 2.443 3.959 2.710 2.605 2.851 . 0 0 "[ . 1 . 2]" 1
805 3 19 TYR H 3 22 ILE MD 4.185 3.688 4.682 4.663 4.338 4.885 0.203 20 0 "[ . 1 . 2]" 1
806 3 19 TYR HA 3 20 ARG H 3.460 2.962 3.958 3.544 3.513 3.578 . 0 0 "[ . 1 . 2]" 1
807 3 20 ARG H 3 20 ARG HA 3.260 2.803 3.717 2.799 2.774 2.825 0.029 9 0 "[ . 1 . 2]" 1
808 3 20 ARG H 3 20 ARG QB 2.536 . 3.152 2.259 2.136 2.461 . 0 0 "[ . 1 . 2]" 1
809 3 20 ARG H 3 21 LYS H 3.254 2.501 4.007 2.704 2.636 2.777 . 0 0 "[ . 1 . 2]" 1
810 3 21 LYS H 3 22 ILE H 3.291 2.548 4.034 2.869 2.736 3.008 . 0 0 "[ . 1 . 2]" 1
811 3 22 ILE MD 3 22 ILE MG 2.107 . 2.715 1.922 1.877 2.006 . 0 0 "[ . 1 . 2]" 1
812 3 22 ILE MG 3 23 LEU H 3.875 3.453 4.297 3.983 3.878 4.093 . 0 0 "[ . 1 . 2]" 1
813 3 23 LEU H 3 23 LEU HA 3.187 2.723 3.651 2.785 2.745 2.810 . 0 0 "[ . 1 . 2]" 1
814 3 23 LEU H 3 23 LEU QD 4.296 3.802 4.574 3.625 3.148 3.731 0.654 20 1 "[ . 1 . +]" 1
815 3 23 LEU H 3 24 ASN H 3.084 2.618 3.550 2.819 2.716 2.947 . 0 0 "[ . 1 . 2]" 1
816 3 23 LEU HA 3 24 ASN H 3.722 3.239 4.205 3.559 3.505 3.591 . 0 0 "[ . 1 . 2]" 1
817 3 23 LEU HA 3 26 LEU QD 3.543 2.800 4.286 3.848 3.031 4.137 . 0 0 "[ . 1 . 2]" 1
818 3 23 LEU QD 3 24 ASN H 4.072 3.586 4.558 3.728 3.478 3.906 0.108 11 0 "[ . 1 . 2]" 1
819 3 23 LEU HG 3 24 ASN H 3.455 3.001 3.909 3.930 3.398 4.229 0.320 20 0 "[ . 1 . 2]" 1
820 3 24 ASN H 3 24 ASN HA 3.147 2.450 3.844 2.827 2.781 2.846 . 0 0 "[ . 1 . 2]" 1
821 3 24 ASN H 3 25 ASP H 2.987 2.293 3.681 2.775 2.659 2.907 . 0 0 "[ . 1 . 2]" 1
822 3 26 LEU H 3 26 LEU HA 3.264 2.835 3.693 2.806 2.752 2.838 0.083 13 0 "[ . 1 . 2]" 1
823 3 26 LEU H 3 26 LEU QD . 3.938 4.601 3.649 3.509 3.757 0.429 8 0 "[ . 1 . 2]" 1
824 3 26 LEU H 3 26 LEU HG 4.422 3.961 4.883 4.495 4.334 4.572 . 0 0 "[ . 1 . 2]" 1
825 3 26 LEU H 3 27 SER H 2.970 2.281 3.659 2.735 2.571 2.938 . 0 0 "[ . 1 . 2]" 1
826 3 26 LEU H 3 28 SER H 3.923 3.220 4.626 4.184 3.945 4.440 . 0 0 "[ . 1 . 2]" 1
827 3 26 LEU QB 3 26 LEU QD 2.460 . 2.948 1.925 1.884 1.972 0.088 19 0 "[ . 1 . 2]" 1
828 3 26 LEU QB 3 27 SER H 4.320 3.860 4.780 2.701 2.539 2.795 1.321 20 20 [*****************-*+] 1
829 3 26 LEU QD 3 26 LEU HG 2.156 . 2.768 1.898 1.889 1.906 . 0 0 "[ . 1 . 2]" 1
830 3 26 LEU QD 3 27 SER H 4.740 3.963 5.510 4.028 3.846 4.148 0.117 4 0 "[ . 1 . 2]" 1
831 3 26 LEU HG 3 27 SER H 3.751 3.255 4.247 4.065 3.536 4.373 0.126 8 0 "[ . 1 . 2]" 1
832 3 27 SER H 3 27 SER HB2 3.954 3.259 4.649 3.587 3.521 3.641 . 0 0 "[ . 1 . 2]" 1
833 3 27 SER H 3 27 SER HB3 3.118 2.700 3.536 2.752 2.654 2.911 0.046 16 0 "[ . 1 . 2]" 1
834 3 27 SER HB3 3 28 SER H 4.251 3.550 4.952 4.324 4.100 4.564 . 0 0 "[ . 1 . 2]" 1
835 3 28 SER H 3 28 SER HA 2.718 2.227 3.209 2.769 2.296 2.945 . 0 0 "[ . 1 . 2]" 1
836 3 28 SER H 3 28 SER QB 2.439 . 2.896 2.442 2.176 2.987 0.091 4 0 "[ . 1 . 2]" 1
837 3 28 SER H 3 29 ASP H 2.767 2.137 3.397 2.951 2.431 3.233 . 0 0 "[ . 1 . 2]" 1
838 3 28 SER QB 3 29 ASP H 3.634 3.143 4.125 3.476 2.048 3.903 1.095 2 2 "[ + . 1 . - 2]" 1
839 3 29 ASP H 3 29 ASP HA 2.431 . 2.894 2.626 2.253 2.912 0.018 20 0 "[ . 1 . 2]" 1
840 3 29 ASP H 3 30 ALA H 2.463 2.005 2.921 2.754 2.267 3.074 0.153 11 0 "[ . 1 . 2]" 1
841 3 29 ASP H 3 30 ALA MB 4.153 3.673 4.633 4.158 3.463 4.709 0.210 12 0 "[ . 1 . 2]" 1
842 3 29 ASP HA 3 30 ALA H 2.591 2.124 3.058 2.498 2.277 2.844 . 0 0 "[ . 1 . 2]" 1
843 3 30 ALA H 3 30 ALA MB 1.996 . 2.410 2.336 2.255 2.569 0.159 19 0 "[ . 1 . 2]" 1
844 3 30 ALA HA 3 30 ALA MB 1.901 . 2.343 2.126 2.103 2.141 . 0 0 "[ . 1 . 2]" 1
845 3 32 GLY H 3 32 GLY HA2 3.260 2.597 3.923 2.802 2.556 2.965 0.041 18 0 "[ . 1 . 2]" 1
846 3 32 GLY H 3 32 GLY HA3 3.035 2.372 3.698 2.758 2.400 2.958 . 0 0 "[ . 1 . 2]" 1
847 3 32 GLY H 3 33 VAL H 3.578 3.107 4.049 3.330 2.971 4.268 0.219 6 0 "[ . 1 . 2]" 1
848 3 32 GLY H 3 33 VAL HB 3.404 2.919 3.889 3.906 3.555 4.176 0.287 2 0 "[ . 1 . 2]" 1
849 3 32 GLY H 3 33 VAL MG2 4.138 3.267 5.009 3.512 3.313 4.369 . 0 0 "[ . 1 . 2]" 1
850 3 33 VAL H 3 33 VAL HB 3.326 2.900 3.752 3.165 2.563 3.582 0.337 15 0 "[ . 1 . 2]" 1
851 3 33 VAL H 3 33 VAL MG1 4.579 3.776 5.382 3.974 3.711 4.172 0.065 15 0 "[ . 1 . 2]" 1
852 3 33 VAL H 3 33 VAL MG2 3.391 2.917 3.865 3.261 2.863 3.780 0.054 7 0 "[ . 1 . 2]" 1
853 3 33 VAL HA 3 33 VAL HB 3.384 2.607 4.161 3.015 2.944 3.038 . 0 0 "[ . 1 . 2]" 1
854 3 33 VAL HA 3 33 VAL MG1 3.425 2.651 4.199 2.667 2.591 2.838 0.060 8 0 "[ . 1 . 2]" 1
855 3 33 VAL HA 3 33 VAL MG2 2.755 2.311 3.199 2.277 2.191 2.312 0.120 2 0 "[ . 1 . 2]" 1
856 3 33 VAL HB 3 33 VAL MG1 2.611 2.170 3.052 2.140 2.135 2.153 0.035 19 0 "[ . 1 . 2]" 1
857 3 33 VAL HB 3 33 VAL MG2 2.610 2.173 3.047 2.129 2.121 2.133 0.052 15 0 "[ . 1 . 2]" 1
stop_
save_