NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
598649 |
2n0m   |
18636 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2n0m
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 2722
_Distance_constraint_stats_list.Viol_count 1057
_Distance_constraint_stats_list.Viol_total 3757.341
_Distance_constraint_stats_list.Viol_max 2.802
_Distance_constraint_stats_list.Viol_rms 0.1001
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0138
_Distance_constraint_stats_list.Viol_average_violations_only 0.3555
_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 2 THR 0.000 0.000 . 0 "[ . 1]"
1 3 ALA 5.594 2.802 1 3 "[+ - . *1]"
1 4 GLY 0.000 0.000 . 0 "[ . 1]"
1 5 ASN 0.000 0.000 . 0 "[ . 1]"
1 6 CYS 9.062 1.485 9 9 "[*****-* +*]"
1 7 ALA 0.000 0.000 . 0 "[ . 1]"
1 8 ALA 0.000 0.000 . 0 "[ . 1]"
1 9 THR 2.820 0.384 8 0 "[ . 1]"
1 10 VAL 8.467 1.114 10 1 "[ . +]"
1 11 GLU 2.364 0.701 6 1 "[ .+ 1]"
1 12 SER 7.806 1.764 3 6 "[ +*.*- **]"
1 13 ASN 7.966 0.971 8 5 "[ **-. +*1]"
1 14 ASP 0.834 0.239 3 0 "[ . 1]"
1 15 ASN 0.397 0.314 3 0 "[ . 1]"
1 16 MET 0.905 0.905 1 1 "[+ . 1]"
1 17 GLN 7.204 1.764 3 4 "[ +*. - *1]"
1 18 PHE 1.046 0.298 6 0 "[ . 1]"
1 19 ASN 1.555 0.347 6 0 "[ . 1]"
1 20 THR 1.162 0.393 2 0 "[ . 1]"
1 21 LYS 3.505 0.617 2 1 "[ + . 1]"
1 22 ASP 0.028 0.028 2 0 "[ . 1]"
1 23 ILE 6.549 0.518 3 2 "[ + . -1]"
1 24 GLN 6.960 0.422 5 0 "[ . 1]"
1 25 VAL 2.952 0.430 8 0 "[ . 1]"
1 26 SER 1.840 0.606 4 1 "[ +. 1]"
1 27 LYS 10.426 0.784 5 6 "[- **+ ** 1]"
1 28 ALA 2.058 0.491 2 0 "[ . 1]"
1 29 CYS 9.539 1.485 9 9 "[*****-* +*]"
1 30 LYS 0.000 0.000 . 0 "[ . 1]"
1 31 GLU 13.735 1.983 4 8 "[ -*+* ****]"
1 32 PHE 7.571 1.381 9 3 "[ - .* +1]"
1 33 THR 0.224 0.224 10 0 "[ . 1]"
1 34 ILE 3.797 0.422 5 0 "[ . 1]"
1 35 THR 1.381 0.329 7 0 "[ . 1]"
1 36 LEU 7.925 0.825 10 4 "[-* . * +]"
1 37 LYS 4.677 0.661 4 4 "[- +.* * 1]"
1 38 HIS 15.702 1.052 8 6 "[ **-.* +*1]"
1 39 THR 6.185 0.885 6 5 "[ **.+ *-1]"
1 40 GLY 23.196 2.179 2 9 [*+**.***-*]
1 41 THR 1.799 0.346 10 0 "[ . 1]"
1 42 GLN 1.878 0.346 10 0 "[ . 1]"
1 43 PRO 3.215 0.290 5 0 "[ . 1]"
1 44 LYS 3.126 0.339 8 0 "[ . 1]"
1 45 ALA 0.064 0.064 3 0 "[ . 1]"
1 46 SER 0.000 0.000 . 0 "[ . 1]"
1 47 MET 6.374 1.039 4 3 "[ *+. * 1]"
1 48 GLY 0.061 0.061 6 0 "[ . 1]"
1 49 HIS 1.695 0.725 3 1 "[ + . 1]"
1 50 ASN 6.671 0.731 9 2 "[ . * +1]"
1 51 LEU 4.940 0.551 7 1 "[ . + 1]"
1 52 VAL 0.539 0.284 5 0 "[ . 1]"
1 53 ILE 12.442 1.381 9 3 "[ * .* +1]"
1 54 ALA 0.334 0.128 8 0 "[ . 1]"
1 55 LYS 25.994 1.937 6 10 [**-**+****]
1 56 ALA 5.362 0.700 2 3 "[ +* . * 1]"
1 57 GLU 4.886 0.940 5 5 "[- *+* * 1]"
1 58 ASP 7.011 0.940 5 5 "[* -*+ * 1]"
1 59 MET 14.109 1.459 7 10 [**-***+***]
1 60 ASP 0.105 0.105 8 0 "[ . 1]"
1 61 GLY 4.788 0.907 7 3 "[- . + *1]"
1 62 VAL 0.920 0.243 1 0 "[ . 1]"
1 63 PHE 3.025 0.481 9 0 "[ . 1]"
1 64 LYS 1.099 0.313 4 0 "[ . 1]"
1 65 ASP 3.219 0.482 1 0 "[ . 1]"
1 66 GLY 0.324 0.324 4 0 "[ . 1]"
1 67 VAL 5.245 0.821 5 5 "[ *- +* *]"
1 68 GLY 0.106 0.106 5 0 "[ . 1]"
1 69 ALA 9.475 1.406 4 8 "[* -+*****1]"
1 70 ALA 1.315 1.315 7 1 "[ . + 1]"
1 71 ASP 0.000 0.000 . 0 "[ . 1]"
1 72 THR 3.599 0.715 3 3 "[ *+ . -]"
1 73 ASP 1.704 0.666 2 2 "[ + . -]"
1 74 TYR 12.648 1.919 7 10 [**-***+***]
1 75 VAL 29.390 1.798 9 9 [**-*****+1]
1 76 LYS 12.501 1.520 9 7 "[ ***-** +1]"
1 77 PRO 10.415 1.406 4 5 "[ **+.* -]"
1 78 ASP 3.109 0.886 7 2 "[ . + -1]"
1 79 ASP 19.482 1.798 9 8 "[****- **+1]"
1 80 ALA 0.815 0.585 5 1 "[ + 1]"
1 81 ARG 0.556 0.313 4 0 "[ . 1]"
1 82 VAL 5.254 1.157 1 3 "[+ -. *1]"
1 83 VAL 22.031 1.937 6 10 [*****+**-*]
1 84 ALA 3.952 1.057 5 3 "[ + -*]"
1 85 HIS 5.301 1.057 5 4 "[ * +* -]"
1 86 THR 10.216 0.545 1 1 "[+ . 1]"
1 87 LYS 0.379 0.237 6 0 "[ . 1]"
1 88 LEU 5.654 1.919 7 3 "[ * . + -]"
1 89 ILE 2.474 0.463 5 0 "[ . 1]"
1 90 GLY 0.960 0.339 8 0 "[ . 1]"
1 91 GLY 0.000 0.000 . 0 "[ . 1]"
1 92 GLY 2.616 0.711 6 3 "[ - .+ *1]"
1 93 GLU 21.459 2.179 2 9 [*+**.*****]
1 94 GLU 5.443 0.886 6 3 "[ *.+ *]"
1 95 SER 1.968 0.661 4 2 "[ +.- 1]"
1 96 SER 5.418 0.618 2 1 "[ + . 1]"
1 97 LEU 11.576 0.615 3 4 "[* + .* -]"
1 98 THR 15.573 1.983 4 8 "[ -*+* ****]"
1 99 LEU 5.225 1.242 4 1 "[ +. 1]"
1 100 ASP 8.052 1.364 2 3 "[ + . -*]"
1 101 PRO 11.691 1.472 9 6 "[- ****+1]"
1 102 ALA 10.468 1.320 2 9 "[*+***-** *]"
1 103 LYS 7.894 1.373 6 6 "[* *+***1]"
1 104 LEU 21.295 1.472 9 6 "[* *-**+1]"
1 105 ALA 9.678 1.320 2 8 "[*+****- *]"
1 106 ASP 0.194 0.083 4 0 "[ . 1]"
1 107 GLY 3.073 0.576 4 2 "[ +. -]"
1 108 ASP 7.788 1.492 4 4 "[ -*+. * 1]"
1 109 TYR 19.066 0.929 2 6 "[ +**. * -*]"
1 110 LYS 15.666 2.236 10 7 "[*-* ** *+]"
1 111 PHE 9.528 1.953 10 4 "[* .- *+]"
1 112 ALA 2.738 0.481 9 0 "[ . 1]"
1 113 CYS 5.451 0.640 1 7 "[+****-* 1]"
1 114 THR 12.176 1.459 7 10 [**-***+***]
1 115 PHE 0.000 0.000 . 0 "[ . 1]"
1 116 PRO 0.000 0.000 . 0 "[ . 1]"
1 117 GLY 0.000 0.000 . 0 "[ . 1]"
1 118 HIS 4.602 1.039 4 3 "[* +. * 1]"
1 119 GLY 1.151 0.510 5 1 "[ + 1]"
1 120 ALA 1.025 0.670 7 1 "[ . + 1]"
1 121 LEU 1.533 0.670 7 1 "[ . + 1]"
1 122 MET 1.380 0.298 6 0 "[ . 1]"
1 123 ASN 6.396 0.617 2 3 "[ + - *]"
1 124 GLY 10.177 1.443 10 8 "[*****-* +]"
1 125 LYS 12.769 2.236 10 7 "[* ***- *+]"
1 126 VAL 1.261 0.955 6 1 "[ .+ 1]"
1 127 THR 4.612 0.929 2 2 "[ +- . 1]"
1 128 LEU 15.292 1.320 2 9 "[*+***** -*]"
1 129 VAL 1.376 0.777 8 1 "[ . + 1]"
1 130 ASP 9.075 2.802 1 3 "[+ - . *1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 THR HB 1 2 THR MG 3.119 . 4.335 2.138 2.135 2.143 . 0 0 "[ . 1]" 1
2 1 2 THR HB 1 129 VAL MG2 4.154 . 6.311 4.588 3.142 5.679 . 0 0 "[ . 1]" 1
3 1 2 THR MG 1 129 VAL MG2 3.657 . 5.329 3.825 2.691 5.282 . 0 0 "[ . 1]" 1
4 1 3 ALA H 1 3 ALA MB 4.373 . 6.764 2.537 2.285 2.976 . 0 0 "[ . 1]" 1
5 1 3 ALA HA 1 3 ALA MB 2.774 . 3.736 2.130 2.123 2.134 . 0 0 "[ . 1]" 1
6 1 3 ALA HA 1 4 GLY H 3.722 . 5.454 3.164 2.776 3.443 . 0 0 "[ . 1]" 1
7 1 3 ALA MB 1 4 GLY H 4.516 . 7.065 3.372 3.024 3.701 . 0 0 "[ . 1]" 1
8 1 3 ALA MB 1 130 ASP H 4.058 . 6.116 5.554 3.412 8.918 2.802 1 3 "[+ - . *1]" 1
9 1 4 GLY QA 1 5 ASN H 3.537 . 5.101 2.742 2.586 2.904 . 0 0 "[ . 1]" 1
10 1 5 ASN H 1 5 ASN QB 3.519 . 5.067 2.724 2.376 3.343 . 0 0 "[ . 1]" 1
11 1 5 ASN HA 1 6 CYS HB3 4.094 . 6.189 5.719 5.584 5.791 . 0 0 "[ . 1]" 1
12 1 5 ASN QB 1 5 ASN HD21 2.978 . 4.087 2.308 2.155 2.782 . 0 0 "[ . 1]" 1
13 1 5 ASN QB 1 5 ASN HD22 3.364 . 4.778 3.305 3.215 3.478 . 0 0 "[ . 1]" 1
14 1 5 ASN QB 1 7 ALA H 3.227 . 4.528 3.304 2.795 3.972 . 0 0 "[ . 1]" 1
15 1 6 CYS HA 1 7 ALA H 2.848 . 3.862 3.269 3.072 3.398 . 0 0 "[ . 1]" 1
16 1 6 CYS HA 1 32 PHE QD 2.884 . 3.924 2.395 2.279 2.539 . 0 0 "[ . 1]" 1
17 1 6 CYS HA 1 32 PHE QE 2.933 . 4.009 3.361 3.128 3.651 . 0 0 "[ . 1]" 1
18 1 6 CYS HB2 1 29 CYS QB 3.689 . 5.390 4.597 4.384 4.833 . 0 0 "[ . 1]" 1
19 1 6 CYS HB2 1 32 PHE HA 3.472 . 4.978 4.939 4.487 5.288 0.310 7 0 "[ . 1]" 1
20 1 6 CYS HB3 1 7 ALA H 4.002 . 6.004 4.243 4.083 4.413 . 0 0 "[ . 1]" 1
21 1 6 CYS HB3 1 29 CYS QB 3.191 . 4.464 3.303 3.056 3.576 . 0 0 "[ . 1]" 1
22 1 6 CYS HB3 1 31 GLU H 4.458 . 6.942 4.536 3.941 5.091 . 0 0 "[ . 1]" 1
23 1 6 CYS HB3 1 32 PHE HA 3.223 . 4.521 3.655 3.045 4.035 . 0 0 "[ . 1]" 1
24 1 6 CYS HB3 1 32 PHE QD 3.701 . 5.413 4.406 4.185 4.623 . 0 0 "[ . 1]" 1
25 1 6 CYS HB3 1 33 THR H 3.567 . 5.158 4.373 3.982 4.631 . 0 0 "[ . 1]" 1
26 1 6 CYS SG 1 29 CYS SG 2.020 . 2.120 2.943 2.618 3.605 1.485 9 9 "[*****-* +*]" 1
27 1 7 ALA H 1 7 ALA HA 2.765 . 3.720 2.896 2.885 2.909 . 0 0 "[ . 1]" 1
28 1 7 ALA H 1 7 ALA MB 2.409 . 3.134 2.696 2.660 2.736 . 0 0 "[ . 1]" 1
29 1 7 ALA H 1 8 ALA H 3.210 . 4.498 4.318 4.272 4.354 . 0 0 "[ . 1]" 1
30 1 7 ALA H 1 8 ALA MB 3.810 . 5.624 4.459 4.319 4.629 . 0 0 "[ . 1]" 1
31 1 7 ALA H 1 32 PHE HA 4.303 . 6.617 4.993 4.718 5.309 . 0 0 "[ . 1]" 1
32 1 7 ALA H 1 32 PHE QD 3.341 . 4.736 4.384 4.198 4.683 . 0 0 "[ . 1]" 1
33 1 7 ALA H 1 33 THR H 3.565 . 5.153 4.490 4.352 4.681 . 0 0 "[ . 1]" 1
34 1 7 ALA HA 1 7 ALA MB 2.413 . 3.141 2.132 2.131 2.133 . 0 0 "[ . 1]" 1
35 1 7 ALA HA 1 8 ALA H 2.306 . 2.971 2.275 2.221 2.337 . 0 0 "[ . 1]" 1
36 1 7 ALA HA 1 8 ALA MB 3.701 . 5.413 3.888 3.862 3.908 . 0 0 "[ . 1]" 1
37 1 7 ALA HA 1 32 PHE HA 3.482 . 4.998 3.671 3.526 3.825 . 0 0 "[ . 1]" 1
38 1 7 ALA HA 1 32 PHE HA 3.289 . 4.641 3.939 3.715 4.204 . 0 0 "[ . 1]" 1
39 1 7 ALA HA 1 33 THR H 2.631 . 3.496 2.381 2.282 2.487 . 0 0 "[ . 1]" 1
40 1 7 ALA HA 1 33 THR HB 3.117 . 4.332 3.084 2.897 3.295 . 0 0 "[ . 1]" 1
41 1 7 ALA HA 1 34 ILE HA 3.086 . 4.276 4.155 4.078 4.200 . 0 0 "[ . 1]" 1
42 1 7 ALA MB 1 8 ALA H 2.491 . 3.267 2.641 2.487 2.776 . 0 0 "[ . 1]" 1
43 1 7 ALA MB 1 8 ALA MB 3.244 . 4.560 3.510 3.291 3.749 . 0 0 "[ . 1]" 1
44 1 8 ALA H 1 8 ALA MB 2.623 . 3.483 2.645 2.557 2.675 . 0 0 "[ . 1]" 1
45 1 8 ALA H 1 9 THR H 3.576 . 5.175 4.336 4.287 4.390 . 0 0 "[ . 1]" 1
46 1 8 ALA H 1 9 THR H 3.123 . 4.342 3.408 3.246 3.542 . 0 0 "[ . 1]" 1
47 1 8 ALA H 1 33 THR H 3.369 . 4.788 4.198 4.097 4.290 . 0 0 "[ . 1]" 1
48 1 8 ALA H 1 33 THR HA 4.042 . 6.085 5.123 5.043 5.188 . 0 0 "[ . 1]" 1
49 1 8 ALA H 1 33 THR HB 3.879 . 5.760 4.163 3.911 4.346 . 0 0 "[ . 1]" 1
50 1 8 ALA H 1 34 ILE HG12 3.604 . 5.228 3.701 3.431 3.911 . 0 0 "[ . 1]" 1
51 1 8 ALA H 1 34 ILE HG13 3.762 . 5.531 4.457 4.259 4.674 . 0 0 "[ . 1]" 1
52 1 8 ALA H 1 34 ILE MG 3.480 . 4.994 4.160 4.058 4.322 . 0 0 "[ . 1]" 1
53 1 8 ALA H 1 35 THR H 3.279 . 4.623 3.567 3.359 3.743 . 0 0 "[ . 1]" 1
54 1 8 ALA HA 1 8 ALA MB 2.254 . 2.889 2.130 2.126 2.132 . 0 0 "[ . 1]" 1
55 1 8 ALA HA 1 9 THR H 2.265 . 2.906 2.249 2.193 2.342 . 0 0 "[ . 1]" 1
56 1 8 ALA MB 1 9 THR H 2.588 . 3.425 2.749 2.539 2.865 . 0 0 "[ . 1]" 1
57 1 8 ALA MB 1 9 THR HB 3.727 . 5.463 4.999 4.866 5.129 . 0 0 "[ . 1]" 1
58 1 8 ALA MB 1 23 ILE MD 3.707 . 5.425 3.561 3.384 3.709 . 0 0 "[ . 1]" 1
59 1 8 ALA MB 1 23 ILE MD 3.258 . 4.585 3.472 3.331 3.595 . 0 0 "[ . 1]" 1
60 1 8 ALA MB 1 23 ILE MG 2.708 . 3.625 2.935 2.759 3.179 . 0 0 "[ . 1]" 1
61 1 8 ALA MB 1 23 ILE MG 2.675 . 3.569 2.639 2.548 2.755 . 0 0 "[ . 1]" 1
62 1 8 ALA MB 1 24 GLN H 3.816 . 5.636 4.648 4.154 5.083 . 0 0 "[ . 1]" 1
63 1 8 ALA MB 1 32 PHE QD 3.693 . 5.398 4.310 4.165 4.541 . 0 0 "[ . 1]" 1
64 1 8 ALA MB 1 32 PHE QE 2.442 . 3.187 2.597 2.407 2.873 . 0 0 "[ . 1]" 1
65 1 8 ALA MB 1 32 PHE HZ 2.278 . 2.927 2.265 2.099 2.360 . 0 0 "[ . 1]" 1
66 1 8 ALA MB 1 33 THR H 4.200 . 6.405 5.379 5.297 5.423 . 0 0 "[ . 1]" 1
67 1 8 ALA MB 1 34 ILE HG12 3.084 . 4.273 2.461 2.307 2.582 . 0 0 "[ . 1]" 1
68 1 8 ALA MB 1 34 ILE HG12 3.126 . 4.348 2.611 2.392 2.799 . 0 0 "[ . 1]" 1
69 1 8 ALA MB 1 35 THR H 3.285 . 4.634 4.088 3.882 4.223 . 0 0 "[ . 1]" 1
70 1 9 THR H 1 9 THR HA 2.829 . 3.829 2.939 2.935 2.947 . 0 0 "[ . 1]" 1
71 1 9 THR H 1 9 THR HB 2.645 . 3.520 2.713 2.589 3.096 . 0 0 "[ . 1]" 1
72 1 9 THR H 1 9 THR MG 3.129 . 4.353 3.683 2.065 3.902 . 0 0 "[ . 1]" 1
73 1 9 THR H 1 10 VAL H 3.216 . 4.509 4.339 4.249 4.404 . 0 0 "[ . 1]" 1
74 1 9 THR H 1 10 VAL QG 3.986 . 5.972 4.176 4.032 4.849 . 0 0 "[ . 1]" 1
75 1 9 THR HA 1 9 THR HB 2.914 . 3.975 2.493 2.212 2.621 . 0 0 "[ . 1]" 1
76 1 9 THR HA 1 9 THR MG 2.496 . 3.275 2.439 2.305 3.218 . 0 0 "[ . 1]" 1
77 1 9 THR HA 1 10 VAL H 2.319 . 2.991 2.135 2.113 2.176 . 0 0 "[ . 1]" 1
78 1 9 THR HA 1 10 VAL HB 3.159 . 4.406 4.605 4.552 4.653 0.247 7 0 "[ . 1]" 1
79 1 9 THR HA 1 10 VAL QG 3.783 . 5.572 3.562 3.413 3.625 . 0 0 "[ . 1]" 1
80 1 9 THR HA 1 34 ILE MG 3.305 . 4.671 3.782 3.549 4.118 . 0 0 "[ . 1]" 1
81 1 9 THR HA 1 35 THR H 2.816 . 3.807 2.636 2.458 2.808 . 0 0 "[ . 1]" 1
82 1 9 THR HA 1 35 THR HB 2.911 . 3.970 2.692 2.554 2.876 . 0 0 "[ . 1]" 1
83 1 9 THR HB 1 9 THR MG 2.262 . 2.902 2.135 2.128 2.137 . 0 0 "[ . 1]" 1
84 1 9 THR HB 1 10 VAL H 3.608 . 5.235 4.142 4.031 4.241 . 0 0 "[ . 1]" 1
85 1 9 THR HB 1 10 VAL H 3.195 . 4.471 3.612 3.555 3.712 . 0 0 "[ . 1]" 1
86 1 9 THR MG 1 10 VAL H 2.584 . 3.419 2.785 2.437 3.681 0.262 2 0 "[ . 1]" 1
87 1 9 THR MG 1 10 VAL QG 3.519 . 5.067 3.121 2.887 3.530 . 0 0 "[ . 1]" 1
88 1 9 THR MG 1 11 GLU QG 3.464 . 4.964 3.444 2.613 5.348 0.384 8 0 "[ . 1]" 1
89 1 9 THR MG 1 35 THR H 2.817 . 3.809 3.535 3.455 3.735 . 0 0 "[ . 1]" 1
90 1 10 VAL H 1 10 VAL HB 2.682 . 3.581 2.696 2.583 3.345 . 0 0 "[ . 1]" 1
91 1 10 VAL H 1 10 VAL QG 2.850 . 3.865 2.588 2.180 2.716 . 0 0 "[ . 1]" 1
92 1 10 VAL H 1 11 GLU H 3.984 . 5.969 4.357 4.303 4.467 . 0 0 "[ . 1]" 1
93 1 10 VAL H 1 34 ILE MG 3.177 . 4.439 3.520 3.342 3.739 . 0 0 "[ . 1]" 1
94 1 10 VAL H 1 35 THR H 3.328 . 4.712 3.690 3.473 3.811 . 0 0 "[ . 1]" 1
95 1 10 VAL H 1 35 THR HB 3.497 . 5.025 3.984 3.857 4.107 . 0 0 "[ . 1]" 1
96 1 10 VAL H 1 36 LEU HA 2.967 . 4.067 2.906 2.767 3.022 . 0 0 "[ . 1]" 1
97 1 10 VAL H 1 36 LEU HB2 4.243 . 6.493 4.787 4.614 4.880 . 0 0 "[ . 1]" 1
98 1 10 VAL H 1 36 LEU QD 3.560 . 5.144 3.779 3.588 3.921 . 0 0 "[ . 1]" 1
99 1 10 VAL H 1 37 LYS H 3.515 . 5.059 3.873 3.704 4.156 . 0 0 "[ . 1]" 1
100 1 10 VAL H 1 51 LEU QD 4.055 . 6.111 4.551 4.409 4.786 . 0 0 "[ . 1]" 1
101 1 10 VAL H 1 86 THR MG 3.952 . 5.905 6.267 6.130 6.348 0.443 3 0 "[ . 1]" 1
102 1 10 VAL HA 1 10 VAL QG 2.722 . 3.648 2.165 2.135 2.382 . 0 0 "[ . 1]" 1
103 1 10 VAL HA 1 11 GLU H 2.354 . 3.047 2.166 2.117 2.230 . 0 0 "[ . 1]" 1
104 1 10 VAL HA 1 11 GLU QG 4.192 . 6.388 4.065 3.541 5.751 . 0 0 "[ . 1]" 1
105 1 10 VAL HA 1 19 ASN H 3.843 . 5.689 4.511 3.910 4.840 . 0 0 "[ . 1]" 1
106 1 10 VAL HA 1 19 ASN QD 4.153 . 5.715 4.404 2.967 5.584 . 0 0 "[ . 1]" 1
107 1 10 VAL HA 1 20 THR MG 3.445 . 4.928 3.332 3.073 3.729 . 0 0 "[ . 1]" 1
108 1 10 VAL HB 1 11 GLU H 3.474 . 4.983 4.118 3.979 4.239 . 0 0 "[ . 1]" 1
109 1 10 VAL HB 1 12 SER H 4.079 . 6.158 6.065 5.683 7.272 1.114 10 1 "[ . +]" 1
110 1 10 VAL HB 1 36 LEU HA 3.181 . 4.446 3.162 2.838 5.029 0.583 10 1 "[ . +]" 1
111 1 10 VAL HB 1 36 LEU QD 2.566 . 3.389 2.553 2.158 4.214 0.825 10 1 "[ . +]" 1
112 1 10 VAL HB 1 37 LYS H 4.090 . 6.181 4.432 4.116 5.891 . 0 0 "[ . 1]" 1
113 1 10 VAL HB 1 51 LEU QD 2.961 . 4.057 2.869 2.564 3.776 . 0 0 "[ . 1]" 1
114 1 10 VAL MG1 1 10 VAL MG2 2.350 . 3.040 2.087 2.081 2.089 . 0 0 "[ . 1]" 1
115 1 10 VAL QG 1 11 GLU H 2.703 . 3.616 2.563 2.351 2.759 . 0 0 "[ . 1]" 1
116 1 10 VAL QG 1 12 SER H 4.117 . 6.236 4.276 4.101 4.479 . 0 0 "[ . 1]" 1
117 1 10 VAL QG 1 18 PHE H 4.413 . 6.847 5.222 4.944 5.392 . 0 0 "[ . 1]" 1
118 1 10 VAL QG 1 18 PHE HA 3.776 . 5.559 3.449 3.294 3.626 . 0 0 "[ . 1]" 1
119 1 10 VAL QG 1 18 PHE HB2 3.301 . 4.663 3.872 3.403 4.094 . 0 0 "[ . 1]" 1
120 1 10 VAL QG 1 18 PHE HB3 3.593 . 5.207 2.542 2.100 2.765 . 0 0 "[ . 1]" 1
121 1 10 VAL QG 1 18 PHE QR 2.470 . 3.233 2.399 2.279 2.549 . 0 0 "[ . 1]" 1
122 1 10 VAL QG 1 18 PHE QD 2.864 . 3.890 2.338 2.220 2.473 . 0 0 "[ . 1]" 1
123 1 10 VAL QG 1 19 ASN H 3.075 . 4.257 2.820 2.430 3.270 . 0 0 "[ . 1]" 1
124 1 10 VAL QG 1 19 ASN QD 4.562 . 7.164 4.505 3.738 5.258 . 0 0 "[ . 1]" 1
125 1 10 VAL QG 1 20 THR H 3.184 . 4.451 3.041 2.700 3.327 . 0 0 "[ . 1]" 1
126 1 10 VAL QG 1 20 THR HB 3.610 . 5.239 3.971 3.500 4.228 . 0 0 "[ . 1]" 1
127 1 10 VAL QG 1 20 THR MG 2.563 . 3.329 2.083 1.935 2.170 . 0 0 "[ . 1]" 1
128 1 10 VAL QG 1 20 THR MG 2.840 . 3.848 2.081 1.934 2.167 . 0 0 "[ . 1]" 1
129 1 10 VAL QG 1 23 ILE MD 2.738 . 3.675 2.130 1.940 2.700 0.053 9 0 "[ . 1]" 1
130 1 10 VAL QG 1 111 PHE QE 4.231 . 6.468 2.764 2.447 2.900 . 0 0 "[ . 1]" 1
131 1 10 VAL QG 1 34 ILE MG 2.555 . 3.371 2.355 2.186 2.535 . 0 0 "[ . 1]" 1
132 1 10 VAL QG 1 36 LEU HA 3.816 . 5.636 3.528 2.307 3.773 . 0 0 "[ . 1]" 1
133 1 10 VAL QG 1 37 LYS H 4.192 . 6.389 4.091 3.391 4.250 . 0 0 "[ . 1]" 1
134 1 10 VAL QG 1 51 LEU QD 2.627 . 3.490 2.109 1.941 2.235 . 0 0 "[ . 1]" 1
135 1 10 VAL QG 1 51 LEU HG 3.452 . 4.942 4.215 4.075 4.326 . 0 0 "[ . 1]" 1
136 1 10 VAL QG 1 111 PHE QD 4.623 . 5.273 4.030 3.793 4.205 . 0 0 "[ . 1]" 1
137 1 10 VAL QG 1 111 PHE QE 4.534 . 7.103 3.360 3.192 3.618 . 0 0 "[ . 1]" 1
138 1 10 VAL QG 1 111 PHE HZ 3.950 . 5.901 4.213 3.959 4.520 . 0 0 "[ . 1]" 1
139 1 11 GLU H 1 11 GLU HB2 2.879 . 3.915 2.662 2.501 2.920 . 0 0 "[ . 1]" 1
140 1 11 GLU H 1 11 GLU HB3 3.009 . 4.141 3.455 2.450 3.743 . 0 0 "[ . 1]" 1
141 1 11 GLU H 1 11 GLU QG 3.158 . 4.405 2.852 2.076 4.007 . 0 0 "[ . 1]" 1
142 1 11 GLU H 1 12 SER H 3.914 . 5.829 4.456 4.368 4.540 . 0 0 "[ . 1]" 1
143 1 11 GLU H 1 19 ASN H 3.245 . 4.562 3.175 2.860 3.615 . 0 0 "[ . 1]" 1
144 1 11 GLU H 1 19 ASN QB 3.959 . 5.918 2.633 1.646 3.562 0.347 6 0 "[ . 1]" 1
145 1 11 GLU H 1 19 ASN QD 3.419 . 4.881 3.415 2.874 4.034 . 0 0 "[ . 1]" 1
146 1 11 GLU H 1 20 THR H 4.122 . 6.246 4.749 4.396 5.398 . 0 0 "[ . 1]" 1
147 1 11 GLU H 1 20 THR MG 3.539 . 5.104 4.114 3.718 4.549 . 0 0 "[ . 1]" 1
148 1 11 GLU H 1 37 LYS H 3.735 . 5.479 4.625 4.564 4.715 . 0 0 "[ . 1]" 1
149 1 11 GLU H 1 51 LEU QD 4.596 . 7.236 5.743 5.523 6.081 . 0 0 "[ . 1]" 1
150 1 11 GLU HA 1 11 GLU QG 2.870 . 3.899 2.567 2.443 3.243 . 0 0 "[ . 1]" 1
151 1 11 GLU HA 1 12 SER H 2.548 . 3.359 2.171 2.129 2.215 . 0 0 "[ . 1]" 1
152 1 11 GLU HA 1 19 ASN H 3.594 . 5.209 4.979 4.695 5.245 0.036 2 0 "[ . 1]" 1
153 1 11 GLU HA 1 19 ASN QD 4.806 . 7.693 4.990 4.520 5.322 . 0 0 "[ . 1]" 1
154 1 11 GLU HA 1 36 LEU QD 3.739 . 5.487 3.412 3.002 3.793 . 0 0 "[ . 1]" 1
155 1 11 GLU HA 1 37 LYS HB3 3.623 . 5.264 3.677 2.790 4.404 . 0 0 "[ . 1]" 1
156 1 11 GLU HB2 1 12 SER H 3.236 . 4.545 4.020 3.694 4.210 . 0 0 "[ . 1]" 1
157 1 11 GLU HB2 1 19 ASN H 3.540 . 5.107 4.127 3.571 5.341 0.234 8 0 "[ . 1]" 1
158 1 11 GLU HB2 1 19 ASN QB 3.615 . 4.854 2.986 2.137 4.170 . 0 0 "[ . 1]" 1
159 1 11 GLU HB2 1 19 ASN QD 3.616 . 5.214 2.885 2.225 3.836 . 0 0 "[ . 1]" 1
160 1 11 GLU HB3 1 19 ASN QB 3.693 . 5.397 3.220 1.944 3.911 0.045 8 0 "[ . 1]" 1
161 1 11 GLU HB3 1 37 LYS HB3 3.408 . 4.860 3.204 1.979 4.203 . 0 0 "[ . 1]" 1
162 1 11 GLU HB3 1 12 SER H 2.967 . 4.067 3.283 2.911 4.217 0.150 8 0 "[ . 1]" 1
163 1 11 GLU HB3 1 13 ASN H 4.937 . 7.984 5.738 5.485 6.180 . 0 0 "[ . 1]" 1
164 1 11 GLU HB3 1 19 ASN QB 3.958 . 5.916 3.903 1.952 5.046 0.048 8 0 "[ . 1]" 1
165 1 11 GLU HB3 1 19 ASN QD 3.683 . 5.379 3.671 1.857 4.631 0.130 10 0 "[ . 1]" 1
166 1 11 GLU HB3 1 39 THR H 4.118 . 6.238 4.317 3.484 5.828 . 0 0 "[ . 1]" 1
167 1 11 GLU QG 1 19 ASN QD 3.349 . 4.751 3.050 2.655 3.765 . 0 0 "[ . 1]" 1
168 1 11 GLU QG 1 37 LYS HB3 3.879 . 5.760 3.360 1.988 5.202 0.010 4 0 "[ . 1]" 1
169 1 11 GLU QG 1 39 THR MG 3.286 . 4.636 3.652 2.361 5.337 0.701 6 1 "[ .+ 1]" 1
170 1 12 SER H 1 12 SER HA 2.327 . 3.004 2.939 2.928 2.944 . 0 0 "[ . 1]" 1
171 1 12 SER H 1 12 SER QB 3.701 . 5.413 3.013 2.632 3.115 . 0 0 "[ . 1]" 1
172 1 12 SER H 1 13 ASN H 3.769 . 5.545 4.392 4.339 4.424 . 0 0 "[ . 1]" 1
173 1 12 SER H 1 36 LEU QD 3.397 . 4.839 3.458 3.210 3.882 . 0 0 "[ . 1]" 1
174 1 12 SER H 1 89 ILE MD 4.118 . 6.238 3.961 3.685 4.100 . 0 0 "[ . 1]" 1
175 1 12 SER H 1 38 HIS HA 2.690 . 3.595 2.658 2.568 2.760 . 0 0 "[ . 1]" 1
176 1 12 SER H 1 39 THR H 3.366 . 4.783 3.173 2.905 3.450 . 0 0 "[ . 1]" 1
177 1 12 SER H 1 39 THR MG 3.405 . 4.854 4.177 3.817 5.739 0.885 6 1 "[ .+ 1]" 1
178 1 12 SER H 1 89 ILE MD 4.479 . 6.987 4.910 4.604 5.181 . 0 0 "[ . 1]" 1
179 1 12 SER HA 1 12 SER QB 3.023 . 4.166 2.216 2.193 2.399 . 0 0 "[ . 1]" 1
180 1 12 SER HA 1 13 ASN H 2.605 . 3.453 2.228 2.209 2.241 . 0 0 "[ . 1]" 1
181 1 12 SER HA 1 17 GLN H 4.353 . 6.721 4.361 4.160 4.616 . 0 0 "[ . 1]" 1
182 1 12 SER HA 1 17 GLN QG 3.860 . 5.722 4.391 3.931 5.760 0.038 3 0 "[ . 1]" 1
183 1 12 SER HA 1 18 PHE HA 3.145 . 4.381 2.783 2.593 3.130 . 0 0 "[ . 1]" 1
184 1 12 SER HA 1 18 PHE QD 2.926 . 3.996 3.420 3.224 3.888 . 0 0 "[ . 1]" 1
185 1 12 SER HA 1 36 LEU QD 3.739 . 5.486 4.164 3.989 4.472 . 0 0 "[ . 1]" 1
186 1 12 SER HA 1 49 HIS HE2 4.334 . 6.682 4.671 4.564 4.808 . 0 0 "[ . 1]" 1
187 1 12 SER QB 1 13 ASN H 3.108 . 4.316 3.048 2.967 3.581 . 0 0 "[ . 1]" 1
188 1 12 SER QB 1 17 GLN H 4.830 . 7.746 4.434 4.231 4.852 . 0 0 "[ . 1]" 1
189 1 12 SER QB 1 17 GLN QG 3.406 . 4.784 5.344 4.928 6.548 1.764 3 4 "[ +*. - *1]" 1
190 1 12 SER QB 1 18 PHE HA 4.413 . 6.816 3.441 3.202 3.686 . 0 0 "[ . 1]" 1
191 1 12 SER QB 1 18 PHE QD 3.041 . 4.197 2.426 2.092 2.858 . 0 0 "[ . 1]" 1
192 1 12 SER QB 1 18 PHE QE 2.719 . 3.643 2.653 2.302 3.113 . 0 0 "[ . 1]" 1
193 1 12 SER QB 1 36 LEU QD 3.396 . 4.479 2.442 2.149 2.559 . 0 0 "[ . 1]" 1
194 1 12 SER QB 1 49 HIS HD2 2.836 . 3.841 2.634 2.362 2.850 . 0 0 "[ . 1]" 1
195 1 12 SER QB 1 49 HIS HE1 4.266 . 6.541 4.495 4.186 4.974 . 0 0 "[ . 1]" 1
196 1 12 SER QB 1 49 HIS HE2 4.414 . 5.798 3.374 3.183 3.904 . 0 0 "[ . 1]" 1
197 1 13 ASN H 1 13 ASN HB2 3.431 . 4.902 3.771 3.721 3.799 . 0 0 "[ . 1]" 1
198 1 13 ASN H 1 13 ASN HB3 3.521 . 5.070 3.168 3.039 3.228 . 0 0 "[ . 1]" 1
199 1 13 ASN H 1 14 ASP H 3.900 . 5.801 3.765 3.354 4.013 . 0 0 "[ . 1]" 1
200 1 13 ASN H 1 15 ASN H 3.573 . 5.169 3.143 2.112 3.693 . 0 0 "[ . 1]" 1
201 1 13 ASN H 1 14 ASP H 4.399 . 6.818 4.390 4.300 4.487 . 0 0 "[ . 1]" 1
202 1 13 ASN H 1 15 ASN H 4.101 . 6.203 4.047 3.877 4.282 . 0 0 "[ . 1]" 1
203 1 13 ASN H 1 16 MET H 3.812 . 5.628 4.298 3.930 4.579 . 0 0 "[ . 1]" 1
204 1 13 ASN H 1 16 MET HA 4.156 . 6.315 4.836 4.249 5.221 . 0 0 "[ . 1]" 1
205 1 13 ASN H 1 17 GLN H 3.026 . 4.171 3.079 2.852 3.336 . 0 0 "[ . 1]" 1
206 1 13 ASN H 1 17 GLN QB 4.306 . 6.381 5.065 4.384 5.245 . 0 0 "[ . 1]" 1
207 1 13 ASN H 1 17 GLN QG 4.003 . 6.006 3.733 3.263 5.601 . 0 0 "[ . 1]" 1
208 1 13 ASN H 1 38 HIS HB2 4.727 . 7.520 6.697 6.476 6.946 . 0 0 "[ . 1]" 1
209 1 13 ASN H 1 39 THR H 4.324 . 6.661 4.882 4.601 5.067 . 0 0 "[ . 1]" 1
210 1 13 ASN H 1 49 HIS HE2 3.686 . 5.384 3.626 3.460 3.774 . 0 0 "[ . 1]" 1
211 1 13 ASN H 1 47 MET HG3 4.761 . 7.594 6.875 6.553 7.670 0.076 7 0 "[ . 1]" 1
212 1 13 ASN H 1 49 HIS HE2 3.704 . 5.419 3.675 3.494 3.857 . 0 0 "[ . 1]" 1
213 1 13 ASN HA 1 13 ASN HB2 2.983 . 4.095 2.496 2.425 2.543 . 0 0 "[ . 1]" 1
214 1 13 ASN HA 1 14 ASP H 3.207 . 4.492 2.657 2.491 2.799 . 0 0 "[ . 1]" 1
215 1 13 ASN HA 1 38 HIS HA 3.630 . 5.277 3.799 3.672 3.897 . 0 0 "[ . 1]" 1
216 1 13 ASN HA 1 38 HIS HB2 4.267 . 6.543 4.472 4.310 4.575 . 0 0 "[ . 1]" 1
217 1 13 ASN HA 1 38 HIS HB3 4.141 . 6.285 4.548 4.456 4.685 . 0 0 "[ . 1]" 1
218 1 13 ASN HA 1 38 HIS HE1 3.397 . 4.840 3.287 2.594 3.623 . 0 0 "[ . 1]" 1
219 1 13 ASN HA 1 39 THR H 3.261 . 4.591 3.402 3.092 3.643 . 0 0 "[ . 1]" 1
220 1 13 ASN HA 1 40 GLY H 3.184 . 4.451 4.432 2.444 5.422 0.971 8 4 "[ **. +-1]" 1
221 1 13 ASN HA 1 40 GLY HA2 3.752 . 5.512 4.586 3.976 5.223 . 0 0 "[ . 1]" 1
222 1 13 ASN HA 1 40 GLY HA3 3.875 . 5.752 3.793 3.100 4.348 . 0 0 "[ . 1]" 1
223 1 13 ASN HB2 1 14 ASP H 3.057 . 4.225 1.982 1.737 2.259 0.152 4 0 "[ . 1]" 1
224 1 13 ASN HB2 1 38 HIS HE1 3.339 . 4.733 5.070 4.232 5.447 0.714 3 3 "[ *+-. 1]" 1
225 1 13 ASN HB2 1 39 THR H 4.343 . 6.701 5.390 5.182 5.811 . 0 0 "[ . 1]" 1
226 1 13 ASN HB2 1 40 GLY H 4.525 . 7.085 5.906 4.426 6.634 . 0 0 "[ . 1]" 1
227 1 13 ASN HB3 1 13 ASN QD 3.293 . 4.648 2.479 2.190 3.321 . 0 0 "[ . 1]" 1
228 1 13 ASN HB3 1 14 ASP H 2.866 . 3.892 3.485 3.319 3.625 . 0 0 "[ . 1]" 1
229 1 13 ASN HB3 1 15 ASN H 3.635 . 5.286 4.196 4.044 4.323 . 0 0 "[ . 1]" 1
230 1 13 ASN HB3 1 40 GLY H 4.326 . 6.665 5.987 4.348 6.818 0.153 3 0 "[ . 1]" 1
231 1 13 ASN QD 1 14 ASP H 3.937 . 5.874 4.158 3.465 4.591 . 0 0 "[ . 1]" 1
232 1 13 ASN QD 1 15 ASN QB 3.012 . 4.146 2.682 1.896 3.544 0.083 3 0 "[ . 1]" 1
233 1 13 ASN QD 1 17 GLN HA 3.849 . 5.701 4.302 3.725 4.571 . 0 0 "[ . 1]" 1
234 1 13 ASN QD 1 17 GLN QB 3.250 . 4.221 3.795 2.839 4.244 0.023 7 0 "[ . 1]" 1
235 1 14 ASP H 1 15 ASN H 3.103 . 4.306 2.589 2.500 2.733 . 0 0 "[ . 1]" 1
236 1 14 ASP H 1 15 ASN QB 3.905 . 5.811 4.365 4.025 4.612 . 0 0 "[ . 1]" 1
237 1 14 ASP H 1 39 THR H 4.930 . 7.968 5.845 5.647 6.217 . 0 0 "[ . 1]" 1
238 1 14 ASP H 1 40 GLY H 4.568 . 7.177 5.478 4.338 5.956 . 0 0 "[ . 1]" 1
239 1 14 ASP H 1 40 GLY H 3.635 . 5.287 3.607 3.102 4.058 . 0 0 "[ . 1]" 1
240 1 14 ASP H 1 40 GLY HA2 3.842 . 5.688 4.188 3.875 4.629 . 0 0 "[ . 1]" 1
241 1 14 ASP H 1 40 GLY HA3 3.975 . 5.950 3.658 3.068 4.173 . 0 0 "[ . 1]" 1
242 1 14 ASP H 1 41 THR H 4.503 . 7.038 4.993 4.272 5.575 . 0 0 "[ . 1]" 1
243 1 14 ASP HA 1 15 ASN H 3.358 . 4.767 3.244 2.947 3.435 . 0 0 "[ . 1]" 1
244 1 14 ASP HA 1 38 HIS HE1 3.234 . 4.541 3.058 2.739 3.427 . 0 0 "[ . 1]" 1
245 1 14 ASP HA 1 38 HIS HE2 4.334 . 6.682 4.644 4.169 5.165 . 0 0 "[ . 1]" 1
246 1 14 ASP HA 1 47 MET ME 3.387 . 4.821 3.280 2.780 3.670 . 0 0 "[ . 1]" 1
247 1 14 ASP HA 1 47 MET HG2 2.929 . 4.001 2.864 2.088 4.235 0.234 4 0 "[ . 1]" 1
248 1 14 ASP HA 1 47 MET HG3 3.162 . 4.412 3.626 2.816 4.651 0.239 3 0 "[ . 1]" 1
249 1 14 ASP HA 1 49 HIS HE2 3.753 . 5.513 3.349 2.719 4.020 . 0 0 "[ . 1]" 1
250 1 14 ASP QB 1 42 GLN HG2 3.886 . 5.774 3.538 2.957 4.667 . 0 0 "[ . 1]" 1
251 1 14 ASP QB 1 42 GLN HG3 3.888 . 5.777 3.460 2.663 4.961 . 0 0 "[ . 1]" 1
252 1 15 ASN H 1 15 ASN HA 2.853 . 3.871 2.915 2.874 2.939 . 0 0 "[ . 1]" 1
253 1 15 ASN H 1 15 ASN QB 2.882 . 3.543 2.405 2.310 2.488 . 0 0 "[ . 1]" 1
254 1 15 ASN H 1 15 ASN HD22 4.319 . 6.651 4.771 4.067 5.852 . 0 0 "[ . 1]" 1
255 1 15 ASN H 1 16 MET H 2.653 . 3.533 2.426 2.157 2.801 . 0 0 "[ . 1]" 1
256 1 15 ASN H 1 16 MET HA 3.670 . 5.354 4.579 4.293 4.946 . 0 0 "[ . 1]" 1
257 1 15 ASN H 1 17 GLN H 3.492 . 5.016 3.995 3.598 4.402 . 0 0 "[ . 1]" 1
258 1 15 ASN H 1 47 MET ME 4.263 . 6.534 5.095 4.749 5.488 . 0 0 "[ . 1]" 1
259 1 15 ASN H 1 49 HIS HE2 4.474 . 6.977 4.674 4.224 5.448 . 0 0 "[ . 1]" 1
260 1 15 ASN HA 1 16 MET H 3.177 . 4.438 3.137 3.072 3.200 . 0 0 "[ . 1]" 1
261 1 15 ASN QB 1 15 ASN HD21 3.633 . 4.215 2.488 2.153 2.812 . 0 0 "[ . 1]" 1
262 1 15 ASN QB 1 15 ASN HD22 3.461 . 4.959 3.365 3.216 3.488 . 0 0 "[ . 1]" 1
263 1 15 ASN QB 1 16 MET H 3.408 . 4.711 3.516 3.427 3.618 . 0 0 "[ . 1]" 1
264 1 15 ASN QB 1 17 GLN H 3.938 . 5.877 4.067 3.547 4.514 . 0 0 "[ . 1]" 1
265 1 15 ASN QB 1 17 GLN QB 3.719 . 5.447 3.736 2.907 4.292 . 0 0 "[ . 1]" 1
266 1 15 ASN QB 1 17 GLN HE22 3.981 . 5.962 4.633 3.039 6.276 0.314 3 0 "[ . 1]" 1
267 1 15 ASN QB 1 17 GLN QG 3.505 . 5.041 2.778 2.184 4.376 . 0 0 "[ . 1]" 1
268 1 16 MET H 1 16 MET HA 2.508 . 3.294 2.259 2.246 2.270 . 0 0 "[ . 1]" 1
269 1 16 MET H 1 16 MET QB 2.774 . 3.736 3.317 3.294 3.362 . 0 0 "[ . 1]" 1
270 1 16 MET H 1 16 MET QG 3.370 . 4.789 2.866 2.750 3.361 . 0 0 "[ . 1]" 1
271 1 16 MET H 1 17 GLN H 2.774 . 3.736 2.870 2.743 3.040 . 0 0 "[ . 1]" 1
272 1 16 MET H 1 47 MET ME 4.084 . 6.169 4.092 3.866 4.362 . 0 0 "[ . 1]" 1
273 1 16 MET H 1 49 HIS HE1 3.490 . 5.012 4.064 3.646 4.619 . 0 0 "[ . 1]" 1
274 1 16 MET H 1 49 HIS HE2 3.861 . 5.724 3.574 3.336 3.917 . 0 0 "[ . 1]" 1
275 1 16 MET HA 1 16 MET QG 3.055 . 4.221 2.403 2.361 2.464 . 0 0 "[ . 1]" 1
276 1 16 MET HA 1 17 GLN H 2.629 . 3.493 2.590 2.471 2.753 . 0 0 "[ . 1]" 1
277 1 16 MET HA 1 18 PHE H 4.724 . 7.513 6.167 5.727 6.469 . 0 0 "[ . 1]" 1
278 1 16 MET HA 1 49 HIS HE1 2.497 . 3.276 2.590 2.278 3.115 . 0 0 "[ . 1]" 1
279 1 16 MET HA 1 49 HIS HE2 3.482 . 4.997 3.492 3.050 3.793 . 0 0 "[ . 1]" 1
280 1 16 MET QB 1 17 GLN H 2.851 . 3.867 2.999 2.553 3.126 . 0 0 "[ . 1]" 1
281 1 16 MET QB 1 49 HIS HE1 3.269 . 4.605 4.027 3.486 4.518 . 0 0 "[ . 1]" 1
282 1 16 MET QB 1 49 HIS HE2 4.127 . 6.256 4.820 4.498 5.028 . 0 0 "[ . 1]" 1
283 1 16 MET QB 1 118 HIS HD2 4.022 . 6.044 5.223 4.879 5.729 . 0 0 "[ . 1]" 1
284 1 16 MET QB 1 122 MET QG 3.544 . 5.114 3.692 3.283 4.059 . 0 0 "[ . 1]" 1
285 1 16 MET ME 1 49 HIS HE2 4.789 . 7.656 6.230 5.587 6.623 . 0 0 "[ . 1]" 1
286 1 16 MET ME 1 118 HIS HD2 3.825 . 5.654 3.988 2.669 6.559 0.905 1 1 "[+ . 1]" 1
287 1 16 MET QG 1 47 MET ME 2.865 . 3.891 2.541 2.119 2.979 . 0 0 "[ . 1]" 1
288 1 16 MET QG 1 49 HIS HE1 2.994 . 4.115 3.138 2.436 3.678 . 0 0 "[ . 1]" 1
289 1 16 MET QG 1 49 HIS HE2 4.579 . 7.200 4.432 3.867 4.834 . 0 0 "[ . 1]" 1
290 1 16 MET QG 1 118 HIS HD2 3.613 . 5.244 4.510 4.028 4.855 . 0 0 "[ . 1]" 1
291 1 16 MET QG 1 118 HIS HE2 4.518 . 7.070 3.737 3.260 4.404 . 0 0 "[ . 1]" 1
292 1 17 GLN H 1 17 GLN QB 2.750 . 3.695 3.122 2.588 3.289 . 0 0 "[ . 1]" 1
293 1 17 GLN H 1 17 GLN QG 3.153 . 4.395 2.815 2.464 4.170 . 0 0 "[ . 1]" 1
294 1 17 GLN H 1 18 PHE H 3.822 . 5.648 4.303 4.224 4.372 . 0 0 "[ . 1]" 1
295 1 17 GLN H 1 49 HIS HE1 3.655 . 5.324 4.343 3.967 4.868 . 0 0 "[ . 1]" 1
296 1 17 GLN H 1 49 HIS HE2 4.332 . 6.677 4.083 3.880 4.333 . 0 0 "[ . 1]" 1
297 1 17 GLN H 1 121 LEU QD 4.731 . 7.529 5.200 4.682 5.827 . 0 0 "[ . 1]" 1
298 1 17 GLN H 1 122 MET QG 4.194 . 6.392 4.141 3.562 4.665 . 0 0 "[ . 1]" 1
299 1 17 GLN HA 1 17 GLN QB 2.843 . 3.854 2.201 2.171 2.371 . 0 0 "[ . 1]" 1
300 1 17 GLN HA 1 17 GLN QG 3.123 . 4.342 3.291 2.942 3.353 . 0 0 "[ . 1]" 1
301 1 17 GLN HA 1 18 PHE H 2.347 . 3.036 2.264 2.132 2.480 . 0 0 "[ . 1]" 1
302 1 17 GLN HA 1 122 MET QG 3.327 . 4.710 2.839 2.219 3.618 . 0 0 "[ . 1]" 1
303 1 17 GLN QB 1 17 GLN HE21 3.423 . 4.887 2.851 1.729 3.744 0.230 1 0 "[ . 1]" 1
304 1 17 GLN QB 1 18 PHE H 2.985 . 4.099 2.772 2.363 3.782 . 0 0 "[ . 1]" 1
305 1 17 GLN HE21 1 17 GLN QG 3.495 . 4.008 2.373 2.158 2.789 . 0 0 "[ . 1]" 1
306 1 17 GLN HE21 1 18 PHE H 4.452 . 6.930 5.201 4.125 6.506 . 0 0 "[ . 1]" 1
307 1 17 GLN HE22 1 17 GLN QG 3.276 . 4.618 3.321 3.210 3.481 . 0 0 "[ . 1]" 1
308 1 17 GLN QG 1 18 PHE H 3.579 . 4.943 3.532 3.032 3.868 . 0 0 "[ . 1]" 1
309 1 17 GLN QG 1 49 HIS HE2 4.583 . 7.208 6.031 5.615 7.933 0.725 3 1 "[ + . 1]" 1
310 1 18 PHE H 1 18 PHE HB2 3.081 . 4.268 2.430 2.340 2.536 . 0 0 "[ . 1]" 1
311 1 18 PHE H 1 18 PHE HB3 2.890 . 3.934 3.635 3.577 3.714 . 0 0 "[ . 1]" 1
312 1 18 PHE H 1 18 PHE QD 3.174 . 4.433 3.282 3.089 3.545 . 0 0 "[ . 1]" 1
313 1 18 PHE H 1 20 THR MG 4.332 . 6.678 6.185 5.825 6.864 0.186 2 0 "[ . 1]" 1
314 1 18 PHE H 1 122 MET QG 3.523 . 5.074 3.750 3.059 5.372 0.298 6 0 "[ . 1]" 1
315 1 18 PHE HA 1 18 PHE QD 2.558 . 3.376 2.339 2.201 2.491 . 0 0 "[ . 1]" 1
316 1 18 PHE HA 1 19 ASN H 2.583 . 3.417 2.312 2.210 2.441 . 0 0 "[ . 1]" 1
317 1 18 PHE HA 1 20 THR H 3.505 . 5.041 3.884 3.672 4.178 . 0 0 "[ . 1]" 1
318 1 18 PHE HA 1 20 THR MG 4.028 . 6.056 5.186 4.962 5.651 . 0 0 "[ . 1]" 1
319 1 18 PHE HB2 1 18 PHE QD 2.538 . 3.343 2.261 2.250 2.272 . 0 0 "[ . 1]" 1
320 1 18 PHE HB2 1 19 ASN H 2.958 . 4.052 3.894 3.539 4.081 0.029 3 0 "[ . 1]" 1
321 1 18 PHE HB2 1 20 THR MG 3.800 . 5.605 4.382 3.889 5.379 . 0 0 "[ . 1]" 1
322 1 18 PHE HB3 1 18 PHE QD 2.544 . 3.353 2.638 2.592 2.684 . 0 0 "[ . 1]" 1
323 1 18 PHE HB3 1 19 ASN H 3.689 . 5.390 2.744 2.218 2.961 . 0 0 "[ . 1]" 1
324 1 18 PHE HB3 1 20 THR MG 4.156 . 6.315 3.456 3.162 4.242 . 0 0 "[ . 1]" 1
325 1 18 PHE QR 1 113 CYS HB2 2.810 . 3.797 3.054 2.754 3.229 . 0 0 "[ . 1]" 1
326 1 18 PHE QD 1 36 LEU QD 2.833 . 3.836 2.854 2.706 3.062 . 0 0 "[ . 1]" 1
327 1 18 PHE QD 1 49 HIS HE2 4.695 . 7.451 6.782 6.613 7.037 . 0 0 "[ . 1]" 1
328 1 18 PHE QD 1 122 MET HA 2.907 . 3.963 3.327 2.955 3.911 . 0 0 "[ . 1]" 1
329 1 18 PHE QE 1 36 LEU QD 2.213 . 2.825 2.262 2.131 2.395 . 0 0 "[ . 1]" 1
330 1 18 PHE QE 1 49 HIS HB2 4.088 . 6.177 4.605 4.255 4.837 . 0 0 "[ . 1]" 1
331 1 18 PHE QE 1 51 LEU QD 2.885 . 3.926 3.442 3.108 3.731 . 0 0 "[ . 1]" 1
332 1 18 PHE QE 1 112 ALA HA 2.656 . 3.538 2.677 2.363 3.088 . 0 0 "[ . 1]" 1
333 1 18 PHE QE 1 112 ALA MB 3.446 . 4.930 3.995 3.758 4.260 . 0 0 "[ . 1]" 1
334 1 18 PHE QE 1 113 CYS H 2.999 . 4.123 2.857 2.523 3.197 . 0 0 "[ . 1]" 1
335 1 18 PHE QE 1 113 CYS HA 4.187 . 6.378 4.417 4.116 4.684 . 0 0 "[ . 1]" 1
336 1 18 PHE QE 1 113 CYS HB2 3.855 . 5.712 3.085 2.775 3.263 . 0 0 "[ . 1]" 1
337 1 18 PHE QE 1 113 CYS HB3 2.978 . 4.087 3.976 3.683 4.138 0.051 7 0 "[ . 1]" 1
338 1 18 PHE QE 1 122 MET H 4.056 . 6.112 5.084 4.956 5.254 . 0 0 "[ . 1]" 1
339 1 18 PHE QE 1 122 MET HA 3.203 . 4.486 3.488 3.143 3.844 . 0 0 "[ . 1]" 1
340 1 18 PHE QE 1 122 MET QG 4.131 . 6.264 3.585 2.454 4.380 . 0 0 "[ . 1]" 1
341 1 18 PHE QE 1 123 ASN H 2.984 . 4.097 4.055 3.859 4.281 0.184 10 0 "[ . 1]" 1
342 1 18 PHE QE 1 123 ASN HA 2.950 . 4.038 3.292 3.029 3.756 . 0 0 "[ . 1]" 1
343 1 18 PHE QE 1 124 GLY H 4.007 . 6.014 4.938 4.705 5.189 . 0 0 "[ . 1]" 1
344 1 19 ASN H 1 19 ASN HA 2.996 . 4.118 2.846 2.790 2.895 . 0 0 "[ . 1]" 1
345 1 19 ASN H 1 19 ASN QB 2.971 . 3.777 2.381 2.233 2.577 . 0 0 "[ . 1]" 1
346 1 19 ASN H 1 19 ASN QD 4.506 . 7.044 4.207 3.807 4.468 . 0 0 "[ . 1]" 1
347 1 19 ASN H 1 20 THR H 2.738 . 3.675 2.636 2.542 2.760 . 0 0 "[ . 1]" 1
348 1 19 ASN H 1 20 THR MG 3.633 . 5.283 3.871 3.636 4.100 . 0 0 "[ . 1]" 1
349 1 19 ASN HA 1 19 ASN QB 2.961 . 3.741 2.344 2.181 2.454 . 0 0 "[ . 1]" 1
350 1 19 ASN HA 1 19 ASN QD 3.589 . 5.199 3.774 2.752 4.293 . 0 0 "[ . 1]" 1
351 1 19 ASN QB 1 19 ASN QD 2.867 . 3.895 2.153 2.124 2.204 . 0 0 "[ . 1]" 1
352 1 19 ASN QB 1 20 THR H 2.742 . 3.682 3.327 2.761 3.895 0.213 1 0 "[ . 1]" 1
353 1 19 ASN QB 1 20 THR MG 3.658 . 5.331 3.565 2.892 4.280 . 0 0 "[ . 1]" 1
354 1 20 THR H 1 20 THR HB 3.114 . 4.327 3.404 3.138 3.818 . 0 0 "[ . 1]" 1
355 1 20 THR H 1 20 THR MG 2.505 . 3.289 2.468 2.213 3.101 . 0 0 "[ . 1]" 1
356 1 20 THR H 1 111 PHE QE 3.839 . 5.681 4.753 4.299 5.043 . 0 0 "[ . 1]" 1
357 1 20 THR H 1 111 PHE HZ 3.417 . 4.876 4.667 4.481 4.832 . 0 0 "[ . 1]" 1
358 1 20 THR HA 1 20 THR HB 2.681 . 3.579 2.456 2.437 2.509 . 0 0 "[ . 1]" 1
359 1 20 THR HB 1 20 THR MG 2.460 . 3.216 2.132 2.130 2.135 . 0 0 "[ . 1]" 1
360 1 20 THR MG 1 22 ASP H 2.897 . 3.946 3.249 2.895 3.974 0.028 2 0 "[ . 1]" 1
361 1 20 THR MG 1 23 ILE MD 3.304 . 4.668 3.159 2.803 3.736 . 0 0 "[ . 1]" 1
362 1 20 THR MG 1 23 ILE HG13 3.250 . 4.570 3.024 2.602 3.773 . 0 0 "[ . 1]" 1
363 1 20 THR MG 1 111 PHE QD 3.823 . 5.650 4.462 4.230 4.778 . 0 0 "[ . 1]" 1
364 1 20 THR MG 1 111 PHE QE 3.672 . 5.357 3.702 3.276 4.710 . 0 0 "[ . 1]" 1
365 1 20 THR MG 1 111 PHE HZ 3.019 . 4.158 3.115 2.539 4.551 0.393 2 0 "[ . 1]" 1
366 1 21 LYS QB 1 21 LYS QE 2.585 . 3.420 2.960 1.950 3.657 0.237 10 0 "[ . 1]" 1
367 1 21 LYS QB 1 21 LYS QG 2.758 . 3.621 2.064 2.000 2.091 . 0 0 "[ . 1]" 1
368 1 21 LYS QB 1 22 ASP H 3.421 . 4.884 3.405 3.101 3.631 . 0 0 "[ . 1]" 1
369 1 21 LYS QB 1 124 GLY HA2 4.677 . 7.411 3.884 2.740 5.428 . 0 0 "[ . 1]" 1
370 1 21 LYS QB 1 124 GLY HA3 4.310 . 6.632 3.779 2.847 4.972 . 0 0 "[ . 1]" 1
371 1 21 LYS QD 1 124 GLY HA3 3.869 . 5.740 4.263 2.965 5.348 . 0 0 "[ . 1]" 1
372 1 21 LYS QE 1 21 LYS QG 2.885 . 3.925 2.364 2.137 2.784 . 0 0 "[ . 1]" 1
373 1 21 LYS QE 1 123 ASN H 4.546 . 7.130 4.300 3.469 5.221 . 0 0 "[ . 1]" 1
374 1 21 LYS QG 1 22 ASP H 3.643 . 5.302 4.432 4.176 4.656 . 0 0 "[ . 1]" 1
375 1 21 LYS QG 1 111 PHE HZ 3.300 . 4.662 4.210 3.774 4.840 0.178 2 0 "[ . 1]" 1
376 1 21 LYS QG 1 123 ASN H 3.711 . 5.433 4.825 4.110 6.050 0.617 2 1 "[ + . 1]" 1
377 1 21 LYS QG 1 123 ASN HD22 4.924 . 7.954 7.272 6.182 8.444 0.490 2 0 "[ . 1]" 1
378 1 21 LYS QG 1 124 GLY HA2 3.952 . 5.905 3.722 2.333 5.263 . 0 0 "[ . 1]" 1
379 1 21 LYS QG 1 124 GLY HA3 3.994 . 5.988 3.621 2.427 4.950 . 0 0 "[ . 1]" 1
380 1 22 ASP H 1 22 ASP HB2 2.966 . 4.066 3.203 2.638 3.928 . 0 0 "[ . 1]" 1
381 1 22 ASP H 1 22 ASP HB3 3.052 . 4.216 3.263 2.735 3.845 . 0 0 "[ . 1]" 1
382 1 22 ASP H 1 23 ILE H 3.912 . 5.825 4.251 4.185 4.353 . 0 0 "[ . 1]" 1
383 1 22 ASP H 1 111 PHE QE 3.945 . 5.890 3.748 3.644 3.948 . 0 0 "[ . 1]" 1
384 1 22 ASP H 1 111 PHE HZ 3.772 . 5.550 3.414 3.196 3.619 . 0 0 "[ . 1]" 1
385 1 22 ASP H 1 124 GLY HA3 4.767 . 7.608 4.985 4.699 5.288 . 0 0 "[ . 1]" 1
386 1 22 ASP HA 1 22 ASP HB3 2.957 . 4.050 2.742 2.501 3.030 . 0 0 "[ . 1]" 1
387 1 22 ASP HA 1 23 ILE H 2.389 . 3.102 2.161 2.121 2.218 . 0 0 "[ . 1]" 1
388 1 22 ASP HA 1 23 ILE HB 4.164 . 6.331 4.537 4.480 4.605 . 0 0 "[ . 1]" 1
389 1 22 ASP HA 1 23 ILE HG12 4.292 . 6.595 5.376 5.091 5.526 . 0 0 "[ . 1]" 1
390 1 22 ASP HA 1 111 PHE QD 3.942 . 5.885 4.507 4.240 4.749 . 0 0 "[ . 1]" 1
391 1 22 ASP HA 1 111 PHE QE 3.320 . 4.698 2.562 2.183 2.783 . 0 0 "[ . 1]" 1
392 1 22 ASP HA 1 111 PHE HZ 3.865 . 5.732 4.125 3.709 4.319 . 0 0 "[ . 1]" 1
393 1 22 ASP HA 1 124 GLY HA2 3.971 . 5.942 5.244 4.921 5.473 . 0 0 "[ . 1]" 1
394 1 22 ASP HA 1 124 GLY HA3 4.199 . 6.403 4.328 3.897 4.702 . 0 0 "[ . 1]" 1
395 1 22 ASP HA 1 125 LYS H 3.027 . 4.172 2.857 2.613 3.106 . 0 0 "[ . 1]" 1
396 1 22 ASP HA 1 125 LYS QB 3.132 . 4.358 3.259 2.904 3.797 . 0 0 "[ . 1]" 1
397 1 22 ASP HB2 1 23 ILE H 3.680 . 5.373 3.984 3.113 4.366 . 0 0 "[ . 1]" 1
398 1 22 ASP HB2 1 125 LYS H 4.592 . 7.228 4.797 3.902 5.645 . 0 0 "[ . 1]" 1
399 1 22 ASP HB3 1 23 ILE H 3.542 . 5.110 3.817 2.968 4.315 . 0 0 "[ . 1]" 1
400 1 23 ILE H 1 23 ILE HB 2.780 . 3.746 2.656 2.609 2.718 . 0 0 "[ . 1]" 1
401 1 23 ILE H 1 23 ILE MD 3.403 . 4.850 4.169 4.084 4.222 . 0 0 "[ . 1]" 1
402 1 23 ILE H 1 23 ILE HG12 3.129 . 4.353 4.201 3.979 4.277 . 0 0 "[ . 1]" 1
403 1 23 ILE H 1 23 ILE HG13 3.330 . 4.716 3.126 2.932 3.224 . 0 0 "[ . 1]" 1
404 1 23 ILE H 1 23 ILE MG 3.249 . 4.569 3.823 3.804 3.847 . 0 0 "[ . 1]" 1
405 1 23 ILE H 1 24 GLN H 3.247 . 4.565 4.288 4.221 4.328 . 0 0 "[ . 1]" 1
406 1 23 ILE H 1 24 GLN HB2 3.939 . 5.878 6.147 6.026 6.300 0.422 5 0 "[ . 1]" 1
407 1 23 ILE H 1 34 ILE HG12 3.450 . 4.937 3.782 3.539 3.924 . 0 0 "[ . 1]" 1
408 1 23 ILE H 1 111 PHE QD 3.784 . 5.574 3.937 3.701 4.029 . 0 0 "[ . 1]" 1
409 1 23 ILE H 1 111 PHE QE 3.223 . 4.521 2.923 2.764 3.060 . 0 0 "[ . 1]" 1
410 1 23 ILE H 1 111 PHE HZ 4.099 . 6.199 4.920 4.777 5.130 . 0 0 "[ . 1]" 1
411 1 23 ILE H 1 125 LYS H 3.645 . 5.306 4.221 3.865 4.557 . 0 0 "[ . 1]" 1
412 1 23 ILE H 1 125 LYS QB 3.538 . 5.103 4.121 3.743 4.519 . 0 0 "[ . 1]" 1
413 1 23 ILE H 1 126 VAL H 4.094 . 6.189 4.721 4.557 4.947 . 0 0 "[ . 1]" 1
414 1 23 ILE H 1 126 VAL QG 3.467 . 4.970 3.788 3.541 3.932 . 0 0 "[ . 1]" 1
415 1 23 ILE H 1 127 THR H 2.982 . 4.093 3.558 2.858 3.972 . 0 0 "[ . 1]" 1
416 1 23 ILE HA 1 23 ILE MD 3.513 . 5.056 3.821 3.805 3.840 . 0 0 "[ . 1]" 1
417 1 23 ILE HA 1 23 ILE HG12 3.155 . 4.399 2.508 2.474 2.548 . 0 0 "[ . 1]" 1
418 1 23 ILE HA 1 23 ILE HG13 2.951 . 4.040 2.905 2.860 3.061 . 0 0 "[ . 1]" 1
419 1 23 ILE HA 1 23 ILE MG 2.635 . 3.503 2.493 2.440 2.520 . 0 0 "[ . 1]" 1
420 1 23 ILE HA 1 24 GLN H 2.208 . 2.818 2.144 2.110 2.160 . 0 0 "[ . 1]" 1
421 1 23 ILE HA 1 24 GLN HB2 3.925 . 5.850 4.516 4.446 4.587 . 0 0 "[ . 1]" 1
422 1 23 ILE HA 1 24 GLN HB3 3.858 . 5.719 5.649 5.624 5.677 . 0 0 "[ . 1]" 1
423 1 23 ILE HA 1 24 GLN HG3 3.686 . 5.384 3.835 3.635 4.072 . 0 0 "[ . 1]" 1
424 1 23 ILE HB 1 23 ILE MD 2.810 . 3.797 2.400 2.377 2.430 . 0 0 "[ . 1]" 1
425 1 23 ILE HB 1 23 ILE HG12 2.939 . 4.018 3.031 3.028 3.032 . 0 0 "[ . 1]" 1
426 1 23 ILE HB 1 23 ILE MG 2.494 . 3.272 2.130 2.126 2.133 . 0 0 "[ . 1]" 1
427 1 23 ILE HB 1 24 GLN H 3.500 . 5.031 4.215 4.136 4.283 . 0 0 "[ . 1]" 1
428 1 23 ILE HB 1 53 ILE MD 2.877 . 3.911 2.446 2.175 2.640 . 0 0 "[ . 1]" 1
429 1 23 ILE HB 1 111 PHE QD 4.113 . 6.228 3.442 3.235 3.852 . 0 0 "[ . 1]" 1
430 1 23 ILE HB 1 126 VAL QG 2.973 . 4.078 2.461 2.183 2.663 . 0 0 "[ . 1]" 1
431 1 23 ILE HB 1 127 THR H 3.563 . 5.150 4.101 3.711 4.335 . 0 0 "[ . 1]" 1
432 1 23 ILE MD 1 23 ILE HG12 2.792 . 3.766 2.117 2.115 2.119 . 0 0 "[ . 1]" 1
433 1 23 ILE MD 1 23 ILE HG13 2.425 . 3.160 2.121 2.118 2.124 . 0 0 "[ . 1]" 1
434 1 23 ILE MD 1 23 ILE MG 2.434 . 3.175 2.003 1.973 2.028 . 0 0 "[ . 1]" 1
435 1 23 ILE MD 1 24 GLN H 3.910 . 5.821 5.038 4.939 5.126 . 0 0 "[ . 1]" 1
436 1 23 ILE MD 1 24 GLN H 4.209 . 6.423 4.783 4.692 4.845 . 0 0 "[ . 1]" 1
437 1 23 ILE MD 1 32 PHE HZ 4.320 . 6.653 5.321 4.959 5.637 . 0 0 "[ . 1]" 1
438 1 23 ILE MD 1 34 ILE MD 2.657 . 3.539 2.187 2.071 2.305 . 0 0 "[ . 1]" 1
439 1 23 ILE MD 1 34 ILE HG12 2.933 . 4.008 2.933 2.384 3.180 . 0 0 "[ . 1]" 1
440 1 23 ILE MD 1 34 ILE MG 3.069 . 4.246 2.772 2.671 2.861 . 0 0 "[ . 1]" 1
441 1 23 ILE MD 1 51 LEU HB2 4.148 . 6.299 5.431 5.175 5.710 . 0 0 "[ . 1]" 1
442 1 23 ILE MD 1 51 LEU QD 2.798 . 3.776 2.329 2.084 2.550 . 0 0 "[ . 1]" 1
443 1 23 ILE MD 1 53 ILE MD 3.223 . 4.522 3.291 3.050 3.604 . 0 0 "[ . 1]" 1
444 1 23 ILE MD 1 111 PHE HB2 4.076 . 6.153 3.661 3.386 3.972 . 0 0 "[ . 1]" 1
445 1 23 ILE MD 1 111 PHE HB3 3.728 . 5.465 3.336 3.057 3.797 . 0 0 "[ . 1]" 1
446 1 23 ILE MD 1 111 PHE QD 2.910 . 3.969 3.079 2.873 3.307 . 0 0 "[ . 1]" 1
447 1 23 ILE MD 1 111 PHE QE 3.876 . 5.754 3.349 3.273 3.417 . 0 0 "[ . 1]" 1
448 1 23 ILE MD 1 111 PHE HZ 3.627 . 5.271 3.879 3.773 3.998 . 0 0 "[ . 1]" 1
449 1 23 ILE MD 1 112 ALA H 4.661 . 7.377 6.064 5.859 6.361 . 0 0 "[ . 1]" 1
450 1 23 ILE MD 1 126 VAL HB 4.193 . 6.391 4.058 3.244 5.750 . 0 0 "[ . 1]" 1
451 1 23 ILE HG12 1 23 ILE MG 3.182 . 4.448 2.359 2.339 2.425 . 0 0 "[ . 1]" 1
452 1 23 ILE HG12 1 24 GLN H 3.653 . 5.321 4.223 4.138 4.310 . 0 0 "[ . 1]" 1
453 1 23 ILE HG12 1 34 ILE MG 3.286 . 4.636 4.216 4.127 4.293 . 0 0 "[ . 1]" 1
454 1 23 ILE HG12 1 51 LEU QD 3.620 . 5.258 4.069 3.921 4.154 . 0 0 "[ . 1]" 1
455 1 23 ILE HG12 1 111 PHE QD 3.593 . 5.207 4.173 3.937 4.889 . 0 0 "[ . 1]" 1
456 1 23 ILE HG12 1 111 PHE QE 3.794 . 5.593 4.550 4.174 4.688 . 0 0 "[ . 1]" 1
457 1 23 ILE HG13 1 23 ILE MG 2.880 . 3.917 3.208 3.205 3.211 . 0 0 "[ . 1]" 1
458 1 23 ILE HG13 1 24 GLN H 3.388 . 4.823 4.931 4.882 5.049 0.226 4 0 "[ . 1]" 1
459 1 23 ILE HG13 1 111 PHE QE 4.056 . 6.113 2.950 2.524 3.100 . 0 0 "[ . 1]" 1
460 1 23 ILE HG13 1 111 PHE HZ 3.818 . 5.640 3.504 3.325 3.660 . 0 0 "[ . 1]" 1
461 1 23 ILE MG 1 24 GLN H 2.717 . 3.640 2.642 2.516 2.779 . 0 0 "[ . 1]" 1
462 1 23 ILE MG 1 24 GLN HB3 4.203 . 6.412 5.122 5.046 5.257 . 0 0 "[ . 1]" 1
463 1 23 ILE MG 1 25 VAL HA 4.056 . 6.112 3.937 3.785 4.014 . 0 0 "[ . 1]" 1
464 1 23 ILE MG 1 25 VAL HA 3.746 . 5.500 3.765 3.684 3.836 . 0 0 "[ . 1]" 1
465 1 23 ILE MG 1 25 VAL HB 3.338 . 4.731 2.649 2.376 3.032 . 0 0 "[ . 1]" 1
466 1 23 ILE MG 1 25 VAL QG 2.705 . 3.620 2.412 2.315 2.536 . 0 0 "[ . 1]" 1
467 1 23 ILE MG 1 25 VAL QG 2.473 . 3.237 1.938 1.827 2.007 . 0 0 "[ . 1]" 1
468 1 23 ILE MG 1 32 PHE QD 3.202 . 4.484 4.057 3.657 4.275 . 0 0 "[ . 1]" 1
469 1 23 ILE MG 1 32 PHE QE 2.847 . 3.860 2.642 2.289 2.852 . 0 0 "[ . 1]" 1
470 1 23 ILE MG 1 32 PHE HZ 3.413 . 4.869 3.198 2.816 3.625 . 0 0 "[ . 1]" 1
471 1 23 ILE MG 1 34 ILE MD 2.335 . 3.017 2.380 2.308 2.489 . 0 0 "[ . 1]" 1
472 1 23 ILE MG 1 34 ILE HG12 3.047 . 4.208 3.327 3.105 3.544 . 0 0 "[ . 1]" 1
473 1 23 ILE MG 1 34 ILE HG13 3.687 . 5.386 4.255 4.108 4.371 . 0 0 "[ . 1]" 1
474 1 23 ILE MG 1 53 ILE MD 2.519 . 3.312 3.575 3.231 3.830 0.518 3 2 "[ + . -1]" 1
475 1 23 ILE MG 1 126 VAL QG 2.348 . 3.037 2.414 2.169 2.906 . 0 0 "[ . 1]" 1
476 1 23 ILE MG 1 127 THR H 3.588 . 5.197 4.057 3.985 4.116 . 0 0 "[ . 1]" 1
477 1 24 GLN H 1 24 GLN HB2 2.868 . 3.896 2.503 2.422 2.550 . 0 0 "[ . 1]" 1
478 1 24 GLN H 1 24 GLN HB3 2.593 . 3.433 3.684 3.639 3.709 0.276 10 0 "[ . 1]" 1
479 1 24 GLN H 1 24 GLN HE21 3.844 . 5.691 4.486 3.809 5.635 . 0 0 "[ . 1]" 1
480 1 24 GLN H 1 24 GLN HG2 3.186 . 4.455 3.897 3.741 4.075 . 0 0 "[ . 1]" 1
481 1 24 GLN H 1 24 GLN HG3 2.801 . 3.782 2.787 2.596 2.959 . 0 0 "[ . 1]" 1
482 1 24 GLN H 1 25 VAL H 3.737 . 5.483 4.308 4.214 4.369 . 0 0 "[ . 1]" 1
483 1 24 GLN H 1 25 VAL QG 3.971 . 5.942 4.342 4.251 4.428 . 0 0 "[ . 1]" 1
484 1 24 GLN H 1 34 ILE HG12 4.000 . 6.000 4.609 4.366 4.990 . 0 0 "[ . 1]" 1
485 1 24 GLN H 1 126 VAL QG 4.230 . 6.467 4.679 4.406 5.138 . 0 0 "[ . 1]" 1
486 1 24 GLN H 1 126 VAL QG 3.732 . 5.473 4.351 4.179 4.604 . 0 0 "[ . 1]" 1
487 1 24 GLN H 1 127 THR H 3.895 . 5.791 4.741 4.589 4.825 . 0 0 "[ . 1]" 1
488 1 24 GLN HA 1 129 VAL MG2 3.650 . 5.315 3.740 3.377 4.014 . 0 0 "[ . 1]" 1
489 1 24 GLN HB2 1 24 GLN HG2 2.646 . 3.521 3.009 3.006 3.012 . 0 0 "[ . 1]" 1
490 1 24 GLN HB2 1 24 GLN HG3 2.812 . 3.800 2.456 2.386 2.516 . 0 0 "[ . 1]" 1
491 1 24 GLN HB2 1 127 THR H 3.876 . 5.754 5.717 5.460 6.109 0.355 2 0 "[ . 1]" 1
492 1 24 GLN HB2 1 129 VAL MG2 2.980 . 4.090 3.550 3.286 3.844 . 0 0 "[ . 1]" 1
493 1 24 GLN HB3 1 24 GLN HG3 2.766 . 3.722 3.010 3.005 3.013 . 0 0 "[ . 1]" 1
494 1 24 GLN HB3 1 25 VAL H 3.703 . 5.417 3.469 3.291 3.717 . 0 0 "[ . 1]" 1
495 1 24 GLN HB3 1 129 VAL MG1 3.221 . 4.518 2.340 2.027 2.587 . 0 0 "[ . 1]" 1
496 1 24 GLN HB3 1 129 VAL MG2 3.158 . 4.405 2.357 2.132 2.634 . 0 0 "[ . 1]" 1
497 1 24 GLN HE21 1 24 GLN HG2 2.975 . 4.081 3.140 2.265 3.493 . 0 0 "[ . 1]" 1
498 1 24 GLN HE21 1 24 GLN HG3 3.205 . 4.489 2.900 2.227 3.475 . 0 0 "[ . 1]" 1
499 1 24 GLN HE21 1 129 VAL MG1 3.508 . 5.047 3.719 2.430 4.725 . 0 0 "[ . 1]" 1
500 1 24 GLN HE22 1 24 GLN HG3 3.459 . 4.955 3.778 3.476 4.060 . 0 0 "[ . 1]" 1
501 1 24 GLN HE22 1 129 VAL MG1 3.482 . 4.998 3.962 3.509 4.571 . 0 0 "[ . 1]" 1
502 1 24 GLN HG2 1 25 VAL H 3.306 . 4.672 4.408 4.191 4.561 . 0 0 "[ . 1]" 1
503 1 24 GLN HG2 1 127 THR H 3.713 . 5.436 4.244 3.823 4.832 . 0 0 "[ . 1]" 1
504 1 24 GLN HG2 1 127 THR HB 3.133 . 4.360 2.940 2.238 3.447 . 0 0 "[ . 1]" 1
505 1 24 GLN HG2 1 129 VAL MG1 2.960 . 4.055 2.703 2.475 3.039 . 0 0 "[ . 1]" 1
506 1 24 GLN HG2 1 129 VAL MG2 3.311 . 4.681 4.060 3.841 4.312 . 0 0 "[ . 1]" 1
507 1 24 GLN HG3 1 25 VAL H 3.650 . 5.315 5.065 4.963 5.200 . 0 0 "[ . 1]" 1
508 1 24 GLN HG3 1 127 THR HB 3.444 . 4.927 4.269 3.569 4.650 . 0 0 "[ . 1]" 1
509 1 24 GLN HG3 1 129 VAL MG1 3.066 . 4.241 3.978 3.758 4.214 . 0 0 "[ . 1]" 1
510 1 25 VAL H 1 25 VAL HB 2.562 . 3.383 2.541 2.479 2.570 . 0 0 "[ . 1]" 1
511 1 25 VAL H 1 25 VAL QG 2.571 . 3.397 2.494 2.405 2.605 . 0 0 "[ . 1]" 1
512 1 25 VAL H 1 26 SER H 3.919 . 5.839 4.358 4.324 4.429 . 0 0 "[ . 1]" 1
513 1 25 VAL H 1 104 LEU QD 3.552 . 5.129 4.336 3.992 4.868 . 0 0 "[ . 1]" 1
514 1 25 VAL H 1 104 LEU QD 4.273 . 6.555 3.775 3.256 4.574 . 0 0 "[ . 1]" 1
515 1 25 VAL H 1 126 VAL QG 3.607 . 5.233 3.609 3.407 3.949 . 0 0 "[ . 1]" 1
516 1 25 VAL H 1 127 THR H 2.946 . 4.031 3.590 3.329 3.837 . 0 0 "[ . 1]" 1
517 1 25 VAL H 1 127 THR HB 3.683 . 5.379 4.165 3.850 4.439 . 0 0 "[ . 1]" 1
518 1 25 VAL H 1 127 THR HB 3.235 . 4.543 3.638 3.495 3.726 . 0 0 "[ . 1]" 1
519 1 25 VAL H 1 127 THR MG 3.730 . 5.469 4.630 4.447 4.776 . 0 0 "[ . 1]" 1
520 1 25 VAL H 1 129 VAL H 2.979 . 4.088 3.330 3.120 3.525 . 0 0 "[ . 1]" 1
521 1 25 VAL H 1 128 LEU HA 3.047 . 4.207 3.012 2.801 3.339 . 0 0 "[ . 1]" 1
522 1 25 VAL H 1 128 LEU QD 2.879 . 3.915 3.227 3.095 3.436 . 0 0 "[ . 1]" 1
523 1 25 VAL H 1 129 VAL MG2 2.928 . 4.000 3.248 2.883 3.413 . 0 0 "[ . 1]" 1
524 1 25 VAL HA 1 25 VAL QG 2.464 . 3.223 2.133 2.128 2.137 . 0 0 "[ . 1]" 1
525 1 25 VAL HA 1 26 SER H 2.384 . 3.095 2.129 2.121 2.137 . 0 0 "[ . 1]" 1
526 1 25 VAL HA 1 26 SER HA 4.268 . 6.545 4.362 4.338 4.379 . 0 0 "[ . 1]" 1
527 1 25 VAL HA 1 26 SER HB2 3.887 . 5.776 4.540 4.414 4.642 . 0 0 "[ . 1]" 1
528 1 25 VAL HA 1 26 SER QB 3.497 . 5.026 4.167 4.022 4.435 . 0 0 "[ . 1]" 1
529 1 25 VAL HA 1 26 SER HB3 3.613 . 5.244 4.927 4.536 5.674 0.430 8 0 "[ . 1]" 1
530 1 25 VAL HA 1 32 PHE QD 4.095 . 6.191 3.555 3.272 3.906 . 0 0 "[ . 1]" 1
531 1 25 VAL HA 1 32 PHE QE 3.417 . 4.876 3.228 2.995 3.521 . 0 0 "[ . 1]" 1
532 1 25 VAL HA 1 32 PHE HZ 3.595 . 5.211 3.765 3.538 3.969 . 0 0 "[ . 1]" 1
533 1 25 VAL HA 1 126 VAL QG 3.616 . 5.250 4.656 4.542 4.859 . 0 0 "[ . 1]" 1
534 1 25 VAL HA 1 129 VAL MG2 3.978 . 5.957 3.933 3.807 4.029 . 0 0 "[ . 1]" 1
535 1 25 VAL HB 1 126 VAL QG 3.163 . 4.383 3.494 3.125 3.701 . 0 0 "[ . 1]" 1
536 1 25 VAL HB 1 128 LEU HA 3.095 . 4.292 2.617 2.466 3.060 . 0 0 "[ . 1]" 1
537 1 25 VAL HB 1 128 LEU QD 3.067 . 4.243 2.592 2.292 2.833 . 0 0 "[ . 1]" 1
538 1 25 VAL HB 1 129 VAL H 3.812 . 5.628 3.867 3.731 4.137 . 0 0 "[ . 1]" 1
539 1 25 VAL QG 1 26 SER H 3.315 . 3.755 2.777 2.653 2.832 . 0 0 "[ . 1]" 1
540 1 25 VAL QG 1 26 SER HB2 4.064 . 6.129 4.593 4.274 4.759 . 0 0 "[ . 1]" 1
541 1 25 VAL QG 1 26 SER QB 3.848 . 5.699 3.990 3.868 4.141 . 0 0 "[ . 1]" 1
542 1 25 VAL QG 1 26 SER HB3 3.997 . 5.994 4.493 4.130 5.144 . 0 0 "[ . 1]" 1
543 1 25 VAL QG 1 27 LYS H 4.351 . 6.718 4.269 4.118 4.377 . 0 0 "[ . 1]" 1
544 1 25 VAL QG 1 27 LYS HA 3.722 . 5.454 3.758 3.605 3.902 . 0 0 "[ . 1]" 1
545 1 25 VAL QG 1 29 CYS H 3.942 . 5.885 4.828 4.702 4.982 . 0 0 "[ . 1]" 1
546 1 25 VAL QG 1 29 CYS QB 3.893 . 5.788 3.898 3.685 4.120 . 0 0 "[ . 1]" 1
547 1 25 VAL QG 1 32 PHE H 3.964 . 5.928 4.361 4.199 4.544 . 0 0 "[ . 1]" 1
548 1 25 VAL QG 1 32 PHE QB 3.374 . 4.797 2.189 2.057 2.329 . 0 0 "[ . 1]" 1
549 1 25 VAL QG 1 32 PHE QD 3.402 . 3.425 2.584 2.521 2.713 . 0 0 "[ . 1]" 1
550 1 25 VAL QG 1 32 PHE QE 3.627 . 5.271 2.951 2.763 3.204 . 0 0 "[ . 1]" 1
551 1 25 VAL QG 1 32 PHE QE 3.555 . 5.135 2.843 2.672 3.072 . 0 0 "[ . 1]" 1
552 1 25 VAL QG 1 34 ILE MD 3.236 . 4.545 3.209 3.006 3.409 . 0 0 "[ . 1]" 1
553 1 25 VAL QG 1 99 LEU H 4.679 . 7.415 5.012 4.937 5.125 . 0 0 "[ . 1]" 1
554 1 25 VAL QG 1 99 LEU QB 4.440 . 6.905 4.396 4.149 4.558 . 0 0 "[ . 1]" 1
555 1 25 VAL QG 1 99 LEU QD 2.695 . 3.220 2.031 1.861 2.125 . 0 0 "[ . 1]" 1
556 1 25 VAL QG 1 99 LEU QD 2.758 . 3.709 1.758 1.665 1.829 0.213 3 0 "[ . 1]" 1
557 1 25 VAL QG 1 101 PRO HA 2.867 . 3.895 2.606 2.385 2.799 . 0 0 "[ . 1]" 1
558 1 25 VAL QG 1 101 PRO HB2 2.958 . 4.052 3.620 2.954 3.946 . 0 0 "[ . 1]" 1
559 1 25 VAL QG 1 101 PRO HD2 3.890 . 5.781 4.701 4.501 4.881 . 0 0 "[ . 1]" 1
560 1 25 VAL QG 1 101 PRO HD3 3.695 . 5.402 3.910 3.565 4.082 . 0 0 "[ . 1]" 1
561 1 25 VAL QG 1 101 PRO HG2 2.941 . 4.022 3.803 3.424 4.422 0.400 7 0 "[ . 1]" 1
562 1 25 VAL QG 1 101 PRO HG3 3.026 . 4.171 2.688 2.275 3.518 . 0 0 "[ . 1]" 1
563 1 25 VAL QG 1 104 LEU QD 2.551 . 3.364 2.052 1.874 2.202 . 0 0 "[ . 1]" 1
564 1 25 VAL QG 1 126 VAL QG 2.486 . 3.259 2.055 1.983 2.127 . 0 0 "[ . 1]" 1
565 1 25 VAL QG 1 127 THR H 3.860 . 4.869 3.855 3.708 4.033 . 0 0 "[ . 1]" 1
566 1 25 VAL QG 1 128 LEU HA 3.538 . 5.103 3.461 3.378 3.683 . 0 0 "[ . 1]" 1
567 1 25 VAL QG 1 128 LEU QB 3.499 . 5.029 4.116 3.964 4.719 . 0 0 "[ . 1]" 1
568 1 25 VAL QG 1 128 LEU QD 2.853 . 3.870 2.452 2.332 2.567 . 0 0 "[ . 1]" 1
569 1 25 VAL QG 1 129 VAL H 3.637 . 5.290 4.029 3.971 4.103 . 0 0 "[ . 1]" 1
570 1 26 SER H 1 26 SER HB2 2.909 . 3.967 2.585 2.448 2.691 . 0 0 "[ . 1]" 1
571 1 26 SER H 1 26 SER QB 2.529 . 3.329 2.328 2.258 2.482 . 0 0 "[ . 1]" 1
572 1 26 SER H 1 26 SER HB3 2.909 . 3.967 2.834 2.438 3.609 . 0 0 "[ . 1]" 1
573 1 26 SER H 1 27 LYS H 3.868 . 5.738 4.459 4.420 4.496 . 0 0 "[ . 1]" 1
574 1 26 SER H 1 32 PHE QD 3.554 . 5.133 3.166 2.909 3.466 . 0 0 "[ . 1]" 1
575 1 26 SER H 1 32 PHE QE 3.231 . 4.536 3.182 3.006 3.417 . 0 0 "[ . 1]" 1
576 1 26 SER H 1 128 LEU QD 4.084 . 6.169 4.277 4.184 4.588 . 0 0 "[ . 1]" 1
577 1 26 SER H 1 129 VAL H 4.380 . 6.778 4.636 4.584 4.764 . 0 0 "[ . 1]" 1
578 1 26 SER H 1 129 VAL MG2 3.299 . 4.659 3.537 3.408 3.819 . 0 0 "[ . 1]" 1
579 1 26 SER HA 1 26 SER HB2 3.000 . 4.125 2.643 2.445 3.030 . 0 0 "[ . 1]" 1
580 1 26 SER HA 1 27 LYS H 2.444 . 3.191 2.124 2.098 2.140 . 0 0 "[ . 1]" 1
581 1 26 SER HA 1 27 LYS QB 3.479 . 4.992 4.331 4.042 4.400 . 0 0 "[ . 1]" 1
582 1 26 SER HA 1 27 LYS QG 3.557 . 5.139 4.075 3.791 5.745 0.606 4 1 "[ +. 1]" 1
583 1 26 SER HA 1 28 ALA H 3.274 . 4.614 3.481 3.367 3.791 . 0 0 "[ . 1]" 1
584 1 26 SER HA 1 28 ALA H 3.609 . 5.237 3.418 3.308 3.716 . 0 0 "[ . 1]" 1
585 1 26 SER HA 1 129 VAL H 3.078 . 4.262 3.110 2.925 3.251 . 0 0 "[ . 1]" 1
586 1 26 SER HA 1 129 VAL MG2 2.619 . 3.476 2.120 2.014 2.366 . 0 0 "[ . 1]" 1
587 1 26 SER HA 1 130 ASP H 3.970 . 5.940 5.051 4.679 5.406 . 0 0 "[ . 1]" 1
588 1 26 SER QB 1 27 LYS H 3.391 . 4.829 3.658 3.281 3.826 . 0 0 "[ . 1]" 1
589 1 26 SER QB 1 129 VAL MG2 3.382 . 4.812 3.116 2.841 3.342 . 0 0 "[ . 1]" 1
590 1 26 SER HB2 1 27 LYS H 3.680 . 5.373 4.283 4.222 4.361 . 0 0 "[ . 1]" 1
591 1 26 SER HB2 1 28 ALA H 4.088 . 6.177 4.138 3.894 4.497 . 0 0 "[ . 1]" 1
592 1 26 SER HB2 1 28 ALA MB 3.896 . 5.794 4.237 3.914 4.455 . 0 0 "[ . 1]" 1
593 1 26 SER HB2 1 29 CYS H 4.280 . 6.570 4.497 3.634 5.075 . 0 0 "[ . 1]" 1
594 1 26 SER HB2 1 32 PHE QD 4.558 . 7.155 4.627 4.063 5.167 . 0 0 "[ . 1]" 1
595 1 26 SER HB2 1 32 PHE QE 4.039 . 6.078 4.373 4.247 4.492 . 0 0 "[ . 1]" 1
596 1 26 SER HB2 1 129 VAL MG2 3.306 . 4.672 3.424 2.901 4.086 . 0 0 "[ . 1]" 1
597 1 26 SER HB3 1 27 LYS H 3.735 . 5.479 4.010 3.419 4.288 . 0 0 "[ . 1]" 1
598 1 26 SER HB3 1 28 ALA H 3.362 . 4.775 3.415 2.824 4.051 . 0 0 "[ . 1]" 1
599 1 26 SER HB3 1 28 ALA MB 4.079 . 6.159 3.633 2.920 4.113 . 0 0 "[ . 1]" 1
600 1 26 SER HB3 1 29 CYS H 4.325 . 6.663 3.553 3.039 4.206 . 0 0 "[ . 1]" 1
601 1 26 SER HB3 1 32 PHE QD 4.506 . 7.043 4.423 3.642 5.869 . 0 0 "[ . 1]" 1
602 1 26 SER HB3 1 32 PHE QE 3.990 . 5.980 4.717 3.932 5.932 . 0 0 "[ . 1]" 1
603 1 26 SER HB3 1 129 VAL H 4.097 . 6.195 5.818 5.333 6.028 . 0 0 "[ . 1]" 1
604 1 26 SER HB3 1 129 VAL MG2 3.341 . 4.736 4.003 3.285 4.560 . 0 0 "[ . 1]" 1
605 1 27 LYS H 1 27 LYS QB 2.646 . 3.521 2.502 2.241 2.611 . 0 0 "[ . 1]" 1
606 1 27 LYS H 1 27 LYS QE 4.085 . 6.171 3.994 3.585 4.670 . 0 0 "[ . 1]" 1
607 1 27 LYS H 1 27 LYS QG 2.804 . 3.787 2.307 2.054 3.967 0.180 4 0 "[ . 1]" 1
608 1 27 LYS H 1 28 ALA H 2.759 . 3.711 2.540 2.467 2.675 . 0 0 "[ . 1]" 1
609 1 27 LYS H 1 29 CYS H 3.723 . 5.456 4.165 3.983 4.311 . 0 0 "[ . 1]" 1
610 1 27 LYS H 1 128 LEU HA 4.073 . 6.147 4.862 4.482 5.040 . 0 0 "[ . 1]" 1
611 1 27 LYS H 1 128 LEU QD 3.456 . 4.949 3.161 2.978 3.641 . 0 0 "[ . 1]" 1
612 1 27 LYS H 1 129 VAL H 3.301 . 4.663 3.479 3.215 3.667 . 0 0 "[ . 1]" 1
613 1 27 LYS H 1 129 VAL MG2 3.100 . 4.301 3.383 3.104 3.558 . 0 0 "[ . 1]" 1
614 1 27 LYS H 1 130 ASP H 4.103 . 6.207 4.912 4.696 5.292 . 0 0 "[ . 1]" 1
615 1 27 LYS H 1 130 ASP HA 3.396 . 4.837 3.362 3.060 3.695 . 0 0 "[ . 1]" 1
616 1 27 LYS HA 1 27 LYS QB 2.494 . 3.271 2.200 2.175 2.384 . 0 0 "[ . 1]" 1
617 1 27 LYS HA 1 27 LYS QE 4.425 . 6.872 4.212 4.078 4.304 . 0 0 "[ . 1]" 1
618 1 27 LYS HA 1 27 LYS QG 2.865 . 3.891 3.260 2.479 3.355 . 0 0 "[ . 1]" 1
619 1 27 LYS HA 1 28 ALA H 3.201 . 4.482 3.360 3.248 3.448 . 0 0 "[ . 1]" 1
620 1 27 LYS HA 1 29 CYS H 3.171 . 4.428 3.352 3.148 3.644 . 0 0 "[ . 1]" 1
621 1 27 LYS HA 1 29 CYS QB 4.340 . 6.694 4.510 4.400 4.723 . 0 0 "[ . 1]" 1
622 1 27 LYS HA 1 101 PRO HA 3.190 . 4.462 4.669 4.239 5.246 0.784 5 3 "[- + * 1]" 1
623 1 27 LYS HA 1 101 PRO HG3 3.815 . 5.634 3.838 3.404 4.497 . 0 0 "[ . 1]" 1
624 1 27 LYS HA 1 128 LEU QD 3.108 . 4.316 2.637 2.257 3.265 . 0 0 "[ . 1]" 1
625 1 27 LYS HA 1 129 VAL H 4.145 . 6.292 5.342 5.244 5.520 . 0 0 "[ . 1]" 1
626 1 27 LYS QB 1 28 ALA H 2.940 . 4.020 3.670 2.993 3.887 . 0 0 "[ . 1]" 1
627 1 27 LYS QB 1 128 LEU QD 2.949 . 4.036 2.037 1.784 2.245 0.078 8 0 "[ . 1]" 1
628 1 27 LYS QB 1 129 VAL H 3.760 . 5.527 4.251 4.037 4.468 . 0 0 "[ . 1]" 1
629 1 27 LYS QB 1 130 ASP HA 2.936 . 4.013 3.944 2.783 4.252 0.239 2 0 "[ . 1]" 1
630 1 27 LYS QD 1 28 ALA H 3.242 . 4.556 4.739 4.377 5.047 0.491 2 0 "[ . 1]" 1
631 1 27 LYS QD 1 130 ASP HA 2.868 . 3.896 3.042 2.506 4.122 0.226 4 0 "[ . 1]" 1
632 1 27 LYS QE 1 128 LEU QD 3.667 . 5.347 2.515 1.948 3.754 0.039 4 0 "[ . 1]" 1
633 1 27 LYS QE 1 129 VAL H 4.041 . 6.082 5.051 4.217 6.859 0.777 8 1 "[ . + 1]" 1
634 1 27 LYS QE 1 130 ASP HA 3.050 . 4.213 3.574 2.410 4.705 0.492 3 0 "[ . 1]" 1
635 1 27 LYS QG 1 29 CYS H 4.000 . 6.000 4.536 4.380 4.799 . 0 0 "[ . 1]" 1
636 1 27 LYS QG 1 129 VAL H 3.001 . 4.127 3.600 3.267 3.753 . 0 0 "[ . 1]" 1
637 1 27 LYS QG 1 128 LEU QD 2.560 . 3.379 3.453 2.470 4.018 0.639 3 1 "[ + . 1]" 1
638 1 28 ALA H 1 28 ALA HA 2.648 . 3.524 2.871 2.830 2.898 . 0 0 "[ . 1]" 1
639 1 28 ALA H 1 28 ALA MB 2.207 . 2.816 2.257 2.232 2.279 . 0 0 "[ . 1]" 1
640 1 28 ALA H 1 29 CYS H 2.549 . 3.361 2.482 2.353 2.650 . 0 0 "[ . 1]" 1
641 1 28 ALA H 1 29 CYS QB 3.659 . 5.332 4.458 4.342 4.612 . 0 0 "[ . 1]" 1
642 1 28 ALA H 1 129 VAL MG2 4.043 . 6.086 4.746 4.451 5.050 . 0 0 "[ . 1]" 1
643 1 28 ALA HA 1 28 ALA MB 2.198 . 2.802 2.129 2.124 2.133 . 0 0 "[ . 1]" 1
644 1 28 ALA HA 1 29 CYS H 2.996 . 4.118 3.298 3.181 3.426 . 0 0 "[ . 1]" 1
645 1 28 ALA MB 1 29 CYS H 2.732 . 3.665 3.174 2.858 3.382 . 0 0 "[ . 1]" 1
646 1 28 ALA MB 1 29 CYS HA 3.644 . 5.304 4.072 4.010 4.134 . 0 0 "[ . 1]" 1
647 1 29 CYS H 1 29 CYS HA 2.833 . 3.836 2.927 2.900 2.943 . 0 0 "[ . 1]" 1
648 1 29 CYS H 1 29 CYS QB 2.339 . 3.023 2.446 2.370 2.516 . 0 0 "[ . 1]" 1
649 1 29 CYS H 1 30 LYS H 4.087 . 6.175 4.505 4.429 4.569 . 0 0 "[ . 1]" 1
650 1 29 CYS H 1 101 PRO HB2 3.475 . 4.985 4.761 4.303 5.469 0.484 5 0 "[ . 1]" 1
651 1 29 CYS H 1 101 PRO HG2 3.795 . 5.595 3.814 3.025 4.997 . 0 0 "[ . 1]" 1
652 1 29 CYS H 1 101 PRO HG3 3.255 . 4.579 4.459 4.004 4.815 0.236 10 0 "[ . 1]" 1
653 1 29 CYS HA 1 29 CYS QB 2.595 . 3.437 2.374 2.350 2.398 . 0 0 "[ . 1]" 1
654 1 29 CYS HA 1 30 LYS H 2.880 . 3.917 2.230 2.186 2.325 . 0 0 "[ . 1]" 1
655 1 29 CYS HA 1 30 LYS HA 3.465 . 4.966 4.340 4.299 4.378 . 0 0 "[ . 1]" 1
656 1 29 CYS HA 1 30 LYS QB 3.561 . 5.146 4.228 4.059 4.537 . 0 0 "[ . 1]" 1
657 1 29 CYS QB 1 30 LYS H 3.843 . 5.690 2.885 2.688 3.014 . 0 0 "[ . 1]" 1
658 1 29 CYS QB 1 31 GLU H 2.783 . 3.751 2.925 2.710 3.136 . 0 0 "[ . 1]" 1
659 1 29 CYS QB 1 32 PHE H 4.101 . 6.203 4.766 4.587 5.031 . 0 0 "[ . 1]" 1
660 1 29 CYS QB 1 32 PHE HA 3.711 . 5.432 3.911 3.611 4.159 . 0 0 "[ . 1]" 1
661 1 29 CYS QB 1 32 PHE QB 3.912 . 5.825 3.527 3.303 3.796 . 0 0 "[ . 1]" 1
662 1 29 CYS QB 1 32 PHE QD 2.963 . 4.061 3.278 2.987 3.458 . 0 0 "[ . 1]" 1
663 1 29 CYS QB 1 33 THR H 4.372 . 6.761 5.625 5.330 5.936 . 0 0 "[ . 1]" 1
664 1 29 CYS QB 1 101 PRO HG2 3.593 . 5.206 3.445 2.684 4.917 . 0 0 "[ . 1]" 1
665 1 29 CYS QB 1 101 PRO HG3 3.095 . 4.293 3.384 3.146 3.697 . 0 0 "[ . 1]" 1
666 1 30 LYS H 1 30 LYS QB 2.919 . 3.984 2.330 2.225 2.489 . 0 0 "[ . 1]" 1
667 1 30 LYS H 1 30 LYS QD 3.549 . 5.124 3.880 2.066 4.663 . 0 0 "[ . 1]" 1
668 1 30 LYS H 1 30 LYS QG 4.360 . 6.736 3.410 2.122 4.051 . 0 0 "[ . 1]" 1
669 1 30 LYS H 1 31 GLU H 2.883 . 3.922 2.436 2.228 2.698 . 0 0 "[ . 1]" 1
670 1 30 LYS H 1 31 GLU QG 4.807 . 7.695 4.757 4.163 5.242 . 0 0 "[ . 1]" 1
671 1 30 LYS HA 1 30 LYS QB 2.489 . 3.264 2.363 2.330 2.417 . 0 0 "[ . 1]" 1
672 1 30 LYS HA 1 30 LYS QD 3.131 . 4.356 3.190 2.002 4.243 . 0 0 "[ . 1]" 1
673 1 30 LYS HA 1 30 LYS QG 3.282 . 4.628 2.691 2.435 3.054 . 0 0 "[ . 1]" 1
674 1 30 LYS HA 1 31 GLU H 3.007 . 4.137 3.499 3.437 3.546 . 0 0 "[ . 1]" 1
675 1 30 LYS QB 1 31 GLU H 2.351 . 3.042 2.400 2.182 2.642 . 0 0 "[ . 1]" 1
676 1 30 LYS QD 1 31 GLU H 3.517 . 5.063 4.563 3.934 4.894 . 0 0 "[ . 1]" 1
677 1 31 GLU H 1 31 GLU HA 2.788 . 3.759 2.920 2.879 2.946 . 0 0 "[ . 1]" 1
678 1 31 GLU H 1 31 GLU QB 3.201 . 4.482 2.814 2.627 3.217 . 0 0 "[ . 1]" 1
679 1 31 GLU H 1 31 GLU QG 3.015 . 4.151 3.054 2.574 3.274 . 0 0 "[ . 1]" 1
680 1 31 GLU H 1 32 PHE H 3.564 . 5.152 4.314 4.241 4.385 . 0 0 "[ . 1]" 1
681 1 31 GLU H 1 32 PHE HA 4.113 . 6.228 4.693 4.586 4.818 . 0 0 "[ . 1]" 1
682 1 31 GLU H 1 101 PRO HD2 4.053 . 6.106 4.956 4.359 5.592 . 0 0 "[ . 1]" 1
683 1 31 GLU H 1 101 PRO HD3 4.092 . 6.185 4.636 4.366 5.021 . 0 0 "[ . 1]" 1
684 1 31 GLU HA 1 31 GLU QB 2.642 . 3.515 2.324 2.179 2.413 . 0 0 "[ . 1]" 1
685 1 31 GLU HA 1 31 GLU QG 2.987 . 4.102 2.789 2.389 3.493 . 0 0 "[ . 1]" 1
686 1 31 GLU HA 1 32 PHE H 2.341 . 3.026 2.223 2.145 2.296 . 0 0 "[ . 1]" 1
687 1 31 GLU HA 1 32 PHE HA 3.437 . 4.914 4.394 4.383 4.415 . 0 0 "[ . 1]" 1
688 1 31 GLU HA 1 32 PHE QB 3.902 . 5.805 4.005 3.918 4.087 . 0 0 "[ . 1]" 1
689 1 31 GLU HA 1 98 THR MG 3.427 . 4.895 3.917 3.285 4.910 0.015 6 0 "[ . 1]" 1
690 1 31 GLU HA 1 100 ASP HA 3.108 . 4.315 3.182 2.764 3.789 . 0 0 "[ . 1]" 1
691 1 31 GLU HA 1 101 PRO HD2 3.247 . 4.565 3.595 2.940 4.235 . 0 0 "[ . 1]" 1
692 1 31 GLU HA 1 101 PRO HD3 3.032 . 4.181 2.704 2.239 3.223 . 0 0 "[ . 1]" 1
693 1 31 GLU HA 1 101 PRO HG2 4.440 . 6.904 4.500 3.714 5.089 . 0 0 "[ . 1]" 1
694 1 31 GLU HA 1 101 PRO HG3 3.430 . 4.900 4.246 3.816 4.689 . 0 0 "[ . 1]" 1
695 1 31 GLU QB 1 31 GLU QG 2.181 . 2.775 2.058 1.996 2.084 . 0 0 "[ . 1]" 1
696 1 31 GLU QB 1 32 PHE H 2.882 . 3.920 2.919 2.714 3.184 . 0 0 "[ . 1]" 1
697 1 31 GLU QB 1 98 THR HB 3.700 . 5.411 4.041 2.192 4.865 . 0 0 "[ . 1]" 1
698 1 31 GLU QB 1 98 THR MG 2.912 . 3.972 2.370 2.031 2.995 . 0 0 "[ . 1]" 1
699 1 31 GLU QB 1 99 LEU H 3.605 . 5.230 4.257 3.755 4.947 . 0 0 "[ . 1]" 1
700 1 31 GLU QB 1 99 LEU QD 4.078 . 6.157 5.257 4.876 5.879 . 0 0 "[ . 1]" 1
701 1 31 GLU QB 1 99 LEU QD 4.073 . 6.147 3.873 3.651 4.165 . 0 0 "[ . 1]" 1
702 1 31 GLU QB 1 100 ASP HA 3.789 . 5.583 4.715 3.984 5.541 . 0 0 "[ . 1]" 1
703 1 31 GLU QB 1 101 PRO HD2 3.221 . 4.518 3.804 3.709 3.870 . 0 0 "[ . 1]" 1
704 1 31 GLU QG 1 32 PHE H 3.146 . 4.383 3.994 3.710 4.707 0.324 4 0 "[ . 1]" 1
705 1 31 GLU QG 1 98 THR HB 2.962 . 4.059 4.952 3.284 6.042 1.983 4 7 "[ *+* -***]" 1
706 1 31 GLU QG 1 98 THR MG 2.754 . 3.702 3.339 2.554 4.383 0.681 2 1 "[ + . 1]" 1
707 1 31 GLU QG 1 99 LEU H 3.684 . 5.380 5.376 4.767 6.622 1.242 4 1 "[ +. 1]" 1
708 1 32 PHE H 1 32 PHE HA 2.878 . 3.914 2.948 2.944 2.954 . 0 0 "[ . 1]" 1
709 1 32 PHE H 1 32 PHE QB 2.946 . 3.872 2.508 2.440 2.567 . 0 0 "[ . 1]" 1
710 1 32 PHE H 1 32 PHE QD 3.615 . 5.248 4.344 4.298 4.381 . 0 0 "[ . 1]" 1
711 1 32 PHE H 1 33 THR H 3.783 . 5.572 4.322 4.225 4.393 . 0 0 "[ . 1]" 1
712 1 32 PHE H 1 98 THR HB 3.944 . 5.889 5.227 4.002 5.899 0.010 8 0 "[ . 1]" 1
713 1 32 PHE H 1 98 THR MG 3.076 . 4.258 3.266 2.777 4.254 . 0 0 "[ . 1]" 1
714 1 32 PHE H 1 99 LEU H 2.642 . 3.514 2.832 2.595 3.150 . 0 0 "[ . 1]" 1
715 1 32 PHE H 1 99 LEU QB 3.413 . 4.869 4.835 4.638 5.247 0.378 4 0 "[ . 1]" 1
716 1 32 PHE H 1 99 LEU QD 3.320 . 4.698 3.433 3.072 3.899 . 0 0 "[ . 1]" 1
717 1 32 PHE H 1 100 ASP HA 3.821 . 5.646 3.912 3.659 4.148 . 0 0 "[ . 1]" 1
718 1 32 PHE H 1 100 ASP HB2 4.258 . 6.525 6.179 5.708 6.918 0.393 4 0 "[ . 1]" 1
719 1 32 PHE H 1 101 PRO HD2 3.374 . 4.797 4.676 4.236 5.384 0.587 6 1 "[ .+ 1]" 1
720 1 32 PHE H 1 101 PRO HD3 3.168 . 4.423 3.078 2.685 3.623 . 0 0 "[ . 1]" 1
721 1 32 PHE HA 1 32 PHE QB 3.069 . 4.246 2.423 2.409 2.434 . 0 0 "[ . 1]" 1
722 1 32 PHE HA 1 32 PHE QD 3.296 . 4.654 2.806 2.700 2.927 . 0 0 "[ . 1]" 1
723 1 32 PHE HA 1 32 PHE HZ 4.122 . 6.246 5.889 5.842 5.920 . 0 0 "[ . 1]" 1
724 1 32 PHE HA 1 33 THR H 2.579 . 3.411 2.149 2.117 2.176 . 0 0 "[ . 1]" 1
725 1 32 PHE HA 1 33 THR H 2.284 . 2.936 2.099 2.072 2.122 . 0 0 "[ . 1]" 1
726 1 32 PHE HA 1 33 THR HB 3.887 . 5.776 4.599 4.531 4.683 . 0 0 "[ . 1]" 1
727 1 32 PHE HA 1 98 THR MG 3.748 . 5.504 4.199 3.897 4.684 . 0 0 "[ . 1]" 1
728 1 32 PHE QB 1 32 PHE QD 2.554 . 3.369 2.125 2.121 2.128 . 0 0 "[ . 1]" 1
729 1 32 PHE QB 1 33 THR H 3.503 . 4.823 3.740 3.666 3.817 . 0 0 "[ . 1]" 1
730 1 32 PHE QB 1 99 LEU H 3.505 . 5.041 3.352 3.126 3.459 . 0 0 "[ . 1]" 1
731 1 32 PHE QB 1 99 LEU QB 3.860 . 5.723 4.365 4.109 4.673 . 0 0 "[ . 1]" 1
732 1 32 PHE QB 1 99 LEU QD 3.508 . 4.801 2.358 1.971 2.645 0.020 3 0 "[ . 1]" 1
733 1 32 PHE QB 1 99 LEU QD 3.523 . 5.075 2.318 1.958 2.561 0.013 3 0 "[ . 1]" 1
734 1 32 PHE QB 1 99 LEU HG 3.739 . 5.486 2.488 2.010 2.974 . 0 0 "[ . 1]" 1
735 1 32 PHE QB 1 101 PRO HD2 3.969 . 5.939 4.842 4.460 5.395 . 0 0 "[ . 1]" 1
736 1 32 PHE QB 1 101 PRO HD3 4.053 . 5.471 3.457 3.137 3.933 . 0 0 "[ . 1]" 1
737 1 32 PHE QB 1 101 PRO HG2 3.689 . 5.158 4.248 3.629 5.313 0.155 7 0 "[ . 1]" 1
738 1 32 PHE QB 1 101 PRO HG3 3.613 . 5.245 2.864 2.301 3.837 . 0 0 "[ . 1]" 1
739 1 32 PHE QD 1 33 THR H 3.378 . 4.804 3.657 3.528 3.829 . 0 0 "[ . 1]" 1
740 1 32 PHE QD 1 34 ILE H 4.277 . 6.564 4.504 4.205 4.690 . 0 0 "[ . 1]" 1
741 1 32 PHE QD 1 34 ILE MD 2.869 . 3.898 2.893 2.604 3.129 . 0 0 "[ . 1]" 1
742 1 32 PHE QD 1 34 ILE HG12 2.995 . 4.116 3.190 2.834 3.499 . 0 0 "[ . 1]" 1
743 1 32 PHE QD 1 34 ILE HG13 2.765 . 3.721 2.415 2.144 2.589 . 0 0 "[ . 1]" 1
744 1 32 PHE QD 1 53 ILE MD 3.039 . 4.193 4.558 4.086 5.574 1.381 9 3 "[ - .* +1]" 1
745 1 32 PHE QD 1 99 LEU QD 4.080 . 4.169 2.802 2.139 3.171 . 0 0 "[ . 1]" 1
746 1 32 PHE QE 1 34 ILE MD 2.865 . 3.891 2.695 2.391 3.008 . 0 0 "[ . 1]" 1
747 1 32 PHE QE 1 34 ILE HG12 2.700 . 3.611 2.191 2.032 2.326 . 0 0 "[ . 1]" 1
748 1 32 PHE QE 1 34 ILE HG13 2.739 . 3.677 2.988 2.547 3.181 . 0 0 "[ . 1]" 1
749 1 32 PHE QE 1 34 ILE MG 3.307 . 4.674 3.645 3.474 3.781 . 0 0 "[ . 1]" 1
750 1 32 PHE QE 1 99 LEU QD 4.564 . 7.168 4.134 3.700 4.497 . 0 0 "[ . 1]" 1
751 1 33 THR H 1 33 THR HB 2.632 . 3.498 2.597 2.561 2.625 . 0 0 "[ . 1]" 1
752 1 33 THR H 1 34 ILE H 3.711 . 5.432 4.397 4.267 4.451 . 0 0 "[ . 1]" 1
753 1 33 THR H 1 34 ILE MD 4.263 . 6.535 5.813 5.640 5.952 . 0 0 "[ . 1]" 1
754 1 33 THR HA 1 33 THR MG 2.600 . 3.445 2.383 2.344 2.422 . 0 0 "[ . 1]" 1
755 1 33 THR HA 1 34 ILE H 2.341 . 3.026 2.148 2.136 2.162 . 0 0 "[ . 1]" 1
756 1 33 THR HA 1 34 ILE HA 3.479 . 4.992 4.389 4.380 4.399 . 0 0 "[ . 1]" 1
757 1 33 THR HA 1 34 ILE HB 4.061 . 6.123 4.604 4.547 4.659 . 0 0 "[ . 1]" 1
758 1 33 THR HA 1 34 ILE HB 3.747 . 5.502 4.407 4.349 4.473 . 0 0 "[ . 1]" 1
759 1 33 THR HA 1 34 ILE MD 4.242 . 6.491 5.106 4.977 5.279 . 0 0 "[ . 1]" 1
760 1 33 THR HA 1 34 ILE HG13 4.120 . 6.242 3.805 3.674 4.017 . 0 0 "[ . 1]" 1
761 1 33 THR HA 1 97 LEU H 3.583 . 5.188 4.287 4.077 4.415 . 0 0 "[ . 1]" 1
762 1 33 THR HA 1 97 LEU MD1 3.248 . 4.566 3.319 3.127 3.557 . 0 0 "[ . 1]" 1
763 1 33 THR HA 1 97 LEU HG 3.961 . 5.923 5.009 4.909 5.090 . 0 0 "[ . 1]" 1
764 1 33 THR HA 1 99 LEU H 3.405 . 4.854 3.724 3.448 4.114 . 0 0 "[ . 1]" 1
765 1 33 THR HA 1 99 LEU QD 3.761 . 5.530 4.674 4.249 5.079 . 0 0 "[ . 1]" 1
766 1 33 THR HB 1 33 THR MG 2.306 . 2.971 2.136 2.135 2.137 . 0 0 "[ . 1]" 1
767 1 33 THR HB 1 34 ILE H 3.368 . 4.786 4.140 4.070 4.315 . 0 0 "[ . 1]" 1
768 1 33 THR MG 1 34 ILE H 2.651 . 3.530 2.661 2.536 3.090 . 0 0 "[ . 1]" 1
769 1 33 THR MG 1 34 ILE HB 4.225 . 6.456 4.658 4.550 4.928 . 0 0 "[ . 1]" 1
770 1 33 THR MG 1 96 SER HB2 2.825 . 3.823 3.356 2.470 3.811 . 0 0 "[ . 1]" 1
771 1 33 THR MG 1 96 SER HB3 2.727 . 3.657 2.905 2.408 3.881 0.224 10 0 "[ . 1]" 1
772 1 33 THR MG 1 97 LEU H 3.037 . 4.190 3.284 3.048 3.453 . 0 0 "[ . 1]" 1
773 1 34 ILE H 1 34 ILE HB 2.849 . 3.864 2.621 2.542 2.674 . 0 0 "[ . 1]" 1
774 1 34 ILE H 1 34 ILE MD 3.897 . 5.795 4.024 3.877 4.133 . 0 0 "[ . 1]" 1
775 1 34 ILE H 1 34 ILE HG12 3.410 . 4.863 3.914 3.770 3.978 . 0 0 "[ . 1]" 1
776 1 34 ILE H 1 34 ILE HG13 3.265 . 4.598 2.801 2.602 2.909 . 0 0 "[ . 1]" 1
777 1 34 ILE H 1 34 ILE MG 3.188 . 4.459 3.840 3.809 3.861 . 0 0 "[ . 1]" 1
778 1 34 ILE H 1 35 THR HA 3.769 . 5.544 4.861 4.766 5.013 . 0 0 "[ . 1]" 1
779 1 34 ILE H 1 96 SER HA 3.981 . 5.962 4.596 4.466 4.759 . 0 0 "[ . 1]" 1
780 1 34 ILE H 1 96 SER HB2 4.259 . 6.527 5.232 3.879 5.867 . 0 0 "[ . 1]" 1
781 1 34 ILE H 1 96 SER HB3 4.471 . 6.970 4.480 3.992 5.546 . 0 0 "[ . 1]" 1
782 1 34 ILE H 1 97 LEU H 2.951 . 4.040 2.772 2.654 2.897 . 0 0 "[ . 1]" 1
783 1 34 ILE H 1 97 LEU MD1 3.403 . 4.851 2.519 2.415 2.598 . 0 0 "[ . 1]" 1
784 1 34 ILE H 1 97 LEU QD 2.716 . 3.638 2.508 2.406 2.585 . 0 0 "[ . 1]" 1
785 1 34 ILE H 1 97 LEU HG 3.181 . 4.445 3.249 3.180 3.344 . 0 0 "[ . 1]" 1
786 1 34 ILE H 1 98 THR HA 3.272 . 4.610 3.490 3.348 3.686 . 0 0 "[ . 1]" 1
787 1 34 ILE H 1 99 LEU H 3.823 . 5.650 4.914 4.624 5.189 . 0 0 "[ . 1]" 1
788 1 34 ILE HA 1 34 ILE MD 3.500 . 5.031 3.830 3.805 3.850 . 0 0 "[ . 1]" 1
789 1 34 ILE HA 1 34 ILE MG 2.904 . 3.958 2.411 2.393 2.435 . 0 0 "[ . 1]" 1
790 1 34 ILE HB 1 34 ILE MD 2.703 . 3.617 2.442 2.424 2.459 . 0 0 "[ . 1]" 1
791 1 34 ILE HB 1 97 LEU H 3.814 . 5.632 3.428 3.317 3.521 . 0 0 "[ . 1]" 1
792 1 34 ILE HB 1 97 LEU QD 2.542 . 3.350 2.183 2.072 2.271 . 0 0 "[ . 1]" 1
793 1 34 ILE HB 1 97 LEU HG 2.903 . 3.956 2.275 2.186 2.438 . 0 0 "[ . 1]" 1
794 1 34 ILE MD 1 34 ILE HG12 2.452 . 3.204 2.119 2.118 2.121 . 0 0 "[ . 1]" 1
795 1 34 ILE MD 1 34 ILE MG 2.421 . 3.154 1.951 1.933 1.972 . 0 0 "[ . 1]" 1
796 1 34 ILE MD 1 51 LEU QD 2.473 . 3.238 2.488 2.321 2.688 . 0 0 "[ . 1]" 1
797 1 34 ILE HG12 1 34 ILE MG 2.830 . 3.831 2.402 2.373 2.424 . 0 0 "[ . 1]" 1
798 1 34 ILE HG12 1 35 THR H 3.505 . 5.041 4.399 4.330 4.463 . 0 0 "[ . 1]" 1
799 1 34 ILE HG13 1 34 ILE MG 3.183 . 4.449 3.212 3.208 3.214 . 0 0 "[ . 1]" 1
800 1 34 ILE MG 1 35 THR H 2.676 . 3.571 2.734 2.610 2.826 . 0 0 "[ . 1]" 1
801 1 34 ILE MG 1 35 THR HB 4.073 . 6.147 4.633 4.520 4.719 . 0 0 "[ . 1]" 1
802 1 34 ILE MG 1 36 LEU H 3.896 . 5.793 4.001 3.884 4.119 . 0 0 "[ . 1]" 1
803 1 34 ILE MG 1 36 LEU HB2 4.380 . 6.778 3.071 2.839 3.174 . 0 0 "[ . 1]" 1
804 1 34 ILE MG 1 36 LEU HB3 4.149 . 6.301 4.931 4.602 5.046 . 0 0 "[ . 1]" 1
805 1 34 ILE MG 1 36 LEU QD 3.544 . 5.114 2.329 2.220 2.567 . 0 0 "[ . 1]" 1
806 1 34 ILE MG 1 51 LEU H 3.981 . 5.962 6.015 5.703 6.372 0.410 4 0 "[ . 1]" 1
807 1 34 ILE MG 1 51 LEU QD 2.885 . 3.926 2.133 1.938 2.324 . 0 0 "[ . 1]" 1
808 1 34 ILE MG 1 96 SER HA 4.040 . 6.080 4.327 4.210 4.439 . 0 0 "[ . 1]" 1
809 1 34 ILE MG 1 97 LEU H 3.447 . 4.932 4.214 4.091 4.317 . 0 0 "[ . 1]" 1
810 1 34 ILE MG 1 97 LEU HG 3.626 . 5.269 3.520 3.407 3.610 . 0 0 "[ . 1]" 1
811 1 35 THR H 1 35 THR HB 2.653 . 3.533 2.567 2.517 2.631 . 0 0 "[ . 1]" 1
812 1 35 THR H 1 36 LEU H 3.793 . 5.591 4.371 4.340 4.388 . 0 0 "[ . 1]" 1
813 1 35 THR H 1 96 SER HA 4.157 . 6.317 4.706 4.629 4.776 . 0 0 "[ . 1]" 1
814 1 35 THR HA 1 35 THR MG 2.732 . 3.665 2.403 2.343 2.449 . 0 0 "[ . 1]" 1
815 1 35 THR HA 1 36 LEU H 2.466 . 3.226 2.137 2.120 2.149 . 0 0 "[ . 1]" 1
816 1 35 THR HA 1 36 LEU HB2 4.198 . 6.401 3.987 3.801 4.169 . 0 0 "[ . 1]" 1
817 1 35 THR HA 1 96 SER HA 2.643 . 3.516 2.252 2.109 2.325 . 0 0 "[ . 1]" 1
818 1 35 THR HA 1 96 SER HB2 3.377 . 4.802 3.922 3.225 4.306 . 0 0 "[ . 1]" 1
819 1 35 THR HA 1 96 SER HB3 3.311 . 4.682 2.955 2.372 3.367 . 0 0 "[ . 1]" 1
820 1 35 THR HA 1 97 LEU H 3.147 . 4.385 3.741 3.638 3.845 . 0 0 "[ . 1]" 1
821 1 35 THR HB 1 35 THR MG 2.298 . 2.958 2.137 2.135 2.139 . 0 0 "[ . 1]" 1
822 1 35 THR HB 1 36 LEU H 3.919 . 5.839 4.223 4.146 4.296 . 0 0 "[ . 1]" 1
823 1 35 THR MG 1 36 LEU H 2.501 . 3.283 2.763 2.700 2.854 . 0 0 "[ . 1]" 1
824 1 35 THR MG 1 38 HIS H 4.211 . 6.428 5.007 4.865 5.411 . 0 0 "[ . 1]" 1
825 1 35 THR MG 1 94 GLU HA 3.655 . 5.325 3.975 3.836 4.240 . 0 0 "[ . 1]" 1
826 1 35 THR MG 1 37 LYS HB2 3.704 . 5.419 4.176 3.224 4.902 . 0 0 "[ . 1]" 1
827 1 35 THR MG 1 37 LYS HB3 3.547 . 5.120 4.867 4.468 5.072 . 0 0 "[ . 1]" 1
828 1 35 THR MG 1 37 LYS QD 2.754 . 3.702 3.418 2.863 4.031 0.329 7 0 "[ . 1]" 1
829 1 35 THR MG 1 94 GLU HB3 3.268 . 4.603 3.956 2.946 4.421 . 0 0 "[ . 1]" 1
830 1 36 LEU H 1 36 LEU HB2 2.782 . 3.749 2.790 2.683 2.908 . 0 0 "[ . 1]" 1
831 1 36 LEU H 1 36 LEU HB3 3.467 . 4.969 2.537 2.502 2.570 . 0 0 "[ . 1]" 1
832 1 36 LEU H 1 36 LEU QD 4.060 . 4.640 3.839 3.797 3.873 . 0 0 "[ . 1]" 1
833 1 36 LEU H 1 36 LEU HG 3.589 . 5.199 4.470 4.421 4.497 . 0 0 "[ . 1]" 1
834 1 36 LEU H 1 37 LYS H 3.822 . 5.648 4.411 4.371 4.447 . 0 0 "[ . 1]" 1
835 1 36 LEU H 1 37 LYS QG 4.189 . 6.382 5.425 4.374 7.015 0.633 8 2 "[- . + 1]" 1
836 1 36 LEU H 1 51 LEU QD 4.798 . 7.676 4.992 4.875 5.122 . 0 0 "[ . 1]" 1
837 1 36 LEU H 1 86 THR H 4.336 . 6.686 4.860 4.780 4.979 . 0 0 "[ . 1]" 1
838 1 36 LEU H 1 86 THR MG 3.243 . 4.558 3.254 3.018 3.432 . 0 0 "[ . 1]" 1
839 1 36 LEU H 1 95 SER H 3.063 . 4.236 3.060 2.927 3.197 . 0 0 "[ . 1]" 1
840 1 36 LEU H 1 95 SER QB 4.536 . 7.108 4.345 4.094 4.727 . 0 0 "[ . 1]" 1
841 1 36 LEU H 1 96 SER H 4.475 . 6.979 4.697 4.506 4.766 . 0 0 "[ . 1]" 1
842 1 36 LEU H 1 96 SER HA 3.001 . 4.127 2.966 2.808 3.114 . 0 0 "[ . 1]" 1
843 1 36 LEU H 1 96 SER HB2 4.004 . 6.008 5.257 4.940 5.520 . 0 0 "[ . 1]" 1
844 1 36 LEU H 1 96 SER HB3 3.996 . 5.992 4.559 3.825 5.058 . 0 0 "[ . 1]" 1
845 1 36 LEU HA 1 36 LEU QD 2.845 . 3.856 2.142 2.117 2.208 . 0 0 "[ . 1]" 1
846 1 36 LEU HA 1 37 LYS H 2.539 . 3.345 2.150 2.131 2.168 . 0 0 "[ . 1]" 1
847 1 36 LEU HA 1 37 LYS QG 4.071 . 6.142 4.635 3.577 5.912 . 0 0 "[ . 1]" 1
848 1 36 LEU HA 1 51 LEU QD 4.219 . 6.443 4.201 4.028 4.339 . 0 0 "[ . 1]" 1
849 1 36 LEU HA 1 86 THR MG 3.770 . 5.546 4.660 4.537 4.860 . 0 0 "[ . 1]" 1
850 1 36 LEU HA 1 95 SER H 4.180 . 6.364 4.788 4.636 4.840 . 0 0 "[ . 1]" 1
851 1 36 LEU HB2 1 36 LEU QD 3.018 . 4.156 2.112 2.099 2.120 . 0 0 "[ . 1]" 1
852 1 36 LEU HB2 1 37 LYS H 4.323 . 6.659 4.289 4.242 4.337 . 0 0 "[ . 1]" 1
853 1 36 LEU HB2 1 38 HIS H 4.278 . 6.565 5.441 4.758 5.803 . 0 0 "[ . 1]" 1
854 1 36 LEU HB2 1 51 LEU H 4.425 . 6.872 4.624 4.247 4.907 . 0 0 "[ . 1]" 1
855 1 36 LEU HB2 1 51 LEU HB2 4.013 . 6.026 3.404 3.257 3.565 . 0 0 "[ . 1]" 1
856 1 36 LEU HB2 1 51 LEU QD 4.274 . 6.557 3.313 3.047 3.460 . 0 0 "[ . 1]" 1
857 1 36 LEU HB2 1 86 THR MG 3.377 . 4.803 2.659 2.540 2.854 . 0 0 "[ . 1]" 1
858 1 36 LEU HB2 1 95 SER QB 3.704 . 5.419 3.058 2.594 3.791 . 0 0 "[ . 1]" 1
859 1 36 LEU HB2 1 89 ILE MD 3.237 . 4.547 4.024 3.918 4.255 . 0 0 "[ . 1]" 1
860 1 36 LEU HB2 1 95 SER H 4.342 . 6.699 4.549 4.450 4.864 . 0 0 "[ . 1]" 1
861 1 36 LEU HB2 1 96 SER H 4.255 . 6.518 6.442 5.976 6.700 0.182 7 0 "[ . 1]" 1
862 1 36 LEU HB2 1 96 SER HA 4.366 . 6.749 4.736 4.531 4.853 . 0 0 "[ . 1]" 1
863 1 36 LEU HB3 1 36 LEU QD 3.012 . 4.146 2.234 2.223 2.249 . 0 0 "[ . 1]" 1
864 1 36 LEU HB3 1 37 LYS H 4.236 . 6.479 4.163 4.099 4.218 . 0 0 "[ . 1]" 1
865 1 36 LEU HB3 1 51 LEU H 3.422 . 4.886 3.828 3.578 4.557 . 0 0 "[ . 1]" 1
866 1 36 LEU HB3 1 51 LEU HB2 3.815 . 5.634 4.640 4.427 4.826 . 0 0 "[ . 1]" 1
867 1 36 LEU HB3 1 51 LEU HB3 3.969 . 5.938 4.738 4.311 4.989 . 0 0 "[ . 1]" 1
868 1 36 LEU HB3 1 51 LEU QD 4.121 . 6.244 4.642 4.331 4.785 . 0 0 "[ . 1]" 1
869 1 36 LEU HB3 1 86 THR HB 4.474 . 6.976 3.838 3.535 4.024 . 0 0 "[ . 1]" 1
870 1 36 LEU HB3 1 86 THR MG 2.658 . 3.541 2.834 2.422 3.076 . 0 0 "[ . 1]" 1
871 1 36 LEU HB3 1 89 ILE MD 3.341 . 4.736 2.743 2.626 3.063 . 0 0 "[ . 1]" 1
872 1 36 LEU HB3 1 95 SER H 2.927 . 3.998 3.006 2.828 3.299 . 0 0 "[ . 1]" 1
873 1 36 LEU HB3 1 95 SER QB 4.121 . 6.244 3.570 3.099 4.300 . 0 0 "[ . 1]" 1
874 1 36 LEU HB3 1 96 SER H 3.782 . 5.570 5.637 5.148 5.856 0.286 8 0 "[ . 1]" 1
875 1 36 LEU HB3 1 96 SER HA 3.103 . 4.307 4.685 4.410 4.925 0.618 2 1 "[ + . 1]" 1
876 1 36 LEU QD 1 36 LEU HG 2.821 . 3.816 1.893 1.892 1.894 . 0 0 "[ . 1]" 1
877 1 36 LEU QD 1 37 LYS H . . 3.927 2.683 2.602 2.795 . 0 0 "[ . 1]" 1
878 1 36 LEU QD 1 38 HIS HA 3.689 . 5.390 4.295 4.151 4.460 . 0 0 "[ . 1]" 1
879 1 36 LEU QD 1 49 HIS HB2 3.297 . 4.656 2.896 2.788 3.115 . 0 0 "[ . 1]" 1
880 1 36 LEU QD 1 49 HIS HB3 3.338 . 4.731 2.741 2.670 2.827 . 0 0 "[ . 1]" 1
881 1 36 LEU QD 1 49 HIS HD2 3.897 . 5.796 4.476 4.386 4.569 . 0 0 "[ . 1]" 1
882 1 36 LEU QD 1 50 ASN HA 2.816 . 3.807 2.450 2.268 2.817 . 0 0 "[ . 1]" 1
883 1 36 LEU QD 1 51 LEU H 3.002 . 4.128 2.782 2.543 3.023 . 0 0 "[ . 1]" 1
884 1 36 LEU QD 1 51 LEU HB2 3.309 . 4.677 2.179 1.987 2.373 . 0 0 "[ . 1]" 1
885 1 36 LEU QD 1 51 LEU HB3 3.406 . 4.856 2.980 2.665 3.169 . 0 0 "[ . 1]" 1
886 1 36 LEU QD 1 51 LEU QD 4.211 . 4.335 2.351 2.234 2.604 . 0 0 "[ . 1]" 1
887 1 36 LEU QD 1 51 LEU HG 3.690 . 5.392 4.029 3.903 4.261 . 0 0 "[ . 1]" 1
888 1 36 LEU QD 1 86 THR MG 2.853 . 3.871 3.052 2.857 3.212 . 0 0 "[ . 1]" 1
889 1 36 LEU QD 1 97 LEU H 4.236 . 6.479 6.327 6.172 6.534 0.055 6 0 "[ . 1]" 1
890 1 36 LEU HG 1 89 ILE MD 2.811 . 3.799 2.253 2.068 2.431 . 0 0 "[ . 1]" 1
891 1 37 LYS H 1 37 LYS HB2 3.497 . 5.026 2.760 2.487 3.110 . 0 0 "[ . 1]" 1
892 1 37 LYS H 1 37 LYS HB3 3.334 . 4.724 3.341 2.656 3.796 . 0 0 "[ . 1]" 1
893 1 37 LYS H 1 37 LYS HB3 3.020 . 4.160 2.728 2.627 2.860 . 0 0 "[ . 1]" 1
894 1 37 LYS H 1 38 HIS H 3.632 . 5.281 4.202 4.144 4.289 . 0 0 "[ . 1]" 1
895 1 37 LYS H 1 89 ILE MD 3.811 . 5.627 4.184 3.877 4.383 . 0 0 "[ . 1]" 1
896 1 37 LYS H 1 94 GLU HA 4.425 . 6.873 5.091 4.896 5.281 . 0 0 "[ . 1]" 1
897 1 37 LYS H 1 95 SER H 3.806 . 5.616 5.152 4.917 5.259 . 0 0 "[ . 1]" 1
898 1 37 LYS HA 1 37 LYS HB2 2.994 . 4.114 2.536 2.230 2.886 . 0 0 "[ . 1]" 1
899 1 37 LYS HA 1 37 LYS QD 3.156 . 4.401 2.700 2.043 3.926 . 0 0 "[ . 1]" 1
900 1 37 LYS HA 1 38 HIS H 2.409 . 3.134 2.154 2.119 2.198 . 0 0 "[ . 1]" 1
901 1 37 LYS HA 1 89 ILE MD 3.336 . 4.727 3.206 2.709 3.461 . 0 0 "[ . 1]" 1
902 1 37 LYS HA 1 94 GLU HA 2.804 . 3.787 2.773 2.290 3.076 . 0 0 "[ . 1]" 1
903 1 37 LYS HA 1 94 GLU HB2 3.525 . 5.079 3.519 3.072 4.738 . 0 0 "[ . 1]" 1
904 1 37 LYS HA 1 94 GLU HB3 3.647 . 5.309 2.933 2.501 3.628 . 0 0 "[ . 1]" 1
905 1 37 LYS HB2 1 37 LYS QD 2.817 . 3.809 2.820 2.229 3.313 . 0 0 "[ . 1]" 1
906 1 37 LYS HB2 1 37 LYS QE 3.623 . 5.264 4.181 3.881 4.507 . 0 0 "[ . 1]" 1
907 1 37 LYS HB2 1 38 HIS H 3.592 . 5.205 4.376 4.221 4.435 . 0 0 "[ . 1]" 1
908 1 37 LYS HB3 1 37 LYS QD 2.841 . 3.850 2.558 2.199 3.322 . 0 0 "[ . 1]" 1
909 1 37 LYS HB3 1 37 LYS QE 3.900 . 5.801 4.148 3.865 4.307 . 0 0 "[ . 1]" 1
910 1 37 LYS HB3 1 38 HIS H 3.179 . 4.442 3.189 2.587 3.398 . 0 0 "[ . 1]" 1
911 1 37 LYS HB3 1 38 HIS H 3.989 . 5.978 3.891 3.624 4.331 . 0 0 "[ . 1]" 1
912 1 37 LYS QD 1 37 LYS QE 2.927 . 3.998 2.043 2.008 2.091 . 0 0 "[ . 1]" 1
913 1 37 LYS QD 1 38 HIS H 3.385 . 4.817 4.056 2.768 5.399 0.582 6 1 "[ .+ 1]" 1
914 1 37 LYS QD 1 94 GLU HA 3.664 . 5.342 3.998 3.276 5.442 0.100 6 0 "[ . 1]" 1
915 1 37 LYS QD 1 94 GLU HG2 3.089 . 4.282 3.647 2.889 4.161 . 0 0 "[ . 1]" 1
916 1 37 LYS QD 1 95 SER H 3.805 . 5.615 4.890 4.010 6.276 0.661 4 2 "[ +.- 1]" 1
917 1 37 LYS QG 1 95 SER H 3.748 . 5.504 4.359 3.951 4.618 . 0 0 "[ . 1]" 1
918 1 38 HIS H 1 38 HIS HB2 2.975 . 4.082 2.783 2.707 2.923 . 0 0 "[ . 1]" 1
919 1 38 HIS H 1 38 HIS HB3 2.893 . 3.939 2.543 2.485 2.610 . 0 0 "[ . 1]" 1
920 1 38 HIS H 1 38 HIS HB3 3.020 . 4.160 2.463 2.348 2.555 . 0 0 "[ . 1]" 1
921 1 38 HIS H 1 38 HIS HD2 4.712 . 7.488 5.375 5.304 5.436 . 0 0 "[ . 1]" 1
922 1 38 HIS H 1 39 THR H 3.687 . 5.386 4.086 4.016 4.209 . 0 0 "[ . 1]" 1
923 1 38 HIS H 1 89 ILE MD 2.795 . 3.771 2.359 2.147 2.519 . 0 0 "[ . 1]" 1
924 1 38 HIS H 1 93 GLU H 3.745 . 5.498 4.293 3.850 4.598 . 0 0 "[ . 1]" 1
925 1 38 HIS H 1 94 GLU HA 3.184 . 4.451 3.139 2.974 3.257 . 0 0 "[ . 1]" 1
926 1 38 HIS H 1 94 GLU HB3 3.112 . 4.323 4.074 3.607 5.209 0.886 6 2 "[ -.+ 1]" 1
927 1 38 HIS H 1 95 SER H 4.141 . 6.284 4.923 4.798 5.062 . 0 0 "[ . 1]" 1
928 1 38 HIS HA 1 39 THR H 2.473 . 3.237 2.173 2.145 2.190 . 0 0 "[ . 1]" 1
929 1 38 HIS HA 1 39 THR MG 3.349 . 4.751 4.100 3.706 5.489 0.738 6 1 "[ .+ 1]" 1
930 1 38 HIS HA 1 40 GLY H 3.512 . 5.054 4.840 3.340 6.106 1.052 8 4 "[ **. +-1]" 1
931 1 38 HIS HA 1 49 HIS HD2 3.354 . 4.760 3.761 3.405 3.873 . 0 0 "[ . 1]" 1
932 1 38 HIS HA 1 89 ILE MD 3.892 . 5.786 3.845 3.614 3.988 . 0 0 "[ . 1]" 1
933 1 38 HIS HB2 1 38 HIS HD2 3.730 . 5.469 3.134 2.998 3.272 . 0 0 "[ . 1]" 1
934 1 38 HIS HB2 1 39 THR H 3.672 . 5.358 4.501 4.460 4.530 . 0 0 "[ . 1]" 1
935 1 38 HIS HB2 1 89 ILE MD 3.054 . 4.220 2.363 2.240 2.513 . 0 0 "[ . 1]" 1
936 1 38 HIS HB2 1 89 ILE QG 3.360 . 4.771 2.430 2.078 2.587 . 0 0 "[ . 1]" 1
937 1 38 HIS HB2 1 90 GLY H 4.381 . 6.781 5.799 5.414 5.983 . 0 0 "[ . 1]" 1
938 1 38 HIS HB2 1 92 GLY H 2.702 . 3.614 2.194 2.096 2.857 . 0 0 "[ . 1]" 1
939 1 38 HIS HB2 1 92 GLY HA3 4.325 . 6.663 3.911 3.883 3.933 . 0 0 "[ . 1]" 1
940 1 38 HIS HB2 1 93 GLU H 3.265 . 4.598 4.861 4.548 5.056 0.458 1 0 "[ . 1]" 1
941 1 38 HIS HB3 1 38 HIS HD2 3.842 . 5.687 2.949 2.849 3.082 . 0 0 "[ . 1]" 1
942 1 38 HIS HB3 1 39 THR H 4.066 . 6.132 4.433 4.399 4.448 . 0 0 "[ . 1]" 1
943 1 38 HIS HB3 1 40 GLY H 4.571 . 7.183 5.058 3.781 6.386 . 0 0 "[ . 1]" 1
944 1 38 HIS HB3 1 91 GLY QA 4.119 . 6.240 3.735 3.084 4.716 . 0 0 "[ . 1]" 1
945 1 38 HIS HB3 1 49 HIS HD2 3.994 . 5.988 4.512 4.202 4.717 . 0 0 "[ . 1]" 1
946 1 38 HIS HB3 1 89 ILE MD 3.163 . 4.413 2.778 2.662 3.060 . 0 0 "[ . 1]" 1
947 1 38 HIS HB3 1 89 ILE QG 3.391 . 4.828 3.128 2.902 3.502 . 0 0 "[ . 1]" 1
948 1 38 HIS HB3 1 91 GLY QA 3.964 . 5.928 3.846 3.091 5.365 . 0 0 "[ . 1]" 1
949 1 38 HIS HB3 1 92 GLY H 3.277 . 4.619 3.373 2.889 3.945 . 0 0 "[ . 1]" 1
950 1 38 HIS HB3 1 93 GLU H 3.150 . 4.390 3.202 2.845 3.478 . 0 0 "[ . 1]" 1
951 1 38 HIS HD2 1 48 GLY QA 4.068 . 5.797 3.187 2.883 3.500 . 0 0 "[ . 1]" 1
952 1 38 HIS HD2 1 49 HIS H 3.256 . 4.581 3.487 2.932 4.041 . 0 0 "[ . 1]" 1
953 1 38 HIS HD2 1 49 HIS HB3 4.337 . 6.688 5.764 5.214 6.357 . 0 0 "[ . 1]" 1
954 1 38 HIS HD2 1 49 HIS HD2 5.022 . 8.174 3.599 3.227 3.958 . 0 0 "[ . 1]" 1
955 1 38 HIS HD2 1 89 ILE HB 3.063 . 4.236 2.905 2.709 3.042 . 0 0 "[ . 1]" 1
956 1 38 HIS HD2 1 93 GLU HB2 3.524 . 5.077 3.765 3.095 4.260 . 0 0 "[ . 1]" 1
957 1 38 HIS HD2 1 89 ILE QG 3.932 . 5.865 3.218 2.950 3.644 . 0 0 "[ . 1]" 1
958 1 38 HIS HD2 1 90 GLY H 4.352 . 6.720 4.244 4.086 4.370 . 0 0 "[ . 1]" 1
959 1 38 HIS HD2 1 90 GLY HA2 3.583 . 5.187 2.374 1.811 2.769 0.168 7 0 "[ . 1]" 1
960 1 38 HIS HD2 1 90 GLY HA3 3.487 . 5.007 3.888 3.542 4.209 . 0 0 "[ . 1]" 1
961 1 38 HIS HE1 1 40 GLY HA2 3.471 . 4.977 4.662 4.080 5.145 0.168 8 0 "[ . 1]" 1
962 1 38 HIS HE1 1 40 GLY HA3 2.721 . 3.646 2.979 2.373 3.480 . 0 0 "[ . 1]" 1
963 1 38 HIS HE1 1 41 THR H 3.646 . 5.308 5.204 4.648 5.621 0.313 2 0 "[ . 1]" 1
964 1 38 HIS HE1 1 47 MET HG2 3.763 . 5.533 3.638 3.279 3.826 . 0 0 "[ . 1]" 1
965 1 38 HIS HE1 1 47 MET HG3 3.327 . 4.710 3.922 3.072 5.301 0.591 3 1 "[ + . 1]" 1
966 1 38 HIS HE1 1 49 HIS HD2 3.927 . 5.854 3.193 2.964 3.368 . 0 0 "[ . 1]" 1
967 1 38 HIS HE1 1 49 HIS HE2 4.139 . 6.281 3.102 2.824 3.333 . 0 0 "[ . 1]" 1
968 1 38 HIS HE2 1 40 GLY H 4.658 . 7.371 6.031 4.639 7.301 . 0 0 "[ . 1]" 1
969 1 38 HIS HE2 1 40 GLY HA3 4.290 . 6.591 4.692 3.958 5.318 . 0 0 "[ . 1]" 1
970 1 38 HIS HE2 1 42 GLN QB 3.998 . 5.996 3.440 2.827 3.875 . 0 0 "[ . 1]" 1
971 1 38 HIS HE2 1 47 MET HB2 4.151 . 6.305 4.821 4.699 4.967 . 0 0 "[ . 1]" 1
972 1 38 HIS HE2 1 47 MET HB3 3.838 . 5.679 3.312 3.076 3.507 . 0 0 "[ . 1]" 1
973 1 38 HIS HE2 1 47 MET ME 4.243 . 6.494 5.344 4.869 5.621 . 0 0 "[ . 1]" 1
974 1 38 HIS HE2 1 47 MET HG2 3.871 . 5.745 3.425 2.393 3.940 . 0 0 "[ . 1]" 1
975 1 38 HIS HE2 1 47 MET HG3 3.258 . 4.585 3.273 2.438 4.526 . 0 0 "[ . 1]" 1
976 1 38 HIS HE2 1 48 GLY QA 3.873 . 5.748 3.381 3.095 3.679 . 0 0 "[ . 1]" 1
977 1 38 HIS HE2 1 49 HIS H 4.162 . 6.327 4.564 4.310 4.772 . 0 0 "[ . 1]" 1
978 1 38 HIS HE2 1 49 HIS HD2 3.432 . 4.904 3.295 3.075 3.463 . 0 0 "[ . 1]" 1
979 1 38 HIS HE2 1 49 HIS HE2 4.020 . 6.040 4.010 3.771 4.204 . 0 0 "[ . 1]" 1
980 1 38 HIS HE2 1 89 ILE QG 4.286 . 6.582 5.369 5.159 5.656 . 0 0 "[ . 1]" 1
981 1 38 HIS HE2 1 90 GLY HA2 3.745 . 5.498 3.712 3.515 4.018 . 0 0 "[ . 1]" 1
982 1 38 HIS HE2 1 90 GLY HA3 4.309 . 6.630 5.204 4.983 5.505 . 0 0 "[ . 1]" 1
983 1 38 HIS HE2 1 91 GLY H 4.345 . 6.705 4.415 3.923 5.536 . 0 0 "[ . 1]" 1
984 1 39 THR H 1 39 THR MG 2.666 . 3.554 2.445 1.987 3.766 0.212 6 0 "[ . 1]" 1
985 1 39 THR H 1 40 GLY H 2.843 . 3.853 3.789 2.495 4.598 0.745 8 4 "[ **. +-1]" 1
986 1 39 THR H 1 40 GLY HA3 4.300 . 6.611 5.053 4.701 5.282 . 0 0 "[ . 1]" 1
987 1 39 THR H 1 92 GLY H 4.762 . 7.597 5.264 4.730 6.275 . 0 0 "[ . 1]" 1
988 1 39 THR H 1 93 GLU H 4.460 . 6.946 6.514 6.044 7.333 0.387 7 0 "[ . 1]" 1
989 1 39 THR HA 1 40 GLY H 2.794 . 3.770 2.559 2.158 3.502 . 0 0 "[ . 1]" 1
990 1 39 THR HA 1 92 GLY H 3.672 . 5.358 3.937 3.285 5.756 0.398 7 0 "[ . 1]" 1
991 1 39 THR MG 1 40 GLY H 3.620 . 5.258 3.872 3.011 4.328 . 0 0 "[ . 1]" 1
992 1 40 GLY H 1 40 GLY HA3 2.842 . 3.852 2.699 2.298 2.948 . 0 0 "[ . 1]" 1
993 1 40 GLY H 1 41 THR H 3.604 . 5.227 4.369 4.157 4.554 . 0 0 "[ . 1]" 1
994 1 40 GLY H 1 42 GLN H 4.163 . 6.329 5.132 4.694 5.941 . 0 0 "[ . 1]" 1
995 1 40 GLY H 1 91 GLY QA 3.740 . 5.488 3.845 2.644 5.195 . 0 0 "[ . 1]" 1
996 1 40 GLY H 1 92 GLY H 4.061 . 6.123 3.733 3.112 4.623 . 0 0 "[ . 1]" 1
997 1 40 GLY H 1 93 GLU H 3.205 . 4.489 5.773 4.750 6.668 2.179 2 9 [*+**.-****] 1
998 1 40 GLY HA2 1 41 THR H 2.841 . 3.850 2.451 2.130 2.797 . 0 0 "[ . 1]" 1
999 1 40 GLY HA2 1 41 THR MG 3.746 . 5.500 4.089 3.571 5.443 . 0 0 "[ . 1]" 1
1000 1 40 GLY HA2 1 42 GLN H 3.548 . 5.121 4.263 3.630 4.541 . 0 0 "[ . 1]" 1
1001 1 40 GLY HA2 1 91 GLY QA 4.624 . 7.296 4.675 4.283 5.743 . 0 0 "[ . 1]" 1
1002 1 40 GLY HA3 1 41 THR H 2.838 . 3.844 2.763 2.365 3.194 . 0 0 "[ . 1]" 1
1003 1 40 GLY HA3 1 41 THR MG 4.098 . 6.197 4.850 4.273 5.996 . 0 0 "[ . 1]" 1
1004 1 40 GLY HA3 1 42 GLN H 3.901 . 5.804 3.438 3.155 3.967 . 0 0 "[ . 1]" 1
1005 1 40 GLY HA3 1 91 GLY QA 4.550 . 7.137 3.923 3.265 5.412 . 0 0 "[ . 1]" 1
1006 1 41 THR H 1 41 THR HB 3.891 . 5.783 3.321 2.652 3.768 . 0 0 "[ . 1]" 1
1007 1 41 THR H 1 41 THR MG 3.062 . 4.234 2.985 2.005 3.893 . 0 0 "[ . 1]" 1
1008 1 41 THR H 1 42 GLN H 2.516 . 3.307 2.560 1.851 3.653 0.346 10 0 "[ . 1]" 1
1009 1 41 THR H 1 42 GLN QB 3.452 . 4.941 4.219 3.763 5.012 0.071 2 0 "[ . 1]" 1
1010 1 41 THR H 1 42 GLN HG2 4.010 . 6.020 4.092 3.226 5.277 . 0 0 "[ . 1]" 1
1011 1 41 THR H 1 42 GLN HG3 4.113 . 6.228 4.903 3.417 5.503 . 0 0 "[ . 1]" 1
1012 1 41 THR H 1 91 GLY QA 4.273 . 4.890 4.038 3.467 4.666 . 0 0 "[ . 1]" 1
1013 1 41 THR HA 1 41 THR MG 2.445 . 3.192 2.462 2.233 3.213 0.021 7 0 "[ . 1]" 1
1014 1 41 THR HA 1 42 GLN H 3.577 . 5.176 3.010 2.475 3.461 . 0 0 "[ . 1]" 1
1015 1 41 THR HA 1 91 GLY H 3.589 . 5.199 4.218 3.930 4.437 . 0 0 "[ . 1]" 1
1016 1 41 THR HA 1 91 GLY QA 3.496 . 4.129 2.650 2.050 3.128 . 0 0 "[ . 1]" 1
1017 1 41 THR HB 1 41 THR MG 2.268 . 2.911 2.134 2.130 2.137 . 0 0 "[ . 1]" 1
1018 1 41 THR HB 1 91 GLY QA 4.320 . 6.653 4.873 4.112 5.345 . 0 0 "[ . 1]" 1
1019 1 41 THR MG 1 42 GLN H 3.647 . 5.310 4.038 3.109 4.437 . 0 0 "[ . 1]" 1
1020 1 42 GLN H 1 42 GLN HA 2.888 . 3.931 2.908 2.797 2.945 . 0 0 "[ . 1]" 1
1021 1 42 GLN H 1 42 GLN QB 2.633 . 3.500 2.395 2.282 2.607 . 0 0 "[ . 1]" 1
1022 1 42 GLN H 1 42 GLN HG2 3.174 . 4.433 3.287 2.598 4.234 . 0 0 "[ . 1]" 1
1023 1 42 GLN H 1 42 GLN HG3 3.200 . 4.480 3.918 2.886 4.400 . 0 0 "[ . 1]" 1
1024 1 42 GLN H 1 43 PRO HD2 3.863 . 5.728 4.833 4.784 4.891 . 0 0 "[ . 1]" 1
1025 1 42 GLN H 1 43 PRO HD3 3.951 . 5.902 4.851 4.733 4.985 . 0 0 "[ . 1]" 1
1026 1 42 GLN H 1 91 GLY H 4.036 . 6.072 3.988 3.423 4.733 . 0 0 "[ . 1]" 1
1027 1 42 GLN H 1 91 GLY QA 2.805 . 3.788 2.892 2.334 3.517 . 0 0 "[ . 1]" 1
1028 1 42 GLN H 1 92 GLY H 4.733 . 7.533 5.532 4.830 6.692 . 0 0 "[ . 1]" 1
1029 1 42 GLN HA 1 42 GLN HE22 4.150 . 6.303 4.505 3.754 5.651 . 0 0 "[ . 1]" 1
1030 1 42 GLN HA 1 42 GLN HG2 3.182 . 4.448 3.019 2.480 3.666 . 0 0 "[ . 1]" 1
1031 1 42 GLN HA 1 42 GLN HG3 2.996 . 4.118 3.364 2.432 3.769 . 0 0 "[ . 1]" 1
1032 1 42 GLN HA 1 43 PRO HD2 2.721 . 3.647 2.182 2.081 2.376 . 0 0 "[ . 1]" 1
1033 1 42 GLN HA 1 43 PRO HD3 2.598 . 3.442 2.268 2.188 2.388 . 0 0 "[ . 1]" 1
1034 1 42 GLN HA 1 43 PRO HG2 3.741 . 5.490 4.337 4.268 4.488 . 0 0 "[ . 1]" 1
1035 1 42 GLN HA 1 43 PRO HG3 3.226 . 4.527 4.374 4.320 4.452 . 0 0 "[ . 1]" 1
1036 1 42 GLN QB 1 42 GLN HE21 3.622 . 5.262 2.899 1.749 3.776 0.233 4 0 "[ . 1]" 1
1037 1 42 GLN QB 1 42 GLN HE22 3.778 . 5.563 3.790 3.297 4.217 . 0 0 "[ . 1]" 1
1038 1 42 GLN QB 1 42 GLN HG2 2.558 . 3.376 2.314 2.157 2.399 . 0 0 "[ . 1]" 1
1039 1 42 GLN QB 1 42 GLN HG3 2.552 . 3.366 2.229 2.155 2.415 . 0 0 "[ . 1]" 1
1040 1 42 GLN QB 1 43 PRO HD2 2.719 . 3.643 2.620 2.287 2.885 . 0 0 "[ . 1]" 1
1041 1 42 GLN QB 1 43 PRO HD3 3.401 . 4.847 3.834 3.567 3.975 . 0 0 "[ . 1]" 1
1042 1 42 GLN QB 1 43 PRO HD3 2.813 . 3.802 2.891 2.847 2.916 . 0 0 "[ . 1]" 1
1043 1 42 GLN QB 1 47 MET HG2 3.897 . 5.796 3.265 2.390 4.107 . 0 0 "[ . 1]" 1
1044 1 42 GLN QB 1 48 GLY H 4.293 . 6.597 5.477 5.236 5.625 . 0 0 "[ . 1]" 1
1045 1 42 GLN QB 1 91 GLY H 4.079 . 6.159 4.527 4.173 5.331 . 0 0 "[ . 1]" 1
1046 1 42 GLN HE21 1 42 GLN HG2 3.382 . 4.812 3.044 2.222 3.473 . 0 0 "[ . 1]" 1
1047 1 42 GLN HE21 1 42 GLN HG3 3.084 . 4.273 2.609 2.220 3.515 . 0 0 "[ . 1]" 1
1048 1 42 GLN HE21 1 47 MET ME 4.431 . 6.885 3.778 3.258 4.412 . 0 0 "[ . 1]" 1
1049 1 42 GLN HE22 1 43 PRO HD3 4.586 . 7.215 5.622 4.344 7.505 0.290 5 0 "[ . 1]" 1
1050 1 42 GLN HE22 1 47 MET ME 3.706 . 5.423 4.758 2.241 5.617 0.194 1 0 "[ . 1]" 1
1051 1 42 GLN HG2 1 43 PRO HD2 3.859 . 5.720 4.292 3.410 4.624 . 0 0 "[ . 1]" 1
1052 1 42 GLN HG2 1 43 PRO HD3 3.891 . 5.784 5.101 4.316 5.587 . 0 0 "[ . 1]" 1
1053 1 42 GLN HG3 1 43 PRO HD2 3.510 . 5.050 3.534 3.038 3.714 . 0 0 "[ . 1]" 1
1054 1 42 GLN HG3 1 43 PRO HD2 3.855 . 5.713 4.204 3.181 4.762 . 0 0 "[ . 1]" 1
1055 1 42 GLN HG3 1 43 PRO HD3 3.893 . 5.788 5.277 4.160 5.977 0.189 2 0 "[ . 1]" 1
1056 1 43 PRO HA 1 43 PRO HB3 2.624 . 3.485 2.298 2.285 2.310 . 0 0 "[ . 1]" 1
1057 1 43 PRO HA 1 43 PRO HD2 3.795 . 5.595 4.097 4.088 4.105 . 0 0 "[ . 1]" 1
1058 1 43 PRO HA 1 43 PRO HD3 3.880 . 5.762 3.584 3.498 3.655 . 0 0 "[ . 1]" 1
1059 1 43 PRO HA 1 43 PRO HG2 3.581 . 5.184 3.844 3.830 3.853 . 0 0 "[ . 1]" 1
1060 1 43 PRO HA 1 44 LYS H 2.561 . 3.381 2.309 2.227 2.442 . 0 0 "[ . 1]" 1
1061 1 43 PRO HA 1 44 LYS HA 4.047 . 6.094 4.214 4.168 4.268 . 0 0 "[ . 1]" 1
1062 1 43 PRO HA 1 45 ALA H 3.642 . 5.300 4.161 3.898 4.597 . 0 0 "[ . 1]" 1
1063 1 43 PRO HA 1 90 GLY H 4.249 . 6.506 5.490 4.997 5.986 . 0 0 "[ . 1]" 1
1064 1 43 PRO HA 1 90 GLY HA2 3.797 . 5.599 4.059 3.431 4.385 . 0 0 "[ . 1]" 1
1065 1 43 PRO HA 1 90 GLY HA3 3.525 . 5.078 3.225 2.713 3.653 . 0 0 "[ . 1]" 1
1066 1 43 PRO HA 1 91 GLY H 3.326 . 4.709 3.033 2.528 3.431 . 0 0 "[ . 1]" 1
1067 1 43 PRO HB2 1 44 LYS H 3.073 . 4.253 2.855 2.623 3.108 . 0 0 "[ . 1]" 1
1068 1 43 PRO HB2 1 45 ALA H 2.880 . 3.917 2.667 2.465 2.994 . 0 0 "[ . 1]" 1
1069 1 43 PRO HB2 1 46 SER H 3.261 . 4.590 3.589 3.351 3.852 . 0 0 "[ . 1]" 1
1070 1 43 PRO HB2 1 92 GLY H 3.761 . 5.529 4.576 4.177 4.936 . 0 0 "[ . 1]" 1
1071 1 43 PRO HB3 1 43 PRO HD2 3.480 . 4.994 3.863 3.849 3.876 . 0 0 "[ . 1]" 1
1072 1 43 PRO HB3 1 43 PRO HD3 3.366 . 4.782 2.955 2.906 2.998 . 0 0 "[ . 1]" 1
1073 1 43 PRO HB3 1 43 PRO HG2 2.914 . 3.975 2.995 2.992 3.002 . 0 0 "[ . 1]" 1
1074 1 43 PRO HB3 1 44 LYS H 3.226 . 4.527 3.581 3.498 3.702 . 0 0 "[ . 1]" 1
1075 1 43 PRO HB3 1 45 ALA H 3.298 . 4.657 4.332 4.125 4.721 0.064 3 0 "[ . 1]" 1
1076 1 43 PRO HB3 1 46 SER H 4.017 . 6.034 5.087 4.906 5.400 . 0 0 "[ . 1]" 1
1077 1 43 PRO HD2 1 43 PRO HG2 2.932 . 4.007 2.309 2.299 2.324 . 0 0 "[ . 1]" 1
1078 1 43 PRO HD2 1 43 PRO HG3 2.808 . 3.794 2.705 2.686 2.723 . 0 0 "[ . 1]" 1
1079 1 43 PRO HD2 1 91 GLY H 3.805 . 5.615 4.558 4.311 4.887 . 0 0 "[ . 1]" 1
1080 1 43 PRO HD2 1 46 SER H 3.492 . 5.017 4.539 4.063 4.870 . 0 0 "[ . 1]" 1
1081 1 43 PRO HD2 1 47 MET H 3.306 . 4.672 4.198 3.991 4.396 . 0 0 "[ . 1]" 1
1082 1 43 PRO HD3 1 43 PRO HG2 2.953 . 4.043 2.992 2.984 3.000 . 0 0 "[ . 1]" 1
1083 1 43 PRO HD3 1 43 PRO HG3 2.823 . 3.819 2.317 2.306 2.326 . 0 0 "[ . 1]" 1
1084 1 43 PRO HG2 1 45 ALA H 3.825 . 5.654 3.869 3.720 4.202 . 0 0 "[ . 1]" 1
1085 1 43 PRO HG2 1 45 ALA MB 3.561 . 5.146 3.800 3.407 4.204 . 0 0 "[ . 1]" 1
1086 1 43 PRO HG2 1 46 SER H 3.131 . 4.356 3.117 2.929 3.320 . 0 0 "[ . 1]" 1
1087 1 43 PRO HG2 1 46 SER QB 2.815 . 3.805 2.582 2.270 3.400 . 0 0 "[ . 1]" 1
1088 1 43 PRO HG2 1 47 MET H 3.040 . 4.195 3.926 3.698 4.372 0.177 3 0 "[ . 1]" 1
1089 1 43 PRO HG3 1 44 LYS H 3.870 . 5.742 5.251 5.106 5.419 . 0 0 "[ . 1]" 1
1090 1 43 PRO HG3 1 44 LYS HA 4.321 . 6.654 6.887 6.818 6.939 0.285 3 0 "[ . 1]" 1
1091 1 43 PRO HG3 1 45 ALA H 3.953 . 5.906 5.009 4.826 5.224 . 0 0 "[ . 1]" 1
1092 1 43 PRO HG3 1 45 ALA MB 3.684 . 5.381 4.667 4.200 4.973 . 0 0 "[ . 1]" 1
1093 1 43 PRO HG3 1 46 SER H 4.159 . 6.321 4.818 4.683 5.016 . 0 0 "[ . 1]" 1
1094 1 44 LYS H 1 44 LYS QB 2.685 . 3.586 2.513 2.442 2.592 . 0 0 "[ . 1]" 1
1095 1 44 LYS H 1 44 LYS QE 4.161 . 6.325 4.409 3.729 4.958 . 0 0 "[ . 1]" 1
1096 1 44 LYS H 1 44 LYS HG2 3.441 . 4.921 2.180 2.040 2.284 . 0 0 "[ . 1]" 1
1097 1 44 LYS H 1 44 LYS HG3 2.962 . 4.058 3.329 3.158 3.481 . 0 0 "[ . 1]" 1
1098 1 44 LYS H 1 45 ALA H 2.988 . 4.104 2.651 2.555 2.877 . 0 0 "[ . 1]" 1
1099 1 44 LYS H 1 45 ALA HA 3.867 . 5.736 4.298 4.157 4.414 . 0 0 "[ . 1]" 1
1100 1 44 LYS H 1 46 SER H 4.152 . 6.307 4.185 4.056 4.536 . 0 0 "[ . 1]" 1
1101 1 44 LYS H 1 90 GLY HA2 2.963 . 4.061 2.813 2.737 2.894 . 0 0 "[ . 1]" 1
1102 1 44 LYS H 1 90 GLY HA3 2.867 . 3.895 2.277 2.195 2.381 . 0 0 "[ . 1]" 1
1103 1 44 LYS H 1 91 GLY H 3.429 . 4.898 3.804 3.481 3.997 . 0 0 "[ . 1]" 1
1104 1 44 LYS H 1 90 GLY HA2 3.477 . 4.988 3.704 3.267 4.360 . 0 0 "[ . 1]" 1
1105 1 44 LYS H 1 90 GLY HA3 3.204 . 4.487 2.929 2.585 3.140 . 0 0 "[ . 1]" 1
1106 1 44 LYS H 1 91 GLY H 4.168 . 6.339 4.223 3.850 4.523 . 0 0 "[ . 1]" 1
1107 1 44 LYS HA 1 44 LYS HG2 3.525 . 5.078 3.780 3.737 3.818 . 0 0 "[ . 1]" 1
1108 1 44 LYS HA 1 44 LYS HG3 3.554 . 5.133 3.757 3.726 3.801 . 0 0 "[ . 1]" 1
1109 1 44 LYS HA 1 45 ALA H 3.371 . 4.792 3.432 3.356 3.541 . 0 0 "[ . 1]" 1
1110 1 44 LYS HA 1 48 GLY H 3.164 . 4.415 3.383 3.155 3.628 . 0 0 "[ . 1]" 1
1111 1 44 LYS HA 1 48 GLY QA 3.170 . 4.169 2.193 2.012 2.349 . 0 0 "[ . 1]" 1
1112 1 44 LYS HA 1 49 HIS H 3.460 . 4.956 4.407 4.176 4.654 . 0 0 "[ . 1]" 1
1113 1 44 LYS HA 1 90 GLY H 4.091 . 6.183 4.832 4.544 5.032 . 0 0 "[ . 1]" 1
1114 1 44 LYS HA 1 90 GLY HA2 3.414 . 4.871 2.929 2.703 3.627 . 0 0 "[ . 1]" 1
1115 1 44 LYS HA 1 90 GLY HA3 3.494 . 5.020 3.557 2.885 3.926 . 0 0 "[ . 1]" 1
1116 1 44 LYS QB 1 45 ALA H 3.004 . 4.132 3.663 3.427 3.755 . 0 0 "[ . 1]" 1
1117 1 44 LYS QB 1 48 GLY QA 3.443 . 4.893 2.733 2.523 2.962 . 0 0 "[ . 1]" 1
1118 1 44 LYS QB 1 90 GLY H 3.004 . 4.132 3.034 2.797 3.447 . 0 0 "[ . 1]" 1
1119 1 44 LYS QB 1 90 GLY HA2 3.263 . 4.594 2.890 2.333 3.432 . 0 0 "[ . 1]" 1
1120 1 44 LYS HB2 1 90 GLY HA3 3.160 . 4.408 4.297 3.701 4.747 0.339 8 0 "[ . 1]" 1
1121 1 44 LYS HB3 1 91 GLY H 3.895 . 5.792 4.861 4.309 5.286 . 0 0 "[ . 1]" 1
1122 1 44 LYS QD 1 88 LEU QB 3.951 . 5.486 3.085 2.100 4.119 . 0 0 "[ . 1]" 1
1123 1 44 LYS QD 1 88 LEU QD 3.338 . 4.731 3.146 2.419 4.372 . 0 0 "[ . 1]" 1
1124 1 44 LYS QE 1 88 LEU QD 3.648 . 5.311 3.829 2.692 4.442 . 0 0 "[ . 1]" 1
1125 1 44 LYS HG2 1 45 ALA H 3.243 . 4.558 3.032 2.857 3.263 . 0 0 "[ . 1]" 1
1126 1 44 LYS HG2 1 46 SER H 4.396 . 6.812 5.284 5.131 5.540 . 0 0 "[ . 1]" 1
1127 1 44 LYS HG2 1 90 GLY H 4.194 . 6.392 4.878 4.582 5.343 . 0 0 "[ . 1]" 1
1128 1 44 LYS HG2 1 90 GLY HA2 4.477 . 6.983 4.969 4.523 5.518 . 0 0 "[ . 1]" 1
1129 1 44 LYS HG2 1 90 GLY HA3 4.554 . 7.146 4.110 3.754 4.510 . 0 0 "[ . 1]" 1
1130 1 44 LYS HG3 1 90 GLY HA2 4.274 . 6.558 5.719 5.235 6.391 . 0 0 "[ . 1]" 1
1131 1 44 LYS HG3 1 90 GLY HA3 4.217 . 6.440 5.307 4.861 5.633 . 0 0 "[ . 1]" 1
1132 1 45 ALA H 1 45 ALA HA 2.671 . 3.563 2.862 2.811 2.889 . 0 0 "[ . 1]" 1
1133 1 45 ALA H 1 45 ALA MB 2.211 . 2.822 2.254 2.228 2.270 . 0 0 "[ . 1]" 1
1134 1 45 ALA H 1 46 SER H 2.885 . 3.925 2.492 2.421 2.632 . 0 0 "[ . 1]" 1
1135 1 45 ALA H 1 46 SER QB 4.067 . 6.134 4.490 4.196 4.944 . 0 0 "[ . 1]" 1
1136 1 45 ALA H 1 48 GLY QA 4.147 . 6.297 4.900 4.733 5.188 . 0 0 "[ . 1]" 1
1137 1 45 ALA HA 1 45 ALA MB 2.238 . 2.864 2.127 2.124 2.129 . 0 0 "[ . 1]" 1
1138 1 45 ALA HA 1 46 SER H 3.267 . 4.601 3.410 3.354 3.486 . 0 0 "[ . 1]" 1
1139 1 45 ALA MB 1 46 SER H 2.758 . 3.709 3.004 2.781 3.152 . 0 0 "[ . 1]" 1
1140 1 46 SER H 1 46 SER QB 2.722 . 3.648 2.549 2.372 2.966 . 0 0 "[ . 1]" 1
1141 1 46 SER H 1 47 MET H 2.364 . 3.062 2.170 1.867 2.279 . 0 0 "[ . 1]" 1
1142 1 46 SER H 1 47 MET HB2 3.900 . 5.801 5.169 4.641 5.376 . 0 0 "[ . 1]" 1
1143 1 46 SER H 1 48 GLY H 3.772 . 5.551 4.126 3.690 4.606 . 0 0 "[ . 1]" 1
1144 1 46 SER H 1 48 GLY QA 4.629 . 7.308 4.710 4.388 5.153 . 0 0 "[ . 1]" 1
1145 1 46 SER QB 1 47 MET H 2.880 . 3.917 2.493 2.255 3.147 . 0 0 "[ . 1]" 1
1146 1 46 SER QB 1 47 MET ME 4.730 . 7.526 4.636 4.202 5.073 . 0 0 "[ . 1]" 1
1147 1 47 MET H 1 47 MET HB2 3.238 . 4.549 3.191 2.913 3.484 . 0 0 "[ . 1]" 1
1148 1 47 MET H 1 48 GLY H 2.926 . 3.996 3.161 2.914 3.285 . 0 0 "[ . 1]" 1
1149 1 47 MET H 1 48 GLY QA 4.119 . 6.240 4.020 3.935 4.161 . 0 0 "[ . 1]" 1
1150 1 47 MET HA 1 47 MET ME 3.270 . 4.606 3.451 2.809 4.033 . 0 0 "[ . 1]" 1
1151 1 47 MET HA 1 47 MET HG2 3.656 . 5.327 3.559 3.020 3.802 . 0 0 "[ . 1]" 1
1152 1 47 MET HA 1 47 MET HG3 3.446 . 4.931 2.871 2.564 3.107 . 0 0 "[ . 1]" 1
1153 1 47 MET HA 1 48 GLY H 2.766 . 3.722 2.431 2.295 2.658 . 0 0 "[ . 1]" 1
1154 1 47 MET HA 1 49 HIS HE1 4.113 . 6.228 5.045 4.558 5.373 . 0 0 "[ . 1]" 1
1155 1 47 MET HA 1 115 PHE QD 4.463 . 6.953 4.925 4.656 5.157 . 0 0 "[ . 1]" 1
1156 1 47 MET HA 1 115 PHE QE 4.278 . 6.566 4.190 3.927 4.605 . 0 0 "[ . 1]" 1
1157 1 47 MET HA 1 118 HIS HD2 4.688 . 7.435 5.827 5.647 6.121 . 0 0 "[ . 1]" 1
1158 1 47 MET HA 1 118 HIS HE1 2.688 . 3.591 2.869 2.566 3.097 . 0 0 "[ . 1]" 1
1159 1 47 MET HA 1 118 HIS HE2 4.198 . 6.401 3.336 3.111 3.571 . 0 0 "[ . 1]" 1
1160 1 47 MET HB2 1 47 MET ME 2.794 . 3.769 2.094 2.024 2.155 . 0 0 "[ . 1]" 1
1161 1 47 MET HB2 1 48 GLY H 3.516 . 5.061 4.607 4.572 4.630 . 0 0 "[ . 1]" 1
1162 1 47 MET HB2 1 118 HIS HE1 5.356 . 8.942 4.682 4.195 4.884 . 0 0 "[ . 1]" 1
1163 1 47 MET HB3 1 47 MET ME 2.578 . 3.409 3.292 2.848 3.491 0.082 1 0 "[ . 1]" 1
1164 1 47 MET HB3 1 49 HIS HE1 4.196 . 6.397 6.026 5.630 6.359 . 0 0 "[ . 1]" 1
1165 1 47 MET ME 1 47 MET HG2 2.913 . 3.973 2.732 2.406 3.403 . 0 0 "[ . 1]" 1
1166 1 47 MET ME 1 47 MET HG3 3.184 . 4.451 3.121 2.476 3.409 . 0 0 "[ . 1]" 1
1167 1 47 MET ME 1 49 HIS HD2 4.571 . 7.183 6.498 6.286 6.698 . 0 0 "[ . 1]" 1
1168 1 47 MET ME 1 49 HIS HE1 3.467 . 4.970 4.602 4.272 4.957 . 0 0 "[ . 1]" 1
1169 1 47 MET ME 1 49 HIS HE2 4.060 . 6.121 4.822 4.603 5.051 . 0 0 "[ . 1]" 1
1170 1 47 MET ME 1 118 HIS QB 4.214 . 6.434 6.673 6.325 7.473 1.039 4 2 "[ +. - 1]" 1
1171 1 47 MET ME 1 118 HIS HD2 4.157 . 6.318 5.559 5.096 6.692 0.374 4 0 "[ . 1]" 1
1172 1 47 MET ME 1 118 HIS HE1 3.186 . 4.455 4.273 3.925 4.959 0.504 4 1 "[ +. 1]" 1
1173 1 47 MET ME 1 118 HIS HE2 4.006 . 6.012 3.815 3.399 4.887 . 0 0 "[ . 1]" 1
1174 1 47 MET HG2 1 49 HIS HD2 4.889 . 7.877 5.010 3.979 5.730 . 0 0 "[ . 1]" 1
1175 1 47 MET HG2 1 49 HIS HE1 3.432 . 4.905 4.347 3.304 5.280 0.375 9 0 "[ . 1]" 1
1176 1 47 MET HG2 1 49 HIS HE2 3.827 . 5.657 3.676 3.074 4.304 . 0 0 "[ . 1]" 1
1177 1 47 MET HG2 1 118 HIS HE1 3.581 . 5.184 4.225 2.871 5.156 . 0 0 "[ . 1]" 1
1178 1 47 MET HG3 1 49 HIS HE1 3.358 . 4.767 3.599 3.146 4.178 . 0 0 "[ . 1]" 1
1179 1 47 MET HG3 1 49 HIS HE2 3.409 . 4.861 3.389 3.017 4.243 . 0 0 "[ . 1]" 1
1180 1 47 MET HG3 1 118 HIS HD2 4.854 . 7.799 6.784 5.353 7.917 0.118 9 0 "[ . 1]" 1
1181 1 47 MET HG3 1 118 HIS HE1 3.342 . 4.738 3.164 2.065 4.002 . 0 0 "[ . 1]" 1
1182 1 48 GLY H 1 49 HIS H 3.665 . 5.344 4.566 4.554 4.580 . 0 0 "[ . 1]" 1
1183 1 48 GLY H 1 88 LEU QD 3.597 . 5.214 4.003 3.447 4.436 . 0 0 "[ . 1]" 1
1184 1 48 GLY H 1 115 PHE QD 3.641 . 5.298 3.910 3.762 4.059 . 0 0 "[ . 1]" 1
1185 1 48 GLY H 1 115 PHE QE 3.270 . 4.607 3.263 3.112 3.439 . 0 0 "[ . 1]" 1
1186 1 48 GLY H 1 118 HIS HE1 3.449 . 4.936 3.569 3.357 3.789 . 0 0 "[ . 1]" 1
1187 1 48 GLY QA 1 49 HIS H 2.858 . 3.568 2.217 2.185 2.246 . 0 0 "[ . 1]" 1
1188 1 48 GLY QA 1 49 HIS HD2 4.613 . 7.273 4.621 4.537 4.705 . 0 0 "[ . 1]" 1
1189 1 48 GLY QA 1 88 LEU QD 3.438 . 4.915 2.497 1.924 2.913 0.061 6 0 "[ . 1]" 1
1190 1 48 GLY QA 1 88 LEU HG 3.951 . 5.756 4.943 3.249 5.740 . 0 0 "[ . 1]" 1
1191 1 48 GLY QA 1 89 ILE H 4.239 . 5.891 4.096 3.698 4.400 . 0 0 "[ . 1]" 1
1192 1 48 GLY QA 1 90 GLY H 3.887 . 5.776 4.865 4.560 5.139 . 0 0 "[ . 1]" 1
1193 1 48 GLY QA 1 115 PHE QD 4.092 . 5.510 3.564 3.459 3.675 . 0 0 "[ . 1]" 1
1194 1 48 GLY QA 1 115 PHE QE 3.260 . 4.589 3.428 3.264 3.619 . 0 0 "[ . 1]" 1
1195 1 49 HIS H 1 49 HIS HB2 3.627 . 5.272 2.765 2.737 2.782 . 0 0 "[ . 1]" 1
1196 1 49 HIS H 1 49 HIS HB3 3.253 . 4.576 3.855 3.841 3.866 . 0 0 "[ . 1]" 1
1197 1 49 HIS H 1 49 HIS HD2 4.582 . 7.206 4.221 4.173 4.273 . 0 0 "[ . 1]" 1
1198 1 49 HIS H 1 50 ASN H 4.000 . 6.000 4.389 4.358 4.413 . 0 0 "[ . 1]" 1
1199 1 49 HIS H 1 88 LEU QD 3.739 . 4.305 3.062 2.747 3.349 . 0 0 "[ . 1]" 1
1200 1 49 HIS H 1 89 ILE H 3.022 . 4.164 2.896 2.496 3.265 . 0 0 "[ . 1]" 1
1201 1 49 HIS H 1 89 ILE HB 4.673 . 7.403 5.184 5.002 5.449 . 0 0 "[ . 1]" 1
1202 1 49 HIS H 1 89 ILE MD 3.596 . 5.212 4.294 4.209 4.382 . 0 0 "[ . 1]" 1
1203 1 49 HIS H 1 89 ILE QG 3.101 . 4.303 3.088 2.947 3.233 . 0 0 "[ . 1]" 1
1204 1 49 HIS H 1 89 ILE MG 3.709 . 5.429 3.230 3.064 3.608 . 0 0 "[ . 1]" 1
1205 1 49 HIS HA 1 50 ASN H 2.510 . 3.297 2.227 2.207 2.267 . 0 0 "[ . 1]" 1
1206 1 49 HIS HA 1 88 LEU QD 3.301 . 4.663 3.325 2.950 3.607 . 0 0 "[ . 1]" 1
1207 1 49 HIS HA 1 115 PHE HB2 4.007 . 6.014 3.447 3.310 3.604 . 0 0 "[ . 1]" 1
1208 1 49 HIS HA 1 115 PHE HB3 4.154 . 6.311 4.221 4.148 4.327 . 0 0 "[ . 1]" 1
1209 1 49 HIS HB2 1 49 HIS HD2 3.134 . 4.362 2.626 2.622 2.634 . 0 0 "[ . 1]" 1
1210 1 49 HIS HB2 1 50 ASN H 2.973 . 4.078 3.888 3.823 3.944 . 0 0 "[ . 1]" 1
1211 1 49 HIS HB2 1 89 ILE QG 4.113 . 6.228 3.117 2.923 3.287 . 0 0 "[ . 1]" 1
1212 1 49 HIS HB3 1 49 HIS HD2 2.892 . 3.937 3.607 3.593 3.627 . 0 0 "[ . 1]" 1
1213 1 49 HIS HB3 1 50 ASN H 3.139 . 4.370 2.776 2.675 2.862 . 0 0 "[ . 1]" 1
1214 1 49 HIS HB3 1 89 ILE H 3.549 . 5.124 4.145 3.614 4.900 . 0 0 "[ . 1]" 1
1215 1 49 HIS HB3 1 89 ILE QG 3.360 . 4.771 4.375 4.168 4.536 . 0 0 "[ . 1]" 1
1216 1 49 HIS HD2 1 89 ILE MD 4.040 . 6.080 4.890 4.704 5.128 . 0 0 "[ . 1]" 1
1217 1 49 HIS HD2 1 89 ILE QG 3.984 . 5.968 4.512 4.315 4.802 . 0 0 "[ . 1]" 1
1218 1 49 HIS HD2 1 90 GLY HA2 4.544 . 7.125 5.755 5.384 6.110 . 0 0 "[ . 1]" 1
1219 1 49 HIS HE1 1 115 PHE QD 4.338 . 6.690 6.071 5.906 6.210 . 0 0 "[ . 1]" 1
1220 1 49 HIS HE1 1 118 HIS HE2 5.450 . 9.163 4.536 4.241 4.697 . 0 0 "[ . 1]" 1
1221 1 49 HIS HE1 1 122 MET ME 3.463 . 4.962 2.495 1.805 3.288 0.159 1 0 "[ . 1]" 1
1222 1 49 HIS HE2 1 118 HIS HE1 4.077 . 6.155 4.476 4.231 4.818 . 0 0 "[ . 1]" 1
1223 1 49 HIS HE2 1 122 MET ME 4.647 . 7.347 4.561 3.859 5.335 . 0 0 "[ . 1]" 1
1224 1 50 ASN H 1 50 ASN HB2 3.826 . 5.656 3.824 3.394 3.940 . 0 0 "[ . 1]" 1
1225 1 50 ASN H 1 51 LEU H 3.888 . 5.777 4.350 4.234 4.393 . 0 0 "[ . 1]" 1
1226 1 50 ASN H 1 88 LEU QD . . 4.381 3.516 3.289 3.803 . 0 0 "[ . 1]" 1
1227 1 50 ASN H 1 89 ILE QG 4.287 . 6.585 5.045 4.879 5.263 . 0 0 "[ . 1]" 1
1228 1 50 ASN H 1 113 CYS HA 3.387 . 4.821 3.185 3.124 3.240 . 0 0 "[ . 1]" 1
1229 1 50 ASN H 1 113 CYS HB3 3.600 . 5.220 4.285 4.232 4.317 . 0 0 "[ . 1]" 1
1230 1 50 ASN H 1 114 THR H 3.569 . 5.161 3.984 3.904 4.075 . 0 0 "[ . 1]" 1
1231 1 50 ASN HA 1 50 ASN HB3 2.985 . 4.099 2.584 2.453 3.034 . 0 0 "[ . 1]" 1
1232 1 50 ASN HA 1 50 ASN HD21 3.610 . 5.239 4.564 4.514 4.587 . 0 0 "[ . 1]" 1
1233 1 50 ASN HA 1 51 LEU H 2.739 . 3.677 2.398 2.209 2.530 . 0 0 "[ . 1]" 1
1234 1 50 ASN HA 1 51 LEU HB3 3.713 . 5.436 4.718 4.656 4.782 . 0 0 "[ . 1]" 1
1235 1 50 ASN HA 1 86 THR MG 3.821 . 5.646 4.379 4.192 4.638 . 0 0 "[ . 1]" 1
1236 1 50 ASN HA 1 89 ILE H 3.844 . 5.691 4.104 3.849 4.447 . 0 0 "[ . 1]" 1
1237 1 50 ASN HA 1 113 CYS HA 4.280 . 6.570 4.102 4.072 4.117 . 0 0 "[ . 1]" 1
1238 1 50 ASN HB2 1 50 ASN HD22 3.668 . 5.349 3.698 3.487 3.775 . 0 0 "[ . 1]" 1
1239 1 50 ASN HB2 1 51 LEU H 2.699 . 3.610 2.784 2.222 4.161 0.551 7 1 "[ . + 1]" 1
1240 1 50 ASN HB2 1 86 THR H 3.980 . 5.960 3.989 3.337 5.987 0.027 7 0 "[ . 1]" 1
1241 1 50 ASN HB2 1 88 LEU H 4.394 . 6.807 4.863 3.997 5.291 . 0 0 "[ . 1]" 1
1242 1 50 ASN HB2 1 88 LEU QD 4.095 . 6.191 3.373 1.980 3.864 0.019 9 0 "[ . 1]" 1
1243 1 50 ASN HB2 1 89 ILE H 3.884 . 5.770 5.119 3.972 5.785 0.015 8 0 "[ . 1]" 1
1244 1 50 ASN HB2 1 114 THR HG1 3.666 . 5.346 5.494 4.977 5.712 0.366 3 0 "[ . 1]" 1
1245 1 50 ASN HB3 1 50 ASN HD21 3.291 . 4.645 2.367 2.204 2.854 . 0 0 "[ . 1]" 1
1246 1 50 ASN HB3 1 50 ASN HD22 3.711 . 5.433 3.541 3.462 3.749 . 0 0 "[ . 1]" 1
1247 1 50 ASN HB3 1 51 LEU H 2.934 . 4.010 3.880 3.671 4.173 0.163 9 0 "[ . 1]" 1
1248 1 50 ASN HB3 1 52 VAL H 4.245 . 6.498 6.215 5.369 6.576 0.078 5 0 "[ . 1]" 1
1249 1 50 ASN HB3 1 88 LEU H 4.307 . 6.626 4.496 4.018 5.908 . 0 0 "[ . 1]" 1
1250 1 50 ASN HB3 1 88 LEU QD 3.388 . 4.823 2.343 1.943 3.245 0.010 10 0 "[ . 1]" 1
1251 1 50 ASN HB3 1 89 ILE H 4.125 . 6.252 4.381 3.659 5.622 . 0 0 "[ . 1]" 1
1252 1 50 ASN HB3 1 114 THR HG1 3.760 . 5.527 5.338 3.871 5.849 0.322 10 0 "[ . 1]" 1
1253 1 50 ASN HD21 1 51 LEU H 3.969 . 5.938 5.026 4.620 5.239 . 0 0 "[ . 1]" 1
1254 1 50 ASN HD21 1 74 TYR HB2 3.166 . 4.419 3.382 3.027 3.941 . 0 0 "[ . 1]" 1
1255 1 50 ASN HD21 1 74 TYR HB3 4.317 . 6.647 4.774 4.059 5.370 . 0 0 "[ . 1]" 1
1256 1 50 ASN HD21 1 74 TYR QD 3.922 . 5.844 4.414 3.764 5.003 . 0 0 "[ . 1]" 1
1257 1 50 ASN HD21 1 75 VAL HA 4.644 . 7.340 5.768 5.243 6.529 . 0 0 "[ . 1]" 1
1258 1 50 ASN HD21 1 75 VAL QG 3.255 . 4.579 2.923 2.568 3.667 . 0 0 "[ . 1]" 1
1259 1 50 ASN HD21 1 88 LEU H 4.758 . 7.588 4.899 4.477 5.671 . 0 0 "[ . 1]" 1
1260 1 50 ASN HD21 1 88 LEU QB 4.387 . 6.793 4.663 3.332 5.854 . 0 0 "[ . 1]" 1
1261 1 50 ASN HD21 1 88 LEU QD 3.267 . 4.601 2.944 2.188 4.005 . 0 0 "[ . 1]" 1
1262 1 50 ASN HD21 1 114 THR H 3.649 . 5.313 3.912 3.221 4.089 . 0 0 "[ . 1]" 1
1263 1 50 ASN HD21 1 114 THR HG1 3.238 . 4.549 3.367 2.318 3.689 . 0 0 "[ . 1]" 1
1264 1 50 ASN HD21 1 114 THR MG 3.793 . 5.592 4.522 3.552 4.949 . 0 0 "[ . 1]" 1
1265 1 50 ASN HD21 1 115 PHE H 5.187 . 8.550 5.156 4.823 5.662 . 0 0 "[ . 1]" 1
1266 1 50 ASN HD22 1 74 TYR HB2 3.050 . 4.213 3.259 2.641 4.944 0.731 9 1 "[ . +1]" 1
1267 1 50 ASN HD22 1 74 TYR HB3 3.809 . 5.623 4.235 3.458 6.148 0.525 9 1 "[ . +1]" 1
1268 1 50 ASN HD22 1 75 VAL QG 3.233 . 4.540 2.861 2.066 3.582 . 0 0 "[ . 1]" 1
1269 1 50 ASN HD22 1 88 LEU QD 3.341 . 4.736 3.618 2.996 4.996 0.260 7 0 "[ . 1]" 1
1270 1 50 ASN HD22 1 113 CYS HA 4.355 . 6.725 4.645 4.327 5.765 . 0 0 "[ . 1]" 1
1271 1 50 ASN HD22 1 114 THR H 3.227 . 4.529 3.017 2.602 4.604 0.075 9 0 "[ . 1]" 1
1272 1 50 ASN HD22 1 114 THR HG1 3.105 . 4.310 2.470 2.158 3.386 . 0 0 "[ . 1]" 1
1273 1 50 ASN HD22 1 114 THR MG 3.671 . 5.355 3.585 3.221 4.163 . 0 0 "[ . 1]" 1
1274 1 50 ASN HD22 1 115 PHE H 4.418 . 6.858 4.461 3.676 6.581 . 0 0 "[ . 1]" 1
1275 1 51 LEU H 1 51 LEU HB2 3.734 . 5.477 2.996 2.820 3.120 . 0 0 "[ . 1]" 1
1276 1 51 LEU H 1 51 LEU HB3 3.027 . 4.172 2.730 2.633 2.805 . 0 0 "[ . 1]" 1
1277 1 51 LEU H 1 51 LEU QD 3.696 . 5.404 3.861 3.819 3.891 . 0 0 "[ . 1]" 1
1278 1 51 LEU H 1 51 LEU HG 4.300 . 6.612 4.652 4.600 4.688 . 0 0 "[ . 1]" 1
1279 1 51 LEU H 1 52 VAL H 3.811 . 5.627 4.119 4.028 4.237 . 0 0 "[ . 1]" 1
1280 1 51 LEU H 1 86 THR H 3.091 . 4.285 2.880 2.634 3.270 . 0 0 "[ . 1]" 1
1281 1 51 LEU H 1 86 THR MG 2.993 . 4.113 3.103 2.886 3.591 . 0 0 "[ . 1]" 1
1282 1 51 LEU H 1 95 SER QB 4.084 . 6.169 5.361 4.938 6.049 . 0 0 "[ . 1]" 1
1283 1 51 LEU H 1 97 LEU MD2 3.721 . 5.452 4.192 3.972 4.390 . 0 0 "[ . 1]" 1
1284 1 51 LEU H 1 113 CYS HA 3.952 . 5.904 4.908 4.785 5.028 . 0 0 "[ . 1]" 1
1285 1 51 LEU H 1 114 THR H 4.203 . 6.411 5.698 5.526 5.878 . 0 0 "[ . 1]" 1
1286 1 51 LEU HA 1 51 LEU HG 3.254 . 4.578 2.433 2.411 2.452 . 0 0 "[ . 1]" 1
1287 1 51 LEU HA 1 52 VAL H 2.502 . 3.284 2.111 2.097 2.120 . 0 0 "[ . 1]" 1
1288 1 51 LEU HA 1 112 ALA H 3.563 . 5.150 3.708 3.588 3.825 . 0 0 "[ . 1]" 1
1289 1 51 LEU HA 1 113 CYS HA 3.713 . 5.436 3.386 3.241 3.522 . 0 0 "[ . 1]" 1
1290 1 51 LEU HA 1 114 THR H 4.486 . 7.002 4.930 4.727 5.118 . 0 0 "[ . 1]" 1
1291 1 51 LEU HB2 1 51 LEU QD 2.982 . 3.923 2.140 2.130 2.160 . 0 0 "[ . 1]" 1
1292 1 51 LEU HB2 1 52 VAL H 3.487 . 5.006 4.417 4.398 4.453 . 0 0 "[ . 1]" 1
1293 1 51 LEU HB2 1 86 THR H 3.608 . 5.235 3.900 3.687 4.124 . 0 0 "[ . 1]" 1
1294 1 51 LEU HB2 1 86 THR MG 2.576 . 3.406 3.636 3.499 3.869 0.463 5 0 "[ . 1]" 1
1295 1 51 LEU HB2 1 111 PHE QD 4.288 . 6.586 4.615 4.502 4.742 . 0 0 "[ . 1]" 1
1296 1 51 LEU HB3 1 51 LEU QD 3.246 . 4.563 2.104 2.093 2.121 . 0 0 "[ . 1]" 1
1297 1 51 LEU HB3 1 113 CYS HA 4.759 . 7.590 6.245 6.106 6.389 . 0 0 "[ . 1]" 1
1298 1 51 LEU MD1 1 51 LEU MD2 2.778 . 3.743 2.076 2.073 2.078 . 0 0 "[ . 1]" 1
1299 1 51 LEU QD 1 51 LEU HG 3.168 . 3.744 1.898 1.896 1.900 0.017 8 0 "[ . 1]" 1
1300 1 51 LEU QD 1 52 VAL H 3.366 . 4.782 3.253 3.098 3.381 . 0 0 "[ . 1]" 1
1301 1 51 LEU QD 1 53 ILE H 4.375 . 6.768 3.863 3.643 4.019 . 0 0 "[ . 1]" 1
1302 1 51 LEU QD 1 53 ILE MD 3.344 . 4.742 2.541 2.100 2.907 . 0 0 "[ . 1]" 1
1303 1 51 LEU QD 1 53 ILE HG12 3.122 . 4.340 2.910 2.537 3.118 . 0 0 "[ . 1]" 1
1304 1 51 LEU QD 1 53 ILE HG13 2.932 . 4.006 2.539 2.159 3.538 . 0 0 "[ . 1]" 1
1305 1 51 LEU QD 1 85 HIS HA 3.703 . 5.417 3.660 3.528 3.757 . 0 0 "[ . 1]" 1
1306 1 51 LEU QD 1 86 THR MG 3.128 . 4.351 3.141 2.978 3.349 . 0 0 "[ . 1]" 1
1307 1 51 LEU QD 1 97 LEU MD2 . . 3.689 2.122 1.965 2.263 0.029 4 0 "[ . 1]" 1
1308 1 51 LEU QD 1 97 LEU HG 3.719 . 5.448 3.635 3.425 3.810 . 0 0 "[ . 1]" 1
1309 1 51 LEU QD 1 99 LEU QD 3.825 . 5.654 4.120 3.830 4.400 . 0 0 "[ . 1]" 1
1310 1 51 LEU QD 1 111 PHE HA 3.796 . 5.597 3.830 3.635 4.068 . 0 0 "[ . 1]" 1
1311 1 51 LEU QD 1 111 PHE HB2 4.031 . 4.670 2.292 2.118 2.493 . 0 0 "[ . 1]" 1
1312 1 51 LEU QD 1 111 PHE HB3 4.043 . 4.903 3.036 2.789 3.362 . 0 0 "[ . 1]" 1
1313 1 51 LEU QD 1 111 PHE QD 2.776 . 3.739 2.638 2.530 2.710 . 0 0 "[ . 1]" 1
1314 1 51 LEU QD 1 111 PHE QE 4.418 . 6.858 3.369 3.222 3.527 . 0 0 "[ . 1]" 1
1315 1 51 LEU QD 1 111 PHE HZ 4.539 . 7.114 4.702 4.559 4.857 . 0 0 "[ . 1]" 1
1316 1 51 LEU QD 1 112 ALA H 4.131 . 5.140 3.784 3.637 3.956 . 0 0 "[ . 1]" 1
1317 1 51 LEU QD 1 126 VAL QG 3.114 . 4.326 3.881 3.434 4.340 0.014 3 0 "[ . 1]" 1
1318 1 51 LEU HG 1 52 VAL H 3.198 . 4.477 3.323 3.247 3.441 . 0 0 "[ . 1]" 1
1319 1 51 LEU HG 1 52 VAL QG 3.703 . 5.417 4.234 4.087 4.436 . 0 0 "[ . 1]" 1
1320 1 51 LEU HG 1 111 PHE HB3 3.698 . 5.407 3.445 3.153 3.923 . 0 0 "[ . 1]" 1
1321 1 51 LEU HG 1 97 LEU MD2 3.585 . 5.191 4.549 4.346 4.775 . 0 0 "[ . 1]" 1
1322 1 51 LEU HG 1 111 PHE HA 4.249 . 6.506 4.443 4.246 4.611 . 0 0 "[ . 1]" 1
1323 1 51 LEU HG 1 111 PHE HB2 3.431 . 4.903 2.535 2.347 2.774 . 0 0 "[ . 1]" 1
1324 1 51 LEU HG 1 111 PHE HB3 3.628 . 5.273 4.200 4.018 4.442 . 0 0 "[ . 1]" 1
1325 1 51 LEU HG 1 111 PHE QD 2.712 . 3.632 2.472 2.388 2.557 . 0 0 "[ . 1]" 1
1326 1 51 LEU HG 1 111 PHE HZ 4.793 . 7.664 6.437 6.284 6.603 . 0 0 "[ . 1]" 1
1327 1 51 LEU HG 1 112 ALA H 3.533 . 5.093 3.558 3.385 3.700 . 0 0 "[ . 1]" 1
1328 1 51 LEU HG 1 113 CYS H 4.347 . 6.709 5.842 5.657 6.064 . 0 0 "[ . 1]" 1
1329 1 52 VAL H 1 52 VAL HB 2.779 . 3.744 3.239 2.567 3.776 0.032 7 0 "[ . 1]" 1
1330 1 52 VAL H 1 52 VAL QG 2.832 . 3.834 2.219 2.022 2.575 . 0 0 "[ . 1]" 1
1331 1 52 VAL H 1 53 ILE H 3.734 . 5.476 4.462 4.386 4.505 . 0 0 "[ . 1]" 1
1332 1 52 VAL H 1 53 ILE HA 4.387 . 6.793 4.220 4.159 4.297 . 0 0 "[ . 1]" 1
1333 1 52 VAL H 1 59 MET ME 4.575 . 7.192 4.316 4.055 4.641 . 0 0 "[ . 1]" 1
1334 1 52 VAL H 1 85 HIS QB 4.217 . 6.440 4.982 4.792 5.522 . 0 0 "[ . 1]" 1
1335 1 52 VAL H 1 97 LEU MD2 4.201 . 6.407 4.898 4.757 5.349 . 0 0 "[ . 1]" 1
1336 1 52 VAL H 1 111 PHE HA 3.807 . 5.619 4.198 4.109 4.293 . 0 0 "[ . 1]" 1
1337 1 52 VAL H 1 111 PHE HB2 4.046 . 6.092 4.105 3.978 4.186 . 0 0 "[ . 1]" 1
1338 1 52 VAL H 1 111 PHE QD 4.521 . 7.076 4.750 4.496 4.996 . 0 0 "[ . 1]" 1
1339 1 52 VAL H 1 112 ALA H 2.802 . 3.783 2.527 2.446 2.630 . 0 0 "[ . 1]" 1
1340 1 52 VAL H 1 112 ALA MB 3.888 . 5.777 4.147 3.994 4.291 . 0 0 "[ . 1]" 1
1341 1 52 VAL H 1 113 CYS H 5.164 . 8.497 4.989 4.889 5.097 . 0 0 "[ . 1]" 1
1342 1 52 VAL H 1 113 CYS HA 3.733 . 5.475 3.755 3.650 3.839 . 0 0 "[ . 1]" 1
1343 1 52 VAL H 1 114 THR H 4.503 . 7.038 4.632 4.496 4.769 . 0 0 "[ . 1]" 1
1344 1 52 VAL HA 1 52 VAL QG 3.001 . 4.127 2.270 2.135 2.380 . 0 0 "[ . 1]" 1
1345 1 52 VAL HA 1 53 ILE H 2.464 . 3.223 2.213 2.149 2.261 . 0 0 "[ . 1]" 1
1346 1 52 VAL HA 1 53 ILE HB 3.823 . 5.650 4.540 4.480 4.610 . 0 0 "[ . 1]" 1
1347 1 52 VAL HA 1 85 HIS HA 2.893 . 3.939 2.273 2.162 2.519 . 0 0 "[ . 1]" 1
1348 1 52 VAL HA 1 85 HIS QB 3.440 . 4.750 2.921 2.655 3.269 . 0 0 "[ . 1]" 1
1349 1 52 VAL HB 1 53 ILE H 3.327 . 4.710 3.484 2.760 4.150 . 0 0 "[ . 1]" 1
1350 1 52 VAL HB 1 85 HIS HA 4.195 . 6.395 4.324 3.941 5.150 . 0 0 "[ . 1]" 1
1351 1 52 VAL HB 1 85 HIS QB 3.899 . 5.800 3.503 2.789 4.439 . 0 0 "[ . 1]" 1
1352 1 52 VAL HB 1 86 THR H 4.612 . 7.271 5.481 4.691 6.081 . 0 0 "[ . 1]" 1
1353 1 52 VAL HB 1 112 ALA H 3.863 . 5.728 4.478 3.426 4.971 . 0 0 "[ . 1]" 1
1354 1 52 VAL HB 1 114 THR MG 3.050 . 4.213 3.172 2.386 3.721 . 0 0 "[ . 1]" 1
1355 1 52 VAL QG 1 53 ILE H 3.167 . 3.399 2.886 2.252 3.371 . 0 0 "[ . 1]" 1
1356 1 52 VAL QG 1 54 ALA H 3.220 . 4.516 3.611 3.470 3.802 . 0 0 "[ . 1]" 1
1357 1 52 VAL QG 1 54 ALA MB 3.010 . 4.143 3.023 2.608 3.435 . 0 0 "[ . 1]" 1
1358 1 52 VAL QG 1 75 VAL HB 3.400 . 4.845 3.348 2.754 3.923 . 0 0 "[ . 1]" 1
1359 1 52 VAL QG 1 75 VAL QG 2.619 . 3.476 2.202 1.990 2.599 . 0 0 "[ . 1]" 1
1360 1 52 VAL QG 1 85 HIS HA 3.128 . 4.351 3.004 2.623 3.402 . 0 0 "[ . 1]" 1
1361 1 52 VAL QG 1 85 HIS QB 2.864 . 3.889 2.011 1.830 2.330 0.058 3 0 "[ . 1]" 1
1362 1 52 VAL QG 1 86 THR H 3.208 . 4.494 3.681 3.224 4.778 0.284 5 0 "[ . 1]" 1
1363 1 52 VAL QG 1 112 ALA H 3.216 . 4.509 3.007 2.474 3.953 . 0 0 "[ . 1]" 1
1364 1 52 VAL QG 1 112 ALA MB 3.731 . 5.471 3.161 2.574 4.152 . 0 0 "[ . 1]" 1
1365 1 52 VAL QG 1 113 CYS H 4.338 . 6.691 4.701 4.251 5.385 . 0 0 "[ . 1]" 1
1366 1 52 VAL QG 1 113 CYS HA 3.814 . 5.633 3.570 3.282 3.899 . 0 0 "[ . 1]" 1
1367 1 52 VAL QG 1 114 THR H 3.327 . 4.710 3.249 3.061 3.707 . 0 0 "[ . 1]" 1
1368 1 52 VAL QG 1 114 THR MG 2.722 . 3.358 1.912 1.816 2.096 . 0 0 "[ . 1]" 1
1369 1 53 ILE H 1 53 ILE HB 2.602 . 3.448 2.580 2.494 2.654 . 0 0 "[ . 1]" 1
1370 1 53 ILE H 1 53 ILE MD 3.811 . 5.627 4.093 3.808 4.227 . 0 0 "[ . 1]" 1
1371 1 53 ILE H 1 53 ILE MD 3.249 . 4.568 3.925 3.677 4.051 . 0 0 "[ . 1]" 1
1372 1 53 ILE H 1 53 ILE HG12 3.718 . 5.446 3.773 2.759 4.068 . 0 0 "[ . 1]" 1
1373 1 53 ILE H 1 53 ILE HG13 3.606 . 5.231 3.206 2.830 4.074 . 0 0 "[ . 1]" 1
1374 1 53 ILE H 1 53 ILE MG 3.810 . 5.624 3.809 3.756 3.841 . 0 0 "[ . 1]" 1
1375 1 53 ILE H 1 83 VAL H 3.581 . 5.184 4.200 3.985 4.382 . 0 0 "[ . 1]" 1
1376 1 53 ILE H 1 84 ALA H 3.059 . 4.229 3.058 2.909 3.275 . 0 0 "[ . 1]" 1
1377 1 53 ILE H 1 84 ALA MB 2.952 . 4.041 3.714 3.453 3.948 . 0 0 "[ . 1]" 1
1378 1 53 ILE H 1 85 HIS HA 3.320 . 4.698 3.566 3.440 4.103 . 0 0 "[ . 1]" 1
1379 1 53 ILE H 1 85 HIS QB 4.278 . 5.012 3.820 3.537 4.259 . 0 0 "[ . 1]" 1
1380 1 53 ILE H 1 97 LEU MD2 4.492 . 7.014 3.782 3.466 4.259 . 0 0 "[ . 1]" 1
1381 1 53 ILE H 1 111 PHE HA 4.474 . 6.976 4.736 4.570 5.004 . 0 0 "[ . 1]" 1
1382 1 53 ILE HA 1 53 ILE MD 3.317 . 4.692 3.441 2.106 3.792 . 0 0 "[ . 1]" 1
1383 1 53 ILE HA 1 53 ILE HG12 3.048 . 4.210 2.530 2.375 2.987 . 0 0 "[ . 1]" 1
1384 1 53 ILE HA 1 53 ILE HG13 3.172 . 4.429 3.141 2.937 3.778 . 0 0 "[ . 1]" 1
1385 1 53 ILE HA 1 53 ILE MG 2.754 . 3.702 2.466 2.403 2.525 . 0 0 "[ . 1]" 1
1386 1 53 ILE HA 1 54 ALA H 2.339 . 3.023 2.120 2.097 2.167 . 0 0 "[ . 1]" 1
1387 1 53 ILE HA 1 54 ALA HA 4.165 . 6.334 4.388 4.373 4.404 . 0 0 "[ . 1]" 1
1388 1 53 ILE HA 1 59 MET ME 3.255 . 4.579 3.315 3.106 3.544 . 0 0 "[ . 1]" 1
1389 1 53 ILE HA 1 109 TYR QD 3.848 . 5.699 4.746 4.499 4.967 . 0 0 "[ . 1]" 1
1390 1 53 ILE HA 1 110 LYS H 4.169 . 6.342 4.401 4.219 4.634 . 0 0 "[ . 1]" 1
1391 1 53 ILE HA 1 111 PHE HA 3.040 . 4.195 2.535 2.315 2.873 . 0 0 "[ . 1]" 1
1392 1 53 ILE HA 1 111 PHE HB2 4.104 . 6.210 3.985 3.694 4.260 . 0 0 "[ . 1]" 1
1393 1 53 ILE HA 1 111 PHE HB3 4.094 . 6.189 3.665 3.567 3.830 . 0 0 "[ . 1]" 1
1394 1 53 ILE HA 1 111 PHE QD 3.813 . 5.630 5.306 5.185 5.490 . 0 0 "[ . 1]" 1
1395 1 53 ILE HA 1 112 ALA H 3.792 . 5.589 4.146 3.934 4.350 . 0 0 "[ . 1]" 1
1396 1 53 ILE HB 1 53 ILE MD 2.725 . 3.654 2.633 2.463 3.235 . 0 0 "[ . 1]" 1
1397 1 53 ILE HB 1 53 ILE HG12 2.904 . 3.958 2.780 2.135 2.935 . 0 0 "[ . 1]" 1
1398 1 53 ILE HB 1 53 ILE HG13 2.843 . 3.853 2.437 2.410 2.460 . 0 0 "[ . 1]" 1
1399 1 53 ILE HB 1 54 ALA H 3.521 . 5.070 3.731 3.412 3.902 . 0 0 "[ . 1]" 1
1400 1 53 ILE HB 1 84 ALA H 3.122 . 4.340 2.992 2.541 3.368 . 0 0 "[ . 1]" 1
1401 1 53 ILE HB 1 99 LEU QD 3.598 . 5.216 3.170 2.751 3.710 . 0 0 "[ . 1]" 1
1402 1 53 ILE HB 1 126 VAL QG 3.185 . 4.453 4.117 3.882 4.538 0.085 6 0 "[ . 1]" 1
1403 1 53 ILE MD 1 53 ILE HG13 2.485 . 3.257 2.120 2.118 2.121 . 0 0 "[ . 1]" 1
1404 1 53 ILE MD 1 53 ILE MG 2.290 . 2.945 1.914 1.865 1.951 . 0 0 "[ . 1]" 1
1405 1 53 ILE MD 1 54 ALA H 3.978 . 5.956 4.808 3.754 5.131 . 0 0 "[ . 1]" 1
1406 1 53 ILE MD 1 104 LEU QD 2.840 . 3.848 2.128 1.969 2.437 . 0 0 "[ . 1]" 1
1407 1 53 ILE MD 1 109 TYR QD 3.603 . 5.226 5.066 4.646 5.478 0.252 7 0 "[ . 1]" 1
1408 1 53 ILE MD 1 111 PHE H 4.197 . 6.399 5.281 4.205 5.773 . 0 0 "[ . 1]" 1
1409 1 53 ILE MD 1 111 PHE HA 3.919 . 5.839 4.208 2.737 4.762 . 0 0 "[ . 1]" 1
1410 1 53 ILE MD 1 111 PHE HB2 3.817 . 5.638 3.593 2.553 4.282 . 0 0 "[ . 1]" 1
1411 1 53 ILE MD 1 111 PHE HB3 3.368 . 4.786 2.992 1.935 3.533 0.015 6 0 "[ . 1]" 1
1412 1 53 ILE MD 1 111 PHE QD 3.230 . 4.534 4.249 3.569 4.657 0.123 7 0 "[ . 1]" 1
1413 1 53 ILE MD 1 126 VAL HB 3.567 . 5.158 3.440 3.071 3.933 . 0 0 "[ . 1]" 1
1414 1 53 ILE HG12 1 53 ILE MG 2.645 . 3.519 2.584 2.412 3.203 . 0 0 "[ . 1]" 1
1415 1 53 ILE HG12 1 97 LEU MD1 3.505 . 5.041 4.756 3.296 5.458 0.417 10 0 "[ . 1]" 1
1416 1 53 ILE HG12 1 97 LEU MD2 3.403 . 4.851 4.296 2.655 4.977 0.126 10 0 "[ . 1]" 1
1417 1 53 ILE HG12 1 109 TYR QD 4.106 . 6.213 5.905 5.358 6.455 0.242 9 0 "[ . 1]" 1
1418 1 53 ILE HG12 1 111 PHE H 4.036 . 6.072 5.089 4.442 6.960 0.888 9 2 "[ .- +1]" 1
1419 1 53 ILE HG12 1 111 PHE HA 3.629 . 5.275 3.360 2.901 4.664 . 0 0 "[ . 1]" 1
1420 1 53 ILE HG12 1 111 PHE HB2 3.804 . 5.613 3.188 2.431 4.389 . 0 0 "[ . 1]" 1
1421 1 53 ILE HG12 1 111 PHE HB3 3.501 . 5.033 2.606 2.016 4.385 . 0 0 "[ . 1]" 1
1422 1 53 ILE HG13 1 85 HIS HA 3.555 . 5.134 3.775 3.673 3.844 . 0 0 "[ . 1]" 1
1423 1 53 ILE HG13 1 111 PHE HA 3.726 . 5.461 4.278 3.757 5.745 0.284 6 0 "[ . 1]" 1
1424 1 53 ILE HG13 1 111 PHE QD 3.879 . 5.759 5.364 4.941 6.440 0.681 9 2 "[ .- +1]" 1
1425 1 53 ILE MG 1 54 ALA H 2.599 . 3.443 2.828 2.745 2.961 . 0 0 "[ . 1]" 1
1426 1 53 ILE MG 1 54 ALA HA 3.806 . 5.617 3.373 3.250 3.494 . 0 0 "[ . 1]" 1
1427 1 53 ILE MG 1 54 ALA HA 3.133 . 4.360 2.665 2.453 2.886 . 0 0 "[ . 1]" 1
1428 1 53 ILE MG 1 84 ALA H 3.917 . 5.835 3.949 3.717 4.400 . 0 0 "[ . 1]" 1
1429 1 53 ILE MG 1 84 ALA MB 3.007 . 4.137 3.845 3.541 4.206 0.069 5 0 "[ . 1]" 1
1430 1 53 ILE MG 1 99 LEU QD 3.017 . 4.154 2.451 2.002 2.720 . 0 0 "[ . 1]" 1
1431 1 53 ILE MG 1 104 LEU QD 2.889 . 3.932 2.350 2.073 2.539 . 0 0 "[ . 1]" 1
1432 1 53 ILE MG 1 109 TYR HA 4.164 . 6.331 4.463 4.189 4.892 . 0 0 "[ . 1]" 1
1433 1 53 ILE MG 1 109 TYR HB2 3.440 . 4.919 3.536 3.145 4.044 . 0 0 "[ . 1]" 1
1434 1 53 ILE MG 1 109 TYR HB3 3.664 . 5.342 2.494 2.154 2.958 . 0 0 "[ . 1]" 1
1435 1 53 ILE MG 1 109 TYR QD 2.336 . 3.018 2.479 2.139 2.802 . 0 0 "[ . 1]" 1
1436 1 53 ILE MG 1 109 TYR QE 4.044 . 6.088 3.908 3.499 4.322 . 0 0 "[ . 1]" 1
1437 1 53 ILE MG 1 110 LYS H 4.105 . 6.211 3.784 3.582 4.245 . 0 0 "[ . 1]" 1
1438 1 53 ILE MG 1 110 LYS H 3.366 . 4.782 3.140 2.890 3.468 . 0 0 "[ . 1]" 1
1439 1 53 ILE MG 1 111 PHE HA 3.345 . 4.743 3.396 3.147 3.531 . 0 0 "[ . 1]" 1
1440 1 53 ILE MG 1 112 ALA H 3.633 . 5.283 4.935 4.659 5.089 . 0 0 "[ . 1]" 1
1441 1 53 ILE MG 1 126 VAL QG 2.464 . 2.867 2.040 1.897 2.178 . 0 0 "[ . 1]" 1
1442 1 54 ALA H 1 54 ALA HA 2.922 . 3.989 2.913 2.891 2.927 . 0 0 "[ . 1]" 1
1443 1 54 ALA H 1 54 ALA MB 2.692 . 3.598 2.668 2.622 2.739 . 0 0 "[ . 1]" 1
1444 1 54 ALA H 1 55 LYS H 4.089 . 6.179 4.382 4.368 4.403 . 0 0 "[ . 1]" 1
1445 1 54 ALA H 1 59 MET ME 2.725 . 3.653 2.868 2.323 3.222 . 0 0 "[ . 1]" 1
1446 1 54 ALA H 1 62 VAL QG 3.369 . 4.788 4.614 4.312 4.916 0.128 8 0 "[ . 1]" 1
1447 1 54 ALA H 1 109 TYR HB2 4.219 . 6.444 5.465 5.274 5.882 . 0 0 "[ . 1]" 1
1448 1 54 ALA H 1 109 TYR QD 3.543 . 5.112 3.589 3.468 3.690 . 0 0 "[ . 1]" 1
1449 1 54 ALA H 1 110 LYS H 3.082 . 4.270 2.989 2.792 3.173 . 0 0 "[ . 1]" 1
1450 1 54 ALA H 1 111 PHE H 4.049 . 6.099 5.216 5.137 5.364 . 0 0 "[ . 1]" 1
1451 1 54 ALA H 1 111 PHE HA 3.411 . 4.866 3.665 3.469 3.809 . 0 0 "[ . 1]" 1
1452 1 54 ALA H 1 126 VAL QG 3.465 . 4.965 4.037 3.685 4.363 . 0 0 "[ . 1]" 1
1453 1 54 ALA HA 1 54 ALA MB 2.477 . 3.244 2.132 2.128 2.135 . 0 0 "[ . 1]" 1
1454 1 54 ALA HA 1 55 LYS H 2.778 . 3.743 2.450 2.343 2.528 . 0 0 "[ . 1]" 1
1455 1 54 ALA HA 1 55 LYS HA 3.690 . 5.392 4.311 4.264 4.333 . 0 0 "[ . 1]" 1
1456 1 54 ALA HA 1 82 VAL HA 3.442 . 4.923 3.254 2.406 4.787 . 0 0 "[ . 1]" 1
1457 1 54 ALA HA 1 83 VAL H 3.366 . 4.783 2.992 2.572 3.585 . 0 0 "[ . 1]" 1
1458 1 54 ALA HA 1 83 VAL HB 3.371 . 4.791 4.033 3.595 4.341 . 0 0 "[ . 1]" 1
1459 1 54 ALA HA 1 83 VAL QG 2.948 . 4.034 2.803 2.523 3.138 . 0 0 "[ . 1]" 1
1460 1 54 ALA HA 1 84 ALA H 4.544 . 7.125 4.820 4.425 5.381 . 0 0 "[ . 1]" 1
1461 1 54 ALA HA 1 109 TYR QD 2.889 . 3.932 2.931 2.679 3.235 . 0 0 "[ . 1]" 1
1462 1 54 ALA HA 1 109 TYR QE 2.985 . 4.099 3.539 3.118 3.874 . 0 0 "[ . 1]" 1
1463 1 54 ALA MB 1 55 LYS H 2.722 . 3.648 2.268 2.117 2.437 . 0 0 "[ . 1]" 1
1464 1 54 ALA MB 1 55 LYS HA 3.222 . 4.520 3.676 3.631 3.711 . 0 0 "[ . 1]" 1
1465 1 54 ALA MB 1 55 LYS HB2 3.197 . 4.474 4.084 3.752 4.427 . 0 0 "[ . 1]" 1
1466 1 54 ALA MB 1 59 MET HA 3.132 . 4.358 3.009 2.621 3.293 . 0 0 "[ . 1]" 1
1467 1 54 ALA MB 1 59 MET ME 2.564 . 3.386 2.603 2.221 2.866 . 0 0 "[ . 1]" 1
1468 1 54 ALA MB 1 59 MET QG 3.562 . 5.148 3.512 1.922 4.011 0.054 8 0 "[ . 1]" 1
1469 1 54 ALA MB 1 62 VAL H 4.490 . 7.010 4.853 4.627 4.962 . 0 0 "[ . 1]" 1
1470 1 54 ALA MB 1 62 VAL QG 2.562 . 3.382 2.039 1.766 2.214 0.109 1 0 "[ . 1]" 1
1471 1 54 ALA MB 1 82 VAL HA 3.118 . 4.333 2.576 2.256 3.467 . 0 0 "[ . 1]" 1
1472 1 54 ALA MB 1 83 VAL H 3.415 . 4.873 3.501 3.239 3.726 . 0 0 "[ . 1]" 1
1473 1 55 LYS H 1 55 LYS HB2 3.469 . 4.973 2.439 2.237 2.589 . 0 0 "[ . 1]" 1
1474 1 55 LYS H 1 55 LYS QD 3.375 . 4.799 4.068 3.651 4.335 . 0 0 "[ . 1]" 1
1475 1 55 LYS H 1 55 LYS QG 2.907 . 3.963 3.158 2.243 3.971 0.008 5 0 "[ . 1]" 1
1476 1 55 LYS H 1 56 ALA H 4.049 . 6.099 4.569 4.527 4.624 . 0 0 "[ . 1]" 1
1477 1 55 LYS H 1 58 ASP H 4.020 . 6.040 4.609 4.292 4.843 . 0 0 "[ . 1]" 1
1478 1 55 LYS H 1 58 ASP HB2 3.633 . 5.283 4.179 3.031 5.662 0.379 5 0 "[ . 1]" 1
1479 1 55 LYS H 1 83 VAL HB 3.250 . 4.570 6.042 5.514 6.507 1.937 6 10 [-****+****] 1
1480 1 55 LYS H 1 83 VAL QG 3.845 . 5.693 4.019 3.502 4.973 . 0 0 "[ . 1]" 1
1481 1 55 LYS H 1 109 TYR HA 4.110 . 6.221 4.690 4.541 4.950 . 0 0 "[ . 1]" 1
1482 1 55 LYS H 1 109 TYR QD 4.003 . 6.006 3.700 3.213 4.192 . 0 0 "[ . 1]" 1
1483 1 55 LYS H 1 109 TYR QE 3.669 . 5.352 3.740 3.313 4.188 . 0 0 "[ . 1]" 1
1484 1 55 LYS HA 1 55 LYS QD 3.660 . 4.498 3.878 2.278 4.242 . 0 0 "[ . 1]" 1
1485 1 55 LYS HA 1 55 LYS QG 3.177 . 4.439 2.455 2.303 2.768 . 0 0 "[ . 1]" 1
1486 1 55 LYS HA 1 56 ALA H 2.361 . 3.058 2.193 2.139 2.302 . 0 0 "[ . 1]" 1
1487 1 55 LYS HA 1 57 GLU H 4.189 . 6.383 4.223 3.882 4.699 . 0 0 "[ . 1]" 1
1488 1 55 LYS HA 1 58 ASP H 3.355 . 4.762 3.989 3.873 4.128 . 0 0 "[ . 1]" 1
1489 1 55 LYS HA 1 109 TYR H 3.926 . 5.852 4.842 4.635 5.312 . 0 0 "[ . 1]" 1
1490 1 55 LYS HA 1 109 TYR HA 2.702 . 3.615 2.349 2.042 2.794 . 0 0 "[ . 1]" 1
1491 1 55 LYS HA 1 109 TYR QD 2.900 . 3.951 3.270 2.955 3.511 . 0 0 "[ . 1]" 1
1492 1 55 LYS HA 1 109 TYR QE 3.142 . 4.376 3.919 3.634 4.231 . 0 0 "[ . 1]" 1
1493 1 55 LYS HA 1 110 LYS H 3.174 . 4.433 3.710 3.395 4.011 . 0 0 "[ . 1]" 1
1494 1 55 LYS HB2 1 55 LYS QD 3.556 . 5.137 2.503 2.278 3.498 . 0 0 "[ . 1]" 1
1495 1 55 LYS HB2 1 55 LYS QD 2.764 . 3.719 1.943 1.909 2.007 . 0 0 "[ . 1]" 1
1496 1 55 LYS HB2 1 56 ALA H 3.050 . 4.213 3.155 2.597 3.864 . 0 0 "[ . 1]" 1
1497 1 55 LYS HB2 1 57 GLU H 3.254 . 4.578 3.121 1.966 3.989 . 0 0 "[ . 1]" 1
1498 1 55 LYS HB2 1 56 ALA H 4.048 . 6.096 4.146 3.880 4.292 . 0 0 "[ . 1]" 1
1499 1 55 LYS HB2 1 57 GLU H 4.480 . 6.989 4.497 3.662 5.447 . 0 0 "[ . 1]" 1
1500 1 55 LYS HB2 1 58 ASP H 3.026 . 4.170 3.944 2.843 4.985 0.815 5 4 "[* - + * 1]" 1
1501 1 55 LYS HB2 1 58 ASP HB2 3.892 . 5.785 3.532 2.223 5.545 . 0 0 "[ . 1]" 1
1502 1 55 LYS HB3 1 55 LYS QD 3.425 . 4.852 2.654 2.331 2.987 . 0 0 "[ . 1]" 1
1503 1 55 LYS HB3 1 109 TYR QD 3.685 . 5.383 5.157 4.978 5.489 0.106 4 0 "[ . 1]" 1
1504 1 55 LYS HB3 1 109 TYR QE 3.261 . 4.590 4.853 4.297 5.295 0.705 4 1 "[ +. 1]" 1
1505 1 55 LYS QD 1 55 LYS QE 3.648 . 4.960 2.059 1.998 2.094 . 0 0 "[ . 1]" 1
1506 1 55 LYS QD 1 56 ALA H 3.434 . 4.908 4.911 3.711 5.608 0.700 2 1 "[ + . 1]" 1
1507 1 55 LYS QD 1 109 TYR QE 2.639 . 3.509 3.416 2.883 3.805 0.296 7 0 "[ . 1]" 1
1508 1 55 LYS QD 1 109 TYR QE 2.931 . 4.005 2.943 2.722 3.345 . 0 0 "[ . 1]" 1
1509 1 55 LYS QD 1 107 GLY QA 4.117 . 5.926 4.202 3.797 4.593 . 0 0 "[ . 1]" 1
1510 1 55 LYS QD 1 109 TYR QE 3.797 . 5.475 3.714 2.991 4.572 . 0 0 "[ . 1]" 1
1511 1 55 LYS QE 1 107 GLY QA 3.328 . 4.713 3.110 2.577 3.712 . 0 0 "[ . 1]" 1
1512 1 55 LYS QG 1 107 GLY QA 3.730 . 5.201 3.869 3.391 5.628 0.427 4 0 "[ . 1]" 1
1513 1 55 LYS QG 1 108 ASP H 3.532 . 5.091 4.313 3.557 6.583 1.492 4 1 "[ +. 1]" 1
1514 1 55 LYS QG 1 109 TYR QD 3.596 . 5.212 3.799 3.264 4.479 . 0 0 "[ . 1]" 1
1515 1 55 LYS QG 1 109 TYR QE 3.142 . 4.376 3.253 2.477 4.206 . 0 0 "[ . 1]" 1
1516 1 56 ALA H 1 56 ALA HA 2.873 . 3.904 2.772 2.726 2.798 . 0 0 "[ . 1]" 1
1517 1 56 ALA H 1 57 GLU H 3.170 . 4.426 2.825 2.685 3.097 . 0 0 "[ . 1]" 1
1518 1 56 ALA H 1 57 GLU QB 3.980 . 5.960 4.799 4.432 5.198 . 0 0 "[ . 1]" 1
1519 1 56 ALA H 1 58 ASP H 3.954 . 5.908 4.133 3.957 4.270 . 0 0 "[ . 1]" 1
1520 1 56 ALA H 1 59 MET H 4.844 . 7.778 5.056 4.762 5.270 . 0 0 "[ . 1]" 1
1521 1 56 ALA H 1 108 ASP HB2 3.803 . 5.611 4.972 4.088 5.829 0.218 4 0 "[ . 1]" 1
1522 1 56 ALA H 1 108 ASP HB3 3.648 . 5.312 4.359 3.660 5.760 0.448 8 0 "[ . 1]" 1
1523 1 56 ALA H 1 109 TYR HA 2.838 . 3.845 2.615 2.399 2.899 . 0 0 "[ . 1]" 1
1524 1 56 ALA H 1 109 TYR HB3 4.811 . 7.704 5.094 4.792 5.449 . 0 0 "[ . 1]" 1
1525 1 56 ALA H 1 109 TYR QD 4.153 . 6.308 4.614 4.322 4.959 . 0 0 "[ . 1]" 1
1526 1 56 ALA H 1 110 LYS QD 3.520 . 5.069 4.673 4.362 5.159 0.090 3 0 "[ . 1]" 1
1527 1 56 ALA HA 1 56 ALA MB 2.261 . 2.900 2.100 1.948 2.122 . 0 0 "[ . 1]" 1
1528 1 56 ALA HA 1 57 GLU H 3.329 . 4.714 3.511 3.461 3.576 . 0 0 "[ . 1]" 1
1529 1 56 ALA HA 1 58 ASP H 4.120 . 6.242 3.961 3.768 4.257 . 0 0 "[ . 1]" 1
1530 1 56 ALA HA 1 59 MET H 3.774 . 5.554 3.582 3.241 4.149 . 0 0 "[ . 1]" 1
1531 1 56 ALA HA 1 59 MET QG 3.195 . 4.471 3.408 2.696 4.022 . 0 0 "[ . 1]" 1
1532 1 56 ALA HA 1 109 TYR HA 3.942 . 5.885 4.287 4.071 4.578 . 0 0 "[ . 1]" 1
1533 1 56 ALA HA 1 110 LYS HA 4.270 . 6.549 5.514 5.295 5.734 . 0 0 "[ . 1]" 1
1534 1 56 ALA HA 1 110 LYS HB2 3.854 . 5.711 3.477 3.046 4.719 . 0 0 "[ . 1]" 1
1535 1 56 ALA HA 1 110 LYS HB3 3.938 . 5.876 4.639 3.722 4.977 . 0 0 "[ . 1]" 1
1536 1 56 ALA HA 1 110 LYS QD 2.641 . 3.513 2.583 2.111 3.089 . 0 0 "[ . 1]" 1
1537 1 56 ALA HA 1 110 LYS QE 3.797 . 5.599 3.998 2.290 4.649 . 0 0 "[ . 1]" 1
1538 1 56 ALA MB 1 57 GLU H 2.638 . 3.508 2.580 2.265 2.850 . 0 0 "[ . 1]" 1
1539 1 56 ALA MB 1 58 ASP H 3.387 . 4.821 4.299 4.088 4.454 . 0 0 "[ . 1]" 1
1540 1 56 ALA MB 1 108 ASP H 3.485 . 5.003 4.245 3.966 4.462 . 0 0 "[ . 1]" 1
1541 1 56 ALA MB 1 108 ASP HB2 2.845 . 3.857 3.730 2.741 4.502 0.645 3 2 "[ -+ . 1]" 1
1542 1 56 ALA MB 1 108 ASP HB3 2.917 . 3.980 3.125 2.487 4.516 0.536 8 1 "[ . + 1]" 1
1543 1 56 ALA MB 1 109 TYR HA 3.368 . 4.786 3.346 3.077 3.625 . 0 0 "[ . 1]" 1
1544 1 57 GLU H 1 57 GLU HA 2.896 . 3.944 2.851 2.780 2.896 . 0 0 "[ . 1]" 1
1545 1 57 GLU H 1 57 GLU QB 2.634 . 3.501 2.374 2.193 2.646 . 0 0 "[ . 1]" 1
1546 1 57 GLU H 1 57 GLU HG2 3.274 . 4.614 3.310 2.032 4.430 . 0 0 "[ . 1]" 1
1547 1 57 GLU H 1 57 GLU HG3 2.890 . 3.934 3.466 2.406 4.489 0.555 6 3 "[- .+ * 1]" 1
1548 1 57 GLU H 1 58 ASP H 3.006 . 4.136 2.550 2.429 2.732 . 0 0 "[ . 1]" 1
1549 1 57 GLU H 1 58 ASP HB2 4.726 . 7.517 4.692 4.389 5.021 . 0 0 "[ . 1]" 1
1550 1 57 GLU H 1 59 MET H 3.861 . 5.724 4.000 3.814 4.168 . 0 0 "[ . 1]" 1
1551 1 57 GLU HA 1 57 GLU QB 2.252 . 2.886 2.325 2.173 2.400 . 0 0 "[ . 1]" 1
1552 1 57 GLU HA 1 57 GLU HG2 3.088 . 4.280 3.070 2.444 3.812 . 0 0 "[ . 1]" 1
1553 1 57 GLU HA 1 57 GLU HG3 2.876 . 3.910 3.201 2.583 3.778 . 0 0 "[ . 1]" 1
1554 1 57 GLU HA 1 58 ASP H 3.350 . 4.753 3.398 3.249 3.489 . 0 0 "[ . 1]" 1
1555 1 57 GLU HA 1 59 MET H 3.865 . 5.733 3.899 3.617 4.074 . 0 0 "[ . 1]" 1
1556 1 57 GLU HA 1 60 ASP H 4.240 . 6.487 5.029 4.421 5.777 . 0 0 "[ . 1]" 1
1557 1 57 GLU HA 1 61 GLY H 4.903 . 7.909 6.750 6.437 7.088 . 0 0 "[ . 1]" 1
1558 1 57 GLU QB 1 57 GLU HG2 2.304 . 2.968 2.340 2.293 2.388 . 0 0 "[ . 1]" 1
1559 1 57 GLU QB 1 57 GLU HG3 2.306 . 2.971 2.305 2.164 2.389 . 0 0 "[ . 1]" 1
1560 1 57 GLU QB 1 58 ASP H 3.163 . 4.414 3.210 2.817 3.757 . 0 0 "[ . 1]" 1
1561 1 57 GLU QB 1 59 MET H 3.034 . 4.185 3.597 2.703 3.905 . 0 0 "[ . 1]" 1
1562 1 57 GLU HG2 1 58 ASP H 3.578 . 5.178 4.323 3.194 5.221 0.043 2 0 "[ . 1]" 1
1563 1 57 GLU HG3 1 58 ASP H 3.236 . 4.545 4.557 2.918 5.485 0.940 5 2 "[ -+ 1]" 1
1564 1 58 ASP H 1 58 ASP HB2 2.752 . 3.699 2.639 2.468 3.049 . 0 0 "[ . 1]" 1
1565 1 58 ASP H 1 59 MET H 2.427 . 3.163 2.171 2.042 2.350 . 0 0 "[ . 1]" 1
1566 1 58 ASP H 1 60 ASP H 3.959 . 5.918 4.504 4.228 4.869 . 0 0 "[ . 1]" 1
1567 1 58 ASP H 1 62 VAL QG 4.148 . 6.299 4.884 4.666 5.250 . 0 0 "[ . 1]" 1
1568 1 58 ASP HA 1 59 MET H 3.421 . 4.884 3.178 3.032 3.316 . 0 0 "[ . 1]" 1
1569 1 58 ASP HA 1 60 ASP H 4.078 . 6.157 3.803 3.697 3.957 . 0 0 "[ . 1]" 1
1570 1 58 ASP HB2 1 59 MET H 3.338 . 4.731 3.939 3.469 4.401 . 0 0 "[ . 1]" 1
1571 1 58 ASP HB3 1 62 VAL QG 3.753 . 5.514 3.557 3.228 4.044 . 0 0 "[ . 1]" 1
1572 1 59 MET H 1 59 MET HA 2.816 . 3.807 2.817 2.765 2.856 . 0 0 "[ . 1]" 1
1573 1 59 MET H 1 59 MET HB2 2.553 . 3.368 2.326 2.246 2.504 . 0 0 "[ . 1]" 1
1574 1 59 MET H 1 59 MET HB3 2.790 . 3.763 2.904 2.591 3.535 . 0 0 "[ . 1]" 1
1575 1 59 MET H 1 60 ASP H 2.939 . 4.018 2.623 2.464 2.810 . 0 0 "[ . 1]" 1
1576 1 59 MET H 1 60 ASP HA 4.408 . 6.837 5.222 5.058 5.376 . 0 0 "[ . 1]" 1
1577 1 59 MET H 1 61 GLY H 4.164 . 6.331 4.253 4.066 4.448 . 0 0 "[ . 1]" 1
1578 1 59 MET H 1 62 VAL QG 3.832 . 5.668 4.147 3.954 4.312 . 0 0 "[ . 1]" 1
1579 1 59 MET H 1 109 TYR HA 4.783 . 7.642 6.909 6.554 7.353 . 0 0 "[ . 1]" 1
1580 1 59 MET HA 1 59 MET HB2 2.777 . 3.741 2.657 2.508 2.981 . 0 0 "[ . 1]" 1
1581 1 59 MET HA 1 59 MET HB3 3.000 . 4.125 2.937 2.647 3.020 . 0 0 "[ . 1]" 1
1582 1 59 MET HA 1 59 MET ME 3.482 . 4.998 3.929 3.773 4.492 . 0 0 "[ . 1]" 1
1583 1 59 MET HA 1 60 ASP H 3.368 . 4.786 3.364 3.239 3.449 . 0 0 "[ . 1]" 1
1584 1 59 MET HA 1 62 VAL QG 3.472 . 4.978 2.326 2.031 2.473 . 0 0 "[ . 1]" 1
1585 1 59 MET HA 1 62 VAL H 3.277 . 4.620 3.245 3.019 3.407 . 0 0 "[ . 1]" 1
1586 1 59 MET HA 1 62 VAL HB 2.687 . 3.589 2.756 2.266 3.082 . 0 0 "[ . 1]" 1
1587 1 59 MET HA 1 62 VAL QG 2.836 . 3.841 2.350 2.038 2.505 . 0 0 "[ . 1]" 1
1588 1 59 MET HB2 1 60 ASP H 3.006 . 4.135 3.621 2.965 4.009 . 0 0 "[ . 1]" 1
1589 1 59 MET HB3 1 60 ASP H 2.967 . 4.068 2.903 2.663 3.516 . 0 0 "[ . 1]" 1
1590 1 59 MET HB3 1 63 PHE QE 2.607 . 3.457 3.241 2.251 3.678 0.221 10 0 "[ . 1]" 1
1591 1 59 MET ME 1 59 MET QG 2.669 . 3.560 2.237 2.225 2.243 . 0 0 "[ . 1]" 1
1592 1 59 MET ME 1 110 LYS H 3.628 . 5.273 3.900 3.147 4.286 . 0 0 "[ . 1]" 1
1593 1 59 MET ME 1 110 LYS HB2 2.462 . 3.220 2.746 2.299 3.444 0.224 6 0 "[ . 1]" 1
1594 1 59 MET ME 1 111 PHE H 3.792 . 5.589 3.858 3.708 4.030 . 0 0 "[ . 1]" 1
1595 1 59 MET ME 1 111 PHE HA 3.161 . 4.410 2.780 2.545 3.006 . 0 0 "[ . 1]" 1
1596 1 59 MET ME 1 112 ALA H 3.203 . 4.486 3.000 2.851 3.190 . 0 0 "[ . 1]" 1
1597 1 59 MET ME 1 112 ALA MB 2.436 . 3.178 2.132 1.973 2.367 . 0 0 "[ . 1]" 1
1598 1 59 MET ME 1 114 THR HG1 4.075 . 6.151 6.969 6.661 7.610 1.459 7 10 [**-***+***] 1
1599 1 59 MET ME 1 123 ASN HB2 3.870 . 5.743 4.394 3.800 6.352 0.609 10 1 "[ . +]" 1
1600 1 59 MET QG 1 61 GLY H 3.582 . 5.186 5.634 5.298 6.093 0.907 7 3 "[- . + *1]" 1
1601 1 59 MET QG 1 112 ALA H 4.207 . 6.419 5.744 5.529 5.977 . 0 0 "[ . 1]" 1
1602 1 59 MET QG 1 112 ALA MB 3.435 . 4.910 3.565 3.222 4.110 . 0 0 "[ . 1]" 1
1603 1 60 ASP H 1 60 ASP HA 2.727 . 3.657 2.803 2.779 2.832 . 0 0 "[ . 1]" 1
1604 1 60 ASP H 1 60 ASP QB 2.280 . 2.930 2.296 2.239 2.437 . 0 0 "[ . 1]" 1
1605 1 60 ASP H 1 61 GLY H 2.733 . 3.667 2.683 2.573 2.795 . 0 0 "[ . 1]" 1
1606 1 60 ASP H 1 62 VAL H 3.873 . 5.748 3.953 3.802 4.019 . 0 0 "[ . 1]" 1
1607 1 60 ASP H 1 62 VAL QG 4.275 . 6.559 4.480 4.288 4.557 . 0 0 "[ . 1]" 1
1608 1 60 ASP H 1 63 PHE HB2 4.950 . 8.013 5.799 5.405 6.032 . 0 0 "[ . 1]" 1
1609 1 60 ASP H 1 63 PHE QD 3.990 . 5.980 4.429 4.324 4.519 . 0 0 "[ . 1]" 1
1610 1 60 ASP HA 1 60 ASP QB 2.467 . 3.228 2.374 2.310 2.454 . 0 0 "[ . 1]" 1
1611 1 60 ASP HA 1 61 GLY H 3.455 . 4.947 3.526 3.502 3.544 . 0 0 "[ . 1]" 1
1612 1 60 ASP HA 1 63 PHE HB2 3.203 . 4.485 3.300 3.127 3.554 . 0 0 "[ . 1]" 1
1613 1 60 ASP HA 1 63 PHE HB3 3.540 . 5.107 4.946 4.830 5.212 0.105 8 0 "[ . 1]" 1
1614 1 60 ASP HA 1 63 PHE QD 2.454 . 3.207 2.252 1.939 2.765 . 0 0 "[ . 1]" 1
1615 1 60 ASP HA 1 64 LYS H 3.896 . 5.793 4.358 3.982 4.696 . 0 0 "[ . 1]" 1
1616 1 60 ASP QB 1 61 GLY H 2.652 . 3.531 2.588 2.461 2.717 . 0 0 "[ . 1]" 1
1617 1 60 ASP QB 1 61 GLY QA 3.850 . 5.702 3.683 3.540 3.867 . 0 0 "[ . 1]" 1
1618 1 60 ASP QB 1 62 VAL H 3.873 . 5.748 4.554 4.410 4.647 . 0 0 "[ . 1]" 1
1619 1 61 GLY H 1 61 GLY QA 2.328 . 3.005 2.205 2.198 2.213 . 0 0 "[ . 1]" 1
1620 1 61 GLY H 1 62 VAL H 2.701 . 3.613 2.554 2.469 2.623 . 0 0 "[ . 1]" 1
1621 1 61 GLY H 1 62 VAL HA 4.049 . 6.098 5.161 5.105 5.222 . 0 0 "[ . 1]" 1
1622 1 61 GLY H 1 62 VAL HB 4.268 . 6.545 4.809 4.714 4.881 . 0 0 "[ . 1]" 1
1623 1 61 GLY H 1 62 VAL QG 3.403 . 4.851 3.828 3.641 3.932 . 0 0 "[ . 1]" 1
1624 1 61 GLY H 1 64 LYS QD 3.816 . 5.636 4.911 4.055 5.949 0.313 4 0 "[ . 1]" 1
1625 1 61 GLY H 1 81 ARG HD3 4.392 . 6.803 4.980 4.145 5.564 . 0 0 "[ . 1]" 1
1626 1 61 GLY QA 1 62 VAL H 3.337 . 4.729 2.795 2.768 2.865 . 0 0 "[ . 1]" 1
1627 1 61 GLY QA 1 62 VAL HA 3.650 . 5.315 4.046 4.029 4.078 . 0 0 "[ . 1]" 1
1628 1 61 GLY QA 1 62 VAL QG 3.927 . 5.854 3.778 3.724 3.839 . 0 0 "[ . 1]" 1
1629 1 61 GLY QA 1 64 LYS H 3.462 . 4.960 3.311 3.072 3.493 . 0 0 "[ . 1]" 1
1630 1 61 GLY QA 1 64 LYS QB 2.999 . 4.123 2.629 2.328 3.911 . 0 0 "[ . 1]" 1
1631 1 61 GLY QA 1 64 LYS QD 3.610 . 5.239 3.247 2.020 4.774 . 0 0 "[ . 1]" 1
1632 1 62 VAL H 1 62 VAL HB 2.555 . 3.371 2.505 2.437 2.594 . 0 0 "[ . 1]" 1
1633 1 62 VAL H 1 62 VAL QG 2.937 . 3.143 2.137 2.011 2.318 . 0 0 "[ . 1]" 1
1634 1 62 VAL H 1 63 PHE H 2.755 . 3.703 2.643 2.518 2.706 . 0 0 "[ . 1]" 1
1635 1 62 VAL H 1 64 LYS H 3.940 . 5.881 3.991 3.886 4.257 . 0 0 "[ . 1]" 1
1636 1 62 VAL H 1 81 ARG QB 3.758 . 5.523 4.772 4.093 5.497 . 0 0 "[ . 1]" 1
1637 1 62 VAL H 1 81 ARG HD3 4.094 . 6.189 4.291 3.415 5.643 . 0 0 "[ . 1]" 1
1638 1 62 VAL HA 1 62 VAL QG 2.366 . 3.066 2.135 2.124 2.149 . 0 0 "[ . 1]" 1
1639 1 62 VAL HA 1 63 PHE H 3.732 . 5.473 3.552 3.518 3.575 . 0 0 "[ . 1]" 1
1640 1 62 VAL HA 1 65 ASP H 3.522 . 5.073 3.741 3.460 4.096 . 0 0 "[ . 1]" 1
1641 1 62 VAL HA 1 65 ASP HB3 3.487 . 5.007 4.424 2.790 5.162 0.155 9 0 "[ . 1]" 1
1642 1 62 VAL HA 1 81 ARG QB 4.101 . 6.203 4.300 3.271 5.313 . 0 0 "[ . 1]" 1
1643 1 62 VAL HA 1 81 ARG HD2 4.256 . 6.521 4.160 2.490 6.337 . 0 0 "[ . 1]" 1
1644 1 62 VAL HB 1 62 VAL QG 2.840 . 3.249 1.900 1.898 1.901 . 0 0 "[ . 1]" 1
1645 1 62 VAL HB 1 63 PHE H 2.704 . 3.618 2.584 2.449 2.786 . 0 0 "[ . 1]" 1
1646 1 62 VAL QG 1 63 PHE H 3.592 . 3.817 3.168 3.024 3.303 . 0 0 "[ . 1]" 1
1647 1 62 VAL QG 1 64 LYS H 4.158 . 6.319 4.592 4.480 4.867 . 0 0 "[ . 1]" 1
1648 1 62 VAL QG 1 81 ARG HA 3.532 . 5.092 4.379 3.220 4.988 . 0 0 "[ . 1]" 1
1649 1 62 VAL QG 1 81 ARG QB 2.931 . 4.005 2.451 1.886 3.298 . 0 0 "[ . 1]" 1
1650 1 62 VAL QG 1 81 ARG HD2 3.379 . 4.806 3.353 2.041 5.049 0.243 1 0 "[ . 1]" 1
1651 1 62 VAL QG 1 81 ARG HD3 3.455 . 4.948 3.066 2.245 4.559 . 0 0 "[ . 1]" 1
1652 1 62 VAL QG 1 114 THR MG 2.761 . 3.714 2.234 1.952 2.538 . 0 0 "[ . 1]" 1
1653 1 62 VAL QG 1 114 THR MG 2.920 . 3.986 2.242 1.959 2.558 . 0 0 "[ . 1]" 1
1654 1 63 PHE H 1 63 PHE HA 2.965 . 4.064 2.836 2.816 2.862 . 0 0 "[ . 1]" 1
1655 1 63 PHE H 1 63 PHE HB2 2.745 . 3.687 2.505 2.457 2.581 . 0 0 "[ . 1]" 1
1656 1 63 PHE H 1 63 PHE HB3 3.020 . 4.160 3.622 3.612 3.627 . 0 0 "[ . 1]" 1
1657 1 63 PHE H 1 63 PHE QD 3.108 . 4.315 3.005 2.697 3.220 . 0 0 "[ . 1]" 1
1658 1 63 PHE H 1 64 LYS H 2.772 . 3.732 2.607 2.489 2.709 . 0 0 "[ . 1]" 1
1659 1 63 PHE H 1 66 GLY H 3.959 . 5.918 4.579 4.445 4.643 . 0 0 "[ . 1]" 1
1660 1 63 PHE H 1 114 THR MG 4.144 . 6.290 4.289 4.123 4.434 . 0 0 "[ . 1]" 1
1661 1 63 PHE HA 1 63 PHE QD 2.348 . 3.037 2.341 2.153 2.592 . 0 0 "[ . 1]" 1
1662 1 63 PHE HA 1 64 LYS H 3.754 . 5.516 3.518 3.480 3.563 . 0 0 "[ . 1]" 1
1663 1 63 PHE HA 1 66 GLY H 3.629 . 5.275 3.413 3.186 3.575 . 0 0 "[ . 1]" 1
1664 1 63 PHE HA 1 114 THR MG 3.477 . 4.988 3.030 2.811 3.157 . 0 0 "[ . 1]" 1
1665 1 63 PHE HB2 1 63 PHE QD 2.695 . 3.603 2.269 2.260 2.281 . 0 0 "[ . 1]" 1
1666 1 63 PHE HB2 1 64 LYS H 2.938 . 4.017 2.684 2.467 2.895 . 0 0 "[ . 1]" 1
1667 1 63 PHE HB2 1 64 LYS HA 4.378 . 6.774 4.258 4.182 4.302 . 0 0 "[ . 1]" 1
1668 1 63 PHE HB3 1 63 PHE QD 2.617 . 3.473 2.622 2.524 2.697 . 0 0 "[ . 1]" 1
1669 1 63 PHE HB3 1 64 LYS H 3.309 . 4.677 3.681 3.453 3.941 . 0 0 "[ . 1]" 1
1670 1 63 PHE HB3 1 64 LYS HA 4.275 . 6.560 4.366 4.232 4.567 . 0 0 "[ . 1]" 1
1671 1 63 PHE QR 1 114 THR MG 2.895 . 3.943 2.185 2.034 2.305 . 0 0 "[ . 1]" 1
1672 1 63 PHE QR 1 115 PHE H 4.534 . 7.104 4.651 4.533 4.932 . 0 0 "[ . 1]" 1
1673 1 63 PHE QD 1 64 LYS H 3.924 . 5.848 4.281 4.089 4.383 . 0 0 "[ . 1]" 1
1674 1 63 PHE QD 1 112 ALA MB 2.905 . 3.960 4.196 3.992 4.441 0.481 9 0 "[ . 1]" 1
1675 1 63 PHE QD 1 114 THR HB 2.875 . 3.908 3.240 2.949 3.457 . 0 0 "[ . 1]" 1
1676 1 63 PHE QD 1 114 THR MG 2.591 . 3.430 2.346 2.181 2.512 . 0 0 "[ . 1]" 1
1677 1 63 PHE QE 1 112 ALA H 4.164 . 6.332 5.230 5.100 5.497 . 0 0 "[ . 1]" 1
1678 1 63 PHE QE 1 112 ALA MB 2.875 . 3.909 2.338 2.074 2.666 . 0 0 "[ . 1]" 1
1679 1 63 PHE QE 1 114 THR H 4.106 . 6.213 4.359 4.144 4.612 . 0 0 "[ . 1]" 1
1680 1 63 PHE QE 1 119 GLY H 4.076 . 6.153 4.918 4.656 5.195 . 0 0 "[ . 1]" 1
1681 1 63 PHE QE 1 119 GLY HA3 3.699 . 5.409 3.252 2.992 3.455 . 0 0 "[ . 1]" 1
1682 1 64 LYS H 1 64 LYS HA 2.907 . 3.963 2.816 2.789 2.850 . 0 0 "[ . 1]" 1
1683 1 64 LYS H 1 64 LYS QB 2.444 . 3.190 2.340 2.217 2.643 . 0 0 "[ . 1]" 1
1684 1 64 LYS H 1 64 LYS HG2 3.894 . 5.790 3.816 1.902 4.618 0.096 3 0 "[ . 1]" 1
1685 1 64 LYS H 1 64 LYS HG3 3.134 . 4.362 3.804 2.252 4.498 0.136 9 0 "[ . 1]" 1
1686 1 64 LYS H 1 65 ASP H 2.882 . 3.920 2.710 2.554 2.855 . 0 0 "[ . 1]" 1
1687 1 64 LYS H 1 65 ASP HB3 4.150 . 6.303 5.899 4.873 6.381 0.078 7 0 "[ . 1]" 1
1688 1 64 LYS HA 1 64 LYS QB 2.577 . 3.407 2.347 2.170 2.408 . 0 0 "[ . 1]" 1
1689 1 64 LYS HA 1 64 LYS HG2 3.294 . 4.650 3.169 2.605 3.741 . 0 0 "[ . 1]" 1
1690 1 64 LYS HA 1 64 LYS HG3 3.299 . 4.660 2.944 2.568 3.807 . 0 0 "[ . 1]" 1
1691 1 64 LYS HA 1 66 GLY H 3.503 . 5.037 4.146 3.990 4.419 . 0 0 "[ . 1]" 1
1692 1 64 LYS HA 1 67 VAL H 3.449 . 4.936 3.893 3.704 4.034 . 0 0 "[ . 1]" 1
1693 1 64 LYS HA 1 67 VAL HB 3.885 . 5.772 3.999 3.520 4.427 . 0 0 "[ . 1]" 1
1694 1 64 LYS HA 1 67 VAL QG 3.188 . 4.458 3.206 2.559 3.765 . 0 0 "[ . 1]" 1
1695 1 64 LYS QB 1 65 ASP H 2.540 . 3.347 2.523 2.290 3.271 . 0 0 "[ . 1]" 1
1696 1 64 LYS QB 1 66 GLY H 3.790 . 5.586 4.424 4.244 4.699 . 0 0 "[ . 1]" 1
1697 1 65 ASP H 1 65 ASP HA 2.827 . 3.826 2.867 2.855 2.879 . 0 0 "[ . 1]" 1
1698 1 65 ASP H 1 65 ASP HB3 2.564 . 3.386 3.298 2.470 3.622 0.236 10 0 "[ . 1]" 1
1699 1 65 ASP HB2 1 76 LYS H 4.172 . 6.347 5.049 3.429 6.759 0.412 8 0 "[ . 1]" 1
1700 1 65 ASP HB2 1 76 LYS QD 3.495 . 5.022 3.907 2.602 5.504 0.482 1 0 "[ . 1]" 1
1701 1 66 GLY H 1 66 GLY QA 2.545 . 3.355 2.203 2.187 2.219 . 0 0 "[ . 1]" 1
1702 1 66 GLY H 1 67 VAL H 2.668 . 3.558 2.642 2.550 2.833 . 0 0 "[ . 1]" 1
1703 1 66 GLY H 1 67 VAL HA 4.231 . 6.469 5.239 5.162 5.398 . 0 0 "[ . 1]" 1
1704 1 66 GLY H 1 67 VAL HB 3.976 . 5.952 4.905 4.678 5.166 . 0 0 "[ . 1]" 1
1705 1 66 GLY H 1 67 VAL QG 3.310 . 4.679 3.902 3.683 4.067 . 0 0 "[ . 1]" 1
1706 1 66 GLY H 1 76 LYS QB 3.903 . 5.808 4.945 4.426 6.132 0.324 4 0 "[ . 1]" 1
1707 1 66 GLY QA 1 67 VAL H 3.456 . 4.771 2.708 2.625 2.798 . 0 0 "[ . 1]" 1
1708 1 66 GLY QA 1 69 ALA H 3.773 . 5.465 3.476 3.274 3.703 . 0 0 "[ . 1]" 1
1709 1 66 GLY QA 1 69 ALA MB 3.031 . 4.179 2.615 2.276 2.806 . 0 0 "[ . 1]" 1
1710 1 66 GLY QA 1 74 TYR HA 4.155 . 6.313 3.358 3.111 3.655 . 0 0 "[ . 1]" 1
1711 1 66 GLY QA 1 74 TYR QD 3.177 . 4.439 4.030 3.801 4.207 . 0 0 "[ . 1]" 1
1712 1 66 GLY QA 1 75 VAL HA 3.376 . 4.800 2.880 2.605 3.382 . 0 0 "[ . 1]" 1
1713 1 66 GLY QA 1 75 VAL HA 3.384 . 4.815 2.870 2.602 3.351 . 0 0 "[ . 1]" 1
1714 1 66 GLY QA 1 76 LYS H 3.608 . 5.235 3.563 3.201 4.153 . 0 0 "[ . 1]" 1
1715 1 66 GLY QA 1 76 LYS QB 4.431 . 6.020 4.021 3.360 4.941 . 0 0 "[ . 1]" 1
1716 1 66 GLY QA 1 76 LYS QD 4.171 . 6.346 5.319 3.661 6.028 . 0 0 "[ . 1]" 1
1717 1 66 GLY QA 1 76 LYS QG 4.318 . 6.648 5.189 3.277 6.125 . 0 0 "[ . 1]" 1
1718 1 66 GLY QA 1 114 THR MG 4.446 . 6.917 3.682 3.395 4.005 . 0 0 "[ . 1]" 1
1719 1 67 VAL H 1 67 VAL HA 2.832 . 3.834 2.810 2.792 2.826 . 0 0 "[ . 1]" 1
1720 1 67 VAL H 1 67 VAL HB 2.603 . 3.450 2.552 2.495 2.607 . 0 0 "[ . 1]" 1
1721 1 67 VAL H 1 67 VAL QG 2.416 . 3.146 2.043 1.953 2.137 . 0 0 "[ . 1]" 1
1722 1 67 VAL H 1 68 GLY H 2.916 . 3.979 2.640 2.583 2.690 . 0 0 "[ . 1]" 1
1723 1 67 VAL H 1 68 GLY HA2 4.174 . 6.351 5.271 5.224 5.314 . 0 0 "[ . 1]" 1
1724 1 67 VAL H 1 68 GLY HA3 4.417 . 6.856 4.963 4.908 5.025 . 0 0 "[ . 1]" 1
1725 1 67 VAL H 1 69 ALA H 3.579 . 5.180 3.944 3.826 4.068 . 0 0 "[ . 1]" 1
1726 1 67 VAL H 1 116 PRO HB2 3.921 . 5.843 4.927 4.619 5.280 . 0 0 "[ . 1]" 1
1727 1 67 VAL HA 1 67 VAL HB 2.859 . 3.881 2.970 2.467 3.029 . 0 0 "[ . 1]" 1
1728 1 67 VAL HA 1 67 VAL QG 2.622 . 3.481 2.150 2.125 2.296 . 0 0 "[ . 1]" 1
1729 1 67 VAL HA 1 68 GLY H 3.480 . 4.994 3.482 3.411 3.515 . 0 0 "[ . 1]" 1
1730 1 67 VAL HA 1 69 ALA H 3.001 . 4.127 3.626 3.421 3.751 . 0 0 "[ . 1]" 1
1731 1 67 VAL HA 1 74 TYR QD 2.681 . 3.579 2.469 2.181 2.775 . 0 0 "[ . 1]" 1
1732 1 67 VAL HA 1 74 TYR QE 3.138 . 4.369 3.400 3.134 3.826 . 0 0 "[ . 1]" 1
1733 1 67 VAL HA 1 115 PHE HA 4.470 . 6.968 5.462 5.152 5.725 . 0 0 "[ . 1]" 1
1734 1 67 VAL HA 1 116 PRO QD 3.883 . 5.767 3.142 3.100 3.174 . 0 0 "[ . 1]" 1
1735 1 67 VAL HA 1 116 PRO HB3 3.952 . 5.904 4.724 4.216 5.347 . 0 0 "[ . 1]" 1
1736 1 67 VAL HA 1 116 PRO QD 4.385 . 5.984 3.780 3.658 3.952 . 0 0 "[ . 1]" 1
1737 1 67 VAL HA 1 116 PRO QG 2.993 . 4.113 2.791 2.448 3.133 . 0 0 "[ . 1]" 1
1738 1 67 VAL HB 1 68 GLY H 2.967 . 4.067 2.994 2.710 4.173 0.106 5 0 "[ . 1]" 1
1739 1 67 VAL HB 1 68 GLY HA2 4.366 . 6.749 4.552 4.289 5.765 . 0 0 "[ . 1]" 1
1740 1 67 VAL HB 1 68 GLY HA3 4.570 . 7.181 4.676 4.400 6.044 . 0 0 "[ . 1]" 1
1741 1 67 VAL QG 1 68 GLY H 3.115 . 4.328 3.266 2.561 3.514 . 0 0 "[ . 1]" 1
1742 1 67 VAL QG 1 68 GLY HA2 3.917 . 5.721 3.535 3.328 3.773 . 0 0 "[ . 1]" 1
1743 1 67 VAL QG 1 68 GLY HA3 3.768 . 5.305 4.224 3.437 4.458 . 0 0 "[ . 1]" 1
1744 1 67 VAL QG 1 74 TYR QD 2.483 . 3.254 3.728 3.442 4.075 0.821 5 5 "[ *- +* *]" 1
1745 1 67 VAL QG 1 74 TYR QE 3.791 . 5.587 3.610 3.196 4.098 . 0 0 "[ . 1]" 1
1746 1 67 VAL QG 1 114 THR HB 3.669 . 5.352 4.729 4.053 5.750 0.398 5 0 "[ . 1]" 1
1747 1 67 VAL QG 1 116 PRO HB2 3.583 . 5.188 3.888 3.647 4.098 . 0 0 "[ . 1]" 1
1748 1 67 VAL QG 1 116 PRO HB3 3.211 . 4.500 2.732 2.381 3.121 . 0 0 "[ . 1]" 1
1749 1 67 VAL QG 1 116 PRO QD 4.127 . 6.227 3.514 3.047 3.925 . 0 0 "[ . 1]" 1
1750 1 67 VAL QG 1 117 GLY H 3.828 . 5.659 4.368 3.635 4.955 . 0 0 "[ . 1]" 1
1751 1 68 GLY H 1 68 GLY HA2 2.455 . 3.208 2.904 2.865 2.940 . 0 0 "[ . 1]" 1
1752 1 68 GLY H 1 68 GLY HA3 2.690 . 3.594 2.344 2.311 2.396 . 0 0 "[ . 1]" 1
1753 1 68 GLY H 1 69 ALA H 2.679 . 3.576 2.591 2.432 2.750 . 0 0 "[ . 1]" 1
1754 1 68 GLY HA2 1 69 ALA H 3.255 . 4.579 3.209 3.112 3.377 . 0 0 "[ . 1]" 1
1755 1 68 GLY HA2 1 70 ALA H 3.652 . 5.319 3.831 3.541 4.144 . 0 0 "[ . 1]" 1
1756 1 68 GLY HA3 1 69 ALA H 3.236 . 4.545 3.337 3.154 3.424 . 0 0 "[ . 1]" 1
1757 1 68 GLY HA3 1 70 ALA H 3.866 . 5.734 4.836 4.565 5.107 . 0 0 "[ . 1]" 1
1758 1 69 ALA H 1 69 ALA MB 2.433 . 3.173 2.479 2.379 2.571 . 0 0 "[ . 1]" 1
1759 1 69 ALA H 1 74 TYR HA 3.403 . 4.851 3.417 3.242 3.711 . 0 0 "[ . 1]" 1
1760 1 69 ALA HA 1 77 PRO QD 3.393 . 4.832 5.131 4.265 6.238 1.406 4 2 "[ +.- 1]" 1
1761 1 69 ALA MB 1 72 THR H 2.995 . 4.117 3.362 3.146 3.594 . 0 0 "[ . 1]" 1
1762 1 69 ALA MB 1 74 TYR H 3.004 . 4.132 3.500 3.120 3.729 . 0 0 "[ . 1]" 1
1763 1 69 ALA MB 1 74 TYR HA 2.902 . 3.955 2.609 2.448 2.913 . 0 0 "[ . 1]" 1
1764 1 69 ALA MB 1 74 TYR QD 3.230 . 4.534 4.074 3.799 4.257 . 0 0 "[ . 1]" 1
1765 1 69 ALA MB 1 75 VAL H 2.811 . 3.799 2.799 2.534 3.168 . 0 0 "[ . 1]" 1
1766 1 69 ALA MB 1 75 VAL HB 3.172 . 4.429 4.980 4.431 5.208 0.779 4 8 "[* -+*****1]" 1
1767 1 69 ALA MB 1 76 LYS H 3.707 . 5.425 3.718 3.361 4.256 . 0 0 "[ . 1]" 1
1768 1 69 ALA MB 1 76 LYS HA 2.796 . 3.773 2.873 2.427 3.547 . 0 0 "[ . 1]" 1
1769 1 69 ALA MB 1 76 LYS QB 3.322 . 4.701 3.427 2.429 4.394 . 0 0 "[ . 1]" 1
1770 1 69 ALA MB 1 77 PRO QD 2.869 . 3.898 3.203 2.626 3.882 . 0 0 "[ . 1]" 1
1771 1 70 ALA H 1 70 ALA HA 2.620 . 3.478 2.804 2.786 2.844 . 0 0 "[ . 1]" 1
1772 1 70 ALA H 1 70 ALA MB 2.200 . 2.805 2.227 2.218 2.244 . 0 0 "[ . 1]" 1
1773 1 70 ALA H 1 71 ASP H 2.689 . 3.593 2.662 2.529 2.738 . 0 0 "[ . 1]" 1
1774 1 70 ALA H 1 71 ASP QB 4.210 . 6.425 4.661 4.244 4.865 . 0 0 "[ . 1]" 1
1775 1 70 ALA H 1 74 TYR HA 4.220 . 6.446 4.322 4.202 4.434 . 0 0 "[ . 1]" 1
1776 1 70 ALA H 1 74 TYR QD 3.758 . 5.524 4.039 3.832 4.191 . 0 0 "[ . 1]" 1
1777 1 70 ALA H 1 74 TYR QE 3.910 . 5.821 4.118 3.798 4.357 . 0 0 "[ . 1]" 1
1778 1 70 ALA HA 1 70 ALA MB 2.306 . 2.971 2.128 2.126 2.132 . 0 0 "[ . 1]" 1
1779 1 70 ALA HA 1 71 ASP H 3.306 . 4.672 3.475 3.354 3.525 . 0 0 "[ . 1]" 1
1780 1 70 ALA HA 1 72 THR H 3.682 . 5.376 3.862 3.613 4.084 . 0 0 "[ . 1]" 1
1781 1 70 ALA HA 1 73 ASP H 3.799 . 5.603 4.601 4.361 5.096 . 0 0 "[ . 1]" 1
1782 1 70 ALA HA 1 74 TYR H 2.964 . 4.062 3.138 2.984 3.322 . 0 0 "[ . 1]" 1
1783 1 70 ALA HA 1 74 TYR HA 3.582 . 5.186 3.272 3.117 3.415 . 0 0 "[ . 1]" 1
1784 1 70 ALA HA 1 74 TYR HB2 4.492 . 7.014 4.904 4.773 5.081 . 0 0 "[ . 1]" 1
1785 1 70 ALA HA 1 74 TYR QD 3.566 . 5.155 2.957 2.737 3.120 . 0 0 "[ . 1]" 1
1786 1 70 ALA HA 1 74 TYR QE 3.032 . 4.181 2.953 2.824 3.140 . 0 0 "[ . 1]" 1
1787 1 70 ALA HA 1 88 LEU HG 4.403 . 6.827 6.354 5.380 8.142 1.315 7 1 "[ . + 1]" 1
1788 1 70 ALA MB 1 71 ASP H 2.624 . 3.485 2.763 2.630 3.037 . 0 0 "[ . 1]" 1
1789 1 70 ALA MB 1 71 ASP HA 4.000 . 6.000 3.836 3.805 3.946 . 0 0 "[ . 1]" 1
1790 1 70 ALA MB 1 74 TYR QD 4.032 . 6.064 3.568 3.397 3.784 . 0 0 "[ . 1]" 1
1791 1 70 ALA MB 1 74 TYR QE 2.393 . 3.109 2.377 2.256 2.477 . 0 0 "[ . 1]" 1
1792 1 71 ASP H 1 71 ASP HA 2.746 . 3.689 2.856 2.760 2.889 . 0 0 "[ . 1]" 1
1793 1 71 ASP H 1 71 ASP QB 2.512 . 3.300 2.397 2.232 2.547 . 0 0 "[ . 1]" 1
1794 1 71 ASP H 1 72 THR H 2.522 . 3.317 2.568 2.473 2.848 . 0 0 "[ . 1]" 1
1795 1 71 ASP HA 1 71 ASP QB 2.358 . 3.053 2.305 2.179 2.408 . 0 0 "[ . 1]" 1
1796 1 71 ASP HA 1 73 ASP HA 3.911 . 5.823 4.736 4.477 4.896 . 0 0 "[ . 1]" 1
1797 1 71 ASP QB 1 72 THR H 3.142 . 4.376 3.362 2.521 3.874 . 0 0 "[ . 1]" 1
1798 1 71 ASP QB 1 73 ASP H 4.221 . 6.448 5.221 4.796 6.111 . 0 0 "[ . 1]" 1
1799 1 72 THR H 1 72 THR HA 2.796 . 3.774 2.928 2.904 2.942 . 0 0 "[ . 1]" 1
1800 1 72 THR H 1 72 THR MG 2.788 . 3.759 2.868 2.208 3.890 0.131 9 0 "[ . 1]" 1
1801 1 72 THR H 1 73 ASP H 2.809 . 3.796 2.898 2.713 3.029 . 0 0 "[ . 1]" 1
1802 1 72 THR H 1 73 ASP HA 3.678 . 5.369 4.810 4.653 4.977 . 0 0 "[ . 1]" 1
1803 1 72 THR H 1 74 TYR H 2.752 . 3.699 3.056 2.853 3.365 . 0 0 "[ . 1]" 1
1804 1 72 THR HA 1 72 THR HB 2.479 . 3.247 2.573 2.367 3.020 . 0 0 "[ . 1]" 1
1805 1 72 THR HA 1 72 THR MG 2.358 . 3.053 2.649 2.253 3.220 0.167 3 0 "[ . 1]" 1
1806 1 72 THR HA 1 73 ASP H 2.600 . 3.445 2.820 2.558 3.550 0.105 2 0 "[ . 1]" 1
1807 1 72 THR HA 1 73 ASP HA 4.165 . 6.334 4.638 4.542 4.745 . 0 0 "[ . 1]" 1
1808 1 72 THR HA 1 74 TYR H 4.057 . 6.114 4.502 4.336 5.018 . 0 0 "[ . 1]" 1
1809 1 72 THR MG 1 73 ASP H 3.267 . 4.601 3.985 2.955 4.378 . 0 0 "[ . 1]" 1
1810 1 72 THR MG 1 77 PRO HA 3.991 . 5.982 4.882 3.058 6.385 0.403 4 0 "[ . 1]" 1
1811 1 72 THR MG 1 77 PRO HG2 3.008 . 4.139 3.952 2.931 4.854 0.715 3 3 "[ *+ . -]" 1
1812 1 72 THR MG 1 77 PRO HG3 3.023 . 4.165 3.302 2.689 4.290 0.125 4 0 "[ . 1]" 1
1813 1 73 ASP H 1 73 ASP HA 2.334 . 3.015 2.388 2.261 2.924 . 0 0 "[ . 1]" 1
1814 1 73 ASP H 1 73 ASP QB 2.962 . 4.058 3.276 2.758 3.388 . 0 0 "[ . 1]" 1
1815 1 73 ASP H 1 74 TYR H 2.882 . 3.920 2.557 1.817 2.737 0.027 2 0 "[ . 1]" 1
1816 1 73 ASP H 1 74 TYR HA 4.040 . 6.080 4.728 3.796 4.973 . 0 0 "[ . 1]" 1
1817 1 73 ASP H 1 74 TYR QD 4.390 . 6.799 5.161 4.869 5.391 . 0 0 "[ . 1]" 1
1818 1 73 ASP H 1 75 VAL H 4.053 . 6.107 4.052 2.562 4.532 . 0 0 "[ . 1]" 1
1819 1 73 ASP H 1 75 VAL QG 4.900 . 7.901 4.291 2.483 4.745 . 0 0 "[ . 1]" 1
1820 1 73 ASP H 1 88 LEU H 4.276 . 6.562 5.298 4.706 5.706 . 0 0 "[ . 1]" 1
1821 1 73 ASP H 1 88 LEU QB 3.723 . 5.456 4.667 3.970 6.020 0.564 10 1 "[ . +]" 1
1822 1 73 ASP H 1 88 LEU QD 3.447 . 4.932 4.214 3.205 5.598 0.666 2 1 "[ + . 1]" 1
1823 1 73 ASP HA 1 73 ASP QB 2.645 . 3.519 2.360 2.189 2.408 . 0 0 "[ . 1]" 1
1824 1 73 ASP HA 1 74 TYR H 3.092 . 4.287 2.965 2.813 3.046 . 0 0 "[ . 1]" 1
1825 1 73 ASP HA 1 74 TYR HA 3.824 . 5.652 4.055 3.994 4.095 . 0 0 "[ . 1]" 1
1826 1 73 ASP HA 1 74 TYR QD 3.451 . 4.940 3.849 3.476 4.140 . 0 0 "[ . 1]" 1
1827 1 73 ASP HA 1 88 LEU H 3.477 . 4.988 3.521 3.220 3.885 . 0 0 "[ . 1]" 1
1828 1 73 ASP HA 1 88 LEU QB 3.032 . 4.181 2.800 2.014 3.468 . 0 0 "[ . 1]" 1
1829 1 73 ASP HA 1 88 LEU QD 3.296 . 4.654 2.730 2.119 3.780 . 0 0 "[ . 1]" 1
1830 1 73 ASP HA 1 89 ILE H 4.733 . 7.533 6.840 6.492 7.240 . 0 0 "[ . 1]" 1
1831 1 73 ASP QB 1 74 TYR QD 3.451 . 4.940 4.748 4.480 4.872 . 0 0 "[ . 1]" 1
1832 1 73 ASP QB 1 75 VAL H 3.531 . 5.089 3.613 3.363 4.122 . 0 0 "[ . 1]" 1
1833 1 73 ASP QB 1 75 VAL HB 3.880 . 5.762 4.846 4.313 5.371 . 0 0 "[ . 1]" 1
1834 1 73 ASP QB 1 75 VAL QG 3.527 . 5.082 2.373 2.038 3.716 . 0 0 "[ . 1]" 1
1835 1 73 ASP QB 1 87 LYS HA 3.254 . 4.577 2.743 2.533 3.141 . 0 0 "[ . 1]" 1
1836 1 73 ASP QB 1 88 LEU H 2.783 . 3.751 2.427 1.989 2.994 . 0 0 "[ . 1]" 1
1837 1 73 ASP QB 1 88 LEU QB 3.452 . 4.871 3.135 2.223 4.011 . 0 0 "[ . 1]" 1
1838 1 74 TYR H 1 74 TYR HA 2.484 . 3.255 2.252 2.244 2.261 . 0 0 "[ . 1]" 1
1839 1 74 TYR H 1 74 TYR HB2 3.674 . 5.362 3.511 3.476 3.536 . 0 0 "[ . 1]" 1
1840 1 74 TYR H 1 74 TYR HB3 3.825 . 5.654 4.089 4.081 4.099 . 0 0 "[ . 1]" 1
1841 1 74 TYR H 1 74 TYR QD 3.362 . 4.775 3.648 3.613 3.675 . 0 0 "[ . 1]" 1
1842 1 74 TYR H 1 75 VAL H 2.647 . 3.523 2.648 2.587 2.704 . 0 0 "[ . 1]" 1
1843 1 74 TYR H 1 75 VAL HB 3.945 . 5.890 6.179 5.071 6.495 0.605 5 7 "[* -*+ ***1]" 1
1844 1 74 TYR H 1 75 VAL QG 3.994 . 5.988 3.860 3.544 4.434 . 0 0 "[ . 1]" 1
1845 1 74 TYR HA 1 74 TYR QD 2.631 . 3.496 2.435 2.252 2.574 . 0 0 "[ . 1]" 1
1846 1 74 TYR HA 1 74 TYR QE 3.561 . 5.147 4.422 4.358 4.486 . 0 0 "[ . 1]" 1
1847 1 74 TYR HA 1 75 VAL H 2.897 . 3.946 2.871 2.652 2.979 . 0 0 "[ . 1]" 1
1848 1 74 TYR HA 1 75 VAL QG 4.442 . 6.908 4.132 3.928 4.414 . 0 0 "[ . 1]" 1
1849 1 74 TYR HA 1 88 LEU HG 4.317 . 6.646 6.193 5.798 8.565 1.919 7 1 "[ . + 1]" 1
1850 1 74 TYR HA 1 116 PRO QD 4.421 . 6.864 5.089 4.799 5.413 . 0 0 "[ . 1]" 1
1851 1 74 TYR HB2 1 74 TYR QD 2.630 . 3.495 2.280 2.266 2.288 . 0 0 "[ . 1]" 1
1852 1 74 TYR HB2 1 74 TYR QE 3.427 . 4.895 4.378 4.371 4.387 . 0 0 "[ . 1]" 1
1853 1 74 TYR HB2 1 75 VAL QG 4.276 . 6.561 3.724 3.534 4.243 . 0 0 "[ . 1]" 1
1854 1 74 TYR HB2 1 88 LEU QD 4.139 . 6.080 3.112 2.835 3.412 . 0 0 "[ . 1]" 1
1855 1 74 TYR HB2 1 114 THR HB 4.173 . 6.349 4.097 3.257 4.492 . 0 0 "[ . 1]" 1
1856 1 74 TYR HB2 1 114 THR HG1 3.372 . 4.794 2.799 2.429 3.136 . 0 0 "[ . 1]" 1
1857 1 74 TYR HB2 1 114 THR MG 4.998 . 8.120 4.867 4.448 5.149 . 0 0 "[ . 1]" 1
1858 1 74 TYR HB2 1 116 PRO QD 4.121 . 6.243 3.547 3.359 3.713 . 0 0 "[ . 1]" 1
1859 1 74 TYR HB3 1 74 TYR QD 2.602 . 3.448 2.583 2.531 2.655 . 0 0 "[ . 1]" 1
1860 1 74 TYR HB3 1 74 TYR QE 3.467 . 4.969 4.462 4.445 4.480 . 0 0 "[ . 1]" 1
1861 1 74 TYR HB3 1 75 VAL QG 4.353 . 6.722 4.214 4.027 4.826 . 0 0 "[ . 1]" 1
1862 1 74 TYR HB3 1 88 LEU QD 3.787 . 5.579 4.336 4.071 4.544 . 0 0 "[ . 1]" 1
1863 1 74 TYR HB3 1 114 THR HB 3.982 . 5.964 3.195 2.705 3.566 . 0 0 "[ . 1]" 1
1864 1 74 TYR HB3 1 114 THR HG1 3.273 . 4.612 2.747 2.362 3.049 . 0 0 "[ . 1]" 1
1865 1 74 TYR HB3 1 115 PHE HA 4.053 . 6.106 3.676 3.322 3.974 . 0 0 "[ . 1]" 1
1866 1 74 TYR QD 1 88 LEU QD 2.532 . 3.301 2.035 1.803 2.659 . 0 0 "[ . 1]" 1
1867 1 74 TYR QD 1 88 LEU HG 3.000 . 4.125 3.151 1.864 4.572 0.447 7 0 "[ . 1]" 1
1868 1 74 TYR QD 1 115 PHE H 4.910 . 7.923 4.972 4.715 5.303 . 0 0 "[ . 1]" 1
1869 1 74 TYR QD 1 115 PHE HA 3.078 . 4.263 3.230 2.952 3.607 . 0 0 "[ . 1]" 1
1870 1 74 TYR QD 1 115 PHE HB2 3.266 . 4.599 4.079 3.802 4.397 . 0 0 "[ . 1]" 1
1871 1 74 TYR QD 1 115 PHE QD 2.996 . 4.118 2.871 2.661 3.248 . 0 0 "[ . 1]" 1
1872 1 74 TYR QD 1 116 PRO QD 2.997 . 4.120 3.064 2.918 3.253 . 0 0 "[ . 1]" 1
1873 1 74 TYR QE 1 88 LEU QD 3.375 . 4.428 2.579 2.011 3.099 . 0 0 "[ . 1]" 1
1874 1 74 TYR QE 1 115 PHE HA 3.589 . 5.199 3.967 3.711 4.451 . 0 0 "[ . 1]" 1
1875 1 74 TYR QE 1 115 PHE QD 2.880 . 3.916 2.775 2.428 3.117 . 0 0 "[ . 1]" 1
1876 1 74 TYR QE 1 116 PRO QD 3.412 . 4.868 2.979 2.872 3.210 . 0 0 "[ . 1]" 1
1877 1 74 TYR QE 1 116 PRO QG 2.964 . 4.062 2.821 2.656 3.243 . 0 0 "[ . 1]" 1
1878 1 75 VAL H 1 75 VAL HA 2.875 . 3.908 2.927 2.883 2.945 . 0 0 "[ . 1]" 1
1879 1 75 VAL H 1 75 VAL HB 2.583 . 3.417 3.700 2.682 3.897 0.480 4 0 "[ . 1]" 1
1880 1 75 VAL H 1 75 VAL QG 2.808 . 3.793 2.320 2.155 2.816 . 0 0 "[ . 1]" 1
1881 1 75 VAL H 1 76 LYS H 3.935 . 5.871 4.300 4.189 4.424 . 0 0 "[ . 1]" 1
1882 1 75 VAL HA 1 75 VAL QG 2.656 . 3.538 2.291 2.137 2.376 . 0 0 "[ . 1]" 1
1883 1 75 VAL HA 1 76 LYS H 2.596 . 3.438 2.212 2.119 2.303 . 0 0 "[ . 1]" 1
1884 1 75 VAL HB 1 76 LYS H 4.087 . 6.175 3.249 2.669 4.189 . 0 0 "[ . 1]" 1
1885 1 75 VAL HB 1 76 LYS H 3.277 . 4.620 3.128 2.620 3.895 . 0 0 "[ . 1]" 1
1886 1 75 VAL HB 1 79 ASP H 3.255 . 4.580 5.048 4.083 6.100 1.520 9 5 "[ ***- +1]" 1
1887 1 75 VAL HB 1 77 PRO HA 4.035 . 6.070 5.410 4.659 6.717 0.647 6 1 "[ .+ 1]" 1
1888 1 75 VAL MG1 1 75 VAL MG2 2.572 . 3.399 2.087 2.079 2.095 . 0 0 "[ . 1]" 1
1889 1 75 VAL QG 1 76 LYS H 2.962 . 4.059 3.238 2.451 3.533 . 0 0 "[ . 1]" 1
1890 1 75 VAL QG 1 77 PRO HA 3.924 . 5.849 4.053 3.552 4.669 . 0 0 "[ . 1]" 1
1891 1 75 VAL QG 1 79 ASP H 3.418 . 4.879 5.498 3.867 6.677 1.798 9 7 "[* **- **+1]" 1
1892 1 75 VAL QG 1 82 VAL HB 3.398 . 4.841 4.664 2.921 5.998 1.157 1 2 "[+ -. 1]" 1
1893 1 75 VAL QG 1 82 VAL MG2 3.199 . 4.478 3.275 1.949 4.662 0.184 1 0 "[ . 1]" 1
1894 1 75 VAL QG 1 85 HIS QB 3.602 . 4.990 2.279 1.997 2.732 . 0 0 "[ . 1]" 1
1895 1 75 VAL QG 1 85 HIS QB 3.768 . 5.543 2.278 1.996 2.726 . 0 0 "[ . 1]" 1
1896 1 75 VAL QG 1 114 THR H 4.209 . 6.423 4.661 4.340 5.056 . 0 0 "[ . 1]" 1
1897 1 75 VAL QG 1 114 THR HG1 3.339 . 4.733 2.697 2.393 3.345 . 0 0 "[ . 1]" 1
1898 1 75 VAL QG 1 114 THR MG 3.360 . 4.771 2.986 2.527 3.507 . 0 0 "[ . 1]" 1
1899 1 76 LYS H 1 76 LYS QB 2.981 . 4.022 2.328 2.176 2.556 . 0 0 "[ . 1]" 1
1900 1 76 LYS H 1 79 ASP H 4.736 . 7.540 5.675 4.745 7.982 0.442 9 0 "[ . 1]" 1
1901 1 76 LYS H 1 82 VAL MG2 4.176 . 6.356 3.791 3.044 4.187 . 0 0 "[ . 1]" 1
1902 1 76 LYS HA 1 77 PRO QD 2.955 . 4.046 1.932 1.820 2.027 0.044 5 0 "[ . 1]" 1
1903 1 76 LYS QB 1 76 LYS QD 2.456 . 3.210 2.238 2.062 2.765 . 0 0 "[ . 1]" 1
1904 1 76 LYS QB 1 77 PRO QD 3.538 . 5.103 3.446 2.462 3.725 . 0 0 "[ . 1]" 1
1905 1 76 LYS QB 1 79 ASP H 3.340 . 4.734 4.382 3.316 6.071 1.337 9 1 "[ . +1]" 1
1906 1 76 LYS QD 1 76 LYS QE 3.126 . 4.347 2.064 2.001 2.094 . 0 0 "[ . 1]" 1
1907 1 76 LYS QD 1 77 PRO QD 3.000 . 4.125 3.833 2.072 4.813 0.688 6 1 "[ .+ 1]" 1
1908 1 76 LYS QD 1 78 ASP H 3.485 . 5.003 4.507 3.652 5.889 0.886 7 1 "[ . + 1]" 1
1909 1 76 LYS QE 1 77 PRO QD 4.469 . 6.966 4.241 3.300 5.385 . 0 0 "[ . 1]" 1
1910 1 77 PRO HA 1 77 PRO HB2 2.565 . 3.387 2.863 2.703 2.980 . 0 0 "[ . 1]" 1
1911 1 77 PRO HA 1 77 PRO HB3 2.786 . 3.756 2.289 2.276 2.308 . 0 0 "[ . 1]" 1
1912 1 77 PRO HA 1 77 PRO QD 3.591 . 4.740 3.404 3.362 3.456 . 0 0 "[ . 1]" 1
1913 1 77 PRO HA 1 77 PRO HG3 2.873 . 3.905 3.445 2.983 4.031 0.126 10 0 "[ . 1]" 1
1914 1 77 PRO HA 1 78 ASP H 2.465 . 3.224 2.921 2.167 3.492 0.268 6 0 "[ . 1]" 1
1915 1 77 PRO HA 1 78 ASP H 2.120 . 2.682 2.528 2.098 2.787 0.105 6 0 "[ . 1]" 1
1916 1 77 PRO HA 1 79 ASP H 3.483 . 4.999 4.009 3.389 5.222 0.223 9 0 "[ . 1]" 1
1917 1 77 PRO HA 1 79 ASP H 2.377 . 3.083 2.427 2.225 2.853 . 0 0 "[ . 1]" 1
1918 1 77 PRO HB2 1 77 PRO QD 3.447 . 4.718 3.138 2.845 3.547 . 0 0 "[ . 1]" 1
1919 1 77 PRO HB2 1 77 PRO HG3 2.362 . 3.059 2.863 2.658 3.002 . 0 0 "[ . 1]" 1
1920 1 77 PRO HB2 1 78 ASP H 3.202 . 4.483 3.888 3.005 4.282 . 0 0 "[ . 1]" 1
1921 1 77 PRO HB3 1 77 PRO QD 3.134 . 4.155 3.280 2.875 3.542 . 0 0 "[ . 1]" 1
1922 1 77 PRO HB3 1 77 PRO HG3 2.470 . 3.233 2.321 2.308 2.334 . 0 0 "[ . 1]" 1
1923 1 77 PRO HB3 1 78 ASP H 3.281 . 4.626 4.395 3.996 4.652 0.026 10 0 "[ . 1]" 1
1924 1 77 PRO QD 1 77 PRO HG3 2.955 . 4.047 2.223 2.188 2.253 . 0 0 "[ . 1]" 1
1925 1 77 PRO QD 1 78 ASP H 4.436 . 6.896 3.585 2.531 4.769 . 0 0 "[ . 1]" 1
1926 1 78 ASP H 1 78 ASP HA 2.304 . 2.968 2.464 2.156 2.774 . 0 0 "[ . 1]" 1
1927 1 78 ASP H 1 79 ASP H 2.675 . 3.569 2.583 1.978 4.318 0.749 9 1 "[ . +1]" 1
1928 1 78 ASP HA 1 78 ASP QB 2.439 . 3.182 2.373 2.290 2.436 . 0 0 "[ . 1]" 1
1929 1 79 ASP H 1 79 ASP HA 2.677 . 3.573 2.462 2.256 2.936 . 0 0 "[ . 1]" 1
1930 1 79 ASP H 1 80 ALA H 3.666 . 5.346 3.314 2.751 4.537 . 0 0 "[ . 1]" 1
1931 1 79 ASP H 1 82 VAL HB 3.587 . 5.195 4.078 3.135 5.622 0.427 9 0 "[ . 1]" 1
1932 1 79 ASP H 1 82 VAL MG2 3.545 . 5.116 4.201 2.969 6.047 0.931 9 1 "[ . +1]" 1
1933 1 79 ASP HA 1 80 ALA H 2.297 . 2.956 2.753 2.219 3.541 0.585 5 1 "[ + 1]" 1
1934 1 79 ASP HA 1 82 VAL H 3.682 . 5.377 3.528 2.781 5.095 . 0 0 "[ . 1]" 1
1935 1 79 ASP QB 1 80 ALA H 3.487 . 5.007 3.663 2.841 3.904 . 0 0 "[ . 1]" 1
1936 1 79 ASP QB 1 82 VAL H 3.284 . 4.632 4.346 3.005 4.992 0.360 1 0 "[ . 1]" 1
1937 1 79 ASP QB 1 82 VAL HB 3.359 . 4.769 3.962 3.110 4.623 . 0 0 "[ . 1]" 1
1938 1 80 ALA H 1 80 ALA HA 2.827 . 3.826 2.918 2.862 2.948 . 0 0 "[ . 1]" 1
1939 1 80 ALA H 1 80 ALA MB 2.350 . 3.040 2.339 2.265 2.403 . 0 0 "[ . 1]" 1
1940 1 80 ALA H 1 81 ARG QB 4.022 . 6.044 3.748 3.437 4.066 . 0 0 "[ . 1]" 1
1941 1 80 ALA H 1 82 VAL H 3.930 . 5.860 3.328 2.699 4.152 . 0 0 "[ . 1]" 1
1942 1 80 ALA H 1 82 VAL MG2 4.796 . 7.671 4.469 3.965 5.135 . 0 0 "[ . 1]" 1
1943 1 80 ALA HA 1 80 ALA MB 2.192 . 2.792 2.128 2.125 2.132 . 0 0 "[ . 1]" 1
1944 1 80 ALA HA 1 81 ARG H 3.007 . 4.137 3.503 3.361 3.578 . 0 0 "[ . 1]" 1
1945 1 80 ALA HA 1 82 VAL H 3.555 . 5.134 4.064 3.581 4.484 . 0 0 "[ . 1]" 1
1946 1 80 ALA MB 1 81 ARG H 3.007 . 4.137 2.610 2.135 3.204 . 0 0 "[ . 1]" 1
1947 1 80 ALA MB 1 82 VAL H 3.655 . 5.325 4.209 3.923 4.550 . 0 0 "[ . 1]" 1
1948 1 81 ARG H 1 81 ARG QB 2.674 . 3.568 2.447 2.259 2.679 . 0 0 "[ . 1]" 1
1949 1 81 ARG H 1 81 ARG HD2 3.426 . 4.893 4.312 3.934 4.809 . 0 0 "[ . 1]" 1
1950 1 81 ARG H 1 81 ARG HD3 3.846 . 5.695 4.742 4.134 4.998 . 0 0 "[ . 1]" 1
1951 1 81 ARG H 1 81 ARG QG 2.649 . 3.526 2.420 2.061 2.753 . 0 0 "[ . 1]" 1
1952 1 81 ARG H 1 82 VAL H 2.535 . 3.338 2.301 2.031 2.546 . 0 0 "[ . 1]" 1
1953 1 81 ARG H 1 82 VAL HB 3.545 . 5.115 4.554 4.279 4.820 . 0 0 "[ . 1]" 1
1954 1 81 ARG H 1 82 VAL MG1 4.023 . 6.046 5.615 5.401 5.785 . 0 0 "[ . 1]" 1
1955 1 81 ARG HA 1 81 ARG QG 3.562 . 5.148 2.630 2.270 3.350 . 0 0 "[ . 1]" 1
1956 1 81 ARG HA 1 82 VAL H 3.490 . 5.013 3.393 3.234 3.463 . 0 0 "[ . 1]" 1
1957 1 81 ARG QB 1 81 ARG HD3 2.889 . 3.932 2.104 2.064 2.146 . 0 0 "[ . 1]" 1
1958 1 81 ARG QB 1 82 VAL HA 3.344 . 4.742 3.861 3.738 4.117 . 0 0 "[ . 1]" 1
1959 1 81 ARG HD3 1 81 ARG QG 3.542 . 5.110 2.362 2.174 2.442 . 0 0 "[ . 1]" 1
1960 1 82 VAL H 1 82 VAL HA 2.757 . 3.707 2.917 2.895 2.939 . 0 0 "[ . 1]" 1
1961 1 82 VAL H 1 82 VAL HB 2.400 . 3.120 2.577 2.506 2.783 . 0 0 "[ . 1]" 1
1962 1 82 VAL H 1 82 VAL MG1 2.863 . 3.887 3.815 3.779 3.912 0.025 5 0 "[ . 1]" 1
1963 1 82 VAL H 1 82 VAL MG2 2.487 . 3.260 2.422 2.209 2.748 . 0 0 "[ . 1]" 1
1964 1 82 VAL H 1 83 VAL H 3.413 . 4.869 4.321 3.603 4.484 . 0 0 "[ . 1]" 1
1965 1 82 VAL HA 1 82 VAL MG1 2.726 . 3.655 2.379 2.332 2.408 . 0 0 "[ . 1]" 1
1966 1 82 VAL HA 1 82 VAL MG2 2.603 . 3.450 2.431 2.398 2.470 . 0 0 "[ . 1]" 1
1967 1 82 VAL HA 1 83 VAL H 2.399 . 3.118 2.167 2.113 2.309 . 0 0 "[ . 1]" 1
1968 1 82 VAL HA 1 83 VAL HA 3.224 . 4.524 4.395 4.369 4.541 0.017 5 0 "[ . 1]" 1
1969 1 82 VAL HA 1 84 ALA H 3.154 . 4.397 3.827 3.455 4.033 . 0 0 "[ . 1]" 1
1970 1 82 VAL HB 1 83 VAL H 3.877 . 5.756 4.203 3.989 4.451 . 0 0 "[ . 1]" 1
1971 1 82 VAL HB 1 84 ALA H 3.980 . 5.960 4.795 4.568 5.068 . 0 0 "[ . 1]" 1
1972 1 82 VAL MG1 1 82 VAL MG2 2.268 . 2.911 2.086 2.080 2.090 . 0 0 "[ . 1]" 1
1973 1 82 VAL MG1 1 83 VAL H 3.192 . 4.466 2.830 2.428 3.607 . 0 0 "[ . 1]" 1
1974 1 82 VAL MG1 1 84 ALA H 2.472 . 3.236 2.513 2.333 3.015 . 0 0 "[ . 1]" 1
1975 1 82 VAL MG1 1 85 HIS H 3.436 . 4.912 3.942 3.662 4.093 . 0 0 "[ . 1]" 1
1976 1 82 VAL MG1 1 85 HIS QB 2.794 . 3.770 2.270 1.936 2.497 . 0 0 "[ . 1]" 1
1977 1 82 VAL MG1 1 85 HIS HD2 2.977 . 4.085 2.618 2.110 4.188 0.103 5 0 "[ . 1]" 1
1978 1 83 VAL H 1 83 VAL HA 2.957 . 4.050 2.890 2.820 2.929 . 0 0 "[ . 1]" 1
1979 1 83 VAL H 1 83 VAL HB 2.659 . 3.543 2.509 2.446 2.730 . 0 0 "[ . 1]" 1
1980 1 83 VAL H 1 83 VAL QG 2.606 . 3.455 2.274 2.098 2.495 . 0 0 "[ . 1]" 1
1981 1 83 VAL H 1 84 ALA H 2.552 . 3.366 2.348 2.167 2.585 . 0 0 "[ . 1]" 1
1982 1 83 VAL H 1 104 LEU QD 4.577 . 7.196 5.124 4.556 5.440 . 0 0 "[ . 1]" 1
1983 1 83 VAL H 1 109 TYR QE 4.674 . 7.405 4.629 4.339 5.144 . 0 0 "[ . 1]" 1
1984 1 83 VAL HA 1 83 VAL HB 2.916 . 3.979 2.973 2.496 3.029 . 0 0 "[ . 1]" 1
1985 1 83 VAL HA 1 83 VAL QG 2.515 . 3.163 2.146 2.121 2.273 . 0 0 "[ . 1]" 1
1986 1 83 VAL HA 1 84 ALA H 3.178 . 4.441 3.514 3.456 3.532 . 0 0 "[ . 1]" 1
1987 1 83 VAL HA 1 100 ASP H 3.967 . 5.934 6.268 5.484 7.298 1.364 2 3 "[ + . *-]" 1
1988 1 83 VAL HB 1 84 ALA H 2.429 . 3.166 2.749 2.524 4.047 0.881 9 1 "[ . +1]" 1
1989 1 83 VAL HB 1 100 ASP H 4.071 . 6.142 6.164 5.683 6.796 0.654 9 1 "[ . +1]" 1
1990 1 83 VAL HB 1 104 LEU QD 3.778 . 5.562 3.410 2.729 3.973 . 0 0 "[ . 1]" 1
1991 1 83 VAL HB 1 109 TYR QD 3.433 . 4.906 4.197 3.816 5.053 0.147 9 0 "[ . 1]" 1
1992 1 83 VAL HB 1 109 TYR QE 3.465 . 4.966 4.068 3.626 4.629 . 0 0 "[ . 1]" 1
1993 1 83 VAL MG1 1 83 VAL MG2 2.227 . 2.847 2.081 2.075 2.085 . 0 0 "[ . 1]" 1
1994 1 83 VAL QG 1 84 ALA H 2.683 . 3.583 3.115 2.414 3.238 . 0 0 "[ . 1]" 1
1995 1 83 VAL QG 1 84 ALA MB 2.822 . 3.817 2.675 2.464 2.786 . 0 0 "[ . 1]" 1
1996 1 83 VAL QG 1 99 LEU QB 3.566 . 5.095 2.286 1.885 2.693 0.091 1 0 "[ . 1]" 1
1997 1 83 VAL QG 1 99 LEU QD 3.224 . 3.915 2.770 2.442 3.370 . 0 0 "[ . 1]" 1
1998 1 83 VAL QG 1 100 ASP H 3.810 . 5.625 3.309 2.912 3.811 . 0 0 "[ . 1]" 1
1999 1 83 VAL QG 1 103 LYS H 4.059 . 6.118 4.502 4.083 5.108 . 0 0 "[ . 1]" 1
2000 1 83 VAL QG 1 104 LEU HA 3.860 . 5.722 3.611 3.185 3.839 . 0 0 "[ . 1]" 1
2001 1 83 VAL QG 1 104 LEU QD 2.654 . 3.534 2.131 1.917 2.679 . 0 0 "[ . 1]" 1
2002 1 83 VAL QG 1 109 TYR QD 2.620 . 3.478 2.916 2.632 3.312 . 0 0 "[ . 1]" 1
2003 1 83 VAL QG 1 109 TYR QE 2.229 . 2.850 2.030 1.807 2.946 0.096 9 0 "[ . 1]" 1
2004 1 84 ALA H 1 84 ALA HA 2.814 . 3.804 2.877 2.844 2.908 . 0 0 "[ . 1]" 1
2005 1 84 ALA H 1 84 ALA MB 2.743 . 3.683 2.750 2.675 2.829 . 0 0 "[ . 1]" 1
2006 1 84 ALA H 1 85 HIS H 3.666 . 5.346 4.314 4.257 4.351 . 0 0 "[ . 1]" 1
2007 1 84 ALA H 1 85 HIS QB 4.020 . 6.040 4.391 4.117 4.517 . 0 0 "[ . 1]" 1
2008 1 84 ALA H 1 85 HIS HD2 3.637 . 5.290 4.678 4.060 6.347 1.057 5 1 "[ + 1]" 1
2009 1 84 ALA H 1 104 LEU QD 4.349 . 6.713 5.248 4.638 5.529 . 0 0 "[ . 1]" 1
2010 1 84 ALA HA 1 84 ALA MB 2.304 . 2.968 2.130 2.126 2.135 . 0 0 "[ . 1]" 1
2011 1 84 ALA HA 1 85 HIS H 2.468 . 3.230 2.307 2.250 2.361 . 0 0 "[ . 1]" 1
2012 1 84 ALA MB 1 85 HIS H 2.606 . 3.455 2.634 2.546 2.742 . 0 0 "[ . 1]" 1
2013 1 84 ALA MB 1 97 LEU MD1 2.427 . 3.163 1.939 1.858 1.996 . 0 0 "[ . 1]" 1
2014 1 84 ALA MB 1 98 THR H 2.706 . 3.621 3.592 3.091 4.632 1.011 10 1 "[ . +]" 1
2015 1 84 ALA MB 1 98 THR HA 3.274 . 4.614 3.929 3.792 4.175 . 0 0 "[ . 1]" 1
2016 1 84 ALA MB 1 99 LEU H 2.634 . 3.502 2.969 2.827 3.121 . 0 0 "[ . 1]" 1
2017 1 84 ALA MB 1 100 ASP H 2.748 . 3.692 2.516 2.439 2.620 . 0 0 "[ . 1]" 1
2018 1 84 ALA MB 1 99 LEU QD 3.151 . 4.392 1.838 1.780 1.872 0.130 8 0 "[ . 1]" 1
2019 1 85 HIS H 1 85 HIS QB 4.214 . 4.907 3.210 2.773 3.319 . 0 0 "[ . 1]" 1
2020 1 85 HIS H 1 85 HIS HD2 3.443 . 4.925 3.382 2.768 5.449 0.524 5 1 "[ + 1]" 1
2021 1 85 HIS H 1 86 THR H 3.718 . 5.446 4.237 4.155 4.311 . 0 0 "[ . 1]" 1
2022 1 85 HIS H 1 97 LEU H 4.138 . 6.278 6.634 6.435 6.893 0.615 3 3 "[ + .* -]" 1
2023 1 85 HIS H 1 97 LEU QD 3.115 . 4.328 2.911 2.589 3.044 . 0 0 "[ . 1]" 1
2024 1 85 HIS H 1 97 LEU MD2 3.917 . 5.835 2.970 2.618 3.119 . 0 0 "[ . 1]" 1
2025 1 85 HIS HA 1 85 HIS QB 2.752 . 3.699 2.204 2.183 2.356 . 0 0 "[ . 1]" 1
2026 1 85 HIS HA 1 86 THR H 2.514 . 3.304 2.198 2.146 2.265 . 0 0 "[ . 1]" 1
2027 1 85 HIS HA 1 86 THR MG 3.492 . 5.016 3.788 3.706 3.979 . 0 0 "[ . 1]" 1
2028 1 85 HIS HA 1 97 LEU HB3 4.137 . 6.276 4.214 3.993 4.797 . 0 0 "[ . 1]" 1
2029 1 85 HIS HA 1 97 LEU MD2 2.814 . 3.804 2.508 2.321 2.724 . 0 0 "[ . 1]" 1
2030 1 85 HIS HA 1 97 LEU HG 4.398 . 6.816 5.274 5.085 5.561 . 0 0 "[ . 1]" 1
2031 1 85 HIS QB 1 86 THR H 2.820 . 3.814 2.982 2.757 3.717 . 0 0 "[ . 1]" 1
2032 1 85 HIS QB 1 97 LEU MD2 3.922 . 5.844 3.935 3.790 4.055 . 0 0 "[ . 1]" 1
2033 1 85 HIS QB 1 114 THR MG 4.282 . 6.236 4.830 4.630 5.397 . 0 0 "[ . 1]" 1
2034 1 86 THR H 1 86 THR HB 3.129 . 4.353 3.642 3.603 3.678 . 0 0 "[ . 1]" 1
2035 1 86 THR H 1 86 THR MG 2.612 . 3.465 2.489 2.412 2.623 . 0 0 "[ . 1]" 1
2036 1 86 THR H 1 97 LEU MD2 2.818 . 3.811 2.629 2.388 2.775 . 0 0 "[ . 1]" 1
2037 1 86 THR H 1 97 LEU HG 4.224 . 6.454 5.058 4.796 5.223 . 0 0 "[ . 1]" 1
2038 1 86 THR HA 1 86 THR HB 2.637 . 3.507 2.483 2.443 2.527 . 0 0 "[ . 1]" 1
2039 1 86 THR HA 1 86 THR MG 2.698 . 3.608 2.337 2.270 2.394 . 0 0 "[ . 1]" 1
2040 1 86 THR HA 1 87 LYS H 2.680 . 3.578 2.475 2.250 2.600 . 0 0 "[ . 1]" 1
2041 1 86 THR HA 1 95 SER QB 3.568 . 5.159 3.758 3.180 4.015 . 0 0 "[ . 1]" 1
2042 1 86 THR HA 1 96 SER H 3.887 . 5.776 4.530 4.168 5.113 . 0 0 "[ . 1]" 1
2043 1 86 THR HA 1 97 LEU H 4.639 . 7.329 5.351 5.116 5.514 . 0 0 "[ . 1]" 1
2044 1 86 THR HA 1 97 LEU HB2 3.202 . 4.484 4.880 4.677 5.029 0.545 1 1 "[+ . 1]" 1
2045 1 86 THR HA 1 97 LEU HB3 3.162 . 4.412 3.245 3.048 3.380 . 0 0 "[ . 1]" 1
2046 1 86 THR HA 1 97 LEU MD2 3.441 . 4.921 3.513 3.179 3.695 . 0 0 "[ . 1]" 1
2047 1 86 THR HB 1 87 LYS H 2.959 . 4.054 2.338 2.078 2.875 . 0 0 "[ . 1]" 1
2048 1 86 THR HB 1 97 LEU MD2 3.632 . 5.281 4.364 4.192 4.444 . 0 0 "[ . 1]" 1
2049 1 86 THR MG 1 87 LYS H 3.552 . 5.129 3.664 3.525 3.766 . 0 0 "[ . 1]" 1
2050 1 86 THR MG 1 89 ILE MD 3.544 . 5.114 4.368 4.228 4.546 . 0 0 "[ . 1]" 1
2051 1 86 THR MG 1 95 SER H 3.797 . 5.599 4.332 4.129 4.537 . 0 0 "[ . 1]" 1
2052 1 86 THR MG 1 95 SER QB 4.071 . 5.116 3.051 2.961 3.162 . 0 0 "[ . 1]" 1
2053 1 86 THR MG 1 96 SER H 3.852 . 5.707 3.588 3.365 3.873 . 0 0 "[ . 1]" 1
2054 1 86 THR MG 1 96 SER HA 3.201 . 4.482 2.788 2.664 2.966 . 0 0 "[ . 1]" 1
2055 1 86 THR MG 1 97 LEU H 3.053 . 4.218 3.271 3.142 3.456 . 0 0 "[ . 1]" 1
2056 1 86 THR MG 1 97 LEU MD2 2.550 . 3.363 1.879 1.865 1.901 . 0 0 "[ . 1]" 1
2057 1 86 THR MG 1 97 LEU HG 3.081 . 4.268 2.810 2.606 2.953 . 0 0 "[ . 1]" 1
2058 1 87 LYS H 1 87 LYS QB 3.379 . 4.806 2.467 2.269 2.792 . 0 0 "[ . 1]" 1
2059 1 87 LYS H 1 88 LEU H 4.105 . 6.212 4.575 4.518 4.634 . 0 0 "[ . 1]" 1
2060 1 87 LYS H 1 89 ILE MG 4.072 . 6.145 3.936 3.665 4.295 . 0 0 "[ . 1]" 1
2061 1 87 LYS H 1 95 SER QB 3.459 . 4.711 2.634 2.439 2.863 . 0 0 "[ . 1]" 1
2062 1 87 LYS HA 1 87 LYS QB 2.970 . 4.073 2.354 2.181 2.410 . 0 0 "[ . 1]" 1
2063 1 87 LYS HA 1 87 LYS QD 3.090 . 4.284 3.945 2.117 4.521 0.237 6 0 "[ . 1]" 1
2064 1 87 LYS HA 1 87 LYS QG 2.945 . 4.029 2.595 2.387 3.346 . 0 0 "[ . 1]" 1
2065 1 87 LYS HA 1 88 LEU H 2.503 . 3.286 2.371 2.266 2.535 . 0 0 "[ . 1]" 1
2066 1 87 LYS HA 1 88 LEU QB 4.664 . 6.607 4.333 4.033 4.653 . 0 0 "[ . 1]" 1
2067 1 87 LYS QB 1 95 SER QB 3.791 . 5.587 3.118 2.608 4.104 . 0 0 "[ . 1]" 1
2068 1 87 LYS QE 1 89 ILE MG 4.210 . 6.425 4.648 2.361 6.567 0.142 10 0 "[ . 1]" 1
2069 1 87 LYS QG 1 95 SER QB 3.716 . 5.339 3.896 2.218 4.443 . 0 0 "[ . 1]" 1
2070 1 88 LEU H 1 88 LEU QB 2.704 . 3.618 2.264 2.202 2.349 . 0 0 "[ . 1]" 1
2071 1 88 LEU H 1 88 LEU QD 3.331 . 4.718 3.447 3.253 3.706 . 0 0 "[ . 1]" 1
2072 1 88 LEU H 1 88 LEU HG 3.511 . 5.052 3.465 2.639 4.581 . 0 0 "[ . 1]" 1
2073 1 88 LEU H 1 89 ILE H 4.023 . 6.047 4.419 4.269 4.548 . 0 0 "[ . 1]" 1
2074 1 88 LEU H 1 89 ILE MG 4.223 . 6.452 4.427 4.211 4.588 . 0 0 "[ . 1]" 1
2075 1 88 LEU QB 1 88 LEU QD 3.181 . 4.090 1.980 1.932 2.069 0.019 7 0 "[ . 1]" 1
2076 1 88 LEU QB 1 89 ILE H 4.393 . 5.685 3.544 3.135 3.934 . 0 0 "[ . 1]" 1
2077 1 88 LEU MD1 1 88 LEU MD2 2.921 . 3.988 2.088 2.084 2.094 . 0 0 "[ . 1]" 1
2078 1 88 LEU QD 1 88 LEU HG 2.749 . 3.694 1.896 1.890 1.900 . 0 0 "[ . 1]" 1
2079 1 88 LEU QD 1 89 ILE H 3.059 . 4.229 3.011 2.477 3.362 . 0 0 "[ . 1]" 1
2080 1 88 LEU QD 1 115 PHE H 3.665 . 5.344 4.145 3.857 4.443 . 0 0 "[ . 1]" 1
2081 1 88 LEU QD 1 115 PHE HA 4.225 . 5.613 3.684 3.548 3.935 . 0 0 "[ . 1]" 1
2082 1 88 LEU QD 1 115 PHE HB2 3.438 . 4.916 2.922 2.513 3.120 . 0 0 "[ . 1]" 1
2083 1 88 LEU QD 1 115 PHE QD 2.761 . 3.327 2.151 1.951 2.349 . 0 0 "[ . 1]" 1
2084 1 88 LEU QD 1 115 PHE QE 3.012 . 4.146 2.870 2.714 3.084 . 0 0 "[ . 1]" 1
2085 1 89 ILE H 1 89 ILE MD 3.979 . 5.958 3.743 3.672 3.857 . 0 0 "[ . 1]" 1
2086 1 89 ILE H 1 89 ILE QG 2.609 . 3.460 2.015 1.935 2.147 . 0 0 "[ . 1]" 1
2087 1 89 ILE H 1 89 ILE MG 2.931 . 4.005 2.918 2.785 3.059 . 0 0 "[ . 1]" 1
2088 1 89 ILE H 1 90 GLY H 4.198 . 6.401 4.449 4.360 4.518 . 0 0 "[ . 1]" 1
2089 1 89 ILE HA 1 90 GLY HA2 3.864 . 5.730 4.368 4.336 4.410 . 0 0 "[ . 1]" 1
2090 1 89 ILE HA 1 90 GLY HA3 3.828 . 5.660 4.348 4.287 4.371 . 0 0 "[ . 1]" 1
2091 1 89 ILE HB 1 89 ILE MD 3.040 . 4.195 2.413 2.404 2.437 . 0 0 "[ . 1]" 1
2092 1 89 ILE HB 1 89 ILE QG 3.166 . 4.419 2.374 2.358 2.380 . 0 0 "[ . 1]" 1
2093 1 89 ILE HB 1 90 GLY H 2.873 . 3.905 2.978 2.795 3.066 . 0 0 "[ . 1]" 1
2094 1 89 ILE HB 1 93 GLU H 4.083 . 6.166 3.798 3.567 3.945 . 0 0 "[ . 1]" 1
2095 1 89 ILE HB 1 93 GLU HB2 2.955 . 4.047 2.036 1.842 2.295 0.021 3 0 "[ . 1]" 1
2096 1 89 ILE HB 1 93 GLU HB3 2.968 . 4.069 2.668 2.162 3.059 . 0 0 "[ . 1]" 1
2097 1 89 ILE HB 1 94 GLU H 4.059 . 6.119 4.075 3.817 4.602 . 0 0 "[ . 1]" 1
2098 1 89 ILE MD 1 92 GLY H 4.389 . 6.796 5.343 4.962 5.862 . 0 0 "[ . 1]" 1
2099 1 89 ILE MD 1 93 GLU H 3.399 . 4.843 4.282 4.076 4.624 . 0 0 "[ . 1]" 1
2100 1 89 ILE MD 1 93 GLU HB3 3.709 . 5.429 3.965 3.512 4.336 . 0 0 "[ . 1]" 1
2101 1 89 ILE MD 1 94 GLU HA 2.716 . 3.638 2.230 2.042 2.440 . 0 0 "[ . 1]" 1
2102 1 89 ILE MD 1 95 SER H 2.756 . 3.705 2.631 2.373 2.786 . 0 0 "[ . 1]" 1
2103 1 89 ILE MD 1 95 SER QB 3.976 . 5.952 2.951 2.526 3.506 . 0 0 "[ . 1]" 1
2104 1 89 ILE QG 1 89 ILE MG 2.643 . 3.516 2.323 2.309 2.346 . 0 0 "[ . 1]" 1
2105 1 89 ILE QG 1 92 GLY H 4.593 . 7.230 5.964 5.417 6.500 . 0 0 "[ . 1]" 1
2106 1 89 ILE QG 1 93 GLU H 3.880 . 5.762 5.016 4.889 5.182 . 0 0 "[ . 1]" 1
2107 1 89 ILE QG 1 94 GLU HA 3.646 . 5.308 4.301 4.112 4.583 . 0 0 "[ . 1]" 1
2108 1 89 ILE MG 1 90 GLY H 3.002 . 4.128 3.660 3.588 3.736 . 0 0 "[ . 1]" 1
2109 1 89 ILE MG 1 93 GLU HB2 3.038 . 4.191 3.116 2.783 3.344 . 0 0 "[ . 1]" 1
2110 1 89 ILE MG 1 93 GLU HB3 3.322 . 4.702 2.527 2.366 2.900 . 0 0 "[ . 1]" 1
2111 1 89 ILE MG 1 93 GLU HG2 3.618 . 5.255 4.642 4.174 5.162 . 0 0 "[ . 1]" 1
2112 1 89 ILE MG 1 93 GLU HG3 3.521 . 5.070 4.442 3.785 4.861 . 0 0 "[ . 1]" 1
2113 1 89 ILE MG 1 94 GLU H 3.130 . 4.355 3.267 3.086 3.688 . 0 0 "[ . 1]" 1
2114 1 89 ILE MG 1 95 SER H 3.889 . 5.780 3.279 2.939 3.672 . 0 0 "[ . 1]" 1
2115 1 89 ILE MG 1 95 SER QB 2.733 . 3.666 2.128 2.028 2.374 . 0 0 "[ . 1]" 1
2116 1 90 GLY H 1 90 GLY HA3 2.961 . 4.057 2.385 2.332 2.589 . 0 0 "[ . 1]" 1
2117 1 90 GLY H 1 91 GLY H 4.100 . 6.201 4.327 3.971 4.455 . 0 0 "[ . 1]" 1
2118 1 90 GLY H 1 93 GLU H 3.521 . 5.071 4.318 3.624 4.585 . 0 0 "[ . 1]" 1
2119 1 90 GLY H 1 93 GLU HB2 3.164 . 4.416 2.573 2.334 2.762 . 0 0 "[ . 1]" 1
2120 1 90 GLY H 1 93 GLU HB3 3.179 . 4.442 3.722 3.378 4.089 . 0 0 "[ . 1]" 1
2121 1 90 GLY H 1 93 GLU HG2 4.108 . 6.218 4.167 3.458 4.519 . 0 0 "[ . 1]" 1
2122 1 90 GLY H 1 93 GLU HG3 4.039 . 6.078 3.212 2.287 3.623 . 0 0 "[ . 1]" 1
2123 1 90 GLY HA2 1 91 GLY H 2.890 . 3.934 2.741 2.370 3.074 . 0 0 "[ . 1]" 1
2124 1 90 GLY HA3 1 91 GLY H 2.893 . 3.939 2.412 2.160 2.771 . 0 0 "[ . 1]" 1
2125 1 91 GLY H 1 92 GLY H 3.583 . 5.188 4.282 2.792 4.516 . 0 0 "[ . 1]" 1
2126 1 91 GLY H 1 93 GLU H 3.957 . 5.914 4.686 4.277 5.058 . 0 0 "[ . 1]" 1
2127 1 91 GLY H 1 93 GLU HB2 4.024 . 6.048 5.209 4.898 5.544 . 0 0 "[ . 1]" 1
2128 1 91 GLY QA 1 92 GLY H 3.054 . 3.543 2.199 2.098 2.891 . 0 0 "[ . 1]" 1
2129 1 91 GLY QA 1 92 GLY HA2 4.150 . 6.048 4.120 4.057 4.415 . 0 0 "[ . 1]" 1
2130 1 91 GLY QA 1 92 GLY HA3 3.961 . 5.704 3.925 3.894 3.969 . 0 0 "[ . 1]" 1
2131 1 91 GLY QA 1 93 GLU H 4.076 . 5.256 3.534 3.357 3.857 . 0 0 "[ . 1]" 1
2132 1 92 GLY H 1 92 GLY HA2 2.709 . 3.626 2.386 2.310 2.461 . 0 0 "[ . 1]" 1
2133 1 92 GLY H 1 92 GLY HA3 2.816 . 3.807 2.926 2.870 2.957 . 0 0 "[ . 1]" 1
2134 1 92 GLY H 1 93 GLU H 2.759 . 3.710 2.344 2.172 2.498 . 0 0 "[ . 1]" 1
2135 1 92 GLY HA2 1 93 GLU H 3.294 . 4.650 3.223 2.974 3.441 . 0 0 "[ . 1]" 1
2136 1 92 GLY HA2 1 93 GLU HG3 4.077 . 6.155 5.829 4.858 6.866 0.711 6 3 "[ - .+ *1]" 1
2137 1 92 GLY HA3 1 93 GLU H 3.411 . 4.866 3.298 3.045 3.495 . 0 0 "[ . 1]" 1
2138 1 92 GLY HA3 1 93 GLU HG3 4.096 . 6.193 4.970 3.981 5.974 . 0 0 "[ . 1]" 1
2139 1 93 GLU H 1 93 GLU HA 2.938 . 4.017 2.921 2.838 2.944 . 0 0 "[ . 1]" 1
2140 1 93 GLU H 1 93 GLU HB2 2.548 . 3.359 2.458 2.335 2.640 . 0 0 "[ . 1]" 1
2141 1 93 GLU H 1 93 GLU HB3 2.837 . 3.843 3.657 3.574 3.779 . 0 0 "[ . 1]" 1
2142 1 93 GLU H 1 93 GLU HG2 3.442 . 4.923 3.542 2.869 4.149 . 0 0 "[ . 1]" 1
2143 1 93 GLU H 1 93 GLU HG3 3.520 . 5.069 3.361 2.441 4.255 . 0 0 "[ . 1]" 1
2144 1 93 GLU HA 1 93 GLU HG2 2.919 . 3.984 2.666 2.453 2.997 . 0 0 "[ . 1]" 1
2145 1 93 GLU HA 1 93 GLU HG3 2.904 . 3.958 3.318 2.982 3.795 . 0 0 "[ . 1]" 1
2146 1 93 GLU HB2 1 94 GLU H 2.353 . 3.045 3.371 3.174 3.610 0.565 10 2 "[ .- +]" 1
2147 1 93 GLU HB3 1 93 GLU HG3 2.970 . 4.072 2.793 2.417 3.014 . 0 0 "[ . 1]" 1
2148 1 93 GLU HB3 1 94 GLU H 3.018 . 4.156 2.437 2.199 2.716 . 0 0 "[ . 1]" 1
2149 1 93 GLU HG2 1 94 GLU H 3.656 . 5.327 4.209 3.709 4.902 . 0 0 "[ . 1]" 1
2150 1 93 GLU HG3 1 94 GLU H 3.515 . 5.060 4.757 4.498 5.046 . 0 0 "[ . 1]" 1
2151 1 94 GLU H 1 94 GLU HA 2.983 . 4.095 2.918 2.892 2.944 . 0 0 "[ . 1]" 1
2152 1 94 GLU H 1 94 GLU HB2 3.415 . 4.873 3.659 2.646 3.936 . 0 0 "[ . 1]" 1
2153 1 94 GLU H 1 94 GLU HB3 3.092 . 4.287 3.443 3.242 3.857 . 0 0 "[ . 1]" 1
2154 1 94 GLU H 1 94 GLU HG2 3.526 . 5.080 3.165 2.398 4.419 . 0 0 "[ . 1]" 1
2155 1 94 GLU H 1 94 GLU HG3 3.315 . 4.689 3.386 2.331 4.218 . 0 0 "[ . 1]" 1
2156 1 94 GLU H 1 95 SER H 3.731 . 5.471 4.380 4.295 4.460 . 0 0 "[ . 1]" 1
2157 1 94 GLU HA 1 94 GLU HB2 2.765 . 3.721 2.532 2.380 2.899 . 0 0 "[ . 1]" 1
2158 1 94 GLU HA 1 94 GLU HB3 2.748 . 3.692 2.440 2.330 2.492 . 0 0 "[ . 1]" 1
2159 1 94 GLU HA 1 94 GLU HG2 3.496 . 5.024 3.762 3.570 4.232 . 0 0 "[ . 1]" 1
2160 1 94 GLU HA 1 94 GLU HG3 3.437 . 4.914 3.610 2.497 4.260 . 0 0 "[ . 1]" 1
2161 1 94 GLU HA 1 95 SER H 2.398 . 3.117 2.300 2.245 2.352 . 0 0 "[ . 1]" 1
2162 1 94 GLU HA 1 95 SER QB 4.454 . 6.934 4.101 3.934 4.427 . 0 0 "[ . 1]" 1
2163 1 94 GLU HB2 1 95 SER H 2.764 . 3.719 2.873 2.587 3.620 . 0 0 "[ . 1]" 1
2164 1 94 GLU HB2 1 95 SER H 3.660 . 5.335 2.918 2.596 3.754 . 0 0 "[ . 1]" 1
2165 1 94 GLU HB3 1 95 SER H 2.838 . 3.845 3.657 2.625 4.019 0.174 10 0 "[ . 1]" 1
2166 1 94 GLU HG2 1 95 SER H 3.570 . 5.164 4.658 3.860 4.973 . 0 0 "[ . 1]" 1
2167 1 94 GLU HG3 1 95 SER H 3.689 . 5.390 4.308 3.894 4.959 . 0 0 "[ . 1]" 1
2168 1 95 SER H 1 95 SER QB 3.425 . 4.446 2.905 2.726 3.245 . 0 0 "[ . 1]" 1
2169 1 95 SER QB 1 96 SER H 3.541 . 5.109 3.173 2.328 3.602 . 0 0 "[ . 1]" 1
2170 1 96 SER H 1 96 SER HB2 3.112 . 4.323 3.072 2.676 3.847 . 0 0 "[ . 1]" 1
2171 1 96 SER H 1 96 SER HB3 3.409 . 4.861 3.699 3.232 3.925 . 0 0 "[ . 1]" 1
2172 1 96 SER H 1 97 LEU H 3.676 . 5.365 4.410 4.335 4.463 . 0 0 "[ . 1]" 1
2173 1 96 SER H 1 97 LEU HB3 4.296 . 6.603 5.256 5.081 5.565 . 0 0 "[ . 1]" 1
2174 1 96 SER H 1 97 LEU HG 4.498 . 7.027 5.910 5.677 6.098 . 0 0 "[ . 1]" 1
2175 1 96 SER HA 1 96 SER HB2 2.882 . 3.920 2.887 2.519 3.034 . 0 0 "[ . 1]" 1
2176 1 96 SER HA 1 96 SER HB3 2.862 . 3.886 2.443 2.373 2.499 . 0 0 "[ . 1]" 1
2177 1 96 SER HA 1 97 LEU H 2.451 . 3.202 2.304 2.225 2.350 . 0 0 "[ . 1]" 1
2178 1 96 SER HA 1 97 LEU HB2 3.958 . 5.916 5.669 5.638 5.691 . 0 0 "[ . 1]" 1
2179 1 96 SER HA 1 97 LEU HB3 4.363 . 6.743 4.505 4.462 4.530 . 0 0 "[ . 1]" 1
2180 1 96 SER HA 1 97 LEU MD2 3.759 . 5.525 4.661 4.556 4.743 . 0 0 "[ . 1]" 1
2181 1 96 SER HA 1 97 LEU HG 3.666 . 5.346 3.800 3.678 3.865 . 0 0 "[ . 1]" 1
2182 1 96 SER HB2 1 97 LEU H 2.894 . 3.941 3.416 2.583 3.812 . 0 0 "[ . 1]" 1
2183 1 96 SER HB2 1 97 LEU QD 4.491 . 7.012 5.459 4.769 5.779 . 0 0 "[ . 1]" 1
2184 1 96 SER HB3 1 97 LEU H 2.873 . 3.905 2.975 2.546 3.926 0.021 10 0 "[ . 1]" 1
2185 1 96 SER HB3 1 97 LEU MD2 4.484 . 6.997 6.144 5.871 6.609 . 0 0 "[ . 1]" 1
2186 1 97 LEU H 1 97 LEU HB2 2.914 . 3.976 3.853 3.817 3.882 . 0 0 "[ . 1]" 1
2187 1 97 LEU H 1 97 LEU HB3 3.305 . 4.671 3.301 3.236 3.370 . 0 0 "[ . 1]" 1
2188 1 97 LEU H 1 97 LEU MD1 3.721 . 5.452 3.202 3.124 3.278 . 0 0 "[ . 1]" 1
2189 1 97 LEU H 1 97 LEU QD 2.770 . 3.729 3.049 2.989 3.106 . 0 0 "[ . 1]" 1
2190 1 97 LEU H 1 97 LEU MD2 3.843 . 5.689 3.833 3.726 3.898 . 0 0 "[ . 1]" 1
2191 1 97 LEU H 1 97 LEU HG 2.648 . 3.524 2.291 2.199 2.333 . 0 0 "[ . 1]" 1
2192 1 97 LEU HB2 1 97 LEU MD1 2.850 . 3.865 2.292 2.266 2.317 . 0 0 "[ . 1]" 1
2193 1 97 LEU HB2 1 97 LEU MD2 2.673 . 3.566 2.570 2.544 2.599 . 0 0 "[ . 1]" 1
2194 1 97 LEU HB2 1 98 THR H 3.527 . 5.082 2.584 2.474 2.739 . 0 0 "[ . 1]" 1
2195 1 97 LEU HB3 1 97 LEU MD1 3.086 . 4.277 3.191 3.180 3.200 . 0 0 "[ . 1]" 1
2196 1 97 LEU HB3 1 97 LEU MD2 2.857 . 3.877 2.200 2.186 2.218 . 0 0 "[ . 1]" 1
2197 1 97 LEU HB3 1 98 THR H 2.662 . 3.548 3.826 3.754 3.908 0.360 10 0 "[ . 1]" 1
2198 1 97 LEU QD 1 98 THR H 2.770 . 3.729 3.188 3.106 3.311 . 0 0 "[ . 1]" 1
2199 1 97 LEU QD 1 98 THR HB 3.722 . 5.454 4.865 4.815 4.963 . 0 0 "[ . 1]" 1
2200 1 97 LEU MD1 1 97 LEU HG 2.933 . 4.008 2.129 2.127 2.130 . 0 0 "[ . 1]" 1
2201 1 97 LEU MD1 1 98 THR H 3.776 . 5.558 3.244 3.161 3.371 . 0 0 "[ . 1]" 1
2202 1 97 LEU MD1 1 98 THR HA 3.001 . 4.126 2.858 2.798 2.921 . 0 0 "[ . 1]" 1
2203 1 97 LEU MD2 1 97 LEU HG 2.943 . 4.026 2.126 2.124 2.128 . 0 0 "[ . 1]" 1
2204 1 97 LEU MD2 1 98 THR H 4.405 . 6.831 4.681 4.561 4.834 . 0 0 "[ . 1]" 1
2205 1 97 LEU HG 1 98 THR H 3.604 . 5.227 4.692 4.659 4.752 . 0 0 "[ . 1]" 1
2206 1 97 LEU HG 1 98 THR HA 3.755 . 5.518 5.062 4.972 5.160 . 0 0 "[ . 1]" 1
2207 1 98 THR H 1 98 THR HA 2.953 . 4.043 2.935 2.926 2.940 . 0 0 "[ . 1]" 1
2208 1 98 THR H 1 98 THR HB 2.717 . 3.640 3.061 2.712 3.747 0.107 6 0 "[ . 1]" 1
2209 1 98 THR H 1 98 THR MG 3.039 . 4.194 3.742 3.157 3.945 . 0 0 "[ . 1]" 1
2210 1 98 THR H 1 99 LEU H 3.570 . 5.163 4.281 4.200 4.376 . 0 0 "[ . 1]" 1
2211 1 98 THR H 1 99 LEU QD 4.484 . 6.997 5.052 4.820 5.248 . 0 0 "[ . 1]" 1
2212 1 98 THR HA 1 98 THR HB 2.798 . 3.776 2.904 2.552 3.028 . 0 0 "[ . 1]" 1
2213 1 98 THR HA 1 98 THR MG 2.538 . 3.343 2.317 2.172 2.394 . 0 0 "[ . 1]" 1
2214 1 98 THR HA 1 99 LEU H 2.284 . 2.936 2.174 2.132 2.216 . 0 0 "[ . 1]" 1
2215 1 98 THR HA 1 99 LEU QD 4.713 . 7.490 4.111 3.871 4.273 . 0 0 "[ . 1]" 1
2216 1 98 THR HB 1 98 THR MG 2.284 . 2.936 2.132 2.129 2.134 . 0 0 "[ . 1]" 1
2217 1 98 THR HB 1 99 LEU H 3.064 . 4.238 3.837 2.980 4.235 . 0 0 "[ . 1]" 1
2218 1 98 THR HB 1 99 LEU QD 4.424 . 6.870 5.678 5.245 5.904 . 0 0 "[ . 1]" 1
2219 1 98 THR MG 1 99 LEU H 2.718 . 3.641 2.901 2.524 3.794 0.153 6 0 "[ . 1]" 1
2220 1 99 LEU H 1 99 LEU QB 3.658 . 4.439 3.029 2.889 3.171 . 0 0 "[ . 1]" 1
2221 1 99 LEU H 1 99 LEU QD . . 4.157 3.048 2.911 3.156 . 0 0 "[ . 1]" 1
2222 1 99 LEU H 1 100 ASP H 3.733 . 5.475 4.450 4.396 4.486 . 0 0 "[ . 1]" 1
2223 1 99 LEU QB 1 99 LEU QD 2.933 . 3.997 1.887 1.862 1.909 . 0 0 "[ . 1]" 1
2224 1 99 LEU QB 1 100 ASP H 3.271 . 3.617 2.540 2.453 2.650 . 0 0 "[ . 1]" 1
2225 1 99 LEU QD 1 100 ASP H 3.792 . 4.378 3.224 3.149 3.390 . 0 0 "[ . 1]" 1
2226 1 99 LEU QD 1 100 ASP HA 3.776 . 5.558 3.492 3.377 3.596 . 0 0 "[ . 1]" 1
2227 1 99 LEU QD 1 101 PRO HA 3.329 . 4.714 2.795 2.494 3.097 . 0 0 "[ . 1]" 1
2228 1 99 LEU QD 1 101 PRO HA 2.735 . 3.670 2.463 2.160 2.715 . 0 0 "[ . 1]" 1
2229 1 99 LEU QD 1 101 PRO HD2 3.742 . 5.492 4.309 3.962 4.696 . 0 0 "[ . 1]" 1
2230 1 99 LEU QD 1 101 PRO HD3 3.634 . 5.285 3.116 2.807 3.620 . 0 0 "[ . 1]" 1
2231 1 99 LEU QD 1 101 PRO HG2 3.490 . 5.013 4.700 4.449 5.032 0.019 6 0 "[ . 1]" 1
2232 1 99 LEU QD 1 101 PRO HG3 3.719 . 5.447 3.580 3.200 4.363 . 0 0 "[ . 1]" 1
2233 1 99 LEU QD 1 104 LEU QD 2.770 . 3.729 1.934 1.809 2.042 0.002 3 0 "[ . 1]" 1
2234 1 99 LEU HG 1 100 ASP HA 3.747 . 5.502 5.217 4.745 5.568 0.066 10 0 "[ . 1]" 1
2235 1 100 ASP H 1 100 ASP HA 2.911 . 3.970 2.913 2.895 2.926 . 0 0 "[ . 1]" 1
2236 1 100 ASP H 1 100 ASP HB2 2.573 . 3.401 2.765 2.318 3.697 0.296 6 0 "[ . 1]" 1
2237 1 100 ASP H 1 100 ASP HB3 2.500 . 3.281 2.843 2.341 3.636 0.355 4 0 "[ . 1]" 1
2238 1 100 ASP H 1 101 PRO HD3 3.763 . 5.533 4.414 4.218 4.587 . 0 0 "[ . 1]" 1
2239 1 100 ASP H 1 103 LYS QB 3.549 . 5.123 3.877 3.545 4.409 . 0 0 "[ . 1]" 1
2240 1 100 ASP HA 1 100 ASP HB2 2.802 . 3.783 2.627 2.395 3.030 . 0 0 "[ . 1]" 1
2241 1 100 ASP HA 1 100 ASP HB3 2.917 . 3.981 2.821 2.439 3.033 . 0 0 "[ . 1]" 1
2242 1 100 ASP HA 1 101 PRO HA 4.119 . 6.240 4.472 4.424 4.514 . 0 0 "[ . 1]" 1
2243 1 100 ASP HA 1 101 PRO HD2 2.693 . 3.600 2.382 2.022 2.758 . 0 0 "[ . 1]" 1
2244 1 100 ASP HA 1 101 PRO HD3 2.640 . 3.511 2.050 1.835 2.416 . 0 0 "[ . 1]" 1
2245 1 100 ASP HA 1 101 PRO HG2 3.938 . 5.877 4.352 4.219 4.424 . 0 0 "[ . 1]" 1
2246 1 100 ASP HA 1 101 PRO HG3 3.479 . 4.992 4.205 3.975 4.389 . 0 0 "[ . 1]" 1
2247 1 100 ASP HA 1 103 LYS H 4.467 . 6.961 4.752 4.593 4.999 . 0 0 "[ . 1]" 1
2248 1 100 ASP HB2 1 101 PRO HD2 4.076 . 6.153 4.280 2.925 4.654 . 0 0 "[ . 1]" 1
2249 1 100 ASP HB2 1 103 LYS H 3.912 . 5.825 4.366 3.257 5.075 . 0 0 "[ . 1]" 1
2250 1 100 ASP HB3 1 102 ALA H 3.555 . 5.135 3.784 3.066 4.325 . 0 0 "[ . 1]" 1
2251 1 100 ASP HB3 1 103 LYS H 3.591 . 5.203 3.588 3.098 4.889 . 0 0 "[ . 1]" 1
2252 1 101 PRO HA 1 101 PRO HB3 2.850 . 3.865 2.286 2.267 2.299 . 0 0 "[ . 1]" 1
2253 1 101 PRO HA 1 101 PRO HD3 3.499 . 5.030 3.658 3.503 3.826 . 0 0 "[ . 1]" 1
2254 1 101 PRO HA 1 101 PRO HG2 3.126 . 4.348 3.930 3.854 4.002 . 0 0 "[ . 1]" 1
2255 1 101 PRO HA 1 102 ALA H 3.101 . 4.303 3.490 3.404 3.532 . 0 0 "[ . 1]" 1
2256 1 101 PRO HA 1 102 ALA MB 3.498 . 5.027 4.999 4.949 5.026 . 0 0 "[ . 1]" 1
2257 1 101 PRO HA 1 103 LYS H 3.647 . 5.309 3.907 3.603 4.339 . 0 0 "[ . 1]" 1
2258 1 101 PRO HA 1 104 LEU H 3.313 . 4.685 3.483 3.222 3.819 . 0 0 "[ . 1]" 1
2259 1 101 PRO HA 1 104 LEU HB2 3.393 . 4.832 3.157 2.808 3.590 . 0 0 "[ . 1]" 1
2260 1 101 PRO HA 1 104 LEU HB3 4.438 . 6.900 4.717 4.454 4.969 . 0 0 "[ . 1]" 1
2261 1 101 PRO HA 1 104 LEU QD 3.268 . 4.603 2.754 2.351 3.004 . 0 0 "[ . 1]" 1
2262 1 101 PRO HA 1 104 LEU HG 3.023 . 4.165 4.090 2.550 5.637 1.472 9 5 "[ -***+1]" 1
2263 1 101 PRO HA 1 105 ALA H 4.468 . 6.963 5.365 4.614 6.071 . 0 0 "[ . 1]" 1
2264 1 101 PRO HA 1 128 LEU QD 3.260 . 4.588 2.781 2.379 3.032 . 0 0 "[ . 1]" 1
2265 1 101 PRO HB2 1 102 ALA H 3.009 . 4.141 3.067 2.767 3.670 . 0 0 "[ . 1]" 1
2266 1 101 PRO HB2 1 105 ALA H 3.756 . 5.519 4.409 4.259 4.584 . 0 0 "[ . 1]" 1
2267 1 101 PRO HB2 1 104 LEU QD 3.614 . 5.247 4.873 4.124 5.377 0.130 3 0 "[ . 1]" 1
2268 1 101 PRO HB2 1 128 LEU QD 3.038 . 4.192 2.797 1.951 3.735 . 0 0 "[ . 1]" 1
2269 1 101 PRO HD2 1 101 PRO HG3 2.940 . 4.020 2.932 2.693 2.996 . 0 0 "[ . 1]" 1
2270 1 101 PRO HD2 1 102 ALA H 2.938 . 4.017 2.869 2.698 3.020 . 0 0 "[ . 1]" 1
2271 1 101 PRO HD3 1 101 PRO HG3 2.913 . 3.974 2.307 2.294 2.315 . 0 0 "[ . 1]" 1
2272 1 101 PRO HD3 1 102 ALA H 3.689 . 5.390 4.024 3.828 4.113 . 0 0 "[ . 1]" 1
2273 1 101 PRO HG2 1 128 LEU QD 4.010 . 6.020 4.262 3.824 5.051 . 0 0 "[ . 1]" 1
2274 1 101 PRO HG3 1 128 LEU QD 4.014 . 6.028 4.046 3.832 4.542 . 0 0 "[ . 1]" 1
2275 1 102 ALA H 1 102 ALA HA 2.462 . 3.220 2.838 2.801 2.867 . 0 0 "[ . 1]" 1
2276 1 102 ALA H 1 102 ALA MB 2.127 . 2.692 2.245 2.224 2.264 . 0 0 "[ . 1]" 1
2277 1 102 ALA H 1 103 LYS H 2.532 . 3.333 2.548 2.454 2.653 . 0 0 "[ . 1]" 1
2278 1 102 ALA H 1 103 LYS QG 3.121 . 4.338 4.347 3.891 5.177 0.839 1 3 "[+ .- * 1]" 1
2279 1 102 ALA H 1 104 LEU H 3.312 . 4.683 4.059 3.956 4.147 . 0 0 "[ . 1]" 1
2280 1 102 ALA H 1 128 LEU QD 3.647 . 5.310 4.307 3.881 4.789 . 0 0 "[ . 1]" 1
2281 1 102 ALA HA 1 104 LEU H 2.587 . 3.423 3.182 2.960 3.312 . 0 0 "[ . 1]" 1
2282 1 102 ALA MB 1 105 ALA HA 2.208 . 2.818 3.652 2.906 4.138 1.320 2 8 "[*+****- *]" 1
2283 1 103 LYS H 1 103 LYS HA 2.710 . 3.628 2.866 2.827 2.905 . 0 0 "[ . 1]" 1
2284 1 103 LYS H 1 103 LYS QB 2.482 . 3.252 2.332 2.246 2.404 . 0 0 "[ . 1]" 1
2285 1 103 LYS H 1 103 LYS QG 2.937 . 4.015 2.946 2.383 4.037 0.022 6 0 "[ . 1]" 1
2286 1 103 LYS H 1 104 LEU H 2.509 . 3.296 2.460 2.330 2.601 . 0 0 "[ . 1]" 1
2287 1 103 LYS H 1 104 LEU QD 3.933 . 5.867 3.905 3.429 4.516 . 0 0 "[ . 1]" 1
2288 1 103 LYS H 1 104 LEU HG 3.529 . 5.086 5.067 3.619 6.459 1.373 6 5 "[ -+***1]" 1
2289 1 103 LYS H 1 105 ALA H 3.504 . 5.039 4.024 3.839 4.261 . 0 0 "[ . 1]" 1
2290 1 103 LYS QB 1 104 LEU H 3.025 . 4.169 3.012 2.719 3.366 . 0 0 "[ . 1]" 1
2291 1 103 LYS QB 1 104 LEU QD 3.588 . 5.197 2.810 2.426 3.303 . 0 0 "[ . 1]" 1
2292 1 104 LEU H 1 104 LEU HB2 2.572 . 3.399 2.400 2.256 2.541 . 0 0 "[ . 1]" 1
2293 1 104 LEU H 1 104 LEU HB3 3.299 . 4.660 3.593 3.535 3.658 . 0 0 "[ . 1]" 1
2294 1 104 LEU H 1 104 LEU QD 2.947 . 4.032 2.781 2.411 3.138 . 0 0 "[ . 1]" 1
2295 1 104 LEU H 1 104 LEU HG 2.530 . 3.330 3.333 2.401 4.399 1.069 9 5 "[ ***-+1]" 1
2296 1 104 LEU H 1 105 ALA H 2.409 . 3.134 2.406 2.349 2.499 . 0 0 "[ . 1]" 1
2297 1 104 LEU H 1 105 ALA HA 3.729 . 5.467 4.856 4.550 4.977 . 0 0 "[ . 1]" 1
2298 1 104 LEU H 1 106 ASP H 3.921 . 5.843 4.497 4.107 5.265 . 0 0 "[ . 1]" 1
2299 1 104 LEU H 1 109 TYR QE 4.246 . 6.500 4.868 4.709 5.062 . 0 0 "[ . 1]" 1
2300 1 104 LEU H 1 128 LEU QD 3.214 . 4.505 3.363 3.008 3.693 . 0 0 "[ . 1]" 1
2301 1 104 LEU HA 1 104 LEU HB3 2.887 . 3.929 2.540 2.435 2.652 . 0 0 "[ . 1]" 1
2302 1 104 LEU HA 1 104 LEU QD 2.634 . 3.501 2.246 2.039 2.481 . 0 0 "[ . 1]" 1
2303 1 104 LEU HA 1 104 LEU HG 3.346 . 4.745 2.904 2.512 3.318 . 0 0 "[ . 1]" 1
2304 1 104 LEU HA 1 105 ALA H 2.833 . 3.836 3.250 3.028 3.387 . 0 0 "[ . 1]" 1
2305 1 104 LEU HA 1 106 ASP H 3.659 . 5.333 3.383 3.262 3.799 . 0 0 "[ . 1]" 1
2306 1 104 LEU HA 1 109 TYR QE 2.385 . 3.096 2.418 2.103 2.728 . 0 0 "[ . 1]" 1
2307 1 104 LEU HA 1 109 TYR HB3 4.710 . 7.483 5.329 4.753 5.762 . 0 0 "[ . 1]" 1
2308 1 104 LEU HA 1 109 TYR QE 3.233 . 4.539 2.473 2.142 2.814 . 0 0 "[ . 1]" 1
2309 1 104 LEU HB2 1 104 LEU QD 3.197 . 3.924 2.232 2.120 2.350 . 0 0 "[ . 1]" 1
2310 1 104 LEU HB2 1 105 ALA H 3.039 . 4.193 3.527 3.263 3.973 . 0 0 "[ . 1]" 1
2311 1 104 LEU HB2 1 109 TYR QD 3.409 . 4.862 4.919 4.750 5.047 0.185 9 0 "[ . 1]" 1
2312 1 104 LEU HB2 1 109 TYR QE 3.568 . 5.159 4.951 4.564 5.269 0.110 5 0 "[ . 1]" 1
2313 1 104 LEU HB2 1 128 LEU QD 2.948 . 4.034 2.237 1.978 2.655 . 0 0 "[ . 1]" 1
2314 1 104 LEU HB3 1 104 LEU QD 3.001 . 3.853 2.205 2.106 2.301 . 0 0 "[ . 1]" 1
2315 1 104 LEU HB3 1 104 LEU HG 2.855 . 3.874 2.738 2.452 3.021 . 0 0 "[ . 1]" 1
2316 1 104 LEU HB3 1 109 TYR QD 2.893 . 3.939 3.557 3.248 3.936 . 0 0 "[ . 1]" 1
2317 1 104 LEU HB3 1 128 LEU QD 2.925 . 3.994 2.868 1.888 3.455 . 0 0 "[ . 1]" 1
2318 1 104 LEU MD1 1 104 LEU MD2 2.447 . 3.196 2.081 2.076 2.089 . 0 0 "[ . 1]" 1
2319 1 104 LEU QD 1 105 ALA H 3.586 . 5.193 4.162 4.023 4.283 . 0 0 "[ . 1]" 1
2320 1 104 LEU QD 1 106 ASP H 4.336 . 6.687 4.828 4.667 5.255 . 0 0 "[ . 1]" 1
2321 1 104 LEU QD 1 109 TYR H 4.045 . 6.090 4.594 4.307 4.946 . 0 0 "[ . 1]" 1
2322 1 104 LEU QD 1 109 TYR HB2 3.806 . 5.617 3.003 2.870 3.192 . 0 0 "[ . 1]" 1
2323 1 104 LEU QD 1 109 TYR HB3 3.929 . 5.858 3.351 3.125 3.559 . 0 0 "[ . 1]" 1
2324 1 104 LEU QD 1 109 TYR QD 2.593 . 3.434 2.987 2.781 3.257 . 0 0 "[ . 1]" 1
2325 1 104 LEU QD 1 109 TYR QE 2.711 . 3.630 3.112 2.914 3.556 . 0 0 "[ . 1]" 1
2326 1 104 LEU QD 1 128 LEU HA 3.946 . 5.893 3.782 3.380 4.783 . 0 0 "[ . 1]" 1
2327 1 104 LEU QD 1 128 LEU QD 3.033 . 4.183 2.680 2.340 3.196 . 0 0 "[ . 1]" 1
2328 1 104 LEU QD 1 129 VAL H 4.014 . 6.028 5.342 5.012 6.145 0.117 3 0 "[ . 1]" 1
2329 1 104 LEU HG 1 128 LEU QD 3.279 . 4.623 4.035 3.462 4.891 0.268 9 0 "[ . 1]" 1
2330 1 105 ALA H 1 105 ALA HA 2.449 . 3.199 2.892 2.863 2.921 . 0 0 "[ . 1]" 1
2331 1 105 ALA H 1 106 ASP H 2.675 . 3.569 2.694 2.347 3.618 0.049 6 0 "[ . 1]" 1
2332 1 105 ALA H 1 107 GLY H 3.901 . 5.803 4.695 4.251 5.219 . 0 0 "[ . 1]" 1
2333 1 105 ALA H 1 109 TYR QE 3.555 . 5.135 4.443 4.158 4.888 . 0 0 "[ . 1]" 1
2334 1 105 ALA H 1 128 LEU QD 3.148 . 4.387 3.167 2.898 3.479 . 0 0 "[ . 1]" 1
2335 1 105 ALA HA 1 106 ASP H 2.636 . 3.504 3.106 2.521 3.369 . 0 0 "[ . 1]" 1
2336 1 105 ALA HA 1 109 TYR QE 3.520 . 5.068 4.874 4.365 5.482 0.414 5 0 "[ . 1]" 1
2337 1 105 ALA HA 1 128 LEU QD 2.629 . 3.493 2.574 2.152 3.200 . 0 0 "[ . 1]" 1
2338 1 106 ASP H 1 106 ASP HB2 2.809 . 3.795 2.684 2.303 3.569 . 0 0 "[ . 1]" 1
2339 1 106 ASP H 1 106 ASP HB3 2.738 . 3.675 3.287 2.519 3.758 0.083 4 0 "[ . 1]" 1
2340 1 106 ASP H 1 107 GLY H 2.818 . 3.811 2.474 1.838 3.350 . 0 0 "[ . 1]" 1
2341 1 106 ASP H 1 107 GLY QA 4.827 . 7.739 4.321 3.869 4.589 . 0 0 "[ . 1]" 1
2342 1 106 ASP H 1 109 TYR QE 3.055 . 4.222 2.864 2.309 3.532 . 0 0 "[ . 1]" 1
2343 1 106 ASP H 1 128 LEU QD 3.806 . 5.616 4.502 3.977 4.832 . 0 0 "[ . 1]" 1
2344 1 106 ASP HB3 1 109 TYR QE 3.884 . 5.770 3.991 2.334 5.062 . 0 0 "[ . 1]" 1
2345 1 107 GLY H 1 107 GLY QA 2.613 . 3.466 2.454 2.386 2.504 . 0 0 "[ . 1]" 1
2346 1 107 GLY H 1 108 ASP H 3.510 . 5.050 4.357 4.226 4.443 . 0 0 "[ . 1]" 1
2347 1 107 GLY H 1 109 TYR QD 3.417 . 4.876 3.944 3.183 4.863 . 0 0 "[ . 1]" 1
2348 1 107 GLY H 1 109 TYR QE 2.778 . 3.743 2.673 2.205 3.781 0.038 7 0 "[ . 1]" 1
2349 1 107 GLY QA 1 108 ASP H 2.472 . 3.236 2.208 2.127 2.273 . 0 0 "[ . 1]" 1
2350 1 107 GLY QA 1 108 ASP HA 4.188 . 6.187 3.924 3.907 3.945 . 0 0 "[ . 1]" 1
2351 1 107 GLY QA 1 108 ASP HB3 4.029 . 5.849 4.726 4.247 5.254 . 0 0 "[ . 1]" 1
2352 1 107 GLY QA 1 109 TYR H 4.515 . 6.929 5.152 4.997 5.338 . 0 0 "[ . 1]" 1
2353 1 107 GLY QA 1 109 TYR QD 2.854 . 3.872 4.133 3.907 4.448 0.576 4 2 "[ +. -]" 1
2354 1 107 GLY QA 1 109 TYR QE 2.892 . 3.937 3.474 3.067 3.894 . 0 0 "[ . 1]" 1
2355 1 108 ASP H 1 108 ASP HA 2.630 . 3.495 2.918 2.895 2.944 . 0 0 "[ . 1]" 1
2356 1 108 ASP H 1 108 ASP HB2 2.791 . 3.765 2.705 2.222 3.670 . 0 0 "[ . 1]" 1
2357 1 108 ASP H 1 108 ASP HB3 2.561 . 3.381 2.997 2.497 3.622 0.241 1 0 "[ . 1]" 1
2358 1 108 ASP H 1 109 TYR H 3.421 . 4.884 4.378 4.262 4.438 . 0 0 "[ . 1]" 1
2359 1 108 ASP H 1 109 TYR HA 3.909 . 5.820 5.005 4.700 5.156 . 0 0 "[ . 1]" 1
2360 1 108 ASP H 1 109 TYR QD 4.104 . 6.210 4.310 4.014 4.688 . 0 0 "[ . 1]" 1
2361 1 108 ASP H 1 109 TYR QE 4.173 . 6.349 4.767 4.548 5.164 . 0 0 "[ . 1]" 1
2362 1 108 ASP HA 1 108 ASP HB2 2.672 . 3.565 2.692 2.444 3.021 . 0 0 "[ . 1]" 1
2363 1 108 ASP HA 1 108 ASP HB3 2.709 . 3.626 2.793 2.431 3.029 . 0 0 "[ . 1]" 1
2364 1 108 ASP HA 1 109 TYR H 2.269 . 2.912 2.123 2.088 2.148 . 0 0 "[ . 1]" 1
2365 1 108 ASP HA 1 109 TYR QD 2.956 . 4.048 3.227 2.982 3.518 . 0 0 "[ . 1]" 1
2366 1 108 ASP HA 1 109 TYR QE 3.745 . 5.498 4.900 4.552 5.438 . 0 0 "[ . 1]" 1
2367 1 108 ASP HA 1 125 LYS QE 3.569 . 5.161 4.633 2.979 6.352 1.191 4 2 "[ -+. 1]" 1
2368 1 108 ASP HB2 1 109 TYR H 3.321 . 4.700 4.237 3.384 4.430 . 0 0 "[ . 1]" 1
2369 1 108 ASP HB2 1 109 TYR QD 4.181 . 6.366 5.420 5.076 5.670 . 0 0 "[ . 1]" 1
2370 1 108 ASP HB3 1 109 TYR H 3.233 . 4.539 3.888 3.190 4.349 . 0 0 "[ . 1]" 1
2371 1 108 ASP HB3 1 109 TYR H 2.789 . 3.762 2.402 2.358 2.471 . 0 0 "[ . 1]" 1
2372 1 109 TYR H 1 109 TYR HB2 3.126 . 4.348 2.432 2.370 2.485 . 0 0 "[ . 1]" 1
2373 1 109 TYR H 1 109 TYR HB3 2.711 . 3.629 3.647 3.590 3.680 0.051 2 0 "[ . 1]" 1
2374 1 109 TYR H 1 109 TYR QD 2.775 . 3.737 2.525 2.416 2.755 . 0 0 "[ . 1]" 1
2375 1 109 TYR H 1 109 TYR QE 3.879 . 5.760 4.781 4.620 5.057 . 0 0 "[ . 1]" 1
2376 1 109 TYR H 1 110 LYS HG2 3.779 . 5.565 5.707 4.935 6.216 0.651 10 3 "[ -* . +]" 1
2377 1 109 TYR H 1 126 VAL H 4.099 . 6.199 4.441 4.116 5.037 . 0 0 "[ . 1]" 1
2378 1 109 TYR H 1 126 VAL QG 4.219 . 5.156 3.860 3.343 4.525 . 0 0 "[ . 1]" 1
2379 1 109 TYR HA 1 109 TYR QD 2.665 . 3.552 3.072 2.996 3.108 . 0 0 "[ . 1]" 1
2380 1 109 TYR HA 1 109 TYR QE 3.371 . 4.791 4.609 4.515 4.665 . 0 0 "[ . 1]" 1
2381 1 109 TYR HA 1 110 LYS H 2.548 . 3.359 2.270 2.172 2.314 . 0 0 "[ . 1]" 1
2382 1 109 TYR HA 1 110 LYS QD 3.744 . 5.496 5.265 5.026 5.500 0.004 3 0 "[ . 1]" 1
2383 1 109 TYR HA 1 110 LYS HG3 3.511 . 5.052 3.924 3.372 5.116 0.064 6 0 "[ . 1]" 1
2384 1 109 TYR HA 1 126 VAL H 4.120 . 6.241 5.177 4.871 5.819 . 0 0 "[ . 1]" 1
2385 1 109 TYR HB2 1 109 TYR QD 2.305 . 2.969 2.538 2.460 2.647 . 0 0 "[ . 1]" 1
2386 1 109 TYR HB2 1 109 TYR QE 3.121 . 4.338 4.445 4.425 4.470 0.132 9 0 "[ . 1]" 1
2387 1 109 TYR HB2 1 110 LYS H 3.228 . 4.530 3.931 3.796 4.049 . 0 0 "[ . 1]" 1
2388 1 109 TYR HB2 1 126 VAL H 3.909 . 5.819 4.294 3.957 4.738 . 0 0 "[ . 1]" 1
2389 1 109 TYR HB2 1 126 VAL QG 4.102 . 6.205 2.505 1.993 3.166 0.006 10 0 "[ . 1]" 1
2390 1 109 TYR HB3 1 109 TYR QD 2.378 . 3.085 2.307 2.267 2.342 . 0 0 "[ . 1]" 1
2391 1 109 TYR HB3 1 109 TYR QE 3.314 . 4.687 4.386 4.367 4.394 . 0 0 "[ . 1]" 1
2392 1 109 TYR HB3 1 110 LYS H 3.507 . 5.044 2.709 2.572 2.835 . 0 0 "[ . 1]" 1
2393 1 109 TYR HB3 1 126 VAL H 3.559 . 5.142 4.589 4.328 5.114 . 0 0 "[ . 1]" 1
2394 1 109 TYR HB3 1 126 VAL QG 3.545 . 5.115 2.582 2.066 3.375 . 0 0 "[ . 1]" 1
2395 1 109 TYR HB3 1 127 THR H 4.797 . 7.673 6.964 6.360 7.891 0.218 3 0 "[ . 1]" 1
2396 1 109 TYR QD 1 110 LYS H 3.546 . 5.118 3.799 3.689 3.959 . 0 0 "[ . 1]" 1
2397 1 109 TYR QD 1 126 VAL QG 3.434 . 4.908 3.772 3.430 4.209 . 0 0 "[ . 1]" 1
2398 1 109 TYR QD 1 127 THR MG 4.347 . 6.709 6.335 5.314 7.638 0.929 2 2 "[ +- . 1]" 1
2399 1 109 TYR QD 1 128 LEU QD 3.474 . 4.983 5.100 3.596 5.576 0.593 7 2 "[ . + -1]" 1
2400 1 109 TYR QE 1 126 VAL QG 4.339 . 6.692 5.234 5.014 5.578 . 0 0 "[ . 1]" 1
2401 1 109 TYR QE 1 128 LEU QD 3.817 . 5.638 5.154 4.423 5.647 0.009 7 0 "[ . 1]" 1
2402 1 110 LYS H 1 110 LYS HB2 3.534 . 5.095 2.799 2.522 3.885 . 0 0 "[ . 1]" 1
2403 1 110 LYS H 1 110 LYS HB3 3.352 . 4.756 3.739 3.321 3.870 . 0 0 "[ . 1]" 1
2404 1 110 LYS H 1 110 LYS HG2 2.989 . 4.106 3.895 2.436 4.360 0.254 5 0 "[ . 1]" 1
2405 1 110 LYS H 1 111 PHE H 3.874 . 5.750 4.428 4.377 4.467 . 0 0 "[ . 1]" 1
2406 1 110 LYS H 1 125 LYS QD 3.425 . 4.891 5.472 4.766 7.127 2.236 10 5 "[- ** *+]" 1
2407 1 110 LYS H 1 126 VAL H 4.293 . 6.597 4.542 4.268 5.049 . 0 0 "[ . 1]" 1
2408 1 110 LYS HA 1 110 LYS HG2 3.016 . 4.153 2.710 2.523 3.747 . 0 0 "[ . 1]" 1
2409 1 110 LYS HA 1 110 LYS HG3 3.120 . 4.337 3.191 2.884 3.769 . 0 0 "[ . 1]" 1
2410 1 110 LYS HA 1 111 PHE H 2.470 . 3.233 2.318 2.267 2.377 . 0 0 "[ . 1]" 1
2411 1 110 LYS HA 1 111 PHE QD 3.555 . 5.134 3.790 3.617 4.049 . 0 0 "[ . 1]" 1
2412 1 110 LYS HA 1 125 LYS H 4.512 . 7.056 4.969 4.785 5.371 . 0 0 "[ . 1]" 1
2413 1 110 LYS HA 1 125 LYS HA 2.904 . 3.958 2.466 2.152 2.836 . 0 0 "[ . 1]" 1
2414 1 110 LYS HA 1 125 LYS QB 4.001 . 6.002 4.407 4.088 4.782 . 0 0 "[ . 1]" 1
2415 1 110 LYS HA 1 125 LYS QD 3.477 . 4.988 3.584 2.975 5.365 0.377 10 0 "[ . 1]" 1
2416 1 110 LYS HA 1 126 VAL H 2.696 . 3.605 2.409 2.185 2.797 . 0 0 "[ . 1]" 1
2417 1 110 LYS HA 1 126 VAL QG 3.383 . 4.814 2.503 2.096 2.974 . 0 0 "[ . 1]" 1
2418 1 110 LYS HB2 1 110 LYS QE 3.964 . 5.928 3.154 2.172 4.177 . 0 0 "[ . 1]" 1
2419 1 110 LYS HB2 1 111 PHE H 2.883 . 3.922 3.647 2.675 3.951 0.029 10 0 "[ . 1]" 1
2420 1 110 LYS HB2 1 112 ALA MB 3.444 . 4.927 4.409 3.937 4.833 . 0 0 "[ . 1]" 1
2421 1 110 LYS HB2 1 124 GLY H 4.016 . 6.032 5.073 3.685 5.694 . 0 0 "[ . 1]" 1
2422 1 110 LYS HB3 1 110 LYS QE 3.371 . 4.791 2.803 1.939 4.215 0.012 4 0 "[ . 1]" 1
2423 1 110 LYS HB3 1 110 LYS HG2 2.999 . 4.123 2.455 2.382 2.568 . 0 0 "[ . 1]" 1
2424 1 110 LYS HB3 1 111 PHE H 2.674 . 3.567 2.767 2.506 3.916 0.349 6 0 "[ . 1]" 1
2425 1 110 LYS HB3 1 111 PHE QD 4.280 . 6.570 5.056 4.685 5.723 . 0 0 "[ . 1]" 1
2426 1 110 LYS HB3 1 124 GLY H 3.693 . 5.397 3.806 3.417 5.352 . 0 0 "[ . 1]" 1
2427 1 110 LYS QE 1 111 PHE H 3.807 . 5.619 4.710 3.898 6.311 0.692 10 1 "[ . +]" 1
2428 1 110 LYS QE 1 124 GLY H 3.702 . 5.415 4.529 3.382 6.858 1.443 10 1 "[ . +]" 1
2429 1 110 LYS QE 1 124 GLY HA3 4.627 . 7.303 5.970 4.643 8.143 0.840 10 1 "[ . +]" 1
2430 1 110 LYS HG2 1 125 LYS HA 3.471 . 4.977 3.251 2.538 5.533 0.556 6 1 "[ .+ 1]" 1
2431 1 110 LYS HG2 1 126 VAL H 3.373 . 4.795 4.284 3.629 5.750 0.955 6 1 "[ .+ 1]" 1
2432 1 111 PHE H 1 111 PHE HB2 3.522 . 5.073 3.825 3.796 3.870 . 0 0 "[ . 1]" 1
2433 1 111 PHE H 1 111 PHE QD 2.968 . 4.069 2.612 2.496 2.784 . 0 0 "[ . 1]" 1
2434 1 111 PHE H 1 111 PHE QE 4.345 . 6.705 4.255 4.136 4.434 . 0 0 "[ . 1]" 1
2435 1 111 PHE H 1 112 ALA H 3.834 . 5.671 4.437 4.391 4.503 . 0 0 "[ . 1]" 1
2436 1 111 PHE H 1 124 GLY HA2 4.652 . 7.357 4.813 4.725 4.990 . 0 0 "[ . 1]" 1
2437 1 111 PHE H 1 124 GLY HA3 4.138 . 6.278 4.274 4.141 4.460 . 0 0 "[ . 1]" 1
2438 1 111 PHE H 1 125 LYS QD 3.315 . 4.689 4.979 4.296 6.642 1.953 10 2 "[- . +]" 1
2439 1 111 PHE H 1 126 VAL H 3.624 . 5.266 3.789 3.631 3.947 . 0 0 "[ . 1]" 1
2440 1 111 PHE H 1 126 VAL HB 3.698 . 5.408 4.370 3.992 4.996 . 0 0 "[ . 1]" 1
2441 1 111 PHE H 1 126 VAL QG 3.141 . 4.374 2.979 2.631 3.554 . 0 0 "[ . 1]" 1
2442 1 111 PHE HA 1 112 ALA H 2.472 . 3.236 2.264 2.208 2.346 . 0 0 "[ . 1]" 1
2443 1 111 PHE HA 1 112 ALA MB 4.289 . 6.589 3.797 3.781 3.818 . 0 0 "[ . 1]" 1
2444 1 111 PHE HA 1 126 VAL QG 3.795 . 5.595 3.675 3.317 4.298 . 0 0 "[ . 1]" 1
2445 1 111 PHE HB2 1 111 PHE QD 2.714 . 3.635 2.368 2.341 2.390 . 0 0 "[ . 1]" 1
2446 1 111 PHE HB2 1 112 ALA H 2.938 . 4.017 2.897 2.682 3.043 . 0 0 "[ . 1]" 1
2447 1 111 PHE HB2 1 113 CYS H 4.502 . 7.035 6.457 6.325 6.660 . 0 0 "[ . 1]" 1
2448 1 111 PHE HB2 1 126 VAL QG 3.433 . 4.906 3.914 3.268 4.457 . 0 0 "[ . 1]" 1
2449 1 111 PHE HB3 1 111 PHE QD 2.632 . 3.498 2.405 2.383 2.429 . 0 0 "[ . 1]" 1
2450 1 111 PHE HB3 1 112 ALA H 3.127 . 4.350 4.097 3.975 4.158 . 0 0 "[ . 1]" 1
2451 1 111 PHE HB3 1 112 ALA MB 4.441 . 6.907 5.512 5.477 5.556 . 0 0 "[ . 1]" 1
2452 1 111 PHE HB3 1 126 VAL QG 3.207 . 4.492 2.595 1.911 3.207 0.060 4 0 "[ . 1]" 1
2453 1 111 PHE QD 1 112 ALA H 3.224 . 4.524 3.551 3.364 3.872 . 0 0 "[ . 1]" 1
2454 1 111 PHE QD 1 112 ALA HA 3.591 . 5.203 3.508 3.346 3.844 . 0 0 "[ . 1]" 1
2455 1 111 PHE QD 1 113 CYS H 4.839 . 7.766 5.259 5.069 5.419 . 0 0 "[ . 1]" 1
2456 1 111 PHE QD 1 123 ASN HA 3.778 . 5.562 4.361 3.995 4.854 . 0 0 "[ . 1]" 1
2457 1 111 PHE QD 1 124 GLY H 3.871 . 5.744 3.898 3.724 4.143 . 0 0 "[ . 1]" 1
2458 1 111 PHE QD 1 124 GLY HA3 3.758 . 5.524 3.964 3.867 4.038 . 0 0 "[ . 1]" 1
2459 1 111 PHE QD 1 125 LYS H 4.070 . 6.141 3.984 3.806 4.156 . 0 0 "[ . 1]" 1
2460 1 111 PHE QD 1 126 VAL H 3.910 . 5.821 3.523 3.149 3.780 . 0 0 "[ . 1]" 1
2461 1 111 PHE QD 1 126 VAL HB 3.671 . 5.355 2.929 2.183 4.374 . 0 0 "[ . 1]" 1
2462 1 111 PHE QD 1 126 VAL QG 2.405 . 3.128 2.621 1.884 3.258 0.130 3 0 "[ . 1]" 1
2463 1 111 PHE QE 1 124 GLY HA2 3.742 . 5.492 4.301 4.234 4.399 . 0 0 "[ . 1]" 1
2464 1 111 PHE QE 1 124 GLY HA3 3.609 . 5.237 2.899 2.779 2.984 . 0 0 "[ . 1]" 1
2465 1 111 PHE QE 1 125 LYS H 3.396 . 4.838 2.777 2.480 2.918 . 0 0 "[ . 1]" 1
2466 1 111 PHE HZ 1 112 ALA HA 4.345 . 6.705 6.465 6.283 6.771 0.066 9 0 "[ . 1]" 1
2467 1 111 PHE HZ 1 124 GLY HA2 3.596 . 5.212 4.712 4.543 4.856 . 0 0 "[ . 1]" 1
2468 1 111 PHE HZ 1 124 GLY HA3 3.056 . 4.224 3.018 2.868 3.129 . 0 0 "[ . 1]" 1
2469 1 111 PHE HZ 1 125 LYS H 4.001 . 6.002 4.286 4.015 4.573 . 0 0 "[ . 1]" 1
2470 1 112 ALA H 1 112 ALA MB 2.909 . 3.967 2.775 2.704 2.812 . 0 0 "[ . 1]" 1
2471 1 112 ALA H 1 113 CYS H 4.149 . 6.300 4.345 4.327 4.361 . 0 0 "[ . 1]" 1
2472 1 112 ALA H 1 113 CYS HB2 4.758 . 7.588 5.923 5.862 5.971 . 0 0 "[ . 1]" 1
2473 1 112 ALA H 1 124 GLY H 4.851 . 7.792 4.945 4.842 5.036 . 0 0 "[ . 1]" 1
2474 1 112 ALA H 1 126 VAL QG 4.273 . 6.555 5.379 4.948 5.982 . 0 0 "[ . 1]" 1
2475 1 112 ALA HA 1 112 ALA MB 2.743 . 3.683 2.128 2.125 2.130 . 0 0 "[ . 1]" 1
2476 1 112 ALA HA 1 113 CYS H 2.634 . 3.501 2.341 2.286 2.404 . 0 0 "[ . 1]" 1
2477 1 112 ALA HA 1 123 ASN H 3.995 . 5.990 4.624 4.529 4.807 . 0 0 "[ . 1]" 1
2478 1 112 ALA HA 1 123 ASN HA 2.838 . 3.845 2.205 2.126 2.546 . 0 0 "[ . 1]" 1
2479 1 112 ALA HA 1 123 ASN HB2 3.738 . 5.485 4.140 3.606 5.530 0.045 10 0 "[ . 1]" 1
2480 1 112 ALA HA 1 123 ASN HB3 3.659 . 5.333 3.708 3.337 4.879 . 0 0 "[ . 1]" 1
2481 1 112 ALA HA 1 124 GLY H 3.413 . 4.869 3.668 3.565 3.779 . 0 0 "[ . 1]" 1
2482 1 112 ALA MB 1 113 CYS H 2.553 . 3.368 2.348 2.244 2.460 . 0 0 "[ . 1]" 1
2483 1 112 ALA MB 1 113 CYS HA 3.939 . 5.878 4.088 4.056 4.124 . 0 0 "[ . 1]" 1
2484 1 112 ALA MB 1 113 CYS HB2 4.014 . 6.028 4.688 4.634 4.747 . 0 0 "[ . 1]" 1
2485 1 112 ALA MB 1 114 THR H 4.407 . 6.834 4.669 4.575 4.827 . 0 0 "[ . 1]" 1
2486 1 112 ALA MB 1 114 THR MG 3.503 . 5.037 3.393 3.281 3.492 . 0 0 "[ . 1]" 1
2487 1 112 ALA MB 1 119 GLY H 3.811 . 5.626 5.510 5.275 5.799 0.173 10 0 "[ . 1]" 1
2488 1 112 ALA MB 1 119 GLY HA2 3.353 . 4.758 3.163 3.010 3.413 . 0 0 "[ . 1]" 1
2489 1 112 ALA MB 1 119 GLY HA3 3.428 . 4.897 4.106 3.762 4.535 . 0 0 "[ . 1]" 1
2490 1 112 ALA MB 1 123 ASN HA 3.086 . 4.276 2.583 2.386 2.726 . 0 0 "[ . 1]" 1
2491 1 112 ALA MB 1 123 ASN HB2 3.398 . 4.841 2.771 2.183 4.321 . 0 0 "[ . 1]" 1
2492 1 112 ALA MB 1 123 ASN HB3 3.040 . 4.195 2.409 2.069 3.437 . 0 0 "[ . 1]" 1
2493 1 112 ALA MB 1 123 ASN HD22 3.986 . 5.972 5.025 3.813 5.501 . 0 0 "[ . 1]" 1
2494 1 112 ALA MB 1 124 GLY H 3.379 . 4.806 3.457 3.209 3.609 . 0 0 "[ . 1]" 1
2495 1 113 CYS H 1 113 CYS HB2 2.949 . 4.036 2.703 2.646 2.772 . 0 0 "[ . 1]" 1
2496 1 113 CYS H 1 113 CYS HB3 3.301 . 4.663 2.567 2.505 2.631 . 0 0 "[ . 1]" 1
2497 1 113 CYS H 1 113 CYS HB3 2.992 . 4.111 2.552 2.493 2.612 . 0 0 "[ . 1]" 1
2498 1 113 CYS H 1 114 THR H 3.951 . 5.902 4.426 4.381 4.460 . 0 0 "[ . 1]" 1
2499 1 113 CYS H 1 118 HIS QB 3.757 . 5.522 4.148 4.046 4.304 . 0 0 "[ . 1]" 1
2500 1 113 CYS H 1 119 GLY H 3.943 . 5.887 4.192 4.004 4.350 . 0 0 "[ . 1]" 1
2501 1 113 CYS H 1 119 GLY HA2 3.740 . 5.489 3.430 3.251 3.727 . 0 0 "[ . 1]" 1
2502 1 113 CYS H 1 119 GLY HA2 3.557 . 5.139 3.241 3.082 3.388 . 0 0 "[ . 1]" 1
2503 1 113 CYS H 1 119 GLY HA3 3.719 . 5.448 4.993 4.645 5.375 . 0 0 "[ . 1]" 1
2504 1 113 CYS H 1 122 MET HB2 3.624 . 5.266 3.277 2.730 4.631 . 0 0 "[ . 1]" 1
2505 1 113 CYS H 1 124 GLY H 3.605 . 5.230 5.768 5.639 5.870 0.640 1 7 "[+****-* 1]" 1
2506 1 113 CYS HA 1 114 THR H 2.501 . 3.283 2.191 2.165 2.209 . 0 0 "[ . 1]" 1
2507 1 113 CYS HA 1 114 THR MG 3.699 . 5.409 3.728 3.610 3.909 . 0 0 "[ . 1]" 1
2508 1 113 CYS HA 1 115 PHE H 3.765 . 5.536 3.687 3.610 3.728 . 0 0 "[ . 1]" 1
2509 1 113 CYS HB2 1 114 THR H 4.167 . 6.338 4.393 4.346 4.441 . 0 0 "[ . 1]" 1
2510 1 113 CYS HB2 1 118 HIS QB 4.049 . 5.762 3.764 3.590 3.885 . 0 0 "[ . 1]" 1
2511 1 113 CYS HB2 1 122 MET HB2 3.627 . 5.271 3.322 2.835 4.712 . 0 0 "[ . 1]" 1
2512 1 113 CYS HB2 1 122 MET HB3 3.466 . 4.967 2.874 2.395 3.299 . 0 0 "[ . 1]" 1
2513 1 113 CYS HB2 1 123 ASN HA 4.359 . 6.734 5.844 5.672 6.087 . 0 0 "[ . 1]" 1
2514 1 113 CYS HB3 1 114 THR H 3.582 . 5.186 4.197 4.127 4.235 . 0 0 "[ . 1]" 1
2515 1 113 CYS HB3 1 122 MET HB2 3.787 . 5.579 2.479 2.138 3.645 . 0 0 "[ . 1]" 1
2516 1 113 CYS HB3 1 122 MET HB3 3.601 . 5.222 2.908 2.340 3.427 . 0 0 "[ . 1]" 1
2517 1 114 THR H 1 114 THR HB 3.714 . 5.438 3.671 3.601 3.711 . 0 0 "[ . 1]" 1
2518 1 114 THR H 1 114 THR HG1 3.893 . 5.787 3.497 3.338 3.551 . 0 0 "[ . 1]" 1
2519 1 114 THR H 1 114 THR MG 2.844 . 3.855 2.584 2.525 2.668 . 0 0 "[ . 1]" 1
2520 1 114 THR H 1 115 PHE HB2 4.295 . 6.601 4.450 4.317 4.509 . 0 0 "[ . 1]" 1
2521 1 114 THR H 1 115 PHE HB3 3.923 . 5.847 5.112 4.925 5.198 . 0 0 "[ . 1]" 1
2522 1 114 THR HA 1 114 THR HB 2.893 . 3.939 2.497 2.485 2.555 . 0 0 "[ . 1]" 1
2523 1 114 THR HA 1 114 THR MG 2.911 . 3.970 2.315 2.263 2.338 . 0 0 "[ . 1]" 1
2524 1 114 THR HA 1 115 PHE H 3.614 . 5.247 3.143 3.087 3.206 . 0 0 "[ . 1]" 1
2525 1 114 THR HG1 1 114 THR MG 3.246 . 4.563 2.618 2.513 2.710 . 0 0 "[ . 1]" 1
2526 1 114 THR HG1 1 115 PHE H 4.876 . 7.848 4.664 4.563 4.844 . 0 0 "[ . 1]" 1
2527 1 114 THR MG 1 115 PHE H 3.956 . 5.912 4.312 4.283 4.351 . 0 0 "[ . 1]" 1
2528 1 115 PHE H 1 115 PHE HB2 2.908 . 3.965 2.418 2.373 2.445 . 0 0 "[ . 1]" 1
2529 1 115 PHE H 1 115 PHE HB3 2.859 . 3.881 2.636 2.613 2.663 . 0 0 "[ . 1]" 1
2530 1 115 PHE H 1 115 PHE QD 3.375 . 4.799 4.165 4.143 4.186 . 0 0 "[ . 1]" 1
2531 1 115 PHE H 1 116 PRO QD 4.370 . 6.416 4.323 4.253 4.371 . 0 0 "[ . 1]" 1
2532 1 115 PHE H 1 116 PRO QG 4.699 . 7.459 6.014 5.914 6.082 . 0 0 "[ . 1]" 1
2533 1 115 PHE H 1 117 GLY H 4.808 . 7.697 4.559 4.456 4.667 . 0 0 "[ . 1]" 1
2534 1 115 PHE H 1 118 HIS H 4.516 . 7.065 4.694 4.575 4.816 . 0 0 "[ . 1]" 1
2535 1 115 PHE H 1 118 HIS QB 3.962 . 5.924 2.993 2.883 3.094 . 0 0 "[ . 1]" 1
2536 1 115 PHE HA 1 115 PHE QD 2.957 . 4.050 2.963 2.888 3.099 . 0 0 "[ . 1]" 1
2537 1 115 PHE HA 1 116 PRO QD 2.820 . 3.814 1.912 1.882 1.939 . 0 0 "[ . 1]" 1
2538 1 115 PHE HA 1 116 PRO QG 3.489 . 5.010 3.826 3.795 3.853 . 0 0 "[ . 1]" 1
2539 1 115 PHE HA 1 117 GLY H 4.507 . 7.046 5.750 5.592 5.835 . 0 0 "[ . 1]" 1
2540 1 115 PHE HA 1 117 GLY H 4.408 . 6.837 4.373 4.293 4.469 . 0 0 "[ . 1]" 1
2541 1 115 PHE HB2 1 115 PHE QD 2.642 . 3.514 2.375 2.307 2.415 . 0 0 "[ . 1]" 1
2542 1 115 PHE HB2 1 115 PHE QE 3.268 . 4.603 4.398 4.376 4.415 . 0 0 "[ . 1]" 1
2543 1 115 PHE HB2 1 118 HIS HD2 4.727 . 7.520 5.772 5.596 5.928 . 0 0 "[ . 1]" 1
2544 1 115 PHE HB2 1 118 HIS HE1 4.037 . 6.074 4.846 4.552 5.062 . 0 0 "[ . 1]" 1
2545 1 115 PHE HB3 1 115 PHE QD 2.665 . 3.553 2.400 2.358 2.483 . 0 0 "[ . 1]" 1
2546 1 115 PHE HB3 1 116 PRO QD 4.154 . 6.311 3.910 3.818 4.050 . 0 0 "[ . 1]" 1
2547 1 115 PHE HB3 1 118 HIS HD2 4.503 . 7.038 4.098 3.931 4.250 . 0 0 "[ . 1]" 1
2548 1 115 PHE HB3 1 118 HIS HE1 3.831 . 5.666 4.167 3.922 4.329 . 0 0 "[ . 1]" 1
2549 1 115 PHE QD 1 116 PRO QD 3.405 . 4.672 3.027 2.927 3.225 . 0 0 "[ . 1]" 1
2550 1 115 PHE QD 1 116 PRO QG 3.455 . 4.947 4.561 4.454 4.759 . 0 0 "[ . 1]" 1
2551 1 115 PHE QD 1 118 HIS H 3.745 . 5.498 3.433 3.072 3.654 . 0 0 "[ . 1]" 1
2552 1 115 PHE QD 1 118 HIS QB 3.975 . 5.950 3.244 3.074 3.514 . 0 0 "[ . 1]" 1
2553 1 115 PHE QD 1 118 HIS HD2 3.025 . 4.169 2.921 2.688 3.206 . 0 0 "[ . 1]" 1
2554 1 115 PHE QD 1 118 HIS HE1 3.137 . 4.367 4.004 3.707 4.202 . 0 0 "[ . 1]" 1
2555 1 115 PHE QD 1 118 HIS HE2 3.780 . 5.566 3.281 3.149 3.497 . 0 0 "[ . 1]" 1
2556 1 115 PHE QE 1 118 HIS HE1 5.396 . 9.036 4.600 4.360 4.786 . 0 0 "[ . 1]" 1
2557 1 115 PHE QE 1 118 HIS HE2 3.841 . 5.686 3.398 3.220 3.632 . 0 0 "[ . 1]" 1
2558 1 116 PRO HA 1 116 PRO HB3 2.880 . 3.917 2.303 2.294 2.311 . 0 0 "[ . 1]" 1
2559 1 116 PRO HA 1 117 GLY H 2.395 . 3.112 2.148 2.135 2.176 . 0 0 "[ . 1]" 1
2560 1 116 PRO HA 1 119 GLY H 4.478 . 6.984 4.406 4.179 4.588 . 0 0 "[ . 1]" 1
2561 1 116 PRO HB2 1 116 PRO QD 3.697 . 5.405 2.881 2.864 2.904 . 0 0 "[ . 1]" 1
2562 1 116 PRO HB2 1 117 GLY H 3.247 . 4.565 3.896 3.858 3.951 . 0 0 "[ . 1]" 1
2563 1 116 PRO HB2 1 117 GLY H 3.839 . 5.682 4.135 4.072 4.216 . 0 0 "[ . 1]" 1
2564 1 116 PRO HB3 1 116 PRO QD 3.530 . 5.088 3.542 3.541 3.544 . 0 0 "[ . 1]" 1
2565 1 116 PRO HB3 1 117 GLY H 3.328 . 4.712 3.830 3.770 3.940 . 0 0 "[ . 1]" 1
2566 1 116 PRO QD 1 116 PRO QG 2.768 . 3.725 1.969 1.968 1.971 . 0 0 "[ . 1]" 1
2567 1 116 PRO QD 1 118 HIS QB 4.437 . 6.898 4.826 4.657 5.055 . 0 0 "[ . 1]" 1
2568 1 117 GLY H 1 117 GLY HA2 2.693 . 3.599 2.388 2.346 2.409 . 0 0 "[ . 1]" 1
2569 1 117 GLY H 1 117 GLY HA2 2.782 . 3.749 2.341 2.294 2.366 . 0 0 "[ . 1]" 1
2570 1 117 GLY H 1 117 GLY HA3 2.869 . 3.898 2.938 2.913 2.948 . 0 0 "[ . 1]" 1
2571 1 117 GLY H 1 120 ALA H 4.391 . 6.801 3.911 3.676 4.166 . 0 0 "[ . 1]" 1
2572 1 117 GLY H 1 119 GLY H 4.056 . 6.113 3.239 2.995 3.338 . 0 0 "[ . 1]" 1
2573 1 117 GLY HA2 1 118 HIS HD2 4.116 . 6.234 3.173 3.110 3.238 . 0 0 "[ . 1]" 1
2574 1 117 GLY HA2 1 118 HIS HD2 3.607 . 5.233 4.582 4.333 4.897 . 0 0 "[ . 1]" 1
2575 1 117 GLY HA3 1 118 HIS H 3.392 . 4.830 3.139 2.931 3.316 . 0 0 "[ . 1]" 1
2576 1 117 GLY HA3 1 118 HIS HD2 3.503 . 5.037 3.373 3.144 3.630 . 0 0 "[ . 1]" 1
2577 1 117 GLY HA3 1 120 ALA H 4.784 . 7.645 5.615 5.240 6.044 . 0 0 "[ . 1]" 1
2578 1 118 HIS H 1 118 HIS QB 2.737 . 3.673 2.337 2.267 2.407 . 0 0 "[ . 1]" 1
2579 1 118 HIS H 1 118 HIS HD2 3.233 . 4.539 3.076 2.792 3.309 . 0 0 "[ . 1]" 1
2580 1 118 HIS H 1 119 GLY H 2.893 . 3.939 2.239 2.082 2.419 . 0 0 "[ . 1]" 1
2581 1 118 HIS HA 1 118 HIS HD2 2.542 . 3.349 2.687 2.565 2.794 . 0 0 "[ . 1]" 1
2582 1 118 HIS QB 1 118 HIS HD2 3.469 . 4.973 3.237 3.187 3.286 . 0 0 "[ . 1]" 1
2583 1 118 HIS QB 1 119 GLY H 4.066 . 5.029 2.872 2.578 3.141 . 0 0 "[ . 1]" 1
2584 1 118 HIS QB 1 120 ALA H 4.352 . 6.720 4.725 4.445 5.066 . 0 0 "[ . 1]" 1
2585 1 118 HIS QB 1 121 LEU H 4.175 . 6.353 4.727 4.496 4.928 . 0 0 "[ . 1]" 1
2586 1 118 HIS QB 1 122 MET H 3.633 . 5.283 4.027 3.800 4.298 . 0 0 "[ . 1]" 1
2587 1 118 HIS HD2 1 119 GLY H 4.593 . 7.230 4.941 4.860 5.020 . 0 0 "[ . 1]" 1
2588 1 118 HIS HD2 1 122 MET ME 2.968 . 4.069 3.342 3.192 3.491 . 0 0 "[ . 1]" 1
2589 1 118 HIS HE1 1 122 MET ME 3.885 . 5.772 3.494 3.174 3.852 . 0 0 "[ . 1]" 1
2590 1 118 HIS HE2 1 122 MET ME 3.901 . 5.803 3.827 3.331 4.136 . 0 0 "[ . 1]" 1
2591 1 119 GLY H 1 119 GLY HA2 2.850 . 3.865 2.798 2.765 2.835 . 0 0 "[ . 1]" 1
2592 1 119 GLY H 1 119 GLY HA3 2.635 . 3.503 2.291 2.288 2.297 . 0 0 "[ . 1]" 1
2593 1 119 GLY H 1 120 ALA H 3.389 . 4.824 2.787 2.681 2.932 . 0 0 "[ . 1]" 1
2594 1 119 GLY H 1 120 ALA MB 4.120 . 6.242 4.449 4.356 4.612 . 0 0 "[ . 1]" 1
2595 1 119 GLY H 1 122 MET H 4.443 . 6.911 4.775 4.618 5.093 . 0 0 "[ . 1]" 1
2596 1 119 GLY HA2 1 120 ALA H 4.280 . 6.570 3.480 3.418 3.563 . 0 0 "[ . 1]" 1
2597 1 119 GLY HA2 1 123 ASN HD22 3.223 . 4.522 3.554 2.864 4.546 0.024 5 0 "[ . 1]" 1
2598 1 119 GLY HA2 1 120 ALA MB 4.389 . 6.797 4.984 4.948 5.033 . 0 0 "[ . 1]" 1
2599 1 119 GLY HA2 1 122 MET H 3.291 . 4.645 3.628 3.287 4.040 . 0 0 "[ . 1]" 1
2600 1 119 GLY HA2 1 123 ASN HD21 3.254 . 4.577 4.226 3.745 5.087 0.510 5 1 "[ + 1]" 1
2601 1 119 GLY HA3 1 120 ALA H 3.390 . 4.826 3.000 2.755 3.143 . 0 0 "[ . 1]" 1
2602 1 119 GLY HA3 1 120 ALA MB 4.297 . 6.605 4.442 4.276 4.578 . 0 0 "[ . 1]" 1
2603 1 119 GLY HA3 1 121 LEU H 4.049 . 6.098 4.581 4.361 4.846 . 0 0 "[ . 1]" 1
2604 1 119 GLY HA3 1 122 MET H 3.970 . 5.940 4.893 4.611 5.407 . 0 0 "[ . 1]" 1
2605 1 120 ALA H 1 120 ALA HA 2.742 . 3.682 2.853 2.813 2.896 . 0 0 "[ . 1]" 1
2606 1 120 ALA H 1 120 ALA MB 2.361 . 3.058 2.254 2.227 2.287 . 0 0 "[ . 1]" 1
2607 1 120 ALA H 1 121 LEU H 2.865 . 3.891 2.512 2.353 2.638 . 0 0 "[ . 1]" 1
2608 1 120 ALA H 1 121 LEU HA 4.084 . 6.169 5.152 4.984 5.272 . 0 0 "[ . 1]" 1
2609 1 120 ALA H 1 121 LEU HB3 3.758 . 5.523 5.083 4.547 6.193 0.670 7 1 "[ . + 1]" 1
2610 1 120 ALA H 1 121 LEU QD 4.064 . 6.129 5.199 4.239 5.677 . 0 0 "[ . 1]" 1
2611 1 120 ALA H 1 122 MET H 3.687 . 5.386 3.984 3.611 4.243 . 0 0 "[ . 1]" 1
2612 1 120 ALA HA 1 121 LEU H 3.270 . 4.607 3.450 3.358 3.507 . 0 0 "[ . 1]" 1
2613 1 120 ALA MB 1 121 LEU H 2.732 . 3.665 2.899 2.706 3.118 . 0 0 "[ . 1]" 1
2614 1 120 ALA MB 1 121 LEU HB2 4.021 . 6.042 4.037 3.621 4.870 . 0 0 "[ . 1]" 1
2615 1 120 ALA MB 1 121 LEU HB3 3.972 . 5.944 3.231 2.538 3.714 . 0 0 "[ . 1]" 1
2616 1 120 ALA MB 1 123 ASN HD21 3.766 . 5.539 4.513 4.261 5.178 . 0 0 "[ . 1]" 1
2617 1 120 ALA MB 1 123 ASN HD22 3.817 . 5.638 4.565 4.107 5.275 . 0 0 "[ . 1]" 1
2618 1 121 LEU H 1 121 LEU HA 2.931 . 4.005 2.940 2.923 2.949 . 0 0 "[ . 1]" 1
2619 1 121 LEU H 1 121 LEU HB2 3.318 . 4.694 2.959 2.525 3.764 . 0 0 "[ . 1]" 1
2620 1 121 LEU H 1 121 LEU HB3 3.298 . 4.658 2.844 2.401 3.716 . 0 0 "[ . 1]" 1
2621 1 121 LEU H 1 121 LEU QD 3.891 . 4.340 3.662 2.972 3.939 . 0 0 "[ . 1]" 1
2622 1 121 LEU H 1 122 MET H 2.412 . 3.139 2.079 1.899 2.234 . 0 0 "[ . 1]" 1
2623 1 121 LEU H 1 122 MET HA 4.094 . 6.189 4.785 4.576 4.926 . 0 0 "[ . 1]" 1
2624 1 121 LEU HA 1 121 LEU HB2 2.817 . 3.809 2.568 2.396 3.023 . 0 0 "[ . 1]" 1
2625 1 121 LEU HA 1 121 LEU QD 2.583 . 3.417 2.255 2.009 3.424 0.007 5 0 "[ . 1]" 1
2626 1 121 LEU HA 1 121 LEU HG 3.002 . 4.128 3.228 3.041 3.703 . 0 0 "[ . 1]" 1
2627 1 121 LEU HA 1 122 MET H 3.374 . 4.797 3.496 3.302 3.564 . 0 0 "[ . 1]" 1
2628 1 121 LEU HA 1 123 ASN HD21 4.009 . 6.018 4.002 3.600 4.622 . 0 0 "[ . 1]" 1
2629 1 121 LEU HA 1 123 ASN HD22 3.687 . 5.386 3.782 3.230 4.680 . 0 0 "[ . 1]" 1
2630 1 121 LEU HB2 1 121 LEU QD 2.733 . 3.667 2.179 2.111 2.444 . 0 0 "[ . 1]" 1
2631 1 121 LEU HB2 1 122 MET H 3.902 . 5.806 3.733 2.406 4.183 . 0 0 "[ . 1]" 1
2632 1 121 LEU HB3 1 121 LEU QD 2.967 . 4.068 2.196 2.106 2.262 . 0 0 "[ . 1]" 1
2633 1 121 LEU HB3 1 122 MET H 3.841 . 5.685 3.076 2.504 4.390 . 0 0 "[ . 1]" 1
2634 1 121 LEU HB3 1 122 MET H 2.707 . 3.623 2.769 2.465 3.425 . 0 0 "[ . 1]" 1
2635 1 121 LEU HB3 1 123 ASN HD21 3.820 . 5.644 5.063 4.776 5.830 0.186 5 0 "[ . 1]" 1
2636 1 121 LEU QD 1 122 MET H 3.621 . 5.260 3.797 2.969 4.285 . 0 0 "[ . 1]" 1
2637 1 121 LEU QD 1 122 MET HA 3.544 . 5.114 4.120 2.834 5.312 0.198 7 0 "[ . 1]" 1
2638 1 121 LEU QD 1 122 MET QG 3.110 . 4.319 3.391 2.673 4.422 0.103 7 0 "[ . 1]" 1
2639 1 121 LEU QD 1 123 ASN H 4.273 . 6.555 4.838 3.630 5.948 . 0 0 "[ . 1]" 1
2640 1 122 MET H 1 122 MET HB2 3.335 . 4.726 2.446 2.120 2.653 . 0 0 "[ . 1]" 1
2641 1 122 MET H 1 122 MET QG 3.141 . 4.374 2.905 2.192 4.016 . 0 0 "[ . 1]" 1
2642 1 122 MET H 1 123 ASN H 3.561 . 5.146 3.794 3.526 4.114 . 0 0 "[ . 1]" 1
2643 1 122 MET H 1 123 ASN HD21 4.075 . 6.151 3.617 3.182 4.533 . 0 0 "[ . 1]" 1
2644 1 122 MET H 1 123 ASN HD22 4.258 . 6.525 4.612 3.940 5.056 . 0 0 "[ . 1]" 1
2645 1 122 MET HA 1 122 MET QG 3.114 . 4.326 2.365 2.221 2.531 . 0 0 "[ . 1]" 1
2646 1 122 MET HA 1 123 ASN H 2.403 . 3.125 2.325 2.206 2.400 . 0 0 "[ . 1]" 1
2647 1 122 MET HB3 1 122 MET QG 3.274 . 4.614 2.275 2.153 2.386 . 0 0 "[ . 1]" 1
2648 1 122 MET HB3 1 123 ASN H 3.476 . 4.987 4.178 3.960 4.316 . 0 0 "[ . 1]" 1
2649 1 122 MET QG 1 123 ASN H 3.655 . 5.324 4.338 4.034 4.504 . 0 0 "[ . 1]" 1
2650 1 123 ASN H 1 123 ASN HB2 3.651 . 5.317 3.823 2.778 3.995 . 0 0 "[ . 1]" 1
2651 1 123 ASN H 1 123 ASN HB3 3.302 . 4.665 3.458 3.318 3.851 . 0 0 "[ . 1]" 1
2652 1 123 ASN H 1 123 ASN HD22 3.582 . 5.186 3.923 3.737 4.513 . 0 0 "[ . 1]" 1
2653 1 123 ASN H 1 124 GLY H 3.693 . 5.398 4.323 4.272 4.402 . 0 0 "[ . 1]" 1
2654 1 123 ASN HA 1 123 ASN HB2 2.898 . 3.947 2.530 2.399 3.031 . 0 0 "[ . 1]" 1
2655 1 123 ASN HA 1 123 ASN HB3 2.907 . 3.964 2.456 2.401 2.535 . 0 0 "[ . 1]" 1
2656 1 123 ASN HA 1 123 ASN HD21 3.988 . 5.976 4.080 3.868 4.507 . 0 0 "[ . 1]" 1
2657 1 123 ASN HA 1 123 ASN HD22 4.326 . 6.665 5.060 4.338 5.342 . 0 0 "[ . 1]" 1
2658 1 123 ASN HA 1 124 GLY H 2.571 . 3.397 2.278 2.208 2.432 . 0 0 "[ . 1]" 1
2659 1 123 ASN HA 1 124 GLY HA2 4.568 . 7.177 4.478 4.439 4.557 . 0 0 "[ . 1]" 1
2660 1 123 ASN HB2 1 123 ASN HD21 3.174 . 4.433 3.274 2.240 3.458 . 0 0 "[ . 1]" 1
2661 1 123 ASN HB2 1 124 GLY H 2.807 . 3.792 2.824 2.380 3.996 0.204 10 0 "[ . 1]" 1
2662 1 123 ASN HB3 1 123 ASN HD21 2.885 . 3.925 2.341 2.195 3.465 . 0 0 "[ . 1]" 1
2663 1 123 ASN HB3 1 123 ASN HD22 2.961 . 4.057 3.531 3.465 4.047 . 0 0 "[ . 1]" 1
2664 1 123 ASN HB3 1 124 GLY H 2.742 . 3.682 3.788 2.876 4.043 0.361 7 0 "[ . 1]" 1
2665 1 123 ASN HD21 1 124 GLY H 4.297 . 6.605 5.532 5.283 5.649 . 0 0 "[ . 1]" 1
2666 1 123 ASN HD22 1 124 GLY H 4.535 . 7.105 6.090 5.811 6.225 . 0 0 "[ . 1]" 1
2667 1 124 GLY HA2 1 125 LYS H 2.773 . 3.734 2.716 2.598 2.915 . 0 0 "[ . 1]" 1
2668 1 124 GLY HA3 1 125 LYS H 2.755 . 3.704 2.441 2.233 2.577 . 0 0 "[ . 1]" 1
2669 1 125 LYS H 1 125 LYS QB 2.734 . 3.668 2.432 2.344 2.490 . 0 0 "[ . 1]" 1
2670 1 125 LYS H 1 126 VAL H 4.332 . 6.678 4.457 4.392 4.503 . 0 0 "[ . 1]" 1
2671 1 125 LYS QB 1 126 VAL H 3.263 . 4.594 3.287 2.897 3.746 . 0 0 "[ . 1]" 1
2672 1 126 VAL H 1 126 VAL HB 2.622 . 3.481 3.025 2.513 3.342 . 0 0 "[ . 1]" 1
2673 1 126 VAL H 1 126 VAL QG 3.108 . 3.583 2.266 1.990 2.672 . 0 0 "[ . 1]" 1
2674 1 126 VAL H 1 127 THR H 3.612 . 5.242 4.239 4.101 4.375 . 0 0 "[ . 1]" 1
2675 1 126 VAL H 1 127 THR MG 4.183 . 6.370 5.855 5.665 6.111 . 0 0 "[ . 1]" 1
2676 1 126 VAL HA 1 126 VAL QG 3.169 . 4.424 2.295 2.132 2.391 . 0 0 "[ . 1]" 1
2677 1 126 VAL HB 1 127 THR H 3.572 . 5.167 4.242 4.150 4.379 . 0 0 "[ . 1]" 1
2678 1 126 VAL MG1 1 126 VAL MG2 2.251 . 2.884 2.079 2.073 2.083 . 0 0 "[ . 1]" 1
2679 1 126 VAL QG 1 127 THR H 2.673 . 3.566 2.828 2.686 3.054 . 0 0 "[ . 1]" 1
2680 1 126 VAL QG 1 127 THR HA 4.133 . 6.268 3.705 3.553 3.960 . 0 0 "[ . 1]" 1
2681 1 127 THR H 1 127 THR HA 2.885 . 3.925 2.942 2.920 2.952 . 0 0 "[ . 1]" 1
2682 1 127 THR H 1 127 THR HB 2.756 . 3.705 2.652 2.597 2.736 . 0 0 "[ . 1]" 1
2683 1 127 THR H 1 127 THR MG 3.129 . 4.353 3.855 3.812 3.898 . 0 0 "[ . 1]" 1
2684 1 127 THR HA 1 128 LEU H 2.191 . 2.791 2.169 2.135 2.200 . 0 0 "[ . 1]" 1
2685 1 127 THR HB 1 127 THR MG 2.398 . 3.117 2.135 2.133 2.137 . 0 0 "[ . 1]" 1
2686 1 127 THR HB 1 128 LEU H 3.380 . 4.808 4.048 3.916 4.284 . 0 0 "[ . 1]" 1
2687 1 127 THR HB 1 129 VAL MG1 3.455 . 4.947 3.049 2.748 3.409 . 0 0 "[ . 1]" 1
2688 1 127 THR MG 1 128 LEU H 2.678 . 3.575 2.582 2.393 3.092 . 0 0 "[ . 1]" 1
2689 1 127 THR MG 1 128 LEU HA 3.911 . 5.823 4.015 3.941 4.161 . 0 0 "[ . 1]" 1
2690 1 127 THR MG 1 128 LEU QD 3.197 . 4.475 4.566 3.958 4.906 0.431 2 0 "[ . 1]" 1
2691 1 127 THR MG 1 129 VAL H 3.940 . 5.881 4.354 4.145 4.660 . 0 0 "[ . 1]" 1
2692 1 127 THR MG 1 129 VAL HA 3.662 . 5.338 3.882 3.704 4.132 . 0 0 "[ . 1]" 1
2693 1 128 LEU H 1 128 LEU HA 2.901 . 3.953 2.888 2.870 2.911 . 0 0 "[ . 1]" 1
2694 1 128 LEU H 1 128 LEU QB 2.486 . 3.259 2.261 2.237 2.315 . 0 0 "[ . 1]" 1
2695 1 128 LEU H 1 128 LEU QD 3.486 . 4.071 3.606 2.466 3.757 . 0 0 "[ . 1]" 1
2696 1 128 LEU HA 1 128 LEU QB 2.968 . 4.069 2.398 2.366 2.473 . 0 0 "[ . 1]" 1
2697 1 128 LEU HA 1 128 LEU QD 2.711 . 3.630 2.090 1.881 2.201 . 0 0 "[ . 1]" 1
2698 1 128 LEU HA 1 129 VAL H 2.181 . 2.776 2.148 2.114 2.174 . 0 0 "[ . 1]" 1
2699 1 128 LEU HA 1 129 VAL MG2 3.037 . 4.190 3.735 3.598 3.857 . 0 0 "[ . 1]" 1
2700 1 128 LEU QB 1 128 LEU QD 2.620 . 3.312 1.949 1.905 2.057 . 0 0 "[ . 1]" 1
2701 1 128 LEU QB 1 129 VAL H 3.621 . 4.108 3.757 3.389 3.884 . 0 0 "[ . 1]" 1
2702 1 128 LEU QD 1 129 VAL H 3.550 . 5.125 2.734 2.539 3.249 . 0 0 "[ . 1]" 1
2703 1 128 LEU QD 1 130 ASP HA 3.594 . 5.209 4.928 4.115 5.679 0.470 3 0 "[ . 1]" 1
2704 1 129 VAL H 1 129 VAL HA 2.896 . 3.944 2.947 2.944 2.951 . 0 0 "[ . 1]" 1
2705 1 129 VAL H 1 129 VAL HB 3.318 . 4.694 3.791 3.766 3.817 . 0 0 "[ . 1]" 1
2706 1 129 VAL H 1 129 VAL MG1 2.651 . 3.530 2.798 2.637 2.940 . 0 0 "[ . 1]" 1
2707 1 129 VAL H 1 129 VAL MG2 2.422 . 3.155 2.128 2.091 2.165 . 0 0 "[ . 1]" 1
2708 1 129 VAL H 1 130 ASP H 3.619 . 5.256 4.466 4.423 4.494 . 0 0 "[ . 1]" 1
2709 1 129 VAL H 1 130 ASP HA 4.305 . 6.621 5.044 4.907 5.324 . 0 0 "[ . 1]" 1
2710 1 129 VAL HA 1 129 VAL HB 2.401 . 3.122 2.451 2.429 2.475 . 0 0 "[ . 1]" 1
2711 1 129 VAL HA 1 129 VAL MG1 2.403 . 3.125 2.358 2.320 2.394 . 0 0 "[ . 1]" 1
2712 1 129 VAL HA 1 129 VAL MG2 2.840 . 3.848 3.212 3.206 3.216 . 0 0 "[ . 1]" 1
2713 1 129 VAL HA 1 130 ASP H 2.289 . 2.944 2.382 2.293 2.545 . 0 0 "[ . 1]" 1
2714 1 129 VAL HB 1 129 VAL MG1 2.475 . 3.240 2.128 2.125 2.130 . 0 0 "[ . 1]" 1
2715 1 129 VAL HB 1 130 ASP H 2.175 . 2.766 2.373 2.082 2.541 . 0 0 "[ . 1]" 1
2716 1 129 VAL MG1 1 130 ASP H 2.731 . 3.663 3.649 3.565 3.720 0.057 3 0 "[ . 1]" 1
2717 1 129 VAL MG2 1 130 ASP H 2.743 . 3.684 3.364 3.088 3.550 . 0 0 "[ . 1]" 1
2718 1 130 ASP H 1 130 ASP HA 2.578 . 3.409 2.909 2.788 2.946 . 0 0 "[ . 1]" 1
2719 1 130 ASP H 1 130 ASP HB2 2.756 . 3.706 3.117 2.358 3.814 0.108 9 0 "[ . 1]" 1
2720 1 130 ASP H 1 130 ASP HB3 2.462 . 3.220 2.863 2.512 3.598 0.378 5 0 "[ . 1]" 1
2721 1 130 ASP HA 1 130 ASP HB2 2.519 . 3.312 2.563 2.385 3.024 . 0 0 "[ . 1]" 1
2722 1 130 ASP HA 1 130 ASP HB3 2.752 . 3.699 2.766 2.431 3.033 . 0 0 "[ . 1]" 1
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