NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
572650 |
2mgr   |
19234 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mgr
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 1741
_Distance_constraint_stats_list.Viol_count 4017
_Distance_constraint_stats_list.Viol_total 9545.109
_Distance_constraint_stats_list.Viol_max 1.378
_Distance_constraint_stats_list.Viol_rms 0.0615
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0137
_Distance_constraint_stats_list.Viol_average_violations_only 0.1188
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 GLY 9.984 0.778 13 6 "[ * .* * *+ . - 2]"
1 2 VAL 25.299 0.949 1 15 "[+***.* *** ***-** *]"
1 3 ASP 25.002 0.949 1 11 "[+***. *** *-* *]"
1 4 PRO 20.903 1.378 11 1 "[ . 1+ . 2]"
1 5 LYS 8.040 0.375 14 0 "[ . 1 . 2]"
1 6 HIS 12.143 0.356 9 0 "[ . 1 . 2]"
1 7 VAL 6.595 0.637 20 1 "[ . 1 . +]"
1 8 CYS 8.057 0.637 20 1 "[ . 1 . +]"
1 9 VAL 3.659 0.541 8 1 "[ . + 1 . 2]"
1 10 ASP 5.252 0.634 12 1 "[ . 1 + . 2]"
1 11 THR 6.911 0.634 12 1 "[ . 1 + . 2]"
1 12 ARG 15.392 0.903 8 9 "[ . + *** ***- *]"
1 13 ASP 4.959 0.754 8 5 "[ . + 1** . - *]"
1 14 ILE 8.371 0.287 8 0 "[ . 1 . 2]"
1 15 PRO 9.620 0.634 13 3 "[ . 1 *+ . - 2]"
1 16 LYS 18.444 0.647 5 4 "[ + 1 ** - 2]"
1 17 ASN 6.389 0.969 18 4 "[ * 1 - *. + 2]"
1 18 ALA 5.787 0.187 18 0 "[ . 1 . 2]"
1 19 GLY 0.800 0.060 15 0 "[ . 1 . 2]"
1 20 CYS 3.042 0.118 14 0 "[ . 1 . 2]"
1 21 PHE 15.907 0.918 12 1 "[ . 1 + . 2]"
1 22 ARG 13.011 0.957 6 2 "[ .+ - 1 . 2]"
1 23 ASP 3.260 0.215 9 0 "[ . 1 . 2]"
1 24 ASP 1.651 0.359 5 0 "[ . 1 . 2]"
1 25 ASP 0.505 0.465 20 0 "[ . 1 . 2]"
1 26 GLY 0.721 0.141 8 0 "[ . 1 . 2]"
1 27 THR 5.911 0.215 9 0 "[ . 1 . 2]"
1 28 LYS 7.737 0.778 8 1 "[ . + 1 . 2]"
1 29 GLU 11.143 0.285 5 0 "[ . 1 . 2]"
1 30 TRP 15.787 0.293 13 0 "[ . 1 . 2]"
1 31 ARG 10.970 0.231 20 0 "[ . 1 . 2]"
1 32 CYS 8.208 0.573 4 1 "[ +. 1 . 2]"
1 33 LEU 4.056 0.181 18 0 "[ . 1 . 2]"
1 34 LEU 10.822 0.197 10 0 "[ . 1 . 2]"
1 35 GLY 1.941 0.129 5 0 "[ . 1 . 2]"
1 36 TYR 9.519 0.376 12 0 "[ . 1 . 2]"
1 37 LYS 9.351 0.954 12 2 "[ . 1 + . - 2]"
1 38 LYS 18.384 0.573 4 1 "[ +. 1 . 2]"
1 39 GLY 3.047 0.223 18 0 "[ . 1 . 2]"
1 40 GLU 1.731 0.168 3 0 "[ . 1 . 2]"
1 41 GLY 7.395 0.419 8 0 "[ . 1 . 2]"
1 42 ASN 13.617 0.634 13 2 "[ . 1 -+ . 2]"
1 43 THR 11.101 0.216 3 0 "[ . 1 . 2]"
1 44 CYS 9.028 0.969 18 2 "[ . 1 - . + 2]"
1 45 VAL 6.676 0.408 12 0 "[ . 1 . 2]"
1 46 GLU 4.519 0.594 18 1 "[ . 1 . + 2]"
1 47 ASN 6.201 0.267 12 0 "[ . 1 . 2]"
1 48 ASN 2.853 0.490 17 0 "[ . 1 . 2]"
1 49 ASN 8.101 0.434 16 0 "[ . 1 . 2]"
1 50 PRO 5.606 0.842 17 2 "[ . 1 . + *]"
1 51 THR 4.413 0.680 11 2 "[ -. 1+ . 2]"
1 52 CYS 2.244 0.268 14 0 "[ . 1 . 2]"
1 53 ASP 4.624 0.264 13 0 "[ . 1 . 2]"
1 54 ILE 7.559 0.264 13 0 "[ . 1 . 2]"
1 55 ASN 2.874 0.155 18 0 "[ . 1 . 2]"
1 56 ASN 10.795 0.474 10 0 "[ . 1 . 2]"
1 57 GLY 4.077 0.680 11 2 "[ -. 1+ . 2]"
1 58 GLY 0.186 0.046 19 0 "[ . 1 . 2]"
1 59 CYS 9.902 0.953 10 2 "[ . + . -]"
1 60 ASP 5.076 0.213 13 0 "[ . 1 . 2]"
1 61 PRO 14.806 0.393 3 0 "[ . 1 . 2]"
1 62 THR 0.232 0.052 7 0 "[ . 1 . 2]"
1 63 ALA 16.686 0.810 10 1 "[ . + . 2]"
1 64 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 CYS 10.588 0.953 10 4 "[ . + -.* *]"
1 66 GLN 8.808 0.413 5 0 "[ . 1 . 2]"
1 67 ASN 8.603 0.627 17 4 "[ -. * 1 *. + 2]"
1 68 ALA 2.064 0.195 17 0 "[ . 1 . 2]"
1 69 GLU 7.601 0.916 16 3 "[ .* 1- .+ 2]"
1 70 SER 7.103 0.877 19 1 "[ . 1 . +2]"
1 71 THR 1.281 0.122 15 0 "[ . 1 . 2]"
1 72 GLU 12.149 0.798 17 2 "[ . - . + 2]"
1 73 ASN 12.191 0.594 18 1 "[ . 1 . + 2]"
1 74 SER 5.469 0.305 13 0 "[ . 1 . 2]"
1 75 LYS 9.045 0.798 17 2 "[ . - . + 2]"
1 76 LYS 18.070 0.877 19 3 "[ . 1 . - +*]"
1 77 ILE 12.321 0.835 19 2 "[ . 1 . - +2]"
1 78 ILE 7.565 0.255 15 0 "[ . 1 . 2]"
1 79 CYS 11.420 0.603 16 6 "[ *. * 1 -.+* *]"
1 80 THR 10.039 0.504 20 2 "[ -. 1 . +]"
1 81 CYS 4.012 0.462 9 0 "[ . 1 . 2]"
1 82 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 GLU 0.540 0.245 6 0 "[ . 1 . 2]"
1 84 PRO 5.840 0.558 6 2 "[ -+ 1 . 2]"
1 85 THR 5.978 0.299 5 0 "[ . 1 . 2]"
1 86 PRO 30.020 0.905 9 16 "[**-*****+*****. * *]"
1 87 ASN 24.973 0.842 8 14 "[* ****-+*1****. * *]"
1 88 ALA 2.209 0.462 9 0 "[ . 1 . 2]"
1 89 TYR 6.634 0.286 14 0 "[ . 1 . 2]"
1 90 TYR 2.737 0.206 3 0 "[ . 1 . 2]"
1 91 GLU 6.974 0.237 3 0 "[ . 1 . 2]"
1 92 GLY 5.224 0.598 17 2 "[ . - 1 . + 2]"
1 93 VAL 9.248 0.227 18 0 "[ . 1 . 2]"
1 94 PHE 16.490 0.918 12 1 "[ . 1 + . 2]"
1 95 CYS 3.923 0.299 5 0 "[ . 1 . 2]"
1 96 SER 9.934 0.391 20 0 "[ . 1 . 2]"
1 97 SER 2.372 0.216 20 0 "[ . 1 . 2]"
1 98 SER 13.305 1.378 11 9 "[** * *+* .*- *]"
1 99 SER 2.635 0.504 18 1 "[ . 1 . + 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 GLY H1 1 1 GLY HA3 2.287 . 2.941 2.661 2.369 2.973 0.032 20 0 "[ . 1 . 2]" 1
2 1 1 GLY HA3 1 2 VAL H 2.174 . 2.765 2.794 2.115 3.543 0.778 13 6 "[ * .* * *+ . - 2]" 1
3 1 1 GLY HA3 1 2 VAL HB 3.280 . 6.000 5.322 4.304 6.045 0.045 13 0 "[ . 1 . 2]" 1
4 1 1 GLY HA3 1 2 VAL QG 2.868 . 3.896 3.925 3.189 4.563 0.667 12 2 "[ . 1 +- . 2]" 1
5 1 2 VAL H 1 2 VAL HA 2.695 . 3.603 2.914 2.824 2.946 . 0 0 "[ . 1 . 2]" 1
6 1 2 VAL H 1 2 VAL HB 2.277 . 2.925 2.721 2.576 2.965 0.040 16 0 "[ . 1 . 2]" 1
7 1 2 VAL H 1 2 VAL QG 2.145 . 2.720 2.208 1.825 2.721 0.001 10 0 "[ . 1 . 2]" 1
8 1 2 VAL H 1 3 ASP H 3.148 . 4.387 4.441 4.285 4.525 0.138 8 0 "[ . 1 . 2]" 1
9 1 2 VAL HA 1 2 VAL HB 2.302 . 2.964 2.934 2.406 3.027 0.063 7 0 "[ . 1 . 2]" 1
10 1 2 VAL HA 1 2 VAL QG 2.276 . 2.839 2.167 2.132 2.350 . 0 0 "[ . 1 . 2]" 1
11 1 2 VAL HA 1 3 ASP H 2.174 . 2.765 2.457 2.123 2.731 . 0 0 "[ . 1 . 2]" 1
12 1 2 VAL HA 1 3 ASP HB3 3.366 . 4.782 5.018 4.076 5.731 0.949 1 9 "[+***. *-* *. *]" 1
13 1 2 VAL HB 1 2 VAL QG 2.056 . 2.553 1.890 1.879 1.894 . 0 0 "[ . 1 . 2]" 1
14 1 2 VAL HB 1 3 ASP H 2.533 . 3.335 3.311 2.647 3.669 0.334 5 0 "[ . 1 . 2]" 1
15 1 2 VAL QG 1 3 ASP H 2.726 . 3.655 1.622 1.262 1.911 0.535 16 2 "[ . 1 -+ 2]" 1
16 1 2 VAL QG 1 85 THR MG 2.567 . 6.000 4.269 3.078 5.210 . 0 0 "[ . 1 . 2]" 1
17 1 3 ASP H 1 3 ASP HA 2.734 . 3.668 2.924 2.890 2.939 . 0 0 "[ . 1 . 2]" 1
18 1 3 ASP H 1 3 ASP HB2 2.556 . 6.000 3.106 2.289 3.828 . 0 0 "[ . 1 . 2]" 1
19 1 3 ASP H 1 3 ASP HB3 2.487 . 3.260 3.274 2.417 3.725 0.465 3 0 "[ . 1 . 2]" 1
20 1 3 ASP H 1 6 HIS HD2 3.725 . 5.459 4.640 4.250 5.122 . 0 0 "[ . 1 . 2]" 1
21 1 3 ASP H 1 86 PRO QD 3.461 . 4.958 4.864 4.770 4.924 . 0 0 "[ . 1 . 2]" 1
22 1 3 ASP HA 1 3 ASP HB2 2.561 . 3.381 2.721 2.239 3.027 . 0 0 "[ . 1 . 2]" 1
23 1 3 ASP HA 1 5 LYS H 3.380 . 4.808 3.777 3.594 3.945 . 0 0 "[ . 1 . 2]" 1
24 1 3 ASP HA 1 85 THR MG 2.522 . 6.000 3.506 3.195 3.820 . 0 0 "[ . 1 . 2]" 1
25 1 3 ASP HA 1 86 PRO HB2 2.517 . 6.000 5.093 4.931 5.250 . 0 0 "[ . 1 . 2]" 1
26 1 3 ASP HA 1 86 PRO QD 2.054 . 2.700 2.394 2.223 2.520 . 0 0 "[ . 1 . 2]" 1
27 1 3 ASP HB2 1 5 LYS H 3.084 . 4.273 3.526 2.850 4.648 0.375 14 0 "[ . 1 . 2]" 1
28 1 3 ASP HB2 1 86 PRO QD 3.049 . 4.211 3.762 2.769 4.673 0.462 10 0 "[ . 1 . 2]" 1
29 1 3 ASP HB2 1 86 PRO QG 2.867 . 3.895 3.661 2.603 4.800 0.905 9 5 "[ *- . +* *. 2]" 1
30 1 3 ASP HB3 1 5 LYS H 3.272 . 4.610 3.872 2.632 4.806 0.196 19 0 "[ . 1 . 2]" 1
31 1 3 ASP HB3 1 6 HIS HD2 2.530 . 6.000 5.205 4.002 6.018 0.018 11 0 "[ . 1 . 2]" 1
32 1 3 ASP HB3 1 86 PRO QD 2.992 . 6.000 3.544 2.472 4.547 . 0 0 "[ . 1 . 2]" 1
33 1 4 PRO HA 1 4 PRO HB2 2.300 . 2.961 2.991 2.978 3.002 0.041 10 0 "[ . 1 . 2]" 1
34 1 4 PRO HA 1 4 PRO HB3 2.287 . 2.941 2.356 2.326 2.382 . 0 0 "[ . 1 . 2]" 1
35 1 4 PRO HA 1 4 PRO HD3 3.124 . 4.344 3.074 2.978 3.148 . 0 0 "[ . 1 . 2]" 1
36 1 4 PRO HA 1 4 PRO HG3 2.786 . 3.756 2.913 2.824 3.009 . 0 0 "[ . 1 . 2]" 1
37 1 4 PRO HA 1 5 LYS QD 3.518 . 6.000 5.838 5.160 6.324 0.324 9 0 "[ . 1 . 2]" 1
38 1 4 PRO HA 1 6 HIS HD2 3.293 . 4.649 3.707 1.891 4.243 0.046 20 0 "[ . 1 . 2]" 1
39 1 4 PRO HA 1 87 ASN H 3.041 . 6.000 4.670 4.407 5.034 . 0 0 "[ . 1 . 2]" 1
40 1 4 PRO HA 1 98 SER H 2.863 . 6.000 6.257 5.888 7.378 1.378 11 1 "[ . 1+ . 2]" 1
41 1 4 PRO HB2 1 4 PRO HD2 2.977 . 4.085 3.279 3.188 3.375 . 0 0 "[ . 1 . 2]" 1
42 1 4 PRO HB2 1 4 PRO HD3 2.796 . 3.773 3.843 3.826 3.871 0.098 20 0 "[ . 1 . 2]" 1
43 1 4 PRO HB2 1 87 ASN H 3.493 . 5.018 2.381 2.172 2.759 . 0 0 "[ . 1 . 2]" 1
44 1 4 PRO HB3 1 4 PRO HD2 2.823 . 6.000 4.046 4.012 4.075 . 0 0 "[ . 1 . 2]" 1
45 1 4 PRO HB3 1 4 PRO HD3 2.775 . 3.738 3.845 3.781 3.886 0.148 12 0 "[ . 1 . 2]" 1
46 1 4 PRO HB3 1 4 PRO HG2 2.380 . 3.088 2.678 2.652 2.703 . 0 0 "[ . 1 . 2]" 1
47 1 4 PRO HB3 1 4 PRO HG3 2.336 . 3.018 2.282 2.270 2.292 . 0 0 "[ . 1 . 2]" 1
48 1 4 PRO HB3 1 86 PRO HB2 3.169 . 4.424 2.987 2.826 3.156 . 0 0 "[ . 1 . 2]" 1
49 1 4 PRO HB3 1 87 ASN H 3.380 . 4.808 2.553 2.222 2.984 . 0 0 "[ . 1 . 2]" 1
50 1 4 PRO HB3 1 87 ASN HA 3.219 . 4.514 4.806 4.672 4.962 0.448 11 0 "[ . 1 . 2]" 1
51 1 4 PRO HD2 1 4 PRO HG3 2.517 . 3.309 2.884 2.849 2.905 . 0 0 "[ . 1 . 2]" 1
52 1 4 PRO HD2 1 85 THR H 2.934 . 6.000 4.704 4.509 4.895 . 0 0 "[ . 1 . 2]" 1
53 1 4 PRO HD2 1 85 THR HA 2.315 . 2.985 1.785 1.625 1.961 0.020 7 0 "[ . 1 . 2]" 1
54 1 4 PRO HD2 1 85 THR MG 2.980 . 4.090 2.611 2.361 2.809 . 0 0 "[ . 1 . 2]" 1
55 1 4 PRO HD2 1 86 PRO QD 2.609 . 3.460 1.528 1.394 1.700 0.364 12 0 "[ . 1 . 2]" 1
56 1 4 PRO HD2 1 87 ASN H 2.912 . 6.000 4.234 4.089 4.412 . 0 0 "[ . 1 . 2]" 1
57 1 4 PRO HD3 1 4 PRO HG2 2.387 . 3.099 2.817 2.788 2.855 . 0 0 "[ . 1 . 2]" 1
58 1 4 PRO HD3 1 85 THR H 2.877 . 6.000 5.859 5.668 6.000 . 0 0 "[ . 1 . 2]" 1
59 1 4 PRO HD3 1 85 THR HA 2.495 . 3.273 3.164 2.975 3.315 0.042 10 0 "[ . 1 . 2]" 1
60 1 4 PRO HD3 1 85 THR MG 3.143 . 4.377 2.511 2.183 2.828 . 0 0 "[ . 1 . 2]" 1
61 1 4 PRO HD3 1 87 ASN H 3.134 . 6.000 4.763 4.599 4.958 . 0 0 "[ . 1 . 2]" 1
62 1 4 PRO HG2 1 85 THR HA 2.918 . 3.983 2.306 2.012 2.533 . 0 0 "[ . 1 . 2]" 1
63 1 4 PRO HG2 1 85 THR HB 2.852 . 3.869 1.877 1.800 2.046 0.035 13 0 "[ . 1 . 2]" 1
64 1 4 PRO HG2 1 85 THR MG 2.763 . 3.717 3.177 2.993 3.400 . 0 0 "[ . 1 . 2]" 1
65 1 4 PRO HG2 1 87 ASN H 3.176 . 4.436 2.104 1.928 2.315 . 0 0 "[ . 1 . 2]" 1
66 1 4 PRO HG3 1 85 THR HA 3.353 . 4.758 3.561 3.225 3.810 . 0 0 "[ . 1 . 2]" 1
67 1 4 PRO HG3 1 87 ASN H 3.151 . 4.392 3.043 2.867 3.298 . 0 0 "[ . 1 . 2]" 1
68 1 5 LYS H 1 5 LYS HA 2.280 . 2.930 2.730 2.657 2.784 . 0 0 "[ . 1 . 2]" 1
69 1 5 LYS H 1 5 LYS HB2 2.469 . 6.000 3.513 2.280 3.623 . 0 0 "[ . 1 . 2]" 1
70 1 5 LYS H 1 5 LYS HB3 2.408 . 3.133 2.539 2.387 3.504 0.371 9 0 "[ . 1 . 2]" 1
71 1 5 LYS H 1 5 LYS QD 3.129 . 4.353 3.661 2.356 4.054 . 0 0 "[ . 1 . 2]" 1
72 1 5 LYS H 1 5 LYS QG 2.689 . 3.593 2.117 1.841 2.312 0.014 1 0 "[ . 1 . 2]" 1
73 1 5 LYS H 1 6 HIS H 2.643 . 3.516 3.153 3.058 3.269 . 0 0 "[ . 1 . 2]" 1
74 1 5 LYS H 1 7 VAL H 3.324 . 6.000 5.065 4.847 5.410 . 0 0 "[ . 1 . 2]" 1
75 1 5 LYS H 1 7 VAL QG 3.252 . 6.000 5.226 4.988 5.358 . 0 0 "[ . 1 . 2]" 1
76 1 5 LYS H 1 86 PRO HA 2.396 . 6.000 5.393 5.319 5.475 . 0 0 "[ . 1 . 2]" 1
77 1 5 LYS H 1 86 PRO HB2 2.964 . 4.062 3.011 2.896 3.184 . 0 0 "[ . 1 . 2]" 1
78 1 5 LYS H 1 86 PRO HB3 2.784 . 3.753 3.853 3.783 3.975 0.222 9 0 "[ . 1 . 2]" 1
79 1 5 LYS H 1 86 PRO QD 2.987 . 3.817 3.019 2.921 3.105 . 0 0 "[ . 1 . 2]" 1
80 1 5 LYS H 1 86 PRO QG 2.701 . 3.613 1.901 1.774 2.036 0.015 14 0 "[ . 1 . 2]" 1
81 1 5 LYS HA 1 5 LYS HB2 2.200 . 2.805 2.499 2.421 2.933 0.128 9 0 "[ . 1 . 2]" 1
82 1 5 LYS HA 1 5 LYS HB3 2.165 . 2.751 2.397 2.318 2.564 . 0 0 "[ . 1 . 2]" 1
83 1 5 LYS HA 1 5 LYS QD 2.769 . 3.728 3.798 3.715 3.906 0.178 14 0 "[ . 1 . 2]" 1
84 1 5 LYS HA 1 5 LYS QG 2.801 . 3.847 3.259 2.163 3.362 . 0 0 "[ . 1 . 2]" 1
85 1 5 LYS HA 1 6 HIS H 2.529 . 3.329 3.164 3.069 3.239 . 0 0 "[ . 1 . 2]" 1
86 1 5 LYS HA 1 7 VAL H 2.915 . 3.977 3.428 3.119 3.975 . 0 0 "[ . 1 . 2]" 1
87 1 5 LYS HA 1 7 VAL QG 2.560 . 3.379 3.251 2.869 3.403 0.024 19 0 "[ . 1 . 2]" 1
88 1 5 LYS HA 1 86 PRO HB2 2.633 . 3.499 3.505 3.225 3.669 0.170 9 0 "[ . 1 . 2]" 1
89 1 5 LYS HB2 1 5 LYS QD 2.145 . 2.720 2.309 1.993 2.950 0.230 13 0 "[ . 1 . 2]" 1
90 1 5 LYS HB2 1 5 LYS QG 2.645 . 3.216 2.423 2.113 2.501 . 0 0 "[ . 1 . 2]" 1
91 1 5 LYS HB2 1 6 HIS H 2.977 . 6.000 4.255 3.619 4.375 . 0 0 "[ . 1 . 2]" 1
92 1 5 LYS HB3 1 5 LYS QG 2.582 . 3.358 2.194 2.123 2.503 . 0 0 "[ . 1 . 2]" 1
93 1 5 LYS HB3 1 6 HIS H 3.213 . 4.504 4.461 4.031 4.528 0.024 14 0 "[ . 1 . 2]" 1
94 1 5 LYS HB3 1 6 HIS HD2 3.274 . 6.000 4.745 3.527 5.122 . 0 0 "[ . 1 . 2]" 1
95 1 5 LYS HB3 1 86 PRO QG 3.172 . 4.430 2.612 2.384 4.304 . 0 0 "[ . 1 . 2]" 1
96 1 5 LYS QD 1 5 LYS QG 2.239 . 2.866 2.054 2.000 2.095 . 0 0 "[ . 1 . 2]" 1
97 1 5 LYS QD 1 6 HIS HD2 3.329 . 4.714 3.252 2.237 4.627 . 0 0 "[ . 1 . 2]" 1
98 1 5 LYS QG 1 6 HIS H 3.435 . 4.910 3.220 3.029 4.381 . 0 0 "[ . 1 . 2]" 1
99 1 5 LYS QG 1 6 HIS HD2 3.412 . 4.868 2.576 2.026 4.360 . 0 0 "[ . 1 . 2]" 1
100 1 5 LYS QG 1 7 VAL H 3.475 . 4.985 4.951 4.589 5.105 0.120 3 0 "[ . 1 . 2]" 1
101 1 5 LYS QG 1 86 PRO HB2 3.465 . 4.966 4.707 3.571 4.877 . 0 0 "[ . 1 . 2]" 1
102 1 5 LYS QG 1 86 PRO QG 2.811 . 3.798 3.113 1.750 3.403 0.172 9 0 "[ . 1 . 2]" 1
103 1 6 HIS H 1 6 HIS HA 2.976 . 4.083 2.825 2.799 2.889 . 0 0 "[ . 1 . 2]" 1
104 1 6 HIS H 1 6 HIS HB2 2.786 . 3.756 2.474 2.382 2.666 . 0 0 "[ . 1 . 2]" 1
105 1 6 HIS H 1 6 HIS HB3 3.124 . 4.344 3.539 3.504 3.580 . 0 0 "[ . 1 . 2]" 1
106 1 6 HIS H 1 7 VAL H 2.569 . 3.394 2.680 2.465 3.294 . 0 0 "[ . 1 . 2]" 1
107 1 6 HIS H 1 7 VAL QG 2.835 . 3.840 3.888 3.783 4.071 0.231 14 0 "[ . 1 . 2]" 1
108 1 6 HIS H 1 86 PRO HB2 3.080 . 6.000 4.973 4.758 5.127 . 0 0 "[ . 1 . 2]" 1
109 1 6 HIS HA 1 6 HIS HD2 3.437 . 4.914 3.026 2.846 3.884 . 0 0 "[ . 1 . 2]" 1
110 1 6 HIS HA 1 7 VAL H 3.147 . 4.385 3.276 2.893 3.467 . 0 0 "[ . 1 . 2]" 1
111 1 6 HIS HA 1 22 ARG QB 3.000 . 6.000 4.353 4.075 4.599 . 0 0 "[ . 1 . 2]" 1
112 1 6 HIS HB2 1 6 HIS HD2 3.371 . 4.791 3.445 3.066 3.581 . 0 0 "[ . 1 . 2]" 1
113 1 6 HIS HB2 1 7 VAL H 3.343 . 4.740 3.178 2.550 4.069 . 0 0 "[ . 1 . 2]" 1
114 1 6 HIS HB2 1 7 VAL QG 3.497 . 5.026 4.369 4.155 4.879 . 0 0 "[ . 1 . 2]" 1
115 1 6 HIS HB2 1 21 PHE QD 3.155 . 4.399 4.015 3.684 4.317 . 0 0 "[ . 1 . 2]" 1
116 1 6 HIS HB2 1 21 PHE QE 3.101 . 4.303 2.454 1.921 3.210 . 0 0 "[ . 1 . 2]" 1
117 1 6 HIS HB2 1 22 ARG H 3.439 . 4.917 3.955 3.638 4.113 . 0 0 "[ . 1 . 2]" 1
118 1 6 HIS HB2 1 96 SER H 3.341 . 6.000 6.128 6.038 6.254 0.254 20 0 "[ . 1 . 2]" 1
119 1 6 HIS HB3 1 22 ARG H 3.284 . 4.632 4.170 3.865 4.417 . 0 0 "[ . 1 . 2]" 1
120 1 6 HIS HD2 1 7 VAL QG 3.176 . 6.000 5.062 4.963 5.259 . 0 0 "[ . 1 . 2]" 1
121 1 6 HIS HD2 1 21 PHE HE1 3.132 . 6.000 4.938 3.765 5.114 . 0 0 "[ . 1 . 2]" 1
122 1 6 HIS HD2 1 21 PHE QE 3.243 . 4.558 4.761 3.723 4.914 0.356 9 0 "[ . 1 . 2]" 1
123 1 6 HIS HD2 1 21 PHE HZ 3.371 . 4.791 4.273 3.644 4.540 . 0 0 "[ . 1 . 2]" 1
124 1 6 HIS HD2 1 86 PRO HB2 2.905 . 6.000 5.955 4.724 6.158 0.158 19 0 "[ . 1 . 2]" 1
125 1 6 HIS HD2 1 97 SER HA 3.165 . 6.000 6.073 5.575 6.216 0.216 20 0 "[ . 1 . 2]" 1
126 1 6 HIS HE1 1 21 PHE HE1 3.266 . 6.000 5.824 5.451 6.349 0.349 12 0 "[ . 1 . 2]" 1
127 1 6 HIS HE1 1 21 PHE QE 3.266 . 4.599 3.920 3.378 4.392 . 0 0 "[ . 1 . 2]" 1
128 1 6 HIS HE1 1 21 PHE HZ 3.104 . 4.308 3.544 3.169 4.452 0.144 12 0 "[ . 1 . 2]" 1
129 1 6 HIS HE1 1 24 ASP H 3.271 . 4.608 3.459 2.712 3.893 . 0 0 "[ . 1 . 2]" 1
130 1 7 VAL H 1 7 VAL HA 2.539 . 3.345 2.388 2.262 2.775 . 0 0 "[ . 1 . 2]" 1
131 1 7 VAL H 1 7 VAL HB 2.182 . 6.000 3.748 2.678 3.987 . 0 0 "[ . 1 . 2]" 1
132 1 7 VAL H 1 7 VAL QG 2.552 . 2.771 2.190 1.503 2.436 0.235 14 0 "[ . 1 . 2]" 1
133 1 7 VAL H 1 8 CYS H 3.520 . 5.069 4.573 4.256 4.635 . 0 0 "[ . 1 . 2]" 1
134 1 7 VAL HA 1 7 VAL HB 2.410 . 3.136 2.361 2.201 2.928 . 0 0 "[ . 1 . 2]" 1
135 1 7 VAL HA 1 7 VAL QG 2.159 . 2.700 2.409 2.037 2.598 . 0 0 "[ . 1 . 2]" 1
136 1 7 VAL HA 1 8 CYS H 1.996 . 2.494 2.477 2.111 2.698 0.204 5 0 "[ . 1 . 2]" 1
137 1 7 VAL HA 1 8 CYS HA 2.923 . 6.000 4.450 4.135 4.568 . 0 0 "[ . 1 . 2]" 1
138 1 7 VAL HA 1 8 CYS QB 3.160 . 3.986 4.105 3.885 4.623 0.637 20 1 "[ . 1 . +]" 1
139 1 7 VAL HA 1 21 PHE HA 3.272 . 6.000 5.404 4.474 5.750 . 0 0 "[ . 1 . 2]" 1
140 1 7 VAL HA 1 22 ARG QB 3.266 . 4.599 4.282 3.628 4.561 . 0 0 "[ . 1 . 2]" 1
141 1 7 VAL HB 1 7 VAL QG 1.923 . 2.385 1.889 1.883 1.894 . 0 0 "[ . 1 . 2]" 1
142 1 7 VAL HB 1 8 CYS H 2.982 . 4.093 2.318 1.873 3.778 . 0 0 "[ . 1 . 2]" 1
143 1 7 VAL HB 1 89 TYR QE 3.226 . 6.000 5.724 4.623 6.184 0.184 20 0 "[ . 1 . 2]" 1
144 1 7 VAL QG 1 8 CYS H 2.253 . 2.887 2.511 2.189 2.905 0.018 11 0 "[ . 1 . 2]" 1
145 1 7 VAL QG 1 97 SER H 3.090 . 6.000 2.835 1.360 3.736 . 0 0 "[ . 1 . 2]" 1
146 1 8 CYS H 1 8 CYS HA 2.980 . 4.090 2.899 2.868 2.944 . 0 0 "[ . 1 . 2]" 1
147 1 8 CYS H 1 8 CYS QB 2.467 . 3.228 2.987 2.340 3.131 . 0 0 "[ . 1 . 2]" 1
148 1 8 CYS H 1 11 THR MG 3.124 . 6.000 5.049 4.594 5.343 . 0 0 "[ . 1 . 2]" 1
149 1 8 CYS HA 1 8 CYS QB 2.374 . 2.889 2.200 2.162 2.501 . 0 0 "[ . 1 . 2]" 1
150 1 8 CYS HA 1 9 VAL H 2.009 . 2.513 2.256 2.138 2.447 . 0 0 "[ . 1 . 2]" 1
151 1 8 CYS HA 1 9 VAL HA 3.095 . 4.293 4.371 4.327 4.414 0.121 8 0 "[ . 1 . 2]" 1
152 1 8 CYS HA 1 9 VAL HB 3.053 . 6.000 4.558 4.408 4.710 . 0 0 "[ . 1 . 2]" 1
153 1 8 CYS HA 1 11 THR MG 2.840 . 3.848 3.550 3.308 4.082 0.234 14 0 "[ . 1 . 2]" 1
154 1 8 CYS HA 1 22 ARG H 3.117 . 4.331 3.558 2.776 4.183 . 0 0 "[ . 1 . 2]" 1
155 1 8 CYS HA 1 22 ARG QB 2.877 . 3.912 1.829 1.658 2.027 0.272 19 0 "[ . 1 . 2]" 1
156 1 8 CYS HA 1 22 ARG HD3 2.822 . 3.818 2.830 2.067 3.620 . 0 0 "[ . 1 . 2]" 1
157 1 8 CYS QB 1 10 ASP H 3.067 . 4.243 4.191 3.868 4.278 0.035 4 0 "[ . 1 . 2]" 1
158 1 8 CYS QB 1 22 ARG H 3.692 . 5.396 2.689 2.279 3.846 . 0 0 "[ . 1 . 2]" 1
159 1 9 VAL H 1 9 VAL HB 2.334 . 3.015 2.704 2.594 2.800 . 0 0 "[ . 1 . 2]" 1
160 1 9 VAL H 1 9 VAL QG 3.180 . 4.444 2.622 2.177 2.838 . 0 0 "[ . 1 . 2]" 1
161 1 9 VAL HA 1 9 VAL HB 2.209 . 6.000 3.020 3.006 3.028 . 0 0 "[ . 1 . 2]" 1
162 1 9 VAL HA 1 9 VAL QG 2.132 . 2.700 2.138 2.131 2.145 . 0 0 "[ . 1 . 2]" 1
163 1 9 VAL HA 1 10 ASP H 2.459 . 6.000 3.540 3.506 3.564 . 0 0 "[ . 1 . 2]" 1
164 1 9 VAL HB 1 10 ASP H 2.429 . 3.167 2.324 2.022 2.606 . 0 0 "[ . 1 . 2]" 1
165 1 9 VAL HB 1 10 ASP HB2 3.424 . 4.890 4.108 3.148 4.966 0.076 6 0 "[ . 1 . 2]" 1
166 1 9 VAL HB 1 10 ASP HB3 3.430 . 4.901 4.294 3.774 4.989 0.088 3 0 "[ . 1 . 2]" 1
167 1 9 VAL HB 1 11 THR MG 3.471 . 4.977 4.960 4.757 5.043 0.066 20 0 "[ . 1 . 2]" 1
168 1 9 VAL HB 1 28 LYS HG2 2.465 . 6.000 5.049 4.037 5.559 . 0 0 "[ . 1 . 2]" 1
169 1 9 VAL QG 1 10 ASP H 3.202 . 4.484 3.060 2.859 3.217 . 0 0 "[ . 1 . 2]" 1
170 1 9 VAL MG2 1 22 ARG HD2 3.045 . 4.204 4.149 3.067 4.745 0.541 8 1 "[ . + 1 . 2]" 1
171 1 10 ASP H 1 10 ASP HB3 2.476 . 3.242 2.923 2.316 3.692 0.450 4 0 "[ . 1 . 2]" 1
172 1 10 ASP H 1 11 THR MG 3.364 . 4.779 3.186 2.880 3.573 . 0 0 "[ . 1 . 2]" 1
173 1 10 ASP HA 1 11 THR H 2.632 . 3.498 3.502 2.835 3.562 0.064 13 0 "[ . 1 . 2]" 1
174 1 10 ASP HA 1 12 ARG H 3.446 . 4.931 4.255 3.872 4.638 . 0 0 "[ . 1 . 2]" 1
175 1 10 ASP HB2 1 11 THR H 2.824 . 3.821 2.961 1.616 4.455 0.634 12 1 "[ . 1 + . 2]" 1
176 1 10 ASP HB3 1 28 LYS QD 3.194 . 4.469 2.687 1.788 4.295 0.131 19 0 "[ . 1 . 2]" 1
177 1 11 THR H 1 11 THR HA 2.530 . 3.330 2.296 2.251 2.831 . 0 0 "[ . 1 . 2]" 1
178 1 11 THR H 1 11 THR MG 2.460 . 3.216 2.540 2.355 2.643 . 0 0 "[ . 1 . 2]" 1
179 1 11 THR H 1 12 ARG H 3.294 . 4.651 2.869 2.769 3.560 . 0 0 "[ . 1 . 2]" 1
180 1 11 THR HA 1 11 THR MG 2.065 . 2.598 2.289 2.213 2.415 . 0 0 "[ . 1 . 2]" 1
181 1 11 THR HA 1 12 ARG H 2.504 . 3.288 2.807 2.608 2.939 . 0 0 "[ . 1 . 2]" 1
182 1 11 THR HA 1 14 ILE HB 2.732 . 3.665 3.729 3.666 3.809 0.144 12 0 "[ . 1 . 2]" 1
183 1 11 THR HA 1 14 ILE MD 2.486 . 3.258 1.728 1.663 1.876 0.051 8 0 "[ . 1 . 2]" 1
184 1 11 THR HA 1 14 ILE HG12 2.428 . 3.165 3.290 3.253 3.315 0.150 20 0 "[ . 1 . 2]" 1
185 1 11 THR HA 1 21 PHE H 2.900 . 6.000 4.896 4.662 5.087 . 0 0 "[ . 1 . 2]" 1
186 1 11 THR HB 1 11 THR MG 2.025 . 2.537 2.132 2.130 2.139 . 0 0 "[ . 1 . 2]" 1
187 1 11 THR HB 1 14 ILE HA 2.764 . 6.000 5.064 4.774 5.416 . 0 0 "[ . 1 . 2]" 1
188 1 11 THR HB 1 14 ILE HB 2.492 . 3.268 2.687 2.450 2.999 . 0 0 "[ . 1 . 2]" 1
189 1 11 THR MG 1 12 ARG H 2.941 . 6.000 4.335 4.281 4.388 . 0 0 "[ . 1 . 2]" 1
190 1 11 THR MG 1 13 ASP H 3.563 . 5.150 4.903 4.717 5.051 . 0 0 "[ . 1 . 2]" 1
191 1 11 THR MG 1 14 ILE H 2.636 . 6.000 4.932 4.732 5.174 . 0 0 "[ . 1 . 2]" 1
192 1 11 THR MG 1 20 CYS HB2 2.592 . 3.432 1.785 1.688 2.024 0.064 1 0 "[ . 1 . 2]" 1
193 1 11 THR MG 1 28 LYS HB3 3.402 . 4.849 2.512 2.200 3.004 . 0 0 "[ . 1 . 2]" 1
194 1 11 THR MG 1 28 LYS QD 3.039 . 4.193 3.351 3.047 3.524 . 0 0 "[ . 1 . 2]" 1
195 1 12 ARG H 1 12 ARG HA 2.305 . 2.969 2.892 2.872 2.907 . 0 0 "[ . 1 . 2]" 1
196 1 12 ARG H 1 12 ARG HB2 2.437 . 3.180 2.699 2.281 3.602 0.422 15 0 "[ . 1 . 2]" 1
197 1 12 ARG H 1 12 ARG HG3 2.622 . 3.481 2.913 2.000 3.746 0.265 12 0 "[ . 1 . 2]" 1
198 1 12 ARG H 1 13 ASP H 3.112 . 4.322 2.250 2.128 2.342 . 0 0 "[ . 1 . 2]" 1
199 1 12 ARG HA 1 12 ARG HB2 2.399 . 3.118 2.830 2.210 3.022 . 0 0 "[ . 1 . 2]" 1
200 1 12 ARG HA 1 12 ARG HB3 2.150 . 2.728 2.523 2.334 2.678 . 0 0 "[ . 1 . 2]" 1
201 1 12 ARG HA 1 12 ARG HG3 2.227 . 2.847 3.155 2.655 3.750 0.903 8 7 "[ . + * * -** *]" 1
202 1 12 ARG HA 1 13 ASP H 2.168 . 6.000 3.385 3.296 3.465 . 0 0 "[ . 1 . 2]" 1
203 1 12 ARG HA 1 14 ILE H 2.856 . 3.876 3.297 2.972 3.509 . 0 0 "[ . 1 . 2]" 1
204 1 12 ARG HB2 1 12 ARG HE 3.161 . 4.410 3.580 2.390 4.572 0.162 8 0 "[ . 1 . 2]" 1
205 1 12 ARG HB2 1 13 ASP H 2.802 . 3.783 3.367 2.902 4.357 0.574 11 2 "[ . 1+ . - 2]" 1
206 1 12 ARG HB3 1 12 ARG HE 3.192 . 4.465 3.529 1.936 4.541 0.076 16 0 "[ . 1 . 2]" 1
207 1 12 ARG HD2 1 12 ARG HE 2.827 . 3.826 2.801 2.546 2.955 . 0 0 "[ . 1 . 2]" 1
208 1 12 ARG HD3 1 12 ARG HE 2.840 . 3.848 2.735 2.382 2.946 . 0 0 "[ . 1 . 2]" 1
209 1 12 ARG HE 1 12 ARG HG3 3.078 . 4.262 2.944 2.257 3.814 . 0 0 "[ . 1 . 2]" 1
210 1 12 ARG HG3 1 13 ASP H 3.164 . 4.416 4.116 2.345 5.170 0.754 8 3 "[ . + 1 - . *]" 1
211 1 13 ASP H 1 13 ASP HB2 2.889 . 3.933 2.538 2.364 2.755 . 0 0 "[ . 1 . 2]" 1
212 1 13 ASP H 1 13 ASP HB3 2.854 . 3.872 3.407 2.516 3.641 . 0 0 "[ . 1 . 2]" 1
213 1 13 ASP H 1 14 ILE H 2.548 . 3.360 2.492 2.354 2.698 . 0 0 "[ . 1 . 2]" 1
214 1 13 ASP HB3 1 14 ILE H 3.402 . 4.848 4.084 3.276 4.426 . 0 0 "[ . 1 . 2]" 1
215 1 14 ILE H 1 14 ILE HA 2.652 . 3.531 2.883 2.807 2.918 . 0 0 "[ . 1 . 2]" 1
216 1 14 ILE H 1 14 ILE HB 2.313 . 2.982 2.257 2.215 2.297 . 0 0 "[ . 1 . 2]" 1
217 1 14 ILE H 1 14 ILE MD 2.609 . 3.460 2.330 2.145 2.519 . 0 0 "[ . 1 . 2]" 1
218 1 14 ILE H 1 15 PRO HD3 3.325 . 4.707 4.126 4.022 4.245 . 0 0 "[ . 1 . 2]" 1
219 1 14 ILE H 1 18 ALA MB 2.470 . 6.000 5.847 5.734 5.933 . 0 0 "[ . 1 . 2]" 1
220 1 14 ILE H 1 30 TRP HB3 3.436 . 4.912 4.753 4.626 4.940 0.028 5 0 "[ . 1 . 2]" 1
221 1 14 ILE HA 1 14 ILE HB 2.694 . 3.601 3.004 2.994 3.015 . 0 0 "[ . 1 . 2]" 1
222 1 14 ILE HA 1 14 ILE HG12 2.862 . 3.886 3.674 3.637 3.694 . 0 0 "[ . 1 . 2]" 1
223 1 14 ILE HA 1 14 ILE HG13 2.869 . 3.898 2.579 2.534 2.625 . 0 0 "[ . 1 . 2]" 1
224 1 14 ILE HA 1 14 ILE MG 2.330 . 3.008 2.620 2.585 2.659 . 0 0 "[ . 1 . 2]" 1
225 1 14 ILE HA 1 15 PRO HD2 2.228 . 2.849 2.455 2.402 2.499 . 0 0 "[ . 1 . 2]" 1
226 1 14 ILE HA 1 15 PRO HD3 2.076 . 2.615 1.804 1.688 1.882 . 0 0 "[ . 1 . 2]" 1
227 1 14 ILE HA 1 15 PRO QG 2.949 . 6.000 3.673 3.586 3.731 . 0 0 "[ . 1 . 2]" 1
228 1 14 ILE HB 1 14 ILE MD 2.545 . 3.354 2.568 2.529 2.599 . 0 0 "[ . 1 . 2]" 1
229 1 14 ILE HB 1 14 ILE HG12 2.524 . 3.320 2.394 2.374 2.425 . 0 0 "[ . 1 . 2]" 1
230 1 14 ILE HB 1 15 PRO HD3 3.031 . 6.000 4.675 4.584 4.726 . 0 0 "[ . 1 . 2]" 1
231 1 14 ILE HB 1 20 CYS HB3 3.642 . 5.300 3.450 3.106 3.780 . 0 0 "[ . 1 . 2]" 1
232 1 14 ILE MD 1 14 ILE HG13 2.167 . 2.754 2.125 2.120 2.130 . 0 0 "[ . 1 . 2]" 1
233 1 14 ILE MD 1 15 PRO HD3 2.758 . 3.709 3.599 3.358 3.734 0.025 12 0 "[ . 1 . 2]" 1
234 1 14 ILE MD 1 15 PRO QG 2.089 . 6.000 5.050 4.838 5.173 . 0 0 "[ . 1 . 2]" 1
235 1 14 ILE MD 1 20 CYS H 3.340 . 6.000 5.863 5.688 6.029 0.029 20 0 "[ . 1 . 2]" 1
236 1 14 ILE MD 1 20 CYS HA 3.104 . 4.308 3.509 3.339 3.705 . 0 0 "[ . 1 . 2]" 1
237 1 14 ILE MD 1 21 PHE H 3.573 . 5.169 3.240 3.014 3.541 . 0 0 "[ . 1 . 2]" 1
238 1 14 ILE MD 1 22 ARG HD2 2.640 . 6.000 5.753 5.260 6.287 0.287 8 0 "[ . 1 . 2]" 1
239 1 14 ILE MD 1 28 LYS HB2 3.137 . 4.367 2.704 2.464 2.979 . 0 0 "[ . 1 . 2]" 1
240 1 14 ILE MD 1 28 LYS HB3 2.639 . 3.510 3.043 2.684 3.511 0.001 12 0 "[ . 1 . 2]" 1
241 1 14 ILE MD 1 28 LYS QD 2.948 . 4.034 3.236 2.975 3.443 . 0 0 "[ . 1 . 2]" 1
242 1 14 ILE MD 1 28 LYS HG3 3.327 . 4.710 4.779 4.492 4.898 0.188 15 0 "[ . 1 . 2]" 1
243 1 14 ILE MD 1 30 TRP H 3.597 . 5.214 4.210 4.072 4.365 . 0 0 "[ . 1 . 2]" 1
244 1 14 ILE MD 1 30 TRP HA 2.915 . 3.977 3.955 3.850 4.046 0.069 17 0 "[ . 1 . 2]" 1
245 1 14 ILE MD 1 30 TRP HB2 2.482 . 6.000 4.042 3.883 4.157 . 0 0 "[ . 1 . 2]" 1
246 1 14 ILE MD 1 30 TRP HB3 2.513 . 3.303 2.584 2.427 2.678 . 0 0 "[ . 1 . 2]" 1
247 1 14 ILE MD 1 30 TRP HD1 2.112 . 2.670 2.668 2.508 2.729 0.059 3 0 "[ . 1 . 2]" 1
248 1 14 ILE MD 1 30 TRP HE1 3.247 . 4.565 4.546 4.301 4.660 0.095 3 0 "[ . 1 . 2]" 1
249 1 14 ILE HG12 1 20 CYS HB2 3.055 . 4.222 2.467 2.202 2.751 . 0 0 "[ . 1 . 2]" 1
250 1 14 ILE HG12 1 20 CYS HB3 3.305 . 4.670 2.693 2.460 3.040 . 0 0 "[ . 1 . 2]" 1
251 1 14 ILE HG13 1 20 CYS HB3 3.064 . 4.238 3.951 3.691 4.245 0.007 1 0 "[ . 1 . 2]" 1
252 1 14 ILE MG 1 15 PRO HD3 2.537 . 6.000 3.655 3.554 3.803 . 0 0 "[ . 1 . 2]" 1
253 1 14 ILE MG 1 18 ALA MB 2.149 . 2.726 2.426 2.288 2.578 . 0 0 "[ . 1 . 2]" 1
254 1 14 ILE MG 1 20 CYS H 3.274 . 4.614 3.648 3.486 3.859 . 0 0 "[ . 1 . 2]" 1
255 1 14 ILE MG 1 20 CYS HA 3.198 . 4.476 2.677 2.442 2.978 . 0 0 "[ . 1 . 2]" 1
256 1 14 ILE MG 1 20 CYS HB2 2.544 . 3.353 3.381 3.212 3.439 0.086 3 0 "[ . 1 . 2]" 1
257 1 14 ILE MG 1 20 CYS HB3 2.560 . 3.379 2.162 1.760 2.271 . 0 0 "[ . 1 . 2]" 1
258 1 14 ILE MG 1 30 TRP HA 2.960 . 4.055 3.806 3.592 4.065 0.010 19 0 "[ . 1 . 2]" 1
259 1 14 ILE MG 1 30 TRP HB2 2.381 . 3.090 2.774 2.565 2.987 . 0 0 "[ . 1 . 2]" 1
260 1 14 ILE MG 1 31 ARG H 3.229 . 4.532 4.274 4.083 4.477 . 0 0 "[ . 1 . 2]" 1
261 1 15 PRO HA 1 15 PRO HB2 2.352 . 3.043 2.924 2.904 2.944 . 0 0 "[ . 1 . 2]" 1
262 1 15 PRO HA 1 15 PRO HB3 2.161 . 2.745 2.254 2.241 2.274 . 0 0 "[ . 1 . 2]" 1
263 1 15 PRO HA 1 15 PRO HD3 2.982 . 4.094 3.807 3.769 3.840 . 0 0 "[ . 1 . 2]" 1
264 1 15 PRO HA 1 15 PRO QG 2.925 . 3.994 3.032 2.962 3.097 . 0 0 "[ . 1 . 2]" 1
265 1 15 PRO HA 1 16 LYS H 1.969 . 2.454 2.472 2.370 2.552 0.098 7 0 "[ . 1 . 2]" 1
266 1 15 PRO HA 1 16 LYS HG3 3.244 . 6.000 6.158 5.195 6.537 0.537 17 1 "[ . 1 . + 2]" 1
267 1 15 PRO HA 1 18 ALA MB 3.169 . 4.424 4.184 4.120 4.242 . 0 0 "[ . 1 . 2]" 1
268 1 15 PRO HA 1 43 THR HA 3.130 . 4.355 4.402 4.328 4.467 0.112 11 0 "[ . 1 . 2]" 1
269 1 15 PRO HB2 1 15 PRO HD3 2.942 . 4.024 3.900 3.866 3.929 . 0 0 "[ . 1 . 2]" 1
270 1 15 PRO HB2 1 16 LYS H 2.796 . 3.773 2.734 2.537 2.860 . 0 0 "[ . 1 . 2]" 1
271 1 15 PRO HB2 1 18 ALA H 3.486 . 5.005 4.362 4.070 4.563 . 0 0 "[ . 1 . 2]" 1
272 1 15 PRO HB2 1 18 ALA MB 2.236 . 2.861 2.773 2.612 2.868 0.007 1 0 "[ . 1 . 2]" 1
273 1 15 PRO HB2 1 30 TRP HE3 3.218 . 4.513 4.141 3.899 4.297 . 0 0 "[ . 1 . 2]" 1
274 1 15 PRO HB2 1 43 THR HA 2.802 . 3.783 1.958 1.865 2.087 . 0 0 "[ . 1 . 2]" 1
275 1 15 PRO HB2 1 44 CYS H 3.165 . 4.417 3.055 2.804 3.257 . 0 0 "[ . 1 . 2]" 1
276 1 15 PRO HB3 1 15 PRO HD3 3.042 . 4.199 4.021 3.996 4.050 . 0 0 "[ . 1 . 2]" 1
277 1 15 PRO HB3 1 16 LYS H 2.607 . 3.456 2.629 2.466 2.758 . 0 0 "[ . 1 . 2]" 1
278 1 15 PRO HB3 1 18 ALA MB 2.584 . 6.000 4.163 4.026 4.244 . 0 0 "[ . 1 . 2]" 1
279 1 15 PRO HB3 1 43 THR HA 2.539 . 3.345 2.337 2.254 2.387 . 0 0 "[ . 1 . 2]" 1
280 1 15 PRO HB3 1 44 CYS H 2.960 . 4.055 4.078 3.931 4.139 0.084 8 0 "[ . 1 . 2]" 1
281 1 15 PRO HD2 1 15 PRO QG 2.558 . 3.376 2.227 2.213 2.241 . 0 0 "[ . 1 . 2]" 1
282 1 15 PRO HD2 1 18 ALA MB 2.318 . 2.990 2.351 2.254 2.468 . 0 0 "[ . 1 . 2]" 1
283 1 15 PRO HD2 1 30 TRP HB3 3.256 . 4.582 3.131 2.999 3.255 . 0 0 "[ . 1 . 2]" 1
284 1 15 PRO HD2 1 30 TRP HD1 3.398 . 4.841 4.442 4.311 4.513 . 0 0 "[ . 1 . 2]" 1
285 1 15 PRO HD2 1 30 TRP HE1 3.430 . 4.901 4.963 4.910 5.000 0.099 4 0 "[ . 1 . 2]" 1
286 1 15 PRO HD2 1 30 TRP HE3 2.935 . 4.012 2.772 2.675 2.853 . 0 0 "[ . 1 . 2]" 1
287 1 15 PRO HD3 1 15 PRO QG 2.563 . 3.353 2.171 2.167 2.178 . 0 0 "[ . 1 . 2]" 1
288 1 15 PRO HD3 1 30 TRP HD1 3.281 . 4.627 3.757 3.620 3.843 . 0 0 "[ . 1 . 2]" 1
289 1 15 PRO HD3 1 30 TRP HE1 3.330 . 4.716 4.015 3.858 4.126 . 0 0 "[ . 1 . 2]" 1
290 1 15 PRO QG 1 18 ALA MB 2.809 . 6.000 3.275 3.141 3.385 . 0 0 "[ . 1 . 2]" 1
291 1 15 PRO QG 1 30 TRP HE3 2.970 . 4.072 3.143 3.095 3.176 . 0 0 "[ . 1 . 2]" 1
292 1 15 PRO QG 1 30 TRP HH2 3.471 . 4.977 3.409 3.240 3.585 . 0 0 "[ . 1 . 2]" 1
293 1 15 PRO QG 1 30 TRP HZ2 3.184 . 4.451 3.688 3.518 3.867 . 0 0 "[ . 1 . 2]" 1
294 1 15 PRO QG 1 42 ASN HA 2.853 . 5.559 3.998 3.834 4.200 . 0 0 "[ . 1 . 2]" 1
295 1 15 PRO QG 1 42 ASN QB 2.867 . 3.894 3.186 2.904 3.361 . 0 0 "[ . 1 . 2]" 1
296 1 15 PRO QG 1 42 ASN HB3 3.075 . 4.257 3.412 2.959 4.891 0.634 13 2 "[ . 1 -+ . 2]" 1
297 1 15 PRO QG 1 43 THR HA 3.341 . 4.737 2.351 2.036 2.699 . 0 0 "[ . 1 . 2]" 1
298 1 16 LYS H 1 16 LYS HA 2.350 . 3.040 2.819 2.722 2.870 . 0 0 "[ . 1 . 2]" 1
299 1 16 LYS H 1 16 LYS QB 2.182 . 2.777 2.171 1.955 2.650 . 0 0 "[ . 1 . 2]" 1
300 1 16 LYS H 1 16 LYS HG3 2.684 . 3.584 3.879 2.750 4.231 0.647 5 4 "[ + 1 ** - 2]" 1
301 1 16 LYS H 1 17 ASN H 3.284 . 4.632 4.584 4.554 4.613 . 0 0 "[ . 1 . 2]" 1
302 1 16 LYS HA 1 16 LYS QB 2.119 . 2.680 2.297 2.151 2.524 . 0 0 "[ . 1 . 2]" 1
303 1 16 LYS HA 1 16 LYS HG2 2.576 . 3.406 3.250 2.192 3.900 0.494 6 0 "[ . 1 . 2]" 1
304 1 16 LYS HA 1 16 LYS HG3 2.391 . 6.000 3.265 2.514 3.596 . 0 0 "[ . 1 . 2]" 1
305 1 16 LYS HA 1 17 ASN H 1.944 . 2.417 2.274 2.176 2.422 0.005 1 0 "[ . 1 . 2]" 1
306 1 16 LYS HA 1 17 ASN HA 2.594 . 6.000 4.417 4.368 4.465 . 0 0 "[ . 1 . 2]" 1
307 1 16 LYS HA 1 18 ALA H 2.618 . 3.475 3.148 2.938 3.369 . 0 0 "[ . 1 . 2]" 1
308 1 16 LYS QB 1 16 LYS HG3 2.041 . 2.562 2.283 2.136 2.412 . 0 0 "[ . 1 . 2]" 1
309 1 16 LYS QB 1 17 ASN H 2.834 . 3.719 2.938 2.444 3.495 . 0 0 "[ . 1 . 2]" 1
310 1 16 LYS QB 1 17 ASN HA 3.248 . 6.000 4.686 4.282 4.960 . 0 0 "[ . 1 . 2]" 1
311 1 16 LYS QB 1 17 ASN HD21 3.554 . 4.985 3.761 2.324 4.527 . 0 0 "[ . 1 . 2]" 1
312 1 16 LYS QB 1 17 ASN HD22 3.572 . 5.018 3.935 3.209 4.451 . 0 0 "[ . 1 . 2]" 1
313 1 16 LYS QB 1 18 ALA H 3.436 . 4.911 4.410 4.229 4.512 . 0 0 "[ . 1 . 2]" 1
314 1 16 LYS HG3 1 17 ASN H 2.902 . 3.955 3.320 2.560 4.536 0.581 5 2 "[ + 1 -. 2]" 1
315 1 17 ASN H 1 17 ASN HA 2.152 . 2.731 2.273 2.261 2.284 . 0 0 "[ . 1 . 2]" 1
316 1 17 ASN H 1 17 ASN HB2 3.189 . 4.461 3.552 3.506 3.629 . 0 0 "[ . 1 . 2]" 1
317 1 17 ASN H 1 17 ASN HB3 2.966 . 4.066 4.037 3.977 4.091 0.025 5 0 "[ . 1 . 2]" 1
318 1 17 ASN H 1 18 ALA H 2.418 . 3.149 2.683 2.539 2.858 . 0 0 "[ . 1 . 2]" 1
319 1 17 ASN H 1 33 LEU QD 2.787 . 6.000 4.336 4.120 4.534 . 0 0 "[ . 1 . 2]" 1
320 1 17 ASN HA 1 17 ASN HB2 2.639 . 3.510 3.022 3.018 3.027 . 0 0 "[ . 1 . 2]" 1
321 1 17 ASN HA 1 17 ASN HB3 2.327 . 3.004 2.460 2.438 2.492 . 0 0 "[ . 1 . 2]" 1
322 1 17 ASN HA 1 17 ASN HD21 3.361 . 4.773 4.347 4.119 4.435 . 0 0 "[ . 1 . 2]" 1
323 1 17 ASN HA 1 18 ALA H 2.550 . 3.363 3.079 2.974 3.238 . 0 0 "[ . 1 . 2]" 1
324 1 17 ASN HA 1 18 ALA MB 3.324 . 4.705 4.732 4.688 4.810 0.105 12 0 "[ . 1 . 2]" 1
325 1 17 ASN HA 1 33 LEU H 3.566 . 5.155 4.926 4.706 5.091 . 0 0 "[ . 1 . 2]" 1
326 1 17 ASN HA 1 33 LEU QD 2.293 . 2.950 2.653 2.431 2.871 . 0 0 "[ . 1 . 2]" 1
327 1 17 ASN HA 1 36 TYR QD 3.292 . 4.647 4.455 4.190 4.698 0.051 11 0 "[ . 1 . 2]" 1
328 1 17 ASN HA 1 36 TYR QE 3.186 . 4.455 3.744 3.449 4.148 . 0 0 "[ . 1 . 2]" 1
329 1 17 ASN HB2 1 17 ASN HD21 2.496 . 3.274 2.124 2.098 2.166 . 0 0 "[ . 1 . 2]" 1
330 1 17 ASN HB2 1 17 ASN HD22 2.709 . 3.626 3.436 3.420 3.456 . 0 0 "[ . 1 . 2]" 1
331 1 17 ASN HB2 1 18 ALA H 3.393 . 4.832 3.775 3.473 3.991 . 0 0 "[ . 1 . 2]" 1
332 1 17 ASN HB2 1 33 LEU QD 3.301 . 4.663 4.347 4.120 4.450 . 0 0 "[ . 1 . 2]" 1
333 1 17 ASN HB2 1 36 TYR QD 2.850 . 3.865 3.184 2.889 3.482 . 0 0 "[ . 1 . 2]" 1
334 1 17 ASN HB2 1 36 TYR QE 3.239 . 4.092 3.743 3.465 4.152 0.060 12 0 "[ . 1 . 2]" 1
335 1 17 ASN HB2 1 44 CYS HB2 2.470 . 3.233 2.313 1.920 3.871 0.638 18 2 "[ . 1 - . + 2]" 1
336 1 17 ASN HB3 1 17 ASN HD21 2.579 . 3.410 3.139 3.027 3.389 . 0 0 "[ . 1 . 2]" 1
337 1 17 ASN HB3 1 18 ALA H 3.366 . 4.782 4.359 4.211 4.429 . 0 0 "[ . 1 . 2]" 1
338 1 17 ASN HB3 1 33 LEU HB2 3.371 . 4.792 3.616 3.380 3.857 . 0 0 "[ . 1 . 2]" 1
339 1 17 ASN HB3 1 33 LEU QD 2.927 . 3.998 3.319 3.048 3.485 . 0 0 "[ . 1 . 2]" 1
340 1 17 ASN HB3 1 36 TYR QD 2.605 . 3.453 2.157 1.915 2.486 . 0 0 "[ . 1 . 2]" 1
341 1 17 ASN HB3 1 36 TYR HD2 3.185 . 4.453 2.158 1.916 2.487 0.001 16 0 "[ . 1 . 2]" 1
342 1 17 ASN HB3 1 36 TYR QE 3.116 . 3.633 2.200 1.953 2.594 . 0 0 "[ . 1 . 2]" 1
343 1 17 ASN HB3 1 44 CYS HB2 2.712 . 3.631 3.201 2.832 4.600 0.969 18 2 "[ . 1 - . + 2]" 1
344 1 17 ASN HD21 1 36 TYR QE 2.888 . 6.000 4.229 3.918 4.750 . 0 0 "[ . 1 . 2]" 1
345 1 17 ASN HD21 1 44 CYS H 2.791 . 3.765 3.813 3.676 3.894 0.129 3 0 "[ . 1 . 2]" 1
346 1 18 ALA H 1 18 ALA HA 2.766 . 3.722 2.932 2.919 2.941 . 0 0 "[ . 1 . 2]" 1
347 1 18 ALA H 1 18 ALA MB 2.159 . 2.742 2.372 2.289 2.418 . 0 0 "[ . 1 . 2]" 1
348 1 18 ALA H 1 19 GLY H 3.440 . 4.919 4.373 4.336 4.411 . 0 0 "[ . 1 . 2]" 1
349 1 18 ALA H 1 30 TRP HB2 3.210 . 6.000 5.608 5.484 5.733 . 0 0 "[ . 1 . 2]" 1
350 1 18 ALA H 1 32 CYS HA 3.205 . 6.000 5.058 4.898 5.189 . 0 0 "[ . 1 . 2]" 1
351 1 18 ALA H 1 33 LEU QD 2.522 . 6.000 3.797 3.696 4.033 . 0 0 "[ . 1 . 2]" 1
352 1 18 ALA HA 1 18 ALA MB 2.117 . 2.677 2.142 2.135 2.150 . 0 0 "[ . 1 . 2]" 1
353 1 18 ALA HA 1 19 GLY H 2.274 . 2.921 2.143 2.118 2.166 . 0 0 "[ . 1 . 2]" 1
354 1 18 ALA HA 1 30 TRP HE3 3.341 . 4.737 4.228 4.055 4.351 . 0 0 "[ . 1 . 2]" 1
355 1 18 ALA HA 1 31 ARG H 3.405 . 4.854 4.033 3.832 4.132 . 0 0 "[ . 1 . 2]" 1
356 1 18 ALA HA 1 33 LEU H 2.287 . 2.941 3.027 2.985 3.076 0.135 7 0 "[ . 1 . 2]" 1
357 1 18 ALA HA 1 33 LEU QD 2.920 . 3.360 2.708 2.547 3.273 . 0 0 "[ . 1 . 2]" 1
358 1 18 ALA HA 1 94 PHE HZ 3.318 . 4.694 4.055 3.915 4.246 . 0 0 "[ . 1 . 2]" 1
359 1 18 ALA MB 1 19 GLY H 2.225 . 6.000 2.981 2.903 3.077 . 0 0 "[ . 1 . 2]" 1
360 1 18 ALA MB 1 30 TRP HA 2.868 . 3.896 3.829 3.710 3.927 0.031 13 0 "[ . 1 . 2]" 1
361 1 18 ALA MB 1 30 TRP HB2 2.555 . 3.371 2.095 2.014 2.154 . 0 0 "[ . 1 . 2]" 1
362 1 18 ALA MB 1 30 TRP HB3 2.549 . 3.361 3.480 3.416 3.548 0.187 18 0 "[ . 1 . 2]" 1
363 1 18 ALA MB 1 30 TRP HE1 3.619 . 6.000 6.053 5.999 6.132 0.132 7 0 "[ . 1 . 2]" 1
364 1 18 ALA MB 1 30 TRP HE3 2.089 . 2.635 2.199 2.057 2.319 . 0 0 "[ . 1 . 2]" 1
365 1 18 ALA MB 1 31 ARG H 2.605 . 3.453 2.952 2.809 3.051 . 0 0 "[ . 1 . 2]" 1
366 1 18 ALA MB 1 31 ARG HA 3.082 . 4.269 4.174 4.025 4.280 0.011 1 0 "[ . 1 . 2]" 1
367 1 18 ALA MB 1 33 LEU H 2.724 . 6.000 4.367 4.268 4.439 . 0 0 "[ . 1 . 2]" 1
368 1 19 GLY H 1 19 GLY QA 2.530 . 3.330 2.234 2.214 2.255 . 0 0 "[ . 1 . 2]" 1
369 1 19 GLY H 1 30 TRP HA 3.364 . 4.779 4.674 4.550 4.789 0.010 13 0 "[ . 1 . 2]" 1
370 1 19 GLY H 1 30 TRP HE3 3.526 . 5.080 5.094 4.991 5.140 0.060 15 0 "[ . 1 . 2]" 1
371 1 19 GLY H 1 31 ARG H 2.780 . 3.746 3.081 2.931 3.180 . 0 0 "[ . 1 . 2]" 1
372 1 19 GLY H 1 32 CYS H 3.494 . 5.020 5.024 4.905 5.078 0.058 1 0 "[ . 1 . 2]" 1
373 1 19 GLY H 1 32 CYS HA 2.863 . 3.888 3.741 3.594 3.881 . 0 0 "[ . 1 . 2]" 1
374 1 19 GLY H 1 33 LEU H 3.124 . 4.344 3.910 3.772 4.034 . 0 0 "[ . 1 . 2]" 1
375 1 19 GLY H 1 33 LEU HA 3.458 . 4.953 4.372 4.197 4.522 . 0 0 "[ . 1 . 2]" 1
376 1 19 GLY H 1 33 LEU QD 2.615 . 3.470 2.439 2.340 2.696 . 0 0 "[ . 1 . 2]" 1
377 1 19 GLY H 1 93 VAL QG 3.446 . 4.931 3.191 3.103 3.300 . 0 0 "[ . 1 . 2]" 1
378 1 19 GLY H 1 94 PHE HZ 3.169 . 4.424 2.187 2.051 2.374 . 0 0 "[ . 1 . 2]" 1
379 1 19 GLY QA 1 20 CYS H 2.242 . 2.870 2.279 2.261 2.289 . 0 0 "[ . 1 . 2]" 1
380 1 19 GLY QA 1 33 LEU QD 2.452 . 3.203 2.664 2.584 2.767 . 0 0 "[ . 1 . 2]" 1
381 1 19 GLY QA 1 33 LEU HG 2.709 . 6.000 5.052 4.357 5.271 . 0 0 "[ . 1 . 2]" 1
382 1 19 GLY QA 1 90 TYR QB 2.684 . 3.584 3.433 3.363 3.491 . 0 0 "[ . 1 . 2]" 1
383 1 19 GLY QA 1 90 TYR QE 3.087 . 4.278 2.543 2.354 2.680 . 0 0 "[ . 1 . 2]" 1
384 1 20 CYS H 1 20 CYS HA 2.734 . 3.668 2.920 2.914 2.926 . 0 0 "[ . 1 . 2]" 1
385 1 20 CYS H 1 20 CYS HB2 2.683 . 3.583 3.672 3.653 3.701 0.118 14 0 "[ . 1 . 2]" 1
386 1 20 CYS H 1 20 CYS HB3 2.521 . 3.315 2.883 2.806 3.051 . 0 0 "[ . 1 . 2]" 1
387 1 20 CYS H 1 21 PHE H 3.535 . 5.097 4.470 4.425 4.506 . 0 0 "[ . 1 . 2]" 1
388 1 20 CYS H 1 90 TYR QE 2.834 . 3.838 2.128 1.835 2.600 . 0 0 "[ . 1 . 2]" 1
389 1 20 CYS H 1 94 PHE QB 2.390 . 6.000 5.691 5.594 5.725 . 0 0 "[ . 1 . 2]" 1
390 1 20 CYS HA 1 20 CYS HB2 2.477 . 3.244 2.443 2.402 2.501 . 0 0 "[ . 1 . 2]" 1
391 1 20 CYS HA 1 20 CYS HB3 2.472 . 3.236 2.449 2.390 2.486 . 0 0 "[ . 1 . 2]" 1
392 1 20 CYS HA 1 21 PHE H 2.127 . 2.692 2.188 2.161 2.224 . 0 0 "[ . 1 . 2]" 1
393 1 20 CYS HA 1 30 TRP HA 2.281 . 6.000 3.282 3.069 3.490 . 0 0 "[ . 1 . 2]" 1
394 1 20 CYS HA 1 30 TRP HB2 2.774 . 6.000 4.408 4.248 4.584 . 0 0 "[ . 1 . 2]" 1
395 1 20 CYS HA 1 30 TRP HB3 3.085 . 4.275 3.654 3.446 3.808 . 0 0 "[ . 1 . 2]" 1
396 1 20 CYS HA 1 31 ARG H 2.839 . 6.000 4.602 4.416 4.779 . 0 0 "[ . 1 . 2]" 1
397 1 20 CYS HB2 1 21 PHE H 3.279 . 4.623 3.139 2.976 3.303 . 0 0 "[ . 1 . 2]" 1
398 1 20 CYS HB2 1 30 TRP HA 3.225 . 6.000 5.601 5.389 5.826 . 0 0 "[ . 1 . 2]" 1
399 1 20 CYS HB3 1 21 PHE H 3.229 . 4.532 4.150 3.977 4.247 . 0 0 "[ . 1 . 2]" 1
400 1 21 PHE H 1 21 PHE HB2 2.759 . 3.711 3.259 3.167 3.354 . 0 0 "[ . 1 . 2]" 1
401 1 21 PHE H 1 21 PHE HB3 2.861 . 3.884 2.834 2.742 3.036 . 0 0 "[ . 1 . 2]" 1
402 1 21 PHE H 1 21 PHE QD 3.480 . 4.993 4.425 4.384 4.462 . 0 0 "[ . 1 . 2]" 1
403 1 21 PHE H 1 22 ARG H 3.502 . 5.035 4.335 4.272 4.392 . 0 0 "[ . 1 . 2]" 1
404 1 21 PHE H 1 28 LYS HA 3.483 . 4.999 4.826 4.459 5.022 0.023 8 0 "[ . 1 . 2]" 1
405 1 21 PHE H 1 29 GLU H 2.796 . 3.773 3.480 3.187 3.813 0.040 11 0 "[ . 1 . 2]" 1
406 1 21 PHE H 1 29 GLU HB2 3.393 . 4.832 4.296 4.060 4.498 . 0 0 "[ . 1 . 2]" 1
407 1 21 PHE H 1 29 GLU HB3 3.537 . 5.101 5.218 5.103 5.344 0.243 2 0 "[ . 1 . 2]" 1
408 1 21 PHE H 1 30 TRP HA 2.927 . 3.998 3.522 3.251 3.785 . 0 0 "[ . 1 . 2]" 1
409 1 21 PHE H 1 94 PHE HZ 3.411 . 6.000 5.352 5.119 5.629 . 0 0 "[ . 1 . 2]" 1
410 1 21 PHE HA 1 21 PHE HB2 2.550 . 3.363 2.478 2.455 2.522 . 0 0 "[ . 1 . 2]" 1
411 1 21 PHE HA 1 21 PHE HB3 2.404 . 3.127 3.027 3.004 3.032 . 0 0 "[ . 1 . 2]" 1
412 1 21 PHE HA 1 21 PHE HD1 3.077 . 4.260 2.343 1.942 2.489 . 0 0 "[ . 1 . 2]" 1
413 1 21 PHE HA 1 21 PHE QD 2.442 . 3.187 2.336 1.940 2.477 . 0 0 "[ . 1 . 2]" 1
414 1 21 PHE HA 1 22 ARG QB 3.442 . 4.923 4.145 4.054 4.252 . 0 0 "[ . 1 . 2]" 1
415 1 21 PHE HB2 1 21 PHE HD1 2.732 . 3.665 2.809 2.700 3.299 . 0 0 "[ . 1 . 2]" 1
416 1 21 PHE HB2 1 22 ARG H 3.480 . 4.994 4.079 4.018 4.163 . 0 0 "[ . 1 . 2]" 1
417 1 21 PHE HB2 1 29 GLU HB2 3.102 . 4.305 4.285 4.083 4.466 0.161 12 0 "[ . 1 . 2]" 1
418 1 21 PHE HB2 1 94 PHE QD 2.526 . 3.324 2.519 2.185 2.968 . 0 0 "[ . 1 . 2]" 1
419 1 21 PHE HB2 1 94 PHE QE 3.139 . 4.371 3.555 3.053 4.076 . 0 0 "[ . 1 . 2]" 1
420 1 21 PHE HB3 1 21 PHE HD1 2.683 . 6.000 3.747 3.639 3.769 . 0 0 "[ . 1 . 2]" 1
421 1 21 PHE HB3 1 21 PHE QD 2.329 . 3.007 2.251 2.231 2.373 . 0 0 "[ . 1 . 2]" 1
422 1 21 PHE HB3 1 29 GLU HB2 3.363 . 4.777 2.571 2.378 2.799 . 0 0 "[ . 1 . 2]" 1
423 1 21 PHE HB3 1 29 GLU HB3 3.252 . 4.574 3.803 3.385 4.237 . 0 0 "[ . 1 . 2]" 1
424 1 21 PHE HB3 1 94 PHE QD 2.314 . 2.983 2.790 2.503 2.924 . 0 0 "[ . 1 . 2]" 1
425 1 21 PHE QD 1 22 ARG H 3.237 . 4.547 2.798 1.801 2.978 0.126 12 0 "[ . 1 . 2]" 1
426 1 21 PHE QD 1 29 GLU HB2 2.955 . 4.046 2.316 1.867 4.048 0.002 12 0 "[ . 1 . 2]" 1
427 1 21 PHE QD 1 89 TYR HB2 3.510 . 5.050 4.367 4.186 4.714 . 0 0 "[ . 1 . 2]" 1
428 1 21 PHE QD 1 89 TYR QE 3.267 . 4.601 4.463 3.260 4.625 0.024 6 0 "[ . 1 . 2]" 1
429 1 21 PHE QD 1 94 PHE HA 3.478 . 4.990 4.986 3.929 5.152 0.162 9 0 "[ . 1 . 2]" 1
430 1 21 PHE QD 1 94 PHE QB 3.639 . 4.130 2.945 2.008 3.134 . 0 0 "[ . 1 . 2]" 1
431 1 21 PHE HD1 1 94 PHE QD 3.339 . 4.733 4.447 3.933 5.651 0.918 12 1 "[ . 1 + . 2]" 1
432 1 21 PHE QE 1 22 ARG H 3.671 . 5.356 3.928 3.406 4.071 . 0 0 "[ . 1 . 2]" 1
433 1 21 PHE QE 1 86 PRO HB2 2.865 . 6.000 6.163 6.106 6.261 0.261 20 0 "[ . 1 . 2]" 1
434 1 21 PHE QE 1 89 TYR QE 3.154 . 6.000 5.533 3.804 5.895 . 0 0 "[ . 1 . 2]" 1
435 1 21 PHE QE 1 95 CYS HB2 3.965 . 5.930 4.584 4.106 5.304 . 0 0 "[ . 1 . 2]" 1
436 1 21 PHE QE 1 96 SER HA 3.315 . 4.688 2.230 1.764 2.543 0.178 17 0 "[ . 1 . 2]" 1
437 1 21 PHE HE1 1 89 TYR QE 2.838 . 6.000 5.591 3.839 5.965 . 0 0 "[ . 1 . 2]" 1
438 1 21 PHE HE1 1 94 PHE QB 3.360 . 4.606 4.021 3.532 5.362 0.756 12 1 "[ . 1 + . 2]" 1
439 1 21 PHE HZ 1 96 SER HA 3.180 . 4.444 4.302 3.067 4.565 0.121 14 0 "[ . 1 . 2]" 1
440 1 22 ARG H 1 22 ARG QB 2.601 . 3.447 2.455 2.366 2.511 . 0 0 "[ . 1 . 2]" 1
441 1 22 ARG H 1 22 ARG HD2 3.491 . 5.014 5.071 4.442 5.971 0.957 6 2 "[ .+ - 1 . 2]" 1
442 1 22 ARG H 1 22 ARG HG2 3.327 . 4.710 4.712 4.508 4.824 0.114 6 0 "[ . 1 . 2]" 1
443 1 22 ARG H 1 22 ARG HG3 3.155 . 4.400 4.480 4.347 4.523 0.123 7 0 "[ . 1 . 2]" 1
444 1 22 ARG H 1 23 ASP HA 3.344 . 6.000 4.734 4.592 4.916 . 0 0 "[ . 1 . 2]" 1
445 1 22 ARG QB 1 22 ARG HD2 2.566 . 3.389 2.555 2.164 3.326 . 0 0 "[ . 1 . 2]" 1
446 1 22 ARG QB 1 22 ARG HG2 2.511 . 3.299 2.147 2.123 2.211 . 0 0 "[ . 1 . 2]" 1
447 1 22 ARG QB 1 22 ARG HG3 2.338 . 3.021 2.491 2.397 2.528 . 0 0 "[ . 1 . 2]" 1
448 1 22 ARG QB 1 23 ASP H 3.413 . 4.534 3.492 3.252 3.607 . 0 0 "[ . 1 . 2]" 1
449 1 22 ARG HD2 1 28 LYS H 3.483 . 4.999 4.257 3.371 4.832 . 0 0 "[ . 1 . 2]" 1
450 1 22 ARG HD2 1 28 LYS HB2 2.689 . 6.000 4.526 3.857 5.010 . 0 0 "[ . 1 . 2]" 1
451 1 22 ARG HD2 1 28 LYS HB3 2.663 . 3.549 3.253 2.365 4.327 0.778 8 1 "[ . + 1 . 2]" 1
452 1 22 ARG HD2 1 28 LYS QD 2.447 . 6.000 3.877 3.392 4.471 . 0 0 "[ . 1 . 2]" 1
453 1 22 ARG HD2 1 28 LYS HG2 2.614 . 3.468 2.218 1.947 2.619 . 0 0 "[ . 1 . 2]" 1
454 1 22 ARG HD2 1 28 LYS HG3 2.643 . 3.516 3.538 2.706 3.684 0.168 20 0 "[ . 1 . 2]" 1
455 1 22 ARG HD3 1 22 ARG HE 2.626 . 3.488 2.852 2.606 2.957 . 0 0 "[ . 1 . 2]" 1
456 1 22 ARG HD3 1 22 ARG HG2 2.440 . 3.184 2.517 2.359 3.004 . 0 0 "[ . 1 . 2]" 1
457 1 22 ARG HD3 1 22 ARG HG3 2.571 . 3.397 2.957 2.500 3.016 . 0 0 "[ . 1 . 2]" 1
458 1 22 ARG HE 1 22 ARG HG2 3.199 . 4.478 2.785 2.134 3.479 . 0 0 "[ . 1 . 2]" 1
459 1 22 ARG HE 1 22 ARG HG3 3.173 . 4.432 2.728 2.346 3.660 . 0 0 "[ . 1 . 2]" 1
460 1 22 ARG HE 1 26 GLY HA2 3.254 . 4.577 3.102 2.308 4.234 . 0 0 "[ . 1 . 2]" 1
461 1 22 ARG HG2 1 23 ASP H 3.031 . 4.179 3.454 2.937 4.084 . 0 0 "[ . 1 . 2]" 1
462 1 22 ARG HG2 1 26 GLY H 3.576 . 5.174 4.106 3.482 4.892 . 0 0 "[ . 1 . 2]" 1
463 1 22 ARG HG2 1 26 GLY HA2 2.803 . 3.785 3.318 2.292 3.850 0.065 16 0 "[ . 1 . 2]" 1
464 1 22 ARG HG3 1 23 ASP H 2.953 . 4.043 2.473 2.196 3.132 . 0 0 "[ . 1 . 2]" 1
465 1 22 ARG HG3 1 26 GLY HA2 2.811 . 3.799 3.724 3.008 3.940 0.141 8 0 "[ . 1 . 2]" 1
466 1 22 ARG HG3 1 28 LYS HG3 2.542 . 6.000 4.309 3.000 5.559 . 0 0 "[ . 1 . 2]" 1
467 1 23 ASP H 1 23 ASP HB2 2.365 . 3.064 2.831 2.623 3.033 . 0 0 "[ . 1 . 2]" 1
468 1 23 ASP H 1 23 ASP QB 2.399 . 3.119 2.396 2.328 2.443 . 0 0 "[ . 1 . 2]" 1
469 1 23 ASP H 1 26 GLY H 3.427 . 4.895 3.735 3.568 3.997 . 0 0 "[ . 1 . 2]" 1
470 1 23 ASP H 1 27 THR H 3.154 . 4.398 3.721 3.134 3.969 . 0 0 "[ . 1 . 2]" 1
471 1 23 ASP H 1 27 THR HA 3.214 . 4.505 4.668 4.578 4.720 0.215 9 0 "[ . 1 . 2]" 1
472 1 23 ASP H 1 28 LYS HA 2.141 . 6.000 3.117 2.767 3.475 . 0 0 "[ . 1 . 2]" 1
473 1 23 ASP HA 1 25 ASP H 2.579 . 6.000 4.076 3.770 4.327 . 0 0 "[ . 1 . 2]" 1
474 1 23 ASP QB 1 24 ASP H 2.316 . 6.000 3.240 2.848 3.450 . 0 0 "[ . 1 . 2]" 1
475 1 23 ASP QB 1 25 ASP H 2.541 . 3.348 2.843 2.611 3.108 . 0 0 "[ . 1 . 2]" 1
476 1 23 ASP QB 1 26 GLY H 3.148 . 4.387 3.324 3.059 3.685 . 0 0 "[ . 1 . 2]" 1
477 1 23 ASP QB 1 27 THR H 2.791 . 3.765 3.210 2.828 3.493 . 0 0 "[ . 1 . 2]" 1
478 1 23 ASP QB 1 27 THR HB 2.503 . 3.286 2.889 2.386 3.215 . 0 0 "[ . 1 . 2]" 1
479 1 23 ASP QB 1 29 GLU HG2 3.411 . 4.865 3.660 2.360 4.567 . 0 0 "[ . 1 . 2]" 1
480 1 24 ASP H 1 24 ASP HA 2.658 . 3.541 2.827 2.787 2.868 . 0 0 "[ . 1 . 2]" 1
481 1 24 ASP H 1 24 ASP HB2 2.516 . 3.307 2.757 2.111 3.666 0.359 5 0 "[ . 1 . 2]" 1
482 1 24 ASP H 1 25 ASP H 2.797 . 3.775 2.546 2.407 2.702 . 0 0 "[ . 1 . 2]" 1
483 1 24 ASP HA 1 25 ASP H 2.952 . 4.042 3.409 3.300 3.495 . 0 0 "[ . 1 . 2]" 1
484 1 25 ASP H 1 25 ASP HA 2.412 . 3.139 2.825 2.812 2.870 . 0 0 "[ . 1 . 2]" 1
485 1 25 ASP H 1 25 ASP HB2 2.385 . 3.096 2.648 2.345 3.561 0.465 20 0 "[ . 1 . 2]" 1
486 1 25 ASP H 1 25 ASP HB3 2.567 . 3.390 2.411 2.273 2.685 . 0 0 "[ . 1 . 2]" 1
487 1 25 ASP HA 1 25 ASP HB2 2.020 . 2.530 2.426 2.369 2.555 0.025 19 0 "[ . 1 . 2]" 1
488 1 25 ASP HA 1 26 GLY H 2.955 . 4.046 3.449 3.391 3.475 . 0 0 "[ . 1 . 2]" 1
489 1 25 ASP HB2 1 27 THR H 3.554 . 5.133 4.226 3.873 4.820 . 0 0 "[ . 1 . 2]" 1
490 1 26 GLY H 1 26 GLY HA2 2.218 . 2.833 2.417 2.349 2.461 . 0 0 "[ . 1 . 2]" 1
491 1 26 GLY HA2 1 27 THR H 2.871 . 3.902 3.346 3.127 3.462 . 0 0 "[ . 1 . 2]" 1
492 1 27 THR H 1 27 THR HA 2.479 . 3.247 2.849 2.790 2.936 . 0 0 "[ . 1 . 2]" 1
493 1 27 THR H 1 27 THR HB 2.387 . 3.099 2.454 2.374 2.649 . 0 0 "[ . 1 . 2]" 1
494 1 27 THR H 1 27 THR MG 2.467 . 6.000 3.751 3.706 3.829 . 0 0 "[ . 1 . 2]" 1
495 1 27 THR H 1 28 LYS H 3.275 . 4.616 4.531 4.448 4.629 0.013 19 0 "[ . 1 . 2]" 1
496 1 27 THR H 1 28 LYS HA 3.706 . 5.423 5.331 4.984 5.475 0.052 3 0 "[ . 1 . 2]" 1
497 1 27 THR HA 1 27 THR HB 2.277 . 2.925 3.009 3.003 3.013 0.088 8 0 "[ . 1 . 2]" 1
498 1 27 THR HA 1 27 THR MG 2.064 . 2.596 2.428 2.321 2.492 . 0 0 "[ . 1 . 2]" 1
499 1 27 THR HA 1 28 LYS H 1.912 . 2.369 2.180 2.111 2.285 . 0 0 "[ . 1 . 2]" 1
500 1 27 THR HA 1 28 LYS HB2 3.222 . 6.000 5.190 4.945 5.501 . 0 0 "[ . 1 . 2]" 1
501 1 27 THR HA 1 28 LYS HG2 3.402 . 4.849 4.664 4.262 4.902 0.053 8 0 "[ . 1 . 2]" 1
502 1 27 THR HA 1 28 LYS HG3 2.925 . 3.994 3.515 3.265 3.706 . 0 0 "[ . 1 . 2]" 1
503 1 27 THR HB 1 27 THR MG 1.791 . 2.192 2.133 2.127 2.137 . 0 0 "[ . 1 . 2]" 1
504 1 27 THR HB 1 28 LYS H 2.692 . 6.000 4.192 3.786 4.321 . 0 0 "[ . 1 . 2]" 1
505 1 27 THR MG 1 28 LYS H 2.237 . 2.863 2.666 2.252 2.883 0.020 8 0 "[ . 1 . 2]" 1
506 1 27 THR MG 1 29 GLU HG2 2.839 . 3.847 2.799 2.517 3.148 . 0 0 "[ . 1 . 2]" 1
507 1 27 THR MG 1 29 GLU HG3 2.844 . 3.855 3.462 2.822 4.002 0.147 20 0 "[ . 1 . 2]" 1
508 1 28 LYS H 1 28 LYS HA 2.655 . 3.536 2.904 2.872 2.938 . 0 0 "[ . 1 . 2]" 1
509 1 28 LYS H 1 28 LYS HB2 2.448 . 3.197 3.024 2.819 3.308 0.111 19 0 "[ . 1 . 2]" 1
510 1 28 LYS H 1 28 LYS HB3 2.517 . 6.000 3.623 3.528 3.653 . 0 0 "[ . 1 . 2]" 1
511 1 28 LYS H 1 28 LYS HG2 2.884 . 3.924 3.101 2.606 3.351 . 0 0 "[ . 1 . 2]" 1
512 1 28 LYS H 1 28 LYS HG3 2.806 . 3.790 1.790 1.628 1.971 0.194 12 0 "[ . 1 . 2]" 1
513 1 28 LYS H 1 29 GLU H 3.188 . 4.458 4.430 4.145 4.531 0.073 5 0 "[ . 1 . 2]" 1
514 1 28 LYS HA 1 28 LYS HB2 2.490 . 3.265 2.935 2.823 2.995 . 0 0 "[ . 1 . 2]" 1
515 1 28 LYS HA 1 28 LYS HB3 2.525 . 3.322 2.274 2.224 2.326 . 0 0 "[ . 1 . 2]" 1
516 1 28 LYS HA 1 28 LYS HG2 2.583 . 3.417 3.160 2.873 3.549 0.132 11 0 "[ . 1 . 2]" 1
517 1 28 LYS HA 1 28 LYS HG3 2.633 . 3.500 3.332 3.113 3.547 0.047 20 0 "[ . 1 . 2]" 1
518 1 28 LYS HA 1 29 GLU H 2.106 . 2.660 2.117 2.046 2.247 . 0 0 "[ . 1 . 2]" 1
519 1 28 LYS HB2 1 28 LYS HG2 2.394 . 3.111 2.967 2.840 3.000 . 0 0 "[ . 1 . 2]" 1
520 1 28 LYS HB2 1 29 GLU H 2.966 . 4.066 3.661 3.206 4.018 . 0 0 "[ . 1 . 2]" 1
521 1 28 LYS HB3 1 28 LYS HG2 2.348 . 3.037 2.305 2.193 2.390 . 0 0 "[ . 1 . 2]" 1
522 1 28 LYS HB3 1 29 GLU H 2.893 . 3.939 3.305 2.831 3.780 . 0 0 "[ . 1 . 2]" 1
523 1 28 LYS QD 1 28 LYS HG2 2.317 . 2.988 2.222 2.151 2.304 . 0 0 "[ . 1 . 2]" 1
524 1 28 LYS HG2 1 29 GLU H 3.077 . 6.000 5.002 4.634 5.463 . 0 0 "[ . 1 . 2]" 1
525 1 28 LYS HG3 1 29 GLU H 3.256 . 6.000 5.052 4.952 5.166 . 0 0 "[ . 1 . 2]" 1
526 1 29 GLU H 1 29 GLU HB2 2.566 . 3.389 2.526 2.396 2.711 . 0 0 "[ . 1 . 2]" 1
527 1 29 GLU H 1 29 GLU HB3 3.197 . 4.475 3.677 3.604 3.791 . 0 0 "[ . 1 . 2]" 1
528 1 29 GLU H 1 29 GLU HG2 2.833 . 3.836 3.469 2.820 4.121 0.285 5 0 "[ . 1 . 2]" 1
529 1 29 GLU H 1 30 TRP H 3.385 . 4.817 4.398 4.346 4.460 . 0 0 "[ . 1 . 2]" 1
530 1 29 GLU HB2 1 30 TRP H 2.737 . 3.673 3.476 3.360 3.567 . 0 0 "[ . 1 . 2]" 1
531 1 29 GLU HB2 1 30 TRP HD1 3.140 . 6.000 5.499 5.449 5.633 . 0 0 "[ . 1 . 2]" 1
532 1 29 GLU HB2 1 94 PHE QD 3.112 . 4.322 4.213 3.853 4.410 0.088 20 0 "[ . 1 . 2]" 1
533 1 29 GLU HB3 1 29 GLU HG2 2.331 . 3.010 2.708 2.420 3.003 . 0 0 "[ . 1 . 2]" 1
534 1 29 GLU HB3 1 29 GLU HG3 2.178 . 2.771 2.780 2.462 3.010 0.239 5 0 "[ . 1 . 2]" 1
535 1 29 GLU HB3 1 30 TRP H 2.799 . 3.778 2.192 2.086 2.342 . 0 0 "[ . 1 . 2]" 1
536 1 29 GLU HB3 1 30 TRP HA 3.307 . 4.674 4.025 3.863 4.202 . 0 0 "[ . 1 . 2]" 1
537 1 29 GLU HB3 1 30 TRP HD1 3.192 . 4.465 4.658 4.597 4.729 0.264 12 0 "[ . 1 . 2]" 1
538 1 29 GLU HG2 1 30 TRP H 2.935 . 6.000 4.147 3.785 4.541 . 0 0 "[ . 1 . 2]" 1
539 1 29 GLU HG2 1 30 TRP HD1 3.314 . 6.000 5.500 5.140 5.961 . 0 0 "[ . 1 . 2]" 1
540 1 30 TRP H 1 30 TRP HA 2.906 . 3.961 2.890 2.871 2.904 . 0 0 "[ . 1 . 2]" 1
541 1 30 TRP H 1 30 TRP HB3 3.259 . 4.587 3.437 3.365 3.494 . 0 0 "[ . 1 . 2]" 1
542 1 30 TRP H 1 30 TRP HD1 2.965 . 4.064 2.834 2.678 2.987 . 0 0 "[ . 1 . 2]" 1
543 1 30 TRP H 1 31 ARG H 3.322 . 4.701 4.229 4.177 4.263 . 0 0 "[ . 1 . 2]" 1
544 1 30 TRP HA 1 30 TRP HB2 2.327 . 3.004 2.500 2.474 2.519 . 0 0 "[ . 1 . 2]" 1
545 1 30 TRP HA 1 30 TRP HB3 2.347 . 3.036 2.410 2.380 2.443 . 0 0 "[ . 1 . 2]" 1
546 1 30 TRP HA 1 30 TRP HD1 2.925 . 6.000 4.187 4.140 4.248 . 0 0 "[ . 1 . 2]" 1
547 1 30 TRP HA 1 30 TRP HE3 2.982 . 6.000 4.503 4.415 4.558 . 0 0 "[ . 1 . 2]" 1
548 1 30 TRP HA 1 31 ARG H 2.131 . 2.699 2.192 2.155 2.222 . 0 0 "[ . 1 . 2]" 1
549 1 30 TRP HA 1 31 ARG HA 3.194 . 4.469 4.396 4.368 4.434 . 0 0 "[ . 1 . 2]" 1
550 1 30 TRP HA 1 31 ARG HB2 3.330 . 4.716 4.444 4.367 4.548 . 0 0 "[ . 1 . 2]" 1
551 1 30 TRP HA 1 31 ARG HG3 3.723 . 5.456 3.527 3.378 3.709 . 0 0 "[ . 1 . 2]" 1
552 1 30 TRP HA 1 93 VAL QG 3.648 . 5.311 5.168 5.044 5.233 . 0 0 "[ . 1 . 2]" 1
553 1 30 TRP HA 1 94 PHE QE 2.789 . 3.761 2.479 2.267 2.648 . 0 0 "[ . 1 . 2]" 1
554 1 30 TRP HA 1 94 PHE HZ 2.724 . 3.652 3.331 3.047 3.558 . 0 0 "[ . 1 . 2]" 1
555 1 30 TRP HB2 1 30 TRP HD1 3.065 . 4.239 3.846 3.832 3.855 . 0 0 "[ . 1 . 2]" 1
556 1 30 TRP HB2 1 30 TRP HE3 2.521 . 3.315 2.474 2.438 2.519 . 0 0 "[ . 1 . 2]" 1
557 1 30 TRP HB2 1 31 ARG H 2.563 . 3.384 2.733 2.654 2.798 . 0 0 "[ . 1 . 2]" 1
558 1 30 TRP HB3 1 30 TRP HD1 2.364 . 3.063 2.745 2.721 2.763 . 0 0 "[ . 1 . 2]" 1
559 1 30 TRP HB3 1 30 TRP HE3 2.738 . 6.000 4.036 4.007 4.080 . 0 0 "[ . 1 . 2]" 1
560 1 30 TRP HB3 1 31 ARG H 2.622 . 6.000 3.830 3.740 3.913 . 0 0 "[ . 1 . 2]" 1
561 1 30 TRP HE3 1 31 ARG H 2.740 . 3.678 3.695 3.553 3.764 0.086 11 0 "[ . 1 . 2]" 1
562 1 30 TRP HE3 1 31 ARG HA 2.408 . 6.000 3.575 3.436 3.726 . 0 0 "[ . 1 . 2]" 1
563 1 30 TRP HE3 1 31 ARG HB2 3.562 . 6.000 5.754 5.634 5.885 . 0 0 "[ . 1 . 2]" 1
564 1 30 TRP HE3 1 31 ARG HG3 3.481 . 6.000 5.730 5.571 5.877 . 0 0 "[ . 1 . 2]" 1
565 1 30 TRP HH2 1 38 LYS HD3 3.005 . 4.134 2.171 1.719 4.303 0.169 12 0 "[ . 1 . 2]" 1
566 1 30 TRP HH2 1 38 LYS QE 2.805 . 3.788 2.721 2.383 3.098 . 0 0 "[ . 1 . 2]" 1
567 1 30 TRP HH2 1 38 LYS HG2 3.207 . 4.493 3.548 1.980 3.988 . 0 0 "[ . 1 . 2]" 1
568 1 30 TRP HH2 1 38 LYS HG3 3.169 . 4.424 4.384 2.320 4.648 0.224 18 0 "[ . 1 . 2]" 1
569 1 30 TRP HH2 1 42 ASN HA 2.213 . 2.825 1.874 1.544 2.156 0.057 16 0 "[ . 1 . 2]" 1
570 1 30 TRP HH2 1 43 THR H 2.898 . 3.948 2.561 2.220 3.032 . 0 0 "[ . 1 . 2]" 1
571 1 30 TRP HZ2 1 38 LYS QE 2.888 . 3.931 3.595 3.182 3.967 0.036 6 0 "[ . 1 . 2]" 1
572 1 30 TRP HZ2 1 42 ASN HA 2.307 . 2.972 2.915 2.573 3.054 0.082 11 0 "[ . 1 . 2]" 1
573 1 30 TRP HZ2 1 42 ASN QB 2.759 . 3.711 2.953 2.360 3.151 . 0 0 "[ . 1 . 2]" 1
574 1 30 TRP HZ2 1 42 ASN HB3 2.410 . 3.136 3.086 2.765 3.429 0.293 13 0 "[ . 1 . 2]" 1
575 1 31 ARG H 1 31 ARG HA 2.653 . 3.533 2.905 2.898 2.911 . 0 0 "[ . 1 . 2]" 1
576 1 31 ARG H 1 31 ARG HB2 2.828 . 3.827 2.796 2.747 2.847 . 0 0 "[ . 1 . 2]" 1
577 1 31 ARG H 1 31 ARG HB3 2.935 . 4.012 3.849 3.827 3.880 . 0 0 "[ . 1 . 2]" 1
578 1 31 ARG H 1 31 ARG HD2 3.083 . 6.000 4.581 4.433 4.729 . 0 0 "[ . 1 . 2]" 1
579 1 31 ARG H 1 31 ARG HD3 3.615 . 5.249 5.345 5.305 5.379 0.130 16 0 "[ . 1 . 2]" 1
580 1 31 ARG H 1 31 ARG HG3 3.237 . 4.547 3.050 2.922 3.212 . 0 0 "[ . 1 . 2]" 1
581 1 31 ARG H 1 32 CYS H 3.370 . 4.789 4.288 4.264 4.311 . 0 0 "[ . 1 . 2]" 1
582 1 31 ARG H 1 32 CYS HA 3.675 . 5.363 4.611 4.568 4.667 . 0 0 "[ . 1 . 2]" 1
583 1 31 ARG H 1 93 VAL QG 3.031 . 4.179 3.759 3.681 3.836 . 0 0 "[ . 1 . 2]" 1
584 1 31 ARG H 1 94 PHE HZ 2.593 . 3.434 2.009 1.788 2.157 . 0 0 "[ . 1 . 2]" 1
585 1 31 ARG HA 1 31 ARG HB3 2.681 . 3.580 2.450 2.409 2.502 . 0 0 "[ . 1 . 2]" 1
586 1 31 ARG HA 1 31 ARG HG2 2.878 . 3.913 2.610 2.559 2.740 . 0 0 "[ . 1 . 2]" 1
587 1 31 ARG HA 1 31 ARG HG3 2.760 . 3.712 3.027 2.894 3.184 . 0 0 "[ . 1 . 2]" 1
588 1 31 ARG HA 1 32 CYS QB 3.394 . 6.000 4.600 4.445 4.668 . 0 0 "[ . 1 . 2]" 1
589 1 31 ARG HA 1 93 VAL QG 2.986 . 4.101 4.154 4.079 4.217 0.116 16 0 "[ . 1 . 2]" 1
590 1 31 ARG HB2 1 31 ARG HD2 2.779 . 3.744 2.449 2.317 2.642 . 0 0 "[ . 1 . 2]" 1
591 1 31 ARG HB2 1 31 ARG HD3 2.696 . 3.605 2.966 2.826 3.070 . 0 0 "[ . 1 . 2]" 1
592 1 31 ARG HB2 1 31 ARG HG2 2.752 . 3.699 3.005 3.000 3.009 . 0 0 "[ . 1 . 2]" 1
593 1 31 ARG HB2 1 31 ARG HG3 2.734 . 3.668 2.444 2.420 2.481 . 0 0 "[ . 1 . 2]" 1
594 1 31 ARG HB2 1 32 CYS H 2.921 . 3.987 3.258 3.091 3.410 . 0 0 "[ . 1 . 2]" 1
595 1 31 ARG HB2 1 93 VAL QG 2.284 . 2.936 1.878 1.824 1.949 . 0 0 "[ . 1 . 2]" 1
596 1 31 ARG HB2 1 94 PHE HZ 2.636 . 3.504 2.687 2.497 2.812 . 0 0 "[ . 1 . 2]" 1
597 1 31 ARG HB3 1 31 ARG HD3 2.835 . 3.839 2.547 2.408 2.625 . 0 0 "[ . 1 . 2]" 1
598 1 31 ARG HB3 1 31 ARG HG2 2.617 . 3.473 2.405 2.371 2.429 . 0 0 "[ . 1 . 2]" 1
599 1 31 ARG HB3 1 31 ARG HG3 2.479 . 3.247 2.981 2.976 2.989 . 0 0 "[ . 1 . 2]" 1
600 1 31 ARG HB3 1 32 CYS H 2.638 . 3.508 2.145 2.089 2.225 . 0 0 "[ . 1 . 2]" 1
601 1 31 ARG HB3 1 93 VAL QG 2.359 . 3.055 2.652 2.475 2.823 . 0 0 "[ . 1 . 2]" 1
602 1 31 ARG HD2 1 31 ARG HG3 2.813 . 3.802 2.417 2.326 2.493 . 0 0 "[ . 1 . 2]" 1
603 1 31 ARG HD2 1 93 VAL QG 2.451 . 3.202 2.763 2.468 3.073 . 0 0 "[ . 1 . 2]" 1
604 1 31 ARG HD2 1 94 PHE QD 2.550 . 3.363 2.444 2.259 2.829 . 0 0 "[ . 1 . 2]" 1
605 1 31 ARG HD2 1 94 PHE QE 3.292 . 4.646 2.934 2.754 3.164 . 0 0 "[ . 1 . 2]" 1
606 1 31 ARG HD3 1 31 ARG HG2 2.778 . 3.742 2.448 2.370 2.564 . 0 0 "[ . 1 . 2]" 1
607 1 31 ARG HD3 1 93 VAL QG 2.577 . 3.407 3.251 3.008 3.435 0.028 19 0 "[ . 1 . 2]" 1
608 1 31 ARG HE 1 31 ARG HG2 2.628 . 3.491 2.846 2.402 3.636 0.145 19 0 "[ . 1 . 2]" 1
609 1 31 ARG HE 1 31 ARG HG3 2.610 . 3.462 2.899 2.654 3.547 0.085 1 0 "[ . 1 . 2]" 1
610 1 31 ARG HG2 1 32 CYS H 3.258 . 4.585 4.001 3.886 4.160 . 0 0 "[ . 1 . 2]" 1
611 1 31 ARG HG2 1 93 VAL QG 3.115 . 4.328 4.177 4.078 4.229 . 0 0 "[ . 1 . 2]" 1
612 1 31 ARG HG3 1 32 CYS H 3.196 . 4.473 4.647 4.610 4.704 0.231 20 0 "[ . 1 . 2]" 1
613 1 31 ARG HG3 1 93 VAL HB 2.719 . 6.000 6.173 6.039 6.227 0.227 18 0 "[ . 1 . 2]" 1
614 1 31 ARG HG3 1 93 VAL QG 2.867 . 3.895 3.805 3.669 3.898 0.003 18 0 "[ . 1 . 2]" 1
615 1 32 CYS H 1 32 CYS HA 2.754 . 3.702 2.943 2.936 2.950 . 0 0 "[ . 1 . 2]" 1
616 1 32 CYS H 1 32 CYS QB 2.650 . 3.528 2.865 2.532 3.008 . 0 0 "[ . 1 . 2]" 1
617 1 32 CYS H 1 33 LEU H 3.409 . 4.862 4.300 4.273 4.321 . 0 0 "[ . 1 . 2]" 1
618 1 32 CYS H 1 55 ASN HD22 2.812 . 3.801 2.653 2.185 3.144 . 0 0 "[ . 1 . 2]" 1
619 1 32 CYS H 1 93 VAL QG 3.333 . 4.722 3.320 3.163 3.407 . 0 0 "[ . 1 . 2]" 1
620 1 32 CYS HA 1 32 CYS QB 2.506 . 3.291 2.199 2.160 2.313 . 0 0 "[ . 1 . 2]" 1
621 1 32 CYS HA 1 33 LEU H 2.158 . 2.740 2.042 2.003 2.071 . 0 0 "[ . 1 . 2]" 1
622 1 32 CYS HA 1 33 LEU HB2 3.495 . 5.022 4.049 3.952 4.367 . 0 0 "[ . 1 . 2]" 1
623 1 32 CYS HA 1 36 TYR QD 3.464 . 4.964 4.473 4.363 4.632 . 0 0 "[ . 1 . 2]" 1
624 1 32 CYS HA 1 36 TYR QE 3.784 . 6.000 6.146 6.056 6.247 0.247 12 0 "[ . 1 . 2]" 1
625 1 32 CYS QB 1 33 LEU H 2.907 . 3.635 3.127 3.063 3.194 . 0 0 "[ . 1 . 2]" 1
626 1 32 CYS QB 1 36 TYR H 2.702 . 6.000 3.879 3.697 4.090 . 0 0 "[ . 1 . 2]" 1
627 1 32 CYS QB 1 36 TYR QB 2.706 . 3.412 2.166 2.081 2.276 . 0 0 "[ . 1 . 2]" 1
628 1 32 CYS QB 1 36 TYR QD 2.756 . 6.000 3.712 3.549 3.903 . 0 0 "[ . 1 . 2]" 1
629 1 32 CYS QB 1 37 LYS H 3.448 . 4.507 2.935 2.708 3.156 . 0 0 "[ . 1 . 2]" 1
630 1 32 CYS QB 1 38 LYS HG3 3.375 . 4.799 4.733 4.173 5.372 0.573 4 1 "[ +. 1 . 2]" 1
631 1 33 LEU H 1 33 LEU HA 2.585 . 3.420 2.693 2.671 2.707 . 0 0 "[ . 1 . 2]" 1
632 1 33 LEU H 1 33 LEU HB2 2.504 . 3.288 2.054 1.978 2.351 . 0 0 "[ . 1 . 2]" 1
633 1 33 LEU H 1 33 LEU HB3 2.657 . 3.540 3.383 3.315 3.490 . 0 0 "[ . 1 . 2]" 1
634 1 33 LEU H 1 33 LEU QD 2.591 . 2.995 2.400 2.239 2.850 . 0 0 "[ . 1 . 2]" 1
635 1 33 LEU H 1 33 LEU HG 2.228 . 6.000 4.101 2.089 4.283 . 0 0 "[ . 1 . 2]" 1
636 1 33 LEU H 1 34 LEU H 3.348 . 4.749 4.600 4.546 4.622 . 0 0 "[ . 1 . 2]" 1
637 1 33 LEU H 1 36 TYR H 3.596 . 5.213 4.817 4.665 5.067 . 0 0 "[ . 1 . 2]" 1
638 1 33 LEU H 1 36 TYR QB 3.054 . 4.220 2.675 2.565 2.830 . 0 0 "[ . 1 . 2]" 1
639 1 33 LEU H 1 36 TYR HD2 2.931 . 4.005 3.719 3.595 3.855 . 0 0 "[ . 1 . 2]" 1
640 1 33 LEU H 1 36 TYR QE 3.282 . 6.000 4.829 4.757 4.958 . 0 0 "[ . 1 . 2]" 1
641 1 33 LEU H 1 93 VAL QG 3.518 . 5.065 3.475 3.339 3.588 . 0 0 "[ . 1 . 2]" 1
642 1 33 LEU HA 1 33 LEU HB2 2.545 . 3.354 2.888 2.855 2.982 . 0 0 "[ . 1 . 2]" 1
643 1 33 LEU HA 1 33 LEU HB3 2.309 . 2.975 2.743 2.528 2.793 . 0 0 "[ . 1 . 2]" 1
644 1 33 LEU HA 1 33 LEU QD . . 2.494 1.697 1.611 1.755 0.161 6 0 "[ . 1 . 2]" 1
645 1 33 LEU HA 1 93 VAL QG 2.605 . 2.640 1.817 1.730 1.910 0.027 20 0 "[ . 1 . 2]" 1
646 1 33 LEU HB2 1 33 LEU QD 2.176 . 2.768 2.087 2.059 2.316 . 0 0 "[ . 1 . 2]" 1
647 1 33 LEU HB2 1 33 LEU HG 2.610 . 3.462 2.958 2.357 2.999 . 0 0 "[ . 1 . 2]" 1
648 1 33 LEU HB2 1 34 LEU H 2.832 . 3.834 3.776 3.465 3.839 0.005 1 0 "[ . 1 . 2]" 1
649 1 33 LEU HB2 1 36 TYR H 3.056 . 6.000 4.819 4.274 5.045 . 0 0 "[ . 1 . 2]" 1
650 1 33 LEU HB2 1 36 TYR QD 2.403 . 3.125 3.129 2.894 3.197 0.072 6 0 "[ . 1 . 2]" 1
651 1 33 LEU HB2 1 36 TYR HD2 3.022 . 4.164 3.362 3.229 3.497 . 0 0 "[ . 1 . 2]" 1
652 1 33 LEU HB2 1 36 TYR QE 3.117 . 3.596 3.539 3.260 3.665 0.069 5 0 "[ . 1 . 2]" 1
653 1 33 LEU HB2 1 93 VAL QG 3.178 . 4.440 3.953 3.854 4.051 . 0 0 "[ . 1 . 2]" 1
654 1 33 LEU HB3 1 33 LEU QD 2.195 . 2.797 2.426 2.146 2.480 . 0 0 "[ . 1 . 2]" 1
655 1 33 LEU HB3 1 33 LEU HG 2.502 . 3.284 2.359 2.300 2.981 . 0 0 "[ . 1 . 2]" 1
656 1 33 LEU HB3 1 34 LEU H 2.141 . 2.714 2.361 2.130 2.454 . 0 0 "[ . 1 . 2]" 1
657 1 33 LEU HB3 1 36 TYR QB 3.465 . 4.966 3.640 3.481 4.150 . 0 0 "[ . 1 . 2]" 1
658 1 33 LEU HB3 1 36 TYR QD 3.377 . 4.802 3.063 2.810 3.572 . 0 0 "[ . 1 . 2]" 1
659 1 33 LEU HB3 1 36 TYR QE 2.783 . 3.751 3.167 3.011 3.473 . 0 0 "[ . 1 . 2]" 1
660 1 33 LEU HB3 1 93 VAL QG 3.028 . 4.174 3.608 3.320 3.745 . 0 0 "[ . 1 . 2]" 1
661 1 33 LEU QD 1 33 LEU HG 2.125 . 2.581 1.896 1.876 1.900 . 0 0 "[ . 1 . 2]" 1
662 1 33 LEU QD 1 34 LEU H 2.992 . 4.111 3.306 2.982 3.403 . 0 0 "[ . 1 . 2]" 1
663 1 33 LEU QD 1 36 TYR QE 3.269 . 3.497 3.317 3.025 3.453 . 0 0 "[ . 1 . 2]" 1
664 1 33 LEU QD 1 90 TYR QB 2.351 . 3.042 2.369 2.074 2.467 . 0 0 "[ . 1 . 2]" 1
665 1 33 LEU QD 1 90 TYR QD 2.463 . 6.000 2.301 2.138 2.478 . 0 0 "[ . 1 . 2]" 1
666 1 33 LEU QD 1 93 VAL HB 2.906 . 3.962 3.217 3.173 3.292 . 0 0 "[ . 1 . 2]" 1
667 1 33 LEU QD 1 93 VAL QG 2.241 . 2.869 1.822 1.625 1.883 . 0 0 "[ . 1 . 2]" 1
668 1 33 LEU QD 1 94 PHE QE 3.075 . 4.257 3.000 2.870 3.202 . 0 0 "[ . 1 . 2]" 1
669 1 33 LEU HG 1 34 LEU H 3.172 . 4.430 3.000 2.697 4.611 0.181 18 0 "[ . 1 . 2]" 1
670 1 34 LEU H 1 34 LEU HB2 2.645 . 3.520 2.523 2.495 2.549 . 0 0 "[ . 1 . 2]" 1
671 1 34 LEU H 1 34 LEU HB3 2.810 . 3.797 3.582 3.569 3.603 . 0 0 "[ . 1 . 2]" 1
672 1 34 LEU H 1 34 LEU MD1 2.588 . 6.000 3.668 3.623 3.728 . 0 0 "[ . 1 . 2]" 1
673 1 34 LEU H 1 34 LEU HG 2.516 . 3.308 2.180 2.100 2.272 . 0 0 "[ . 1 . 2]" 1
674 1 34 LEU H 1 93 VAL H 3.903 . 5.807 5.514 5.193 5.817 0.010 15 0 "[ . 1 . 2]" 1
675 1 34 LEU H 1 93 VAL HA 3.782 . 5.570 5.446 5.237 5.612 0.042 16 0 "[ . 1 . 2]" 1
676 1 34 LEU H 1 93 VAL QG . . 2.969 2.492 2.326 2.647 . 0 0 "[ . 1 . 2]" 1
677 1 34 LEU HA 1 34 LEU HB2 2.679 . 3.576 3.009 3.004 3.013 . 0 0 "[ . 1 . 2]" 1
678 1 34 LEU HA 1 34 LEU HB3 2.646 . 3.521 2.453 2.437 2.476 . 0 0 "[ . 1 . 2]" 1
679 1 34 LEU HA 1 35 GLY H 2.173 . 2.763 2.081 2.059 2.107 . 0 0 "[ . 1 . 2]" 1
680 1 34 LEU HA 1 36 TYR H 2.686 . 3.588 3.430 3.352 3.522 . 0 0 "[ . 1 . 2]" 1
681 1 34 LEU HB2 1 34 LEU MD1 2.345 . 3.033 2.396 2.339 2.443 . 0 0 "[ . 1 . 2]" 1
682 1 34 LEU HB2 1 34 LEU MD2 2.609 . 3.460 3.188 3.180 3.197 . 0 0 "[ . 1 . 2]" 1
683 1 34 LEU HB2 1 35 GLY H 3.122 . 4.340 4.269 4.221 4.319 . 0 0 "[ . 1 . 2]" 1
684 1 34 LEU HB2 1 93 VAL QG 2.995 . 4.116 3.947 3.826 4.091 . 0 0 "[ . 1 . 2]" 1
685 1 34 LEU HB3 1 34 LEU MD1 2.293 . 2.950 2.288 2.234 2.333 . 0 0 "[ . 1 . 2]" 1
686 1 34 LEU HB3 1 34 LEU MD2 2.494 . 3.272 2.456 2.403 2.500 . 0 0 "[ . 1 . 2]" 1
687 1 34 LEU HB3 1 34 LEU HG 2.705 . 3.620 3.012 3.006 3.016 . 0 0 "[ . 1 . 2]" 1
688 1 34 LEU HB3 1 35 GLY H 2.926 . 3.997 3.444 3.329 3.546 . 0 0 "[ . 1 . 2]" 1
689 1 34 LEU HB3 1 74 SER HA 3.254 . 4.577 3.417 2.451 4.217 . 0 0 "[ . 1 . 2]" 1
690 1 34 LEU MD1 1 34 LEU MD2 1.896 . 2.345 2.075 2.069 2.083 . 0 0 "[ . 1 . 2]" 1
691 1 34 LEU MD1 1 34 LEU HG 2.381 . 3.089 2.112 2.107 2.117 . 0 0 "[ . 1 . 2]" 1
692 1 34 LEU MD1 1 35 GLY H 3.322 . 6.000 5.048 4.956 5.159 . 0 0 "[ . 1 . 2]" 1
693 1 34 LEU MD1 1 36 TYR QE 3.594 . 6.000 6.047 5.849 6.113 0.113 20 0 "[ . 1 . 2]" 1
694 1 34 LEU MD1 1 60 ASP H 3.664 . 6.000 6.069 5.922 6.122 0.122 8 0 "[ . 1 . 2]" 1
695 1 34 LEU MD1 1 79 CYS H 3.172 . 4.430 3.534 3.093 3.990 . 0 0 "[ . 1 . 2]" 1
696 1 34 LEU MD1 1 79 CYS HB2 3.480 . 4.994 4.245 3.277 4.545 . 0 0 "[ . 1 . 2]" 1
697 1 34 LEU MD1 1 79 CYS HB3 3.244 . 4.560 3.860 3.287 4.420 . 0 0 "[ . 1 . 2]" 1
698 1 34 LEU MD1 1 91 GLU HA 3.206 . 4.491 4.060 3.848 4.229 . 0 0 "[ . 1 . 2]" 1
699 1 34 LEU MD1 1 91 GLU HB2 2.331 . 3.010 1.636 1.585 1.683 0.067 15 0 "[ . 1 . 2]" 1
700 1 34 LEU MD1 1 91 GLU HB3 2.556 . 3.373 2.528 2.436 2.722 . 0 0 "[ . 1 . 2]" 1
701 1 34 LEU MD1 1 91 GLU HG2 2.748 . 3.692 3.638 3.449 3.743 0.051 11 0 "[ . 1 . 2]" 1
702 1 34 LEU MD1 1 91 GLU HG3 2.723 . 3.650 2.640 2.260 3.029 . 0 0 "[ . 1 . 2]" 1
703 1 34 LEU MD1 1 93 VAL H 3.464 . 4.964 4.060 3.795 4.385 . 0 0 "[ . 1 . 2]" 1
704 1 34 LEU MD1 1 93 VAL QG 2.385 . 3.096 3.203 3.136 3.260 0.164 16 0 "[ . 1 . 2]" 1
705 1 34 LEU MD2 1 34 LEU HG 1.977 . 2.465 2.122 2.118 2.126 . 0 0 "[ . 1 . 2]" 1
706 1 34 LEU MD2 1 35 GLY H 2.586 . 3.422 3.519 3.494 3.551 0.129 5 0 "[ . 1 . 2]" 1
707 1 34 LEU MD2 1 58 GLY H 3.686 . 5.384 4.917 4.731 5.068 . 0 0 "[ . 1 . 2]" 1
708 1 34 LEU MD2 1 58 GLY HA2 2.682 . 6.000 4.209 4.031 4.364 . 0 0 "[ . 1 . 2]" 1
709 1 34 LEU MD2 1 59 CYS H 2.897 . 3.946 3.918 3.797 3.975 0.029 19 0 "[ . 1 . 2]" 1
710 1 34 LEU MD2 1 59 CYS HA 2.597 . 3.440 2.525 2.407 2.623 . 0 0 "[ . 1 . 2]" 1
711 1 34 LEU MD2 1 59 CYS HB2 3.547 . 5.119 4.042 2.739 4.176 . 0 0 "[ . 1 . 2]" 1
712 1 34 LEU MD2 1 60 ASP H 3.303 . 4.667 4.207 4.051 4.318 . 0 0 "[ . 1 . 2]" 1
713 1 34 LEU MD2 1 77 ILE HB 2.644 . 3.518 3.530 3.352 3.584 0.066 11 0 "[ . 1 . 2]" 1
714 1 34 LEU MD2 1 93 VAL H 3.301 . 4.663 3.128 2.881 3.356 . 0 0 "[ . 1 . 2]" 1
715 1 34 LEU MD2 1 93 VAL HA 2.982 . 4.093 2.836 2.759 2.916 . 0 0 "[ . 1 . 2]" 1
716 1 34 LEU MD2 1 94 PHE HE1 2.903 . 6.000 6.136 6.086 6.197 0.197 10 0 "[ . 1 . 2]" 1
717 1 34 LEU HG 1 91 GLU HB2 3.301 . 4.663 2.990 2.767 3.279 . 0 0 "[ . 1 . 2]" 1
718 1 34 LEU HG 1 91 GLU HG3 3.610 . 5.239 3.869 3.612 4.222 . 0 0 "[ . 1 . 2]" 1
719 1 34 LEU HG 1 93 VAL H 3.347 . 4.747 4.165 3.800 4.574 . 0 0 "[ . 1 . 2]" 1
720 1 34 LEU HG 1 93 VAL QG 2.066 . 2.599 2.272 2.131 2.412 . 0 0 "[ . 1 . 2]" 1
721 1 35 GLY H 1 35 GLY HA3 2.523 . 3.318 2.882 2.861 2.913 . 0 0 "[ . 1 . 2]" 1
722 1 35 GLY H 1 36 TYR H 2.425 . 3.160 2.499 2.385 2.599 . 0 0 "[ . 1 . 2]" 1
723 1 35 GLY H 1 50 PRO QG 3.616 . 5.250 4.246 3.727 4.469 . 0 0 "[ . 1 . 2]" 1
724 1 35 GLY HA3 1 36 TYR H 2.846 . 3.858 3.373 3.264 3.442 . 0 0 "[ . 1 . 2]" 1
725 1 36 TYR H 1 36 TYR HA 2.541 . 3.348 2.920 2.901 2.937 . 0 0 "[ . 1 . 2]" 1
726 1 36 TYR H 1 36 TYR QB 2.599 . 3.268 2.315 2.267 2.463 . 0 0 "[ . 1 . 2]" 1
727 1 36 TYR H 1 36 TYR QD 2.528 . 3.327 2.353 2.193 2.520 . 0 0 "[ . 1 . 2]" 1
728 1 36 TYR H 1 36 TYR HD2 2.336 . 6.000 5.169 5.077 5.259 . 0 0 "[ . 1 . 2]" 1
729 1 36 TYR H 1 36 TYR QE 2.814 . 6.000 4.687 4.533 4.848 . 0 0 "[ . 1 . 2]" 1
730 1 36 TYR H 1 37 LYS H 3.120 . 6.000 4.483 4.436 4.516 . 0 0 "[ . 1 . 2]" 1
731 1 36 TYR H 1 37 LYS HA 3.501 . 6.000 5.230 5.112 5.350 . 0 0 "[ . 1 . 2]" 1
732 1 36 TYR H 1 46 GLU HA 3.478 . 4.990 4.961 4.738 5.104 0.114 11 0 "[ . 1 . 2]" 1
733 1 36 TYR H 1 47 ASN H 3.503 . 5.037 4.272 4.124 4.493 . 0 0 "[ . 1 . 2]" 1
734 1 36 TYR H 1 58 GLY HA2 3.231 . 4.536 3.897 3.610 4.214 . 0 0 "[ . 1 . 2]" 1
735 1 36 TYR H 1 73 ASN HB2 2.871 . 6.000 5.545 4.418 6.101 0.101 4 0 "[ . 1 . 2]" 1
736 1 36 TYR H 1 73 ASN HB3 2.393 . 6.000 5.866 4.826 6.158 0.158 15 0 "[ . 1 . 2]" 1
737 1 36 TYR H 1 74 SER HA 3.516 . 5.061 4.949 4.491 5.119 0.058 13 0 "[ . 1 . 2]" 1
738 1 36 TYR HA 1 36 TYR QB 2.627 . 3.490 2.418 2.364 2.440 . 0 0 "[ . 1 . 2]" 1
739 1 36 TYR HA 1 36 TYR QD 3.674 . 5.361 2.987 2.891 3.050 . 0 0 "[ . 1 . 2]" 1
740 1 36 TYR HA 1 36 TYR HD2 2.466 . 6.000 3.865 3.756 3.993 . 0 0 "[ . 1 . 2]" 1
741 1 36 TYR HA 1 36 TYR QE 2.882 . 6.000 4.607 4.543 4.686 . 0 0 "[ . 1 . 2]" 1
742 1 36 TYR HA 1 37 LYS H 2.202 . 2.808 2.539 2.450 2.623 . 0 0 "[ . 1 . 2]" 1
743 1 36 TYR HA 1 37 LYS QG 2.951 . 4.039 3.643 3.258 3.954 . 0 0 "[ . 1 . 2]" 1
744 1 36 TYR HA 1 45 VAL H 3.246 . 4.563 4.382 4.161 4.593 0.030 9 0 "[ . 1 . 2]" 1
745 1 36 TYR HA 1 46 GLU HA 2.395 . 3.112 2.582 2.358 2.782 . 0 0 "[ . 1 . 2]" 1
746 1 36 TYR HA 1 47 ASN H 2.333 . 3.013 1.702 1.593 2.137 0.060 12 0 "[ . 1 . 2]" 1
747 1 36 TYR HA 1 47 ASN HB2 3.088 . 4.280 3.062 2.729 3.351 . 0 0 "[ . 1 . 2]" 1
748 1 36 TYR HA 1 47 ASN HB3 3.145 . 4.381 2.908 2.665 3.226 . 0 0 "[ . 1 . 2]" 1
749 1 36 TYR QB 1 36 TYR QD 2.236 . 2.861 2.144 2.126 2.176 . 0 0 "[ . 1 . 2]" 1
750 1 36 TYR QB 1 36 TYR HD2 2.746 . 3.465 2.231 2.187 2.263 . 0 0 "[ . 1 . 2]" 1
751 1 36 TYR QB 1 37 LYS H 2.764 . 3.152 2.060 1.873 2.187 . 0 0 "[ . 1 . 2]" 1
752 1 36 TYR QB 1 44 CYS HB3 2.900 . 3.951 2.853 2.500 4.327 0.376 12 0 "[ . 1 . 2]" 1
753 1 36 TYR QB 1 45 VAL H 3.188 . 4.459 2.982 2.574 3.080 . 0 0 "[ . 1 . 2]" 1
754 1 36 TYR QD 1 37 LYS H 3.059 . 4.229 3.643 3.515 3.707 . 0 0 "[ . 1 . 2]" 1
755 1 36 TYR QD 1 44 CYS HA 3.344 . 4.742 4.558 4.369 4.757 0.015 5 0 "[ . 1 . 2]" 1
756 1 36 TYR QD 1 45 VAL H 3.469 . 4.973 3.246 3.137 3.307 . 0 0 "[ . 1 . 2]" 1
757 1 36 TYR QD 1 45 VAL HA 2.456 . 3.210 3.114 2.991 3.227 0.017 8 0 "[ . 1 . 2]" 1
758 1 36 TYR QD 1 45 VAL MG1 3.081 . 6.000 4.771 4.664 4.835 . 0 0 "[ . 1 . 2]" 1
759 1 36 TYR QD 1 46 GLU HA 2.227 . 6.000 3.326 3.207 3.434 . 0 0 "[ . 1 . 2]" 1
760 1 36 TYR QD 1 47 ASN H 3.137 . 4.367 3.902 3.666 4.073 . 0 0 "[ . 1 . 2]" 1
761 1 36 TYR QD 1 74 SER HA 3.675 . 5.363 3.827 3.356 4.366 . 0 0 "[ . 1 . 2]" 1
762 1 36 TYR QD 1 74 SER HB3 3.761 . 5.529 4.804 3.413 5.691 0.162 3 0 "[ . 1 . 2]" 1
763 1 36 TYR HD2 1 37 LYS H 2.812 . 3.800 3.728 3.577 3.809 0.009 15 0 "[ . 1 . 2]" 1
764 1 36 TYR HD2 1 45 VAL H 3.106 . 4.312 3.255 3.146 3.316 . 0 0 "[ . 1 . 2]" 1
765 1 36 TYR HD2 1 45 VAL HA 2.975 . 4.081 3.119 2.995 3.234 . 0 0 "[ . 1 . 2]" 1
766 1 36 TYR HD2 1 45 VAL MG2 3.172 . 6.000 4.659 4.557 4.731 . 0 0 "[ . 1 . 2]" 1
767 1 36 TYR HD2 1 46 GLU H 2.996 . 4.118 4.021 3.846 4.127 0.009 15 0 "[ . 1 . 2]" 1
768 1 36 TYR HD2 1 46 GLU HA 2.829 . 3.829 3.684 3.525 3.864 0.035 15 0 "[ . 1 . 2]" 1
769 1 36 TYR HD2 1 47 ASN H 3.291 . 6.000 4.872 4.639 5.265 . 0 0 "[ . 1 . 2]" 1
770 1 36 TYR QE 1 37 LYS H 3.293 . 6.000 5.634 5.568 5.709 . 0 0 "[ . 1 . 2]" 1
771 1 36 TYR QE 1 45 VAL H 3.596 . 5.213 5.213 5.173 5.267 0.054 18 0 "[ . 1 . 2]" 1
772 1 36 TYR QE 1 45 VAL HA 2.749 . 3.694 3.697 3.581 3.800 0.106 18 0 "[ . 1 . 2]" 1
773 1 36 TYR QE 1 45 VAL MG1 3.385 . 6.000 5.301 5.165 5.366 . 0 0 "[ . 1 . 2]" 1
774 1 36 TYR QE 1 45 VAL MG2 3.419 . 6.000 5.738 5.665 5.867 . 0 0 "[ . 1 . 2]" 1
775 1 36 TYR QE 1 46 GLU H 3.073 . 4.254 3.995 3.833 4.193 . 0 0 "[ . 1 . 2]" 1
776 1 36 TYR QE 1 46 GLU HA 3.088 . 4.280 3.760 3.644 3.855 . 0 0 "[ . 1 . 2]" 1
777 1 36 TYR QE 1 46 GLU QB 3.356 . 4.612 4.216 3.968 4.374 . 0 0 "[ . 1 . 2]" 1
778 1 36 TYR QE 1 46 GLU QG 2.924 . 3.555 2.875 2.688 3.076 . 0 0 "[ . 1 . 2]" 1
779 1 36 TYR QE 1 74 SER HB2 3.057 . 4.225 3.226 1.925 4.530 0.305 13 0 "[ . 1 . 2]" 1
780 1 36 TYR QE 1 74 SER HB3 3.400 . 4.845 3.296 1.898 4.071 0.057 8 0 "[ . 1 . 2]" 1
781 1 37 LYS H 1 37 LYS HA 2.556 . 3.373 2.888 2.856 2.908 . 0 0 "[ . 1 . 2]" 1
782 1 37 LYS H 1 37 LYS HB2 2.956 . 4.048 3.950 3.884 4.030 . 0 0 "[ . 1 . 2]" 1
783 1 37 LYS H 1 37 LYS HB3 3.009 . 4.141 3.334 3.259 3.517 . 0 0 "[ . 1 . 2]" 1
784 1 37 LYS H 1 37 LYS HD2 3.348 . 6.000 5.211 5.086 5.394 . 0 0 "[ . 1 . 2]" 1
785 1 37 LYS H 1 37 LYS HD3 2.843 . 6.000 4.829 4.660 5.148 . 0 0 "[ . 1 . 2]" 1
786 1 37 LYS H 1 37 LYS HE2 3.530 . 6.000 5.146 4.801 5.475 . 0 0 "[ . 1 . 2]" 1
787 1 37 LYS H 1 37 LYS HE3 3.520 . 6.000 5.475 5.165 5.944 . 0 0 "[ . 1 . 2]" 1
788 1 37 LYS H 1 37 LYS HG2 2.304 . 2.968 2.674 2.448 3.040 0.072 12 0 "[ . 1 . 2]" 1
789 1 37 LYS H 1 37 LYS QG 2.380 . 3.088 2.558 2.369 2.794 . 0 0 "[ . 1 . 2]" 1
790 1 37 LYS H 1 38 LYS H 3.373 . 4.795 4.345 4.304 4.374 . 0 0 "[ . 1 . 2]" 1
791 1 37 LYS H 1 44 CYS HA 2.831 . 3.833 3.871 3.459 4.003 0.170 9 0 "[ . 1 . 2]" 1
792 1 37 LYS H 1 44 CYS HB3 3.217 . 4.511 3.815 3.404 5.465 0.954 12 2 "[ . 1 + . - 2]" 1
793 1 37 LYS H 1 45 VAL H 2.401 . 3.122 2.384 2.141 2.519 . 0 0 "[ . 1 . 2]" 1
794 1 37 LYS H 1 45 VAL HB 3.569 . 5.162 5.133 5.034 5.200 0.038 5 0 "[ . 1 . 2]" 1
795 1 37 LYS H 1 45 VAL MG1 3.176 . 6.000 5.030 4.872 5.130 . 0 0 "[ . 1 . 2]" 1
796 1 37 LYS H 1 45 VAL MG2 2.588 . 3.426 3.204 3.092 3.309 . 0 0 "[ . 1 . 2]" 1
797 1 37 LYS H 1 46 GLU HA 2.906 . 6.000 4.130 3.796 4.412 . 0 0 "[ . 1 . 2]" 1
798 1 37 LYS H 1 47 ASN H 3.129 . 4.353 3.502 3.092 4.099 . 0 0 "[ . 1 . 2]" 1
799 1 37 LYS H 1 47 ASN HA 3.445 . 4.928 4.771 4.102 4.975 0.047 10 0 "[ . 1 . 2]" 1
800 1 37 LYS H 1 47 ASN HB2 3.047 . 4.207 3.243 3.065 3.473 . 0 0 "[ . 1 . 2]" 1
801 1 37 LYS H 1 47 ASN HB3 3.319 . 4.696 4.227 3.811 4.667 . 0 0 "[ . 1 . 2]" 1
802 1 37 LYS HA 1 38 LYS H 2.073 . 2.610 2.446 2.336 2.600 . 0 0 "[ . 1 . 2]" 1
803 1 37 LYS HA 1 47 ASN HB2 3.265 . 4.597 3.979 3.798 4.233 . 0 0 "[ . 1 . 2]" 1
804 1 37 LYS HB2 1 37 LYS HD2 2.668 . 3.558 2.400 2.256 2.521 . 0 0 "[ . 1 . 2]" 1
805 1 37 LYS HB2 1 37 LYS HE3 3.438 . 4.916 4.024 2.008 4.308 . 0 0 "[ . 1 . 2]" 1
806 1 37 LYS HB2 1 37 LYS QG 2.399 . 3.119 2.362 2.320 2.412 . 0 0 "[ . 1 . 2]" 1
807 1 37 LYS HB2 1 38 LYS H 2.648 . 3.525 2.575 2.232 2.854 . 0 0 "[ . 1 . 2]" 1
808 1 37 LYS HB2 1 38 LYS HB2 2.690 . 6.000 4.502 4.122 4.703 . 0 0 "[ . 1 . 2]" 1
809 1 37 LYS HB2 1 45 VAL MG2 3.209 . 4.496 4.414 4.159 4.616 0.120 5 0 "[ . 1 . 2]" 1
810 1 37 LYS HB2 1 47 ASN HB2 2.767 . 3.724 3.515 3.343 3.991 0.267 12 0 "[ . 1 . 2]" 1
811 1 37 LYS HB2 1 47 ASN HD21 3.235 . 4.543 4.102 3.724 4.558 0.015 5 0 "[ . 1 . 2]" 1
812 1 37 LYS HB2 1 47 ASN HD22 3.161 . 6.000 4.732 4.485 4.990 . 0 0 "[ . 1 . 2]" 1
813 1 37 LYS HB3 1 37 LYS HD2 2.534 . 3.336 2.929 2.563 3.057 . 0 0 "[ . 1 . 2]" 1
814 1 37 LYS HB3 1 37 LYS HD3 2.471 . 3.234 2.683 2.476 3.659 0.425 12 0 "[ . 1 . 2]" 1
815 1 37 LYS HB3 1 37 LYS QG 2.242 . 2.870 2.319 2.237 2.365 . 0 0 "[ . 1 . 2]" 1
816 1 37 LYS HB3 1 38 LYS H 2.523 . 6.000 3.910 3.668 4.125 . 0 0 "[ . 1 . 2]" 1
817 1 37 LYS HB3 1 45 VAL MG2 3.187 . 4.457 4.494 4.395 4.618 0.161 12 0 "[ . 1 . 2]" 1
818 1 37 LYS HB3 1 47 ASN HB2 2.891 . 3.936 2.003 1.784 2.601 0.062 5 0 "[ . 1 . 2]" 1
819 1 37 LYS HB3 1 47 ASN HD21 3.411 . 4.865 2.606 2.123 3.131 . 0 0 "[ . 1 . 2]" 1
820 1 37 LYS HB3 1 47 ASN HD22 3.292 . 4.646 3.617 3.272 3.968 . 0 0 "[ . 1 . 2]" 1
821 1 37 LYS HD2 1 37 LYS HE3 2.558 . 3.376 2.457 2.377 2.526 . 0 0 "[ . 1 . 2]" 1
822 1 37 LYS HD2 1 37 LYS QG 2.197 . 2.801 2.405 2.351 2.457 . 0 0 "[ . 1 . 2]" 1
823 1 37 LYS HD2 1 45 VAL MG2 2.937 . 6.000 4.260 3.886 4.602 . 0 0 "[ . 1 . 2]" 1
824 1 37 LYS HD2 1 47 ASN HA 3.148 . 4.387 4.356 3.935 4.498 0.111 3 0 "[ . 1 . 2]" 1
825 1 37 LYS HD2 1 47 ASN HB2 2.918 . 3.983 3.652 3.430 4.119 0.136 8 0 "[ . 1 . 2]" 1
826 1 37 LYS HD2 1 47 ASN HB3 3.174 . 6.000 5.173 4.872 5.650 . 0 0 "[ . 1 . 2]" 1
827 1 37 LYS HD2 1 47 ASN HD21 3.265 . 4.597 4.519 3.328 4.698 0.101 9 0 "[ . 1 . 2]" 1
828 1 37 LYS HD2 1 47 ASN HD22 3.340 . 4.734 4.402 3.195 4.627 . 0 0 "[ . 1 . 2]" 1
829 1 37 LYS HD3 1 37 LYS HE2 2.540 . 3.346 2.436 2.376 2.514 . 0 0 "[ . 1 . 2]" 1
830 1 37 LYS HD3 1 37 LYS QG 2.239 . 2.866 2.279 2.154 2.343 . 0 0 "[ . 1 . 2]" 1
831 1 37 LYS HD3 1 38 LYS H 3.295 . 6.000 5.553 5.174 5.817 . 0 0 "[ . 1 . 2]" 1
832 1 37 LYS HD3 1 45 VAL MG2 3.023 . 4.166 4.103 3.643 4.226 0.060 7 0 "[ . 1 . 2]" 1
833 1 37 LYS HD3 1 47 ASN HB3 3.444 . 4.927 3.816 3.437 5.000 0.073 12 0 "[ . 1 . 2]" 1
834 1 37 LYS HD3 1 47 ASN HD21 3.554 . 5.133 3.650 3.069 4.369 . 0 0 "[ . 1 . 2]" 1
835 1 37 LYS HD3 1 47 ASN HD22 3.596 . 5.212 3.579 3.103 4.293 . 0 0 "[ . 1 . 2]" 1
836 1 37 LYS HE2 1 37 LYS QG 2.260 . 2.899 2.446 2.333 2.558 . 0 0 "[ . 1 . 2]" 1
837 1 37 LYS HE2 1 45 VAL H 3.970 . 5.940 5.702 5.306 5.967 0.027 8 0 "[ . 1 . 2]" 1
838 1 37 LYS HE3 1 37 LYS QG 2.593 . 3.433 2.370 2.239 2.672 . 0 0 "[ . 1 . 2]" 1
839 1 37 LYS QG 1 38 LYS H 2.941 . 4.022 3.418 2.965 3.705 . 0 0 "[ . 1 . 2]" 1
840 1 37 LYS QG 1 45 VAL H 3.163 . 4.414 3.463 3.311 3.616 . 0 0 "[ . 1 . 2]" 1
841 1 37 LYS QG 1 45 VAL MG2 2.127 . 2.693 2.202 2.109 2.332 . 0 0 "[ . 1 . 2]" 1
842 1 37 LYS QG 1 47 ASN H 3.557 . 5.138 3.443 3.131 3.866 . 0 0 "[ . 1 . 2]" 1
843 1 37 LYS QG 1 47 ASN HB2 2.640 . 3.511 1.906 1.692 2.206 0.077 12 0 "[ . 1 . 2]" 1
844 1 37 LYS QG 1 47 ASN HB3 2.798 . 3.776 3.520 3.327 3.785 0.009 5 0 "[ . 1 . 2]" 1
845 1 37 LYS QG 1 47 ASN HD22 3.525 . 5.078 4.798 3.977 5.093 0.015 6 0 "[ . 1 . 2]" 1
846 1 37 LYS HG2 1 45 VAL H 2.969 . 4.071 3.963 3.741 4.479 0.408 12 0 "[ . 1 . 2]" 1
847 1 38 LYS H 1 38 LYS HA 2.353 . 3.045 2.850 2.798 2.890 . 0 0 "[ . 1 . 2]" 1
848 1 38 LYS H 1 38 LYS HB3 2.319 . 6.000 3.591 3.546 3.620 . 0 0 "[ . 1 . 2]" 1
849 1 38 LYS H 1 38 LYS HD2 3.181 . 4.446 4.474 2.568 4.749 0.303 14 0 "[ . 1 . 2]" 1
850 1 38 LYS H 1 38 LYS HD3 3.161 . 6.000 4.629 2.345 4.994 . 0 0 "[ . 1 . 2]" 1
851 1 38 LYS H 1 38 LYS HG2 2.808 . 3.794 3.033 2.577 4.059 0.265 3 0 "[ . 1 . 2]" 1
852 1 38 LYS H 1 38 LYS HG3 2.330 . 3.009 2.593 2.398 3.233 0.224 12 0 "[ . 1 . 2]" 1
853 1 38 LYS H 1 45 VAL MG2 3.402 . 4.849 4.629 4.425 4.819 . 0 0 "[ . 1 . 2]" 1
854 1 38 LYS HA 1 38 LYS HB3 2.487 . 3.260 2.447 2.397 2.538 . 0 0 "[ . 1 . 2]" 1
855 1 38 LYS HA 1 38 LYS HD2 2.980 . 4.090 3.948 3.098 4.379 0.289 16 0 "[ . 1 . 2]" 1
856 1 38 LYS HA 1 38 LYS HD3 2.895 . 3.942 3.976 3.736 4.285 0.343 1 0 "[ . 1 . 2]" 1
857 1 38 LYS HA 1 38 LYS HG3 2.513 . 3.302 3.320 2.146 3.575 0.273 15 0 "[ . 1 . 2]" 1
858 1 38 LYS HA 1 39 GLY H 2.011 . 2.516 2.138 2.064 2.172 . 0 0 "[ . 1 . 2]" 1
859 1 38 LYS HA 1 42 ASN H 2.915 . 6.000 5.626 5.018 6.272 0.272 17 0 "[ . 1 . 2]" 1
860 1 38 LYS HA 1 43 THR H 2.267 . 6.000 3.530 2.824 3.834 . 0 0 "[ . 1 . 2]" 1
861 1 38 LYS HA 1 44 CYS HA 2.678 . 3.574 2.317 2.031 2.728 . 0 0 "[ . 1 . 2]" 1
862 1 38 LYS HB2 1 40 GLU H 3.322 . 6.000 6.007 5.800 6.141 0.141 3 0 "[ . 1 . 2]" 1
863 1 38 LYS HB2 1 45 VAL MG2 2.337 . 6.000 5.444 5.202 5.715 . 0 0 "[ . 1 . 2]" 1
864 1 38 LYS HB3 1 39 GLY H 2.863 . 3.888 3.402 3.003 3.625 . 0 0 "[ . 1 . 2]" 1
865 1 38 LYS HD2 1 38 LYS QE 2.281 . 2.931 2.299 2.160 2.464 . 0 0 "[ . 1 . 2]" 1
866 1 38 LYS HD3 1 38 LYS QE 2.361 . 3.058 2.255 2.162 2.397 . 0 0 "[ . 1 . 2]" 1
867 1 38 LYS HD3 1 39 GLY H 2.983 . 6.000 5.585 5.070 6.223 0.223 18 0 "[ . 1 . 2]" 1
868 1 38 LYS HD3 1 43 THR H 3.520 . 5.069 3.266 2.540 5.285 0.216 3 0 "[ . 1 . 2]" 1
869 1 38 LYS QE 1 38 LYS HG2 2.695 . 3.603 2.943 2.152 3.513 . 0 0 "[ . 1 . 2]" 1
870 1 38 LYS QE 1 38 LYS HG3 2.739 . 3.677 2.670 2.154 3.290 . 0 0 "[ . 1 . 2]" 1
871 1 38 LYS QE 1 42 ASN HA 2.879 . 3.915 3.526 2.572 4.014 0.099 16 0 "[ . 1 . 2]" 1
872 1 38 LYS QE 1 43 THR H 3.098 . 4.298 4.179 3.559 4.410 0.112 2 0 "[ . 1 . 2]" 1
873 1 38 LYS HG2 1 39 GLY H 2.926 . 6.000 4.428 3.991 5.241 . 0 0 "[ . 1 . 2]" 1
874 1 38 LYS HG2 1 43 THR H 3.373 . 4.795 3.598 2.327 4.057 . 0 0 "[ . 1 . 2]" 1
875 1 38 LYS HG3 1 39 GLY H 2.983 . 6.000 5.270 4.045 5.520 . 0 0 "[ . 1 . 2]" 1
876 1 39 GLY H 1 40 GLU H 3.012 . 4.146 2.130 1.997 2.297 . 0 0 "[ . 1 . 2]" 1
877 1 39 GLY H 1 40 GLU HG2 2.554 . 3.370 3.382 3.232 3.538 0.168 3 0 "[ . 1 . 2]" 1
878 1 39 GLY H 1 43 THR H 2.978 . 4.087 3.986 3.500 4.142 0.055 7 0 "[ . 1 . 2]" 1
879 1 39 GLY H 1 44 CYS HA 2.611 . 3.463 3.023 2.775 3.400 . 0 0 "[ . 1 . 2]" 1
880 1 39 GLY H 1 45 VAL H 3.297 . 4.656 3.819 3.533 4.122 . 0 0 "[ . 1 . 2]" 1
881 1 39 GLY H 1 45 VAL MG2 2.827 . 3.826 2.680 2.421 2.907 . 0 0 "[ . 1 . 2]" 1
882 1 39 GLY HA3 1 40 GLU HG2 3.221 . 4.518 3.734 3.465 3.878 . 0 0 "[ . 1 . 2]" 1
883 1 39 GLY HA3 1 43 THR MG 3.335 . 6.000 6.080 6.024 6.136 0.136 3 0 "[ . 1 . 2]" 1
884 1 39 GLY HA3 1 45 VAL MG2 2.506 . 3.291 1.956 1.746 2.236 . 0 0 "[ . 1 . 2]" 1
885 1 40 GLU H 1 40 GLU HA 2.583 . 3.417 2.856 2.800 2.919 . 0 0 "[ . 1 . 2]" 1
886 1 40 GLU H 1 40 GLU HG2 2.374 . 3.078 1.737 1.566 1.918 0.104 7 0 "[ . 1 . 2]" 1
887 1 40 GLU H 1 43 THR HB 3.580 . 5.182 2.711 2.380 3.254 . 0 0 "[ . 1 . 2]" 1
888 1 40 GLU H 1 45 VAL MG1 2.856 . 3.876 2.800 2.340 3.355 . 0 0 "[ . 1 . 2]" 1
889 1 40 GLU HA 1 41 GLY H 1.942 . 6.000 3.195 2.328 3.547 . 0 0 "[ . 1 . 2]" 1
890 1 40 GLU HG2 1 43 THR HB 3.144 . 4.379 2.309 1.993 2.802 . 0 0 "[ . 1 . 2]" 1
891 1 40 GLU HG2 1 45 VAL MG1 3.158 . 4.404 2.220 1.899 2.486 0.013 6 0 "[ . 1 . 2]" 1
892 1 40 GLU HG2 1 45 VAL MG2 2.935 . 4.012 3.883 3.656 4.029 0.017 3 0 "[ . 1 . 2]" 1
893 1 41 GLY H 1 41 GLY HA3 2.279 . 2.928 2.809 2.293 2.955 0.027 6 0 "[ . 1 . 2]" 1
894 1 41 GLY HA3 1 42 ASN H 2.348 . 3.037 3.259 2.211 3.456 0.419 8 0 "[ . 1 . 2]" 1
895 1 41 GLY HA3 1 42 ASN HA 2.968 . 6.000 5.177 4.395 5.325 . 0 0 "[ . 1 . 2]" 1
896 1 41 GLY HA3 1 42 ASN QB 3.280 . 4.625 4.325 4.116 4.946 0.321 12 0 "[ . 1 . 2]" 1
897 1 41 GLY HA3 1 43 THR MG 3.233 . 6.000 5.694 4.726 6.163 0.163 7 0 "[ . 1 . 2]" 1
898 1 42 ASN H 1 42 ASN HA 2.289 . 2.944 2.343 2.267 2.947 0.003 11 0 "[ . 1 . 2]" 1
899 1 42 ASN H 1 42 ASN QB 2.393 . 3.109 3.108 2.451 3.278 0.169 6 0 "[ . 1 . 2]" 1
900 1 42 ASN H 1 43 THR H 3.342 . 4.738 3.018 2.693 3.415 . 0 0 "[ . 1 . 2]" 1
901 1 42 ASN HA 1 42 ASN QB 2.126 . 2.691 2.419 2.172 2.476 . 0 0 "[ . 1 . 2]" 1
902 1 42 ASN HA 1 43 THR H 2.174 . 2.765 2.467 2.285 2.637 . 0 0 "[ . 1 . 2]" 1
903 1 42 ASN QB 1 42 ASN HD21 2.444 . 3.191 2.177 2.138 2.220 . 0 0 "[ . 1 . 2]" 1
904 1 42 ASN QB 1 42 ASN HD22 2.636 . 3.505 3.236 3.205 3.302 . 0 0 "[ . 1 . 2]" 1
905 1 42 ASN QB 1 43 THR H 2.974 . 4.079 3.890 3.836 3.924 . 0 0 "[ . 1 . 2]" 1
906 1 42 ASN QB 1 43 THR MG 3.233 . 4.539 4.579 3.604 4.717 0.178 5 0 "[ . 1 . 2]" 1
907 1 43 THR H 1 43 THR HA 2.605 . 3.453 2.854 2.825 2.873 . 0 0 "[ . 1 . 2]" 1
908 1 43 THR H 1 43 THR HB 3.106 . 4.312 3.453 3.335 3.824 . 0 0 "[ . 1 . 2]" 1
909 1 43 THR H 1 43 THR MG 2.556 . 6.000 3.975 3.622 4.057 . 0 0 "[ . 1 . 2]" 1
910 1 43 THR H 1 44 CYS H 3.449 . 4.936 4.319 4.286 4.358 . 0 0 "[ . 1 . 2]" 1
911 1 43 THR HA 1 43 THR HB 2.163 . 2.748 2.888 2.658 2.950 0.202 5 0 "[ . 1 . 2]" 1
912 1 43 THR HA 1 43 THR MG 2.145 . 2.720 2.178 2.155 2.251 . 0 0 "[ . 1 . 2]" 1
913 1 43 THR HA 1 44 CYS H 2.127 . 2.692 2.557 2.385 2.691 . 0 0 "[ . 1 . 2]" 1
914 1 43 THR HB 1 43 THR MG 1.966 . 2.449 2.123 2.113 2.137 . 0 0 "[ . 1 . 2]" 1
915 1 43 THR HB 1 44 CYS H 2.355 . 3.048 2.659 1.841 3.087 0.039 19 0 "[ . 1 . 2]" 1
916 1 43 THR HB 1 45 VAL H 3.848 . 5.699 5.516 5.223 5.728 0.029 3 0 "[ . 1 . 2]" 1
917 1 43 THR HB 1 45 VAL MG1 2.672 . 3.565 3.638 3.491 3.702 0.137 4 0 "[ . 1 . 2]" 1
918 1 43 THR MG 1 44 CYS H 2.532 . 3.333 2.054 1.710 3.055 0.021 8 0 "[ . 1 . 2]" 1
919 1 44 CYS H 1 44 CYS HA 2.704 . 3.618 2.934 2.900 2.945 . 0 0 "[ . 1 . 2]" 1
920 1 44 CYS H 1 45 VAL H 3.479 . 4.992 4.393 4.305 4.485 . 0 0 "[ . 1 . 2]" 1
921 1 44 CYS HA 1 44 CYS HB2 2.756 . 3.706 2.949 2.308 3.022 . 0 0 "[ . 1 . 2]" 1
922 1 44 CYS HA 1 45 VAL H 1.947 . 2.421 2.214 2.177 2.260 . 0 0 "[ . 1 . 2]" 1
923 1 44 CYS HA 1 45 VAL MG1 2.900 . 3.951 3.699 3.556 3.905 . 0 0 "[ . 1 . 2]" 1
924 1 44 CYS HA 1 45 VAL MG2 2.634 . 3.502 3.400 3.308 3.486 . 0 0 "[ . 1 . 2]" 1
925 1 44 CYS HB2 1 45 VAL H 3.151 . 4.392 3.761 3.662 3.880 . 0 0 "[ . 1 . 2]" 1
926 1 44 CYS HB3 1 45 VAL H 2.838 . 3.845 2.909 2.639 4.137 0.292 12 0 "[ . 1 . 2]" 1
927 1 45 VAL H 1 45 VAL HA 2.404 . 3.127 2.904 2.878 2.915 . 0 0 "[ . 1 . 2]" 1
928 1 45 VAL H 1 45 VAL HB 2.809 . 3.795 3.865 3.845 3.888 0.093 11 0 "[ . 1 . 2]" 1
929 1 45 VAL H 1 45 VAL MG1 2.406 . 6.000 3.206 3.147 3.344 . 0 0 "[ . 1 . 2]" 1
930 1 45 VAL H 1 45 VAL MG2 2.060 . 2.590 2.340 2.282 2.403 . 0 0 "[ . 1 . 2]" 1
931 1 45 VAL H 1 46 GLU HA 3.542 . 5.110 4.829 4.700 4.890 . 0 0 "[ . 1 . 2]" 1
932 1 45 VAL HA 1 45 VAL HB 2.168 . 2.755 2.491 2.458 2.523 . 0 0 "[ . 1 . 2]" 1
933 1 45 VAL HA 1 46 GLU H 2.054 . 2.581 2.412 2.353 2.458 . 0 0 "[ . 1 . 2]" 1
934 1 45 VAL HA 1 46 GLU QB 3.302 . 4.665 4.208 4.137 4.328 . 0 0 "[ . 1 . 2]" 1
935 1 45 VAL HB 1 45 VAL MG1 1.904 . 2.357 2.131 2.124 2.137 . 0 0 "[ . 1 . 2]" 1
936 1 45 VAL HB 1 45 VAL MG2 1.994 . 2.491 2.129 2.124 2.133 . 0 0 "[ . 1 . 2]" 1
937 1 45 VAL HB 1 46 GLU H 2.130 . 2.697 2.338 2.186 2.465 . 0 0 "[ . 1 . 2]" 1
938 1 45 VAL HB 1 46 GLU HA 3.124 . 6.000 4.669 4.586 4.740 . 0 0 "[ . 1 . 2]" 1
939 1 45 VAL HB 1 46 GLU QB 3.438 . 4.379 3.900 3.749 4.047 . 0 0 "[ . 1 . 2]" 1
940 1 45 VAL MG1 1 45 VAL MG2 1.788 . 2.188 2.091 2.082 2.109 . 0 0 "[ . 1 . 2]" 1
941 1 45 VAL MG2 1 46 GLU H 2.627 . 3.490 3.434 3.286 3.523 0.033 13 0 "[ . 1 . 2]" 1
942 1 46 GLU H 1 46 GLU HA 2.449 . 3.199 2.830 2.810 2.853 . 0 0 "[ . 1 . 2]" 1
943 1 46 GLU H 1 46 GLU QB 2.304 . 2.917 2.023 1.984 2.089 . 0 0 "[ . 1 . 2]" 1
944 1 46 GLU H 1 46 GLU QG 2.645 . 6.000 3.374 3.031 3.545 . 0 0 "[ . 1 . 2]" 1
945 1 46 GLU H 1 47 ASN H 3.360 . 4.771 4.357 4.151 4.535 . 0 0 "[ . 1 . 2]" 1
946 1 46 GLU HA 1 46 GLU QB 2.373 . 2.998 2.532 2.515 2.541 . 0 0 "[ . 1 . 2]" 1
947 1 46 GLU HA 1 46 GLU QG 2.695 . 3.603 2.210 2.037 2.554 . 0 0 "[ . 1 . 2]" 1
948 1 46 GLU HA 1 47 ASN H 1.938 . 2.407 2.136 2.096 2.211 . 0 0 "[ . 1 . 2]" 1
949 1 46 GLU HA 1 47 ASN HB2 3.269 . 4.605 4.645 4.376 4.747 0.142 15 0 "[ . 1 . 2]" 1
950 1 46 GLU QB 1 48 ASN HD21 3.516 . 5.061 2.959 2.074 4.181 . 0 0 "[ . 1 . 2]" 1
951 1 46 GLU QB 1 48 ASN HD22 3.351 . 4.755 3.177 2.507 4.613 . 0 0 "[ . 1 . 2]" 1
952 1 46 GLU QB 1 73 ASN HD21 3.413 . 4.869 4.124 2.253 5.463 0.594 18 1 "[ . 1 . + 2]" 1
953 1 46 GLU QG 1 47 ASN H 2.983 . 4.095 3.663 3.349 3.892 . 0 0 "[ . 1 . 2]" 1
954 1 46 GLU QG 1 48 ASN HD21 3.366 . 4.782 4.252 3.479 4.800 0.018 11 0 "[ . 1 . 2]" 1
955 1 46 GLU QG 1 48 ASN HD22 3.330 . 4.716 4.502 3.976 4.779 0.063 13 0 "[ . 1 . 2]" 1
956 1 47 ASN H 1 47 ASN HB3 2.527 . 3.326 2.475 2.397 2.633 . 0 0 "[ . 1 . 2]" 1
957 1 47 ASN H 1 48 ASN H 3.261 . 4.590 4.053 2.445 4.416 . 0 0 "[ . 1 . 2]" 1
958 1 47 ASN HA 1 47 ASN HB2 2.698 . 3.608 2.454 2.406 2.545 . 0 0 "[ . 1 . 2]" 1
959 1 47 ASN HA 1 47 ASN HB3 2.705 . 3.619 3.030 3.023 3.035 . 0 0 "[ . 1 . 2]" 1
960 1 47 ASN HB2 1 47 ASN HD21 2.903 . 3.957 2.676 2.255 2.869 . 0 0 "[ . 1 . 2]" 1
961 1 47 ASN HB3 1 47 ASN HD21 2.885 . 3.925 2.395 2.248 2.755 . 0 0 "[ . 1 . 2]" 1
962 1 47 ASN HB3 1 47 ASN HD22 2.625 . 3.486 3.543 3.486 3.690 0.204 7 0 "[ . 1 . 2]" 1
963 1 47 ASN HD21 1 50 PRO HA 2.416 . 3.145 2.558 2.176 2.910 . 0 0 "[ . 1 . 2]" 1
964 1 47 ASN HD21 1 50 PRO HB2 3.330 . 4.716 4.635 4.256 4.803 0.087 12 0 "[ . 1 . 2]" 1
965 1 47 ASN HD21 1 50 PRO HB3 3.100 . 4.301 3.221 2.777 3.399 . 0 0 "[ . 1 . 2]" 1
966 1 47 ASN HD21 1 51 THR H 3.116 . 4.330 3.803 3.545 4.113 . 0 0 "[ . 1 . 2]" 1
967 1 47 ASN HD22 1 50 PRO HA 2.584 . 3.419 2.534 2.287 2.930 . 0 0 "[ . 1 . 2]" 1
968 1 48 ASN H 1 48 ASN HA 2.449 . 3.199 2.759 2.260 2.883 . 0 0 "[ . 1 . 2]" 1
969 1 48 ASN H 1 48 ASN QB 2.465 . 3.225 2.392 2.022 3.090 . 0 0 "[ . 1 . 2]" 1
970 1 48 ASN H 1 49 ASN H 2.877 . 3.912 2.787 2.580 3.072 . 0 0 "[ . 1 . 2]" 1
971 1 48 ASN HA 1 48 ASN HD21 2.450 . 3.201 2.634 1.825 3.250 0.049 16 0 "[ . 1 . 2]" 1
972 1 48 ASN HA 1 48 ASN HD22 3.097 . 4.296 3.668 3.468 4.002 . 0 0 "[ . 1 . 2]" 1
973 1 48 ASN HA 1 49 ASN H 2.503 . 3.286 3.142 2.913 3.308 0.022 8 0 "[ . 1 . 2]" 1
974 1 48 ASN HA 1 50 PRO QD 2.894 . 4.392 3.582 3.280 3.848 . 0 0 "[ . 1 . 2]" 1
975 1 48 ASN QB 1 73 ASN HD21 2.864 . 3.889 3.510 3.164 4.038 0.149 4 0 "[ . 1 . 2]" 1
976 1 48 ASN QB 1 73 ASN HD22 2.597 . 3.440 3.299 2.620 3.930 0.490 17 0 "[ . 1 . 2]" 1
977 1 49 ASN H 1 49 ASN HA 2.421 . 3.154 2.862 2.833 2.883 . 0 0 "[ . 1 . 2]" 1
978 1 49 ASN H 1 49 ASN HB2 2.455 . 3.209 3.302 3.238 3.363 0.154 1 0 "[ . 1 . 2]" 1
979 1 49 ASN H 1 49 ASN HB3 2.432 . 3.171 3.069 2.996 3.182 0.011 2 0 "[ . 1 . 2]" 1
980 1 49 ASN H 1 50 PRO QG 3.419 . 4.485 3.708 3.576 3.813 . 0 0 "[ . 1 . 2]" 1
981 1 49 ASN HA 1 49 ASN HB2 2.206 . 2.815 2.541 2.495 2.602 . 0 0 "[ . 1 . 2]" 1
982 1 49 ASN HA 1 50 PRO QD 2.110 . 2.667 2.161 1.965 2.302 . 0 0 "[ . 1 . 2]" 1
983 1 49 ASN HA 1 50 PRO QG 3.204 . 4.620 4.049 3.860 4.189 . 0 0 "[ . 1 . 2]" 1
984 1 49 ASN HB2 1 49 ASN HD22 2.715 . 3.637 3.916 3.723 4.071 0.434 16 0 "[ . 1 . 2]" 1
985 1 49 ASN HB3 1 49 ASN HD21 2.537 . 6.000 2.302 2.180 3.523 . 0 0 "[ . 1 . 2]" 1
986 1 49 ASN HB3 1 49 ASN HD22 2.897 . 3.946 3.514 3.464 4.051 0.105 3 0 "[ . 1 . 2]" 1
987 1 49 ASN HB3 1 50 PRO QD 3.206 . 6.000 4.347 4.303 4.393 . 0 0 "[ . 1 . 2]" 1
988 1 49 ASN HB3 1 51 THR MG 3.440 . 6.000 5.849 5.328 6.082 0.082 17 0 "[ . 1 . 2]" 1
989 1 49 ASN HD22 1 51 THR HB 2.991 . 6.000 4.907 3.967 5.554 . 0 0 "[ . 1 . 2]" 1
990 1 49 ASN HD22 1 51 THR MG 3.088 . 6.000 5.652 4.928 6.310 0.310 8 0 "[ . 1 . 2]" 1
991 1 50 PRO HA 1 50 PRO HB2 2.393 . 3.109 2.803 2.756 2.859 . 0 0 "[ . 1 . 2]" 1
992 1 50 PRO HA 1 50 PRO QD 2.755 . 6.000 3.497 3.480 3.509 . 0 0 "[ . 1 . 2]" 1
993 1 50 PRO HA 1 50 PRO QG 2.803 . 3.785 3.395 3.267 3.465 . 0 0 "[ . 1 . 2]" 1
994 1 50 PRO HA 1 51 THR H 1.984 . 2.476 2.114 2.084 2.138 . 0 0 "[ . 1 . 2]" 1
995 1 50 PRO HA 1 51 THR MG 2.795 . 3.771 3.744 3.604 3.832 0.061 10 0 "[ . 1 . 2]" 1
996 1 50 PRO HB2 1 50 PRO QD 2.987 . 3.881 3.217 3.095 3.375 . 0 0 "[ . 1 . 2]" 1
997 1 50 PRO HB2 1 50 PRO QG 2.362 . 3.059 2.176 2.166 2.187 . 0 0 "[ . 1 . 2]" 1
998 1 50 PRO HB2 1 51 THR H 2.859 . 3.881 3.486 3.363 3.624 . 0 0 "[ . 1 . 2]" 1
999 1 50 PRO HB2 1 77 ILE MD 2.637 . 3.506 2.121 1.897 2.413 . 0 0 "[ . 1 . 2]" 1
1000 1 50 PRO HB2 1 77 ILE HG12 2.590 . 3.429 2.185 1.960 2.399 . 0 0 "[ . 1 . 2]" 1
1001 1 50 PRO HB2 1 77 ILE HG13 2.403 . 3.125 2.081 1.710 2.208 . 0 0 "[ . 1 . 2]" 1
1002 1 50 PRO HB2 1 77 ILE MG 3.036 . 4.189 4.025 3.710 4.151 . 0 0 "[ . 1 . 2]" 1
1003 1 50 PRO HB3 1 50 PRO QD 2.784 . 3.753 3.432 3.342 3.476 . 0 0 "[ . 1 . 2]" 1
1004 1 50 PRO HB3 1 50 PRO QG 2.219 . 2.835 2.162 2.151 2.178 . 0 0 "[ . 1 . 2]" 1
1005 1 50 PRO HB3 1 51 THR H 2.896 . 3.944 3.684 3.546 3.817 . 0 0 "[ . 1 . 2]" 1
1006 1 50 PRO HB3 1 77 ILE MD 2.904 . 3.958 3.679 3.479 3.939 . 0 0 "[ . 1 . 2]" 1
1007 1 50 PRO HB3 1 77 ILE HG12 3.078 . 4.263 3.474 3.209 3.738 . 0 0 "[ . 1 . 2]" 1
1008 1 50 PRO HB3 1 77 ILE HG13 3.078 . 4.262 3.222 2.939 3.540 . 0 0 "[ . 1 . 2]" 1
1009 1 50 PRO QD 1 51 THR H 2.881 . 6.000 4.806 4.726 4.892 . 0 0 "[ . 1 . 2]" 1
1010 1 50 PRO QD 1 69 GLU HA 2.825 . 3.822 3.767 3.525 3.940 0.118 12 0 "[ . 1 . 2]" 1
1011 1 50 PRO QD 1 70 SER H 2.787 . 6.000 4.559 4.229 4.797 . 0 0 "[ . 1 . 2]" 1
1012 1 50 PRO QD 1 73 ASN HA 3.274 . 4.444 3.310 2.696 3.705 . 0 0 "[ . 1 . 2]" 1
1013 1 50 PRO QD 1 76 LYS HD2 2.659 . 3.368 2.081 1.637 3.988 0.620 20 2 "[ . 1 . - +]" 1
1014 1 50 PRO QD 1 76 LYS HD3 3.154 . 4.398 2.850 1.818 3.184 0.092 13 0 "[ . 1 . 2]" 1
1015 1 50 PRO QD 1 76 LYS HG3 3.259 . 4.587 3.745 2.069 4.421 . 0 0 "[ . 1 . 2]" 1
1016 1 50 PRO QD 1 77 ILE MD 2.689 . 3.593 3.536 3.260 3.616 0.023 7 0 "[ . 1 . 2]" 1
1017 1 50 PRO QD 1 77 ILE HG12 3.486 . 5.005 3.983 3.497 4.176 . 0 0 "[ . 1 . 2]" 1
1018 1 50 PRO QG 1 68 ALA H 3.476 . 4.987 4.854 4.709 4.967 . 0 0 "[ . 1 . 2]" 1
1019 1 50 PRO QG 1 73 ASN HB3 2.829 . 3.829 2.823 2.260 3.285 . 0 0 "[ . 1 . 2]" 1
1020 1 50 PRO QG 1 76 LYS H 3.030 . 4.177 4.023 3.905 4.104 . 0 0 "[ . 1 . 2]" 1
1021 1 50 PRO QG 1 76 LYS HD2 2.477 . 3.244 2.452 1.994 4.086 0.842 17 2 "[ . 1 . + -]" 1
1022 1 50 PRO QG 1 76 LYS QE 3.204 . 4.268 3.040 2.493 3.499 . 0 0 "[ . 1 . 2]" 1
1023 1 50 PRO QG 1 76 LYS HG3 3.067 . 4.243 3.372 2.604 4.233 . 0 0 "[ . 1 . 2]" 1
1024 1 50 PRO QG 1 77 ILE H 3.222 . 4.519 3.392 3.216 3.542 . 0 0 "[ . 1 . 2]" 1
1025 1 50 PRO QG 1 77 ILE MD 3.073 . 4.253 3.045 2.796 3.209 . 0 0 "[ . 1 . 2]" 1
1026 1 50 PRO QG 1 77 ILE HG12 2.988 . 4.104 2.351 1.839 2.485 0.056 17 0 "[ . 1 . 2]" 1
1027 1 50 PRO QG 1 77 ILE HG13 3.340 . 4.734 3.433 2.783 3.597 . 0 0 "[ . 1 . 2]" 1
1028 1 50 PRO QG 1 77 ILE MG 3.575 . 5.172 4.820 4.359 4.916 . 0 0 "[ . 1 . 2]" 1
1029 1 51 THR H 1 51 THR HB 2.928 . 4.000 3.037 2.927 3.109 . 0 0 "[ . 1 . 2]" 1
1030 1 51 THR H 1 51 THR MG 2.266 . 2.908 2.187 2.117 2.245 . 0 0 "[ . 1 . 2]" 1
1031 1 51 THR H 1 52 CYS H 3.350 . 4.753 4.429 4.406 4.459 . 0 0 "[ . 1 . 2]" 1
1032 1 51 THR H 1 54 ILE HB 3.371 . 4.792 4.232 4.027 4.402 . 0 0 "[ . 1 . 2]" 1
1033 1 51 THR H 1 57 GLY HA3 3.110 . 4.319 4.463 4.375 4.999 0.680 11 2 "[ -. 1+ . 2]" 1
1034 1 51 THR H 1 77 ILE MD 2.977 . 4.085 3.757 3.640 3.942 . 0 0 "[ . 1 . 2]" 1
1035 1 51 THR HA 1 51 THR HB 2.160 . 2.743 2.505 2.472 2.549 . 0 0 "[ . 1 . 2]" 1
1036 1 51 THR HA 1 52 CYS H 2.024 . 2.536 2.302 2.258 2.354 . 0 0 "[ . 1 . 2]" 1
1037 1 51 THR HA 1 67 ASN HB2 3.015 . 4.152 3.257 2.405 4.048 . 0 0 "[ . 1 . 2]" 1
1038 1 51 THR HA 1 77 ILE MD 2.396 . 3.114 2.971 2.804 3.130 0.016 9 0 "[ . 1 . 2]" 1
1039 1 51 THR HA 1 77 ILE MG 2.972 . 6.000 5.147 4.833 5.396 . 0 0 "[ . 1 . 2]" 1
1040 1 51 THR HB 1 51 THR MG 1.993 . 2.490 2.132 2.126 2.135 . 0 0 "[ . 1 . 2]" 1
1041 1 51 THR MG 1 52 CYS H 2.976 . 4.083 3.548 3.445 3.673 . 0 0 "[ . 1 . 2]" 1
1042 1 51 THR MG 1 53 ASP H 2.484 . 6.000 5.056 4.867 5.215 . 0 0 "[ . 1 . 2]" 1
1043 1 51 THR MG 1 53 ASP HB2 2.674 . 6.000 4.066 3.724 4.514 . 0 0 "[ . 1 . 2]" 1
1044 1 51 THR MG 1 53 ASP HB3 2.585 . 6.000 4.824 3.631 5.226 . 0 0 "[ . 1 . 2]" 1
1045 1 51 THR MG 1 54 ILE H 2.193 . 2.794 2.830 2.771 2.902 0.108 17 0 "[ . 1 . 2]" 1
1046 1 51 THR MG 1 54 ILE HB 2.188 . 2.787 2.197 1.952 2.327 . 0 0 "[ . 1 . 2]" 1
1047 1 51 THR MG 1 54 ILE MD 2.232 . 2.855 1.995 1.831 2.142 . 0 0 "[ . 1 . 2]" 1
1048 1 51 THR MG 1 54 ILE HG12 2.580 . 6.000 4.012 3.720 4.125 . 0 0 "[ . 1 . 2]" 1
1049 1 51 THR MG 1 54 ILE HG13 2.389 . 3.103 2.916 2.451 3.130 0.027 10 0 "[ . 1 . 2]" 1
1050 1 51 THR MG 1 54 ILE MG 2.741 . 3.680 3.294 3.092 3.425 . 0 0 "[ . 1 . 2]" 1
1051 1 51 THR MG 1 57 GLY H 3.368 . 4.786 4.373 4.236 4.525 . 0 0 "[ . 1 . 2]" 1
1052 1 52 CYS H 1 52 CYS HA 2.425 . 3.160 2.879 2.860 2.892 . 0 0 "[ . 1 . 2]" 1
1053 1 52 CYS H 1 52 CYS HB2 2.541 . 3.348 2.958 2.203 3.575 0.227 4 0 "[ . 1 . 2]" 1
1054 1 52 CYS H 1 52 CYS HB3 2.454 . 3.206 2.519 2.168 3.474 0.268 14 0 "[ . 1 . 2]" 1
1055 1 52 CYS H 1 53 ASP H 2.600 . 6.000 4.540 4.495 4.575 . 0 0 "[ . 1 . 2]" 1
1056 1 52 CYS H 1 67 ASN HD21 3.487 . 5.007 3.099 2.120 3.840 . 0 0 "[ . 1 . 2]" 1
1057 1 52 CYS H 1 67 ASN HD22 3.188 . 4.458 3.952 2.768 4.506 0.048 8 0 "[ . 1 . 2]" 1
1058 1 52 CYS HA 1 52 CYS HB2 2.349 . 3.038 2.464 2.299 3.002 . 0 0 "[ . 1 . 2]" 1
1059 1 52 CYS HA 1 52 CYS HB3 2.531 . 3.332 2.832 2.424 3.037 . 0 0 "[ . 1 . 2]" 1
1060 1 52 CYS HA 1 53 ASP H 2.717 . 3.640 2.560 2.487 2.659 . 0 0 "[ . 1 . 2]" 1
1061 1 52 CYS HA 1 57 GLY H 2.445 . 3.192 2.987 2.632 3.216 0.024 17 0 "[ . 1 . 2]" 1
1062 1 52 CYS HA 1 57 GLY HA3 2.656 . 3.538 3.095 2.572 3.444 . 0 0 "[ . 1 . 2]" 1
1063 1 52 CYS HA 1 65 CYS HB3 3.328 . 4.713 4.607 4.097 4.978 0.265 19 0 "[ . 1 . 2]" 1
1064 1 52 CYS HB2 1 53 ASP H 3.062 . 4.234 3.236 2.190 3.724 . 0 0 "[ . 1 . 2]" 1
1065 1 52 CYS HB2 1 77 ILE MD 3.465 . 4.966 3.912 3.336 4.755 . 0 0 "[ . 1 . 2]" 1
1066 1 52 CYS HB3 1 53 ASP H 3.018 . 4.157 3.475 2.243 3.849 . 0 0 "[ . 1 . 2]" 1
1067 1 52 CYS HB3 1 77 ILE MD 3.421 . 4.884 4.228 3.092 4.909 0.025 14 0 "[ . 1 . 2]" 1
1068 1 53 ASP H 1 53 ASP HA 2.542 . 3.350 2.281 2.267 2.317 . 0 0 "[ . 1 . 2]" 1
1069 1 53 ASP H 1 53 ASP HB2 2.417 . 6.000 3.500 3.311 3.615 . 0 0 "[ . 1 . 2]" 1
1070 1 53 ASP H 1 53 ASP HB3 2.368 . 6.000 4.140 3.888 4.197 . 0 0 "[ . 1 . 2]" 1
1071 1 53 ASP H 1 54 ILE H 2.430 . 3.168 3.160 2.873 3.308 0.140 11 0 "[ . 1 . 2]" 1
1072 1 53 ASP H 1 54 ILE HB 3.434 . 6.000 5.654 5.525 5.731 . 0 0 "[ . 1 . 2]" 1
1073 1 53 ASP HA 1 53 ASP HB3 2.204 . 2.811 2.669 2.526 2.981 0.170 19 0 "[ . 1 . 2]" 1
1074 1 53 ASP HA 1 54 ILE H 2.899 . 3.949 3.490 3.445 3.510 . 0 0 "[ . 1 . 2]" 1
1075 1 53 ASP HB2 1 54 ILE H 2.940 . 4.021 2.942 2.615 3.718 . 0 0 "[ . 1 . 2]" 1
1076 1 53 ASP HB2 1 54 ILE MD 3.247 . 4.565 4.350 4.079 4.736 0.171 19 0 "[ . 1 . 2]" 1
1077 1 53 ASP HB2 1 54 ILE HG12 3.262 . 4.592 4.599 4.368 4.723 0.131 12 0 "[ . 1 . 2]" 1
1078 1 53 ASP HB2 1 54 ILE HG13 2.942 . 4.024 3.162 2.838 3.689 . 0 0 "[ . 1 . 2]" 1
1079 1 53 ASP HB3 1 54 ILE H 2.964 . 4.062 3.352 2.592 3.795 . 0 0 "[ . 1 . 2]" 1
1080 1 53 ASP HB3 1 54 ILE MD 3.145 . 4.381 4.346 3.435 4.645 0.264 13 0 "[ . 1 . 2]" 1
1081 1 53 ASP HB3 1 54 ILE HG12 3.129 . 4.353 3.953 2.967 4.313 . 0 0 "[ . 1 . 2]" 1
1082 1 53 ASP HB3 1 54 ILE HG13 2.977 . 4.085 3.036 2.062 3.353 . 0 0 "[ . 1 . 2]" 1
1083 1 54 ILE H 1 54 ILE HA 2.593 . 3.433 2.943 2.920 2.955 . 0 0 "[ . 1 . 2]" 1
1084 1 54 ILE H 1 54 ILE HB 2.327 . 3.004 2.571 2.505 2.675 . 0 0 "[ . 1 . 2]" 1
1085 1 54 ILE H 1 54 ILE HG12 2.944 . 4.028 3.705 3.394 3.943 . 0 0 "[ . 1 . 2]" 1
1086 1 54 ILE H 1 54 ILE HG13 2.746 . 3.689 2.489 2.243 2.771 . 0 0 "[ . 1 . 2]" 1
1087 1 54 ILE H 1 56 ASN H 3.275 . 4.616 3.460 3.306 3.589 . 0 0 "[ . 1 . 2]" 1
1088 1 54 ILE H 1 56 ASN HA 2.863 . 3.887 3.972 3.915 4.005 0.118 8 0 "[ . 1 . 2]" 1
1089 1 54 ILE H 1 57 GLY H 2.934 . 4.010 3.591 3.388 3.814 . 0 0 "[ . 1 . 2]" 1
1090 1 54 ILE HA 1 54 ILE HB 2.603 . 3.450 3.021 3.013 3.025 . 0 0 "[ . 1 . 2]" 1
1091 1 54 ILE HA 1 54 ILE HG12 2.325 . 3.001 2.569 2.525 2.605 . 0 0 "[ . 1 . 2]" 1
1092 1 54 ILE HA 1 54 ILE HG13 2.481 . 3.250 3.034 2.935 3.215 . 0 0 "[ . 1 . 2]" 1
1093 1 54 ILE HA 1 54 ILE MG 2.080 . 2.621 2.369 2.308 2.392 . 0 0 "[ . 1 . 2]" 1
1094 1 54 ILE HA 1 55 ASN H 2.032 . 2.548 2.104 2.091 2.116 . 0 0 "[ . 1 . 2]" 1
1095 1 54 ILE HA 1 55 ASN QB 3.028 . 4.174 4.043 4.017 4.077 . 0 0 "[ . 1 . 2]" 1
1096 1 54 ILE HB 1 54 ILE MD 2.273 . 2.919 2.421 2.370 2.496 . 0 0 "[ . 1 . 2]" 1
1097 1 54 ILE HB 1 54 ILE HG12 2.494 . 3.271 3.027 3.021 3.032 . 0 0 "[ . 1 . 2]" 1
1098 1 54 ILE HB 1 54 ILE HG13 2.286 . 2.939 2.482 2.426 2.518 . 0 0 "[ . 1 . 2]" 1
1099 1 54 ILE HB 1 54 ILE MG 2.008 . 2.512 2.131 2.127 2.134 . 0 0 "[ . 1 . 2]" 1
1100 1 54 ILE HB 1 55 ASN H 3.391 . 4.828 4.341 4.270 4.380 . 0 0 "[ . 1 . 2]" 1
1101 1 54 ILE HB 1 55 ASN QB 3.442 . 4.923 4.121 3.980 4.213 . 0 0 "[ . 1 . 2]" 1
1102 1 54 ILE HB 1 57 GLY H 3.476 . 4.987 4.235 4.051 4.384 . 0 0 "[ . 1 . 2]" 1
1103 1 54 ILE MD 1 54 ILE HG12 1.916 . 2.375 2.114 2.111 2.116 . 0 0 "[ . 1 . 2]" 1
1104 1 54 ILE MD 1 54 ILE HG13 2.028 . 2.542 2.112 2.107 2.116 . 0 0 "[ . 1 . 2]" 1
1105 1 54 ILE MD 1 55 ASN H 3.310 . 6.000 5.368 5.314 5.418 . 0 0 "[ . 1 . 2]" 1
1106 1 54 ILE HG12 1 55 ASN H 3.338 . 4.731 4.593 4.539 4.655 . 0 0 "[ . 1 . 2]" 1
1107 1 54 ILE HG13 1 54 ILE MG 2.342 . 6.000 3.211 3.203 3.222 . 0 0 "[ . 1 . 2]" 1
1108 1 54 ILE HG13 1 55 ASN H 3.335 . 6.000 5.054 4.974 5.178 . 0 0 "[ . 1 . 2]" 1
1109 1 54 ILE MG 1 55 ASN H 2.469 . 3.231 3.094 2.979 3.173 . 0 0 "[ . 1 . 2]" 1
1110 1 54 ILE MG 1 55 ASN HA 2.816 . 6.000 4.305 4.217 4.356 . 0 0 "[ . 1 . 2]" 1
1111 1 54 ILE MG 1 55 ASN QB 2.390 . 2.892 2.745 2.625 2.793 . 0 0 "[ . 1 . 2]" 1
1112 1 54 ILE MG 1 55 ASN HD21 3.352 . 4.756 4.798 4.714 4.857 0.101 19 0 "[ . 1 . 2]" 1
1113 1 55 ASN H 1 55 ASN HA 2.002 . 2.503 2.284 2.272 2.292 . 0 0 "[ . 1 . 2]" 1
1114 1 55 ASN H 1 55 ASN QB 2.794 . 3.467 2.958 2.924 2.985 . 0 0 "[ . 1 . 2]" 1
1115 1 55 ASN H 1 56 ASN H 3.109 . 4.317 2.492 2.436 2.561 . 0 0 "[ . 1 . 2]" 1
1116 1 55 ASN HA 1 55 ASN QB 2.366 . 2.822 2.409 2.400 2.429 . 0 0 "[ . 1 . 2]" 1
1117 1 55 ASN HA 1 55 ASN HD21 3.161 . 4.410 4.433 4.418 4.445 0.035 10 0 "[ . 1 . 2]" 1
1118 1 55 ASN HA 1 56 ASN HB2 3.454 . 4.946 4.280 4.125 4.417 . 0 0 "[ . 1 . 2]" 1
1119 1 55 ASN HA 1 56 ASN HB3 3.349 . 4.751 4.826 4.766 4.906 0.155 18 0 "[ . 1 . 2]" 1
1120 1 55 ASN HA 1 57 GLY H 3.241 . 4.554 4.373 4.291 4.530 . 0 0 "[ . 1 . 2]" 1
1121 1 55 ASN HA 1 58 GLY H 2.464 . 6.000 4.153 4.063 4.197 . 0 0 "[ . 1 . 2]" 1
1122 1 55 ASN HA 1 58 GLY HA2 1.898 . 6.000 5.024 4.902 5.121 . 0 0 "[ . 1 . 2]" 1
1123 1 55 ASN HA 1 59 CYS H 2.778 . 6.000 5.024 4.768 5.161 . 0 0 "[ . 1 . 2]" 1
1124 1 55 ASN QB 1 55 ASN HD21 2.434 . 2.810 2.138 2.115 2.162 . 0 0 "[ . 1 . 2]" 1
1125 1 55 ASN QB 1 55 ASN HD22 2.530 . 3.772 3.202 3.189 3.214 . 0 0 "[ . 1 . 2]" 1
1126 1 55 ASN QB 1 56 ASN H 3.240 . 4.552 3.566 3.476 3.617 . 0 0 "[ . 1 . 2]" 1
1127 1 55 ASN QB 1 57 GLY H 3.482 . 3.867 2.880 2.775 3.006 . 0 0 "[ . 1 . 2]" 1
1128 1 55 ASN QB 1 58 GLY H 2.922 . 3.989 2.633 2.481 2.723 . 0 0 "[ . 1 . 2]" 1
1129 1 55 ASN QB 1 58 GLY HA2 3.364 . 4.779 3.647 3.549 3.770 . 0 0 "[ . 1 . 2]" 1
1130 1 55 ASN HD21 1 58 GLY H 3.350 . 4.753 3.155 2.985 3.297 . 0 0 "[ . 1 . 2]" 1
1131 1 55 ASN HD21 1 58 GLY HA2 2.790 . 3.763 2.744 2.462 2.977 . 0 0 "[ . 1 . 2]" 1
1132 1 55 ASN HD22 1 58 GLY HA2 2.959 . 4.054 2.263 2.109 2.459 . 0 0 "[ . 1 . 2]" 1
1133 1 56 ASN H 1 56 ASN HA 2.036 . 2.554 2.262 2.255 2.268 . 0 0 "[ . 1 . 2]" 1
1134 1 56 ASN H 1 56 ASN HB2 2.630 . 3.495 3.015 2.959 3.039 . 0 0 "[ . 1 . 2]" 1
1135 1 56 ASN H 1 56 ASN HB3 2.869 . 3.898 3.775 3.720 3.836 . 0 0 "[ . 1 . 2]" 1
1136 1 56 ASN H 1 57 GLY H 2.641 . 3.513 2.696 2.646 2.756 . 0 0 "[ . 1 . 2]" 1
1137 1 56 ASN HA 1 56 ASN HB2 2.578 . 3.409 2.652 2.623 2.704 . 0 0 "[ . 1 . 2]" 1
1138 1 56 ASN HA 1 56 ASN HB3 2.706 . 3.621 3.000 2.975 3.016 . 0 0 "[ . 1 . 2]" 1
1139 1 56 ASN HA 1 57 GLY H 2.596 . 3.438 2.951 2.886 3.047 . 0 0 "[ . 1 . 2]" 1
1140 1 56 ASN HA 1 59 CYS H 3.553 . 5.131 4.336 4.281 4.397 . 0 0 "[ . 1 . 2]" 1
1141 1 56 ASN HA 1 65 CYS HB3 2.951 . 4.040 3.868 3.644 4.104 0.064 11 0 "[ . 1 . 2]" 1
1142 1 56 ASN HB2 1 56 ASN HD21 2.621 . 3.480 3.004 2.919 3.164 . 0 0 "[ . 1 . 2]" 1
1143 1 56 ASN HB2 1 56 ASN HD22 2.858 . 3.879 3.810 3.768 3.883 0.004 11 0 "[ . 1 . 2]" 1
1144 1 56 ASN HB2 1 58 GLY H 3.377 . 4.802 4.616 4.442 4.823 0.021 4 0 "[ . 1 . 2]" 1
1145 1 56 ASN HB2 1 59 CYS H 3.096 . 4.294 3.775 3.594 3.927 . 0 0 "[ . 1 . 2]" 1
1146 1 56 ASN HB2 1 59 CYS HB3 3.436 . 4.912 4.903 3.444 5.036 0.124 17 0 "[ . 1 . 2]" 1
1147 1 56 ASN HB2 1 61 PRO HA 2.769 . 3.728 3.812 3.752 3.861 0.133 5 0 "[ . 1 . 2]" 1
1148 1 56 ASN HB2 1 61 PRO HD3 3.272 . 4.610 3.936 3.455 4.201 . 0 0 "[ . 1 . 2]" 1
1149 1 56 ASN HB3 1 56 ASN HD21 2.552 . 3.366 2.183 2.134 2.209 . 0 0 "[ . 1 . 2]" 1
1150 1 56 ASN HB3 1 56 ASN HD22 2.738 . 3.675 3.470 3.443 3.490 . 0 0 "[ . 1 . 2]" 1
1151 1 56 ASN HB3 1 58 GLY H 3.219 . 4.514 3.611 3.467 3.852 . 0 0 "[ . 1 . 2]" 1
1152 1 56 ASN HB3 1 59 CYS H 2.886 . 3.927 2.218 2.091 2.393 . 0 0 "[ . 1 . 2]" 1
1153 1 56 ASN HB3 1 59 CYS HB3 3.214 . 4.505 3.451 1.850 3.598 0.073 10 0 "[ . 1 . 2]" 1
1154 1 56 ASN HB3 1 61 PRO HA 3.032 . 6.000 4.764 4.660 4.839 . 0 0 "[ . 1 . 2]" 1
1155 1 56 ASN HD21 1 59 CYS HB2 2.854 . 3.872 2.040 1.793 3.503 0.043 18 0 "[ . 1 . 2]" 1
1156 1 56 ASN HD21 1 59 CYS HB3 3.050 . 4.213 2.290 2.000 2.427 . 0 0 "[ . 1 . 2]" 1
1157 1 56 ASN HD21 1 61 PRO HA 2.628 . 6.000 3.832 3.658 4.032 . 0 0 "[ . 1 . 2]" 1
1158 1 56 ASN HD21 1 63 ALA H 3.055 . 4.222 4.292 4.232 4.333 0.111 3 0 "[ . 1 . 2]" 1
1159 1 56 ASN HD21 1 63 ALA MB 3.286 . 4.635 3.149 2.890 3.490 . 0 0 "[ . 1 . 2]" 1
1160 1 56 ASN HD22 1 59 CYS HB2 2.895 . 3.942 3.073 2.873 4.416 0.474 10 0 "[ . 1 . 2]" 1
1161 1 56 ASN HD22 1 59 CYS HB3 3.156 . 4.401 3.234 3.051 3.490 . 0 0 "[ . 1 . 2]" 1
1162 1 56 ASN HD22 1 61 PRO HA 2.692 . 3.598 3.569 3.347 3.654 0.056 2 0 "[ . 1 . 2]" 1
1163 1 56 ASN HD22 1 63 ALA H 2.960 . 4.055 4.158 4.086 4.209 0.154 15 0 "[ . 1 . 2]" 1
1164 1 56 ASN HD22 1 65 CYS HB3 2.924 . 3.992 2.710 2.320 3.283 . 0 0 "[ . 1 . 2]" 1
1165 1 57 GLY H 1 57 GLY HA3 2.427 . 3.163 2.851 2.822 2.891 . 0 0 "[ . 1 . 2]" 1
1166 1 57 GLY H 1 58 GLY H 2.494 . 3.272 2.515 2.348 2.593 . 0 0 "[ . 1 . 2]" 1
1167 1 57 GLY H 1 58 GLY HA2 2.203 . 6.000 4.819 4.655 4.889 . 0 0 "[ . 1 . 2]" 1
1168 1 57 GLY H 1 77 ILE MD 3.051 . 6.000 4.838 4.601 4.990 . 0 0 "[ . 1 . 2]" 1
1169 1 57 GLY H 1 77 ILE HG13 3.628 . 5.273 4.917 4.696 5.095 . 0 0 "[ . 1 . 2]" 1
1170 1 57 GLY H 1 77 ILE MG 3.085 . 4.275 4.323 4.263 4.434 0.159 20 0 "[ . 1 . 2]" 1
1171 1 57 GLY HA3 1 58 GLY H 2.928 . 4.000 3.435 3.402 3.456 . 0 0 "[ . 1 . 2]" 1
1172 1 57 GLY HA3 1 58 GLY HA2 2.010 . 6.000 5.263 5.241 5.285 . 0 0 "[ . 1 . 2]" 1
1173 1 57 GLY HA3 1 59 CYS H 3.003 . 4.130 4.075 3.772 4.218 0.088 10 0 "[ . 1 . 2]" 1
1174 1 57 GLY HA3 1 77 ILE MD 2.579 . 3.411 2.641 2.465 2.831 . 0 0 "[ . 1 . 2]" 1
1175 1 57 GLY HA3 1 77 ILE HG12 3.636 . 5.288 4.034 3.767 4.202 . 0 0 "[ . 1 . 2]" 1
1176 1 57 GLY HA3 1 77 ILE HG13 3.295 . 4.652 2.330 2.031 2.523 . 0 0 "[ . 1 . 2]" 1
1177 1 57 GLY HA3 1 77 ILE MG 2.449 . 3.199 2.002 1.773 2.120 . 0 0 "[ . 1 . 2]" 1
1178 1 58 GLY H 1 58 GLY HA2 2.242 . 2.870 2.350 2.317 2.375 . 0 0 "[ . 1 . 2]" 1
1179 1 58 GLY H 1 59 CYS H 2.223 . 2.841 2.138 2.056 2.237 . 0 0 "[ . 1 . 2]" 1
1180 1 58 GLY H 1 59 CYS HB2 3.516 . 5.061 4.382 4.192 4.538 . 0 0 "[ . 1 . 2]" 1
1181 1 58 GLY H 1 77 ILE MD 3.774 . 5.554 5.546 5.434 5.600 0.046 19 0 "[ . 1 . 2]" 1
1182 1 58 GLY H 1 77 ILE MG 3.551 . 5.127 4.255 4.102 4.440 . 0 0 "[ . 1 . 2]" 1
1183 1 58 GLY HA2 1 59 CYS H 2.615 . 3.470 3.016 2.920 3.072 . 0 0 "[ . 1 . 2]" 1
1184 1 59 CYS H 1 59 CYS HA 2.521 . 3.316 2.940 2.931 2.952 . 0 0 "[ . 1 . 2]" 1
1185 1 59 CYS H 1 59 CYS HB2 2.399 . 3.119 2.555 2.467 2.910 . 0 0 "[ . 1 . 2]" 1
1186 1 59 CYS H 1 59 CYS HB3 2.638 . 6.000 3.646 2.549 3.749 . 0 0 "[ . 1 . 2]" 1
1187 1 59 CYS H 1 60 ASP H 3.191 . 4.464 4.433 4.416 4.457 . 0 0 "[ . 1 . 2]" 1
1188 1 59 CYS H 1 63 ALA MB 3.188 . 6.000 5.499 5.321 5.997 . 0 0 "[ . 1 . 2]" 1
1189 1 59 CYS H 1 77 ILE MD 3.622 . 6.000 6.011 5.892 6.050 0.050 12 0 "[ . 1 . 2]" 1
1190 1 59 CYS H 1 77 ILE MG 2.977 . 4.085 3.963 3.855 4.131 0.046 4 0 "[ . 1 . 2]" 1
1191 1 59 CYS H 1 93 VAL HA 3.443 . 4.924 4.373 4.227 4.525 . 0 0 "[ . 1 . 2]" 1
1192 1 59 CYS H 1 93 VAL QG 3.631 . 5.279 4.026 3.922 4.156 . 0 0 "[ . 1 . 2]" 1
1193 1 59 CYS HA 1 59 CYS HB2 2.576 . 3.406 2.992 2.450 3.034 . 0 0 "[ . 1 . 2]" 1
1194 1 59 CYS HA 1 59 CYS HB3 2.407 . 3.131 2.509 2.433 3.021 . 0 0 "[ . 1 . 2]" 1
1195 1 59 CYS HA 1 60 ASP H 2.173 . 2.763 2.533 2.501 2.568 . 0 0 "[ . 1 . 2]" 1
1196 1 59 CYS HA 1 60 ASP HB3 3.157 . 6.000 4.797 4.676 4.947 . 0 0 "[ . 1 . 2]" 1
1197 1 59 CYS HA 1 79 CYS HB2 3.204 . 4.487 4.330 3.874 4.653 0.166 13 0 "[ . 1 . 2]" 1
1198 1 59 CYS HA 1 79 CYS HB3 3.222 . 4.520 3.537 3.219 4.705 0.185 20 0 "[ . 1 . 2]" 1
1199 1 59 CYS HA 1 93 VAL HA 2.261 . 2.900 1.852 1.765 1.949 . 0 0 "[ . 1 . 2]" 1
1200 1 59 CYS HA 1 93 VAL QG 2.674 . 3.568 2.904 2.835 2.983 . 0 0 "[ . 1 . 2]" 1
1201 1 59 CYS HB2 1 60 ASP H 2.877 . 3.911 3.355 3.210 3.662 . 0 0 "[ . 1 . 2]" 1
1202 1 59 CYS HB2 1 63 ALA H 3.679 . 6.000 5.877 5.666 6.749 0.749 10 1 "[ . + . 2]" 1
1203 1 59 CYS HB2 1 63 ALA MB 2.409 . 6.000 3.851 3.461 4.403 . 0 0 "[ . 1 . 2]" 1
1204 1 59 CYS HB2 1 65 CYS H 3.348 . 4.749 4.777 4.150 5.526 0.777 10 1 "[ . + . 2]" 1
1205 1 59 CYS HB2 1 65 CYS HB3 2.628 . 3.492 3.124 2.229 4.445 0.953 10 2 "[ . + . -]" 1
1206 1 59 CYS HB2 1 77 ILE MG 3.380 . 4.808 3.508 2.699 3.769 . 0 0 "[ . 1 . 2]" 1
1207 1 59 CYS HB2 1 79 CYS HB3 3.283 . 4.630 3.776 3.153 5.214 0.584 20 1 "[ . 1 . +]" 1
1208 1 59 CYS HB3 1 60 ASP H 2.640 . 3.511 2.175 2.074 3.309 . 0 0 "[ . 1 . 2]" 1
1209 1 59 CYS HB3 1 63 ALA MB 2.419 . 3.150 2.573 2.280 3.960 0.810 10 1 "[ . + . 2]" 1
1210 1 59 CYS HB3 1 79 CYS HB3 3.153 . 4.396 2.588 1.850 4.348 0.060 17 0 "[ . 1 . 2]" 1
1211 1 60 ASP H 1 60 ASP HB2 2.305 . 2.969 2.798 2.700 2.877 . 0 0 "[ . 1 . 2]" 1
1212 1 60 ASP H 1 60 ASP HB3 2.393 . 3.109 2.444 2.368 2.594 . 0 0 "[ . 1 . 2]" 1
1213 1 60 ASP H 1 61 PRO HD2 3.341 . 6.000 4.958 4.717 5.156 . 0 0 "[ . 1 . 2]" 1
1214 1 60 ASP H 1 63 ALA H 3.530 . 5.088 3.745 3.598 3.913 . 0 0 "[ . 1 . 2]" 1
1215 1 60 ASP H 1 63 ALA MB 2.587 . 3.424 2.034 1.941 2.420 . 0 0 "[ . 1 . 2]" 1
1216 1 60 ASP H 1 79 CYS HB3 3.551 . 5.127 3.745 3.453 4.115 . 0 0 "[ . 1 . 2]" 1
1217 1 60 ASP H 1 93 VAL H 3.458 . 4.953 4.799 4.754 4.866 . 0 0 "[ . 1 . 2]" 1
1218 1 60 ASP H 1 93 VAL HA 2.353 . 3.045 3.061 2.961 3.146 0.101 11 0 "[ . 1 . 2]" 1
1219 1 60 ASP H 1 93 VAL QG 3.032 . 4.716 4.224 4.136 4.288 . 0 0 "[ . 1 . 2]" 1
1220 1 60 ASP H 1 94 PHE H 3.319 . 4.696 4.630 4.561 4.714 0.018 15 0 "[ . 1 . 2]" 1
1221 1 60 ASP H 1 94 PHE HA 3.172 . 4.430 4.397 4.210 4.532 0.102 10 0 "[ . 1 . 2]" 1
1222 1 60 ASP HA 1 60 ASP HB2 2.517 . 3.309 2.473 2.423 2.541 . 0 0 "[ . 1 . 2]" 1
1223 1 60 ASP HA 1 60 ASP HB3 2.631 . 3.497 3.032 3.022 3.040 . 0 0 "[ . 1 . 2]" 1
1224 1 60 ASP HA 1 61 PRO HD2 2.205 . 2.813 2.353 2.035 2.631 . 0 0 "[ . 1 . 2]" 1
1225 1 60 ASP HA 1 61 PRO HD3 2.069 . 2.604 2.253 1.994 2.529 . 0 0 "[ . 1 . 2]" 1
1226 1 60 ASP HA 1 61 PRO HG2 2.742 . 6.000 4.389 4.201 4.583 . 0 0 "[ . 1 . 2]" 1
1227 1 60 ASP HB2 1 61 PRO HD2 3.473 . 4.981 3.770 3.503 4.128 . 0 0 "[ . 1 . 2]" 1
1228 1 60 ASP HB2 1 63 ALA H 3.181 . 4.446 4.135 4.074 4.267 . 0 0 "[ . 1 . 2]" 1
1229 1 60 ASP HB2 1 63 ALA MB 2.527 . 3.325 3.416 3.330 3.538 0.213 13 0 "[ . 1 . 2]" 1
1230 1 60 ASP HB2 1 93 VAL HA 3.068 . 4.245 3.703 3.541 3.860 . 0 0 "[ . 1 . 2]" 1
1231 1 60 ASP HB3 1 61 PRO HD2 3.366 . 4.782 4.026 3.843 4.222 . 0 0 "[ . 1 . 2]" 1
1232 1 60 ASP HB3 1 63 ALA H 2.603 . 3.450 2.482 2.354 2.651 . 0 0 "[ . 1 . 2]" 1
1233 1 60 ASP HB3 1 63 ALA MB 2.334 . 3.015 2.174 2.007 2.461 . 0 0 "[ . 1 . 2]" 1
1234 1 60 ASP HB3 1 93 VAL HA 3.233 . 4.539 4.579 4.462 4.679 0.140 20 0 "[ . 1 . 2]" 1
1235 1 60 ASP HB3 1 94 PHE HA 2.992 . 4.111 3.134 2.910 3.322 . 0 0 "[ . 1 . 2]" 1
1236 1 61 PRO HA 1 61 PRO HB2 2.334 . 3.015 2.915 2.802 2.989 . 0 0 "[ . 1 . 2]" 1
1237 1 61 PRO HA 1 61 PRO HB3 2.096 . 2.645 2.280 2.253 2.304 . 0 0 "[ . 1 . 2]" 1
1238 1 61 PRO HA 1 61 PRO HD2 2.953 . 4.043 3.956 3.919 4.015 . 0 0 "[ . 1 . 2]" 1
1239 1 61 PRO HA 1 61 PRO HD3 2.783 . 3.751 3.411 3.225 3.586 . 0 0 "[ . 1 . 2]" 1
1240 1 61 PRO HA 1 62 THR H 3.218 . 4.513 3.545 3.523 3.579 . 0 0 "[ . 1 . 2]" 1
1241 1 61 PRO HA 1 63 ALA H 3.346 . 4.746 4.367 4.158 4.542 . 0 0 "[ . 1 . 2]" 1
1242 1 61 PRO HB2 1 61 PRO HD2 2.749 . 3.694 3.407 3.014 3.957 0.263 3 0 "[ . 1 . 2]" 1
1243 1 61 PRO HB2 1 61 PRO HD3 2.804 . 3.787 3.856 3.846 3.864 0.077 6 0 "[ . 1 . 2]" 1
1244 1 61 PRO HB2 1 62 THR H 2.935 . 4.012 2.960 2.463 3.272 . 0 0 "[ . 1 . 2]" 1
1245 1 61 PRO HB2 1 62 THR MG 2.634 . 3.501 3.187 2.802 3.481 . 0 0 "[ . 1 . 2]" 1
1246 1 61 PRO HB3 1 61 PRO HD2 2.840 . 3.848 3.916 3.901 3.933 0.085 11 0 "[ . 1 . 2]" 1
1247 1 61 PRO HB3 1 61 PRO HD3 2.775 . 3.738 3.585 3.021 3.963 0.225 20 0 "[ . 1 . 2]" 1
1248 1 61 PRO HB3 1 61 PRO HG2 2.046 . 2.569 2.767 2.638 2.962 0.393 3 0 "[ . 1 . 2]" 1
1249 1 61 PRO HB3 1 62 THR H 3.174 . 4.434 4.147 3.852 4.287 . 0 0 "[ . 1 . 2]" 1
1250 1 61 PRO HB3 1 62 THR MG 2.995 . 6.000 4.622 4.212 4.899 . 0 0 "[ . 1 . 2]" 1
1251 1 61 PRO HD2 1 61 PRO HG2 2.207 . 2.816 2.278 2.273 2.285 . 0 0 "[ . 1 . 2]" 1
1252 1 61 PRO HD2 1 62 THR H 3.139 . 4.371 3.171 3.031 3.313 . 0 0 "[ . 1 . 2]" 1
1253 1 61 PRO HD2 1 62 THR MG 3.151 . 4.392 4.260 3.864 4.418 0.026 6 0 "[ . 1 . 2]" 1
1254 1 61 PRO HD3 1 61 PRO HG2 2.194 . 2.796 2.818 2.694 2.980 0.184 9 0 "[ . 1 . 2]" 1
1255 1 61 PRO HD3 1 62 THR H 3.353 . 4.758 4.208 4.131 4.260 . 0 0 "[ . 1 . 2]" 1
1256 1 61 PRO HG2 1 62 THR H 3.098 . 4.298 3.700 2.870 4.334 0.036 13 0 "[ . 1 . 2]" 1
1257 1 61 PRO HG2 1 62 THR MG 2.813 . 6.000 3.975 2.993 4.811 . 0 0 "[ . 1 . 2]" 1
1258 1 62 THR H 1 62 THR HA 2.677 . 3.573 2.903 2.868 2.924 . 0 0 "[ . 1 . 2]" 1
1259 1 62 THR H 1 63 ALA H 2.377 . 3.083 2.308 2.167 2.438 . 0 0 "[ . 1 . 2]" 1
1260 1 62 THR HB 1 62 THR MG 2.106 . 2.661 2.131 2.128 2.135 . 0 0 "[ . 1 . 2]" 1
1261 1 62 THR MG 1 85 THR MG 2.389 . 3.103 2.827 2.374 3.155 0.052 7 0 "[ . 1 . 2]" 1
1262 1 63 ALA H 1 63 ALA HA 2.397 . 3.115 2.845 2.794 2.880 . 0 0 "[ . 1 . 2]" 1
1263 1 63 ALA H 1 63 ALA MB 2.024 . 2.536 2.212 2.163 2.246 . 0 0 "[ . 1 . 2]" 1
1264 1 63 ALA H 1 64 SER H 3.255 . 4.579 4.292 4.082 4.520 . 0 0 "[ . 1 . 2]" 1
1265 1 63 ALA H 1 80 THR MG 3.207 . 6.000 6.258 6.174 6.399 0.399 20 0 "[ . 1 . 2]" 1
1266 1 63 ALA H 1 81 CYS HA 3.292 . 6.000 4.670 4.264 5.075 . 0 0 "[ . 1 . 2]" 1
1267 1 63 ALA H 1 94 PHE HA 3.585 . 5.192 5.422 5.286 5.572 0.380 16 0 "[ . 1 . 2]" 1
1268 1 63 ALA HA 1 63 ALA MB 2.020 . 2.530 2.133 2.128 2.138 . 0 0 "[ . 1 . 2]" 1
1269 1 63 ALA HA 1 64 SER H 2.136 . 2.706 2.171 2.123 2.262 . 0 0 "[ . 1 . 2]" 1
1270 1 63 ALA HA 1 64 SER QB 3.127 . 6.000 4.156 4.055 4.547 . 0 0 "[ . 1 . 2]" 1
1271 1 63 ALA MB 1 64 SER H 2.210 . 6.000 3.409 3.068 3.596 . 0 0 "[ . 1 . 2]" 1
1272 1 63 ALA MB 1 79 CYS HA 2.759 . 3.711 2.944 2.619 3.664 . 0 0 "[ . 1 . 2]" 1
1273 1 63 ALA MB 1 79 CYS HB2 2.711 . 3.630 2.022 1.750 3.433 0.042 15 0 "[ . 1 . 2]" 1
1274 1 63 ALA MB 1 79 CYS HB3 2.997 . 4.119 2.794 2.064 3.227 . 0 0 "[ . 1 . 2]" 1
1275 1 63 ALA MB 1 80 THR H 2.297 . 2.957 2.277 1.946 2.983 0.026 20 0 "[ . 1 . 2]" 1
1276 1 63 ALA MB 1 81 CYS QB 3.488 . 5.009 3.772 3.261 4.150 . 0 0 "[ . 1 . 2]" 1
1277 1 64 SER H 1 64 SER HA 2.637 . 3.506 2.783 2.730 2.866 . 0 0 "[ . 1 . 2]" 1
1278 1 64 SER H 1 64 SER QB 2.460 . 3.184 2.289 2.192 2.681 . 0 0 "[ . 1 . 2]" 1
1279 1 64 SER H 1 80 THR MG 3.297 . 4.656 3.146 2.758 3.549 . 0 0 "[ . 1 . 2]" 1
1280 1 64 SER HA 1 64 SER QB 2.444 . 3.080 2.377 2.254 2.436 . 0 0 "[ . 1 . 2]" 1
1281 1 64 SER HA 1 65 CYS H 2.036 . 2.554 2.146 2.124 2.186 . 0 0 "[ . 1 . 2]" 1
1282 1 64 SER QB 1 65 CYS H 2.610 . 6.000 3.866 3.506 3.958 . 0 0 "[ . 1 . 2]" 1
1283 1 64 SER QB 1 80 THR H 2.978 . 4.087 3.471 2.977 3.846 . 0 0 "[ . 1 . 2]" 1
1284 1 64 SER QB 1 80 THR MG 2.806 . 3.790 2.798 2.212 3.449 . 0 0 "[ . 1 . 2]" 1
1285 1 64 SER QB 1 82 LYS QD 3.316 . 4.690 3.617 2.456 4.299 . 0 0 "[ . 1 . 2]" 1
1286 1 65 CYS H 1 65 CYS HA 2.548 . 3.360 2.860 2.819 2.897 . 0 0 "[ . 1 . 2]" 1
1287 1 65 CYS H 1 65 CYS HB3 2.450 . 3.200 2.442 2.129 2.762 . 0 0 "[ . 1 . 2]" 1
1288 1 65 CYS H 1 79 CYS HB2 2.460 . 6.000 6.244 5.970 6.603 0.603 16 2 "[ . 1 -.+ 2]" 1
1289 1 65 CYS HA 1 65 CYS HB3 2.438 . 3.181 2.700 2.356 3.009 . 0 0 "[ . 1 . 2]" 1
1290 1 65 CYS HA 1 66 GLN H 1.932 . 2.398 2.182 2.099 2.257 . 0 0 "[ . 1 . 2]" 1
1291 1 65 CYS HA 1 79 CYS HA 2.488 . 3.261 2.629 2.386 2.965 . 0 0 "[ . 1 . 2]" 1
1292 1 65 CYS HA 1 79 CYS HB2 2.582 . 6.000 4.935 3.950 5.270 . 0 0 "[ . 1 . 2]" 1
1293 1 65 CYS HA 1 80 THR H 3.231 . 4.536 4.077 3.669 4.571 0.035 4 0 "[ . 1 . 2]" 1
1294 1 65 CYS HB3 1 66 GLN H 2.917 . 3.980 4.010 3.778 4.165 0.185 10 0 "[ . 1 . 2]" 1
1295 1 65 CYS HB3 1 77 ILE MG 3.482 . 4.997 3.759 2.956 4.348 . 0 0 "[ . 1 . 2]" 1
1296 1 66 GLN H 1 66 GLN HA 2.566 . 3.389 2.933 2.904 2.945 . 0 0 "[ . 1 . 2]" 1
1297 1 66 GLN H 1 66 GLN HB3 2.937 . 4.015 3.363 2.380 3.895 . 0 0 "[ . 1 . 2]" 1
1298 1 66 GLN H 1 66 GLN QG 2.718 . 3.642 2.972 2.438 3.473 . 0 0 "[ . 1 . 2]" 1
1299 1 66 GLN H 1 77 ILE HA 3.439 . 4.917 3.945 3.359 4.451 . 0 0 "[ . 1 . 2]" 1
1300 1 66 GLN H 1 77 ILE MG 2.922 . 3.989 2.718 2.347 3.173 . 0 0 "[ . 1 . 2]" 1
1301 1 66 GLN H 1 78 ILE HB 3.025 . 4.169 3.036 2.413 3.558 . 0 0 "[ . 1 . 2]" 1
1302 1 66 GLN H 1 79 CYS HA 3.243 . 6.000 4.172 3.321 4.625 . 0 0 "[ . 1 . 2]" 1
1303 1 66 GLN HA 1 66 GLN HB2 2.730 . 3.661 2.751 2.238 3.035 . 0 0 "[ . 1 . 2]" 1
1304 1 66 GLN HA 1 66 GLN HB3 2.744 . 3.685 2.576 2.378 2.909 . 0 0 "[ . 1 . 2]" 1
1305 1 66 GLN HA 1 66 GLN QG 2.416 . 3.146 2.662 2.357 3.068 . 0 0 "[ . 1 . 2]" 1
1306 1 66 GLN HA 1 67 ASN H 1.983 . 2.474 2.183 2.116 2.248 . 0 0 "[ . 1 . 2]" 1
1307 1 66 GLN HA 1 67 ASN HA 2.669 . 6.000 4.372 4.332 4.420 . 0 0 "[ . 1 . 2]" 1
1308 1 66 GLN HB2 1 66 GLN HE21 2.862 . 3.886 2.571 1.708 3.983 0.130 1 0 "[ . 1 . 2]" 1
1309 1 66 GLN HB2 1 66 GLN HE22 3.132 . 4.358 3.819 3.217 4.575 0.217 3 0 "[ . 1 . 2]" 1
1310 1 66 GLN HB2 1 67 ASN H 2.881 . 3.919 3.944 3.467 4.332 0.413 5 0 "[ . 1 . 2]" 1
1311 1 66 GLN HB2 1 68 ALA MB 3.361 . 4.773 4.374 3.821 4.856 0.083 1 0 "[ . 1 . 2]" 1
1312 1 66 GLN HB2 1 78 ILE HB 2.786 . 3.756 2.473 1.741 3.765 0.075 13 0 "[ . 1 . 2]" 1
1313 1 66 GLN HB2 1 78 ILE MD 2.929 . 4.002 2.940 2.129 4.084 0.082 6 0 "[ . 1 . 2]" 1
1314 1 66 GLN HB2 1 78 ILE MG 3.220 . 4.516 3.747 3.283 4.536 0.020 6 0 "[ . 1 . 2]" 1
1315 1 66 GLN HB3 1 66 GLN HE21 3.004 . 4.132 2.380 1.706 4.113 0.170 18 0 "[ . 1 . 2]" 1
1316 1 66 GLN HB3 1 66 GLN HE22 3.286 . 4.636 3.676 3.147 4.670 0.034 17 0 "[ . 1 . 2]" 1
1317 1 66 GLN HB3 1 67 ASN H 3.087 . 4.278 3.709 2.999 4.418 0.140 17 0 "[ . 1 . 2]" 1
1318 1 66 GLN HB3 1 68 ALA MB 3.280 . 4.625 4.419 3.883 4.820 0.195 17 0 "[ . 1 . 2]" 1
1319 1 66 GLN HB3 1 78 ILE HB 2.828 . 3.827 2.974 1.801 3.712 0.028 1 0 "[ . 1 . 2]" 1
1320 1 66 GLN HB3 1 78 ILE MD 2.950 . 4.038 3.286 3.042 4.038 . 0 0 "[ . 1 . 2]" 1
1321 1 66 GLN HB3 1 78 ILE MG 3.206 . 4.491 4.057 3.075 4.590 0.099 5 0 "[ . 1 . 2]" 1
1322 1 66 GLN QG 1 67 ASN H 2.670 . 6.000 3.807 2.694 4.506 . 0 0 "[ . 1 . 2]" 1
1323 1 66 GLN QG 1 78 ILE HB 2.429 . 3.166 2.484 1.927 3.084 . 0 0 "[ . 1 . 2]" 1
1324 1 67 ASN H 1 67 ASN HA 2.562 . 3.382 2.885 2.832 2.929 . 0 0 "[ . 1 . 2]" 1
1325 1 67 ASN H 1 67 ASN HB2 2.306 . 2.971 3.088 2.517 3.598 0.627 17 4 "[ -. * 1 *. + 2]" 1
1326 1 67 ASN H 1 67 ASN HB3 2.330 . 3.009 2.659 2.307 3.025 0.016 18 0 "[ . 1 . 2]" 1
1327 1 67 ASN HA 1 67 ASN HB2 2.174 . 2.765 2.494 2.363 2.640 . 0 0 "[ . 1 . 2]" 1
1328 1 67 ASN HA 1 67 ASN HB3 2.397 . 3.115 2.719 2.270 3.032 . 0 0 "[ . 1 . 2]" 1
1329 1 67 ASN HA 1 68 ALA H 1.962 . 2.443 2.166 2.101 2.224 . 0 0 "[ . 1 . 2]" 1
1330 1 67 ASN HA 1 77 ILE HA 3.209 . 4.496 3.448 3.074 3.743 . 0 0 "[ . 1 . 2]" 1
1331 1 67 ASN HA 1 77 ILE MD 2.313 . 2.982 1.987 1.772 2.300 . 0 0 "[ . 1 . 2]" 1
1332 1 67 ASN HA 1 77 ILE MG 2.912 . 3.972 3.276 2.851 3.575 . 0 0 "[ . 1 . 2]" 1
1333 1 67 ASN HB2 1 67 ASN HD22 2.844 . 3.855 3.656 3.414 4.003 0.148 17 0 "[ . 1 . 2]" 1
1334 1 67 ASN HB2 1 68 ALA H 2.688 . 6.000 3.769 2.959 4.339 . 0 0 "[ . 1 . 2]" 1
1335 1 67 ASN HB3 1 67 ASN HD21 2.678 . 3.575 2.563 2.214 3.505 . 0 0 "[ . 1 . 2]" 1
1336 1 67 ASN HB3 1 67 ASN HD22 2.900 . 3.951 3.622 3.469 4.051 0.100 13 0 "[ . 1 . 2]" 1
1337 1 68 ALA H 1 68 ALA HA 2.457 . 3.212 2.893 2.859 2.917 . 0 0 "[ . 1 . 2]" 1
1338 1 68 ALA H 1 68 ALA MB 2.282 . 2.933 2.716 2.632 2.824 . 0 0 "[ . 1 . 2]" 1
1339 1 68 ALA H 1 69 GLU H 3.239 . 4.550 4.363 4.324 4.391 . 0 0 "[ . 1 . 2]" 1
1340 1 68 ALA H 1 77 ILE HA 2.824 . 3.821 3.484 3.211 3.849 0.028 17 0 "[ . 1 . 2]" 1
1341 1 68 ALA H 1 77 ILE MD 2.870 . 3.900 2.089 1.815 2.249 0.025 14 0 "[ . 1 . 2]" 1
1342 1 68 ALA H 1 77 ILE MG 3.448 . 4.934 4.369 4.085 4.634 . 0 0 "[ . 1 . 2]" 1
1343 1 68 ALA HA 1 68 ALA MB 1.929 . 2.394 2.128 2.121 2.134 . 0 0 "[ . 1 . 2]" 1
1344 1 68 ALA HA 1 69 GLU H 1.910 . 2.366 2.385 2.351 2.420 0.054 18 0 "[ . 1 . 2]" 1
1345 1 68 ALA HA 1 69 GLU HB2 2.963 . 6.000 4.621 4.097 5.717 . 0 0 "[ . 1 . 2]" 1
1346 1 68 ALA HA 1 78 ILE MD 2.974 . 6.000 5.218 4.789 5.893 . 0 0 "[ . 1 . 2]" 1
1347 1 68 ALA MB 1 69 GLU H 2.281 . 2.931 2.384 2.293 2.452 . 0 0 "[ . 1 . 2]" 1
1348 1 68 ALA MB 1 69 GLU HB2 3.060 . 6.000 4.878 4.542 5.464 . 0 0 "[ . 1 . 2]" 1
1349 1 68 ALA MB 1 70 SER H 3.581 . 5.184 5.147 4.835 5.265 0.081 6 0 "[ . 1 . 2]" 1
1350 1 68 ALA MB 1 70 SER QB 3.234 . 4.541 4.258 3.935 4.453 . 0 0 "[ . 1 . 2]" 1
1351 1 68 ALA MB 1 76 LYS HA 2.344 . 3.031 2.894 2.631 3.064 0.033 8 0 "[ . 1 . 2]" 1
1352 1 68 ALA MB 1 77 ILE H 3.186 . 4.455 4.385 4.218 4.516 0.061 4 0 "[ . 1 . 2]" 1
1353 1 69 GLU H 1 69 GLU HA 2.465 . 3.224 2.945 2.930 2.958 . 0 0 "[ . 1 . 2]" 1
1354 1 69 GLU H 1 69 GLU HB2 2.220 . 2.836 3.029 2.405 3.752 0.916 16 3 "[ .* 1- .+ 2]" 1
1355 1 69 GLU H 1 69 GLU HB3 2.236 . 6.000 2.843 2.436 3.772 . 0 0 "[ . 1 . 2]" 1
1356 1 69 GLU H 1 70 SER H 3.259 . 4.587 4.457 4.399 4.519 . 0 0 "[ . 1 . 2]" 1
1357 1 69 GLU HA 1 69 GLU HB2 2.293 . 2.950 2.557 2.406 3.019 0.069 5 0 "[ . 1 . 2]" 1
1358 1 69 GLU HA 1 69 GLU HB3 2.277 . 2.925 2.835 2.393 3.029 0.104 12 0 "[ . 1 . 2]" 1
1359 1 69 GLU HA 1 70 SER H 2.089 . 2.635 2.256 2.160 2.370 . 0 0 "[ . 1 . 2]" 1
1360 1 69 GLU HB2 1 70 SER H 2.933 . 4.008 3.777 2.561 4.085 0.077 3 0 "[ . 1 . 2]" 1
1361 1 69 GLU HB3 1 70 SER H 2.935 . 4.011 3.676 2.595 4.061 0.050 4 0 "[ . 1 . 2]" 1
1362 1 70 SER H 1 70 SER HA 2.421 . 3.154 2.857 2.809 2.893 . 0 0 "[ . 1 . 2]" 1
1363 1 70 SER H 1 70 SER QB 2.826 . 3.795 2.910 2.739 3.121 . 0 0 "[ . 1 . 2]" 1
1364 1 70 SER H 1 76 LYS HA 3.239 . 6.000 4.681 3.976 5.572 . 0 0 "[ . 1 . 2]" 1
1365 1 70 SER H 1 76 LYS HB2 3.429 . 4.898 4.820 3.871 5.359 0.461 5 0 "[ . 1 . 2]" 1
1366 1 70 SER H 1 76 LYS QE 3.593 . 5.207 2.536 1.786 3.578 0.193 9 0 "[ . 1 . 2]" 1
1367 1 70 SER H 1 76 LYS HG3 3.104 . 4.309 3.682 3.075 4.342 0.033 11 0 "[ . 1 . 2]" 1
1368 1 70 SER HA 1 70 SER QB 2.251 . 2.884 2.379 2.184 2.515 . 0 0 "[ . 1 . 2]" 1
1369 1 70 SER HA 1 71 THR H 2.043 . 2.565 2.547 2.329 2.687 0.122 15 0 "[ . 1 . 2]" 1
1370 1 70 SER QB 1 71 THR H 3.177 . 4.243 2.574 2.227 3.320 . 0 0 "[ . 1 . 2]" 1
1371 1 70 SER QB 1 72 GLU H 3.046 . 4.047 2.688 2.454 2.977 . 0 0 "[ . 1 . 2]" 1
1372 1 70 SER QB 1 72 GLU HB2 2.708 . 3.625 3.567 3.270 3.722 0.097 16 0 "[ . 1 . 2]" 1
1373 1 70 SER QB 1 76 LYS HA 2.833 . 3.836 2.636 2.203 3.357 . 0 0 "[ . 1 . 2]" 1
1374 1 70 SER QB 1 76 LYS HD3 2.754 . 3.702 3.663 2.966 4.579 0.877 19 1 "[ . 1 . +2]" 1
1375 1 70 SER QB 1 76 LYS HG2 2.892 . 3.938 2.082 1.668 3.727 0.217 14 0 "[ . 1 . 2]" 1
1376 1 70 SER QB 1 76 LYS HG3 2.999 . 4.123 2.939 1.839 3.663 0.044 13 0 "[ . 1 . 2]" 1
1377 1 71 THR H 1 71 THR HA 2.442 . 3.188 2.857 2.756 2.917 . 0 0 "[ . 1 . 2]" 1
1378 1 71 THR H 1 71 THR HB 2.777 . 3.741 3.205 2.535 3.649 . 0 0 "[ . 1 . 2]" 1
1379 1 71 THR H 1 71 THR MG 2.288 . 2.943 2.386 1.986 2.976 0.033 9 0 "[ . 1 . 2]" 1
1380 1 71 THR H 1 72 GLU H 2.759 . 3.711 2.481 2.198 2.954 . 0 0 "[ . 1 . 2]" 1
1381 1 71 THR HA 1 72 GLU H 2.611 . 3.463 3.460 3.278 3.555 0.092 12 0 "[ . 1 . 2]" 1
1382 1 71 THR HB 1 71 THR MG 1.980 . 2.470 2.134 2.131 2.139 . 0 0 "[ . 1 . 2]" 1
1383 1 71 THR MG 1 72 GLU H 3.192 . 4.466 3.403 2.185 4.129 . 0 0 "[ . 1 . 2]" 1
1384 1 72 GLU H 1 72 GLU HA 2.366 . 3.065 2.913 2.840 2.957 . 0 0 "[ . 1 . 2]" 1
1385 1 72 GLU H 1 72 GLU HB2 2.396 . 3.114 2.471 2.338 2.622 . 0 0 "[ . 1 . 2]" 1
1386 1 72 GLU H 1 72 GLU HB3 2.658 . 6.000 3.635 3.551 3.760 . 0 0 "[ . 1 . 2]" 1
1387 1 72 GLU H 1 72 GLU QG 2.261 . 2.900 2.697 2.246 3.130 0.230 7 0 "[ . 1 . 2]" 1
1388 1 72 GLU HA 1 72 GLU HB2 2.381 . 3.090 3.014 2.999 3.027 . 0 0 "[ . 1 . 2]" 1
1389 1 72 GLU HA 1 72 GLU HB3 2.260 . 2.898 2.467 2.380 2.526 . 0 0 "[ . 1 . 2]" 1
1390 1 72 GLU HA 1 72 GLU QG 2.176 . 2.768 2.802 2.347 3.093 0.325 11 0 "[ . 1 . 2]" 1
1391 1 72 GLU HA 1 73 ASN H 2.054 . 2.581 2.188 2.142 2.246 . 0 0 "[ . 1 . 2]" 1
1392 1 72 GLU HB2 1 72 GLU QG 1.940 . 2.410 2.195 2.129 2.446 0.036 2 0 "[ . 1 . 2]" 1
1393 1 72 GLU HB2 1 75 LYS H 2.449 . 3.199 2.750 2.241 3.254 0.055 15 0 "[ . 1 . 2]" 1
1394 1 72 GLU HB2 1 75 LYS HD2 2.530 . 3.330 3.072 2.352 4.128 0.798 17 2 "[ . - . + 2]" 1
1395 1 72 GLU HB2 1 75 LYS HG3 2.354 . 3.046 2.127 1.617 2.428 0.045 17 0 "[ . 1 . 2]" 1
1396 1 72 GLU HB3 1 74 SER H 3.214 . 4.505 2.732 2.516 3.108 . 0 0 "[ . 1 . 2]" 1
1397 1 72 GLU HB3 1 75 LYS HG3 3.028 . 4.174 2.276 1.793 3.614 0.089 2 0 "[ . 1 . 2]" 1
1398 1 72 GLU QG 1 73 ASN H 2.852 . 6.000 4.613 4.324 4.841 . 0 0 "[ . 1 . 2]" 1
1399 1 72 GLU QG 1 74 SER H 3.262 . 4.592 4.676 4.608 4.828 0.236 16 0 "[ . 1 . 2]" 1
1400 1 72 GLU QG 1 75 LYS H 3.049 . 6.000 4.322 3.869 4.757 . 0 0 "[ . 1 . 2]" 1
1401 1 72 GLU QG 1 75 LYS HD2 2.717 . 3.640 2.514 1.757 3.849 0.209 17 0 "[ . 1 . 2]" 1
1402 1 72 GLU QG 1 75 LYS HD3 2.832 . 3.834 3.329 2.012 3.891 0.057 18 0 "[ . 1 . 2]" 1
1403 1 72 GLU QG 1 75 LYS QE 2.831 . 3.833 2.574 1.822 3.883 0.050 15 0 "[ . 1 . 2]" 1
1404 1 72 GLU QG 1 75 LYS HG2 2.739 . 3.677 3.775 3.233 3.963 0.286 2 0 "[ . 1 . 2]" 1
1405 1 72 GLU QG 1 75 LYS HG3 2.640 . 3.511 2.599 2.307 3.742 0.231 16 0 "[ . 1 . 2]" 1
1406 1 73 ASN H 1 73 ASN HB2 2.652 . 3.531 2.993 2.445 3.603 0.072 17 0 "[ . 1 . 2]" 1
1407 1 73 ASN H 1 73 ASN HB3 2.603 . 3.450 3.383 2.744 3.589 0.139 4 0 "[ . 1 . 2]" 1
1408 1 73 ASN H 1 74 SER H 3.435 . 4.910 2.630 2.442 2.889 . 0 0 "[ . 1 . 2]" 1
1409 1 73 ASN H 1 76 LYS QE 3.428 . 4.897 3.468 2.769 4.281 . 0 0 "[ . 1 . 2]" 1
1410 1 73 ASN HA 1 74 SER H 3.146 . 4.383 3.468 3.426 3.505 . 0 0 "[ . 1 . 2]" 1
1411 1 73 ASN HA 1 76 LYS HD2 2.534 . 3.336 2.936 1.861 3.476 0.140 10 0 "[ . 1 . 2]" 1
1412 1 73 ASN HA 1 76 LYS HD3 2.712 . 6.000 3.644 1.668 4.174 . 0 0 "[ . 1 . 2]" 1
1413 1 73 ASN HA 1 76 LYS QE 2.415 . 3.144 1.594 1.378 2.119 0.308 18 0 "[ . 1 . 2]" 1
1414 1 73 ASN HA 1 76 LYS HG2 2.861 . 3.884 3.774 3.368 4.176 0.292 19 0 "[ . 1 . 2]" 1
1415 1 73 ASN HA 1 76 LYS HG3 2.945 . 4.029 2.539 1.854 4.061 0.032 20 0 "[ . 1 . 2]" 1
1416 1 73 ASN HB2 1 74 SER HA 3.067 . 4.243 4.075 3.892 4.308 0.065 13 0 "[ . 1 . 2]" 1
1417 1 74 SER H 1 74 SER HA 2.621 . 3.480 2.890 2.864 2.926 . 0 0 "[ . 1 . 2]" 1
1418 1 74 SER H 1 74 SER HB2 2.568 . 3.392 2.765 2.433 3.600 0.208 13 0 "[ . 1 . 2]" 1
1419 1 74 SER H 1 74 SER HB3 2.613 . 6.000 3.073 2.465 3.646 . 0 0 "[ . 1 . 2]" 1
1420 1 74 SER H 1 75 LYS H 2.781 . 3.748 2.418 2.339 2.498 . 0 0 "[ . 1 . 2]" 1
1421 1 74 SER H 1 75 LYS HG3 3.578 . 5.178 3.976 3.680 4.807 . 0 0 "[ . 1 . 2]" 1
1422 1 74 SER HA 1 74 SER HB3 2.179 . 2.772 2.654 2.281 3.033 0.261 19 0 "[ . 1 . 2]" 1
1423 1 74 SER HA 1 75 LYS H 2.918 . 3.982 3.360 3.183 3.474 . 0 0 "[ . 1 . 2]" 1
1424 1 74 SER HA 1 76 LYS QE 2.743 . 6.000 5.696 5.387 5.889 . 0 0 "[ . 1 . 2]" 1
1425 1 74 SER HB3 1 75 LYS H 3.188 . 4.459 3.923 3.175 4.517 0.058 1 0 "[ . 1 . 2]" 1
1426 1 75 LYS H 1 75 LYS HB2 2.960 . 4.055 2.719 2.483 3.750 . 0 0 "[ . 1 . 2]" 1
1427 1 75 LYS H 1 75 LYS HG2 2.879 . 3.915 3.381 2.065 3.865 . 0 0 "[ . 1 . 2]" 1
1428 1 75 LYS H 1 75 LYS HG3 2.896 . 3.944 2.752 2.467 3.208 . 0 0 "[ . 1 . 2]" 1
1429 1 75 LYS H 1 76 LYS H 2.435 . 3.176 2.327 2.104 2.646 . 0 0 "[ . 1 . 2]" 1
1430 1 75 LYS HA 1 75 LYS HD2 2.799 . 6.000 4.591 3.981 4.891 . 0 0 "[ . 1 . 2]" 1
1431 1 75 LYS HA 1 75 LYS HG2 2.628 . 3.492 2.604 2.382 3.573 0.081 15 0 "[ . 1 . 2]" 1
1432 1 75 LYS HA 1 75 LYS HG3 2.561 . 3.381 3.395 3.297 3.765 0.384 16 0 "[ . 1 . 2]" 1
1433 1 75 LYS HA 1 76 LYS H 2.778 . 3.742 3.167 2.949 3.489 . 0 0 "[ . 1 . 2]" 1
1434 1 75 LYS HA 1 77 ILE H 2.549 . 6.000 4.619 4.308 4.913 . 0 0 "[ . 1 . 2]" 1
1435 1 75 LYS HD2 1 75 LYS QE 2.306 . 2.971 2.310 2.165 2.411 . 0 0 "[ . 1 . 2]" 1
1436 1 75 LYS HD2 1 75 LYS HG2 2.276 . 2.923 2.860 2.367 3.001 0.078 1 0 "[ . 1 . 2]" 1
1437 1 75 LYS HD2 1 75 LYS HG3 2.458 . 3.213 2.538 2.360 3.009 . 0 0 "[ . 1 . 2]" 1
1438 1 75 LYS QE 1 75 LYS HG3 2.657 . 3.539 2.607 2.315 3.290 . 0 0 "[ . 1 . 2]" 1
1439 1 76 LYS H 1 76 LYS HA 2.776 . 3.739 2.904 2.850 2.942 . 0 0 "[ . 1 . 2]" 1
1440 1 76 LYS H 1 76 LYS HB2 2.732 . 3.665 2.658 2.455 3.710 0.045 20 0 "[ . 1 . 2]" 1
1441 1 76 LYS H 1 76 LYS HB3 2.892 . 3.937 3.580 2.851 3.690 . 0 0 "[ . 1 . 2]" 1
1442 1 76 LYS H 1 76 LYS HD2 3.542 . 5.110 4.099 2.485 4.552 . 0 0 "[ . 1 . 2]" 1
1443 1 76 LYS H 1 76 LYS HG3 3.158 . 4.404 2.628 2.116 3.785 . 0 0 "[ . 1 . 2]" 1
1444 1 76 LYS H 1 77 ILE H 2.603 . 3.450 2.468 2.197 2.689 . 0 0 "[ . 1 . 2]" 1
1445 1 76 LYS HA 1 76 LYS HB2 2.657 . 3.539 2.963 2.482 3.027 . 0 0 "[ . 1 . 2]" 1
1446 1 76 LYS HA 1 76 LYS HB3 2.364 . 3.063 2.434 2.318 2.508 . 0 0 "[ . 1 . 2]" 1
1447 1 76 LYS HA 1 76 LYS HG2 2.813 . 3.802 2.694 2.438 3.639 . 0 0 "[ . 1 . 2]" 1
1448 1 76 LYS HA 1 76 LYS HG3 2.311 . 6.000 3.317 2.441 4.221 . 0 0 "[ . 1 . 2]" 1
1449 1 76 LYS HA 1 77 ILE H 2.694 . 3.601 3.549 3.523 3.566 . 0 0 "[ . 1 . 2]" 1
1450 1 76 LYS HB2 1 76 LYS QE 3.235 . 4.543 3.652 3.498 3.792 . 0 0 "[ . 1 . 2]" 1
1451 1 76 LYS HB2 1 76 LYS HG3 2.442 . 3.187 2.385 2.226 2.804 . 0 0 "[ . 1 . 2]" 1
1452 1 76 LYS HB2 1 77 ILE H 2.772 . 3.732 2.345 2.067 3.769 0.037 17 0 "[ . 1 . 2]" 1
1453 1 76 LYS HB3 1 76 LYS HD2 2.701 . 3.613 2.597 2.011 3.742 0.129 19 0 "[ . 1 . 2]" 1
1454 1 76 LYS HB3 1 76 LYS HD3 2.475 . 3.241 2.732 2.504 3.419 0.178 20 0 "[ . 1 . 2]" 1
1455 1 76 LYS HB3 1 76 LYS QE 3.209 . 4.496 3.877 2.941 4.164 . 0 0 "[ . 1 . 2]" 1
1456 1 76 LYS HB3 1 76 LYS HG2 2.771 . 3.731 2.516 2.204 2.935 . 0 0 "[ . 1 . 2]" 1
1457 1 76 LYS HB3 1 76 LYS HG3 2.420 . 3.152 2.951 2.652 3.004 . 0 0 "[ . 1 . 2]" 1
1458 1 76 LYS HB3 1 77 ILE H 3.295 . 4.652 3.425 3.177 4.163 . 0 0 "[ . 1 . 2]" 1
1459 1 76 LYS HD2 1 76 LYS QE 2.291 . 2.947 2.282 2.109 2.410 . 0 0 "[ . 1 . 2]" 1
1460 1 76 LYS HD2 1 77 ILE HA 3.535 . 6.000 6.190 6.019 6.835 0.835 19 2 "[ . 1 . - +2]" 1
1461 1 76 LYS HD3 1 76 LYS QE 2.397 . 3.099 2.373 2.136 2.527 . 0 0 "[ . 1 . 2]" 1
1462 1 76 LYS QE 1 76 LYS HG2 2.822 . 3.817 2.630 2.146 3.101 . 0 0 "[ . 1 . 2]" 1
1463 1 76 LYS QE 1 76 LYS HG3 2.519 . 3.165 2.276 1.967 3.091 . 0 0 "[ . 1 . 2]" 1
1464 1 77 ILE H 1 77 ILE HA 2.744 . 3.685 2.868 2.855 2.897 . 0 0 "[ . 1 . 2]" 1
1465 1 77 ILE H 1 77 ILE HB 2.367 . 3.067 2.591 2.509 2.659 . 0 0 "[ . 1 . 2]" 1
1466 1 77 ILE H 1 77 ILE MD 2.943 . 4.026 3.228 3.122 3.418 . 0 0 "[ . 1 . 2]" 1
1467 1 77 ILE H 1 77 ILE HG12 2.724 . 3.652 2.186 2.078 2.406 . 0 0 "[ . 1 . 2]" 1
1468 1 77 ILE H 1 77 ILE HG13 3.222 . 4.520 3.664 3.592 3.836 . 0 0 "[ . 1 . 2]" 1
1469 1 77 ILE H 1 77 ILE MG 2.880 . 3.917 3.786 3.765 3.837 . 0 0 "[ . 1 . 2]" 1
1470 1 77 ILE H 1 78 ILE H 3.462 . 4.961 4.491 4.420 4.534 . 0 0 "[ . 1 . 2]" 1
1471 1 77 ILE HA 1 77 ILE HB 2.696 . 3.605 3.006 2.995 3.012 . 0 0 "[ . 1 . 2]" 1
1472 1 77 ILE HA 1 78 ILE H 1.952 . 2.428 2.128 2.070 2.174 . 0 0 "[ . 1 . 2]" 1
1473 1 77 ILE HB 1 77 ILE MD 2.624 . 3.485 3.225 3.212 3.235 . 0 0 "[ . 1 . 2]" 1
1474 1 77 ILE HB 1 77 ILE HG12 2.360 . 3.056 2.462 2.446 2.490 . 0 0 "[ . 1 . 2]" 1
1475 1 77 ILE HB 1 77 ILE HG13 2.346 . 3.034 2.457 2.432 2.476 . 0 0 "[ . 1 . 2]" 1
1476 1 77 ILE HB 1 78 ILE H 2.769 . 3.727 3.903 3.839 3.982 0.255 15 0 "[ . 1 . 2]" 1
1477 1 77 ILE MD 1 77 ILE HG12 2.233 . 2.856 2.115 2.106 2.120 . 0 0 "[ . 1 . 2]" 1
1478 1 77 ILE MD 1 78 ILE HB 3.389 . 6.000 5.557 5.368 5.699 . 0 0 "[ . 1 . 2]" 1
1479 1 77 ILE HG12 1 77 ILE MG 2.364 . 3.063 3.182 3.173 3.189 0.126 1 0 "[ . 1 . 2]" 1
1480 1 77 ILE MG 1 78 ILE H 2.480 . 3.249 2.393 2.249 2.588 . 0 0 "[ . 1 . 2]" 1
1481 1 77 ILE MG 1 79 CYS H 3.182 . 4.448 4.220 3.918 4.472 0.024 12 0 "[ . 1 . 2]" 1
1482 1 77 ILE MG 1 79 CYS HA 3.178 . 4.440 4.140 3.892 4.491 0.051 4 0 "[ . 1 . 2]" 1
1483 1 78 ILE H 1 78 ILE HA 2.440 . 3.184 2.941 2.928 2.957 . 0 0 "[ . 1 . 2]" 1
1484 1 78 ILE H 1 78 ILE HB 2.309 . 2.976 2.493 2.376 2.664 . 0 0 "[ . 1 . 2]" 1
1485 1 78 ILE H 1 78 ILE MD 2.717 . 3.640 2.489 2.339 2.737 . 0 0 "[ . 1 . 2]" 1
1486 1 78 ILE HA 1 78 ILE HB 2.701 . 3.613 3.011 2.988 3.026 . 0 0 "[ . 1 . 2]" 1
1487 1 78 ILE HA 1 78 ILE MD 2.705 . 3.619 3.002 2.651 3.153 . 0 0 "[ . 1 . 2]" 1
1488 1 78 ILE HA 1 78 ILE HG12 2.602 . 3.448 3.538 3.525 3.568 0.120 20 0 "[ . 1 . 2]" 1
1489 1 78 ILE HA 1 78 ILE HG13 3.059 . 4.228 2.263 2.230 2.314 . 0 0 "[ . 1 . 2]" 1
1490 1 78 ILE HA 1 78 ILE MG 2.124 . 2.688 2.552 2.476 2.667 . 0 0 "[ . 1 . 2]" 1
1491 1 78 ILE HA 1 79 CYS H 2.021 . 2.532 2.161 2.116 2.289 . 0 0 "[ . 1 . 2]" 1
1492 1 78 ILE HB 1 78 ILE MD 2.293 . 2.950 2.300 2.265 2.378 . 0 0 "[ . 1 . 2]" 1
1493 1 78 ILE HB 1 78 ILE HG12 2.299 . 2.959 2.596 2.525 2.618 . 0 0 "[ . 1 . 2]" 1
1494 1 78 ILE HB 1 78 ILE HG13 2.484 . 3.255 3.001 2.991 3.019 . 0 0 "[ . 1 . 2]" 1
1495 1 78 ILE HB 1 78 ILE MG 1.963 . 2.445 2.125 2.120 2.130 . 0 0 "[ . 1 . 2]" 1
1496 1 78 ILE HB 1 79 CYS H 3.256 . 4.582 4.298 4.054 4.426 . 0 0 "[ . 1 . 2]" 1
1497 1 78 ILE MD 1 78 ILE HG12 1.974 . 2.461 2.115 2.113 2.118 . 0 0 "[ . 1 . 2]" 1
1498 1 78 ILE MD 1 78 ILE HG13 1.998 . 2.497 2.116 2.111 2.119 . 0 0 "[ . 1 . 2]" 1
1499 1 78 ILE MD 1 79 CYS H 3.356 . 4.764 4.789 4.518 4.875 0.111 4 0 "[ . 1 . 2]" 1
1500 1 78 ILE HG12 1 78 ILE MG 2.287 . 2.941 2.194 2.174 2.247 . 0 0 "[ . 1 . 2]" 1
1501 1 78 ILE HG13 1 78 ILE MG 2.119 . 2.680 2.584 2.487 2.621 . 0 0 "[ . 1 . 2]" 1
1502 1 78 ILE HG13 1 79 CYS H 3.406 . 4.856 4.085 3.786 4.254 . 0 0 "[ . 1 . 2]" 1
1503 1 78 ILE MG 1 79 CYS H 2.308 . 2.974 2.724 2.315 2.988 0.014 8 0 "[ . 1 . 2]" 1
1504 1 78 ILE MG 1 79 CYS HA 3.029 . 4.176 3.431 3.071 3.784 . 0 0 "[ . 1 . 2]" 1
1505 1 79 CYS H 1 79 CYS HA 2.636 . 3.504 2.930 2.907 2.949 . 0 0 "[ . 1 . 2]" 1
1506 1 79 CYS H 1 79 CYS HB2 2.769 . 3.728 3.514 2.744 3.746 0.018 12 0 "[ . 1 . 2]" 1
1507 1 79 CYS H 1 79 CYS HB3 2.615 . 3.470 3.214 2.991 3.576 0.106 4 0 "[ . 1 . 2]" 1
1508 1 79 CYS HA 1 79 CYS HB2 2.387 . 3.099 2.611 2.512 2.900 . 0 0 "[ . 1 . 2]" 1
1509 1 79 CYS HA 1 79 CYS HB3 2.629 . 3.493 2.392 2.262 2.892 . 0 0 "[ . 1 . 2]" 1
1510 1 79 CYS HA 1 80 THR H 2.035 . 2.552 2.217 2.115 2.301 . 0 0 "[ . 1 . 2]" 1
1511 1 79 CYS HA 1 80 THR HA 3.042 . 6.000 4.402 4.326 4.453 . 0 0 "[ . 1 . 2]" 1
1512 1 79 CYS HA 1 80 THR HB 3.468 . 4.971 4.339 4.131 4.465 . 0 0 "[ . 1 . 2]" 1
1513 1 79 CYS HB2 1 80 THR H 2.728 . 3.658 3.113 2.809 4.162 0.504 20 2 "[ -. 1 . +]" 1
1514 1 79 CYS HB2 1 92 GLY QA 2.492 . 6.000 2.165 1.907 3.164 . 0 0 "[ . 1 . 2]" 1
1515 1 79 CYS HB3 1 80 THR H 3.068 . 4.244 3.792 3.030 4.046 . 0 0 "[ . 1 . 2]" 1
1516 1 79 CYS HB3 1 92 GLY QA 2.418 . 3.149 3.079 1.943 3.747 0.598 17 2 "[ . - 1 . + 2]" 1
1517 1 80 THR H 1 80 THR HB 2.309 . 2.975 2.656 2.337 3.005 0.030 4 0 "[ . 1 . 2]" 1
1518 1 80 THR H 1 80 THR MG 2.734 . 3.668 3.688 2.474 3.814 0.146 14 0 "[ . 1 . 2]" 1
1519 1 80 THR HA 1 80 THR HB 2.815 . 3.805 2.984 2.623 3.012 . 0 0 "[ . 1 . 2]" 1
1520 1 80 THR HA 1 80 THR MG 2.413 . 3.141 2.535 2.417 3.154 0.013 4 0 "[ . 1 . 2]" 1
1521 1 80 THR HA 1 81 CYS H 2.062 . 2.593 2.211 2.173 2.268 . 0 0 "[ . 1 . 2]" 1
1522 1 80 THR HB 1 80 THR MG 2.001 . 2.501 2.125 2.118 2.131 . 0 0 "[ . 1 . 2]" 1
1523 1 80 THR MG 1 81 CYS H 2.417 . 3.147 3.251 3.168 3.315 0.168 10 0 "[ . 1 . 2]" 1
1524 1 80 THR MG 1 82 LYS QB 3.203 . 4.485 3.943 3.816 4.258 . 0 0 "[ . 1 . 2]" 1
1525 1 80 THR MG 1 82 LYS QD 2.856 . 3.875 2.981 2.395 3.506 . 0 0 "[ . 1 . 2]" 1
1526 1 81 CYS H 1 81 CYS QB 2.670 . 3.144 2.505 2.381 2.713 . 0 0 "[ . 1 . 2]" 1
1527 1 81 CYS HA 1 81 CYS QB 2.461 . 3.199 2.329 2.183 2.399 . 0 0 "[ . 1 . 2]" 1
1528 1 81 CYS QB 1 82 LYS H 2.695 . 3.603 2.821 2.597 3.034 . 0 0 "[ . 1 . 2]" 1
1529 1 81 CYS QB 1 85 THR HB 2.591 . 3.301 3.129 2.616 3.303 0.002 10 0 "[ . 1 . 2]" 1
1530 1 81 CYS QB 1 87 ASN H 3.359 . 4.770 4.243 3.749 4.606 . 0 0 "[ . 1 . 2]" 1
1531 1 81 CYS QB 1 88 ALA MB 3.019 . 4.159 1.861 1.417 2.470 0.462 9 0 "[ . 1 . 2]" 1
1532 1 81 CYS QB 1 95 CYS HB3 3.199 . 4.478 3.857 3.394 4.403 . 0 0 "[ . 1 . 2]" 1
1533 1 82 LYS H 1 82 LYS QB 2.842 . 3.628 2.506 2.413 2.651 . 0 0 "[ . 1 . 2]" 1
1534 1 82 LYS H 1 82 LYS QG 2.657 . 3.539 2.729 2.100 3.132 . 0 0 "[ . 1 . 2]" 1
1535 1 82 LYS H 1 85 THR HB 3.017 . 4.155 3.790 3.504 4.099 . 0 0 "[ . 1 . 2]" 1
1536 1 82 LYS HA 1 82 LYS QB 2.302 . 2.931 2.356 2.290 2.408 . 0 0 "[ . 1 . 2]" 1
1537 1 82 LYS HA 1 83 GLU HB2 3.266 . 6.000 4.788 4.533 5.241 . 0 0 "[ . 1 . 2]" 1
1538 1 82 LYS QB 1 82 LYS QD 2.436 . 3.178 2.321 2.267 2.572 . 0 0 "[ . 1 . 2]" 1
1539 1 82 LYS QB 1 83 GLU H 2.477 . 3.244 1.962 1.852 2.113 . 0 0 "[ . 1 . 2]" 1
1540 1 82 LYS QD 1 84 PRO HG2 2.739 . 6.000 4.266 3.052 5.251 . 0 0 "[ . 1 . 2]" 1
1541 1 82 LYS QG 1 83 GLU H 3.043 . 4.201 3.761 3.485 4.081 . 0 0 "[ . 1 . 2]" 1
1542 1 83 GLU H 1 83 GLU HA 2.552 . 3.366 2.785 2.730 2.872 . 0 0 "[ . 1 . 2]" 1
1543 1 83 GLU H 1 83 GLU HB2 2.345 . 3.033 2.441 2.235 2.612 . 0 0 "[ . 1 . 2]" 1
1544 1 83 GLU H 1 83 GLU HB3 2.503 . 3.286 2.719 2.448 3.531 0.245 6 0 "[ . 1 . 2]" 1
1545 1 83 GLU H 1 83 GLU HG2 2.513 . 6.000 4.255 1.956 4.648 . 0 0 "[ . 1 . 2]" 1
1546 1 83 GLU HA 1 83 GLU HB2 2.375 . 3.080 2.547 2.396 3.014 . 0 0 "[ . 1 . 2]" 1
1547 1 83 GLU HA 1 83 GLU HB3 2.521 . 3.316 2.954 2.413 3.023 . 0 0 "[ . 1 . 2]" 1
1548 1 83 GLU HA 1 84 PRO HA 2.106 . 6.000 4.868 4.800 4.937 . 0 0 "[ . 1 . 2]" 1
1549 1 83 GLU HA 1 85 THR H 2.312 . 6.000 3.471 3.339 3.567 . 0 0 "[ . 1 . 2]" 1
1550 1 83 GLU HB2 1 84 PRO HA 2.487 . 6.000 5.624 4.312 5.855 . 0 0 "[ . 1 . 2]" 1
1551 1 83 GLU HB3 1 84 PRO HA 2.516 . 6.000 4.426 4.216 4.688 . 0 0 "[ . 1 . 2]" 1
1552 1 83 GLU HB3 1 85 THR H 3.411 . 4.865 4.732 4.619 4.895 0.030 6 0 "[ . 1 . 2]" 1
1553 1 84 PRO HA 1 84 PRO HB2 2.405 . 3.128 2.747 2.680 2.958 . 0 0 "[ . 1 . 2]" 1
1554 1 84 PRO HA 1 84 PRO HB3 2.322 . 2.996 2.291 2.269 2.316 . 0 0 "[ . 1 . 2]" 1
1555 1 84 PRO HA 1 84 PRO HD2 2.858 . 6.000 4.069 3.898 4.100 . 0 0 "[ . 1 . 2]" 1
1556 1 84 PRO HA 1 84 PRO HD3 3.004 . 4.132 3.547 3.376 3.808 . 0 0 "[ . 1 . 2]" 1
1557 1 84 PRO HA 1 84 PRO HG2 3.053 . 4.218 3.849 3.796 3.948 . 0 0 "[ . 1 . 2]" 1
1558 1 84 PRO HA 1 85 THR H 2.734 . 3.668 3.275 3.135 3.396 . 0 0 "[ . 1 . 2]" 1
1559 1 84 PRO HB2 1 84 PRO HD2 2.897 . 3.946 3.914 2.779 4.067 0.121 12 0 "[ . 1 . 2]" 1
1560 1 84 PRO HB2 1 84 PRO HD3 2.753 . 6.000 3.869 3.777 3.912 . 0 0 "[ . 1 . 2]" 1
1561 1 84 PRO HB2 1 84 PRO HG2 2.259 . 2.897 2.311 2.287 2.330 . 0 0 "[ . 1 . 2]" 1
1562 1 84 PRO HB2 1 84 PRO HG3 2.344 . 3.031 2.682 2.625 2.977 . 0 0 "[ . 1 . 2]" 1
1563 1 84 PRO HB2 1 85 THR H 3.469 . 4.973 3.969 3.343 4.224 . 0 0 "[ . 1 . 2]" 1
1564 1 84 PRO HB2 1 85 THR MG 3.003 . 4.130 3.199 2.527 3.487 . 0 0 "[ . 1 . 2]" 1
1565 1 84 PRO HB3 1 84 PRO HD2 2.762 . 6.000 3.849 3.805 3.894 . 0 0 "[ . 1 . 2]" 1
1566 1 84 PRO HB3 1 84 PRO HD3 2.634 . 3.501 3.039 2.810 4.059 0.558 6 2 "[ -+ 1 . 2]" 1
1567 1 84 PRO HB3 1 84 PRO HG2 2.330 . 3.009 2.954 2.632 2.998 . 0 0 "[ . 1 . 2]" 1
1568 1 84 PRO HB3 1 84 PRO HG3 2.412 . 3.139 2.324 2.302 2.345 . 0 0 "[ . 1 . 2]" 1
1569 1 84 PRO HB3 1 85 THR MG 3.209 . 4.496 4.506 4.027 4.621 0.125 8 0 "[ . 1 . 2]" 1
1570 1 84 PRO HD2 1 84 PRO HG2 2.321 . 2.994 2.304 2.288 2.333 . 0 0 "[ . 1 . 2]" 1
1571 1 84 PRO HD2 1 84 PRO HG3 2.484 . 3.255 2.708 2.643 2.997 . 0 0 "[ . 1 . 2]" 1
1572 1 84 PRO HD2 1 85 THR H 2.950 . 4.038 3.308 2.955 3.502 . 0 0 "[ . 1 . 2]" 1
1573 1 84 PRO HD2 1 85 THR MG 2.997 . 4.119 3.799 3.142 4.190 0.071 8 0 "[ . 1 . 2]" 1
1574 1 84 PRO HD3 1 84 PRO HG3 2.520 . 3.314 2.313 2.299 2.338 . 0 0 "[ . 1 . 2]" 1
1575 1 84 PRO HD3 1 85 THR H 3.083 . 4.271 4.209 3.928 4.325 0.054 20 0 "[ . 1 . 2]" 1
1576 1 84 PRO HG2 1 85 THR H 3.442 . 4.923 3.654 3.363 4.797 . 0 0 "[ . 1 . 2]" 1
1577 1 84 PRO HG2 1 85 THR MG 2.883 . 3.922 2.710 2.352 4.045 0.123 5 0 "[ . 1 . 2]" 1
1578 1 84 PRO HG3 1 85 THR H 3.346 . 4.746 4.812 4.663 4.986 0.240 20 0 "[ . 1 . 2]" 1
1579 1 85 THR H 1 85 THR HA 2.741 . 3.680 2.941 2.931 2.947 . 0 0 "[ . 1 . 2]" 1
1580 1 85 THR H 1 85 THR HB 2.916 . 3.979 3.821 3.765 3.886 . 0 0 "[ . 1 . 2]" 1
1581 1 85 THR HA 1 85 THR HB 2.343 . 3.029 2.481 2.423 2.562 . 0 0 "[ . 1 . 2]" 1
1582 1 85 THR HB 1 85 THR MG 2.027 . 2.541 2.129 2.124 2.134 . 0 0 "[ . 1 . 2]" 1
1583 1 85 THR HB 1 95 CYS HB3 2.725 . 3.653 3.326 2.338 3.798 0.145 4 0 "[ . 1 . 2]" 1
1584 1 85 THR HB 1 96 SER H 3.302 . 6.000 5.393 4.889 6.042 0.042 10 0 "[ . 1 . 2]" 1
1585 1 85 THR MG 1 95 CYS HB2 3.047 . 4.207 4.187 3.660 4.506 0.299 5 0 "[ . 1 . 2]" 1
1586 1 85 THR MG 1 95 CYS HB3 3.320 . 4.698 4.092 3.325 4.330 . 0 0 "[ . 1 . 2]" 1
1587 1 86 PRO HA 1 86 PRO QD 2.849 . 3.863 3.178 3.090 3.287 . 0 0 "[ . 1 . 2]" 1
1588 1 86 PRO HA 1 86 PRO QG 2.366 . 3.065 2.591 2.538 2.659 . 0 0 "[ . 1 . 2]" 1
1589 1 86 PRO HB2 1 86 PRO QD 2.771 . 3.731 2.782 2.610 2.880 . 0 0 "[ . 1 . 2]" 1
1590 1 86 PRO HB3 1 86 PRO QD 2.665 . 6.000 3.531 3.489 3.548 . 0 0 "[ . 1 . 2]" 1
1591 1 86 PRO QD 1 86 PRO QG 2.045 . 2.568 1.969 1.953 1.986 . 0 0 "[ . 1 . 2]" 1
1592 1 86 PRO QD 1 87 ASN QB 3.206 . 4.491 5.092 4.489 5.333 0.842 8 14 "[* ****-+*1****. * *]" 1
1593 1 87 ASN H 1 87 ASN QB 2.464 . 3.223 2.767 2.553 2.908 . 0 0 "[ . 1 . 2]" 1
1594 1 87 ASN H 1 87 ASN HD21 3.223 . 6.000 5.221 4.714 5.399 . 0 0 "[ . 1 . 2]" 1
1595 1 87 ASN H 1 88 ALA H 3.501 . 5.033 4.399 4.357 4.455 . 0 0 "[ . 1 . 2]" 1
1596 1 87 ASN H 1 95 CYS HA 3.248 . 4.567 3.997 3.770 4.220 . 0 0 "[ . 1 . 2]" 1
1597 1 87 ASN H 1 96 SER H 2.839 . 3.847 3.183 2.301 3.992 0.145 18 0 "[ . 1 . 2]" 1
1598 1 87 ASN HA 1 87 ASN QB 2.576 . 3.191 2.333 2.188 2.460 . 0 0 "[ . 1 . 2]" 1
1599 1 87 ASN HA 1 88 ALA H 2.016 . 2.524 2.322 2.238 2.478 . 0 0 "[ . 1 . 2]" 1
1600 1 87 ASN HA 1 89 TYR QD 3.186 . 6.000 6.098 6.026 6.238 0.238 12 0 "[ . 1 . 2]" 1
1601 1 87 ASN QB 1 87 ASN HD21 2.523 . 3.319 2.125 2.078 2.163 . 0 0 "[ . 1 . 2]" 1
1602 1 87 ASN QB 1 87 ASN HD22 2.829 . 3.829 3.230 3.192 3.275 . 0 0 "[ . 1 . 2]" 1
1603 1 87 ASN QB 1 88 ALA H 3.023 . 3.748 3.244 2.937 3.389 . 0 0 "[ . 1 . 2]" 1
1604 1 87 ASN QB 1 89 TYR H 2.657 . 6.000 4.464 3.915 4.870 . 0 0 "[ . 1 . 2]" 1
1605 1 87 ASN QB 1 89 TYR QE 2.606 . 6.000 4.647 4.043 5.033 . 0 0 "[ . 1 . 2]" 1
1606 1 87 ASN QB 1 95 CYS HA 3.409 . 4.862 3.202 2.778 3.457 . 0 0 "[ . 1 . 2]" 1
1607 1 87 ASN QB 1 96 SER H 3.035 . 4.186 1.715 1.505 1.809 0.391 20 0 "[ . 1 . 2]" 1
1608 1 87 ASN QB 1 96 SER QB 2.896 . 3.810 2.566 1.921 3.344 0.017 8 0 "[ . 1 . 2]" 1
1609 1 87 ASN HD21 1 96 SER H 3.190 . 4.462 3.446 2.388 4.642 0.180 19 0 "[ . 1 . 2]" 1
1610 1 87 ASN HD21 1 96 SER QB 2.865 . 3.780 2.351 1.701 3.479 0.138 12 0 "[ . 1 . 2]" 1
1611 1 87 ASN HD22 1 94 PHE QB 3.259 . 6.000 5.882 5.810 5.931 . 0 0 "[ . 1 . 2]" 1
1612 1 88 ALA H 1 88 ALA HA 2.791 . 3.765 2.949 2.927 2.966 . 0 0 "[ . 1 . 2]" 1
1613 1 88 ALA H 1 88 ALA MB 2.190 . 2.790 2.535 2.434 2.641 . 0 0 "[ . 1 . 2]" 1
1614 1 88 ALA H 1 89 TYR H 3.410 . 4.864 4.015 3.921 4.140 . 0 0 "[ . 1 . 2]" 1
1615 1 88 ALA HA 1 88 ALA MB 2.051 . 2.577 2.130 2.124 2.134 . 0 0 "[ . 1 . 2]" 1
1616 1 88 ALA HA 1 89 TYR H 2.073 . 2.610 2.156 2.114 2.179 . 0 0 "[ . 1 . 2]" 1
1617 1 88 ALA HA 1 92 GLY H 3.486 . 5.005 4.674 4.490 5.021 0.016 3 0 "[ . 1 . 2]" 1
1618 1 88 ALA HA 1 92 GLY QA 3.164 . 4.416 3.162 2.823 4.314 . 0 0 "[ . 1 . 2]" 1
1619 1 88 ALA HA 1 94 PHE H 3.381 . 4.810 4.151 4.011 4.346 . 0 0 "[ . 1 . 2]" 1
1620 1 88 ALA HA 1 95 CYS HA 2.487 . 3.260 2.412 2.091 2.606 . 0 0 "[ . 1 . 2]" 1
1621 1 88 ALA HA 1 96 SER H 3.274 . 4.614 4.192 3.626 4.650 0.036 3 0 "[ . 1 . 2]" 1
1622 1 88 ALA MB 1 91 GLU HA 2.695 . 6.000 3.766 3.569 4.113 . 0 0 "[ . 1 . 2]" 1
1623 1 88 ALA MB 1 95 CYS HA 2.996 . 4.118 4.029 3.774 4.177 0.059 10 0 "[ . 1 . 2]" 1
1624 1 89 TYR H 1 89 TYR HB2 2.997 . 4.120 2.135 2.065 2.220 . 0 0 "[ . 1 . 2]" 1
1625 1 89 TYR H 1 89 TYR HB3 2.605 . 3.453 3.163 2.772 3.419 . 0 0 "[ . 1 . 2]" 1
1626 1 89 TYR H 1 89 TYR QE 3.299 . 6.000 5.687 5.335 5.868 . 0 0 "[ . 1 . 2]" 1
1627 1 89 TYR H 1 90 TYR QB 3.264 . 6.000 5.047 4.982 5.123 . 0 0 "[ . 1 . 2]" 1
1628 1 89 TYR H 1 94 PHE H 2.948 . 4.034 2.866 2.738 3.024 . 0 0 "[ . 1 . 2]" 1
1629 1 89 TYR H 1 94 PHE QB 3.406 . 4.705 3.153 2.904 3.315 . 0 0 "[ . 1 . 2]" 1
1630 1 89 TYR H 1 94 PHE QD 3.368 . 4.786 3.779 3.643 3.936 . 0 0 "[ . 1 . 2]" 1
1631 1 89 TYR H 1 94 PHE HE1 2.668 . 6.000 6.142 6.001 6.286 0.286 14 0 "[ . 1 . 2]" 1
1632 1 89 TYR H 1 95 CYS HA 2.905 . 3.960 2.623 2.271 3.186 . 0 0 "[ . 1 . 2]" 1
1633 1 89 TYR HA 1 89 TYR QD 3.331 . 4.718 2.959 2.772 3.023 . 0 0 "[ . 1 . 2]" 1
1634 1 89 TYR HA 1 94 PHE H 3.767 . 5.541 4.620 4.527 4.858 . 0 0 "[ . 1 . 2]" 1
1635 1 89 TYR HA 1 94 PHE QE 2.836 . 6.000 5.838 5.716 5.947 . 0 0 "[ . 1 . 2]" 1
1636 1 89 TYR HB2 1 94 PHE QB 2.605 . 3.453 1.940 1.555 2.149 0.202 20 0 "[ . 1 . 2]" 1
1637 1 89 TYR HB3 1 90 TYR QD 2.901 . 3.953 2.427 1.845 3.317 0.004 12 0 "[ . 1 . 2]" 1
1638 1 89 TYR HB3 1 94 PHE H 3.075 . 4.257 3.294 2.806 3.748 . 0 0 "[ . 1 . 2]" 1
1639 1 89 TYR HB3 1 94 PHE QD 2.490 . 3.265 1.686 1.582 1.818 0.133 13 0 "[ . 1 . 2]" 1
1640 1 89 TYR QE 1 94 PHE QD 1.656 . 6.000 5.337 4.693 5.625 . 0 0 "[ . 1 . 2]" 1
1641 1 89 TYR QE 1 96 SER H 3.130 . 6.000 5.092 3.859 5.941 . 0 0 "[ . 1 . 2]" 1
1642 1 89 TYR QE 1 96 SER QB 2.523 . 6.000 2.209 1.432 2.624 . 0 0 "[ . 1 . 2]" 1
1643 1 90 TYR H 1 90 TYR HA 2.137 . 2.708 2.276 2.253 2.287 . 0 0 "[ . 1 . 2]" 1
1644 1 90 TYR H 1 90 TYR QB 3.236 . 4.442 3.242 3.206 3.290 . 0 0 "[ . 1 . 2]" 1
1645 1 90 TYR H 1 90 TYR QD 3.155 . 4.399 3.192 2.982 3.379 . 0 0 "[ . 1 . 2]" 1
1646 1 90 TYR H 1 91 GLU H 2.860 . 3.883 2.758 2.641 2.833 . 0 0 "[ . 1 . 2]" 1
1647 1 90 TYR H 1 94 PHE HE1 3.204 . 6.000 5.280 5.068 5.602 . 0 0 "[ . 1 . 2]" 1
1648 1 90 TYR HA 1 90 TYR QB 2.345 . 3.032 2.439 2.407 2.471 . 0 0 "[ . 1 . 2]" 1
1649 1 90 TYR HA 1 90 TYR QD 2.191 . 6.000 2.887 2.777 2.989 . 0 0 "[ . 1 . 2]" 1
1650 1 90 TYR HA 1 90 TYR QE 2.818 . 6.000 4.517 4.413 4.580 . 0 0 "[ . 1 . 2]" 1
1651 1 90 TYR HA 1 91 GLU H 2.399 . 3.119 2.578 2.512 2.677 . 0 0 "[ . 1 . 2]" 1
1652 1 90 TYR HA 1 91 GLU HG2 3.093 . 4.289 2.841 2.548 2.948 . 0 0 "[ . 1 . 2]" 1
1653 1 90 TYR HA 1 91 GLU HG3 3.071 . 4.250 4.380 4.143 4.456 0.206 3 0 "[ . 1 . 2]" 1
1654 1 90 TYR HA 1 92 GLY H 3.341 . 4.736 4.143 4.028 4.390 . 0 0 "[ . 1 . 2]" 1
1655 1 90 TYR QB 1 90 TYR QD 2.639 . 3.510 2.142 2.136 2.144 . 0 0 "[ . 1 . 2]" 1
1656 1 90 TYR QB 1 91 GLU H 3.333 . 4.722 3.907 3.884 3.920 . 0 0 "[ . 1 . 2]" 1
1657 1 90 TYR QB 1 92 GLY H 2.498 . 4.751 3.528 3.448 3.777 . 0 0 "[ . 1 . 2]" 1
1658 1 90 TYR QB 1 93 VAL H 2.795 . 3.772 2.947 2.896 3.006 . 0 0 "[ . 1 . 2]" 1
1659 1 90 TYR QB 1 93 VAL HA 3.298 . 4.657 4.483 4.452 4.518 . 0 0 "[ . 1 . 2]" 1
1660 1 90 TYR QB 1 93 VAL HB 2.597 . 3.228 2.065 1.932 2.161 . 0 0 "[ . 1 . 2]" 1
1661 1 90 TYR QB 1 93 VAL QG 3.001 . 3.037 2.037 1.938 2.114 . 0 0 "[ . 1 . 2]" 1
1662 1 90 TYR QB 1 94 PHE H 3.384 . 3.793 3.711 3.588 3.808 0.015 15 0 "[ . 1 . 2]" 1
1663 1 90 TYR QB 1 94 PHE QD 2.760 . 3.712 2.839 2.651 3.145 . 0 0 "[ . 1 . 2]" 1
1664 1 90 TYR QB 1 94 PHE QE 3.391 . 4.674 2.593 2.419 2.949 . 0 0 "[ . 1 . 2]" 1
1665 1 90 TYR QD 1 94 PHE H 3.362 . 6.000 4.763 4.421 5.008 . 0 0 "[ . 1 . 2]" 1
1666 1 90 TYR QD 1 94 PHE QD 2.473 . 3.237 2.718 2.427 3.202 . 0 0 "[ . 1 . 2]" 1
1667 1 90 TYR QE 1 93 VAL HB 3.234 . 6.000 5.659 5.526 5.738 . 0 0 "[ . 1 . 2]" 1
1668 1 91 GLU H 1 91 GLU HA 2.096 . 2.645 2.247 2.238 2.257 . 0 0 "[ . 1 . 2]" 1
1669 1 91 GLU H 1 91 GLU HB2 3.053 . 4.218 3.721 3.679 3.776 . 0 0 "[ . 1 . 2]" 1
1670 1 91 GLU H 1 91 GLU HB3 2.578 . 6.000 4.008 3.954 4.041 . 0 0 "[ . 1 . 2]" 1
1671 1 91 GLU H 1 91 GLU HG2 2.572 . 3.399 2.686 2.630 2.745 . 0 0 "[ . 1 . 2]" 1
1672 1 91 GLU H 1 92 GLY H 2.538 . 3.343 2.904 2.747 3.220 . 0 0 "[ . 1 . 2]" 1
1673 1 91 GLU HA 1 91 GLU HB2 2.411 . 3.138 3.002 2.990 3.008 . 0 0 "[ . 1 . 2]" 1
1674 1 91 GLU HA 1 91 GLU HB3 2.077 . 2.616 2.364 2.322 2.382 . 0 0 "[ . 1 . 2]" 1
1675 1 91 GLU HA 1 91 GLU HG2 2.361 . 3.058 2.998 2.928 3.117 0.059 20 0 "[ . 1 . 2]" 1
1676 1 91 GLU HA 1 91 GLU HG3 2.361 . 6.000 3.869 3.841 3.915 . 0 0 "[ . 1 . 2]" 1
1677 1 91 GLU HA 1 92 GLY H 2.465 . 3.225 3.360 3.255 3.462 0.237 3 0 "[ . 1 . 2]" 1
1678 1 91 GLU HA 1 93 VAL H 3.613 . 5.245 4.974 4.812 5.158 . 0 0 "[ . 1 . 2]" 1
1679 1 91 GLU HB2 1 91 GLU HG2 2.108 . 2.664 2.581 2.545 2.621 . 0 0 "[ . 1 . 2]" 1
1680 1 91 GLU HB2 1 91 GLU HG3 2.085 . 2.629 2.295 2.263 2.330 . 0 0 "[ . 1 . 2]" 1
1681 1 91 GLU HB2 1 93 VAL QG 3.322 . 4.701 3.483 3.377 3.630 . 0 0 "[ . 1 . 2]" 1
1682 1 91 GLU HG3 1 93 VAL QG 3.203 . 4.485 4.523 4.436 4.676 0.191 20 0 "[ . 1 . 2]" 1
1683 1 92 GLY H 1 92 GLY QA 2.337 . 3.020 2.435 2.374 2.500 . 0 0 "[ . 1 . 2]" 1
1684 1 92 GLY H 1 93 VAL HB 3.184 . 4.451 4.107 3.959 4.245 . 0 0 "[ . 1 . 2]" 1
1685 1 92 GLY H 1 94 PHE H 2.992 . 4.111 3.323 3.111 3.714 . 0 0 "[ . 1 . 2]" 1
1686 1 92 GLY QA 1 93 VAL H 3.102 . 4.305 2.895 2.779 2.935 . 0 0 "[ . 1 . 2]" 1
1687 1 92 GLY QA 1 94 PHE H 2.381 . 6.000 3.256 2.970 3.793 . 0 0 "[ . 1 . 2]" 1
1688 1 93 VAL H 1 93 VAL HA 2.538 . 3.343 2.849 2.814 2.890 . 0 0 "[ . 1 . 2]" 1
1689 1 93 VAL H 1 93 VAL HB 2.213 . 2.825 2.624 2.590 2.679 . 0 0 "[ . 1 . 2]" 1
1690 1 93 VAL H 1 93 VAL QG . . 2.455 2.007 1.866 2.133 . 0 0 "[ . 1 . 2]" 1
1691 1 93 VAL H 1 94 PHE H 2.203 . 2.810 2.401 2.246 2.545 . 0 0 "[ . 1 . 2]" 1
1692 1 93 VAL HA 1 93 VAL HB 2.687 . 3.590 3.022 3.008 3.030 . 0 0 "[ . 1 . 2]" 1
1693 1 93 VAL HA 1 93 VAL QG 2.170 . 2.758 2.142 2.124 2.153 . 0 0 "[ . 1 . 2]" 1
1694 1 93 VAL HA 1 94 PHE H 2.841 . 3.850 3.441 3.409 3.478 . 0 0 "[ . 1 . 2]" 1
1695 1 93 VAL HA 1 94 PHE QE 2.933 . 6.000 5.082 5.004 5.167 . 0 0 "[ . 1 . 2]" 1
1696 1 93 VAL HB 1 94 PHE H 2.573 . 3.401 2.928 2.879 2.996 . 0 0 "[ . 1 . 2]" 1
1697 1 93 VAL HB 1 94 PHE HD1 3.295 . 4.653 2.551 2.391 2.739 . 0 0 "[ . 1 . 2]" 1
1698 1 93 VAL HB 1 94 PHE QD 2.243 . 2.872 2.546 2.388 2.730 . 0 0 "[ . 1 . 2]" 1
1699 1 93 VAL HB 1 94 PHE QE 3.240 . 4.552 2.432 2.301 2.600 . 0 0 "[ . 1 . 2]" 1
1700 1 93 VAL MG1 1 93 VAL MG2 1.917 . 2.376 2.075 2.062 2.089 . 0 0 "[ . 1 . 2]" 1
1701 1 93 VAL QG 1 94 PHE H 2.779 . 3.744 3.388 3.359 3.424 . 0 0 "[ . 1 . 2]" 1
1702 1 93 VAL QG 1 94 PHE HD1 2.603 . 3.450 3.332 3.251 3.403 . 0 0 "[ . 1 . 2]" 1
1703 1 93 VAL QG 1 94 PHE HE1 2.696 . 3.605 2.680 2.599 2.749 . 0 0 "[ . 1 . 2]" 1
1704 1 93 VAL QG 1 94 PHE HZ 3.413 . 4.869 2.829 2.683 2.944 . 0 0 "[ . 1 . 2]" 1
1705 1 94 PHE H 1 94 PHE HA 2.538 . 3.343 2.921 2.908 2.940 . 0 0 "[ . 1 . 2]" 1
1706 1 94 PHE H 1 94 PHE QB 2.709 . 6.000 3.047 2.970 3.102 . 0 0 "[ . 1 . 2]" 1
1707 1 94 PHE H 1 94 PHE HD1 2.464 . 3.223 2.536 2.413 2.674 . 0 0 "[ . 1 . 2]" 1
1708 1 94 PHE H 1 94 PHE HZ 2.709 . 6.000 6.073 6.037 6.136 0.136 20 0 "[ . 1 . 2]" 1
1709 1 94 PHE H 1 95 CYS HA 3.364 . 4.779 4.614 4.549 4.696 . 0 0 "[ . 1 . 2]" 1
1710 1 94 PHE HA 1 94 PHE HD1 3.293 . 4.649 4.049 3.968 4.141 . 0 0 "[ . 1 . 2]" 1
1711 1 94 PHE HA 1 95 CYS H 2.342 . 3.027 2.511 2.178 2.686 . 0 0 "[ . 1 . 2]" 1
1712 1 94 PHE QB 1 94 PHE HD1 2.815 . 3.508 2.468 2.408 2.549 . 0 0 "[ . 1 . 2]" 1
1713 1 94 PHE QB 1 94 PHE QD 2.136 . 2.706 2.102 2.093 2.115 . 0 0 "[ . 1 . 2]" 1
1714 1 94 PHE QB 1 95 CYS H 2.752 . 3.699 2.102 1.822 2.804 . 0 0 "[ . 1 . 2]" 1
1715 1 94 PHE QB 1 95 CYS HA 3.767 . 5.541 3.703 3.592 3.906 . 0 0 "[ . 1 . 2]" 1
1716 1 95 CYS H 1 95 CYS HA 2.742 . 3.682 2.911 2.895 2.939 . 0 0 "[ . 1 . 2]" 1
1717 1 95 CYS H 1 95 CYS HB2 2.864 . 3.889 3.323 2.358 3.752 . 0 0 "[ . 1 . 2]" 1
1718 1 95 CYS H 1 95 CYS HB3 2.741 . 3.680 3.431 2.930 3.796 0.116 13 0 "[ . 1 . 2]" 1
1719 1 95 CYS HA 1 95 CYS HB2 2.509 . 3.296 2.694 2.487 3.014 . 0 0 "[ . 1 . 2]" 1
1720 1 95 CYS HA 1 95 CYS HB3 2.621 . 3.480 2.424 2.359 2.564 . 0 0 "[ . 1 . 2]" 1
1721 1 95 CYS HA 1 96 SER H 2.136 . 2.706 2.338 2.075 2.681 . 0 0 "[ . 1 . 2]" 1
1722 1 95 CYS HB2 1 96 SER H 2.965 . 4.064 3.280 2.318 4.258 0.194 13 0 "[ . 1 . 2]" 1
1723 1 95 CYS HB3 1 96 SER H 3.148 . 4.387 3.705 2.490 4.190 . 0 0 "[ . 1 . 2]" 1
1724 1 96 SER H 1 96 SER HA 2.904 . 3.958 2.878 2.797 2.944 . 0 0 "[ . 1 . 2]" 1
1725 1 96 SER H 1 96 SER QB 2.765 . 3.675 2.662 2.220 2.971 . 0 0 "[ . 1 . 2]" 1
1726 1 96 SER HA 1 96 SER QB 2.469 . 3.231 2.456 2.297 2.536 . 0 0 "[ . 1 . 2]" 1
1727 1 96 SER HA 1 97 SER H 2.616 . 3.471 2.553 2.095 2.659 . 0 0 "[ . 1 . 2]" 1
1728 1 96 SER QB 1 97 SER H 2.780 . 3.746 2.447 1.897 3.484 . 0 0 "[ . 1 . 2]" 1
1729 1 96 SER QB 1 98 SER H 3.364 . 4.779 3.547 2.648 4.566 . 0 0 "[ . 1 . 2]" 1
1730 1 97 SER H 1 97 SER HB2 3.020 . 4.160 2.957 2.423 3.623 . 0 0 "[ . 1 . 2]" 1
1731 1 97 SER H 1 97 SER HB3 3.164 . 4.415 2.639 2.460 2.809 . 0 0 "[ . 1 . 2]" 1
1732 1 97 SER HA 1 97 SER HB2 2.408 . 3.133 2.521 2.374 2.616 . 0 0 "[ . 1 . 2]" 1
1733 1 97 SER HB2 1 98 SER H 3.404 . 4.852 4.336 3.655 4.652 . 0 0 "[ . 1 . 2]" 1
1734 1 97 SER HB3 1 98 SER H 3.213 . 4.504 4.311 2.527 4.635 0.131 13 0 "[ . 1 . 2]" 1
1735 1 98 SER H 1 98 SER HB2 2.413 . 3.141 3.361 2.410 4.071 0.930 16 8 "[** * * * .+- *]" 1
1736 1 98 SER H 1 98 SER QB 2.972 . 4.076 2.849 2.249 3.122 . 0 0 "[ . 1 . 2]" 1
1737 1 98 SER QB 1 99 SER H 2.626 . 3.488 2.566 1.823 3.564 0.076 9 0 "[ . 1 . 2]" 1
1738 1 99 SER H 1 99 SER HA 2.394 . 3.110 2.860 2.262 2.940 . 0 0 "[ . 1 . 2]" 1
1739 1 99 SER H 1 99 SER HB2 2.593 . 3.434 3.186 2.423 3.938 0.504 18 1 "[ . 1 . + 2]" 1
1740 1 99 SER H 1 99 SER QB 2.657 . 3.539 2.875 2.388 3.260 . 0 0 "[ . 1 . 2]" 1
1741 1 99 SER HA 1 99 SER QB 3.394 . 4.834 2.326 2.188 2.473 . 0 0 "[ . 1 . 2]" 1
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