NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
529587 |
2lfn   |
17765 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lfn
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 927
_Distance_constraint_stats_list.Viol_count 532
_Distance_constraint_stats_list.Viol_total 1025.391
_Distance_constraint_stats_list.Viol_max 0.958
_Distance_constraint_stats_list.Viol_rms 0.0307
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0028
_Distance_constraint_stats_list.Viol_average_violations_only 0.0964
_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 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 ALA 0.157 0.062 1 0 "[ . 1 . 2]"
1 3 THR 0.079 0.052 17 0 "[ . 1 . 2]"
1 4 THR 0.006 0.006 15 0 "[ . 1 . 2]"
1 5 ILE 1.377 0.113 18 0 "[ . 1 . 2]"
1 6 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 PRO 4.399 0.958 9 5 "[ . +- *.* * 2]"
1 8 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 THR 0.528 0.081 15 0 "[ . 1 . 2]"
1 10 CYS 0.618 0.181 9 0 "[ . 1 . 2]"
1 11 SER 5.219 0.358 5 0 "[ . 1 . 2]"
1 12 ILE 1.703 0.208 20 0 "[ . 1 . 2]"
1 13 ASP 5.237 0.358 5 0 "[ . 1 . 2]"
1 14 ASP 1.743 0.175 8 0 "[ . 1 . 2]"
1 15 TYR 4.483 0.549 2 1 "[ + . 1 . 2]"
1 16 LYS 1.100 0.343 7 0 "[ . 1 . 2]"
1 17 PRO 2.070 0.343 7 0 "[ . 1 . 2]"
1 18 TYR 3.716 0.358 15 0 "[ . 1 . 2]"
1 19 CYS 0.012 0.012 9 0 "[ . 1 . 2]"
1 20 CYS 4.481 0.565 10 1 "[ . + . 2]"
1 21 GLN 1.400 0.285 2 0 "[ . 1 . 2]"
1 22 SER 0.243 0.056 11 0 "[ . 1 . 2]"
1 23 MET 0.553 0.172 9 0 "[ . 1 . 2]"
1 24 SER 0.082 0.056 11 0 "[ . 1 . 2]"
1 25 GLY 0.029 0.029 15 0 "[ . 1 . 2]"
1 26 SER 0.216 0.172 9 0 "[ . 1 . 2]"
1 27 ALA 0.490 0.303 20 0 "[ . 1 . 2]"
1 28 SER 1.301 0.632 9 1 "[ . +1 . 2]"
1 29 LEU 5.213 0.795 2 3 "[ + .* 1 . -]"
1 30 GLY 2.615 0.795 2 3 "[ + .* 1 . -]"
1 31 CYS 3.403 0.240 13 0 "[ . 1 . 2]"
1 32 VAL 0.033 0.012 9 0 "[ . 1 . 2]"
1 33 VAL 0.092 0.023 1 0 "[ . 1 . 2]"
1 34 GLY 0.449 0.069 5 0 "[ . 1 . 2]"
1 35 VAL 0.430 0.100 11 0 "[ . 1 . 2]"
1 36 ILE 5.010 0.958 9 5 "[ . +- *.* * 2]"
1 37 GLY 0.138 0.113 18 0 "[ . 1 . 2]"
1 38 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 GLN 2.190 0.901 9 2 "[ . +1 - . 2]"
1 40 CYS 0.028 0.018 13 0 "[ . 1 . 2]"
1 41 GLY 0.127 0.060 15 0 "[ . 1 . 2]"
1 42 ALA 1.665 0.285 2 0 "[ . 1 . 2]"
1 43 SER 0.343 0.078 17 0 "[ . 1 . 2]"
1 44 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 LYS 2.520 0.565 10 1 "[ . + . 2]"
1 46 CYS 8.992 0.880 20 5 "[ * . *1 *- +]"
1 47 CYS 1.215 0.358 15 0 "[ . 1 . 2]"
1 48 LYS 3.123 0.617 11 1 "[ . 1+ . 2]"
1 49 ASP 0.818 0.431 20 0 "[ . 1 . 2]"
1 50 ASP 0.489 0.437 1 0 "[ . 1 . 2]"
1 51 VAL 0.489 0.437 1 0 "[ . 1 . 2]"
1 52 THR 0.186 0.099 7 0 "[ . 1 . 2]"
1 53 ASN 0.186 0.099 7 0 "[ . 1 . 2]"
1 54 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 GLY 1.151 0.518 20 1 "[ . 1 . +]"
1 56 ASN 1.297 0.518 20 1 "[ . 1 . +]"
1 57 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 LEU 0.766 0.289 15 0 "[ . 1 . 2]"
1 60 ILE 1.102 0.632 9 1 "[ . +1 . 2]"
1 61 ILE 0.686 0.341 10 0 "[ . 1 . 2]"
1 62 ASN 0.182 0.126 15 0 "[ . 1 . 2]"
1 63 ALA 0.979 0.162 19 0 "[ . 1 . 2]"
1 64 ALA 0.162 0.162 19 0 "[ . 1 . 2]"
1 65 ASN 2.116 0.617 11 1 "[ . 1+ . 2]"
1 66 CYS 6.438 0.797 16 5 "[ * . *1 *+ -]"
1 67 VAL 10.248 0.880 20 5 "[ * . *1 *- +]"
1 68 ALA 0.296 0.075 19 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 SER HA 1 2 ALA H 3.400 . 5.200 2.746 2.140 3.574 . 0 0 "[ . 1 . 2]" 1
2 1 2 ALA H 1 2 ALA MB 2.700 . 3.900 2.373 2.096 2.780 . 0 0 "[ . 1 . 2]" 1
3 1 2 ALA H 1 3 THR H 6.000 . 6.000 3.960 2.253 4.576 . 0 0 "[ . 1 . 2]" 1
4 1 2 ALA H 1 3 THR H 3.300 . 5.000 3.137 2.236 3.557 . 0 0 "[ . 1 . 2]" 1
5 1 2 ALA HA 1 3 THR H 6.000 . 6.000 2.265 2.117 2.827 . 0 0 "[ . 1 . 2]" 1
6 1 2 ALA HA 1 41 GLY H 4.900 . 6.000 5.150 4.304 5.886 . 0 0 "[ . 1 . 2]" 1
7 1 2 ALA MB 1 3 THR H 3.100 . 4.600 3.370 2.628 3.721 . 0 0 "[ . 1 . 2]" 1
8 1 2 ALA MB 1 39 GLN HG2 3.800 . 5.900 2.721 1.895 4.145 . 0 0 "[ . 1 . 2]" 1
9 1 2 ALA MB 1 39 GLN HE21 4.700 . 6.000 3.962 2.071 6.062 0.062 1 0 "[ . 1 . 2]" 1
10 1 2 ALA MB 1 39 GLN HG3 5.100 . 6.000 3.799 2.836 4.616 . 0 0 "[ . 1 . 2]" 1
11 1 2 ALA MB 1 40 CYS H 3.900 . 6.000 4.285 3.155 5.194 . 0 0 "[ . 1 . 2]" 1
12 1 2 ALA MB 1 41 GLY H 4.400 . 6.000 5.263 3.676 6.060 0.060 15 0 "[ . 1 . 2]" 1
13 1 3 THR H 1 3 THR MG 3.500 . 5.300 3.665 3.372 3.958 . 0 0 "[ . 1 . 2]" 1
14 1 3 THR H 1 4 THR H 6.000 . 6.000 4.484 4.177 4.597 . 0 0 "[ . 1 . 2]" 1
15 1 3 THR H 1 40 CYS H 3.000 . 4.400 3.300 2.678 3.786 . 0 0 "[ . 1 . 2]" 1
16 1 3 THR H 1 40 CYS HB2 4.100 . 6.000 4.510 3.421 5.646 . 0 0 "[ . 1 . 2]" 1
17 1 3 THR H 1 40 CYS HB3 4.900 . 6.000 4.177 3.364 6.000 . 0 0 "[ . 1 . 2]" 1
18 1 3 THR H 1 41 GLY H 6.000 . 6.000 5.527 4.894 6.052 0.052 17 0 "[ . 1 . 2]" 1
19 1 3 THR HA 1 3 THR MG 2.800 . 4.100 2.063 1.962 2.202 . 0 0 "[ . 1 . 2]" 1
20 1 3 THR HA 1 4 THR H 6.000 . 6.000 2.186 2.135 2.328 . 0 0 "[ . 1 . 2]" 1
21 1 3 THR HA 1 40 CYS H 6.000 . 6.000 4.750 4.341 5.579 . 0 0 "[ . 1 . 2]" 1
22 1 3 THR HB 1 4 THR H 6.000 . 6.000 3.735 3.299 4.187 . 0 0 "[ . 1 . 2]" 1
23 1 3 THR HB 1 40 CYS H 3.400 . 5.200 3.745 2.950 4.571 . 0 0 "[ . 1 . 2]" 1
24 1 3 THR HB 1 40 CYS HB2 3.300 . 5.000 3.859 2.313 4.901 . 0 0 "[ . 1 . 2]" 1
25 1 3 THR HB 1 40 CYS HB3 4.600 . 6.000 4.082 2.826 6.010 0.010 11 0 "[ . 1 . 2]" 1
26 1 3 THR MG 1 4 THR H 3.000 . 4.400 2.769 2.292 3.291 . 0 0 "[ . 1 . 2]" 1
27 1 3 THR MG 1 40 CYS H 4.500 . 6.000 4.961 4.180 5.640 . 0 0 "[ . 1 . 2]" 1
28 1 3 THR MG 1 40 CYS HB2 4.100 . 6.000 5.184 3.417 6.018 0.018 13 0 "[ . 1 . 2]" 1
29 1 4 THR HA 1 4 THR MG 2.600 . 3.700 2.094 1.946 2.258 . 0 0 "[ . 1 . 2]" 1
30 1 4 THR HA 1 5 ILE H 6.000 . 6.000 2.161 2.128 2.227 . 0 0 "[ . 1 . 2]" 1
31 1 4 THR HA 1 5 ILE HG12 6.000 . 6.000 3.733 2.810 4.708 . 0 0 "[ . 1 . 2]" 1
32 1 4 THR HA 1 5 ILE HG13 3.500 . 5.300 3.502 2.963 4.225 . 0 0 "[ . 1 . 2]" 1
33 1 4 THR HA 1 39 GLN HG2 4.400 . 6.000 3.742 2.823 4.805 . 0 0 "[ . 1 . 2]" 1
34 1 4 THR HA 1 39 GLN HG3 4.300 . 6.000 3.036 1.850 5.684 . 0 0 "[ . 1 . 2]" 1
35 1 4 THR HB 1 5 ILE H 6.000 . 6.000 3.785 3.499 4.168 . 0 0 "[ . 1 . 2]" 1
36 1 4 THR MG 1 5 ILE H 6.000 . 6.000 2.771 2.219 3.279 . 0 0 "[ . 1 . 2]" 1
37 1 4 THR MG 1 37 GLY H 3.100 . 4.600 3.948 3.259 4.499 . 0 0 "[ . 1 . 2]" 1
38 1 4 THR MG 1 37 GLY HA2 3.500 . 5.400 3.174 2.211 4.114 . 0 0 "[ . 1 . 2]" 1
39 1 4 THR MG 1 39 GLN HA 6.000 . 6.000 3.615 3.087 4.323 . 0 0 "[ . 1 . 2]" 1
40 1 4 THR MG 1 39 GLN HE21 4.200 . 6.000 3.792 2.159 6.006 0.006 15 0 "[ . 1 . 2]" 1
41 1 4 THR MG 1 39 GLN HE22 6.000 . 6.000 4.246 2.971 5.822 . 0 0 "[ . 1 . 2]" 1
42 1 5 ILE H 1 5 ILE HB 2.500 . 3.600 2.541 2.213 2.808 . 0 0 "[ . 1 . 2]" 1
43 1 5 ILE H 1 6 GLY H 6.000 . 6.000 4.457 4.266 4.553 . 0 0 "[ . 1 . 2]" 1
44 1 5 ILE H 1 37 GLY H 6.000 . 6.000 3.911 3.563 4.194 . 0 0 "[ . 1 . 2]" 1
45 1 5 ILE H 1 39 GLN HA 3.300 . 4.900 3.183 2.903 3.511 . 0 0 "[ . 1 . 2]" 1
46 1 5 ILE H 1 40 CYS H 4.200 . 6.000 4.262 3.587 5.003 . 0 0 "[ . 1 . 2]" 1
47 1 5 ILE HA 1 5 ILE HG13 3.000 . 4.400 3.061 2.386 3.928 . 0 0 "[ . 1 . 2]" 1
48 1 5 ILE HA 1 6 GLY H 2.200 . 3.100 2.126 2.092 2.209 . 0 0 "[ . 1 . 2]" 1
49 1 5 ILE HA 1 9 THR MG 3.200 . 4.800 3.723 2.701 4.680 . 0 0 "[ . 1 . 2]" 1
50 1 5 ILE HA 1 37 GLY H 5.100 . 6.000 5.123 4.834 5.453 . 0 0 "[ . 1 . 2]" 1
51 1 5 ILE HB 1 5 ILE HG13 2.600 . 3.700 2.514 2.266 2.805 . 0 0 "[ . 1 . 2]" 1
52 1 5 ILE HB 1 6 GLY H 6.000 . 6.000 4.121 3.510 4.387 . 0 0 "[ . 1 . 2]" 1
53 1 5 ILE HB 1 38 SER QB 6.000 . 6.000 3.197 2.533 3.644 . 0 0 "[ . 1 . 2]" 1
54 1 5 ILE HB 1 36 ILE HA 3.000 . 4.400 3.620 2.905 4.055 . 0 0 "[ . 1 . 2]" 1
55 1 5 ILE HB 1 36 ILE HA 3.300 . 5.000 3.979 2.921 5.017 0.017 10 0 "[ . 1 . 2]" 1
56 1 5 ILE HB 1 37 GLY H 3.100 . 4.600 3.843 3.144 4.293 . 0 0 "[ . 1 . 2]" 1
57 1 5 ILE HB 1 38 SER H 2.800 . 4.100 3.350 2.928 3.919 . 0 0 "[ . 1 . 2]" 1
58 1 5 ILE HB 1 38 SER QB 3.000 . 4.400 3.577 2.570 4.321 . 0 0 "[ . 1 . 2]" 1
59 1 5 ILE MD 1 6 GLY H 6.000 . 6.000 4.819 3.459 5.289 . 0 0 "[ . 1 . 2]" 1
60 1 5 ILE MD 1 9 THR MG 6.000 . 6.000 5.114 2.158 6.031 0.031 19 0 "[ . 1 . 2]" 1
61 1 5 ILE MD 1 17 PRO HB3 6.000 . 6.000 4.781 2.655 5.629 . 0 0 "[ . 1 . 2]" 1
62 1 5 ILE MD 1 17 PRO HG2 6.000 . 6.000 5.042 4.279 5.748 . 0 0 "[ . 1 . 2]" 1
63 1 5 ILE MD 1 18 TYR H 6.000 . 6.000 5.374 3.942 6.064 0.064 5 0 "[ . 1 . 2]" 1
64 1 5 ILE MD 1 19 CYS HA 6.000 . 6.000 4.319 3.466 5.082 . 0 0 "[ . 1 . 2]" 1
65 1 5 ILE MD 1 19 CYS QB 4.300 . 6.000 3.536 1.977 4.260 . 0 0 "[ . 1 . 2]" 1
66 1 5 ILE MD 1 19 CYS QB 6.000 . 6.000 2.567 1.960 3.256 . 0 0 "[ . 1 . 2]" 1
67 1 5 ILE MD 1 19 CYS QB 4.800 . 6.000 3.369 1.973 4.115 . 0 0 "[ . 1 . 2]" 1
68 1 5 ILE MD 1 33 VAL HA 6.000 . 6.000 5.031 4.251 5.499 . 0 0 "[ . 1 . 2]" 1
69 1 5 ILE MD 1 34 GLY H 3.900 . 6.000 4.391 3.794 5.028 . 0 0 "[ . 1 . 2]" 1
70 1 5 ILE MD 1 34 GLY HA2 2.600 . 3.700 2.566 2.024 3.452 . 0 0 "[ . 1 . 2]" 1
71 1 5 ILE MD 1 34 GLY HA3 2.600 . 3.700 2.724 2.179 3.478 . 0 0 "[ . 1 . 2]" 1
72 1 5 ILE MD 1 35 VAL H 3.400 . 5.100 3.177 1.987 4.671 . 0 0 "[ . 1 . 2]" 1
73 1 5 ILE MD 1 35 VAL HA 6.000 . 6.000 5.234 4.037 6.100 0.100 11 0 "[ . 1 . 2]" 1
74 1 5 ILE MD 1 36 ILE HA 6.000 . 6.000 5.517 4.366 6.027 0.027 16 0 "[ . 1 . 2]" 1
75 1 5 ILE MD 1 37 GLY H 6.000 . 6.000 5.515 4.802 6.113 0.113 18 0 "[ . 1 . 2]" 1
76 1 5 ILE MD 1 38 SER H 6.000 . 6.000 4.611 3.754 5.904 . 0 0 "[ . 1 . 2]" 1
77 1 5 ILE MD 1 40 CYS H 6.000 . 6.000 3.224 2.141 4.621 . 0 0 "[ . 1 . 2]" 1
78 1 5 ILE MD 1 40 CYS HA 4.500 . 6.000 3.516 2.355 5.139 . 0 0 "[ . 1 . 2]" 1
79 1 5 ILE MD 1 40 CYS HB2 3.000 . 4.400 2.130 1.638 3.447 . 0 0 "[ . 1 . 2]" 1
80 1 5 ILE MD 1 40 CYS HB3 3.400 . 5.100 3.410 2.671 4.218 . 0 0 "[ . 1 . 2]" 1
81 1 5 ILE MD 1 44 VAL QG 3.100 . 4.600 2.717 1.739 4.188 . 0 0 "[ . 1 . 2]" 1
82 1 5 ILE HG12 1 6 GLY H 6.000 . 6.000 4.493 4.024 5.117 . 0 0 "[ . 1 . 2]" 1
83 1 5 ILE HG12 1 40 CYS HB2 6.000 . 6.000 3.065 2.366 3.645 . 0 0 "[ . 1 . 2]" 1
84 1 5 ILE HG13 1 6 GLY H 6.000 . 6.000 4.984 4.431 5.594 . 0 0 "[ . 1 . 2]" 1
85 1 5 ILE HG13 1 40 CYS HB2 4.000 . 6.000 2.959 2.205 3.873 . 0 0 "[ . 1 . 2]" 1
86 1 5 ILE MG 1 6 GLY H 2.700 . 3.900 2.488 1.878 2.931 . 0 0 "[ . 1 . 2]" 1
87 1 5 ILE MG 1 9 THR MG 3.200 . 4.800 3.743 2.542 4.835 0.035 1 0 "[ . 1 . 2]" 1
88 1 5 ILE MG 1 17 PRO HB3 6.000 . 6.000 3.015 2.542 3.649 . 0 0 "[ . 1 . 2]" 1
89 1 5 ILE MG 1 17 PRO HG2 6.000 . 6.000 3.155 2.626 4.060 . 0 0 "[ . 1 . 2]" 1
90 1 5 ILE MG 1 17 PRO HG3 3.000 . 4.400 3.035 2.366 3.706 . 0 0 "[ . 1 . 2]" 1
91 1 5 ILE MG 1 34 GLY HA2 6.000 . 6.000 2.730 2.051 3.060 . 0 0 "[ . 1 . 2]" 1
92 1 5 ILE MG 1 34 GLY HA3 6.000 . 6.000 1.754 1.407 2.108 . 0 0 "[ . 1 . 2]" 1
93 1 5 ILE MG 1 35 VAL H 6.000 . 6.000 3.405 2.956 3.752 . 0 0 "[ . 1 . 2]" 1
94 1 5 ILE MG 1 35 VAL HA 3.200 . 4.800 4.311 3.946 4.796 . 0 0 "[ . 1 . 2]" 1
95 1 5 ILE MG 1 35 VAL HA 3.200 . 4.800 3.845 2.805 4.426 . 0 0 "[ . 1 . 2]" 1
96 1 5 ILE MG 1 36 ILE HA 2.500 . 3.600 3.532 2.554 3.669 0.069 20 0 "[ . 1 . 2]" 1
97 1 5 ILE MG 1 36 ILE MD 4.000 . 6.000 5.171 3.022 5.933 . 0 0 "[ . 1 . 2]" 1
98 1 5 ILE MG 1 37 GLY H 3.700 . 5.700 4.243 3.449 4.745 . 0 0 "[ . 1 . 2]" 1
99 1 5 ILE MG 1 38 SER H 6.000 . 6.000 4.446 3.411 4.866 . 0 0 "[ . 1 . 2]" 1
100 1 6 GLY H 1 6 GLY HA2 2.600 . 3.800 2.922 2.693 2.957 . 0 0 "[ . 1 . 2]" 1
101 1 6 GLY H 1 7 PRO HD2 6.000 . 6.000 4.874 4.575 5.190 . 0 0 "[ . 1 . 2]" 1
102 1 6 GLY H 1 7 PRO HD3 6.000 . 6.000 4.838 4.365 5.192 . 0 0 "[ . 1 . 2]" 1
103 1 6 GLY H 1 9 THR H 3.700 . 5.700 4.476 3.509 5.362 . 0 0 "[ . 1 . 2]" 1
104 1 6 GLY H 1 9 THR HA 6.000 . 6.000 5.438 4.761 5.958 . 0 0 "[ . 1 . 2]" 1
105 1 6 GLY H 1 9 THR HB 6.000 . 6.000 5.161 3.548 5.746 . 0 0 "[ . 1 . 2]" 1
106 1 6 GLY H 1 9 THR MG 4.000 . 6.000 3.229 2.245 4.515 . 0 0 "[ . 1 . 2]" 1
107 1 6 GLY HA2 1 7 PRO HD2 2.900 . 4.200 2.397 1.796 3.113 . 0 0 "[ . 1 . 2]" 1
108 1 6 GLY HA2 1 7 PRO HD3 2.500 . 3.600 2.363 1.895 2.695 . 0 0 "[ . 1 . 2]" 1
109 1 6 GLY HA2 1 36 ILE HA 3.300 . 4.900 2.751 2.317 3.569 . 0 0 "[ . 1 . 2]" 1
110 1 6 GLY HA2 1 36 ILE HB 4.700 . 6.000 4.420 3.904 4.814 . 0 0 "[ . 1 . 2]" 1
111 1 6 GLY HA3 1 7 PRO HD2 6.000 . 6.000 2.913 2.561 3.504 . 0 0 "[ . 1 . 2]" 1
112 1 6 GLY HA3 1 7 PRO HD3 4.400 . 6.000 3.655 2.968 4.217 . 0 0 "[ . 1 . 2]" 1
113 1 6 GLY HA3 1 36 ILE HA 2.900 . 4.300 2.850 2.617 3.204 . 0 0 "[ . 1 . 2]" 1
114 1 6 GLY HA3 1 36 ILE MG 6.000 . 6.000 3.714 2.544 4.975 . 0 0 "[ . 1 . 2]" 1
115 1 7 PRO HA 1 7 PRO HB3 2.100 . 2.900 2.281 2.244 2.311 . 0 0 "[ . 1 . 2]" 1
116 1 7 PRO HA 1 7 PRO HD3 4.600 . 6.000 3.483 3.118 3.770 . 0 0 "[ . 1 . 2]" 1
117 1 7 PRO HA 1 9 THR H 4.600 . 6.000 3.771 3.318 4.436 . 0 0 "[ . 1 . 2]" 1
118 1 7 PRO HA 1 36 ILE HG12 3.300 . 4.900 5.009 4.424 5.858 0.958 9 5 "[ . +- *.* * 2]" 1
119 1 7 PRO HB2 1 8 ASN H 6.000 . 6.000 3.622 2.656 4.356 . 0 0 "[ . 1 . 2]" 1
120 1 7 PRO HB3 1 7 PRO HD2 3.800 . 5.900 3.893 3.846 3.977 . 0 0 "[ . 1 . 2]" 1
121 1 7 PRO HB3 1 7 PRO HD3 3.800 . 5.900 3.265 2.865 4.052 . 0 0 "[ . 1 . 2]" 1
122 1 7 PRO HB3 1 8 ASN H 4.100 . 6.000 4.389 3.987 4.692 . 0 0 "[ . 1 . 2]" 1
123 1 7 PRO HB3 1 36 ILE HG12 3.600 . 5.500 4.003 3.117 5.339 . 0 0 "[ . 1 . 2]" 1
124 1 7 PRO HB3 1 36 ILE MG 6.000 . 6.000 4.755 3.860 5.953 . 0 0 "[ . 1 . 2]" 1
125 1 7 PRO HD2 1 8 ASN H 3.300 . 5.000 3.507 2.977 4.530 . 0 0 "[ . 1 . 2]" 1
126 1 7 PRO HD2 1 36 ILE MG 6.000 . 6.000 2.324 1.996 3.064 . 0 0 "[ . 1 . 2]" 1
127 1 7 PRO HD3 1 7 PRO QG 2.600 . 3.700 2.225 2.173 2.258 . 0 0 "[ . 1 . 2]" 1
128 1 7 PRO HD3 1 8 ASN H 4.100 . 6.000 4.319 4.036 4.828 . 0 0 "[ . 1 . 2]" 1
129 1 7 PRO HD3 1 33 VAL QG 6.000 . 6.000 5.948 5.842 6.020 0.020 18 0 "[ . 1 . 2]" 1
130 1 7 PRO HD3 1 36 ILE MG 2.900 . 4.200 2.284 1.613 2.756 . 0 0 "[ . 1 . 2]" 1
131 1 7 PRO QG 1 8 ASN H 6.000 . 6.000 3.568 2.451 4.818 . 0 0 "[ . 1 . 2]" 1
132 1 8 ASN H 1 8 ASN HB2 2.500 . 3.600 2.471 2.167 3.171 . 0 0 "[ . 1 . 2]" 1
133 1 8 ASN H 1 8 ASN HB3 3.500 . 5.400 2.925 2.455 3.737 . 0 0 "[ . 1 . 2]" 1
134 1 8 ASN H 1 9 THR H 6.000 . 6.000 2.580 1.666 3.550 . 0 0 "[ . 1 . 2]" 1
135 1 8 ASN H 1 9 THR H 2.300 . 3.300 2.178 1.656 2.558 . 0 0 "[ . 1 . 2]" 1
136 1 8 ASN H 1 9 THR HA 6.000 . 6.000 3.429 3.296 3.487 . 0 0 "[ . 1 . 2]" 1
137 1 8 ASN HA 1 9 THR H 3.200 . 4.800 3.052 2.459 3.542 . 0 0 "[ . 1 . 2]" 1
138 1 8 ASN HB2 1 8 ASN HD21 3.500 . 5.300 2.814 2.116 3.529 . 0 0 "[ . 1 . 2]" 1
139 1 8 ASN HB2 1 9 THR H 6.000 . 6.000 4.311 3.740 4.647 . 0 0 "[ . 1 . 2]" 1
140 1 8 ASN HB2 1 9 THR HA 4.100 . 6.000 5.235 4.499 5.637 . 0 0 "[ . 1 . 2]" 1
141 1 8 ASN HB3 1 9 THR H 6.000 . 6.000 3.923 2.515 4.631 . 0 0 "[ . 1 . 2]" 1
142 1 8 ASN HB3 1 9 THR HA 3.700 . 5.700 3.725 2.568 4.644 . 0 0 "[ . 1 . 2]" 1
143 1 9 THR H 1 9 THR HA 2.900 . 4.200 2.855 2.757 2.933 . 0 0 "[ . 1 . 2]" 1
144 1 9 THR H 1 9 THR HB 2.500 . 3.600 3.289 2.662 3.517 . 0 0 "[ . 1 . 2]" 1
145 1 9 THR H 1 9 THR MG 3.900 . 6.000 3.285 2.759 3.780 . 0 0 "[ . 1 . 2]" 1
146 1 9 THR H 1 10 CYS H 6.000 . 6.000 2.621 2.209 3.128 . 0 0 "[ . 1 . 2]" 1
147 1 9 THR HA 1 9 THR MG 2.800 . 4.000 2.055 1.924 2.276 . 0 0 "[ . 1 . 2]" 1
148 1 9 THR HA 1 10 CYS H 6.000 . 6.000 3.529 3.446 3.566 . 0 0 "[ . 1 . 2]" 1
149 1 9 THR HA 1 10 CYS HB3 3.800 . 5.900 4.719 3.085 5.524 . 0 0 "[ . 1 . 2]" 1
150 1 9 THR HB 1 9 THR MG 2.400 . 3.400 2.109 2.088 2.139 . 0 0 "[ . 1 . 2]" 1
151 1 9 THR HB 1 10 CYS H 2.500 . 3.600 2.691 2.216 3.412 . 0 0 "[ . 1 . 2]" 1
152 1 9 THR HB 1 17 PRO HG2 4.600 . 6.000 5.943 5.059 6.081 0.081 15 0 "[ . 1 . 2]" 1
153 1 9 THR HB 1 17 PRO HG3 5.500 . 6.000 4.666 3.774 4.858 . 0 0 "[ . 1 . 2]" 1
154 1 9 THR MG 1 10 CYS H 6.000 . 6.000 3.939 3.414 4.280 . 0 0 "[ . 1 . 2]" 1
155 1 9 THR MG 1 17 PRO HB2 6.000 . 6.000 4.636 3.667 5.376 . 0 0 "[ . 1 . 2]" 1
156 1 9 THR MG 1 17 PRO HB3 6.000 . 6.000 3.580 2.366 4.525 . 0 0 "[ . 1 . 2]" 1
157 1 9 THR MG 1 18 TYR H 4.400 . 6.000 5.254 4.722 5.751 . 0 0 "[ . 1 . 2]" 1
158 1 10 CYS H 1 10 CYS HB3 3.900 . 6.000 3.677 3.557 3.853 . 0 0 "[ . 1 . 2]" 1
159 1 10 CYS HA 1 10 CYS HB3 2.600 . 3.700 2.480 2.240 2.740 . 0 0 "[ . 1 . 2]" 1
160 1 10 CYS HA 1 11 SER H 2.400 . 3.400 2.247 2.123 2.566 . 0 0 "[ . 1 . 2]" 1
161 1 10 CYS HA 1 12 ILE H 6.000 . 6.000 3.800 3.354 4.391 . 0 0 "[ . 1 . 2]" 1
162 1 10 CYS HB2 1 11 SER H 6.000 . 6.000 3.952 2.985 4.471 . 0 0 "[ . 1 . 2]" 1
163 1 10 CYS HB2 1 15 TYR QD 6.000 . 6.000 4.857 4.022 5.474 . 0 0 "[ . 1 . 2]" 1
164 1 10 CYS HB2 1 17 PRO HD3 4.100 . 6.000 3.707 2.376 4.633 . 0 0 "[ . 1 . 2]" 1
165 1 10 CYS HB2 1 46 CYS HA 6.000 . 6.000 3.962 2.990 4.859 . 0 0 "[ . 1 . 2]" 1
166 1 10 CYS HB3 1 11 SER H 3.200 . 4.800 3.235 2.592 3.933 . 0 0 "[ . 1 . 2]" 1
167 1 10 CYS HB3 1 11 SER HB2 4.500 . 6.000 4.942 3.092 6.039 0.039 15 0 "[ . 1 . 2]" 1
168 1 10 CYS HB3 1 12 ILE H 3.600 . 5.500 3.847 2.924 4.676 . 0 0 "[ . 1 . 2]" 1
169 1 10 CYS HB3 1 15 TYR QE 6.000 . 6.000 4.719 4.016 5.106 . 0 0 "[ . 1 . 2]" 1
170 1 10 CYS HB3 1 15 TYR H 4.100 . 6.000 3.892 3.568 4.155 . 0 0 "[ . 1 . 2]" 1
171 1 10 CYS HB3 1 15 TYR HB3 2.900 . 4.300 2.513 1.988 3.092 . 0 0 "[ . 1 . 2]" 1
172 1 10 CYS HB3 1 15 TYR QD 6.000 . 6.000 3.935 3.547 4.625 . 0 0 "[ . 1 . 2]" 1
173 1 10 CYS HB3 1 15 TYR QD 3.600 . 5.600 3.793 3.499 4.107 . 0 0 "[ . 1 . 2]" 1
174 1 10 CYS HB3 1 15 TYR QE 6.000 . 6.000 5.928 5.528 6.181 0.181 9 0 "[ . 1 . 2]" 1
175 1 10 CYS HB3 1 17 PRO HD3 5.100 . 6.000 5.013 4.003 6.037 0.037 20 0 "[ . 1 . 2]" 1
176 1 10 CYS HB3 1 46 CYS HA 4.400 . 6.000 4.282 2.297 5.578 . 0 0 "[ . 1 . 2]" 1
177 1 11 SER H 1 11 SER HB2 2.900 . 4.300 3.369 2.918 3.882 . 0 0 "[ . 1 . 2]" 1
178 1 11 SER H 1 12 ILE H 2.500 . 3.600 1.836 1.610 2.311 . 0 0 "[ . 1 . 2]" 1
179 1 11 SER H 1 12 ILE HA 6.000 . 6.000 4.112 3.911 4.307 . 0 0 "[ . 1 . 2]" 1
180 1 11 SER H 1 12 ILE HB 6.000 . 6.000 4.567 4.200 4.970 . 0 0 "[ . 1 . 2]" 1
181 1 11 SER H 1 12 ILE HG13 6.000 . 6.000 2.443 1.880 3.466 . 0 0 "[ . 1 . 2]" 1
182 1 11 SER H 1 13 ASP HA 6.000 . 6.000 6.086 5.973 6.175 0.175 8 0 "[ . 1 . 2]" 1
183 1 11 SER H 1 13 ASP QB 4.800 . 6.000 6.172 6.038 6.358 0.358 5 0 "[ . 1 . 2]" 1
184 1 11 SER HA 1 12 ILE H 3.000 . 4.400 2.957 2.682 3.129 . 0 0 "[ . 1 . 2]" 1
185 1 11 SER HB2 1 12 ILE H 6.000 . 6.000 4.096 3.823 4.344 . 0 0 "[ . 1 . 2]" 1
186 1 11 SER HB3 1 12 ILE H 6.000 . 6.000 4.536 4.229 4.655 . 0 0 "[ . 1 . 2]" 1
187 1 12 ILE H 1 12 ILE HA 2.900 . 4.200 2.893 2.871 2.945 . 0 0 "[ . 1 . 2]" 1
188 1 12 ILE H 1 12 ILE MD 4.400 . 6.000 2.992 2.193 3.783 . 0 0 "[ . 1 . 2]" 1
189 1 12 ILE H 1 13 ASP H 4.000 . 6.000 2.905 2.669 3.302 . 0 0 "[ . 1 . 2]" 1
190 1 12 ILE H 1 15 TYR H 3.700 . 5.700 3.782 2.768 4.431 . 0 0 "[ . 1 . 2]" 1
191 1 12 ILE H 1 15 TYR HB2 6.000 . 6.000 3.173 2.496 3.786 . 0 0 "[ . 1 . 2]" 1
192 1 12 ILE H 1 15 TYR HB3 5.200 . 6.000 4.646 3.790 5.280 . 0 0 "[ . 1 . 2]" 1
193 1 12 ILE HA 1 12 ILE MD 3.900 . 6.000 4.049 3.877 4.161 . 0 0 "[ . 1 . 2]" 1
194 1 12 ILE HA 1 12 ILE MG 2.700 . 3.900 2.107 1.919 2.291 . 0 0 "[ . 1 . 2]" 1
195 1 12 ILE HA 1 13 ASP H 3.100 . 4.600 3.504 3.398 3.546 . 0 0 "[ . 1 . 2]" 1
196 1 12 ILE HB 1 13 ASP H 6.000 . 6.000 1.768 1.514 2.257 . 0 0 "[ . 1 . 2]" 1
197 1 12 ILE HB 1 15 TYR H 6.000 . 6.000 4.999 4.472 5.368 . 0 0 "[ . 1 . 2]" 1
198 1 12 ILE HB 1 15 TYR HB2 6.000 . 6.000 4.396 3.988 4.629 . 0 0 "[ . 1 . 2]" 1
199 1 12 ILE HB 1 15 TYR HB3 6.000 . 6.000 5.874 5.305 6.084 0.084 16 0 "[ . 1 . 2]" 1
200 1 12 ILE HB 1 15 TYR QD 6.000 . 6.000 3.326 2.348 5.123 . 0 0 "[ . 1 . 2]" 1
201 1 12 ILE HB 1 15 TYR QE 6.000 . 6.000 4.298 3.402 6.030 0.030 6 0 "[ . 1 . 2]" 1
202 1 12 ILE MD 1 13 ASP H 6.000 . 6.000 2.983 2.387 3.517 . 0 0 "[ . 1 . 2]" 1
203 1 12 ILE MD 1 15 TYR H 6.000 . 6.000 4.847 3.921 5.923 . 0 0 "[ . 1 . 2]" 1
204 1 12 ILE MD 1 15 TYR HB2 6.000 . 6.000 3.339 2.430 4.542 . 0 0 "[ . 1 . 2]" 1
205 1 12 ILE MD 1 15 TYR HB3 6.000 . 6.000 4.060 3.413 5.345 . 0 0 "[ . 1 . 2]" 1
206 1 12 ILE MD 1 15 TYR QD 4.100 . 6.000 2.365 1.873 3.900 . 0 0 "[ . 1 . 2]" 1
207 1 12 ILE MD 1 15 TYR QE 3.400 . 5.100 3.391 2.819 4.974 . 0 0 "[ . 1 . 2]" 1
208 1 12 ILE HG12 1 13 ASP H 6.000 . 6.000 4.092 3.259 4.522 . 0 0 "[ . 1 . 2]" 1
209 1 12 ILE HG13 1 13 ASP H 6.000 . 6.000 3.156 1.791 3.997 . 0 0 "[ . 1 . 2]" 1
210 1 12 ILE HG13 1 15 TYR H 6.000 . 6.000 4.914 3.268 5.905 . 0 0 "[ . 1 . 2]" 1
211 1 12 ILE HG13 1 15 TYR HB2 6.000 . 6.000 3.722 1.991 4.787 . 0 0 "[ . 1 . 2]" 1
212 1 12 ILE HG13 1 15 TYR HB3 6.000 . 6.000 5.016 3.371 6.029 0.029 13 0 "[ . 1 . 2]" 1
213 1 12 ILE HG13 1 15 TYR QD 6.000 . 6.000 3.657 2.105 4.366 . 0 0 "[ . 1 . 2]" 1
214 1 12 ILE HG13 1 15 TYR QE 6.000 . 6.000 5.469 4.267 6.040 0.040 11 0 "[ . 1 . 2]" 1
215 1 12 ILE MG 1 13 ASP H 2.900 . 4.300 3.353 3.031 3.760 . 0 0 "[ . 1 . 2]" 1
216 1 12 ILE MG 1 15 TYR H 4.600 . 6.000 5.887 5.333 6.208 0.208 20 0 "[ . 1 . 2]" 1
217 1 13 ASP H 1 13 ASP QB 2.300 . 3.300 2.266 2.070 2.338 . 0 0 "[ . 1 . 2]" 1
218 1 13 ASP H 1 14 ASP H 6.000 . 6.000 3.990 3.360 4.500 . 0 0 "[ . 1 . 2]" 1
219 1 13 ASP H 1 15 TYR H 5.400 . 6.000 3.434 2.858 3.970 . 0 0 "[ . 1 . 2]" 1
220 1 13 ASP HA 1 13 ASP QB 2.500 . 3.600 2.452 2.344 2.527 . 0 0 "[ . 1 . 2]" 1
221 1 13 ASP HA 1 14 ASP H 6.000 . 6.000 2.694 2.347 2.973 . 0 0 "[ . 1 . 2]" 1
222 1 13 ASP HA 1 15 TYR QD 5.000 . 6.000 4.534 3.985 4.947 . 0 0 "[ . 1 . 2]" 1
223 1 13 ASP HA 1 15 TYR QE 6.000 . 6.000 5.231 4.661 6.000 . 0 0 "[ . 1 . 2]" 1
224 1 13 ASP QB 1 14 ASP H 6.000 . 6.000 3.140 2.171 4.013 . 0 0 "[ . 1 . 2]" 1
225 1 13 ASP QB 1 15 TYR H 6.000 . 6.000 3.509 2.833 4.721 . 0 0 "[ . 1 . 2]" 1
226 1 13 ASP QB 1 15 TYR QD 3.300 . 4.900 2.668 1.708 3.005 . 0 0 "[ . 1 . 2]" 1
227 1 13 ASP QB 1 15 TYR QE 4.400 . 6.000 2.787 2.019 3.755 . 0 0 "[ . 1 . 2]" 1
228 1 13 ASP HB2 1 15 TYR HB3 3.000 . 4.400 2.218 1.568 3.048 0.032 19 0 "[ . 1 . 2]" 1
229 1 14 ASP H 1 15 TYR H 2.500 . 3.600 3.041 2.576 3.442 . 0 0 "[ . 1 . 2]" 1
230 1 14 ASP H 1 15 TYR HB3 4.000 . 6.000 3.372 2.488 4.167 . 0 0 "[ . 1 . 2]" 1
231 1 14 ASP H 1 15 TYR QD 3.600 . 5.500 3.488 3.114 3.910 . 0 0 "[ . 1 . 2]" 1
232 1 14 ASP H 1 15 TYR QE 6.000 . 6.000 5.064 4.761 5.337 . 0 0 "[ . 1 . 2]" 1
233 1 14 ASP HA 1 15 TYR H 2.900 . 4.300 2.735 2.557 2.982 . 0 0 "[ . 1 . 2]" 1
234 1 14 ASP HB2 1 15 TYR H 6.000 . 6.000 4.506 4.108 4.626 . 0 0 "[ . 1 . 2]" 1
235 1 14 ASP HB3 1 15 TYR H 6.000 . 6.000 4.226 3.970 4.370 . 0 0 "[ . 1 . 2]" 1
236 1 15 TYR H 1 15 TYR HB2 3.000 . 4.400 2.299 2.157 2.481 . 0 0 "[ . 1 . 2]" 1
237 1 15 TYR H 1 15 TYR HB3 2.700 . 3.900 3.555 3.448 3.634 . 0 0 "[ . 1 . 2]" 1
238 1 15 TYR H 1 15 TYR QD 2.600 . 3.800 3.450 2.528 3.822 0.022 11 0 "[ . 1 . 2]" 1
239 1 15 TYR H 1 15 TYR QE 4.700 . 6.000 5.143 4.827 5.596 . 0 0 "[ . 1 . 2]" 1
240 1 15 TYR H 1 16 LYS H 6.000 . 6.000 4.341 3.747 4.564 . 0 0 "[ . 1 . 2]" 1
241 1 15 TYR HA 1 15 TYR QD 2.900 . 4.200 2.040 1.642 2.698 . 0 0 "[ . 1 . 2]" 1
242 1 15 TYR HA 1 15 TYR QE 6.000 . 6.000 4.235 4.030 4.452 . 0 0 "[ . 1 . 2]" 1
243 1 15 TYR HA 1 16 LYS H 6.000 . 6.000 2.218 2.128 2.410 . 0 0 "[ . 1 . 2]" 1
244 1 15 TYR HA 1 47 CYS H 6.000 . 6.000 4.232 3.424 4.958 . 0 0 "[ . 1 . 2]" 1
245 1 15 TYR HA 1 47 CYS HA 6.000 . 6.000 4.481 3.504 5.705 . 0 0 "[ . 1 . 2]" 1
246 1 15 TYR HA 1 48 LYS HA 3.400 . 5.200 2.922 1.933 4.393 . 0 0 "[ . 1 . 2]" 1
247 1 15 TYR HA 1 48 LYS QB 6.000 . 6.000 3.586 2.735 4.803 . 0 0 "[ . 1 . 2]" 1
248 1 15 TYR HB2 1 15 TYR QD 2.400 . 3.400 2.359 2.261 2.729 . 0 0 "[ . 1 . 2]" 1
249 1 15 TYR HB2 1 15 TYR QE 4.600 . 6.000 4.400 4.362 4.500 . 0 0 "[ . 1 . 2]" 1
250 1 15 TYR HB2 1 16 LYS H 3.100 . 4.600 4.296 3.791 4.569 . 0 0 "[ . 1 . 2]" 1
251 1 15 TYR HB2 1 46 CYS HB2 6.000 . 6.000 4.926 3.075 6.037 0.037 9 0 "[ . 1 . 2]" 1
252 1 15 TYR HB2 1 47 CYS H 4.100 . 6.000 5.806 5.413 6.060 0.060 12 0 "[ . 1 . 2]" 1
253 1 15 TYR HB3 1 15 TYR QD 2.200 . 3.100 2.694 2.291 2.768 . 0 0 "[ . 1 . 2]" 1
254 1 15 TYR HB3 1 15 TYR QE 3.300 . 5.000 4.490 4.383 4.514 . 0 0 "[ . 1 . 2]" 1
255 1 15 TYR HB3 1 16 LYS H 4.000 . 6.000 3.393 2.489 4.236 . 0 0 "[ . 1 . 2]" 1
256 1 15 TYR HB3 1 46 CYS HA 4.900 . 6.000 3.680 3.143 4.166 . 0 0 "[ . 1 . 2]" 1
257 1 15 TYR HB3 1 46 CYS HB2 3.400 . 5.200 3.630 1.658 4.785 . 0 0 "[ . 1 . 2]" 1
258 1 15 TYR HB3 1 47 CYS H 3.300 . 5.000 4.176 3.672 4.479 . 0 0 "[ . 1 . 2]" 1
259 1 15 TYR HB3 1 47 CYS HA 6.000 . 6.000 4.858 4.236 5.883 . 0 0 "[ . 1 . 2]" 1
260 1 15 TYR QD 1 46 CYS HA 4.100 . 6.000 4.604 4.082 4.971 . 0 0 "[ . 1 . 2]" 1
261 1 15 TYR QD 1 46 CYS HB2 3.800 . 5.900 4.076 2.765 5.018 . 0 0 "[ . 1 . 2]" 1
262 1 15 TYR QD 1 46 CYS HB3 6.000 . 6.000 3.397 1.745 4.152 . 0 0 "[ . 1 . 2]" 1
263 1 15 TYR QD 1 47 CYS H 3.500 . 5.300 4.004 3.344 4.777 . 0 0 "[ . 1 . 2]" 1
264 1 15 TYR QD 1 47 CYS HA 2.900 . 4.200 3.135 2.340 4.241 0.041 6 0 "[ . 1 . 2]" 1
265 1 15 TYR QD 1 48 LYS H 3.200 . 4.800 3.295 2.678 4.496 . 0 0 "[ . 1 . 2]" 1
266 1 15 TYR QD 1 48 LYS HA 3.100 . 4.600 3.080 1.622 4.590 . 0 0 "[ . 1 . 2]" 1
267 1 15 TYR QD 1 48 LYS QB 6.000 . 6.000 3.177 2.259 4.654 . 0 0 "[ . 1 . 2]" 1
268 1 15 TYR QD 1 48 LYS HB3 6.000 . 6.000 3.983 2.398 5.431 . 0 0 "[ . 1 . 2]" 1
269 1 15 TYR QD 1 48 LYS QG 6.000 . 6.000 3.640 2.496 4.728 . 0 0 "[ . 1 . 2]" 1
270 1 15 TYR QD 1 66 CYS HA 4.300 . 6.000 4.439 3.238 5.582 . 0 0 "[ . 1 . 2]" 1
271 1 15 TYR QD 1 67 VAL H 3.500 . 5.300 4.571 3.510 5.277 . 0 0 "[ . 1 . 2]" 1
272 1 15 TYR QD 1 67 VAL MG1 3.400 . 5.200 4.117 2.557 5.393 0.193 2 0 "[ . 1 . 2]" 1
273 1 15 TYR QD 1 67 VAL MG2 6.000 . 6.000 3.275 2.368 4.510 . 0 0 "[ . 1 . 2]" 1
274 1 15 TYR QE 1 47 CYS H 6.000 . 6.000 5.511 4.648 6.016 0.016 15 0 "[ . 1 . 2]" 1
275 1 15 TYR QE 1 47 CYS HA 3.100 . 4.600 3.390 2.635 4.302 . 0 0 "[ . 1 . 2]" 1
276 1 15 TYR QE 1 48 LYS H 3.300 . 5.000 3.114 2.579 4.348 . 0 0 "[ . 1 . 2]" 1
277 1 15 TYR QE 1 48 LYS HA 4.900 . 6.000 4.187 2.934 5.938 . 0 0 "[ . 1 . 2]" 1
278 1 15 TYR QE 1 48 LYS QB 2.800 . 4.100 2.826 1.745 4.102 0.002 9 0 "[ . 1 . 2]" 1
279 1 15 TYR QE 1 48 LYS HE3 6.000 . 6.000 4.725 2.494 6.014 0.014 7 0 "[ . 1 . 2]" 1
280 1 15 TYR QE 1 48 LYS QG 6.000 . 6.000 3.255 1.998 4.909 . 0 0 "[ . 1 . 2]" 1
281 1 15 TYR QE 1 65 ASN HA 6.000 . 6.000 4.788 3.712 5.556 . 0 0 "[ . 1 . 2]" 1
282 1 15 TYR QE 1 66 CYS H 6.000 . 6.000 5.347 3.998 6.062 0.062 16 0 "[ . 1 . 2]" 1
283 1 15 TYR QE 1 66 CYS HA 3.400 . 5.100 3.663 1.949 4.489 . 0 0 "[ . 1 . 2]" 1
284 1 15 TYR QE 1 67 VAL H 3.300 . 4.900 3.944 2.085 4.796 . 0 0 "[ . 1 . 2]" 1
285 1 15 TYR QE 1 67 VAL HB 6.000 . 6.000 4.978 3.801 5.667 . 0 0 "[ . 1 . 2]" 1
286 1 15 TYR QE 1 67 VAL MG1 2.700 . 3.900 2.966 1.890 4.449 0.549 2 1 "[ + . 1 . 2]" 1
287 1 15 TYR QE 1 67 VAL MG2 3.000 . 4.500 2.978 1.485 4.544 0.044 8 0 "[ . 1 . 2]" 1
288 1 16 LYS H 1 16 LYS QD 6.000 . 6.000 3.966 2.509 4.788 . 0 0 "[ . 1 . 2]" 1
289 1 16 LYS H 1 16 LYS QE 6.000 . 6.000 4.337 3.030 5.702 . 0 0 "[ . 1 . 2]" 1
290 1 16 LYS H 1 16 LYS HG3 4.000 . 6.000 2.914 1.942 3.414 . 0 0 "[ . 1 . 2]" 1
291 1 16 LYS H 1 18 TYR QD 3.300 . 5.000 3.248 2.894 3.593 . 0 0 "[ . 1 . 2]" 1
292 1 16 LYS H 1 18 TYR QE 3.200 . 4.800 3.232 2.762 3.803 . 0 0 "[ . 1 . 2]" 1
293 1 16 LYS H 1 18 TYR QE 3.000 . 4.400 2.990 2.679 3.271 . 0 0 "[ . 1 . 2]" 1
294 1 16 LYS H 1 46 CYS HA 4.200 . 6.000 4.184 3.721 4.772 . 0 0 "[ . 1 . 2]" 1
295 1 16 LYS H 1 47 CYS H 2.700 . 3.900 3.373 2.855 3.830 . 0 0 "[ . 1 . 2]" 1
296 1 16 LYS HA 1 16 LYS QE 6.000 . 6.000 4.795 3.752 5.776 . 0 0 "[ . 1 . 2]" 1
297 1 16 LYS HA 1 17 PRO HD2 6.000 . 6.000 2.338 2.066 2.524 . 0 0 "[ . 1 . 2]" 1
298 1 16 LYS HA 1 17 PRO HD3 2.200 . 3.100 2.449 2.266 2.639 . 0 0 "[ . 1 . 2]" 1
299 1 16 LYS HA 1 18 TYR H 6.000 . 6.000 4.538 4.332 4.742 . 0 0 "[ . 1 . 2]" 1
300 1 16 LYS HA 1 18 TYR QD 6.000 . 6.000 5.126 4.645 5.597 . 0 0 "[ . 1 . 2]" 1
301 1 16 LYS HA 1 18 TYR QE 6.000 . 6.000 5.018 4.596 5.559 . 0 0 "[ . 1 . 2]" 1
302 1 16 LYS HA 1 46 CYS HA 4.700 . 6.000 4.997 4.599 5.827 . 0 0 "[ . 1 . 2]" 1
303 1 16 LYS HA 1 47 CYS H 6.000 . 6.000 5.241 4.862 5.781 . 0 0 "[ . 1 . 2]" 1
304 1 16 LYS QB 1 17 PRO HD2 3.700 . 5.700 2.196 1.700 2.503 0.000 9 0 "[ . 1 . 2]" 1
305 1 16 LYS QB 1 17 PRO HD3 3.300 . 5.000 3.504 3.199 3.806 . 0 0 "[ . 1 . 2]" 1
306 1 16 LYS QB 1 18 TYR QE 4.500 . 6.000 2.824 1.851 4.379 . 0 0 "[ . 1 . 2]" 1
307 1 16 LYS HB2 1 18 TYR QE 3.200 . 4.800 2.933 1.859 5.042 0.242 9 0 "[ . 1 . 2]" 1
308 1 16 LYS QD 1 18 TYR QE 6.000 . 6.000 3.737 2.329 4.605 . 0 0 "[ . 1 . 2]" 1
309 1 16 LYS QE 1 16 LYS HG2 3.400 . 5.200 2.829 1.926 3.368 . 0 0 "[ . 1 . 2]" 1
310 1 16 LYS QE 1 16 LYS HG3 2.400 . 3.400 2.453 1.926 3.293 . 0 0 "[ . 1 . 2]" 1
311 1 16 LYS QE 1 33 VAL QG 6.000 . 6.000 4.079 2.246 5.619 . 0 0 "[ . 1 . 2]" 1
312 1 16 LYS HG2 1 17 PRO HD3 5.300 . 6.000 5.209 4.380 5.749 . 0 0 "[ . 1 . 2]" 1
313 1 16 LYS HG2 1 18 TYR QE 4.100 . 6.000 3.664 2.176 4.843 . 0 0 "[ . 1 . 2]" 1
314 1 16 LYS HG3 1 17 PRO HD2 6.000 . 6.000 4.668 3.632 5.128 . 0 0 "[ . 1 . 2]" 1
315 1 16 LYS HG3 1 17 PRO HD3 6.000 . 6.000 5.719 4.898 6.343 0.343 7 0 "[ . 1 . 2]" 1
316 1 16 LYS HG3 1 33 VAL QG 6.000 . 6.000 3.317 3.148 3.953 . 0 0 "[ . 1 . 2]" 1
317 1 16 LYS HG3 1 18 TYR QD 6.000 . 6.000 4.241 3.382 4.889 . 0 0 "[ . 1 . 2]" 1
318 1 16 LYS HG3 1 49 ASP HB3 6.000 . 6.000 3.048 2.408 3.309 . 0 0 "[ . 1 . 2]" 1
319 1 16 LYS HG3 1 18 TYR QE 2.400 . 3.400 2.799 1.710 3.458 0.058 6 0 "[ . 1 . 2]" 1
320 1 16 LYS HG3 1 47 CYS H 6.000 . 6.000 5.354 4.040 6.025 0.025 16 0 "[ . 1 . 2]" 1
321 1 17 PRO HA 1 17 PRO HD3 4.300 . 6.000 3.531 3.401 3.700 . 0 0 "[ . 1 . 2]" 1
322 1 17 PRO HA 1 17 PRO HG2 3.300 . 5.000 3.854 3.814 3.897 . 0 0 "[ . 1 . 2]" 1
323 1 17 PRO HA 1 17 PRO HG3 4.100 . 6.000 4.013 3.984 4.051 . 0 0 "[ . 1 . 2]" 1
324 1 17 PRO HA 1 18 TYR H 2.100 . 2.900 2.152 2.090 2.187 . 0 0 "[ . 1 . 2]" 1
325 1 17 PRO HA 1 18 TYR HB2 4.300 . 6.000 4.325 4.142 4.519 . 0 0 "[ . 1 . 2]" 1
326 1 17 PRO HA 1 18 TYR QD 3.400 . 5.200 4.441 4.091 4.698 . 0 0 "[ . 1 . 2]" 1
327 1 17 PRO HA 1 18 TYR QE 4.700 . 6.000 6.007 5.859 6.099 0.099 4 0 "[ . 1 . 2]" 1
328 1 17 PRO HA 1 44 VAL QG 4.200 . 6.000 3.555 2.552 4.340 . 0 0 "[ . 1 . 2]" 1
329 1 17 PRO HA 1 45 LYS H 4.100 . 6.000 4.751 4.274 5.164 . 0 0 "[ . 1 . 2]" 1
330 1 17 PRO HA 1 46 CYS HA 3.200 . 4.800 3.212 2.835 3.755 . 0 0 "[ . 1 . 2]" 1
331 1 17 PRO HB2 1 18 TYR H 3.200 . 4.800 3.722 3.522 3.956 . 0 0 "[ . 1 . 2]" 1
332 1 17 PRO HB2 1 34 GLY H 6.000 . 6.000 3.464 2.840 3.902 . 0 0 "[ . 1 . 2]" 1
333 1 17 PRO HB3 1 17 PRO HD3 3.400 . 5.100 2.961 2.874 3.086 . 0 0 "[ . 1 . 2]" 1
334 1 17 PRO HD2 1 17 PRO HG2 2.600 . 3.800 2.312 2.289 2.328 . 0 0 "[ . 1 . 2]" 1
335 1 17 PRO HD2 1 17 PRO HG3 3.000 . 4.400 2.696 2.667 2.738 . 0 0 "[ . 1 . 2]" 1
336 1 17 PRO HD3 1 17 PRO HG3 2.600 . 3.700 2.316 2.291 2.336 . 0 0 "[ . 1 . 2]" 1
337 1 17 PRO HG2 1 18 TYR H 4.800 . 6.000 5.034 4.952 5.105 . 0 0 "[ . 1 . 2]" 1
338 1 17 PRO HG2 1 34 GLY H 4.700 . 6.000 3.173 2.813 3.489 . 0 0 "[ . 1 . 2]" 1
339 1 17 PRO HG2 1 34 GLY HA2 4.300 . 6.000 4.752 4.321 4.950 . 0 0 "[ . 1 . 2]" 1
340 1 17 PRO HG2 1 34 GLY HA3 2.600 . 3.700 3.131 2.572 3.361 . 0 0 "[ . 1 . 2]" 1
341 1 17 PRO HG3 1 18 TYR H 5.800 . 6.000 5.725 5.630 5.799 . 0 0 "[ . 1 . 2]" 1
342 1 17 PRO HG3 1 34 GLY HA3 3.800 . 5.900 3.529 2.772 3.993 . 0 0 "[ . 1 . 2]" 1
343 1 17 PRO HG3 1 33 VAL HA 5.000 . 6.000 4.662 4.550 4.796 . 0 0 "[ . 1 . 2]" 1
344 1 17 PRO HG3 1 33 VAL QG 3.100 . 4.600 3.911 3.280 4.266 . 0 0 "[ . 1 . 2]" 1
345 1 17 PRO HG3 1 34 GLY H 3.500 . 5.400 4.828 4.362 5.181 . 0 0 "[ . 1 . 2]" 1
346 1 17 PRO HG3 1 34 GLY HA2 6.000 . 6.000 5.906 5.209 6.069 0.069 5 0 "[ . 1 . 2]" 1
347 1 18 TYR H 1 18 TYR HA 2.900 . 4.200 2.940 2.928 2.945 . 0 0 "[ . 1 . 2]" 1
348 1 18 TYR H 1 18 TYR HB2 2.300 . 3.300 2.484 2.305 2.615 . 0 0 "[ . 1 . 2]" 1
349 1 18 TYR H 1 18 TYR QD 3.100 . 4.600 3.549 3.176 3.844 . 0 0 "[ . 1 . 2]" 1
350 1 18 TYR H 1 18 TYR QE 6.000 . 6.000 5.495 5.161 5.712 . 0 0 "[ . 1 . 2]" 1
351 1 18 TYR H 1 19 CYS H 3.200 . 4.800 4.307 4.205 4.410 . 0 0 "[ . 1 . 2]" 1
352 1 18 TYR H 1 19 CYS H 2.900 . 4.200 3.051 2.845 3.321 . 0 0 "[ . 1 . 2]" 1
353 1 18 TYR H 1 33 VAL HA 5.800 . 6.000 5.446 5.230 5.917 . 0 0 "[ . 1 . 2]" 1
354 1 18 TYR H 1 34 GLY H 4.600 . 6.000 4.654 4.361 4.948 . 0 0 "[ . 1 . 2]" 1
355 1 18 TYR H 1 44 VAL QG 3.200 . 4.700 3.367 2.905 4.109 . 0 0 "[ . 1 . 2]" 1
356 1 18 TYR H 1 45 LYS QB 4.200 . 6.000 4.080 3.796 4.475 . 0 0 "[ . 1 . 2]" 1
357 1 18 TYR HA 1 18 TYR QD 2.800 . 4.100 2.601 2.261 2.980 . 0 0 "[ . 1 . 2]" 1
358 1 18 TYR HA 1 18 TYR QE 6.000 . 6.000 4.380 4.210 4.536 . 0 0 "[ . 1 . 2]" 1
359 1 18 TYR HA 1 19 CYS H 6.000 . 6.000 2.138 2.102 2.238 . 0 0 "[ . 1 . 2]" 1
360 1 18 TYR HA 1 19 CYS HA 3.300 . 5.000 2.635 2.238 3.311 . 0 0 "[ . 1 . 2]" 1
361 1 18 TYR HA 1 20 CYS H 3.600 . 5.500 3.354 2.804 4.129 . 0 0 "[ . 1 . 2]" 1
362 1 18 TYR HA 1 34 GLY H 2.600 . 3.800 2.869 2.566 3.221 . 0 0 "[ . 1 . 2]" 1
363 1 18 TYR HB2 1 18 TYR QD 2.300 . 3.300 2.309 2.261 2.416 . 0 0 "[ . 1 . 2]" 1
364 1 18 TYR HB2 1 18 TYR QE 3.200 . 4.800 3.803 3.257 4.203 . 0 0 "[ . 1 . 2]" 1
365 1 18 TYR HB2 1 19 CYS H 6.000 . 6.000 4.357 4.125 4.438 . 0 0 "[ . 1 . 2]" 1
366 1 18 TYR HB2 1 19 CYS HA 6.000 . 6.000 4.465 3.957 4.856 . 0 0 "[ . 1 . 2]" 1
367 1 18 TYR HB2 1 20 CYS H 5.200 . 6.000 4.907 4.345 5.434 . 0 0 "[ . 1 . 2]" 1
368 1 18 TYR HB2 1 44 VAL QG 2.700 . 3.900 2.781 2.121 3.602 . 0 0 "[ . 1 . 2]" 1
369 1 18 TYR HB2 1 45 LYS QB 2.900 . 4.200 3.287 2.657 4.112 . 0 0 "[ . 1 . 2]" 1
370 1 18 TYR HB2 1 46 CYS HA 4.200 . 6.000 3.924 3.357 4.472 . 0 0 "[ . 1 . 2]" 1
371 1 18 TYR HB3 1 19 CYS H 2.600 . 3.700 2.248 2.072 2.484 . 0 0 "[ . 1 . 2]" 1
372 1 18 TYR HB3 1 18 TYR QD 2.300 . 3.200 2.531 2.383 2.658 . 0 0 "[ . 1 . 2]" 1
373 1 18 TYR HB3 1 43 SER HB3 4.000 . 6.000 2.832 1.728 4.575 . 0 0 "[ . 1 . 2]" 1
374 1 18 TYR HB3 1 31 CYS HA 6.000 . 6.000 3.384 2.908 3.821 . 0 0 "[ . 1 . 2]" 1
375 1 18 TYR HB3 1 31 CYS HA 6.000 . 6.000 3.310 2.880 3.697 . 0 0 "[ . 1 . 2]" 1
376 1 18 TYR HB3 1 61 ILE MD 4.600 . 6.000 3.681 2.948 4.662 . 0 0 "[ . 1 . 2]" 1
377 1 18 TYR HB3 1 45 LYS QB 3.300 . 4.900 3.961 3.003 4.954 0.054 3 0 "[ . 1 . 2]" 1
378 1 18 TYR HB3 1 45 LYS HG3 6.000 . 6.000 5.471 4.183 6.046 0.046 19 0 "[ . 1 . 2]" 1
379 1 18 TYR QD 1 19 CYS H 3.300 . 5.000 3.462 2.806 3.863 . 0 0 "[ . 1 . 2]" 1
380 1 18 TYR QD 1 19 CYS QB 6.000 . 6.000 4.576 4.243 4.786 . 0 0 "[ . 1 . 2]" 1
381 1 18 TYR QD 1 31 CYS HA 3.800 . 5.900 4.109 3.868 4.441 . 0 0 "[ . 1 . 2]" 1
382 1 18 TYR QD 1 31 CYS HB2 6.000 . 6.000 3.442 2.557 4.533 . 0 0 "[ . 1 . 2]" 1
383 1 18 TYR QD 1 31 CYS HB3 2.600 . 3.700 2.796 1.978 3.524 . 0 0 "[ . 1 . 2]" 1
384 1 18 TYR QD 1 32 VAL H 3.400 . 5.200 3.868 3.274 4.319 . 0 0 "[ . 1 . 2]" 1
385 1 18 TYR QD 1 33 VAL HA 2.400 . 3.400 2.976 2.450 3.423 0.023 1 0 "[ . 1 . 2]" 1
386 1 18 TYR QD 1 33 VAL HB 5.100 . 6.000 5.054 3.688 5.788 . 0 0 "[ . 1 . 2]" 1
387 1 18 TYR QD 1 33 VAL QG 6.000 . 6.000 3.675 3.093 4.256 . 0 0 "[ . 1 . 2]" 1
388 1 18 TYR QD 1 34 GLY H 4.000 . 6.000 4.308 3.889 4.687 . 0 0 "[ . 1 . 2]" 1
389 1 18 TYR QD 1 45 LYS QB 6.000 . 6.000 4.653 4.093 5.365 . 0 0 "[ . 1 . 2]" 1
390 1 18 TYR QD 1 46 CYS HA 3.400 . 5.200 3.713 3.137 4.117 . 0 0 "[ . 1 . 2]" 1
391 1 18 TYR QD 1 47 CYS H 2.700 . 3.900 2.106 1.705 2.522 . 0 0 "[ . 1 . 2]" 1
392 1 18 TYR QD 1 47 CYS HB2 3.000 . 4.400 2.444 1.966 3.016 . 0 0 "[ . 1 . 2]" 1
393 1 18 TYR QD 1 59 LEU HB2 6.000 . 6.000 4.073 3.271 4.876 . 0 0 "[ . 1 . 2]" 1
394 1 18 TYR QD 1 59 LEU HB3 6.000 . 6.000 4.424 3.963 5.034 . 0 0 "[ . 1 . 2]" 1
395 1 18 TYR QD 1 59 LEU MD1 6.000 . 6.000 4.299 3.201 6.074 0.074 12 0 "[ . 1 . 2]" 1
396 1 18 TYR QD 1 59 LEU MD2 6.000 . 6.000 4.749 4.022 6.017 0.017 15 0 "[ . 1 . 2]" 1
397 1 18 TYR QD 1 61 ILE MD 2.900 . 4.300 3.267 2.804 3.953 . 0 0 "[ . 1 . 2]" 1
398 1 18 TYR QD 1 61 ILE MG 6.000 . 6.000 5.235 4.633 5.703 . 0 0 "[ . 1 . 2]" 1
399 1 18 TYR QE 1 19 CYS H 6.000 . 6.000 5.549 5.064 5.797 . 0 0 "[ . 1 . 2]" 1
400 1 18 TYR QE 1 30 GLY HA3 6.000 . 6.000 4.446 3.060 6.049 0.049 10 0 "[ . 1 . 2]" 1
401 1 18 TYR QE 1 31 CYS HA 4.900 . 6.000 6.018 5.775 6.097 0.097 13 0 "[ . 1 . 2]" 1
402 1 18 TYR QE 1 31 CYS HA 6.000 . 6.000 4.890 4.492 5.369 . 0 0 "[ . 1 . 2]" 1
403 1 18 TYR QE 1 31 CYS HB3 5.100 . 6.000 4.566 3.750 5.571 . 0 0 "[ . 1 . 2]" 1
404 1 18 TYR QE 1 33 VAL HA 2.900 . 4.300 3.355 3.046 4.032 . 0 0 "[ . 1 . 2]" 1
405 1 18 TYR QE 1 33 VAL HB 4.000 . 6.000 4.364 2.549 5.482 . 0 0 "[ . 1 . 2]" 1
406 1 18 TYR QE 1 33 VAL QG 2.900 . 4.200 2.762 1.926 3.807 . 0 0 "[ . 1 . 2]" 1
407 1 18 TYR QE 1 34 GLY H 6.000 . 6.000 5.125 4.654 5.715 . 0 0 "[ . 1 . 2]" 1
408 1 18 TYR QE 1 34 GLY HA3 6.000 . 6.000 4.459 2.762 5.678 . 0 0 "[ . 1 . 2]" 1
409 1 18 TYR QE 1 46 CYS HA 5.000 . 6.000 5.517 5.040 5.902 . 0 0 "[ . 1 . 2]" 1
410 1 18 TYR QE 1 47 CYS H 3.000 . 4.400 3.827 3.266 4.354 . 0 0 "[ . 1 . 2]" 1
411 1 18 TYR QE 1 47 CYS HB2 2.800 . 4.100 3.536 2.522 4.458 0.358 15 0 "[ . 1 . 2]" 1
412 1 18 TYR QE 1 48 LYS HA 3.600 . 5.500 4.063 2.188 5.243 . 0 0 "[ . 1 . 2]" 1
413 1 18 TYR QE 1 49 ASP H 6.000 . 6.000 4.221 3.280 5.392 . 0 0 "[ . 1 . 2]" 1
414 1 18 TYR QE 1 59 LEU HB2 6.000 . 6.000 3.108 2.145 3.968 . 0 0 "[ . 1 . 2]" 1
415 1 18 TYR QE 1 59 LEU HB3 6.000 . 6.000 3.620 2.821 4.504 . 0 0 "[ . 1 . 2]" 1
416 1 18 TYR QE 1 59 LEU MD1 6.000 . 6.000 2.683 1.723 4.843 . 0 0 "[ . 1 . 2]" 1
417 1 18 TYR QE 1 59 LEU MD2 3.200 . 4.800 3.422 2.284 5.089 0.289 15 0 "[ . 1 . 2]" 1
418 1 18 TYR QE 1 61 ILE MD 2.900 . 4.300 3.255 2.888 4.087 . 0 0 "[ . 1 . 2]" 1
419 1 18 TYR QE 1 61 ILE MG 6.000 . 6.000 5.375 4.331 6.077 0.077 11 0 "[ . 1 . 2]" 1
420 1 19 CYS H 1 20 CYS HB3 6.000 . 6.000 3.939 3.409 4.582 . 0 0 "[ . 1 . 2]" 1
421 1 19 CYS H 1 19 CYS HA 2.800 . 4.100 2.913 2.888 2.948 . 0 0 "[ . 1 . 2]" 1
422 1 19 CYS H 1 20 CYS H 3.300 . 5.000 4.016 3.763 4.211 . 0 0 "[ . 1 . 2]" 1
423 1 19 CYS H 1 20 CYS H 3.400 . 5.200 3.192 2.936 3.486 . 0 0 "[ . 1 . 2]" 1
424 1 19 CYS H 1 20 CYS HA 6.000 . 6.000 4.920 4.628 5.043 . 0 0 "[ . 1 . 2]" 1
425 1 19 CYS H 1 31 CYS HA 6.000 . 6.000 3.973 3.740 4.166 . 0 0 "[ . 1 . 2]" 1
426 1 19 CYS H 1 31 CYS HB2 6.000 . 6.000 4.525 3.983 5.345 . 0 0 "[ . 1 . 2]" 1
427 1 19 CYS H 1 32 VAL H 2.700 . 3.900 3.243 2.388 3.629 . 0 0 "[ . 1 . 2]" 1
428 1 19 CYS H 1 32 VAL HB 6.000 . 6.000 4.528 3.807 5.055 . 0 0 "[ . 1 . 2]" 1
429 1 19 CYS H 1 32 VAL MG2 4.100 . 6.000 3.419 2.701 4.470 . 0 0 "[ . 1 . 2]" 1
430 1 19 CYS H 1 32 VAL MG2 4.300 . 6.000 3.321 2.690 4.072 . 0 0 "[ . 1 . 2]" 1
431 1 19 CYS H 1 34 GLY H 4.900 . 6.000 3.812 3.392 4.244 . 0 0 "[ . 1 . 2]" 1
432 1 19 CYS H 1 34 GLY HA2 6.000 . 6.000 4.047 3.548 4.579 . 0 0 "[ . 1 . 2]" 1
433 1 19 CYS HA 1 20 CYS H 2.200 . 3.100 2.239 2.152 2.346 . 0 0 "[ . 1 . 2]" 1
434 1 19 CYS HA 1 20 CYS HB2 6.000 . 6.000 4.526 4.263 4.766 . 0 0 "[ . 1 . 2]" 1
435 1 19 CYS HA 1 20 CYS HB3 5.200 . 6.000 5.661 5.101 5.813 . 0 0 "[ . 1 . 2]" 1
436 1 19 CYS HA 1 32 VAL H 5.000 . 6.000 4.741 4.183 5.074 . 0 0 "[ . 1 . 2]" 1
437 1 19 CYS HA 1 40 CYS HB2 5.200 . 6.000 4.888 4.063 5.723 . 0 0 "[ . 1 . 2]" 1
438 1 19 CYS HA 1 40 CYS HB3 4.000 . 6.000 4.609 3.472 5.109 . 0 0 "[ . 1 . 2]" 1
439 1 19 CYS HA 1 44 VAL QG 6.000 . 6.000 3.442 2.798 4.066 . 0 0 "[ . 1 . 2]" 1
440 1 19 CYS QB 1 20 CYS H 4.600 . 6.000 3.839 3.596 4.005 . 0 0 "[ . 1 . 2]" 1
441 1 19 CYS QB 1 20 CYS H 2.500 . 3.600 2.329 2.062 2.573 . 0 0 "[ . 1 . 2]" 1
442 1 19 CYS QB 1 43 SER QB 4.100 . 6.000 2.823 1.728 4.501 . 0 0 "[ . 1 . 2]" 1
443 1 19 CYS QB 1 32 VAL H 6.000 . 6.000 3.202 2.667 3.744 . 0 0 "[ . 1 . 2]" 1
444 1 19 CYS QB 1 32 VAL HB 4.300 . 6.000 3.917 2.818 4.721 . 0 0 "[ . 1 . 2]" 1
445 1 19 CYS QB 1 32 VAL MG1 6.000 . 6.000 4.484 4.102 4.920 . 0 0 "[ . 1 . 2]" 1
446 1 19 CYS QB 1 32 VAL MG2 3.000 . 4.400 2.261 1.688 3.040 0.012 9 0 "[ . 1 . 2]" 1
447 1 19 CYS QB 1 40 CYS HA 6.000 . 6.000 4.291 3.685 5.166 . 0 0 "[ . 1 . 2]" 1
448 1 19 CYS QB 1 41 GLY H 6.000 . 6.000 4.813 3.679 5.506 . 0 0 "[ . 1 . 2]" 1
449 1 20 CYS H 1 20 CYS HA 3.000 . 4.500 2.871 2.825 2.930 . 0 0 "[ . 1 . 2]" 1
450 1 20 CYS H 1 20 CYS HB3 3.500 . 5.300 3.484 2.953 3.630 . 0 0 "[ . 1 . 2]" 1
451 1 20 CYS H 1 21 GLN H 5.100 . 6.000 4.319 3.898 4.485 . 0 0 "[ . 1 . 2]" 1
452 1 20 CYS H 1 31 CYS H 5.100 . 6.000 6.093 6.034 6.240 0.240 13 0 "[ . 1 . 2]" 1
453 1 20 CYS H 1 42 ALA H 6.000 . 6.000 6.025 5.648 6.126 0.126 15 0 "[ . 1 . 2]" 1
454 1 20 CYS H 1 42 ALA MB 3.600 . 5.500 3.936 3.166 4.923 . 0 0 "[ . 1 . 2]" 1
455 1 20 CYS H 1 43 SER H 3.100 . 4.600 4.125 3.502 4.616 0.016 4 0 "[ . 1 . 2]" 1
456 1 20 CYS H 1 43 SER QB 3.300 . 4.900 3.728 3.035 4.784 . 0 0 "[ . 1 . 2]" 1
457 1 20 CYS H 1 44 VAL QG 5.400 . 6.000 4.459 4.019 5.099 . 0 0 "[ . 1 . 2]" 1
458 1 20 CYS H 1 45 LYS HG2 6.000 . 6.000 4.110 3.125 5.365 . 0 0 "[ . 1 . 2]" 1
459 1 20 CYS H 1 45 LYS HG3 6.000 . 6.000 4.121 3.043 4.981 . 0 0 "[ . 1 . 2]" 1
460 1 20 CYS HA 1 21 GLN H 2.300 . 3.300 2.150 2.104 2.364 . 0 0 "[ . 1 . 2]" 1
461 1 20 CYS HA 1 21 GLN HA 4.300 . 6.000 4.395 4.346 4.500 . 0 0 "[ . 1 . 2]" 1
462 1 20 CYS HA 1 21 GLN QG 4.400 . 6.000 4.341 3.128 5.794 . 0 0 "[ . 1 . 2]" 1
463 1 20 CYS HA 1 29 LEU MD2 6.000 . 6.000 5.060 2.757 6.036 0.036 15 0 "[ . 1 . 2]" 1
464 1 20 CYS HA 1 31 CYS HB2 6.000 . 6.000 4.051 3.394 4.352 . 0 0 "[ . 1 . 2]" 1
465 1 20 CYS HA 1 32 VAL H 3.600 . 5.600 3.583 3.253 4.410 . 0 0 "[ . 1 . 2]" 1
466 1 20 CYS HA 1 42 ALA MB 6.000 . 6.000 4.594 4.109 5.149 . 0 0 "[ . 1 . 2]" 1
467 1 20 CYS HB2 1 21 GLN H 6.000 . 6.000 4.427 4.137 4.602 . 0 0 "[ . 1 . 2]" 1
468 1 20 CYS HB2 1 29 LEU MD1 6.000 . 6.000 3.783 3.220 4.392 . 0 0 "[ . 1 . 2]" 1
469 1 20 CYS HB2 1 29 LEU MD2 2.500 . 3.600 2.753 1.848 3.763 0.163 19 0 "[ . 1 . 2]" 1
470 1 20 CYS HB3 1 21 GLN H 6.000 . 6.000 3.731 3.395 4.197 . 0 0 "[ . 1 . 2]" 1
471 1 20 CYS HB3 1 23 MET H 3.900 . 6.000 4.499 3.793 5.376 . 0 0 "[ . 1 . 2]" 1
472 1 20 CYS HB3 1 29 LEU MD1 6.000 . 6.000 3.049 1.982 3.813 . 0 0 "[ . 1 . 2]" 1
473 1 20 CYS HB3 1 45 LYS H 6.000 . 6.000 5.827 5.329 6.565 0.565 10 1 "[ . + . 2]" 1
474 1 21 GLN H 1 21 GLN HB2 3.000 . 4.500 2.483 2.075 3.681 . 0 0 "[ . 1 . 2]" 1
475 1 21 GLN H 1 21 GLN HB3 3.900 . 6.000 3.465 2.356 3.741 . 0 0 "[ . 1 . 2]" 1
476 1 21 GLN H 1 21 GLN QG 3.100 . 4.600 2.841 1.943 3.955 . 0 0 "[ . 1 . 2]" 1
477 1 21 GLN H 1 22 SER H 6.000 . 6.000 4.015 1.796 4.613 . 0 0 "[ . 1 . 2]" 1
478 1 21 GLN H 1 23 MET H 2.900 . 4.300 3.634 3.054 4.348 0.048 7 0 "[ . 1 . 2]" 1
479 1 21 GLN H 1 29 LEU MD1 6.000 . 6.000 5.574 3.893 6.083 0.083 7 0 "[ . 1 . 2]" 1
480 1 21 GLN H 1 29 LEU MD2 4.100 . 6.000 5.552 3.900 6.053 0.053 10 0 "[ . 1 . 2]" 1
481 1 21 GLN H 1 30 GLY HA2 4.200 . 6.000 4.745 4.294 5.887 . 0 0 "[ . 1 . 2]" 1
482 1 21 GLN H 1 31 CYS HA 3.400 . 5.100 3.225 2.548 3.634 . 0 0 "[ . 1 . 2]" 1
483 1 21 GLN H 1 32 VAL H 6.000 . 6.000 4.145 3.581 4.900 . 0 0 "[ . 1 . 2]" 1
484 1 21 GLN H 1 42 ALA MB 3.300 . 5.000 4.063 3.445 4.755 . 0 0 "[ . 1 . 2]" 1
485 1 21 GLN HA 1 21 GLN HB3 2.900 . 4.200 2.590 2.285 3.018 . 0 0 "[ . 1 . 2]" 1
486 1 21 GLN HA 1 22 SER H 6.000 . 6.000 2.446 2.123 3.548 . 0 0 "[ . 1 . 2]" 1
487 1 21 GLN HA 1 42 ALA MB 6.000 . 6.000 2.370 1.817 3.122 . 0 0 "[ . 1 . 2]" 1
488 1 21 GLN HB2 1 21 GLN QG 2.500 . 3.600 2.227 2.130 2.510 . 0 0 "[ . 1 . 2]" 1
489 1 21 GLN HB2 1 22 SER H 6.000 . 6.000 3.947 2.307 4.622 . 0 0 "[ . 1 . 2]" 1
490 1 21 GLN HB2 1 22 SER H 2.900 . 4.200 2.171 1.544 2.702 0.056 11 0 "[ . 1 . 2]" 1
491 1 21 GLN HB2 1 42 ALA MB 6.000 . 6.000 4.321 2.568 5.086 . 0 0 "[ . 1 . 2]" 1
492 1 21 GLN HB3 1 21 GLN QG 2.500 . 3.600 2.389 2.151 2.518 . 0 0 "[ . 1 . 2]" 1
493 1 21 GLN HB3 1 22 SER H 3.200 . 4.800 3.528 2.100 4.432 . 0 0 "[ . 1 . 2]" 1
494 1 21 GLN HB3 1 42 ALA MB 3.100 . 4.600 4.010 1.993 4.885 0.285 2 0 "[ . 1 . 2]" 1
495 1 21 GLN HE21 1 42 ALA MB 4.000 . 6.000 4.410 2.948 5.782 . 0 0 "[ . 1 . 2]" 1
496 1 21 GLN HE22 1 42 ALA MB 6.000 . 6.000 4.570 2.603 5.963 . 0 0 "[ . 1 . 2]" 1
497 1 21 GLN QG 1 22 SER H 4.600 . 6.000 4.137 3.257 4.733 . 0 0 "[ . 1 . 2]" 1
498 1 21 GLN QG 1 31 CYS HA 4.800 . 6.000 4.953 3.758 6.203 0.203 4 0 "[ . 1 . 2]" 1
499 1 21 GLN QG 1 42 ALA MB 3.300 . 5.000 2.945 1.720 4.001 . 0 0 "[ . 1 . 2]" 1
500 1 21 GLN HG2 1 42 ALA MB 2.800 . 4.100 3.206 1.950 4.161 0.061 11 0 "[ . 1 . 2]" 1
501 1 22 SER H 1 22 SER HB2 2.600 . 3.800 2.490 2.111 2.709 . 0 0 "[ . 1 . 2]" 1
502 1 22 SER H 1 42 ALA MB 5.100 . 6.000 3.590 2.575 5.803 . 0 0 "[ . 1 . 2]" 1
503 1 22 SER HA 1 23 MET H 6.000 . 6.000 2.482 2.129 3.479 . 0 0 "[ . 1 . 2]" 1
504 1 22 SER HA 1 23 MET QB 4.800 . 6.000 3.915 3.752 4.166 . 0 0 "[ . 1 . 2]" 1
505 1 22 SER HA 1 23 MET ME 3.000 . 4.400 3.855 2.624 4.454 0.054 7 0 "[ . 1 . 2]" 1
506 1 22 SER HA 1 23 MET QG 5.200 . 6.000 4.531 3.490 5.550 . 0 0 "[ . 1 . 2]" 1
507 1 22 SER QB 1 23 MET H 6.000 . 6.000 2.978 1.519 3.882 . 0 0 "[ . 1 . 2]" 1
508 1 22 SER QB 1 23 MET ME 6.000 . 6.000 4.455 2.346 5.275 . 0 0 "[ . 1 . 2]" 1
509 1 23 MET H 1 23 MET ME 6.000 . 6.000 3.343 2.559 5.209 . 0 0 "[ . 1 . 2]" 1
510 1 23 MET H 1 23 MET QG 3.000 . 4.400 3.204 1.563 4.058 0.037 14 0 "[ . 1 . 2]" 1
511 1 23 MET HA 1 23 MET ME 6.000 . 6.000 3.943 2.622 5.231 . 0 0 "[ . 1 . 2]" 1
512 1 23 MET HA 1 24 SER H 6.000 . 6.000 2.724 2.146 3.551 . 0 0 "[ . 1 . 2]" 1
513 1 23 MET QB 1 24 SER H 6.000 . 6.000 2.859 1.581 3.898 . 0 0 "[ . 1 . 2]" 1
514 1 23 MET QB 1 26 SER HB2 6.000 . 6.000 4.597 2.219 6.172 0.172 9 0 "[ . 1 . 2]" 1
515 1 23 MET ME 1 24 SER H 6.000 . 6.000 5.136 4.251 6.024 0.024 13 0 "[ . 1 . 2]" 1
516 1 23 MET QG 1 24 SER H 6.000 . 6.000 3.726 2.453 4.645 . 0 0 "[ . 1 . 2]" 1
517 1 24 SER H 1 24 SER HA 2.600 . 3.700 2.792 2.255 2.937 . 0 0 "[ . 1 . 2]" 1
518 1 24 SER H 1 25 GLY H 6.000 . 6.000 3.210 2.363 4.415 . 0 0 "[ . 1 . 2]" 1
519 1 24 SER HA 1 25 GLY H 6.000 . 6.000 3.018 2.144 3.589 . 0 0 "[ . 1 . 2]" 1
520 1 24 SER HA 1 25 GLY H 2.900 . 4.200 2.518 2.092 2.815 . 0 0 "[ . 1 . 2]" 1
521 1 24 SER HA 1 26 SER H 4.500 . 6.000 4.624 3.692 5.751 . 0 0 "[ . 1 . 2]" 1
522 1 24 SER QB 1 25 GLY H 6.000 . 6.000 3.016 1.671 3.927 . 0 0 "[ . 1 . 2]" 1
523 1 24 SER QB 1 26 SER H 6.000 . 6.000 4.754 3.597 5.703 . 0 0 "[ . 1 . 2]" 1
524 1 25 GLY H 1 25 GLY HA2 2.400 . 3.400 2.707 2.302 2.961 . 0 0 "[ . 1 . 2]" 1
525 1 25 GLY H 1 25 GLY HA3 2.900 . 4.300 2.656 2.329 2.959 . 0 0 "[ . 1 . 2]" 1
526 1 25 GLY H 1 26 SER H 2.800 . 4.100 2.984 1.809 4.129 0.029 15 0 "[ . 1 . 2]" 1
527 1 25 GLY HA2 1 26 SER H 6.000 . 6.000 3.005 2.220 3.562 . 0 0 "[ . 1 . 2]" 1
528 1 25 GLY HA3 1 26 SER H 4.300 . 6.000 3.151 2.161 3.570 . 0 0 "[ . 1 . 2]" 1
529 1 26 SER H 1 26 SER HA 2.800 . 4.100 2.831 2.258 2.944 . 0 0 "[ . 1 . 2]" 1
530 1 26 SER H 1 26 SER HB2 3.300 . 5.000 3.032 2.620 3.755 . 0 0 "[ . 1 . 2]" 1
531 1 26 SER H 1 26 SER HB3 3.600 . 5.500 3.728 3.284 4.112 . 0 0 "[ . 1 . 2]" 1
532 1 26 SER H 1 27 ALA H 3.400 . 5.100 4.106 2.170 4.624 . 0 0 "[ . 1 . 2]" 1
533 1 26 SER HA 1 27 ALA H 2.500 . 3.600 2.449 2.136 3.540 . 0 0 "[ . 1 . 2]" 1
534 1 26 SER HB2 1 27 ALA H 3.300 . 4.900 3.559 2.521 4.463 . 0 0 "[ . 1 . 2]" 1
535 1 26 SER HB2 1 28 SER H 5.700 . 6.000 4.074 2.099 6.015 0.015 4 0 "[ . 1 . 2]" 1
536 1 26 SER HB3 1 27 ALA H 6.000 . 6.000 3.302 1.958 4.206 . 0 0 "[ . 1 . 2]" 1
537 1 27 ALA H 1 28 SER H 2.700 . 3.900 2.673 2.262 4.203 0.303 20 0 "[ . 1 . 2]" 1
538 1 27 ALA MB 1 28 SER H 3.200 . 4.800 2.835 1.688 3.715 . 0 0 "[ . 1 . 2]" 1
539 1 28 SER H 1 29 LEU H 4.500 . 6.000 4.352 3.382 4.619 . 0 0 "[ . 1 . 2]" 1
540 1 28 SER HA 1 29 LEU H 6.000 . 6.000 2.225 2.140 2.529 . 0 0 "[ . 1 . 2]" 1
541 1 28 SER HB2 1 29 LEU H 6.000 . 6.000 3.720 2.640 4.444 . 0 0 "[ . 1 . 2]" 1
542 1 28 SER HB2 1 29 LEU MD1 6.000 . 6.000 4.329 1.588 5.718 . 0 0 "[ . 1 . 2]" 1
543 1 28 SER HB2 1 29 LEU MD1 6.000 . 6.000 2.424 1.587 3.489 . 0 0 "[ . 1 . 2]" 1
544 1 28 SER HB2 1 60 ILE HG12 6.000 . 6.000 4.672 2.352 6.632 0.632 9 1 "[ . +1 . 2]" 1
545 1 28 SER HB3 1 29 LEU H 6.000 . 6.000 3.519 2.835 4.020 . 0 0 "[ . 1 . 2]" 1
546 1 28 SER HB3 1 29 LEU MD1 6.000 . 6.000 4.348 2.519 5.301 . 0 0 "[ . 1 . 2]" 1
547 1 28 SER HB3 1 60 ILE MD 6.000 . 6.000 2.530 1.943 3.025 . 0 0 "[ . 1 . 2]" 1
548 1 28 SER HB3 1 60 ILE HG12 6.000 . 6.000 4.969 3.078 6.106 0.106 9 0 "[ . 1 . 2]" 1
549 1 29 LEU H 1 29 LEU QB 2.500 . 3.600 2.663 2.065 3.104 . 0 0 "[ . 1 . 2]" 1
550 1 29 LEU H 1 29 LEU MD2 3.500 . 5.300 3.429 2.621 4.258 . 0 0 "[ . 1 . 2]" 1
551 1 29 LEU H 1 29 LEU HG 3.300 . 5.000 2.487 1.518 4.190 0.082 4 0 "[ . 1 . 2]" 1
552 1 29 LEU H 1 30 GLY H 6.000 . 6.000 4.404 3.899 4.590 . 0 0 "[ . 1 . 2]" 1
553 1 29 LEU H 1 63 ALA HA 6.000 . 6.000 5.208 4.435 6.095 0.095 13 0 "[ . 1 . 2]" 1
554 1 29 LEU HA 1 29 LEU HG 3.000 . 4.400 3.215 2.474 3.657 . 0 0 "[ . 1 . 2]" 1
555 1 29 LEU HA 1 30 GLY H 6.000 . 6.000 2.211 2.122 2.424 . 0 0 "[ . 1 . 2]" 1
556 1 29 LEU QB 1 30 GLY H 6.000 . 6.000 3.206 2.545 3.904 . 0 0 "[ . 1 . 2]" 1
557 1 29 LEU QB 1 61 ILE H 6.000 . 6.000 3.895 2.851 4.543 . 0 0 "[ . 1 . 2]" 1
558 1 29 LEU MD1 1 30 GLY H 6.000 . 6.000 4.654 3.317 5.342 . 0 0 "[ . 1 . 2]" 1
559 1 29 LEU MD1 1 30 GLY HA2 3.600 . 5.500 5.506 4.834 6.295 0.795 2 3 "[ + .* 1 . -]" 1
560 1 29 LEU MD1 1 31 CYS HB2 3.100 . 4.600 4.303 3.023 4.711 0.111 6 0 "[ . 1 . 2]" 1
561 1 29 LEU MD1 1 63 ALA HA 6.000 . 6.000 2.792 1.833 5.575 . 0 0 "[ . 1 . 2]" 1
562 1 29 LEU MD1 1 63 ALA MB 6.000 . 6.000 3.234 2.247 5.859 . 0 0 "[ . 1 . 2]" 1
563 1 29 LEU MD1 1 66 CYS HB3 6.000 . 6.000 4.890 3.639 6.494 0.494 13 0 "[ . 1 . 2]" 1
564 1 29 LEU MD2 1 30 GLY H 6.000 . 6.000 4.302 2.797 5.000 . 0 0 "[ . 1 . 2]" 1
565 1 29 LEU HG 1 30 GLY H 6.000 . 6.000 5.100 4.282 5.754 . 0 0 "[ . 1 . 2]" 1
566 1 29 LEU HG 1 61 ILE MD 6.000 . 6.000 4.314 2.082 5.388 . 0 0 "[ . 1 . 2]" 1
567 1 29 LEU HG 1 63 ALA H 6.000 . 6.000 4.164 3.057 5.709 . 0 0 "[ . 1 . 2]" 1
568 1 29 LEU HG 1 63 ALA HA 2.900 . 4.200 3.978 3.008 4.280 0.080 17 0 "[ . 1 . 2]" 1
569 1 30 GLY H 1 30 GLY HA2 2.700 . 3.900 2.897 2.866 2.946 . 0 0 "[ . 1 . 2]" 1
570 1 30 GLY H 1 31 CYS H 3.700 . 5.700 3.871 3.120 4.219 . 0 0 "[ . 1 . 2]" 1
571 1 30 GLY HA2 1 31 CYS H 2.900 . 4.300 2.360 2.183 2.707 . 0 0 "[ . 1 . 2]" 1
572 1 30 GLY HA3 1 31 CYS H 6.000 . 6.000 3.508 3.405 3.550 . 0 0 "[ . 1 . 2]" 1
573 1 30 GLY HA3 1 31 CYS HA 6.000 . 6.000 4.643 4.559 4.718 . 0 0 "[ . 1 . 2]" 1
574 1 31 CYS H 1 31 CYS HB2 3.100 . 4.600 2.456 2.086 2.944 . 0 0 "[ . 1 . 2]" 1
575 1 31 CYS H 1 32 VAL H 6.000 . 6.000 4.289 4.090 4.544 . 0 0 "[ . 1 . 2]" 1
576 1 31 CYS H 1 59 LEU H 3.600 . 5.500 4.482 3.191 5.437 . 0 0 "[ . 1 . 2]" 1
577 1 31 CYS HA 1 32 VAL H 2.200 . 3.100 2.181 2.121 2.267 . 0 0 "[ . 1 . 2]" 1
578 1 31 CYS HA 1 32 VAL MG1 4.200 . 6.000 4.001 3.391 4.765 . 0 0 "[ . 1 . 2]" 1
579 1 31 CYS HA 1 32 VAL MG2 4.800 . 6.000 3.497 3.211 3.833 . 0 0 "[ . 1 . 2]" 1
580 1 31 CYS HA 1 61 ILE H 6.000 . 6.000 5.731 5.337 6.056 0.056 14 0 "[ . 1 . 2]" 1
581 1 31 CYS HB2 1 32 VAL H 6.000 . 6.000 4.371 4.106 4.654 . 0 0 "[ . 1 . 2]" 1
582 1 31 CYS HB2 1 59 LEU H 6.000 . 6.000 5.043 3.950 6.057 0.057 5 0 "[ . 1 . 2]" 1
583 1 31 CYS HB2 1 59 LEU QB 3.100 . 4.600 3.163 2.684 3.776 . 0 0 "[ . 1 . 2]" 1
584 1 31 CYS HB2 1 59 LEU HB3 6.000 . 6.000 3.288 2.694 3.873 . 0 0 "[ . 1 . 2]" 1
585 1 31 CYS HB2 1 61 ILE MD 2.700 . 3.900 2.436 1.602 3.370 . 0 0 "[ . 1 . 2]" 1
586 1 31 CYS HB2 1 61 ILE HG12 6.000 . 6.000 4.060 2.033 5.622 . 0 0 "[ . 1 . 2]" 1
587 1 31 CYS HB2 1 61 ILE HG13 3.200 . 4.800 3.354 2.220 4.836 0.036 7 0 "[ . 1 . 2]" 1
588 1 31 CYS HB3 1 32 VAL H 6.000 . 6.000 3.759 3.109 4.148 . 0 0 "[ . 1 . 2]" 1
589 1 31 CYS HB3 1 61 ILE MD 3.400 . 5.100 3.157 2.075 4.478 . 0 0 "[ . 1 . 2]" 1
590 1 32 VAL H 1 32 VAL HB 3.300 . 5.000 3.435 2.980 3.707 . 0 0 "[ . 1 . 2]" 1
591 1 32 VAL H 1 32 VAL MG1 2.700 . 3.900 3.194 2.261 3.840 . 0 0 "[ . 1 . 2]" 1
592 1 32 VAL H 1 32 VAL MG2 2.900 . 4.200 1.850 1.589 2.181 0.011 12 0 "[ . 1 . 2]" 1
593 1 32 VAL H 1 33 VAL H 6.000 . 6.000 4.567 4.461 4.623 . 0 0 "[ . 1 . 2]" 1
594 1 32 VAL HA 1 33 VAL H 6.000 . 6.000 2.332 2.228 2.477 . 0 0 "[ . 1 . 2]" 1
595 1 32 VAL HB 1 32 VAL MG1 2.200 . 3.100 2.108 2.084 2.128 . 0 0 "[ . 1 . 2]" 1
596 1 32 VAL HB 1 32 VAL MG2 2.300 . 3.200 2.109 2.080 2.132 . 0 0 "[ . 1 . 2]" 1
597 1 32 VAL HB 1 33 VAL H 2.600 . 3.700 2.887 2.371 3.487 . 0 0 "[ . 1 . 2]" 1
598 1 32 VAL MG1 1 33 VAL H 6.000 . 6.000 3.116 2.420 3.786 . 0 0 "[ . 1 . 2]" 1
599 1 32 VAL MG1 1 59 LEU H 3.300 . 5.000 3.371 1.846 4.657 . 0 0 "[ . 1 . 2]" 1
600 1 32 VAL MG2 1 33 VAL H 6.000 . 6.000 3.994 3.320 4.316 . 0 0 "[ . 1 . 2]" 1
601 1 32 VAL MG2 1 33 VAL H 2.700 . 3.900 2.113 1.713 2.548 . 0 0 "[ . 1 . 2]" 1
602 1 33 VAL H 1 33 VAL HA 2.400 . 3.400 2.502 2.477 2.518 . 0 0 "[ . 1 . 2]" 1
603 1 33 VAL H 1 33 VAL HB 2.500 . 3.600 2.534 2.216 2.792 . 0 0 "[ . 1 . 2]" 1
604 1 33 VAL H 1 33 VAL QG 3.200 . 4.800 2.074 1.711 2.409 . 0 0 "[ . 1 . 2]" 1
605 1 33 VAL H 1 34 GLY H 5.500 . 6.000 4.558 4.501 4.596 . 0 0 "[ . 1 . 2]" 1
606 1 33 VAL HA 1 33 VAL HB 3.000 . 4.400 2.832 2.373 3.027 . 0 0 "[ . 1 . 2]" 1
607 1 33 VAL HA 1 34 GLY H 2.100 . 3.000 2.153 2.131 2.195 . 0 0 "[ . 1 . 2]" 1
608 1 33 VAL HA 1 34 GLY HA3 4.000 . 6.000 4.377 4.351 4.414 . 0 0 "[ . 1 . 2]" 1
609 1 33 VAL HB 1 34 GLY H 4.500 . 6.000 4.127 3.925 4.305 . 0 0 "[ . 1 . 2]" 1
610 1 33 VAL QG 1 34 GLY H 3.900 . 4.300 2.374 2.185 2.562 . 0 0 "[ . 1 . 2]" 1
611 1 33 VAL QG 1 35 VAL H 4.200 . 6.000 4.219 3.236 5.008 . 0 0 "[ . 1 . 2]" 1
612 1 33 VAL QG 1 35 VAL HA 4.200 . 6.000 3.660 2.967 4.531 . 0 0 "[ . 1 . 2]" 1
613 1 34 GLY H 1 34 GLY HA2 2.500 . 3.600 2.817 2.744 2.893 . 0 0 "[ . 1 . 2]" 1
614 1 34 GLY H 1 34 GLY HA3 2.700 . 3.900 2.292 2.281 2.320 . 0 0 "[ . 1 . 2]" 1
615 1 34 GLY H 1 35 VAL H 4.700 . 6.000 4.439 4.095 4.606 . 0 0 "[ . 1 . 2]" 1
616 1 34 GLY HA2 1 35 VAL H 3.000 . 4.500 2.150 2.119 2.247 . 0 0 "[ . 1 . 2]" 1
617 1 34 GLY HA2 1 35 VAL HB 6.000 . 6.000 5.102 4.548 5.480 . 0 0 "[ . 1 . 2]" 1
618 1 34 GLY HA2 1 35 VAL MG1 6.000 . 6.000 5.212 4.746 5.502 . 0 0 "[ . 1 . 2]" 1
619 1 34 GLY HA2 1 35 VAL MG2 6.000 . 6.000 3.327 3.003 4.167 . 0 0 "[ . 1 . 2]" 1
620 1 34 GLY HA3 1 35 VAL H 6.000 . 6.000 3.257 3.012 3.469 . 0 0 "[ . 1 . 2]" 1
621 1 35 VAL H 1 35 VAL HA 2.700 . 3.900 2.873 2.862 2.884 . 0 0 "[ . 1 . 2]" 1
622 1 35 VAL H 1 35 VAL HB 2.300 . 3.300 2.966 2.351 3.362 0.062 4 0 "[ . 1 . 2]" 1
623 1 35 VAL H 1 36 ILE H 4.400 . 6.000 4.483 4.267 4.592 . 0 0 "[ . 1 . 2]" 1
624 1 35 VAL H 1 36 ILE HA 6.000 . 6.000 5.396 5.183 5.568 . 0 0 "[ . 1 . 2]" 1
625 1 35 VAL H 1 38 SER QB 4.300 . 6.000 3.364 2.580 4.137 . 0 0 "[ . 1 . 2]" 1
626 1 35 VAL HA 1 35 VAL HB 2.800 . 4.100 2.937 2.782 3.024 . 0 0 "[ . 1 . 2]" 1
627 1 35 VAL HA 1 36 ILE H 1.900 . 2.700 2.170 2.097 2.393 . 0 0 "[ . 1 . 2]" 1
628 1 35 VAL HA 1 36 ILE MD 5.000 . 6.000 3.866 3.062 4.928 . 0 0 "[ . 1 . 2]" 1
629 1 35 VAL HA 1 36 ILE HG12 4.600 . 6.000 5.123 3.806 5.774 . 0 0 "[ . 1 . 2]" 1
630 1 35 VAL HA 1 37 GLY H 3.900 . 6.000 4.451 4.012 4.772 . 0 0 "[ . 1 . 2]" 1
631 1 35 VAL HB 1 36 ILE H 6.000 . 6.000 3.754 3.173 4.121 . 0 0 "[ . 1 . 2]" 1
632 1 35 VAL HB 1 38 SER H 4.000 . 6.000 3.620 3.170 4.082 . 0 0 "[ . 1 . 2]" 1
633 1 35 VAL HB 1 38 SER QB 2.400 . 3.400 2.439 1.751 3.287 . 0 0 "[ . 1 . 2]" 1
634 1 35 VAL QG 1 38 SER H 6.000 . 6.000 3.988 3.309 4.458 . 0 0 "[ . 1 . 2]" 1
635 1 35 VAL MG1 1 36 ILE H 6.000 . 6.000 2.674 1.824 3.482 . 0 0 "[ . 1 . 2]" 1
636 1 35 VAL MG1 1 38 SER QB 6.000 . 6.000 3.745 3.057 4.523 . 0 0 "[ . 1 . 2]" 1
637 1 35 VAL MG2 1 36 ILE H 6.000 . 6.000 4.249 3.788 4.449 . 0 0 "[ . 1 . 2]" 1
638 1 35 VAL MG2 1 38 SER H 6.000 . 6.000 4.667 3.966 5.120 . 0 0 "[ . 1 . 2]" 1
639 1 35 VAL MG2 1 38 SER QB 6.000 . 6.000 2.864 1.928 4.264 . 0 0 "[ . 1 . 2]" 1
640 1 36 ILE H 1 36 ILE HB 2.300 . 3.200 2.757 2.466 2.967 . 0 0 "[ . 1 . 2]" 1
641 1 36 ILE H 1 36 ILE MD 2.800 . 4.100 2.532 1.928 3.363 . 0 0 "[ . 1 . 2]" 1
642 1 36 ILE H 1 36 ILE MG 4.000 . 6.000 3.726 3.662 3.773 . 0 0 "[ . 1 . 2]" 1
643 1 36 ILE H 1 37 GLY H 6.000 . 6.000 4.433 4.291 4.557 . 0 0 "[ . 1 . 2]" 1
644 1 36 ILE HA 1 36 ILE HB 2.900 . 4.200 3.006 2.974 3.027 . 0 0 "[ . 1 . 2]" 1
645 1 36 ILE HA 1 36 ILE MD 3.700 . 5.700 3.749 1.908 4.039 . 0 0 "[ . 1 . 2]" 1
646 1 36 ILE HA 1 36 ILE HG13 2.800 . 4.000 2.788 2.291 3.680 . 0 0 "[ . 1 . 2]" 1
647 1 36 ILE HA 1 36 ILE MG 2.600 . 3.700 2.249 2.019 2.434 . 0 0 "[ . 1 . 2]" 1
648 1 36 ILE HA 1 37 GLY H 1.900 . 2.700 2.143 2.121 2.175 . 0 0 "[ . 1 . 2]" 1
649 1 36 ILE HA 1 37 GLY HA2 6.000 . 6.000 4.365 4.331 4.410 . 0 0 "[ . 1 . 2]" 1
650 1 36 ILE HA 1 37 GLY HA3 5.000 . 6.000 4.383 4.348 4.429 . 0 0 "[ . 1 . 2]" 1
651 1 36 ILE HA 1 38 SER H 4.100 . 6.000 3.552 3.377 3.721 . 0 0 "[ . 1 . 2]" 1
652 1 36 ILE HB 1 36 ILE MG 2.400 . 3.400 2.103 2.078 2.127 . 0 0 "[ . 1 . 2]" 1
653 1 36 ILE HB 1 37 GLY H 6.000 . 6.000 4.182 3.992 4.347 . 0 0 "[ . 1 . 2]" 1
654 1 36 ILE MD 1 36 ILE HG13 1.900 . 2.700 2.101 2.075 2.121 . 0 0 "[ . 1 . 2]" 1
655 1 36 ILE MD 1 37 GLY H 6.000 . 6.000 5.242 3.725 5.495 . 0 0 "[ . 1 . 2]" 1
656 1 36 ILE HG12 1 37 GLY H 6.000 . 6.000 5.165 4.581 5.476 . 0 0 "[ . 1 . 2]" 1
657 1 36 ILE HG13 1 37 GLY H 6.000 . 6.000 4.843 4.378 5.583 . 0 0 "[ . 1 . 2]" 1
658 1 36 ILE MG 1 37 GLY H 3.100 . 4.600 2.853 2.500 3.285 . 0 0 "[ . 1 . 2]" 1
659 1 37 GLY H 1 37 GLY HA2 2.200 . 3.100 2.372 2.309 2.499 . 0 0 "[ . 1 . 2]" 1
660 1 37 GLY H 1 38 SER H 2.400 . 3.400 2.368 2.195 2.508 . 0 0 "[ . 1 . 2]" 1
661 1 37 GLY HA2 1 38 SER H 4.400 . 6.000 3.223 3.001 3.443 . 0 0 "[ . 1 . 2]" 1
662 1 37 GLY HA3 1 38 SER H 6.000 . 6.000 3.297 3.051 3.453 . 0 0 "[ . 1 . 2]" 1
663 1 38 SER H 1 38 SER QB 2.700 . 3.900 2.342 2.150 2.587 . 0 0 "[ . 1 . 2]" 1
664 1 38 SER H 1 39 GLN H 6.000 . 6.000 4.492 4.376 4.624 . 0 0 "[ . 1 . 2]" 1
665 1 38 SER HA 1 39 GLN H 6.000 . 6.000 2.434 2.140 2.712 . 0 0 "[ . 1 . 2]" 1
666 1 38 SER QB 1 39 GLN H 3.900 . 6.000 2.515 2.182 3.231 . 0 0 "[ . 1 . 2]" 1
667 1 39 GLN H 1 39 GLN HA 3.000 . 4.400 2.934 2.882 2.952 . 0 0 "[ . 1 . 2]" 1
668 1 39 GLN H 1 39 GLN HB2 2.600 . 3.800 2.497 2.246 2.932 . 0 0 "[ . 1 . 2]" 1
669 1 39 GLN H 1 39 GLN HB3 2.900 . 4.200 3.545 3.014 3.768 . 0 0 "[ . 1 . 2]" 1
670 1 39 GLN H 1 39 GLN HG2 4.400 . 6.000 4.180 1.936 4.864 . 0 0 "[ . 1 . 2]" 1
671 1 39 GLN H 1 39 GLN HG3 3.200 . 4.800 3.542 2.532 4.563 . 0 0 "[ . 1 . 2]" 1
672 1 39 GLN H 1 40 CYS H 4.300 . 6.000 4.398 3.834 4.545 . 0 0 "[ . 1 . 2]" 1
673 1 39 GLN HA 1 39 GLN HB3 2.700 . 3.900 2.607 2.292 2.992 . 0 0 "[ . 1 . 2]" 1
674 1 39 GLN HA 1 39 GLN HE21 6.000 . 6.000 4.507 2.383 5.374 . 0 0 "[ . 1 . 2]" 1
675 1 39 GLN HA 1 39 GLN HE22 6.000 . 6.000 5.475 3.864 6.021 0.021 17 0 "[ . 1 . 2]" 1
676 1 39 GLN HA 1 39 GLN HG2 3.200 . 4.800 3.069 2.411 3.545 . 0 0 "[ . 1 . 2]" 1
677 1 39 GLN HA 1 39 GLN HG3 2.200 . 3.100 2.569 2.060 4.001 0.901 9 2 "[ . +1 - . 2]" 1
678 1 39 GLN HA 1 40 CYS H 6.000 . 6.000 2.204 2.133 2.417 . 0 0 "[ . 1 . 2]" 1
679 1 39 GLN HB2 1 40 CYS H 6.000 . 6.000 4.168 3.351 4.609 . 0 0 "[ . 1 . 2]" 1
680 1 39 GLN HB3 1 40 CYS H 3.400 . 5.100 3.241 2.476 4.273 . 0 0 "[ . 1 . 2]" 1
681 1 39 GLN HG2 1 40 CYS H 6.000 . 6.000 4.350 3.290 5.170 . 0 0 "[ . 1 . 2]" 1
682 1 39 GLN HG3 1 40 CYS H 6.000 . 6.000 4.319 3.361 5.525 . 0 0 "[ . 1 . 2]" 1
683 1 40 CYS H 1 40 CYS HA 2.700 . 3.900 2.912 2.858 2.948 . 0 0 "[ . 1 . 2]" 1
684 1 40 CYS H 1 40 CYS HB2 2.300 . 3.300 2.409 2.091 2.914 . 0 0 "[ . 1 . 2]" 1
685 1 40 CYS H 1 40 CYS HB3 3.600 . 5.500 3.129 2.649 3.674 . 0 0 "[ . 1 . 2]" 1
686 1 40 CYS H 1 41 GLY H 4.300 . 6.000 4.417 4.201 4.623 . 0 0 "[ . 1 . 2]" 1
687 1 40 CYS HA 1 40 CYS HB3 2.800 . 4.100 2.878 2.560 3.021 . 0 0 "[ . 1 . 2]" 1
688 1 40 CYS HA 1 41 GLY H 2.200 . 3.100 2.191 2.128 2.362 . 0 0 "[ . 1 . 2]" 1
689 1 40 CYS HA 1 42 ALA H 4.400 . 6.000 3.748 3.228 4.540 . 0 0 "[ . 1 . 2]" 1
690 1 40 CYS HB2 1 41 GLY H 4.200 . 6.000 4.379 4.099 4.652 . 0 0 "[ . 1 . 2]" 1
691 1 40 CYS HB2 1 42 ALA H 4.900 . 6.000 4.673 4.163 5.478 . 0 0 "[ . 1 . 2]" 1
692 1 40 CYS HB3 1 41 GLY H 3.400 . 5.200 3.667 3.088 4.187 . 0 0 "[ . 1 . 2]" 1
693 1 40 CYS HB3 1 42 ALA H 4.500 . 6.000 3.397 2.453 4.269 . 0 0 "[ . 1 . 2]" 1
694 1 40 CYS HB3 1 44 VAL QG 3.000 . 4.400 2.572 1.801 3.837 . 0 0 "[ . 1 . 2]" 1
695 1 41 GLY H 1 41 GLY HA2 2.500 . 3.600 2.932 2.861 2.959 . 0 0 "[ . 1 . 2]" 1
696 1 41 GLY H 1 41 GLY HA3 2.600 . 3.800 2.395 2.304 2.569 . 0 0 "[ . 1 . 2]" 1
697 1 41 GLY H 1 42 ALA H 2.500 . 3.600 2.450 2.126 3.577 . 0 0 "[ . 1 . 2]" 1
698 1 41 GLY H 1 42 ALA MB 4.800 . 6.000 3.831 3.442 4.275 . 0 0 "[ . 1 . 2]" 1
699 1 41 GLY HA2 1 42 ALA H 3.300 . 5.000 3.205 2.539 3.560 . 0 0 "[ . 1 . 2]" 1
700 1 41 GLY HA3 1 42 ALA H 3.100 . 4.600 3.252 2.665 3.561 . 0 0 "[ . 1 . 2]" 1
701 1 42 ALA H 1 42 ALA MB 2.400 . 3.400 2.385 2.125 2.731 . 0 0 "[ . 1 . 2]" 1
702 1 42 ALA H 1 43 SER H 3.200 . 4.800 3.992 2.723 4.385 . 0 0 "[ . 1 . 2]" 1
703 1 42 ALA MB 1 43 SER H 6.000 . 6.000 1.834 1.335 2.305 . 0 0 "[ . 1 . 2]" 1
704 1 42 ALA MB 1 43 SER QB 4.700 . 6.000 3.865 3.250 4.169 . 0 0 "[ . 1 . 2]" 1
705 1 43 SER H 1 43 SER QB 2.600 . 3.800 2.812 2.084 3.231 . 0 0 "[ . 1 . 2]" 1
706 1 43 SER H 1 44 VAL H 6.000 . 6.000 4.243 3.892 4.536 . 0 0 "[ . 1 . 2]" 1
707 1 43 SER HA 1 44 VAL H 6.000 . 6.000 2.193 2.141 2.341 . 0 0 "[ . 1 . 2]" 1
708 1 43 SER HA 1 44 VAL QG 3.600 . 5.500 3.356 2.904 3.607 . 0 0 "[ . 1 . 2]" 1
709 1 43 SER QB 1 44 VAL H 4.200 . 6.000 3.526 3.088 3.842 . 0 0 "[ . 1 . 2]" 1
710 1 43 SER QB 1 45 LYS HE2 3.000 . 4.400 3.372 2.018 4.412 0.012 2 0 "[ . 1 . 2]" 1
711 1 43 SER QB 1 45 LYS HE3 3.000 . 4.400 3.527 1.743 4.478 0.078 17 0 "[ . 1 . 2]" 1
712 1 43 SER QB 1 45 LYS HG2 6.000 . 6.000 2.877 2.372 3.470 . 0 0 "[ . 1 . 2]" 1
713 1 43 SER QB 1 45 LYS HG3 6.000 . 6.000 3.295 2.196 4.112 . 0 0 "[ . 1 . 2]" 1
714 1 43 SER HB2 1 45 LYS HD3 6.000 . 6.000 4.789 1.743 6.077 0.077 3 0 "[ . 1 . 2]" 1
715 1 44 VAL H 1 44 VAL HB 2.400 . 3.400 2.812 2.622 3.053 . 0 0 "[ . 1 . 2]" 1
716 1 44 VAL H 1 44 VAL QG 2.700 . 3.900 1.929 1.632 2.250 . 0 0 "[ . 1 . 2]" 1
717 1 44 VAL H 1 45 LYS H 6.000 . 6.000 4.317 3.999 4.498 . 0 0 "[ . 1 . 2]" 1
718 1 44 VAL HA 1 45 LYS H 6.000 . 6.000 2.154 2.103 2.280 . 0 0 "[ . 1 . 2]" 1
719 1 44 VAL HB 1 44 VAL QG 2.100 . 3.000 1.878 1.860 1.889 . 0 0 "[ . 1 . 2]" 1
720 1 44 VAL HB 1 45 LYS H 6.000 . 6.000 4.212 3.896 4.394 . 0 0 "[ . 1 . 2]" 1
721 1 44 VAL QG 1 45 LYS H . . 4.800 2.963 2.485 3.464 . 0 0 "[ . 1 . 2]" 1
722 1 44 VAL QG 1 45 LYS HG2 6.000 . 6.000 4.530 4.025 5.272 . 0 0 "[ . 1 . 2]" 1
723 1 44 VAL QG 1 61 ILE MD 6.000 . 6.000 4.582 2.736 5.926 . 0 0 "[ . 1 . 2]" 1
724 1 45 LYS H 1 45 LYS HD2 6.000 . 6.000 5.135 4.152 5.669 . 0 0 "[ . 1 . 2]" 1
725 1 45 LYS H 1 45 LYS HD3 6.000 . 6.000 4.815 3.989 5.462 . 0 0 "[ . 1 . 2]" 1
726 1 45 LYS H 1 45 LYS HE2 6.000 . 6.000 5.021 4.077 6.024 0.024 17 0 "[ . 1 . 2]" 1
727 1 45 LYS H 1 45 LYS HE3 6.000 . 6.000 5.461 3.913 6.084 0.084 12 0 "[ . 1 . 2]" 1
728 1 45 LYS H 1 46 CYS HA 6.000 . 6.000 4.958 4.777 5.199 . 0 0 "[ . 1 . 2]" 1
729 1 45 LYS HA 1 46 CYS H 6.000 . 6.000 2.352 2.119 2.631 . 0 0 "[ . 1 . 2]" 1
730 1 45 LYS QB 1 46 CYS H 2.500 . 3.600 2.561 1.945 3.591 . 0 0 "[ . 1 . 2]" 1
731 1 45 LYS QB 1 61 ILE MD 6.000 . 6.000 5.134 3.978 6.017 0.017 13 0 "[ . 1 . 2]" 1
732 1 45 LYS QB 1 66 CYS HB3 3.200 . 4.800 3.060 1.983 4.551 . 0 0 "[ . 1 . 2]" 1
733 1 45 LYS HD2 1 46 CYS H 5.000 . 6.000 4.822 3.563 6.014 0.014 2 0 "[ . 1 . 2]" 1
734 1 45 LYS HD3 1 46 CYS H 6.000 . 6.000 4.145 3.004 5.990 . 0 0 "[ . 1 . 2]" 1
735 1 45 LYS HE2 1 46 CYS H 6.000 . 6.000 5.285 4.033 6.068 0.068 13 0 "[ . 1 . 2]" 1
736 1 45 LYS HE3 1 45 LYS HG3 2.700 . 3.900 3.156 2.334 3.900 0.000 4 0 "[ . 1 . 2]" 1
737 1 45 LYS HE3 1 46 CYS H 6.000 . 6.000 5.568 4.378 6.073 0.073 7 0 "[ . 1 . 2]" 1
738 1 45 LYS HG2 1 46 CYS H 6.000 . 6.000 4.642 3.747 5.207 . 0 0 "[ . 1 . 2]" 1
739 1 45 LYS HG3 1 46 CYS H 6.000 . 6.000 5.022 4.673 5.507 . 0 0 "[ . 1 . 2]" 1
740 1 46 CYS H 1 46 CYS HA 3.000 . 4.400 2.930 2.890 2.952 . 0 0 "[ . 1 . 2]" 1
741 1 46 CYS H 1 47 CYS H 4.400 . 6.000 4.080 3.827 4.370 . 0 0 "[ . 1 . 2]" 1
742 1 46 CYS H 1 67 VAL H 6.000 . 6.000 3.936 3.112 5.352 . 0 0 "[ . 1 . 2]" 1
743 1 46 CYS H 1 67 VAL MG1 6.000 . 6.000 5.569 3.812 6.516 0.516 16 1 "[ . 1 .+ 2]" 1
744 1 46 CYS HA 1 47 CYS H 2.200 . 3.100 2.193 2.141 2.305 . 0 0 "[ . 1 . 2]" 1
745 1 46 CYS HB2 1 47 CYS H 4.000 . 6.000 4.413 3.987 4.580 . 0 0 "[ . 1 . 2]" 1
746 1 46 CYS HB2 1 67 VAL MG1 6.000 . 6.000 3.736 2.359 4.716 . 0 0 "[ . 1 . 2]" 1
747 1 46 CYS HB2 1 67 VAL MG1 2.900 . 4.200 4.235 2.751 4.997 0.797 16 5 "[ * . *1 *+ -]" 1
748 1 46 CYS HB2 1 67 VAL H 6.000 . 6.000 3.733 3.016 4.811 . 0 0 "[ . 1 . 2]" 1
749 1 46 CYS HB2 1 67 VAL HA 6.000 . 6.000 5.636 4.920 5.976 . 0 0 "[ . 1 . 2]" 1
750 1 46 CYS HB2 1 67 VAL HB 4.100 . 6.000 4.572 3.860 5.535 . 0 0 "[ . 1 . 2]" 1
751 1 46 CYS HB3 1 47 CYS H 6.000 . 6.000 3.845 3.547 4.141 . 0 0 "[ . 1 . 2]" 1
752 1 46 CYS HB3 1 67 VAL MG1 6.000 . 6.000 5.158 3.342 6.880 0.880 20 2 "[ - . 1 . +]" 1
753 1 47 CYS H 1 47 CYS HB2 3.100 . 4.600 2.615 2.327 3.001 . 0 0 "[ . 1 . 2]" 1
754 1 47 CYS H 1 48 LYS H 4.800 . 6.000 4.479 4.404 4.532 . 0 0 "[ . 1 . 2]" 1
755 1 47 CYS H 1 61 ILE MG 6.000 . 6.000 5.750 5.300 6.057 0.057 13 0 "[ . 1 . 2]" 1
756 1 47 CYS HA 1 47 CYS HB3 2.800 . 4.100 2.532 2.288 2.842 . 0 0 "[ . 1 . 2]" 1
757 1 47 CYS HA 1 48 LYS H 2.300 . 3.200 2.327 2.202 2.603 . 0 0 "[ . 1 . 2]" 1
758 1 47 CYS HA 1 48 LYS HA 6.000 . 6.000 4.363 4.291 4.586 . 0 0 "[ . 1 . 2]" 1
759 1 47 CYS HA 1 66 CYS H 6.000 . 6.000 4.674 4.176 5.270 . 0 0 "[ . 1 . 2]" 1
760 1 47 CYS HA 1 67 VAL H 6.000 . 6.000 3.602 3.187 4.072 . 0 0 "[ . 1 . 2]" 1
761 1 47 CYS HB2 1 48 LYS H 2.900 . 4.300 3.740 2.717 4.239 . 0 0 "[ . 1 . 2]" 1
762 1 47 CYS HB2 1 61 ILE HB 6.000 . 6.000 4.855 3.539 6.028 0.028 6 0 "[ . 1 . 2]" 1
763 1 47 CYS HB2 1 61 ILE MD 3.200 . 4.800 2.684 1.993 3.608 . 0 0 "[ . 1 . 2]" 1
764 1 47 CYS HB2 1 61 ILE MG 6.000 . 6.000 3.798 3.141 4.516 . 0 0 "[ . 1 . 2]" 1
765 1 47 CYS HB3 1 48 LYS H 3.300 . 4.900 2.725 2.326 3.125 . 0 0 "[ . 1 . 2]" 1
766 1 47 CYS HB3 1 48 LYS HA 4.700 . 6.000 4.215 3.829 4.635 . 0 0 "[ . 1 . 2]" 1
767 1 47 CYS HB3 1 61 ILE MD 3.100 . 4.600 2.657 1.819 3.599 . 0 0 "[ . 1 . 2]" 1
768 1 47 CYS HB3 1 61 ILE MG 2.800 . 4.100 2.839 2.262 3.826 . 0 0 "[ . 1 . 2]" 1
769 1 47 CYS HB3 1 66 CYS HA 6.000 . 6.000 3.837 2.807 4.744 . 0 0 "[ . 1 . 2]" 1
770 1 48 LYS H 1 48 LYS QD 6.000 . 6.000 3.987 2.842 4.902 . 0 0 "[ . 1 . 2]" 1
771 1 48 LYS H 1 48 LYS HE2 6.000 . 6.000 5.462 4.197 6.093 0.093 19 0 "[ . 1 . 2]" 1
772 1 48 LYS H 1 48 LYS HE3 6.000 . 6.000 5.253 4.288 6.050 0.050 3 0 "[ . 1 . 2]" 1
773 1 48 LYS H 1 49 ASP H 6.000 . 6.000 4.225 2.012 4.579 . 0 0 "[ . 1 . 2]" 1
774 1 48 LYS H 1 61 ILE MG 6.000 . 6.000 4.164 3.181 5.379 . 0 0 "[ . 1 . 2]" 1
775 1 48 LYS H 1 65 ASN HB3 2.900 . 4.200 3.301 2.723 4.817 0.617 11 1 "[ . 1+ . 2]" 1
776 1 48 LYS H 1 66 CYS HA 4.300 . 6.000 3.698 3.253 4.667 . 0 0 "[ . 1 . 2]" 1
777 1 48 LYS HA 1 48 LYS QB 2.600 . 3.800 2.334 2.154 2.545 . 0 0 "[ . 1 . 2]" 1
778 1 48 LYS HA 1 48 LYS HE3 6.000 . 6.000 4.557 2.414 6.312 0.312 15 0 "[ . 1 . 2]" 1
779 1 48 LYS HA 1 48 LYS QZ 6.000 . 6.000 4.960 3.235 6.043 0.043 20 0 "[ . 1 . 2]" 1
780 1 48 LYS HA 1 49 ASP H 6.000 . 6.000 2.414 2.097 3.549 . 0 0 "[ . 1 . 2]" 1
781 1 48 LYS QB 1 65 ASN HB3 2.600 . 3.700 3.330 2.245 4.182 0.482 11 0 "[ . 1 . 2]" 1
782 1 48 LYS QB 1 49 ASP H 6.000 . 6.000 2.986 1.684 3.906 . 0 0 "[ . 1 . 2]" 1
783 1 48 LYS QD 1 48 LYS HE3 2.500 . 3.600 2.347 2.138 2.530 . 0 0 "[ . 1 . 2]" 1
784 1 48 LYS HE3 1 49 ASP H 6.000 . 6.000 4.937 2.138 6.431 0.431 20 0 "[ . 1 . 2]" 1
785 1 48 LYS QG 1 49 ASP H 6.000 . 6.000 3.599 2.473 4.371 . 0 0 "[ . 1 . 2]" 1
786 1 48 LYS QG 1 50 ASP H 6.000 . 6.000 3.963 2.680 5.436 . 0 0 "[ . 1 . 2]" 1
787 1 48 LYS QG 1 65 ASN HB3 6.000 . 6.000 4.244 2.298 6.085 0.085 11 0 "[ . 1 . 2]" 1
788 1 49 ASP H 1 49 ASP HB2 2.800 . 4.100 2.939 2.134 3.977 . 0 0 "[ . 1 . 2]" 1
789 1 49 ASP HA 1 50 ASP H 6.000 . 6.000 2.702 2.100 3.562 . 0 0 "[ . 1 . 2]" 1
790 1 49 ASP HA 1 51 VAL H 6.000 . 6.000 3.810 2.852 5.701 . 0 0 "[ . 1 . 2]" 1
791 1 49 ASP HB2 1 50 ASP H 4.500 . 6.000 4.039 2.439 4.640 . 0 0 "[ . 1 . 2]" 1
792 1 49 ASP HB3 1 50 ASP H 6.000 . 6.000 4.055 2.272 4.646 . 0 0 "[ . 1 . 2]" 1
793 1 50 ASP H 1 51 VAL H 2.800 . 4.100 2.837 1.822 4.150 0.050 9 0 "[ . 1 . 2]" 1
794 1 50 ASP H 1 51 VAL QG 2.900 . 4.200 3.383 2.528 4.637 0.437 1 0 "[ . 1 . 2]" 1
795 1 50 ASP HA 1 51 VAL H 2.900 . 4.300 3.083 2.131 3.558 . 0 0 "[ . 1 . 2]" 1
796 1 50 ASP HB2 1 51 VAL H 6.000 . 6.000 4.025 2.929 4.624 . 0 0 "[ . 1 . 2]" 1
797 1 50 ASP HB3 1 51 VAL H 6.000 . 6.000 3.604 1.833 4.671 . 0 0 "[ . 1 . 2]" 1
798 1 51 VAL H 1 51 VAL HA 2.900 . 4.300 2.896 2.709 2.953 . 0 0 "[ . 1 . 2]" 1
799 1 51 VAL H 1 51 VAL HB 2.900 . 4.200 3.343 2.610 3.782 . 0 0 "[ . 1 . 2]" 1
800 1 51 VAL H 1 52 THR H 4.100 . 6.000 3.455 1.943 4.600 . 0 0 "[ . 1 . 2]" 1
801 1 51 VAL HA 1 51 VAL HB 2.700 . 3.900 2.689 2.324 3.024 . 0 0 "[ . 1 . 2]" 1
802 1 51 VAL HA 1 51 VAL QG 2.700 . 3.900 2.129 1.904 2.515 . 0 0 "[ . 1 . 2]" 1
803 1 51 VAL HA 1 52 THR H 2.900 . 4.300 2.670 2.094 3.565 . 0 0 "[ . 1 . 2]" 1
804 1 51 VAL HB 1 52 THR H 3.400 . 5.100 3.590 2.071 4.501 . 0 0 "[ . 1 . 2]" 1
805 1 51 VAL QG 1 52 THR H 6.000 . 6.000 2.943 1.766 3.700 . 0 0 "[ . 1 . 2]" 1
806 1 51 VAL QG 1 61 ILE MD 6.000 . 6.000 4.094 1.935 5.737 . 0 0 "[ . 1 . 2]" 1
807 1 52 THR H 1 52 THR HB 3.800 . 5.900 3.292 2.830 3.838 . 0 0 "[ . 1 . 2]" 1
808 1 52 THR H 1 53 ASN H 6.000 . 6.000 2.828 1.973 4.490 . 0 0 "[ . 1 . 2]" 1
809 1 52 THR H 1 53 ASN HA 6.000 . 6.000 5.031 4.177 6.099 0.099 7 0 "[ . 1 . 2]" 1
810 1 52 THR H 1 53 ASN HB2 6.000 . 6.000 4.757 3.917 5.964 . 0 0 "[ . 1 . 2]" 1
811 1 52 THR H 1 53 ASN HB3 6.000 . 6.000 5.297 4.160 6.058 0.058 16 0 "[ . 1 . 2]" 1
812 1 52 THR HA 1 53 ASN H 3.400 . 5.100 3.048 2.196 3.565 . 0 0 "[ . 1 . 2]" 1
813 1 52 THR HA 1 53 ASN H 6.000 . 6.000 2.444 2.016 3.167 . 0 0 "[ . 1 . 2]" 1
814 1 52 THR HB 1 53 ASN H 3.400 . 5.100 3.643 1.979 4.335 . 0 0 "[ . 1 . 2]" 1
815 1 52 THR MG 1 53 ASN H 3.700 . 5.700 4.076 2.543 4.402 . 0 0 "[ . 1 . 2]" 1
816 1 52 THR MG 1 53 ASN H 3.800 . 5.900 3.317 2.333 3.895 . 0 0 "[ . 1 . 2]" 1
817 1 53 ASN HD21 1 54 THR H 4.100 . 6.000 4.182 2.933 4.843 . 0 0 "[ . 1 . 2]" 1
818 1 55 GLY H 1 56 ASN H 6.000 . 6.000 3.117 1.833 4.621 . 0 0 "[ . 1 . 2]" 1
819 1 55 GLY H 1 56 ASN HD21 6.000 . 6.000 5.425 2.802 6.518 0.518 20 1 "[ . 1 . +]" 1
820 1 55 GLY HA2 1 56 ASN H 6.000 . 6.000 2.719 2.225 3.450 . 0 0 "[ . 1 . 2]" 1
821 1 55 GLY HA3 1 56 ASN H 6.000 . 6.000 3.259 2.261 3.564 . 0 0 "[ . 1 . 2]" 1
822 1 56 ASN H 1 56 ASN HD21 6.000 . 6.000 4.167 2.519 5.317 . 0 0 "[ . 1 . 2]" 1
823 1 56 ASN H 1 56 ASN HD22 6.000 . 6.000 5.053 3.600 6.101 0.101 11 0 "[ . 1 . 2]" 1
824 1 56 ASN H 1 57 SER H 6.000 . 6.000 3.609 2.366 4.626 . 0 0 "[ . 1 . 2]" 1
825 1 56 ASN HA 1 57 SER H 6.000 . 6.000 3.045 2.146 3.576 . 0 0 "[ . 1 . 2]" 1
826 1 56 ASN HB2 1 57 SER H 6.000 . 6.000 3.131 1.624 4.574 . 0 0 "[ . 1 . 2]" 1
827 1 56 ASN HB3 1 57 SER H 6.000 . 6.000 3.038 1.342 4.318 . 0 0 "[ . 1 . 2]" 1
828 1 57 SER H 1 57 SER QB 2.800 . 4.100 2.881 2.684 3.143 . 0 0 "[ . 1 . 2]" 1
829 1 57 SER H 1 58 GLY H 6.000 . 6.000 2.974 2.326 4.499 . 0 0 "[ . 1 . 2]" 1
830 1 57 SER HA 1 58 GLY H 6.000 . 6.000 3.069 2.147 3.567 . 0 0 "[ . 1 . 2]" 1
831 1 57 SER QB 1 58 GLY H 6.000 . 6.000 3.266 2.007 3.952 . 0 0 "[ . 1 . 2]" 1
832 1 58 GLY H 1 59 LEU H 6.000 . 6.000 4.023 2.446 4.614 . 0 0 "[ . 1 . 2]" 1
833 1 58 GLY HA2 1 59 LEU H 6.000 . 6.000 2.456 2.184 2.858 . 0 0 "[ . 1 . 2]" 1
834 1 58 GLY HA3 1 59 LEU H 3.200 . 4.800 2.983 2.321 3.549 . 0 0 "[ . 1 . 2]" 1
835 1 59 LEU H 1 59 LEU HG 3.000 . 4.500 3.955 3.024 4.592 0.092 12 0 "[ . 1 . 2]" 1
836 1 59 LEU H 1 60 ILE H 6.000 . 6.000 4.172 3.496 4.548 . 0 0 "[ . 1 . 2]" 1
837 1 59 LEU HA 1 59 LEU MD1 3.500 . 5.300 3.291 1.735 3.839 . 0 0 "[ . 1 . 2]" 1
838 1 59 LEU HA 1 59 LEU MD2 4.300 . 6.000 2.961 2.001 3.864 . 0 0 "[ . 1 . 2]" 1
839 1 59 LEU HA 1 59 LEU HG 3.100 . 4.600 2.411 2.081 3.562 . 0 0 "[ . 1 . 2]" 1
840 1 59 LEU HA 1 60 ILE H 6.000 . 6.000 2.182 2.112 2.403 . 0 0 "[ . 1 . 2]" 1
841 1 59 LEU HA 1 60 ILE HB 4.500 . 6.000 4.864 4.395 5.540 . 0 0 "[ . 1 . 2]" 1
842 1 59 LEU HB2 1 60 ILE H 6.000 . 6.000 4.525 4.307 4.643 . 0 0 "[ . 1 . 2]" 1
843 1 59 LEU HB3 1 60 ILE H 6.000 . 6.000 3.871 3.223 4.297 . 0 0 "[ . 1 . 2]" 1
844 1 59 LEU MD1 1 60 ILE H 6.000 . 6.000 4.794 3.063 5.553 . 0 0 "[ . 1 . 2]" 1
845 1 59 LEU MD1 1 61 ILE MD 6.000 . 6.000 3.684 2.412 4.927 . 0 0 "[ . 1 . 2]" 1
846 1 59 LEU MD2 1 60 ILE H 6.000 . 6.000 3.896 2.434 5.460 . 0 0 "[ . 1 . 2]" 1
847 1 59 LEU MD2 1 61 ILE MD 6.000 . 6.000 2.830 1.901 4.266 . 0 0 "[ . 1 . 2]" 1
848 1 59 LEU HG 1 60 ILE H 4.000 . 6.000 4.205 3.409 5.387 . 0 0 "[ . 1 . 2]" 1
849 1 60 ILE H 1 60 ILE HB 2.400 . 3.400 2.747 2.490 3.414 0.014 18 0 "[ . 1 . 2]" 1
850 1 60 ILE H 1 60 ILE MG 3.600 . 5.500 3.473 1.786 3.809 . 0 0 "[ . 1 . 2]" 1
851 1 60 ILE H 1 61 ILE H 6.000 . 6.000 4.122 3.824 4.437 . 0 0 "[ . 1 . 2]" 1
852 1 60 ILE HA 1 60 ILE HG13 2.700 . 3.900 2.806 2.216 3.780 . 0 0 "[ . 1 . 2]" 1
853 1 60 ILE HA 1 60 ILE MG 2.600 . 3.800 2.389 1.915 3.222 . 0 0 "[ . 1 . 2]" 1
854 1 60 ILE HA 1 61 ILE H 6.000 . 6.000 2.214 2.138 2.361 . 0 0 "[ . 1 . 2]" 1
855 1 60 ILE HB 1 61 ILE H 6.000 . 6.000 4.342 4.157 4.546 . 0 0 "[ . 1 . 2]" 1
856 1 60 ILE MD 1 61 ILE H 6.000 . 6.000 5.099 3.918 5.638 . 0 0 "[ . 1 . 2]" 1
857 1 60 ILE HG12 1 61 ILE H 2.900 . 4.200 2.659 2.200 3.290 . 0 0 "[ . 1 . 2]" 1
858 1 60 ILE HG13 1 61 ILE H 6.000 . 6.000 4.571 2.567 5.762 . 0 0 "[ . 1 . 2]" 1
859 1 60 ILE MG 1 61 ILE H 6.000 . 6.000 3.467 2.848 4.230 . 0 0 "[ . 1 . 2]" 1
860 1 60 ILE MG 1 61 ILE HA 6.000 . 6.000 4.342 3.512 5.421 . 0 0 "[ . 1 . 2]" 1
861 1 61 ILE H 1 61 ILE MD 4.200 . 6.000 3.349 2.738 4.077 . 0 0 "[ . 1 . 2]" 1
862 1 61 ILE H 1 62 ASN H 6.000 . 6.000 4.481 4.024 4.609 . 0 0 "[ . 1 . 2]" 1
863 1 61 ILE HA 1 61 ILE HB 2.800 . 4.100 2.985 2.824 3.029 . 0 0 "[ . 1 . 2]" 1
864 1 61 ILE HA 1 61 ILE HG13 3.300 . 5.000 3.052 1.961 4.024 . 0 0 "[ . 1 . 2]" 1
865 1 61 ILE HA 1 61 ILE MG 2.700 . 3.900 2.353 1.946 2.988 . 0 0 "[ . 1 . 2]" 1
866 1 61 ILE HA 1 62 ASN H 2.200 . 3.100 2.257 2.143 2.946 . 0 0 "[ . 1 . 2]" 1
867 1 61 ILE HA 1 62 ASN HB2 4.300 . 6.000 4.444 4.102 5.667 . 0 0 "[ . 1 . 2]" 1
868 1 61 ILE HB 1 61 ILE MD 2.600 . 3.700 2.455 1.993 3.231 . 0 0 "[ . 1 . 2]" 1
869 1 61 ILE HB 1 62 ASN H 6.000 . 6.000 3.794 1.872 4.431 . 0 0 "[ . 1 . 2]" 1
870 1 61 ILE MD 1 61 ILE HG13 2.400 . 3.400 2.095 2.072 2.117 . 0 0 "[ . 1 . 2]" 1
871 1 61 ILE MD 1 61 ILE MG 2.500 . 3.600 2.269 1.667 3.067 . 0 0 "[ . 1 . 2]" 1
872 1 61 ILE MD 1 62 ASN H 6.000 . 6.000 4.649 3.605 5.251 . 0 0 "[ . 1 . 2]" 1
873 1 61 ILE HG12 1 62 ASN H 6.000 . 6.000 4.609 2.962 5.579 . 0 0 "[ . 1 . 2]" 1
874 1 61 ILE HG13 1 62 ASN H 6.000 . 6.000 4.776 3.612 5.388 . 0 0 "[ . 1 . 2]" 1
875 1 61 ILE MG 1 62 ASN H 6.000 . 6.000 2.322 1.837 3.163 . 0 0 "[ . 1 . 2]" 1
876 1 61 ILE MG 1 62 ASN HD21 3.700 . 5.700 4.206 2.894 5.054 . 0 0 "[ . 1 . 2]" 1
877 1 61 ILE MG 1 62 ASN HD22 4.500 . 6.000 4.782 3.152 5.907 . 0 0 "[ . 1 . 2]" 1
878 1 61 ILE MG 1 65 ASN HB2 6.000 . 6.000 3.195 1.778 5.118 . 0 0 "[ . 1 . 2]" 1
879 1 61 ILE MG 1 65 ASN HB3 3.400 . 5.100 3.240 2.166 5.441 0.341 10 0 "[ . 1 . 2]" 1
880 1 61 ILE MG 1 66 CYS H 4.500 . 6.000 4.583 3.639 5.643 . 0 0 "[ . 1 . 2]" 1
881 1 62 ASN H 1 62 ASN HD21 4.300 . 6.000 4.625 2.128 5.403 . 0 0 "[ . 1 . 2]" 1
882 1 62 ASN H 1 62 ASN HD22 4.800 . 6.000 5.601 3.464 6.126 0.126 15 0 "[ . 1 . 2]" 1
883 1 62 ASN H 1 63 ALA H 6.000 . 6.000 3.532 1.631 4.634 . 0 0 "[ . 1 . 2]" 1
884 1 62 ASN HA 1 63 ALA H 6.000 . 6.000 2.695 2.153 3.575 . 0 0 "[ . 1 . 2]" 1
885 1 62 ASN HB2 1 63 ALA H 6.000 . 6.000 4.151 2.823 4.585 . 0 0 "[ . 1 . 2]" 1
886 1 62 ASN HB2 1 63 ALA MB 6.000 . 6.000 5.324 4.349 5.739 . 0 0 "[ . 1 . 2]" 1
887 1 62 ASN HB3 1 63 ALA H 6.000 . 6.000 3.807 2.009 4.391 . 0 0 "[ . 1 . 2]" 1
888 1 63 ALA H 1 63 ALA MB 2.400 . 3.500 2.533 2.024 2.958 . 0 0 "[ . 1 . 2]" 1
889 1 63 ALA H 1 64 ALA H 3.000 . 4.400 3.228 2.053 4.562 0.162 19 0 "[ . 1 . 2]" 1
890 1 63 ALA HA 1 63 ALA MB 2.300 . 3.300 2.097 2.072 2.126 . 0 0 "[ . 1 . 2]" 1
891 1 63 ALA HA 1 64 ALA H 3.300 . 4.900 3.278 2.220 3.580 . 0 0 "[ . 1 . 2]" 1
892 1 63 ALA HA 1 66 CYS H 3.900 . 6.000 4.753 3.465 6.050 0.050 20 0 "[ . 1 . 2]" 1
893 1 63 ALA MB 1 64 ALA H 6.000 . 6.000 2.835 1.575 3.693 . 0 0 "[ . 1 . 2]" 1
894 1 64 ALA H 1 65 ASN H 6.000 . 6.000 2.730 1.851 3.865 . 0 0 "[ . 1 . 2]" 1
895 1 64 ALA H 1 66 CYS H 4.400 . 6.000 4.376 3.398 5.508 . 0 0 "[ . 1 . 2]" 1
896 1 64 ALA HA 1 64 ALA MB 2.300 . 3.300 2.106 2.075 2.130 . 0 0 "[ . 1 . 2]" 1
897 1 64 ALA HA 1 65 ASN H 6.000 . 6.000 3.173 2.398 3.586 . 0 0 "[ . 1 . 2]" 1
898 1 64 ALA HA 1 66 CYS H 3.300 . 4.900 3.591 3.046 4.177 . 0 0 "[ . 1 . 2]" 1
899 1 64 ALA MB 1 65 ASN H 3.400 . 5.100 3.173 1.833 3.725 . 0 0 "[ . 1 . 2]" 1
900 1 64 ALA MB 1 66 CYS H 4.200 . 6.000 4.446 4.175 4.816 . 0 0 "[ . 1 . 2]" 1
901 1 65 ASN H 1 65 ASN HA 2.900 . 4.200 2.921 2.885 2.951 . 0 0 "[ . 1 . 2]" 1
902 1 65 ASN H 1 65 ASN HB3 3.300 . 4.900 3.315 2.915 3.809 . 0 0 "[ . 1 . 2]" 1
903 1 65 ASN H 1 65 ASN HD21 4.000 . 6.000 4.478 3.075 5.160 . 0 0 "[ . 1 . 2]" 1
904 1 65 ASN H 1 65 ASN HD22 6.000 . 6.000 5.339 3.275 6.076 0.076 3 0 "[ . 1 . 2]" 1
905 1 65 ASN H 1 66 CYS H 2.400 . 3.400 2.462 1.802 3.401 0.001 10 0 "[ . 1 . 2]" 1
906 1 65 ASN HA 1 65 ASN HB3 2.500 . 3.600 2.759 2.327 2.966 . 0 0 "[ . 1 . 2]" 1
907 1 65 ASN HA 1 66 CYS H 2.900 . 4.300 3.009 2.590 3.371 . 0 0 "[ . 1 . 2]" 1
908 1 65 ASN HB2 1 66 CYS H 6.000 . 6.000 4.149 3.311 4.572 . 0 0 "[ . 1 . 2]" 1
909 1 65 ASN HB3 1 65 ASN HD21 3.100 . 4.600 2.832 2.114 3.552 . 0 0 "[ . 1 . 2]" 1
910 1 65 ASN HB3 1 66 CYS H 4.300 . 6.000 4.144 3.546 4.632 . 0 0 "[ . 1 . 2]" 1
911 1 66 CYS H 1 66 CYS HA 2.900 . 4.200 2.933 2.872 2.951 . 0 0 "[ . 1 . 2]" 1
912 1 66 CYS H 1 66 CYS HB2 3.600 . 5.500 2.657 2.144 3.373 . 0 0 "[ . 1 . 2]" 1
913 1 66 CYS H 1 66 CYS HB3 3.400 . 5.200 3.575 2.990 3.882 . 0 0 "[ . 1 . 2]" 1
914 1 66 CYS H 1 67 VAL H 3.700 . 5.700 4.341 3.777 4.562 . 0 0 "[ . 1 . 2]" 1
915 1 66 CYS HA 1 67 VAL H 2.400 . 3.400 2.294 2.130 2.571 . 0 0 "[ . 1 . 2]" 1
916 1 66 CYS HA 1 67 VAL HA 5.000 . 6.000 4.377 4.265 4.451 . 0 0 "[ . 1 . 2]" 1
917 1 66 CYS HB2 1 67 VAL H 6.000 . 6.000 4.014 2.832 4.570 . 0 0 "[ . 1 . 2]" 1
918 1 66 CYS HB3 1 67 VAL H 3.400 . 5.100 3.183 2.398 4.070 . 0 0 "[ . 1 . 2]" 1
919 1 66 CYS HB3 1 68 ALA H 6.000 . 6.000 4.353 2.312 6.075 0.075 19 0 "[ . 1 . 2]" 1
920 1 67 VAL H 1 67 VAL HB 3.600 . 5.500 3.521 2.754 3.743 . 0 0 "[ . 1 . 2]" 1
921 1 67 VAL H 1 67 VAL MG1 2.900 . 4.200 3.156 2.600 3.844 . 0 0 "[ . 1 . 2]" 1
922 1 67 VAL H 1 68 ALA H 6.000 . 6.000 3.366 2.154 4.520 . 0 0 "[ . 1 . 2]" 1
923 1 67 VAL HA 1 67 VAL MG1 3.400 . 5.100 2.122 1.937 2.287 . 0 0 "[ . 1 . 2]" 1
924 1 67 VAL HA 1 68 ALA H 3.000 . 4.400 3.065 2.106 3.578 . 0 0 "[ . 1 . 2]" 1
925 1 67 VAL HB 1 68 ALA H 2.600 . 3.700 2.861 1.479 3.750 0.050 16 0 "[ . 1 . 2]" 1
926 1 67 VAL MG1 1 68 ALA H 3.700 . 5.700 3.753 2.439 4.263 . 0 0 "[ . 1 . 2]" 1
927 1 67 VAL MG2 1 68 ALA H 6.000 . 6.000 2.995 1.752 4.407 . 0 0 "[ . 1 . 2]" 1
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