NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
407252 |
1y58   |
6463 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1y58
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 442
_Distance_constraint_stats_list.Viol_count 457
_Distance_constraint_stats_list.Viol_total 837.193
_Distance_constraint_stats_list.Viol_max 0.794
_Distance_constraint_stats_list.Viol_rms 0.0422
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0047
_Distance_constraint_stats_list.Viol_average_violations_only 0.0916
_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 CYS 0.009 0.009 17 0 "[ . 1 . 2]"
1 2 ARG 7.336 0.794 14 9 "[* * . ***1 *+* - 2]"
1 3 ARG 9.581 0.794 14 9 "[* * . ***1 *+* - 2]"
1 4 TRP 5.045 0.227 9 0 "[ . 1 . 2]"
1 5 GLN 4.626 0.173 17 0 "[ . 1 . 2]"
1 6 TRP 7.146 0.592 16 2 "[ -. 1 .+ 2]"
1 7 ARG 5.017 0.279 14 0 "[ . 1 . 2]"
1 8 MET 8.898 0.652 16 3 "[ *.- 1 .+ 2]"
1 9 LYS 2.839 0.461 13 0 "[ . 1 . 2]"
1 10 LYS 11.871 0.794 20 12 "[** ** ** ***. *- +]"
1 11 LEU 1.476 0.104 18 0 "[ . 1 . 2]"
1 12 GLY 1.849 0.104 18 0 "[ . 1 . 2]"
1 13 CYS 1.680 0.173 17 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 CYS HA 1 1 CYS HB3 2.700 . 3.600 3.024 3.007 3.027 . 0 0 "[ . 1 . 2]" 1
2 1 1 CYS HA 1 2 ARG H 2.900 . 4.000 3.548 3.537 3.564 . 0 0 "[ . 1 . 2]" 1
3 1 1 CYS HA 1 6 TRP HA 6.000 . 6.000 4.170 3.892 4.482 . 0 0 "[ . 1 . 2]" 1
4 1 1 CYS HA 1 13 CYS HB2 5.200 . 6.000 5.154 5.010 5.289 . 0 0 "[ . 1 . 2]" 1
5 1 1 CYS HA 1 13 CYS HB3 2.800 . 6.000 4.627 4.514 5.080 . 0 0 "[ . 1 . 2]" 1
6 1 1 CYS HB2 1 2 ARG H 3.100 . 4.300 3.791 3.740 3.924 . 0 0 "[ . 1 . 2]" 1
7 1 1 CYS HB2 1 2 ARG HA 6.000 . 6.000 5.938 5.800 5.959 . 0 0 "[ . 1 . 2]" 1
8 1 1 CYS HB2 1 5 GLN HB2 4.300 . 6.000 4.120 3.934 4.729 . 0 0 "[ . 1 . 2]" 1
9 1 1 CYS HB2 1 6 TRP H 5.000 . 6.000 4.750 4.420 5.547 . 0 0 "[ . 1 . 2]" 1
10 1 1 CYS HB2 1 6 TRP HD1 4.700 . 6.000 5.677 5.486 5.921 . 0 0 "[ . 1 . 2]" 1
11 1 1 CYS HB2 1 9 LYS HD3 2.900 . 6.000 4.688 4.000 5.435 . 0 0 "[ . 1 . 2]" 1
12 1 1 CYS HB2 1 12 GLY HA2 4.900 . 6.000 5.027 4.789 5.916 . 0 0 "[ . 1 . 2]" 1
13 1 1 CYS HB2 1 13 CYS HA 4.700 . 6.000 5.870 5.720 6.009 0.009 17 0 "[ . 1 . 2]" 1
14 1 1 CYS HB3 1 2 ARG H 3.700 . 5.500 2.558 2.475 2.633 . 0 0 "[ . 1 . 2]" 1
15 1 1 CYS HB3 1 3 ARG H 6.000 . 6.000 4.001 3.903 4.323 . 0 0 "[ . 1 . 2]" 1
16 1 1 CYS HB3 1 4 TRP H 5.200 . 6.000 4.170 4.034 4.559 . 0 0 "[ . 1 . 2]" 1
17 1 1 CYS HB3 1 4 TRP HD1 6.000 . 6.000 4.138 3.997 4.413 . 0 0 "[ . 1 . 2]" 1
18 1 1 CYS HB3 1 5 GLN H 5.000 . 6.000 3.573 3.372 4.024 . 0 0 "[ . 1 . 2]" 1
19 1 1 CYS HB3 1 5 GLN HA 6.000 . 6.000 4.697 4.535 5.027 . 0 0 "[ . 1 . 2]" 1
20 1 1 CYS HB3 1 5 GLN HB2 4.400 . 6.000 3.094 2.940 3.436 . 0 0 "[ . 1 . 2]" 1
21 1 1 CYS HB3 1 12 GLY HA2 6.000 . 6.000 5.083 4.935 5.650 . 0 0 "[ . 1 . 2]" 1
22 1 1 CYS HB3 1 13 CYS HA 5.200 . 6.000 4.420 4.250 4.570 . 0 0 "[ . 1 . 2]" 1
23 1 2 ARG H 1 2 ARG HB3 2.800 . 3.700 3.037 2.755 3.108 . 0 0 "[ . 1 . 2]" 1
24 1 2 ARG H 1 2 ARG HG3 3.200 . 6.000 4.819 4.524 4.878 . 0 0 "[ . 1 . 2]" 1
25 1 2 ARG H 1 3 ARG H 3.400 . 4.800 2.468 2.252 2.579 . 0 0 "[ . 1 . 2]" 1
26 1 2 ARG H 1 3 ARG HB3 5.000 . 6.000 5.198 5.152 5.256 . 0 0 "[ . 1 . 2]" 1
27 1 2 ARG H 1 4 TRP H 4.500 . 6.000 3.171 3.043 3.270 . 0 0 "[ . 1 . 2]" 1
28 1 2 ARG H 1 5 GLN H 6.000 . 6.000 4.094 3.892 4.170 . 0 0 "[ . 1 . 2]" 1
29 1 2 ARG H 1 5 GLN HA 6.000 . 6.000 6.014 5.858 6.054 0.054 20 0 "[ . 1 . 2]" 1
30 1 2 ARG H 1 5 GLN HB2 4.300 . 6.000 4.883 4.646 4.959 . 0 0 "[ . 1 . 2]" 1
31 1 2 ARG H 1 6 TRP HB2 6.000 . 6.000 5.556 5.341 5.720 . 0 0 "[ . 1 . 2]" 1
32 1 2 ARG H 1 13 CYS HA 5.400 . 6.000 5.418 4.902 5.624 . 0 0 "[ . 1 . 2]" 1
33 1 2 ARG H 1 13 CYS HB2 5.200 . 6.000 3.374 3.094 3.561 . 0 0 "[ . 1 . 2]" 1
34 1 2 ARG H 1 13 CYS HB3 4.200 . 6.000 3.563 3.401 3.614 . 0 0 "[ . 1 . 2]" 1
35 1 2 ARG HA 1 2 ARG HD2 3.700 . 5.400 4.282 2.077 4.695 . 0 0 "[ . 1 . 2]" 1
36 1 2 ARG HA 1 2 ARG HD3 3.700 . 5.400 4.516 2.076 4.869 . 0 0 "[ . 1 . 2]" 1
37 1 2 ARG HA 1 2 ARG HE 4.500 . 6.000 5.143 3.406 5.942 . 0 0 "[ . 1 . 2]" 1
38 1 2 ARG HA 1 2 ARG HG3 2.300 . 3.000 2.625 2.497 3.097 0.097 1 0 "[ . 1 . 2]" 1
39 1 2 ARG HA 1 3 ARG H 2.700 . 3.600 3.590 3.583 3.595 . 0 0 "[ . 1 . 2]" 1
40 1 2 ARG HA 1 3 ARG HA 4.300 . 6.000 4.735 4.702 4.755 . 0 0 "[ . 1 . 2]" 1
41 1 2 ARG HA 1 4 TRP H 5.700 . 6.000 5.205 5.178 5.246 . 0 0 "[ . 1 . 2]" 1
42 1 2 ARG HA 1 4 TRP HD1 6.000 . 6.000 5.118 5.043 5.200 . 0 0 "[ . 1 . 2]" 1
43 1 2 ARG HA 1 4 TRP HE1 6.000 . 6.000 5.423 5.281 5.600 . 0 0 "[ . 1 . 2]" 1
44 1 2 ARG HB3 1 2 ARG HD2 3.600 . 5.200 3.008 2.473 4.231 . 0 0 "[ . 1 . 2]" 1
45 1 2 ARG HB3 1 2 ARG HD3 4.100 . 6.000 2.917 2.456 3.721 . 0 0 "[ . 1 . 2]" 1
46 1 2 ARG HB3 1 2 ARG HE 3.600 . 5.200 4.211 3.352 5.201 0.001 9 0 "[ . 1 . 2]" 1
47 1 2 ARG HB3 1 2 ARG HG3 2.300 . 3.000 2.956 2.452 3.012 0.012 3 0 "[ . 1 . 2]" 1
48 1 2 ARG HB3 1 3 ARG H 2.700 . 3.600 2.178 2.086 2.294 . 0 0 "[ . 1 . 2]" 1
49 1 2 ARG HB3 1 3 ARG HG3 2.700 . 3.600 3.560 2.831 4.394 0.794 14 9 "[* * . ***1 *+* - 2]" 1
50 1 2 ARG HB3 1 4 TRP HD1 3.800 . 5.600 2.759 2.609 2.961 . 0 0 "[ . 1 . 2]" 1
51 1 2 ARG HB3 1 4 TRP HE1 3.400 . 4.800 2.437 2.321 2.596 . 0 0 "[ . 1 . 2]" 1
52 1 2 ARG HB3 1 4 TRP HZ2 5.800 . 6.000 5.121 5.006 5.279 . 0 0 "[ . 1 . 2]" 1
53 1 2 ARG HB3 1 5 GLN H 5.500 . 6.000 4.094 3.942 4.357 . 0 0 "[ . 1 . 2]" 1
54 1 2 ARG HD2 1 2 ARG HE 2.900 . 3.900 2.671 2.269 2.817 . 0 0 "[ . 1 . 2]" 1
55 1 2 ARG HD2 1 2 ARG HG3 2.500 . 3.300 2.590 2.432 3.017 . 0 0 "[ . 1 . 2]" 1
56 1 2 ARG HD2 1 3 ARG HE 5.900 . 6.000 4.542 3.228 5.797 . 0 0 "[ . 1 . 2]" 1
57 1 2 ARG HD2 1 3 ARG HG3 5.000 . 6.000 4.674 2.969 5.994 . 0 0 "[ . 1 . 2]" 1
58 1 2 ARG HD2 1 4 TRP HE1 5.100 . 6.000 3.497 2.175 5.508 . 0 0 "[ . 1 . 2]" 1
59 1 2 ARG HD3 1 2 ARG HE 2.800 . 3.800 2.643 2.269 2.822 . 0 0 "[ . 1 . 2]" 1
60 1 2 ARG HD3 1 2 ARG HG3 2.600 . 3.400 2.846 2.435 3.018 . 0 0 "[ . 1 . 2]" 1
61 1 2 ARG HD3 1 4 TRP HD1 6.000 . 6.000 4.765 3.902 6.227 0.227 9 0 "[ . 1 . 2]" 1
62 1 2 ARG HD3 1 4 TRP HE1 4.800 . 6.000 2.997 1.963 5.650 . 0 0 "[ . 1 . 2]" 1
63 1 2 ARG HE 1 4 TRP HE1 4.500 . 6.000 4.536 3.355 6.008 0.008 9 0 "[ . 1 . 2]" 1
64 1 2 ARG HG3 1 3 ARG H 3.200 . 4.400 4.255 3.201 4.486 0.086 11 0 "[ . 1 . 2]" 1
65 1 2 ARG HG3 1 3 ARG HA 4.700 . 6.000 5.639 4.450 5.942 . 0 0 "[ . 1 . 2]" 1
66 1 2 ARG HG3 1 3 ARG HE 5.600 . 6.000 5.078 3.467 5.781 . 0 0 "[ . 1 . 2]" 1
67 1 2 ARG HG3 1 4 TRP HD1 4.800 . 6.000 5.344 4.159 5.670 . 0 0 "[ . 1 . 2]" 1
68 1 2 ARG HG3 1 4 TRP HE1 4.300 . 6.000 4.599 3.602 4.925 . 0 0 "[ . 1 . 2]" 1
69 1 3 ARG H 1 3 ARG HA 2.700 . 3.600 2.818 2.805 2.844 . 0 0 "[ . 1 . 2]" 1
70 1 3 ARG H 1 3 ARG HB2 3.200 . 4.500 4.026 4.010 4.048 . 0 0 "[ . 1 . 2]" 1
71 1 3 ARG H 1 3 ARG HB3 2.700 . 3.600 3.622 3.553 3.671 0.071 5 0 "[ . 1 . 2]" 1
72 1 3 ARG H 1 3 ARG HD3 4.700 . 6.000 4.787 4.508 5.051 . 0 0 "[ . 1 . 2]" 1
73 1 3 ARG H 1 3 ARG HE 5.200 . 6.000 4.799 4.489 5.096 . 0 0 "[ . 1 . 2]" 1
74 1 3 ARG H 1 3 ARG HG3 2.600 . 3.400 3.040 2.667 3.474 0.074 7 0 "[ . 1 . 2]" 1
75 1 3 ARG H 1 4 TRP H 2.600 . 3.400 1.900 1.849 1.968 . 0 0 "[ . 1 . 2]" 1
76 1 3 ARG H 1 4 TRP HD1 3.500 . 6.000 1.757 1.674 1.831 . 0 0 "[ . 1 . 2]" 1
77 1 3 ARG H 1 5 GLN H 6.000 . 6.000 3.208 3.133 3.312 . 0 0 "[ . 1 . 2]" 1
78 1 3 ARG HA 1 3 ARG HB2 2.600 . 3.500 2.514 2.468 2.548 . 0 0 "[ . 1 . 2]" 1
79 1 3 ARG HA 1 3 ARG HB3 2.400 . 3.100 2.381 2.341 2.432 . 0 0 "[ . 1 . 2]" 1
80 1 3 ARG HA 1 3 ARG HD3 4.400 . 6.000 4.589 4.422 4.783 . 0 0 "[ . 1 . 2]" 1
81 1 3 ARG HA 1 3 ARG HE 6.000 . 6.000 5.950 5.844 5.997 . 0 0 "[ . 1 . 2]" 1
82 1 3 ARG HA 1 3 ARG HG3 3.400 . 4.800 3.698 3.626 3.810 . 0 0 "[ . 1 . 2]" 1
83 1 3 ARG HA 1 4 TRP H 3.100 . 4.300 2.918 2.861 2.969 . 0 0 "[ . 1 . 2]" 1
84 1 3 ARG HA 1 4 TRP HA 6.000 . 6.000 4.347 4.327 4.371 . 0 0 "[ . 1 . 2]" 1
85 1 3 ARG HA 1 4 TRP HD1 5.900 . 6.000 4.016 3.925 4.109 . 0 0 "[ . 1 . 2]" 1
86 1 3 ARG HA 1 5 GLN H 6.000 . 6.000 5.197 5.046 5.331 . 0 0 "[ . 1 . 2]" 1
87 1 3 ARG HA 1 6 TRP H 5.800 . 6.000 5.710 5.407 5.927 . 0 0 "[ . 1 . 2]" 1
88 1 3 ARG HA 1 6 TRP HD1 3.900 . 5.800 3.002 2.829 3.205 . 0 0 "[ . 1 . 2]" 1
89 1 3 ARG HA 1 6 TRP HE1 5.000 . 6.000 2.457 1.977 2.869 . 0 0 "[ . 1 . 2]" 1
90 1 3 ARG HA 1 6 TRP HZ2 3.500 . 6.000 5.027 4.435 5.492 . 0 0 "[ . 1 . 2]" 1
91 1 3 ARG HB2 1 3 ARG HD3 2.800 . 3.800 2.716 2.395 3.101 . 0 0 "[ . 1 . 2]" 1
92 1 3 ARG HB2 1 3 ARG HE 4.600 . 6.000 4.581 4.426 4.769 . 0 0 "[ . 1 . 2]" 1
93 1 3 ARG HB2 1 3 ARG HG3 2.600 . 3.500 2.744 2.401 3.009 . 0 0 "[ . 1 . 2]" 1
94 1 3 ARG HB2 1 4 TRP HD1 5.200 . 6.000 4.709 4.611 4.774 . 0 0 "[ . 1 . 2]" 1
95 1 3 ARG HB2 1 6 TRP HD1 6.000 . 6.000 5.474 5.357 5.651 . 0 0 "[ . 1 . 2]" 1
96 1 3 ARG HB3 1 3 ARG HD3 2.800 . 3.800 3.110 2.415 3.660 . 0 0 "[ . 1 . 2]" 1
97 1 3 ARG HB3 1 3 ARG HE 4.400 . 6.000 4.815 4.397 5.277 . 0 0 "[ . 1 . 2]" 1
98 1 3 ARG HB3 1 4 TRP HD1 4.400 . 6.000 4.838 4.724 4.966 . 0 0 "[ . 1 . 2]" 1
99 1 3 ARG HB3 1 4 TRP HE1 6.000 . 6.000 5.778 5.529 5.995 . 0 0 "[ . 1 . 2]" 1
100 1 3 ARG HB3 1 6 TRP HD1 5.000 . 6.000 5.201 4.971 5.358 . 0 0 "[ . 1 . 2]" 1
101 1 3 ARG HB3 1 6 TRP HE1 6.000 . 6.000 4.709 4.229 5.155 . 0 0 "[ . 1 . 2]" 1
102 1 3 ARG HD3 1 3 ARG HE 2.800 . 3.700 2.807 2.784 2.826 . 0 0 "[ . 1 . 2]" 1
103 1 3 ARG HD3 1 3 ARG HG3 2.700 . 3.600 3.016 3.015 3.017 . 0 0 "[ . 1 . 2]" 1
104 1 3 ARG HD3 1 4 TRP HE1 6.000 . 6.000 5.250 4.936 5.596 . 0 0 "[ . 1 . 2]" 1
105 1 3 ARG HE 1 3 ARG HG3 2.900 . 3.900 2.821 2.508 3.178 . 0 0 "[ . 1 . 2]" 1
106 1 3 ARG HE 1 4 TRP HB3 5.400 . 6.000 5.098 4.280 5.872 . 0 0 "[ . 1 . 2]" 1
107 1 3 ARG HE 1 4 TRP HE1 5.100 . 6.000 3.385 2.820 3.928 . 0 0 "[ . 1 . 2]" 1
108 1 3 ARG HE 1 4 TRP HZ2 4.100 . 6.000 3.672 3.091 4.254 . 0 0 "[ . 1 . 2]" 1
109 1 3 ARG HE 1 13 CYS HB2 6.000 . 6.000 5.326 4.724 6.061 0.061 17 0 "[ . 1 . 2]" 1
110 1 3 ARG HG3 1 4 TRP HD1 3.400 . 4.800 3.404 3.138 3.639 . 0 0 "[ . 1 . 2]" 1
111 1 3 ARG HG3 1 4 TRP HE1 4.100 . 6.000 3.669 3.301 3.858 . 0 0 "[ . 1 . 2]" 1
112 1 3 ARG HG3 1 6 TRP HD1 2.800 . 6.000 6.085 5.854 6.346 0.346 7 0 "[ . 1 . 2]" 1
113 1 4 TRP H 1 4 TRP HA 2.700 . 3.600 2.796 2.787 2.809 . 0 0 "[ . 1 . 2]" 1
114 1 4 TRP H 1 4 TRP HB2 3.300 . 4.700 3.987 3.973 4.007 . 0 0 "[ . 1 . 2]" 1
115 1 4 TRP H 1 4 TRP HB3 3.500 . 5.000 3.772 3.747 3.789 . 0 0 "[ . 1 . 2]" 1
116 1 4 TRP H 1 4 TRP HD1 2.000 . 2.500 1.912 1.854 1.965 . 0 0 "[ . 1 . 2]" 1
117 1 4 TRP H 1 4 TRP HE1 5.400 . 6.000 4.434 4.381 4.490 . 0 0 "[ . 1 . 2]" 1
118 1 4 TRP H 1 5 GLN HA 5.200 . 6.000 4.534 4.476 4.585 . 0 0 "[ . 1 . 2]" 1
119 1 4 TRP H 1 6 TRP H 3.700 . 5.400 3.420 3.163 3.585 . 0 0 "[ . 1 . 2]" 1
120 1 4 TRP H 1 6 TRP HB2 4.900 . 6.000 5.568 5.497 5.644 . 0 0 "[ . 1 . 2]" 1
121 1 4 TRP H 1 6 TRP HE1 4.200 . 6.000 2.994 2.790 3.131 . 0 0 "[ . 1 . 2]" 1
122 1 4 TRP H 1 13 CYS HB3 4.800 . 6.000 4.159 4.029 4.336 . 0 0 "[ . 1 . 2]" 1
123 1 4 TRP HA 1 4 TRP HB2 2.600 . 3.500 2.590 2.573 2.607 . 0 0 "[ . 1 . 2]" 1
124 1 4 TRP HA 1 4 TRP HB3 2.600 . 3.400 2.308 2.298 2.321 . 0 0 "[ . 1 . 2]" 1
125 1 4 TRP HA 1 4 TRP HD1 3.600 . 5.200 3.768 3.754 3.778 . 0 0 "[ . 1 . 2]" 1
126 1 4 TRP HA 1 4 TRP HE1 6.000 . 6.000 6.094 6.087 6.103 0.103 12 0 "[ . 1 . 2]" 1
127 1 4 TRP HA 1 5 GLN H 3.100 . 4.300 3.562 3.550 3.569 . 0 0 "[ . 1 . 2]" 1
128 1 4 TRP HA 1 5 GLN HB2 5.400 . 6.000 5.750 5.692 5.778 . 0 0 "[ . 1 . 2]" 1
129 1 4 TRP HA 1 5 GLN HG3 6.000 . 6.000 6.049 5.964 6.091 0.091 16 0 "[ . 1 . 2]" 1
130 1 4 TRP HA 1 6 TRP H 4.300 . 6.000 3.881 3.802 3.991 . 0 0 "[ . 1 . 2]" 1
131 1 4 TRP HA 1 6 TRP HD1 3.900 . 5.800 4.658 4.382 5.031 . 0 0 "[ . 1 . 2]" 1
132 1 4 TRP HA 1 6 TRP HE1 4.100 . 6.000 3.028 2.779 3.407 . 0 0 "[ . 1 . 2]" 1
133 1 4 TRP HA 1 6 TRP HE3 4.500 . 6.000 5.285 5.052 5.436 . 0 0 "[ . 1 . 2]" 1
134 1 4 TRP HA 1 6 TRP HH2 4.000 . 6.000 4.044 3.649 4.357 . 0 0 "[ . 1 . 2]" 1
135 1 4 TRP HA 1 6 TRP HZ3 4.300 . 6.000 5.150 4.763 5.438 . 0 0 "[ . 1 . 2]" 1
136 1 4 TRP HA 1 7 ARG H 5.400 . 6.000 5.583 5.363 5.686 . 0 0 "[ . 1 . 2]" 1
137 1 4 TRP HA 1 8 MET H 5.900 . 6.000 5.876 5.548 6.004 0.004 20 0 "[ . 1 . 2]" 1
138 1 4 TRP HB2 1 4 TRP HD1 3.000 . 4.100 3.684 3.638 3.721 . 0 0 "[ . 1 . 2]" 1
139 1 4 TRP HB2 1 4 TRP HE3 3.100 . 4.300 2.804 2.733 2.889 . 0 0 "[ . 1 . 2]" 1
140 1 4 TRP HB2 1 5 GLN H 3.400 . 4.800 3.207 3.079 3.325 . 0 0 "[ . 1 . 2]" 1
141 1 4 TRP HB2 1 5 GLN HG3 5.200 . 6.000 4.602 4.399 4.765 . 0 0 "[ . 1 . 2]" 1
142 1 4 TRP HB2 1 6 TRP HE1 5.600 . 6.000 5.481 5.299 5.756 . 0 0 "[ . 1 . 2]" 1
143 1 4 TRP HB3 1 4 TRP HD1 3.200 . 4.500 3.589 3.539 3.644 . 0 0 "[ . 1 . 2]" 1
144 1 4 TRP HB3 1 4 TRP HE3 3.100 . 4.300 3.003 2.914 3.083 . 0 0 "[ . 1 . 2]" 1
145 1 4 TRP HB3 1 4 TRP HZ3 5.500 . 6.000 5.305 5.229 5.373 . 0 0 "[ . 1 . 2]" 1
146 1 4 TRP HB3 1 5 GLN H 4.200 . 6.000 3.957 3.909 4.000 . 0 0 "[ . 1 . 2]" 1
147 1 4 TRP HB3 1 6 TRP HE1 6.000 . 6.000 4.741 4.589 4.982 . 0 0 "[ . 1 . 2]" 1
148 1 4 TRP HD1 1 5 GLN H 2.800 . 3.800 1.917 1.854 2.021 . 0 0 "[ . 1 . 2]" 1
149 1 4 TRP HD1 1 5 GLN HA 5.400 . 6.000 4.794 4.723 4.906 . 0 0 "[ . 1 . 2]" 1
150 1 4 TRP HD1 1 5 GLN HB2 4.800 . 6.000 3.661 3.618 3.775 . 0 0 "[ . 1 . 2]" 1
151 1 4 TRP HD1 1 5 GLN HG3 5.100 . 6.000 5.639 5.525 5.825 . 0 0 "[ . 1 . 2]" 1
152 1 4 TRP HD1 1 6 TRP H 5.500 . 6.000 4.680 4.453 4.855 . 0 0 "[ . 1 . 2]" 1
153 1 4 TRP HD1 1 6 TRP HE1 5.800 . 6.000 4.726 4.587 4.861 . 0 0 "[ . 1 . 2]" 1
154 1 4 TRP HD1 1 13 CYS HA 6.000 . 6.000 3.215 3.108 3.391 . 0 0 "[ . 1 . 2]" 1
155 1 4 TRP HD1 1 13 CYS HB3 4.600 . 6.000 3.307 3.135 3.434 . 0 0 "[ . 1 . 2]" 1
156 1 4 TRP HE1 1 5 GLN QE 5.900 . 6.000 5.139 5.010 5.414 . 0 0 "[ . 1 . 2]" 1
157 1 4 TRP HE1 1 11 LEU HB3 6.000 . 6.000 5.654 5.441 5.919 . 0 0 "[ . 1 . 2]" 1
158 1 4 TRP HE1 1 13 CYS HB3 4.100 . 6.000 3.596 3.416 3.777 . 0 0 "[ . 1 . 2]" 1
159 1 4 TRP HE3 1 5 GLN QE 4.600 . 6.000 2.737 2.698 2.822 . 0 0 "[ . 1 . 2]" 1
160 1 4 TRP HE3 1 5 GLN HG3 5.600 . 6.000 6.093 6.069 6.111 0.111 13 0 "[ . 1 . 2]" 1
161 1 4 TRP HE3 1 11 LEU HB3 4.800 . 6.000 5.220 5.019 5.366 . 0 0 "[ . 1 . 2]" 1
162 1 4 TRP HE3 1 11 LEU MD2 6.000 . 6.000 3.983 3.598 4.386 . 0 0 "[ . 1 . 2]" 1
163 1 4 TRP HH2 1 11 LEU MD1 6.000 . 6.000 4.850 4.751 4.965 . 0 0 "[ . 1 . 2]" 1
164 1 4 TRP HH2 1 11 LEU HG 4.100 . 6.000 4.799 4.574 4.957 . 0 0 "[ . 1 . 2]" 1
165 1 4 TRP HZ2 1 11 LEU HG 4.000 . 6.000 4.705 4.534 4.924 . 0 0 "[ . 1 . 2]" 1
166 1 4 TRP HZ2 1 13 CYS HB3 4.900 . 6.000 5.852 5.610 6.018 0.018 8 0 "[ . 1 . 2]" 1
167 1 5 GLN H 1 5 GLN HA 2.900 . 3.900 2.895 2.883 2.910 . 0 0 "[ . 1 . 2]" 1
168 1 5 GLN H 1 5 GLN HB2 2.400 . 6.000 2.296 2.283 2.312 . 0 0 "[ . 1 . 2]" 1
169 1 5 GLN H 1 5 GLN HG3 3.000 . 4.100 3.899 3.816 4.026 . 0 0 "[ . 1 . 2]" 1
170 1 5 GLN H 1 6 TRP H 3.100 . 4.300 3.342 3.154 3.454 . 0 0 "[ . 1 . 2]" 1
171 1 5 GLN H 1 6 TRP HA 4.700 . 6.000 4.911 4.831 4.977 . 0 0 "[ . 1 . 2]" 1
172 1 5 GLN H 1 6 TRP HE1 6.000 . 6.000 5.085 4.988 5.171 . 0 0 "[ . 1 . 2]" 1
173 1 5 GLN H 1 7 ARG H 5.000 . 6.000 5.506 5.259 5.650 . 0 0 "[ . 1 . 2]" 1
174 1 5 GLN H 1 9 LYS QG 4.200 . 6.000 5.275 5.015 5.586 . 0 0 "[ . 1 . 2]" 1
175 1 5 GLN H 1 13 CYS HB2 5.400 . 6.000 3.275 3.169 3.668 . 0 0 "[ . 1 . 2]" 1
176 1 5 GLN H 1 13 CYS HB3 4.200 . 6.000 2.800 2.645 2.977 . 0 0 "[ . 1 . 2]" 1
177 1 5 GLN HA 1 5 GLN QE 4.400 . 6.000 3.089 3.005 3.204 . 0 0 "[ . 1 . 2]" 1
178 1 5 GLN HA 1 5 GLN HG3 2.100 . 2.600 2.304 2.275 2.328 . 0 0 "[ . 1 . 2]" 1
179 1 5 GLN HA 1 6 TRP H 2.500 . 3.300 2.679 2.600 2.818 . 0 0 "[ . 1 . 2]" 1
180 1 5 GLN HA 1 6 TRP HA 5.200 . 6.000 4.561 4.511 4.621 . 0 0 "[ . 1 . 2]" 1
181 1 5 GLN HA 1 6 TRP HB2 5.300 . 6.000 5.783 5.743 5.851 . 0 0 "[ . 1 . 2]" 1
182 1 5 GLN HA 1 6 TRP HE3 5.600 . 6.000 4.707 4.603 4.800 . 0 0 "[ . 1 . 2]" 1
183 1 5 GLN HA 1 6 TRP HZ3 5.400 . 6.000 5.527 5.380 5.659 . 0 0 "[ . 1 . 2]" 1
184 1 5 GLN HA 1 7 ARG H 3.800 . 5.600 3.748 3.478 3.891 . 0 0 "[ . 1 . 2]" 1
185 1 5 GLN HA 1 8 MET HB2 4.700 . 6.000 4.084 2.877 4.590 . 0 0 "[ . 1 . 2]" 1
186 1 5 GLN HA 1 8 MET HB3 5.900 . 6.000 4.799 4.029 5.215 . 0 0 "[ . 1 . 2]" 1
187 1 5 GLN HA 1 8 MET HG2 5.200 . 6.000 3.959 3.230 5.864 . 0 0 "[ . 1 . 2]" 1
188 1 5 GLN HA 1 8 MET HG3 4.300 . 6.000 3.173 2.323 5.438 . 0 0 "[ . 1 . 2]" 1
189 1 5 GLN HA 1 9 LYS H 4.800 . 6.000 4.092 3.981 4.255 . 0 0 "[ . 1 . 2]" 1
190 1 5 GLN HA 1 9 LYS HA 3.100 . 4.300 2.938 2.744 3.224 . 0 0 "[ . 1 . 2]" 1
191 1 5 GLN HA 1 11 LEU HB3 6.000 . 6.000 5.568 5.279 5.789 . 0 0 "[ . 1 . 2]" 1
192 1 5 GLN HA 1 13 CYS HB3 3.800 . 5.600 4.421 4.327 4.493 . 0 0 "[ . 1 . 2]" 1
193 1 5 GLN HB2 1 5 GLN QE 3.700 . 5.400 3.848 3.829 3.865 . 0 0 "[ . 1 . 2]" 1
194 1 5 GLN HB2 1 6 TRP H 3.600 . 5.300 4.402 4.307 4.464 . 0 0 "[ . 1 . 2]" 1
195 1 5 GLN HB2 1 9 LYS HA 5.000 . 6.000 3.402 3.270 3.602 . 0 0 "[ . 1 . 2]" 1
196 1 5 GLN HB2 1 12 GLY H 5.100 . 6.000 3.592 3.465 3.710 . 0 0 "[ . 1 . 2]" 1
197 1 5 GLN QE 1 5 GLN HG3 2.200 . 2.800 2.067 2.056 2.081 . 0 0 "[ . 1 . 2]" 1
198 1 5 GLN QE 1 8 MET ME 4.400 . 6.000 3.317 2.570 4.914 . 0 0 "[ . 1 . 2]" 1
199 1 5 GLN QE 1 8 MET HG2 6.000 . 6.000 4.874 4.311 5.839 . 0 0 "[ . 1 . 2]" 1
200 1 5 GLN QE 1 8 MET HG3 4.700 . 6.000 3.602 2.754 5.720 . 0 0 "[ . 1 . 2]" 1
201 1 5 GLN QE 1 9 LYS H 6.000 . 6.000 5.832 5.736 5.876 . 0 0 "[ . 1 . 2]" 1
202 1 5 GLN QE 1 9 LYS HA 6.000 . 6.000 4.378 4.173 4.619 . 0 0 "[ . 1 . 2]" 1
203 1 5 GLN QE 1 10 LYS H 5.100 . 6.000 3.432 3.101 3.701 . 0 0 "[ . 1 . 2]" 1
204 1 5 GLN QE 1 10 LYS HD3 5.600 . 6.000 4.006 2.744 4.609 . 0 0 "[ . 1 . 2]" 1
205 1 5 GLN QE 1 10 LYS HE3 4.600 . 6.000 4.163 2.412 5.793 . 0 0 "[ . 1 . 2]" 1
206 1 5 GLN QE 1 10 LYS HG2 2.500 . 3.300 2.672 2.110 2.974 . 0 0 "[ . 1 . 2]" 1
207 1 5 GLN QE 1 10 LYS HG3 3.100 . 4.300 3.300 2.767 3.566 . 0 0 "[ . 1 . 2]" 1
208 1 5 GLN QE 1 11 LEU H 5.900 . 6.000 3.151 2.978 3.239 . 0 0 "[ . 1 . 2]" 1
209 1 5 GLN QE 1 11 LEU HA 6.000 . 6.000 5.276 5.248 5.299 . 0 0 "[ . 1 . 2]" 1
210 1 5 GLN QE 1 11 LEU HB3 3.300 . 4.600 3.071 2.986 3.164 . 0 0 "[ . 1 . 2]" 1
211 1 5 GLN QE 1 11 LEU HG 6.000 . 6.000 5.104 4.965 5.276 . 0 0 "[ . 1 . 2]" 1
212 1 5 GLN QE 1 13 CYS HA 5.600 . 6.000 4.186 4.131 4.290 . 0 0 "[ . 1 . 2]" 1
213 1 5 GLN HG3 1 6 TRP H 4.300 . 6.000 4.959 4.874 5.070 . 0 0 "[ . 1 . 2]" 1
214 1 5 GLN HG3 1 7 ARG H 5.200 . 6.000 5.876 5.608 6.004 0.004 14 0 "[ . 1 . 2]" 1
215 1 5 GLN HG3 1 8 MET H 4.800 . 6.000 5.035 4.840 5.201 . 0 0 "[ . 1 . 2]" 1
216 1 5 GLN HG3 1 9 LYS H 6.000 . 6.000 4.493 4.399 4.579 . 0 0 "[ . 1 . 2]" 1
217 1 5 GLN HG3 1 9 LYS HA 3.400 . 4.900 2.488 2.268 2.763 . 0 0 "[ . 1 . 2]" 1
218 1 5 GLN HG3 1 10 LYS HG2 2.200 . 6.000 2.759 2.409 2.935 . 0 0 "[ . 1 . 2]" 1
219 1 5 GLN HG3 1 10 LYS HG3 2.800 . 3.800 3.625 3.347 3.765 . 0 0 "[ . 1 . 2]" 1
220 1 5 GLN HG3 1 11 LEU H 3.100 . 4.300 2.478 2.356 2.614 . 0 0 "[ . 1 . 2]" 1
221 1 5 GLN HG3 1 11 LEU HA 6.000 . 6.000 5.225 5.044 5.405 . 0 0 "[ . 1 . 2]" 1
222 1 5 GLN HG3 1 11 LEU HG 4.200 . 6.000 5.858 5.571 6.037 0.037 20 0 "[ . 1 . 2]" 1
223 1 5 GLN HG3 1 12 GLY H 5.500 . 6.000 3.003 2.822 3.229 . 0 0 "[ . 1 . 2]" 1
224 1 5 GLN HG3 1 13 CYS HB2 5.900 . 6.000 6.062 6.031 6.173 0.173 17 0 "[ . 1 . 2]" 1
225 1 5 GLN HG3 1 13 CYS HB3 6.000 . 6.000 4.821 4.722 4.892 . 0 0 "[ . 1 . 2]" 1
226 1 6 TRP H 1 6 TRP HA 2.700 . 3.600 2.901 2.883 2.918 . 0 0 "[ . 1 . 2]" 1
227 1 6 TRP H 1 6 TRP HB2 2.600 . 3.400 3.309 3.267 3.334 . 0 0 "[ . 1 . 2]" 1
228 1 6 TRP H 1 6 TRP HD1 3.200 . 4.400 3.782 3.706 3.905 . 0 0 "[ . 1 . 2]" 1
229 1 6 TRP H 1 6 TRP HE1 5.600 . 6.000 4.409 4.358 4.504 . 0 0 "[ . 1 . 2]" 1
230 1 6 TRP H 1 6 TRP HE3 3.600 . 5.200 2.892 2.773 2.992 . 0 0 "[ . 1 . 2]" 1
231 1 6 TRP H 1 6 TRP HZ2 4.600 . 6.000 5.020 4.992 5.050 . 0 0 "[ . 1 . 2]" 1
232 1 6 TRP H 1 6 TRP HZ3 5.700 . 6.000 4.477 4.359 4.577 . 0 0 "[ . 1 . 2]" 1
233 1 6 TRP H 1 7 ARG H 2.600 . 3.400 2.315 2.183 2.397 . 0 0 "[ . 1 . 2]" 1
234 1 6 TRP H 1 7 ARG HA 6.000 . 6.000 4.982 4.887 5.054 . 0 0 "[ . 1 . 2]" 1
235 1 6 TRP H 1 7 ARG HB2 6.000 . 6.000 4.721 4.660 4.753 . 0 0 "[ . 1 . 2]" 1
236 1 6 TRP H 1 7 ARG HB3 6.000 . 6.000 6.017 5.948 6.045 0.045 1 0 "[ . 1 . 2]" 1
237 1 6 TRP H 1 7 ARG HG2 6.000 . 6.000 4.584 4.386 4.771 . 0 0 "[ . 1 . 2]" 1
238 1 6 TRP H 1 7 ARG HG3 6.000 . 6.000 6.005 5.886 6.052 0.052 8 0 "[ . 1 . 2]" 1
239 1 6 TRP H 1 8 MET H 4.000 . 6.000 3.379 3.261 3.494 . 0 0 "[ . 1 . 2]" 1
240 1 6 TRP H 1 8 MET HB2 6.000 . 6.000 5.648 4.366 6.089 0.089 12 0 "[ . 1 . 2]" 1
241 1 6 TRP H 1 8 MET HB3 6.000 . 6.000 5.915 5.750 6.043 0.043 16 0 "[ . 1 . 2]" 1
242 1 6 TRP H 1 9 LYS H 5.800 . 6.000 5.338 5.136 5.588 . 0 0 "[ . 1 . 2]" 1
243 1 6 TRP H 1 9 LYS HA 6.000 . 6.000 4.968 4.831 5.176 . 0 0 "[ . 1 . 2]" 1
244 1 6 TRP H 1 9 LYS QG 4.700 . 6.000 4.260 4.062 4.510 . 0 0 "[ . 1 . 2]" 1
245 1 6 TRP H 1 13 CYS HB3 5.800 . 6.000 4.912 4.742 5.070 . 0 0 "[ . 1 . 2]" 1
246 1 6 TRP HA 1 6 TRP HB2 2.500 . 3.300 2.832 2.814 2.853 . 0 0 "[ . 1 . 2]" 1
247 1 6 TRP HA 1 6 TRP HD1 3.900 . 5.800 4.080 4.024 4.169 . 0 0 "[ . 1 . 2]" 1
248 1 6 TRP HA 1 6 TRP HE3 3.700 . 5.400 4.421 4.347 4.484 . 0 0 "[ . 1 . 2]" 1
249 1 6 TRP HA 1 7 ARG H 2.700 . 3.600 3.505 3.462 3.523 . 0 0 "[ . 1 . 2]" 1
250 1 6 TRP HA 1 7 ARG HA 4.400 . 6.000 4.583 4.533 4.607 . 0 0 "[ . 1 . 2]" 1
251 1 6 TRP HA 1 7 ARG HE 4.700 . 6.000 4.571 3.906 6.047 0.047 15 0 "[ . 1 . 2]" 1
252 1 6 TRP HA 1 8 MET H 4.800 . 6.000 5.068 4.894 5.151 . 0 0 "[ . 1 . 2]" 1
253 1 6 TRP HA 1 9 LYS H 5.000 . 6.000 5.680 5.518 5.812 . 0 0 "[ . 1 . 2]" 1
254 1 6 TRP HA 1 9 LYS HA 6.000 . 6.000 5.374 5.287 5.499 . 0 0 "[ . 1 . 2]" 1
255 1 6 TRP HA 1 9 LYS HB3 4.200 . 6.000 6.019 5.894 6.086 0.086 15 0 "[ . 1 . 2]" 1
256 1 6 TRP HB2 1 6 TRP HD1 3.400 . 4.800 3.687 3.656 3.717 . 0 0 "[ . 1 . 2]" 1
257 1 6 TRP HB2 1 6 TRP HE1 4.900 . 6.000 5.185 5.171 5.196 . 0 0 "[ . 1 . 2]" 1
258 1 6 TRP HB2 1 6 TRP HE3 2.400 . 6.000 2.827 2.787 2.896 . 0 0 "[ . 1 . 2]" 1
259 1 6 TRP HB2 1 7 ARG H 2.900 . 6.000 2.907 2.738 3.171 . 0 0 "[ . 1 . 2]" 1
260 1 6 TRP HB2 1 7 ARG HA 5.000 . 6.000 4.223 4.134 4.363 . 0 0 "[ . 1 . 2]" 1
261 1 6 TRP HB2 1 7 ARG HB3 6.000 . 6.000 5.301 5.256 5.366 . 0 0 "[ . 1 . 2]" 1
262 1 6 TRP HB2 1 7 ARG HE 3.800 . 5.600 3.636 2.922 5.341 . 0 0 "[ . 1 . 2]" 1
263 1 6 TRP HB2 1 8 MET H 2.400 . 6.000 4.851 4.756 4.956 . 0 0 "[ . 1 . 2]" 1
264 1 6 TRP HD1 1 7 ARG H 3.200 . 6.000 5.316 5.257 5.411 . 0 0 "[ . 1 . 2]" 1
265 1 6 TRP HD1 1 13 CYS HB2 3.100 . 6.000 5.990 5.820 6.068 0.068 17 0 "[ . 1 . 2]" 1
266 1 6 TRP HD1 1 13 CYS HB3 3.700 . 6.000 5.937 5.841 6.021 0.021 8 0 "[ . 1 . 2]" 1
267 1 6 TRP HE3 1 7 ARG HA 4.300 . 6.000 3.803 3.724 3.900 . 0 0 "[ . 1 . 2]" 1
268 1 6 TRP HE3 1 7 ARG HB2 3.700 . 5.400 2.282 2.167 2.379 . 0 0 "[ . 1 . 2]" 1
269 1 6 TRP HE3 1 7 ARG HB3 4.900 . 6.000 3.781 3.672 3.894 . 0 0 "[ . 1 . 2]" 1
270 1 6 TRP HE3 1 7 ARG HD2 5.500 . 6.000 4.653 3.649 4.952 . 0 0 "[ . 1 . 2]" 1
271 1 6 TRP HE3 1 7 ARG HG2 4.000 . 6.000 2.220 1.880 2.485 0.120 15 0 "[ . 1 . 2]" 1
272 1 6 TRP HE3 1 7 ARG HG3 4.800 . 6.000 3.245 3.117 3.370 . 0 0 "[ . 1 . 2]" 1
273 1 6 TRP HE3 1 8 MET HA 6.000 . 6.000 5.508 5.470 5.539 . 0 0 "[ . 1 . 2]" 1
274 1 6 TRP HE3 1 8 MET HB2 6.000 . 6.000 5.637 4.443 6.054 0.054 14 0 "[ . 1 . 2]" 1
275 1 6 TRP HE3 1 8 MET HB3 6.000 . 6.000 5.279 4.940 6.032 0.032 15 0 "[ . 1 . 2]" 1
276 1 6 TRP HE3 1 8 MET HG2 6.000 . 6.000 3.773 3.243 5.897 . 0 0 "[ . 1 . 2]" 1
277 1 6 TRP HE3 1 9 LYS QG 6.000 . 6.000 5.293 5.116 5.722 . 0 0 "[ . 1 . 2]" 1
278 1 6 TRP HH2 1 7 ARG H 5.900 . 6.000 5.349 5.301 5.407 . 0 0 "[ . 1 . 2]" 1
279 1 6 TRP HH2 1 8 MET HG2 6.000 . 6.000 4.415 3.802 6.592 0.592 16 2 "[ -. 1 .+ 2]" 1
280 1 6 TRP HZ2 1 7 ARG H 3.800 . 6.000 5.937 5.873 5.997 . 0 0 "[ . 1 . 2]" 1
281 1 6 TRP HZ3 1 7 ARG H 4.600 . 6.000 3.526 3.493 3.565 . 0 0 "[ . 1 . 2]" 1
282 1 6 TRP HZ3 1 7 ARG HB3 4.200 . 6.000 4.552 4.380 4.769 . 0 0 "[ . 1 . 2]" 1
283 1 6 TRP HZ3 1 7 ARG HG3 3.500 . 5.100 4.056 3.886 4.280 . 0 0 "[ . 1 . 2]" 1
284 1 6 TRP HZ3 1 8 MET ME 4.800 . 6.000 4.122 2.285 5.843 . 0 0 "[ . 1 . 2]" 1
285 1 6 TRP HZ3 1 8 MET HG2 4.800 . 6.000 3.047 2.528 4.954 . 0 0 "[ . 1 . 2]" 1
286 1 6 TRP HZ3 1 8 MET HG3 6.000 . 6.000 4.133 2.941 4.591 . 0 0 "[ . 1 . 2]" 1
287 1 7 ARG H 1 7 ARG HA 2.700 . 3.600 2.943 2.936 2.947 . 0 0 "[ . 1 . 2]" 1
288 1 7 ARG H 1 7 ARG HB2 2.700 . 6.000 2.564 2.469 2.699 . 0 0 "[ . 1 . 2]" 1
289 1 7 ARG H 1 7 ARG HB3 3.600 . 5.200 3.710 3.660 3.791 . 0 0 "[ . 1 . 2]" 1
290 1 7 ARG H 1 7 ARG HD2 5.100 . 6.000 4.929 3.590 5.188 . 0 0 "[ . 1 . 2]" 1
291 1 7 ARG H 1 7 ARG HG2 3.200 . 4.500 2.755 2.676 2.876 . 0 0 "[ . 1 . 2]" 1
292 1 7 ARG H 1 7 ARG HG3 4.300 . 6.000 3.993 3.903 4.238 . 0 0 "[ . 1 . 2]" 1
293 1 7 ARG H 1 8 MET HA 5.300 . 6.000 4.663 4.533 4.771 . 0 0 "[ . 1 . 2]" 1
294 1 7 ARG H 1 8 MET HB2 6.000 . 6.000 5.135 3.925 5.576 . 0 0 "[ . 1 . 2]" 1
295 1 7 ARG H 1 9 LYS HA 5.200 . 6.000 5.338 5.102 5.453 . 0 0 "[ . 1 . 2]" 1
296 1 7 ARG H 1 9 LYS QG 4.400 . 6.000 3.973 3.633 4.370 . 0 0 "[ . 1 . 2]" 1
297 1 7 ARG HA 1 7 ARG HB3 2.400 . 3.100 2.462 2.427 2.501 . 0 0 "[ . 1 . 2]" 1
298 1 7 ARG HA 1 7 ARG HD2 3.700 . 5.400 3.731 2.298 3.915 . 0 0 "[ . 1 . 2]" 1
299 1 7 ARG HA 1 7 ARG HE 3.900 . 5.800 2.057 1.960 2.384 0.040 12 0 "[ . 1 . 2]" 1
300 1 7 ARG HA 1 7 ARG HG2 3.200 . 4.500 3.070 2.912 3.323 . 0 0 "[ . 1 . 2]" 1
301 1 7 ARG HA 1 7 ARG HG3 3.800 . 5.600 3.815 3.763 3.842 . 0 0 "[ . 1 . 2]" 1
302 1 7 ARG HA 1 8 MET H 3.100 . 4.300 3.509 3.481 3.522 . 0 0 "[ . 1 . 2]" 1
303 1 7 ARG HA 1 8 MET HA 4.900 . 6.000 4.671 4.632 4.711 . 0 0 "[ . 1 . 2]" 1
304 1 7 ARG HA 1 9 LYS H 4.300 . 6.000 4.029 3.849 4.177 . 0 0 "[ . 1 . 2]" 1
305 1 7 ARG HB2 1 7 ARG HD2 3.900 . 5.800 4.164 3.748 4.220 . 0 0 "[ . 1 . 2]" 1
306 1 7 ARG HB2 1 7 ARG HE 3.900 . 5.800 4.041 3.844 4.495 . 0 0 "[ . 1 . 2]" 1
307 1 7 ARG HB2 1 7 ARG HG2 2.900 . 3.900 2.492 2.390 2.549 . 0 0 "[ . 1 . 2]" 1
308 1 7 ARG HB2 1 7 ARG HG3 2.800 . 3.800 2.374 2.326 2.480 . 0 0 "[ . 1 . 2]" 1
309 1 7 ARG HB2 1 8 MET H 2.700 . 3.600 2.463 2.374 2.631 . 0 0 "[ . 1 . 2]" 1
310 1 7 ARG HB2 1 9 LYS H 3.300 . 6.000 5.203 5.078 5.357 . 0 0 "[ . 1 . 2]" 1
311 1 7 ARG HB3 1 7 ARG HD2 3.300 . 4.600 3.574 3.325 3.622 . 0 0 "[ . 1 . 2]" 1
312 1 7 ARG HB3 1 7 ARG HG2 3.000 . 4.100 3.007 3.001 3.010 . 0 0 "[ . 1 . 2]" 1
313 1 7 ARG HB3 1 7 ARG HG3 2.900 . 3.900 2.483 2.380 2.539 . 0 0 "[ . 1 . 2]" 1
314 1 7 ARG HB3 1 8 MET H 3.900 . 5.800 3.606 3.486 3.738 . 0 0 "[ . 1 . 2]" 1
315 1 7 ARG HB3 1 9 LYS H 3.000 . 6.000 5.239 5.118 5.378 . 0 0 "[ . 1 . 2]" 1
316 1 7 ARG HD2 1 7 ARG HE 2.600 . 3.400 2.733 2.265 2.827 . 0 0 "[ . 1 . 2]" 1
317 1 7 ARG HD2 1 7 ARG HG2 2.700 . 3.600 2.513 2.368 2.550 . 0 0 "[ . 1 . 2]" 1
318 1 7 ARG HD2 1 7 ARG HG3 2.600 . 3.400 2.424 2.341 3.008 . 0 0 "[ . 1 . 2]" 1
319 1 7 ARG HD2 1 8 MET H 3.200 . 6.000 6.070 4.884 6.279 0.279 14 0 "[ . 1 . 2]" 1
320 1 7 ARG HE 1 9 LYS QG 3.000 . 6.000 4.663 4.316 5.306 . 0 0 "[ . 1 . 2]" 1
321 1 7 ARG HG2 1 8 MET H 4.800 . 6.000 4.094 3.965 4.223 . 0 0 "[ . 1 . 2]" 1
322 1 7 ARG HG3 1 8 MET H 5.200 . 6.000 4.707 4.633 4.856 . 0 0 "[ . 1 . 2]" 1
323 1 8 MET H 1 8 MET HA 2.500 . 3.300 2.908 2.891 2.923 . 0 0 "[ . 1 . 2]" 1
324 1 8 MET H 1 8 MET HB2 3.100 . 4.300 3.303 2.366 3.636 . 0 0 "[ . 1 . 2]" 1
325 1 8 MET H 1 8 MET HB3 2.900 . 3.900 3.070 2.853 3.602 . 0 0 "[ . 1 . 2]" 1
326 1 8 MET H 1 8 MET HG2 2.400 . 3.100 2.229 1.814 3.752 0.652 16 3 "[ *.- 1 .+ 2]" 1
327 1 8 MET H 1 8 MET HG3 3.400 . 4.900 2.907 2.457 3.820 . 0 0 "[ . 1 . 2]" 1
328 1 8 MET H 1 9 LYS H 2.700 . 3.600 3.496 3.357 3.582 . 0 0 "[ . 1 . 2]" 1
329 1 8 MET H 1 9 LYS HA 4.900 . 6.000 4.785 4.695 4.859 . 0 0 "[ . 1 . 2]" 1
330 1 8 MET H 1 9 LYS QG 6.000 . 6.000 4.084 3.915 4.448 . 0 0 "[ . 1 . 2]" 1
331 1 8 MET HA 1 8 MET HB2 2.900 . 3.900 2.639 2.488 3.029 . 0 0 "[ . 1 . 2]" 1
332 1 8 MET HA 1 8 MET HB3 2.700 . 3.600 2.423 2.376 2.523 . 0 0 "[ . 1 . 2]" 1
333 1 8 MET HA 1 8 MET HG2 3.500 . 5.000 3.465 2.508 3.746 . 0 0 "[ . 1 . 2]" 1
334 1 8 MET HA 1 8 MET HG3 3.900 . 5.800 3.666 2.996 3.803 . 0 0 "[ . 1 . 2]" 1
335 1 8 MET HA 1 9 LYS H 2.500 . 3.300 2.537 2.483 2.604 . 0 0 "[ . 1 . 2]" 1
336 1 8 MET HA 1 9 LYS HA 4.500 . 6.000 4.628 4.599 4.660 . 0 0 "[ . 1 . 2]" 1
337 1 8 MET HA 1 10 LYS H 3.500 . 5.000 4.147 3.853 4.384 . 0 0 "[ . 1 . 2]" 1
338 1 8 MET HB2 1 8 MET HG3 2.800 . 3.800 2.435 2.380 2.483 . 0 0 "[ . 1 . 2]" 1
339 1 8 MET HB2 1 9 LYS H 4.100 . 6.000 4.354 4.299 4.425 . 0 0 "[ . 1 . 2]" 1
340 1 8 MET HB2 1 10 LYS H 3.700 . 5.400 3.905 3.626 4.295 . 0 0 "[ . 1 . 2]" 1
341 1 8 MET HB3 1 8 MET HG2 2.600 . 3.500 2.494 2.401 3.006 . 0 0 "[ . 1 . 2]" 1
342 1 8 MET HB3 1 9 LYS H 4.100 . 6.000 4.556 4.326 4.639 . 0 0 "[ . 1 . 2]" 1
343 1 8 MET HB3 1 10 LYS H 2.800 . 6.000 4.833 3.452 5.404 . 0 0 "[ . 1 . 2]" 1
344 1 8 MET HB3 1 10 LYS HD3 2.000 . 6.000 5.072 3.382 6.355 0.355 20 0 "[ . 1 . 2]" 1
345 1 8 MET HB3 1 10 LYS HG2 2.400 . 6.000 4.668 2.944 5.591 . 0 0 "[ . 1 . 2]" 1
346 1 8 MET HG2 1 9 LYS H 5.300 . 6.000 4.891 4.734 5.085 . 0 0 "[ . 1 . 2]" 1
347 1 8 MET HG3 1 9 LYS H 5.100 . 6.000 4.774 4.462 5.990 . 0 0 "[ . 1 . 2]" 1
348 1 8 MET HG3 1 10 LYS H 4.900 . 6.000 4.448 3.841 6.061 0.061 4 0 "[ . 1 . 2]" 1
349 1 9 LYS H 1 9 LYS HA 2.500 . 3.300 2.825 2.807 2.838 . 0 0 "[ . 1 . 2]" 1
350 1 9 LYS H 1 9 LYS HB3 3.200 . 4.500 3.580 3.569 3.604 . 0 0 "[ . 1 . 2]" 1
351 1 9 LYS H 1 9 LYS HD3 4.900 . 6.000 4.073 1.439 4.710 0.461 13 0 "[ . 1 . 2]" 1
352 1 9 LYS H 1 9 LYS HE3 5.100 . 6.000 4.736 2.737 5.542 . 0 0 "[ . 1 . 2]" 1
353 1 9 LYS H 1 9 LYS QG . . 3.300 2.131 1.970 2.882 0.030 11 0 "[ . 1 . 2]" 1
354 1 9 LYS H 1 10 LYS H 2.800 . 3.800 3.682 3.501 3.822 0.022 7 0 "[ . 1 . 2]" 1
355 1 9 LYS H 1 12 GLY HA2 6.000 . 6.000 6.004 5.937 6.043 0.043 17 0 "[ . 1 . 2]" 1
356 1 9 LYS HA 1 9 LYS HB3 2.100 . 2.700 2.439 2.398 2.499 . 0 0 "[ . 1 . 2]" 1
357 1 9 LYS HA 1 9 LYS HD3 4.100 . 6.000 4.575 3.497 4.873 . 0 0 "[ . 1 . 2]" 1
358 1 9 LYS HA 1 9 LYS HE3 3.300 . 6.000 4.951 4.292 6.025 0.025 18 0 "[ . 1 . 2]" 1
359 1 9 LYS HA 1 9 LYS QG 2.700 . 3.600 2.488 2.432 2.528 . 0 0 "[ . 1 . 2]" 1
360 1 9 LYS HA 1 10 LYS H 2.400 . 3.100 2.574 2.470 2.707 . 0 0 "[ . 1 . 2]" 1
361 1 9 LYS HA 1 10 LYS HA 3.200 . 4.500 4.546 4.517 4.577 0.077 18 0 "[ . 1 . 2]" 1
362 1 9 LYS HA 1 11 LEU H 4.700 . 6.000 3.828 3.723 3.949 . 0 0 "[ . 1 . 2]" 1
363 1 9 LYS HA 1 12 GLY H 2.900 . 4.000 3.039 2.971 3.110 . 0 0 "[ . 1 . 2]" 1
364 1 9 LYS HA 1 13 CYS HB3 4.100 . 6.000 4.840 4.613 5.001 . 0 0 "[ . 1 . 2]" 1
365 1 9 LYS HB3 1 9 LYS HD3 2.300 . 6.000 3.186 2.460 3.766 . 0 0 "[ . 1 . 2]" 1
366 1 9 LYS HB3 1 9 LYS HE3 3.700 . 5.400 3.372 2.172 4.685 . 0 0 "[ . 1 . 2]" 1
367 1 9 LYS HB3 1 9 LYS QZ 4.800 . 6.000 3.765 2.600 4.551 . 0 0 "[ . 1 . 2]" 1
368 1 9 LYS HB3 1 12 GLY H 3.900 . 5.800 3.869 3.676 4.141 . 0 0 "[ . 1 . 2]" 1
369 1 9 LYS HB3 1 12 GLY HA3 4.800 . 6.000 4.576 4.324 4.799 . 0 0 "[ . 1 . 2]" 1
370 1 9 LYS HD3 1 9 LYS QZ 3.900 . 5.800 2.594 2.277 3.179 . 0 0 "[ . 1 . 2]" 1
371 1 9 LYS HE3 1 9 LYS QZ 3.300 . 4.700 2.083 2.062 2.103 . 0 0 "[ . 1 . 2]" 1
372 1 9 LYS QG 1 9 LYS QZ 3.700 . 5.500 2.841 1.760 3.496 0.140 18 0 "[ . 1 . 2]" 1
373 1 10 LYS H 1 10 LYS HA 2.700 . 3.600 2.889 2.879 2.898 . 0 0 "[ . 1 . 2]" 1
374 1 10 LYS H 1 10 LYS HB2 3.100 . 4.300 3.624 3.600 3.642 . 0 0 "[ . 1 . 2]" 1
375 1 10 LYS H 1 10 LYS HB3 2.200 . 2.800 2.780 2.723 2.808 0.008 7 0 "[ . 1 . 2]" 1
376 1 10 LYS H 1 10 LYS HD3 4.300 . 6.000 4.165 4.001 4.392 . 0 0 "[ . 1 . 2]" 1
377 1 10 LYS H 1 10 LYS HE3 5.800 . 6.000 5.174 4.280 5.953 . 0 0 "[ . 1 . 2]" 1
378 1 10 LYS H 1 10 LYS HG2 2.500 . 3.300 1.957 1.852 2.055 . 0 0 "[ . 1 . 2]" 1
379 1 10 LYS H 1 10 LYS HG3 3.600 . 5.200 3.046 2.978 3.141 . 0 0 "[ . 1 . 2]" 1
380 1 10 LYS H 1 11 LEU H 2.500 . 3.300 2.388 2.305 2.472 . 0 0 "[ . 1 . 2]" 1
381 1 10 LYS H 1 11 LEU HA 5.000 . 6.000 5.042 4.985 5.100 . 0 0 "[ . 1 . 2]" 1
382 1 10 LYS H 1 12 GLY HA3 5.600 . 6.000 6.019 5.991 6.040 0.040 13 0 "[ . 1 . 2]" 1
383 1 10 LYS HA 1 10 LYS QB 2.300 . 2.900 2.180 2.177 2.184 . 0 0 "[ . 1 . 2]" 1
384 1 10 LYS HA 1 10 LYS HB3 2.300 . 2.900 2.423 2.400 2.450 . 0 0 "[ . 1 . 2]" 1
385 1 10 LYS HA 1 10 LYS HD3 4.200 . 6.000 5.057 4.746 5.543 . 0 0 "[ . 1 . 2]" 1
386 1 10 LYS HA 1 10 LYS HE3 5.600 . 6.000 5.879 4.427 6.758 0.758 6 5 "[ *+ 1 **. - 2]" 1
387 1 10 LYS HA 1 10 LYS HG2 3.300 . 4.600 3.732 3.698 3.772 . 0 0 "[ . 1 . 2]" 1
388 1 10 LYS HA 1 10 LYS HG3 3.500 . 5.000 3.768 3.734 3.808 . 0 0 "[ . 1 . 2]" 1
389 1 10 LYS HA 1 11 LEU H 3.000 . 4.100 3.541 3.528 3.558 . 0 0 "[ . 1 . 2]" 1
390 1 10 LYS HA 1 11 LEU HA 3.900 . 5.800 4.634 4.608 4.664 . 0 0 "[ . 1 . 2]" 1
391 1 10 LYS HA 1 12 GLY H 4.100 . 6.000 4.164 3.978 4.301 . 0 0 "[ . 1 . 2]" 1
392 1 10 LYS HB2 1 11 LEU H 3.400 . 4.800 3.558 3.451 3.627 . 0 0 "[ . 1 . 2]" 1
393 1 10 LYS HB2 1 11 LEU HA 4.200 . 6.000 4.493 4.423 4.579 . 0 0 "[ . 1 . 2]" 1
394 1 10 LYS HB3 1 10 LYS HD3 2.300 . 2.900 2.923 2.463 3.694 0.794 20 7 "[** . ** * . - +]" 1
395 1 10 LYS HB3 1 10 LYS HE3 4.200 . 6.000 4.193 2.801 4.829 . 0 0 "[ . 1 . 2]" 1
396 1 10 LYS HB3 1 10 LYS HG3 3.000 . 4.100 3.010 3.009 3.012 . 0 0 "[ . 1 . 2]" 1
397 1 10 LYS HB3 1 10 LYS QZ 4.900 . 6.000 3.997 2.486 4.484 . 0 0 "[ . 1 . 2]" 1
398 1 10 LYS HB3 1 11 LEU H 3.400 . 4.800 3.857 3.833 3.875 . 0 0 "[ . 1 . 2]" 1
399 1 10 LYS HB3 1 12 GLY H 3.000 . 6.000 5.400 5.326 5.476 . 0 0 "[ . 1 . 2]" 1
400 1 10 LYS HD3 1 10 LYS QZ 3.500 . 5.000 2.502 2.277 3.179 . 0 0 "[ . 1 . 2]" 1
401 1 10 LYS HE3 1 10 LYS QZ 3.100 . 4.300 2.083 2.063 2.104 . 0 0 "[ . 1 . 2]" 1
402 1 10 LYS HE3 1 11 LEU H 4.800 . 6.000 4.762 3.990 5.603 . 0 0 "[ . 1 . 2]" 1
403 1 10 LYS HG2 1 10 LYS QZ 4.000 . 6.000 3.221 1.993 4.121 0.007 17 0 "[ . 1 . 2]" 1
404 1 10 LYS HG2 1 11 LEU H 3.500 . 5.000 2.466 2.401 2.544 . 0 0 "[ . 1 . 2]" 1
405 1 10 LYS HG2 1 11 LEU HA 5.100 . 6.000 5.029 4.935 5.139 . 0 0 "[ . 1 . 2]" 1
406 1 10 LYS HG2 1 12 GLY H 6.000 . 6.000 4.376 4.259 4.455 . 0 0 "[ . 1 . 2]" 1
407 1 10 LYS HG3 1 11 LEU H 3.200 . 4.500 1.975 1.886 2.071 0.014 17 0 "[ . 1 . 2]" 1
408 1 10 LYS HG3 1 12 GLY H 6.000 . 6.000 4.204 4.100 4.289 . 0 0 "[ . 1 . 2]" 1
409 1 11 LEU H 1 11 LEU HA 2.600 . 3.400 2.904 2.882 2.922 . 0 0 "[ . 1 . 2]" 1
410 1 11 LEU H 1 11 LEU HB3 2.200 . 2.800 2.497 2.447 2.534 . 0 0 "[ . 1 . 2]" 1
411 1 11 LEU H 1 11 LEU MD1 4.800 . 6.000 4.160 4.083 4.215 . 0 0 "[ . 1 . 2]" 1
412 1 11 LEU H 1 11 LEU MD2 4.800 . 6.000 4.290 4.254 4.338 . 0 0 "[ . 1 . 2]" 1
413 1 11 LEU H 1 11 LEU HG 3.200 . 4.500 4.459 4.402 4.497 . 0 0 "[ . 1 . 2]" 1
414 1 11 LEU H 1 12 GLY H 2.000 . 2.500 2.251 2.185 2.313 . 0 0 "[ . 1 . 2]" 1
415 1 11 LEU H 1 12 GLY HA2 6.000 . 6.000 4.542 4.481 4.591 . 0 0 "[ . 1 . 2]" 1
416 1 11 LEU HA 1 11 LEU HB3 2.900 . 3.900 3.016 3.013 3.018 . 0 0 "[ . 1 . 2]" 1
417 1 11 LEU HA 1 11 LEU MD1 3.200 . 4.500 2.099 1.879 2.215 0.021 10 0 "[ . 1 . 2]" 1
418 1 11 LEU HA 1 11 LEU MD2 3.600 . 5.200 3.868 3.850 3.887 . 0 0 "[ . 1 . 2]" 1
419 1 11 LEU HA 1 11 LEU HG 2.400 . 3.100 3.108 3.078 3.126 0.026 20 0 "[ . 1 . 2]" 1
420 1 11 LEU HA 1 12 GLY H 2.500 . 3.300 3.358 3.299 3.404 0.104 18 0 "[ . 1 . 2]" 1
421 1 11 LEU HA 1 12 GLY HA2 5.100 . 6.000 5.161 5.139 5.192 . 0 0 "[ . 1 . 2]" 1
422 1 11 LEU HA 1 12 GLY HA3 3.900 . 5.800 4.519 4.505 4.540 . 0 0 "[ . 1 . 2]" 1
423 1 11 LEU HB3 1 11 LEU MD1 3.300 . 4.600 3.191 3.180 3.199 . 0 0 "[ . 1 . 2]" 1
424 1 11 LEU HB3 1 11 LEU MD2 2.800 . 3.800 2.275 2.195 2.376 . 0 0 "[ . 1 . 2]" 1
425 1 11 LEU HB3 1 12 GLY H 3.400 . 4.900 3.228 2.996 3.450 . 0 0 "[ . 1 . 2]" 1
426 1 11 LEU MD1 1 11 LEU MD2 2.200 . 6.000 2.026 1.890 2.086 . 0 0 "[ . 1 . 2]" 1
427 1 11 LEU MD1 1 11 LEU HG 2.400 . 3.100 2.106 2.080 2.125 . 0 0 "[ . 1 . 2]" 1
428 1 11 LEU MD1 1 12 GLY H 3.300 . 6.000 4.647 4.574 4.691 . 0 0 "[ . 1 . 2]" 1
429 1 11 LEU MD2 1 11 LEU HG 2.300 . 3.000 2.104 2.083 2.126 . 0 0 "[ . 1 . 2]" 1
430 1 11 LEU MD2 1 12 GLY H 5.000 . 6.000 4.931 4.757 5.107 . 0 0 "[ . 1 . 2]" 1
431 1 11 LEU HG 1 12 GLY H 3.400 . 4.800 4.365 4.182 4.541 . 0 0 "[ . 1 . 2]" 1
432 1 11 LEU HG 1 13 CYS HA 5.500 . 6.000 4.494 4.172 4.772 . 0 0 "[ . 1 . 2]" 1
433 1 12 GLY H 1 12 GLY HA2 2.200 . 2.800 2.309 2.297 2.327 . 0 0 "[ . 1 . 2]" 1
434 1 12 GLY H 1 12 GLY HA3 2.700 . 3.600 2.866 2.832 2.898 . 0 0 "[ . 1 . 2]" 1
435 1 12 GLY H 1 13 CYS HA 6.000 . 6.000 4.685 4.588 4.816 . 0 0 "[ . 1 . 2]" 1
436 1 12 GLY HA2 1 13 CYS HA 6.000 . 6.000 4.903 4.876 4.939 . 0 0 "[ . 1 . 2]" 1
437 1 12 GLY HA2 1 13 CYS HB2 4.900 . 6.000 5.676 5.650 5.692 . 0 0 "[ . 1 . 2]" 1
438 1 12 GLY HA2 1 13 CYS HB3 3.600 . 5.200 4.273 4.212 4.434 . 0 0 "[ . 1 . 2]" 1
439 1 12 GLY HA3 1 13 CYS HA 5.800 . 6.000 5.254 5.240 5.271 . 0 0 "[ . 1 . 2]" 1
440 1 12 GLY HA3 1 13 CYS HB3 6.000 . 6.000 5.268 5.198 5.449 . 0 0 "[ . 1 . 2]" 1
441 1 13 CYS HA 1 13 CYS HB2 2.800 . 3.800 2.343 2.317 2.426 . 0 0 "[ . 1 . 2]" 1
442 1 13 CYS HA 1 13 CYS HB3 2.500 . 3.300 2.553 2.453 2.591 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Saturday, April 27, 2024 6:55:04 PM GMT (wattos1)