NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
395123 |
1ron   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1ron
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 455
_Distance_constraint_stats_list.Viol_count 1397
_Distance_constraint_stats_list.Viol_total 2548.101
_Distance_constraint_stats_list.Viol_max 0.269
_Distance_constraint_stats_list.Viol_rms 0.0302
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0083
_Distance_constraint_stats_list.Viol_average_violations_only 0.0702
_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 TYR 0.016 0.008 18 0 "[ . 1 . 2 . ]"
1 2 PRO 0.077 0.027 14 0 "[ . 1 . 2 . ]"
1 3 SER 0.166 0.080 17 0 "[ . 1 . 2 . ]"
1 4 LYS 0.105 0.080 17 0 "[ . 1 . 2 . ]"
1 5 PRO 0.251 0.035 10 0 "[ . 1 . 2 . ]"
1 6 ASP 0.405 0.045 8 0 "[ . 1 . 2 . ]"
1 7 ASN 0.435 0.045 8 0 "[ . 1 . 2 . ]"
1 8 PRO 0.101 0.037 11 0 "[ . 1 . 2 . ]"
1 9 GLY 0.377 0.041 23 0 "[ . 1 . 2 . ]"
1 10 GLU 0.956 0.091 23 0 "[ . 1 . 2 . ]"
1 11 ASP 2.023 0.091 23 0 "[ . 1 . 2 . ]"
1 12 ALA 4.217 0.131 25 0 "[ . 1 . 2 . ]"
1 13 PRO 7.987 0.222 24 0 "[ . 1 . 2 . ]"
1 14 ALA 0.246 0.053 24 0 "[ . 1 . 2 . ]"
1 15 GLU 10.544 0.222 24 0 "[ . 1 . 2 . ]"
1 16 ASP 4.918 0.230 4 0 "[ . 1 . 2 . ]"
1 17 MET 6.387 0.179 15 0 "[ . 1 . 2 . ]"
1 18 ALA 4.834 0.163 20 0 "[ . 1 . 2 . ]"
1 19 ARG 13.946 0.230 4 0 "[ . 1 . 2 . ]"
1 20 TYR 1.453 0.070 7 0 "[ . 1 . 2 . ]"
1 21 TYR 4.245 0.094 11 0 "[ . 1 . 2 . ]"
1 22 SER 9.666 0.202 18 0 "[ . 1 . 2 . ]"
1 23 ALA 3.642 0.177 3 0 "[ . 1 . 2 . ]"
1 24 LEU 0.445 0.045 18 0 "[ . 1 . 2 . ]"
1 25 ARG 6.338 0.098 18 0 "[ . 1 . 2 . ]"
1 26 HIS 3.027 0.100 18 0 "[ . 1 . 2 . ]"
1 27 TYR 2.607 0.117 22 0 "[ . 1 . 2 . ]"
1 28 ILE 3.386 0.115 15 0 "[ . 1 . 2 . ]"
1 29 ASN 17.316 0.185 17 0 "[ . 1 . 2 . ]"
1 30 LEU 1.527 0.073 2 0 "[ . 1 . 2 . ]"
1 31 ILE 9.372 0.200 25 0 "[ . 1 . 2 . ]"
1 32 THR 7.984 0.185 17 0 "[ . 1 . 2 . ]"
1 33 ARG 4.244 0.089 13 0 "[ . 1 . 2 . ]"
1 34 GLN 5.791 0.269 24 0 "[ . 1 . 2 . ]"
1 35 ARG 6.350 0.254 9 0 "[ . 1 . 2 . ]"
1 36 TYR 0.234 0.022 16 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 TYR HA 1 2 PRO HD2 0.000 . 3.360 2.263 2.024 2.638 . 0 0 "[ . 1 . 2 . ]" 1
2 1 1 TYR HA 1 2 PRO QD 0.000 . 3.190 2.151 2.001 2.315 . 0 0 "[ . 1 . 2 . ]" 1
3 1 1 TYR HA 1 2 PRO HD3 0.000 . 3.360 2.915 2.400 3.368 0.008 18 0 "[ . 1 . 2 . ]" 1
4 1 2 PRO HA 1 3 SER H 0.000 . 3.410 2.943 2.242 3.437 0.027 14 0 "[ . 1 . 2 . ]" 1
5 1 2 PRO QG 1 3 SER H 0.000 . 4.500 3.078 1.857 3.987 . 0 0 "[ . 1 . 2 . ]" 1
6 1 3 SER HA 1 4 LYS H 0.000 . 3.050 2.487 2.168 3.130 0.080 17 0 "[ . 1 . 2 . ]" 1
7 1 4 LYS H 1 4 LYS QD 0.000 . 4.350 3.183 1.806 3.974 . 0 0 "[ . 1 . 2 . ]" 1
8 1 4 LYS H 1 4 LYS QG 0.000 . 4.650 2.822 1.911 4.099 . 0 0 "[ . 1 . 2 . ]" 1
9 1 5 PRO HA 1 6 ASP H 0.000 . 2.820 2.549 2.159 2.849 0.029 24 0 "[ . 1 . 2 . ]" 1
10 1 5 PRO QB 1 6 ASP H 0.000 . 4.400 2.805 1.820 3.998 . 0 0 "[ . 1 . 2 . ]" 1
11 1 5 PRO HB2 1 6 ASP H 0.000 . 4.550 2.951 1.828 4.403 . 0 0 "[ . 1 . 2 . ]" 1
12 1 5 PRO HB3 1 6 ASP H 0.000 . 4.550 3.839 3.331 4.585 0.035 10 0 "[ . 1 . 2 . ]" 1
13 1 5 PRO QD 1 6 ASP H 0.000 . 5.360 4.503 3.579 4.885 . 0 0 "[ . 1 . 2 . ]" 1
14 1 5 PRO QG 1 6 ASP H 0.000 . 4.990 3.778 3.016 4.344 . 0 0 "[ . 1 . 2 . ]" 1
15 1 6 ASP H 1 6 ASP HB2 0.000 . 3.950 3.300 2.669 3.977 0.027 3 0 "[ . 1 . 2 . ]" 1
16 1 6 ASP H 1 6 ASP HB3 0.000 . 4.150 3.403 2.461 4.160 0.010 23 0 "[ . 1 . 2 . ]" 1
17 1 6 ASP HA 1 7 ASN H 0.000 . 3.000 2.666 2.136 3.045 0.045 8 0 "[ . 1 . 2 . ]" 1
18 1 7 ASN H 1 7 ASN HB2 0.000 . 4.090 3.803 3.552 4.095 0.005 22 0 "[ . 1 . 2 . ]" 1
19 1 7 ASN H 1 7 ASN HB3 0.000 . 3.750 3.055 2.456 3.791 0.041 22 0 "[ . 1 . 2 . ]" 1
20 1 7 ASN HA 1 9 GLY H 0.000 . 4.570 4.329 3.345 4.611 0.041 23 0 "[ . 1 . 2 . ]" 1
21 1 8 PRO HA 1 9 GLY H 0.000 . 2.980 2.627 2.308 3.017 0.037 11 0 "[ . 1 . 2 . ]" 1
22 1 10 GLU H 1 10 GLU QB 0.000 . 3.690 2.824 2.043 3.334 . 0 0 "[ . 1 . 2 . ]" 1
23 1 10 GLU HA 1 11 ASP H 0.000 . 3.230 2.258 2.041 2.859 . 0 0 "[ . 1 . 2 . ]" 1
24 1 10 GLU HB2 1 11 ASP H 0.000 . 4.280 3.860 2.065 4.371 0.091 23 0 "[ . 1 . 2 . ]" 1
25 1 10 GLU HB3 1 11 ASP H 0.000 . 4.280 4.129 3.503 4.339 0.059 6 0 "[ . 1 . 2 . ]" 1
26 1 10 GLU QG 1 11 ASP H 0.000 . 5.850 3.622 1.875 4.532 . 0 0 "[ . 1 . 2 . ]" 1
27 1 10 GLU QG 1 13 PRO HA 0.000 . 6.100 4.807 3.345 5.496 . 0 0 "[ . 1 . 2 . ]" 1
28 1 11 ASP H 1 11 ASP HB2 0.000 . 3.800 2.551 2.296 2.842 . 0 0 "[ . 1 . 2 . ]" 1
29 1 11 ASP H 1 11 ASP HB3 0.000 . 4.050 3.717 3.593 3.896 . 0 0 "[ . 1 . 2 . ]" 1
30 1 11 ASP H 1 12 ALA H 0.000 . 3.080 2.329 1.947 2.833 . 0 0 "[ . 1 . 2 . ]" 1
31 1 11 ASP H 1 12 ALA HA 0.000 . 5.070 4.845 4.403 5.155 0.085 11 0 "[ . 1 . 2 . ]" 1
32 1 11 ASP H 1 12 ALA MB 0.000 . 6.210 3.814 3.384 4.245 . 0 0 "[ . 1 . 2 . ]" 1
33 1 11 ASP HA 1 12 ALA H 0.000 . 3.180 3.156 2.829 3.237 0.057 19 0 "[ . 1 . 2 . ]" 1
34 1 11 ASP HA 1 14 ALA MB 0.000 . 8.000 6.356 5.934 6.582 . 0 0 "[ . 1 . 2 . ]" 1
35 1 11 ASP HB2 1 12 ALA H 0.000 . 4.070 3.698 3.289 4.078 0.008 18 0 "[ . 1 . 2 . ]" 1
36 1 11 ASP HB3 1 12 ALA H 0.000 . 4.230 4.240 4.138 4.294 0.064 18 0 "[ . 1 . 2 . ]" 1
37 1 12 ALA H 1 13 PRO HD2 0.000 . 4.290 3.673 3.515 3.789 . 0 0 "[ . 1 . 2 . ]" 1
38 1 12 ALA H 1 13 PRO QD 0.000 . 4.140 2.544 2.309 2.739 . 0 0 "[ . 1 . 2 . ]" 1
39 1 12 ALA H 1 13 PRO HD3 0.000 . 4.290 2.595 2.341 2.816 . 0 0 "[ . 1 . 2 . ]" 1
40 1 12 ALA HA 1 13 PRO HD2 0.000 . 3.250 2.829 2.632 2.977 . 0 0 "[ . 1 . 2 . ]" 1
41 1 12 ALA HA 1 13 PRO QD 0.000 . 3.030 2.684 2.537 2.788 . 0 0 "[ . 1 . 2 . ]" 1
42 1 12 ALA HA 1 13 PRO HD3 0.000 . 3.250 3.349 3.322 3.381 0.131 25 0 "[ . 1 . 2 . ]" 1
43 1 12 ALA HA 1 14 ALA MB 0.000 . 7.250 3.831 3.467 4.090 . 0 0 "[ . 1 . 2 . ]" 1
44 1 12 ALA HA 1 15 GLU H 0.000 . 4.070 4.053 3.663 4.133 0.063 13 0 "[ . 1 . 2 . ]" 1
45 1 12 ALA HA 1 15 GLU QB 0.000 . 5.240 4.468 3.945 4.742 . 0 0 "[ . 1 . 2 . ]" 1
46 1 12 ALA MB 1 15 GLU QB 0.000 . 7.150 3.151 2.749 3.713 . 0 0 "[ . 1 . 2 . ]" 1
47 1 12 ALA MB 1 15 GLU QG 0.000 . 7.650 4.460 2.539 5.476 . 0 0 "[ . 1 . 2 . ]" 1
48 1 13 PRO HA 1 14 ALA H 0.000 . 3.240 3.202 3.118 3.293 0.053 24 0 "[ . 1 . 2 . ]" 1
49 1 13 PRO HA 1 14 ALA MB 0.000 . 5.930 4.745 4.684 4.797 . 0 0 "[ . 1 . 2 . ]" 1
50 1 13 PRO HA 1 15 GLU H 0.000 . 2.900 3.043 2.986 3.122 0.222 24 0 "[ . 1 . 2 . ]" 1
51 1 13 PRO HA 1 16 ASP H 0.000 . 4.500 2.186 2.046 2.510 . 0 0 "[ . 1 . 2 . ]" 1
52 1 13 PRO HA 1 16 ASP QB 0.000 . 4.830 2.549 2.350 2.776 . 0 0 "[ . 1 . 2 . ]" 1
53 1 13 PRO HA 1 17 MET HG3 0.000 . 4.820 4.876 4.823 4.977 0.157 24 0 "[ . 1 . 2 . ]" 1
54 1 13 PRO QD 1 16 ASP H 0.000 . 5.510 5.027 4.988 5.082 . 0 0 "[ . 1 . 2 . ]" 1
55 1 14 ALA HA 1 17 MET H 0.000 . 5.000 4.131 3.767 4.377 . 0 0 "[ . 1 . 2 . ]" 1
56 1 14 ALA HA 1 17 MET QB 0.000 . 4.720 4.031 3.776 4.247 . 0 0 "[ . 1 . 2 . ]" 1
57 1 14 ALA HA 1 17 MET HG2 0.000 . 4.900 2.711 2.393 3.628 . 0 0 "[ . 1 . 2 . ]" 1
58 1 14 ALA HA 1 17 MET QG 0.000 . 4.740 2.352 2.178 2.552 . 0 0 "[ . 1 . 2 . ]" 1
59 1 14 ALA HA 1 17 MET HG3 0.000 . 4.900 2.651 2.343 3.254 . 0 0 "[ . 1 . 2 . ]" 1
60 1 14 ALA MB 1 15 GLU H 0.000 . 4.270 2.813 2.713 2.968 . 0 0 "[ . 1 . 2 . ]" 1
61 1 14 ALA MB 1 15 GLU HA 0.000 . 4.980 4.033 3.983 4.072 . 0 0 "[ . 1 . 2 . ]" 1
62 1 14 ALA MB 1 15 GLU QB 0.000 . 6.640 3.809 3.595 4.434 . 0 0 "[ . 1 . 2 . ]" 1
63 1 15 GLU H 1 15 GLU HA 0.000 . 2.860 2.943 2.932 2.958 0.098 1 0 "[ . 1 . 2 . ]" 1
64 1 15 GLU H 1 15 GLU QG 0.000 . 4.910 3.766 2.459 4.126 . 0 0 "[ . 1 . 2 . ]" 1
65 1 15 GLU H 1 16 ASP H 0.000 . 3.090 2.352 2.208 2.517 . 0 0 "[ . 1 . 2 . ]" 1
66 1 15 GLU HA 1 16 ASP QB 0.000 . 5.750 5.129 5.006 5.203 . 0 0 "[ . 1 . 2 . ]" 1
67 1 15 GLU HA 1 18 ALA H 0.000 . 3.230 3.187 2.971 3.335 0.105 19 0 "[ . 1 . 2 . ]" 1
68 1 15 GLU HA 1 18 ALA MB 0.000 . 4.990 2.182 2.026 2.318 . 0 0 "[ . 1 . 2 . ]" 1
69 1 15 GLU HA 1 19 ARG H 0.000 . 3.430 3.565 3.496 3.628 0.198 1 0 "[ . 1 . 2 . ]" 1
70 1 15 GLU QB 1 18 ALA H 0.000 . 5.630 4.756 4.655 4.889 . 0 0 "[ . 1 . 2 . ]" 1
71 1 15 GLU QB 1 18 ALA MB 0.000 . 6.380 3.930 3.600 4.160 . 0 0 "[ . 1 . 2 . ]" 1
72 1 15 GLU QB 1 19 ARG H 0.000 . 5.640 4.839 4.366 5.071 . 0 0 "[ . 1 . 2 . ]" 1
73 1 15 GLU QG 1 18 ALA MB 0.000 . 6.900 3.550 2.992 4.545 . 0 0 "[ . 1 . 2 . ]" 1
74 1 16 ASP HA 1 19 ARG H 0.000 . 3.600 2.910 2.804 3.003 . 0 0 "[ . 1 . 2 . ]" 1
75 1 16 ASP HA 1 19 ARG HA 0.000 . 4.420 4.609 4.544 4.650 0.230 4 0 "[ . 1 . 2 . ]" 1
76 1 16 ASP HA 1 19 ARG HB2 0.000 . 4.210 1.876 1.824 1.923 . 0 0 "[ . 1 . 2 . ]" 1
77 1 16 ASP HA 1 19 ARG HB3 0.000 . 4.210 3.501 3.443 3.554 . 0 0 "[ . 1 . 2 . ]" 1
78 1 16 ASP HA 1 19 ARG QD 0.000 . 5.330 2.426 1.951 4.766 . 0 0 "[ . 1 . 2 . ]" 1
79 1 16 ASP HA 1 19 ARG HE 0.000 . 4.700 4.114 2.852 4.709 0.009 6 0 "[ . 1 . 2 . ]" 1
80 1 16 ASP QB 1 17 MET H 0.000 . 4.400 2.548 2.382 2.778 . 0 0 "[ . 1 . 2 . ]" 1
81 1 16 ASP QB 1 17 MET HA 0.000 . 5.890 4.009 3.835 4.178 . 0 0 "[ . 1 . 2 . ]" 1
82 1 16 ASP QB 1 19 ARG H 0.000 . 5.730 4.726 4.635 4.786 . 0 0 "[ . 1 . 2 . ]" 1
83 1 16 ASP QB 1 20 TYR QD 0.000 . 8.000 4.379 3.577 4.729 . 0 0 "[ . 1 . 2 . ]" 1
84 1 16 ASP QB 1 20 TYR QE 0.000 . 6.520 3.629 2.905 4.083 . 0 0 "[ . 1 . 2 . ]" 1
85 1 17 MET H 1 17 MET HG2 0.000 . 3.990 3.026 1.725 3.476 0.055 20 0 "[ . 1 . 2 . ]" 1
86 1 17 MET H 1 17 MET QG 0.000 . 3.750 2.419 1.706 2.751 0.074 20 0 "[ . 1 . 2 . ]" 1
87 1 17 MET H 1 17 MET HG3 0.000 . 3.990 2.779 2.360 3.286 . 0 0 "[ . 1 . 2 . ]" 1
88 1 17 MET H 1 18 ALA H 0.000 . 3.080 2.524 2.219 2.728 . 0 0 "[ . 1 . 2 . ]" 1
89 1 17 MET HA 1 17 MET HG2 0.000 . 3.750 3.797 2.822 3.929 0.179 15 0 "[ . 1 . 2 . ]" 1
90 1 17 MET HA 1 17 MET HG3 0.000 . 3.750 3.676 3.601 3.874 0.124 24 0 "[ . 1 . 2 . ]" 1
91 1 17 MET HA 1 18 ALA H 0.000 . 3.550 3.469 3.393 3.555 0.005 19 0 "[ . 1 . 2 . ]" 1
92 1 17 MET HA 1 19 ARG H 0.000 . 5.000 4.556 4.344 4.849 . 0 0 "[ . 1 . 2 . ]" 1
93 1 17 MET HA 1 20 TYR H 0.000 . 3.340 3.048 2.815 3.327 . 0 0 "[ . 1 . 2 . ]" 1
94 1 17 MET HA 1 20 TYR HB2 0.000 . 3.720 2.004 1.887 2.104 . 0 0 "[ . 1 . 2 . ]" 1
95 1 17 MET HA 1 20 TYR HB3 0.000 . 3.720 3.272 3.035 3.504 . 0 0 "[ . 1 . 2 . ]" 1
96 1 17 MET QB 1 18 ALA HA 0.000 . 5.480 4.316 3.333 4.631 . 0 0 "[ . 1 . 2 . ]" 1
97 1 17 MET QB 1 20 TYR QD 0.000 . 6.730 3.219 2.871 3.974 . 0 0 "[ . 1 . 2 . ]" 1
98 1 17 MET QB 1 20 TYR QE 0.000 . 7.000 4.203 3.670 5.505 . 0 0 "[ . 1 . 2 . ]" 1
99 1 17 MET QB 1 21 TYR QD 0.000 . 6.380 4.873 3.964 5.227 . 0 0 "[ . 1 . 2 . ]" 1
100 1 17 MET QB 1 21 TYR QE 0.000 . 6.230 3.849 2.503 4.366 . 0 0 "[ . 1 . 2 . ]" 1
101 1 17 MET ME 1 20 TYR H 0.000 . 6.450 5.233 4.976 5.309 . 0 0 "[ . 1 . 2 . ]" 1
102 1 17 MET ME 1 20 TYR QD 0.000 . 7.560 3.762 2.548 4.105 . 0 0 "[ . 1 . 2 . ]" 1
103 1 17 MET ME 1 20 TYR QE 0.000 . 7.680 4.905 3.385 5.386 . 0 0 "[ . 1 . 2 . ]" 1
104 1 17 MET ME 1 21 TYR QD 0.000 . 7.810 4.739 3.986 5.821 . 0 0 "[ . 1 . 2 . ]" 1
105 1 17 MET ME 1 21 TYR QE 0.000 . 7.270 3.348 2.503 4.576 . 0 0 "[ . 1 . 2 . ]" 1
106 1 17 MET QG 1 18 ALA HA 0.000 . 5.060 3.841 3.505 4.590 . 0 0 "[ . 1 . 2 . ]" 1
107 1 17 MET QG 1 19 ARG H 0.000 . 7.010 4.596 4.409 5.013 . 0 0 "[ . 1 . 2 . ]" 1
108 1 17 MET HG2 1 18 ALA H 0.000 . 4.720 3.628 2.406 4.120 . 0 0 "[ . 1 . 2 . ]" 1
109 1 17 MET HG2 1 18 ALA HA 0.000 . 5.280 5.040 4.511 5.443 0.163 20 0 "[ . 1 . 2 . ]" 1
110 1 17 MET HG2 1 21 TYR QD 0.000 . 7.000 6.285 5.822 6.615 . 0 0 "[ . 1 . 2 . ]" 1
111 1 17 MET HG2 1 21 TYR QE 0.000 . 6.780 4.850 4.350 5.328 . 0 0 "[ . 1 . 2 . ]" 1
112 1 17 MET HG3 1 18 ALA H 0.000 . 4.720 2.672 2.195 3.957 . 0 0 "[ . 1 . 2 . ]" 1
113 1 17 MET HG3 1 18 ALA HA 0.000 . 5.280 4.137 3.571 5.435 0.155 26 0 "[ . 1 . 2 . ]" 1
114 1 17 MET HG3 1 21 TYR QD 0.000 . 6.650 5.671 5.197 6.233 . 0 0 "[ . 1 . 2 . ]" 1
115 1 17 MET HG3 1 21 TYR QE 0.000 . 6.780 4.420 3.835 5.176 . 0 0 "[ . 1 . 2 . ]" 1
116 1 18 ALA H 1 18 ALA HA 0.000 . 2.770 2.835 2.696 2.872 0.102 13 0 "[ . 1 . 2 . ]" 1
117 1 18 ALA H 1 19 ARG H 0.000 . 2.960 2.393 2.234 2.728 . 0 0 "[ . 1 . 2 . ]" 1
118 1 18 ALA H 1 20 TYR QD 0.000 . 7.930 5.109 4.927 5.376 . 0 0 "[ . 1 . 2 . ]" 1
119 1 18 ALA H 1 20 TYR QE 0.000 . 8.690 5.966 5.785 6.376 . 0 0 "[ . 1 . 2 . ]" 1
120 1 18 ALA HA 1 19 ARG H 0.000 . 3.680 3.488 3.437 3.539 . 0 0 "[ . 1 . 2 . ]" 1
121 1 18 ALA HA 1 21 TYR H 0.000 . 3.380 3.441 3.381 3.474 0.094 11 0 "[ . 1 . 2 . ]" 1
122 1 18 ALA HA 1 21 TYR QD 0.000 . 5.800 2.305 2.114 3.129 . 0 0 "[ . 1 . 2 . ]" 1
123 1 18 ALA MB 1 20 TYR QD 0.000 . 8.450 5.565 5.521 5.619 . 0 0 "[ . 1 . 2 . ]" 1
124 1 18 ALA MB 1 20 TYR QE 0.000 . 8.350 6.433 6.367 6.531 . 0 0 "[ . 1 . 2 . ]" 1
125 1 18 ALA MB 1 21 TYR QD 0.000 . 7.700 3.713 3.501 4.329 . 0 0 "[ . 1 . 2 . ]" 1
126 1 18 ALA MB 1 21 TYR QE 0.000 . 9.200 4.064 3.730 4.641 . 0 0 "[ . 1 . 2 . ]" 1
127 1 19 ARG H 1 19 ARG HA 0.000 . 2.670 2.725 2.708 2.759 0.089 1 0 "[ . 1 . 2 . ]" 1
128 1 19 ARG H 1 19 ARG HB2 0.000 . 3.440 2.444 2.328 2.550 . 0 0 "[ . 1 . 2 . ]" 1
129 1 19 ARG H 1 19 ARG HB3 0.000 . 3.440 3.522 3.502 3.541 0.101 2 0 "[ . 1 . 2 . ]" 1
130 1 19 ARG H 1 19 ARG QD 0.000 . 4.150 3.586 3.386 3.779 . 0 0 "[ . 1 . 2 . ]" 1
131 1 19 ARG H 1 19 ARG HG2 0.000 . 3.740 3.495 2.124 3.717 . 0 0 "[ . 1 . 2 . ]" 1
132 1 19 ARG H 1 19 ARG QG 0.000 . 3.400 2.277 2.099 2.442 . 0 0 "[ . 1 . 2 . ]" 1
133 1 19 ARG H 1 19 ARG HG3 0.000 . 3.740 2.390 2.167 3.304 . 0 0 "[ . 1 . 2 . ]" 1
134 1 19 ARG HA 1 19 ARG QD 0.000 . 5.020 3.984 2.064 4.201 . 0 0 "[ . 1 . 2 . ]" 1
135 1 19 ARG HA 1 19 ARG HE 0.000 . 4.810 4.326 3.957 4.763 . 0 0 "[ . 1 . 2 . ]" 1
136 1 19 ARG HA 1 19 ARG HG2 0.000 . 3.490 2.531 2.394 2.641 . 0 0 "[ . 1 . 2 . ]" 1
137 1 19 ARG HA 1 19 ARG HG3 0.000 . 3.490 2.805 2.605 3.565 0.075 14 0 "[ . 1 . 2 . ]" 1
138 1 19 ARG HA 1 22 SER H 0.000 . 3.650 3.719 3.667 3.753 0.103 20 0 "[ . 1 . 2 . ]" 1
139 1 19 ARG HA 1 22 SER HB2 0.000 . 4.330 3.673 3.449 4.181 . 0 0 "[ . 1 . 2 . ]" 1
140 1 19 ARG HA 1 22 SER QB 0.000 . 4.000 2.930 2.502 3.421 . 0 0 "[ . 1 . 2 . ]" 1
141 1 19 ARG HA 1 22 SER HB3 0.000 . 4.330 3.101 2.568 3.931 . 0 0 "[ . 1 . 2 . ]" 1
142 1 19 ARG HB2 1 19 ARG QD 0.000 . 3.840 2.539 2.353 3.481 . 0 0 "[ . 1 . 2 . ]" 1
143 1 19 ARG HB2 1 19 ARG HE 0.000 . 4.110 3.097 2.483 3.741 . 0 0 "[ . 1 . 2 . ]" 1
144 1 19 ARG HB3 1 19 ARG QD 0.000 . 3.840 3.020 2.437 3.252 . 0 0 "[ . 1 . 2 . ]" 1
145 1 19 ARG HB3 1 19 ARG HE 0.000 . 4.110 2.267 1.895 2.877 . 0 0 "[ . 1 . 2 . ]" 1
146 1 19 ARG HE 1 19 ARG HG2 0.000 . 4.130 2.792 2.430 3.572 . 0 0 "[ . 1 . 2 . ]" 1
147 1 19 ARG HE 1 19 ARG HG3 0.000 . 4.130 3.595 2.271 3.883 . 0 0 "[ . 1 . 2 . ]" 1
148 1 20 TYR H 1 20 TYR HA 0.000 . 2.910 2.887 2.824 2.922 0.012 24 0 "[ . 1 . 2 . ]" 1
149 1 20 TYR H 1 20 TYR HB2 0.000 . 3.400 2.216 2.086 2.306 . 0 0 "[ . 1 . 2 . ]" 1
150 1 20 TYR H 1 20 TYR HB3 0.000 . 3.400 3.454 3.429 3.470 0.070 7 0 "[ . 1 . 2 . ]" 1
151 1 20 TYR H 1 20 TYR QE 0.000 . 6.960 4.623 4.322 5.012 . 0 0 "[ . 1 . 2 . ]" 1
152 1 20 TYR H 1 21 TYR H 0.000 . 3.000 2.342 1.964 2.649 . 0 0 "[ . 1 . 2 . ]" 1
153 1 20 TYR H 1 21 TYR QD 0.000 . 7.020 4.294 3.943 4.665 . 0 0 "[ . 1 . 2 . ]" 1
154 1 20 TYR H 1 21 TYR QE 0.000 . 8.080 5.126 4.857 5.420 . 0 0 "[ . 1 . 2 . ]" 1
155 1 20 TYR H 1 23 ALA MB 0.000 . 6.950 4.092 3.957 4.175 . 0 0 "[ . 1 . 2 . ]" 1
156 1 20 TYR H 1 24 LEU QD 0.000 . 8.500 4.194 4.038 4.297 . 0 0 "[ . 1 . 2 . ]" 1
157 1 20 TYR HA 1 20 TYR QE 0.000 . 6.360 3.988 3.893 4.067 . 0 0 "[ . 1 . 2 . ]" 1
158 1 20 TYR HA 1 21 TYR QD 0.000 . 5.480 5.187 4.774 5.357 . 0 0 "[ . 1 . 2 . ]" 1
159 1 20 TYR HA 1 23 ALA H 0.000 . 3.140 2.150 2.001 2.977 . 0 0 "[ . 1 . 2 . ]" 1
160 1 20 TYR HA 1 23 ALA MB 0.000 . 4.970 1.838 1.793 1.877 . 0 0 "[ . 1 . 2 . ]" 1
161 1 20 TYR HA 1 24 LEU H 0.000 . 4.000 2.389 2.030 2.508 . 0 0 "[ . 1 . 2 . ]" 1
162 1 20 TYR HA 1 24 LEU QD 0.000 . 6.060 2.431 2.207 2.701 . 0 0 "[ . 1 . 2 . ]" 1
163 1 20 TYR QD 1 23 ALA HA 0.000 . 7.300 4.498 4.412 4.621 . 0 0 "[ . 1 . 2 . ]" 1
164 1 20 TYR QD 1 23 ALA MB 0.000 . 8.080 2.046 1.877 2.210 . 0 0 "[ . 1 . 2 . ]" 1
165 1 20 TYR QD 1 24 LEU HA 0.000 . 8.100 5.852 5.576 5.906 . 0 0 "[ . 1 . 2 . ]" 1
166 1 20 TYR QD 1 24 LEU QD 0.000 . 6.070 2.637 2.481 2.763 . 0 0 "[ . 1 . 2 . ]" 1
167 1 20 TYR QE 1 23 ALA HA 0.000 . 6.800 5.486 5.325 5.626 . 0 0 "[ . 1 . 2 . ]" 1
168 1 20 TYR QE 1 23 ALA MB 0.000 . 8.510 2.878 2.720 3.020 . 0 0 "[ . 1 . 2 . ]" 1
169 1 20 TYR QE 1 24 LEU HA 0.000 . 7.300 6.808 6.710 6.904 . 0 0 "[ . 1 . 2 . ]" 1
170 1 20 TYR QE 1 24 LEU QD 0.000 . 5.920 3.692 3.573 3.889 . 0 0 "[ . 1 . 2 . ]" 1
171 1 21 TYR H 1 21 TYR HA 0.000 . 2.930 2.868 2.856 2.888 . 0 0 "[ . 1 . 2 . ]" 1
172 1 21 TYR H 1 21 TYR HB2 0.000 . 3.390 2.294 2.214 2.438 . 0 0 "[ . 1 . 2 . ]" 1
173 1 21 TYR H 1 21 TYR QB 0.000 . 3.210 2.262 2.189 2.392 . 0 0 "[ . 1 . 2 . ]" 1
174 1 21 TYR H 1 21 TYR HB3 0.000 . 3.390 3.442 3.416 3.466 0.076 20 0 "[ . 1 . 2 . ]" 1
175 1 21 TYR H 1 21 TYR QE 0.000 . 7.050 4.285 4.142 4.406 . 0 0 "[ . 1 . 2 . ]" 1
176 1 21 TYR H 1 22 SER H 0.000 . 6.500 2.370 2.291 2.451 . 0 0 "[ . 1 . 2 . ]" 1
177 1 21 TYR H 1 24 LEU QD 0.000 . 6.430 4.050 3.960 4.248 . 0 0 "[ . 1 . 2 . ]" 1
178 1 21 TYR HA 1 21 TYR QE 0.000 . 6.070 4.268 4.192 4.409 . 0 0 "[ . 1 . 2 . ]" 1
179 1 21 TYR HA 1 22 SER H 0.000 . 3.410 3.282 3.162 3.348 . 0 0 "[ . 1 . 2 . ]" 1
180 1 21 TYR HA 1 24 LEU QB 0.000 . 4.360 3.526 3.501 3.588 . 0 0 "[ . 1 . 2 . ]" 1
181 1 21 TYR HA 1 24 LEU QD 0.000 . 5.550 3.479 3.409 3.991 . 0 0 "[ . 1 . 2 . ]" 1
182 1 21 TYR HA 1 25 ARG H 0.000 . 3.690 3.566 3.500 3.697 0.007 18 0 "[ . 1 . 2 . ]" 1
183 1 21 TYR HB2 1 22 SER H 0.000 . 4.000 3.099 3.028 3.194 . 0 0 "[ . 1 . 2 . ]" 1
184 1 21 TYR HB3 1 22 SER H 0.000 . 4.000 4.050 4.027 4.075 0.075 3 0 "[ . 1 . 2 . ]" 1
185 1 21 TYR QD 1 22 SER H 0.000 . 6.900 4.379 4.281 4.473 . 0 0 "[ . 1 . 2 . ]" 1
186 1 21 TYR QD 1 22 SER QB 0.000 . 7.000 5.374 5.151 5.701 . 0 0 "[ . 1 . 2 . ]" 1
187 1 21 TYR QD 1 22 SER HB3 . . 7.170 6.310 6.047 6.558 . 0 0 "[ . 1 . 2 . ]" 1
188 1 21 TYR QD 1 25 ARG HB2 0.000 . 6.060 5.156 5.000 5.357 . 0 0 "[ . 1 . 2 . ]" 1
189 1 21 TYR QD 1 25 ARG QB 0.000 . 6.670 4.892 4.773 5.049 . 0 0 "[ . 1 . 2 . ]" 1
190 1 21 TYR QD 1 25 ARG HB3 0.000 . 6.970 6.089 5.963 6.204 . 0 0 "[ . 1 . 2 . ]" 1
191 1 21 TYR QE 1 22 SER H 0.000 . 7.310 6.157 5.974 6.274 . 0 0 "[ . 1 . 2 . ]" 1
192 1 22 SER H 1 22 SER HA 0.000 . 2.650 2.840 2.820 2.852 0.202 18 0 "[ . 1 . 2 . ]" 1
193 1 22 SER H 1 22 SER HB2 0.000 . 3.400 2.801 2.697 3.366 . 0 0 "[ . 1 . 2 . ]" 1
194 1 22 SER H 1 22 SER HB3 0.000 . 3.400 2.622 2.484 3.097 . 0 0 "[ . 1 . 2 . ]" 1
195 1 22 SER H 1 23 ALA H 0.000 . 3.120 2.211 2.065 2.724 . 0 0 "[ . 1 . 2 . ]" 1
196 1 22 SER H 1 23 ALA MB 0.000 . 5.520 4.017 3.949 4.095 . 0 0 "[ . 1 . 2 . ]" 1
197 1 22 SER H 1 25 ARG QB 0.000 . 4.800 4.030 3.893 4.156 . 0 0 "[ . 1 . 2 . ]" 1
198 1 22 SER HA 1 25 ARG H 0.000 . 5.000 3.916 3.663 4.019 . 0 0 "[ . 1 . 2 . ]" 1
199 1 22 SER HA 1 25 ARG HB2 0.000 . 3.460 3.521 3.493 3.542 0.082 12 0 "[ . 1 . 2 . ]" 1
200 1 22 SER HA 1 25 ARG QB 0.000 . 3.280 2.385 2.253 2.474 . 0 0 "[ . 1 . 2 . ]" 1
201 1 22 SER HA 1 25 ARG HB3 0.000 . 3.460 2.426 2.280 2.527 . 0 0 "[ . 1 . 2 . ]" 1
202 1 22 SER HA 1 25 ARG QD 0.000 . 4.520 2.839 2.510 4.112 . 0 0 "[ . 1 . 2 . ]" 1
203 1 22 SER HA 1 25 ARG HE 0.000 . 4.310 3.272 2.363 4.335 0.025 19 0 "[ . 1 . 2 . ]" 1
204 1 22 SER HA 1 25 ARG QG 0.000 . 5.130 4.185 3.699 4.374 . 0 0 "[ . 1 . 2 . ]" 1
205 1 22 SER HA 1 25 ARG QH 0.000 . 9.800 3.486 2.033 4.795 . 0 0 "[ . 1 . 2 . ]" 1
206 1 23 ALA H 1 23 ALA HA 0.000 . 2.610 2.749 2.646 2.787 0.177 3 0 "[ . 1 . 2 . ]" 1
207 1 23 ALA H 1 24 LEU H 0.000 . 3.850 2.900 2.608 3.424 . 0 0 "[ . 1 . 2 . ]" 1
208 1 23 ALA HA 1 26 HIS H 0.000 . 5.000 3.616 3.258 3.944 . 0 0 "[ . 1 . 2 . ]" 1
209 1 23 ALA HA 1 26 HIS HB2 0.000 . 3.540 3.271 2.813 3.550 0.010 15 0 "[ . 1 . 2 . ]" 1
210 1 23 ALA HA 1 26 HIS HB3 0.000 . 3.420 2.829 2.685 3.051 . 0 0 "[ . 1 . 2 . ]" 1
211 1 23 ALA HA 1 26 HIS HD2 0.000 . 5.260 4.725 4.471 4.850 . 0 0 "[ . 1 . 2 . ]" 1
212 1 23 ALA HA 1 27 TYR QE 0.000 . 6.320 4.835 4.570 5.122 . 0 0 "[ . 1 . 2 . ]" 1
213 1 23 ALA MB 1 25 ARG H 0.000 . 5.420 4.210 4.127 4.289 . 0 0 "[ . 1 . 2 . ]" 1
214 1 23 ALA MB 1 26 HIS HB2 0.000 . 6.310 4.703 4.370 4.962 . 0 0 "[ . 1 . 2 . ]" 1
215 1 23 ALA MB 1 26 HIS HB3 0.000 . 6.090 4.146 3.957 4.292 . 0 0 "[ . 1 . 2 . ]" 1
216 1 23 ALA MB 1 26 HIS HD2 0.000 . 7.100 5.844 5.569 5.937 . 0 0 "[ . 1 . 2 . ]" 1
217 1 23 ALA MB 1 27 TYR H 0.000 . 6.050 4.446 4.380 4.522 . 0 0 "[ . 1 . 2 . ]" 1
218 1 23 ALA MB 1 27 TYR QD 0.000 . 6.590 3.229 2.763 3.728 . 0 0 "[ . 1 . 2 . ]" 1
219 1 23 ALA MB 1 27 TYR QE 0.000 . 6.370 3.504 3.324 3.860 . 0 0 "[ . 1 . 2 . ]" 1
220 1 24 LEU HA 1 25 ARG H 0.000 . 3.380 3.396 3.367 3.425 0.045 18 0 "[ . 1 . 2 . ]" 1
221 1 24 LEU HA 1 26 HIS H 0.000 . 4.320 4.162 3.486 4.288 . 0 0 "[ . 1 . 2 . ]" 1
222 1 24 LEU HA 1 26 HIS QB 0.000 . 5.860 4.793 4.707 4.927 . 0 0 "[ . 1 . 2 . ]" 1
223 1 24 LEU HA 1 27 TYR H 0.000 . 3.270 3.014 2.928 3.113 . 0 0 "[ . 1 . 2 . ]" 1
224 1 24 LEU HA 1 27 TYR HB2 0.000 . 3.850 1.982 1.843 2.101 . 0 0 "[ . 1 . 2 . ]" 1
225 1 24 LEU HA 1 27 TYR HB3 0.000 . 3.850 3.491 2.988 3.649 . 0 0 "[ . 1 . 2 . ]" 1
226 1 24 LEU HA 1 27 TYR QD 0.000 . 6.550 2.725 2.103 3.546 . 0 0 "[ . 1 . 2 . ]" 1
227 1 24 LEU HA 1 27 TYR QE 0.000 . 7.220 4.668 4.249 5.010 . 0 0 "[ . 1 . 2 . ]" 1
228 1 24 LEU HA 1 28 ILE H 0.000 . 4.430 3.819 3.476 3.912 . 0 0 "[ . 1 . 2 . ]" 1
229 1 24 LEU QD 1 25 ARG H 0.000 . 5.820 3.306 3.240 3.568 . 0 0 "[ . 1 . 2 . ]" 1
230 1 24 LEU QD 1 26 HIS H 0.000 . 5.900 4.535 4.297 4.574 . 0 0 "[ . 1 . 2 . ]" 1
231 1 24 LEU QD 1 27 TYR HB2 0.000 . 5.870 2.961 2.870 3.273 . 0 0 "[ . 1 . 2 . ]" 1
232 1 24 LEU QD 1 27 TYR HB3 0.000 . 5.870 3.762 3.678 4.171 . 0 0 "[ . 1 . 2 . ]" 1
233 1 24 LEU QD 1 27 TYR QD 0.000 . 6.550 2.816 2.114 3.595 . 0 0 "[ . 1 . 2 . ]" 1
234 1 25 ARG H 1 25 ARG HB2 0.000 . 3.420 2.602 2.369 2.687 . 0 0 "[ . 1 . 2 . ]" 1
235 1 25 ARG H 1 25 ARG QB 0.000 . 3.240 2.250 2.200 2.296 . 0 0 "[ . 1 . 2 . ]" 1
236 1 25 ARG H 1 25 ARG HB3 0.000 . 3.420 2.467 2.402 2.612 . 0 0 "[ . 1 . 2 . ]" 1
237 1 25 ARG H 1 25 ARG QD 0.000 . 5.300 4.620 4.571 4.651 . 0 0 "[ . 1 . 2 . ]" 1
238 1 25 ARG H 1 25 ARG QG 0.000 . 4.820 4.066 4.025 4.115 . 0 0 "[ . 1 . 2 . ]" 1
239 1 25 ARG HA 1 25 ARG QD 0.000 . 4.920 4.256 3.461 4.371 . 0 0 "[ . 1 . 2 . ]" 1
240 1 25 ARG HA 1 25 ARG HE 0.000 . 4.410 4.157 3.855 4.422 0.012 15 0 "[ . 1 . 2 . ]" 1
241 1 25 ARG HA 1 27 TYR H 0.000 . 5.000 4.066 3.988 4.158 . 0 0 "[ . 1 . 2 . ]" 1
242 1 25 ARG HA 1 28 ILE H 0.000 . 3.450 3.450 3.293 3.548 0.098 18 0 "[ . 1 . 2 . ]" 1
243 1 25 ARG HA 1 28 ILE HB 0.000 . 3.500 2.976 2.679 3.275 . 0 0 "[ . 1 . 2 . ]" 1
244 1 25 ARG HA 1 28 ILE MD 0.000 . 5.120 4.173 3.307 4.771 . 0 0 "[ . 1 . 2 . ]" 1
245 1 25 ARG HA 1 28 ILE QG 0.000 . 5.350 4.661 4.242 4.870 . 0 0 "[ . 1 . 2 . ]" 1
246 1 25 ARG HA 1 28 ILE MG 0.000 . 5.150 3.111 2.706 3.888 . 0 0 "[ . 1 . 2 . ]" 1
247 1 25 ARG HA 1 29 ASN H 0.000 . 5.000 4.496 4.319 4.618 . 0 0 "[ . 1 . 2 . ]" 1
248 1 25 ARG HA 1 29 ASN QD 0.000 . 6.130 3.496 2.792 3.631 . 0 0 "[ . 1 . 2 . ]" 1
249 1 25 ARG QB 1 25 ARG HE 0.000 . 3.700 2.074 1.867 2.517 . 0 0 "[ . 1 . 2 . ]" 1
250 1 25 ARG QB 1 29 ASN QD 0.000 . 4.600 3.714 3.659 3.820 . 0 0 "[ . 1 . 2 . ]" 1
251 1 25 ARG HB2 1 25 ARG HE 0.000 . 3.940 3.348 1.939 3.950 0.010 18 0 "[ . 1 . 2 . ]" 1
252 1 25 ARG HB2 1 26 HIS H 0.000 . 3.860 3.608 3.487 3.924 0.064 18 0 "[ . 1 . 2 . ]" 1
253 1 25 ARG HB2 1 29 ASN HD21 0.000 . 4.970 5.041 5.009 5.062 0.092 15 0 "[ . 1 . 2 . ]" 1
254 1 25 ARG HB2 1 29 ASN HD22 0.000 . 4.970 5.031 4.993 5.059 0.089 2 0 "[ . 1 . 2 . ]" 1
255 1 25 ARG HB3 1 25 ARG HE 0.000 . 3.940 2.291 1.875 3.309 . 0 0 "[ . 1 . 2 . ]" 1
256 1 25 ARG HB3 1 26 HIS H 0.000 . 3.860 2.260 2.141 3.150 . 0 0 "[ . 1 . 2 . ]" 1
257 1 25 ARG HB3 1 29 ASN HD21 0.000 . 4.970 4.273 4.189 4.550 . 0 0 "[ . 1 . 2 . ]" 1
258 1 25 ARG HB3 1 29 ASN HD22 0.000 . 4.970 4.693 4.567 4.841 . 0 0 "[ . 1 . 2 . ]" 1
259 1 25 ARG QD 1 26 HIS HD2 0.000 . 6.780 6.063 5.965 6.118 . 0 0 "[ . 1 . 2 . ]" 1
260 1 25 ARG QD 1 29 ASN QD 0.000 . 7.430 3.081 1.685 3.973 0.095 22 0 "[ . 1 . 2 . ]" 1
261 1 25 ARG HE 1 28 ILE MG 0.000 . 6.500 5.224 4.834 5.368 . 0 0 "[ . 1 . 2 . ]" 1
262 1 25 ARG QG 1 29 ASN HD21 0.000 . 6.340 2.626 2.221 3.332 . 0 0 "[ . 1 . 2 . ]" 1
263 1 25 ARG QG 1 29 ASN QD 0.000 . 6.110 2.070 1.890 2.552 . 0 0 "[ . 1 . 2 . ]" 1
264 1 25 ARG QG 1 29 ASN HD22 0.000 . 6.340 2.173 2.031 2.650 . 0 0 "[ . 1 . 2 . ]" 1
265 1 26 HIS H 1 26 HIS HA 0.000 . 2.910 2.926 2.913 3.010 0.100 18 0 "[ . 1 . 2 . ]" 1
266 1 26 HIS H 1 26 HIS HB2 0.000 . 3.430 2.529 2.464 2.611 . 0 0 "[ . 1 . 2 . ]" 1
267 1 26 HIS H 1 26 HIS HB3 0.000 . 3.400 2.883 2.802 2.982 . 0 0 "[ . 1 . 2 . ]" 1
268 1 26 HIS H 1 27 TYR H 0.000 . 3.090 2.426 1.739 2.523 0.041 18 0 "[ . 1 . 2 . ]" 1
269 1 26 HIS H 1 29 ASN QD 0.000 . 6.090 3.708 3.588 3.861 . 0 0 "[ . 1 . 2 . ]" 1
270 1 26 HIS HA 1 27 TYR H 0.000 . 3.440 3.416 3.305 3.447 0.007 22 0 "[ . 1 . 2 . ]" 1
271 1 26 HIS HA 1 29 ASN HB2 0.000 . 3.900 2.446 2.382 2.578 . 0 0 "[ . 1 . 2 . ]" 1
272 1 26 HIS HA 1 29 ASN HB3 0.000 . 3.900 3.942 3.910 3.984 0.084 15 0 "[ . 1 . 2 . ]" 1
273 1 26 HIS HB2 1 26 HIS HE1 0.000 . 5.330 5.148 5.124 5.170 . 0 0 "[ . 1 . 2 . ]" 1
274 1 26 HIS HB2 1 27 TYR H 0.000 . 3.670 3.686 3.452 3.713 0.043 22 0 "[ . 1 . 2 . ]" 1
275 1 26 HIS HB2 1 27 TYR QD 0.000 . 7.020 5.353 4.588 5.970 . 0 0 "[ . 1 . 2 . ]" 1
276 1 26 HIS HB2 1 27 TYR QE 0.000 . 8.150 6.660 5.944 7.184 . 0 0 "[ . 1 . 2 . ]" 1
277 1 26 HIS HB2 1 29 ASN QD 0.000 . 5.460 4.411 4.186 4.809 . 0 0 "[ . 1 . 2 . ]" 1
278 1 26 HIS HB3 1 26 HIS HE1 0.000 . 5.120 4.933 4.893 5.001 . 0 0 "[ . 1 . 2 . ]" 1
279 1 26 HIS HB3 1 27 TYR H 0.000 . 3.550 2.718 2.602 2.797 . 0 0 "[ . 1 . 2 . ]" 1
280 1 26 HIS HB3 1 27 TYR QD 0.000 . 6.720 3.898 2.997 4.571 . 0 0 "[ . 1 . 2 . ]" 1
281 1 26 HIS HB3 1 27 TYR QE 0.000 . 7.260 5.139 4.370 5.694 . 0 0 "[ . 1 . 2 . ]" 1
282 1 26 HIS HD1 1 29 ASN HA 0.000 . 5.420 5.449 5.428 5.502 0.082 18 0 "[ . 1 . 2 . ]" 1
283 1 26 HIS HD1 1 30 LEU MD1 0.000 . 6.190 4.618 3.160 4.873 . 0 0 "[ . 1 . 2 . ]" 1
284 1 26 HIS HD1 1 30 LEU QD 0.000 . 5.750 4.212 3.132 4.383 . 0 0 "[ . 1 . 2 . ]" 1
285 1 26 HIS HD1 1 30 LEU MD2 0.000 . 6.190 4.907 4.654 5.125 . 0 0 "[ . 1 . 2 . ]" 1
286 1 26 HIS HD1 1 30 LEU HG 0.000 . 4.790 4.352 3.856 4.585 . 0 0 "[ . 1 . 2 . ]" 1
287 1 27 TYR H 1 27 TYR HA 0.000 . 2.850 2.780 2.742 2.811 . 0 0 "[ . 1 . 2 . ]" 1
288 1 27 TYR H 1 27 TYR HB2 0.000 . 3.380 2.240 2.074 2.347 . 0 0 "[ . 1 . 2 . ]" 1
289 1 27 TYR H 1 27 TYR HB3 0.000 . 3.380 3.452 3.333 3.497 0.117 22 0 "[ . 1 . 2 . ]" 1
290 1 27 TYR H 1 27 TYR QE 0.000 . 6.380 4.988 4.707 5.292 . 0 0 "[ . 1 . 2 . ]" 1
291 1 27 TYR H 1 28 ILE H 0.000 . 3.260 2.653 2.532 2.794 . 0 0 "[ . 1 . 2 . ]" 1
292 1 27 TYR H 1 29 ASN QD 0.000 . 5.450 4.131 3.971 4.276 . 0 0 "[ . 1 . 2 . ]" 1
293 1 27 TYR HA 1 28 ILE H 0.000 . 3.570 3.419 3.390 3.464 . 0 0 "[ . 1 . 2 . ]" 1
294 1 27 TYR HA 1 29 ASN QD 0.000 . 6.060 5.235 5.171 5.283 . 0 0 "[ . 1 . 2 . ]" 1
295 1 27 TYR HA 1 30 LEU H 0.000 . 3.590 3.081 2.903 3.308 . 0 0 "[ . 1 . 2 . ]" 1
296 1 27 TYR QB 1 31 ILE MD 0.000 . 5.220 3.061 1.893 3.493 . 0 0 "[ . 1 . 2 . ]" 1
297 1 27 TYR HB2 1 31 ILE MD 0.000 . 5.370 4.528 3.341 4.995 . 0 0 "[ . 1 . 2 . ]" 1
298 1 27 TYR HB2 1 31 ILE MG 0.000 . 5.630 4.627 4.582 4.724 . 0 0 "[ . 1 . 2 . ]" 1
299 1 27 TYR HB3 1 31 ILE MD 0.000 . 5.370 3.114 1.903 3.566 . 0 0 "[ . 1 . 2 . ]" 1
300 1 27 TYR HB3 1 31 ILE MG 0.000 . 5.630 3.324 3.224 3.570 . 0 0 "[ . 1 . 2 . ]" 1
301 1 27 TYR QD 1 28 ILE H 0.000 . 6.710 4.143 4.047 4.197 . 0 0 "[ . 1 . 2 . ]" 1
302 1 27 TYR QD 1 28 ILE HA 0.000 . 6.660 4.448 4.191 4.707 . 0 0 "[ . 1 . 2 . ]" 1
303 1 27 TYR QD 1 30 LEU H 0.000 . 7.480 4.796 4.403 5.359 . 0 0 "[ . 1 . 2 . ]" 1
304 1 27 TYR QD 1 30 LEU QD 0.000 . 7.750 3.671 2.655 4.599 . 0 0 "[ . 1 . 2 . ]" 1
305 1 27 TYR QD 1 30 LEU HG 0.000 . 6.890 5.802 5.196 6.344 . 0 0 "[ . 1 . 2 . ]" 1
306 1 27 TYR QD 1 31 ILE H 0.000 . 6.820 4.358 3.818 5.160 . 0 0 "[ . 1 . 2 . ]" 1
307 1 27 TYR QD 1 31 ILE HB 0.000 . 6.600 2.636 2.125 3.624 . 0 0 "[ . 1 . 2 . ]" 1
308 1 27 TYR QD 1 31 ILE MD 0.000 . 6.410 2.425 2.028 3.259 . 0 0 "[ . 1 . 2 . ]" 1
309 1 27 TYR QD 1 31 ILE QG 0.000 . 7.110 3.675 3.039 4.416 . 0 0 "[ . 1 . 2 . ]" 1
310 1 27 TYR QD 1 31 ILE MG 0.000 . 6.750 3.675 3.114 4.185 . 0 0 "[ . 1 . 2 . ]" 1
311 1 27 TYR QE 1 28 ILE HA 0.000 . 7.010 6.514 6.321 6.667 . 0 0 "[ . 1 . 2 . ]" 1
312 1 27 TYR QE 1 31 ILE H 0.000 . 6.960 5.894 5.498 6.499 . 0 0 "[ . 1 . 2 . ]" 1
313 1 27 TYR QE 1 31 ILE HB 0.000 . 6.430 4.281 3.740 5.041 . 0 0 "[ . 1 . 2 . ]" 1
314 1 28 ILE H 1 28 ILE HB 0.000 . 3.450 2.028 1.923 2.113 . 0 0 "[ . 1 . 2 . ]" 1
315 1 28 ILE H 1 28 ILE MD 0.000 . 5.490 3.158 2.197 4.239 . 0 0 "[ . 1 . 2 . ]" 1
316 1 28 ILE H 1 28 ILE QG 0.000 . 4.580 3.804 3.550 4.017 . 0 0 "[ . 1 . 2 . ]" 1
317 1 28 ILE H 1 29 ASN H 0.000 . 2.960 2.653 2.579 2.799 . 0 0 "[ . 1 . 2 . ]" 1
318 1 28 ILE HA 1 29 ASN H 0.000 . 3.270 3.268 3.165 3.301 0.031 2 0 "[ . 1 . 2 . ]" 1
319 1 28 ILE HA 1 30 LEU H 0.000 . 4.630 4.221 4.146 4.400 . 0 0 "[ . 1 . 2 . ]" 1
320 1 28 ILE HA 1 31 ILE H 0.000 . 3.380 3.459 3.418 3.495 0.115 15 0 "[ . 1 . 2 . ]" 1
321 1 28 ILE HA 1 31 ILE HB 0.000 . 3.450 3.321 2.611 3.454 0.004 23 0 "[ . 1 . 2 . ]" 1
322 1 28 ILE HA 1 31 ILE MD 0.000 . 5.330 3.469 2.723 3.675 . 0 0 "[ . 1 . 2 . ]" 1
323 1 28 ILE HA 1 31 ILE QG 0.000 . 5.070 4.492 4.085 4.583 . 0 0 "[ . 1 . 2 . ]" 1
324 1 28 ILE HA 1 32 THR MG 0.000 . 6.850 4.339 4.188 4.522 . 0 0 "[ . 1 . 2 . ]" 1
325 1 28 ILE HB 1 29 ASN H 0.000 . 3.470 3.365 2.883 3.521 0.051 10 0 "[ . 1 . 2 . ]" 1
326 1 28 ILE HB 1 29 ASN QD 0.000 . 5.050 4.081 3.321 4.556 . 0 0 "[ . 1 . 2 . ]" 1
327 1 28 ILE HB 1 31 ILE MD 0.000 . 6.120 5.400 4.309 5.658 . 0 0 "[ . 1 . 2 . ]" 1
328 1 28 ILE MD 1 29 ASN H 0.000 . 5.620 4.555 3.990 4.956 . 0 0 "[ . 1 . 2 . ]" 1
329 1 28 ILE QG 1 29 ASN H 0.000 . 4.970 4.339 4.156 4.484 . 0 0 "[ . 1 . 2 . ]" 1
330 1 28 ILE QG 1 32 THR MG 0.000 . 6.520 4.540 4.313 4.752 . 0 0 "[ . 1 . 2 . ]" 1
331 1 28 ILE MG 1 29 ASN H 0.000 . 4.860 2.409 2.148 2.719 . 0 0 "[ . 1 . 2 . ]" 1
332 1 28 ILE MG 1 29 ASN HD21 0.000 . 6.140 2.762 2.295 3.379 . 0 0 "[ . 1 . 2 . ]" 1
333 1 28 ILE MG 1 29 ASN QD 0.000 . 5.770 2.381 2.010 2.850 . 0 0 "[ . 1 . 2 . ]" 1
334 1 28 ILE MG 1 29 ASN HD22 0.000 . 6.140 2.605 2.221 3.070 . 0 0 "[ . 1 . 2 . ]" 1
335 1 28 ILE MG 1 30 LEU H 0.000 . 7.160 4.498 4.335 4.743 . 0 0 "[ . 1 . 2 . ]" 1
336 1 28 ILE MG 1 31 ILE H 0.000 . 5.900 4.864 4.841 4.912 . 0 0 "[ . 1 . 2 . ]" 1
337 1 28 ILE MG 1 32 THR MG 0.000 . 6.510 3.721 3.369 4.007 . 0 0 "[ . 1 . 2 . ]" 1
338 1 29 ASN H 1 29 ASN HA 0.000 . 2.860 2.849 2.824 2.870 0.010 18 0 "[ . 1 . 2 . ]" 1
339 1 29 ASN H 1 29 ASN HB2 0.000 . 3.460 2.299 2.203 2.396 . 0 0 "[ . 1 . 2 . ]" 1
340 1 29 ASN H 1 29 ASN HB3 0.000 . 3.460 3.513 3.476 3.547 0.087 14 0 "[ . 1 . 2 . ]" 1
341 1 29 ASN H 1 29 ASN QD 0.000 . 5.440 2.512 2.136 2.764 . 0 0 "[ . 1 . 2 . ]" 1
342 1 29 ASN H 1 30 LEU H 0.000 . 3.130 2.555 2.404 2.706 . 0 0 "[ . 1 . 2 . ]" 1
343 1 29 ASN H 1 31 ILE H 0.000 . 4.000 3.644 3.471 3.758 . 0 0 "[ . 1 . 2 . ]" 1
344 1 29 ASN H 1 32 THR MG 0.000 . 7.030 4.062 3.913 4.217 . 0 0 "[ . 1 . 2 . ]" 1
345 1 29 ASN HA 1 29 ASN HD21 0.000 . 4.120 3.988 3.705 4.084 . 0 0 "[ . 1 . 2 . ]" 1
346 1 29 ASN HA 1 29 ASN HD22 0.000 . 4.120 4.218 4.149 4.243 0.123 20 0 "[ . 1 . 2 . ]" 1
347 1 29 ASN HA 1 30 LEU H 0.000 . 3.390 3.413 3.367 3.463 0.073 2 0 "[ . 1 . 2 . ]" 1
348 1 29 ASN HA 1 32 THR H 0.000 . 3.570 3.711 3.673 3.755 0.185 17 0 "[ . 1 . 2 . ]" 1
349 1 29 ASN HA 1 32 THR HB 0.000 . 3.970 3.962 3.849 4.007 0.037 6 0 "[ . 1 . 2 . ]" 1
350 1 29 ASN HA 1 32 THR MG 0.000 . 7.290 2.236 2.097 2.386 . 0 0 "[ . 1 . 2 . ]" 1
351 1 29 ASN QB 1 30 LEU HA 0.000 . 6.070 3.961 3.905 4.068 . 0 0 "[ . 1 . 2 . ]" 1
352 1 29 ASN QB 1 31 ILE H 0.000 . 4.780 4.303 4.288 4.317 . 0 0 "[ . 1 . 2 . ]" 1
353 1 29 ASN QB 1 32 THR MG 0.000 . 8.160 3.704 3.607 3.871 . 0 0 "[ . 1 . 2 . ]" 1
354 1 29 ASN HB2 1 30 LEU H 0.000 . 4.030 2.750 2.570 2.815 . 0 0 "[ . 1 . 2 . ]" 1
355 1 29 ASN HB2 1 31 ILE H 0.000 . 5.000 4.637 4.602 4.667 . 0 0 "[ . 1 . 2 . ]" 1
356 1 29 ASN HB3 1 30 LEU H 0.000 . 4.030 3.473 3.303 3.538 . 0 0 "[ . 1 . 2 . ]" 1
357 1 29 ASN HB3 1 31 ILE H 0.000 . 5.000 5.101 5.071 5.134 0.134 22 0 "[ . 1 . 2 . ]" 1
358 1 30 LEU H 1 30 LEU HB2 0.000 . 4.030 2.957 2.790 3.772 . 0 0 "[ . 1 . 2 . ]" 1
359 1 30 LEU H 1 30 LEU QB 0.000 . 3.740 2.202 2.129 2.557 . 0 0 "[ . 1 . 2 . ]" 1
360 1 30 LEU H 1 30 LEU HB3 0.000 . 4.030 2.274 2.177 2.601 . 0 0 "[ . 1 . 2 . ]" 1
361 1 30 LEU H 1 30 LEU HG 0.000 . 4.670 4.637 3.975 4.696 0.026 14 0 "[ . 1 . 2 . ]" 1
362 1 30 LEU H 1 31 ILE H 0.000 . 3.090 2.088 1.965 2.247 . 0 0 "[ . 1 . 2 . ]" 1
363 1 30 LEU H 1 31 ILE HB 0.000 . 4.270 3.943 3.603 4.065 . 0 0 "[ . 1 . 2 . ]" 1
364 1 30 LEU H 1 31 ILE QG 0.000 . 6.220 5.597 5.354 5.633 . 0 0 "[ . 1 . 2 . ]" 1
365 1 30 LEU H 1 31 ILE MG 0.000 . 7.310 3.555 3.364 3.918 . 0 0 "[ . 1 . 2 . ]" 1
366 1 30 LEU HA 1 31 ILE H 0.000 . 3.370 3.365 3.328 3.405 0.035 10 0 "[ . 1 . 2 . ]" 1
367 1 30 LEU HA 1 33 ARG H 0.000 . 3.940 3.865 3.602 3.964 0.024 24 0 "[ . 1 . 2 . ]" 1
368 1 30 LEU HA 1 33 ARG HB2 0.000 . 5.000 4.565 3.714 5.064 0.064 25 0 "[ . 1 . 2 . ]" 1
369 1 30 LEU HA 1 33 ARG QB 0.000 . 4.500 3.802 2.759 4.043 . 0 0 "[ . 1 . 2 . ]" 1
370 1 30 LEU HA 1 33 ARG HB3 0.000 . 5.000 4.336 2.845 5.022 0.022 7 0 "[ . 1 . 2 . ]" 1
371 1 30 LEU HA 1 33 ARG QD 0.000 . 5.440 3.145 2.119 4.665 . 0 0 "[ . 1 . 2 . ]" 1
372 1 30 LEU QD 1 32 THR MG 0.000 . 7.460 4.403 4.120 4.525 . 0 0 "[ . 1 . 2 . ]" 1
373 1 30 LEU QD 1 33 ARG QB 0.000 . 7.390 3.569 2.513 4.881 . 0 0 "[ . 1 . 2 . ]" 1
374 1 30 LEU QD 1 33 ARG QD 0.000 . 8.670 2.677 1.918 4.606 . 0 0 "[ . 1 . 2 . ]" 1
375 1 30 LEU QD 1 33 ARG QG 0.000 . 5.540 2.789 2.553 3.393 . 0 0 "[ . 1 . 2 . ]" 1
376 1 30 LEU QD 1 34 GLN QB 0.000 . 6.330 3.753 3.310 3.961 . 0 0 "[ . 1 . 2 . ]" 1
377 1 30 LEU MD1 1 32 THR MG 0.000 . 8.660 5.099 4.543 5.326 . 0 0 "[ . 1 . 2 . ]" 1
378 1 30 LEU MD1 1 33 ARG HB2 0.000 . 9.150 5.546 3.829 6.989 . 0 0 "[ . 1 . 2 . ]" 1
379 1 30 LEU MD1 1 33 ARG HB3 0.000 . 9.150 5.820 3.985 6.395 . 0 0 "[ . 1 . 2 . ]" 1
380 1 30 LEU MD1 1 33 ARG QG 0.000 . 6.060 4.017 3.748 4.356 . 0 0 "[ . 1 . 2 . ]" 1
381 1 30 LEU MD1 1 34 GLN HB2 0.000 . 7.020 4.360 3.670 5.686 . 0 0 "[ . 1 . 2 . ]" 1
382 1 30 LEU MD1 1 34 GLN HB3 0.000 . 7.020 4.616 4.062 4.995 . 0 0 "[ . 1 . 2 . ]" 1
383 1 30 LEU MD2 1 32 THR MG 0.000 . 8.660 4.828 4.444 5.298 . 0 0 "[ . 1 . 2 . ]" 1
384 1 30 LEU MD2 1 33 ARG HB2 0.000 . 9.150 4.124 2.778 5.879 . 0 0 "[ . 1 . 2 . ]" 1
385 1 30 LEU MD2 1 33 ARG HB3 0.000 . 9.150 4.385 2.587 5.790 . 0 0 "[ . 1 . 2 . ]" 1
386 1 30 LEU MD2 1 33 ARG QG 0.000 . 6.060 2.849 2.594 3.553 . 0 0 "[ . 1 . 2 . ]" 1
387 1 30 LEU MD2 1 34 GLN HB2 0.000 . 7.020 5.251 4.407 5.714 . 0 0 "[ . 1 . 2 . ]" 1
388 1 30 LEU MD2 1 34 GLN HB3 0.000 . 7.020 5.509 4.297 5.732 . 0 0 "[ . 1 . 2 . ]" 1
389 1 31 ILE H 1 31 ILE HA 0.000 . 2.660 2.832 2.786 2.860 0.200 25 0 "[ . 1 . 2 . ]" 1
390 1 31 ILE H 1 31 ILE HB 0.000 . 3.100 2.381 1.954 2.497 . 0 0 "[ . 1 . 2 . ]" 1
391 1 31 ILE H 1 31 ILE MD 0.000 . 5.130 4.235 3.656 4.354 . 0 0 "[ . 1 . 2 . ]" 1
392 1 31 ILE H 1 31 ILE QG 0.000 . 4.290 3.905 3.690 3.940 . 0 0 "[ . 1 . 2 . ]" 1
393 1 31 ILE H 1 31 ILE MG 0.000 . 4.800 2.097 1.942 2.600 . 0 0 "[ . 1 . 2 . ]" 1
394 1 31 ILE H 1 34 GLN QG 0.000 . 6.370 4.320 4.025 5.224 . 0 0 "[ . 1 . 2 . ]" 1
395 1 31 ILE HA 1 32 THR MG 0.000 . 6.420 4.453 4.381 4.604 . 0 0 "[ . 1 . 2 . ]" 1
396 1 31 ILE HA 1 33 ARG H 0.000 . 4.580 3.966 3.535 4.584 0.004 10 0 "[ . 1 . 2 . ]" 1
397 1 31 ILE HA 1 34 GLN QB 0.000 . 4.670 2.222 1.989 2.472 . 0 0 "[ . 1 . 2 . ]" 1
398 1 31 ILE HA 1 34 GLN QG 0.000 . 5.370 2.187 1.853 3.189 . 0 0 "[ . 1 . 2 . ]" 1
399 1 31 ILE MG 1 32 THR HA 0.000 . 5.380 2.876 2.830 2.976 . 0 0 "[ . 1 . 2 . ]" 1
400 1 31 ILE MG 1 32 THR HB 0.000 . 5.800 3.311 3.142 3.478 . 0 0 "[ . 1 . 2 . ]" 1
401 1 31 ILE MG 1 32 THR MG 0.000 . 4.840 3.056 3.005 3.102 . 0 0 "[ . 1 . 2 . ]" 1
402 1 31 ILE MG 1 34 GLN HB2 0.000 . 6.360 4.257 3.981 5.382 . 0 0 "[ . 1 . 2 . ]" 1
403 1 31 ILE MG 1 34 GLN QB 0.000 . 5.810 3.967 3.872 4.137 . 0 0 "[ . 1 . 2 . ]" 1
404 1 31 ILE MG 1 34 GLN HB3 0.000 . 6.360 5.183 4.248 5.390 . 0 0 "[ . 1 . 2 . ]" 1
405 1 31 ILE MG 1 34 GLN QE 0.000 . 8.540 5.967 4.417 6.260 . 0 0 "[ . 1 . 2 . ]" 1
406 1 31 ILE MG 1 34 GLN QG 0.000 . 6.910 4.254 3.341 4.859 . 0 0 "[ . 1 . 2 . ]" 1
407 1 32 THR H 1 32 THR HA 0.000 . 2.610 2.710 2.691 2.739 0.129 14 0 "[ . 1 . 2 . ]" 1
408 1 32 THR H 1 32 THR HB 0.000 . 3.630 2.556 2.462 2.652 . 0 0 "[ . 1 . 2 . ]" 1
409 1 32 THR H 1 33 ARG H 0.000 . 3.230 2.781 2.660 2.889 . 0 0 "[ . 1 . 2 . ]" 1
410 1 32 THR HA 1 33 ARG H 0.000 . 3.390 3.439 3.376 3.475 0.085 10 0 "[ . 1 . 2 . ]" 1
411 1 32 THR HA 1 35 ARG QB 0.000 . 5.500 3.889 2.568 4.920 . 0 0 "[ . 1 . 2 . ]" 1
412 1 32 THR HB 1 33 ARG H 0.000 . 4.200 3.982 3.794 4.218 0.018 14 0 "[ . 1 . 2 . ]" 1
413 1 32 THR MG 1 33 ARG H 0.000 . 5.840 1.970 1.691 2.447 0.089 13 0 "[ . 1 . 2 . ]" 1
414 1 32 THR MG 1 34 GLN QG 0.000 . 6.800 4.953 4.894 5.074 . 0 0 "[ . 1 . 2 . ]" 1
415 1 32 THR MG 1 35 ARG H 0.000 . 7.270 5.293 5.047 5.729 . 0 0 "[ . 1 . 2 . ]" 1
416 1 32 THR MG 1 35 ARG QD 0.000 . 6.140 4.455 4.218 4.656 . 0 0 "[ . 1 . 2 . ]" 1
417 1 32 THR MG 1 36 TYR QD 0.000 . 7.210 4.524 3.928 5.095 . 0 0 "[ . 1 . 2 . ]" 1
418 1 33 ARG H 1 33 ARG HA 0.000 . 2.830 2.847 2.820 2.902 0.072 14 0 "[ . 1 . 2 . ]" 1
419 1 33 ARG H 1 33 ARG HB2 0.000 . 3.460 3.188 2.643 3.527 0.067 25 0 "[ . 1 . 2 . ]" 1
420 1 33 ARG H 1 33 ARG HB3 0.000 . 3.460 2.809 2.106 3.544 0.084 22 0 "[ . 1 . 2 . ]" 1
421 1 33 ARG H 1 33 ARG QD 0.000 . 5.900 3.911 2.948 4.853 . 0 0 "[ . 1 . 2 . ]" 1
422 1 33 ARG H 1 34 GLN H 0.000 . 3.360 2.583 2.133 2.771 . 0 0 "[ . 1 . 2 . ]" 1
423 1 33 ARG H 1 34 GLN QG 0.000 . 6.650 4.061 3.588 4.600 . 0 0 "[ . 1 . 2 . ]" 1
424 1 33 ARG HA 1 33 ARG QD 0.000 . 5.010 4.108 2.039 4.492 . 0 0 "[ . 1 . 2 . ]" 1
425 1 33 ARG HA 1 33 ARG HE 0.000 . 4.350 4.016 2.312 4.426 0.076 1 0 "[ . 1 . 2 . ]" 1
426 1 33 ARG QB 1 34 GLN H 0.000 . 3.920 2.937 1.874 3.591 . 0 0 "[ . 1 . 2 . ]" 1
427 1 33 ARG HB2 1 33 ARG QD 0.000 . 3.590 2.760 2.307 3.320 . 0 0 "[ . 1 . 2 . ]" 1
428 1 33 ARG HB2 1 34 GLN H 0.000 . 4.100 3.286 1.887 4.122 0.022 16 0 "[ . 1 . 2 . ]" 1
429 1 33 ARG HB3 1 33 ARG QD 0.000 . 3.590 2.634 2.202 3.145 . 0 0 "[ . 1 . 2 . ]" 1
430 1 33 ARG HB3 1 34 GLN H 0.000 . 4.100 3.688 2.937 4.062 . 0 0 "[ . 1 . 2 . ]" 1
431 1 33 ARG QG 1 34 GLN QG 0.000 . 6.300 3.243 2.094 5.005 . 0 0 "[ . 1 . 2 . ]" 1
432 1 34 GLN H 1 34 GLN HA 0.000 . 2.430 2.635 2.563 2.699 0.269 24 0 "[ . 1 . 2 . ]" 1
433 1 34 GLN H 1 34 GLN HB2 0.000 . 3.710 2.544 2.111 3.317 . 0 0 "[ . 1 . 2 . ]" 1
434 1 34 GLN H 1 34 GLN QB 0.000 . 3.460 2.304 1.975 2.566 . 0 0 "[ . 1 . 2 . ]" 1
435 1 34 GLN H 1 34 GLN HB3 0.000 . 3.710 3.246 1.990 3.533 . 0 0 "[ . 1 . 2 . ]" 1
436 1 34 GLN H 1 34 GLN QG 0.000 . 4.880 2.287 1.825 3.052 . 0 0 "[ . 1 . 2 . ]" 1
437 1 34 GLN H 1 35 ARG H 0.000 . 2.940 2.877 2.590 2.977 0.037 26 0 "[ . 1 . 2 . ]" 1
438 1 34 GLN QB 1 35 ARG H 0.000 . 3.470 2.420 2.103 3.135 . 0 0 "[ . 1 . 2 . ]" 1
439 1 34 GLN HB2 1 34 GLN HE22 0.000 . 5.400 4.805 3.529 5.324 . 0 0 "[ . 1 . 2 . ]" 1
440 1 34 GLN HB2 1 35 ARG H 0.000 . 3.780 2.579 2.138 3.836 0.056 4 0 "[ . 1 . 2 . ]" 1
441 1 34 GLN HB3 1 34 GLN HE22 0.000 . 5.400 3.933 3.349 5.321 . 0 0 "[ . 1 . 2 . ]" 1
442 1 34 GLN HB3 1 35 ARG H 0.000 . 3.780 3.216 2.679 3.578 . 0 0 "[ . 1 . 2 . ]" 1
443 1 34 GLN QG 1 35 ARG H 0.000 . 5.400 3.662 1.761 4.172 0.019 8 0 "[ . 1 . 2 . ]" 1
444 1 35 ARG H 1 35 ARG HA 0.000 . 2.420 2.636 2.595 2.674 0.254 9 0 "[ . 1 . 2 . ]" 1
445 1 35 ARG H 1 35 ARG QD 0.000 . 4.760 3.066 1.716 3.780 0.064 23 0 "[ . 1 . 2 . ]" 1
446 1 35 ARG H 1 35 ARG HG2 0.000 . 3.670 2.526 1.836 3.340 . 0 0 "[ . 1 . 2 . ]" 1
447 1 35 ARG H 1 35 ARG QG 0.000 . 3.490 1.940 1.733 2.313 0.047 8 0 "[ . 1 . 2 . ]" 1
448 1 35 ARG H 1 35 ARG HG3 0.000 . 3.670 2.597 1.763 3.590 0.017 19 0 "[ . 1 . 2 . ]" 1
449 1 35 ARG H 1 36 TYR QE 0.000 . 5.990 5.534 5.089 5.704 . 0 0 "[ . 1 . 2 . ]" 1
450 1 35 ARG HA 1 35 ARG QD 0.000 . 4.780 4.087 3.509 4.269 . 0 0 "[ . 1 . 2 . ]" 1
451 1 35 ARG QB 1 36 TYR QD 0.000 . 7.390 3.364 2.722 4.096 . 0 0 "[ . 1 . 2 . ]" 1
452 1 35 ARG QG 1 36 TYR H 0.000 . 4.670 2.949 1.895 3.961 . 0 0 "[ . 1 . 2 . ]" 1
453 1 36 TYR H 1 36 TYR HB2 0.000 . 3.420 2.574 2.488 2.755 . 0 0 "[ . 1 . 2 . ]" 1
454 1 36 TYR H 1 36 TYR HB3 0.000 . 3.620 3.628 3.607 3.642 0.022 16 0 "[ . 1 . 2 . ]" 1
455 1 36 TYR H 1 36 TYR QE 0.000 . 7.390 4.396 4.058 4.654 . 0 0 "[ . 1 . 2 . ]" 1
stop_
save_
Contact the webmaster for help, if required. Monday, April 29, 2024 9:13:41 PM GMT (wattos1)