NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
559217 |
2m2o   |
18924 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2m2o
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 710
_Distance_constraint_stats_list.Viol_count 9
_Distance_constraint_stats_list.Viol_total 44.208
_Distance_constraint_stats_list.Viol_max 0.255
_Distance_constraint_stats_list.Viol_rms 0.0039
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.1694
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 2 ILE 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 3 VAL 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 4 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 5 GLN 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 6 CYS 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 7 CYS 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 8 THR 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 9 SER 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 10 ILE 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 11 CYS 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 12 SER 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 13 LEU 0.113 0.113 22 0 "[ . 1 . 2 . ]"
1 14 TYR 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 15 GLN 1.180 0.255 25 0 "[ . 1 . 2 . ]"
1 16 LEU 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 17 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 18 ASN 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 19 TYR 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 20 CYS 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 21 ASN 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 1 PHE 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 2 VAL 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 3 ASN 0.088 0.088 23 0 "[ . 1 . 2 . ]"
2 4 GLN 0.088 0.088 23 0 "[ . 1 . 2 . ]"
2 5 HIS 0.031 0.031 2 0 "[ . 1 . 2 . ]"
2 6 LEU 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 7 CYS 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 8 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 9 SER 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 10 HIS 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 11 LEU 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 12 VAL 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 13 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 14 ALA 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 15 LEU 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 16 TYR 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 17 LEU 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 18 VAL 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 19 CYS 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 20 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 21 GLU 0.112 0.112 24 0 "[ . 1 . 2 . ]"
2 22 ARG 0.112 0.112 24 0 "[ . 1 . 2 . ]"
2 23 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 25 PHE 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 26 TYR 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 27 THR 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 28 PRO 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 29 LYS 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 30 THR 0.000 0.000 . 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 GLY QA 1 2 ILE H 2.920 . 3.420 2.223 2.087 2.294 . 0 0 "[ . 1 . 2 . ]" 1
2 1 1 GLY QA 1 2 ILE MG 5.430 . 5.930 3.584 3.159 3.911 . 0 0 "[ . 1 . 2 . ]" 1
3 1 1 GLY QA 1 19 TYR QD 6.930 . 7.430 4.735 3.230 5.511 . 0 0 "[ . 1 . 2 . ]" 1
4 1 1 GLY QA 1 19 TYR QE 5.620 . 6.120 3.763 2.636 4.474 . 0 0 "[ . 1 . 2 . ]" 1
5 1 2 ILE H 1 2 ILE HB 3.740 . 4.240 2.498 2.212 2.820 . 0 0 "[ . 1 . 2 . ]" 1
6 1 2 ILE H 1 2 ILE MD 5.300 . 5.800 4.350 4.161 4.524 . 0 0 "[ . 1 . 2 . ]" 1
7 1 2 ILE H 1 2 ILE QG 4.600 . 5.100 3.981 3.842 4.079 . 0 0 "[ . 1 . 2 . ]" 1
8 1 2 ILE H 1 2 ILE MG 3.450 . 3.950 2.065 1.854 2.951 . 0 0 "[ . 1 . 2 . ]" 1
9 1 2 ILE H 1 3 VAL CB 6.580 . 7.080 5.488 4.831 6.228 . 0 0 "[ . 1 . 2 . ]" 1
10 1 2 ILE H 1 3 VAL H 3.310 . 3.810 2.944 2.376 3.615 . 0 0 "[ . 1 . 2 . ]" 1
11 1 2 ILE H 1 19 TYR QD 5.070 . 5.570 4.173 3.243 4.522 . 0 0 "[ . 1 . 2 . ]" 1
12 1 2 ILE H 1 19 TYR QE 4.430 . 4.930 3.704 3.057 3.976 . 0 0 "[ . 1 . 2 . ]" 1
13 1 2 ILE HA 1 5 GLN HB2 4.490 . 4.990 3.010 2.395 4.143 . 0 0 "[ . 1 . 2 . ]" 1
14 1 2 ILE HA 1 5 GLN QB 4.310 . 4.810 2.712 2.376 3.197 . 0 0 "[ . 1 . 2 . ]" 1
15 1 2 ILE HA 1 5 GLN HB3 4.490 . 4.990 3.839 2.574 4.513 . 0 0 "[ . 1 . 2 . ]" 1
16 1 2 ILE HA 1 6 CYS H 4.380 . 4.880 3.956 3.389 4.414 . 0 0 "[ . 1 . 2 . ]" 1
17 1 2 ILE HA 1 19 TYR QE 4.490 . 4.990 2.978 2.596 3.402 . 0 0 "[ . 1 . 2 . ]" 1
18 1 2 ILE HB 1 3 VAL H 4.420 . 4.920 4.013 3.884 4.128 . 0 0 "[ . 1 . 2 . ]" 1
19 1 2 ILE HB 1 19 TYR QD 4.890 . 5.390 2.900 2.419 3.232 . 0 0 "[ . 1 . 2 . ]" 1
20 1 2 ILE HB 1 19 TYR QE 4.790 . 5.290 3.223 2.929 3.478 . 0 0 "[ . 1 . 2 . ]" 1
21 1 2 ILE MD 1 3 VAL H 5.620 . 6.120 4.491 3.738 4.738 . 0 0 "[ . 1 . 2 . ]" 1
22 1 2 ILE MD 1 6 CYS H 6.610 . 7.110 4.776 2.752 5.551 . 0 0 "[ . 1 . 2 . ]" 1
23 1 2 ILE MD 1 6 CYS QB 6.670 . 7.170 3.538 2.062 4.514 . 0 0 "[ . 1 . 2 . ]" 1
24 1 2 ILE MD 1 16 LEU CG 7.880 . 8.380 4.401 3.654 5.688 . 0 0 "[ . 1 . 2 . ]" 1
25 1 2 ILE MD 1 16 LEU HA 6.080 . 6.580 3.567 3.063 4.321 . 0 0 "[ . 1 . 2 . ]" 1
26 1 2 ILE MD 1 16 LEU QB 7.200 . 7.700 4.293 2.778 5.373 . 0 0 "[ . 1 . 2 . ]" 1
27 1 2 ILE MD 1 19 TYR H 6.210 . 6.710 4.684 4.238 5.249 . 0 0 "[ . 1 . 2 . ]" 1
28 1 2 ILE MD 1 19 TYR HB2 5.390 . 5.890 2.924 2.493 4.146 . 0 0 "[ . 1 . 2 . ]" 1
29 1 2 ILE MD 1 19 TYR HB3 6.290 . 6.790 2.864 2.083 4.615 . 0 0 "[ . 1 . 2 . ]" 1
30 1 2 ILE MD 1 19 TYR QD 4.810 . 5.310 2.618 2.158 3.470 . 0 0 "[ . 1 . 2 . ]" 1
31 1 2 ILE MD 1 19 TYR QE 5.580 . 6.080 3.380 2.416 3.931 . 0 0 "[ . 1 . 2 . ]" 1
32 1 2 ILE MD 2 11 LEU CG 6.910 . 7.410 3.267 2.927 3.935 . 0 0 "[ . 1 . 2 . ]" 1
33 1 2 ILE MD 2 11 LEU QB 7.200 . 7.700 4.295 4.006 4.957 . 0 0 "[ . 1 . 2 . ]" 1
34 1 2 ILE MD 2 11 LEU MD1 7.330 . 7.830 2.276 2.027 3.170 . 0 0 "[ . 1 . 2 . ]" 1
35 1 2 ILE MD 2 11 LEU MD2 7.330 . 7.830 2.671 1.967 3.408 . 0 0 "[ . 1 . 2 . ]" 1
36 1 2 ILE MD 2 11 LEU HG 5.920 . 6.420 2.939 2.245 4.535 . 0 0 "[ . 1 . 2 . ]" 1
37 1 2 ILE QG 1 19 TYR QE 5.520 . 6.020 3.236 2.453 4.461 . 0 0 "[ . 1 . 2 . ]" 1
38 1 2 ILE QG 2 11 LEU CG 7.070 . 7.570 3.416 2.927 5.156 . 0 0 "[ . 1 . 2 . ]" 1
39 1 2 ILE QG 2 11 LEU HG 5.890 . 6.390 3.293 2.427 4.766 . 0 0 "[ . 1 . 2 . ]" 1
40 1 2 ILE MG 1 3 VAL CB 6.520 . 7.020 3.817 3.609 4.039 . 0 0 "[ . 1 . 2 . ]" 1
41 1 2 ILE MG 1 3 VAL H 3.520 . 4.020 2.198 2.030 2.366 . 0 0 "[ . 1 . 2 . ]" 1
42 1 2 ILE MG 1 3 VAL HA 5.990 . 6.490 3.651 3.194 4.092 . 0 0 "[ . 1 . 2 . ]" 1
43 1 2 ILE MG 1 19 TYR HB2 6.530 . 7.030 4.790 3.774 5.473 . 0 0 "[ . 1 . 2 . ]" 1
44 1 2 ILE MG 1 19 TYR QD 5.450 . 5.950 3.938 3.694 4.085 . 0 0 "[ . 1 . 2 . ]" 1
45 1 2 ILE MG 1 19 TYR QE 5.920 . 6.420 4.390 4.115 4.467 . 0 0 "[ . 1 . 2 . ]" 1
46 1 3 VAL CB 1 4 GLU H 5.180 . 5.680 3.126 2.840 3.283 . 0 0 "[ . 1 . 2 . ]" 1
47 1 3 VAL CB 1 6 CYS H 7.640 . 8.140 5.510 5.123 6.337 . 0 0 "[ . 1 . 2 . ]" 1
48 1 3 VAL CB 1 7 CYS H 6.590 . 7.090 5.262 4.525 6.432 . 0 0 "[ . 1 . 2 . ]" 1
49 1 3 VAL CB 1 7 CYS QB 6.600 . 7.100 4.374 3.502 5.494 . 0 0 "[ . 1 . 2 . ]" 1
50 1 3 VAL H 1 3 VAL HB 2.710 . 3.210 2.542 2.296 2.762 . 0 0 "[ . 1 . 2 . ]" 1
51 1 3 VAL H 2 11 LEU CG 6.400 . 6.900 6.043 5.201 6.463 . 0 0 "[ . 1 . 2 . ]" 1
52 1 3 VAL HA 1 6 CYS H 4.680 . 5.180 3.720 3.304 4.326 . 0 0 "[ . 1 . 2 . ]" 1
53 1 3 VAL HA 1 7 CYS H 5.010 . 5.510 3.579 2.898 4.396 . 0 0 "[ . 1 . 2 . ]" 1
54 1 3 VAL HA 2 11 LEU CG 6.290 . 6.790 4.674 4.092 5.450 . 0 0 "[ . 1 . 2 . ]" 1
55 1 3 VAL HA 2 11 LEU MD1 6.610 . 7.110 4.145 2.793 4.875 . 0 0 "[ . 1 . 2 . ]" 1
56 1 3 VAL HA 2 11 LEU MD2 6.610 . 7.110 2.755 2.006 5.289 . 0 0 "[ . 1 . 2 . ]" 1
57 1 3 VAL MG1 1 4 GLU H 4.100 . 4.600 2.410 2.115 3.459 . 0 0 "[ . 1 . 2 . ]" 1
58 1 3 VAL MG1 1 7 CYS H 6.610 . 7.110 5.038 3.772 5.601 . 0 0 "[ . 1 . 2 . ]" 1
59 1 3 VAL MG2 1 4 GLU H 4.100 . 4.600 3.487 3.428 3.541 . 0 0 "[ . 1 . 2 . ]" 1
60 1 3 VAL MG2 1 7 CYS H 6.610 . 7.110 4.473 3.490 5.531 . 0 0 "[ . 1 . 2 . ]" 1
61 1 4 GLU H 1 4 GLU QG 4.440 . 4.940 2.471 1.801 3.967 . 0 0 "[ . 1 . 2 . ]" 1
62 1 4 GLU H 1 5 GLN H 3.630 . 4.130 2.817 2.467 3.680 . 0 0 "[ . 1 . 2 . ]" 1
63 1 4 GLU H 1 6 CYS H 4.600 . 5.100 4.401 4.130 4.602 . 0 0 "[ . 1 . 2 . ]" 1
64 1 4 GLU H 1 7 CYS H 5.180 . 5.680 4.447 3.027 5.074 . 0 0 "[ . 1 . 2 . ]" 1
65 1 4 GLU H 1 8 THR MG 6.610 . 7.110 4.989 3.387 5.611 . 0 0 "[ . 1 . 2 . ]" 1
66 1 4 GLU HA 1 6 CYS H 4.790 . 5.290 4.637 3.981 4.862 . 0 0 "[ . 1 . 2 . ]" 1
67 1 4 GLU HA 1 7 CYS H 4.950 . 5.450 3.861 3.156 4.485 . 0 0 "[ . 1 . 2 . ]" 1
68 1 4 GLU HA 1 8 THR H 4.410 . 4.910 3.915 3.081 4.564 . 0 0 "[ . 1 . 2 . ]" 1
69 1 4 GLU HA 1 8 THR HB 4.360 . 4.860 4.039 2.795 4.442 . 0 0 "[ . 1 . 2 . ]" 1
70 1 4 GLU HA 1 8 THR MG 5.380 . 5.880 2.984 1.994 4.159 . 0 0 "[ . 1 . 2 . ]" 1
71 1 4 GLU QB 1 8 THR MG 6.650 . 7.150 3.542 2.372 4.425 . 0 0 "[ . 1 . 2 . ]" 1
72 1 4 GLU QG 1 5 GLN H 5.750 . 6.250 3.827 2.203 4.739 . 0 0 "[ . 1 . 2 . ]" 1
73 1 4 GLU QG 1 7 CYS H 6.170 . 6.670 5.523 5.093 5.721 . 0 0 "[ . 1 . 2 . ]" 1
74 1 5 GLN HA 1 5 GLN QE 5.410 . 5.910 3.430 2.219 4.745 . 0 0 "[ . 1 . 2 . ]" 1
75 1 5 GLN QB 1 19 TYR QE 5.000 . 5.500 3.755 2.990 4.016 . 0 0 "[ . 1 . 2 . ]" 1
76 1 5 GLN HB2 1 19 TYR QE 5.280 . 5.780 4.213 3.524 4.795 . 0 0 "[ . 1 . 2 . ]" 1
77 1 5 GLN HB3 1 19 TYR QE 5.280 . 5.780 4.332 3.232 4.746 . 0 0 "[ . 1 . 2 . ]" 1
78 1 5 GLN QG 1 6 CYS H 5.230 . 5.730 4.131 3.136 4.666 . 0 0 "[ . 1 . 2 . ]" 1
79 1 5 GLN QG 1 19 TYR QE 6.380 . 6.880 4.185 2.435 5.109 . 0 0 "[ . 1 . 2 . ]" 1
80 1 5 GLN HG2 1 6 CYS H 5.500 . 6.000 4.816 4.081 5.390 . 0 0 "[ . 1 . 2 . ]" 1
81 1 5 GLN HG3 1 6 CYS H 5.500 . 6.000 4.596 3.248 5.370 . 0 0 "[ . 1 . 2 . ]" 1
82 1 6 CYS H 1 6 CYS HB2 3.860 . 4.360 2.439 2.043 2.654 . 0 0 "[ . 1 . 2 . ]" 1
83 1 6 CYS H 1 6 CYS QB 3.500 . 4.000 2.373 2.016 2.508 . 0 0 "[ . 1 . 2 . ]" 1
84 1 6 CYS H 1 6 CYS HB3 3.860 . 4.360 3.456 2.626 3.704 . 0 0 "[ . 1 . 2 . ]" 1
85 1 6 CYS H 1 8 THR MG 5.600 . 6.100 4.641 4.240 4.767 . 0 0 "[ . 1 . 2 . ]" 1
86 1 6 CYS H 1 19 TYR QE 6.170 . 6.670 5.404 4.534 5.584 . 0 0 "[ . 1 . 2 . ]" 1
87 1 6 CYS H 2 11 LEU CG 6.570 . 7.070 5.806 5.200 6.297 . 0 0 "[ . 1 . 2 . ]" 1
88 1 6 CYS H 2 11 LEU MD1 6.610 . 7.110 4.173 3.185 5.501 . 0 0 "[ . 1 . 2 . ]" 1
89 1 6 CYS H 2 11 LEU MD2 6.610 . 7.110 3.943 3.215 4.667 . 0 0 "[ . 1 . 2 . ]" 1
90 1 6 CYS QB 1 7 CYS H 4.490 . 4.990 3.156 2.787 3.906 . 0 0 "[ . 1 . 2 . ]" 1
91 1 6 CYS QB 2 11 LEU CG 5.920 . 6.420 3.589 2.871 4.019 . 0 0 "[ . 1 . 2 . ]" 1
92 1 6 CYS HB2 2 11 LEU MD1 5.620 . 6.120 2.510 2.062 3.862 . 0 0 "[ . 1 . 2 . ]" 1
93 1 6 CYS HB2 2 11 LEU MD2 5.620 . 6.120 2.890 2.181 4.336 . 0 0 "[ . 1 . 2 . ]" 1
94 1 6 CYS HB3 2 11 LEU MD1 5.620 . 6.120 2.464 2.007 4.518 . 0 0 "[ . 1 . 2 . ]" 1
95 1 6 CYS HB3 2 11 LEU MD2 5.620 . 6.120 3.368 2.390 4.440 . 0 0 "[ . 1 . 2 . ]" 1
96 1 7 CYS H 1 8 THR MG 6.030 . 6.530 3.790 3.364 4.522 . 0 0 "[ . 1 . 2 . ]" 1
97 1 7 CYS H 1 9 SER H 4.610 . 5.110 3.917 3.555 4.304 . 0 0 "[ . 1 . 2 . ]" 1
98 1 7 CYS H 2 11 LEU CG 6.740 . 7.240 6.018 5.460 6.445 . 0 0 "[ . 1 . 2 . ]" 1
99 1 7 CYS H 2 11 LEU MD1 6.610 . 7.110 4.603 3.569 5.544 . 0 0 "[ . 1 . 2 . ]" 1
100 1 7 CYS H 2 11 LEU MD2 6.610 . 7.110 4.059 3.285 5.507 . 0 0 "[ . 1 . 2 . ]" 1
101 1 7 CYS HA 2 5 HIS HB2 5.500 . 6.000 4.935 4.296 5.551 . 0 0 "[ . 1 . 2 . ]" 1
102 1 7 CYS HA 2 5 HIS HB3 4.530 . 5.030 3.459 2.775 4.192 . 0 0 "[ . 1 . 2 . ]" 1
103 1 7 CYS QB 1 8 THR H 4.070 . 4.570 3.015 2.712 3.368 . 0 0 "[ . 1 . 2 . ]" 1
104 1 7 CYS QB 1 8 THR MG 6.620 . 7.120 3.873 2.337 4.696 . 0 0 "[ . 1 . 2 . ]" 1
105 1 7 CYS QB 2 7 CYS HA 5.620 . 6.120 3.104 2.293 4.438 . 0 0 "[ . 1 . 2 . ]" 1
106 1 7 CYS QB 2 11 LEU CG 7.410 . 7.910 5.551 4.721 6.689 . 0 0 "[ . 1 . 2 . ]" 1
107 1 7 CYS HB2 1 8 THR H 4.290 . 4.790 3.940 3.050 4.322 . 0 0 "[ . 1 . 2 . ]" 1
108 1 7 CYS HB3 1 8 THR H 4.290 . 4.790 3.240 2.766 4.245 . 0 0 "[ . 1 . 2 . ]" 1
109 1 8 THR H 1 8 THR HB 3.760 . 4.260 2.991 2.447 3.670 . 0 0 "[ . 1 . 2 . ]" 1
110 1 8 THR H 1 9 SER H 4.500 . 5.000 2.302 1.938 3.390 . 0 0 "[ . 1 . 2 . ]" 1
111 1 8 THR H 1 9 SER HA 5.190 . 5.690 5.019 4.683 5.249 . 0 0 "[ . 1 . 2 . ]" 1
112 1 8 THR HB 1 9 SER H 4.250 . 4.750 4.064 3.551 4.324 . 0 0 "[ . 1 . 2 . ]" 1
113 1 9 SER HA 1 10 ILE H 3.290 . 3.790 2.456 2.320 2.685 . 0 0 "[ . 1 . 2 . ]" 1
114 1 9 SER QB 1 10 ILE H 3.730 . 4.230 2.608 2.104 3.325 . 0 0 "[ . 1 . 2 . ]" 1
115 1 9 SER QB 2 5 HIS HE1 5.990 . 6.490 4.525 3.926 5.127 . 0 0 "[ . 1 . 2 . ]" 1
116 1 10 ILE H 1 10 ILE HB 3.330 . 3.830 2.389 2.267 2.553 . 0 0 "[ . 1 . 2 . ]" 1
117 1 10 ILE H 1 10 ILE MD 4.920 . 5.420 3.771 3.632 3.910 . 0 0 "[ . 1 . 2 . ]" 1
118 1 10 ILE H 1 10 ILE HG12 4.540 . 5.040 3.497 3.200 3.658 . 0 0 "[ . 1 . 2 . ]" 1
119 1 10 ILE H 1 10 ILE QG 4.180 . 4.680 2.307 2.107 2.503 . 0 0 "[ . 1 . 2 . ]" 1
120 1 10 ILE H 1 10 ILE HG13 4.540 . 5.040 2.341 2.137 2.548 . 0 0 "[ . 1 . 2 . ]" 1
121 1 10 ILE H 1 11 CYS H 5.010 . 5.510 4.576 2.844 4.674 . 0 0 "[ . 1 . 2 . ]" 1
122 1 10 ILE HB 2 5 HIS HE1 5.500 . 6.000 5.451 5.233 5.518 . 0 0 "[ . 1 . 2 . ]" 1
123 1 10 ILE MD 2 3 ASN QB 6.480 . 6.980 3.088 2.190 4.270 . 0 0 "[ . 1 . 2 . ]" 1
124 1 10 ILE MD 2 4 GLN H 5.140 . 5.640 4.125 2.828 4.343 . 0 0 "[ . 1 . 2 . ]" 1
125 1 10 ILE MD 2 4 GLN HA 4.860 . 5.360 3.157 2.281 3.421 . 0 0 "[ . 1 . 2 . ]" 1
126 1 10 ILE MD 2 4 GLN HB2 6.610 . 7.110 5.183 3.983 5.519 . 0 0 "[ . 1 . 2 . ]" 1
127 1 10 ILE MD 2 4 GLN HB3 6.260 . 6.760 5.033 4.056 5.246 . 0 0 "[ . 1 . 2 . ]" 1
128 1 10 ILE MD 2 5 HIS H 4.980 . 5.480 4.078 3.650 4.176 . 0 0 "[ . 1 . 2 . ]" 1
129 1 10 ILE MD 2 5 HIS HD2 4.560 . 5.060 3.325 2.955 3.615 . 0 0 "[ . 1 . 2 . ]" 1
130 1 10 ILE MD 2 5 HIS HE1 5.330 . 5.830 4.447 4.349 4.476 . 0 0 "[ . 1 . 2 . ]" 1
131 1 10 ILE QG 2 5 HIS H 5.890 . 6.390 3.037 2.546 3.361 . 0 0 "[ . 1 . 2 . ]" 1
132 1 10 ILE QG 2 5 HIS HD2 4.930 . 5.430 2.741 2.616 3.066 . 0 0 "[ . 1 . 2 . ]" 1
133 1 10 ILE QG 2 5 HIS HE1 4.160 . 4.660 3.332 3.234 3.396 . 0 0 "[ . 1 . 2 . ]" 1
134 1 10 ILE HG12 2 5 HIS HD2 5.140 . 5.640 2.839 2.692 3.235 . 0 0 "[ . 1 . 2 . ]" 1
135 1 10 ILE HG13 2 5 HIS HD2 5.140 . 5.640 3.626 3.460 3.807 . 0 0 "[ . 1 . 2 . ]" 1
136 1 10 ILE MG 1 11 CYS H 5.090 . 5.590 2.535 2.394 3.204 . 0 0 "[ . 1 . 2 . ]" 1
137 1 10 ILE MG 2 3 ASN H 6.210 . 6.710 4.894 4.662 5.035 . 0 0 "[ . 1 . 2 . ]" 1
138 1 10 ILE MG 2 3 ASN HA 5.360 . 5.860 3.396 2.643 4.264 . 0 0 "[ . 1 . 2 . ]" 1
139 1 10 ILE MG 2 3 ASN QB 5.000 . 5.500 2.084 1.999 2.358 . 0 0 "[ . 1 . 2 . ]" 1
140 1 10 ILE MG 2 3 ASN HD21 6.260 . 6.760 3.012 2.278 4.288 . 0 0 "[ . 1 . 2 . ]" 1
141 1 10 ILE MG 2 3 ASN QD 6.010 . 6.510 2.900 2.240 4.100 . 0 0 "[ . 1 . 2 . ]" 1
142 1 10 ILE MG 2 3 ASN HD22 6.260 . 6.760 3.888 2.757 5.220 . 0 0 "[ . 1 . 2 . ]" 1
143 1 10 ILE MG 2 4 GLN H 4.520 . 5.020 2.490 2.072 3.024 . 0 0 "[ . 1 . 2 . ]" 1
144 1 10 ILE MG 2 4 GLN HA 5.630 . 6.130 3.330 2.730 3.807 . 0 0 "[ . 1 . 2 . ]" 1
145 1 10 ILE MG 2 4 GLN HB2 6.610 . 7.110 5.174 4.798 5.513 . 0 0 "[ . 1 . 2 . ]" 1
146 1 10 ILE MG 2 4 GLN HB3 6.610 . 7.110 4.971 4.603 5.265 . 0 0 "[ . 1 . 2 . ]" 1
147 1 10 ILE MG 2 5 HIS H 5.880 . 6.380 4.301 3.966 4.605 . 0 0 "[ . 1 . 2 . ]" 1
148 1 10 ILE MG 2 5 HIS HA 6.030 . 6.530 4.336 3.900 4.566 . 0 0 "[ . 1 . 2 . ]" 1
149 1 10 ILE MG 2 5 HIS HD2 6.580 . 7.080 4.756 4.596 5.193 . 0 0 "[ . 1 . 2 . ]" 1
150 1 11 CYS H 1 12 SER H 5.080 . 5.580 4.389 3.855 4.582 . 0 0 "[ . 1 . 2 . ]" 1
151 1 11 CYS QB 1 12 SER H 4.370 . 4.870 2.825 2.258 3.618 . 0 0 "[ . 1 . 2 . ]" 1
152 1 11 CYS QB 1 15 GLN QG 6.530 . 7.030 4.285 2.839 5.253 . 0 0 "[ . 1 . 2 . ]" 1
153 1 11 CYS HB2 1 12 SER H 4.450 . 4.950 3.357 2.277 4.512 . 0 0 "[ . 1 . 2 . ]" 1
154 1 11 CYS HB3 1 12 SER H 4.450 . 4.950 3.590 2.575 4.170 . 0 0 "[ . 1 . 2 . ]" 1
155 1 12 SER H 1 12 SER HB2 4.000 . 4.500 2.702 2.459 3.892 . 0 0 "[ . 1 . 2 . ]" 1
156 1 12 SER H 1 12 SER QB 3.680 . 4.180 2.557 2.297 3.027 . 0 0 "[ . 1 . 2 . ]" 1
157 1 12 SER H 1 12 SER HB3 4.000 . 4.500 3.609 2.677 3.869 . 0 0 "[ . 1 . 2 . ]" 1
158 1 12 SER H 1 14 TYR H 5.280 . 5.780 5.000 4.624 5.343 . 0 0 "[ . 1 . 2 . ]" 1
159 1 12 SER H 1 15 GLN H 4.200 . 4.700 3.662 3.250 3.962 . 0 0 "[ . 1 . 2 . ]" 1
160 1 12 SER H 1 15 GLN HB2 3.920 . 4.420 2.720 1.986 3.119 . 0 0 "[ . 1 . 2 . ]" 1
161 1 12 SER H 1 15 GLN HG2 4.420 . 4.920 4.186 2.703 4.489 . 0 0 "[ . 1 . 2 . ]" 1
162 1 12 SER H 1 15 GLN QG 4.110 . 4.610 2.998 2.469 3.263 . 0 0 "[ . 1 . 2 . ]" 1
163 1 12 SER H 1 15 GLN HG3 4.420 . 4.920 3.102 2.780 3.411 . 0 0 "[ . 1 . 2 . ]" 1
164 1 12 SER H 1 16 LEU H 4.420 . 4.920 4.314 3.528 4.491 . 0 0 "[ . 1 . 2 . ]" 1
165 1 12 SER HA 1 13 LEU H 2.700 . 3.200 2.374 2.294 2.480 . 0 0 "[ . 1 . 2 . ]" 1
166 1 12 SER HA 1 13 LEU HA 4.650 . 5.150 4.361 4.258 4.455 . 0 0 "[ . 1 . 2 . ]" 1
167 1 12 SER HA 1 13 LEU QB 5.510 . 6.010 4.464 4.196 4.749 . 0 0 "[ . 1 . 2 . ]" 1
168 1 12 SER HA 1 14 TYR H 4.430 . 4.930 4.346 3.992 4.486 . 0 0 "[ . 1 . 2 . ]" 1
169 1 12 SER HA 1 15 GLN H 4.950 . 5.450 4.680 4.511 4.815 . 0 0 "[ . 1 . 2 . ]" 1
170 1 12 SER HA 2 1 PHE QE 5.240 . 5.740 2.634 2.132 4.687 . 0 0 "[ . 1 . 2 . ]" 1
171 1 12 SER QB 1 13 LEU H 3.370 . 3.870 2.515 2.321 3.039 . 0 0 "[ . 1 . 2 . ]" 1
172 1 12 SER QB 1 13 LEU QB 6.400 . 6.900 4.297 3.570 4.809 . 0 0 "[ . 1 . 2 . ]" 1
173 1 12 SER QB 1 14 TYR H 3.730 . 4.230 2.741 2.398 2.936 . 0 0 "[ . 1 . 2 . ]" 1
174 1 12 SER QB 1 14 TYR QD 4.620 . 5.120 2.639 2.334 2.855 . 0 0 "[ . 1 . 2 . ]" 1
175 1 12 SER QB 1 14 TYR QE 5.640 . 6.140 3.879 3.480 4.308 . 0 0 "[ . 1 . 2 . ]" 1
176 1 12 SER QB 1 15 GLN H 5.120 . 5.620 3.094 2.699 3.608 . 0 0 "[ . 1 . 2 . ]" 1
177 1 12 SER HB2 1 13 LEU H 3.820 . 4.320 3.567 2.441 3.841 . 0 0 "[ . 1 . 2 . ]" 1
178 1 12 SER HB2 1 14 TYR H 3.870 . 4.370 3.267 2.529 4.018 . 0 0 "[ . 1 . 2 . ]" 1
179 1 12 SER HB2 1 14 TYR QD 4.710 . 5.210 3.126 2.499 3.582 . 0 0 "[ . 1 . 2 . ]" 1
180 1 12 SER HB2 1 14 TYR QE 5.770 . 6.270 4.948 3.818 5.154 . 0 0 "[ . 1 . 2 . ]" 1
181 1 12 SER HB3 1 13 LEU H 3.820 . 4.320 2.703 2.353 3.861 . 0 0 "[ . 1 . 2 . ]" 1
182 1 12 SER HB3 1 14 TYR H 3.870 . 4.370 3.073 2.416 3.962 . 0 0 "[ . 1 . 2 . ]" 1
183 1 12 SER HB3 1 14 TYR QD 4.710 . 5.210 2.914 2.468 3.705 . 0 0 "[ . 1 . 2 . ]" 1
184 1 12 SER HB3 1 14 TYR QE 5.770 . 6.270 4.144 3.628 5.145 . 0 0 "[ . 1 . 2 . ]" 1
185 1 13 LEU CG 1 14 TYR H 6.370 . 6.870 3.380 2.981 4.398 . 0 0 "[ . 1 . 2 . ]" 1
186 1 13 LEU CG 1 14 TYR QD 7.520 . 8.020 4.588 4.131 5.898 . 0 0 "[ . 1 . 2 . ]" 1
187 1 13 LEU CG 1 14 TYR QE 7.330 . 7.830 4.576 4.092 6.009 . 0 0 "[ . 1 . 2 . ]" 1
188 1 13 LEU CG 1 17 GLU QG 7.050 . 7.550 5.132 4.420 5.924 . 0 0 "[ . 1 . 2 . ]" 1
189 1 13 LEU CG 2 1 PHE QD 6.870 . 7.370 4.041 2.879 4.463 . 0 0 "[ . 1 . 2 . ]" 1
190 1 13 LEU CG 2 1 PHE QE 7.180 . 7.680 4.848 3.348 5.521 . 0 0 "[ . 1 . 2 . ]" 1
191 1 13 LEU CG 2 18 VAL HB 7.640 . 8.140 5.540 4.121 6.591 . 0 0 "[ . 1 . 2 . ]" 1
192 1 13 LEU CG 2 18 VAL MG1 7.460 . 7.960 5.204 4.707 5.779 . 0 0 "[ . 1 . 2 . ]" 1
193 1 13 LEU H 1 13 LEU QB 3.060 . 3.560 2.425 2.200 2.758 . 0 0 "[ . 1 . 2 . ]" 1
194 1 13 LEU H 1 13 LEU MD1 5.010 . 5.510 3.452 1.687 4.078 0.113 22 0 "[ . 1 . 2 . ]" 1
195 1 13 LEU H 1 13 LEU MD2 5.010 . 5.510 2.850 1.851 3.900 . 0 0 "[ . 1 . 2 . ]" 1
196 1 13 LEU H 1 13 LEU HG 3.580 . 4.080 2.965 2.065 3.633 . 0 0 "[ . 1 . 2 . ]" 1
197 1 13 LEU H 1 14 TYR H 3.250 . 3.750 2.853 2.625 2.922 . 0 0 "[ . 1 . 2 . ]" 1
198 1 13 LEU H 1 14 TYR HA 5.500 . 6.000 5.479 5.306 5.521 . 0 0 "[ . 1 . 2 . ]" 1
199 1 13 LEU H 1 14 TYR HB2 5.120 . 5.620 5.129 4.969 5.164 . 0 0 "[ . 1 . 2 . ]" 1
200 1 13 LEU H 1 14 TYR QD 5.560 . 6.060 4.427 4.109 4.697 . 0 0 "[ . 1 . 2 . ]" 1
201 1 13 LEU H 1 15 GLN H 4.670 . 5.170 4.313 4.155 4.406 . 0 0 "[ . 1 . 2 . ]" 1
202 1 13 LEU H 2 1 PHE QD 5.410 . 5.910 3.582 2.813 4.734 . 0 0 "[ . 1 . 2 . ]" 1
203 1 13 LEU HA 1 15 GLN H 4.690 . 5.190 4.049 3.733 4.465 . 0 0 "[ . 1 . 2 . ]" 1
204 1 13 LEU HA 1 16 LEU CG 6.980 . 7.480 3.662 3.133 4.345 . 0 0 "[ . 1 . 2 . ]" 1
205 1 13 LEU HA 1 16 LEU H 3.770 . 4.270 3.327 2.899 3.780 . 0 0 "[ . 1 . 2 . ]" 1
206 1 13 LEU HA 1 16 LEU HB2 4.680 . 5.180 2.643 2.194 4.301 . 0 0 "[ . 1 . 2 . ]" 1
207 1 13 LEU HA 1 16 LEU QB 4.420 . 4.920 2.509 2.182 2.977 . 0 0 "[ . 1 . 2 . ]" 1
208 1 13 LEU HA 1 16 LEU HB3 4.680 . 5.180 4.024 2.504 4.647 . 0 0 "[ . 1 . 2 . ]" 1
209 1 13 LEU HA 1 16 LEU HG 4.840 . 5.340 3.466 2.674 4.325 . 0 0 "[ . 1 . 2 . ]" 1
210 1 13 LEU HA 2 1 PHE QD 6.170 . 6.670 4.421 3.043 5.285 . 0 0 "[ . 1 . 2 . ]" 1
211 1 13 LEU HA 2 1 PHE QE 5.770 . 6.270 3.858 2.797 4.470 . 0 0 "[ . 1 . 2 . ]" 1
212 1 13 LEU QB 1 14 TYR H 4.020 . 4.520 3.317 2.120 3.641 . 0 0 "[ . 1 . 2 . ]" 1
213 1 13 LEU QB 1 14 TYR HA 5.660 . 6.160 4.468 3.751 4.818 . 0 0 "[ . 1 . 2 . ]" 1
214 1 13 LEU QB 1 14 TYR QD 6.190 . 6.690 4.649 3.567 4.931 . 0 0 "[ . 1 . 2 . ]" 1
215 1 13 LEU QB 1 15 GLN H 5.920 . 6.420 4.918 4.385 5.292 . 0 0 "[ . 1 . 2 . ]" 1
216 1 13 LEU QB 2 1 PHE QD 5.920 . 6.420 3.253 2.395 4.726 . 0 0 "[ . 1 . 2 . ]" 1
217 1 13 LEU QB 2 1 PHE QE 6.310 . 6.810 3.733 2.502 5.054 . 0 0 "[ . 1 . 2 . ]" 1
218 1 13 LEU MD1 1 14 TYR H 6.060 . 6.560 3.562 1.823 4.442 . 0 0 "[ . 1 . 2 . ]" 1
219 1 13 LEU MD1 2 1 PHE QD 6.700 . 7.200 3.777 2.238 4.973 . 0 0 "[ . 1 . 2 . ]" 1
220 1 13 LEU MD1 2 1 PHE QE 7.000 . 7.500 4.719 2.908 5.236 . 0 0 "[ . 1 . 2 . ]" 1
221 1 13 LEU MD1 2 18 VAL MG1 7.760 . 8.260 4.660 3.966 5.435 . 0 0 "[ . 1 . 2 . ]" 1
222 1 13 LEU MD2 1 14 TYR H 6.060 . 6.560 3.436 2.073 4.782 . 0 0 "[ . 1 . 2 . ]" 1
223 1 13 LEU MD2 2 1 PHE QD 6.700 . 7.200 2.875 2.123 3.846 . 0 0 "[ . 1 . 2 . ]" 1
224 1 13 LEU MD2 2 1 PHE QE 7.000 . 7.500 4.002 2.618 5.233 . 0 0 "[ . 1 . 2 . ]" 1
225 1 13 LEU MD2 2 18 VAL MG1 7.760 . 8.260 4.964 2.936 5.471 . 0 0 "[ . 1 . 2 . ]" 1
226 1 13 LEU HG 1 14 TYR H 4.460 . 4.960 3.139 2.189 4.691 . 0 0 "[ . 1 . 2 . ]" 1
227 1 14 TYR H 1 14 TYR QD 4.010 . 4.510 2.784 2.525 3.025 . 0 0 "[ . 1 . 2 . ]" 1
228 1 14 TYR HA 1 14 TYR QE 5.400 . 5.900 4.626 4.581 4.691 . 0 0 "[ . 1 . 2 . ]" 1
229 1 14 TYR HB2 1 15 GLN H 3.650 . 4.150 2.926 2.631 3.095 . 0 0 "[ . 1 . 2 . ]" 1
230 1 14 TYR HB3 1 15 GLN H 4.040 . 4.540 4.005 3.785 4.104 . 0 0 "[ . 1 . 2 . ]" 1
231 1 14 TYR QD 1 15 GLN H 4.880 . 5.380 4.287 4.005 4.411 . 0 0 "[ . 1 . 2 . ]" 1
232 1 14 TYR QD 1 15 GLN QG 5.900 . 6.400 4.509 4.249 4.701 . 0 0 "[ . 1 . 2 . ]" 1
233 1 15 GLN H 1 15 GLN HB2 3.500 . 4.000 2.508 2.336 2.670 . 0 0 "[ . 1 . 2 . ]" 1
234 1 15 GLN H 1 16 LEU H 3.110 . 3.610 2.400 2.146 2.664 . 0 0 "[ . 1 . 2 . ]" 1
235 1 15 GLN H 1 16 LEU QB 5.030 . 5.530 4.277 3.755 4.532 . 0 0 "[ . 1 . 2 . ]" 1
236 1 15 GLN H 1 16 LEU HG 5.500 . 6.000 4.305 3.937 5.518 . 0 0 "[ . 1 . 2 . ]" 1
237 1 15 GLN H 1 17 GLU H 4.270 . 4.770 3.951 3.712 4.199 . 0 0 "[ . 1 . 2 . ]" 1
238 1 15 GLN HA 1 15 GLN HE21 4.620 . 5.120 4.124 2.143 4.719 . 0 0 "[ . 1 . 2 . ]" 1
239 1 15 GLN HA 1 18 ASN H 3.870 . 4.370 3.560 3.148 3.934 . 0 0 "[ . 1 . 2 . ]" 1
240 1 15 GLN HA 1 18 ASN QB 5.740 . 6.240 3.289 2.397 4.057 . 0 0 "[ . 1 . 2 . ]" 1
241 1 15 GLN HA 1 18 ASN HD21 4.210 . 4.710 2.874 2.085 3.408 . 0 0 "[ . 1 . 2 . ]" 1
242 1 15 GLN HA 1 18 ASN HD22 4.210 . 4.710 3.573 2.654 4.318 . 0 0 "[ . 1 . 2 . ]" 1
243 1 15 GLN HA 1 19 TYR H 5.500 . 6.000 5.034 4.181 5.649 . 0 0 "[ . 1 . 2 . ]" 1
244 1 15 GLN HB2 1 15 GLN HE22 4.320 . 4.820 4.252 3.869 5.075 0.255 25 0 "[ . 1 . 2 . ]" 1
245 1 15 GLN HB2 1 16 LEU H 3.730 . 4.230 2.558 2.420 2.770 . 0 0 "[ . 1 . 2 . ]" 1
246 1 15 GLN HB3 1 15 GLN HE21 3.800 . 4.300 2.636 2.343 3.547 . 0 0 "[ . 1 . 2 . ]" 1
247 1 15 GLN HB3 1 15 GLN HE22 3.580 . 4.080 3.696 3.620 3.945 . 0 0 "[ . 1 . 2 . ]" 1
248 1 15 GLN HB3 1 16 LEU H 4.180 . 4.680 3.644 3.392 3.863 . 0 0 "[ . 1 . 2 . ]" 1
249 1 15 GLN QG 1 16 LEU H 4.730 . 5.230 4.048 3.824 4.206 . 0 0 "[ . 1 . 2 . ]" 1
250 1 15 GLN HG2 1 16 LEU H 5.030 . 5.530 4.876 4.210 5.074 . 0 0 "[ . 1 . 2 . ]" 1
251 1 15 GLN HG3 1 16 LEU H 5.030 . 5.530 4.386 3.990 5.054 . 0 0 "[ . 1 . 2 . ]" 1
252 1 16 LEU CG 1 19 TYR HB3 7.210 . 7.710 7.089 6.809 7.270 . 0 0 "[ . 1 . 2 . ]" 1
253 1 16 LEU CG 1 19 TYR QD 6.520 . 7.020 4.304 3.856 4.652 . 0 0 "[ . 1 . 2 . ]" 1
254 1 16 LEU CG 1 19 TYR QE 6.340 . 6.840 4.979 4.312 5.685 . 0 0 "[ . 1 . 2 . ]" 1
255 1 16 LEU CG 2 1 PHE QE 7.870 . 8.370 4.579 4.181 5.128 . 0 0 "[ . 1 . 2 . ]" 1
256 1 16 LEU CG 2 14 ALA MB 6.620 . 7.120 4.177 3.639 4.976 . 0 0 "[ . 1 . 2 . ]" 1
257 1 16 LEU CG 2 15 LEU HA 6.010 . 6.510 4.203 3.896 4.740 . 0 0 "[ . 1 . 2 . ]" 1
258 1 16 LEU CG 2 18 VAL HB 7.160 . 7.660 5.560 4.150 5.903 . 0 0 "[ . 1 . 2 . ]" 1
259 1 16 LEU CG 2 18 VAL MG1 6.720 . 7.220 3.655 2.750 4.106 . 0 0 "[ . 1 . 2 . ]" 1
260 1 16 LEU H 1 16 LEU HB2 3.560 . 4.060 2.481 2.323 3.180 . 0 0 "[ . 1 . 2 . ]" 1
261 1 16 LEU H 1 16 LEU QB 3.220 . 3.720 2.363 1.929 2.494 . 0 0 "[ . 1 . 2 . ]" 1
262 1 16 LEU H 1 16 LEU HB3 3.560 . 4.060 3.470 1.947 3.610 . 0 0 "[ . 1 . 2 . ]" 1
263 1 16 LEU H 1 16 LEU MD1 5.370 . 5.870 3.593 3.243 4.388 . 0 0 "[ . 1 . 2 . ]" 1
264 1 16 LEU H 1 16 LEU MD2 5.370 . 5.870 3.443 3.103 3.772 . 0 0 "[ . 1 . 2 . ]" 1
265 1 16 LEU H 1 16 LEU HG 3.580 . 4.080 2.363 2.109 3.654 . 0 0 "[ . 1 . 2 . ]" 1
266 1 16 LEU H 1 18 ASN H 4.530 . 5.030 4.296 4.125 4.558 . 0 0 "[ . 1 . 2 . ]" 1
267 1 16 LEU H 1 19 TYR QD 5.860 . 6.360 4.292 4.072 4.853 . 0 0 "[ . 1 . 2 . ]" 1
268 1 16 LEU H 1 19 TYR QE 5.430 . 5.930 4.485 4.029 4.857 . 0 0 "[ . 1 . 2 . ]" 1
269 1 16 LEU HA 1 16 LEU HG 4.240 . 4.740 3.095 2.864 3.617 . 0 0 "[ . 1 . 2 . ]" 1
270 1 16 LEU HA 1 19 TYR QD 3.200 . 3.700 1.964 1.924 2.063 . 0 0 "[ . 1 . 2 . ]" 1
271 1 16 LEU HA 1 19 TYR QE 3.950 . 4.450 3.468 2.682 3.598 . 0 0 "[ . 1 . 2 . ]" 1
272 1 16 LEU QB 2 18 VAL MG1 5.300 . 5.800 2.234 1.965 3.995 . 0 0 "[ . 1 . 2 . ]" 1
273 1 16 LEU HB2 1 19 TYR QD 5.310 . 5.810 4.761 3.629 4.907 . 0 0 "[ . 1 . 2 . ]" 1
274 1 16 LEU HB2 2 18 VAL MG1 5.520 . 6.020 2.463 2.210 4.606 . 0 0 "[ . 1 . 2 . ]" 1
275 1 16 LEU HB3 1 19 TYR QD 5.310 . 5.810 4.208 3.631 4.767 . 0 0 "[ . 1 . 2 . ]" 1
276 1 16 LEU HB3 2 18 VAL MG1 5.520 . 6.020 2.597 2.139 4.385 . 0 0 "[ . 1 . 2 . ]" 1
277 1 16 LEU MD1 2 15 LEU HA 5.360 . 5.860 3.023 2.044 3.822 . 0 0 "[ . 1 . 2 . ]" 1
278 1 16 LEU MD2 2 15 LEU HA 5.360 . 5.860 3.586 2.958 3.965 . 0 0 "[ . 1 . 2 . ]" 1
279 1 16 LEU HG 1 19 TYR QD 5.430 . 5.930 4.480 3.737 4.878 . 0 0 "[ . 1 . 2 . ]" 1
280 1 17 GLU H 1 17 GLU HA 2.920 . 3.420 2.853 2.800 2.903 . 0 0 "[ . 1 . 2 . ]" 1
281 1 17 GLU H 1 17 GLU QB 3.550 . 4.050 2.328 2.238 2.394 . 0 0 "[ . 1 . 2 . ]" 1
282 1 17 GLU H 1 17 GLU HG2 3.810 . 4.310 3.503 2.555 3.829 . 0 0 "[ . 1 . 2 . ]" 1
283 1 17 GLU H 1 17 GLU QG 3.410 . 3.910 2.504 2.334 2.681 . 0 0 "[ . 1 . 2 . ]" 1
284 1 17 GLU H 1 17 GLU HG3 3.810 . 4.310 2.674 2.394 3.512 . 0 0 "[ . 1 . 2 . ]" 1
285 1 17 GLU H 1 18 ASN H 3.150 . 3.650 2.847 2.697 2.997 . 0 0 "[ . 1 . 2 . ]" 1
286 1 17 GLU H 1 19 TYR H 4.990 . 5.490 4.371 4.168 4.619 . 0 0 "[ . 1 . 2 . ]" 1
287 1 17 GLU H 1 19 TYR QD 5.890 . 6.390 4.975 4.539 5.309 . 0 0 "[ . 1 . 2 . ]" 1
288 1 17 GLU H 2 18 VAL MG1 5.690 . 6.190 3.381 2.882 3.876 . 0 0 "[ . 1 . 2 . ]" 1
289 1 17 GLU HA 1 17 GLU HG2 4.110 . 4.610 2.482 2.240 4.155 . 0 0 "[ . 1 . 2 . ]" 1
290 1 17 GLU HA 1 17 GLU HG3 4.110 . 4.610 3.071 2.691 3.723 . 0 0 "[ . 1 . 2 . ]" 1
291 1 17 GLU HA 2 18 VAL MG1 5.130 . 5.630 3.182 2.360 3.970 . 0 0 "[ . 1 . 2 . ]" 1
292 1 17 GLU HA 2 18 VAL MG2 5.580 . 6.080 4.345 3.546 4.744 . 0 0 "[ . 1 . 2 . ]" 1
293 1 17 GLU HA 2 19 CYS HA 5.500 . 6.000 4.509 3.498 5.308 . 0 0 "[ . 1 . 2 . ]" 1
294 1 17 GLU QB 1 19 TYR H 5.920 . 6.420 4.823 4.664 5.141 . 0 0 "[ . 1 . 2 . ]" 1
295 1 17 GLU HB2 1 18 ASN H 3.880 . 4.380 3.091 2.746 3.920 . 0 0 "[ . 1 . 2 . ]" 1
296 1 17 GLU HB3 1 18 ASN H 3.880 . 4.380 3.756 3.507 4.007 . 0 0 "[ . 1 . 2 . ]" 1
297 1 17 GLU HG2 2 18 VAL MG1 5.860 . 6.360 2.917 2.330 4.308 . 0 0 "[ . 1 . 2 . ]" 1
298 1 17 GLU HG2 2 18 VAL MG2 5.040 . 5.540 2.968 2.220 3.687 . 0 0 "[ . 1 . 2 . ]" 1
299 1 17 GLU HG3 2 18 VAL MG1 5.860 . 6.360 2.952 2.324 4.888 . 0 0 "[ . 1 . 2 . ]" 1
300 1 17 GLU HG3 2 18 VAL MG2 5.040 . 5.540 2.661 2.166 4.234 . 0 0 "[ . 1 . 2 . ]" 1
301 1 18 ASN H 1 18 ASN HB2 3.700 . 4.200 2.453 2.298 2.643 . 0 0 "[ . 1 . 2 . ]" 1
302 1 18 ASN H 1 18 ASN QB 3.430 . 3.930 2.414 2.271 2.585 . 0 0 "[ . 1 . 2 . ]" 1
303 1 18 ASN H 1 18 ASN HB3 3.700 . 4.200 3.613 3.559 3.684 . 0 0 "[ . 1 . 2 . ]" 1
304 1 18 ASN H 1 18 ASN HD21 4.700 . 5.200 3.468 2.217 4.345 . 0 0 "[ . 1 . 2 . ]" 1
305 1 18 ASN H 1 18 ASN HD22 4.700 . 5.200 4.185 3.207 4.716 . 0 0 "[ . 1 . 2 . ]" 1
306 1 18 ASN H 1 19 TYR H 3.090 . 3.590 2.604 2.319 2.791 . 0 0 "[ . 1 . 2 . ]" 1
307 1 18 ASN H 1 19 TYR HB2 5.080 . 5.580 4.866 4.608 5.088 . 0 0 "[ . 1 . 2 . ]" 1
308 1 18 ASN QB 1 19 TYR H 3.910 . 4.410 2.854 2.635 3.138 . 0 0 "[ . 1 . 2 . ]" 1
309 1 18 ASN QB 1 19 TYR QD 5.300 . 5.800 3.878 3.404 4.217 . 0 0 "[ . 1 . 2 . ]" 1
310 1 18 ASN QB 1 19 TYR QE 5.830 . 6.330 4.236 3.652 4.681 . 0 0 "[ . 1 . 2 . ]" 1
311 1 18 ASN HB2 1 19 TYR H 4.000 . 4.500 2.952 2.691 3.330 . 0 0 "[ . 1 . 2 . ]" 1
312 1 18 ASN HB2 1 19 TYR QE 6.170 . 6.670 4.475 3.809 5.089 . 0 0 "[ . 1 . 2 . ]" 1
313 1 18 ASN HB3 1 19 TYR H 4.000 . 4.500 3.817 3.548 4.030 . 0 0 "[ . 1 . 2 . ]" 1
314 1 18 ASN HB3 1 19 TYR QE 6.170 . 6.670 5.331 4.609 5.562 . 0 0 "[ . 1 . 2 . ]" 1
315 1 19 TYR H 1 19 TYR HB2 3.090 . 3.590 2.515 2.373 2.625 . 0 0 "[ . 1 . 2 . ]" 1
316 1 19 TYR H 1 19 TYR HB3 3.670 . 4.170 3.615 3.531 3.663 . 0 0 "[ . 1 . 2 . ]" 1
317 1 19 TYR H 1 19 TYR QD 3.810 . 4.310 2.820 2.176 3.273 . 0 0 "[ . 1 . 2 . ]" 1
318 1 19 TYR H 1 19 TYR QE 5.260 . 5.760 4.464 4.136 4.669 . 0 0 "[ . 1 . 2 . ]" 1
319 1 19 TYR H 1 20 CYS H 2.920 . 3.420 2.599 2.355 2.799 . 0 0 "[ . 1 . 2 . ]" 1
320 1 19 TYR H 1 20 CYS HA 5.490 . 5.990 5.267 5.016 5.421 . 0 0 "[ . 1 . 2 . ]" 1
321 1 19 TYR H 1 20 CYS QB 5.310 . 5.810 4.417 4.075 4.776 . 0 0 "[ . 1 . 2 . ]" 1
322 1 19 TYR HA 1 19 TYR QD 3.220 . 3.720 2.548 2.256 2.909 . 0 0 "[ . 1 . 2 . ]" 1
323 1 19 TYR HA 1 19 TYR QE 5.290 . 5.790 4.622 4.458 4.751 . 0 0 "[ . 1 . 2 . ]" 1
324 1 19 TYR HB2 2 15 LEU MD1 6.610 . 7.110 3.944 2.659 4.622 . 0 0 "[ . 1 . 2 . ]" 1
325 1 19 TYR HB2 2 15 LEU MD2 5.320 . 5.820 2.954 2.378 3.850 . 0 0 "[ . 1 . 2 . ]" 1
326 1 19 TYR QD 2 15 LEU HB3 6.170 . 6.670 4.552 3.304 5.428 . 0 0 "[ . 1 . 2 . ]" 1
327 1 19 TYR QD 2 15 LEU MD2 6.120 . 6.620 3.878 3.031 4.432 . 0 0 "[ . 1 . 2 . ]" 1
328 1 19 TYR QE 2 11 LEU CG 8.310 . 8.810 6.884 4.874 7.484 . 0 0 "[ . 1 . 2 . ]" 1
329 1 19 TYR QE 2 15 LEU MD2 7.410 . 7.910 5.329 4.685 5.548 . 0 0 "[ . 1 . 2 . ]" 1
330 1 20 CYS H 1 20 CYS QB 3.550 . 4.050 2.285 2.151 2.652 . 0 0 "[ . 1 . 2 . ]" 1
331 1 20 CYS H 1 21 ASN H 3.280 . 3.780 2.601 2.229 2.766 . 0 0 "[ . 1 . 2 . ]" 1
332 1 20 CYS H 2 15 LEU MD1 6.610 . 7.110 4.219 3.217 5.520 . 0 0 "[ . 1 . 2 . ]" 1
333 1 20 CYS HA 2 15 LEU MD1 5.740 . 6.240 3.272 2.145 4.584 . 0 0 "[ . 1 . 2 . ]" 1
334 1 20 CYS HA 2 15 LEU MD2 6.610 . 7.110 4.694 3.758 5.520 . 0 0 "[ . 1 . 2 . ]" 1
335 1 20 CYS QB 1 21 ASN H 3.860 . 4.360 2.919 2.402 3.548 . 0 0 "[ . 1 . 2 . ]" 1
336 1 20 CYS HB2 1 21 ASN H 4.010 . 4.510 3.822 2.664 4.056 . 0 0 "[ . 1 . 2 . ]" 1
337 1 20 CYS HB3 1 21 ASN H 4.010 . 4.510 3.188 2.429 4.176 . 0 0 "[ . 1 . 2 . ]" 1
338 2 1 PHE HA 2 1 PHE QD 3.770 . 4.270 2.864 2.329 3.106 . 0 0 "[ . 1 . 2 . ]" 1
339 2 1 PHE HA 2 1 PHE QE 5.260 . 5.760 4.672 4.604 4.727 . 0 0 "[ . 1 . 2 . ]" 1
340 2 1 PHE HA 2 2 VAL CB 6.690 . 7.190 4.796 4.690 4.872 . 0 0 "[ . 1 . 2 . ]" 1
341 2 1 PHE HA 2 2 VAL H 2.720 . 3.220 2.241 2.124 2.357 . 0 0 "[ . 1 . 2 . ]" 1
342 2 1 PHE QB 2 2 VAL H 4.610 . 5.110 3.547 3.298 3.783 . 0 0 "[ . 1 . 2 . ]" 1
343 2 1 PHE QB 2 3 ASN H 6.170 . 6.670 5.498 4.629 5.567 . 0 0 "[ . 1 . 2 . ]" 1
344 2 1 PHE QD 2 2 VAL H 4.470 . 4.970 3.074 2.246 3.311 . 0 0 "[ . 1 . 2 . ]" 1
345 2 1 PHE QD 2 2 VAL HA 4.880 . 5.380 3.523 3.049 4.301 . 0 0 "[ . 1 . 2 . ]" 1
346 2 1 PHE QD 2 3 ASN H 5.230 . 5.730 3.881 2.506 4.691 . 0 0 "[ . 1 . 2 . ]" 1
347 2 1 PHE QD 2 3 ASN HA 4.570 . 5.070 4.010 3.539 4.162 . 0 0 "[ . 1 . 2 . ]" 1
348 2 1 PHE QD 2 6 LEU CG 8.120 . 8.620 6.813 5.374 7.261 . 0 0 "[ . 1 . 2 . ]" 1
349 2 1 PHE QD 2 18 VAL MG1 7.410 . 7.910 4.938 3.903 5.506 . 0 0 "[ . 1 . 2 . ]" 1
350 2 1 PHE QE 2 2 VAL H 6.170 . 6.670 4.092 3.847 4.274 . 0 0 "[ . 1 . 2 . ]" 1
351 2 1 PHE QE 2 2 VAL HA 6.170 . 6.670 4.686 4.382 5.167 . 0 0 "[ . 1 . 2 . ]" 1
352 2 1 PHE QE 2 3 ASN H 6.170 . 6.670 3.991 2.731 4.974 . 0 0 "[ . 1 . 2 . ]" 1
353 2 1 PHE QE 2 3 ASN HA 4.400 . 4.900 2.493 2.179 2.991 . 0 0 "[ . 1 . 2 . ]" 1
354 2 1 PHE QE 2 3 ASN QB 6.930 . 7.430 3.875 2.771 4.555 . 0 0 "[ . 1 . 2 . ]" 1
355 2 1 PHE QE 2 4 GLN H 5.380 . 5.880 3.942 3.392 4.862 . 0 0 "[ . 1 . 2 . ]" 1
356 2 1 PHE QE 2 4 GLN QG 5.610 . 6.110 3.967 2.412 4.498 . 0 0 "[ . 1 . 2 . ]" 1
357 2 1 PHE QE 2 6 LEU CG 6.870 . 7.370 4.817 3.241 5.325 . 0 0 "[ . 1 . 2 . ]" 1
358 2 1 PHE QE 2 14 ALA HA 6.170 . 6.670 4.463 2.567 5.506 . 0 0 "[ . 1 . 2 . ]" 1
359 2 1 PHE QE 2 14 ALA MB 6.630 . 7.130 2.784 2.237 3.824 . 0 0 "[ . 1 . 2 . ]" 1
360 2 1 PHE QE 2 18 VAL MG1 6.480 . 6.980 4.654 3.843 4.858 . 0 0 "[ . 1 . 2 . ]" 1
361 2 1 PHE HZ 2 6 LEU CG 6.470 . 6.970 4.681 3.911 5.451 . 0 0 "[ . 1 . 2 . ]" 1
362 2 2 VAL CB 2 3 ASN H 5.760 . 6.260 3.456 3.227 3.890 . 0 0 "[ . 1 . 2 . ]" 1
363 2 2 VAL CB 2 3 ASN QB 7.830 . 8.330 5.380 4.359 5.774 . 0 0 "[ . 1 . 2 . ]" 1
364 2 2 VAL CB 2 4 GLN H 6.990 . 7.490 6.482 6.147 6.856 . 0 0 "[ . 1 . 2 . ]" 1
365 2 2 VAL CB 2 4 GLN HB3 7.000 . 7.500 5.625 5.198 6.471 . 0 0 "[ . 1 . 2 . ]" 1
366 2 2 VAL CB 2 4 GLN QE 7.300 . 7.800 4.074 3.348 5.822 . 0 0 "[ . 1 . 2 . ]" 1
367 2 2 VAL CB 2 4 GLN QG 7.850 . 8.350 5.749 5.050 6.520 . 0 0 "[ . 1 . 2 . ]" 1
368 2 2 VAL H 2 3 ASN H 4.540 . 5.040 4.242 3.601 4.357 . 0 0 "[ . 1 . 2 . ]" 1
369 2 2 VAL H 2 4 GLN QE 5.990 . 6.490 3.450 2.718 5.340 . 0 0 "[ . 1 . 2 . ]" 1
370 2 2 VAL HA 2 3 ASN H 2.490 . 2.990 2.177 2.136 2.232 . 0 0 "[ . 1 . 2 . ]" 1
371 2 2 VAL HA 2 3 ASN HA 5.280 . 5.780 4.333 4.086 4.424 . 0 0 "[ . 1 . 2 . ]" 1
372 2 2 VAL HA 2 3 ASN QB 5.310 . 5.810 4.474 3.817 4.685 . 0 0 "[ . 1 . 2 . ]" 1
373 2 2 VAL HB 2 3 ASN H 4.530 . 5.030 3.610 2.888 4.284 . 0 0 "[ . 1 . 2 . ]" 1
374 2 2 VAL HB 2 3 ASN HA 5.500 . 6.000 5.233 4.898 5.861 . 0 0 "[ . 1 . 2 . ]" 1
375 2 2 VAL HB 2 4 GLN QE 5.950 . 6.450 3.945 2.555 5.313 . 0 0 "[ . 1 . 2 . ]" 1
376 2 3 ASN H 2 3 ASN QB 3.220 . 3.720 2.580 2.357 3.009 . 0 0 "[ . 1 . 2 . ]" 1
377 2 3 ASN H 2 3 ASN HD21 4.950 . 5.450 4.180 3.185 4.733 . 0 0 "[ . 1 . 2 . ]" 1
378 2 3 ASN H 2 3 ASN QD 4.790 . 5.290 3.795 2.988 4.291 . 0 0 "[ . 1 . 2 . ]" 1
379 2 3 ASN H 2 3 ASN HD22 4.950 . 5.450 4.365 3.616 4.933 . 0 0 "[ . 1 . 2 . ]" 1
380 2 3 ASN HA 2 4 GLN H 2.630 . 3.130 2.186 2.103 2.913 . 0 0 "[ . 1 . 2 . ]" 1
381 2 3 ASN HA 2 4 GLN QG 5.990 . 6.490 3.594 3.120 4.392 . 0 0 "[ . 1 . 2 . ]" 1
382 2 3 ASN QB 2 4 GLN H 4.040 . 4.540 2.758 1.712 3.305 0.088 23 0 "[ . 1 . 2 . ]" 1
383 2 3 ASN QB 2 5 HIS H 6.170 . 6.670 5.672 5.503 5.743 . 0 0 "[ . 1 . 2 . ]" 1
384 2 4 GLN H 2 4 GLN HB2 4.170 . 4.670 4.020 3.962 4.055 . 0 0 "[ . 1 . 2 . ]" 1
385 2 4 GLN H 2 4 GLN HB3 3.810 . 4.310 3.514 3.012 3.618 . 0 0 "[ . 1 . 2 . ]" 1
386 2 4 GLN H 2 4 GLN HG2 3.900 . 4.400 2.713 2.588 3.649 . 0 0 "[ . 1 . 2 . ]" 1
387 2 4 GLN H 2 4 GLN QG 3.770 . 4.270 2.646 2.527 3.402 . 0 0 "[ . 1 . 2 . ]" 1
388 2 4 GLN H 2 4 GLN HG3 3.900 . 4.400 3.736 3.426 4.067 . 0 0 "[ . 1 . 2 . ]" 1
389 2 4 GLN H 2 5 HIS H 4.280 . 4.780 4.206 4.061 4.337 . 0 0 "[ . 1 . 2 . ]" 1
390 2 4 GLN H 2 5 HIS HD2 5.500 . 6.000 5.609 5.516 5.692 . 0 0 "[ . 1 . 2 . ]" 1
391 2 4 GLN H 2 6 LEU CG 7.640 . 8.140 5.253 3.483 6.710 . 0 0 "[ . 1 . 2 . ]" 1
392 2 4 GLN HA 2 5 HIS H 2.730 . 3.230 2.308 2.180 2.811 . 0 0 "[ . 1 . 2 . ]" 1
393 2 4 GLN HA 2 5 HIS HD2 3.940 . 4.440 3.299 3.163 3.456 . 0 0 "[ . 1 . 2 . ]" 1
394 2 4 GLN HB2 2 5 HIS H 3.440 . 3.940 2.550 1.972 2.955 . 0 0 "[ . 1 . 2 . ]" 1
395 2 4 GLN HB2 2 5 HIS HD2 5.280 . 5.780 4.137 2.889 4.680 . 0 0 "[ . 1 . 2 . ]" 1
396 2 4 GLN HB2 2 6 LEU CG 6.790 . 7.290 5.328 4.630 6.434 . 0 0 "[ . 1 . 2 . ]" 1
397 2 4 GLN HB3 2 5 HIS H 4.330 . 4.830 3.795 3.487 4.053 . 0 0 "[ . 1 . 2 . ]" 1
398 2 4 GLN HB3 2 5 HIS HD2 5.500 . 6.000 5.153 4.397 5.522 . 0 0 "[ . 1 . 2 . ]" 1
399 2 4 GLN QE 2 6 LEU CG 7.520 . 8.020 5.275 4.214 6.183 . 0 0 "[ . 1 . 2 . ]" 1
400 2 4 GLN QG 2 5 HIS H 4.920 . 5.420 3.632 2.650 3.937 . 0 0 "[ . 1 . 2 . ]" 1
401 2 4 GLN QG 2 6 LEU CG 6.750 . 7.250 3.036 2.808 3.930 . 0 0 "[ . 1 . 2 . ]" 1
402 2 4 GLN HG2 2 5 HIS H 5.030 . 5.530 4.577 3.927 4.860 . 0 0 "[ . 1 . 2 . ]" 1
403 2 4 GLN HG3 2 5 HIS H 5.030 . 5.530 3.817 2.694 4.184 . 0 0 "[ . 1 . 2 . ]" 1
404 2 5 HIS H 2 5 HIS HB2 3.120 . 3.620 2.549 2.422 2.786 . 0 0 "[ . 1 . 2 . ]" 1
405 2 5 HIS H 2 5 HIS HB3 3.610 . 4.110 3.633 3.604 3.662 . 0 0 "[ . 1 . 2 . ]" 1
406 2 5 HIS H 2 5 HIS HD2 3.180 . 3.680 2.040 1.769 2.347 0.031 2 0 "[ . 1 . 2 . ]" 1
407 2 5 HIS H 2 6 LEU H 4.780 . 5.280 4.354 2.797 4.678 . 0 0 "[ . 1 . 2 . ]" 1
408 2 5 HIS HA 2 5 HIS HD2 4.540 . 5.040 3.970 3.764 4.214 . 0 0 "[ . 1 . 2 . ]" 1
409 2 5 HIS HA 2 6 LEU H 3.300 . 3.800 2.325 2.187 3.458 . 0 0 "[ . 1 . 2 . ]" 1
410 2 5 HIS HB2 2 5 HIS HD2 3.400 . 3.900 2.875 2.741 2.941 . 0 0 "[ . 1 . 2 . ]" 1
411 2 5 HIS HB2 2 6 LEU H 4.580 . 5.080 4.120 2.812 4.547 . 0 0 "[ . 1 . 2 . ]" 1
412 2 5 HIS HB3 2 6 LEU H 4.160 . 4.660 3.438 2.904 4.236 . 0 0 "[ . 1 . 2 . ]" 1
413 2 6 LEU CG 2 7 CYS H 5.770 . 6.270 4.440 4.074 4.539 . 0 0 "[ . 1 . 2 . ]" 1
414 2 6 LEU CG 2 10 HIS H 7.640 . 8.140 7.299 6.857 7.563 . 0 0 "[ . 1 . 2 . ]" 1
415 2 6 LEU CG 2 10 HIS QB 6.250 . 6.750 4.383 3.965 4.748 . 0 0 "[ . 1 . 2 . ]" 1
416 2 6 LEU CG 2 11 LEU H 6.810 . 7.310 5.564 5.240 5.842 . 0 0 "[ . 1 . 2 . ]" 1
417 2 6 LEU CG 2 11 LEU HA 6.470 . 6.970 3.842 3.334 4.051 . 0 0 "[ . 1 . 2 . ]" 1
418 2 6 LEU CG 2 14 ALA H 7.070 . 7.570 5.816 5.292 6.137 . 0 0 "[ . 1 . 2 . ]" 1
419 2 6 LEU CG 2 14 ALA MB 5.790 . 6.290 3.465 3.045 3.789 . 0 0 "[ . 1 . 2 . ]" 1
420 2 6 LEU H 2 6 LEU MD1 5.600 . 6.100 3.865 2.554 4.409 . 0 0 "[ . 1 . 2 . ]" 1
421 2 6 LEU H 2 6 LEU HG 4.360 . 4.860 3.339 2.358 4.501 . 0 0 "[ . 1 . 2 . ]" 1
422 2 6 LEU H 2 7 CYS H 4.780 . 5.280 4.452 4.273 4.679 . 0 0 "[ . 1 . 2 . ]" 1
423 2 6 LEU HA 2 7 CYS H 2.710 . 3.210 2.189 2.104 2.567 . 0 0 "[ . 1 . 2 . ]" 1
424 2 6 LEU HA 2 10 HIS QB 4.920 . 5.420 3.489 3.085 3.878 . 0 0 "[ . 1 . 2 . ]" 1
425 2 6 LEU HA 2 14 ALA MB 6.610 . 7.110 5.143 4.835 5.524 . 0 0 "[ . 1 . 2 . ]" 1
426 2 6 LEU QB 2 7 CYS H 4.250 . 4.750 3.070 2.117 3.344 . 0 0 "[ . 1 . 2 . ]" 1
427 2 6 LEU QB 2 10 HIS QB 5.660 . 6.160 3.717 2.996 4.106 . 0 0 "[ . 1 . 2 . ]" 1
428 2 6 LEU QB 2 11 LEU CG 6.060 . 6.560 3.484 3.030 3.785 . 0 0 "[ . 1 . 2 . ]" 1
429 2 6 LEU QB 2 11 LEU H 4.780 . 5.280 3.707 3.297 3.944 . 0 0 "[ . 1 . 2 . ]" 1
430 2 6 LEU QB 2 11 LEU HA 4.330 . 4.830 2.250 2.092 2.801 . 0 0 "[ . 1 . 2 . ]" 1
431 2 6 LEU QB 2 11 LEU QB 5.410 . 5.910 2.621 2.351 3.142 . 0 0 "[ . 1 . 2 . ]" 1
432 2 6 LEU QB 2 11 LEU HG 5.990 . 6.490 4.068 2.213 4.667 . 0 0 "[ . 1 . 2 . ]" 1
433 2 6 LEU QB 2 14 ALA H 5.990 . 6.490 5.043 4.680 5.357 . 0 0 "[ . 1 . 2 . ]" 1
434 2 6 LEU HB2 2 7 CYS H 4.390 . 4.890 4.205 3.249 4.402 . 0 0 "[ . 1 . 2 . ]" 1
435 2 6 LEU HB2 2 11 LEU HA 4.440 . 4.940 3.590 2.746 3.922 . 0 0 "[ . 1 . 2 . ]" 1
436 2 6 LEU HB3 2 7 CYS H 4.390 . 4.890 3.157 2.146 3.465 . 0 0 "[ . 1 . 2 . ]" 1
437 2 6 LEU HB3 2 11 LEU HA 4.440 . 4.940 2.277 2.105 2.868 . 0 0 "[ . 1 . 2 . ]" 1
438 2 6 LEU MD1 2 7 CYS H 6.120 . 6.620 4.746 3.173 5.127 . 0 0 "[ . 1 . 2 . ]" 1
439 2 6 LEU MD1 2 14 ALA MB 4.920 . 5.420 2.210 1.924 3.412 . 0 0 "[ . 1 . 2 . ]" 1
440 2 6 LEU MD2 2 7 CYS H 6.120 . 6.620 3.683 3.294 5.081 . 0 0 "[ . 1 . 2 . ]" 1
441 2 6 LEU MD2 2 14 ALA MB 4.920 . 5.420 2.535 2.056 3.287 . 0 0 "[ . 1 . 2 . ]" 1
442 2 6 LEU HG 2 7 CYS H 4.840 . 5.340 4.892 4.789 4.947 . 0 0 "[ . 1 . 2 . ]" 1
443 2 7 CYS H 2 7 CYS HB2 3.660 . 4.160 2.974 2.557 3.508 . 0 0 "[ . 1 . 2 . ]" 1
444 2 7 CYS H 2 7 CYS QB 3.560 . 4.060 2.715 2.515 3.022 . 0 0 "[ . 1 . 2 . ]" 1
445 2 7 CYS H 2 7 CYS HB3 3.660 . 4.160 3.288 2.874 3.764 . 0 0 "[ . 1 . 2 . ]" 1
446 2 7 CYS H 2 8 GLY H 4.620 . 5.120 4.413 3.110 4.499 . 0 0 "[ . 1 . 2 . ]" 1
447 2 7 CYS H 2 10 HIS H 4.410 . 4.910 4.369 3.963 4.452 . 0 0 "[ . 1 . 2 . ]" 1
448 2 7 CYS H 2 10 HIS HB2 3.760 . 4.260 2.656 2.332 2.944 . 0 0 "[ . 1 . 2 . ]" 1
449 2 7 CYS H 2 10 HIS QB 3.650 . 4.150 2.603 2.310 2.846 . 0 0 "[ . 1 . 2 . ]" 1
450 2 7 CYS H 2 10 HIS HB3 3.760 . 4.260 3.797 3.643 3.846 . 0 0 "[ . 1 . 2 . ]" 1
451 2 7 CYS H 2 11 LEU H 5.040 . 5.540 3.394 3.088 3.687 . 0 0 "[ . 1 . 2 . ]" 1
452 2 7 CYS H 2 11 LEU HA 4.830 . 5.330 4.397 4.136 4.768 . 0 0 "[ . 1 . 2 . ]" 1
453 2 7 CYS H 2 11 LEU QB 5.260 . 5.760 3.122 2.886 3.472 . 0 0 "[ . 1 . 2 . ]" 1
454 2 7 CYS HA 2 11 LEU CG 7.190 . 7.690 4.093 3.471 5.147 . 0 0 "[ . 1 . 2 . ]" 1
455 2 7 CYS QB 2 8 GLY H 4.030 . 4.530 3.125 2.017 3.440 . 0 0 "[ . 1 . 2 . ]" 1
456 2 7 CYS QB 2 8 GLY HA3 5.790 . 6.290 4.072 3.599 4.615 . 0 0 "[ . 1 . 2 . ]" 1
457 2 7 CYS QB 2 11 LEU H 5.520 . 6.020 4.876 4.646 4.951 . 0 0 "[ . 1 . 2 . ]" 1
458 2 7 CYS HB2 2 8 GLY H 4.250 . 4.750 3.992 2.111 4.261 . 0 0 "[ . 1 . 2 . ]" 1
459 2 7 CYS HB3 2 8 GLY H 4.250 . 4.750 3.291 2.561 3.710 . 0 0 "[ . 1 . 2 . ]" 1
460 2 8 GLY H 2 9 SER H 4.630 . 5.130 4.566 2.772 4.661 . 0 0 "[ . 1 . 2 . ]" 1
461 2 8 GLY H 2 11 LEU CG 6.930 . 7.430 5.142 4.631 6.676 . 0 0 "[ . 1 . 2 . ]" 1
462 2 8 GLY H 2 11 LEU HB2 5.110 . 5.610 3.898 3.137 4.861 . 0 0 "[ . 1 . 2 . ]" 1
463 2 8 GLY H 2 11 LEU QB 4.960 . 5.460 3.401 3.005 4.415 . 0 0 "[ . 1 . 2 . ]" 1
464 2 8 GLY H 2 11 LEU HB3 5.110 . 5.610 3.793 3.322 5.184 . 0 0 "[ . 1 . 2 . ]" 1
465 2 8 GLY HA2 2 9 SER H 3.350 . 3.850 3.037 2.083 3.232 . 0 0 "[ . 1 . 2 . ]" 1
466 2 8 GLY HA3 2 9 SER H 3.070 . 3.570 2.287 2.146 3.374 . 0 0 "[ . 1 . 2 . ]" 1
467 2 8 GLY HA3 2 10 HIS H 4.030 . 4.530 3.781 3.603 4.246 . 0 0 "[ . 1 . 2 . ]" 1
468 2 9 SER H 2 9 SER QB 3.600 . 4.100 2.587 2.216 3.308 . 0 0 "[ . 1 . 2 . ]" 1
469 2 9 SER H 2 10 HIS H 3.400 . 3.900 2.895 2.724 3.461 . 0 0 "[ . 1 . 2 . ]" 1
470 2 9 SER H 2 12 VAL CB 7.030 . 7.530 6.066 4.370 6.314 . 0 0 "[ . 1 . 2 . ]" 1
471 2 9 SER H 2 12 VAL HB 5.500 . 6.000 5.327 4.045 5.548 . 0 0 "[ . 1 . 2 . ]" 1
472 2 9 SER HA 2 12 VAL CB 5.720 . 6.220 3.660 3.306 3.900 . 0 0 "[ . 1 . 2 . ]" 1
473 2 9 SER HA 2 12 VAL H 3.920 . 4.420 3.360 2.730 3.476 . 0 0 "[ . 1 . 2 . ]" 1
474 2 9 SER HA 2 12 VAL HA 5.500 . 6.000 5.414 5.067 5.526 . 0 0 "[ . 1 . 2 . ]" 1
475 2 9 SER HA 2 12 VAL HB 4.100 . 4.600 2.796 2.520 3.720 . 0 0 "[ . 1 . 2 . ]" 1
476 2 10 HIS H 2 10 HIS HB2 3.770 . 4.270 2.474 2.336 2.581 . 0 0 "[ . 1 . 2 . ]" 1
477 2 10 HIS H 2 10 HIS QB 3.380 . 3.880 2.432 2.307 2.528 . 0 0 "[ . 1 . 2 . ]" 1
478 2 10 HIS H 2 10 HIS HB3 3.770 . 4.270 3.602 3.577 3.646 . 0 0 "[ . 1 . 2 . ]" 1
479 2 10 HIS H 2 10 HIS HD2 3.790 . 4.290 3.233 2.268 3.809 . 0 0 "[ . 1 . 2 . ]" 1
480 2 10 HIS H 2 11 LEU H 3.470 . 3.970 2.668 2.436 2.790 . 0 0 "[ . 1 . 2 . ]" 1
481 2 10 HIS H 2 11 LEU QB 5.990 . 6.490 4.318 3.864 4.436 . 0 0 "[ . 1 . 2 . ]" 1
482 2 10 HIS H 2 12 VAL CB 7.290 . 7.790 6.139 5.789 6.406 . 0 0 "[ . 1 . 2 . ]" 1
483 2 10 HIS HA 2 10 HIS HD2 3.550 . 4.050 2.868 2.351 3.590 . 0 0 "[ . 1 . 2 . ]" 1
484 2 10 HIS HA 2 13 GLU H 4.120 . 4.620 3.520 3.318 4.021 . 0 0 "[ . 1 . 2 . ]" 1
485 2 10 HIS HA 2 13 GLU QB 4.430 . 4.930 2.622 2.398 3.166 . 0 0 "[ . 1 . 2 . ]" 1
486 2 10 HIS HA 2 13 GLU QG 5.480 . 5.980 3.948 3.427 4.532 . 0 0 "[ . 1 . 2 . ]" 1
487 2 10 HIS HA 2 14 ALA H 4.370 . 4.870 3.874 3.722 4.165 . 0 0 "[ . 1 . 2 . ]" 1
488 2 10 HIS HA 2 14 ALA MB 6.610 . 7.110 4.412 4.230 4.745 . 0 0 "[ . 1 . 2 . ]" 1
489 2 10 HIS QB 2 11 LEU H 4.300 . 4.800 2.746 2.467 2.912 . 0 0 "[ . 1 . 2 . ]" 1
490 2 10 HIS HB2 2 11 LEU H 4.360 . 4.860 2.827 2.515 3.034 . 0 0 "[ . 1 . 2 . ]" 1
491 2 10 HIS HB3 2 11 LEU H 4.360 . 4.860 3.746 3.531 3.976 . 0 0 "[ . 1 . 2 . ]" 1
492 2 11 LEU CG 2 12 VAL HA 7.220 . 7.720 4.899 4.520 5.478 . 0 0 "[ . 1 . 2 . ]" 1
493 2 11 LEU CG 2 14 ALA H 6.800 . 7.300 5.975 5.656 6.130 . 0 0 "[ . 1 . 2 . ]" 1
494 2 11 LEU CG 2 14 ALA MB 6.790 . 7.290 4.807 4.262 4.994 . 0 0 "[ . 1 . 2 . ]" 1
495 2 11 LEU CG 2 15 LEU H 6.400 . 6.900 5.631 5.321 5.986 . 0 0 "[ . 1 . 2 . ]" 1
496 2 11 LEU CG 2 15 LEU HB3 6.150 . 6.650 5.363 4.705 5.908 . 0 0 "[ . 1 . 2 . ]" 1
497 2 11 LEU H 2 11 LEU HB2 3.750 . 4.250 2.445 2.129 2.571 . 0 0 "[ . 1 . 2 . ]" 1
498 2 11 LEU H 2 11 LEU QB 3.680 . 4.180 2.159 2.052 2.224 . 0 0 "[ . 1 . 2 . ]" 1
499 2 11 LEU H 2 11 LEU HB3 3.750 . 4.250 2.441 2.264 2.932 . 0 0 "[ . 1 . 2 . ]" 1
500 2 11 LEU H 2 11 LEU MD1 5.310 . 5.810 4.149 4.034 4.248 . 0 0 "[ . 1 . 2 . ]" 1
501 2 11 LEU H 2 11 LEU MD2 5.310 . 5.810 4.148 3.963 4.300 . 0 0 "[ . 1 . 2 . ]" 1
502 2 11 LEU H 2 11 LEU HG 4.610 . 5.110 4.423 4.043 4.503 . 0 0 "[ . 1 . 2 . ]" 1
503 2 11 LEU H 2 12 VAL CB 7.080 . 7.580 5.176 5.018 5.381 . 0 0 "[ . 1 . 2 . ]" 1
504 2 11 LEU HA 2 14 ALA MB 4.580 . 5.080 2.662 2.320 2.924 . 0 0 "[ . 1 . 2 . ]" 1
505 2 11 LEU QB 2 12 VAL H 3.840 . 4.340 2.551 2.368 2.705 . 0 0 "[ . 1 . 2 . ]" 1
506 2 11 LEU QB 2 14 ALA H 5.700 . 6.200 5.066 4.865 5.131 . 0 0 "[ . 1 . 2 . ]" 1
507 2 11 LEU HB2 2 12 VAL H 4.040 . 4.540 3.844 3.355 3.990 . 0 0 "[ . 1 . 2 . ]" 1
508 2 11 LEU HB3 2 12 VAL H 4.040 . 4.540 2.590 2.421 2.751 . 0 0 "[ . 1 . 2 . ]" 1
509 2 11 LEU MD1 2 12 VAL H 5.610 . 6.110 4.451 3.215 4.653 . 0 0 "[ . 1 . 2 . ]" 1
510 2 11 LEU MD2 2 12 VAL H 5.610 . 6.110 4.299 3.729 4.523 . 0 0 "[ . 1 . 2 . ]" 1
511 2 11 LEU HG 2 12 VAL H 4.940 . 5.440 3.978 3.636 5.007 . 0 0 "[ . 1 . 2 . ]" 1
512 2 12 VAL CB 2 13 GLU H 5.640 . 6.140 3.135 3.079 3.278 . 0 0 "[ . 1 . 2 . ]" 1
513 2 12 VAL CB 2 14 ALA H 7.640 . 8.140 5.327 5.267 5.379 . 0 0 "[ . 1 . 2 . ]" 1
514 2 12 VAL CB 2 16 TYR QB 7.330 . 7.830 5.047 4.776 5.293 . 0 0 "[ . 1 . 2 . ]" 1
515 2 12 VAL H 2 12 VAL HB 3.200 . 3.700 2.506 2.345 2.573 . 0 0 "[ . 1 . 2 . ]" 1
516 2 12 VAL H 2 13 GLU H 3.400 . 3.900 2.741 2.497 2.876 . 0 0 "[ . 1 . 2 . ]" 1
517 2 12 VAL H 2 14 ALA H 4.610 . 5.110 4.211 3.986 4.301 . 0 0 "[ . 1 . 2 . ]" 1
518 2 12 VAL H 2 15 LEU H 5.500 . 6.000 4.972 4.845 5.062 . 0 0 "[ . 1 . 2 . ]" 1
519 2 12 VAL H 2 15 LEU MD2 5.730 . 6.230 4.475 4.238 4.766 . 0 0 "[ . 1 . 2 . ]" 1
520 2 12 VAL HA 2 14 ALA H 4.710 . 5.210 4.609 4.484 4.728 . 0 0 "[ . 1 . 2 . ]" 1
521 2 12 VAL HA 2 15 LEU H 4.020 . 4.520 3.710 3.555 3.852 . 0 0 "[ . 1 . 2 . ]" 1
522 2 12 VAL HA 2 15 LEU HB2 5.500 . 6.000 5.339 5.160 5.475 . 0 0 "[ . 1 . 2 . ]" 1
523 2 12 VAL HA 2 15 LEU HB3 4.670 . 5.170 4.577 4.261 4.691 . 0 0 "[ . 1 . 2 . ]" 1
524 2 12 VAL HA 2 15 LEU MD1 6.470 . 6.970 3.396 2.993 3.783 . 0 0 "[ . 1 . 2 . ]" 1
525 2 12 VAL HA 2 15 LEU MD2 4.820 . 5.320 2.651 2.434 2.867 . 0 0 "[ . 1 . 2 . ]" 1
526 2 12 VAL HA 2 16 TYR H 4.290 . 4.790 4.146 3.940 4.308 . 0 0 "[ . 1 . 2 . ]" 1
527 2 12 VAL MG1 2 13 GLU H 4.730 . 5.230 3.392 2.277 3.652 . 0 0 "[ . 1 . 2 . ]" 1
528 2 12 VAL MG2 2 13 GLU H 4.730 . 5.230 3.947 3.859 3.998 . 0 0 "[ . 1 . 2 . ]" 1
529 2 13 GLU H 2 13 GLU HB2 3.590 . 4.090 2.380 2.349 2.431 . 0 0 "[ . 1 . 2 . ]" 1
530 2 13 GLU H 2 13 GLU QB 3.270 . 3.770 2.348 2.319 2.395 . 0 0 "[ . 1 . 2 . ]" 1
531 2 13 GLU H 2 13 GLU HB3 3.590 . 4.090 3.596 3.572 3.609 . 0 0 "[ . 1 . 2 . ]" 1
532 2 13 GLU H 2 13 GLU QG 3.690 . 4.190 2.469 2.340 2.532 . 0 0 "[ . 1 . 2 . ]" 1
533 2 13 GLU H 2 14 ALA H 3.180 . 3.680 2.814 2.755 2.840 . 0 0 "[ . 1 . 2 . ]" 1
534 2 13 GLU H 2 14 ALA MB 5.320 . 5.820 4.430 4.368 4.449 . 0 0 "[ . 1 . 2 . ]" 1
535 2 13 GLU H 2 16 TYR QB 5.250 . 5.750 4.573 4.408 4.712 . 0 0 "[ . 1 . 2 . ]" 1
536 2 13 GLU HA 2 16 TYR H 3.640 . 4.140 3.550 3.403 3.664 . 0 0 "[ . 1 . 2 . ]" 1
537 2 13 GLU HA 2 16 TYR QB 3.780 . 4.280 2.404 2.234 2.574 . 0 0 "[ . 1 . 2 . ]" 1
538 2 13 GLU HA 2 16 TYR QD 3.880 . 4.380 2.703 2.393 3.093 . 0 0 "[ . 1 . 2 . ]" 1
539 2 13 GLU HA 2 16 TYR QE 5.460 . 5.960 4.733 4.498 4.882 . 0 0 "[ . 1 . 2 . ]" 1
540 2 13 GLU QB 2 14 ALA H 3.610 . 4.110 2.668 2.576 2.775 . 0 0 "[ . 1 . 2 . ]" 1
541 2 13 GLU QB 2 15 LEU H 5.990 . 6.490 4.850 4.784 4.925 . 0 0 "[ . 1 . 2 . ]" 1
542 2 13 GLU HB2 2 14 ALA H 3.710 . 4.210 2.758 2.657 2.887 . 0 0 "[ . 1 . 2 . ]" 1
543 2 13 GLU HB2 2 14 ALA MB 6.230 . 6.730 4.137 4.018 4.242 . 0 0 "[ . 1 . 2 . ]" 1
544 2 13 GLU HB3 2 14 ALA H 3.710 . 4.210 3.548 3.464 3.615 . 0 0 "[ . 1 . 2 . ]" 1
545 2 13 GLU HB3 2 14 ALA MB 6.230 . 6.730 4.651 4.557 4.750 . 0 0 "[ . 1 . 2 . ]" 1
546 2 13 GLU QG 2 14 ALA H 4.980 . 5.480 4.326 4.260 4.397 . 0 0 "[ . 1 . 2 . ]" 1
547 2 13 GLU QG 2 16 TYR QD 5.570 . 6.070 3.767 3.429 4.442 . 0 0 "[ . 1 . 2 . ]" 1
548 2 14 ALA H 2 14 ALA MB 3.270 . 3.770 2.195 2.167 2.221 . 0 0 "[ . 1 . 2 . ]" 1
549 2 14 ALA H 2 15 LEU H 3.100 . 3.600 2.859 2.788 2.930 . 0 0 "[ . 1 . 2 . ]" 1
550 2 14 ALA H 2 15 LEU HB3 5.500 . 6.000 5.314 5.162 5.499 . 0 0 "[ . 1 . 2 . ]" 1
551 2 14 ALA H 2 15 LEU MD2 6.610 . 7.110 5.254 5.118 5.477 . 0 0 "[ . 1 . 2 . ]" 1
552 2 14 ALA H 2 15 LEU HG 4.880 . 5.380 4.658 4.477 4.884 . 0 0 "[ . 1 . 2 . ]" 1
553 2 14 ALA H 2 16 TYR H 4.530 . 5.030 4.254 4.188 4.339 . 0 0 "[ . 1 . 2 . ]" 1
554 2 14 ALA H 2 16 TYR QB 5.530 . 6.030 4.774 4.651 4.899 . 0 0 "[ . 1 . 2 . ]" 1
555 2 14 ALA MB 2 15 LEU H 3.720 . 4.220 2.688 2.584 2.769 . 0 0 "[ . 1 . 2 . ]" 1
556 2 14 ALA MB 2 16 TYR H 5.550 . 6.050 4.594 4.534 4.627 . 0 0 "[ . 1 . 2 . ]" 1
557 2 14 ALA MB 2 18 VAL H 5.900 . 6.400 4.718 4.448 4.951 . 0 0 "[ . 1 . 2 . ]" 1
558 2 14 ALA MB 2 18 VAL HB 6.610 . 7.110 4.700 4.242 5.197 . 0 0 "[ . 1 . 2 . ]" 1
559 2 14 ALA MB 2 18 VAL MG1 6.430 . 6.930 4.236 3.918 4.472 . 0 0 "[ . 1 . 2 . ]" 1
560 2 15 LEU H 2 15 LEU HB2 3.680 . 4.180 3.697 3.681 3.720 . 0 0 "[ . 1 . 2 . ]" 1
561 2 15 LEU H 2 15 LEU HB3 3.140 . 3.640 2.656 2.561 2.817 . 0 0 "[ . 1 . 2 . ]" 1
562 2 15 LEU H 2 15 LEU MD1 5.580 . 6.080 3.744 3.532 3.880 . 0 0 "[ . 1 . 2 . ]" 1
563 2 15 LEU H 2 15 LEU MD2 4.440 . 4.940 3.412 3.295 3.566 . 0 0 "[ . 1 . 2 . ]" 1
564 2 15 LEU H 2 15 LEU HG 3.250 . 3.750 2.348 2.164 2.532 . 0 0 "[ . 1 . 2 . ]" 1
565 2 15 LEU H 2 16 TYR QD 6.170 . 6.670 5.578 5.548 5.605 . 0 0 "[ . 1 . 2 . ]" 1
566 2 15 LEU H 2 18 VAL MG1 5.640 . 6.140 4.362 4.252 4.499 . 0 0 "[ . 1 . 2 . ]" 1
567 2 15 LEU HA 2 15 LEU HG 4.240 . 4.740 3.776 3.734 3.812 . 0 0 "[ . 1 . 2 . ]" 1
568 2 15 LEU HA 2 16 TYR H 3.570 . 4.070 3.547 3.507 3.578 . 0 0 "[ . 1 . 2 . ]" 1
569 2 15 LEU HA 2 18 VAL HB 4.200 . 4.700 4.005 3.677 4.205 . 0 0 "[ . 1 . 2 . ]" 1
570 2 15 LEU HA 2 18 VAL MG1 4.400 . 4.900 1.994 1.963 2.036 . 0 0 "[ . 1 . 2 . ]" 1
571 2 15 LEU HA 2 18 VAL MG2 5.450 . 5.950 4.615 4.548 4.666 . 0 0 "[ . 1 . 2 . ]" 1
572 2 15 LEU HA 2 19 CYS H 3.870 . 4.370 3.840 3.688 3.922 . 0 0 "[ . 1 . 2 . ]" 1
573 2 15 LEU HA 2 19 CYS QB 5.990 . 6.490 4.202 3.861 4.729 . 0 0 "[ . 1 . 2 . ]" 1
574 2 15 LEU HB2 2 16 TYR H 4.160 . 4.660 4.105 4.057 4.178 . 0 0 "[ . 1 . 2 . ]" 1
575 2 15 LEU HB2 2 18 VAL H 5.500 . 6.000 5.498 5.315 5.547 . 0 0 "[ . 1 . 2 . ]" 1
576 2 15 LEU HB2 2 19 CYS H 5.060 . 5.560 5.034 4.841 5.130 . 0 0 "[ . 1 . 2 . ]" 1
577 2 15 LEU HB3 2 18 VAL MG1 5.140 . 5.640 3.926 3.839 4.032 . 0 0 "[ . 1 . 2 . ]" 1
578 2 15 LEU MD1 2 16 TYR HA 5.300 . 5.800 2.948 2.833 3.104 . 0 0 "[ . 1 . 2 . ]" 1
579 2 15 LEU MD1 2 16 TYR QD 6.980 . 7.480 4.777 4.582 4.952 . 0 0 "[ . 1 . 2 . ]" 1
580 2 15 LEU MD1 2 17 LEU H 5.780 . 6.280 4.848 4.826 4.866 . 0 0 "[ . 1 . 2 . ]" 1
581 2 15 LEU MD1 2 18 VAL MG1 7.230 . 7.730 4.366 4.133 4.520 . 0 0 "[ . 1 . 2 . ]" 1
582 2 15 LEU MD1 2 19 CYS H 5.900 . 6.400 4.795 4.374 4.948 . 0 0 "[ . 1 . 2 . ]" 1
583 2 15 LEU MD1 2 19 CYS QB 6.380 . 6.880 3.656 3.123 4.149 . 0 0 "[ . 1 . 2 . ]" 1
584 2 15 LEU MD2 2 16 TYR H 5.460 . 5.960 4.243 4.099 4.485 . 0 0 "[ . 1 . 2 . ]" 1
585 2 15 LEU MD2 2 18 VAL MG1 7.930 . 8.430 4.988 4.881 5.073 . 0 0 "[ . 1 . 2 . ]" 1
586 2 16 TYR H 2 16 TYR QB 2.920 . 3.420 2.060 2.017 2.086 . 0 0 "[ . 1 . 2 . ]" 1
587 2 16 TYR H 2 16 TYR QD 4.440 . 4.940 3.865 3.787 3.964 . 0 0 "[ . 1 . 2 . ]" 1
588 2 16 TYR H 2 17 LEU H 3.540 . 4.040 2.719 2.599 2.813 . 0 0 "[ . 1 . 2 . ]" 1
589 2 16 TYR H 2 19 CYS H 5.120 . 5.620 4.875 4.688 5.049 . 0 0 "[ . 1 . 2 . ]" 1
590 2 16 TYR HA 2 18 VAL H 4.920 . 5.420 4.818 4.725 4.937 . 0 0 "[ . 1 . 2 . ]" 1
591 2 16 TYR HA 2 19 CYS H 4.120 . 4.620 3.853 3.624 4.090 . 0 0 "[ . 1 . 2 . ]" 1
592 2 16 TYR HA 2 19 CYS QB 4.590 . 5.090 3.075 2.399 3.643 . 0 0 "[ . 1 . 2 . ]" 1
593 2 16 TYR HA 2 20 GLY H 4.060 . 4.560 3.824 3.380 4.109 . 0 0 "[ . 1 . 2 . ]" 1
594 2 16 TYR QB 2 17 LEU H 3.820 . 4.320 2.835 2.743 2.929 . 0 0 "[ . 1 . 2 . ]" 1
595 2 16 TYR QB 2 17 LEU HG 5.740 . 6.240 3.945 3.858 4.033 . 0 0 "[ . 1 . 2 . ]" 1
596 2 16 TYR QB 2 18 VAL H 6.110 . 6.610 5.130 5.063 5.187 . 0 0 "[ . 1 . 2 . ]" 1
597 2 16 TYR QD 2 17 LEU CG 5.900 . 6.400 3.360 3.267 3.418 . 0 0 "[ . 1 . 2 . ]" 1
598 2 16 TYR QD 2 17 LEU H 4.460 . 4.960 2.936 2.800 3.059 . 0 0 "[ . 1 . 2 . ]" 1
599 2 16 TYR QD 2 17 LEU HB2 5.620 . 6.120 4.268 4.140 4.321 . 0 0 "[ . 1 . 2 . ]" 1
600 2 16 TYR QD 2 17 LEU HB3 5.620 . 6.120 5.010 4.841 5.077 . 0 0 "[ . 1 . 2 . ]" 1
601 2 16 TYR QD 2 17 LEU HG 4.270 . 4.770 2.307 2.257 2.372 . 0 0 "[ . 1 . 2 . ]" 1
602 2 16 TYR QD 2 18 VAL H 6.170 . 6.670 5.431 5.345 5.473 . 0 0 "[ . 1 . 2 . ]" 1
603 2 16 TYR QE 2 17 LEU HA 5.660 . 6.160 4.168 4.032 4.415 . 0 0 "[ . 1 . 2 . ]" 1
604 2 16 TYR QE 2 17 LEU QB 6.650 . 7.150 5.009 4.721 5.284 . 0 0 "[ . 1 . 2 . ]" 1
605 2 17 LEU CG 2 18 VAL H 7.260 . 7.760 4.476 4.400 4.524 . 0 0 "[ . 1 . 2 . ]" 1
606 2 17 LEU CG 2 20 GLY H 7.450 . 7.950 6.288 5.961 6.572 . 0 0 "[ . 1 . 2 . ]" 1
607 2 17 LEU H 2 17 LEU HB2 3.590 . 4.090 2.273 2.224 2.318 . 0 0 "[ . 1 . 2 . ]" 1
608 2 17 LEU H 2 17 LEU QB 3.520 . 4.020 2.247 2.201 2.290 . 0 0 "[ . 1 . 2 . ]" 1
609 2 17 LEU H 2 17 LEU HB3 3.590 . 4.090 3.541 3.517 3.567 . 0 0 "[ . 1 . 2 . ]" 1
610 2 17 LEU H 2 17 LEU HG 3.690 . 4.190 2.662 2.571 2.774 . 0 0 "[ . 1 . 2 . ]" 1
611 2 17 LEU H 2 18 VAL H 3.560 . 4.060 2.775 2.705 2.828 . 0 0 "[ . 1 . 2 . ]" 1
612 2 17 LEU H 2 18 VAL HB 5.000 . 5.500 5.051 5.015 5.111 . 0 0 "[ . 1 . 2 . ]" 1
613 2 17 LEU H 2 18 VAL MG1 5.450 . 5.950 4.194 3.917 4.461 . 0 0 "[ . 1 . 2 . ]" 1
614 2 17 LEU H 2 19 CYS H 4.680 . 5.180 4.139 3.994 4.307 . 0 0 "[ . 1 . 2 . ]" 1
615 2 17 LEU HA 2 17 LEU HG 4.150 . 4.650 2.846 2.747 2.896 . 0 0 "[ . 1 . 2 . ]" 1
616 2 17 LEU HA 2 19 CYS H 4.580 . 5.080 4.485 4.391 4.646 . 0 0 "[ . 1 . 2 . ]" 1
617 2 17 LEU QB 2 18 VAL HA 5.810 . 6.310 3.870 3.721 3.989 . 0 0 "[ . 1 . 2 . ]" 1
618 2 17 LEU QB 2 18 VAL MG1 6.750 . 7.250 4.176 3.935 4.416 . 0 0 "[ . 1 . 2 . ]" 1
619 2 17 LEU QB 2 19 CYS H 5.140 . 5.640 4.618 4.596 4.667 . 0 0 "[ . 1 . 2 . ]" 1
620 2 17 LEU HB2 2 18 VAL H 3.550 . 4.050 2.617 2.516 2.697 . 0 0 "[ . 1 . 2 . ]" 1
621 2 17 LEU HB2 2 19 CYS H 5.390 . 5.890 4.999 4.962 5.087 . 0 0 "[ . 1 . 2 . ]" 1
622 2 17 LEU HB3 2 18 VAL H 3.550 . 4.050 3.329 3.147 3.420 . 0 0 "[ . 1 . 2 . ]" 1
623 2 17 LEU HB3 2 19 CYS H 5.390 . 5.890 5.431 5.401 5.456 . 0 0 "[ . 1 . 2 . ]" 1
624 2 17 LEU HG 2 18 VAL H 4.960 . 5.460 4.681 4.621 4.728 . 0 0 "[ . 1 . 2 . ]" 1
625 2 18 VAL H 2 18 VAL HB 3.090 . 3.590 2.422 2.346 2.529 . 0 0 "[ . 1 . 2 . ]" 1
626 2 18 VAL H 2 18 VAL MG1 3.530 . 4.030 2.275 2.082 2.486 . 0 0 "[ . 1 . 2 . ]" 1
627 2 18 VAL H 2 19 CYS H 3.120 . 3.620 2.654 2.576 2.832 . 0 0 "[ . 1 . 2 . ]" 1
628 2 18 VAL H 2 19 CYS QB 5.860 . 6.360 4.429 4.196 4.798 . 0 0 "[ . 1 . 2 . ]" 1
629 2 18 VAL H 2 20 GLY H 4.340 . 4.840 4.181 3.969 4.393 . 0 0 "[ . 1 . 2 . ]" 1
630 2 18 VAL HB 2 19 CYS H 4.100 . 4.600 4.003 3.907 4.102 . 0 0 "[ . 1 . 2 . ]" 1
631 2 18 VAL MG1 2 19 CYS H 4.050 . 4.550 2.366 2.278 2.517 . 0 0 "[ . 1 . 2 . ]" 1
632 2 18 VAL MG1 2 19 CYS HA 5.800 . 6.300 3.553 3.365 3.748 . 0 0 "[ . 1 . 2 . ]" 1
633 2 18 VAL MG2 2 19 CYS H 4.790 . 5.290 3.961 3.802 4.047 . 0 0 "[ . 1 . 2 . ]" 1
634 2 18 VAL MG2 2 19 CYS HA 5.310 . 5.810 4.135 3.858 4.385 . 0 0 "[ . 1 . 2 . ]" 1
635 2 19 CYS H 2 19 CYS HB2 3.340 . 3.840 2.428 2.290 2.601 . 0 0 "[ . 1 . 2 . ]" 1
636 2 19 CYS H 2 19 CYS QB 3.230 . 3.730 2.242 2.133 2.354 . 0 0 "[ . 1 . 2 . ]" 1
637 2 19 CYS H 2 19 CYS HB3 3.340 . 3.840 2.782 2.304 3.545 . 0 0 "[ . 1 . 2 . ]" 1
638 2 19 CYS H 2 20 GLY H 3.070 . 3.570 2.500 2.384 2.684 . 0 0 "[ . 1 . 2 . ]" 1
639 2 19 CYS H 2 21 GLU H 4.400 . 4.900 4.153 3.772 4.492 . 0 0 "[ . 1 . 2 . ]" 1
640 2 19 CYS HA 2 21 GLU H 4.590 . 5.090 4.298 3.575 4.724 . 0 0 "[ . 1 . 2 . ]" 1
641 2 19 CYS QB 2 20 GLY H 3.830 . 4.330 2.779 2.499 3.010 . 0 0 "[ . 1 . 2 . ]" 1
642 2 19 CYS QB 2 20 GLY QA 5.900 . 6.400 4.012 3.734 4.300 . 0 0 "[ . 1 . 2 . ]" 1
643 2 19 CYS QB 2 21 GLU H 5.650 . 6.150 3.644 2.342 4.900 . 0 0 "[ . 1 . 2 . ]" 1
644 2 19 CYS HB2 2 20 GLY H 3.900 . 4.400 3.695 2.984 3.969 . 0 0 "[ . 1 . 2 . ]" 1
645 2 19 CYS HB2 2 20 GLY QA 6.050 . 6.550 5.097 4.172 5.438 . 0 0 "[ . 1 . 2 . ]" 1
646 2 19 CYS HB3 2 20 GLY H 3.900 . 4.400 3.064 2.532 3.941 . 0 0 "[ . 1 . 2 . ]" 1
647 2 19 CYS HB3 2 20 GLY QA 6.050 . 6.550 4.273 3.837 4.886 . 0 0 "[ . 1 . 2 . ]" 1
648 2 20 GLY H 2 21 GLU H 3.270 . 3.770 2.651 2.354 3.149 . 0 0 "[ . 1 . 2 . ]" 1
649 2 20 GLY H 2 21 GLU HA 5.490 . 5.990 5.098 4.560 5.434 . 0 0 "[ . 1 . 2 . ]" 1
650 2 20 GLY H 2 21 GLU QB 5.380 . 5.880 4.513 4.110 4.823 . 0 0 "[ . 1 . 2 . ]" 1
651 2 20 GLY QA 2 21 GLU H 3.380 . 3.880 2.891 2.712 2.986 . 0 0 "[ . 1 . 2 . ]" 1
652 2 21 GLU H 2 21 GLU HB2 3.820 . 4.320 2.719 2.109 3.384 . 0 0 "[ . 1 . 2 . ]" 1
653 2 21 GLU H 2 21 GLU QB 3.420 . 3.920 2.486 2.090 2.972 . 0 0 "[ . 1 . 2 . ]" 1
654 2 21 GLU H 2 21 GLU HB3 3.820 . 4.320 3.070 2.513 3.943 . 0 0 "[ . 1 . 2 . ]" 1
655 2 21 GLU HA 2 22 ARG H 3.330 . 3.830 2.601 2.083 3.538 . 0 0 "[ . 1 . 2 . ]" 1
656 2 21 GLU QB 2 22 ARG H 4.800 . 5.300 3.326 2.230 4.146 . 0 0 "[ . 1 . 2 . ]" 1
657 2 21 GLU QG 2 22 ARG H 5.990 . 6.490 3.213 1.688 4.540 0.112 24 0 "[ . 1 . 2 . ]" 1
658 2 22 ARG H 2 22 ARG HB2 3.770 . 4.270 3.150 2.410 3.827 . 0 0 "[ . 1 . 2 . ]" 1
659 2 22 ARG H 2 22 ARG QB 3.360 . 3.860 2.539 2.276 3.151 . 0 0 "[ . 1 . 2 . ]" 1
660 2 22 ARG H 2 22 ARG HB3 3.770 . 4.270 3.088 2.304 3.794 . 0 0 "[ . 1 . 2 . ]" 1
661 2 22 ARG H 2 22 ARG QD 4.570 . 5.070 3.359 2.057 4.133 . 0 0 "[ . 1 . 2 . ]" 1
662 2 22 ARG H 2 22 ARG HE 4.910 . 5.410 4.266 2.402 5.067 . 0 0 "[ . 1 . 2 . ]" 1
663 2 22 ARG H 2 22 ARG HG2 3.950 . 4.450 2.865 2.041 4.034 . 0 0 "[ . 1 . 2 . ]" 1
664 2 22 ARG H 2 22 ARG QG 3.770 . 4.270 2.495 1.989 3.395 . 0 0 "[ . 1 . 2 . ]" 1
665 2 22 ARG H 2 22 ARG HG3 3.950 . 4.450 3.342 2.051 4.019 . 0 0 "[ . 1 . 2 . ]" 1
666 2 22 ARG H 2 23 GLY H 3.330 . 3.830 2.699 1.903 3.386 . 0 0 "[ . 1 . 2 . ]" 1
667 2 22 ARG QB 2 23 GLY H 4.730 . 5.230 3.588 2.693 4.058 . 0 0 "[ . 1 . 2 . ]" 1
668 2 22 ARG HB2 2 22 ARG HE 4.280 . 4.780 3.590 2.106 4.454 . 0 0 "[ . 1 . 2 . ]" 1
669 2 22 ARG HB3 2 22 ARG HE 4.280 . 4.780 3.420 2.060 4.442 . 0 0 "[ . 1 . 2 . ]" 1
670 2 22 ARG QD 2 23 GLY H 5.420 . 5.920 4.478 2.803 4.903 . 0 0 "[ . 1 . 2 . ]" 1
671 2 22 ARG HE 2 22 ARG HG2 4.090 . 4.590 2.933 2.169 3.772 . 0 0 "[ . 1 . 2 . ]" 1
672 2 22 ARG HE 2 22 ARG HG3 4.090 . 4.590 2.920 2.164 3.994 . 0 0 "[ . 1 . 2 . ]" 1
673 2 23 GLY QA 2 25 PHE H 5.010 . 5.510 3.546 3.093 4.473 . 0 0 "[ . 1 . 2 . ]" 1
674 2 23 GLY QA 2 25 PHE QD 6.540 . 7.040 3.307 2.531 4.791 . 0 0 "[ . 1 . 2 . ]" 1
675 2 23 GLY QA 2 25 PHE QE 6.780 . 7.280 2.981 2.244 4.330 . 0 0 "[ . 1 . 2 . ]" 1
676 2 23 GLY QA 2 25 PHE HZ 6.170 . 6.670 4.072 2.872 5.521 . 0 0 "[ . 1 . 2 . ]" 1
677 2 25 PHE H 2 25 PHE HB2 3.700 . 4.200 2.593 2.347 3.426 . 0 0 "[ . 1 . 2 . ]" 1
678 2 25 PHE H 2 25 PHE QB 3.430 . 3.930 2.533 2.317 3.176 . 0 0 "[ . 1 . 2 . ]" 1
679 2 25 PHE H 2 25 PHE HB3 3.700 . 4.200 3.607 3.539 3.756 . 0 0 "[ . 1 . 2 . ]" 1
680 2 25 PHE H 2 25 PHE QD 3.970 . 4.470 2.754 2.169 3.380 . 0 0 "[ . 1 . 2 . ]" 1
681 2 25 PHE H 2 25 PHE QE 6.170 . 6.670 4.309 3.746 4.850 . 0 0 "[ . 1 . 2 . ]" 1
682 2 25 PHE HA 2 25 PHE QD 3.600 . 4.100 2.604 2.312 3.128 . 0 0 "[ . 1 . 2 . ]" 1
683 2 25 PHE HA 2 25 PHE QE 5.260 . 5.760 4.628 4.542 4.764 . 0 0 "[ . 1 . 2 . ]" 1
684 2 25 PHE HA 2 26 TYR H 2.830 . 3.330 2.432 2.035 3.205 . 0 0 "[ . 1 . 2 . ]" 1
685 2 25 PHE QB 2 26 TYR H 3.860 . 4.360 2.687 2.124 3.234 . 0 0 "[ . 1 . 2 . ]" 1
686 2 25 PHE HB2 2 26 TYR H 4.180 . 4.680 3.647 3.092 4.222 . 0 0 "[ . 1 . 2 . ]" 1
687 2 25 PHE HB3 2 26 TYR H 4.180 . 4.680 2.879 2.164 4.201 . 0 0 "[ . 1 . 2 . ]" 1
688 2 25 PHE QD 2 26 TYR H 4.500 . 5.000 3.938 3.596 4.158 . 0 0 "[ . 1 . 2 . ]" 1
689 2 26 TYR H 2 26 TYR QB 3.260 . 3.760 2.534 2.250 2.829 . 0 0 "[ . 1 . 2 . ]" 1
690 2 26 TYR H 2 26 TYR QD 3.920 . 4.420 2.677 2.201 3.122 . 0 0 "[ . 1 . 2 . ]" 1
691 2 26 TYR H 2 26 TYR QE 5.100 . 5.600 4.384 3.838 4.593 . 0 0 "[ . 1 . 2 . ]" 1
692 2 26 TYR H 2 27 THR H 5.390 . 5.890 4.538 2.871 4.688 . 0 0 "[ . 1 . 2 . ]" 1
693 2 26 TYR HA 2 26 TYR QD 3.480 . 3.980 2.708 2.368 3.085 . 0 0 "[ . 1 . 2 . ]" 1
694 2 26 TYR HA 2 26 TYR QE 5.350 . 5.850 4.637 4.465 4.790 . 0 0 "[ . 1 . 2 . ]" 1
695 2 26 TYR HA 2 27 THR H 2.660 . 3.160 2.282 2.103 2.929 . 0 0 "[ . 1 . 2 . ]" 1
696 2 26 TYR QB 2 27 THR H 3.860 . 4.360 2.783 2.374 3.503 . 0 0 "[ . 1 . 2 . ]" 1
697 2 26 TYR QD 2 27 THR H 4.910 . 5.410 3.923 3.342 4.486 . 0 0 "[ . 1 . 2 . ]" 1
698 2 26 TYR QD 2 28 PRO QD 6.930 . 7.430 4.934 3.663 5.555 . 0 0 "[ . 1 . 2 . ]" 1
699 2 27 THR H 2 27 THR HB 3.770 . 4.270 3.169 2.529 3.876 . 0 0 "[ . 1 . 2 . ]" 1
700 2 27 THR HA 2 28 PRO QD 4.000 . 4.500 2.819 2.030 3.863 . 0 0 "[ . 1 . 2 . ]" 1
701 2 27 THR MG 2 28 PRO QD 5.880 . 6.380 3.412 2.048 4.089 . 0 0 "[ . 1 . 2 . ]" 1
702 2 28 PRO HA 2 29 LYS H 2.620 . 3.120 2.238 2.089 2.347 . 0 0 "[ . 1 . 2 . ]" 1
703 2 28 PRO HA 2 29 LYS QB 5.380 . 5.880 4.281 3.841 4.774 . 0 0 "[ . 1 . 2 . ]" 1
704 2 28 PRO QB 2 29 LYS H 4.050 . 4.550 2.952 2.669 3.533 . 0 0 "[ . 1 . 2 . ]" 1
705 2 28 PRO HB2 2 29 LYS H 4.110 . 4.610 3.416 2.749 3.962 . 0 0 "[ . 1 . 2 . ]" 1
706 2 28 PRO HB3 2 29 LYS H 4.110 . 4.610 3.401 2.881 4.158 . 0 0 "[ . 1 . 2 . ]" 1
707 2 29 LYS H 2 29 LYS HB2 4.190 . 4.690 3.198 2.435 3.986 . 0 0 "[ . 1 . 2 . ]" 1
708 2 29 LYS H 2 29 LYS HB3 4.190 . 4.690 3.549 2.839 4.039 . 0 0 "[ . 1 . 2 . ]" 1
709 2 29 LYS H 2 30 THR H 4.350 . 4.850 3.912 2.043 4.480 . 0 0 "[ . 1 . 2 . ]" 1
710 2 30 THR H 2 30 THR HB 4.110 . 4.610 3.214 2.541 3.839 . 0 0 "[ . 1 . 2 . ]" 1
stop_
save_
Contact the webmaster for help, if required. Wednesday, May 1, 2024 12:44:54 AM GMT (wattos1)