NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
454836 |
3hck   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_3hck
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 1557
_Distance_constraint_stats_list.Viol_count 877
_Distance_constraint_stats_list.Viol_total 428.284
_Distance_constraint_stats_list.Viol_max 0.151
_Distance_constraint_stats_list.Viol_rms 0.0065
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0007
_Distance_constraint_stats_list.Viol_average_violations_only 0.0244
_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 2 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 GLU 0.000 0.000 10 0 "[ . 1 . 2]"
1 6 TRP 0.068 0.039 6 0 "[ . 1 . 2]"
1 7 PHE 0.013 0.007 5 0 "[ . 1 . 2]"
1 8 PHE 0.003 0.002 18 0 "[ . 1 . 2]"
1 9 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 ILE 0.312 0.037 16 0 "[ . 1 . 2]"
1 12 SER 0.011 0.004 14 0 "[ . 1 . 2]"
1 13 ARG 0.771 0.068 9 0 "[ . 1 . 2]"
1 14 LYS 2.176 0.140 13 0 "[ . 1 . 2]"
1 15 ASP 3.165 0.149 9 0 "[ . 1 . 2]"
1 16 ALA 2.733 0.149 9 0 "[ . 1 . 2]"
1 17 GLU 1.299 0.098 10 0 "[ . 1 . 2]"
1 18 ARG 1.083 0.104 16 0 "[ . 1 . 2]"
1 19 GLN 1.669 0.118 20 0 "[ . 1 . 2]"
1 20 LEU 0.973 0.118 20 0 "[ . 1 . 2]"
1 21 LEU 0.001 0.001 8 0 "[ . 1 . 2]"
1 22 ALA 0.016 0.010 17 0 "[ . 1 . 2]"
1 23 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 ASN 0.007 0.004 9 0 "[ . 1 . 2]"
1 26 MET 0.105 0.029 1 0 "[ . 1 . 2]"
1 27 LEU 0.242 0.033 1 0 "[ . 1 . 2]"
1 28 GLY 0.029 0.007 17 0 "[ . 1 . 2]"
1 29 SER 0.046 0.008 13 0 "[ . 1 . 2]"
1 30 PHE 0.193 0.018 17 0 "[ . 1 . 2]"
1 31 MET 0.017 0.006 11 0 "[ . 1 . 2]"
1 32 ILE 0.221 0.020 5 0 "[ . 1 . 2]"
1 33 ARG 0.015 0.006 11 0 "[ . 1 . 2]"
1 34 ASP 0.002 0.002 5 0 "[ . 1 . 2]"
1 35 SER 0.020 0.010 11 0 "[ . 1 . 2]"
1 36 GLU 0.475 0.075 11 0 "[ . 1 . 2]"
1 37 THR 0.021 0.021 3 0 "[ . 1 . 2]"
1 38 THR 0.023 0.021 3 0 "[ . 1 . 2]"
1 39 LYS 0.002 0.002 8 0 "[ . 1 . 2]"
1 40 GLY 0.077 0.014 17 0 "[ . 1 . 2]"
1 41 SER 0.084 0.014 17 0 "[ . 1 . 2]"
1 42 TYR 0.006 0.006 13 0 "[ . 1 . 2]"
1 43 SER 0.066 0.007 5 0 "[ . 1 . 2]"
1 44 LEU 0.070 0.014 11 0 "[ . 1 . 2]"
1 45 SER 0.029 0.006 17 0 "[ . 1 . 2]"
1 46 VAL 0.013 0.007 16 0 "[ . 1 . 2]"
1 47 ARG 0.269 0.103 17 0 "[ . 1 . 2]"
1 48 ASP 0.308 0.045 15 0 "[ . 1 . 2]"
1 49 TYR 0.280 0.045 15 0 "[ . 1 . 2]"
1 50 ASP 0.056 0.014 5 0 "[ . 1 . 2]"
1 51 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 GLY 0.297 0.038 13 0 "[ . 1 . 2]"
1 55 ASP 0.021 0.008 19 0 "[ . 1 . 2]"
1 56 THR 0.243 0.030 17 0 "[ . 1 . 2]"
1 57 VAL 0.187 0.030 17 0 "[ . 1 . 2]"
1 58 LYS 0.009 0.006 5 0 "[ . 1 . 2]"
1 59 HIS 0.021 0.007 16 0 "[ . 1 . 2]"
1 60 TYR 0.016 0.006 18 0 "[ . 1 . 2]"
1 61 LYS 0.045 0.007 5 0 "[ . 1 . 2]"
1 62 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 ARG 0.032 0.008 1 0 "[ . 1 . 2]"
1 64 THR 0.018 0.008 1 0 "[ . 1 . 2]"
1 65 LEU 0.001 0.001 15 0 "[ . 1 . 2]"
1 66 ASP 0.009 0.009 15 0 "[ . 1 . 2]"
1 67 ASN 0.370 0.131 19 0 "[ . 1 . 2]"
1 68 GLY 0.379 0.131 19 0 "[ . 1 . 2]"
1 69 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 PHE 0.032 0.006 15 0 "[ . 1 . 2]"
1 71 TYR 0.092 0.019 9 0 "[ . 1 . 2]"
1 72 ILE 0.023 0.019 9 0 "[ . 1 . 2]"
1 73 SER 0.034 0.007 4 0 "[ . 1 . 2]"
1 74 PRO 0.001 0.001 13 0 "[ . 1 . 2]"
1 75 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 SER 0.001 0.001 13 0 "[ . 1 . 2]"
1 77 THR 0.027 0.009 9 0 "[ . 1 . 2]"
1 78 PHE 0.004 0.003 17 0 "[ . 1 . 2]"
1 79 SER 0.507 0.057 9 0 "[ . 1 . 2]"
1 80 THR 0.495 0.057 9 0 "[ . 1 . 2]"
1 81 LEU 0.129 0.023 5 0 "[ . 1 . 2]"
1 82 GLN 1.186 0.091 10 0 "[ . 1 . 2]"
1 83 GLU 1.229 0.091 10 0 "[ . 1 . 2]"
1 84 LEU 1.585 0.078 5 0 "[ . 1 . 2]"
1 85 VAL 2.817 0.133 6 0 "[ . 1 . 2]"
1 86 ASP 3.630 0.151 12 0 "[ . 1 . 2]"
1 87 HIS 3.589 0.151 12 0 "[ . 1 . 2]"
1 88 TYR 1.681 0.100 6 0 "[ . 1 . 2]"
1 89 LYS 0.949 0.071 14 0 "[ . 1 . 2]"
1 90 LYS 1.401 0.071 14 0 "[ . 1 . 2]"
1 91 GLY 0.807 0.057 19 0 "[ . 1 . 2]"
1 92 ASN 0.023 0.004 7 0 "[ . 1 . 2]"
1 93 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 LEU 0.019 0.003 7 0 "[ . 1 . 2]"
1 96 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 GLN 0.004 0.004 14 0 "[ . 1 . 2]"
1 98 LYS 0.006 0.004 7 0 "[ . 1 . 2]"
1 99 LEU 0.004 0.002 9 0 "[ . 1 . 2]"
1 100 SER 0.106 0.013 17 0 "[ . 1 . 2]"
1 101 VAL 1.125 0.064 13 0 "[ . 1 . 2]"
1 102 PRO 0.976 0.064 13 0 "[ . 1 . 2]"
1 103 CYS 0.021 0.008 13 0 "[ . 1 . 2]"
1 104 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 LYS 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 2 GLU HA 1 2 GLU QG . . 3.500 2.278 1.980 3.306 . 0 0 "[ . 1 . 2]" 1
2 1 2 GLU HA 1 3 THR H . . 3.500 2.415 2.203 3.011 . 0 0 "[ . 1 . 2]" 1
3 1 2 GLU QB 1 3 THR H . . 4.200 3.311 2.324 3.948 . 0 0 "[ . 1 . 2]" 1
4 1 2 GLU QB 1 3 THR HA . . 6.000 4.195 3.894 4.616 . 0 0 "[ . 1 . 2]" 1
5 1 2 GLU QG 1 3 THR H . . 5.000 3.678 2.198 4.542 . 0 0 "[ . 1 . 2]" 1
6 1 3 THR H 1 3 THR HB . . 4.200 3.754 3.533 3.908 . 0 0 "[ . 1 . 2]" 1
7 1 3 THR H 1 4 GLU H . . 5.000 4.353 3.933 4.541 . 0 0 "[ . 1 . 2]" 1
8 1 3 THR H 1 4 GLU HA . . 6.000 4.788 4.532 5.223 . 0 0 "[ . 1 . 2]" 1
9 1 3 THR HA 1 3 THR MG . . 3.000 2.333 2.234 2.439 . 0 0 "[ . 1 . 2]" 1
10 1 3 THR HA 1 4 GLU H . . 3.500 2.465 2.150 2.821 . 0 0 "[ . 1 . 2]" 1
11 1 3 THR HA 1 4 GLU QB . . 6.000 4.274 3.867 4.904 . 0 0 "[ . 1 . 2]" 1
12 1 3 THR HB 1 4 GLU H . . 4.200 2.640 1.948 3.852 . 0 0 "[ . 1 . 2]" 1
13 1 3 THR MG 1 4 GLU H . . 5.000 3.735 3.479 4.044 . 0 0 "[ . 1 . 2]" 1
14 1 4 GLU H 1 4 GLU QB . . 3.500 2.523 2.047 3.072 . 0 0 "[ . 1 . 2]" 1
15 1 4 GLU H 1 4 GLU QG . . 5.000 3.459 1.851 4.124 . 0 0 "[ . 1 . 2]" 1
16 1 4 GLU H 1 5 GLU H . . 5.000 4.033 1.892 4.556 . 0 0 "[ . 1 . 2]" 1
17 1 4 GLU HA 1 4 GLU QG . . 3.500 2.316 2.006 3.175 . 0 0 "[ . 1 . 2]" 1
18 1 4 GLU HA 1 5 GLU H . . 3.000 2.254 2.202 2.948 . 0 0 "[ . 1 . 2]" 1
19 1 4 GLU HA 1 6 TRP H . . 5.000 3.998 3.490 4.257 . 0 0 "[ . 1 . 2]" 1
20 1 4 GLU HA 1 6 TRP HE1 . . 6.000 4.637 3.523 5.381 . 0 0 "[ . 1 . 2]" 1
21 1 4 GLU QB 1 5 GLU H . . 4.200 3.647 3.477 3.863 . 0 0 "[ . 1 . 2]" 1
22 1 4 GLU QB 1 5 GLU HA . . 5.000 4.204 4.142 4.285 . 0 0 "[ . 1 . 2]" 1
23 1 4 GLU QB 1 6 TRP H . . 5.000 3.283 2.942 4.209 . 0 0 "[ . 1 . 2]" 1
24 1 4 GLU QB 1 6 TRP HE1 . . 5.000 2.291 1.984 4.181 . 0 0 "[ . 1 . 2]" 1
25 1 4 GLU QB 1 7 PHE H . . 6.000 4.818 4.472 5.064 . 0 0 "[ . 1 . 2]" 1
26 1 4 GLU QG 1 6 TRP HE1 . . 5.000 2.633 2.118 3.406 . 0 0 "[ . 1 . 2]" 1
27 1 4 GLU QG 1 6 TRP HZ2 . . 6.000 4.997 4.385 5.191 . 0 0 "[ . 1 . 2]" 1
28 1 5 GLU H 1 5 GLU QB . . 3.500 2.370 2.171 2.478 . 0 0 "[ . 1 . 2]" 1
29 1 5 GLU H 1 5 GLU QG . . 4.200 3.459 3.042 3.903 . 0 0 "[ . 1 . 2]" 1
30 1 5 GLU H 1 6 TRP H . . 3.500 3.081 2.937 3.290 . 0 0 "[ . 1 . 2]" 1
31 1 5 GLU H 1 7 PHE H . . 5.000 4.879 4.757 5.000 0.000 10 0 "[ . 1 . 2]" 1
32 1 5 GLU HA 1 5 GLU QG . . 3.000 2.218 2.100 2.481 . 0 0 "[ . 1 . 2]" 1
33 1 5 GLU HA 1 6 TRP H . . 3.000 2.708 2.609 2.763 . 0 0 "[ . 1 . 2]" 1
34 1 5 GLU HA 1 7 PHE H . . 3.500 3.039 2.880 3.307 . 0 0 "[ . 1 . 2]" 1
35 1 5 GLU QB 1 7 PHE H . . 6.000 4.473 4.218 4.895 . 0 0 "[ . 1 . 2]" 1
36 1 5 GLU QG 1 6 TRP H . . 5.000 4.476 4.066 4.532 . 0 0 "[ . 1 . 2]" 1
37 1 5 GLU QG 1 7 PHE H . . 6.000 4.587 3.883 4.959 . 0 0 "[ . 1 . 2]" 1
38 1 6 TRP H 1 6 TRP HB3 . . 3.000 2.979 2.909 3.039 0.039 6 0 "[ . 1 . 2]" 1
39 1 6 TRP H 1 6 TRP HD1 . . 3.500 2.966 2.800 3.105 . 0 0 "[ . 1 . 2]" 1
40 1 6 TRP H 1 6 TRP HE1 . . 5.000 4.272 4.175 4.525 . 0 0 "[ . 1 . 2]" 1
41 1 6 TRP H 1 6 TRP HE3 . . 5.000 4.075 3.881 4.287 . 0 0 "[ . 1 . 2]" 1
42 1 6 TRP H 1 7 PHE H . . 3.000 2.236 1.953 2.327 . 0 0 "[ . 1 . 2]" 1
43 1 6 TRP H 1 7 PHE HA . . 5.000 4.839 4.632 4.914 . 0 0 "[ . 1 . 2]" 1
44 1 6 TRP H 1 7 PHE HB2 . . 5.000 4.640 4.430 4.841 . 0 0 "[ . 1 . 2]" 1
45 1 6 TRP H 1 7 PHE HB3 . . 5.000 4.047 3.822 4.262 . 0 0 "[ . 1 . 2]" 1
46 1 6 TRP H 1 102 PRO QB . . 5.000 3.956 3.594 4.310 . 0 0 "[ . 1 . 2]" 1
47 1 6 TRP HA 1 6 TRP HB2 . . 3.000 2.555 2.450 2.577 . 0 0 "[ . 1 . 2]" 1
48 1 6 TRP HA 1 6 TRP HB3 . . 3.000 2.307 2.290 2.392 . 0 0 "[ . 1 . 2]" 1
49 1 6 TRP HA 1 31 MET HA . . 4.200 3.921 3.546 4.206 0.006 11 0 "[ . 1 . 2]" 1
50 1 6 TRP HA 1 102 PRO HA . . 5.000 4.397 3.656 4.946 . 0 0 "[ . 1 . 2]" 1
51 1 6 TRP HA 1 102 PRO QB . . 3.500 2.701 1.836 3.084 . 0 0 "[ . 1 . 2]" 1
52 1 6 TRP HB2 1 7 PHE H . . 4.200 4.073 3.917 4.168 . 0 0 "[ . 1 . 2]" 1
53 1 6 TRP HB2 1 32 ILE H . . 5.000 3.904 3.341 4.570 . 0 0 "[ . 1 . 2]" 1
54 1 6 TRP HB2 1 102 PRO QB . . 5.000 3.005 2.532 3.528 . 0 0 "[ . 1 . 2]" 1
55 1 6 TRP HB3 1 32 ILE H . . 6.000 5.415 4.871 5.993 . 0 0 "[ . 1 . 2]" 1
56 1 6 TRP HD1 1 85 VAL MG1 . . 6.000 3.774 3.317 4.243 . 0 0 "[ . 1 . 2]" 1
57 1 6 TRP HD1 1 102 PRO HG3 . . 5.000 3.643 3.126 4.311 . 0 0 "[ . 1 . 2]" 1
58 1 6 TRP HE1 1 82 GLN HA . . 5.000 4.440 3.824 4.893 . 0 0 "[ . 1 . 2]" 1
59 1 6 TRP HE1 1 82 GLN QE . . 3.500 2.515 1.902 3.168 . 0 0 "[ . 1 . 2]" 1
60 1 6 TRP HE1 1 85 VAL MG1 . . 5.000 3.954 3.841 4.015 . 0 0 "[ . 1 . 2]" 1
61 1 6 TRP HE1 1 85 VAL MG2 . . 6.000 4.551 4.173 4.744 . 0 0 "[ . 1 . 2]" 1
62 1 6 TRP HE3 1 7 PHE H . . 6.000 3.273 3.074 3.502 . 0 0 "[ . 1 . 2]" 1
63 1 6 TRP HE3 1 7 PHE HA . . 4.200 2.728 2.548 2.955 . 0 0 "[ . 1 . 2]" 1
64 1 6 TRP HE3 1 32 ILE H . . 5.000 3.310 2.803 3.726 . 0 0 "[ . 1 . 2]" 1
65 1 6 TRP HE3 1 32 ILE HB . . 4.200 2.097 1.998 2.318 . 0 0 "[ . 1 . 2]" 1
66 1 6 TRP HE3 1 32 ILE MD . . 5.000 2.343 1.977 2.850 . 0 0 "[ . 1 . 2]" 1
67 1 6 TRP HE3 1 32 ILE MG . . 6.000 3.479 3.196 3.828 . 0 0 "[ . 1 . 2]" 1
68 1 6 TRP HH2 1 32 ILE MD . . 6.000 3.798 3.488 4.338 . 0 0 "[ . 1 . 2]" 1
69 1 6 TRP HH2 1 81 LEU HA . . 6.000 5.356 4.735 5.801 . 0 0 "[ . 1 . 2]" 1
70 1 6 TRP HH2 1 81 LEU HB2 . . 3.500 2.962 2.262 3.444 . 0 0 "[ . 1 . 2]" 1
71 1 6 TRP HH2 1 81 LEU HB3 . . 3.500 3.014 2.401 3.491 . 0 0 "[ . 1 . 2]" 1
72 1 6 TRP HH2 1 81 LEU MD1 . . 5.000 3.276 2.616 3.909 . 0 0 "[ . 1 . 2]" 1
73 1 6 TRP HH2 1 82 GLN H . . 5.000 4.699 4.299 4.998 . 0 0 "[ . 1 . 2]" 1
74 1 6 TRP HH2 1 82 GLN HA . . 5.000 4.566 4.143 4.897 . 0 0 "[ . 1 . 2]" 1
75 1 6 TRP HZ2 1 82 GLN H . . 5.000 4.525 3.888 4.983 . 0 0 "[ . 1 . 2]" 1
76 1 6 TRP HZ2 1 82 GLN HA . . 3.500 3.329 2.916 3.503 0.003 7 0 "[ . 1 . 2]" 1
77 1 6 TRP HZ2 1 82 GLN HB2 . . 4.200 3.477 3.001 3.819 . 0 0 "[ . 1 . 2]" 1
78 1 6 TRP HZ2 1 82 GLN HB3 . . 6.000 5.081 4.701 5.452 . 0 0 "[ . 1 . 2]" 1
79 1 6 TRP HZ2 1 82 GLN QG . . 6.000 4.227 2.795 5.012 . 0 0 "[ . 1 . 2]" 1
80 1 6 TRP HZ2 1 85 VAL HB . . 6.000 4.831 4.621 5.127 . 0 0 "[ . 1 . 2]" 1
81 1 6 TRP HZ2 1 85 VAL MG2 . . 6.000 4.044 3.804 4.551 . 0 0 "[ . 1 . 2]" 1
82 1 6 TRP HZ3 1 32 ILE HB . . 4.200 2.698 2.335 3.188 . 0 0 "[ . 1 . 2]" 1
83 1 6 TRP HZ3 1 32 ILE MD . . 6.000 2.463 2.069 2.886 . 0 0 "[ . 1 . 2]" 1
84 1 6 TRP HZ3 1 32 ILE MG . . 5.000 2.456 1.987 2.828 . 0 0 "[ . 1 . 2]" 1
85 1 6 TRP HZ3 1 81 LEU MD1 . . 6.000 3.504 2.910 3.918 . 0 0 "[ . 1 . 2]" 1
86 1 6 TRP O 1 32 ILE H . . 2.400 2.027 1.815 2.276 . 0 0 "[ . 1 . 2]" 1
87 1 6 TRP O 1 32 ILE N . . 3.300 2.981 2.793 3.184 . 0 0 "[ . 1 . 2]" 1
88 1 7 PHE H 1 7 PHE HB2 . . 3.000 2.895 2.748 2.988 . 0 0 "[ . 1 . 2]" 1
89 1 7 PHE H 1 7 PHE HB3 . . 3.000 2.155 2.073 2.271 . 0 0 "[ . 1 . 2]" 1
90 1 7 PHE H 1 8 PHE H . . 5.000 4.531 4.465 4.597 . 0 0 "[ . 1 . 2]" 1
91 1 7 PHE HA 1 7 PHE HB2 . . 3.000 2.437 2.397 2.497 . 0 0 "[ . 1 . 2]" 1
92 1 7 PHE HA 1 8 PHE H . . 2.500 2.239 2.201 2.313 . 0 0 "[ . 1 . 2]" 1
93 1 7 PHE HA 1 32 ILE H . . 3.000 2.926 2.726 3.007 0.007 5 0 "[ . 1 . 2]" 1
94 1 7 PHE HA 1 32 ILE HB . . 3.500 2.778 2.494 3.169 . 0 0 "[ . 1 . 2]" 1
95 1 7 PHE HA 1 32 ILE MG . . 5.000 3.401 3.035 3.983 . 0 0 "[ . 1 . 2]" 1
96 1 7 PHE HB2 1 8 PHE H . . 4.200 4.134 3.987 4.202 0.002 18 0 "[ . 1 . 2]" 1
97 1 7 PHE QD 1 8 PHE H . . 4.200 2.963 2.119 3.800 . 0 0 "[ . 1 . 2]" 1
98 1 7 PHE QD 1 9 LYS H . . 6.000 5.396 4.983 5.651 . 0 0 "[ . 1 . 2]" 1
99 1 7 PHE QD 1 32 ILE HB . . 6.000 3.584 2.817 4.139 . 0 0 "[ . 1 . 2]" 1
100 1 7 PHE QD 1 33 ARG HA . . 5.000 3.267 2.349 4.195 . 0 0 "[ . 1 . 2]" 1
101 1 7 PHE QE 1 9 LYS HA . . 5.000 3.992 3.338 4.578 . 0 0 "[ . 1 . 2]" 1
102 1 8 PHE H 1 8 PHE HB2 . . 3.000 2.304 2.155 2.496 . 0 0 "[ . 1 . 2]" 1
103 1 8 PHE H 1 9 LYS H . . 5.000 4.512 4.399 4.554 . 0 0 "[ . 1 . 2]" 1
104 1 8 PHE H 1 31 MET QB . . 6.000 4.852 4.496 5.014 . 0 0 "[ . 1 . 2]" 1
105 1 8 PHE H 1 32 ILE H . . 4.200 3.867 3.508 4.200 . 0 0 "[ . 1 . 2]" 1
106 1 8 PHE H 1 32 ILE HB . . 5.000 4.391 3.990 4.870 . 0 0 "[ . 1 . 2]" 1
107 1 8 PHE H 1 32 ILE MG . . 6.000 4.086 3.549 4.719 . 0 0 "[ . 1 . 2]" 1
108 1 8 PHE H 1 32 ILE O . . 2.400 1.996 1.802 2.286 . 0 0 "[ . 1 . 2]" 1
109 1 8 PHE H 1 33 ARG HA . . 3.500 2.871 2.562 3.193 . 0 0 "[ . 1 . 2]" 1
110 1 8 PHE H 1 33 ARG HB3 . . 5.000 3.843 3.289 4.207 . 0 0 "[ . 1 . 2]" 1
111 1 8 PHE HA 1 8 PHE HB3 . . 3.000 2.680 2.586 2.749 . 0 0 "[ . 1 . 2]" 1
112 1 8 PHE HA 1 9 LYS H . . 2.500 2.404 2.268 2.491 . 0 0 "[ . 1 . 2]" 1
113 1 8 PHE HA 1 9 LYS QD . . 5.000 3.741 3.053 4.149 . 0 0 "[ . 1 . 2]" 1
114 1 8 PHE HA 1 9 LYS QG . . 6.000 4.718 4.398 5.298 . 0 0 "[ . 1 . 2]" 1
115 1 8 PHE HB2 1 9 LYS H . . 4.200 4.004 3.844 4.189 . 0 0 "[ . 1 . 2]" 1
116 1 8 PHE HB3 1 9 LYS H . . 3.500 2.745 2.544 3.121 . 0 0 "[ . 1 . 2]" 1
117 1 8 PHE HB3 1 11 ILE MG . . 6.000 3.362 2.752 3.736 . 0 0 "[ . 1 . 2]" 1
118 1 8 PHE HB3 1 31 MET ME . . 6.000 4.640 4.104 4.852 . 0 0 "[ . 1 . 2]" 1
119 1 8 PHE QD 1 9 LYS H . . 6.000 3.550 2.951 4.041 . 0 0 "[ . 1 . 2]" 1
120 1 8 PHE QD 1 11 ILE MD . . 6.000 2.648 1.910 3.520 . 0 0 "[ . 1 . 2]" 1
121 1 8 PHE QD 1 11 ILE MG . . 6.000 3.956 3.494 4.479 . 0 0 "[ . 1 . 2]" 1
122 1 8 PHE QD 1 31 MET ME . . 6.000 3.120 2.189 3.924 . 0 0 "[ . 1 . 2]" 1
123 1 8 PHE QD 1 32 ILE H . . 6.000 3.571 3.023 4.880 . 0 0 "[ . 1 . 2]" 1
124 1 8 PHE N 1 32 ILE O . . 3.300 2.912 2.677 3.209 . 0 0 "[ . 1 . 2]" 1
125 1 9 LYS H 1 9 LYS QB . . 3.500 2.540 2.015 2.905 . 0 0 "[ . 1 . 2]" 1
126 1 9 LYS H 1 9 LYS QD . . 5.000 2.659 2.037 3.522 . 0 0 "[ . 1 . 2]" 1
127 1 9 LYS H 1 9 LYS QE . . 6.000 3.637 1.993 5.212 . 0 0 "[ . 1 . 2]" 1
128 1 9 LYS H 1 9 LYS QG . . 4.200 2.906 2.413 3.679 . 0 0 "[ . 1 . 2]" 1
129 1 9 LYS H 1 10 GLY H . . 5.000 4.508 4.471 4.558 . 0 0 "[ . 1 . 2]" 1
130 1 9 LYS HA 1 9 LYS QD . . 5.000 3.713 2.725 4.095 . 0 0 "[ . 1 . 2]" 1
131 1 9 LYS HA 1 9 LYS QE . . 5.000 4.270 3.203 4.515 . 0 0 "[ . 1 . 2]" 1
132 1 9 LYS HA 1 10 GLY H . . 3.000 2.476 2.294 2.813 . 0 0 "[ . 1 . 2]" 1
133 1 9 LYS HA 1 10 GLY QA . . 5.000 3.993 3.972 4.033 . 0 0 "[ . 1 . 2]" 1
134 1 9 LYS HA 1 11 ILE H . . 5.000 4.230 3.193 4.813 . 0 0 "[ . 1 . 2]" 1
135 1 9 LYS HA 1 33 ARG HA . . 6.000 4.973 4.423 5.545 . 0 0 "[ . 1 . 2]" 1
136 1 9 LYS QB 1 10 GLY H . . 3.500 2.566 1.952 2.910 . 0 0 "[ . 1 . 2]" 1
137 1 9 LYS QB 1 10 GLY QA . . 6.000 3.862 3.635 4.034 . 0 0 "[ . 1 . 2]" 1
138 1 9 LYS QD 1 10 GLY H . . 6.000 5.050 4.512 5.334 . 0 0 "[ . 1 . 2]" 1
139 1 9 LYS QG 1 10 GLY H . . 4.200 3.441 2.900 3.789 . 0 0 "[ . 1 . 2]" 1
140 1 9 LYS QG 1 10 GLY QA . . 6.000 4.109 3.547 4.845 . 0 0 "[ . 1 . 2]" 1
141 1 10 GLY H 1 11 ILE H . . 4.200 3.402 2.815 3.908 . 0 0 "[ . 1 . 2]" 1
142 1 10 GLY H 1 34 ASP H . . 6.000 4.974 4.318 5.465 . 0 0 "[ . 1 . 2]" 1
143 1 10 GLY H 1 34 ASP QB . . 6.000 4.655 3.911 5.330 . 0 0 "[ . 1 . 2]" 1
144 1 10 GLY QA 1 11 ILE HA . . 5.000 4.042 3.959 4.104 . 0 0 "[ . 1 . 2]" 1
145 1 11 ILE H 1 11 ILE HB . . 3.000 2.389 2.243 2.592 . 0 0 "[ . 1 . 2]" 1
146 1 11 ILE H 1 11 ILE HG12 . . 5.000 4.546 4.385 4.679 . 0 0 "[ . 1 . 2]" 1
147 1 11 ILE H 1 11 ILE HG13 . . 4.200 4.198 3.933 4.237 0.037 16 0 "[ . 1 . 2]" 1
148 1 11 ILE H 1 11 ILE MG . . 4.200 2.677 2.429 3.413 . 0 0 "[ . 1 . 2]" 1
149 1 11 ILE H 1 12 SER H . . 5.000 4.562 4.427 4.629 . 0 0 "[ . 1 . 2]" 1
150 1 11 ILE HA 1 11 ILE HB . . 3.000 2.711 2.628 2.930 . 0 0 "[ . 1 . 2]" 1
151 1 11 ILE HA 1 11 ILE HG12 . . 4.200 2.471 2.104 2.685 . 0 0 "[ . 1 . 2]" 1
152 1 11 ILE HA 1 11 ILE HG13 . . 4.200 2.429 2.212 2.859 . 0 0 "[ . 1 . 2]" 1
153 1 11 ILE HA 1 12 SER H . . 3.000 2.400 2.351 2.476 . 0 0 "[ . 1 . 2]" 1
154 1 11 ILE HA 1 12 SER HA . . 5.000 4.303 4.254 4.349 . 0 0 "[ . 1 . 2]" 1
155 1 11 ILE HA 1 15 ASP HB2 . . 5.000 4.183 3.728 4.400 . 0 0 "[ . 1 . 2]" 1
156 1 11 ILE HA 1 15 ASP HB3 . . 5.000 4.750 4.396 5.001 0.001 15 0 "[ . 1 . 2]" 1
157 1 11 ILE HB 1 12 SER H . . 4.200 4.169 4.093 4.204 0.004 15 0 "[ . 1 . 2]" 1
158 1 11 ILE MD 1 12 SER H . . 5.000 3.832 3.649 4.020 . 0 0 "[ . 1 . 2]" 1
159 1 11 ILE MD 1 15 ASP HB2 . . 6.000 3.718 2.685 4.543 . 0 0 "[ . 1 . 2]" 1
160 1 11 ILE MD 1 16 ALA H . . 6.000 3.839 3.331 4.475 . 0 0 "[ . 1 . 2]" 1
161 1 11 ILE MD 1 16 ALA HA . . 5.000 2.860 2.184 3.274 . 0 0 "[ . 1 . 2]" 1
162 1 11 ILE MD 1 16 ALA MB . . 5.000 2.876 2.180 3.189 . 0 0 "[ . 1 . 2]" 1
163 1 11 ILE MD 1 19 GLN HE21 . . 4.200 2.114 1.811 2.585 . 0 0 "[ . 1 . 2]" 1
164 1 11 ILE MD 1 19 GLN HE22 . . 4.200 2.392 1.953 2.995 . 0 0 "[ . 1 . 2]" 1
165 1 11 ILE MD 1 19 GLN HG3 . . 6.000 3.469 1.940 4.281 . 0 0 "[ . 1 . 2]" 1
166 1 11 ILE MD 1 31 MET ME . . 5.000 2.832 2.391 3.309 . 0 0 "[ . 1 . 2]" 1
167 1 11 ILE HG12 1 12 SER H . . 4.200 2.325 2.015 3.312 . 0 0 "[ . 1 . 2]" 1
168 1 11 ILE HG13 1 12 SER H . . 5.000 3.609 3.165 4.643 . 0 0 "[ . 1 . 2]" 1
169 1 11 ILE MG 1 12 SER H . . 4.200 2.803 2.179 3.180 . 0 0 "[ . 1 . 2]" 1
170 1 11 ILE MG 1 16 ALA H . . 5.000 3.410 3.057 3.830 . 0 0 "[ . 1 . 2]" 1
171 1 11 ILE MG 1 16 ALA HA . . 6.000 3.636 3.012 4.224 . 0 0 "[ . 1 . 2]" 1
172 1 11 ILE MG 1 16 ALA MB . . 4.200 2.259 1.930 2.635 . 0 0 "[ . 1 . 2]" 1
173 1 11 ILE MG 1 19 GLN HE21 . . 6.000 4.156 3.485 4.649 . 0 0 "[ . 1 . 2]" 1
174 1 11 ILE MG 1 19 GLN HE22 . . 6.000 4.811 4.509 4.932 . 0 0 "[ . 1 . 2]" 1
175 1 11 ILE MG 1 33 ARG HE . . 6.000 3.695 2.443 4.517 . 0 0 "[ . 1 . 2]" 1
176 1 12 SER H 1 12 SER HB2 . . 4.200 3.659 3.553 3.752 . 0 0 "[ . 1 . 2]" 1
177 1 12 SER H 1 12 SER HB3 . . 3.000 2.635 2.347 2.973 . 0 0 "[ . 1 . 2]" 1
178 1 12 SER H 1 15 ASP H . . 5.000 3.688 3.521 3.950 . 0 0 "[ . 1 . 2]" 1
179 1 12 SER H 1 15 ASP HB2 . . 3.000 2.260 1.983 2.643 . 0 0 "[ . 1 . 2]" 1
180 1 12 SER H 1 15 ASP HB3 . . 4.200 3.526 3.209 4.120 . 0 0 "[ . 1 . 2]" 1
181 1 12 SER H 1 16 ALA H . . 5.000 3.979 3.462 4.575 . 0 0 "[ . 1 . 2]" 1
182 1 12 SER HA 1 12 SER HB2 . . 3.000 2.380 2.328 2.511 . 0 0 "[ . 1 . 2]" 1
183 1 12 SER HA 1 12 SER HB3 . . 3.000 2.575 2.428 2.644 . 0 0 "[ . 1 . 2]" 1
184 1 12 SER HA 1 13 ARG H . . 3.000 2.525 2.388 2.759 . 0 0 "[ . 1 . 2]" 1
185 1 12 SER HA 1 13 ARG HB2 . . 5.000 4.629 4.439 4.784 . 0 0 "[ . 1 . 2]" 1
186 1 12 SER HA 1 13 ARG HB3 . . 6.000 4.936 4.709 5.119 . 0 0 "[ . 1 . 2]" 1
187 1 12 SER HB2 1 13 ARG H . . 3.000 2.574 2.024 2.875 . 0 0 "[ . 1 . 2]" 1
188 1 12 SER HB2 1 14 LYS H . . 5.000 2.962 2.659 3.177 . 0 0 "[ . 1 . 2]" 1
189 1 12 SER HB3 1 13 ARG H . . 4.200 3.951 3.570 4.153 . 0 0 "[ . 1 . 2]" 1
190 1 12 SER HB3 1 14 LYS H . . 6.000 4.238 4.156 4.420 . 0 0 "[ . 1 . 2]" 1
191 1 12 SER O 1 16 ALA H . . 2.400 2.017 1.821 2.404 0.004 14 0 "[ . 1 . 2]" 1
192 1 12 SER O 1 16 ALA N . . 3.300 2.894 2.666 3.200 . 0 0 "[ . 1 . 2]" 1
193 1 13 ARG H 1 13 ARG HB2 . . 3.000 2.567 2.353 2.821 . 0 0 "[ . 1 . 2]" 1
194 1 13 ARG H 1 13 ARG HB3 . . 3.000 2.435 2.274 2.644 . 0 0 "[ . 1 . 2]" 1
195 1 13 ARG H 1 13 ARG QD . . 6.000 4.211 3.811 4.547 . 0 0 "[ . 1 . 2]" 1
196 1 13 ARG H 1 13 ARG HG2 . . 5.000 4.365 4.312 4.401 . 0 0 "[ . 1 . 2]" 1
197 1 13 ARG H 1 13 ARG HG3 . . 5.000 4.594 4.506 4.677 . 0 0 "[ . 1 . 2]" 1
198 1 13 ARG H 1 14 LYS H . . 3.000 2.488 2.297 2.685 . 0 0 "[ . 1 . 2]" 1
199 1 13 ARG H 1 15 ASP H . . 5.000 4.042 3.767 4.608 . 0 0 "[ . 1 . 2]" 1
200 1 13 ARG HA 1 13 ARG HB2 . . 3.000 2.483 2.404 2.592 . 0 0 "[ . 1 . 2]" 1
201 1 13 ARG HA 1 13 ARG QD . . 5.000 3.701 3.390 3.927 . 0 0 "[ . 1 . 2]" 1
202 1 13 ARG HA 1 13 ARG HG2 . . 3.500 2.448 2.239 2.609 . 0 0 "[ . 1 . 2]" 1
203 1 13 ARG HA 1 13 ARG HG3 . . 4.200 3.453 3.269 3.601 . 0 0 "[ . 1 . 2]" 1
204 1 13 ARG HA 1 14 LYS H . . 3.500 3.533 3.511 3.568 0.068 9 0 "[ . 1 . 2]" 1
205 1 13 ARG HA 1 16 ALA H . . 4.200 3.402 3.121 3.716 . 0 0 "[ . 1 . 2]" 1
206 1 13 ARG HA 1 16 ALA MB . . 4.200 2.471 2.126 2.768 . 0 0 "[ . 1 . 2]" 1
207 1 13 ARG HA 1 17 GLU H . . 5.000 4.226 4.097 4.384 . 0 0 "[ . 1 . 2]" 1
208 1 13 ARG QD 1 14 LYS H . . 6.000 3.534 3.116 3.928 . 0 0 "[ . 1 . 2]" 1
209 1 13 ARG QD 1 14 LYS HA . . 4.200 3.015 2.578 3.450 . 0 0 "[ . 1 . 2]" 1
210 1 13 ARG HE 1 14 LYS H . . 6.000 5.479 4.527 6.003 0.003 14 0 "[ . 1 . 2]" 1
211 1 13 ARG HG3 1 14 LYS HA . . 6.000 5.694 5.412 5.968 . 0 0 "[ . 1 . 2]" 1
212 1 13 ARG O 1 17 GLU H . . 2.400 2.396 2.242 2.410 0.010 20 0 "[ . 1 . 2]" 1
213 1 13 ARG O 1 17 GLU N . . 3.300 3.142 2.910 3.222 . 0 0 "[ . 1 . 2]" 1
214 1 14 LYS H 1 14 LYS QB . . 3.500 2.207 2.121 2.337 . 0 0 "[ . 1 . 2]" 1
215 1 14 LYS H 1 14 LYS QG . . 3.500 2.785 2.463 3.069 . 0 0 "[ . 1 . 2]" 1
216 1 14 LYS H 1 15 ASP H . . 3.000 2.405 2.242 2.756 . 0 0 "[ . 1 . 2]" 1
217 1 14 LYS H 1 16 ALA H . . 5.000 3.793 3.484 4.315 . 0 0 "[ . 1 . 2]" 1
218 1 14 LYS HA 1 15 ASP H . . 3.500 3.571 3.519 3.640 0.140 13 0 "[ . 1 . 2]" 1
219 1 14 LYS HA 1 16 ALA H . . 5.000 4.293 3.919 4.850 . 0 0 "[ . 1 . 2]" 1
220 1 14 LYS HA 1 17 GLU H . . 3.500 3.287 3.116 3.496 . 0 0 "[ . 1 . 2]" 1
221 1 14 LYS HA 1 17 GLU HB2 . . 3.500 2.466 2.225 2.649 . 0 0 "[ . 1 . 2]" 1
222 1 14 LYS HA 1 17 GLU HB3 . . 5.000 4.013 3.715 4.293 . 0 0 "[ . 1 . 2]" 1
223 1 14 LYS QB 1 15 ASP H . . 4.200 2.836 2.285 3.043 . 0 0 "[ . 1 . 2]" 1
224 1 14 LYS QG 1 15 ASP H . . 5.000 4.358 4.060 4.506 . 0 0 "[ . 1 . 2]" 1
225 1 14 LYS O 1 18 ARG H . . 2.400 2.361 2.141 2.412 0.012 16 0 "[ . 1 . 2]" 1
226 1 14 LYS O 1 18 ARG N . . 3.300 3.052 2.794 3.307 0.007 10 0 "[ . 1 . 2]" 1
227 1 15 ASP H 1 15 ASP HB2 . . 3.000 2.185 2.137 2.315 . 0 0 "[ . 1 . 2]" 1
228 1 15 ASP H 1 16 ALA H . . 3.000 2.497 2.268 2.775 . 0 0 "[ . 1 . 2]" 1
229 1 15 ASP H 1 16 ALA MB . . 6.000 4.074 3.866 4.364 . 0 0 "[ . 1 . 2]" 1
230 1 15 ASP H 1 17 GLU H . . 4.200 3.824 3.626 4.188 . 0 0 "[ . 1 . 2]" 1
231 1 15 ASP HA 1 15 ASP HB3 . . 3.000 2.692 2.645 2.720 . 0 0 "[ . 1 . 2]" 1
232 1 15 ASP HA 1 16 ALA H . . 3.500 3.586 3.532 3.649 0.149 9 0 "[ . 1 . 2]" 1
233 1 15 ASP HA 1 17 GLU H . . 5.000 4.076 3.898 4.207 . 0 0 "[ . 1 . 2]" 1
234 1 15 ASP HA 1 18 ARG H . . 4.200 3.237 3.050 3.409 . 0 0 "[ . 1 . 2]" 1
235 1 15 ASP HA 1 18 ARG QB . . 4.200 2.604 2.240 3.686 . 0 0 "[ . 1 . 2]" 1
236 1 15 ASP HA 1 18 ARG QG . . 5.000 3.609 1.983 4.510 . 0 0 "[ . 1 . 2]" 1
237 1 15 ASP HB2 1 16 ALA H . . 3.000 2.815 2.444 3.017 0.017 10 0 "[ . 1 . 2]" 1
238 1 15 ASP HB2 1 16 ALA MB . . 6.000 4.068 3.963 4.182 . 0 0 "[ . 1 . 2]" 1
239 1 15 ASP HB2 1 17 GLU H . . 6.000 4.918 4.647 5.147 . 0 0 "[ . 1 . 2]" 1
240 1 15 ASP HB2 1 18 ARG H . . 6.000 5.340 5.084 5.641 . 0 0 "[ . 1 . 2]" 1
241 1 15 ASP HB3 1 16 ALA H . . 4.200 3.476 3.010 3.783 . 0 0 "[ . 1 . 2]" 1
242 1 15 ASP HB3 1 19 GLN HE21 . . 5.000 3.700 2.784 4.876 . 0 0 "[ . 1 . 2]" 1
243 1 15 ASP O 1 19 GLN H . . 2.400 2.145 1.849 2.401 0.001 6 0 "[ . 1 . 2]" 1
244 1 15 ASP O 1 19 GLN N . . 3.300 2.943 2.679 3.198 . 0 0 "[ . 1 . 2]" 1
245 1 16 ALA H 1 16 ALA MB . . 3.000 2.075 1.976 2.164 . 0 0 "[ . 1 . 2]" 1
246 1 16 ALA H 1 17 GLU H . . 3.000 2.492 2.356 2.720 . 0 0 "[ . 1 . 2]" 1
247 1 16 ALA H 1 18 ARG H . . 5.000 3.876 3.780 4.081 . 0 0 "[ . 1 . 2]" 1
248 1 16 ALA HA 1 17 GLU H . . 3.500 3.545 3.495 3.578 0.078 13 0 "[ . 1 . 2]" 1
249 1 16 ALA HA 1 19 GLN H . . 3.500 3.268 3.121 3.424 . 0 0 "[ . 1 . 2]" 1
250 1 16 ALA HA 1 19 GLN QB . . 4.200 2.629 2.299 3.053 . 0 0 "[ . 1 . 2]" 1
251 1 16 ALA HA 1 19 GLN HG2 . . 5.000 4.828 4.184 5.016 0.016 10 0 "[ . 1 . 2]" 1
252 1 16 ALA HA 1 20 LEU H . . 5.000 4.254 3.931 4.432 . 0 0 "[ . 1 . 2]" 1
253 1 16 ALA HA 1 20 LEU MD1 . . 6.000 4.410 4.047 4.737 . 0 0 "[ . 1 . 2]" 1
254 1 16 ALA HA 1 31 MET ME . . 5.000 2.465 2.029 3.025 . 0 0 "[ . 1 . 2]" 1
255 1 16 ALA MB 1 17 GLU H . . 4.200 2.888 2.740 3.080 . 0 0 "[ . 1 . 2]" 1
256 1 16 ALA MB 1 17 GLU HA . . 6.000 3.883 3.804 3.930 . 0 0 "[ . 1 . 2]" 1
257 1 16 ALA MB 1 18 ARG H . . 6.000 4.443 4.278 4.780 . 0 0 "[ . 1 . 2]" 1
258 1 16 ALA MB 1 19 GLN H . . 6.000 4.512 4.369 4.658 . 0 0 "[ . 1 . 2]" 1
259 1 16 ALA MB 1 20 LEU MD1 . . 6.000 3.262 3.032 3.521 . 0 0 "[ . 1 . 2]" 1
260 1 16 ALA MB 1 31 MET ME . . 5.000 2.774 2.405 3.206 . 0 0 "[ . 1 . 2]" 1
261 1 16 ALA MB 1 31 MET QG . . 6.000 3.592 3.024 3.897 . 0 0 "[ . 1 . 2]" 1
262 1 16 ALA MB 1 33 ARG QD . . 5.000 2.567 2.273 3.231 . 0 0 "[ . 1 . 2]" 1
263 1 16 ALA MB 1 33 ARG HE . . 4.200 3.120 2.708 3.502 . 0 0 "[ . 1 . 2]" 1
264 1 16 ALA MB 1 45 SER HB3 . . 6.000 3.768 3.311 4.168 . 0 0 "[ . 1 . 2]" 1
265 1 16 ALA O 1 20 LEU H . . 2.400 2.376 2.200 2.413 0.013 10 0 "[ . 1 . 2]" 1
266 1 16 ALA O 1 20 LEU N . . 3.300 3.210 3.051 3.303 0.003 20 0 "[ . 1 . 2]" 1
267 1 17 GLU H 1 17 GLU HB2 . . 3.000 2.172 2.145 2.224 . 0 0 "[ . 1 . 2]" 1
268 1 17 GLU H 1 17 GLU HB3 . . 4.200 3.459 3.440 3.498 . 0 0 "[ . 1 . 2]" 1
269 1 17 GLU H 1 17 GLU HG2 . . 4.200 3.666 3.361 4.114 . 0 0 "[ . 1 . 2]" 1
270 1 17 GLU H 1 17 GLU HG3 . . 3.500 3.095 2.934 3.303 . 0 0 "[ . 1 . 2]" 1
271 1 17 GLU H 1 18 ARG H . . 3.000 2.407 2.338 2.493 . 0 0 "[ . 1 . 2]" 1
272 1 17 GLU H 1 18 ARG QB . . 6.000 4.211 3.974 4.550 . 0 0 "[ . 1 . 2]" 1
273 1 17 GLU H 1 19 GLN H . . 5.000 3.883 3.650 4.155 . 0 0 "[ . 1 . 2]" 1
274 1 17 GLU HA 1 17 GLU HB3 . . 3.000 2.698 2.658 2.716 . 0 0 "[ . 1 . 2]" 1
275 1 17 GLU HA 1 17 GLU HG2 . . 3.000 2.137 2.062 2.551 . 0 0 "[ . 1 . 2]" 1
276 1 17 GLU HA 1 17 GLU HG3 . . 3.500 3.086 2.530 3.359 . 0 0 "[ . 1 . 2]" 1
277 1 17 GLU HA 1 18 ARG H . . 3.500 3.503 3.448 3.598 0.098 10 0 "[ . 1 . 2]" 1
278 1 17 GLU HA 1 20 LEU H . . 4.200 3.425 3.245 3.666 . 0 0 "[ . 1 . 2]" 1
279 1 17 GLU HA 1 20 LEU HB2 . . 4.200 2.835 2.600 3.195 . 0 0 "[ . 1 . 2]" 1
280 1 17 GLU HA 1 20 LEU MD1 . . 5.000 3.186 2.716 3.699 . 0 0 "[ . 1 . 2]" 1
281 1 17 GLU HA 1 57 VAL MG1 . . 5.000 2.770 2.352 3.094 . 0 0 "[ . 1 . 2]" 1
282 1 17 GLU HA 1 57 VAL MG2 . . 4.200 2.978 2.689 3.211 . 0 0 "[ . 1 . 2]" 1
283 1 17 GLU HB2 1 18 ARG H . . 3.500 3.236 2.892 3.404 . 0 0 "[ . 1 . 2]" 1
284 1 17 GLU HB2 1 18 ARG HA . . 5.000 4.751 4.670 4.803 . 0 0 "[ . 1 . 2]" 1
285 1 17 GLU HB2 1 59 HIS HE1 . . 6.000 4.853 4.253 5.735 . 0 0 "[ . 1 . 2]" 1
286 1 17 GLU HG2 1 57 VAL HB . . 5.000 2.646 2.083 3.180 . 0 0 "[ . 1 . 2]" 1
287 1 17 GLU HG2 1 57 VAL MG1 . . 5.000 2.557 2.025 2.989 . 0 0 "[ . 1 . 2]" 1
288 1 17 GLU HG2 1 57 VAL MG2 . . 5.000 3.051 2.412 3.506 . 0 0 "[ . 1 . 2]" 1
289 1 17 GLU HG2 1 59 HIS HE1 . . 4.200 2.759 2.007 4.153 . 0 0 "[ . 1 . 2]" 1
290 1 17 GLU HG3 1 57 VAL MG1 . . 6.000 3.835 3.127 4.336 . 0 0 "[ . 1 . 2]" 1
291 1 17 GLU HG3 1 59 HIS HE1 . . 4.200 2.895 2.045 3.942 . 0 0 "[ . 1 . 2]" 1
292 1 17 GLU O 1 21 LEU H . . 2.400 2.213 1.944 2.377 . 0 0 "[ . 1 . 2]" 1
293 1 17 GLU O 1 21 LEU N . . 3.300 3.136 2.861 3.301 0.001 8 0 "[ . 1 . 2]" 1
294 1 18 ARG H 1 18 ARG QB . . 3.500 2.204 2.072 2.480 . 0 0 "[ . 1 . 2]" 1
295 1 18 ARG H 1 19 GLN H . . 3.000 2.303 2.227 2.433 . 0 0 "[ . 1 . 2]" 1
296 1 18 ARG HA 1 18 ARG QD . . 5.000 3.284 2.442 4.297 . 0 0 "[ . 1 . 2]" 1
297 1 18 ARG HA 1 19 GLN H . . 3.500 3.535 3.502 3.604 0.104 16 0 "[ . 1 . 2]" 1
298 1 18 ARG HA 1 21 LEU H . . 4.200 3.407 3.170 3.695 . 0 0 "[ . 1 . 2]" 1
299 1 18 ARG HA 1 21 LEU HB2 . . 3.500 2.727 2.330 3.159 . 0 0 "[ . 1 . 2]" 1
300 1 18 ARG HA 1 21 LEU HB3 . . 5.000 4.219 3.816 4.680 . 0 0 "[ . 1 . 2]" 1
301 1 18 ARG HA 1 21 LEU MD1 . . 6.000 3.464 2.951 3.908 . 0 0 "[ . 1 . 2]" 1
302 1 19 GLN H 1 19 GLN QB . . 3.500 2.286 2.164 2.431 . 0 0 "[ . 1 . 2]" 1
303 1 19 GLN H 1 19 GLN QG . . 3.000 2.607 2.319 2.835 . 0 0 "[ . 1 . 2]" 1
304 1 19 GLN H 1 20 LEU H . . 3.000 2.419 2.287 2.725 . 0 0 "[ . 1 . 2]" 1
305 1 19 GLN HA 1 19 GLN HG2 . . 4.200 2.226 2.084 2.376 . 0 0 "[ . 1 . 2]" 1
306 1 19 GLN HA 1 20 LEU H . . 3.500 3.546 3.511 3.618 0.118 20 0 "[ . 1 . 2]" 1
307 1 19 GLN HA 1 22 ALA H . . 3.500 3.429 3.249 3.510 0.010 17 0 "[ . 1 . 2]" 1
308 1 19 GLN HA 1 22 ALA MB . . 5.000 2.205 2.006 2.462 . 0 0 "[ . 1 . 2]" 1
309 1 19 GLN QB 1 19 GLN HE21 . . 4.200 2.844 2.243 3.449 . 0 0 "[ . 1 . 2]" 1
310 1 19 GLN QB 1 19 GLN HE22 . . 5.000 3.627 3.232 3.950 . 0 0 "[ . 1 . 2]" 1
311 1 19 GLN QB 1 20 LEU H . . 4.200 2.897 2.618 3.011 . 0 0 "[ . 1 . 2]" 1
312 1 19 GLN QB 1 31 MET ME . . 5.000 2.384 2.043 2.670 . 0 0 "[ . 1 . 2]" 1
313 1 19 GLN HE21 1 31 MET ME . . 5.000 3.059 2.215 4.039 . 0 0 "[ . 1 . 2]" 1
314 1 19 GLN HE22 1 31 MET ME . . 5.000 3.647 3.212 4.159 . 0 0 "[ . 1 . 2]" 1
315 1 19 GLN HG2 1 20 LEU H . . 6.000 4.943 4.789 5.065 . 0 0 "[ . 1 . 2]" 1
316 1 19 GLN HG3 1 20 LEU H . . 5.000 4.702 4.406 4.962 . 0 0 "[ . 1 . 2]" 1
317 1 19 GLN HG3 1 31 MET ME . . 5.000 3.928 3.353 4.091 . 0 0 "[ . 1 . 2]" 1
318 1 20 LEU H 1 20 LEU HB2 . . 2.500 2.178 2.131 2.261 . 0 0 "[ . 1 . 2]" 1
319 1 20 LEU H 1 20 LEU MD1 . . 5.000 3.628 3.411 3.920 . 0 0 "[ . 1 . 2]" 1
320 1 20 LEU H 1 20 LEU HG . . 4.200 3.012 2.758 3.236 . 0 0 "[ . 1 . 2]" 1
321 1 20 LEU H 1 21 LEU H . . 3.000 2.411 2.217 2.659 . 0 0 "[ . 1 . 2]" 1
322 1 20 LEU H 1 22 ALA H . . 4.200 3.475 3.332 3.672 . 0 0 "[ . 1 . 2]" 1
323 1 20 LEU H 1 31 MET ME . . 6.000 3.952 3.564 4.388 . 0 0 "[ . 1 . 2]" 1
324 1 20 LEU HA 1 20 LEU HB3 . . 3.000 2.632 2.562 2.674 . 0 0 "[ . 1 . 2]" 1
325 1 20 LEU HA 1 20 LEU HG . . 3.500 2.665 2.481 2.782 . 0 0 "[ . 1 . 2]" 1
326 1 20 LEU HA 1 22 ALA H . . 5.000 3.810 3.700 3.998 . 0 0 "[ . 1 . 2]" 1
327 1 20 LEU HA 1 25 ASN HD21 . . 4.200 3.276 2.714 3.930 . 0 0 "[ . 1 . 2]" 1
328 1 20 LEU HA 1 25 ASN HD22 . . 4.200 3.974 3.393 4.204 0.004 9 0 "[ . 1 . 2]" 1
329 1 20 LEU HA 1 31 MET ME . . 6.000 4.368 3.968 4.796 . 0 0 "[ . 1 . 2]" 1
330 1 20 LEU HB2 1 20 LEU MD1 . . 3.500 2.201 2.047 2.357 . 0 0 "[ . 1 . 2]" 1
331 1 20 LEU HB2 1 21 LEU H . . 3.500 2.830 2.594 3.108 . 0 0 "[ . 1 . 2]" 1
332 1 20 LEU HB2 1 57 VAL MG2 . . 5.000 2.980 2.545 3.419 . 0 0 "[ . 1 . 2]" 1
333 1 20 LEU HB3 1 21 LEU H . . 4.200 3.435 3.139 3.731 . 0 0 "[ . 1 . 2]" 1
334 1 20 LEU HB3 1 57 VAL MG2 . . 6.000 3.001 2.090 3.478 . 0 0 "[ . 1 . 2]" 1
335 1 20 LEU MD1 1 30 PHE HA . . 6.000 3.686 3.081 4.178 . 0 0 "[ . 1 . 2]" 1
336 1 20 LEU MD1 1 31 MET H . . 6.000 3.768 3.355 4.191 . 0 0 "[ . 1 . 2]" 1
337 1 20 LEU MD1 1 31 MET QB . . 6.000 3.684 3.368 4.071 . 0 0 "[ . 1 . 2]" 1
338 1 20 LEU MD1 1 31 MET ME . . 6.000 3.117 2.580 3.655 . 0 0 "[ . 1 . 2]" 1
339 1 20 LEU MD1 1 31 MET QG . . 5.000 2.122 1.863 2.992 . 0 0 "[ . 1 . 2]" 1
340 1 20 LEU MD1 1 45 SER H . . 6.000 4.506 4.231 4.806 . 0 0 "[ . 1 . 2]" 1
341 1 20 LEU MD1 1 45 SER HA . . 6.000 4.088 3.776 4.426 . 0 0 "[ . 1 . 2]" 1
342 1 20 LEU MD1 1 45 SER HB2 . . 4.200 2.491 2.043 3.284 . 0 0 "[ . 1 . 2]" 1
343 1 20 LEU MD1 1 45 SER HB3 . . 5.000 2.676 2.427 3.061 . 0 0 "[ . 1 . 2]" 1
344 1 20 LEU MD1 1 46 VAL H . . 6.000 3.695 3.444 4.049 . 0 0 "[ . 1 . 2]" 1
345 1 20 LEU MD1 1 46 VAL HA . . 5.000 3.036 2.705 3.571 . 0 0 "[ . 1 . 2]" 1
346 1 20 LEU MD1 1 47 ARG HA . . 6.000 3.544 3.071 4.041 . 0 0 "[ . 1 . 2]" 1
347 1 20 LEU MD1 1 57 VAL HB . . 6.000 4.096 3.802 4.440 . 0 0 "[ . 1 . 2]" 1
348 1 20 LEU MD1 1 57 VAL MG1 . . 4.200 1.784 1.653 2.027 . 0 0 "[ . 1 . 2]" 1
349 1 20 LEU MD2 1 25 ASN HD21 . . 6.000 4.403 3.948 4.841 . 0 0 "[ . 1 . 2]" 1
350 1 20 LEU MD2 1 25 ASN HD22 . . 6.000 4.512 3.812 4.857 . 0 0 "[ . 1 . 2]" 1
351 1 20 LEU MD2 1 26 MET H . . 6.000 4.823 4.428 4.933 . 0 0 "[ . 1 . 2]" 1
352 1 20 LEU MD2 1 29 SER H . . 6.000 4.151 3.703 4.520 . 0 0 "[ . 1 . 2]" 1
353 1 20 LEU MD2 1 29 SER HA . . 6.000 4.307 3.828 4.740 . 0 0 "[ . 1 . 2]" 1
354 1 20 LEU MD2 1 30 PHE H . . 6.000 4.016 3.402 4.428 . 0 0 "[ . 1 . 2]" 1
355 1 20 LEU MD2 1 30 PHE HA . . 5.000 2.925 2.519 3.251 . 0 0 "[ . 1 . 2]" 1
356 1 20 LEU MD2 1 31 MET ME . . 6.000 3.388 2.794 3.620 . 0 0 "[ . 1 . 2]" 1
357 1 20 LEU MD2 1 103 CYS HA . . 6.000 3.902 3.424 4.362 . 0 0 "[ . 1 . 2]" 1
358 1 21 LEU H 1 21 LEU HB2 . . 3.000 2.216 2.132 2.301 . 0 0 "[ . 1 . 2]" 1
359 1 21 LEU H 1 21 LEU MD1 . . 5.000 3.514 3.371 3.755 . 0 0 "[ . 1 . 2]" 1
360 1 21 LEU H 1 22 ALA H . . 3.000 2.474 2.317 2.646 . 0 0 "[ . 1 . 2]" 1
361 1 21 LEU H 1 22 ALA MB . . 6.000 3.987 3.788 4.179 . 0 0 "[ . 1 . 2]" 1
362 1 21 LEU H 1 57 VAL MG2 . . 5.000 3.596 3.146 3.950 . 0 0 "[ . 1 . 2]" 1
363 1 21 LEU HA 1 21 LEU HB3 . . 3.000 2.596 2.535 2.655 . 0 0 "[ . 1 . 2]" 1
364 1 21 LEU HA 1 21 LEU MD2 . . 3.500 2.208 1.990 2.460 . 0 0 "[ . 1 . 2]" 1
365 1 21 LEU HA 1 22 ALA H . . 3.500 3.447 3.395 3.499 . 0 0 "[ . 1 . 2]" 1
366 1 21 LEU HA 1 47 ARG QD . . 6.000 3.215 2.435 4.699 . 0 0 "[ . 1 . 2]" 1
367 1 21 LEU HA 1 47 ARG HE . . 5.000 4.047 2.663 4.860 . 0 0 "[ . 1 . 2]" 1
368 1 21 LEU HB2 1 22 ALA H . . 3.500 3.382 3.253 3.488 . 0 0 "[ . 1 . 2]" 1
369 1 21 LEU HB2 1 57 VAL MG2 . . 6.000 4.003 3.697 4.289 . 0 0 "[ . 1 . 2]" 1
370 1 21 LEU HB3 1 21 LEU MD2 . . 3.500 2.261 2.136 2.363 . 0 0 "[ . 1 . 2]" 1
371 1 21 LEU HB3 1 22 ALA H . . 4.200 4.030 3.824 4.196 . 0 0 "[ . 1 . 2]" 1
372 1 21 LEU MD1 1 57 VAL H . . 6.000 4.680 4.359 4.850 . 0 0 "[ . 1 . 2]" 1
373 1 21 LEU MD2 1 47 ARG QD . . 6.000 3.363 2.641 3.966 . 0 0 "[ . 1 . 2]" 1
374 1 21 LEU MD2 1 47 ARG HE . . 5.000 3.395 2.088 4.003 . 0 0 "[ . 1 . 2]" 1
375 1 21 LEU MD2 1 55 ASP HB2 . . 5.000 2.900 2.433 3.229 . 0 0 "[ . 1 . 2]" 1
376 1 21 LEU MD2 1 55 ASP HB3 . . 5.000 2.307 1.871 3.312 . 0 0 "[ . 1 . 2]" 1
377 1 21 LEU MD2 1 56 THR H . . 6.000 3.911 3.361 4.811 . 0 0 "[ . 1 . 2]" 1
378 1 21 LEU MD2 1 56 THR HA . . 6.000 3.505 2.910 4.022 . 0 0 "[ . 1 . 2]" 1
379 1 22 ALA H 1 22 ALA MB . . 3.000 1.976 1.932 2.074 . 0 0 "[ . 1 . 2]" 1
380 1 22 ALA H 1 23 PRO HD2 . . 5.000 4.902 4.801 4.968 . 0 0 "[ . 1 . 2]" 1
381 1 22 ALA HA 1 23 PRO HB2 . . 6.000 5.631 5.561 5.712 . 0 0 "[ . 1 . 2]" 1
382 1 22 ALA HA 1 23 PRO HB3 . . 6.000 4.992 4.966 5.034 . 0 0 "[ . 1 . 2]" 1
383 1 22 ALA HA 1 23 PRO HD2 . . 3.000 2.833 2.676 3.000 . 0 0 "[ . 1 . 2]" 1
384 1 22 ALA HA 1 23 PRO HD3 . . 2.500 2.071 1.980 2.190 . 0 0 "[ . 1 . 2]" 1
385 1 22 ALA HA 1 23 PRO QG . . 5.000 4.007 3.924 4.109 . 0 0 "[ . 1 . 2]" 1
386 1 22 ALA MB 1 23 PRO QD . . 4.200 2.106 1.899 2.302 . 0 0 "[ . 1 . 2]" 1
387 1 22 ALA MB 1 23 PRO QG . . 6.000 3.801 3.603 3.980 . 0 0 "[ . 1 . 2]" 1
388 1 22 ALA MB 1 25 ASN H . . 6.000 3.515 2.927 4.389 . 0 0 "[ . 1 . 2]" 1
389 1 22 ALA MB 1 25 ASN HD21 . . 4.200 2.846 2.178 3.312 . 0 0 "[ . 1 . 2]" 1
390 1 22 ALA MB 1 25 ASN HD22 . . 5.000 3.756 3.253 4.045 . 0 0 "[ . 1 . 2]" 1
391 1 23 PRO HA 1 24 GLY H . . 3.500 3.001 2.151 3.490 . 0 0 "[ . 1 . 2]" 1
392 1 23 PRO HA 1 25 ASN H . . 4.200 3.716 3.113 4.184 . 0 0 "[ . 1 . 2]" 1
393 1 23 PRO HB2 1 24 GLY H . . 4.200 3.598 2.387 4.172 . 0 0 "[ . 1 . 2]" 1
394 1 24 GLY H 1 25 ASN H . . 3.500 2.713 2.170 3.430 . 0 0 "[ . 1 . 2]" 1
395 1 24 GLY HA3 1 25 ASN H . . 3.500 3.011 2.771 3.489 . 0 0 "[ . 1 . 2]" 1
396 1 25 ASN H 1 25 ASN HB2 . . 3.000 2.463 2.298 2.707 . 0 0 "[ . 1 . 2]" 1
397 1 25 ASN H 1 25 ASN HB3 . . 4.200 3.622 3.539 3.725 . 0 0 "[ . 1 . 2]" 1
398 1 25 ASN H 1 26 MET H . . 5.000 4.516 4.339 4.625 . 0 0 "[ . 1 . 2]" 1
399 1 25 ASN HA 1 25 ASN HB3 . . 3.000 2.579 2.502 2.719 . 0 0 "[ . 1 . 2]" 1
400 1 25 ASN HA 1 26 MET H . . 3.000 2.546 2.355 2.786 . 0 0 "[ . 1 . 2]" 1
401 1 25 ASN HA 1 26 MET QG . . 5.000 3.909 3.690 4.173 . 0 0 "[ . 1 . 2]" 1
402 1 25 ASN QB 1 26 MET HA . . 5.000 3.834 3.742 3.971 . 0 0 "[ . 1 . 2]" 1
403 1 25 ASN HB2 1 26 MET H . . 4.200 3.657 3.065 4.169 . 0 0 "[ . 1 . 2]" 1
404 1 25 ASN HB3 1 26 MET H . . 3.500 2.455 1.983 2.959 . 0 0 "[ . 1 . 2]" 1
405 1 25 ASN HD21 1 103 CYS HA . . 6.000 5.362 4.512 5.844 . 0 0 "[ . 1 . 2]" 1
406 1 25 ASN HD21 1 104 MET H . . 5.000 4.580 3.697 4.947 . 0 0 "[ . 1 . 2]" 1
407 1 25 ASN HD22 1 103 CYS HA . . 5.000 4.222 3.623 4.874 . 0 0 "[ . 1 . 2]" 1
408 1 25 ASN HD22 1 104 MET H . . 3.500 3.050 2.253 3.444 . 0 0 "[ . 1 . 2]" 1
409 1 25 ASN HD22 1 104 MET QB . . 5.000 3.682 3.028 4.445 . 0 0 "[ . 1 . 2]" 1
410 1 25 ASN HD22 1 104 MET QG . . 5.000 3.534 1.993 4.523 . 0 0 "[ . 1 . 2]" 1
411 1 26 MET H 1 26 MET QB . . 3.500 3.104 3.018 3.146 . 0 0 "[ . 1 . 2]" 1
412 1 26 MET H 1 26 MET QG . . 3.500 2.301 2.088 2.491 . 0 0 "[ . 1 . 2]" 1
413 1 26 MET H 1 27 LEU H . . 5.000 4.408 4.384 4.452 . 0 0 "[ . 1 . 2]" 1
414 1 26 MET H 1 29 SER H . . 5.000 3.621 3.359 3.973 . 0 0 "[ . 1 . 2]" 1
415 1 26 MET H 1 29 SER HA . . 5.000 4.799 4.625 5.001 0.001 14 0 "[ . 1 . 2]" 1
416 1 26 MET H 1 29 SER HB2 . . 3.500 3.254 2.846 3.507 0.007 5 0 "[ . 1 . 2]" 1
417 1 26 MET H 1 29 SER HB3 . . 4.200 3.958 3.677 4.200 . 0 0 "[ . 1 . 2]" 1
418 1 26 MET HA 1 27 LEU H . . 2.500 2.484 2.419 2.529 0.029 1 0 "[ . 1 . 2]" 1
419 1 26 MET HA 1 27 LEU QB . . 6.000 4.385 4.260 4.486 . 0 0 "[ . 1 . 2]" 1
420 1 26 MET HA 1 47 ARG HE . . 6.000 4.354 3.131 5.793 . 0 0 "[ . 1 . 2]" 1
421 1 26 MET QB 1 27 LEU H . . 3.500 2.526 2.421 2.654 . 0 0 "[ . 1 . 2]" 1
422 1 26 MET QG 1 27 LEU H . . 4.200 3.431 3.134 3.601 . 0 0 "[ . 1 . 2]" 1
423 1 26 MET QG 1 29 SER H . . 6.000 3.830 3.628 4.086 . 0 0 "[ . 1 . 2]" 1
424 1 26 MET O 1 29 SER H . . 2.400 1.942 1.816 2.204 . 0 0 "[ . 1 . 2]" 1
425 1 26 MET O 1 29 SER N . . 3.300 2.859 2.744 3.001 . 0 0 "[ . 1 . 2]" 1
426 1 27 LEU H 1 27 LEU QB . . 3.000 2.067 1.983 2.138 . 0 0 "[ . 1 . 2]" 1
427 1 27 LEU H 1 27 LEU MD2 . . 5.000 3.888 3.118 4.291 . 0 0 "[ . 1 . 2]" 1
428 1 27 LEU H 1 27 LEU HG . . 4.200 3.517 3.068 4.233 0.033 1 0 "[ . 1 . 2]" 1
429 1 27 LEU H 1 28 GLY H . . 5.000 4.504 4.321 4.614 . 0 0 "[ . 1 . 2]" 1
430 1 27 LEU HA 1 27 LEU MD2 . . 4.200 2.563 1.901 3.239 . 0 0 "[ . 1 . 2]" 1
431 1 27 LEU HA 1 28 GLY H . . 3.000 2.192 2.176 2.227 . 0 0 "[ . 1 . 2]" 1
432 1 27 LEU HA 1 28 GLY HA2 . . 5.000 4.390 4.327 4.450 . 0 0 "[ . 1 . 2]" 1
433 1 27 LEU HA 1 28 GLY HA3 . . 5.000 4.412 4.402 4.431 . 0 0 "[ . 1 . 2]" 1
434 1 27 LEU HA 1 29 SER H . . 4.200 3.451 3.265 3.589 . 0 0 "[ . 1 . 2]" 1
435 1 27 LEU HA 1 47 ARG H . . 6.000 4.803 4.609 5.165 . 0 0 "[ . 1 . 2]" 1
436 1 27 LEU HA 1 47 ARG HB3 . . 4.200 2.455 2.206 2.763 . 0 0 "[ . 1 . 2]" 1
437 1 27 LEU HA 1 47 ARG HE . . 5.000 4.078 3.217 5.002 0.002 13 0 "[ . 1 . 2]" 1
438 1 27 LEU QB 1 28 GLY H . . 5.000 3.605 3.282 3.826 . 0 0 "[ . 1 . 2]" 1
439 1 27 LEU QB 1 29 SER H . . 6.000 4.874 4.712 5.066 . 0 0 "[ . 1 . 2]" 1
440 1 27 LEU MD1 1 48 ASP H . . 6.000 4.807 4.338 4.949 . 0 0 "[ . 1 . 2]" 1
441 1 27 LEU MD1 1 48 ASP HA . . 6.000 3.680 2.168 4.404 . 0 0 "[ . 1 . 2]" 1
442 1 27 LEU MD1 1 49 TYR H . . 5.000 3.705 3.009 4.079 . 0 0 "[ . 1 . 2]" 1
443 1 27 LEU MD2 1 28 GLY H . . 6.000 3.371 2.250 3.936 . 0 0 "[ . 1 . 2]" 1
444 1 27 LEU MD2 1 28 GLY HA2 . . 6.000 4.640 3.633 4.874 . 0 0 "[ . 1 . 2]" 1
445 1 27 LEU MD2 1 47 ARG HE . . 6.000 4.036 2.268 4.937 . 0 0 "[ . 1 . 2]" 1
446 1 27 LEU MD2 1 48 ASP HA . . 5.000 2.146 1.905 2.496 . 0 0 "[ . 1 . 2]" 1
447 1 27 LEU MD2 1 49 TYR H . . 4.200 2.567 2.108 3.068 . 0 0 "[ . 1 . 2]" 1
448 1 27 LEU MD2 1 49 TYR HA . . 6.000 3.722 3.434 4.230 . 0 0 "[ . 1 . 2]" 1
449 1 27 LEU MD2 1 49 TYR HB2 . . 5.000 2.137 1.944 2.835 . 0 0 "[ . 1 . 2]" 1
450 1 27 LEU MD2 1 49 TYR HB3 . . 5.000 2.837 2.178 3.601 . 0 0 "[ . 1 . 2]" 1
451 1 27 LEU MD2 1 49 TYR QD . . 6.000 3.637 3.069 4.355 . 0 0 "[ . 1 . 2]" 1
452 1 27 LEU MD2 1 97 GLN HE21 . . 5.000 3.394 2.496 4.077 . 0 0 "[ . 1 . 2]" 1
453 1 27 LEU MD2 1 97 GLN HE22 . . 5.000 2.788 1.927 3.994 . 0 0 "[ . 1 . 2]" 1
454 1 27 LEU HG 1 48 ASP HA . . 5.000 3.880 3.156 5.001 0.001 15 0 "[ . 1 . 2]" 1
455 1 28 GLY H 1 29 SER H . . 3.500 2.354 1.952 2.717 . 0 0 "[ . 1 . 2]" 1
456 1 28 GLY H 1 46 VAL MG1 . . 6.000 3.691 3.480 4.071 . 0 0 "[ . 1 . 2]" 1
457 1 28 GLY H 1 47 ARG HB2 . . 5.000 3.934 2.946 4.353 . 0 0 "[ . 1 . 2]" 1
458 1 28 GLY H 1 47 ARG HB3 . . 6.000 2.349 1.946 2.723 . 0 0 "[ . 1 . 2]" 1
459 1 28 GLY H 1 48 ASP HA . . 6.000 4.769 4.295 5.430 . 0 0 "[ . 1 . 2]" 1
460 1 28 GLY HA2 1 46 VAL MG1 . . 5.000 3.709 3.450 3.957 . 0 0 "[ . 1 . 2]" 1
461 1 28 GLY HA2 1 99 LEU HA . . 6.000 4.060 3.523 4.479 . 0 0 "[ . 1 . 2]" 1
462 1 28 GLY HA2 1 100 SER H . . 5.000 3.636 3.135 4.330 . 0 0 "[ . 1 . 2]" 1
463 1 28 GLY HA3 1 99 LEU HA . . 6.000 4.932 4.175 5.359 . 0 0 "[ . 1 . 2]" 1
464 1 28 GLY HA3 1 100 SER H . . 4.200 3.688 2.997 4.207 0.007 17 0 "[ . 1 . 2]" 1
465 1 28 GLY O 1 100 SER H . . 2.400 2.204 1.986 2.378 . 0 0 "[ . 1 . 2]" 1
466 1 28 GLY O 1 100 SER N . . 3.300 3.165 2.968 3.307 0.007 17 0 "[ . 1 . 2]" 1
467 1 29 SER H 1 29 SER HB2 . . 3.000 2.488 2.212 2.631 . 0 0 "[ . 1 . 2]" 1
468 1 29 SER H 1 29 SER HB3 . . 4.200 3.559 3.491 3.597 . 0 0 "[ . 1 . 2]" 1
469 1 29 SER H 1 30 PHE H . . 5.000 4.591 4.544 4.626 . 0 0 "[ . 1 . 2]" 1
470 1 29 SER H 1 46 VAL MG1 . . 6.000 4.353 4.163 4.626 . 0 0 "[ . 1 . 2]" 1
471 1 29 SER H 1 47 ARG H . . 4.200 4.138 3.957 4.203 0.003 11 0 "[ . 1 . 2]" 1
472 1 29 SER H 1 47 ARG HB2 . . 5.000 3.927 3.350 4.257 . 0 0 "[ . 1 . 2]" 1
473 1 29 SER H 1 47 ARG HB3 . . 3.500 3.141 2.790 3.352 . 0 0 "[ . 1 . 2]" 1
474 1 29 SER H 1 47 ARG QD . . 6.000 4.256 3.587 5.226 . 0 0 "[ . 1 . 2]" 1
475 1 29 SER H 1 47 ARG QG . . 6.000 4.656 4.240 5.193 . 0 0 "[ . 1 . 2]" 1
476 1 29 SER HA 1 29 SER HB3 . . 3.000 2.502 2.439 2.663 . 0 0 "[ . 1 . 2]" 1
477 1 29 SER HA 1 30 PHE H . . 2.500 2.256 2.230 2.339 . 0 0 "[ . 1 . 2]" 1
478 1 29 SER HA 1 30 PHE HA . . 5.000 4.413 4.401 4.450 . 0 0 "[ . 1 . 2]" 1
479 1 29 SER HA 1 30 PHE HB3 . . 5.000 4.257 4.077 4.419 . 0 0 "[ . 1 . 2]" 1
480 1 29 SER HA 1 100 SER H . . 5.000 4.112 3.757 4.412 . 0 0 "[ . 1 . 2]" 1
481 1 29 SER HA 1 101 VAL H . . 3.500 2.931 2.699 3.133 . 0 0 "[ . 1 . 2]" 1
482 1 29 SER HA 1 101 VAL MG2 . . 5.000 2.958 2.686 3.324 . 0 0 "[ . 1 . 2]" 1
483 1 29 SER HA 1 102 PRO HA . . 5.000 4.275 4.145 4.384 . 0 0 "[ . 1 . 2]" 1
484 1 29 SER HA 1 103 CYS H . . 5.000 4.948 4.690 5.008 0.008 13 0 "[ . 1 . 2]" 1
485 1 29 SER HB2 1 30 PHE H . . 4.200 4.169 4.067 4.199 . 0 0 "[ . 1 . 2]" 1
486 1 29 SER HB2 1 47 ARG H . . 6.000 4.312 4.006 4.652 . 0 0 "[ . 1 . 2]" 1
487 1 29 SER HB3 1 30 PHE H . . 3.500 3.236 2.950 3.391 . 0 0 "[ . 1 . 2]" 1
488 1 29 SER O 1 47 ARG H . . 2.400 2.196 1.974 2.400 0.000 15 0 "[ . 1 . 2]" 1
489 1 29 SER O 1 47 ARG N . . 3.300 3.114 2.885 3.304 0.004 18 0 "[ . 1 . 2]" 1
490 1 30 PHE H 1 30 PHE HB3 . . 3.500 2.884 2.690 3.173 . 0 0 "[ . 1 . 2]" 1
491 1 30 PHE H 1 31 MET H . . 5.000 4.482 4.417 4.512 . 0 0 "[ . 1 . 2]" 1
492 1 30 PHE H 1 99 LEU MD2 . . 6.000 3.981 3.650 4.336 . 0 0 "[ . 1 . 2]" 1
493 1 30 PHE H 1 101 VAL H . . 4.200 4.165 4.056 4.213 0.013 20 0 "[ . 1 . 2]" 1
494 1 30 PHE H 1 101 VAL MG2 . . 6.000 4.359 4.183 4.603 . 0 0 "[ . 1 . 2]" 1
495 1 30 PHE H 1 101 VAL O . . 2.400 2.400 2.380 2.411 0.011 17 0 "[ . 1 . 2]" 1
496 1 30 PHE H 1 102 PRO HA . . 3.500 2.894 2.576 3.073 . 0 0 "[ . 1 . 2]" 1
497 1 30 PHE H 1 103 CYS H . . 4.200 3.479 3.250 3.670 . 0 0 "[ . 1 . 2]" 1
498 1 30 PHE HA 1 30 PHE HB2 . . 3.000 2.449 2.400 2.518 . 0 0 "[ . 1 . 2]" 1
499 1 30 PHE HA 1 30 PHE HB3 . . 3.000 2.591 2.512 2.653 . 0 0 "[ . 1 . 2]" 1
500 1 30 PHE HA 1 31 MET H . . 2.500 2.405 2.362 2.484 . 0 0 "[ . 1 . 2]" 1
501 1 30 PHE HA 1 31 MET HA . . 5.000 4.456 4.437 4.482 . 0 0 "[ . 1 . 2]" 1
502 1 30 PHE HA 1 31 MET QB . . 6.000 4.183 4.019 4.374 . 0 0 "[ . 1 . 2]" 1
503 1 30 PHE HA 1 31 MET QG . . 5.000 3.716 3.392 4.096 . 0 0 "[ . 1 . 2]" 1
504 1 30 PHE HA 1 45 SER H . . 5.000 4.940 4.830 5.006 0.006 17 0 "[ . 1 . 2]" 1
505 1 30 PHE HA 1 46 VAL HA . . 2.500 2.167 2.054 2.251 . 0 0 "[ . 1 . 2]" 1
506 1 30 PHE HA 1 46 VAL HB . . 5.000 4.736 4.537 4.950 . 0 0 "[ . 1 . 2]" 1
507 1 30 PHE HA 1 46 VAL MG2 . . 5.000 2.924 2.554 3.302 . 0 0 "[ . 1 . 2]" 1
508 1 30 PHE HA 1 47 ARG H . . 3.500 3.502 3.466 3.518 0.018 17 0 "[ . 1 . 2]" 1
509 1 30 PHE HA 1 99 LEU MD2 . . 6.000 3.890 3.761 4.128 . 0 0 "[ . 1 . 2]" 1
510 1 30 PHE QB 1 46 VAL MG2 . . 4.200 2.031 1.796 2.286 . 0 0 "[ . 1 . 2]" 1
511 1 30 PHE QB 1 100 SER H . . 6.000 4.266 4.071 4.587 . 0 0 "[ . 1 . 2]" 1
512 1 30 PHE HB2 1 31 MET H . . 3.000 2.780 2.640 2.883 . 0 0 "[ . 1 . 2]" 1
513 1 30 PHE HB2 1 46 VAL HA . . 4.200 3.583 3.178 3.791 . 0 0 "[ . 1 . 2]" 1
514 1 30 PHE HB3 1 31 MET H . . 4.200 4.067 3.947 4.155 . 0 0 "[ . 1 . 2]" 1
515 1 30 PHE QD 1 31 MET H . . 6.000 3.247 2.831 3.638 . 0 0 "[ . 1 . 2]" 1
516 1 30 PHE N 1 101 VAL O . . 3.300 3.289 3.264 3.306 0.006 17 0 "[ . 1 . 2]" 1
517 1 30 PHE O 1 103 CYS H . . 2.400 2.040 1.849 2.365 . 0 0 "[ . 1 . 2]" 1
518 1 30 PHE O 1 103 CYS N . . 3.300 2.873 2.593 3.160 . 0 0 "[ . 1 . 2]" 1
519 1 31 MET H 1 31 MET QB . . 3.500 3.146 3.083 3.224 . 0 0 "[ . 1 . 2]" 1
520 1 31 MET H 1 31 MET QG . . 4.200 2.380 2.151 2.521 . 0 0 "[ . 1 . 2]" 1
521 1 31 MET H 1 32 ILE H . . 5.000 4.361 4.241 4.417 . 0 0 "[ . 1 . 2]" 1
522 1 31 MET H 1 44 LEU HA . . 5.000 4.921 4.794 5.003 0.003 13 0 "[ . 1 . 2]" 1
523 1 31 MET H 1 45 SER H . . 3.500 3.017 2.884 3.067 . 0 0 "[ . 1 . 2]" 1
524 1 31 MET H 1 45 SER HB2 . . 4.200 3.747 3.456 4.065 . 0 0 "[ . 1 . 2]" 1
525 1 31 MET H 1 45 SER O . . 2.400 1.857 1.792 2.095 . 0 0 "[ . 1 . 2]" 1
526 1 31 MET H 1 46 VAL HA . . 3.500 3.422 3.360 3.501 0.001 19 0 "[ . 1 . 2]" 1
527 1 31 MET H 1 46 VAL MG2 . . 6.000 3.076 2.671 3.534 . 0 0 "[ . 1 . 2]" 1
528 1 31 MET HA 1 32 ILE H . . 2.500 2.369 2.276 2.491 . 0 0 "[ . 1 . 2]" 1
529 1 31 MET HA 1 45 SER H . . 5.000 4.932 4.815 5.004 0.004 20 0 "[ . 1 . 2]" 1
530 1 31 MET HA 1 103 CYS H . . 5.000 3.418 3.162 3.662 . 0 0 "[ . 1 . 2]" 1
531 1 31 MET QB 1 32 ILE H . . 4.200 2.774 2.490 3.085 . 0 0 "[ . 1 . 2]" 1
532 1 31 MET QB 1 45 SER H . . 6.000 4.727 4.574 4.946 . 0 0 "[ . 1 . 2]" 1
533 1 31 MET ME 1 103 CYS HA . . 6.000 4.739 4.507 4.877 . 0 0 "[ . 1 . 2]" 1
534 1 31 MET ME 1 103 CYS HB3 . . 6.000 3.360 2.223 4.033 . 0 0 "[ . 1 . 2]" 1
535 1 31 MET QG 1 32 ILE H . . 5.000 3.894 3.607 4.326 . 0 0 "[ . 1 . 2]" 1
536 1 31 MET QG 1 45 SER H . . 5.000 2.851 2.602 3.214 . 0 0 "[ . 1 . 2]" 1
537 1 31 MET N 1 45 SER O . . 3.300 2.767 2.694 2.886 . 0 0 "[ . 1 . 2]" 1
538 1 31 MET O 1 45 SER H . . 2.400 1.915 1.795 2.045 . 0 0 "[ . 1 . 2]" 1
539 1 31 MET O 1 45 SER N . . 3.300 2.867 2.738 2.977 . 0 0 "[ . 1 . 2]" 1
540 1 32 ILE H 1 32 ILE HB . . 3.000 2.522 2.388 2.629 . 0 0 "[ . 1 . 2]" 1
541 1 32 ILE H 1 32 ILE MD . . 5.000 3.871 3.691 4.044 . 0 0 "[ . 1 . 2]" 1
542 1 32 ILE H 1 32 ILE HG12 . . 5.000 4.290 4.117 4.471 . 0 0 "[ . 1 . 2]" 1
543 1 32 ILE H 1 32 ILE HG13 . . 5.000 3.112 2.822 3.388 . 0 0 "[ . 1 . 2]" 1
544 1 32 ILE H 1 33 ARG H . . 5.000 4.437 4.321 4.524 . 0 0 "[ . 1 . 2]" 1
545 1 32 ILE HA 1 32 ILE HB . . 3.000 3.010 2.991 3.020 0.020 5 0 "[ . 1 . 2]" 1
546 1 32 ILE HA 1 32 ILE HG12 . . 3.500 2.611 2.479 2.711 . 0 0 "[ . 1 . 2]" 1
547 1 32 ILE HA 1 32 ILE HG13 . . 4.200 2.689 2.570 2.787 . 0 0 "[ . 1 . 2]" 1
548 1 32 ILE HA 1 33 ARG H . . 2.500 2.270 2.196 2.352 . 0 0 "[ . 1 . 2]" 1
549 1 32 ILE HA 1 33 ARG HA . . 5.000 4.385 4.335 4.436 . 0 0 "[ . 1 . 2]" 1
550 1 32 ILE HA 1 43 SER H . . 5.000 4.928 4.709 4.999 . 0 0 "[ . 1 . 2]" 1
551 1 32 ILE HA 1 44 LEU HA . . 2.500 2.418 2.263 2.501 0.001 3 0 "[ . 1 . 2]" 1
552 1 32 ILE HA 1 44 LEU MD1 . . 6.000 2.645 2.369 2.933 . 0 0 "[ . 1 . 2]" 1
553 1 32 ILE HA 1 45 SER H . . 3.500 3.340 3.204 3.446 . 0 0 "[ . 1 . 2]" 1
554 1 32 ILE MD 1 44 LEU HA . . 6.000 4.647 4.459 4.882 . 0 0 "[ . 1 . 2]" 1
555 1 32 ILE MD 1 44 LEU MD1 . . 5.000 2.778 2.506 2.928 . 0 0 "[ . 1 . 2]" 1
556 1 32 ILE MD 1 62 ILE MD . . 6.000 3.393 3.012 3.924 . 0 0 "[ . 1 . 2]" 1
557 1 32 ILE MD 1 81 LEU HA . . 6.000 4.764 4.441 4.939 . 0 0 "[ . 1 . 2]" 1
558 1 32 ILE MD 1 81 LEU MD1 . . 6.000 3.585 3.026 3.918 . 0 0 "[ . 1 . 2]" 1
559 1 32 ILE MD 1 81 LEU MD2 . . 5.000 2.818 2.378 3.078 . 0 0 "[ . 1 . 2]" 1
560 1 32 ILE MD 1 85 VAL HA . . 6.000 4.180 3.613 4.516 . 0 0 "[ . 1 . 2]" 1
561 1 32 ILE MD 1 85 VAL MG1 . . 6.000 3.528 3.243 3.751 . 0 0 "[ . 1 . 2]" 1
562 1 32 ILE MD 1 85 VAL MG2 . . 4.200 1.986 1.783 2.158 . 0 0 "[ . 1 . 2]" 1
563 1 32 ILE HG12 1 32 ILE MG . . 3.500 2.346 2.259 2.430 . 0 0 "[ . 1 . 2]" 1
564 1 32 ILE HG12 1 44 LEU HA . . 3.500 3.076 2.835 3.395 . 0 0 "[ . 1 . 2]" 1
565 1 32 ILE HG12 1 45 SER H . . 6.000 4.296 4.012 4.581 . 0 0 "[ . 1 . 2]" 1
566 1 32 ILE HG13 1 44 LEU HA . . 4.200 3.805 3.558 3.960 . 0 0 "[ . 1 . 2]" 1
567 1 32 ILE HG13 1 45 SER H . . 6.000 4.094 3.934 4.234 . 0 0 "[ . 1 . 2]" 1
568 1 32 ILE HG13 1 62 ILE MD . . 6.000 4.402 4.147 4.695 . 0 0 "[ . 1 . 2]" 1
569 1 32 ILE MG 1 33 ARG H . . 3.500 2.257 1.958 2.716 . 0 0 "[ . 1 . 2]" 1
570 1 32 ILE MG 1 33 ARG HA . . 5.000 3.312 3.014 3.552 . 0 0 "[ . 1 . 2]" 1
571 1 32 ILE MG 1 42 TYR HB2 . . 6.000 4.678 4.317 4.942 . 0 0 "[ . 1 . 2]" 1
572 1 32 ILE MG 1 42 TYR HB3 . . 5.000 3.341 2.998 3.625 . 0 0 "[ . 1 . 2]" 1
573 1 32 ILE MG 1 42 TYR QD . . 6.000 2.478 2.246 3.376 . 0 0 "[ . 1 . 2]" 1
574 1 32 ILE MG 1 42 TYR QE . . 6.000 3.380 2.968 4.172 . 0 0 "[ . 1 . 2]" 1
575 1 32 ILE MG 1 43 SER H . . 5.000 3.648 3.337 3.845 . 0 0 "[ . 1 . 2]" 1
576 1 32 ILE MG 1 44 LEU HA . . 6.000 3.554 3.042 3.848 . 0 0 "[ . 1 . 2]" 1
577 1 32 ILE MG 1 81 LEU MD1 . . 5.000 2.916 2.270 3.264 . 0 0 "[ . 1 . 2]" 1
578 1 32 ILE MG 1 81 LEU MD2 . . 6.000 3.135 2.660 3.577 . 0 0 "[ . 1 . 2]" 1
579 1 33 ARG H 1 33 ARG HB2 . . 4.200 3.900 3.751 3.981 . 0 0 "[ . 1 . 2]" 1
580 1 33 ARG H 1 33 ARG HB3 . . 4.200 3.329 3.132 3.543 . 0 0 "[ . 1 . 2]" 1
581 1 33 ARG H 1 33 ARG QG . . 4.200 2.278 1.958 2.495 . 0 0 "[ . 1 . 2]" 1
582 1 33 ARG H 1 34 ASP H . . 5.000 4.363 4.237 4.431 . 0 0 "[ . 1 . 2]" 1
583 1 33 ARG H 1 43 SER H . . 3.500 3.162 2.963 3.324 . 0 0 "[ . 1 . 2]" 1
584 1 33 ARG H 1 43 SER O . . 2.400 2.149 1.939 2.348 . 0 0 "[ . 1 . 2]" 1
585 1 33 ARG H 1 44 LEU HA . . 3.500 3.359 3.187 3.504 0.004 11 0 "[ . 1 . 2]" 1
586 1 33 ARG HA 1 33 ARG HB2 . . 3.000 2.489 2.412 2.648 . 0 0 "[ . 1 . 2]" 1
587 1 33 ARG HA 1 33 ARG HB3 . . 3.000 2.488 2.355 2.570 . 0 0 "[ . 1 . 2]" 1
588 1 33 ARG HA 1 34 ASP H . . 3.000 2.423 2.302 2.660 . 0 0 "[ . 1 . 2]" 1
589 1 33 ARG HA 1 34 ASP QB . . 6.000 4.160 4.030 4.802 . 0 0 "[ . 1 . 2]" 1
590 1 33 ARG HA 1 43 SER H . . 5.000 4.949 4.833 5.004 0.004 19 0 "[ . 1 . 2]" 1
591 1 33 ARG HB2 1 34 ASP H . . 3.500 2.731 2.194 3.063 . 0 0 "[ . 1 . 2]" 1
592 1 33 ARG HB2 1 43 SER H . . 6.000 5.310 5.042 5.564 . 0 0 "[ . 1 . 2]" 1
593 1 33 ARG HB3 1 34 ASP H . . 4.200 3.974 3.512 4.191 . 0 0 "[ . 1 . 2]" 1
594 1 33 ARG HE 1 43 SER HB2 . . 4.200 3.845 3.206 4.206 0.006 11 0 "[ . 1 . 2]" 1
595 1 33 ARG QG 1 34 ASP H . . 5.000 3.698 3.220 4.066 . 0 0 "[ . 1 . 2]" 1
596 1 33 ARG QG 1 43 SER H . . 5.000 3.223 2.942 3.565 . 0 0 "[ . 1 . 2]" 1
597 1 33 ARG QG 1 43 SER HB2 . . 5.000 2.511 2.102 3.043 . 0 0 "[ . 1 . 2]" 1
598 1 33 ARG QG 1 43 SER HB3 . . 6.000 3.931 3.505 4.276 . 0 0 "[ . 1 . 2]" 1
599 1 33 ARG N 1 43 SER O . . 3.300 3.071 2.855 3.215 . 0 0 "[ . 1 . 2]" 1
600 1 33 ARG O 1 43 SER H . . 2.400 1.879 1.801 1.953 . 0 0 "[ . 1 . 2]" 1
601 1 33 ARG O 1 43 SER N . . 3.300 2.847 2.726 2.950 . 0 0 "[ . 1 . 2]" 1
602 1 34 ASP H 1 34 ASP QB . . 3.500 2.290 2.061 2.757 . 0 0 "[ . 1 . 2]" 1
603 1 34 ASP H 1 35 SER H . . 5.000 4.596 4.536 4.639 . 0 0 "[ . 1 . 2]" 1
604 1 34 ASP HA 1 35 SER H . . 2.500 2.448 2.366 2.502 0.002 5 0 "[ . 1 . 2]" 1
605 1 34 ASP HA 1 42 TYR HA . . 2.500 2.287 2.039 2.415 . 0 0 "[ . 1 . 2]" 1
606 1 34 ASP HA 1 42 TYR QD . . 4.200 3.229 2.061 3.628 . 0 0 "[ . 1 . 2]" 1
607 1 34 ASP HA 1 42 TYR QE . . 6.000 4.105 3.552 4.462 . 0 0 "[ . 1 . 2]" 1
608 1 34 ASP HA 1 43 SER H . . 3.500 3.237 2.882 3.374 . 0 0 "[ . 1 . 2]" 1
609 1 34 ASP QB 1 35 SER H . . 4.200 3.145 2.610 3.592 . 0 0 "[ . 1 . 2]" 1
610 1 34 ASP QB 1 42 TYR QE . . 6.000 3.537 2.601 4.758 . 0 0 "[ . 1 . 2]" 1
611 1 35 SER H 1 35 SER HB2 . . 3.000 2.503 2.180 2.945 . 0 0 "[ . 1 . 2]" 1
612 1 35 SER H 1 35 SER HB3 . . 3.000 2.483 2.122 2.813 . 0 0 "[ . 1 . 2]" 1
613 1 35 SER H 1 36 GLU H . . 5.000 4.631 4.530 4.664 . 0 0 "[ . 1 . 2]" 1
614 1 35 SER H 1 41 SER H . . 4.200 3.948 3.781 4.160 . 0 0 "[ . 1 . 2]" 1
615 1 35 SER H 1 41 SER HB3 . . 6.000 5.114 4.900 5.418 . 0 0 "[ . 1 . 2]" 1
616 1 35 SER H 1 41 SER O . . 2.400 1.953 1.807 2.233 . 0 0 "[ . 1 . 2]" 1
617 1 35 SER H 1 42 TYR HA . . 3.500 2.788 2.643 3.159 . 0 0 "[ . 1 . 2]" 1
618 1 35 SER H 1 42 TYR HB3 . . 6.000 5.459 5.283 5.787 . 0 0 "[ . 1 . 2]" 1
619 1 35 SER H 1 42 TYR QD . . 5.000 4.636 4.203 4.835 . 0 0 "[ . 1 . 2]" 1
620 1 35 SER H 1 43 SER H . . 5.000 4.424 4.035 4.844 . 0 0 "[ . 1 . 2]" 1
621 1 35 SER HA 1 35 SER HB2 . . 3.000 2.488 2.309 2.650 . 0 0 "[ . 1 . 2]" 1
622 1 35 SER HA 1 36 GLU H . . 3.000 2.405 2.226 2.609 . 0 0 "[ . 1 . 2]" 1
623 1 35 SER HA 1 37 THR H . . 5.000 4.192 3.570 4.979 . 0 0 "[ . 1 . 2]" 1
624 1 35 SER HA 1 43 SER H . . 6.000 5.155 4.409 5.958 . 0 0 "[ . 1 . 2]" 1
625 1 35 SER HB2 1 36 GLU H . . 4.200 4.013 3.661 4.210 0.010 11 0 "[ . 1 . 2]" 1
626 1 35 SER HB2 1 37 THR H . . 6.000 4.921 4.067 5.919 . 0 0 "[ . 1 . 2]" 1
627 1 35 SER HB2 1 38 THR H . . 5.000 4.288 3.729 4.796 . 0 0 "[ . 1 . 2]" 1
628 1 35 SER HB3 1 36 GLU H . . 5.000 3.828 3.094 4.498 . 0 0 "[ . 1 . 2]" 1
629 1 35 SER HB3 1 37 THR H . . 5.000 4.424 3.654 4.977 . 0 0 "[ . 1 . 2]" 1
630 1 35 SER HB3 1 38 THR H . . 4.200 3.735 3.071 4.139 . 0 0 "[ . 1 . 2]" 1
631 1 35 SER HB3 1 41 SER H . . 4.200 3.022 2.802 3.420 . 0 0 "[ . 1 . 2]" 1
632 1 35 SER HB3 1 42 TYR HA . . 5.000 4.676 4.091 4.956 . 0 0 "[ . 1 . 2]" 1
633 1 35 SER N 1 41 SER O . . 3.300 2.898 2.724 3.131 . 0 0 "[ . 1 . 2]" 1
634 1 36 GLU H 1 36 GLU HB2 . . 3.500 2.907 2.212 3.575 0.075 11 0 "[ . 1 . 2]" 1
635 1 36 GLU H 1 36 GLU HB3 . . 4.200 3.112 2.313 3.600 . 0 0 "[ . 1 . 2]" 1
636 1 36 GLU H 1 36 GLU QG . . 4.200 2.906 1.848 3.818 . 0 0 "[ . 1 . 2]" 1
637 1 36 GLU H 1 37 THR H . . 3.500 2.191 1.922 2.401 . 0 0 "[ . 1 . 2]" 1
638 1 36 GLU H 1 37 THR MG . . 6.000 3.843 3.286 4.447 . 0 0 "[ . 1 . 2]" 1
639 1 36 GLU QB 1 37 THR H . . 4.200 3.039 2.294 3.807 . 0 0 "[ . 1 . 2]" 1
640 1 36 GLU QG 1 37 THR H . . 5.000 3.507 2.197 4.511 . 0 0 "[ . 1 . 2]" 1
641 1 37 THR H 1 37 THR HB . . 4.200 3.546 3.484 3.664 . 0 0 "[ . 1 . 2]" 1
642 1 37 THR H 1 37 THR MG . . 4.200 2.438 2.091 2.993 . 0 0 "[ . 1 . 2]" 1
643 1 37 THR H 1 38 THR H . . 3.000 2.474 2.225 3.021 0.021 3 0 "[ . 1 . 2]" 1
644 1 37 THR H 1 38 THR HB . . 6.000 4.609 4.368 5.113 . 0 0 "[ . 1 . 2]" 1
645 1 37 THR HA 1 37 THR HB . . 3.000 2.544 2.410 2.646 . 0 0 "[ . 1 . 2]" 1
646 1 37 THR HA 1 39 LYS H . . 5.000 4.335 4.115 4.952 . 0 0 "[ . 1 . 2]" 1
647 1 37 THR HB 1 38 THR H . . 4.200 3.390 2.471 4.065 . 0 0 "[ . 1 . 2]" 1
648 1 38 THR H 1 38 THR HB . . 3.000 2.318 2.233 2.544 . 0 0 "[ . 1 . 2]" 1
649 1 38 THR H 1 39 LYS H . . 5.000 3.739 3.526 4.143 . 0 0 "[ . 1 . 2]" 1
650 1 38 THR H 1 39 LYS QG . . 6.000 5.082 4.454 5.403 . 0 0 "[ . 1 . 2]" 1
651 1 38 THR HA 1 39 LYS H . . 2.500 2.454 2.257 2.502 0.002 8 0 "[ . 1 . 2]" 1
652 1 38 THR HA 1 39 LYS QB . . 6.000 4.493 4.160 4.761 . 0 0 "[ . 1 . 2]" 1
653 1 38 THR HB 1 39 LYS H . . 5.000 4.606 4.560 4.641 . 0 0 "[ . 1 . 2]" 1
654 1 38 THR MG 1 39 LYS H . . 5.000 3.893 3.614 4.036 . 0 0 "[ . 1 . 2]" 1
655 1 38 THR MG 1 41 SER H . . 5.000 3.646 3.422 3.805 . 0 0 "[ . 1 . 2]" 1
656 1 38 THR O 1 41 SER H . . 2.400 2.360 2.271 2.398 . 0 0 "[ . 1 . 2]" 1
657 1 38 THR O 1 41 SER N . . 3.300 3.252 3.180 3.300 0.000 2 0 "[ . 1 . 2]" 1
658 1 39 LYS H 1 39 LYS QB . . 3.500 2.341 2.125 2.569 . 0 0 "[ . 1 . 2]" 1
659 1 39 LYS H 1 39 LYS QD . . 6.000 4.230 3.997 4.556 . 0 0 "[ . 1 . 2]" 1
660 1 39 LYS H 1 39 LYS QG . . 3.500 2.416 2.059 2.835 . 0 0 "[ . 1 . 2]" 1
661 1 39 LYS H 1 40 GLY H . . 5.000 4.664 4.632 4.675 . 0 0 "[ . 1 . 2]" 1
662 1 39 LYS HA 1 40 GLY H . . 2.500 2.337 2.237 2.428 . 0 0 "[ . 1 . 2]" 1
663 1 39 LYS HA 1 40 GLY HA2 . . 5.000 4.534 4.467 4.588 . 0 0 "[ . 1 . 2]" 1
664 1 39 LYS HA 1 40 GLY HA3 . . 5.000 4.474 4.422 4.524 . 0 0 "[ . 1 . 2]" 1
665 1 39 LYS HA 1 41 SER H . . 3.500 3.136 3.043 3.255 . 0 0 "[ . 1 . 2]" 1
666 1 39 LYS QB 1 40 GLY H . . 4.200 2.813 2.597 3.158 . 0 0 "[ . 1 . 2]" 1
667 1 39 LYS QB 1 41 SER H . . 6.000 4.516 4.382 4.713 . 0 0 "[ . 1 . 2]" 1
668 1 39 LYS QD 1 40 GLY H . . 5.000 3.850 2.977 4.339 . 0 0 "[ . 1 . 2]" 1
669 1 39 LYS QG 1 40 GLY H . . 5.000 3.974 3.470 4.339 . 0 0 "[ . 1 . 2]" 1
670 1 40 GLY H 1 41 SER H . . 3.000 2.612 2.435 2.753 . 0 0 "[ . 1 . 2]" 1
671 1 40 GLY HA2 1 41 SER H . . 3.500 3.498 3.442 3.514 0.014 17 0 "[ . 1 . 2]" 1
672 1 40 GLY HA3 1 41 SER H . . 3.500 3.175 3.148 3.257 . 0 0 "[ . 1 . 2]" 1
673 1 41 SER H 1 41 SER HB2 . . 3.000 2.475 2.374 2.586 . 0 0 "[ . 1 . 2]" 1
674 1 41 SER H 1 41 SER HB3 . . 4.200 3.652 3.584 3.707 . 0 0 "[ . 1 . 2]" 1
675 1 41 SER H 1 42 TYR H . . 5.000 4.527 4.482 4.554 . 0 0 "[ . 1 . 2]" 1
676 1 41 SER HA 1 41 SER HB3 . . 3.000 2.558 2.469 2.647 . 0 0 "[ . 1 . 2]" 1
677 1 41 SER HA 1 42 TYR H . . 2.500 2.377 2.310 2.506 0.006 13 0 "[ . 1 . 2]" 1
678 1 41 SER HA 1 62 ILE H . . 6.000 5.549 5.233 5.915 . 0 0 "[ . 1 . 2]" 1
679 1 41 SER HA 1 64 THR H . . 5.000 4.855 4.686 4.994 . 0 0 "[ . 1 . 2]" 1
680 1 41 SER HB2 1 42 TYR H . . 4.200 3.955 3.625 4.145 . 0 0 "[ . 1 . 2]" 1
681 1 41 SER HB3 1 42 TYR H . . 3.000 2.801 2.464 3.000 0.000 10 0 "[ . 1 . 2]" 1
682 1 42 TYR H 1 42 TYR HB2 . . 3.000 2.193 2.054 2.325 . 0 0 "[ . 1 . 2]" 1
683 1 42 TYR H 1 42 TYR QD . . 4.200 2.910 2.677 3.232 . 0 0 "[ . 1 . 2]" 1
684 1 42 TYR H 1 42 TYR QE . . 6.000 5.217 5.050 5.437 . 0 0 "[ . 1 . 2]" 1
685 1 42 TYR H 1 43 SER H . . 5.000 4.527 4.484 4.579 . 0 0 "[ . 1 . 2]" 1
686 1 42 TYR H 1 62 ILE H . . 4.200 3.551 3.362 3.778 . 0 0 "[ . 1 . 2]" 1
687 1 42 TYR H 1 62 ILE HB . . 4.200 3.230 2.989 3.324 . 0 0 "[ . 1 . 2]" 1
688 1 42 TYR H 1 62 ILE MD . . 6.000 4.635 4.421 4.744 . 0 0 "[ . 1 . 2]" 1
689 1 42 TYR H 1 62 ILE MG . . 6.000 3.412 3.070 3.652 . 0 0 "[ . 1 . 2]" 1
690 1 42 TYR H 1 64 THR MG . . 6.000 3.974 3.744 4.191 . 0 0 "[ . 1 . 2]" 1
691 1 42 TYR HA 1 42 TYR HB3 . . 3.000 2.718 2.664 2.750 . 0 0 "[ . 1 . 2]" 1
692 1 42 TYR HA 1 43 SER H . . 2.500 2.423 2.340 2.487 . 0 0 "[ . 1 . 2]" 1
693 1 42 TYR HA 1 62 ILE MD . . 6.000 4.526 4.384 4.737 . 0 0 "[ . 1 . 2]" 1
694 1 42 TYR HA 1 62 ILE MG . . 6.000 4.798 4.613 4.893 . 0 0 "[ . 1 . 2]" 1
695 1 42 TYR HB2 1 43 SER H . . 4.200 4.011 3.885 4.140 . 0 0 "[ . 1 . 2]" 1
696 1 42 TYR HB2 1 62 ILE H . . 6.000 3.947 3.759 4.342 . 0 0 "[ . 1 . 2]" 1
697 1 42 TYR HB2 1 62 ILE MD . . 4.200 3.097 2.867 3.195 . 0 0 "[ . 1 . 2]" 1
698 1 42 TYR HB3 1 43 SER H . . 3.000 2.705 2.532 2.918 . 0 0 "[ . 1 . 2]" 1
699 1 42 TYR HB3 1 62 ILE H . . 6.000 4.316 3.856 4.838 . 0 0 "[ . 1 . 2]" 1
700 1 42 TYR HB3 1 62 ILE MD . . 4.200 2.318 2.063 2.582 . 0 0 "[ . 1 . 2]" 1
701 1 42 TYR QD 1 43 SER H . . 5.000 3.460 3.066 3.964 . 0 0 "[ . 1 . 2]" 1
702 1 42 TYR QD 1 81 LEU MD2 . . 6.000 3.985 3.489 4.339 . 0 0 "[ . 1 . 2]" 1
703 1 42 TYR QE 1 81 LEU MD1 . . 6.000 3.023 2.340 3.388 . 0 0 "[ . 1 . 2]" 1
704 1 42 TYR O 1 62 ILE H . . 2.400 1.934 1.797 2.257 . 0 0 "[ . 1 . 2]" 1
705 1 42 TYR O 1 62 ILE N . . 3.300 2.859 2.718 3.101 . 0 0 "[ . 1 . 2]" 1
706 1 43 SER H 1 43 SER HB2 . . 3.000 2.893 2.759 2.955 . 0 0 "[ . 1 . 2]" 1
707 1 43 SER H 1 43 SER HB3 . . 4.200 3.883 3.817 3.916 . 0 0 "[ . 1 . 2]" 1
708 1 43 SER H 1 44 LEU H . . 5.000 4.204 4.127 4.289 . 0 0 "[ . 1 . 2]" 1
709 1 43 SER H 1 62 ILE HB . . 5.000 4.122 3.968 4.285 . 0 0 "[ . 1 . 2]" 1
710 1 43 SER H 1 62 ILE MD . . 6.000 3.531 3.348 3.752 . 0 0 "[ . 1 . 2]" 1
711 1 43 SER HA 1 43 SER HB3 . . 3.000 2.428 2.399 2.460 . 0 0 "[ . 1 . 2]" 1
712 1 43 SER HA 1 44 LEU H . . 2.500 2.227 2.219 2.251 . 0 0 "[ . 1 . 2]" 1
713 1 43 SER HA 1 61 LYS HA . . 2.500 2.494 2.437 2.507 0.007 5 0 "[ . 1 . 2]" 1
714 1 43 SER HA 1 62 ILE H . . 3.500 2.936 2.530 3.327 . 0 0 "[ . 1 . 2]" 1
715 1 43 SER HA 1 62 ILE MD . . 4.200 3.155 3.093 3.199 . 0 0 "[ . 1 . 2]" 1
716 1 43 SER HB2 1 44 LEU H . . 4.200 4.170 4.025 4.204 0.004 5 0 "[ . 1 . 2]" 1
717 1 43 SER HB3 1 44 LEU H . . 3.500 3.421 3.274 3.505 0.005 14 0 "[ . 1 . 2]" 1
718 1 43 SER HB3 1 60 TYR H . . 6.000 4.963 4.497 5.215 . 0 0 "[ . 1 . 2]" 1
719 1 44 LEU H 1 44 LEU HB2 . . 3.000 2.996 2.906 3.014 0.014 11 0 "[ . 1 . 2]" 1
720 1 44 LEU H 1 44 LEU HB3 . . 3.000 2.288 2.216 2.400 . 0 0 "[ . 1 . 2]" 1
721 1 44 LEU H 1 44 LEU HG . . 5.000 4.178 4.106 4.274 . 0 0 "[ . 1 . 2]" 1
722 1 44 LEU H 1 45 SER H . . 5.000 4.573 4.547 4.597 . 0 0 "[ . 1 . 2]" 1
723 1 44 LEU H 1 59 HIS HA . . 5.000 4.871 4.717 5.000 . 0 0 "[ . 1 . 2]" 1
724 1 44 LEU H 1 60 TYR H . . 3.500 3.296 3.064 3.501 0.001 20 0 "[ . 1 . 2]" 1
725 1 44 LEU H 1 60 TYR HB2 . . 4.200 3.371 3.084 3.773 . 0 0 "[ . 1 . 2]" 1
726 1 44 LEU H 1 60 TYR HB3 . . 5.000 4.599 4.257 5.006 0.006 18 0 "[ . 1 . 2]" 1
727 1 44 LEU H 1 60 TYR O . . 2.400 1.848 1.787 2.106 . 0 0 "[ . 1 . 2]" 1
728 1 44 LEU H 1 61 LYS HA . . 3.500 3.369 3.188 3.502 0.002 14 0 "[ . 1 . 2]" 1
729 1 44 LEU H 1 62 ILE H . . 5.000 4.221 3.684 4.614 . 0 0 "[ . 1 . 2]" 1
730 1 44 LEU H 1 62 ILE MD . . 5.000 2.554 2.293 2.851 . 0 0 "[ . 1 . 2]" 1
731 1 44 LEU HA 1 44 LEU HB2 . . 3.000 2.337 2.308 2.380 . 0 0 "[ . 1 . 2]" 1
732 1 44 LEU HA 1 44 LEU MD1 . . 3.500 2.210 1.979 2.528 . 0 0 "[ . 1 . 2]" 1
733 1 44 LEU HA 1 44 LEU HG . . 3.500 3.244 3.128 3.337 . 0 0 "[ . 1 . 2]" 1
734 1 44 LEU HA 1 45 SER H . . 2.500 2.322 2.232 2.383 . 0 0 "[ . 1 . 2]" 1
735 1 44 LEU HA 1 62 ILE MD . . 6.000 3.158 2.977 3.406 . 0 0 "[ . 1 . 2]" 1
736 1 44 LEU HB2 1 45 SER H . . 4.200 3.900 3.828 4.017 . 0 0 "[ . 1 . 2]" 1
737 1 44 LEU HB2 1 60 TYR H . . 5.000 4.851 4.653 5.002 0.002 19 0 "[ . 1 . 2]" 1
738 1 44 LEU HB2 1 60 TYR HB2 . . 6.000 4.016 3.745 4.390 . 0 0 "[ . 1 . 2]" 1
739 1 44 LEU HB2 1 62 ILE MD . . 4.200 1.923 1.836 2.033 . 0 0 "[ . 1 . 2]" 1
740 1 44 LEU HB3 1 44 LEU MD2 . . 3.500 2.223 2.065 2.388 . 0 0 "[ . 1 . 2]" 1
741 1 44 LEU HB3 1 45 SER H . . 5.000 4.110 3.931 4.317 . 0 0 "[ . 1 . 2]" 1
742 1 44 LEU HB3 1 60 TYR H . . 4.200 3.319 3.082 3.484 . 0 0 "[ . 1 . 2]" 1
743 1 44 LEU HB3 1 60 TYR QD . . 5.000 3.304 2.873 3.644 . 0 0 "[ . 1 . 2]" 1
744 1 44 LEU HB3 1 62 ILE MD . . 5.000 2.642 2.323 2.931 . 0 0 "[ . 1 . 2]" 1
745 1 44 LEU MD1 1 45 SER H . . 3.500 2.073 1.821 2.410 . 0 0 "[ . 1 . 2]" 1
746 1 44 LEU MD2 1 45 SER H . . 6.000 4.103 3.913 4.419 . 0 0 "[ . 1 . 2]" 1
747 1 44 LEU MD2 1 46 VAL MG2 . . 6.000 2.512 2.164 2.743 . 0 0 "[ . 1 . 2]" 1
748 1 44 LEU MD2 1 60 TYR H . . 6.000 4.112 3.806 4.563 . 0 0 "[ . 1 . 2]" 1
749 1 44 LEU MD2 1 60 TYR HB3 . . 6.000 3.867 3.409 4.317 . 0 0 "[ . 1 . 2]" 1
750 1 44 LEU MD2 1 60 TYR QD . . 5.000 2.576 1.997 3.069 . 0 0 "[ . 1 . 2]" 1
751 1 44 LEU MD2 1 60 TYR QE . . 6.000 3.739 3.225 4.120 . 0 0 "[ . 1 . 2]" 1
752 1 44 LEU MD2 1 62 ILE MD . . 5.000 3.076 2.900 3.200 . 0 0 "[ . 1 . 2]" 1
753 1 44 LEU MD2 1 95 LEU MD1 . . 5.000 2.695 2.076 3.227 . 0 0 "[ . 1 . 2]" 1
754 1 44 LEU MD2 1 95 LEU MD2 . . 6.000 2.860 2.263 3.580 . 0 0 "[ . 1 . 2]" 1
755 1 44 LEU HG 1 45 SER H . . 4.200 2.664 2.428 2.976 . 0 0 "[ . 1 . 2]" 1
756 1 44 LEU HG 1 60 TYR H . . 6.000 3.614 3.423 3.902 . 0 0 "[ . 1 . 2]" 1
757 1 44 LEU N 1 60 TYR O . . 3.300 2.736 2.640 2.882 . 0 0 "[ . 1 . 2]" 1
758 1 44 LEU O 1 60 TYR H . . 2.400 1.875 1.796 2.142 . 0 0 "[ . 1 . 2]" 1
759 1 44 LEU O 1 60 TYR N . . 3.300 2.705 2.533 2.913 . 0 0 "[ . 1 . 2]" 1
760 1 45 SER H 1 45 SER HB2 . . 3.000 2.928 2.658 3.006 0.006 9 0 "[ . 1 . 2]" 1
761 1 45 SER H 1 45 SER HB3 . . 4.200 3.881 3.717 3.933 . 0 0 "[ . 1 . 2]" 1
762 1 45 SER H 1 46 VAL H . . 5.000 4.218 4.074 4.332 . 0 0 "[ . 1 . 2]" 1
763 1 45 SER H 1 46 VAL MG2 . . 6.000 3.321 3.162 3.639 . 0 0 "[ . 1 . 2]" 1
764 1 45 SER HA 1 45 SER HB3 . . 3.000 2.417 2.348 2.652 . 0 0 "[ . 1 . 2]" 1
765 1 45 SER HA 1 46 VAL H . . 2.500 2.233 2.217 2.266 . 0 0 "[ . 1 . 2]" 1
766 1 45 SER HA 1 46 VAL HB . . 5.000 4.667 4.492 4.801 . 0 0 "[ . 1 . 2]" 1
767 1 45 SER HA 1 46 VAL MG2 . . 6.000 3.469 3.190 3.777 . 0 0 "[ . 1 . 2]" 1
768 1 45 SER HA 1 57 VAL MG1 . . 6.000 4.011 3.794 4.248 . 0 0 "[ . 1 . 2]" 1
769 1 45 SER HA 1 58 LYS H . . 6.000 5.024 4.878 5.150 . 0 0 "[ . 1 . 2]" 1
770 1 45 SER HA 1 59 HIS HA . . 2.500 2.160 2.000 2.297 . 0 0 "[ . 1 . 2]" 1
771 1 45 SER HA 1 59 HIS QB . . 5.000 3.692 3.479 3.974 . 0 0 "[ . 1 . 2]" 1
772 1 45 SER HA 1 60 TYR H . . 3.500 3.281 2.928 3.502 0.002 11 0 "[ . 1 . 2]" 1
773 1 45 SER QB 1 46 VAL H . . 4.200 3.249 3.073 3.409 . 0 0 "[ . 1 . 2]" 1
774 1 45 SER HB2 1 57 VAL MG1 . . 6.000 3.950 3.739 4.229 . 0 0 "[ . 1 . 2]" 1
775 1 45 SER HB3 1 57 VAL MG1 . . 5.000 2.872 2.628 2.997 . 0 0 "[ . 1 . 2]" 1
776 1 46 VAL H 1 46 VAL HB . . 3.000 2.739 2.611 2.861 . 0 0 "[ . 1 . 2]" 1
777 1 46 VAL H 1 57 VAL MG1 . . 4.200 3.347 3.265 3.408 . 0 0 "[ . 1 . 2]" 1
778 1 46 VAL H 1 58 LYS H . . 3.500 3.332 3.182 3.461 . 0 0 "[ . 1 . 2]" 1
779 1 46 VAL H 1 58 LYS O . . 2.400 1.995 1.839 2.268 . 0 0 "[ . 1 . 2]" 1
780 1 46 VAL H 1 59 HIS HA . . 3.500 3.450 3.265 3.507 0.007 16 0 "[ . 1 . 2]" 1
781 1 46 VAL H 1 60 TYR H . . 5.000 4.620 4.306 4.887 . 0 0 "[ . 1 . 2]" 1
782 1 46 VAL HA 1 47 ARG H . . 2.500 2.371 2.306 2.431 . 0 0 "[ . 1 . 2]" 1
783 1 46 VAL HA 1 47 ARG HB2 . . 5.000 4.378 4.213 4.501 . 0 0 "[ . 1 . 2]" 1
784 1 46 VAL HA 1 47 ARG HB3 . . 6.000 4.858 4.711 5.067 . 0 0 "[ . 1 . 2]" 1
785 1 46 VAL HA 1 57 VAL MG1 . . 5.000 4.078 3.988 4.129 . 0 0 "[ . 1 . 2]" 1
786 1 46 VAL HB 1 47 ARG H . . 5.000 3.748 3.578 3.996 . 0 0 "[ . 1 . 2]" 1
787 1 46 VAL HB 1 60 TYR QD . . 6.000 4.285 3.931 4.747 . 0 0 "[ . 1 . 2]" 1
788 1 46 VAL HB 1 60 TYR QE . . 6.000 2.573 2.289 3.218 . 0 0 "[ . 1 . 2]" 1
789 1 46 VAL MG1 1 47 ARG H . . 4.200 2.045 1.932 2.256 . 0 0 "[ . 1 . 2]" 1
790 1 46 VAL MG1 1 47 ARG HA . . 6.000 4.039 3.825 4.182 . 0 0 "[ . 1 . 2]" 1
791 1 46 VAL MG2 1 47 ARG H . . 5.000 4.024 3.865 4.126 . 0 0 "[ . 1 . 2]" 1
792 1 46 VAL MG2 1 60 TYR QD . . 6.000 2.877 2.383 3.302 . 0 0 "[ . 1 . 2]" 1
793 1 46 VAL MG2 1 60 TYR QE . . 6.000 2.480 2.007 3.104 . 0 0 "[ . 1 . 2]" 1
794 1 46 VAL MG2 1 99 LEU MD1 . . 6.000 3.413 2.888 3.857 . 0 0 "[ . 1 . 2]" 1
795 1 46 VAL N 1 58 LYS O . . 3.300 2.896 2.728 3.150 . 0 0 "[ . 1 . 2]" 1
796 1 46 VAL O 1 58 LYS H . . 2.400 1.838 1.792 1.930 . 0 0 "[ . 1 . 2]" 1
797 1 46 VAL O 1 58 LYS N . . 3.300 2.702 2.641 2.765 . 0 0 "[ . 1 . 2]" 1
798 1 47 ARG H 1 47 ARG HB2 . . 3.000 2.558 2.291 2.689 . 0 0 "[ . 1 . 2]" 1
799 1 47 ARG H 1 47 ARG HB3 . . 3.000 2.538 2.406 2.754 . 0 0 "[ . 1 . 2]" 1
800 1 47 ARG H 1 47 ARG QD . . 5.000 4.387 4.008 4.477 . 0 0 "[ . 1 . 2]" 1
801 1 47 ARG H 1 47 ARG QG . . 5.000 3.963 3.926 3.999 . 0 0 "[ . 1 . 2]" 1
802 1 47 ARG H 1 48 ASP H . . 5.000 4.599 4.559 4.636 . 0 0 "[ . 1 . 2]" 1
803 1 47 ARG H 1 57 VAL MG1 . . 6.000 4.126 4.009 4.371 . 0 0 "[ . 1 . 2]" 1
804 1 47 ARG HA 1 47 ARG HB2 . . 3.000 2.547 2.477 2.662 . 0 0 "[ . 1 . 2]" 1
805 1 47 ARG HA 1 48 ASP H . . 2.500 2.308 2.272 2.336 . 0 0 "[ . 1 . 2]" 1
806 1 47 ARG HA 1 48 ASP HA . . 5.000 4.427 4.403 4.442 . 0 0 "[ . 1 . 2]" 1
807 1 47 ARG HA 1 48 ASP HB3 . . 6.000 4.617 4.381 4.801 . 0 0 "[ . 1 . 2]" 1
808 1 47 ARG HA 1 57 VAL HA . . 2.500 2.403 2.294 2.504 0.004 17 0 "[ . 1 . 2]" 1
809 1 47 ARG HA 1 57 VAL MG2 . . 6.000 3.154 3.007 3.337 . 0 0 "[ . 1 . 2]" 1
810 1 47 ARG HA 1 58 LYS H . . 3.500 3.298 3.194 3.429 . 0 0 "[ . 1 . 2]" 1
811 1 47 ARG HB2 1 47 ARG HE . . 5.000 4.462 4.103 5.006 0.006 3 0 "[ . 1 . 2]" 1
812 1 47 ARG HB2 1 48 ASP H . . 5.000 4.221 4.104 4.402 . 0 0 "[ . 1 . 2]" 1
813 1 47 ARG HB3 1 47 ARG HE . . 5.000 4.445 4.025 5.103 0.103 17 0 "[ . 1 . 2]" 1
814 1 47 ARG HB3 1 48 ASP H . . 4.200 3.983 3.742 4.114 . 0 0 "[ . 1 . 2]" 1
815 1 47 ARG HE 1 48 ASP H . . 6.000 4.708 4.351 6.003 0.003 15 0 "[ . 1 . 2]" 1
816 1 47 ARG QG 1 48 ASP H . . 4.200 2.243 2.034 2.575 . 0 0 "[ . 1 . 2]" 1
817 1 47 ARG QG 1 57 VAL MG2 . . 6.000 3.066 2.440 3.970 . 0 0 "[ . 1 . 2]" 1
818 1 48 ASP H 1 48 ASP HB2 . . 3.500 3.200 2.990 3.398 . 0 0 "[ . 1 . 2]" 1
819 1 48 ASP H 1 48 ASP HB3 . . 3.000 2.859 2.716 2.997 . 0 0 "[ . 1 . 2]" 1
820 1 48 ASP H 1 49 TYR H . . 5.000 4.391 4.380 4.420 . 0 0 "[ . 1 . 2]" 1
821 1 48 ASP H 1 56 THR H . . 3.500 3.451 3.336 3.511 0.011 13 0 "[ . 1 . 2]" 1
822 1 48 ASP H 1 56 THR MG . . 6.000 4.951 4.872 4.999 . 0 0 "[ . 1 . 2]" 1
823 1 48 ASP H 1 56 THR O . . 2.400 1.885 1.798 1.938 . 0 0 "[ . 1 . 2]" 1
824 1 48 ASP H 1 57 VAL HA . . 3.500 2.648 2.514 2.791 . 0 0 "[ . 1 . 2]" 1
825 1 48 ASP H 1 57 VAL MG2 . . 6.000 3.607 3.461 3.859 . 0 0 "[ . 1 . 2]" 1
826 1 48 ASP H 1 58 LYS H . . 5.000 3.722 3.403 3.875 . 0 0 "[ . 1 . 2]" 1
827 1 48 ASP HA 1 48 ASP HB2 . . 3.000 2.539 2.429 2.629 . 0 0 "[ . 1 . 2]" 1
828 1 48 ASP HA 1 49 TYR H . . 2.500 2.510 2.481 2.545 0.045 15 0 "[ . 1 . 2]" 1
829 1 48 ASP HA 1 49 TYR HA . . 5.000 4.508 4.491 4.528 . 0 0 "[ . 1 . 2]" 1
830 1 48 ASP HA 1 56 THR H . . 5.000 4.986 4.948 5.008 0.008 17 0 "[ . 1 . 2]" 1
831 1 48 ASP HA 1 97 GLN HE21 . . 4.200 3.227 2.990 4.083 . 0 0 "[ . 1 . 2]" 1
832 1 48 ASP HA 1 97 GLN HE22 . . 4.200 3.243 2.343 3.939 . 0 0 "[ . 1 . 2]" 1
833 1 48 ASP HA 1 97 GLN QG . . 6.000 5.120 4.728 5.380 . 0 0 "[ . 1 . 2]" 1
834 1 48 ASP QB 1 49 TYR H . . 4.200 3.308 3.179 3.413 . 0 0 "[ . 1 . 2]" 1
835 1 48 ASP HB2 1 58 LYS H . . 6.000 3.639 3.290 3.906 . 0 0 "[ . 1 . 2]" 1
836 1 48 ASP HB2 1 58 LYS QG . . 6.000 2.669 2.361 2.986 . 0 0 "[ . 1 . 2]" 1
837 1 48 ASP N 1 56 THR O . . 3.300 2.871 2.772 2.928 . 0 0 "[ . 1 . 2]" 1
838 1 48 ASP O 1 56 THR H . . 2.400 1.805 1.775 1.840 . 0 0 "[ . 1 . 2]" 1
839 1 48 ASP O 1 56 THR N . . 3.300 2.704 2.676 2.724 . 0 0 "[ . 1 . 2]" 1
840 1 49 TYR H 1 49 TYR HB2 . . 3.000 2.884 2.802 2.983 . 0 0 "[ . 1 . 2]" 1
841 1 49 TYR H 1 49 TYR HB3 . . 3.000 2.646 2.600 2.682 . 0 0 "[ . 1 . 2]" 1
842 1 49 TYR H 1 50 ASP H . . 5.000 4.451 4.425 4.480 . 0 0 "[ . 1 . 2]" 1
843 1 49 TYR H 1 50 ASP HA . . 5.000 4.717 4.674 4.773 . 0 0 "[ . 1 . 2]" 1
844 1 49 TYR H 1 56 THR H . . 5.000 4.686 4.506 4.806 . 0 0 "[ . 1 . 2]" 1
845 1 49 TYR H 1 56 THR MG . . 6.000 4.749 4.586 4.831 . 0 0 "[ . 1 . 2]" 1
846 1 49 TYR H 1 97 GLN HE21 . . 5.000 3.975 3.509 4.476 . 0 0 "[ . 1 . 2]" 1
847 1 49 TYR H 1 97 GLN HE22 . . 4.200 3.450 2.560 3.994 . 0 0 "[ . 1 . 2]" 1
848 1 49 TYR HA 1 49 TYR HB2 . . 3.000 2.627 2.613 2.636 . 0 0 "[ . 1 . 2]" 1
849 1 49 TYR HA 1 49 TYR QD . . 3.500 3.142 2.940 3.205 . 0 0 "[ . 1 . 2]" 1
850 1 49 TYR HA 1 49 TYR QE . . 6.000 4.761 4.691 4.794 . 0 0 "[ . 1 . 2]" 1
851 1 49 TYR HA 1 50 ASP H . . 2.500 2.359 2.320 2.423 . 0 0 "[ . 1 . 2]" 1
852 1 49 TYR HA 1 54 GLY HA2 . . 6.000 4.586 4.383 4.729 . 0 0 "[ . 1 . 2]" 1
853 1 49 TYR HA 1 54 GLY HA3 . . 6.000 5.368 5.243 5.450 . 0 0 "[ . 1 . 2]" 1
854 1 49 TYR HA 1 55 ASP HA . . 3.000 2.827 2.642 2.969 . 0 0 "[ . 1 . 2]" 1
855 1 49 TYR HA 1 55 ASP HB3 . . 6.000 5.188 4.945 5.396 . 0 0 "[ . 1 . 2]" 1
856 1 49 TYR HA 1 56 THR H . . 3.500 2.634 2.408 2.857 . 0 0 "[ . 1 . 2]" 1
857 1 49 TYR HA 1 56 THR MG . . 4.200 2.664 2.393 2.905 . 0 0 "[ . 1 . 2]" 1
858 1 49 TYR HB2 1 50 ASP H . . 4.200 4.165 4.079 4.214 0.014 5 0 "[ . 1 . 2]" 1
859 1 49 TYR HB2 1 55 ASP HA . . 5.000 3.697 3.509 3.856 . 0 0 "[ . 1 . 2]" 1
860 1 49 TYR HB3 1 50 ASP H . . 5.000 3.771 3.636 3.875 . 0 0 "[ . 1 . 2]" 1
861 1 49 TYR QD 1 50 ASP H . . 4.200 2.702 2.457 3.185 . 0 0 "[ . 1 . 2]" 1
862 1 49 TYR QD 1 50 ASP HA . . 6.000 3.281 3.096 3.694 . 0 0 "[ . 1 . 2]" 1
863 1 49 TYR QD 1 51 PRO HA . . 6.000 3.917 3.766 4.221 . 0 0 "[ . 1 . 2]" 1
864 1 49 TYR QD 1 54 GLY H . . 6.000 4.645 4.432 5.019 . 0 0 "[ . 1 . 2]" 1
865 1 49 TYR QD 1 54 GLY HA2 . . 5.000 3.703 3.561 3.887 . 0 0 "[ . 1 . 2]" 1
866 1 49 TYR QD 1 54 GLY HA3 . . 6.000 4.790 4.675 5.003 . 0 0 "[ . 1 . 2]" 1
867 1 49 TYR QD 1 55 ASP H . . 5.000 4.139 3.666 4.297 . 0 0 "[ . 1 . 2]" 1
868 1 49 TYR QD 1 55 ASP HA . . 4.200 2.429 2.024 2.758 . 0 0 "[ . 1 . 2]" 1
869 1 49 TYR QD 1 56 THR H . . 5.000 4.082 3.758 4.351 . 0 0 "[ . 1 . 2]" 1
870 1 49 TYR QE 1 50 ASP H . . 5.000 3.835 3.638 4.138 . 0 0 "[ . 1 . 2]" 1
871 1 49 TYR QE 1 51 PRO HA . . 5.000 2.923 2.742 3.300 . 0 0 "[ . 1 . 2]" 1
872 1 49 TYR QE 1 54 GLY H . . 6.000 4.614 4.289 5.094 . 0 0 "[ . 1 . 2]" 1
873 1 49 TYR QE 1 54 GLY HA2 . . 4.200 2.833 2.523 3.267 . 0 0 "[ . 1 . 2]" 1
874 1 49 TYR QE 1 54 GLY HA3 . . 5.000 3.831 3.586 4.176 . 0 0 "[ . 1 . 2]" 1
875 1 49 TYR QE 1 55 ASP H . . 4.200 3.455 2.976 3.716 . 0 0 "[ . 1 . 2]" 1
876 1 49 TYR QE 1 55 ASP HA . . 6.000 3.629 3.314 3.875 . 0 0 "[ . 1 . 2]" 1
877 1 50 ASP H 1 50 ASP QB . . 3.500 2.500 2.409 2.698 . 0 0 "[ . 1 . 2]" 1
878 1 50 ASP H 1 51 PRO QD . . 5.000 4.242 4.222 4.264 . 0 0 "[ . 1 . 2]" 1
879 1 50 ASP H 1 52 ARG H . . 5.000 4.587 4.508 4.739 . 0 0 "[ . 1 . 2]" 1
880 1 50 ASP H 1 53 GLN H . . 5.000 4.575 4.376 4.651 . 0 0 "[ . 1 . 2]" 1
881 1 50 ASP H 1 53 GLN QB . . 5.000 4.225 4.089 4.332 . 0 0 "[ . 1 . 2]" 1
882 1 50 ASP H 1 54 GLY H . . 4.200 2.620 2.547 2.701 . 0 0 "[ . 1 . 2]" 1
883 1 50 ASP H 1 54 GLY HA2 . . 4.200 2.950 2.759 3.120 . 0 0 "[ . 1 . 2]" 1
884 1 50 ASP H 1 54 GLY HA3 . . 5.000 4.161 4.054 4.248 . 0 0 "[ . 1 . 2]" 1
885 1 50 ASP H 1 55 ASP HA . . 4.200 4.023 3.890 4.208 0.008 19 0 "[ . 1 . 2]" 1
886 1 50 ASP H 1 56 THR H . . 5.000 4.465 4.099 4.774 . 0 0 "[ . 1 . 2]" 1
887 1 50 ASP H 1 56 THR MG . . 5.000 2.878 2.731 3.023 . 0 0 "[ . 1 . 2]" 1
888 1 50 ASP HA 1 51 PRO QD . . 2.500 1.933 1.925 1.953 . 0 0 "[ . 1 . 2]" 1
889 1 50 ASP HA 1 51 PRO QG . . 5.000 3.928 3.919 3.949 . 0 0 "[ . 1 . 2]" 1
890 1 50 ASP HA 1 52 ARG H . . 4.200 3.753 3.722 3.802 . 0 0 "[ . 1 . 2]" 1
891 1 50 ASP HA 1 56 THR MG . . 6.000 4.538 4.341 4.842 . 0 0 "[ . 1 . 2]" 1
892 1 50 ASP QB 1 52 ARG H . . 4.200 2.145 1.978 2.454 . 0 0 "[ . 1 . 2]" 1
893 1 50 ASP QB 1 53 GLN H . . 4.200 2.091 1.974 2.369 . 0 0 "[ . 1 . 2]" 1
894 1 50 ASP QB 1 53 GLN HA . . 6.000 4.432 4.227 4.735 . 0 0 "[ . 1 . 2]" 1
895 1 50 ASP QB 1 54 GLY H . . 4.200 2.188 1.941 2.498 . 0 0 "[ . 1 . 2]" 1
896 1 50 ASP QB 1 54 GLY HA2 . . 5.000 4.028 3.882 4.247 . 0 0 "[ . 1 . 2]" 1
897 1 51 PRO HA 1 54 GLY H . . 6.000 5.000 4.744 5.253 . 0 0 "[ . 1 . 2]" 1
898 1 51 PRO HB2 1 52 ARG H . . 4.200 3.947 3.840 4.000 . 0 0 "[ . 1 . 2]" 1
899 1 51 PRO QD 1 52 ARG H . . 3.500 2.561 2.448 2.624 . 0 0 "[ . 1 . 2]" 1
900 1 51 PRO QG 1 52 ARG H . . 4.200 3.584 3.431 3.662 . 0 0 "[ . 1 . 2]" 1
901 1 52 ARG H 1 52 ARG HB2 . . 3.000 2.301 2.201 2.409 . 0 0 "[ . 1 . 2]" 1
902 1 52 ARG H 1 52 ARG HB3 . . 4.200 3.530 3.452 3.618 . 0 0 "[ . 1 . 2]" 1
903 1 52 ARG H 1 52 ARG QD . . 6.000 3.176 2.364 4.240 . 0 0 "[ . 1 . 2]" 1
904 1 52 ARG H 1 52 ARG QG . . 4.200 3.354 2.949 3.733 . 0 0 "[ . 1 . 2]" 1
905 1 52 ARG H 1 53 GLN H . . 3.000 2.373 2.251 2.571 . 0 0 "[ . 1 . 2]" 1
906 1 52 ARG H 1 53 GLN QG . . 6.000 4.614 4.413 4.839 . 0 0 "[ . 1 . 2]" 1
907 1 52 ARG H 1 54 GLY H . . 4.200 3.730 3.595 3.882 . 0 0 "[ . 1 . 2]" 1
908 1 52 ARG HA 1 52 ARG HB3 . . 3.000 2.680 2.603 2.735 . 0 0 "[ . 1 . 2]" 1
909 1 52 ARG HA 1 52 ARG QD . . 5.000 3.534 2.063 4.068 . 0 0 "[ . 1 . 2]" 1
910 1 52 ARG HA 1 54 GLY H . . 6.000 5.461 5.370 5.646 . 0 0 "[ . 1 . 2]" 1
911 1 52 ARG QB 1 53 GLN H . . 3.500 2.302 2.241 2.378 . 0 0 "[ . 1 . 2]" 1
912 1 52 ARG QD 1 53 GLN H . . 5.000 4.160 3.852 4.508 . 0 0 "[ . 1 . 2]" 1
913 1 52 ARG QG 1 53 GLN H . . 5.000 4.267 4.138 4.370 . 0 0 "[ . 1 . 2]" 1
914 1 53 GLN H 1 53 GLN HB2 . . 3.000 2.325 2.279 2.437 . 0 0 "[ . 1 . 2]" 1
915 1 53 GLN H 1 53 GLN HB3 . . 4.200 3.549 3.529 3.608 . 0 0 "[ . 1 . 2]" 1
916 1 53 GLN H 1 53 GLN QG . . 3.000 2.681 2.574 2.770 . 0 0 "[ . 1 . 2]" 1
917 1 53 GLN H 1 54 GLY H . . 3.000 2.597 2.390 2.735 . 0 0 "[ . 1 . 2]" 1
918 1 53 GLN HA 1 53 GLN HB3 . . 3.000 2.583 2.522 2.613 . 0 0 "[ . 1 . 2]" 1
919 1 53 GLN HB2 1 54 GLY H . . 3.000 2.350 2.208 2.444 . 0 0 "[ . 1 . 2]" 1
920 1 53 GLN HB3 1 54 GLY H . . 4.200 3.219 3.038 3.479 . 0 0 "[ . 1 . 2]" 1
921 1 53 GLN QG 1 54 GLY H . . 5.000 4.049 3.958 4.128 . 0 0 "[ . 1 . 2]" 1
922 1 54 GLY H 1 54 GLY HA2 . . 2.500 2.514 2.486 2.538 0.038 13 0 "[ . 1 . 2]" 1
923 1 54 GLY H 1 55 ASP H . . 5.000 4.290 4.164 4.390 . 0 0 "[ . 1 . 2]" 1
924 1 54 GLY H 1 56 THR MG . . 6.000 2.964 2.756 3.125 . 0 0 "[ . 1 . 2]" 1
925 1 54 GLY HA2 1 55 ASP H . . 3.500 3.269 3.112 3.391 . 0 0 "[ . 1 . 2]" 1
926 1 54 GLY HA2 1 55 ASP HA . . 5.000 4.399 4.362 4.432 . 0 0 "[ . 1 . 2]" 1
927 1 54 GLY HA3 1 55 ASP H . . 2.500 2.210 2.199 2.250 . 0 0 "[ . 1 . 2]" 1
928 1 54 GLY HA3 1 55 ASP HB2 . . 6.000 4.601 4.398 4.985 . 0 0 "[ . 1 . 2]" 1
929 1 55 ASP H 1 55 ASP HB2 . . 3.000 2.441 2.230 2.848 . 0 0 "[ . 1 . 2]" 1
930 1 55 ASP H 1 56 THR H . . 5.000 4.520 4.400 4.596 . 0 0 "[ . 1 . 2]" 1
931 1 55 ASP HA 1 55 ASP HB3 . . 3.000 2.535 2.354 2.651 . 0 0 "[ . 1 . 2]" 1
932 1 55 ASP HA 1 56 THR H . . 2.500 2.271 2.252 2.295 . 0 0 "[ . 1 . 2]" 1
933 1 55 ASP HA 1 56 THR MG . . 6.000 3.293 3.083 3.511 . 0 0 "[ . 1 . 2]" 1
934 1 55 ASP HB2 1 56 THR H . . 5.000 4.271 3.970 4.526 . 0 0 "[ . 1 . 2]" 1
935 1 55 ASP HB3 1 56 THR H . . 5.000 3.447 3.176 3.833 . 0 0 "[ . 1 . 2]" 1
936 1 56 THR H 1 56 THR HB . . 4.200 3.877 3.785 3.958 . 0 0 "[ . 1 . 2]" 1
937 1 56 THR H 1 56 THR MG . . 4.200 2.603 2.433 2.693 . 0 0 "[ . 1 . 2]" 1
938 1 56 THR H 1 57 VAL H . . 5.000 4.427 4.394 4.467 . 0 0 "[ . 1 . 2]" 1
939 1 56 THR HA 1 56 THR HB . . 3.000 2.393 2.359 2.426 . 0 0 "[ . 1 . 2]" 1
940 1 56 THR HA 1 57 VAL H . . 2.500 2.507 2.457 2.530 0.030 17 0 "[ . 1 . 2]" 1
941 1 56 THR HA 1 57 VAL HB . . 5.000 4.656 4.570 4.750 . 0 0 "[ . 1 . 2]" 1
942 1 56 THR HA 1 57 VAL MG2 . . 6.000 3.018 2.885 3.172 . 0 0 "[ . 1 . 2]" 1
943 1 56 THR HB 1 57 VAL H . . 4.200 2.584 2.515 2.663 . 0 0 "[ . 1 . 2]" 1
944 1 56 THR MG 1 57 VAL H . . 5.000 4.049 3.996 4.097 . 0 0 "[ . 1 . 2]" 1
945 1 57 VAL H 1 57 VAL HB . . 3.000 2.805 2.664 2.912 . 0 0 "[ . 1 . 2]" 1
946 1 57 VAL H 1 57 VAL MG2 . . 3.500 2.694 2.579 2.833 . 0 0 "[ . 1 . 2]" 1
947 1 57 VAL H 1 58 LYS H . . 5.000 4.232 4.156 4.345 . 0 0 "[ . 1 . 2]" 1
948 1 57 VAL HA 1 58 LYS H . . 2.500 2.190 2.184 2.216 . 0 0 "[ . 1 . 2]" 1
949 1 57 VAL MG1 1 58 LYS H . . 4.200 2.765 2.561 2.922 . 0 0 "[ . 1 . 2]" 1
950 1 57 VAL MG1 1 58 LYS HA . . 6.000 4.228 4.068 4.394 . 0 0 "[ . 1 . 2]" 1
951 1 57 VAL MG1 1 59 HIS HE1 . . 6.000 3.047 1.891 4.566 . 0 0 "[ . 1 . 2]" 1
952 1 57 VAL MG2 1 58 LYS H . . 6.000 4.255 4.207 4.326 . 0 0 "[ . 1 . 2]" 1
953 1 58 LYS H 1 58 LYS HB2 . . 3.000 2.298 2.226 2.406 . 0 0 "[ . 1 . 2]" 1
954 1 58 LYS H 1 58 LYS HB3 . . 4.200 3.542 3.489 3.603 . 0 0 "[ . 1 . 2]" 1
955 1 58 LYS H 1 58 LYS QG . . 4.200 2.839 2.563 3.032 . 0 0 "[ . 1 . 2]" 1
956 1 58 LYS H 1 59 HIS H . . 5.000 4.593 4.556 4.604 . 0 0 "[ . 1 . 2]" 1
957 1 58 LYS HA 1 58 LYS HB3 . . 3.000 2.586 2.508 2.647 . 0 0 "[ . 1 . 2]" 1
958 1 58 LYS HA 1 59 HIS H . . 2.500 2.350 2.284 2.485 . 0 0 "[ . 1 . 2]" 1
959 1 58 LYS HA 1 59 HIS HA . . 5.000 4.425 4.394 4.488 . 0 0 "[ . 1 . 2]" 1
960 1 58 LYS HA 1 59 HIS QB . . 6.000 4.459 4.192 4.593 . 0 0 "[ . 1 . 2]" 1
961 1 58 LYS HB2 1 58 LYS QE . . 4.200 3.568 3.047 3.823 . 0 0 "[ . 1 . 2]" 1
962 1 58 LYS HB2 1 59 HIS H . . 4.200 4.048 3.813 4.206 0.006 5 0 "[ . 1 . 2]" 1
963 1 58 LYS HB2 1 59 HIS HA . . 6.000 4.914 4.754 5.065 . 0 0 "[ . 1 . 2]" 1
964 1 58 LYS HB2 1 60 TYR QE . . 5.000 3.194 2.444 3.935 . 0 0 "[ . 1 . 2]" 1
965 1 58 LYS HB3 1 59 HIS H . . 3.000 2.818 2.479 3.004 0.004 17 0 "[ . 1 . 2]" 1
966 1 58 LYS HB3 1 60 TYR QE . . 5.000 3.137 2.464 3.737 . 0 0 "[ . 1 . 2]" 1
967 1 58 LYS QD 1 59 HIS H . . 4.200 3.221 2.899 3.470 . 0 0 "[ . 1 . 2]" 1
968 1 58 LYS QE 1 59 HIS H . . 6.000 3.690 2.260 5.078 . 0 0 "[ . 1 . 2]" 1
969 1 58 LYS QG 1 59 HIS H . . 5.000 4.232 4.038 4.381 . 0 0 "[ . 1 . 2]" 1
970 1 59 HIS H 1 59 HIS QB . . 3.500 2.851 2.683 2.958 . 0 0 "[ . 1 . 2]" 1
971 1 59 HIS H 1 59 HIS HD2 . . 5.000 3.406 2.253 4.677 . 0 0 "[ . 1 . 2]" 1
972 1 59 HIS H 1 60 TYR H . . 5.000 4.125 3.863 4.319 . 0 0 "[ . 1 . 2]" 1
973 1 59 HIS HA 1 60 TYR H . . 2.500 2.194 2.185 2.228 . 0 0 "[ . 1 . 2]" 1
974 1 59 HIS HA 1 60 TYR HA . . 5.000 4.387 4.381 4.400 . 0 0 "[ . 1 . 2]" 1
975 1 59 HIS HA 1 60 TYR HB2 . . 5.000 4.552 4.395 4.700 . 0 0 "[ . 1 . 2]" 1
976 1 59 HIS HA 1 60 TYR QD . . 6.000 3.591 2.845 4.421 . 0 0 "[ . 1 . 2]" 1
977 1 59 HIS QB 1 60 TYR H . . 4.200 3.385 3.104 3.604 . 0 0 "[ . 1 . 2]" 1
978 1 60 TYR H 1 60 TYR HB2 . . 3.000 2.447 2.224 2.639 . 0 0 "[ . 1 . 2]" 1
979 1 60 TYR H 1 60 TYR QD . . 3.500 2.477 1.949 3.174 . 0 0 "[ . 1 . 2]" 1
980 1 60 TYR H 1 61 LYS H . . 5.000 4.506 4.316 4.592 . 0 0 "[ . 1 . 2]" 1
981 1 60 TYR HA 1 60 TYR HB3 . . 3.000 2.512 2.451 2.601 . 0 0 "[ . 1 . 2]" 1
982 1 60 TYR HA 1 61 LYS H . . 2.500 2.349 2.195 2.500 . 9 0 "[ . 1 . 2]" 1
983 1 60 TYR HA 1 61 LYS QB . . 5.000 4.168 3.987 4.309 . 0 0 "[ . 1 . 2]" 1
984 1 60 TYR HA 1 61 LYS QG . . 6.000 4.388 3.928 5.385 . 0 0 "[ . 1 . 2]" 1
985 1 60 TYR HB2 1 61 LYS H . . 4.200 3.860 3.508 4.200 . 0 0 "[ . 1 . 2]" 1
986 1 60 TYR HB2 1 72 ILE MD . . 5.000 3.032 2.488 3.696 . 0 0 "[ . 1 . 2]" 1
987 1 60 TYR HB2 1 72 ILE MG . . 5.000 3.378 2.822 3.925 . 0 0 "[ . 1 . 2]" 1
988 1 60 TYR HB3 1 61 LYS H . . 3.500 2.936 2.511 3.504 0.004 11 0 "[ . 1 . 2]" 1
989 1 60 TYR HB3 1 72 ILE MD . . 5.000 3.219 2.436 3.729 . 0 0 "[ . 1 . 2]" 1
990 1 60 TYR HB3 1 72 ILE MG . . 5.000 2.438 2.018 2.869 . 0 0 "[ . 1 . 2]" 1
991 1 60 TYR QD 1 61 LYS H . . 5.000 4.197 3.626 4.742 . 0 0 "[ . 1 . 2]" 1
992 1 60 TYR QD 1 72 ILE MD . . 6.000 4.024 3.653 4.347 . 0 0 "[ . 1 . 2]" 1
993 1 60 TYR QE 1 95 LEU HA . . 6.000 3.962 3.018 4.838 . 0 0 "[ . 1 . 2]" 1
994 1 60 TYR QE 1 95 LEU MD2 . . 4.200 2.827 2.384 3.282 . 0 0 "[ . 1 . 2]" 1
995 1 60 TYR QE 1 96 CYS H . . 5.000 4.191 3.543 4.741 . 0 0 "[ . 1 . 2]" 1
996 1 61 LYS H 1 61 LYS QB . . 3.500 2.454 2.085 2.850 . 0 0 "[ . 1 . 2]" 1
997 1 61 LYS H 1 61 LYS QD . . 5.000 3.749 1.832 4.523 . 0 0 "[ . 1 . 2]" 1
998 1 61 LYS H 1 61 LYS QG . . 4.200 2.774 1.943 3.725 . 0 0 "[ . 1 . 2]" 1
999 1 61 LYS H 1 62 ILE H . . 5.000 4.558 4.439 4.646 . 0 0 "[ . 1 . 2]" 1
1000 1 61 LYS HA 1 62 ILE H . . 2.500 2.301 2.184 2.477 . 0 0 "[ . 1 . 2]" 1
1001 1 61 LYS QB 1 62 ILE H . . 4.200 2.995 2.691 3.396 . 0 0 "[ . 1 . 2]" 1
1002 1 61 LYS QD 1 62 ILE H . . 5.000 3.698 2.543 4.452 . 0 0 "[ . 1 . 2]" 1
1003 1 61 LYS QD 1 62 ILE HA . . 6.000 4.493 3.019 5.342 . 0 0 "[ . 1 . 2]" 1
1004 1 61 LYS QG 1 62 ILE H . . 6.000 3.807 2.294 4.451 . 0 0 "[ . 1 . 2]" 1
1005 1 62 ILE H 1 62 ILE HB . . 3.000 2.501 2.346 2.652 . 0 0 "[ . 1 . 2]" 1
1006 1 62 ILE H 1 63 ARG H . . 5.000 4.101 3.918 4.310 . 0 0 "[ . 1 . 2]" 1
1007 1 62 ILE HA 1 63 ARG H . . 2.500 2.199 2.176 2.235 . 0 0 "[ . 1 . 2]" 1
1008 1 62 ILE HA 1 63 ARG HB2 . . 5.000 4.465 4.373 4.615 . 0 0 "[ . 1 . 2]" 1
1009 1 62 ILE HA 1 63 ARG HB3 . . 6.000 5.683 5.636 5.757 . 0 0 "[ . 1 . 2]" 1
1010 1 62 ILE HA 1 71 TYR H . . 5.000 4.443 4.248 4.744 . 0 0 "[ . 1 . 2]" 1
1011 1 62 ILE HA 1 71 TYR HA . . 6.000 5.408 5.174 5.714 . 0 0 "[ . 1 . 2]" 1
1012 1 62 ILE HA 1 72 ILE MD . . 5.000 3.983 3.673 4.166 . 0 0 "[ . 1 . 2]" 1
1013 1 62 ILE HB 1 63 ARG H . . 5.000 4.564 4.486 4.608 . 0 0 "[ . 1 . 2]" 1
1014 1 62 ILE MD 1 72 ILE HG12 . . 6.000 3.673 3.524 3.985 . 0 0 "[ . 1 . 2]" 1
1015 1 62 ILE MD 1 81 LEU MD2 . . 6.000 2.598 2.162 2.921 . 0 0 "[ . 1 . 2]" 1
1016 1 62 ILE MG 1 63 ARG H . . 5.000 3.176 2.901 3.342 . 0 0 "[ . 1 . 2]" 1
1017 1 62 ILE MG 1 63 ARG HA . . 6.000 3.917 3.749 4.024 . 0 0 "[ . 1 . 2]" 1
1018 1 62 ILE MG 1 70 PHE H . . 6.000 4.995 4.883 5.041 . 0 0 "[ . 1 . 2]" 1
1019 1 62 ILE MG 1 70 PHE HA . . 5.000 3.472 3.271 3.628 . 0 0 "[ . 1 . 2]" 1
1020 1 62 ILE MG 1 71 TYR H . . 5.000 3.276 2.941 3.449 . 0 0 "[ . 1 . 2]" 1
1021 1 62 ILE MG 1 81 LEU MD2 . . 5.000 2.167 1.890 2.626 . 0 0 "[ . 1 . 2]" 1
1022 1 63 ARG H 1 63 ARG HB2 . . 3.000 2.299 2.195 2.422 . 0 0 "[ . 1 . 2]" 1
1023 1 63 ARG H 1 63 ARG HB3 . . 4.200 3.540 3.460 3.609 . 0 0 "[ . 1 . 2]" 1
1024 1 63 ARG H 1 63 ARG QD . . 5.000 4.375 4.168 4.519 . 0 0 "[ . 1 . 2]" 1
1025 1 63 ARG H 1 63 ARG QG . . 4.200 2.869 2.643 3.079 . 0 0 "[ . 1 . 2]" 1
1026 1 63 ARG H 1 64 THR H . . 5.000 4.591 4.567 4.607 . 0 0 "[ . 1 . 2]" 1
1027 1 63 ARG H 1 70 PHE HA . . 5.000 4.957 4.836 5.006 0.006 15 0 "[ . 1 . 2]" 1
1028 1 63 ARG H 1 71 TYR H . . 3.500 3.467 3.347 3.501 0.001 12 0 "[ . 1 . 2]" 1
1029 1 63 ARG H 1 71 TYR QD . . 6.000 4.348 4.159 4.673 . 0 0 "[ . 1 . 2]" 1
1030 1 63 ARG H 1 71 TYR O . . 2.400 2.257 1.962 2.401 0.001 3 0 "[ . 1 . 2]" 1
1031 1 63 ARG H 1 72 ILE HA . . 3.500 3.385 2.799 3.489 . 0 0 "[ . 1 . 2]" 1
1032 1 63 ARG HA 1 63 ARG HB3 . . 3.000 2.643 2.553 2.723 . 0 0 "[ . 1 . 2]" 1
1033 1 63 ARG HA 1 63 ARG QD . . 3.500 2.561 2.116 2.963 . 0 0 "[ . 1 . 2]" 1
1034 1 63 ARG HA 1 64 THR H . . 2.500 2.432 2.343 2.508 0.008 1 0 "[ . 1 . 2]" 1
1035 1 63 ARG HA 1 64 THR MG . . 6.000 3.201 3.026 3.517 . 0 0 "[ . 1 . 2]" 1
1036 1 63 ARG HB2 1 64 THR H . . 4.200 3.960 3.767 4.201 0.001 4 0 "[ . 1 . 2]" 1
1037 1 63 ARG HB2 1 71 TYR QD . . 6.000 3.800 3.539 4.165 . 0 0 "[ . 1 . 2]" 1
1038 1 63 ARG HB2 1 71 TYR QE . . 5.000 2.958 2.540 3.567 . 0 0 "[ . 1 . 2]" 1
1039 1 63 ARG HB3 1 64 THR H . . 3.000 2.691 2.481 2.973 . 0 0 "[ . 1 . 2]" 1
1040 1 63 ARG QD 1 64 THR H . . 4.200 3.147 2.718 3.568 . 0 0 "[ . 1 . 2]" 1
1041 1 63 ARG QD 1 71 TYR QE . . 6.000 4.117 3.654 4.513 . 0 0 "[ . 1 . 2]" 1
1042 1 63 ARG QG 1 64 THR H . . 5.000 4.155 3.905 4.352 . 0 0 "[ . 1 . 2]" 1
1043 1 63 ARG N 1 71 TYR O . . 3.300 3.105 2.824 3.267 . 0 0 "[ . 1 . 2]" 1
1044 1 63 ARG O 1 71 TYR H . . 2.400 1.851 1.799 1.973 . 0 0 "[ . 1 . 2]" 1
1045 1 63 ARG O 1 71 TYR N . . 3.300 2.808 2.749 2.889 . 0 0 "[ . 1 . 2]" 1
1046 1 64 THR H 1 64 THR HB . . 4.200 3.659 3.609 3.729 . 0 0 "[ . 1 . 2]" 1
1047 1 64 THR H 1 64 THR MG . . 4.200 2.415 1.939 2.820 . 0 0 "[ . 1 . 2]" 1
1048 1 64 THR H 1 65 LEU H . . 5.000 4.546 4.494 4.584 . 0 0 "[ . 1 . 2]" 1
1049 1 64 THR H 1 70 PHE HA . . 5.000 4.683 4.582 4.840 . 0 0 "[ . 1 . 2]" 1
1050 1 64 THR HA 1 64 THR HB . . 3.000 2.467 2.389 2.570 . 0 0 "[ . 1 . 2]" 1
1051 1 64 THR HA 1 65 LEU H . . 2.500 2.349 2.281 2.426 . 0 0 "[ . 1 . 2]" 1
1052 1 64 THR HA 1 65 LEU HA . . 5.000 4.306 4.276 4.337 . 0 0 "[ . 1 . 2]" 1
1053 1 64 THR HA 1 65 LEU QB . . 6.000 4.386 4.263 4.490 . 0 0 "[ . 1 . 2]" 1
1054 1 64 THR HA 1 69 GLY H . . 5.000 4.521 3.751 4.974 . 0 0 "[ . 1 . 2]" 1
1055 1 64 THR HA 1 70 PHE HA . . 2.500 2.197 2.057 2.333 . 0 0 "[ . 1 . 2]" 1
1056 1 64 THR HA 1 70 PHE HB3 . . 5.000 4.235 3.962 4.442 . 0 0 "[ . 1 . 2]" 1
1057 1 64 THR HA 1 70 PHE QD . . 5.000 3.980 2.771 4.323 . 0 0 "[ . 1 . 2]" 1
1058 1 64 THR HA 1 71 TYR H . . 3.500 3.372 3.282 3.505 0.005 15 0 "[ . 1 . 2]" 1
1059 1 64 THR HA 1 71 TYR QE . . 6.000 3.795 3.269 4.336 . 0 0 "[ . 1 . 2]" 1
1060 1 64 THR HB 1 65 LEU H . . 3.000 2.821 2.623 2.978 . 0 0 "[ . 1 . 2]" 1
1061 1 64 THR HB 1 70 PHE HA . . 5.000 4.075 3.783 4.530 . 0 0 "[ . 1 . 2]" 1
1062 1 64 THR MG 1 65 LEU H . . 5.000 4.039 3.820 4.193 . 0 0 "[ . 1 . 2]" 1
1063 1 64 THR MG 1 70 PHE HA . . 5.000 3.211 2.631 3.913 . 0 0 "[ . 1 . 2]" 1
1064 1 65 LEU H 1 65 LEU QB . . 3.500 2.364 2.154 2.500 . 0 0 "[ . 1 . 2]" 1
1065 1 65 LEU H 1 65 LEU MD1 . . 5.000 3.481 3.322 3.883 . 0 0 "[ . 1 . 2]" 1
1066 1 65 LEU H 1 65 LEU MD2 . . 5.000 3.970 3.794 4.121 . 0 0 "[ . 1 . 2]" 1
1067 1 65 LEU H 1 65 LEU HG . . 3.000 2.772 2.513 3.001 0.001 15 0 "[ . 1 . 2]" 1
1068 1 65 LEU H 1 66 ASP H . . 5.000 4.558 4.464 4.604 . 0 0 "[ . 1 . 2]" 1
1069 1 65 LEU H 1 69 GLY H . . 5.000 3.134 2.079 3.783 . 0 0 "[ . 1 . 2]" 1
1070 1 65 LEU H 1 70 PHE HA . . 4.200 3.701 3.483 3.928 . 0 0 "[ . 1 . 2]" 1
1071 1 65 LEU H 1 71 TYR QD . . 6.000 3.744 3.442 3.906 . 0 0 "[ . 1 . 2]" 1
1072 1 65 LEU HA 1 65 LEU MD2 . . 4.200 2.302 2.070 2.496 . 0 0 "[ . 1 . 2]" 1
1073 1 65 LEU HA 1 66 ASP H . . 3.000 2.406 2.275 2.757 . 0 0 "[ . 1 . 2]" 1
1074 1 65 LEU HA 1 71 TYR QE . . 6.000 3.362 2.098 3.871 . 0 0 "[ . 1 . 2]" 1
1075 1 65 LEU QB 1 66 ASP H . . 3.500 2.610 1.937 2.905 . 0 0 "[ . 1 . 2]" 1
1076 1 65 LEU QB 1 67 ASN H . . 5.000 2.876 2.371 3.343 . 0 0 "[ . 1 . 2]" 1
1077 1 65 LEU QB 1 67 ASN HA . . 6.000 4.704 4.582 4.952 . 0 0 "[ . 1 . 2]" 1
1078 1 65 LEU QB 1 68 GLY H . . 5.000 2.912 2.303 3.276 . 0 0 "[ . 1 . 2]" 1
1079 1 65 LEU QB 1 69 GLY H . . 5.000 2.783 2.381 3.933 . 0 0 "[ . 1 . 2]" 1
1080 1 65 LEU MD1 1 68 GLY H . . 6.000 4.306 3.584 4.645 . 0 0 "[ . 1 . 2]" 1
1081 1 65 LEU MD1 1 69 GLY H . . 6.000 2.739 1.952 4.506 . 0 0 "[ . 1 . 2]" 1
1082 1 65 LEU MD1 1 69 GLY QA . . 6.000 3.807 1.838 4.307 . 0 0 "[ . 1 . 2]" 1
1083 1 65 LEU MD1 1 71 TYR QD . . 6.000 3.146 2.701 3.703 . 0 0 "[ . 1 . 2]" 1
1084 1 65 LEU MD2 1 66 ASP H . . 6.000 3.327 2.695 3.629 . 0 0 "[ . 1 . 2]" 1
1085 1 65 LEU MD2 1 71 TYR QD . . 6.000 3.101 2.207 3.876 . 0 0 "[ . 1 . 2]" 1
1086 1 65 LEU MD2 1 71 TYR QE . . 5.000 2.824 2.204 3.337 . 0 0 "[ . 1 . 2]" 1
1087 1 65 LEU HG 1 70 PHE HA . . 5.000 4.294 3.760 4.745 . 0 0 "[ . 1 . 2]" 1
1088 1 65 LEU HG 1 71 TYR QD . . 4.200 2.215 2.003 2.889 . 0 0 "[ . 1 . 2]" 1
1089 1 65 LEU HG 1 71 TYR QE . . 5.000 3.089 2.524 3.830 . 0 0 "[ . 1 . 2]" 1
1090 1 66 ASP H 1 66 ASP QB . . 3.500 2.232 2.007 2.674 . 0 0 "[ . 1 . 2]" 1
1091 1 66 ASP H 1 67 ASN H . . 3.500 2.859 2.545 3.095 . 0 0 "[ . 1 . 2]" 1
1092 1 66 ASP HA 1 67 ASN HA . . 5.000 4.528 4.361 4.582 . 0 0 "[ . 1 . 2]" 1
1093 1 66 ASP HA 1 68 GLY H . . 5.000 4.856 4.634 5.009 0.009 15 0 "[ . 1 . 2]" 1
1094 1 66 ASP QB 1 67 ASN H . . 4.200 2.643 1.927 3.815 . 0 0 "[ . 1 . 2]" 1
1095 1 66 ASP QB 1 67 ASN HA . . 6.000 4.105 3.981 4.366 . 0 0 "[ . 1 . 2]" 1
1096 1 66 ASP QB 1 68 GLY H . . 6.000 5.033 4.445 5.335 . 0 0 "[ . 1 . 2]" 1
1097 1 67 ASN H 1 67 ASN QB . . 3.500 2.668 2.392 3.142 . 0 0 "[ . 1 . 2]" 1
1098 1 67 ASN H 1 68 GLY H . . 3.500 3.029 1.890 3.484 . 0 0 "[ . 1 . 2]" 1
1099 1 67 ASN HA 1 68 GLY H . . 3.500 2.721 2.476 3.631 0.131 19 0 "[ . 1 . 2]" 1
1100 1 67 ASN HA 1 68 GLY QA . . 5.000 4.086 4.005 4.299 . 0 0 "[ . 1 . 2]" 1
1101 1 68 GLY H 1 69 GLY H . . 4.200 3.635 2.307 3.929 . 0 0 "[ . 1 . 2]" 1
1102 1 68 GLY H 1 69 GLY QA . . 6.000 4.150 3.744 4.429 . 0 0 "[ . 1 . 2]" 1
1103 1 69 GLY H 1 70 PHE H . . 4.200 3.551 3.249 4.182 . 0 0 "[ . 1 . 2]" 1
1104 1 69 GLY H 1 79 SER HA . . 5.000 3.850 3.362 4.704 . 0 0 "[ . 1 . 2]" 1
1105 1 69 GLY QA 1 79 SER HA . . 3.500 2.068 1.986 2.288 . 0 0 "[ . 1 . 2]" 1
1106 1 70 PHE H 1 70 PHE HB2 . . 3.000 2.718 2.542 2.963 . 0 0 "[ . 1 . 2]" 1
1107 1 70 PHE H 1 70 PHE QD . . 4.200 2.389 2.050 3.061 . 0 0 "[ . 1 . 2]" 1
1108 1 70 PHE H 1 71 TYR H . . 5.000 4.322 4.100 4.460 . 0 0 "[ . 1 . 2]" 1
1109 1 70 PHE H 1 77 THR HA . . 6.000 5.511 5.093 5.684 . 0 0 "[ . 1 . 2]" 1
1110 1 70 PHE H 1 77 THR HB . . 5.000 4.584 4.090 4.976 . 0 0 "[ . 1 . 2]" 1
1111 1 70 PHE H 1 78 PHE H . . 3.500 3.298 2.967 3.437 . 0 0 "[ . 1 . 2]" 1
1112 1 70 PHE H 1 78 PHE O . . 2.400 1.812 1.794 1.866 . 0 0 "[ . 1 . 2]" 1
1113 1 70 PHE H 1 79 SER HA . . 3.500 3.476 3.398 3.505 0.005 2 0 "[ . 1 . 2]" 1
1114 1 70 PHE HA 1 70 PHE HB3 . . 3.000 2.482 2.408 2.517 . 0 0 "[ . 1 . 2]" 1
1115 1 70 PHE HA 1 71 TYR H . . 2.500 2.229 2.200 2.259 . 0 0 "[ . 1 . 2]" 1
1116 1 70 PHE HA 1 71 TYR QD . . 5.000 3.174 2.869 3.640 . 0 0 "[ . 1 . 2]" 1
1117 1 70 PHE HB2 1 71 TYR H . . 4.200 4.094 3.950 4.202 0.002 15 0 "[ . 1 . 2]" 1
1118 1 70 PHE HB2 1 81 LEU MD2 . . 5.000 2.696 2.350 3.187 . 0 0 "[ . 1 . 2]" 1
1119 1 70 PHE HB2 1 84 LEU MD1 . . 5.000 3.403 3.162 3.813 . 0 0 "[ . 1 . 2]" 1
1120 1 70 PHE HB3 1 71 TYR H . . 3.500 3.314 3.155 3.502 0.002 15 0 "[ . 1 . 2]" 1
1121 1 70 PHE HB3 1 81 LEU MD2 . . 5.000 2.950 2.537 3.303 . 0 0 "[ . 1 . 2]" 1
1122 1 70 PHE HB3 1 84 LEU MD1 . . 6.000 4.010 3.693 4.289 . 0 0 "[ . 1 . 2]" 1
1123 1 70 PHE QD 1 71 TYR H . . 6.000 4.606 4.364 4.731 . 0 0 "[ . 1 . 2]" 1
1124 1 70 PHE N 1 78 PHE O . . 3.300 2.741 2.628 2.815 . 0 0 "[ . 1 . 2]" 1
1125 1 70 PHE O 1 78 PHE H . . 2.400 2.253 1.971 2.395 . 0 0 "[ . 1 . 2]" 1
1126 1 70 PHE O 1 78 PHE N . . 3.300 3.166 2.946 3.273 . 0 0 "[ . 1 . 2]" 1
1127 1 71 TYR H 1 71 TYR HB3 . . 3.500 2.973 2.823 3.180 . 0 0 "[ . 1 . 2]" 1
1128 1 71 TYR H 1 72 ILE H . . 5.000 4.426 4.354 4.464 . 0 0 "[ . 1 . 2]" 1
1129 1 71 TYR HA 1 71 TYR HB2 . . 3.000 2.462 2.419 2.510 . 0 0 "[ . 1 . 2]" 1
1130 1 71 TYR HA 1 71 TYR HB3 . . 3.000 2.592 2.537 2.648 . 0 0 "[ . 1 . 2]" 1
1131 1 71 TYR HA 1 72 ILE H . . 2.500 2.315 2.278 2.362 . 0 0 "[ . 1 . 2]" 1
1132 1 71 TYR HA 1 73 SER H . . 4.200 4.178 4.118 4.207 0.007 4 0 "[ . 1 . 2]" 1
1133 1 71 TYR HA 1 77 THR HA . . 3.000 2.989 2.949 3.009 0.009 9 0 "[ . 1 . 2]" 1
1134 1 71 TYR HA 1 77 THR MG . . 6.000 3.959 3.712 4.245 . 0 0 "[ . 1 . 2]" 1
1135 1 71 TYR HA 1 78 PHE H . . 4.200 3.366 3.129 3.506 . 0 0 "[ . 1 . 2]" 1
1136 1 71 TYR HA 1 78 PHE QD . . 5.000 2.771 2.413 2.923 . 0 0 "[ . 1 . 2]" 1
1137 1 71 TYR HA 1 84 LEU MD1 . . 6.000 3.126 2.771 3.534 . 0 0 "[ . 1 . 2]" 1
1138 1 71 TYR HB2 1 72 ILE H . . 3.500 3.003 2.926 3.079 . 0 0 "[ . 1 . 2]" 1
1139 1 71 TYR HB2 1 73 SER H . . 6.000 3.793 3.595 4.100 . 0 0 "[ . 1 . 2]" 1
1140 1 71 TYR HB2 1 77 THR HA . . 4.200 2.840 2.615 3.065 . 0 0 "[ . 1 . 2]" 1
1141 1 71 TYR HB2 1 78 PHE H . . 5.000 4.333 4.089 4.535 . 0 0 "[ . 1 . 2]" 1
1142 1 71 TYR HB3 1 72 ILE H . . 4.200 4.190 4.169 4.219 0.019 9 0 "[ . 1 . 2]" 1
1143 1 71 TYR HB3 1 77 THR HA . . 4.200 2.952 2.569 3.348 . 0 0 "[ . 1 . 2]" 1
1144 1 71 TYR HB3 1 78 PHE H . . 4.200 3.424 3.143 3.874 . 0 0 "[ . 1 . 2]" 1
1145 1 71 TYR QD 1 72 ILE H . . 5.000 3.697 3.100 4.052 . 0 0 "[ . 1 . 2]" 1
1146 1 71 TYR QD 1 73 SER H . . 6.000 3.740 3.285 4.089 . 0 0 "[ . 1 . 2]" 1
1147 1 71 TYR QD 1 74 PRO HA . . 6.000 3.504 3.141 3.977 . 0 0 "[ . 1 . 2]" 1
1148 1 71 TYR QD 1 77 THR MG . . 5.000 3.266 2.959 3.613 . 0 0 "[ . 1 . 2]" 1
1149 1 71 TYR QE 1 74 PRO HA . . 6.000 4.302 3.937 4.622 . 0 0 "[ . 1 . 2]" 1
1150 1 71 TYR QE 1 74 PRO HB3 . . 6.000 4.076 3.690 4.514 . 0 0 "[ . 1 . 2]" 1
1151 1 72 ILE H 1 72 ILE HB . . 3.000 2.418 2.295 2.557 . 0 0 "[ . 1 . 2]" 1
1152 1 72 ILE H 1 72 ILE MD . . 5.000 3.941 3.606 4.116 . 0 0 "[ . 1 . 2]" 1
1153 1 72 ILE H 1 72 ILE HG13 . . 4.200 2.895 2.638 3.284 . 0 0 "[ . 1 . 2]" 1
1154 1 72 ILE H 1 73 SER H . . 3.000 2.073 1.982 2.192 . 0 0 "[ . 1 . 2]" 1
1155 1 72 ILE H 1 73 SER HA . . 5.000 4.638 4.520 4.752 . 0 0 "[ . 1 . 2]" 1
1156 1 72 ILE H 1 73 SER HB3 . . 6.000 4.611 4.108 4.896 . 0 0 "[ . 1 . 2]" 1
1157 1 72 ILE HA 1 72 ILE HG13 . . 4.200 2.890 2.650 3.221 . 0 0 "[ . 1 . 2]" 1
1158 1 72 ILE HB 1 73 SER H . . 3.500 2.691 2.577 2.848 . 0 0 "[ . 1 . 2]" 1
1159 1 72 ILE MD 1 84 LEU MD1 . . 6.000 2.288 1.949 2.745 . 0 0 "[ . 1 . 2]" 1
1160 1 72 ILE MD 1 84 LEU HG . . 6.000 3.837 3.279 4.225 . 0 0 "[ . 1 . 2]" 1
1161 1 72 ILE MD 1 95 LEU MD2 . . 6.000 3.217 2.632 3.713 . 0 0 "[ . 1 . 2]" 1
1162 1 72 ILE HG12 1 72 ILE MG . . 3.500 2.433 2.294 2.580 . 0 0 "[ . 1 . 2]" 1
1163 1 72 ILE MG 1 73 SER H . . 5.000 3.302 3.010 3.506 . 0 0 "[ . 1 . 2]" 1
1164 1 72 ILE MG 1 73 SER HA . . 6.000 3.633 3.459 3.832 . 0 0 "[ . 1 . 2]" 1
1165 1 72 ILE MG 1 73 SER HB2 . . 5.000 3.228 2.664 3.963 . 0 0 "[ . 1 . 2]" 1
1166 1 72 ILE MG 1 95 LEU MD2 . . 5.000 3.171 2.991 3.297 . 0 0 "[ . 1 . 2]" 1
1167 1 73 SER H 1 73 SER HB2 . . 3.500 2.898 2.561 3.209 . 0 0 "[ . 1 . 2]" 1
1168 1 73 SER H 1 73 SER HB3 . . 3.000 2.633 2.225 2.836 . 0 0 "[ . 1 . 2]" 1
1169 1 73 SER H 1 74 PRO QD . . 5.000 4.300 4.288 4.312 . 0 0 "[ . 1 . 2]" 1
1170 1 73 SER HA 1 73 SER HB2 . . 3.000 2.527 2.306 2.657 . 0 0 "[ . 1 . 2]" 1
1171 1 73 SER HA 1 74 PRO HB3 . . 6.000 4.992 4.990 4.994 . 0 0 "[ . 1 . 2]" 1
1172 1 73 SER HA 1 74 PRO QD . . 3.000 1.915 1.882 1.932 . 0 0 "[ . 1 . 2]" 1
1173 1 73 SER HA 1 74 PRO QG . . 5.000 3.909 3.873 3.927 . 0 0 "[ . 1 . 2]" 1
1174 1 73 SER HA 1 75 ARG H . . 6.000 4.442 4.383 4.482 . 0 0 "[ . 1 . 2]" 1
1175 1 73 SER HB3 1 76 SER H . . 5.000 3.599 3.411 3.910 . 0 0 "[ . 1 . 2]" 1
1176 1 74 PRO HA 1 75 ARG H . . 3.500 2.607 2.585 2.625 . 0 0 "[ . 1 . 2]" 1
1177 1 74 PRO HA 1 76 SER H . . 5.000 4.822 4.620 5.001 0.001 13 0 "[ . 1 . 2]" 1
1178 1 74 PRO HA 1 77 THR MG . . 6.000 3.861 3.537 4.253 . 0 0 "[ . 1 . 2]" 1
1179 1 75 ARG H 1 75 ARG HB2 . . 3.000 2.773 2.745 2.804 . 0 0 "[ . 1 . 2]" 1
1180 1 75 ARG H 1 75 ARG HB3 . . 4.200 3.835 3.821 3.849 . 0 0 "[ . 1 . 2]" 1
1181 1 75 ARG H 1 75 ARG QD . . 5.000 4.370 4.202 4.458 . 0 0 "[ . 1 . 2]" 1
1182 1 75 ARG H 1 75 ARG QG . . 3.500 2.941 2.854 2.998 . 0 0 "[ . 1 . 2]" 1
1183 1 75 ARG H 1 76 SER H . . 3.000 2.285 2.105 2.438 . 0 0 "[ . 1 . 2]" 1
1184 1 75 ARG HA 1 75 ARG HB3 . . 3.000 2.511 2.486 2.530 . 0 0 "[ . 1 . 2]" 1
1185 1 75 ARG HA 1 75 ARG QG . . 3.500 2.694 2.628 2.804 . 0 0 "[ . 1 . 2]" 1
1186 1 75 ARG HB2 1 76 SER H . . 3.000 2.112 1.995 2.273 . 0 0 "[ . 1 . 2]" 1
1187 1 75 ARG HB2 1 76 SER HA . . 5.000 4.500 4.470 4.551 . 0 0 "[ . 1 . 2]" 1
1188 1 75 ARG HB3 1 76 SER H . . 4.200 3.280 3.100 3.488 . 0 0 "[ . 1 . 2]" 1
1189 1 75 ARG QD 1 76 SER H . . 6.000 4.820 4.728 4.902 . 0 0 "[ . 1 . 2]" 1
1190 1 75 ARG QG 1 76 SER H . . 4.200 3.783 3.718 3.825 . 0 0 "[ . 1 . 2]" 1
1191 1 76 SER H 1 76 SER QB . . 3.500 2.566 2.418 2.734 . 0 0 "[ . 1 . 2]" 1
1192 1 76 SER HA 1 77 THR H . . 2.500 2.229 2.215 2.303 . 0 0 "[ . 1 . 2]" 1
1193 1 76 SER HA 1 77 THR MG . . 6.000 3.414 3.130 3.640 . 0 0 "[ . 1 . 2]" 1
1194 1 76 SER QB 1 77 THR H . . 4.200 3.420 2.997 3.606 . 0 0 "[ . 1 . 2]" 1
1195 1 76 SER QB 1 78 PHE HZ . . 5.000 3.446 3.009 3.813 . 0 0 "[ . 1 . 2]" 1
1196 1 77 THR H 1 77 THR HB . . 4.200 3.619 3.547 3.725 . 0 0 "[ . 1 . 2]" 1
1197 1 77 THR H 1 77 THR MG . . 3.500 2.260 2.033 2.681 . 0 0 "[ . 1 . 2]" 1
1198 1 77 THR HA 1 77 THR HB . . 3.000 2.455 2.387 2.511 . 0 0 "[ . 1 . 2]" 1
1199 1 77 THR HA 1 78 PHE H . . 2.500 2.476 2.413 2.503 0.003 17 0 "[ . 1 . 2]" 1
1200 1 77 THR HA 1 78 PHE HB2 . . 5.000 4.585 4.500 4.672 . 0 0 "[ . 1 . 2]" 1
1201 1 77 THR HB 1 78 PHE H . . 3.000 2.563 2.478 2.643 . 0 0 "[ . 1 . 2]" 1
1202 1 77 THR MG 1 78 PHE H . . 5.000 3.969 3.888 4.066 . 0 0 "[ . 1 . 2]" 1
1203 1 78 PHE H 1 78 PHE HB2 . . 3.000 2.708 2.604 2.784 . 0 0 "[ . 1 . 2]" 1
1204 1 78 PHE H 1 79 SER H . . 5.000 4.384 4.257 4.475 . 0 0 "[ . 1 . 2]" 1
1205 1 78 PHE HA 1 78 PHE HB3 . . 3.000 2.479 2.450 2.515 . 0 0 "[ . 1 . 2]" 1
1206 1 78 PHE HA 1 78 PHE QE . . 6.000 4.922 4.865 4.987 . 0 0 "[ . 1 . 2]" 1
1207 1 78 PHE HA 1 79 SER H . . 2.500 2.278 2.208 2.380 . 0 0 "[ . 1 . 2]" 1
1208 1 78 PHE HA 1 79 SER HA . . 5.000 4.291 4.282 4.307 . 0 0 "[ . 1 . 2]" 1
1209 1 78 PHE HA 1 79 SER HB3 . . 6.000 5.698 5.657 5.729 . 0 0 "[ . 1 . 2]" 1
1210 1 78 PHE HA 1 80 THR H . . 4.200 3.839 3.653 4.094 . 0 0 "[ . 1 . 2]" 1
1211 1 78 PHE HA 1 83 GLU QB . . 6.000 4.272 3.882 4.509 . 0 0 "[ . 1 . 2]" 1
1212 1 78 PHE HB2 1 79 SER H . . 4.200 3.954 3.653 4.177 . 0 0 "[ . 1 . 2]" 1
1213 1 78 PHE HB2 1 80 THR H . . 4.200 3.560 3.310 3.744 . 0 0 "[ . 1 . 2]" 1
1214 1 78 PHE HB2 1 84 LEU H . . 5.000 4.170 3.822 4.442 . 0 0 "[ . 1 . 2]" 1
1215 1 78 PHE HB3 1 79 SER H . . 3.500 3.118 2.826 3.430 . 0 0 "[ . 1 . 2]" 1
1216 1 78 PHE HB3 1 80 THR H . . 3.500 2.792 2.675 2.986 . 0 0 "[ . 1 . 2]" 1
1217 1 78 PHE HB3 1 84 LEU H . . 4.200 3.615 3.437 3.755 . 0 0 "[ . 1 . 2]" 1
1218 1 78 PHE QD 1 79 SER H . . 5.000 4.492 4.306 4.684 . 0 0 "[ . 1 . 2]" 1
1219 1 78 PHE QD 1 80 THR H . . 6.000 4.618 4.420 4.814 . 0 0 "[ . 1 . 2]" 1
1220 1 78 PHE QD 1 84 LEU H . . 5.000 3.861 3.689 4.058 . 0 0 "[ . 1 . 2]" 1
1221 1 78 PHE QD 1 84 LEU HA . . 5.000 2.778 2.555 3.117 . 0 0 "[ . 1 . 2]" 1
1222 1 78 PHE QD 1 84 LEU HB2 . . 5.000 2.854 2.751 2.932 . 0 0 "[ . 1 . 2]" 1
1223 1 78 PHE QD 1 84 LEU MD1 . . 5.000 2.342 2.002 2.524 . 0 0 "[ . 1 . 2]" 1
1224 1 78 PHE QE 1 84 LEU MD1 . . 6.000 2.701 2.350 2.930 . 0 0 "[ . 1 . 2]" 1
1225 1 79 SER H 1 79 SER HB2 . . 3.000 2.372 2.174 2.622 . 0 0 "[ . 1 . 2]" 1
1226 1 79 SER H 1 79 SER HB3 . . 4.200 3.540 3.465 3.610 . 0 0 "[ . 1 . 2]" 1
1227 1 79 SER H 1 80 THR H . . 3.000 2.415 2.230 2.589 . 0 0 "[ . 1 . 2]" 1
1228 1 79 SER H 1 83 GLU QB . . 6.000 3.969 3.726 4.193 . 0 0 "[ . 1 . 2]" 1
1229 1 79 SER H 1 83 GLU QG . . 6.000 4.563 4.263 4.846 . 0 0 "[ . 1 . 2]" 1
1230 1 79 SER HA 1 79 SER HB3 . . 3.000 2.565 2.420 2.695 . 0 0 "[ . 1 . 2]" 1
1231 1 79 SER HA 1 80 THR H . . 3.500 3.523 3.482 3.557 0.057 9 0 "[ . 1 . 2]" 1
1232 1 79 SER QB 1 80 THR MG . . 6.000 2.503 2.215 2.936 . 0 0 "[ . 1 . 2]" 1
1233 1 79 SER HB2 1 80 THR H . . 3.500 3.070 2.904 3.187 . 0 0 "[ . 1 . 2]" 1
1234 1 79 SER HB3 1 80 THR H . . 4.200 3.942 3.698 4.162 . 0 0 "[ . 1 . 2]" 1
1235 1 80 THR H 1 80 THR HB . . 4.200 3.778 3.696 3.873 . 0 0 "[ . 1 . 2]" 1
1236 1 80 THR H 1 80 THR MG . . 4.200 2.852 2.561 3.218 . 0 0 "[ . 1 . 2]" 1
1237 1 80 THR H 1 81 LEU H . . 5.000 4.446 4.407 4.480 . 0 0 "[ . 1 . 2]" 1
1238 1 80 THR H 1 83 GLU H . . 4.200 3.939 3.780 4.050 . 0 0 "[ . 1 . 2]" 1
1239 1 80 THR H 1 83 GLU QB . . 4.200 2.984 2.744 3.218 . 0 0 "[ . 1 . 2]" 1
1240 1 80 THR H 1 83 GLU QG . . 4.200 3.614 3.472 3.725 . 0 0 "[ . 1 . 2]" 1
1241 1 80 THR HA 1 80 THR HB . . 3.000 2.518 2.427 2.630 . 0 0 "[ . 1 . 2]" 1
1242 1 80 THR HA 1 80 THR MG . . 3.500 2.456 2.241 2.606 . 0 0 "[ . 1 . 2]" 1
1243 1 80 THR HA 1 81 LEU H . . 2.500 2.342 2.273 2.430 . 0 0 "[ . 1 . 2]" 1
1244 1 80 THR HA 1 81 LEU HA . . 5.000 4.270 4.264 4.281 . 0 0 "[ . 1 . 2]" 1
1245 1 80 THR HA 1 81 LEU HB2 . . 5.000 4.475 4.365 4.620 . 0 0 "[ . 1 . 2]" 1
1246 1 80 THR HA 1 81 LEU HG . . 5.000 4.097 3.851 4.308 . 0 0 "[ . 1 . 2]" 1
1247 1 80 THR HA 1 82 GLN H . . 5.000 3.909 3.772 4.048 . 0 0 "[ . 1 . 2]" 1
1248 1 80 THR HA 1 83 GLU H . . 6.000 4.598 4.492 4.715 . 0 0 "[ . 1 . 2]" 1
1249 1 80 THR HA 1 84 LEU H . . 6.000 5.570 5.473 5.695 . 0 0 "[ . 1 . 2]" 1
1250 1 80 THR HB 1 81 LEU H . . 3.000 2.821 2.596 2.990 . 0 0 "[ . 1 . 2]" 1
1251 1 80 THR HB 1 82 GLN H . . 3.000 2.585 2.381 2.799 . 0 0 "[ . 1 . 2]" 1
1252 1 80 THR HB 1 82 GLN HA . . 6.000 5.202 4.970 5.417 . 0 0 "[ . 1 . 2]" 1
1253 1 80 THR HB 1 83 GLU H . . 5.000 3.434 3.080 3.776 . 0 0 "[ . 1 . 2]" 1
1254 1 80 THR MG 1 81 LEU H . . 5.000 3.941 3.673 4.132 . 0 0 "[ . 1 . 2]" 1
1255 1 80 THR MG 1 82 GLN H . . 6.000 4.241 4.064 4.325 . 0 0 "[ . 1 . 2]" 1
1256 1 80 THR MG 1 83 GLU H . . 6.000 4.349 4.218 4.500 . 0 0 "[ . 1 . 2]" 1
1257 1 81 LEU H 1 81 LEU HB2 . . 3.000 2.210 2.137 2.309 . 0 0 "[ . 1 . 2]" 1
1258 1 81 LEU H 1 81 LEU MD1 . . 5.000 3.505 3.318 3.688 . 0 0 "[ . 1 . 2]" 1
1259 1 81 LEU H 1 81 LEU MD2 . . 5.000 3.979 3.817 4.135 . 0 0 "[ . 1 . 2]" 1
1260 1 81 LEU H 1 81 LEU HG . . 3.500 2.857 2.599 3.094 . 0 0 "[ . 1 . 2]" 1
1261 1 81 LEU H 1 82 GLN H . . 3.000 2.395 2.274 2.487 . 0 0 "[ . 1 . 2]" 1
1262 1 81 LEU H 1 83 GLU H . . 4.200 4.075 3.960 4.204 0.004 10 0 "[ . 1 . 2]" 1
1263 1 81 LEU HA 1 81 LEU HB3 . . 3.000 2.600 2.527 2.660 . 0 0 "[ . 1 . 2]" 1
1264 1 81 LEU HA 1 81 LEU MD2 . . 3.500 2.229 2.025 2.375 . 0 0 "[ . 1 . 2]" 1
1265 1 81 LEU HA 1 81 LEU HG . . 3.500 2.678 2.570 2.834 . 0 0 "[ . 1 . 2]" 1
1266 1 81 LEU HA 1 82 GLN H . . 3.500 3.501 3.476 3.523 0.023 5 0 "[ . 1 . 2]" 1
1267 1 81 LEU HA 1 84 LEU H . . 3.500 3.007 2.937 3.081 . 0 0 "[ . 1 . 2]" 1
1268 1 81 LEU HA 1 84 LEU HA . . 6.000 5.043 4.934 5.150 . 0 0 "[ . 1 . 2]" 1
1269 1 81 LEU HA 1 84 LEU HB2 . . 3.500 3.465 3.369 3.505 0.005 3 0 "[ . 1 . 2]" 1
1270 1 81 LEU HA 1 84 LEU HB3 . . 3.000 2.282 2.100 2.476 . 0 0 "[ . 1 . 2]" 1
1271 1 81 LEU HA 1 84 LEU MD1 . . 5.000 3.634 3.413 3.822 . 0 0 "[ . 1 . 2]" 1
1272 1 81 LEU HA 1 84 LEU MD2 . . 6.000 3.443 2.912 3.927 . 0 0 "[ . 1 . 2]" 1
1273 1 81 LEU HB2 1 81 LEU MD1 . . 3.500 2.162 2.022 2.290 . 0 0 "[ . 1 . 2]" 1
1274 1 81 LEU HB2 1 82 GLN H . . 3.500 3.228 3.141 3.327 . 0 0 "[ . 1 . 2]" 1
1275 1 81 LEU HB3 1 81 LEU MD1 . . 3.500 2.558 2.475 2.649 . 0 0 "[ . 1 . 2]" 1
1276 1 81 LEU HB3 1 82 GLN H . . 4.200 3.904 3.794 4.032 . 0 0 "[ . 1 . 2]" 1
1277 1 81 LEU MD2 1 84 LEU H . . 6.000 4.496 4.385 4.690 . 0 0 "[ . 1 . 2]" 1
1278 1 81 LEU MD2 1 84 LEU MD1 . . 5.000 2.679 2.308 2.958 . 0 0 "[ . 1 . 2]" 1
1279 1 81 LEU O 1 85 VAL H . . 2.400 2.029 1.814 2.228 . 0 0 "[ . 1 . 2]" 1
1280 1 81 LEU O 1 85 VAL N . . 3.300 2.882 2.727 3.041 . 0 0 "[ . 1 . 2]" 1
1281 1 82 GLN H 1 82 GLN HB2 . . 3.000 2.409 2.226 2.551 . 0 0 "[ . 1 . 2]" 1
1282 1 82 GLN H 1 82 GLN HB3 . . 3.000 2.576 2.442 2.776 . 0 0 "[ . 1 . 2]" 1
1283 1 82 GLN H 1 82 GLN QG . . 5.000 3.976 3.892 4.038 . 0 0 "[ . 1 . 2]" 1
1284 1 82 GLN H 1 83 GLU H . . 3.000 2.539 2.476 2.631 . 0 0 "[ . 1 . 2]" 1
1285 1 82 GLN H 1 84 LEU H . . 5.000 3.848 3.811 3.936 . 0 0 "[ . 1 . 2]" 1
1286 1 82 GLN HA 1 82 GLN HB2 . . 3.000 2.540 2.466 2.647 . 0 0 "[ . 1 . 2]" 1
1287 1 82 GLN HA 1 83 GLU H . . 3.500 3.547 3.534 3.591 0.091 10 0 "[ . 1 . 2]" 1
1288 1 82 GLN HA 1 85 VAL H . . 3.500 3.401 3.248 3.504 0.004 5 0 "[ . 1 . 2]" 1
1289 1 82 GLN HA 1 85 VAL HA . . 6.000 5.551 5.297 5.718 . 0 0 "[ . 1 . 2]" 1
1290 1 82 GLN HA 1 85 VAL HB . . 3.500 2.775 2.555 3.004 . 0 0 "[ . 1 . 2]" 1
1291 1 82 GLN HA 1 85 VAL MG1 . . 6.000 4.060 3.873 4.350 . 0 0 "[ . 1 . 2]" 1
1292 1 82 GLN HA 1 85 VAL MG2 . . 5.000 3.339 2.948 3.838 . 0 0 "[ . 1 . 2]" 1
1293 1 82 GLN HA 1 86 ASP H . . 5.000 4.237 4.028 4.351 . 0 0 "[ . 1 . 2]" 1
1294 1 82 GLN HB2 1 83 GLU H . . 4.200 3.995 3.758 4.129 . 0 0 "[ . 1 . 2]" 1
1295 1 82 GLN HB3 1 83 GLU H . . 3.000 2.963 2.758 3.015 0.015 16 0 "[ . 1 . 2]" 1
1296 1 82 GLN QG 1 83 GLU H . . 5.000 4.085 3.838 4.542 . 0 0 "[ . 1 . 2]" 1
1297 1 82 GLN O 1 86 ASP H . . 2.400 2.365 2.218 2.404 0.004 9 0 "[ . 1 . 2]" 1
1298 1 82 GLN O 1 86 ASP N . . 3.300 3.223 3.143 3.284 . 0 0 "[ . 1 . 2]" 1
1299 1 83 GLU H 1 83 GLU QB . . 3.500 2.355 2.277 2.436 . 0 0 "[ . 1 . 2]" 1
1300 1 83 GLU H 1 83 GLU QG . . 3.000 2.464 2.215 2.649 . 0 0 "[ . 1 . 2]" 1
1301 1 83 GLU H 1 84 LEU H . . 3.000 2.333 2.270 2.486 . 0 0 "[ . 1 . 2]" 1
1302 1 83 GLU H 1 85 VAL H . . 5.000 3.872 3.796 3.960 . 0 0 "[ . 1 . 2]" 1
1303 1 83 GLU HA 1 83 GLU QG . . 3.500 2.585 2.361 2.858 . 0 0 "[ . 1 . 2]" 1
1304 1 83 GLU HA 1 84 LEU H . . 3.500 3.509 3.496 3.526 0.026 1 0 "[ . 1 . 2]" 1
1305 1 83 GLU HA 1 86 ASP H . . 3.500 3.278 3.171 3.481 . 0 0 "[ . 1 . 2]" 1
1306 1 83 GLU HA 1 86 ASP QB . . 4.200 2.503 2.281 2.868 . 0 0 "[ . 1 . 2]" 1
1307 1 83 GLU QB 1 84 LEU H . . 3.500 3.016 2.962 3.059 . 0 0 "[ . 1 . 2]" 1
1308 1 83 GLU QG 1 84 LEU H . . 5.000 4.236 4.103 4.348 . 0 0 "[ . 1 . 2]" 1
1309 1 83 GLU O 1 87 HIS H . . 2.400 2.203 1.987 2.383 . 0 0 "[ . 1 . 2]" 1
1310 1 83 GLU O 1 87 HIS N . . 3.300 3.091 2.851 3.273 . 0 0 "[ . 1 . 2]" 1
1311 1 84 LEU H 1 84 LEU HB2 . . 3.000 2.808 2.719 2.928 . 0 0 "[ . 1 . 2]" 1
1312 1 84 LEU H 1 84 LEU HB3 . . 3.000 2.231 2.128 2.322 . 0 0 "[ . 1 . 2]" 1
1313 1 84 LEU H 1 84 LEU MD2 . . 5.000 3.701 3.441 3.854 . 0 0 "[ . 1 . 2]" 1
1314 1 84 LEU H 1 84 LEU HG . . 5.000 4.464 4.409 4.518 . 0 0 "[ . 1 . 2]" 1
1315 1 84 LEU H 1 85 VAL H . . 3.000 2.354 2.272 2.427 . 0 0 "[ . 1 . 2]" 1
1316 1 84 LEU H 1 85 VAL MG2 . . 6.000 4.089 3.914 4.298 . 0 0 "[ . 1 . 2]" 1
1317 1 84 LEU H 1 86 ASP H . . 5.000 3.831 3.683 4.175 . 0 0 "[ . 1 . 2]" 1
1318 1 84 LEU HA 1 84 LEU HB2 . . 3.000 2.344 2.283 2.396 . 0 0 "[ . 1 . 2]" 1
1319 1 84 LEU HA 1 84 LEU HG . . 3.000 2.666 2.550 2.802 . 0 0 "[ . 1 . 2]" 1
1320 1 84 LEU HA 1 85 VAL H . . 3.500 3.554 3.530 3.578 0.078 5 0 "[ . 1 . 2]" 1
1321 1 84 LEU HA 1 87 HIS H . . 4.200 3.354 3.183 3.576 . 0 0 "[ . 1 . 2]" 1
1322 1 84 LEU HA 1 87 HIS QB . . 3.500 2.686 2.283 3.087 . 0 0 "[ . 1 . 2]" 1
1323 1 84 LEU HB2 1 84 LEU MD1 . . 3.500 2.129 2.003 2.284 . 0 0 "[ . 1 . 2]" 1
1324 1 84 LEU HB2 1 85 VAL H . . 4.200 4.212 4.154 4.233 0.033 18 0 "[ . 1 . 2]" 1
1325 1 84 LEU HB3 1 84 LEU MD1 . . 3.500 2.600 2.433 2.698 . 0 0 "[ . 1 . 2]" 1
1326 1 84 LEU HB3 1 85 VAL H . . 3.500 3.030 2.982 3.082 . 0 0 "[ . 1 . 2]" 1
1327 1 84 LEU MD1 1 85 VAL H . . 6.000 4.932 4.798 5.032 . 0 0 "[ . 1 . 2]" 1
1328 1 84 LEU MD2 1 85 VAL H . . 4.200 3.011 2.500 3.307 . 0 0 "[ . 1 . 2]" 1
1329 1 84 LEU MD2 1 85 VAL HA . . 4.200 2.681 2.471 2.869 . 0 0 "[ . 1 . 2]" 1
1330 1 84 LEU MD2 1 85 VAL MG2 . . 6.000 2.311 1.957 2.720 . 0 0 "[ . 1 . 2]" 1
1331 1 84 LEU MD2 1 88 TYR H . . 6.000 4.172 3.686 4.564 . 0 0 "[ . 1 . 2]" 1
1332 1 84 LEU O 1 88 TYR H . . 2.400 2.237 2.070 2.408 0.008 9 0 "[ . 1 . 2]" 1
1333 1 84 LEU O 1 88 TYR N . . 3.300 3.073 2.928 3.225 . 0 0 "[ . 1 . 2]" 1
1334 1 85 VAL H 1 85 VAL HB . . 3.000 2.218 2.138 2.337 . 0 0 "[ . 1 . 2]" 1
1335 1 85 VAL H 1 85 VAL MG2 . . 3.500 2.543 2.251 2.783 . 0 0 "[ . 1 . 2]" 1
1336 1 85 VAL H 1 86 ASP H . . 3.000 2.439 2.346 2.614 . 0 0 "[ . 1 . 2]" 1
1337 1 85 VAL H 1 87 HIS H . . 5.000 3.947 3.678 4.343 . 0 0 "[ . 1 . 2]" 1
1338 1 85 VAL HA 1 86 ASP H . . 3.500 3.571 3.534 3.633 0.133 6 0 "[ . 1 . 2]" 1
1339 1 85 VAL HA 1 88 TYR H . . 4.200 3.310 3.146 3.606 . 0 0 "[ . 1 . 2]" 1
1340 1 85 VAL HA 1 88 TYR HB2 . . 3.500 2.400 2.147 2.810 . 0 0 "[ . 1 . 2]" 1
1341 1 85 VAL HA 1 88 TYR QD . . 6.000 3.288 2.331 3.995 . 0 0 "[ . 1 . 2]" 1
1342 1 85 VAL HA 1 99 LEU MD1 . . 5.000 3.076 2.767 3.418 . 0 0 "[ . 1 . 2]" 1
1343 1 85 VAL HB 1 86 ASP H . . 3.500 2.900 2.567 3.053 . 0 0 "[ . 1 . 2]" 1
1344 1 85 VAL MG1 1 86 ASP H . . 5.000 3.424 2.951 3.728 . 0 0 "[ . 1 . 2]" 1
1345 1 85 VAL MG2 1 86 ASP H . . 5.000 4.099 3.981 4.215 . 0 0 "[ . 1 . 2]" 1
1346 1 85 VAL O 1 89 LYS H . . 2.400 2.283 1.912 2.406 0.006 15 0 "[ . 1 . 2]" 1
1347 1 85 VAL O 1 89 LYS N . . 3.300 2.950 2.673 3.185 . 0 0 "[ . 1 . 2]" 1
1348 1 86 ASP H 1 86 ASP HB2 . . 3.000 2.220 2.130 2.475 . 0 0 "[ . 1 . 2]" 1
1349 1 86 ASP H 1 87 HIS H . . 3.000 2.533 2.337 2.682 . 0 0 "[ . 1 . 2]" 1
1350 1 86 ASP H 1 88 TYR H . . 5.000 3.891 3.650 4.214 . 0 0 "[ . 1 . 2]" 1
1351 1 86 ASP HA 1 86 ASP HB3 . . 3.000 2.668 2.526 2.727 . 0 0 "[ . 1 . 2]" 1
1352 1 86 ASP HA 1 87 HIS H . . 3.500 3.604 3.568 3.651 0.151 12 0 "[ . 1 . 2]" 1
1353 1 86 ASP HA 1 89 LYS H . . 3.500 3.242 3.049 3.368 . 0 0 "[ . 1 . 2]" 1
1354 1 86 ASP HA 1 89 LYS QB . . 3.500 2.384 2.152 2.618 . 0 0 "[ . 1 . 2]" 1
1355 1 86 ASP HA 1 89 LYS QD . . 5.000 3.741 2.063 4.491 . 0 0 "[ . 1 . 2]" 1
1356 1 86 ASP HB2 1 87 HIS H . . 3.000 2.703 2.216 2.954 . 0 0 "[ . 1 . 2]" 1
1357 1 86 ASP HB2 1 89 LYS H . . 6.000 5.268 5.070 5.406 . 0 0 "[ . 1 . 2]" 1
1358 1 86 ASP HB3 1 87 HIS H . . 3.500 3.442 3.187 3.513 0.013 14 0 "[ . 1 . 2]" 1
1359 1 86 ASP O 1 90 LYS H . . 2.400 2.314 2.077 2.405 0.005 16 0 "[ . 1 . 2]" 1
1360 1 86 ASP O 1 90 LYS N . . 3.300 3.091 2.846 3.215 . 0 0 "[ . 1 . 2]" 1
1361 1 87 HIS H 1 87 HIS QB . . 3.000 2.163 2.082 2.207 . 0 0 "[ . 1 . 2]" 1
1362 1 87 HIS H 1 88 TYR H . . 3.000 2.574 2.434 2.783 . 0 0 "[ . 1 . 2]" 1
1363 1 87 HIS HA 1 88 TYR H . . 3.500 3.567 3.529 3.600 0.100 6 0 "[ . 1 . 2]" 1
1364 1 87 HIS HA 1 90 LYS H . . 4.200 3.388 3.219 3.490 . 0 0 "[ . 1 . 2]" 1
1365 1 87 HIS HA 1 90 LYS QB . . 4.200 2.834 2.607 3.077 . 0 0 "[ . 1 . 2]" 1
1366 1 87 HIS HA 1 90 LYS QD . . 5.000 3.700 2.592 4.526 . 0 0 "[ . 1 . 2]" 1
1367 1 87 HIS HA 1 90 LYS QG . . 6.000 3.974 3.012 4.782 . 0 0 "[ . 1 . 2]" 1
1368 1 87 HIS QB 1 88 TYR H . . 3.500 2.838 2.686 2.972 . 0 0 "[ . 1 . 2]" 1
1369 1 87 HIS O 1 91 GLY H . . 2.400 2.404 2.394 2.409 0.009 5 0 "[ . 1 . 2]" 1
1370 1 87 HIS O 1 91 GLY N . . 3.300 3.206 3.123 3.259 . 0 0 "[ . 1 . 2]" 1
1371 1 88 TYR H 1 88 TYR HB2 . . 3.000 2.013 1.973 2.089 . 0 0 "[ . 1 . 2]" 1
1372 1 88 TYR H 1 88 TYR QD . . 4.200 2.949 2.450 3.397 . 0 0 "[ . 1 . 2]" 1
1373 1 88 TYR H 1 89 LYS H . . 3.000 2.456 2.365 2.541 . 0 0 "[ . 1 . 2]" 1
1374 1 88 TYR H 1 90 LYS H . . 5.000 3.987 3.888 4.126 . 0 0 "[ . 1 . 2]" 1
1375 1 88 TYR H 1 99 LEU MD1 . . 6.000 4.139 3.877 4.452 . 0 0 "[ . 1 . 2]" 1
1376 1 88 TYR HA 1 88 TYR HB3 . . 3.000 2.723 2.671 2.751 . 0 0 "[ . 1 . 2]" 1
1377 1 88 TYR HA 1 89 LYS H . . 3.500 3.507 3.437 3.551 0.051 14 0 "[ . 1 . 2]" 1
1378 1 88 TYR HA 1 90 LYS H . . 4.200 4.015 3.861 4.211 0.011 11 0 "[ . 1 . 2]" 1
1379 1 88 TYR HA 1 91 GLY H . . 3.500 3.158 3.047 3.321 . 0 0 "[ . 1 . 2]" 1
1380 1 88 TYR HA 1 99 LEU MD1 . . 6.000 4.368 4.177 4.577 . 0 0 "[ . 1 . 2]" 1
1381 1 88 TYR HB2 1 89 LYS H . . 4.200 3.048 2.853 3.259 . 0 0 "[ . 1 . 2]" 1
1382 1 88 TYR HB2 1 99 LEU H . . 6.000 5.154 4.886 5.346 . 0 0 "[ . 1 . 2]" 1
1383 1 88 TYR HB3 1 89 LYS H . . 4.200 3.693 3.576 3.899 . 0 0 "[ . 1 . 2]" 1
1384 1 88 TYR HB3 1 99 LEU H . . 5.000 3.761 3.455 3.958 . 0 0 "[ . 1 . 2]" 1
1385 1 88 TYR QD 1 89 LYS H . . 5.000 4.581 4.396 4.805 . 0 0 "[ . 1 . 2]" 1
1386 1 88 TYR QD 1 95 LEU MD1 . . 5.000 2.551 2.202 3.099 . 0 0 "[ . 1 . 2]" 1
1387 1 88 TYR QE 1 95 LEU MD1 . . 5.000 2.754 2.068 3.530 . 0 0 "[ . 1 . 2]" 1
1388 1 88 TYR QE 1 95 LEU MD2 . . 6.000 3.051 2.361 3.723 . 0 0 "[ . 1 . 2]" 1
1389 1 88 TYR O 1 99 LEU H . . 2.400 2.032 1.851 2.190 . 0 0 "[ . 1 . 2]" 1
1390 1 88 TYR O 1 99 LEU N . . 3.300 3.007 2.831 3.130 . 0 0 "[ . 1 . 2]" 1
1391 1 89 LYS H 1 89 LYS QB . . 3.500 2.181 2.106 2.324 . 0 0 "[ . 1 . 2]" 1
1392 1 89 LYS H 1 89 LYS QD . . 5.000 4.218 3.264 4.514 . 0 0 "[ . 1 . 2]" 1
1393 1 89 LYS H 1 89 LYS QE . . 6.000 4.997 4.263 5.344 . 0 0 "[ . 1 . 2]" 1
1394 1 89 LYS H 1 89 LYS QG . . 4.200 2.893 2.674 3.148 . 0 0 "[ . 1 . 2]" 1
1395 1 89 LYS H 1 90 LYS H . . 3.000 2.366 2.252 2.473 . 0 0 "[ . 1 . 2]" 1
1396 1 89 LYS H 1 91 GLY H . . 5.000 3.785 3.628 3.908 . 0 0 "[ . 1 . 2]" 1
1397 1 89 LYS H 1 99 LEU MD1 . . 6.000 4.004 3.707 4.443 . 0 0 "[ . 1 . 2]" 1
1398 1 89 LYS HA 1 89 LYS QD . . 4.200 3.501 2.970 3.959 . 0 0 "[ . 1 . 2]" 1
1399 1 89 LYS HA 1 90 LYS H . . 3.500 3.532 3.503 3.571 0.071 14 0 "[ . 1 . 2]" 1
1400 1 89 LYS HA 1 91 GLY H . . 5.000 4.115 3.945 4.226 . 0 0 "[ . 1 . 2]" 1
1401 1 89 LYS HA 1 99 LEU H . . 3.000 2.952 2.826 3.002 0.002 11 0 "[ . 1 . 2]" 1
1402 1 89 LYS HA 1 99 LEU HB2 . . 3.000 2.182 2.011 2.369 . 0 0 "[ . 1 . 2]" 1
1403 1 89 LYS HA 1 99 LEU HB3 . . 4.200 3.510 3.294 3.793 . 0 0 "[ . 1 . 2]" 1
1404 1 89 LYS HA 1 99 LEU MD1 . . 6.000 3.918 3.717 4.353 . 0 0 "[ . 1 . 2]" 1
1405 1 89 LYS HA 1 99 LEU MD2 . . 6.000 4.941 4.805 5.032 . 0 0 "[ . 1 . 2]" 1
1406 1 89 LYS QB 1 90 LYS H . . 3.500 3.021 2.910 3.101 . 0 0 "[ . 1 . 2]" 1
1407 1 89 LYS QG 1 90 LYS H . . 5.000 4.445 4.268 4.541 . 0 0 "[ . 1 . 2]" 1
1408 1 90 LYS H 1 90 LYS QB . . 3.500 2.193 2.104 2.343 . 0 0 "[ . 1 . 2]" 1
1409 1 90 LYS H 1 90 LYS QD . . 5.000 3.792 2.298 4.520 . 0 0 "[ . 1 . 2]" 1
1410 1 90 LYS H 1 90 LYS QE . . 6.000 4.706 3.839 5.286 . 0 0 "[ . 1 . 2]" 1
1411 1 90 LYS H 1 90 LYS QG . . 4.200 2.965 2.511 3.677 . 0 0 "[ . 1 . 2]" 1
1412 1 90 LYS H 1 91 GLY H . . 3.000 2.342 2.247 2.475 . 0 0 "[ . 1 . 2]" 1
1413 1 90 LYS HA 1 90 LYS QD . . 4.200 3.626 2.970 3.806 . 0 0 "[ . 1 . 2]" 1
1414 1 90 LYS HA 1 90 LYS QE . . 5.000 4.108 2.962 4.518 . 0 0 "[ . 1 . 2]" 1
1415 1 90 LYS HA 1 90 LYS QG . . 3.500 2.099 2.010 2.230 . 0 0 "[ . 1 . 2]" 1
1416 1 90 LYS HA 1 91 GLY H . . 3.500 3.536 3.509 3.557 0.057 19 0 "[ . 1 . 2]" 1
1417 1 90 LYS QB 1 91 GLY H . . 3.500 3.003 2.901 3.092 . 0 0 "[ . 1 . 2]" 1
1418 1 91 GLY H 1 92 ASN H . . 5.000 4.239 4.138 4.331 . 0 0 "[ . 1 . 2]" 1
1419 1 91 GLY HA2 1 92 ASN H . . 3.000 2.335 2.259 2.480 . 0 0 "[ . 1 . 2]" 1
1420 1 91 GLY HA2 1 93 ASP H . . 5.000 4.379 4.235 4.521 . 0 0 "[ . 1 . 2]" 1
1421 1 91 GLY HA2 1 98 LYS QB . . 6.000 2.264 2.077 2.570 . 0 0 "[ . 1 . 2]" 1
1422 1 91 GLY HA2 1 98 LYS QD . . 5.000 3.264 2.583 4.060 . 0 0 "[ . 1 . 2]" 1
1423 1 91 GLY HA2 1 98 LYS QE . . 6.000 4.765 3.508 5.399 . 0 0 "[ . 1 . 2]" 1
1424 1 91 GLY HA2 1 98 LYS QG . . 6.000 4.172 3.669 4.546 . 0 0 "[ . 1 . 2]" 1
1425 1 92 ASN H 1 92 ASN HB3 . . 3.000 2.728 2.615 2.805 . 0 0 "[ . 1 . 2]" 1
1426 1 92 ASN HA 1 92 ASN HB2 . . 3.000 2.632 2.594 2.680 . 0 0 "[ . 1 . 2]" 1
1427 1 92 ASN HA 1 92 ASN HB3 . . 3.000 2.377 2.346 2.403 . 0 0 "[ . 1 . 2]" 1
1428 1 92 ASN HA 1 95 LEU H . . 4.200 3.509 3.350 3.627 . 0 0 "[ . 1 . 2]" 1
1429 1 92 ASN HA 1 95 LEU HB2 . . 4.200 2.670 2.558 2.847 . 0 0 "[ . 1 . 2]" 1
1430 1 92 ASN HA 1 95 LEU HB3 . . 5.000 4.312 4.093 4.552 . 0 0 "[ . 1 . 2]" 1
1431 1 92 ASN HA 1 95 LEU MD1 . . 5.000 3.161 2.770 3.731 . 0 0 "[ . 1 . 2]" 1
1432 1 92 ASN HA 1 98 LYS HA . . 3.500 2.423 2.198 2.740 . 0 0 "[ . 1 . 2]" 1
1433 1 92 ASN HA 1 98 LYS QB . . 4.200 3.617 3.199 3.816 . 0 0 "[ . 1 . 2]" 1
1434 1 92 ASN HB2 1 92 ASN HD21 . . 3.500 2.118 2.103 2.167 . 0 0 "[ . 1 . 2]" 1
1435 1 92 ASN HB2 1 92 ASN HD22 . . 3.500 3.452 3.445 3.471 . 0 0 "[ . 1 . 2]" 1
1436 1 92 ASN HB2 1 93 ASP H . . 5.000 3.341 3.209 3.456 . 0 0 "[ . 1 . 2]" 1
1437 1 92 ASN HB2 1 94 GLY H . . 5.000 2.977 2.656 3.209 . 0 0 "[ . 1 . 2]" 1
1438 1 92 ASN HB2 1 95 LEU H . . 4.200 2.486 2.224 2.733 . 0 0 "[ . 1 . 2]" 1
1439 1 92 ASN HB2 1 98 LYS H . . 5.000 4.688 4.369 5.004 0.004 7 0 "[ . 1 . 2]" 1
1440 1 92 ASN HB3 1 93 ASP H . . 4.200 3.934 3.888 3.988 . 0 0 "[ . 1 . 2]" 1
1441 1 92 ASN HB3 1 95 LEU H . . 5.000 3.998 3.831 4.138 . 0 0 "[ . 1 . 2]" 1
1442 1 92 ASN HB3 1 98 LYS H . . 5.000 2.975 2.642 3.288 . 0 0 "[ . 1 . 2]" 1
1443 1 92 ASN HD21 1 94 GLY H . . 4.200 2.496 1.974 2.961 . 0 0 "[ . 1 . 2]" 1
1444 1 92 ASN HD21 1 95 LEU H . . 4.200 3.749 3.241 4.072 . 0 0 "[ . 1 . 2]" 1
1445 1 92 ASN HD21 1 97 GLN HA . . 5.000 4.838 4.475 5.000 . 0 0 "[ . 1 . 2]" 1
1446 1 92 ASN HD22 1 94 GLY H . . 5.000 3.477 3.060 3.787 . 0 0 "[ . 1 . 2]" 1
1447 1 92 ASN HD22 1 95 LEU H . . 6.000 5.271 4.861 5.631 . 0 0 "[ . 1 . 2]" 1
1448 1 92 ASN HD22 1 97 GLN HA . . 6.000 5.239 4.888 5.745 . 0 0 "[ . 1 . 2]" 1
1449 1 92 ASN O 1 95 LEU H . . 2.400 2.313 2.254 2.346 . 0 0 "[ . 1 . 2]" 1
1450 1 92 ASN O 1 95 LEU N . . 3.300 3.286 3.210 3.303 0.003 7 0 "[ . 1 . 2]" 1
1451 1 93 ASP H 1 93 ASP HA . . 2.500 2.188 2.182 2.191 . 0 0 "[ . 1 . 2]" 1
1452 1 93 ASP H 1 93 ASP HB2 . . 3.500 2.901 2.856 2.993 . 0 0 "[ . 1 . 2]" 1
1453 1 93 ASP H 1 94 GLY H . . 3.500 3.040 2.959 3.136 . 0 0 "[ . 1 . 2]" 1
1454 1 93 ASP H 1 95 LEU H . . 5.000 4.365 4.193 4.514 . 0 0 "[ . 1 . 2]" 1
1455 1 93 ASP HA 1 93 ASP HB2 . . 3.000 2.566 2.434 2.660 . 0 0 "[ . 1 . 2]" 1
1456 1 93 ASP HA 1 94 GLY H . . 3.000 2.723 2.624 2.819 . 0 0 "[ . 1 . 2]" 1
1457 1 93 ASP HB2 1 94 GLY H . . 5.000 4.691 4.646 4.719 . 0 0 "[ . 1 . 2]" 1
1458 1 93 ASP HB2 1 95 LEU H . . 6.000 5.672 5.431 5.912 . 0 0 "[ . 1 . 2]" 1
1459 1 93 ASP HB3 1 94 GLY H . . 5.000 4.345 4.271 4.416 . 0 0 "[ . 1 . 2]" 1
1460 1 94 GLY H 1 95 LEU H . . 3.000 2.772 2.591 2.959 . 0 0 "[ . 1 . 2]" 1
1461 1 95 LEU H 1 95 LEU HB2 . . 3.000 2.420 2.175 2.604 . 0 0 "[ . 1 . 2]" 1
1462 1 95 LEU H 1 95 LEU MD2 . . 5.000 3.256 2.851 3.923 . 0 0 "[ . 1 . 2]" 1
1463 1 95 LEU H 1 95 LEU HG . . 3.500 2.288 1.990 2.806 . 0 0 "[ . 1 . 2]" 1
1464 1 95 LEU H 1 96 CYS H . . 5.000 4.601 4.546 4.647 . 0 0 "[ . 1 . 2]" 1
1465 1 95 LEU H 1 97 GLN H . . 6.000 5.308 5.120 5.527 . 0 0 "[ . 1 . 2]" 1
1466 1 95 LEU HA 1 95 LEU HB3 . . 3.000 2.476 2.373 2.622 . 0 0 "[ . 1 . 2]" 1
1467 1 95 LEU HA 1 95 LEU MD2 . . 4.200 2.067 1.923 2.319 . 0 0 "[ . 1 . 2]" 1
1468 1 95 LEU HA 1 95 LEU HG . . 3.500 3.116 2.696 3.333 . 0 0 "[ . 1 . 2]" 1
1469 1 95 LEU HA 1 96 CYS H . . 3.000 2.586 2.470 2.713 . 0 0 "[ . 1 . 2]" 1
1470 1 95 LEU HA 1 97 GLN H . . 5.000 4.388 4.134 4.663 . 0 0 "[ . 1 . 2]" 1
1471 1 95 LEU HB2 1 96 CYS H . . 4.200 3.450 3.094 3.816 . 0 0 "[ . 1 . 2]" 1
1472 1 95 LEU HB2 1 97 GLN H . . 4.200 3.369 2.978 3.800 . 0 0 "[ . 1 . 2]" 1
1473 1 95 LEU HB3 1 96 CYS H . . 3.000 2.271 2.082 2.490 . 0 0 "[ . 1 . 2]" 1
1474 1 95 LEU HB3 1 97 GLN H . . 4.200 2.765 2.430 3.088 . 0 0 "[ . 1 . 2]" 1
1475 1 95 LEU MD1 1 96 CYS H . . 6.000 4.237 3.958 4.429 . 0 0 "[ . 1 . 2]" 1
1476 1 95 LEU MD1 1 97 GLN H . . 6.000 4.129 3.942 4.251 . 0 0 "[ . 1 . 2]" 1
1477 1 95 LEU MD2 1 96 CYS H . . 5.000 3.369 2.654 3.828 . 0 0 "[ . 1 . 2]" 1
1478 1 95 LEU HG 1 96 CYS H . . 5.000 4.853 4.536 4.998 . 0 0 "[ . 1 . 2]" 1
1479 1 95 LEU HG 1 97 GLN H . . 6.000 5.543 5.371 5.729 . 0 0 "[ . 1 . 2]" 1
1480 1 96 CYS H 1 96 CYS HB2 . . 4.200 3.594 3.571 3.633 . 0 0 "[ . 1 . 2]" 1
1481 1 96 CYS H 1 96 CYS HB3 . . 3.000 2.688 2.481 2.820 . 0 0 "[ . 1 . 2]" 1
1482 1 96 CYS H 1 97 GLN H . . 3.000 2.355 2.167 2.541 . 0 0 "[ . 1 . 2]" 1
1483 1 96 CYS HA 1 96 CYS HB2 . . 3.000 2.460 2.396 2.511 . 0 0 "[ . 1 . 2]" 1
1484 1 96 CYS HA 1 96 CYS HB3 . . 3.000 2.435 2.388 2.502 . 0 0 "[ . 1 . 2]" 1
1485 1 96 CYS HB2 1 97 GLN H . . 4.200 3.915 3.730 4.116 . 0 0 "[ . 1 . 2]" 1
1486 1 96 CYS HB3 1 97 GLN H . . 4.200 4.043 3.899 4.162 . 0 0 "[ . 1 . 2]" 1
1487 1 97 GLN H 1 97 GLN HB2 . . 4.200 2.814 2.649 2.942 . 0 0 "[ . 1 . 2]" 1
1488 1 97 GLN H 1 97 GLN HB3 . . 4.200 3.846 3.695 3.923 . 0 0 "[ . 1 . 2]" 1
1489 1 97 GLN H 1 97 GLN QG . . 5.000 3.195 2.803 3.706 . 0 0 "[ . 1 . 2]" 1
1490 1 97 GLN H 1 98 LYS H . . 5.000 4.328 4.195 4.424 . 0 0 "[ . 1 . 2]" 1
1491 1 97 GLN HA 1 97 GLN HB3 . . 3.000 2.531 2.442 2.685 . 0 0 "[ . 1 . 2]" 1
1492 1 97 GLN HA 1 97 GLN HE21 . . 5.000 4.908 4.720 5.000 . 17 0 "[ . 1 . 2]" 1
1493 1 97 GLN HA 1 97 GLN HE22 . . 6.000 5.870 5.608 6.004 0.004 14 0 "[ . 1 . 2]" 1
1494 1 97 GLN HA 1 98 LYS H . . 2.500 2.290 2.218 2.359 . 0 0 "[ . 1 . 2]" 1
1495 1 97 GLN HA 1 98 LYS QB . . 6.000 4.309 4.222 4.367 . 0 0 "[ . 1 . 2]" 1
1496 1 97 GLN QG 1 98 LYS H . . 5.000 4.031 3.543 4.230 . 0 0 "[ . 1 . 2]" 1
1497 1 98 LYS H 1 98 LYS QB . . 3.500 2.331 2.206 2.490 . 0 0 "[ . 1 . 2]" 1
1498 1 98 LYS H 1 98 LYS QD . . 6.000 3.516 2.342 4.289 . 0 0 "[ . 1 . 2]" 1
1499 1 98 LYS H 1 98 LYS QE . . 6.000 4.116 2.335 4.992 . 0 0 "[ . 1 . 2]" 1
1500 1 98 LYS H 1 98 LYS QG . . 4.200 2.352 2.088 2.865 . 0 0 "[ . 1 . 2]" 1
1501 1 98 LYS H 1 99 LEU H . . 5.000 4.654 4.629 4.669 . 0 0 "[ . 1 . 2]" 1
1502 1 98 LYS HA 1 99 LEU H . . 2.500 2.478 2.427 2.502 0.002 9 0 "[ . 1 . 2]" 1
1503 1 98 LYS HA 1 99 LEU HB2 . . 5.000 4.614 4.565 4.674 . 0 0 "[ . 1 . 2]" 1
1504 1 98 LYS HA 1 99 LEU HB3 . . 6.000 5.744 5.715 5.774 . 0 0 "[ . 1 . 2]" 1
1505 1 98 LYS HA 1 99 LEU MD2 . . 6.000 4.113 3.808 4.351 . 0 0 "[ . 1 . 2]" 1
1506 1 98 LYS QB 1 99 LEU H . . 4.200 2.526 2.442 2.636 . 0 0 "[ . 1 . 2]" 1
1507 1 98 LYS QG 1 99 LEU H . . 5.000 3.389 3.175 3.756 . 0 0 "[ . 1 . 2]" 1
1508 1 99 LEU H 1 99 LEU HB2 . . 3.000 2.290 2.242 2.337 . 0 0 "[ . 1 . 2]" 1
1509 1 99 LEU H 1 99 LEU MD1 . . 5.000 4.023 3.892 4.148 . 0 0 "[ . 1 . 2]" 1
1510 1 99 LEU H 1 99 LEU MD2 . . 5.000 3.465 3.267 3.625 . 0 0 "[ . 1 . 2]" 1
1511 1 99 LEU H 1 99 LEU HG . . 3.000 2.855 2.687 2.977 . 0 0 "[ . 1 . 2]" 1
1512 1 99 LEU H 1 100 SER H . . 5.000 4.575 4.497 4.630 . 0 0 "[ . 1 . 2]" 1
1513 1 99 LEU HA 1 99 LEU HB3 . . 3.000 2.553 2.522 2.587 . 0 0 "[ . 1 . 2]" 1
1514 1 99 LEU HA 1 99 LEU HG . . 4.200 3.162 3.077 3.274 . 0 0 "[ . 1 . 2]" 1
1515 1 99 LEU HA 1 100 SER H . . 2.500 2.251 2.181 2.320 . 0 0 "[ . 1 . 2]" 1
1516 1 99 LEU HA 1 101 VAL H . . 5.000 4.864 4.517 4.979 . 0 0 "[ . 1 . 2]" 1
1517 1 99 LEU HB2 1 100 SER H . . 5.000 4.221 4.035 4.442 . 0 0 "[ . 1 . 2]" 1
1518 1 99 LEU HB3 1 100 SER H . . 3.500 3.120 2.854 3.498 . 0 0 "[ . 1 . 2]" 1
1519 1 99 LEU MD2 1 100 SER H . . 4.200 3.118 2.970 3.219 . 0 0 "[ . 1 . 2]" 1
1520 1 99 LEU HG 1 100 SER H . . 6.000 5.134 5.049 5.254 . 0 0 "[ . 1 . 2]" 1
1521 1 100 SER H 1 100 SER HB2 . . 4.200 3.655 3.568 3.717 . 0 0 "[ . 1 . 2]" 1
1522 1 100 SER H 1 100 SER HB3 . . 3.000 2.886 2.745 3.012 0.012 17 0 "[ . 1 . 2]" 1
1523 1 100 SER H 1 101 VAL H . . 4.200 2.705 2.589 2.811 . 0 0 "[ . 1 . 2]" 1
1524 1 100 SER HA 1 100 SER HB2 . . 3.000 2.488 2.455 2.587 . 0 0 "[ . 1 . 2]" 1
1525 1 100 SER HA 1 100 SER HB3 . . 3.000 2.451 2.366 2.483 . 0 0 "[ . 1 . 2]" 1
1526 1 100 SER HB2 1 101 VAL H . . 3.000 3.000 2.972 3.013 0.013 17 0 "[ . 1 . 2]" 1
1527 1 100 SER HB3 1 101 VAL H . . 4.200 3.541 3.473 3.739 . 0 0 "[ . 1 . 2]" 1
1528 1 101 VAL H 1 101 VAL MG1 . . 4.200 3.107 2.869 3.338 . 0 0 "[ . 1 . 2]" 1
1529 1 101 VAL H 1 101 VAL MG2 . . 3.000 2.069 1.935 2.345 . 0 0 "[ . 1 . 2]" 1
1530 1 101 VAL H 1 102 PRO HD3 . . 6.000 4.668 4.635 4.690 . 0 0 "[ . 1 . 2]" 1
1531 1 101 VAL HA 1 101 VAL HB . . 3.000 2.490 2.424 2.592 . 0 0 "[ . 1 . 2]" 1
1532 1 101 VAL HA 1 102 PRO QB . . 6.000 4.636 4.632 4.643 . 0 0 "[ . 1 . 2]" 1
1533 1 101 VAL HA 1 102 PRO HD3 . . 3.500 1.982 1.970 2.000 . 0 0 "[ . 1 . 2]" 1
1534 1 101 VAL HA 1 102 PRO HG2 . . 5.000 4.619 4.601 4.645 . 0 0 "[ . 1 . 2]" 1
1535 1 101 VAL HA 1 102 PRO HG3 . . 4.200 4.249 4.239 4.264 0.064 13 0 "[ . 1 . 2]" 1
1536 1 102 PRO HA 1 103 CYS H . . 2.500 2.287 2.222 2.358 . 0 0 "[ . 1 . 2]" 1
1537 1 102 PRO QB 1 103 CYS H . . 4.200 2.945 2.777 3.120 . 0 0 "[ . 1 . 2]" 1
1538 1 103 CYS H 1 103 CYS HB2 . . 3.000 2.229 2.146 2.522 . 0 0 "[ . 1 . 2]" 1
1539 1 103 CYS H 1 103 CYS HB3 . . 3.000 2.849 2.488 2.983 . 0 0 "[ . 1 . 2]" 1
1540 1 103 CYS H 1 104 MET H . . 5.000 4.653 4.504 4.674 . 0 0 "[ . 1 . 2]" 1
1541 1 103 CYS HA 1 103 CYS HB2 . . 3.000 2.587 2.406 2.648 . 0 0 "[ . 1 . 2]" 1
1542 1 103 CYS HA 1 104 MET H . . 2.500 2.396 2.221 2.499 . 0 0 "[ . 1 . 2]" 1
1543 1 103 CYS HA 1 104 MET HA . . 5.000 4.338 4.305 4.388 . 0 0 "[ . 1 . 2]" 1
1544 1 103 CYS HB2 1 104 MET H . . 5.000 4.159 4.027 4.550 . 0 0 "[ . 1 . 2]" 1
1545 1 103 CYS HB3 1 104 MET H . . 5.000 3.641 3.302 4.318 . 0 0 "[ . 1 . 2]" 1
1546 1 104 MET H 1 104 MET QB . . 3.500 2.424 2.117 2.857 . 0 0 "[ . 1 . 2]" 1
1547 1 104 MET H 1 104 MET QG . . 4.200 2.466 2.028 3.822 . 0 0 "[ . 1 . 2]" 1
1548 1 104 MET H 1 105 SER H . . 5.000 4.579 4.469 4.637 . 0 0 "[ . 1 . 2]" 1
1549 1 104 MET HA 1 105 SER H . . 3.000 2.451 2.234 2.711 . 0 0 "[ . 1 . 2]" 1
1550 1 104 MET QB 1 105 SER H . . 4.200 2.617 2.026 3.771 . 0 0 "[ . 1 . 2]" 1
1551 1 104 MET QG 1 105 SER H . . 5.000 4.008 2.396 4.391 . 0 0 "[ . 1 . 2]" 1
1552 1 105 SER H 1 105 SER QB . . 3.500 2.655 2.181 3.182 . 0 0 "[ . 1 . 2]" 1
1553 1 105 SER HA 1 106 SER H . . 3.000 2.319 2.220 2.575 . 0 0 "[ . 1 . 2]" 1
1554 1 106 SER H 1 106 SER QB . . 3.500 2.733 2.298 2.994 . 0 0 "[ . 1 . 2]" 1
1555 1 106 SER H 1 107 LYS H . . 5.000 4.321 3.667 4.643 . 0 0 "[ . 1 . 2]" 1
1556 1 106 SER HA 1 107 LYS H . . 3.000 2.352 2.217 2.608 . 0 0 "[ . 1 . 2]" 1
1557 1 106 SER QB 1 107 LYS H . . 4.200 3.135 2.277 3.787 . 0 0 "[ . 1 . 2]" 1
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