NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
409377 |
1zdv   |
6629 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1zdv
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 2616
_Distance_constraint_stats_list.Viol_count 3901
_Distance_constraint_stats_list.Viol_total 6564.180
_Distance_constraint_stats_list.Viol_max 0.958
_Distance_constraint_stats_list.Viol_rms 0.0307
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0063
_Distance_constraint_stats_list.Viol_average_violations_only 0.0841
_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 GLN 2.589 0.680 20 1 "[ . 1 . +]"
1 3 GLU 2.552 0.100 13 0 "[ . 1 . 2]"
1 4 LEU 4.894 0.216 5 0 "[ . 1 . 2]"
1 5 PRO 7.577 0.216 5 0 "[ . 1 . 2]"
1 6 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLY 3.550 0.117 3 0 "[ . 1 . 2]"
1 8 THR 7.685 0.265 11 0 "[ . 1 . 2]"
1 9 TYR 9.650 0.336 10 0 "[ . 1 . 2]"
1 10 ARG 8.633 0.721 3 3 "[ + .* 1 . - 2]"
1 11 VAL 11.259 0.721 3 2 "[ + .- 1 . 2]"
1 12 ASP 11.279 0.571 9 1 "[ . +1 . 2]"
1 13 ILE 5.917 0.108 9 0 "[ . 1 . 2]"
1 14 TYR 6.583 0.277 19 0 "[ . 1 . 2]"
1 15 LEU 5.464 0.126 2 0 "[ . 1 . 2]"
1 16 ASN 4.228 0.685 18 1 "[ . 1 . + 2]"
1 17 ASN 7.470 0.579 6 1 "[ .+ 1 . 2]"
1 18 GLY 8.659 0.579 6 1 "[ .+ 1 . 2]"
1 19 TYR 4.922 0.311 10 0 "[ . 1 . 2]"
1 20 MET 13.233 0.342 10 0 "[ . 1 . 2]"
1 21 ALA 2.651 0.122 4 0 "[ . 1 . 2]"
1 22 THR 1.035 0.176 3 0 "[ . 1 . 2]"
1 23 ARG 0.995 0.125 20 0 "[ . 1 . 2]"
1 24 ASP 7.613 0.646 3 2 "[ + . 1 . - 2]"
1 25 VAL 2.121 0.347 12 0 "[ . 1 . 2]"
1 26 THR 4.243 0.102 10 0 "[ . 1 . 2]"
1 27 PHE 18.617 0.131 18 0 "[ . 1 . 2]"
1 28 ASN 3.539 0.106 1 0 "[ . 1 . 2]"
1 29 THR 3.513 0.104 16 0 "[ . 1 . 2]"
1 30 GLY 1.675 0.104 16 0 "[ . 1 . 2]"
1 31 ASP 1.752 0.128 10 0 "[ . 1 . 2]"
1 32 SER 0.343 0.058 12 0 "[ . 1 . 2]"
1 33 GLU 1.124 0.105 19 0 "[ . 1 . 2]"
1 34 GLN 4.438 0.680 20 1 "[ . 1 . +]"
1 35 GLY 1.945 0.097 15 0 "[ . 1 . 2]"
1 36 ILE 10.019 0.121 9 0 "[ . 1 . 2]"
1 37 VAL 2.130 0.335 17 0 "[ . 1 . 2]"
1 38 PRO 2.989 0.335 17 0 "[ . 1 . 2]"
1 39 CYS 2.789 0.311 9 0 "[ . 1 . 2]"
1 40 LEU 2.211 0.111 17 0 "[ . 1 . 2]"
1 41 THR 6.040 0.126 5 0 "[ . 1 . 2]"
1 42 ARG 7.496 0.889 12 2 "[* . 1 + . 2]"
1 43 ALA 2.099 0.260 1 0 "[ . 1 . 2]"
1 44 GLN 5.841 0.265 10 0 "[ . 1 . 2]"
1 45 LEU 10.968 0.177 18 0 "[ . 1 . 2]"
1 46 ALA 3.455 0.379 14 0 "[ . 1 . 2]"
1 47 SER 1.193 0.605 10 1 "[ . + . 2]"
1 48 MET 14.234 0.605 10 1 "[ . + . 2]"
1 49 GLY 1.808 0.119 8 0 "[ . 1 . 2]"
1 50 LEU 5.110 0.379 14 0 "[ . 1 . 2]"
1 51 ASN 4.995 0.363 9 0 "[ . 1 . 2]"
1 52 THR 9.305 0.177 18 0 "[ . 1 . 2]"
1 53 ALA 11.930 0.958 6 3 "[ .+ -1 . *]"
1 54 SER 8.474 0.958 6 2 "[ .+ *1 . 2]"
1 55 VAL 7.312 0.209 12 0 "[ . 1 . 2]"
1 56 ALA 3.750 0.135 14 0 "[ . 1 . 2]"
1 57 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 MET 13.304 0.889 12 1 "[ . 1 + . 2]"
1 59 ASN 2.011 0.113 12 0 "[ . 1 . 2]"
1 60 LEU 0.914 0.096 20 0 "[ . 1 . 2]"
1 61 LEU 2.623 0.106 3 0 "[ . 1 . 2]"
1 62 ALA 2.436 0.099 5 0 "[ . 1 . 2]"
1 63 ASP 1.950 0.644 1 1 "[+ . 1 . 2]"
1 64 ASP 1.886 0.086 12 0 "[ . 1 . 2]"
1 65 ALA 3.982 0.126 5 0 "[ . 1 . 2]"
1 66 CYS 2.562 0.319 8 0 "[ . 1 . 2]"
1 67 VAL 3.833 0.128 7 0 "[ . 1 . 2]"
1 68 PRO 8.865 0.237 3 0 "[ . 1 . 2]"
1 69 LEU 8.426 0.137 12 0 "[ . 1 . 2]"
1 70 THR 2.784 0.102 10 0 "[ . 1 . 2]"
1 71 THR 7.257 0.150 3 0 "[ . 1 . 2]"
1 72 MET 12.729 0.641 1 1 "[+ . 1 . 2]"
1 73 VAL 8.689 0.641 1 2 "[+ . 1- . 2]"
1 74 GLN 3.869 0.284 15 0 "[ . 1 . 2]"
1 75 ASP 7.000 0.511 18 1 "[ . 1 . + 2]"
1 76 ALA 10.241 0.387 1 0 "[ . 1 . 2]"
1 77 THR 11.197 0.511 18 1 "[ . 1 . + 2]"
1 78 ALA 5.883 0.121 5 0 "[ . 1 . 2]"
1 79 HIS 2.558 0.128 12 0 "[ . 1 . 2]"
1 80 LEU 3.007 0.114 19 0 "[ . 1 . 2]"
1 81 ASP 3.640 0.184 15 0 "[ . 1 . 2]"
1 82 VAL 6.494 0.120 2 0 "[ . 1 . 2]"
1 83 GLY 2.926 0.103 15 0 "[ . 1 . 2]"
1 84 GLN 3.228 0.387 2 0 "[ . 1 . 2]"
1 85 GLN 6.421 0.130 11 0 "[ . 1 . 2]"
1 86 ARG 9.745 0.571 9 1 "[ . +1 . 2]"
1 87 LEU 5.932 0.336 10 0 "[ . 1 . 2]"
1 88 ASN 2.457 0.128 12 0 "[ . 1 . 2]"
1 89 LEU 3.133 0.110 11 0 "[ . 1 . 2]"
1 90 THR 4.471 0.163 11 0 "[ . 1 . 2]"
1 91 ILE 6.644 0.502 17 1 "[ . 1 . + 2]"
1 92 PRO 5.490 0.590 11 3 "[ . *1+ . - 2]"
1 93 GLN 9.322 0.862 17 3 "[ . *1 . +- 2]"
1 94 ALA 3.873 0.662 6 2 "[ .+ 1 . - 2]"
1 95 PHE 1.967 0.094 13 0 "[ . 1 . 2]"
1 96 MET 7.427 0.862 17 1 "[ . 1 . + 2]"
1 97 SER 2.322 0.216 17 0 "[ . 1 . 2]"
1 98 ASN 0.515 0.086 3 0 "[ . 1 . 2]"
1 99 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 ALA 5.598 0.787 1 1 "[+ . 1 . 2]"
1 101 ARG 9.887 0.619 15 6 "[ * . *-1 * + *]"
1 102 GLY 2.159 0.475 5 0 "[ . 1 . 2]"
1 103 TYR 11.723 0.475 5 0 "[ . 1 . 2]"
1 104 ILE 14.693 0.644 1 1 "[+ . 1 . 2]"
1 105 PRO 11.519 0.465 13 0 "[ . 1 . 2]"
1 106 PRO 3.110 0.465 13 0 "[ . 1 . 2]"
1 107 GLU 6.074 0.189 2 0 "[ . 1 . 2]"
1 108 LEU 9.559 0.373 12 0 "[ . 1 . 2]"
1 109 TRP 11.010 0.265 10 0 "[ . 1 . 2]"
1 110 ASP 3.021 0.673 16 1 "[ . 1 .+ 2]"
1 111 PRO 2.741 0.090 1 0 "[ . 1 . 2]"
1 112 GLY 2.569 0.138 10 0 "[ . 1 . 2]"
1 113 ILE 9.208 0.673 16 1 "[ . 1 .+ 2]"
1 114 ASN 3.012 0.668 11 2 "[ . - 1+ . 2]"
1 115 ALA 4.258 0.668 11 2 "[ . - 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 GLN HA 1 2 GLN HE21 . . 5.500 4.289 2.284 5.370 . 0 0 "[ . 1 . 2]" 1
2 1 2 GLN HA 1 2 GLN HE22 . . 5.500 4.881 3.716 5.587 0.087 20 0 "[ . 1 . 2]" 1
3 1 2 GLN HA 1 2 GLN QG . . 3.650 2.939 2.109 3.518 . 0 0 "[ . 1 . 2]" 1
4 1 2 GLN HA 1 3 GLU H . . 3.020 2.655 2.257 3.079 0.059 10 0 "[ . 1 . 2]" 1
5 1 2 GLN HA 1 3 GLU QB . . 5.400 4.163 3.805 4.591 . 0 0 "[ . 1 . 2]" 1
6 1 2 GLN HA 1 34 GLN HA . . 4.510 4.081 2.863 4.601 0.091 3 0 "[ . 1 . 2]" 1
7 1 2 GLN HB3 1 2 GLN HE22 . . 5.500 4.750 3.261 5.415 . 0 0 "[ . 1 . 2]" 1
8 1 2 GLN HB3 1 3 GLU H . . 5.260 3.606 2.509 4.716 . 0 0 "[ . 1 . 2]" 1
9 1 2 GLN HB3 1 4 LEU QD . . 5.500 3.554 2.198 4.849 . 0 0 "[ . 1 . 2]" 1
10 1 2 GLN HB3 1 34 GLN HA . . 5.500 4.378 2.162 6.180 0.680 20 1 "[ . 1 . +]" 1
11 1 2 GLN QG 1 3 GLU H . . 4.940 2.479 1.953 3.929 . 0 0 "[ . 1 . 2]" 1
12 1 2 GLN QG 1 3 GLU HA . . 5.400 4.103 3.025 4.981 . 0 0 "[ . 1 . 2]" 1
13 1 2 GLN QG 1 3 GLU QB . . 4.990 4.203 3.454 4.584 . 0 0 "[ . 1 . 2]" 1
14 1 2 GLN QG 1 4 LEU H . . 5.150 4.612 3.940 4.963 . 0 0 "[ . 1 . 2]" 1
15 1 2 GLN QG 1 4 LEU QD . . 5.500 2.260 1.940 3.535 . 0 0 "[ . 1 . 2]" 1
16 1 3 GLU H 1 3 GLU QB . . 3.430 2.529 2.076 2.901 . 0 0 "[ . 1 . 2]" 1
17 1 3 GLU H 1 3 GLU HG2 . . 4.550 4.310 3.459 4.629 0.079 5 0 "[ . 1 . 2]" 1
18 1 3 GLU H 1 4 LEU H . . 4.350 4.113 3.384 4.425 0.075 13 0 "[ . 1 . 2]" 1
19 1 3 GLU H 1 4 LEU QD . . 5.500 3.166 2.402 3.935 . 0 0 "[ . 1 . 2]" 1
20 1 3 GLU H 1 34 GLN HA . . 5.500 4.259 2.212 5.025 . 0 0 "[ . 1 . 2]" 1
21 1 3 GLU HA 1 3 GLU HG2 . . 3.870 2.934 2.450 3.540 . 0 0 "[ . 1 . 2]" 1
22 1 3 GLU HA 1 3 GLU HG3 . . 3.860 3.099 2.615 3.960 0.100 13 0 "[ . 1 . 2]" 1
23 1 3 GLU HA 1 4 LEU H . . 2.760 2.181 2.001 2.356 . 0 0 "[ . 1 . 2]" 1
24 1 3 GLU HA 1 4 LEU HA . . 4.770 4.367 4.230 4.474 . 0 0 "[ . 1 . 2]" 1
25 1 3 GLU HA 1 4 LEU QD . . 5.370 2.986 2.471 3.638 . 0 0 "[ . 1 . 2]" 1
26 1 3 GLU HA 1 34 GLN HA . . 3.660 3.451 2.964 3.743 0.083 15 0 "[ . 1 . 2]" 1
27 1 3 GLU HA 1 34 GLN HB2 . . 5.500 4.352 4.034 4.585 . 0 0 "[ . 1 . 2]" 1
28 1 3 GLU HA 1 34 GLN HB3 . . 5.500 2.802 2.499 2.987 . 0 0 "[ . 1 . 2]" 1
29 1 3 GLU HA 1 34 GLN QG . . 5.500 4.202 3.826 4.898 . 0 0 "[ . 1 . 2]" 1
30 1 3 GLU HA 1 35 GLY H . . 5.500 5.118 4.847 5.294 . 0 0 "[ . 1 . 2]" 1
31 1 3 GLU HA 1 35 GLY HA3 . . 5.310 4.375 4.046 4.630 . 0 0 "[ . 1 . 2]" 1
32 1 3 GLU QB 1 4 LEU HA . . 5.500 4.606 4.393 4.829 . 0 0 "[ . 1 . 2]" 1
33 1 3 GLU QB 1 34 GLN HA . . 5.390 4.179 3.706 4.413 . 0 0 "[ . 1 . 2]" 1
34 1 3 GLU QB 1 35 GLY H . . 5.500 4.746 4.227 5.065 . 0 0 "[ . 1 . 2]" 1
35 1 3 GLU QB 1 35 GLY HA2 . . 5.170 4.695 3.989 5.102 . 0 0 "[ . 1 . 2]" 1
36 1 3 GLU QB 1 35 GLY HA3 . . 5.500 3.144 2.425 3.576 . 0 0 "[ . 1 . 2]" 1
37 1 3 GLU HG2 1 4 LEU H . . 5.060 3.242 2.569 3.880 . 0 0 "[ . 1 . 2]" 1
38 1 3 GLU HG2 1 4 LEU QD . . 5.500 4.407 4.063 4.785 . 0 0 "[ . 1 . 2]" 1
39 1 3 GLU HG2 1 5 PRO HG2 . . 5.500 4.184 3.938 4.392 . 0 0 "[ . 1 . 2]" 1
40 1 3 GLU HG3 1 4 LEU H . . 5.070 4.059 3.083 4.763 . 0 0 "[ . 1 . 2]" 1
41 1 3 GLU HG3 1 4 LEU HA . . 5.500 5.107 4.473 5.591 0.091 9 0 "[ . 1 . 2]" 1
42 1 3 GLU HG3 1 5 PRO HD2 . . 5.160 3.973 3.424 4.661 . 0 0 "[ . 1 . 2]" 1
43 1 3 GLU HG3 1 5 PRO HD3 . . 4.160 3.025 2.300 3.601 . 0 0 "[ . 1 . 2]" 1
44 1 3 GLU HG3 1 5 PRO HG2 . . 5.500 4.884 4.464 5.161 . 0 0 "[ . 1 . 2]" 1
45 1 3 GLU HG3 1 5 PRO HG3 . . 3.650 3.649 3.316 3.739 0.089 20 0 "[ . 1 . 2]" 1
46 1 3 GLU HG3 1 29 THR HB . . 5.500 5.056 4.328 5.574 0.074 19 0 "[ . 1 . 2]" 1
47 1 3 GLU HG3 1 29 THR MG . . 4.660 2.452 2.147 3.074 . 0 0 "[ . 1 . 2]" 1
48 1 3 GLU HG3 1 35 GLY HA3 . . 5.500 3.634 2.631 4.443 . 0 0 "[ . 1 . 2]" 1
49 1 3 GLU HG3 1 36 ILE MG . . 4.420 2.681 2.133 3.411 . 0 0 "[ . 1 . 2]" 1
50 1 4 LEU H 1 4 LEU HB2 . . 3.990 3.904 3.820 4.038 0.048 12 0 "[ . 1 . 2]" 1
51 1 4 LEU H 1 4 LEU HB3 . . 3.800 3.588 3.369 3.801 0.001 12 0 "[ . 1 . 2]" 1
52 1 4 LEU H 1 4 LEU QD . . 4.390 2.164 1.903 3.164 . 0 0 "[ . 1 . 2]" 1
53 1 4 LEU H 1 5 PRO HB3 . . 5.500 4.920 4.654 5.217 . 0 0 "[ . 1 . 2]" 1
54 1 4 LEU H 1 5 PRO HD2 . . 5.500 3.632 3.268 4.075 . 0 0 "[ . 1 . 2]" 1
55 1 4 LEU H 1 5 PRO HD3 . . 5.500 2.561 2.286 2.873 . 0 0 "[ . 1 . 2]" 1
56 1 4 LEU H 1 34 GLN HA . . 4.960 4.990 4.736 5.041 0.081 6 0 "[ . 1 . 2]" 1
57 1 4 LEU H 1 36 ILE MD . . 5.230 2.617 1.785 3.534 . 0 0 "[ . 1 . 2]" 1
58 1 4 LEU H 1 36 ILE HG12 . . 5.500 3.582 2.781 4.288 . 0 0 "[ . 1 . 2]" 1
59 1 4 LEU H 1 36 ILE MG . . 5.500 3.412 2.869 3.828 . 0 0 "[ . 1 . 2]" 1
60 1 4 LEU HA 1 4 LEU QD . . 3.420 3.189 3.151 3.333 . 0 0 "[ . 1 . 2]" 1
61 1 4 LEU HA 1 5 PRO HD2 . . 3.460 2.375 2.273 2.514 . 0 0 "[ . 1 . 2]" 1
62 1 4 LEU HA 1 5 PRO HD3 . . 3.300 3.036 2.762 3.198 . 0 0 "[ . 1 . 2]" 1
63 1 4 LEU HA 1 5 PRO HG3 . . 4.850 4.909 4.739 4.936 0.086 14 0 "[ . 1 . 2]" 1
64 1 4 LEU HA 1 36 ILE MD . . 5.500 4.593 3.879 5.385 . 0 0 "[ . 1 . 2]" 1
65 1 4 LEU HB2 1 5 PRO HD3 . . 4.920 4.999 4.851 5.136 0.216 5 0 "[ . 1 . 2]" 1
66 1 4 LEU HB3 1 4 LEU QD . . 3.180 2.260 2.031 2.383 . 0 0 "[ . 1 . 2]" 1
67 1 4 LEU QD 1 5 PRO HD2 . . 5.190 4.429 4.259 4.831 . 0 0 "[ . 1 . 2]" 1
68 1 4 LEU QD 1 5 PRO HD3 . . 5.500 3.915 3.623 4.683 . 0 0 "[ . 1 . 2]" 1
69 1 4 LEU QD 1 27 PHE QE . . 5.500 3.516 3.109 4.058 . 0 0 "[ . 1 . 2]" 1
70 1 4 LEU QD 1 34 GLN HA . . 5.500 4.092 3.649 4.474 . 0 0 "[ . 1 . 2]" 1
71 1 4 LEU QD 1 34 GLN HB2 . . 5.500 4.183 3.584 4.678 . 0 0 "[ . 1 . 2]" 1
72 1 4 LEU QD 1 34 GLN HB3 . . 4.310 3.023 2.446 3.587 . 0 0 "[ . 1 . 2]" 1
73 1 4 LEU QD 1 34 GLN QE . . 4.480 3.392 2.233 3.986 . 0 0 "[ . 1 . 2]" 1
74 1 4 LEU QD 1 34 GLN QG . . 5.170 3.031 2.425 4.001 . 0 0 "[ . 1 . 2]" 1
75 1 4 LEU QD 1 36 ILE MD . . 4.030 2.650 2.081 3.160 . 0 0 "[ . 1 . 2]" 1
76 1 4 LEU QD 1 80 LEU QD . . 4.670 2.979 2.164 3.407 . 0 0 "[ . 1 . 2]" 1
77 1 5 PRO HB2 1 28 ASN HA . . 5.240 3.374 2.775 4.087 . 0 0 "[ . 1 . 2]" 1
78 1 5 PRO HB2 1 36 ILE MG . . 5.500 3.398 3.180 3.502 . 0 0 "[ . 1 . 2]" 1
79 1 5 PRO HB3 1 27 PHE H . . 5.500 5.205 4.735 5.574 0.074 20 0 "[ . 1 . 2]" 1
80 1 5 PRO HB3 1 27 PHE HB2 . . 5.480 4.746 4.275 5.233 . 0 0 "[ . 1 . 2]" 1
81 1 5 PRO HB3 1 27 PHE QD . . 5.500 3.574 2.744 4.621 . 0 0 "[ . 1 . 2]" 1
82 1 5 PRO HB3 1 27 PHE QE . . 5.500 3.789 3.099 4.611 . 0 0 "[ . 1 . 2]" 1
83 1 5 PRO HB3 1 27 PHE HZ . . 5.000 5.078 5.051 5.090 0.090 3 0 "[ . 1 . 2]" 1
84 1 5 PRO HB3 1 28 ASN H . . 5.500 4.832 4.404 5.489 . 0 0 "[ . 1 . 2]" 1
85 1 5 PRO HB3 1 28 ASN HA . . 4.870 3.088 2.733 3.670 . 0 0 "[ . 1 . 2]" 1
86 1 5 PRO HB3 1 29 THR H . . 5.500 4.667 4.327 4.956 . 0 0 "[ . 1 . 2]" 1
87 1 5 PRO HB3 1 29 THR HA . . 5.500 5.328 4.809 5.584 0.084 16 0 "[ . 1 . 2]" 1
88 1 5 PRO HB3 1 29 THR MG . . 5.500 5.184 4.227 5.597 0.097 2 0 "[ . 1 . 2]" 1
89 1 5 PRO HB3 1 36 ILE HB . . 5.290 3.640 3.389 3.899 . 0 0 "[ . 1 . 2]" 1
90 1 5 PRO HB3 1 36 ILE MD . . 4.710 2.910 2.458 3.327 . 0 0 "[ . 1 . 2]" 1
91 1 5 PRO HB3 1 36 ILE HG12 . . 5.420 4.870 4.319 5.295 . 0 0 "[ . 1 . 2]" 1
92 1 5 PRO HB3 1 36 ILE HG13 . . 5.500 5.265 4.929 5.567 0.067 19 0 "[ . 1 . 2]" 1
93 1 5 PRO HB3 1 36 ILE MG . . 3.780 2.016 1.952 2.100 . 0 0 "[ . 1 . 2]" 1
94 1 5 PRO HD2 1 36 ILE MD . . 5.500 4.446 3.696 5.385 . 0 0 "[ . 1 . 2]" 1
95 1 5 PRO HD3 1 36 ILE MD . . 5.500 3.087 2.315 4.117 . 0 0 "[ . 1 . 2]" 1
96 1 5 PRO HG2 1 36 ILE MD . . 5.500 4.928 4.428 5.586 0.086 13 0 "[ . 1 . 2]" 1
97 1 5 PRO HG3 1 28 ASN HA . . 5.500 3.544 3.057 4.190 . 0 0 "[ . 1 . 2]" 1
98 1 5 PRO HG3 1 29 THR MG . . 4.390 3.572 2.621 4.142 . 0 0 "[ . 1 . 2]" 1
99 1 5 PRO HG3 1 36 ILE MD . . 5.500 4.070 3.355 4.651 . 0 0 "[ . 1 . 2]" 1
100 1 5 PRO HG3 1 36 ILE MG . . 4.520 2.270 2.111 2.515 . 0 0 "[ . 1 . 2]" 1
101 1 6 PRO HD2 1 7 GLY HA2 . . 5.500 4.792 4.331 5.458 . 0 0 "[ . 1 . 2]" 1
102 1 6 PRO HD2 1 36 ILE MD . . 5.500 4.122 3.608 4.750 . 0 0 "[ . 1 . 2]" 1
103 1 7 GLY H 1 8 THR HA . . 5.500 4.849 4.401 5.498 . 0 0 "[ . 1 . 2]" 1
104 1 7 GLY H 1 26 THR HA . . 5.500 5.554 5.408 5.594 0.094 5 0 "[ . 1 . 2]" 1
105 1 7 GLY H 1 26 THR MG . . 5.500 5.098 4.667 5.389 . 0 0 "[ . 1 . 2]" 1
106 1 7 GLY H 1 27 PHE QD . . 5.330 4.709 4.314 5.115 . 0 0 "[ . 1 . 2]" 1
107 1 7 GLY H 1 27 PHE QE . . 5.500 3.994 3.499 4.353 . 0 0 "[ . 1 . 2]" 1
108 1 7 GLY H 1 27 PHE HZ . . 4.650 4.279 3.418 4.706 0.056 4 0 "[ . 1 . 2]" 1
109 1 7 GLY H 1 28 ASN HA . . 5.500 5.295 4.666 5.577 0.077 3 0 "[ . 1 . 2]" 1
110 1 7 GLY H 1 36 ILE MD . . 5.500 5.330 4.865 5.607 0.107 15 0 "[ . 1 . 2]" 1
111 1 7 GLY H 1 36 ILE MG . . 5.230 5.279 5.093 5.347 0.117 3 0 "[ . 1 . 2]" 1
112 1 7 GLY HA2 1 8 THR HA . . 5.500 4.536 4.261 4.763 . 0 0 "[ . 1 . 2]" 1
113 1 7 GLY HA2 1 26 THR MG . . 5.500 3.529 2.932 4.037 . 0 0 "[ . 1 . 2]" 1
114 1 7 GLY HA3 1 8 THR HA . . 5.500 4.749 4.380 5.329 . 0 0 "[ . 1 . 2]" 1
115 1 7 GLY HA3 1 26 THR MG . . 5.500 4.205 3.326 5.256 . 0 0 "[ . 1 . 2]" 1
116 1 8 THR H 1 8 THR HB . . 3.530 2.998 2.538 3.619 0.089 8 0 "[ . 1 . 2]" 1
117 1 8 THR H 1 8 THR MG . . 4.460 3.924 3.829 4.029 . 0 0 "[ . 1 . 2]" 1
118 1 8 THR H 1 9 TYR H . . 5.470 4.317 3.609 4.541 . 0 0 "[ . 1 . 2]" 1
119 1 8 THR H 1 26 THR HA . . 5.450 3.902 2.076 4.942 . 0 0 "[ . 1 . 2]" 1
120 1 8 THR H 1 26 THR MG . . 5.500 3.925 2.836 4.804 . 0 0 "[ . 1 . 2]" 1
121 1 8 THR H 1 27 PHE H . . 5.500 4.258 2.566 5.204 . 0 0 "[ . 1 . 2]" 1
122 1 8 THR H 1 27 PHE QD . . 5.500 4.726 2.955 5.590 0.090 2 0 "[ . 1 . 2]" 1
123 1 8 THR H 1 27 PHE QE . . 5.500 4.080 3.302 4.700 . 0 0 "[ . 1 . 2]" 1
124 1 8 THR H 1 27 PHE HZ . . 5.500 5.525 5.217 5.582 0.082 9 0 "[ . 1 . 2]" 1
125 1 8 THR HA 1 8 THR MG . . 3.560 2.451 2.286 2.627 . 0 0 "[ . 1 . 2]" 1
126 1 8 THR HA 1 9 TYR H . . 3.290 2.218 1.992 2.357 . 0 0 "[ . 1 . 2]" 1
127 1 8 THR HA 1 9 TYR HB2 . . 5.500 5.603 5.522 5.765 0.265 11 0 "[ . 1 . 2]" 1
128 1 8 THR HA 1 26 THR H . . 5.500 4.523 4.227 4.845 . 0 0 "[ . 1 . 2]" 1
129 1 8 THR HA 1 26 THR HA . . 3.550 2.152 1.992 2.425 . 0 0 "[ . 1 . 2]" 1
130 1 8 THR HA 1 26 THR MG . . 5.020 3.566 3.166 3.922 . 0 0 "[ . 1 . 2]" 1
131 1 8 THR HA 1 27 PHE H . . 4.130 3.478 3.135 3.978 . 0 0 "[ . 1 . 2]" 1
132 1 8 THR HA 1 27 PHE QD . . 4.970 3.218 2.683 3.831 . 0 0 "[ . 1 . 2]" 1
133 1 8 THR HA 1 27 PHE QE . . 5.110 3.174 2.625 3.845 . 0 0 "[ . 1 . 2]" 1
134 1 8 THR HB 1 9 TYR H . . 4.860 3.896 3.518 4.456 . 0 0 "[ . 1 . 2]" 1
135 1 8 THR HB 1 26 THR HA . . 4.940 4.543 4.133 5.023 0.083 10 0 "[ . 1 . 2]" 1
136 1 8 THR HB 1 26 THR MG . . 5.500 4.532 4.182 5.105 . 0 0 "[ . 1 . 2]" 1
137 1 8 THR HB 1 112 GLY HA3 . . 4.730 4.304 3.405 4.786 0.056 1 0 "[ . 1 . 2]" 1
138 1 8 THR MG 1 9 TYR H . . 3.520 2.362 1.695 3.114 . 0 0 "[ . 1 . 2]" 1
139 1 8 THR MG 1 9 TYR HA . . 5.300 3.598 3.210 3.994 . 0 0 "[ . 1 . 2]" 1
140 1 8 THR MG 1 10 ARG H . . 5.180 4.716 3.875 5.060 . 0 0 "[ . 1 . 2]" 1
141 1 8 THR MG 1 24 ASP H . . 5.100 5.081 4.858 5.214 0.114 10 0 "[ . 1 . 2]" 1
142 1 8 THR MG 1 24 ASP HA . . 4.670 3.428 2.957 3.867 . 0 0 "[ . 1 . 2]" 1
143 1 8 THR MG 1 24 ASP HB2 . . 3.380 3.485 3.195 3.543 0.163 16 0 "[ . 1 . 2]" 1
144 1 8 THR MG 1 24 ASP HB3 . . 3.880 2.465 2.106 4.014 0.134 10 0 "[ . 1 . 2]" 1
145 1 8 THR MG 1 25 VAL HA . . 5.500 3.997 3.474 5.137 . 0 0 "[ . 1 . 2]" 1
146 1 8 THR MG 1 25 VAL QG . . 5.150 4.088 3.025 4.835 . 0 0 "[ . 1 . 2]" 1
147 1 8 THR MG 1 26 THR H . . 5.180 3.786 3.252 4.207 . 0 0 "[ . 1 . 2]" 1
148 1 8 THR MG 1 26 THR HA . . 4.370 3.126 2.646 3.563 . 0 0 "[ . 1 . 2]" 1
149 1 8 THR MG 1 26 THR HB . . 5.500 4.572 3.954 5.389 . 0 0 "[ . 1 . 2]" 1
150 1 8 THR MG 1 26 THR MG . . 4.090 3.817 3.229 4.171 0.081 18 0 "[ . 1 . 2]" 1
151 1 8 THR MG 1 27 PHE H . . 5.310 5.011 4.604 5.392 0.082 13 0 "[ . 1 . 2]" 1
152 1 8 THR MG 1 27 PHE QD . . 5.500 4.680 4.011 5.287 . 0 0 "[ . 1 . 2]" 1
153 1 8 THR MG 1 27 PHE QE . . 5.500 4.680 3.963 5.286 . 0 0 "[ . 1 . 2]" 1
154 1 8 THR MG 1 112 GLY HA3 . . 5.320 2.625 2.181 4.148 . 0 0 "[ . 1 . 2]" 1
155 1 9 TYR H 1 9 TYR HD1 . . 4.270 2.232 1.940 2.397 . 0 0 "[ . 1 . 2]" 1
156 1 9 TYR H 1 9 TYR HE1 . . 5.360 4.561 4.350 4.810 . 0 0 "[ . 1 . 2]" 1
157 1 9 TYR H 1 10 ARG H . . 5.500 4.304 4.148 4.483 . 0 0 "[ . 1 . 2]" 1
158 1 9 TYR H 1 11 VAL QG . . 5.500 4.526 4.156 4.732 . 0 0 "[ . 1 . 2]" 1
159 1 9 TYR H 1 26 THR HA . . 4.410 3.746 3.547 3.974 . 0 0 "[ . 1 . 2]" 1
160 1 9 TYR H 1 26 THR MG . . 5.500 5.316 5.028 5.530 0.030 17 0 "[ . 1 . 2]" 1
161 1 9 TYR H 1 27 PHE H . . 5.470 5.061 4.839 5.401 . 0 0 "[ . 1 . 2]" 1
162 1 9 TYR H 1 27 PHE QD . . 4.530 3.753 3.538 3.974 . 0 0 "[ . 1 . 2]" 1
163 1 9 TYR H 1 27 PHE HZ . . 5.500 5.415 5.170 5.565 0.065 10 0 "[ . 1 . 2]" 1
164 1 9 TYR HA 1 10 ARG H . . 3.160 2.487 2.231 2.747 . 0 0 "[ . 1 . 2]" 1
165 1 9 TYR HA 1 27 PHE QE . . 4.180 4.225 4.054 4.272 0.092 7 0 "[ . 1 . 2]" 1
166 1 9 TYR HB2 1 10 ARG H . . 4.990 2.852 2.515 3.423 . 0 0 "[ . 1 . 2]" 1
167 1 9 TYR HB2 1 11 VAL QG . . 4.910 3.328 3.066 3.799 . 0 0 "[ . 1 . 2]" 1
168 1 9 TYR HB2 1 27 PHE QE . . 3.870 3.922 3.769 3.971 0.101 15 0 "[ . 1 . 2]" 1
169 1 9 TYR HB2 1 27 PHE HZ . . 5.500 4.589 4.263 4.961 . 0 0 "[ . 1 . 2]" 1
170 1 9 TYR HB2 1 80 LEU QD . . 5.270 4.577 4.244 4.863 . 0 0 "[ . 1 . 2]" 1
171 1 9 TYR HB3 1 9 TYR HE1 . . 5.500 5.032 4.910 5.122 . 0 0 "[ . 1 . 2]" 1
172 1 9 TYR HB3 1 10 ARG H . . 4.570 4.158 3.956 4.479 . 0 0 "[ . 1 . 2]" 1
173 1 9 TYR HB3 1 11 VAL QG . . 5.500 4.274 4.032 4.525 . 0 0 "[ . 1 . 2]" 1
174 1 9 TYR HB3 1 27 PHE QE . . 3.850 2.340 2.209 2.477 . 0 0 "[ . 1 . 2]" 1
175 1 9 TYR HB3 1 27 PHE HZ . . 5.400 3.174 2.944 3.413 . 0 0 "[ . 1 . 2]" 1
176 1 9 TYR HB3 1 80 LEU QD . . 5.260 4.396 3.803 4.724 . 0 0 "[ . 1 . 2]" 1
177 1 9 TYR HD1 1 10 ARG H . . 5.400 4.919 4.433 5.455 0.055 20 0 "[ . 1 . 2]" 1
178 1 9 TYR HD1 1 11 VAL QG . . 4.970 3.679 3.259 4.133 . 0 0 "[ . 1 . 2]" 1
179 1 9 TYR HD1 1 25 VAL HB . . 5.430 3.088 2.334 4.879 . 0 0 "[ . 1 . 2]" 1
180 1 9 TYR HD1 1 25 VAL QG . . 4.660 3.168 2.169 3.736 . 0 0 "[ . 1 . 2]" 1
181 1 9 TYR HD1 1 26 THR HA . . 5.500 4.282 3.990 4.516 . 0 0 "[ . 1 . 2]" 1
182 1 9 TYR HE1 1 11 VAL QG . . 4.550 3.326 2.913 3.790 . 0 0 "[ . 1 . 2]" 1
183 1 9 TYR HE1 1 25 VAL HA . . 5.500 5.037 4.709 5.535 0.035 14 0 "[ . 1 . 2]" 1
184 1 9 TYR HE1 1 25 VAL HB . . 3.910 2.704 2.078 3.997 0.087 11 0 "[ . 1 . 2]" 1
185 1 9 TYR HE1 1 25 VAL QG . . 4.030 2.300 1.857 3.292 . 0 0 "[ . 1 . 2]" 1
186 1 9 TYR HE1 1 26 THR H . . 5.500 5.520 5.164 5.592 0.092 16 0 "[ . 1 . 2]" 1
187 1 9 TYR HE1 1 27 PHE H . . 5.500 5.511 5.236 5.589 0.089 11 0 "[ . 1 . 2]" 1
188 1 9 TYR HE1 1 27 PHE HB3 . . 5.500 3.946 3.470 4.373 . 0 0 "[ . 1 . 2]" 1
189 1 9 TYR HE1 1 38 PRO HA . . 5.500 5.257 4.858 5.544 0.044 3 0 "[ . 1 . 2]" 1
190 1 9 TYR HE1 1 38 PRO HB3 . . 5.300 3.976 3.541 4.507 . 0 0 "[ . 1 . 2]" 1
191 1 9 TYR HE1 1 80 LEU HB2 . . 5.250 4.538 3.912 5.144 . 0 0 "[ . 1 . 2]" 1
192 1 9 TYR HE1 1 80 LEU QD . . 4.250 3.760 2.950 4.137 . 0 0 "[ . 1 . 2]" 1
193 1 9 TYR HE1 1 87 LEU HA . . 5.500 5.348 4.629 5.595 0.095 5 0 "[ . 1 . 2]" 1
194 1 9 TYR HE1 1 87 LEU HB3 . . 5.500 5.561 5.390 5.836 0.336 10 0 "[ . 1 . 2]" 1
195 1 9 TYR HE1 1 87 LEU QD . . 3.800 3.278 2.717 3.748 . 0 0 "[ . 1 . 2]" 1
196 1 10 ARG H 1 10 ARG HB3 . . 3.590 2.709 2.305 3.023 . 0 0 "[ . 1 . 2]" 1
197 1 10 ARG H 1 10 ARG HG2 . . 5.500 4.577 4.422 4.761 . 0 0 "[ . 1 . 2]" 1
198 1 10 ARG H 1 10 ARG HG3 . . 5.500 4.788 4.246 5.016 . 0 0 "[ . 1 . 2]" 1
199 1 10 ARG H 1 11 VAL QG . . 5.500 3.209 2.788 3.824 . 0 0 "[ . 1 . 2]" 1
200 1 10 ARG H 1 24 ASP HA . . 5.320 4.545 3.984 4.970 . 0 0 "[ . 1 . 2]" 1
201 1 10 ARG H 1 85 GLN HE21 . . 5.500 4.188 2.861 5.409 . 0 0 "[ . 1 . 2]" 1
202 1 10 ARG HA 1 10 ARG HD3 . . 5.500 3.707 2.577 4.441 . 0 0 "[ . 1 . 2]" 1
203 1 10 ARG HA 1 10 ARG HE . . 5.200 4.765 3.350 5.229 0.029 19 0 "[ . 1 . 2]" 1
204 1 10 ARG HA 1 11 VAL QG . . 4.950 3.017 2.725 3.480 . 0 0 "[ . 1 . 2]" 1
205 1 10 ARG HA 1 22 THR MG . . 5.500 5.113 4.869 5.470 . 0 0 "[ . 1 . 2]" 1
206 1 10 ARG HB3 1 10 ARG HD2 . . 3.860 2.872 2.208 4.267 0.407 18 0 "[ . 1 . 2]" 1
207 1 10 ARG HB3 1 10 ARG HD3 . . 3.890 3.549 3.112 3.971 0.081 20 0 "[ . 1 . 2]" 1
208 1 10 ARG HB3 1 11 VAL HA . . 5.500 4.909 4.546 5.170 . 0 0 "[ . 1 . 2]" 1
209 1 10 ARG HB3 1 24 ASP HA . . 5.390 4.334 3.949 4.611 . 0 0 "[ . 1 . 2]" 1
210 1 10 ARG HD2 1 11 VAL H . . 4.640 3.730 2.136 4.731 0.091 20 0 "[ . 1 . 2]" 1
211 1 10 ARG HD2 1 22 THR MG . . 5.060 3.211 2.356 4.539 . 0 0 "[ . 1 . 2]" 1
212 1 10 ARG HD2 1 24 ASP HA . . 5.430 5.036 3.429 5.514 0.084 16 0 "[ . 1 . 2]" 1
213 1 10 ARG HD3 1 11 VAL H . . 4.720 3.480 2.456 4.311 . 0 0 "[ . 1 . 2]" 1
214 1 10 ARG HD3 1 11 VAL HA . . 5.500 4.755 3.491 6.221 0.721 3 2 "[ + .- 1 . 2]" 1
215 1 10 ARG HD3 1 11 VAL QG . . 5.500 4.752 4.107 5.370 . 0 0 "[ . 1 . 2]" 1
216 1 10 ARG HD3 1 22 THR MG . . 4.880 2.815 2.108 4.238 . 0 0 "[ . 1 . 2]" 1
217 1 10 ARG HD3 1 23 ARG H . . 5.500 4.090 3.264 4.840 . 0 0 "[ . 1 . 2]" 1
218 1 10 ARG HD3 1 23 ARG HA . . 5.420 3.520 2.436 5.218 . 0 0 "[ . 1 . 2]" 1
219 1 10 ARG HD3 1 24 ASP H . . 5.500 4.496 2.334 5.557 0.057 5 0 "[ . 1 . 2]" 1
220 1 10 ARG HD3 1 24 ASP HA . . 5.500 4.505 2.850 5.206 . 0 0 "[ . 1 . 2]" 1
221 1 10 ARG HD3 1 25 VAL QG . . 5.500 5.317 4.528 5.847 0.347 12 0 "[ . 1 . 2]" 1
222 1 10 ARG HE 1 24 ASP HA . . 5.500 5.090 3.298 5.589 0.089 14 0 "[ . 1 . 2]" 1
223 1 10 ARG HG2 1 11 VAL H . . 4.800 3.212 2.110 4.749 . 0 0 "[ . 1 . 2]" 1
224 1 10 ARG HG2 1 11 VAL HA . . 5.500 5.090 4.000 5.739 0.239 3 0 "[ . 1 . 2]" 1
225 1 10 ARG HG2 1 11 VAL QG . . 5.040 4.450 3.656 5.347 0.307 3 0 "[ . 1 . 2]" 1
226 1 10 ARG HG2 1 22 THR MG . . 4.270 4.023 2.949 4.446 0.176 3 0 "[ . 1 . 2]" 1
227 1 10 ARG HG2 1 23 ARG HA . . 5.500 3.725 2.894 5.328 . 0 0 "[ . 1 . 2]" 1
228 1 10 ARG HG2 1 24 ASP HA . . 5.500 3.160 2.142 5.292 . 0 0 "[ . 1 . 2]" 1
229 1 10 ARG HG3 1 11 VAL H . . 4.690 4.177 2.112 4.773 0.083 9 0 "[ . 1 . 2]" 1
230 1 10 ARG HG3 1 23 ARG HA . . 5.500 4.159 2.768 5.427 . 0 0 "[ . 1 . 2]" 1
231 1 10 ARG HG3 1 24 ASP H . . 4.860 4.097 2.911 5.506 0.646 3 2 "[ + . 1 . - 2]" 1
232 1 10 ARG HG3 1 24 ASP HA . . 5.340 3.652 2.288 5.233 . 0 0 "[ . 1 . 2]" 1
233 1 11 VAL H 1 11 VAL QG . . 3.630 2.305 2.168 2.523 . 0 0 "[ . 1 . 2]" 1
234 1 11 VAL H 1 23 ARG HA . . 5.500 4.897 4.481 5.399 . 0 0 "[ . 1 . 2]" 1
235 1 11 VAL H 1 24 ASP HA . . 4.320 3.980 3.599 4.282 . 0 0 "[ . 1 . 2]" 1
236 1 11 VAL H 1 25 VAL H . . 5.100 4.700 4.142 5.155 0.055 11 0 "[ . 1 . 2]" 1
237 1 11 VAL H 1 25 VAL QG . . 5.430 3.128 2.881 3.389 . 0 0 "[ . 1 . 2]" 1
238 1 11 VAL HA 1 12 ASP H . . 3.210 2.630 2.446 2.826 . 0 0 "[ . 1 . 2]" 1
239 1 11 VAL HA 1 12 ASP HA . . 5.500 4.538 4.227 4.665 . 0 0 "[ . 1 . 2]" 1
240 1 11 VAL HA 1 12 ASP HB3 . . 5.500 5.606 4.937 6.000 0.500 3 0 "[ . 1 . 2]" 1
241 1 11 VAL HA 1 22 THR MG . . 5.500 3.734 3.239 4.326 . 0 0 "[ . 1 . 2]" 1
242 1 11 VAL HA 1 85 GLN HA . . 5.500 5.237 4.709 5.561 0.061 13 0 "[ . 1 . 2]" 1
243 1 11 VAL HA 1 85 GLN HB2 . . 5.190 4.886 4.411 5.319 0.129 13 0 "[ . 1 . 2]" 1
244 1 11 VAL HA 1 85 GLN HB3 . . 4.180 3.417 3.183 3.673 . 0 0 "[ . 1 . 2]" 1
245 1 11 VAL HA 1 85 GLN HE21 . . 5.500 5.134 3.779 5.580 0.080 9 0 "[ . 1 . 2]" 1
246 1 11 VAL HA 1 85 GLN HG2 . . 5.370 5.439 5.321 5.500 0.130 11 0 "[ . 1 . 2]" 1
247 1 11 VAL HA 1 86 ARG HA . . 4.920 4.522 4.075 4.909 . 0 0 "[ . 1 . 2]" 1
248 1 11 VAL HB 1 12 ASP H . . 3.910 2.172 1.954 2.377 . 0 0 "[ . 1 . 2]" 1
249 1 11 VAL HB 1 12 ASP HA . . 5.500 4.531 4.364 4.781 . 0 0 "[ . 1 . 2]" 1
250 1 11 VAL HB 1 12 ASP HB2 . . 5.500 4.666 4.023 5.633 0.133 4 0 "[ . 1 . 2]" 1
251 1 11 VAL HB 1 80 LEU QD . . 5.500 4.971 4.704 5.435 . 0 0 "[ . 1 . 2]" 1
252 1 11 VAL HB 1 86 ARG H . . 5.500 4.027 3.633 4.280 . 0 0 "[ . 1 . 2]" 1
253 1 11 VAL HB 1 86 ARG HA . . 4.410 2.337 2.045 2.618 . 0 0 "[ . 1 . 2]" 1
254 1 11 VAL HB 1 86 ARG HB2 . . 5.500 4.463 4.094 4.758 . 0 0 "[ . 1 . 2]" 1
255 1 11 VAL HB 1 87 LEU H . . 4.130 3.575 2.630 4.174 0.044 18 0 "[ . 1 . 2]" 1
256 1 11 VAL QG 1 12 ASP H . . 4.320 3.050 2.755 3.192 . 0 0 "[ . 1 . 2]" 1
257 1 11 VAL QG 1 13 ILE H . . 5.500 4.009 3.217 4.471 . 0 0 "[ . 1 . 2]" 1
258 1 11 VAL QG 1 13 ILE HA . . 4.450 3.502 3.203 4.030 . 0 0 "[ . 1 . 2]" 1
259 1 11 VAL QG 1 13 ILE HG12 . . 4.230 3.468 2.401 4.260 0.030 20 0 "[ . 1 . 2]" 1
260 1 11 VAL QG 1 13 ILE HG13 . . 5.350 2.778 2.317 3.429 . 0 0 "[ . 1 . 2]" 1
261 1 11 VAL QG 1 14 TYR H . . 5.500 5.087 4.788 5.428 . 0 0 "[ . 1 . 2]" 1
262 1 11 VAL QG 1 22 THR HA . . 5.500 4.459 4.237 4.670 . 0 0 "[ . 1 . 2]" 1
263 1 11 VAL QG 1 22 THR MG . . 5.500 4.264 4.058 4.546 . 0 0 "[ . 1 . 2]" 1
264 1 11 VAL QG 1 25 VAL H . . 4.640 4.025 3.316 4.337 . 0 0 "[ . 1 . 2]" 1
265 1 11 VAL QG 1 25 VAL HA . . 5.500 5.120 4.698 5.405 . 0 0 "[ . 1 . 2]" 1
266 1 11 VAL QG 1 25 VAL HB . . 3.870 3.223 2.725 3.799 . 0 0 "[ . 1 . 2]" 1
267 1 11 VAL QG 1 25 VAL QG . . 3.760 2.193 1.855 2.528 . 0 0 "[ . 1 . 2]" 1
268 1 11 VAL QG 1 80 LEU QD . . 3.630 3.167 2.936 3.372 . 0 0 "[ . 1 . 2]" 1
269 1 11 VAL QG 1 85 GLN H . . 5.500 4.419 4.160 4.556 . 0 0 "[ . 1 . 2]" 1
270 1 11 VAL QG 1 85 GLN HA . . 4.470 2.603 2.343 2.816 . 0 0 "[ . 1 . 2]" 1
271 1 11 VAL QG 1 85 GLN HB2 . . 5.500 3.586 3.471 3.800 . 0 0 "[ . 1 . 2]" 1
272 1 11 VAL QG 1 85 GLN HB3 . . 5.160 2.098 1.988 2.301 . 0 0 "[ . 1 . 2]" 1
273 1 11 VAL QG 1 85 GLN HE21 . . 5.500 3.072 1.798 4.082 . 0 0 "[ . 1 . 2]" 1
274 1 11 VAL QG 1 85 GLN HG2 . . 5.500 3.001 2.619 3.507 . 0 0 "[ . 1 . 2]" 1
275 1 11 VAL QG 1 85 GLN HG3 . . 5.500 4.109 3.800 4.486 . 0 0 "[ . 1 . 2]" 1
276 1 11 VAL QG 1 86 ARG H . . 4.940 3.148 2.816 3.466 . 0 0 "[ . 1 . 2]" 1
277 1 11 VAL QG 1 86 ARG HA . . 5.050 2.935 2.553 3.189 . 0 0 "[ . 1 . 2]" 1
278 1 11 VAL QG 1 87 LEU H . . 4.890 3.125 2.461 4.064 . 0 0 "[ . 1 . 2]" 1
279 1 11 VAL QG 1 87 LEU HB2 . . 4.930 2.361 1.941 2.976 . 0 0 "[ . 1 . 2]" 1
280 1 11 VAL QG 1 87 LEU HB3 . . 3.980 3.306 2.562 3.815 . 0 0 "[ . 1 . 2]" 1
281 1 11 VAL QG 1 87 LEU QD . . 3.760 3.292 2.895 3.560 . 0 0 "[ . 1 . 2]" 1
282 1 11 VAL QG 1 87 LEU HG . . 5.500 4.155 2.376 5.379 . 0 0 "[ . 1 . 2]" 1
283 1 12 ASP H 1 13 ILE H . . 5.500 4.280 3.641 4.408 . 0 0 "[ . 1 . 2]" 1
284 1 12 ASP H 1 13 ILE HA . . 4.910 4.953 4.534 4.997 0.087 16 0 "[ . 1 . 2]" 1
285 1 12 ASP H 1 14 TYR QD . . 5.500 5.030 4.307 5.577 0.077 12 0 "[ . 1 . 2]" 1
286 1 12 ASP H 1 19 TYR QE . . 5.500 5.403 5.122 5.598 0.098 1 0 "[ . 1 . 2]" 1
287 1 12 ASP H 1 22 THR HA . . 5.500 4.762 4.535 5.085 . 0 0 "[ . 1 . 2]" 1
288 1 12 ASP H 1 22 THR MG . . 5.500 3.848 3.454 4.378 . 0 0 "[ . 1 . 2]" 1
289 1 12 ASP H 1 85 GLN HB3 . . 5.500 4.543 4.188 5.030 . 0 0 "[ . 1 . 2]" 1
290 1 12 ASP H 1 86 ARG H . . 5.500 5.299 4.860 5.519 0.019 9 0 "[ . 1 . 2]" 1
291 1 12 ASP H 1 86 ARG HA . . 3.960 2.871 2.428 3.044 . 0 0 "[ . 1 . 2]" 1
292 1 12 ASP H 1 86 ARG HB2 . . 5.500 4.240 3.509 4.697 . 0 0 "[ . 1 . 2]" 1
293 1 12 ASP H 1 86 ARG HB3 . . 5.500 5.494 4.068 5.589 0.089 8 0 "[ . 1 . 2]" 1
294 1 12 ASP H 1 86 ARG HG2 . . 5.500 5.439 5.163 5.849 0.349 19 0 "[ . 1 . 2]" 1
295 1 12 ASP H 1 87 LEU H . . 4.820 4.175 3.761 4.616 . 0 0 "[ . 1 . 2]" 1
296 1 12 ASP HA 1 13 ILE H . . 3.610 2.164 2.030 2.653 . 0 0 "[ . 1 . 2]" 1
297 1 12 ASP HA 1 13 ILE HB . . 5.500 4.446 3.996 4.905 . 0 0 "[ . 1 . 2]" 1
298 1 12 ASP HA 1 13 ILE MD . . 5.500 4.154 3.121 4.929 . 0 0 "[ . 1 . 2]" 1
299 1 12 ASP HA 1 14 TYR QD . . 5.500 4.785 4.417 5.215 . 0 0 "[ . 1 . 2]" 1
300 1 12 ASP HA 1 19 TYR QD . . 5.500 4.362 3.907 5.076 . 0 0 "[ . 1 . 2]" 1
301 1 12 ASP HA 1 19 TYR QE . . 4.880 2.909 2.533 3.623 . 0 0 "[ . 1 . 2]" 1
302 1 12 ASP HA 1 22 THR H . . 5.500 4.777 4.391 5.029 . 0 0 "[ . 1 . 2]" 1
303 1 12 ASP HA 1 22 THR HA . . 4.070 2.399 2.085 2.635 . 0 0 "[ . 1 . 2]" 1
304 1 12 ASP HA 1 22 THR MG . . 4.760 2.804 2.273 3.305 . 0 0 "[ . 1 . 2]" 1
305 1 12 ASP HA 1 23 ARG H . . 4.840 4.206 3.771 4.735 . 0 0 "[ . 1 . 2]" 1
306 1 12 ASP HB2 1 13 ILE H . . 5.500 3.973 2.516 4.634 . 0 0 "[ . 1 . 2]" 1
307 1 12 ASP HB2 1 14 TYR QD . . 4.600 3.408 2.582 4.568 . 0 0 "[ . 1 . 2]" 1
308 1 12 ASP HB2 1 19 TYR QE . . 5.300 3.695 2.105 4.616 . 0 0 "[ . 1 . 2]" 1
309 1 12 ASP HB2 1 22 THR HA . . 5.500 5.087 4.275 5.535 0.035 3 0 "[ . 1 . 2]" 1
310 1 12 ASP HB2 1 86 ARG HA . . 4.980 4.258 3.315 5.122 0.142 4 0 "[ . 1 . 2]" 1
311 1 12 ASP HB2 1 86 ARG HG2 . . 5.500 5.417 4.834 6.071 0.571 9 1 "[ . +1 . 2]" 1
312 1 12 ASP HB2 1 87 LEU H . . 5.500 5.031 4.325 5.480 . 0 0 "[ . 1 . 2]" 1
313 1 12 ASP HB3 1 13 ILE H . . 5.500 3.699 3.138 4.466 . 0 0 "[ . 1 . 2]" 1
314 1 12 ASP HB3 1 14 TYR QD . . 4.470 3.283 2.109 4.564 0.094 5 0 "[ . 1 . 2]" 1
315 1 12 ASP HB3 1 19 TYR QD . . 5.500 3.285 2.471 4.674 . 0 0 "[ . 1 . 2]" 1
316 1 12 ASP HB3 1 19 TYR QE . . 4.780 2.981 2.261 3.973 . 0 0 "[ . 1 . 2]" 1
317 1 12 ASP HB3 1 22 THR HA . . 5.500 4.727 3.798 5.471 . 0 0 "[ . 1 . 2]" 1
318 1 12 ASP HB3 1 22 THR MG . . 5.500 4.154 3.073 4.868 . 0 0 "[ . 1 . 2]" 1
319 1 12 ASP HB3 1 86 ARG HA . . 5.500 4.960 4.324 5.565 0.065 7 0 "[ . 1 . 2]" 1
320 1 13 ILE H 1 13 ILE HB . . 4.050 2.404 2.285 2.598 . 0 0 "[ . 1 . 2]" 1
321 1 13 ILE H 1 13 ILE MD . . 4.590 3.036 2.000 3.692 . 0 0 "[ . 1 . 2]" 1
322 1 13 ILE H 1 13 ILE HG12 . . 4.480 3.935 3.492 4.281 . 0 0 "[ . 1 . 2]" 1
323 1 13 ILE H 1 13 ILE HG13 . . 5.260 2.738 1.943 3.419 . 0 0 "[ . 1 . 2]" 1
324 1 13 ILE H 1 13 ILE MG . . 4.510 3.754 3.687 3.792 . 0 0 "[ . 1 . 2]" 1
325 1 13 ILE H 1 14 TYR H . . 5.500 4.460 4.066 4.592 . 0 0 "[ . 1 . 2]" 1
326 1 13 ILE H 1 14 TYR QD . . 5.500 4.490 3.923 5.237 . 0 0 "[ . 1 . 2]" 1
327 1 13 ILE H 1 19 TYR QD . . 5.500 4.102 3.537 5.219 . 0 0 "[ . 1 . 2]" 1
328 1 13 ILE H 1 19 TYR QE . . 5.400 3.273 2.610 4.040 . 0 0 "[ . 1 . 2]" 1
329 1 13 ILE H 1 20 MET H . . 5.500 4.248 3.765 5.455 . 0 0 "[ . 1 . 2]" 1
330 1 13 ILE H 1 21 ALA H . . 4.340 3.221 2.785 4.383 0.043 9 0 "[ . 1 . 2]" 1
331 1 13 ILE H 1 21 ALA HA . . 5.500 4.858 4.672 5.487 . 0 0 "[ . 1 . 2]" 1
332 1 13 ILE H 1 22 THR HA . . 4.650 3.012 2.615 3.470 . 0 0 "[ . 1 . 2]" 1
333 1 13 ILE H 1 22 THR MG . . 5.500 4.406 3.887 4.923 . 0 0 "[ . 1 . 2]" 1
334 1 13 ILE H 1 23 ARG H . . 5.500 4.204 3.254 4.913 . 0 0 "[ . 1 . 2]" 1
335 1 13 ILE HA 1 13 ILE MD . . 4.110 3.825 3.352 4.034 . 0 0 "[ . 1 . 2]" 1
336 1 13 ILE HA 1 14 TYR H . . 3.490 2.191 2.048 2.298 . 0 0 "[ . 1 . 2]" 1
337 1 13 ILE HA 1 14 TYR HB3 . . 5.360 5.170 4.663 5.428 0.068 5 0 "[ . 1 . 2]" 1
338 1 13 ILE HA 1 14 TYR QD . . 5.490 4.383 3.858 4.727 . 0 0 "[ . 1 . 2]" 1
339 1 13 ILE HA 1 21 ALA H . . 5.270 4.929 4.702 5.332 0.062 9 0 "[ . 1 . 2]" 1
340 1 13 ILE HA 1 25 VAL QG . . 5.500 4.325 3.944 4.835 . 0 0 "[ . 1 . 2]" 1
341 1 13 ILE HA 1 86 ARG HA . . 5.500 4.524 4.370 4.788 . 0 0 "[ . 1 . 2]" 1
342 1 13 ILE HA 1 87 LEU H . . 4.600 2.827 2.630 3.020 . 0 0 "[ . 1 . 2]" 1
343 1 13 ILE HA 1 87 LEU HA . . 4.540 4.610 4.489 4.648 0.108 9 0 "[ . 1 . 2]" 1
344 1 13 ILE HA 1 87 LEU HB2 . . 5.100 3.328 2.209 3.739 . 0 0 "[ . 1 . 2]" 1
345 1 13 ILE HA 1 87 LEU HB3 . . 5.500 2.132 1.985 2.837 . 0 0 "[ . 1 . 2]" 1
346 1 13 ILE HA 1 87 LEU QD . . 5.070 3.385 2.862 3.583 . 0 0 "[ . 1 . 2]" 1
347 1 13 ILE HA 1 88 ASN HA . . 5.500 5.400 5.083 5.571 0.071 18 0 "[ . 1 . 2]" 1
348 1 13 ILE HA 1 89 LEU QD . . 5.050 4.057 3.521 4.715 . 0 0 "[ . 1 . 2]" 1
349 1 13 ILE HB 1 14 TYR H . . 5.500 4.197 4.043 4.469 . 0 0 "[ . 1 . 2]" 1
350 1 13 ILE HB 1 19 TYR QE . . 5.500 4.810 4.330 5.570 0.070 5 0 "[ . 1 . 2]" 1
351 1 13 ILE HB 1 20 MET H . . 5.500 4.089 3.579 4.692 . 0 0 "[ . 1 . 2]" 1
352 1 13 ILE HB 1 21 ALA H . . 3.730 2.501 2.198 2.943 . 0 0 "[ . 1 . 2]" 1
353 1 13 ILE HB 1 21 ALA MB . . 5.500 3.190 2.403 4.387 . 0 0 "[ . 1 . 2]" 1
354 1 13 ILE MD 1 13 ILE MG . . 3.290 2.421 2.072 3.149 . 0 0 "[ . 1 . 2]" 1
355 1 13 ILE MD 1 14 TYR H . . 5.500 5.245 5.016 5.540 0.040 5 0 "[ . 1 . 2]" 1
356 1 13 ILE MD 1 19 TYR QE . . 5.500 5.152 4.595 5.602 0.102 5 0 "[ . 1 . 2]" 1
357 1 13 ILE MD 1 20 MET HB3 . . 5.500 4.901 4.055 5.583 0.083 5 0 "[ . 1 . 2]" 1
358 1 13 ILE MD 1 21 ALA H . . 5.420 3.726 3.032 4.052 . 0 0 "[ . 1 . 2]" 1
359 1 13 ILE MD 1 21 ALA MB . . 4.680 2.594 2.128 3.973 . 0 0 "[ . 1 . 2]" 1
360 1 13 ILE MD 1 22 THR H . . 5.500 4.042 3.524 4.876 . 0 0 "[ . 1 . 2]" 1
361 1 13 ILE MD 1 22 THR HA . . 5.500 3.186 2.391 4.270 . 0 0 "[ . 1 . 2]" 1
362 1 13 ILE MD 1 22 THR MG . . 5.500 4.608 3.891 5.402 . 0 0 "[ . 1 . 2]" 1
363 1 13 ILE MD 1 23 ARG H . . 5.070 2.469 1.796 3.534 . 0 0 "[ . 1 . 2]" 1
364 1 13 ILE MD 1 23 ARG HA . . 5.500 4.347 3.959 4.848 . 0 0 "[ . 1 . 2]" 1
365 1 13 ILE MD 1 23 ARG HB2 . . 5.500 2.588 1.992 4.347 . 0 0 "[ . 1 . 2]" 1
366 1 13 ILE MD 1 23 ARG HB3 . . 5.330 3.937 3.391 4.796 . 0 0 "[ . 1 . 2]" 1
367 1 13 ILE MD 1 23 ARG HD3 . . 5.500 5.160 3.624 5.574 0.074 18 0 "[ . 1 . 2]" 1
368 1 13 ILE MD 1 23 ARG QG . . 5.500 3.289 2.612 3.809 . 0 0 "[ . 1 . 2]" 1
369 1 13 ILE MD 1 24 ASP H . . 5.500 4.915 4.326 5.425 . 0 0 "[ . 1 . 2]" 1
370 1 13 ILE MD 1 25 VAL QG . . 5.350 2.435 1.984 3.998 . 0 0 "[ . 1 . 2]" 1
371 1 13 ILE MD 1 87 LEU HB2 . . 5.420 4.854 4.205 5.494 0.074 16 0 "[ . 1 . 2]" 1
372 1 13 ILE MD 1 87 LEU QD . . 3.740 3.547 3.147 3.813 0.073 8 0 "[ . 1 . 2]" 1
373 1 13 ILE MD 1 109 TRP HH2 . . 5.160 5.028 4.421 5.255 0.095 1 0 "[ . 1 . 2]" 1
374 1 13 ILE MD 1 109 TRP HZ2 . . 5.500 4.187 3.617 4.586 . 0 0 "[ . 1 . 2]" 1
375 1 13 ILE HG12 1 22 THR HA . . 5.500 5.296 4.561 5.593 0.093 15 0 "[ . 1 . 2]" 1
376 1 13 ILE HG12 1 25 VAL QG . . 4.930 2.668 2.169 3.855 . 0 0 "[ . 1 . 2]" 1
377 1 13 ILE HG12 1 87 LEU HB2 . . 4.720 3.798 2.794 4.743 0.023 4 0 "[ . 1 . 2]" 1
378 1 13 ILE HG12 1 87 LEU HB3 . . 5.500 3.201 2.545 4.117 . 0 0 "[ . 1 . 2]" 1
379 1 13 ILE HG12 1 87 LEU QD . . 5.080 2.501 2.151 2.842 . 0 0 "[ . 1 . 2]" 1
380 1 13 ILE HG13 1 14 TYR H . . 5.500 4.800 4.304 5.227 . 0 0 "[ . 1 . 2]" 1
381 1 13 ILE HG13 1 87 LEU HB2 . . 5.500 3.983 2.799 4.619 . 0 0 "[ . 1 . 2]" 1
382 1 13 ILE MG 1 14 TYR H . . 4.010 2.703 2.443 3.299 . 0 0 "[ . 1 . 2]" 1
383 1 13 ILE MG 1 14 TYR HA . . 5.430 3.906 3.523 4.377 . 0 0 "[ . 1 . 2]" 1
384 1 13 ILE MG 1 14 TYR HB2 . . 5.500 4.652 4.507 5.047 . 0 0 "[ . 1 . 2]" 1
385 1 13 ILE MG 1 14 TYR HB3 . . 5.500 5.233 5.015 5.601 0.101 5 0 "[ . 1 . 2]" 1
386 1 13 ILE MG 1 15 LEU H . . 5.500 4.486 3.547 5.147 . 0 0 "[ . 1 . 2]" 1
387 1 13 ILE MG 1 15 LEU HA . . 5.500 4.955 4.577 5.356 . 0 0 "[ . 1 . 2]" 1
388 1 13 ILE MG 1 20 MET H . . 5.500 4.229 3.788 4.762 . 0 0 "[ . 1 . 2]" 1
389 1 13 ILE MG 1 20 MET HB2 . . 5.280 2.555 2.251 3.536 . 0 0 "[ . 1 . 2]" 1
390 1 13 ILE MG 1 20 MET HB3 . . 5.410 3.642 3.195 4.742 . 0 0 "[ . 1 . 2]" 1
391 1 13 ILE MG 1 20 MET HG2 . . 5.030 3.721 2.715 4.731 . 0 0 "[ . 1 . 2]" 1
392 1 13 ILE MG 1 20 MET HG3 . . 5.310 3.326 2.793 4.472 . 0 0 "[ . 1 . 2]" 1
393 1 13 ILE MG 1 21 ALA H . . 5.150 3.605 3.366 4.020 . 0 0 "[ . 1 . 2]" 1
394 1 13 ILE MG 1 25 VAL QG . . 5.500 3.712 2.957 4.599 . 0 0 "[ . 1 . 2]" 1
395 1 13 ILE MG 1 48 MET ME . . 2.810 2.224 1.965 2.892 0.082 9 0 "[ . 1 . 2]" 1
396 1 13 ILE MG 1 87 LEU H . . 5.500 4.592 4.292 4.916 . 0 0 "[ . 1 . 2]" 1
397 1 13 ILE MG 1 87 LEU HB2 . . 5.050 4.008 2.629 4.718 . 0 0 "[ . 1 . 2]" 1
398 1 14 TYR H 1 14 TYR QD . . 4.620 3.870 3.409 4.189 . 0 0 "[ . 1 . 2]" 1
399 1 14 TYR H 1 15 LEU H . . 5.500 4.291 3.786 4.559 . 0 0 "[ . 1 . 2]" 1
400 1 14 TYR H 1 19 TYR HA . . 5.500 5.140 4.660 5.457 . 0 0 "[ . 1 . 2]" 1
401 1 14 TYR H 1 20 MET H . . 5.500 4.991 4.589 5.212 . 0 0 "[ . 1 . 2]" 1
402 1 14 TYR H 1 20 MET HG2 . . 5.500 5.074 3.999 5.591 0.091 14 0 "[ . 1 . 2]" 1
403 1 14 TYR H 1 86 ARG HA . . 5.500 5.419 4.936 5.577 0.077 8 0 "[ . 1 . 2]" 1
404 1 14 TYR H 1 86 ARG HG2 . . 5.500 4.165 3.709 5.735 0.235 19 0 "[ . 1 . 2]" 1
405 1 14 TYR H 1 87 LEU H . . 5.130 3.467 3.040 3.916 . 0 0 "[ . 1 . 2]" 1
406 1 14 TYR H 1 87 LEU HA . . 5.500 4.770 4.617 4.908 . 0 0 "[ . 1 . 2]" 1
407 1 14 TYR H 1 87 LEU HB2 . . 5.360 4.551 3.467 5.021 . 0 0 "[ . 1 . 2]" 1
408 1 14 TYR H 1 87 LEU HG . . 5.500 4.755 3.929 5.593 0.093 11 0 "[ . 1 . 2]" 1
409 1 14 TYR H 1 88 ASN HA . . 4.410 3.636 3.315 3.848 . 0 0 "[ . 1 . 2]" 1
410 1 14 TYR H 1 89 LEU H . . 4.750 3.958 3.592 4.562 . 0 0 "[ . 1 . 2]" 1
411 1 14 TYR H 1 89 LEU QD . . 5.500 3.332 2.612 4.581 . 0 0 "[ . 1 . 2]" 1
412 1 14 TYR H 1 89 LEU HG . . 5.500 4.318 3.360 5.582 0.082 8 0 "[ . 1 . 2]" 1
413 1 14 TYR HA 1 15 LEU H . . 3.370 2.252 2.192 2.333 . 0 0 "[ . 1 . 2]" 1
414 1 14 TYR HA 1 15 LEU HB2 . . 5.400 4.662 4.301 5.091 . 0 0 "[ . 1 . 2]" 1
415 1 14 TYR HA 1 15 LEU HB3 . . 5.500 4.585 4.386 4.770 . 0 0 "[ . 1 . 2]" 1
416 1 14 TYR HA 1 18 GLY H . . 5.480 4.370 3.727 4.945 . 0 0 "[ . 1 . 2]" 1
417 1 14 TYR HA 1 19 TYR HA . . 4.090 2.480 2.043 2.838 . 0 0 "[ . 1 . 2]" 1
418 1 14 TYR HA 1 19 TYR QD . . 5.500 3.988 3.194 4.888 . 0 0 "[ . 1 . 2]" 1
419 1 14 TYR HA 1 20 MET H . . 4.480 3.115 2.800 3.571 . 0 0 "[ . 1 . 2]" 1
420 1 14 TYR HA 1 20 MET ME . . 4.960 4.464 4.038 5.049 0.089 18 0 "[ . 1 . 2]" 1
421 1 14 TYR HA 1 20 MET HG2 . . 5.500 3.281 2.426 3.606 . 0 0 "[ . 1 . 2]" 1
422 1 14 TYR HA 1 20 MET HG3 . . 5.160 4.561 4.096 4.933 . 0 0 "[ . 1 . 2]" 1
423 1 14 TYR HA 1 21 ALA H . . 5.500 4.826 4.408 5.378 . 0 0 "[ . 1 . 2]" 1
424 1 14 TYR HB2 1 15 LEU H . . 5.120 4.514 4.235 4.732 . 0 0 "[ . 1 . 2]" 1
425 1 14 TYR HB2 1 20 MET H . . 5.500 5.355 4.982 5.561 0.061 19 0 "[ . 1 . 2]" 1
426 1 14 TYR HB2 1 88 ASN HA . . 4.940 3.291 2.682 3.820 . 0 0 "[ . 1 . 2]" 1
427 1 14 TYR HB2 1 89 LEU H . . 5.500 4.572 4.068 5.308 . 0 0 "[ . 1 . 2]" 1
428 1 14 TYR HB3 1 15 LEU H . . 5.310 3.656 3.036 4.347 . 0 0 "[ . 1 . 2]" 1
429 1 14 TYR HB3 1 17 ASN HA . . 5.240 3.881 2.957 4.782 . 0 0 "[ . 1 . 2]" 1
430 1 14 TYR HB3 1 86 ARG HG2 . . 5.500 3.810 3.045 4.540 . 0 0 "[ . 1 . 2]" 1
431 1 14 TYR HB3 1 88 ASN H . . 5.500 5.399 4.969 5.582 0.082 1 0 "[ . 1 . 2]" 1
432 1 14 TYR HB3 1 88 ASN HA . . 4.300 2.798 2.540 2.957 . 0 0 "[ . 1 . 2]" 1
433 1 14 TYR HB3 1 89 LEU H . . 5.280 3.795 3.417 4.119 . 0 0 "[ . 1 . 2]" 1
434 1 14 TYR QD 1 15 LEU H . . 5.500 3.583 3.140 4.484 . 0 0 "[ . 1 . 2]" 1
435 1 14 TYR QD 1 17 ASN H . . 5.500 3.761 3.304 4.569 . 0 0 "[ . 1 . 2]" 1
436 1 14 TYR QD 1 17 ASN HA . . 4.510 2.458 2.047 3.302 . 0 0 "[ . 1 . 2]" 1
437 1 14 TYR QD 1 17 ASN HB2 . . 5.500 5.192 4.812 5.631 0.131 19 0 "[ . 1 . 2]" 1
438 1 14 TYR QD 1 17 ASN HB3 . . 5.500 4.592 4.072 5.067 . 0 0 "[ . 1 . 2]" 1
439 1 14 TYR QD 1 18 GLY H . . 5.070 3.060 2.463 3.660 . 0 0 "[ . 1 . 2]" 1
440 1 14 TYR QD 1 18 GLY HA2 . . 5.500 3.998 3.159 4.777 . 0 0 "[ . 1 . 2]" 1
441 1 14 TYR QD 1 18 GLY HA3 . . 5.400 4.605 4.252 5.055 . 0 0 "[ . 1 . 2]" 1
442 1 14 TYR QD 1 19 TYR H . . 4.580 3.946 2.241 4.655 0.075 1 0 "[ . 1 . 2]" 1
443 1 14 TYR QD 1 19 TYR HA . . 4.840 3.288 2.889 3.705 . 0 0 "[ . 1 . 2]" 1
444 1 14 TYR QD 1 19 TYR HB2 . . 5.430 4.089 3.672 4.474 . 0 0 "[ . 1 . 2]" 1
445 1 14 TYR QD 1 19 TYR HB3 . . 5.500 5.275 4.886 5.552 0.052 19 0 "[ . 1 . 2]" 1
446 1 14 TYR QD 1 20 MET H . . 5.500 4.378 4.105 4.924 . 0 0 "[ . 1 . 2]" 1
447 1 14 TYR QD 1 20 MET HG2 . . 5.500 5.426 4.884 5.626 0.126 6 0 "[ . 1 . 2]" 1
448 1 14 TYR QD 1 86 ARG HA . . 5.500 4.762 4.093 5.255 . 0 0 "[ . 1 . 2]" 1
449 1 14 TYR QD 1 86 ARG HB2 . . 5.160 4.616 2.323 5.174 0.014 8 0 "[ . 1 . 2]" 1
450 1 14 TYR QD 1 86 ARG HB3 . . 5.290 5.263 3.806 5.383 0.093 3 0 "[ . 1 . 2]" 1
451 1 14 TYR QD 1 86 ARG HD2 . . 5.410 3.883 2.557 4.641 . 0 0 "[ . 1 . 2]" 1
452 1 14 TYR QD 1 86 ARG HD3 . . 5.500 3.464 2.924 5.035 . 0 0 "[ . 1 . 2]" 1
453 1 14 TYR QD 1 86 ARG HE . . 5.500 4.117 2.675 5.453 . 0 0 "[ . 1 . 2]" 1
454 1 14 TYR QD 1 86 ARG HG2 . . 4.520 3.696 3.268 4.797 0.277 19 0 "[ . 1 . 2]" 1
455 1 14 TYR QD 1 86 ARG HG3 . . 4.820 2.615 2.380 3.412 . 0 0 "[ . 1 . 2]" 1
456 1 14 TYR QD 1 87 LEU H . . 5.500 4.352 3.730 4.867 . 0 0 "[ . 1 . 2]" 1
457 1 14 TYR QD 1 88 ASN HA . . 5.500 4.673 4.202 4.898 . 0 0 "[ . 1 . 2]" 1
458 1 15 LEU H 1 15 LEU QD . . 5.060 3.867 3.676 4.012 . 0 0 "[ . 1 . 2]" 1
459 1 15 LEU H 1 15 LEU HG . . 5.500 4.588 4.419 5.024 . 0 0 "[ . 1 . 2]" 1
460 1 15 LEU H 1 17 ASN H . . 5.500 4.290 3.890 4.860 . 0 0 "[ . 1 . 2]" 1
461 1 15 LEU H 1 17 ASN HA . . 5.500 4.826 4.370 5.575 0.075 19 0 "[ . 1 . 2]" 1
462 1 15 LEU H 1 18 GLY HA2 . . 5.500 5.001 4.748 5.566 0.066 6 0 "[ . 1 . 2]" 1
463 1 15 LEU H 1 18 GLY HA3 . . 5.500 4.302 4.000 4.878 . 0 0 "[ . 1 . 2]" 1
464 1 15 LEU H 1 19 TYR H . . 5.220 4.458 2.548 5.261 0.041 19 0 "[ . 1 . 2]" 1
465 1 15 LEU H 1 19 TYR HA . . 5.140 3.761 3.330 4.078 . 0 0 "[ . 1 . 2]" 1
466 1 15 LEU H 1 20 MET H . . 5.430 4.370 3.642 4.712 . 0 0 "[ . 1 . 2]" 1
467 1 15 LEU H 1 20 MET HA . . 5.500 5.403 4.833 5.578 0.078 4 0 "[ . 1 . 2]" 1
468 1 15 LEU H 1 20 MET ME . . 4.050 3.164 2.730 3.996 . 0 0 "[ . 1 . 2]" 1
469 1 15 LEU H 1 20 MET HG2 . . 4.950 2.702 2.073 3.109 . 0 0 "[ . 1 . 2]" 1
470 1 15 LEU H 1 20 MET HG3 . . 4.280 3.827 2.973 4.331 0.051 13 0 "[ . 1 . 2]" 1
471 1 15 LEU HA 1 15 LEU QD . . 3.650 2.772 2.146 3.045 . 0 0 "[ . 1 . 2]" 1
472 1 15 LEU HA 1 15 LEU HG . . 4.140 2.728 2.176 3.769 . 0 0 "[ . 1 . 2]" 1
473 1 15 LEU HA 1 16 ASN H . . 3.320 2.148 2.065 2.227 . 0 0 "[ . 1 . 2]" 1
474 1 15 LEU HA 1 16 ASN HA . . 4.720 4.279 4.022 4.470 . 0 0 "[ . 1 . 2]" 1
475 1 15 LEU HA 1 16 ASN HB2 . . 5.500 4.799 4.552 4.902 . 0 0 "[ . 1 . 2]" 1
476 1 15 LEU HA 1 17 ASN H . . 5.070 3.707 3.379 4.164 . 0 0 "[ . 1 . 2]" 1
477 1 15 LEU HA 1 20 MET ME . . 5.130 4.528 4.251 4.840 . 0 0 "[ . 1 . 2]" 1
478 1 15 LEU HA 1 20 MET HG2 . . 5.500 4.818 4.355 5.095 . 0 0 "[ . 1 . 2]" 1
479 1 15 LEU HA 1 20 MET HG3 . . 5.500 5.008 4.461 5.339 . 0 0 "[ . 1 . 2]" 1
480 1 15 LEU HA 1 89 LEU H . . 4.290 2.769 2.570 2.978 . 0 0 "[ . 1 . 2]" 1
481 1 15 LEU HA 1 89 LEU HB2 . . 3.890 2.354 1.996 3.456 . 0 0 "[ . 1 . 2]" 1
482 1 15 LEU HA 1 89 LEU QD . . 4.830 3.439 2.685 4.211 . 0 0 "[ . 1 . 2]" 1
483 1 15 LEU HA 1 89 LEU HG . . 5.500 4.400 3.552 5.450 . 0 0 "[ . 1 . 2]" 1
484 1 15 LEU HA 1 91 ILE H . . 5.500 5.550 5.467 5.579 0.079 13 0 "[ . 1 . 2]" 1
485 1 15 LEU HB2 1 16 ASN H . . 4.880 4.120 3.847 4.368 . 0 0 "[ . 1 . 2]" 1
486 1 15 LEU HB2 1 18 GLY H . . 5.500 5.567 5.383 5.613 0.113 20 0 "[ . 1 . 2]" 1
487 1 15 LEU HB2 1 20 MET ME . . 4.000 3.449 3.097 3.662 . 0 0 "[ . 1 . 2]" 1
488 1 15 LEU HB2 1 20 MET HG2 . . 4.940 3.486 3.117 4.041 . 0 0 "[ . 1 . 2]" 1
489 1 15 LEU HB2 1 20 MET HG3 . . 4.940 2.950 2.427 3.404 . 0 0 "[ . 1 . 2]" 1
490 1 15 LEU HB3 1 16 ASN H . . 5.500 4.121 3.981 4.313 . 0 0 "[ . 1 . 2]" 1
491 1 15 LEU HB3 1 20 MET ME . . 2.630 2.077 2.006 2.207 . 0 0 "[ . 1 . 2]" 1
492 1 15 LEU HB3 1 20 MET HG2 . . 4.920 2.792 2.592 3.096 . 0 0 "[ . 1 . 2]" 1
493 1 15 LEU HB3 1 20 MET HG3 . . 5.190 2.722 2.285 3.340 . 0 0 "[ . 1 . 2]" 1
494 1 15 LEU QD 1 16 ASN H . . 3.740 2.841 1.687 3.522 . 0 0 "[ . 1 . 2]" 1
495 1 15 LEU QD 1 16 ASN HA . . 5.500 3.911 2.952 4.609 . 0 0 "[ . 1 . 2]" 1
496 1 15 LEU QD 1 16 ASN HB2 . . 4.240 2.411 1.978 2.773 . 0 0 "[ . 1 . 2]" 1
497 1 15 LEU QD 1 16 ASN QD . . 4.570 2.625 2.386 3.128 . 0 0 "[ . 1 . 2]" 1
498 1 15 LEU QD 1 18 GLY H . . 5.500 4.370 3.950 4.791 . 0 0 "[ . 1 . 2]" 1
499 1 15 LEU QD 1 20 MET ME . . 3.700 2.195 1.992 2.492 . 0 0 "[ . 1 . 2]" 1
500 1 15 LEU QD 1 20 MET HG2 . . 5.380 4.042 3.802 4.331 . 0 0 "[ . 1 . 2]" 1
501 1 15 LEU QD 1 20 MET HG3 . . 5.500 3.573 3.248 4.162 . 0 0 "[ . 1 . 2]" 1
502 1 15 LEU QD 1 48 MET H . . 5.500 4.642 4.269 5.213 . 0 0 "[ . 1 . 2]" 1
503 1 15 LEU QD 1 48 MET HA . . 4.830 3.744 3.468 4.005 . 0 0 "[ . 1 . 2]" 1
504 1 15 LEU QD 1 48 MET HB2 . . 5.280 2.673 2.132 3.567 . 0 0 "[ . 1 . 2]" 1
505 1 15 LEU QD 1 48 MET HB3 . . 4.160 2.317 2.006 2.913 . 0 0 "[ . 1 . 2]" 1
506 1 15 LEU QD 1 48 MET HG2 . . 5.500 3.345 2.449 4.138 . 0 0 "[ . 1 . 2]" 1
507 1 15 LEU QD 1 48 MET HG3 . . 5.500 4.141 2.970 4.933 . 0 0 "[ . 1 . 2]" 1
508 1 15 LEU QD 1 49 GLY H . . 5.500 4.487 4.201 4.956 . 0 0 "[ . 1 . 2]" 1
509 1 15 LEU QD 1 49 GLY HA2 . . 5.500 5.223 4.913 5.442 . 0 0 "[ . 1 . 2]" 1
510 1 15 LEU QD 1 49 GLY HA3 . . 5.500 4.132 3.676 4.304 . 0 0 "[ . 1 . 2]" 1
511 1 15 LEU QD 1 89 LEU HB2 . . 3.660 2.259 2.008 2.478 . 0 0 "[ . 1 . 2]" 1
512 1 15 LEU QD 1 89 LEU QD . . 3.040 2.698 2.175 3.067 0.027 14 0 "[ . 1 . 2]" 1
513 1 15 LEU QD 1 90 THR H . . 5.190 3.683 3.147 4.154 . 0 0 "[ . 1 . 2]" 1
514 1 15 LEU QD 1 90 THR HA . . 4.120 3.301 2.190 3.782 . 0 0 "[ . 1 . 2]" 1
515 1 15 LEU QD 1 90 THR MG . . 5.340 4.367 3.724 4.701 . 0 0 "[ . 1 . 2]" 1
516 1 15 LEU QD 1 91 ILE H . . 4.160 3.226 2.526 3.615 . 0 0 "[ . 1 . 2]" 1
517 1 15 LEU QD 1 91 ILE MD . . 3.310 2.137 1.826 2.501 . 0 0 "[ . 1 . 2]" 1
518 1 15 LEU QD 1 91 ILE HG12 . . 4.360 3.426 3.078 3.673 . 0 0 "[ . 1 . 2]" 1
519 1 15 LEU QD 1 91 ILE MG . . 3.980 3.536 3.365 3.709 . 0 0 "[ . 1 . 2]" 1
520 1 15 LEU QD 1 96 MET ME . . 3.380 2.110 1.895 2.300 . 0 0 "[ . 1 . 2]" 1
521 1 15 LEU HG 1 16 ASN H . . 4.520 2.795 2.185 4.118 . 0 0 "[ . 1 . 2]" 1
522 1 15 LEU HG 1 16 ASN HA . . 5.500 4.568 4.097 5.613 0.113 14 0 "[ . 1 . 2]" 1
523 1 15 LEU HG 1 16 ASN HB2 . . 4.710 4.019 3.086 4.755 0.045 6 0 "[ . 1 . 2]" 1
524 1 15 LEU HG 1 16 ASN QD . . 5.290 4.207 3.683 4.780 . 0 0 "[ . 1 . 2]" 1
525 1 15 LEU HG 1 20 MET ME . . 4.460 4.045 3.454 4.476 0.016 18 0 "[ . 1 . 2]" 1
526 1 15 LEU HG 1 20 MET HG2 . . 5.500 5.476 5.043 5.626 0.126 2 0 "[ . 1 . 2]" 1
527 1 15 LEU HG 1 20 MET HG3 . . 5.500 5.077 4.149 5.567 0.067 16 0 "[ . 1 . 2]" 1
528 1 15 LEU HG 1 48 MET HB3 . . 5.500 3.959 2.225 4.918 . 0 0 "[ . 1 . 2]" 1
529 1 15 LEU HG 1 89 LEU HB2 . . 5.230 3.396 2.510 3.958 . 0 0 "[ . 1 . 2]" 1
530 1 15 LEU HG 1 89 LEU QD . . 4.840 4.177 3.638 4.730 . 0 0 "[ . 1 . 2]" 1
531 1 15 LEU HG 1 90 THR HA . . 5.500 3.733 2.936 5.365 . 0 0 "[ . 1 . 2]" 1
532 1 15 LEU HG 1 91 ILE H . . 5.500 4.117 3.601 5.174 . 0 0 "[ . 1 . 2]" 1
533 1 16 ASN H 1 16 ASN QD . . 5.500 4.460 4.297 4.575 . 0 0 "[ . 1 . 2]" 1
534 1 16 ASN H 1 17 ASN H . . 4.060 2.811 2.599 3.030 . 0 0 "[ . 1 . 2]" 1
535 1 16 ASN H 1 17 ASN HA . . 5.110 4.983 4.759 5.173 0.063 4 0 "[ . 1 . 2]" 1
536 1 16 ASN H 1 18 GLY H . . 5.500 4.257 3.978 4.694 . 0 0 "[ . 1 . 2]" 1
537 1 16 ASN H 1 20 MET ME . . 5.500 5.132 4.580 5.583 0.083 9 0 "[ . 1 . 2]" 1
538 1 16 ASN H 1 89 LEU HB2 . . 4.980 3.819 3.325 4.712 . 0 0 "[ . 1 . 2]" 1
539 1 16 ASN H 1 90 THR H . . 5.130 4.554 4.207 4.863 . 0 0 "[ . 1 . 2]" 1
540 1 16 ASN H 1 90 THR HA . . 3.840 2.523 2.267 2.760 . 0 0 "[ . 1 . 2]" 1
541 1 16 ASN H 1 90 THR MG . . 4.200 4.119 3.754 4.293 0.093 6 0 "[ . 1 . 2]" 1
542 1 16 ASN H 1 91 ILE H . . 4.680 4.024 3.857 4.433 . 0 0 "[ . 1 . 2]" 1
543 1 16 ASN HA 1 17 ASN HB2 . . 5.500 4.094 3.954 4.463 . 0 0 "[ . 1 . 2]" 1
544 1 16 ASN HA 1 17 ASN HB3 . . 5.500 5.517 4.980 5.596 0.096 17 0 "[ . 1 . 2]" 1
545 1 16 ASN HA 1 18 GLY H . . 5.500 4.421 4.194 4.930 . 0 0 "[ . 1 . 2]" 1
546 1 16 ASN HA 1 90 THR HA . . 4.460 3.109 2.646 3.662 . 0 0 "[ . 1 . 2]" 1
547 1 16 ASN HA 1 90 THR MG . . 4.050 3.385 3.147 3.828 . 0 0 "[ . 1 . 2]" 1
548 1 16 ASN HB2 1 17 ASN H . . 5.500 4.392 4.242 4.509 . 0 0 "[ . 1 . 2]" 1
549 1 16 ASN HB2 1 90 THR HA . . 5.500 4.830 4.590 4.946 . 0 0 "[ . 1 . 2]" 1
550 1 16 ASN HB2 1 90 THR MG . . 5.500 5.256 5.000 5.461 . 0 0 "[ . 1 . 2]" 1
551 1 16 ASN HB2 1 91 ILE H . . 5.500 4.746 4.503 4.879 . 0 0 "[ . 1 . 2]" 1
552 1 16 ASN HB2 1 96 MET ME . . 5.500 4.008 3.264 4.654 . 0 0 "[ . 1 . 2]" 1
553 1 16 ASN QD 1 20 MET ME . . 5.500 4.949 4.234 5.326 . 0 0 "[ . 1 . 2]" 1
554 1 16 ASN QD 1 90 THR HA . . 5.450 4.251 4.001 4.399 . 0 0 "[ . 1 . 2]" 1
555 1 16 ASN QD 1 90 THR MG . . 5.500 4.030 3.733 4.224 . 0 0 "[ . 1 . 2]" 1
556 1 16 ASN QD 1 91 ILE H . . 4.210 2.680 2.462 2.873 . 0 0 "[ . 1 . 2]" 1
557 1 16 ASN QD 1 91 ILE HA . . 5.500 4.542 4.360 4.803 . 0 0 "[ . 1 . 2]" 1
558 1 16 ASN QD 1 91 ILE HB . . 4.500 3.043 2.652 3.681 . 0 0 "[ . 1 . 2]" 1
559 1 16 ASN QD 1 91 ILE MG . . 5.180 3.907 3.609 4.429 . 0 0 "[ . 1 . 2]" 1
560 1 16 ASN QD 1 93 GLN H . . 5.500 4.620 2.955 5.122 . 0 0 "[ . 1 . 2]" 1
561 1 16 ASN QD 1 93 GLN HA . . 5.500 4.703 3.928 5.198 . 0 0 "[ . 1 . 2]" 1
562 1 16 ASN QD 1 93 GLN QE . . 4.610 3.342 2.550 3.931 . 0 0 "[ . 1 . 2]" 1
563 1 16 ASN QD 1 93 GLN HG2 . . 5.270 4.489 2.620 5.955 0.685 18 1 "[ . 1 . + 2]" 1
564 1 16 ASN QD 1 96 MET ME . . 5.280 2.721 2.191 3.775 . 0 0 "[ . 1 . 2]" 1
565 1 16 ASN QD 1 96 MET HG2 . . 5.500 4.402 3.797 4.929 . 0 0 "[ . 1 . 2]" 1
566 1 16 ASN QD 1 96 MET HG3 . . 5.500 4.241 3.303 4.863 . 0 0 "[ . 1 . 2]" 1
567 1 17 ASN H 1 18 GLY H . . 4.210 2.922 2.716 3.061 . 0 0 "[ . 1 . 2]" 1
568 1 17 ASN H 1 90 THR HA . . 5.500 4.729 4.273 5.436 . 0 0 "[ . 1 . 2]" 1
569 1 17 ASN H 1 90 THR MG . . 5.500 5.254 4.835 5.601 0.101 12 0 "[ . 1 . 2]" 1
570 1 17 ASN HA 1 17 ASN HD22 . . 5.500 3.796 3.106 4.447 . 0 0 "[ . 1 . 2]" 1
571 1 17 ASN HB2 1 18 GLY H . . 5.130 4.283 3.991 4.531 . 0 0 "[ . 1 . 2]" 1
572 1 17 ASN HB2 1 18 GLY HA3 . . 5.500 5.649 5.029 6.079 0.579 6 1 "[ .+ 1 . 2]" 1
573 1 17 ASN HB3 1 18 GLY H . . 4.980 4.380 4.074 4.602 . 0 0 "[ . 1 . 2]" 1
574 1 17 ASN HB3 1 18 GLY HA3 . . 5.500 5.480 5.032 5.801 0.301 11 0 "[ . 1 . 2]" 1
575 1 17 ASN HD21 1 18 GLY H . . 5.480 5.287 4.514 5.560 0.080 3 0 "[ . 1 . 2]" 1
576 1 18 GLY H 1 19 TYR H . . 5.090 3.921 2.191 4.529 . 0 0 "[ . 1 . 2]" 1
577 1 18 GLY H 1 20 MET ME . . 4.770 4.066 3.478 4.867 0.097 5 0 "[ . 1 . 2]" 1
578 1 18 GLY HA2 1 19 TYR HA . . 5.500 4.590 4.256 5.325 . 0 0 "[ . 1 . 2]" 1
579 1 18 GLY HA3 1 19 TYR HB2 . . 5.500 5.538 5.275 5.811 0.311 10 0 "[ . 1 . 2]" 1
580 1 18 GLY HA3 1 20 MET ME . . 4.940 3.578 2.959 4.427 . 0 0 "[ . 1 . 2]" 1
581 1 19 TYR H 1 19 TYR QD . . 4.910 4.175 4.072 4.447 . 0 0 "[ . 1 . 2]" 1
582 1 19 TYR H 1 20 MET H . . 5.500 4.517 3.997 4.667 . 0 0 "[ . 1 . 2]" 1
583 1 19 TYR H 1 20 MET HA . . 5.500 5.449 5.202 5.576 0.076 13 0 "[ . 1 . 2]" 1
584 1 19 TYR H 1 20 MET ME . . 5.370 4.433 3.604 5.080 . 0 0 "[ . 1 . 2]" 1
585 1 19 TYR HA 1 19 TYR QD . . 4.300 2.494 2.178 2.984 . 0 0 "[ . 1 . 2]" 1
586 1 19 TYR HA 1 20 MET H . . 3.450 2.256 2.155 2.342 . 0 0 "[ . 1 . 2]" 1
587 1 19 TYR HA 1 20 MET HA . . 5.500 4.469 4.389 4.519 . 0 0 "[ . 1 . 2]" 1
588 1 19 TYR HA 1 20 MET HB2 . . 5.500 4.513 4.356 4.923 . 0 0 "[ . 1 . 2]" 1
589 1 19 TYR HA 1 20 MET HG3 . . 5.500 5.537 5.262 5.577 0.077 2 0 "[ . 1 . 2]" 1
590 1 19 TYR HB2 1 20 MET H . . 5.500 3.981 3.861 4.339 . 0 0 "[ . 1 . 2]" 1
591 1 19 TYR QD 1 20 MET H . . 5.230 2.651 2.246 3.708 . 0 0 "[ . 1 . 2]" 1
592 1 19 TYR QD 1 20 MET HA . . 5.500 4.415 4.180 4.844 . 0 0 "[ . 1 . 2]" 1
593 1 19 TYR QD 1 21 ALA HA . . 5.500 4.811 4.563 5.057 . 0 0 "[ . 1 . 2]" 1
594 1 19 TYR QE 1 20 MET H . . 5.500 3.723 3.344 4.488 . 0 0 "[ . 1 . 2]" 1
595 1 19 TYR QE 1 20 MET HA . . 5.500 5.035 4.644 5.558 0.058 18 0 "[ . 1 . 2]" 1
596 1 19 TYR QE 1 21 ALA H . . 5.130 3.577 3.229 3.983 . 0 0 "[ . 1 . 2]" 1
597 1 19 TYR QE 1 21 ALA HA . . 4.950 3.447 3.225 3.923 . 0 0 "[ . 1 . 2]" 1
598 1 19 TYR QE 1 21 ALA MB . . 5.500 4.429 4.243 4.795 . 0 0 "[ . 1 . 2]" 1
599 1 19 TYR QE 1 22 THR H . . 5.500 4.245 3.844 4.805 . 0 0 "[ . 1 . 2]" 1
600 1 19 TYR QE 1 22 THR HA . . 5.500 3.859 3.504 4.314 . 0 0 "[ . 1 . 2]" 1
601 1 19 TYR QE 1 22 THR HB . . 5.500 4.507 4.159 5.102 . 0 0 "[ . 1 . 2]" 1
602 1 19 TYR QE 1 22 THR MG . . 5.500 4.165 3.755 4.626 . 0 0 "[ . 1 . 2]" 1
603 1 20 MET H 1 20 MET ME . . 4.600 4.471 4.279 4.671 0.071 9 0 "[ . 1 . 2]" 1
604 1 20 MET H 1 20 MET HG2 . . 4.890 3.147 2.540 3.472 . 0 0 "[ . 1 . 2]" 1
605 1 20 MET H 1 20 MET HG3 . . 4.630 4.374 3.974 4.634 0.004 13 0 "[ . 1 . 2]" 1
606 1 20 MET H 1 21 ALA H . . 3.790 2.441 2.077 2.984 . 0 0 "[ . 1 . 2]" 1
607 1 20 MET HA 1 20 MET ME . . 3.590 3.405 2.888 3.657 0.067 14 0 "[ . 1 . 2]" 1
608 1 20 MET HB2 1 21 ALA H . . 4.770 2.229 1.985 2.685 . 0 0 "[ . 1 . 2]" 1
609 1 20 MET HB2 1 21 ALA MB . . 5.500 3.689 3.304 4.203 . 0 0 "[ . 1 . 2]" 1
610 1 20 MET HB2 1 48 MET HG2 . . 5.500 3.766 2.548 5.842 0.342 10 0 "[ . 1 . 2]" 1
611 1 20 MET HB3 1 21 ALA H . . 4.900 3.053 2.424 3.975 . 0 0 "[ . 1 . 2]" 1
612 1 20 MET HB3 1 21 ALA MB . . 5.500 3.375 3.022 3.994 . 0 0 "[ . 1 . 2]" 1
613 1 20 MET ME 1 20 MET HG2 . . 3.830 2.285 2.101 3.408 . 0 0 "[ . 1 . 2]" 1
614 1 20 MET ME 1 20 MET HG3 . . 3.470 2.714 2.349 2.902 . 0 0 "[ . 1 . 2]" 1
615 1 20 MET ME 1 21 ALA H . . 5.500 5.607 5.539 5.622 0.122 4 0 "[ . 1 . 2]" 1
616 1 20 MET ME 1 48 MET H . . 5.220 5.239 4.577 5.332 0.112 19 0 "[ . 1 . 2]" 1
617 1 20 MET ME 1 48 MET HA . . 3.490 2.946 2.240 3.179 . 0 0 "[ . 1 . 2]" 1
618 1 20 MET ME 1 49 GLY H . . 5.410 5.135 4.581 5.483 0.073 20 0 "[ . 1 . 2]" 1
619 1 20 MET ME 1 49 GLY HA3 . . 5.500 4.640 3.937 5.090 . 0 0 "[ . 1 . 2]" 1
620 1 20 MET HG2 1 21 ALA H . . 5.500 4.256 3.918 4.442 . 0 0 "[ . 1 . 2]" 1
621 1 20 MET HG2 1 48 MET ME . . 5.180 5.239 4.927 5.335 0.155 16 0 "[ . 1 . 2]" 1
622 1 20 MET HG3 1 21 ALA H . . 5.500 4.628 4.283 5.017 . 0 0 "[ . 1 . 2]" 1
623 1 20 MET HG3 1 21 ALA MB . . 5.500 5.280 4.859 5.579 0.079 9 0 "[ . 1 . 2]" 1
624 1 20 MET HG3 1 48 MET HA . . 5.500 3.043 2.234 3.752 . 0 0 "[ . 1 . 2]" 1
625 1 20 MET HG3 1 48 MET HB2 . . 3.930 3.990 3.808 4.028 0.098 8 0 "[ . 1 . 2]" 1
626 1 20 MET HG3 1 48 MET HB3 . . 2.550 2.508 2.340 2.618 0.068 14 0 "[ . 1 . 2]" 1
627 1 20 MET HG3 1 48 MET ME . . 5.380 4.030 3.739 4.533 . 0 0 "[ . 1 . 2]" 1
628 1 21 ALA H 1 22 THR H . . 5.500 4.437 4.316 4.554 . 0 0 "[ . 1 . 2]" 1
629 1 21 ALA H 1 48 MET ME . . 5.500 5.112 4.522 5.588 0.088 18 0 "[ . 1 . 2]" 1
630 1 21 ALA HA 1 22 THR H . . 3.330 2.521 2.321 2.702 . 0 0 "[ . 1 . 2]" 1
631 1 21 ALA HA 1 22 THR HA . . 5.500 4.533 4.274 4.601 . 0 0 "[ . 1 . 2]" 1
632 1 21 ALA HA 1 22 THR HB . . 5.450 4.642 4.315 4.921 . 0 0 "[ . 1 . 2]" 1
633 1 21 ALA MB 1 22 THR H . . 3.720 2.283 2.047 2.503 . 0 0 "[ . 1 . 2]" 1
634 1 21 ALA MB 1 22 THR HA . . 5.500 4.008 3.755 4.269 . 0 0 "[ . 1 . 2]" 1
635 1 21 ALA MB 1 23 ARG H . . 5.500 4.214 3.692 4.585 . 0 0 "[ . 1 . 2]" 1
636 1 21 ALA MB 1 23 ARG HD2 . . 5.480 4.966 3.466 5.532 0.052 7 0 "[ . 1 . 2]" 1
637 1 21 ALA MB 1 23 ARG HD3 . . 5.500 4.833 4.251 5.381 . 0 0 "[ . 1 . 2]" 1
638 1 21 ALA MB 1 23 ARG QG . . 2.810 2.664 2.431 2.869 0.059 7 0 "[ . 1 . 2]" 1
639 1 22 THR H 1 22 THR HB . . 3.840 2.690 2.397 2.881 . 0 0 "[ . 1 . 2]" 1
640 1 22 THR H 1 22 THR MG . . 4.540 3.899 3.766 3.969 . 0 0 "[ . 1 . 2]" 1
641 1 22 THR H 1 23 ARG H . . 4.280 3.985 3.394 4.284 0.004 9 0 "[ . 1 . 2]" 1
642 1 22 THR H 1 23 ARG HA . . 5.500 4.911 4.652 5.286 . 0 0 "[ . 1 . 2]" 1
643 1 22 THR H 1 23 ARG HB2 . . 5.500 4.995 4.585 5.578 0.078 11 0 "[ . 1 . 2]" 1
644 1 22 THR HA 1 23 ARG H . . 3.440 2.276 2.210 2.473 . 0 0 "[ . 1 . 2]" 1
645 1 22 THR HA 1 23 ARG HA . . 5.500 4.477 4.379 4.551 . 0 0 "[ . 1 . 2]" 1
646 1 22 THR HB 1 23 ARG H . . 5.390 4.472 4.263 4.573 . 0 0 "[ . 1 . 2]" 1
647 1 22 THR MG 1 23 ARG H . . 4.050 3.429 3.018 4.073 0.023 17 0 "[ . 1 . 2]" 1
648 1 22 THR MG 1 23 ARG HA . . 5.380 3.990 3.722 4.438 . 0 0 "[ . 1 . 2]" 1
649 1 23 ARG H 1 23 ARG HD2 . . 5.500 5.316 2.870 5.625 0.125 20 0 "[ . 1 . 2]" 1
650 1 23 ARG H 1 23 ARG HD3 . . 5.500 4.534 4.305 5.368 . 0 0 "[ . 1 . 2]" 1
651 1 23 ARG H 1 23 ARG QG . . 4.640 3.339 2.924 3.534 . 0 0 "[ . 1 . 2]" 1
652 1 23 ARG H 1 24 ASP H . . 5.500 4.371 4.238 4.497 . 0 0 "[ . 1 . 2]" 1
653 1 23 ARG H 1 24 ASP HA . . 5.500 4.998 4.713 5.308 . 0 0 "[ . 1 . 2]" 1
654 1 23 ARG H 1 25 VAL QG . . 5.450 3.699 3.325 4.200 . 0 0 "[ . 1 . 2]" 1
655 1 23 ARG HA 1 23 ARG HD2 . . 4.290 3.393 2.914 4.110 . 0 0 "[ . 1 . 2]" 1
656 1 23 ARG HA 1 23 ARG HD3 . . 4.890 2.369 2.006 4.576 . 0 0 "[ . 1 . 2]" 1
657 1 23 ARG HA 1 24 ASP H . . 3.270 2.461 2.295 2.631 . 0 0 "[ . 1 . 2]" 1
658 1 23 ARG HB2 1 24 ASP H . . 3.980 3.528 2.207 3.882 . 0 0 "[ . 1 . 2]" 1
659 1 23 ARG HB2 1 25 VAL QG . . 5.210 3.836 2.653 5.167 . 0 0 "[ . 1 . 2]" 1
660 1 23 ARG HB3 1 24 ASP H . . 4.070 2.424 2.093 3.166 . 0 0 "[ . 1 . 2]" 1
661 1 23 ARG HD2 1 24 ASP H . . 5.230 4.129 3.372 5.300 0.070 20 0 "[ . 1 . 2]" 1
662 1 23 ARG HD3 1 24 ASP H . . 5.500 3.807 3.445 4.183 . 0 0 "[ . 1 . 2]" 1
663 1 23 ARG QG 1 24 ASP H . . 5.500 4.264 4.074 4.527 . 0 0 "[ . 1 . 2]" 1
664 1 24 ASP H 1 24 ASP HB2 . . 3.990 2.507 2.159 2.683 . 0 0 "[ . 1 . 2]" 1
665 1 24 ASP H 1 24 ASP HB3 . . 3.630 3.452 2.198 3.658 0.028 19 0 "[ . 1 . 2]" 1
666 1 24 ASP H 1 25 VAL H . . 5.190 4.590 4.378 4.650 . 0 0 "[ . 1 . 2]" 1
667 1 24 ASP H 1 25 VAL QG . . 5.500 4.388 3.567 4.709 . 0 0 "[ . 1 . 2]" 1
668 1 24 ASP HA 1 25 VAL H . . 3.220 2.252 2.119 2.331 . 0 0 "[ . 1 . 2]" 1
669 1 24 ASP HA 1 25 VAL HA . . 5.500 4.506 4.384 4.613 . 0 0 "[ . 1 . 2]" 1
670 1 24 ASP HA 1 25 VAL HB . . 5.030 4.607 4.258 4.970 . 0 0 "[ . 1 . 2]" 1
671 1 24 ASP HA 1 25 VAL QG . . 5.340 3.304 3.027 3.870 . 0 0 "[ . 1 . 2]" 1
672 1 24 ASP HA 1 112 GLY H . . 5.280 5.366 5.348 5.389 0.109 16 0 "[ . 1 . 2]" 1
673 1 24 ASP HB2 1 25 VAL H . . 4.810 4.067 3.840 4.489 . 0 0 "[ . 1 . 2]" 1
674 1 24 ASP HB2 1 112 GLY H . . 5.500 2.805 2.515 3.749 . 0 0 "[ . 1 . 2]" 1
675 1 24 ASP HB2 1 113 ILE MG . . 5.500 4.762 4.230 5.631 0.131 6 0 "[ . 1 . 2]" 1
676 1 24 ASP HB3 1 25 VAL H . . 5.290 3.175 2.680 4.284 . 0 0 "[ . 1 . 2]" 1
677 1 24 ASP HB3 1 25 VAL QG . . 5.500 4.631 4.361 5.103 . 0 0 "[ . 1 . 2]" 1
678 1 25 VAL H 1 25 VAL HB . . 3.930 2.864 2.480 3.616 . 0 0 "[ . 1 . 2]" 1
679 1 25 VAL H 1 25 VAL QG . . 4.280 2.591 2.218 2.840 . 0 0 "[ . 1 . 2]" 1
680 1 25 VAL H 1 26 THR H . . 5.220 4.171 3.480 4.539 . 0 0 "[ . 1 . 2]" 1
681 1 25 VAL HA 1 26 THR H . . 3.280 2.208 2.067 2.396 . 0 0 "[ . 1 . 2]" 1
682 1 25 VAL HA 1 26 THR HA . . 5.500 4.514 4.428 4.669 . 0 0 "[ . 1 . 2]" 1
683 1 25 VAL HA 1 26 THR HB . . 4.910 4.642 4.373 4.866 . 0 0 "[ . 1 . 2]" 1
684 1 25 VAL HA 1 26 THR MG . . 5.500 5.476 5.364 5.602 0.102 10 0 "[ . 1 . 2]" 1
685 1 25 VAL HA 1 109 TRP HZ2 . . 5.500 3.826 3.014 4.490 . 0 0 "[ . 1 . 2]" 1
686 1 25 VAL HB 1 26 THR H . . 5.400 4.159 3.645 4.524 . 0 0 "[ . 1 . 2]" 1
687 1 25 VAL HB 1 27 PHE QD . . 5.340 4.357 3.664 5.448 0.108 16 0 "[ . 1 . 2]" 1
688 1 25 VAL QG 1 26 THR H . . 3.890 2.879 2.382 3.614 . 0 0 "[ . 1 . 2]" 1
689 1 25 VAL QG 1 26 THR HA . . 5.500 4.061 3.787 4.521 . 0 0 "[ . 1 . 2]" 1
690 1 25 VAL QG 1 26 THR HB . . 5.500 4.569 4.236 5.061 . 0 0 "[ . 1 . 2]" 1
691 1 25 VAL QG 1 26 THR MG . . 5.500 4.900 4.725 5.265 . 0 0 "[ . 1 . 2]" 1
692 1 25 VAL QG 1 27 PHE H . . 5.500 4.526 4.090 5.099 . 0 0 "[ . 1 . 2]" 1
693 1 25 VAL QG 1 27 PHE HA . . 5.500 4.535 4.221 5.078 . 0 0 "[ . 1 . 2]" 1
694 1 25 VAL QG 1 27 PHE QD . . 5.110 3.304 2.561 4.115 . 0 0 "[ . 1 . 2]" 1
695 1 25 VAL QG 1 38 PRO HA . . 4.360 3.470 3.116 3.945 . 0 0 "[ . 1 . 2]" 1
696 1 25 VAL QG 1 38 PRO HB2 . . 4.970 2.652 2.252 2.935 . 0 0 "[ . 1 . 2]" 1
697 1 25 VAL QG 1 38 PRO HB3 . . 4.870 2.590 2.297 3.285 . 0 0 "[ . 1 . 2]" 1
698 1 25 VAL QG 1 38 PRO HD3 . . 5.500 4.878 4.571 5.455 . 0 0 "[ . 1 . 2]" 1
699 1 25 VAL QG 1 38 PRO HG2 . . 5.500 4.382 3.946 4.808 . 0 0 "[ . 1 . 2]" 1
700 1 25 VAL QG 1 38 PRO HG3 . . 5.500 3.935 3.530 4.476 . 0 0 "[ . 1 . 2]" 1
701 1 25 VAL QG 1 39 CYS H . . 4.180 3.495 2.798 4.081 . 0 0 "[ . 1 . 2]" 1
702 1 25 VAL QG 1 40 LEU QD . . 5.150 2.871 2.433 3.620 . 0 0 "[ . 1 . 2]" 1
703 1 25 VAL QG 1 40 LEU HG . . 5.500 4.538 3.974 5.396 . 0 0 "[ . 1 . 2]" 1
704 1 25 VAL QG 1 109 TRP HH2 . . 5.500 3.554 2.296 4.093 . 0 0 "[ . 1 . 2]" 1
705 1 25 VAL QG 1 109 TRP HZ2 . . 5.400 3.805 2.399 4.710 . 0 0 "[ . 1 . 2]" 1
706 1 26 THR H 1 26 THR HB . . 3.510 2.517 2.314 2.784 . 0 0 "[ . 1 . 2]" 1
707 1 26 THR H 1 26 THR MG . . 4.280 3.792 3.716 3.885 . 0 0 "[ . 1 . 2]" 1
708 1 26 THR H 1 27 PHE H . . 5.120 4.575 4.424 4.799 . 0 0 "[ . 1 . 2]" 1
709 1 26 THR H 1 27 PHE QD . . 5.500 4.466 3.948 4.816 . 0 0 "[ . 1 . 2]" 1
710 1 26 THR H 1 38 PRO HA . . 5.500 4.987 4.446 5.336 . 0 0 "[ . 1 . 2]" 1
711 1 26 THR H 1 39 CYS H . . 5.500 3.809 3.390 3.995 . 0 0 "[ . 1 . 2]" 1
712 1 26 THR H 1 39 CYS HB2 . . 5.310 4.245 2.886 5.377 0.067 13 0 "[ . 1 . 2]" 1
713 1 26 THR H 1 39 CYS HB3 . . 5.500 3.873 3.080 5.233 . 0 0 "[ . 1 . 2]" 1
714 1 26 THR HA 1 26 THR MG . . 3.680 2.386 2.264 2.558 . 0 0 "[ . 1 . 2]" 1
715 1 26 THR HA 1 27 PHE H . . 3.380 2.330 2.187 2.444 . 0 0 "[ . 1 . 2]" 1
716 1 26 THR HA 1 27 PHE HB3 . . 5.500 4.707 4.362 4.882 . 0 0 "[ . 1 . 2]" 1
717 1 26 THR HA 1 27 PHE QD . . 4.950 2.893 2.396 3.332 . 0 0 "[ . 1 . 2]" 1
718 1 26 THR HB 1 27 PHE H . . 5.170 4.180 3.878 4.424 . 0 0 "[ . 1 . 2]" 1
719 1 26 THR HB 1 28 ASN HD21 . . 5.500 4.823 4.022 5.568 0.068 2 0 "[ . 1 . 2]" 1
720 1 26 THR HB 1 28 ASN HD22 . . 5.500 4.618 3.389 5.580 0.080 7 0 "[ . 1 . 2]" 1
721 1 26 THR HB 1 39 CYS H . . 5.150 3.790 3.123 4.325 . 0 0 "[ . 1 . 2]" 1
722 1 26 THR HB 1 39 CYS HA . . 5.500 5.317 4.836 5.581 0.081 6 0 "[ . 1 . 2]" 1
723 1 26 THR HB 1 39 CYS HB2 . . 4.210 2.972 2.182 3.722 . 0 0 "[ . 1 . 2]" 1
724 1 26 THR HB 1 39 CYS HB3 . . 4.660 3.016 2.304 4.075 . 0 0 "[ . 1 . 2]" 1
725 1 26 THR MG 1 27 PHE H . . 3.670 2.780 2.547 3.117 . 0 0 "[ . 1 . 2]" 1
726 1 26 THR MG 1 27 PHE HA . . 5.310 3.747 3.408 4.134 . 0 0 "[ . 1 . 2]" 1
727 1 26 THR MG 1 27 PHE HB3 . . 5.500 5.112 4.906 5.322 . 0 0 "[ . 1 . 2]" 1
728 1 26 THR MG 1 27 PHE QD . . 5.500 4.308 3.976 4.573 . 0 0 "[ . 1 . 2]" 1
729 1 26 THR MG 1 28 ASN H . . 5.500 4.884 4.281 5.259 . 0 0 "[ . 1 . 2]" 1
730 1 26 THR MG 1 28 ASN HA . . 5.500 5.229 4.697 5.585 0.085 10 0 "[ . 1 . 2]" 1
731 1 26 THR MG 1 28 ASN QB . . 5.500 4.233 3.535 4.783 . 0 0 "[ . 1 . 2]" 1
732 1 26 THR MG 1 28 ASN HD21 . . 5.350 3.010 2.132 4.539 . 0 0 "[ . 1 . 2]" 1
733 1 26 THR MG 1 28 ASN HD22 . . 4.530 3.118 2.011 4.629 0.099 7 0 "[ . 1 . 2]" 1
734 1 26 THR MG 1 39 CYS H . . 5.500 4.416 3.772 5.135 . 0 0 "[ . 1 . 2]" 1
735 1 26 THR MG 1 39 CYS HB2 . . 4.590 3.716 3.136 4.329 . 0 0 "[ . 1 . 2]" 1
736 1 26 THR MG 1 39 CYS HB3 . . 4.980 4.123 3.132 4.910 . 0 0 "[ . 1 . 2]" 1
737 1 27 PHE H 1 27 PHE HB3 . . 4.130 3.361 3.192 3.502 . 0 0 "[ . 1 . 2]" 1
738 1 27 PHE H 1 27 PHE QD . . 4.140 2.281 1.827 2.656 . 0 0 "[ . 1 . 2]" 1
739 1 27 PHE H 1 27 PHE QE . . 5.260 3.905 3.731 4.073 . 0 0 "[ . 1 . 2]" 1
740 1 27 PHE H 1 27 PHE HZ . . 5.500 5.428 5.065 5.595 0.095 5 0 "[ . 1 . 2]" 1
741 1 27 PHE H 1 28 ASN H . . 5.320 4.274 4.085 4.401 . 0 0 "[ . 1 . 2]" 1
742 1 27 PHE H 1 36 ILE MD . . 5.500 5.607 5.584 5.621 0.121 9 0 "[ . 1 . 2]" 1
743 1 27 PHE H 1 38 PRO HA . . 5.500 4.397 4.223 4.621 . 0 0 "[ . 1 . 2]" 1
744 1 27 PHE HA 1 27 PHE QD . . 4.460 3.714 3.681 3.762 . 0 0 "[ . 1 . 2]" 1
745 1 27 PHE HA 1 28 ASN H . . 3.240 2.288 2.174 2.454 . 0 0 "[ . 1 . 2]" 1
746 1 27 PHE HA 1 28 ASN QB . . 5.490 4.358 4.055 4.757 . 0 0 "[ . 1 . 2]" 1
747 1 27 PHE HA 1 36 ILE HB . . 5.320 4.726 4.449 4.999 . 0 0 "[ . 1 . 2]" 1
748 1 27 PHE HA 1 37 VAL H . . 5.330 4.259 4.059 4.478 . 0 0 "[ . 1 . 2]" 1
749 1 27 PHE HA 1 38 PRO HA . . 3.690 2.218 2.009 2.547 . 0 0 "[ . 1 . 2]" 1
750 1 27 PHE HA 1 38 PRO HB3 . . 5.500 4.324 3.933 4.735 . 0 0 "[ . 1 . 2]" 1
751 1 27 PHE HA 1 39 CYS H . . 4.350 3.108 2.664 3.751 . 0 0 "[ . 1 . 2]" 1
752 1 27 PHE HB2 1 28 ASN H . . 5.050 2.744 2.435 3.319 . 0 0 "[ . 1 . 2]" 1
753 1 27 PHE HB2 1 36 ILE HA . . 5.440 4.660 4.396 4.952 . 0 0 "[ . 1 . 2]" 1
754 1 27 PHE HB2 1 36 ILE HB . . 4.000 2.732 2.547 2.917 . 0 0 "[ . 1 . 2]" 1
755 1 27 PHE HB2 1 36 ILE MD . . 4.100 3.681 3.131 4.061 . 0 0 "[ . 1 . 2]" 1
756 1 27 PHE HB2 1 36 ILE HG13 . . 5.500 4.397 3.773 5.045 . 0 0 "[ . 1 . 2]" 1
757 1 27 PHE HB2 1 36 ILE MG . . 4.710 3.947 3.925 3.998 . 0 0 "[ . 1 . 2]" 1
758 1 27 PHE HB2 1 37 VAL H . . 4.760 3.396 3.261 3.772 . 0 0 "[ . 1 . 2]" 1
759 1 27 PHE HB2 1 38 PRO HA . . 5.500 2.996 2.784 3.190 . 0 0 "[ . 1 . 2]" 1
760 1 27 PHE HB3 1 28 ASN H . . 5.150 3.898 3.722 4.226 . 0 0 "[ . 1 . 2]" 1
761 1 27 PHE HB3 1 36 ILE HB . . 4.550 4.430 4.271 4.629 0.079 1 0 "[ . 1 . 2]" 1
762 1 27 PHE HB3 1 36 ILE MG . . 5.250 5.352 5.334 5.365 0.115 2 0 "[ . 1 . 2]" 1
763 1 27 PHE HB3 1 37 VAL H . . 5.500 4.854 4.685 5.274 . 0 0 "[ . 1 . 2]" 1
764 1 27 PHE HB3 1 38 PRO HA . . 5.500 2.097 1.986 2.289 . 0 0 "[ . 1 . 2]" 1
765 1 27 PHE QD 1 28 ASN H . . 5.160 4.101 3.566 4.636 . 0 0 "[ . 1 . 2]" 1
766 1 27 PHE QD 1 28 ASN HD21 . . 5.500 5.591 5.544 5.606 0.106 1 0 "[ . 1 . 2]" 1
767 1 27 PHE QD 1 36 ILE HA . . 5.500 4.700 4.466 5.001 . 0 0 "[ . 1 . 2]" 1
768 1 27 PHE QD 1 36 ILE HB . . 4.450 2.243 2.066 2.529 . 0 0 "[ . 1 . 2]" 1
769 1 27 PHE QD 1 36 ILE MD . . 4.020 2.135 1.913 2.553 . 0 0 "[ . 1 . 2]" 1
770 1 27 PHE QD 1 36 ILE HG12 . . 5.440 4.055 3.736 4.308 . 0 0 "[ . 1 . 2]" 1
771 1 27 PHE QD 1 36 ILE HG13 . . 5.000 3.197 2.262 4.093 . 0 0 "[ . 1 . 2]" 1
772 1 27 PHE QD 1 36 ILE MG . . 5.150 3.135 2.607 3.735 . 0 0 "[ . 1 . 2]" 1
773 1 27 PHE QD 1 37 VAL H . . 5.100 4.388 4.192 4.622 . 0 0 "[ . 1 . 2]" 1
774 1 27 PHE QD 1 37 VAL HA . . 5.200 5.139 4.805 5.305 0.105 13 0 "[ . 1 . 2]" 1
775 1 27 PHE QD 1 37 VAL QG . . 5.500 5.162 5.054 5.222 . 0 0 "[ . 1 . 2]" 1
776 1 27 PHE QD 1 38 PRO HA . . 4.650 4.140 4.020 4.334 . 0 0 "[ . 1 . 2]" 1
777 1 27 PHE QD 1 38 PRO HB2 . . 5.500 5.538 5.260 5.631 0.131 18 0 "[ . 1 . 2]" 1
778 1 27 PHE QD 1 39 CYS H . . 5.470 5.106 4.869 5.347 . 0 0 "[ . 1 . 2]" 1
779 1 27 PHE QD 1 80 LEU QD . . 4.680 3.268 2.781 4.181 . 0 0 "[ . 1 . 2]" 1
780 1 27 PHE QD 1 80 LEU HG . . 5.500 4.884 3.635 5.606 0.106 15 0 "[ . 1 . 2]" 1
781 1 27 PHE QE 1 36 ILE HB . . 5.500 4.213 4.026 4.430 . 0 0 "[ . 1 . 2]" 1
782 1 27 PHE QE 1 36 ILE MD . . 4.820 2.031 1.959 2.199 . 0 0 "[ . 1 . 2]" 1
783 1 27 PHE QE 1 80 LEU HB2 . . 5.500 4.896 4.239 5.447 . 0 0 "[ . 1 . 2]" 1
784 1 27 PHE QE 1 80 LEU QD . . 4.690 2.465 2.024 3.130 . 0 0 "[ . 1 . 2]" 1
785 1 27 PHE HZ 1 36 ILE MD . . 4.100 3.928 3.558 4.181 0.081 15 0 "[ . 1 . 2]" 1
786 1 27 PHE HZ 1 36 ILE MG . . 5.500 5.528 5.350 5.616 0.116 10 0 "[ . 1 . 2]" 1
787 1 27 PHE HZ 1 80 LEU QD . . 4.680 3.158 2.920 3.616 . 0 0 "[ . 1 . 2]" 1
788 1 28 ASN H 1 28 ASN QB . . 3.830 3.149 2.752 3.387 . 0 0 "[ . 1 . 2]" 1
789 1 28 ASN H 1 28 ASN HD21 . . 5.430 3.110 2.061 3.901 . 0 0 "[ . 1 . 2]" 1
790 1 28 ASN H 1 28 ASN HD22 . . 5.500 3.914 3.306 4.491 . 0 0 "[ . 1 . 2]" 1
791 1 28 ASN H 1 29 THR H . . 5.500 4.366 4.264 4.432 . 0 0 "[ . 1 . 2]" 1
792 1 28 ASN H 1 29 THR HA . . 5.500 4.749 4.494 5.127 . 0 0 "[ . 1 . 2]" 1
793 1 28 ASN H 1 36 ILE HA . . 5.500 3.989 3.758 4.348 . 0 0 "[ . 1 . 2]" 1
794 1 28 ASN H 1 36 ILE HB . . 5.160 3.473 3.075 4.186 . 0 0 "[ . 1 . 2]" 1
795 1 28 ASN H 1 36 ILE MD . . 5.500 5.051 4.723 5.562 0.062 8 0 "[ . 1 . 2]" 1
796 1 28 ASN H 1 36 ILE MG . . 5.500 3.628 3.351 3.865 . 0 0 "[ . 1 . 2]" 1
797 1 28 ASN H 1 37 VAL H . . 4.080 2.611 2.456 2.914 . 0 0 "[ . 1 . 2]" 1
798 1 28 ASN H 1 37 VAL HB . . 5.500 5.211 5.068 5.362 . 0 0 "[ . 1 . 2]" 1
799 1 28 ASN H 1 37 VAL QG . . 4.280 3.187 3.018 3.346 . 0 0 "[ . 1 . 2]" 1
800 1 28 ASN H 1 38 PRO HA . . 4.580 3.903 3.634 4.225 . 0 0 "[ . 1 . 2]" 1
801 1 28 ASN HA 1 28 ASN HD22 . . 5.500 4.918 4.573 5.212 . 0 0 "[ . 1 . 2]" 1
802 1 28 ASN HA 1 29 THR H . . 3.240 2.527 2.385 2.728 . 0 0 "[ . 1 . 2]" 1
803 1 28 ASN HA 1 29 THR HA . . 5.500 4.221 4.019 4.421 . 0 0 "[ . 1 . 2]" 1
804 1 28 ASN HA 1 29 THR MG . . 5.470 4.823 3.813 5.518 0.048 13 0 "[ . 1 . 2]" 1
805 1 28 ASN HA 1 36 ILE HB . . 5.500 4.099 3.563 4.637 . 0 0 "[ . 1 . 2]" 1
806 1 28 ASN HA 1 36 ILE MG . . 5.450 2.703 2.194 3.242 . 0 0 "[ . 1 . 2]" 1
807 1 28 ASN HA 1 37 VAL H . . 5.500 4.514 4.330 4.750 . 0 0 "[ . 1 . 2]" 1
808 1 28 ASN QB 1 29 THR H . . 3.700 2.373 2.165 2.753 . 0 0 "[ . 1 . 2]" 1
809 1 28 ASN QB 1 29 THR HA . . 5.500 4.472 4.322 4.595 . 0 0 "[ . 1 . 2]" 1
810 1 28 ASN QB 1 29 THR HB . . 5.380 4.736 4.319 5.234 . 0 0 "[ . 1 . 2]" 1
811 1 28 ASN QB 1 29 THR MG . . 5.500 4.919 4.263 5.340 . 0 0 "[ . 1 . 2]" 1
812 1 28 ASN QB 1 37 VAL H . . 5.500 4.739 4.152 5.081 . 0 0 "[ . 1 . 2]" 1
813 1 28 ASN QB 1 37 VAL QG . . 4.900 4.185 3.435 4.605 . 0 0 "[ . 1 . 2]" 1
814 1 28 ASN HD21 1 29 THR H . . 5.500 5.407 5.173 5.551 0.051 1 0 "[ . 1 . 2]" 1
815 1 28 ASN HD21 1 37 VAL QG . . 5.500 4.713 2.957 5.497 . 0 0 "[ . 1 . 2]" 1
816 1 28 ASN HD21 1 39 CYS HB2 . . 5.500 4.546 2.737 5.558 0.058 10 0 "[ . 1 . 2]" 1
817 1 28 ASN HD22 1 37 VAL QG . . 5.500 4.832 3.502 5.513 0.013 14 0 "[ . 1 . 2]" 1
818 1 28 ASN HD22 1 39 CYS H . . 5.500 4.787 3.162 5.572 0.072 15 0 "[ . 1 . 2]" 1
819 1 28 ASN HD22 1 39 CYS HB2 . . 5.060 3.961 2.721 5.110 0.050 20 0 "[ . 1 . 2]" 1
820 1 29 THR H 1 29 THR HB . . 3.430 2.992 2.592 3.469 0.039 10 0 "[ . 1 . 2]" 1
821 1 29 THR H 1 29 THR MG . . 3.820 3.289 2.468 3.720 . 0 0 "[ . 1 . 2]" 1
822 1 29 THR H 1 30 GLY H . . 5.080 4.599 4.456 4.676 . 0 0 "[ . 1 . 2]" 1
823 1 29 THR H 1 36 ILE HA . . 5.500 4.201 3.933 4.480 . 0 0 "[ . 1 . 2]" 1
824 1 29 THR H 1 36 ILE MG . . 5.230 3.042 2.746 3.338 . 0 0 "[ . 1 . 2]" 1
825 1 29 THR HA 1 29 THR MG . . 3.470 2.189 2.108 2.302 . 0 0 "[ . 1 . 2]" 1
826 1 29 THR HA 1 30 GLY H . . 3.130 2.216 2.100 2.378 . 0 0 "[ . 1 . 2]" 1
827 1 29 THR HA 1 30 GLY HA2 . . 5.090 4.531 4.446 4.679 . 0 0 "[ . 1 . 2]" 1
828 1 29 THR HA 1 30 GLY HA3 . . 5.140 4.347 4.260 4.462 . 0 0 "[ . 1 . 2]" 1
829 1 29 THR HA 1 36 ILE HA . . 3.610 2.099 1.899 2.420 . 0 0 "[ . 1 . 2]" 1
830 1 29 THR HA 1 36 ILE HB . . 5.500 4.157 3.874 4.610 . 0 0 "[ . 1 . 2]" 1
831 1 29 THR HA 1 36 ILE MD . . 5.500 5.222 4.905 5.568 0.068 6 0 "[ . 1 . 2]" 1
832 1 29 THR HA 1 36 ILE MG . . 3.850 2.368 2.103 2.806 . 0 0 "[ . 1 . 2]" 1
833 1 29 THR HA 1 37 VAL H . . 4.490 3.703 3.471 3.965 . 0 0 "[ . 1 . 2]" 1
834 1 29 THR HA 1 37 VAL QG . . 4.930 3.660 3.372 3.954 . 0 0 "[ . 1 . 2]" 1
835 1 29 THR HB 1 30 GLY H . . 3.970 3.665 2.949 4.025 0.055 9 0 "[ . 1 . 2]" 1
836 1 29 THR HB 1 30 GLY HA3 . . 5.500 5.380 4.891 5.565 0.065 19 0 "[ . 1 . 2]" 1
837 1 29 THR HB 1 36 ILE HA . . 5.500 4.972 4.587 5.170 . 0 0 "[ . 1 . 2]" 1
838 1 29 THR HB 1 36 ILE MG . . 5.340 4.331 4.013 4.619 . 0 0 "[ . 1 . 2]" 1
839 1 29 THR MG 1 30 GLY H . . 3.610 2.826 2.088 3.570 . 0 0 "[ . 1 . 2]" 1
840 1 29 THR MG 1 30 GLY HA2 . . 5.500 4.479 3.720 5.455 . 0 0 "[ . 1 . 2]" 1
841 1 29 THR MG 1 30 GLY HA3 . . 5.500 4.932 4.356 5.604 0.104 16 0 "[ . 1 . 2]" 1
842 1 29 THR MG 1 35 GLY H . . 5.500 5.329 4.682 5.597 0.097 15 0 "[ . 1 . 2]" 1
843 1 29 THR MG 1 35 GLY HA2 . . 5.500 3.978 3.355 4.471 . 0 0 "[ . 1 . 2]" 1
844 1 29 THR MG 1 35 GLY HA3 . . 5.500 2.973 2.288 3.413 . 0 0 "[ . 1 . 2]" 1
845 1 29 THR MG 1 36 ILE HA . . 4.780 3.530 3.224 3.796 . 0 0 "[ . 1 . 2]" 1
846 1 29 THR MG 1 36 ILE MG . . 4.140 2.662 2.271 3.085 . 0 0 "[ . 1 . 2]" 1
847 1 29 THR MG 1 37 VAL QG . . 5.500 4.528 4.130 4.912 . 0 0 "[ . 1 . 2]" 1
848 1 30 GLY H 1 35 GLY HA2 . . 5.440 3.953 3.693 4.220 . 0 0 "[ . 1 . 2]" 1
849 1 30 GLY H 1 35 GLY HA3 . . 5.500 4.091 3.756 4.404 . 0 0 "[ . 1 . 2]" 1
850 1 30 GLY H 1 36 ILE H . . 5.500 4.527 4.236 4.837 . 0 0 "[ . 1 . 2]" 1
851 1 30 GLY H 1 36 ILE HA . . 3.710 2.873 2.443 3.111 . 0 0 "[ . 1 . 2]" 1
852 1 30 GLY H 1 36 ILE HB . . 5.500 5.414 5.020 5.576 0.076 13 0 "[ . 1 . 2]" 1
853 1 30 GLY H 1 36 ILE MG . . 4.530 4.030 3.693 4.373 . 0 0 "[ . 1 . 2]" 1
854 1 30 GLY H 1 37 VAL H . . 4.620 4.059 3.562 4.462 . 0 0 "[ . 1 . 2]" 1
855 1 30 GLY H 1 37 VAL QG . . 4.420 2.976 2.599 3.485 . 0 0 "[ . 1 . 2]" 1
856 1 30 GLY HA2 1 31 ASP HA . . 5.500 4.775 4.610 4.908 . 0 0 "[ . 1 . 2]" 1
857 1 30 GLY HA2 1 31 ASP HB2 . . 4.700 4.495 4.128 4.788 0.088 2 0 "[ . 1 . 2]" 1
858 1 30 GLY HA2 1 31 ASP HB3 . . 5.320 5.115 4.767 5.403 0.083 14 0 "[ . 1 . 2]" 1
859 1 30 GLY HA2 1 36 ILE HA . . 5.500 5.371 5.112 5.540 0.040 3 0 "[ . 1 . 2]" 1
860 1 30 GLY HA2 1 37 VAL QG . . 4.100 3.339 3.095 3.483 . 0 0 "[ . 1 . 2]" 1
861 1 30 GLY HA3 1 31 ASP HA . . 4.890 4.554 4.429 4.626 . 0 0 "[ . 1 . 2]" 1
862 1 30 GLY HA3 1 31 ASP HB2 . . 5.390 4.540 4.079 4.829 . 0 0 "[ . 1 . 2]" 1
863 1 30 GLY HA3 1 31 ASP HB3 . . 5.390 4.555 4.191 4.984 . 0 0 "[ . 1 . 2]" 1
864 1 30 GLY HA3 1 36 ILE HA . . 5.500 4.473 4.168 4.729 . 0 0 "[ . 1 . 2]" 1
865 1 30 GLY HA3 1 37 VAL H . . 5.320 4.335 4.017 4.661 . 0 0 "[ . 1 . 2]" 1
866 1 30 GLY HA3 1 37 VAL HB . . 5.500 4.613 4.252 4.869 . 0 0 "[ . 1 . 2]" 1
867 1 30 GLY HA3 1 37 VAL QG . . 3.340 2.076 1.923 2.211 . 0 0 "[ . 1 . 2]" 1
868 1 31 ASP H 1 31 ASP HB2 . . 3.830 3.411 3.120 3.700 . 0 0 "[ . 1 . 2]" 1
869 1 31 ASP H 1 31 ASP HB3 . . 3.860 2.981 2.505 3.237 . 0 0 "[ . 1 . 2]" 1
870 1 31 ASP H 1 32 SER H . . 5.500 3.810 3.364 4.086 . 0 0 "[ . 1 . 2]" 1
871 1 31 ASP H 1 37 VAL QG . . 4.890 1.973 1.716 2.519 . 0 0 "[ . 1 . 2]" 1
872 1 31 ASP HA 1 32 SER H . . 3.080 2.235 2.096 2.309 . 0 0 "[ . 1 . 2]" 1
873 1 31 ASP HA 1 35 GLY H . . 5.500 4.982 4.625 5.434 . 0 0 "[ . 1 . 2]" 1
874 1 31 ASP HA 1 35 GLY HA2 . . 5.500 3.300 2.858 3.713 . 0 0 "[ . 1 . 2]" 1
875 1 31 ASP HA 1 37 VAL QG . . 4.810 3.972 3.692 4.563 . 0 0 "[ . 1 . 2]" 1
876 1 31 ASP HB2 1 32 SER H . . 4.610 4.498 4.327 4.668 0.058 12 0 "[ . 1 . 2]" 1
877 1 31 ASP HB2 1 37 VAL QG . . 5.500 4.377 3.855 4.741 . 0 0 "[ . 1 . 2]" 1
878 1 31 ASP HB2 1 71 THR MG . . 5.500 5.475 4.750 5.628 0.128 10 0 "[ . 1 . 2]" 1
879 1 31 ASP HB3 1 32 SER H . . 4.630 4.440 4.236 4.585 . 0 0 "[ . 1 . 2]" 1
880 1 31 ASP HB3 1 37 VAL QG . . 5.330 3.619 3.147 4.035 . 0 0 "[ . 1 . 2]" 1
881 1 31 ASP HB3 1 71 THR MG . . 5.500 4.807 3.915 5.400 . 0 0 "[ . 1 . 2]" 1
882 1 32 SER H 1 32 SER HA . . 2.840 2.804 2.721 2.885 0.045 12 0 "[ . 1 . 2]" 1
883 1 32 SER H 1 33 GLU HA . . 5.500 4.990 4.704 5.313 . 0 0 "[ . 1 . 2]" 1
884 1 32 SER H 1 34 GLN H . . 5.500 4.931 4.170 5.551 0.051 13 0 "[ . 1 . 2]" 1
885 1 32 SER H 1 35 GLY H . . 4.310 3.096 2.588 3.492 . 0 0 "[ . 1 . 2]" 1
886 1 32 SER H 1 35 GLY HA2 . . 4.330 2.379 2.035 2.861 . 0 0 "[ . 1 . 2]" 1
887 1 32 SER H 1 35 GLY HA3 . . 4.820 4.111 3.763 4.475 . 0 0 "[ . 1 . 2]" 1
888 1 32 SER H 1 36 ILE H . . 5.500 4.854 3.981 5.356 . 0 0 "[ . 1 . 2]" 1
889 1 32 SER H 1 37 VAL QG . . 5.170 3.985 3.586 4.588 . 0 0 "[ . 1 . 2]" 1
890 1 32 SER HA 1 35 GLY HA2 . . 5.340 4.899 4.559 5.391 0.051 6 0 "[ . 1 . 2]" 1
891 1 32 SER QB 1 33 GLU HB3 . . 4.860 3.912 3.282 4.504 . 0 0 "[ . 1 . 2]" 1
892 1 32 SER QB 1 34 GLN H . . 4.650 3.053 2.263 3.758 . 0 0 "[ . 1 . 2]" 1
893 1 32 SER QB 1 34 GLN HB2 . . 5.500 4.199 3.506 4.882 . 0 0 "[ . 1 . 2]" 1
894 1 32 SER QB 1 35 GLY H . . 4.930 3.385 2.627 3.945 . 0 0 "[ . 1 . 2]" 1
895 1 32 SER QB 1 36 ILE H . . 5.330 3.716 2.376 4.767 . 0 0 "[ . 1 . 2]" 1
896 1 32 SER QB 1 37 VAL QG . . 4.070 2.489 2.007 3.079 . 0 0 "[ . 1 . 2]" 1
897 1 33 GLU HA 1 33 GLU HB3 . . 3.050 2.939 2.281 3.063 0.013 13 0 "[ . 1 . 2]" 1
898 1 33 GLU HA 1 34 GLN HA . . 4.680 4.696 4.530 4.756 0.076 17 0 "[ . 1 . 2]" 1
899 1 33 GLU HA 1 35 GLY H . . 4.900 3.819 3.588 4.208 . 0 0 "[ . 1 . 2]" 1
900 1 33 GLU HB3 1 34 GLN H . . 3.960 2.648 2.068 4.004 0.044 19 0 "[ . 1 . 2]" 1
901 1 33 GLU HB3 1 34 GLN HA . . 5.500 4.788 4.380 5.605 0.105 19 0 "[ . 1 . 2]" 1
902 1 33 GLU QG 1 34 GLN H . . 5.410 3.099 1.981 3.910 . 0 0 "[ . 1 . 2]" 1
903 1 33 GLU QG 1 34 GLN HA . . 5.500 3.755 3.465 4.200 . 0 0 "[ . 1 . 2]" 1
904 1 33 GLU QG 1 34 GLN QE . . 5.500 4.310 3.044 4.933 . 0 0 "[ . 1 . 2]" 1
905 1 33 GLU QG 1 34 GLN QG . . 3.580 2.665 2.014 3.457 . 0 0 "[ . 1 . 2]" 1
906 1 34 GLN H 1 34 GLN HB2 . . 4.080 2.422 2.245 2.535 . 0 0 "[ . 1 . 2]" 1
907 1 34 GLN H 1 34 GLN QG . . 4.400 2.815 2.238 3.742 . 0 0 "[ . 1 . 2]" 1
908 1 34 GLN H 1 35 GLY H . . 4.010 2.710 2.332 3.051 . 0 0 "[ . 1 . 2]" 1
909 1 34 GLN H 1 35 GLY HA3 . . 5.500 5.204 4.880 5.551 0.051 18 0 "[ . 1 . 2]" 1
910 1 34 GLN H 1 36 ILE H . . 5.260 3.916 3.074 4.530 . 0 0 "[ . 1 . 2]" 1
911 1 34 GLN HA 1 34 GLN QE . . 5.500 4.747 4.248 5.018 . 0 0 "[ . 1 . 2]" 1
912 1 34 GLN HA 1 34 GLN QG . . 3.670 2.297 2.097 2.683 . 0 0 "[ . 1 . 2]" 1
913 1 34 GLN HA 1 36 ILE H . . 5.500 4.165 4.117 4.271 . 0 0 "[ . 1 . 2]" 1
914 1 34 GLN HB2 1 35 GLY H . . 4.850 3.993 3.881 4.141 . 0 0 "[ . 1 . 2]" 1
915 1 34 GLN HB2 1 36 ILE H . . 4.690 3.192 2.961 3.572 . 0 0 "[ . 1 . 2]" 1
916 1 34 GLN HB2 1 36 ILE MD . . 5.350 3.085 2.532 3.557 . 0 0 "[ . 1 . 2]" 1
917 1 34 GLN HB2 1 36 ILE HG13 . . 5.500 2.678 2.175 3.322 . 0 0 "[ . 1 . 2]" 1
918 1 34 GLN HB3 1 35 GLY H . . 5.500 4.478 4.427 4.558 . 0 0 "[ . 1 . 2]" 1
919 1 34 GLN HB3 1 36 ILE H . . 4.940 3.485 3.259 3.695 . 0 0 "[ . 1 . 2]" 1
920 1 34 GLN HB3 1 36 ILE MD . . 5.500 2.804 2.460 3.321 . 0 0 "[ . 1 . 2]" 1
921 1 34 GLN HB3 1 36 ILE HG12 . . 5.110 2.495 2.172 2.903 . 0 0 "[ . 1 . 2]" 1
922 1 34 GLN HB3 1 36 ILE HG13 . . 5.500 3.394 2.617 3.913 . 0 0 "[ . 1 . 2]" 1
923 1 34 GLN QE 1 80 LEU H . . 4.320 2.974 2.275 3.813 . 0 0 "[ . 1 . 2]" 1
924 1 34 GLN QE 1 80 LEU HA . . 5.500 4.457 4.062 4.815 . 0 0 "[ . 1 . 2]" 1
925 1 34 GLN QE 1 80 LEU HB2 . . 5.080 4.069 3.682 4.526 . 0 0 "[ . 1 . 2]" 1
926 1 34 GLN QE 1 80 LEU HB3 . . 5.150 2.638 2.129 3.370 . 0 0 "[ . 1 . 2]" 1
927 1 34 GLN QE 1 80 LEU QD . . 5.500 2.431 1.763 3.297 . 0 0 "[ . 1 . 2]" 1
928 1 34 GLN QE 1 80 LEU HG . . 5.500 3.284 1.926 4.691 . 0 0 "[ . 1 . 2]" 1
929 1 34 GLN QE 1 81 ASP HA . . 5.030 4.125 3.727 4.479 . 0 0 "[ . 1 . 2]" 1
930 1 34 GLN QE 1 82 VAL H . . 5.500 3.571 2.961 4.113 . 0 0 "[ . 1 . 2]" 1
931 1 34 GLN QE 1 82 VAL MG1 . . 5.490 3.872 2.955 4.376 . 0 0 "[ . 1 . 2]" 1
932 1 34 GLN QG 1 35 GLY H . . 5.500 4.581 4.363 4.821 . 0 0 "[ . 1 . 2]" 1
933 1 34 GLN QG 1 36 ILE H . . 5.500 4.885 4.759 4.960 . 0 0 "[ . 1 . 2]" 1
934 1 35 GLY H 1 36 ILE H . . 3.970 3.198 2.854 3.418 . 0 0 "[ . 1 . 2]" 1
935 1 35 GLY H 1 36 ILE HA . . 5.500 5.502 5.401 5.561 0.061 8 0 "[ . 1 . 2]" 1
936 1 35 GLY H 1 36 ILE HG13 . . 5.500 5.207 4.688 5.579 0.079 20 0 "[ . 1 . 2]" 1
937 1 35 GLY HA2 1 36 ILE MG . . 5.500 4.939 4.694 5.223 . 0 0 "[ . 1 . 2]" 1
938 1 35 GLY HA3 1 36 ILE HG12 . . 5.500 4.491 4.266 4.747 . 0 0 "[ . 1 . 2]" 1
939 1 35 GLY HA3 1 36 ILE MG . . 5.500 3.917 3.675 4.244 . 0 0 "[ . 1 . 2]" 1
940 1 36 ILE H 1 36 ILE MD . . 4.910 3.515 3.197 3.832 . 0 0 "[ . 1 . 2]" 1
941 1 36 ILE H 1 36 ILE HG12 . . 4.030 1.939 1.649 2.607 . 0 0 "[ . 1 . 2]" 1
942 1 36 ILE H 1 36 ILE HG13 . . 4.410 2.677 2.192 3.107 . 0 0 "[ . 1 . 2]" 1
943 1 36 ILE H 1 36 ILE MG . . 4.520 2.749 2.343 3.405 . 0 0 "[ . 1 . 2]" 1
944 1 36 ILE H 1 37 VAL H . . 5.420 4.566 4.446 4.637 . 0 0 "[ . 1 . 2]" 1
945 1 36 ILE H 1 37 VAL QG . . 5.500 4.303 3.629 4.545 . 0 0 "[ . 1 . 2]" 1
946 1 36 ILE HA 1 36 ILE MG . . 3.640 2.246 2.138 2.358 . 0 0 "[ . 1 . 2]" 1
947 1 36 ILE HA 1 37 VAL H . . 3.260 2.172 2.097 2.320 . 0 0 "[ . 1 . 2]" 1
948 1 36 ILE HA 1 37 VAL HA . . 5.500 4.419 4.342 4.499 . 0 0 "[ . 1 . 2]" 1
949 1 36 ILE HA 1 37 VAL QG . . 4.400 2.952 2.723 3.188 . 0 0 "[ . 1 . 2]" 1
950 1 36 ILE HB 1 37 VAL H . . 3.940 2.761 2.461 3.019 . 0 0 "[ . 1 . 2]" 1
951 1 36 ILE HB 1 37 VAL HA . . 4.480 4.335 4.026 4.542 0.062 16 0 "[ . 1 . 2]" 1
952 1 36 ILE HB 1 37 VAL QG . . 5.500 4.107 3.971 4.241 . 0 0 "[ . 1 . 2]" 1
953 1 36 ILE MD 1 36 ILE MG . . 3.630 2.038 1.926 2.148 . 0 0 "[ . 1 . 2]" 1
954 1 36 ILE MD 1 37 VAL H . . 5.260 4.728 4.250 5.082 . 0 0 "[ . 1 . 2]" 1
955 1 36 ILE MD 1 80 LEU QD . . 4.000 2.224 1.858 2.919 . 0 0 "[ . 1 . 2]" 1
956 1 36 ILE HG12 1 36 ILE MG . . 3.580 2.441 2.243 2.734 . 0 0 "[ . 1 . 2]" 1
957 1 36 ILE HG12 1 37 VAL H . . 5.500 5.055 4.754 5.311 . 0 0 "[ . 1 . 2]" 1
958 1 36 ILE HG12 1 80 LEU QD . . 5.500 4.268 3.694 4.923 . 0 0 "[ . 1 . 2]" 1
959 1 36 ILE HG13 1 37 VAL H . . 5.500 4.430 4.146 4.752 . 0 0 "[ . 1 . 2]" 1
960 1 36 ILE HG13 1 80 LEU QD . . 5.500 3.602 2.648 4.367 . 0 0 "[ . 1 . 2]" 1
961 1 36 ILE MG 1 80 LEU QD . . 5.500 4.582 4.076 5.300 . 0 0 "[ . 1 . 2]" 1
962 1 37 VAL H 1 37 VAL QG . . 3.330 2.078 1.949 2.188 . 0 0 "[ . 1 . 2]" 1
963 1 37 VAL HA 1 38 PRO HD2 . . 3.540 2.462 2.132 3.240 . 0 0 "[ . 1 . 2]" 1
964 1 37 VAL HA 1 38 PRO HD3 . . 3.660 2.321 2.043 2.554 . 0 0 "[ . 1 . 2]" 1
965 1 37 VAL HA 1 38 PRO HG2 . . 5.350 4.568 4.336 4.709 . 0 0 "[ . 1 . 2]" 1
966 1 37 VAL HA 1 38 PRO HG3 . . 5.470 4.506 3.907 4.678 . 0 0 "[ . 1 . 2]" 1
967 1 37 VAL HA 1 78 ALA MB . . 5.100 3.791 3.197 4.381 . 0 0 "[ . 1 . 2]" 1
968 1 37 VAL HB 1 38 PRO HD3 . . 4.060 3.927 3.110 4.395 0.335 17 0 "[ . 1 . 2]" 1
969 1 37 VAL HB 1 38 PRO HG2 . . 5.500 4.583 4.222 5.079 . 0 0 "[ . 1 . 2]" 1
970 1 37 VAL HB 1 78 ALA MB . . 5.500 4.276 3.315 5.575 0.075 17 0 "[ . 1 . 2]" 1
971 1 37 VAL QG 1 38 PRO HD2 . . 5.110 3.277 3.085 3.580 . 0 0 "[ . 1 . 2]" 1
972 1 37 VAL QG 1 38 PRO HD3 . . 5.370 3.806 3.245 4.040 . 0 0 "[ . 1 . 2]" 1
973 1 37 VAL QG 1 68 PRO HA . . 5.500 4.137 3.603 4.424 . 0 0 "[ . 1 . 2]" 1
974 1 37 VAL QG 1 69 LEU H . . 5.500 4.272 3.958 4.635 . 0 0 "[ . 1 . 2]" 1
975 1 37 VAL QG 1 70 THR H . . 5.280 4.405 3.898 5.006 . 0 0 "[ . 1 . 2]" 1
976 1 37 VAL QG 1 78 ALA MB . . 4.290 3.588 2.761 4.292 0.002 17 0 "[ . 1 . 2]" 1
977 1 38 PRO HA 1 39 CYS H . . 3.290 2.238 2.086 2.455 . 0 0 "[ . 1 . 2]" 1
978 1 38 PRO HA 1 39 CYS HB3 . . 5.500 4.872 4.204 5.580 0.080 18 0 "[ . 1 . 2]" 1
979 1 38 PRO HA 1 40 LEU QD . . 5.500 4.291 3.728 4.770 . 0 0 "[ . 1 . 2]" 1
980 1 38 PRO HB2 1 39 CYS H . . 4.490 2.941 2.394 3.328 . 0 0 "[ . 1 . 2]" 1
981 1 38 PRO HB2 1 39 CYS HA . . 5.500 4.689 4.448 5.004 . 0 0 "[ . 1 . 2]" 1
982 1 38 PRO HB2 1 40 LEU QD . . 5.270 2.418 2.024 3.051 . 0 0 "[ . 1 . 2]" 1
983 1 38 PRO HB3 1 39 CYS H . . 4.750 3.695 3.298 3.971 . 0 0 "[ . 1 . 2]" 1
984 1 38 PRO HB3 1 40 LEU QD . . 5.500 3.533 3.264 4.010 . 0 0 "[ . 1 . 2]" 1
985 1 38 PRO HD2 1 40 LEU QD . . 5.500 3.656 3.112 4.188 . 0 0 "[ . 1 . 2]" 1
986 1 38 PRO HD2 1 78 ALA MB . . 4.470 2.613 2.151 3.242 . 0 0 "[ . 1 . 2]" 1
987 1 38 PRO HD2 1 89 LEU QD . . 5.500 4.295 3.815 4.954 . 0 0 "[ . 1 . 2]" 1
988 1 38 PRO HD3 1 40 LEU QD . . 5.500 4.263 4.099 4.504 . 0 0 "[ . 1 . 2]" 1
989 1 38 PRO HD3 1 78 ALA MB . . 4.870 2.883 2.370 3.516 . 0 0 "[ . 1 . 2]" 1
990 1 38 PRO HD3 1 89 LEU QD . . 5.500 4.314 3.610 5.180 . 0 0 "[ . 1 . 2]" 1
991 1 38 PRO HG2 1 39 CYS H . . 5.500 4.541 4.073 5.097 . 0 0 "[ . 1 . 2]" 1
992 1 38 PRO HG2 1 40 LEU QD . . 5.500 2.211 1.972 2.554 . 0 0 "[ . 1 . 2]" 1
993 1 38 PRO HG2 1 78 ALA MB . . 4.230 3.090 2.409 3.821 . 0 0 "[ . 1 . 2]" 1
994 1 38 PRO HG2 1 87 LEU QD . . 4.920 3.304 2.389 3.805 . 0 0 "[ . 1 . 2]" 1
995 1 38 PRO HG2 1 89 LEU QD . . 5.460 3.381 2.634 3.937 . 0 0 "[ . 1 . 2]" 1
996 1 38 PRO HG3 1 39 CYS H . . 5.500 5.304 4.926 5.552 0.052 7 0 "[ . 1 . 2]" 1
997 1 38 PRO HG3 1 40 LEU QD . . 5.040 2.822 2.380 3.596 . 0 0 "[ . 1 . 2]" 1
998 1 38 PRO HG3 1 78 ALA HA . . 5.500 4.781 4.324 5.546 0.046 5 0 "[ . 1 . 2]" 1
999 1 38 PRO HG3 1 78 ALA MB . . 4.360 2.562 2.221 3.516 . 0 0 "[ . 1 . 2]" 1
1000 1 38 PRO HG3 1 89 LEU QD . . 5.500 2.805 2.205 3.588 . 0 0 "[ . 1 . 2]" 1
1001 1 39 CYS H 1 39 CYS HB2 . . 4.030 2.606 2.102 3.086 . 0 0 "[ . 1 . 2]" 1
1002 1 39 CYS H 1 39 CYS HB3 . . 4.020 2.806 2.230 3.683 . 0 0 "[ . 1 . 2]" 1
1003 1 39 CYS H 1 40 LEU H . . 5.230 4.263 4.037 4.458 . 0 0 "[ . 1 . 2]" 1
1004 1 39 CYS H 1 40 LEU QD . . 5.500 3.861 2.585 4.671 . 0 0 "[ . 1 . 2]" 1
1005 1 39 CYS H 1 40 LEU HG . . 5.500 4.695 4.091 5.585 0.085 12 0 "[ . 1 . 2]" 1
1006 1 39 CYS HA 1 40 LEU H . . 3.250 2.185 2.098 2.262 . 0 0 "[ . 1 . 2]" 1
1007 1 39 CYS HA 1 40 LEU HB2 . . 5.500 4.784 4.325 4.974 . 0 0 "[ . 1 . 2]" 1
1008 1 39 CYS HA 1 40 LEU QD . . 5.500 4.078 2.743 4.673 . 0 0 "[ . 1 . 2]" 1
1009 1 39 CYS HA 1 40 LEU HG . . 5.500 4.632 4.122 5.590 0.090 6 0 "[ . 1 . 2]" 1
1010 1 39 CYS HA 1 66 CYS HA . . 4.300 3.595 2.528 4.368 0.068 9 0 "[ . 1 . 2]" 1
1011 1 39 CYS HA 1 67 VAL H . . 5.100 4.385 4.004 4.881 . 0 0 "[ . 1 . 2]" 1
1012 1 39 CYS HB2 1 40 LEU H . . 5.500 4.423 4.253 4.557 . 0 0 "[ . 1 . 2]" 1
1013 1 39 CYS HB3 1 40 LEU H . . 4.720 4.188 3.535 4.533 . 0 0 "[ . 1 . 2]" 1
1014 1 39 CYS HB3 1 66 CYS HA . . 5.500 4.972 3.755 5.811 0.311 9 0 "[ . 1 . 2]" 1
1015 1 40 LEU H 1 40 LEU HB2 . . 4.170 2.756 2.579 2.998 . 0 0 "[ . 1 . 2]" 1
1016 1 40 LEU H 1 40 LEU QD . . 4.690 3.246 2.195 3.747 . 0 0 "[ . 1 . 2]" 1
1017 1 40 LEU H 1 40 LEU HG . . 4.500 3.414 2.870 4.327 . 0 0 "[ . 1 . 2]" 1
1018 1 40 LEU H 1 41 THR H . . 5.490 4.273 3.765 4.528 . 0 0 "[ . 1 . 2]" 1
1019 1 40 LEU H 1 45 LEU QD . . 5.500 4.370 3.813 4.642 . 0 0 "[ . 1 . 2]" 1
1020 1 40 LEU H 1 66 CYS HA . . 5.090 3.200 2.594 3.875 . 0 0 "[ . 1 . 2]" 1
1021 1 40 LEU HA 1 40 LEU QD . . 3.610 2.321 2.122 2.642 . 0 0 "[ . 1 . 2]" 1
1022 1 40 LEU HA 1 41 THR H . . 3.160 2.342 2.205 2.524 . 0 0 "[ . 1 . 2]" 1
1023 1 40 LEU HA 1 41 THR MG . . 4.740 3.396 3.057 3.700 . 0 0 "[ . 1 . 2]" 1
1024 1 40 LEU HA 1 44 GLN H . . 5.500 5.308 4.942 5.579 0.079 9 0 "[ . 1 . 2]" 1
1025 1 40 LEU HA 1 44 GLN HB3 . . 4.980 3.387 2.930 3.865 . 0 0 "[ . 1 . 2]" 1
1026 1 40 LEU HA 1 44 GLN HG3 . . 5.500 5.061 3.226 5.540 0.040 4 0 "[ . 1 . 2]" 1
1027 1 40 LEU HA 1 45 LEU H . . 5.050 4.947 4.460 5.121 0.071 7 0 "[ . 1 . 2]" 1
1028 1 40 LEU HA 1 45 LEU QD . . 5.500 4.010 3.591 4.367 . 0 0 "[ . 1 . 2]" 1
1029 1 40 LEU HA 1 45 LEU HG . . 5.500 4.217 3.549 5.366 . 0 0 "[ . 1 . 2]" 1
1030 1 40 LEU HA 1 48 MET ME . . 5.500 4.537 3.995 5.086 . 0 0 "[ . 1 . 2]" 1
1031 1 40 LEU HA 1 66 CYS HA . . 5.500 5.011 4.747 5.427 . 0 0 "[ . 1 . 2]" 1
1032 1 40 LEU HB2 1 41 THR H . . 4.740 4.001 3.318 4.616 . 0 0 "[ . 1 . 2]" 1
1033 1 40 LEU HB2 1 45 LEU QD . . 3.740 2.476 2.152 2.954 . 0 0 "[ . 1 . 2]" 1
1034 1 40 LEU HB3 1 41 THR H . . 4.940 3.220 2.696 4.072 . 0 0 "[ . 1 . 2]" 1
1035 1 40 LEU HB3 1 44 GLN HB3 . . 5.500 3.497 2.572 4.810 . 0 0 "[ . 1 . 2]" 1
1036 1 40 LEU HB3 1 45 LEU H . . 5.500 4.034 3.694 4.597 . 0 0 "[ . 1 . 2]" 1
1037 1 40 LEU HB3 1 45 LEU QD . . 3.860 2.275 2.009 2.670 . 0 0 "[ . 1 . 2]" 1
1038 1 40 LEU HB3 1 45 LEU HG . . 4.160 2.510 2.279 3.170 . 0 0 "[ . 1 . 2]" 1
1039 1 40 LEU QD 1 41 THR H . . 4.630 3.897 3.544 4.207 . 0 0 "[ . 1 . 2]" 1
1040 1 40 LEU QD 1 44 GLN HB3 . . 5.500 3.464 2.622 4.245 . 0 0 "[ . 1 . 2]" 1
1041 1 40 LEU QD 1 45 LEU H . . 5.500 4.719 4.267 5.202 . 0 0 "[ . 1 . 2]" 1
1042 1 40 LEU QD 1 45 LEU HA . . 5.500 4.179 3.560 5.135 . 0 0 "[ . 1 . 2]" 1
1043 1 40 LEU QD 1 48 MET ME . . 4.570 2.737 1.824 3.839 . 0 0 "[ . 1 . 2]" 1
1044 1 40 LEU QD 1 109 TRP HH2 . . 4.920 2.995 2.279 3.502 . 0 0 "[ . 1 . 2]" 1
1045 1 40 LEU QD 1 109 TRP HZ2 . . 5.240 4.696 3.918 5.237 . 0 0 "[ . 1 . 2]" 1
1046 1 40 LEU QD 1 109 TRP HZ3 . . 5.310 3.840 3.429 4.162 . 0 0 "[ . 1 . 2]" 1
1047 1 40 LEU HG 1 41 THR H . . 5.500 5.253 4.942 5.545 0.045 15 0 "[ . 1 . 2]" 1
1048 1 40 LEU HG 1 69 LEU MD2 . . 4.530 4.120 2.480 4.641 0.111 17 0 "[ . 1 . 2]" 1
1049 1 41 THR H 1 41 THR MG . . 3.630 2.572 2.197 2.918 . 0 0 "[ . 1 . 2]" 1
1050 1 41 THR H 1 42 ARG H . . 5.500 4.504 4.432 4.614 . 0 0 "[ . 1 . 2]" 1
1051 1 41 THR H 1 43 ALA MB . . 5.500 4.716 3.720 5.228 . 0 0 "[ . 1 . 2]" 1
1052 1 41 THR H 1 44 GLN H . . 5.030 3.263 2.719 3.654 . 0 0 "[ . 1 . 2]" 1
1053 1 41 THR H 1 44 GLN HA . . 5.500 4.907 4.549 5.379 . 0 0 "[ . 1 . 2]" 1
1054 1 41 THR H 1 44 GLN HB2 . . 4.620 2.392 1.978 2.916 . 0 0 "[ . 1 . 2]" 1
1055 1 41 THR H 1 44 GLN HB3 . . 3.950 2.764 2.094 3.566 . 0 0 "[ . 1 . 2]" 1
1056 1 41 THR H 1 44 GLN HG2 . . 5.500 3.927 2.018 4.491 . 0 0 "[ . 1 . 2]" 1
1057 1 41 THR H 1 45 LEU QD . . 5.500 3.913 2.609 4.431 . 0 0 "[ . 1 . 2]" 1
1058 1 41 THR H 1 48 MET ME . . 5.500 4.886 4.386 5.299 . 0 0 "[ . 1 . 2]" 1
1059 1 41 THR H 1 64 ASP HA . . 5.500 5.449 5.190 5.578 0.078 17 0 "[ . 1 . 2]" 1
1060 1 41 THR H 1 67 VAL QG . . 5.500 4.374 3.986 4.875 . 0 0 "[ . 1 . 2]" 1
1061 1 41 THR HA 1 42 ARG H . . 3.280 2.562 2.410 2.826 . 0 0 "[ . 1 . 2]" 1
1062 1 41 THR HA 1 42 ARG HA . . 4.500 4.280 4.123 4.472 . 0 0 "[ . 1 . 2]" 1
1063 1 41 THR HA 1 45 LEU HG . . 4.390 4.284 4.073 4.505 0.115 18 0 "[ . 1 . 2]" 1
1064 1 41 THR HA 1 67 VAL HA . . 5.500 5.309 4.895 5.574 0.074 18 0 "[ . 1 . 2]" 1
1065 1 41 THR HA 1 67 VAL QG . . 3.760 2.143 2.017 2.637 . 0 0 "[ . 1 . 2]" 1
1066 1 41 THR HB 1 43 ALA H . . 3.680 3.447 2.918 3.742 0.062 4 0 "[ . 1 . 2]" 1
1067 1 41 THR HB 1 43 ALA MB . . 4.080 3.947 3.540 4.163 0.083 5 0 "[ . 1 . 2]" 1
1068 1 41 THR HB 1 44 GLN H . . 4.230 4.154 3.876 4.322 0.092 18 0 "[ . 1 . 2]" 1
1069 1 41 THR HB 1 64 ASP HA . . 4.210 2.143 1.860 2.439 . 0 0 "[ . 1 . 2]" 1
1070 1 41 THR HB 1 64 ASP QB . . 5.260 4.126 3.794 4.521 . 0 0 "[ . 1 . 2]" 1
1071 1 41 THR HB 1 65 ALA H . . 3.540 2.772 2.198 3.313 . 0 0 "[ . 1 . 2]" 1
1072 1 41 THR HB 1 65 ALA MB . . 4.160 4.250 4.059 4.286 0.126 5 0 "[ . 1 . 2]" 1
1073 1 41 THR HB 1 109 TRP HE3 . . 5.220 4.635 4.175 4.982 . 0 0 "[ . 1 . 2]" 1
1074 1 41 THR HB 1 109 TRP HZ3 . . 5.500 5.188 4.770 5.550 0.050 16 0 "[ . 1 . 2]" 1
1075 1 41 THR MG 1 42 ARG H . . 4.600 3.862 3.768 3.994 . 0 0 "[ . 1 . 2]" 1
1076 1 41 THR MG 1 43 ALA H . . 5.280 4.703 4.307 5.097 . 0 0 "[ . 1 . 2]" 1
1077 1 41 THR MG 1 43 ALA MB . . 5.500 4.322 3.923 4.689 . 0 0 "[ . 1 . 2]" 1
1078 1 41 THR MG 1 44 GLN H . . 5.190 4.261 3.859 4.589 . 0 0 "[ . 1 . 2]" 1
1079 1 41 THR MG 1 44 GLN HB3 . . 4.920 4.645 3.982 5.012 0.092 18 0 "[ . 1 . 2]" 1
1080 1 41 THR MG 1 44 GLN HE21 . . 5.500 4.053 3.134 4.393 . 0 0 "[ . 1 . 2]" 1
1081 1 41 THR MG 1 44 GLN HE22 . . 5.500 5.369 4.590 5.608 0.108 18 0 "[ . 1 . 2]" 1
1082 1 41 THR MG 1 44 GLN HG2 . . 5.500 4.719 2.587 5.352 . 0 0 "[ . 1 . 2]" 1
1083 1 41 THR MG 1 64 ASP H . . 5.500 4.878 4.493 5.181 . 0 0 "[ . 1 . 2]" 1
1084 1 41 THR MG 1 64 ASP HA . . 3.810 2.571 2.022 3.070 . 0 0 "[ . 1 . 2]" 1
1085 1 41 THR MG 1 64 ASP QB . . 5.500 3.542 2.877 4.023 . 0 0 "[ . 1 . 2]" 1
1086 1 41 THR MG 1 65 ALA H . . 5.380 3.351 2.645 3.861 . 0 0 "[ . 1 . 2]" 1
1087 1 41 THR MG 1 65 ALA MB . . 5.500 4.078 3.890 4.359 . 0 0 "[ . 1 . 2]" 1
1088 1 41 THR MG 1 66 CYS H . . 5.500 3.257 1.929 4.473 . 0 0 "[ . 1 . 2]" 1
1089 1 41 THR MG 1 66 CYS HA . . 4.870 2.506 1.980 3.634 . 0 0 "[ . 1 . 2]" 1
1090 1 41 THR MG 1 67 VAL H . . 5.500 3.552 2.993 4.310 . 0 0 "[ . 1 . 2]" 1
1091 1 41 THR MG 1 67 VAL QG . . 3.670 3.484 3.189 3.738 0.068 7 0 "[ . 1 . 2]" 1
1092 1 42 ARG H 1 42 ARG HB2 . . 4.070 2.657 2.268 3.187 . 0 0 "[ . 1 . 2]" 1
1093 1 42 ARG H 1 42 ARG HD2 . . 5.500 4.662 3.973 5.328 . 0 0 "[ . 1 . 2]" 1
1094 1 42 ARG H 1 42 ARG HD3 . . 5.500 4.236 2.850 5.137 . 0 0 "[ . 1 . 2]" 1
1095 1 42 ARG H 1 42 ARG QG . . 4.170 2.343 1.769 3.608 . 0 0 "[ . 1 . 2]" 1
1096 1 42 ARG H 1 43 ALA H . . 4.290 2.750 2.478 2.935 . 0 0 "[ . 1 . 2]" 1
1097 1 42 ARG H 1 43 ALA MB . . 5.500 4.264 3.814 4.452 . 0 0 "[ . 1 . 2]" 1
1098 1 42 ARG H 1 44 GLN H . . 5.500 4.357 4.081 4.746 . 0 0 "[ . 1 . 2]" 1
1099 1 42 ARG H 1 58 MET ME . . 5.380 5.122 4.388 5.475 0.095 10 0 "[ . 1 . 2]" 1
1100 1 42 ARG H 1 63 ASP HA . . 5.500 4.378 3.386 5.166 . 0 0 "[ . 1 . 2]" 1
1101 1 42 ARG H 1 64 ASP HA . . 5.500 3.925 3.410 4.393 . 0 0 "[ . 1 . 2]" 1
1102 1 42 ARG H 1 65 ALA MB . . 5.500 4.251 3.659 4.900 . 0 0 "[ . 1 . 2]" 1
1103 1 42 ARG H 1 67 VAL H . . 5.500 5.285 4.578 5.572 0.072 11 0 "[ . 1 . 2]" 1
1104 1 42 ARG H 1 67 VAL QG . . 4.100 2.907 2.286 3.678 . 0 0 "[ . 1 . 2]" 1
1105 1 42 ARG HA 1 42 ARG HD2 . . 5.300 4.377 4.095 4.830 . 0 0 "[ . 1 . 2]" 1
1106 1 42 ARG HA 1 42 ARG HD3 . . 4.970 4.672 2.518 5.071 0.101 20 0 "[ . 1 . 2]" 1
1107 1 42 ARG HA 1 42 ARG QG . . 3.740 2.598 2.300 3.440 . 0 0 "[ . 1 . 2]" 1
1108 1 42 ARG HA 1 43 ALA HA . . 5.500 4.892 4.719 5.133 . 0 0 "[ . 1 . 2]" 1
1109 1 42 ARG HA 1 43 ALA MB . . 5.500 4.965 4.769 5.050 . 0 0 "[ . 1 . 2]" 1
1110 1 42 ARG HA 1 44 GLN H . . 5.490 4.646 4.281 4.917 . 0 0 "[ . 1 . 2]" 1
1111 1 42 ARG HA 1 45 LEU H . . 4.530 3.678 3.493 3.820 . 0 0 "[ . 1 . 2]" 1
1112 1 42 ARG HA 1 45 LEU HA . . 5.500 5.574 5.504 5.596 0.096 5 0 "[ . 1 . 2]" 1
1113 1 42 ARG HA 1 45 LEU HB2 . . 3.830 2.725 2.575 2.833 . 0 0 "[ . 1 . 2]" 1
1114 1 42 ARG HA 1 45 LEU HB3 . . 5.500 4.385 4.069 4.531 . 0 0 "[ . 1 . 2]" 1
1115 1 42 ARG HA 1 45 LEU QD . . 4.170 2.843 2.666 3.174 . 0 0 "[ . 1 . 2]" 1
1116 1 42 ARG HA 1 46 ALA H . . 5.500 3.930 3.489 4.252 . 0 0 "[ . 1 . 2]" 1
1117 1 42 ARG HA 1 46 ALA MB . . 5.450 4.393 3.971 4.763 . 0 0 "[ . 1 . 2]" 1
1118 1 42 ARG HA 1 52 THR MG . . 3.390 2.469 2.197 2.795 . 0 0 "[ . 1 . 2]" 1
1119 1 42 ARG HA 1 58 MET HG2 . . 5.500 4.161 3.727 4.609 . 0 0 "[ . 1 . 2]" 1
1120 1 42 ARG HA 1 67 VAL HB . . 5.310 5.192 4.532 5.395 0.085 13 0 "[ . 1 . 2]" 1
1121 1 42 ARG HA 1 67 VAL QG . . 3.760 3.477 2.910 3.773 0.013 18 0 "[ . 1 . 2]" 1
1122 1 42 ARG HB2 1 43 ALA H . . 4.160 2.582 2.273 4.420 0.260 1 0 "[ . 1 . 2]" 1
1123 1 42 ARG HB2 1 43 ALA HA . . 5.500 4.290 3.690 5.733 0.233 1 0 "[ . 1 . 2]" 1
1124 1 42 ARG HB2 1 52 THR HB . . 5.500 4.617 2.621 5.281 . 0 0 "[ . 1 . 2]" 1
1125 1 42 ARG HB2 1 63 ASP HA . . 5.140 3.213 2.253 5.262 0.122 1 0 "[ . 1 . 2]" 1
1126 1 42 ARG HB2 1 100 ALA MB . . 5.500 3.880 3.221 4.688 . 0 0 "[ . 1 . 2]" 1
1127 1 42 ARG HB3 1 43 ALA H . . 4.710 3.565 3.154 3.954 . 0 0 "[ . 1 . 2]" 1
1128 1 42 ARG HB3 1 52 THR HB . . 4.930 3.267 2.327 4.158 . 0 0 "[ . 1 . 2]" 1
1129 1 42 ARG HB3 1 52 THR MG . . 5.500 2.328 2.075 3.855 . 0 0 "[ . 1 . 2]" 1
1130 1 42 ARG HB3 1 58 MET HG3 . . 5.500 4.709 2.954 5.574 0.074 5 0 "[ . 1 . 2]" 1
1131 1 42 ARG HB3 1 100 ALA MB . . 4.040 3.397 2.623 4.827 0.787 1 1 "[+ . 1 . 2]" 1
1132 1 42 ARG HD2 1 52 THR HB . . 5.080 3.162 2.157 4.730 . 0 0 "[ . 1 . 2]" 1
1133 1 42 ARG HD2 1 52 THR MG . . 5.060 3.849 2.979 4.860 . 0 0 "[ . 1 . 2]" 1
1134 1 42 ARG HD2 1 58 MET HA . . 5.500 4.474 3.954 6.035 0.535 12 1 "[ . 1 + . 2]" 1
1135 1 42 ARG HD2 1 58 MET ME . . 5.300 5.164 4.748 6.189 0.889 12 1 "[ . 1 + . 2]" 1
1136 1 42 ARG HD2 1 58 MET HG2 . . 5.080 2.468 2.049 3.780 . 0 0 "[ . 1 . 2]" 1
1137 1 42 ARG HD2 1 58 MET HG3 . . 5.110 3.582 2.888 5.066 . 0 0 "[ . 1 . 2]" 1
1138 1 42 ARG HD2 1 59 ASN HA . . 4.760 3.673 2.785 4.248 . 0 0 "[ . 1 . 2]" 1
1139 1 42 ARG HD2 1 61 LEU H . . 5.500 4.493 3.523 5.606 0.106 3 0 "[ . 1 . 2]" 1
1140 1 42 ARG HD2 1 67 VAL QG . . 5.500 4.262 3.339 5.504 0.004 3 0 "[ . 1 . 2]" 1
1141 1 42 ARG HD3 1 52 THR HB . . 5.500 4.297 2.102 5.178 . 0 0 "[ . 1 . 2]" 1
1142 1 42 ARG HD3 1 52 THR MG . . 5.420 4.661 2.671 5.315 . 0 0 "[ . 1 . 2]" 1
1143 1 42 ARG HD3 1 58 MET HG2 . . 5.120 3.023 2.045 4.542 . 0 0 "[ . 1 . 2]" 1
1144 1 42 ARG HD3 1 58 MET HG3 . . 4.990 3.559 2.580 4.854 . 0 0 "[ . 1 . 2]" 1
1145 1 42 ARG HD3 1 59 ASN HA . . 4.710 4.326 2.787 4.802 0.092 15 0 "[ . 1 . 2]" 1
1146 1 42 ARG HD3 1 61 LEU H . . 5.500 4.031 3.091 5.567 0.067 5 0 "[ . 1 . 2]" 1
1147 1 42 ARG HD3 1 61 LEU QB . . 5.500 2.978 2.044 4.827 . 0 0 "[ . 1 . 2]" 1
1148 1 42 ARG QG 1 52 THR HB . . 5.020 3.157 2.100 4.230 . 0 0 "[ . 1 . 2]" 1
1149 1 42 ARG QG 1 58 MET HG2 . . 4.140 2.481 1.981 3.760 . 0 0 "[ . 1 . 2]" 1
1150 1 42 ARG QG 1 58 MET HG3 . . 4.810 2.723 2.177 4.383 . 0 0 "[ . 1 . 2]" 1
1151 1 42 ARG QG 1 63 ASP HA . . 5.270 3.548 2.248 5.106 . 0 0 "[ . 1 . 2]" 1
1152 1 43 ALA H 1 43 ALA MB . . 3.310 2.172 2.108 2.222 . 0 0 "[ . 1 . 2]" 1
1153 1 43 ALA H 1 44 GLN H . . 3.980 2.854 2.607 3.267 . 0 0 "[ . 1 . 2]" 1
1154 1 43 ALA H 1 45 LEU H . . 5.500 4.317 3.985 4.559 . 0 0 "[ . 1 . 2]" 1
1155 1 43 ALA H 1 45 LEU QD . . 5.500 5.257 4.044 5.379 . 0 0 "[ . 1 . 2]" 1
1156 1 43 ALA H 1 63 ASP HA . . 5.490 4.279 3.565 5.114 . 0 0 "[ . 1 . 2]" 1
1157 1 43 ALA H 1 64 ASP HA . . 5.500 4.205 3.324 5.137 . 0 0 "[ . 1 . 2]" 1
1158 1 43 ALA HA 1 45 LEU H . . 5.500 4.825 4.576 5.029 . 0 0 "[ . 1 . 2]" 1
1159 1 43 ALA HA 1 46 ALA H . . 4.520 3.949 3.474 4.367 . 0 0 "[ . 1 . 2]" 1
1160 1 43 ALA HA 1 46 ALA MB . . 3.450 3.082 2.506 3.528 0.078 11 0 "[ . 1 . 2]" 1
1161 1 43 ALA HA 1 47 SER H . . 5.200 4.763 4.232 5.187 . 0 0 "[ . 1 . 2]" 1
1162 1 43 ALA HA 1 52 THR MG . . 5.500 4.549 3.775 5.277 . 0 0 "[ . 1 . 2]" 1
1163 1 43 ALA HA 1 100 ALA MB . . 5.500 2.799 2.186 3.917 . 0 0 "[ . 1 . 2]" 1
1164 1 43 ALA MB 1 44 GLN H . . 3.970 2.277 1.883 2.630 . 0 0 "[ . 1 . 2]" 1
1165 1 43 ALA MB 1 44 GLN HA . . 5.500 3.725 3.555 3.850 . 0 0 "[ . 1 . 2]" 1
1166 1 43 ALA MB 1 44 GLN HG3 . . 5.500 5.336 4.890 5.644 0.144 6 0 "[ . 1 . 2]" 1
1167 1 43 ALA MB 1 45 LEU H . . 5.500 4.489 4.202 4.715 . 0 0 "[ . 1 . 2]" 1
1168 1 43 ALA MB 1 46 ALA H . . 5.260 4.842 4.544 5.083 . 0 0 "[ . 1 . 2]" 1
1169 1 43 ALA MB 1 47 SER H . . 5.500 5.117 4.716 5.430 . 0 0 "[ . 1 . 2]" 1
1170 1 43 ALA MB 1 47 SER HB2 . . 5.500 4.894 4.318 5.343 . 0 0 "[ . 1 . 2]" 1
1171 1 43 ALA MB 1 63 ASP HA . . 5.330 4.528 3.986 5.372 0.042 5 0 "[ . 1 . 2]" 1
1172 1 43 ALA MB 1 63 ASP QB . . 5.500 3.852 2.723 4.852 . 0 0 "[ . 1 . 2]" 1
1173 1 43 ALA MB 1 64 ASP HA . . 5.500 4.021 3.251 5.007 . 0 0 "[ . 1 . 2]" 1
1174 1 43 ALA MB 1 104 ILE MG . . 4.240 3.085 2.238 3.448 . 0 0 "[ . 1 . 2]" 1
1175 1 44 GLN H 1 44 GLN HB3 . . 3.680 3.199 2.956 3.676 . 0 0 "[ . 1 . 2]" 1
1176 1 44 GLN H 1 44 GLN HG2 . . 4.680 4.269 2.527 4.577 . 0 0 "[ . 1 . 2]" 1
1177 1 44 GLN H 1 44 GLN HG3 . . 5.500 4.395 3.893 4.546 . 0 0 "[ . 1 . 2]" 1
1178 1 44 GLN H 1 45 LEU H . . 3.970 2.746 2.388 2.980 . 0 0 "[ . 1 . 2]" 1
1179 1 44 GLN H 1 45 LEU HG . . 5.500 4.735 4.412 5.576 0.076 18 0 "[ . 1 . 2]" 1
1180 1 44 GLN H 1 46 ALA H . . 4.860 4.293 3.954 4.457 . 0 0 "[ . 1 . 2]" 1
1181 1 44 GLN H 1 48 MET ME . . 5.370 5.127 4.727 5.431 0.061 20 0 "[ . 1 . 2]" 1
1182 1 44 GLN HA 1 44 GLN HE22 . . 5.500 3.871 3.490 4.285 . 0 0 "[ . 1 . 2]" 1
1183 1 44 GLN HA 1 46 ALA H . . 5.500 4.445 4.125 4.662 . 0 0 "[ . 1 . 2]" 1
1184 1 44 GLN HA 1 48 MET H . . 5.500 4.880 4.202 5.392 . 0 0 "[ . 1 . 2]" 1
1185 1 44 GLN HA 1 48 MET ME . . 5.500 3.567 3.211 4.046 . 0 0 "[ . 1 . 2]" 1
1186 1 44 GLN HB2 1 45 LEU H . . 5.050 3.301 2.639 3.678 . 0 0 "[ . 1 . 2]" 1
1187 1 44 GLN HB2 1 45 LEU HA . . 5.500 5.258 4.067 5.585 0.085 20 0 "[ . 1 . 2]" 1
1188 1 44 GLN HB2 1 109 TRP HE3 . . 5.500 3.820 3.157 5.548 0.048 16 0 "[ . 1 . 2]" 1
1189 1 44 GLN HB2 1 109 TRP HH2 . . 5.500 4.483 3.860 4.765 . 0 0 "[ . 1 . 2]" 1
1190 1 44 GLN HB2 1 109 TRP HZ2 . . 5.500 5.411 4.744 5.638 0.138 17 0 "[ . 1 . 2]" 1
1191 1 44 GLN HB3 1 44 GLN HE22 . . 5.500 5.009 4.942 5.159 . 0 0 "[ . 1 . 2]" 1
1192 1 44 GLN HB3 1 45 LEU H . . 4.280 2.919 2.465 3.810 . 0 0 "[ . 1 . 2]" 1
1193 1 44 GLN HB3 1 48 MET ME . . 5.500 2.722 2.156 3.381 . 0 0 "[ . 1 . 2]" 1
1194 1 44 GLN HE21 1 109 TRP HA . . 5.500 5.545 5.274 5.765 0.265 10 0 "[ . 1 . 2]" 1
1195 1 44 GLN HE21 1 109 TRP HH2 . . 5.500 4.799 4.144 5.355 . 0 0 "[ . 1 . 2]" 1
1196 1 44 GLN HG2 1 45 LEU H . . 5.500 5.095 4.263 5.470 . 0 0 "[ . 1 . 2]" 1
1197 1 44 GLN HG2 1 109 TRP HH2 . . 5.500 3.056 2.718 4.178 . 0 0 "[ . 1 . 2]" 1
1198 1 44 GLN HG2 1 109 TRP HZ2 . . 5.500 3.337 2.722 4.728 . 0 0 "[ . 1 . 2]" 1
1199 1 44 GLN HG3 1 109 TRP HH2 . . 5.500 4.409 2.876 4.937 . 0 0 "[ . 1 . 2]" 1
1200 1 44 GLN HG3 1 109 TRP HZ2 . . 5.500 4.387 3.170 4.764 . 0 0 "[ . 1 . 2]" 1
1201 1 45 LEU H 1 45 LEU HB2 . . 3.810 2.423 2.278 2.484 . 0 0 "[ . 1 . 2]" 1
1202 1 45 LEU H 1 45 LEU QD . . 4.120 3.113 2.085 3.310 . 0 0 "[ . 1 . 2]" 1
1203 1 45 LEU H 1 45 LEU HG . . 3.900 2.445 2.231 3.434 . 0 0 "[ . 1 . 2]" 1
1204 1 45 LEU H 1 46 ALA H . . 3.800 2.830 2.700 2.966 . 0 0 "[ . 1 . 2]" 1
1205 1 45 LEU H 1 46 ALA HA . . 5.500 5.445 5.345 5.541 0.041 7 0 "[ . 1 . 2]" 1
1206 1 45 LEU H 1 46 ALA MB . . 4.830 4.426 4.217 4.584 . 0 0 "[ . 1 . 2]" 1
1207 1 45 LEU H 1 47 SER H . . 5.150 4.059 3.930 4.257 . 0 0 "[ . 1 . 2]" 1
1208 1 45 LEU H 1 48 MET ME . . 4.720 4.165 3.701 4.470 . 0 0 "[ . 1 . 2]" 1
1209 1 45 LEU H 1 50 LEU QD . . 5.400 4.649 4.371 5.312 . 0 0 "[ . 1 . 2]" 1
1210 1 45 LEU H 1 52 THR MG . . 5.500 4.580 3.992 4.759 . 0 0 "[ . 1 . 2]" 1
1211 1 45 LEU H 1 67 VAL QG . . 5.500 5.021 4.383 5.396 . 0 0 "[ . 1 . 2]" 1
1212 1 45 LEU HA 1 45 LEU QD . . 3.260 2.144 2.025 3.085 . 0 0 "[ . 1 . 2]" 1
1213 1 45 LEU HA 1 45 LEU HG . . 4.150 2.969 2.777 3.127 . 0 0 "[ . 1 . 2]" 1
1214 1 45 LEU HA 1 46 ALA HA . . 5.500 4.810 4.743 4.886 . 0 0 "[ . 1 . 2]" 1
1215 1 45 LEU HA 1 48 MET H . . 4.440 3.440 3.119 3.577 . 0 0 "[ . 1 . 2]" 1
1216 1 45 LEU HA 1 48 MET HB2 . . 5.020 3.488 2.680 3.902 . 0 0 "[ . 1 . 2]" 1
1217 1 45 LEU HA 1 48 MET ME . . 3.330 3.308 2.880 3.426 0.096 9 0 "[ . 1 . 2]" 1
1218 1 45 LEU HA 1 48 MET HG2 . . 4.600 4.599 2.496 4.759 0.159 8 0 "[ . 1 . 2]" 1
1219 1 45 LEU HA 1 48 MET HG3 . . 5.300 4.318 3.121 4.948 . 0 0 "[ . 1 . 2]" 1
1220 1 45 LEU HA 1 49 GLY H . . 5.500 4.715 4.152 5.204 . 0 0 "[ . 1 . 2]" 1
1221 1 45 LEU HA 1 50 LEU H . . 5.230 4.430 4.095 4.771 . 0 0 "[ . 1 . 2]" 1
1222 1 45 LEU HA 1 50 LEU HB2 . . 5.500 4.293 3.769 4.606 . 0 0 "[ . 1 . 2]" 1
1223 1 45 LEU HA 1 50 LEU HB3 . . 5.500 3.817 3.537 4.110 . 0 0 "[ . 1 . 2]" 1
1224 1 45 LEU HA 1 50 LEU QD . . 5.010 4.227 3.847 4.677 . 0 0 "[ . 1 . 2]" 1
1225 1 45 LEU HA 1 52 THR MG . . 5.500 5.273 4.750 5.542 0.042 20 0 "[ . 1 . 2]" 1
1226 1 45 LEU HA 1 69 LEU MD2 . . 5.500 5.000 4.565 5.535 0.035 10 0 "[ . 1 . 2]" 1
1227 1 45 LEU HB2 1 45 LEU QD . . 3.270 2.273 2.149 2.377 . 0 0 "[ . 1 . 2]" 1
1228 1 45 LEU HB2 1 46 ALA H . . 4.210 2.693 2.528 2.926 . 0 0 "[ . 1 . 2]" 1
1229 1 45 LEU HB2 1 46 ALA HA . . 5.500 4.554 4.369 4.791 . 0 0 "[ . 1 . 2]" 1
1230 1 45 LEU HB2 1 46 ALA MB . . 5.500 4.054 3.882 4.245 . 0 0 "[ . 1 . 2]" 1
1231 1 45 LEU HB2 1 50 LEU HB2 . . 5.140 4.657 4.191 5.037 . 0 0 "[ . 1 . 2]" 1
1232 1 45 LEU HB2 1 50 LEU HB3 . . 5.050 3.375 3.061 3.690 . 0 0 "[ . 1 . 2]" 1
1233 1 45 LEU HB2 1 50 LEU QD . . 3.360 2.595 2.286 3.461 0.101 11 0 "[ . 1 . 2]" 1
1234 1 45 LEU HB2 1 52 THR H . . 5.500 5.610 5.434 5.677 0.177 18 0 "[ . 1 . 2]" 1
1235 1 45 LEU HB2 1 52 THR MG . . 4.020 3.010 2.552 3.280 . 0 0 "[ . 1 . 2]" 1
1236 1 45 LEU HB2 1 100 ALA MB . . 5.310 5.396 5.129 5.459 0.149 4 0 "[ . 1 . 2]" 1
1237 1 45 LEU HB3 1 46 ALA H . . 5.060 3.591 3.350 3.799 . 0 0 "[ . 1 . 2]" 1
1238 1 45 LEU HB3 1 46 ALA HA . . 5.500 4.432 4.278 4.752 . 0 0 "[ . 1 . 2]" 1
1239 1 45 LEU HB3 1 50 LEU H . . 5.500 4.017 3.749 4.367 . 0 0 "[ . 1 . 2]" 1
1240 1 45 LEU HB3 1 50 LEU HB3 . . 4.670 2.223 2.036 2.473 . 0 0 "[ . 1 . 2]" 1
1241 1 45 LEU HB3 1 50 LEU QD . . 3.890 2.194 1.910 2.990 . 0 0 "[ . 1 . 2]" 1
1242 1 45 LEU HB3 1 69 LEU MD2 . . 5.500 4.991 4.485 5.485 . 0 0 "[ . 1 . 2]" 1
1243 1 45 LEU QD 1 46 ALA H . . 5.050 4.158 3.806 4.321 . 0 0 "[ . 1 . 2]" 1
1244 1 45 LEU QD 1 47 SER H . . 5.500 5.219 5.064 5.278 . 0 0 "[ . 1 . 2]" 1
1245 1 45 LEU QD 1 48 MET H . . 5.500 4.785 4.512 5.204 . 0 0 "[ . 1 . 2]" 1
1246 1 45 LEU QD 1 48 MET HB2 . . 5.500 4.107 3.820 4.888 . 0 0 "[ . 1 . 2]" 1
1247 1 45 LEU QD 1 48 MET ME . . 3.580 3.421 3.012 3.658 0.078 9 0 "[ . 1 . 2]" 1
1248 1 45 LEU QD 1 48 MET HG3 . . 5.500 4.968 3.854 5.448 . 0 0 "[ . 1 . 2]" 1
1249 1 45 LEU QD 1 67 VAL H . . 5.060 4.025 3.439 4.283 . 0 0 "[ . 1 . 2]" 1
1250 1 45 LEU QD 1 67 VAL HA . . 5.500 4.912 4.520 5.181 . 0 0 "[ . 1 . 2]" 1
1251 1 45 LEU QD 1 67 VAL HB . . 3.740 2.900 2.251 3.836 0.096 20 0 "[ . 1 . 2]" 1
1252 1 45 LEU QD 1 67 VAL QG . . 3.630 2.460 1.746 3.033 . 0 0 "[ . 1 . 2]" 1
1253 1 45 LEU QD 1 68 PRO HD2 . . 5.500 5.243 5.004 5.442 . 0 0 "[ . 1 . 2]" 1
1254 1 45 LEU QD 1 69 LEU H . . 5.500 4.798 4.484 5.071 . 0 0 "[ . 1 . 2]" 1
1255 1 45 LEU QD 1 69 LEU HA . . 5.500 3.701 3.272 4.075 . 0 0 "[ . 1 . 2]" 1
1256 1 45 LEU QD 1 73 VAL QG . . 4.530 3.670 3.436 3.919 . 0 0 "[ . 1 . 2]" 1
1257 1 45 LEU HG 1 46 ALA H . . 5.500 4.612 4.471 5.130 . 0 0 "[ . 1 . 2]" 1
1258 1 46 ALA H 1 46 ALA MB . . 3.070 2.182 2.090 2.246 . 0 0 "[ . 1 . 2]" 1
1259 1 46 ALA H 1 47 SER H . . 3.790 2.689 2.528 2.822 . 0 0 "[ . 1 . 2]" 1
1260 1 46 ALA H 1 47 SER HA . . 5.500 5.305 5.191 5.401 . 0 0 "[ . 1 . 2]" 1
1261 1 46 ALA H 1 47 SER HB2 . . 5.500 4.733 4.521 5.226 . 0 0 "[ . 1 . 2]" 1
1262 1 46 ALA H 1 47 SER HB3 . . 5.500 5.276 4.711 5.564 0.064 9 0 "[ . 1 . 2]" 1
1263 1 46 ALA H 1 48 MET H . . 5.350 4.274 4.053 4.624 . 0 0 "[ . 1 . 2]" 1
1264 1 46 ALA H 1 48 MET ME . . 5.500 5.381 5.076 5.567 0.067 3 0 "[ . 1 . 2]" 1
1265 1 46 ALA H 1 50 LEU H . . 5.500 4.411 4.151 4.984 . 0 0 "[ . 1 . 2]" 1
1266 1 46 ALA H 1 50 LEU HB3 . . 5.500 3.891 3.594 4.097 . 0 0 "[ . 1 . 2]" 1
1267 1 46 ALA H 1 50 LEU QD . . 5.500 3.954 3.452 4.532 . 0 0 "[ . 1 . 2]" 1
1268 1 46 ALA H 1 52 THR MG . . 4.290 3.342 3.027 3.658 . 0 0 "[ . 1 . 2]" 1
1269 1 46 ALA HA 1 48 MET H . . 5.280 4.049 3.420 4.561 . 0 0 "[ . 1 . 2]" 1
1270 1 46 ALA HA 1 48 MET HB2 . . 5.500 5.215 5.001 5.540 0.040 10 0 "[ . 1 . 2]" 1
1271 1 46 ALA HA 1 49 GLY H . . 4.770 2.880 2.608 3.057 . 0 0 "[ . 1 . 2]" 1
1272 1 46 ALA HA 1 50 LEU H . . 3.850 2.429 2.063 2.881 . 0 0 "[ . 1 . 2]" 1
1273 1 46 ALA HA 1 50 LEU HA . . 4.690 4.629 4.407 4.781 0.091 16 0 "[ . 1 . 2]" 1
1274 1 46 ALA HA 1 50 LEU HB2 . . 4.350 4.450 4.243 4.729 0.379 14 0 "[ . 1 . 2]" 1
1275 1 46 ALA HA 1 50 LEU HB3 . . 4.960 3.130 2.946 3.467 . 0 0 "[ . 1 . 2]" 1
1276 1 46 ALA HA 1 50 LEU QD . . 5.500 3.955 3.457 4.489 . 0 0 "[ . 1 . 2]" 1
1277 1 46 ALA HA 1 52 THR H . . 5.500 4.655 4.252 4.884 . 0 0 "[ . 1 . 2]" 1
1278 1 46 ALA HA 1 52 THR MG . . 4.170 3.665 3.262 4.052 . 0 0 "[ . 1 . 2]" 1
1279 1 46 ALA MB 1 47 SER H . . 3.550 2.899 2.618 3.164 . 0 0 "[ . 1 . 2]" 1
1280 1 46 ALA MB 1 47 SER HA . . 4.970 4.035 3.871 4.202 . 0 0 "[ . 1 . 2]" 1
1281 1 46 ALA MB 1 47 SER HB2 . . 5.370 4.263 3.906 4.594 . 0 0 "[ . 1 . 2]" 1
1282 1 46 ALA MB 1 47 SER HB3 . . 5.500 5.170 4.703 5.463 . 0 0 "[ . 1 . 2]" 1
1283 1 46 ALA MB 1 48 MET H . . 5.320 4.586 4.190 4.921 . 0 0 "[ . 1 . 2]" 1
1284 1 46 ALA MB 1 49 GLY H . . 5.440 4.144 3.952 4.368 . 0 0 "[ . 1 . 2]" 1
1285 1 46 ALA MB 1 50 LEU H . . 4.750 4.094 3.735 4.504 . 0 0 "[ . 1 . 2]" 1
1286 1 46 ALA MB 1 50 LEU QD . . 5.500 3.892 3.520 4.421 . 0 0 "[ . 1 . 2]" 1
1287 1 46 ALA MB 1 51 ASN HA . . 5.500 4.701 4.225 5.117 . 0 0 "[ . 1 . 2]" 1
1288 1 46 ALA MB 1 52 THR H . . 5.500 3.796 3.393 4.033 . 0 0 "[ . 1 . 2]" 1
1289 1 46 ALA MB 1 52 THR MG . . 3.620 2.421 2.120 2.702 . 0 0 "[ . 1 . 2]" 1
1290 1 46 ALA MB 1 100 ALA H . . 5.500 3.182 2.480 3.835 . 0 0 "[ . 1 . 2]" 1
1291 1 46 ALA MB 1 100 ALA MB . . 3.970 1.982 1.900 2.042 . 0 0 "[ . 1 . 2]" 1
1292 1 47 SER H 1 47 SER HB2 . . 3.630 2.303 2.111 2.667 . 0 0 "[ . 1 . 2]" 1
1293 1 47 SER H 1 47 SER HB3 . . 3.500 2.773 2.333 2.983 . 0 0 "[ . 1 . 2]" 1
1294 1 47 SER H 1 48 MET H . . 3.860 2.624 2.416 2.755 . 0 0 "[ . 1 . 2]" 1
1295 1 47 SER H 1 48 MET ME . . 5.500 4.307 3.848 4.792 . 0 0 "[ . 1 . 2]" 1
1296 1 47 SER H 1 48 MET HG3 . . 5.500 4.831 3.708 6.105 0.605 10 1 "[ . + . 2]" 1
1297 1 47 SER H 1 49 GLY H . . 5.040 3.736 3.409 4.056 . 0 0 "[ . 1 . 2]" 1
1298 1 47 SER H 1 50 LEU H . . 5.190 4.762 4.541 5.065 . 0 0 "[ . 1 . 2]" 1
1299 1 47 SER H 1 52 THR MG . . 5.500 5.422 5.167 5.616 0.116 15 0 "[ . 1 . 2]" 1
1300 1 47 SER HA 1 49 GLY H . . 5.010 4.000 3.595 4.817 . 0 0 "[ . 1 . 2]" 1
1301 1 47 SER HB2 1 48 MET H . . 4.770 3.866 3.583 4.214 . 0 0 "[ . 1 . 2]" 1
1302 1 47 SER HB3 1 48 MET H . . 4.980 2.948 2.505 3.582 . 0 0 "[ . 1 . 2]" 1
1303 1 47 SER HB3 1 48 MET HG3 . . 5.500 3.543 2.926 5.261 . 0 0 "[ . 1 . 2]" 1
1304 1 48 MET H 1 48 MET HB2 . . 3.930 2.647 2.527 2.796 . 0 0 "[ . 1 . 2]" 1
1305 1 48 MET H 1 48 MET ME . . 4.280 3.529 2.803 4.018 . 0 0 "[ . 1 . 2]" 1
1306 1 48 MET H 1 48 MET HG2 . . 4.070 3.752 2.335 4.153 0.083 8 0 "[ . 1 . 2]" 1
1307 1 48 MET H 1 48 MET HG3 . . 4.240 2.740 1.854 3.826 . 0 0 "[ . 1 . 2]" 1
1308 1 48 MET H 1 49 GLY H . . 3.660 2.410 1.912 2.652 . 0 0 "[ . 1 . 2]" 1
1309 1 48 MET H 1 49 GLY HA2 . . 5.500 4.729 4.283 5.020 . 0 0 "[ . 1 . 2]" 1
1310 1 48 MET H 1 50 LEU H . . 4.820 3.790 3.240 4.232 . 0 0 "[ . 1 . 2]" 1
1311 1 48 MET HA 1 48 MET ME . . 4.720 4.501 4.030 4.787 0.067 1 0 "[ . 1 . 2]" 1
1312 1 48 MET HA 1 48 MET HG2 . . 4.080 3.352 2.534 3.761 . 0 0 "[ . 1 . 2]" 1
1313 1 48 MET HA 1 48 MET HG3 . . 4.230 2.798 2.500 3.843 . 0 0 "[ . 1 . 2]" 1
1314 1 48 MET HA 1 49 GLY HA2 . . 5.500 4.914 4.742 5.033 . 0 0 "[ . 1 . 2]" 1
1315 1 48 MET HA 1 50 LEU H . . 5.500 5.102 4.856 5.451 . 0 0 "[ . 1 . 2]" 1
1316 1 48 MET HB2 1 49 GLY H . . 5.500 3.227 2.351 3.557 . 0 0 "[ . 1 . 2]" 1
1317 1 48 MET HB2 1 49 GLY HA3 . . 5.500 4.874 4.540 5.083 . 0 0 "[ . 1 . 2]" 1
1318 1 48 MET HB2 1 50 LEU H . . 5.500 3.625 3.219 3.957 . 0 0 "[ . 1 . 2]" 1
1319 1 48 MET HB2 1 96 MET ME . . 4.750 4.511 3.651 4.842 0.092 5 0 "[ . 1 . 2]" 1
1320 1 48 MET HB3 1 48 MET HG2 . . 2.720 2.291 2.177 3.001 0.281 10 0 "[ . 1 . 2]" 1
1321 1 48 MET HB3 1 49 GLY H . . 5.480 4.197 3.581 4.429 . 0 0 "[ . 1 . 2]" 1
1322 1 48 MET HB3 1 91 ILE MD . . 5.400 4.376 3.801 5.039 . 0 0 "[ . 1 . 2]" 1
1323 1 48 MET ME 1 48 MET HG2 . . 3.500 2.635 2.183 2.836 . 0 0 "[ . 1 . 2]" 1
1324 1 48 MET ME 1 48 MET HG3 . . 3.680 2.317 2.078 2.490 . 0 0 "[ . 1 . 2]" 1
1325 1 48 MET ME 1 49 GLY H . . 5.500 5.481 5.033 5.605 0.105 18 0 "[ . 1 . 2]" 1
1326 1 48 MET ME 1 109 TRP HH2 . . 5.140 4.700 4.364 4.927 . 0 0 "[ . 1 . 2]" 1
1327 1 48 MET ME 1 109 TRP HZ2 . . 5.500 5.161 4.570 5.544 0.044 11 0 "[ . 1 . 2]" 1
1328 1 48 MET ME 1 109 TRP HZ3 . . 5.500 5.579 5.465 5.604 0.104 1 0 "[ . 1 . 2]" 1
1329 1 48 MET HG2 1 49 GLY H . . 5.500 5.353 4.376 5.619 0.119 8 0 "[ . 1 . 2]" 1
1330 1 48 MET HG3 1 49 GLY H . . 5.500 4.668 3.938 5.512 0.012 10 0 "[ . 1 . 2]" 1
1331 1 49 GLY H 1 50 LEU HA . . 5.500 4.886 4.480 5.159 . 0 0 "[ . 1 . 2]" 1
1332 1 49 GLY H 1 50 LEU HB2 . . 5.500 4.471 3.804 4.898 . 0 0 "[ . 1 . 2]" 1
1333 1 49 GLY H 1 50 LEU HB3 . . 5.500 4.161 3.998 4.338 . 0 0 "[ . 1 . 2]" 1
1334 1 49 GLY H 1 50 LEU QD . . 5.500 5.170 5.007 5.265 . 0 0 "[ . 1 . 2]" 1
1335 1 49 GLY HA2 1 96 MET ME . . 4.910 4.062 3.568 4.453 . 0 0 "[ . 1 . 2]" 1
1336 1 49 GLY HA2 1 97 SER H . . 5.500 4.049 3.612 4.574 . 0 0 "[ . 1 . 2]" 1
1337 1 49 GLY HA3 1 96 MET ME . . 4.440 2.703 2.098 3.146 . 0 0 "[ . 1 . 2]" 1
1338 1 49 GLY HA3 1 97 SER H . . 5.500 4.323 3.958 4.798 . 0 0 "[ . 1 . 2]" 1
1339 1 50 LEU H 1 50 LEU HB2 . . 3.580 2.582 2.252 2.784 . 0 0 "[ . 1 . 2]" 1
1340 1 50 LEU H 1 50 LEU HB3 . . 3.650 2.269 2.127 2.510 . 0 0 "[ . 1 . 2]" 1
1341 1 50 LEU H 1 50 LEU QD . . 4.480 3.678 3.534 3.789 . 0 0 "[ . 1 . 2]" 1
1342 1 50 LEU H 1 51 ASN H . . 5.090 4.553 4.499 4.677 . 0 0 "[ . 1 . 2]" 1
1343 1 50 LEU H 1 96 MET HA . . 5.500 4.622 4.441 4.997 . 0 0 "[ . 1 . 2]" 1
1344 1 50 LEU HA 1 50 LEU QD . . 3.510 2.399 2.057 2.618 . 0 0 "[ . 1 . 2]" 1
1345 1 50 LEU HA 1 51 ASN H . . 3.330 2.168 2.074 2.444 . 0 0 "[ . 1 . 2]" 1
1346 1 50 LEU HA 1 51 ASN HA . . 4.840 4.436 4.357 4.599 . 0 0 "[ . 1 . 2]" 1
1347 1 50 LEU HA 1 51 ASN QB . . 4.690 4.032 3.845 4.254 . 0 0 "[ . 1 . 2]" 1
1348 1 50 LEU HA 1 96 MET H . . 5.500 4.967 4.753 5.186 . 0 0 "[ . 1 . 2]" 1
1349 1 50 LEU HA 1 96 MET HA . . 3.800 2.232 2.070 2.533 . 0 0 "[ . 1 . 2]" 1
1350 1 50 LEU HA 1 96 MET HB3 . . 5.460 4.332 3.539 5.332 . 0 0 "[ . 1 . 2]" 1
1351 1 50 LEU HA 1 96 MET ME . . 5.200 3.709 2.740 4.918 . 0 0 "[ . 1 . 2]" 1
1352 1 50 LEU HA 1 96 MET HG2 . . 5.170 3.154 2.111 5.304 0.134 18 0 "[ . 1 . 2]" 1
1353 1 50 LEU HA 1 97 SER H . . 4.890 3.219 3.010 3.840 . 0 0 "[ . 1 . 2]" 1
1354 1 50 LEU HB2 1 51 ASN H . . 5.500 4.081 3.834 4.275 . 0 0 "[ . 1 . 2]" 1
1355 1 50 LEU HB3 1 51 ASN H . . 5.310 4.108 3.789 4.237 . 0 0 "[ . 1 . 2]" 1
1356 1 50 LEU HB3 1 96 MET HA . . 5.500 5.132 4.938 5.459 . 0 0 "[ . 1 . 2]" 1
1357 1 50 LEU QD 1 51 ASN H . . 3.730 2.213 1.823 2.880 . 0 0 "[ . 1 . 2]" 1
1358 1 50 LEU QD 1 51 ASN HA . . 4.840 3.611 3.425 4.308 . 0 0 "[ . 1 . 2]" 1
1359 1 50 LEU QD 1 51 ASN QB . . 5.500 3.293 3.023 3.933 . 0 0 "[ . 1 . 2]" 1
1360 1 50 LEU QD 1 52 THR HA . . 4.070 2.439 2.191 3.222 . 0 0 "[ . 1 . 2]" 1
1361 1 50 LEU QD 1 52 THR HB . . 5.500 3.663 3.487 4.584 . 0 0 "[ . 1 . 2]" 1
1362 1 50 LEU QD 1 52 THR MG . . 3.670 2.045 1.902 2.362 . 0 0 "[ . 1 . 2]" 1
1363 1 50 LEU QD 1 55 VAL H . . 5.500 3.879 3.463 4.440 . 0 0 "[ . 1 . 2]" 1
1364 1 50 LEU QD 1 55 VAL HB . . 5.500 4.018 3.254 5.003 . 0 0 "[ . 1 . 2]" 1
1365 1 50 LEU QD 1 55 VAL QG . . 3.410 2.082 1.893 2.688 . 0 0 "[ . 1 . 2]" 1
1366 1 50 LEU QD 1 73 VAL QG . . 4.030 2.615 2.067 3.058 . 0 0 "[ . 1 . 2]" 1
1367 1 50 LEU QD 1 91 ILE MG . . 3.580 2.037 1.857 2.307 . 0 0 "[ . 1 . 2]" 1
1368 1 50 LEU QD 1 95 PHE QB . . 3.730 2.293 2.084 2.457 . 0 0 "[ . 1 . 2]" 1
1369 1 50 LEU QD 1 96 MET HA . . 4.760 3.441 3.008 3.950 . 0 0 "[ . 1 . 2]" 1
1370 1 50 LEU QD 1 97 SER H . . 5.500 4.377 4.153 4.777 . 0 0 "[ . 1 . 2]" 1
1371 1 50 LEU HG 1 51 ASN H . . 4.430 4.102 2.131 4.487 0.057 5 0 "[ . 1 . 2]" 1
1372 1 50 LEU HG 1 73 VAL QG . . 5.500 3.978 3.169 4.689 . 0 0 "[ . 1 . 2]" 1
1373 1 50 LEU HG 1 91 ILE MG . . 5.160 3.681 3.354 4.277 . 0 0 "[ . 1 . 2]" 1
1374 1 50 LEU HG 1 95 PHE QB . . 5.500 4.541 3.457 4.870 . 0 0 "[ . 1 . 2]" 1
1375 1 50 LEU HG 1 96 MET HA . . 5.500 5.439 4.393 5.604 0.104 18 0 "[ . 1 . 2]" 1
1376 1 51 ASN H 1 52 THR MG . . 5.500 4.769 4.610 4.902 . 0 0 "[ . 1 . 2]" 1
1377 1 51 ASN H 1 95 PHE H . . 5.500 5.298 4.987 5.568 0.068 11 0 "[ . 1 . 2]" 1
1378 1 51 ASN H 1 96 MET H . . 5.500 4.017 3.673 4.591 . 0 0 "[ . 1 . 2]" 1
1379 1 51 ASN H 1 96 MET HA . . 3.990 2.272 1.877 2.910 . 0 0 "[ . 1 . 2]" 1
1380 1 51 ASN H 1 97 SER H . . 5.080 3.018 2.713 3.664 . 0 0 "[ . 1 . 2]" 1
1381 1 51 ASN H 1 97 SER QB . . 5.500 4.204 3.797 5.256 . 0 0 "[ . 1 . 2]" 1
1382 1 51 ASN HA 1 52 THR HA . . 5.500 4.591 4.530 4.704 . 0 0 "[ . 1 . 2]" 1
1383 1 51 ASN HA 1 52 THR MG . . 4.860 3.782 3.642 4.157 . 0 0 "[ . 1 . 2]" 1
1384 1 51 ASN HA 1 53 ALA MB . . 5.500 4.555 4.378 4.687 . 0 0 "[ . 1 . 2]" 1
1385 1 51 ASN HA 1 96 MET HA . . 5.500 4.375 4.107 4.722 . 0 0 "[ . 1 . 2]" 1
1386 1 51 ASN HA 1 97 SER HA . . 5.500 4.905 4.502 5.575 0.075 15 0 "[ . 1 . 2]" 1
1387 1 51 ASN HA 1 97 SER QB . . 5.380 2.573 2.064 3.695 . 0 0 "[ . 1 . 2]" 1
1388 1 51 ASN QB 1 53 ALA H . . 5.500 3.992 3.757 4.238 . 0 0 "[ . 1 . 2]" 1
1389 1 51 ASN QB 1 54 SER H . . 5.500 3.242 2.849 3.944 . 0 0 "[ . 1 . 2]" 1
1390 1 51 ASN QB 1 54 SER HB2 . . 5.500 2.464 1.931 4.140 . 0 0 "[ . 1 . 2]" 1
1391 1 51 ASN QB 1 54 SER HB3 . . 5.500 2.807 2.207 4.064 . 0 0 "[ . 1 . 2]" 1
1392 1 51 ASN QB 1 95 PHE HA . . 5.380 2.588 2.167 3.223 . 0 0 "[ . 1 . 2]" 1
1393 1 51 ASN QB 1 96 MET H . . 3.660 3.122 2.686 3.422 . 0 0 "[ . 1 . 2]" 1
1394 1 51 ASN QB 1 96 MET HA . . 5.500 3.022 2.809 3.294 . 0 0 "[ . 1 . 2]" 1
1395 1 51 ASN QB 1 97 SER H . . 4.690 2.815 2.308 3.153 . 0 0 "[ . 1 . 2]" 1
1396 1 51 ASN QB 1 97 SER HA . . 5.500 3.951 3.695 4.217 . 0 0 "[ . 1 . 2]" 1
1397 1 51 ASN QB 1 97 SER QB . . 4.910 2.267 1.931 2.779 . 0 0 "[ . 1 . 2]" 1
1398 1 51 ASN HD21 1 53 ALA MB . . 4.940 4.451 2.723 5.296 0.356 10 0 "[ . 1 . 2]" 1
1399 1 51 ASN HD21 1 54 SER HA . . 5.500 5.277 4.287 5.863 0.363 9 0 "[ . 1 . 2]" 1
1400 1 51 ASN HD21 1 54 SER HB2 . . 5.380 3.600 2.584 5.085 . 0 0 "[ . 1 . 2]" 1
1401 1 51 ASN HD21 1 54 SER HB3 . . 5.500 4.512 3.509 5.339 . 0 0 "[ . 1 . 2]" 1
1402 1 51 ASN HD21 1 97 SER HA . . 5.500 4.985 4.352 5.558 0.058 2 0 "[ . 1 . 2]" 1
1403 1 51 ASN HD22 1 53 ALA MB . . 5.500 3.532 2.419 4.266 . 0 0 "[ . 1 . 2]" 1
1404 1 51 ASN HD22 1 54 SER HB2 . . 5.320 3.911 2.612 5.555 0.235 6 0 "[ . 1 . 2]" 1
1405 1 51 ASN HD22 1 54 SER HB3 . . 5.500 5.028 3.825 5.570 0.070 20 0 "[ . 1 . 2]" 1
1406 1 51 ASN HD22 1 97 SER HA . . 5.500 5.581 5.551 5.593 0.093 17 0 "[ . 1 . 2]" 1
1407 1 52 THR H 1 52 THR MG . . 4.110 1.882 1.722 2.331 . 0 0 "[ . 1 . 2]" 1
1408 1 52 THR H 1 53 ALA H . . 5.260 2.864 2.755 2.971 . 0 0 "[ . 1 . 2]" 1
1409 1 52 THR H 1 53 ALA MB . . 5.500 4.509 4.400 4.720 . 0 0 "[ . 1 . 2]" 1
1410 1 52 THR HA 1 53 ALA HA . . 5.500 4.614 4.470 4.730 . 0 0 "[ . 1 . 2]" 1
1411 1 52 THR HA 1 53 ALA MB . . 5.500 4.943 4.775 5.089 . 0 0 "[ . 1 . 2]" 1
1412 1 52 THR HA 1 54 SER H . . 4.830 3.729 3.431 4.064 . 0 0 "[ . 1 . 2]" 1
1413 1 52 THR HA 1 55 VAL H . . 4.740 3.479 3.134 3.682 . 0 0 "[ . 1 . 2]" 1
1414 1 52 THR HA 1 55 VAL HB . . 5.480 4.703 2.853 5.574 0.094 16 0 "[ . 1 . 2]" 1
1415 1 52 THR HA 1 55 VAL QG . . 4.460 2.711 2.377 3.387 . 0 0 "[ . 1 . 2]" 1
1416 1 52 THR HA 1 58 MET H . . 5.500 5.508 5.138 5.593 0.093 12 0 "[ . 1 . 2]" 1
1417 1 52 THR HA 1 58 MET HB2 . . 5.500 4.173 3.865 4.399 . 0 0 "[ . 1 . 2]" 1
1418 1 52 THR HA 1 58 MET HB3 . . 4.890 3.140 2.749 3.376 . 0 0 "[ . 1 . 2]" 1
1419 1 52 THR HA 1 58 MET ME . . 4.220 3.606 3.047 3.931 . 0 0 "[ . 1 . 2]" 1
1420 1 52 THR HA 1 58 MET HG2 . . 4.980 3.697 3.238 4.364 . 0 0 "[ . 1 . 2]" 1
1421 1 52 THR HA 1 58 MET HG3 . . 5.500 4.719 4.376 5.463 . 0 0 "[ . 1 . 2]" 1
1422 1 52 THR HA 1 59 ASN QD . . 5.500 5.133 4.267 5.401 . 0 0 "[ . 1 . 2]" 1
1423 1 52 THR HB 1 53 ALA H . . 5.500 4.219 3.872 4.526 . 0 0 "[ . 1 . 2]" 1
1424 1 52 THR HB 1 58 MET HB3 . . 5.500 3.375 2.987 3.803 . 0 0 "[ . 1 . 2]" 1
1425 1 52 THR HB 1 58 MET ME . . 4.150 4.241 4.192 4.268 0.118 15 0 "[ . 1 . 2]" 1
1426 1 52 THR HB 1 58 MET HG2 . . 4.490 2.403 2.078 2.862 . 0 0 "[ . 1 . 2]" 1
1427 1 52 THR HB 1 58 MET HG3 . . 4.410 3.932 3.571 4.441 0.031 11 0 "[ . 1 . 2]" 1
1428 1 52 THR MG 1 53 ALA H . . 5.130 4.017 3.878 4.248 . 0 0 "[ . 1 . 2]" 1
1429 1 52 THR MG 1 53 ALA HA . . 5.500 5.577 5.468 5.614 0.114 4 0 "[ . 1 . 2]" 1
1430 1 52 THR MG 1 53 ALA MB . . 5.200 4.905 4.713 5.173 . 0 0 "[ . 1 . 2]" 1
1431 1 52 THR MG 1 54 SER H . . 5.230 5.219 5.102 5.323 0.093 14 0 "[ . 1 . 2]" 1
1432 1 52 THR MG 1 55 VAL H . . 5.500 5.471 5.213 5.606 0.106 20 0 "[ . 1 . 2]" 1
1433 1 52 THR MG 1 58 MET HB2 . . 5.500 5.070 4.435 5.469 . 0 0 "[ . 1 . 2]" 1
1434 1 52 THR MG 1 58 MET HG2 . . 5.320 3.528 2.842 3.784 . 0 0 "[ . 1 . 2]" 1
1435 1 52 THR MG 1 58 MET HG3 . . 5.210 4.353 3.886 4.684 . 0 0 "[ . 1 . 2]" 1
1436 1 53 ALA H 1 53 ALA MB . . 3.100 2.298 2.194 2.420 . 0 0 "[ . 1 . 2]" 1
1437 1 53 ALA H 1 54 SER H . . 3.760 2.482 2.222 3.024 . 0 0 "[ . 1 . 2]" 1
1438 1 53 ALA H 1 54 SER HA . . 5.020 5.005 4.810 5.103 0.083 7 0 "[ . 1 . 2]" 1
1439 1 53 ALA H 1 54 SER HB2 . . 5.500 4.569 3.804 5.977 0.477 9 0 "[ . 1 . 2]" 1
1440 1 53 ALA H 1 55 VAL H . . 5.070 4.208 3.916 4.591 . 0 0 "[ . 1 . 2]" 1
1441 1 53 ALA HA 1 54 SER HB2 . . 5.500 5.578 5.066 6.458 0.958 6 2 "[ .+ -1 . 2]" 1
1442 1 53 ALA HA 1 55 VAL H . . 4.490 4.186 3.849 4.535 0.045 8 0 "[ . 1 . 2]" 1
1443 1 53 ALA HA 1 58 MET HB3 . . 5.500 4.783 4.237 5.308 . 0 0 "[ . 1 . 2]" 1
1444 1 53 ALA HA 1 59 ASN QB . . 4.880 3.100 1.990 4.403 . 0 0 "[ . 1 . 2]" 1
1445 1 53 ALA HA 1 59 ASN QD . . 5.500 2.538 1.819 3.376 . 0 0 "[ . 1 . 2]" 1
1446 1 53 ALA HA 1 101 ARG HG3 . . 5.500 4.919 3.919 5.578 0.078 1 0 "[ . 1 . 2]" 1
1447 1 53 ALA MB 1 54 SER H . . 3.950 3.443 3.120 3.710 . 0 0 "[ . 1 . 2]" 1
1448 1 53 ALA MB 1 54 SER HA . . 4.920 4.310 4.003 4.435 . 0 0 "[ . 1 . 2]" 1
1449 1 53 ALA MB 1 54 SER HB2 . . 5.500 4.759 4.215 5.831 0.331 9 0 "[ . 1 . 2]" 1
1450 1 53 ALA MB 1 55 VAL H . . 5.080 4.957 4.677 5.151 0.071 11 0 "[ . 1 . 2]" 1
1451 1 53 ALA MB 1 59 ASN HA . . 4.800 4.848 4.414 4.913 0.113 12 0 "[ . 1 . 2]" 1
1452 1 53 ALA MB 1 59 ASN QB . . 5.500 3.715 2.832 4.724 . 0 0 "[ . 1 . 2]" 1
1453 1 53 ALA MB 1 59 ASN QD . . 5.500 3.853 3.214 4.572 . 0 0 "[ . 1 . 2]" 1
1454 1 53 ALA MB 1 99 ARG QB . . 4.660 4.427 3.834 4.624 . 0 0 "[ . 1 . 2]" 1
1455 1 53 ALA MB 1 101 ARG HB2 . . 4.400 4.145 3.207 4.511 0.111 12 0 "[ . 1 . 2]" 1
1456 1 53 ALA MB 1 101 ARG HG2 . . 4.140 3.696 2.960 4.284 0.144 11 0 "[ . 1 . 2]" 1
1457 1 53 ALA MB 1 101 ARG HG3 . . 3.670 3.363 2.655 4.234 0.564 20 2 "[ . -1 . +]" 1
1458 1 54 SER H 1 54 SER HB2 . . 4.020 2.698 2.268 3.679 . 0 0 "[ . 1 . 2]" 1
1459 1 54 SER H 1 54 SER HB3 . . 4.040 3.003 2.546 3.694 . 0 0 "[ . 1 . 2]" 1
1460 1 54 SER H 1 55 VAL H . . 3.460 2.238 1.836 2.714 . 0 0 "[ . 1 . 2]" 1
1461 1 54 SER H 1 55 VAL HA . . 5.500 4.875 4.488 5.233 . 0 0 "[ . 1 . 2]" 1
1462 1 54 SER H 1 55 VAL QG . . 4.700 3.391 3.078 3.769 . 0 0 "[ . 1 . 2]" 1
1463 1 54 SER HA 1 55 VAL QG . . 5.300 4.529 4.221 4.747 . 0 0 "[ . 1 . 2]" 1
1464 1 54 SER HA 1 56 ALA H . . 5.500 5.310 4.730 5.579 0.079 13 0 "[ . 1 . 2]" 1
1465 1 54 SER HB2 1 55 VAL H . . 5.140 3.781 2.803 4.196 . 0 0 "[ . 1 . 2]" 1
1466 1 54 SER HB2 1 55 VAL QG . . 5.500 4.008 2.966 4.605 . 0 0 "[ . 1 . 2]" 1
1467 1 54 SER HB2 1 95 PHE HA . . 5.410 3.037 2.482 3.454 . 0 0 "[ . 1 . 2]" 1
1468 1 54 SER HB3 1 55 VAL QG . . 5.500 3.233 2.483 4.902 . 0 0 "[ . 1 . 2]" 1
1469 1 54 SER HB3 1 94 ALA MB . . 5.500 5.422 4.713 6.162 0.662 6 1 "[ .+ 1 . 2]" 1
1470 1 54 SER HB3 1 95 PHE HA . . 4.870 2.577 2.104 4.117 . 0 0 "[ . 1 . 2]" 1
1471 1 54 SER HB3 1 95 PHE QD . . 5.500 2.326 1.961 3.783 . 0 0 "[ . 1 . 2]" 1
1472 1 55 VAL H 1 55 VAL HB . . 3.550 3.268 2.311 3.646 0.096 17 0 "[ . 1 . 2]" 1
1473 1 55 VAL H 1 55 VAL QG . . 3.510 2.057 1.860 2.230 . 0 0 "[ . 1 . 2]" 1
1474 1 55 VAL H 1 56 ALA H . . 5.310 4.316 4.082 4.471 . 0 0 "[ . 1 . 2]" 1
1475 1 55 VAL H 1 56 ALA HA . . 5.500 5.255 4.783 5.580 0.080 7 0 "[ . 1 . 2]" 1
1476 1 55 VAL H 1 56 ALA MB . . 5.500 5.521 5.286 5.619 0.119 13 0 "[ . 1 . 2]" 1
1477 1 55 VAL H 1 58 MET H . . 5.500 4.993 4.301 5.436 . 0 0 "[ . 1 . 2]" 1
1478 1 55 VAL H 1 58 MET HB2 . . 5.060 4.907 4.249 5.160 0.100 1 0 "[ . 1 . 2]" 1
1479 1 55 VAL H 1 58 MET ME . . 5.080 4.889 4.595 5.162 0.082 1 0 "[ . 1 . 2]" 1
1480 1 55 VAL H 1 59 ASN QD . . 5.500 4.092 3.538 4.466 . 0 0 "[ . 1 . 2]" 1
1481 1 55 VAL HA 1 55 VAL QG . . 3.330 2.291 2.116 2.523 . 0 0 "[ . 1 . 2]" 1
1482 1 55 VAL HA 1 56 ALA H . . 3.290 2.148 2.077 2.271 . 0 0 "[ . 1 . 2]" 1
1483 1 55 VAL HA 1 56 ALA MB . . 4.760 3.978 3.882 4.130 . 0 0 "[ . 1 . 2]" 1
1484 1 55 VAL HA 1 73 VAL QG . . 5.500 4.352 3.978 5.164 . 0 0 "[ . 1 . 2]" 1
1485 1 55 VAL HA 1 95 PHE HZ . . 5.500 5.073 4.512 5.588 0.088 20 0 "[ . 1 . 2]" 1
1486 1 55 VAL HB 1 56 ALA H . . 5.500 3.861 3.325 4.486 . 0 0 "[ . 1 . 2]" 1
1487 1 55 VAL HB 1 56 ALA HA . . 5.500 5.397 5.114 5.587 0.087 8 0 "[ . 1 . 2]" 1
1488 1 55 VAL HB 1 56 ALA MB . . 5.500 4.970 4.149 5.599 0.099 14 0 "[ . 1 . 2]" 1
1489 1 55 VAL HB 1 58 MET HB2 . . 4.780 3.711 2.366 4.542 . 0 0 "[ . 1 . 2]" 1
1490 1 55 VAL HB 1 58 MET ME . . 4.530 3.614 2.503 4.286 . 0 0 "[ . 1 . 2]" 1
1491 1 55 VAL HB 1 72 MET HB2 . . 5.500 5.412 4.727 5.709 0.209 12 0 "[ . 1 . 2]" 1
1492 1 55 VAL HB 1 73 VAL QG . . 5.500 3.669 2.625 4.541 . 0 0 "[ . 1 . 2]" 1
1493 1 55 VAL QG 1 56 ALA H . . 4.320 3.461 2.765 3.834 . 0 0 "[ . 1 . 2]" 1
1494 1 55 VAL QG 1 56 ALA HA . . 5.500 4.527 4.168 4.993 . 0 0 "[ . 1 . 2]" 1
1495 1 55 VAL QG 1 56 ALA MB . . 4.860 4.164 3.634 4.628 . 0 0 "[ . 1 . 2]" 1
1496 1 55 VAL QG 1 57 GLY QA . . 5.500 4.442 3.765 5.060 . 0 0 "[ . 1 . 2]" 1
1497 1 55 VAL QG 1 58 MET H . . 4.390 2.727 1.830 3.197 . 0 0 "[ . 1 . 2]" 1
1498 1 55 VAL QG 1 58 MET HA . . 5.080 4.114 3.707 4.511 . 0 0 "[ . 1 . 2]" 1
1499 1 55 VAL QG 1 58 MET HB2 . . 4.320 2.225 1.951 2.675 . 0 0 "[ . 1 . 2]" 1
1500 1 55 VAL QG 1 58 MET ME . . 3.820 2.050 1.856 2.366 . 0 0 "[ . 1 . 2]" 1
1501 1 55 VAL QG 1 58 MET HG2 . . 4.820 4.115 3.678 4.574 . 0 0 "[ . 1 . 2]" 1
1502 1 55 VAL QG 1 58 MET HG3 . . 4.850 4.030 3.685 4.481 . 0 0 "[ . 1 . 2]" 1
1503 1 55 VAL QG 1 67 VAL QG . . 4.230 3.614 3.283 4.098 . 0 0 "[ . 1 . 2]" 1
1504 1 55 VAL QG 1 72 MET H . . 5.500 4.862 4.133 5.250 . 0 0 "[ . 1 . 2]" 1
1505 1 55 VAL QG 1 72 MET HA . . 5.120 4.400 3.723 5.006 . 0 0 "[ . 1 . 2]" 1
1506 1 55 VAL QG 1 72 MET ME . . 3.800 3.671 3.195 3.856 0.056 8 0 "[ . 1 . 2]" 1
1507 1 55 VAL QG 1 72 MET HG2 . . 4.060 2.493 1.990 3.754 . 0 0 "[ . 1 . 2]" 1
1508 1 55 VAL QG 1 72 MET HG3 . . 4.630 2.582 1.991 3.759 . 0 0 "[ . 1 . 2]" 1
1509 1 55 VAL QG 1 73 VAL H . . 5.200 3.709 3.034 4.206 . 0 0 "[ . 1 . 2]" 1
1510 1 55 VAL QG 1 73 VAL HA . . 4.560 2.807 2.235 3.383 . 0 0 "[ . 1 . 2]" 1
1511 1 55 VAL QG 1 73 VAL QG . . 3.380 2.161 1.766 2.447 . 0 0 "[ . 1 . 2]" 1
1512 1 55 VAL QG 1 74 GLN H . . 5.500 4.087 3.574 4.586 . 0 0 "[ . 1 . 2]" 1
1513 1 55 VAL QG 1 95 PHE H . . 5.500 5.170 4.918 5.470 . 0 0 "[ . 1 . 2]" 1
1514 1 55 VAL QG 1 95 PHE HA . . 5.080 3.895 3.600 4.393 . 0 0 "[ . 1 . 2]" 1
1515 1 55 VAL QG 1 95 PHE QB . . 4.450 2.178 2.025 2.623 . 0 0 "[ . 1 . 2]" 1
1516 1 55 VAL QG 1 95 PHE QD . . 4.260 2.349 2.093 2.867 . 0 0 "[ . 1 . 2]" 1
1517 1 55 VAL QG 1 95 PHE QE . . 5.110 3.282 2.732 3.901 . 0 0 "[ . 1 . 2]" 1
1518 1 55 VAL QG 1 95 PHE HZ . . 5.500 4.398 3.848 4.901 . 0 0 "[ . 1 . 2]" 1
1519 1 56 ALA H 1 56 ALA MB . . 3.390 2.275 2.131 2.644 . 0 0 "[ . 1 . 2]" 1
1520 1 56 ALA HA 1 57 GLY QA . . 5.060 4.088 3.901 4.557 . 0 0 "[ . 1 . 2]" 1
1521 1 56 ALA HA 1 58 MET H . . 4.650 4.152 3.482 4.729 0.079 17 0 "[ . 1 . 2]" 1
1522 1 56 ALA MB 1 57 GLY H . . 5.500 2.708 1.801 3.743 . 0 0 "[ . 1 . 2]" 1
1523 1 56 ALA MB 1 57 GLY QA . . 5.500 3.686 3.286 4.093 . 0 0 "[ . 1 . 2]" 1
1524 1 56 ALA MB 1 58 MET H . . 5.500 4.438 3.474 5.326 . 0 0 "[ . 1 . 2]" 1
1525 1 56 ALA MB 1 60 LEU QD . . 5.470 4.270 3.183 4.843 . 0 0 "[ . 1 . 2]" 1
1526 1 56 ALA MB 1 72 MET ME . . 5.500 4.919 2.582 5.635 0.135 14 0 "[ . 1 . 2]" 1
1527 1 57 GLY H 1 58 MET H . . 5.490 3.160 2.217 3.736 . 0 0 "[ . 1 . 2]" 1
1528 1 57 GLY H 1 60 LEU QD . . 5.500 3.418 2.699 4.297 . 0 0 "[ . 1 . 2]" 1
1529 1 57 GLY H 1 72 MET ME . . 5.500 4.488 2.776 5.414 . 0 0 "[ . 1 . 2]" 1
1530 1 57 GLY QA 1 58 MET HB2 . . 5.500 4.657 4.317 4.997 . 0 0 "[ . 1 . 2]" 1
1531 1 57 GLY QA 1 58 MET HB3 . . 5.500 4.991 4.717 5.175 . 0 0 "[ . 1 . 2]" 1
1532 1 57 GLY QA 1 59 ASN QD . . 5.500 4.015 2.751 4.786 . 0 0 "[ . 1 . 2]" 1
1533 1 57 GLY QA 1 60 LEU H . . 5.360 3.639 3.257 4.220 . 0 0 "[ . 1 . 2]" 1
1534 1 57 GLY QA 1 60 LEU HB3 . . 5.500 4.636 4.299 5.302 . 0 0 "[ . 1 . 2]" 1
1535 1 57 GLY QA 1 60 LEU QD . . 3.900 2.208 1.879 2.439 . 0 0 "[ . 1 . 2]" 1
1536 1 57 GLY QA 1 60 LEU HG . . 4.810 2.666 2.020 3.734 . 0 0 "[ . 1 . 2]" 1
1537 1 57 GLY QA 1 61 LEU QD . . 4.230 3.527 3.122 3.947 . 0 0 "[ . 1 . 2]" 1
1538 1 57 GLY QA 1 61 LEU HG . . 5.500 4.770 4.307 5.088 . 0 0 "[ . 1 . 2]" 1
1539 1 57 GLY QA 1 72 MET ME . . 4.540 2.813 2.129 3.742 . 0 0 "[ . 1 . 2]" 1
1540 1 58 MET H 1 58 MET HB2 . . 3.600 2.373 2.185 2.605 . 0 0 "[ . 1 . 2]" 1
1541 1 58 MET H 1 58 MET HB3 . . 3.420 2.574 2.421 2.846 . 0 0 "[ . 1 . 2]" 1
1542 1 58 MET H 1 58 MET ME . . 4.290 4.135 3.760 4.381 0.091 8 0 "[ . 1 . 2]" 1
1543 1 58 MET H 1 58 MET HG2 . . 5.000 4.435 4.292 4.517 . 0 0 "[ . 1 . 2]" 1
1544 1 58 MET H 1 58 MET HG3 . . 5.070 4.320 4.074 4.504 . 0 0 "[ . 1 . 2]" 1
1545 1 58 MET H 1 59 ASN H . . 4.110 2.745 2.547 2.940 . 0 0 "[ . 1 . 2]" 1
1546 1 58 MET H 1 59 ASN QB . . 5.500 4.911 4.590 5.261 . 0 0 "[ . 1 . 2]" 1
1547 1 58 MET H 1 59 ASN QD . . 5.500 3.614 3.311 3.918 . 0 0 "[ . 1 . 2]" 1
1548 1 58 MET H 1 60 LEU H . . 5.050 4.276 4.055 4.621 . 0 0 "[ . 1 . 2]" 1
1549 1 58 MET H 1 60 LEU QD . . 5.500 4.788 3.992 5.056 . 0 0 "[ . 1 . 2]" 1
1550 1 58 MET H 1 61 LEU QD . . 5.500 4.058 3.444 4.655 . 0 0 "[ . 1 . 2]" 1
1551 1 58 MET H 1 67 VAL QG . . 5.500 4.602 3.945 5.166 . 0 0 "[ . 1 . 2]" 1
1552 1 58 MET H 1 72 MET ME . . 3.800 3.195 2.681 3.886 0.086 2 0 "[ . 1 . 2]" 1
1553 1 58 MET H 1 72 MET HG3 . . 5.500 4.032 3.190 5.506 0.006 14 0 "[ . 1 . 2]" 1
1554 1 58 MET HA 1 58 MET ME . . 3.880 3.756 3.531 3.933 0.053 19 0 "[ . 1 . 2]" 1
1555 1 58 MET HA 1 58 MET HG2 . . 4.020 3.021 2.731 3.243 . 0 0 "[ . 1 . 2]" 1
1556 1 58 MET HA 1 58 MET HG3 . . 4.090 2.362 2.127 2.618 . 0 0 "[ . 1 . 2]" 1
1557 1 58 MET HA 1 59 ASN HA . . 5.500 4.790 4.630 4.900 . 0 0 "[ . 1 . 2]" 1
1558 1 58 MET HA 1 60 LEU H . . 4.760 3.514 3.333 3.777 . 0 0 "[ . 1 . 2]" 1
1559 1 58 MET HA 1 61 LEU H . . 4.750 3.482 3.259 3.809 . 0 0 "[ . 1 . 2]" 1
1560 1 58 MET HA 1 61 LEU HA . . 5.470 5.348 4.908 5.562 0.092 12 0 "[ . 1 . 2]" 1
1561 1 58 MET HA 1 61 LEU QB . . 5.470 3.004 2.404 3.856 . 0 0 "[ . 1 . 2]" 1
1562 1 58 MET HA 1 61 LEU QD . . 3.380 2.426 1.887 3.118 . 0 0 "[ . 1 . 2]" 1
1563 1 58 MET HA 1 61 LEU HG . . 4.040 2.970 2.002 4.108 0.068 17 0 "[ . 1 . 2]" 1
1564 1 58 MET HA 1 67 VAL QG . . 5.500 3.169 2.710 3.903 . 0 0 "[ . 1 . 2]" 1
1565 1 58 MET HA 1 72 MET ME . . 3.130 2.783 2.434 3.188 0.058 11 0 "[ . 1 . 2]" 1
1566 1 58 MET HB2 1 58 MET ME . . 3.850 2.122 2.022 2.251 . 0 0 "[ . 1 . 2]" 1
1567 1 58 MET HB2 1 59 ASN H . . 5.180 3.948 3.724 4.228 . 0 0 "[ . 1 . 2]" 1
1568 1 58 MET HB2 1 61 LEU QD . . 5.500 4.033 3.166 4.698 . 0 0 "[ . 1 . 2]" 1
1569 1 58 MET HB3 1 58 MET ME . . 4.440 3.206 2.843 3.458 . 0 0 "[ . 1 . 2]" 1
1570 1 58 MET HB3 1 59 ASN H . . 5.500 2.822 2.339 3.441 . 0 0 "[ . 1 . 2]" 1
1571 1 58 MET HB3 1 59 ASN QB . . 5.500 4.552 3.853 5.250 . 0 0 "[ . 1 . 2]" 1
1572 1 58 MET HB3 1 67 VAL QG . . 4.750 4.178 3.767 4.476 . 0 0 "[ . 1 . 2]" 1
1573 1 58 MET ME 1 58 MET HG2 . . 3.500 3.414 3.328 3.508 0.008 1 0 "[ . 1 . 2]" 1
1574 1 58 MET ME 1 58 MET HG3 . . 3.590 2.531 2.285 2.724 . 0 0 "[ . 1 . 2]" 1
1575 1 58 MET ME 1 67 VAL H . . 5.310 4.982 4.705 5.350 0.040 14 0 "[ . 1 . 2]" 1
1576 1 58 MET ME 1 67 VAL HA . . 5.500 4.534 4.352 4.820 . 0 0 "[ . 1 . 2]" 1
1577 1 58 MET ME 1 67 VAL HB . . 2.620 2.493 2.119 2.748 0.128 7 0 "[ . 1 . 2]" 1
1578 1 58 MET ME 1 67 VAL QG . . 3.040 1.857 1.635 1.956 . 0 0 "[ . 1 . 2]" 1
1579 1 58 MET ME 1 68 PRO HD2 . . 4.720 4.251 4.125 4.400 . 0 0 "[ . 1 . 2]" 1
1580 1 58 MET ME 1 68 PRO HD3 . . 5.500 5.551 5.279 5.608 0.108 15 0 "[ . 1 . 2]" 1
1581 1 58 MET ME 1 69 LEU HA . . 4.560 4.385 3.993 4.637 0.077 4 0 "[ . 1 . 2]" 1
1582 1 58 MET ME 1 72 MET HG2 . . 4.210 2.901 2.005 4.082 . 0 0 "[ . 1 . 2]" 1
1583 1 58 MET ME 1 72 MET HG3 . . 4.530 3.786 2.852 4.590 0.060 17 0 "[ . 1 . 2]" 1
1584 1 58 MET ME 1 73 VAL H . . 4.880 4.801 4.404 4.975 0.095 14 0 "[ . 1 . 2]" 1
1585 1 58 MET ME 1 73 VAL QG . . 3.550 3.228 2.684 3.611 0.061 7 0 "[ . 1 . 2]" 1
1586 1 58 MET HG2 1 59 ASN HA . . 5.500 4.045 3.500 4.513 . 0 0 "[ . 1 . 2]" 1
1587 1 58 MET HG2 1 67 VAL QG . . 5.270 3.420 3.030 3.912 . 0 0 "[ . 1 . 2]" 1
1588 1 58 MET HG2 1 72 MET ME . . 5.130 5.087 4.590 5.235 0.105 13 0 "[ . 1 . 2]" 1
1589 1 58 MET HG3 1 60 LEU H . . 5.500 5.378 5.038 5.568 0.068 16 0 "[ . 1 . 2]" 1
1590 1 58 MET HG3 1 61 LEU QB . . 5.500 3.577 2.975 4.815 . 0 0 "[ . 1 . 2]" 1
1591 1 58 MET HG3 1 61 LEU QD . . 5.500 3.286 2.173 4.249 . 0 0 "[ . 1 . 2]" 1
1592 1 58 MET HG3 1 67 VAL QG . . 5.300 2.175 1.921 2.565 . 0 0 "[ . 1 . 2]" 1
1593 1 58 MET HG3 1 72 MET ME . . 4.080 3.980 3.308 4.195 0.115 12 0 "[ . 1 . 2]" 1
1594 1 59 ASN H 1 59 ASN QD . . 5.500 2.158 1.931 2.442 . 0 0 "[ . 1 . 2]" 1
1595 1 59 ASN H 1 60 LEU H . . 4.640 2.886 2.373 3.304 . 0 0 "[ . 1 . 2]" 1
1596 1 59 ASN H 1 60 LEU QD . . 5.500 4.059 3.306 4.579 . 0 0 "[ . 1 . 2]" 1
1597 1 59 ASN H 1 60 LEU HG . . 5.500 3.757 3.304 4.220 . 0 0 "[ . 1 . 2]" 1
1598 1 59 ASN H 1 61 LEU H . . 5.500 4.355 4.133 4.593 . 0 0 "[ . 1 . 2]" 1
1599 1 59 ASN HA 1 60 LEU HG . . 5.500 4.997 4.647 5.277 . 0 0 "[ . 1 . 2]" 1
1600 1 59 ASN HA 1 61 LEU H . . 4.390 4.003 3.686 4.449 0.059 15 0 "[ . 1 . 2]" 1
1601 1 59 ASN HA 1 61 LEU QD . . 5.500 5.362 5.077 5.441 . 0 0 "[ . 1 . 2]" 1
1602 1 59 ASN QB 1 60 LEU H . . 4.800 3.686 2.867 4.160 . 0 0 "[ . 1 . 2]" 1
1603 1 59 ASN QB 1 60 LEU QD . . 5.080 3.213 2.068 4.378 . 0 0 "[ . 1 . 2]" 1
1604 1 59 ASN QB 1 60 LEU HG . . 5.500 3.934 2.725 4.850 . 0 0 "[ . 1 . 2]" 1
1605 1 59 ASN QD 1 60 LEU QD . . 4.590 3.672 2.327 4.199 . 0 0 "[ . 1 . 2]" 1
1606 1 60 LEU H 1 60 LEU QD . . 4.130 3.067 1.755 3.435 . 0 0 "[ . 1 . 2]" 1
1607 1 60 LEU H 1 60 LEU HG . . 3.540 2.475 2.032 2.877 . 0 0 "[ . 1 . 2]" 1
1608 1 60 LEU H 1 61 LEU H . . 3.520 2.017 1.620 2.376 . 0 0 "[ . 1 . 2]" 1
1609 1 60 LEU H 1 61 LEU QB . . 5.500 3.760 3.248 4.433 . 0 0 "[ . 1 . 2]" 1
1610 1 60 LEU H 1 61 LEU QD . . 5.250 3.328 2.817 4.022 . 0 0 "[ . 1 . 2]" 1
1611 1 60 LEU H 1 61 LEU HG . . 5.500 4.140 3.647 4.728 . 0 0 "[ . 1 . 2]" 1
1612 1 60 LEU H 1 72 MET ME . . 5.080 4.955 4.467 5.176 0.096 20 0 "[ . 1 . 2]" 1
1613 1 60 LEU HA 1 60 LEU QD . . 2.980 2.485 2.164 3.053 0.073 20 0 "[ . 1 . 2]" 1
1614 1 60 LEU HA 1 60 LEU HG . . 3.880 3.442 3.212 3.679 . 0 0 "[ . 1 . 2]" 1
1615 1 60 LEU HB2 1 61 LEU H . . 5.500 3.427 2.686 4.405 . 0 0 "[ . 1 . 2]" 1
1616 1 60 LEU HB3 1 61 LEU H . . 5.190 4.357 3.818 4.643 . 0 0 "[ . 1 . 2]" 1
1617 1 60 LEU QD 1 61 LEU H . . 5.290 4.159 2.505 4.468 . 0 0 "[ . 1 . 2]" 1
1618 1 60 LEU QD 1 72 MET ME . . 5.500 4.673 3.675 5.208 . 0 0 "[ . 1 . 2]" 1
1619 1 61 LEU H 1 61 LEU QB . . 3.790 2.208 2.026 2.666 . 0 0 "[ . 1 . 2]" 1
1620 1 61 LEU H 1 61 LEU QD . . 3.960 2.802 2.239 3.413 . 0 0 "[ . 1 . 2]" 1
1621 1 61 LEU H 1 61 LEU HG . . 3.870 3.077 2.094 3.877 0.007 18 0 "[ . 1 . 2]" 1
1622 1 61 LEU H 1 62 ALA H . . 4.960 4.550 4.107 4.697 . 0 0 "[ . 1 . 2]" 1
1623 1 61 LEU H 1 65 ALA MB . . 5.500 5.156 4.770 5.540 0.040 16 0 "[ . 1 . 2]" 1
1624 1 61 LEU H 1 72 MET ME . . 5.070 5.063 4.650 5.167 0.097 8 0 "[ . 1 . 2]" 1
1625 1 61 LEU HA 1 61 LEU QD . . 3.200 2.359 2.101 3.187 . 0 0 "[ . 1 . 2]" 1
1626 1 61 LEU HA 1 62 ALA H . . 3.120 2.530 2.344 3.091 . 0 0 "[ . 1 . 2]" 1
1627 1 61 LEU HA 1 62 ALA HA . . 4.640 4.460 4.253 4.713 0.073 7 0 "[ . 1 . 2]" 1
1628 1 61 LEU HA 1 62 ALA MB . . 4.270 4.181 3.883 4.352 0.082 17 0 "[ . 1 . 2]" 1
1629 1 61 LEU HA 1 65 ALA MB . . 4.920 3.903 3.506 4.370 . 0 0 "[ . 1 . 2]" 1
1630 1 61 LEU QB 1 62 ALA H . . 4.340 2.376 1.807 2.740 . 0 0 "[ . 1 . 2]" 1
1631 1 61 LEU QB 1 62 ALA HA . . 5.500 4.349 4.056 4.928 . 0 0 "[ . 1 . 2]" 1
1632 1 61 LEU QB 1 62 ALA MB . . 4.200 3.847 3.402 4.115 . 0 0 "[ . 1 . 2]" 1
1633 1 61 LEU QB 1 65 ALA MB . . 4.240 2.326 1.963 3.129 . 0 0 "[ . 1 . 2]" 1
1634 1 61 LEU QD 1 62 ALA H . . 4.000 3.027 2.436 3.523 . 0 0 "[ . 1 . 2]" 1
1635 1 61 LEU QD 1 62 ALA MB . . 5.500 4.067 3.486 4.526 . 0 0 "[ . 1 . 2]" 1
1636 1 61 LEU QD 1 65 ALA H . . 5.500 4.543 3.577 4.986 . 0 0 "[ . 1 . 2]" 1
1637 1 61 LEU QD 1 65 ALA MB . . 4.130 2.237 1.957 2.802 . 0 0 "[ . 1 . 2]" 1
1638 1 61 LEU QD 1 66 CYS H . . 5.500 4.779 4.093 5.477 . 0 0 "[ . 1 . 2]" 1
1639 1 61 LEU QD 1 67 VAL HA . . 3.990 3.269 2.575 3.880 . 0 0 "[ . 1 . 2]" 1
1640 1 61 LEU QD 1 67 VAL QG . . 3.270 2.082 1.843 2.579 . 0 0 "[ . 1 . 2]" 1
1641 1 61 LEU QD 1 68 PRO HD2 . . 5.500 3.796 2.934 4.515 . 0 0 "[ . 1 . 2]" 1
1642 1 61 LEU QD 1 68 PRO HD3 . . 5.430 4.171 3.438 4.728 . 0 0 "[ . 1 . 2]" 1
1643 1 61 LEU QD 1 72 MET ME . . 3.770 2.191 1.890 2.731 . 0 0 "[ . 1 . 2]" 1
1644 1 61 LEU HG 1 62 ALA H . . 5.500 4.602 4.123 5.224 . 0 0 "[ . 1 . 2]" 1
1645 1 61 LEU HG 1 65 ALA MB . . 4.590 4.279 3.741 4.682 0.092 5 0 "[ . 1 . 2]" 1
1646 1 62 ALA H 1 62 ALA MB . . 3.160 2.248 2.093 2.533 . 0 0 "[ . 1 . 2]" 1
1647 1 62 ALA H 1 64 ASP H . . 5.440 5.314 4.620 5.515 0.075 5 0 "[ . 1 . 2]" 1
1648 1 62 ALA H 1 65 ALA H . . 5.310 4.550 3.326 5.078 . 0 0 "[ . 1 . 2]" 1
1649 1 62 ALA H 1 65 ALA HA . . 5.120 4.810 4.341 5.200 0.080 5 0 "[ . 1 . 2]" 1
1650 1 62 ALA H 1 65 ALA MB . . 3.760 2.336 1.873 2.590 . 0 0 "[ . 1 . 2]" 1
1651 1 62 ALA HA 1 63 ASP H . . 3.370 2.381 2.171 2.525 . 0 0 "[ . 1 . 2]" 1
1652 1 62 ALA HA 1 63 ASP QB . . 4.950 4.427 3.975 4.734 . 0 0 "[ . 1 . 2]" 1
1653 1 62 ALA HA 1 64 ASP H . . 5.040 4.420 4.145 4.863 . 0 0 "[ . 1 . 2]" 1
1654 1 62 ALA HA 1 65 ALA H . . 5.500 5.301 4.787 5.593 0.093 6 0 "[ . 1 . 2]" 1
1655 1 62 ALA HA 1 65 ALA MB . . 5.070 4.045 3.861 4.180 . 0 0 "[ . 1 . 2]" 1
1656 1 62 ALA MB 1 63 ASP H . . 3.760 2.411 2.170 2.940 . 0 0 "[ . 1 . 2]" 1
1657 1 62 ALA MB 1 63 ASP HA . . 5.210 4.392 4.321 4.661 . 0 0 "[ . 1 . 2]" 1
1658 1 62 ALA MB 1 63 ASP QB . . 5.370 3.893 3.492 4.525 . 0 0 "[ . 1 . 2]" 1
1659 1 62 ALA MB 1 64 ASP H . . 3.720 2.815 2.487 3.363 . 0 0 "[ . 1 . 2]" 1
1660 1 62 ALA MB 1 64 ASP HA . . 5.500 4.765 4.297 5.263 . 0 0 "[ . 1 . 2]" 1
1661 1 62 ALA MB 1 64 ASP QB . . 5.500 4.198 3.408 4.710 . 0 0 "[ . 1 . 2]" 1
1662 1 62 ALA MB 1 65 ALA H . . 3.930 3.426 3.018 4.001 0.071 5 0 "[ . 1 . 2]" 1
1663 1 62 ALA MB 1 65 ALA HA . . 5.030 3.451 2.856 3.819 . 0 0 "[ . 1 . 2]" 1
1664 1 62 ALA MB 1 65 ALA MB . . 3.210 2.100 2.013 2.224 . 0 0 "[ . 1 . 2]" 1
1665 1 62 ALA MB 1 66 CYS H . . 5.500 5.433 5.144 5.599 0.099 5 0 "[ . 1 . 2]" 1
1666 1 63 ASP H 1 63 ASP QB . . 3.690 2.328 2.055 2.886 . 0 0 "[ . 1 . 2]" 1
1667 1 63 ASP H 1 64 ASP H . . 4.110 2.680 2.285 2.929 . 0 0 "[ . 1 . 2]" 1
1668 1 63 ASP H 1 64 ASP HA . . 5.310 5.284 5.059 5.396 0.086 12 0 "[ . 1 . 2]" 1
1669 1 63 ASP H 1 65 ALA H . . 5.500 4.652 4.091 5.109 . 0 0 "[ . 1 . 2]" 1
1670 1 63 ASP H 1 65 ALA MB . . 5.500 4.522 4.169 4.806 . 0 0 "[ . 1 . 2]" 1
1671 1 63 ASP HA 1 64 ASP HA . . 5.500 4.582 4.448 4.784 . 0 0 "[ . 1 . 2]" 1
1672 1 63 ASP HA 1 64 ASP QB . . 5.500 4.939 4.693 5.264 . 0 0 "[ . 1 . 2]" 1
1673 1 63 ASP HA 1 65 ALA H . . 4.740 4.285 3.669 4.817 0.077 19 0 "[ . 1 . 2]" 1
1674 1 63 ASP HA 1 104 ILE HG13 . . 5.500 5.231 4.520 6.144 0.644 1 1 "[+ . 1 . 2]" 1
1675 1 63 ASP QB 1 64 ASP H . . 3.990 2.616 2.272 3.197 . 0 0 "[ . 1 . 2]" 1
1676 1 63 ASP QB 1 64 ASP HA . . 5.500 4.251 4.030 4.532 . 0 0 "[ . 1 . 2]" 1
1677 1 63 ASP QB 1 65 ALA H . . 5.500 4.868 4.474 5.236 . 0 0 "[ . 1 . 2]" 1
1678 1 64 ASP H 1 65 ALA H . . 3.400 3.108 2.720 3.449 0.049 19 0 "[ . 1 . 2]" 1
1679 1 64 ASP H 1 65 ALA HA . . 5.500 4.674 4.114 5.017 . 0 0 "[ . 1 . 2]" 1
1680 1 64 ASP H 1 65 ALA MB . . 4.880 4.007 3.612 4.320 . 0 0 "[ . 1 . 2]" 1
1681 1 64 ASP HA 1 65 ALA HA . . 5.500 4.470 4.088 4.675 . 0 0 "[ . 1 . 2]" 1
1682 1 64 ASP HA 1 65 ALA MB . . 5.500 4.356 4.100 4.597 . 0 0 "[ . 1 . 2]" 1
1683 1 64 ASP QB 1 65 ALA H . . 4.930 3.937 3.785 4.013 . 0 0 "[ . 1 . 2]" 1
1684 1 64 ASP QB 1 65 ALA HA . . 5.500 4.644 4.263 4.971 . 0 0 "[ . 1 . 2]" 1
1685 1 64 ASP QB 1 65 ALA MB . . 5.500 4.864 4.625 5.068 . 0 0 "[ . 1 . 2]" 1
1686 1 65 ALA H 1 65 ALA MB . . 3.240 2.269 2.034 2.567 . 0 0 "[ . 1 . 2]" 1
1687 1 65 ALA H 1 66 CYS H . . 4.820 4.196 3.021 4.647 . 0 0 "[ . 1 . 2]" 1
1688 1 65 ALA HA 1 66 CYS H . . 3.050 2.460 2.115 3.128 0.078 4 0 "[ . 1 . 2]" 1
1689 1 65 ALA MB 1 66 CYS H . . 3.660 3.090 2.718 3.526 . 0 0 "[ . 1 . 2]" 1
1690 1 65 ALA MB 1 67 VAL H . . 5.500 4.721 4.130 5.345 . 0 0 "[ . 1 . 2]" 1
1691 1 65 ALA MB 1 67 VAL HA . . 5.500 4.546 3.968 5.319 . 0 0 "[ . 1 . 2]" 1
1692 1 66 CYS H 1 66 CYS HB2 . . 4.070 2.603 2.130 3.571 . 0 0 "[ . 1 . 2]" 1
1693 1 66 CYS H 1 66 CYS HB3 . . 3.680 3.281 2.324 3.999 0.319 8 0 "[ . 1 . 2]" 1
1694 1 66 CYS H 1 67 VAL H . . 5.330 4.355 3.447 4.687 . 0 0 "[ . 1 . 2]" 1
1695 1 66 CYS H 1 67 VAL HA . . 5.500 5.412 5.062 5.585 0.085 3 0 "[ . 1 . 2]" 1
1696 1 66 CYS HA 1 67 VAL H . . 3.120 2.284 2.165 2.416 . 0 0 "[ . 1 . 2]" 1
1697 1 66 CYS HA 1 67 VAL HA . . 5.500 4.473 4.398 4.535 . 0 0 "[ . 1 . 2]" 1
1698 1 66 CYS HA 1 67 VAL QG . . 4.660 3.529 3.189 3.874 . 0 0 "[ . 1 . 2]" 1
1699 1 66 CYS HB2 1 67 VAL H . . 4.710 4.420 4.104 4.557 . 0 0 "[ . 1 . 2]" 1
1700 1 66 CYS HB3 1 67 VAL H . . 4.930 3.983 3.133 4.466 . 0 0 "[ . 1 . 2]" 1
1701 1 67 VAL H 1 67 VAL HB . . 3.590 3.068 2.652 3.682 0.092 16 0 "[ . 1 . 2]" 1
1702 1 67 VAL H 1 67 VAL QG . . 3.410 2.285 2.009 2.638 . 0 0 "[ . 1 . 2]" 1
1703 1 67 VAL H 1 68 PRO HD2 . . 5.500 5.002 4.857 5.278 . 0 0 "[ . 1 . 2]" 1
1704 1 67 VAL H 1 68 PRO HD3 . . 5.500 4.834 4.492 5.035 . 0 0 "[ . 1 . 2]" 1
1705 1 67 VAL HA 1 68 PRO HD2 . . 3.760 2.459 2.208 3.024 . 0 0 "[ . 1 . 2]" 1
1706 1 67 VAL QG 1 68 PRO HA . . 5.030 4.353 3.966 4.600 . 0 0 "[ . 1 . 2]" 1
1707 1 67 VAL QG 1 68 PRO HB2 . . 5.500 4.868 4.118 5.290 . 0 0 "[ . 1 . 2]" 1
1708 1 67 VAL QG 1 68 PRO HD2 . . 3.990 2.264 1.855 3.311 . 0 0 "[ . 1 . 2]" 1
1709 1 67 VAL QG 1 68 PRO HD3 . . 4.720 3.278 2.630 4.078 . 0 0 "[ . 1 . 2]" 1
1710 1 67 VAL QG 1 68 PRO HG2 . . 5.500 3.701 3.034 4.502 . 0 0 "[ . 1 . 2]" 1
1711 1 67 VAL QG 1 72 MET HB2 . . 4.830 3.205 2.342 4.705 . 0 0 "[ . 1 . 2]" 1
1712 1 67 VAL QG 1 72 MET ME . . 5.030 2.666 2.003 3.997 . 0 0 "[ . 1 . 2]" 1
1713 1 67 VAL QG 1 72 MET HG2 . . 5.500 3.296 2.066 4.478 . 0 0 "[ . 1 . 2]" 1
1714 1 67 VAL QG 1 72 MET HG3 . . 5.500 4.205 2.029 5.327 . 0 0 "[ . 1 . 2]" 1
1715 1 67 VAL QG 1 73 VAL H . . 5.500 5.194 4.766 5.505 0.005 10 0 "[ . 1 . 2]" 1
1716 1 67 VAL QG 1 73 VAL QG . . 4.320 4.193 3.802 4.320 . 6 0 "[ . 1 . 2]" 1
1717 1 68 PRO HA 1 69 LEU H . . 3.100 2.290 2.165 2.566 . 0 0 "[ . 1 . 2]" 1
1718 1 68 PRO HA 1 69 LEU HA . . 5.040 4.328 4.126 4.510 . 0 0 "[ . 1 . 2]" 1
1719 1 68 PRO HA 1 69 LEU HB3 . . 5.240 4.931 4.665 5.351 0.111 12 0 "[ . 1 . 2]" 1
1720 1 68 PRO HA 1 70 THR H . . 4.530 4.199 3.777 4.574 0.044 20 0 "[ . 1 . 2]" 1
1721 1 68 PRO HA 1 70 THR MG . . 5.500 5.030 4.512 5.445 . 0 0 "[ . 1 . 2]" 1
1722 1 68 PRO HA 1 71 THR H . . 5.370 4.666 4.271 5.334 . 0 0 "[ . 1 . 2]" 1
1723 1 68 PRO HA 1 71 THR HB . . 5.500 4.664 4.517 4.873 . 0 0 "[ . 1 . 2]" 1
1724 1 68 PRO HA 1 71 THR MG . . 5.500 5.581 5.388 5.614 0.114 7 0 "[ . 1 . 2]" 1
1725 1 68 PRO HB2 1 70 THR HA . . 5.500 5.453 5.168 5.601 0.101 18 0 "[ . 1 . 2]" 1
1726 1 68 PRO HB2 1 71 THR H . . 5.500 2.544 2.087 3.173 . 0 0 "[ . 1 . 2]" 1
1727 1 68 PRO HB2 1 71 THR HB . . 4.500 2.077 1.960 2.385 . 0 0 "[ . 1 . 2]" 1
1728 1 68 PRO HB2 1 71 THR MG . . 5.500 3.581 3.345 4.081 . 0 0 "[ . 1 . 2]" 1
1729 1 68 PRO HB2 1 72 MET H . . 5.500 2.927 2.368 3.307 . 0 0 "[ . 1 . 2]" 1
1730 1 68 PRO HB2 1 72 MET HA . . 5.500 5.375 4.996 5.605 0.105 12 0 "[ . 1 . 2]" 1
1731 1 68 PRO HB2 1 72 MET HB2 . . 4.960 4.457 3.740 5.173 0.213 3 0 "[ . 1 . 2]" 1
1732 1 68 PRO HB3 1 69 LEU H . . 4.690 3.662 2.915 4.034 . 0 0 "[ . 1 . 2]" 1
1733 1 68 PRO HB3 1 69 LEU HA . . 5.500 5.535 4.852 5.606 0.106 2 0 "[ . 1 . 2]" 1
1734 1 68 PRO HB3 1 71 THR H . . 5.500 4.206 3.030 4.930 . 0 0 "[ . 1 . 2]" 1
1735 1 68 PRO HB3 1 71 THR HB . . 4.370 3.104 2.360 3.346 . 0 0 "[ . 1 . 2]" 1
1736 1 68 PRO HB3 1 72 MET H . . 5.500 4.436 3.751 4.740 . 0 0 "[ . 1 . 2]" 1
1737 1 68 PRO HD2 1 72 MET HB2 . . 5.110 2.982 2.413 4.428 . 0 0 "[ . 1 . 2]" 1
1738 1 68 PRO HD2 1 72 MET ME . . 3.850 2.863 2.164 3.892 0.042 1 0 "[ . 1 . 2]" 1
1739 1 68 PRO HD3 1 71 THR HB . . 4.870 4.732 4.489 4.863 . 0 0 "[ . 1 . 2]" 1
1740 1 68 PRO HD3 1 72 MET HB2 . . 5.500 4.500 4.060 5.737 0.237 3 0 "[ . 1 . 2]" 1
1741 1 68 PRO HG2 1 69 LEU H . . 5.500 4.794 4.402 5.066 . 0 0 "[ . 1 . 2]" 1
1742 1 68 PRO HG2 1 69 LEU HA . . 5.500 4.994 4.545 5.560 0.060 14 0 "[ . 1 . 2]" 1
1743 1 68 PRO HG2 1 70 THR H . . 5.500 5.282 4.936 5.602 0.102 10 0 "[ . 1 . 2]" 1
1744 1 68 PRO HG2 1 71 THR H . . 5.110 3.718 3.443 4.075 . 0 0 "[ . 1 . 2]" 1
1745 1 68 PRO HG2 1 71 THR HA . . 5.500 4.978 4.715 5.342 . 0 0 "[ . 1 . 2]" 1
1746 1 68 PRO HG2 1 71 THR HB . . 3.860 2.366 2.063 2.756 . 0 0 "[ . 1 . 2]" 1
1747 1 68 PRO HG2 1 71 THR MG . . 4.680 3.667 3.173 4.209 . 0 0 "[ . 1 . 2]" 1
1748 1 68 PRO HG2 1 72 MET H . . 4.610 2.331 2.094 2.743 . 0 0 "[ . 1 . 2]" 1
1749 1 68 PRO HG3 1 71 THR H . . 5.500 4.743 4.285 5.181 . 0 0 "[ . 1 . 2]" 1
1750 1 68 PRO HG3 1 71 THR HA . . 5.500 5.533 5.266 5.593 0.093 14 0 "[ . 1 . 2]" 1
1751 1 68 PRO HG3 1 71 THR HB . . 4.890 2.613 2.278 2.756 . 0 0 "[ . 1 . 2]" 1
1752 1 68 PRO HG3 1 71 THR MG . . 5.500 3.242 2.805 3.645 . 0 0 "[ . 1 . 2]" 1
1753 1 68 PRO HG3 1 72 MET H . . 4.170 3.863 3.397 4.204 0.034 16 0 "[ . 1 . 2]" 1
1754 1 69 LEU H 1 69 LEU HB2 . . 3.420 2.673 2.338 3.253 . 0 0 "[ . 1 . 2]" 1
1755 1 69 LEU H 1 69 LEU HB3 . . 3.610 2.772 2.593 3.062 . 0 0 "[ . 1 . 2]" 1
1756 1 69 LEU H 1 69 LEU MD1 . . 4.410 4.135 3.716 4.332 . 0 0 "[ . 1 . 2]" 1
1757 1 69 LEU H 1 70 THR MG . . 4.970 3.910 3.450 4.390 . 0 0 "[ . 1 . 2]" 1
1758 1 69 LEU HA 1 69 LEU MD1 . . 3.420 2.050 1.992 2.332 . 0 0 "[ . 1 . 2]" 1
1759 1 69 LEU HA 1 69 LEU MD2 . . 3.670 3.664 2.094 3.778 0.108 2 0 "[ . 1 . 2]" 1
1760 1 69 LEU HA 1 70 THR HA . . 5.500 4.534 4.333 4.696 . 0 0 "[ . 1 . 2]" 1
1761 1 69 LEU HA 1 70 THR MG . . 5.500 5.259 5.007 5.499 . 0 0 "[ . 1 . 2]" 1
1762 1 69 LEU HA 1 71 THR H . . 5.170 3.818 3.490 4.367 . 0 0 "[ . 1 . 2]" 1
1763 1 69 LEU HA 1 73 VAL H . . 4.850 4.036 3.529 4.891 0.041 12 0 "[ . 1 . 2]" 1
1764 1 69 LEU HA 1 73 VAL HB . . 5.390 4.923 3.958 5.480 0.090 16 0 "[ . 1 . 2]" 1
1765 1 69 LEU HA 1 73 VAL QG . . 4.340 2.744 2.364 3.581 . 0 0 "[ . 1 . 2]" 1
1766 1 69 LEU HB2 1 69 LEU MD1 . . 3.200 2.505 2.343 3.253 0.053 12 0 "[ . 1 . 2]" 1
1767 1 69 LEU HB2 1 70 THR H . . 4.330 4.071 3.353 4.364 0.034 6 0 "[ . 1 . 2]" 1
1768 1 69 LEU HB2 1 71 THR H . . 5.500 5.534 5.278 5.628 0.128 14 0 "[ . 1 . 2]" 1
1769 1 69 LEU HB2 1 73 VAL QG . . 5.500 4.575 4.258 5.637 0.137 12 0 "[ . 1 . 2]" 1
1770 1 69 LEU HB2 1 78 ALA MB . . 3.460 3.378 2.610 3.581 0.121 5 0 "[ . 1 . 2]" 1
1771 1 69 LEU HB3 1 70 THR H . . 3.760 3.088 2.313 3.641 . 0 0 "[ . 1 . 2]" 1
1772 1 69 LEU HB3 1 70 THR MG . . 4.820 4.448 3.812 4.891 0.071 11 0 "[ . 1 . 2]" 1
1773 1 69 LEU HB3 1 71 THR H . . 5.500 5.040 4.637 5.304 . 0 0 "[ . 1 . 2]" 1
1774 1 69 LEU HB3 1 77 THR HA . . 5.500 4.323 3.833 4.890 . 0 0 "[ . 1 . 2]" 1
1775 1 69 LEU HB3 1 89 LEU QD . . 5.500 3.880 3.449 4.492 . 0 0 "[ . 1 . 2]" 1
1776 1 69 LEU MD1 1 70 THR H . . 5.260 4.598 3.744 4.938 . 0 0 "[ . 1 . 2]" 1
1777 1 69 LEU MD1 1 73 VAL H . . 4.940 4.311 3.741 4.911 . 0 0 "[ . 1 . 2]" 1
1778 1 69 LEU MD1 1 73 VAL HB . . 4.080 3.892 2.921 4.189 0.109 6 0 "[ . 1 . 2]" 1
1779 1 69 LEU MD1 1 73 VAL QG . . 3.810 2.156 1.900 3.069 . 0 0 "[ . 1 . 2]" 1
1780 1 69 LEU MD1 1 77 THR H . . 5.500 4.528 2.692 5.400 . 0 0 "[ . 1 . 2]" 1
1781 1 69 LEU MD2 1 70 THR H . . 5.500 4.957 4.233 5.308 . 0 0 "[ . 1 . 2]" 1
1782 1 69 LEU MD2 1 73 VAL QG . . 4.400 4.085 3.815 4.317 . 0 0 "[ . 1 . 2]" 1
1783 1 69 LEU MD2 1 89 LEU QD . . 4.990 2.089 1.910 2.661 . 0 0 "[ . 1 . 2]" 1
1784 1 69 LEU HG 1 70 THR H . . 5.110 4.449 3.767 4.938 . 0 0 "[ . 1 . 2]" 1
1785 1 69 LEU HG 1 70 THR HA . . 5.480 4.415 3.637 5.537 0.057 12 0 "[ . 1 . 2]" 1
1786 1 69 LEU HG 1 70 THR HB . . 5.500 4.821 4.185 5.564 0.064 11 0 "[ . 1 . 2]" 1
1787 1 69 LEU HG 1 77 THR H . . 5.010 3.509 2.926 4.314 . 0 0 "[ . 1 . 2]" 1
1788 1 69 LEU HG 1 77 THR HA . . 5.170 4.317 3.700 5.176 0.006 5 0 "[ . 1 . 2]" 1
1789 1 70 THR H 1 70 THR MG . . 3.430 2.236 2.001 2.422 . 0 0 "[ . 1 . 2]" 1
1790 1 70 THR H 1 71 THR H . . 3.700 2.460 2.007 3.020 . 0 0 "[ . 1 . 2]" 1
1791 1 70 THR H 1 71 THR HA . . 5.500 4.929 4.630 5.315 . 0 0 "[ . 1 . 2]" 1
1792 1 70 THR H 1 76 ALA MB . . 5.500 4.879 4.368 5.137 . 0 0 "[ . 1 . 2]" 1
1793 1 70 THR HA 1 70 THR MG . . 3.370 3.257 3.213 3.292 . 0 0 "[ . 1 . 2]" 1
1794 1 70 THR HA 1 73 VAL H . . 4.870 4.573 4.063 4.928 0.058 4 0 "[ . 1 . 2]" 1
1795 1 70 THR HA 1 73 VAL QG . . 5.500 3.732 3.171 4.747 . 0 0 "[ . 1 . 2]" 1
1796 1 70 THR HA 1 74 GLN HA . . 5.500 5.308 4.674 5.582 0.082 7 0 "[ . 1 . 2]" 1
1797 1 70 THR HA 1 76 ALA H . . 5.020 4.226 3.784 4.556 . 0 0 "[ . 1 . 2]" 1
1798 1 70 THR HA 1 76 ALA MB . . 3.830 3.274 2.528 3.724 . 0 0 "[ . 1 . 2]" 1
1799 1 70 THR HA 1 77 THR HA . . 4.090 3.587 3.046 4.011 . 0 0 "[ . 1 . 2]" 1
1800 1 70 THR HB 1 71 THR H . . 5.000 4.340 4.022 4.559 . 0 0 "[ . 1 . 2]" 1
1801 1 70 THR HB 1 76 ALA MB . . 5.010 4.719 4.130 5.108 0.098 3 0 "[ . 1 . 2]" 1
1802 1 70 THR HB 1 77 THR HA . . 3.250 2.474 2.074 3.101 . 0 0 "[ . 1 . 2]" 1
1803 1 70 THR HB 1 78 ALA H . . 5.500 3.628 3.171 4.111 . 0 0 "[ . 1 . 2]" 1
1804 1 70 THR HB 1 78 ALA MB . . 5.100 4.053 3.313 4.550 . 0 0 "[ . 1 . 2]" 1
1805 1 70 THR MG 1 71 THR H . . 4.990 3.270 2.678 3.898 . 0 0 "[ . 1 . 2]" 1
1806 1 71 THR H 1 71 THR HB . . 3.520 2.710 2.444 3.024 . 0 0 "[ . 1 . 2]" 1
1807 1 71 THR H 1 71 THR MG . . 4.070 3.865 3.714 4.026 . 0 0 "[ . 1 . 2]" 1
1808 1 71 THR H 1 72 MET H . . 3.060 2.314 2.059 2.581 . 0 0 "[ . 1 . 2]" 1
1809 1 71 THR H 1 72 MET HA . . 5.110 4.945 4.705 5.176 0.066 10 0 "[ . 1 . 2]" 1
1810 1 71 THR H 1 73 VAL H . . 4.660 3.437 2.874 4.084 . 0 0 "[ . 1 . 2]" 1
1811 1 71 THR H 1 73 VAL QG . . 5.500 3.848 3.225 4.844 . 0 0 "[ . 1 . 2]" 1
1812 1 71 THR H 1 76 ALA MB . . 5.500 5.049 4.489 5.596 0.096 10 0 "[ . 1 . 2]" 1
1813 1 71 THR HA 1 71 THR MG . . 3.320 2.359 2.264 2.457 . 0 0 "[ . 1 . 2]" 1
1814 1 71 THR HA 1 73 VAL H . . 5.370 4.676 4.283 5.072 . 0 0 "[ . 1 . 2]" 1
1815 1 71 THR HB 1 72 MET H . . 3.690 2.527 2.151 2.871 . 0 0 "[ . 1 . 2]" 1
1816 1 71 THR HB 1 72 MET HA . . 4.140 4.165 3.860 4.219 0.079 3 0 "[ . 1 . 2]" 1
1817 1 71 THR HB 1 72 MET HB2 . . 5.050 4.204 3.649 5.146 0.096 3 0 "[ . 1 . 2]" 1
1818 1 71 THR HB 1 73 VAL H . . 5.340 4.792 4.309 5.123 . 0 0 "[ . 1 . 2]" 1
1819 1 71 THR HB 1 73 VAL QG . . 5.500 5.381 5.049 5.479 . 0 0 "[ . 1 . 2]" 1
1820 1 71 THR MG 1 72 MET H . . 4.410 3.783 3.469 4.110 . 0 0 "[ . 1 . 2]" 1
1821 1 71 THR MG 1 72 MET HA . . 5.080 4.037 3.720 4.465 . 0 0 "[ . 1 . 2]" 1
1822 1 71 THR MG 1 72 MET HB2 . . 5.500 4.900 4.412 5.650 0.150 3 0 "[ . 1 . 2]" 1
1823 1 71 THR MG 1 73 VAL H . . 5.500 5.389 5.114 5.594 0.094 13 0 "[ . 1 . 2]" 1
1824 1 72 MET H 1 72 MET HB2 . . 3.450 2.601 1.959 3.569 0.119 14 0 "[ . 1 . 2]" 1
1825 1 72 MET H 1 72 MET ME . . 4.780 4.517 4.024 4.881 0.101 1 0 "[ . 1 . 2]" 1
1826 1 72 MET H 1 73 VAL H . . 3.410 2.422 2.164 2.725 . 0 0 "[ . 1 . 2]" 1
1827 1 72 MET H 1 73 VAL QG . . 5.500 3.458 3.011 3.777 . 0 0 "[ . 1 . 2]" 1
1828 1 72 MET HA 1 72 MET ME . . 3.570 3.488 2.894 3.689 0.119 14 0 "[ . 1 . 2]" 1
1829 1 72 MET HA 1 72 MET HG2 . . 3.770 3.571 2.745 3.930 0.160 11 0 "[ . 1 . 2]" 1
1830 1 72 MET HA 1 72 MET HG3 . . 4.070 2.859 2.111 3.917 . 0 0 "[ . 1 . 2]" 1
1831 1 72 MET HA 1 73 VAL HA . . 5.500 4.737 4.607 4.869 . 0 0 "[ . 1 . 2]" 1
1832 1 72 MET HA 1 73 VAL QG . . 5.420 4.509 4.170 4.748 . 0 0 "[ . 1 . 2]" 1
1833 1 72 MET HB2 1 73 VAL H . . 3.880 3.644 2.179 3.924 0.044 4 0 "[ . 1 . 2]" 1
1834 1 72 MET ME 1 72 MET HG2 . . 3.430 2.683 2.285 3.363 . 0 0 "[ . 1 . 2]" 1
1835 1 72 MET ME 1 72 MET HG3 . . 3.570 2.978 2.096 3.434 . 0 0 "[ . 1 . 2]" 1
1836 1 72 MET ME 1 73 VAL H . . 5.480 5.423 5.016 5.592 0.112 1 0 "[ . 1 . 2]" 1
1837 1 72 MET ME 1 73 VAL QG . . 5.500 5.111 4.437 5.401 . 0 0 "[ . 1 . 2]" 1
1838 1 72 MET HG2 1 73 VAL HA . . 5.500 5.186 3.726 6.141 0.641 1 1 "[+ . 1 . 2]" 1
1839 1 72 MET HG2 1 73 VAL QG . . 5.230 3.943 2.959 4.819 . 0 0 "[ . 1 . 2]" 1
1840 1 72 MET HG3 1 73 VAL H . . 5.500 4.007 2.387 4.833 . 0 0 "[ . 1 . 2]" 1
1841 1 72 MET HG3 1 73 VAL QG . . 5.500 3.951 2.476 5.235 . 0 0 "[ . 1 . 2]" 1
1842 1 73 VAL H 1 73 VAL HB . . 3.540 2.948 2.540 3.485 . 0 0 "[ . 1 . 2]" 1
1843 1 73 VAL H 1 73 VAL QG . . 3.740 1.955 1.804 2.354 . 0 0 "[ . 1 . 2]" 1
1844 1 73 VAL H 1 74 GLN H . . 4.990 4.465 4.366 4.572 . 0 0 "[ . 1 . 2]" 1
1845 1 73 VAL H 1 76 ALA MB . . 4.790 4.220 3.899 4.542 . 0 0 "[ . 1 . 2]" 1
1846 1 73 VAL HA 1 74 GLN H . . 3.110 2.353 2.084 2.707 . 0 0 "[ . 1 . 2]" 1
1847 1 73 VAL HA 1 76 ALA H . . 5.470 5.449 5.193 5.555 0.085 11 0 "[ . 1 . 2]" 1
1848 1 73 VAL HA 1 76 ALA MB . . 5.500 4.665 4.341 4.969 . 0 0 "[ . 1 . 2]" 1
1849 1 73 VAL HA 1 95 PHE QE . . 5.440 4.177 3.471 4.665 . 0 0 "[ . 1 . 2]" 1
1850 1 73 VAL HA 1 95 PHE HZ . . 5.500 4.420 3.379 5.190 . 0 0 "[ . 1 . 2]" 1
1851 1 73 VAL HB 1 76 ALA H . . 5.410 4.764 3.084 5.496 0.086 7 0 "[ . 1 . 2]" 1
1852 1 73 VAL HB 1 76 ALA MB . . 3.790 3.267 2.048 3.913 0.123 16 0 "[ . 1 . 2]" 1
1853 1 73 VAL QG 1 74 GLN H . . 4.220 2.093 1.600 2.595 . 0 0 "[ . 1 . 2]" 1
1854 1 73 VAL QG 1 74 GLN HA . . 5.500 3.841 3.580 4.242 . 0 0 "[ . 1 . 2]" 1
1855 1 73 VAL QG 1 74 GLN HB2 . . 5.500 4.462 4.215 5.184 . 0 0 "[ . 1 . 2]" 1
1856 1 73 VAL QG 1 74 GLN HB3 . . 5.500 3.549 3.374 4.391 . 0 0 "[ . 1 . 2]" 1
1857 1 73 VAL QG 1 74 GLN HG3 . . 5.500 5.478 5.418 5.784 0.284 15 0 "[ . 1 . 2]" 1
1858 1 73 VAL QG 1 75 ASP H . . 5.150 4.430 4.063 4.941 . 0 0 "[ . 1 . 2]" 1
1859 1 73 VAL QG 1 75 ASP HB3 . . 5.500 4.432 4.003 4.803 . 0 0 "[ . 1 . 2]" 1
1860 1 73 VAL QG 1 76 ALA H . . 4.290 2.652 2.258 3.175 . 0 0 "[ . 1 . 2]" 1
1861 1 73 VAL QG 1 76 ALA HA . . 5.180 3.980 3.692 4.370 . 0 0 "[ . 1 . 2]" 1
1862 1 73 VAL QG 1 76 ALA MB . . 3.700 1.918 1.759 2.245 . 0 0 "[ . 1 . 2]" 1
1863 1 73 VAL QG 1 77 THR H . . 5.500 4.808 4.530 5.233 . 0 0 "[ . 1 . 2]" 1
1864 1 73 VAL QG 1 91 ILE HA . . 5.060 3.693 3.437 4.052 . 0 0 "[ . 1 . 2]" 1
1865 1 73 VAL QG 1 91 ILE HB . . 5.500 4.985 4.593 5.359 . 0 0 "[ . 1 . 2]" 1
1866 1 73 VAL QG 1 91 ILE MD . . 5.500 3.467 2.970 4.138 . 0 0 "[ . 1 . 2]" 1
1867 1 73 VAL QG 1 91 ILE HG12 . . 4.690 3.399 3.069 3.698 . 0 0 "[ . 1 . 2]" 1
1868 1 73 VAL QG 1 91 ILE HG13 . . 5.500 4.729 4.422 5.012 . 0 0 "[ . 1 . 2]" 1
1869 1 73 VAL QG 1 91 ILE MG . . 3.770 2.587 2.114 3.014 . 0 0 "[ . 1 . 2]" 1
1870 1 73 VAL QG 1 92 PRO HB2 . . 5.500 5.207 4.436 6.090 0.590 11 1 "[ . 1+ . 2]" 1
1871 1 73 VAL QG 1 92 PRO QD . . 4.390 2.757 2.457 3.321 . 0 0 "[ . 1 . 2]" 1
1872 1 73 VAL QG 1 92 PRO QG . . 5.500 3.363 3.063 3.901 . 0 0 "[ . 1 . 2]" 1
1873 1 73 VAL QG 1 95 PHE H . . 5.500 4.713 4.260 5.041 . 0 0 "[ . 1 . 2]" 1
1874 1 73 VAL QG 1 95 PHE QB . . 5.500 2.759 2.359 3.085 . 0 0 "[ . 1 . 2]" 1
1875 1 73 VAL QG 1 95 PHE QD . . 4.540 2.697 2.485 2.948 . 0 0 "[ . 1 . 2]" 1
1876 1 73 VAL QG 1 95 PHE QE . . 4.670 2.890 2.745 3.231 . 0 0 "[ . 1 . 2]" 1
1877 1 73 VAL QG 1 95 PHE HZ . . 5.500 3.840 3.508 4.398 . 0 0 "[ . 1 . 2]" 1
1878 1 74 GLN H 1 74 GLN HB2 . . 3.380 3.020 2.558 3.471 0.091 15 0 "[ . 1 . 2]" 1
1879 1 74 GLN H 1 74 GLN HB3 . . 3.400 2.213 1.966 2.436 . 0 0 "[ . 1 . 2]" 1
1880 1 74 GLN H 1 74 GLN HG2 . . 4.420 4.297 3.810 4.395 . 0 0 "[ . 1 . 2]" 1
1881 1 74 GLN H 1 75 ASP H . . 4.480 4.430 4.219 4.550 0.070 5 0 "[ . 1 . 2]" 1
1882 1 74 GLN H 1 76 ALA MB . . 5.500 4.251 3.672 4.939 . 0 0 "[ . 1 . 2]" 1
1883 1 74 GLN H 1 95 PHE QD . . 5.500 4.328 3.867 5.007 . 0 0 "[ . 1 . 2]" 1
1884 1 74 GLN H 1 95 PHE HZ . . 5.110 3.482 2.629 4.352 . 0 0 "[ . 1 . 2]" 1
1885 1 74 GLN HA 1 74 GLN QE . . 5.500 3.953 3.805 4.321 . 0 0 "[ . 1 . 2]" 1
1886 1 74 GLN HA 1 74 GLN HG2 . . 3.900 2.830 2.626 3.280 . 0 0 "[ . 1 . 2]" 1
1887 1 74 GLN HA 1 74 GLN HG3 . . 3.780 3.586 3.422 3.837 0.057 15 0 "[ . 1 . 2]" 1
1888 1 74 GLN HA 1 75 ASP H . . 2.930 2.195 2.106 2.296 . 0 0 "[ . 1 . 2]" 1
1889 1 74 GLN HA 1 75 ASP HA . . 4.410 4.373 4.281 4.471 0.061 11 0 "[ . 1 . 2]" 1
1890 1 74 GLN HA 1 75 ASP HB2 . . 5.500 4.577 4.304 4.889 . 0 0 "[ . 1 . 2]" 1
1891 1 74 GLN HA 1 75 ASP HB3 . . 5.500 5.034 4.757 5.371 . 0 0 "[ . 1 . 2]" 1
1892 1 74 GLN HA 1 76 ALA H . . 4.290 3.803 3.372 4.126 . 0 0 "[ . 1 . 2]" 1
1893 1 74 GLN HA 1 76 ALA MB . . 5.500 4.821 4.341 5.246 . 0 0 "[ . 1 . 2]" 1
1894 1 74 GLN HB2 1 75 ASP H . . 4.350 3.940 3.185 4.108 . 0 0 "[ . 1 . 2]" 1
1895 1 74 GLN HB2 1 76 ALA H . . 5.500 5.522 5.047 5.620 0.120 14 0 "[ . 1 . 2]" 1
1896 1 74 GLN HB2 1 95 PHE QE . . 5.290 4.342 3.948 4.906 . 0 0 "[ . 1 . 2]" 1
1897 1 74 GLN HB2 1 95 PHE HZ . . 4.720 4.098 3.401 4.807 0.087 15 0 "[ . 1 . 2]" 1
1898 1 74 GLN HB3 1 76 ALA H . . 5.500 4.982 4.829 5.185 . 0 0 "[ . 1 . 2]" 1
1899 1 74 GLN HB3 1 95 PHE QE . . 5.130 2.700 2.271 3.526 . 0 0 "[ . 1 . 2]" 1
1900 1 74 GLN HB3 1 95 PHE HZ . . 4.590 2.786 2.177 3.464 . 0 0 "[ . 1 . 2]" 1
1901 1 74 GLN QE 1 75 ASP H . . 5.500 3.824 3.606 4.161 . 0 0 "[ . 1 . 2]" 1
1902 1 74 GLN QE 1 75 ASP HA . . 5.500 4.378 4.193 4.776 . 0 0 "[ . 1 . 2]" 1
1903 1 74 GLN QE 1 75 ASP HB2 . . 5.500 2.735 2.344 3.055 . 0 0 "[ . 1 . 2]" 1
1904 1 74 GLN QE 1 75 ASP HB3 . . 5.500 2.453 2.033 3.111 . 0 0 "[ . 1 . 2]" 1
1905 1 74 GLN QE 1 92 PRO QG . . 5.500 2.145 1.881 2.480 . 0 0 "[ . 1 . 2]" 1
1906 1 74 GLN QE 1 95 PHE QD . . 3.920 3.634 3.403 3.771 . 0 0 "[ . 1 . 2]" 1
1907 1 74 GLN QE 1 95 PHE HZ . . 4.410 3.869 2.865 4.117 . 0 0 "[ . 1 . 2]" 1
1908 1 74 GLN HG2 1 75 ASP H . . 4.150 2.560 2.313 2.678 . 0 0 "[ . 1 . 2]" 1
1909 1 74 GLN HG2 1 75 ASP HA . . 5.050 3.811 3.528 4.101 . 0 0 "[ . 1 . 2]" 1
1910 1 74 GLN HG2 1 75 ASP HB2 . . 4.990 2.625 2.119 3.235 . 0 0 "[ . 1 . 2]" 1
1911 1 74 GLN HG2 1 75 ASP HB3 . . 5.360 3.750 3.191 4.666 . 0 0 "[ . 1 . 2]" 1
1912 1 74 GLN HG2 1 76 ALA H . . 5.500 4.673 4.038 5.018 . 0 0 "[ . 1 . 2]" 1
1913 1 74 GLN HG3 1 75 ASP H . . 4.110 4.122 3.735 4.179 0.069 3 0 "[ . 1 . 2]" 1
1914 1 74 GLN HG3 1 95 PHE HZ . . 5.500 4.841 4.284 5.400 . 0 0 "[ . 1 . 2]" 1
1915 1 75 ASP H 1 76 ALA H . . 3.550 3.104 2.863 3.306 . 0 0 "[ . 1 . 2]" 1
1916 1 75 ASP H 1 76 ALA MB . . 4.890 4.690 4.577 4.933 0.043 11 0 "[ . 1 . 2]" 1
1917 1 75 ASP H 1 77 THR MG . . 5.500 5.063 4.693 5.587 0.087 20 0 "[ . 1 . 2]" 1
1918 1 75 ASP HA 1 77 THR MG . . 5.500 3.894 3.565 4.347 . 0 0 "[ . 1 . 2]" 1
1919 1 75 ASP HB2 1 76 ALA H . . 5.240 4.174 3.879 4.429 . 0 0 "[ . 1 . 2]" 1
1920 1 75 ASP HB2 1 76 ALA MB . . 5.500 5.543 5.345 5.887 0.387 1 0 "[ . 1 . 2]" 1
1921 1 75 ASP HB2 1 77 THR MG . . 5.500 5.692 5.419 6.011 0.511 18 1 "[ . 1 . + 2]" 1
1922 1 75 ASP HB2 1 92 PRO QD . . 5.500 4.572 3.984 5.060 . 0 0 "[ . 1 . 2]" 1
1923 1 75 ASP HB2 1 92 PRO QG . . 4.460 3.437 2.857 3.734 . 0 0 "[ . 1 . 2]" 1
1924 1 75 ASP HB3 1 76 ALA H . . 4.960 3.331 2.770 3.868 . 0 0 "[ . 1 . 2]" 1
1925 1 75 ASP HB3 1 92 PRO HB3 . . 5.500 3.659 2.418 4.333 . 0 0 "[ . 1 . 2]" 1
1926 1 75 ASP HB3 1 92 PRO QD . . 5.500 3.022 2.426 3.611 . 0 0 "[ . 1 . 2]" 1
1927 1 75 ASP HB3 1 92 PRO QG . . 4.980 2.122 2.017 2.270 . 0 0 "[ . 1 . 2]" 1
1928 1 76 ALA H 1 76 ALA MB . . 3.260 2.215 2.092 2.354 . 0 0 "[ . 1 . 2]" 1
1929 1 76 ALA H 1 77 THR H . . 5.500 4.634 4.516 4.704 . 0 0 "[ . 1 . 2]" 1
1930 1 76 ALA H 1 77 THR MG . . 5.500 4.277 3.760 4.562 . 0 0 "[ . 1 . 2]" 1
1931 1 76 ALA H 1 91 ILE HA . . 5.290 4.355 4.095 4.717 . 0 0 "[ . 1 . 2]" 1
1932 1 76 ALA H 1 91 ILE MG . . 5.500 4.995 4.550 5.504 0.004 17 0 "[ . 1 . 2]" 1
1933 1 76 ALA H 1 92 PRO QD . . 5.240 3.211 2.969 3.468 . 0 0 "[ . 1 . 2]" 1
1934 1 76 ALA HA 1 77 THR H . . 3.030 2.334 2.193 2.429 . 0 0 "[ . 1 . 2]" 1
1935 1 76 ALA HA 1 77 THR MG . . 3.030 3.097 2.899 3.137 0.107 17 0 "[ . 1 . 2]" 1
1936 1 76 ALA HA 1 90 THR H . . 4.440 4.224 3.881 4.486 0.046 10 0 "[ . 1 . 2]" 1
1937 1 76 ALA HA 1 90 THR HB . . 3.430 3.217 2.794 3.490 0.060 16 0 "[ . 1 . 2]" 1
1938 1 76 ALA HA 1 90 THR MG . . 3.210 3.213 2.825 3.315 0.105 8 0 "[ . 1 . 2]" 1
1939 1 76 ALA HA 1 91 ILE HA . . 4.320 2.694 2.240 2.951 . 0 0 "[ . 1 . 2]" 1
1940 1 76 ALA HA 1 91 ILE MD . . 5.500 5.364 5.074 5.571 0.071 18 0 "[ . 1 . 2]" 1
1941 1 76 ALA HA 1 91 ILE HG12 . . 5.500 3.968 3.620 4.211 . 0 0 "[ . 1 . 2]" 1
1942 1 76 ALA HA 1 91 ILE HG13 . . 5.500 4.677 4.419 5.110 . 0 0 "[ . 1 . 2]" 1
1943 1 76 ALA HA 1 91 ILE MG . . 5.140 4.486 4.033 4.747 . 0 0 "[ . 1 . 2]" 1
1944 1 76 ALA HA 1 92 PRO QD . . 4.640 2.771 2.356 3.286 . 0 0 "[ . 1 . 2]" 1
1945 1 76 ALA MB 1 77 THR H . . 3.700 2.577 2.448 2.752 . 0 0 "[ . 1 . 2]" 1
1946 1 76 ALA MB 1 77 THR HB . . 5.500 5.583 5.555 5.604 0.104 12 0 "[ . 1 . 2]" 1
1947 1 76 ALA MB 1 77 THR MG . . 4.410 4.005 3.941 4.068 . 0 0 "[ . 1 . 2]" 1
1948 1 76 ALA MB 1 90 THR H . . 5.470 4.070 3.833 4.283 . 0 0 "[ . 1 . 2]" 1
1949 1 76 ALA MB 1 90 THR HB . . 5.500 4.390 4.133 4.678 . 0 0 "[ . 1 . 2]" 1
1950 1 76 ALA MB 1 91 ILE HA . . 4.080 2.286 2.158 2.427 . 0 0 "[ . 1 . 2]" 1
1951 1 76 ALA MB 1 91 ILE HB . . 5.500 4.380 4.091 4.554 . 0 0 "[ . 1 . 2]" 1
1952 1 76 ALA MB 1 92 PRO QD . . 4.360 2.419 2.055 2.970 . 0 0 "[ . 1 . 2]" 1
1953 1 76 ALA MB 1 92 PRO QG . . 5.500 3.871 3.478 4.416 . 0 0 "[ . 1 . 2]" 1
1954 1 77 THR H 1 77 THR MG . . 3.820 2.936 2.752 3.076 . 0 0 "[ . 1 . 2]" 1
1955 1 77 THR H 1 78 ALA HA . . 5.500 4.848 4.718 5.094 . 0 0 "[ . 1 . 2]" 1
1956 1 77 THR H 1 78 ALA MB . . 5.500 4.655 4.428 4.859 . 0 0 "[ . 1 . 2]" 1
1957 1 77 THR H 1 89 LEU QD . . 5.500 4.856 4.351 5.299 . 0 0 "[ . 1 . 2]" 1
1958 1 77 THR H 1 90 THR H . . 3.880 2.477 2.310 2.667 . 0 0 "[ . 1 . 2]" 1
1959 1 77 THR H 1 90 THR HA . . 5.500 4.502 4.297 4.654 . 0 0 "[ . 1 . 2]" 1
1960 1 77 THR H 1 90 THR HB . . 4.390 2.664 2.174 3.103 . 0 0 "[ . 1 . 2]" 1
1961 1 77 THR H 1 90 THR MG . . 4.650 3.898 3.464 4.275 . 0 0 "[ . 1 . 2]" 1
1962 1 77 THR H 1 91 ILE HA . . 5.000 4.104 3.877 4.357 . 0 0 "[ . 1 . 2]" 1
1963 1 77 THR H 1 91 ILE HG12 . . 5.500 4.154 3.883 4.482 . 0 0 "[ . 1 . 2]" 1
1964 1 77 THR H 1 91 ILE HG13 . . 5.500 4.420 4.075 4.782 . 0 0 "[ . 1 . 2]" 1
1965 1 77 THR H 1 91 ILE MG . . 5.500 5.488 5.188 5.588 0.088 16 0 "[ . 1 . 2]" 1
1966 1 77 THR H 1 92 PRO QD . . 5.380 4.777 4.487 5.175 . 0 0 "[ . 1 . 2]" 1
1967 1 77 THR HA 1 77 THR MG . . 2.850 2.582 2.399 2.743 . 0 0 "[ . 1 . 2]" 1
1968 1 77 THR HA 1 78 ALA H . . 3.030 2.442 2.301 2.615 . 0 0 "[ . 1 . 2]" 1
1969 1 77 THR HA 1 78 ALA HA . . 4.800 4.539 4.495 4.591 . 0 0 "[ . 1 . 2]" 1
1970 1 77 THR HA 1 78 ALA MB . . 3.790 3.868 3.675 3.896 0.106 11 0 "[ . 1 . 2]" 1
1971 1 77 THR HB 1 78 ALA H . . 3.460 2.457 2.287 2.648 . 0 0 "[ . 1 . 2]" 1
1972 1 77 THR HB 1 78 ALA HA . . 5.500 4.509 4.293 4.936 . 0 0 "[ . 1 . 2]" 1
1973 1 77 THR HB 1 78 ALA MB . . 5.190 4.662 4.535 4.738 . 0 0 "[ . 1 . 2]" 1
1974 1 77 THR HB 1 79 HIS H . . 5.500 5.022 3.752 5.574 0.074 17 0 "[ . 1 . 2]" 1
1975 1 77 THR HB 1 90 THR HB . . 4.470 4.355 4.149 4.525 0.055 2 0 "[ . 1 . 2]" 1
1976 1 77 THR MG 1 78 ALA H . . 3.910 3.921 3.781 4.010 0.100 5 0 "[ . 1 . 2]" 1
1977 1 77 THR MG 1 78 ALA HA . . 5.500 5.464 5.328 5.541 0.041 15 0 "[ . 1 . 2]" 1
1978 1 77 THR MG 1 90 THR H . . 5.250 4.375 3.692 4.921 . 0 0 "[ . 1 . 2]" 1
1979 1 77 THR MG 1 91 ILE HA . . 5.500 5.339 4.942 5.583 0.083 10 0 "[ . 1 . 2]" 1
1980 1 78 ALA H 1 78 ALA MB . . 3.600 2.715 2.616 2.823 . 0 0 "[ . 1 . 2]" 1
1981 1 78 ALA H 1 79 HIS HB2 . . 5.500 4.602 4.070 5.502 0.002 10 0 "[ . 1 . 2]" 1
1982 1 78 ALA H 1 79 HIS HB3 . . 5.500 4.960 4.317 5.476 . 0 0 "[ . 1 . 2]" 1
1983 1 78 ALA H 1 89 LEU QD . . 5.500 4.428 4.161 5.004 . 0 0 "[ . 1 . 2]" 1
1984 1 78 ALA HA 1 79 HIS H . . 3.140 2.193 2.105 2.579 . 0 0 "[ . 1 . 2]" 1
1985 1 78 ALA HA 1 79 HIS HA . . 5.500 4.516 4.448 4.674 . 0 0 "[ . 1 . 2]" 1
1986 1 78 ALA HA 1 79 HIS HB2 . . 5.500 4.905 4.436 5.592 0.092 10 0 "[ . 1 . 2]" 1
1987 1 78 ALA HA 1 79 HIS HB3 . . 5.500 4.334 3.990 4.746 . 0 0 "[ . 1 . 2]" 1
1988 1 78 ALA HA 1 87 LEU QD . . 5.050 3.798 3.057 4.411 . 0 0 "[ . 1 . 2]" 1
1989 1 78 ALA HA 1 88 ASN H . . 5.260 4.951 4.568 5.312 0.052 5 0 "[ . 1 . 2]" 1
1990 1 78 ALA HA 1 89 LEU H . . 5.500 4.755 4.594 4.882 . 0 0 "[ . 1 . 2]" 1
1991 1 78 ALA HA 1 89 LEU HB2 . . 5.500 4.942 4.619 5.121 . 0 0 "[ . 1 . 2]" 1
1992 1 78 ALA HA 1 89 LEU QD . . 3.690 2.221 1.911 3.167 . 0 0 "[ . 1 . 2]" 1
1993 1 78 ALA HA 1 89 LEU HG . . 5.200 4.150 3.010 4.637 . 0 0 "[ . 1 . 2]" 1
1994 1 78 ALA HA 1 90 THR H . . 4.460 3.937 3.724 4.467 0.007 11 0 "[ . 1 . 2]" 1
1995 1 78 ALA MB 1 79 HIS H . . 3.910 3.320 2.864 3.784 . 0 0 "[ . 1 . 2]" 1
1996 1 78 ALA MB 1 79 HIS HA . . 5.500 4.280 3.898 4.537 . 0 0 "[ . 1 . 2]" 1
1997 1 78 ALA MB 1 79 HIS HB2 . . 5.500 5.281 4.942 5.576 0.076 13 0 "[ . 1 . 2]" 1
1998 1 78 ALA MB 1 79 HIS HB3 . . 5.500 5.210 4.834 5.533 0.033 13 0 "[ . 1 . 2]" 1
1999 1 78 ALA MB 1 89 LEU H . . 5.500 5.585 5.461 5.610 0.110 11 0 "[ . 1 . 2]" 1
2000 1 78 ALA MB 1 89 LEU QD . . 3.550 2.060 1.992 2.212 . 0 0 "[ . 1 . 2]" 1
2001 1 78 ALA MB 1 90 THR H . . 5.320 4.507 4.242 4.870 . 0 0 "[ . 1 . 2]" 1
2002 1 79 HIS H 1 79 HIS HB2 . . 4.160 3.285 2.715 4.000 . 0 0 "[ . 1 . 2]" 1
2003 1 79 HIS H 1 79 HIS HB3 . . 3.830 2.498 2.206 3.149 . 0 0 "[ . 1 . 2]" 1
2004 1 79 HIS H 1 79 HIS HD2 . . 5.500 4.595 4.126 5.580 0.080 9 0 "[ . 1 . 2]" 1
2005 1 79 HIS H 1 80 LEU H . . 5.500 4.331 4.052 4.625 . 0 0 "[ . 1 . 2]" 1
2006 1 79 HIS H 1 87 LEU HA . . 5.500 5.101 4.647 5.566 0.066 13 0 "[ . 1 . 2]" 1
2007 1 79 HIS H 1 87 LEU QD . . 4.130 3.508 3.088 4.108 . 0 0 "[ . 1 . 2]" 1
2008 1 79 HIS H 1 88 ASN H . . 4.360 3.506 3.112 3.951 . 0 0 "[ . 1 . 2]" 1
2009 1 79 HIS H 1 88 ASN HB2 . . 5.070 3.609 3.174 4.299 . 0 0 "[ . 1 . 2]" 1
2010 1 79 HIS H 1 88 ASN HB3 . . 5.170 4.106 3.625 4.569 . 0 0 "[ . 1 . 2]" 1
2011 1 79 HIS H 1 89 LEU H . . 5.500 4.840 4.553 5.179 . 0 0 "[ . 1 . 2]" 1
2012 1 79 HIS H 1 89 LEU QD . . 4.510 3.265 2.551 4.162 . 0 0 "[ . 1 . 2]" 1
2013 1 79 HIS H 1 89 LEU HG . . 5.500 4.980 3.632 5.591 0.091 18 0 "[ . 1 . 2]" 1
2014 1 79 HIS HA 1 80 LEU H . . 3.290 2.166 1.951 2.379 . 0 0 "[ . 1 . 2]" 1
2015 1 79 HIS HA 1 80 LEU HB3 . . 5.500 4.090 3.907 4.280 . 0 0 "[ . 1 . 2]" 1
2016 1 79 HIS HA 1 80 LEU QD . . 5.500 5.083 5.016 5.156 . 0 0 "[ . 1 . 2]" 1
2017 1 79 HIS HB2 1 80 LEU H . . 5.000 3.905 2.886 4.291 . 0 0 "[ . 1 . 2]" 1
2018 1 79 HIS HB2 1 88 ASN HB2 . . 4.870 4.459 3.940 4.998 0.128 12 0 "[ . 1 . 2]" 1
2019 1 79 HIS HB2 1 88 ASN HB3 . . 5.500 5.060 4.027 5.576 0.076 18 0 "[ . 1 . 2]" 1
2020 1 79 HIS HB3 1 80 LEU H . . 4.750 4.204 3.794 4.551 . 0 0 "[ . 1 . 2]" 1
2021 1 79 HIS HB3 1 88 ASN HB2 . . 5.320 2.837 2.203 4.131 . 0 0 "[ . 1 . 2]" 1
2022 1 79 HIS HB3 1 88 ASN HB3 . . 5.500 3.384 2.420 4.494 . 0 0 "[ . 1 . 2]" 1
2023 1 79 HIS HD2 1 80 LEU H . . 5.500 4.119 2.736 5.572 0.072 8 0 "[ . 1 . 2]" 1
2024 1 79 HIS HD2 1 81 ASP H . . 5.500 4.211 3.108 5.576 0.076 18 0 "[ . 1 . 2]" 1
2025 1 79 HIS HD2 1 88 ASN HB2 . . 5.500 2.707 2.034 5.566 0.066 9 0 "[ . 1 . 2]" 1
2026 1 79 HIS HD2 1 88 ASN QD . . 5.500 2.939 1.974 5.383 . 0 0 "[ . 1 . 2]" 1
2027 1 79 HIS HE1 1 88 ASN QD . . 5.500 4.847 2.330 5.383 . 0 0 "[ . 1 . 2]" 1
2028 1 80 LEU H 1 80 LEU HB2 . . 3.940 3.102 2.525 3.745 . 0 0 "[ . 1 . 2]" 1
2029 1 80 LEU H 1 80 LEU HB3 . . 4.040 2.293 1.973 2.707 . 0 0 "[ . 1 . 2]" 1
2030 1 80 LEU H 1 80 LEU QD . . 5.110 3.671 3.457 3.883 . 0 0 "[ . 1 . 2]" 1
2031 1 80 LEU H 1 80 LEU HG . . 5.500 4.304 3.610 4.930 . 0 0 "[ . 1 . 2]" 1
2032 1 80 LEU H 1 81 ASP H . . 5.470 4.294 3.997 4.557 . 0 0 "[ . 1 . 2]" 1
2033 1 80 LEU H 1 87 LEU QD . . 4.990 4.053 3.316 4.697 . 0 0 "[ . 1 . 2]" 1
2034 1 80 LEU H 1 88 ASN H . . 5.500 4.789 4.551 5.020 . 0 0 "[ . 1 . 2]" 1
2035 1 80 LEU HA 1 80 LEU QD . . 3.620 2.435 2.209 2.714 . 0 0 "[ . 1 . 2]" 1
2036 1 80 LEU HA 1 81 ASP H . . 3.510 2.190 2.063 2.304 . 0 0 "[ . 1 . 2]" 1
2037 1 80 LEU HA 1 81 ASP HB2 . . 5.500 4.519 3.994 4.839 . 0 0 "[ . 1 . 2]" 1
2038 1 80 LEU HA 1 81 ASP HB3 . . 5.500 5.121 4.774 5.592 0.092 16 0 "[ . 1 . 2]" 1
2039 1 80 LEU HA 1 86 ARG H . . 5.500 4.779 4.492 5.555 0.055 19 0 "[ . 1 . 2]" 1
2040 1 80 LEU HA 1 87 LEU HA . . 4.200 2.633 2.260 3.204 . 0 0 "[ . 1 . 2]" 1
2041 1 80 LEU HA 1 87 LEU QD . . 4.290 2.621 2.371 3.119 . 0 0 "[ . 1 . 2]" 1
2042 1 80 LEU HA 1 87 LEU HG . . 4.760 4.710 4.301 4.848 0.088 16 0 "[ . 1 . 2]" 1
2043 1 80 LEU HA 1 88 ASN H . . 4.600 3.264 3.013 3.572 . 0 0 "[ . 1 . 2]" 1
2044 1 80 LEU HB2 1 81 ASP H . . 5.500 4.233 3.794 4.553 . 0 0 "[ . 1 . 2]" 1
2045 1 80 LEU HB2 1 88 ASN H . . 5.500 5.145 4.595 5.614 0.114 19 0 "[ . 1 . 2]" 1
2046 1 80 LEU HB3 1 81 ASP H . . 4.870 4.537 4.429 4.640 . 0 0 "[ . 1 . 2]" 1
2047 1 80 LEU HB3 1 87 LEU QD . . 5.000 4.107 3.427 4.782 . 0 0 "[ . 1 . 2]" 1
2048 1 80 LEU QD 1 81 ASP H . . 3.710 2.507 2.306 2.725 . 0 0 "[ . 1 . 2]" 1
2049 1 80 LEU QD 1 81 ASP HA . . 5.500 3.444 3.197 3.809 . 0 0 "[ . 1 . 2]" 1
2050 1 80 LEU QD 1 81 ASP HB2 . . 5.500 4.314 3.757 4.551 . 0 0 "[ . 1 . 2]" 1
2051 1 80 LEU QD 1 82 VAL H . . 5.500 2.716 2.133 3.141 . 0 0 "[ . 1 . 2]" 1
2052 1 80 LEU QD 1 82 VAL HA . . 4.420 2.311 2.023 2.658 . 0 0 "[ . 1 . 2]" 1
2053 1 80 LEU QD 1 82 VAL HB . . 5.380 2.269 1.939 2.648 . 0 0 "[ . 1 . 2]" 1
2054 1 80 LEU QD 1 82 VAL MG1 . . 3.880 3.341 2.919 3.556 . 0 0 "[ . 1 . 2]" 1
2055 1 80 LEU QD 1 85 GLN H . . 5.500 4.404 4.090 5.079 . 0 0 "[ . 1 . 2]" 1
2056 1 80 LEU QD 1 85 GLN HA . . 5.030 3.555 3.145 4.595 . 0 0 "[ . 1 . 2]" 1
2057 1 80 LEU QD 1 86 ARG H . . 4.620 3.172 2.990 4.124 . 0 0 "[ . 1 . 2]" 1
2058 1 80 LEU QD 1 86 ARG HA . . 5.500 4.835 4.577 5.404 . 0 0 "[ . 1 . 2]" 1
2059 1 80 LEU QD 1 87 LEU H . . 5.500 5.031 4.624 5.456 . 0 0 "[ . 1 . 2]" 1
2060 1 80 LEU QD 1 87 LEU HA . . 4.450 3.683 3.426 4.013 . 0 0 "[ . 1 . 2]" 1
2061 1 80 LEU QD 1 87 LEU HB2 . . 5.500 4.405 3.914 5.371 . 0 0 "[ . 1 . 2]" 1
2062 1 80 LEU QD 1 87 LEU QD . . 4.830 3.450 3.124 3.959 . 0 0 "[ . 1 . 2]" 1
2063 1 80 LEU QD 1 88 ASN H . . 5.500 4.810 4.641 5.041 . 0 0 "[ . 1 . 2]" 1
2064 1 80 LEU HG 1 81 ASP H . . 5.320 4.482 3.954 5.173 . 0 0 "[ . 1 . 2]" 1
2065 1 80 LEU HG 1 82 VAL H . . 5.500 4.297 2.808 5.578 0.078 5 0 "[ . 1 . 2]" 1
2066 1 80 LEU HG 1 82 VAL HA . . 5.060 4.475 3.614 5.149 0.089 19 0 "[ . 1 . 2]" 1
2067 1 80 LEU HG 1 82 VAL HB . . 5.500 3.599 2.212 5.213 . 0 0 "[ . 1 . 2]" 1
2068 1 81 ASP H 1 82 VAL H . . 5.280 4.104 3.854 4.249 . 0 0 "[ . 1 . 2]" 1
2069 1 81 ASP H 1 86 ARG H . . 4.500 3.202 2.991 3.563 . 0 0 "[ . 1 . 2]" 1
2070 1 81 ASP H 1 86 ARG HG2 . . 5.500 4.690 3.764 5.275 . 0 0 "[ . 1 . 2]" 1
2071 1 81 ASP H 1 87 LEU HA . . 5.020 3.281 2.995 3.622 . 0 0 "[ . 1 . 2]" 1
2072 1 81 ASP HA 1 82 VAL H . . 3.080 2.290 2.219 2.375 . 0 0 "[ . 1 . 2]" 1
2073 1 81 ASP HA 1 82 VAL HA . . 5.430 4.496 4.405 4.565 . 0 0 "[ . 1 . 2]" 1
2074 1 81 ASP HA 1 82 VAL HB . . 4.500 4.480 4.233 4.587 0.087 16 0 "[ . 1 . 2]" 1
2075 1 81 ASP HA 1 84 GLN H . . 4.460 4.279 3.855 4.535 0.075 13 0 "[ . 1 . 2]" 1
2076 1 81 ASP HA 1 86 ARG H . . 5.500 4.628 4.457 4.831 . 0 0 "[ . 1 . 2]" 1
2077 1 81 ASP HB2 1 82 VAL H . . 5.190 4.682 4.475 4.763 . 0 0 "[ . 1 . 2]" 1
2078 1 81 ASP HB2 1 83 GLY H . . 5.500 5.180 4.731 5.549 0.049 17 0 "[ . 1 . 2]" 1
2079 1 81 ASP HB2 1 84 GLN H . . 5.500 4.640 3.606 5.143 . 0 0 "[ . 1 . 2]" 1
2080 1 81 ASP HB2 1 84 GLN QB . . 5.190 3.932 3.479 4.506 . 0 0 "[ . 1 . 2]" 1
2081 1 81 ASP HB2 1 86 ARG H . . 4.600 3.842 2.695 4.257 . 0 0 "[ . 1 . 2]" 1
2082 1 81 ASP HB2 1 86 ARG HA . . 5.500 5.430 4.348 5.684 0.184 15 0 "[ . 1 . 2]" 1
2083 1 81 ASP HB2 1 86 ARG HB3 . . 4.710 3.086 2.015 4.822 0.112 19 0 "[ . 1 . 2]" 1
2084 1 81 ASP HB2 1 86 ARG HG2 . . 5.500 4.354 2.625 4.916 . 0 0 "[ . 1 . 2]" 1
2085 1 81 ASP HB2 1 88 ASN QD . . 5.500 2.480 1.698 3.856 . 0 0 "[ . 1 . 2]" 1
2086 1 81 ASP HB3 1 82 VAL H . . 4.810 4.305 3.901 4.510 . 0 0 "[ . 1 . 2]" 1
2087 1 81 ASP HB3 1 83 GLY H . . 5.500 4.242 3.404 4.714 . 0 0 "[ . 1 . 2]" 1
2088 1 81 ASP HB3 1 84 GLN QB . . 5.500 2.749 2.225 3.453 . 0 0 "[ . 1 . 2]" 1
2089 1 81 ASP HB3 1 86 ARG H . . 4.400 2.795 2.125 3.677 . 0 0 "[ . 1 . 2]" 1
2090 1 81 ASP HB3 1 86 ARG HB2 . . 4.980 3.910 2.771 4.634 . 0 0 "[ . 1 . 2]" 1
2091 1 81 ASP HB3 1 86 ARG HB3 . . 5.290 2.590 2.024 3.619 . 0 0 "[ . 1 . 2]" 1
2092 1 81 ASP HB3 1 86 ARG HG2 . . 5.500 4.551 2.308 5.512 0.012 16 0 "[ . 1 . 2]" 1
2093 1 81 ASP HB3 1 88 ASN QD . . 5.500 3.677 2.817 4.814 . 0 0 "[ . 1 . 2]" 1
2094 1 82 VAL H 1 82 VAL HB . . 3.320 2.324 2.122 2.435 . 0 0 "[ . 1 . 2]" 1
2095 1 82 VAL H 1 82 VAL MG1 . . 3.310 2.447 2.142 2.796 . 0 0 "[ . 1 . 2]" 1
2096 1 82 VAL H 1 83 GLY H . . 4.410 2.517 2.199 2.903 . 0 0 "[ . 1 . 2]" 1
2097 1 82 VAL H 1 83 GLY HA2 . . 5.500 5.040 4.732 5.431 . 0 0 "[ . 1 . 2]" 1
2098 1 82 VAL H 1 83 GLY HA3 . . 5.500 4.753 4.512 5.161 . 0 0 "[ . 1 . 2]" 1
2099 1 82 VAL H 1 84 GLN H . . 5.500 4.279 3.777 4.753 . 0 0 "[ . 1 . 2]" 1
2100 1 82 VAL H 1 86 ARG H . . 5.500 4.927 4.850 5.010 . 0 0 "[ . 1 . 2]" 1
2101 1 82 VAL HA 1 82 VAL MG1 . . 3.350 3.231 3.162 3.272 . 0 0 "[ . 1 . 2]" 1
2102 1 82 VAL HA 1 84 GLN H . . 5.500 4.287 3.652 5.383 . 0 0 "[ . 1 . 2]" 1
2103 1 82 VAL HA 1 85 GLN H . . 4.710 3.235 2.723 4.152 . 0 0 "[ . 1 . 2]" 1
2104 1 82 VAL HA 1 85 GLN HA . . 4.730 2.972 2.589 3.650 . 0 0 "[ . 1 . 2]" 1
2105 1 82 VAL HA 1 85 GLN HE21 . . 5.500 5.535 5.160 5.585 0.085 11 0 "[ . 1 . 2]" 1
2106 1 82 VAL HA 1 85 GLN HG2 . . 5.500 3.678 3.323 4.092 . 0 0 "[ . 1 . 2]" 1
2107 1 82 VAL HA 1 85 GLN HG3 . . 5.500 4.218 3.448 5.328 . 0 0 "[ . 1 . 2]" 1
2108 1 82 VAL HA 1 86 ARG H . . 5.210 3.806 3.594 4.253 . 0 0 "[ . 1 . 2]" 1
2109 1 82 VAL HB 1 83 GLY H . . 4.090 4.007 3.754 4.155 0.065 19 0 "[ . 1 . 2]" 1
2110 1 82 VAL HB 1 83 GLY HA2 . . 5.500 5.576 5.504 5.602 0.102 4 0 "[ . 1 . 2]" 1
2111 1 82 VAL MG1 1 83 GLY H . . 4.680 2.698 2.268 3.309 . 0 0 "[ . 1 . 2]" 1
2112 1 82 VAL MG1 1 83 GLY HA2 . . 5.390 3.249 3.020 3.774 . 0 0 "[ . 1 . 2]" 1
2113 1 82 VAL MG1 1 84 GLN H . . 5.500 4.634 4.306 5.406 . 0 0 "[ . 1 . 2]" 1
2114 1 82 VAL MG1 1 85 GLN H . . 5.480 4.814 4.657 5.091 . 0 0 "[ . 1 . 2]" 1
2115 1 82 VAL MG1 1 85 GLN HA . . 5.500 5.452 5.269 5.590 0.090 17 0 "[ . 1 . 2]" 1
2116 1 82 VAL MG1 1 85 GLN HG2 . . 5.500 5.514 5.193 5.620 0.120 2 0 "[ . 1 . 2]" 1
2117 1 82 VAL MG1 1 85 GLN HG3 . . 5.500 5.433 4.951 5.595 0.095 2 0 "[ . 1 . 2]" 1
2118 1 83 GLY H 1 84 GLN H . . 4.090 2.445 2.232 2.712 . 0 0 "[ . 1 . 2]" 1
2119 1 83 GLY H 1 84 GLN HA . . 5.500 5.141 4.945 5.372 . 0 0 "[ . 1 . 2]" 1
2120 1 83 GLY H 1 84 GLN QB . . 5.500 4.456 4.056 4.882 . 0 0 "[ . 1 . 2]" 1
2121 1 83 GLY H 1 84 GLN HG2 . . 5.500 5.060 4.320 5.603 0.103 15 0 "[ . 1 . 2]" 1
2122 1 83 GLY H 1 84 GLN HG3 . . 5.500 5.241 4.333 5.577 0.077 9 0 "[ . 1 . 2]" 1
2123 1 83 GLY H 1 85 GLN H . . 5.390 3.610 2.868 4.069 . 0 0 "[ . 1 . 2]" 1
2124 1 83 GLY HA2 1 84 GLN HG2 . . 5.500 5.061 4.545 5.573 0.073 19 0 "[ . 1 . 2]" 1
2125 1 83 GLY HA2 1 85 GLN H . . 5.500 4.003 3.516 4.342 . 0 0 "[ . 1 . 2]" 1
2126 1 83 GLY HA3 1 85 GLN H . . 5.500 4.424 3.913 4.659 . 0 0 "[ . 1 . 2]" 1
2127 1 84 GLN H 1 84 GLN HG2 . . 4.110 3.184 2.544 3.910 . 0 0 "[ . 1 . 2]" 1
2128 1 84 GLN H 1 84 GLN HG3 . . 4.200 3.450 2.460 4.157 . 0 0 "[ . 1 . 2]" 1
2129 1 84 GLN H 1 85 GLN H . . 3.900 2.359 1.929 2.991 . 0 0 "[ . 1 . 2]" 1
2130 1 84 GLN H 1 85 GLN HA . . 5.140 4.364 3.909 5.200 0.060 4 0 "[ . 1 . 2]" 1
2131 1 84 GLN H 1 85 GLN HG3 . . 5.500 4.995 4.275 5.558 0.058 13 0 "[ . 1 . 2]" 1
2132 1 84 GLN H 1 86 ARG H . . 5.250 4.245 3.801 5.089 . 0 0 "[ . 1 . 2]" 1
2133 1 84 GLN HA 1 84 GLN HE21 . . 5.500 4.234 2.376 5.326 . 0 0 "[ . 1 . 2]" 1
2134 1 84 GLN HA 1 84 GLN HG2 . . 4.100 2.506 2.262 2.896 . 0 0 "[ . 1 . 2]" 1
2135 1 84 GLN HA 1 84 GLN HG3 . . 3.700 3.590 3.264 3.757 0.057 11 0 "[ . 1 . 2]" 1
2136 1 84 GLN HA 1 85 GLN HG3 . . 5.500 4.773 3.931 5.525 0.025 9 0 "[ . 1 . 2]" 1
2137 1 84 GLN HA 1 86 ARG H . . 5.500 5.520 5.261 5.584 0.084 10 0 "[ . 1 . 2]" 1
2138 1 84 GLN QB 1 85 GLN H . . 5.500 3.505 3.043 3.807 . 0 0 "[ . 1 . 2]" 1
2139 1 84 GLN QB 1 86 ARG H . . 5.500 4.103 3.430 4.574 . 0 0 "[ . 1 . 2]" 1
2140 1 84 GLN QB 1 86 ARG HB2 . . 5.500 3.567 2.968 5.095 . 0 0 "[ . 1 . 2]" 1
2141 1 84 GLN QB 1 86 ARG HB3 . . 5.500 3.419 2.871 4.181 . 0 0 "[ . 1 . 2]" 1
2142 1 84 GLN QB 1 86 ARG HD2 . . 5.500 4.531 2.710 5.887 0.387 2 0 "[ . 1 . 2]" 1
2143 1 84 GLN QB 1 86 ARG HE . . 5.500 4.118 2.559 4.992 . 0 0 "[ . 1 . 2]" 1
2144 1 85 GLN H 1 85 GLN HG2 . . 4.210 3.480 3.127 3.716 . 0 0 "[ . 1 . 2]" 1
2145 1 85 GLN H 1 85 GLN HG3 . . 4.140 2.906 2.291 3.456 . 0 0 "[ . 1 . 2]" 1
2146 1 85 GLN H 1 86 ARG H . . 3.880 3.187 2.858 3.564 . 0 0 "[ . 1 . 2]" 1
2147 1 85 GLN HA 1 85 GLN HG2 . . 3.950 2.258 2.090 2.430 . 0 0 "[ . 1 . 2]" 1
2148 1 85 GLN HA 1 85 GLN HG3 . . 3.940 2.923 2.656 3.131 . 0 0 "[ . 1 . 2]" 1
2149 1 85 GLN HA 1 86 ARG HB2 . . 5.500 4.879 4.485 5.624 0.124 19 0 "[ . 1 . 2]" 1
2150 1 85 GLN HA 1 86 ARG HB3 . . 5.500 4.962 4.530 5.315 . 0 0 "[ . 1 . 2]" 1
2151 1 85 GLN HB2 1 86 ARG H . . 5.500 4.630 4.560 4.680 . 0 0 "[ . 1 . 2]" 1
2152 1 85 GLN HB3 1 85 GLN HE22 . . 5.110 4.020 3.416 4.289 . 0 0 "[ . 1 . 2]" 1
2153 1 85 GLN HB3 1 86 ARG H . . 5.500 4.326 4.233 4.438 . 0 0 "[ . 1 . 2]" 1
2154 1 85 GLN HG2 1 86 ARG H . . 5.430 4.584 4.164 4.894 . 0 0 "[ . 1 . 2]" 1
2155 1 85 GLN HG3 1 86 ARG H . . 5.430 5.120 4.831 5.396 . 0 0 "[ . 1 . 2]" 1
2156 1 86 ARG H 1 86 ARG HB2 . . 4.150 3.353 2.906 4.068 . 0 0 "[ . 1 . 2]" 1
2157 1 86 ARG H 1 86 ARG HG2 . . 5.230 4.527 3.190 4.848 . 0 0 "[ . 1 . 2]" 1
2158 1 86 ARG H 1 86 ARG HG3 . . 5.100 4.875 4.514 5.012 . 0 0 "[ . 1 . 2]" 1
2159 1 86 ARG H 1 87 LEU H . . 5.500 4.349 4.028 4.446 . 0 0 "[ . 1 . 2]" 1
2160 1 86 ARG HA 1 86 ARG HD2 . . 5.500 4.723 4.571 4.943 . 0 0 "[ . 1 . 2]" 1
2161 1 86 ARG HA 1 86 ARG HD3 . . 5.500 4.752 4.088 5.404 . 0 0 "[ . 1 . 2]" 1
2162 1 86 ARG HA 1 87 LEU H . . 3.450 2.242 2.009 2.525 . 0 0 "[ . 1 . 2]" 1
2163 1 86 ARG HA 1 87 LEU HA . . 5.500 4.382 4.289 4.494 . 0 0 "[ . 1 . 2]" 1
2164 1 86 ARG HA 1 87 LEU HB2 . . 5.500 4.329 3.990 4.589 . 0 0 "[ . 1 . 2]" 1
2165 1 86 ARG HA 1 87 LEU QD . . 5.500 5.153 5.097 5.199 . 0 0 "[ . 1 . 2]" 1
2166 1 86 ARG HB2 1 86 ARG HD2 . . 4.210 3.225 2.795 3.843 . 0 0 "[ . 1 . 2]" 1
2167 1 86 ARG HB2 1 86 ARG HE . . 5.120 2.762 2.104 4.125 . 0 0 "[ . 1 . 2]" 1
2168 1 86 ARG HB2 1 87 LEU H . . 4.760 3.932 2.811 4.349 . 0 0 "[ . 1 . 2]" 1
2169 1 86 ARG HB3 1 86 ARG HE . . 5.350 3.059 1.969 3.897 . 0 0 "[ . 1 . 2]" 1
2170 1 86 ARG HB3 1 87 LEU H . . 4.860 3.875 3.266 4.386 . 0 0 "[ . 1 . 2]" 1
2171 1 86 ARG HB3 1 88 ASN QD . . 5.500 3.589 2.358 4.714 . 0 0 "[ . 1 . 2]" 1
2172 1 86 ARG HD2 1 88 ASN QD . . 5.500 3.392 2.183 4.421 . 0 0 "[ . 1 . 2]" 1
2173 1 86 ARG HD3 1 88 ASN QD . . 5.500 3.850 1.866 4.813 . 0 0 "[ . 1 . 2]" 1
2174 1 86 ARG HG2 1 87 LEU H . . 4.890 2.625 2.016 3.820 . 0 0 "[ . 1 . 2]" 1
2175 1 86 ARG HG2 1 88 ASN QD . . 5.500 3.554 2.508 4.602 . 0 0 "[ . 1 . 2]" 1
2176 1 86 ARG HG3 1 87 LEU H . . 5.030 2.838 2.445 3.289 . 0 0 "[ . 1 . 2]" 1
2177 1 87 LEU HA 1 87 LEU QD . . 3.610 2.014 1.959 2.062 . 0 0 "[ . 1 . 2]" 1
2178 1 87 LEU HA 1 88 ASN H . . 3.460 2.226 2.116 2.355 . 0 0 "[ . 1 . 2]" 1
2179 1 87 LEU HA 1 88 ASN HB2 . . 5.500 4.416 4.100 4.664 . 0 0 "[ . 1 . 2]" 1
2180 1 87 LEU HB3 1 88 ASN H . . 5.390 4.306 3.523 4.547 . 0 0 "[ . 1 . 2]" 1
2181 1 87 LEU QD 1 88 ASN H . . 3.750 2.672 2.162 3.037 . 0 0 "[ . 1 . 2]" 1
2182 1 87 LEU QD 1 88 ASN HA . . 5.500 4.379 3.822 4.787 . 0 0 "[ . 1 . 2]" 1
2183 1 87 LEU QD 1 88 ASN HB2 . . 5.500 4.436 4.080 4.837 . 0 0 "[ . 1 . 2]" 1
2184 1 87 LEU QD 1 88 ASN HB3 . . 5.500 5.246 4.892 5.416 . 0 0 "[ . 1 . 2]" 1
2185 1 87 LEU QD 1 89 LEU QD . . 2.840 1.876 1.701 2.021 . 0 0 "[ . 1 . 2]" 1
2186 1 87 LEU QD 1 89 LEU HG . . 5.300 2.889 2.188 3.676 . 0 0 "[ . 1 . 2]" 1
2187 1 87 LEU HG 1 88 ASN H . . 5.020 4.015 2.947 5.090 0.070 17 0 "[ . 1 . 2]" 1
2188 1 88 ASN H 1 88 ASN HB2 . . 4.170 2.346 2.235 2.584 . 0 0 "[ . 1 . 2]" 1
2189 1 88 ASN H 1 88 ASN QD . . 5.410 3.506 2.542 4.391 . 0 0 "[ . 1 . 2]" 1
2190 1 88 ASN H 1 89 LEU H . . 4.820 4.238 3.918 4.547 . 0 0 "[ . 1 . 2]" 1
2191 1 88 ASN H 1 89 LEU QD . . 5.500 3.880 2.786 4.691 . 0 0 "[ . 1 . 2]" 1
2192 1 88 ASN HA 1 89 LEU H . . 3.240 2.234 2.144 2.322 . 0 0 "[ . 1 . 2]" 1
2193 1 88 ASN HB2 1 89 LEU H . . 5.260 4.471 4.045 4.682 . 0 0 "[ . 1 . 2]" 1
2194 1 88 ASN HB3 1 89 LEU H . . 4.820 3.678 2.903 4.089 . 0 0 "[ . 1 . 2]" 1
2195 1 89 LEU H 1 89 LEU HB2 . . 4.120 2.626 2.453 2.951 . 0 0 "[ . 1 . 2]" 1
2196 1 89 LEU H 1 89 LEU QD . . 4.750 2.946 2.103 3.554 . 0 0 "[ . 1 . 2]" 1
2197 1 89 LEU H 1 89 LEU HG . . 4.120 3.108 2.371 4.178 0.058 7 0 "[ . 1 . 2]" 1
2198 1 89 LEU H 1 90 THR H . . 5.500 4.506 4.313 4.621 . 0 0 "[ . 1 . 2]" 1
2199 1 89 LEU HB2 1 90 THR H . . 4.960 3.678 3.398 3.924 . 0 0 "[ . 1 . 2]" 1
2200 1 89 LEU HB3 1 90 THR H . . 4.310 2.712 2.436 2.937 . 0 0 "[ . 1 . 2]" 1
2201 1 89 LEU HB3 1 90 THR HA . . 5.500 4.506 4.258 4.863 . 0 0 "[ . 1 . 2]" 1
2202 1 89 LEU HB3 1 90 THR HB . . 5.500 5.416 5.177 5.560 0.060 15 0 "[ . 1 . 2]" 1
2203 1 89 LEU QD 1 90 THR H . . 4.520 3.730 3.462 4.073 . 0 0 "[ . 1 . 2]" 1
2204 1 89 LEU HG 1 90 THR H . . 5.500 5.003 4.710 5.241 . 0 0 "[ . 1 . 2]" 1
2205 1 90 THR H 1 90 THR MG . . 4.170 3.915 3.817 3.997 . 0 0 "[ . 1 . 2]" 1
2206 1 90 THR H 1 91 ILE H . . 5.050 4.328 4.283 4.400 . 0 0 "[ . 1 . 2]" 1
2207 1 90 THR H 1 91 ILE HG12 . . 5.500 4.493 4.291 4.745 . 0 0 "[ . 1 . 2]" 1
2208 1 90 THR H 1 91 ILE HG13 . . 5.500 3.760 3.536 4.038 . 0 0 "[ . 1 . 2]" 1
2209 1 90 THR HA 1 90 THR MG . . 3.380 2.399 2.277 2.512 . 0 0 "[ . 1 . 2]" 1
2210 1 90 THR HA 1 91 ILE H . . 3.100 2.288 2.214 2.378 . 0 0 "[ . 1 . 2]" 1
2211 1 90 THR HA 1 91 ILE HA . . 5.500 4.533 4.479 4.603 . 0 0 "[ . 1 . 2]" 1
2212 1 90 THR HA 1 91 ILE HB . . 5.270 4.675 4.432 4.945 . 0 0 "[ . 1 . 2]" 1
2213 1 90 THR HA 1 91 ILE HG12 . . 5.500 5.143 4.955 5.342 . 0 0 "[ . 1 . 2]" 1
2214 1 90 THR HA 1 91 ILE HG13 . . 5.500 3.907 3.752 4.119 . 0 0 "[ . 1 . 2]" 1
2215 1 90 THR HB 1 91 ILE H . . 4.250 4.012 3.882 4.164 . 0 0 "[ . 1 . 2]" 1
2216 1 90 THR HB 1 91 ILE HG12 . . 5.500 5.556 5.335 5.663 0.163 11 0 "[ . 1 . 2]" 1
2217 1 90 THR HB 1 91 ILE HG13 . . 5.500 5.187 5.039 5.404 . 0 0 "[ . 1 . 2]" 1
2218 1 90 THR MG 1 91 ILE H . . 3.780 2.515 2.374 2.642 . 0 0 "[ . 1 . 2]" 1
2219 1 90 THR MG 1 91 ILE HB . . 5.500 4.877 4.682 5.131 . 0 0 "[ . 1 . 2]" 1
2220 1 90 THR MG 1 92 PRO HA . . 5.500 4.362 3.783 4.747 . 0 0 "[ . 1 . 2]" 1
2221 1 90 THR MG 1 92 PRO QD . . 5.500 3.515 3.271 3.832 . 0 0 "[ . 1 . 2]" 1
2222 1 90 THR MG 1 92 PRO QG . . 5.500 4.754 3.900 5.228 . 0 0 "[ . 1 . 2]" 1
2223 1 91 ILE H 1 91 ILE HB . . 3.920 2.917 2.779 3.091 . 0 0 "[ . 1 . 2]" 1
2224 1 91 ILE H 1 91 ILE MD . . 5.500 4.459 4.304 4.589 . 0 0 "[ . 1 . 2]" 1
2225 1 91 ILE H 1 91 ILE HG12 . . 5.040 4.177 4.050 4.294 . 0 0 "[ . 1 . 2]" 1
2226 1 91 ILE H 1 91 ILE HG13 . . 4.780 3.283 3.171 3.431 . 0 0 "[ . 1 . 2]" 1
2227 1 91 ILE H 1 91 ILE MG . . 4.720 3.975 3.909 4.060 . 0 0 "[ . 1 . 2]" 1
2228 1 91 ILE H 1 92 PRO QD . . 5.500 4.042 3.911 4.189 . 0 0 "[ . 1 . 2]" 1
2229 1 91 ILE HA 1 91 ILE MD . . 4.720 3.864 3.775 4.019 . 0 0 "[ . 1 . 2]" 1
2230 1 91 ILE HA 1 91 ILE HG12 . . 4.250 2.547 2.400 2.787 . 0 0 "[ . 1 . 2]" 1
2231 1 91 ILE HA 1 92 PRO HB2 . . 5.500 5.514 5.147 5.674 0.174 13 0 "[ . 1 . 2]" 1
2232 1 91 ILE HA 1 92 PRO QD . . 3.650 2.041 2.010 2.074 . 0 0 "[ . 1 . 2]" 1
2233 1 91 ILE HA 1 92 PRO QG . . 4.890 3.973 3.940 4.020 . 0 0 "[ . 1 . 2]" 1
2234 1 91 ILE HA 1 95 PHE QD . . 5.500 5.058 4.541 5.336 . 0 0 "[ . 1 . 2]" 1
2235 1 91 ILE HB 1 92 PRO QD . . 5.500 4.103 3.708 4.342 . 0 0 "[ . 1 . 2]" 1
2236 1 91 ILE HB 1 96 MET HG2 . . 5.160 3.778 3.030 5.662 0.502 17 1 "[ . 1 . + 2]" 1
2237 1 91 ILE MD 1 91 ILE MG . . 3.930 2.058 2.002 2.128 . 0 0 "[ . 1 . 2]" 1
2238 1 91 ILE MD 1 92 PRO QD . . 5.500 4.523 4.354 4.825 . 0 0 "[ . 1 . 2]" 1
2239 1 91 ILE MD 1 96 MET HG2 . . 5.500 4.000 2.690 5.777 0.277 17 0 "[ . 1 . 2]" 1
2240 1 91 ILE HG12 1 91 ILE MG . . 3.380 2.413 2.306 2.489 . 0 0 "[ . 1 . 2]" 1
2241 1 91 ILE HG12 1 92 PRO QD . . 5.500 3.836 3.606 4.140 . 0 0 "[ . 1 . 2]" 1
2242 1 91 ILE HG12 1 95 PHE QB . . 5.500 5.168 4.706 5.350 . 0 0 "[ . 1 . 2]" 1
2243 1 91 ILE HG13 1 92 PRO QD . . 5.500 4.707 4.579 4.867 . 0 0 "[ . 1 . 2]" 1
2244 1 91 ILE MG 1 92 PRO QD . . 4.020 2.317 1.956 2.680 . 0 0 "[ . 1 . 2]" 1
2245 1 91 ILE MG 1 92 PRO QG . . 5.500 3.681 3.229 4.319 . 0 0 "[ . 1 . 2]" 1
2246 1 91 ILE MG 1 93 GLN H . . 5.500 4.700 2.528 5.067 . 0 0 "[ . 1 . 2]" 1
2247 1 91 ILE MG 1 95 PHE H . . 4.420 3.362 2.908 3.564 . 0 0 "[ . 1 . 2]" 1
2248 1 91 ILE MG 1 95 PHE HA . . 5.500 4.645 4.240 4.814 . 0 0 "[ . 1 . 2]" 1
2249 1 91 ILE MG 1 95 PHE QB . . 3.560 2.559 2.258 2.811 . 0 0 "[ . 1 . 2]" 1
2250 1 91 ILE MG 1 95 PHE QD . . 4.380 3.336 2.937 3.649 . 0 0 "[ . 1 . 2]" 1
2251 1 91 ILE MG 1 96 MET HA . . 5.500 3.671 3.157 3.990 . 0 0 "[ . 1 . 2]" 1
2252 1 91 ILE MG 1 96 MET HB3 . . 5.500 4.665 3.671 5.401 . 0 0 "[ . 1 . 2]" 1
2253 1 91 ILE MG 1 96 MET HG2 . . 5.500 2.889 2.185 5.232 . 0 0 "[ . 1 . 2]" 1
2254 1 91 ILE MG 1 96 MET HG3 . . 5.400 2.870 2.079 4.937 . 0 0 "[ . 1 . 2]" 1
2255 1 92 PRO HA 1 93 GLN H . . 3.250 2.378 2.177 3.085 . 0 0 "[ . 1 . 2]" 1
2256 1 92 PRO HA 1 93 GLN HA . . 4.750 4.425 4.229 4.840 0.090 11 0 "[ . 1 . 2]" 1
2257 1 92 PRO HA 1 93 GLN HG2 . . 5.140 4.359 3.508 5.729 0.589 9 2 "[ . +1 . - 2]" 1
2258 1 92 PRO HA 1 94 ALA H . . 5.120 4.022 3.739 4.225 . 0 0 "[ . 1 . 2]" 1
2259 1 92 PRO HA 1 94 ALA MB . . 5.500 4.970 4.710 5.433 . 0 0 "[ . 1 . 2]" 1
2260 1 92 PRO HA 1 95 PHE QD . . 5.500 5.443 5.138 5.566 0.066 11 0 "[ . 1 . 2]" 1
2261 1 92 PRO HB2 1 94 ALA H . . 5.490 2.510 2.041 3.491 . 0 0 "[ . 1 . 2]" 1
2262 1 92 PRO HB2 1 94 ALA MB . . 4.440 2.816 2.338 3.202 . 0 0 "[ . 1 . 2]" 1
2263 1 92 PRO HB2 1 95 PHE H . . 5.500 4.010 3.347 4.919 . 0 0 "[ . 1 . 2]" 1
2264 1 92 PRO HB2 1 95 PHE QD . . 4.940 3.779 2.644 4.609 . 0 0 "[ . 1 . 2]" 1
2265 1 92 PRO HB2 1 95 PHE QE . . 5.260 4.435 3.702 4.864 . 0 0 "[ . 1 . 2]" 1
2266 1 92 PRO HB3 1 93 GLN H . . 4.370 3.581 2.906 4.734 0.364 13 0 "[ . 1 . 2]" 1
2267 1 92 PRO HB3 1 94 ALA H . . 5.180 3.949 3.041 4.834 . 0 0 "[ . 1 . 2]" 1
2268 1 92 PRO HB3 1 94 ALA MB . . 5.070 4.130 3.323 4.602 . 0 0 "[ . 1 . 2]" 1
2269 1 92 PRO HB3 1 95 PHE H . . 5.500 5.433 4.930 5.594 0.094 13 0 "[ . 1 . 2]" 1
2270 1 92 PRO HB3 1 95 PHE QD . . 5.110 4.887 4.330 5.159 0.049 15 0 "[ . 1 . 2]" 1
2271 1 92 PRO HB3 1 95 PHE QE . . 5.500 5.283 4.581 5.528 0.028 5 0 "[ . 1 . 2]" 1
2272 1 92 PRO QD 1 93 GLN H . . 5.500 4.849 3.598 5.016 . 0 0 "[ . 1 . 2]" 1
2273 1 92 PRO QD 1 95 PHE QB . . 5.500 3.644 3.268 4.110 . 0 0 "[ . 1 . 2]" 1
2274 1 92 PRO QD 1 95 PHE QD . . 4.810 2.815 2.249 3.090 . 0 0 "[ . 1 . 2]" 1
2275 1 92 PRO QD 1 95 PHE QE . . 5.020 4.017 3.505 4.359 . 0 0 "[ . 1 . 2]" 1
2276 1 92 PRO QG 1 93 GLN H . . 5.500 4.444 3.819 4.702 . 0 0 "[ . 1 . 2]" 1
2277 1 92 PRO QG 1 94 ALA MB . . 5.500 2.974 2.160 4.418 . 0 0 "[ . 1 . 2]" 1
2278 1 92 PRO QG 1 95 PHE QD . . 4.250 2.376 1.960 3.151 . 0 0 "[ . 1 . 2]" 1
2279 1 92 PRO QG 1 95 PHE QE . . 4.370 2.787 2.286 3.106 . 0 0 "[ . 1 . 2]" 1
2280 1 93 GLN H 1 93 GLN HB2 . . 3.430 2.379 2.180 3.469 0.039 13 0 "[ . 1 . 2]" 1
2281 1 93 GLN H 1 93 GLN HB3 . . 3.450 3.522 3.508 3.551 0.101 11 0 "[ . 1 . 2]" 1
2282 1 93 GLN H 1 93 GLN HG2 . . 3.990 2.685 2.203 3.858 . 0 0 "[ . 1 . 2]" 1
2283 1 93 GLN H 1 94 ALA H . . 4.040 2.801 2.557 3.291 . 0 0 "[ . 1 . 2]" 1
2284 1 93 GLN H 1 94 ALA HA . . 5.500 5.376 5.156 5.596 0.096 13 0 "[ . 1 . 2]" 1
2285 1 93 GLN H 1 94 ALA MB . . 5.300 4.423 4.218 4.739 . 0 0 "[ . 1 . 2]" 1
2286 1 93 GLN H 1 95 PHE H . . 5.500 4.462 3.739 4.629 . 0 0 "[ . 1 . 2]" 1
2287 1 93 GLN HA 1 93 GLN QE . . 4.080 2.497 1.982 3.199 . 0 0 "[ . 1 . 2]" 1
2288 1 93 GLN HA 1 93 GLN HG2 . . 3.410 2.931 2.496 3.717 0.307 17 0 "[ . 1 . 2]" 1
2289 1 93 GLN HA 1 94 ALA HA . . 5.350 4.874 4.656 4.993 . 0 0 "[ . 1 . 2]" 1
2290 1 93 GLN HA 1 94 ALA MB . . 5.260 4.906 4.760 4.977 . 0 0 "[ . 1 . 2]" 1
2291 1 93 GLN HA 1 95 PHE H . . 4.890 3.629 3.214 4.239 . 0 0 "[ . 1 . 2]" 1
2292 1 93 GLN HA 1 96 MET H . . 4.360 3.784 3.111 4.414 0.054 11 0 "[ . 1 . 2]" 1
2293 1 93 GLN HA 1 96 MET HA . . 5.500 5.069 4.545 5.562 0.062 11 0 "[ . 1 . 2]" 1
2294 1 93 GLN HA 1 96 MET HB3 . . 4.860 3.856 2.493 4.581 . 0 0 "[ . 1 . 2]" 1
2295 1 93 GLN HA 1 96 MET HG3 . . 4.580 3.053 2.190 5.442 0.862 17 1 "[ . 1 . + 2]" 1
2296 1 93 GLN HB2 1 94 ALA H . . 3.910 3.196 2.868 3.941 0.031 11 0 "[ . 1 . 2]" 1
2297 1 93 GLN HB2 1 94 ALA HA . . 5.330 4.722 4.528 5.004 . 0 0 "[ . 1 . 2]" 1
2298 1 93 GLN HB2 1 94 ALA MB . . 5.350 4.540 4.070 4.849 . 0 0 "[ . 1 . 2]" 1
2299 1 93 GLN HB3 1 94 ALA H . . 4.340 3.873 3.574 4.413 0.073 11 0 "[ . 1 . 2]" 1
2300 1 93 GLN HB3 1 94 ALA HA . . 5.250 4.585 4.039 5.207 . 0 0 "[ . 1 . 2]" 1
2301 1 93 GLN HB3 1 94 ALA MB . . 5.500 5.056 4.306 5.555 0.055 11 0 "[ . 1 . 2]" 1
2302 1 93 GLN QE 1 94 ALA H . . 5.500 5.229 4.752 5.392 . 0 0 "[ . 1 . 2]" 1
2303 1 93 GLN QE 1 96 MET HB3 . . 5.500 3.531 2.596 5.401 . 0 0 "[ . 1 . 2]" 1
2304 1 93 GLN HG2 1 94 ALA H . . 4.880 4.862 4.495 5.427 0.547 18 1 "[ . 1 . + 2]" 1
2305 1 94 ALA H 1 94 ALA MB . . 3.250 2.230 2.138 2.396 . 0 0 "[ . 1 . 2]" 1
2306 1 94 ALA H 1 95 PHE H . . 3.910 2.748 2.233 2.951 . 0 0 "[ . 1 . 2]" 1
2307 1 94 ALA H 1 95 PHE QE . . 5.500 5.293 4.825 5.478 . 0 0 "[ . 1 . 2]" 1
2308 1 94 ALA H 1 96 MET H . . 5.500 4.804 4.250 5.153 . 0 0 "[ . 1 . 2]" 1
2309 1 94 ALA HA 1 95 PHE HA . . 5.500 4.549 4.282 4.632 . 0 0 "[ . 1 . 2]" 1
2310 1 94 ALA HA 1 95 PHE QD . . 5.500 4.973 4.748 5.277 . 0 0 "[ . 1 . 2]" 1
2311 1 94 ALA HA 1 96 MET H . . 5.020 4.425 3.712 4.854 . 0 0 "[ . 1 . 2]" 1
2312 1 94 ALA MB 1 95 PHE H . . 3.920 2.929 2.408 3.524 . 0 0 "[ . 1 . 2]" 1
2313 1 94 ALA MB 1 95 PHE HA . . 4.910 4.199 3.793 4.383 . 0 0 "[ . 1 . 2]" 1
2314 1 94 ALA MB 1 95 PHE QB . . 5.300 4.080 3.857 4.753 . 0 0 "[ . 1 . 2]" 1
2315 1 94 ALA MB 1 95 PHE QD . . 4.320 2.792 2.494 3.907 . 0 0 "[ . 1 . 2]" 1
2316 1 94 ALA MB 1 95 PHE QE . . 4.610 3.066 2.595 4.255 . 0 0 "[ . 1 . 2]" 1
2317 1 94 ALA MB 1 95 PHE HZ . . 5.500 4.066 3.474 5.156 . 0 0 "[ . 1 . 2]" 1
2318 1 94 ALA MB 1 96 MET H . . 5.000 4.904 4.416 5.087 0.087 3 0 "[ . 1 . 2]" 1
2319 1 95 PHE H 1 95 PHE QB . . 3.700 2.735 2.465 2.875 . 0 0 "[ . 1 . 2]" 1
2320 1 95 PHE H 1 95 PHE QD . . 4.150 2.849 2.448 3.205 . 0 0 "[ . 1 . 2]" 1
2321 1 95 PHE H 1 96 MET HA . . 5.500 4.730 4.494 5.153 . 0 0 "[ . 1 . 2]" 1
2322 1 95 PHE HA 1 95 PHE QD . . 4.170 3.035 2.795 3.241 . 0 0 "[ . 1 . 2]" 1
2323 1 95 PHE HA 1 96 MET HA . . 5.500 4.496 4.376 4.610 . 0 0 "[ . 1 . 2]" 1
2324 1 95 PHE QB 1 96 MET H . . 5.340 3.974 3.906 4.046 . 0 0 "[ . 1 . 2]" 1
2325 1 95 PHE QD 1 96 MET H . . 5.500 5.093 4.978 5.155 . 0 0 "[ . 1 . 2]" 1
2326 1 96 MET H 1 96 MET HB3 . . 3.610 3.563 2.736 3.825 0.215 11 0 "[ . 1 . 2]" 1
2327 1 96 MET H 1 97 SER H . . 4.850 4.330 3.900 4.528 . 0 0 "[ . 1 . 2]" 1
2328 1 96 MET H 1 97 SER HA . . 5.500 5.258 4.949 5.553 0.053 8 0 "[ . 1 . 2]" 1
2329 1 96 MET HA 1 96 MET ME . . 4.750 3.692 3.296 4.522 . 0 0 "[ . 1 . 2]" 1
2330 1 96 MET HA 1 97 SER H . . 3.470 2.221 2.121 2.535 . 0 0 "[ . 1 . 2]" 1
2331 1 96 MET HA 1 97 SER HA . . 5.270 4.475 4.242 4.649 . 0 0 "[ . 1 . 2]" 1
2332 1 96 MET HA 1 97 SER QB . . 5.290 4.298 4.021 4.821 . 0 0 "[ . 1 . 2]" 1
2333 1 96 MET HB3 1 96 MET ME . . 5.060 2.761 2.191 4.240 . 0 0 "[ . 1 . 2]" 1
2334 1 96 MET HB3 1 97 SER H . . 4.180 3.420 2.556 4.396 0.216 17 0 "[ . 1 . 2]" 1
2335 1 96 MET HB3 1 97 SER HA . . 5.500 4.317 3.818 4.886 . 0 0 "[ . 1 . 2]" 1
2336 1 96 MET ME 1 97 SER H . . 4.910 4.347 3.879 4.990 0.080 17 0 "[ . 1 . 2]" 1
2337 1 96 MET HG2 1 97 SER H . . 5.500 4.204 3.479 4.926 . 0 0 "[ . 1 . 2]" 1
2338 1 96 MET HG3 1 97 SER H . . 5.500 4.857 3.239 5.544 0.044 12 0 "[ . 1 . 2]" 1
2339 1 97 SER H 1 97 SER QB . . 3.650 2.985 2.839 3.182 . 0 0 "[ . 1 . 2]" 1
2340 1 97 SER HA 1 98 ASN QB . . 5.500 4.503 4.077 4.822 . 0 0 "[ . 1 . 2]" 1
2341 1 97 SER QB 1 98 ASN QB . . 5.500 4.634 4.119 4.984 . 0 0 "[ . 1 . 2]" 1
2342 1 97 SER QB 1 99 ARG QB . . 5.500 4.241 2.542 4.990 . 0 0 "[ . 1 . 2]" 1
2343 1 97 SER QB 1 99 ARG QG . . 5.500 2.626 2.048 4.543 . 0 0 "[ . 1 . 2]" 1
2344 1 98 ASN HA 1 100 ALA H . . 5.280 5.159 4.565 5.366 0.086 3 0 "[ . 1 . 2]" 1
2345 1 98 ASN QB 1 99 ARG H . . 5.170 2.534 1.833 3.707 . 0 0 "[ . 1 . 2]" 1
2346 1 98 ASN QB 1 99 ARG HA . . 5.480 3.777 3.556 4.119 . 0 0 "[ . 1 . 2]" 1
2347 1 98 ASN QB 1 99 ARG QB . . 5.500 3.993 3.796 4.270 . 0 0 "[ . 1 . 2]" 1
2348 1 98 ASN QB 1 99 ARG QG . . 5.500 4.172 2.879 5.133 . 0 0 "[ . 1 . 2]" 1
2349 1 99 ARG HA 1 99 ARG QG . . 3.820 3.326 2.211 3.513 . 0 0 "[ . 1 . 2]" 1
2350 1 99 ARG HA 1 100 ALA MB . . 5.460 4.146 3.943 4.362 . 0 0 "[ . 1 . 2]" 1
2351 1 99 ARG QB 1 100 ALA H . . 5.460 3.744 3.408 4.089 . 0 0 "[ . 1 . 2]" 1
2352 1 99 ARG QG 1 100 ALA HA . . 5.500 4.768 4.429 5.413 . 0 0 "[ . 1 . 2]" 1
2353 1 100 ALA H 1 103 TYR HA . . 5.500 5.347 4.556 5.589 0.089 17 0 "[ . 1 . 2]" 1
2354 1 100 ALA HA 1 101 ARG H . . 3.550 2.984 2.069 3.542 . 0 0 "[ . 1 . 2]" 1
2355 1 100 ALA HA 1 101 ARG HB2 . . 5.500 4.336 3.622 4.683 . 0 0 "[ . 1 . 2]" 1
2356 1 100 ALA MB 1 101 ARG HA . . 5.500 4.245 3.758 4.812 . 0 0 "[ . 1 . 2]" 1
2357 1 100 ALA MB 1 101 ARG HB2 . . 4.440 4.381 3.897 4.577 0.137 5 0 "[ . 1 . 2]" 1
2358 1 100 ALA MB 1 101 ARG HB3 . . 5.500 5.086 4.596 5.567 0.067 1 0 "[ . 1 . 2]" 1
2359 1 100 ALA MB 1 102 GLY H . . 5.500 3.166 2.119 4.632 . 0 0 "[ . 1 . 2]" 1
2360 1 100 ALA MB 1 103 TYR HB2 . . 5.500 3.438 2.214 4.542 . 0 0 "[ . 1 . 2]" 1
2361 1 100 ALA MB 1 103 TYR HB3 . . 5.500 4.423 3.604 5.483 . 0 0 "[ . 1 . 2]" 1
2362 1 100 ALA MB 1 103 TYR HD1 . . 5.500 5.236 4.351 5.602 0.102 12 0 "[ . 1 . 2]" 1
2363 1 101 ARG H 1 101 ARG HD2 . . 5.500 5.065 3.405 5.943 0.443 15 0 "[ . 1 . 2]" 1
2364 1 101 ARG HA 1 101 ARG HD2 . . 4.310 3.335 2.080 4.654 0.344 11 0 "[ . 1 . 2]" 1
2365 1 101 ARG HA 1 101 ARG HD3 . . 4.650 3.221 2.253 4.051 . 0 0 "[ . 1 . 2]" 1
2366 1 101 ARG HA 1 101 ARG HG2 . . 4.200 2.479 2.171 2.954 . 0 0 "[ . 1 . 2]" 1
2367 1 101 ARG HA 1 101 ARG HG3 . . 4.070 3.623 3.088 3.804 . 0 0 "[ . 1 . 2]" 1
2368 1 101 ARG HB2 1 101 ARG HD2 . . 3.620 3.760 2.996 4.239 0.619 15 4 "[ - . * 1 * + 2]" 1
2369 1 101 ARG HB2 1 101 ARG HG2 . . 3.040 2.619 2.458 2.994 . 0 0 "[ . 1 . 2]" 1
2370 1 101 ARG HB2 1 101 ARG HG3 . . 2.950 2.327 2.241 2.411 . 0 0 "[ . 1 . 2]" 1
2371 1 101 ARG HB3 1 101 ARG HD2 . . 3.560 2.839 2.179 3.703 0.143 15 0 "[ . 1 . 2]" 1
2372 1 101 ARG HB3 1 102 GLY HA2 . . 5.500 5.201 4.566 5.579 0.079 14 0 "[ . 1 . 2]" 1
2373 1 102 GLY HA2 1 103 TYR HA . . 5.340 4.890 4.488 5.435 0.095 6 0 "[ . 1 . 2]" 1
2374 1 102 GLY HA2 1 103 TYR HB2 . . 5.500 5.301 4.678 5.975 0.475 5 0 "[ . 1 . 2]" 1
2375 1 102 GLY HA2 1 103 TYR HB3 . . 5.500 4.524 3.888 4.931 . 0 0 "[ . 1 . 2]" 1
2376 1 102 GLY HA2 1 104 ILE MD . . 5.500 4.985 3.968 5.898 0.398 19 0 "[ . 1 . 2]" 1
2377 1 103 TYR H 1 103 TYR HB2 . . 4.080 3.432 2.535 4.040 . 0 0 "[ . 1 . 2]" 1
2378 1 103 TYR H 1 103 TYR HB3 . . 4.040 3.028 2.137 3.800 . 0 0 "[ . 1 . 2]" 1
2379 1 103 TYR H 1 103 TYR HD1 . . 5.240 4.931 4.476 5.236 . 0 0 "[ . 1 . 2]" 1
2380 1 103 TYR H 1 104 ILE H . . 4.820 4.095 3.484 4.585 . 0 0 "[ . 1 . 2]" 1
2381 1 103 TYR HA 1 103 TYR HD1 . . 3.780 3.125 2.293 3.787 0.007 7 0 "[ . 1 . 2]" 1
2382 1 103 TYR HA 1 103 TYR HE1 . . 5.500 5.240 4.578 5.572 0.072 6 0 "[ . 1 . 2]" 1
2383 1 103 TYR HA 1 104 ILE H . . 3.090 2.161 2.044 2.274 . 0 0 "[ . 1 . 2]" 1
2384 1 103 TYR HA 1 104 ILE HA . . 4.750 4.425 4.360 4.504 . 0 0 "[ . 1 . 2]" 1
2385 1 103 TYR HA 1 104 ILE HB . . 5.200 4.424 3.932 4.685 . 0 0 "[ . 1 . 2]" 1
2386 1 103 TYR HA 1 104 ILE MD . . 5.500 4.515 2.646 5.264 . 0 0 "[ . 1 . 2]" 1
2387 1 103 TYR HA 1 104 ILE HG12 . . 5.500 4.344 3.930 5.590 0.090 20 0 "[ . 1 . 2]" 1
2388 1 103 TYR HA 1 104 ILE HG13 . . 5.330 5.390 4.377 5.595 0.265 17 0 "[ . 1 . 2]" 1
2389 1 103 TYR HA 1 104 ILE MG . . 5.500 5.454 5.147 5.572 0.072 10 0 "[ . 1 . 2]" 1
2390 1 103 TYR HB2 1 103 TYR HE1 . . 5.500 5.166 4.789 5.530 0.030 15 0 "[ . 1 . 2]" 1
2391 1 103 TYR HB2 1 104 ILE H . . 4.770 4.009 3.648 4.329 . 0 0 "[ . 1 . 2]" 1
2392 1 103 TYR HB3 1 103 TYR HD1 . . 3.730 3.401 2.579 3.799 0.069 4 0 "[ . 1 . 2]" 1
2393 1 103 TYR HB3 1 103 TYR HE1 . . 5.500 5.241 4.714 5.524 0.024 4 0 "[ . 1 . 2]" 1
2394 1 103 TYR HB3 1 104 ILE H . . 4.980 4.348 3.989 4.553 . 0 0 "[ . 1 . 2]" 1
2395 1 103 TYR HB3 1 104 ILE MD . . 5.500 5.152 4.602 5.577 0.077 16 0 "[ . 1 . 2]" 1
2396 1 103 TYR HD1 1 104 ILE H . . 4.940 2.691 2.032 3.359 . 0 0 "[ . 1 . 2]" 1
2397 1 103 TYR HD1 1 104 ILE HA . . 5.500 3.560 2.776 4.153 . 0 0 "[ . 1 . 2]" 1
2398 1 103 TYR HD1 1 104 ILE HB . . 5.500 5.010 4.462 5.365 . 0 0 "[ . 1 . 2]" 1
2399 1 103 TYR HD1 1 104 ILE MG . . 5.500 5.155 4.897 5.330 . 0 0 "[ . 1 . 2]" 1
2400 1 103 TYR HD1 1 105 PRO HA . . 5.420 4.167 3.759 4.819 . 0 0 "[ . 1 . 2]" 1
2401 1 103 TYR HD1 1 105 PRO HB3 . . 5.500 4.789 4.373 5.541 0.041 14 0 "[ . 1 . 2]" 1
2402 1 103 TYR HD1 1 105 PRO HD2 . . 5.380 5.151 4.446 5.623 0.243 14 0 "[ . 1 . 2]" 1
2403 1 103 TYR HD1 1 105 PRO HD3 . . 5.500 3.864 2.972 4.572 . 0 0 "[ . 1 . 2]" 1
2404 1 103 TYR HD1 1 105 PRO HG3 . . 5.500 5.386 4.891 5.580 0.080 8 0 "[ . 1 . 2]" 1
2405 1 103 TYR HE1 1 104 ILE H . . 5.500 4.238 3.621 4.609 . 0 0 "[ . 1 . 2]" 1
2406 1 103 TYR HE1 1 104 ILE MD . . 5.500 5.594 5.563 5.629 0.129 20 0 "[ . 1 . 2]" 1
2407 1 103 TYR HE1 1 105 PRO HA . . 4.350 2.747 2.125 3.464 . 0 0 "[ . 1 . 2]" 1
2408 1 103 TYR HE1 1 105 PRO HB2 . . 5.500 4.283 3.906 4.904 . 0 0 "[ . 1 . 2]" 1
2409 1 103 TYR HE1 1 105 PRO HB3 . . 4.490 2.678 2.260 3.422 . 0 0 "[ . 1 . 2]" 1
2410 1 103 TYR HE1 1 105 PRO HD2 . . 5.050 4.600 4.079 5.035 . 0 0 "[ . 1 . 2]" 1
2411 1 103 TYR HE1 1 105 PRO HD3 . . 5.500 3.305 2.654 4.070 . 0 0 "[ . 1 . 2]" 1
2412 1 103 TYR HE1 1 105 PRO HG3 . . 4.370 3.830 2.917 4.450 0.080 15 0 "[ . 1 . 2]" 1
2413 1 103 TYR HE1 1 106 PRO HD2 . . 5.270 4.727 4.286 5.302 0.032 1 0 "[ . 1 . 2]" 1
2414 1 103 TYR HE1 1 106 PRO HD3 . . 5.500 4.804 3.799 5.429 . 0 0 "[ . 1 . 2]" 1
2415 1 104 ILE H 1 104 ILE HB . . 3.760 2.714 2.510 2.908 . 0 0 "[ . 1 . 2]" 1
2416 1 104 ILE H 1 104 ILE MD . . 5.110 3.781 2.304 4.333 . 0 0 "[ . 1 . 2]" 1
2417 1 104 ILE H 1 104 ILE HG12 . . 4.620 3.533 3.128 4.669 0.049 11 0 "[ . 1 . 2]" 1
2418 1 104 ILE H 1 104 ILE HG13 . . 4.310 4.319 3.523 4.633 0.323 15 0 "[ . 1 . 2]" 1
2419 1 104 ILE H 1 104 ILE MG . . 4.570 3.849 3.598 3.956 . 0 0 "[ . 1 . 2]" 1
2420 1 104 ILE H 1 105 PRO HD2 . . 5.500 4.905 4.776 5.105 . 0 0 "[ . 1 . 2]" 1
2421 1 104 ILE H 1 105 PRO HD3 . . 5.500 4.373 4.085 4.563 . 0 0 "[ . 1 . 2]" 1
2422 1 104 ILE HA 1 104 ILE MD . . 4.280 2.318 1.980 3.523 . 0 0 "[ . 1 . 2]" 1
2423 1 104 ILE HA 1 104 ILE HG12 . . 4.030 3.023 2.754 3.731 . 0 0 "[ . 1 . 2]" 1
2424 1 104 ILE HA 1 104 ILE MG . . 3.540 2.622 2.452 2.886 . 0 0 "[ . 1 . 2]" 1
2425 1 104 ILE HA 1 105 PRO HB3 . . 5.500 4.947 4.781 5.378 . 0 0 "[ . 1 . 2]" 1
2426 1 104 ILE HA 1 105 PRO HD2 . . 3.300 2.467 2.306 2.744 . 0 0 "[ . 1 . 2]" 1
2427 1 104 ILE HA 1 105 PRO HD3 . . 3.300 2.091 2.002 2.169 . 0 0 "[ . 1 . 2]" 1
2428 1 104 ILE HA 1 105 PRO HG3 . . 4.630 4.344 4.228 4.495 . 0 0 "[ . 1 . 2]" 1
2429 1 104 ILE HA 1 108 LEU HB2 . . 5.500 4.275 3.655 4.756 . 0 0 "[ . 1 . 2]" 1
2430 1 104 ILE HA 1 108 LEU MD1 . . 4.300 3.773 3.331 4.282 . 0 0 "[ . 1 . 2]" 1
2431 1 104 ILE HB 1 105 PRO HD2 . . 5.500 4.377 4.118 4.572 . 0 0 "[ . 1 . 2]" 1
2432 1 104 ILE HB 1 105 PRO HD3 . . 5.020 4.824 4.690 4.950 . 0 0 "[ . 1 . 2]" 1
2433 1 104 ILE MD 1 104 ILE MG . . 3.240 2.346 2.088 3.250 0.010 14 0 "[ . 1 . 2]" 1
2434 1 104 ILE MD 1 105 PRO HD2 . . 5.500 3.514 2.534 5.322 . 0 0 "[ . 1 . 2]" 1
2435 1 104 ILE MD 1 105 PRO HD3 . . 5.500 3.603 2.977 5.224 . 0 0 "[ . 1 . 2]" 1
2436 1 104 ILE HG12 1 105 PRO HD2 . . 5.500 4.952 4.515 5.392 . 0 0 "[ . 1 . 2]" 1
2437 1 104 ILE HG12 1 105 PRO HD3 . . 5.500 5.051 4.747 5.592 0.092 18 0 "[ . 1 . 2]" 1
2438 1 104 ILE HG13 1 105 PRO HD2 . . 5.500 4.882 4.147 5.453 . 0 0 "[ . 1 . 2]" 1
2439 1 104 ILE HG13 1 105 PRO HD3 . . 5.500 5.347 4.288 5.587 0.087 10 0 "[ . 1 . 2]" 1
2440 1 104 ILE MG 1 105 PRO HA . . 5.500 4.273 4.122 4.415 . 0 0 "[ . 1 . 2]" 1
2441 1 104 ILE MG 1 105 PRO HB3 . . 5.500 5.175 5.023 5.376 . 0 0 "[ . 1 . 2]" 1
2442 1 104 ILE MG 1 105 PRO HD2 . . 4.500 2.306 2.078 2.648 . 0 0 "[ . 1 . 2]" 1
2443 1 104 ILE MG 1 105 PRO HD3 . . 4.030 3.451 3.093 3.722 . 0 0 "[ . 1 . 2]" 1
2444 1 104 ILE MG 1 105 PRO HG3 . . 5.460 4.719 4.460 5.012 . 0 0 "[ . 1 . 2]" 1
2445 1 104 ILE MG 1 106 PRO HA . . 5.500 4.320 3.629 4.687 . 0 0 "[ . 1 . 2]" 1
2446 1 104 ILE MG 1 107 GLU H . . 5.500 4.791 4.126 5.299 . 0 0 "[ . 1 . 2]" 1
2447 1 104 ILE MG 1 108 LEU H . . 4.890 3.525 3.227 3.728 . 0 0 "[ . 1 . 2]" 1
2448 1 104 ILE MG 1 108 LEU HB2 . . 3.910 2.308 2.006 2.613 . 0 0 "[ . 1 . 2]" 1
2449 1 104 ILE MG 1 108 LEU HB3 . . 3.770 2.884 2.431 3.351 . 0 0 "[ . 1 . 2]" 1
2450 1 104 ILE MG 1 109 TRP H . . 5.000 3.203 2.627 3.621 . 0 0 "[ . 1 . 2]" 1
2451 1 104 ILE MG 1 109 TRP HA . . 4.770 3.633 3.190 4.019 . 0 0 "[ . 1 . 2]" 1
2452 1 104 ILE MG 1 109 TRP HB2 . . 4.900 3.455 3.066 3.834 . 0 0 "[ . 1 . 2]" 1
2453 1 104 ILE MG 1 109 TRP HB3 . . 5.330 2.496 2.156 2.830 . 0 0 "[ . 1 . 2]" 1
2454 1 104 ILE MG 1 109 TRP HD1 . . 5.010 4.713 4.080 5.103 0.093 14 0 "[ . 1 . 2]" 1
2455 1 104 ILE MG 1 109 TRP HE3 . . 4.840 4.917 4.688 4.951 0.111 11 0 "[ . 1 . 2]" 1
2456 1 105 PRO HA 1 106 PRO HB3 . . 5.500 4.889 4.646 5.081 . 0 0 "[ . 1 . 2]" 1
2457 1 105 PRO HA 1 106 PRO HD2 . . 3.180 2.577 2.297 2.801 . 0 0 "[ . 1 . 2]" 1
2458 1 105 PRO HA 1 106 PRO HD3 . . 3.310 2.449 2.338 2.581 . 0 0 "[ . 1 . 2]" 1
2459 1 105 PRO HA 1 107 GLU H . . 5.500 4.019 3.774 4.341 . 0 0 "[ . 1 . 2]" 1
2460 1 105 PRO HB2 1 106 PRO HD2 . . 4.810 2.375 2.149 2.985 . 0 0 "[ . 1 . 2]" 1
2461 1 105 PRO HB2 1 106 PRO HD3 . . 3.840 3.754 3.494 4.271 0.431 5 0 "[ . 1 . 2]" 1
2462 1 105 PRO HB2 1 107 GLU H . . 4.810 2.375 1.992 2.872 . 0 0 "[ . 1 . 2]" 1
2463 1 105 PRO HB2 1 108 LEU H . . 5.070 3.896 3.232 4.230 . 0 0 "[ . 1 . 2]" 1
2464 1 105 PRO HB2 1 108 LEU HG . . 5.020 4.491 4.132 4.774 . 0 0 "[ . 1 . 2]" 1
2465 1 105 PRO HB3 1 106 PRO HD2 . . 4.550 3.008 2.660 3.303 . 0 0 "[ . 1 . 2]" 1
2466 1 105 PRO HB3 1 106 PRO HD3 . . 3.930 4.010 3.778 4.395 0.465 13 0 "[ . 1 . 2]" 1
2467 1 105 PRO HB3 1 107 GLU H . . 5.180 4.059 3.553 4.481 . 0 0 "[ . 1 . 2]" 1
2468 1 105 PRO HB3 1 108 LEU H . . 5.500 5.288 4.883 5.565 0.065 15 0 "[ . 1 . 2]" 1
2469 1 105 PRO HB3 1 108 LEU MD1 . . 5.500 4.836 4.410 5.255 . 0 0 "[ . 1 . 2]" 1
2470 1 105 PRO HB3 1 108 LEU HG . . 5.500 5.440 5.062 5.570 0.070 9 0 "[ . 1 . 2]" 1
2471 1 105 PRO HD2 1 108 LEU HB2 . . 5.500 2.225 2.005 2.534 . 0 0 "[ . 1 . 2]" 1
2472 1 105 PRO HD2 1 108 LEU HB3 . . 5.500 3.657 3.281 3.971 . 0 0 "[ . 1 . 2]" 1
2473 1 105 PRO HD2 1 108 LEU MD1 . . 4.950 2.189 2.029 2.485 . 0 0 "[ . 1 . 2]" 1
2474 1 105 PRO HD3 1 108 LEU H . . 5.500 5.309 4.897 5.640 0.140 15 0 "[ . 1 . 2]" 1
2475 1 105 PRO HD3 1 108 LEU HB2 . . 5.410 3.942 3.724 4.287 . 0 0 "[ . 1 . 2]" 1
2476 1 105 PRO HD3 1 108 LEU HB3 . . 5.190 5.266 4.942 5.562 0.372 13 0 "[ . 1 . 2]" 1
2477 1 105 PRO HD3 1 108 LEU MD1 . . 4.490 2.946 2.684 3.294 . 0 0 "[ . 1 . 2]" 1
2478 1 105 PRO HD3 1 108 LEU MD2 . . 5.500 5.562 5.115 5.873 0.373 12 0 "[ . 1 . 2]" 1
2479 1 105 PRO HD3 1 108 LEU HG . . 5.500 4.697 3.958 5.031 . 0 0 "[ . 1 . 2]" 1
2480 1 105 PRO HG3 1 108 LEU H . . 5.190 4.990 4.555 5.262 0.072 18 0 "[ . 1 . 2]" 1
2481 1 105 PRO HG3 1 108 LEU MD1 . . 4.510 3.066 2.480 3.653 . 0 0 "[ . 1 . 2]" 1
2482 1 105 PRO HG3 1 108 LEU HG . . 5.500 3.871 3.299 4.508 . 0 0 "[ . 1 . 2]" 1
2483 1 106 PRO HA 1 109 TRP H . . 5.050 3.456 2.979 3.871 . 0 0 "[ . 1 . 2]" 1
2484 1 106 PRO HA 1 109 TRP HB2 . . 5.390 4.931 4.110 5.462 0.072 16 0 "[ . 1 . 2]" 1
2485 1 106 PRO HA 1 109 TRP HB3 . . 5.470 3.601 2.477 4.249 . 0 0 "[ . 1 . 2]" 1
2486 1 106 PRO HA 1 109 TRP HD1 . . 5.500 2.339 2.034 2.700 . 0 0 "[ . 1 . 2]" 1
2487 1 106 PRO HA 1 109 TRP HE1 . . 5.500 3.433 2.956 4.103 . 0 0 "[ . 1 . 2]" 1
2488 1 106 PRO HB2 1 107 GLU H . . 4.500 4.049 3.674 4.318 . 0 0 "[ . 1 . 2]" 1
2489 1 106 PRO HB2 1 107 GLU HA . . 5.500 4.632 4.371 4.795 . 0 0 "[ . 1 . 2]" 1
2490 1 106 PRO HD2 1 107 GLU H . . 5.500 3.018 2.532 3.459 . 0 0 "[ . 1 . 2]" 1
2491 1 106 PRO HD3 1 107 GLU H . . 4.940 4.066 3.748 4.324 . 0 0 "[ . 1 . 2]" 1
2492 1 106 PRO HG2 1 107 GLU H . . 4.830 3.253 2.526 3.680 . 0 0 "[ . 1 . 2]" 1
2493 1 106 PRO HG3 1 107 GLU H . . 4.910 4.617 4.034 4.966 0.056 16 0 "[ . 1 . 2]" 1
2494 1 107 GLU H 1 107 GLU HB2 . . 3.960 2.573 2.081 3.576 . 0 0 "[ . 1 . 2]" 1
2495 1 107 GLU H 1 107 GLU HB3 . . 3.510 2.574 2.209 3.046 . 0 0 "[ . 1 . 2]" 1
2496 1 107 GLU H 1 107 GLU HG2 . . 4.580 4.403 2.154 4.673 0.093 6 0 "[ . 1 . 2]" 1
2497 1 107 GLU H 1 107 GLU HG3 . . 4.490 4.395 3.626 4.545 0.055 10 0 "[ . 1 . 2]" 1
2498 1 107 GLU H 1 108 LEU H . . 4.280 2.404 2.019 2.738 . 0 0 "[ . 1 . 2]" 1
2499 1 107 GLU H 1 108 LEU HA . . 5.500 5.036 4.732 5.334 . 0 0 "[ . 1 . 2]" 1
2500 1 107 GLU H 1 109 TRP H . . 5.500 3.933 3.466 4.338 . 0 0 "[ . 1 . 2]" 1
2501 1 107 GLU HA 1 107 GLU HG2 . . 3.830 3.345 2.703 3.670 . 0 0 "[ . 1 . 2]" 1
2502 1 107 GLU HA 1 107 GLU HG3 . . 3.770 2.442 2.145 3.896 0.126 8 0 "[ . 1 . 2]" 1
2503 1 107 GLU HA 1 108 LEU H . . 3.430 3.363 3.011 3.509 0.079 20 0 "[ . 1 . 2]" 1
2504 1 107 GLU HA 1 108 LEU HA . . 4.640 4.544 4.240 4.693 0.053 5 0 "[ . 1 . 2]" 1
2505 1 107 GLU HA 1 108 LEU HG . . 5.380 5.101 4.855 5.434 0.054 5 0 "[ . 1 . 2]" 1
2506 1 107 GLU HA 1 109 TRP H . . 5.060 4.350 3.928 4.811 . 0 0 "[ . 1 . 2]" 1
2507 1 107 GLU HA 1 110 ASP H . . 5.500 4.293 3.580 5.019 . 0 0 "[ . 1 . 2]" 1
2508 1 107 GLU HA 1 113 ILE MD . . 5.500 3.280 2.538 3.688 . 0 0 "[ . 1 . 2]" 1
2509 1 107 GLU HB2 1 108 LEU H . . 4.860 4.167 3.190 4.455 . 0 0 "[ . 1 . 2]" 1
2510 1 107 GLU HB2 1 108 LEU HG . . 5.500 4.925 4.150 5.570 0.070 15 0 "[ . 1 . 2]" 1
2511 1 107 GLU HB2 1 113 ILE MD . . 5.500 5.013 4.040 5.508 0.008 6 0 "[ . 1 . 2]" 1
2512 1 107 GLU HB3 1 108 LEU H . . 4.110 3.472 2.546 4.079 . 0 0 "[ . 1 . 2]" 1
2513 1 107 GLU HB3 1 108 LEU HA . . 5.500 4.731 3.645 5.595 0.095 8 0 "[ . 1 . 2]" 1
2514 1 107 GLU HB3 1 108 LEU MD2 . . 5.500 4.338 3.304 5.470 . 0 0 "[ . 1 . 2]" 1
2515 1 107 GLU HB3 1 108 LEU HG . . 5.500 3.422 2.817 4.919 . 0 0 "[ . 1 . 2]" 1
2516 1 107 GLU HB3 1 109 TRP H . . 5.500 5.332 4.766 5.580 0.080 8 0 "[ . 1 . 2]" 1
2517 1 107 GLU HG2 1 108 LEU H . . 5.240 4.765 2.489 5.359 0.119 6 0 "[ . 1 . 2]" 1
2518 1 107 GLU HG2 1 108 LEU HA . . 5.500 4.898 3.947 5.632 0.132 6 0 "[ . 1 . 2]" 1
2519 1 107 GLU HG2 1 108 LEU MD2 . . 5.500 4.157 3.295 4.827 . 0 0 "[ . 1 . 2]" 1
2520 1 107 GLU HG2 1 108 LEU HG . . 4.810 4.184 2.708 4.928 0.118 6 0 "[ . 1 . 2]" 1
2521 1 107 GLU HG2 1 113 ILE MD . . 5.500 5.521 4.763 5.630 0.130 13 0 "[ . 1 . 2]" 1
2522 1 107 GLU HG3 1 108 LEU H . . 5.100 4.885 3.432 5.194 0.094 2 0 "[ . 1 . 2]" 1
2523 1 107 GLU HG3 1 108 LEU HA . . 5.390 5.211 3.866 5.579 0.189 2 0 "[ . 1 . 2]" 1
2524 1 107 GLU HG3 1 108 LEU MD2 . . 5.500 4.911 3.205 5.528 0.028 3 0 "[ . 1 . 2]" 1
2525 1 107 GLU HG3 1 108 LEU HG . . 5.280 5.136 2.239 5.364 0.084 18 0 "[ . 1 . 2]" 1
2526 1 107 GLU HG3 1 113 ILE MD . . 5.500 4.372 3.944 5.590 0.090 8 0 "[ . 1 . 2]" 1
2527 1 108 LEU H 1 108 LEU HB2 . . 4.130 2.501 2.266 2.847 . 0 0 "[ . 1 . 2]" 1
2528 1 108 LEU H 1 108 LEU MD1 . . 5.200 4.149 3.805 4.442 . 0 0 "[ . 1 . 2]" 1
2529 1 108 LEU H 1 108 LEU MD2 . . 4.870 4.021 3.709 4.316 . 0 0 "[ . 1 . 2]" 1
2530 1 108 LEU H 1 108 LEU HG . . 4.300 3.236 2.716 3.659 . 0 0 "[ . 1 . 2]" 1
2531 1 108 LEU H 1 109 TRP H . . 3.390 2.023 1.670 2.753 . 0 0 "[ . 1 . 2]" 1
2532 1 108 LEU HA 1 108 LEU MD2 . . 3.220 2.086 2.038 2.189 . 0 0 "[ . 1 . 2]" 1
2533 1 108 LEU HA 1 108 LEU HG . . 3.300 2.996 2.820 3.221 . 0 0 "[ . 1 . 2]" 1
2534 1 108 LEU HA 1 109 TRP H . . 3.600 3.386 3.091 3.551 . 0 0 "[ . 1 . 2]" 1
2535 1 108 LEU HA 1 109 TRP HA . . 5.280 4.684 4.520 4.822 . 0 0 "[ . 1 . 2]" 1
2536 1 108 LEU HB2 1 109 TRP H . . 5.050 3.281 2.859 3.683 . 0 0 "[ . 1 . 2]" 1
2537 1 108 LEU HB3 1 109 TRP H . . 4.030 3.953 3.598 4.118 0.088 18 0 "[ . 1 . 2]" 1
2538 1 108 LEU HB3 1 110 ASP H . . 5.500 5.026 4.588 5.408 . 0 0 "[ . 1 . 2]" 1
2539 1 108 LEU MD1 1 109 TRP H . . 5.500 5.088 4.775 5.384 . 0 0 "[ . 1 . 2]" 1
2540 1 108 LEU MD2 1 109 TRP H . . 5.420 4.804 4.671 4.973 . 0 0 "[ . 1 . 2]" 1
2541 1 108 LEU HG 1 109 TRP H . . 5.500 4.805 4.595 4.973 . 0 0 "[ . 1 . 2]" 1
2542 1 109 TRP H 1 109 TRP HB3 . . 4.090 2.438 2.097 2.808 . 0 0 "[ . 1 . 2]" 1
2543 1 109 TRP H 1 109 TRP HD1 . . 4.940 2.653 2.271 3.354 . 0 0 "[ . 1 . 2]" 1
2544 1 109 TRP H 1 110 ASP H . . 4.240 2.527 2.140 3.005 . 0 0 "[ . 1 . 2]" 1
2545 1 109 TRP HA 1 109 TRP HD1 . . 4.260 4.204 4.092 4.326 0.066 14 0 "[ . 1 . 2]" 1
2546 1 109 TRP HA 1 109 TRP HE3 . . 4.300 4.308 3.933 4.391 0.091 1 0 "[ . 1 . 2]" 1
2547 1 109 TRP HA 1 110 ASP H . . 3.320 3.200 2.999 3.319 . 0 0 "[ . 1 . 2]" 1
2548 1 109 TRP HA 1 111 PRO HA . . 5.500 5.580 5.571 5.590 0.090 1 0 "[ . 1 . 2]" 1
2549 1 109 TRP HB2 1 110 ASP H . . 5.070 4.597 4.533 4.664 . 0 0 "[ . 1 . 2]" 1
2550 1 109 TRP HB3 1 110 ASP H . . 5.090 4.278 3.884 4.508 . 0 0 "[ . 1 . 2]" 1
2551 1 109 TRP HD1 1 110 ASP H . . 5.270 3.322 2.912 3.688 . 0 0 "[ . 1 . 2]" 1
2552 1 109 TRP HD1 1 110 ASP HA . . 5.180 3.071 2.477 3.640 . 0 0 "[ . 1 . 2]" 1
2553 1 109 TRP HD1 1 111 PRO HD2 . . 5.500 4.010 3.414 4.517 . 0 0 "[ . 1 . 2]" 1
2554 1 109 TRP HD1 1 111 PRO HD3 . . 5.500 3.037 2.595 3.549 . 0 0 "[ . 1 . 2]" 1
2555 1 109 TRP HD1 1 111 PRO HG3 . . 5.500 4.842 4.291 5.547 0.047 16 0 "[ . 1 . 2]" 1
2556 1 109 TRP HE1 1 113 ILE MD . . 5.360 4.260 3.207 4.948 . 0 0 "[ . 1 . 2]" 1
2557 1 109 TRP HE3 1 111 PRO HB3 . . 5.500 5.035 4.435 5.571 0.071 9 0 "[ . 1 . 2]" 1
2558 1 109 TRP HH2 1 111 PRO HB3 . . 5.500 5.030 3.810 5.557 0.057 16 0 "[ . 1 . 2]" 1
2559 1 109 TRP HZ3 1 111 PRO HB3 . . 5.500 5.184 4.137 5.577 0.077 5 0 "[ . 1 . 2]" 1
2560 1 110 ASP H 1 110 ASP HA . . 2.840 2.616 2.473 2.708 . 0 0 "[ . 1 . 2]" 1
2561 1 110 ASP H 1 110 ASP HB2 . . 3.910 3.449 2.746 3.625 . 0 0 "[ . 1 . 2]" 1
2562 1 110 ASP H 1 110 ASP HB3 . . 3.920 2.623 2.310 3.640 . 0 0 "[ . 1 . 2]" 1
2563 1 110 ASP H 1 111 PRO HD2 . . 5.500 4.764 4.493 5.086 . 0 0 "[ . 1 . 2]" 1
2564 1 110 ASP H 1 111 PRO HD3 . . 5.500 4.051 3.664 4.334 . 0 0 "[ . 1 . 2]" 1
2565 1 110 ASP H 1 113 ILE MD . . 5.500 4.050 3.665 4.340 . 0 0 "[ . 1 . 2]" 1
2566 1 110 ASP H 1 113 ILE HG13 . . 5.500 5.236 4.785 5.571 0.071 16 0 "[ . 1 . 2]" 1
2567 1 110 ASP HA 1 111 PRO HD2 . . 2.770 2.291 2.109 2.770 0.000 10 0 "[ . 1 . 2]" 1
2568 1 110 ASP HA 1 111 PRO HD3 . . 3.330 2.369 2.071 2.541 . 0 0 "[ . 1 . 2]" 1
2569 1 110 ASP HA 1 111 PRO HG3 . . 5.310 4.489 4.243 4.611 . 0 0 "[ . 1 . 2]" 1
2570 1 110 ASP HA 1 113 ILE HG13 . . 4.100 3.006 2.404 4.035 . 0 0 "[ . 1 . 2]" 1
2571 1 110 ASP HB2 1 111 PRO HD2 . . 5.150 3.996 3.453 5.232 0.082 10 0 "[ . 1 . 2]" 1
2572 1 110 ASP HB2 1 111 PRO HD3 . . 5.500 4.601 4.221 4.994 . 0 0 "[ . 1 . 2]" 1
2573 1 110 ASP HB2 1 112 GLY H . . 5.500 5.063 4.366 5.638 0.138 10 0 "[ . 1 . 2]" 1
2574 1 110 ASP HB2 1 113 ILE HB . . 5.500 3.622 2.984 5.501 0.001 11 0 "[ . 1 . 2]" 1
2575 1 110 ASP HB2 1 113 ILE MD . . 5.500 2.499 2.111 4.138 . 0 0 "[ . 1 . 2]" 1
2576 1 110 ASP HB2 1 113 ILE HG12 . . 5.500 3.951 2.282 5.590 0.090 19 0 "[ . 1 . 2]" 1
2577 1 110 ASP HB2 1 113 ILE HG13 . . 5.500 2.635 2.196 4.030 . 0 0 "[ . 1 . 2]" 1
2578 1 110 ASP HB2 1 113 ILE MG . . 5.500 4.531 4.179 5.678 0.178 11 0 "[ . 1 . 2]" 1
2579 1 110 ASP HB3 1 111 PRO HD2 . . 4.800 4.344 3.587 4.858 0.058 9 0 "[ . 1 . 2]" 1
2580 1 110 ASP HB3 1 111 PRO HD3 . . 5.500 4.654 4.305 4.851 . 0 0 "[ . 1 . 2]" 1
2581 1 110 ASP HB3 1 113 ILE H . . 5.330 5.196 4.817 6.003 0.673 16 1 "[ . 1 .+ 2]" 1
2582 1 110 ASP HB3 1 113 ILE HB . . 4.880 4.496 3.509 5.485 0.605 16 1 "[ . 1 .+ 2]" 1
2583 1 110 ASP HB3 1 113 ILE MD . . 5.020 2.407 2.046 2.894 . 0 0 "[ . 1 . 2]" 1
2584 1 110 ASP HB3 1 113 ILE HG12 . . 5.500 4.457 2.103 5.168 . 0 0 "[ . 1 . 2]" 1
2585 1 110 ASP HB3 1 113 ILE HG13 . . 5.380 3.424 2.174 3.927 . 0 0 "[ . 1 . 2]" 1
2586 1 111 PRO HA 1 113 ILE H . . 5.500 5.292 4.608 5.577 0.077 19 0 "[ . 1 . 2]" 1
2587 1 111 PRO HD2 1 112 GLY H . . 4.700 2.901 2.452 3.485 . 0 0 "[ . 1 . 2]" 1
2588 1 111 PRO HD2 1 113 ILE HG13 . . 4.930 2.902 2.247 4.991 0.061 10 0 "[ . 1 . 2]" 1
2589 1 111 PRO HD3 1 112 GLY H . . 5.500 4.021 3.869 4.266 . 0 0 "[ . 1 . 2]" 1
2590 1 111 PRO HG3 1 112 GLY H . . 4.380 3.732 3.433 4.442 0.062 9 0 "[ . 1 . 2]" 1
2591 1 112 GLY H 1 113 ILE H . . 4.240 2.796 1.875 3.360 . 0 0 "[ . 1 . 2]" 1
2592 1 112 GLY HA2 1 115 ALA MB . . 5.500 3.586 2.333 5.591 0.091 5 0 "[ . 1 . 2]" 1
2593 1 113 ILE H 1 113 ILE HB . . 3.770 2.806 2.386 3.826 0.056 11 0 "[ . 1 . 2]" 1
2594 1 113 ILE H 1 113 ILE HG12 . . 4.400 3.344 2.914 3.623 . 0 0 "[ . 1 . 2]" 1
2595 1 113 ILE H 1 113 ILE HG13 . . 4.550 2.639 2.012 4.607 0.057 11 0 "[ . 1 . 2]" 1
2596 1 113 ILE H 1 113 ILE MG . . 4.500 3.861 3.762 4.182 . 0 0 "[ . 1 . 2]" 1
2597 1 113 ILE H 1 114 ASN H . . 4.700 3.650 2.448 4.125 . 0 0 "[ . 1 . 2]" 1
2598 1 113 ILE HA 1 113 ILE MD . . 4.710 3.616 2.204 4.007 . 0 0 "[ . 1 . 2]" 1
2599 1 113 ILE HA 1 113 ILE HG12 . . 4.090 2.640 2.329 3.339 . 0 0 "[ . 1 . 2]" 1
2600 1 113 ILE HA 1 113 ILE MG . . 3.700 2.372 2.235 2.599 . 0 0 "[ . 1 . 2]" 1
2601 1 113 ILE HB 1 114 ASN H . . 5.450 4.310 3.217 4.546 . 0 0 "[ . 1 . 2]" 1
2602 1 113 ILE HB 1 115 ALA MB . . 3.940 3.768 2.899 4.041 0.101 16 0 "[ . 1 . 2]" 1
2603 1 113 ILE MD 1 115 ALA MB . . 5.070 5.092 4.601 5.209 0.139 14 0 "[ . 1 . 2]" 1
2604 1 113 ILE HG12 1 113 ILE MG . . 3.440 2.535 2.313 3.220 . 0 0 "[ . 1 . 2]" 1
2605 1 113 ILE MG 1 114 ASN H . . 5.500 3.600 3.461 3.856 . 0 0 "[ . 1 . 2]" 1
2606 1 113 ILE MG 1 114 ASN HA . . 4.740 4.805 4.596 4.862 0.122 11 0 "[ . 1 . 2]" 1
2607 1 113 ILE MG 1 114 ASN HB2 . . 5.140 3.765 2.906 5.195 0.055 5 0 "[ . 1 . 2]" 1
2608 1 113 ILE MG 1 114 ASN HB3 . . 4.860 4.237 3.359 4.937 0.077 13 0 "[ . 1 . 2]" 1
2609 1 113 ILE MG 1 115 ALA H . . 5.500 4.962 2.958 5.490 . 0 0 "[ . 1 . 2]" 1
2610 1 113 ILE MG 1 115 ALA MB . . 4.380 4.255 2.314 4.501 0.121 13 0 "[ . 1 . 2]" 1
2611 1 114 ASN H 1 114 ASN HA . . 2.400 2.243 2.186 2.294 . 0 0 "[ . 1 . 2]" 1
2612 1 114 ASN H 1 115 ALA H . . 5.480 2.888 2.384 3.418 . 0 0 "[ . 1 . 2]" 1
2613 1 114 ASN HA 1 115 ALA H . . 3.370 2.590 2.211 2.933 . 0 0 "[ . 1 . 2]" 1
2614 1 114 ASN HB2 1 115 ALA H . . 5.500 4.539 4.337 4.699 . 0 0 "[ . 1 . 2]" 1
2615 1 114 ASN HB3 1 115 ALA H . . 5.500 4.444 4.207 4.685 . 0 0 "[ . 1 . 2]" 1
2616 1 114 ASN HB3 1 115 ALA HA . . 5.500 5.137 4.769 6.168 0.668 11 2 "[ . - 1+ . 2]" 1
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