NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
493944 |
2l6o   |
17320 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l6o
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 1712
_Distance_constraint_stats_list.Viol_count 3547
_Distance_constraint_stats_list.Viol_total 5984.333
_Distance_constraint_stats_list.Viol_max 0.995
_Distance_constraint_stats_list.Viol_rms 0.0416
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0087
_Distance_constraint_stats_list.Viol_average_violations_only 0.0844
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 6.401 0.635 11 9 "[ ** .*- *+ . ***]"
1 2 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 ALA 0.085 0.085 15 0 "[ . 1 . 2]"
1 4 GLY 1.094 0.112 4 0 "[ . 1 . 2]"
1 5 GLN 2.194 0.112 4 0 "[ . 1 . 2]"
1 6 THR 2.801 0.098 2 0 "[ . 1 . 2]"
1 7 PRO 1.719 0.081 4 0 "[ . 1 . 2]"
1 8 HIS 7.778 0.524 19 1 "[ . 1 . +2]"
1 9 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 GLN 2.624 0.642 6 1 "[ .+ 1 . 2]"
1 11 LEU 4.662 0.275 8 0 "[ . 1 . 2]"
1 12 ILE 9.937 0.440 15 0 "[ . 1 . 2]"
1 13 TRP 5.574 0.092 17 0 "[ . 1 . 2]"
1 14 PRO 8.919 0.844 8 1 "[ . + 1 . 2]"
1 15 ALA 2.972 0.120 18 0 "[ . 1 . 2]"
1 16 LEU 0.486 0.095 18 0 "[ . 1 . 2]"
1 17 LEU 4.092 0.995 5 1 "[ + 1 . 2]"
1 18 LYS 3.863 0.104 5 0 "[ . 1 . 2]"
1 19 GLN 5.594 0.995 5 2 "[ + 1 . - 2]"
1 20 GLN 5.558 0.533 5 1 "[ + 1 . 2]"
1 21 GLY 2.073 0.533 5 1 "[ + 1 . 2]"
1 22 CYS 7.754 0.818 4 2 "[ +. 1 . - 2]"
1 23 ASN 10.533 0.818 4 2 "[ +.- 1 . 2]"
1 24 GLU 2.634 0.116 3 0 "[ . 1 . 2]"
1 25 LEU 2.101 0.101 16 0 "[ . 1 . 2]"
1 26 LEU 5.952 0.401 9 0 "[ . 1 . 2]"
1 27 PRO 3.968 0.401 9 0 "[ . 1 . 2]"
1 28 LEU 1.859 0.808 12 2 "[ . 1 + . -2]"
1 29 ARG 5.793 0.808 12 2 "[ . 1 + . -2]"
1 30 THR 2.441 0.098 8 0 "[ . 1 . 2]"
1 31 ASN 0.629 0.069 17 0 "[ . 1 . 2]"
1 32 ASP 0.905 0.081 5 0 "[ . 1 . 2]"
1 33 ASP 1.935 0.171 18 0 "[ . 1 . 2]"
1 34 TRP 5.154 0.171 18 0 "[ . 1 . 2]"
1 35 GLN 3.410 0.092 10 0 "[ . 1 . 2]"
1 36 ARG 1.136 0.108 10 0 "[ . 1 . 2]"
1 37 PHE 11.410 0.665 9 5 "[ .*- +1 * . *2]"
1 38 CYS 7.375 0.460 14 0 "[ . 1 . 2]"
1 39 ALA 3.967 0.175 9 0 "[ . 1 . 2]"
1 40 ASP 10.491 0.511 19 3 "[ . - 1 * . +2]"
1 41 SER 3.913 0.374 18 0 "[ . 1 . 2]"
1 42 LYS 2.680 0.107 17 0 "[ . 1 . 2]"
1 43 HIS 5.604 0.665 9 2 "[ .- +1 . 2]"
1 44 LEU 3.140 0.258 9 0 "[ . 1 . 2]"
1 45 LEU 5.468 0.128 11 0 "[ . 1 . 2]"
1 46 GLN 1.045 0.109 8 0 "[ . 1 . 2]"
1 47 TYR 6.931 0.836 11 2 "[ . 1+ -. 2]"
1 48 GLY 3.914 0.712 14 2 "[ . 1- +. 2]"
1 49 ASP 5.637 0.740 11 2 "[ . 1+ -. 2]"
1 50 LYS 13.474 0.729 2 3 "[ + . 1 * - 2]"
1 51 LEU 5.751 0.120 18 0 "[ . 1 . 2]"
1 52 VAL 3.050 0.107 18 0 "[ . 1 . 2]"
1 53 ASP 4.190 0.087 6 0 "[ . 1 . 2]"
1 54 SER 8.523 0.844 8 1 "[ . + 1 . 2]"
1 55 ASN 10.165 0.481 18 0 "[ . 1 . 2]"
1 56 PHE 12.056 0.814 12 5 "[ . * +**. -]"
1 57 HIS 4.178 0.085 12 0 "[ . 1 . 2]"
1 58 CYS 2.458 0.272 4 0 "[ . 1 . 2]"
1 59 PHE 5.499 0.104 17 0 "[ . 1 . 2]"
1 60 VAL 4.955 0.727 2 1 "[ + . 1 . 2]"
1 61 LEU 13.157 0.836 11 2 "[ . 1+ -. 2]"
1 62 GLU 1.820 0.097 1 0 "[ . 1 . 2]"
1 63 GLU 1.940 0.103 19 0 "[ . 1 . 2]"
1 64 ASP 0.930 0.081 9 0 "[ . 1 . 2]"
1 65 ALA 1.764 0.100 10 0 "[ . 1 . 2]"
1 66 HIS 5.451 0.101 5 0 "[ . 1 . 2]"
1 67 TRP 21.020 0.526 3 5 "[ + . * 1 - **]"
1 68 HIS 9.447 0.526 3 4 "[ + . * 1 - *]"
1 69 PRO 3.916 0.384 17 0 "[ . 1 . 2]"
1 70 ALA 5.369 0.384 17 0 "[ . 1 . 2]"
1 71 ALA 2.509 0.104 9 0 "[ . 1 . 2]"
1 72 PRO 7.762 0.814 12 5 "[ . * +**. -]"
1 73 LEU 6.391 0.112 15 0 "[ . 1 . 2]"
1 74 PRO 1.796 0.086 8 0 "[ . 1 . 2]"
1 75 PRO 2.103 0.092 7 0 "[ . 1 . 2]"
1 76 GLU 7.734 0.561 15 4 "[ . 1- +* *2]"
1 77 GLY 5.346 0.405 17 0 "[ . 1 . 2]"
1 78 LEU 4.051 0.115 11 0 "[ . 1 . 2]"
1 79 ASN 2.286 0.079 19 0 "[ . 1 . 2]"
1 80 ASP 14.324 0.963 9 12 "[***** *+1 *-** *2]"
1 81 LEU 9.366 0.897 15 9 "[* *** * 1 +** *2]"
1 82 ILE 4.075 0.136 12 0 "[ . 1 . 2]"
1 83 ARG 9.996 0.963 9 4 "[ * . +1 *- 2]"
1 84 ALA 7.411 0.667 6 1 "[ .+ 1 . 2]"
1 85 HIS 3.260 0.755 6 1 "[ .+ 1 . 2]"
1 86 CYS 6.653 0.479 16 0 "[ . 1 . 2]"
1 87 ALA 2.630 0.105 7 0 "[ . 1 . 2]"
1 88 THR 3.759 0.116 3 0 "[ . 1 . 2]"
1 89 LEU 4.130 0.598 16 1 "[ . 1 .+ 2]"
1 90 GLY 0.012 0.012 5 0 "[ . 1 . 2]"
1 91 HIS 5.171 0.598 16 1 "[ . 1 .+ 2]"
1 92 CYS 0.282 0.098 10 0 "[ . 1 . 2]"
1 93 CYS 3.618 0.117 14 0 "[ . 1 . 2]"
1 94 THR 1.556 0.117 14 0 "[ . 1 . 2]"
1 95 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 LYS 1.209 0.096 15 0 "[ . 1 . 2]"
1 97 MET 3.263 0.144 3 0 "[ . 1 . 2]"
1 98 HIS 3.858 0.144 3 0 "[ . 1 . 2]"
1 99 LEU 4.397 0.112 12 0 "[ . 1 . 2]"
1 100 HIS 2.568 0.096 15 0 "[ . 1 . 2]"
1 101 SER 3.369 0.090 15 0 "[ . 1 . 2]"
1 102 VAL 7.845 0.197 19 0 "[ . 1 . 2]"
1 103 MET 4.538 0.197 19 0 "[ . 1 . 2]"
1 104 ASP 3.608 0.101 7 0 "[ . 1 . 2]"
1 105 ALA 3.854 0.103 19 0 "[ . 1 . 2]"
1 106 ILE 6.022 0.126 15 0 "[ . 1 . 2]"
1 107 ASP 2.523 0.090 3 0 "[ . 1 . 2]"
1 108 PHE 4.443 0.136 12 0 "[ . 1 . 2]"
1 109 LEU 4.836 0.110 6 0 "[ . 1 . 2]"
1 110 ASN 3.476 0.101 1 0 "[ . 1 . 2]"
1 111 ALA 0.828 0.093 13 0 "[ . 1 . 2]"
1 112 LEU 5.861 0.788 1 2 "[+ . 1 - . 2]"
1 113 GLU 5.198 0.788 1 3 "[+ . 1* - . 2]"
1 114 GLY 1.243 0.507 11 1 "[ . 1+ . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 MET HA 1 1 MET ME . . 3.710 3.511 2.446 3.816 0.106 10 0 "[ . 1 . 2]" 1
2 1 1 MET QB 1 1 MET ME . . 2.400 2.220 2.020 2.443 0.043 5 0 "[ . 1 . 2]" 1
3 1 1 MET ME 1 1 MET HG3 . . 2.800 2.855 2.285 3.435 0.635 11 9 "[ ** .*- *+ . ***]" 1
4 1 2 GLY QA 1 3 ALA H . . 3.510 2.336 2.131 2.862 . 0 0 "[ . 1 . 2]" 1
5 1 3 ALA H 1 4 GLY H . . 4.800 4.230 2.310 4.745 . 0 0 "[ . 1 . 2]" 1
6 1 3 ALA HA 1 4 GLY H . . 3.420 2.608 2.172 3.505 0.085 15 0 "[ . 1 . 2]" 1
7 1 3 ALA MB 1 4 GLY H . . 4.540 2.610 1.814 3.702 . 0 0 "[ . 1 . 2]" 1
8 1 3 ALA MB 1 4 GLY QA . . 4.190 3.708 3.319 4.107 . 0 0 "[ . 1 . 2]" 1
9 1 4 GLY H 1 6 THR H . . 5.270 4.111 2.359 5.343 0.073 15 0 "[ . 1 . 2]" 1
10 1 4 GLY QA 1 5 GLN HE21 . . 5.500 5.012 2.746 5.600 0.100 12 0 "[ . 1 . 2]" 1
11 1 4 GLY QA 1 5 GLN QG . . 4.700 3.608 2.947 4.812 0.112 4 0 "[ . 1 . 2]" 1
12 1 4 GLY QA 1 6 THR H . . 4.830 3.678 2.879 4.854 0.024 3 0 "[ . 1 . 2]" 1
13 1 5 GLN H 1 5 GLN QB . . 3.720 2.734 2.385 3.365 . 0 0 "[ . 1 . 2]" 1
14 1 5 GLN H 1 5 GLN QG . . 4.280 2.917 2.314 3.611 . 0 0 "[ . 1 . 2]" 1
15 1 5 GLN H 1 6 THR H . . 3.580 2.829 1.762 3.659 0.079 3 0 "[ . 1 . 2]" 1
16 1 5 GLN HA 1 5 GLN QG . . 3.350 2.611 2.153 3.418 0.068 17 0 "[ . 1 . 2]" 1
17 1 5 GLN HA 1 6 THR H . . 3.000 2.883 2.133 3.087 0.087 7 0 "[ . 1 . 2]" 1
18 1 5 GLN QB 1 5 GLN QG . . 2.470 2.090 2.014 2.127 . 0 0 "[ . 1 . 2]" 1
19 1 5 GLN QB 1 6 THR H . . 3.840 3.655 3.597 3.687 . 0 0 "[ . 1 . 2]" 1
20 1 5 GLN QG 1 6 THR H . . 4.710 4.369 3.079 4.789 0.079 11 0 "[ . 1 . 2]" 1
21 1 6 THR H 1 6 THR HB . . 4.170 3.600 3.219 3.944 . 0 0 "[ . 1 . 2]" 1
22 1 6 THR H 1 6 THR MG . . 3.770 3.098 2.274 3.706 . 0 0 "[ . 1 . 2]" 1
23 1 6 THR HA 1 6 THR MG . . 3.390 2.248 2.115 2.494 . 0 0 "[ . 1 . 2]" 1
24 1 6 THR HA 1 7 PRO HA . . 4.350 4.374 4.211 4.431 0.081 4 0 "[ . 1 . 2]" 1
25 1 6 THR HA 1 7 PRO HD2 . . 3.390 2.600 2.352 2.982 . 0 0 "[ . 1 . 2]" 1
26 1 6 THR HA 1 7 PRO HD3 . . 3.310 2.389 2.110 2.607 . 0 0 "[ . 1 . 2]" 1
27 1 6 THR HA 1 13 TRP HZ2 . . 5.070 3.732 2.937 4.537 . 0 0 "[ . 1 . 2]" 1
28 1 6 THR HA 1 34 TRP HD1 . . 4.290 3.596 2.652 4.350 0.060 16 0 "[ . 1 . 2]" 1
29 1 6 THR HA 1 34 TRP HE1 . . 4.900 3.434 2.364 4.952 0.052 20 0 "[ . 1 . 2]" 1
30 1 6 THR HB 1 7 PRO HD2 . . 4.450 2.425 2.070 3.250 . 0 0 "[ . 1 . 2]" 1
31 1 6 THR MG 1 7 PRO HD2 . . 4.740 2.871 2.151 3.954 . 0 0 "[ . 1 . 2]" 1
32 1 6 THR MG 1 11 LEU MD2 . . 5.180 4.305 2.649 5.278 0.098 2 0 "[ . 1 . 2]" 1
33 1 6 THR MG 1 31 ASN HD21 . . 5.500 2.846 1.887 3.864 . 0 0 "[ . 1 . 2]" 1
34 1 6 THR MG 1 31 ASN HD22 . . 4.480 2.392 1.695 3.272 . 0 0 "[ . 1 . 2]" 1
35 1 7 PRO HA 1 34 TRP HE1 . . 5.240 5.082 3.444 5.319 0.079 13 0 "[ . 1 . 2]" 1
36 1 7 PRO HA 1 51 LEU QD . . 5.070 4.203 3.762 4.628 . 0 0 "[ . 1 . 2]" 1
37 1 7 PRO HA 1 67 TRP HD1 . . 3.930 2.753 2.064 3.952 0.022 17 0 "[ . 1 . 2]" 1
38 1 7 PRO HA 1 67 TRP HE1 . . 4.220 3.700 3.163 4.291 0.071 7 0 "[ . 1 . 2]" 1
39 1 7 PRO HB2 1 11 LEU MD1 . . 5.140 3.144 2.177 4.409 . 0 0 "[ . 1 . 2]" 1
40 1 7 PRO HB2 1 51 LEU QD . . 5.160 2.338 2.002 2.676 . 0 0 "[ . 1 . 2]" 1
41 1 7 PRO HB2 1 67 TRP HD1 . . 5.500 3.889 3.013 5.557 0.057 17 0 "[ . 1 . 2]" 1
42 1 7 PRO HB3 1 34 TRP HE1 . . 5.500 4.756 3.092 5.456 . 0 0 "[ . 1 . 2]" 1
43 1 7 PRO HB3 1 51 LEU QD . . 5.480 2.674 2.262 3.057 . 0 0 "[ . 1 . 2]" 1
44 1 7 PRO HD2 1 11 LEU MD1 . . 4.880 4.167 3.523 4.793 . 0 0 "[ . 1 . 2]" 1
45 1 7 PRO HD2 1 11 LEU MD2 . . 5.020 3.202 2.509 5.011 . 0 0 "[ . 1 . 2]" 1
46 1 7 PRO HD2 1 13 TRP HH2 . . 5.220 3.269 2.611 4.003 . 0 0 "[ . 1 . 2]" 1
47 1 7 PRO HD2 1 13 TRP HZ2 . . 4.200 2.412 1.984 3.024 . 0 0 "[ . 1 . 2]" 1
48 1 7 PRO HD2 1 51 LEU QD . . 5.290 4.429 3.806 5.106 . 0 0 "[ . 1 . 2]" 1
49 1 7 PRO HD3 1 13 TRP HH2 . . 5.330 3.061 2.656 3.534 . 0 0 "[ . 1 . 2]" 1
50 1 7 PRO HD3 1 13 TRP HZ2 . . 4.760 3.278 2.704 3.852 . 0 0 "[ . 1 . 2]" 1
51 1 7 PRO HD3 1 34 TRP HE1 . . 4.830 3.316 2.341 4.439 . 0 0 "[ . 1 . 2]" 1
52 1 7 PRO HD3 1 51 LEU QD . . 5.500 4.118 3.712 4.461 . 0 0 "[ . 1 . 2]" 1
53 1 8 HIS HA 1 9 PRO HD2 . . 3.240 2.439 2.306 2.628 . 0 0 "[ . 1 . 2]" 1
54 1 8 HIS HA 1 9 PRO HD3 . . 3.050 2.474 2.328 2.640 . 0 0 "[ . 1 . 2]" 1
55 1 8 HIS HA 1 9 PRO HG2 . . 4.820 4.608 4.518 4.741 . 0 0 "[ . 1 . 2]" 1
56 1 8 HIS HA 1 9 PRO HG3 . . 4.810 4.634 4.564 4.723 . 0 0 "[ . 1 . 2]" 1
57 1 8 HIS HB2 1 11 LEU H . . 4.200 4.310 4.247 4.461 0.261 13 0 "[ . 1 . 2]" 1
58 1 8 HIS HB2 1 11 LEU HB2 . . 4.870 3.848 3.414 4.235 . 0 0 "[ . 1 . 2]" 1
59 1 8 HIS HB2 1 11 LEU HB3 . . 4.620 4.445 3.996 4.895 0.275 8 0 "[ . 1 . 2]" 1
60 1 8 HIS HB2 1 11 LEU MD1 . . 5.500 4.344 3.831 4.695 . 0 0 "[ . 1 . 2]" 1
61 1 8 HIS HB2 1 67 TRP HB3 . . 3.790 3.193 2.558 3.626 . 0 0 "[ . 1 . 2]" 1
62 1 8 HIS HB3 1 11 LEU H . . 4.380 2.582 2.496 2.764 . 0 0 "[ . 1 . 2]" 1
63 1 8 HIS HB3 1 11 LEU HB3 . . 5.070 3.104 2.532 3.492 . 0 0 "[ . 1 . 2]" 1
64 1 8 HIS HB3 1 67 TRP HB3 . . 4.650 4.699 4.060 5.174 0.524 19 1 "[ . 1 . +2]" 1
65 1 8 HIS HD2 1 9 PRO HD2 . . 5.390 3.164 2.563 3.738 . 0 0 "[ . 1 . 2]" 1
66 1 8 HIS HD2 1 68 HIS HA . . 4.570 4.563 4.009 4.655 0.085 17 0 "[ . 1 . 2]" 1
67 1 8 HIS HE1 1 9 PRO HD2 . . 4.960 4.041 3.460 4.696 . 0 0 "[ . 1 . 2]" 1
68 1 8 HIS HE1 1 10 GLN H . . 4.460 3.844 3.278 4.318 . 0 0 "[ . 1 . 2]" 1
69 1 8 HIS HE1 1 10 GLN HB2 . . 4.130 2.829 2.261 3.165 . 0 0 "[ . 1 . 2]" 1
70 1 8 HIS HE1 1 10 GLN HB3 . . 4.630 4.030 2.823 4.686 0.056 7 0 "[ . 1 . 2]" 1
71 1 8 HIS HE1 1 10 GLN QG . . 3.510 2.996 2.281 3.587 0.077 12 0 "[ . 1 . 2]" 1
72 1 8 HIS HE1 1 11 LEU H . . 5.500 5.443 5.062 5.575 0.075 16 0 "[ . 1 . 2]" 1
73 1 9 PRO HA 1 11 LEU H . . 4.570 3.914 3.523 4.204 . 0 0 "[ . 1 . 2]" 1
74 1 9 PRO HD2 1 10 GLN H . . 4.930 2.745 2.315 3.501 . 0 0 "[ . 1 . 2]" 1
75 1 10 GLN H 1 10 GLN HB2 . . 3.840 2.405 2.030 2.905 . 0 0 "[ . 1 . 2]" 1
76 1 10 GLN H 1 10 GLN HB3 . . 4.090 3.525 2.925 3.907 . 0 0 "[ . 1 . 2]" 1
77 1 10 GLN H 1 10 GLN QG . . 3.760 2.955 2.022 3.834 0.074 4 0 "[ . 1 . 2]" 1
78 1 10 GLN H 1 11 LEU H . . 3.530 2.552 1.829 2.775 . 0 0 "[ . 1 . 2]" 1
79 1 10 GLN HA 1 10 GLN HE22 . . 5.480 4.852 3.358 6.122 0.642 6 1 "[ .+ 1 . 2]" 1
80 1 10 GLN HA 1 10 GLN QG . . 3.020 2.452 2.107 2.918 . 0 0 "[ . 1 . 2]" 1
81 1 10 GLN HA 1 12 ILE MD . . 5.340 3.664 2.811 5.422 0.082 18 0 "[ . 1 . 2]" 1
82 1 10 GLN HB2 1 10 GLN HE22 . . 5.160 4.714 3.761 5.303 0.143 12 0 "[ . 1 . 2]" 1
83 1 10 GLN HB2 1 11 LEU H . . 4.490 3.520 3.066 3.964 . 0 0 "[ . 1 . 2]" 1
84 1 10 GLN HB2 1 59 PHE HZ . . 4.720 3.807 2.456 4.712 . 0 0 "[ . 1 . 2]" 1
85 1 10 GLN HB3 1 59 PHE HZ . . 4.640 3.579 2.281 4.715 0.075 8 0 "[ . 1 . 2]" 1
86 1 10 GLN QG 1 11 LEU H . . 4.860 4.579 4.066 4.947 0.087 20 0 "[ . 1 . 2]" 1
87 1 11 LEU H 1 11 LEU HB2 . . 3.280 2.604 2.419 2.776 . 0 0 "[ . 1 . 2]" 1
88 1 11 LEU H 1 11 LEU HB3 . . 3.400 2.321 2.169 2.486 . 0 0 "[ . 1 . 2]" 1
89 1 11 LEU H 1 11 LEU MD1 . . 4.770 4.273 4.135 4.398 . 0 0 "[ . 1 . 2]" 1
90 1 11 LEU H 1 11 LEU MD2 . . 5.180 4.026 3.836 4.211 . 0 0 "[ . 1 . 2]" 1
91 1 11 LEU H 1 11 LEU HG . . 4.830 4.435 4.333 4.517 . 0 0 "[ . 1 . 2]" 1
92 1 11 LEU H 1 12 ILE H . . 4.830 4.554 4.385 4.698 . 0 0 "[ . 1 . 2]" 1
93 1 11 LEU HA 1 11 LEU MD1 . . 4.620 3.359 2.977 3.816 . 0 0 "[ . 1 . 2]" 1
94 1 11 LEU HA 1 11 LEU MD2 . . 4.150 3.641 3.101 3.821 . 0 0 "[ . 1 . 2]" 1
95 1 11 LEU HA 1 11 LEU HG . . 3.690 2.574 2.460 2.698 . 0 0 "[ . 1 . 2]" 1
96 1 11 LEU HA 1 12 ILE H . . 2.990 2.198 2.120 2.331 . 0 0 "[ . 1 . 2]" 1
97 1 11 LEU HA 1 12 ILE HB . . 4.710 4.592 4.103 4.761 0.051 4 0 "[ . 1 . 2]" 1
98 1 11 LEU HA 1 53 ASP HB3 . . 4.320 2.990 2.331 3.521 . 0 0 "[ . 1 . 2]" 1
99 1 11 LEU HA 1 59 PHE QE . . 4.530 2.771 2.161 3.911 . 0 0 "[ . 1 . 2]" 1
100 1 11 LEU HA 1 59 PHE HZ . . 4.220 3.426 2.748 4.261 0.041 17 0 "[ . 1 . 2]" 1
101 1 11 LEU HB2 1 12 ILE H . . 4.990 4.244 3.952 4.518 . 0 0 "[ . 1 . 2]" 1
102 1 11 LEU HB3 1 12 ILE H . . 5.020 4.327 4.042 4.517 . 0 0 "[ . 1 . 2]" 1
103 1 11 LEU MD1 1 15 ALA MB . . 4.000 2.151 2.031 2.454 . 0 0 "[ . 1 . 2]" 1
104 1 11 LEU MD1 1 51 LEU HB2 . . 4.530 3.685 3.076 4.353 . 0 0 "[ . 1 . 2]" 1
105 1 11 LEU MD1 1 51 LEU HB3 . . 4.320 2.756 2.111 3.431 . 0 0 "[ . 1 . 2]" 1
106 1 11 LEU MD1 1 51 LEU QD . . 3.620 2.065 1.844 2.479 . 0 0 "[ . 1 . 2]" 1
107 1 11 LEU MD1 1 53 ASP HB2 . . 4.970 3.608 3.053 4.720 . 0 0 "[ . 1 . 2]" 1
108 1 11 LEU MD1 1 53 ASP HB3 . . 4.370 2.638 2.021 3.898 . 0 0 "[ . 1 . 2]" 1
109 1 11 LEU MD1 1 59 PHE QD . . 4.330 2.743 2.228 4.427 0.097 20 0 "[ . 1 . 2]" 1
110 1 11 LEU MD2 1 12 ILE H . . 4.760 3.583 2.863 3.959 . 0 0 "[ . 1 . 2]" 1
111 1 11 LEU MD2 1 12 ILE HA . . 4.530 3.521 2.943 3.932 . 0 0 "[ . 1 . 2]" 1
112 1 11 LEU MD2 1 12 ILE MD . . 5.500 4.602 4.254 5.621 0.121 18 0 "[ . 1 . 2]" 1
113 1 11 LEU MD2 1 12 ILE MG . . 5.500 4.855 4.326 5.291 . 0 0 "[ . 1 . 2]" 1
114 1 11 LEU MD2 1 13 TRP H . . 4.390 3.229 2.626 4.424 0.034 18 0 "[ . 1 . 2]" 1
115 1 11 LEU MD2 1 13 TRP HA . . 4.350 3.231 2.371 3.760 . 0 0 "[ . 1 . 2]" 1
116 1 11 LEU MD2 1 13 TRP HE1 . . 5.110 3.439 2.940 3.921 . 0 0 "[ . 1 . 2]" 1
117 1 11 LEU MD2 1 13 TRP HE3 . . 5.300 3.370 2.912 3.904 . 0 0 "[ . 1 . 2]" 1
118 1 11 LEU MD2 1 13 TRP HH2 . . 5.500 3.400 3.119 3.998 . 0 0 "[ . 1 . 2]" 1
119 1 11 LEU MD2 1 13 TRP HZ3 . . 5.330 3.530 3.347 3.836 . 0 0 "[ . 1 . 2]" 1
120 1 11 LEU MD2 1 15 ALA MB . . 3.990 2.338 1.970 2.878 . 0 0 "[ . 1 . 2]" 1
121 1 11 LEU MD2 1 53 ASP HA . . 5.340 4.395 2.972 4.880 . 0 0 "[ . 1 . 2]" 1
122 1 11 LEU MD2 1 53 ASP HB2 . . 5.140 3.688 2.519 4.322 . 0 0 "[ . 1 . 2]" 1
123 1 11 LEU MD2 1 53 ASP HB3 . . 4.930 3.861 3.066 4.063 . 0 0 "[ . 1 . 2]" 1
124 1 11 LEU HG 1 12 ILE H . . 3.970 2.740 2.206 3.916 . 0 0 "[ . 1 . 2]" 1
125 1 11 LEU HG 1 53 ASP HA . . 5.380 3.747 3.132 4.215 . 0 0 "[ . 1 . 2]" 1
126 1 11 LEU HG 1 53 ASP HB2 . . 4.050 2.493 2.178 3.533 . 0 0 "[ . 1 . 2]" 1
127 1 11 LEU HG 1 53 ASP HB3 . . 3.790 2.302 2.191 2.483 . 0 0 "[ . 1 . 2]" 1
128 1 11 LEU HG 1 54 SER H . . 5.210 4.623 4.266 5.284 0.074 17 0 "[ . 1 . 2]" 1
129 1 11 LEU HG 1 59 PHE QE . . 5.090 3.754 3.260 4.394 . 0 0 "[ . 1 . 2]" 1
130 1 12 ILE H 1 12 ILE HB . . 3.470 2.569 2.378 2.783 . 0 0 "[ . 1 . 2]" 1
131 1 12 ILE H 1 12 ILE MD . . 4.370 3.626 3.244 4.200 . 0 0 "[ . 1 . 2]" 1
132 1 12 ILE H 1 12 ILE QG . . 4.120 2.759 2.238 3.843 . 0 0 "[ . 1 . 2]" 1
133 1 12 ILE H 1 12 ILE HG13 . . 4.050 4.080 3.705 4.241 0.191 8 0 "[ . 1 . 2]" 1
134 1 12 ILE H 1 12 ILE MG . . 4.300 3.770 2.262 3.956 . 0 0 "[ . 1 . 2]" 1
135 1 12 ILE H 1 53 ASP H . . 5.270 5.337 5.229 5.357 0.087 6 0 "[ . 1 . 2]" 1
136 1 12 ILE H 1 53 ASP HB2 . . 4.000 2.244 1.906 2.569 . 0 0 "[ . 1 . 2]" 1
137 1 12 ILE H 1 53 ASP HB3 . . 4.170 3.049 2.519 3.282 . 0 0 "[ . 1 . 2]" 1
138 1 12 ILE H 1 54 SER H . . 4.640 3.832 3.448 4.504 . 0 0 "[ . 1 . 2]" 1
139 1 12 ILE HA 1 12 ILE MD . . 3.270 2.324 2.125 3.380 0.110 18 0 "[ . 1 . 2]" 1
140 1 12 ILE HA 1 12 ILE QG . . 3.950 3.041 1.938 3.283 . 0 0 "[ . 1 . 2]" 1
141 1 12 ILE HA 1 12 ILE MG . . 3.120 2.459 2.269 3.220 0.100 18 0 "[ . 1 . 2]" 1
142 1 12 ILE HA 1 13 TRP H . . 2.810 2.199 2.073 2.699 . 0 0 "[ . 1 . 2]" 1
143 1 12 ILE HA 1 13 TRP HD1 . . 4.160 4.049 3.398 4.234 0.074 17 0 "[ . 1 . 2]" 1
144 1 12 ILE HB 1 13 TRP H . . 4.440 4.316 3.905 4.496 0.056 2 0 "[ . 1 . 2]" 1
145 1 12 ILE HB 1 54 SER H . . 4.600 3.682 2.848 4.647 0.047 18 0 "[ . 1 . 2]" 1
146 1 12 ILE HB 1 55 ASN H . . 4.950 3.748 2.970 4.652 . 0 0 "[ . 1 . 2]" 1
147 1 12 ILE HB 1 55 ASN HD21 . . 4.690 2.707 1.967 4.525 . 0 0 "[ . 1 . 2]" 1
148 1 12 ILE HB 1 55 ASN HD22 . . 4.770 2.911 2.160 4.710 . 0 0 "[ . 1 . 2]" 1
149 1 12 ILE MD 1 12 ILE MG . . 2.960 2.163 2.087 2.237 . 0 0 "[ . 1 . 2]" 1
150 1 12 ILE MD 1 13 TRP H . . 4.260 3.992 3.613 4.343 0.083 11 0 "[ . 1 . 2]" 1
151 1 12 ILE MD 1 55 ASN HD21 . . 4.200 4.229 3.026 4.531 0.331 20 0 "[ . 1 . 2]" 1
152 1 12 ILE MD 1 55 ASN HD22 . . 4.440 3.765 2.098 4.288 . 0 0 "[ . 1 . 2]" 1
153 1 12 ILE QG 1 12 ILE MG . . 3.110 2.244 2.176 2.305 . 0 0 "[ . 1 . 2]" 1
154 1 12 ILE QG 1 54 SER HB2 . . 5.330 5.293 3.935 5.770 0.440 15 0 "[ . 1 . 2]" 1
155 1 12 ILE QG 1 55 ASN HD21 . . 4.350 2.726 2.086 3.985 . 0 0 "[ . 1 . 2]" 1
156 1 12 ILE QG 1 55 ASN HD22 . . 4.630 2.316 1.714 3.742 . 0 0 "[ . 1 . 2]" 1
157 1 12 ILE HG13 1 55 ASN HD21 . . 4.000 3.184 2.283 4.373 0.373 18 0 "[ . 1 . 2]" 1
158 1 12 ILE HG13 1 55 ASN HD22 . . 4.280 2.436 1.839 4.053 . 0 0 "[ . 1 . 2]" 1
159 1 12 ILE MG 1 13 TRP H . . 3.620 3.097 2.487 3.526 . 0 0 "[ . 1 . 2]" 1
160 1 12 ILE MG 1 54 SER HB2 . . 4.360 3.336 1.971 4.160 . 0 0 "[ . 1 . 2]" 1
161 1 12 ILE MG 1 54 SER HB3 . . 4.090 3.509 2.596 4.173 0.083 9 0 "[ . 1 . 2]" 1
162 1 12 ILE MG 1 55 ASN HD21 . . 4.410 3.686 2.309 4.624 0.214 15 0 "[ . 1 . 2]" 1
163 1 12 ILE MG 1 55 ASN HD22 . . 5.470 3.139 2.465 4.292 . 0 0 "[ . 1 . 2]" 1
164 1 13 TRP H 1 13 TRP HB2 . . 3.480 2.608 2.458 2.820 . 0 0 "[ . 1 . 2]" 1
165 1 13 TRP H 1 13 TRP HB3 . . 3.990 3.581 3.516 3.843 . 0 0 "[ . 1 . 2]" 1
166 1 13 TRP H 1 13 TRP HD1 . . 3.850 2.611 2.226 3.023 . 0 0 "[ . 1 . 2]" 1
167 1 13 TRP H 1 13 TRP HE1 . . 5.140 4.402 3.908 5.172 0.032 18 0 "[ . 1 . 2]" 1
168 1 13 TRP HA 1 13 TRP HE3 . . 3.800 2.867 2.432 3.206 . 0 0 "[ . 1 . 2]" 1
169 1 13 TRP HA 1 14 PRO HA . . 3.360 2.440 2.368 2.553 . 0 0 "[ . 1 . 2]" 1
170 1 13 TRP HA 1 14 PRO HB2 . . 4.420 4.506 4.498 4.511 0.091 20 0 "[ . 1 . 2]" 1
171 1 13 TRP HA 1 15 ALA H . . 4.190 3.634 3.408 3.841 . 0 0 "[ . 1 . 2]" 1
172 1 13 TRP HA 1 15 ALA MB . . 4.350 3.168 2.916 3.448 . 0 0 "[ . 1 . 2]" 1
173 1 13 TRP HB2 1 13 TRP HD1 . . 3.860 2.641 2.538 2.752 . 0 0 "[ . 1 . 2]" 1
174 1 13 TRP HB2 1 14 PRO HA . . 3.500 3.576 3.553 3.586 0.086 2 0 "[ . 1 . 2]" 1
175 1 13 TRP HB2 1 30 THR HA . . 3.810 3.070 2.632 3.563 . 0 0 "[ . 1 . 2]" 1
176 1 13 TRP HB3 1 13 TRP HE3 . . 4.110 2.756 2.640 2.951 . 0 0 "[ . 1 . 2]" 1
177 1 13 TRP HB3 1 14 PRO HA . . 3.150 2.092 2.041 2.130 . 0 0 "[ . 1 . 2]" 1
178 1 13 TRP HB3 1 15 ALA H . . 4.420 4.190 3.944 4.411 . 0 0 "[ . 1 . 2]" 1
179 1 13 TRP HB3 1 15 ALA MB . . 5.440 4.576 4.273 4.733 . 0 0 "[ . 1 . 2]" 1
180 1 13 TRP HB3 1 30 THR HA . . 3.560 2.219 1.980 2.606 . 0 0 "[ . 1 . 2]" 1
181 1 13 TRP HD1 1 31 ASN H . . 5.240 3.828 3.367 4.761 . 0 0 "[ . 1 . 2]" 1
182 1 13 TRP HE1 1 31 ASN H . . 4.740 4.014 3.546 4.525 . 0 0 "[ . 1 . 2]" 1
183 1 13 TRP HE1 1 31 ASN HA . . 4.470 3.754 3.033 4.507 0.037 4 0 "[ . 1 . 2]" 1
184 1 13 TRP HE1 1 31 ASN QB . . 3.540 2.454 2.099 2.772 . 0 0 "[ . 1 . 2]" 1
185 1 13 TRP HE1 1 31 ASN HD21 . . 5.010 4.423 2.493 5.065 0.055 11 0 "[ . 1 . 2]" 1
186 1 13 TRP HE3 1 14 PRO HA . . 3.670 2.676 2.573 2.819 . 0 0 "[ . 1 . 2]" 1
187 1 13 TRP HE3 1 14 PRO HB3 . . 4.580 4.641 4.557 4.672 0.092 17 0 "[ . 1 . 2]" 1
188 1 13 TRP HE3 1 15 ALA H . . 3.700 2.742 2.488 2.990 . 0 0 "[ . 1 . 2]" 1
189 1 13 TRP HE3 1 15 ALA MB . . 3.790 2.694 2.389 2.976 . 0 0 "[ . 1 . 2]" 1
190 1 13 TRP HE3 1 28 LEU QB . . 4.240 2.916 2.611 3.616 . 0 0 "[ . 1 . 2]" 1
191 1 13 TRP HH2 1 15 ALA MB . . 5.500 3.921 3.611 4.191 . 0 0 "[ . 1 . 2]" 1
192 1 13 TRP HH2 1 28 LEU QD . . 4.520 3.746 3.192 4.381 . 0 0 "[ . 1 . 2]" 1
193 1 13 TRP HH2 1 31 ASN HA . . 5.330 3.878 3.396 4.656 . 0 0 "[ . 1 . 2]" 1
194 1 13 TRP HH2 1 34 TRP HB2 . . 4.120 2.413 2.226 2.698 . 0 0 "[ . 1 . 2]" 1
195 1 13 TRP HH2 1 34 TRP HB3 . . 4.740 3.195 2.773 3.470 . 0 0 "[ . 1 . 2]" 1
196 1 13 TRP HH2 1 34 TRP HE3 . . 4.930 3.202 2.476 4.798 . 0 0 "[ . 1 . 2]" 1
197 1 13 TRP HH2 1 51 LEU QD . . 4.880 3.804 3.203 4.396 . 0 0 "[ . 1 . 2]" 1
198 1 13 TRP HZ2 1 31 ASN HA . . 4.090 3.173 2.807 3.454 . 0 0 "[ . 1 . 2]" 1
199 1 13 TRP HZ3 1 15 ALA H . . 5.190 3.947 3.513 4.231 . 0 0 "[ . 1 . 2]" 1
200 1 13 TRP HZ3 1 15 ALA MB . . 3.610 2.312 2.107 2.797 . 0 0 "[ . 1 . 2]" 1
201 1 13 TRP HZ3 1 28 LEU QB . . 3.960 2.284 2.105 2.792 . 0 0 "[ . 1 . 2]" 1
202 1 13 TRP HZ3 1 28 LEU QD . . 3.680 2.646 2.214 3.206 . 0 0 "[ . 1 . 2]" 1
203 1 13 TRP HZ3 1 28 LEU HG . . 5.010 3.791 2.468 5.086 0.076 4 0 "[ . 1 . 2]" 1
204 1 13 TRP HZ3 1 34 TRP HB2 . . 5.300 2.968 2.517 3.518 . 0 0 "[ . 1 . 2]" 1
205 1 13 TRP HZ3 1 51 LEU QD . . 4.620 3.735 3.161 4.241 . 0 0 "[ . 1 . 2]" 1
206 1 14 PRO HA 1 15 ALA H . . 3.100 2.471 2.339 2.617 . 0 0 "[ . 1 . 2]" 1
207 1 14 PRO HA 1 15 ALA MB . . 4.700 3.910 3.711 4.025 . 0 0 "[ . 1 . 2]" 1
208 1 14 PRO HA 1 29 ARG HA . . 3.760 3.690 3.382 3.853 0.093 17 0 "[ . 1 . 2]" 1
209 1 14 PRO HA 1 106 ILE MD . . 5.380 4.345 4.051 4.506 . 0 0 "[ . 1 . 2]" 1
210 1 14 PRO HB2 1 15 ALA H . . 3.500 2.461 2.355 2.661 . 0 0 "[ . 1 . 2]" 1
211 1 14 PRO HB2 1 15 ALA HA . . 5.060 4.084 3.843 4.237 . 0 0 "[ . 1 . 2]" 1
212 1 14 PRO HB2 1 29 ARG HA . . 3.400 3.407 3.238 3.472 0.072 19 0 "[ . 1 . 2]" 1
213 1 14 PRO HB2 1 102 VAL MG1 . . 4.080 3.175 2.963 3.331 . 0 0 "[ . 1 . 2]" 1
214 1 14 PRO HB2 1 106 ILE MD . . 2.890 2.295 2.147 2.424 . 0 0 "[ . 1 . 2]" 1
215 1 14 PRO HB3 1 15 ALA H . . 3.770 3.358 3.217 3.590 . 0 0 "[ . 1 . 2]" 1
216 1 14 PRO HB3 1 15 ALA MB . . 5.500 5.306 5.121 5.442 . 0 0 "[ . 1 . 2]" 1
217 1 14 PRO HB3 1 28 LEU H . . 5.140 4.818 4.359 5.187 0.047 12 0 "[ . 1 . 2]" 1
218 1 14 PRO HB3 1 29 ARG HA . . 3.010 2.216 2.011 2.455 . 0 0 "[ . 1 . 2]" 1
219 1 14 PRO HB3 1 102 VAL MG1 . . 4.270 4.356 4.195 4.384 0.114 13 0 "[ . 1 . 2]" 1
220 1 14 PRO HB3 1 106 ILE MD . . 3.610 3.316 3.084 3.527 . 0 0 "[ . 1 . 2]" 1
221 1 14 PRO HD2 1 103 MET ME . . 4.260 3.143 2.213 4.338 0.078 16 0 "[ . 1 . 2]" 1
222 1 14 PRO HD3 1 103 MET ME . . 3.740 2.583 2.064 3.216 . 0 0 "[ . 1 . 2]" 1
223 1 14 PRO QG 1 15 ALA H . . 5.290 4.131 4.006 4.303 . 0 0 "[ . 1 . 2]" 1
224 1 14 PRO QG 1 54 SER HB2 . . 4.610 4.150 3.121 5.454 0.844 8 1 "[ . + 1 . 2]" 1
225 1 14 PRO QG 1 102 VAL MG1 . . 3.240 2.136 2.013 2.321 . 0 0 "[ . 1 . 2]" 1
226 1 14 PRO QG 1 103 MET H . . 5.130 4.007 3.382 4.380 . 0 0 "[ . 1 . 2]" 1
227 1 14 PRO QG 1 103 MET HA . . 4.130 2.710 2.227 3.331 . 0 0 "[ . 1 . 2]" 1
228 1 14 PRO QG 1 103 MET ME . . 4.520 2.416 2.070 3.037 . 0 0 "[ . 1 . 2]" 1
229 1 14 PRO QG 1 106 ILE MD . . 3.730 3.406 3.233 3.478 . 0 0 "[ . 1 . 2]" 1
230 1 14 PRO QG 1 106 ILE HG13 . . 3.070 2.374 2.235 2.523 . 0 0 "[ . 1 . 2]" 1
231 1 15 ALA H 1 15 ALA MB . . 3.430 2.640 2.575 2.704 . 0 0 "[ . 1 . 2]" 1
232 1 15 ALA H 1 28 LEU H . . 3.900 3.059 2.881 3.248 . 0 0 "[ . 1 . 2]" 1
233 1 15 ALA H 1 28 LEU QB . . 4.290 2.782 2.536 3.060 . 0 0 "[ . 1 . 2]" 1
234 1 15 ALA H 1 28 LEU QD . . 5.090 4.042 3.738 4.220 . 0 0 "[ . 1 . 2]" 1
235 1 15 ALA H 1 102 VAL MG1 . . 4.640 4.366 4.115 4.655 0.015 13 0 "[ . 1 . 2]" 1
236 1 15 ALA H 1 106 ILE MD . . 3.960 3.181 2.900 3.619 . 0 0 "[ . 1 . 2]" 1
237 1 15 ALA HA 1 16 LEU H . . 2.970 2.385 2.258 2.488 . 0 0 "[ . 1 . 2]" 1
238 1 15 ALA HA 1 16 LEU HB2 . . 4.890 4.003 3.767 4.151 . 0 0 "[ . 1 . 2]" 1
239 1 15 ALA HA 1 16 LEU HG . . 4.390 4.094 3.650 4.485 0.095 18 0 "[ . 1 . 2]" 1
240 1 15 ALA HA 1 53 ASP HA . . 3.090 2.300 2.111 2.504 . 0 0 "[ . 1 . 2]" 1
241 1 15 ALA HA 1 53 ASP HB2 . . 4.530 4.243 3.966 4.593 0.063 20 0 "[ . 1 . 2]" 1
242 1 15 ALA HA 1 53 ASP HB3 . . 4.940 4.472 4.066 4.874 . 0 0 "[ . 1 . 2]" 1
243 1 15 ALA HA 1 54 SER H . . 4.570 4.129 3.694 4.528 . 0 0 "[ . 1 . 2]" 1
244 1 15 ALA HA 1 102 VAL MG1 . . 3.470 3.394 3.037 3.565 0.095 3 0 "[ . 1 . 2]" 1
245 1 15 ALA MB 1 16 LEU H . . 3.060 2.250 2.138 2.377 . 0 0 "[ . 1 . 2]" 1
246 1 15 ALA MB 1 16 LEU HA . . 5.230 4.056 3.915 4.167 . 0 0 "[ . 1 . 2]" 1
247 1 15 ALA MB 1 28 LEU H . . 5.050 4.079 3.704 4.487 . 0 0 "[ . 1 . 2]" 1
248 1 15 ALA MB 1 28 LEU QB . . 3.740 2.634 2.243 3.245 . 0 0 "[ . 1 . 2]" 1
249 1 15 ALA MB 1 28 LEU QD . . 3.480 2.752 2.254 3.184 . 0 0 "[ . 1 . 2]" 1
250 1 15 ALA MB 1 51 LEU HA . . 4.360 4.440 4.292 4.480 0.120 18 0 "[ . 1 . 2]" 1
251 1 15 ALA MB 1 51 LEU HB3 . . 5.000 3.809 3.111 4.715 . 0 0 "[ . 1 . 2]" 1
252 1 15 ALA MB 1 51 LEU QD . . 3.860 2.231 1.946 2.805 . 0 0 "[ . 1 . 2]" 1
253 1 15 ALA MB 1 53 ASP HA . . 3.310 2.913 2.376 3.212 . 0 0 "[ . 1 . 2]" 1
254 1 15 ALA MB 1 53 ASP HB2 . . 4.400 3.688 3.236 4.293 . 0 0 "[ . 1 . 2]" 1
255 1 15 ALA MB 1 53 ASP HB3 . . 4.630 3.655 3.138 4.123 . 0 0 "[ . 1 . 2]" 1
256 1 15 ALA MB 1 54 SER H . . 4.570 4.480 4.013 4.681 0.111 15 0 "[ . 1 . 2]" 1
257 1 16 LEU H 1 16 LEU HB2 . . 3.140 2.543 2.301 2.694 . 0 0 "[ . 1 . 2]" 1
258 1 16 LEU H 1 16 LEU HB3 . . 3.840 3.653 3.529 3.726 . 0 0 "[ . 1 . 2]" 1
259 1 16 LEU H 1 16 LEU HG . . 3.920 3.649 3.432 4.002 0.082 18 0 "[ . 1 . 2]" 1
260 1 16 LEU H 1 17 LEU H . . 4.380 3.985 3.631 4.200 . 0 0 "[ . 1 . 2]" 1
261 1 16 LEU H 1 28 LEU QD . . 4.260 4.120 3.798 4.311 0.051 7 0 "[ . 1 . 2]" 1
262 1 16 LEU H 1 51 LEU QD . . 5.240 2.995 2.498 3.520 . 0 0 "[ . 1 . 2]" 1
263 1 16 LEU H 1 52 VAL HB . . 4.010 3.690 3.255 4.071 0.061 8 0 "[ . 1 . 2]" 1
264 1 16 LEU H 1 53 ASP HA . . 4.000 3.832 3.512 3.991 . 0 0 "[ . 1 . 2]" 1
265 1 16 LEU HA 1 16 LEU QD . . 2.980 2.116 1.956 2.367 . 0 0 "[ . 1 . 2]" 1
266 1 16 LEU HA 1 16 LEU HG . . 4.090 2.712 2.287 3.744 . 0 0 "[ . 1 . 2]" 1
267 1 16 LEU HA 1 17 LEU H . . 2.890 2.155 2.093 2.229 . 0 0 "[ . 1 . 2]" 1
268 1 16 LEU HA 1 27 PRO HA . . 3.600 2.900 2.628 3.354 . 0 0 "[ . 1 . 2]" 1
269 1 16 LEU HA 1 28 LEU H . . 3.960 3.567 3.215 3.962 0.002 2 0 "[ . 1 . 2]" 1
270 1 16 LEU HA 1 28 LEU QD . . 4.960 3.386 2.991 3.761 . 0 0 "[ . 1 . 2]" 1
271 1 16 LEU HA 1 51 LEU QD . . 5.420 3.998 3.595 4.444 . 0 0 "[ . 1 . 2]" 1
272 1 16 LEU HB2 1 52 VAL H . . 4.230 3.526 2.739 3.953 . 0 0 "[ . 1 . 2]" 1
273 1 16 LEU HB2 1 52 VAL HB . . 4.140 2.651 2.071 3.502 . 0 0 "[ . 1 . 2]" 1
274 1 16 LEU HB3 1 17 LEU H . . 4.080 3.829 3.663 4.004 . 0 0 "[ . 1 . 2]" 1
275 1 16 LEU HB3 1 26 LEU H . . 5.170 4.528 3.956 4.844 . 0 0 "[ . 1 . 2]" 1
276 1 16 LEU QD 1 17 LEU H . . 4.210 3.449 3.271 3.627 . 0 0 "[ . 1 . 2]" 1
277 1 16 LEU QD 1 17 LEU HA . . 5.410 5.213 5.120 5.240 . 0 0 "[ . 1 . 2]" 1
278 1 16 LEU QD 1 27 PRO HA . . 3.040 2.190 1.909 2.633 . 0 0 "[ . 1 . 2]" 1
279 1 16 LEU QD 1 27 PRO HB3 . . 3.560 2.494 2.170 3.539 . 0 0 "[ . 1 . 2]" 1
280 1 16 LEU QD 1 27 PRO QD . . 5.060 3.196 2.807 4.218 . 0 0 "[ . 1 . 2]" 1
281 1 17 LEU H 1 17 LEU HB2 . . 3.730 2.659 2.306 2.945 . 0 0 "[ . 1 . 2]" 1
282 1 17 LEU H 1 17 LEU HB3 . . 3.250 2.445 2.290 2.686 . 0 0 "[ . 1 . 2]" 1
283 1 17 LEU H 1 17 LEU MD2 . . 4.850 4.223 3.919 4.420 . 0 0 "[ . 1 . 2]" 1
284 1 17 LEU H 1 17 LEU HG . . 4.980 4.474 4.347 4.579 . 0 0 "[ . 1 . 2]" 1
285 1 17 LEU H 1 18 LYS H . . 4.720 4.646 4.537 4.739 0.019 4 0 "[ . 1 . 2]" 1
286 1 17 LEU H 1 26 LEU H . . 3.730 3.110 2.874 3.466 . 0 0 "[ . 1 . 2]" 1
287 1 17 LEU H 1 26 LEU HB2 . . 4.730 3.853 3.381 4.782 0.052 15 0 "[ . 1 . 2]" 1
288 1 17 LEU H 1 26 LEU HB3 . . 4.110 3.065 2.432 3.330 . 0 0 "[ . 1 . 2]" 1
289 1 17 LEU H 1 27 PRO HA . . 4.390 4.239 4.013 4.461 0.071 18 0 "[ . 1 . 2]" 1
290 1 17 LEU H 1 28 LEU QD . . 4.140 2.784 2.398 3.145 . 0 0 "[ . 1 . 2]" 1
291 1 17 LEU H 1 51 LEU QD . . 5.210 3.232 2.897 3.632 . 0 0 "[ . 1 . 2]" 1
292 1 17 LEU HA 1 17 LEU MD1 . . 3.080 2.402 2.260 2.705 . 0 0 "[ . 1 . 2]" 1
293 1 17 LEU HA 1 17 LEU MD2 . . 4.550 3.896 2.513 4.020 . 0 0 "[ . 1 . 2]" 1
294 1 17 LEU HA 1 17 LEU HG . . 4.170 3.045 2.843 3.740 . 0 0 "[ . 1 . 2]" 1
295 1 17 LEU HA 1 18 LYS H . . 2.850 2.393 2.294 2.492 . 0 0 "[ . 1 . 2]" 1
296 1 17 LEU HA 1 51 LEU QD . . 3.640 2.301 2.000 2.440 . 0 0 "[ . 1 . 2]" 1
297 1 17 LEU HB2 1 17 LEU MD2 . . 3.190 2.502 2.179 2.626 . 0 0 "[ . 1 . 2]" 1
298 1 17 LEU HB2 1 18 LYS H . . 4.700 4.263 3.975 4.338 . 0 0 "[ . 1 . 2]" 1
299 1 17 LEU HB2 1 26 LEU HB3 . . 4.070 3.356 2.652 3.786 . 0 0 "[ . 1 . 2]" 1
300 1 17 LEU HB2 1 28 LEU QD . . 3.530 2.650 2.382 3.001 . 0 0 "[ . 1 . 2]" 1
301 1 17 LEU HB2 1 51 LEU QD . . 3.340 2.431 2.205 2.806 . 0 0 "[ . 1 . 2]" 1
302 1 17 LEU HB3 1 17 LEU MD1 . . 3.410 3.176 2.649 3.231 . 0 0 "[ . 1 . 2]" 1
303 1 17 LEU HB3 1 17 LEU MD2 . . 3.310 2.286 2.181 3.176 . 0 0 "[ . 1 . 2]" 1
304 1 17 LEU HB3 1 26 LEU H . . 3.890 3.352 2.783 3.939 0.049 18 0 "[ . 1 . 2]" 1
305 1 17 LEU HB3 1 26 LEU HB2 . . 3.470 2.491 2.151 3.519 0.049 15 0 "[ . 1 . 2]" 1
306 1 17 LEU HB3 1 26 LEU HB3 . . 3.640 2.195 2.030 2.648 . 0 0 "[ . 1 . 2]" 1
307 1 17 LEU HB3 1 51 LEU QD . . 3.890 3.708 3.491 3.948 0.058 5 0 "[ . 1 . 2]" 1
308 1 17 LEU MD1 1 18 LYS H . . 3.210 2.798 1.625 3.236 0.026 9 0 "[ . 1 . 2]" 1
309 1 17 LEU MD1 1 19 GLN H . . 5.500 4.490 2.160 4.994 . 0 0 "[ . 1 . 2]" 1
310 1 17 LEU MD1 1 19 GLN HA . . 4.900 3.963 2.490 4.592 . 0 0 "[ . 1 . 2]" 1
311 1 17 LEU MD1 1 19 GLN QE . . 5.380 4.072 3.275 4.910 . 0 0 "[ . 1 . 2]" 1
312 1 17 LEU MD1 1 19 GLN HG2 . . 4.200 3.543 2.008 4.187 . 0 0 "[ . 1 . 2]" 1
313 1 17 LEU MD1 1 34 TRP HH2 . . 4.970 3.234 2.431 4.190 . 0 0 "[ . 1 . 2]" 1
314 1 17 LEU MD1 1 34 TRP HZ3 . . 4.780 2.671 2.137 4.243 . 0 0 "[ . 1 . 2]" 1
315 1 17 LEU MD1 1 45 LEU MD2 . . 4.010 3.054 2.033 3.754 . 0 0 "[ . 1 . 2]" 1
316 1 17 LEU MD1 1 49 ASP HB2 . . 4.200 3.437 2.861 3.811 . 0 0 "[ . 1 . 2]" 1
317 1 17 LEU MD1 1 49 ASP HB3 . . 3.530 2.170 2.011 2.462 . 0 0 "[ . 1 . 2]" 1
318 1 17 LEU MD1 1 50 LYS H . . 4.310 4.285 4.022 4.396 0.086 17 0 "[ . 1 . 2]" 1
319 1 17 LEU MD1 1 51 LEU QD . . 3.510 2.355 1.953 3.558 0.048 5 0 "[ . 1 . 2]" 1
320 1 17 LEU MD1 1 67 TRP HH2 . . 3.460 2.393 2.094 3.180 . 0 0 "[ . 1 . 2]" 1
321 1 17 LEU MD1 1 67 TRP HZ2 . . 4.590 3.128 2.624 4.420 . 0 0 "[ . 1 . 2]" 1
322 1 17 LEU MD1 1 67 TRP HZ3 . . 4.380 3.976 3.534 4.682 0.302 5 0 "[ . 1 . 2]" 1
323 1 17 LEU MD2 1 18 LYS H . . 4.700 4.137 3.300 4.381 . 0 0 "[ . 1 . 2]" 1
324 1 17 LEU MD2 1 19 GLN H . . 5.020 3.892 3.388 4.910 . 0 0 "[ . 1 . 2]" 1
325 1 17 LEU MD2 1 19 GLN HA . . 5.040 4.142 3.557 4.708 . 0 0 "[ . 1 . 2]" 1
326 1 17 LEU MD2 1 19 GLN HB3 . . 5.090 4.921 4.419 6.085 0.995 5 1 "[ + 1 . 2]" 1
327 1 17 LEU MD2 1 19 GLN HG2 . . 4.000 2.678 2.049 3.941 . 0 0 "[ . 1 . 2]" 1
328 1 17 LEU MD2 1 26 LEU H . . 5.130 4.639 4.126 5.496 0.366 5 0 "[ . 1 . 2]" 1
329 1 17 LEU MD2 1 34 TRP HH2 . . 5.140 3.942 2.085 5.210 0.070 19 0 "[ . 1 . 2]" 1
330 1 17 LEU MD2 1 34 TRP HZ3 . . 4.130 3.080 2.044 4.183 0.053 17 0 "[ . 1 . 2]" 1
331 1 17 LEU MD2 1 45 LEU HA . . 5.030 4.574 3.855 5.110 0.080 6 0 "[ . 1 . 2]" 1
332 1 17 LEU MD2 1 45 LEU MD2 . . 3.450 2.768 2.151 3.475 0.025 7 0 "[ . 1 . 2]" 1
333 1 17 LEU MD2 1 49 ASP HB3 . . 4.960 3.686 2.924 4.162 . 0 0 "[ . 1 . 2]" 1
334 1 17 LEU MD2 1 51 LEU QD . . 5.340 3.587 1.917 3.864 . 0 0 "[ . 1 . 2]" 1
335 1 17 LEU HG 1 18 LYS H . . 3.440 2.594 2.282 3.544 0.104 5 0 "[ . 1 . 2]" 1
336 1 17 LEU HG 1 19 GLN H . . 3.870 3.290 2.945 3.961 0.091 5 0 "[ . 1 . 2]" 1
337 1 17 LEU HG 1 19 GLN HG2 . . 3.980 3.144 2.420 3.616 . 0 0 "[ . 1 . 2]" 1
338 1 17 LEU HG 1 19 GLN HG3 . . 4.520 3.842 2.481 4.585 0.065 12 0 "[ . 1 . 2]" 1
339 1 17 LEU HG 1 26 LEU H . . 5.220 4.884 4.399 5.260 0.040 18 0 "[ . 1 . 2]" 1
340 1 17 LEU HG 1 51 LEU QD . . 5.410 4.127 3.895 4.346 . 0 0 "[ . 1 . 2]" 1
341 1 18 LYS H 1 18 LYS HB2 . . 3.330 3.097 2.879 3.402 0.072 5 0 "[ . 1 . 2]" 1
342 1 18 LYS H 1 18 LYS HB3 . . 3.680 3.278 3.063 3.483 . 0 0 "[ . 1 . 2]" 1
343 1 18 LYS H 1 18 LYS QE . . 5.260 4.807 4.354 5.133 . 0 0 "[ . 1 . 2]" 1
344 1 18 LYS H 1 18 LYS QG . . 4.320 4.314 4.203 4.408 0.088 5 0 "[ . 1 . 2]" 1
345 1 18 LYS H 1 19 GLN H . . 4.400 3.610 3.177 3.784 . 0 0 "[ . 1 . 2]" 1
346 1 18 LYS H 1 50 LYS HB2 . . 5.040 4.924 4.555 5.129 0.089 5 0 "[ . 1 . 2]" 1
347 1 18 LYS H 1 50 LYS HB3 . . 4.540 3.447 3.159 3.858 . 0 0 "[ . 1 . 2]" 1
348 1 18 LYS H 1 51 LEU HA . . 4.430 4.045 3.389 4.500 0.070 18 0 "[ . 1 . 2]" 1
349 1 18 LYS H 1 51 LEU QD . . 4.350 4.190 3.781 4.351 0.001 2 0 "[ . 1 . 2]" 1
350 1 18 LYS HA 1 18 LYS HB3 . . 3.010 3.014 2.972 3.052 0.042 7 0 "[ . 1 . 2]" 1
351 1 18 LYS HA 1 18 LYS QG . . 3.670 2.230 2.101 2.318 . 0 0 "[ . 1 . 2]" 1
352 1 18 LYS HA 1 19 GLN H . . 2.930 2.219 2.095 2.317 . 0 0 "[ . 1 . 2]" 1
353 1 18 LYS HB3 1 18 LYS HD3 . . 4.110 3.752 3.658 3.834 . 0 0 "[ . 1 . 2]" 1
354 1 18 LYS HB3 1 18 LYS QE . . 3.580 2.115 2.012 2.281 . 0 0 "[ . 1 . 2]" 1
355 1 18 LYS HB3 1 19 GLN H . . 4.630 4.397 4.244 4.553 . 0 0 "[ . 1 . 2]" 1
356 1 18 LYS HD2 1 19 GLN H . . 4.410 3.288 2.945 3.968 . 0 0 "[ . 1 . 2]" 1
357 1 18 LYS HD2 1 23 ASN HA . . 3.670 3.392 2.926 3.744 0.074 6 0 "[ . 1 . 2]" 1
358 1 18 LYS HD3 1 23 ASN HA . . 3.720 2.266 2.097 2.632 . 0 0 "[ . 1 . 2]" 1
359 1 18 LYS QE 1 23 ASN HA . . 3.070 3.067 2.794 3.107 0.037 7 0 "[ . 1 . 2]" 1
360 1 18 LYS QG 1 19 GLN H . . 4.450 4.022 3.797 4.190 . 0 0 "[ . 1 . 2]" 1
361 1 18 LYS QG 1 24 GLU HA . . 5.260 4.793 4.345 5.300 0.040 2 0 "[ . 1 . 2]" 1
362 1 18 LYS QG 1 25 LEU H . . 3.950 3.949 3.614 4.051 0.101 16 0 "[ . 1 . 2]" 1
363 1 18 LYS QG 1 25 LEU HA . . 2.720 2.267 2.056 2.457 . 0 0 "[ . 1 . 2]" 1
364 1 18 LYS QG 1 26 LEU H . . 4.000 3.997 3.724 4.099 0.099 20 0 "[ . 1 . 2]" 1
365 1 19 GLN H 1 19 GLN HB2 . . 3.840 2.462 1.999 2.988 . 0 0 "[ . 1 . 2]" 1
366 1 19 GLN H 1 19 GLN HB3 . . 3.790 3.545 3.228 3.686 . 0 0 "[ . 1 . 2]" 1
367 1 19 GLN H 1 19 GLN HG2 . . 3.460 2.979 2.344 3.533 0.073 12 0 "[ . 1 . 2]" 1
368 1 19 GLN H 1 19 GLN HG3 . . 4.480 2.715 2.151 3.887 . 0 0 "[ . 1 . 2]" 1
369 1 19 GLN H 1 20 GLN H . . 5.020 4.636 4.541 4.719 . 0 0 "[ . 1 . 2]" 1
370 1 19 GLN H 1 22 CYS H . . 5.110 4.969 4.342 5.190 0.080 1 0 "[ . 1 . 2]" 1
371 1 19 GLN H 1 22 CYS HB2 . . 4.680 3.930 3.171 4.804 0.124 18 0 "[ . 1 . 2]" 1
372 1 19 GLN H 1 22 CYS HB3 . . 4.720 4.530 3.895 4.806 0.086 17 0 "[ . 1 . 2]" 1
373 1 19 GLN HA 1 19 GLN HG2 . . 3.280 2.349 2.169 2.587 . 0 0 "[ . 1 . 2]" 1
374 1 19 GLN HA 1 19 GLN HG3 . . 3.480 3.415 3.078 3.566 0.086 14 0 "[ . 1 . 2]" 1
375 1 19 GLN HA 1 20 GLN H . . 2.930 2.264 2.148 2.485 . 0 0 "[ . 1 . 2]" 1
376 1 19 GLN HA 1 49 ASP HB2 . . 4.750 4.484 4.237 4.829 0.079 11 0 "[ . 1 . 2]" 1
377 1 19 GLN HA 1 49 ASP HB3 . . 4.010 3.586 2.910 4.088 0.078 14 0 "[ . 1 . 2]" 1
378 1 19 GLN HB2 1 20 GLN H . . 4.660 4.025 3.495 4.468 . 0 0 "[ . 1 . 2]" 1
379 1 19 GLN HB2 1 22 CYS HB2 . . 3.830 2.596 2.050 3.901 0.071 18 0 "[ . 1 . 2]" 1
380 1 19 GLN HB2 1 22 CYS HB3 . . 3.840 3.502 2.338 3.914 0.074 16 0 "[ . 1 . 2]" 1
381 1 19 GLN HB3 1 19 GLN QE . . 4.530 3.116 2.694 3.880 . 0 0 "[ . 1 . 2]" 1
382 1 19 GLN HB3 1 20 GLN H . . 3.410 2.906 2.389 3.486 0.076 12 0 "[ . 1 . 2]" 1
383 1 19 GLN HB3 1 22 CYS HB2 . . 4.080 3.661 2.182 4.794 0.714 18 1 "[ . 1 . + 2]" 1
384 1 19 GLN QE 1 44 LEU QB . . 5.180 2.787 1.687 4.145 . 0 0 "[ . 1 . 2]" 1
385 1 19 GLN QE 1 45 LEU HA . . 3.670 2.655 2.283 2.980 . 0 0 "[ . 1 . 2]" 1
386 1 19 GLN QE 1 45 LEU MD2 . . 4.130 3.016 2.002 3.619 . 0 0 "[ . 1 . 2]" 1
387 1 19 GLN QE 1 46 GLN H . . 4.550 3.240 2.257 4.079 . 0 0 "[ . 1 . 2]" 1
388 1 19 GLN HG2 1 20 GLN H . . 4.560 4.118 3.568 4.609 0.049 14 0 "[ . 1 . 2]" 1
389 1 20 GLN H 1 20 GLN QB . . 2.950 2.109 1.901 2.321 . 0 0 "[ . 1 . 2]" 1
390 1 20 GLN H 1 20 GLN QG . . 3.710 3.591 2.683 3.816 0.106 18 0 "[ . 1 . 2]" 1
391 1 20 GLN H 1 21 GLY H . . 4.400 4.166 2.606 4.485 0.085 7 0 "[ . 1 . 2]" 1
392 1 20 GLN H 1 22 CYS H . . 5.020 4.475 4.181 4.711 . 0 0 "[ . 1 . 2]" 1
393 1 20 GLN H 1 46 GLN QE . . 4.640 3.263 2.533 4.344 . 0 0 "[ . 1 . 2]" 1
394 1 20 GLN H 1 49 ASP H . . 4.670 4.646 4.199 4.760 0.090 7 0 "[ . 1 . 2]" 1
395 1 20 GLN H 1 49 ASP HA . . 3.620 2.461 2.089 2.987 . 0 0 "[ . 1 . 2]" 1
396 1 20 GLN HA 1 20 GLN QB . . 2.700 2.504 2.129 2.584 . 0 0 "[ . 1 . 2]" 1
397 1 20 GLN HA 1 20 GLN QG . . 3.760 2.314 2.038 3.546 . 0 0 "[ . 1 . 2]" 1
398 1 20 GLN HA 1 21 GLY H . . 3.170 2.233 2.008 3.257 0.087 16 0 "[ . 1 . 2]" 1
399 1 20 GLN HA 1 22 CYS H . . 3.920 3.881 3.452 4.010 0.090 13 0 "[ . 1 . 2]" 1
400 1 20 GLN QB 1 21 GLY H . . 4.200 3.690 3.299 4.082 . 0 0 "[ . 1 . 2]" 1
401 1 20 GLN QB 1 22 CYS H . . 5.430 4.887 4.521 5.133 . 0 0 "[ . 1 . 2]" 1
402 1 20 GLN QB 1 46 GLN QE . . 4.520 3.562 2.714 4.183 . 0 0 "[ . 1 . 2]" 1
403 1 20 GLN QB 1 48 GLY HA3 . . 4.290 3.699 2.813 4.371 0.081 2 0 "[ . 1 . 2]" 1
404 1 20 GLN HE21 1 48 GLY HA3 . . 5.010 3.522 1.941 5.077 0.067 5 0 "[ . 1 . 2]" 1
405 1 20 GLN QG 1 21 GLY H . . 4.620 3.561 2.679 4.550 . 0 0 "[ . 1 . 2]" 1
406 1 20 GLN QG 1 21 GLY HA2 . . 4.940 4.769 3.805 5.473 0.533 5 1 "[ + 1 . 2]" 1
407 1 20 GLN QG 1 48 GLY HA2 . . 4.850 4.543 3.644 4.942 0.092 3 0 "[ . 1 . 2]" 1
408 1 20 GLN QG 1 48 GLY HA3 . . 4.550 3.360 2.090 4.042 . 0 0 "[ . 1 . 2]" 1
409 1 21 GLY H 1 22 CYS H . . 3.390 2.749 2.273 3.446 0.056 20 0 "[ . 1 . 2]" 1
410 1 22 CYS H 1 22 CYS HB2 . . 3.420 2.496 2.110 3.562 0.142 18 0 "[ . 1 . 2]" 1
411 1 22 CYS H 1 22 CYS HB3 . . 3.480 3.344 2.425 3.558 0.078 9 0 "[ . 1 . 2]" 1
412 1 22 CYS H 1 23 ASN H . . 5.110 4.127 2.415 4.587 . 0 0 "[ . 1 . 2]" 1
413 1 22 CYS HA 1 22 CYS HB3 . . 3.020 2.675 2.420 3.053 0.033 12 0 "[ . 1 . 2]" 1
414 1 22 CYS HA 1 23 ASN HD22 . . 3.690 3.796 3.721 4.508 0.818 4 1 "[ +. 1 . 2]" 1
415 1 22 CYS HB2 1 24 GLU H . . 4.000 3.968 2.523 4.086 0.086 16 0 "[ . 1 . 2]" 1
416 1 22 CYS HB3 1 24 GLU H . . 4.080 2.781 2.393 4.080 0.000 18 0 "[ . 1 . 2]" 1
417 1 23 ASN H 1 24 GLU H . . 3.650 2.053 1.669 3.176 . 0 0 "[ . 1 . 2]" 1
418 1 23 ASN H 1 88 THR MG . . 5.080 4.210 3.537 5.157 0.077 13 0 "[ . 1 . 2]" 1
419 1 23 ASN HA 1 84 ALA MB . . 3.500 2.423 2.120 2.894 . 0 0 "[ . 1 . 2]" 1
420 1 23 ASN HB2 1 23 ASN HD21 . . 3.330 2.476 2.162 3.400 0.070 16 0 "[ . 1 . 2]" 1
421 1 23 ASN HB2 1 24 GLU H . . 3.920 3.233 2.774 3.837 . 0 0 "[ . 1 . 2]" 1
422 1 23 ASN HB2 1 84 ALA HA . . 4.520 4.492 3.649 5.187 0.667 6 1 "[ .+ 1 . 2]" 1
423 1 23 ASN HB2 1 84 ALA MB . . 3.390 3.293 2.169 3.687 0.297 6 0 "[ . 1 . 2]" 1
424 1 23 ASN HB2 1 85 HIS H . . 5.070 5.016 4.319 5.825 0.755 6 1 "[ .+ 1 . 2]" 1
425 1 23 ASN HB2 1 85 HIS HA . . 4.060 3.881 3.366 4.340 0.280 6 0 "[ . 1 . 2]" 1
426 1 23 ASN HB2 1 88 THR H . . 4.980 4.358 3.974 4.745 . 0 0 "[ . 1 . 2]" 1
427 1 23 ASN HB2 1 88 THR HB . . 4.170 2.643 2.184 3.218 . 0 0 "[ . 1 . 2]" 1
428 1 23 ASN HB2 1 88 THR MG . . 3.410 2.443 2.127 3.070 . 0 0 "[ . 1 . 2]" 1
429 1 23 ASN HD21 1 84 ALA MB . . 4.920 4.800 3.962 5.000 0.080 12 0 "[ . 1 . 2]" 1
430 1 23 ASN HD21 1 88 THR HB . . 5.040 3.674 2.970 4.783 . 0 0 "[ . 1 . 2]" 1
431 1 23 ASN HD21 1 88 THR MG . . 5.500 3.826 3.111 5.202 . 0 0 "[ . 1 . 2]" 1
432 1 23 ASN HD22 1 84 ALA MB . . 5.060 5.125 4.939 5.173 0.113 14 0 "[ . 1 . 2]" 1
433 1 23 ASN HD22 1 88 THR MG . . 5.500 4.963 4.582 5.538 0.038 6 0 "[ . 1 . 2]" 1
434 1 24 GLU H 1 24 GLU HB2 . . 3.110 2.314 2.086 2.640 . 0 0 "[ . 1 . 2]" 1
435 1 24 GLU H 1 24 GLU HB3 . . 3.180 2.493 2.183 2.925 . 0 0 "[ . 1 . 2]" 1
436 1 24 GLU H 1 24 GLU QG . . 4.030 3.888 3.730 4.004 . 0 0 "[ . 1 . 2]" 1
437 1 24 GLU H 1 84 ALA MB . . 4.930 4.790 4.617 5.003 0.073 4 0 "[ . 1 . 2]" 1
438 1 24 GLU H 1 85 HIS HA . . 4.950 4.489 3.914 4.755 . 0 0 "[ . 1 . 2]" 1
439 1 24 GLU H 1 88 THR MG . . 4.150 3.347 2.826 3.766 . 0 0 "[ . 1 . 2]" 1
440 1 24 GLU HA 1 24 GLU QG . . 3.540 2.387 2.240 2.568 . 0 0 "[ . 1 . 2]" 1
441 1 24 GLU HA 1 25 LEU H . . 2.850 2.245 2.155 2.383 . 0 0 "[ . 1 . 2]" 1
442 1 24 GLU HA 1 25 LEU QD . . 4.100 3.917 3.370 4.127 0.027 8 0 "[ . 1 . 2]" 1
443 1 24 GLU HA 1 85 HIS HA . . 3.380 2.552 2.206 2.876 . 0 0 "[ . 1 . 2]" 1
444 1 24 GLU HA 1 85 HIS QB . . 4.570 2.830 2.300 3.165 . 0 0 "[ . 1 . 2]" 1
445 1 24 GLU HA 1 88 THR MG . . 4.340 3.066 2.742 3.448 . 0 0 "[ . 1 . 2]" 1
446 1 24 GLU HA 1 89 LEU QD . . 5.030 4.271 3.676 4.595 . 0 0 "[ . 1 . 2]" 1
447 1 24 GLU HB2 1 88 THR MG . . 3.910 3.065 2.581 3.639 . 0 0 "[ . 1 . 2]" 1
448 1 24 GLU HB3 1 25 LEU H . . 4.830 4.148 3.599 4.529 . 0 0 "[ . 1 . 2]" 1
449 1 24 GLU QG 1 25 LEU H . . 4.300 2.885 2.128 3.841 . 0 0 "[ . 1 . 2]" 1
450 1 24 GLU QG 1 88 THR MG . . 3.660 3.618 2.891 3.776 0.116 3 0 "[ . 1 . 2]" 1
451 1 24 GLU QG 1 89 LEU QD . . 4.050 3.201 2.328 3.778 . 0 0 "[ . 1 . 2]" 1
452 1 25 LEU H 1 25 LEU HB2 . . 3.650 2.350 2.168 2.978 . 0 0 "[ . 1 . 2]" 1
453 1 25 LEU H 1 25 LEU HB3 . . 4.080 3.560 3.441 3.803 . 0 0 "[ . 1 . 2]" 1
454 1 25 LEU H 1 25 LEU QD . . 3.910 2.783 2.360 3.274 . 0 0 "[ . 1 . 2]" 1
455 1 25 LEU H 1 85 HIS HA . . 4.800 3.611 3.039 4.611 . 0 0 "[ . 1 . 2]" 1
456 1 25 LEU H 1 85 HIS QB . . 4.620 2.134 1.636 3.133 . 0 0 "[ . 1 . 2]" 1
457 1 25 LEU H 1 89 LEU QD . . 5.290 4.969 4.493 5.180 . 0 0 "[ . 1 . 2]" 1
458 1 25 LEU H 1 109 LEU QD . . 5.500 3.768 3.404 4.288 . 0 0 "[ . 1 . 2]" 1
459 1 25 LEU HA 1 25 LEU QD . . 3.690 2.314 1.969 2.774 . 0 0 "[ . 1 . 2]" 1
460 1 25 LEU HA 1 26 LEU H . . 2.980 2.198 2.090 2.327 . 0 0 "[ . 1 . 2]" 1
461 1 25 LEU HB2 1 26 LEU H . . 4.160 3.998 3.354 4.228 0.068 15 0 "[ . 1 . 2]" 1
462 1 25 LEU HB2 1 85 HIS QB . . 4.510 2.797 2.157 4.241 . 0 0 "[ . 1 . 2]" 1
463 1 25 LEU HB2 1 85 HIS HE1 . . 4.710 4.594 3.291 4.782 0.072 19 0 "[ . 1 . 2]" 1
464 1 25 LEU HB2 1 109 LEU QD . . 4.160 2.410 2.166 2.946 . 0 0 "[ . 1 . 2]" 1
465 1 25 LEU HB3 1 26 LEU H . . 3.690 2.880 2.414 3.140 . 0 0 "[ . 1 . 2]" 1
466 1 25 LEU HB3 1 109 LEU QD . . 4.700 2.848 2.381 3.681 . 0 0 "[ . 1 . 2]" 1
467 1 25 LEU QD 1 26 LEU H . . 5.250 3.043 2.406 4.091 . 0 0 "[ . 1 . 2]" 1
468 1 25 LEU QD 1 81 LEU HA . . 5.000 3.509 2.955 4.255 . 0 0 "[ . 1 . 2]" 1
469 1 25 LEU QD 1 82 ILE H . . 5.000 3.492 3.019 3.982 . 0 0 "[ . 1 . 2]" 1
470 1 25 LEU QD 1 82 ILE HA . . 3.560 2.192 1.892 2.630 . 0 0 "[ . 1 . 2]" 1
471 1 25 LEU QD 1 84 ALA H . . 5.450 3.823 3.077 4.648 . 0 0 "[ . 1 . 2]" 1
472 1 25 LEU QD 1 85 HIS H . . 4.760 2.600 1.802 3.442 . 0 0 "[ . 1 . 2]" 1
473 1 25 LEU QD 1 85 HIS HA . . 5.220 3.899 3.417 4.339 . 0 0 "[ . 1 . 2]" 1
474 1 25 LEU QD 1 85 HIS QB . . 3.710 2.035 1.878 2.183 . 0 0 "[ . 1 . 2]" 1
475 1 25 LEU HG 1 85 HIS H . . 5.180 4.445 3.907 4.880 . 0 0 "[ . 1 . 2]" 1
476 1 25 LEU HG 1 85 HIS QB . . 3.810 3.161 2.096 3.590 . 0 0 "[ . 1 . 2]" 1
477 1 25 LEU HG 1 109 LEU QD . . 5.500 3.668 2.412 4.894 . 0 0 "[ . 1 . 2]" 1
478 1 26 LEU H 1 26 LEU HB2 . . 3.520 2.560 2.290 2.919 . 0 0 "[ . 1 . 2]" 1
479 1 26 LEU H 1 26 LEU HB3 . . 3.300 3.146 2.571 3.350 0.050 1 0 "[ . 1 . 2]" 1
480 1 26 LEU H 1 26 LEU MD1 . . 4.440 4.382 4.169 4.491 0.051 11 0 "[ . 1 . 2]" 1
481 1 26 LEU H 1 26 LEU MD2 . . 4.530 3.849 3.355 4.365 . 0 0 "[ . 1 . 2]" 1
482 1 26 LEU H 1 27 PRO QD . . 4.950 3.750 3.509 3.906 . 0 0 "[ . 1 . 2]" 1
483 1 26 LEU HA 1 26 LEU MD1 . . 3.320 2.363 2.057 3.037 . 0 0 "[ . 1 . 2]" 1
484 1 26 LEU HA 1 26 LEU MD2 . . 3.820 2.144 1.980 2.497 . 0 0 "[ . 1 . 2]" 1
485 1 26 LEU HA 1 26 LEU HG . . 3.980 3.598 3.552 3.716 . 0 0 "[ . 1 . 2]" 1
486 1 26 LEU HA 1 27 PRO QD . . 2.930 1.987 1.880 2.029 . 0 0 "[ . 1 . 2]" 1
487 1 26 LEU HA 1 27 PRO HG2 . . 4.190 4.220 4.138 4.262 0.072 5 0 "[ . 1 . 2]" 1
488 1 26 LEU HA 1 27 PRO HG3 . . 4.610 4.605 4.496 4.664 0.054 2 0 "[ . 1 . 2]" 1
489 1 26 LEU HA 1 109 LEU QD . . 5.500 4.458 3.996 5.255 . 0 0 "[ . 1 . 2]" 1
490 1 26 LEU HB2 1 37 PHE QE . . 5.110 4.406 3.638 4.830 . 0 0 "[ . 1 . 2]" 1
491 1 26 LEU HB3 1 27 PRO QD . . 4.480 4.241 4.146 4.279 . 0 0 "[ . 1 . 2]" 1
492 1 26 LEU HB3 1 37 PHE QE . . 4.640 4.458 3.662 4.735 0.095 15 0 "[ . 1 . 2]" 1
493 1 26 LEU MD1 1 27 PRO HA . . 5.470 4.664 4.139 5.179 . 0 0 "[ . 1 . 2]" 1
494 1 26 LEU MD1 1 27 PRO QD . . 3.620 2.718 2.252 3.345 . 0 0 "[ . 1 . 2]" 1
495 1 26 LEU MD1 1 27 PRO HG3 . . 5.030 4.968 4.525 5.431 0.401 9 0 "[ . 1 . 2]" 1
496 1 26 LEU MD1 1 37 PHE QB . . 5.140 3.698 2.729 5.105 . 0 0 "[ . 1 . 2]" 1
497 1 26 LEU MD1 1 37 PHE QE . . 3.550 3.107 2.158 3.639 0.089 20 0 "[ . 1 . 2]" 1
498 1 26 LEU MD2 1 27 PRO QD . . 4.890 3.107 2.424 3.849 . 0 0 "[ . 1 . 2]" 1
499 1 26 LEU MD2 1 37 PHE QE . . 3.390 2.978 2.171 3.649 0.259 11 0 "[ . 1 . 2]" 1
500 1 26 LEU HG 1 37 PHE QE . . 5.220 2.450 2.163 2.726 . 0 0 "[ . 1 . 2]" 1
501 1 27 PRO HA 1 28 LEU H . . 2.690 2.195 2.130 2.264 . 0 0 "[ . 1 . 2]" 1
502 1 27 PRO HA 1 28 LEU QD . . 4.240 3.857 3.398 4.154 . 0 0 "[ . 1 . 2]" 1
503 1 27 PRO HA 1 106 ILE HA . . 4.920 4.463 4.000 4.969 0.049 7 0 "[ . 1 . 2]" 1
504 1 27 PRO HA 1 106 ILE MD . . 4.120 2.390 2.204 2.524 . 0 0 "[ . 1 . 2]" 1
505 1 27 PRO HA 1 106 ILE HG12 . . 5.130 4.987 4.489 5.179 0.049 7 0 "[ . 1 . 2]" 1
506 1 27 PRO HA 1 106 ILE HG13 . . 5.100 5.156 5.104 5.180 0.080 11 0 "[ . 1 . 2]" 1
507 1 27 PRO HA 1 106 ILE MG . . 5.450 4.298 4.045 4.741 . 0 0 "[ . 1 . 2]" 1
508 1 27 PRO HA 1 109 LEU QD . . 5.500 3.834 3.652 4.282 . 0 0 "[ . 1 . 2]" 1
509 1 27 PRO HB2 1 28 LEU H . . 3.870 3.567 3.254 3.913 0.043 12 0 "[ . 1 . 2]" 1
510 1 27 PRO HB2 1 106 ILE HA . . 4.800 3.014 2.505 3.488 . 0 0 "[ . 1 . 2]" 1
511 1 27 PRO HB2 1 106 ILE MG . . 3.390 2.463 2.206 3.041 . 0 0 "[ . 1 . 2]" 1
512 1 27 PRO HB2 1 109 LEU QD . . 4.540 3.773 3.412 4.336 . 0 0 "[ . 1 . 2]" 1
513 1 27 PRO HB3 1 106 ILE HA . . 4.440 2.772 2.440 3.290 . 0 0 "[ . 1 . 2]" 1
514 1 27 PRO HB3 1 109 LEU QD . . 2.830 2.366 2.150 2.894 0.064 5 0 "[ . 1 . 2]" 1
515 1 27 PRO QD 1 109 LEU QD . . 3.860 2.317 1.994 3.497 . 0 0 "[ . 1 . 2]" 1
516 1 27 PRO HG2 1 106 ILE HA . . 5.470 4.942 4.604 5.398 . 0 0 "[ . 1 . 2]" 1
517 1 27 PRO HG3 1 106 ILE MG . . 4.870 4.499 4.176 4.923 0.053 1 0 "[ . 1 . 2]" 1
518 1 27 PRO HG3 1 109 LEU HB2 . . 5.050 2.803 2.389 3.595 . 0 0 "[ . 1 . 2]" 1
519 1 27 PRO HG3 1 109 LEU QD . . 4.940 2.693 2.332 3.693 . 0 0 "[ . 1 . 2]" 1
520 1 28 LEU H 1 28 LEU QB . . 3.690 2.580 2.440 2.799 . 0 0 "[ . 1 . 2]" 1
521 1 28 LEU H 1 28 LEU QD . . 4.060 3.102 2.591 3.505 . 0 0 "[ . 1 . 2]" 1
522 1 28 LEU H 1 29 ARG H . . 4.930 4.029 3.824 4.179 . 0 0 "[ . 1 . 2]" 1
523 1 28 LEU H 1 106 ILE MD . . 3.810 2.404 2.055 2.830 . 0 0 "[ . 1 . 2]" 1
524 1 28 LEU H 1 106 ILE MG . . 5.500 4.164 3.786 4.750 . 0 0 "[ . 1 . 2]" 1
525 1 28 LEU HA 1 28 LEU QD . . 3.440 2.335 2.095 2.635 . 0 0 "[ . 1 . 2]" 1
526 1 28 LEU HA 1 28 LEU HG . . 3.870 3.201 2.683 3.776 . 0 0 "[ . 1 . 2]" 1
527 1 28 LEU HA 1 29 ARG H . . 2.910 2.193 1.954 2.300 . 0 0 "[ . 1 . 2]" 1
528 1 28 LEU HA 1 29 ARG HG3 . . 4.950 4.490 3.669 5.758 0.808 12 2 "[ . 1 + . -2]" 1
529 1 28 LEU HA 1 30 THR H . . 4.530 3.985 3.669 4.275 . 0 0 "[ . 1 . 2]" 1
530 1 28 LEU HA 1 33 ASP HB3 . . 3.770 2.721 2.326 3.117 . 0 0 "[ . 1 . 2]" 1
531 1 28 LEU QB 1 29 ARG H . . 4.180 3.562 3.324 3.753 . 0 0 "[ . 1 . 2]" 1
532 1 28 LEU QB 1 30 THR H . . 5.000 3.626 3.224 3.828 . 0 0 "[ . 1 . 2]" 1
533 1 28 LEU QB 1 33 ASP HB2 . . 4.440 3.576 2.721 4.349 . 0 0 "[ . 1 . 2]" 1
534 1 28 LEU QB 1 34 TRP H . . 4.710 3.462 3.120 3.781 . 0 0 "[ . 1 . 2]" 1
535 1 28 LEU QB 1 34 TRP HA . . 4.630 3.999 3.515 4.420 . 0 0 "[ . 1 . 2]" 1
536 1 28 LEU QB 1 34 TRP HB2 . . 4.980 3.333 2.837 3.814 . 0 0 "[ . 1 . 2]" 1
537 1 28 LEU QD 1 29 ARG H . . 4.250 3.928 3.660 4.196 . 0 0 "[ . 1 . 2]" 1
538 1 28 LEU QD 1 33 ASP H . . 5.370 4.495 4.113 4.756 . 0 0 "[ . 1 . 2]" 1
539 1 28 LEU QD 1 33 ASP HB2 . . 4.460 3.591 2.832 4.091 . 0 0 "[ . 1 . 2]" 1
540 1 28 LEU QD 1 33 ASP HB3 . . 4.070 2.471 2.082 3.027 . 0 0 "[ . 1 . 2]" 1
541 1 28 LEU QD 1 34 TRP H . . 4.230 3.180 2.781 3.593 . 0 0 "[ . 1 . 2]" 1
542 1 28 LEU QD 1 34 TRP HA . . 3.520 2.258 2.005 2.567 . 0 0 "[ . 1 . 2]" 1
543 1 28 LEU QD 1 34 TRP HB2 . . 3.550 2.894 2.287 3.299 . 0 0 "[ . 1 . 2]" 1
544 1 28 LEU QD 1 34 TRP HB3 . . 5.220 4.027 3.646 4.342 . 0 0 "[ . 1 . 2]" 1
545 1 28 LEU QD 1 34 TRP HE3 . . 3.330 2.221 1.951 2.676 . 0 0 "[ . 1 . 2]" 1
546 1 28 LEU QD 1 37 PHE H . . 4.430 3.971 3.445 4.427 . 0 0 "[ . 1 . 2]" 1
547 1 28 LEU QD 1 37 PHE QB . . 4.150 2.694 2.123 3.487 . 0 0 "[ . 1 . 2]" 1
548 1 28 LEU QD 1 37 PHE QD . . 4.340 3.206 2.906 3.551 . 0 0 "[ . 1 . 2]" 1
549 1 28 LEU QD 1 51 LEU QD . . 3.490 2.671 2.121 3.091 . 0 0 "[ . 1 . 2]" 1
550 1 28 LEU HG 1 34 TRP HE3 . . 5.170 3.678 2.168 4.966 . 0 0 "[ . 1 . 2]" 1
551 1 29 ARG H 1 29 ARG QB . . 2.960 2.521 2.041 2.922 . 0 0 "[ . 1 . 2]" 1
552 1 29 ARG H 1 29 ARG QD . . 4.630 3.709 1.849 4.415 . 0 0 "[ . 1 . 2]" 1
553 1 29 ARG H 1 29 ARG HG2 . . 4.050 3.310 2.417 4.048 . 0 0 "[ . 1 . 2]" 1
554 1 29 ARG H 1 29 ARG HG3 . . 3.550 2.628 2.093 3.919 0.369 12 0 "[ . 1 . 2]" 1
555 1 29 ARG H 1 30 THR H . . 3.140 2.831 2.713 3.056 . 0 0 "[ . 1 . 2]" 1
556 1 29 ARG H 1 30 THR MG . . 4.790 4.723 4.235 4.883 0.093 15 0 "[ . 1 . 2]" 1
557 1 29 ARG H 1 33 ASP H . . 5.150 5.035 4.830 5.198 0.048 18 0 "[ . 1 . 2]" 1
558 1 29 ARG H 1 33 ASP HB2 . . 3.530 2.985 2.649 3.433 . 0 0 "[ . 1 . 2]" 1
559 1 29 ARG H 1 33 ASP HB3 . . 4.040 3.151 2.741 3.561 . 0 0 "[ . 1 . 2]" 1
560 1 29 ARG H 1 106 ILE MG . . 5.330 3.743 3.334 4.148 . 0 0 "[ . 1 . 2]" 1
561 1 29 ARG HA 1 29 ARG HG2 . . 3.620 2.810 2.351 3.638 0.018 4 0 "[ . 1 . 2]" 1
562 1 29 ARG HA 1 29 ARG HG3 . . 3.760 3.218 2.529 3.771 0.011 2 0 "[ . 1 . 2]" 1
563 1 29 ARG HA 1 106 ILE MD . . 3.410 3.354 2.902 3.500 0.090 4 0 "[ . 1 . 2]" 1
564 1 29 ARG QB 1 29 ARG QD . . 2.980 2.131 2.057 2.434 . 0 0 "[ . 1 . 2]" 1
565 1 29 ARG QB 1 30 THR H . . 3.410 2.577 2.335 2.840 . 0 0 "[ . 1 . 2]" 1
566 1 29 ARG QB 1 30 THR MG . . 3.360 2.673 2.370 3.418 0.058 3 0 "[ . 1 . 2]" 1
567 1 29 ARG QB 1 106 ILE MG . . 4.260 3.421 2.735 3.838 . 0 0 "[ . 1 . 2]" 1
568 1 29 ARG QD 1 30 THR MG . . 4.450 4.164 3.606 4.547 0.097 15 0 "[ . 1 . 2]" 1
569 1 29 ARG QD 1 106 ILE MD . . 5.250 5.131 4.211 5.366 0.116 6 0 "[ . 1 . 2]" 1
570 1 29 ARG QD 1 106 ILE MG . . 4.260 3.236 2.024 3.865 . 0 0 "[ . 1 . 2]" 1
571 1 29 ARG HE 1 106 ILE MG . . 5.150 3.774 2.353 4.966 . 0 0 "[ . 1 . 2]" 1
572 1 29 ARG HG3 1 106 ILE MG . . 3.760 3.000 2.135 3.755 . 0 0 "[ . 1 . 2]" 1
573 1 30 THR H 1 30 THR MG . . 3.810 2.879 2.501 3.338 . 0 0 "[ . 1 . 2]" 1
574 1 30 THR H 1 31 ASN H . . 4.970 4.325 4.253 4.450 . 0 0 "[ . 1 . 2]" 1
575 1 30 THR H 1 33 ASP HB2 . . 3.270 2.267 1.632 2.969 . 0 0 "[ . 1 . 2]" 1
576 1 30 THR H 1 33 ASP HB3 . . 3.680 3.140 2.295 3.760 0.080 10 0 "[ . 1 . 2]" 1
577 1 30 THR H 1 34 TRP H . . 5.440 4.281 3.797 4.631 . 0 0 "[ . 1 . 2]" 1
578 1 30 THR HA 1 30 THR MG . . 3.440 2.861 2.280 3.283 . 0 0 "[ . 1 . 2]" 1
579 1 30 THR HA 1 31 ASN H . . 3.120 2.549 2.451 2.703 . 0 0 "[ . 1 . 2]" 1
580 1 30 THR HB 1 31 ASN H . . 3.550 2.976 2.173 3.613 0.063 6 0 "[ . 1 . 2]" 1
581 1 30 THR HB 1 31 ASN QB . . 5.500 4.530 3.608 5.232 . 0 0 "[ . 1 . 2]" 1
582 1 30 THR HB 1 32 ASP H . . 4.520 3.788 2.541 4.601 0.081 5 0 "[ . 1 . 2]" 1
583 1 30 THR MG 1 31 ASN H . . 4.030 3.334 2.719 3.767 . 0 0 "[ . 1 . 2]" 1
584 1 30 THR MG 1 31 ASN QB . . 5.220 4.367 3.582 4.983 . 0 0 "[ . 1 . 2]" 1
585 1 30 THR MG 1 32 ASP H . . 4.630 3.052 1.791 4.542 . 0 0 "[ . 1 . 2]" 1
586 1 30 THR MG 1 32 ASP QB . . 4.840 3.178 2.069 4.640 . 0 0 "[ . 1 . 2]" 1
587 1 30 THR MG 1 33 ASP H . . 5.040 3.661 2.394 5.138 0.098 8 0 "[ . 1 . 2]" 1
588 1 31 ASN H 1 31 ASN QB . . 2.960 2.127 2.020 2.289 . 0 0 "[ . 1 . 2]" 1
589 1 31 ASN H 1 32 ASP H . . 3.520 2.768 2.506 2.928 . 0 0 "[ . 1 . 2]" 1
590 1 31 ASN HA 1 31 ASN HD21 . . 4.800 2.655 1.965 3.871 . 0 0 "[ . 1 . 2]" 1
591 1 31 ASN HA 1 33 ASP H . . 4.990 3.992 3.627 4.558 . 0 0 "[ . 1 . 2]" 1
592 1 31 ASN HA 1 34 TRP H . . 3.680 3.255 2.866 3.728 0.048 8 0 "[ . 1 . 2]" 1
593 1 31 ASN HA 1 35 GLN H . . 4.960 4.271 3.953 5.029 0.069 17 0 "[ . 1 . 2]" 1
594 1 31 ASN QB 1 32 ASP H . . 4.480 2.836 2.568 3.051 . 0 0 "[ . 1 . 2]" 1
595 1 31 ASN HD21 1 34 TRP HB3 . . 5.460 3.189 2.224 5.144 . 0 0 "[ . 1 . 2]" 1
596 1 31 ASN HD22 1 34 TRP HD1 . . 4.530 3.667 2.784 4.594 0.064 17 0 "[ . 1 . 2]" 1
597 1 32 ASP H 1 32 ASP QB . . 3.040 2.355 1.996 2.705 . 0 0 "[ . 1 . 2]" 1
598 1 32 ASP H 1 33 ASP H . . 3.280 2.727 2.584 2.949 . 0 0 "[ . 1 . 2]" 1
599 1 32 ASP HA 1 34 TRP H . . 4.780 4.482 4.182 4.842 0.062 8 0 "[ . 1 . 2]" 1
600 1 32 ASP HA 1 35 GLN H . . 3.720 3.417 3.048 3.798 0.078 8 0 "[ . 1 . 2]" 1
601 1 32 ASP HA 1 35 GLN QB . . 3.270 2.777 2.457 3.220 . 0 0 "[ . 1 . 2]" 1
602 1 32 ASP HA 1 35 GLN HG2 . . 4.430 3.690 2.421 4.497 0.067 11 0 "[ . 1 . 2]" 1
603 1 32 ASP HA 1 35 GLN HG3 . . 4.350 2.785 2.106 3.885 . 0 0 "[ . 1 . 2]" 1
604 1 32 ASP QB 1 33 ASP H . . 3.240 2.850 2.503 3.193 . 0 0 "[ . 1 . 2]" 1
605 1 33 ASP H 1 33 ASP HB2 . . 3.040 2.323 2.119 2.558 . 0 0 "[ . 1 . 2]" 1
606 1 33 ASP H 1 33 ASP HB3 . . 3.570 3.063 2.480 3.635 0.065 14 0 "[ . 1 . 2]" 1
607 1 33 ASP H 1 34 TRP H . . 3.110 2.485 2.254 2.750 . 0 0 "[ . 1 . 2]" 1
608 1 33 ASP H 1 35 GLN H . . 4.330 3.923 3.665 4.181 . 0 0 "[ . 1 . 2]" 1
609 1 33 ASP H 1 35 GLN QB . . 5.350 4.927 4.482 5.282 . 0 0 "[ . 1 . 2]" 1
610 1 33 ASP HA 1 36 ARG H . . 4.120 3.319 2.791 3.731 . 0 0 "[ . 1 . 2]" 1
611 1 33 ASP HA 1 36 ARG QB . . 3.140 2.678 1.984 3.234 0.094 10 0 "[ . 1 . 2]" 1
612 1 33 ASP HA 1 36 ARG QD . . 4.120 2.673 1.943 4.031 . 0 0 "[ . 1 . 2]" 1
613 1 33 ASP HA 1 36 ARG QG . . 5.040 3.736 2.202 4.636 . 0 0 "[ . 1 . 2]" 1
614 1 33 ASP HA 1 37 PHE H . . 5.010 4.359 3.748 5.083 0.073 8 0 "[ . 1 . 2]" 1
615 1 33 ASP HB2 1 34 TRP H . . 3.600 3.363 2.836 3.771 0.171 18 0 "[ . 1 . 2]" 1
616 1 33 ASP HB3 1 34 TRP H . . 3.940 3.010 2.452 4.001 0.061 11 0 "[ . 1 . 2]" 1
617 1 34 TRP H 1 34 TRP HB2 . . 3.370 2.621 2.403 2.844 . 0 0 "[ . 1 . 2]" 1
618 1 34 TRP H 1 34 TRP HB3 . . 3.210 2.404 2.278 2.557 . 0 0 "[ . 1 . 2]" 1
619 1 34 TRP H 1 35 GLN H . . 3.220 2.692 2.487 2.868 . 0 0 "[ . 1 . 2]" 1
620 1 34 TRP H 1 35 GLN QB . . 4.850 4.715 4.510 4.919 0.069 6 0 "[ . 1 . 2]" 1
621 1 34 TRP H 1 36 ARG H . . 4.950 4.239 3.920 4.453 . 0 0 "[ . 1 . 2]" 1
622 1 34 TRP HA 1 34 TRP HE3 . . 3.370 3.070 2.249 3.434 0.064 16 0 "[ . 1 . 2]" 1
623 1 34 TRP HA 1 37 PHE H . . 3.910 3.485 3.175 3.724 . 0 0 "[ . 1 . 2]" 1
624 1 34 TRP HA 1 37 PHE QB . . 3.890 2.770 2.216 3.396 . 0 0 "[ . 1 . 2]" 1
625 1 34 TRP HB2 1 34 TRP HE3 . . 4.100 2.656 2.451 2.925 . 0 0 "[ . 1 . 2]" 1
626 1 34 TRP HB2 1 34 TRP HZ3 . . 4.990 5.040 4.896 5.078 0.088 5 0 "[ . 1 . 2]" 1
627 1 34 TRP HB2 1 35 GLN H . . 4.000 4.016 3.930 4.067 0.067 18 0 "[ . 1 . 2]" 1
628 1 34 TRP HB3 1 35 GLN H . . 3.530 2.752 2.600 2.926 . 0 0 "[ . 1 . 2]" 1
629 1 34 TRP HD1 1 35 GLN H . . 4.710 3.643 3.170 4.085 . 0 0 "[ . 1 . 2]" 1
630 1 34 TRP HD1 1 35 GLN HA . . 4.540 3.568 2.886 4.180 . 0 0 "[ . 1 . 2]" 1
631 1 34 TRP HD1 1 35 GLN HG2 . . 4.520 3.323 2.563 3.984 . 0 0 "[ . 1 . 2]" 1
632 1 34 TRP HD1 1 35 GLN HG3 . . 5.450 4.834 3.155 5.522 0.072 20 0 "[ . 1 . 2]" 1
633 1 34 TRP HE3 1 51 LEU QD . . 5.150 3.447 2.904 4.579 . 0 0 "[ . 1 . 2]" 1
634 1 34 TRP HH2 1 45 LEU MD2 . . 3.950 3.064 2.230 4.030 0.080 6 0 "[ . 1 . 2]" 1
635 1 34 TRP HH2 1 51 LEU QD . . 5.180 3.060 2.498 3.890 . 0 0 "[ . 1 . 2]" 1
636 1 34 TRP HH2 1 67 TRP HE1 . . 4.150 3.709 2.349 4.239 0.089 18 0 "[ . 1 . 2]" 1
637 1 34 TRP HH2 1 67 TRP HZ2 . . 4.190 2.833 2.195 4.228 0.038 7 0 "[ . 1 . 2]" 1
638 1 34 TRP HZ2 1 45 LEU MD2 . . 5.190 4.069 3.191 5.103 . 0 0 "[ . 1 . 2]" 1
639 1 34 TRP HZ2 1 67 TRP HE1 . . 4.310 3.638 2.571 4.373 0.063 17 0 "[ . 1 . 2]" 1
640 1 34 TRP HZ3 1 51 LEU QD . . 4.430 2.481 2.029 3.584 . 0 0 "[ . 1 . 2]" 1
641 1 35 GLN H 1 35 GLN QB . . 3.040 2.474 2.217 2.641 . 0 0 "[ . 1 . 2]" 1
642 1 35 GLN H 1 35 GLN HG2 . . 3.410 2.473 2.094 3.371 . 0 0 "[ . 1 . 2]" 1
643 1 35 GLN H 1 35 GLN HG3 . . 3.460 3.181 2.386 3.537 0.077 9 0 "[ . 1 . 2]" 1
644 1 35 GLN H 1 36 ARG H . . 3.400 2.753 2.574 2.986 . 0 0 "[ . 1 . 2]" 1
645 1 35 GLN HA 1 35 GLN HG2 . . 3.320 2.749 2.393 3.141 . 0 0 "[ . 1 . 2]" 1
646 1 35 GLN HA 1 35 GLN HG3 . . 3.830 3.728 3.269 3.873 0.043 10 0 "[ . 1 . 2]" 1
647 1 35 GLN HA 1 39 ALA H . . 4.320 4.273 3.936 4.412 0.092 10 0 "[ . 1 . 2]" 1
648 1 35 GLN HA 1 39 ALA MB . . 5.140 4.325 3.899 4.822 . 0 0 "[ . 1 . 2]" 1
649 1 35 GLN QB 1 36 ARG H . . 3.240 2.480 2.191 2.733 . 0 0 "[ . 1 . 2]" 1
650 1 35 GLN QB 1 36 ARG QD . . 4.850 4.333 3.040 4.770 . 0 0 "[ . 1 . 2]" 1
651 1 35 GLN HG2 1 36 ARG H . . 5.180 4.497 4.175 4.877 . 0 0 "[ . 1 . 2]" 1
652 1 35 GLN HG3 1 36 ARG H . . 4.740 4.618 4.260 4.825 0.085 3 0 "[ . 1 . 2]" 1
653 1 36 ARG H 1 36 ARG QB . . 2.800 2.313 1.945 2.597 . 0 0 "[ . 1 . 2]" 1
654 1 36 ARG H 1 36 ARG QD . . 4.760 3.373 2.360 4.083 . 0 0 "[ . 1 . 2]" 1
655 1 36 ARG H 1 36 ARG QG . . 3.760 2.688 2.149 3.606 . 0 0 "[ . 1 . 2]" 1
656 1 36 ARG HA 1 36 ARG QD . . 4.950 3.871 2.988 4.178 . 0 0 "[ . 1 . 2]" 1
657 1 36 ARG HA 1 36 ARG QG . . 3.600 2.415 2.140 3.183 . 0 0 "[ . 1 . 2]" 1
658 1 36 ARG HA 1 39 ALA H . . 3.760 3.449 3.114 3.759 . 0 0 "[ . 1 . 2]" 1
659 1 36 ARG HA 1 39 ALA MB . . 3.160 2.235 1.809 2.604 . 0 0 "[ . 1 . 2]" 1
660 1 36 ARG QB 1 36 ARG QD . . 3.490 2.167 1.993 2.413 . 0 0 "[ . 1 . 2]" 1
661 1 36 ARG QB 1 37 PHE H . . 3.400 2.936 2.512 3.508 0.108 10 0 "[ . 1 . 2]" 1
662 1 36 ARG QB 1 37 PHE HA . . 4.850 4.098 3.609 4.910 0.060 14 0 "[ . 1 . 2]" 1
663 1 36 ARG QB 1 37 PHE QB . . 5.080 4.239 3.855 5.136 0.056 10 0 "[ . 1 . 2]" 1
664 1 36 ARG QG 1 39 ALA MB . . 4.050 3.744 3.463 3.997 . 0 0 "[ . 1 . 2]" 1
665 1 37 PHE H 1 37 PHE QB . . 2.870 2.207 2.075 2.376 . 0 0 "[ . 1 . 2]" 1
666 1 37 PHE H 1 37 PHE QD . . 4.420 4.189 4.037 4.328 . 0 0 "[ . 1 . 2]" 1
667 1 37 PHE H 1 39 ALA H . . 5.320 3.907 3.600 4.255 . 0 0 "[ . 1 . 2]" 1
668 1 37 PHE HA 1 37 PHE QD . . 3.510 2.987 2.412 3.318 . 0 0 "[ . 1 . 2]" 1
669 1 37 PHE HA 1 39 ALA H . . 4.720 4.360 4.149 4.648 . 0 0 "[ . 1 . 2]" 1
670 1 37 PHE HA 1 40 ASP H . . 4.940 3.813 3.389 4.531 . 0 0 "[ . 1 . 2]" 1
671 1 37 PHE HA 1 40 ASP HB2 . . 4.270 4.412 3.310 4.781 0.511 19 3 "[ . - 1 * . +2]" 1
672 1 37 PHE HA 1 40 ASP HB3 . . 4.690 4.088 3.540 4.758 0.068 20 0 "[ . 1 . 2]" 1
673 1 37 PHE QB 1 38 CYS H . . 3.030 2.263 1.972 2.725 . 0 0 "[ . 1 . 2]" 1
674 1 37 PHE QB 1 38 CYS HB3 . . 5.090 4.385 3.628 5.187 0.097 19 0 "[ . 1 . 2]" 1
675 1 37 PHE QB 1 39 ALA H . . 4.800 4.378 4.140 4.723 . 0 0 "[ . 1 . 2]" 1
676 1 37 PHE QD 1 38 CYS H . . 3.820 3.055 2.447 3.402 . 0 0 "[ . 1 . 2]" 1
677 1 37 PHE QD 1 38 CYS HA . . 4.070 3.254 2.697 3.875 . 0 0 "[ . 1 . 2]" 1
678 1 37 PHE QD 1 38 CYS HB2 . . 5.190 3.933 2.798 5.251 0.061 13 0 "[ . 1 . 2]" 1
679 1 37 PHE QE 1 38 CYS H . . 5.500 5.237 4.693 5.591 0.091 11 0 "[ . 1 . 2]" 1
680 1 37 PHE QE 1 42 LYS HA . . 5.300 4.892 3.143 5.394 0.094 9 0 "[ . 1 . 2]" 1
681 1 37 PHE QE 1 43 HIS HB3 . . 4.200 3.695 2.435 4.865 0.665 9 2 "[ .- +1 . 2]" 1
682 1 37 PHE QE 1 45 LEU MD2 . . 3.210 2.940 2.202 3.338 0.128 11 0 "[ . 1 . 2]" 1
683 1 37 PHE QE 1 45 LEU HG . . 3.880 3.483 2.259 3.969 0.089 15 0 "[ . 1 . 2]" 1
684 1 38 CYS H 1 38 CYS HB2 . . 3.170 2.922 2.169 3.630 0.460 14 0 "[ . 1 . 2]" 1
685 1 38 CYS H 1 38 CYS HB3 . . 3.580 2.762 2.415 3.583 0.003 8 0 "[ . 1 . 2]" 1
686 1 38 CYS H 1 39 ALA H . . 3.250 2.601 2.226 2.742 . 0 0 "[ . 1 . 2]" 1
687 1 38 CYS H 1 39 ALA MB . . 4.290 4.280 3.885 4.371 0.081 16 0 "[ . 1 . 2]" 1
688 1 38 CYS H 1 40 ASP H . . 4.830 4.221 3.923 4.515 . 0 0 "[ . 1 . 2]" 1
689 1 38 CYS HA 1 40 ASP H . . 4.800 3.907 3.008 4.630 . 0 0 "[ . 1 . 2]" 1
690 1 38 CYS HA 1 42 LYS H . . 5.030 3.891 2.117 5.100 0.070 7 0 "[ . 1 . 2]" 1
691 1 38 CYS HA 1 42 LYS QB . . 4.180 3.974 2.145 4.287 0.107 17 0 "[ . 1 . 2]" 1
692 1 38 CYS HB2 1 39 ALA H . . 4.050 3.921 3.092 4.225 0.175 17 0 "[ . 1 . 2]" 1
693 1 38 CYS HB3 1 39 ALA H . . 4.160 3.648 2.817 4.141 . 0 0 "[ . 1 . 2]" 1
694 1 39 ALA H 1 39 ALA MB . . 3.140 2.244 2.182 2.339 . 0 0 "[ . 1 . 2]" 1
695 1 39 ALA H 1 40 ASP H . . 3.220 2.659 2.564 2.874 . 0 0 "[ . 1 . 2]" 1
696 1 39 ALA H 1 40 ASP HA . . 5.160 5.233 5.189 5.250 0.090 10 0 "[ . 1 . 2]" 1
697 1 39 ALA MB 1 40 ASP H . . 3.900 2.891 2.348 3.384 . 0 0 "[ . 1 . 2]" 1
698 1 39 ALA MB 1 40 ASP HA . . 4.820 3.996 3.577 4.356 . 0 0 "[ . 1 . 2]" 1
699 1 39 ALA MB 1 40 ASP HB2 . . 5.500 3.435 2.755 4.179 . 0 0 "[ . 1 . 2]" 1
700 1 39 ALA MB 1 40 ASP HB3 . . 5.040 4.627 3.906 5.215 0.175 9 0 "[ . 1 . 2]" 1
701 1 40 ASP H 1 40 ASP HB2 . . 2.970 2.572 2.119 3.216 0.246 14 0 "[ . 1 . 2]" 1
702 1 40 ASP H 1 40 ASP HB3 . . 3.320 2.957 2.498 3.396 0.076 11 0 "[ . 1 . 2]" 1
703 1 40 ASP H 1 41 SER H . . 3.650 2.650 1.828 3.744 0.094 14 0 "[ . 1 . 2]" 1
704 1 40 ASP HA 1 40 ASP HB2 . . 2.960 2.689 2.508 2.940 . 0 0 "[ . 1 . 2]" 1
705 1 40 ASP HA 1 41 SER H . . 3.160 2.934 2.004 3.255 0.095 12 0 "[ . 1 . 2]" 1
706 1 40 ASP HB2 1 41 SER H . . 4.260 4.192 3.593 4.634 0.374 18 0 "[ . 1 . 2]" 1
707 1 40 ASP HB3 1 41 SER H . . 4.760 3.843 3.136 4.343 . 0 0 "[ . 1 . 2]" 1
708 1 41 SER H 1 41 SER QB . . 3.760 2.921 2.074 3.441 . 0 0 "[ . 1 . 2]" 1
709 1 41 SER H 1 42 LYS QG . . 5.260 4.541 2.917 5.355 0.095 7 0 "[ . 1 . 2]" 1
710 1 41 SER HA 1 43 HIS H . . 4.470 4.229 3.353 4.560 0.090 5 0 "[ . 1 . 2]" 1
711 1 42 LYS H 1 42 LYS QB . . 3.220 2.640 2.171 3.316 0.096 5 0 "[ . 1 . 2]" 1
712 1 42 LYS H 1 42 LYS QG . . 3.670 2.957 2.170 3.777 0.107 12 0 "[ . 1 . 2]" 1
713 1 42 LYS H 1 43 HIS H . . 3.420 3.188 2.456 3.503 0.083 1 0 "[ . 1 . 2]" 1
714 1 42 LYS HA 1 42 LYS QG . . 3.390 2.720 2.049 3.405 0.015 11 0 "[ . 1 . 2]" 1
715 1 42 LYS QB 1 42 LYS QE . . 4.490 3.093 1.946 3.782 . 0 0 "[ . 1 . 2]" 1
716 1 42 LYS QB 1 43 HIS H . . 4.230 3.605 2.333 4.156 . 0 0 "[ . 1 . 2]" 1
717 1 42 LYS QE 1 42 LYS QG . . 3.460 2.241 2.013 2.681 . 0 0 "[ . 1 . 2]" 1
718 1 42 LYS QG 1 43 HIS H . . 5.030 4.309 2.429 4.848 . 0 0 "[ . 1 . 2]" 1
719 1 43 HIS H 1 43 HIS HB2 . . 3.670 2.896 2.010 4.032 0.362 17 0 "[ . 1 . 2]" 1
720 1 43 HIS H 1 43 HIS HD2 . . 5.250 4.332 2.341 5.293 0.043 10 0 "[ . 1 . 2]" 1
721 1 43 HIS H 1 44 LEU H . . 4.580 4.095 2.382 4.658 0.078 5 0 "[ . 1 . 2]" 1
722 1 43 HIS HA 1 43 HIS HD2 . . 3.950 3.297 2.122 4.035 0.085 17 0 "[ . 1 . 2]" 1
723 1 43 HIS HA 1 44 LEU H . . 2.940 2.636 2.192 3.036 0.096 11 0 "[ . 1 . 2]" 1
724 1 43 HIS HB2 1 44 LEU H . . 5.300 3.912 2.124 4.635 . 0 0 "[ . 1 . 2]" 1
725 1 43 HIS HB3 1 44 LEU H . . 4.440 3.584 2.158 4.698 0.258 9 0 "[ . 1 . 2]" 1
726 1 43 HIS HD2 1 44 LEU QD . . 4.770 3.747 2.073 4.804 0.034 12 0 "[ . 1 . 2]" 1
727 1 44 LEU H 1 44 LEU QB . . 3.440 2.472 1.878 3.290 . 0 0 "[ . 1 . 2]" 1
728 1 44 LEU H 1 44 LEU QD . . 4.030 2.912 1.632 3.698 . 0 0 "[ . 1 . 2]" 1
729 1 44 LEU H 1 44 LEU HG . . 4.120 3.525 2.279 4.217 0.097 9 0 "[ . 1 . 2]" 1
730 1 44 LEU HA 1 44 LEU QD . . 3.130 2.531 1.988 3.035 . 0 0 "[ . 1 . 2]" 1
731 1 44 LEU HA 1 45 LEU H . . 2.810 2.363 2.116 2.795 . 0 0 "[ . 1 . 2]" 1
732 1 44 LEU HA 1 45 LEU HB2 . . 4.650 4.587 4.280 4.740 0.090 8 0 "[ . 1 . 2]" 1
733 1 44 LEU HA 1 45 LEU MD2 . . 5.290 5.151 4.765 5.352 0.062 3 0 "[ . 1 . 2]" 1
734 1 44 LEU HA 1 45 LEU HG . . 4.160 4.182 3.982 4.254 0.094 1 0 "[ . 1 . 2]" 1
735 1 44 LEU QB 1 44 LEU QD . . 2.870 1.902 1.849 1.988 . 0 0 "[ . 1 . 2]" 1
736 1 44 LEU QB 1 45 LEU HA . . 4.580 4.178 3.628 4.490 . 0 0 "[ . 1 . 2]" 1
737 1 44 LEU QB 1 46 GLN QE . . 4.850 3.785 2.727 4.333 . 0 0 "[ . 1 . 2]" 1
738 1 44 LEU QD 1 46 GLN QE . . 4.660 3.303 2.279 4.015 . 0 0 "[ . 1 . 2]" 1
739 1 44 LEU QD 1 46 GLN QG . . 5.500 3.590 1.926 4.770 . 0 0 "[ . 1 . 2]" 1
740 1 45 LEU H 1 45 LEU HB2 . . 3.540 2.711 2.371 3.575 0.035 8 0 "[ . 1 . 2]" 1
741 1 45 LEU H 1 45 LEU HB3 . . 4.040 3.780 3.614 4.055 0.015 8 0 "[ . 1 . 2]" 1
742 1 45 LEU H 1 45 LEU MD2 . . 4.320 4.040 3.116 4.354 0.034 13 0 "[ . 1 . 2]" 1
743 1 45 LEU H 1 45 LEU HG . . 3.560 3.198 2.591 3.633 0.073 20 0 "[ . 1 . 2]" 1
744 1 45 LEU H 1 46 GLN H . . 5.120 4.126 3.152 4.577 . 0 0 "[ . 1 . 2]" 1
745 1 45 LEU HA 1 45 LEU MD2 . . 2.970 2.155 2.036 2.323 . 0 0 "[ . 1 . 2]" 1
746 1 45 LEU HA 1 45 LEU HG . . 3.520 2.930 2.745 3.168 . 0 0 "[ . 1 . 2]" 1
747 1 45 LEU HA 1 46 GLN H . . 2.820 2.193 2.113 2.292 . 0 0 "[ . 1 . 2]" 1
748 1 45 LEU HA 1 46 GLN QG . . 4.760 3.755 3.129 4.622 . 0 0 "[ . 1 . 2]" 1
749 1 45 LEU HA 1 61 LEU QD . . 5.320 4.041 3.252 4.490 . 0 0 "[ . 1 . 2]" 1
750 1 45 LEU HB2 1 46 GLN H . . 4.350 4.289 3.903 4.425 0.075 8 0 "[ . 1 . 2]" 1
751 1 45 LEU HB2 1 61 LEU QD . . 4.080 3.804 2.787 4.098 0.018 7 0 "[ . 1 . 2]" 1
752 1 45 LEU HB3 1 46 GLN H . . 3.940 3.423 2.792 4.012 0.072 1 0 "[ . 1 . 2]" 1
753 1 45 LEU HB3 1 61 LEU QD . . 3.720 2.726 2.199 3.095 . 0 0 "[ . 1 . 2]" 1
754 1 45 LEU MD2 1 46 GLN H . . 3.750 3.603 3.400 3.859 0.109 8 0 "[ . 1 . 2]" 1
755 1 45 LEU MD2 1 49 ASP HB2 . . 4.220 3.929 3.270 4.327 0.107 11 0 "[ . 1 . 2]" 1
756 1 45 LEU MD2 1 49 ASP HB3 . . 4.410 3.804 3.081 4.474 0.064 7 0 "[ . 1 . 2]" 1
757 1 45 LEU MD2 1 61 LEU QD . . 5.280 3.449 2.602 3.880 . 0 0 "[ . 1 . 2]" 1
758 1 45 LEU MD2 1 67 TRP HE1 . . 5.490 4.541 3.792 5.371 . 0 0 "[ . 1 . 2]" 1
759 1 45 LEU MD2 1 67 TRP HZ2 . . 3.570 3.135 2.220 3.674 0.104 19 0 "[ . 1 . 2]" 1
760 1 46 GLN H 1 46 GLN QB . . 3.400 2.791 2.380 3.283 . 0 0 "[ . 1 . 2]" 1
761 1 46 GLN H 1 46 GLN QE . . 4.900 3.443 1.986 4.426 . 0 0 "[ . 1 . 2]" 1
762 1 46 GLN H 1 46 GLN QG . . 4.020 2.623 2.107 3.150 . 0 0 "[ . 1 . 2]" 1
763 1 46 GLN H 1 49 ASP HB2 . . 4.530 3.244 2.385 4.292 . 0 0 "[ . 1 . 2]" 1
764 1 46 GLN H 1 49 ASP HB3 . . 5.010 4.276 3.714 5.070 0.060 13 0 "[ . 1 . 2]" 1
765 1 46 GLN H 1 61 LEU QD . . 4.510 3.368 2.886 3.900 . 0 0 "[ . 1 . 2]" 1
766 1 46 GLN HA 1 46 GLN QG . . 3.660 2.869 2.405 3.327 . 0 0 "[ . 1 . 2]" 1
767 1 46 GLN HA 1 47 TYR H . . 2.690 2.320 2.161 2.476 . 0 0 "[ . 1 . 2]" 1
768 1 46 GLN HA 1 61 LEU QD . . 5.200 3.482 2.691 3.976 . 0 0 "[ . 1 . 2]" 1
769 1 46 GLN QB 1 46 GLN QE . . 3.820 2.867 2.056 3.597 . 0 0 "[ . 1 . 2]" 1
770 1 46 GLN QB 1 47 TYR H . . 3.160 2.715 2.368 3.238 0.078 6 0 "[ . 1 . 2]" 1
771 1 46 GLN QG 1 47 TYR H . . 4.860 3.855 3.118 4.315 . 0 0 "[ . 1 . 2]" 1
772 1 47 TYR H 1 47 TYR QB . . 3.020 2.547 2.351 2.724 . 0 0 "[ . 1 . 2]" 1
773 1 47 TYR H 1 47 TYR QD . . 3.780 3.105 2.949 3.276 . 0 0 "[ . 1 . 2]" 1
774 1 47 TYR H 1 48 GLY H . . 4.830 4.362 3.770 4.642 . 0 0 "[ . 1 . 2]" 1
775 1 47 TYR H 1 61 LEU QD . . 4.350 3.536 3.192 4.275 . 0 0 "[ . 1 . 2]" 1
776 1 47 TYR HA 1 47 TYR QD . . 3.130 2.297 2.163 2.502 . 0 0 "[ . 1 . 2]" 1
777 1 47 TYR HA 1 48 GLY H . . 2.750 2.188 2.067 2.416 . 0 0 "[ . 1 . 2]" 1
778 1 47 TYR HA 1 48 GLY HA2 . . 4.330 4.382 4.302 4.412 0.082 13 0 "[ . 1 . 2]" 1
779 1 47 TYR HA 1 48 GLY HA3 . . 5.000 4.464 4.377 4.584 . 0 0 "[ . 1 . 2]" 1
780 1 47 TYR HA 1 49 ASP H . . 3.950 3.531 3.117 4.018 0.068 12 0 "[ . 1 . 2]" 1
781 1 47 TYR HA 1 61 LEU HB2 . . 4.220 4.015 3.324 5.056 0.836 11 2 "[ . 1+ -. 2]" 1
782 1 47 TYR HA 1 61 LEU QD . . 4.030 2.524 1.966 3.380 . 0 0 "[ . 1 . 2]" 1
783 1 47 TYR HA 1 61 LEU HG . . 3.790 3.393 2.651 3.893 0.103 7 0 "[ . 1 . 2]" 1
784 1 47 TYR QB 1 48 GLY H . . 4.030 3.293 2.596 3.887 . 0 0 "[ . 1 . 2]" 1
785 1 47 TYR QB 1 48 GLY HA3 . . 4.390 4.276 3.967 4.483 0.093 8 0 "[ . 1 . 2]" 1
786 1 47 TYR QB 1 63 GLU HA . . 4.980 4.279 3.836 4.843 . 0 0 "[ . 1 . 2]" 1
787 1 47 TYR QB 1 63 GLU QG . . 4.660 3.493 2.948 4.511 . 0 0 "[ . 1 . 2]" 1
788 1 47 TYR QD 1 48 GLY H . . 4.490 4.147 3.685 4.571 0.081 12 0 "[ . 1 . 2]" 1
789 1 47 TYR QD 1 61 LEU QD . . 4.280 2.385 1.784 3.200 . 0 0 "[ . 1 . 2]" 1
790 1 47 TYR QD 1 61 LEU HG . . 3.460 2.739 2.206 3.575 0.115 7 0 "[ . 1 . 2]" 1
791 1 47 TYR QD 1 62 GLU HA . . 3.780 3.702 2.924 3.877 0.097 1 0 "[ . 1 . 2]" 1
792 1 47 TYR QD 1 63 GLU H . . 4.870 4.194 3.845 4.564 . 0 0 "[ . 1 . 2]" 1
793 1 47 TYR QD 1 63 GLU HA . . 3.890 3.359 3.003 3.775 . 0 0 "[ . 1 . 2]" 1
794 1 47 TYR QD 1 63 GLU QB . . 4.740 4.434 2.870 4.838 0.098 5 0 "[ . 1 . 2]" 1
795 1 47 TYR QD 1 63 GLU QG . . 4.260 3.033 2.308 4.311 0.051 1 0 "[ . 1 . 2]" 1
796 1 47 TYR QE 1 63 GLU H . . 4.710 4.744 4.575 4.813 0.103 19 0 "[ . 1 . 2]" 1
797 1 47 TYR QE 1 63 GLU HA . . 4.020 2.749 2.406 2.939 . 0 0 "[ . 1 . 2]" 1
798 1 47 TYR QE 1 63 GLU QB . . 4.530 3.826 2.807 4.223 . 0 0 "[ . 1 . 2]" 1
799 1 47 TYR QE 1 63 GLU QG . . 4.670 3.174 2.434 4.588 . 0 0 "[ . 1 . 2]" 1
800 1 47 TYR QE 1 65 ALA H . . 4.910 3.448 2.534 4.227 . 0 0 "[ . 1 . 2]" 1
801 1 47 TYR QE 1 65 ALA HA . . 4.340 3.299 2.137 4.428 0.088 5 0 "[ . 1 . 2]" 1
802 1 48 GLY H 1 49 ASP H . . 3.230 2.308 1.566 2.824 . 0 0 "[ . 1 . 2]" 1
803 1 48 GLY H 1 49 ASP HB2 . . 4.710 4.037 3.266 4.633 . 0 0 "[ . 1 . 2]" 1
804 1 48 GLY H 1 60 VAL QG . . 4.450 2.998 2.305 3.972 . 0 0 "[ . 1 . 2]" 1
805 1 48 GLY H 1 61 LEU H . . 4.670 2.976 2.596 3.721 . 0 0 "[ . 1 . 2]" 1
806 1 48 GLY H 1 61 LEU HB2 . . 4.070 3.844 2.904 4.782 0.712 14 2 "[ . 1- +. 2]" 1
807 1 48 GLY H 1 61 LEU HB3 . . 4.910 2.397 1.905 3.168 . 0 0 "[ . 1 . 2]" 1
808 1 48 GLY H 1 61 LEU QD . . 3.840 3.589 2.785 3.827 . 0 0 "[ . 1 . 2]" 1
809 1 48 GLY H 1 61 LEU HG . . 4.860 4.462 3.680 4.891 0.031 7 0 "[ . 1 . 2]" 1
810 1 48 GLY HA2 1 60 VAL QG . . 3.440 2.117 1.906 2.633 . 0 0 "[ . 1 . 2]" 1
811 1 48 GLY HA2 1 61 LEU H . . 5.220 3.618 2.731 4.542 . 0 0 "[ . 1 . 2]" 1
812 1 48 GLY HA3 1 60 VAL QG . . 4.130 3.475 3.163 3.874 . 0 0 "[ . 1 . 2]" 1
813 1 49 ASP H 1 49 ASP HA . . 2.830 2.760 2.668 2.898 0.068 12 0 "[ . 1 . 2]" 1
814 1 49 ASP H 1 49 ASP HB2 . . 3.230 2.071 1.986 2.239 . 0 0 "[ . 1 . 2]" 1
815 1 49 ASP H 1 49 ASP HB3 . . 3.500 3.330 3.063 3.504 0.004 19 0 "[ . 1 . 2]" 1
816 1 49 ASP H 1 60 VAL QG . . 4.880 3.955 2.858 4.732 . 0 0 "[ . 1 . 2]" 1
817 1 49 ASP H 1 61 LEU H . . 4.960 3.604 3.167 4.103 . 0 0 "[ . 1 . 2]" 1
818 1 49 ASP H 1 61 LEU HB2 . . 3.730 3.835 3.471 4.470 0.740 11 2 "[ . 1+ -. 2]" 1
819 1 49 ASP H 1 61 LEU HB3 . . 4.400 3.025 2.651 3.663 . 0 0 "[ . 1 . 2]" 1
820 1 49 ASP H 1 61 LEU QD . . 4.470 3.628 3.274 3.988 . 0 0 "[ . 1 . 2]" 1
821 1 49 ASP H 1 61 LEU HG . . 5.500 5.263 4.646 5.577 0.077 9 0 "[ . 1 . 2]" 1
822 1 49 ASP HA 1 50 LYS H . . 3.510 3.322 3.191 3.475 . 0 0 "[ . 1 . 2]" 1
823 1 49 ASP HB2 1 50 LYS H . . 4.170 3.513 3.176 3.865 . 0 0 "[ . 1 . 2]" 1
824 1 49 ASP HB2 1 61 LEU HB2 . . 3.980 3.570 2.751 4.073 0.093 9 0 "[ . 1 . 2]" 1
825 1 49 ASP HB2 1 61 LEU HB3 . . 4.920 3.543 2.647 4.416 . 0 0 "[ . 1 . 2]" 1
826 1 49 ASP HB2 1 61 LEU QD . . 4.220 3.230 2.564 3.513 . 0 0 "[ . 1 . 2]" 1
827 1 49 ASP HB2 1 67 TRP HH2 . . 4.430 3.042 2.429 3.779 . 0 0 "[ . 1 . 2]" 1
828 1 49 ASP HB3 1 50 LYS H . . 3.670 3.536 3.062 3.754 0.084 20 0 "[ . 1 . 2]" 1
829 1 49 ASP HB3 1 61 LEU QD . . 4.650 4.368 3.576 4.668 0.018 10 0 "[ . 1 . 2]" 1
830 1 49 ASP HB3 1 67 TRP HH2 . . 5.000 2.467 2.145 3.209 . 0 0 "[ . 1 . 2]" 1
831 1 49 ASP HB3 1 67 TRP HZ2 . . 5.500 3.797 3.036 4.568 . 0 0 "[ . 1 . 2]" 1
832 1 50 LYS H 1 50 LYS HB2 . . 3.620 2.959 2.640 3.319 . 0 0 "[ . 1 . 2]" 1
833 1 50 LYS H 1 50 LYS HB3 . . 3.810 3.690 3.464 3.876 0.066 13 0 "[ . 1 . 2]" 1
834 1 50 LYS H 1 50 LYS HG3 . . 4.760 4.296 4.011 4.624 . 0 0 "[ . 1 . 2]" 1
835 1 50 LYS H 1 51 LEU H . . 4.870 4.176 4.009 4.361 . 0 0 "[ . 1 . 2]" 1
836 1 50 LYS H 1 60 VAL QG . . 5.020 3.095 1.777 3.998 . 0 0 "[ . 1 . 2]" 1
837 1 50 LYS HA 1 50 LYS HE2 . . 4.740 4.547 3.566 5.469 0.729 2 3 "[ + . 1 * - 2]" 1
838 1 50 LYS HA 1 50 LYS HG2 . . 3.990 3.055 2.520 3.709 . 0 0 "[ . 1 . 2]" 1
839 1 50 LYS HA 1 50 LYS HG3 . . 4.250 2.478 2.196 2.624 . 0 0 "[ . 1 . 2]" 1
840 1 50 LYS HA 1 51 LEU H . . 2.930 2.196 2.109 2.305 . 0 0 "[ . 1 . 2]" 1
841 1 50 LYS HA 1 51 LEU HB2 . . 5.010 4.296 3.993 4.537 . 0 0 "[ . 1 . 2]" 1
842 1 50 LYS HA 1 60 VAL H . . 4.690 4.718 4.402 4.786 0.096 18 0 "[ . 1 . 2]" 1
843 1 50 LYS HA 1 60 VAL HA . . 3.170 2.512 2.073 2.793 . 0 0 "[ . 1 . 2]" 1
844 1 50 LYS HA 1 60 VAL HB . . 5.420 4.661 2.230 5.513 0.093 10 0 "[ . 1 . 2]" 1
845 1 50 LYS HA 1 60 VAL QG . . 3.880 2.986 2.205 3.556 . 0 0 "[ . 1 . 2]" 1
846 1 50 LYS HA 1 61 LEU H . . 4.060 4.019 3.642 4.139 0.079 18 0 "[ . 1 . 2]" 1
847 1 50 LYS HA 1 67 TRP HH2 . . 4.440 3.976 3.498 4.510 0.070 19 0 "[ . 1 . 2]" 1
848 1 50 LYS HA 1 67 TRP HZ3 . . 3.490 2.346 2.044 2.738 . 0 0 "[ . 1 . 2]" 1
849 1 50 LYS HB2 1 50 LYS HE2 . . 4.150 3.251 2.151 3.968 . 0 0 "[ . 1 . 2]" 1
850 1 50 LYS HB2 1 51 LEU H . . 4.350 4.212 3.794 4.423 0.073 10 0 "[ . 1 . 2]" 1
851 1 50 LYS HB2 1 60 VAL HA . . 4.690 4.492 4.011 4.726 0.036 7 0 "[ . 1 . 2]" 1
852 1 50 LYS HB2 1 60 VAL QG . . 4.030 3.474 2.704 3.993 . 0 0 "[ . 1 . 2]" 1
853 1 50 LYS HB3 1 50 LYS HE2 . . 4.290 4.240 3.303 4.788 0.498 12 0 "[ . 1 . 2]" 1
854 1 50 LYS HB3 1 51 LEU H . . 4.690 3.860 3.646 4.102 . 0 0 "[ . 1 . 2]" 1
855 1 50 LYS HB3 1 51 LEU HA . . 4.340 4.415 4.342 4.442 0.102 11 0 "[ . 1 . 2]" 1
856 1 50 LYS HE2 1 50 LYS HG2 . . 4.240 3.679 2.924 4.042 . 0 0 "[ . 1 . 2]" 1
857 1 50 LYS HE2 1 60 VAL QG . . 3.680 3.502 2.524 4.407 0.727 2 1 "[ + . 1 . 2]" 1
858 1 50 LYS HG2 1 51 LEU H . . 4.340 2.835 2.310 3.992 . 0 0 "[ . 1 . 2]" 1
859 1 50 LYS HG2 1 58 CYS HA . . 5.180 4.518 4.005 5.117 . 0 0 "[ . 1 . 2]" 1
860 1 50 LYS HG2 1 58 CYS HB3 . . 4.830 4.576 3.471 5.102 0.272 4 0 "[ . 1 . 2]" 1
861 1 50 LYS HG2 1 59 PHE H . . 4.790 3.736 3.052 4.638 . 0 0 "[ . 1 . 2]" 1
862 1 50 LYS HG3 1 51 LEU H . . 4.350 2.964 2.017 3.779 . 0 0 "[ . 1 . 2]" 1
863 1 50 LYS HG3 1 58 CYS HB3 . . 5.020 4.118 3.136 5.076 0.056 7 0 "[ . 1 . 2]" 1
864 1 50 LYS HG3 1 60 VAL HA . . 5.070 4.115 3.816 4.604 . 0 0 "[ . 1 . 2]" 1
865 1 51 LEU H 1 51 LEU HB2 . . 3.640 2.647 2.408 2.994 . 0 0 "[ . 1 . 2]" 1
866 1 51 LEU H 1 51 LEU HB3 . . 4.190 3.439 2.967 3.708 . 0 0 "[ . 1 . 2]" 1
867 1 51 LEU H 1 51 LEU QD . . 4.710 3.801 3.235 3.971 . 0 0 "[ . 1 . 2]" 1
868 1 51 LEU H 1 59 PHE H . . 3.590 2.740 2.475 3.046 . 0 0 "[ . 1 . 2]" 1
869 1 51 LEU H 1 59 PHE HB2 . . 4.390 2.964 2.367 3.462 . 0 0 "[ . 1 . 2]" 1
870 1 51 LEU H 1 59 PHE HB3 . . 4.490 4.222 3.707 4.571 0.081 14 0 "[ . 1 . 2]" 1
871 1 51 LEU H 1 60 VAL HA . . 4.230 3.730 3.243 4.187 . 0 0 "[ . 1 . 2]" 1
872 1 51 LEU H 1 60 VAL QG . . 5.240 4.144 3.591 4.516 . 0 0 "[ . 1 . 2]" 1
873 1 51 LEU H 1 67 TRP HH2 . . 4.890 4.422 4.023 4.948 0.058 19 0 "[ . 1 . 2]" 1
874 1 51 LEU H 1 67 TRP HZ3 . . 3.790 2.569 2.241 3.043 . 0 0 "[ . 1 . 2]" 1
875 1 51 LEU HA 1 51 LEU QD . . 3.160 2.137 1.994 2.433 . 0 0 "[ . 1 . 2]" 1
876 1 51 LEU HA 1 51 LEU HG . . 3.700 2.844 2.517 3.671 . 0 0 "[ . 1 . 2]" 1
877 1 51 LEU HA 1 52 VAL H . . 2.780 2.271 2.095 2.381 . 0 0 "[ . 1 . 2]" 1
878 1 51 LEU HA 1 52 VAL MG2 . . 4.740 3.835 3.662 4.026 . 0 0 "[ . 1 . 2]" 1
879 1 51 LEU HB2 1 52 VAL H . . 4.430 4.175 3.983 4.371 . 0 0 "[ . 1 . 2]" 1
880 1 51 LEU HB2 1 59 PHE H . . 4.800 4.113 3.665 4.788 . 0 0 "[ . 1 . 2]" 1
881 1 51 LEU HB2 1 59 PHE HB2 . . 3.940 2.398 2.058 3.005 . 0 0 "[ . 1 . 2]" 1
882 1 51 LEU HB2 1 59 PHE HB3 . . 4.180 3.662 2.695 4.240 0.060 5 0 "[ . 1 . 2]" 1
883 1 51 LEU HB2 1 59 PHE QD . . 5.080 3.452 2.632 4.150 . 0 0 "[ . 1 . 2]" 1
884 1 51 LEU HB3 1 51 LEU QD . . 3.240 2.225 2.123 2.449 . 0 0 "[ . 1 . 2]" 1
885 1 51 LEU HB3 1 52 VAL H . . 3.790 3.085 2.708 3.518 . 0 0 "[ . 1 . 2]" 1
886 1 51 LEU HB3 1 53 ASP H . . 5.120 5.123 4.712 5.203 0.083 16 0 "[ . 1 . 2]" 1
887 1 51 LEU HB3 1 59 PHE H . . 4.890 4.192 3.323 4.817 . 0 0 "[ . 1 . 2]" 1
888 1 51 LEU HB3 1 59 PHE HB2 . . 4.250 2.880 2.085 3.340 . 0 0 "[ . 1 . 2]" 1
889 1 51 LEU HB3 1 59 PHE HB3 . . 4.630 4.404 3.660 4.708 0.078 11 0 "[ . 1 . 2]" 1
890 1 51 LEU HB3 1 59 PHE QD . . 4.740 2.682 2.222 3.517 . 0 0 "[ . 1 . 2]" 1
891 1 51 LEU QD 1 52 VAL H . . 3.690 2.784 2.251 3.206 . 0 0 "[ . 1 . 2]" 1
892 1 51 LEU QD 1 59 PHE HB2 . . 4.630 3.539 3.245 3.858 . 0 0 "[ . 1 . 2]" 1
893 1 51 LEU QD 1 59 PHE HB3 . . 4.960 4.154 3.531 4.685 . 0 0 "[ . 1 . 2]" 1
894 1 51 LEU QD 1 67 TRP HE1 . . 5.500 4.053 3.567 4.990 . 0 0 "[ . 1 . 2]" 1
895 1 51 LEU QD 1 67 TRP HH2 . . 5.500 3.289 2.809 3.726 . 0 0 "[ . 1 . 2]" 1
896 1 51 LEU QD 1 67 TRP HZ2 . . 4.770 3.371 2.891 3.759 . 0 0 "[ . 1 . 2]" 1
897 1 51 LEU QD 1 67 TRP HZ3 . . 4.540 3.486 2.886 3.961 . 0 0 "[ . 1 . 2]" 1
898 1 51 LEU HG 1 52 VAL H . . 5.300 3.954 2.327 4.614 . 0 0 "[ . 1 . 2]" 1
899 1 52 VAL H 1 52 VAL HB . . 3.050 2.707 2.499 2.903 . 0 0 "[ . 1 . 2]" 1
900 1 52 VAL H 1 52 VAL MG1 . . 3.930 3.855 3.711 3.988 0.058 10 0 "[ . 1 . 2]" 1
901 1 52 VAL H 1 52 VAL MG2 . . 3.330 3.123 2.963 3.236 . 0 0 "[ . 1 . 2]" 1
902 1 52 VAL HA 1 52 VAL MG1 . . 3.230 2.509 2.352 2.648 . 0 0 "[ . 1 . 2]" 1
903 1 52 VAL HA 1 52 VAL MG2 . . 3.190 2.362 2.235 2.528 . 0 0 "[ . 1 . 2]" 1
904 1 52 VAL HA 1 53 ASP H . . 2.980 2.289 2.093 2.412 . 0 0 "[ . 1 . 2]" 1
905 1 52 VAL HA 1 56 PHE HA . . 4.700 4.645 4.350 4.773 0.073 11 0 "[ . 1 . 2]" 1
906 1 52 VAL HA 1 58 CYS HA . . 3.280 2.729 2.300 3.268 . 0 0 "[ . 1 . 2]" 1
907 1 52 VAL HA 1 59 PHE H . . 4.400 3.796 3.421 4.115 . 0 0 "[ . 1 . 2]" 1
908 1 52 VAL HB 1 53 ASP H . . 4.670 4.147 3.930 4.417 . 0 0 "[ . 1 . 2]" 1
909 1 52 VAL MG1 1 53 ASP H . . 3.640 2.552 2.257 3.074 . 0 0 "[ . 1 . 2]" 1
910 1 52 VAL MG1 1 56 PHE H . . 4.640 3.513 3.055 3.834 . 0 0 "[ . 1 . 2]" 1
911 1 52 VAL MG1 1 56 PHE HA . . 3.550 2.460 2.071 2.906 . 0 0 "[ . 1 . 2]" 1
912 1 52 VAL MG1 1 56 PHE HB3 . . 5.020 4.127 3.412 4.778 . 0 0 "[ . 1 . 2]" 1
913 1 52 VAL MG1 1 56 PHE QD . . 4.280 3.828 2.313 4.331 0.051 18 0 "[ . 1 . 2]" 1
914 1 52 VAL MG1 1 56 PHE QE . . 4.850 4.602 2.861 4.931 0.081 10 0 "[ . 1 . 2]" 1
915 1 52 VAL MG1 1 57 HIS H . . 5.020 3.943 3.336 4.642 . 0 0 "[ . 1 . 2]" 1
916 1 52 VAL MG1 1 58 CYS H . . 5.500 4.763 3.042 5.588 0.088 4 0 "[ . 1 . 2]" 1
917 1 52 VAL MG1 1 58 CYS HA . . 4.270 3.754 2.824 4.249 . 0 0 "[ . 1 . 2]" 1
918 1 52 VAL MG2 1 53 ASP H . . 4.360 3.968 3.725 4.178 . 0 0 "[ . 1 . 2]" 1
919 1 52 VAL MG2 1 56 PHE HA . . 4.270 4.338 4.044 4.377 0.107 18 0 "[ . 1 . 2]" 1
920 1 52 VAL MG2 1 58 CYS HA . . 4.310 2.504 2.077 2.912 . 0 0 "[ . 1 . 2]" 1
921 1 52 VAL MG2 1 58 CYS HB2 . . 4.750 4.221 3.220 4.839 0.089 8 0 "[ . 1 . 2]" 1
922 1 53 ASP H 1 53 ASP HB3 . . 3.680 2.771 2.574 2.988 . 0 0 "[ . 1 . 2]" 1
923 1 53 ASP H 1 54 SER H . . 5.020 4.394 4.235 4.491 . 0 0 "[ . 1 . 2]" 1
924 1 53 ASP H 1 56 PHE H . . 4.790 3.585 3.338 4.038 . 0 0 "[ . 1 . 2]" 1
925 1 53 ASP H 1 56 PHE HA . . 4.960 3.746 3.320 4.396 . 0 0 "[ . 1 . 2]" 1
926 1 53 ASP H 1 57 HIS H . . 3.750 3.224 2.971 3.822 0.072 4 0 "[ . 1 . 2]" 1
927 1 53 ASP H 1 57 HIS HB2 . . 4.880 3.820 3.206 4.940 0.060 8 0 "[ . 1 . 2]" 1
928 1 53 ASP H 1 58 CYS HA . . 4.720 4.380 4.046 4.796 0.076 8 0 "[ . 1 . 2]" 1
929 1 53 ASP HA 1 54 SER H . . 3.310 2.558 2.338 2.852 . 0 0 "[ . 1 . 2]" 1
930 1 53 ASP HA 1 102 VAL MG1 . . 4.310 3.675 3.196 4.211 . 0 0 "[ . 1 . 2]" 1
931 1 53 ASP HB2 1 54 SER H . . 3.140 2.319 2.198 2.402 . 0 0 "[ . 1 . 2]" 1
932 1 53 ASP HB2 1 56 PHE H . . 5.090 5.015 4.658 5.173 0.083 20 0 "[ . 1 . 2]" 1
933 1 53 ASP HB3 1 54 SER H . . 3.700 3.748 3.527 3.780 0.080 1 0 "[ . 1 . 2]" 1
934 1 53 ASP HB3 1 59 PHE QD . . 4.730 3.854 3.291 4.640 . 0 0 "[ . 1 . 2]" 1
935 1 53 ASP HB3 1 59 PHE QE . . 4.900 2.692 2.084 4.019 . 0 0 "[ . 1 . 2]" 1
936 1 54 SER H 1 54 SER HB2 . . 3.530 2.451 2.003 3.574 0.044 8 0 "[ . 1 . 2]" 1
937 1 54 SER H 1 54 SER HB3 . . 3.600 3.051 2.294 3.598 . 0 0 "[ . 1 . 2]" 1
938 1 54 SER H 1 55 ASN H . . 3.820 2.854 2.574 3.159 . 0 0 "[ . 1 . 2]" 1
939 1 54 SER H 1 56 PHE H . . 5.160 4.332 4.107 4.608 . 0 0 "[ . 1 . 2]" 1
940 1 54 SER H 1 102 VAL HB . . 5.180 4.836 4.426 5.115 . 0 0 "[ . 1 . 2]" 1
941 1 54 SER H 1 102 VAL MG1 . . 5.110 3.620 3.243 3.967 . 0 0 "[ . 1 . 2]" 1
942 1 54 SER H 1 102 VAL MG2 . . 4.730 4.183 3.600 4.444 . 0 0 "[ . 1 . 2]" 1
943 1 54 SER HA 1 102 VAL H . . 4.270 4.249 3.850 4.358 0.088 9 0 "[ . 1 . 2]" 1
944 1 54 SER HA 1 102 VAL HB . . 3.270 2.468 2.224 3.132 . 0 0 "[ . 1 . 2]" 1
945 1 54 SER HA 1 102 VAL MG1 . . 3.830 2.686 2.132 3.425 . 0 0 "[ . 1 . 2]" 1
946 1 54 SER HA 1 102 VAL MG2 . . 3.320 2.269 2.106 2.644 . 0 0 "[ . 1 . 2]" 1
947 1 54 SER HB2 1 55 ASN H . . 4.990 3.838 3.254 4.272 . 0 0 "[ . 1 . 2]" 1
948 1 54 SER HB2 1 102 VAL MG2 . . 5.500 4.561 3.846 5.081 . 0 0 "[ . 1 . 2]" 1
949 1 54 SER HB3 1 55 ASN H . . 3.860 3.804 3.197 4.341 0.481 18 0 "[ . 1 . 2]" 1
950 1 54 SER HB3 1 102 VAL MG2 . . 4.750 4.525 3.887 4.846 0.096 4 0 "[ . 1 . 2]" 1
951 1 55 ASN H 1 55 ASN HB2 . . 3.340 2.465 2.227 2.665 . 0 0 "[ . 1 . 2]" 1
952 1 55 ASN H 1 55 ASN HB3 . . 3.720 3.603 2.856 3.774 0.054 17 0 "[ . 1 . 2]" 1
953 1 55 ASN H 1 55 ASN HD22 . . 5.240 4.366 3.419 5.554 0.314 11 0 "[ . 1 . 2]" 1
954 1 55 ASN H 1 56 PHE H . . 3.020 2.324 1.910 2.735 . 0 0 "[ . 1 . 2]" 1
955 1 55 ASN H 1 102 VAL MG2 . . 5.000 4.419 3.794 4.783 . 0 0 "[ . 1 . 2]" 1
956 1 55 ASN HA 1 55 ASN HB2 . . 2.990 3.015 2.747 3.050 0.060 10 0 "[ . 1 . 2]" 1
957 1 55 ASN HA 1 56 PHE QD . . 4.550 3.433 2.939 4.332 . 0 0 "[ . 1 . 2]" 1
958 1 55 ASN HB2 1 55 ASN HD22 . . 3.650 3.589 3.478 3.921 0.271 11 0 "[ . 1 . 2]" 1
959 1 55 ASN HB2 1 56 PHE H . . 4.380 3.618 3.246 4.062 . 0 0 "[ . 1 . 2]" 1
960 1 55 ASN HB2 1 57 HIS H . . 3.910 3.086 2.485 3.947 0.037 4 0 "[ . 1 . 2]" 1
961 1 55 ASN HB2 1 57 HIS HB2 . . 5.080 3.735 2.785 4.363 . 0 0 "[ . 1 . 2]" 1
962 1 55 ASN HB3 1 55 ASN HD22 . . 3.820 3.966 3.546 4.139 0.319 4 0 "[ . 1 . 2]" 1
963 1 55 ASN HB3 1 57 HIS H . . 5.100 3.817 2.590 4.452 . 0 0 "[ . 1 . 2]" 1
964 1 56 PHE H 1 56 PHE HA . . 2.820 2.245 2.191 2.271 . 0 0 "[ . 1 . 2]" 1
965 1 56 PHE H 1 56 PHE HB2 . . 4.130 3.660 3.400 3.848 . 0 0 "[ . 1 . 2]" 1
966 1 56 PHE H 1 56 PHE QD . . 4.790 3.040 2.617 3.763 . 0 0 "[ . 1 . 2]" 1
967 1 56 PHE H 1 57 HIS H . . 3.200 2.601 2.316 2.947 . 0 0 "[ . 1 . 2]" 1
968 1 56 PHE H 1 102 VAL MG2 . . 4.680 3.592 3.162 4.131 . 0 0 "[ . 1 . 2]" 1
969 1 56 PHE HA 1 56 PHE QD . . 4.150 3.049 2.496 3.224 . 0 0 "[ . 1 . 2]" 1
970 1 56 PHE HA 1 56 PHE QE . . 4.610 4.668 4.395 4.712 0.102 10 0 "[ . 1 . 2]" 1
971 1 56 PHE HA 1 57 HIS H . . 3.500 3.020 2.535 3.172 . 0 0 "[ . 1 . 2]" 1
972 1 56 PHE HA 1 102 VAL MG2 . . 4.610 4.027 3.355 4.696 0.086 8 0 "[ . 1 . 2]" 1
973 1 56 PHE HB2 1 73 LEU H . . 4.260 3.312 2.912 3.814 . 0 0 "[ . 1 . 2]" 1
974 1 56 PHE HB2 1 73 LEU HB2 . . 5.140 4.961 4.694 5.220 0.080 4 0 "[ . 1 . 2]" 1
975 1 56 PHE HB2 1 73 LEU HB3 . . 4.200 3.785 3.506 3.924 . 0 0 "[ . 1 . 2]" 1
976 1 56 PHE HB2 1 73 LEU QD . . 5.270 4.651 4.099 5.057 . 0 0 "[ . 1 . 2]" 1
977 1 56 PHE HB3 1 72 PRO HB2 . . 5.300 4.417 3.768 5.097 . 0 0 "[ . 1 . 2]" 1
978 1 56 PHE HB3 1 72 PRO HB3 . . 5.060 5.162 4.387 5.874 0.814 12 5 "[ . * +**. -]" 1
979 1 56 PHE HB3 1 73 LEU H . . 3.990 2.537 2.188 2.970 . 0 0 "[ . 1 . 2]" 1
980 1 56 PHE HB3 1 73 LEU HB2 . . 4.740 3.451 3.208 3.652 . 0 0 "[ . 1 . 2]" 1
981 1 56 PHE HB3 1 73 LEU HB3 . . 3.970 2.142 2.024 2.308 . 0 0 "[ . 1 . 2]" 1
982 1 56 PHE QD 1 73 LEU H . . 5.500 4.186 3.685 4.819 . 0 0 "[ . 1 . 2]" 1
983 1 56 PHE QD 1 73 LEU HB3 . . 4.580 2.583 2.227 3.246 . 0 0 "[ . 1 . 2]" 1
984 1 56 PHE QD 1 73 LEU QD . . 4.240 2.503 1.906 3.168 . 0 0 "[ . 1 . 2]" 1
985 1 56 PHE QD 1 73 LEU HG . . 4.050 3.986 3.429 4.162 0.112 15 0 "[ . 1 . 2]" 1
986 1 56 PHE QD 1 78 LEU HB2 . . 5.500 3.767 2.588 4.455 . 0 0 "[ . 1 . 2]" 1
987 1 56 PHE QD 1 102 VAL MG2 . . 3.490 3.412 3.050 3.609 0.119 17 0 "[ . 1 . 2]" 1
988 1 56 PHE QE 1 75 PRO HA . . 4.520 2.780 2.185 4.565 0.045 8 0 "[ . 1 . 2]" 1
989 1 56 PHE QE 1 78 LEU HB2 . . 4.620 2.436 2.101 2.802 . 0 0 "[ . 1 . 2]" 1
990 1 56 PHE QE 1 78 LEU HB3 . . 4.850 3.038 2.445 4.184 . 0 0 "[ . 1 . 2]" 1
991 1 56 PHE QE 1 78 LEU MD1 . . 4.210 3.935 2.939 4.302 0.092 9 0 "[ . 1 . 2]" 1
992 1 56 PHE QE 1 78 LEU MD2 . . 3.920 2.990 2.105 3.503 . 0 0 "[ . 1 . 2]" 1
993 1 56 PHE QE 1 101 SER HA . . 4.770 3.705 3.002 4.308 . 0 0 "[ . 1 . 2]" 1
994 1 56 PHE QE 1 102 VAL H . . 5.310 3.421 2.447 4.273 . 0 0 "[ . 1 . 2]" 1
995 1 56 PHE QE 1 102 VAL MG2 . . 3.510 2.631 2.358 3.363 . 0 0 "[ . 1 . 2]" 1
996 1 56 PHE HZ 1 75 PRO HA . . 4.580 3.843 3.095 4.659 0.079 8 0 "[ . 1 . 2]" 1
997 1 56 PHE HZ 1 78 LEU HB2 . . 4.700 3.691 2.676 4.633 . 0 0 "[ . 1 . 2]" 1
998 1 56 PHE HZ 1 78 LEU MD2 . . 3.850 2.671 2.075 3.965 0.115 11 0 "[ . 1 . 2]" 1
999 1 56 PHE HZ 1 101 SER HA . . 3.850 3.175 2.261 3.937 0.087 15 0 "[ . 1 . 2]" 1
1000 1 56 PHE HZ 1 102 VAL H . . 4.970 3.956 3.116 4.692 . 0 0 "[ . 1 . 2]" 1
1001 1 56 PHE HZ 1 102 VAL MG2 . . 3.720 3.352 2.450 3.823 0.103 11 0 "[ . 1 . 2]" 1
1002 1 57 HIS H 1 57 HIS HB2 . . 3.160 2.441 2.281 2.647 . 0 0 "[ . 1 . 2]" 1
1003 1 57 HIS H 1 57 HIS HB3 . . 3.720 3.592 3.485 3.674 . 0 0 "[ . 1 . 2]" 1
1004 1 57 HIS H 1 57 HIS HD2 . . 4.740 3.801 3.288 4.358 . 0 0 "[ . 1 . 2]" 1
1005 1 57 HIS H 1 58 CYS H . . 4.910 4.329 2.144 4.592 . 0 0 "[ . 1 . 2]" 1
1006 1 57 HIS HA 1 57 HIS HD2 . . 3.010 2.440 2.240 2.606 . 0 0 "[ . 1 . 2]" 1
1007 1 57 HIS HA 1 58 CYS H . . 2.940 2.300 2.189 3.006 0.066 8 0 "[ . 1 . 2]" 1
1008 1 57 HIS HA 1 59 PHE HZ . . 4.820 4.889 4.816 4.905 0.085 12 0 "[ . 1 . 2]" 1
1009 1 57 HIS HA 1 73 LEU HB2 . . 4.890 4.827 4.400 4.968 0.078 5 0 "[ . 1 . 2]" 1
1010 1 57 HIS HB2 1 58 CYS H . . 4.710 4.365 3.662 4.534 . 0 0 "[ . 1 . 2]" 1
1011 1 57 HIS HB2 1 59 PHE QE . . 4.930 2.453 2.136 3.300 . 0 0 "[ . 1 . 2]" 1
1012 1 57 HIS HB2 1 59 PHE HZ . . 4.770 2.684 2.202 3.248 . 0 0 "[ . 1 . 2]" 1
1013 1 57 HIS HB3 1 58 CYS H . . 3.910 3.691 3.321 3.994 0.084 8 0 "[ . 1 . 2]" 1
1014 1 57 HIS HB3 1 59 PHE QE . . 4.590 2.965 2.570 3.308 . 0 0 "[ . 1 . 2]" 1
1015 1 57 HIS HB3 1 59 PHE HZ . . 5.270 2.535 2.442 2.762 . 0 0 "[ . 1 . 2]" 1
1016 1 57 HIS HD2 1 58 CYS H . . 4.820 4.576 4.312 4.895 0.075 17 0 "[ . 1 . 2]" 1
1017 1 57 HIS HD2 1 72 PRO HB2 . . 4.510 4.413 3.662 4.584 0.074 3 0 "[ . 1 . 2]" 1
1018 1 57 HIS HD2 1 72 PRO HB3 . . 4.000 2.867 2.169 3.446 . 0 0 "[ . 1 . 2]" 1
1019 1 57 HIS HD2 1 73 LEU H . . 5.040 4.917 3.916 5.118 0.078 5 0 "[ . 1 . 2]" 1
1020 1 58 CYS H 1 58 CYS HB2 . . 3.480 2.501 2.197 3.556 0.076 10 0 "[ . 1 . 2]" 1
1021 1 58 CYS H 1 58 CYS HB3 . . 4.100 3.429 2.792 4.065 . 0 0 "[ . 1 . 2]" 1
1022 1 58 CYS H 1 59 PHE H . . 4.990 4.541 4.126 4.643 . 0 0 "[ . 1 . 2]" 1
1023 1 58 CYS H 1 70 ALA H . . 4.850 4.384 4.112 4.933 0.083 8 0 "[ . 1 . 2]" 1
1024 1 58 CYS H 1 70 ALA MB . . 5.500 4.336 3.856 5.249 . 0 0 "[ . 1 . 2]" 1
1025 1 58 CYS H 1 73 LEU H . . 4.900 4.278 3.644 4.766 . 0 0 "[ . 1 . 2]" 1
1026 1 58 CYS H 1 73 LEU HB2 . . 5.040 3.753 3.279 4.088 . 0 0 "[ . 1 . 2]" 1
1027 1 58 CYS HA 1 59 PHE H . . 2.850 2.244 2.116 2.371 . 0 0 "[ . 1 . 2]" 1
1028 1 58 CYS HA 1 59 PHE QD . . 4.300 3.922 3.364 4.398 0.098 17 0 "[ . 1 . 2]" 1
1029 1 58 CYS HA 1 70 ALA MB . . 4.970 4.063 3.751 4.562 . 0 0 "[ . 1 . 2]" 1
1030 1 58 CYS HB2 1 70 ALA H . . 5.010 4.061 3.046 5.061 0.051 16 0 "[ . 1 . 2]" 1
1031 1 58 CYS HB2 1 70 ALA MB . . 3.600 2.904 2.167 3.694 0.094 7 0 "[ . 1 . 2]" 1
1032 1 58 CYS HB3 1 59 PHE H . . 3.660 3.083 2.701 3.613 . 0 0 "[ . 1 . 2]" 1
1033 1 58 CYS HB3 1 70 ALA MB . . 3.740 2.321 1.974 3.831 0.091 10 0 "[ . 1 . 2]" 1
1034 1 59 PHE H 1 59 PHE HB2 . . 3.620 2.690 2.340 2.901 . 0 0 "[ . 1 . 2]" 1
1035 1 59 PHE H 1 59 PHE HB3 . . 3.980 3.801 3.574 3.925 . 0 0 "[ . 1 . 2]" 1
1036 1 59 PHE H 1 59 PHE QD . . 3.760 3.333 2.966 3.659 . 0 0 "[ . 1 . 2]" 1
1037 1 59 PHE H 1 59 PHE QE . . 5.230 5.093 4.828 5.304 0.074 2 0 "[ . 1 . 2]" 1
1038 1 59 PHE H 1 60 VAL H . . 4.870 4.394 4.336 4.492 . 0 0 "[ . 1 . 2]" 1
1039 1 59 PHE H 1 70 ALA MB . . 4.460 3.434 3.006 4.260 . 0 0 "[ . 1 . 2]" 1
1040 1 59 PHE HA 1 59 PHE QD . . 4.120 2.631 2.162 3.127 . 0 0 "[ . 1 . 2]" 1
1041 1 59 PHE HA 1 60 VAL H . . 2.950 2.363 2.142 2.523 . 0 0 "[ . 1 . 2]" 1
1042 1 59 PHE HA 1 60 VAL HB . . 4.610 4.349 3.933 4.669 0.059 19 0 "[ . 1 . 2]" 1
1043 1 59 PHE HA 1 60 VAL QG . . 4.580 3.704 3.407 3.981 . 0 0 "[ . 1 . 2]" 1
1044 1 59 PHE HA 1 69 PRO HA . . 3.480 2.871 2.420 3.381 . 0 0 "[ . 1 . 2]" 1
1045 1 59 PHE HA 1 70 ALA H . . 3.720 2.496 1.835 3.433 . 0 0 "[ . 1 . 2]" 1
1046 1 59 PHE HA 1 70 ALA MB . . 4.180 2.775 2.469 3.330 . 0 0 "[ . 1 . 2]" 1
1047 1 59 PHE HB2 1 60 VAL H . . 4.680 3.771 3.537 4.170 . 0 0 "[ . 1 . 2]" 1
1048 1 59 PHE HB2 1 67 TRP HZ3 . . 4.210 3.696 3.346 3.988 . 0 0 "[ . 1 . 2]" 1
1049 1 59 PHE HB3 1 60 VAL H . . 4.000 2.702 2.415 3.209 . 0 0 "[ . 1 . 2]" 1
1050 1 59 PHE HB3 1 67 TRP HZ3 . . 4.120 4.131 3.762 4.197 0.077 18 0 "[ . 1 . 2]" 1
1051 1 59 PHE QD 1 60 VAL H . . 4.980 3.858 3.712 4.026 . 0 0 "[ . 1 . 2]" 1
1052 1 59 PHE QD 1 69 PRO HA . . 3.950 2.214 2.043 2.436 . 0 0 "[ . 1 . 2]" 1
1053 1 59 PHE QD 1 69 PRO HD2 . . 5.500 4.985 4.373 5.555 0.055 2 0 "[ . 1 . 2]" 1
1054 1 59 PHE QD 1 70 ALA MB . . 4.550 4.529 3.923 4.654 0.104 17 0 "[ . 1 . 2]" 1
1055 1 59 PHE QE 1 69 PRO HB3 . . 4.550 2.689 2.235 3.408 . 0 0 "[ . 1 . 2]" 1
1056 1 59 PHE QE 1 69 PRO HG3 . . 5.350 4.743 3.983 5.392 0.042 3 0 "[ . 1 . 2]" 1
1057 1 60 VAL H 1 60 VAL HB . . 3.300 2.778 2.476 3.392 0.092 19 0 "[ . 1 . 2]" 1
1058 1 60 VAL H 1 60 VAL QG . . 3.630 2.927 2.343 3.154 . 0 0 "[ . 1 . 2]" 1
1059 1 60 VAL H 1 61 LEU H . . 4.370 4.262 4.136 4.404 0.034 14 0 "[ . 1 . 2]" 1
1060 1 60 VAL H 1 67 TRP HZ3 . . 4.530 4.284 3.847 4.564 0.034 4 0 "[ . 1 . 2]" 1
1061 1 60 VAL H 1 69 PRO HA . . 4.730 4.411 3.869 4.790 0.060 8 0 "[ . 1 . 2]" 1
1062 1 60 VAL H 1 70 ALA H . . 4.870 4.288 3.620 4.936 0.066 11 0 "[ . 1 . 2]" 1
1063 1 60 VAL H 1 70 ALA MB . . 4.030 3.322 2.849 3.929 . 0 0 "[ . 1 . 2]" 1
1064 1 60 VAL HA 1 60 VAL QG . . 3.310 2.209 2.122 2.459 . 0 0 "[ . 1 . 2]" 1
1065 1 60 VAL HA 1 61 LEU H . . 2.890 2.223 2.117 2.382 . 0 0 "[ . 1 . 2]" 1
1066 1 60 VAL HA 1 61 LEU HA . . 5.000 4.441 4.269 4.518 . 0 0 "[ . 1 . 2]" 1
1067 1 60 VAL HA 1 61 LEU HB2 . . 4.500 4.406 4.009 4.632 0.132 11 0 "[ . 1 . 2]" 1
1068 1 60 VAL HA 1 61 LEU HB3 . . 5.060 4.637 4.479 4.820 . 0 0 "[ . 1 . 2]" 1
1069 1 60 VAL HA 1 67 TRP HZ3 . . 3.700 2.557 2.112 3.155 . 0 0 "[ . 1 . 2]" 1
1070 1 60 VAL HB 1 61 LEU H . . 4.260 4.048 3.550 4.324 0.064 7 0 "[ . 1 . 2]" 1
1071 1 60 VAL HB 1 68 HIS H . . 5.270 4.436 3.791 5.352 0.082 11 0 "[ . 1 . 2]" 1
1072 1 60 VAL HB 1 70 ALA MB . . 4.030 3.011 2.445 4.093 0.063 11 0 "[ . 1 . 2]" 1
1073 1 60 VAL QG 1 61 LEU H . . 3.520 2.330 1.903 2.716 . 0 0 "[ . 1 . 2]" 1
1074 1 60 VAL QG 1 62 GLU QG . . 3.590 2.772 2.097 3.561 . 0 0 "[ . 1 . 2]" 1
1075 1 60 VAL QG 1 67 TRP HZ3 . . 5.360 3.885 3.360 4.312 . 0 0 "[ . 1 . 2]" 1
1076 1 60 VAL QG 1 68 HIS H . . 4.860 4.047 3.394 4.501 . 0 0 "[ . 1 . 2]" 1
1077 1 60 VAL QG 1 68 HIS QB . . 4.940 3.777 2.850 4.426 . 0 0 "[ . 1 . 2]" 1
1078 1 60 VAL QG 1 70 ALA MB . . 3.080 2.211 1.959 3.094 0.014 8 0 "[ . 1 . 2]" 1
1079 1 61 LEU H 1 61 LEU HB2 . . 3.380 2.615 2.236 3.119 . 0 0 "[ . 1 . 2]" 1
1080 1 61 LEU H 1 61 LEU HB3 . . 3.470 2.469 2.265 2.744 . 0 0 "[ . 1 . 2]" 1
1081 1 61 LEU H 1 61 LEU QD . . 4.580 3.822 3.698 4.003 . 0 0 "[ . 1 . 2]" 1
1082 1 61 LEU H 1 61 LEU HG . . 4.680 4.409 4.183 4.548 . 0 0 "[ . 1 . 2]" 1
1083 1 61 LEU H 1 67 TRP HZ3 . . 4.110 3.316 2.881 3.835 . 0 0 "[ . 1 . 2]" 1
1084 1 61 LEU HA 1 61 LEU QD . . 2.840 2.237 2.064 2.533 . 0 0 "[ . 1 . 2]" 1
1085 1 61 LEU HA 1 61 LEU HG . . 4.140 3.015 2.856 3.389 . 0 0 "[ . 1 . 2]" 1
1086 1 61 LEU HA 1 62 GLU H . . 2.880 2.244 2.083 2.320 . 0 0 "[ . 1 . 2]" 1
1087 1 61 LEU HA 1 62 GLU HB2 . . 5.020 4.618 4.135 5.060 0.040 13 0 "[ . 1 . 2]" 1
1088 1 61 LEU HA 1 62 GLU QG . . 4.980 3.789 3.509 4.465 . 0 0 "[ . 1 . 2]" 1
1089 1 61 LEU HA 1 66 HIS HD2 . . 4.420 4.339 3.976 4.499 0.079 3 0 "[ . 1 . 2]" 1
1090 1 61 LEU HA 1 67 TRP H . . 4.990 4.784 4.569 5.044 0.054 5 0 "[ . 1 . 2]" 1
1091 1 61 LEU HA 1 67 TRP HA . . 3.250 2.398 2.187 2.627 . 0 0 "[ . 1 . 2]" 1
1092 1 61 LEU HA 1 68 HIS H . . 4.140 3.724 3.490 4.011 . 0 0 "[ . 1 . 2]" 1
1093 1 61 LEU HA 1 68 HIS QB . . 5.500 4.983 4.776 5.384 . 0 0 "[ . 1 . 2]" 1
1094 1 61 LEU HB2 1 61 LEU QD . . 2.980 2.265 2.113 2.576 . 0 0 "[ . 1 . 2]" 1
1095 1 61 LEU HB2 1 62 GLU H . . 4.920 4.339 4.125 4.521 . 0 0 "[ . 1 . 2]" 1
1096 1 61 LEU HB2 1 67 TRP HE1 . . 4.220 4.088 2.648 4.301 0.081 9 0 "[ . 1 . 2]" 1
1097 1 61 LEU HB2 1 67 TRP HH2 . . 4.540 3.524 3.211 4.240 . 0 0 "[ . 1 . 2]" 1
1098 1 61 LEU HB2 1 67 TRP HZ3 . . 5.500 3.955 3.510 4.951 . 0 0 "[ . 1 . 2]" 1
1099 1 61 LEU HB3 1 62 GLU H . . 4.710 4.103 3.917 4.260 . 0 0 "[ . 1 . 2]" 1
1100 1 61 LEU HB3 1 67 TRP HZ3 . . 4.990 4.926 4.495 5.305 0.315 11 0 "[ . 1 . 2]" 1
1101 1 61 LEU QD 1 62 GLU H . . 3.460 2.499 1.969 2.949 . 0 0 "[ . 1 . 2]" 1
1102 1 61 LEU QD 1 62 GLU HA . . 5.050 4.233 3.612 4.649 . 0 0 "[ . 1 . 2]" 1
1103 1 61 LEU QD 1 65 ALA H . . 4.670 3.521 2.777 4.468 . 0 0 "[ . 1 . 2]" 1
1104 1 61 LEU QD 1 65 ALA HA . . 3.480 2.364 2.015 3.069 . 0 0 "[ . 1 . 2]" 1
1105 1 61 LEU QD 1 65 ALA MB . . 4.170 3.305 2.533 3.884 . 0 0 "[ . 1 . 2]" 1
1106 1 61 LEU QD 1 66 HIS H . . 3.830 3.533 2.760 3.857 0.027 16 0 "[ . 1 . 2]" 1
1107 1 61 LEU QD 1 66 HIS HA . . 3.700 3.725 3.501 3.780 0.080 18 0 "[ . 1 . 2]" 1
1108 1 61 LEU QD 1 67 TRP H . . 5.340 4.250 3.714 4.555 . 0 0 "[ . 1 . 2]" 1
1109 1 61 LEU QD 1 67 TRP HB3 . . 5.270 4.834 4.142 5.397 0.127 7 0 "[ . 1 . 2]" 1
1110 1 61 LEU QD 1 67 TRP HD1 . . 4.900 3.318 2.844 4.171 . 0 0 "[ . 1 . 2]" 1
1111 1 61 LEU QD 1 67 TRP HE1 . . 4.090 2.737 2.245 3.761 . 0 0 "[ . 1 . 2]" 1
1112 1 61 LEU QD 1 67 TRP HZ2 . . 4.430 3.132 2.463 3.515 . 0 0 "[ . 1 . 2]" 1
1113 1 61 LEU HG 1 62 GLU H . . 4.370 3.229 2.346 4.419 0.049 6 0 "[ . 1 . 2]" 1
1114 1 61 LEU HG 1 65 ALA H . . 5.500 4.805 3.871 5.600 0.100 10 0 "[ . 1 . 2]" 1
1115 1 61 LEU HG 1 65 ALA HA . . 4.370 3.868 2.663 4.446 0.076 7 0 "[ . 1 . 2]" 1
1116 1 62 GLU H 1 62 GLU HB2 . . 3.440 2.593 2.298 2.929 . 0 0 "[ . 1 . 2]" 1
1117 1 62 GLU H 1 62 GLU HB3 . . 3.940 3.735 3.524 3.873 . 0 0 "[ . 1 . 2]" 1
1118 1 62 GLU H 1 62 GLU QG . . 3.990 2.872 2.576 3.360 . 0 0 "[ . 1 . 2]" 1
1119 1 62 GLU H 1 63 GLU H . . 4.760 4.499 4.403 4.591 . 0 0 "[ . 1 . 2]" 1
1120 1 62 GLU H 1 65 ALA H . . 4.760 3.983 3.568 4.590 . 0 0 "[ . 1 . 2]" 1
1121 1 62 GLU H 1 66 HIS H . . 3.970 3.566 3.025 4.037 0.067 5 0 "[ . 1 . 2]" 1
1122 1 62 GLU H 1 66 HIS HD2 . . 4.120 3.271 2.758 3.665 . 0 0 "[ . 1 . 2]" 1
1123 1 62 GLU H 1 67 TRP HA . . 4.060 3.561 3.288 3.885 . 0 0 "[ . 1 . 2]" 1
1124 1 62 GLU H 1 68 HIS H . . 4.860 4.274 3.813 4.926 0.066 9 0 "[ . 1 . 2]" 1
1125 1 62 GLU HA 1 62 GLU QG . . 3.390 2.409 2.268 2.571 . 0 0 "[ . 1 . 2]" 1
1126 1 62 GLU HA 1 63 GLU H . . 3.280 2.507 2.336 2.744 . 0 0 "[ . 1 . 2]" 1
1127 1 62 GLU HB2 1 63 GLU H . . 3.640 3.505 3.248 3.718 0.078 8 0 "[ . 1 . 2]" 1
1128 1 62 GLU HB2 1 64 ASP H . . 3.590 2.970 2.419 3.537 . 0 0 "[ . 1 . 2]" 1
1129 1 62 GLU HB2 1 66 HIS H . . 5.060 3.638 2.819 4.086 . 0 0 "[ . 1 . 2]" 1
1130 1 62 GLU HB2 1 66 HIS HD2 . . 3.590 2.719 2.226 3.197 . 0 0 "[ . 1 . 2]" 1
1131 1 62 GLU HB3 1 63 GLU H . . 2.980 2.358 2.040 2.602 . 0 0 "[ . 1 . 2]" 1
1132 1 62 GLU HB3 1 64 ASP H . . 3.730 2.992 2.414 3.573 . 0 0 "[ . 1 . 2]" 1
1133 1 62 GLU HB3 1 66 HIS HD2 . . 4.800 4.342 3.611 4.881 0.081 7 0 "[ . 1 . 2]" 1
1134 1 62 GLU QG 1 63 GLU H . . 4.920 4.084 3.763 4.266 . 0 0 "[ . 1 . 2]" 1
1135 1 62 GLU QG 1 66 HIS HD2 . . 3.400 2.840 1.988 3.422 0.022 7 0 "[ . 1 . 2]" 1
1136 1 62 GLU QG 1 68 HIS H . . 4.560 3.233 2.577 4.180 . 0 0 "[ . 1 . 2]" 1
1137 1 62 GLU QG 1 68 HIS QB . . 4.380 2.440 2.036 2.924 . 0 0 "[ . 1 . 2]" 1
1138 1 63 GLU H 1 63 GLU QB . . 3.070 2.517 2.160 2.969 . 0 0 "[ . 1 . 2]" 1
1139 1 63 GLU H 1 63 GLU QG . . 3.460 2.449 1.796 3.157 . 0 0 "[ . 1 . 2]" 1
1140 1 63 GLU H 1 64 ASP H . . 3.430 2.775 2.553 3.076 . 0 0 "[ . 1 . 2]" 1
1141 1 63 GLU H 1 65 ALA H . . 4.690 4.340 4.000 4.671 . 0 0 "[ . 1 . 2]" 1
1142 1 63 GLU HA 1 63 GLU QG . . 3.330 2.496 2.117 3.405 0.075 1 0 "[ . 1 . 2]" 1
1143 1 63 GLU HA 1 65 ALA H . . 3.920 3.380 3.097 3.816 . 0 0 "[ . 1 . 2]" 1
1144 1 63 GLU QB 1 63 GLU QG . . 2.400 2.076 2.009 2.128 . 0 0 "[ . 1 . 2]" 1
1145 1 63 GLU QB 1 64 ASP H . . 4.210 3.117 2.693 3.766 . 0 0 "[ . 1 . 2]" 1
1146 1 63 GLU QB 1 64 ASP HA . . 4.610 4.147 3.770 4.678 0.068 1 0 "[ . 1 . 2]" 1
1147 1 63 GLU QG 1 64 ASP H . . 4.540 4.298 2.601 4.610 0.070 14 0 "[ . 1 . 2]" 1
1148 1 64 ASP H 1 64 ASP HB2 . . 3.860 2.325 2.000 2.717 . 0 0 "[ . 1 . 2]" 1
1149 1 64 ASP H 1 64 ASP HB3 . . 3.490 2.869 2.315 3.539 0.049 6 0 "[ . 1 . 2]" 1
1150 1 64 ASP H 1 65 ALA H . . 3.120 2.660 2.346 2.915 . 0 0 "[ . 1 . 2]" 1
1151 1 64 ASP H 1 65 ALA HA . . 5.000 4.750 4.276 5.054 0.054 13 0 "[ . 1 . 2]" 1
1152 1 64 ASP H 1 65 ALA MB . . 4.980 4.927 4.735 5.037 0.057 13 0 "[ . 1 . 2]" 1
1153 1 64 ASP HA 1 65 ALA MB . . 4.450 4.022 3.660 4.324 . 0 0 "[ . 1 . 2]" 1
1154 1 64 ASP HA 1 66 HIS H . . 4.560 4.381 4.017 4.641 0.081 9 0 "[ . 1 . 2]" 1
1155 1 64 ASP HB2 1 65 ALA H . . 5.000 4.150 3.658 4.581 . 0 0 "[ . 1 . 2]" 1
1156 1 65 ALA H 1 65 ALA HA . . 2.880 2.182 2.116 2.233 . 0 0 "[ . 1 . 2]" 1
1157 1 65 ALA H 1 65 ALA MB . . 3.470 2.922 2.727 3.069 . 0 0 "[ . 1 . 2]" 1
1158 1 65 ALA H 1 66 HIS H . . 3.210 2.704 2.326 2.870 . 0 0 "[ . 1 . 2]" 1
1159 1 65 ALA HA 1 66 HIS H . . 3.570 3.103 2.693 3.408 . 0 0 "[ . 1 . 2]" 1
1160 1 65 ALA HA 1 66 HIS HA . . 4.570 4.516 4.231 4.632 0.062 16 0 "[ . 1 . 2]" 1
1161 1 65 ALA MB 1 66 HIS H . . 4.310 3.551 3.305 3.728 . 0 0 "[ . 1 . 2]" 1
1162 1 66 HIS H 1 66 HIS HB2 . . 3.870 3.751 3.674 3.909 0.039 9 0 "[ . 1 . 2]" 1
1163 1 66 HIS H 1 66 HIS HB3 . . 3.740 2.987 2.720 3.284 . 0 0 "[ . 1 . 2]" 1
1164 1 66 HIS H 1 66 HIS HD2 . . 5.130 3.315 2.893 3.838 . 0 0 "[ . 1 . 2]" 1
1165 1 66 HIS H 1 67 TRP H . . 4.920 4.506 4.412 4.583 . 0 0 "[ . 1 . 2]" 1
1166 1 66 HIS HA 1 66 HIS HD2 . . 3.990 4.074 4.059 4.091 0.101 5 0 "[ . 1 . 2]" 1
1167 1 66 HIS HA 1 67 TRP H . . 2.940 2.391 2.207 2.647 . 0 0 "[ . 1 . 2]" 1
1168 1 66 HIS HA 1 67 TRP HD1 . . 4.380 3.584 3.135 4.273 . 0 0 "[ . 1 . 2]" 1
1169 1 66 HIS HB2 1 67 TRP H . . 3.240 2.326 2.147 2.461 . 0 0 "[ . 1 . 2]" 1
1170 1 66 HIS HB3 1 67 TRP H . . 3.660 3.689 3.565 3.730 0.070 8 0 "[ . 1 . 2]" 1
1171 1 66 HIS HD2 1 67 TRP HA . . 4.310 3.482 3.091 4.134 . 0 0 "[ . 1 . 2]" 1
1172 1 66 HIS HD2 1 68 HIS H . . 3.900 3.311 2.464 3.973 0.073 11 0 "[ . 1 . 2]" 1
1173 1 66 HIS HD2 1 68 HIS QB . . 4.560 3.056 2.457 3.957 . 0 0 "[ . 1 . 2]" 1
1174 1 67 TRP H 1 67 TRP HB2 . . 3.910 2.430 2.309 2.562 . 0 0 "[ . 1 . 2]" 1
1175 1 67 TRP H 1 67 TRP HB3 . . 3.370 3.613 3.533 3.686 0.316 1 0 "[ . 1 . 2]" 1
1176 1 67 TRP H 1 67 TRP HD1 . . 3.690 3.218 2.943 3.455 . 0 0 "[ . 1 . 2]" 1
1177 1 67 TRP H 1 68 HIS H . . 4.910 4.223 3.853 4.418 . 0 0 "[ . 1 . 2]" 1
1178 1 67 TRP H 1 68 HIS HA . . 4.740 4.737 4.433 4.824 0.084 17 0 "[ . 1 . 2]" 1
1179 1 67 TRP HA 1 68 HIS H . . 2.940 2.231 2.150 2.349 . 0 0 "[ . 1 . 2]" 1
1180 1 67 TRP HB2 1 68 HIS H . . 4.080 4.410 3.937 4.606 0.526 3 4 "[ + . * 1 - *]" 1
1181 1 68 HIS H 1 68 HIS QB . . 3.440 2.257 2.131 2.422 . 0 0 "[ . 1 . 2]" 1
1182 1 68 HIS HA 1 69 PRO QD . . 2.920 2.152 2.060 2.291 . 0 0 "[ . 1 . 2]" 1
1183 1 68 HIS HA 1 69 PRO HG2 . . 4.740 4.578 4.380 4.807 0.067 3 0 "[ . 1 . 2]" 1
1184 1 68 HIS HA 1 69 PRO HG3 . . 5.130 4.613 4.497 4.717 . 0 0 "[ . 1 . 2]" 1
1185 1 68 HIS QB 1 69 PRO QD . . 4.080 2.963 2.214 3.468 . 0 0 "[ . 1 . 2]" 1
1186 1 69 PRO HA 1 70 ALA H . . 2.750 2.165 2.057 2.323 . 0 0 "[ . 1 . 2]" 1
1187 1 69 PRO HA 1 70 ALA MB . . 4.400 3.911 3.718 4.040 . 0 0 "[ . 1 . 2]" 1
1188 1 69 PRO HA 1 71 ALA H . . 4.790 3.911 3.322 4.525 . 0 0 "[ . 1 . 2]" 1
1189 1 69 PRO HB2 1 70 ALA H . . 4.320 3.607 2.804 3.962 . 0 0 "[ . 1 . 2]" 1
1190 1 69 PRO HB3 1 70 ALA H . . 3.920 4.053 3.614 4.304 0.384 17 0 "[ . 1 . 2]" 1
1191 1 70 ALA H 1 70 ALA MB . . 3.260 2.363 2.116 2.638 . 0 0 "[ . 1 . 2]" 1
1192 1 70 ALA H 1 71 ALA H . . 4.020 2.850 2.308 3.269 . 0 0 "[ . 1 . 2]" 1
1193 1 70 ALA HA 1 71 ALA H . . 3.090 2.844 2.543 3.094 0.004 6 0 "[ . 1 . 2]" 1
1194 1 70 ALA HA 1 71 ALA MB . . 4.760 3.865 3.751 3.975 . 0 0 "[ . 1 . 2]" 1
1195 1 71 ALA H 1 71 ALA MB . . 2.850 2.902 2.852 2.954 0.104 9 0 "[ . 1 . 2]" 1
1196 1 71 ALA H 1 72 PRO HD2 . . 4.780 4.748 4.501 4.849 0.069 4 0 "[ . 1 . 2]" 1
1197 1 71 ALA HA 1 72 PRO HB3 . . 4.970 5.020 4.951 5.048 0.078 16 0 "[ . 1 . 2]" 1
1198 1 71 ALA HA 1 72 PRO QD . . 2.640 2.327 2.170 2.398 . 0 0 "[ . 1 . 2]" 1
1199 1 71 ALA MB 1 72 PRO QD . . 3.130 2.019 1.972 2.150 . 0 0 "[ . 1 . 2]" 1
1200 1 71 ALA MB 1 72 PRO HG2 . . 4.170 3.674 3.478 3.882 . 0 0 "[ . 1 . 2]" 1
1201 1 72 PRO HA 1 73 LEU H . . 3.070 2.456 2.278 2.603 . 0 0 "[ . 1 . 2]" 1
1202 1 72 PRO HB2 1 73 LEU H . . 3.600 2.417 2.144 2.658 . 0 0 "[ . 1 . 2]" 1
1203 1 72 PRO HB2 1 73 LEU HA . . 4.330 4.406 4.382 4.421 0.091 9 0 "[ . 1 . 2]" 1
1204 1 72 PRO HB3 1 73 LEU H . . 3.710 3.394 3.203 3.568 . 0 0 "[ . 1 . 2]" 1
1205 1 73 LEU H 1 73 LEU HB2 . . 3.410 2.763 2.501 2.967 . 0 0 "[ . 1 . 2]" 1
1206 1 73 LEU H 1 73 LEU HB3 . . 3.270 2.620 2.357 2.912 . 0 0 "[ . 1 . 2]" 1
1207 1 73 LEU H 1 73 LEU QD . . 4.410 3.808 3.649 3.976 . 0 0 "[ . 1 . 2]" 1
1208 1 73 LEU H 1 74 PRO HD2 . . 5.020 4.981 4.805 5.088 0.068 15 0 "[ . 1 . 2]" 1
1209 1 73 LEU HA 1 73 LEU QD . . 3.060 2.499 2.069 3.006 . 0 0 "[ . 1 . 2]" 1
1210 1 73 LEU HA 1 73 LEU HG . . 3.460 2.773 2.331 3.095 . 0 0 "[ . 1 . 2]" 1
1211 1 73 LEU HA 1 74 PRO HD2 . . 3.050 2.413 2.153 2.622 . 0 0 "[ . 1 . 2]" 1
1212 1 73 LEU HA 1 74 PRO HD3 . . 2.920 2.456 2.114 2.798 . 0 0 "[ . 1 . 2]" 1
1213 1 73 LEU HB2 1 73 LEU QD . . 3.230 2.187 2.055 2.280 . 0 0 "[ . 1 . 2]" 1
1214 1 73 LEU HB2 1 74 PRO HD2 . . 4.620 4.136 3.950 4.282 . 0 0 "[ . 1 . 2]" 1
1215 1 73 LEU HB3 1 74 PRO HD2 . . 4.740 4.043 3.825 4.252 . 0 0 "[ . 1 . 2]" 1
1216 1 73 LEU QD 1 74 PRO HD2 . . 3.140 2.195 2.011 2.434 . 0 0 "[ . 1 . 2]" 1
1217 1 73 LEU QD 1 74 PRO HD3 . . 3.540 3.354 2.869 3.551 0.011 20 0 "[ . 1 . 2]" 1
1218 1 73 LEU QD 1 77 GLY H . . 4.990 3.474 2.541 4.180 . 0 0 "[ . 1 . 2]" 1
1219 1 73 LEU QD 1 77 GLY HA2 . . 4.300 3.373 3.061 3.610 . 0 0 "[ . 1 . 2]" 1
1220 1 73 LEU QD 1 77 GLY HA3 . . 3.880 2.313 1.989 2.697 . 0 0 "[ . 1 . 2]" 1
1221 1 73 LEU QD 1 78 LEU H . . 4.310 2.897 2.261 3.933 . 0 0 "[ . 1 . 2]" 1
1222 1 73 LEU QD 1 78 LEU HA . . 3.450 2.923 2.323 3.493 0.043 11 0 "[ . 1 . 2]" 1
1223 1 73 LEU HG 1 74 PRO HD2 . . 3.750 2.167 2.003 2.560 . 0 0 "[ . 1 . 2]" 1
1224 1 73 LEU HG 1 74 PRO HD3 . . 4.220 3.620 3.130 4.135 . 0 0 "[ . 1 . 2]" 1
1225 1 73 LEU HG 1 77 GLY H . . 4.390 3.934 3.262 4.467 0.077 7 0 "[ . 1 . 2]" 1
1226 1 73 LEU HG 1 77 GLY HA2 . . 4.290 4.133 3.728 4.379 0.089 7 0 "[ . 1 . 2]" 1
1227 1 73 LEU HG 1 77 GLY HA3 . . 3.980 2.476 2.034 2.855 . 0 0 "[ . 1 . 2]" 1
1228 1 74 PRO HA 1 75 PRO QD . . 3.990 2.278 2.194 2.358 . 0 0 "[ . 1 . 2]" 1
1229 1 74 PRO HB2 1 75 PRO QD . . 3.420 2.295 2.152 2.498 . 0 0 "[ . 1 . 2]" 1
1230 1 74 PRO HB2 1 77 GLY H . . 4.120 3.177 2.931 3.350 . 0 0 "[ . 1 . 2]" 1
1231 1 74 PRO HB3 1 75 PRO QD . . 3.300 2.922 2.730 3.066 . 0 0 "[ . 1 . 2]" 1
1232 1 74 PRO HB3 1 76 GLU H . . 4.640 4.250 3.959 4.658 0.018 19 0 "[ . 1 . 2]" 1
1233 1 74 PRO HB3 1 77 GLY H . . 4.430 4.498 4.384 4.516 0.086 8 0 "[ . 1 . 2]" 1
1234 1 74 PRO HD2 1 77 GLY H . . 4.950 3.705 3.173 4.541 . 0 0 "[ . 1 . 2]" 1
1235 1 74 PRO HG2 1 77 GLY H . . 3.640 2.210 1.935 2.697 . 0 0 "[ . 1 . 2]" 1
1236 1 74 PRO HG2 1 77 GLY HA2 . . 4.840 3.323 3.069 3.638 . 0 0 "[ . 1 . 2]" 1
1237 1 74 PRO HG2 1 77 GLY HA3 . . 4.360 2.572 2.277 2.891 . 0 0 "[ . 1 . 2]" 1
1238 1 75 PRO HA 1 77 GLY H . . 4.420 4.087 3.704 4.231 . 0 0 "[ . 1 . 2]" 1
1239 1 75 PRO HA 1 78 LEU HB3 . . 4.530 4.296 3.797 4.604 0.074 8 0 "[ . 1 . 2]" 1
1240 1 75 PRO HA 1 78 LEU MD2 . . 4.770 4.639 4.222 4.862 0.092 7 0 "[ . 1 . 2]" 1
1241 1 75 PRO HB2 1 76 GLU H . . 3.740 3.571 3.289 3.784 0.044 2 0 "[ . 1 . 2]" 1
1242 1 75 PRO HB3 1 76 GLU H . . 4.310 4.329 4.174 4.392 0.082 4 0 "[ . 1 . 2]" 1
1243 1 75 PRO QD 1 76 GLU H . . 4.360 2.977 2.737 3.136 . 0 0 "[ . 1 . 2]" 1
1244 1 75 PRO QD 1 76 GLU HG2 . . 5.500 4.071 3.183 5.279 . 0 0 "[ . 1 . 2]" 1
1245 1 75 PRO HG2 1 76 GLU HG2 . . 3.690 3.556 2.940 3.768 0.078 8 0 "[ . 1 . 2]" 1
1246 1 76 GLU H 1 76 GLU HB2 . . 3.640 3.317 2.476 3.702 0.062 4 0 "[ . 1 . 2]" 1
1247 1 76 GLU H 1 76 GLU HB3 . . 3.110 3.054 2.668 3.671 0.561 15 4 "[ . 1- +* *2]" 1
1248 1 76 GLU H 1 76 GLU HG2 . . 4.030 2.423 1.854 3.219 . 0 0 "[ . 1 . 2]" 1
1249 1 76 GLU H 1 76 GLU HG3 . . 3.800 2.564 1.854 3.137 . 0 0 "[ . 1 . 2]" 1
1250 1 76 GLU H 1 77 GLY H . . 3.450 2.354 2.198 2.469 . 0 0 "[ . 1 . 2]" 1
1251 1 76 GLU H 1 77 GLY HA2 . . 4.850 4.900 4.794 4.936 0.086 19 0 "[ . 1 . 2]" 1
1252 1 76 GLU HA 1 76 GLU HB2 . . 3.020 2.635 2.385 3.058 0.038 11 0 "[ . 1 . 2]" 1
1253 1 76 GLU HA 1 76 GLU HG3 . . 3.780 3.627 3.332 3.801 0.021 6 0 "[ . 1 . 2]" 1
1254 1 76 GLU HA 1 79 ASN HB2 . . 5.200 3.176 2.231 3.816 . 0 0 "[ . 1 . 2]" 1
1255 1 76 GLU HA 1 79 ASN QD . . 4.520 3.932 3.303 4.388 . 0 0 "[ . 1 . 2]" 1
1256 1 76 GLU HB2 1 76 GLU HG3 . . 2.960 2.536 2.344 2.990 0.030 8 0 "[ . 1 . 2]" 1
1257 1 76 GLU HB3 1 76 GLU HG3 . . 2.930 3.001 2.794 3.052 0.122 10 0 "[ . 1 . 2]" 1
1258 1 76 GLU HB3 1 77 GLY H . . 4.900 4.292 3.996 4.505 . 0 0 "[ . 1 . 2]" 1
1259 1 76 GLU HG2 1 77 GLY H . . 4.690 3.886 2.899 4.774 0.084 11 0 "[ . 1 . 2]" 1
1260 1 76 GLU HG3 1 77 GLY H . . 4.560 3.209 2.314 4.467 . 0 0 "[ . 1 . 2]" 1
1261 1 77 GLY H 1 78 LEU H . . 3.450 2.621 2.472 2.792 . 0 0 "[ . 1 . 2]" 1
1262 1 77 GLY H 1 79 ASN H . . 5.040 4.369 4.171 4.625 . 0 0 "[ . 1 . 2]" 1
1263 1 77 GLY HA2 1 80 ASP H . . 3.820 3.289 2.891 3.755 . 0 0 "[ . 1 . 2]" 1
1264 1 77 GLY HA2 1 80 ASP HB2 . . 3.880 3.034 2.176 3.744 . 0 0 "[ . 1 . 2]" 1
1265 1 77 GLY HA3 1 79 ASN H . . 5.420 4.925 4.681 5.068 . 0 0 "[ . 1 . 2]" 1
1266 1 77 GLY HA3 1 80 ASP H . . 4.910 4.523 4.288 4.878 . 0 0 "[ . 1 . 2]" 1
1267 1 77 GLY HA3 1 80 ASP HB2 . . 4.930 4.579 3.816 5.335 0.405 17 0 "[ . 1 . 2]" 1
1268 1 78 LEU H 1 78 LEU HB2 . . 3.480 2.653 2.573 2.763 . 0 0 "[ . 1 . 2]" 1
1269 1 78 LEU H 1 78 LEU HB3 . . 3.510 2.296 2.154 2.388 . 0 0 "[ . 1 . 2]" 1
1270 1 78 LEU H 1 78 LEU MD1 . . 4.400 4.255 4.184 4.300 . 0 0 "[ . 1 . 2]" 1
1271 1 78 LEU H 1 79 ASN H . . 4.260 2.697 2.481 2.821 . 0 0 "[ . 1 . 2]" 1
1272 1 78 LEU HA 1 78 LEU MD1 . . 2.990 2.315 2.212 2.450 . 0 0 "[ . 1 . 2]" 1
1273 1 78 LEU HA 1 78 LEU MD2 . . 3.880 3.932 3.886 3.968 0.088 12 0 "[ . 1 . 2]" 1
1274 1 78 LEU HA 1 78 LEU HG . . 3.430 3.356 3.257 3.446 0.016 18 0 "[ . 1 . 2]" 1
1275 1 78 LEU HA 1 81 LEU H . . 3.870 3.637 3.285 3.934 0.064 14 0 "[ . 1 . 2]" 1
1276 1 78 LEU HA 1 81 LEU HB2 . . 3.860 3.130 2.615 3.610 . 0 0 "[ . 1 . 2]" 1
1277 1 78 LEU HA 1 81 LEU QD . . 3.390 3.125 2.834 3.420 0.030 11 0 "[ . 1 . 2]" 1
1278 1 78 LEU HB2 1 78 LEU MD2 . . 3.130 2.385 2.284 2.529 . 0 0 "[ . 1 . 2]" 1
1279 1 78 LEU HB2 1 79 ASN H . . 4.030 3.825 3.709 3.968 . 0 0 "[ . 1 . 2]" 1
1280 1 78 LEU HB3 1 78 LEU MD2 . . 3.410 2.310 2.237 2.355 . 0 0 "[ . 1 . 2]" 1
1281 1 78 LEU HB3 1 78 LEU HG . . 2.830 2.464 2.385 2.542 . 0 0 "[ . 1 . 2]" 1
1282 1 78 LEU HB3 1 79 ASN H . . 3.460 2.404 2.227 2.622 . 0 0 "[ . 1 . 2]" 1
1283 1 78 LEU QD 1 79 ASN H . . 4.670 3.627 3.486 3.707 . 0 0 "[ . 1 . 2]" 1
1284 1 78 LEU MD1 1 79 ASN H . . 4.490 4.227 4.115 4.359 . 0 0 "[ . 1 . 2]" 1
1285 1 78 LEU MD1 1 102 VAL HA . . 3.660 3.300 2.490 3.763 0.103 12 0 "[ . 1 . 2]" 1
1286 1 78 LEU MD2 1 79 ASN H . . 4.200 3.953 3.746 4.083 . 0 0 "[ . 1 . 2]" 1
1287 1 78 LEU MD2 1 102 VAL H . . 4.820 3.615 2.822 4.457 . 0 0 "[ . 1 . 2]" 1
1288 1 78 LEU MD2 1 102 VAL HA . . 3.520 3.113 2.609 3.467 . 0 0 "[ . 1 . 2]" 1
1289 1 78 LEU HG 1 79 ASN H . . 3.180 3.219 3.038 3.255 0.075 3 0 "[ . 1 . 2]" 1
1290 1 78 LEU HG 1 79 ASN HA . . 4.470 3.321 3.024 3.605 . 0 0 "[ . 1 . 2]" 1
1291 1 79 ASN H 1 79 ASN HB2 . . 3.590 2.469 1.978 2.759 . 0 0 "[ . 1 . 2]" 1
1292 1 79 ASN H 1 79 ASN HB3 . . 3.500 3.496 3.176 3.574 0.074 18 0 "[ . 1 . 2]" 1
1293 1 79 ASN H 1 79 ASN QD . . 4.350 3.604 2.743 4.013 . 0 0 "[ . 1 . 2]" 1
1294 1 79 ASN HA 1 82 ILE H . . 3.870 3.474 3.121 3.760 . 0 0 "[ . 1 . 2]" 1
1295 1 79 ASN HA 1 82 ILE HB . . 3.540 2.504 1.980 3.202 . 0 0 "[ . 1 . 2]" 1
1296 1 79 ASN HA 1 82 ILE HG12 . . 4.230 3.920 2.799 4.309 0.079 19 0 "[ . 1 . 2]" 1
1297 1 79 ASN HA 1 82 ILE HG13 . . 5.020 3.658 2.732 5.055 0.035 19 0 "[ . 1 . 2]" 1
1298 1 79 ASN HA 1 99 LEU QD . . 4.180 3.707 2.395 4.231 0.051 11 0 "[ . 1 . 2]" 1
1299 1 79 ASN HB2 1 80 ASP H . . 3.770 3.149 2.663 3.591 . 0 0 "[ . 1 . 2]" 1
1300 1 79 ASN QD 1 98 HIS HA . . 4.570 4.395 4.254 4.529 . 0 0 "[ . 1 . 2]" 1
1301 1 79 ASN QD 1 98 HIS HB2 . . 4.450 2.342 1.819 3.194 . 0 0 "[ . 1 . 2]" 1
1302 1 79 ASN QD 1 98 HIS HB3 . . 4.410 2.554 1.763 3.668 . 0 0 "[ . 1 . 2]" 1
1303 1 79 ASN QD 1 99 LEU H . . 4.100 2.787 1.865 3.497 . 0 0 "[ . 1 . 2]" 1
1304 1 80 ASP H 1 80 ASP HB2 . . 2.980 2.442 1.960 2.993 0.013 19 0 "[ . 1 . 2]" 1
1305 1 80 ASP H 1 83 ARG H . . 5.410 4.616 4.361 4.831 . 0 0 "[ . 1 . 2]" 1
1306 1 80 ASP HA 1 83 ARG H . . 3.910 3.548 3.168 3.823 . 0 0 "[ . 1 . 2]" 1
1307 1 80 ASP HA 1 83 ARG HB3 . . 3.780 3.637 3.035 3.864 0.084 5 0 "[ . 1 . 2]" 1
1308 1 80 ASP HA 1 83 ARG HG2 . . 4.770 4.790 3.832 5.733 0.963 9 4 "[ * . +1 *- 2]" 1
1309 1 80 ASP HB2 1 81 LEU H . . 3.330 3.509 2.587 4.164 0.834 19 9 "[* *** * 1 -** +2]" 1
1310 1 80 ASP HB2 1 81 LEU QD . . 4.760 4.353 2.679 5.657 0.897 15 2 "[ . 1 +- 2]" 1
1311 1 81 LEU H 1 81 LEU HB2 . . 3.240 2.263 2.025 2.511 . 0 0 "[ . 1 . 2]" 1
1312 1 81 LEU H 1 81 LEU HB3 . . 3.530 3.505 3.187 3.614 0.084 14 0 "[ . 1 . 2]" 1
1313 1 81 LEU H 1 81 LEU QD . . 3.830 2.779 2.260 3.376 . 0 0 "[ . 1 . 2]" 1
1314 1 81 LEU H 1 82 ILE H . . 3.250 2.667 2.317 2.869 . 0 0 "[ . 1 . 2]" 1
1315 1 81 LEU H 1 82 ILE HG12 . . 4.780 4.438 4.017 4.795 0.015 14 0 "[ . 1 . 2]" 1
1316 1 81 LEU H 1 83 ARG H . . 4.670 3.999 3.540 4.305 . 0 0 "[ . 1 . 2]" 1
1317 1 81 LEU HA 1 81 LEU HB3 . . 2.910 2.676 2.484 2.905 . 0 0 "[ . 1 . 2]" 1
1318 1 81 LEU HA 1 81 LEU QD . . 2.850 2.134 1.998 2.384 . 0 0 "[ . 1 . 2]" 1
1319 1 81 LEU HA 1 81 LEU HG . . 4.260 2.983 2.370 3.754 . 0 0 "[ . 1 . 2]" 1
1320 1 81 LEU HB2 1 82 ILE H . . 3.560 2.574 2.308 3.024 . 0 0 "[ . 1 . 2]" 1
1321 1 81 LEU HB3 1 81 LEU QD . . 3.060 2.256 2.103 2.427 . 0 0 "[ . 1 . 2]" 1
1322 1 81 LEU HB3 1 82 ILE H . . 3.930 3.008 2.579 3.422 . 0 0 "[ . 1 . 2]" 1
1323 1 81 LEU QD 1 82 ILE H . . 4.780 3.919 3.782 4.147 . 0 0 "[ . 1 . 2]" 1
1324 1 81 LEU HG 1 82 ILE H . . 4.790 4.716 4.268 4.863 0.073 7 0 "[ . 1 . 2]" 1
1325 1 82 ILE H 1 82 ILE HB . . 2.970 2.425 2.179 2.646 . 0 0 "[ . 1 . 2]" 1
1326 1 82 ILE H 1 82 ILE MD . . 4.060 3.506 2.942 3.806 . 0 0 "[ . 1 . 2]" 1
1327 1 82 ILE H 1 82 ILE HG12 . . 3.310 2.168 2.016 2.363 . 0 0 "[ . 1 . 2]" 1
1328 1 82 ILE H 1 82 ILE HG13 . . 3.800 3.433 3.206 3.669 . 0 0 "[ . 1 . 2]" 1
1329 1 82 ILE H 1 82 ILE MG . . 4.010 3.769 3.686 3.825 . 0 0 "[ . 1 . 2]" 1
1330 1 82 ILE H 1 83 ARG H . . 3.350 2.877 2.750 3.051 . 0 0 "[ . 1 . 2]" 1
1331 1 82 ILE H 1 83 ARG HB2 . . 4.900 4.606 4.391 4.911 0.011 9 0 "[ . 1 . 2]" 1
1332 1 82 ILE HA 1 82 ILE MD . . 3.120 2.265 2.121 2.463 . 0 0 "[ . 1 . 2]" 1
1333 1 82 ILE HA 1 82 ILE HG12 . . 3.940 2.919 2.622 3.320 . 0 0 "[ . 1 . 2]" 1
1334 1 82 ILE HA 1 82 ILE MG . . 3.230 2.519 2.350 2.761 . 0 0 "[ . 1 . 2]" 1
1335 1 82 ILE HA 1 84 ALA H . . 4.950 3.983 3.758 4.411 . 0 0 "[ . 1 . 2]" 1
1336 1 82 ILE HA 1 85 HIS H . . 3.900 3.372 3.119 3.652 . 0 0 "[ . 1 . 2]" 1
1337 1 82 ILE HA 1 85 HIS QB . . 3.610 2.845 2.554 3.341 . 0 0 "[ . 1 . 2]" 1
1338 1 82 ILE HA 1 86 CYS H . . 4.220 4.035 3.804 4.273 0.053 10 0 "[ . 1 . 2]" 1
1339 1 82 ILE HB 1 83 ARG H . . 3.510 2.930 2.545 3.251 . 0 0 "[ . 1 . 2]" 1
1340 1 82 ILE HB 1 99 LEU QD . . 3.890 3.289 2.282 3.925 0.035 20 0 "[ . 1 . 2]" 1
1341 1 82 ILE MD 1 82 ILE MG . . 2.820 2.100 1.998 2.256 . 0 0 "[ . 1 . 2]" 1
1342 1 82 ILE MD 1 83 ARG H . . 5.000 4.964 4.749 5.084 0.084 4 0 "[ . 1 . 2]" 1
1343 1 82 ILE MD 1 85 HIS QB . . 5.120 3.444 2.760 4.061 . 0 0 "[ . 1 . 2]" 1
1344 1 82 ILE MD 1 108 PHE QD . . 4.550 3.875 2.851 4.542 . 0 0 "[ . 1 . 2]" 1
1345 1 82 ILE MD 1 108 PHE QE . . 5.500 4.722 3.622 5.452 . 0 0 "[ . 1 . 2]" 1
1346 1 82 ILE MD 1 109 LEU HG . . 3.830 3.775 3.253 3.940 0.110 6 0 "[ . 1 . 2]" 1
1347 1 82 ILE HG12 1 82 ILE MG . . 3.650 3.240 3.203 3.272 . 0 0 "[ . 1 . 2]" 1
1348 1 82 ILE HG13 1 82 ILE MG . . 3.490 2.441 2.208 2.622 . 0 0 "[ . 1 . 2]" 1
1349 1 82 ILE HG13 1 83 ARG H . . 5.500 5.153 4.869 5.534 0.034 19 0 "[ . 1 . 2]" 1
1350 1 82 ILE HG13 1 99 LEU QD . . 3.740 2.119 1.945 2.459 . 0 0 "[ . 1 . 2]" 1
1351 1 82 ILE MG 1 83 ARG H . . 4.240 3.540 3.040 3.878 . 0 0 "[ . 1 . 2]" 1
1352 1 82 ILE MG 1 83 ARG HA . . 3.930 3.736 3.344 4.018 0.088 19 0 "[ . 1 . 2]" 1
1353 1 82 ILE MG 1 85 HIS QB . . 4.390 3.294 2.756 3.932 . 0 0 "[ . 1 . 2]" 1
1354 1 82 ILE MG 1 86 CYS H . . 3.950 3.566 3.312 4.009 0.059 20 0 "[ . 1 . 2]" 1
1355 1 82 ILE MG 1 86 CYS HB2 . . 4.970 3.752 3.274 4.359 . 0 0 "[ . 1 . 2]" 1
1356 1 82 ILE MG 1 86 CYS HB3 . . 5.130 4.468 4.118 4.848 . 0 0 "[ . 1 . 2]" 1
1357 1 82 ILE MG 1 108 PHE QD . . 3.890 3.572 2.704 4.011 0.121 10 0 "[ . 1 . 2]" 1
1358 1 82 ILE MG 1 108 PHE QE . . 3.760 3.351 2.721 3.896 0.136 12 0 "[ . 1 . 2]" 1
1359 1 83 ARG H 1 83 ARG HB2 . . 2.930 2.050 1.891 2.192 . 0 0 "[ . 1 . 2]" 1
1360 1 83 ARG H 1 83 ARG HB3 . . 3.430 3.178 2.867 3.458 0.028 12 0 "[ . 1 . 2]" 1
1361 1 83 ARG H 1 83 ARG HG2 . . 3.780 3.814 2.983 4.166 0.386 7 0 "[ . 1 . 2]" 1
1362 1 83 ARG H 1 83 ARG HG3 . . 4.070 3.749 3.287 4.146 0.076 13 0 "[ . 1 . 2]" 1
1363 1 83 ARG H 1 84 ALA H . . 3.240 2.990 2.792 3.094 . 0 0 "[ . 1 . 2]" 1
1364 1 83 ARG HA 1 83 ARG QD . . 4.410 3.413 2.335 4.073 . 0 0 "[ . 1 . 2]" 1
1365 1 83 ARG HA 1 83 ARG HG2 . . 3.970 2.234 2.130 2.487 . 0 0 "[ . 1 . 2]" 1
1366 1 83 ARG HA 1 83 ARG HG3 . . 3.430 3.135 2.464 3.560 0.130 3 0 "[ . 1 . 2]" 1
1367 1 83 ARG HB2 1 83 ARG QD . . 3.790 3.051 2.496 3.418 . 0 0 "[ . 1 . 2]" 1
1368 1 83 ARG HB3 1 83 ARG QD . . 2.950 2.314 2.140 2.595 . 0 0 "[ . 1 . 2]" 1
1369 1 83 ARG HB3 1 84 ALA H . . 3.250 2.955 2.569 3.309 0.059 1 0 "[ . 1 . 2]" 1
1370 1 83 ARG QD 1 84 ALA H . . 5.500 4.751 3.834 5.288 . 0 0 "[ . 1 . 2]" 1
1371 1 84 ALA H 1 84 ALA MB . . 2.730 2.227 2.170 2.331 . 0 0 "[ . 1 . 2]" 1
1372 1 84 ALA H 1 85 HIS QB . . 4.940 4.374 3.991 4.516 . 0 0 "[ . 1 . 2]" 1
1373 1 84 ALA HA 1 86 CYS H . . 4.450 4.523 4.499 4.533 0.083 7 0 "[ . 1 . 2]" 1
1374 1 84 ALA HA 1 87 ALA H . . 3.640 3.487 3.162 3.702 0.062 15 0 "[ . 1 . 2]" 1
1375 1 84 ALA MB 1 85 HIS H . . 3.660 2.426 2.164 2.770 . 0 0 "[ . 1 . 2]" 1
1376 1 84 ALA MB 1 85 HIS HA . . 4.080 3.943 3.807 4.096 0.016 17 0 "[ . 1 . 2]" 1
1377 1 84 ALA MB 1 85 HIS QB . . 5.070 3.755 3.515 4.064 . 0 0 "[ . 1 . 2]" 1
1378 1 85 HIS H 1 85 HIS QB . . 3.100 2.171 2.099 2.244 . 0 0 "[ . 1 . 2]" 1
1379 1 85 HIS H 1 85 HIS HD2 . . 5.010 4.794 4.513 5.071 0.061 16 0 "[ . 1 . 2]" 1
1380 1 85 HIS H 1 86 CYS H . . 3.230 2.795 2.617 2.960 . 0 0 "[ . 1 . 2]" 1
1381 1 85 HIS H 1 87 ALA H . . 5.030 4.232 4.028 4.560 . 0 0 "[ . 1 . 2]" 1
1382 1 85 HIS HA 1 88 THR H . . 4.170 3.660 3.481 3.925 . 0 0 "[ . 1 . 2]" 1
1383 1 85 HIS HA 1 88 THR MG . . 4.080 2.162 1.938 2.361 . 0 0 "[ . 1 . 2]" 1
1384 1 85 HIS QB 1 86 CYS H . . 3.220 2.597 2.397 2.796 . 0 0 "[ . 1 . 2]" 1
1385 1 85 HIS QB 1 109 LEU QD . . 5.500 3.184 2.709 3.564 . 0 0 "[ . 1 . 2]" 1
1386 1 85 HIS HD2 1 86 CYS H . . 4.210 3.366 2.850 4.252 0.042 16 0 "[ . 1 . 2]" 1
1387 1 85 HIS HD2 1 86 CYS HA . . 3.940 3.069 2.576 3.763 . 0 0 "[ . 1 . 2]" 1
1388 1 85 HIS HD2 1 89 LEU HG . . 5.500 4.598 2.798 5.566 0.066 20 0 "[ . 1 . 2]" 1
1389 1 85 HIS HD2 1 109 LEU QD . . 3.940 3.273 2.630 3.789 . 0 0 "[ . 1 . 2]" 1
1390 1 85 HIS HD2 1 112 LEU QD . . 3.520 3.246 2.399 3.599 0.079 20 0 "[ . 1 . 2]" 1
1391 1 85 HIS HE1 1 109 LEU QD . . 4.260 2.841 2.324 3.432 . 0 0 "[ . 1 . 2]" 1
1392 1 86 CYS H 1 86 CYS HB2 . . 3.000 2.429 2.268 2.788 . 0 0 "[ . 1 . 2]" 1
1393 1 86 CYS H 1 87 ALA H . . 3.300 2.716 2.600 2.806 . 0 0 "[ . 1 . 2]" 1
1394 1 86 CYS H 1 87 ALA MB . . 4.590 4.381 4.242 4.489 . 0 0 "[ . 1 . 2]" 1
1395 1 86 CYS H 1 88 THR H . . 4.840 4.217 4.081 4.344 . 0 0 "[ . 1 . 2]" 1
1396 1 86 CYS H 1 91 HIS H . . 5.500 5.504 5.163 5.584 0.084 11 0 "[ . 1 . 2]" 1
1397 1 86 CYS H 1 109 LEU QD . . 5.500 4.990 4.498 5.396 . 0 0 "[ . 1 . 2]" 1
1398 1 86 CYS HA 1 89 LEU H . . 3.610 3.609 3.317 3.691 0.081 16 0 "[ . 1 . 2]" 1
1399 1 86 CYS HA 1 89 LEU QB . . 3.620 3.110 2.868 3.443 . 0 0 "[ . 1 . 2]" 1
1400 1 86 CYS HA 1 89 LEU QD . . 3.970 3.615 2.928 3.964 . 0 0 "[ . 1 . 2]" 1
1401 1 86 CYS HA 1 89 LEU HG . . 4.390 4.381 4.056 4.470 0.080 8 0 "[ . 1 . 2]" 1
1402 1 86 CYS HA 1 91 HIS H . . 3.840 2.935 2.452 3.232 . 0 0 "[ . 1 . 2]" 1
1403 1 86 CYS HA 1 91 HIS HB2 . . 4.090 2.610 2.184 4.569 0.479 16 0 "[ . 1 . 2]" 1
1404 1 86 CYS HA 1 91 HIS HB3 . . 4.510 4.000 3.511 4.470 . 0 0 "[ . 1 . 2]" 1
1405 1 86 CYS HA 1 91 HIS HD2 . . 4.330 3.759 2.404 4.423 0.093 8 0 "[ . 1 . 2]" 1
1406 1 86 CYS HB2 1 87 ALA H . . 3.310 2.734 2.458 3.087 . 0 0 "[ . 1 . 2]" 1
1407 1 86 CYS HB2 1 87 ALA HA . . 4.530 4.399 3.873 4.605 0.075 5 0 "[ . 1 . 2]" 1
1408 1 86 CYS HB2 1 87 ALA MB . . 5.160 3.990 3.661 4.241 . 0 0 "[ . 1 . 2]" 1
1409 1 86 CYS HB2 1 88 THR H . . 5.070 5.108 4.829 5.155 0.085 7 0 "[ . 1 . 2]" 1
1410 1 86 CYS HB3 1 87 ALA H . . 3.870 3.698 3.354 3.945 0.075 5 0 "[ . 1 . 2]" 1
1411 1 86 CYS HB3 1 87 ALA HA . . 4.700 4.372 4.087 4.665 . 0 0 "[ . 1 . 2]" 1
1412 1 86 CYS HB3 1 91 HIS HB2 . . 4.650 2.934 2.183 4.667 0.017 16 0 "[ . 1 . 2]" 1
1413 1 87 ALA H 1 87 ALA MB . . 2.890 2.221 2.173 2.280 . 0 0 "[ . 1 . 2]" 1
1414 1 87 ALA H 1 88 THR H . . 3.210 2.694 2.430 3.071 . 0 0 "[ . 1 . 2]" 1
1415 1 87 ALA H 1 89 LEU H . . 4.730 4.167 3.862 4.365 . 0 0 "[ . 1 . 2]" 1
1416 1 87 ALA HA 1 88 THR MG . . 5.280 5.311 5.069 5.385 0.105 7 0 "[ . 1 . 2]" 1
1417 1 87 ALA HA 1 89 LEU H . . 4.370 4.128 3.600 4.438 0.068 6 0 "[ . 1 . 2]" 1
1418 1 87 ALA HA 1 91 HIS H . . 4.250 4.191 3.694 4.333 0.083 16 0 "[ . 1 . 2]" 1
1419 1 87 ALA MB 1 88 THR H . . 3.420 2.851 2.570 3.227 . 0 0 "[ . 1 . 2]" 1
1420 1 87 ALA MB 1 88 THR HA . . 4.600 3.922 3.690 4.191 . 0 0 "[ . 1 . 2]" 1
1421 1 88 THR H 1 88 THR HB . . 2.870 2.598 2.304 2.941 0.071 4 0 "[ . 1 . 2]" 1
1422 1 88 THR H 1 88 THR MG . . 3.350 2.263 1.932 2.432 . 0 0 "[ . 1 . 2]" 1
1423 1 88 THR H 1 89 LEU H . . 3.190 2.517 2.042 2.786 . 0 0 "[ . 1 . 2]" 1
1424 1 88 THR H 1 89 LEU QD . . 5.160 4.490 2.801 4.798 . 0 0 "[ . 1 . 2]" 1
1425 1 88 THR H 1 89 LEU HG . . 4.680 4.215 3.775 4.777 0.097 4 0 "[ . 1 . 2]" 1
1426 1 88 THR HA 1 88 THR HB . . 2.820 2.461 2.294 2.562 . 0 0 "[ . 1 . 2]" 1
1427 1 88 THR HA 1 88 THR MG . . 3.520 3.266 3.235 3.312 . 0 0 "[ . 1 . 2]" 1
1428 1 88 THR HA 1 89 LEU QD . . 5.500 4.710 3.834 5.211 . 0 0 "[ . 1 . 2]" 1
1429 1 88 THR HB 1 89 LEU H . . 4.460 4.208 4.019 4.514 0.054 20 0 "[ . 1 . 2]" 1
1430 1 88 THR MG 1 89 LEU H . . 3.880 2.814 2.494 3.390 . 0 0 "[ . 1 . 2]" 1
1431 1 88 THR MG 1 89 LEU QD . . 3.900 2.618 1.889 3.001 . 0 0 "[ . 1 . 2]" 1
1432 1 89 LEU H 1 89 LEU QB . . 2.850 2.451 2.141 2.568 . 0 0 "[ . 1 . 2]" 1
1433 1 89 LEU H 1 89 LEU QD . . 3.960 3.234 2.302 3.601 . 0 0 "[ . 1 . 2]" 1
1434 1 89 LEU H 1 89 LEU HG . . 3.520 2.661 2.312 3.586 0.066 4 0 "[ . 1 . 2]" 1
1435 1 89 LEU H 1 90 GLY H . . 2.860 2.346 1.832 2.818 . 0 0 "[ . 1 . 2]" 1
1436 1 89 LEU H 1 90 GLY HA2 . . 5.010 4.516 4.111 4.800 . 0 0 "[ . 1 . 2]" 1
1437 1 89 LEU H 1 91 HIS H . . 4.240 3.922 3.395 4.311 0.071 15 0 "[ . 1 . 2]" 1
1438 1 89 LEU HA 1 89 LEU QB . . 2.800 2.365 2.317 2.424 . 0 0 "[ . 1 . 2]" 1
1439 1 89 LEU HA 1 89 LEU QD . . 2.820 2.144 2.054 2.245 . 0 0 "[ . 1 . 2]" 1
1440 1 89 LEU HA 1 89 LEU HG . . 3.780 3.180 3.001 3.821 0.041 4 0 "[ . 1 . 2]" 1
1441 1 89 LEU HA 1 90 GLY HA3 . . 4.810 4.629 4.450 4.736 . 0 0 "[ . 1 . 2]" 1
1442 1 89 LEU QB 1 89 LEU QD . . 2.760 1.982 1.931 2.061 . 0 0 "[ . 1 . 2]" 1
1443 1 89 LEU QB 1 90 GLY H . . 3.730 2.639 2.104 3.452 . 0 0 "[ . 1 . 2]" 1
1444 1 89 LEU QB 1 90 GLY HA2 . . 4.970 4.610 4.362 4.982 0.012 5 0 "[ . 1 . 2]" 1
1445 1 89 LEU QB 1 91 HIS H . . 3.850 3.244 2.632 3.906 0.056 10 0 "[ . 1 . 2]" 1
1446 1 89 LEU QB 1 91 HIS HB2 . . 4.280 3.774 3.095 4.878 0.598 16 1 "[ . 1 .+ 2]" 1
1447 1 89 LEU QB 1 91 HIS HB3 . . 4.970 4.838 3.479 5.055 0.085 10 0 "[ . 1 . 2]" 1
1448 1 89 LEU QB 1 91 HIS HD2 . . 4.030 2.826 2.062 4.118 0.088 15 0 "[ . 1 . 2]" 1
1449 1 89 LEU QD 1 90 GLY H . . 5.140 4.105 3.845 4.433 . 0 0 "[ . 1 . 2]" 1
1450 1 89 LEU QD 1 91 HIS H . . 5.300 4.654 4.220 5.131 . 0 0 "[ . 1 . 2]" 1
1451 1 89 LEU QD 1 91 HIS HB2 . . 5.050 4.427 3.532 5.152 0.102 16 0 "[ . 1 . 2]" 1
1452 1 90 GLY H 1 90 GLY HA2 . . 2.950 2.457 2.267 2.666 . 0 0 "[ . 1 . 2]" 1
1453 1 90 GLY H 1 91 HIS H . . 3.120 2.206 1.733 3.000 . 0 0 "[ . 1 . 2]" 1
1454 1 90 GLY H 1 91 HIS HB2 . . 5.240 4.256 3.233 5.170 . 0 0 "[ . 1 . 2]" 1
1455 1 91 HIS H 1 91 HIS HB2 . . 3.380 2.549 2.283 3.728 0.348 16 0 "[ . 1 . 2]" 1
1456 1 91 HIS H 1 91 HIS HB3 . . 3.660 3.565 2.780 3.723 0.063 6 0 "[ . 1 . 2]" 1
1457 1 91 HIS H 1 91 HIS HD2 . . 4.930 3.746 2.816 4.729 . 0 0 "[ . 1 . 2]" 1
1458 1 91 HIS HB2 1 112 LEU QD . . 4.760 3.369 2.936 3.800 . 0 0 "[ . 1 . 2]" 1
1459 1 91 HIS HB3 1 112 LEU QD . . 4.710 3.124 2.184 4.315 . 0 0 "[ . 1 . 2]" 1
1460 1 91 HIS HD2 1 112 LEU QD . . 3.620 2.634 1.983 3.550 . 0 0 "[ . 1 . 2]" 1
1461 1 92 CYS HA 1 93 CYS H . . 3.340 2.694 2.141 3.438 0.098 10 0 "[ . 1 . 2]" 1
1462 1 93 CYS H 1 93 CYS HB2 . . 4.080 3.464 2.323 4.067 . 0 0 "[ . 1 . 2]" 1
1463 1 93 CYS HA 1 94 THR H . . 3.270 2.464 2.030 3.241 . 0 0 "[ . 1 . 2]" 1
1464 1 93 CYS HA 1 94 THR MG . . 3.180 3.239 2.976 3.297 0.117 14 0 "[ . 1 . 2]" 1
1465 1 93 CYS HA 1 98 HIS HA . . 3.340 3.233 2.599 3.455 0.115 18 0 "[ . 1 . 2]" 1
1466 1 93 CYS HA 1 98 HIS HD2 . . 3.750 3.286 2.152 3.843 0.093 18 0 "[ . 1 . 2]" 1
1467 1 93 CYS HA 1 108 PHE QE . . 5.200 4.500 3.741 5.092 . 0 0 "[ . 1 . 2]" 1
1468 1 93 CYS HA 1 108 PHE HZ . . 4.520 4.284 3.343 4.597 0.077 15 0 "[ . 1 . 2]" 1
1469 1 94 THR HA 1 94 THR HB . . 2.630 2.370 2.250 2.509 . 0 0 "[ . 1 . 2]" 1
1470 1 94 THR HA 1 94 THR MG . . 3.350 3.026 2.368 3.310 . 0 0 "[ . 1 . 2]" 1
1471 1 95 SER HA 1 95 SER QB . . 2.730 2.388 2.138 2.558 . 0 0 "[ . 1 . 2]" 1
1472 1 95 SER HA 1 96 LYS QB . . 4.970 4.472 3.867 4.860 . 0 0 "[ . 1 . 2]" 1
1473 1 95 SER QB 1 96 LYS H . . 4.260 2.879 1.797 3.931 . 0 0 "[ . 1 . 2]" 1
1474 1 96 LYS H 1 97 MET H . . 4.550 3.801 2.713 4.620 0.070 4 0 "[ . 1 . 2]" 1
1475 1 96 LYS HA 1 96 LYS QD . . 4.250 3.734 2.043 4.318 0.068 13 0 "[ . 1 . 2]" 1
1476 1 96 LYS HA 1 96 LYS QG . . 3.470 2.707 2.082 3.344 . 0 0 "[ . 1 . 2]" 1
1477 1 96 LYS HA 1 97 MET H . . 2.980 2.629 2.060 3.041 0.061 11 0 "[ . 1 . 2]" 1
1478 1 96 LYS QE 1 100 HIS HA . . 3.480 3.294 2.561 3.576 0.096 15 0 "[ . 1 . 2]" 1
1479 1 96 LYS QE 1 100 HIS QB . . 3.590 2.067 1.761 2.782 . 0 0 "[ . 1 . 2]" 1
1480 1 96 LYS QG 1 100 HIS HA . . 3.670 3.440 2.560 3.687 0.017 8 0 "[ . 1 . 2]" 1
1481 1 96 LYS QG 1 100 HIS QB . . 4.200 3.059 2.117 3.776 . 0 0 "[ . 1 . 2]" 1
1482 1 97 MET H 1 97 MET HB2 . . 3.620 2.932 2.260 3.707 0.087 2 0 "[ . 1 . 2]" 1
1483 1 97 MET H 1 97 MET HB3 . . 3.580 3.274 2.262 3.700 0.120 5 0 "[ . 1 . 2]" 1
1484 1 97 MET H 1 97 MET QG . . 4.920 3.636 2.011 4.524 . 0 0 "[ . 1 . 2]" 1
1485 1 97 MET H 1 98 HIS H . . 4.980 3.452 2.647 4.643 . 0 0 "[ . 1 . 2]" 1
1486 1 97 MET HA 1 97 MET HB2 . . 3.020 2.583 2.294 3.067 0.047 15 0 "[ . 1 . 2]" 1
1487 1 97 MET HA 1 97 MET QG . . 3.670 2.708 2.130 3.407 . 0 0 "[ . 1 . 2]" 1
1488 1 97 MET HA 1 98 HIS H . . 3.160 2.599 2.202 3.250 0.090 6 0 "[ . 1 . 2]" 1
1489 1 97 MET HA 1 99 LEU H . . 5.270 4.847 4.383 5.357 0.087 12 0 "[ . 1 . 2]" 1
1490 1 97 MET HB2 1 98 HIS H . . 4.540 4.303 2.250 4.684 0.144 3 0 "[ . 1 . 2]" 1
1491 1 97 MET ME 1 99 LEU H . . 3.720 3.651 3.150 3.826 0.106 7 0 "[ . 1 . 2]" 1
1492 1 98 HIS HA 1 98 HIS HD2 . . 4.030 3.067 2.249 4.138 0.108 5 0 "[ . 1 . 2]" 1
1493 1 98 HIS HA 1 99 LEU QD . . 4.540 4.132 3.433 4.403 . 0 0 "[ . 1 . 2]" 1
1494 1 98 HIS HB2 1 99 LEU H . . 4.390 3.084 2.013 3.676 . 0 0 "[ . 1 . 2]" 1
1495 1 98 HIS HB3 1 98 HIS HD2 . . 3.940 2.958 2.415 3.870 . 0 0 "[ . 1 . 2]" 1
1496 1 98 HIS HB3 1 99 LEU H . . 4.250 2.528 2.109 2.904 . 0 0 "[ . 1 . 2]" 1
1497 1 98 HIS HD2 1 99 LEU HG . . 3.450 3.398 2.523 3.547 0.097 12 0 "[ . 1 . 2]" 1
1498 1 99 LEU H 1 99 LEU HB2 . . 3.150 2.681 2.466 2.834 . 0 0 "[ . 1 . 2]" 1
1499 1 99 LEU H 1 99 LEU HB3 . . 3.970 3.788 3.459 3.885 . 0 0 "[ . 1 . 2]" 1
1500 1 99 LEU H 1 99 LEU QD . . 4.080 3.540 1.693 3.717 . 0 0 "[ . 1 . 2]" 1
1501 1 99 LEU H 1 99 LEU HG . . 3.320 3.286 2.962 3.432 0.112 12 0 "[ . 1 . 2]" 1
1502 1 99 LEU H 1 100 HIS H . . 5.130 4.261 3.876 4.418 . 0 0 "[ . 1 . 2]" 1
1503 1 99 LEU HA 1 99 LEU QD . . 3.080 2.188 2.111 2.400 . 0 0 "[ . 1 . 2]" 1
1504 1 99 LEU HA 1 99 LEU HG . . 4.120 3.116 2.970 3.684 . 0 0 "[ . 1 . 2]" 1
1505 1 99 LEU HA 1 100 HIS H . . 3.370 2.202 2.088 2.362 . 0 0 "[ . 1 . 2]" 1
1506 1 99 LEU HA 1 100 HIS QB . . 4.850 4.028 3.655 4.570 . 0 0 "[ . 1 . 2]" 1
1507 1 99 LEU HA 1 101 SER H . . 3.920 3.919 3.522 4.010 0.090 15 0 "[ . 1 . 2]" 1
1508 1 99 LEU HB2 1 99 LEU QD . . 3.180 2.214 2.165 2.268 . 0 0 "[ . 1 . 2]" 1
1509 1 99 LEU HB2 1 100 HIS H . . 4.980 4.031 3.475 4.456 . 0 0 "[ . 1 . 2]" 1
1510 1 99 LEU HB2 1 101 SER H . . 4.660 4.099 3.625 4.466 . 0 0 "[ . 1 . 2]" 1
1511 1 99 LEU HB3 1 100 HIS H . . 4.750 3.045 2.231 3.829 . 0 0 "[ . 1 . 2]" 1
1512 1 99 LEU HB3 1 101 SER H . . 4.310 2.904 2.346 3.428 . 0 0 "[ . 1 . 2]" 1
1513 1 99 LEU HB3 1 104 ASP HB2 . . 4.610 3.697 2.633 4.697 0.087 7 0 "[ . 1 . 2]" 1
1514 1 99 LEU HB3 1 104 ASP HB3 . . 4.720 3.405 2.169 4.753 0.033 7 0 "[ . 1 . 2]" 1
1515 1 99 LEU HB3 1 105 ALA H . . 5.080 3.733 2.577 4.513 . 0 0 "[ . 1 . 2]" 1
1516 1 99 LEU QD 1 100 HIS H . . 5.110 3.487 3.150 4.073 . 0 0 "[ . 1 . 2]" 1
1517 1 99 LEU QD 1 101 SER H . . 5.010 3.901 3.388 4.423 . 0 0 "[ . 1 . 2]" 1
1518 1 99 LEU QD 1 104 ASP HB2 . . 5.120 3.667 2.901 4.832 . 0 0 "[ . 1 . 2]" 1
1519 1 99 LEU QD 1 104 ASP HB3 . . 3.530 2.795 2.292 3.586 0.056 7 0 "[ . 1 . 2]" 1
1520 1 99 LEU QD 1 105 ALA H . . 3.880 3.080 2.731 3.478 . 0 0 "[ . 1 . 2]" 1
1521 1 99 LEU QD 1 105 ALA HA . . 3.180 2.044 1.931 2.287 . 0 0 "[ . 1 . 2]" 1
1522 1 99 LEU QD 1 108 PHE H . . 4.380 3.981 3.563 4.363 . 0 0 "[ . 1 . 2]" 1
1523 1 99 LEU QD 1 108 PHE HB2 . . 4.020 2.678 2.236 3.188 . 0 0 "[ . 1 . 2]" 1
1524 1 99 LEU QD 1 108 PHE HB3 . . 4.320 2.716 2.393 3.113 . 0 0 "[ . 1 . 2]" 1
1525 1 99 LEU QD 1 108 PHE QD . . 4.230 2.551 2.131 3.216 . 0 0 "[ . 1 . 2]" 1
1526 1 100 HIS H 1 100 HIS HD2 . . 5.500 4.840 2.995 5.523 0.023 19 0 "[ . 1 . 2]" 1
1527 1 100 HIS H 1 101 SER H . . 3.200 2.471 1.753 3.041 . 0 0 "[ . 1 . 2]" 1
1528 1 100 HIS HA 1 100 HIS HD2 . . 3.320 2.807 2.337 3.366 0.046 19 0 "[ . 1 . 2]" 1
1529 1 100 HIS HA 1 101 SER H . . 3.450 3.517 3.430 3.535 0.085 13 0 "[ . 1 . 2]" 1
1530 1 100 HIS HA 1 104 ASP HB2 . . 5.140 5.096 4.893 5.233 0.093 7 0 "[ . 1 . 2]" 1
1531 1 100 HIS QB 1 101 SER H . . 4.280 2.796 2.414 3.206 . 0 0 "[ . 1 . 2]" 1
1532 1 100 HIS QB 1 101 SER QB . . 4.830 3.665 3.235 4.267 . 0 0 "[ . 1 . 2]" 1
1533 1 101 SER H 1 102 VAL H . . 4.970 4.413 4.282 4.535 . 0 0 "[ . 1 . 2]" 1
1534 1 101 SER H 1 104 ASP H . . 4.280 3.510 3.023 3.896 . 0 0 "[ . 1 . 2]" 1
1535 1 101 SER H 1 104 ASP HB2 . . 4.050 2.365 2.050 2.870 . 0 0 "[ . 1 . 2]" 1
1536 1 101 SER H 1 104 ASP HB3 . . 4.050 3.207 2.338 3.970 . 0 0 "[ . 1 . 2]" 1
1537 1 101 SER H 1 105 ALA H . . 4.010 3.915 3.651 4.076 0.066 14 0 "[ . 1 . 2]" 1
1538 1 101 SER HA 1 102 VAL H . . 2.920 2.612 2.415 2.748 . 0 0 "[ . 1 . 2]" 1
1539 1 101 SER HA 1 102 VAL MG2 . . 3.850 3.783 3.628 3.930 0.080 20 0 "[ . 1 . 2]" 1
1540 1 101 SER HA 1 103 MET H . . 5.000 4.574 4.180 4.835 . 0 0 "[ . 1 . 2]" 1
1541 1 101 SER QB 1 102 VAL H . . 3.450 2.503 2.031 3.270 . 0 0 "[ . 1 . 2]" 1
1542 1 101 SER QB 1 102 VAL MG2 . . 5.500 4.044 3.418 4.876 . 0 0 "[ . 1 . 2]" 1
1543 1 101 SER QB 1 103 MET H . . 4.210 2.855 2.392 3.480 . 0 0 "[ . 1 . 2]" 1
1544 1 101 SER QB 1 104 ASP H . . 4.860 3.116 2.423 4.348 . 0 0 "[ . 1 . 2]" 1
1545 1 102 VAL H 1 102 VAL HB . . 3.110 2.468 2.296 2.669 . 0 0 "[ . 1 . 2]" 1
1546 1 102 VAL H 1 102 VAL MG2 . . 3.120 2.104 1.915 2.349 . 0 0 "[ . 1 . 2]" 1
1547 1 102 VAL H 1 103 MET H . . 3.350 2.707 2.582 2.941 . 0 0 "[ . 1 . 2]" 1
1548 1 102 VAL H 1 103 MET HB3 . . 5.030 4.983 4.616 5.227 0.197 19 0 "[ . 1 . 2]" 1
1549 1 102 VAL H 1 104 ASP H . . 5.130 4.285 4.013 4.520 . 0 0 "[ . 1 . 2]" 1
1550 1 102 VAL H 1 105 ALA MB . . 5.290 4.644 4.419 4.874 . 0 0 "[ . 1 . 2]" 1
1551 1 102 VAL HA 1 102 VAL MG1 . . 3.160 2.466 2.350 2.610 . 0 0 "[ . 1 . 2]" 1
1552 1 102 VAL HA 1 102 VAL MG2 . . 2.990 2.384 2.259 2.522 . 0 0 "[ . 1 . 2]" 1
1553 1 102 VAL HA 1 103 MET HA . . 4.900 4.869 4.752 4.952 0.052 12 0 "[ . 1 . 2]" 1
1554 1 102 VAL HA 1 104 ASP H . . 4.670 4.379 3.847 4.675 0.005 10 0 "[ . 1 . 2]" 1
1555 1 102 VAL HA 1 105 ALA H . . 3.600 3.292 3.101 3.447 . 0 0 "[ . 1 . 2]" 1
1556 1 102 VAL HA 1 105 ALA MB . . 3.170 2.456 2.307 2.658 . 0 0 "[ . 1 . 2]" 1
1557 1 102 VAL HB 1 103 MET H . . 3.450 2.693 2.560 2.778 . 0 0 "[ . 1 . 2]" 1
1558 1 102 VAL MG1 1 103 MET H . . 4.120 3.534 3.229 3.749 . 0 0 "[ . 1 . 2]" 1
1559 1 102 VAL MG1 1 103 MET HA . . 4.360 3.652 3.321 4.034 . 0 0 "[ . 1 . 2]" 1
1560 1 102 VAL MG1 1 104 ASP H . . 5.100 5.123 4.792 5.201 0.101 7 0 "[ . 1 . 2]" 1
1561 1 102 VAL MG1 1 105 ALA H . . 5.270 4.557 4.373 4.818 . 0 0 "[ . 1 . 2]" 1
1562 1 102 VAL MG1 1 106 ILE H . . 4.320 3.947 3.686 4.398 0.078 3 0 "[ . 1 . 2]" 1
1563 1 102 VAL MG1 1 106 ILE MD . . 3.310 3.044 2.721 3.420 0.110 3 0 "[ . 1 . 2]" 1
1564 1 102 VAL MG1 1 106 ILE HG12 . . 4.020 2.761 2.397 3.334 . 0 0 "[ . 1 . 2]" 1
1565 1 102 VAL MG2 1 105 ALA H . . 5.180 5.122 4.973 5.255 0.075 12 0 "[ . 1 . 2]" 1
1566 1 103 MET H 1 103 MET HB2 . . 3.070 2.357 2.106 2.710 . 0 0 "[ . 1 . 2]" 1
1567 1 103 MET H 1 103 MET HB3 . . 3.250 2.641 2.389 3.085 . 0 0 "[ . 1 . 2]" 1
1568 1 103 MET H 1 103 MET ME . . 4.900 4.283 3.359 4.991 0.091 19 0 "[ . 1 . 2]" 1
1569 1 103 MET H 1 103 MET HG2 . . 4.720 4.547 4.385 4.683 . 0 0 "[ . 1 . 2]" 1
1570 1 103 MET H 1 103 MET HG3 . . 4.480 4.451 4.333 4.516 0.036 15 0 "[ . 1 . 2]" 1
1571 1 103 MET H 1 104 ASP H . . 3.330 2.819 2.586 3.060 . 0 0 "[ . 1 . 2]" 1
1572 1 103 MET H 1 105 ALA H . . 4.790 4.156 3.962 4.346 . 0 0 "[ . 1 . 2]" 1
1573 1 103 MET H 1 105 ALA MB . . 4.680 4.737 4.624 4.783 0.103 19 0 "[ . 1 . 2]" 1
1574 1 103 MET HA 1 103 MET ME . . 4.160 2.639 2.075 3.553 . 0 0 "[ . 1 . 2]" 1
1575 1 103 MET HA 1 103 MET HG2 . . 4.070 3.679 3.347 3.854 . 0 0 "[ . 1 . 2]" 1
1576 1 103 MET HA 1 103 MET HG3 . . 3.910 2.678 2.346 3.174 . 0 0 "[ . 1 . 2]" 1
1577 1 103 MET HA 1 105 ALA H . . 5.010 4.377 4.040 4.607 . 0 0 "[ . 1 . 2]" 1
1578 1 103 MET HA 1 106 ILE H . . 3.710 3.578 3.165 3.778 0.068 11 0 "[ . 1 . 2]" 1
1579 1 103 MET HA 1 106 ILE HB . . 3.420 3.199 2.719 3.481 0.061 9 0 "[ . 1 . 2]" 1
1580 1 103 MET HA 1 106 ILE HG12 . . 4.590 3.543 2.727 4.280 . 0 0 "[ . 1 . 2]" 1
1581 1 103 MET HA 1 107 ASP H . . 4.910 4.501 4.038 4.970 0.060 5 0 "[ . 1 . 2]" 1
1582 1 103 MET HB2 1 104 ASP H . . 3.830 3.771 3.352 3.901 0.071 18 0 "[ . 1 . 2]" 1
1583 1 103 MET HB3 1 104 ASP H . . 3.400 2.559 2.335 2.877 . 0 0 "[ . 1 . 2]" 1
1584 1 103 MET ME 1 103 MET HG3 . . 3.460 2.575 2.195 3.466 0.006 11 0 "[ . 1 . 2]" 1
1585 1 103 MET ME 1 106 ILE MG . . 4.440 3.974 2.856 4.566 0.126 15 0 "[ . 1 . 2]" 1
1586 1 103 MET HG2 1 104 ASP H . . 5.050 4.355 3.279 5.003 . 0 0 "[ . 1 . 2]" 1
1587 1 103 MET HG2 1 104 ASP HA . . 5.390 4.875 3.407 5.469 0.079 11 0 "[ . 1 . 2]" 1
1588 1 103 MET HG3 1 104 ASP HA . . 5.010 4.345 3.660 5.055 0.045 20 0 "[ . 1 . 2]" 1
1589 1 104 ASP H 1 104 ASP HB2 . . 3.100 2.277 1.962 2.563 . 0 0 "[ . 1 . 2]" 1
1590 1 104 ASP H 1 104 ASP HB3 . . 3.680 3.320 2.761 3.625 . 0 0 "[ . 1 . 2]" 1
1591 1 104 ASP H 1 105 ALA H . . 3.170 2.618 2.294 2.797 . 0 0 "[ . 1 . 2]" 1
1592 1 104 ASP H 1 105 ALA MB . . 5.040 4.257 3.924 4.439 . 0 0 "[ . 1 . 2]" 1
1593 1 104 ASP H 1 106 ILE H . . 5.180 4.318 4.078 4.471 . 0 0 "[ . 1 . 2]" 1
1594 1 104 ASP HA 1 105 ALA MB . . 5.020 5.042 4.983 5.088 0.068 6 0 "[ . 1 . 2]" 1
1595 1 104 ASP HA 1 106 ILE H . . 4.900 4.578 4.138 4.893 . 0 0 "[ . 1 . 2]" 1
1596 1 104 ASP HB2 1 105 ALA H . . 3.450 3.087 2.455 3.518 0.068 9 0 "[ . 1 . 2]" 1
1597 1 104 ASP HB3 1 105 ALA H . . 3.770 3.162 2.432 3.809 0.039 2 0 "[ . 1 . 2]" 1
1598 1 105 ALA H 1 105 ALA MB . . 3.000 2.199 2.138 2.250 . 0 0 "[ . 1 . 2]" 1
1599 1 105 ALA H 1 106 ILE H . . 3.260 2.798 2.573 3.017 . 0 0 "[ . 1 . 2]" 1
1600 1 105 ALA H 1 106 ILE HB . . 5.280 4.916 4.617 5.212 . 0 0 "[ . 1 . 2]" 1
1601 1 105 ALA HA 1 108 PHE H . . 3.900 3.474 3.086 3.748 . 0 0 "[ . 1 . 2]" 1
1602 1 105 ALA HA 1 108 PHE HB2 . . 3.250 3.308 3.180 3.329 0.079 12 0 "[ . 1 . 2]" 1
1603 1 105 ALA HA 1 108 PHE HB3 . . 3.360 2.446 2.074 2.655 . 0 0 "[ . 1 . 2]" 1
1604 1 105 ALA HA 1 108 PHE QD . . 4.040 3.569 3.186 4.117 0.077 7 0 "[ . 1 . 2]" 1
1605 1 105 ALA MB 1 106 ILE H . . 3.420 2.471 2.222 2.769 . 0 0 "[ . 1 . 2]" 1
1606 1 105 ALA MB 1 108 PHE H . . 5.330 4.641 4.437 4.765 . 0 0 "[ . 1 . 2]" 1
1607 1 105 ALA MB 1 108 PHE HB3 . . 5.300 3.958 3.727 4.105 . 0 0 "[ . 1 . 2]" 1
1608 1 106 ILE H 1 106 ILE HB . . 3.040 2.432 2.312 2.543 . 0 0 "[ . 1 . 2]" 1
1609 1 106 ILE H 1 106 ILE MD . . 4.100 3.437 3.248 3.690 . 0 0 "[ . 1 . 2]" 1
1610 1 106 ILE H 1 106 ILE HG12 . . 3.220 2.178 2.057 2.362 . 0 0 "[ . 1 . 2]" 1
1611 1 106 ILE H 1 106 ILE HG13 . . 3.970 3.502 3.139 3.742 . 0 0 "[ . 1 . 2]" 1
1612 1 106 ILE H 1 106 ILE MG . . 3.760 3.778 3.723 3.843 0.083 12 0 "[ . 1 . 2]" 1
1613 1 106 ILE H 1 107 ASP HB2 . . 5.300 4.761 4.476 5.018 . 0 0 "[ . 1 . 2]" 1
1614 1 106 ILE HA 1 106 ILE MD . . 3.670 2.260 2.118 2.466 . 0 0 "[ . 1 . 2]" 1
1615 1 106 ILE HA 1 106 ILE HG12 . . 3.720 3.046 2.750 3.210 . 0 0 "[ . 1 . 2]" 1
1616 1 106 ILE HA 1 106 ILE HG13 . . 3.730 3.785 3.750 3.805 0.075 4 0 "[ . 1 . 2]" 1
1617 1 106 ILE HA 1 106 ILE MG . . 3.170 2.543 2.460 2.685 . 0 0 "[ . 1 . 2]" 1
1618 1 106 ILE HA 1 109 LEU H . . 3.980 3.890 3.644 4.042 0.062 5 0 "[ . 1 . 2]" 1
1619 1 106 ILE HA 1 109 LEU HB2 . . 3.320 3.057 2.651 3.401 0.081 5 0 "[ . 1 . 2]" 1
1620 1 106 ILE HA 1 109 LEU HB3 . . 5.080 4.659 4.114 5.044 . 0 0 "[ . 1 . 2]" 1
1621 1 106 ILE HA 1 109 LEU QD . . 3.720 3.222 2.168 3.671 . 0 0 "[ . 1 . 2]" 1
1622 1 106 ILE HA 1 110 ASN H . . 4.690 4.163 3.679 4.598 . 0 0 "[ . 1 . 2]" 1
1623 1 106 ILE HB 1 107 ASP H . . 3.220 2.646 2.375 2.993 . 0 0 "[ . 1 . 2]" 1
1624 1 106 ILE MD 1 110 ASN QD . . 5.040 4.134 3.397 4.929 . 0 0 "[ . 1 . 2]" 1
1625 1 106 ILE MG 1 107 ASP H . . 3.930 3.415 3.193 3.728 . 0 0 "[ . 1 . 2]" 1
1626 1 106 ILE MG 1 107 ASP HA . . 4.140 3.489 3.162 3.801 . 0 0 "[ . 1 . 2]" 1
1627 1 106 ILE MG 1 110 ASN H . . 5.060 4.425 3.940 4.926 . 0 0 "[ . 1 . 2]" 1
1628 1 106 ILE MG 1 110 ASN QB . . 4.460 3.844 3.013 4.561 0.101 1 0 "[ . 1 . 2]" 1
1629 1 106 ILE MG 1 110 ASN QD . . 3.810 2.700 2.138 3.618 . 0 0 "[ . 1 . 2]" 1
1630 1 107 ASP H 1 107 ASP HB2 . . 3.070 2.223 2.096 2.388 . 0 0 "[ . 1 . 2]" 1
1631 1 107 ASP H 1 107 ASP HB3 . . 3.410 2.943 2.561 3.469 0.059 3 0 "[ . 1 . 2]" 1
1632 1 107 ASP H 1 108 PHE H . . 3.180 2.581 2.379 2.762 . 0 0 "[ . 1 . 2]" 1
1633 1 107 ASP HA 1 107 ASP HB2 . . 2.810 2.691 2.493 2.900 0.090 3 0 "[ . 1 . 2]" 1
1634 1 107 ASP HA 1 107 ASP HB3 . . 2.920 2.949 2.690 3.003 0.083 17 0 "[ . 1 . 2]" 1
1635 1 107 ASP HB2 1 108 PHE H . . 3.480 3.492 3.078 3.566 0.086 18 0 "[ . 1 . 2]" 1
1636 1 107 ASP HB3 1 108 PHE H . . 3.720 2.740 2.233 3.429 . 0 0 "[ . 1 . 2]" 1
1637 1 108 PHE H 1 108 PHE HB2 . . 3.000 2.525 2.409 2.683 . 0 0 "[ . 1 . 2]" 1
1638 1 108 PHE H 1 108 PHE HB3 . . 3.440 2.510 2.389 2.603 . 0 0 "[ . 1 . 2]" 1
1639 1 108 PHE H 1 108 PHE QD . . 4.500 4.235 4.187 4.311 . 0 0 "[ . 1 . 2]" 1
1640 1 108 PHE H 1 109 LEU H . . 3.370 3.014 2.765 3.237 . 0 0 "[ . 1 . 2]" 1
1641 1 108 PHE HA 1 108 PHE QD . . 3.940 2.464 2.145 2.941 . 0 0 "[ . 1 . 2]" 1
1642 1 108 PHE HA 1 111 ALA H . . 4.150 3.623 3.223 3.959 . 0 0 "[ . 1 . 2]" 1
1643 1 108 PHE HA 1 111 ALA MB . . 3.810 2.847 2.219 3.416 . 0 0 "[ . 1 . 2]" 1
1644 1 108 PHE HA 1 112 LEU H . . 5.310 4.712 4.155 5.377 0.067 18 0 "[ . 1 . 2]" 1
1645 1 108 PHE HB2 1 109 LEU H . . 3.910 3.761 3.673 3.855 . 0 0 "[ . 1 . 2]" 1
1646 1 108 PHE HB3 1 109 LEU H . . 3.480 2.306 2.172 2.519 . 0 0 "[ . 1 . 2]" 1
1647 1 108 PHE HB3 1 109 LEU HG . . 4.940 4.154 2.997 4.983 0.043 11 0 "[ . 1 . 2]" 1
1648 1 108 PHE QD 1 109 LEU H . . 4.420 3.339 2.844 3.648 . 0 0 "[ . 1 . 2]" 1
1649 1 108 PHE QD 1 109 LEU HA . . 4.880 3.902 2.994 4.451 . 0 0 "[ . 1 . 2]" 1
1650 1 108 PHE QD 1 109 LEU QD . . 3.740 2.414 2.077 3.689 . 0 0 "[ . 1 . 2]" 1
1651 1 108 PHE QD 1 109 LEU HG . . 4.360 3.533 2.238 4.429 0.069 8 0 "[ . 1 . 2]" 1
1652 1 108 PHE QD 1 112 LEU QD . . 3.820 3.199 2.310 3.755 . 0 0 "[ . 1 . 2]" 1
1653 1 108 PHE QE 1 109 LEU H . . 5.400 5.281 5.009 5.483 0.083 7 0 "[ . 1 . 2]" 1
1654 1 108 PHE QE 1 112 LEU QD . . 3.810 2.544 2.248 3.102 . 0 0 "[ . 1 . 2]" 1
1655 1 108 PHE HZ 1 112 LEU QD . . 4.460 2.774 2.248 3.358 . 0 0 "[ . 1 . 2]" 1
1656 1 109 LEU H 1 109 LEU HB2 . . 2.970 2.343 2.201 2.525 . 0 0 "[ . 1 . 2]" 1
1657 1 109 LEU H 1 109 LEU HB3 . . 3.660 3.514 3.422 3.612 . 0 0 "[ . 1 . 2]" 1
1658 1 109 LEU H 1 109 LEU QD . . 3.980 2.452 1.900 3.206 . 0 0 "[ . 1 . 2]" 1
1659 1 109 LEU H 1 109 LEU HG . . 3.280 2.944 2.219 3.375 0.095 14 0 "[ . 1 . 2]" 1
1660 1 109 LEU H 1 111 ALA H . . 5.290 4.232 3.968 4.572 . 0 0 "[ . 1 . 2]" 1
1661 1 109 LEU HA 1 109 LEU QD . . 2.920 2.501 2.077 2.862 . 0 0 "[ . 1 . 2]" 1
1662 1 109 LEU HA 1 109 LEU HG . . 3.870 2.611 2.147 3.487 . 0 0 "[ . 1 . 2]" 1
1663 1 109 LEU HA 1 110 ASN HA . . 4.670 4.724 4.650 4.748 0.078 10 0 "[ . 1 . 2]" 1
1664 1 109 LEU HA 1 111 ALA H . . 5.370 4.201 3.693 4.654 . 0 0 "[ . 1 . 2]" 1
1665 1 109 LEU HA 1 112 LEU H . . 4.080 3.486 3.260 4.095 0.015 15 0 "[ . 1 . 2]" 1
1666 1 109 LEU HA 1 112 LEU QD . . 3.390 2.353 2.035 3.179 . 0 0 "[ . 1 . 2]" 1
1667 1 109 LEU HA 1 112 LEU HG . . 3.890 3.114 2.172 3.850 . 0 0 "[ . 1 . 2]" 1
1668 1 109 LEU HB2 1 110 ASN H . . 3.340 2.734 2.607 3.002 . 0 0 "[ . 1 . 2]" 1
1669 1 109 LEU HB2 1 110 ASN QB . . 4.900 4.516 3.797 4.916 0.016 1 0 "[ . 1 . 2]" 1
1670 1 109 LEU HB3 1 110 ASN H . . 4.090 3.489 3.268 3.730 . 0 0 "[ . 1 . 2]" 1
1671 1 109 LEU HB3 1 110 ASN QB . . 5.180 5.118 4.793 5.270 0.090 5 0 "[ . 1 . 2]" 1
1672 1 109 LEU QD 1 110 ASN H . . 4.680 4.076 3.931 4.227 . 0 0 "[ . 1 . 2]" 1
1673 1 109 LEU QD 1 112 LEU QD . . 3.180 2.786 2.021 3.184 0.004 8 0 "[ . 1 . 2]" 1
1674 1 110 ASN H 1 110 ASN QB . . 2.790 2.250 2.073 2.424 . 0 0 "[ . 1 . 2]" 1
1675 1 110 ASN H 1 110 ASN QD . . 5.390 2.823 2.334 4.004 . 0 0 "[ . 1 . 2]" 1
1676 1 110 ASN H 1 111 ALA H . . 3.130 2.678 2.444 2.913 . 0 0 "[ . 1 . 2]" 1
1677 1 110 ASN H 1 111 ALA MB . . 4.400 4.312 3.978 4.468 0.068 3 0 "[ . 1 . 2]" 1
1678 1 110 ASN H 1 112 LEU H . . 4.810 4.117 3.866 4.372 . 0 0 "[ . 1 . 2]" 1
1679 1 110 ASN HA 1 110 ASN QB . . 2.780 2.497 2.402 2.565 . 0 0 "[ . 1 . 2]" 1
1680 1 110 ASN HA 1 110 ASN QD . . 4.490 3.214 1.957 3.797 . 0 0 "[ . 1 . 2]" 1
1681 1 110 ASN HA 1 112 LEU H . . 4.050 4.015 3.607 4.132 0.082 2 0 "[ . 1 . 2]" 1
1682 1 110 ASN HA 1 113 GLU H . . 4.830 3.835 3.530 4.264 . 0 0 "[ . 1 . 2]" 1
1683 1 110 ASN HA 1 113 GLU HG3 . . 4.820 4.175 3.267 4.893 0.073 10 0 "[ . 1 . 2]" 1
1684 1 110 ASN QB 1 111 ALA H . . 3.290 2.974 2.476 3.383 0.093 13 0 "[ . 1 . 2]" 1
1685 1 110 ASN QB 1 111 ALA HA . . 4.330 4.009 3.707 4.288 . 0 0 "[ . 1 . 2]" 1
1686 1 110 ASN QB 1 111 ALA MB . . 4.400 3.842 3.481 4.137 . 0 0 "[ . 1 . 2]" 1
1687 1 110 ASN QB 1 112 LEU H . . 4.920 4.706 4.420 5.001 0.081 13 0 "[ . 1 . 2]" 1
1688 1 111 ALA H 1 111 ALA MB . . 2.590 2.244 2.166 2.361 . 0 0 "[ . 1 . 2]" 1
1689 1 111 ALA H 1 112 LEU H . . 3.030 2.496 2.057 2.941 . 0 0 "[ . 1 . 2]" 1
1690 1 111 ALA HA 1 113 GLU H . . 4.870 4.344 3.533 4.913 0.043 3 0 "[ . 1 . 2]" 1
1691 1 111 ALA MB 1 112 LEU H . . 3.280 3.105 2.832 3.360 0.080 15 0 "[ . 1 . 2]" 1
1692 1 111 ALA MB 1 112 LEU QD . . 5.500 3.928 3.380 4.684 . 0 0 "[ . 1 . 2]" 1
1693 1 112 LEU H 1 112 LEU HB2 . . 3.060 2.449 2.280 2.728 . 0 0 "[ . 1 . 2]" 1
1694 1 112 LEU H 1 112 LEU HB3 . . 3.560 3.403 1.668 3.634 0.074 5 0 "[ . 1 . 2]" 1
1695 1 112 LEU H 1 112 LEU QD . . 3.680 3.194 2.903 3.368 . 0 0 "[ . 1 . 2]" 1
1696 1 112 LEU H 1 112 LEU HG . . 3.270 2.628 2.289 3.373 0.103 1 0 "[ . 1 . 2]" 1
1697 1 112 LEU H 1 113 GLU H . . 3.470 2.507 2.072 2.847 . 0 0 "[ . 1 . 2]" 1
1698 1 112 LEU HA 1 112 LEU QD . . 2.960 2.126 2.045 2.322 . 0 0 "[ . 1 . 2]" 1
1699 1 112 LEU HA 1 113 GLU H . . 3.570 3.551 3.436 3.619 0.049 3 0 "[ . 1 . 2]" 1
1700 1 112 LEU HB2 1 113 GLU H . . 3.480 2.716 2.189 3.984 0.504 13 1 "[ . 1 + . 2]" 1
1701 1 112 LEU HB2 1 113 GLU HA . . 4.440 4.428 3.986 5.228 0.788 1 2 "[+ . 1 - . 2]" 1
1702 1 112 LEU HB3 1 113 GLU H . . 4.030 3.417 2.625 4.086 0.056 15 0 "[ . 1 . 2]" 1
1703 1 112 LEU HB3 1 113 GLU HA . . 5.130 4.378 3.882 4.813 . 0 0 "[ . 1 . 2]" 1
1704 1 112 LEU QD 1 113 GLU H . . 4.600 3.989 3.460 4.291 . 0 0 "[ . 1 . 2]" 1
1705 1 113 GLU H 1 113 GLU QB . . 3.280 2.365 1.969 2.690 . 0 0 "[ . 1 . 2]" 1
1706 1 113 GLU H 1 113 GLU HG2 . . 4.160 3.129 1.788 4.243 0.083 3 0 "[ . 1 . 2]" 1
1707 1 113 GLU H 1 113 GLU HG3 . . 4.050 3.460 2.532 4.124 0.074 10 0 "[ . 1 . 2]" 1
1708 1 113 GLU HA 1 113 GLU HG2 . . 3.910 2.910 2.224 4.254 0.344 13 0 "[ . 1 . 2]" 1
1709 1 113 GLU HA 1 114 GLY H . . 2.990 2.433 2.142 3.056 0.066 11 0 "[ . 1 . 2]" 1
1710 1 113 GLU QB 1 114 GLY H . . 4.370 2.909 2.350 3.902 . 0 0 "[ . 1 . 2]" 1
1711 1 113 GLU QB 1 114 GLY HA2 . . 4.880 4.251 3.489 5.387 0.507 11 1 "[ . 1+ . 2]" 1
1712 1 114 GLY H 1 114 GLY HA2 . . 2.840 2.710 2.376 2.974 0.134 2 0 "[ . 1 . 2]" 1
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