NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
562488 |
2lsv   |
18447 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lsv
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 2674
_Distance_constraint_stats_list.Viol_count 8078
_Distance_constraint_stats_list.Viol_total 14597.764
_Distance_constraint_stats_list.Viol_max 0.952
_Distance_constraint_stats_list.Viol_rms 0.0478
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0136
_Distance_constraint_stats_list.Viol_average_violations_only 0.0904
_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 3 PHE 17.615 0.344 9 0 "[ . 1 . 2]"
1 4 GLU 9.955 0.205 2 0 "[ . 1 . 2]"
1 5 LYS 17.133 0.307 2 0 "[ . 1 . 2]"
1 6 GLN 15.457 0.273 2 0 "[ . 1 . 2]"
1 7 LYS 15.248 0.264 11 0 "[ . 1 . 2]"
1 8 GLU 8.331 0.264 11 0 "[ . 1 . 2]"
1 9 GLN 15.736 0.307 2 0 "[ . 1 . 2]"
1 10 GLY 3.753 0.171 2 0 "[ . 1 . 2]"
1 11 ASN 4.652 0.236 16 0 "[ . 1 . 2]"
1 12 SER 4.695 0.214 12 0 "[ . 1 . 2]"
1 13 LEU 14.272 0.391 3 0 "[ . 1 . 2]"
1 14 PHE 12.925 0.237 14 0 "[ . 1 . 2]"
1 15 LYS 14.815 0.237 14 0 "[ . 1 . 2]"
1 16 GLN 9.165 0.177 2 0 "[ . 1 . 2]"
1 17 GLY 4.972 0.952 1 1 "[+ . 1 . 2]"
1 18 LEU 9.113 0.952 1 1 "[+ . 1 . 2]"
1 19 TYR 11.065 0.562 14 1 "[ . 1 +. 2]"
1 20 ARG 29.101 0.947 3 20 [**+**********-******]
1 21 GLU 9.380 0.218 1 0 "[ . 1 . 2]"
1 22 ALA 5.592 0.158 1 0 "[ . 1 . 2]"
1 23 VAL 59.417 0.947 3 20 [**+**********-******]
1 24 HIS 24.023 0.360 16 0 "[ . 1 . 2]"
1 25 CYS 0.155 0.038 15 0 "[ . 1 . 2]"
1 26 TYR 15.514 0.472 13 0 "[ . 1 . 2]"
1 27 ASP 6.401 0.149 14 0 "[ . 1 . 2]"
1 28 GLN 10.205 0.249 20 0 "[ . 1 . 2]"
1 29 LEU 8.379 0.236 16 0 "[ . 1 . 2]"
1 30 ILE 9.626 0.203 1 0 "[ . 1 . 2]"
1 31 THR 11.773 0.249 20 0 "[ . 1 . 2]"
1 32 ALA 4.713 0.105 20 0 "[ . 1 . 2]"
1 33 GLN 15.002 0.257 19 0 "[ . 1 . 2]"
1 34 PRO 14.752 0.282 16 0 "[ . 1 . 2]"
1 35 GLN 18.489 0.307 16 0 "[ . 1 . 2]"
1 36 ASN 18.742 0.391 7 0 "[ . 1 . 2]"
1 37 PRO 17.559 0.391 7 0 "[ . 1 . 2]"
1 38 VAL 52.019 0.633 9 6 "[ .*- +1 * .* * 2]"
1 39 GLY 21.880 0.633 9 3 "[ . - +1 . * 2]"
1 40 TYR 7.154 0.141 19 0 "[ . 1 . 2]"
1 41 SER 9.986 0.369 13 0 "[ . 1 . 2]"
1 42 ASN 2.917 0.194 9 0 "[ . 1 . 2]"
1 43 LYS 7.811 0.328 20 0 "[ . 1 . 2]"
1 44 ALA 4.747 0.175 19 0 "[ . 1 . 2]"
1 45 MET 3.002 0.122 10 0 "[ . 1 . 2]"
1 46 ALA 1.032 0.106 18 0 "[ . 1 . 2]"
1 47 LEU 5.670 0.191 14 0 "[ . 1 . 2]"
1 48 ILE 14.620 0.248 2 0 "[ . 1 . 2]"
1 49 LYS 13.882 0.251 18 0 "[ . 1 . 2]"
1 50 LEU 12.972 0.562 14 1 "[ . 1 +. 2]"
1 51 GLY 9.003 0.248 2 0 "[ . 1 . 2]"
1 52 GLU 8.491 0.132 12 0 "[ . 1 . 2]"
1 53 TYR 20.902 0.461 20 0 "[ . 1 . 2]"
1 54 THR 4.128 0.234 15 0 "[ . 1 . 2]"
1 55 GLN 17.310 0.327 15 0 "[ . 1 . 2]"
1 56 ALA 8.113 0.124 9 0 "[ . 1 . 2]"
1 57 ILE 11.076 0.135 14 0 "[ . 1 . 2]"
1 58 GLN 18.550 0.285 9 0 "[ . 1 . 2]"
1 59 MET 5.850 0.246 9 0 "[ . 1 . 2]"
1 60 CYS 6.245 0.204 16 0 "[ . 1 . 2]"
1 61 GLN 10.504 0.171 17 0 "[ . 1 . 2]"
1 62 GLN 9.748 0.207 4 0 "[ . 1 . 2]"
1 63 GLY 2.406 0.141 19 0 "[ . 1 . 2]"
1 64 LEU 9.493 0.425 20 0 "[ . 1 . 2]"
1 65 ARG 13.613 0.338 14 0 "[ . 1 . 2]"
1 66 TYR 20.632 0.338 14 0 "[ . 1 . 2]"
1 67 THR 2.871 0.123 11 0 "[ . 1 . 2]"
1 68 SER 3.319 0.180 20 0 "[ . 1 . 2]"
1 69 THR 3.882 0.180 20 0 "[ . 1 . 2]"
1 70 ALA 1.141 0.071 12 0 "[ . 1 . 2]"
1 71 GLU 10.095 0.240 20 0 "[ . 1 . 2]"
1 72 HIS 11.022 0.240 20 0 "[ . 1 . 2]"
1 73 VAL 7.333 0.369 7 0 "[ . 1 . 2]"
1 74 ALA 13.271 0.369 7 0 "[ . 1 . 2]"
1 75 ILE 35.962 0.548 12 3 "[ .- 1 + .* 2]"
1 76 ARG 14.844 0.297 8 0 "[ . 1 . 2]"
1 77 SER 11.924 0.194 1 0 "[ . 1 . 2]"
1 78 LYS 7.622 0.354 15 0 "[ . 1 . 2]"
1 79 LEU 11.566 0.369 13 0 "[ . 1 . 2]"
1 80 GLN 24.978 0.390 9 0 "[ . 1 . 2]"
1 81 TYR 12.160 0.210 14 0 "[ . 1 . 2]"
1 82 ARG 16.474 0.258 5 0 "[ . 1 . 2]"
1 83 LEU 13.108 0.425 20 0 "[ . 1 . 2]"
1 84 GLU 8.471 0.191 7 0 "[ . 1 . 2]"
1 85 LEU 12.190 0.258 5 0 "[ . 1 . 2]"
1 86 ALA 9.882 0.212 10 0 "[ . 1 . 2]"
1 87 GLN 17.132 0.279 15 0 "[ . 1 . 2]"
1 88 GLY 4.058 0.168 5 0 "[ . 1 . 2]"
1 89 ALA 6.510 0.299 10 0 "[ . 1 . 2]"
1 90 VAL 41.833 0.461 20 0 "[ . 1 . 2]"
1 91 GLY 7.085 0.230 14 0 "[ . 1 . 2]"
1 92 SER 1.954 0.128 1 0 "[ . 1 . 2]"
1 93 VAL 6.506 0.548 3 1 "[ + . 1 . 2]"
1 94 GLN 7.470 0.548 3 1 "[ + . 1 . 2]"
1 95 ILE 0.215 0.044 3 0 "[ . 1 . 2]"
1 96 PRO 1.431 0.072 8 0 "[ . 1 . 2]"
1 97 VAL 4.120 0.244 18 0 "[ . 1 . 2]"
1 98 VAL 9.123 0.285 3 0 "[ . 1 . 2]"
1 99 GLU 11.996 0.415 7 0 "[ . 1 . 2]"
1 100 VAL 4.243 0.092 17 0 "[ . 1 . 2]"
1 101 ASP 3.860 0.415 7 0 "[ . 1 . 2]"
1 102 GLU 10.376 0.460 17 0 "[ . 1 . 2]"
1 103 LEU 33.598 0.607 13 3 "[ . 1 *+ . - 2]"
1 104 PRO 13.502 0.607 13 2 "[ . 1 + . - 2]"
1 105 GLU 1.917 0.102 4 0 "[ . 1 . 2]"
1 106 GLY 1.370 0.102 4 0 "[ . 1 . 2]"
1 107 TYR 21.476 0.571 12 1 "[ . 1 + . 2]"
1 108 ASP 3.647 0.241 20 0 "[ . 1 . 2]"
1 109 ARG 1.389 0.197 19 0 "[ . 1 . 2]"
1 110 SER 0.900 0.285 10 0 "[ . 1 . 2]"
2 1 ALA 0.258 0.052 12 0 "[ . 1 . 2]"
2 2 ASP 0.751 0.115 4 0 "[ . 1 . 2]"
2 3 THR 5.848 0.189 18 0 "[ . 1 . 2]"
2 4 GLU 2.476 0.157 12 0 "[ . 1 . 2]"
2 5 MET 12.335 0.310 13 0 "[ . 1 . 2]"
2 6 GLU 3.122 0.182 2 0 "[ . 1 . 2]"
2 7 GLU 1.546 0.116 14 0 "[ . 1 . 2]"
2 8 VAL 15.280 0.304 12 0 "[ . 1 . 2]"
2 9 ASP 13.147 0.304 12 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 PHE H 1 3 PHE HB3 . . 4.130 2.827 2.712 2.872 . 0 0 "[ . 1 . 2]" 1
2 1 3 PHE H 1 3 PHE QD . . 4.330 4.209 4.127 4.256 . 0 0 "[ . 1 . 2]" 1
3 1 3 PHE H 1 4 GLU H . . 4.780 1.683 1.632 1.743 . 0 0 "[ . 1 . 2]" 1
4 1 3 PHE H 1 4 GLU HA . . 5.390 4.223 4.199 4.243 . 0 0 "[ . 1 . 2]" 1
5 1 3 PHE H 1 4 GLU HB2 . . 4.310 3.205 3.142 3.287 . 0 0 "[ . 1 . 2]" 1
6 1 3 PHE H 1 5 LYS HB2 . . 5.500 4.479 4.262 4.846 . 0 0 "[ . 1 . 2]" 1
7 1 3 PHE H 1 6 GLN QB . . 5.500 4.972 4.599 5.510 0.010 2 0 "[ . 1 . 2]" 1
8 1 3 PHE HA 1 3 PHE QD . . 3.320 3.155 3.114 3.195 . 0 0 "[ . 1 . 2]" 1
9 1 3 PHE HA 1 7 LYS H . . 4.960 4.910 4.591 5.004 0.044 10 0 "[ . 1 . 2]" 1
10 1 3 PHE HA 1 29 LEU MD2 . . 3.720 2.938 2.727 3.191 . 0 0 "[ . 1 . 2]" 1
11 1 3 PHE HB2 1 4 GLU H . . 4.040 3.780 3.689 3.825 . 0 0 "[ . 1 . 2]" 1
12 1 3 PHE HB2 1 29 LEU MD2 . . 5.100 4.108 3.961 4.369 . 0 0 "[ . 1 . 2]" 1
13 1 3 PHE HB2 1 32 ALA MB . . 4.380 3.551 3.230 3.824 . 0 0 "[ . 1 . 2]" 1
14 1 3 PHE HB2 1 33 GLN QE . . 5.350 3.182 2.788 3.941 . 0 0 "[ . 1 . 2]" 1
15 1 3 PHE HB3 1 4 GLU H . . 3.880 2.421 2.292 2.494 . 0 0 "[ . 1 . 2]" 1
16 1 3 PHE HB3 1 4 GLU HA . . 5.090 4.239 4.171 4.306 . 0 0 "[ . 1 . 2]" 1
17 1 3 PHE HB3 1 29 LEU MD2 . . 5.390 4.389 4.266 4.586 . 0 0 "[ . 1 . 2]" 1
18 1 3 PHE HB3 1 32 ALA MB . . 5.290 4.993 4.684 5.247 . 0 0 "[ . 1 . 2]" 1
19 1 3 PHE HB3 1 33 GLN QE . . 5.500 3.654 3.248 4.159 . 0 0 "[ . 1 . 2]" 1
20 1 3 PHE QD 1 4 GLU H . . 3.650 3.086 2.970 3.237 . 0 0 "[ . 1 . 2]" 1
21 1 3 PHE QD 1 4 GLU HA . . 3.800 2.783 2.706 2.839 . 0 0 "[ . 1 . 2]" 1
22 1 3 PHE QD 1 4 GLU HB3 . . 5.260 4.925 4.810 4.972 . 0 0 "[ . 1 . 2]" 1
23 1 3 PHE QD 1 4 GLU QG . . 3.980 3.126 2.872 3.345 . 0 0 "[ . 1 . 2]" 1
24 1 3 PHE QD 1 5 LYS H . . 5.500 5.305 5.134 5.455 . 0 0 "[ . 1 . 2]" 1
25 1 3 PHE QD 1 7 LYS H . . 5.050 5.038 4.837 5.117 0.067 2 0 "[ . 1 . 2]" 1
26 1 3 PHE QD 1 7 LYS HD2 . . 4.520 4.643 4.572 4.682 0.162 10 0 "[ . 1 . 2]" 1
27 1 3 PHE QD 1 7 LYS HE2 . . 4.890 2.795 2.340 3.082 . 0 0 "[ . 1 . 2]" 1
28 1 3 PHE QD 1 29 LEU HA . . 4.670 2.864 2.631 3.150 . 0 0 "[ . 1 . 2]" 1
29 1 3 PHE QD 1 29 LEU MD1 . . 4.280 4.174 3.851 4.295 0.015 3 0 "[ . 1 . 2]" 1
30 1 3 PHE QD 1 29 LEU MD2 . . 3.610 3.004 2.908 3.196 . 0 0 "[ . 1 . 2]" 1
31 1 3 PHE QD 1 32 ALA H . . 4.930 4.725 4.504 4.868 . 0 0 "[ . 1 . 2]" 1
32 1 3 PHE QD 1 32 ALA MB . . 3.190 2.636 2.457 2.801 . 0 0 "[ . 1 . 2]" 1
33 1 3 PHE QD 1 33 GLN H . . 4.720 4.130 3.892 4.329 . 0 0 "[ . 1 . 2]" 1
34 1 3 PHE QD 1 33 GLN QE . . 4.250 2.457 2.301 2.891 . 0 0 "[ . 1 . 2]" 1
35 1 3 PHE QE 1 4 GLU H . . 5.500 5.357 5.253 5.470 . 0 0 "[ . 1 . 2]" 1
36 1 3 PHE QE 1 4 GLU HA . . 4.240 4.354 4.300 4.408 0.168 9 0 "[ . 1 . 2]" 1
37 1 3 PHE QE 1 4 GLU QG . . 5.150 4.753 4.501 4.951 . 0 0 "[ . 1 . 2]" 1
38 1 3 PHE QE 1 7 LYS HD2 . . 4.470 3.020 2.907 3.125 . 0 0 "[ . 1 . 2]" 1
39 1 3 PHE QE 1 7 LYS HD3 . . 4.610 1.986 1.874 2.072 . 0 0 "[ . 1 . 2]" 1
40 1 3 PHE QE 1 7 LYS HE2 . . 4.350 2.530 2.023 3.287 . 0 0 "[ . 1 . 2]" 1
41 1 3 PHE QE 1 7 LYS HE3 . . 4.320 3.518 2.959 4.360 0.040 2 0 "[ . 1 . 2]" 1
42 1 3 PHE QE 1 29 LEU HA . . 3.590 2.967 2.886 3.114 . 0 0 "[ . 1 . 2]" 1
43 1 3 PHE QE 1 29 LEU HB2 . . 4.600 3.898 3.760 3.994 . 0 0 "[ . 1 . 2]" 1
44 1 3 PHE QE 1 29 LEU HB3 . . 4.340 2.398 2.214 2.538 . 0 0 "[ . 1 . 2]" 1
45 1 3 PHE QE 1 29 LEU MD1 . . 4.200 3.271 2.937 3.416 . 0 0 "[ . 1 . 2]" 1
46 1 3 PHE QE 1 29 LEU MD2 . . 3.760 3.169 3.022 3.288 . 0 0 "[ . 1 . 2]" 1
47 1 3 PHE QE 1 32 ALA H . . 5.500 5.133 4.980 5.207 . 0 0 "[ . 1 . 2]" 1
48 1 3 PHE QE 1 32 ALA MB . . 4.100 3.992 3.813 4.123 0.023 16 0 "[ . 1 . 2]" 1
49 1 3 PHE QE 1 33 GLN H . . 4.010 4.008 3.918 4.051 0.041 3 0 "[ . 1 . 2]" 1
50 1 3 PHE QE 1 33 GLN HB2 . . 4.490 3.074 2.907 3.191 . 0 0 "[ . 1 . 2]" 1
51 1 3 PHE QE 1 33 GLN HB3 . . 4.710 2.487 2.334 2.567 . 0 0 "[ . 1 . 2]" 1
52 1 3 PHE QE 1 33 GLN QE . . 5.500 2.673 2.005 3.201 . 0 0 "[ . 1 . 2]" 1
53 1 3 PHE QE 1 33 GLN HG3 . . 5.030 5.076 4.923 5.159 0.129 8 0 "[ . 1 . 2]" 1
54 1 3 PHE QE 1 38 VAL HB . . 4.570 4.689 4.612 4.729 0.159 1 0 "[ . 1 . 2]" 1
55 1 3 PHE QE 1 38 VAL MG1 . . 5.500 2.858 2.196 3.348 . 0 0 "[ . 1 . 2]" 1
56 1 3 PHE QE 1 38 VAL MG2 . . 3.610 2.756 2.337 3.668 0.058 13 0 "[ . 1 . 2]" 1
57 1 3 PHE HZ 1 29 LEU HA . . 4.640 4.693 4.641 4.757 0.117 14 0 "[ . 1 . 2]" 1
58 1 3 PHE HZ 1 29 LEU HB2 . . 4.790 4.478 4.271 4.589 . 0 0 "[ . 1 . 2]" 1
59 1 3 PHE HZ 1 29 LEU HB3 . . 4.250 2.893 2.765 2.978 . 0 0 "[ . 1 . 2]" 1
60 1 3 PHE HZ 1 29 LEU MD1 . . 4.250 3.046 2.628 3.225 . 0 0 "[ . 1 . 2]" 1
61 1 3 PHE HZ 1 29 LEU MD2 . . 4.020 3.672 3.451 3.815 . 0 0 "[ . 1 . 2]" 1
62 1 3 PHE HZ 1 36 ASN HB3 . . 4.930 4.783 4.610 4.934 0.004 16 0 "[ . 1 . 2]" 1
63 1 3 PHE HZ 1 36 ASN HD22 . . 5.110 3.227 2.989 3.387 . 0 0 "[ . 1 . 2]" 1
64 1 3 PHE HZ 1 38 VAL HB . . 4.160 4.387 4.315 4.504 0.344 9 0 "[ . 1 . 2]" 1
65 1 3 PHE HZ 1 38 VAL MG2 . . 3.460 2.375 1.814 3.709 0.249 3 0 "[ . 1 . 2]" 1
66 1 3 PHE HZ 1 39 GLY HA3 . . 4.400 4.402 3.976 4.671 0.271 10 0 "[ . 1 . 2]" 1
67 1 4 GLU H 1 4 GLU HB2 . . 3.710 2.391 2.349 2.427 . 0 0 "[ . 1 . 2]" 1
68 1 4 GLU H 1 4 GLU HB3 . . 3.330 3.468 3.448 3.483 0.153 10 0 "[ . 1 . 2]" 1
69 1 4 GLU H 1 4 GLU QG . . 3.620 2.253 1.795 3.039 . 0 0 "[ . 1 . 2]" 1
70 1 4 GLU H 1 5 LYS H . . 3.890 3.035 2.957 3.138 . 0 0 "[ . 1 . 2]" 1
71 1 4 GLU H 1 7 LYS H . . 5.380 4.965 4.800 5.062 . 0 0 "[ . 1 . 2]" 1
72 1 4 GLU H 1 7 LYS HB3 . . 5.500 4.903 4.747 5.013 . 0 0 "[ . 1 . 2]" 1
73 1 4 GLU H 1 29 LEU MD2 . . 5.500 4.753 4.654 4.880 . 0 0 "[ . 1 . 2]" 1
74 1 4 GLU HA 1 4 GLU HB3 . . 2.940 2.515 2.485 2.540 . 0 0 "[ . 1 . 2]" 1
75 1 4 GLU HA 1 4 GLU QG . . 2.830 2.329 2.274 2.403 . 0 0 "[ . 1 . 2]" 1
76 1 4 GLU HA 1 6 GLN H . . 5.070 4.798 4.673 5.134 0.064 2 0 "[ . 1 . 2]" 1
77 1 4 GLU HA 1 7 LYS H . . 4.460 3.642 3.556 3.703 . 0 0 "[ . 1 . 2]" 1
78 1 4 GLU HA 1 7 LYS HB2 . . 4.790 3.556 3.384 3.749 . 0 0 "[ . 1 . 2]" 1
79 1 4 GLU HA 1 7 LYS HB3 . . 4.220 2.564 2.461 2.657 . 0 0 "[ . 1 . 2]" 1
80 1 4 GLU HA 1 7 LYS HE2 . . 4.590 2.792 1.946 3.370 . 0 0 "[ . 1 . 2]" 1
81 1 4 GLU HA 1 7 LYS HE3 . . 4.570 2.391 1.866 3.397 . 0 0 "[ . 1 . 2]" 1
82 1 4 GLU HA 1 7 LYS HG2 . . 5.130 4.619 4.473 4.790 . 0 0 "[ . 1 . 2]" 1
83 1 4 GLU HA 1 29 LEU MD2 . . 4.750 4.399 4.284 4.519 . 0 0 "[ . 1 . 2]" 1
84 1 4 GLU HB3 1 4 GLU QG . . 2.650 2.305 2.167 2.401 . 0 0 "[ . 1 . 2]" 1
85 1 4 GLU HB3 1 5 LYS H . . 3.490 3.513 3.305 3.695 0.205 2 0 "[ . 1 . 2]" 1
86 1 4 GLU HB3 1 5 LYS HA . . 3.930 4.006 3.828 4.125 0.195 3 0 "[ . 1 . 2]" 1
87 1 4 GLU QG 1 5 LYS H . . 4.460 4.235 4.053 4.488 0.028 9 0 "[ . 1 . 2]" 1
88 1 4 GLU QG 1 7 LYS H . . 5.500 5.516 5.429 5.595 0.095 8 0 "[ . 1 . 2]" 1
89 1 4 GLU QG 1 7 LYS HB3 . . 4.470 4.538 4.489 4.576 0.106 4 0 "[ . 1 . 2]" 1
90 1 4 GLU QG 1 7 LYS HE2 . . 4.750 3.495 3.128 3.788 . 0 0 "[ . 1 . 2]" 1
91 1 5 LYS H 1 5 LYS HB2 . . 3.230 2.135 2.043 2.354 . 0 0 "[ . 1 . 2]" 1
92 1 5 LYS H 1 5 LYS HB3 . . 3.250 3.142 2.359 3.459 0.209 18 0 "[ . 1 . 2]" 1
93 1 5 LYS H 1 5 LYS QD . . 3.990 3.063 2.403 4.181 0.191 2 0 "[ . 1 . 2]" 1
94 1 5 LYS H 1 5 LYS QE . . 5.040 3.834 1.997 4.740 . 0 0 "[ . 1 . 2]" 1
95 1 5 LYS H 1 5 LYS HG2 . . 4.160 4.168 4.035 4.395 0.235 15 0 "[ . 1 . 2]" 1
96 1 5 LYS H 1 5 LYS HG3 . . 4.350 4.149 3.929 4.418 0.068 16 0 "[ . 1 . 2]" 1
97 1 5 LYS H 1 6 GLN H . . 3.870 2.596 2.377 2.839 . 0 0 "[ . 1 . 2]" 1
98 1 5 LYS H 1 6 GLN QB . . 5.500 4.510 4.186 4.872 . 0 0 "[ . 1 . 2]" 1
99 1 5 LYS H 1 6 GLN HG3 . . 4.820 4.389 3.855 4.967 0.147 5 0 "[ . 1 . 2]" 1
100 1 5 LYS H 1 7 LYS H . . 5.500 3.766 3.579 3.912 . 0 0 "[ . 1 . 2]" 1
101 1 5 LYS H 1 29 LEU MD2 . . 5.500 5.059 4.805 5.304 . 0 0 "[ . 1 . 2]" 1
102 1 5 LYS HA 1 5 LYS QD . . 3.790 2.450 1.875 3.966 0.176 2 0 "[ . 1 . 2]" 1
103 1 5 LYS HA 1 5 LYS QE . . 4.300 3.477 1.937 4.344 0.044 15 0 "[ . 1 . 2]" 1
104 1 5 LYS HA 1 5 LYS HG2 . . 3.590 3.534 2.872 3.701 0.111 16 0 "[ . 1 . 2]" 1
105 1 5 LYS HA 1 5 LYS HG3 . . 3.520 2.482 2.196 3.158 . 0 0 "[ . 1 . 2]" 1
106 1 5 LYS HA 1 8 GLU H . . 4.150 3.182 2.883 3.629 . 0 0 "[ . 1 . 2]" 1
107 1 5 LYS HA 1 8 GLU HG3 . . 5.160 3.201 2.258 3.812 . 0 0 "[ . 1 . 2]" 1
108 1 5 LYS HB2 1 5 LYS QE . . 4.830 3.115 1.988 4.043 . 0 0 "[ . 1 . 2]" 1
109 1 5 LYS HB2 1 6 GLN H . . 3.620 3.090 2.718 3.760 0.140 2 0 "[ . 1 . 2]" 1
110 1 5 LYS HB2 1 9 GLN H . . 5.430 5.635 5.570 5.737 0.307 2 0 "[ . 1 . 2]" 1
111 1 5 LYS HB3 1 5 LYS QD . . 3.650 3.344 2.264 3.565 . 0 0 "[ . 1 . 2]" 1
112 1 5 LYS HB3 1 5 LYS QE . . 4.150 3.758 2.024 4.209 0.059 5 0 "[ . 1 . 2]" 1
113 1 5 LYS HB3 1 6 GLN H . . 3.560 2.999 2.319 3.323 . 0 0 "[ . 1 . 2]" 1
114 1 5 LYS QD 1 5 LYS HG3 . . 2.660 2.322 2.193 2.522 . 0 0 "[ . 1 . 2]" 1
115 1 5 LYS QD 1 6 GLN H . . 5.120 4.584 4.242 5.162 0.042 15 0 "[ . 1 . 2]" 1
116 1 5 LYS QE 1 5 LYS HG3 . . 3.680 2.745 2.229 3.535 . 0 0 "[ . 1 . 2]" 1
117 1 5 LYS HG2 1 6 GLN H . . 5.070 4.910 3.370 5.207 0.137 11 0 "[ . 1 . 2]" 1
118 1 5 LYS HG3 1 6 GLN H . . 5.500 4.764 3.838 5.067 . 0 0 "[ . 1 . 2]" 1
119 1 5 LYS HG3 1 8 GLU HG3 . . 5.140 4.881 3.690 5.245 0.105 15 0 "[ . 1 . 2]" 1
120 1 5 LYS HG3 1 9 GLN QG . . 5.370 5.240 3.966 5.462 0.092 10 0 "[ . 1 . 2]" 1
121 1 6 GLN H 1 6 GLN QB . . 3.720 2.386 2.303 2.477 . 0 0 "[ . 1 . 2]" 1
122 1 6 GLN H 1 6 GLN HE22 . . 5.500 5.705 5.637 5.773 0.273 2 0 "[ . 1 . 2]" 1
123 1 6 GLN H 1 6 GLN HG2 . . 3.720 2.414 1.831 2.935 . 0 0 "[ . 1 . 2]" 1
124 1 6 GLN H 1 6 GLN HG3 . . 3.620 2.390 1.836 3.184 . 0 0 "[ . 1 . 2]" 1
125 1 6 GLN H 1 7 LYS HA . . 5.500 5.292 5.233 5.358 . 0 0 "[ . 1 . 2]" 1
126 1 6 GLN H 1 7 LYS HB3 . . 5.500 4.742 4.626 4.988 . 0 0 "[ . 1 . 2]" 1
127 1 6 GLN H 1 29 LEU MD1 . . 5.500 5.562 5.530 5.595 0.095 5 0 "[ . 1 . 2]" 1
128 1 6 GLN H 1 29 LEU MD2 . . 4.980 3.699 3.618 3.791 . 0 0 "[ . 1 . 2]" 1
129 1 6 GLN HA 1 6 GLN HE21 . . 4.730 4.049 3.605 4.741 0.011 12 0 "[ . 1 . 2]" 1
130 1 6 GLN HA 1 6 GLN HE22 . . 4.990 4.902 4.111 5.229 0.239 16 0 "[ . 1 . 2]" 1
131 1 6 GLN HA 1 6 GLN HG2 . . 3.710 2.559 2.282 2.934 . 0 0 "[ . 1 . 2]" 1
132 1 6 GLN HA 1 6 GLN HG3 . . 3.610 3.460 3.146 3.779 0.169 4 0 "[ . 1 . 2]" 1
133 1 6 GLN HA 1 9 GLN H . . 4.610 3.933 3.193 4.187 . 0 0 "[ . 1 . 2]" 1
134 1 6 GLN HA 1 9 GLN HB2 . . 3.810 3.879 3.829 3.936 0.126 4 0 "[ . 1 . 2]" 1
135 1 6 GLN HA 1 9 GLN HE21 . . 5.500 5.444 4.340 5.531 0.031 3 0 "[ . 1 . 2]" 1
136 1 6 GLN HA 1 9 GLN HE22 . . 5.500 5.439 5.168 5.769 0.269 2 0 "[ . 1 . 2]" 1
137 1 6 GLN HA 1 10 GLY H . . 4.600 4.201 2.948 4.617 0.017 5 0 "[ . 1 . 2]" 1
138 1 6 GLN HA 1 29 LEU MD2 . . 5.500 4.013 3.831 4.381 . 0 0 "[ . 1 . 2]" 1
139 1 6 GLN QB 1 7 LYS H . . 4.920 3.160 2.843 3.340 . 0 0 "[ . 1 . 2]" 1
140 1 6 GLN QB 1 28 GLN QB . . 3.530 2.796 2.570 3.512 . 0 0 "[ . 1 . 2]" 1
141 1 6 GLN QB 1 29 LEU MD2 . . 4.470 2.016 1.843 2.202 . 0 0 "[ . 1 . 2]" 1
142 1 6 GLN HE21 1 28 GLN QB . . 3.840 2.268 1.760 2.680 . 0 0 "[ . 1 . 2]" 1
143 1 6 GLN HE21 1 28 GLN HG3 . . 4.440 4.437 4.078 4.549 0.109 8 0 "[ . 1 . 2]" 1
144 1 6 GLN HE21 1 29 LEU MD2 . . 5.500 4.459 3.760 4.645 . 0 0 "[ . 1 . 2]" 1
145 1 6 GLN HE22 1 28 GLN QB . . 4.000 2.445 2.045 2.940 . 0 0 "[ . 1 . 2]" 1
146 1 6 GLN HE22 1 28 GLN HG2 . . 4.900 2.653 2.143 3.359 . 0 0 "[ . 1 . 2]" 1
147 1 6 GLN HE22 1 28 GLN HG3 . . 4.370 4.095 3.352 4.458 0.088 6 0 "[ . 1 . 2]" 1
148 1 6 GLN HE22 1 29 LEU MD2 . . 5.500 5.166 4.859 5.543 0.043 14 0 "[ . 1 . 2]" 1
149 1 6 GLN HG2 1 29 LEU MD2 . . 4.980 4.408 4.025 4.764 . 0 0 "[ . 1 . 2]" 1
150 1 6 GLN HG3 1 29 LEU MD2 . . 5.150 3.802 3.341 4.168 . 0 0 "[ . 1 . 2]" 1
151 1 7 LYS H 1 7 LYS HB2 . . 3.780 2.665 2.357 2.827 . 0 0 "[ . 1 . 2]" 1
152 1 7 LYS H 1 7 LYS HB3 . . 3.960 2.361 2.255 2.484 . 0 0 "[ . 1 . 2]" 1
153 1 7 LYS H 1 7 LYS HD3 . . 5.310 4.819 4.680 5.046 . 0 0 "[ . 1 . 2]" 1
154 1 7 LYS H 1 7 LYS HE2 . . 5.500 5.120 4.109 5.630 0.130 16 0 "[ . 1 . 2]" 1
155 1 7 LYS H 1 7 LYS HE3 . . 4.700 4.215 3.883 4.811 0.111 3 0 "[ . 1 . 2]" 1
156 1 7 LYS H 1 7 LYS HG2 . . 4.520 4.354 4.263 4.443 . 0 0 "[ . 1 . 2]" 1
157 1 7 LYS H 1 7 LYS HG3 . . 4.800 4.496 4.364 4.560 . 0 0 "[ . 1 . 2]" 1
158 1 7 LYS H 1 8 GLU H . . 4.090 2.239 1.971 2.701 . 0 0 "[ . 1 . 2]" 1
159 1 7 LYS H 1 8 GLU HG2 . . 4.890 3.885 3.586 4.453 . 0 0 "[ . 1 . 2]" 1
160 1 7 LYS H 1 8 GLU HG3 . . 4.590 4.625 4.064 4.854 0.264 11 0 "[ . 1 . 2]" 1
161 1 7 LYS H 1 29 LEU MD1 . . 4.280 4.016 3.907 4.115 . 0 0 "[ . 1 . 2]" 1
162 1 7 LYS H 1 29 LEU MD2 . . 3.510 2.982 2.857 3.064 . 0 0 "[ . 1 . 2]" 1
163 1 7 LYS H 1 29 LEU HG . . 5.340 5.375 5.284 5.414 0.074 9 0 "[ . 1 . 2]" 1
164 1 7 LYS HA 1 7 LYS HD2 . . 4.660 4.767 4.701 4.818 0.158 7 0 "[ . 1 . 2]" 1
165 1 7 LYS HA 1 7 LYS HD3 . . 4.370 4.144 4.020 4.354 . 0 0 "[ . 1 . 2]" 1
166 1 7 LYS HA 1 7 LYS HE3 . . 4.880 4.660 4.464 4.885 0.005 9 0 "[ . 1 . 2]" 1
167 1 7 LYS HA 1 7 LYS HG2 . . 4.200 3.151 2.830 3.258 . 0 0 "[ . 1 . 2]" 1
168 1 7 LYS HA 1 9 GLN H . . 5.500 4.473 4.331 4.584 . 0 0 "[ . 1 . 2]" 1
169 1 7 LYS HA 1 10 GLY H . . 4.620 4.054 3.669 4.629 0.009 3 0 "[ . 1 . 2]" 1
170 1 7 LYS HA 1 11 ASN H . . 5.500 4.485 4.018 4.796 . 0 0 "[ . 1 . 2]" 1
171 1 7 LYS HA 1 29 LEU MD1 . . 3.590 2.180 2.021 2.602 . 0 0 "[ . 1 . 2]" 1
172 1 7 LYS HA 1 29 LEU MD2 . . 4.200 2.951 2.751 3.309 . 0 0 "[ . 1 . 2]" 1
173 1 7 LYS HB2 1 7 LYS HE2 . . 4.130 3.483 2.657 3.960 . 0 0 "[ . 1 . 2]" 1
174 1 7 LYS HB2 1 7 LYS HE3 . . 4.160 3.008 2.496 3.626 . 0 0 "[ . 1 . 2]" 1
175 1 7 LYS HB2 1 8 GLU H . . 4.060 3.872 3.625 4.158 0.098 14 0 "[ . 1 . 2]" 1
176 1 7 LYS HB2 1 29 LEU MD1 . . 5.340 2.306 2.170 2.553 . 0 0 "[ . 1 . 2]" 1
177 1 7 LYS HB2 1 29 LEU MD2 . . 4.870 2.189 2.050 2.326 . 0 0 "[ . 1 . 2]" 1
178 1 7 LYS HB3 1 7 LYS HE2 . . 5.120 2.995 2.051 3.571 . 0 0 "[ . 1 . 2]" 1
179 1 7 LYS HB3 1 7 LYS HE3 . . 3.600 2.038 1.801 2.465 . 0 0 "[ . 1 . 2]" 1
180 1 7 LYS HB3 1 8 GLU H . . 4.290 2.633 2.129 3.418 . 0 0 "[ . 1 . 2]" 1
181 1 7 LYS HB3 1 29 LEU MD1 . . 4.690 3.653 3.520 3.867 . 0 0 "[ . 1 . 2]" 1
182 1 7 LYS HB3 1 29 LEU MD2 . . 4.650 3.510 3.382 3.685 . 0 0 "[ . 1 . 2]" 1
183 1 7 LYS HD2 1 29 LEU MD1 . . 5.320 3.502 3.315 3.912 . 0 0 "[ . 1 . 2]" 1
184 1 7 LYS HD2 1 29 LEU MD2 . . 5.280 4.759 4.530 5.032 . 0 0 "[ . 1 . 2]" 1
185 1 7 LYS HD2 1 38 VAL MG2 . . 3.980 2.129 1.984 2.297 . 0 0 "[ . 1 . 2]" 1
186 1 7 LYS HD3 1 29 LEU MD1 . . 4.840 2.482 2.191 2.894 . 0 0 "[ . 1 . 2]" 1
187 1 7 LYS HD3 1 29 LEU MD2 . . 5.500 3.341 3.111 3.606 . 0 0 "[ . 1 . 2]" 1
188 1 7 LYS HD3 1 38 VAL MG2 . . 4.810 2.361 2.076 3.142 . 0 0 "[ . 1 . 2]" 1
189 1 7 LYS HE2 1 8 GLU H . . 5.500 5.368 4.745 5.604 0.104 4 0 "[ . 1 . 2]" 1
190 1 7 LYS HE2 1 38 VAL MG1 . . 5.450 4.194 3.945 5.117 . 0 0 "[ . 1 . 2]" 1
191 1 7 LYS HE2 1 38 VAL MG2 . . 4.720 3.852 3.405 4.615 . 0 0 "[ . 1 . 2]" 1
192 1 7 LYS HE3 1 7 LYS HG2 . . 4.220 2.751 2.212 3.101 . 0 0 "[ . 1 . 2]" 1
193 1 7 LYS HE3 1 8 GLU H . . 4.930 4.214 3.603 5.068 0.138 2 0 "[ . 1 . 2]" 1
194 1 7 LYS HE3 1 29 LEU MD1 . . 5.480 4.371 3.861 4.883 . 0 0 "[ . 1 . 2]" 1
195 1 7 LYS HE3 1 38 VAL MG2 . . 4.110 4.204 4.154 4.285 0.175 7 0 "[ . 1 . 2]" 1
196 1 7 LYS HG2 1 8 GLU H . . 5.070 3.833 3.237 4.693 . 0 0 "[ . 1 . 2]" 1
197 1 7 LYS HG2 1 29 LEU MD1 . . 4.750 3.661 3.496 3.975 . 0 0 "[ . 1 . 2]" 1
198 1 7 LYS HG2 1 29 LEU MD2 . . 5.440 4.665 4.498 4.840 . 0 0 "[ . 1 . 2]" 1
199 1 7 LYS HG3 1 8 GLU H . . 5.360 4.730 4.324 5.289 . 0 0 "[ . 1 . 2]" 1
200 1 7 LYS HG3 1 29 LEU MD2 . . 5.500 3.779 3.538 4.038 . 0 0 "[ . 1 . 2]" 1
201 1 8 GLU H 1 8 GLU QB . . 3.250 2.544 2.301 3.158 . 0 0 "[ . 1 . 2]" 1
202 1 8 GLU H 1 8 GLU HG2 . . 3.560 2.325 1.996 2.919 . 0 0 "[ . 1 . 2]" 1
203 1 8 GLU H 1 8 GLU HG3 . . 3.590 3.109 2.281 3.727 0.137 14 0 "[ . 1 . 2]" 1
204 1 8 GLU H 1 29 LEU MD1 . . 5.480 5.039 4.872 5.268 . 0 0 "[ . 1 . 2]" 1
205 1 8 GLU H 1 29 LEU MD2 . . 5.280 4.713 4.573 4.932 . 0 0 "[ . 1 . 2]" 1
206 1 8 GLU HA 1 8 GLU HG2 . . 3.730 3.129 2.529 3.818 0.088 19 0 "[ . 1 . 2]" 1
207 1 8 GLU HA 1 8 GLU HG3 . . 3.810 3.658 3.535 3.732 . 0 0 "[ . 1 . 2]" 1
208 1 8 GLU HA 1 11 ASN H . . 4.220 3.063 2.675 3.404 . 0 0 "[ . 1 . 2]" 1
209 1 8 GLU HA 1 11 ASN HB2 . . 3.890 2.014 1.878 2.217 . 0 0 "[ . 1 . 2]" 1
210 1 8 GLU HA 1 11 ASN HB3 . . 4.130 2.546 1.900 3.611 . 0 0 "[ . 1 . 2]" 1
211 1 8 GLU HA 1 11 ASN HD21 . . 5.070 2.082 1.712 2.501 . 0 0 "[ . 1 . 2]" 1
212 1 8 GLU HG2 1 9 GLN H . . 4.070 4.107 3.410 4.313 0.243 8 0 "[ . 1 . 2]" 1
213 1 8 GLU HG2 1 11 ASN HD21 . . 5.340 4.045 2.903 5.576 0.236 16 0 "[ . 1 . 2]" 1
214 1 8 GLU HG3 1 11 ASN HD21 . . 5.470 4.640 4.090 5.498 0.028 20 0 "[ . 1 . 2]" 1
215 1 9 GLN H 1 9 GLN HB2 . . 3.410 2.465 2.347 3.197 . 0 0 "[ . 1 . 2]" 1
216 1 9 GLN H 1 9 GLN HB3 . . 3.340 2.630 1.951 2.744 . 0 0 "[ . 1 . 2]" 1
217 1 9 GLN H 1 9 GLN QG . . 3.910 3.915 3.332 3.978 0.068 20 0 "[ . 1 . 2]" 1
218 1 9 GLN H 1 10 GLY H . . 4.070 2.707 2.563 2.905 . 0 0 "[ . 1 . 2]" 1
219 1 9 GLN H 1 10 GLY HA2 . . 5.500 5.343 5.221 5.465 . 0 0 "[ . 1 . 2]" 1
220 1 9 GLN H 1 10 GLY HA3 . . 5.350 4.981 4.802 5.154 . 0 0 "[ . 1 . 2]" 1
221 1 9 GLN H 1 11 ASN H . . 5.500 3.644 3.446 3.805 . 0 0 "[ . 1 . 2]" 1
222 1 9 GLN H 1 11 ASN HB2 . . 4.760 4.546 4.022 4.882 0.122 20 0 "[ . 1 . 2]" 1
223 1 9 GLN HA 1 9 GLN QG . . 3.200 2.389 2.266 3.466 0.266 2 0 "[ . 1 . 2]" 1
224 1 9 GLN HA 1 11 ASN H . . 5.500 4.047 3.773 4.289 . 0 0 "[ . 1 . 2]" 1
225 1 9 GLN HA 1 12 SER H . . 4.060 4.130 3.539 4.274 0.214 12 0 "[ . 1 . 2]" 1
226 1 9 GLN HA 1 13 LEU H . . 5.180 5.159 4.723 5.322 0.142 13 0 "[ . 1 . 2]" 1
227 1 9 GLN HB2 1 10 GLY H . . 3.700 3.708 3.567 3.871 0.171 2 0 "[ . 1 . 2]" 1
228 1 9 GLN HB3 1 10 GLY H . . 3.760 2.436 2.145 2.919 . 0 0 "[ . 1 . 2]" 1
229 1 9 GLN HB3 1 10 GLY HA3 . . 4.990 4.282 4.139 5.128 0.138 2 0 "[ . 1 . 2]" 1
230 1 9 GLN HB3 1 11 ASN H . . 5.020 4.560 4.347 4.768 . 0 0 "[ . 1 . 2]" 1
231 1 9 GLN HE21 1 13 LEU MD1 . . 4.850 2.712 1.961 3.388 . 0 0 "[ . 1 . 2]" 1
232 1 9 GLN HE21 1 13 LEU HG . . 5.500 3.872 2.728 5.559 0.059 2 0 "[ . 1 . 2]" 1
233 1 9 GLN HE22 1 10 GLY H . . 5.500 5.095 3.993 5.475 . 0 0 "[ . 1 . 2]" 1
234 1 9 GLN HE22 1 10 GLY HA2 . . 5.120 4.846 3.295 5.196 0.076 11 0 "[ . 1 . 2]" 1
235 1 9 GLN HE22 1 13 LEU MD1 . . 4.400 3.565 2.188 4.287 . 0 0 "[ . 1 . 2]" 1
236 1 9 GLN HE22 1 13 LEU HG . . 5.500 5.147 4.211 5.607 0.107 15 0 "[ . 1 . 2]" 1
237 1 9 GLN QG 1 10 GLY H . . 4.780 3.775 1.828 4.168 . 0 0 "[ . 1 . 2]" 1
238 1 9 GLN QG 1 12 SER H . . 5.350 4.990 4.546 5.396 0.046 2 0 "[ . 1 . 2]" 1
239 1 9 GLN QG 1 13 LEU H . . 5.500 5.011 4.446 5.521 0.021 2 0 "[ . 1 . 2]" 1
240 1 9 GLN QG 1 13 LEU MD1 . . 4.050 3.431 2.151 4.056 0.006 18 0 "[ . 1 . 2]" 1
241 1 10 GLY H 1 11 ASN H . . 4.650 2.482 2.239 2.632 . 0 0 "[ . 1 . 2]" 1
242 1 10 GLY H 1 11 ASN HA . . 5.500 5.050 4.822 5.278 . 0 0 "[ . 1 . 2]" 1
243 1 10 GLY H 1 12 SER H . . 5.500 4.366 4.159 4.530 . 0 0 "[ . 1 . 2]" 1
244 1 10 GLY H 1 13 LEU MD1 . . 5.160 4.780 3.758 5.192 0.032 5 0 "[ . 1 . 2]" 1
245 1 10 GLY H 1 22 ALA MB . . 5.500 5.189 4.926 5.457 . 0 0 "[ . 1 . 2]" 1
246 1 10 GLY HA2 1 13 LEU H . . 4.710 2.904 2.752 3.170 . 0 0 "[ . 1 . 2]" 1
247 1 10 GLY HA2 1 13 LEU HB2 . . 5.320 2.170 1.972 2.331 . 0 0 "[ . 1 . 2]" 1
248 1 10 GLY HA2 1 18 LEU MD1 . . 4.910 5.004 4.960 5.065 0.155 3 0 "[ . 1 . 2]" 1
249 1 10 GLY HA2 1 22 ALA MB . . 4.840 3.318 2.914 3.617 . 0 0 "[ . 1 . 2]" 1
250 1 10 GLY HA2 1 25 CYS HB2 . . 4.050 3.974 3.404 4.088 0.038 15 0 "[ . 1 . 2]" 1
251 1 10 GLY HA3 1 11 ASN HA . . 4.820 4.527 4.454 4.610 . 0 0 "[ . 1 . 2]" 1
252 1 10 GLY HA3 1 12 SER H . . 5.500 4.473 4.011 4.948 . 0 0 "[ . 1 . 2]" 1
253 1 10 GLY HA3 1 25 CYS HB2 . . 3.950 3.146 2.503 3.707 . 0 0 "[ . 1 . 2]" 1
254 1 11 ASN H 1 11 ASN HB2 . . 4.040 2.204 1.938 2.457 . 0 0 "[ . 1 . 2]" 1
255 1 11 ASN H 1 11 ASN HB3 . . 4.080 2.723 2.098 3.600 . 0 0 "[ . 1 . 2]" 1
256 1 11 ASN H 1 11 ASN HD21 . . 5.500 3.940 2.196 4.537 . 0 0 "[ . 1 . 2]" 1
257 1 11 ASN H 1 12 SER H . . 4.040 2.768 2.694 2.931 . 0 0 "[ . 1 . 2]" 1
258 1 11 ASN H 1 12 SER QB . . 4.950 4.938 4.561 5.003 0.053 1 0 "[ . 1 . 2]" 1
259 1 11 ASN H 1 22 ALA MB . . 5.500 4.948 4.524 5.227 . 0 0 "[ . 1 . 2]" 1
260 1 11 ASN H 1 26 TYR QE . . 5.000 3.055 2.537 3.385 . 0 0 "[ . 1 . 2]" 1
261 1 11 ASN HA 1 13 LEU H . . 5.500 4.649 3.806 4.961 . 0 0 "[ . 1 . 2]" 1
262 1 11 ASN HA 1 14 PHE H . . 4.550 4.037 3.247 4.331 . 0 0 "[ . 1 . 2]" 1
263 1 11 ASN HA 1 14 PHE HB2 . . 4.810 4.489 3.530 4.825 0.015 12 0 "[ . 1 . 2]" 1
264 1 11 ASN HA 1 14 PHE HB3 . . 4.560 3.326 2.399 3.640 . 0 0 "[ . 1 . 2]" 1
265 1 11 ASN HA 1 14 PHE QD . . 4.570 3.935 3.556 4.211 . 0 0 "[ . 1 . 2]" 1
266 1 11 ASN HA 1 15 LYS H . . 5.170 5.059 4.555 5.292 0.122 17 0 "[ . 1 . 2]" 1
267 1 11 ASN HA 1 15 LYS HD2 . . 5.500 4.300 3.481 4.807 . 0 0 "[ . 1 . 2]" 1
268 1 11 ASN HA 1 22 ALA MB . . 4.870 4.541 3.885 4.878 0.008 16 0 "[ . 1 . 2]" 1
269 1 11 ASN HA 2 8 VAL MG1 . . 4.000 2.216 2.020 2.384 . 0 0 "[ . 1 . 2]" 1
270 1 11 ASN HB2 1 12 SER H . . 4.150 3.766 2.890 4.276 0.126 13 0 "[ . 1 . 2]" 1
271 1 11 ASN HB2 2 8 VAL MG1 . . 4.500 4.055 3.228 4.657 0.157 16 0 "[ . 1 . 2]" 1
272 1 11 ASN HB3 1 12 SER H . . 4.320 3.116 2.289 3.890 . 0 0 "[ . 1 . 2]" 1
273 1 11 ASN HB3 1 15 LYS HD2 . . 5.080 4.751 3.710 5.193 0.113 6 0 "[ . 1 . 2]" 1
274 1 11 ASN HB3 2 8 VAL MG1 . . 4.500 4.373 3.315 4.618 0.118 8 0 "[ . 1 . 2]" 1
275 1 12 SER H 1 12 SER QB . . 3.140 2.697 2.223 3.136 . 0 0 "[ . 1 . 2]" 1
276 1 12 SER H 1 13 LEU H . . 4.180 2.218 1.786 2.705 . 0 0 "[ . 1 . 2]" 1
277 1 12 SER H 1 13 LEU MD1 . . 5.500 4.672 3.067 5.370 . 0 0 "[ . 1 . 2]" 1
278 1 12 SER HA 1 14 PHE H . . 5.500 4.106 3.744 4.425 . 0 0 "[ . 1 . 2]" 1
279 1 12 SER HA 1 15 LYS H . . 4.050 3.214 2.795 3.587 . 0 0 "[ . 1 . 2]" 1
280 1 12 SER HA 1 15 LYS QB . . 4.030 3.068 2.632 4.133 0.103 3 0 "[ . 1 . 2]" 1
281 1 12 SER HA 1 15 LYS HD2 . . 4.620 3.142 2.488 3.785 . 0 0 "[ . 1 . 2]" 1
282 1 12 SER HA 1 15 LYS HD3 . . 4.770 2.675 2.299 2.932 . 0 0 "[ . 1 . 2]" 1
283 1 12 SER HA 1 15 LYS QE . . 5.150 4.532 4.113 4.792 . 0 0 "[ . 1 . 2]" 1
284 1 12 SER HA 1 15 LYS HG2 . . 4.410 3.990 2.290 4.468 0.058 15 0 "[ . 1 . 2]" 1
285 1 12 SER HA 1 15 LYS HG3 . . 4.770 2.635 2.292 3.451 . 0 0 "[ . 1 . 2]" 1
286 1 12 SER QB 1 15 LYS HD3 . . 3.880 3.915 3.457 3.979 0.099 12 0 "[ . 1 . 2]" 1
287 1 13 LEU H 1 13 LEU HB3 . . 4.190 3.507 3.466 3.625 . 0 0 "[ . 1 . 2]" 1
288 1 13 LEU H 1 13 LEU MD1 . . 3.540 3.333 2.010 3.761 0.221 10 0 "[ . 1 . 2]" 1
289 1 13 LEU H 1 13 LEU HG . . 4.090 2.793 2.206 4.128 0.038 20 0 "[ . 1 . 2]" 1
290 1 13 LEU H 1 14 PHE H . . 4.350 2.625 1.938 2.901 . 0 0 "[ . 1 . 2]" 1
291 1 13 LEU H 1 14 PHE HB3 . . 5.100 4.423 3.687 4.696 . 0 0 "[ . 1 . 2]" 1
292 1 13 LEU H 1 15 LYS H . . 5.500 4.005 3.369 4.189 . 0 0 "[ . 1 . 2]" 1
293 1 13 LEU H 1 22 ALA HA . . 4.740 4.580 4.286 4.753 0.013 16 0 "[ . 1 . 2]" 1
294 1 13 LEU H 1 22 ALA MB . . 4.510 3.901 3.521 4.122 . 0 0 "[ . 1 . 2]" 1
295 1 13 LEU HA 1 13 LEU MD1 . . 2.950 3.118 2.788 3.275 0.325 1 0 "[ . 1 . 2]" 1
296 1 13 LEU HA 1 16 GLN H . . 4.640 3.598 3.503 3.761 . 0 0 "[ . 1 . 2]" 1
297 1 13 LEU HA 1 16 GLN HB2 . . 3.940 2.748 2.709 2.819 . 0 0 "[ . 1 . 2]" 1
298 1 13 LEU HA 1 16 GLN HB3 . . 4.190 4.276 4.248 4.296 0.106 8 0 "[ . 1 . 2]" 1
299 1 13 LEU HA 1 16 GLN HE21 . . 4.320 1.893 1.780 2.172 . 0 0 "[ . 1 . 2]" 1
300 1 13 LEU HA 1 16 GLN HE22 . . 4.630 3.356 3.159 3.674 . 0 0 "[ . 1 . 2]" 1
301 1 13 LEU HA 1 16 GLN HG2 . . 5.060 4.770 4.461 5.005 . 0 0 "[ . 1 . 2]" 1
302 1 13 LEU HA 1 16 GLN HG3 . . 5.100 3.314 2.858 3.662 . 0 0 "[ . 1 . 2]" 1
303 1 13 LEU HA 1 18 LEU H . . 4.480 4.443 4.074 4.535 0.055 3 0 "[ . 1 . 2]" 1
304 1 13 LEU HA 1 18 LEU MD1 . . 3.480 2.249 2.039 2.828 . 0 0 "[ . 1 . 2]" 1
305 1 13 LEU HA 1 22 ALA HA . . 5.280 5.272 5.117 5.353 0.073 14 0 "[ . 1 . 2]" 1
306 1 13 LEU HB2 1 13 LEU MD1 . . 3.520 2.440 2.082 2.639 . 0 0 "[ . 1 . 2]" 1
307 1 13 LEU HB2 1 14 PHE H . . 4.570 2.751 2.571 3.035 . 0 0 "[ . 1 . 2]" 1
308 1 13 LEU HB2 1 14 PHE HB2 . . 5.360 4.631 4.445 4.950 . 0 0 "[ . 1 . 2]" 1
309 1 13 LEU HB2 1 18 LEU MD1 . . 3.760 3.328 3.248 3.551 . 0 0 "[ . 1 . 2]" 1
310 1 13 LEU HB2 1 22 ALA H . . 4.240 4.176 3.939 4.297 0.057 15 0 "[ . 1 . 2]" 1
311 1 13 LEU HB2 1 22 ALA HA . . 4.410 2.453 2.321 2.532 . 0 0 "[ . 1 . 2]" 1
312 1 13 LEU HB3 1 13 LEU MD1 . . 2.690 2.336 2.009 3.081 0.391 3 0 "[ . 1 . 2]" 1
313 1 13 LEU HB3 1 14 PHE H . . 4.820 3.674 3.418 3.833 . 0 0 "[ . 1 . 2]" 1
314 1 13 LEU HB3 1 18 LEU MD1 . . 3.770 1.920 1.855 1.998 . 0 0 "[ . 1 . 2]" 1
315 1 13 LEU HB3 1 22 ALA H . . 4.890 3.610 3.320 4.020 . 0 0 "[ . 1 . 2]" 1
316 1 13 LEU MD1 1 14 PHE H . . 5.050 4.558 3.962 4.889 . 0 0 "[ . 1 . 2]" 1
317 1 13 LEU MD1 1 16 GLN HE21 . . 4.280 3.842 3.280 4.098 . 0 0 "[ . 1 . 2]" 1
318 1 13 LEU MD1 1 16 GLN HE22 . . 4.150 4.096 3.547 4.186 0.036 18 0 "[ . 1 . 2]" 1
319 1 13 LEU MD1 1 22 ALA H . . 5.430 4.520 3.840 5.515 0.085 2 0 "[ . 1 . 2]" 1
320 1 13 LEU MD1 1 22 ALA HA . . 4.340 3.185 2.713 3.780 . 0 0 "[ . 1 . 2]" 1
321 1 13 LEU HG 1 16 GLN HE22 . . 5.500 4.606 3.065 5.355 . 0 0 "[ . 1 . 2]" 1
322 1 13 LEU HG 1 18 LEU MD1 . . 3.890 3.436 2.047 4.010 0.120 14 0 "[ . 1 . 2]" 1
323 1 14 PHE H 1 14 PHE HB3 . . 4.030 2.094 2.020 2.165 . 0 0 "[ . 1 . 2]" 1
324 1 14 PHE H 1 14 PHE QD . . 4.440 3.949 3.853 4.022 . 0 0 "[ . 1 . 2]" 1
325 1 14 PHE H 1 15 LYS H . . 4.940 2.589 2.495 2.711 . 0 0 "[ . 1 . 2]" 1
326 1 14 PHE H 1 15 LYS QB . . 5.070 4.792 4.583 4.994 . 0 0 "[ . 1 . 2]" 1
327 1 14 PHE H 1 15 LYS HG2 . . 4.780 4.757 3.990 4.875 0.095 16 0 "[ . 1 . 2]" 1
328 1 14 PHE H 1 16 GLN H . . 5.350 4.137 3.888 4.313 . 0 0 "[ . 1 . 2]" 1
329 1 14 PHE H 1 19 TYR QD . . 5.440 5.383 5.278 5.464 0.024 1 0 "[ . 1 . 2]" 1
330 1 14 PHE H 1 22 ALA MB . . 3.690 2.475 2.304 2.607 . 0 0 "[ . 1 . 2]" 1
331 1 14 PHE HA 1 14 PHE QD . . 3.890 2.841 2.776 2.945 . 0 0 "[ . 1 . 2]" 1
332 1 14 PHE HA 1 16 GLN H . . 4.890 3.902 3.759 4.076 . 0 0 "[ . 1 . 2]" 1
333 1 14 PHE HA 1 17 GLY H . . 4.300 4.080 3.625 4.262 . 0 0 "[ . 1 . 2]" 1
334 1 14 PHE HA 1 18 LEU H . . 5.140 4.264 3.947 4.552 . 0 0 "[ . 1 . 2]" 1
335 1 14 PHE HA 1 19 TYR H . . 5.500 4.207 3.853 4.760 . 0 0 "[ . 1 . 2]" 1
336 1 14 PHE HA 1 19 TYR HA . . 4.350 2.332 2.246 2.448 . 0 0 "[ . 1 . 2]" 1
337 1 14 PHE HA 1 19 TYR QD . . 3.880 2.632 2.490 2.740 . 0 0 "[ . 1 . 2]" 1
338 1 14 PHE HA 1 19 TYR QE . . 4.790 4.261 4.139 4.352 . 0 0 "[ . 1 . 2]" 1
339 1 14 PHE HA 1 22 ALA MB . . 4.160 2.343 2.278 2.434 . 0 0 "[ . 1 . 2]" 1
340 1 14 PHE HA 1 46 ALA MB . . 5.150 4.210 4.060 4.337 . 0 0 "[ . 1 . 2]" 1
341 1 14 PHE QB 2 8 VAL MG1 . . 5.000 2.829 2.637 3.066 . 0 0 "[ . 1 . 2]" 1
342 1 14 PHE QB 2 8 VAL MG2 . . 5.000 4.488 4.130 4.795 . 0 0 "[ . 1 . 2]" 1
343 1 14 PHE HB2 1 15 LYS H . . 5.330 4.181 4.055 4.265 . 0 0 "[ . 1 . 2]" 1
344 1 14 PHE HB2 1 19 TYR HA . . 5.000 3.632 3.422 3.774 . 0 0 "[ . 1 . 2]" 1
345 1 14 PHE HB2 1 22 ALA MB . . 5.320 2.094 1.988 2.288 . 0 0 "[ . 1 . 2]" 1
346 1 14 PHE HB2 1 46 ALA MB . . 5.030 3.502 3.251 3.813 . 0 0 "[ . 1 . 2]" 1
347 1 14 PHE HB3 1 15 LYS H . . 4.340 2.928 2.718 3.078 . 0 0 "[ . 1 . 2]" 1
348 1 14 PHE HB3 1 15 LYS HA . . 4.960 4.632 4.543 4.754 . 0 0 "[ . 1 . 2]" 1
349 1 14 PHE HB3 1 16 GLN H . . 5.500 5.024 4.856 5.135 . 0 0 "[ . 1 . 2]" 1
350 1 14 PHE HB3 1 22 ALA MB . . 3.750 3.010 2.855 3.212 . 0 0 "[ . 1 . 2]" 1
351 1 14 PHE QD 1 15 LYS H . . 4.250 3.462 3.201 3.614 . 0 0 "[ . 1 . 2]" 1
352 1 14 PHE QD 1 15 LYS HA . . 3.610 3.775 3.703 3.847 0.237 14 0 "[ . 1 . 2]" 1
353 1 14 PHE QD 1 15 LYS QB . . 4.070 3.994 2.633 4.167 0.097 18 0 "[ . 1 . 2]" 1
354 1 14 PHE QD 1 15 LYS HD2 . . 4.500 3.570 3.242 3.913 . 0 0 "[ . 1 . 2]" 1
355 1 14 PHE QD 1 15 LYS HD3 . . 5.500 4.752 4.459 5.507 0.007 3 0 "[ . 1 . 2]" 1
356 1 14 PHE QD 1 15 LYS HG2 . . 4.500 2.395 2.100 4.496 . 0 0 "[ . 1 . 2]" 1
357 1 14 PHE QD 1 15 LYS HG3 . . 5.400 2.967 2.492 5.455 0.055 3 0 "[ . 1 . 2]" 1
358 1 14 PHE QD 1 19 TYR QD . . 3.840 2.361 2.109 2.789 . 0 0 "[ . 1 . 2]" 1
359 1 14 PHE QD 1 19 TYR QE . . 4.510 4.140 3.825 4.502 . 0 0 "[ . 1 . 2]" 1
360 1 14 PHE QD 1 22 ALA MB . . 3.860 3.445 3.253 3.565 . 0 0 "[ . 1 . 2]" 1
361 1 14 PHE QD 1 46 ALA H . . 4.410 4.386 4.281 4.428 0.018 7 0 "[ . 1 . 2]" 1
362 1 14 PHE QD 1 46 ALA HA . . 3.490 2.704 2.418 2.859 . 0 0 "[ . 1 . 2]" 1
363 1 14 PHE QD 1 46 ALA MB . . 3.380 2.666 2.334 2.894 . 0 0 "[ . 1 . 2]" 1
364 1 14 PHE QD 2 7 GLU HA . . 4.500 4.489 3.781 4.598 0.098 2 0 "[ . 1 . 2]" 1
365 1 14 PHE QD 2 8 VAL HA . . 5.000 5.096 5.006 5.205 0.205 13 0 "[ . 1 . 2]" 1
366 1 14 PHE QD 2 8 VAL HB . . 5.000 4.795 4.658 4.981 . 0 0 "[ . 1 . 2]" 1
367 1 14 PHE QD 2 8 VAL MG1 . . 4.500 2.347 2.236 2.426 . 0 0 "[ . 1 . 2]" 1
368 1 14 PHE QD 2 8 VAL MG2 . . 5.000 4.412 4.092 4.571 . 0 0 "[ . 1 . 2]" 1
369 1 14 PHE QE 1 45 MET ME . . 3.980 3.764 3.425 3.979 . 0 0 "[ . 1 . 2]" 1
370 1 14 PHE QE 1 49 LYS H . . 5.350 4.036 3.871 4.166 . 0 0 "[ . 1 . 2]" 1
371 1 14 PHE QE 1 49 LYS HB2 . . 4.790 2.888 2.697 3.672 . 0 0 "[ . 1 . 2]" 1
372 1 14 PHE QE 1 49 LYS HB3 . . 3.980 4.029 3.972 4.172 0.192 14 0 "[ . 1 . 2]" 1
373 1 14 PHE QE 1 49 LYS HD2 . . 4.650 4.638 4.266 4.711 0.061 19 0 "[ . 1 . 2]" 1
374 1 14 PHE QE 1 49 LYS HD3 . . 4.660 4.541 4.119 4.662 0.002 20 0 "[ . 1 . 2]" 1
375 1 14 PHE QE 1 49 LYS HE2 . . 4.080 2.563 2.462 2.668 . 0 0 "[ . 1 . 2]" 1
376 1 14 PHE QE 1 49 LYS HE3 . . 4.080 2.353 2.250 2.851 . 0 0 "[ . 1 . 2]" 1
377 1 14 PHE QE 1 49 LYS HG2 . . 4.420 3.344 2.272 3.500 . 0 0 "[ . 1 . 2]" 1
378 1 14 PHE QE 2 7 GLU HA . . 4.500 3.022 2.136 3.817 . 0 0 "[ . 1 . 2]" 1
379 1 14 PHE QE 2 8 VAL HA . . 5.000 4.419 4.278 4.617 . 0 0 "[ . 1 . 2]" 1
380 1 14 PHE QE 2 8 VAL HB . . 5.000 5.120 5.057 5.188 0.188 5 0 "[ . 1 . 2]" 1
381 1 14 PHE QE 2 8 VAL MG1 . . 4.500 2.658 2.501 2.740 . 0 0 "[ . 1 . 2]" 1
382 1 14 PHE QE 2 8 VAL MG2 . . 5.000 4.957 4.441 5.080 0.080 12 0 "[ . 1 . 2]" 1
383 1 15 LYS H 1 15 LYS QB . . 2.940 2.564 2.510 2.647 . 0 0 "[ . 1 . 2]" 1
384 1 15 LYS H 1 15 LYS HD2 . . 4.070 4.111 3.337 4.231 0.161 12 0 "[ . 1 . 2]" 1
385 1 15 LYS H 1 15 LYS HD3 . . 4.160 4.058 3.945 4.279 0.119 3 0 "[ . 1 . 2]" 1
386 1 15 LYS H 1 15 LYS QE . . 5.300 4.545 4.288 4.628 . 0 0 "[ . 1 . 2]" 1
387 1 15 LYS H 1 15 LYS HG2 . . 3.640 2.886 1.945 3.097 . 0 0 "[ . 1 . 2]" 1
388 1 15 LYS H 1 15 LYS HG3 . . 3.960 2.035 1.831 3.451 . 0 0 "[ . 1 . 2]" 1
389 1 15 LYS H 1 16 GLN H . . 4.080 2.579 2.481 2.741 . 0 0 "[ . 1 . 2]" 1
390 1 15 LYS H 1 17 GLY H . . 5.220 4.412 4.230 4.587 . 0 0 "[ . 1 . 2]" 1
391 1 15 LYS H 1 18 LEU H . . 5.500 5.461 5.356 5.527 0.027 12 0 "[ . 1 . 2]" 1
392 1 15 LYS H 1 22 ALA MB . . 5.500 4.352 4.269 4.436 . 0 0 "[ . 1 . 2]" 1
393 1 15 LYS HA 1 15 LYS QB . . 2.750 2.276 2.140 2.311 . 0 0 "[ . 1 . 2]" 1
394 1 15 LYS HA 1 15 LYS HG2 . . 3.700 2.717 2.486 3.667 . 0 0 "[ . 1 . 2]" 1
395 1 15 LYS HA 1 15 LYS HG3 . . 3.890 3.345 3.231 3.902 0.012 20 0 "[ . 1 . 2]" 1
396 1 15 LYS HA 1 17 GLY H . . 4.500 4.171 3.748 4.351 . 0 0 "[ . 1 . 2]" 1
397 1 15 LYS QB 1 15 LYS HD2 . . 3.180 3.200 2.473 3.295 0.115 9 0 "[ . 1 . 2]" 1
398 1 15 LYS QB 1 15 LYS HD3 . . 3.710 2.414 2.250 3.295 . 0 0 "[ . 1 . 2]" 1
399 1 15 LYS QB 1 15 LYS QE . . 4.530 2.063 1.925 2.171 . 0 0 "[ . 1 . 2]" 1
400 1 15 LYS QB 1 16 GLN H . . 5.060 3.478 3.137 4.027 . 0 0 "[ . 1 . 2]" 1
401 1 15 LYS QB 1 16 GLN HG2 . . 4.920 4.369 3.891 4.979 0.059 20 0 "[ . 1 . 2]" 1
402 1 15 LYS QB 1 17 GLY H . . 4.990 5.062 5.000 5.162 0.172 20 0 "[ . 1 . 2]" 1
403 1 15 LYS QD 2 8 VAL MG1 . . 4.500 3.606 3.254 4.112 . 0 0 "[ . 1 . 2]" 1
404 1 15 LYS QE 2 8 VAL MG1 . . 4.000 4.048 4.023 4.103 0.103 20 0 "[ . 1 . 2]" 1
405 1 15 LYS HG2 1 16 GLN H . . 5.300 4.854 3.599 5.061 . 0 0 "[ . 1 . 2]" 1
406 1 15 LYS HG3 1 16 GLN H . . 4.890 4.284 4.132 4.466 . 0 0 "[ . 1 . 2]" 1
407 1 16 GLN H 1 16 GLN HB2 . . 3.640 2.288 2.194 2.440 . 0 0 "[ . 1 . 2]" 1
408 1 16 GLN H 1 16 GLN HB3 . . 3.500 3.551 3.489 3.648 0.148 3 0 "[ . 1 . 2]" 1
409 1 16 GLN H 1 16 GLN HE21 . . 5.190 4.009 3.804 4.364 . 0 0 "[ . 1 . 2]" 1
410 1 16 GLN H 1 16 GLN HG2 . . 3.720 3.816 3.746 3.897 0.177 2 0 "[ . 1 . 2]" 1
411 1 16 GLN H 1 16 GLN HG3 . . 4.170 2.891 2.780 2.968 . 0 0 "[ . 1 . 2]" 1
412 1 16 GLN H 1 17 GLY H . . 3.610 2.223 2.036 2.375 . 0 0 "[ . 1 . 2]" 1
413 1 16 GLN H 1 17 GLY HA2 . . 4.690 4.774 4.588 4.829 0.139 2 0 "[ . 1 . 2]" 1
414 1 16 GLN H 1 18 LEU H . . 4.580 3.402 3.247 3.721 . 0 0 "[ . 1 . 2]" 1
415 1 16 GLN H 1 18 LEU MD1 . . 5.500 4.108 3.648 5.007 . 0 0 "[ . 1 . 2]" 1
416 1 16 GLN H 1 18 LEU HG . . 5.500 4.099 3.700 4.408 . 0 0 "[ . 1 . 2]" 1
417 1 16 GLN HA 1 16 GLN HE21 . . 4.780 4.778 4.636 4.816 0.036 9 0 "[ . 1 . 2]" 1
418 1 16 GLN HA 1 16 GLN HG2 . . 3.490 2.265 2.237 2.387 . 0 0 "[ . 1 . 2]" 1
419 1 16 GLN HA 1 16 GLN HG3 . . 3.360 3.015 2.866 3.163 . 0 0 "[ . 1 . 2]" 1
420 1 16 GLN HA 1 17 GLY HA2 . . 5.150 4.927 4.908 4.970 . 0 0 "[ . 1 . 2]" 1
421 1 16 GLN HA 1 17 GLY HA3 . . 5.280 4.596 4.564 4.651 . 0 0 "[ . 1 . 2]" 1
422 1 16 GLN HA 1 18 LEU H . . 5.430 4.803 4.678 4.904 . 0 0 "[ . 1 . 2]" 1
423 1 16 GLN HA 1 18 LEU HG . . 5.440 5.084 4.958 5.436 . 0 0 "[ . 1 . 2]" 1
424 1 16 GLN HB2 1 16 GLN HE22 . . 4.970 3.734 3.554 3.788 . 0 0 "[ . 1 . 2]" 1
425 1 16 GLN HB2 1 17 GLY H . . 4.690 3.142 2.637 3.481 . 0 0 "[ . 1 . 2]" 1
426 1 16 GLN HB2 1 18 LEU H . . 3.860 3.049 2.870 3.148 . 0 0 "[ . 1 . 2]" 1
427 1 16 GLN HB2 1 18 LEU HB3 . . 5.330 5.375 5.269 5.489 0.159 12 0 "[ . 1 . 2]" 1
428 1 16 GLN HB2 1 18 LEU MD1 . . 3.700 2.911 2.506 3.618 . 0 0 "[ . 1 . 2]" 1
429 1 16 GLN HB2 1 18 LEU MD2 . . 3.990 3.474 2.649 3.953 . 0 0 "[ . 1 . 2]" 1
430 1 16 GLN HB2 1 18 LEU HG . . 4.230 2.662 2.502 2.867 . 0 0 "[ . 1 . 2]" 1
431 1 16 GLN HB3 1 16 GLN HE21 . . 4.660 3.157 2.756 3.590 . 0 0 "[ . 1 . 2]" 1
432 1 16 GLN HB3 1 16 GLN HE22 . . 5.110 3.914 3.722 4.137 . 0 0 "[ . 1 . 2]" 1
433 1 16 GLN HB3 1 17 GLY H . . 4.270 3.880 3.454 4.210 . 0 0 "[ . 1 . 2]" 1
434 1 16 GLN HB3 1 17 GLY HA3 . . 5.350 4.263 4.107 4.555 . 0 0 "[ . 1 . 2]" 1
435 1 16 GLN HB3 1 18 LEU H . . 3.950 3.886 3.626 3.988 0.038 15 0 "[ . 1 . 2]" 1
436 1 16 GLN HB3 1 18 LEU HG . . 4.210 3.274 3.075 3.913 . 0 0 "[ . 1 . 2]" 1
437 1 16 GLN HE21 1 18 LEU MD1 . . 4.770 2.539 2.128 3.041 . 0 0 "[ . 1 . 2]" 1
438 1 16 GLN HE22 1 18 LEU MD1 . . 4.660 3.355 2.579 3.738 . 0 0 "[ . 1 . 2]" 1
439 1 16 GLN HE22 1 18 LEU MD2 . . 3.750 3.735 3.342 3.795 0.045 1 0 "[ . 1 . 2]" 1
440 1 16 GLN HG2 1 17 GLY H . . 5.170 5.109 5.020 5.155 . 0 0 "[ . 1 . 2]" 1
441 1 16 GLN HG2 1 18 LEU HG . . 5.500 5.473 5.224 5.645 0.145 14 0 "[ . 1 . 2]" 1
442 1 16 GLN HG3 1 17 GLY H . . 5.320 4.736 4.566 4.810 . 0 0 "[ . 1 . 2]" 1
443 1 16 GLN HG3 1 18 LEU HG . . 5.430 5.048 4.707 5.277 . 0 0 "[ . 1 . 2]" 1
444 1 17 GLY H 1 18 LEU HA . . 5.210 4.703 4.572 4.948 . 0 0 "[ . 1 . 2]" 1
445 1 17 GLY H 1 18 LEU MD1 . . 5.430 4.303 3.792 5.308 . 0 0 "[ . 1 . 2]" 1
446 1 17 GLY H 1 18 LEU HG . . 5.170 3.577 3.367 3.907 . 0 0 "[ . 1 . 2]" 1
447 1 17 GLY H 1 19 TYR H . . 5.500 4.278 4.027 5.549 0.049 14 0 "[ . 1 . 2]" 1
448 1 17 GLY H 1 19 TYR QD . . 4.960 4.135 4.022 4.259 . 0 0 "[ . 1 . 2]" 1
449 1 17 GLY H 1 19 TYR QE . . 5.190 3.476 3.192 3.897 . 0 0 "[ . 1 . 2]" 1
450 1 17 GLY HA2 1 18 LEU HA . . 5.290 4.634 4.601 4.824 . 0 0 "[ . 1 . 2]" 1
451 1 17 GLY HA2 1 19 TYR QE . . 5.020 3.326 2.828 3.387 . 0 0 "[ . 1 . 2]" 1
452 1 17 GLY HA3 1 18 LEU HA . . 4.700 4.176 4.080 4.289 . 0 0 "[ . 1 . 2]" 1
453 1 17 GLY HA3 1 18 LEU HB3 . . 5.060 4.571 4.390 6.012 0.952 1 1 "[+ . 1 . 2]" 1
454 1 17 GLY HA3 1 18 LEU MD2 . . 5.050 4.169 2.880 4.611 . 0 0 "[ . 1 . 2]" 1
455 1 17 GLY HA3 1 18 LEU HG . . 5.500 3.802 3.531 4.395 . 0 0 "[ . 1 . 2]" 1
456 1 17 GLY HA3 1 19 TYR QE . . 4.650 4.665 4.256 4.701 0.051 3 0 "[ . 1 . 2]" 1
457 1 18 LEU H 1 18 LEU HB2 . . 3.810 3.500 2.458 3.613 . 0 0 "[ . 1 . 2]" 1
458 1 18 LEU H 1 18 LEU MD1 . . 3.720 2.905 2.404 3.569 . 0 0 "[ . 1 . 2]" 1
459 1 18 LEU H 1 18 LEU HG . . 3.670 1.837 1.772 2.040 . 0 0 "[ . 1 . 2]" 1
460 1 18 LEU H 1 19 TYR H . . 4.380 3.396 3.227 4.394 0.014 14 0 "[ . 1 . 2]" 1
461 1 18 LEU H 1 19 TYR QD . . 5.500 4.585 4.447 4.760 . 0 0 "[ . 1 . 2]" 1
462 1 18 LEU H 1 19 TYR QE . . 5.500 4.782 4.466 4.962 . 0 0 "[ . 1 . 2]" 1
463 1 18 LEU HA 1 18 LEU MD1 . . 4.160 3.795 3.658 4.111 . 0 0 "[ . 1 . 2]" 1
464 1 18 LEU HA 1 18 LEU HG . . 3.890 3.593 3.493 3.671 . 0 0 "[ . 1 . 2]" 1
465 1 18 LEU HA 1 19 TYR H . . 3.360 2.328 2.195 2.853 . 0 0 "[ . 1 . 2]" 1
466 1 18 LEU HA 1 19 TYR QD . . 4.680 4.359 4.090 4.797 0.117 1 0 "[ . 1 . 2]" 1
467 1 18 LEU HA 1 20 ARG H . . 4.680 3.409 3.301 4.098 . 0 0 "[ . 1 . 2]" 1
468 1 18 LEU HA 1 21 GLU H . . 5.380 3.876 3.775 4.209 . 0 0 "[ . 1 . 2]" 1
469 1 18 LEU HA 1 21 GLU HB2 . . 4.990 4.440 4.194 4.567 . 0 0 "[ . 1 . 2]" 1
470 1 18 LEU HA 1 50 LEU MD2 . . 5.500 4.549 4.272 5.370 . 0 0 "[ . 1 . 2]" 1
471 1 18 LEU HB2 1 18 LEU MD1 . . 3.060 2.182 2.130 2.248 . 0 0 "[ . 1 . 2]" 1
472 1 18 LEU HB2 1 19 TYR H . . 4.290 4.208 3.492 4.278 . 0 0 "[ . 1 . 2]" 1
473 1 18 LEU HB2 1 20 ARG H . . 4.800 4.255 3.947 5.230 0.430 1 0 "[ . 1 . 2]" 1
474 1 18 LEU HB2 1 21 GLU H . . 4.190 3.011 2.892 4.120 . 0 0 "[ . 1 . 2]" 1
475 1 18 LEU HB2 1 21 GLU HB2 . . 4.180 2.207 2.030 2.796 . 0 0 "[ . 1 . 2]" 1
476 1 18 LEU HB2 1 21 GLU HG3 . . 4.660 2.610 2.377 4.133 . 0 0 "[ . 1 . 2]" 1
477 1 18 LEU HB3 1 18 LEU MD2 . . 3.630 2.246 2.190 2.491 . 0 0 "[ . 1 . 2]" 1
478 1 18 LEU HB3 1 19 TYR H . . 4.610 4.350 4.117 4.399 . 0 0 "[ . 1 . 2]" 1
479 1 18 LEU MD1 1 21 GLU H . . 4.680 3.820 3.602 4.495 . 0 0 "[ . 1 . 2]" 1
480 1 18 LEU MD1 1 21 GLU HB2 . . 4.060 2.013 1.871 2.396 . 0 0 "[ . 1 . 2]" 1
481 1 18 LEU MD1 1 21 GLU HG2 . . 3.980 4.031 3.871 4.198 0.218 1 0 "[ . 1 . 2]" 1
482 1 18 LEU MD1 1 21 GLU HG3 . . 4.160 3.460 3.227 3.665 . 0 0 "[ . 1 . 2]" 1
483 1 18 LEU MD1 1 22 ALA H . . 4.400 3.604 3.331 4.298 . 0 0 "[ . 1 . 2]" 1
484 1 18 LEU MD1 1 22 ALA HA . . 4.300 4.271 4.065 4.458 0.158 1 0 "[ . 1 . 2]" 1
485 1 18 LEU MD1 1 22 ALA MB . . 3.940 3.316 2.870 3.905 . 0 0 "[ . 1 . 2]" 1
486 1 18 LEU HG 1 19 TYR H . . 4.820 4.788 4.641 5.004 0.184 1 0 "[ . 1 . 2]" 1
487 1 19 TYR H 1 19 TYR HB2 . . 4.040 2.584 2.253 2.825 . 0 0 "[ . 1 . 2]" 1
488 1 19 TYR H 1 19 TYR HB3 . . 3.940 3.472 3.451 3.531 . 0 0 "[ . 1 . 2]" 1
489 1 19 TYR H 1 19 TYR QD . . 3.710 2.793 2.724 2.996 . 0 0 "[ . 1 . 2]" 1
490 1 19 TYR H 1 19 TYR QE . . 5.360 3.932 3.838 4.439 . 0 0 "[ . 1 . 2]" 1
491 1 19 TYR H 1 20 ARG H . . 4.030 2.898 1.906 3.328 . 0 0 "[ . 1 . 2]" 1
492 1 19 TYR H 1 20 ARG HB2 . . 5.410 4.867 3.604 5.315 . 0 0 "[ . 1 . 2]" 1
493 1 19 TYR H 1 21 GLU H . . 5.180 4.398 3.533 4.664 . 0 0 "[ . 1 . 2]" 1
494 1 19 TYR H 1 22 ALA H . . 5.220 4.766 4.194 4.927 . 0 0 "[ . 1 . 2]" 1
495 1 19 TYR H 1 50 LEU MD2 . . 3.830 3.653 3.507 3.883 0.053 1 0 "[ . 1 . 2]" 1
496 1 19 TYR H 1 50 LEU HG . . 4.660 4.735 4.666 5.222 0.562 14 1 "[ . 1 +. 2]" 1
497 1 19 TYR HA 1 19 TYR QD . . 3.390 2.256 2.171 2.401 . 0 0 "[ . 1 . 2]" 1
498 1 19 TYR HA 1 19 TYR QE . . 4.780 4.485 4.452 4.600 . 0 0 "[ . 1 . 2]" 1
499 1 19 TYR HA 1 22 ALA H . . 4.450 3.577 3.458 3.660 . 0 0 "[ . 1 . 2]" 1
500 1 19 TYR HA 1 22 ALA MB . . 3.220 2.557 2.288 2.652 . 0 0 "[ . 1 . 2]" 1
501 1 19 TYR HA 1 46 ALA MB . . 5.060 3.067 2.884 3.150 . 0 0 "[ . 1 . 2]" 1
502 1 19 TYR HA 1 50 LEU MD2 . . 4.930 4.588 3.821 4.685 . 0 0 "[ . 1 . 2]" 1
503 1 19 TYR HB2 1 20 ARG H . . 3.930 2.605 2.377 2.700 . 0 0 "[ . 1 . 2]" 1
504 1 19 TYR HB2 1 23 VAL MG1 . . 4.030 4.116 3.990 4.191 0.161 11 0 "[ . 1 . 2]" 1
505 1 19 TYR HB2 1 46 ALA MB . . 4.110 3.436 3.283 3.547 . 0 0 "[ . 1 . 2]" 1
506 1 19 TYR HB2 1 49 LYS HB2 . . 5.350 4.771 3.367 5.077 . 0 0 "[ . 1 . 2]" 1
507 1 19 TYR HB2 1 50 LEU H . . 4.960 4.827 4.317 4.973 0.013 2 0 "[ . 1 . 2]" 1
508 1 19 TYR HB2 1 50 LEU MD1 . . 3.260 2.670 1.974 2.796 . 0 0 "[ . 1 . 2]" 1
509 1 19 TYR HB2 1 50 LEU MD2 . . 3.710 2.045 1.808 2.091 . 0 0 "[ . 1 . 2]" 1
510 1 19 TYR HB2 1 50 LEU HG . . 4.080 2.273 2.077 3.525 . 0 0 "[ . 1 . 2]" 1
511 1 19 TYR HB3 1 20 ARG H . . 4.390 3.865 3.678 3.935 . 0 0 "[ . 1 . 2]" 1
512 1 19 TYR HB3 1 20 ARG HA . . 5.390 4.628 4.561 4.771 . 0 0 "[ . 1 . 2]" 1
513 1 19 TYR HB3 1 46 ALA MB . . 5.460 2.225 2.149 2.329 . 0 0 "[ . 1 . 2]" 1
514 1 19 TYR HB3 1 50 LEU H . . 5.230 4.487 4.262 4.602 . 0 0 "[ . 1 . 2]" 1
515 1 19 TYR HB3 1 50 LEU HA . . 5.020 5.115 5.048 5.239 0.219 14 0 "[ . 1 . 2]" 1
516 1 19 TYR HB3 1 50 LEU MD1 . . 4.780 3.148 2.987 3.310 . 0 0 "[ . 1 . 2]" 1
517 1 19 TYR HB3 1 50 LEU MD2 . . 3.350 3.352 1.984 3.448 0.098 11 0 "[ . 1 . 2]" 1
518 1 19 TYR HB3 1 50 LEU HG . . 4.440 2.636 2.434 4.350 . 0 0 "[ . 1 . 2]" 1
519 1 19 TYR QD 1 20 ARG H . . 4.580 4.103 3.932 4.247 . 0 0 "[ . 1 . 2]" 1
520 1 19 TYR QD 1 22 ALA MB . . 3.890 3.989 3.951 4.022 0.132 4 0 "[ . 1 . 2]" 1
521 1 19 TYR QD 1 46 ALA HA . . 4.500 3.705 3.512 4.023 . 0 0 "[ . 1 . 2]" 1
522 1 19 TYR QD 1 46 ALA MB . . 3.840 3.754 3.615 3.865 0.025 11 0 "[ . 1 . 2]" 1
523 1 19 TYR QD 1 49 LYS H . . 5.500 5.121 4.753 5.244 . 0 0 "[ . 1 . 2]" 1
524 1 19 TYR QD 1 49 LYS HB2 . . 4.390 3.707 2.865 3.955 . 0 0 "[ . 1 . 2]" 1
525 1 19 TYR QD 1 49 LYS HB3 . . 4.750 2.937 2.870 3.239 . 0 0 "[ . 1 . 2]" 1
526 1 19 TYR QD 1 49 LYS HE3 . . 4.490 4.531 4.508 4.562 0.072 15 0 "[ . 1 . 2]" 1
527 1 19 TYR QD 1 49 LYS HG2 . . 5.240 3.638 3.414 4.378 . 0 0 "[ . 1 . 2]" 1
528 1 19 TYR QD 1 50 LEU H . . 5.290 4.573 3.815 4.688 . 0 0 "[ . 1 . 2]" 1
529 1 19 TYR QD 1 50 LEU HA . . 4.810 3.360 2.800 3.503 . 0 0 "[ . 1 . 2]" 1
530 1 19 TYR QD 1 50 LEU MD1 . . 4.200 3.978 1.979 4.178 . 0 0 "[ . 1 . 2]" 1
531 1 19 TYR QD 1 50 LEU MD2 . . 3.440 2.241 2.143 2.336 . 0 0 "[ . 1 . 2]" 1
532 1 19 TYR QD 1 50 LEU HG . . 4.110 3.043 2.862 4.326 0.216 14 0 "[ . 1 . 2]" 1
533 1 19 TYR QE 1 49 LYS HA . . 5.380 4.576 4.308 4.673 . 0 0 "[ . 1 . 2]" 1
534 1 19 TYR QE 1 49 LYS HB3 . . 4.630 3.289 2.958 3.534 . 0 0 "[ . 1 . 2]" 1
535 1 19 TYR QE 1 49 LYS HE3 . . 5.020 4.074 3.749 4.293 . 0 0 "[ . 1 . 2]" 1
536 1 19 TYR QE 1 49 LYS HG2 . . 4.910 2.913 2.541 4.955 0.045 14 0 "[ . 1 . 2]" 1
537 1 19 TYR QE 1 50 LEU MD2 . . 5.040 4.075 3.963 4.180 . 0 0 "[ . 1 . 2]" 1
538 1 20 ARG H 1 20 ARG HB2 . . 3.480 2.190 1.993 2.535 . 0 0 "[ . 1 . 2]" 1
539 1 20 ARG H 1 20 ARG HB3 . . 3.390 2.746 2.190 3.163 . 0 0 "[ . 1 . 2]" 1
540 1 20 ARG H 1 20 ARG QD . . 4.360 4.291 4.214 4.391 0.031 11 0 "[ . 1 . 2]" 1
541 1 20 ARG H 1 20 ARG HG2 . . 4.260 4.101 3.657 4.402 0.142 11 0 "[ . 1 . 2]" 1
542 1 20 ARG H 1 20 ARG QG . . 3.700 3.778 3.445 3.841 0.141 16 0 "[ . 1 . 2]" 1
543 1 20 ARG H 1 21 GLU H . . 3.860 2.502 2.380 2.743 . 0 0 "[ . 1 . 2]" 1
544 1 20 ARG H 1 21 GLU HG2 . . 5.500 4.983 3.946 5.541 0.041 5 0 "[ . 1 . 2]" 1
545 1 20 ARG H 1 21 GLU HG3 . . 5.500 4.593 4.055 5.530 0.030 17 0 "[ . 1 . 2]" 1
546 1 20 ARG H 1 22 ALA H . . 4.650 3.690 3.423 3.840 . 0 0 "[ . 1 . 2]" 1
547 1 20 ARG H 1 23 VAL H . . 5.500 4.598 4.335 4.774 . 0 0 "[ . 1 . 2]" 1
548 1 20 ARG H 1 23 VAL MG1 . . 5.240 3.906 3.805 4.016 . 0 0 "[ . 1 . 2]" 1
549 1 20 ARG H 1 50 LEU MD1 . . 3.980 3.127 2.192 3.397 . 0 0 "[ . 1 . 2]" 1
550 1 20 ARG H 1 50 LEU MD2 . . 3.490 2.703 2.307 3.533 0.043 14 0 "[ . 1 . 2]" 1
551 1 20 ARG HA 1 20 ARG QD . . 3.250 2.069 1.976 2.223 . 0 0 "[ . 1 . 2]" 1
552 1 20 ARG HA 1 20 ARG HG2 . . 3.410 2.791 2.572 3.655 0.245 11 0 "[ . 1 . 2]" 1
553 1 20 ARG HA 1 20 ARG QG . . 3.770 2.660 2.525 3.150 . 0 0 "[ . 1 . 2]" 1
554 1 20 ARG HA 1 20 ARG HG3 . . 4.020 3.611 3.241 3.676 . 0 0 "[ . 1 . 2]" 1
555 1 20 ARG HA 1 23 VAL H . . 3.950 2.957 2.646 3.154 . 0 0 "[ . 1 . 2]" 1
556 1 20 ARG HA 1 23 VAL HB . . 3.610 4.444 4.173 4.557 0.947 3 20 [**+**********-******] 1
557 1 20 ARG HA 1 23 VAL MG1 . . 4.160 1.827 1.764 2.171 . 0 0 "[ . 1 . 2]" 1
558 1 20 ARG HA 1 24 HIS H . . 4.660 3.919 3.596 4.194 . 0 0 "[ . 1 . 2]" 1
559 1 20 ARG HA 1 50 LEU MD1 . . 3.810 2.588 2.425 3.153 . 0 0 "[ . 1 . 2]" 1
560 1 20 ARG HA 1 50 LEU MD2 . . 4.860 3.865 3.716 4.061 . 0 0 "[ . 1 . 2]" 1
561 1 20 ARG HB2 1 20 ARG QD . . 3.390 3.264 2.665 3.378 . 0 0 "[ . 1 . 2]" 1
562 1 20 ARG HB2 1 21 GLU H . . 3.890 3.501 2.918 3.988 0.098 16 0 "[ . 1 . 2]" 1
563 1 20 ARG HB2 1 50 LEU MD1 . . 4.890 2.724 2.143 3.078 . 0 0 "[ . 1 . 2]" 1
564 1 20 ARG HB2 1 50 LEU MD2 . . 5.010 2.620 2.383 4.152 . 0 0 "[ . 1 . 2]" 1
565 1 20 ARG HB3 1 20 ARG QD . . 3.660 2.748 2.336 3.504 . 0 0 "[ . 1 . 2]" 1
566 1 20 ARG HB3 1 21 GLU H . . 3.810 2.571 2.506 2.758 . 0 0 "[ . 1 . 2]" 1
567 1 20 ARG HB3 1 50 LEU MD1 . . 4.790 4.023 3.543 4.357 . 0 0 "[ . 1 . 2]" 1
568 1 20 ARG HB3 1 50 LEU MD2 . . 5.260 4.011 3.242 5.305 0.045 14 0 "[ . 1 . 2]" 1
569 1 20 ARG QD 1 21 GLU H . . 4.440 4.074 3.911 4.459 0.019 19 0 "[ . 1 . 2]" 1
570 1 20 ARG QD 1 22 ALA H . . 5.500 4.788 4.329 5.166 . 0 0 "[ . 1 . 2]" 1
571 1 20 ARG QD 1 23 VAL H . . 4.660 3.769 3.665 3.981 . 0 0 "[ . 1 . 2]" 1
572 1 20 ARG QD 1 23 VAL HB . . 4.150 4.302 4.201 4.394 0.244 6 0 "[ . 1 . 2]" 1
573 1 20 ARG QD 1 23 VAL MG1 . . 4.940 2.868 2.598 3.359 . 0 0 "[ . 1 . 2]" 1
574 1 20 ARG QD 1 23 VAL MG2 . . 5.390 1.846 1.775 1.971 . 0 0 "[ . 1 . 2]" 1
575 1 20 ARG QD 1 24 HIS H . . 5.200 3.417 2.853 4.073 . 0 0 "[ . 1 . 2]" 1
576 1 20 ARG QD 1 24 HIS HE1 . . 5.500 5.596 5.559 5.615 0.115 10 0 "[ . 1 . 2]" 1
577 1 20 ARG QD 1 50 LEU MD1 . . 4.000 3.521 2.938 3.877 . 0 0 "[ . 1 . 2]" 1
578 1 20 ARG QD 1 50 LEU MD2 . . 4.700 4.681 4.312 4.753 0.053 1 0 "[ . 1 . 2]" 1
579 1 20 ARG QG 1 21 GLU H . . 4.320 4.283 3.518 4.400 0.080 15 0 "[ . 1 . 2]" 1
580 1 20 ARG QG 1 50 LEU MD2 . . 4.430 3.399 3.210 3.948 . 0 0 "[ . 1 . 2]" 1
581 1 20 ARG HG2 1 50 LEU MD1 . . 4.700 2.710 2.206 3.907 . 0 0 "[ . 1 . 2]" 1
582 1 20 ARG HG2 1 50 LEU MD2 . . 4.690 3.551 3.321 4.160 . 0 0 "[ . 1 . 2]" 1
583 1 20 ARG HG3 1 21 GLU H . . 4.740 4.672 3.627 4.914 0.174 14 0 "[ . 1 . 2]" 1
584 1 20 ARG HG3 1 50 LEU MD1 . . 4.800 3.951 2.876 4.531 . 0 0 "[ . 1 . 2]" 1
585 1 20 ARG HG3 1 50 LEU MD2 . . 4.860 4.355 4.070 4.910 0.050 11 0 "[ . 1 . 2]" 1
586 1 21 GLU H 1 21 GLU HB2 . . 3.940 2.522 2.466 2.763 . 0 0 "[ . 1 . 2]" 1
587 1 21 GLU H 1 21 GLU HB3 . . 4.090 3.601 3.581 3.649 . 0 0 "[ . 1 . 2]" 1
588 1 21 GLU H 1 21 GLU HG2 . . 3.840 2.801 1.947 3.313 . 0 0 "[ . 1 . 2]" 1
589 1 21 GLU H 1 21 GLU HG3 . . 3.940 2.566 1.988 3.512 . 0 0 "[ . 1 . 2]" 1
590 1 21 GLU H 1 22 ALA H . . 3.900 2.566 2.434 2.616 . 0 0 "[ . 1 . 2]" 1
591 1 21 GLU H 1 22 ALA HA . . 5.420 5.216 5.139 5.264 . 0 0 "[ . 1 . 2]" 1
592 1 21 GLU H 1 22 ALA MB . . 4.150 4.198 4.117 4.223 0.073 8 0 "[ . 1 . 2]" 1
593 1 21 GLU H 1 23 VAL H . . 5.040 4.192 3.977 4.398 . 0 0 "[ . 1 . 2]" 1
594 1 21 GLU H 1 24 HIS HD2 . . 4.820 4.780 4.496 4.978 0.158 2 0 "[ . 1 . 2]" 1
595 1 21 GLU HA 1 21 GLU HG2 . . 3.670 2.679 2.447 3.060 . 0 0 "[ . 1 . 2]" 1
596 1 21 GLU HA 1 21 GLU HG3 . . 3.480 3.334 3.112 3.689 0.209 19 0 "[ . 1 . 2]" 1
597 1 21 GLU HA 1 24 HIS H . . 4.300 3.527 3.385 3.711 . 0 0 "[ . 1 . 2]" 1
598 1 21 GLU HA 1 24 HIS HB2 . . 4.710 2.920 2.180 4.818 0.108 2 0 "[ . 1 . 2]" 1
599 1 21 GLU HA 1 24 HIS HB3 . . 4.060 3.222 2.830 3.799 . 0 0 "[ . 1 . 2]" 1
600 1 21 GLU HA 1 24 HIS HD2 . . 3.920 2.841 2.624 3.065 . 0 0 "[ . 1 . 2]" 1
601 1 21 GLU HB2 1 22 ALA H . . 4.880 2.975 2.752 3.362 . 0 0 "[ . 1 . 2]" 1
602 1 21 GLU HB2 1 22 ALA HA . . 5.300 4.426 4.040 4.658 . 0 0 "[ . 1 . 2]" 1
603 1 21 GLU HG2 1 22 ALA H . . 5.140 4.718 4.109 5.113 . 0 0 "[ . 1 . 2]" 1
604 1 21 GLU HG3 1 22 ALA H . . 4.820 4.552 4.033 4.948 0.128 13 0 "[ . 1 . 2]" 1
605 1 22 ALA H 1 22 ALA MB . . 3.050 2.207 2.169 2.272 . 0 0 "[ . 1 . 2]" 1
606 1 22 ALA H 1 23 VAL HA . . 5.150 5.115 4.937 5.201 0.051 18 0 "[ . 1 . 2]" 1
607 1 22 ALA H 1 23 VAL MG1 . . 5.300 3.703 3.257 4.034 . 0 0 "[ . 1 . 2]" 1
608 1 22 ALA HA 1 24 HIS H . . 5.290 4.212 4.029 4.586 . 0 0 "[ . 1 . 2]" 1
609 1 22 ALA HA 1 25 CYS HB2 . . 4.270 3.902 3.569 4.201 . 0 0 "[ . 1 . 2]" 1
610 1 22 ALA HA 1 26 TYR H . . 4.770 4.611 4.399 4.827 0.057 14 0 "[ . 1 . 2]" 1
611 1 22 ALA MB 1 23 VAL H . . 4.090 2.646 2.420 2.977 . 0 0 "[ . 1 . 2]" 1
612 1 22 ALA MB 1 23 VAL HA . . 5.150 3.819 3.735 3.899 . 0 0 "[ . 1 . 2]" 1
613 1 22 ALA MB 1 23 VAL HB . . 5.460 4.945 4.753 5.223 . 0 0 "[ . 1 . 2]" 1
614 1 22 ALA MB 1 24 HIS H . . 5.400 4.295 4.199 4.468 . 0 0 "[ . 1 . 2]" 1
615 1 22 ALA MB 1 26 TYR H . . 5.500 4.787 4.632 4.960 . 0 0 "[ . 1 . 2]" 1
616 1 22 ALA MB 1 26 TYR QD . . 5.000 3.806 3.593 4.065 . 0 0 "[ . 1 . 2]" 1
617 1 22 ALA MB 1 26 TYR QE . . 4.000 2.935 2.730 3.227 . 0 0 "[ . 1 . 2]" 1
618 1 23 VAL H 1 23 VAL HB . . 3.280 3.474 3.387 3.580 0.300 14 0 "[ . 1 . 2]" 1
619 1 23 VAL H 1 23 VAL MG1 . . 3.060 2.057 1.683 2.552 . 0 0 "[ . 1 . 2]" 1
620 1 23 VAL H 1 23 VAL MG2 . . 3.780 2.891 2.375 3.159 . 0 0 "[ . 1 . 2]" 1
621 1 23 VAL H 1 24 HIS H . . 3.850 2.291 2.041 2.619 . 0 0 "[ . 1 . 2]" 1
622 1 23 VAL H 1 24 HIS HA . . 5.060 4.901 4.692 5.176 0.116 2 0 "[ . 1 . 2]" 1
623 1 23 VAL H 1 24 HIS HB3 . . 4.650 4.893 4.701 5.010 0.360 16 0 "[ . 1 . 2]" 1
624 1 23 VAL H 1 25 CYS H . . 5.500 4.104 4.015 4.193 . 0 0 "[ . 1 . 2]" 1
625 1 23 VAL H 1 26 TYR H . . 5.500 4.607 4.512 4.701 . 0 0 "[ . 1 . 2]" 1
626 1 23 VAL H 1 26 TYR HB3 . . 5.500 5.917 5.852 5.972 0.472 13 0 "[ . 1 . 2]" 1
627 1 23 VAL H 1 46 ALA MB . . 3.990 3.627 3.385 3.996 0.006 14 0 "[ . 1 . 2]" 1
628 1 23 VAL H 1 50 LEU MD1 . . 5.500 4.692 4.477 5.158 . 0 0 "[ . 1 . 2]" 1
629 1 23 VAL HA 1 23 VAL MG1 . . 3.140 2.619 2.453 2.686 . 0 0 "[ . 1 . 2]" 1
630 1 23 VAL HA 1 23 VAL MG2 . . 3.160 3.134 3.070 3.224 0.064 14 0 "[ . 1 . 2]" 1
631 1 23 VAL HA 1 24 HIS HA . . 4.810 4.807 4.668 4.876 0.066 16 0 "[ . 1 . 2]" 1
632 1 23 VAL HA 1 26 TYR H . . 4.080 2.867 2.686 2.974 . 0 0 "[ . 1 . 2]" 1
633 1 23 VAL HA 1 26 TYR HB3 . . 3.810 3.121 3.087 3.156 . 0 0 "[ . 1 . 2]" 1
634 1 23 VAL HA 1 26 TYR QD . . 4.800 2.048 1.973 2.260 . 0 0 "[ . 1 . 2]" 1
635 1 23 VAL HA 1 26 TYR QE . . 4.800 3.808 3.735 3.865 . 0 0 "[ . 1 . 2]" 1
636 1 23 VAL HA 1 27 ASP H . . 4.420 3.814 3.690 3.874 . 0 0 "[ . 1 . 2]" 1
637 1 23 VAL HA 1 43 LYS HA . . 3.870 3.053 2.862 3.354 . 0 0 "[ . 1 . 2]" 1
638 1 23 VAL HA 1 46 ALA MB . . 3.850 3.867 3.803 3.909 0.059 1 0 "[ . 1 . 2]" 1
639 1 23 VAL HB 1 24 HIS H . . 3.700 4.022 3.995 4.048 0.348 5 0 "[ . 1 . 2]" 1
640 1 23 VAL HB 1 24 HIS HA . . 4.740 4.917 4.806 5.027 0.287 8 0 "[ . 1 . 2]" 1
641 1 23 VAL HB 1 46 ALA MB . . 4.870 3.490 3.336 3.775 . 0 0 "[ . 1 . 2]" 1
642 1 23 VAL MG1 1 24 HIS H . . 3.940 3.464 3.097 3.895 . 0 0 "[ . 1 . 2]" 1
643 1 23 VAL MG1 1 26 TYR H . . 5.390 4.960 4.762 5.021 . 0 0 "[ . 1 . 2]" 1
644 1 23 VAL MG1 1 26 TYR HB2 . . 4.970 4.003 3.591 4.132 . 0 0 "[ . 1 . 2]" 1
645 1 23 VAL MG1 1 26 TYR HB3 . . 4.940 4.762 4.162 4.963 0.023 5 0 "[ . 1 . 2]" 1
646 1 23 VAL MG1 1 26 TYR QD . . 5.500 2.782 2.306 2.990 . 0 0 "[ . 1 . 2]" 1
647 1 23 VAL MG1 1 27 ASP H . . 5.500 5.500 5.172 5.591 0.091 5 0 "[ . 1 . 2]" 1
648 1 23 VAL MG1 1 43 LYS H . . 5.350 5.061 4.477 5.307 . 0 0 "[ . 1 . 2]" 1
649 1 23 VAL MG1 1 43 LYS HA . . 3.430 2.744 2.087 3.013 . 0 0 "[ . 1 . 2]" 1
650 1 23 VAL MG1 1 43 LYS QB . . 4.700 4.190 3.632 4.466 . 0 0 "[ . 1 . 2]" 1
651 1 23 VAL MG1 1 44 ALA H . . 5.500 5.360 4.868 5.567 0.067 11 0 "[ . 1 . 2]" 1
652 1 23 VAL MG1 1 46 ALA H . . 4.520 3.871 3.739 3.970 . 0 0 "[ . 1 . 2]" 1
653 1 23 VAL MG1 1 46 ALA HA . . 4.440 4.082 4.043 4.145 . 0 0 "[ . 1 . 2]" 1
654 1 23 VAL MG1 1 46 ALA MB . . 3.120 1.785 1.752 1.827 . 0 0 "[ . 1 . 2]" 1
655 1 23 VAL MG1 1 47 LEU H . . 4.660 3.740 3.142 4.076 . 0 0 "[ . 1 . 2]" 1
656 1 23 VAL MG1 1 47 LEU MD1 . . 4.630 4.288 3.929 4.471 . 0 0 "[ . 1 . 2]" 1
657 1 23 VAL MG1 1 47 LEU MD2 . . 3.550 3.490 3.340 3.591 0.041 15 0 "[ . 1 . 2]" 1
658 1 23 VAL MG1 1 47 LEU HG . . 4.660 3.228 2.853 3.532 . 0 0 "[ . 1 . 2]" 1
659 1 23 VAL MG1 1 50 LEU MD1 . . 3.700 2.691 2.442 3.731 0.031 14 0 "[ . 1 . 2]" 1
660 1 23 VAL MG2 1 24 HIS H . . 3.630 2.423 2.326 2.572 . 0 0 "[ . 1 . 2]" 1
661 1 23 VAL MG2 1 24 HIS HA . . 3.670 2.905 2.771 3.221 . 0 0 "[ . 1 . 2]" 1
662 1 23 VAL MG2 1 24 HIS HB2 . . 5.470 3.464 3.144 3.999 . 0 0 "[ . 1 . 2]" 1
663 1 23 VAL MG2 1 24 HIS HB3 . . 5.430 4.124 2.846 4.812 . 0 0 "[ . 1 . 2]" 1
664 1 23 VAL MG2 1 24 HIS HD2 . . 4.590 4.219 3.927 4.597 0.007 2 0 "[ . 1 . 2]" 1
665 1 23 VAL MG2 1 26 TYR H . . 5.500 4.562 4.466 4.671 . 0 0 "[ . 1 . 2]" 1
666 1 23 VAL MG2 1 26 TYR HB2 . . 5.500 3.769 3.728 3.839 . 0 0 "[ . 1 . 2]" 1
667 1 23 VAL MG2 1 26 TYR HB3 . . 4.880 4.909 4.883 4.938 0.058 4 0 "[ . 1 . 2]" 1
668 1 23 VAL MG2 1 27 ASP H . . 4.080 3.940 3.882 4.073 . 0 0 "[ . 1 . 2]" 1
669 1 23 VAL MG2 1 27 ASP HB2 . . 3.080 3.155 3.117 3.229 0.149 14 0 "[ . 1 . 2]" 1
670 1 23 VAL MG2 1 43 LYS HA . . 3.570 3.841 3.791 3.898 0.328 20 0 "[ . 1 . 2]" 1
671 1 23 VAL MG2 1 43 LYS QB . . 5.500 4.108 3.766 4.248 . 0 0 "[ . 1 . 2]" 1
672 1 23 VAL MG2 1 46 ALA MB . . 3.870 3.868 3.744 3.903 0.033 6 0 "[ . 1 . 2]" 1
673 1 23 VAL MG2 1 50 LEU MD1 . . 3.970 3.683 3.510 4.178 0.208 14 0 "[ . 1 . 2]" 1
674 1 24 HIS H 1 24 HIS HB2 . . 3.500 2.364 1.922 3.585 0.085 5 0 "[ . 1 . 2]" 1
675 1 24 HIS H 1 24 HIS HB3 . . 3.290 2.821 2.313 3.116 . 0 0 "[ . 1 . 2]" 1
676 1 24 HIS H 1 24 HIS HD2 . . 4.200 3.722 2.435 4.212 0.012 12 0 "[ . 1 . 2]" 1
677 1 24 HIS H 1 26 TYR H . . 4.900 3.986 3.926 4.108 . 0 0 "[ . 1 . 2]" 1
678 1 24 HIS H 1 27 ASP H . . 5.040 4.734 4.639 4.764 . 0 0 "[ . 1 . 2]" 1
679 1 24 HIS H 1 46 ALA MB . . 5.500 5.364 5.240 5.540 0.040 14 0 "[ . 1 . 2]" 1
680 1 24 HIS HA 1 24 HIS HD2 . . 3.980 4.067 3.970 4.110 0.130 13 0 "[ . 1 . 2]" 1
681 1 24 HIS HA 1 27 ASP H . . 4.320 3.753 3.467 3.911 . 0 0 "[ . 1 . 2]" 1
682 1 24 HIS HA 1 27 ASP HB2 . . 3.960 3.482 3.090 3.685 . 0 0 "[ . 1 . 2]" 1
683 1 24 HIS HA 1 27 ASP HB3 . . 4.330 3.578 3.270 3.757 . 0 0 "[ . 1 . 2]" 1
684 1 24 HIS HA 1 28 GLN QE . . 4.500 3.471 3.240 3.675 . 0 0 "[ . 1 . 2]" 1
685 1 24 HIS HA 1 28 GLN HE22 . . 5.220 3.595 3.321 3.847 . 0 0 "[ . 1 . 2]" 1
686 1 24 HIS HB2 1 28 GLN HE22 . . 5.500 5.316 4.258 5.708 0.208 20 0 "[ . 1 . 2]" 1
687 1 24 HIS HB3 1 24 HIS HD2 . . 3.390 3.422 3.330 3.491 0.101 14 0 "[ . 1 . 2]" 1
688 1 26 TYR H 1 26 TYR HB2 . . 3.860 2.261 2.190 2.299 . 0 0 "[ . 1 . 2]" 1
689 1 26 TYR H 1 26 TYR HB3 . . 3.520 3.469 3.434 3.493 . 0 0 "[ . 1 . 2]" 1
690 1 26 TYR H 1 26 TYR QD . . 5.500 2.864 2.747 2.999 . 0 0 "[ . 1 . 2]" 1
691 1 26 TYR H 1 27 ASP H . . 4.040 2.655 2.589 2.699 . 0 0 "[ . 1 . 2]" 1
692 1 26 TYR H 1 28 GLN H . . 5.320 4.282 4.108 4.340 . 0 0 "[ . 1 . 2]" 1
693 1 26 TYR H 1 29 LEU H . . 5.500 5.171 5.018 5.254 . 0 0 "[ . 1 . 2]" 1
694 1 26 TYR H 1 29 LEU MD1 . . 5.010 4.804 4.678 4.997 . 0 0 "[ . 1 . 2]" 1
695 1 26 TYR H 1 43 LYS HA . . 5.500 5.481 5.420 5.530 0.030 14 0 "[ . 1 . 2]" 1
696 1 26 TYR HA 1 26 TYR QE . . 4.720 4.455 4.430 4.486 . 0 0 "[ . 1 . 2]" 1
697 1 26 TYR HA 1 29 LEU H . . 4.230 3.354 3.258 3.432 . 0 0 "[ . 1 . 2]" 1
698 1 26 TYR HA 1 29 LEU HB2 . . 5.260 3.647 3.538 3.731 . 0 0 "[ . 1 . 2]" 1
699 1 26 TYR HA 1 29 LEU HB3 . . 4.560 4.708 4.652 4.790 0.230 3 0 "[ . 1 . 2]" 1
700 1 26 TYR HA 1 29 LEU MD1 . . 3.670 2.511 2.382 2.696 . 0 0 "[ . 1 . 2]" 1
701 1 26 TYR HA 1 29 LEU MD2 . . 4.160 3.499 3.461 3.552 . 0 0 "[ . 1 . 2]" 1
702 1 26 TYR HA 1 29 LEU HG . . 4.070 2.048 2.009 2.088 . 0 0 "[ . 1 . 2]" 1
703 1 26 TYR HB2 1 27 ASP H . . 4.330 2.579 2.470 2.628 . 0 0 "[ . 1 . 2]" 1
704 1 26 TYR HB2 1 28 GLN H . . 5.500 4.894 4.712 4.952 . 0 0 "[ . 1 . 2]" 1
705 1 26 TYR HB2 1 29 LEU MD1 . . 5.460 4.642 4.483 4.753 . 0 0 "[ . 1 . 2]" 1
706 1 26 TYR HB2 1 43 LYS H . . 4.690 4.080 3.977 4.188 . 0 0 "[ . 1 . 2]" 1
707 1 26 TYR HB2 1 43 LYS HA . . 4.360 3.395 3.326 3.476 . 0 0 "[ . 1 . 2]" 1
708 1 26 TYR HB2 1 43 LYS QB . . 4.080 2.971 2.876 3.156 . 0 0 "[ . 1 . 2]" 1
709 1 26 TYR HB3 1 27 ASP H . . 4.790 3.593 3.493 3.639 . 0 0 "[ . 1 . 2]" 1
710 1 26 TYR HB3 1 29 LEU MD1 . . 4.270 3.555 3.376 3.789 . 0 0 "[ . 1 . 2]" 1
711 1 26 TYR HB3 1 43 LYS H . . 4.750 2.730 2.592 2.823 . 0 0 "[ . 1 . 2]" 1
712 1 26 TYR HB3 1 43 LYS HA . . 3.980 3.326 3.213 3.511 . 0 0 "[ . 1 . 2]" 1
713 1 26 TYR HB3 1 43 LYS QB . . 4.060 2.366 2.189 2.570 . 0 0 "[ . 1 . 2]" 1
714 1 26 TYR QD 1 27 ASP H . . 5.000 4.473 4.407 4.502 . 0 0 "[ . 1 . 2]" 1
715 1 26 TYR QD 1 29 LEU MD1 . . 5.000 2.950 2.823 3.132 . 0 0 "[ . 1 . 2]" 1
716 1 26 TYR QD 1 43 LYS HA . . 4.490 2.024 1.972 2.098 . 0 0 "[ . 1 . 2]" 1
717 1 26 TYR QD 1 43 LYS QB . . 4.930 3.283 3.208 3.363 . 0 0 "[ . 1 . 2]" 1
718 1 26 TYR QE 1 29 LEU MD1 . . 5.000 4.158 4.049 4.323 . 0 0 "[ . 1 . 2]" 1
719 1 26 TYR QE 1 42 ASN HB2 . . 4.600 3.847 2.682 4.389 . 0 0 "[ . 1 . 2]" 1
720 1 26 TYR QE 1 43 LYS HA . . 5.340 3.906 3.820 4.013 . 0 0 "[ . 1 . 2]" 1
721 1 26 TYR QE 1 43 LYS QB . . 5.100 5.182 5.151 5.214 0.114 1 0 "[ . 1 . 2]" 1
722 1 26 TYR QE 1 44 ALA H . . 5.500 5.590 5.539 5.641 0.141 14 0 "[ . 1 . 2]" 1
723 1 27 ASP H 1 27 ASP HB2 . . 3.450 2.382 2.323 2.415 . 0 0 "[ . 1 . 2]" 1
724 1 27 ASP H 1 27 ASP HB3 . . 3.570 2.530 2.488 2.572 . 0 0 "[ . 1 . 2]" 1
725 1 27 ASP H 1 28 GLN H . . 3.940 2.698 2.597 2.777 . 0 0 "[ . 1 . 2]" 1
726 1 27 ASP H 1 28 GLN HA . . 5.170 5.265 5.201 5.315 0.145 15 0 "[ . 1 . 2]" 1
727 1 27 ASP H 1 28 GLN QB . . 5.240 4.743 4.471 4.854 . 0 0 "[ . 1 . 2]" 1
728 1 27 ASP H 1 28 GLN HE21 . . 5.500 3.986 3.623 4.302 . 0 0 "[ . 1 . 2]" 1
729 1 27 ASP H 1 28 GLN HE22 . . 5.170 3.803 3.445 4.049 . 0 0 "[ . 1 . 2]" 1
730 1 27 ASP H 1 29 LEU H . . 4.890 4.080 4.004 4.172 . 0 0 "[ . 1 . 2]" 1
731 1 27 ASP H 1 29 LEU MD1 . . 5.500 5.337 5.211 5.450 . 0 0 "[ . 1 . 2]" 1
732 1 27 ASP H 1 29 LEU HG . . 4.990 4.641 4.517 4.779 . 0 0 "[ . 1 . 2]" 1
733 1 27 ASP H 1 30 ILE MD . . 5.370 3.904 3.853 3.971 . 0 0 "[ . 1 . 2]" 1
734 1 27 ASP H 1 43 LYS HA . . 5.500 5.533 5.463 5.587 0.087 15 0 "[ . 1 . 2]" 1
735 1 27 ASP HA 1 28 GLN HA . . 5.380 4.682 4.659 4.724 . 0 0 "[ . 1 . 2]" 1
736 1 27 ASP HA 1 28 GLN QE . . 5.250 4.568 4.379 4.824 . 0 0 "[ . 1 . 2]" 1
737 1 27 ASP HA 1 30 ILE H . . 4.640 3.476 3.401 3.533 . 0 0 "[ . 1 . 2]" 1
738 1 27 ASP HA 1 30 ILE HB . . 3.710 3.664 3.484 3.764 0.054 19 0 "[ . 1 . 2]" 1
739 1 27 ASP HA 1 30 ILE MD . . 3.300 1.906 1.873 1.935 . 0 0 "[ . 1 . 2]" 1
740 1 27 ASP HA 1 30 ILE HG12 . . 4.700 4.581 4.530 4.648 . 0 0 "[ . 1 . 2]" 1
741 1 27 ASP HA 1 30 ILE HG13 . . 4.580 4.483 4.439 4.534 . 0 0 "[ . 1 . 2]" 1
742 1 27 ASP HA 1 30 ILE MG . . 5.500 4.924 4.812 4.983 . 0 0 "[ . 1 . 2]" 1
743 1 27 ASP HA 1 31 THR H . . 4.730 4.555 4.337 4.726 . 0 0 "[ . 1 . 2]" 1
744 1 27 ASP HB2 1 28 GLN H . . 4.070 4.065 4.025 4.088 0.018 15 0 "[ . 1 . 2]" 1
745 1 27 ASP HB2 1 28 GLN HE21 . . 5.120 4.133 3.808 5.153 0.033 14 0 "[ . 1 . 2]" 1
746 1 27 ASP HB2 1 28 GLN QE . . 4.480 3.730 3.537 3.951 . 0 0 "[ . 1 . 2]" 1
747 1 27 ASP HB2 1 28 GLN HE22 . . 4.690 4.324 3.933 4.588 . 0 0 "[ . 1 . 2]" 1
748 1 27 ASP HB2 1 30 ILE MD . . 3.810 3.847 3.820 3.859 0.049 3 0 "[ . 1 . 2]" 1
749 1 27 ASP HB3 1 28 GLN H . . 4.260 2.954 2.892 3.020 . 0 0 "[ . 1 . 2]" 1
750 1 27 ASP HB3 1 28 GLN HA . . 4.340 4.379 4.362 4.390 0.050 16 0 "[ . 1 . 2]" 1
751 1 27 ASP HB3 1 28 GLN QE . . 4.220 2.210 1.990 2.449 . 0 0 "[ . 1 . 2]" 1
752 1 27 ASP HB3 1 30 ILE MD . . 4.400 4.347 4.287 4.400 0.000 9 0 "[ . 1 . 2]" 1
753 1 28 GLN H 1 28 GLN QB . . 3.460 2.361 2.203 2.399 . 0 0 "[ . 1 . 2]" 1
754 1 28 GLN H 1 28 GLN HE21 . . 4.580 2.810 2.075 3.100 . 0 0 "[ . 1 . 2]" 1
755 1 28 GLN H 1 28 GLN HG2 . . 3.930 4.036 3.994 4.066 0.136 6 0 "[ . 1 . 2]" 1
756 1 28 GLN H 1 28 GLN HG3 . . 4.080 3.276 3.100 4.097 0.017 14 0 "[ . 1 . 2]" 1
757 1 28 GLN H 1 29 LEU H . . 4.140 2.578 2.513 2.613 . 0 0 "[ . 1 . 2]" 1
758 1 28 GLN H 1 29 LEU MD1 . . 5.500 5.295 5.201 5.460 . 0 0 "[ . 1 . 2]" 1
759 1 28 GLN H 1 29 LEU MD2 . . 5.500 4.462 4.286 4.694 . 0 0 "[ . 1 . 2]" 1
760 1 28 GLN H 1 29 LEU HG . . 5.500 3.945 3.840 4.129 . 0 0 "[ . 1 . 2]" 1
761 1 28 GLN H 1 30 ILE MD . . 5.500 4.122 3.988 4.265 . 0 0 "[ . 1 . 2]" 1
762 1 28 GLN HA 1 28 GLN HE21 . . 4.840 3.639 3.497 4.112 . 0 0 "[ . 1 . 2]" 1
763 1 28 GLN HA 1 28 GLN HG3 . . 3.590 2.244 2.176 2.421 . 0 0 "[ . 1 . 2]" 1
764 1 28 GLN HA 1 31 THR H . . 4.040 2.687 2.601 2.827 . 0 0 "[ . 1 . 2]" 1
765 1 28 GLN HA 1 31 THR MG . . 4.560 3.558 3.074 3.718 . 0 0 "[ . 1 . 2]" 1
766 1 28 GLN QB 1 28 GLN HE22 . . 5.030 4.019 3.550 4.130 . 0 0 "[ . 1 . 2]" 1
767 1 28 GLN QB 1 29 LEU H . . 3.800 3.198 3.131 3.306 . 0 0 "[ . 1 . 2]" 1
768 1 28 GLN QB 1 29 LEU MD2 . . 5.260 3.546 3.339 3.812 . 0 0 "[ . 1 . 2]" 1
769 1 28 GLN QB 1 31 THR H . . 4.980 4.410 4.334 4.555 . 0 0 "[ . 1 . 2]" 1
770 1 28 GLN QB 1 31 THR HB . . 4.720 3.650 3.539 3.805 . 0 0 "[ . 1 . 2]" 1
771 1 28 GLN QB 1 31 THR MG . . 5.500 4.257 3.982 4.394 . 0 0 "[ . 1 . 2]" 1
772 1 28 GLN QB 1 32 ALA H . . 5.500 4.142 4.040 4.370 . 0 0 "[ . 1 . 2]" 1
773 1 28 GLN HE21 1 31 THR MG . . 5.500 5.539 5.357 5.749 0.249 20 0 "[ . 1 . 2]" 1
774 1 28 GLN HG2 1 31 THR MG . . 4.620 4.657 4.333 4.693 0.073 12 0 "[ . 1 . 2]" 1
775 1 28 GLN HG3 1 29 LEU H . . 5.420 5.022 4.914 5.391 . 0 0 "[ . 1 . 2]" 1
776 1 29 LEU H 1 29 LEU HB2 . . 3.880 2.522 2.481 2.576 . 0 0 "[ . 1 . 2]" 1
777 1 29 LEU H 1 29 LEU HB3 . . 3.890 3.602 3.587 3.621 . 0 0 "[ . 1 . 2]" 1
778 1 29 LEU H 1 29 LEU MD1 . . 3.790 3.693 3.628 3.773 . 0 0 "[ . 1 . 2]" 1
779 1 29 LEU H 1 29 LEU MD2 . . 3.700 2.892 2.772 3.029 . 0 0 "[ . 1 . 2]" 1
780 1 29 LEU H 1 29 LEU HG . . 4.050 2.098 2.014 2.224 . 0 0 "[ . 1 . 2]" 1
781 1 29 LEU H 1 30 ILE HB . . 5.160 4.938 4.901 5.016 . 0 0 "[ . 1 . 2]" 1
782 1 29 LEU H 1 30 ILE MD . . 5.500 3.210 3.088 3.291 . 0 0 "[ . 1 . 2]" 1
783 1 29 LEU H 1 30 ILE HG13 . . 5.310 4.706 4.636 4.776 . 0 0 "[ . 1 . 2]" 1
784 1 29 LEU H 1 31 THR H . . 4.840 3.911 3.745 4.026 . 0 0 "[ . 1 . 2]" 1
785 1 29 LEU H 1 32 ALA MB . . 5.500 4.721 4.640 4.825 . 0 0 "[ . 1 . 2]" 1
786 1 29 LEU H 1 39 GLY HA3 . . 5.500 5.114 5.022 5.257 . 0 0 "[ . 1 . 2]" 1
787 1 29 LEU HA 1 29 LEU MD1 . . 4.150 3.774 3.720 3.809 . 0 0 "[ . 1 . 2]" 1
788 1 29 LEU HA 1 29 LEU MD2 . . 3.070 2.057 2.033 2.098 . 0 0 "[ . 1 . 2]" 1
789 1 29 LEU HA 1 29 LEU HG . . 4.080 3.313 3.275 3.344 . 0 0 "[ . 1 . 2]" 1
790 1 29 LEU HA 1 30 ILE HA . . 5.320 4.712 4.695 4.728 . 0 0 "[ . 1 . 2]" 1
791 1 29 LEU HA 1 30 ILE MD . . 4.870 4.870 4.702 4.919 0.049 11 0 "[ . 1 . 2]" 1
792 1 29 LEU HA 1 32 ALA MB . . 3.190 2.839 2.629 3.016 . 0 0 "[ . 1 . 2]" 1
793 1 29 LEU HA 1 33 GLN H . . 4.390 3.930 3.773 4.106 . 0 0 "[ . 1 . 2]" 1
794 1 29 LEU HA 1 33 GLN QE . . 5.500 4.635 4.364 5.261 . 0 0 "[ . 1 . 2]" 1
795 1 29 LEU HB2 1 29 LEU MD1 . . 3.590 2.429 2.400 2.464 . 0 0 "[ . 1 . 2]" 1
796 1 29 LEU HB2 1 29 LEU MD2 . . 3.300 3.219 3.212 3.230 . 0 0 "[ . 1 . 2]" 1
797 1 29 LEU HB2 1 30 ILE H . . 4.780 2.591 2.502 2.694 . 0 0 "[ . 1 . 2]" 1
798 1 29 LEU HB2 1 30 ILE HG13 . . 4.880 3.204 2.942 3.354 . 0 0 "[ . 1 . 2]" 1
799 1 29 LEU HB2 1 39 GLY H . . 5.500 4.371 4.216 4.632 . 0 0 "[ . 1 . 2]" 1
800 1 29 LEU HB2 1 39 GLY HA2 . . 4.270 1.885 1.831 2.034 . 0 0 "[ . 1 . 2]" 1
801 1 29 LEU HB3 1 30 ILE H . . 5.100 3.795 3.688 3.898 . 0 0 "[ . 1 . 2]" 1
802 1 29 LEU HB3 1 39 GLY HA2 . . 4.310 2.559 2.285 2.810 . 0 0 "[ . 1 . 2]" 1
803 1 29 LEU HB3 1 39 GLY HA3 . . 4.390 3.217 2.928 3.403 . 0 0 "[ . 1 . 2]" 1
804 1 29 LEU MD1 1 38 VAL MG2 . . 4.760 2.302 1.979 3.208 . 0 0 "[ . 1 . 2]" 1
805 1 29 LEU MD1 1 39 GLY H . . 5.110 4.055 3.893 4.205 . 0 0 "[ . 1 . 2]" 1
806 1 29 LEU MD1 1 39 GLY HA2 . . 4.190 2.496 2.241 2.681 . 0 0 "[ . 1 . 2]" 1
807 1 29 LEU MD1 1 39 GLY HA3 . . 3.830 3.910 3.658 4.066 0.236 16 0 "[ . 1 . 2]" 1
808 1 29 LEU MD2 1 30 ILE H . . 5.500 4.461 4.409 4.498 . 0 0 "[ . 1 . 2]" 1
809 1 29 LEU MD2 1 32 ALA H . . 5.500 4.881 4.664 5.119 . 0 0 "[ . 1 . 2]" 1
810 1 29 LEU MD2 1 32 ALA MB . . 4.400 3.725 3.481 3.963 . 0 0 "[ . 1 . 2]" 1
811 1 29 LEU MD2 1 38 VAL MG2 . . 4.820 3.898 3.470 4.807 . 0 0 "[ . 1 . 2]" 1
812 1 29 LEU MD2 1 39 GLY HA2 . . 5.250 4.333 4.061 4.487 . 0 0 "[ . 1 . 2]" 1
813 1 29 LEU HG 1 30 ILE H . . 5.500 4.024 3.964 4.103 . 0 0 "[ . 1 . 2]" 1
814 1 29 LEU HG 1 39 GLY HA2 . . 4.810 3.797 3.722 3.847 . 0 0 "[ . 1 . 2]" 1
815 1 30 ILE H 1 30 ILE HB . . 3.510 2.647 2.611 2.694 . 0 0 "[ . 1 . 2]" 1
816 1 30 ILE H 1 30 ILE MD . . 4.730 1.911 1.790 2.014 . 0 0 "[ . 1 . 2]" 1
817 1 30 ILE H 1 30 ILE HG12 . . 4.300 3.850 3.802 3.890 . 0 0 "[ . 1 . 2]" 1
818 1 30 ILE H 1 30 ILE HG13 . . 4.500 2.668 2.608 2.737 . 0 0 "[ . 1 . 2]" 1
819 1 30 ILE H 1 30 ILE MG . . 4.520 3.715 3.691 3.726 . 0 0 "[ . 1 . 2]" 1
820 1 30 ILE H 1 31 THR H . . 4.390 2.495 2.453 2.530 . 0 0 "[ . 1 . 2]" 1
821 1 30 ILE H 1 31 THR HA . . 5.240 5.128 5.096 5.154 . 0 0 "[ . 1 . 2]" 1
822 1 30 ILE H 1 31 THR HB . . 4.890 4.519 4.320 4.584 . 0 0 "[ . 1 . 2]" 1
823 1 30 ILE H 1 32 ALA H . . 5.170 3.892 3.834 3.951 . 0 0 "[ . 1 . 2]" 1
824 1 30 ILE H 1 33 GLN H . . 5.500 4.458 4.420 4.536 . 0 0 "[ . 1 . 2]" 1
825 1 30 ILE H 1 39 GLY HA3 . . 5.500 3.700 3.523 3.844 . 0 0 "[ . 1 . 2]" 1
826 1 30 ILE HA 1 30 ILE MD . . 3.980 3.657 3.623 3.678 . 0 0 "[ . 1 . 2]" 1
827 1 30 ILE HA 1 30 ILE HG12 . . 3.720 3.464 3.407 3.513 . 0 0 "[ . 1 . 2]" 1
828 1 30 ILE HA 1 30 ILE HG13 . . 3.810 2.526 2.488 2.555 . 0 0 "[ . 1 . 2]" 1
829 1 30 ILE HA 1 30 ILE MG . . 2.990 2.132 2.100 2.153 . 0 0 "[ . 1 . 2]" 1
830 1 30 ILE HA 1 32 ALA H . . 5.240 4.193 4.083 4.303 . 0 0 "[ . 1 . 2]" 1
831 1 30 ILE HA 1 33 GLN H . . 4.510 3.264 3.156 3.378 . 0 0 "[ . 1 . 2]" 1
832 1 30 ILE HA 1 34 PRO HA . . 4.090 2.652 2.540 2.754 . 0 0 "[ . 1 . 2]" 1
833 1 30 ILE HA 1 34 PRO HB3 . . 5.330 4.285 4.233 4.345 . 0 0 "[ . 1 . 2]" 1
834 1 30 ILE HA 1 39 GLY HA3 . . 4.920 3.248 3.153 3.358 . 0 0 "[ . 1 . 2]" 1
835 1 30 ILE HB 1 30 ILE MD . . 3.120 2.181 2.151 2.206 . 0 0 "[ . 1 . 2]" 1
836 1 30 ILE HB 1 31 THR H . . 3.550 2.800 2.722 2.881 . 0 0 "[ . 1 . 2]" 1
837 1 30 ILE HB 1 31 THR HA . . 5.260 4.239 4.100 4.322 . 0 0 "[ . 1 . 2]" 1
838 1 30 ILE HB 1 33 GLN H . . 5.500 5.386 5.289 5.462 . 0 0 "[ . 1 . 2]" 1
839 1 30 ILE MD 1 30 ILE MG . . 3.140 2.970 2.933 3.020 . 0 0 "[ . 1 . 2]" 1
840 1 30 ILE MD 1 31 THR H . . 4.980 3.607 3.414 3.741 . 0 0 "[ . 1 . 2]" 1
841 1 30 ILE MD 1 32 ALA H . . 5.500 5.327 5.195 5.436 . 0 0 "[ . 1 . 2]" 1
842 1 30 ILE MD 1 39 GLY H . . 5.500 5.123 5.066 5.187 . 0 0 "[ . 1 . 2]" 1
843 1 30 ILE MD 1 39 GLY HA2 . . 3.320 3.158 3.120 3.212 . 0 0 "[ . 1 . 2]" 1
844 1 30 ILE MD 1 39 GLY HA3 . . 3.130 3.283 3.230 3.333 0.203 1 0 "[ . 1 . 2]" 1
845 1 30 ILE MD 1 40 TYR H . . 4.200 4.073 3.985 4.237 0.037 9 0 "[ . 1 . 2]" 1
846 1 30 ILE MD 1 40 TYR HA . . 3.910 3.124 3.034 3.290 . 0 0 "[ . 1 . 2]" 1
847 1 30 ILE MD 1 40 TYR HB3 . . 5.280 5.269 5.199 5.318 0.038 12 0 "[ . 1 . 2]" 1
848 1 30 ILE MD 1 40 TYR QD . . 4.550 4.239 4.096 4.374 . 0 0 "[ . 1 . 2]" 1
849 1 30 ILE MD 1 41 SER H . . 5.020 5.083 5.027 5.134 0.114 8 0 "[ . 1 . 2]" 1
850 1 30 ILE MD 1 43 LYS H . . 5.500 3.858 3.500 4.177 . 0 0 "[ . 1 . 2]" 1
851 1 30 ILE MD 1 43 LYS QB . . 4.710 2.579 2.439 2.749 . 0 0 "[ . 1 . 2]" 1
852 1 30 ILE MD 1 44 ALA H . . 5.500 5.306 5.095 5.437 . 0 0 "[ . 1 . 2]" 1
853 1 30 ILE HG12 1 30 ILE MG . . 3.360 2.072 2.057 2.100 . 0 0 "[ . 1 . 2]" 1
854 1 30 ILE HG12 1 31 THR H . . 5.380 5.270 5.177 5.323 . 0 0 "[ . 1 . 2]" 1
855 1 30 ILE HG12 1 39 GLY H . . 5.500 5.431 5.336 5.476 . 0 0 "[ . 1 . 2]" 1
856 1 30 ILE HG12 1 39 GLY HA2 . . 5.080 4.280 4.262 4.316 . 0 0 "[ . 1 . 2]" 1
857 1 30 ILE HG12 1 39 GLY HA3 . . 4.200 3.347 3.273 3.400 . 0 0 "[ . 1 . 2]" 1
858 1 30 ILE HG12 1 40 TYR H . . 5.500 3.641 3.435 4.134 . 0 0 "[ . 1 . 2]" 1
859 1 30 ILE HG13 1 30 ILE MG . . 3.600 2.661 2.625 2.689 . 0 0 "[ . 1 . 2]" 1
860 1 30 ILE HG13 1 31 THR H . . 5.360 4.604 4.519 4.647 . 0 0 "[ . 1 . 2]" 1
861 1 30 ILE HG13 1 39 GLY H . . 5.280 4.234 4.159 4.289 . 0 0 "[ . 1 . 2]" 1
862 1 30 ILE HG13 1 39 GLY HA2 . . 5.400 2.807 2.771 2.881 . 0 0 "[ . 1 . 2]" 1
863 1 30 ILE HG13 1 39 GLY HA3 . . 5.230 1.883 1.846 1.923 . 0 0 "[ . 1 . 2]" 1
864 1 30 ILE HG13 1 40 TYR H . . 5.500 3.452 3.241 3.870 . 0 0 "[ . 1 . 2]" 1
865 1 30 ILE MG 1 31 THR H . . 3.660 3.734 3.709 3.773 0.113 11 0 "[ . 1 . 2]" 1
866 1 30 ILE MG 1 31 THR HA . . 3.620 3.689 3.659 3.725 0.105 3 0 "[ . 1 . 2]" 1
867 1 30 ILE MG 1 31 THR HB . . 5.280 5.328 5.293 5.359 0.079 3 0 "[ . 1 . 2]" 1
868 1 30 ILE MG 1 32 ALA H . . 5.430 4.985 4.892 5.072 . 0 0 "[ . 1 . 2]" 1
869 1 30 ILE MG 1 33 GLN H . . 4.700 4.482 4.392 4.598 . 0 0 "[ . 1 . 2]" 1
870 1 30 ILE MG 1 34 PRO HA . . 3.800 2.061 1.972 2.178 . 0 0 "[ . 1 . 2]" 1
871 1 30 ILE MG 1 34 PRO HB2 . . 3.960 3.710 3.633 3.822 . 0 0 "[ . 1 . 2]" 1
872 1 30 ILE MG 1 34 PRO HB3 . . 3.970 2.644 2.503 2.782 . 0 0 "[ . 1 . 2]" 1
873 1 30 ILE MG 1 34 PRO HG2 . . 5.500 5.104 4.972 5.228 . 0 0 "[ . 1 . 2]" 1
874 1 30 ILE MG 1 35 GLN H . . 5.500 4.729 4.552 4.864 . 0 0 "[ . 1 . 2]" 1
875 1 30 ILE MG 1 39 GLY HA3 . . 4.660 3.765 3.713 3.806 . 0 0 "[ . 1 . 2]" 1
876 1 30 ILE MG 1 40 TYR H . . 5.500 4.356 4.104 4.935 . 0 0 "[ . 1 . 2]" 1
877 1 30 ILE MG 1 40 TYR HA . . 5.500 4.621 4.323 5.204 . 0 0 "[ . 1 . 2]" 1
878 1 30 ILE MG 1 40 TYR QD . . 4.750 3.715 3.475 3.919 . 0 0 "[ . 1 . 2]" 1
879 1 31 THR H 1 31 THR HB . . 3.030 2.249 2.138 2.284 . 0 0 "[ . 1 . 2]" 1
880 1 31 THR H 1 31 THR MG . . 4.050 3.703 3.640 3.720 . 0 0 "[ . 1 . 2]" 1
881 1 31 THR H 1 32 ALA HA . . 5.300 5.214 5.148 5.281 . 0 0 "[ . 1 . 2]" 1
882 1 31 THR H 1 32 ALA MB . . 4.780 4.297 4.215 4.364 . 0 0 "[ . 1 . 2]" 1
883 1 31 THR H 1 33 GLN H . . 4.890 3.907 3.782 4.024 . 0 0 "[ . 1 . 2]" 1
884 1 31 THR H 1 34 PRO HA . . 5.500 5.044 4.935 5.099 . 0 0 "[ . 1 . 2]" 1
885 1 31 THR HA 1 31 THR MG . . 2.770 2.618 2.580 2.770 . 20 0 "[ . 1 . 2]" 1
886 1 31 THR HA 1 32 ALA HA . . 4.600 4.645 4.626 4.668 0.068 19 0 "[ . 1 . 2]" 1
887 1 31 THR HA 1 32 ALA MB . . 5.130 5.004 4.989 5.015 . 0 0 "[ . 1 . 2]" 1
888 1 31 THR HA 1 33 GLN H . . 4.810 4.228 3.989 4.394 . 0 0 "[ . 1 . 2]" 1
889 1 31 THR HA 1 34 PRO HB3 . . 4.810 3.323 3.217 3.478 . 0 0 "[ . 1 . 2]" 1
890 1 31 THR HA 1 34 PRO HD3 . . 5.000 3.825 3.554 4.243 . 0 0 "[ . 1 . 2]" 1
891 1 31 THR HA 1 34 PRO HG2 . . 4.850 5.001 4.924 5.064 0.214 17 0 "[ . 1 . 2]" 1
892 1 31 THR HB 1 32 ALA H . . 3.330 2.944 2.894 2.988 . 0 0 "[ . 1 . 2]" 1
893 1 31 THR HB 1 32 ALA HA . . 4.540 4.610 4.594 4.645 0.105 20 0 "[ . 1 . 2]" 1
894 1 31 THR HB 1 32 ALA MB . . 4.340 4.088 3.980 4.142 . 0 0 "[ . 1 . 2]" 1
895 1 31 THR MG 1 32 ALA H . . 3.540 3.571 3.544 3.600 0.060 16 0 "[ . 1 . 2]" 1
896 1 31 THR MG 1 32 ALA HA . . 3.870 3.513 3.480 3.598 . 0 0 "[ . 1 . 2]" 1
897 1 31 THR MG 1 32 ALA MB . . 4.130 3.881 3.735 3.961 . 0 0 "[ . 1 . 2]" 1
898 1 31 THR MG 1 33 GLN H . . 5.500 5.024 4.875 5.098 . 0 0 "[ . 1 . 2]" 1
899 1 32 ALA H 1 32 ALA MB . . 2.770 2.261 2.243 2.287 . 0 0 "[ . 1 . 2]" 1
900 1 32 ALA H 1 33 GLN H . . 3.600 2.268 2.190 2.310 . 0 0 "[ . 1 . 2]" 1
901 1 32 ALA H 1 33 GLN HA . . 5.060 4.963 4.904 4.997 . 0 0 "[ . 1 . 2]" 1
902 1 32 ALA H 1 33 GLN HB3 . . 4.960 5.017 4.977 5.035 0.075 17 0 "[ . 1 . 2]" 1
903 1 32 ALA H 1 34 PRO HD3 . . 5.500 4.124 4.096 4.170 . 0 0 "[ . 1 . 2]" 1
904 1 32 ALA HA 1 34 PRO HD2 . . 5.230 5.259 5.225 5.315 0.085 16 0 "[ . 1 . 2]" 1
905 1 32 ALA HA 1 34 PRO HD3 . . 5.240 3.807 3.687 3.910 . 0 0 "[ . 1 . 2]" 1
906 1 32 ALA MB 1 33 GLN H . . 3.110 2.756 2.700 2.913 . 0 0 "[ . 1 . 2]" 1
907 1 32 ALA MB 1 33 GLN HA . . 5.090 4.278 4.248 4.365 . 0 0 "[ . 1 . 2]" 1
908 1 32 ALA MB 1 33 GLN QE . . 4.740 3.761 3.498 4.495 . 0 0 "[ . 1 . 2]" 1
909 1 32 ALA MB 1 33 GLN HG3 . . 5.110 4.860 4.728 5.119 0.009 17 0 "[ . 1 . 2]" 1
910 1 32 ALA MB 1 34 PRO HD3 . . 5.180 4.450 4.398 4.580 . 0 0 "[ . 1 . 2]" 1
911 1 33 GLN H 1 33 GLN HB2 . . 3.840 2.815 2.698 3.135 . 0 0 "[ . 1 . 2]" 1
912 1 33 GLN H 1 33 GLN HB3 . . 3.940 2.991 2.946 3.130 . 0 0 "[ . 1 . 2]" 1
913 1 33 GLN H 1 33 GLN QE . . 5.500 4.293 4.160 4.735 . 0 0 "[ . 1 . 2]" 1
914 1 33 GLN H 1 33 GLN HG2 . . 5.200 4.791 4.751 4.845 . 0 0 "[ . 1 . 2]" 1
915 1 33 GLN H 1 34 PRO HD2 . . 4.590 4.076 3.928 4.248 . 0 0 "[ . 1 . 2]" 1
916 1 33 GLN H 1 34 PRO HD3 . . 4.190 2.828 2.715 2.922 . 0 0 "[ . 1 . 2]" 1
917 1 33 GLN H 1 34 PRO HG2 . . 5.440 5.510 5.368 5.541 0.101 7 0 "[ . 1 . 2]" 1
918 1 33 GLN H 1 35 GLN H . . 4.780 4.782 4.736 4.808 0.028 1 0 "[ . 1 . 2]" 1
919 1 33 GLN HA 1 33 GLN QE . . 5.500 4.076 3.935 4.339 . 0 0 "[ . 1 . 2]" 1
920 1 33 GLN HA 1 33 GLN HG2 . . 3.950 2.956 2.824 3.106 . 0 0 "[ . 1 . 2]" 1
921 1 33 GLN HA 1 33 GLN HG3 . . 3.400 2.376 2.224 2.461 . 0 0 "[ . 1 . 2]" 1
922 1 33 GLN HA 1 34 PRO HA . . 4.620 4.601 4.567 4.619 . 0 0 "[ . 1 . 2]" 1
923 1 33 GLN HA 1 34 PRO HD2 . . 3.570 2.188 2.093 2.355 . 0 0 "[ . 1 . 2]" 1
924 1 33 GLN HA 1 34 PRO HD3 . . 3.580 2.422 2.290 2.516 . 0 0 "[ . 1 . 2]" 1
925 1 33 GLN HA 1 34 PRO HG3 . . 4.200 4.426 4.365 4.457 0.257 19 0 "[ . 1 . 2]" 1
926 1 33 GLN HA 1 35 GLN HE21 . . 4.080 4.023 3.834 4.119 0.039 14 0 "[ . 1 . 2]" 1
927 1 33 GLN HA 1 35 GLN HE22 . . 4.360 4.169 4.027 4.373 0.013 14 0 "[ . 1 . 2]" 1
928 1 33 GLN HB2 1 33 GLN QE . . 4.330 1.877 1.735 2.248 . 0 0 "[ . 1 . 2]" 1
929 1 33 GLN HB2 1 34 PRO HD2 . . 5.280 4.848 4.764 5.028 . 0 0 "[ . 1 . 2]" 1
930 1 33 GLN HB2 1 36 ASN HB2 . . 4.380 4.590 4.560 4.626 0.246 11 0 "[ . 1 . 2]" 1
931 1 33 GLN HB2 1 36 ASN HB3 . . 3.830 3.578 3.524 3.617 . 0 0 "[ . 1 . 2]" 1
932 1 33 GLN HB2 1 36 ASN HD21 . . 4.880 4.020 3.787 4.241 . 0 0 "[ . 1 . 2]" 1
933 1 33 GLN HB2 1 36 ASN HD22 . . 4.790 4.667 4.411 4.839 0.049 14 0 "[ . 1 . 2]" 1
934 1 33 GLN HB3 1 33 GLN HG2 . . 2.830 2.490 2.427 2.527 . 0 0 "[ . 1 . 2]" 1
935 1 33 GLN HB3 1 34 PRO HD2 . . 5.080 4.866 4.812 4.957 . 0 0 "[ . 1 . 2]" 1
936 1 33 GLN HB3 1 36 ASN HD21 . . 5.500 2.380 2.187 2.560 . 0 0 "[ . 1 . 2]" 1
937 1 33 GLN HB3 1 36 ASN HD22 . . 5.380 3.258 3.111 3.364 . 0 0 "[ . 1 . 2]" 1
938 1 33 GLN QE 1 36 ASN HD21 . . 5.500 4.371 3.710 4.876 . 0 0 "[ . 1 . 2]" 1
939 1 33 GLN QE 1 36 ASN HD22 . . 5.500 4.548 3.894 5.129 . 0 0 "[ . 1 . 2]" 1
940 1 33 GLN HG2 1 34 PRO HD2 . . 4.700 4.526 4.189 4.739 0.039 20 0 "[ . 1 . 2]" 1
941 1 33 GLN HG2 1 36 ASN HB3 . . 4.580 2.064 2.002 2.112 . 0 0 "[ . 1 . 2]" 1
942 1 33 GLN HG2 1 36 ASN HD21 . . 5.500 3.995 3.937 4.070 . 0 0 "[ . 1 . 2]" 1
943 1 33 GLN HG3 1 34 PRO HD3 . . 4.860 4.782 4.527 4.888 0.028 7 0 "[ . 1 . 2]" 1
944 1 33 GLN HG3 1 35 GLN HE22 . . 5.410 5.493 5.444 5.533 0.123 2 0 "[ . 1 . 2]" 1
945 1 34 PRO HA 1 36 ASN H . . 4.350 3.535 3.390 3.694 . 0 0 "[ . 1 . 2]" 1
946 1 34 PRO HA 1 36 ASN HD22 . . 5.500 5.126 4.994 5.323 . 0 0 "[ . 1 . 2]" 1
947 1 34 PRO HB2 1 35 GLN H . . 3.810 3.606 3.501 3.681 . 0 0 "[ . 1 . 2]" 1
948 1 34 PRO HB2 1 35 GLN HE21 . . 4.560 2.954 2.708 3.320 . 0 0 "[ . 1 . 2]" 1
949 1 34 PRO HB2 1 35 GLN HE22 . . 5.360 4.270 3.947 4.516 . 0 0 "[ . 1 . 2]" 1
950 1 34 PRO HB3 1 35 GLN HE22 . . 5.500 5.238 5.047 5.384 . 0 0 "[ . 1 . 2]" 1
951 1 34 PRO HD2 1 35 GLN H . . 4.250 2.413 2.374 2.458 . 0 0 "[ . 1 . 2]" 1
952 1 34 PRO HD2 1 35 GLN HE21 . . 5.500 2.261 2.133 2.392 . 0 0 "[ . 1 . 2]" 1
953 1 34 PRO HD2 1 35 GLN HE22 . . 5.500 2.378 2.208 2.673 . 0 0 "[ . 1 . 2]" 1
954 1 34 PRO HD3 1 35 GLN H . . 4.460 3.595 3.565 3.621 . 0 0 "[ . 1 . 2]" 1
955 1 34 PRO HD3 1 35 GLN HE21 . . 5.500 3.762 3.668 4.058 . 0 0 "[ . 1 . 2]" 1
956 1 34 PRO HG2 1 35 GLN H . . 5.040 3.505 3.332 3.780 . 0 0 "[ . 1 . 2]" 1
957 1 34 PRO HG3 1 35 GLN H . . 4.100 4.349 4.318 4.382 0.282 16 0 "[ . 1 . 2]" 1
958 1 34 PRO HG3 1 35 GLN HE21 . . 5.420 3.737 3.589 4.466 . 0 0 "[ . 1 . 2]" 1
959 1 35 GLN H 1 35 GLN HB2 . . 3.810 2.773 2.607 3.910 0.100 16 0 "[ . 1 . 2]" 1
960 1 35 GLN H 1 35 GLN HB3 . . 3.630 3.763 3.026 3.833 0.203 9 0 "[ . 1 . 2]" 1
961 1 35 GLN H 1 35 GLN HE21 . . 5.500 1.940 1.793 2.171 . 0 0 "[ . 1 . 2]" 1
962 1 35 GLN H 1 35 GLN HE22 . . 5.500 3.253 3.110 3.475 . 0 0 "[ . 1 . 2]" 1
963 1 35 GLN H 1 35 GLN QG . . 3.220 3.021 2.915 3.138 . 0 0 "[ . 1 . 2]" 1
964 1 35 GLN H 1 36 ASN H . . 3.520 3.092 2.782 3.233 . 0 0 "[ . 1 . 2]" 1
965 1 35 GLN H 1 36 ASN HA . . 5.160 5.171 5.087 5.216 0.056 18 0 "[ . 1 . 2]" 1
966 1 35 GLN H 1 36 ASN HB3 . . 4.800 3.917 3.841 3.979 . 0 0 "[ . 1 . 2]" 1
967 1 35 GLN H 1 66 TYR QD . . 5.500 5.226 4.981 5.489 . 0 0 "[ . 1 . 2]" 1
968 1 35 GLN H 1 66 TYR QE . . 5.470 4.921 4.632 5.183 . 0 0 "[ . 1 . 2]" 1
969 1 35 GLN HA 1 35 GLN HE21 . . 5.320 3.776 3.514 3.915 . 0 0 "[ . 1 . 2]" 1
970 1 35 GLN HA 1 35 GLN HE22 . . 5.500 5.290 5.228 5.377 . 0 0 "[ . 1 . 2]" 1
971 1 35 GLN HA 1 35 GLN QG . . 2.990 2.480 2.372 3.296 0.306 16 0 "[ . 1 . 2]" 1
972 1 35 GLN HA 1 36 ASN HD21 . . 5.150 5.334 5.289 5.389 0.239 10 0 "[ . 1 . 2]" 1
973 1 35 GLN HA 1 66 TYR HB3 . . 4.840 4.018 3.768 4.383 . 0 0 "[ . 1 . 2]" 1
974 1 35 GLN HA 1 66 TYR QD . . 3.760 2.676 2.272 3.338 . 0 0 "[ . 1 . 2]" 1
975 1 35 GLN HA 1 66 TYR QE . . 3.540 2.419 1.964 2.857 . 0 0 "[ . 1 . 2]" 1
976 1 35 GLN HB2 1 36 ASN H . . 4.720 4.363 4.289 4.528 . 0 0 "[ . 1 . 2]" 1
977 1 35 GLN HB2 1 66 TYR QD . . 4.430 4.049 2.616 4.317 . 0 0 "[ . 1 . 2]" 1
978 1 35 GLN HB2 1 66 TYR QE . . 4.480 4.423 1.861 4.580 0.100 13 0 "[ . 1 . 2]" 1
979 1 35 GLN HB3 1 35 GLN HE22 . . 5.500 4.908 3.482 5.023 . 0 0 "[ . 1 . 2]" 1
980 1 35 GLN HB3 1 36 ASN H . . 4.580 4.476 4.438 4.602 0.022 16 0 "[ . 1 . 2]" 1
981 1 35 GLN HB3 1 66 TYR QD . . 4.840 2.626 2.332 4.298 . 0 0 "[ . 1 . 2]" 1
982 1 35 GLN HB3 1 66 TYR QE . . 5.150 3.297 3.029 3.474 . 0 0 "[ . 1 . 2]" 1
983 1 35 GLN HE21 1 36 ASN H . . 5.160 4.826 4.396 5.005 . 0 0 "[ . 1 . 2]" 1
984 1 35 GLN HE21 1 66 TYR QE . . 4.970 5.011 4.968 5.040 0.070 2 0 "[ . 1 . 2]" 1
985 1 35 GLN QG 1 36 ASN H . . 4.490 4.522 4.073 4.564 0.074 15 0 "[ . 1 . 2]" 1
986 1 35 GLN QG 1 66 TYR QD . . 3.790 3.550 3.337 3.807 0.017 7 0 "[ . 1 . 2]" 1
987 1 35 GLN QG 1 66 TYR QE . . 3.160 2.716 2.575 3.467 0.307 16 0 "[ . 1 . 2]" 1
988 1 36 ASN H 1 36 ASN HB2 . . 4.140 3.868 3.757 3.897 . 0 0 "[ . 1 . 2]" 1
989 1 36 ASN H 1 36 ASN HB3 . . 3.760 2.736 2.552 2.797 . 0 0 "[ . 1 . 2]" 1
990 1 36 ASN H 1 36 ASN HD21 . . 5.200 2.749 2.597 2.875 . 0 0 "[ . 1 . 2]" 1
991 1 36 ASN H 1 36 ASN HD22 . . 5.500 4.281 4.170 4.350 . 0 0 "[ . 1 . 2]" 1
992 1 36 ASN H 1 37 PRO HD2 . . 5.150 5.146 5.011 5.242 0.092 3 0 "[ . 1 . 2]" 1
993 1 36 ASN H 1 37 PRO HD3 . . 5.500 4.473 4.369 4.685 . 0 0 "[ . 1 . 2]" 1
994 1 36 ASN H 1 66 TYR QD . . 4.740 4.028 3.864 4.396 . 0 0 "[ . 1 . 2]" 1
995 1 36 ASN HA 1 36 ASN HD22 . . 5.430 5.076 5.039 5.115 . 0 0 "[ . 1 . 2]" 1
996 1 36 ASN HA 1 37 PRO HB2 . . 4.980 5.194 5.005 5.371 0.391 7 0 "[ . 1 . 2]" 1
997 1 36 ASN HA 1 37 PRO HD2 . . 3.710 2.716 2.517 2.879 . 0 0 "[ . 1 . 2]" 1
998 1 36 ASN HA 1 37 PRO HD3 . . 3.670 1.817 1.768 1.882 . 0 0 "[ . 1 . 2]" 1
999 1 36 ASN HA 1 37 PRO HG3 . . 4.210 3.999 3.829 4.173 . 0 0 "[ . 1 . 2]" 1
1000 1 36 ASN HA 1 38 VAL H . . 4.580 4.594 4.274 4.669 0.089 16 0 "[ . 1 . 2]" 1
1001 1 36 ASN HA 1 38 VAL MG1 . . 5.120 4.861 4.625 5.157 0.037 8 0 "[ . 1 . 2]" 1
1002 1 36 ASN HA 1 39 GLY H . . 5.140 4.995 4.911 5.089 . 0 0 "[ . 1 . 2]" 1
1003 1 36 ASN HA 1 72 HIS HE1 . . 4.680 3.142 2.760 3.696 . 0 0 "[ . 1 . 2]" 1
1004 1 36 ASN HB2 1 37 PRO HD2 . . 5.370 3.131 2.727 3.422 . 0 0 "[ . 1 . 2]" 1
1005 1 36 ASN HB3 1 37 PRO HD2 . . 4.700 4.477 4.131 4.716 0.016 12 0 "[ . 1 . 2]" 1
1006 1 36 ASN HB3 1 37 PRO HD3 . . 5.080 4.459 4.377 4.508 . 0 0 "[ . 1 . 2]" 1
1007 1 36 ASN HB3 1 38 VAL H . . 5.500 5.582 5.280 5.664 0.164 16 0 "[ . 1 . 2]" 1
1008 1 36 ASN HB3 1 39 GLY H . . 5.500 4.758 4.658 4.867 . 0 0 "[ . 1 . 2]" 1
1009 1 36 ASN HD21 1 37 PRO HD2 . . 5.500 5.317 4.925 5.549 0.049 6 0 "[ . 1 . 2]" 1
1010 1 36 ASN HD21 1 38 VAL H . . 5.500 5.543 5.293 5.609 0.109 14 0 "[ . 1 . 2]" 1
1011 1 36 ASN HD22 1 38 VAL H . . 5.500 4.845 4.635 4.933 . 0 0 "[ . 1 . 2]" 1
1012 1 36 ASN HD22 1 38 VAL MG2 . . 5.350 3.945 3.102 5.373 0.023 3 0 "[ . 1 . 2]" 1
1013 1 37 PRO HA 1 39 GLY H . . 5.340 3.984 3.810 4.124 . 0 0 "[ . 1 . 2]" 1
1014 1 37 PRO HA 1 40 TYR H . . 4.450 3.205 2.955 3.419 . 0 0 "[ . 1 . 2]" 1
1015 1 37 PRO HA 1 40 TYR HB2 . . 4.380 3.019 2.928 3.077 . 0 0 "[ . 1 . 2]" 1
1016 1 37 PRO HA 1 40 TYR QD . . 3.700 2.098 1.860 2.368 . 0 0 "[ . 1 . 2]" 1
1017 1 37 PRO HA 1 41 SER H . . 4.890 4.210 4.032 4.848 . 0 0 "[ . 1 . 2]" 1
1018 1 37 PRO HA 1 63 GLY H . . 5.300 4.625 4.420 4.870 . 0 0 "[ . 1 . 2]" 1
1019 1 37 PRO HA 1 63 GLY HA2 . . 4.420 2.231 1.952 2.517 . 0 0 "[ . 1 . 2]" 1
1020 1 37 PRO HA 1 63 GLY HA3 . . 4.380 3.187 2.732 3.606 . 0 0 "[ . 1 . 2]" 1
1021 1 37 PRO HA 1 66 TYR HB3 . . 5.420 4.734 3.858 5.184 . 0 0 "[ . 1 . 2]" 1
1022 1 37 PRO HA 1 66 TYR QD . . 4.190 3.047 2.791 3.574 . 0 0 "[ . 1 . 2]" 1
1023 1 37 PRO HA 1 75 ILE MG . . 4.480 3.766 3.475 4.054 . 0 0 "[ . 1 . 2]" 1
1024 1 37 PRO HA 1 79 LEU MD2 . . 4.570 3.739 3.181 4.204 . 0 0 "[ . 1 . 2]" 1
1025 1 37 PRO HB2 1 40 TYR H . . 5.460 5.076 4.807 5.351 . 0 0 "[ . 1 . 2]" 1
1026 1 37 PRO HB2 1 63 GLY HA2 . . 4.800 4.057 3.362 4.709 . 0 0 "[ . 1 . 2]" 1
1027 1 37 PRO HB2 1 63 GLY HA3 . . 4.600 3.985 3.259 4.638 0.038 14 0 "[ . 1 . 2]" 1
1028 1 37 PRO HB2 1 66 TYR QD . . 4.900 4.947 4.691 5.075 0.175 14 0 "[ . 1 . 2]" 1
1029 1 37 PRO HB2 1 67 THR MG . . 3.610 3.188 2.564 3.562 . 0 0 "[ . 1 . 2]" 1
1030 1 37 PRO HB2 1 75 ILE HG12 . . 5.050 4.670 4.103 5.183 0.133 10 0 "[ . 1 . 2]" 1
1031 1 37 PRO HB2 1 79 LEU MD2 . . 4.400 2.992 2.360 3.920 . 0 0 "[ . 1 . 2]" 1
1032 1 37 PRO HB3 1 38 VAL H . . 4.490 3.978 3.729 4.194 . 0 0 "[ . 1 . 2]" 1
1033 1 37 PRO HB3 1 39 GLY H . . 5.210 5.470 5.431 5.511 0.301 3 0 "[ . 1 . 2]" 1
1034 1 37 PRO HB3 1 40 TYR H . . 5.500 5.229 5.070 5.421 . 0 0 "[ . 1 . 2]" 1
1035 1 37 PRO HB3 1 40 TYR QD . . 5.050 4.249 3.895 4.591 . 0 0 "[ . 1 . 2]" 1
1036 1 37 PRO HB3 1 75 ILE MG . . 3.100 2.604 2.063 3.200 0.100 18 0 "[ . 1 . 2]" 1
1037 1 37 PRO HB3 1 79 LEU MD2 . . 3.990 2.534 1.948 3.252 . 0 0 "[ . 1 . 2]" 1
1038 1 37 PRO HD2 1 38 VAL H . . 4.200 2.379 2.017 2.510 . 0 0 "[ . 1 . 2]" 1
1039 1 37 PRO HD2 1 38 VAL HB . . 5.290 5.105 3.859 5.435 0.145 20 0 "[ . 1 . 2]" 1
1040 1 37 PRO HD2 1 38 VAL MG1 . . 4.060 3.053 2.632 3.601 . 0 0 "[ . 1 . 2]" 1
1041 1 37 PRO HD2 1 66 TYR HB2 . . 5.500 4.235 3.944 4.677 . 0 0 "[ . 1 . 2]" 1
1042 1 37 PRO HD2 1 66 TYR HB3 . . 4.760 4.356 3.965 4.681 . 0 0 "[ . 1 . 2]" 1
1043 1 37 PRO HD2 1 72 HIS HD2 . . 5.000 4.265 3.476 5.043 0.043 7 0 "[ . 1 . 2]" 1
1044 1 37 PRO HD2 1 72 HIS HE1 . . 3.990 3.344 2.914 3.845 . 0 0 "[ . 1 . 2]" 1
1045 1 37 PRO HD3 1 38 VAL H . . 4.910 3.905 3.617 4.086 . 0 0 "[ . 1 . 2]" 1
1046 1 37 PRO HD3 1 38 VAL MG1 . . 4.930 4.549 4.184 5.002 0.072 3 0 "[ . 1 . 2]" 1
1047 1 37 PRO HD3 1 66 TYR HB2 . . 3.660 2.741 2.417 3.324 . 0 0 "[ . 1 . 2]" 1
1048 1 37 PRO HD3 1 66 TYR HB3 . . 4.420 2.600 2.235 2.901 . 0 0 "[ . 1 . 2]" 1
1049 1 37 PRO HD3 1 72 HIS HE1 . . 4.120 2.824 2.581 3.097 . 0 0 "[ . 1 . 2]" 1
1050 1 37 PRO HG2 1 66 TYR HB3 . . 4.750 4.767 4.609 4.940 0.190 5 0 "[ . 1 . 2]" 1
1051 1 37 PRO HG2 1 67 THR HA . . 5.440 3.974 2.730 5.431 . 0 0 "[ . 1 . 2]" 1
1052 1 37 PRO HG2 1 67 THR MG . . 4.500 2.861 2.104 3.759 . 0 0 "[ . 1 . 2]" 1
1053 1 37 PRO HG2 1 72 HIS HB3 . . 5.040 2.650 1.971 3.784 . 0 0 "[ . 1 . 2]" 1
1054 1 37 PRO HG2 1 72 HIS HE1 . . 4.490 4.461 4.245 4.570 0.080 10 0 "[ . 1 . 2]" 1
1055 1 37 PRO HG3 1 38 VAL H . . 4.400 4.150 3.598 4.525 0.125 9 0 "[ . 1 . 2]" 1
1056 1 37 PRO HG3 1 72 HIS HE1 . . 4.720 4.413 3.559 4.767 0.047 15 0 "[ . 1 . 2]" 1
1057 1 38 VAL H 1 38 VAL HB . . 2.880 3.015 2.457 3.323 0.443 10 0 "[ . 1 . 2]" 1
1058 1 38 VAL H 1 38 VAL MG1 . . 3.140 1.946 1.742 2.502 . 0 0 "[ . 1 . 2]" 1
1059 1 38 VAL H 1 38 VAL MG2 . . 3.830 3.543 3.250 3.836 0.006 9 0 "[ . 1 . 2]" 1
1060 1 38 VAL H 1 39 GLY H . . 4.100 2.745 2.452 2.864 . 0 0 "[ . 1 . 2]" 1
1061 1 38 VAL H 1 39 GLY HA2 . . 5.500 5.492 5.274 5.581 0.081 20 0 "[ . 1 . 2]" 1
1062 1 38 VAL H 1 40 TYR H . . 5.200 4.629 4.301 4.812 . 0 0 "[ . 1 . 2]" 1
1063 1 38 VAL H 1 40 TYR QD . . 5.110 5.175 5.117 5.214 0.104 19 0 "[ . 1 . 2]" 1
1064 1 38 VAL H 1 41 SER H . . 5.120 4.478 4.415 4.701 . 0 0 "[ . 1 . 2]" 1
1065 1 38 VAL H 1 75 ILE HG12 . . 4.490 4.864 4.380 5.038 0.548 12 3 "[ .- 1 + .* 2]" 1
1066 1 38 VAL HA 1 38 VAL MG1 . . 2.990 2.984 2.769 3.233 0.243 8 0 "[ . 1 . 2]" 1
1067 1 38 VAL HA 1 38 VAL MG2 . . 3.300 2.745 2.106 3.024 . 0 0 "[ . 1 . 2]" 1
1068 1 38 VAL HA 1 40 TYR H . . 4.810 4.403 3.848 4.697 . 0 0 "[ . 1 . 2]" 1
1069 1 38 VAL HA 1 41 SER H . . 4.160 2.851 2.591 3.053 . 0 0 "[ . 1 . 2]" 1
1070 1 38 VAL HA 1 41 SER HB2 . . 3.680 2.168 1.777 3.341 . 0 0 "[ . 1 . 2]" 1
1071 1 38 VAL HA 1 42 ASN H . . 4.990 3.655 3.441 4.236 . 0 0 "[ . 1 . 2]" 1
1072 1 38 VAL HA 1 75 ILE MD . . 3.190 2.136 1.872 3.326 0.136 3 0 "[ . 1 . 2]" 1
1073 1 38 VAL HA 1 75 ILE HG12 . . 4.770 4.609 2.387 4.882 0.112 9 0 "[ . 1 . 2]" 1
1074 1 38 VAL HA 1 75 ILE HG13 . . 5.230 4.274 3.380 4.989 . 0 0 "[ . 1 . 2]" 1
1075 1 38 VAL HA 1 75 ILE MG . . 5.410 3.161 2.101 4.039 . 0 0 "[ . 1 . 2]" 1
1076 1 38 VAL HB 1 39 GLY H . . 3.620 4.061 3.853 4.253 0.633 9 3 "[ . - +1 . * 2]" 1
1077 1 38 VAL HB 1 41 SER H . . 5.440 4.854 4.521 5.287 . 0 0 "[ . 1 . 2]" 1
1078 1 38 VAL MG1 1 39 GLY H . . 3.990 3.007 2.499 3.365 . 0 0 "[ . 1 . 2]" 1
1079 1 38 VAL MG1 1 75 ILE HG12 . . 4.110 3.967 3.439 4.392 0.282 1 0 "[ . 1 . 2]" 1
1080 1 38 VAL MG1 2 9 ASP HA . . 3.500 3.730 3.673 3.796 0.296 8 0 "[ . 1 . 2]" 1
1081 1 38 VAL MG1 2 9 ASP HB2 . . 3.500 2.968 2.511 3.582 0.082 3 0 "[ . 1 . 2]" 1
1082 1 38 VAL MG1 2 9 ASP HB3 . . 3.500 3.605 3.499 3.676 0.176 9 0 "[ . 1 . 2]" 1
1083 1 38 VAL MG2 1 39 GLY H . . 3.490 2.858 2.323 3.673 0.183 3 0 "[ . 1 . 2]" 1
1084 1 38 VAL MG2 1 39 GLY HA3 . . 5.460 4.075 3.579 4.994 . 0 0 "[ . 1 . 2]" 1
1085 1 38 VAL MG2 1 40 TYR H . . 4.940 4.835 4.638 5.074 0.134 3 0 "[ . 1 . 2]" 1
1086 1 38 VAL MG2 1 41 SER H . . 5.260 4.161 3.503 4.390 . 0 0 "[ . 1 . 2]" 1
1087 1 38 VAL MG2 1 41 SER HB2 . . 3.750 3.884 3.751 4.010 0.260 9 0 "[ . 1 . 2]" 1
1088 1 38 VAL MG2 1 42 ASN H . . 4.720 3.634 3.114 4.345 . 0 0 "[ . 1 . 2]" 1
1089 1 38 VAL MG2 2 9 ASP HA . . 4.000 2.861 1.806 3.994 . 0 0 "[ . 1 . 2]" 1
1090 1 38 VAL MG2 2 9 ASP HB2 . . 4.000 2.835 1.963 3.603 . 0 0 "[ . 1 . 2]" 1
1091 1 38 VAL MG2 2 9 ASP HB3 . . 4.000 2.491 2.160 3.072 . 0 0 "[ . 1 . 2]" 1
1092 1 39 GLY H 1 40 TYR H . . 4.260 2.948 2.773 3.010 . 0 0 "[ . 1 . 2]" 1
1093 1 39 GLY H 1 40 TYR QD . . 4.380 4.256 4.001 4.407 0.027 3 0 "[ . 1 . 2]" 1
1094 1 39 GLY H 1 41 SER H . . 5.050 3.688 3.547 3.792 . 0 0 "[ . 1 . 2]" 1
1095 1 40 TYR H 1 40 TYR HB2 . . 4.170 2.267 2.222 2.317 . 0 0 "[ . 1 . 2]" 1
1096 1 40 TYR H 1 40 TYR QD . . 3.980 2.330 2.210 2.531 . 0 0 "[ . 1 . 2]" 1
1097 1 40 TYR H 1 41 SER H . . 4.350 2.501 2.421 2.601 . 0 0 "[ . 1 . 2]" 1
1098 1 40 TYR H 1 44 ALA MB . . 5.500 5.565 5.512 5.592 0.092 17 0 "[ . 1 . 2]" 1
1099 1 40 TYR H 1 63 GLY H . . 5.500 5.593 5.541 5.641 0.141 19 0 "[ . 1 . 2]" 1
1100 1 40 TYR HA 1 40 TYR QD . . 4.060 2.752 2.663 2.859 . 0 0 "[ . 1 . 2]" 1
1101 1 40 TYR HA 1 44 ALA H . . 4.560 4.026 3.747 4.220 . 0 0 "[ . 1 . 2]" 1
1102 1 40 TYR HA 1 44 ALA MB . . 4.130 4.007 3.763 4.080 . 0 0 "[ . 1 . 2]" 1
1103 1 40 TYR HA 1 59 MET HB3 . . 4.780 3.126 2.899 3.271 . 0 0 "[ . 1 . 2]" 1
1104 1 40 TYR HB2 1 41 SER H . . 4.210 2.847 2.673 3.459 . 0 0 "[ . 1 . 2]" 1
1105 1 40 TYR HB2 1 63 GLY H . . 4.510 3.472 3.404 3.534 . 0 0 "[ . 1 . 2]" 1
1106 1 40 TYR HB2 1 63 GLY HA2 . . 4.140 3.152 3.049 3.212 . 0 0 "[ . 1 . 2]" 1
1107 1 40 TYR HB2 1 79 LEU MD1 . . 4.680 3.553 3.339 3.682 . 0 0 "[ . 1 . 2]" 1
1108 1 40 TYR HB3 1 41 SER H . . 4.600 3.862 3.720 4.273 . 0 0 "[ . 1 . 2]" 1
1109 1 40 TYR HB3 1 44 ALA H . . 5.500 5.015 4.811 5.172 . 0 0 "[ . 1 . 2]" 1
1110 1 40 TYR HB3 1 59 MET HA . . 4.590 3.058 3.000 3.130 . 0 0 "[ . 1 . 2]" 1
1111 1 40 TYR HB3 1 59 MET HB3 . . 4.690 2.433 2.318 2.642 . 0 0 "[ . 1 . 2]" 1
1112 1 40 TYR HB3 1 63 GLY H . . 4.630 3.282 3.221 3.334 . 0 0 "[ . 1 . 2]" 1
1113 1 40 TYR QD 1 41 SER H . . 4.580 4.180 4.020 4.582 0.002 9 0 "[ . 1 . 2]" 1
1114 1 40 TYR QD 1 59 MET HA . . 4.790 2.487 2.106 2.900 . 0 0 "[ . 1 . 2]" 1
1115 1 40 TYR QD 1 59 MET ME . . 3.550 3.312 3.006 3.477 . 0 0 "[ . 1 . 2]" 1
1116 1 40 TYR QD 1 62 GLN H . . 5.500 5.016 4.857 5.126 . 0 0 "[ . 1 . 2]" 1
1117 1 40 TYR QD 1 62 GLN HA . . 5.430 5.443 5.391 5.498 0.068 9 0 "[ . 1 . 2]" 1
1118 1 40 TYR QD 1 62 GLN HB2 . . 4.730 3.543 3.314 3.698 . 0 0 "[ . 1 . 2]" 1
1119 1 40 TYR QD 1 62 GLN HB3 . . 4.720 3.161 3.047 3.271 . 0 0 "[ . 1 . 2]" 1
1120 1 40 TYR QD 1 63 GLY H . . 4.430 3.982 3.889 4.154 . 0 0 "[ . 1 . 2]" 1
1121 1 40 TYR QD 1 63 GLY HA2 . . 4.910 2.690 2.446 2.837 . 0 0 "[ . 1 . 2]" 1
1122 1 40 TYR QD 1 63 GLY HA3 . . 4.220 3.885 3.580 4.043 . 0 0 "[ . 1 . 2]" 1
1123 1 40 TYR QD 1 79 LEU MD1 . . 4.800 4.879 4.825 4.937 0.137 13 0 "[ . 1 . 2]" 1
1124 1 41 SER H 1 41 SER HB2 . . 4.120 2.779 2.445 3.669 . 0 0 "[ . 1 . 2]" 1
1125 1 41 SER H 1 41 SER HB3 . . 3.980 3.240 2.174 3.627 . 0 0 "[ . 1 . 2]" 1
1126 1 41 SER H 1 42 ASN H . . 4.590 2.614 2.286 2.750 . 0 0 "[ . 1 . 2]" 1
1127 1 41 SER H 1 44 ALA MB . . 5.500 4.350 4.226 4.490 . 0 0 "[ . 1 . 2]" 1
1128 1 41 SER H 1 79 LEU MD1 . . 4.290 3.687 3.021 3.999 . 0 0 "[ . 1 . 2]" 1
1129 1 41 SER HA 1 44 ALA MB . . 4.230 2.455 2.230 2.895 . 0 0 "[ . 1 . 2]" 1
1130 1 41 SER HA 1 79 LEU MD1 . . 2.790 2.660 2.166 2.867 0.077 18 0 "[ . 1 . 2]" 1
1131 1 41 SER HA 1 79 LEU MD2 . . 5.500 4.952 4.524 5.285 . 0 0 "[ . 1 . 2]" 1
1132 1 41 SER HB2 1 42 ASN H . . 4.050 3.160 2.636 4.072 0.022 9 0 "[ . 1 . 2]" 1
1133 1 41 SER HB2 1 75 ILE MD . . 4.460 2.739 2.432 4.559 0.099 3 0 "[ . 1 . 2]" 1
1134 1 41 SER HB2 1 75 ILE HG12 . . 5.100 5.139 3.115 5.342 0.242 2 0 "[ . 1 . 2]" 1
1135 1 41 SER HB3 1 42 ASN H . . 4.280 3.729 2.617 4.310 0.030 12 0 "[ . 1 . 2]" 1
1136 1 41 SER HB3 1 75 ILE MD . . 4.340 2.765 2.140 4.370 0.030 3 0 "[ . 1 . 2]" 1
1137 1 41 SER HB3 1 75 ILE HG12 . . 5.400 5.105 3.001 5.446 0.046 8 0 "[ . 1 . 2]" 1
1138 1 41 SER HB3 1 79 LEU MD1 . . 3.720 2.939 2.694 3.319 . 0 0 "[ . 1 . 2]" 1
1139 1 41 SER HB3 1 79 LEU MD2 . . 5.290 4.739 3.990 5.066 . 0 0 "[ . 1 . 2]" 1
1140 1 41 SER HB3 1 79 LEU HG . . 5.490 5.608 5.240 5.859 0.369 13 0 "[ . 1 . 2]" 1
1141 1 42 ASN H 1 42 ASN HB2 . . 3.980 2.601 2.202 3.769 . 0 0 "[ . 1 . 2]" 1
1142 1 42 ASN H 1 42 ASN HB3 . . 4.090 3.438 2.858 3.588 . 0 0 "[ . 1 . 2]" 1
1143 1 42 ASN H 1 43 LYS H . . 4.380 2.490 1.985 2.783 . 0 0 "[ . 1 . 2]" 1
1144 1 42 ASN H 1 43 LYS QB . . 4.540 4.047 3.566 4.291 . 0 0 "[ . 1 . 2]" 1
1145 1 42 ASN HA 1 44 ALA H . . 4.650 3.983 3.549 4.308 . 0 0 "[ . 1 . 2]" 1
1146 1 42 ASN HA 1 45 MET H . . 4.060 3.386 2.784 3.708 . 0 0 "[ . 1 . 2]" 1
1147 1 42 ASN HA 2 8 VAL HA . . 4.500 3.429 3.088 4.079 . 0 0 "[ . 1 . 2]" 1
1148 1 42 ASN HA 2 8 VAL HB . . 5.000 3.157 2.979 3.370 . 0 0 "[ . 1 . 2]" 1
1149 1 42 ASN HA 2 8 VAL MG1 . . 5.000 3.987 3.413 4.338 . 0 0 "[ . 1 . 2]" 1
1150 1 42 ASN HA 2 8 VAL MG2 . . 4.500 4.577 4.445 4.694 0.194 9 0 "[ . 1 . 2]" 1
1151 1 42 ASN HB2 1 43 LYS H . . 4.090 2.667 2.287 3.778 . 0 0 "[ . 1 . 2]" 1
1152 1 42 ASN HB2 1 44 ALA H . . 4.980 4.772 4.615 5.155 0.175 19 0 "[ . 1 . 2]" 1
1153 1 42 ASN HB3 1 43 LYS H . . 4.490 3.511 3.099 4.113 . 0 0 "[ . 1 . 2]" 1
1154 1 42 ASN HB3 1 45 MET H . . 5.500 5.463 5.086 5.589 0.089 5 0 "[ . 1 . 2]" 1
1155 1 43 LYS H 1 43 LYS QB . . 3.790 2.149 2.126 2.215 . 0 0 "[ . 1 . 2]" 1
1156 1 43 LYS H 1 44 ALA H . . 4.000 2.690 2.600 2.771 . 0 0 "[ . 1 . 2]" 1
1157 1 43 LYS H 1 44 ALA MB . . 4.660 4.395 4.333 4.453 . 0 0 "[ . 1 . 2]" 1
1158 1 43 LYS H 1 45 MET H . . 5.500 4.554 4.370 4.655 . 0 0 "[ . 1 . 2]" 1
1159 1 43 LYS HA 1 46 ALA H . . 4.400 3.914 3.784 4.008 . 0 0 "[ . 1 . 2]" 1
1160 1 43 LYS HA 1 46 ALA MB . . 3.710 2.924 2.630 3.068 . 0 0 "[ . 1 . 2]" 1
1161 1 43 LYS HA 1 47 LEU MD1 . . 5.500 4.608 4.307 4.782 . 0 0 "[ . 1 . 2]" 1
1162 1 43 LYS QB 1 44 ALA H . . 3.880 2.814 2.697 2.975 . 0 0 "[ . 1 . 2]" 1
1163 1 43 LYS QB 1 44 ALA MB . . 5.040 3.942 3.875 4.062 . 0 0 "[ . 1 . 2]" 1
1164 1 43 LYS QB 1 47 LEU MD1 . . 5.500 4.174 3.877 4.398 . 0 0 "[ . 1 . 2]" 1
1165 1 44 ALA H 1 44 ALA MB . . 3.000 2.250 2.225 2.286 . 0 0 "[ . 1 . 2]" 1
1166 1 44 ALA H 1 45 MET H . . 4.170 2.651 2.455 2.747 . 0 0 "[ . 1 . 2]" 1
1167 1 44 ALA H 1 47 LEU MD1 . . 5.440 4.393 4.210 4.562 . 0 0 "[ . 1 . 2]" 1
1168 1 44 ALA H 1 59 MET HB2 . . 4.960 4.496 4.383 4.718 . 0 0 "[ . 1 . 2]" 1
1169 1 44 ALA H 1 59 MET HB3 . . 4.980 3.935 3.795 4.202 . 0 0 "[ . 1 . 2]" 1
1170 1 44 ALA HA 1 46 ALA H . . 4.530 4.208 4.070 4.348 . 0 0 "[ . 1 . 2]" 1
1171 1 44 ALA MB 1 45 MET H . . 3.420 2.401 2.280 2.527 . 0 0 "[ . 1 . 2]" 1
1172 1 44 ALA MB 1 47 LEU MD1 . . 5.480 3.561 3.429 3.702 . 0 0 "[ . 1 . 2]" 1
1173 1 44 ALA MB 1 48 ILE MD . . 3.710 3.190 3.004 3.303 . 0 0 "[ . 1 . 2]" 1
1174 1 44 ALA MB 1 59 MET H . . 4.530 4.177 4.094 4.275 . 0 0 "[ . 1 . 2]" 1
1175 1 44 ALA MB 1 59 MET HA . . 4.210 4.220 4.104 4.267 0.057 9 0 "[ . 1 . 2]" 1
1176 1 44 ALA MB 1 59 MET HB2 . . 4.340 2.011 1.971 2.048 . 0 0 "[ . 1 . 2]" 1
1177 1 44 ALA MB 1 59 MET HB3 . . 3.880 2.149 2.072 2.183 . 0 0 "[ . 1 . 2]" 1
1178 1 44 ALA MB 1 59 MET ME . . 4.750 4.763 4.690 4.782 0.032 14 0 "[ . 1 . 2]" 1
1179 1 44 ALA MB 1 59 MET HG2 . . 3.790 3.721 3.536 3.821 0.031 18 0 "[ . 1 . 2]" 1
1180 1 44 ALA MB 1 59 MET HG3 . . 4.490 2.907 2.730 3.065 . 0 0 "[ . 1 . 2]" 1
1181 1 44 ALA MB 1 60 CYS H . . 4.530 3.450 3.282 3.580 . 0 0 "[ . 1 . 2]" 1
1182 1 44 ALA MB 1 60 CYS HA . . 4.710 3.591 3.305 3.772 . 0 0 "[ . 1 . 2]" 1
1183 1 44 ALA MB 1 60 CYS HB2 . . 5.480 4.527 4.395 4.662 . 0 0 "[ . 1 . 2]" 1
1184 1 45 MET H 1 46 ALA H . . 3.960 2.735 2.632 2.864 . 0 0 "[ . 1 . 2]" 1
1185 1 45 MET H 1 46 ALA HA . . 5.500 5.359 5.278 5.458 . 0 0 "[ . 1 . 2]" 1
1186 1 45 MET H 1 46 ALA MB . . 4.960 4.347 4.216 4.463 . 0 0 "[ . 1 . 2]" 1
1187 1 45 MET H 1 47 LEU H . . 5.500 4.246 4.129 4.437 . 0 0 "[ . 1 . 2]" 1
1188 1 45 MET H 1 48 ILE MD . . 4.630 4.112 3.833 4.242 . 0 0 "[ . 1 . 2]" 1
1189 1 45 MET H 1 82 ARG QD . . 4.600 4.666 4.582 4.722 0.122 10 0 "[ . 1 . 2]" 1
1190 1 45 MET ME 1 46 ALA H . . 4.870 4.664 4.552 4.883 0.013 14 0 "[ . 1 . 2]" 1
1191 1 45 MET ME 1 46 ALA HA . . 5.150 4.624 4.349 4.835 . 0 0 "[ . 1 . 2]" 1
1192 1 45 MET ME 1 48 ILE H . . 4.710 3.556 3.422 3.912 . 0 0 "[ . 1 . 2]" 1
1193 1 45 MET ME 1 48 ILE HB . . 3.320 2.065 1.976 2.245 . 0 0 "[ . 1 . 2]" 1
1194 1 45 MET ME 1 48 ILE MD . . 3.710 2.427 2.082 3.227 . 0 0 "[ . 1 . 2]" 1
1195 1 45 MET ME 1 48 ILE HG12 . . 4.000 2.713 2.421 3.220 . 0 0 "[ . 1 . 2]" 1
1196 1 45 MET ME 1 48 ILE HG13 . . 4.370 3.921 3.647 4.406 0.036 14 0 "[ . 1 . 2]" 1
1197 1 45 MET ME 1 48 ILE MG . . 3.380 2.208 2.090 2.376 . 0 0 "[ . 1 . 2]" 1
1198 1 45 MET ME 1 49 LYS H . . 4.610 3.489 3.321 3.821 . 0 0 "[ . 1 . 2]" 1
1199 1 45 MET ME 1 49 LYS HA . . 5.460 4.848 4.745 4.961 . 0 0 "[ . 1 . 2]" 1
1200 1 45 MET ME 1 49 LYS HD2 . . 4.160 4.206 4.172 4.232 0.072 1 0 "[ . 1 . 2]" 1
1201 1 45 MET ME 1 49 LYS HD3 . . 4.440 3.421 2.988 3.607 . 0 0 "[ . 1 . 2]" 1
1202 1 45 MET ME 1 49 LYS HE3 . . 4.050 3.529 3.306 3.790 . 0 0 "[ . 1 . 2]" 1
1203 1 45 MET ME 1 49 LYS HG2 . . 5.420 4.814 2.973 5.193 . 0 0 "[ . 1 . 2]" 1
1204 1 46 ALA H 1 46 ALA MB . . 3.230 2.168 2.137 2.185 . 0 0 "[ . 1 . 2]" 1
1205 1 46 ALA H 1 47 LEU H . . 4.160 2.627 2.507 2.872 . 0 0 "[ . 1 . 2]" 1
1206 1 46 ALA H 1 47 LEU MD1 . . 5.340 5.156 5.087 5.289 . 0 0 "[ . 1 . 2]" 1
1207 1 46 ALA H 1 48 ILE H . . 5.500 4.088 3.946 4.237 . 0 0 "[ . 1 . 2]" 1
1208 1 46 ALA HA 1 49 LYS H . . 4.790 3.278 3.083 3.411 . 0 0 "[ . 1 . 2]" 1
1209 1 46 ALA HA 1 49 LYS HB2 . . 4.610 2.660 2.389 3.159 . 0 0 "[ . 1 . 2]" 1
1210 1 46 ALA HA 1 49 LYS HB3 . . 4.480 3.579 3.301 4.514 0.034 14 0 "[ . 1 . 2]" 1
1211 1 46 ALA HA 1 49 LYS HE3 . . 4.690 4.394 4.073 4.796 0.106 18 0 "[ . 1 . 2]" 1
1212 1 46 ALA HA 1 50 LEU H . . 5.160 4.563 4.423 4.936 . 0 0 "[ . 1 . 2]" 1
1213 1 46 ALA MB 1 47 LEU H . . 3.680 2.627 2.337 2.735 . 0 0 "[ . 1 . 2]" 1
1214 1 46 ALA MB 1 50 LEU MD1 . . 5.480 2.976 2.769 4.068 . 0 0 "[ . 1 . 2]" 1
1215 1 47 LEU H 1 47 LEU HB3 . . 4.100 3.571 3.553 3.592 . 0 0 "[ . 1 . 2]" 1
1216 1 47 LEU H 1 47 LEU MD1 . . 4.410 3.476 3.392 3.571 . 0 0 "[ . 1 . 2]" 1
1217 1 47 LEU H 1 47 LEU MD2 . . 3.630 3.664 3.602 3.699 0.069 15 0 "[ . 1 . 2]" 1
1218 1 47 LEU H 1 48 ILE H . . 4.360 2.734 2.642 3.022 . 0 0 "[ . 1 . 2]" 1
1219 1 47 LEU H 1 48 ILE HA . . 5.430 5.358 5.292 5.550 0.120 14 0 "[ . 1 . 2]" 1
1220 1 47 LEU H 1 50 LEU H . . 5.500 4.749 4.687 4.902 . 0 0 "[ . 1 . 2]" 1
1221 1 47 LEU H 1 50 LEU MD1 . . 5.500 3.970 3.768 5.595 0.095 14 0 "[ . 1 . 2]" 1
1222 1 47 LEU H 1 52 GLU HB2 . . 5.500 5.395 5.286 5.510 0.010 5 0 "[ . 1 . 2]" 1
1223 1 47 LEU H 1 56 ALA MB . . 4.310 4.043 3.928 4.186 . 0 0 "[ . 1 . 2]" 1
1224 1 47 LEU HA 1 47 LEU MD2 . . 3.020 1.982 1.957 2.036 . 0 0 "[ . 1 . 2]" 1
1225 1 47 LEU HA 1 47 LEU HG . . 4.050 2.822 2.730 2.898 . 0 0 "[ . 1 . 2]" 1
1226 1 47 LEU HA 1 48 ILE HA . . 4.900 4.754 4.694 4.794 . 0 0 "[ . 1 . 2]" 1
1227 1 47 LEU HA 1 49 LYS H . . 5.500 4.540 4.150 4.654 . 0 0 "[ . 1 . 2]" 1
1228 1 47 LEU HA 1 50 LEU H . . 4.210 3.141 3.100 3.206 . 0 0 "[ . 1 . 2]" 1
1229 1 47 LEU HA 1 50 LEU HB3 . . 4.490 3.746 3.604 4.234 . 0 0 "[ . 1 . 2]" 1
1230 1 47 LEU HA 1 50 LEU MD1 . . 3.920 2.351 2.128 4.111 0.191 14 0 "[ . 1 . 2]" 1
1231 1 47 LEU HA 1 52 GLU H . . 4.690 3.412 3.248 3.579 . 0 0 "[ . 1 . 2]" 1
1232 1 47 LEU HA 1 52 GLU HG2 . . 5.050 4.791 4.535 5.115 0.065 5 0 "[ . 1 . 2]" 1
1233 1 47 LEU HA 1 52 GLU HG3 . . 4.310 3.975 3.361 4.368 0.058 14 0 "[ . 1 . 2]" 1
1234 1 47 LEU HB3 1 52 GLU HB2 . . 4.830 2.615 2.353 2.848 . 0 0 "[ . 1 . 2]" 1
1235 1 47 LEU MD1 1 52 GLU HA . . 5.500 5.554 5.518 5.572 0.072 17 0 "[ . 1 . 2]" 1
1236 1 47 LEU MD1 1 52 GLU HB2 . . 5.500 3.723 3.354 3.943 . 0 0 "[ . 1 . 2]" 1
1237 1 47 LEU MD1 1 52 GLU HB3 . . 5.140 4.107 3.915 4.381 . 0 0 "[ . 1 . 2]" 1
1238 1 47 LEU MD1 1 55 GLN H . . 4.960 3.893 3.547 4.012 . 0 0 "[ . 1 . 2]" 1
1239 1 47 LEU MD1 1 55 GLN HA . . 3.990 3.994 3.787 4.054 0.064 11 0 "[ . 1 . 2]" 1
1240 1 47 LEU MD1 1 55 GLN HB2 . . 3.770 1.995 1.956 2.018 . 0 0 "[ . 1 . 2]" 1
1241 1 47 LEU MD1 1 55 GLN HB3 . . 3.890 2.512 2.449 2.545 . 0 0 "[ . 1 . 2]" 1
1242 1 47 LEU MD1 1 55 GLN HE21 . . 5.500 5.373 4.579 5.499 . 0 0 "[ . 1 . 2]" 1
1243 1 47 LEU MD1 1 55 GLN HG3 . . 4.320 3.863 3.746 4.462 0.142 15 0 "[ . 1 . 2]" 1
1244 1 47 LEU MD1 1 56 ALA H . . 3.760 2.735 2.547 2.811 . 0 0 "[ . 1 . 2]" 1
1245 1 47 LEU MD1 1 56 ALA HA . . 3.030 2.411 2.301 2.490 . 0 0 "[ . 1 . 2]" 1
1246 1 47 LEU MD1 1 56 ALA MB . . 3.770 2.946 2.847 3.058 . 0 0 "[ . 1 . 2]" 1
1247 1 47 LEU MD1 1 59 MET H . . 4.970 4.227 4.069 4.413 . 0 0 "[ . 1 . 2]" 1
1248 1 47 LEU MD1 1 59 MET HA . . 5.500 5.252 5.123 5.454 . 0 0 "[ . 1 . 2]" 1
1249 1 47 LEU MD1 1 59 MET HB2 . . 5.190 3.645 3.478 3.804 . 0 0 "[ . 1 . 2]" 1
1250 1 47 LEU MD1 1 59 MET ME . . 4.620 3.541 3.168 3.744 . 0 0 "[ . 1 . 2]" 1
1251 1 47 LEU MD1 1 59 MET HG2 . . 4.760 2.646 2.351 2.864 . 0 0 "[ . 1 . 2]" 1
1252 1 47 LEU MD1 1 59 MET HG3 . . 4.250 2.291 2.183 2.475 . 0 0 "[ . 1 . 2]" 1
1253 1 47 LEU MD2 1 50 LEU H . . 4.580 4.608 4.499 4.660 0.080 5 0 "[ . 1 . 2]" 1
1254 1 47 LEU MD2 1 51 GLY H . . 5.250 5.158 4.928 5.277 0.027 16 0 "[ . 1 . 2]" 1
1255 1 47 LEU MD2 1 52 GLU H . . 3.900 3.759 3.672 3.834 . 0 0 "[ . 1 . 2]" 1
1256 1 47 LEU MD2 1 52 GLU HA . . 4.780 4.401 4.244 4.651 . 0 0 "[ . 1 . 2]" 1
1257 1 47 LEU MD2 1 52 GLU HB2 . . 3.090 1.979 1.910 2.022 . 0 0 "[ . 1 . 2]" 1
1258 1 47 LEU MD2 1 52 GLU HB3 . . 3.520 2.582 2.271 3.033 . 0 0 "[ . 1 . 2]" 1
1259 1 47 LEU MD2 1 52 GLU HG2 . . 4.200 3.967 3.829 4.145 . 0 0 "[ . 1 . 2]" 1
1260 1 47 LEU MD2 1 52 GLU HG3 . . 4.200 3.031 2.976 3.118 . 0 0 "[ . 1 . 2]" 1
1261 1 47 LEU MD2 1 55 GLN H . . 5.360 4.314 4.086 4.608 . 0 0 "[ . 1 . 2]" 1
1262 1 47 LEU MD2 1 55 GLN HB2 . . 4.610 2.565 2.382 2.821 . 0 0 "[ . 1 . 2]" 1
1263 1 47 LEU MD2 1 55 GLN HB3 . . 3.950 3.502 3.376 3.655 . 0 0 "[ . 1 . 2]" 1
1264 1 47 LEU MD2 1 55 GLN HG3 . . 4.710 3.542 3.180 4.846 0.136 15 0 "[ . 1 . 2]" 1
1265 1 47 LEU MD2 1 56 ALA H . . 4.460 3.977 3.769 4.211 . 0 0 "[ . 1 . 2]" 1
1266 1 47 LEU HG 1 56 ALA H . . 5.280 5.327 5.179 5.378 0.098 5 0 "[ . 1 . 2]" 1
1267 1 48 ILE H 1 48 ILE HB . . 3.690 2.202 2.172 2.229 . 0 0 "[ . 1 . 2]" 1
1268 1 48 ILE H 1 48 ILE MD . . 3.600 2.195 2.124 2.266 . 0 0 "[ . 1 . 2]" 1
1269 1 48 ILE H 1 48 ILE HG13 . . 4.380 3.771 3.693 3.841 . 0 0 "[ . 1 . 2]" 1
1270 1 48 ILE H 1 48 ILE MG . . 3.630 3.637 3.613 3.658 0.028 18 0 "[ . 1 . 2]" 1
1271 1 48 ILE H 1 49 LYS H . . 4.590 2.588 2.502 2.631 . 0 0 "[ . 1 . 2]" 1
1272 1 48 ILE H 1 50 LEU H . . 5.260 3.688 3.609 3.974 . 0 0 "[ . 1 . 2]" 1
1273 1 48 ILE H 1 51 GLY H . . 5.500 4.428 4.255 4.650 . 0 0 "[ . 1 . 2]" 1
1274 1 48 ILE H 1 52 GLU H . . 5.300 5.069 4.936 5.155 . 0 0 "[ . 1 . 2]" 1
1275 1 48 ILE H 1 53 TYR QD . . 5.500 4.752 4.510 5.045 . 0 0 "[ . 1 . 2]" 1
1276 1 48 ILE H 1 53 TYR QE . . 5.480 5.177 4.898 5.414 . 0 0 "[ . 1 . 2]" 1
1277 1 48 ILE H 1 56 ALA MB . . 4.620 3.456 3.385 3.540 . 0 0 "[ . 1 . 2]" 1
1278 1 48 ILE HA 1 48 ILE MD . . 3.490 2.862 2.729 2.974 . 0 0 "[ . 1 . 2]" 1
1279 1 48 ILE HA 1 48 ILE HG12 . . 3.920 3.626 3.575 3.656 . 0 0 "[ . 1 . 2]" 1
1280 1 48 ILE HA 1 48 ILE HG13 . . 3.650 2.343 2.289 2.383 . 0 0 "[ . 1 . 2]" 1
1281 1 48 ILE HA 1 48 ILE MG . . 3.220 2.639 2.605 2.704 . 0 0 "[ . 1 . 2]" 1
1282 1 48 ILE HA 1 50 LEU H . . 4.780 3.732 3.608 3.941 . 0 0 "[ . 1 . 2]" 1
1283 1 48 ILE HA 1 51 GLY H . . 4.340 3.035 2.973 3.208 . 0 0 "[ . 1 . 2]" 1
1284 1 48 ILE HA 1 51 GLY HA3 . . 4.630 4.821 4.748 4.878 0.248 2 0 "[ . 1 . 2]" 1
1285 1 48 ILE HA 1 52 GLU H . . 4.540 3.988 3.777 4.147 . 0 0 "[ . 1 . 2]" 1
1286 1 48 ILE HA 1 53 TYR QD . . 3.000 2.390 2.097 2.683 . 0 0 "[ . 1 . 2]" 1
1287 1 48 ILE HA 1 53 TYR QE . . 3.240 2.526 2.220 2.813 . 0 0 "[ . 1 . 2]" 1
1288 1 48 ILE HA 1 56 ALA MB . . 4.520 3.692 3.551 3.770 . 0 0 "[ . 1 . 2]" 1
1289 1 48 ILE HA 1 85 LEU MD1 . . 4.400 3.774 3.644 3.891 . 0 0 "[ . 1 . 2]" 1
1290 1 48 ILE HA 1 86 ALA HA . . 4.580 4.540 4.425 4.605 0.025 8 0 "[ . 1 . 2]" 1
1291 1 48 ILE HB 1 48 ILE MD . . 3.310 2.316 2.262 2.362 . 0 0 "[ . 1 . 2]" 1
1292 1 48 ILE HB 1 49 LYS H . . 4.340 2.544 2.460 2.828 . 0 0 "[ . 1 . 2]" 1
1293 1 48 ILE HB 1 49 LYS HD3 . . 5.500 3.970 3.551 4.158 . 0 0 "[ . 1 . 2]" 1
1294 1 48 ILE HB 1 53 TYR QD . . 5.150 4.667 4.479 4.863 . 0 0 "[ . 1 . 2]" 1
1295 1 48 ILE HB 1 53 TYR QE . . 4.790 4.389 4.174 4.548 . 0 0 "[ . 1 . 2]" 1
1296 1 48 ILE HB 1 56 ALA MB . . 4.830 4.418 4.357 4.461 . 0 0 "[ . 1 . 2]" 1
1297 1 48 ILE HB 1 85 LEU MD1 . . 4.170 3.950 3.780 4.140 . 0 0 "[ . 1 . 2]" 1
1298 1 48 ILE MD 1 49 LYS H . . 4.710 4.048 3.979 4.165 . 0 0 "[ . 1 . 2]" 1
1299 1 48 ILE MD 1 53 TYR QD . . 4.050 3.239 2.965 3.502 . 0 0 "[ . 1 . 2]" 1
1300 1 48 ILE MD 1 53 TYR QE . . 5.130 4.312 4.033 4.490 . 0 0 "[ . 1 . 2]" 1
1301 1 48 ILE MD 1 56 ALA MB . . 3.190 1.833 1.751 1.877 . 0 0 "[ . 1 . 2]" 1
1302 1 48 ILE MD 1 81 TYR QD . . 5.260 5.187 5.029 5.272 0.012 16 0 "[ . 1 . 2]" 1
1303 1 48 ILE MD 1 82 ARG H . . 5.500 4.841 4.735 4.968 . 0 0 "[ . 1 . 2]" 1
1304 1 48 ILE MD 1 82 ARG HA . . 3.650 3.667 3.489 3.753 0.103 3 0 "[ . 1 . 2]" 1
1305 1 48 ILE MD 1 82 ARG HB2 . . 5.270 2.359 1.982 2.891 . 0 0 "[ . 1 . 2]" 1
1306 1 48 ILE MD 1 82 ARG HB3 . . 4.430 2.692 1.877 3.409 . 0 0 "[ . 1 . 2]" 1
1307 1 48 ILE MD 1 82 ARG QD . . 3.850 3.904 3.780 3.980 0.130 13 0 "[ . 1 . 2]" 1
1308 1 48 ILE MD 1 86 ALA H . . 4.850 4.010 3.858 4.189 . 0 0 "[ . 1 . 2]" 1
1309 1 48 ILE HG12 1 48 ILE MG . . 3.580 2.171 2.128 2.202 . 0 0 "[ . 1 . 2]" 1
1310 1 48 ILE HG12 1 53 TYR QD . . 4.380 3.785 3.712 3.996 . 0 0 "[ . 1 . 2]" 1
1311 1 48 ILE HG12 1 53 TYR QE . . 3.930 3.934 3.800 3.960 0.030 13 0 "[ . 1 . 2]" 1
1312 1 48 ILE HG12 1 86 ALA HA . . 4.840 4.489 4.332 4.658 . 0 0 "[ . 1 . 2]" 1
1313 1 48 ILE HG13 1 53 TYR QD . . 3.290 2.062 1.951 2.278 . 0 0 "[ . 1 . 2]" 1
1314 1 48 ILE HG13 1 53 TYR QE . . 4.670 2.856 2.581 2.997 . 0 0 "[ . 1 . 2]" 1
1315 1 48 ILE HG13 1 56 ALA MB . . 3.350 3.362 3.167 3.437 0.087 3 0 "[ . 1 . 2]" 1
1316 1 48 ILE HG13 1 86 ALA HA . . 4.420 3.264 3.153 3.404 . 0 0 "[ . 1 . 2]" 1
1317 1 48 ILE MG 1 49 LYS H . . 3.780 2.773 2.704 3.107 . 0 0 "[ . 1 . 2]" 1
1318 1 48 ILE MG 1 49 LYS HA . . 4.480 3.024 2.976 3.125 . 0 0 "[ . 1 . 2]" 1
1319 1 48 ILE MG 1 49 LYS HB3 . . 4.650 4.837 4.729 4.871 0.221 9 0 "[ . 1 . 2]" 1
1320 1 48 ILE MG 1 49 LYS HE3 . . 4.740 4.416 4.155 4.792 0.052 14 0 "[ . 1 . 2]" 1
1321 1 48 ILE MG 1 49 LYS HG2 . . 5.500 4.736 3.422 4.961 . 0 0 "[ . 1 . 2]" 1
1322 1 48 ILE MG 1 51 GLY H . . 5.050 4.189 4.101 4.300 . 0 0 "[ . 1 . 2]" 1
1323 1 48 ILE MG 1 53 TYR QD . . 3.900 3.441 3.333 3.610 . 0 0 "[ . 1 . 2]" 1
1324 1 48 ILE MG 1 53 TYR QE . . 2.720 1.929 1.908 1.969 . 0 0 "[ . 1 . 2]" 1
1325 1 48 ILE MG 1 85 LEU HB2 . . 4.810 4.777 4.631 4.874 0.064 11 0 "[ . 1 . 2]" 1
1326 1 48 ILE MG 1 85 LEU MD1 . . 2.760 1.974 1.934 2.015 . 0 0 "[ . 1 . 2]" 1
1327 1 48 ILE MG 1 85 LEU MD2 . . 2.930 2.542 2.359 2.715 . 0 0 "[ . 1 . 2]" 1
1328 1 48 ILE MG 1 86 ALA H . . 5.390 5.041 4.829 5.141 . 0 0 "[ . 1 . 2]" 1
1329 1 48 ILE MG 1 86 ALA HA . . 4.230 4.391 4.346 4.442 0.212 10 0 "[ . 1 . 2]" 1
1330 1 49 LYS H 1 49 LYS HB2 . . 3.720 1.982 1.890 2.575 . 0 0 "[ . 1 . 2]" 1
1331 1 49 LYS H 1 49 LYS HB3 . . 3.950 3.200 3.111 3.549 . 0 0 "[ . 1 . 2]" 1
1332 1 49 LYS H 1 49 LYS HD2 . . 4.430 4.508 4.062 4.592 0.162 19 0 "[ . 1 . 2]" 1
1333 1 49 LYS H 1 49 LYS HD3 . . 4.220 3.064 3.025 3.148 . 0 0 "[ . 1 . 2]" 1
1334 1 49 LYS H 1 49 LYS HE2 . . 4.620 2.874 2.598 4.236 . 0 0 "[ . 1 . 2]" 1
1335 1 49 LYS H 1 49 LYS HE3 . . 4.910 4.195 4.032 4.931 0.021 18 0 "[ . 1 . 2]" 1
1336 1 49 LYS H 1 49 LYS HG2 . . 4.140 3.982 1.969 4.213 0.073 2 0 "[ . 1 . 2]" 1
1337 1 49 LYS H 1 49 LYS HG3 . . 4.150 4.110 3.470 4.201 0.051 15 0 "[ . 1 . 2]" 1
1338 1 49 LYS H 1 50 LEU H . . 4.170 2.759 2.573 2.842 . 0 0 "[ . 1 . 2]" 1
1339 1 49 LYS H 1 51 GLY H . . 5.080 3.900 3.644 3.972 . 0 0 "[ . 1 . 2]" 1
1340 1 49 LYS HA 1 49 LYS HD2 . . 3.310 3.264 2.429 3.382 0.072 13 0 "[ . 1 . 2]" 1
1341 1 49 LYS HA 1 49 LYS HD3 . . 3.480 2.158 2.090 2.412 . 0 0 "[ . 1 . 2]" 1
1342 1 49 LYS HA 1 49 LYS HE2 . . 4.550 3.891 3.736 4.573 0.023 14 0 "[ . 1 . 2]" 1
1343 1 49 LYS HA 1 49 LYS HE3 . . 4.400 4.465 4.442 4.560 0.160 14 0 "[ . 1 . 2]" 1
1344 1 49 LYS HA 1 49 LYS HG2 . . 4.080 3.461 3.245 3.492 . 0 0 "[ . 1 . 2]" 1
1345 1 49 LYS HA 1 49 LYS HG3 . . 4.100 2.421 2.258 3.716 . 0 0 "[ . 1 . 2]" 1
1346 1 49 LYS HA 1 50 LEU HA . . 5.130 4.658 4.616 4.770 . 0 0 "[ . 1 . 2]" 1
1347 1 49 LYS HA 1 51 GLY H . . 4.790 3.937 3.698 4.196 . 0 0 "[ . 1 . 2]" 1
1348 1 49 LYS HB2 1 49 LYS HE3 . . 5.030 2.985 2.797 4.386 . 0 0 "[ . 1 . 2]" 1
1349 1 49 LYS HB2 1 50 LEU H . . 4.450 3.674 3.085 3.783 . 0 0 "[ . 1 . 2]" 1
1350 1 49 LYS HB3 1 49 LYS HD3 . . 4.150 3.696 3.296 3.754 . 0 0 "[ . 1 . 2]" 1
1351 1 49 LYS HB3 1 49 LYS HE2 . . 4.090 3.920 3.823 4.341 0.251 18 0 "[ . 1 . 2]" 1
1352 1 49 LYS HB3 1 49 LYS HE3 . . 4.820 3.869 3.579 3.966 . 0 0 "[ . 1 . 2]" 1
1353 1 49 LYS HB3 1 50 LEU H . . 4.530 3.708 3.558 4.307 . 0 0 "[ . 1 . 2]" 1
1354 1 49 LYS HB3 1 51 GLY H . . 5.500 5.215 5.068 5.523 0.023 18 0 "[ . 1 . 2]" 1
1355 1 49 LYS HE2 1 49 LYS HG3 . . 4.230 3.767 2.573 3.942 . 0 0 "[ . 1 . 2]" 1
1356 1 50 LEU H 1 50 LEU HB2 . . 3.910 2.309 2.274 2.468 . 0 0 "[ . 1 . 2]" 1
1357 1 50 LEU H 1 50 LEU HB3 . . 3.440 3.567 3.547 3.618 0.178 14 0 "[ . 1 . 2]" 1
1358 1 50 LEU H 1 50 LEU MD1 . . 4.240 3.692 3.611 3.807 . 0 0 "[ . 1 . 2]" 1
1359 1 50 LEU H 1 50 LEU MD2 . . 4.270 3.835 1.780 3.993 . 0 0 "[ . 1 . 2]" 1
1360 1 50 LEU H 1 50 LEU HG . . 4.520 2.928 2.798 3.793 . 0 0 "[ . 1 . 2]" 1
1361 1 50 LEU H 1 51 GLY H . . 3.820 1.944 1.901 2.008 . 0 0 "[ . 1 . 2]" 1
1362 1 50 LEU H 1 51 GLY HA3 . . 4.600 4.704 4.674 4.782 0.182 14 0 "[ . 1 . 2]" 1
1363 1 50 LEU H 1 52 GLU H . . 4.530 3.390 3.190 3.582 . 0 0 "[ . 1 . 2]" 1
1364 1 50 LEU H 1 52 GLU HB2 . . 5.380 4.854 4.394 5.361 . 0 0 "[ . 1 . 2]" 1
1365 1 50 LEU HA 1 50 LEU MD1 . . 4.100 3.796 2.632 3.885 . 0 0 "[ . 1 . 2]" 1
1366 1 50 LEU HA 1 50 LEU MD2 . . 2.840 2.134 2.041 2.863 0.023 14 0 "[ . 1 . 2]" 1
1367 1 50 LEU HA 1 50 LEU HG . . 4.090 2.949 2.853 3.947 . 0 0 "[ . 1 . 2]" 1
1368 1 50 LEU HA 1 52 GLU H . . 4.940 4.421 4.303 4.576 . 0 0 "[ . 1 . 2]" 1
1369 1 50 LEU HA 1 52 GLU HG2 . . 5.500 4.865 4.341 5.532 0.032 8 0 "[ . 1 . 2]" 1
1370 1 50 LEU HA 1 52 GLU HG3 . . 5.100 4.888 4.376 5.225 0.125 7 0 "[ . 1 . 2]" 1
1371 1 50 LEU HB2 1 50 LEU MD1 . . 3.470 2.318 2.233 3.259 . 0 0 "[ . 1 . 2]" 1
1372 1 50 LEU HB2 1 50 LEU MD2 . . 3.280 3.177 2.286 3.229 . 0 0 "[ . 1 . 2]" 1
1373 1 50 LEU HB2 1 51 GLY H . . 4.630 3.093 2.837 3.251 . 0 0 "[ . 1 . 2]" 1
1374 1 50 LEU HB2 1 52 GLU H . . 4.340 2.679 2.228 2.800 . 0 0 "[ . 1 . 2]" 1
1375 1 50 LEU HB2 1 52 GLU HG3 . . 4.180 3.010 2.332 3.499 . 0 0 "[ . 1 . 2]" 1
1376 1 50 LEU HB3 1 51 GLY H . . 4.140 3.973 3.792 4.074 . 0 0 "[ . 1 . 2]" 1
1377 1 50 LEU HB3 1 52 GLU H . . 4.450 3.393 3.303 3.510 . 0 0 "[ . 1 . 2]" 1
1378 1 50 LEU MD1 1 51 GLY H . . 5.500 4.825 4.592 4.980 . 0 0 "[ . 1 . 2]" 1
1379 1 50 LEU MD1 1 52 GLU H . . 5.120 4.384 4.211 5.059 . 0 0 "[ . 1 . 2]" 1
1380 1 50 LEU MD1 1 52 GLU HB2 . . 5.500 3.853 3.504 4.842 . 0 0 "[ . 1 . 2]" 1
1381 1 50 LEU MD1 1 52 GLU HG2 . . 4.530 4.331 3.981 4.567 0.037 4 0 "[ . 1 . 2]" 1
1382 1 50 LEU MD1 1 52 GLU HG3 . . 4.570 3.340 3.154 3.993 . 0 0 "[ . 1 . 2]" 1
1383 1 50 LEU MD2 1 51 GLY H . . 5.130 4.763 3.420 4.867 . 0 0 "[ . 1 . 2]" 1
1384 1 50 LEU MD2 1 52 GLU HG3 . . 5.160 4.196 4.026 4.375 . 0 0 "[ . 1 . 2]" 1
1385 1 51 GLY H 1 52 GLU H . . 3.870 2.450 2.350 2.542 . 0 0 "[ . 1 . 2]" 1
1386 1 51 GLY H 1 52 GLU HA . . 5.160 5.174 5.070 5.257 0.097 10 0 "[ . 1 . 2]" 1
1387 1 51 GLY H 1 52 GLU HB2 . . 4.790 4.672 4.514 4.822 0.032 5 0 "[ . 1 . 2]" 1
1388 1 51 GLY H 1 52 GLU HG2 . . 4.840 4.597 4.246 4.913 0.073 19 0 "[ . 1 . 2]" 1
1389 1 51 GLY H 1 53 TYR H . . 5.390 4.180 3.842 4.609 . 0 0 "[ . 1 . 2]" 1
1390 1 51 GLY H 1 53 TYR QD . . 5.000 4.653 4.419 4.867 . 0 0 "[ . 1 . 2]" 1
1391 1 51 GLY H 1 53 TYR QE . . 4.790 4.135 3.837 4.510 . 0 0 "[ . 1 . 2]" 1
1392 1 51 GLY HA2 1 53 TYR H . . 4.790 3.038 2.870 3.331 . 0 0 "[ . 1 . 2]" 1
1393 1 51 GLY HA2 1 53 TYR QE . . 4.730 2.922 2.826 3.051 . 0 0 "[ . 1 . 2]" 1
1394 1 51 GLY HA3 1 52 GLU HA . . 5.210 4.696 4.659 4.717 . 0 0 "[ . 1 . 2]" 1
1395 1 51 GLY HA3 1 53 TYR H . . 4.380 3.987 3.903 4.169 . 0 0 "[ . 1 . 2]" 1
1396 1 51 GLY HA3 1 53 TYR QE . . 3.420 3.499 3.434 3.580 0.160 3 0 "[ . 1 . 2]" 1
1397 1 52 GLU H 1 52 GLU HB2 . . 3.680 2.462 2.296 2.695 . 0 0 "[ . 1 . 2]" 1
1398 1 52 GLU H 1 52 GLU HB3 . . 3.620 3.605 3.570 3.648 0.028 4 0 "[ . 1 . 2]" 1
1399 1 52 GLU H 1 52 GLU HG2 . . 3.920 2.646 2.405 2.936 . 0 0 "[ . 1 . 2]" 1
1400 1 52 GLU H 1 52 GLU HG3 . . 3.960 3.020 2.096 3.652 . 0 0 "[ . 1 . 2]" 1
1401 1 52 GLU H 1 53 TYR QE . . 5.380 5.158 4.999 5.375 . 0 0 "[ . 1 . 2]" 1
1402 1 52 GLU H 1 56 ALA H . . 5.500 5.523 5.508 5.552 0.052 15 0 "[ . 1 . 2]" 1
1403 1 52 GLU HA 1 52 GLU HG2 . . 3.530 2.857 2.704 2.978 . 0 0 "[ . 1 . 2]" 1
1404 1 52 GLU HA 1 52 GLU HG3 . . 3.710 3.730 3.548 3.834 0.124 16 0 "[ . 1 . 2]" 1
1405 1 52 GLU HA 1 53 TYR HA . . 5.270 4.716 4.607 4.793 . 0 0 "[ . 1 . 2]" 1
1406 1 52 GLU HA 1 53 TYR HB2 . . 4.800 4.220 3.959 4.475 . 0 0 "[ . 1 . 2]" 1
1407 1 52 GLU HA 1 54 THR H . . 4.420 3.100 3.029 3.189 . 0 0 "[ . 1 . 2]" 1
1408 1 52 GLU HA 1 55 GLN H . . 5.500 3.915 3.801 4.307 . 0 0 "[ . 1 . 2]" 1
1409 1 52 GLU HA 1 55 GLN HB2 . . 4.850 4.773 4.676 4.885 0.035 15 0 "[ . 1 . 2]" 1
1410 1 52 GLU HA 1 55 GLN HE21 . . 5.500 5.412 3.607 5.632 0.132 12 0 "[ . 1 . 2]" 1
1411 1 52 GLU HA 1 56 ALA H . . 5.310 4.973 4.902 5.145 . 0 0 "[ . 1 . 2]" 1
1412 1 52 GLU HB3 1 55 GLN HE21 . . 5.500 4.926 3.543 5.173 . 0 0 "[ . 1 . 2]" 1
1413 1 53 TYR H 1 56 ALA H . . 5.500 4.544 4.423 4.714 . 0 0 "[ . 1 . 2]" 1
1414 1 53 TYR HA 1 53 TYR QD . . 2.940 2.401 2.240 2.516 . 0 0 "[ . 1 . 2]" 1
1415 1 53 TYR HA 1 56 ALA H . . 4.110 3.121 3.017 3.201 . 0 0 "[ . 1 . 2]" 1
1416 1 53 TYR HA 1 56 ALA MB . . 3.640 1.898 1.858 1.943 . 0 0 "[ . 1 . 2]" 1
1417 1 53 TYR HA 1 89 ALA MB . . 5.500 5.267 5.067 5.506 0.006 4 0 "[ . 1 . 2]" 1
1418 1 53 TYR HB2 1 54 THR H . . 3.980 2.410 2.189 2.751 . 0 0 "[ . 1 . 2]" 1
1419 1 53 TYR HB2 1 54 THR HA . . 5.340 3.966 3.937 4.050 . 0 0 "[ . 1 . 2]" 1
1420 1 53 TYR HB2 1 54 THR MG . . 5.480 5.032 4.941 5.142 . 0 0 "[ . 1 . 2]" 1
1421 1 53 TYR HB2 1 55 GLN H . . 5.500 4.713 4.506 4.931 . 0 0 "[ . 1 . 2]" 1
1422 1 53 TYR HB2 1 56 ALA MB . . 5.090 4.365 4.339 4.399 . 0 0 "[ . 1 . 2]" 1
1423 1 53 TYR HB2 1 57 ILE MD . . 4.760 3.574 3.522 3.636 . 0 0 "[ . 1 . 2]" 1
1424 1 53 TYR HB2 1 86 ALA HA . . 4.500 3.994 3.930 4.069 . 0 0 "[ . 1 . 2]" 1
1425 1 53 TYR HB2 1 86 ALA MB . . 4.150 3.446 3.398 3.510 . 0 0 "[ . 1 . 2]" 1
1426 1 53 TYR HB2 1 89 ALA H . . 5.500 5.031 4.818 5.195 . 0 0 "[ . 1 . 2]" 1
1427 1 53 TYR HB2 1 89 ALA MB . . 4.620 4.088 4.000 4.127 . 0 0 "[ . 1 . 2]" 1
1428 1 53 TYR HB2 1 90 VAL H . . 5.270 4.257 3.512 4.993 . 0 0 "[ . 1 . 2]" 1
1429 1 53 TYR HB2 1 90 VAL HA . . 4.690 3.021 1.961 4.213 . 0 0 "[ . 1 . 2]" 1
1430 1 53 TYR HB2 1 90 VAL HB . . 4.420 4.140 4.059 4.219 . 0 0 "[ . 1 . 2]" 1
1431 1 53 TYR HB2 1 90 VAL MG1 . . 3.300 2.740 2.150 3.398 0.098 14 0 "[ . 1 . 2]" 1
1432 1 53 TYR HB2 1 90 VAL MG2 . . 3.730 1.971 1.758 2.200 . 0 0 "[ . 1 . 2]" 1
1433 1 53 TYR HB3 1 54 THR H . . 4.090 3.527 3.333 3.794 . 0 0 "[ . 1 . 2]" 1
1434 1 53 TYR HB3 1 55 GLN H . . 5.500 5.258 5.087 5.487 . 0 0 "[ . 1 . 2]" 1
1435 1 53 TYR HB3 1 56 ALA H . . 5.300 5.030 4.914 5.125 . 0 0 "[ . 1 . 2]" 1
1436 1 53 TYR HB3 1 56 ALA MB . . 4.180 3.707 3.601 3.802 . 0 0 "[ . 1 . 2]" 1
1437 1 53 TYR HB3 1 57 ILE H . . 5.360 4.557 4.387 4.657 . 0 0 "[ . 1 . 2]" 1
1438 1 53 TYR HB3 1 57 ILE MD . . 4.890 2.792 2.606 3.015 . 0 0 "[ . 1 . 2]" 1
1439 1 53 TYR HB3 1 86 ALA H . . 5.470 4.783 4.743 4.828 . 0 0 "[ . 1 . 2]" 1
1440 1 53 TYR HB3 1 86 ALA HA . . 4.180 2.704 2.609 2.815 . 0 0 "[ . 1 . 2]" 1
1441 1 53 TYR HB3 1 86 ALA MB . . 3.650 2.060 2.030 2.105 . 0 0 "[ . 1 . 2]" 1
1442 1 53 TYR HB3 1 87 GLN H . . 5.500 3.996 3.917 4.076 . 0 0 "[ . 1 . 2]" 1
1443 1 53 TYR HB3 1 89 ALA H . . 5.500 4.275 4.153 4.389 . 0 0 "[ . 1 . 2]" 1
1444 1 53 TYR HB3 1 89 ALA MB . . 4.070 3.727 3.596 3.911 . 0 0 "[ . 1 . 2]" 1
1445 1 53 TYR HB3 1 90 VAL H . . 4.860 3.960 3.334 4.595 . 0 0 "[ . 1 . 2]" 1
1446 1 53 TYR HB3 1 90 VAL HA . . 4.410 3.917 3.046 4.804 0.394 6 0 "[ . 1 . 2]" 1
1447 1 53 TYR HB3 1 90 VAL HB . . 4.250 4.257 3.690 4.711 0.461 20 0 "[ . 1 . 2]" 1
1448 1 53 TYR HB3 1 90 VAL MG1 . . 3.350 3.492 3.355 3.644 0.294 18 0 "[ . 1 . 2]" 1
1449 1 53 TYR HB3 1 90 VAL MG2 . . 4.090 1.883 1.784 1.994 . 0 0 "[ . 1 . 2]" 1
1450 1 53 TYR QD 1 54 THR H . . 4.250 4.044 3.949 4.351 0.101 9 0 "[ . 1 . 2]" 1
1451 1 53 TYR QD 1 56 ALA MB . . 3.970 3.321 3.098 3.448 . 0 0 "[ . 1 . 2]" 1
1452 1 53 TYR QD 1 85 LEU MD1 . . 3.820 3.135 2.990 3.306 . 0 0 "[ . 1 . 2]" 1
1453 1 53 TYR QD 1 86 ALA H . . 5.040 4.277 4.127 4.415 . 0 0 "[ . 1 . 2]" 1
1454 1 53 TYR QD 1 86 ALA HA . . 3.650 2.268 2.012 2.476 . 0 0 "[ . 1 . 2]" 1
1455 1 53 TYR QD 1 86 ALA MB . . 3.010 2.469 2.329 2.595 . 0 0 "[ . 1 . 2]" 1
1456 1 53 TYR QD 1 89 ALA H . . 5.500 4.485 4.210 4.754 . 0 0 "[ . 1 . 2]" 1
1457 1 53 TYR QD 1 89 ALA HA . . 5.140 4.941 4.667 5.185 0.045 1 0 "[ . 1 . 2]" 1
1458 1 53 TYR QD 1 89 ALA MB . . 3.330 2.901 2.651 3.134 . 0 0 "[ . 1 . 2]" 1
1459 1 53 TYR QD 1 90 VAL H . . 4.520 3.930 3.318 4.235 . 0 0 "[ . 1 . 2]" 1
1460 1 53 TYR QD 1 90 VAL HA . . 4.190 2.409 1.702 3.339 . 0 0 "[ . 1 . 2]" 1
1461 1 53 TYR QD 1 90 VAL HB . . 4.140 4.458 4.329 4.565 0.425 13 0 "[ . 1 . 2]" 1
1462 1 53 TYR QD 1 91 GLY H . . 5.500 5.090 4.651 5.608 0.108 16 0 "[ . 1 . 2]" 1
1463 1 53 TYR QE 1 56 ALA MB . . 5.470 5.045 4.780 5.136 . 0 0 "[ . 1 . 2]" 1
1464 1 53 TYR QE 1 85 LEU MD1 . . 3.640 2.540 2.425 2.653 . 0 0 "[ . 1 . 2]" 1
1465 1 53 TYR QE 1 85 LEU QD . . 3.130 2.528 2.416 2.638 . 0 0 "[ . 1 . 2]" 1
1466 1 53 TYR QE 1 86 ALA H . . 5.500 5.357 5.251 5.476 . 0 0 "[ . 1 . 2]" 1
1467 1 53 TYR QE 1 86 ALA HA . . 3.550 3.516 3.389 3.605 0.055 3 0 "[ . 1 . 2]" 1
1468 1 53 TYR QE 1 86 ALA MB . . 5.210 4.192 4.029 4.284 . 0 0 "[ . 1 . 2]" 1
1469 1 53 TYR QE 1 89 ALA H . . 5.500 5.314 5.128 5.522 0.022 8 0 "[ . 1 . 2]" 1
1470 1 53 TYR QE 1 89 ALA MB . . 3.160 2.534 2.219 2.901 . 0 0 "[ . 1 . 2]" 1
1471 1 53 TYR QE 1 90 VAL H . . 5.500 5.251 4.861 5.535 0.035 19 0 "[ . 1 . 2]" 1
1472 1 54 THR H 1 54 THR HB . . 3.330 2.839 2.739 2.925 . 0 0 "[ . 1 . 2]" 1
1473 1 54 THR H 1 54 THR MG . . 3.890 3.668 3.619 3.728 . 0 0 "[ . 1 . 2]" 1
1474 1 54 THR H 1 55 GLN H . . 3.650 2.679 2.571 2.738 . 0 0 "[ . 1 . 2]" 1
1475 1 54 THR H 1 55 GLN HE21 . . 5.500 4.136 2.006 4.459 . 0 0 "[ . 1 . 2]" 1
1476 1 54 THR H 1 55 GLN HG2 . . 5.280 4.275 4.077 5.496 0.216 9 0 "[ . 1 . 2]" 1
1477 1 54 THR H 1 56 ALA H . . 5.230 4.007 3.950 4.037 . 0 0 "[ . 1 . 2]" 1
1478 1 54 THR H 1 56 ALA MB . . 5.080 4.434 4.379 4.500 . 0 0 "[ . 1 . 2]" 1
1479 1 54 THR H 1 57 ILE MD . . 4.990 3.790 3.636 3.949 . 0 0 "[ . 1 . 2]" 1
1480 1 54 THR H 1 90 VAL MG1 . . 3.990 2.663 2.224 3.137 . 0 0 "[ . 1 . 2]" 1
1481 1 54 THR H 1 90 VAL MG2 . . 4.610 3.071 2.493 3.647 . 0 0 "[ . 1 . 2]" 1
1482 1 54 THR HA 1 54 THR MG . . 2.880 2.182 2.132 2.246 . 0 0 "[ . 1 . 2]" 1
1483 1 54 THR HA 1 56 ALA MB . . 5.500 4.975 4.863 5.090 . 0 0 "[ . 1 . 2]" 1
1484 1 54 THR HA 1 57 ILE HB . . 3.580 3.607 3.537 3.642 0.062 17 0 "[ . 1 . 2]" 1
1485 1 54 THR HA 1 57 ILE MD . . 3.340 1.922 1.837 2.005 . 0 0 "[ . 1 . 2]" 1
1486 1 54 THR HA 1 58 GLN HG2 . . 5.440 4.869 4.798 5.104 . 0 0 "[ . 1 . 2]" 1
1487 1 54 THR HA 1 90 VAL MG2 . . 4.230 2.864 2.755 2.977 . 0 0 "[ . 1 . 2]" 1
1488 1 54 THR HB 1 55 GLN H . . 3.300 2.619 2.563 2.921 . 0 0 "[ . 1 . 2]" 1
1489 1 54 THR HB 1 55 GLN HB2 . . 5.300 4.604 4.274 4.733 . 0 0 "[ . 1 . 2]" 1
1490 1 54 THR HB 1 55 GLN HE21 . . 4.920 1.929 1.706 2.164 . 0 0 "[ . 1 . 2]" 1
1491 1 54 THR HB 1 55 GLN HG2 . . 3.330 2.879 2.772 3.564 0.234 15 0 "[ . 1 . 2]" 1
1492 1 54 THR HB 1 57 ILE MD . . 4.590 4.586 4.518 4.647 0.057 8 0 "[ . 1 . 2]" 1
1493 1 54 THR HB 1 90 VAL MG1 . . 4.140 3.724 3.663 3.812 . 0 0 "[ . 1 . 2]" 1
1494 1 54 THR MG 1 55 GLN H . . 3.940 3.796 3.689 3.985 0.045 15 0 "[ . 1 . 2]" 1
1495 1 54 THR MG 1 55 GLN HA . . 4.650 4.038 3.887 4.155 . 0 0 "[ . 1 . 2]" 1
1496 1 54 THR MG 1 55 GLN HE21 . . 5.500 2.581 2.329 3.385 . 0 0 "[ . 1 . 2]" 1
1497 1 54 THR MG 1 55 GLN HE22 . . 4.110 3.161 2.852 4.280 0.170 9 0 "[ . 1 . 2]" 1
1498 1 54 THR MG 1 55 GLN HG2 . . 4.370 4.195 4.019 4.493 0.123 15 0 "[ . 1 . 2]" 1
1499 1 54 THR MG 1 55 GLN HG3 . . 5.500 5.207 3.212 5.542 0.042 1 0 "[ . 1 . 2]" 1
1500 1 54 THR MG 1 57 ILE H . . 5.500 5.120 5.019 5.204 . 0 0 "[ . 1 . 2]" 1
1501 1 54 THR MG 1 57 ILE HB . . 5.020 4.430 4.268 4.524 . 0 0 "[ . 1 . 2]" 1
1502 1 54 THR MG 1 57 ILE MD . . 3.740 3.276 3.190 3.331 . 0 0 "[ . 1 . 2]" 1
1503 1 54 THR MG 1 58 GLN H . . 5.500 5.242 4.919 5.326 . 0 0 "[ . 1 . 2]" 1
1504 1 54 THR MG 1 58 GLN HE21 . . 4.830 3.676 2.529 3.922 . 0 0 "[ . 1 . 2]" 1
1505 1 54 THR MG 1 58 GLN HE22 . . 5.180 4.806 3.497 5.069 . 0 0 "[ . 1 . 2]" 1
1506 1 54 THR MG 1 58 GLN HG2 . . 4.050 4.113 4.072 4.207 0.157 5 0 "[ . 1 . 2]" 1
1507 1 54 THR MG 1 58 GLN HG3 . . 4.920 4.697 3.667 4.823 . 0 0 "[ . 1 . 2]" 1
1508 1 54 THR MG 1 90 VAL MG1 . . 3.430 2.469 2.402 2.637 . 0 0 "[ . 1 . 2]" 1
1509 1 55 GLN H 1 55 GLN HB2 . . 3.450 2.432 2.286 2.506 . 0 0 "[ . 1 . 2]" 1
1510 1 55 GLN H 1 55 GLN HB3 . . 3.630 3.574 3.492 3.615 . 0 0 "[ . 1 . 2]" 1
1511 1 55 GLN H 1 55 GLN HE21 . . 5.160 2.635 1.649 2.822 . 0 0 "[ . 1 . 2]" 1
1512 1 55 GLN H 1 55 GLN HE22 . . 5.500 4.267 3.115 4.471 . 0 0 "[ . 1 . 2]" 1
1513 1 55 GLN H 1 55 GLN HG2 . . 3.470 2.309 2.120 3.797 0.327 15 0 "[ . 1 . 2]" 1
1514 1 55 GLN H 1 55 GLN HG3 . . 3.500 3.504 2.546 3.631 0.131 19 0 "[ . 1 . 2]" 1
1515 1 55 GLN H 1 56 ALA MB . . 5.430 3.890 3.539 3.963 . 0 0 "[ . 1 . 2]" 1
1516 1 55 GLN H 1 90 VAL MG1 . . 4.440 4.613 4.496 4.757 0.317 5 0 "[ . 1 . 2]" 1
1517 1 55 GLN HA 1 55 GLN HE21 . . 5.500 2.815 2.636 3.837 . 0 0 "[ . 1 . 2]" 1
1518 1 55 GLN HA 1 55 GLN HE22 . . 5.300 3.441 3.208 5.375 0.075 9 0 "[ . 1 . 2]" 1
1519 1 55 GLN HA 1 55 GLN HG2 . . 3.600 3.248 3.105 3.280 . 0 0 "[ . 1 . 2]" 1
1520 1 55 GLN HA 1 56 ALA MB . . 4.910 4.963 4.918 4.983 0.073 3 0 "[ . 1 . 2]" 1
1521 1 55 GLN HA 1 57 ILE H . . 5.190 4.262 4.150 4.382 . 0 0 "[ . 1 . 2]" 1
1522 1 55 GLN HA 1 58 GLN H . . 4.030 3.350 2.941 3.570 . 0 0 "[ . 1 . 2]" 1
1523 1 55 GLN HA 1 58 GLN HE21 . . 5.230 4.252 3.293 4.479 . 0 0 "[ . 1 . 2]" 1
1524 1 55 GLN HA 1 58 GLN HG2 . . 4.270 2.720 1.986 3.725 . 0 0 "[ . 1 . 2]" 1
1525 1 55 GLN HA 1 59 MET H . . 5.290 4.471 4.096 4.597 . 0 0 "[ . 1 . 2]" 1
1526 1 55 GLN HB2 1 55 GLN HE22 . . 5.040 4.968 3.797 5.106 0.066 1 0 "[ . 1 . 2]" 1
1527 1 55 GLN HB2 1 56 ALA H . . 4.000 2.531 2.493 2.578 . 0 0 "[ . 1 . 2]" 1
1528 1 55 GLN HB2 1 56 ALA MB . . 5.350 3.933 3.832 4.084 . 0 0 "[ . 1 . 2]" 1
1529 1 55 GLN HB3 1 55 GLN HE21 . . 4.680 4.033 3.963 4.192 . 0 0 "[ . 1 . 2]" 1
1530 1 55 GLN HB3 1 55 GLN HE22 . . 5.060 4.584 4.483 5.094 0.034 9 0 "[ . 1 . 2]" 1
1531 1 55 GLN HB3 1 56 ALA H . . 3.620 3.718 3.691 3.744 0.124 9 0 "[ . 1 . 2]" 1
1532 1 55 GLN HB3 1 59 MET ME . . 3.940 3.348 3.116 3.591 . 0 0 "[ . 1 . 2]" 1
1533 1 55 GLN HE21 1 58 GLN H . . 5.500 5.574 5.537 5.785 0.285 9 0 "[ . 1 . 2]" 1
1534 1 55 GLN HE21 1 58 GLN HE21 . . 5.230 5.172 3.427 5.415 0.185 15 0 "[ . 1 . 2]" 1
1535 1 55 GLN HE22 1 55 GLN HG2 . . 4.040 3.581 3.512 4.087 0.047 15 0 "[ . 1 . 2]" 1
1536 1 55 GLN HG2 1 56 ALA H . . 4.910 4.119 3.995 5.029 0.119 9 0 "[ . 1 . 2]" 1
1537 1 55 GLN HG3 1 56 ALA H . . 4.970 4.766 4.167 4.882 . 0 0 "[ . 1 . 2]" 1
1538 1 56 ALA H 1 56 ALA MB . . 2.890 2.143 2.125 2.185 . 0 0 "[ . 1 . 2]" 1
1539 1 56 ALA H 1 57 ILE HA . . 5.370 5.430 5.408 5.446 0.076 10 0 "[ . 1 . 2]" 1
1540 1 56 ALA H 1 57 ILE HG13 . . 4.550 4.400 4.339 4.448 . 0 0 "[ . 1 . 2]" 1
1541 1 56 ALA H 1 58 GLN H . . 5.250 4.205 4.047 4.283 . 0 0 "[ . 1 . 2]" 1
1542 1 56 ALA H 1 59 MET H . . 5.250 4.749 4.655 4.803 . 0 0 "[ . 1 . 2]" 1
1543 1 56 ALA H 1 59 MET HG2 . . 5.150 4.420 4.353 4.482 . 0 0 "[ . 1 . 2]" 1
1544 1 56 ALA HA 1 58 GLN H . . 4.300 4.215 4.125 4.304 0.004 9 0 "[ . 1 . 2]" 1
1545 1 56 ALA HA 1 59 MET H . . 4.100 3.230 3.090 3.379 . 0 0 "[ . 1 . 2]" 1
1546 1 56 ALA HA 1 59 MET HA . . 5.440 5.246 5.083 5.363 . 0 0 "[ . 1 . 2]" 1
1547 1 56 ALA HA 1 59 MET HB2 . . 3.960 2.703 2.511 2.833 . 0 0 "[ . 1 . 2]" 1
1548 1 56 ALA HA 1 59 MET ME . . 4.260 4.331 4.315 4.347 0.087 12 0 "[ . 1 . 2]" 1
1549 1 56 ALA HA 1 59 MET HG2 . . 4.270 2.694 2.590 2.776 . 0 0 "[ . 1 . 2]" 1
1550 1 56 ALA MB 1 57 ILE H . . 4.050 2.474 2.383 2.570 . 0 0 "[ . 1 . 2]" 1
1551 1 56 ALA MB 1 57 ILE HA . . 4.590 3.823 3.766 3.860 . 0 0 "[ . 1 . 2]" 1
1552 1 56 ALA MB 1 57 ILE HB . . 5.390 4.517 4.454 4.617 . 0 0 "[ . 1 . 2]" 1
1553 1 56 ALA MB 1 58 GLN H . . 5.020 4.418 4.374 4.459 . 0 0 "[ . 1 . 2]" 1
1554 1 56 ALA MB 1 59 MET H . . 4.720 4.436 4.333 4.535 . 0 0 "[ . 1 . 2]" 1
1555 1 56 ALA MB 1 59 MET HG2 . . 4.380 4.343 4.259 4.397 0.017 9 0 "[ . 1 . 2]" 1
1556 1 57 ILE H 1 57 ILE HB . . 3.400 2.397 2.362 2.444 . 0 0 "[ . 1 . 2]" 1
1557 1 57 ILE H 1 57 ILE MD . . 3.320 2.973 2.926 3.026 . 0 0 "[ . 1 . 2]" 1
1558 1 57 ILE H 1 57 ILE HG12 . . 3.920 3.563 3.529 3.597 . 0 0 "[ . 1 . 2]" 1
1559 1 57 ILE H 1 57 ILE HG13 . . 4.520 2.085 2.049 2.122 . 0 0 "[ . 1 . 2]" 1
1560 1 57 ILE H 1 57 ILE MG . . 4.130 3.727 3.705 3.736 . 0 0 "[ . 1 . 2]" 1
1561 1 57 ILE H 1 58 GLN H . . 3.900 2.686 2.634 2.722 . 0 0 "[ . 1 . 2]" 1
1562 1 57 ILE H 1 58 GLN HG2 . . 5.500 4.191 4.103 4.519 . 0 0 "[ . 1 . 2]" 1
1563 1 57 ILE H 1 59 MET H . . 5.500 4.091 3.993 4.141 . 0 0 "[ . 1 . 2]" 1
1564 1 57 ILE H 1 59 MET HG2 . . 5.500 5.135 5.031 5.261 . 0 0 "[ . 1 . 2]" 1
1565 1 57 ILE HA 1 57 ILE MD . . 3.950 3.886 3.873 3.901 . 0 0 "[ . 1 . 2]" 1
1566 1 57 ILE HA 1 57 ILE HG12 . . 4.180 2.802 2.754 2.849 . 0 0 "[ . 1 . 2]" 1
1567 1 57 ILE HA 1 57 ILE HG13 . . 4.010 2.727 2.703 2.775 . 0 0 "[ . 1 . 2]" 1
1568 1 57 ILE HA 1 57 ILE MG . . 3.110 2.474 2.448 2.491 . 0 0 "[ . 1 . 2]" 1
1569 1 57 ILE HA 1 58 GLN HG2 . . 5.500 5.473 5.190 5.562 0.062 15 0 "[ . 1 . 2]" 1
1570 1 57 ILE HA 1 59 MET H . . 5.270 4.428 4.354 4.570 . 0 0 "[ . 1 . 2]" 1
1571 1 57 ILE HA 1 60 CYS H . . 4.270 3.646 3.580 3.726 . 0 0 "[ . 1 . 2]" 1
1572 1 57 ILE HA 1 60 CYS HB2 . . 5.390 3.184 3.117 3.257 . 0 0 "[ . 1 . 2]" 1
1573 1 57 ILE HA 1 60 CYS HB3 . . 4.780 4.839 4.793 4.886 0.106 20 0 "[ . 1 . 2]" 1
1574 1 57 ILE HA 1 61 GLN H . . 4.830 4.158 4.056 4.255 . 0 0 "[ . 1 . 2]" 1
1575 1 57 ILE HA 1 83 LEU HA . . 3.810 2.914 2.695 3.186 . 0 0 "[ . 1 . 2]" 1
1576 1 57 ILE HA 1 83 LEU MD1 . . 3.310 2.417 2.306 2.517 . 0 0 "[ . 1 . 2]" 1
1577 1 57 ILE HA 1 83 LEU MD2 . . 5.070 4.765 4.597 4.875 . 0 0 "[ . 1 . 2]" 1
1578 1 57 ILE HA 1 86 ALA MB . . 3.980 3.441 3.314 3.526 . 0 0 "[ . 1 . 2]" 1
1579 1 57 ILE HA 1 87 GLN H . . 5.500 4.693 4.554 4.780 . 0 0 "[ . 1 . 2]" 1
1580 1 57 ILE HA 1 87 GLN HE22 . . 5.500 5.559 5.482 5.589 0.089 7 0 "[ . 1 . 2]" 1
1581 1 57 ILE HA 1 87 GLN HG2 . . 5.000 4.991 4.869 5.062 0.062 19 0 "[ . 1 . 2]" 1
1582 1 57 ILE HB 1 57 ILE MD . . 2.950 2.164 2.135 2.202 . 0 0 "[ . 1 . 2]" 1
1583 1 57 ILE HB 1 58 GLN H . . 3.650 2.691 2.574 2.732 . 0 0 "[ . 1 . 2]" 1
1584 1 57 ILE HB 1 59 MET H . . 4.950 4.979 4.946 5.006 0.056 17 0 "[ . 1 . 2]" 1
1585 1 57 ILE HB 1 83 LEU MD1 . . 4.190 4.241 4.199 4.301 0.111 16 0 "[ . 1 . 2]" 1
1586 1 57 ILE HB 1 86 ALA MB . . 5.120 4.276 4.217 4.337 . 0 0 "[ . 1 . 2]" 1
1587 1 57 ILE MD 1 58 GLN H . . 4.640 4.253 4.166 4.328 . 0 0 "[ . 1 . 2]" 1
1588 1 57 ILE MD 1 58 GLN HE21 . . 5.500 3.609 3.365 5.489 . 0 0 "[ . 1 . 2]" 1
1589 1 57 ILE MD 1 86 ALA MB . . 3.130 2.841 2.776 2.891 . 0 0 "[ . 1 . 2]" 1
1590 1 57 ILE MD 1 87 GLN H . . 4.070 2.953 2.905 3.017 . 0 0 "[ . 1 . 2]" 1
1591 1 57 ILE MD 1 87 GLN HA . . 2.790 1.935 1.895 1.956 . 0 0 "[ . 1 . 2]" 1
1592 1 57 ILE MD 1 87 GLN HB2 . . 3.870 3.129 3.016 3.250 . 0 0 "[ . 1 . 2]" 1
1593 1 57 ILE MD 1 87 GLN HB3 . . 4.070 2.046 1.957 2.125 . 0 0 "[ . 1 . 2]" 1
1594 1 57 ILE MD 1 87 GLN HG2 . . 3.780 3.789 3.768 3.812 0.032 3 0 "[ . 1 . 2]" 1
1595 1 57 ILE MD 1 87 GLN HG3 . . 4.920 4.447 4.408 4.466 . 0 0 "[ . 1 . 2]" 1
1596 1 57 ILE MD 1 88 GLY H . . 4.830 4.507 4.473 4.553 . 0 0 "[ . 1 . 2]" 1
1597 1 57 ILE MD 1 90 VAL H . . 4.290 4.080 3.899 4.245 . 0 0 "[ . 1 . 2]" 1
1598 1 57 ILE MD 1 90 VAL HA . . 4.650 4.639 4.416 4.785 0.135 14 0 "[ . 1 . 2]" 1
1599 1 57 ILE MD 1 90 VAL HB . . 3.980 3.410 2.565 4.065 0.085 1 0 "[ . 1 . 2]" 1
1600 1 57 ILE MD 1 90 VAL MG1 . . 3.410 2.794 2.336 3.207 . 0 0 "[ . 1 . 2]" 1
1601 1 57 ILE MD 1 90 VAL MG2 . . 2.480 1.919 1.793 2.071 . 0 0 "[ . 1 . 2]" 1
1602 1 57 ILE MD 1 91 GLY H . . 5.500 5.272 4.357 5.578 0.078 12 0 "[ . 1 . 2]" 1
1603 1 57 ILE HG12 1 57 ILE MG . . 3.390 2.184 2.149 2.210 . 0 0 "[ . 1 . 2]" 1
1604 1 57 ILE HG12 1 83 LEU MD1 . . 4.850 3.052 2.962 3.231 . 0 0 "[ . 1 . 2]" 1
1605 1 57 ILE HG12 1 87 GLN H . . 4.520 2.388 2.224 2.548 . 0 0 "[ . 1 . 2]" 1
1606 1 57 ILE HG12 1 87 GLN HA . . 3.770 3.422 3.364 3.447 . 0 0 "[ . 1 . 2]" 1
1607 1 57 ILE HG12 1 87 GLN HB3 . . 2.400 2.191 2.158 2.242 . 0 0 "[ . 1 . 2]" 1
1608 1 57 ILE HG13 1 83 LEU MD1 . . 5.100 4.037 3.898 4.197 . 0 0 "[ . 1 . 2]" 1
1609 1 57 ILE HG13 1 86 ALA MB . . 4.360 2.062 1.994 2.112 . 0 0 "[ . 1 . 2]" 1
1610 1 57 ILE HG13 1 87 GLN H . . 4.770 3.223 3.117 3.285 . 0 0 "[ . 1 . 2]" 1
1611 1 57 ILE HG13 1 87 GLN HA . . 4.130 4.039 3.988 4.082 . 0 0 "[ . 1 . 2]" 1
1612 1 57 ILE HG13 1 87 GLN HG2 . . 5.500 4.389 4.261 4.518 . 0 0 "[ . 1 . 2]" 1
1613 1 57 ILE MG 1 58 GLN H . . 3.920 3.599 3.511 3.642 . 0 0 "[ . 1 . 2]" 1
1614 1 57 ILE MG 1 58 GLN HA . . 3.970 3.620 3.563 3.666 . 0 0 "[ . 1 . 2]" 1
1615 1 57 ILE MG 1 60 CYS H . . 5.100 4.983 4.925 5.036 . 0 0 "[ . 1 . 2]" 1
1616 1 57 ILE MG 1 61 GLN HG2 . . 3.380 3.257 3.134 3.404 0.024 14 0 "[ . 1 . 2]" 1
1617 1 57 ILE MG 1 61 GLN HG3 . . 4.380 4.328 4.227 4.397 0.017 16 0 "[ . 1 . 2]" 1
1618 1 57 ILE MG 1 83 LEU MD1 . . 2.860 2.021 1.976 2.075 . 0 0 "[ . 1 . 2]" 1
1619 1 57 ILE MG 1 86 ALA MB . . 4.480 3.942 3.845 3.991 . 0 0 "[ . 1 . 2]" 1
1620 1 57 ILE MG 1 87 GLN HA . . 4.140 4.206 4.185 4.226 0.086 7 0 "[ . 1 . 2]" 1
1621 1 57 ILE MG 1 87 GLN HE21 . . 3.820 2.695 2.049 3.136 . 0 0 "[ . 1 . 2]" 1
1622 1 57 ILE MG 1 87 GLN HE22 . . 3.570 3.282 3.125 3.441 . 0 0 "[ . 1 . 2]" 1
1623 1 57 ILE MG 1 87 GLN HG2 . . 3.660 3.648 3.433 3.721 0.061 9 0 "[ . 1 . 2]" 1
1624 1 58 GLN H 1 58 GLN HB2 . . 3.640 2.479 2.430 2.836 . 0 0 "[ . 1 . 2]" 1
1625 1 58 GLN H 1 58 GLN HB3 . . 3.320 3.521 3.471 3.547 0.227 9 0 "[ . 1 . 2]" 1
1626 1 58 GLN H 1 58 GLN HE21 . . 5.000 3.156 2.940 4.590 . 0 0 "[ . 1 . 2]" 1
1627 1 58 GLN H 1 58 GLN HG2 . . 3.450 2.174 2.107 2.337 . 0 0 "[ . 1 . 2]" 1
1628 1 58 GLN H 1 58 GLN HG3 . . 3.850 3.487 1.782 3.661 . 0 0 "[ . 1 . 2]" 1
1629 1 58 GLN H 1 59 MET H . . 3.920 2.521 2.465 2.592 . 0 0 "[ . 1 . 2]" 1
1630 1 58 GLN H 1 59 MET HA . . 5.450 5.210 5.161 5.258 . 0 0 "[ . 1 . 2]" 1
1631 1 58 GLN H 1 59 MET ME . . 4.100 3.864 3.809 4.045 . 0 0 "[ . 1 . 2]" 1
1632 1 58 GLN H 1 59 MET HG2 . . 5.120 4.186 4.091 4.400 . 0 0 "[ . 1 . 2]" 1
1633 1 58 GLN H 1 60 CYS H . . 5.020 4.212 4.148 4.290 . 0 0 "[ . 1 . 2]" 1
1634 1 58 GLN H 1 83 LEU MD1 . . 5.240 4.985 4.913 5.064 . 0 0 "[ . 1 . 2]" 1
1635 1 58 GLN HA 1 58 GLN HB3 . . 2.930 2.396 2.295 2.416 . 0 0 "[ . 1 . 2]" 1
1636 1 58 GLN HA 1 58 GLN HE21 . . 5.500 3.896 3.684 5.261 . 0 0 "[ . 1 . 2]" 1
1637 1 58 GLN HA 1 58 GLN HG2 . . 3.750 3.295 2.467 3.418 . 0 0 "[ . 1 . 2]" 1
1638 1 58 GLN HA 1 58 GLN HG3 . . 3.510 3.667 3.585 3.687 0.177 4 0 "[ . 1 . 2]" 1
1639 1 58 GLN HA 1 59 MET HA . . 4.860 4.862 4.831 4.887 0.027 5 0 "[ . 1 . 2]" 1
1640 1 58 GLN HA 1 61 GLN H . . 4.090 4.124 4.077 4.172 0.082 4 0 "[ . 1 . 2]" 1
1641 1 58 GLN HA 1 61 GLN HE21 . . 5.500 4.238 3.742 5.180 . 0 0 "[ . 1 . 2]" 1
1642 1 58 GLN HA 1 61 GLN HE22 . . 5.500 4.643 4.302 5.178 . 0 0 "[ . 1 . 2]" 1
1643 1 58 GLN HA 1 61 GLN HG2 . . 3.700 2.834 2.743 3.216 . 0 0 "[ . 1 . 2]" 1
1644 1 58 GLN HA 1 61 GLN HG3 . . 4.490 2.633 2.546 2.737 . 0 0 "[ . 1 . 2]" 1
1645 1 58 GLN HA 1 62 GLN H . . 5.310 4.311 4.160 4.439 . 0 0 "[ . 1 . 2]" 1
1646 1 58 GLN HA 1 62 GLN HE21 . . 5.500 4.057 3.342 5.520 0.020 5 0 "[ . 1 . 2]" 1
1647 1 58 GLN HA 1 83 LEU MD1 . . 5.500 4.851 4.765 4.967 . 0 0 "[ . 1 . 2]" 1
1648 1 58 GLN HB2 1 58 GLN HE22 . . 5.000 5.152 4.872 5.197 0.197 3 0 "[ . 1 . 2]" 1
1649 1 58 GLN HB2 1 59 MET H . . 4.090 2.653 2.445 2.707 . 0 0 "[ . 1 . 2]" 1
1650 1 58 GLN HB3 1 58 GLN HE21 . . 4.700 4.454 4.239 4.509 . 0 0 "[ . 1 . 2]" 1
1651 1 58 GLN HB3 1 58 GLN HE22 . . 4.740 4.771 4.418 4.852 0.112 15 0 "[ . 1 . 2]" 1
1652 1 58 GLN HB3 1 58 GLN HG3 . . 2.940 2.418 2.350 3.015 0.075 5 0 "[ . 1 . 2]" 1
1653 1 58 GLN HB3 1 59 MET H . . 3.720 3.792 3.770 3.849 0.129 15 0 "[ . 1 . 2]" 1
1654 1 58 GLN HG2 1 59 MET H . . 4.120 4.173 4.097 4.366 0.246 9 0 "[ . 1 . 2]" 1
1655 1 59 MET H 1 59 MET ME . . 3.140 2.629 2.579 2.697 . 0 0 "[ . 1 . 2]" 1
1656 1 59 MET H 1 59 MET HG2 . . 4.170 2.298 2.256 2.468 . 0 0 "[ . 1 . 2]" 1
1657 1 59 MET H 1 59 MET HG3 . . 4.310 3.733 3.689 3.869 . 0 0 "[ . 1 . 2]" 1
1658 1 59 MET H 1 60 CYS H . . 4.420 2.696 2.623 2.838 . 0 0 "[ . 1 . 2]" 1
1659 1 59 MET H 1 60 CYS HA . . 5.290 5.292 5.240 5.392 0.102 5 0 "[ . 1 . 2]" 1
1660 1 59 MET H 1 60 CYS HB2 . . 5.420 4.878 4.815 5.093 . 0 0 "[ . 1 . 2]" 1
1661 1 59 MET H 1 62 GLN H . . 5.500 4.803 4.721 4.915 . 0 0 "[ . 1 . 2]" 1
1662 1 59 MET HA 1 59 MET ME . . 2.810 2.221 2.099 2.358 . 0 0 "[ . 1 . 2]" 1
1663 1 59 MET HA 1 59 MET HG2 . . 4.220 3.303 3.265 3.344 . 0 0 "[ . 1 . 2]" 1
1664 1 59 MET HA 1 61 GLN H . . 5.500 5.074 4.857 5.219 . 0 0 "[ . 1 . 2]" 1
1665 1 59 MET HA 1 62 GLN H . . 4.600 3.628 3.431 3.798 . 0 0 "[ . 1 . 2]" 1
1666 1 59 MET HA 1 62 GLN HB2 . . 4.040 2.599 2.456 2.801 . 0 0 "[ . 1 . 2]" 1
1667 1 59 MET HA 1 62 GLN HB3 . . 4.130 3.558 3.305 3.842 . 0 0 "[ . 1 . 2]" 1
1668 1 59 MET HA 1 62 GLN HG2 . . 4.830 3.951 3.798 4.227 . 0 0 "[ . 1 . 2]" 1
1669 1 59 MET HA 1 63 GLY H . . 5.220 4.200 4.071 4.357 . 0 0 "[ . 1 . 2]" 1
1670 1 59 MET HB3 1 60 CYS H . . 4.910 3.647 3.525 3.724 . 0 0 "[ . 1 . 2]" 1
1671 1 59 MET ME 1 60 CYS H . . 5.010 4.563 4.524 4.598 . 0 0 "[ . 1 . 2]" 1
1672 1 59 MET ME 1 62 GLN H . . 4.920 4.770 4.567 4.919 . 0 0 "[ . 1 . 2]" 1
1673 1 59 MET ME 1 62 GLN HB3 . . 5.050 4.677 4.441 4.887 . 0 0 "[ . 1 . 2]" 1
1674 1 60 CYS H 1 60 CYS HB2 . . 3.790 2.423 2.368 2.505 . 0 0 "[ . 1 . 2]" 1
1675 1 60 CYS H 1 60 CYS HB3 . . 4.060 3.562 3.537 3.606 . 0 0 "[ . 1 . 2]" 1
1676 1 60 CYS H 1 61 GLN H . . 4.000 2.826 2.730 2.948 . 0 0 "[ . 1 . 2]" 1
1677 1 60 CYS H 1 61 GLN HG2 . . 4.970 4.997 4.745 5.035 0.065 18 0 "[ . 1 . 2]" 1
1678 1 60 CYS H 1 61 GLN HG3 . . 4.720 3.983 3.849 4.221 . 0 0 "[ . 1 . 2]" 1
1679 1 60 CYS H 1 62 GLN H . . 5.500 3.956 3.874 4.075 . 0 0 "[ . 1 . 2]" 1
1680 1 60 CYS H 1 83 LEU MD1 . . 4.520 3.983 3.842 4.120 . 0 0 "[ . 1 . 2]" 1
1681 1 60 CYS HA 1 63 GLY H . . 5.290 3.409 3.227 3.637 . 0 0 "[ . 1 . 2]" 1
1682 1 60 CYS HA 1 79 LEU MD1 . . 3.100 2.581 2.465 2.672 . 0 0 "[ . 1 . 2]" 1
1683 1 60 CYS HA 1 79 LEU MD2 . . 5.110 4.093 3.765 4.617 . 0 0 "[ . 1 . 2]" 1
1684 1 60 CYS HA 1 79 LEU HG . . 5.120 2.431 2.024 3.125 . 0 0 "[ . 1 . 2]" 1
1685 1 60 CYS HA 1 82 ARG QD . . 4.460 4.568 4.490 4.664 0.204 16 0 "[ . 1 . 2]" 1
1686 1 60 CYS HB2 1 61 GLN H . . 4.060 2.356 2.229 2.514 . 0 0 "[ . 1 . 2]" 1
1687 1 60 CYS HB2 1 61 GLN HA . . 4.590 4.432 4.367 4.482 . 0 0 "[ . 1 . 2]" 1
1688 1 60 CYS HB2 1 61 GLN HG2 . . 5.320 4.802 4.149 5.019 . 0 0 "[ . 1 . 2]" 1
1689 1 60 CYS HB2 1 64 LEU MD1 . . 5.060 5.054 4.816 5.151 0.091 3 0 "[ . 1 . 2]" 1
1690 1 60 CYS HB2 1 82 ARG QD . . 5.000 5.046 4.944 5.117 0.117 3 0 "[ . 1 . 2]" 1
1691 1 60 CYS HB2 1 83 LEU HA . . 4.000 3.159 2.706 3.626 . 0 0 "[ . 1 . 2]" 1
1692 1 60 CYS HB2 1 83 LEU HB2 . . 4.760 2.289 2.162 2.420 . 0 0 "[ . 1 . 2]" 1
1693 1 60 CYS HB2 1 83 LEU HB3 . . 4.520 4.001 3.851 4.122 . 0 0 "[ . 1 . 2]" 1
1694 1 60 CYS HB2 1 83 LEU MD1 . . 3.440 2.298 2.162 2.467 . 0 0 "[ . 1 . 2]" 1
1695 1 60 CYS HB2 1 83 LEU MD2 . . 3.920 3.162 2.778 3.404 . 0 0 "[ . 1 . 2]" 1
1696 1 60 CYS HB3 1 61 GLN H . . 3.970 3.380 3.197 3.585 . 0 0 "[ . 1 . 2]" 1
1697 1 60 CYS HB3 1 64 LEU MD1 . . 5.410 4.417 3.992 4.675 . 0 0 "[ . 1 . 2]" 1
1698 1 60 CYS HB3 1 79 LEU MD1 . . 4.290 3.592 3.419 3.778 . 0 0 "[ . 1 . 2]" 1
1699 1 60 CYS HB3 1 82 ARG QD . . 4.130 4.118 4.003 4.215 0.085 3 0 "[ . 1 . 2]" 1
1700 1 60 CYS HB3 1 83 LEU HA . . 4.410 3.890 3.543 4.271 . 0 0 "[ . 1 . 2]" 1
1701 1 60 CYS HB3 1 83 LEU HB2 . . 4.270 2.034 1.913 2.122 . 0 0 "[ . 1 . 2]" 1
1702 1 60 CYS HB3 1 83 LEU HB3 . . 4.550 3.492 3.405 3.611 . 0 0 "[ . 1 . 2]" 1
1703 1 60 CYS HB3 1 83 LEU MD1 . . 4.360 3.394 3.273 3.595 . 0 0 "[ . 1 . 2]" 1
1704 1 60 CYS HB3 1 83 LEU MD2 . . 4.570 3.047 2.710 3.424 . 0 0 "[ . 1 . 2]" 1
1705 1 61 GLN H 1 61 GLN HB2 . . 3.680 3.606 3.578 3.625 . 0 0 "[ . 1 . 2]" 1
1706 1 61 GLN H 1 61 GLN HB3 . . 3.790 2.589 2.513 2.789 . 0 0 "[ . 1 . 2]" 1
1707 1 61 GLN H 1 61 GLN HE21 . . 4.900 4.174 4.038 4.386 . 0 0 "[ . 1 . 2]" 1
1708 1 61 GLN H 1 61 GLN HE22 . . 5.500 5.586 5.513 5.666 0.166 5 0 "[ . 1 . 2]" 1
1709 1 61 GLN H 1 61 GLN HG2 . . 3.560 2.936 2.440 3.049 . 0 0 "[ . 1 . 2]" 1
1710 1 61 GLN H 1 61 GLN HG3 . . 3.650 2.173 2.125 2.201 . 0 0 "[ . 1 . 2]" 1
1711 1 61 GLN H 1 62 GLN H . . 4.100 2.915 2.864 2.953 . 0 0 "[ . 1 . 2]" 1
1712 1 61 GLN H 1 62 GLN HA . . 5.480 5.534 5.500 5.566 0.086 2 0 "[ . 1 . 2]" 1
1713 1 61 GLN H 1 64 LEU MD1 . . 4.730 4.345 4.213 4.435 . 0 0 "[ . 1 . 2]" 1
1714 1 61 GLN H 1 79 LEU MD1 . . 5.470 5.554 5.493 5.633 0.163 8 0 "[ . 1 . 2]" 1
1715 1 61 GLN H 1 83 LEU HB2 . . 5.360 4.084 3.949 4.199 . 0 0 "[ . 1 . 2]" 1
1716 1 61 GLN H 1 83 LEU MD1 . . 3.290 2.781 2.704 2.877 . 0 0 "[ . 1 . 2]" 1
1717 1 61 GLN H 1 83 LEU MD2 . . 4.410 3.363 2.985 3.704 . 0 0 "[ . 1 . 2]" 1
1718 1 61 GLN HA 1 61 GLN HE21 . . 4.460 4.035 3.368 4.470 0.010 5 0 "[ . 1 . 2]" 1
1719 1 61 GLN HA 1 61 GLN HG3 . . 3.550 3.589 3.575 3.597 0.047 6 0 "[ . 1 . 2]" 1
1720 1 61 GLN HA 1 63 GLY H . . 4.620 4.472 4.272 4.609 . 0 0 "[ . 1 . 2]" 1
1721 1 61 GLN HA 1 64 LEU H . . 4.260 3.444 3.171 3.592 . 0 0 "[ . 1 . 2]" 1
1722 1 61 GLN HA 1 64 LEU HB2 . . 3.820 3.136 2.520 3.510 . 0 0 "[ . 1 . 2]" 1
1723 1 61 GLN HA 1 64 LEU MD1 . . 2.920 2.046 1.992 2.150 . 0 0 "[ . 1 . 2]" 1
1724 1 61 GLN HA 1 64 LEU HG . . 4.960 3.287 2.956 3.559 . 0 0 "[ . 1 . 2]" 1
1725 1 61 GLN HB2 1 61 GLN HE22 . . 5.170 3.658 3.354 3.940 . 0 0 "[ . 1 . 2]" 1
1726 1 61 GLN HB2 1 62 GLN H . . 3.850 3.989 3.908 4.021 0.171 17 0 "[ . 1 . 2]" 1
1727 1 61 GLN HB2 1 83 LEU MD1 . . 5.500 4.442 4.205 4.682 . 0 0 "[ . 1 . 2]" 1
1728 1 61 GLN HB3 1 61 GLN HE21 . . 4.390 4.050 3.529 4.357 . 0 0 "[ . 1 . 2]" 1
1729 1 61 GLN HB3 1 62 GLN H . . 4.270 4.284 4.221 4.403 0.133 5 0 "[ . 1 . 2]" 1
1730 1 61 GLN HB3 1 83 LEU MD1 . . 3.990 2.950 2.713 3.194 . 0 0 "[ . 1 . 2]" 1
1731 1 61 GLN HE21 1 62 GLN HA . . 5.380 2.750 2.565 3.491 . 0 0 "[ . 1 . 2]" 1
1732 1 61 GLN HE21 1 62 GLN HE21 . . 4.430 3.652 2.517 4.384 . 0 0 "[ . 1 . 2]" 1
1733 1 61 GLN HE21 1 64 LEU MD1 . . 5.500 5.287 4.408 5.538 0.038 12 0 "[ . 1 . 2]" 1
1734 1 61 GLN HE22 1 61 GLN HG3 . . 3.980 3.638 3.537 3.864 . 0 0 "[ . 1 . 2]" 1
1735 1 61 GLN HE22 1 62 GLN H . . 5.500 4.112 3.932 4.876 . 0 0 "[ . 1 . 2]" 1
1736 1 61 GLN HE22 1 62 GLN HE21 . . 4.690 3.877 3.364 3.985 . 0 0 "[ . 1 . 2]" 1
1737 1 61 GLN HE22 1 62 GLN HG3 . . 5.500 4.756 4.589 5.530 0.030 5 0 "[ . 1 . 2]" 1
1738 1 61 GLN HG2 1 62 GLN H . . 4.560 4.103 4.015 4.162 . 0 0 "[ . 1 . 2]" 1
1739 1 61 GLN HG2 1 64 LEU MD1 . . 5.500 5.414 4.992 5.528 0.028 17 0 "[ . 1 . 2]" 1
1740 1 61 GLN HG2 1 83 LEU MD1 . . 4.120 3.448 2.811 3.688 . 0 0 "[ . 1 . 2]" 1
1741 1 61 GLN HG3 1 62 GLN H . . 3.550 2.379 2.273 2.438 . 0 0 "[ . 1 . 2]" 1
1742 1 61 GLN HG3 1 63 GLY H . . 5.110 4.963 4.848 5.047 . 0 0 "[ . 1 . 2]" 1
1743 1 61 GLN HG3 1 64 LEU MD1 . . 5.320 5.195 5.034 5.343 0.023 17 0 "[ . 1 . 2]" 1
1744 1 61 GLN HG3 1 83 LEU MD1 . . 4.530 4.038 3.932 4.190 . 0 0 "[ . 1 . 2]" 1
1745 1 62 GLN H 1 62 GLN HB2 . . 3.450 1.998 1.937 2.096 . 0 0 "[ . 1 . 2]" 1
1746 1 62 GLN H 1 62 GLN HB3 . . 3.510 3.201 3.059 3.385 . 0 0 "[ . 1 . 2]" 1
1747 1 62 GLN H 1 62 GLN HE22 . . 5.500 4.381 3.975 4.788 . 0 0 "[ . 1 . 2]" 1
1748 1 62 GLN H 1 62 GLN HG2 . . 4.050 4.215 4.148 4.257 0.207 4 0 "[ . 1 . 2]" 1
1749 1 62 GLN H 1 63 GLY H . . 4.170 2.731 2.658 2.790 . 0 0 "[ . 1 . 2]" 1
1750 1 62 GLN H 1 66 TYR QE . . 5.500 5.537 5.390 5.611 0.111 7 0 "[ . 1 . 2]" 1
1751 1 62 GLN H 1 83 LEU MD1 . . 5.500 5.347 5.272 5.429 . 0 0 "[ . 1 . 2]" 1
1752 1 62 GLN HA 1 62 GLN HE21 . . 4.960 4.170 2.352 4.459 . 0 0 "[ . 1 . 2]" 1
1753 1 62 GLN HA 1 62 GLN HE22 . . 4.960 4.323 3.795 4.499 . 0 0 "[ . 1 . 2]" 1
1754 1 62 GLN HA 1 62 GLN HG2 . . 3.620 3.614 3.596 3.630 0.010 4 0 "[ . 1 . 2]" 1
1755 1 62 GLN HA 1 62 GLN HG3 . . 3.550 2.558 2.366 2.580 . 0 0 "[ . 1 . 2]" 1
1756 1 62 GLN HA 1 65 ARG H . . 4.360 3.745 3.610 3.823 . 0 0 "[ . 1 . 2]" 1
1757 1 62 GLN HA 1 65 ARG HB2 . . 4.430 3.714 3.578 3.807 . 0 0 "[ . 1 . 2]" 1
1758 1 62 GLN HA 1 65 ARG HD2 . . 3.620 2.400 2.270 2.599 . 0 0 "[ . 1 . 2]" 1
1759 1 62 GLN HA 1 65 ARG HD3 . . 3.650 2.336 2.248 2.441 . 0 0 "[ . 1 . 2]" 1
1760 1 62 GLN HA 1 65 ARG HG2 . . 4.230 3.889 3.713 4.082 . 0 0 "[ . 1 . 2]" 1
1761 1 62 GLN HA 1 65 ARG HG3 . . 4.220 2.484 2.349 2.630 . 0 0 "[ . 1 . 2]" 1
1762 1 62 GLN HA 1 66 TYR QE . . 4.990 3.669 3.464 3.875 . 0 0 "[ . 1 . 2]" 1
1763 1 62 GLN HB2 1 62 GLN HE22 . . 4.860 3.909 3.812 4.445 . 0 0 "[ . 1 . 2]" 1
1764 1 62 GLN HB2 1 63 GLY H . . 3.800 3.073 2.915 3.228 . 0 0 "[ . 1 . 2]" 1
1765 1 62 GLN HB2 1 65 ARG HD3 . . 5.370 4.645 4.547 4.710 . 0 0 "[ . 1 . 2]" 1
1766 1 62 GLN HB3 1 62 GLN HE22 . . 5.500 5.106 5.048 5.216 . 0 0 "[ . 1 . 2]" 1
1767 1 62 GLN HB3 1 63 GLY H . . 3.820 2.771 2.626 3.034 . 0 0 "[ . 1 . 2]" 1
1768 1 62 GLN HB3 1 63 GLY HA2 . . 4.800 3.792 3.716 3.927 . 0 0 "[ . 1 . 2]" 1
1769 1 62 GLN HB3 1 63 GLY HA3 . . 4.670 4.501 4.401 4.705 0.035 5 0 "[ . 1 . 2]" 1
1770 1 62 GLN HB3 1 66 TYR QE . . 4.800 2.946 2.658 3.214 . 0 0 "[ . 1 . 2]" 1
1771 1 62 GLN HE21 1 65 ARG HD3 . . 5.500 5.347 3.162 5.512 0.012 3 0 "[ . 1 . 2]" 1
1772 1 62 GLN HE22 1 62 GLN HG2 . . 3.960 3.585 3.519 4.064 0.104 5 0 "[ . 1 . 2]" 1
1773 1 62 GLN HE22 1 65 ARG HD3 . . 5.410 5.393 4.899 5.490 0.080 9 0 "[ . 1 . 2]" 1
1774 1 62 GLN HG2 1 63 GLY H . . 5.500 5.005 4.905 5.130 . 0 0 "[ . 1 . 2]" 1
1775 1 62 GLN HG2 1 66 TYR QE . . 4.670 4.148 3.795 4.478 . 0 0 "[ . 1 . 2]" 1
1776 1 62 GLN HG3 1 65 ARG HD3 . . 4.480 2.394 2.289 2.558 . 0 0 "[ . 1 . 2]" 1
1777 1 62 GLN HG3 1 66 TYR QE . . 3.810 2.965 2.407 3.440 . 0 0 "[ . 1 . 2]" 1
1778 1 63 GLY H 1 64 LEU H . . 4.460 2.901 2.808 3.012 . 0 0 "[ . 1 . 2]" 1
1779 1 63 GLY H 1 65 ARG H . . 5.250 4.382 4.340 4.416 . 0 0 "[ . 1 . 2]" 1
1780 1 63 GLY H 1 66 TYR QD . . 4.510 4.430 4.181 4.575 0.065 9 0 "[ . 1 . 2]" 1
1781 1 63 GLY H 1 66 TYR QE . . 5.500 4.423 4.148 4.757 . 0 0 "[ . 1 . 2]" 1
1782 1 63 GLY H 1 79 LEU MD1 . . 4.800 4.006 3.694 4.300 . 0 0 "[ . 1 . 2]" 1
1783 1 63 GLY H 1 79 LEU MD2 . . 5.500 3.732 3.439 3.921 . 0 0 "[ . 1 . 2]" 1
1784 1 63 GLY HA2 1 66 TYR H . . 5.310 3.946 3.680 4.107 . 0 0 "[ . 1 . 2]" 1
1785 1 63 GLY HA2 1 66 TYR QD . . 4.480 2.196 2.097 2.364 . 0 0 "[ . 1 . 2]" 1
1786 1 63 GLY HA2 1 67 THR MG . . 5.120 4.134 4.007 4.283 . 0 0 "[ . 1 . 2]" 1
1787 1 63 GLY HA2 1 79 LEU MD1 . . 5.500 4.120 3.858 4.591 . 0 0 "[ . 1 . 2]" 1
1788 1 63 GLY HA2 1 79 LEU MD2 . . 4.630 3.183 3.079 3.265 . 0 0 "[ . 1 . 2]" 1
1789 1 63 GLY HA3 1 65 ARG H . . 5.500 4.314 4.277 4.380 . 0 0 "[ . 1 . 2]" 1
1790 1 63 GLY HA3 1 66 TYR H . . 5.440 4.849 4.631 4.982 . 0 0 "[ . 1 . 2]" 1
1791 1 63 GLY HA3 1 66 TYR QD . . 4.300 3.830 3.720 3.929 . 0 0 "[ . 1 . 2]" 1
1792 1 63 GLY HA3 1 79 LEU MD1 . . 4.970 2.812 2.501 3.270 . 0 0 "[ . 1 . 2]" 1
1793 1 63 GLY HA3 1 79 LEU MD2 . . 4.540 2.004 1.867 2.140 . 0 0 "[ . 1 . 2]" 1
1794 1 64 LEU H 1 64 LEU HB2 . . 3.450 2.351 2.122 2.439 . 0 0 "[ . 1 . 2]" 1
1795 1 64 LEU H 1 64 LEU HB3 . . 3.710 3.550 3.456 3.573 . 0 0 "[ . 1 . 2]" 1
1796 1 64 LEU H 1 64 LEU MD1 . . 3.590 3.367 3.217 3.600 0.010 6 0 "[ . 1 . 2]" 1
1797 1 64 LEU H 1 64 LEU MD2 . . 4.340 3.600 3.445 3.903 . 0 0 "[ . 1 . 2]" 1
1798 1 64 LEU H 1 64 LEU HG . . 4.010 2.269 2.047 2.844 . 0 0 "[ . 1 . 2]" 1
1799 1 64 LEU H 1 65 ARG H . . 3.990 2.840 2.736 2.934 . 0 0 "[ . 1 . 2]" 1
1800 1 64 LEU H 1 65 ARG HG3 . . 4.990 3.788 3.712 3.862 . 0 0 "[ . 1 . 2]" 1
1801 1 64 LEU H 1 66 TYR H . . 5.010 4.280 4.080 4.460 . 0 0 "[ . 1 . 2]" 1
1802 1 64 LEU H 1 66 TYR QD . . 4.660 4.589 4.273 4.719 0.059 14 0 "[ . 1 . 2]" 1
1803 1 64 LEU H 1 79 LEU HB2 . . 4.620 4.646 4.579 4.692 0.072 14 0 "[ . 1 . 2]" 1
1804 1 64 LEU H 1 79 LEU HB3 . . 4.880 3.844 3.593 4.359 . 0 0 "[ . 1 . 2]" 1
1805 1 64 LEU H 1 79 LEU MD2 . . 3.860 2.741 2.545 2.928 . 0 0 "[ . 1 . 2]" 1
1806 1 64 LEU H 1 80 GLN HE22 . . 5.500 4.825 4.476 4.927 . 0 0 "[ . 1 . 2]" 1
1807 1 64 LEU HA 1 64 LEU MD1 . . 3.810 3.834 3.782 3.855 0.045 13 0 "[ . 1 . 2]" 1
1808 1 64 LEU HA 1 64 LEU MD2 . . 3.100 2.026 1.929 2.141 . 0 0 "[ . 1 . 2]" 1
1809 1 64 LEU HA 1 64 LEU HG . . 3.940 2.837 2.658 2.932 . 0 0 "[ . 1 . 2]" 1
1810 1 64 LEU HA 1 66 TYR H . . 4.820 3.541 3.386 3.767 . 0 0 "[ . 1 . 2]" 1
1811 1 64 LEU HA 1 67 THR H . . 4.670 3.204 2.868 4.172 . 0 0 "[ . 1 . 2]" 1
1812 1 64 LEU HA 1 67 THR MG . . 4.220 2.672 2.397 2.984 . 0 0 "[ . 1 . 2]" 1
1813 1 64 LEU HA 1 79 LEU HB2 . . 4.870 4.740 4.419 4.995 0.125 8 0 "[ . 1 . 2]" 1
1814 1 64 LEU HA 1 79 LEU MD2 . . 3.820 2.715 2.491 3.054 . 0 0 "[ . 1 . 2]" 1
1815 1 64 LEU HB2 1 65 ARG H . . 4.080 3.526 3.451 3.623 . 0 0 "[ . 1 . 2]" 1
1816 1 64 LEU HB3 1 64 LEU MD2 . . 3.480 2.298 2.190 2.390 . 0 0 "[ . 1 . 2]" 1
1817 1 64 LEU HB3 1 65 ARG H . . 4.770 4.222 4.012 4.366 . 0 0 "[ . 1 . 2]" 1
1818 1 64 LEU MD1 1 65 ARG H . . 5.500 5.121 5.011 5.297 . 0 0 "[ . 1 . 2]" 1
1819 1 64 LEU MD1 1 76 ARG HG2 . . 4.440 4.473 4.313 4.517 0.077 10 0 "[ . 1 . 2]" 1
1820 1 64 LEU MD1 1 79 LEU HB2 . . 4.000 3.622 3.330 4.039 0.039 3 0 "[ . 1 . 2]" 1
1821 1 64 LEU MD1 1 80 GLN HB2 . . 5.320 5.066 4.838 5.355 0.035 17 0 "[ . 1 . 2]" 1
1822 1 64 LEU MD1 1 80 GLN HE21 . . 4.080 3.402 2.145 3.902 . 0 0 "[ . 1 . 2]" 1
1823 1 64 LEU MD1 1 80 GLN HE22 . . 5.030 2.123 1.710 3.286 . 0 0 "[ . 1 . 2]" 1
1824 1 64 LEU MD1 1 80 GLN HG3 . . 4.390 4.187 2.896 4.406 0.016 15 0 "[ . 1 . 2]" 1
1825 1 64 LEU MD1 1 83 LEU HB3 . . 4.950 5.020 4.779 5.375 0.425 20 0 "[ . 1 . 2]" 1
1826 1 64 LEU MD1 1 83 LEU MD2 . . 3.460 2.789 2.555 3.019 . 0 0 "[ . 1 . 2]" 1
1827 1 64 LEU MD2 1 76 ARG HA . . 3.380 2.470 2.235 2.993 . 0 0 "[ . 1 . 2]" 1
1828 1 64 LEU MD2 1 76 ARG QD . . 5.070 3.798 3.521 3.968 . 0 0 "[ . 1 . 2]" 1
1829 1 64 LEU MD2 1 76 ARG HG2 . . 4.470 2.391 2.216 2.555 . 0 0 "[ . 1 . 2]" 1
1830 1 64 LEU MD2 1 76 ARG HG3 . . 3.470 2.507 2.044 3.211 . 0 0 "[ . 1 . 2]" 1
1831 1 64 LEU MD2 1 79 LEU HB2 . . 3.420 2.586 2.078 3.499 0.079 17 0 "[ . 1 . 2]" 1
1832 1 64 LEU MD2 1 79 LEU HB3 . . 4.220 3.174 2.605 4.242 0.022 3 0 "[ . 1 . 2]" 1
1833 1 64 LEU MD2 1 80 GLN H . . 5.500 4.513 4.332 5.369 . 0 0 "[ . 1 . 2]" 1
1834 1 64 LEU MD2 1 80 GLN HB2 . . 5.310 4.635 4.455 5.396 0.086 17 0 "[ . 1 . 2]" 1
1835 1 64 LEU MD2 1 80 GLN HB3 . . 5.500 5.602 5.505 5.689 0.189 20 0 "[ . 1 . 2]" 1
1836 1 64 LEU MD2 1 80 GLN HE21 . . 3.450 2.383 1.527 2.722 . 0 0 "[ . 1 . 2]" 1
1837 1 64 LEU MD2 1 80 GLN HE22 . . 5.210 1.735 1.557 2.307 . 0 0 "[ . 1 . 2]" 1
1838 1 64 LEU MD2 1 80 GLN HG2 . . 4.410 3.874 3.431 3.984 . 0 0 "[ . 1 . 2]" 1
1839 1 64 LEU MD2 1 80 GLN HG3 . . 4.550 4.529 3.337 4.691 0.141 2 0 "[ . 1 . 2]" 1
1840 1 64 LEU HG 1 79 LEU HB2 . . 5.200 3.037 2.918 3.196 . 0 0 "[ . 1 . 2]" 1
1841 1 65 ARG H 1 65 ARG HB2 . . 3.450 2.195 2.167 2.213 . 0 0 "[ . 1 . 2]" 1
1842 1 65 ARG H 1 65 ARG HB3 . . 3.550 3.460 3.443 3.469 . 0 0 "[ . 1 . 2]" 1
1843 1 65 ARG H 1 65 ARG HD2 . . 4.370 4.473 4.453 4.486 0.116 17 0 "[ . 1 . 2]" 1
1844 1 65 ARG H 1 65 ARG HD3 . . 4.460 3.771 3.738 3.814 . 0 0 "[ . 1 . 2]" 1
1845 1 65 ARG H 1 65 ARG HG2 . . 3.410 3.497 3.481 3.508 0.098 1 0 "[ . 1 . 2]" 1
1846 1 65 ARG H 1 65 ARG HG3 . . 3.640 2.284 2.250 2.304 . 0 0 "[ . 1 . 2]" 1
1847 1 65 ARG H 1 66 TYR H . . 3.540 2.121 2.051 2.167 . 0 0 "[ . 1 . 2]" 1
1848 1 65 ARG H 1 66 TYR HA . . 5.190 4.869 4.823 4.895 . 0 0 "[ . 1 . 2]" 1
1849 1 65 ARG H 1 66 TYR HB3 . . 5.160 5.457 5.402 5.498 0.338 14 0 "[ . 1 . 2]" 1
1850 1 65 ARG H 1 66 TYR QD . . 4.130 3.111 2.702 3.368 . 0 0 "[ . 1 . 2]" 1
1851 1 65 ARG H 1 66 TYR QE . . 5.330 3.805 3.729 3.988 . 0 0 "[ . 1 . 2]" 1
1852 1 65 ARG HA 1 65 ARG HG3 . . 3.450 3.026 3.000 3.061 . 0 0 "[ . 1 . 2]" 1
1853 1 65 ARG HA 1 66 TYR QD . . 5.470 4.881 4.741 4.944 . 0 0 "[ . 1 . 2]" 1
1854 1 65 ARG HB2 1 65 ARG HD2 . . 3.650 3.648 3.636 3.666 0.016 3 0 "[ . 1 . 2]" 1
1855 1 65 ARG HB2 1 65 ARG HD3 . . 3.620 2.402 2.376 2.426 . 0 0 "[ . 1 . 2]" 1
1856 1 65 ARG HB2 1 66 TYR H . . 3.940 2.960 2.922 2.980 . 0 0 "[ . 1 . 2]" 1
1857 1 65 ARG HB2 1 66 TYR QD . . 3.830 2.996 2.618 3.229 . 0 0 "[ . 1 . 2]" 1
1858 1 65 ARG HB2 1 66 TYR QE . . 3.980 2.700 2.435 2.900 . 0 0 "[ . 1 . 2]" 1
1859 1 65 ARG HB3 1 65 ARG HD3 . . 3.700 2.929 2.857 3.002 . 0 0 "[ . 1 . 2]" 1
1860 1 65 ARG HB3 1 66 TYR H . . 4.270 3.959 3.942 3.976 . 0 0 "[ . 1 . 2]" 1
1861 1 65 ARG HB3 1 66 TYR QD . . 4.780 3.974 3.905 4.027 . 0 0 "[ . 1 . 2]" 1
1862 1 65 ARG HB3 1 66 TYR QE . . 4.530 3.555 3.365 3.641 . 0 0 "[ . 1 . 2]" 1
1863 1 65 ARG HD2 1 66 TYR QE . . 4.510 4.502 4.352 4.607 0.097 9 0 "[ . 1 . 2]" 1
1864 1 65 ARG HD3 1 66 TYR H . . 5.160 5.227 5.191 5.248 0.088 7 0 "[ . 1 . 2]" 1
1865 1 65 ARG HD3 1 66 TYR QD . . 5.060 4.486 4.233 4.660 . 0 0 "[ . 1 . 2]" 1
1866 1 65 ARG HD3 1 66 TYR QE . . 4.140 2.887 2.634 3.078 . 0 0 "[ . 1 . 2]" 1
1867 1 65 ARG HG2 1 66 TYR H . . 4.880 4.938 4.911 4.963 0.083 6 0 "[ . 1 . 2]" 1
1868 1 65 ARG HG2 1 66 TYR QE . . 5.500 5.036 4.926 5.092 . 0 0 "[ . 1 . 2]" 1
1869 1 65 ARG HG3 1 66 TYR H . . 4.520 4.212 4.149 4.248 . 0 0 "[ . 1 . 2]" 1
1870 1 65 ARG HG3 1 66 TYR QD . . 5.450 4.665 4.310 4.875 . 0 0 "[ . 1 . 2]" 1
1871 1 65 ARG HG3 1 66 TYR QE . . 4.870 4.182 4.077 4.280 . 0 0 "[ . 1 . 2]" 1
1872 1 66 TYR H 1 66 TYR HB2 . . 3.920 2.534 2.392 2.633 . 0 0 "[ . 1 . 2]" 1
1873 1 66 TYR H 1 66 TYR HB3 . . 3.740 3.658 3.611 3.690 . 0 0 "[ . 1 . 2]" 1
1874 1 66 TYR H 1 66 TYR QD . . 3.430 2.742 2.440 3.013 . 0 0 "[ . 1 . 2]" 1
1875 1 66 TYR H 1 66 TYR QE . . 4.150 4.326 4.288 4.400 0.250 16 0 "[ . 1 . 2]" 1
1876 1 66 TYR HB3 1 67 THR H . . 4.620 4.372 4.151 4.612 . 0 0 "[ . 1 . 2]" 1
1877 1 66 TYR HB3 1 67 THR MG . . 4.700 4.611 4.260 4.777 0.077 3 0 "[ . 1 . 2]" 1
1878 1 66 TYR QD 1 67 THR H . . 5.190 4.443 4.217 4.867 . 0 0 "[ . 1 . 2]" 1
1879 1 66 TYR QD 1 67 THR MG . . 5.240 4.327 4.114 4.613 . 0 0 "[ . 1 . 2]" 1
1880 1 67 THR H 1 67 THR MG . . 3.400 2.497 2.118 3.054 . 0 0 "[ . 1 . 2]" 1
1881 1 67 THR H 1 72 HIS HB3 . . 5.250 4.802 4.533 5.199 . 0 0 "[ . 1 . 2]" 1
1882 1 67 THR HA 1 72 HIS HB2 . . 3.870 2.226 2.097 2.639 . 0 0 "[ . 1 . 2]" 1
1883 1 67 THR HA 1 72 HIS HB3 . . 4.200 2.330 2.108 2.897 . 0 0 "[ . 1 . 2]" 1
1884 1 67 THR HB 1 72 HIS H . . 5.500 5.255 4.922 5.529 0.029 13 0 "[ . 1 . 2]" 1
1885 1 67 THR HB 1 72 HIS HA . . 5.280 5.311 5.259 5.338 0.058 20 0 "[ . 1 . 2]" 1
1886 1 67 THR HB 1 72 HIS HB3 . . 3.820 3.395 3.110 3.544 . 0 0 "[ . 1 . 2]" 1
1887 1 67 THR HB 1 73 VAL H . . 5.410 5.087 4.867 5.438 0.028 7 0 "[ . 1 . 2]" 1
1888 1 67 THR HB 1 73 VAL HA . . 5.280 3.761 3.329 4.574 . 0 0 "[ . 1 . 2]" 1
1889 1 67 THR HB 1 76 ARG H . . 4.520 3.936 3.631 4.364 . 0 0 "[ . 1 . 2]" 1
1890 1 67 THR HB 1 76 ARG HA . . 4.670 4.076 3.846 4.323 . 0 0 "[ . 1 . 2]" 1
1891 1 67 THR HB 1 76 ARG HB2 . . 4.030 2.217 1.999 2.483 . 0 0 "[ . 1 . 2]" 1
1892 1 67 THR HB 1 76 ARG HB3 . . 4.120 3.830 3.428 4.152 0.032 7 0 "[ . 1 . 2]" 1
1893 1 67 THR HB 1 76 ARG QD . . 4.730 3.944 2.961 4.747 0.017 4 0 "[ . 1 . 2]" 1
1894 1 67 THR HB 1 76 ARG HG2 . . 5.030 4.491 4.206 4.970 . 0 0 "[ . 1 . 2]" 1
1895 1 67 THR HB 1 76 ARG HG3 . . 5.130 3.194 2.787 3.609 . 0 0 "[ . 1 . 2]" 1
1896 1 67 THR MG 1 69 THR H . . 5.500 4.741 4.693 4.928 . 0 0 "[ . 1 . 2]" 1
1897 1 67 THR MG 1 72 HIS H . . 5.180 4.988 4.905 5.202 0.022 13 0 "[ . 1 . 2]" 1
1898 1 67 THR MG 1 72 HIS HB2 . . 3.520 3.219 2.867 3.396 . 0 0 "[ . 1 . 2]" 1
1899 1 67 THR MG 1 72 HIS HB3 . . 4.210 2.006 1.964 2.051 . 0 0 "[ . 1 . 2]" 1
1900 1 67 THR MG 1 72 HIS HD2 . . 5.010 5.086 5.025 5.133 0.123 11 0 "[ . 1 . 2]" 1
1901 1 67 THR MG 1 76 ARG H . . 3.840 2.910 2.620 3.174 . 0 0 "[ . 1 . 2]" 1
1902 1 67 THR MG 1 76 ARG HA . . 4.010 2.445 2.261 2.789 . 0 0 "[ . 1 . 2]" 1
1903 1 67 THR MG 1 76 ARG QD . . 5.090 4.391 3.866 4.857 . 0 0 "[ . 1 . 2]" 1
1904 1 67 THR MG 1 79 LEU MD2 . . 3.430 2.259 1.942 2.568 . 0 0 "[ . 1 . 2]" 1
1905 1 68 SER HA 1 69 THR MG . . 5.030 4.628 4.398 4.687 . 0 0 "[ . 1 . 2]" 1
1906 1 68 SER HB2 1 69 THR H . . 4.190 3.730 3.599 4.224 0.034 13 0 "[ . 1 . 2]" 1
1907 1 68 SER HB2 1 69 THR MG . . 3.900 3.632 3.325 3.974 0.074 20 0 "[ . 1 . 2]" 1
1908 1 68 SER HB3 1 69 THR H . . 4.140 4.298 4.276 4.320 0.180 20 0 "[ . 1 . 2]" 1
1909 1 68 SER HB3 1 69 THR MG . . 4.700 4.609 4.221 4.703 0.003 15 0 "[ . 1 . 2]" 1
1910 1 69 THR H 1 69 THR MG . . 3.170 2.238 2.204 2.268 . 0 0 "[ . 1 . 2]" 1
1911 1 69 THR H 1 72 HIS HB2 . . 5.500 3.001 2.554 3.484 . 0 0 "[ . 1 . 2]" 1
1912 1 69 THR H 1 72 HIS HB3 . . 5.500 4.491 4.122 5.089 . 0 0 "[ . 1 . 2]" 1
1913 1 69 THR HA 1 69 THR MG . . 3.480 3.222 3.196 3.230 . 0 0 "[ . 1 . 2]" 1
1914 1 69 THR HA 1 70 ALA HA . . 5.130 4.271 4.238 4.306 . 0 0 "[ . 1 . 2]" 1
1915 1 69 THR HA 1 70 ALA MB . . 4.480 3.963 3.941 4.037 . 0 0 "[ . 1 . 2]" 1
1916 1 69 THR HA 1 71 GLU H . . 5.220 4.210 4.147 4.260 . 0 0 "[ . 1 . 2]" 1
1917 1 69 THR HB 1 70 ALA H . . 4.420 3.779 3.611 3.843 . 0 0 "[ . 1 . 2]" 1
1918 1 69 THR HB 1 71 GLU H . . 4.770 4.430 4.374 4.487 . 0 0 "[ . 1 . 2]" 1
1919 1 69 THR HB 1 71 GLU HG2 . . 4.630 4.013 3.966 4.104 . 0 0 "[ . 1 . 2]" 1
1920 1 69 THR MG 1 70 ALA H . . 4.530 3.718 3.636 3.854 . 0 0 "[ . 1 . 2]" 1
1921 1 69 THR MG 1 71 GLU H . . 4.650 2.778 2.692 2.996 . 0 0 "[ . 1 . 2]" 1
1922 1 69 THR MG 1 71 GLU HB2 . . 4.290 4.318 4.298 4.368 0.078 20 0 "[ . 1 . 2]" 1
1923 1 69 THR MG 1 71 GLU HG3 . . 3.990 2.480 2.423 2.626 . 0 0 "[ . 1 . 2]" 1
1924 1 69 THR MG 1 72 HIS H . . 4.070 2.842 2.676 3.315 . 0 0 "[ . 1 . 2]" 1
1925 1 69 THR MG 1 72 HIS HD2 . . 4.660 4.131 3.879 4.597 . 0 0 "[ . 1 . 2]" 1
1926 1 69 THR MG 1 72 HIS HE1 . . 4.420 3.776 3.348 4.169 . 0 0 "[ . 1 . 2]" 1
1927 1 70 ALA H 1 70 ALA MB . . 3.460 2.217 2.200 2.231 . 0 0 "[ . 1 . 2]" 1
1928 1 70 ALA HA 1 73 VAL H . . 4.530 2.921 2.768 3.135 . 0 0 "[ . 1 . 2]" 1
1929 1 70 ALA HA 1 73 VAL HA . . 5.320 4.405 4.306 4.662 . 0 0 "[ . 1 . 2]" 1
1930 1 70 ALA HA 1 73 VAL HB . . 4.380 2.433 2.300 2.786 . 0 0 "[ . 1 . 2]" 1
1931 1 70 ALA HA 1 73 VAL MG1 . . 2.980 2.981 2.638 3.051 0.071 12 0 "[ . 1 . 2]" 1
1932 1 70 ALA HA 1 73 VAL MG2 . . 4.330 4.019 3.851 4.324 . 0 0 "[ . 1 . 2]" 1
1933 1 70 ALA MB 1 71 GLU H . . 3.450 3.248 3.146 3.324 . 0 0 "[ . 1 . 2]" 1
1934 1 70 ALA MB 1 71 GLU HA . . 4.650 4.146 4.103 4.168 . 0 0 "[ . 1 . 2]" 1
1935 1 70 ALA MB 1 71 GLU HG2 . . 5.250 4.696 4.585 4.832 . 0 0 "[ . 1 . 2]" 1
1936 1 70 ALA MB 1 72 HIS H . . 4.300 4.250 4.137 4.316 0.016 13 0 "[ . 1 . 2]" 1
1937 1 70 ALA MB 1 73 VAL H . . 4.460 4.198 4.047 4.253 . 0 0 "[ . 1 . 2]" 1
1938 1 70 ALA MB 1 73 VAL HB . . 3.720 3.653 3.601 3.757 0.037 13 0 "[ . 1 . 2]" 1
1939 1 70 ALA MB 1 73 VAL MG1 . . 3.440 3.116 2.634 3.207 . 0 0 "[ . 1 . 2]" 1
1940 1 70 ALA MB 1 73 VAL MG2 . . 4.280 4.307 4.288 4.321 0.041 7 0 "[ . 1 . 2]" 1
1941 1 71 GLU H 1 71 GLU HB2 . . 3.490 3.599 3.586 3.611 0.121 17 0 "[ . 1 . 2]" 1
1942 1 71 GLU H 1 71 GLU HG2 . . 3.930 1.797 1.777 1.829 . 0 0 "[ . 1 . 2]" 1
1943 1 71 GLU H 1 71 GLU HG3 . . 3.890 3.075 3.001 3.161 . 0 0 "[ . 1 . 2]" 1
1944 1 71 GLU H 1 72 HIS H . . 5.300 2.445 2.404 2.561 . 0 0 "[ . 1 . 2]" 1
1945 1 71 GLU HA 1 71 GLU HG2 . . 3.680 3.687 3.668 3.697 0.017 8 0 "[ . 1 . 2]" 1
1946 1 71 GLU HA 1 71 GLU HG3 . . 3.780 3.796 3.787 3.809 0.029 20 0 "[ . 1 . 2]" 1
1947 1 71 GLU HA 1 72 HIS HA . . 4.840 4.610 4.587 4.632 . 0 0 "[ . 1 . 2]" 1
1948 1 71 GLU HA 1 73 VAL H . . 4.360 4.082 3.917 4.230 . 0 0 "[ . 1 . 2]" 1
1949 1 71 GLU QB 1 72 HIS HD2 . . 5.300 3.318 3.259 3.375 . 0 0 "[ . 1 . 2]" 1
1950 1 71 GLU HB2 1 72 HIS H . . 4.150 4.166 4.124 4.210 0.060 7 0 "[ . 1 . 2]" 1
1951 1 71 GLU HB3 1 72 HIS H . . 5.230 4.310 4.261 4.354 . 0 0 "[ . 1 . 2]" 1
1952 1 71 GLU HB3 1 72 HIS HD2 . . 4.610 4.815 4.769 4.850 0.240 20 0 "[ . 1 . 2]" 1
1953 1 71 GLU HG2 1 72 HIS H . . 4.010 3.089 2.983 3.203 . 0 0 "[ . 1 . 2]" 1
1954 1 71 GLU HG2 1 72 HIS HA . . 4.920 5.038 5.013 5.062 0.142 13 0 "[ . 1 . 2]" 1
1955 1 71 GLU HG2 1 72 HIS HD2 . . 4.720 4.209 4.016 4.391 . 0 0 "[ . 1 . 2]" 1
1956 1 71 GLU HG3 1 72 HIS H . . 3.980 3.114 2.997 3.249 . 0 0 "[ . 1 . 2]" 1
1957 1 71 GLU HG3 1 72 HIS HD2 . . 4.980 2.566 2.391 2.761 . 0 0 "[ . 1 . 2]" 1
1958 1 72 HIS H 1 72 HIS HB3 . . 4.130 3.678 3.640 3.715 . 0 0 "[ . 1 . 2]" 1
1959 1 72 HIS H 1 72 HIS HD2 . . 4.250 3.704 3.632 3.811 . 0 0 "[ . 1 . 2]" 1
1960 1 72 HIS H 1 73 VAL H . . 4.540 2.172 2.019 2.384 . 0 0 "[ . 1 . 2]" 1
1961 1 72 HIS H 1 73 VAL HB . . 4.720 4.138 3.960 4.259 . 0 0 "[ . 1 . 2]" 1
1962 1 72 HIS H 1 73 VAL MG1 . . 3.920 3.675 3.507 3.919 . 0 0 "[ . 1 . 2]" 1
1963 1 72 HIS HA 1 72 HIS HD2 . . 4.170 2.199 2.134 2.296 . 0 0 "[ . 1 . 2]" 1
1964 1 72 HIS HA 1 73 VAL HA . . 5.030 4.827 4.615 4.897 . 0 0 "[ . 1 . 2]" 1
1965 1 72 HIS HA 1 74 ALA H . . 5.000 3.530 3.330 3.831 . 0 0 "[ . 1 . 2]" 1
1966 1 72 HIS HA 1 74 ALA MB . . 5.090 3.610 3.341 4.389 . 0 0 "[ . 1 . 2]" 1
1967 1 72 HIS HA 1 75 ILE H . . 4.520 3.245 3.082 3.495 . 0 0 "[ . 1 . 2]" 1
1968 1 72 HIS HA 1 75 ILE HB . . 4.250 3.201 2.728 3.502 . 0 0 "[ . 1 . 2]" 1
1969 1 72 HIS HA 1 75 ILE HG13 . . 5.300 3.202 2.753 5.194 . 0 0 "[ . 1 . 2]" 1
1970 1 72 HIS HA 1 75 ILE MG . . 5.060 4.472 3.745 4.830 . 0 0 "[ . 1 . 2]" 1
1971 1 72 HIS HA 1 76 ARG H . . 5.340 4.446 4.217 4.651 . 0 0 "[ . 1 . 2]" 1
1972 1 72 HIS HB2 1 72 HIS HD2 . . 3.960 3.735 3.706 3.769 . 0 0 "[ . 1 . 2]" 1
1973 1 72 HIS HB2 1 72 HIS HE1 . . 4.930 4.916 4.889 4.943 0.013 17 0 "[ . 1 . 2]" 1
1974 1 72 HIS HB2 1 73 VAL H . . 4.870 3.703 3.443 3.942 . 0 0 "[ . 1 . 2]" 1
1975 1 72 HIS HB2 1 75 ILE H . . 5.360 5.304 5.097 5.399 0.039 4 0 "[ . 1 . 2]" 1
1976 1 72 HIS HB2 1 75 ILE HB . . 5.110 4.719 4.173 5.144 0.034 13 0 "[ . 1 . 2]" 1
1977 1 72 HIS HB2 1 76 ARG H . . 5.260 5.214 4.763 5.282 0.022 19 0 "[ . 1 . 2]" 1
1978 1 72 HIS HB3 1 72 HIS HD2 . . 3.790 3.560 3.533 3.597 . 0 0 "[ . 1 . 2]" 1
1979 1 72 HIS HB3 1 73 VAL H . . 5.480 4.296 4.154 4.428 . 0 0 "[ . 1 . 2]" 1
1980 1 72 HIS HB3 1 75 ILE H . . 5.500 4.240 3.822 4.411 . 0 0 "[ . 1 . 2]" 1
1981 1 72 HIS HB3 1 75 ILE HB . . 4.680 3.156 2.542 3.618 . 0 0 "[ . 1 . 2]" 1
1982 1 72 HIS HB3 1 75 ILE MG . . 4.830 3.863 2.786 4.724 . 0 0 "[ . 1 . 2]" 1
1983 1 72 HIS HB3 1 76 ARG H . . 5.350 4.158 3.716 4.259 . 0 0 "[ . 1 . 2]" 1
1984 1 72 HIS HD2 1 75 ILE MG . . 5.500 5.354 4.758 5.603 0.103 15 0 "[ . 1 . 2]" 1
1985 1 73 VAL H 1 73 VAL HB . . 2.860 2.482 2.399 2.675 . 0 0 "[ . 1 . 2]" 1
1986 1 73 VAL H 1 73 VAL MG1 . . 2.750 2.015 1.898 2.145 . 0 0 "[ . 1 . 2]" 1
1987 1 73 VAL H 1 74 ALA H . . 4.090 2.636 2.474 3.531 . 0 0 "[ . 1 . 2]" 1
1988 1 73 VAL H 1 74 ALA HA . . 5.360 5.254 5.154 5.452 0.092 7 0 "[ . 1 . 2]" 1
1989 1 73 VAL H 1 74 ALA MB . . 4.380 4.144 3.946 4.399 0.019 3 0 "[ . 1 . 2]" 1
1990 1 73 VAL H 1 75 ILE H . . 5.480 4.234 4.115 4.599 . 0 0 "[ . 1 . 2]" 1
1991 1 73 VAL H 1 76 ARG H . . 5.500 4.704 4.527 5.077 . 0 0 "[ . 1 . 2]" 1
1992 1 73 VAL H 1 76 ARG HB3 . . 5.500 5.209 4.824 5.554 0.054 7 0 "[ . 1 . 2]" 1
1993 1 73 VAL HA 1 73 VAL MG1 . . 3.330 3.242 3.238 3.247 . 0 0 "[ . 1 . 2]" 1
1994 1 73 VAL HA 1 73 VAL MG2 . . 2.990 2.312 2.123 2.351 . 0 0 "[ . 1 . 2]" 1
1995 1 73 VAL HA 1 74 ALA MB . . 5.030 4.870 4.119 5.019 . 0 0 "[ . 1 . 2]" 1
1996 1 73 VAL HA 1 75 ILE H . . 5.340 4.053 3.705 4.210 . 0 0 "[ . 1 . 2]" 1
1997 1 73 VAL HA 1 76 ARG H . . 4.030 3.145 2.949 3.370 . 0 0 "[ . 1 . 2]" 1
1998 1 73 VAL HA 1 76 ARG HB2 . . 3.980 2.829 2.533 3.291 . 0 0 "[ . 1 . 2]" 1
1999 1 73 VAL HA 1 76 ARG HB3 . . 3.990 2.481 2.143 2.791 . 0 0 "[ . 1 . 2]" 1
2000 1 73 VAL HA 1 76 ARG QD . . 4.060 3.394 3.092 3.847 . 0 0 "[ . 1 . 2]" 1
2001 1 73 VAL HA 1 76 ARG HG2 . . 5.390 5.075 4.860 5.412 0.022 7 0 "[ . 1 . 2]" 1
2002 1 73 VAL HA 1 77 SER H . . 4.630 4.389 4.012 4.703 0.073 17 0 "[ . 1 . 2]" 1
2003 1 73 VAL HB 1 74 ALA H . . 3.870 3.976 3.926 4.239 0.369 7 0 "[ . 1 . 2]" 1
2004 1 73 VAL MG1 1 74 ALA H . . 4.300 2.307 2.144 4.127 . 0 0 "[ . 1 . 2]" 1
2005 1 73 VAL MG1 1 76 ARG QD . . 5.200 5.218 5.166 5.234 0.034 15 0 "[ . 1 . 2]" 1
2006 1 73 VAL MG2 1 74 ALA H . . 3.590 3.654 3.534 3.718 0.128 8 0 "[ . 1 . 2]" 1
2007 1 73 VAL MG2 1 74 ALA HA . . 4.780 3.811 3.631 4.155 . 0 0 "[ . 1 . 2]" 1
2008 1 73 VAL MG2 1 74 ALA MB . . 4.440 4.461 4.348 4.484 0.044 10 0 "[ . 1 . 2]" 1
2009 1 73 VAL MG2 1 75 ILE H . . 4.830 4.900 4.716 4.994 0.164 7 0 "[ . 1 . 2]" 1
2010 1 73 VAL MG2 1 76 ARG HB3 . . 4.170 3.167 2.979 3.447 . 0 0 "[ . 1 . 2]" 1
2011 1 73 VAL MG2 1 76 ARG QD . . 3.820 3.052 2.858 3.284 . 0 0 "[ . 1 . 2]" 1
2012 1 73 VAL MG2 1 77 SER H . . 5.000 4.352 4.082 4.671 . 0 0 "[ . 1 . 2]" 1
2013 1 74 ALA H 1 74 ALA MB . . 2.840 2.180 2.137 2.646 . 0 0 "[ . 1 . 2]" 1
2014 1 74 ALA H 1 75 ILE H . . 3.950 2.585 1.750 2.730 . 0 0 "[ . 1 . 2]" 1
2015 1 74 ALA H 1 75 ILE HA . . 5.360 5.259 4.320 5.361 0.001 4 0 "[ . 1 . 2]" 1
2016 1 74 ALA H 1 75 ILE HB . . 4.910 4.412 3.089 4.935 0.025 15 0 "[ . 1 . 2]" 1
2017 1 74 ALA H 1 75 ILE HG13 . . 4.900 4.918 4.524 5.095 0.195 3 0 "[ . 1 . 2]" 1
2018 1 74 ALA H 1 76 ARG H . . 5.090 3.879 2.313 4.137 . 0 0 "[ . 1 . 2]" 1
2019 1 74 ALA H 1 77 SER H . . 5.500 4.909 3.357 5.168 . 0 0 "[ . 1 . 2]" 1
2020 1 74 ALA HA 1 76 ARG H . . 4.750 4.622 4.350 4.776 0.026 13 0 "[ . 1 . 2]" 1
2021 1 74 ALA HA 1 77 SER H . . 4.140 4.054 3.652 4.178 0.038 2 0 "[ . 1 . 2]" 1
2022 1 74 ALA HA 1 77 SER HB3 . . 4.550 3.670 3.194 3.863 . 0 0 "[ . 1 . 2]" 1
2023 1 74 ALA HA 1 78 LYS QE . . 4.760 4.461 4.087 4.809 0.049 15 0 "[ . 1 . 2]" 1
2024 1 74 ALA MB 1 75 ILE H . . 3.110 2.321 2.033 2.640 . 0 0 "[ . 1 . 2]" 1
2025 1 74 ALA MB 1 75 ILE HA . . 4.260 3.703 3.640 3.852 . 0 0 "[ . 1 . 2]" 1
2026 1 74 ALA MB 1 75 ILE HB . . 4.690 3.850 3.337 4.416 . 0 0 "[ . 1 . 2]" 1
2027 1 74 ALA MB 1 75 ILE HG13 . . 3.170 3.406 3.251 3.467 0.297 13 0 "[ . 1 . 2]" 1
2028 1 74 ALA MB 1 76 ARG H . . 4.590 4.246 4.069 4.446 . 0 0 "[ . 1 . 2]" 1
2029 1 74 ALA MB 1 77 SER H . . 4.660 4.682 4.461 4.732 0.072 16 0 "[ . 1 . 2]" 1
2030 1 74 ALA MB 1 77 SER HB2 . . 4.980 5.086 5.045 5.117 0.137 4 0 "[ . 1 . 2]" 1
2031 1 74 ALA MB 1 77 SER HB3 . . 5.200 4.617 4.175 4.759 . 0 0 "[ . 1 . 2]" 1
2032 1 74 ALA MB 1 78 LYS QE . . 4.450 3.359 2.802 3.893 . 0 0 "[ . 1 . 2]" 1
2033 1 75 ILE H 1 75 ILE HB . . 2.970 2.145 1.799 2.436 . 0 0 "[ . 1 . 2]" 1
2034 1 75 ILE H 1 75 ILE MD . . 3.660 3.704 1.952 3.881 0.221 6 0 "[ . 1 . 2]" 1
2035 1 75 ILE H 1 75 ILE HG12 . . 3.810 2.599 2.340 4.036 0.226 3 0 "[ . 1 . 2]" 1
2036 1 75 ILE H 1 75 ILE HG13 . . 3.720 3.053 2.490 3.532 . 0 0 "[ . 1 . 2]" 1
2037 1 75 ILE H 1 75 ILE MG . . 4.040 3.568 3.375 3.715 . 0 0 "[ . 1 . 2]" 1
2038 1 75 ILE H 1 76 ARG H . . 3.860 2.295 1.911 2.476 . 0 0 "[ . 1 . 2]" 1
2039 1 75 ILE H 1 76 ARG HB2 . . 5.160 4.531 4.154 4.893 . 0 0 "[ . 1 . 2]" 1
2040 1 75 ILE H 1 77 SER H . . 4.890 3.736 3.291 3.958 . 0 0 "[ . 1 . 2]" 1
2041 1 75 ILE H 1 78 LYS H . . 5.500 4.707 4.252 4.860 . 0 0 "[ . 1 . 2]" 1
2042 1 75 ILE H 1 78 LYS HG3 . . 5.410 4.944 4.666 5.300 . 0 0 "[ . 1 . 2]" 1
2043 1 75 ILE HA 1 75 ILE MD . . 2.980 2.395 2.107 3.128 0.148 3 0 "[ . 1 . 2]" 1
2044 1 75 ILE HA 1 75 ILE HG12 . . 3.750 2.590 2.252 3.144 . 0 0 "[ . 1 . 2]" 1
2045 1 75 ILE HA 1 75 ILE HG13 . . 3.560 3.550 1.880 3.749 0.189 13 0 "[ . 1 . 2]" 1
2046 1 75 ILE HA 1 75 ILE MG . . 3.000 2.434 2.180 2.772 . 0 0 "[ . 1 . 2]" 1
2047 1 75 ILE HA 1 78 LYS H . . 3.660 2.916 2.210 3.161 . 0 0 "[ . 1 . 2]" 1
2048 1 75 ILE HA 1 78 LYS HB2 . . 4.080 2.599 1.796 2.992 . 0 0 "[ . 1 . 2]" 1
2049 1 75 ILE HA 1 78 LYS HB3 . . 4.540 4.189 3.472 4.444 . 0 0 "[ . 1 . 2]" 1
2050 1 75 ILE HA 1 78 LYS HD2 . . 4.390 2.525 2.142 2.987 . 0 0 "[ . 1 . 2]" 1
2051 1 75 ILE HB 1 75 ILE MD . . 3.690 3.080 2.154 3.258 . 0 0 "[ . 1 . 2]" 1
2052 1 75 ILE HB 1 76 ARG H . . 3.570 2.580 2.360 2.970 . 0 0 "[ . 1 . 2]" 1
2053 1 75 ILE HB 1 78 LYS H . . 5.420 5.055 4.768 5.231 . 0 0 "[ . 1 . 2]" 1
2054 1 75 ILE MD 1 75 ILE MG . . 3.060 1.922 1.777 2.933 . 0 0 "[ . 1 . 2]" 1
2055 1 75 ILE MD 1 78 LYS H . . 4.610 4.754 4.606 4.964 0.354 15 0 "[ . 1 . 2]" 1
2056 1 75 ILE MD 1 78 LYS HB3 . . 5.070 4.598 4.317 5.300 0.230 3 0 "[ . 1 . 2]" 1
2057 1 75 ILE MD 1 78 LYS HD2 . . 5.500 2.614 2.055 3.318 . 0 0 "[ . 1 . 2]" 1
2058 1 75 ILE MD 1 78 LYS HD3 . . 5.500 3.913 3.304 4.716 . 0 0 "[ . 1 . 2]" 1
2059 1 75 ILE MD 1 78 LYS QE . . 5.000 3.986 2.538 4.812 . 0 0 "[ . 1 . 2]" 1
2060 1 75 ILE MD 2 9 ASP HA . . 4.500 2.749 2.176 4.122 . 0 0 "[ . 1 . 2]" 1
2061 1 75 ILE MD 2 9 ASP HB2 . . 4.500 3.304 2.821 3.740 . 0 0 "[ . 1 . 2]" 1
2062 1 75 ILE MD 2 9 ASP HB3 . . 4.500 4.147 3.566 4.564 0.064 3 0 "[ . 1 . 2]" 1
2063 1 75 ILE HG12 1 75 ILE MG . . 3.430 3.103 2.081 3.231 . 0 0 "[ . 1 . 2]" 1
2064 1 75 ILE HG12 1 76 ARG H . . 5.090 4.405 4.009 5.293 0.203 3 0 "[ . 1 . 2]" 1
2065 1 75 ILE HG13 1 75 ILE MG . . 3.190 2.737 2.507 3.168 . 0 0 "[ . 1 . 2]" 1
2066 1 75 ILE HG13 1 76 ARG H . . 4.320 4.562 4.425 4.617 0.297 8 0 "[ . 1 . 2]" 1
2067 1 75 ILE MG 1 76 ARG H . . 4.040 3.222 2.708 3.604 . 0 0 "[ . 1 . 2]" 1
2068 1 75 ILE MG 1 76 ARG HB2 . . 5.360 4.359 3.608 4.954 . 0 0 "[ . 1 . 2]" 1
2069 1 75 ILE MG 1 77 SER H . . 4.440 4.442 4.119 4.535 0.095 1 0 "[ . 1 . 2]" 1
2070 1 75 ILE MG 1 78 LYS H . . 5.500 3.847 3.415 4.160 . 0 0 "[ . 1 . 2]" 1
2071 1 75 ILE MG 1 78 LYS HB3 . . 5.080 4.452 3.512 5.133 0.053 16 0 "[ . 1 . 2]" 1
2072 1 75 ILE MG 1 78 LYS QE . . 5.180 5.079 4.206 5.247 0.067 17 0 "[ . 1 . 2]" 1
2073 1 75 ILE MG 1 79 LEU H . . 4.720 3.470 2.970 3.820 . 0 0 "[ . 1 . 2]" 1
2074 1 75 ILE MG 1 79 LEU HB2 . . 4.920 3.875 3.703 4.123 . 0 0 "[ . 1 . 2]" 1
2075 1 75 ILE MG 1 79 LEU MD2 . . 3.120 1.832 1.771 1.922 . 0 0 "[ . 1 . 2]" 1
2076 1 76 ARG H 1 76 ARG HB2 . . 3.710 2.431 2.271 2.630 . 0 0 "[ . 1 . 2]" 1
2077 1 76 ARG H 1 76 ARG HB3 . . 3.730 2.610 2.441 2.745 . 0 0 "[ . 1 . 2]" 1
2078 1 76 ARG H 1 76 ARG QD . . 4.300 4.295 4.134 4.440 0.140 10 0 "[ . 1 . 2]" 1
2079 1 76 ARG H 1 76 ARG HG2 . . 4.440 4.444 4.392 4.491 0.051 11 0 "[ . 1 . 2]" 1
2080 1 76 ARG H 1 76 ARG HG3 . . 5.200 4.465 4.318 4.659 . 0 0 "[ . 1 . 2]" 1
2081 1 76 ARG H 1 77 SER H . . 3.640 2.608 2.534 2.659 . 0 0 "[ . 1 . 2]" 1
2082 1 76 ARG H 1 77 SER HB2 . . 5.440 4.731 4.627 4.898 . 0 0 "[ . 1 . 2]" 1
2083 1 76 ARG H 1 77 SER HB3 . . 4.720 4.832 4.802 4.861 0.141 17 0 "[ . 1 . 2]" 1
2084 1 76 ARG H 1 78 LYS H . . 5.490 4.004 3.718 4.095 . 0 0 "[ . 1 . 2]" 1
2085 1 76 ARG H 1 79 LEU HB2 . . 5.500 5.233 4.930 5.588 0.088 3 0 "[ . 1 . 2]" 1
2086 1 76 ARG H 1 79 LEU MD2 . . 5.500 3.634 3.349 4.023 . 0 0 "[ . 1 . 2]" 1
2087 1 76 ARG HA 1 76 ARG QD . . 3.940 3.833 3.600 4.052 0.112 10 0 "[ . 1 . 2]" 1
2088 1 76 ARG HA 1 77 SER H . . 3.390 3.440 3.199 3.490 0.100 11 0 "[ . 1 . 2]" 1
2089 1 76 ARG HA 1 77 SER HA . . 5.070 4.772 4.500 4.855 . 0 0 "[ . 1 . 2]" 1
2090 1 76 ARG HA 1 79 LEU MD2 . . 3.710 2.229 1.956 2.877 . 0 0 "[ . 1 . 2]" 1
2091 1 76 ARG HB2 1 76 ARG QD . . 3.570 2.834 2.476 3.215 . 0 0 "[ . 1 . 2]" 1
2092 1 76 ARG HB2 1 77 SER H . . 4.370 3.974 3.786 4.323 . 0 0 "[ . 1 . 2]" 1
2093 1 76 ARG HB3 1 76 ARG QD . . 3.650 2.163 2.060 2.219 . 0 0 "[ . 1 . 2]" 1
2094 1 76 ARG HB3 1 77 SER H . . 3.960 2.949 2.724 3.653 . 0 0 "[ . 1 . 2]" 1
2095 1 76 ARG HB3 1 80 GLN HE21 . . 5.500 4.967 4.644 5.642 0.142 17 0 "[ . 1 . 2]" 1
2096 1 76 ARG QD 1 77 SER H . . 4.370 4.099 3.203 4.458 0.088 17 0 "[ . 1 . 2]" 1
2097 1 76 ARG QD 1 80 GLN HE21 . . 5.500 4.396 3.704 4.795 . 0 0 "[ . 1 . 2]" 1
2098 1 76 ARG QD 1 80 GLN HE22 . . 5.340 5.260 4.833 5.414 0.074 6 0 "[ . 1 . 2]" 1
2099 1 76 ARG HG2 1 77 SER H . . 4.660 4.391 4.181 4.670 0.010 17 0 "[ . 1 . 2]" 1
2100 1 76 ARG HG2 1 78 LYS H . . 5.490 5.574 5.493 5.756 0.266 3 0 "[ . 1 . 2]" 1
2101 1 76 ARG HG2 1 80 GLN HE21 . . 5.500 2.929 2.628 3.324 . 0 0 "[ . 1 . 2]" 1
2102 1 76 ARG HG3 1 80 GLN HE21 . . 5.500 4.405 3.816 5.096 . 0 0 "[ . 1 . 2]" 1
2103 1 76 ARG HG3 1 80 GLN HE22 . . 5.500 4.598 3.919 5.508 0.008 13 0 "[ . 1 . 2]" 1
2104 1 77 SER H 1 77 SER HB2 . . 3.500 2.447 2.334 2.748 . 0 0 "[ . 1 . 2]" 1
2105 1 77 SER H 1 77 SER HB3 . . 3.540 2.493 2.411 2.559 . 0 0 "[ . 1 . 2]" 1
2106 1 77 SER H 1 78 LYS H . . 3.800 2.435 1.979 2.650 . 0 0 "[ . 1 . 2]" 1
2107 1 77 SER H 1 79 LEU H . . 5.500 4.090 3.792 4.240 . 0 0 "[ . 1 . 2]" 1
2108 1 77 SER H 1 79 LEU HB2 . . 5.500 5.095 4.830 5.425 . 0 0 "[ . 1 . 2]" 1
2109 1 77 SER H 1 79 LEU MD2 . . 4.850 4.491 4.306 4.653 . 0 0 "[ . 1 . 2]" 1
2110 1 77 SER H 1 80 GLN H . . 5.290 5.231 5.043 5.313 0.023 14 0 "[ . 1 . 2]" 1
2111 1 77 SER HA 1 79 LEU H . . 4.660 4.678 4.582 4.749 0.089 6 0 "[ . 1 . 2]" 1
2112 1 77 SER HA 1 80 GLN H . . 4.210 4.100 3.838 4.237 0.027 8 0 "[ . 1 . 2]" 1
2113 1 77 SER HA 1 80 GLN HB3 . . 4.200 4.355 4.305 4.394 0.194 1 0 "[ . 1 . 2]" 1
2114 1 77 SER HA 1 80 GLN HE21 . . 5.500 4.020 3.514 5.364 . 0 0 "[ . 1 . 2]" 1
2115 1 77 SER HA 1 80 GLN HG2 . . 4.810 4.001 3.443 4.450 . 0 0 "[ . 1 . 2]" 1
2116 1 77 SER HA 2 5 MET ME . . 4.500 4.176 3.849 4.453 . 0 0 "[ . 1 . 2]" 1
2117 1 77 SER QB 2 5 MET ME . . 3.500 3.369 2.870 3.583 0.083 8 0 "[ . 1 . 2]" 1
2118 1 77 SER HB2 1 78 LYS H . . 4.080 4.016 3.902 4.114 0.034 17 0 "[ . 1 . 2]" 1
2119 1 77 SER HB2 1 78 LYS HG3 . . 5.330 4.653 4.416 5.171 . 0 0 "[ . 1 . 2]" 1
2120 1 77 SER HB3 1 78 LYS H . . 4.050 2.954 2.770 3.207 . 0 0 "[ . 1 . 2]" 1
2121 1 78 LYS H 1 78 LYS HB2 . . 3.810 2.407 2.288 2.538 . 0 0 "[ . 1 . 2]" 1
2122 1 78 LYS H 1 78 LYS HB3 . . 3.940 3.601 3.550 3.687 . 0 0 "[ . 1 . 2]" 1
2123 1 78 LYS H 1 78 LYS HD2 . . 5.120 4.066 3.922 4.316 . 0 0 "[ . 1 . 2]" 1
2124 1 78 LYS H 1 78 LYS QE . . 4.580 4.422 4.140 4.632 0.052 14 0 "[ . 1 . 2]" 1
2125 1 78 LYS H 1 78 LYS HG2 . . 4.130 3.595 3.247 3.815 . 0 0 "[ . 1 . 2]" 1
2126 1 78 LYS H 1 78 LYS HG3 . . 4.250 2.415 2.142 2.698 . 0 0 "[ . 1 . 2]" 1
2127 1 78 LYS H 1 79 LEU H . . 3.890 2.306 2.076 2.584 . 0 0 "[ . 1 . 2]" 1
2128 1 78 LYS H 1 79 LEU HB2 . . 4.730 4.185 3.908 4.557 . 0 0 "[ . 1 . 2]" 1
2129 1 78 LYS H 1 80 GLN H . . 4.980 3.851 3.524 4.209 . 0 0 "[ . 1 . 2]" 1
2130 1 78 LYS H 1 81 TYR H . . 5.500 4.897 4.753 5.295 . 0 0 "[ . 1 . 2]" 1
2131 1 78 LYS H 1 81 TYR QB . . 5.500 5.037 4.837 5.476 . 0 0 "[ . 1 . 2]" 1
2132 1 78 LYS HA 1 78 LYS HD3 . . 4.920 4.300 4.169 4.422 . 0 0 "[ . 1 . 2]" 1
2133 1 78 LYS HA 1 78 LYS QE . . 4.950 4.413 4.165 4.682 . 0 0 "[ . 1 . 2]" 1
2134 1 78 LYS HA 1 78 LYS HG3 . . 4.220 3.031 2.770 3.275 . 0 0 "[ . 1 . 2]" 1
2135 1 78 LYS HA 1 80 GLN H . . 4.150 3.703 3.255 4.214 0.064 15 0 "[ . 1 . 2]" 1
2136 1 78 LYS HA 1 81 TYR H . . 4.020 3.139 2.865 3.569 . 0 0 "[ . 1 . 2]" 1
2137 1 78 LYS HA 1 81 TYR QB . . 3.890 2.561 2.307 3.109 . 0 0 "[ . 1 . 2]" 1
2138 1 78 LYS HA 1 82 ARG H . . 5.500 4.122 3.583 4.922 . 0 0 "[ . 1 . 2]" 1
2139 1 78 LYS HA 2 5 MET ME . . 3.500 2.063 1.816 2.299 . 0 0 "[ . 1 . 2]" 1
2140 1 78 LYS HB2 1 78 LYS QE . . 4.160 3.955 3.918 4.006 . 0 0 "[ . 1 . 2]" 1
2141 1 78 LYS HB2 1 79 LEU H . . 4.170 2.675 2.438 2.830 . 0 0 "[ . 1 . 2]" 1
2142 1 78 LYS HB2 1 79 LEU HB2 . . 5.260 4.773 4.380 5.082 . 0 0 "[ . 1 . 2]" 1
2143 1 78 LYS HB3 1 78 LYS QE . . 4.170 3.904 3.797 3.971 . 0 0 "[ . 1 . 2]" 1
2144 1 78 LYS HB3 1 79 LEU H . . 4.520 3.711 3.497 3.838 . 0 0 "[ . 1 . 2]" 1
2145 1 78 LYS HB3 1 81 TYR H . . 5.340 4.805 4.478 5.071 . 0 0 "[ . 1 . 2]" 1
2146 1 78 LYS HB3 1 81 TYR QB . . 4.940 4.184 3.804 4.527 . 0 0 "[ . 1 . 2]" 1
2147 1 78 LYS HB3 1 82 ARG QD . . 5.420 3.077 2.490 3.885 . 0 0 "[ . 1 . 2]" 1
2148 1 78 LYS QD 2 5 MET HA . . 5.000 2.704 2.121 3.771 . 0 0 "[ . 1 . 2]" 1
2149 1 78 LYS QD 2 5 MET ME . . 5.000 4.104 3.584 4.691 . 0 0 "[ . 1 . 2]" 1
2150 1 78 LYS QE 2 4 GLU QB . . 4.500 2.673 1.956 3.173 . 0 0 "[ . 1 . 2]" 1
2151 1 78 LYS QE 2 4 GLU QG . . 4.000 2.106 1.859 3.551 . 0 0 "[ . 1 . 2]" 1
2152 1 78 LYS QE 2 5 MET HA . . 2.500 2.585 2.533 2.715 0.215 6 0 "[ . 1 . 2]" 1
2153 1 78 LYS QE 2 5 MET ME . . 5.000 3.471 2.702 4.102 . 0 0 "[ . 1 . 2]" 1
2154 1 78 LYS QG 2 5 MET HA . . 4.500 2.416 2.101 2.944 . 0 0 "[ . 1 . 2]" 1
2155 1 78 LYS QG 2 5 MET ME . . 5.000 2.290 1.886 2.928 . 0 0 "[ . 1 . 2]" 1
2156 1 78 LYS HG2 1 79 LEU H . . 5.370 4.964 4.833 5.106 . 0 0 "[ . 1 . 2]" 1
2157 1 78 LYS HG3 1 79 LEU H . . 5.500 4.266 4.021 4.643 . 0 0 "[ . 1 . 2]" 1
2158 1 79 LEU H 1 79 LEU HB2 . . 3.960 2.233 2.137 2.416 . 0 0 "[ . 1 . 2]" 1
2159 1 79 LEU H 1 79 LEU HB3 . . 4.050 3.505 3.466 3.589 . 0 0 "[ . 1 . 2]" 1
2160 1 79 LEU H 1 79 LEU MD1 . . 3.850 2.210 2.124 2.325 . 0 0 "[ . 1 . 2]" 1
2161 1 79 LEU H 1 79 LEU MD2 . . 3.750 2.818 2.652 3.004 . 0 0 "[ . 1 . 2]" 1
2162 1 79 LEU H 1 79 LEU HG . . 4.050 4.013 3.953 4.054 0.004 14 0 "[ . 1 . 2]" 1
2163 1 79 LEU H 1 80 GLN H . . 4.140 2.726 2.659 2.786 . 0 0 "[ . 1 . 2]" 1
2164 1 79 LEU H 1 81 TYR H . . 5.500 4.191 4.062 4.354 . 0 0 "[ . 1 . 2]" 1
2165 1 79 LEU H 1 82 ARG QD . . 5.500 4.360 4.033 4.619 . 0 0 "[ . 1 . 2]" 1
2166 1 79 LEU HA 1 79 LEU MD1 . . 3.720 2.028 1.956 2.104 . 0 0 "[ . 1 . 2]" 1
2167 1 79 LEU HA 1 79 LEU MD2 . . 4.730 3.802 3.761 3.842 . 0 0 "[ . 1 . 2]" 1
2168 1 79 LEU HA 1 79 LEU HG . . 3.710 3.040 2.941 3.158 . 0 0 "[ . 1 . 2]" 1
2169 1 79 LEU HA 1 81 TYR H . . 4.930 4.134 3.888 4.501 . 0 0 "[ . 1 . 2]" 1
2170 1 79 LEU HA 1 82 ARG H . . 5.500 4.347 3.813 4.826 . 0 0 "[ . 1 . 2]" 1
2171 1 79 LEU HA 1 82 ARG QD . . 4.400 3.072 2.281 3.735 . 0 0 "[ . 1 . 2]" 1
2172 1 79 LEU HB2 1 79 LEU MD1 . . 3.650 2.940 2.883 3.028 . 0 0 "[ . 1 . 2]" 1
2173 1 79 LEU HB2 1 79 LEU MD2 . . 3.490 2.107 2.063 2.137 . 0 0 "[ . 1 . 2]" 1
2174 1 79 LEU HB2 1 80 GLN H . . 3.300 3.152 2.595 3.466 0.166 17 0 "[ . 1 . 2]" 1
2175 1 79 LEU HB2 1 80 GLN HG2 . . 4.930 4.975 4.789 5.071 0.141 8 0 "[ . 1 . 2]" 1
2176 1 79 LEU HB3 1 80 GLN H . . 4.250 3.869 3.384 4.089 . 0 0 "[ . 1 . 2]" 1
2177 1 79 LEU MD1 1 80 GLN H . . 5.120 4.262 4.205 4.314 . 0 0 "[ . 1 . 2]" 1
2178 1 79 LEU MD1 1 82 ARG QD . . 4.400 3.359 2.912 3.926 . 0 0 "[ . 1 . 2]" 1
2179 1 79 LEU HG 1 80 GLN H . . 5.500 5.480 5.148 5.591 0.091 17 0 "[ . 1 . 2]" 1
2180 1 79 LEU HG 1 80 GLN HE21 . . 5.480 5.494 5.358 5.650 0.170 3 0 "[ . 1 . 2]" 1
2181 1 80 GLN H 1 80 GLN HB2 . . 3.670 1.881 1.751 2.254 . 0 0 "[ . 1 . 2]" 1
2182 1 80 GLN H 1 80 GLN HB3 . . 3.500 3.239 3.148 3.552 0.052 17 0 "[ . 1 . 2]" 1
2183 1 80 GLN H 1 80 GLN HE21 . . 5.500 2.834 2.197 4.434 . 0 0 "[ . 1 . 2]" 1
2184 1 80 GLN H 1 80 GLN HG2 . . 3.700 3.759 3.546 3.945 0.245 17 0 "[ . 1 . 2]" 1
2185 1 80 GLN H 1 80 GLN HG3 . . 3.900 4.180 3.803 4.290 0.390 9 0 "[ . 1 . 2]" 1
2186 1 80 GLN H 1 81 TYR H . . 4.030 2.284 1.960 2.683 . 0 0 "[ . 1 . 2]" 1
2187 1 80 GLN H 1 81 TYR HA . . 5.020 4.916 4.743 5.230 0.210 14 0 "[ . 1 . 2]" 1
2188 1 80 GLN H 1 82 ARG H . . 5.500 4.396 3.811 4.657 . 0 0 "[ . 1 . 2]" 1
2189 1 80 GLN H 1 83 LEU HB3 . . 4.740 4.296 3.968 4.441 . 0 0 "[ . 1 . 2]" 1
2190 1 80 GLN H 1 83 LEU MD2 . . 5.100 4.417 4.284 4.480 . 0 0 "[ . 1 . 2]" 1
2191 1 80 GLN HA 1 80 GLN HE22 . . 4.830 4.012 3.753 4.805 . 0 0 "[ . 1 . 2]" 1
2192 1 80 GLN HA 1 80 GLN HG2 . . 3.990 3.658 3.562 3.790 . 0 0 "[ . 1 . 2]" 1
2193 1 80 GLN HA 1 80 GLN HG3 . . 3.660 2.717 2.465 2.842 . 0 0 "[ . 1 . 2]" 1
2194 1 80 GLN HA 1 83 LEU HB3 . . 3.370 2.369 1.947 2.665 . 0 0 "[ . 1 . 2]" 1
2195 1 80 GLN HA 1 83 LEU MD2 . . 3.030 2.240 2.018 2.458 . 0 0 "[ . 1 . 2]" 1
2196 1 80 GLN HB2 1 80 GLN HE22 . . 4.810 3.968 3.732 4.614 . 0 0 "[ . 1 . 2]" 1
2197 1 80 GLN HB2 1 81 TYR H . . 4.510 3.159 2.892 3.279 . 0 0 "[ . 1 . 2]" 1
2198 1 80 GLN HB2 1 83 LEU MD2 . . 4.600 4.759 4.726 4.808 0.208 10 0 "[ . 1 . 2]" 1
2199 1 80 GLN HB3 1 80 GLN HE22 . . 5.370 5.085 4.973 5.402 0.032 17 0 "[ . 1 . 2]" 1
2200 1 80 GLN HB3 1 81 TYR H . . 3.780 3.619 3.357 3.883 0.103 17 0 "[ . 1 . 2]" 1
2201 1 80 GLN HB3 1 81 TYR QB . . 4.700 4.423 4.207 4.729 0.029 3 0 "[ . 1 . 2]" 1
2202 1 80 GLN HE21 1 80 GLN HG2 . . 3.600 2.477 2.380 3.020 . 0 0 "[ . 1 . 2]" 1
2203 1 80 GLN HE21 1 80 GLN HG3 . . 3.670 3.521 2.295 3.617 . 0 0 "[ . 1 . 2]" 1
2204 1 80 GLN HE21 1 83 LEU MD2 . . 4.980 4.627 4.227 4.833 . 0 0 "[ . 1 . 2]" 1
2205 1 80 GLN HE22 1 80 GLN HG2 . . 3.860 3.604 3.549 3.869 0.009 17 0 "[ . 1 . 2]" 1
2206 1 80 GLN HE22 1 83 LEU MD2 . . 4.740 3.950 3.525 4.843 0.103 17 0 "[ . 1 . 2]" 1
2207 1 80 GLN HG2 1 81 TYR H . . 5.200 5.311 5.183 5.378 0.178 7 0 "[ . 1 . 2]" 1
2208 1 81 TYR H 1 81 TYR QB . . 3.400 2.150 2.059 2.293 . 0 0 "[ . 1 . 2]" 1
2209 1 81 TYR H 1 81 TYR QD . . 4.170 3.928 3.715 4.096 . 0 0 "[ . 1 . 2]" 1
2210 1 81 TYR H 1 82 ARG H . . 4.260 2.567 2.380 2.785 . 0 0 "[ . 1 . 2]" 1
2211 1 81 TYR H 1 82 ARG HA . . 5.500 5.169 5.002 5.346 . 0 0 "[ . 1 . 2]" 1
2212 1 81 TYR H 1 82 ARG QD . . 5.500 3.275 3.096 3.549 . 0 0 "[ . 1 . 2]" 1
2213 1 81 TYR H 1 83 LEU H . . 4.980 3.301 2.948 3.641 . 0 0 "[ . 1 . 2]" 1
2214 1 81 TYR HA 1 81 TYR QD . . 3.440 2.879 2.608 3.195 . 0 0 "[ . 1 . 2]" 1
2215 1 81 TYR HA 1 81 TYR QE . . 5.040 4.896 4.717 5.066 0.026 8 0 "[ . 1 . 2]" 1
2216 1 81 TYR HA 1 83 LEU H . . 5.500 4.053 3.865 4.329 . 0 0 "[ . 1 . 2]" 1
2217 1 81 TYR HA 1 84 GLU H . . 4.620 3.622 3.422 3.857 . 0 0 "[ . 1 . 2]" 1
2218 1 81 TYR HA 1 84 GLU QB . . 3.700 3.420 2.870 3.656 . 0 0 "[ . 1 . 2]" 1
2219 1 81 TYR HA 1 84 GLU HG2 . . 5.320 3.666 2.114 5.367 0.047 7 0 "[ . 1 . 2]" 1
2220 1 81 TYR HA 1 85 LEU H . . 5.500 4.897 4.406 5.338 . 0 0 "[ . 1 . 2]" 1
2221 1 81 TYR HA 1 85 LEU MD2 . . 5.500 4.629 4.383 4.804 . 0 0 "[ . 1 . 2]" 1
2222 1 81 TYR QB 1 82 ARG H . . 4.400 2.470 2.043 2.927 . 0 0 "[ . 1 . 2]" 1
2223 1 81 TYR QB 1 82 ARG HA . . 5.010 4.448 4.320 4.669 . 0 0 "[ . 1 . 2]" 1
2224 1 81 TYR QB 1 82 ARG HB2 . . 5.230 5.231 4.990 5.342 0.112 14 0 "[ . 1 . 2]" 1
2225 1 81 TYR QB 1 83 LEU H . . 4.690 4.182 3.959 4.522 . 0 0 "[ . 1 . 2]" 1
2226 1 81 TYR QB 1 84 GLU H . . 5.250 4.934 4.800 5.112 . 0 0 "[ . 1 . 2]" 1
2227 1 81 TYR QB 1 84 GLU QB . . 5.250 5.116 4.690 5.295 0.045 6 0 "[ . 1 . 2]" 1
2228 1 81 TYR QB 1 85 LEU MD2 . . 4.810 4.459 4.278 4.731 . 0 0 "[ . 1 . 2]" 1
2229 1 81 TYR QB 2 5 MET ME . . 4.000 2.168 1.891 2.813 . 0 0 "[ . 1 . 2]" 1
2230 1 81 TYR QD 1 82 ARG H . . 3.770 2.567 2.260 3.063 . 0 0 "[ . 1 . 2]" 1
2231 1 81 TYR QD 1 82 ARG HA . . 3.910 3.488 3.013 3.790 . 0 0 "[ . 1 . 2]" 1
2232 1 81 TYR QD 1 82 ARG HB2 . . 4.040 4.056 3.783 4.180 0.140 16 0 "[ . 1 . 2]" 1
2233 1 81 TYR QD 1 82 ARG QD . . 4.450 2.349 1.866 3.315 . 0 0 "[ . 1 . 2]" 1
2234 1 81 TYR QD 1 83 LEU H . . 4.530 4.617 4.560 4.658 0.128 6 0 "[ . 1 . 2]" 1
2235 1 81 TYR QD 1 84 GLU H . . 5.500 5.142 4.939 5.337 . 0 0 "[ . 1 . 2]" 1
2236 1 81 TYR QD 1 84 GLU QB . . 5.500 5.082 4.409 5.624 0.124 3 0 "[ . 1 . 2]" 1
2237 1 81 TYR QD 1 85 LEU H . . 5.500 5.402 5.039 5.600 0.100 10 0 "[ . 1 . 2]" 1
2238 1 81 TYR QD 1 85 LEU HB3 . . 4.880 4.707 4.481 4.947 0.067 6 0 "[ . 1 . 2]" 1
2239 1 81 TYR QD 1 85 LEU QD . . 3.430 3.257 3.003 3.444 0.014 19 0 "[ . 1 . 2]" 1
2240 1 81 TYR QD 1 85 LEU MD2 . . 3.800 3.279 3.016 3.473 . 0 0 "[ . 1 . 2]" 1
2241 1 81 TYR QD 2 5 MET HA . . 5.000 4.502 3.977 4.848 . 0 0 "[ . 1 . 2]" 1
2242 1 81 TYR QD 2 5 MET QB . . 4.500 2.477 2.027 4.303 . 0 0 "[ . 1 . 2]" 1
2243 1 81 TYR QD 2 5 MET ME . . 4.000 3.388 2.962 3.897 . 0 0 "[ . 1 . 2]" 1
2244 1 81 TYR QE 1 82 ARG HA . . 4.550 4.202 4.016 4.368 . 0 0 "[ . 1 . 2]" 1
2245 1 81 TYR QE 1 85 LEU QD . . 2.800 2.814 2.639 2.852 0.052 8 0 "[ . 1 . 2]" 1
2246 1 81 TYR QE 1 85 LEU MD2 . . 3.220 2.832 2.653 2.873 . 0 0 "[ . 1 . 2]" 1
2247 1 81 TYR QE 2 3 THR MG . . 5.000 4.052 2.802 4.874 . 0 0 "[ . 1 . 2]" 1
2248 1 81 TYR QE 2 5 MET HA . . 5.000 5.055 4.727 5.170 0.170 8 0 "[ . 1 . 2]" 1
2249 1 81 TYR QE 2 5 MET QB . . 4.500 2.850 2.397 4.148 . 0 0 "[ . 1 . 2]" 1
2250 1 81 TYR QE 2 5 MET ME . . 5.000 4.608 4.262 5.013 0.013 18 0 "[ . 1 . 2]" 1
2251 1 81 TYR QE 2 5 MET QG . . 4.500 3.147 2.734 4.076 . 0 0 "[ . 1 . 2]" 1
2252 1 81 TYR QE 2 6 GLU HA . . 4.500 4.372 3.705 4.603 0.103 14 0 "[ . 1 . 2]" 1
2253 1 81 TYR QE 2 6 GLU QG . . 4.500 4.527 4.099 4.585 0.085 17 0 "[ . 1 . 2]" 1
2254 1 82 ARG H 1 82 ARG QD . . 4.810 1.700 1.562 2.082 . 0 0 "[ . 1 . 2]" 1
2255 1 82 ARG H 1 83 LEU H . . 4.560 2.284 1.969 2.546 . 0 0 "[ . 1 . 2]" 1
2256 1 82 ARG H 1 84 GLU H . . 5.180 3.945 3.613 4.258 . 0 0 "[ . 1 . 2]" 1
2257 1 82 ARG H 1 84 GLU QB . . 5.360 5.386 5.170 5.512 0.152 17 0 "[ . 1 . 2]" 1
2258 1 82 ARG H 1 85 LEU MD2 . . 5.500 4.037 3.834 4.409 . 0 0 "[ . 1 . 2]" 1
2259 1 82 ARG HA 1 82 ARG QD . . 4.420 3.687 3.512 3.820 . 0 0 "[ . 1 . 2]" 1
2260 1 82 ARG HA 1 84 GLU H . . 5.500 3.531 3.239 3.779 . 0 0 "[ . 1 . 2]" 1
2261 1 82 ARG HA 1 85 LEU H . . 4.250 3.014 2.830 3.200 . 0 0 "[ . 1 . 2]" 1
2262 1 82 ARG HA 1 85 LEU HB3 . . 3.840 3.390 3.074 3.856 0.016 11 0 "[ . 1 . 2]" 1
2263 1 82 ARG HA 1 85 LEU MD1 . . 3.810 3.733 3.629 3.869 0.059 6 0 "[ . 1 . 2]" 1
2264 1 82 ARG HA 1 85 LEU MD2 . . 3.700 1.978 1.818 2.267 . 0 0 "[ . 1 . 2]" 1
2265 1 82 ARG HA 1 85 LEU HG . . 4.060 2.259 2.070 2.455 . 0 0 "[ . 1 . 2]" 1
2266 1 82 ARG HA 1 86 ALA H . . 4.540 3.512 3.225 3.719 . 0 0 "[ . 1 . 2]" 1
2267 1 82 ARG HA 1 86 ALA MB . . 4.020 4.045 3.887 4.115 0.095 11 0 "[ . 1 . 2]" 1
2268 1 82 ARG HB2 1 83 LEU H . . 5.010 3.814 3.027 4.454 . 0 0 "[ . 1 . 2]" 1
2269 1 82 ARG HB2 1 85 LEU MD2 . . 3.650 3.304 2.669 3.908 0.258 5 0 "[ . 1 . 2]" 1
2270 1 82 ARG HB3 1 83 LEU H . . 4.490 4.238 4.121 4.353 . 0 0 "[ . 1 . 2]" 1
2271 1 82 ARG HB3 1 85 LEU MD2 . . 5.500 2.825 2.509 3.409 . 0 0 "[ . 1 . 2]" 1
2272 1 82 ARG QD 1 83 LEU H . . 4.970 3.315 3.044 3.473 . 0 0 "[ . 1 . 2]" 1
2273 1 82 ARG QD 1 83 LEU HB2 . . 4.950 4.640 4.423 4.916 . 0 0 "[ . 1 . 2]" 1
2274 1 82 ARG QD 1 85 LEU MD2 . . 4.970 4.352 3.829 4.953 . 0 0 "[ . 1 . 2]" 1
2275 1 82 ARG QD 2 5 MET ME . . 4.000 4.179 4.134 4.239 0.239 15 0 "[ . 1 . 2]" 1
2276 1 83 LEU H 1 83 LEU HB2 . . 3.770 2.646 2.450 2.829 . 0 0 "[ . 1 . 2]" 1
2277 1 83 LEU H 1 83 LEU HB3 . . 3.600 2.259 2.178 2.337 . 0 0 "[ . 1 . 2]" 1
2278 1 83 LEU H 1 83 LEU MD1 . . 4.440 4.196 4.073 4.293 . 0 0 "[ . 1 . 2]" 1
2279 1 83 LEU H 1 83 LEU MD2 . . 4.320 4.111 4.060 4.170 . 0 0 "[ . 1 . 2]" 1
2280 1 83 LEU H 1 84 GLU H . . 3.920 2.458 2.282 2.572 . 0 0 "[ . 1 . 2]" 1
2281 1 83 LEU H 1 84 GLU QB . . 4.380 4.366 4.171 4.445 0.065 16 0 "[ . 1 . 2]" 1
2282 1 83 LEU H 1 85 LEU H . . 5.500 4.028 3.877 4.258 . 0 0 "[ . 1 . 2]" 1
2283 1 83 LEU HA 1 83 LEU MD1 . . 2.820 2.184 2.002 2.342 . 0 0 "[ . 1 . 2]" 1
2284 1 83 LEU HA 1 83 LEU HG . . 3.450 3.335 3.211 3.457 0.007 13 0 "[ . 1 . 2]" 1
2285 1 83 LEU HA 1 87 GLN HE22 . . 5.470 5.116 4.566 5.342 . 0 0 "[ . 1 . 2]" 1
2286 1 83 LEU HB2 1 83 LEU HG . . 2.950 3.052 3.043 3.059 0.109 12 0 "[ . 1 . 2]" 1
2287 1 83 LEU HB2 1 84 GLU H . . 4.620 4.116 4.025 4.208 . 0 0 "[ . 1 . 2]" 1
2288 1 83 LEU HB3 1 83 LEU MD1 . . 3.440 3.237 3.223 3.255 . 0 0 "[ . 1 . 2]" 1
2289 1 83 LEU HB3 1 83 LEU MD2 . . 3.350 2.265 2.220 2.319 . 0 0 "[ . 1 . 2]" 1
2290 1 83 LEU HB3 1 84 GLU H . . 3.980 2.986 2.699 3.457 . 0 0 "[ . 1 . 2]" 1
2291 1 83 LEU MD1 1 84 GLU H . . 4.860 4.409 4.194 4.578 . 0 0 "[ . 1 . 2]" 1
2292 1 83 LEU MD1 1 86 ALA MB . . 3.870 3.879 3.723 3.944 0.074 8 0 "[ . 1 . 2]" 1
2293 1 83 LEU MD1 1 87 GLN H . . 4.510 4.157 4.042 4.205 . 0 0 "[ . 1 . 2]" 1
2294 1 83 LEU MD1 1 87 GLN HE21 . . 3.550 2.094 1.991 2.246 . 0 0 "[ . 1 . 2]" 1
2295 1 83 LEU MD1 1 87 GLN HE22 . . 3.700 2.580 2.419 2.730 . 0 0 "[ . 1 . 2]" 1
2296 1 83 LEU MD1 1 87 GLN HG2 . . 4.020 3.470 3.309 3.589 . 0 0 "[ . 1 . 2]" 1
2297 1 83 LEU MD1 1 87 GLN HG3 . . 4.730 4.821 4.741 4.894 0.164 17 0 "[ . 1 . 2]" 1
2298 1 83 LEU MD2 1 87 GLN HE21 . . 4.420 4.028 3.745 4.458 0.038 7 0 "[ . 1 . 2]" 1
2299 1 83 LEU MD2 1 87 GLN HE22 . . 4.170 3.833 3.385 4.205 0.035 8 0 "[ . 1 . 2]" 1
2300 1 83 LEU HG 1 84 GLU H . . 5.220 3.866 3.318 4.580 . 0 0 "[ . 1 . 2]" 1
2301 1 83 LEU HG 1 87 GLN HE21 . . 4.970 2.733 2.324 3.514 . 0 0 "[ . 1 . 2]" 1
2302 1 83 LEU HG 1 87 GLN HE22 . . 4.610 3.104 2.786 3.417 . 0 0 "[ . 1 . 2]" 1
2303 1 84 GLU H 1 84 GLU QB . . 3.210 2.404 2.191 2.816 . 0 0 "[ . 1 . 2]" 1
2304 1 84 GLU H 1 84 GLU HG2 . . 3.550 2.794 2.496 3.741 0.191 7 0 "[ . 1 . 2]" 1
2305 1 84 GLU H 1 84 GLU HG3 . . 3.600 3.440 2.488 3.755 0.155 11 0 "[ . 1 . 2]" 1
2306 1 84 GLU H 1 85 LEU H . . 4.050 2.303 1.952 2.412 . 0 0 "[ . 1 . 2]" 1
2307 1 84 GLU H 1 85 LEU HA . . 5.170 4.942 4.659 5.059 . 0 0 "[ . 1 . 2]" 1
2308 1 84 GLU H 1 85 LEU HB3 . . 4.340 4.247 3.907 4.420 0.080 20 0 "[ . 1 . 2]" 1
2309 1 84 GLU H 1 85 LEU MD2 . . 4.440 4.397 4.183 4.509 0.069 1 0 "[ . 1 . 2]" 1
2310 1 84 GLU H 1 86 ALA H . . 5.500 3.983 3.710 4.167 . 0 0 "[ . 1 . 2]" 1
2311 1 84 GLU H 1 86 ALA MB . . 5.190 4.637 4.476 4.820 . 0 0 "[ . 1 . 2]" 1
2312 1 84 GLU H 1 87 GLN H . . 5.500 5.245 5.006 5.517 0.017 6 0 "[ . 1 . 2]" 1
2313 1 84 GLU HA 1 84 GLU HG2 . . 4.210 3.209 2.240 3.874 . 0 0 "[ . 1 . 2]" 1
2314 1 84 GLU HA 1 84 GLU HG3 . . 3.440 3.475 3.036 3.625 0.185 20 0 "[ . 1 . 2]" 1
2315 1 84 GLU QB 1 85 LEU H . . 3.730 3.339 2.512 3.862 0.132 8 0 "[ . 1 . 2]" 1
2316 1 84 GLU QB 1 85 LEU HA . . 4.680 4.359 3.785 4.779 0.099 5 0 "[ . 1 . 2]" 1
2317 1 84 GLU HG2 1 85 LEU H . . 5.080 3.962 2.761 5.078 . 0 0 "[ . 1 . 2]" 1
2318 1 84 GLU HG3 1 85 LEU H . . 4.810 4.134 3.116 4.904 0.094 18 0 "[ . 1 . 2]" 1
2319 1 85 LEU H 1 85 LEU HB2 . . 3.810 3.684 3.533 3.834 0.024 10 0 "[ . 1 . 2]" 1
2320 1 85 LEU H 1 85 LEU HB3 . . 3.370 2.531 2.225 2.826 . 0 0 "[ . 1 . 2]" 1
2321 1 85 LEU H 1 85 LEU MD1 . . 4.040 3.916 3.775 4.001 . 0 0 "[ . 1 . 2]" 1
2322 1 85 LEU H 1 85 LEU MD2 . . 3.770 3.350 3.161 3.560 . 0 0 "[ . 1 . 2]" 1
2323 1 85 LEU H 1 85 LEU HG . . 3.740 2.539 2.334 2.647 . 0 0 "[ . 1 . 2]" 1
2324 1 85 LEU H 1 86 ALA H . . 4.030 2.289 1.959 2.630 . 0 0 "[ . 1 . 2]" 1
2325 1 85 LEU H 1 86 ALA MB . . 5.130 3.786 3.504 4.115 . 0 0 "[ . 1 . 2]" 1
2326 1 85 LEU H 1 87 GLN H . . 5.100 4.273 3.811 4.685 . 0 0 "[ . 1 . 2]" 1
2327 1 85 LEU H 1 87 GLN HG3 . . 5.500 5.156 4.590 5.544 0.044 18 0 "[ . 1 . 2]" 1
2328 1 85 LEU H 1 88 GLY H . . 5.210 4.565 4.194 4.913 . 0 0 "[ . 1 . 2]" 1
2329 1 85 LEU HA 1 85 LEU MD1 . . 3.510 3.450 3.384 3.514 0.004 17 0 "[ . 1 . 2]" 1
2330 1 85 LEU HA 1 85 LEU MD2 . . 4.530 4.125 4.095 4.167 . 0 0 "[ . 1 . 2]" 1
2331 1 85 LEU HA 1 88 GLY H . . 4.600 3.525 3.345 3.645 . 0 0 "[ . 1 . 2]" 1
2332 1 85 LEU HA 1 89 ALA MB . . 5.500 4.435 4.209 4.702 . 0 0 "[ . 1 . 2]" 1
2333 1 85 LEU HB2 1 85 LEU MD1 . . 3.130 2.216 2.183 2.241 . 0 0 "[ . 1 . 2]" 1
2334 1 85 LEU HB2 1 85 LEU MD2 . . 3.400 2.619 2.540 2.720 . 0 0 "[ . 1 . 2]" 1
2335 1 85 LEU HB2 1 86 ALA H . . 3.970 4.069 4.035 4.099 0.129 8 0 "[ . 1 . 2]" 1
2336 1 85 LEU HB3 1 85 LEU MD2 . . 3.530 2.155 2.113 2.185 . 0 0 "[ . 1 . 2]" 1
2337 1 85 LEU HB3 1 86 ALA H . . 3.700 3.788 3.748 3.827 0.127 11 0 "[ . 1 . 2]" 1
2338 1 85 LEU MD1 1 86 ALA H . . 3.780 2.954 2.859 3.047 . 0 0 "[ . 1 . 2]" 1
2339 1 85 LEU MD1 1 86 ALA HA . . 3.350 2.541 2.452 2.624 . 0 0 "[ . 1 . 2]" 1
2340 1 85 LEU MD1 1 89 ALA H . . 4.900 4.828 4.674 4.924 0.024 9 0 "[ . 1 . 2]" 1
2341 1 85 LEU MD1 1 89 ALA HA . . 5.500 5.579 5.506 5.668 0.168 16 0 "[ . 1 . 2]" 1
2342 1 85 LEU MD1 1 89 ALA MB . . 4.710 3.057 2.950 3.196 . 0 0 "[ . 1 . 2]" 1
2343 1 85 LEU MD2 1 86 ALA H . . 4.150 3.760 3.647 3.868 . 0 0 "[ . 1 . 2]" 1
2344 1 85 LEU HG 1 86 ALA H . . 4.010 2.021 1.906 2.129 . 0 0 "[ . 1 . 2]" 1
2345 1 85 LEU HG 1 86 ALA HA . . 5.320 3.664 3.483 3.818 . 0 0 "[ . 1 . 2]" 1
2346 1 85 LEU HG 1 89 ALA MB . . 5.500 5.108 4.891 5.342 . 0 0 "[ . 1 . 2]" 1
2347 1 86 ALA H 1 86 ALA MB . . 3.130 2.083 2.053 2.102 . 0 0 "[ . 1 . 2]" 1
2348 1 86 ALA H 1 87 GLN H . . 3.910 2.966 2.862 3.086 . 0 0 "[ . 1 . 2]" 1
2349 1 86 ALA H 1 87 GLN HG2 . . 5.500 4.028 3.850 4.293 . 0 0 "[ . 1 . 2]" 1
2350 1 86 ALA H 1 88 GLY H . . 4.870 3.827 3.786 3.915 . 0 0 "[ . 1 . 2]" 1
2351 1 86 ALA H 1 89 ALA H . . 5.250 5.210 5.141 5.253 0.003 12 0 "[ . 1 . 2]" 1
2352 1 86 ALA H 1 89 ALA MB . . 4.870 4.669 4.508 4.872 0.002 3 0 "[ . 1 . 2]" 1
2353 1 86 ALA HA 1 88 GLY H . . 4.680 4.052 3.977 4.167 . 0 0 "[ . 1 . 2]" 1
2354 1 86 ALA HA 1 89 ALA H . . 3.870 3.895 3.879 3.916 0.046 10 0 "[ . 1 . 2]" 1
2355 1 86 ALA HA 1 89 ALA MB . . 3.720 2.798 2.619 3.003 . 0 0 "[ . 1 . 2]" 1
2356 1 86 ALA MB 1 87 GLN H . . 3.600 2.116 2.061 2.164 . 0 0 "[ . 1 . 2]" 1
2357 1 86 ALA MB 1 87 GLN HB3 . . 3.910 3.936 3.916 3.951 0.041 14 0 "[ . 1 . 2]" 1
2358 1 86 ALA MB 1 87 GLN HG2 . . 5.500 3.452 3.319 3.593 . 0 0 "[ . 1 . 2]" 1
2359 1 86 ALA MB 1 88 GLY H . . 5.100 4.035 3.994 4.080 . 0 0 "[ . 1 . 2]" 1
2360 1 86 ALA MB 1 89 ALA H . . 4.580 4.589 4.562 4.608 0.028 13 0 "[ . 1 . 2]" 1
2361 1 86 ALA MB 1 89 ALA MB . . 4.660 4.116 3.980 4.269 . 0 0 "[ . 1 . 2]" 1
2362 1 86 ALA MB 1 90 VAL H . . 5.500 4.920 4.540 5.341 . 0 0 "[ . 1 . 2]" 1
2363 1 86 ALA MB 1 90 VAL MG1 . . 5.050 4.605 4.563 4.702 . 0 0 "[ . 1 . 2]" 1
2364 1 87 GLN H 1 87 GLN HB2 . . 3.550 3.585 3.561 3.608 0.058 5 0 "[ . 1 . 2]" 1
2365 1 87 GLN H 1 87 GLN HB3 . . 3.470 2.663 2.633 2.692 . 0 0 "[ . 1 . 2]" 1
2366 1 87 GLN H 1 87 GLN HE21 . . 5.300 3.703 3.559 3.878 . 0 0 "[ . 1 . 2]" 1
2367 1 87 GLN H 1 87 GLN HE22 . . 5.500 5.182 5.083 5.302 . 0 0 "[ . 1 . 2]" 1
2368 1 87 GLN H 1 87 GLN HG2 . . 3.740 1.867 1.785 2.026 . 0 0 "[ . 1 . 2]" 1
2369 1 87 GLN H 1 87 GLN HG3 . . 3.780 2.980 2.730 3.187 . 0 0 "[ . 1 . 2]" 1
2370 1 87 GLN H 1 88 GLY H . . 3.810 2.712 2.687 2.725 . 0 0 "[ . 1 . 2]" 1
2371 1 87 GLN H 1 88 GLY HA2 . . 5.400 5.353 5.319 5.372 . 0 0 "[ . 1 . 2]" 1
2372 1 87 GLN H 1 88 GLY HA3 . . 5.000 5.002 4.960 5.027 0.027 8 0 "[ . 1 . 2]" 1
2373 1 87 GLN H 1 89 ALA H . . 4.540 4.164 4.111 4.202 . 0 0 "[ . 1 . 2]" 1
2374 1 87 GLN H 1 89 ALA MB . . 5.500 4.944 4.811 5.096 . 0 0 "[ . 1 . 2]" 1
2375 1 87 GLN H 1 90 VAL H . . 5.500 4.865 4.721 5.053 . 0 0 "[ . 1 . 2]" 1
2376 1 87 GLN HA 1 90 VAL H . . 4.030 3.167 3.010 3.273 . 0 0 "[ . 1 . 2]" 1
2377 1 87 GLN HA 1 90 VAL MG2 . . 3.310 2.220 1.755 2.790 . 0 0 "[ . 1 . 2]" 1
2378 1 87 GLN HB2 1 88 GLY H . . 4.210 3.969 3.933 3.991 . 0 0 "[ . 1 . 2]" 1
2379 1 87 GLN HB2 1 88 GLY HA2 . . 5.110 4.557 4.524 4.586 . 0 0 "[ . 1 . 2]" 1
2380 1 87 GLN HB2 1 88 GLY HA3 . . 5.200 5.302 5.235 5.368 0.168 5 0 "[ . 1 . 2]" 1
2381 1 87 GLN HB2 1 89 ALA H . . 4.980 4.946 4.794 5.035 0.055 8 0 "[ . 1 . 2]" 1
2382 1 87 GLN HB2 1 90 VAL MG2 . . 4.640 4.173 3.651 4.804 0.164 18 0 "[ . 1 . 2]" 1
2383 1 87 GLN HB3 1 87 GLN HE21 . . 4.460 3.180 2.461 3.593 . 0 0 "[ . 1 . 2]" 1
2384 1 87 GLN HB3 1 87 GLN HE22 . . 4.680 4.016 3.740 4.171 . 0 0 "[ . 1 . 2]" 1
2385 1 87 GLN HB3 1 88 GLY H . . 4.210 4.273 4.250 4.307 0.097 15 0 "[ . 1 . 2]" 1
2386 1 87 GLN HB3 1 89 ALA H . . 5.500 5.343 5.258 5.387 . 0 0 "[ . 1 . 2]" 1
2387 1 87 GLN HB3 1 90 VAL H . . 5.330 5.408 5.245 5.493 0.163 2 0 "[ . 1 . 2]" 1
2388 1 87 GLN HB3 1 90 VAL MG2 . . 5.120 3.891 3.462 4.404 . 0 0 "[ . 1 . 2]" 1
2389 1 87 GLN HG2 1 88 GLY H . . 5.040 3.224 3.132 3.417 . 0 0 "[ . 1 . 2]" 1
2390 1 87 GLN HG3 1 88 GLY H . . 4.490 2.717 2.611 2.894 . 0 0 "[ . 1 . 2]" 1
2391 1 87 GLN HG3 1 90 VAL H . . 5.500 5.662 5.523 5.779 0.279 15 0 "[ . 1 . 2]" 1
2392 1 88 GLY H 1 89 ALA H . . 3.500 2.506 2.464 2.546 . 0 0 "[ . 1 . 2]" 1
2393 1 88 GLY H 1 89 ALA HA . . 5.290 5.068 4.979 5.162 . 0 0 "[ . 1 . 2]" 1
2394 1 88 GLY H 1 89 ALA MB . . 4.400 3.850 3.673 4.032 . 0 0 "[ . 1 . 2]" 1
2395 1 88 GLY H 1 90 VAL H . . 3.880 3.911 3.881 3.950 0.070 6 0 "[ . 1 . 2]" 1
2396 1 88 GLY H 1 90 VAL MG2 . . 5.210 4.144 3.766 4.594 . 0 0 "[ . 1 . 2]" 1
2397 1 88 GLY HA2 1 89 ALA MB . . 5.390 4.684 4.623 4.749 . 0 0 "[ . 1 . 2]" 1
2398 1 88 GLY HA3 1 89 ALA HA . . 4.940 4.695 4.676 4.713 . 0 0 "[ . 1 . 2]" 1
2399 1 88 GLY HA3 1 89 ALA MB . . 5.220 4.202 4.120 4.287 . 0 0 "[ . 1 . 2]" 1
2400 1 89 ALA H 1 89 ALA MB . . 2.630 2.480 2.457 2.496 . 0 0 "[ . 1 . 2]" 1
2401 1 89 ALA H 1 90 VAL HB . . 4.710 3.929 3.430 4.381 . 0 0 "[ . 1 . 2]" 1
2402 1 89 ALA H 1 90 VAL MG2 . . 4.650 2.871 2.652 3.107 . 0 0 "[ . 1 . 2]" 1
2403 1 89 ALA HA 1 90 VAL MG2 . . 5.180 4.633 4.387 4.819 . 0 0 "[ . 1 . 2]" 1
2404 1 89 ALA MB 1 90 VAL H . . 3.730 3.082 2.842 3.382 . 0 0 "[ . 1 . 2]" 1
2405 1 89 ALA MB 1 90 VAL HA . . 4.310 3.900 3.617 4.282 . 0 0 "[ . 1 . 2]" 1
2406 1 89 ALA MB 1 90 VAL HB . . 4.780 4.840 4.536 5.079 0.299 10 0 "[ . 1 . 2]" 1
2407 1 89 ALA MB 1 92 SER H . . 5.500 4.776 4.061 5.581 0.081 19 0 "[ . 1 . 2]" 1
2408 1 89 ALA MB 1 92 SER QB . . 5.140 4.477 3.256 5.147 0.007 13 0 "[ . 1 . 2]" 1
2409 1 90 VAL H 1 90 VAL HB . . 2.990 2.526 2.208 2.770 . 0 0 "[ . 1 . 2]" 1
2410 1 90 VAL H 1 90 VAL MG2 . . 3.060 2.111 1.645 2.649 . 0 0 "[ . 1 . 2]" 1
2411 1 90 VAL HA 1 90 VAL HB . . 2.810 2.942 2.901 2.992 0.182 3 0 "[ . 1 . 2]" 1
2412 1 90 VAL HA 1 90 VAL MG1 . . 3.160 2.368 2.189 2.580 . 0 0 "[ . 1 . 2]" 1
2413 1 90 VAL HA 1 90 VAL MG2 . . 3.120 2.401 2.063 2.700 . 0 0 "[ . 1 . 2]" 1
2414 1 90 VAL HA 1 91 GLY H . . 3.380 3.190 2.244 3.514 0.134 2 0 "[ . 1 . 2]" 1
2415 1 90 VAL HB 1 91 GLY H . . 3.950 2.583 2.030 3.954 0.004 5 0 "[ . 1 . 2]" 1
2416 1 90 VAL HB 1 91 GLY QA . . 5.080 3.746 3.386 4.584 . 0 0 "[ . 1 . 2]" 1
2417 1 90 VAL HB 1 92 SER H . . 5.500 4.551 4.093 5.190 . 0 0 "[ . 1 . 2]" 1
2418 1 90 VAL MG1 1 91 GLY H . . 3.330 3.128 2.105 3.485 0.155 2 0 "[ . 1 . 2]" 1
2419 1 90 VAL MG2 1 91 GLY H . . 4.200 3.356 3.220 3.667 . 0 0 "[ . 1 . 2]" 1
2420 1 90 VAL MG2 1 91 GLY QA . . 4.460 4.601 4.526 4.690 0.230 14 0 "[ . 1 . 2]" 1
2421 1 91 GLY QA 1 92 SER H . . 3.500 2.931 2.870 2.994 . 0 0 "[ . 1 . 2]" 1
2422 1 92 SER H 1 92 SER QB . . 3.090 2.536 2.213 2.859 . 0 0 "[ . 1 . 2]" 1
2423 1 92 SER HA 1 92 SER QB . . 2.570 2.297 2.155 2.400 . 0 0 "[ . 1 . 2]" 1
2424 1 92 SER HA 1 93 VAL H . . 2.920 2.580 2.154 3.038 0.118 5 0 "[ . 1 . 2]" 1
2425 1 92 SER HA 1 93 VAL HA . . 4.490 4.438 4.280 4.553 0.063 13 0 "[ . 1 . 2]" 1
2426 1 92 SER HA 1 93 VAL MG2 . . 4.360 4.122 3.304 4.377 0.017 13 0 "[ . 1 . 2]" 1
2427 1 92 SER HA 1 94 GLN H . . 5.020 4.904 4.105 5.148 0.128 1 0 "[ . 1 . 2]" 1
2428 1 92 SER QB 1 93 VAL H . . 3.650 2.747 2.028 3.712 0.062 2 0 "[ . 1 . 2]" 1
2429 1 92 SER QB 1 93 VAL MG2 . . 3.990 3.124 2.505 4.040 0.050 18 0 "[ . 1 . 2]" 1
2430 1 92 SER QB 1 94 GLN HE21 . . 5.500 4.672 3.578 5.530 0.030 3 0 "[ . 1 . 2]" 1
2431 1 93 VAL H 1 93 VAL HB . . 3.480 3.155 2.375 3.551 0.071 15 0 "[ . 1 . 2]" 1
2432 1 93 VAL H 1 93 VAL MG2 . . 3.030 2.585 2.136 3.031 0.001 1 0 "[ . 1 . 2]" 1
2433 1 93 VAL H 1 94 GLN H . . 3.860 3.575 2.364 3.977 0.117 14 0 "[ . 1 . 2]" 1
2434 1 93 VAL H 1 94 GLN HA . . 5.330 5.118 4.447 5.508 0.178 20 0 "[ . 1 . 2]" 1
2435 1 93 VAL H 1 94 GLN QG . . 5.500 4.305 3.825 5.244 . 0 0 "[ . 1 . 2]" 1
2436 1 93 VAL HA 1 93 VAL MG1 . . 2.940 2.328 2.275 2.466 . 0 0 "[ . 1 . 2]" 1
2437 1 93 VAL HA 1 93 VAL MG2 . . 3.640 2.336 2.245 2.390 . 0 0 "[ . 1 . 2]" 1
2438 1 93 VAL HA 1 94 GLN H . . 2.900 2.214 2.041 3.260 0.360 3 0 "[ . 1 . 2]" 1
2439 1 93 VAL HA 1 94 GLN HA . . 4.510 4.445 4.349 5.058 0.548 3 1 "[ + . 1 . 2]" 1
2440 1 93 VAL HA 1 94 GLN QG . . 4.610 3.986 3.682 4.635 0.025 7 0 "[ . 1 . 2]" 1
2441 1 93 VAL HA 1 96 PRO HD3 . . 4.540 4.258 3.646 4.607 0.067 13 0 "[ . 1 . 2]" 1
2442 1 93 VAL MG1 1 94 GLN H . . 3.840 3.355 3.137 3.695 . 0 0 "[ . 1 . 2]" 1
2443 1 93 VAL MG1 1 94 GLN HA . . 4.160 4.039 3.593 4.166 0.006 18 0 "[ . 1 . 2]" 1
2444 1 93 VAL MG1 1 94 GLN HB3 . . 5.320 5.366 5.014 5.526 0.206 20 0 "[ . 1 . 2]" 1
2445 1 93 VAL MG1 1 96 PRO HA . . 3.840 3.249 2.414 3.865 0.025 16 0 "[ . 1 . 2]" 1
2446 1 93 VAL MG1 1 96 PRO HD2 . . 3.990 3.793 3.594 4.006 0.016 10 0 "[ . 1 . 2]" 1
2447 1 93 VAL MG1 1 96 PRO HD3 . . 3.720 2.341 2.068 2.613 . 0 0 "[ . 1 . 2]" 1
2448 1 93 VAL MG1 1 96 PRO HG3 . . 5.030 3.284 2.465 3.951 . 0 0 "[ . 1 . 2]" 1
2449 1 93 VAL MG2 1 94 GLN H . . 4.400 4.143 3.901 4.269 . 0 0 "[ . 1 . 2]" 1
2450 1 93 VAL MG2 1 94 GLN HE21 . . 5.190 5.236 5.195 5.317 0.127 14 0 "[ . 1 . 2]" 1
2451 1 94 GLN H 1 94 GLN HB2 . . 3.900 3.003 2.183 3.888 . 0 0 "[ . 1 . 2]" 1
2452 1 94 GLN H 1 94 GLN HB3 . . 3.350 3.338 2.771 3.649 0.299 20 0 "[ . 1 . 2]" 1
2453 1 94 GLN H 1 94 GLN QG . . 4.190 2.385 1.839 3.190 . 0 0 "[ . 1 . 2]" 1
2454 1 94 GLN H 1 96 PRO HD2 . . 5.500 5.016 4.102 5.554 0.054 17 0 "[ . 1 . 2]" 1
2455 1 94 GLN HA 1 94 GLN QG . . 3.510 3.024 2.370 3.493 . 0 0 "[ . 1 . 2]" 1
2456 1 94 GLN HB2 1 95 ILE H . . 4.420 4.017 3.486 4.464 0.044 3 0 "[ . 1 . 2]" 1
2457 1 95 ILE MG 1 96 PRO HD2 . . 4.870 4.371 4.007 4.615 . 0 0 "[ . 1 . 2]" 1
2458 1 96 PRO HA 1 97 VAL H . . 2.620 2.516 2.385 2.619 . 0 0 "[ . 1 . 2]" 1
2459 1 96 PRO HA 1 97 VAL HB . . 5.150 4.861 4.308 5.137 . 0 0 "[ . 1 . 2]" 1
2460 1 96 PRO HB2 1 97 VAL H . . 3.480 2.438 2.206 2.732 . 0 0 "[ . 1 . 2]" 1
2461 1 96 PRO HB3 1 97 VAL H . . 3.670 3.502 3.424 3.626 . 0 0 "[ . 1 . 2]" 1
2462 1 96 PRO HB3 1 98 VAL MG2 . . 5.500 5.100 4.023 5.556 0.056 15 0 "[ . 1 . 2]" 1
2463 1 96 PRO HD2 1 98 VAL H . . 5.010 4.909 4.582 5.082 0.072 8 0 "[ . 1 . 2]" 1
2464 1 96 PRO HG2 1 97 VAL H . . 4.780 4.159 3.883 4.509 . 0 0 "[ . 1 . 2]" 1
2465 1 96 PRO HG2 1 98 VAL MG2 . . 4.750 3.186 2.097 4.647 . 0 0 "[ . 1 . 2]" 1
2466 1 96 PRO HG3 1 98 VAL MG2 . . 5.500 4.081 3.246 4.828 . 0 0 "[ . 1 . 2]" 1
2467 1 97 VAL H 1 97 VAL HB . . 3.170 2.652 2.519 3.105 . 0 0 "[ . 1 . 2]" 1
2468 1 97 VAL HA 1 97 VAL HB . . 2.900 2.885 2.426 3.034 0.134 15 0 "[ . 1 . 2]" 1
2469 1 97 VAL HA 1 98 VAL H . . 2.400 2.447 2.262 2.644 0.244 18 0 "[ . 1 . 2]" 1
2470 1 97 VAL HA 1 99 GLU H . . 4.810 3.969 3.203 4.860 0.050 8 0 "[ . 1 . 2]" 1
2471 1 97 VAL MG1 1 99 GLU HB2 . . 4.880 3.620 2.227 4.950 0.070 7 0 "[ . 1 . 2]" 1
2472 1 97 VAL MG1 1 99 GLU HB3 . . 3.730 3.363 2.802 3.806 0.076 12 0 "[ . 1 . 2]" 1
2473 1 98 VAL H 1 98 VAL HB . . 2.700 2.384 2.124 2.712 0.012 1 0 "[ . 1 . 2]" 1
2474 1 98 VAL H 1 98 VAL MG2 . . 3.370 3.159 2.058 3.629 0.259 16 0 "[ . 1 . 2]" 1
2475 1 98 VAL H 1 99 GLU H . . 4.020 3.416 3.024 4.097 0.077 19 0 "[ . 1 . 2]" 1
2476 1 98 VAL HA 1 99 GLU H . . 2.600 2.613 2.164 2.885 0.285 3 0 "[ . 1 . 2]" 1
2477 1 98 VAL HB 1 99 GLU H . . 4.810 4.460 4.390 4.538 . 0 0 "[ . 1 . 2]" 1
2478 1 98 VAL MG1 1 99 GLU H . . 3.510 3.546 3.392 3.637 0.127 18 0 "[ . 1 . 2]" 1
2479 1 98 VAL MG1 1 99 GLU HA . . 4.330 3.908 3.737 4.366 0.036 20 0 "[ . 1 . 2]" 1
2480 1 99 GLU H 1 99 GLU HB2 . . 3.930 2.875 2.362 3.938 0.008 5 0 "[ . 1 . 2]" 1
2481 1 99 GLU H 1 99 GLU HB3 . . 3.300 2.544 2.165 3.073 . 0 0 "[ . 1 . 2]" 1
2482 1 99 GLU H 1 99 GLU HG2 . . 4.070 3.883 2.467 4.425 0.355 16 0 "[ . 1 . 2]" 1
2483 1 99 GLU H 1 100 VAL H . . 4.520 4.528 4.319 4.612 0.092 17 0 "[ . 1 . 2]" 1
2484 1 99 GLU HA 1 99 GLU HB2 . . 3.020 2.411 2.309 2.474 . 0 0 "[ . 1 . 2]" 1
2485 1 99 GLU HA 1 99 GLU HG2 . . 3.610 3.404 3.185 3.722 0.112 5 0 "[ . 1 . 2]" 1
2486 1 99 GLU HA 1 100 VAL H . . 2.510 2.278 2.138 2.571 0.061 8 0 "[ . 1 . 2]" 1
2487 1 99 GLU HA 1 100 VAL HA . . 4.510 4.498 4.466 4.530 0.020 7 0 "[ . 1 . 2]" 1
2488 1 99 GLU HA 1 100 VAL HB . . 5.080 4.599 4.549 4.647 . 0 0 "[ . 1 . 2]" 1
2489 1 99 GLU HA 1 100 VAL MG2 . . 3.710 3.452 3.203 3.618 . 0 0 "[ . 1 . 2]" 1
2490 1 99 GLU HB2 1 100 VAL H . . 4.930 3.607 2.278 4.088 . 0 0 "[ . 1 . 2]" 1
2491 1 99 GLU HB3 1 99 GLU HG2 . . 2.580 2.412 2.293 2.599 0.019 2 0 "[ . 1 . 2]" 1
2492 1 99 GLU HG2 1 100 VAL H . . 4.130 3.145 2.746 3.807 . 0 0 "[ . 1 . 2]" 1
2493 1 99 GLU HG2 1 100 VAL MG2 . . 5.500 4.726 4.600 4.996 . 0 0 "[ . 1 . 2]" 1
2494 1 99 GLU HG2 1 101 ASP HB2 . . 5.290 3.702 3.302 4.293 . 0 0 "[ . 1 . 2]" 1
2495 1 99 GLU HG2 1 101 ASP HB3 . . 4.970 4.325 3.815 5.385 0.415 7 0 "[ . 1 . 2]" 1
2496 1 99 GLU HG3 1 100 VAL H . . 3.970 2.447 2.077 2.623 . 0 0 "[ . 1 . 2]" 1
2497 1 99 GLU HG3 1 100 VAL MG2 . . 4.950 4.702 4.447 4.862 . 0 0 "[ . 1 . 2]" 1
2498 1 99 GLU HG3 1 101 ASP HB2 . . 4.200 3.704 3.023 4.006 . 0 0 "[ . 1 . 2]" 1
2499 1 100 VAL H 1 100 VAL HB . . 3.100 2.772 2.670 2.822 . 0 0 "[ . 1 . 2]" 1
2500 1 100 VAL H 1 100 VAL QG . . 3.410 2.801 2.753 2.823 . 0 0 "[ . 1 . 2]" 1
2501 1 100 VAL H 1 100 VAL MG2 . . 2.830 2.868 2.815 2.892 0.062 3 0 "[ . 1 . 2]" 1
2502 1 100 VAL HA 1 100 VAL HB . . 2.950 3.035 3.030 3.041 0.091 16 0 "[ . 1 . 2]" 1
2503 1 100 VAL HA 1 100 VAL MG1 . . 2.790 2.346 2.305 2.386 . 0 0 "[ . 1 . 2]" 1
2504 1 100 VAL HA 1 100 VAL MG2 . . 3.430 2.418 2.345 2.453 . 0 0 "[ . 1 . 2]" 1
2505 1 100 VAL HA 1 101 ASP H . . 2.640 2.206 2.172 2.269 . 0 0 "[ . 1 . 2]" 1
2506 1 100 VAL HA 1 101 ASP HA . . 4.740 4.467 4.452 4.479 . 0 0 "[ . 1 . 2]" 1
2507 1 100 VAL HA 1 101 ASP HB2 . . 4.540 4.342 4.146 4.441 . 0 0 "[ . 1 . 2]" 1
2508 1 100 VAL HA 1 101 ASP HB3 . . 4.630 4.467 4.431 4.493 . 0 0 "[ . 1 . 2]" 1
2509 1 100 VAL HB 1 101 ASP H . . 4.130 4.078 3.973 4.149 0.019 20 0 "[ . 1 . 2]" 1
2510 1 100 VAL HB 1 101 ASP HA . . 5.000 4.681 4.576 4.829 . 0 0 "[ . 1 . 2]" 1
2511 1 100 VAL QG 1 101 ASP H . . 3.870 2.505 2.295 2.634 . 0 0 "[ . 1 . 2]" 1
2512 1 100 VAL MG1 1 101 ASP H . . 3.640 2.529 2.311 2.665 . 0 0 "[ . 1 . 2]" 1
2513 1 100 VAL MG1 1 101 ASP HA . . 4.450 3.526 3.438 3.635 . 0 0 "[ . 1 . 2]" 1
2514 1 100 VAL MG1 1 101 ASP HB2 . . 5.040 4.766 4.719 4.812 . 0 0 "[ . 1 . 2]" 1
2515 1 100 VAL MG1 1 101 ASP HB3 . . 4.960 4.883 4.686 4.991 0.031 20 0 "[ . 1 . 2]" 1
2516 1 100 VAL MG1 1 102 GLU H . . 2.930 2.267 1.955 2.672 . 0 0 "[ . 1 . 2]" 1
2517 1 100 VAL MG1 1 102 GLU HB3 . . 4.700 4.127 2.962 4.775 0.075 3 0 "[ . 1 . 2]" 1
2518 1 100 VAL MG2 1 101 ASP H . . 4.190 4.054 3.906 4.129 . 0 0 "[ . 1 . 2]" 1
2519 1 101 ASP H 1 101 ASP HB2 . . 3.310 3.304 3.199 3.350 0.040 17 0 "[ . 1 . 2]" 1
2520 1 101 ASP H 1 101 ASP HB3 . . 3.290 2.912 2.865 2.978 . 0 0 "[ . 1 . 2]" 1
2521 1 101 ASP H 1 102 GLU H . . 3.130 2.009 1.814 2.183 . 0 0 "[ . 1 . 2]" 1
2522 1 101 ASP H 1 102 GLU HA . . 4.900 4.302 3.708 4.599 . 0 0 "[ . 1 . 2]" 1
2523 1 101 ASP H 1 102 GLU HB3 . . 5.500 4.013 3.446 4.834 . 0 0 "[ . 1 . 2]" 1
2524 1 101 ASP HA 1 101 ASP HB2 . . 2.990 2.510 2.483 2.552 . 0 0 "[ . 1 . 2]" 1
2525 1 101 ASP HA 1 102 GLU H . . 2.800 2.912 2.870 2.977 0.177 18 0 "[ . 1 . 2]" 1
2526 1 101 ASP HB2 1 102 GLU H . . 4.680 4.520 4.468 4.618 . 0 0 "[ . 1 . 2]" 1
2527 1 101 ASP HB3 1 102 GLU H . . 4.160 4.069 3.961 4.194 0.034 20 0 "[ . 1 . 2]" 1
2528 1 102 GLU H 1 102 GLU HB2 . . 3.910 3.518 2.277 3.937 0.027 3 0 "[ . 1 . 2]" 1
2529 1 102 GLU H 1 102 GLU HB3 . . 3.130 3.000 2.341 3.266 0.136 18 0 "[ . 1 . 2]" 1
2530 1 102 GLU HA 1 102 GLU HG2 . . 3.720 3.419 2.719 3.743 0.023 12 0 "[ . 1 . 2]" 1
2531 1 102 GLU HA 1 103 LEU H . . 2.740 2.742 2.268 3.200 0.460 17 0 "[ . 1 . 2]" 1
2532 1 102 GLU HB2 1 102 GLU HG3 . . 2.470 2.376 2.244 2.503 0.033 8 0 "[ . 1 . 2]" 1
2533 1 102 GLU HB2 1 103 LEU H . . 3.680 2.723 1.768 3.990 0.310 12 0 "[ . 1 . 2]" 1
2534 1 102 GLU HB2 1 103 LEU HB2 . . 4.860 4.633 3.679 5.118 0.258 6 0 "[ . 1 . 2]" 1
2535 1 102 GLU HB3 1 102 GLU HG3 . . 2.880 2.822 2.558 3.037 0.157 11 0 "[ . 1 . 2]" 1
2536 1 102 GLU HG2 1 103 LEU HB2 . . 5.040 3.790 2.408 5.161 0.121 3 0 "[ . 1 . 2]" 1
2537 1 102 GLU HG2 1 103 LEU MD1 . . 5.500 3.671 2.207 4.866 . 0 0 "[ . 1 . 2]" 1
2538 1 102 GLU HG2 1 103 LEU HG . . 5.000 4.090 2.623 5.029 0.029 14 0 "[ . 1 . 2]" 1
2539 1 102 GLU HG3 1 103 LEU HG . . 4.990 4.362 2.719 5.096 0.106 1 0 "[ . 1 . 2]" 1
2540 1 103 LEU H 1 103 LEU HB2 . . 2.950 2.630 2.078 3.296 0.346 13 0 "[ . 1 . 2]" 1
2541 1 103 LEU H 1 103 LEU HB3 . . 3.620 3.361 1.947 3.905 0.285 14 0 "[ . 1 . 2]" 1
2542 1 103 LEU H 1 103 LEU MD1 . . 4.650 3.215 1.927 4.107 . 0 0 "[ . 1 . 2]" 1
2543 1 103 LEU H 1 103 LEU MD2 . . 4.380 3.760 2.025 4.411 0.031 8 0 "[ . 1 . 2]" 1
2544 1 103 LEU H 1 103 LEU HG . . 3.490 2.647 2.052 3.764 0.274 3 0 "[ . 1 . 2]" 1
2545 1 103 LEU H 1 104 PRO HD2 . . 4.920 4.855 4.345 4.985 0.065 12 0 "[ . 1 . 2]" 1
2546 1 103 LEU H 1 104 PRO HD3 . . 4.670 4.513 4.084 4.724 0.054 20 0 "[ . 1 . 2]" 1
2547 1 103 LEU HA 1 103 LEU MD1 . . 3.980 3.784 3.488 4.057 0.077 3 0 "[ . 1 . 2]" 1
2548 1 103 LEU HA 1 103 LEU HG . . 3.750 2.769 2.401 3.904 0.154 18 0 "[ . 1 . 2]" 1
2549 1 103 LEU HA 1 104 PRO HD2 . . 2.840 2.914 2.847 3.015 0.175 18 0 "[ . 1 . 2]" 1
2550 1 103 LEU HA 1 104 PRO HD3 . . 2.930 1.942 1.777 2.184 . 0 0 "[ . 1 . 2]" 1
2551 1 103 LEU HA 1 104 PRO QG . . 4.030 3.880 3.668 4.153 0.123 18 0 "[ . 1 . 2]" 1
2552 1 103 LEU HA 1 107 TYR QB . . 4.810 4.624 4.231 4.856 0.046 20 0 "[ . 1 . 2]" 1
2553 1 103 LEU HB2 1 103 LEU MD1 . . 2.790 2.271 2.175 2.545 . 0 0 "[ . 1 . 2]" 1
2554 1 103 LEU HB2 1 104 PRO HD2 . . 4.290 3.255 1.766 3.787 . 0 0 "[ . 1 . 2]" 1
2555 1 103 LEU HB2 1 104 PRO HD3 . . 3.890 3.780 2.295 4.163 0.273 4 0 "[ . 1 . 2]" 1
2556 1 103 LEU HB2 1 107 TYR QB . . 4.110 3.577 2.508 4.234 0.124 5 0 "[ . 1 . 2]" 1
2557 1 103 LEU HB2 1 107 TYR QD . . 4.850 4.173 2.130 4.882 0.032 11 0 "[ . 1 . 2]" 1
2558 1 103 LEU HB3 1 103 LEU MD1 . . 3.270 2.672 2.152 3.240 . 0 0 "[ . 1 . 2]" 1
2559 1 103 LEU HB3 1 103 LEU MD2 . . 2.800 2.012 1.877 2.787 . 0 0 "[ . 1 . 2]" 1
2560 1 103 LEU HB3 1 103 LEU HG . . 2.910 2.892 2.408 3.007 0.097 4 0 "[ . 1 . 2]" 1
2561 1 103 LEU HB3 1 104 PRO HD2 . . 4.090 2.135 1.851 3.364 . 0 0 "[ . 1 . 2]" 1
2562 1 103 LEU HB3 1 104 PRO HD3 . . 3.470 2.940 2.559 3.664 0.194 3 0 "[ . 1 . 2]" 1
2563 1 103 LEU HB3 1 104 PRO QG . . 5.020 4.137 3.910 5.033 0.013 13 0 "[ . 1 . 2]" 1
2564 1 103 LEU HB3 1 107 TYR QB . . 3.890 2.824 2.155 4.283 0.393 18 0 "[ . 1 . 2]" 1
2565 1 103 LEU HB3 1 107 TYR QD . . 3.910 3.252 2.422 3.925 0.015 3 0 "[ . 1 . 2]" 1
2566 1 103 LEU HB3 1 107 TYR QE . . 4.070 4.164 2.944 4.512 0.442 9 0 "[ . 1 . 2]" 1
2567 1 103 LEU MD1 1 104 PRO HD3 . . 4.560 4.410 3.452 4.623 0.063 20 0 "[ . 1 . 2]" 1
2568 1 103 LEU MD1 1 107 TYR QB . . 4.440 3.001 2.048 4.439 . 0 0 "[ . 1 . 2]" 1
2569 1 103 LEU MD1 1 107 TYR QD . . 3.520 3.277 2.133 3.610 0.090 20 0 "[ . 1 . 2]" 1
2570 1 103 LEU MD1 1 107 TYR QE . . 4.420 3.887 2.404 4.685 0.265 13 0 "[ . 1 . 2]" 1
2571 1 103 LEU MD2 1 104 PRO HB3 . . 5.090 5.269 5.033 5.697 0.607 13 2 "[ . 1 + . - 2]" 1
2572 1 103 LEU MD2 1 104 PRO HD2 . . 4.350 2.220 1.892 3.203 . 0 0 "[ . 1 . 2]" 1
2573 1 103 LEU MD2 1 104 PRO HD3 . . 3.880 2.499 1.924 4.052 0.172 3 0 "[ . 1 . 2]" 1
2574 1 103 LEU MD2 1 104 PRO QG . . 4.220 3.495 3.022 4.263 0.043 20 0 "[ . 1 . 2]" 1
2575 1 103 LEU MD2 1 107 TYR H . . 4.060 4.325 4.032 4.631 0.571 12 1 "[ . 1 + . 2]" 1
2576 1 103 LEU MD2 1 107 TYR QB . . 3.740 2.529 2.132 3.477 . 0 0 "[ . 1 . 2]" 1
2577 1 103 LEU MD2 1 107 TYR QD . . 5.160 2.661 1.799 4.349 . 0 0 "[ . 1 . 2]" 1
2578 1 104 PRO HA 1 105 GLU H . . 2.720 2.448 2.289 2.763 0.043 16 0 "[ . 1 . 2]" 1
2579 1 104 PRO HB2 1 105 GLU H . . 3.730 3.170 2.403 3.731 0.001 20 0 "[ . 1 . 2]" 1
2580 1 104 PRO HB2 1 107 TYR QB . . 5.140 2.912 1.936 4.495 . 0 0 "[ . 1 . 2]" 1
2581 1 104 PRO HB3 1 105 GLU H . . 3.720 2.897 2.123 3.730 0.010 13 0 "[ . 1 . 2]" 1
2582 1 104 PRO HB3 1 107 TYR QB . . 4.500 4.340 3.424 4.603 0.103 16 0 "[ . 1 . 2]" 1
2583 1 104 PRO HB3 1 107 TYR QD . . 4.300 4.211 4.011 4.501 0.201 3 0 "[ . 1 . 2]" 1
2584 1 104 PRO HD2 1 107 TYR QB . . 4.680 2.247 1.785 2.531 . 0 0 "[ . 1 . 2]" 1
2585 1 104 PRO HD3 1 107 TYR QB . . 4.110 3.878 3.232 4.133 0.023 20 0 "[ . 1 . 2]" 1
2586 1 104 PRO HD3 1 107 TYR QD . . 3.880 3.259 2.317 3.883 0.003 5 0 "[ . 1 . 2]" 1
2587 1 104 PRO HD3 1 107 TYR QE . . 4.570 3.983 3.599 4.849 0.279 16 0 "[ . 1 . 2]" 1
2588 1 104 PRO QG 1 105 GLU H . . 4.310 4.222 3.683 4.375 0.065 14 0 "[ . 1 . 2]" 1
2589 1 104 PRO QG 1 107 TYR H . . 5.330 4.299 2.462 5.311 . 0 0 "[ . 1 . 2]" 1
2590 1 104 PRO QG 1 107 TYR HA . . 5.290 4.100 2.614 5.367 0.077 14 0 "[ . 1 . 2]" 1
2591 1 104 PRO QG 1 107 TYR QB . . 4.240 3.243 2.005 3.764 . 0 0 "[ . 1 . 2]" 1
2592 1 104 PRO QG 1 107 TYR QD . . 3.770 2.425 2.125 3.783 0.013 5 0 "[ . 1 . 2]" 1
2593 1 105 GLU H 1 105 GLU QB . . 2.780 2.411 2.183 2.647 . 0 0 "[ . 1 . 2]" 1
2594 1 105 GLU H 1 105 GLU QG . . 4.240 2.968 1.896 4.101 . 0 0 "[ . 1 . 2]" 1
2595 1 105 GLU H 1 107 TYR H . . 5.500 4.748 3.912 5.344 . 0 0 "[ . 1 . 2]" 1
2596 1 105 GLU HA 1 105 GLU QB . . 2.790 2.300 2.182 2.448 . 0 0 "[ . 1 . 2]" 1
2597 1 105 GLU HA 1 105 GLU QG . . 3.610 2.926 2.275 3.521 . 0 0 "[ . 1 . 2]" 1
2598 1 105 GLU HA 1 106 GLY H . . 3.040 3.062 2.193 3.142 0.102 4 0 "[ . 1 . 2]" 1
2599 1 105 GLU HA 1 107 TYR H . . 4.750 4.533 4.099 4.713 . 0 0 "[ . 1 . 2]" 1
2600 1 105 GLU QB 1 106 GLY H . . 4.560 3.909 3.693 4.053 . 0 0 "[ . 1 . 2]" 1
2601 1 105 GLU QB 1 106 GLY HA3 . . 5.230 4.680 4.315 4.965 . 0 0 "[ . 1 . 2]" 1
2602 1 105 GLU QG 1 106 GLY H . . 5.240 3.888 3.268 4.681 . 0 0 "[ . 1 . 2]" 1
2603 1 105 GLU QG 1 106 GLY HA3 . . 5.260 4.157 3.547 5.291 0.031 5 0 "[ . 1 . 2]" 1
2604 1 106 GLY H 1 107 TYR H . . 4.290 2.117 1.794 3.170 . 0 0 "[ . 1 . 2]" 1
2605 1 106 GLY H 1 107 TYR HA . . 5.500 4.203 3.820 5.499 . 0 0 "[ . 1 . 2]" 1
2606 1 107 TYR H 1 107 TYR QB . . 3.070 2.001 1.857 2.529 . 0 0 "[ . 1 . 2]" 1
2607 1 107 TYR H 1 107 TYR QD . . 4.260 3.714 2.296 4.359 0.099 18 0 "[ . 1 . 2]" 1
2608 1 107 TYR H 1 108 ASP H . . 4.520 4.173 2.472 4.603 0.083 13 0 "[ . 1 . 2]" 1
2609 1 107 TYR H 1 108 ASP HA . . 5.500 5.381 4.687 5.598 0.098 15 0 "[ . 1 . 2]" 1
2610 1 107 TYR HA 1 107 TYR QB . . 2.760 2.379 2.105 2.464 . 0 0 "[ . 1 . 2]" 1
2611 1 107 TYR HA 1 107 TYR QD . . 3.180 2.886 2.412 3.445 0.265 5 0 "[ . 1 . 2]" 1
2612 1 107 TYR HA 1 107 TYR QE . . 4.990 4.745 4.535 5.421 0.431 16 0 "[ . 1 . 2]" 1
2613 1 107 TYR HA 1 108 ASP H . . 3.250 2.582 2.192 3.491 0.241 20 0 "[ . 1 . 2]" 1
2614 1 107 TYR QB 1 108 ASP H . . 3.800 3.071 2.144 3.795 . 0 0 "[ . 1 . 2]" 1
2615 1 107 TYR QD 1 108 ASP H . . 4.470 2.798 1.894 3.572 . 0 0 "[ . 1 . 2]" 1
2616 1 107 TYR QD 1 108 ASP HA . . 3.390 3.405 3.110 3.516 0.126 9 0 "[ . 1 . 2]" 1
2617 1 107 TYR QD 1 109 ARG HA . . 4.950 4.239 3.289 4.770 . 0 0 "[ . 1 . 2]" 1
2618 1 107 TYR QD 1 109 ARG QG . . 5.480 4.738 3.394 5.494 0.014 7 0 "[ . 1 . 2]" 1
2619 1 107 TYR QE 1 109 ARG HA . . 3.690 3.563 2.699 3.887 0.197 19 0 "[ . 1 . 2]" 1
2620 1 107 TYR QE 1 109 ARG QG . . 4.570 3.576 2.107 4.597 0.027 6 0 "[ . 1 . 2]" 1
2621 1 108 ASP H 1 108 ASP HB2 . . 3.480 3.127 2.506 3.393 . 0 0 "[ . 1 . 2]" 1
2622 1 108 ASP H 1 108 ASP HB3 . . 4.000 3.091 2.826 3.873 . 0 0 "[ . 1 . 2]" 1
2623 1 108 ASP HA 1 109 ARG H . . 3.280 2.481 2.193 3.152 . 0 0 "[ . 1 . 2]" 1
2624 1 108 ASP HA 1 109 ARG HB3 . . 5.370 4.619 4.005 5.221 . 0 0 "[ . 1 . 2]" 1
2625 1 108 ASP HA 1 110 SER H . . 5.440 4.198 3.498 5.511 0.071 7 0 "[ . 1 . 2]" 1
2626 1 108 ASP HB2 1 109 ARG H . . 5.420 4.120 3.628 4.592 . 0 0 "[ . 1 . 2]" 1
2627 1 108 ASP HB3 1 109 ARG H . . 5.200 3.747 2.439 4.536 . 0 0 "[ . 1 . 2]" 1
2628 1 109 ARG H 1 109 ARG HB2 . . 4.200 3.028 2.276 3.958 . 0 0 "[ . 1 . 2]" 1
2629 1 109 ARG H 1 109 ARG HB3 . . 4.070 2.970 2.548 3.711 . 0 0 "[ . 1 . 2]" 1
2630 1 109 ARG H 1 109 ARG QD . . 5.500 4.246 1.683 5.112 . 0 0 "[ . 1 . 2]" 1
2631 1 109 ARG H 1 109 ARG QG . . 4.440 3.822 2.365 4.374 . 0 0 "[ . 1 . 2]" 1
2632 1 109 ARG HA 1 109 ARG HB2 . . 2.940 2.513 2.367 2.588 . 0 0 "[ . 1 . 2]" 1
2633 1 109 ARG HA 1 109 ARG QD . . 4.070 3.803 2.084 4.164 0.094 12 0 "[ . 1 . 2]" 1
2634 1 109 ARG HA 1 109 ARG QG . . 3.480 2.595 2.250 3.517 0.037 17 0 "[ . 1 . 2]" 1
2635 1 109 ARG HB2 1 109 ARG QD . . 3.530 2.633 2.310 3.358 . 0 0 "[ . 1 . 2]" 1
2636 1 109 ARG HB2 1 110 SER H . . 5.350 4.358 4.112 4.624 . 0 0 "[ . 1 . 2]" 1
2637 1 109 ARG HB3 1 109 ARG QD . . 3.500 2.501 2.267 3.542 0.042 10 0 "[ . 1 . 2]" 1
2638 1 109 ARG HB3 1 109 ARG QG . . 2.770 2.363 2.163 2.426 . 0 0 "[ . 1 . 2]" 1
2639 1 109 ARG HB3 1 110 SER H . . 5.190 3.878 3.032 4.647 . 0 0 "[ . 1 . 2]" 1
2640 1 109 ARG QD 1 110 SER QB . . 4.890 4.631 3.014 4.930 0.040 20 0 "[ . 1 . 2]" 1
2641 1 109 ARG QG 1 110 SER H . . 5.500 4.120 3.125 4.514 . 0 0 "[ . 1 . 2]" 1
2642 1 109 ARG QG 1 110 SER HA . . 5.240 4.594 4.274 5.080 . 0 0 "[ . 1 . 2]" 1
2643 1 110 SER H 1 110 SER HB2 . . 4.060 3.467 2.386 3.941 . 0 0 "[ . 1 . 2]" 1
2644 1 110 SER HA 1 110 SER HB2 . . 2.710 2.527 2.456 2.995 0.285 10 0 "[ . 1 . 2]" 1
2645 2 1 ALA HA 2 2 ASP HB2 . . 4.620 4.407 4.090 4.672 0.052 12 0 "[ . 1 . 2]" 1
2646 2 1 ALA MB 2 2 ASP HA . . 5.340 4.093 3.867 4.877 . 0 0 "[ . 1 . 2]" 1
2647 2 1 ALA MB 2 3 THR MG . . 4.080 3.593 2.165 4.109 0.029 1 0 "[ . 1 . 2]" 1
2648 2 2 ASP HA 2 3 THR HA . . 5.200 4.570 4.429 4.870 . 0 0 "[ . 1 . 2]" 1
2649 2 2 ASP HA 2 3 THR MG . . 4.440 4.411 3.837 4.555 0.115 4 0 "[ . 1 . 2]" 1
2650 2 3 THR HA 2 3 THR MG . . 3.160 2.832 2.323 3.212 0.052 13 0 "[ . 1 . 2]" 1
2651 2 3 THR HA 2 4 GLU QB . . 4.560 4.392 4.251 4.634 0.074 12 0 "[ . 1 . 2]" 1
2652 2 3 THR HA 2 4 GLU QG . . 4.760 3.725 3.515 3.974 . 0 0 "[ . 1 . 2]" 1
2653 2 3 THR HA 2 5 MET ME . . 5.070 4.990 3.867 5.206 0.136 18 0 "[ . 1 . 2]" 1
2654 2 3 THR HB 2 4 GLU QG . . 5.090 4.745 4.271 5.102 0.012 7 0 "[ . 1 . 2]" 1
2655 2 3 THR HB 2 5 MET ME . . 4.680 4.684 3.839 4.869 0.189 18 0 "[ . 1 . 2]" 1
2656 2 3 THR MG 2 4 GLU HA . . 5.500 4.784 4.211 5.577 0.077 12 0 "[ . 1 . 2]" 1
2657 2 3 THR MG 2 4 GLU QG . . 5.500 4.648 3.995 5.087 . 0 0 "[ . 1 . 2]" 1
2658 2 3 THR MG 2 5 MET ME . . 4.490 4.216 3.690 4.643 0.153 12 0 "[ . 1 . 2]" 1
2659 2 3 THR MG 2 6 GLU HA . . 5.500 4.527 3.667 5.315 . 0 0 "[ . 1 . 2]" 1
2660 2 3 THR MG 2 6 GLU HB3 . . 3.160 3.241 3.187 3.342 0.182 2 0 "[ . 1 . 2]" 1
2661 2 4 GLU HA 2 4 GLU QG . . 3.260 3.321 3.233 3.337 0.077 18 0 "[ . 1 . 2]" 1
2662 2 4 GLU HA 2 7 GLU HA . . 5.170 5.149 4.859 5.286 0.116 14 0 "[ . 1 . 2]" 1
2663 2 4 GLU HA 2 7 GLU HB3 . . 4.070 3.349 2.246 4.124 0.054 7 0 "[ . 1 . 2]" 1
2664 2 4 GLU QG 2 5 MET ME . . 3.390 2.991 2.356 3.547 0.157 12 0 "[ . 1 . 2]" 1
2665 2 5 MET HA 2 5 MET ME . . 3.340 3.174 1.787 3.650 0.310 13 0 "[ . 1 . 2]" 1
2666 2 5 MET HA 2 5 MET HG2 . . 3.980 3.428 2.363 3.742 . 0 0 "[ . 1 . 2]" 1
2667 2 7 GLU HA 2 7 GLU HG2 . . 4.080 3.090 2.444 3.755 . 0 0 "[ . 1 . 2]" 1
2668 2 7 GLU HA 2 7 GLU HG3 . . 3.840 3.100 2.305 3.761 . 0 0 "[ . 1 . 2]" 1
2669 2 7 GLU HA 2 8 VAL HA . . 5.300 4.462 4.149 4.876 . 0 0 "[ . 1 . 2]" 1
2670 2 7 GLU HA 2 8 VAL MG1 . . 4.050 3.139 2.865 3.382 . 0 0 "[ . 1 . 2]" 1
2671 2 8 VAL HA 2 8 VAL MG2 . . 3.650 3.218 3.175 3.255 . 0 0 "[ . 1 . 2]" 1
2672 2 8 VAL HA 2 9 ASP HA . . 4.550 4.493 4.399 4.601 0.051 19 0 "[ . 1 . 2]" 1
2673 2 8 VAL HB 2 9 ASP HA . . 4.420 4.511 4.285 4.724 0.304 12 0 "[ . 1 . 2]" 1
2674 2 8 VAL MG1 2 9 ASP HA . . 5.310 5.520 5.436 5.597 0.287 16 0 "[ . 1 . 2]" 1
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