NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
426463 |
2h7b   |
7147 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2h7b
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 1509
_Distance_constraint_stats_list.Viol_count 2646
_Distance_constraint_stats_list.Viol_total 4028.218
_Distance_constraint_stats_list.Viol_max 0.502
_Distance_constraint_stats_list.Viol_rms 0.0293
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0067
_Distance_constraint_stats_list.Viol_average_violations_only 0.0761
_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 ALA 1.454 0.095 11 0 "[ . 1 . 2]"
1 4 ARG 1.967 0.115 20 0 "[ . 1 . 2]"
1 5 GLN 1.612 0.207 17 0 "[ . 1 . 2]"
1 6 LEU 1.181 0.169 18 0 "[ . 1 . 2]"
1 7 SER 8.663 0.227 11 0 "[ . 1 . 2]"
1 8 LYS 1.483 0.120 2 0 "[ . 1 . 2]"
1 9 LEU 2.701 0.169 18 0 "[ . 1 . 2]"
1 10 LYS 2.638 0.128 8 0 "[ . 1 . 2]"
1 11 ARG 4.011 0.206 18 0 "[ . 1 . 2]"
1 12 PHE 5.553 0.301 13 0 "[ . 1 . 2]"
1 13 LEU 4.281 0.301 13 0 "[ . 1 . 2]"
1 14 THR 0.396 0.105 4 0 "[ . 1 . 2]"
1 15 THR 5.405 0.231 11 0 "[ . 1 . 2]"
1 16 LEU 5.663 0.215 20 0 "[ . 1 . 2]"
1 17 GLN 2.645 0.226 4 0 "[ . 1 . 2]"
1 18 GLN 8.394 0.231 11 0 "[ . 1 . 2]"
1 19 PHE 3.540 0.235 16 0 "[ . 1 . 2]"
1 20 GLY 0.055 0.036 8 0 "[ . 1 . 2]"
1 21 ASN 2.180 0.151 20 0 "[ . 1 . 2]"
1 22 ASP 3.445 0.235 16 0 "[ . 1 . 2]"
1 23 ILE 3.652 0.286 18 0 "[ . 1 . 2]"
1 24 SER 2.681 0.158 1 0 "[ . 1 . 2]"
1 25 PRO 4.114 0.205 8 0 "[ . 1 . 2]"
1 26 GLU 0.774 0.098 7 0 "[ . 1 . 2]"
1 27 ILE 18.951 0.286 18 0 "[ . 1 . 2]"
1 28 GLY 5.838 0.245 1 0 "[ . 1 . 2]"
1 29 GLU 3.024 0.185 6 0 "[ . 1 . 2]"
1 30 ARG 10.704 0.254 4 0 "[ . 1 . 2]"
1 31 VAL 10.536 0.245 1 0 "[ . 1 . 2]"
1 32 ARG 3.538 0.181 16 0 "[ . 1 . 2]"
1 33 THR 3.043 0.138 8 0 "[ . 1 . 2]"
1 34 LEU 10.028 0.229 12 0 "[ . 1 . 2]"
1 35 VAL 6.557 0.215 20 0 "[ . 1 . 2]"
1 36 LEU 5.679 0.226 4 0 "[ . 1 . 2]"
1 37 GLY 11.418 0.231 8 0 "[ . 1 . 2]"
1 38 LEU 7.410 0.222 6 0 "[ . 1 . 2]"
1 39 VAL 5.555 0.207 14 0 "[ . 1 . 2]"
1 40 ASN 1.184 0.079 2 0 "[ . 1 . 2]"
1 41 SER 0.036 0.036 20 0 "[ . 1 . 2]"
1 42 THR 8.556 0.330 20 0 "[ . 1 . 2]"
1 43 LEU 21.875 0.345 11 0 "[ . 1 . 2]"
1 44 THR 1.034 0.072 14 0 "[ . 1 . 2]"
1 45 ILE 15.891 0.433 14 0 "[ . 1 . 2]"
1 46 GLU 0.280 0.089 19 0 "[ . 1 . 2]"
1 47 GLU 8.838 0.322 19 0 "[ . 1 . 2]"
1 48 PHE 7.138 0.345 11 0 "[ . 1 . 2]"
1 49 HIS 3.505 0.309 20 0 "[ . 1 . 2]"
1 50 SER 4.361 0.214 4 0 "[ . 1 . 2]"
1 51 LYS 2.585 0.153 18 0 "[ . 1 . 2]"
1 52 LEU 2.984 0.145 12 0 "[ . 1 . 2]"
1 53 GLN 0.335 0.156 14 0 "[ . 1 . 2]"
1 54 GLU 2.319 0.214 4 0 "[ . 1 . 2]"
1 55 ALA 2.335 0.362 9 0 "[ . 1 . 2]"
1 56 THR 6.913 0.437 16 0 "[ . 1 . 2]"
1 57 ASN 1.557 0.362 9 0 "[ . 1 . 2]"
1 60 LEU 2.437 0.220 16 0 "[ . 1 . 2]"
1 61 ARG 6.653 0.437 16 0 "[ . 1 . 2]"
1 62 PRO 1.716 0.174 12 0 "[ . 1 . 2]"
1 63 PHE 0.768 0.268 16 0 "[ . 1 . 2]"
1 64 VAL 7.769 0.502 6 1 "[ .+ 1 . 2]"
1 65 ILE 10.532 0.502 6 1 "[ .+ 1 . 2]"
1 66 PRO 0.768 0.268 16 0 "[ . 1 . 2]"
1 67 PHE 0.124 0.044 3 0 "[ . 1 . 2]"
1 68 LEU 1.366 0.157 14 0 "[ . 1 . 2]"
1 69 LYS 8.278 0.337 8 0 "[ . 1 . 2]"
1 70 ALA 6.729 0.301 15 0 "[ . 1 . 2]"
1 71 ASN 0.093 0.044 3 0 "[ . 1 . 2]"
1 72 LEU 3.653 0.236 9 0 "[ . 1 . 2]"
1 73 PRO 4.793 0.279 17 0 "[ . 1 . 2]"
1 74 LEU 8.953 0.279 17 0 "[ . 1 . 2]"
1 75 LEU 4.771 0.226 16 0 "[ . 1 . 2]"
1 76 GLN 5.218 0.236 9 0 "[ . 1 . 2]"
1 77 ARG 6.968 0.436 19 0 "[ . 1 . 2]"
1 78 GLU 2.589 0.147 17 0 "[ . 1 . 2]"
1 79 LEU 1.747 0.110 20 0 "[ . 1 . 2]"
1 80 LEU 1.753 0.168 7 0 "[ . 1 . 2]"
1 81 HIS 3.220 0.147 17 0 "[ . 1 . 2]"
1 82 ALA 1.361 0.119 8 0 "[ . 1 . 2]"
1 83 ALA 6.604 0.213 17 0 "[ . 1 . 2]"
1 84 ARG 1.141 0.139 8 0 "[ . 1 . 2]"
1 85 LEU 0.707 0.260 18 0 "[ . 1 . 2]"
1 86 ALA 4.150 0.260 18 0 "[ . 1 . 2]"
1 87 LYS 4.438 0.356 1 0 "[ . 1 . 2]"
1 88 GLN 3.401 0.213 17 0 "[ . 1 . 2]"
1 89 ASN 0.376 0.135 17 0 "[ . 1 . 2]"
1 90 PRO 2.048 0.161 11 0 "[ . 1 . 2]"
1 91 ALA 0.549 0.169 10 0 "[ . 1 . 2]"
1 92 GLN 0.485 0.169 10 0 "[ . 1 . 2]"
1 93 TYR 1.150 0.087 10 0 "[ . 1 . 2]"
1 94 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 ALA 0.165 0.027 12 0 "[ . 1 . 2]"
1 96 GLN 0.026 0.016 19 0 "[ . 1 . 2]"
1 97 HIS 0.086 0.061 12 0 "[ . 1 . 2]"
1 98 GLU 0.172 0.033 12 0 "[ . 1 . 2]"
1 99 GLN 0.009 0.005 13 0 "[ . 1 . 2]"
1 100 LEU 0.399 0.202 15 0 "[ . 1 . 2]"
1 101 LEU 0.176 0.041 14 0 "[ . 1 . 2]"
1 102 LEU 0.240 0.104 12 0 "[ . 1 . 2]"
1 103 ASP 0.314 0.202 15 0 "[ . 1 . 2]"
1 104 ALA 0.143 0.104 12 0 "[ . 1 . 2]"
1 105 SER 0.023 0.023 17 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 ALA H 1 3 ALA MB . . 3.670 2.173 2.110 2.295 . 0 0 "[ . 1 . 2]" 1
2 1 3 ALA H 1 4 ARG HA . . 5.500 5.139 4.964 5.458 . 0 0 "[ . 1 . 2]" 1
3 1 3 ALA HA 1 5 GLN QG . . 5.050 4.271 3.770 4.845 . 0 0 "[ . 1 . 2]" 1
4 1 3 ALA HA 1 6 LEU H . . 4.540 3.711 3.543 3.922 . 0 0 "[ . 1 . 2]" 1
5 1 3 ALA HA 1 6 LEU QB . . 3.820 3.293 2.787 3.860 0.040 14 0 "[ . 1 . 2]" 1
6 1 3 ALA HA 1 7 SER HA . . 5.500 5.533 5.370 5.595 0.095 11 0 "[ . 1 . 2]" 1
7 1 3 ALA HA 1 74 LEU MD1 . . 4.160 2.113 1.903 2.686 . 0 0 "[ . 1 . 2]" 1
8 1 3 ALA HA 1 74 LEU MD2 . . 4.590 2.408 1.937 2.853 . 0 0 "[ . 1 . 2]" 1
9 1 3 ALA HA 1 74 LEU HG . . 4.400 3.525 2.922 4.012 . 0 0 "[ . 1 . 2]" 1
10 1 3 ALA MB 1 4 ARG QB . . 3.940 3.652 3.455 3.827 . 0 0 "[ . 1 . 2]" 1
11 1 3 ALA MB 1 4 ARG QD . . 4.910 4.813 4.691 4.914 0.004 17 0 "[ . 1 . 2]" 1
12 1 3 ALA MB 1 5 GLN QG . . 4.450 4.466 4.383 4.540 0.090 17 0 "[ . 1 . 2]" 1
13 1 3 ALA MB 1 6 LEU H . . 4.810 4.623 4.432 4.807 . 0 0 "[ . 1 . 2]" 1
14 1 3 ALA MB 1 74 LEU MD1 . . 3.710 2.335 1.888 2.770 . 0 0 "[ . 1 . 2]" 1
15 1 3 ALA MB 1 74 LEU MD2 . . 4.160 3.444 2.757 4.034 . 0 0 "[ . 1 . 2]" 1
16 1 4 ARG H 1 4 ARG QB . . 3.280 2.178 2.048 2.249 . 0 0 "[ . 1 . 2]" 1
17 1 4 ARG H 1 4 ARG QD . . 4.240 4.180 4.108 4.267 0.027 1 0 "[ . 1 . 2]" 1
18 1 4 ARG H 1 4 ARG QG . . 4.220 3.744 3.165 4.026 . 0 0 "[ . 1 . 2]" 1
19 1 4 ARG HA 1 4 ARG QD . . 3.360 2.161 1.995 2.318 . 0 0 "[ . 1 . 2]" 1
20 1 4 ARG HA 1 4 ARG QG . . 3.340 2.853 2.425 3.079 . 0 0 "[ . 1 . 2]" 1
21 1 4 ARG HA 1 5 GLN HA . . 5.150 4.810 4.738 4.851 . 0 0 "[ . 1 . 2]" 1
22 1 4 ARG HA 1 5 GLN QG . . 4.990 4.963 4.887 5.082 0.092 14 0 "[ . 1 . 2]" 1
23 1 4 ARG HA 1 7 SER QB . . 4.330 2.069 1.915 2.503 . 0 0 "[ . 1 . 2]" 1
24 1 4 ARG HA 1 10 LYS QB . . 5.500 5.567 5.513 5.604 0.104 11 0 "[ . 1 . 2]" 1
25 1 4 ARG QB 1 4 ARG QD . . 3.160 2.301 2.215 2.472 . 0 0 "[ . 1 . 2]" 1
26 1 4 ARG QB 1 5 GLN HA . . 4.500 4.037 3.677 4.314 . 0 0 "[ . 1 . 2]" 1
27 1 4 ARG QB 1 5 GLN QG . . 4.400 4.020 3.585 4.267 . 0 0 "[ . 1 . 2]" 1
28 1 4 ARG QB 1 7 SER QB . . 4.230 4.014 3.871 4.185 . 0 0 "[ . 1 . 2]" 1
29 1 4 ARG QD 1 5 GLN HA . . 4.730 4.669 4.463 4.765 0.035 20 0 "[ . 1 . 2]" 1
30 1 4 ARG QD 1 7 SER H . . 4.290 4.182 3.985 4.314 0.024 17 0 "[ . 1 . 2]" 1
31 1 4 ARG QD 1 7 SER QB . . 3.570 2.860 2.472 3.144 . 0 0 "[ . 1 . 2]" 1
32 1 4 ARG QG 1 5 GLN H . . 4.560 3.909 3.251 4.567 0.007 8 0 "[ . 1 . 2]" 1
33 1 4 ARG QG 1 7 SER QB . . 4.350 4.182 3.785 4.465 0.115 20 0 "[ . 1 . 2]" 1
34 1 5 GLN H 1 5 GLN QG . . 3.600 1.987 1.839 2.188 . 0 0 "[ . 1 . 2]" 1
35 1 5 GLN HA 1 5 GLN QG . . 3.600 3.302 3.085 3.387 . 0 0 "[ . 1 . 2]" 1
36 1 5 GLN HA 1 6 LEU QD . . 4.490 4.252 4.034 4.538 0.048 18 0 "[ . 1 . 2]" 1
37 1 5 GLN QB 1 6 LEU H . . 4.190 3.176 2.383 3.488 . 0 0 "[ . 1 . 2]" 1
38 1 5 GLN QG 1 6 LEU H . . 4.310 2.482 1.924 3.674 . 0 0 "[ . 1 . 2]" 1
39 1 5 GLN QG 1 6 LEU QD . . 4.530 2.447 1.867 3.705 . 0 0 "[ . 1 . 2]" 1
40 1 5 GLN QG 1 74 LEU MD2 . . 4.980 4.826 4.289 5.187 0.207 17 0 "[ . 1 . 2]" 1
41 1 6 LEU H 1 6 LEU QB . . 3.770 2.241 2.094 2.621 . 0 0 "[ . 1 . 2]" 1
42 1 6 LEU H 1 6 LEU QD . . 3.770 2.665 2.382 3.105 . 0 0 "[ . 1 . 2]" 1
43 1 6 LEU H 1 6 LEU HG . . 5.130 3.932 2.323 4.436 . 0 0 "[ . 1 . 2]" 1
44 1 6 LEU H 1 74 LEU MD1 . . 4.230 4.093 3.792 4.259 0.029 12 0 "[ . 1 . 2]" 1
45 1 6 LEU H 1 74 LEU MD2 . . 4.390 3.955 3.170 4.370 . 0 0 "[ . 1 . 2]" 1
46 1 6 LEU HA 1 6 LEU QD . . 2.920 2.091 1.855 2.371 . 0 0 "[ . 1 . 2]" 1
47 1 6 LEU HA 1 9 LEU H . . 4.210 4.211 3.926 4.379 0.169 18 0 "[ . 1 . 2]" 1
48 1 6 LEU HA 1 9 LEU QB . . 5.230 4.793 4.407 5.006 . 0 0 "[ . 1 . 2]" 1
49 1 6 LEU QB 1 6 LEU QD . . 2.910 1.972 1.918 2.055 . 0 0 "[ . 1 . 2]" 1
50 1 6 LEU QB 1 74 LEU MD2 . . 3.570 2.177 1.888 2.504 . 0 0 "[ . 1 . 2]" 1
51 1 6 LEU QD 1 9 LEU QB . . 5.240 4.701 3.511 5.262 0.022 11 0 "[ . 1 . 2]" 1
52 1 7 SER H 1 7 SER QB . . 3.710 2.307 2.104 2.464 . 0 0 "[ . 1 . 2]" 1
53 1 7 SER HA 1 7 SER QB . . 2.500 2.236 2.178 2.527 0.027 6 0 "[ . 1 . 2]" 1
54 1 7 SER HA 1 10 LYS H . . 4.600 2.702 2.674 2.738 . 0 0 "[ . 1 . 2]" 1
55 1 7 SER HA 1 10 LYS QB . . 4.810 2.077 1.941 2.216 . 0 0 "[ . 1 . 2]" 1
56 1 7 SER HA 1 10 LYS QD . . 4.540 3.622 3.231 4.287 . 0 0 "[ . 1 . 2]" 1
57 1 7 SER HA 1 10 LYS QG . . 4.570 3.977 3.791 4.245 . 0 0 "[ . 1 . 2]" 1
58 1 7 SER HA 1 11 ARG QG . . 5.060 4.886 4.754 5.118 0.058 11 0 "[ . 1 . 2]" 1
59 1 7 SER HA 1 74 LEU MD1 . . 4.750 3.344 2.837 3.801 . 0 0 "[ . 1 . 2]" 1
60 1 7 SER HA 1 74 LEU HG . . 4.470 3.034 2.335 3.379 . 0 0 "[ . 1 . 2]" 1
61 1 7 SER QB 1 8 LYS H . . 3.590 3.588 3.201 3.710 0.120 2 0 "[ . 1 . 2]" 1
62 1 7 SER QB 1 10 LYS H . . 4.230 4.099 3.936 4.268 0.038 18 0 "[ . 1 . 2]" 1
63 1 7 SER QB 1 10 LYS QB . . 4.030 2.687 2.511 3.206 . 0 0 "[ . 1 . 2]" 1
64 1 7 SER QB 1 10 LYS QD . . 3.860 2.792 2.332 3.456 . 0 0 "[ . 1 . 2]" 1
65 1 7 SER QB 1 11 ARG QG . . 3.730 3.864 3.805 3.936 0.206 18 0 "[ . 1 . 2]" 1
66 1 7 SER QB 1 74 LEU MD1 . . 4.530 3.152 2.736 3.334 . 0 0 "[ . 1 . 2]" 1
67 1 7 SER QB 1 74 LEU HG . . 3.800 3.960 3.896 4.027 0.227 11 0 "[ . 1 . 2]" 1
68 1 8 LYS HA 1 8 LYS QG . . 3.940 2.583 2.311 3.418 . 0 0 "[ . 1 . 2]" 1
69 1 8 LYS HA 1 9 LEU HA . . 5.250 4.628 4.624 4.647 . 0 0 "[ . 1 . 2]" 1
70 1 8 LYS QB 1 8 LYS QD . . 3.470 2.183 2.015 2.541 . 0 0 "[ . 1 . 2]" 1
71 1 8 LYS QB 1 9 LEU HA . . 4.500 4.243 4.038 4.577 0.077 12 0 "[ . 1 . 2]" 1
72 1 8 LYS QG 1 12 PHE QB . . 5.340 5.037 4.710 5.347 0.007 20 0 "[ . 1 . 2]" 1
73 1 9 LEU H 1 9 LEU QD . . 4.410 3.611 3.466 3.797 . 0 0 "[ . 1 . 2]" 1
74 1 9 LEU H 1 9 LEU HG . . 5.360 4.548 3.951 4.719 . 0 0 "[ . 1 . 2]" 1
75 1 9 LEU HA 1 9 LEU MD1 . . 4.610 3.404 2.379 3.755 . 0 0 "[ . 1 . 2]" 1
76 1 9 LEU HA 1 9 LEU QD . . 3.860 2.629 1.886 3.216 . 0 0 "[ . 1 . 2]" 1
77 1 9 LEU HA 1 9 LEU MD2 . . 4.610 2.938 1.896 3.988 . 0 0 "[ . 1 . 2]" 1
78 1 9 LEU HA 1 12 PHE H . . 5.500 3.490 3.380 3.606 . 0 0 "[ . 1 . 2]" 1
79 1 9 LEU HA 1 12 PHE HB2 . . 5.030 3.673 2.795 3.931 . 0 0 "[ . 1 . 2]" 1
80 1 9 LEU HA 1 12 PHE HB3 . . 5.030 2.724 2.616 2.973 . 0 0 "[ . 1 . 2]" 1
81 1 9 LEU HA 1 12 PHE QD . . 4.350 3.958 3.488 4.425 0.075 20 0 "[ . 1 . 2]" 1
82 1 9 LEU HA 1 13 LEU QD . . 5.500 4.991 4.701 5.547 0.047 19 0 "[ . 1 . 2]" 1
83 1 9 LEU HA 1 75 LEU QD . . 5.500 5.171 4.916 5.528 0.028 16 0 "[ . 1 . 2]" 1
84 1 9 LEU QB 1 12 PHE QD . . 5.120 4.746 3.902 5.251 0.131 9 0 "[ . 1 . 2]" 1
85 1 9 LEU QB 1 13 LEU QD . . 5.440 4.466 4.078 4.809 . 0 0 "[ . 1 . 2]" 1
86 1 9 LEU QB 1 75 LEU QD . . 5.500 3.927 3.242 4.292 . 0 0 "[ . 1 . 2]" 1
87 1 9 LEU QD 1 10 LYS HA . . 3.500 2.963 2.648 3.628 0.128 8 0 "[ . 1 . 2]" 1
88 1 9 LEU QD 1 10 LYS QB . . 4.990 4.051 3.741 4.606 . 0 0 "[ . 1 . 2]" 1
89 1 9 LEU QD 1 12 PHE QB . . 4.850 2.898 1.879 3.773 . 0 0 "[ . 1 . 2]" 1
90 1 9 LEU QD 1 13 LEU HA . . 4.390 3.601 3.225 4.158 . 0 0 "[ . 1 . 2]" 1
91 1 9 LEU QD 1 13 LEU QB . . 3.790 2.003 1.857 2.808 . 0 0 "[ . 1 . 2]" 1
92 1 9 LEU QD 1 13 LEU QD . . 3.230 2.062 1.792 2.465 . 0 0 "[ . 1 . 2]" 1
93 1 9 LEU QD 1 13 LEU HG . . 3.750 2.743 2.443 3.341 . 0 0 "[ . 1 . 2]" 1
94 1 9 LEU QD 1 71 ASN HA . . 5.030 4.202 3.755 4.919 . 0 0 "[ . 1 . 2]" 1
95 1 9 LEU QD 1 71 ASN QB . . 3.580 2.191 1.814 2.836 . 0 0 "[ . 1 . 2]" 1
96 1 9 LEU QD 1 71 ASN QD . . 4.530 2.518 1.840 3.635 . 0 0 "[ . 1 . 2]" 1
97 1 9 LEU QD 1 72 LEU H . . 5.440 5.225 4.819 5.558 0.118 14 0 "[ . 1 . 2]" 1
98 1 9 LEU QD 1 75 LEU H . . 5.360 5.226 4.566 5.425 0.065 4 0 "[ . 1 . 2]" 1
99 1 9 LEU QD 1 75 LEU QD . . 3.210 2.238 1.791 2.717 . 0 0 "[ . 1 . 2]" 1
100 1 9 LEU HG 1 10 LYS H . . 5.500 4.746 3.159 5.279 . 0 0 "[ . 1 . 2]" 1
101 1 9 LEU HG 1 12 PHE QD . . 4.950 3.725 2.095 4.864 . 0 0 "[ . 1 . 2]" 1
102 1 9 LEU HG 1 13 LEU QD . . 4.490 3.466 2.590 4.339 . 0 0 "[ . 1 . 2]" 1
103 1 10 LYS H 1 10 LYS QD . . 5.210 4.432 4.346 4.540 . 0 0 "[ . 1 . 2]" 1
104 1 10 LYS H 1 10 LYS QG . . 4.670 3.940 3.875 3.972 . 0 0 "[ . 1 . 2]" 1
105 1 10 LYS H 1 74 LEU HG . . 5.500 4.822 4.321 5.299 . 0 0 "[ . 1 . 2]" 1
106 1 10 LYS H 1 75 LEU QD . . 4.220 3.931 3.537 4.193 . 0 0 "[ . 1 . 2]" 1
107 1 10 LYS HA 1 10 LYS QD . . 4.160 4.039 3.559 4.180 0.020 1 0 "[ . 1 . 2]" 1
108 1 10 LYS HA 1 10 LYS QG . . 3.660 2.480 2.345 2.722 . 0 0 "[ . 1 . 2]" 1
109 1 10 LYS HA 1 13 LEU QD . . 4.640 4.426 4.179 4.560 . 0 0 "[ . 1 . 2]" 1
110 1 10 LYS HA 1 13 LEU HG . . 4.690 4.500 4.148 4.790 0.100 9 0 "[ . 1 . 2]" 1
111 1 10 LYS HA 1 71 ASN QB . . 5.290 4.329 3.614 4.774 . 0 0 "[ . 1 . 2]" 1
112 1 10 LYS HA 1 75 LEU HA . . 4.240 4.133 3.633 4.355 0.115 2 0 "[ . 1 . 2]" 1
113 1 10 LYS HA 1 75 LEU QD . . 3.200 2.088 1.865 2.618 . 0 0 "[ . 1 . 2]" 1
114 1 10 LYS QB 1 11 ARG H . . 5.300 2.196 2.046 2.453 . 0 0 "[ . 1 . 2]" 1
115 1 10 LYS QB 1 11 ARG QG . . 3.940 3.064 2.949 3.350 . 0 0 "[ . 1 . 2]" 1
116 1 10 LYS QB 1 13 LEU QB . . 5.190 4.602 4.382 4.807 . 0 0 "[ . 1 . 2]" 1
117 1 10 LYS QB 1 74 LEU HB2 . . 5.500 4.132 3.786 4.630 . 0 0 "[ . 1 . 2]" 1
118 1 10 LYS QB 1 74 LEU HB3 . . 5.200 2.694 2.329 3.089 . 0 0 "[ . 1 . 2]" 1
119 1 10 LYS QB 1 74 LEU MD1 . . 5.180 3.551 3.101 4.030 . 0 0 "[ . 1 . 2]" 1
120 1 10 LYS QB 1 74 LEU MD2 . . 5.070 4.903 4.536 5.105 0.035 16 0 "[ . 1 . 2]" 1
121 1 10 LYS QB 1 75 LEU QD . . 3.950 3.314 2.685 3.793 . 0 0 "[ . 1 . 2]" 1
122 1 10 LYS QD 1 11 ARG H . . 5.430 3.671 2.859 4.045 . 0 0 "[ . 1 . 2]" 1
123 1 10 LYS QD 1 11 ARG HA . . 4.850 4.342 2.688 4.919 0.069 2 0 "[ . 1 . 2]" 1
124 1 10 LYS QD 1 11 ARG QG . . 4.340 3.559 2.801 3.990 . 0 0 "[ . 1 . 2]" 1
125 1 10 LYS QD 1 74 LEU MD1 . . 4.860 3.737 2.736 4.822 . 0 0 "[ . 1 . 2]" 1
126 1 10 LYS QD 1 78 GLU HG2 . . 5.500 4.588 3.443 5.245 . 0 0 "[ . 1 . 2]" 1
127 1 10 LYS QD 1 78 GLU QG . . 4.730 4.303 3.355 4.751 0.021 5 0 "[ . 1 . 2]" 1
128 1 10 LYS QD 1 78 GLU HG3 . . 5.500 5.302 4.468 5.532 0.032 1 0 "[ . 1 . 2]" 1
129 1 10 LYS QE 1 11 ARG HA . . 5.500 4.207 2.508 5.508 0.008 14 0 "[ . 1 . 2]" 1
130 1 10 LYS QE 1 11 ARG QG . . 5.390 3.988 2.307 4.983 . 0 0 "[ . 1 . 2]" 1
131 1 10 LYS QE 1 75 LEU HA . . 5.500 4.815 4.114 5.527 0.027 1 0 "[ . 1 . 2]" 1
132 1 10 LYS QE 1 77 ARG QB . . 5.500 4.639 2.216 5.521 0.021 14 0 "[ . 1 . 2]" 1
133 1 10 LYS QE 1 78 GLU HG2 . . 5.500 3.973 2.650 5.256 . 0 0 "[ . 1 . 2]" 1
134 1 10 LYS QE 1 78 GLU QG . . 4.800 3.686 2.603 4.672 . 0 0 "[ . 1 . 2]" 1
135 1 10 LYS QE 1 78 GLU HG3 . . 5.500 4.515 3.552 5.412 . 0 0 "[ . 1 . 2]" 1
136 1 10 LYS QG 1 75 LEU QD . . 3.190 2.785 2.242 3.276 0.086 2 0 "[ . 1 . 2]" 1
137 1 11 ARG HA 1 11 ARG QD . . 4.560 3.894 2.251 4.270 . 0 0 "[ . 1 . 2]" 1
138 1 11 ARG HA 1 12 PHE HA . . 4.780 4.835 4.801 4.851 0.071 9 0 "[ . 1 . 2]" 1
139 1 11 ARG HA 1 14 THR MG . . 4.980 4.003 1.982 4.300 . 0 0 "[ . 1 . 2]" 1
140 1 11 ARG QB 1 12 PHE QB . . 4.580 3.760 3.703 3.818 . 0 0 "[ . 1 . 2]" 1
141 1 12 PHE HA 1 12 PHE QD . . 3.630 2.564 2.077 3.106 . 0 0 "[ . 1 . 2]" 1
142 1 12 PHE HA 1 15 THR MG . . 4.660 2.302 2.004 2.960 . 0 0 "[ . 1 . 2]" 1
143 1 12 PHE HB2 1 13 LEU QD . . 5.500 5.337 4.823 5.591 0.091 19 0 "[ . 1 . 2]" 1
144 1 12 PHE HB2 1 15 THR MG . . 5.500 4.268 3.933 4.985 . 0 0 "[ . 1 . 2]" 1
145 1 12 PHE HB3 1 13 LEU QD . . 5.500 4.073 3.354 4.502 . 0 0 "[ . 1 . 2]" 1
146 1 12 PHE HB3 1 15 THR MG . . 5.500 4.646 4.318 5.427 . 0 0 "[ . 1 . 2]" 1
147 1 12 PHE QD 1 13 LEU HA . . 4.090 3.603 2.668 4.391 0.301 13 0 "[ . 1 . 2]" 1
148 1 12 PHE QD 1 13 LEU QD . . 4.250 3.253 2.396 3.999 . 0 0 "[ . 1 . 2]" 1
149 1 12 PHE QD 1 15 THR MG . . 4.000 3.410 2.450 4.161 0.161 7 0 "[ . 1 . 2]" 1
150 1 12 PHE QD 1 16 LEU QD . . 3.530 3.363 2.509 3.715 0.185 7 0 "[ . 1 . 2]" 1
151 1 12 PHE QE 1 16 LEU QD . . 3.640 2.311 1.893 2.742 . 0 0 "[ . 1 . 2]" 1
152 1 12 PHE QE 1 16 LEU HG . . 4.470 4.510 4.423 4.558 0.088 20 0 "[ . 1 . 2]" 1
153 1 13 LEU H 1 13 LEU QD . . 4.370 3.155 2.933 3.332 . 0 0 "[ . 1 . 2]" 1
154 1 13 LEU HA 1 13 LEU QD . . 3.120 1.947 1.880 2.020 . 0 0 "[ . 1 . 2]" 1
155 1 13 LEU HA 1 13 LEU HG . . 3.770 3.647 3.626 3.668 . 0 0 "[ . 1 . 2]" 1
156 1 13 LEU HA 1 16 LEU H . . 4.370 3.453 3.378 3.534 . 0 0 "[ . 1 . 2]" 1
157 1 13 LEU HA 1 16 LEU QB . . 3.990 2.119 2.059 2.266 . 0 0 "[ . 1 . 2]" 1
158 1 13 LEU HA 1 16 LEU QD . . 3.770 2.530 2.287 2.843 . 0 0 "[ . 1 . 2]" 1
159 1 13 LEU HA 1 17 GLN QE . . 5.440 4.854 3.863 5.607 0.167 4 0 "[ . 1 . 2]" 1
160 1 13 LEU HA 1 75 LEU QD . . 4.860 3.884 3.757 4.073 . 0 0 "[ . 1 . 2]" 1
161 1 13 LEU QB 1 16 LEU QD . . 4.860 3.904 3.647 4.217 . 0 0 "[ . 1 . 2]" 1
162 1 13 LEU QB 1 35 VAL QG . . 4.500 3.748 3.405 3.977 . 0 0 "[ . 1 . 2]" 1
163 1 13 LEU QB 1 75 LEU QD . . 3.080 1.774 1.672 1.976 . 0 0 "[ . 1 . 2]" 1
164 1 13 LEU QD 1 14 THR H . . 4.810 3.588 3.379 3.814 . 0 0 "[ . 1 . 2]" 1
165 1 13 LEU QD 1 14 THR HA . . 4.870 3.608 3.228 4.038 . 0 0 "[ . 1 . 2]" 1
166 1 13 LEU QD 1 14 THR HB . . 5.500 5.410 4.733 5.605 0.105 4 0 "[ . 1 . 2]" 1
167 1 13 LEU QD 1 15 THR H . . 5.260 5.066 4.833 5.260 0.000 9 0 "[ . 1 . 2]" 1
168 1 13 LEU QD 1 16 LEU QB . . 4.510 2.909 2.846 2.980 . 0 0 "[ . 1 . 2]" 1
169 1 13 LEU QD 1 16 LEU QD . . 3.020 1.907 1.742 2.164 . 0 0 "[ . 1 . 2]" 1
170 1 13 LEU QD 1 17 GLN QB . . 3.610 2.847 2.643 3.253 . 0 0 "[ . 1 . 2]" 1
171 1 13 LEU QD 1 17 GLN QE . . 4.350 2.346 1.884 3.687 . 0 0 "[ . 1 . 2]" 1
172 1 13 LEU QD 1 35 VAL H . . 5.360 4.690 4.473 4.925 . 0 0 "[ . 1 . 2]" 1
173 1 13 LEU QD 1 35 VAL HA . . 4.720 3.548 3.288 3.758 . 0 0 "[ . 1 . 2]" 1
174 1 13 LEU QD 1 35 VAL HB . . 4.940 3.692 3.503 3.825 . 0 0 "[ . 1 . 2]" 1
175 1 13 LEU QD 1 35 VAL QG . . 3.240 1.663 1.576 1.733 . 0 0 "[ . 1 . 2]" 1
176 1 13 LEU QD 1 38 LEU MD1 . . 4.820 4.168 3.976 4.515 . 0 0 "[ . 1 . 2]" 1
177 1 13 LEU QD 1 75 LEU HA . . 5.400 4.839 4.606 5.102 . 0 0 "[ . 1 . 2]" 1
178 1 13 LEU QD 1 75 LEU QD . . 3.550 1.943 1.821 2.186 . 0 0 "[ . 1 . 2]" 1
179 1 13 LEU QD 1 79 LEU QD . . 4.860 4.900 4.783 4.953 0.093 17 0 "[ . 1 . 2]" 1
180 1 13 LEU HG 1 16 LEU QB . . 5.270 5.316 5.246 5.398 0.128 4 0 "[ . 1 . 2]" 1
181 1 13 LEU HG 1 71 ASN QB . . 5.340 4.237 3.750 5.058 . 0 0 "[ . 1 . 2]" 1
182 1 13 LEU HG 1 75 LEU QD . . 3.060 1.973 1.715 2.350 . 0 0 "[ . 1 . 2]" 1
183 1 14 THR H 1 14 THR HB . . 3.820 2.835 2.568 3.484 . 0 0 "[ . 1 . 2]" 1
184 1 14 THR HA 1 15 THR HA . . 4.860 4.741 4.728 4.754 . 0 0 "[ . 1 . 2]" 1
185 1 15 THR HA 1 16 LEU HA . . 4.970 4.811 4.784 4.826 . 0 0 "[ . 1 . 2]" 1
186 1 15 THR HB 1 16 LEU H . . 4.740 4.046 3.971 4.111 . 0 0 "[ . 1 . 2]" 1
187 1 15 THR HB 1 18 GLN H . . 5.500 5.476 5.309 5.529 0.029 9 0 "[ . 1 . 2]" 1
188 1 15 THR HB 1 18 GLN QB . . 4.240 4.319 4.247 4.393 0.153 20 0 "[ . 1 . 2]" 1
189 1 15 THR HB 1 18 GLN QG . . 4.520 4.682 4.609 4.751 0.231 11 0 "[ . 1 . 2]" 1
190 1 16 LEU H 1 16 LEU QD . . 4.050 3.565 3.359 3.679 . 0 0 "[ . 1 . 2]" 1
191 1 16 LEU HA 1 16 LEU QD . . 4.080 3.187 3.066 3.265 . 0 0 "[ . 1 . 2]" 1
192 1 16 LEU HA 1 16 LEU HG . . 3.570 2.769 2.656 2.918 . 0 0 "[ . 1 . 2]" 1
193 1 16 LEU HA 1 17 GLN HA . . 4.980 4.673 4.652 4.692 . 0 0 "[ . 1 . 2]" 1
194 1 16 LEU HA 1 18 GLN H . . 5.240 4.396 4.302 4.497 . 0 0 "[ . 1 . 2]" 1
195 1 16 LEU HA 1 19 PHE H . . 5.000 3.948 3.869 4.148 . 0 0 "[ . 1 . 2]" 1
196 1 16 LEU HA 1 19 PHE HB2 . . 4.660 4.404 3.933 4.658 . 0 0 "[ . 1 . 2]" 1
197 1 16 LEU HA 1 19 PHE QB . . 3.960 3.879 3.708 4.004 0.044 11 0 "[ . 1 . 2]" 1
198 1 16 LEU HA 1 19 PHE HB3 . . 4.660 4.379 3.935 4.669 0.009 6 0 "[ . 1 . 2]" 1
199 1 16 LEU QB 1 17 GLN H . . 4.020 2.629 2.511 2.796 . 0 0 "[ . 1 . 2]" 1
200 1 16 LEU QB 1 17 GLN HA . . 5.500 4.437 4.306 4.562 . 0 0 "[ . 1 . 2]" 1
201 1 16 LEU QD 1 17 GLN QB . . 4.780 2.521 2.316 2.890 . 0 0 "[ . 1 . 2]" 1
202 1 16 LEU QD 1 31 VAL HB . . 5.500 4.098 4.008 4.265 . 0 0 "[ . 1 . 2]" 1
203 1 16 LEU QD 1 35 VAL HA . . 5.100 5.206 5.142 5.315 0.215 20 0 "[ . 1 . 2]" 1
204 1 16 LEU QD 1 35 VAL QG . . 3.920 2.401 2.334 2.536 . 0 0 "[ . 1 . 2]" 1
205 1 16 LEU QD 1 52 LEU QD . . 3.590 2.910 2.424 3.443 . 0 0 "[ . 1 . 2]" 1
206 1 16 LEU QD 1 64 VAL QG . . 5.440 5.295 4.723 5.619 0.179 11 0 "[ . 1 . 2]" 1
207 1 17 GLN H 1 17 GLN HB2 . . 4.200 3.544 2.703 3.625 . 0 0 "[ . 1 . 2]" 1
208 1 17 GLN H 1 17 GLN HB3 . . 4.200 2.606 2.157 2.820 . 0 0 "[ . 1 . 2]" 1
209 1 17 GLN H 1 17 GLN HG2 . . 4.410 2.507 2.053 4.380 . 0 0 "[ . 1 . 2]" 1
210 1 17 GLN H 1 17 GLN HG3 . . 4.410 3.176 2.499 4.632 0.222 4 0 "[ . 1 . 2]" 1
211 1 17 GLN HA 1 17 GLN QE . . 5.280 4.943 4.275 5.289 0.009 12 0 "[ . 1 . 2]" 1
212 1 17 GLN HA 1 17 GLN HG2 . . 3.930 3.724 2.670 3.945 0.015 19 0 "[ . 1 . 2]" 1
213 1 17 GLN HA 1 17 GLN HG3 . . 3.930 3.644 3.101 3.815 . 0 0 "[ . 1 . 2]" 1
214 1 17 GLN HA 1 18 GLN HA . . 4.910 4.747 4.719 4.774 . 0 0 "[ . 1 . 2]" 1
215 1 17 GLN HA 1 31 VAL HA . . 5.500 5.351 5.180 5.481 . 0 0 "[ . 1 . 2]" 1
216 1 17 GLN HA 1 31 VAL HB . . 4.740 3.701 3.429 3.895 . 0 0 "[ . 1 . 2]" 1
217 1 17 GLN HA 1 31 VAL QG . . 4.780 1.896 1.847 2.124 . 0 0 "[ . 1 . 2]" 1
218 1 17 GLN HA 1 35 VAL QG . . 4.170 3.665 3.474 3.857 . 0 0 "[ . 1 . 2]" 1
219 1 17 GLN QB 1 17 GLN QE . . 3.990 2.681 1.910 3.106 . 0 0 "[ . 1 . 2]" 1
220 1 17 GLN QB 1 18 GLN H . . 4.070 3.486 2.768 3.602 . 0 0 "[ . 1 . 2]" 1
221 1 17 GLN QB 1 31 VAL QG . . 4.600 2.476 2.237 2.822 . 0 0 "[ . 1 . 2]" 1
222 1 17 GLN QB 1 35 VAL HA . . 5.340 5.286 5.005 5.515 0.175 20 0 "[ . 1 . 2]" 1
223 1 17 GLN QB 1 35 VAL HB . . 4.120 3.087 2.792 3.398 . 0 0 "[ . 1 . 2]" 1
224 1 17 GLN QB 1 35 VAL QG . . 3.450 2.178 1.974 2.304 . 0 0 "[ . 1 . 2]" 1
225 1 17 GLN QB 1 36 LEU QD . . 3.270 3.291 2.881 3.496 0.226 4 0 "[ . 1 . 2]" 1
226 1 17 GLN HB2 1 17 GLN QE . . 4.570 3.475 2.485 3.861 . 0 0 "[ . 1 . 2]" 1
227 1 17 GLN HB2 1 35 VAL QG . . 3.960 2.948 2.188 3.305 . 0 0 "[ . 1 . 2]" 1
228 1 17 GLN HB3 1 17 GLN QE . . 4.570 2.825 1.923 3.363 . 0 0 "[ . 1 . 2]" 1
229 1 17 GLN HB3 1 35 VAL QG . . 3.960 2.313 2.015 3.194 . 0 0 "[ . 1 . 2]" 1
230 1 17 GLN QE 1 32 ARG HA . . 5.500 4.961 4.450 5.500 . 7 0 "[ . 1 . 2]" 1
231 1 17 GLN QE 1 35 VAL HB . . 5.500 3.984 3.677 4.608 . 0 0 "[ . 1 . 2]" 1
232 1 17 GLN QE 1 35 VAL QG . . 3.690 2.052 1.830 2.967 . 0 0 "[ . 1 . 2]" 1
233 1 17 GLN QE 1 36 LEU HA . . 5.500 4.566 3.657 5.514 0.014 3 0 "[ . 1 . 2]" 1
234 1 17 GLN QE 1 36 LEU QD . . 3.950 2.593 1.895 3.784 . 0 0 "[ . 1 . 2]" 1
235 1 17 GLN QG 1 18 GLN H . . 4.480 2.377 2.132 3.886 . 0 0 "[ . 1 . 2]" 1
236 1 17 GLN QG 1 36 LEU QD . . 4.200 3.543 2.093 3.960 . 0 0 "[ . 1 . 2]" 1
237 1 17 GLN HG2 1 35 VAL QG . . 4.460 3.367 2.606 4.077 . 0 0 "[ . 1 . 2]" 1
238 1 17 GLN HG3 1 35 VAL QG . . 4.460 3.890 2.768 4.212 . 0 0 "[ . 1 . 2]" 1
239 1 18 GLN H 1 18 GLN HB2 . . 3.740 2.812 2.369 3.052 . 0 0 "[ . 1 . 2]" 1
240 1 18 GLN H 1 18 GLN QB . . 3.210 2.205 2.104 2.408 . 0 0 "[ . 1 . 2]" 1
241 1 18 GLN H 1 18 GLN HB3 . . 3.740 2.605 2.148 3.597 . 0 0 "[ . 1 . 2]" 1
242 1 18 GLN H 1 18 GLN HG2 . . 4.630 3.935 2.487 4.584 . 0 0 "[ . 1 . 2]" 1
243 1 18 GLN H 1 18 GLN QG . . 3.940 3.388 2.423 3.847 . 0 0 "[ . 1 . 2]" 1
244 1 18 GLN H 1 18 GLN HG3 . . 4.630 3.818 3.162 4.133 . 0 0 "[ . 1 . 2]" 1
245 1 18 GLN HA 1 18 GLN HE21 . . 4.140 3.335 2.721 4.046 . 0 0 "[ . 1 . 2]" 1
246 1 18 GLN HA 1 18 GLN QE . . 3.620 3.129 2.608 3.657 0.037 5 0 "[ . 1 . 2]" 1
247 1 18 GLN HA 1 18 GLN HE22 . . 4.140 3.926 3.343 4.194 0.054 8 0 "[ . 1 . 2]" 1
248 1 18 GLN HA 1 18 GLN HG2 . . 3.920 3.511 2.498 3.951 0.031 16 0 "[ . 1 . 2]" 1
249 1 18 GLN HA 1 18 GLN QG . . 3.200 3.036 2.461 3.297 0.097 16 0 "[ . 1 . 2]" 1
250 1 18 GLN HA 1 18 GLN HG3 . . 3.920 3.556 3.425 3.741 . 0 0 "[ . 1 . 2]" 1
251 1 18 GLN HA 1 21 ASN QB . . 4.700 4.803 4.767 4.851 0.151 20 0 "[ . 1 . 2]" 1
252 1 18 GLN HB2 1 19 PHE H . . 4.170 3.565 2.411 4.115 . 0 0 "[ . 1 . 2]" 1
253 1 18 GLN HB3 1 19 PHE H . . 4.170 2.950 2.456 3.519 . 0 0 "[ . 1 . 2]" 1
254 1 19 PHE HA 1 22 ASP HA . . 5.170 5.341 5.213 5.405 0.235 16 0 "[ . 1 . 2]" 1
255 1 19 PHE HA 1 22 ASP HB2 . . 4.110 3.234 2.643 3.790 . 0 0 "[ . 1 . 2]" 1
256 1 19 PHE HA 1 22 ASP HB3 . . 4.110 3.778 2.922 4.090 . 0 0 "[ . 1 . 2]" 1
257 1 20 GLY QA 1 23 ILE MG . . 4.040 2.325 1.994 4.076 0.036 8 0 "[ . 1 . 2]" 1
258 1 20 GLY QA 1 27 ILE MG . . 3.780 3.459 3.042 3.799 0.019 11 0 "[ . 1 . 2]" 1
259 1 20 GLY QA 1 28 GLY HA2 . . 4.650 3.107 2.714 3.473 . 0 0 "[ . 1 . 2]" 1
260 1 20 GLY QA 1 31 VAL QG . . 3.970 2.691 2.588 2.791 . 0 0 "[ . 1 . 2]" 1
261 1 20 GLY HA2 1 31 VAL QG . . 4.530 3.558 3.257 3.770 . 0 0 "[ . 1 . 2]" 1
262 1 20 GLY HA3 1 31 VAL QG . . 4.530 2.787 2.676 2.915 . 0 0 "[ . 1 . 2]" 1
263 1 21 ASN H 1 21 ASN HB2 . . 3.840 2.610 2.131 3.585 . 0 0 "[ . 1 . 2]" 1
264 1 21 ASN H 1 21 ASN HB3 . . 3.840 2.710 2.197 3.211 . 0 0 "[ . 1 . 2]" 1
265 1 21 ASN HA 1 23 ILE H . . 5.500 4.659 4.531 4.790 . 0 0 "[ . 1 . 2]" 1
266 1 21 ASN HA 1 24 SER H . . 4.590 3.813 3.668 3.915 . 0 0 "[ . 1 . 2]" 1
267 1 21 ASN HA 1 25 PRO HA . . 4.410 4.112 3.821 4.454 0.044 8 0 "[ . 1 . 2]" 1
268 1 21 ASN HA 1 28 GLY H . . 4.220 4.001 3.531 4.240 0.020 19 0 "[ . 1 . 2]" 1
269 1 21 ASN HA 1 28 GLY HA2 . . 3.880 2.991 2.675 3.378 . 0 0 "[ . 1 . 2]" 1
270 1 21 ASN HA 1 28 GLY HA3 . . 4.070 2.151 1.991 2.337 . 0 0 "[ . 1 . 2]" 1
271 1 21 ASN QB 1 22 ASP H . . 3.820 3.249 3.067 3.711 . 0 0 "[ . 1 . 2]" 1
272 1 21 ASN HB2 1 22 ASP H . . 4.380 4.048 3.678 4.405 0.025 9 0 "[ . 1 . 2]" 1
273 1 21 ASN HB3 1 22 ASP H . . 4.380 3.457 3.235 3.996 . 0 0 "[ . 1 . 2]" 1
274 1 22 ASP H 1 22 ASP HB2 . . 3.740 2.552 2.203 2.895 . 0 0 "[ . 1 . 2]" 1
275 1 22 ASP H 1 22 ASP HB3 . . 3.740 2.647 2.291 3.134 . 0 0 "[ . 1 . 2]" 1
276 1 22 ASP HB2 1 23 ILE H . . 4.710 3.668 3.198 4.036 . 0 0 "[ . 1 . 2]" 1
277 1 22 ASP HB3 1 23 ILE H . . 4.710 2.467 2.358 2.725 . 0 0 "[ . 1 . 2]" 1
278 1 23 ILE H 1 23 ILE MG . . 4.700 2.037 1.886 3.766 . 0 0 "[ . 1 . 2]" 1
279 1 23 ILE HA 1 23 ILE QG . . 3.880 2.468 2.237 2.517 . 0 0 "[ . 1 . 2]" 1
280 1 23 ILE HA 1 23 ILE MG . . 3.260 3.150 2.414 3.199 . 0 0 "[ . 1 . 2]" 1
281 1 23 ILE HA 1 27 ILE MG . . 5.260 4.860 4.500 5.141 . 0 0 "[ . 1 . 2]" 1
282 1 23 ILE HB 1 24 SER H . . 4.220 3.935 2.494 4.107 . 0 0 "[ . 1 . 2]" 1
283 1 23 ILE HB 1 27 ILE MG . . 4.410 3.948 2.265 4.176 . 0 0 "[ . 1 . 2]" 1
284 1 23 ILE MD 1 27 ILE MD . . 4.000 4.107 3.888 4.243 0.243 11 0 "[ . 1 . 2]" 1
285 1 23 ILE MD 1 27 ILE MG . . 3.040 2.216 1.846 2.788 . 0 0 "[ . 1 . 2]" 1
286 1 23 ILE QG 1 27 ILE MD . . 5.500 5.504 5.354 5.786 0.286 18 0 "[ . 1 . 2]" 1
287 1 23 ILE QG 1 27 ILE MG . . 4.130 2.884 2.311 3.823 . 0 0 "[ . 1 . 2]" 1
288 1 23 ILE MG 1 24 SER H . . 4.850 2.039 1.915 3.277 . 0 0 "[ . 1 . 2]" 1
289 1 23 ILE MG 1 24 SER QB . . 4.840 3.320 2.473 3.897 . 0 0 "[ . 1 . 2]" 1
290 1 23 ILE MG 1 27 ILE H . . 4.990 4.720 4.584 4.999 0.009 8 0 "[ . 1 . 2]" 1
291 1 23 ILE MG 1 27 ILE HB . . 4.760 3.811 3.320 4.138 . 0 0 "[ . 1 . 2]" 1
292 1 23 ILE MG 1 27 ILE MD . . 4.130 4.099 3.887 4.265 0.135 15 0 "[ . 1 . 2]" 1
293 1 23 ILE MG 1 27 ILE MG . . 3.210 1.849 1.737 2.172 . 0 0 "[ . 1 . 2]" 1
294 1 23 ILE MG 1 28 GLY HA2 . . 5.500 3.897 3.508 5.573 0.073 8 0 "[ . 1 . 2]" 1
295 1 24 SER H 1 27 ILE MG . . 4.090 3.075 2.749 3.373 . 0 0 "[ . 1 . 2]" 1
296 1 24 SER HA 1 25 PRO HB2 . . 5.500 5.634 5.604 5.658 0.158 1 0 "[ . 1 . 2]" 1
297 1 24 SER HA 1 25 PRO QB . . 4.700 4.593 4.576 4.607 . 0 0 "[ . 1 . 2]" 1
298 1 24 SER HA 1 25 PRO HB3 . . 5.500 4.867 4.852 4.880 . 0 0 "[ . 1 . 2]" 1
299 1 24 SER HA 1 25 PRO QD . . 3.300 2.152 2.111 2.184 . 0 0 "[ . 1 . 2]" 1
300 1 24 SER QB 1 25 PRO QD . . 3.340 2.061 1.914 2.389 . 0 0 "[ . 1 . 2]" 1
301 1 24 SER QB 1 25 PRO QG . . 3.960 3.556 3.382 3.897 . 0 0 "[ . 1 . 2]" 1
302 1 25 PRO HA 1 28 GLY HA2 . . 5.280 5.349 5.269 5.485 0.205 8 0 "[ . 1 . 2]" 1
303 1 25 PRO QB 1 26 GLU H . . 3.960 2.783 2.662 2.827 . 0 0 "[ . 1 . 2]" 1
304 1 25 PRO QD 1 26 GLU H . . 4.200 2.721 2.698 2.788 . 0 0 "[ . 1 . 2]" 1
305 1 25 PRO QG 1 26 GLU H . . 4.380 1.877 1.788 1.914 . 0 0 "[ . 1 . 2]" 1
306 1 26 GLU H 1 26 GLU HB2 . . 3.760 3.538 3.503 3.576 . 0 0 "[ . 1 . 2]" 1
307 1 26 GLU H 1 26 GLU QB . . 3.260 2.750 2.637 2.818 . 0 0 "[ . 1 . 2]" 1
308 1 26 GLU H 1 26 GLU HB3 . . 3.760 2.869 2.715 2.971 . 0 0 "[ . 1 . 2]" 1
309 1 26 GLU H 1 26 GLU HG2 . . 4.250 2.027 1.860 2.402 . 0 0 "[ . 1 . 2]" 1
310 1 26 GLU H 1 26 GLU QG . . 3.730 1.904 1.789 1.977 . 0 0 "[ . 1 . 2]" 1
311 1 26 GLU H 1 26 GLU HG3 . . 4.250 3.007 1.944 3.461 . 0 0 "[ . 1 . 2]" 1
312 1 26 GLU HA 1 26 GLU QB . . 2.640 2.161 2.154 2.174 . 0 0 "[ . 1 . 2]" 1
313 1 26 GLU HA 1 26 GLU QG . . 3.520 3.325 3.229 3.376 . 0 0 "[ . 1 . 2]" 1
314 1 26 GLU HA 1 27 ILE HA . . 4.880 4.776 4.757 4.794 . 0 0 "[ . 1 . 2]" 1
315 1 26 GLU HA 1 28 GLY H . . 5.010 4.292 4.245 4.330 . 0 0 "[ . 1 . 2]" 1
316 1 26 GLU HA 1 29 GLU QG . . 3.970 2.653 2.368 3.178 . 0 0 "[ . 1 . 2]" 1
317 1 26 GLU HA 1 30 ARG H . . 5.410 4.309 4.205 4.425 . 0 0 "[ . 1 . 2]" 1
318 1 26 GLU QB 1 29 GLU QG . . 5.100 4.100 3.906 4.452 . 0 0 "[ . 1 . 2]" 1
319 1 26 GLU HB2 1 27 ILE H . . 4.220 2.656 2.419 3.179 . 0 0 "[ . 1 . 2]" 1
320 1 26 GLU HB3 1 27 ILE H . . 4.220 3.680 3.580 3.810 . 0 0 "[ . 1 . 2]" 1
321 1 26 GLU HG2 1 27 ILE H . . 4.080 2.357 1.852 3.463 . 0 0 "[ . 1 . 2]" 1
322 1 26 GLU HG2 1 27 ILE MG . . 4.780 4.179 2.968 4.668 . 0 0 "[ . 1 . 2]" 1
323 1 26 GLU HG3 1 27 ILE H . . 4.080 2.290 1.796 2.677 . 0 0 "[ . 1 . 2]" 1
324 1 26 GLU HG3 1 27 ILE MG . . 4.780 4.189 2.929 4.878 0.098 7 0 "[ . 1 . 2]" 1
325 1 27 ILE H 1 27 ILE MD . . 4.320 4.067 3.958 4.163 . 0 0 "[ . 1 . 2]" 1
326 1 27 ILE H 1 27 ILE MG . . 3.990 2.688 2.072 3.228 . 0 0 "[ . 1 . 2]" 1
327 1 27 ILE HA 1 27 ILE MD . . 3.060 1.922 1.883 1.971 . 0 0 "[ . 1 . 2]" 1
328 1 27 ILE HA 1 27 ILE QG . . 3.880 2.673 2.392 3.009 . 0 0 "[ . 1 . 2]" 1
329 1 27 ILE HA 1 27 ILE MG . . 3.300 3.108 2.972 3.202 . 0 0 "[ . 1 . 2]" 1
330 1 27 ILE HA 1 30 ARG H . . 3.910 3.746 3.675 3.800 . 0 0 "[ . 1 . 2]" 1
331 1 27 ILE HA 1 30 ARG QB . . 3.370 2.761 2.668 2.807 . 0 0 "[ . 1 . 2]" 1
332 1 27 ILE HA 1 30 ARG QD . . 4.900 4.581 4.144 4.878 . 0 0 "[ . 1 . 2]" 1
333 1 27 ILE HA 1 30 ARG HG2 . . 4.930 4.518 4.453 4.638 . 0 0 "[ . 1 . 2]" 1
334 1 27 ILE HA 1 55 ALA MB . . 4.840 2.501 2.146 2.849 . 0 0 "[ . 1 . 2]" 1
335 1 27 ILE HB 1 27 ILE MD . . 3.700 2.912 2.503 3.226 . 0 0 "[ . 1 . 2]" 1
336 1 27 ILE MD 1 28 GLY HA2 . . 4.540 4.398 4.185 4.592 0.052 11 0 "[ . 1 . 2]" 1
337 1 27 ILE MD 1 29 GLU QG . . 5.240 5.335 5.278 5.425 0.185 6 0 "[ . 1 . 2]" 1
338 1 27 ILE MD 1 30 ARG H . . 4.150 4.333 4.262 4.404 0.254 4 0 "[ . 1 . 2]" 1
339 1 27 ILE MD 1 30 ARG HA . . 5.330 5.287 5.132 5.365 0.035 4 0 "[ . 1 . 2]" 1
340 1 27 ILE MD 1 30 ARG QB . . 3.510 2.687 2.527 2.754 . 0 0 "[ . 1 . 2]" 1
341 1 27 ILE MD 1 30 ARG HD2 . . 5.490 5.476 5.370 5.605 0.115 7 0 "[ . 1 . 2]" 1
342 1 27 ILE MD 1 30 ARG QD . . 4.740 4.784 4.479 4.909 0.169 19 0 "[ . 1 . 2]" 1
343 1 27 ILE MD 1 30 ARG HD3 . . 5.490 5.287 4.710 5.466 . 0 0 "[ . 1 . 2]" 1
344 1 27 ILE MD 1 30 ARG HG2 . . 4.010 4.032 3.828 4.090 0.080 10 0 "[ . 1 . 2]" 1
345 1 27 ILE MD 1 31 VAL HB . . 4.000 3.802 3.601 4.017 0.017 2 0 "[ . 1 . 2]" 1
346 1 27 ILE MD 1 55 ALA HA . . 4.030 3.872 3.507 4.118 0.088 6 0 "[ . 1 . 2]" 1
347 1 27 ILE MD 1 55 ALA MB . . 3.330 2.037 1.847 2.335 . 0 0 "[ . 1 . 2]" 1
348 1 27 ILE MD 1 56 THR HA . . 3.860 2.536 2.064 2.808 . 0 0 "[ . 1 . 2]" 1
349 1 27 ILE MD 1 56 THR MG . . 3.280 2.028 1.777 2.375 . 0 0 "[ . 1 . 2]" 1
350 1 27 ILE QG 1 28 GLY HA2 . . 5.500 4.735 3.644 5.640 0.140 4 0 "[ . 1 . 2]" 1
351 1 27 ILE QG 1 56 THR HA . . 4.020 2.750 2.188 3.292 . 0 0 "[ . 1 . 2]" 1
352 1 27 ILE MG 1 28 GLY H . . 4.100 2.176 1.903 2.332 . 0 0 "[ . 1 . 2]" 1
353 1 27 ILE MG 1 28 GLY HA2 . . 4.740 2.981 2.794 3.282 . 0 0 "[ . 1 . 2]" 1
354 1 27 ILE MG 1 28 GLY HA3 . . 4.140 3.446 3.384 3.583 . 0 0 "[ . 1 . 2]" 1
355 1 27 ILE MG 1 29 GLU H . . 4.820 4.647 4.602 4.710 . 0 0 "[ . 1 . 2]" 1
356 1 27 ILE MG 1 29 GLU QG . . 5.500 5.278 5.017 5.614 0.114 19 0 "[ . 1 . 2]" 1
357 1 27 ILE MG 1 31 VAL HB . . 4.400 4.150 3.528 4.614 0.214 17 0 "[ . 1 . 2]" 1
358 1 27 ILE MG 1 56 THR HA . . 4.450 4.529 4.269 4.621 0.171 17 0 "[ . 1 . 2]" 1
359 1 27 ILE MG 1 56 THR MG . . 4.330 4.372 4.132 4.525 0.195 15 0 "[ . 1 . 2]" 1
360 1 28 GLY H 1 29 GLU QG . . 4.800 4.113 3.850 4.595 . 0 0 "[ . 1 . 2]" 1
361 1 28 GLY HA2 1 30 ARG H . . 4.970 4.391 4.304 4.463 . 0 0 "[ . 1 . 2]" 1
362 1 28 GLY HA2 1 31 VAL HA . . 5.500 5.689 5.646 5.745 0.245 1 0 "[ . 1 . 2]" 1
363 1 28 GLY HA2 1 31 VAL HB . . 4.320 2.918 2.837 3.031 . 0 0 "[ . 1 . 2]" 1
364 1 28 GLY HA2 1 31 VAL QG . . 4.520 3.244 3.133 3.380 . 0 0 "[ . 1 . 2]" 1
365 1 28 GLY HA2 1 32 ARG H . . 4.660 3.946 3.820 4.022 . 0 0 "[ . 1 . 2]" 1
366 1 28 GLY HA3 1 29 GLU HB3 . . 5.040 4.748 4.612 4.863 . 0 0 "[ . 1 . 2]" 1
367 1 28 GLY HA3 1 31 VAL HB . . 4.670 4.541 4.474 4.641 . 0 0 "[ . 1 . 2]" 1
368 1 28 GLY HA3 1 31 VAL QG . . 4.730 4.542 4.465 4.644 . 0 0 "[ . 1 . 2]" 1
369 1 29 GLU H 1 29 GLU HB3 . . 3.360 2.425 2.193 2.584 . 0 0 "[ . 1 . 2]" 1
370 1 29 GLU H 1 29 GLU QG . . 3.570 2.351 2.025 2.836 . 0 0 "[ . 1 . 2]" 1
371 1 29 GLU H 1 32 ARG QD . . 4.470 3.744 3.577 3.830 . 0 0 "[ . 1 . 2]" 1
372 1 29 GLU HA 1 29 GLU QG . . 3.430 3.337 3.278 3.454 0.024 5 0 "[ . 1 . 2]" 1
373 1 29 GLU HA 1 32 ARG HB3 . . 4.800 4.482 4.434 4.531 . 0 0 "[ . 1 . 2]" 1
374 1 29 GLU HA 1 32 ARG QD . . 3.710 1.990 1.906 2.185 . 0 0 "[ . 1 . 2]" 1
375 1 29 GLU HA 1 32 ARG QG . . 3.910 2.326 2.273 2.395 . 0 0 "[ . 1 . 2]" 1
376 1 29 GLU HB2 1 29 GLU QG . . 2.760 2.345 2.259 2.452 . 0 0 "[ . 1 . 2]" 1
377 1 29 GLU HB2 1 30 ARG H . . 4.760 3.792 3.634 4.014 . 0 0 "[ . 1 . 2]" 1
378 1 29 GLU HB3 1 30 ARG H . . 5.290 3.851 3.641 3.968 . 0 0 "[ . 1 . 2]" 1
379 1 29 GLU QG 1 30 ARG H . . 3.820 1.997 1.880 2.072 . 0 0 "[ . 1 . 2]" 1
380 1 29 GLU QG 1 30 ARG HA . . 4.240 3.279 3.008 3.563 . 0 0 "[ . 1 . 2]" 1
381 1 29 GLU QG 1 30 ARG QD . . 4.110 3.129 2.931 3.455 . 0 0 "[ . 1 . 2]" 1
382 1 29 GLU QG 1 30 ARG HG2 . . 5.500 5.182 5.057 5.341 . 0 0 "[ . 1 . 2]" 1
383 1 29 GLU QG 1 30 ARG HG3 . . 5.050 4.769 4.350 5.048 . 0 0 "[ . 1 . 2]" 1
384 1 29 GLU QG 1 33 THR MG . . 5.500 5.189 4.532 5.505 0.005 5 0 "[ . 1 . 2]" 1
385 1 29 GLU QG 1 34 LEU QD . . 5.500 5.432 5.095 5.593 0.093 6 0 "[ . 1 . 2]" 1
386 1 30 ARG H 1 30 ARG QB . . 3.180 2.110 2.088 2.141 . 0 0 "[ . 1 . 2]" 1
387 1 30 ARG H 1 30 ARG QD . . 3.770 3.556 3.367 3.843 0.073 1 0 "[ . 1 . 2]" 1
388 1 30 ARG H 1 30 ARG HG2 . . 4.720 4.630 4.595 4.659 . 0 0 "[ . 1 . 2]" 1
389 1 30 ARG H 1 30 ARG HG3 . . 4.570 4.352 4.260 4.388 . 0 0 "[ . 1 . 2]" 1
390 1 30 ARG HA 1 30 ARG QD . . 3.600 2.812 2.736 2.971 . 0 0 "[ . 1 . 2]" 1
391 1 30 ARG HA 1 30 ARG HG2 . . 3.710 3.559 3.473 3.591 . 0 0 "[ . 1 . 2]" 1
392 1 30 ARG HA 1 30 ARG HG3 . . 3.310 2.280 2.151 2.346 . 0 0 "[ . 1 . 2]" 1
393 1 30 ARG HA 1 33 THR H . . 4.270 3.561 3.506 3.614 . 0 0 "[ . 1 . 2]" 1
394 1 30 ARG HA 1 33 THR HB . . 3.970 2.321 2.286 2.368 . 0 0 "[ . 1 . 2]" 1
395 1 30 ARG HA 1 33 THR MG . . 3.780 3.573 3.540 3.616 . 0 0 "[ . 1 . 2]" 1
396 1 30 ARG HA 1 34 LEU QD . . 3.160 3.288 3.185 3.389 0.229 12 0 "[ . 1 . 2]" 1
397 1 30 ARG HA 1 51 LYS QG . . 4.900 4.860 4.515 4.948 0.048 8 0 "[ . 1 . 2]" 1
398 1 30 ARG QB 1 30 ARG HD2 . . 3.580 2.334 2.087 3.335 . 0 0 "[ . 1 . 2]" 1
399 1 30 ARG QB 1 30 ARG QD . . 3.070 2.123 2.036 2.457 . 0 0 "[ . 1 . 2]" 1
400 1 30 ARG QB 1 30 ARG HD3 . . 3.580 2.740 2.303 2.977 . 0 0 "[ . 1 . 2]" 1
401 1 30 ARG QB 1 31 VAL H . . 3.690 2.173 2.128 2.214 . 0 0 "[ . 1 . 2]" 1
402 1 30 ARG QB 1 33 THR HB . . 4.960 4.424 4.402 4.455 . 0 0 "[ . 1 . 2]" 1
403 1 30 ARG QB 1 52 LEU HG . . 5.500 4.532 4.143 4.966 . 0 0 "[ . 1 . 2]" 1
404 1 30 ARG QB 1 55 ALA MB . . 3.400 2.405 2.177 2.585 . 0 0 "[ . 1 . 2]" 1
405 1 30 ARG QB 1 56 THR MG . . 5.270 4.983 4.643 5.341 0.071 14 0 "[ . 1 . 2]" 1
406 1 30 ARG QD 1 33 THR HB . . 4.660 4.705 4.675 4.762 0.102 1 0 "[ . 1 . 2]" 1
407 1 30 ARG QD 1 33 THR MG . . 4.820 4.758 4.624 4.803 . 0 0 "[ . 1 . 2]" 1
408 1 30 ARG QD 1 34 LEU QD . . 4.190 3.724 3.515 3.919 . 0 0 "[ . 1 . 2]" 1
409 1 30 ARG QD 1 55 ALA MB . . 4.400 2.741 2.221 3.054 . 0 0 "[ . 1 . 2]" 1
410 1 30 ARG HG2 1 31 VAL H . . 5.270 4.394 4.306 4.482 . 0 0 "[ . 1 . 2]" 1
411 1 30 ARG HG2 1 31 VAL HA . . 5.500 5.195 4.984 5.370 . 0 0 "[ . 1 . 2]" 1
412 1 30 ARG HG2 1 34 LEU QD . . 3.490 2.877 2.585 3.184 . 0 0 "[ . 1 . 2]" 1
413 1 30 ARG HG2 1 52 LEU HA . . 5.080 3.463 3.149 3.823 . 0 0 "[ . 1 . 2]" 1
414 1 30 ARG HG2 1 54 GLU QG . . 5.340 4.221 3.934 4.566 . 0 0 "[ . 1 . 2]" 1
415 1 30 ARG HG2 1 55 ALA MB . . 3.420 1.935 1.869 2.098 . 0 0 "[ . 1 . 2]" 1
416 1 30 ARG HG3 1 31 VAL H . . 5.500 4.331 4.249 4.444 . 0 0 "[ . 1 . 2]" 1
417 1 30 ARG HG3 1 31 VAL HA . . 5.500 4.968 4.837 5.196 . 0 0 "[ . 1 . 2]" 1
418 1 30 ARG HG3 1 33 THR HB . . 4.480 3.790 3.736 3.831 . 0 0 "[ . 1 . 2]" 1
419 1 30 ARG HG3 1 34 LEU QD . . 3.070 2.370 2.108 2.608 . 0 0 "[ . 1 . 2]" 1
420 1 30 ARG HG3 1 51 LYS HB2 . . 4.080 4.045 3.564 4.181 0.101 14 0 "[ . 1 . 2]" 1
421 1 30 ARG HG3 1 51 LYS HB3 . . 3.350 2.492 2.176 2.643 . 0 0 "[ . 1 . 2]" 1
422 1 30 ARG HG3 1 51 LYS QG . . 3.580 3.254 2.914 3.402 . 0 0 "[ . 1 . 2]" 1
423 1 30 ARG HG3 1 52 LEU HA . . 5.500 4.520 4.323 4.817 . 0 0 "[ . 1 . 2]" 1
424 1 30 ARG HG3 1 55 ALA MB . . 3.950 3.424 3.274 3.590 . 0 0 "[ . 1 . 2]" 1
425 1 31 VAL H 1 31 VAL HB . . 4.170 2.487 2.366 2.567 . 0 0 "[ . 1 . 2]" 1
426 1 31 VAL HA 1 31 VAL QG . . 3.290 2.109 2.075 2.141 . 0 0 "[ . 1 . 2]" 1
427 1 31 VAL HA 1 34 LEU H . . 4.160 3.998 3.937 4.053 . 0 0 "[ . 1 . 2]" 1
428 1 31 VAL HA 1 34 LEU QB . . 4.120 3.517 3.456 3.585 . 0 0 "[ . 1 . 2]" 1
429 1 31 VAL HA 1 34 LEU QD . . 3.400 3.546 3.460 3.618 0.218 16 0 "[ . 1 . 2]" 1
430 1 31 VAL HA 1 34 LEU HG . . 4.110 3.385 3.255 3.494 . 0 0 "[ . 1 . 2]" 1
431 1 31 VAL HA 1 35 VAL QG . . 4.310 3.303 3.239 3.385 . 0 0 "[ . 1 . 2]" 1
432 1 31 VAL HA 1 48 PHE QE . . 5.500 4.946 4.537 5.216 . 0 0 "[ . 1 . 2]" 1
433 1 31 VAL HA 1 52 LEU QD . . 4.690 3.172 2.692 3.341 . 0 0 "[ . 1 . 2]" 1
434 1 31 VAL HA 1 52 LEU HG . . 4.180 3.486 3.231 3.827 . 0 0 "[ . 1 . 2]" 1
435 1 31 VAL HA 1 55 ALA MB . . 5.270 4.748 4.385 4.974 . 0 0 "[ . 1 . 2]" 1
436 1 31 VAL HA 1 56 THR MG . . 5.500 5.188 4.658 5.576 0.076 14 0 "[ . 1 . 2]" 1
437 1 31 VAL HB 1 32 ARG H . . 4.350 2.346 2.269 2.443 . 0 0 "[ . 1 . 2]" 1
438 1 31 VAL HB 1 32 ARG HB3 . . 4.440 4.259 4.151 4.412 . 0 0 "[ . 1 . 2]" 1
439 1 31 VAL HB 1 32 ARG QD . . 4.680 4.750 4.715 4.823 0.143 12 0 "[ . 1 . 2]" 1
440 1 31 VAL HB 1 52 LEU QD . . 5.110 5.083 4.789 5.205 0.095 19 0 "[ . 1 . 2]" 1
441 1 31 VAL QG 1 32 ARG HA . . 3.580 2.993 2.836 3.130 . 0 0 "[ . 1 . 2]" 1
442 1 31 VAL QG 1 32 ARG HB3 . . 4.110 3.650 3.354 3.850 . 0 0 "[ . 1 . 2]" 1
443 1 31 VAL QG 1 35 VAL HB . . 4.070 3.599 3.494 3.691 . 0 0 "[ . 1 . 2]" 1
444 1 31 VAL QG 1 35 VAL QG . . 2.830 2.249 2.101 2.372 . 0 0 "[ . 1 . 2]" 1
445 1 31 VAL QG 1 52 LEU QD . . 2.930 2.814 2.644 2.927 . 0 0 "[ . 1 . 2]" 1
446 1 31 VAL QG 1 56 THR MG . . 3.450 3.233 2.897 3.529 0.079 14 0 "[ . 1 . 2]" 1
447 1 32 ARG H 1 32 ARG QD . . 4.640 3.368 3.333 3.440 . 0 0 "[ . 1 . 2]" 1
448 1 32 ARG H 1 36 LEU QD . . 4.720 4.776 4.724 4.859 0.139 4 0 "[ . 1 . 2]" 1
449 1 32 ARG HA 1 32 ARG QD . . 4.520 4.420 4.217 4.540 0.020 19 0 "[ . 1 . 2]" 1
450 1 32 ARG HA 1 32 ARG HG2 . . 4.060 3.655 3.649 3.676 . 0 0 "[ . 1 . 2]" 1
451 1 32 ARG HA 1 32 ARG QG . . 3.440 3.343 3.342 3.344 . 0 0 "[ . 1 . 2]" 1
452 1 32 ARG HA 1 32 ARG HG3 . . 4.060 3.871 3.844 3.881 . 0 0 "[ . 1 . 2]" 1
453 1 32 ARG HA 1 33 THR HA . . 5.500 4.851 4.846 4.863 . 0 0 "[ . 1 . 2]" 1
454 1 32 ARG HA 1 35 VAL H . . 4.280 3.876 3.807 3.925 . 0 0 "[ . 1 . 2]" 1
455 1 32 ARG HA 1 35 VAL HB . . 3.710 2.611 2.558 2.673 . 0 0 "[ . 1 . 2]" 1
456 1 32 ARG HA 1 35 VAL QG . . 3.830 3.226 3.105 3.294 . 0 0 "[ . 1 . 2]" 1
457 1 32 ARG HA 1 36 LEU H . . 4.320 3.202 3.105 3.320 . 0 0 "[ . 1 . 2]" 1
458 1 32 ARG HA 1 36 LEU QD . . 3.480 2.900 2.341 3.199 . 0 0 "[ . 1 . 2]" 1
459 1 32 ARG HA 1 36 LEU HG . . 4.270 3.238 2.587 4.451 0.181 16 0 "[ . 1 . 2]" 1
460 1 32 ARG HB2 1 32 ARG QD . . 3.840 2.960 2.524 3.200 . 0 0 "[ . 1 . 2]" 1
461 1 32 ARG HB2 1 33 THR HA . . 4.870 4.432 4.400 4.469 . 0 0 "[ . 1 . 2]" 1
462 1 32 ARG HB2 1 36 LEU QD . . 3.380 2.261 1.934 2.995 . 0 0 "[ . 1 . 2]" 1
463 1 32 ARG HB3 1 32 ARG QD . . 3.370 2.414 2.204 2.535 . 0 0 "[ . 1 . 2]" 1
464 1 32 ARG QD 1 36 LEU QD . . 5.380 4.273 3.555 5.189 . 0 0 "[ . 1 . 2]" 1
465 1 32 ARG QG 1 33 THR HB . . 4.400 3.769 3.719 3.805 . 0 0 "[ . 1 . 2]" 1
466 1 33 THR H 1 33 THR HB . . 3.710 2.395 2.369 2.414 . 0 0 "[ . 1 . 2]" 1
467 1 33 THR H 1 33 THR MG . . 4.090 3.737 3.727 3.744 . 0 0 "[ . 1 . 2]" 1
468 1 33 THR H 1 36 LEU QD . . 5.330 4.428 4.194 4.703 . 0 0 "[ . 1 . 2]" 1
469 1 33 THR HA 1 33 THR MG . . 2.960 2.520 2.505 2.538 . 0 0 "[ . 1 . 2]" 1
470 1 33 THR HA 1 34 LEU HA . . 5.470 4.769 4.759 4.779 . 0 0 "[ . 1 . 2]" 1
471 1 33 THR HA 1 34 LEU QD . . 4.360 4.444 4.364 4.498 0.138 8 0 "[ . 1 . 2]" 1
472 1 33 THR HB 1 34 LEU H . . 4.270 2.374 2.319 2.447 . 0 0 "[ . 1 . 2]" 1
473 1 33 THR HB 1 34 LEU QD . . 3.310 2.803 2.580 3.014 . 0 0 "[ . 1 . 2]" 1
474 1 33 THR HB 1 34 LEU HG . . 5.120 3.458 3.345 3.567 . 0 0 "[ . 1 . 2]" 1
475 1 33 THR HB 1 35 VAL H . . 5.500 5.078 5.018 5.148 . 0 0 "[ . 1 . 2]" 1
476 1 33 THR MG 1 34 LEU H . . 3.750 2.730 2.623 2.772 . 0 0 "[ . 1 . 2]" 1
477 1 33 THR MG 1 34 LEU HA . . 5.180 2.952 2.904 2.978 . 0 0 "[ . 1 . 2]" 1
478 1 33 THR MG 1 34 LEU QB . . 4.090 4.110 4.036 4.150 0.060 17 0 "[ . 1 . 2]" 1
479 1 33 THR MG 1 34 LEU QD . . 3.250 1.911 1.899 1.928 . 0 0 "[ . 1 . 2]" 1
480 1 33 THR MG 1 34 LEU HG . . 3.850 3.682 3.583 3.750 . 0 0 "[ . 1 . 2]" 1
481 1 33 THR MG 1 35 VAL H . . 5.330 4.897 4.800 4.948 . 0 0 "[ . 1 . 2]" 1
482 1 34 LEU H 1 34 LEU QD . . 3.760 2.326 2.232 2.418 . 0 0 "[ . 1 . 2]" 1
483 1 34 LEU H 1 34 LEU HG . . 3.930 2.050 1.968 2.127 . 0 0 "[ . 1 . 2]" 1
484 1 34 LEU HA 1 34 LEU QD . . 2.890 2.091 1.998 2.223 . 0 0 "[ . 1 . 2]" 1
485 1 34 LEU HA 1 34 LEU HG . . 4.180 3.525 3.483 3.573 . 0 0 "[ . 1 . 2]" 1
486 1 34 LEU HA 1 36 LEU H . . 5.500 5.300 5.204 5.379 . 0 0 "[ . 1 . 2]" 1
487 1 34 LEU HA 1 38 LEU MD2 . . 4.480 4.093 3.763 4.558 0.078 20 0 "[ . 1 . 2]" 1
488 1 34 LEU HA 1 43 LEU HB2 . . 5.410 4.853 4.683 4.978 . 0 0 "[ . 1 . 2]" 1
489 1 34 LEU HA 1 43 LEU QD . . 3.240 2.108 1.905 2.317 . 0 0 "[ . 1 . 2]" 1
490 1 34 LEU HA 1 48 PHE QD . . 4.780 3.798 3.284 3.956 . 0 0 "[ . 1 . 2]" 1
491 1 34 LEU QB 1 35 VAL H . . 5.500 2.168 2.117 2.222 . 0 0 "[ . 1 . 2]" 1
492 1 34 LEU QB 1 35 VAL HA . . 5.320 3.724 3.717 3.732 . 0 0 "[ . 1 . 2]" 1
493 1 34 LEU QB 1 35 VAL HB . . 5.500 4.504 4.451 4.556 . 0 0 "[ . 1 . 2]" 1
494 1 34 LEU QB 1 35 VAL QG . . 4.120 2.958 2.898 3.049 . 0 0 "[ . 1 . 2]" 1
495 1 34 LEU QB 1 38 LEU MD2 . . 3.930 3.191 2.907 3.627 . 0 0 "[ . 1 . 2]" 1
496 1 34 LEU QB 1 43 LEU QD . . 3.260 3.150 2.978 3.260 . 0 0 "[ . 1 . 2]" 1
497 1 34 LEU QB 1 47 GLU HG3 . . 5.500 5.414 5.166 5.555 0.055 18 0 "[ . 1 . 2]" 1
498 1 34 LEU QB 1 48 PHE HA . . 4.190 2.367 2.216 2.480 . 0 0 "[ . 1 . 2]" 1
499 1 34 LEU QB 1 48 PHE HB2 . . 4.740 2.510 2.042 2.949 . 0 0 "[ . 1 . 2]" 1
500 1 34 LEU QB 1 48 PHE QD . . 5.500 1.879 1.849 1.906 . 0 0 "[ . 1 . 2]" 1
501 1 34 LEU QB 1 48 PHE QE . . 5.500 3.315 2.723 3.533 . 0 0 "[ . 1 . 2]" 1
502 1 34 LEU QD 1 35 VAL H . . 4.440 3.801 3.770 3.831 . 0 0 "[ . 1 . 2]" 1
503 1 34 LEU QD 1 43 LEU HB2 . . 5.500 5.514 5.381 5.629 0.129 12 0 "[ . 1 . 2]" 1
504 1 34 LEU QD 1 43 LEU QD . . 2.770 2.477 2.324 2.645 . 0 0 "[ . 1 . 2]" 1
505 1 34 LEU QD 1 47 GLU HG3 . . 4.470 3.778 3.516 4.029 . 0 0 "[ . 1 . 2]" 1
506 1 34 LEU QD 1 48 PHE HA . . 3.800 2.327 2.076 2.605 . 0 0 "[ . 1 . 2]" 1
507 1 34 LEU QD 1 48 PHE QD . . 3.820 3.016 2.879 3.291 . 0 0 "[ . 1 . 2]" 1
508 1 34 LEU QD 1 49 HIS HA . . 4.100 3.910 3.789 4.063 . 0 0 "[ . 1 . 2]" 1
509 1 34 LEU QD 1 50 SER HA . . 5.500 5.344 5.211 5.503 0.003 14 0 "[ . 1 . 2]" 1
510 1 34 LEU QD 1 51 LYS H . . 4.570 2.879 2.610 3.257 . 0 0 "[ . 1 . 2]" 1
511 1 34 LEU QD 1 51 LYS HA . . 3.930 3.564 3.426 3.709 . 0 0 "[ . 1 . 2]" 1
512 1 34 LEU QD 1 51 LYS HB2 . . 2.990 1.862 1.777 1.948 . 0 0 "[ . 1 . 2]" 1
513 1 34 LEU QD 1 51 LYS HB3 . . 3.020 1.816 1.723 2.055 . 0 0 "[ . 1 . 2]" 1
514 1 34 LEU QD 1 51 LYS QE . . 4.040 2.127 1.904 2.273 . 0 0 "[ . 1 . 2]" 1
515 1 34 LEU QD 1 52 LEU HA . . 3.700 2.620 2.456 2.831 . 0 0 "[ . 1 . 2]" 1
516 1 34 LEU QD 1 52 LEU QB . . 3.320 1.930 1.873 2.157 . 0 0 "[ . 1 . 2]" 1
517 1 34 LEU QD 1 52 LEU HG . . 3.040 2.931 2.479 3.089 0.049 20 0 "[ . 1 . 2]" 1
518 1 34 LEU HG 1 35 VAL QG . . 5.500 4.554 4.503 4.623 . 0 0 "[ . 1 . 2]" 1
519 1 34 LEU HG 1 43 LEU QD . . 4.670 4.597 4.414 4.723 0.053 18 0 "[ . 1 . 2]" 1
520 1 34 LEU HG 1 48 PHE HA . . 5.070 4.720 4.505 4.983 . 0 0 "[ . 1 . 2]" 1
521 1 34 LEU HG 1 51 LYS QE . . 4.910 4.821 4.358 4.976 0.066 15 0 "[ . 1 . 2]" 1
522 1 34 LEU HG 1 52 LEU QD . . 4.050 3.975 3.386 4.094 0.044 17 0 "[ . 1 . 2]" 1
523 1 34 LEU HG 1 52 LEU HG . . 5.500 4.623 4.131 5.016 . 0 0 "[ . 1 . 2]" 1
524 1 35 VAL H 1 35 VAL HB . . 3.900 2.537 2.494 2.567 . 0 0 "[ . 1 . 2]" 1
525 1 35 VAL H 1 35 VAL QG . . 3.430 2.042 1.984 2.126 . 0 0 "[ . 1 . 2]" 1
526 1 35 VAL H 1 37 GLY HA3 . . 5.500 5.489 5.433 5.525 0.025 11 0 "[ . 1 . 2]" 1
527 1 35 VAL H 1 43 LEU QD . . 5.260 4.738 4.546 4.947 . 0 0 "[ . 1 . 2]" 1
528 1 35 VAL HA 1 36 LEU HA . . 5.450 4.771 4.758 4.782 . 0 0 "[ . 1 . 2]" 1
529 1 35 VAL HA 1 36 LEU QD . . 5.020 4.810 4.262 5.150 0.130 19 0 "[ . 1 . 2]" 1
530 1 35 VAL HA 1 38 LEU H . . 5.150 4.182 4.102 4.257 . 0 0 "[ . 1 . 2]" 1
531 1 35 VAL HA 1 38 LEU MD1 . . 4.660 3.144 2.932 3.427 . 0 0 "[ . 1 . 2]" 1
532 1 35 VAL HA 1 38 LEU MD2 . . 3.810 2.661 2.423 2.780 . 0 0 "[ . 1 . 2]" 1
533 1 35 VAL HA 1 38 LEU HG . . 4.570 2.741 2.600 2.818 . 0 0 "[ . 1 . 2]" 1
534 1 35 VAL HA 1 39 VAL QG . . 4.500 3.569 3.471 3.691 . 0 0 "[ . 1 . 2]" 1
535 1 35 VAL HA 1 48 PHE QD . . 4.750 3.447 3.064 3.614 . 0 0 "[ . 1 . 2]" 1
536 1 35 VAL HA 1 48 PHE QE . . 3.980 3.726 2.527 4.023 0.043 9 0 "[ . 1 . 2]" 1
537 1 35 VAL HA 1 52 LEU QD . . 5.400 4.856 4.597 5.052 . 0 0 "[ . 1 . 2]" 1
538 1 35 VAL HB 1 36 LEU H . . 4.300 2.022 1.987 2.068 . 0 0 "[ . 1 . 2]" 1
539 1 35 VAL HB 1 36 LEU HB2 . . 4.700 4.503 4.177 4.679 . 0 0 "[ . 1 . 2]" 1
540 1 35 VAL HB 1 36 LEU MD1 . . 4.800 4.571 4.358 4.856 0.056 7 0 "[ . 1 . 2]" 1
541 1 35 VAL HB 1 36 LEU QD . . 3.850 3.173 2.409 3.618 . 0 0 "[ . 1 . 2]" 1
542 1 35 VAL HB 1 36 LEU MD2 . . 4.800 3.291 2.415 3.839 . 0 0 "[ . 1 . 2]" 1
543 1 35 VAL HB 1 36 LEU HG . . 5.500 3.609 2.943 5.075 . 0 0 "[ . 1 . 2]" 1
544 1 35 VAL HB 1 48 PHE QE . . 5.500 5.319 4.180 5.560 0.060 12 0 "[ . 1 . 2]" 1
545 1 35 VAL QG 1 36 LEU H . . 4.220 2.545 2.420 2.630 . 0 0 "[ . 1 . 2]" 1
546 1 35 VAL QG 1 36 LEU HA . . 4.590 3.022 2.897 3.155 . 0 0 "[ . 1 . 2]" 1
547 1 35 VAL QG 1 36 LEU HB2 . . 4.670 4.366 4.153 4.505 . 0 0 "[ . 1 . 2]" 1
548 1 35 VAL QG 1 36 LEU HB3 . . 4.840 4.619 4.417 4.813 . 0 0 "[ . 1 . 2]" 1
549 1 35 VAL QG 1 36 LEU MD1 . . 4.130 3.999 3.485 4.215 0.085 12 0 "[ . 1 . 2]" 1
550 1 35 VAL QG 1 36 LEU QD . . 3.410 2.357 1.910 2.768 . 0 0 "[ . 1 . 2]" 1
551 1 35 VAL QG 1 36 LEU MD2 . . 4.130 2.377 1.917 2.807 . 0 0 "[ . 1 . 2]" 1
552 1 35 VAL QG 1 36 LEU HG . . 4.480 3.555 3.079 4.540 0.060 7 0 "[ . 1 . 2]" 1
553 1 35 VAL QG 1 38 LEU MD1 . . 4.510 3.263 3.074 3.455 . 0 0 "[ . 1 . 2]" 1
554 1 35 VAL QG 1 38 LEU MD2 . . 4.200 3.440 3.299 3.514 . 0 0 "[ . 1 . 2]" 1
555 1 35 VAL QG 1 39 VAL HB . . 5.500 4.098 3.970 4.252 . 0 0 "[ . 1 . 2]" 1
556 1 35 VAL QG 1 39 VAL QG . . 3.650 2.490 2.349 2.629 . 0 0 "[ . 1 . 2]" 1
557 1 35 VAL QG 1 48 PHE QD . . 4.210 3.447 3.287 3.545 . 0 0 "[ . 1 . 2]" 1
558 1 35 VAL QG 1 48 PHE QE . . 3.960 2.680 1.913 2.860 . 0 0 "[ . 1 . 2]" 1
559 1 35 VAL QG 1 52 LEU HG . . 4.850 4.917 4.863 4.995 0.145 12 0 "[ . 1 . 2]" 1
560 1 35 VAL QG 1 75 LEU QD . . 3.120 2.475 1.985 2.961 . 0 0 "[ . 1 . 2]" 1
561 1 35 VAL QG 1 75 LEU HG . . 5.490 3.246 2.866 5.174 . 0 0 "[ . 1 . 2]" 1
562 1 35 VAL QG 1 79 LEU QD . . 3.930 3.447 3.072 3.877 . 0 0 "[ . 1 . 2]" 1
563 1 36 LEU H 1 36 LEU MD1 . . 3.990 3.578 3.415 3.807 . 0 0 "[ . 1 . 2]" 1
564 1 36 LEU H 1 36 LEU MD2 . . 3.990 2.665 1.853 3.119 . 0 0 "[ . 1 . 2]" 1
565 1 36 LEU H 1 39 VAL QG . . 4.380 3.956 3.691 4.179 . 0 0 "[ . 1 . 2]" 1
566 1 36 LEU HA 1 36 LEU MD1 . . 3.920 3.408 2.110 3.952 0.032 14 0 "[ . 1 . 2]" 1
567 1 36 LEU HA 1 36 LEU QD . . 3.060 2.113 1.975 2.360 . 0 0 "[ . 1 . 2]" 1
568 1 36 LEU HA 1 36 LEU MD2 . . 3.920 2.221 1.994 2.379 . 0 0 "[ . 1 . 2]" 1
569 1 36 LEU HA 1 39 VAL H . . 4.410 3.621 3.571 3.698 . 0 0 "[ . 1 . 2]" 1
570 1 36 LEU HA 1 39 VAL HA . . 5.500 5.134 5.078 5.232 . 0 0 "[ . 1 . 2]" 1
571 1 36 LEU HA 1 39 VAL HB . . 3.760 2.290 2.189 2.367 . 0 0 "[ . 1 . 2]" 1
572 1 36 LEU HA 1 39 VAL QG . . 3.410 2.542 2.260 2.776 . 0 0 "[ . 1 . 2]" 1
573 1 36 LEU HA 1 40 ASN H . . 5.050 3.963 3.906 4.042 . 0 0 "[ . 1 . 2]" 1
574 1 36 LEU HA 1 79 LEU QD . . 3.740 2.692 2.267 3.213 . 0 0 "[ . 1 . 2]" 1
575 1 36 LEU HB2 1 36 LEU MD1 . . 3.340 2.515 2.129 3.179 . 0 0 "[ . 1 . 2]" 1
576 1 36 LEU HB2 1 36 LEU MD2 . . 3.340 2.959 2.431 3.185 . 0 0 "[ . 1 . 2]" 1
577 1 36 LEU HB2 1 37 GLY H . . 4.770 2.776 2.707 2.892 . 0 0 "[ . 1 . 2]" 1
578 1 36 LEU HB3 1 37 GLY H . . 4.590 3.800 3.542 3.947 . 0 0 "[ . 1 . 2]" 1
579 1 36 LEU HB3 1 37 GLY HA2 . . 5.000 4.523 4.210 4.720 . 0 0 "[ . 1 . 2]" 1
580 1 36 LEU HB3 1 39 VAL QG . . 4.270 4.151 4.048 4.310 0.040 20 0 "[ . 1 . 2]" 1
581 1 36 LEU HB3 1 79 LEU QD . . 3.990 3.442 2.954 4.026 0.036 17 0 "[ . 1 . 2]" 1
582 1 36 LEU QD 1 37 GLY H . . 5.160 3.993 3.814 4.109 . 0 0 "[ . 1 . 2]" 1
583 1 36 LEU QD 1 39 VAL H . . 5.440 4.956 4.590 5.198 . 0 0 "[ . 1 . 2]" 1
584 1 36 LEU QD 1 39 VAL HB . . 4.350 3.643 3.233 3.947 . 0 0 "[ . 1 . 2]" 1
585 1 36 LEU QD 1 40 ASN QD . . 4.540 3.255 2.273 4.466 . 0 0 "[ . 1 . 2]" 1
586 1 36 LEU QD 1 79 LEU QB . . 4.930 4.339 3.823 4.777 . 0 0 "[ . 1 . 2]" 1
587 1 36 LEU QD 1 79 LEU QD . . 2.930 1.886 1.648 2.269 . 0 0 "[ . 1 . 2]" 1
588 1 36 LEU QD 1 82 ALA MB . . 5.280 3.904 3.135 4.697 . 0 0 "[ . 1 . 2]" 1
589 1 36 LEU HG 1 79 LEU QD . . 4.540 4.115 3.755 4.537 . 0 0 "[ . 1 . 2]" 1
590 1 37 GLY HA2 1 38 LEU HG . . 5.140 5.308 5.244 5.362 0.222 6 0 "[ . 1 . 2]" 1
591 1 37 GLY HA2 1 39 VAL H . . 4.820 4.033 3.998 4.075 . 0 0 "[ . 1 . 2]" 1
592 1 37 GLY HA2 1 39 VAL QG . . 4.880 5.045 5.012 5.087 0.207 14 0 "[ . 1 . 2]" 1
593 1 37 GLY HA2 1 40 ASN H . . 4.920 3.844 3.746 3.903 . 0 0 "[ . 1 . 2]" 1
594 1 37 GLY HA2 1 40 ASN QB . . 5.500 5.400 4.665 5.579 0.079 2 0 "[ . 1 . 2]" 1
595 1 37 GLY HA2 1 40 ASN HD21 . . 5.500 5.029 4.048 5.520 0.020 18 0 "[ . 1 . 2]" 1
596 1 37 GLY HA2 1 40 ASN HD22 . . 5.500 4.535 3.559 5.563 0.063 1 0 "[ . 1 . 2]" 1
597 1 37 GLY HA2 1 41 SER HA . . 4.530 4.389 4.304 4.443 . 0 0 "[ . 1 . 2]" 1
598 1 37 GLY HA2 1 42 THR H . . 5.360 5.114 5.006 5.215 . 0 0 "[ . 1 . 2]" 1
599 1 37 GLY HA2 1 43 LEU H . . 5.500 5.595 5.533 5.645 0.145 20 0 "[ . 1 . 2]" 1
600 1 37 GLY HA2 1 43 LEU HB2 . . 4.220 3.887 3.747 3.994 . 0 0 "[ . 1 . 2]" 1
601 1 37 GLY HA2 1 43 LEU HB3 . . 5.500 5.295 5.134 5.421 . 0 0 "[ . 1 . 2]" 1
602 1 37 GLY HA2 1 43 LEU QD . . 3.880 2.891 2.581 3.432 . 0 0 "[ . 1 . 2]" 1
603 1 37 GLY HA2 1 43 LEU HG . . 5.500 5.372 4.605 5.731 0.231 8 0 "[ . 1 . 2]" 1
604 1 37 GLY HA3 1 38 LEU HG . . 4.670 4.411 4.318 4.477 . 0 0 "[ . 1 . 2]" 1
605 1 37 GLY HA3 1 43 LEU H . . 5.490 5.414 5.318 5.475 . 0 0 "[ . 1 . 2]" 1
606 1 37 GLY HA3 1 43 LEU HB2 . . 4.250 3.054 2.907 3.160 . 0 0 "[ . 1 . 2]" 1
607 1 37 GLY HA3 1 43 LEU HB3 . . 5.260 4.037 3.890 4.152 . 0 0 "[ . 1 . 2]" 1
608 1 37 GLY HA3 1 43 LEU QD . . 4.040 1.948 1.853 2.073 . 0 0 "[ . 1 . 2]" 1
609 1 37 GLY HA3 1 43 LEU HG . . 5.500 4.275 3.609 4.643 . 0 0 "[ . 1 . 2]" 1
610 1 38 LEU H 1 38 LEU HB3 . . 3.750 2.565 2.498 2.636 . 0 0 "[ . 1 . 2]" 1
611 1 38 LEU H 1 38 LEU MD2 . . 3.950 3.212 3.066 3.389 . 0 0 "[ . 1 . 2]" 1
612 1 38 LEU H 1 38 LEU HG . . 4.350 2.110 1.985 2.233 . 0 0 "[ . 1 . 2]" 1
613 1 38 LEU H 1 43 LEU HB3 . . 4.290 2.993 2.764 3.149 . 0 0 "[ . 1 . 2]" 1
614 1 38 LEU H 1 43 LEU QD . . 4.140 2.544 2.122 2.852 . 0 0 "[ . 1 . 2]" 1
615 1 38 LEU HA 1 38 LEU MD1 . . 4.060 3.583 3.529 3.633 . 0 0 "[ . 1 . 2]" 1
616 1 38 LEU HA 1 38 LEU MD2 . . 4.070 4.051 4.023 4.083 0.013 11 0 "[ . 1 . 2]" 1
617 1 38 LEU HA 1 39 VAL HA . . 5.010 4.787 4.774 4.809 . 0 0 "[ . 1 . 2]" 1
618 1 38 LEU HA 1 42 THR HA . . 4.700 4.674 4.556 4.767 0.067 12 0 "[ . 1 . 2]" 1
619 1 38 LEU HA 1 43 LEU HB2 . . 4.630 2.217 2.047 2.512 . 0 0 "[ . 1 . 2]" 1
620 1 38 LEU HA 1 43 LEU HB3 . . 4.010 2.742 2.565 2.908 . 0 0 "[ . 1 . 2]" 1
621 1 38 LEU HA 1 72 LEU QD . . 4.300 3.954 3.715 4.306 0.006 15 0 "[ . 1 . 2]" 1
622 1 38 LEU HB2 1 38 LEU MD1 . . 3.390 2.136 2.074 2.179 . 0 0 "[ . 1 . 2]" 1
623 1 38 LEU HB2 1 38 LEU MD2 . . 3.040 2.577 2.513 2.605 . 0 0 "[ . 1 . 2]" 1
624 1 38 LEU HB2 1 39 VAL H . . 4.680 3.944 3.894 3.986 . 0 0 "[ . 1 . 2]" 1
625 1 38 LEU HB2 1 39 VAL HA . . 4.630 4.540 4.482 4.588 . 0 0 "[ . 1 . 2]" 1
626 1 38 LEU HB2 1 45 ILE QG . . 5.500 4.518 4.067 4.898 . 0 0 "[ . 1 . 2]" 1
627 1 38 LEU HB2 1 72 LEU QD . . 3.350 2.357 2.025 2.741 . 0 0 "[ . 1 . 2]" 1
628 1 38 LEU HB3 1 38 LEU MD1 . . 3.670 3.143 3.128 3.158 . 0 0 "[ . 1 . 2]" 1
629 1 38 LEU HB3 1 43 LEU HB3 . . 4.600 2.286 2.082 2.471 . 0 0 "[ . 1 . 2]" 1
630 1 38 LEU HB3 1 43 LEU QD . . 4.930 3.230 3.057 3.368 . 0 0 "[ . 1 . 2]" 1
631 1 38 LEU HB3 1 45 ILE HA . . 4.750 4.385 4.280 4.533 . 0 0 "[ . 1 . 2]" 1
632 1 38 LEU HB3 1 48 PHE HB3 . . 5.030 3.493 3.224 3.796 . 0 0 "[ . 1 . 2]" 1
633 1 38 LEU HB3 1 72 LEU QD . . 3.800 3.674 3.388 3.874 0.074 15 0 "[ . 1 . 2]" 1
634 1 38 LEU MD1 1 39 VAL H . . 4.050 2.610 2.347 2.841 . 0 0 "[ . 1 . 2]" 1
635 1 38 LEU MD1 1 39 VAL HA . . 3.930 2.651 2.540 2.746 . 0 0 "[ . 1 . 2]" 1
636 1 38 LEU MD1 1 39 VAL QG . . 3.060 1.886 1.813 1.959 . 0 0 "[ . 1 . 2]" 1
637 1 38 LEU MD1 1 45 ILE HA . . 5.140 4.887 4.657 5.161 0.021 19 0 "[ . 1 . 2]" 1
638 1 38 LEU MD1 1 45 ILE MD . . 4.520 3.614 3.320 3.970 . 0 0 "[ . 1 . 2]" 1
639 1 38 LEU MD1 1 45 ILE MG . . 5.500 5.292 5.034 5.575 0.075 14 0 "[ . 1 . 2]" 1
640 1 38 LEU MD1 1 48 PHE QD . . 4.730 4.473 4.414 4.604 . 0 0 "[ . 1 . 2]" 1
641 1 38 LEU MD1 1 48 PHE QE . . 5.130 4.846 4.730 4.945 . 0 0 "[ . 1 . 2]" 1
642 1 38 LEU MD1 1 68 LEU QB . . 5.180 3.410 2.604 4.829 . 0 0 "[ . 1 . 2]" 1
643 1 38 LEU MD1 1 72 LEU QD . . 3.750 1.710 1.612 1.876 . 0 0 "[ . 1 . 2]" 1
644 1 38 LEU MD1 1 75 LEU QB . . 4.230 3.338 2.749 3.625 . 0 0 "[ . 1 . 2]" 1
645 1 38 LEU MD2 1 39 VAL QG . . 4.220 3.934 3.875 3.998 . 0 0 "[ . 1 . 2]" 1
646 1 38 LEU MD2 1 43 LEU HB2 . . 5.170 4.669 4.541 4.845 . 0 0 "[ . 1 . 2]" 1
647 1 38 LEU MD2 1 43 LEU HB3 . . 4.200 3.728 3.648 3.809 . 0 0 "[ . 1 . 2]" 1
648 1 38 LEU MD2 1 45 ILE HA . . 3.650 3.079 2.775 3.299 . 0 0 "[ . 1 . 2]" 1
649 1 38 LEU MD2 1 45 ILE HB . . 5.500 5.549 5.026 5.693 0.193 5 0 "[ . 1 . 2]" 1
650 1 38 LEU MD2 1 45 ILE MD . . 3.270 3.145 2.798 3.336 0.066 14 0 "[ . 1 . 2]" 1
651 1 38 LEU MD2 1 45 ILE QG . . 4.260 4.047 2.951 4.320 0.060 3 0 "[ . 1 . 2]" 1
652 1 38 LEU MD2 1 48 PHE H . . 4.500 4.087 3.821 4.308 . 0 0 "[ . 1 . 2]" 1
653 1 38 LEU MD2 1 48 PHE HA . . 4.180 3.910 3.717 4.152 . 0 0 "[ . 1 . 2]" 1
654 1 38 LEU MD2 1 48 PHE HB2 . . 3.790 1.989 1.871 2.250 . 0 0 "[ . 1 . 2]" 1
655 1 38 LEU MD2 1 48 PHE HB3 . . 4.050 2.376 2.134 2.589 . 0 0 "[ . 1 . 2]" 1
656 1 38 LEU MD2 1 48 PHE QD . . 3.650 2.279 2.162 2.394 . 0 0 "[ . 1 . 2]" 1
657 1 38 LEU MD2 1 48 PHE QE . . 4.130 3.245 2.955 3.414 . 0 0 "[ . 1 . 2]" 1
658 1 38 LEU MD2 1 68 LEU HB2 . . 4.950 3.858 3.204 4.666 . 0 0 "[ . 1 . 2]" 1
659 1 38 LEU MD2 1 68 LEU QB . . 4.120 3.145 2.702 3.700 . 0 0 "[ . 1 . 2]" 1
660 1 38 LEU MD2 1 68 LEU HB3 . . 4.950 3.337 2.817 3.894 . 0 0 "[ . 1 . 2]" 1
661 1 38 LEU MD2 1 68 LEU QD . . 3.240 2.319 1.801 3.217 . 0 0 "[ . 1 . 2]" 1
662 1 38 LEU MD2 1 72 LEU QD . . 3.540 2.801 2.010 3.378 . 0 0 "[ . 1 . 2]" 1
663 1 38 LEU HG 1 39 VAL HA . . 5.350 4.545 4.403 4.729 . 0 0 "[ . 1 . 2]" 1
664 1 38 LEU HG 1 39 VAL HB . . 5.500 4.576 4.426 4.779 . 0 0 "[ . 1 . 2]" 1
665 1 38 LEU HG 1 39 VAL QG . . 3.250 3.241 3.025 3.417 0.167 13 0 "[ . 1 . 2]" 1
666 1 39 VAL H 1 39 VAL HB . . 3.890 2.339 2.255 2.428 . 0 0 "[ . 1 . 2]" 1
667 1 39 VAL H 1 39 VAL QG . . 3.180 2.493 2.365 2.588 . 0 0 "[ . 1 . 2]" 1
668 1 39 VAL H 1 72 LEU QD . . 5.050 4.049 3.624 4.447 . 0 0 "[ . 1 . 2]" 1
669 1 39 VAL HA 1 39 VAL QG . . 3.190 2.076 2.027 2.126 . 0 0 "[ . 1 . 2]" 1
670 1 39 VAL HA 1 72 LEU QD . . 3.990 2.727 2.132 3.394 . 0 0 "[ . 1 . 2]" 1
671 1 39 VAL HA 1 76 GLN HA . . 5.010 3.994 3.475 4.609 . 0 0 "[ . 1 . 2]" 1
672 1 39 VAL HA 1 76 GLN HG2 . . 5.500 4.848 4.360 5.209 . 0 0 "[ . 1 . 2]" 1
673 1 39 VAL HB 1 40 ASN H . . 4.440 2.340 2.246 2.446 . 0 0 "[ . 1 . 2]" 1
674 1 39 VAL HB 1 79 LEU QD . . 3.430 2.945 2.586 3.424 . 0 0 "[ . 1 . 2]" 1
675 1 39 VAL QG 1 40 ASN H . . 3.870 2.658 2.443 2.830 . 0 0 "[ . 1 . 2]" 1
676 1 39 VAL QG 1 40 ASN HA . . 4.350 3.402 3.278 3.540 . 0 0 "[ . 1 . 2]" 1
677 1 39 VAL QG 1 40 ASN QB . . 4.560 2.827 2.518 3.571 . 0 0 "[ . 1 . 2]" 1
678 1 39 VAL QG 1 40 ASN QD . . 4.540 2.549 1.891 4.353 . 0 0 "[ . 1 . 2]" 1
679 1 39 VAL QG 1 41 SER H . . 4.730 4.247 4.071 4.380 . 0 0 "[ . 1 . 2]" 1
680 1 39 VAL QG 1 75 LEU QB . . 4.310 2.191 1.903 2.488 . 0 0 "[ . 1 . 2]" 1
681 1 39 VAL QG 1 76 GLN HA . . 3.310 1.896 1.828 2.142 . 0 0 "[ . 1 . 2]" 1
682 1 39 VAL QG 1 76 GLN HB2 . . 4.330 2.762 2.347 3.207 . 0 0 "[ . 1 . 2]" 1
683 1 39 VAL QG 1 76 GLN QB . . 3.610 2.242 2.043 2.464 . 0 0 "[ . 1 . 2]" 1
684 1 39 VAL QG 1 76 GLN HB3 . . 4.330 2.419 2.093 2.699 . 0 0 "[ . 1 . 2]" 1
685 1 39 VAL QG 1 76 GLN HG2 . . 4.690 4.157 3.887 4.440 . 0 0 "[ . 1 . 2]" 1
686 1 39 VAL QG 1 76 GLN HG3 . . 4.140 4.210 4.065 4.335 0.195 20 0 "[ . 1 . 2]" 1
687 1 40 ASN H 1 79 LEU QD . . 5.040 4.135 3.511 4.638 . 0 0 "[ . 1 . 2]" 1
688 1 40 ASN HA 1 79 LEU QD . . 5.440 5.042 3.945 5.508 0.068 12 0 "[ . 1 . 2]" 1
689 1 40 ASN QB 1 79 LEU QD . . 4.670 3.533 2.495 4.112 . 0 0 "[ . 1 . 2]" 1
690 1 40 ASN QB 1 91 ALA HA . . 5.500 3.855 2.718 5.196 . 0 0 "[ . 1 . 2]" 1
691 1 40 ASN QB 1 91 ALA MB . . 4.870 4.094 3.010 4.882 0.012 2 0 "[ . 1 . 2]" 1
692 1 40 ASN QD 1 79 LEU QD . . 4.900 2.736 1.818 4.351 . 0 0 "[ . 1 . 2]" 1
693 1 40 ASN QD 1 91 ALA HA . . 5.340 4.880 3.877 5.369 0.029 17 0 "[ . 1 . 2]" 1
694 1 41 SER HA 1 43 LEU H . . 5.370 5.273 5.155 5.406 0.036 20 0 "[ . 1 . 2]" 1
695 1 41 SER QB 1 43 LEU HB2 . . 5.190 3.492 3.339 4.496 . 0 0 "[ . 1 . 2]" 1
696 1 42 THR H 1 42 THR HB . . 3.900 2.423 2.361 2.468 . 0 0 "[ . 1 . 2]" 1
697 1 42 THR H 1 42 THR MG . . 3.930 3.752 3.725 3.766 . 0 0 "[ . 1 . 2]" 1
698 1 42 THR H 1 43 LEU HB2 . . 5.330 4.917 4.814 4.997 . 0 0 "[ . 1 . 2]" 1
699 1 42 THR H 1 43 LEU QD . . 5.470 4.114 3.521 5.158 . 0 0 "[ . 1 . 2]" 1
700 1 42 THR HA 1 42 THR MG . . 2.680 2.425 2.343 2.481 . 0 0 "[ . 1 . 2]" 1
701 1 42 THR HA 1 43 LEU HB2 . . 5.100 4.486 4.395 4.561 . 0 0 "[ . 1 . 2]" 1
702 1 42 THR HA 1 43 LEU HB3 . . 5.500 5.682 5.582 5.753 0.253 9 0 "[ . 1 . 2]" 1
703 1 42 THR HA 1 43 LEU HG . . 5.500 5.541 5.241 5.745 0.245 1 0 "[ . 1 . 2]" 1
704 1 42 THR HB 1 43 LEU H . . 4.700 4.507 4.489 4.527 . 0 0 "[ . 1 . 2]" 1
705 1 42 THR MG 1 43 LEU H . . 3.550 3.424 3.297 3.508 . 0 0 "[ . 1 . 2]" 1
706 1 42 THR MG 1 43 LEU QD . . 4.120 4.243 4.126 4.450 0.330 20 0 "[ . 1 . 2]" 1
707 1 42 THR MG 1 44 THR H . . 5.410 4.703 4.316 5.110 . 0 0 "[ . 1 . 2]" 1
708 1 43 LEU H 1 43 LEU HB3 . . 4.140 3.588 3.493 3.647 . 0 0 "[ . 1 . 2]" 1
709 1 43 LEU H 1 43 LEU QD . . 3.950 3.665 3.384 4.032 0.082 20 0 "[ . 1 . 2]" 1
710 1 43 LEU HA 1 43 LEU QD . . 3.150 2.630 1.940 2.964 . 0 0 "[ . 1 . 2]" 1
711 1 43 LEU HA 1 44 THR HA . . 4.580 4.386 4.374 4.415 . 0 0 "[ . 1 . 2]" 1
712 1 43 LEU HA 1 47 GLU HG2 . . 4.340 3.839 3.633 3.985 . 0 0 "[ . 1 . 2]" 1
713 1 43 LEU HA 1 47 GLU HG3 . . 5.490 5.356 5.010 5.521 0.031 1 0 "[ . 1 . 2]" 1
714 1 43 LEU HB2 1 43 LEU QD . . 2.650 2.033 1.893 2.281 . 0 0 "[ . 1 . 2]" 1
715 1 43 LEU HB2 1 44 THR H . . 4.670 4.330 4.065 4.499 . 0 0 "[ . 1 . 2]" 1
716 1 43 LEU HB2 1 47 GLU HB3 . . 5.500 5.599 5.464 5.742 0.242 11 0 "[ . 1 . 2]" 1
717 1 43 LEU HB2 1 48 PHE HB2 . . 5.460 5.104 4.660 5.314 . 0 0 "[ . 1 . 2]" 1
718 1 43 LEU HB3 1 47 GLU HB3 . . 4.500 4.153 3.944 4.395 . 0 0 "[ . 1 . 2]" 1
719 1 43 LEU HB3 1 47 GLU HG2 . . 4.700 4.457 4.147 4.866 0.166 11 0 "[ . 1 . 2]" 1
720 1 43 LEU HB3 1 47 GLU HG3 . . 5.220 5.298 5.256 5.335 0.115 19 0 "[ . 1 . 2]" 1
721 1 43 LEU HB3 1 48 PHE HA . . 5.070 4.713 4.273 5.000 . 0 0 "[ . 1 . 2]" 1
722 1 43 LEU HB3 1 48 PHE HB2 . . 5.160 3.659 3.153 3.925 . 0 0 "[ . 1 . 2]" 1
723 1 43 LEU HB3 1 48 PHE HB3 . . 5.500 4.180 3.723 4.482 . 0 0 "[ . 1 . 2]" 1
724 1 43 LEU QD 1 44 THR H . . 3.900 3.247 2.635 3.638 . 0 0 "[ . 1 . 2]" 1
725 1 43 LEU QD 1 44 THR HA . . 5.500 4.967 4.583 5.206 . 0 0 "[ . 1 . 2]" 1
726 1 43 LEU QD 1 47 GLU HB2 . . 4.220 3.972 3.389 4.298 0.078 12 0 "[ . 1 . 2]" 1
727 1 43 LEU QD 1 47 GLU HB3 . . 3.150 2.824 2.157 3.157 0.007 18 0 "[ . 1 . 2]" 1
728 1 43 LEU QD 1 47 GLU HG2 . . 4.000 2.151 1.832 2.591 . 0 0 "[ . 1 . 2]" 1
729 1 43 LEU QD 1 47 GLU HG3 . . 3.410 2.726 2.269 3.060 . 0 0 "[ . 1 . 2]" 1
730 1 43 LEU QD 1 48 PHE H . . 4.260 3.397 2.892 3.763 . 0 0 "[ . 1 . 2]" 1
731 1 43 LEU QD 1 48 PHE HA . . 3.940 2.949 2.517 3.115 . 0 0 "[ . 1 . 2]" 1
732 1 43 LEU QD 1 48 PHE HB2 . . 3.700 2.965 2.720 3.108 . 0 0 "[ . 1 . 2]" 1
733 1 43 LEU QD 1 48 PHE HB3 . . 4.810 3.765 3.558 4.055 . 0 0 "[ . 1 . 2]" 1
734 1 43 LEU QD 1 48 PHE QD . . 4.490 4.110 3.618 4.418 . 0 0 "[ . 1 . 2]" 1
735 1 43 LEU QD 1 51 LYS QE . . 3.350 2.925 2.284 3.365 0.015 10 0 "[ . 1 . 2]" 1
736 1 43 LEU HG 1 47 GLU HG2 . . 5.500 3.268 2.742 4.370 . 0 0 "[ . 1 . 2]" 1
737 1 43 LEU HG 1 47 GLU HG3 . . 5.500 4.621 4.269 5.423 . 0 0 "[ . 1 . 2]" 1
738 1 43 LEU HG 1 48 PHE HA . . 5.500 5.692 5.603 5.845 0.345 11 0 "[ . 1 . 2]" 1
739 1 44 THR H 1 44 THR MG . . 3.740 1.973 1.892 2.133 . 0 0 "[ . 1 . 2]" 1
740 1 44 THR H 1 47 GLU HG2 . . 4.650 3.721 3.531 3.956 . 0 0 "[ . 1 . 2]" 1
741 1 44 THR H 1 47 GLU HG3 . . 5.080 4.871 4.697 5.044 . 0 0 "[ . 1 . 2]" 1
742 1 44 THR HA 1 44 THR MG . . 3.610 3.190 3.189 3.195 . 0 0 "[ . 1 . 2]" 1
743 1 44 THR HA 1 45 ILE HA . . 5.490 4.299 4.295 4.308 . 0 0 "[ . 1 . 2]" 1
744 1 44 THR HA 1 45 ILE HB . . 5.170 4.906 4.705 5.012 . 0 0 "[ . 1 . 2]" 1
745 1 44 THR HA 1 45 ILE MD . . 5.490 4.670 3.210 5.183 . 0 0 "[ . 1 . 2]" 1
746 1 44 THR HA 1 45 ILE QG . . 5.160 3.845 3.623 4.985 . 0 0 "[ . 1 . 2]" 1
747 1 44 THR HA 1 45 ILE MG . . 5.500 5.551 5.505 5.572 0.072 14 0 "[ . 1 . 2]" 1
748 1 44 THR MG 1 45 ILE H . . 4.140 3.673 3.538 3.784 . 0 0 "[ . 1 . 2]" 1
749 1 44 THR MG 1 45 ILE HB . . 4.940 4.768 4.591 4.949 0.009 19 0 "[ . 1 . 2]" 1
750 1 44 THR MG 1 46 GLU H . . 4.950 2.907 2.488 3.059 . 0 0 "[ . 1 . 2]" 1
751 1 44 THR MG 1 46 GLU HA . . 4.480 4.379 4.139 4.487 0.007 7 0 "[ . 1 . 2]" 1
752 1 44 THR MG 1 46 GLU QB . . 5.260 2.266 1.982 2.523 . 0 0 "[ . 1 . 2]" 1
753 1 44 THR MG 1 47 GLU H . . 5.460 1.893 1.825 2.158 . 0 0 "[ . 1 . 2]" 1
754 1 44 THR MG 1 47 GLU HA . . 4.850 3.739 3.648 3.993 . 0 0 "[ . 1 . 2]" 1
755 1 44 THR MG 1 47 GLU HB2 . . 4.780 2.320 2.167 2.790 . 0 0 "[ . 1 . 2]" 1
756 1 44 THR MG 1 47 GLU HB3 . . 5.030 2.022 1.939 2.365 . 0 0 "[ . 1 . 2]" 1
757 1 44 THR MG 1 47 GLU HG2 . . 5.400 3.754 3.544 4.206 . 0 0 "[ . 1 . 2]" 1
758 1 44 THR MG 1 47 GLU HG3 . . 5.500 4.345 4.188 4.718 . 0 0 "[ . 1 . 2]" 1
759 1 45 ILE H 1 45 ILE HB . . 3.690 2.614 2.363 2.723 . 0 0 "[ . 1 . 2]" 1
760 1 45 ILE H 1 45 ILE MD . . 3.920 3.280 1.870 3.672 . 0 0 "[ . 1 . 2]" 1
761 1 45 ILE H 1 45 ILE QG . . 4.310 2.105 1.877 3.280 . 0 0 "[ . 1 . 2]" 1
762 1 45 ILE H 1 45 ILE MG . . 4.350 3.760 3.721 3.768 . 0 0 "[ . 1 . 2]" 1
763 1 45 ILE H 1 72 LEU QD . . 5.450 4.250 3.717 5.108 . 0 0 "[ . 1 . 2]" 1
764 1 45 ILE HA 1 45 ILE MD . . 3.330 2.517 2.167 3.042 . 0 0 "[ . 1 . 2]" 1
765 1 45 ILE HA 1 45 ILE QG . . 3.920 2.597 2.190 2.779 . 0 0 "[ . 1 . 2]" 1
766 1 45 ILE HA 1 45 ILE MG . . 3.610 2.351 2.288 2.522 . 0 0 "[ . 1 . 2]" 1
767 1 45 ILE HA 1 48 PHE HB2 . . 4.710 4.087 3.862 4.348 . 0 0 "[ . 1 . 2]" 1
768 1 45 ILE HA 1 48 PHE QD . . 4.470 2.561 2.000 3.453 . 0 0 "[ . 1 . 2]" 1
769 1 45 ILE HA 1 49 HIS H . . 4.860 4.259 3.861 4.477 . 0 0 "[ . 1 . 2]" 1
770 1 45 ILE HA 1 65 ILE MG . . 5.440 4.975 4.577 5.466 0.026 20 0 "[ . 1 . 2]" 1
771 1 45 ILE HA 1 68 LEU QB . . 5.340 4.317 3.960 4.994 . 0 0 "[ . 1 . 2]" 1
772 1 45 ILE HB 1 45 ILE MD . . 3.310 3.016 2.176 3.213 . 0 0 "[ . 1 . 2]" 1
773 1 45 ILE HB 1 46 GLU H . . 4.090 2.457 2.287 2.822 . 0 0 "[ . 1 . 2]" 1
774 1 45 ILE HB 1 69 LYS QE . . 5.430 4.373 1.922 5.264 . 0 0 "[ . 1 . 2]" 1
775 1 45 ILE HB 1 69 LYS QG . . 5.310 3.332 2.551 3.957 . 0 0 "[ . 1 . 2]" 1
776 1 45 ILE MD 1 45 ILE MG . . 2.800 2.046 1.723 3.233 0.433 14 0 "[ . 1 . 2]" 1
777 1 45 ILE MD 1 46 GLU H . . 4.900 4.664 3.924 4.989 0.089 19 0 "[ . 1 . 2]" 1
778 1 45 ILE MD 1 48 PHE HB3 . . 5.120 4.247 3.858 4.704 . 0 0 "[ . 1 . 2]" 1
779 1 45 ILE MD 1 48 PHE QE . . 5.100 4.207 3.670 5.159 0.059 14 0 "[ . 1 . 2]" 1
780 1 45 ILE MD 1 68 LEU HB2 . . 3.880 3.351 2.595 4.037 0.157 14 0 "[ . 1 . 2]" 1
781 1 45 ILE MD 1 68 LEU QB . . 3.120 2.481 2.095 3.156 0.036 8 0 "[ . 1 . 2]" 1
782 1 45 ILE MD 1 68 LEU HB3 . . 3.880 2.604 2.121 3.299 . 0 0 "[ . 1 . 2]" 1
783 1 45 ILE MD 1 69 LYS H . . 3.840 2.954 2.472 3.833 . 0 0 "[ . 1 . 2]" 1
784 1 45 ILE MD 1 69 LYS HA . . 3.130 1.915 1.845 2.095 . 0 0 "[ . 1 . 2]" 1
785 1 45 ILE MD 1 69 LYS HB2 . . 4.440 3.684 2.977 4.527 0.087 14 0 "[ . 1 . 2]" 1
786 1 45 ILE MD 1 69 LYS HB3 . . 5.030 4.014 3.691 4.553 . 0 0 "[ . 1 . 2]" 1
787 1 45 ILE MD 1 69 LYS QD . . 3.650 3.012 2.005 3.845 0.195 18 0 "[ . 1 . 2]" 1
788 1 45 ILE MD 1 69 LYS QE . . 4.210 3.997 1.843 4.537 0.327 2 0 "[ . 1 . 2]" 1
789 1 45 ILE MD 1 69 LYS QG . . 3.910 2.420 1.883 3.538 . 0 0 "[ . 1 . 2]" 1
790 1 45 ILE MD 1 70 ALA H . . 5.020 4.473 4.274 4.863 . 0 0 "[ . 1 . 2]" 1
791 1 45 ILE MD 1 70 ALA HA . . 5.380 5.519 5.290 5.681 0.301 15 0 "[ . 1 . 2]" 1
792 1 45 ILE MD 1 72 LEU QB . . 4.120 2.979 1.836 3.301 . 0 0 "[ . 1 . 2]" 1
793 1 45 ILE MD 1 73 PRO HD3 . . 5.500 5.435 4.673 5.682 0.182 17 0 "[ . 1 . 2]" 1
794 1 45 ILE QG 1 68 LEU QB . . 5.340 4.051 2.371 5.084 . 0 0 "[ . 1 . 2]" 1
795 1 45 ILE QG 1 69 LYS HA . . 3.690 2.829 2.043 3.429 . 0 0 "[ . 1 . 2]" 1
796 1 45 ILE QG 1 69 LYS QD . . 3.430 2.539 1.890 3.748 0.318 14 0 "[ . 1 . 2]" 1
797 1 45 ILE QG 1 69 LYS QE . . 4.320 3.732 1.883 4.569 0.249 8 0 "[ . 1 . 2]" 1
798 1 45 ILE QG 1 72 LEU QD . . 3.940 3.012 2.528 4.000 0.060 7 0 "[ . 1 . 2]" 1
799 1 45 ILE MG 1 46 GLU H . . 4.650 3.306 3.032 3.653 . 0 0 "[ . 1 . 2]" 1
800 1 45 ILE MG 1 46 GLU HA . . 3.950 3.399 3.173 3.659 . 0 0 "[ . 1 . 2]" 1
801 1 45 ILE MG 1 46 GLU QB . . 4.570 4.341 3.902 4.575 0.005 19 0 "[ . 1 . 2]" 1
802 1 45 ILE MG 1 46 GLU QG . . 5.320 4.697 3.594 5.218 . 0 0 "[ . 1 . 2]" 1
803 1 45 ILE MG 1 48 PHE QD . . 5.120 2.549 2.271 3.080 . 0 0 "[ . 1 . 2]" 1
804 1 45 ILE MG 1 49 HIS H . . 4.760 4.155 3.661 4.359 . 0 0 "[ . 1 . 2]" 1
805 1 45 ILE MG 1 49 HIS HA . . 5.500 5.043 4.647 5.403 . 0 0 "[ . 1 . 2]" 1
806 1 45 ILE MG 1 49 HIS QB . . 5.010 3.202 2.731 3.770 . 0 0 "[ . 1 . 2]" 1
807 1 45 ILE MG 1 65 ILE H . . 5.500 4.611 4.160 5.482 . 0 0 "[ . 1 . 2]" 1
808 1 45 ILE MG 1 65 ILE HB . . 5.280 4.088 3.691 4.837 . 0 0 "[ . 1 . 2]" 1
809 1 45 ILE MG 1 65 ILE MD . . 4.330 2.430 1.808 4.038 . 0 0 "[ . 1 . 2]" 1
810 1 45 ILE MG 1 65 ILE QG . . 4.740 3.484 2.476 4.444 . 0 0 "[ . 1 . 2]" 1
811 1 45 ILE MG 1 65 ILE MG . . 3.060 1.949 1.762 2.326 . 0 0 "[ . 1 . 2]" 1
812 1 45 ILE MG 1 68 LEU H . . 5.400 3.946 3.638 4.626 . 0 0 "[ . 1 . 2]" 1
813 1 45 ILE MG 1 68 LEU HB2 . . 4.270 3.647 3.125 4.276 0.006 18 0 "[ . 1 . 2]" 1
814 1 45 ILE MG 1 68 LEU QB . . 3.700 3.227 2.753 3.638 . 0 0 "[ . 1 . 2]" 1
815 1 45 ILE MG 1 68 LEU HB3 . . 4.270 3.799 2.825 4.378 0.108 14 0 "[ . 1 . 2]" 1
816 1 45 ILE MG 1 69 LYS H . . 5.500 3.377 3.116 3.701 . 0 0 "[ . 1 . 2]" 1
817 1 45 ILE MG 1 69 LYS HA . . 4.200 3.401 2.450 3.828 . 0 0 "[ . 1 . 2]" 1
818 1 45 ILE MG 1 69 LYS QD . . 3.950 3.198 2.157 4.022 0.072 3 0 "[ . 1 . 2]" 1
819 1 45 ILE MG 1 69 LYS QE . . 4.110 3.869 2.690 4.284 0.174 4 0 "[ . 1 . 2]" 1
820 1 45 ILE MG 1 69 LYS QG . . 4.310 1.958 1.828 2.481 . 0 0 "[ . 1 . 2]" 1
821 1 45 ILE MG 1 70 ALA H . . 5.500 5.533 5.002 5.685 0.185 6 0 "[ . 1 . 2]" 1
822 1 46 GLU H 1 46 GLU HB2 . . 4.170 2.320 2.078 2.582 . 0 0 "[ . 1 . 2]" 1
823 1 46 GLU H 1 46 GLU HB3 . . 4.170 2.902 2.473 3.494 . 0 0 "[ . 1 . 2]" 1
824 1 46 GLU H 1 46 GLU QG . . 4.410 3.654 2.849 3.970 . 0 0 "[ . 1 . 2]" 1
825 1 46 GLU HA 1 46 GLU QG . . 3.920 2.373 2.148 2.544 . 0 0 "[ . 1 . 2]" 1
826 1 46 GLU HA 1 47 GLU HA . . 4.840 4.758 4.639 4.815 . 0 0 "[ . 1 . 2]" 1
827 1 46 GLU HA 1 49 HIS H . . 4.260 3.645 3.454 4.003 . 0 0 "[ . 1 . 2]" 1
828 1 46 GLU HA 1 49 HIS HB2 . . 4.550 4.115 2.847 4.434 . 0 0 "[ . 1 . 2]" 1
829 1 46 GLU HA 1 49 HIS QB . . 3.720 2.800 2.535 3.085 . 0 0 "[ . 1 . 2]" 1
830 1 46 GLU HA 1 49 HIS HB3 . . 4.550 2.926 2.559 4.418 . 0 0 "[ . 1 . 2]" 1
831 1 46 GLU HA 1 65 ILE MD . . 4.420 2.701 1.872 4.432 0.012 10 0 "[ . 1 . 2]" 1
832 1 46 GLU HA 1 65 ILE QG . . 4.530 3.993 2.586 4.566 0.036 12 0 "[ . 1 . 2]" 1
833 1 46 GLU QB 1 47 GLU H . . 3.640 2.428 2.064 2.860 . 0 0 "[ . 1 . 2]" 1
834 1 46 GLU QB 1 47 GLU HB2 . . 4.230 4.058 3.939 4.204 . 0 0 "[ . 1 . 2]" 1
835 1 46 GLU QB 1 65 ILE MD . . 5.150 4.079 3.264 5.213 0.063 8 0 "[ . 1 . 2]" 1
836 1 46 GLU QG 1 47 GLU H . . 5.150 3.829 3.058 4.443 . 0 0 "[ . 1 . 2]" 1
837 1 46 GLU QG 1 65 ILE MD . . 5.020 3.501 2.574 4.951 . 0 0 "[ . 1 . 2]" 1
838 1 46 GLU QG 1 65 ILE QG . . 5.270 4.392 2.897 5.018 . 0 0 "[ . 1 . 2]" 1
839 1 46 GLU QG 1 65 ILE MG . . 5.230 4.458 3.123 5.238 0.008 8 0 "[ . 1 . 2]" 1
840 1 47 GLU H 1 47 GLU HB2 . . 4.060 2.627 2.517 2.876 . 0 0 "[ . 1 . 2]" 1
841 1 47 GLU H 1 47 GLU HB3 . . 3.910 2.452 2.374 2.537 . 0 0 "[ . 1 . 2]" 1
842 1 47 GLU HA 1 47 GLU HG2 . . 3.980 3.838 3.815 3.864 . 0 0 "[ . 1 . 2]" 1
843 1 47 GLU HA 1 47 GLU HG3 . . 3.550 2.810 2.705 2.961 . 0 0 "[ . 1 . 2]" 1
844 1 47 GLU HA 1 48 PHE HA . . 5.040 4.793 4.745 4.858 . 0 0 "[ . 1 . 2]" 1
845 1 47 GLU HA 1 49 HIS QB . . 5.340 5.007 4.711 5.351 0.011 4 0 "[ . 1 . 2]" 1
846 1 47 GLU HA 1 50 SER H . . 4.020 3.204 3.076 3.345 . 0 0 "[ . 1 . 2]" 1
847 1 47 GLU HA 1 50 SER QB . . 3.180 2.405 2.119 2.609 . 0 0 "[ . 1 . 2]" 1
848 1 47 GLU HA 1 51 LYS QE . . 4.920 4.291 3.645 5.036 0.116 18 0 "[ . 1 . 2]" 1
849 1 47 GLU HB2 1 50 SER QB . . 4.610 4.539 4.295 4.679 0.069 18 0 "[ . 1 . 2]" 1
850 1 47 GLU HB3 1 50 SER QB . . 5.010 5.001 4.754 5.113 0.103 9 0 "[ . 1 . 2]" 1
851 1 47 GLU HB3 1 51 LYS QE . . 5.150 4.530 4.260 5.177 0.027 18 0 "[ . 1 . 2]" 1
852 1 47 GLU HG2 1 48 PHE H . . 4.900 4.209 4.039 4.333 . 0 0 "[ . 1 . 2]" 1
853 1 47 GLU HG2 1 48 PHE HA . . 4.940 4.627 4.466 4.768 . 0 0 "[ . 1 . 2]" 1
854 1 47 GLU HG2 1 48 PHE HB2 . . 5.500 5.629 5.458 5.822 0.322 19 0 "[ . 1 . 2]" 1
855 1 47 GLU HG2 1 50 SER QB . . 5.500 5.247 4.923 5.505 0.005 4 0 "[ . 1 . 2]" 1
856 1 47 GLU HG2 1 51 LYS QE . . 5.260 3.101 2.720 3.834 . 0 0 "[ . 1 . 2]" 1
857 1 47 GLU HG3 1 48 PHE H . . 4.700 3.710 3.351 3.910 . 0 0 "[ . 1 . 2]" 1
858 1 47 GLU HG3 1 48 PHE HA . . 4.570 3.664 3.430 3.830 . 0 0 "[ . 1 . 2]" 1
859 1 47 GLU HG3 1 48 PHE HB2 . . 5.500 5.266 5.074 5.473 . 0 0 "[ . 1 . 2]" 1
860 1 47 GLU HG3 1 50 SER QB . . 5.500 3.786 3.503 4.060 . 0 0 "[ . 1 . 2]" 1
861 1 47 GLU HG3 1 51 LYS QE . . 4.150 2.208 1.961 2.875 . 0 0 "[ . 1 . 2]" 1
862 1 48 PHE HA 1 48 PHE QD . . 3.740 3.274 3.170 3.445 . 0 0 "[ . 1 . 2]" 1
863 1 48 PHE HA 1 48 PHE QE . . 5.410 5.163 4.993 5.298 . 0 0 "[ . 1 . 2]" 1
864 1 48 PHE HA 1 49 HIS HA . . 4.970 4.656 4.639 4.738 . 0 0 "[ . 1 . 2]" 1
865 1 48 PHE HA 1 51 LYS H . . 4.970 3.967 3.636 4.459 . 0 0 "[ . 1 . 2]" 1
866 1 48 PHE HA 1 51 LYS HB2 . . 4.380 3.621 3.221 4.047 . 0 0 "[ . 1 . 2]" 1
867 1 48 PHE HA 1 52 LEU H . . 5.460 4.307 4.010 4.645 . 0 0 "[ . 1 . 2]" 1
868 1 48 PHE HB2 1 49 HIS H . . 4.680 4.335 4.216 4.408 . 0 0 "[ . 1 . 2]" 1
869 1 48 PHE HB3 1 49 HIS H . . 4.660 3.306 3.061 3.513 . 0 0 "[ . 1 . 2]" 1
870 1 48 PHE HB3 1 49 HIS HA . . 5.250 5.064 4.836 5.215 . 0 0 "[ . 1 . 2]" 1
871 1 48 PHE HB3 1 68 LEU QD . . 5.440 4.791 3.735 5.516 0.076 5 0 "[ . 1 . 2]" 1
872 1 48 PHE QD 1 49 HIS HA . . 4.650 3.648 3.296 3.897 . 0 0 "[ . 1 . 2]" 1
873 1 48 PHE QD 1 52 LEU QD . . 4.230 3.025 2.715 3.499 . 0 0 "[ . 1 . 2]" 1
874 1 48 PHE QE 1 52 LEU QD . . 3.760 2.167 1.954 2.527 . 0 0 "[ . 1 . 2]" 1
875 1 48 PHE QE 1 64 VAL QG . . 4.220 3.462 2.836 4.245 0.025 11 0 "[ . 1 . 2]" 1
876 1 49 HIS H 1 49 HIS HB2 . . 4.200 2.991 2.280 3.321 . 0 0 "[ . 1 . 2]" 1
877 1 49 HIS H 1 49 HIS QB . . 3.660 2.218 2.148 2.307 . 0 0 "[ . 1 . 2]" 1
878 1 49 HIS H 1 49 HIS HB3 . . 4.200 2.355 2.183 3.555 . 0 0 "[ . 1 . 2]" 1
879 1 49 HIS HA 1 49 HIS HE1 . . 5.500 5.207 4.697 5.807 0.307 6 0 "[ . 1 . 2]" 1
880 1 49 HIS HA 1 52 LEU H . . 5.120 3.491 3.050 4.076 . 0 0 "[ . 1 . 2]" 1
881 1 49 HIS HA 1 52 LEU QB . . 4.410 2.701 2.380 2.911 . 0 0 "[ . 1 . 2]" 1
882 1 49 HIS HA 1 52 LEU QD . . 4.450 3.525 3.141 3.869 . 0 0 "[ . 1 . 2]" 1
883 1 49 HIS HA 1 65 ILE MD . . 5.500 4.343 3.914 5.553 0.053 15 0 "[ . 1 . 2]" 1
884 1 49 HIS HA 1 65 ILE QG . . 5.500 5.448 4.690 5.809 0.309 20 0 "[ . 1 . 2]" 1
885 1 49 HIS QB 1 50 SER H . . 3.880 3.089 2.706 3.253 . 0 0 "[ . 1 . 2]" 1
886 1 49 HIS QB 1 50 SER QB . . 4.820 4.363 4.138 4.594 . 0 0 "[ . 1 . 2]" 1
887 1 49 HIS QB 1 65 ILE HA . . 4.510 3.400 3.210 3.779 . 0 0 "[ . 1 . 2]" 1
888 1 49 HIS QB 1 65 ILE MG . . 4.220 4.196 3.990 4.336 0.116 8 0 "[ . 1 . 2]" 1
889 1 49 HIS HB2 1 50 SER H . . 4.470 4.216 3.327 4.376 . 0 0 "[ . 1 . 2]" 1
890 1 49 HIS HB2 1 65 ILE HA . . 5.200 3.541 3.327 4.193 . 0 0 "[ . 1 . 2]" 1
891 1 49 HIS HB2 1 65 ILE MD . . 4.780 2.423 1.923 3.983 . 0 0 "[ . 1 . 2]" 1
892 1 49 HIS HB2 1 65 ILE QG . . 4.900 3.490 2.539 4.022 . 0 0 "[ . 1 . 2]" 1
893 1 49 HIS HB2 1 65 ILE MG . . 4.900 4.667 4.415 4.893 . 0 0 "[ . 1 . 2]" 1
894 1 49 HIS HB3 1 50 SER H . . 4.470 3.206 2.748 3.924 . 0 0 "[ . 1 . 2]" 1
895 1 49 HIS HB3 1 65 ILE HA . . 5.200 4.448 3.997 4.871 . 0 0 "[ . 1 . 2]" 1
896 1 49 HIS HB3 1 65 ILE MD . . 4.780 2.456 1.977 4.008 . 0 0 "[ . 1 . 2]" 1
897 1 49 HIS HB3 1 65 ILE QG . . 4.900 3.710 2.761 4.207 . 0 0 "[ . 1 . 2]" 1
898 1 49 HIS HB3 1 65 ILE MG . . 4.900 4.772 4.366 5.010 0.110 20 0 "[ . 1 . 2]" 1
899 1 49 HIS HE1 1 61 ARG QG . . 5.490 4.714 3.433 5.540 0.050 4 0 "[ . 1 . 2]" 1
900 1 49 HIS HE1 1 64 VAL HB . . 4.970 3.835 2.209 5.002 0.032 6 0 "[ . 1 . 2]" 1
901 1 49 HIS HE1 1 65 ILE MD . . 5.500 4.487 3.844 5.173 . 0 0 "[ . 1 . 2]" 1
902 1 50 SER HA 1 51 LYS HB2 . . 5.500 5.566 5.521 5.653 0.153 18 0 "[ . 1 . 2]" 1
903 1 50 SER HA 1 53 GLN QG . . 4.980 3.575 2.275 4.997 0.017 8 0 "[ . 1 . 2]" 1
904 1 50 SER HA 1 54 GLU H . . 4.450 4.554 4.502 4.664 0.214 4 0 "[ . 1 . 2]" 1
905 1 50 SER QB 1 51 LYS QE . . 5.030 4.086 3.440 4.661 . 0 0 "[ . 1 . 2]" 1
906 1 51 LYS H 1 51 LYS QE . . 5.150 3.602 2.838 4.204 . 0 0 "[ . 1 . 2]" 1
907 1 51 LYS H 1 51 LYS QG . . 4.850 3.621 3.197 3.866 . 0 0 "[ . 1 . 2]" 1
908 1 51 LYS HA 1 51 LYS QE . . 5.230 4.320 3.641 4.668 . 0 0 "[ . 1 . 2]" 1
909 1 51 LYS HA 1 51 LYS QG . . 3.350 2.137 2.057 2.250 . 0 0 "[ . 1 . 2]" 1
910 1 51 LYS HA 1 54 GLU H . . 4.020 3.581 3.286 3.788 . 0 0 "[ . 1 . 2]" 1
911 1 51 LYS HA 1 54 GLU HG2 . . 3.790 2.183 1.964 2.561 . 0 0 "[ . 1 . 2]" 1
912 1 51 LYS HA 1 54 GLU QG . . 3.120 2.122 1.940 2.485 . 0 0 "[ . 1 . 2]" 1
913 1 51 LYS HA 1 54 GLU HG3 . . 3.790 2.987 2.549 3.497 . 0 0 "[ . 1 . 2]" 1
914 1 52 LEU H 1 52 LEU QD . . 4.370 3.680 3.539 3.750 . 0 0 "[ . 1 . 2]" 1
915 1 52 LEU H 1 52 LEU HG . . 4.450 4.178 3.985 4.381 . 0 0 "[ . 1 . 2]" 1
916 1 52 LEU HA 1 52 LEU QD . . 3.950 2.824 2.615 2.968 . 0 0 "[ . 1 . 2]" 1
917 1 52 LEU HA 1 52 LEU HG . . 3.380 2.262 2.178 2.316 . 0 0 "[ . 1 . 2]" 1
918 1 52 LEU HA 1 55 ALA H . . 4.930 3.256 3.051 3.555 . 0 0 "[ . 1 . 2]" 1
919 1 52 LEU HA 1 55 ALA MB . . 3.780 2.105 1.881 2.443 . 0 0 "[ . 1 . 2]" 1
920 1 52 LEU HA 1 56 THR MG . . 3.680 3.450 2.858 3.739 0.059 14 0 "[ . 1 . 2]" 1
921 1 52 LEU QB 1 53 GLN H . . 4.400 2.590 2.344 3.090 . 0 0 "[ . 1 . 2]" 1
922 1 52 LEU QB 1 56 THR MG . . 4.360 3.855 3.490 4.086 . 0 0 "[ . 1 . 2]" 1
923 1 52 LEU QB 1 64 VAL QG . . 3.870 3.649 3.318 3.958 0.088 17 0 "[ . 1 . 2]" 1
924 1 52 LEU QD 1 53 GLN H . . 4.870 3.713 3.444 4.044 . 0 0 "[ . 1 . 2]" 1
925 1 52 LEU QD 1 55 ALA MB . . 5.080 3.539 3.104 3.971 . 0 0 "[ . 1 . 2]" 1
926 1 52 LEU QD 1 56 THR MG . . 3.330 1.809 1.708 2.043 . 0 0 "[ . 1 . 2]" 1
927 1 52 LEU QD 1 61 ARG QG . . 3.940 3.740 3.465 4.071 0.131 6 0 "[ . 1 . 2]" 1
928 1 52 LEU QD 1 64 VAL HA . . 5.390 5.167 4.322 5.469 0.079 7 0 "[ . 1 . 2]" 1
929 1 52 LEU QD 1 64 VAL QG . . 3.700 3.079 2.838 3.362 . 0 0 "[ . 1 . 2]" 1
930 1 52 LEU HG 1 55 ALA MB . . 4.760 3.507 3.101 3.853 . 0 0 "[ . 1 . 2]" 1
931 1 52 LEU HG 1 56 THR MG . . 3.470 3.073 2.246 3.479 0.009 2 0 "[ . 1 . 2]" 1
932 1 53 GLN HA 1 54 GLU HA . . 4.900 4.631 4.620 4.673 . 0 0 "[ . 1 . 2]" 1
933 1 53 GLN HA 1 56 THR MG . . 4.780 4.248 3.715 4.605 . 0 0 "[ . 1 . 2]" 1
934 1 53 GLN HA 1 61 ARG QG . . 5.270 4.872 4.063 5.426 0.156 14 0 "[ . 1 . 2]" 1
935 1 53 GLN HA 1 64 VAL QG . . 4.810 4.330 3.743 4.807 . 0 0 "[ . 1 . 2]" 1
936 1 53 GLN QG 1 54 GLU HA . . 4.050 3.625 3.235 4.063 0.013 3 0 "[ . 1 . 2]" 1
937 1 54 GLU H 1 54 GLU QB . . 3.440 2.624 2.512 2.767 . 0 0 "[ . 1 . 2]" 1
938 1 54 GLU H 1 54 GLU HG2 . . 4.100 2.398 1.987 3.102 . 0 0 "[ . 1 . 2]" 1
939 1 54 GLU H 1 54 GLU QG . . 3.590 2.187 1.973 2.408 . 0 0 "[ . 1 . 2]" 1
940 1 54 GLU H 1 54 GLU HG3 . . 4.100 2.970 2.475 3.595 . 0 0 "[ . 1 . 2]" 1
941 1 54 GLU H 1 55 ALA MB . . 4.160 3.906 3.777 4.087 . 0 0 "[ . 1 . 2]" 1
942 1 54 GLU HA 1 55 ALA HA . . 5.100 4.614 4.568 4.730 . 0 0 "[ . 1 . 2]" 1
943 1 54 GLU HA 1 55 ALA MB . . 5.270 4.879 4.862 4.939 . 0 0 "[ . 1 . 2]" 1
944 1 54 GLU QB 1 55 ALA H . . 3.950 3.829 3.737 3.843 . 0 0 "[ . 1 . 2]" 1
945 1 54 GLU QG 1 55 ALA H . . 4.080 2.885 2.466 3.008 . 0 0 "[ . 1 . 2]" 1
946 1 54 GLU QG 1 55 ALA MB . . 3.830 3.211 3.052 3.544 . 0 0 "[ . 1 . 2]" 1
947 1 54 GLU HG2 1 55 ALA H . . 4.680 3.659 3.031 4.311 . 0 0 "[ . 1 . 2]" 1
948 1 54 GLU HG2 1 55 ALA MB . . 4.530 4.178 3.524 4.595 0.065 17 0 "[ . 1 . 2]" 1
949 1 54 GLU HG3 1 55 ALA H . . 4.680 3.159 2.490 3.753 . 0 0 "[ . 1 . 2]" 1
950 1 54 GLU HG3 1 55 ALA MB . . 4.530 3.381 3.101 3.775 . 0 0 "[ . 1 . 2]" 1
951 1 55 ALA H 1 55 ALA MB . . 3.190 2.280 2.166 2.369 . 0 0 "[ . 1 . 2]" 1
952 1 55 ALA MB 1 56 THR H . . 3.380 2.482 2.415 2.593 . 0 0 "[ . 1 . 2]" 1
953 1 55 ALA MB 1 56 THR HA . . 4.790 3.812 3.704 3.894 . 0 0 "[ . 1 . 2]" 1
954 1 55 ALA MB 1 56 THR MG . . 3.420 3.065 2.540 3.488 0.068 4 0 "[ . 1 . 2]" 1
955 1 55 ALA MB 1 57 ASN H . . 5.500 5.284 4.095 5.862 0.362 9 0 "[ . 1 . 2]" 1
956 1 56 THR H 1 56 THR MG . . 4.180 2.334 2.063 2.598 . 0 0 "[ . 1 . 2]" 1
957 1 56 THR HA 1 56 THR MG . . 3.570 2.340 2.137 2.503 . 0 0 "[ . 1 . 2]" 1
958 1 56 THR MG 1 61 ARG QG . . 4.330 4.387 3.918 4.767 0.437 16 0 "[ . 1 . 2]" 1
959 1 56 THR MG 1 64 VAL QG . . 4.990 4.820 4.373 5.216 0.226 11 0 "[ . 1 . 2]" 1
960 1 57 ASN H 1 57 ASN QB . . 3.660 2.623 2.155 3.459 . 0 0 "[ . 1 . 2]" 1
961 1 60 LEU QB 1 64 VAL QG . . 4.140 3.687 2.737 4.167 0.027 13 0 "[ . 1 . 2]" 1
962 1 60 LEU QD 1 64 VAL H . . 4.540 4.080 3.468 4.609 0.069 17 0 "[ . 1 . 2]" 1
963 1 60 LEU QD 1 64 VAL HB . . 4.610 3.352 2.416 4.261 . 0 0 "[ . 1 . 2]" 1
964 1 60 LEU QD 1 64 VAL MG1 . . 3.900 2.746 1.844 3.903 0.003 2 0 "[ . 1 . 2]" 1
965 1 60 LEU QD 1 64 VAL QG . . 3.390 1.980 1.776 2.452 . 0 0 "[ . 1 . 2]" 1
966 1 60 LEU QD 1 64 VAL MG2 . . 3.900 2.436 1.792 3.944 0.044 6 0 "[ . 1 . 2]" 1
967 1 60 LEU QD 1 65 ILE MD . . 4.270 4.263 3.425 4.490 0.220 16 0 "[ . 1 . 2]" 1
968 1 61 ARG H 1 61 ARG HB2 . . 3.870 3.577 3.518 3.666 . 0 0 "[ . 1 . 2]" 1
969 1 61 ARG H 1 61 ARG HD2 . . 5.130 4.190 4.084 4.333 . 0 0 "[ . 1 . 2]" 1
970 1 61 ARG H 1 61 ARG QD . . 4.310 3.809 3.745 3.917 . 0 0 "[ . 1 . 2]" 1
971 1 61 ARG H 1 61 ARG HD3 . . 5.130 4.386 4.170 4.592 . 0 0 "[ . 1 . 2]" 1
972 1 61 ARG H 1 61 ARG QG . . 4.100 1.888 1.821 1.995 . 0 0 "[ . 1 . 2]" 1
973 1 61 ARG H 1 64 VAL QG . . 4.400 2.754 2.396 3.076 . 0 0 "[ . 1 . 2]" 1
974 1 61 ARG HA 1 61 ARG QD . . 4.220 4.188 4.013 4.345 0.125 3 0 "[ . 1 . 2]" 1
975 1 61 ARG HA 1 61 ARG QG . . 3.380 3.315 3.281 3.354 . 0 0 "[ . 1 . 2]" 1
976 1 61 ARG HA 1 64 VAL QG . . 4.410 4.157 3.914 4.612 0.202 8 0 "[ . 1 . 2]" 1
977 1 61 ARG HB2 1 61 ARG HD2 . . 3.800 3.207 2.828 3.510 . 0 0 "[ . 1 . 2]" 1
978 1 61 ARG HB2 1 61 ARG QD . . 3.160 2.050 1.942 2.421 . 0 0 "[ . 1 . 2]" 1
979 1 61 ARG HB2 1 61 ARG HD3 . . 3.800 2.076 1.956 2.467 . 0 0 "[ . 1 . 2]" 1
980 1 61 ARG HB2 1 62 PRO HA . . 5.110 4.775 4.685 4.864 . 0 0 "[ . 1 . 2]" 1
981 1 61 ARG HB2 1 62 PRO QB . . 5.500 4.714 4.624 4.799 . 0 0 "[ . 1 . 2]" 1
982 1 61 ARG HB2 1 62 PRO HG2 . . 3.770 3.651 3.558 3.749 . 0 0 "[ . 1 . 2]" 1
983 1 61 ARG HB2 1 62 PRO HG3 . . 4.540 4.537 4.451 4.637 0.097 8 0 "[ . 1 . 2]" 1
984 1 61 ARG HB2 1 64 VAL QG . . 3.980 3.542 2.876 4.096 0.116 6 0 "[ . 1 . 2]" 1
985 1 61 ARG HB3 1 61 ARG QD . . 3.640 3.050 2.828 3.417 . 0 0 "[ . 1 . 2]" 1
986 1 61 ARG HB3 1 62 PRO HG2 . . 5.470 5.131 4.935 5.302 . 0 0 "[ . 1 . 2]" 1
987 1 61 ARG QD 1 62 PRO HA . . 5.340 5.126 4.495 5.514 0.174 12 0 "[ . 1 . 2]" 1
988 1 61 ARG QD 1 62 PRO HG2 . . 4.390 4.395 4.146 4.535 0.145 3 0 "[ . 1 . 2]" 1
989 1 61 ARG QD 1 64 VAL QG . . 3.640 1.959 1.727 2.288 . 0 0 "[ . 1 . 2]" 1
990 1 61 ARG QG 1 62 PRO HA . . 5.330 5.188 5.068 5.280 . 0 0 "[ . 1 . 2]" 1
991 1 61 ARG QG 1 64 VAL H . . 4.890 4.631 4.229 5.088 0.198 5 0 "[ . 1 . 2]" 1
992 1 61 ARG QG 1 64 VAL HA . . 4.460 3.872 3.405 4.236 . 0 0 "[ . 1 . 2]" 1
993 1 61 ARG QG 1 64 VAL HB . . 4.250 3.663 1.917 4.432 0.182 17 0 "[ . 1 . 2]" 1
994 1 61 ARG QG 1 64 VAL MG1 . . 3.680 2.521 1.805 3.872 0.192 5 0 "[ . 1 . 2]" 1
995 1 61 ARG QG 1 64 VAL QG . . 3.020 1.859 1.703 2.231 . 0 0 "[ . 1 . 2]" 1
996 1 61 ARG QG 1 64 VAL MG2 . . 3.680 2.081 1.833 3.538 . 0 0 "[ . 1 . 2]" 1
997 1 62 PRO HA 1 64 VAL QG . . 4.200 3.932 3.314 4.266 0.066 8 0 "[ . 1 . 2]" 1
998 1 62 PRO QB 1 64 VAL QG . . 5.210 4.881 4.411 5.261 0.051 19 0 "[ . 1 . 2]" 1
999 1 63 PHE H 1 63 PHE HB2 . . 4.040 3.418 2.310 3.774 . 0 0 "[ . 1 . 2]" 1
1000 1 63 PHE H 1 63 PHE QB . . 3.500 3.186 2.283 3.455 . 0 0 "[ . 1 . 2]" 1
1001 1 63 PHE H 1 63 PHE HB3 . . 4.040 3.904 3.561 4.028 . 0 0 "[ . 1 . 2]" 1
1002 1 63 PHE HA 1 66 PRO QB . . 4.790 4.193 3.905 4.465 . 0 0 "[ . 1 . 2]" 1
1003 1 63 PHE QB 1 66 PRO QB . . 4.130 3.755 3.291 4.398 0.268 16 0 "[ . 1 . 2]" 1
1004 1 63 PHE QD 1 66 PRO QB . . 4.630 3.921 2.493 4.554 . 0 0 "[ . 1 . 2]" 1
1005 1 64 VAL H 1 64 VAL MG1 . . 3.880 3.312 1.861 3.824 . 0 0 "[ . 1 . 2]" 1
1006 1 64 VAL H 1 64 VAL MG2 . . 3.880 2.559 1.779 3.826 . 0 0 "[ . 1 . 2]" 1
1007 1 64 VAL H 1 65 ILE MD . . 5.500 5.093 3.407 5.592 0.092 6 0 "[ . 1 . 2]" 1
1008 1 64 VAL HA 1 64 VAL MG1 . . 3.720 2.405 1.980 3.198 . 0 0 "[ . 1 . 2]" 1
1009 1 64 VAL HA 1 64 VAL MG2 . . 3.720 2.521 2.129 3.114 . 0 0 "[ . 1 . 2]" 1
1010 1 64 VAL HA 1 65 ILE MD . . 5.500 5.396 4.756 5.795 0.295 8 0 "[ . 1 . 2]" 1
1011 1 64 VAL HA 1 65 ILE QG . . 5.500 5.276 5.082 5.485 . 0 0 "[ . 1 . 2]" 1
1012 1 64 VAL HA 1 67 PHE HA . . 5.500 5.188 5.021 5.362 . 0 0 "[ . 1 . 2]" 1
1013 1 64 VAL HA 1 67 PHE HB2 . . 4.550 2.536 2.310 3.430 . 0 0 "[ . 1 . 2]" 1
1014 1 64 VAL HA 1 67 PHE QB . . 3.790 2.455 2.278 2.631 . 0 0 "[ . 1 . 2]" 1
1015 1 64 VAL HA 1 67 PHE HB3 . . 4.550 3.633 2.591 3.907 . 0 0 "[ . 1 . 2]" 1
1016 1 64 VAL HA 1 67 PHE QD . . 4.550 3.685 2.473 4.172 . 0 0 "[ . 1 . 2]" 1
1017 1 64 VAL HA 1 67 PHE QE . . 5.500 5.304 4.666 5.544 0.044 3 0 "[ . 1 . 2]" 1
1018 1 64 VAL HB 1 65 ILE H . . 5.080 2.633 2.027 3.849 . 0 0 "[ . 1 . 2]" 1
1019 1 64 VAL HB 1 65 ILE HB . . 5.500 4.928 4.298 6.002 0.502 6 1 "[ .+ 1 . 2]" 1
1020 1 64 VAL QG 1 65 ILE H . . 4.080 2.583 1.855 3.086 . 0 0 "[ . 1 . 2]" 1
1021 1 64 VAL QG 1 65 ILE HA . . 4.150 3.629 2.953 4.071 . 0 0 "[ . 1 . 2]" 1
1022 1 64 VAL QG 1 67 PHE QB . . 4.120 3.502 3.248 3.809 . 0 0 "[ . 1 . 2]" 1
1023 1 64 VAL QG 1 68 LEU H . . 5.440 4.843 4.376 5.548 0.108 11 0 "[ . 1 . 2]" 1
1024 1 64 VAL MG1 1 65 ILE MD . . 5.110 3.611 2.581 4.760 . 0 0 "[ . 1 . 2]" 1
1025 1 64 VAL MG1 1 65 ILE QG . . 4.560 3.562 2.157 4.657 0.097 17 0 "[ . 1 . 2]" 1
1026 1 64 VAL MG2 1 65 ILE MD . . 5.110 4.242 3.169 5.051 . 0 0 "[ . 1 . 2]" 1
1027 1 64 VAL MG2 1 65 ILE QG . . 4.560 3.960 2.385 4.664 0.104 15 0 "[ . 1 . 2]" 1
1028 1 65 ILE H 1 65 ILE HB . . 4.110 2.449 2.216 2.613 . 0 0 "[ . 1 . 2]" 1
1029 1 65 ILE H 1 65 ILE MD . . 4.830 3.246 2.021 3.817 . 0 0 "[ . 1 . 2]" 1
1030 1 65 ILE H 1 65 ILE MG . . 3.880 3.727 3.587 3.766 . 0 0 "[ . 1 . 2]" 1
1031 1 65 ILE HA 1 65 ILE MD . . 4.760 2.323 1.912 3.671 . 0 0 "[ . 1 . 2]" 1
1032 1 65 ILE HB 1 69 LYS QG . . 4.530 4.307 3.927 4.662 0.132 6 0 "[ . 1 . 2]" 1
1033 1 65 ILE MD 1 65 ILE MG . . 3.500 2.114 1.889 3.117 . 0 0 "[ . 1 . 2]" 1
1034 1 65 ILE MD 1 69 LYS QE . . 5.500 5.438 4.835 5.837 0.337 8 0 "[ . 1 . 2]" 1
1035 1 65 ILE MD 1 69 LYS QG . . 5.500 4.349 3.699 5.531 0.031 10 0 "[ . 1 . 2]" 1
1036 1 65 ILE MG 1 69 LYS HB2 . . 4.050 3.591 3.170 4.146 0.096 6 0 "[ . 1 . 2]" 1
1037 1 65 ILE MG 1 69 LYS HB3 . . 5.500 4.356 4.007 4.781 . 0 0 "[ . 1 . 2]" 1
1038 1 65 ILE MG 1 69 LYS QD . . 4.120 3.408 3.049 4.125 0.005 7 0 "[ . 1 . 2]" 1
1039 1 65 ILE MG 1 69 LYS QE . . 3.530 3.224 2.400 3.617 0.087 13 0 "[ . 1 . 2]" 1
1040 1 65 ILE MG 1 69 LYS QG . . 3.610 2.111 1.841 2.466 . 0 0 "[ . 1 . 2]" 1
1041 1 68 LEU HA 1 68 LEU MD1 . . 3.750 2.918 1.982 3.809 0.059 9 0 "[ . 1 . 2]" 1
1042 1 68 LEU HA 1 68 LEU QD . . 3.290 2.329 1.871 2.966 . 0 0 "[ . 1 . 2]" 1
1043 1 68 LEU HA 1 68 LEU MD2 . . 3.750 2.760 1.951 3.826 0.076 18 0 "[ . 1 . 2]" 1
1044 1 68 LEU HA 1 68 LEU HG . . 4.160 2.858 2.184 3.698 . 0 0 "[ . 1 . 2]" 1
1045 1 68 LEU HA 1 70 ALA H . . 4.830 3.833 3.295 4.620 . 0 0 "[ . 1 . 2]" 1
1046 1 68 LEU HA 1 72 LEU QD . . 5.500 4.263 3.726 5.481 . 0 0 "[ . 1 . 2]" 1
1047 1 68 LEU QD 1 72 LEU QB . . 4.660 3.927 2.838 4.709 0.049 2 0 "[ . 1 . 2]" 1
1048 1 68 LEU QD 1 72 LEU QD . . 3.470 2.486 1.789 3.261 . 0 0 "[ . 1 . 2]" 1
1049 1 69 LYS H 1 69 LYS HB2 . . 3.970 2.146 2.072 2.296 . 0 0 "[ . 1 . 2]" 1
1050 1 69 LYS H 1 69 LYS HB3 . . 4.040 3.436 3.267 3.554 . 0 0 "[ . 1 . 2]" 1
1051 1 69 LYS H 1 69 LYS QD . . 4.790 4.313 3.984 4.826 0.036 15 0 "[ . 1 . 2]" 1
1052 1 69 LYS H 1 69 LYS QE . . 5.380 4.920 4.127 5.363 . 0 0 "[ . 1 . 2]" 1
1053 1 69 LYS H 1 69 LYS QG . . 4.150 3.005 2.567 3.414 . 0 0 "[ . 1 . 2]" 1
1054 1 69 LYS HA 1 69 LYS QD . . 3.410 2.439 1.904 3.444 0.034 10 0 "[ . 1 . 2]" 1
1055 1 69 LYS HA 1 69 LYS QE . . 4.680 3.626 1.935 4.285 . 0 0 "[ . 1 . 2]" 1
1056 1 69 LYS HA 1 69 LYS QG . . 3.620 2.380 2.010 2.599 . 0 0 "[ . 1 . 2]" 1
1057 1 69 LYS HB2 1 69 LYS QD . . 3.540 3.374 3.165 3.469 . 0 0 "[ . 1 . 2]" 1
1058 1 69 LYS HB2 1 69 LYS QE . . 4.670 3.535 2.661 4.119 . 0 0 "[ . 1 . 2]" 1
1059 1 69 LYS HB2 1 70 ALA H . . 4.360 3.049 2.675 3.547 . 0 0 "[ . 1 . 2]" 1
1060 1 69 LYS HB2 1 70 ALA MB . . 4.460 4.147 3.871 4.453 . 0 0 "[ . 1 . 2]" 1
1061 1 69 LYS HB3 1 69 LYS QD . . 3.400 2.441 1.977 2.798 . 0 0 "[ . 1 . 2]" 1
1062 1 69 LYS HB3 1 69 LYS QE . . 4.900 2.590 2.013 3.994 . 0 0 "[ . 1 . 2]" 1
1063 1 69 LYS HB3 1 70 ALA H . . 4.480 3.199 2.105 3.616 . 0 0 "[ . 1 . 2]" 1
1064 1 69 LYS HB3 1 70 ALA HA . . 4.250 4.181 3.928 4.339 0.089 19 0 "[ . 1 . 2]" 1
1065 1 69 LYS QE 1 70 ALA HA . . 5.500 5.530 5.051 5.743 0.243 8 0 "[ . 1 . 2]" 1
1066 1 70 ALA H 1 70 ALA MB . . 3.150 2.336 2.243 2.406 . 0 0 "[ . 1 . 2]" 1
1067 1 70 ALA HA 1 72 LEU HB2 . . 5.500 4.691 4.153 5.525 0.025 20 0 "[ . 1 . 2]" 1
1068 1 70 ALA HA 1 72 LEU QB . . 4.730 4.378 4.013 4.696 . 0 0 "[ . 1 . 2]" 1
1069 1 70 ALA HA 1 72 LEU HB3 . . 5.500 5.380 4.274 5.691 0.191 10 0 "[ . 1 . 2]" 1
1070 1 70 ALA HA 1 73 PRO HD2 . . 5.500 3.734 3.430 4.055 . 0 0 "[ . 1 . 2]" 1
1071 1 70 ALA HA 1 73 PRO HD3 . . 4.750 4.367 3.885 4.686 . 0 0 "[ . 1 . 2]" 1
1072 1 70 ALA MB 1 71 ASN H . . 3.570 3.237 2.446 3.446 . 0 0 "[ . 1 . 2]" 1
1073 1 70 ALA MB 1 71 ASN QB . . 4.670 4.270 3.675 4.551 . 0 0 "[ . 1 . 2]" 1
1074 1 70 ALA MB 1 71 ASN HD21 . . 4.760 3.674 3.114 4.674 . 0 0 "[ . 1 . 2]" 1
1075 1 70 ALA MB 1 71 ASN QD . . 4.100 3.420 3.042 3.993 . 0 0 "[ . 1 . 2]" 1
1076 1 70 ALA MB 1 71 ASN HD22 . . 4.760 4.264 3.393 4.804 0.044 3 0 "[ . 1 . 2]" 1
1077 1 71 ASN H 1 71 ASN QB . . 3.690 2.386 2.121 2.728 . 0 0 "[ . 1 . 2]" 1
1078 1 71 ASN H 1 73 PRO HD2 . . 5.050 3.575 3.250 4.027 . 0 0 "[ . 1 . 2]" 1
1079 1 71 ASN H 1 73 PRO HD3 . . 5.500 4.872 4.505 5.381 . 0 0 "[ . 1 . 2]" 1
1080 1 71 ASN HA 1 73 PRO HD3 . . 5.200 4.959 4.772 5.088 . 0 0 "[ . 1 . 2]" 1
1081 1 71 ASN HA 1 74 LEU HB2 . . 3.890 2.216 2.091 2.376 . 0 0 "[ . 1 . 2]" 1
1082 1 71 ASN HA 1 74 LEU MD1 . . 4.950 4.713 4.562 4.896 . 0 0 "[ . 1 . 2]" 1
1083 1 71 ASN HA 1 74 LEU MD2 . . 3.780 2.537 2.338 2.896 . 0 0 "[ . 1 . 2]" 1
1084 1 71 ASN HA 1 75 LEU QD . . 4.580 4.087 3.669 4.592 0.012 16 0 "[ . 1 . 2]" 1
1085 1 72 LEU H 1 72 LEU QD . . 4.340 3.200 2.947 3.604 . 0 0 "[ . 1 . 2]" 1
1086 1 72 LEU H 1 73 PRO HD2 . . 4.110 2.152 2.056 2.206 . 0 0 "[ . 1 . 2]" 1
1087 1 72 LEU H 1 73 PRO HD3 . . 4.020 3.116 3.026 3.201 . 0 0 "[ . 1 . 2]" 1
1088 1 72 LEU HA 1 72 LEU QD . . 3.950 1.945 1.869 2.055 . 0 0 "[ . 1 . 2]" 1
1089 1 72 LEU QB 1 73 PRO HD3 . . 3.450 1.864 1.744 1.905 . 0 0 "[ . 1 . 2]" 1
1090 1 72 LEU HB2 1 73 PRO HD2 . . 4.130 3.168 2.910 3.860 . 0 0 "[ . 1 . 2]" 1
1091 1 72 LEU HB2 1 73 PRO HD3 . . 4.020 2.854 2.595 3.539 . 0 0 "[ . 1 . 2]" 1
1092 1 72 LEU HB3 1 73 PRO HD2 . . 4.130 2.922 2.599 3.005 . 0 0 "[ . 1 . 2]" 1
1093 1 72 LEU HB3 1 73 PRO HD3 . . 4.020 1.894 1.749 1.953 . 0 0 "[ . 1 . 2]" 1
1094 1 72 LEU QD 1 73 PRO HA . . 4.480 3.544 2.362 3.954 . 0 0 "[ . 1 . 2]" 1
1095 1 72 LEU QD 1 73 PRO QB . . 4.890 4.316 2.843 4.612 . 0 0 "[ . 1 . 2]" 1
1096 1 72 LEU QD 1 73 PRO HD2 . . 4.160 3.966 3.269 4.051 . 0 0 "[ . 1 . 2]" 1
1097 1 72 LEU QD 1 73 PRO HD3 . . 4.250 3.464 1.957 3.684 . 0 0 "[ . 1 . 2]" 1
1098 1 72 LEU QD 1 73 PRO HG2 . . 5.400 5.249 4.126 5.433 0.033 6 0 "[ . 1 . 2]" 1
1099 1 72 LEU QD 1 74 LEU H . . 4.450 4.418 3.997 4.522 0.072 6 0 "[ . 1 . 2]" 1
1100 1 72 LEU QD 1 75 LEU QB . . 3.840 3.463 3.248 3.706 . 0 0 "[ . 1 . 2]" 1
1101 1 72 LEU QD 1 76 GLN H . . 5.260 3.860 3.581 4.090 . 0 0 "[ . 1 . 2]" 1
1102 1 72 LEU QD 1 76 GLN HA . . 5.500 4.783 4.311 5.045 . 0 0 "[ . 1 . 2]" 1
1103 1 72 LEU QD 1 76 GLN QB . . 4.020 3.135 2.494 3.514 . 0 0 "[ . 1 . 2]" 1
1104 1 72 LEU QD 1 76 GLN HG2 . . 4.210 3.238 2.786 3.783 . 0 0 "[ . 1 . 2]" 1
1105 1 72 LEU QD 1 76 GLN HG3 . . 4.140 4.167 3.705 4.376 0.236 9 0 "[ . 1 . 2]" 1
1106 1 72 LEU HG 1 73 PRO HD2 . . 5.260 5.144 5.061 5.198 . 0 0 "[ . 1 . 2]" 1
1107 1 72 LEU HG 1 73 PRO HD3 . . 4.580 4.176 3.951 4.252 . 0 0 "[ . 1 . 2]" 1
1108 1 73 PRO HA 1 74 LEU MD2 . . 4.670 4.512 4.364 4.733 0.063 17 0 "[ . 1 . 2]" 1
1109 1 73 PRO HA 1 76 GLN HB2 . . 4.630 4.687 4.597 4.828 0.198 20 0 "[ . 1 . 2]" 1
1110 1 73 PRO HA 1 76 GLN QB . . 3.950 3.841 3.652 3.978 0.028 9 0 "[ . 1 . 2]" 1
1111 1 73 PRO HA 1 76 GLN HB3 . . 4.630 4.081 3.833 4.286 . 0 0 "[ . 1 . 2]" 1
1112 1 73 PRO HA 1 76 GLN HG2 . . 5.220 2.120 1.928 2.317 . 0 0 "[ . 1 . 2]" 1
1113 1 73 PRO HA 1 76 GLN HG3 . . 4.790 2.489 2.037 3.087 . 0 0 "[ . 1 . 2]" 1
1114 1 73 PRO QB 1 74 LEU H . . 4.090 3.500 3.381 3.571 . 0 0 "[ . 1 . 2]" 1
1115 1 73 PRO QB 1 74 LEU MD1 . . 4.670 4.197 4.082 4.394 . 0 0 "[ . 1 . 2]" 1
1116 1 73 PRO HD2 1 74 LEU H . . 4.940 2.763 2.687 2.824 . 0 0 "[ . 1 . 2]" 1
1117 1 73 PRO HD2 1 74 LEU MD1 . . 5.500 5.618 5.528 5.779 0.279 17 0 "[ . 1 . 2]" 1
1118 1 73 PRO HD3 1 74 LEU H . . 4.500 3.904 3.864 3.937 . 0 0 "[ . 1 . 2]" 1
1119 1 73 PRO HD3 1 74 LEU MD2 . . 5.230 4.491 4.294 4.843 . 0 0 "[ . 1 . 2]" 1
1120 1 73 PRO HG2 1 74 LEU HB2 . . 4.290 3.953 3.743 4.090 . 0 0 "[ . 1 . 2]" 1
1121 1 73 PRO HG2 1 74 LEU MD2 . . 3.650 2.181 2.026 2.461 . 0 0 "[ . 1 . 2]" 1
1122 1 74 LEU H 1 74 LEU MD1 . . 3.900 3.902 3.852 3.974 0.074 5 0 "[ . 1 . 2]" 1
1123 1 74 LEU H 1 74 LEU MD2 . . 4.020 2.625 2.321 2.919 . 0 0 "[ . 1 . 2]" 1
1124 1 74 LEU H 1 74 LEU HG . . 5.390 4.347 4.235 4.482 . 0 0 "[ . 1 . 2]" 1
1125 1 74 LEU H 1 76 GLN HG2 . . 5.190 4.723 3.922 5.111 . 0 0 "[ . 1 . 2]" 1
1126 1 74 LEU HA 1 74 LEU MD1 . . 2.680 1.938 1.881 2.042 . 0 0 "[ . 1 . 2]" 1
1127 1 74 LEU HA 1 74 LEU MD2 . . 3.280 2.733 2.681 2.825 . 0 0 "[ . 1 . 2]" 1
1128 1 74 LEU HA 1 77 ARG QB . . 3.710 3.715 3.496 3.810 0.100 12 0 "[ . 1 . 2]" 1
1129 1 74 LEU HA 1 77 ARG HD2 . . 4.470 2.926 2.106 3.950 . 0 0 "[ . 1 . 2]" 1
1130 1 74 LEU HA 1 77 ARG HD3 . . 4.850 3.136 1.977 4.394 . 0 0 "[ . 1 . 2]" 1
1131 1 74 LEU HA 1 77 ARG HG2 . . 3.580 2.691 2.145 3.684 0.104 4 0 "[ . 1 . 2]" 1
1132 1 74 LEU HA 1 77 ARG QG . . 3.110 2.143 1.947 2.345 . 0 0 "[ . 1 . 2]" 1
1133 1 74 LEU HA 1 77 ARG HG3 . . 3.580 2.671 1.962 3.646 0.066 5 0 "[ . 1 . 2]" 1
1134 1 74 LEU HB2 1 74 LEU MD2 . . 3.270 2.227 2.161 2.312 . 0 0 "[ . 1 . 2]" 1
1135 1 74 LEU HB3 1 74 LEU MD1 . . 2.830 2.411 2.349 2.474 . 0 0 "[ . 1 . 2]" 1
1136 1 74 LEU HB3 1 74 LEU MD2 . . 3.270 3.175 3.160 3.185 . 0 0 "[ . 1 . 2]" 1
1137 1 74 LEU MD1 1 77 ARG QB . . 4.440 3.891 3.420 4.290 . 0 0 "[ . 1 . 2]" 1
1138 1 74 LEU MD1 1 77 ARG HD2 . . 4.390 3.103 1.880 4.580 0.190 9 0 "[ . 1 . 2]" 1
1139 1 74 LEU MD1 1 77 ARG HD3 . . 4.070 2.889 1.854 4.102 0.032 16 0 "[ . 1 . 2]" 1
1140 1 74 LEU MD1 1 77 ARG QG . . 3.210 2.877 2.344 3.231 0.021 4 0 "[ . 1 . 2]" 1
1141 1 74 LEU MD2 1 77 ARG HD2 . . 5.500 4.112 3.456 5.557 0.057 9 0 "[ . 1 . 2]" 1
1142 1 74 LEU MD2 1 77 ARG HD3 . . 5.500 4.546 3.608 5.470 . 0 0 "[ . 1 . 2]" 1
1143 1 75 LEU H 1 75 LEU QD . . 3.190 2.822 2.289 3.332 0.142 2 0 "[ . 1 . 2]" 1
1144 1 75 LEU H 1 76 GLN HA . . 5.210 4.993 4.880 5.281 0.071 4 0 "[ . 1 . 2]" 1
1145 1 75 LEU H 1 77 ARG HD2 . . 5.500 5.608 5.502 5.726 0.226 16 0 "[ . 1 . 2]" 1
1146 1 75 LEU HA 1 75 LEU QD . . 2.880 1.974 1.893 2.079 . 0 0 "[ . 1 . 2]" 1
1147 1 75 LEU HA 1 75 LEU HG . . 4.250 3.561 2.740 3.653 . 0 0 "[ . 1 . 2]" 1
1148 1 75 LEU HA 1 76 GLN HA . . 4.900 4.726 4.661 4.769 . 0 0 "[ . 1 . 2]" 1
1149 1 75 LEU HA 1 78 GLU QB . . 4.020 3.783 3.236 4.098 0.078 9 0 "[ . 1 . 2]" 1
1150 1 75 LEU HA 1 78 GLU HG2 . . 4.220 3.023 2.133 3.810 . 0 0 "[ . 1 . 2]" 1
1151 1 75 LEU HA 1 78 GLU HG3 . . 4.220 3.687 2.765 4.339 0.119 1 0 "[ . 1 . 2]" 1
1152 1 75 LEU QB 1 76 GLN H . . 4.440 2.890 2.768 2.996 . 0 0 "[ . 1 . 2]" 1
1153 1 75 LEU QD 1 78 GLU QB . . 3.760 3.763 3.407 3.886 0.126 2 0 "[ . 1 . 2]" 1
1154 1 75 LEU QD 1 78 GLU HG2 . . 4.140 2.701 2.413 3.607 . 0 0 "[ . 1 . 2]" 1
1155 1 75 LEU QD 1 78 GLU QG . . 3.290 2.564 2.299 3.396 0.106 2 0 "[ . 1 . 2]" 1
1156 1 75 LEU QD 1 78 GLU HG3 . . 4.140 3.215 2.774 4.144 0.004 2 0 "[ . 1 . 2]" 1
1157 1 76 GLN H 1 76 GLN HG2 . . 4.460 2.967 2.136 3.416 . 0 0 "[ . 1 . 2]" 1
1158 1 76 GLN H 1 76 GLN HG3 . . 4.360 2.107 1.881 3.390 . 0 0 "[ . 1 . 2]" 1
1159 1 76 GLN H 1 77 ARG HA . . 5.500 5.051 4.941 5.129 . 0 0 "[ . 1 . 2]" 1
1160 1 76 GLN H 1 77 ARG HD2 . . 5.500 5.274 4.165 5.534 0.034 4 0 "[ . 1 . 2]" 1
1161 1 76 GLN HA 1 76 GLN HG3 . . 3.630 3.604 3.541 3.727 0.097 12 0 "[ . 1 . 2]" 1
1162 1 76 GLN HA 1 77 ARG HA . . 4.680 4.666 4.620 4.723 0.043 11 0 "[ . 1 . 2]" 1
1163 1 76 GLN QB 1 77 ARG H . . 4.360 3.758 3.591 3.808 . 0 0 "[ . 1 . 2]" 1
1164 1 76 GLN HG3 1 77 ARG HA . . 4.720 4.271 3.501 4.668 . 0 0 "[ . 1 . 2]" 1
1165 1 76 GLN HG3 1 77 ARG HD2 . . 4.900 4.222 2.659 5.039 0.139 12 0 "[ . 1 . 2]" 1
1166 1 77 ARG H 1 77 ARG QB . . 3.460 2.657 2.541 2.758 . 0 0 "[ . 1 . 2]" 1
1167 1 77 ARG H 1 77 ARG HD2 . . 5.500 4.104 2.963 4.481 . 0 0 "[ . 1 . 2]" 1
1168 1 77 ARG H 1 77 ARG HG2 . . 4.050 2.179 1.850 3.295 . 0 0 "[ . 1 . 2]" 1
1169 1 77 ARG H 1 77 ARG HG3 . . 4.050 3.070 2.143 3.524 . 0 0 "[ . 1 . 2]" 1
1170 1 77 ARG HA 1 77 ARG HD2 . . 4.570 4.415 2.630 5.006 0.436 19 0 "[ . 1 . 2]" 1
1171 1 77 ARG HA 1 77 ARG QG . . 3.530 3.042 2.595 3.344 . 0 0 "[ . 1 . 2]" 1
1172 1 77 ARG HA 1 80 LEU H . . 4.580 3.987 3.576 4.307 . 0 0 "[ . 1 . 2]" 1
1173 1 77 ARG HA 1 80 LEU QD . . 3.580 3.384 2.739 3.599 0.019 6 0 "[ . 1 . 2]" 1
1174 1 77 ARG QB 1 77 ARG HD3 . . 3.560 2.759 2.258 3.396 . 0 0 "[ . 1 . 2]" 1
1175 1 77 ARG QB 1 80 LEU QD . . 4.930 4.437 3.674 4.879 . 0 0 "[ . 1 . 2]" 1
1176 1 77 ARG QG 1 78 GLU QB . . 5.340 4.295 2.896 5.332 . 0 0 "[ . 1 . 2]" 1
1177 1 77 ARG QG 1 78 GLU QG . . 5.180 4.733 3.897 5.234 0.054 9 0 "[ . 1 . 2]" 1
1178 1 78 GLU H 1 78 GLU QB . . 3.500 2.367 2.209 2.523 . 0 0 "[ . 1 . 2]" 1
1179 1 78 GLU H 1 78 GLU HG2 . . 4.270 3.049 2.287 3.610 . 0 0 "[ . 1 . 2]" 1
1180 1 78 GLU H 1 78 GLU QG . . 3.710 2.468 2.256 2.736 . 0 0 "[ . 1 . 2]" 1
1181 1 78 GLU H 1 78 GLU HG3 . . 4.270 3.006 2.508 3.925 . 0 0 "[ . 1 . 2]" 1
1182 1 78 GLU H 1 79 LEU QD . . 5.500 4.709 4.030 5.138 . 0 0 "[ . 1 . 2]" 1
1183 1 78 GLU HA 1 78 GLU QG . . 3.580 3.392 3.286 3.452 . 0 0 "[ . 1 . 2]" 1
1184 1 78 GLU HA 1 81 HIS H . . 3.690 3.444 3.268 3.697 0.007 8 0 "[ . 1 . 2]" 1
1185 1 78 GLU HA 1 81 HIS QB . . 3.670 3.080 2.470 3.673 0.003 8 0 "[ . 1 . 2]" 1
1186 1 78 GLU QB 1 79 LEU H . . 3.780 3.620 3.521 3.714 . 0 0 "[ . 1 . 2]" 1
1187 1 78 GLU QB 1 81 HIS QB . . 4.770 3.462 3.135 3.791 . 0 0 "[ . 1 . 2]" 1
1188 1 78 GLU QG 1 79 LEU H . . 4.090 2.378 2.128 2.625 . 0 0 "[ . 1 . 2]" 1
1189 1 78 GLU QG 1 79 LEU HA . . 4.360 3.352 3.064 3.641 . 0 0 "[ . 1 . 2]" 1
1190 1 78 GLU QG 1 79 LEU QB . . 4.520 3.591 3.356 4.008 . 0 0 "[ . 1 . 2]" 1
1191 1 78 GLU QG 1 79 LEU QD . . 3.780 3.093 2.215 3.713 . 0 0 "[ . 1 . 2]" 1
1192 1 78 GLU QG 1 82 ALA MB . . 5.340 4.839 3.944 5.368 0.028 13 0 "[ . 1 . 2]" 1
1193 1 78 GLU HG2 1 79 LEU H . . 4.670 3.507 2.245 4.225 . 0 0 "[ . 1 . 2]" 1
1194 1 78 GLU HG2 1 81 HIS QB . . 5.500 5.522 5.084 5.647 0.147 17 0 "[ . 1 . 2]" 1
1195 1 78 GLU HG3 1 79 LEU H . . 4.670 2.651 2.138 3.765 . 0 0 "[ . 1 . 2]" 1
1196 1 78 GLU HG3 1 81 HIS QB . . 5.500 4.907 4.011 5.315 . 0 0 "[ . 1 . 2]" 1
1197 1 79 LEU H 1 79 LEU QD . . 4.180 3.071 2.383 3.367 . 0 0 "[ . 1 . 2]" 1
1198 1 79 LEU HA 1 79 LEU QD . . 3.850 2.137 1.884 2.681 . 0 0 "[ . 1 . 2]" 1
1199 1 79 LEU HA 1 80 LEU HA . . 5.500 4.779 4.717 4.878 . 0 0 "[ . 1 . 2]" 1
1200 1 79 LEU HA 1 83 ALA H . . 5.260 4.892 4.457 5.284 0.024 5 0 "[ . 1 . 2]" 1
1201 1 79 LEU QB 1 80 LEU QB . . 5.340 4.282 4.067 4.491 . 0 0 "[ . 1 . 2]" 1
1202 1 79 LEU QD 1 81 HIS QB . . 5.500 5.215 4.725 5.610 0.110 20 0 "[ . 1 . 2]" 1
1203 1 79 LEU QD 1 82 ALA MB . . 3.850 2.977 2.229 3.809 . 0 0 "[ . 1 . 2]" 1
1204 1 79 LEU QD 1 90 PRO HA . . 5.060 3.790 3.109 5.076 0.016 17 0 "[ . 1 . 2]" 1
1205 1 79 LEU QD 1 91 ALA HA . . 4.410 4.114 3.522 4.457 0.047 2 0 "[ . 1 . 2]" 1
1206 1 79 LEU QD 1 93 TYR HB2 . . 5.340 4.374 3.651 5.350 0.010 10 0 "[ . 1 . 2]" 1
1207 1 79 LEU QD 1 93 TYR QB . . 4.690 3.281 2.660 4.119 . 0 0 "[ . 1 . 2]" 1
1208 1 79 LEU QD 1 93 TYR HB3 . . 5.340 3.392 2.718 4.283 . 0 0 "[ . 1 . 2]" 1
1209 1 79 LEU QD 1 93 TYR QD . . 5.350 2.696 1.907 3.656 . 0 0 "[ . 1 . 2]" 1
1210 1 79 LEU QD 1 94 LEU H . . 5.500 4.100 3.748 4.603 . 0 0 "[ . 1 . 2]" 1
1211 1 79 LEU QD 1 94 LEU QB . . 4.670 3.493 2.995 3.817 . 0 0 "[ . 1 . 2]" 1
1212 1 79 LEU QD 1 95 ALA H . . 5.500 5.373 4.907 5.520 0.020 4 0 "[ . 1 . 2]" 1
1213 1 80 LEU H 1 80 LEU HB2 . . 3.750 2.138 2.040 2.235 . 0 0 "[ . 1 . 2]" 1
1214 1 80 LEU H 1 80 LEU HB3 . . 3.750 3.443 3.258 3.524 . 0 0 "[ . 1 . 2]" 1
1215 1 80 LEU H 1 80 LEU QD . . 4.350 2.776 2.067 3.487 . 0 0 "[ . 1 . 2]" 1
1216 1 80 LEU HA 1 80 LEU QD . . 2.990 2.146 1.927 2.688 . 0 0 "[ . 1 . 2]" 1
1217 1 80 LEU HA 1 80 LEU HG . . 4.050 2.943 2.262 3.704 . 0 0 "[ . 1 . 2]" 1
1218 1 80 LEU HA 1 81 HIS QB . . 5.080 5.122 5.083 5.177 0.097 11 0 "[ . 1 . 2]" 1
1219 1 80 LEU HA 1 83 ALA H . . 3.940 3.762 3.414 3.961 0.021 2 0 "[ . 1 . 2]" 1
1220 1 80 LEU HA 1 83 ALA MB . . 4.400 3.107 2.640 3.372 . 0 0 "[ . 1 . 2]" 1
1221 1 80 LEU HA 1 90 PRO HA . . 3.860 3.393 3.056 3.831 . 0 0 "[ . 1 . 2]" 1
1222 1 80 LEU HA 1 90 PRO HB2 . . 4.180 3.024 2.736 3.352 . 0 0 "[ . 1 . 2]" 1
1223 1 80 LEU HA 1 90 PRO HB3 . . 3.560 2.106 1.990 2.359 . 0 0 "[ . 1 . 2]" 1
1224 1 80 LEU HA 1 90 PRO QG . . 4.490 3.906 3.590 4.170 . 0 0 "[ . 1 . 2]" 1
1225 1 80 LEU QB 1 81 HIS QB . . 4.480 4.131 3.973 4.242 . 0 0 "[ . 1 . 2]" 1
1226 1 80 LEU QB 1 90 PRO HB2 . . 5.100 4.497 4.108 4.847 . 0 0 "[ . 1 . 2]" 1
1227 1 80 LEU QB 1 90 PRO HB3 . . 5.340 3.770 3.484 4.092 . 0 0 "[ . 1 . 2]" 1
1228 1 80 LEU HB2 1 80 LEU QD . . 2.780 2.193 1.945 2.379 . 0 0 "[ . 1 . 2]" 1
1229 1 80 LEU HB2 1 81 HIS H . . 4.050 3.337 3.023 3.536 . 0 0 "[ . 1 . 2]" 1
1230 1 80 LEU HB2 1 81 HIS QB . . 5.240 4.587 4.430 4.932 . 0 0 "[ . 1 . 2]" 1
1231 1 80 LEU HB3 1 80 LEU QD . . 2.780 2.207 2.083 2.395 . 0 0 "[ . 1 . 2]" 1
1232 1 80 LEU HB3 1 81 HIS H . . 4.050 3.684 3.137 3.928 . 0 0 "[ . 1 . 2]" 1
1233 1 80 LEU HB3 1 81 HIS QB . . 5.240 4.711 4.467 4.893 . 0 0 "[ . 1 . 2]" 1
1234 1 80 LEU QD 1 81 HIS H . . 4.510 4.174 3.930 4.443 . 0 0 "[ . 1 . 2]" 1
1235 1 80 LEU QD 1 81 HIS QB . . 5.500 5.101 5.002 5.239 . 0 0 "[ . 1 . 2]" 1
1236 1 80 LEU QD 1 83 ALA H . . 5.050 4.857 4.613 5.037 . 0 0 "[ . 1 . 2]" 1
1237 1 80 LEU QD 1 83 ALA MB . . 3.660 3.625 3.383 3.828 0.168 7 0 "[ . 1 . 2]" 1
1238 1 80 LEU QD 1 90 PRO HA . . 4.040 3.734 3.450 3.945 . 0 0 "[ . 1 . 2]" 1
1239 1 80 LEU QD 1 90 PRO HB2 . . 3.170 2.172 1.880 2.748 . 0 0 "[ . 1 . 2]" 1
1240 1 80 LEU QD 1 90 PRO HB3 . . 3.270 2.029 1.893 2.248 . 0 0 "[ . 1 . 2]" 1
1241 1 80 LEU QD 1 90 PRO QD . . 4.970 3.469 3.147 4.057 . 0 0 "[ . 1 . 2]" 1
1242 1 80 LEU QD 1 91 ALA H . . 4.690 4.541 4.206 4.756 0.066 14 0 "[ . 1 . 2]" 1
1243 1 80 LEU HG 1 90 PRO HB2 . . 5.500 3.673 2.093 4.998 . 0 0 "[ . 1 . 2]" 1
1244 1 80 LEU HG 1 90 PRO HB3 . . 5.500 3.505 2.123 4.737 . 0 0 "[ . 1 . 2]" 1
1245 1 81 HIS H 1 81 HIS QB . . 3.270 2.255 2.101 2.342 . 0 0 "[ . 1 . 2]" 1
1246 1 81 HIS HA 1 81 HIS HD2 . . 4.930 3.487 2.131 4.880 . 0 0 "[ . 1 . 2]" 1
1247 1 81 HIS HA 1 82 ALA HA . . 5.120 4.849 4.750 4.882 . 0 0 "[ . 1 . 2]" 1
1248 1 81 HIS HA 1 83 ALA MB . . 4.630 4.683 4.620 4.737 0.107 6 0 "[ . 1 . 2]" 1
1249 1 81 HIS HA 1 84 ARG H . . 4.630 3.399 3.192 3.585 . 0 0 "[ . 1 . 2]" 1
1250 1 81 HIS HA 1 84 ARG QB . . 3.950 3.254 2.891 3.848 . 0 0 "[ . 1 . 2]" 1
1251 1 81 HIS HA 1 84 ARG QG . . 3.430 2.456 1.958 3.031 . 0 0 "[ . 1 . 2]" 1
1252 1 81 HIS QB 1 82 ALA H . . 3.750 2.601 2.426 3.046 . 0 0 "[ . 1 . 2]" 1
1253 1 81 HIS QB 1 82 ALA HA . . 4.840 4.025 3.750 4.365 . 0 0 "[ . 1 . 2]" 1
1254 1 81 HIS QB 1 82 ALA MB . . 4.370 3.915 3.771 4.177 . 0 0 "[ . 1 . 2]" 1
1255 1 81 HIS QB 1 84 ARG QB . . 5.340 4.729 4.409 5.396 0.056 8 0 "[ . 1 . 2]" 1
1256 1 82 ALA H 1 82 ALA MB . . 3.240 2.085 2.027 2.232 . 0 0 "[ . 1 . 2]" 1
1257 1 82 ALA HA 1 83 ALA HA . . 5.500 4.795 4.650 4.856 . 0 0 "[ . 1 . 2]" 1
1258 1 82 ALA HA 1 85 LEU H . . 4.420 3.709 3.302 4.111 . 0 0 "[ . 1 . 2]" 1
1259 1 82 ALA HA 1 85 LEU QB . . 4.010 3.268 2.810 3.800 . 0 0 "[ . 1 . 2]" 1
1260 1 82 ALA HA 1 85 LEU QD . . 4.490 3.952 3.297 4.490 . 0 0 "[ . 1 . 2]" 1
1261 1 82 ALA HA 1 86 ALA MB . . 3.990 4.056 3.994 4.109 0.119 8 0 "[ . 1 . 2]" 1
1262 1 82 ALA MB 1 85 LEU QD . . 5.500 4.726 4.333 5.060 . 0 0 "[ . 1 . 2]" 1
1263 1 82 ALA MB 1 86 ALA MB . . 4.060 3.515 3.275 3.910 . 0 0 "[ . 1 . 2]" 1
1264 1 82 ALA MB 1 93 TYR QB . . 4.820 3.642 3.091 4.058 . 0 0 "[ . 1 . 2]" 1
1265 1 83 ALA H 1 83 ALA MB . . 3.450 2.074 2.039 2.196 . 0 0 "[ . 1 . 2]" 1
1266 1 83 ALA H 1 84 ARG HA . . 5.410 5.270 5.050 5.389 . 0 0 "[ . 1 . 2]" 1
1267 1 83 ALA H 1 84 ARG QD . . 5.500 5.196 4.735 5.534 0.034 11 0 "[ . 1 . 2]" 1
1268 1 83 ALA H 1 84 ARG QG . . 4.090 3.959 3.237 4.115 0.025 7 0 "[ . 1 . 2]" 1
1269 1 83 ALA H 1 86 ALA MB . . 4.300 4.212 4.022 4.396 0.096 19 0 "[ . 1 . 2]" 1
1270 1 83 ALA H 1 90 PRO HA . . 4.210 3.649 3.498 3.877 . 0 0 "[ . 1 . 2]" 1
1271 1 83 ALA H 1 90 PRO HB2 . . 5.500 5.589 5.543 5.661 0.161 11 0 "[ . 1 . 2]" 1
1272 1 83 ALA H 1 90 PRO HB3 . . 5.500 4.385 4.202 4.521 . 0 0 "[ . 1 . 2]" 1
1273 1 83 ALA HA 1 86 ALA MB . . 3.620 2.231 1.955 2.566 . 0 0 "[ . 1 . 2]" 1
1274 1 83 ALA HA 1 90 PRO HA . . 4.870 4.112 3.927 4.333 . 0 0 "[ . 1 . 2]" 1
1275 1 83 ALA HA 1 93 TYR QD . . 5.500 3.435 2.595 3.964 . 0 0 "[ . 1 . 2]" 1
1276 1 83 ALA MB 1 84 ARG HA . . 4.330 3.715 3.623 3.819 . 0 0 "[ . 1 . 2]" 1
1277 1 83 ALA MB 1 84 ARG HB2 . . 5.410 4.860 4.658 5.219 . 0 0 "[ . 1 . 2]" 1
1278 1 83 ALA MB 1 84 ARG QB . . 4.620 4.415 3.916 4.614 . 0 0 "[ . 1 . 2]" 1
1279 1 83 ALA MB 1 84 ARG HB3 . . 5.410 5.156 4.057 5.397 . 0 0 "[ . 1 . 2]" 1
1280 1 83 ALA MB 1 84 ARG QD . . 5.060 3.882 3.116 5.188 0.128 19 0 "[ . 1 . 2]" 1
1281 1 83 ALA MB 1 84 ARG QG . . 3.950 3.469 3.218 3.931 . 0 0 "[ . 1 . 2]" 1
1282 1 83 ALA MB 1 86 ALA MB . . 4.410 3.650 3.418 3.862 . 0 0 "[ . 1 . 2]" 1
1283 1 83 ALA MB 1 88 GLN HB2 . . 4.340 3.710 3.460 3.950 . 0 0 "[ . 1 . 2]" 1
1284 1 83 ALA MB 1 88 GLN HB3 . . 5.220 4.826 3.972 5.146 . 0 0 "[ . 1 . 2]" 1
1285 1 83 ALA MB 1 88 GLN QG . . 4.620 4.728 4.667 4.833 0.213 17 0 "[ . 1 . 2]" 1
1286 1 83 ALA MB 1 90 PRO HA . . 3.300 1.955 1.863 2.071 . 0 0 "[ . 1 . 2]" 1
1287 1 83 ALA MB 1 90 PRO HB2 . . 3.870 3.846 3.750 3.953 0.083 17 0 "[ . 1 . 2]" 1
1288 1 83 ALA MB 1 90 PRO HB3 . . 3.760 2.682 2.558 2.871 . 0 0 "[ . 1 . 2]" 1
1289 1 83 ALA MB 1 90 PRO QD . . 4.210 2.813 2.677 3.019 . 0 0 "[ . 1 . 2]" 1
1290 1 83 ALA MB 1 93 TYR HA . . 4.550 4.402 4.118 4.575 0.025 20 0 "[ . 1 . 2]" 1
1291 1 83 ALA MB 1 93 TYR QB . . 3.910 2.639 2.482 2.870 . 0 0 "[ . 1 . 2]" 1
1292 1 84 ARG H 1 84 ARG HB2 . . 3.640 2.716 2.506 3.590 . 0 0 "[ . 1 . 2]" 1
1293 1 84 ARG H 1 84 ARG HB3 . . 3.640 3.489 2.583 3.593 . 0 0 "[ . 1 . 2]" 1
1294 1 84 ARG H 1 84 ARG QD . . 3.860 3.308 2.860 3.945 0.085 20 0 "[ . 1 . 2]" 1
1295 1 84 ARG H 1 84 ARG QG . . 3.850 1.981 1.894 2.125 . 0 0 "[ . 1 . 2]" 1
1296 1 84 ARG HA 1 84 ARG QD . . 4.130 2.767 1.982 4.269 0.139 8 0 "[ . 1 . 2]" 1
1297 1 84 ARG HA 1 84 ARG QG . . 3.300 2.936 2.432 3.385 0.085 19 0 "[ . 1 . 2]" 1
1298 1 84 ARG HA 1 86 ALA H . . 4.330 4.023 3.769 4.430 0.100 18 0 "[ . 1 . 2]" 1
1299 1 84 ARG HA 1 87 LYS HA . . 4.580 4.295 3.891 4.594 0.014 5 0 "[ . 1 . 2]" 1
1300 1 84 ARG QB 1 84 ARG QD . . 3.260 2.520 2.040 2.875 . 0 0 "[ . 1 . 2]" 1
1301 1 84 ARG QB 1 85 LEU H . . 3.810 2.525 1.930 3.576 . 0 0 "[ . 1 . 2]" 1
1302 1 84 ARG HB2 1 84 ARG QD . . 3.750 3.179 2.096 3.539 . 0 0 "[ . 1 . 2]" 1
1303 1 84 ARG HB2 1 84 ARG QG . . 2.700 2.228 2.161 2.472 . 0 0 "[ . 1 . 2]" 1
1304 1 84 ARG HB2 1 85 LEU H . . 4.390 2.595 1.948 3.899 . 0 0 "[ . 1 . 2]" 1
1305 1 84 ARG HB3 1 84 ARG QD . . 3.750 2.731 2.217 3.459 . 0 0 "[ . 1 . 2]" 1
1306 1 84 ARG HB3 1 84 ARG QG . . 2.700 2.334 2.142 2.397 . 0 0 "[ . 1 . 2]" 1
1307 1 84 ARG HB3 1 85 LEU H . . 4.390 3.648 3.100 4.188 . 0 0 "[ . 1 . 2]" 1
1308 1 84 ARG QD 1 85 LEU H . . 4.990 4.683 2.608 5.037 0.047 11 0 "[ . 1 . 2]" 1
1309 1 84 ARG QG 1 85 LEU H . . 4.210 3.725 2.424 4.097 . 0 0 "[ . 1 . 2]" 1
1310 1 85 LEU H 1 85 LEU HB2 . . 4.130 2.479 2.236 2.714 . 0 0 "[ . 1 . 2]" 1
1311 1 85 LEU H 1 85 LEU QB . . 3.320 2.299 2.188 2.400 . 0 0 "[ . 1 . 2]" 1
1312 1 85 LEU H 1 85 LEU HB3 . . 4.130 2.956 2.308 3.641 . 0 0 "[ . 1 . 2]" 1
1313 1 85 LEU H 1 85 LEU QD . . 3.920 3.468 1.962 3.768 . 0 0 "[ . 1 . 2]" 1
1314 1 85 LEU H 1 85 LEU HG . . 4.590 3.969 2.440 4.590 0.000 10 0 "[ . 1 . 2]" 1
1315 1 85 LEU H 1 86 ALA MB . . 4.380 4.052 3.798 4.401 0.021 10 0 "[ . 1 . 2]" 1
1316 1 85 LEU HA 1 85 LEU QD . . 2.910 2.325 1.926 2.827 . 0 0 "[ . 1 . 2]" 1
1317 1 85 LEU HA 1 85 LEU HG . . 3.580 2.868 2.361 3.709 0.129 18 0 "[ . 1 . 2]" 1
1318 1 85 LEU HA 1 86 ALA HA . . 4.870 4.607 4.506 4.739 . 0 0 "[ . 1 . 2]" 1
1319 1 85 LEU HA 1 87 LYS H . . 4.350 3.744 3.611 3.884 . 0 0 "[ . 1 . 2]" 1
1320 1 85 LEU QB 1 86 ALA HA . . 4.680 4.202 3.867 4.438 . 0 0 "[ . 1 . 2]" 1
1321 1 85 LEU QB 1 86 ALA MB . . 4.200 3.858 3.710 3.987 . 0 0 "[ . 1 . 2]" 1
1322 1 85 LEU HB2 1 85 LEU QD . . 3.110 2.109 1.945 2.408 . 0 0 "[ . 1 . 2]" 1
1323 1 85 LEU HB3 1 85 LEU QD . . 3.110 2.094 1.973 2.353 . 0 0 "[ . 1 . 2]" 1
1324 1 85 LEU QD 1 86 ALA H . . 4.630 4.261 2.930 4.510 . 0 0 "[ . 1 . 2]" 1
1325 1 85 LEU QD 1 86 ALA HA . . 5.400 4.659 2.746 5.317 . 0 0 "[ . 1 . 2]" 1
1326 1 85 LEU QD 1 86 ALA MB . . 5.500 4.530 3.170 4.929 . 0 0 "[ . 1 . 2]" 1
1327 1 85 LEU HG 1 86 ALA H . . 4.850 4.699 3.777 5.110 0.260 18 0 "[ . 1 . 2]" 1
1328 1 86 ALA H 1 86 ALA MB . . 3.190 2.351 2.145 2.468 . 0 0 "[ . 1 . 2]" 1
1329 1 86 ALA H 1 87 LYS HA . . 4.730 4.452 4.194 4.791 0.061 18 0 "[ . 1 . 2]" 1
1330 1 86 ALA HA 1 87 LYS HA . . 5.500 5.159 5.055 5.234 . 0 0 "[ . 1 . 2]" 1
1331 1 86 ALA HA 1 87 LYS QB . . 4.940 4.322 4.121 4.790 . 0 0 "[ . 1 . 2]" 1
1332 1 86 ALA HA 1 87 LYS HD2 . . 5.500 4.578 2.838 5.663 0.163 16 0 "[ . 1 . 2]" 1
1333 1 86 ALA HA 1 87 LYS HD3 . . 5.500 4.478 2.770 5.483 . 0 0 "[ . 1 . 2]" 1
1334 1 86 ALA HA 1 87 LYS QG . . 4.530 3.831 3.067 4.668 0.138 11 0 "[ . 1 . 2]" 1
1335 1 86 ALA HA 1 88 GLN QG . . 4.930 3.957 3.745 4.498 . 0 0 "[ . 1 . 2]" 1
1336 1 86 ALA MB 1 87 LYS H . . 3.780 3.215 2.982 3.519 . 0 0 "[ . 1 . 2]" 1
1337 1 86 ALA MB 1 87 LYS QB . . 4.810 4.368 4.223 4.997 0.187 17 0 "[ . 1 . 2]" 1
1338 1 86 ALA MB 1 88 GLN H . . 3.900 2.777 2.457 3.242 . 0 0 "[ . 1 . 2]" 1
1339 1 86 ALA MB 1 88 GLN HB2 . . 3.630 3.123 2.669 3.322 . 0 0 "[ . 1 . 2]" 1
1340 1 86 ALA MB 1 88 GLN HB3 . . 4.990 4.417 4.173 4.548 . 0 0 "[ . 1 . 2]" 1
1341 1 86 ALA MB 1 88 GLN QE . . 4.750 3.533 2.390 4.765 0.015 15 0 "[ . 1 . 2]" 1
1342 1 86 ALA MB 1 88 GLN QG . . 3.670 2.349 2.033 3.131 . 0 0 "[ . 1 . 2]" 1
1343 1 86 ALA MB 1 89 ASN H . . 5.480 5.404 5.276 5.479 . 0 0 "[ . 1 . 2]" 1
1344 1 86 ALA MB 1 93 TYR HA . . 4.120 4.138 4.102 4.169 0.049 19 0 "[ . 1 . 2]" 1
1345 1 86 ALA MB 1 93 TYR QB . . 4.630 3.735 3.552 3.894 . 0 0 "[ . 1 . 2]" 1
1346 1 86 ALA MB 1 93 TYR QD . . 3.470 2.453 2.160 2.883 . 0 0 "[ . 1 . 2]" 1
1347 1 87 LYS H 1 87 LYS QB . . 3.510 3.371 2.992 3.448 . 0 0 "[ . 1 . 2]" 1
1348 1 87 LYS H 1 87 LYS QD . . 4.320 2.759 2.163 3.104 . 0 0 "[ . 1 . 2]" 1
1349 1 87 LYS H 1 87 LYS QE . . 4.790 3.788 1.923 4.710 . 0 0 "[ . 1 . 2]" 1
1350 1 87 LYS H 1 87 LYS QG . . 3.530 2.927 2.831 3.192 . 0 0 "[ . 1 . 2]" 1
1351 1 87 LYS HA 1 87 LYS HD2 . . 4.340 3.340 2.140 4.501 0.161 17 0 "[ . 1 . 2]" 1
1352 1 87 LYS HA 1 87 LYS QD . . 3.790 2.804 2.104 3.640 . 0 0 "[ . 1 . 2]" 1
1353 1 87 LYS HA 1 87 LYS HD3 . . 4.340 3.638 2.115 4.696 0.356 1 0 "[ . 1 . 2]" 1
1354 1 87 LYS HA 1 87 LYS QE . . 4.730 3.643 2.467 4.810 0.080 17 0 "[ . 1 . 2]" 1
1355 1 87 LYS HA 1 87 LYS QG . . 3.340 2.836 2.320 3.435 0.095 17 0 "[ . 1 . 2]" 1
1356 1 87 LYS QB 1 87 LYS QD . . 3.470 2.440 2.110 2.814 . 0 0 "[ . 1 . 2]" 1
1357 1 87 LYS QB 1 87 LYS QE . . 4.180 2.768 1.989 3.707 . 0 0 "[ . 1 . 2]" 1
1358 1 87 LYS QB 1 88 GLN H . . 4.490 3.773 3.650 3.994 . 0 0 "[ . 1 . 2]" 1
1359 1 87 LYS QE 1 87 LYS QG . . 3.150 2.332 1.937 2.812 . 0 0 "[ . 1 . 2]" 1
1360 1 87 LYS QE 1 88 GLN H . . 5.500 5.366 4.272 5.569 0.069 9 0 "[ . 1 . 2]" 1
1361 1 87 LYS QG 1 88 GLN H . . 4.760 4.546 4.140 4.660 . 0 0 "[ . 1 . 2]" 1
1362 1 88 GLN H 1 88 GLN QG . . 4.000 2.723 2.515 3.336 . 0 0 "[ . 1 . 2]" 1
1363 1 88 GLN HA 1 88 GLN QG . . 3.510 2.654 2.532 2.745 . 0 0 "[ . 1 . 2]" 1
1364 1 88 GLN HB2 1 89 ASN H . . 4.760 2.853 2.701 3.317 . 0 0 "[ . 1 . 2]" 1
1365 1 88 GLN HB2 1 89 ASN HB2 . . 5.130 4.757 4.586 5.265 0.135 17 0 "[ . 1 . 2]" 1
1366 1 88 GLN HB2 1 93 TYR HA . . 3.660 2.863 2.665 3.433 . 0 0 "[ . 1 . 2]" 1
1367 1 88 GLN HB2 1 93 TYR QB . . 4.190 3.432 3.206 3.929 . 0 0 "[ . 1 . 2]" 1
1368 1 88 GLN HB2 1 93 TYR QD . . 4.860 3.221 3.050 3.597 . 0 0 "[ . 1 . 2]" 1
1369 1 88 GLN HB3 1 89 ASN H . . 4.210 2.263 1.945 2.437 . 0 0 "[ . 1 . 2]" 1
1370 1 88 GLN HB3 1 89 ASN HB2 . . 4.700 4.145 3.797 4.298 . 0 0 "[ . 1 . 2]" 1
1371 1 88 GLN HB3 1 93 TYR H . . 5.500 5.032 4.682 5.209 . 0 0 "[ . 1 . 2]" 1
1372 1 88 GLN HB3 1 93 TYR HA . . 3.700 3.700 3.387 3.787 0.087 10 0 "[ . 1 . 2]" 1
1373 1 88 GLN HB3 1 93 TYR QB . . 5.340 4.718 4.336 4.855 . 0 0 "[ . 1 . 2]" 1
1374 1 88 GLN HB3 1 93 TYR QD . . 5.500 4.645 4.396 5.060 . 0 0 "[ . 1 . 2]" 1
1375 1 88 GLN QE 1 93 TYR HA . . 4.080 3.427 2.634 4.118 0.038 1 0 "[ . 1 . 2]" 1
1376 1 88 GLN QG 1 89 ASN H . . 4.570 4.128 3.955 4.197 . 0 0 "[ . 1 . 2]" 1
1377 1 88 GLN QG 1 93 TYR HA . . 4.250 4.060 3.895 4.259 0.009 17 0 "[ . 1 . 2]" 1
1378 1 89 ASN H 1 89 ASN HB2 . . 3.650 2.119 2.084 2.207 . 0 0 "[ . 1 . 2]" 1
1379 1 89 ASN H 1 89 ASN HB3 . . 3.480 3.356 3.257 3.506 0.026 10 0 "[ . 1 . 2]" 1
1380 1 89 ASN H 1 90 PRO QD . . 4.620 4.367 4.360 4.373 . 0 0 "[ . 1 . 2]" 1
1381 1 89 ASN H 1 92 GLN QG . . 4.860 3.844 2.163 4.455 . 0 0 "[ . 1 . 2]" 1
1382 1 89 ASN HB2 1 90 PRO QD . . 3.970 3.648 3.550 3.778 . 0 0 "[ . 1 . 2]" 1
1383 1 89 ASN HB2 1 92 GLN H . . 4.440 3.143 2.750 3.317 . 0 0 "[ . 1 . 2]" 1
1384 1 89 ASN HB2 1 92 GLN QB . . 3.620 2.199 1.972 3.430 . 0 0 "[ . 1 . 2]" 1
1385 1 89 ASN HB2 1 92 GLN QG . . 3.950 2.345 1.880 2.736 . 0 0 "[ . 1 . 2]" 1
1386 1 89 ASN HB3 1 90 PRO QD . . 3.820 2.448 2.088 2.680 . 0 0 "[ . 1 . 2]" 1
1387 1 89 ASN HB3 1 91 ALA HA . . 5.500 5.037 4.904 5.154 . 0 0 "[ . 1 . 2]" 1
1388 1 89 ASN HB3 1 91 ALA MB . . 4.550 3.551 3.162 3.749 . 0 0 "[ . 1 . 2]" 1
1389 1 89 ASN HB3 1 92 GLN H . . 4.440 2.138 1.952 2.587 . 0 0 "[ . 1 . 2]" 1
1390 1 89 ASN HB3 1 92 GLN QB . . 3.650 2.869 2.408 3.763 0.113 10 0 "[ . 1 . 2]" 1
1391 1 89 ASN HB3 1 92 GLN QG . . 4.090 2.172 1.968 3.171 . 0 0 "[ . 1 . 2]" 1
1392 1 89 ASN HB3 1 93 TYR H . . 4.070 3.798 3.572 4.113 0.043 10 0 "[ . 1 . 2]" 1
1393 1 89 ASN QD 1 90 PRO QD . . 4.600 2.985 1.854 4.008 . 0 0 "[ . 1 . 2]" 1
1394 1 89 ASN QD 1 92 GLN QG . . 4.580 3.190 1.984 4.538 . 0 0 "[ . 1 . 2]" 1
1395 1 90 PRO HA 1 91 ALA HA . . 5.500 4.634 4.628 4.643 . 0 0 "[ . 1 . 2]" 1
1396 1 90 PRO HA 1 93 TYR H . . 4.280 3.820 3.773 3.893 . 0 0 "[ . 1 . 2]" 1
1397 1 90 PRO HA 1 93 TYR QB . . 3.580 2.980 2.704 3.114 . 0 0 "[ . 1 . 2]" 1
1398 1 90 PRO HB2 1 91 ALA HA . . 5.220 4.181 4.154 4.242 . 0 0 "[ . 1 . 2]" 1
1399 1 90 PRO HB2 1 91 ALA MB . . 4.360 4.029 3.894 4.259 . 0 0 "[ . 1 . 2]" 1
1400 1 90 PRO HB3 1 91 ALA MB . . 5.500 5.242 5.167 5.383 . 0 0 "[ . 1 . 2]" 1
1401 1 90 PRO QD 1 91 ALA H . . 4.150 2.613 2.602 2.662 . 0 0 "[ . 1 . 2]" 1
1402 1 90 PRO QD 1 91 ALA HA . . 5.340 5.241 5.199 5.264 . 0 0 "[ . 1 . 2]" 1
1403 1 90 PRO QD 1 91 ALA MB . . 4.070 3.905 3.811 3.985 . 0 0 "[ . 1 . 2]" 1
1404 1 90 PRO QG 1 91 ALA HA . . 4.570 4.341 4.337 4.347 . 0 0 "[ . 1 . 2]" 1
1405 1 91 ALA H 1 91 ALA MB . . 3.230 2.271 2.145 2.328 . 0 0 "[ . 1 . 2]" 1
1406 1 91 ALA HA 1 92 GLN HA . . 5.500 4.624 4.607 4.691 . 0 0 "[ . 1 . 2]" 1
1407 1 91 ALA HA 1 93 TYR H . . 5.500 3.950 3.894 4.012 . 0 0 "[ . 1 . 2]" 1
1408 1 91 ALA HA 1 93 TYR QB . . 5.340 4.493 4.317 4.552 . 0 0 "[ . 1 . 2]" 1
1409 1 91 ALA HA 1 94 LEU H . . 5.500 4.661 4.429 4.927 . 0 0 "[ . 1 . 2]" 1
1410 1 91 ALA MB 1 92 GLN H . . 3.530 2.902 2.392 3.074 . 0 0 "[ . 1 . 2]" 1
1411 1 91 ALA MB 1 92 GLN QG . . 4.130 3.250 2.918 4.299 0.169 10 0 "[ . 1 . 2]" 1
1412 1 91 ALA MB 1 93 TYR H . . 4.540 4.395 4.107 4.485 . 0 0 "[ . 1 . 2]" 1
1413 1 92 GLN H 1 92 GLN QB . . 3.280 2.566 2.390 2.626 . 0 0 "[ . 1 . 2]" 1
1414 1 92 GLN H 1 92 GLN QG . . 3.620 2.284 2.134 2.527 . 0 0 "[ . 1 . 2]" 1
1415 1 92 GLN H 1 95 ALA MB . . 4.860 4.472 4.300 4.812 . 0 0 "[ . 1 . 2]" 1
1416 1 92 GLN HA 1 92 GLN QG . . 3.350 2.906 2.452 3.401 0.051 10 0 "[ . 1 . 2]" 1
1417 1 92 GLN HA 1 95 ALA H . . 4.650 3.370 3.008 3.673 . 0 0 "[ . 1 . 2]" 1
1418 1 92 GLN HA 1 95 ALA MB . . 3.070 2.152 1.970 2.387 . 0 0 "[ . 1 . 2]" 1
1419 1 92 GLN QB 1 92 GLN QG . . 2.290 2.039 1.980 2.086 . 0 0 "[ . 1 . 2]" 1
1420 1 92 GLN QB 1 95 ALA MB . . 3.790 3.649 3.234 3.801 0.011 8 0 "[ . 1 . 2]" 1
1421 1 92 GLN QB 1 96 GLN HA . . 3.930 3.183 2.799 3.843 . 0 0 "[ . 1 . 2]" 1
1422 1 92 GLN QB 1 96 GLN QG . . 5.340 4.259 3.822 5.145 . 0 0 "[ . 1 . 2]" 1
1423 1 92 GLN QB 1 97 HIS H . . 5.150 4.019 2.999 4.410 . 0 0 "[ . 1 . 2]" 1
1424 1 92 GLN QG 1 93 TYR H . . 4.150 3.866 2.614 4.160 0.010 5 0 "[ . 1 . 2]" 1
1425 1 93 TYR H 1 93 TYR HB2 . . 3.610 2.625 2.554 2.734 . 0 0 "[ . 1 . 2]" 1
1426 1 93 TYR H 1 93 TYR HB3 . . 3.610 2.448 2.364 2.513 . 0 0 "[ . 1 . 2]" 1
1427 1 93 TYR H 1 95 ALA MB . . 5.420 4.537 4.343 4.887 . 0 0 "[ . 1 . 2]" 1
1428 1 93 TYR HA 1 93 TYR QD . . 4.310 2.469 2.200 2.869 . 0 0 "[ . 1 . 2]" 1
1429 1 93 TYR QB 1 94 LEU QB . . 5.180 3.669 3.535 3.864 . 0 0 "[ . 1 . 2]" 1
1430 1 94 LEU H 1 95 ALA MB . . 4.230 3.966 3.863 4.042 . 0 0 "[ . 1 . 2]" 1
1431 1 94 LEU H 1 96 GLN QG . . 5.190 4.181 3.877 4.515 . 0 0 "[ . 1 . 2]" 1
1432 1 94 LEU HA 1 94 LEU QD . . 3.510 2.435 1.933 3.211 . 0 0 "[ . 1 . 2]" 1
1433 1 94 LEU HA 1 96 GLN QG . . 3.780 3.262 3.075 3.503 . 0 0 "[ . 1 . 2]" 1
1434 1 94 LEU QB 1 94 LEU QD . . 2.820 1.864 1.723 1.992 . 0 0 "[ . 1 . 2]" 1
1435 1 94 LEU QB 1 95 ALA H . . 4.030 2.546 2.235 2.782 . 0 0 "[ . 1 . 2]" 1
1436 1 94 LEU QB 1 95 ALA MB . . 4.150 3.902 3.758 4.055 . 0 0 "[ . 1 . 2]" 1
1437 1 94 LEU HB2 1 95 ALA H . . 4.630 3.745 3.055 4.021 . 0 0 "[ . 1 . 2]" 1
1438 1 94 LEU HB3 1 95 ALA H . . 4.630 2.612 2.254 3.085 . 0 0 "[ . 1 . 2]" 1
1439 1 95 ALA H 1 95 ALA MB . . 3.030 2.164 2.030 2.234 . 0 0 "[ . 1 . 2]" 1
1440 1 95 ALA HA 1 96 GLN QB . . 4.660 4.481 4.365 4.600 . 0 0 "[ . 1 . 2]" 1
1441 1 95 ALA HA 1 96 GLN QG . . 4.580 4.265 3.925 4.578 . 0 0 "[ . 1 . 2]" 1
1442 1 95 ALA HA 1 100 LEU QD . . 4.840 3.519 2.158 4.867 0.027 12 0 "[ . 1 . 2]" 1
1443 1 95 ALA MB 1 96 GLN H . . 3.590 2.154 2.050 2.339 . 0 0 "[ . 1 . 2]" 1
1444 1 95 ALA MB 1 96 GLN HA . . 4.070 3.902 3.796 4.056 . 0 0 "[ . 1 . 2]" 1
1445 1 95 ALA MB 1 96 GLN QB . . 5.340 4.369 4.319 4.406 . 0 0 "[ . 1 . 2]" 1
1446 1 95 ALA MB 1 96 GLN QG . . 4.190 4.048 3.932 4.206 0.016 19 0 "[ . 1 . 2]" 1
1447 1 95 ALA MB 1 97 HIS H . . 4.190 2.493 2.276 2.669 . 0 0 "[ . 1 . 2]" 1
1448 1 95 ALA MB 1 100 LEU HB2 . . 4.720 3.525 1.959 4.686 . 0 0 "[ . 1 . 2]" 1
1449 1 95 ALA MB 1 100 LEU HB3 . . 4.720 3.128 2.071 4.441 . 0 0 "[ . 1 . 2]" 1
1450 1 95 ALA MB 1 100 LEU HG . . 4.900 4.042 2.097 4.879 . 0 0 "[ . 1 . 2]" 1
1451 1 96 GLN H 1 96 GLN QB . . 3.870 3.357 3.295 3.424 . 0 0 "[ . 1 . 2]" 1
1452 1 96 GLN H 1 96 GLN QG . . 3.830 2.656 2.520 2.769 . 0 0 "[ . 1 . 2]" 1
1453 1 96 GLN HA 1 96 GLN QG . . 2.950 2.574 2.419 2.957 0.007 8 0 "[ . 1 . 2]" 1
1454 1 96 GLN QG 1 97 HIS H . . 5.500 4.445 4.261 4.562 . 0 0 "[ . 1 . 2]" 1
1455 1 97 HIS H 1 100 LEU QB . . 4.810 4.093 3.351 4.793 . 0 0 "[ . 1 . 2]" 1
1456 1 97 HIS H 1 100 LEU QD . . 5.300 4.482 2.040 5.241 . 0 0 "[ . 1 . 2]" 1
1457 1 97 HIS QB 1 100 LEU QB . . 3.710 2.791 1.829 3.771 0.061 12 0 "[ . 1 . 2]" 1
1458 1 97 HIS QB 1 100 LEU QD . . 3.390 2.937 2.056 3.400 0.010 10 0 "[ . 1 . 2]" 1
1459 1 97 HIS HB2 1 100 LEU QD . . 3.900 3.295 2.081 3.902 0.002 15 0 "[ . 1 . 2]" 1
1460 1 97 HIS HB3 1 100 LEU QD . . 3.900 3.492 2.088 3.902 0.002 5 0 "[ . 1 . 2]" 1
1461 1 97 HIS HD2 1 100 LEU QD . . 4.620 3.989 2.720 4.624 0.004 7 0 "[ . 1 . 2]" 1
1462 1 98 GLU H 1 98 GLU QG . . 4.040 3.486 2.222 4.036 . 0 0 "[ . 1 . 2]" 1
1463 1 98 GLU HA 1 98 GLU QG . . 3.440 2.869 2.364 3.459 0.019 17 0 "[ . 1 . 2]" 1
1464 1 98 GLU HA 1 99 GLN HA . . 5.500 4.834 4.713 4.892 . 0 0 "[ . 1 . 2]" 1
1465 1 98 GLU HA 1 100 LEU H . . 5.070 4.055 3.508 4.856 . 0 0 "[ . 1 . 2]" 1
1466 1 98 GLU HA 1 101 LEU H . . 5.360 4.277 3.093 5.363 0.003 13 0 "[ . 1 . 2]" 1
1467 1 98 GLU HA 1 101 LEU QB . . 3.860 3.247 1.990 3.880 0.020 12 0 "[ . 1 . 2]" 1
1468 1 98 GLU QG 1 99 GLN HA . . 4.210 3.393 3.035 3.826 . 0 0 "[ . 1 . 2]" 1
1469 1 98 GLU QG 1 99 GLN QG . . 3.980 3.685 2.880 3.985 0.005 13 0 "[ . 1 . 2]" 1
1470 1 98 GLU QG 1 101 LEU QB . . 4.300 3.989 3.269 4.333 0.033 12 0 "[ . 1 . 2]" 1
1471 1 99 GLN H 1 99 GLN QB . . 3.380 2.297 2.044 2.590 . 0 0 "[ . 1 . 2]" 1
1472 1 99 GLN H 1 99 GLN QG . . 3.700 2.627 2.089 3.446 . 0 0 "[ . 1 . 2]" 1
1473 1 99 GLN HA 1 99 GLN QG . . 3.660 2.394 2.102 2.721 . 0 0 "[ . 1 . 2]" 1
1474 1 99 GLN HA 1 100 LEU HA . . 4.990 4.668 4.557 4.886 . 0 0 "[ . 1 . 2]" 1
1475 1 99 GLN HA 1 101 LEU H . . 4.500 3.953 3.508 4.485 . 0 0 "[ . 1 . 2]" 1
1476 1 99 GLN QB 1 100 LEU H . . 3.850 2.765 2.323 3.053 . 0 0 "[ . 1 . 2]" 1
1477 1 99 GLN QB 1 100 LEU QB . . 4.360 3.940 3.582 4.340 . 0 0 "[ . 1 . 2]" 1
1478 1 100 LEU H 1 100 LEU HB2 . . 3.920 2.405 2.112 3.569 . 0 0 "[ . 1 . 2]" 1
1479 1 100 LEU H 1 100 LEU QB . . 3.250 2.264 2.073 2.473 . 0 0 "[ . 1 . 2]" 1
1480 1 100 LEU H 1 100 LEU HB3 . . 3.920 3.132 2.381 3.656 . 0 0 "[ . 1 . 2]" 1
1481 1 100 LEU H 1 100 LEU QD . . 3.750 3.029 2.007 3.755 0.005 15 0 "[ . 1 . 2]" 1
1482 1 100 LEU HA 1 100 LEU QD . . 3.280 2.214 1.919 3.298 0.018 7 0 "[ . 1 . 2]" 1
1483 1 100 LEU HA 1 103 ASP H . . 5.500 4.767 3.811 5.702 0.202 15 0 "[ . 1 . 2]" 1
1484 1 100 LEU HA 1 103 ASP QB . . 4.500 3.837 2.544 4.525 0.025 14 0 "[ . 1 . 2]" 1
1485 1 100 LEU QB 1 100 LEU QD . . 2.720 1.919 1.784 2.042 . 0 0 "[ . 1 . 2]" 1
1486 1 100 LEU HB2 1 100 LEU QD . . 3.200 2.119 2.011 2.290 . 0 0 "[ . 1 . 2]" 1
1487 1 100 LEU HB3 1 100 LEU QD . . 3.200 2.209 1.966 2.345 . 0 0 "[ . 1 . 2]" 1
1488 1 101 LEU H 1 101 LEU HB2 . . 4.120 2.632 2.048 3.714 . 0 0 "[ . 1 . 2]" 1
1489 1 101 LEU H 1 101 LEU QB . . 3.480 2.311 2.030 2.791 . 0 0 "[ . 1 . 2]" 1
1490 1 101 LEU H 1 101 LEU HB3 . . 4.120 2.800 2.331 3.422 . 0 0 "[ . 1 . 2]" 1
1491 1 101 LEU H 1 101 LEU QD . . 4.000 3.335 1.893 3.910 . 0 0 "[ . 1 . 2]" 1
1492 1 101 LEU HA 1 101 LEU QD . . 3.500 2.569 1.937 3.381 . 0 0 "[ . 1 . 2]" 1
1493 1 101 LEU QB 1 101 LEU QD . . 2.650 1.887 1.730 2.038 . 0 0 "[ . 1 . 2]" 1
1494 1 101 LEU QD 1 102 LEU H . . 4.030 2.864 1.869 3.702 . 0 0 "[ . 1 . 2]" 1
1495 1 101 LEU QD 1 102 LEU HA . . 4.630 3.856 2.779 4.600 . 0 0 "[ . 1 . 2]" 1
1496 1 101 LEU QD 1 103 ASP H . . 5.010 4.541 1.815 5.051 0.041 14 0 "[ . 1 . 2]" 1
1497 1 101 LEU QD 1 103 ASP QB . . 5.500 5.199 2.717 5.505 0.005 4 0 "[ . 1 . 2]" 1
1498 1 102 LEU H 1 102 LEU QB . . 3.890 2.715 2.128 3.228 . 0 0 "[ . 1 . 2]" 1
1499 1 102 LEU HA 1 102 LEU QD . . 3.160 2.402 1.916 3.255 0.095 12 0 "[ . 1 . 2]" 1
1500 1 102 LEU HA 1 102 LEU HG . . 3.850 2.939 2.233 3.698 . 0 0 "[ . 1 . 2]" 1
1501 1 102 LEU HA 1 103 ASP QB . . 5.210 4.453 4.037 4.946 . 0 0 "[ . 1 . 2]" 1
1502 1 102 LEU HA 1 104 ALA MB . . 4.880 4.424 3.823 4.881 0.001 7 0 "[ . 1 . 2]" 1
1503 1 102 LEU QB 1 102 LEU HG . . 2.570 2.380 2.167 2.493 . 0 0 "[ . 1 . 2]" 1
1504 1 102 LEU QB 1 103 ASP H . . 5.110 3.358 1.947 3.950 . 0 0 "[ . 1 . 2]" 1
1505 1 102 LEU QB 1 104 ALA HA . . 5.500 5.256 4.652 5.604 0.104 12 0 "[ . 1 . 2]" 1
1506 1 102 LEU QB 1 104 ALA MB . . 3.570 3.320 2.461 3.574 0.004 4 0 "[ . 1 . 2]" 1
1507 1 103 ASP H 1 103 ASP QB . . 3.740 2.542 2.214 3.192 . 0 0 "[ . 1 . 2]" 1
1508 1 104 ALA MB 1 105 SER H . . 4.710 2.461 2.047 3.563 . 0 0 "[ . 1 . 2]" 1
1509 1 104 ALA MB 1 105 SER HA . . 4.030 3.834 3.613 4.053 0.023 17 0 "[ . 1 . 2]" 1
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