NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
576553 |
2mfi   |
19550 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mfi
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 1576
_Distance_constraint_stats_list.Viol_count 508
_Distance_constraint_stats_list.Viol_total 109.337
_Distance_constraint_stats_list.Viol_max 0.280
_Distance_constraint_stats_list.Viol_rms 0.0068
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0007
_Distance_constraint_stats_list.Viol_average_violations_only 0.0215
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 ILE 0.015 0.015 9 0 "[ . 1]"
1 3 ASP 0.000 0.000 . 0 "[ . 1]"
1 4 PRO 0.000 0.000 . 0 "[ . 1]"
1 5 PHE 0.328 0.170 5 0 "[ . 1]"
1 6 THR 0.393 0.170 5 0 "[ . 1]"
1 7 GLU 0.090 0.090 6 0 "[ . 1]"
1 8 SER 0.000 0.000 . 0 "[ . 1]"
1 9 LEU 0.015 0.007 7 0 "[ . 1]"
1 10 LYS 0.015 0.007 7 0 "[ . 1]"
1 11 GLU 0.000 0.000 . 0 "[ . 1]"
1 12 ILE 0.000 0.000 . 0 "[ . 1]"
1 13 GLU 0.088 0.019 1 0 "[ . 1]"
1 14 THR 0.076 0.019 1 0 "[ . 1]"
1 15 ARG 0.131 0.065 7 0 "[ . 1]"
1 16 PRO 0.000 0.000 . 0 "[ . 1]"
1 17 GLY 0.000 0.000 . 0 "[ . 1]"
1 18 SER 0.007 0.003 8 0 "[ . 1]"
1 19 ILE 0.022 0.012 6 0 "[ . 1]"
1 20 VAL 0.027 0.012 6 0 "[ . 1]"
1 21 ARG 0.036 0.005 10 0 "[ . 1]"
1 22 GLY 0.016 0.005 8 0 "[ . 1]"
1 23 VAL 0.444 0.031 8 0 "[ . 1]"
1 24 VAL 0.851 0.169 8 0 "[ . 1]"
1 25 VAL 0.106 0.016 10 0 "[ . 1]"
1 26 ALA 0.301 0.049 7 0 "[ . 1]"
1 27 ILE 0.353 0.045 8 0 "[ . 1]"
1 28 ASP 0.002 0.002 9 0 "[ . 1]"
1 29 LYS 0.043 0.017 5 0 "[ . 1]"
1 30 ASP 0.109 0.030 8 0 "[ . 1]"
1 31 VAL 0.190 0.038 3 0 "[ . 1]"
1 32 VAL 0.207 0.036 3 0 "[ . 1]"
1 33 LEU 0.404 0.024 3 0 "[ . 1]"
1 34 VAL 0.498 0.049 7 0 "[ . 1]"
1 35 ASP 0.191 0.038 10 0 "[ . 1]"
1 36 ALA 0.488 0.145 7 0 "[ . 1]"
1 37 GLY 0.532 0.280 7 0 "[ . 1]"
1 38 LEU 1.033 0.280 7 0 "[ . 1]"
1 39 LYS 0.012 0.009 3 0 "[ . 1]"
1 40 SER 0.018 0.016 10 0 "[ . 1]"
1 41 GLU 0.092 0.021 3 0 "[ . 1]"
1 42 SER 0.091 0.015 3 0 "[ . 1]"
1 43 ALA 0.278 0.038 3 0 "[ . 1]"
1 44 ILE 0.269 0.024 3 0 "[ . 1]"
1 45 PRO 0.006 0.004 7 0 "[ . 1]"
1 46 ALA 0.129 0.030 8 0 "[ . 1]"
1 47 GLU 0.302 0.068 5 0 "[ . 1]"
1 48 GLN 0.862 0.066 8 0 "[ . 1]"
1 49 PHE 0.503 0.061 9 0 "[ . 1]"
1 50 LYS 2.009 0.098 8 0 "[ . 1]"
1 51 ASN 0.043 0.017 5 0 "[ . 1]"
1 52 ALA 0.024 0.016 8 0 "[ . 1]"
1 53 GLN 0.051 0.016 8 0 "[ . 1]"
1 54 GLY 0.038 0.038 9 0 "[ . 1]"
1 55 GLU 0.057 0.013 8 0 "[ . 1]"
1 56 LEU 1.018 0.071 6 0 "[ . 1]"
1 57 GLU 0.774 0.098 8 0 "[ . 1]"
1 58 ILE 0.840 0.071 2 0 "[ . 1]"
1 59 GLN 0.259 0.035 3 0 "[ . 1]"
1 60 VAL 0.669 0.169 8 0 "[ . 1]"
1 61 GLY 0.097 0.031 8 0 "[ . 1]"
1 62 ASP 0.299 0.027 10 0 "[ . 1]"
1 63 GLU 0.037 0.004 5 0 "[ . 1]"
1 64 VAL 0.079 0.020 8 0 "[ . 1]"
1 65 ASP 0.026 0.009 6 0 "[ . 1]"
1 66 VAL 0.027 0.006 8 0 "[ . 1]"
1 67 ALA 0.010 0.005 8 0 "[ . 1]"
1 68 LEU 0.094 0.031 7 0 "[ . 1]"
1 69 ASP 0.088 0.031 7 0 "[ . 1]"
1 70 ALA 0.000 0.000 . 0 "[ . 1]"
1 71 VAL 0.000 0.000 . 0 "[ . 1]"
1 72 GLU 0.000 0.000 . 0 "[ . 1]"
1 73 ASP 0.005 0.005 2 0 "[ . 1]"
1 74 GLY 0.005 0.005 2 0 "[ . 1]"
1 75 PHE 0.000 0.000 9 0 "[ . 1]"
1 76 GLY 0.002 0.002 9 0 "[ . 1]"
1 77 GLU 0.002 0.002 9 0 "[ . 1]"
1 78 THR 0.000 0.000 . 0 "[ . 1]"
1 79 LEU 0.000 0.000 . 0 "[ . 1]"
1 80 LEU 0.000 0.000 . 0 "[ . 1]"
1 81 SER 0.000 0.000 . 0 "[ . 1]"
1 83 GLU 0.000 0.000 . 0 "[ . 1]"
1 84 LYS 0.000 0.000 . 0 "[ . 1]"
1 85 ALA 0.132 0.132 9 0 "[ . 1]"
1 86 LYS 0.266 0.133 7 0 "[ . 1]"
1 87 ARG 0.000 0.000 4 0 "[ . 1]"
1 88 HIS 0.000 0.000 . 0 "[ . 1]"
1 89 GLU 0.269 0.085 8 0 "[ . 1]"
1 90 ALA 0.308 0.085 8 0 "[ . 1]"
1 91 TRP 0.103 0.083 4 0 "[ . 1]"
1 92 ILE 0.563 0.181 10 0 "[ . 1]"
1 93 THR 0.764 0.181 10 0 "[ . 1]"
1 94 LEU 1.376 0.215 9 0 "[ . 1]"
1 95 GLU 1.104 0.215 9 0 "[ . 1]"
1 96 LYS 0.036 0.036 6 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 ILE H 1 2 ILE HB . . 3.510 2.871 2.545 3.525 0.015 9 0 "[ . 1]" 1
2 1 2 ILE H 1 2 ILE MD . . 4.760 3.932 2.858 4.555 . 0 0 "[ . 1]" 1
3 1 2 ILE HA 1 3 ASP H . . 3.250 2.428 2.139 3.013 . 0 0 "[ . 1]" 1
4 1 2 ILE MG 1 3 ASP QB . . 4.370 3.984 2.706 4.367 . 0 0 "[ . 1]" 1
5 1 2 ILE MG 1 4 PRO QD . . 5.110 3.188 1.885 4.876 . 0 0 "[ . 1]" 1
6 1 3 ASP H 1 3 ASP HB2 . . 3.950 3.396 2.910 3.944 . 0 0 "[ . 1]" 1
7 1 3 ASP H 1 3 ASP QB . . 3.410 3.055 2.828 3.402 . 0 0 "[ . 1]" 1
8 1 3 ASP H 1 3 ASP HB3 . . 3.950 3.567 3.140 3.948 . 0 0 "[ . 1]" 1
9 1 3 ASP H 1 4 PRO QD . . 4.120 2.544 2.399 2.743 . 0 0 "[ . 1]" 1
10 1 3 ASP H 1 4 PRO QG . . 4.780 4.497 4.363 4.682 . 0 0 "[ . 1]" 1
11 1 3 ASP HA 1 4 PRO HD2 . . 3.410 2.093 2.071 2.128 . 0 0 "[ . 1]" 1
12 1 3 ASP HA 1 4 PRO QD . . 2.960 2.050 2.029 2.084 . 0 0 "[ . 1]" 1
13 1 3 ASP HA 1 4 PRO HD3 . . 3.410 2.933 2.902 2.981 . 0 0 "[ . 1]" 1
14 1 3 ASP QB 1 4 PRO QD . . 4.710 3.781 3.681 3.834 . 0 0 "[ . 1]" 1
15 1 4 PRO QB 1 5 PHE QD . . 4.790 2.691 2.032 3.582 . 0 0 "[ . 1]" 1
16 1 4 PRO QB 1 5 PHE QE . . 5.340 4.156 3.259 5.074 . 0 0 "[ . 1]" 1
17 1 4 PRO QD 1 5 PHE H . . 3.970 2.660 2.617 2.787 . 0 0 "[ . 1]" 1
18 1 4 PRO QD 1 5 PHE QD . . 4.930 4.021 3.219 4.513 . 0 0 "[ . 1]" 1
19 1 4 PRO QD 1 5 PHE QE . . 5.350 4.294 2.661 4.939 . 0 0 "[ . 1]" 1
20 1 4 PRO QG 1 5 PHE H . . 4.030 2.147 1.935 3.006 . 0 0 "[ . 1]" 1
21 1 4 PRO QG 1 5 PHE QD . . 4.580 2.318 1.978 2.823 . 0 0 "[ . 1]" 1
22 1 4 PRO QG 1 5 PHE QE . . 5.350 3.001 2.645 3.336 . 0 0 "[ . 1]" 1
23 1 5 PHE H 1 5 PHE HB2 . . 3.970 3.830 3.602 3.995 0.025 6 0 "[ . 1]" 1
24 1 5 PHE H 1 5 PHE QB . . 3.260 3.081 2.834 3.245 . 0 0 "[ . 1]" 1
25 1 5 PHE H 1 5 PHE HB3 . . 3.970 3.255 2.955 3.458 . 0 0 "[ . 1]" 1
26 1 5 PHE H 1 6 THR H . . 4.680 3.034 1.903 4.460 . 0 0 "[ . 1]" 1
27 1 5 PHE HA 1 5 PHE QD . . 3.860 3.708 3.632 3.728 . 0 0 "[ . 1]" 1
28 1 5 PHE HA 1 6 THR H . . 3.380 2.853 2.274 3.550 0.170 5 0 "[ . 1]" 1
29 1 5 PHE QB 1 6 THR H . . 4.090 3.278 2.408 4.031 . 0 0 "[ . 1]" 1
30 1 5 PHE QD 1 6 THR HA . . 5.500 3.601 3.083 4.324 . 0 0 "[ . 1]" 1
31 1 5 PHE QD 1 6 THR MG . . 5.050 3.977 1.988 4.835 . 0 0 "[ . 1]" 1
32 1 5 PHE QE 1 6 THR HA . . 5.500 4.807 4.344 5.319 . 0 0 "[ . 1]" 1
33 1 5 PHE QE 1 6 THR MG . . 5.500 4.486 2.077 5.572 0.072 6 0 "[ . 1]" 1
34 1 6 THR H 1 6 THR MG . . 4.000 3.268 2.246 3.855 . 0 0 "[ . 1]" 1
35 1 6 THR H 1 7 GLU H . . 3.660 2.846 1.880 3.387 . 0 0 "[ . 1]" 1
36 1 6 THR H 1 7 GLU QG . . 4.430 3.655 2.893 4.279 . 0 0 "[ . 1]" 1
37 1 6 THR HA 1 6 THR MG . . 3.280 2.238 1.976 3.187 . 0 0 "[ . 1]" 1
38 1 6 THR HA 1 7 GLU H . . 3.190 2.780 2.284 3.280 0.090 6 0 "[ . 1]" 1
39 1 6 THR MG 1 7 GLU H . . 4.750 4.077 2.693 4.386 . 0 0 "[ . 1]" 1
40 1 7 GLU H 1 7 GLU HB2 . . 4.000 2.877 2.184 3.829 . 0 0 "[ . 1]" 1
41 1 7 GLU H 1 7 GLU QB . . 3.310 2.575 2.163 2.966 . 0 0 "[ . 1]" 1
42 1 7 GLU H 1 7 GLU HB3 . . 4.000 3.414 2.800 3.848 . 0 0 "[ . 1]" 1
43 1 7 GLU H 1 7 GLU QG . . 4.040 2.419 1.979 3.232 . 0 0 "[ . 1]" 1
44 1 7 GLU HA 1 8 SER H . . 3.230 2.372 2.149 2.719 . 0 0 "[ . 1]" 1
45 1 7 GLU QB 1 8 SER H . . 4.160 2.637 1.965 3.754 . 0 0 "[ . 1]" 1
46 1 7 GLU QB 1 8 SER QB . . 5.340 4.573 3.906 5.007 . 0 0 "[ . 1]" 1
47 1 8 SER H 1 8 SER QB . . 3.490 2.877 2.299 3.449 . 0 0 "[ . 1]" 1
48 1 8 SER HA 1 9 LEU H . . 3.280 2.354 2.138 2.690 . 0 0 "[ . 1]" 1
49 1 8 SER QB 1 9 LEU H . . 4.170 3.295 2.046 3.950 . 0 0 "[ . 1]" 1
50 1 9 LEU H 1 9 LEU QB . . 3.580 2.389 2.164 2.892 . 0 0 "[ . 1]" 1
51 1 9 LEU H 1 9 LEU QD . . 4.500 3.240 2.224 4.074 . 0 0 "[ . 1]" 1
52 1 9 LEU HA 1 9 LEU MD1 . . 4.440 3.070 1.998 3.868 . 0 0 "[ . 1]" 1
53 1 9 LEU HA 1 9 LEU QD . . 3.820 2.451 1.915 2.912 . 0 0 "[ . 1]" 1
54 1 9 LEU HA 1 9 LEU MD2 . . 4.440 2.934 2.251 3.843 . 0 0 "[ . 1]" 1
55 1 9 LEU HA 1 9 LEU HG . . 4.010 2.771 2.276 3.698 . 0 0 "[ . 1]" 1
56 1 9 LEU HA 1 10 LYS H . . 3.450 2.412 2.138 3.457 0.007 7 0 "[ . 1]" 1
57 1 9 LEU QB 1 10 LYS HA . . 5.340 4.270 3.956 4.594 . 0 0 "[ . 1]" 1
58 1 10 LYS H 1 10 LYS HB2 . . 3.870 3.304 2.487 3.794 . 0 0 "[ . 1]" 1
59 1 10 LYS H 1 10 LYS QB . . 3.390 2.713 2.291 3.015 . 0 0 "[ . 1]" 1
60 1 10 LYS H 1 10 LYS HB3 . . 3.870 2.910 2.581 3.189 . 0 0 "[ . 1]" 1
61 1 10 LYS H 1 10 LYS HE2 . . 5.500 5.071 3.831 5.462 . 0 0 "[ . 1]" 1
62 1 10 LYS H 1 10 LYS HE3 . . 5.500 4.480 2.379 5.445 . 0 0 "[ . 1]" 1
63 1 10 LYS H 1 10 LYS HG2 . . 5.100 3.356 1.986 4.894 . 0 0 "[ . 1]" 1
64 1 10 LYS H 1 10 LYS HG3 . . 5.100 3.907 2.636 4.824 . 0 0 "[ . 1]" 1
65 1 10 LYS H 1 11 GLU H . . 3.560 3.180 2.447 3.559 . 0 0 "[ . 1]" 1
66 1 10 LYS H 1 11 GLU QB . . 5.340 4.235 3.735 4.813 . 0 0 "[ . 1]" 1
67 1 10 LYS HA 1 11 GLU H . . 3.110 2.629 2.216 2.935 . 0 0 "[ . 1]" 1
68 1 10 LYS QB 1 10 LYS QE . . 4.110 2.861 2.058 3.525 . 0 0 "[ . 1]" 1
69 1 10 LYS QG 1 11 GLU H . . 4.350 3.971 3.508 4.241 . 0 0 "[ . 1]" 1
70 1 10 LYS QG 1 11 GLU HA . . 4.240 4.111 3.916 4.219 . 0 0 "[ . 1]" 1
71 1 11 GLU H 1 11 GLU HB2 . . 4.050 2.789 2.234 3.327 . 0 0 "[ . 1]" 1
72 1 11 GLU H 1 11 GLU QB . . 3.470 2.451 2.210 2.820 . 0 0 "[ . 1]" 1
73 1 11 GLU H 1 11 GLU HB3 . . 4.050 2.886 2.448 3.612 . 0 0 "[ . 1]" 1
74 1 11 GLU HA 1 12 ILE H . . 3.450 2.243 2.148 2.373 . 0 0 "[ . 1]" 1
75 1 11 GLU HA 1 12 ILE HB . . 4.910 4.669 4.554 4.780 . 0 0 "[ . 1]" 1
76 1 11 GLU HA 1 12 ILE MD . . 4.610 4.218 2.945 4.608 . 0 0 "[ . 1]" 1
77 1 11 GLU HA 1 12 ILE QG . . 4.160 3.522 3.307 4.108 . 0 0 "[ . 1]" 1
78 1 11 GLU QB 1 12 ILE H . . 3.880 3.376 2.459 3.761 . 0 0 "[ . 1]" 1
79 1 12 ILE H 1 12 ILE HB . . 3.910 2.648 2.567 2.755 . 0 0 "[ . 1]" 1
80 1 12 ILE H 1 12 ILE MD . . 4.630 3.457 1.993 3.933 . 0 0 "[ . 1]" 1
81 1 12 ILE H 1 12 ILE HG12 . . 4.190 3.386 2.126 4.175 . 0 0 "[ . 1]" 1
82 1 12 ILE H 1 12 ILE QG . . 3.660 2.613 2.112 2.940 . 0 0 "[ . 1]" 1
83 1 12 ILE H 1 12 ILE HG13 . . 4.190 3.238 2.673 4.140 . 0 0 "[ . 1]" 1
84 1 12 ILE H 1 12 ILE MG . . 4.440 3.843 3.783 3.903 . 0 0 "[ . 1]" 1
85 1 12 ILE H 1 13 GLU H . . 4.620 4.229 3.726 4.438 . 0 0 "[ . 1]" 1
86 1 12 ILE HA 1 12 ILE QG . . 3.720 2.670 2.369 3.029 . 0 0 "[ . 1]" 1
87 1 12 ILE HA 1 12 ILE MG . . 3.400 2.281 2.197 2.347 . 0 0 "[ . 1]" 1
88 1 12 ILE HA 1 13 GLU H . . 2.910 2.176 2.140 2.323 . 0 0 "[ . 1]" 1
89 1 12 ILE HA 1 13 GLU QB . . 5.030 4.541 4.365 4.791 . 0 0 "[ . 1]" 1
90 1 12 ILE HA 1 13 GLU QG . . 4.010 3.789 3.607 3.992 . 0 0 "[ . 1]" 1
91 1 12 ILE HA 1 14 THR H . . 4.170 3.599 3.366 4.070 . 0 0 "[ . 1]" 1
92 1 12 ILE QG 1 13 GLU H . . 5.180 4.469 4.071 4.805 . 0 0 "[ . 1]" 1
93 1 12 ILE MG 1 13 GLU H . . 4.020 2.849 2.173 3.483 . 0 0 "[ . 1]" 1
94 1 12 ILE MG 1 14 THR H . . 3.850 2.333 2.004 3.574 . 0 0 "[ . 1]" 1
95 1 12 ILE MG 1 14 THR HA . . 5.330 4.336 3.277 5.105 . 0 0 "[ . 1]" 1
96 1 13 GLU H 1 13 GLU HB2 . . 3.800 3.200 2.429 3.812 0.012 6 0 "[ . 1]" 1
97 1 13 GLU H 1 13 GLU QB . . 3.170 2.796 2.393 3.031 . 0 0 "[ . 1]" 1
98 1 13 GLU H 1 13 GLU HB3 . . 3.800 3.434 3.070 3.791 . 0 0 "[ . 1]" 1
99 1 13 GLU H 1 13 GLU QG . . 4.120 2.354 2.051 3.000 . 0 0 "[ . 1]" 1
100 1 13 GLU H 1 14 THR H . . 3.460 2.388 1.977 2.739 . 0 0 "[ . 1]" 1
101 1 13 GLU HA 1 13 GLU QG . . 3.660 2.969 2.524 3.339 . 0 0 "[ . 1]" 1
102 1 13 GLU HA 1 14 THR H . . 3.420 3.119 2.758 3.439 0.019 1 0 "[ . 1]" 1
103 1 13 GLU QB 1 14 THR H . . 4.060 3.617 2.965 4.042 . 0 0 "[ . 1]" 1
104 1 13 GLU HB2 1 14 THR H . . 4.640 3.890 3.050 4.451 . 0 0 "[ . 1]" 1
105 1 13 GLU HB3 1 14 THR H . . 4.640 4.392 3.963 4.637 . 0 0 "[ . 1]" 1
106 1 13 GLU QG 1 14 THR H . . 4.360 3.866 2.423 4.360 . 0 0 "[ . 1]" 1
107 1 14 THR H 1 14 THR HB . . 3.610 3.197 2.581 3.607 . 0 0 "[ . 1]" 1
108 1 14 THR H 1 14 THR MG . . 3.970 2.742 2.112 3.914 . 0 0 "[ . 1]" 1
109 1 14 THR HA 1 14 THR MG . . 3.380 2.643 2.004 3.206 . 0 0 "[ . 1]" 1
110 1 14 THR HA 1 15 ARG H . . 2.970 2.343 2.148 2.665 . 0 0 "[ . 1]" 1
111 1 15 ARG H 1 15 ARG HB2 . . 4.000 2.845 2.225 3.833 . 0 0 "[ . 1]" 1
112 1 15 ARG H 1 15 ARG HB3 . . 4.000 3.652 3.449 4.065 0.065 7 0 "[ . 1]" 1
113 1 15 ARG H 1 16 PRO HD3 . . 5.250 4.907 4.495 5.088 . 0 0 "[ . 1]" 1
114 1 15 ARG HA 1 15 ARG HD2 . . 5.500 4.027 2.690 4.713 . 0 0 "[ . 1]" 1
115 1 15 ARG HA 1 15 ARG QD . . 4.750 3.473 2.640 4.426 . 0 0 "[ . 1]" 1
116 1 15 ARG HA 1 15 ARG HD3 . . 5.500 4.027 2.884 5.495 . 0 0 "[ . 1]" 1
117 1 15 ARG HA 1 15 ARG QG . . 3.650 2.462 2.111 3.436 . 0 0 "[ . 1]" 1
118 1 15 ARG HA 1 16 PRO HD2 . . 3.260 2.500 2.462 2.511 . 0 0 "[ . 1]" 1
119 1 15 ARG HA 1 16 PRO HD3 . . 3.100 2.343 2.324 2.348 . 0 0 "[ . 1]" 1
120 1 15 ARG HA 1 16 PRO HG2 . . 5.120 4.594 4.563 4.604 . 0 0 "[ . 1]" 1
121 1 15 ARG HA 1 16 PRO QG . . 4.280 4.066 4.041 4.073 . 0 0 "[ . 1]" 1
122 1 15 ARG HA 1 16 PRO HG3 . . 5.120 4.535 4.510 4.542 . 0 0 "[ . 1]" 1
123 1 15 ARG QB 1 15 ARG QD . . 3.230 2.251 2.082 2.447 . 0 0 "[ . 1]" 1
124 1 15 ARG QB 1 16 PRO HD2 . . 3.700 2.067 1.951 2.267 . 0 0 "[ . 1]" 1
125 1 15 ARG QB 1 16 PRO HD3 . . 4.260 3.397 3.241 3.554 . 0 0 "[ . 1]" 1
126 1 15 ARG QB 1 16 PRO QG . . 4.790 3.518 3.461 3.638 . 0 0 "[ . 1]" 1
127 1 15 ARG HB2 1 16 PRO HD2 . . 4.280 3.289 1.979 3.655 . 0 0 "[ . 1]" 1
128 1 15 ARG HB3 1 16 PRO HD2 . . 4.280 2.282 2.005 2.969 . 0 0 "[ . 1]" 1
129 1 15 ARG QG 1 16 PRO HD2 . . 4.330 2.610 1.997 3.960 . 0 0 "[ . 1]" 1
130 1 15 ARG HG2 1 16 PRO HD2 . . 5.040 3.160 2.359 4.769 . 0 0 "[ . 1]" 1
131 1 15 ARG HG3 1 16 PRO HD2 . . 5.040 3.133 2.012 4.235 . 0 0 "[ . 1]" 1
132 1 16 PRO HA 1 17 GLY H . . 3.080 2.354 2.163 2.639 . 0 0 "[ . 1]" 1
133 1 16 PRO QB 1 17 GLY H . . 3.970 2.712 2.061 3.284 . 0 0 "[ . 1]" 1
134 1 16 PRO QG 1 17 GLY H . . 4.650 4.268 3.765 4.649 . 0 0 "[ . 1]" 1
135 1 17 GLY H 1 18 SER H . . 3.850 2.986 1.905 3.766 . 0 0 "[ . 1]" 1
136 1 17 GLY QA 1 18 SER H . . 3.130 2.372 2.108 2.864 . 0 0 "[ . 1]" 1
137 1 17 GLY HA2 1 18 SER HA . . 5.500 4.601 4.388 5.272 . 0 0 "[ . 1]" 1
138 1 17 GLY HA2 1 19 ILE H . . 5.500 4.765 4.171 5.262 . 0 0 "[ . 1]" 1
139 1 17 GLY HA2 1 19 ILE MD . . 5.500 4.828 3.904 5.498 . 0 0 "[ . 1]" 1
140 1 17 GLY HA3 1 18 SER HA . . 5.500 4.567 4.352 5.329 . 0 0 "[ . 1]" 1
141 1 17 GLY HA3 1 19 ILE H . . 5.500 4.547 3.890 5.029 . 0 0 "[ . 1]" 1
142 1 17 GLY HA3 1 19 ILE MD . . 5.500 4.278 2.723 5.141 . 0 0 "[ . 1]" 1
143 1 18 SER H 1 18 SER HB2 . . 4.210 2.882 2.514 3.573 . 0 0 "[ . 1]" 1
144 1 18 SER H 1 19 ILE H . . 3.610 3.383 2.828 3.613 0.003 8 0 "[ . 1]" 1
145 1 18 SER H 1 19 ILE MD . . 5.480 4.299 4.066 4.914 . 0 0 "[ . 1]" 1
146 1 18 SER H 1 19 ILE QG . . 4.970 3.312 2.935 3.963 . 0 0 "[ . 1]" 1
147 1 18 SER HA 1 19 ILE H . . 2.970 2.504 2.402 2.651 . 0 0 "[ . 1]" 1
148 1 18 SER HA 1 19 ILE HB . . 5.490 5.132 5.046 5.265 . 0 0 "[ . 1]" 1
149 1 18 SER HA 1 19 ILE MD . . 5.500 5.403 4.690 5.501 0.001 9 0 "[ . 1]" 1
150 1 18 SER HA 1 68 LEU HB2 . . 4.190 4.084 3.741 4.191 0.001 4 0 "[ . 1]" 1
151 1 18 SER HA 1 68 LEU QD . . 3.880 3.502 3.302 3.881 0.001 10 0 "[ . 1]" 1
152 1 18 SER HB2 1 19 ILE H . . 4.700 4.395 4.349 4.434 . 0 0 "[ . 1]" 1
153 1 18 SER HB2 1 19 ILE HA . . 4.890 4.736 4.609 4.845 . 0 0 "[ . 1]" 1
154 1 18 SER HB2 1 19 ILE QG . . 5.340 4.171 3.743 4.357 . 0 0 "[ . 1]" 1
155 1 18 SER HB2 1 67 ALA MB . . 5.390 4.992 4.824 5.082 . 0 0 "[ . 1]" 1
156 1 18 SER HB2 1 68 LEU HB2 . . 5.290 4.662 4.329 5.196 . 0 0 "[ . 1]" 1
157 1 18 SER HB2 1 68 LEU HB3 . . 4.260 3.371 2.840 3.981 . 0 0 "[ . 1]" 1
158 1 18 SER HB3 1 19 ILE H . . 5.050 4.360 4.286 4.430 . 0 0 "[ . 1]" 1
159 1 18 SER HB3 1 19 ILE QG . . 5.340 5.036 4.748 5.203 . 0 0 "[ . 1]" 1
160 1 18 SER HB3 1 68 LEU HB2 . . 5.200 3.770 3.347 4.120 . 0 0 "[ . 1]" 1
161 1 18 SER HB3 1 68 LEU HB3 . . 4.340 2.321 2.000 2.611 . 0 0 "[ . 1]" 1
162 1 18 SER HB3 1 68 LEU MD1 . . 4.610 4.175 2.507 4.596 . 0 0 "[ . 1]" 1
163 1 18 SER HB3 1 68 LEU QD . . 3.780 2.601 2.147 3.156 . 0 0 "[ . 1]" 1
164 1 18 SER HB3 1 68 LEU MD2 . . 4.610 2.847 2.151 4.612 0.002 10 0 "[ . 1]" 1
165 1 19 ILE H 1 19 ILE HB . . 3.240 2.686 2.588 2.795 . 0 0 "[ . 1]" 1
166 1 19 ILE H 1 19 ILE MD . . 4.630 3.888 3.633 4.099 . 0 0 "[ . 1]" 1
167 1 19 ILE H 1 19 ILE HG12 . . 4.460 3.973 2.825 4.193 . 0 0 "[ . 1]" 1
168 1 19 ILE H 1 19 ILE QG . . 3.870 2.801 2.689 2.916 . 0 0 "[ . 1]" 1
169 1 19 ILE H 1 19 ILE HG13 . . 4.460 2.986 2.728 4.170 . 0 0 "[ . 1]" 1
170 1 19 ILE H 1 19 ILE MG . . 4.300 3.868 3.830 3.910 . 0 0 "[ . 1]" 1
171 1 19 ILE H 1 20 VAL H . . 4.690 4.324 4.131 4.450 . 0 0 "[ . 1]" 1
172 1 19 ILE H 1 20 VAL HA . . 5.150 4.851 4.728 4.963 . 0 0 "[ . 1]" 1
173 1 19 ILE H 1 20 VAL MG1 . . 5.500 5.407 5.183 5.512 0.012 6 0 "[ . 1]" 1
174 1 19 ILE H 1 68 LEU H . . 4.490 4.394 4.201 4.491 0.001 5 0 "[ . 1]" 1
175 1 19 ILE H 1 68 LEU HB2 . . 4.840 4.216 3.719 4.476 . 0 0 "[ . 1]" 1
176 1 19 ILE H 1 68 LEU QD . . 5.440 4.400 4.015 4.786 . 0 0 "[ . 1]" 1
177 1 19 ILE HA 1 19 ILE MD . . 3.930 3.688 2.006 3.883 . 0 0 "[ . 1]" 1
178 1 19 ILE HA 1 19 ILE HG12 . . 4.220 2.697 2.590 3.088 . 0 0 "[ . 1]" 1
179 1 19 ILE HA 1 19 ILE QG . . 3.500 2.501 2.434 2.945 . 0 0 "[ . 1]" 1
180 1 19 ILE HA 1 19 ILE HG13 . . 4.220 2.974 2.789 3.721 . 0 0 "[ . 1]" 1
181 1 19 ILE HA 1 19 ILE MG . . 3.220 2.317 2.283 2.382 . 0 0 "[ . 1]" 1
182 1 19 ILE HA 1 20 VAL H . . 3.370 2.163 2.140 2.224 . 0 0 "[ . 1]" 1
183 1 19 ILE HA 1 67 ALA MB . . 4.610 3.903 3.669 4.076 . 0 0 "[ . 1]" 1
184 1 19 ILE HA 1 68 LEU H . . 3.620 2.062 1.948 2.286 . 0 0 "[ . 1]" 1
185 1 19 ILE HA 1 68 LEU HA . . 4.840 4.682 4.580 4.789 . 0 0 "[ . 1]" 1
186 1 19 ILE HA 1 68 LEU HB3 . . 4.520 3.994 3.788 4.344 . 0 0 "[ . 1]" 1
187 1 19 ILE HB 1 20 VAL H . . 4.490 4.154 3.940 4.318 . 0 0 "[ . 1]" 1
188 1 19 ILE MD 1 67 ALA MB . . 4.190 3.960 2.159 4.190 0.000 5 0 "[ . 1]" 1
189 1 19 ILE QG 1 19 ILE MG . . 3.300 2.244 2.152 2.305 . 0 0 "[ . 1]" 1
190 1 19 ILE QG 1 67 ALA MB . . 4.030 3.217 2.995 4.032 0.002 1 0 "[ . 1]" 1
191 1 19 ILE HG12 1 67 ALA HA . . 4.740 3.054 2.665 4.371 . 0 0 "[ . 1]" 1
192 1 19 ILE HG13 1 67 ALA HA . . 4.740 4.150 3.948 4.433 . 0 0 "[ . 1]" 1
193 1 19 ILE MG 1 20 VAL H . . 3.370 2.468 2.076 2.785 . 0 0 "[ . 1]" 1
194 1 19 ILE MG 1 20 VAL HA . . 4.450 3.775 3.611 3.958 . 0 0 "[ . 1]" 1
195 1 19 ILE MG 1 20 VAL HB . . 5.100 4.912 4.729 5.085 . 0 0 "[ . 1]" 1
196 1 19 ILE MG 1 21 ARG H . . 5.070 4.558 4.451 4.734 . 0 0 "[ . 1]" 1
197 1 19 ILE MG 1 65 ASP HA . . 4.320 4.098 3.678 4.324 0.004 10 0 "[ . 1]" 1
198 1 19 ILE MG 1 65 ASP QB . . 3.060 2.664 2.350 2.940 . 0 0 "[ . 1]" 1
199 1 19 ILE MG 1 67 ALA HA . . 4.100 2.834 2.716 3.029 . 0 0 "[ . 1]" 1
200 1 19 ILE MG 1 67 ALA MB . . 4.410 3.783 3.713 3.889 . 0 0 "[ . 1]" 1
201 1 20 VAL H 1 20 VAL HB . . 4.170 3.039 2.886 3.212 . 0 0 "[ . 1]" 1
202 1 20 VAL H 1 20 VAL MG1 . . 3.230 1.991 1.909 2.074 . 0 0 "[ . 1]" 1
203 1 20 VAL H 1 21 ARG H . . 4.740 4.491 4.427 4.556 . 0 0 "[ . 1]" 1
204 1 20 VAL H 1 66 VAL H . . 4.480 3.954 3.607 4.412 . 0 0 "[ . 1]" 1
205 1 20 VAL H 1 66 VAL HB . . 4.900 4.224 3.781 4.465 . 0 0 "[ . 1]" 1
206 1 20 VAL H 1 67 ALA H . . 4.990 4.915 4.774 4.995 0.005 8 0 "[ . 1]" 1
207 1 20 VAL H 1 68 LEU H . . 4.600 2.683 2.295 2.855 . 0 0 "[ . 1]" 1
208 1 20 VAL HA 1 20 VAL MG2 . . 3.270 2.304 2.251 2.337 . 0 0 "[ . 1]" 1
209 1 20 VAL HA 1 21 ARG H . . 3.010 2.230 2.207 2.285 . 0 0 "[ . 1]" 1
210 1 20 VAL HA 1 21 ARG HA . . 4.860 4.362 4.351 4.374 . 0 0 "[ . 1]" 1
211 1 20 VAL HA 1 21 ARG QB . . 4.900 4.034 4.012 4.055 . 0 0 "[ . 1]" 1
212 1 20 VAL HA 1 68 LEU HB2 . . 4.630 4.551 4.360 4.630 . 0 0 "[ . 1]" 1
213 1 20 VAL HA 1 68 LEU QD . . 5.090 4.017 3.742 4.391 . 0 0 "[ . 1]" 1
214 1 20 VAL HB 1 21 ARG H . . 4.030 3.988 3.971 4.023 . 0 0 "[ . 1]" 1
215 1 20 VAL HB 1 36 ALA MB . . 4.420 3.727 3.574 4.025 . 0 0 "[ . 1]" 1
216 1 20 VAL HB 1 68 LEU H . . 4.790 4.475 4.343 4.702 . 0 0 "[ . 1]" 1
217 1 20 VAL HB 1 68 LEU HB3 . . 5.500 4.756 4.592 4.924 . 0 0 "[ . 1]" 1
218 1 20 VAL MG1 1 21 ARG H . . 4.300 3.801 3.527 3.881 . 0 0 "[ . 1]" 1
219 1 20 VAL MG1 1 21 ARG HA . . 4.290 4.149 3.915 4.238 . 0 0 "[ . 1]" 1
220 1 20 VAL MG1 1 36 ALA HA . . 4.170 3.641 3.414 3.853 . 0 0 "[ . 1]" 1
221 1 20 VAL MG1 1 36 ALA MB . . 2.810 1.866 1.714 1.981 . 0 0 "[ . 1]" 1
222 1 20 VAL MG1 1 66 VAL HB . . 4.060 2.291 1.978 2.486 . 0 0 "[ . 1]" 1
223 1 20 VAL MG1 1 68 LEU HA . . 3.680 2.889 2.458 3.542 . 0 0 "[ . 1]" 1
224 1 20 VAL MG1 1 68 LEU HB2 . . 4.430 2.840 2.552 3.183 . 0 0 "[ . 1]" 1
225 1 20 VAL MG1 1 68 LEU QD . . 2.880 2.471 1.892 2.825 . 0 0 "[ . 1]" 1
226 1 20 VAL MG2 1 21 ARG H . . 3.390 2.113 1.987 2.292 . 0 0 "[ . 1]" 1
227 1 20 VAL MG2 1 21 ARG HA . . 5.260 3.872 3.834 3.908 . 0 0 "[ . 1]" 1
228 1 20 VAL MG2 1 21 ARG HB2 . . 4.610 4.552 4.381 4.613 0.003 3 0 "[ . 1]" 1
229 1 20 VAL MG2 1 21 ARG QB . . 3.950 3.695 3.626 3.784 . 0 0 "[ . 1]" 1
230 1 20 VAL MG2 1 21 ARG HB3 . . 4.610 3.913 3.829 4.102 . 0 0 "[ . 1]" 1
231 1 20 VAL MG2 1 22 GLY HA2 . . 5.030 4.098 3.873 4.372 . 0 0 "[ . 1]" 1
232 1 20 VAL MG2 1 36 ALA HA . . 4.240 2.980 2.711 3.412 . 0 0 "[ . 1]" 1
233 1 20 VAL MG2 1 37 GLY QA . . 4.760 4.019 3.342 4.479 . 0 0 "[ . 1]" 1
234 1 20 VAL MG2 1 66 VAL HB . . 4.290 4.177 4.034 4.292 0.002 4 0 "[ . 1]" 1
235 1 20 VAL MG2 1 68 LEU HB2 . . 4.720 4.602 4.475 4.712 . 0 0 "[ . 1]" 1
236 1 20 VAL MG2 1 68 LEU QD . . 3.130 3.085 3.021 3.117 . 0 0 "[ . 1]" 1
237 1 21 ARG H 1 21 ARG HB2 . . 3.540 2.862 2.582 3.027 . 0 0 "[ . 1]" 1
238 1 21 ARG H 1 21 ARG QB . . 3.080 2.308 2.277 2.372 . 0 0 "[ . 1]" 1
239 1 21 ARG H 1 21 ARG HB3 . . 3.540 2.455 2.386 2.680 . 0 0 "[ . 1]" 1
240 1 21 ARG H 1 22 GLY HA2 . . 5.500 5.155 5.008 5.321 . 0 0 "[ . 1]" 1
241 1 21 ARG H 1 36 ALA HA . . 5.500 5.394 5.238 5.502 0.002 4 0 "[ . 1]" 1
242 1 21 ARG H 1 36 ALA MB . . 5.480 4.794 4.538 5.045 . 0 0 "[ . 1]" 1
243 1 21 ARG HA 1 21 ARG HD2 . . 4.140 3.441 2.898 3.733 . 0 0 "[ . 1]" 1
244 1 21 ARG HA 1 21 ARG QD . . 3.630 2.324 1.991 3.376 . 0 0 "[ . 1]" 1
245 1 21 ARG HA 1 21 ARG HD3 . . 4.140 2.465 2.002 4.140 . 0 0 "[ . 1]" 1
246 1 21 ARG HA 1 21 ARG HG2 . . 4.190 3.516 2.291 3.835 . 0 0 "[ . 1]" 1
247 1 21 ARG HA 1 21 ARG QG . . 3.650 2.895 2.265 3.103 . 0 0 "[ . 1]" 1
248 1 21 ARG HA 1 21 ARG HG3 . . 4.190 3.272 3.092 3.548 . 0 0 "[ . 1]" 1
249 1 21 ARG HA 1 22 GLY H . . 3.260 2.161 2.144 2.233 . 0 0 "[ . 1]" 1
250 1 21 ARG HA 1 22 GLY HA3 . . 5.200 4.387 4.315 4.431 . 0 0 "[ . 1]" 1
251 1 21 ARG HA 1 34 VAL MG1 . . 5.440 5.386 5.272 5.445 0.005 10 0 "[ . 1]" 1
252 1 21 ARG HA 1 64 VAL QG . . 5.440 5.168 4.949 5.346 . 0 0 "[ . 1]" 1
253 1 21 ARG HA 1 65 ASP HA . . 3.420 2.365 2.099 2.552 . 0 0 "[ . 1]" 1
254 1 21 ARG HA 1 66 VAL H . . 4.500 3.075 2.842 3.290 . 0 0 "[ . 1]" 1
255 1 21 ARG HA 1 66 VAL QG . . 5.100 4.395 4.031 4.575 . 0 0 "[ . 1]" 1
256 1 21 ARG QB 1 21 ARG QD . . 3.240 2.454 2.101 2.725 . 0 0 "[ . 1]" 1
257 1 21 ARG QB 1 22 GLY H . . 4.250 3.825 3.569 3.929 . 0 0 "[ . 1]" 1
258 1 21 ARG QB 1 65 ASP HA . . 4.410 4.108 3.913 4.364 . 0 0 "[ . 1]" 1
259 1 21 ARG HB2 1 22 GLY H . . 4.990 4.283 4.023 4.522 . 0 0 "[ . 1]" 1
260 1 21 ARG HB3 1 22 GLY H . . 4.990 4.312 3.989 4.461 . 0 0 "[ . 1]" 1
261 1 21 ARG QD 1 22 GLY H . . 4.500 2.667 2.074 3.410 . 0 0 "[ . 1]" 1
262 1 21 ARG QD 1 63 GLU HA . . 5.340 4.359 4.074 4.549 . 0 0 "[ . 1]" 1
263 1 21 ARG QD 1 63 GLU HB2 . . 4.510 4.478 4.281 4.514 0.004 5 0 "[ . 1]" 1
264 1 21 ARG QD 1 63 GLU HB3 . . 4.820 2.932 2.660 3.088 . 0 0 "[ . 1]" 1
265 1 21 ARG QD 1 64 VAL H . . 5.310 3.807 3.472 4.523 . 0 0 "[ . 1]" 1
266 1 21 ARG QD 1 65 ASP HA . . 4.830 2.941 2.269 4.779 . 0 0 "[ . 1]" 1
267 1 21 ARG HD2 1 65 ASP HA . . 5.500 4.170 3.407 5.495 . 0 0 "[ . 1]" 1
268 1 21 ARG HD3 1 65 ASP HA . . 5.500 3.059 2.282 5.300 . 0 0 "[ . 1]" 1
269 1 21 ARG QG 1 22 GLY H . . 4.300 3.271 2.531 3.635 . 0 0 "[ . 1]" 1
270 1 21 ARG QG 1 63 GLU HG2 . . 4.360 4.279 3.885 4.363 0.003 5 0 "[ . 1]" 1
271 1 21 ARG QG 1 65 ASP HA . . 4.610 4.246 3.340 4.612 0.002 3 0 "[ . 1]" 1
272 1 21 ARG HG2 1 22 GLY H . . 5.080 4.396 3.156 4.993 . 0 0 "[ . 1]" 1
273 1 21 ARG HG2 1 65 ASP HA . . 5.430 4.954 3.398 5.429 . 0 0 "[ . 1]" 1
274 1 21 ARG HG3 1 22 GLY H . . 5.080 3.651 2.558 5.002 . 0 0 "[ . 1]" 1
275 1 21 ARG HG3 1 65 ASP HA . . 5.430 4.836 4.342 5.045 . 0 0 "[ . 1]" 1
276 1 22 GLY H 1 23 VAL H . . 4.900 4.234 4.086 4.353 . 0 0 "[ . 1]" 1
277 1 22 GLY H 1 34 VAL MG1 . . 4.230 3.742 3.573 4.029 . 0 0 "[ . 1]" 1
278 1 22 GLY H 1 36 ALA MB . . 4.820 4.339 3.844 4.709 . 0 0 "[ . 1]" 1
279 1 22 GLY H 1 64 VAL H . . 4.260 4.144 3.895 4.264 0.004 4 0 "[ . 1]" 1
280 1 22 GLY H 1 65 ASP H . . 5.480 4.867 4.636 5.167 . 0 0 "[ . 1]" 1
281 1 22 GLY H 1 65 ASP HA . . 4.250 2.683 2.437 3.127 . 0 0 "[ . 1]" 1
282 1 22 GLY H 1 65 ASP HB2 . . 5.500 5.031 4.617 5.505 0.005 8 0 "[ . 1]" 1
283 1 22 GLY H 1 65 ASP HB3 . . 5.500 4.883 4.380 5.502 0.002 3 0 "[ . 1]" 1
284 1 22 GLY H 1 66 VAL H . . 4.490 3.169 2.783 3.495 . 0 0 "[ . 1]" 1
285 1 22 GLY H 1 66 VAL QG . . 3.940 3.285 2.666 3.734 . 0 0 "[ . 1]" 1
286 1 22 GLY HA2 1 23 VAL HA . . 4.810 4.607 4.542 4.695 . 0 0 "[ . 1]" 1
287 1 22 GLY HA2 1 23 VAL MG1 . . 4.630 4.011 3.910 4.065 . 0 0 "[ . 1]" 1
288 1 22 GLY HA2 1 34 VAL MG1 . . 4.180 3.955 3.762 4.068 . 0 0 "[ . 1]" 1
289 1 22 GLY HA2 1 35 ASP HB3 . . 5.180 5.067 4.998 5.181 0.001 5 0 "[ . 1]" 1
290 1 22 GLY HA2 1 36 ALA MB . . 4.640 4.174 3.958 4.385 . 0 0 "[ . 1]" 1
291 1 22 GLY HA2 1 66 VAL QG . . 4.710 4.579 4.241 4.713 0.003 8 0 "[ . 1]" 1
292 1 22 GLY HA3 1 23 VAL H . . 3.560 2.313 2.220 2.407 . 0 0 "[ . 1]" 1
293 1 22 GLY HA3 1 23 VAL HA . . 4.510 4.335 4.326 4.349 . 0 0 "[ . 1]" 1
294 1 22 GLY HA3 1 34 VAL MG1 . . 3.160 2.610 2.444 2.717 . 0 0 "[ . 1]" 1
295 1 22 GLY HA3 1 35 ASP H . . 5.500 4.002 3.882 4.164 . 0 0 "[ . 1]" 1
296 1 22 GLY HA3 1 36 ALA HA . . 3.930 2.390 1.997 2.685 . 0 0 "[ . 1]" 1
297 1 22 GLY HA3 1 36 ALA MB . . 3.650 3.304 3.125 3.524 . 0 0 "[ . 1]" 1
298 1 22 GLY HA3 1 64 VAL H . . 5.500 4.776 4.604 4.931 . 0 0 "[ . 1]" 1
299 1 22 GLY HA3 1 66 VAL QG . . 4.140 3.164 2.869 3.322 . 0 0 "[ . 1]" 1
300 1 23 VAL H 1 23 VAL HB . . 3.490 3.294 3.202 3.388 . 0 0 "[ . 1]" 1
301 1 23 VAL H 1 23 VAL MG1 . . 3.530 2.350 2.252 2.479 . 0 0 "[ . 1]" 1
302 1 23 VAL H 1 23 VAL MG2 . . 4.650 4.001 3.976 4.034 . 0 0 "[ . 1]" 1
303 1 23 VAL H 1 24 VAL H . . 5.270 4.263 4.211 4.313 . 0 0 "[ . 1]" 1
304 1 23 VAL H 1 25 VAL MG1 . . 5.410 4.118 4.017 4.220 . 0 0 "[ . 1]" 1
305 1 23 VAL H 1 34 VAL MG1 . . 3.630 2.316 2.103 2.506 . 0 0 "[ . 1]" 1
306 1 23 VAL H 1 35 ASP H . . 4.160 2.472 2.406 2.608 . 0 0 "[ . 1]" 1
307 1 23 VAL H 1 35 ASP HB3 . . 4.790 3.245 3.118 3.434 . 0 0 "[ . 1]" 1
308 1 23 VAL H 1 66 VAL QG . . 5.170 4.254 3.939 4.515 . 0 0 "[ . 1]" 1
309 1 23 VAL HA 1 23 VAL MG1 . . 3.290 3.189 3.186 3.198 . 0 0 "[ . 1]" 1
310 1 23 VAL HA 1 23 VAL MG2 . . 3.340 2.262 2.165 2.343 . 0 0 "[ . 1]" 1
311 1 23 VAL HA 1 24 VAL H . . 3.400 2.196 2.178 2.220 . 0 0 "[ . 1]" 1
312 1 23 VAL HA 1 24 VAL HB . . 4.870 4.747 4.699 4.786 . 0 0 "[ . 1]" 1
313 1 23 VAL HA 1 24 VAL MG2 . . 4.100 3.621 3.565 3.653 . 0 0 "[ . 1]" 1
314 1 23 VAL HA 1 34 VAL MG1 . . 4.220 3.142 3.101 3.187 . 0 0 "[ . 1]" 1
315 1 23 VAL HA 1 34 VAL MG2 . . 5.280 4.764 4.608 4.911 . 0 0 "[ . 1]" 1
316 1 23 VAL HA 1 63 GLU HA . . 3.200 2.146 1.997 2.287 . 0 0 "[ . 1]" 1
317 1 23 VAL HA 1 63 GLU HG2 . . 4.590 4.049 3.727 4.594 0.004 3 0 "[ . 1]" 1
318 1 23 VAL HA 1 64 VAL H . . 4.170 2.118 2.020 2.388 . 0 0 "[ . 1]" 1
319 1 23 VAL HA 1 64 VAL HB . . 5.500 5.465 5.270 5.512 0.012 4 0 "[ . 1]" 1
320 1 23 VAL HA 1 64 VAL MG1 . . 4.730 3.923 3.607 4.204 . 0 0 "[ . 1]" 1
321 1 23 VAL HA 1 64 VAL QG . . 4.050 2.668 2.537 2.744 . 0 0 "[ . 1]" 1
322 1 23 VAL HA 1 64 VAL MG2 . . 4.730 2.716 2.581 2.785 . 0 0 "[ . 1]" 1
323 1 23 VAL HB 1 24 VAL H . . 4.680 4.152 4.096 4.192 . 0 0 "[ . 1]" 1
324 1 23 VAL HB 1 25 VAL MG1 . . 5.410 5.164 5.071 5.245 . 0 0 "[ . 1]" 1
325 1 23 VAL HB 1 34 VAL MG1 . . 4.740 4.641 4.531 4.698 . 0 0 "[ . 1]" 1
326 1 23 VAL HB 1 35 ASP H . . 5.240 5.213 5.163 5.259 0.019 8 0 "[ . 1]" 1
327 1 23 VAL HB 1 35 ASP HB3 . . 5.000 5.010 4.979 5.024 0.024 3 0 "[ . 1]" 1
328 1 23 VAL HB 1 63 GLU HA . . 3.640 3.076 2.704 3.230 . 0 0 "[ . 1]" 1
329 1 23 VAL HB 1 63 GLU HG2 . . 3.930 2.980 2.629 3.252 . 0 0 "[ . 1]" 1
330 1 23 VAL HB 1 63 GLU HG3 . . 4.140 3.123 2.805 3.427 . 0 0 "[ . 1]" 1
331 1 23 VAL HB 1 64 VAL H . . 4.740 4.117 3.862 4.212 . 0 0 "[ . 1]" 1
332 1 23 VAL MG1 1 24 VAL H . . 4.260 3.750 3.710 3.800 . 0 0 "[ . 1]" 1
333 1 23 VAL MG1 1 24 VAL HA . . 4.400 4.405 4.383 4.416 0.016 3 0 "[ . 1]" 1
334 1 23 VAL MG1 1 25 VAL HA . . 4.570 3.772 3.644 3.887 . 0 0 "[ . 1]" 1
335 1 23 VAL MG1 1 25 VAL MG1 . . 2.770 2.648 2.569 2.720 . 0 0 "[ . 1]" 1
336 1 23 VAL MG1 1 34 VAL HA . . 5.070 4.472 4.401 4.569 . 0 0 "[ . 1]" 1
337 1 23 VAL MG1 1 34 VAL MG1 . . 3.680 3.636 3.502 3.701 0.021 8 0 "[ . 1]" 1
338 1 23 VAL MG1 1 35 ASP HB3 . . 4.500 2.331 2.290 2.421 . 0 0 "[ . 1]" 1
339 1 23 VAL MG1 1 61 GLY HA2 . . 4.640 4.585 4.034 4.671 0.031 8 0 "[ . 1]" 1
340 1 23 VAL MG1 1 63 GLU HA . . 4.440 4.300 4.103 4.395 . 0 0 "[ . 1]" 1
341 1 23 VAL MG1 1 63 GLU HG2 . . 4.690 4.443 4.177 4.692 0.002 1 0 "[ . 1]" 1
342 1 23 VAL MG1 1 63 GLU HG3 . . 4.620 4.325 4.111 4.603 . 0 0 "[ . 1]" 1
343 1 23 VAL MG2 1 24 VAL H . . 3.280 2.173 2.039 2.345 . 0 0 "[ . 1]" 1
344 1 23 VAL MG2 1 24 VAL HA . . 4.410 4.193 4.090 4.271 . 0 0 "[ . 1]" 1
345 1 23 VAL MG2 1 24 VAL HB . . 4.790 3.555 3.464 3.614 . 0 0 "[ . 1]" 1
346 1 23 VAL MG2 1 35 ASP HB3 . . 5.140 4.935 4.866 4.995 . 0 0 "[ . 1]" 1
347 1 23 VAL MG2 1 61 GLY HA2 . . 3.620 3.163 2.728 3.421 . 0 0 "[ . 1]" 1
348 1 23 VAL MG2 1 62 ASP H . . 3.950 3.789 3.280 3.968 0.018 1 0 "[ . 1]" 1
349 1 23 VAL MG2 1 63 GLU HA . . 3.760 2.176 1.962 2.397 . 0 0 "[ . 1]" 1
350 1 23 VAL MG2 1 63 GLU HG2 . . 4.340 3.119 2.716 3.433 . 0 0 "[ . 1]" 1
351 1 23 VAL MG2 1 63 GLU HG3 . . 4.810 2.131 1.948 2.436 . 0 0 "[ . 1]" 1
352 1 23 VAL MG2 1 64 VAL H . . 4.450 3.586 3.488 3.799 . 0 0 "[ . 1]" 1
353 1 23 VAL MG2 1 64 VAL QG . . 4.080 3.671 3.462 3.809 . 0 0 "[ . 1]" 1
354 1 24 VAL H 1 24 VAL HB . . 3.580 2.569 2.525 2.629 . 0 0 "[ . 1]" 1
355 1 24 VAL H 1 24 VAL MG2 . . 3.010 2.155 2.059 2.221 . 0 0 "[ . 1]" 1
356 1 24 VAL H 1 25 VAL H . . 4.970 4.395 4.347 4.460 . 0 0 "[ . 1]" 1
357 1 24 VAL H 1 25 VAL MG1 . . 5.070 4.981 4.891 5.032 . 0 0 "[ . 1]" 1
358 1 24 VAL H 1 35 ASP H . . 5.000 4.747 4.609 4.821 . 0 0 "[ . 1]" 1
359 1 24 VAL H 1 58 ILE MD . . 5.500 4.674 4.336 4.871 . 0 0 "[ . 1]" 1
360 1 24 VAL H 1 62 ASP HB2 . . 5.390 4.842 4.426 5.217 . 0 0 "[ . 1]" 1
361 1 24 VAL H 1 62 ASP HB3 . . 5.500 5.257 4.635 5.499 . 0 0 "[ . 1]" 1
362 1 24 VAL H 1 63 GLU HA . . 4.080 3.278 3.002 3.630 . 0 0 "[ . 1]" 1
363 1 24 VAL H 1 63 GLU HG3 . . 5.500 5.100 4.675 5.503 0.003 3 0 "[ . 1]" 1
364 1 24 VAL H 1 64 VAL H . . 4.470 3.315 3.137 3.751 . 0 0 "[ . 1]" 1
365 1 24 VAL H 1 64 VAL QG . . 3.800 2.623 2.339 2.745 . 0 0 "[ . 1]" 1
366 1 24 VAL HA 1 24 VAL MG1 . . 3.210 2.391 2.345 2.417 . 0 0 "[ . 1]" 1
367 1 24 VAL HA 1 24 VAL MG2 . . 3.340 2.385 2.346 2.427 . 0 0 "[ . 1]" 1
368 1 24 VAL HA 1 25 VAL H . . 3.000 2.154 2.142 2.166 . 0 0 "[ . 1]" 1
369 1 24 VAL HA 1 25 VAL MG1 . . 4.000 3.968 3.912 4.006 0.006 3 0 "[ . 1]" 1
370 1 24 VAL HA 1 25 VAL MG2 . . 3.900 3.692 3.674 3.733 . 0 0 "[ . 1]" 1
371 1 24 VAL HA 1 26 ALA H . . 3.980 3.419 3.378 3.474 . 0 0 "[ . 1]" 1
372 1 24 VAL HA 1 27 ILE HG12 . . 5.500 5.454 5.337 5.545 0.045 8 0 "[ . 1]" 1
373 1 24 VAL HA 1 32 VAL MG1 . . 4.640 3.634 3.532 3.705 . 0 0 "[ . 1]" 1
374 1 24 VAL HA 1 33 LEU HB2 . . 5.500 5.428 5.397 5.503 0.003 8 0 "[ . 1]" 1
375 1 24 VAL HA 1 33 LEU HB3 . . 5.500 5.511 5.505 5.521 0.021 9 0 "[ . 1]" 1
376 1 24 VAL HA 1 34 VAL HA . . 3.350 2.235 2.055 2.331 . 0 0 "[ . 1]" 1
377 1 24 VAL HA 1 34 VAL MG1 . . 3.590 2.843 2.718 2.998 . 0 0 "[ . 1]" 1
378 1 24 VAL HA 1 34 VAL MG2 . . 3.450 2.418 2.159 2.588 . 0 0 "[ . 1]" 1
379 1 24 VAL HA 1 35 ASP H . . 4.100 3.710 3.471 3.835 . 0 0 "[ . 1]" 1
380 1 24 VAL HA 1 58 ILE MD . . 5.500 4.610 4.493 4.794 . 0 0 "[ . 1]" 1
381 1 24 VAL HA 1 60 VAL QG . . 5.440 4.933 4.614 5.097 . 0 0 "[ . 1]" 1
382 1 24 VAL HA 1 61 GLY H . . 4.750 4.671 4.311 4.767 0.017 6 0 "[ . 1]" 1
383 1 24 VAL HB 1 25 VAL H . . 5.090 4.355 4.304 4.391 . 0 0 "[ . 1]" 1
384 1 24 VAL HB 1 34 VAL MG1 . . 5.380 4.923 4.759 5.035 . 0 0 "[ . 1]" 1
385 1 24 VAL HB 1 34 VAL MG2 . . 4.780 4.541 4.247 4.765 . 0 0 "[ . 1]" 1
386 1 24 VAL HB 1 58 ILE MD . . 5.380 3.626 3.263 3.910 . 0 0 "[ . 1]" 1
387 1 24 VAL HB 1 59 GLN H . . 5.500 4.621 4.428 4.864 . 0 0 "[ . 1]" 1
388 1 24 VAL HB 1 60 VAL H . . 5.300 4.742 4.030 4.990 . 0 0 "[ . 1]" 1
389 1 24 VAL HB 1 60 VAL HA . . 3.440 2.629 1.960 2.901 . 0 0 "[ . 1]" 1
390 1 24 VAL HB 1 60 VAL QG . . 5.220 3.830 3.592 3.938 . 0 0 "[ . 1]" 1
391 1 24 VAL HB 1 61 GLY H . . 3.730 2.369 2.054 2.652 . 0 0 "[ . 1]" 1
392 1 24 VAL HB 1 62 ASP H . . 3.430 2.851 2.426 3.169 . 0 0 "[ . 1]" 1
393 1 24 VAL HB 1 64 VAL QG . . 4.240 3.648 3.545 3.736 . 0 0 "[ . 1]" 1
394 1 24 VAL MG1 1 25 VAL H . . 3.560 2.980 2.793 3.123 . 0 0 "[ . 1]" 1
395 1 24 VAL MG1 1 25 VAL MG2 . . 3.930 3.722 3.564 3.842 . 0 0 "[ . 1]" 1
396 1 24 VAL MG1 1 26 ALA H . . 3.390 2.226 1.995 2.422 . 0 0 "[ . 1]" 1
397 1 24 VAL MG1 1 26 ALA HA . . 3.900 3.434 3.287 3.555 . 0 0 "[ . 1]" 1
398 1 24 VAL MG1 1 27 ILE H . . 4.780 3.807 3.639 3.989 . 0 0 "[ . 1]" 1
399 1 24 VAL MG1 1 27 ILE HA . . 4.080 3.381 3.229 3.518 . 0 0 "[ . 1]" 1
400 1 24 VAL MG1 1 27 ILE HB . . 4.830 4.138 4.074 4.227 . 0 0 "[ . 1]" 1
401 1 24 VAL MG1 1 27 ILE MD . . 2.960 1.840 1.796 1.888 . 0 0 "[ . 1]" 1
402 1 24 VAL MG1 1 27 ILE HG12 . . 2.920 2.011 1.945 2.113 . 0 0 "[ . 1]" 1
403 1 24 VAL MG1 1 27 ILE HG13 . . 3.160 3.024 2.892 3.114 . 0 0 "[ . 1]" 1
404 1 24 VAL MG1 1 32 VAL HA . . 4.390 4.270 4.000 4.406 0.016 1 0 "[ . 1]" 1
405 1 24 VAL MG1 1 32 VAL MG1 . . 2.850 2.123 1.880 2.287 . 0 0 "[ . 1]" 1
406 1 24 VAL MG1 1 33 LEU H . . 4.400 3.504 3.361 3.694 . 0 0 "[ . 1]" 1
407 1 24 VAL MG1 1 33 LEU HB2 . . 5.220 4.270 4.184 4.349 . 0 0 "[ . 1]" 1
408 1 24 VAL MG1 1 34 VAL HA . . 4.510 3.878 3.675 4.007 . 0 0 "[ . 1]" 1
409 1 24 VAL MG1 1 34 VAL MG2 . . 3.380 3.119 2.843 3.262 . 0 0 "[ . 1]" 1
410 1 24 VAL MG1 1 49 PHE QD . . 5.500 5.278 4.771 5.482 . 0 0 "[ . 1]" 1
411 1 24 VAL MG1 1 58 ILE MD . . 3.640 2.778 2.591 3.009 . 0 0 "[ . 1]" 1
412 1 24 VAL MG1 1 59 GLN QB . . 5.340 4.630 4.456 4.878 . 0 0 "[ . 1]" 1
413 1 24 VAL MG1 1 60 VAL H . . 4.360 3.371 2.708 3.718 . 0 0 "[ . 1]" 1
414 1 24 VAL MG1 1 60 VAL HA . . 2.950 1.960 1.924 1.979 . 0 0 "[ . 1]" 1
415 1 24 VAL MG1 1 60 VAL HB . . 4.770 4.018 2.503 4.512 . 0 0 "[ . 1]" 1
416 1 24 VAL MG1 1 60 VAL MG1 . . 3.440 3.251 3.012 3.609 0.169 8 0 "[ . 1]" 1
417 1 24 VAL MG1 1 60 VAL QG . . 2.870 2.625 2.459 2.916 0.046 3 0 "[ . 1]" 1
418 1 24 VAL MG1 1 60 VAL MG2 . . 3.440 2.779 2.579 3.093 . 0 0 "[ . 1]" 1
419 1 24 VAL MG1 1 61 GLY H . . 3.870 3.030 2.518 3.609 . 0 0 "[ . 1]" 1
420 1 24 VAL MG1 1 62 ASP H . . 4.950 3.995 3.722 4.444 . 0 0 "[ . 1]" 1
421 1 24 VAL MG2 1 32 VAL HA . . 5.500 5.469 5.303 5.518 0.018 10 0 "[ . 1]" 1
422 1 24 VAL MG2 1 32 VAL MG1 . . 3.620 2.444 2.325 2.510 . 0 0 "[ . 1]" 1
423 1 24 VAL MG2 1 34 VAL HA . . 4.370 3.895 3.683 4.019 . 0 0 "[ . 1]" 1
424 1 24 VAL MG2 1 34 VAL MG2 . . 2.960 2.493 2.217 2.712 . 0 0 "[ . 1]" 1
425 1 24 VAL MG2 1 49 PHE HB3 . . 5.500 4.859 4.563 5.064 . 0 0 "[ . 1]" 1
426 1 24 VAL MG2 1 49 PHE QD . . 5.080 4.301 4.078 4.487 . 0 0 "[ . 1]" 1
427 1 24 VAL MG2 1 58 ILE HB . . 4.150 2.931 2.605 3.268 . 0 0 "[ . 1]" 1
428 1 24 VAL MG2 1 58 ILE MD . . 2.940 1.840 1.700 2.015 . 0 0 "[ . 1]" 1
429 1 24 VAL MG2 1 58 ILE HG12 . . 4.330 3.551 3.424 3.753 . 0 0 "[ . 1]" 1
430 1 24 VAL MG2 1 58 ILE HG13 . . 4.680 4.217 4.116 4.423 . 0 0 "[ . 1]" 1
431 1 24 VAL MG2 1 59 GLN H . . 3.890 3.530 3.220 3.887 . 0 0 "[ . 1]" 1
432 1 24 VAL MG2 1 60 VAL HA . . 4.390 3.843 3.520 4.022 . 0 0 "[ . 1]" 1
433 1 24 VAL MG2 1 62 ASP H . . 3.860 3.525 3.260 3.845 . 0 0 "[ . 1]" 1
434 1 24 VAL MG2 1 62 ASP HB2 . . 4.070 3.208 2.664 4.085 0.015 8 0 "[ . 1]" 1
435 1 24 VAL MG2 1 62 ASP HB3 . . 4.390 3.932 3.062 4.404 0.014 3 0 "[ . 1]" 1
436 1 24 VAL MG2 1 64 VAL QG . . 2.870 1.752 1.675 1.843 . 0 0 "[ . 1]" 1
437 1 25 VAL H 1 25 VAL HB . . 3.930 3.641 3.630 3.659 . 0 0 "[ . 1]" 1
438 1 25 VAL H 1 25 VAL MG1 . . 3.510 2.547 2.471 2.678 . 0 0 "[ . 1]" 1
439 1 25 VAL H 1 25 VAL MG2 . . 3.060 1.933 1.907 2.040 . 0 0 "[ . 1]" 1
440 1 25 VAL H 1 26 ALA H . . 3.150 2.298 2.196 2.349 . 0 0 "[ . 1]" 1
441 1 25 VAL H 1 26 ALA MB . . 4.500 4.366 4.277 4.423 . 0 0 "[ . 1]" 1
442 1 25 VAL H 1 32 VAL MG1 . . 5.400 4.523 4.388 4.690 . 0 0 "[ . 1]" 1
443 1 25 VAL H 1 33 LEU H . . 5.500 4.922 4.664 5.245 . 0 0 "[ . 1]" 1
444 1 25 VAL H 1 33 LEU HB3 . . 5.010 4.130 4.012 4.315 . 0 0 "[ . 1]" 1
445 1 25 VAL H 1 34 VAL HA . . 4.620 2.270 2.176 2.336 . 0 0 "[ . 1]" 1
446 1 25 VAL H 1 34 VAL MG1 . . 4.420 3.843 3.758 3.910 . 0 0 "[ . 1]" 1
447 1 25 VAL H 1 34 VAL MG2 . . 3.780 3.713 3.563 3.792 0.012 8 0 "[ . 1]" 1
448 1 25 VAL H 1 41 GLU HG2 . . 5.500 5.132 4.931 5.403 . 0 0 "[ . 1]" 1
449 1 25 VAL HA 1 25 VAL MG1 . . 2.980 2.261 2.227 2.302 . 0 0 "[ . 1]" 1
450 1 25 VAL HA 1 25 VAL MG2 . . 3.530 3.184 3.183 3.187 . 0 0 "[ . 1]" 1
451 1 25 VAL HA 1 60 VAL HA . . 5.500 5.079 4.509 5.288 . 0 0 "[ . 1]" 1
452 1 25 VAL HA 1 60 VAL QG . . 3.850 3.627 2.723 3.866 0.016 10 0 "[ . 1]" 1
453 1 25 VAL HB 1 26 ALA H . . 4.240 4.002 3.973 4.030 . 0 0 "[ . 1]" 1
454 1 25 VAL HB 1 26 ALA MB . . 4.440 3.705 3.553 3.822 . 0 0 "[ . 1]" 1
455 1 25 VAL HB 1 33 LEU HB3 . . 5.220 4.812 4.597 5.179 . 0 0 "[ . 1]" 1
456 1 25 VAL MG1 1 26 ALA H . . 4.160 4.110 4.073 4.140 . 0 0 "[ . 1]" 1
457 1 25 VAL MG1 1 26 ALA MB . . 4.670 4.628 4.591 4.661 . 0 0 "[ . 1]" 1
458 1 25 VAL MG1 1 34 VAL MG1 . . 4.130 3.955 3.842 4.117 . 0 0 "[ . 1]" 1
459 1 25 VAL MG1 1 35 ASP H . . 3.660 2.582 2.473 2.710 . 0 0 "[ . 1]" 1
460 1 25 VAL MG1 1 35 ASP HA . . 4.490 3.569 3.446 3.759 . 0 0 "[ . 1]" 1
461 1 25 VAL MG1 1 35 ASP HB2 . . 3.360 1.899 1.879 1.922 . 0 0 "[ . 1]" 1
462 1 25 VAL MG1 1 35 ASP HB3 . . 3.490 2.180 2.126 2.327 . 0 0 "[ . 1]" 1
463 1 25 VAL MG1 1 41 GLU HG2 . . 4.640 3.786 3.515 3.961 . 0 0 "[ . 1]" 1
464 1 25 VAL MG1 1 41 GLU HG3 . . 4.910 3.423 3.196 3.694 . 0 0 "[ . 1]" 1
465 1 25 VAL MG2 1 26 ALA H . . 3.730 2.247 2.211 2.292 . 0 0 "[ . 1]" 1
466 1 25 VAL MG2 1 26 ALA MB . . 2.960 2.731 2.557 2.850 . 0 0 "[ . 1]" 1
467 1 25 VAL MG2 1 33 LEU H . . 4.530 4.150 4.007 4.367 . 0 0 "[ . 1]" 1
468 1 25 VAL MG2 1 33 LEU HA . . 4.150 3.910 3.760 4.163 0.013 3 0 "[ . 1]" 1
469 1 25 VAL MG2 1 33 LEU HB2 . . 3.580 2.738 2.604 2.974 . 0 0 "[ . 1]" 1
470 1 25 VAL MG2 1 33 LEU HB3 . . 3.390 2.240 2.095 2.509 . 0 0 "[ . 1]" 1
471 1 25 VAL MG2 1 33 LEU MD1 . . 4.110 3.300 3.115 3.519 . 0 0 "[ . 1]" 1
472 1 25 VAL MG2 1 33 LEU QD . . 3.550 2.991 2.848 3.222 . 0 0 "[ . 1]" 1
473 1 25 VAL MG2 1 33 LEU MD2 . . 4.110 3.424 3.290 3.737 . 0 0 "[ . 1]" 1
474 1 25 VAL MG2 1 34 VAL HA . . 3.650 2.941 2.830 3.121 . 0 0 "[ . 1]" 1
475 1 25 VAL MG2 1 34 VAL HB . . 5.500 5.017 4.845 5.281 . 0 0 "[ . 1]" 1
476 1 25 VAL MG2 1 35 ASP H . . 3.830 3.486 3.370 3.604 . 0 0 "[ . 1]" 1
477 1 25 VAL MG2 1 35 ASP HA . . 4.300 3.853 3.746 3.973 . 0 0 "[ . 1]" 1
478 1 25 VAL MG2 1 35 ASP HB2 . . 3.630 2.993 2.782 3.217 . 0 0 "[ . 1]" 1
479 1 25 VAL MG2 1 35 ASP HB3 . . 4.430 3.888 3.764 3.984 . 0 0 "[ . 1]" 1
480 1 25 VAL MG2 1 41 GLU HB2 . . 4.000 3.881 3.733 3.987 . 0 0 "[ . 1]" 1
481 1 25 VAL MG2 1 41 GLU HG2 . . 3.780 1.940 1.884 2.078 . 0 0 "[ . 1]" 1
482 1 25 VAL MG2 1 41 GLU HG3 . . 4.180 2.562 2.426 2.648 . 0 0 "[ . 1]" 1
483 1 26 ALA H 1 26 ALA MB . . 3.340 2.834 2.786 2.894 . 0 0 "[ . 1]" 1
484 1 26 ALA H 1 27 ILE HG12 . . 5.140 4.272 4.187 4.337 . 0 0 "[ . 1]" 1
485 1 26 ALA H 1 32 VAL MG1 . . 5.200 3.935 3.867 4.080 . 0 0 "[ . 1]" 1
486 1 26 ALA H 1 33 LEU H . . 4.050 3.667 3.559 3.940 . 0 0 "[ . 1]" 1
487 1 26 ALA H 1 33 LEU HB2 . . 3.800 3.064 2.901 3.307 . 0 0 "[ . 1]" 1
488 1 26 ALA H 1 33 LEU HB3 . . 4.160 3.844 3.682 4.014 . 0 0 "[ . 1]" 1
489 1 26 ALA H 1 33 LEU QD . . 4.820 4.196 4.085 4.338 . 0 0 "[ . 1]" 1
490 1 26 ALA H 1 34 VAL MG1 . . 5.500 5.526 5.502 5.549 0.049 7 0 "[ . 1]" 1
491 1 26 ALA H 1 34 VAL MG2 . . 5.140 4.530 4.390 4.634 . 0 0 "[ . 1]" 1
492 1 26 ALA HA 1 27 ILE H . . 2.910 2.218 2.170 2.263 . 0 0 "[ . 1]" 1
493 1 26 ALA HA 1 27 ILE HG13 . . 5.500 5.385 5.283 5.452 . 0 0 "[ . 1]" 1
494 1 26 ALA HA 1 33 LEU QD . . 4.860 4.590 4.349 4.801 . 0 0 "[ . 1]" 1
495 1 26 ALA HA 1 60 VAL HA . . 5.500 4.210 3.921 4.457 . 0 0 "[ . 1]" 1
496 1 26 ALA HA 1 60 VAL HB . . 5.460 4.523 2.549 5.445 . 0 0 "[ . 1]" 1
497 1 26 ALA HA 1 60 VAL MG1 . . 3.410 3.007 2.744 3.427 0.017 3 0 "[ . 1]" 1
498 1 26 ALA HA 1 60 VAL QG . . 2.930 2.338 2.205 2.653 . 0 0 "[ . 1]" 1
499 1 26 ALA HA 1 60 VAL MG2 . . 3.410 2.455 2.323 2.943 . 0 0 "[ . 1]" 1
500 1 26 ALA MB 1 27 ILE H . . 2.990 2.880 2.723 3.001 0.011 9 0 "[ . 1]" 1
501 1 26 ALA MB 1 28 ASP H . . 4.270 4.126 3.961 4.272 0.002 9 0 "[ . 1]" 1
502 1 26 ALA MB 1 28 ASP HA . . 5.500 4.576 4.510 4.715 . 0 0 "[ . 1]" 1
503 1 26 ALA MB 1 32 VAL HA . . 5.230 5.054 4.846 5.162 . 0 0 "[ . 1]" 1
504 1 26 ALA MB 1 33 LEU H . . 3.920 3.736 3.552 3.850 . 0 0 "[ . 1]" 1
505 1 26 ALA MB 1 33 LEU HA . . 5.260 4.948 4.712 5.047 . 0 0 "[ . 1]" 1
506 1 26 ALA MB 1 33 LEU HB2 . . 3.370 2.328 2.198 2.467 . 0 0 "[ . 1]" 1
507 1 26 ALA MB 1 33 LEU HB3 . . 3.770 3.319 3.113 3.493 . 0 0 "[ . 1]" 1
508 1 26 ALA MB 1 33 LEU QD . . 2.780 2.136 1.949 2.309 . 0 0 "[ . 1]" 1
509 1 27 ILE H 1 27 ILE HB . . 3.390 2.486 2.438 2.536 . 0 0 "[ . 1]" 1
510 1 27 ILE H 1 27 ILE MD . . 4.520 3.975 3.910 4.090 . 0 0 "[ . 1]" 1
511 1 27 ILE H 1 27 ILE HG12 . . 3.750 2.939 2.809 3.157 . 0 0 "[ . 1]" 1
512 1 27 ILE H 1 27 ILE MG . . 4.110 3.756 3.743 3.788 . 0 0 "[ . 1]" 1
513 1 27 ILE H 1 32 VAL HA . . 5.490 5.338 5.264 5.387 . 0 0 "[ . 1]" 1
514 1 27 ILE H 1 33 LEU H . . 4.960 4.828 4.689 4.964 0.004 8 0 "[ . 1]" 1
515 1 27 ILE H 1 60 VAL HA . . 5.470 4.610 4.323 5.203 . 0 0 "[ . 1]" 1
516 1 27 ILE H 1 60 VAL MG1 . . 4.320 3.658 3.247 3.833 . 0 0 "[ . 1]" 1
517 1 27 ILE H 1 60 VAL QG . . 3.550 2.247 1.875 3.170 . 0 0 "[ . 1]" 1
518 1 27 ILE H 1 60 VAL MG2 . . 4.320 2.379 1.881 3.796 . 0 0 "[ . 1]" 1
519 1 27 ILE HA 1 27 ILE MD . . 3.770 2.001 1.966 2.077 . 0 0 "[ . 1]" 1
520 1 27 ILE HA 1 27 ILE HG12 . . 3.720 2.805 2.772 2.840 . 0 0 "[ . 1]" 1
521 1 27 ILE HA 1 27 ILE MG . . 3.200 2.442 2.392 2.475 . 0 0 "[ . 1]" 1
522 1 27 ILE HA 1 28 ASP H . . 2.850 2.195 2.180 2.215 . 0 0 "[ . 1]" 1
523 1 27 ILE HA 1 32 VAL MG1 . . 4.320 2.745 2.596 2.932 . 0 0 "[ . 1]" 1
524 1 27 ILE HA 1 33 LEU H . . 3.780 3.048 2.962 3.199 . 0 0 "[ . 1]" 1
525 1 27 ILE HA 1 33 LEU QD . . 5.440 4.781 4.627 4.974 . 0 0 "[ . 1]" 1
526 1 27 ILE HA 1 58 ILE MD . . 5.460 4.805 4.637 5.170 . 0 0 "[ . 1]" 1
527 1 27 ILE HB 1 27 ILE MD . . 3.340 3.219 3.213 3.225 . 0 0 "[ . 1]" 1
528 1 27 ILE HB 1 32 VAL MG1 . . 5.180 4.914 4.794 5.069 . 0 0 "[ . 1]" 1
529 1 27 ILE HB 1 60 VAL MG1 . . 4.960 4.294 3.014 4.689 . 0 0 "[ . 1]" 1
530 1 27 ILE HB 1 60 VAL QG . . 4.050 2.267 2.023 3.264 . 0 0 "[ . 1]" 1
531 1 27 ILE HB 1 60 VAL MG2 . . 4.960 2.624 2.025 4.969 0.009 3 0 "[ . 1]" 1
532 1 27 ILE MD 1 27 ILE MG . . 3.290 2.001 1.898 2.059 . 0 0 "[ . 1]" 1
533 1 27 ILE MD 1 28 ASP H . . 5.430 3.676 3.590 3.759 . 0 0 "[ . 1]" 1
534 1 27 ILE MD 1 32 VAL HA . . 5.330 3.028 2.958 3.114 . 0 0 "[ . 1]" 1
535 1 27 ILE MD 1 32 VAL MG1 . . 3.600 1.825 1.785 1.876 . 0 0 "[ . 1]" 1
536 1 27 ILE MD 1 32 VAL MG2 . . 3.650 1.891 1.849 1.947 . 0 0 "[ . 1]" 1
537 1 27 ILE MD 1 33 LEU H . . 4.880 3.640 3.502 3.915 . 0 0 "[ . 1]" 1
538 1 27 ILE MD 1 46 ALA HA . . 5.500 4.870 4.792 4.971 . 0 0 "[ . 1]" 1
539 1 27 ILE MD 1 56 LEU HB2 . . 5.500 5.047 4.933 5.289 . 0 0 "[ . 1]" 1
540 1 27 ILE MD 1 56 LEU HB3 . . 5.140 4.326 4.107 4.875 . 0 0 "[ . 1]" 1
541 1 27 ILE MD 1 56 LEU MD1 . . 3.880 2.941 2.595 3.800 . 0 0 "[ . 1]" 1
542 1 27 ILE MD 1 56 LEU QD . . 2.930 2.391 1.876 2.629 . 0 0 "[ . 1]" 1
543 1 27 ILE MD 1 56 LEU MD2 . . 3.880 2.713 1.882 2.977 . 0 0 "[ . 1]" 1
544 1 27 ILE MD 1 56 LEU HG . . 5.500 4.726 3.662 5.095 . 0 0 "[ . 1]" 1
545 1 27 ILE MD 1 58 ILE H . . 5.450 5.188 5.032 5.384 . 0 0 "[ . 1]" 1
546 1 27 ILE MD 1 58 ILE HB . . 5.500 4.481 4.328 4.767 . 0 0 "[ . 1]" 1
547 1 27 ILE MD 1 58 ILE MD . . 3.150 1.974 1.840 2.240 . 0 0 "[ . 1]" 1
548 1 27 ILE MD 1 58 ILE HG12 . . 4.940 4.341 4.034 4.725 . 0 0 "[ . 1]" 1
549 1 27 ILE MD 1 58 ILE HG13 . . 4.870 3.899 3.601 4.155 . 0 0 "[ . 1]" 1
550 1 27 ILE MD 1 59 GLN H . . 4.430 4.269 4.128 4.402 . 0 0 "[ . 1]" 1
551 1 27 ILE MD 1 59 GLN HA . . 3.220 2.642 2.411 3.018 . 0 0 "[ . 1]" 1
552 1 27 ILE MD 1 59 GLN HB2 . . 5.500 5.107 4.889 5.239 . 0 0 "[ . 1]" 1
553 1 27 ILE MD 1 59 GLN HB3 . . 5.500 4.655 4.391 5.218 . 0 0 "[ . 1]" 1
554 1 27 ILE MD 1 60 VAL H . . 4.230 3.548 2.978 3.963 . 0 0 "[ . 1]" 1
555 1 27 ILE MD 1 60 VAL HA . . 4.430 3.693 3.536 3.842 . 0 0 "[ . 1]" 1
556 1 27 ILE MD 1 60 VAL HB . . 5.500 4.997 3.642 5.445 . 0 0 "[ . 1]" 1
557 1 27 ILE MD 1 60 VAL QG . . 4.580 3.347 3.235 3.777 . 0 0 "[ . 1]" 1
558 1 27 ILE HG12 1 27 ILE MG . . 3.530 3.195 3.184 3.198 . 0 0 "[ . 1]" 1
559 1 27 ILE HG12 1 32 VAL HA . . 5.120 5.067 4.954 5.156 0.036 3 0 "[ . 1]" 1
560 1 27 ILE HG12 1 32 VAL MG1 . . 4.170 3.524 3.374 3.731 . 0 0 "[ . 1]" 1
561 1 27 ILE HG12 1 59 GLN HA . . 5.050 3.679 3.543 4.202 . 0 0 "[ . 1]" 1
562 1 27 ILE HG12 1 60 VAL H . . 4.520 2.890 2.322 3.581 . 0 0 "[ . 1]" 1
563 1 27 ILE HG12 1 60 VAL QG . . 3.640 2.088 1.886 2.847 . 0 0 "[ . 1]" 1
564 1 27 ILE HG13 1 32 VAL MG1 . . 4.690 4.207 4.116 4.360 . 0 0 "[ . 1]" 1
565 1 27 ILE HG13 1 56 LEU QD . . 4.660 3.907 3.268 4.087 . 0 0 "[ . 1]" 1
566 1 27 ILE HG13 1 58 ILE MD . . 4.840 3.616 3.307 4.024 . 0 0 "[ . 1]" 1
567 1 27 ILE HG13 1 59 GLN HA . . 4.660 2.378 2.178 2.815 . 0 0 "[ . 1]" 1
568 1 27 ILE HG13 1 60 VAL H . . 4.160 2.216 1.947 2.643 . 0 0 "[ . 1]" 1
569 1 27 ILE HG13 1 60 VAL HA . . 4.370 3.673 3.264 4.234 . 0 0 "[ . 1]" 1
570 1 27 ILE HG13 1 60 VAL QG . . 4.810 2.372 2.050 2.903 . 0 0 "[ . 1]" 1
571 1 27 ILE MG 1 28 ASP H . . 3.390 3.232 3.056 3.320 . 0 0 "[ . 1]" 1
572 1 27 ILE MG 1 28 ASP HA . . 4.500 4.211 4.139 4.260 . 0 0 "[ . 1]" 1
573 1 27 ILE MG 1 31 VAL H . . 5.500 5.432 5.307 5.508 0.008 1 0 "[ . 1]" 1
574 1 27 ILE MG 1 32 VAL HA . . 4.120 3.703 3.634 3.780 . 0 0 "[ . 1]" 1
575 1 27 ILE MG 1 32 VAL MG1 . . 3.800 3.651 3.554 3.731 . 0 0 "[ . 1]" 1
576 1 27 ILE MG 1 56 LEU HB2 . . 5.500 4.767 4.477 5.152 . 0 0 "[ . 1]" 1
577 1 27 ILE MG 1 56 LEU QD . . 2.700 2.538 2.187 2.668 . 0 0 "[ . 1]" 1
578 1 27 ILE MG 1 56 LEU HG . . 5.500 5.085 4.477 5.286 . 0 0 "[ . 1]" 1
579 1 27 ILE MG 1 58 ILE MD . . 4.230 3.926 3.790 4.200 . 0 0 "[ . 1]" 1
580 1 27 ILE MG 1 59 GLN HA . . 4.630 3.727 3.465 3.966 . 0 0 "[ . 1]" 1
581 1 27 ILE MG 1 60 VAL HB . . 5.500 5.363 4.658 5.530 0.030 1 0 "[ . 1]" 1
582 1 28 ASP H 1 28 ASP HB2 . . 3.780 2.096 2.067 2.159 . 0 0 "[ . 1]" 1
583 1 28 ASP H 1 31 VAL H . . 4.750 4.576 4.486 4.620 . 0 0 "[ . 1]" 1
584 1 28 ASP H 1 32 VAL HA . . 3.840 2.297 2.247 2.390 . 0 0 "[ . 1]" 1
585 1 28 ASP H 1 32 VAL MG2 . . 3.910 3.474 3.410 3.573 . 0 0 "[ . 1]" 1
586 1 28 ASP H 1 33 LEU H . . 4.000 3.148 2.924 3.307 . 0 0 "[ . 1]" 1
587 1 28 ASP HA 1 31 VAL QG . . 4.960 4.119 4.102 4.157 . 0 0 "[ . 1]" 1
588 1 28 ASP HB2 1 29 LYS H . . 3.810 3.673 3.610 3.724 . 0 0 "[ . 1]" 1
589 1 28 ASP HB2 1 31 VAL H . . 4.280 3.235 2.994 3.497 . 0 0 "[ . 1]" 1
590 1 28 ASP HB2 1 31 VAL HB . . 4.510 4.252 4.043 4.437 . 0 0 "[ . 1]" 1
591 1 28 ASP HB2 1 31 VAL QG . . 4.410 1.981 1.921 2.053 . 0 0 "[ . 1]" 1
592 1 28 ASP HB2 1 33 LEU H . . 4.480 4.123 3.745 4.391 . 0 0 "[ . 1]" 1
593 1 28 ASP HB3 1 29 LYS H . . 3.520 2.335 2.187 2.549 . 0 0 "[ . 1]" 1
594 1 28 ASP HB3 1 29 LYS QB . . 5.310 4.651 4.536 4.857 . 0 0 "[ . 1]" 1
595 1 28 ASP HB3 1 29 LYS QG . . 4.810 3.498 3.370 3.596 . 0 0 "[ . 1]" 1
596 1 28 ASP HB3 1 30 ASP H . . 4.640 2.424 2.174 2.666 . 0 0 "[ . 1]" 1
597 1 28 ASP HB3 1 30 ASP QB . . 4.760 4.310 3.995 4.755 . 0 0 "[ . 1]" 1
598 1 28 ASP HB3 1 31 VAL H . . 4.760 1.963 1.938 2.019 . 0 0 "[ . 1]" 1
599 1 28 ASP HB3 1 31 VAL HB . . 5.500 4.539 4.333 4.718 . 0 0 "[ . 1]" 1
600 1 28 ASP HB3 1 31 VAL MG1 . . 4.450 3.944 3.880 4.124 . 0 0 "[ . 1]" 1
601 1 28 ASP HB3 1 31 VAL MG2 . . 4.450 2.126 2.017 2.214 . 0 0 "[ . 1]" 1
602 1 29 LYS H 1 29 LYS HB2 . . 4.070 3.621 3.605 3.630 . 0 0 "[ . 1]" 1
603 1 29 LYS H 1 29 LYS HB3 . . 4.070 2.705 2.583 2.814 . 0 0 "[ . 1]" 1
604 1 29 LYS H 1 29 LYS QG . . 3.250 2.014 1.927 2.215 . 0 0 "[ . 1]" 1
605 1 29 LYS H 1 30 ASP H . . 3.860 2.368 2.339 2.400 . 0 0 "[ . 1]" 1
606 1 29 LYS H 1 31 VAL H . . 3.580 3.487 3.381 3.597 0.017 5 0 "[ . 1]" 1
607 1 29 LYS HA 1 29 LYS HD2 . . 5.500 4.649 4.138 5.500 0.000 10 0 "[ . 1]" 1
608 1 29 LYS HA 1 29 LYS HD3 . . 5.500 4.984 4.435 5.468 . 0 0 "[ . 1]" 1
609 1 29 LYS HA 1 29 LYS HG2 . . 4.210 3.665 3.568 3.727 . 0 0 "[ . 1]" 1
610 1 29 LYS HA 1 29 LYS QG . . 3.570 3.348 3.336 3.395 . 0 0 "[ . 1]" 1
611 1 29 LYS HA 1 29 LYS HG3 . . 4.210 3.888 3.781 4.187 . 0 0 "[ . 1]" 1
612 1 29 LYS QB 1 29 LYS QE . . 4.460 3.033 2.237 3.633 . 0 0 "[ . 1]" 1
613 1 29 LYS QB 1 30 ASP H . . 3.640 3.488 3.379 3.616 . 0 0 "[ . 1]" 1
614 1 29 LYS HB2 1 30 ASP H . . 4.140 3.846 3.688 4.079 . 0 0 "[ . 1]" 1
615 1 29 LYS HB3 1 30 ASP H . . 4.140 4.002 3.922 4.103 . 0 0 "[ . 1]" 1
616 1 29 LYS HD2 1 30 ASP H . . 5.500 4.714 4.332 5.205 . 0 0 "[ . 1]" 1
617 1 29 LYS HD3 1 30 ASP H . . 5.500 4.536 3.601 5.082 . 0 0 "[ . 1]" 1
618 1 29 LYS QG 1 30 ASP H . . 3.880 2.159 1.925 2.466 . 0 0 "[ . 1]" 1
619 1 29 LYS QG 1 30 ASP HA . . 4.330 3.882 3.787 4.043 . 0 0 "[ . 1]" 1
620 1 29 LYS QG 1 31 VAL H . . 4.160 3.652 3.458 3.900 . 0 0 "[ . 1]" 1
621 1 29 LYS HG2 1 30 ASP H . . 4.480 2.335 1.945 2.752 . 0 0 "[ . 1]" 1
622 1 29 LYS HG3 1 30 ASP H . . 4.480 2.847 2.226 3.638 . 0 0 "[ . 1]" 1
623 1 30 ASP H 1 30 ASP HB2 . . 3.800 2.645 2.435 3.670 . 0 0 "[ . 1]" 1
624 1 30 ASP H 1 30 ASP HB3 . . 3.800 3.586 3.171 3.778 . 0 0 "[ . 1]" 1
625 1 30 ASP H 1 31 VAL H . . 3.250 1.865 1.838 1.886 . 0 0 "[ . 1]" 1
626 1 30 ASP HA 1 31 VAL QG . . 4.470 4.231 4.206 4.239 . 0 0 "[ . 1]" 1
627 1 30 ASP HA 1 46 ALA MB . . 4.010 4.011 3.949 4.040 0.030 8 0 "[ . 1]" 1
628 1 30 ASP QB 1 31 VAL H . . 4.060 2.904 2.731 3.356 . 0 0 "[ . 1]" 1
629 1 30 ASP QB 1 31 VAL QG . . 3.680 2.776 2.672 2.998 . 0 0 "[ . 1]" 1
630 1 30 ASP QB 1 46 ALA H . . 5.310 5.227 5.125 5.312 0.002 2 0 "[ . 1]" 1
631 1 30 ASP QB 1 46 ALA MB . . 4.860 4.788 4.737 4.862 0.002 4 0 "[ . 1]" 1
632 1 30 ASP HB2 1 31 VAL H . . 4.940 3.095 2.801 3.540 . 0 0 "[ . 1]" 1
633 1 30 ASP HB3 1 31 VAL H . . 4.940 3.653 3.147 4.164 . 0 0 "[ . 1]" 1
634 1 31 VAL H 1 31 VAL MG1 . . 3.810 2.730 2.677 2.865 . 0 0 "[ . 1]" 1
635 1 31 VAL H 1 31 VAL QG . . 3.020 2.008 1.901 2.048 . 0 0 "[ . 1]" 1
636 1 31 VAL H 1 31 VAL MG2 . . 3.810 2.069 1.929 2.126 . 0 0 "[ . 1]" 1
637 1 31 VAL H 1 32 VAL H . . 4.590 4.441 4.437 4.446 . 0 0 "[ . 1]" 1
638 1 31 VAL H 1 46 ALA MB . . 4.540 4.433 4.370 4.527 . 0 0 "[ . 1]" 1
639 1 31 VAL HA 1 31 VAL MG1 . . 3.430 2.302 2.220 2.332 . 0 0 "[ . 1]" 1
640 1 31 VAL HA 1 31 VAL QG . . 2.960 2.253 2.181 2.279 . 0 0 "[ . 1]" 1
641 1 31 VAL HA 1 31 VAL MG2 . . 3.430 3.200 3.199 3.203 . 0 0 "[ . 1]" 1
642 1 31 VAL HA 1 32 VAL H . . 3.400 2.602 2.591 2.611 . 0 0 "[ . 1]" 1
643 1 31 VAL HA 1 32 VAL MG2 . . 3.940 3.450 3.255 3.552 . 0 0 "[ . 1]" 1
644 1 31 VAL HA 1 45 PRO HA . . 3.670 2.612 2.505 2.721 . 0 0 "[ . 1]" 1
645 1 31 VAL HA 1 45 PRO QB . . 5.340 4.251 4.143 4.361 . 0 0 "[ . 1]" 1
646 1 31 VAL HA 1 46 ALA H . . 4.010 2.097 2.029 2.147 . 0 0 "[ . 1]" 1
647 1 31 VAL HA 1 46 ALA HA . . 5.000 4.437 4.306 4.510 . 0 0 "[ . 1]" 1
648 1 31 VAL HA 1 46 ALA MB . . 3.710 2.984 2.891 3.136 . 0 0 "[ . 1]" 1
649 1 31 VAL HB 1 32 VAL H . . 3.700 2.034 1.985 2.058 . 0 0 "[ . 1]" 1
650 1 31 VAL HB 1 43 ALA MB . . 4.640 4.342 4.255 4.406 . 0 0 "[ . 1]" 1
651 1 31 VAL HB 1 44 ILE H . . 5.130 3.716 3.523 3.794 . 0 0 "[ . 1]" 1
652 1 31 VAL HB 1 46 ALA H . . 5.070 3.983 3.883 4.049 . 0 0 "[ . 1]" 1
653 1 31 VAL QG 1 32 VAL H . . 3.800 2.770 2.723 2.874 . 0 0 "[ . 1]" 1
654 1 31 VAL QG 1 32 VAL HA . . 4.150 3.418 3.355 3.582 . 0 0 "[ . 1]" 1
655 1 31 VAL QG 1 33 LEU HG . . 4.180 3.342 3.145 3.404 . 0 0 "[ . 1]" 1
656 1 31 VAL QG 1 43 ALA HA . . 4.780 4.309 4.234 4.369 . 0 0 "[ . 1]" 1
657 1 31 VAL QG 1 43 ALA MB . . 3.620 3.620 3.581 3.658 0.038 3 0 "[ . 1]" 1
658 1 31 VAL QG 1 44 ILE H . . 4.020 4.010 3.894 4.044 0.024 3 0 "[ . 1]" 1
659 1 31 VAL QG 1 45 PRO HA . . 3.890 2.830 2.501 2.973 . 0 0 "[ . 1]" 1
660 1 31 VAL QG 1 45 PRO QB . . 4.550 3.557 3.348 3.711 . 0 0 "[ . 1]" 1
661 1 31 VAL MG1 1 43 ALA MB . . 4.420 4.178 4.004 4.279 . 0 0 "[ . 1]" 1
662 1 31 VAL MG1 1 45 PRO HA . . 4.960 2.857 2.512 3.007 . 0 0 "[ . 1]" 1
663 1 31 VAL MG2 1 43 ALA MB . . 4.420 3.972 3.910 4.073 . 0 0 "[ . 1]" 1
664 1 31 VAL MG2 1 45 PRO HA . . 4.960 4.607 4.539 4.702 . 0 0 "[ . 1]" 1
665 1 32 VAL H 1 32 VAL HB . . 4.060 2.757 2.736 2.781 . 0 0 "[ . 1]" 1
666 1 32 VAL H 1 32 VAL MG1 . . 4.550 3.876 3.851 3.898 . 0 0 "[ . 1]" 1
667 1 32 VAL H 1 32 VAL MG2 . . 4.240 3.072 2.944 3.138 . 0 0 "[ . 1]" 1
668 1 32 VAL H 1 43 ALA HA . . 5.040 4.932 4.825 5.050 0.010 6 0 "[ . 1]" 1
669 1 32 VAL H 1 44 ILE H . . 4.050 3.330 3.272 3.390 . 0 0 "[ . 1]" 1
670 1 32 VAL H 1 44 ILE HA . . 5.240 4.929 4.890 4.964 . 0 0 "[ . 1]" 1
671 1 32 VAL H 1 45 PRO HA . . 4.500 3.402 3.332 3.472 . 0 0 "[ . 1]" 1
672 1 32 VAL H 1 46 ALA H . . 4.590 3.449 3.393 3.530 . 0 0 "[ . 1]" 1
673 1 32 VAL H 1 46 ALA HA . . 4.590 4.523 4.362 4.603 0.013 4 0 "[ . 1]" 1
674 1 32 VAL H 1 46 ALA MB . . 4.400 4.022 3.871 4.155 . 0 0 "[ . 1]" 1
675 1 32 VAL HA 1 32 VAL MG1 . . 3.460 2.359 2.325 2.396 . 0 0 "[ . 1]" 1
676 1 32 VAL HA 1 32 VAL MG2 . . 2.890 2.293 2.250 2.364 . 0 0 "[ . 1]" 1
677 1 32 VAL HA 1 33 LEU H . . 2.920 2.186 2.141 2.206 . 0 0 "[ . 1]" 1
678 1 32 VAL HA 1 33 LEU HA . . 5.050 4.381 4.373 4.396 . 0 0 "[ . 1]" 1
679 1 32 VAL HA 1 33 LEU HB2 . . 5.100 4.367 4.341 4.390 . 0 0 "[ . 1]" 1
680 1 32 VAL HA 1 46 ALA MB . . 5.380 4.368 4.224 4.515 . 0 0 "[ . 1]" 1
681 1 32 VAL HA 1 49 PHE QD . . 5.500 5.106 4.910 5.455 . 0 0 "[ . 1]" 1
682 1 32 VAL HA 1 49 PHE QE . . 5.250 4.812 4.629 5.257 0.007 8 0 "[ . 1]" 1
683 1 32 VAL HA 1 56 LEU QD . . 5.000 4.525 4.317 4.719 . 0 0 "[ . 1]" 1
684 1 32 VAL HA 1 58 ILE MD . . 5.500 5.140 4.888 5.503 0.003 3 0 "[ . 1]" 1
685 1 32 VAL HB 1 44 ILE H . . 5.460 4.432 4.284 4.715 . 0 0 "[ . 1]" 1
686 1 32 VAL HB 1 44 ILE HB . . 4.050 3.440 3.323 3.608 . 0 0 "[ . 1]" 1
687 1 32 VAL HB 1 44 ILE MG . . 4.420 3.817 3.763 3.886 . 0 0 "[ . 1]" 1
688 1 32 VAL HB 1 46 ALA H . . 5.330 4.192 4.048 4.268 . 0 0 "[ . 1]" 1
689 1 32 VAL HB 1 46 ALA HA . . 4.330 3.298 3.154 3.394 . 0 0 "[ . 1]" 1
690 1 32 VAL HB 1 49 PHE QD . . 4.050 2.369 2.205 2.644 . 0 0 "[ . 1]" 1
691 1 32 VAL HB 1 49 PHE QE . . 3.790 2.098 1.974 2.511 . 0 0 "[ . 1]" 1
692 1 32 VAL HB 1 49 PHE HZ . . 4.950 4.429 4.330 4.564 . 0 0 "[ . 1]" 1
693 1 32 VAL HB 1 58 ILE MD . . 5.020 4.128 3.852 4.405 . 0 0 "[ . 1]" 1
694 1 32 VAL MG1 1 33 LEU H . . 3.840 2.302 2.111 2.700 . 0 0 "[ . 1]" 1
695 1 32 VAL MG1 1 33 LEU HA . . 5.300 3.808 3.693 4.011 . 0 0 "[ . 1]" 1
696 1 32 VAL MG1 1 34 VAL HA . . 5.220 4.187 4.124 4.293 . 0 0 "[ . 1]" 1
697 1 32 VAL MG1 1 34 VAL MG2 . . 3.260 2.215 2.086 2.310 . 0 0 "[ . 1]" 1
698 1 32 VAL MG1 1 44 ILE H . . 5.500 4.756 4.546 5.001 . 0 0 "[ . 1]" 1
699 1 32 VAL MG1 1 44 ILE HB . . 4.550 3.795 3.604 3.955 . 0 0 "[ . 1]" 1
700 1 32 VAL MG1 1 44 ILE MG . . 4.690 4.348 4.208 4.497 . 0 0 "[ . 1]" 1
701 1 32 VAL MG1 1 46 ALA HA . . 4.850 4.208 4.108 4.281 . 0 0 "[ . 1]" 1
702 1 32 VAL MG1 1 46 ALA MB . . 4.780 4.131 4.053 4.182 . 0 0 "[ . 1]" 1
703 1 32 VAL MG1 1 49 PHE QD . . 4.050 2.991 2.716 3.325 . 0 0 "[ . 1]" 1
704 1 32 VAL MG1 1 49 PHE QE . . 3.970 2.455 2.102 2.818 . 0 0 "[ . 1]" 1
705 1 32 VAL MG1 1 49 PHE HZ . . 4.610 3.653 3.461 3.847 . 0 0 "[ . 1]" 1
706 1 32 VAL MG1 1 56 LEU MD1 . . 4.190 3.930 3.727 4.145 . 0 0 "[ . 1]" 1
707 1 32 VAL MG1 1 56 LEU QD . . 3.470 3.221 3.032 3.391 . 0 0 "[ . 1]" 1
708 1 32 VAL MG1 1 56 LEU MD2 . . 4.190 3.425 3.167 3.599 . 0 0 "[ . 1]" 1
709 1 32 VAL MG1 1 58 ILE MD . . 3.370 2.190 1.931 2.547 . 0 0 "[ . 1]" 1
710 1 32 VAL MG1 1 58 ILE HG12 . . 4.850 4.121 3.759 4.597 . 0 0 "[ . 1]" 1
711 1 32 VAL MG2 1 33 LEU H . . 4.350 3.912 3.843 4.039 . 0 0 "[ . 1]" 1
712 1 32 VAL MG2 1 45 PRO HA . . 5.390 4.531 4.318 4.704 . 0 0 "[ . 1]" 1
713 1 32 VAL MG2 1 46 ALA H . . 4.230 3.146 2.897 3.362 . 0 0 "[ . 1]" 1
714 1 32 VAL MG2 1 46 ALA HA . . 3.240 2.078 1.976 2.297 . 0 0 "[ . 1]" 1
715 1 32 VAL MG2 1 46 ALA MB . . 3.090 1.857 1.844 1.880 . 0 0 "[ . 1]" 1
716 1 32 VAL MG2 1 49 PHE HB2 . . 4.680 3.311 3.143 3.463 . 0 0 "[ . 1]" 1
717 1 32 VAL MG2 1 49 PHE QD . . 3.150 2.357 2.165 2.739 . 0 0 "[ . 1]" 1
718 1 32 VAL MG2 1 49 PHE QE . . 4.620 3.562 3.454 3.847 . 0 0 "[ . 1]" 1
719 1 32 VAL MG2 1 50 LYS H . . 5.500 5.032 4.869 5.148 . 0 0 "[ . 1]" 1
720 1 32 VAL MG2 1 56 LEU QD . . 2.460 2.013 1.811 2.197 . 0 0 "[ . 1]" 1
721 1 32 VAL MG2 1 56 LEU HG . . 4.590 3.953 3.757 4.176 . 0 0 "[ . 1]" 1
722 1 33 LEU H 1 33 LEU HB2 . . 3.290 2.340 2.271 2.369 . 0 0 "[ . 1]" 1
723 1 33 LEU H 1 33 LEU HB3 . . 3.860 3.594 3.553 3.613 . 0 0 "[ . 1]" 1
724 1 33 LEU H 1 33 LEU QD . . 4.410 3.365 3.203 3.493 . 0 0 "[ . 1]" 1
725 1 33 LEU H 1 33 LEU HG . . 4.240 3.147 2.942 3.247 . 0 0 "[ . 1]" 1
726 1 33 LEU H 1 44 ILE H . . 5.500 5.250 5.185 5.310 . 0 0 "[ . 1]" 1
727 1 33 LEU HA 1 33 LEU MD1 . . 3.940 3.847 3.841 3.854 . 0 0 "[ . 1]" 1
728 1 33 LEU HA 1 33 LEU QD . . 2.970 2.365 2.315 2.404 . 0 0 "[ . 1]" 1
729 1 33 LEU HA 1 33 LEU MD2 . . 3.940 2.387 2.334 2.429 . 0 0 "[ . 1]" 1
730 1 33 LEU HA 1 33 LEU HG . . 4.270 2.634 2.611 2.697 . 0 0 "[ . 1]" 1
731 1 33 LEU HA 1 34 VAL H . . 2.960 2.153 2.142 2.188 . 0 0 "[ . 1]" 1
732 1 33 LEU HA 1 34 VAL HB . . 4.750 4.689 4.637 4.740 . 0 0 "[ . 1]" 1
733 1 33 LEU HA 1 34 VAL MG1 . . 5.500 5.450 5.425 5.469 . 0 0 "[ . 1]" 1
734 1 33 LEU HA 1 34 VAL MG2 . . 4.510 3.600 3.480 3.708 . 0 0 "[ . 1]" 1
735 1 33 LEU HA 1 43 ALA H . . 5.500 5.477 5.341 5.518 0.018 4 0 "[ . 1]" 1
736 1 33 LEU HA 1 43 ALA HA . . 3.560 3.411 3.362 3.462 . 0 0 "[ . 1]" 1
737 1 33 LEU HA 1 43 ALA MB . . 4.880 4.820 4.780 4.872 . 0 0 "[ . 1]" 1
738 1 33 LEU HA 1 44 ILE H . . 3.870 3.552 3.497 3.630 . 0 0 "[ . 1]" 1
739 1 33 LEU HA 1 44 ILE HG12 . . 5.310 4.826 4.672 4.992 . 0 0 "[ . 1]" 1
740 1 33 LEU HB2 1 33 LEU QD . . 3.020 2.087 1.973 2.159 . 0 0 "[ . 1]" 1
741 1 33 LEU HB2 1 34 VAL H . . 5.060 4.315 4.188 4.379 . 0 0 "[ . 1]" 1
742 1 33 LEU HB3 1 33 LEU MD1 . . 3.190 2.619 2.576 2.679 . 0 0 "[ . 1]" 1
743 1 33 LEU HB3 1 33 LEU QD . . 2.680 2.094 2.073 2.118 . 0 0 "[ . 1]" 1
744 1 33 LEU HB3 1 33 LEU MD2 . . 3.190 2.203 2.176 2.219 . 0 0 "[ . 1]" 1
745 1 33 LEU HB3 1 34 VAL H . . 4.350 3.311 3.079 3.433 . 0 0 "[ . 1]" 1
746 1 33 LEU HB3 1 34 VAL HA . . 4.750 4.374 4.289 4.416 . 0 0 "[ . 1]" 1
747 1 33 LEU HB3 1 41 GLU HA . . 4.830 4.812 4.671 4.835 0.005 7 0 "[ . 1]" 1
748 1 33 LEU HB3 1 41 GLU HB2 . . 4.180 3.549 3.213 3.768 . 0 0 "[ . 1]" 1
749 1 33 LEU HB3 1 41 GLU HB3 . . 3.840 2.447 2.238 2.521 . 0 0 "[ . 1]" 1
750 1 33 LEU HB3 1 41 GLU HG2 . . 4.480 2.857 2.757 2.946 . 0 0 "[ . 1]" 1
751 1 33 LEU QD 1 34 VAL H . . 3.520 3.275 3.159 3.372 . 0 0 "[ . 1]" 1
752 1 33 LEU QD 1 41 GLU HA . . 4.730 3.880 3.805 3.922 . 0 0 "[ . 1]" 1
753 1 33 LEU QD 1 41 GLU HB2 . . 3.130 1.943 1.867 2.028 . 0 0 "[ . 1]" 1
754 1 33 LEU QD 1 41 GLU HG2 . . 3.820 2.834 2.654 3.013 . 0 0 "[ . 1]" 1
755 1 33 LEU QD 1 42 SER HA . . 4.720 4.655 4.355 4.723 0.003 5 0 "[ . 1]" 1
756 1 33 LEU QD 1 42 SER QB . . 4.850 4.852 4.830 4.864 0.014 3 0 "[ . 1]" 1
757 1 33 LEU QD 1 43 ALA HA . . 3.160 3.078 2.849 3.163 0.003 7 0 "[ . 1]" 1
758 1 33 LEU QD 1 43 ALA MB . . 3.550 3.462 3.292 3.519 . 0 0 "[ . 1]" 1
759 1 33 LEU QD 1 44 ILE H . . 4.490 4.244 4.083 4.338 . 0 0 "[ . 1]" 1
760 1 33 LEU MD1 1 41 GLU HB2 . . 3.950 3.739 3.199 3.952 0.002 7 0 "[ . 1]" 1
761 1 33 LEU MD1 1 41 GLU HB3 . . 4.080 3.891 3.676 3.996 . 0 0 "[ . 1]" 1
762 1 33 LEU MD1 1 41 GLU HG2 . . 4.360 3.571 3.424 3.737 . 0 0 "[ . 1]" 1
763 1 33 LEU MD2 1 41 GLU HB2 . . 3.950 1.950 1.880 2.036 . 0 0 "[ . 1]" 1
764 1 33 LEU MD2 1 41 GLU HB3 . . 4.080 1.967 1.906 2.018 . 0 0 "[ . 1]" 1
765 1 33 LEU MD2 1 41 GLU HG2 . . 4.360 2.980 2.750 3.307 . 0 0 "[ . 1]" 1
766 1 33 LEU HG 1 41 GLU HG2 . . 5.500 5.309 5.210 5.400 . 0 0 "[ . 1]" 1
767 1 33 LEU HG 1 43 ALA HA . . 4.790 4.142 4.098 4.177 . 0 0 "[ . 1]" 1
768 1 33 LEU HG 1 44 ILE H . . 4.700 4.712 4.704 4.724 0.024 3 0 "[ . 1]" 1
769 1 34 VAL H 1 34 VAL HB . . 3.370 2.767 2.705 2.857 . 0 0 "[ . 1]" 1
770 1 34 VAL H 1 34 VAL MG1 . . 4.670 3.908 3.881 3.946 . 0 0 "[ . 1]" 1
771 1 34 VAL H 1 34 VAL MG2 . . 3.440 2.771 2.702 2.826 . 0 0 "[ . 1]" 1
772 1 34 VAL H 1 41 GLU HA . . 4.690 4.586 4.451 4.687 . 0 0 "[ . 1]" 1
773 1 34 VAL H 1 41 GLU HG2 . . 5.500 5.073 4.905 5.383 . 0 0 "[ . 1]" 1
774 1 34 VAL H 1 41 GLU HG3 . . 5.500 5.243 4.986 5.414 . 0 0 "[ . 1]" 1
775 1 34 VAL H 1 42 SER QB . . 4.390 3.678 3.294 4.052 . 0 0 "[ . 1]" 1
776 1 34 VAL H 1 43 ALA H . . 5.500 5.385 5.223 5.460 . 0 0 "[ . 1]" 1
777 1 34 VAL H 1 43 ALA HA . . 4.300 4.302 4.259 4.320 0.020 4 0 "[ . 1]" 1
778 1 34 VAL HA 1 34 VAL MG1 . . 3.080 2.302 2.206 2.370 . 0 0 "[ . 1]" 1
779 1 34 VAL HA 1 34 VAL MG2 . . 3.460 2.374 2.327 2.416 . 0 0 "[ . 1]" 1
780 1 34 VAL HA 1 35 ASP H . . 3.420 2.264 2.244 2.280 . 0 0 "[ . 1]" 1
781 1 34 VAL HA 1 64 VAL QG . . 5.010 3.938 3.741 4.190 . 0 0 "[ . 1]" 1
782 1 34 VAL HB 1 35 ASP H . . 4.300 3.775 3.713 3.879 . 0 0 "[ . 1]" 1
783 1 34 VAL HB 1 36 ALA MB . . 5.130 4.405 4.248 4.516 . 0 0 "[ . 1]" 1
784 1 34 VAL HB 1 42 SER H . . 5.170 4.477 4.189 4.737 . 0 0 "[ . 1]" 1
785 1 34 VAL HB 1 42 SER HB2 . . 4.530 3.560 2.781 4.545 0.015 3 0 "[ . 1]" 1
786 1 34 VAL HB 1 42 SER QB . . 3.670 3.235 2.755 3.672 0.002 3 0 "[ . 1]" 1
787 1 34 VAL HB 1 42 SER HB3 . . 4.530 4.089 3.078 4.520 . 0 0 "[ . 1]" 1
788 1 34 VAL HB 1 44 ILE MD . . 5.500 4.911 4.737 5.174 . 0 0 "[ . 1]" 1
789 1 34 VAL HB 1 49 PHE HZ . . 5.140 3.574 3.129 3.771 . 0 0 "[ . 1]" 1
790 1 34 VAL HB 1 64 VAL QG . . 5.440 3.678 3.526 4.011 . 0 0 "[ . 1]" 1
791 1 34 VAL HB 1 66 VAL MG1 . . 4.130 3.623 3.424 3.879 . 0 0 "[ . 1]" 1
792 1 34 VAL HB 1 66 VAL QG . . 3.560 2.205 2.060 2.522 . 0 0 "[ . 1]" 1
793 1 34 VAL HB 1 66 VAL MG2 . . 4.130 2.225 2.077 2.565 . 0 0 "[ . 1]" 1
794 1 34 VAL MG1 1 35 ASP H . . 3.270 2.094 1.909 2.194 . 0 0 "[ . 1]" 1
795 1 34 VAL MG1 1 35 ASP HA . . 4.940 3.787 3.667 3.923 . 0 0 "[ . 1]" 1
796 1 34 VAL MG1 1 36 ALA H . . 4.740 3.789 3.238 4.149 . 0 0 "[ . 1]" 1
797 1 34 VAL MG1 1 36 ALA HA . . 4.410 3.822 3.517 3.981 . 0 0 "[ . 1]" 1
798 1 34 VAL MG1 1 36 ALA MB . . 3.530 3.488 3.223 3.539 0.009 2 0 "[ . 1]" 1
799 1 34 VAL MG1 1 37 GLY H . . 5.460 5.353 5.199 5.496 0.036 7 0 "[ . 1]" 1
800 1 34 VAL MG1 1 42 SER H . . 5.250 4.958 4.662 5.205 . 0 0 "[ . 1]" 1
801 1 34 VAL MG1 1 42 SER QB . . 4.250 4.075 3.878 4.255 0.005 3 0 "[ . 1]" 1
802 1 34 VAL MG1 1 44 ILE MG . . 5.470 5.236 5.142 5.433 . 0 0 "[ . 1]" 1
803 1 34 VAL MG1 1 49 PHE QE . . 4.560 3.975 3.719 4.147 . 0 0 "[ . 1]" 1
804 1 34 VAL MG1 1 49 PHE HZ . . 3.950 3.551 3.433 3.658 . 0 0 "[ . 1]" 1
805 1 34 VAL MG1 1 64 VAL HB . . 4.510 4.095 3.912 4.351 . 0 0 "[ . 1]" 1
806 1 34 VAL MG1 1 64 VAL QG . . 3.550 1.859 1.783 2.014 . 0 0 "[ . 1]" 1
807 1 34 VAL MG1 1 66 VAL H . . 5.500 4.385 3.966 4.945 . 0 0 "[ . 1]" 1
808 1 34 VAL MG1 1 66 VAL HA . . 5.330 4.734 4.406 5.012 . 0 0 "[ . 1]" 1
809 1 34 VAL MG1 1 66 VAL HB . . 4.310 3.952 3.755 4.257 . 0 0 "[ . 1]" 1
810 1 34 VAL MG1 1 66 VAL MG1 . . 3.940 3.870 3.596 3.941 0.001 9 0 "[ . 1]" 1
811 1 34 VAL MG1 1 66 VAL QG . . 2.540 1.941 1.857 2.142 . 0 0 "[ . 1]" 1
812 1 34 VAL MG1 1 66 VAL MG2 . . 3.940 1.946 1.863 2.151 . 0 0 "[ . 1]" 1
813 1 34 VAL MG2 1 42 SER HB2 . . 5.470 4.802 4.077 5.436 . 0 0 "[ . 1]" 1
814 1 34 VAL MG2 1 42 SER HB3 . . 5.470 5.009 4.178 5.479 0.009 7 0 "[ . 1]" 1
815 1 34 VAL MG2 1 44 ILE H . . 5.390 4.393 4.288 4.592 . 0 0 "[ . 1]" 1
816 1 34 VAL MG2 1 44 ILE MG . . 4.050 3.687 3.555 3.871 . 0 0 "[ . 1]" 1
817 1 34 VAL MG2 1 49 PHE QE . . 3.980 2.536 2.376 2.669 . 0 0 "[ . 1]" 1
818 1 34 VAL MG2 1 49 PHE HZ . . 4.240 1.936 1.890 2.049 . 0 0 "[ . 1]" 1
819 1 34 VAL MG2 1 64 VAL HB . . 4.490 3.932 3.693 4.269 . 0 0 "[ . 1]" 1
820 1 34 VAL MG2 1 64 VAL QG . . 3.620 1.933 1.831 2.134 . 0 0 "[ . 1]" 1
821 1 35 ASP H 1 35 ASP HB2 . . 3.850 3.109 2.963 3.191 . 0 0 "[ . 1]" 1
822 1 35 ASP H 1 35 ASP HB3 . . 3.790 2.433 2.388 2.504 . 0 0 "[ . 1]" 1
823 1 35 ASP H 1 41 GLU HG3 . . 5.500 5.455 5.261 5.505 0.005 3 0 "[ . 1]" 1
824 1 35 ASP H 1 42 SER H . . 5.500 5.234 4.893 5.474 . 0 0 "[ . 1]" 1
825 1 35 ASP HA 1 36 ALA H . . 3.540 2.182 2.145 2.257 . 0 0 "[ . 1]" 1
826 1 35 ASP HA 1 37 GLY H . . 4.200 3.566 3.381 4.238 0.038 10 0 "[ . 1]" 1
827 1 35 ASP HA 1 38 LEU QD . . 4.980 2.813 2.567 4.269 . 0 0 "[ . 1]" 1
828 1 35 ASP HA 1 41 GLU HA . . 3.760 3.326 3.224 3.460 . 0 0 "[ . 1]" 1
829 1 35 ASP HA 1 41 GLU HG3 . . 4.240 4.008 3.803 4.232 . 0 0 "[ . 1]" 1
830 1 35 ASP HB2 1 41 GLU HG3 . . 4.300 3.546 3.408 3.654 . 0 0 "[ . 1]" 1
831 1 35 ASP HB3 1 41 GLU HG3 . . 5.500 5.229 5.145 5.358 . 0 0 "[ . 1]" 1
832 1 36 ALA H 1 36 ALA MB . . 2.940 2.264 2.063 2.367 . 0 0 "[ . 1]" 1
833 1 36 ALA H 1 37 GLY H . . 3.790 2.669 2.566 2.720 . 0 0 "[ . 1]" 1
834 1 36 ALA H 1 37 GLY QA . . 5.090 4.451 4.362 4.504 . 0 0 "[ . 1]" 1
835 1 36 ALA H 1 38 LEU H . . 4.240 3.914 3.806 3.993 . 0 0 "[ . 1]" 1
836 1 36 ALA H 1 38 LEU HG . . 5.500 4.111 3.540 4.253 . 0 0 "[ . 1]" 1
837 1 36 ALA HA 1 38 LEU H . . 5.390 5.369 5.313 5.487 0.097 7 0 "[ . 1]" 1
838 1 36 ALA HA 1 38 LEU QD . . 4.170 3.619 3.440 4.315 0.145 7 0 "[ . 1]" 1
839 1 36 ALA HA 1 66 VAL QG . . 4.450 3.985 3.331 4.261 . 0 0 "[ . 1]" 1
840 1 36 ALA MB 1 37 GLY H . . 4.370 3.307 2.084 3.572 . 0 0 "[ . 1]" 1
841 1 36 ALA MB 1 37 GLY HA2 . . 5.150 4.855 4.242 5.000 . 0 0 "[ . 1]" 1
842 1 36 ALA MB 1 37 GLY HA3 . . 5.150 4.189 3.702 4.330 . 0 0 "[ . 1]" 1
843 1 36 ALA MB 1 38 LEU H . . 4.730 4.605 4.101 4.735 0.005 9 0 "[ . 1]" 1
844 1 36 ALA MB 1 38 LEU HB3 . . 5.500 4.930 4.733 5.560 0.060 10 0 "[ . 1]" 1
845 1 36 ALA MB 1 38 LEU QD . . 3.310 2.065 1.914 2.586 . 0 0 "[ . 1]" 1
846 1 36 ALA MB 1 42 SER HB2 . . 4.380 3.585 3.365 4.078 . 0 0 "[ . 1]" 1
847 1 36 ALA MB 1 42 SER HB3 . . 4.380 4.150 3.174 4.383 0.003 6 0 "[ . 1]" 1
848 1 36 ALA MB 1 66 VAL HA . . 5.500 5.172 4.529 5.502 0.002 3 0 "[ . 1]" 1
849 1 36 ALA MB 1 66 VAL HB . . 4.040 2.590 2.103 2.994 . 0 0 "[ . 1]" 1
850 1 36 ALA MB 1 66 VAL MG1 . . 3.410 3.161 2.795 3.416 0.006 8 0 "[ . 1]" 1
851 1 36 ALA MB 1 66 VAL QG . . 2.940 2.678 2.085 2.903 . 0 0 "[ . 1]" 1
852 1 36 ALA MB 1 66 VAL MG2 . . 3.410 2.912 2.152 3.209 . 0 0 "[ . 1]" 1
853 1 36 ALA MB 1 68 LEU QD . . 4.230 3.790 3.592 4.096 . 0 0 "[ . 1]" 1
854 1 37 GLY H 1 38 LEU H . . 3.600 2.437 2.058 2.549 . 0 0 "[ . 1]" 1
855 1 37 GLY H 1 38 LEU HA . . 5.290 4.962 4.410 5.125 . 0 0 "[ . 1]" 1
856 1 37 GLY H 1 38 LEU MD1 . . 3.610 2.515 2.009 3.890 0.280 7 0 "[ . 1]" 1
857 1 37 GLY H 1 38 LEU MD2 . . 3.610 3.018 1.969 3.750 0.140 10 0 "[ . 1]" 1
858 1 37 GLY QA 1 38 LEU QD . . 3.600 3.027 2.926 3.609 0.009 10 0 "[ . 1]" 1
859 1 38 LEU H 1 38 LEU HB2 . . 3.910 3.745 3.322 3.848 . 0 0 "[ . 1]" 1
860 1 38 LEU H 1 38 LEU HB3 . . 3.890 3.622 3.596 3.779 . 0 0 "[ . 1]" 1
861 1 38 LEU H 1 38 LEU MD1 . . 4.110 2.563 2.052 3.716 . 0 0 "[ . 1]" 1
862 1 38 LEU H 1 38 LEU QD . . 3.590 1.923 1.813 2.659 . 0 0 "[ . 1]" 1
863 1 38 LEU H 1 38 LEU MD2 . . 4.110 2.169 1.865 4.026 . 0 0 "[ . 1]" 1
864 1 38 LEU H 1 38 LEU HG . . 4.260 3.775 2.011 4.139 . 0 0 "[ . 1]" 1
865 1 38 LEU HA 1 38 LEU MD1 . . 4.060 3.447 3.339 4.125 0.065 7 0 "[ . 1]" 1
866 1 38 LEU HA 1 38 LEU QD . . 3.240 3.017 2.835 3.315 0.075 10 0 "[ . 1]" 1
867 1 38 LEU HA 1 38 LEU MD2 . . 4.060 3.395 2.888 3.862 . 0 0 "[ . 1]" 1
868 1 38 LEU HA 1 39 LYS HA . . 4.900 4.326 4.300 4.343 . 0 0 "[ . 1]" 1
869 1 38 LEU HA 1 39 LYS QG . . 5.340 4.211 4.128 4.291 . 0 0 "[ . 1]" 1
870 1 38 LEU HB2 1 38 LEU MD1 . . 3.430 2.953 2.133 3.148 . 0 0 "[ . 1]" 1
871 1 38 LEU HB2 1 38 LEU QD . . 2.980 2.327 2.095 2.386 . 0 0 "[ . 1]" 1
872 1 38 LEU HB2 1 38 LEU MD2 . . 3.430 2.547 2.466 3.156 . 0 0 "[ . 1]" 1
873 1 38 LEU HB2 1 39 LYS H . . 3.570 2.227 1.992 2.913 . 0 0 "[ . 1]" 1
874 1 38 LEU HB2 1 39 LYS QG . . 3.720 3.264 3.037 3.656 . 0 0 "[ . 1]" 1
875 1 38 LEU HB2 1 40 SER H . . 3.770 2.586 2.380 2.667 . 0 0 "[ . 1]" 1
876 1 38 LEU HB3 1 38 LEU MD1 . . 3.540 2.256 2.097 3.165 . 0 0 "[ . 1]" 1
877 1 38 LEU HB3 1 38 LEU MD2 . . 3.540 2.974 2.127 3.180 . 0 0 "[ . 1]" 1
878 1 38 LEU HB3 1 39 LYS H . . 3.520 3.320 2.914 3.475 . 0 0 "[ . 1]" 1
879 1 38 LEU HB3 1 40 SER H . . 4.630 4.292 3.711 4.428 . 0 0 "[ . 1]" 1
880 1 38 LEU QD 1 39 LYS H . . 4.510 3.335 3.083 3.984 . 0 0 "[ . 1]" 1
881 1 38 LEU QD 1 39 LYS QG . . 4.360 4.029 3.895 4.363 0.003 10 0 "[ . 1]" 1
882 1 38 LEU QD 1 40 SER H . . 4.370 2.870 2.590 3.457 . 0 0 "[ . 1]" 1
883 1 38 LEU QD 1 40 SER QB . . 4.510 3.758 3.633 4.102 . 0 0 "[ . 1]" 1
884 1 38 LEU QD 1 41 GLU HA . . 4.550 2.625 2.361 3.942 . 0 0 "[ . 1]" 1
885 1 38 LEU QD 1 42 SER H . . 4.550 2.598 2.279 3.354 . 0 0 "[ . 1]" 1
886 1 38 LEU QD 1 42 SER HA . . 4.320 3.797 2.674 4.107 . 0 0 "[ . 1]" 1
887 1 38 LEU QD 1 42 SER QB . . 4.180 3.141 2.281 3.584 . 0 0 "[ . 1]" 1
888 1 38 LEU MD1 1 42 SER HA . . 5.030 4.601 2.688 5.034 0.004 5 0 "[ . 1]" 1
889 1 38 LEU MD2 1 42 SER HA . . 5.030 4.225 3.081 4.814 . 0 0 "[ . 1]" 1
890 1 39 LYS H 1 39 LYS QB . . 3.150 2.637 2.510 2.711 . 0 0 "[ . 1]" 1
891 1 39 LYS H 1 39 LYS QG . . 4.200 1.955 1.925 2.054 . 0 0 "[ . 1]" 1
892 1 39 LYS H 1 40 SER H . . 3.380 2.436 2.306 2.683 . 0 0 "[ . 1]" 1
893 1 39 LYS HA 1 39 LYS HD2 . . 5.500 4.887 4.494 5.499 . 0 0 "[ . 1]" 1
894 1 39 LYS HA 1 39 LYS HD3 . . 5.500 4.580 4.021 5.471 . 0 0 "[ . 1]" 1
895 1 39 LYS HA 1 39 LYS HG2 . . 4.150 3.929 3.666 4.159 0.009 3 0 "[ . 1]" 1
896 1 39 LYS HA 1 39 LYS QG . . 3.460 3.359 3.343 3.383 . 0 0 "[ . 1]" 1
897 1 39 LYS HA 1 39 LYS HG3 . . 4.150 3.686 3.571 3.854 . 0 0 "[ . 1]" 1
898 1 39 LYS HA 1 40 SER HA . . 4.880 4.602 4.545 4.622 . 0 0 "[ . 1]" 1
899 1 39 LYS QB 1 40 SER H . . 3.920 3.419 3.396 3.486 . 0 0 "[ . 1]" 1
900 1 39 LYS HB2 1 40 SER H . . 4.630 3.734 3.688 3.821 . 0 0 "[ . 1]" 1
901 1 39 LYS HB3 1 40 SER H . . 4.630 3.966 3.928 4.023 . 0 0 "[ . 1]" 1
902 1 39 LYS QE 1 39 LYS QG . . 3.290 2.197 2.118 2.564 . 0 0 "[ . 1]" 1
903 1 39 LYS HE2 1 40 SER H . . 5.500 4.907 4.419 5.241 . 0 0 "[ . 1]" 1
904 1 39 LYS HE3 1 40 SER H . . 5.500 4.784 4.199 5.202 . 0 0 "[ . 1]" 1
905 1 39 LYS QG 1 40 SER H . . 4.320 2.038 1.940 2.241 . 0 0 "[ . 1]" 1
906 1 40 SER H 1 40 SER HB2 . . 3.940 2.677 2.258 3.634 . 0 0 "[ . 1]" 1
907 1 40 SER H 1 40 SER HB3 . . 3.940 3.507 2.993 3.747 . 0 0 "[ . 1]" 1
908 1 40 SER HA 1 41 GLU H . . 3.190 2.221 2.143 2.622 . 0 0 "[ . 1]" 1
909 1 40 SER HA 1 41 GLU HB2 . . 4.830 4.557 4.460 4.846 0.016 10 0 "[ . 1]" 1
910 1 40 SER HA 1 41 GLU HG3 . . 5.500 4.976 4.851 5.129 . 0 0 "[ . 1]" 1
911 1 40 SER HB2 1 41 GLU H . . 4.570 4.074 3.019 4.528 . 0 0 "[ . 1]" 1
912 1 40 SER HB3 1 41 GLU H . . 4.570 3.514 2.125 4.337 . 0 0 "[ . 1]" 1
913 1 41 GLU H 1 41 GLU HB2 . . 4.110 2.466 2.387 2.521 . 0 0 "[ . 1]" 1
914 1 41 GLU H 1 41 GLU HB3 . . 3.790 3.592 3.584 3.612 . 0 0 "[ . 1]" 1
915 1 41 GLU H 1 41 GLU HG2 . . 4.540 3.867 3.813 4.081 . 0 0 "[ . 1]" 1
916 1 41 GLU H 1 41 GLU HG3 . . 4.070 3.172 2.972 3.648 . 0 0 "[ . 1]" 1
917 1 41 GLU HA 1 41 GLU HG3 . . 3.320 2.347 2.326 2.380 . 0 0 "[ . 1]" 1
918 1 41 GLU HA 1 42 SER H . . 3.030 2.152 2.138 2.203 . 0 0 "[ . 1]" 1
919 1 41 GLU HB2 1 42 SER H . . 4.440 4.277 4.087 4.358 . 0 0 "[ . 1]" 1
920 1 41 GLU HB2 1 43 ALA HA . . 5.500 5.495 5.444 5.521 0.021 3 0 "[ . 1]" 1
921 1 41 GLU HB3 1 42 SER H . . 4.560 3.343 3.006 3.511 . 0 0 "[ . 1]" 1
922 1 41 GLU HG3 1 42 SER H . . 4.710 4.252 4.129 4.330 . 0 0 "[ . 1]" 1
923 1 42 SER H 1 42 SER HB2 . . 4.190 2.423 2.089 3.533 . 0 0 "[ . 1]" 1
924 1 42 SER H 1 42 SER QB . . 3.450 2.258 2.069 2.738 . 0 0 "[ . 1]" 1
925 1 42 SER H 1 42 SER HB3 . . 4.190 3.329 2.243 3.586 . 0 0 "[ . 1]" 1
926 1 42 SER H 1 43 ALA H . . 4.530 4.455 4.420 4.507 . 0 0 "[ . 1]" 1
927 1 42 SER HA 1 43 ALA H . . 2.910 2.140 2.138 2.142 . 0 0 "[ . 1]" 1
928 1 42 SER HA 1 43 ALA HA . . 4.750 4.396 4.377 4.405 . 0 0 "[ . 1]" 1
929 1 42 SER HA 1 43 ALA MB . . 4.030 3.984 3.959 4.006 . 0 0 "[ . 1]" 1
930 1 42 SER HA 1 44 ILE MD . . 5.120 4.716 4.646 4.830 . 0 0 "[ . 1]" 1
931 1 42 SER QB 1 43 ALA H . . 3.830 3.488 3.377 3.805 . 0 0 "[ . 1]" 1
932 1 42 SER QB 1 44 ILE MD . . 4.100 3.158 2.933 3.489 . 0 0 "[ . 1]" 1
933 1 42 SER QB 1 44 ILE HG12 . . 4.240 2.981 2.761 3.629 . 0 0 "[ . 1]" 1
934 1 42 SER QB 1 44 ILE HG13 . . 4.790 3.650 3.437 4.296 . 0 0 "[ . 1]" 1
935 1 42 SER QB 1 66 VAL QG . . 3.860 2.577 2.471 2.804 . 0 0 "[ . 1]" 1
936 1 42 SER HB2 1 43 ALA H . . 4.680 4.350 3.497 4.574 . 0 0 "[ . 1]" 1
937 1 42 SER HB3 1 43 ALA H . . 4.680 3.748 3.520 4.458 . 0 0 "[ . 1]" 1
938 1 43 ALA H 1 43 ALA MB . . 2.880 2.219 2.197 2.240 . 0 0 "[ . 1]" 1
939 1 43 ALA H 1 44 ILE HG12 . . 4.630 4.248 4.139 4.359 . 0 0 "[ . 1]" 1
940 1 43 ALA HA 1 44 ILE H . . 3.260 2.143 2.141 2.147 . 0 0 "[ . 1]" 1
941 1 43 ALA HA 1 44 ILE HB . . 5.040 4.656 4.632 4.690 . 0 0 "[ . 1]" 1
942 1 43 ALA HA 1 44 ILE MD . . 4.900 4.534 4.459 4.604 . 0 0 "[ . 1]" 1
943 1 43 ALA MB 1 44 ILE H . . 3.730 3.215 3.152 3.290 . 0 0 "[ . 1]" 1
944 1 43 ALA MB 1 44 ILE HA . . 4.230 4.044 4.027 4.066 . 0 0 "[ . 1]" 1
945 1 43 ALA MB 1 44 ILE MD . . 4.440 4.078 4.026 4.114 . 0 0 "[ . 1]" 1
946 1 44 ILE H 1 44 ILE HB . . 3.590 2.824 2.787 2.834 . 0 0 "[ . 1]" 1
947 1 44 ILE H 1 44 ILE HG12 . . 4.340 3.019 2.979 3.054 . 0 0 "[ . 1]" 1
948 1 44 ILE H 1 44 ILE HG13 . . 5.500 4.340 4.298 4.367 . 0 0 "[ . 1]" 1
949 1 44 ILE H 1 44 ILE MG . . 4.570 3.915 3.900 3.920 . 0 0 "[ . 1]" 1
950 1 44 ILE H 1 49 PHE QE . . 5.080 4.273 4.098 4.394 . 0 0 "[ . 1]" 1
951 1 44 ILE HA 1 44 ILE MD . . 3.140 1.987 1.961 2.006 . 0 0 "[ . 1]" 1
952 1 44 ILE HA 1 44 ILE HG12 . . 3.300 3.043 3.021 3.066 . 0 0 "[ . 1]" 1
953 1 44 ILE HA 1 44 ILE MG . . 3.190 2.398 2.392 2.407 . 0 0 "[ . 1]" 1
954 1 44 ILE HA 1 45 PRO HD2 . . 3.600 2.112 2.109 2.116 . 0 0 "[ . 1]" 1
955 1 44 ILE HA 1 45 PRO QD . . 3.130 1.939 1.938 1.941 . 0 0 "[ . 1]" 1
956 1 44 ILE HA 1 45 PRO HD3 . . 3.600 2.258 2.257 2.259 . 0 0 "[ . 1]" 1
957 1 44 ILE HA 1 45 PRO HG3 . . 4.490 4.336 4.335 4.337 . 0 0 "[ . 1]" 1
958 1 44 ILE HB 1 49 PHE QD . . 4.540 4.165 4.071 4.250 . 0 0 "[ . 1]" 1
959 1 44 ILE HB 1 49 PHE QE . . 3.300 2.073 1.983 2.199 . 0 0 "[ . 1]" 1
960 1 44 ILE HB 1 49 PHE HZ . . 4.140 2.890 2.667 3.222 . 0 0 "[ . 1]" 1
961 1 44 ILE MD 1 44 ILE MG . . 3.050 1.949 1.929 1.997 . 0 0 "[ . 1]" 1
962 1 44 ILE MD 1 45 PRO QD . . 4.580 2.590 2.529 2.747 . 0 0 "[ . 1]" 1
963 1 44 ILE MD 1 48 GLN QE . . 4.100 3.719 2.962 4.074 . 0 0 "[ . 1]" 1
964 1 44 ILE MD 1 49 PHE QE . . 4.720 4.449 4.337 4.522 . 0 0 "[ . 1]" 1
965 1 44 ILE MD 1 49 PHE HZ . . 4.840 4.306 4.129 4.615 . 0 0 "[ . 1]" 1
966 1 44 ILE HG12 1 45 PRO QD . . 5.310 4.399 4.378 4.419 . 0 0 "[ . 1]" 1
967 1 44 ILE HG12 1 49 PHE QE . . 4.770 4.324 4.242 4.398 . 0 0 "[ . 1]" 1
968 1 44 ILE HG12 1 49 PHE HZ . . 5.290 4.156 3.895 4.580 . 0 0 "[ . 1]" 1
969 1 44 ILE HG12 1 66 VAL QG . . 3.800 3.203 2.962 3.439 . 0 0 "[ . 1]" 1
970 1 44 ILE HG13 1 66 VAL HA . . 4.440 4.328 4.089 4.441 0.001 2 0 "[ . 1]" 1
971 1 44 ILE HG13 1 66 VAL MG1 . . 4.560 2.515 2.086 2.815 . 0 0 "[ . 1]" 1
972 1 44 ILE HG13 1 66 VAL QG . . 3.610 2.383 2.033 2.643 . 0 0 "[ . 1]" 1
973 1 44 ILE HG13 1 66 VAL MG2 . . 4.560 2.994 2.750 3.264 . 0 0 "[ . 1]" 1
974 1 44 ILE MG 1 45 PRO HA . . 4.580 4.067 4.054 4.077 . 0 0 "[ . 1]" 1
975 1 44 ILE MG 1 45 PRO HD2 . . 3.660 1.895 1.885 1.900 . 0 0 "[ . 1]" 1
976 1 44 ILE MG 1 45 PRO QD . . 3.050 1.884 1.874 1.889 . 0 0 "[ . 1]" 1
977 1 44 ILE MG 1 45 PRO HD3 . . 3.660 3.273 3.261 3.278 . 0 0 "[ . 1]" 1
978 1 44 ILE MG 1 45 PRO HG3 . . 4.990 4.056 4.044 4.062 . 0 0 "[ . 1]" 1
979 1 44 ILE MG 1 48 GLN H . . 5.230 3.959 3.881 4.034 . 0 0 "[ . 1]" 1
980 1 44 ILE MG 1 48 GLN HA . . 5.210 5.147 5.058 5.231 0.021 9 0 "[ . 1]" 1
981 1 44 ILE MG 1 48 GLN QB . . 3.560 2.635 2.538 2.694 . 0 0 "[ . 1]" 1
982 1 44 ILE MG 1 48 GLN HE21 . . 4.720 3.551 2.197 4.597 . 0 0 "[ . 1]" 1
983 1 44 ILE MG 1 48 GLN HE22 . . 4.720 3.765 2.726 4.731 0.011 4 0 "[ . 1]" 1
984 1 44 ILE MG 1 49 PHE QD . . 3.800 3.338 3.111 3.474 . 0 0 "[ . 1]" 1
985 1 44 ILE MG 1 49 PHE QE . . 3.190 2.539 2.113 2.745 . 0 0 "[ . 1]" 1
986 1 44 ILE MG 1 49 PHE HZ . . 3.840 2.647 2.533 2.917 . 0 0 "[ . 1]" 1
987 1 44 ILE MG 1 64 VAL QG . . 4.700 4.599 4.419 4.720 0.020 8 0 "[ . 1]" 1
988 1 44 ILE MG 1 66 VAL QG . . 4.610 3.383 3.087 3.585 . 0 0 "[ . 1]" 1
989 1 45 PRO HA 1 46 ALA H . . 3.180 2.155 2.151 2.161 . 0 0 "[ . 1]" 1
990 1 45 PRO HA 1 46 ALA MB . . 4.090 3.981 3.930 4.018 . 0 0 "[ . 1]" 1
991 1 45 PRO HA 1 47 GLU H . . 4.540 3.694 3.663 3.744 . 0 0 "[ . 1]" 1
992 1 45 PRO HA 1 49 PHE QD . . 5.500 5.360 5.145 5.504 0.004 7 0 "[ . 1]" 1
993 1 45 PRO QB 1 47 GLU H . . 4.600 2.626 2.524 2.738 . 0 0 "[ . 1]" 1
994 1 45 PRO QB 1 47 GLU QB . . 3.890 2.624 2.519 2.710 . 0 0 "[ . 1]" 1
995 1 45 PRO QB 1 48 GLN H . . 4.470 3.137 3.060 3.265 . 0 0 "[ . 1]" 1
996 1 45 PRO QD 1 48 GLN QE . . 4.680 3.359 2.590 3.953 . 0 0 "[ . 1]" 1
997 1 45 PRO QD 1 48 GLN QG . . 5.180 4.174 2.899 4.686 . 0 0 "[ . 1]" 1
998 1 45 PRO HG2 1 48 GLN H . . 4.030 3.150 3.046 3.236 . 0 0 "[ . 1]" 1
999 1 45 PRO HG2 1 48 GLN QB . . 4.150 2.361 1.985 3.079 . 0 0 "[ . 1]" 1
1000 1 45 PRO HG2 1 48 GLN QE . . 5.340 3.331 2.224 4.091 . 0 0 "[ . 1]" 1
1001 1 45 PRO HG3 1 48 GLN H . . 5.040 4.735 4.642 4.831 . 0 0 "[ . 1]" 1
1002 1 46 ALA H 1 46 ALA MB . . 2.990 2.145 2.024 2.234 . 0 0 "[ . 1]" 1
1003 1 46 ALA H 1 47 GLU H . . 4.500 2.717 2.667 2.757 . 0 0 "[ . 1]" 1
1004 1 46 ALA HA 1 48 GLN H . . 4.870 3.678 3.620 3.743 . 0 0 "[ . 1]" 1
1005 1 46 ALA HA 1 49 PHE H . . 3.940 3.020 2.992 3.054 . 0 0 "[ . 1]" 1
1006 1 46 ALA HA 1 49 PHE HB2 . . 4.830 2.626 2.515 2.718 . 0 0 "[ . 1]" 1
1007 1 46 ALA HA 1 49 PHE QD . . 3.120 2.165 1.980 2.377 . 0 0 "[ . 1]" 1
1008 1 46 ALA HA 1 49 PHE QE . . 4.380 4.182 4.027 4.366 . 0 0 "[ . 1]" 1
1009 1 46 ALA HA 1 50 LYS H . . 4.610 3.893 3.829 4.005 . 0 0 "[ . 1]" 1
1010 1 46 ALA HA 1 50 LYS HG2 . . 5.250 4.881 4.808 4.964 . 0 0 "[ . 1]" 1
1011 1 46 ALA HA 1 56 LEU MD1 . . 4.590 3.260 2.380 3.623 . 0 0 "[ . 1]" 1
1012 1 46 ALA HA 1 56 LEU QD . . 3.640 2.593 2.354 2.925 . 0 0 "[ . 1]" 1
1013 1 46 ALA HA 1 56 LEU MD2 . . 4.590 2.959 2.529 3.856 . 0 0 "[ . 1]" 1
1014 1 46 ALA HA 1 58 ILE MD . . 5.500 4.702 4.558 5.043 . 0 0 "[ . 1]" 1
1015 1 46 ALA MB 1 47 GLU H . . 3.570 2.883 2.772 2.993 . 0 0 "[ . 1]" 1
1016 1 46 ALA MB 1 48 GLN H . . 5.110 4.353 4.309 4.414 . 0 0 "[ . 1]" 1
1017 1 46 ALA MB 1 49 PHE QD . . 4.230 3.578 3.519 3.639 . 0 0 "[ . 1]" 1
1018 1 46 ALA MB 1 50 LYS H . . 5.000 3.955 3.846 4.047 . 0 0 "[ . 1]" 1
1019 1 46 ALA MB 1 50 LYS HD2 . . 5.090 4.640 4.511 4.802 . 0 0 "[ . 1]" 1
1020 1 46 ALA MB 1 50 LYS HE2 . . 4.160 3.274 2.353 4.131 . 0 0 "[ . 1]" 1
1021 1 46 ALA MB 1 50 LYS HE3 . . 4.160 2.661 2.243 3.965 . 0 0 "[ . 1]" 1
1022 1 46 ALA MB 1 50 LYS HG2 . . 4.690 4.105 4.024 4.226 . 0 0 "[ . 1]" 1
1023 1 46 ALA MB 1 56 LEU MD1 . . 3.420 1.909 1.809 2.019 . 0 0 "[ . 1]" 1
1024 1 46 ALA MB 1 56 LEU MD2 . . 3.420 2.515 2.325 2.742 . 0 0 "[ . 1]" 1
1025 1 46 ALA MB 1 56 LEU HG . . 4.280 2.756 2.238 4.149 . 0 0 "[ . 1]" 1
1026 1 47 GLU H 1 47 GLU HB2 . . 3.680 2.442 2.222 2.605 . 0 0 "[ . 1]" 1
1027 1 47 GLU H 1 47 GLU HB3 . . 3.680 2.997 2.442 3.591 . 0 0 "[ . 1]" 1
1028 1 47 GLU H 1 47 GLU QG . . 4.470 3.380 2.247 4.013 . 0 0 "[ . 1]" 1
1029 1 47 GLU H 1 48 GLN H . . 4.150 2.677 2.638 2.717 . 0 0 "[ . 1]" 1
1030 1 47 GLU H 1 50 LYS HG2 . . 4.690 4.209 4.115 4.268 . 0 0 "[ . 1]" 1
1031 1 47 GLU HA 1 47 GLU QG . . 3.690 2.390 2.246 2.570 . 0 0 "[ . 1]" 1
1032 1 47 GLU HA 1 49 PHE H . . 4.760 4.333 4.173 4.391 . 0 0 "[ . 1]" 1
1033 1 47 GLU HA 1 50 LYS H . . 4.180 3.666 3.627 3.686 . 0 0 "[ . 1]" 1
1034 1 47 GLU HA 1 50 LYS HB2 . . 5.500 4.675 4.652 4.692 . 0 0 "[ . 1]" 1
1035 1 47 GLU HA 1 50 LYS HB3 . . 3.950 3.974 3.886 4.018 0.068 5 0 "[ . 1]" 1
1036 1 47 GLU HA 1 50 LYS HD2 . . 3.020 2.141 2.122 2.168 . 0 0 "[ . 1]" 1
1037 1 47 GLU HA 1 50 LYS QE . . 3.750 2.489 2.209 3.354 . 0 0 "[ . 1]" 1
1038 1 47 GLU HA 1 50 LYS HG2 . . 3.630 1.969 1.919 1.984 . 0 0 "[ . 1]" 1
1039 1 47 GLU HA 1 50 LYS HG3 . . 4.220 3.156 3.099 3.244 . 0 0 "[ . 1]" 1
1040 1 47 GLU QB 1 48 GLN H . . 4.140 2.920 2.875 2.968 . 0 0 "[ . 1]" 1
1041 1 47 GLU QB 1 48 GLN HA . . 4.840 4.121 3.984 4.340 . 0 0 "[ . 1]" 1
1042 1 47 GLU QB 1 50 LYS HD2 . . 4.520 3.678 3.531 3.861 . 0 0 "[ . 1]" 1
1043 1 47 GLU QB 1 50 LYS QE . . 5.160 4.075 3.715 4.359 . 0 0 "[ . 1]" 1
1044 1 47 GLU HB2 1 50 LYS HG2 . . 4.960 4.576 4.350 4.791 . 0 0 "[ . 1]" 1
1045 1 47 GLU HB3 1 50 LYS HG2 . . 4.960 4.477 4.104 4.754 . 0 0 "[ . 1]" 1
1046 1 47 GLU QG 1 48 GLN H . . 4.550 4.216 3.755 4.547 . 0 0 "[ . 1]" 1
1047 1 47 GLU QG 1 50 LYS HD2 . . 4.340 2.847 2.513 3.329 . 0 0 "[ . 1]" 1
1048 1 48 GLN H 1 48 GLN QB . . 3.290 2.260 2.193 2.375 . 0 0 "[ . 1]" 1
1049 1 48 GLN H 1 48 GLN QG . . 4.540 3.537 2.490 4.052 . 0 0 "[ . 1]" 1
1050 1 48 GLN H 1 49 PHE H . . 3.940 2.346 2.321 2.354 . 0 0 "[ . 1]" 1
1051 1 48 GLN H 1 50 LYS HD2 . . 5.500 5.549 5.525 5.566 0.066 8 0 "[ . 1]" 1
1052 1 48 GLN H 1 50 LYS HG2 . . 4.450 4.060 4.043 4.090 . 0 0 "[ . 1]" 1
1053 1 48 GLN HA 1 48 GLN QG . . 3.600 2.293 2.191 2.433 . 0 0 "[ . 1]" 1
1054 1 48 GLN HA 1 50 LYS H . . 4.820 4.570 4.555 4.595 . 0 0 "[ . 1]" 1
1055 1 48 GLN HA 1 50 LYS HG2 . . 5.060 4.645 4.562 4.709 . 0 0 "[ . 1]" 1
1056 1 48 GLN QB 1 49 PHE QD . . 4.160 3.999 3.682 4.166 0.006 9 0 "[ . 1]" 1
1057 1 48 GLN QB 1 49 PHE HZ . . 5.340 5.347 5.241 5.401 0.061 9 0 "[ . 1]" 1
1058 1 48 GLN QG 1 49 PHE QD . . 5.340 5.287 4.936 5.401 0.061 6 0 "[ . 1]" 1
1059 1 49 PHE H 1 49 PHE HB2 . . 3.880 2.347 2.330 2.380 . 0 0 "[ . 1]" 1
1060 1 49 PHE H 1 49 PHE QD . . 3.670 3.131 2.704 3.399 . 0 0 "[ . 1]" 1
1061 1 49 PHE H 1 50 LYS H . . 3.350 2.456 2.384 2.470 . 0 0 "[ . 1]" 1
1062 1 49 PHE H 1 50 LYS HG2 . . 4.510 3.827 3.656 3.890 . 0 0 "[ . 1]" 1
1063 1 49 PHE HA 1 49 PHE QD . . 3.230 2.246 2.007 2.653 . 0 0 "[ . 1]" 1
1064 1 49 PHE HA 1 58 ILE MG . . 4.800 4.124 3.713 4.386 . 0 0 "[ . 1]" 1
1065 1 49 PHE HB2 1 50 LYS H . . 4.000 2.681 2.663 2.690 . 0 0 "[ . 1]" 1
1066 1 49 PHE HB2 1 50 LYS HA . . 5.500 4.451 4.410 4.471 . 0 0 "[ . 1]" 1
1067 1 49 PHE HB2 1 56 LEU MD1 . . 4.270 3.607 1.908 4.127 . 0 0 "[ . 1]" 1
1068 1 49 PHE HB2 1 56 LEU QD . . 3.640 1.992 1.873 2.167 . 0 0 "[ . 1]" 1
1069 1 49 PHE HB2 1 56 LEU MD2 . . 4.270 2.360 1.877 4.023 . 0 0 "[ . 1]" 1
1070 1 49 PHE HB2 1 56 LEU HG . . 4.620 3.813 3.586 3.994 . 0 0 "[ . 1]" 1
1071 1 49 PHE HB2 1 58 ILE MD . . 4.420 3.639 3.457 3.999 . 0 0 "[ . 1]" 1
1072 1 49 PHE HB2 1 58 ILE HG13 . . 5.030 3.570 3.396 3.829 . 0 0 "[ . 1]" 1
1073 1 49 PHE HB3 1 50 LYS H . . 4.100 3.553 3.523 3.592 . 0 0 "[ . 1]" 1
1074 1 49 PHE HB3 1 50 LYS HA . . 4.710 4.294 4.264 4.337 . 0 0 "[ . 1]" 1
1075 1 49 PHE HB3 1 56 LEU HA . . 5.390 4.588 4.406 4.838 . 0 0 "[ . 1]" 1
1076 1 49 PHE HB3 1 56 LEU QD . . 3.780 2.375 2.191 2.718 . 0 0 "[ . 1]" 1
1077 1 49 PHE HB3 1 56 LEU HG . . 5.360 4.463 3.368 4.855 . 0 0 "[ . 1]" 1
1078 1 49 PHE HB3 1 58 ILE H . . 5.500 3.686 3.482 3.862 . 0 0 "[ . 1]" 1
1079 1 49 PHE HB3 1 58 ILE HB . . 4.620 4.586 4.506 4.634 0.014 3 0 "[ . 1]" 1
1080 1 49 PHE HB3 1 58 ILE MD . . 4.270 3.105 2.824 3.472 . 0 0 "[ . 1]" 1
1081 1 49 PHE HB3 1 58 ILE HG13 . . 5.500 2.477 2.332 2.885 . 0 0 "[ . 1]" 1
1082 1 49 PHE HB3 1 58 ILE MG . . 4.220 3.096 2.671 3.429 . 0 0 "[ . 1]" 1
1083 1 49 PHE HB3 1 64 VAL MG1 . . 5.500 3.960 3.705 4.429 . 0 0 "[ . 1]" 1
1084 1 49 PHE HB3 1 64 VAL MG2 . . 5.500 5.268 5.116 5.418 . 0 0 "[ . 1]" 1
1085 1 49 PHE QD 1 56 LEU MD1 . . 4.240 4.031 3.198 4.299 0.059 6 0 "[ . 1]" 1
1086 1 49 PHE QD 1 56 LEU MD2 . . 4.240 3.183 2.708 4.249 0.009 8 0 "[ . 1]" 1
1087 1 49 PHE QD 1 56 LEU HG . . 5.500 5.073 4.900 5.241 . 0 0 "[ . 1]" 1
1088 1 49 PHE QD 1 58 ILE HB . . 5.500 5.147 4.451 5.451 . 0 0 "[ . 1]" 1
1089 1 49 PHE QD 1 58 ILE MD . . 3.710 3.297 3.154 3.497 . 0 0 "[ . 1]" 1
1090 1 49 PHE QD 1 58 ILE HG12 . . 4.460 3.062 2.513 3.446 . 0 0 "[ . 1]" 1
1091 1 49 PHE QD 1 58 ILE MG . . 4.290 3.408 2.773 3.967 . 0 0 "[ . 1]" 1
1092 1 49 PHE QD 1 64 VAL HB . . 4.920 3.315 2.963 3.573 . 0 0 "[ . 1]" 1
1093 1 49 PHE QD 1 64 VAL MG1 . . 4.120 3.281 2.473 3.744 . 0 0 "[ . 1]" 1
1094 1 49 PHE QD 1 64 VAL QG . . 3.560 3.100 2.430 3.464 . 0 0 "[ . 1]" 1
1095 1 49 PHE QD 1 64 VAL MG2 . . 4.120 3.891 3.561 4.118 . 0 0 "[ . 1]" 1
1096 1 49 PHE QD 1 66 VAL QG . . 5.160 4.886 4.799 4.930 . 0 0 "[ . 1]" 1
1097 1 49 PHE QE 1 58 ILE MD . . 4.200 3.986 3.864 4.199 . 0 0 "[ . 1]" 1
1098 1 49 PHE QE 1 64 VAL HB . . 4.060 2.511 1.996 3.113 . 0 0 "[ . 1]" 1
1099 1 49 PHE QE 1 64 VAL MG1 . . 4.830 3.476 2.898 3.979 . 0 0 "[ . 1]" 1
1100 1 49 PHE QE 1 64 VAL QG . . 3.410 2.546 2.096 2.909 . 0 0 "[ . 1]" 1
1101 1 49 PHE QE 1 64 VAL MG2 . . 4.830 2.623 2.125 3.009 . 0 0 "[ . 1]" 1
1102 1 49 PHE QE 1 66 VAL HA . . 5.060 4.133 3.592 4.559 . 0 0 "[ . 1]" 1
1103 1 49 PHE QE 1 66 VAL QG . . 3.120 3.106 2.993 3.125 0.005 8 0 "[ . 1]" 1
1104 1 49 PHE HZ 1 58 ILE MD . . 5.280 4.901 4.686 5.284 0.004 1 0 "[ . 1]" 1
1105 1 49 PHE HZ 1 64 VAL HB . . 4.880 4.369 3.908 4.882 0.002 3 0 "[ . 1]" 1
1106 1 49 PHE HZ 1 64 VAL QG . . 4.080 2.967 2.768 3.203 . 0 0 "[ . 1]" 1
1107 1 49 PHE HZ 1 66 VAL QG . . 3.510 2.780 2.493 2.919 . 0 0 "[ . 1]" 1
1108 1 50 LYS H 1 50 LYS HB2 . . 4.110 3.594 3.590 3.599 . 0 0 "[ . 1]" 1
1109 1 50 LYS H 1 50 LYS HB3 . . 3.430 2.515 2.486 2.562 . 0 0 "[ . 1]" 1
1110 1 50 LYS H 1 50 LYS HG2 . . 3.370 2.173 2.123 2.217 . 0 0 "[ . 1]" 1
1111 1 50 LYS H 1 50 LYS HG3 . . 4.290 3.385 3.186 3.460 . 0 0 "[ . 1]" 1
1112 1 50 LYS H 1 51 ASN H . . 4.660 4.549 4.518 4.589 . 0 0 "[ . 1]" 1
1113 1 50 LYS H 1 56 LEU MD1 . . 5.060 4.248 2.261 4.856 . 0 0 "[ . 1]" 1
1114 1 50 LYS H 1 56 LEU QD . . 3.530 2.760 2.257 2.928 . 0 0 "[ . 1]" 1
1115 1 50 LYS H 1 56 LEU MD2 . . 5.060 3.306 2.787 4.988 . 0 0 "[ . 1]" 1
1116 1 50 LYS H 1 56 LEU HG . . 4.670 3.769 3.378 4.685 0.015 1 0 "[ . 1]" 1
1117 1 50 LYS H 1 58 ILE HG13 . . 5.500 5.119 5.011 5.341 . 0 0 "[ . 1]" 1
1118 1 50 LYS HA 1 50 LYS HD3 . . 4.840 4.790 4.784 4.826 . 0 0 "[ . 1]" 1
1119 1 50 LYS HA 1 50 LYS HG2 . . 4.110 3.764 3.742 3.786 . 0 0 "[ . 1]" 1
1120 1 50 LYS HA 1 50 LYS HG3 . . 4.040 3.737 3.721 3.760 . 0 0 "[ . 1]" 1
1121 1 50 LYS HA 1 51 ASN H . . 3.240 2.602 2.503 2.672 . 0 0 "[ . 1]" 1
1122 1 50 LYS HA 1 56 LEU HA . . 3.340 2.125 1.994 2.298 . 0 0 "[ . 1]" 1
1123 1 50 LYS HA 1 56 LEU QD . . 3.990 3.051 2.829 3.295 . 0 0 "[ . 1]" 1
1124 1 50 LYS HA 1 58 ILE MG . . 5.500 4.863 4.467 5.087 . 0 0 "[ . 1]" 1
1125 1 50 LYS HB2 1 50 LYS HE2 . . 4.850 3.190 2.899 4.010 . 0 0 "[ . 1]" 1
1126 1 50 LYS HB2 1 50 LYS QE . . 4.270 2.912 2.589 3.266 . 0 0 "[ . 1]" 1
1127 1 50 LYS HB2 1 50 LYS HE3 . . 4.850 3.616 2.622 4.380 . 0 0 "[ . 1]" 1
1128 1 50 LYS HB2 1 51 ASN H . . 3.880 2.111 2.009 2.274 . 0 0 "[ . 1]" 1
1129 1 50 LYS HB2 1 54 GLY HA2 . . 4.330 3.750 3.378 3.924 . 0 0 "[ . 1]" 1
1130 1 50 LYS HB2 1 55 GLU HA . . 4.390 3.831 3.682 4.031 . 0 0 "[ . 1]" 1
1131 1 50 LYS HB2 1 56 LEU HA . . 3.390 2.697 2.606 2.809 . 0 0 "[ . 1]" 1
1132 1 50 LYS HB2 1 57 GLU H . . 4.450 3.734 3.642 3.794 . 0 0 "[ . 1]" 1
1133 1 50 LYS HB3 1 50 LYS HE2 . . 4.800 2.430 2.052 3.634 . 0 0 "[ . 1]" 1
1134 1 50 LYS HB3 1 50 LYS HE3 . . 4.800 2.514 2.142 3.624 . 0 0 "[ . 1]" 1
1135 1 50 LYS HB3 1 51 ASN H . . 4.010 3.618 3.552 3.725 . 0 0 "[ . 1]" 1
1136 1 50 LYS HB3 1 56 LEU HA . . 3.670 2.070 1.983 2.127 . 0 0 "[ . 1]" 1
1137 1 50 LYS HB3 1 56 LEU MD1 . . 4.420 3.524 1.936 4.066 . 0 0 "[ . 1]" 1
1138 1 50 LYS HB3 1 56 LEU QD . . 3.600 2.739 1.933 2.984 . 0 0 "[ . 1]" 1
1139 1 50 LYS HB3 1 56 LEU MD2 . . 4.420 3.301 2.917 4.401 . 0 0 "[ . 1]" 1
1140 1 50 LYS HB3 1 56 LEU HG . . 4.200 2.653 2.149 4.235 0.035 8 0 "[ . 1]" 1
1141 1 50 LYS HD3 1 51 ASN H . . 4.750 4.044 3.802 4.396 . 0 0 "[ . 1]" 1
1142 1 50 LYS HD3 1 54 GLY H . . 4.290 3.720 3.455 3.922 . 0 0 "[ . 1]" 1
1143 1 50 LYS HD3 1 54 GLY HA2 . . 4.080 2.068 1.975 2.260 . 0 0 "[ . 1]" 1
1144 1 50 LYS HD3 1 54 GLY HA3 . . 4.070 3.540 3.280 3.836 . 0 0 "[ . 1]" 1
1145 1 50 LYS HD3 1 55 GLU H . . 4.000 3.631 3.205 4.008 0.008 9 0 "[ . 1]" 1
1146 1 50 LYS HD3 1 55 GLU HA . . 4.590 4.150 3.999 4.402 . 0 0 "[ . 1]" 1
1147 1 50 LYS QE 1 50 LYS HG2 . . 3.570 2.397 2.289 3.065 . 0 0 "[ . 1]" 1
1148 1 50 LYS QE 1 50 LYS HG3 . . 3.650 3.329 3.304 3.502 . 0 0 "[ . 1]" 1
1149 1 50 LYS QE 1 56 LEU QD . . 3.880 2.936 2.364 3.417 . 0 0 "[ . 1]" 1
1150 1 50 LYS QE 1 56 LEU HG . . 5.170 3.039 2.365 5.027 . 0 0 "[ . 1]" 1
1151 1 50 LYS HE2 1 50 LYS HG3 . . 4.150 3.879 3.532 4.240 0.090 9 0 "[ . 1]" 1
1152 1 50 LYS HE3 1 50 LYS HG3 . . 4.150 3.655 3.546 4.133 . 0 0 "[ . 1]" 1
1153 1 50 LYS HG2 1 51 ASN H . . 4.760 4.239 4.131 4.374 . 0 0 "[ . 1]" 1
1154 1 50 LYS HG2 1 54 GLY HA2 . . 5.330 4.710 4.376 4.974 . 0 0 "[ . 1]" 1
1155 1 50 LYS HG2 1 56 LEU QD . . 4.080 3.976 3.402 4.151 0.071 6 0 "[ . 1]" 1
1156 1 50 LYS HG3 1 51 ASN H . . 4.260 3.064 2.898 3.276 . 0 0 "[ . 1]" 1
1157 1 50 LYS HG3 1 51 ASN HA . . 5.010 3.975 3.926 4.061 . 0 0 "[ . 1]" 1
1158 1 50 LYS HG3 1 54 GLY H . . 5.450 3.973 3.835 4.222 . 0 0 "[ . 1]" 1
1159 1 50 LYS HG3 1 54 GLY HA2 . . 4.220 3.504 3.039 3.840 . 0 0 "[ . 1]" 1
1160 1 50 LYS HG3 1 54 GLY HA3 . . 5.500 5.231 4.787 5.538 0.038 9 0 "[ . 1]" 1
1161 1 50 LYS HG3 1 56 LEU HA . . 4.720 4.710 4.685 4.751 0.031 2 0 "[ . 1]" 1
1162 1 50 LYS HG3 1 57 GLU H . . 5.500 5.564 5.529 5.598 0.098 8 0 "[ . 1]" 1
1163 1 51 ASN H 1 51 ASN HB2 . . 4.000 3.585 3.450 3.744 . 0 0 "[ . 1]" 1
1164 1 51 ASN H 1 51 ASN HB3 . . 4.000 3.244 2.857 3.460 . 0 0 "[ . 1]" 1
1165 1 51 ASN H 1 55 GLU H . . 3.790 3.144 2.634 3.801 0.011 3 0 "[ . 1]" 1
1166 1 51 ASN H 1 56 LEU QD . . 5.240 5.033 4.640 5.257 0.017 5 0 "[ . 1]" 1
1167 1 51 ASN H 1 57 GLU QB . . 4.830 4.222 3.865 4.713 . 0 0 "[ . 1]" 1
1168 1 51 ASN H 1 57 GLU QG . . 5.100 4.207 3.259 5.097 . 0 0 "[ . 1]" 1
1169 1 51 ASN HA 1 52 ALA H . . 3.490 2.631 2.596 2.732 . 0 0 "[ . 1]" 1
1170 1 51 ASN HA 1 52 ALA HA . . 4.450 4.316 4.310 4.331 . 0 0 "[ . 1]" 1
1171 1 51 ASN HA 1 53 GLN H . . 4.420 4.228 4.164 4.358 . 0 0 "[ . 1]" 1
1172 1 51 ASN QB 1 52 ALA H . . 3.190 2.020 1.969 2.056 . 0 0 "[ . 1]" 1
1173 1 51 ASN QB 1 52 ALA MB . . 4.340 3.515 3.395 3.592 . 0 0 "[ . 1]" 1
1174 1 51 ASN QB 1 53 GLN H . . 4.070 2.591 2.336 3.272 . 0 0 "[ . 1]" 1
1175 1 51 ASN HB2 1 52 ALA H . . 3.810 2.040 1.979 2.090 . 0 0 "[ . 1]" 1
1176 1 51 ASN HB3 1 52 ALA H . . 3.810 3.279 3.046 3.525 . 0 0 "[ . 1]" 1
1177 1 51 ASN QD 1 53 GLN HA . . 5.340 4.136 3.829 4.687 . 0 0 "[ . 1]" 1
1178 1 51 ASN QD 1 53 GLN QB . . 4.280 2.042 1.925 2.149 . 0 0 "[ . 1]" 1
1179 1 51 ASN QD 1 53 GLN QG . . 4.760 3.391 2.520 3.948 . 0 0 "[ . 1]" 1
1180 1 51 ASN QD 1 54 GLY HA2 . . 5.340 4.142 3.725 5.085 . 0 0 "[ . 1]" 1
1181 1 51 ASN QD 1 55 GLU H . . 3.960 2.227 1.809 2.954 . 0 0 "[ . 1]" 1
1182 1 51 ASN QD 1 55 GLU QB . . 3.850 2.550 1.996 3.668 . 0 0 "[ . 1]" 1
1183 1 51 ASN QD 1 55 GLU QG . . 4.410 3.330 1.834 4.160 . 0 0 "[ . 1]" 1
1184 1 51 ASN HD21 1 55 GLU HA . . 5.500 5.172 4.937 5.499 . 0 0 "[ . 1]" 1
1185 1 51 ASN HD22 1 55 GLU HA . . 5.500 4.487 4.063 5.277 . 0 0 "[ . 1]" 1
1186 1 52 ALA H 1 52 ALA MB . . 3.270 2.142 2.039 2.235 . 0 0 "[ . 1]" 1
1187 1 52 ALA H 1 53 GLN H . . 3.650 2.659 2.610 2.711 . 0 0 "[ . 1]" 1
1188 1 52 ALA MB 1 53 GLN H . . 3.620 2.937 2.808 3.050 . 0 0 "[ . 1]" 1
1189 1 52 ALA MB 1 53 GLN HA . . 4.320 3.850 3.810 3.905 . 0 0 "[ . 1]" 1
1190 1 52 ALA MB 1 53 GLN QB . . 5.340 4.497 4.273 4.721 . 0 0 "[ . 1]" 1
1191 1 52 ALA MB 1 53 GLN HE21 . . 4.240 3.439 2.475 4.221 . 0 0 "[ . 1]" 1
1192 1 52 ALA MB 1 53 GLN QE . . 3.720 2.870 2.414 3.586 . 0 0 "[ . 1]" 1
1193 1 52 ALA MB 1 53 GLN HE22 . . 4.240 3.224 2.583 3.934 . 0 0 "[ . 1]" 1
1194 1 52 ALA MB 1 53 GLN QG . . 4.620 4.189 3.671 4.636 0.016 8 0 "[ . 1]" 1
1195 1 52 ALA MB 1 54 GLY H . . 4.730 4.416 4.236 4.507 . 0 0 "[ . 1]" 1
1196 1 53 GLN H 1 53 GLN QB . . 3.000 2.360 2.078 2.648 . 0 0 "[ . 1]" 1
1197 1 53 GLN H 1 53 GLN HG2 . . 4.380 3.380 1.961 4.387 0.007 1 0 "[ . 1]" 1
1198 1 53 GLN H 1 53 GLN QG . . 3.780 2.951 1.951 3.684 . 0 0 "[ . 1]" 1
1199 1 53 GLN H 1 53 GLN HG3 . . 4.380 3.663 2.852 4.072 . 0 0 "[ . 1]" 1
1200 1 53 GLN H 1 54 GLY H . . 2.960 2.552 2.541 2.588 . 0 0 "[ . 1]" 1
1201 1 53 GLN H 1 54 GLY HA2 . . 5.030 4.877 4.863 4.897 . 0 0 "[ . 1]" 1
1202 1 53 GLN H 1 54 GLY HA3 . . 5.340 5.198 5.186 5.225 . 0 0 "[ . 1]" 1
1203 1 53 GLN H 1 55 GLU H . . 4.150 4.045 3.920 4.150 . 0 0 "[ . 1]" 1
1204 1 53 GLN HA 1 53 GLN HG2 . . 3.810 3.528 3.392 3.662 . 0 0 "[ . 1]" 1
1205 1 53 GLN HA 1 53 GLN QG . . 3.330 2.620 2.115 3.185 . 0 0 "[ . 1]" 1
1206 1 53 GLN HA 1 53 GLN HG3 . . 3.810 2.834 2.134 3.805 . 0 0 "[ . 1]" 1
1207 1 53 GLN QB 1 54 GLY H . . 3.730 2.990 2.866 3.178 . 0 0 "[ . 1]" 1
1208 1 53 GLN QB 1 54 GLY HA2 . . 5.340 4.741 4.689 4.818 . 0 0 "[ . 1]" 1
1209 1 53 GLN QB 1 55 GLU H . . 3.660 2.924 2.385 3.376 . 0 0 "[ . 1]" 1
1210 1 53 GLN QG 1 55 GLU H . . 5.340 4.816 4.166 5.353 0.013 8 0 "[ . 1]" 1
1211 1 54 GLY H 1 55 GLU H . . 3.090 2.396 2.228 2.604 . 0 0 "[ . 1]" 1
1212 1 54 GLY H 1 55 GLU QG . . 5.010 4.413 3.789 4.813 . 0 0 "[ . 1]" 1
1213 1 54 GLY HA3 1 55 GLU QG . . 5.340 4.207 3.848 4.915 . 0 0 "[ . 1]" 1
1214 1 55 GLU H 1 55 GLU QB . . 3.130 2.570 2.396 2.703 . 0 0 "[ . 1]" 1
1215 1 55 GLU H 1 55 GLU HG2 . . 4.340 3.526 1.950 4.326 . 0 0 "[ . 1]" 1
1216 1 55 GLU H 1 55 GLU QG . . 3.620 2.855 1.936 3.528 . 0 0 "[ . 1]" 1
1217 1 55 GLU H 1 55 GLU HG3 . . 4.340 3.260 2.706 4.276 . 0 0 "[ . 1]" 1
1218 1 55 GLU H 1 56 LEU H . . 4.670 4.317 4.107 4.541 . 0 0 "[ . 1]" 1
1219 1 55 GLU HA 1 55 GLU HG2 . . 3.830 2.663 2.307 3.782 . 0 0 "[ . 1]" 1
1220 1 55 GLU HA 1 55 GLU QG . . 3.350 2.527 2.277 3.339 . 0 0 "[ . 1]" 1
1221 1 55 GLU HA 1 55 GLU HG3 . . 3.830 3.322 2.878 3.823 . 0 0 "[ . 1]" 1
1222 1 55 GLU HA 1 56 LEU H . . 2.880 2.153 2.139 2.199 . 0 0 "[ . 1]" 1
1223 1 55 GLU HA 1 56 LEU HB2 . . 4.810 4.189 4.163 4.232 . 0 0 "[ . 1]" 1
1224 1 55 GLU QB 1 56 LEU H . . 3.760 3.255 2.951 3.436 . 0 0 "[ . 1]" 1
1225 1 55 GLU QB 1 56 LEU HB2 . . 5.340 4.876 4.641 5.193 . 0 0 "[ . 1]" 1
1226 1 55 GLU QG 1 56 LEU H . . 4.220 4.078 3.935 4.211 . 0 0 "[ . 1]" 1
1227 1 56 LEU H 1 56 LEU HB2 . . 3.040 2.086 2.060 2.142 . 0 0 "[ . 1]" 1
1228 1 56 LEU H 1 56 LEU QD . . 4.350 3.429 3.258 3.505 . 0 0 "[ . 1]" 1
1229 1 56 LEU HA 1 56 LEU MD1 . . 4.030 3.427 2.124 3.763 . 0 0 "[ . 1]" 1
1230 1 56 LEU HA 1 56 LEU QD . . 2.840 2.308 2.114 2.513 . 0 0 "[ . 1]" 1
1231 1 56 LEU HA 1 56 LEU MD2 . . 4.030 2.665 2.277 3.805 . 0 0 "[ . 1]" 1
1232 1 56 LEU HA 1 56 LEU HG . . 3.880 2.496 2.369 2.817 . 0 0 "[ . 1]" 1
1233 1 56 LEU HA 1 57 GLU H . . 2.930 2.150 2.140 2.163 . 0 0 "[ . 1]" 1
1234 1 56 LEU HA 1 58 ILE H . . 4.110 3.450 3.374 3.583 . 0 0 "[ . 1]" 1
1235 1 56 LEU HA 1 58 ILE MD . . 5.500 5.147 4.957 5.465 . 0 0 "[ . 1]" 1
1236 1 56 LEU HA 1 58 ILE HG13 . . 4.580 4.209 4.078 4.374 . 0 0 "[ . 1]" 1
1237 1 56 LEU HB2 1 56 LEU MD1 . . 3.530 2.216 2.117 2.284 . 0 0 "[ . 1]" 1
1238 1 56 LEU HB2 1 56 LEU MD2 . . 3.530 3.002 2.312 3.176 . 0 0 "[ . 1]" 1
1239 1 56 LEU HB2 1 58 ILE HG13 . . 5.440 5.086 4.952 5.326 . 0 0 "[ . 1]" 1
1240 1 56 LEU HB3 1 57 GLU H . . 4.890 3.861 3.685 4.097 . 0 0 "[ . 1]" 1
1241 1 56 LEU HB3 1 58 ILE H . . 4.110 3.283 3.029 4.117 0.007 1 0 "[ . 1]" 1
1242 1 56 LEU QD 1 57 GLU H . . 4.510 3.174 2.981 3.306 . 0 0 "[ . 1]" 1
1243 1 56 LEU QD 1 58 ILE H . . 4.020 2.747 2.447 3.381 . 0 0 "[ . 1]" 1
1244 1 56 LEU QD 1 58 ILE MD . . 3.290 2.098 1.914 2.636 . 0 0 "[ . 1]" 1
1245 1 56 LEU QD 1 58 ILE HG12 . . 3.890 3.057 2.885 3.440 . 0 0 "[ . 1]" 1
1246 1 56 LEU QD 1 58 ILE MG . . 3.820 3.739 3.676 3.867 0.047 8 0 "[ . 1]" 1
1247 1 56 LEU MD1 1 58 ILE MD . . 4.120 3.404 3.213 3.622 . 0 0 "[ . 1]" 1
1248 1 56 LEU MD2 1 58 ILE MD . . 4.120 2.121 1.929 2.707 . 0 0 "[ . 1]" 1
1249 1 56 LEU HG 1 58 ILE H . . 4.740 4.357 2.570 4.811 0.071 2 0 "[ . 1]" 1
1250 1 56 LEU HG 1 58 ILE HG13 . . 5.380 4.065 1.985 4.690 . 0 0 "[ . 1]" 1
1251 1 57 GLU H 1 57 GLU QB . . 3.600 2.387 2.076 2.676 . 0 0 "[ . 1]" 1
1252 1 57 GLU H 1 57 GLU HG2 . . 4.200 2.697 2.045 3.901 . 0 0 "[ . 1]" 1
1253 1 57 GLU H 1 57 GLU HG3 . . 4.200 3.383 2.584 4.204 0.004 10 0 "[ . 1]" 1
1254 1 57 GLU H 1 58 ILE H . . 3.750 2.499 2.401 2.557 . 0 0 "[ . 1]" 1
1255 1 57 GLU H 1 58 ILE HA . . 5.180 5.160 5.085 5.204 0.024 5 0 "[ . 1]" 1
1256 1 57 GLU H 1 58 ILE HG12 . . 5.160 5.134 5.045 5.168 0.008 6 0 "[ . 1]" 1
1257 1 57 GLU H 1 58 ILE HG13 . . 5.210 3.994 3.897 4.169 . 0 0 "[ . 1]" 1
1258 1 57 GLU H 1 58 ILE MG . . 4.740 3.996 3.780 4.145 . 0 0 "[ . 1]" 1
1259 1 57 GLU HA 1 57 GLU HG2 . . 3.990 3.129 2.126 3.874 . 0 0 "[ . 1]" 1
1260 1 57 GLU HA 1 57 GLU HG3 . . 3.990 3.626 3.137 3.887 . 0 0 "[ . 1]" 1
1261 1 57 GLU HA 1 58 ILE MG . . 5.150 4.531 4.447 4.712 . 0 0 "[ . 1]" 1
1262 1 57 GLU QB 1 58 ILE H . . 4.360 3.410 3.060 3.675 . 0 0 "[ . 1]" 1
1263 1 57 GLU QG 1 58 ILE MG . . 5.340 3.051 1.882 4.724 . 0 0 "[ . 1]" 1
1264 1 58 ILE H 1 58 ILE MD . . 4.240 3.542 3.423 3.752 . 0 0 "[ . 1]" 1
1265 1 58 ILE H 1 58 ILE HG12 . . 3.890 3.355 3.271 3.405 . 0 0 "[ . 1]" 1
1266 1 58 ILE H 1 58 ILE HG13 . . 4.640 2.016 1.934 2.200 . 0 0 "[ . 1]" 1
1267 1 58 ILE H 1 58 ILE MG . . 3.430 2.603 2.274 2.754 . 0 0 "[ . 1]" 1
1268 1 58 ILE H 1 59 GLN H . . 4.720 4.513 4.500 4.535 . 0 0 "[ . 1]" 1
1269 1 58 ILE HA 1 58 ILE MD . . 3.820 3.650 3.624 3.685 . 0 0 "[ . 1]" 1
1270 1 58 ILE HA 1 58 ILE MG . . 3.320 2.386 2.301 2.428 . 0 0 "[ . 1]" 1
1271 1 58 ILE HA 1 59 GLN H . . 3.080 2.455 2.430 2.522 . 0 0 "[ . 1]" 1
1272 1 58 ILE HB 1 58 ILE MD . . 3.280 2.075 2.051 2.101 . 0 0 "[ . 1]" 1
1273 1 58 ILE HB 1 59 GLN H . . 3.400 2.299 2.212 2.348 . 0 0 "[ . 1]" 1
1274 1 58 ILE HB 1 64 VAL QG . . 4.130 2.512 2.393 2.720 . 0 0 "[ . 1]" 1
1275 1 58 ILE MD 1 58 ILE MG . . 3.950 3.118 3.100 3.127 . 0 0 "[ . 1]" 1
1276 1 58 ILE MD 1 59 GLN H . . 4.250 2.700 2.435 2.850 . 0 0 "[ . 1]" 1
1277 1 58 ILE MD 1 61 GLY H . . 5.500 5.276 4.805 5.426 . 0 0 "[ . 1]" 1
1278 1 58 ILE MD 1 62 ASP H . . 5.500 4.513 4.264 4.712 . 0 0 "[ . 1]" 1
1279 1 58 ILE MD 1 62 ASP HB2 . . 4.740 3.562 3.068 4.277 . 0 0 "[ . 1]" 1
1280 1 58 ILE MD 1 62 ASP HB3 . . 5.090 4.402 3.456 4.773 . 0 0 "[ . 1]" 1
1281 1 58 ILE MD 1 64 VAL HB . . 4.790 4.569 4.298 4.723 . 0 0 "[ . 1]" 1
1282 1 58 ILE MD 1 64 VAL QG . . 4.880 2.489 2.358 2.641 . 0 0 "[ . 1]" 1
1283 1 58 ILE HG12 1 59 GLN H . . 4.630 4.611 4.396 4.665 0.035 3 0 "[ . 1]" 1
1284 1 58 ILE HG12 1 64 VAL QG . . 4.960 2.517 2.317 2.852 . 0 0 "[ . 1]" 1
1285 1 58 ILE HG13 1 64 VAL QG . . 4.640 3.802 3.698 3.991 . 0 0 "[ . 1]" 1
1286 1 58 ILE MG 1 62 ASP HB3 . . 4.880 3.528 2.997 4.605 . 0 0 "[ . 1]" 1
1287 1 58 ILE MG 1 64 VAL HA . . 5.000 3.938 3.739 4.332 . 0 0 "[ . 1]" 1
1288 1 58 ILE MG 1 64 VAL HB . . 5.160 3.650 3.288 4.011 . 0 0 "[ . 1]" 1
1289 1 58 ILE MG 1 65 ASP H . . 5.140 4.964 4.656 5.149 0.009 6 0 "[ . 1]" 1
1290 1 59 GLN H 1 59 GLN HB2 . . 4.050 2.941 2.802 3.982 . 0 0 "[ . 1]" 1
1291 1 59 GLN H 1 59 GLN HB3 . . 4.050 3.768 3.243 3.880 . 0 0 "[ . 1]" 1
1292 1 59 GLN H 1 59 GLN QG . . 3.910 3.506 2.599 3.869 . 0 0 "[ . 1]" 1
1293 1 59 GLN H 1 62 ASP H . . 4.500 3.713 3.546 4.209 . 0 0 "[ . 1]" 1
1294 1 59 GLN H 1 62 ASP HB2 . . 3.940 2.135 1.949 2.899 . 0 0 "[ . 1]" 1
1295 1 59 GLN H 1 62 ASP HB3 . . 4.060 3.214 2.446 3.983 . 0 0 "[ . 1]" 1
1296 1 59 GLN H 1 64 VAL QG . . 4.860 4.030 3.812 4.244 . 0 0 "[ . 1]" 1
1297 1 59 GLN HA 1 59 GLN QE . . 5.260 4.237 3.174 5.187 . 0 0 "[ . 1]" 1
1298 1 59 GLN HA 1 59 GLN HG2 . . 4.230 2.745 2.210 3.761 . 0 0 "[ . 1]" 1
1299 1 59 GLN HA 1 59 GLN QG . . 3.490 2.510 2.165 3.323 . 0 0 "[ . 1]" 1
1300 1 59 GLN HA 1 59 GLN HG3 . . 4.230 3.199 2.226 3.701 . 0 0 "[ . 1]" 1
1301 1 59 GLN HA 1 60 VAL H . . 3.120 2.527 2.356 2.566 . 0 0 "[ . 1]" 1
1302 1 59 GLN HA 1 60 VAL HA . . 4.700 4.303 4.294 4.307 . 0 0 "[ . 1]" 1
1303 1 59 GLN HA 1 64 VAL QG . . 5.440 5.366 5.206 5.443 0.003 2 0 "[ . 1]" 1
1304 1 59 GLN QB 1 60 VAL H . . 3.300 2.177 2.064 2.533 . 0 0 "[ . 1]" 1
1305 1 59 GLN QB 1 60 VAL HA . . 4.910 4.385 4.309 4.650 . 0 0 "[ . 1]" 1
1306 1 59 GLN QB 1 60 VAL QG . . 3.790 3.472 2.901 3.701 . 0 0 "[ . 1]" 1
1307 1 59 GLN QB 1 62 ASP H . . 4.610 4.382 4.161 4.627 0.017 8 0 "[ . 1]" 1
1308 1 59 GLN HB2 1 62 ASP H . . 5.320 4.807 4.518 5.098 . 0 0 "[ . 1]" 1
1309 1 59 GLN HB3 1 62 ASP H . . 5.320 5.058 4.840 5.340 0.020 1 0 "[ . 1]" 1
1310 1 59 GLN QG 1 60 VAL H . . 5.340 3.545 2.838 3.913 . 0 0 "[ . 1]" 1
1311 1 60 VAL H 1 60 VAL HB . . 3.080 2.575 2.516 2.690 . 0 0 "[ . 1]" 1
1312 1 60 VAL H 1 60 VAL QG . . 2.940 2.011 1.902 2.102 . 0 0 "[ . 1]" 1
1313 1 60 VAL H 1 61 GLY H . . 4.760 4.523 4.481 4.564 . 0 0 "[ . 1]" 1
1314 1 60 VAL H 1 62 ASP H . . 5.080 4.616 4.360 4.929 . 0 0 "[ . 1]" 1
1315 1 60 VAL HA 1 60 VAL MG1 . . 3.270 2.518 2.322 3.195 . 0 0 "[ . 1]" 1
1316 1 60 VAL HA 1 60 VAL QG . . 2.860 2.147 2.080 2.372 . 0 0 "[ . 1]" 1
1317 1 60 VAL HA 1 60 VAL MG2 . . 3.270 2.368 2.336 2.446 . 0 0 "[ . 1]" 1
1318 1 60 VAL HA 1 61 GLY H . . 2.820 2.149 2.143 2.161 . 0 0 "[ . 1]" 1
1319 1 60 VAL HA 1 61 GLY HA3 . . 5.080 4.400 4.393 4.408 . 0 0 "[ . 1]" 1
1320 1 60 VAL HA 1 62 ASP H . . 3.950 3.483 3.392 3.613 . 0 0 "[ . 1]" 1
1321 1 60 VAL HB 1 61 GLY H . . 4.490 4.231 4.078 4.308 . 0 0 "[ . 1]" 1
1322 1 60 VAL QG 1 61 GLY H . . 3.500 2.636 2.505 2.750 . 0 0 "[ . 1]" 1
1323 1 60 VAL QG 1 61 GLY HA2 . . 3.890 3.523 3.275 3.645 . 0 0 "[ . 1]" 1
1324 1 60 VAL QG 1 61 GLY HA3 . . 4.280 3.409 3.262 3.499 . 0 0 "[ . 1]" 1
1325 1 61 GLY H 1 62 ASP H . . 3.270 2.516 2.257 2.748 . 0 0 "[ . 1]" 1
1326 1 61 GLY H 1 62 ASP HB2 . . 5.500 4.630 4.458 4.764 . 0 0 "[ . 1]" 1
1327 1 62 ASP H 1 62 ASP HB2 . . 3.210 2.328 2.080 2.451 . 0 0 "[ . 1]" 1
1328 1 62 ASP H 1 62 ASP HB3 . . 3.580 3.521 3.176 3.607 0.027 10 0 "[ . 1]" 1
1329 1 62 ASP H 1 64 VAL QG . . 5.300 4.431 4.151 4.699 . 0 0 "[ . 1]" 1
1330 1 62 ASP HA 1 63 GLU H . . 2.890 2.178 2.139 2.270 . 0 0 "[ . 1]" 1
1331 1 62 ASP HA 1 63 GLU HA . . 4.890 4.351 4.327 4.381 . 0 0 "[ . 1]" 1
1332 1 62 ASP HA 1 63 GLU HG3 . . 4.730 4.422 4.101 4.734 0.004 9 0 "[ . 1]" 1
1333 1 62 ASP HB2 1 63 GLU H . . 4.450 4.274 4.157 4.433 . 0 0 "[ . 1]" 1
1334 1 62 ASP HB3 1 63 GLU H . . 3.620 3.266 2.951 3.624 0.004 1 0 "[ . 1]" 1
1335 1 62 ASP HB3 1 64 VAL QG . . 5.060 3.306 2.798 3.458 . 0 0 "[ . 1]" 1
1336 1 63 GLU H 1 63 GLU HB2 . . 3.270 2.252 2.148 2.398 . 0 0 "[ . 1]" 1
1337 1 63 GLU H 1 63 GLU HG2 . . 4.250 4.140 4.058 4.249 . 0 0 "[ . 1]" 1
1338 1 63 GLU H 1 63 GLU HG3 . . 3.810 2.918 2.762 3.104 . 0 0 "[ . 1]" 1
1339 1 63 GLU H 1 64 VAL H . . 4.610 4.502 4.444 4.609 . 0 0 "[ . 1]" 1
1340 1 63 GLU HA 1 63 GLU HG2 . . 3.650 2.834 2.636 3.255 . 0 0 "[ . 1]" 1
1341 1 63 GLU HA 1 63 GLU HG3 . . 3.590 2.450 2.362 2.554 . 0 0 "[ . 1]" 1
1342 1 63 GLU HA 1 64 VAL H . . 2.910 2.150 2.138 2.206 . 0 0 "[ . 1]" 1
1343 1 63 GLU HA 1 64 VAL HA . . 5.500 4.401 4.394 4.435 . 0 0 "[ . 1]" 1
1344 1 63 GLU HA 1 64 VAL MG1 . . 4.600 3.745 3.573 3.935 . 0 0 "[ . 1]" 1
1345 1 63 GLU HA 1 64 VAL QG . . 3.780 3.308 3.213 3.369 . 0 0 "[ . 1]" 1
1346 1 63 GLU HA 1 64 VAL MG2 . . 4.600 3.696 3.515 3.820 . 0 0 "[ . 1]" 1
1347 1 63 GLU HB2 1 64 VAL H . . 5.120 4.384 4.197 4.473 . 0 0 "[ . 1]" 1
1348 1 63 GLU HB3 1 64 VAL H . . 3.920 3.430 3.128 3.583 . 0 0 "[ . 1]" 1
1349 1 63 GLU HG3 1 64 VAL H . . 5.270 4.485 4.234 4.628 . 0 0 "[ . 1]" 1
1350 1 64 VAL H 1 64 VAL MG1 . . 4.100 2.891 2.721 3.067 . 0 0 "[ . 1]" 1
1351 1 64 VAL H 1 64 VAL QG . . 3.320 2.034 1.901 2.256 . 0 0 "[ . 1]" 1
1352 1 64 VAL H 1 64 VAL MG2 . . 4.100 2.082 1.930 2.327 . 0 0 "[ . 1]" 1
1353 1 64 VAL HA 1 64 VAL QG . . 3.040 2.271 2.191 2.346 . 0 0 "[ . 1]" 1
1354 1 64 VAL HA 1 65 ASP H . . 3.500 2.361 2.229 2.467 . 0 0 "[ . 1]" 1
1355 1 64 VAL HA 1 65 ASP HA . . 4.520 4.368 4.352 4.405 . 0 0 "[ . 1]" 1
1356 1 64 VAL HB 1 65 ASP H . . 3.870 2.500 2.238 2.860 . 0 0 "[ . 1]" 1
1357 1 64 VAL HB 1 66 VAL QG . . 4.250 4.020 3.819 4.209 . 0 0 "[ . 1]" 1
1358 1 64 VAL QG 1 65 ASP H . . 3.680 3.182 3.019 3.380 . 0 0 "[ . 1]" 1
1359 1 64 VAL QG 1 65 ASP HA . . 4.740 3.949 3.790 4.143 . 0 0 "[ . 1]" 1
1360 1 64 VAL QG 1 65 ASP QB . . 5.080 4.614 4.383 4.735 . 0 0 "[ . 1]" 1
1361 1 64 VAL QG 1 66 VAL H . . 4.600 4.323 3.982 4.599 . 0 0 "[ . 1]" 1
1362 1 64 VAL QG 1 66 VAL QG . . 5.090 2.534 2.428 2.621 . 0 0 "[ . 1]" 1
1363 1 64 VAL MG1 1 65 ASP H . . 4.240 3.696 3.528 3.869 . 0 0 "[ . 1]" 1
1364 1 64 VAL MG2 1 65 ASP H . . 4.240 3.482 3.217 3.798 . 0 0 "[ . 1]" 1
1365 1 65 ASP H 1 65 ASP HB2 . . 3.880 3.527 2.207 3.693 . 0 0 "[ . 1]" 1
1366 1 65 ASP H 1 65 ASP QB . . 3.390 2.720 2.180 2.988 . 0 0 "[ . 1]" 1
1367 1 65 ASP H 1 65 ASP HB3 . . 3.880 2.937 2.619 3.402 . 0 0 "[ . 1]" 1
1368 1 65 ASP HA 1 66 VAL H . . 2.880 2.161 2.141 2.230 . 0 0 "[ . 1]" 1
1369 1 65 ASP HA 1 66 VAL HA . . 4.950 4.397 4.389 4.424 . 0 0 "[ . 1]" 1
1370 1 65 ASP HA 1 66 VAL QG . . 4.040 3.590 3.338 3.742 . 0 0 "[ . 1]" 1
1371 1 65 ASP QB 1 66 VAL H . . 4.160 3.206 2.849 3.436 . 0 0 "[ . 1]" 1
1372 1 66 VAL H 1 66 VAL HB . . 3.870 2.649 2.526 2.825 . 0 0 "[ . 1]" 1
1373 1 66 VAL H 1 66 VAL QG . . 3.560 2.607 2.369 2.739 . 0 0 "[ . 1]" 1
1374 1 66 VAL HA 1 66 VAL MG1 . . 3.460 2.297 2.206 2.368 . 0 0 "[ . 1]" 1
1375 1 66 VAL HA 1 66 VAL QG . . 2.770 2.063 2.039 2.093 . 0 0 "[ . 1]" 1
1376 1 66 VAL HA 1 66 VAL MG2 . . 3.460 2.342 2.279 2.417 . 0 0 "[ . 1]" 1
1377 1 66 VAL HA 1 67 ALA H . . 2.740 2.194 2.162 2.236 . 0 0 "[ . 1]" 1
1378 1 66 VAL HB 1 67 ALA H . . 4.710 3.991 3.837 4.136 . 0 0 "[ . 1]" 1
1379 1 66 VAL QG 1 67 ALA H . . 3.480 2.289 2.133 2.428 . 0 0 "[ . 1]" 1
1380 1 66 VAL QG 1 67 ALA HA . . 4.650 3.971 3.819 4.108 . 0 0 "[ . 1]" 1
1381 1 66 VAL QG 1 68 LEU H . . 4.840 4.314 3.908 4.590 . 0 0 "[ . 1]" 1
1382 1 67 ALA H 1 67 ALA MB . . 2.840 2.071 2.048 2.112 . 0 0 "[ . 1]" 1
1383 1 67 ALA HA 1 68 LEU HA . . 5.140 4.407 4.362 4.450 . 0 0 "[ . 1]" 1
1384 1 67 ALA MB 1 68 LEU H . . 3.560 3.336 3.155 3.460 . 0 0 "[ . 1]" 1
1385 1 68 LEU H 1 68 LEU HB2 . . 3.730 2.237 2.152 2.312 . 0 0 "[ . 1]" 1
1386 1 68 LEU H 1 68 LEU HB3 . . 3.360 2.814 2.716 2.933 . 0 0 "[ . 1]" 1
1387 1 68 LEU H 1 68 LEU QD . . 5.060 3.587 3.363 3.706 . 0 0 "[ . 1]" 1
1388 1 68 LEU HA 1 68 LEU MD1 . . 4.110 2.955 2.433 3.575 . 0 0 "[ . 1]" 1
1389 1 68 LEU HA 1 68 LEU QD . . 3.250 2.612 1.909 2.947 . 0 0 "[ . 1]" 1
1390 1 68 LEU HA 1 68 LEU MD2 . . 4.110 3.364 1.961 3.866 . 0 0 "[ . 1]" 1
1391 1 68 LEU HA 1 69 ASP H . . 3.380 2.535 2.140 3.411 0.031 7 0 "[ . 1]" 1
1392 1 68 LEU HA 1 69 ASP QB . . 5.340 4.435 4.112 5.054 . 0 0 "[ . 1]" 1
1393 1 68 LEU HB3 1 68 LEU MD1 . . 3.180 2.831 2.283 3.136 . 0 0 "[ . 1]" 1
1394 1 68 LEU HB3 1 68 LEU MD2 . . 3.180 2.159 1.989 3.181 0.001 10 0 "[ . 1]" 1
1395 1 69 ASP HA 1 70 ALA MB . . 4.180 3.943 3.875 4.087 . 0 0 "[ . 1]" 1
1396 1 69 ASP QB 1 70 ALA H . . 4.020 2.883 2.053 3.654 . 0 0 "[ . 1]" 1
1397 1 69 ASP QB 1 70 ALA HA . . 5.340 4.461 4.087 4.650 . 0 0 "[ . 1]" 1
1398 1 69 ASP QB 1 70 ALA MB . . 5.250 4.452 3.931 4.922 . 0 0 "[ . 1]" 1
1399 1 69 ASP QB 1 71 VAL QG . . 4.580 3.735 2.764 4.513 . 0 0 "[ . 1]" 1
1400 1 69 ASP HB2 1 70 ALA H . . 4.710 3.315 2.264 4.290 . 0 0 "[ . 1]" 1
1401 1 69 ASP HB3 1 70 ALA H . . 4.710 3.631 2.070 4.218 . 0 0 "[ . 1]" 1
1402 1 70 ALA H 1 70 ALA MB . . 3.260 2.342 2.185 2.528 . 0 0 "[ . 1]" 1
1403 1 70 ALA H 1 71 VAL H . . 4.450 4.071 2.565 4.445 . 0 0 "[ . 1]" 1
1404 1 70 ALA H 1 71 VAL HA . . 5.380 5.072 4.835 5.264 . 0 0 "[ . 1]" 1
1405 1 70 ALA HA 1 71 VAL H . . 3.190 2.264 2.141 2.975 . 0 0 "[ . 1]" 1
1406 1 70 ALA HA 1 71 VAL QG . . 4.540 3.699 3.293 4.474 . 0 0 "[ . 1]" 1
1407 1 70 ALA MB 1 71 VAL H . . 4.030 3.331 3.009 3.657 . 0 0 "[ . 1]" 1
1408 1 70 ALA MB 1 71 VAL HA . . 4.400 4.142 3.936 4.399 . 0 0 "[ . 1]" 1
1409 1 71 VAL H 1 71 VAL HB . . 3.690 3.283 2.568 3.690 . 0 0 "[ . 1]" 1
1410 1 71 VAL H 1 71 VAL QG . . 3.620 2.345 1.919 2.901 . 0 0 "[ . 1]" 1
1411 1 71 VAL H 1 72 GLU H . . 4.470 4.295 3.970 4.466 . 0 0 "[ . 1]" 1
1412 1 71 VAL HA 1 71 VAL MG1 . . 3.230 2.673 2.284 3.203 . 0 0 "[ . 1]" 1
1413 1 71 VAL HA 1 71 VAL QG . . 2.790 2.210 2.044 2.318 . 0 0 "[ . 1]" 1
1414 1 71 VAL HA 1 71 VAL MG2 . . 3.230 2.585 2.273 3.203 . 0 0 "[ . 1]" 1
1415 1 71 VAL HA 1 72 GLU H . . 2.960 2.316 2.150 2.623 . 0 0 "[ . 1]" 1
1416 1 71 VAL HB 1 72 GLU H . . 4.970 3.495 1.950 4.355 . 0 0 "[ . 1]" 1
1417 1 71 VAL QG 1 72 GLU H . . 3.270 2.587 2.189 2.923 . 0 0 "[ . 1]" 1
1418 1 71 VAL QG 1 72 GLU HA . . 4.290 3.871 3.407 4.233 . 0 0 "[ . 1]" 1
1419 1 71 VAL QG 1 72 GLU QB . . 4.480 3.983 3.276 4.458 . 0 0 "[ . 1]" 1
1420 1 71 VAL QG 1 73 ASP HA . . 4.520 4.333 4.094 4.520 . 0 0 "[ . 1]" 1
1421 1 72 GLU H 1 72 GLU HB2 . . 3.790 2.875 2.159 3.751 . 0 0 "[ . 1]" 1
1422 1 72 GLU H 1 72 GLU HB3 . . 3.790 3.208 2.557 3.741 . 0 0 "[ . 1]" 1
1423 1 72 GLU H 1 72 GLU HG2 . . 4.380 3.203 2.033 4.369 . 0 0 "[ . 1]" 1
1424 1 72 GLU H 1 72 GLU QG . . 3.820 2.760 2.014 3.747 . 0 0 "[ . 1]" 1
1425 1 72 GLU H 1 72 GLU HG3 . . 4.380 3.454 2.840 4.077 . 0 0 "[ . 1]" 1
1426 1 72 GLU H 1 73 ASP H . . 4.770 4.550 4.455 4.646 . 0 0 "[ . 1]" 1
1427 1 72 GLU HA 1 73 ASP H . . 2.980 2.487 2.304 2.656 . 0 0 "[ . 1]" 1
1428 1 72 GLU HB2 1 73 ASP H . . 4.060 3.082 1.990 4.056 . 0 0 "[ . 1]" 1
1429 1 72 GLU HB3 1 73 ASP H . . 4.060 2.912 2.042 3.931 . 0 0 "[ . 1]" 1
1430 1 72 GLU QG 1 73 ASP H . . 4.040 3.359 1.950 4.017 . 0 0 "[ . 1]" 1
1431 1 73 ASP H 1 73 ASP QB . . 3.650 2.765 2.433 3.192 . 0 0 "[ . 1]" 1
1432 1 73 ASP HA 1 74 GLY H . . 3.460 2.498 2.175 3.465 0.005 2 0 "[ . 1]" 1
1433 1 73 ASP QB 1 74 GLY H . . 4.050 2.876 2.005 3.659 . 0 0 "[ . 1]" 1
1434 1 75 PHE H 1 75 PHE HB2 . . 3.840 3.209 2.233 3.840 0.000 9 0 "[ . 1]" 1
1435 1 75 PHE H 1 75 PHE QB . . 3.370 2.866 2.162 3.238 . 0 0 "[ . 1]" 1
1436 1 75 PHE H 1 75 PHE HB3 . . 3.840 3.494 2.886 3.835 . 0 0 "[ . 1]" 1
1437 1 75 PHE H 1 75 PHE QD . . 3.990 3.263 2.668 3.984 . 0 0 "[ . 1]" 1
1438 1 75 PHE H 1 76 GLY H . . 4.180 3.665 1.912 4.180 . 0 0 "[ . 1]" 1
1439 1 75 PHE H 1 76 GLY QA . . 4.970 4.377 3.828 4.670 . 0 0 "[ . 1]" 1
1440 1 75 PHE HA 1 75 PHE QD . . 3.720 3.102 2.064 3.704 . 0 0 "[ . 1]" 1
1441 1 75 PHE QB 1 76 GLY H . . 3.870 3.107 2.184 3.449 . 0 0 "[ . 1]" 1
1442 1 75 PHE HB2 1 76 GLY H . . 4.430 3.642 2.695 4.416 . 0 0 "[ . 1]" 1
1443 1 75 PHE HB3 1 76 GLY H . . 4.430 3.674 2.212 4.170 . 0 0 "[ . 1]" 1
1444 1 75 PHE QD 1 76 GLY H . . 4.540 4.022 3.031 4.531 . 0 0 "[ . 1]" 1
1445 1 76 GLY H 1 77 GLU H . . 3.830 3.380 2.500 3.806 . 0 0 "[ . 1]" 1
1446 1 76 GLY QA 1 77 GLU H . . 3.030 2.242 2.112 2.437 . 0 0 "[ . 1]" 1
1447 1 76 GLY QA 1 77 GLU HA . . 4.360 4.040 3.937 4.189 . 0 0 "[ . 1]" 1
1448 1 76 GLY QA 1 77 GLU QB . . 4.390 4.126 3.853 4.361 . 0 0 "[ . 1]" 1
1449 1 76 GLY HA2 1 77 GLU H . . 3.560 2.622 2.139 3.562 0.002 9 0 "[ . 1]" 1
1450 1 76 GLY HA3 1 77 GLU H . . 3.560 3.092 2.172 3.555 . 0 0 "[ . 1]" 1
1451 1 77 GLU H 1 77 GLU QB . . 3.180 2.384 2.228 2.560 . 0 0 "[ . 1]" 1
1452 1 77 GLU H 1 77 GLU QG . . 4.030 2.950 2.003 4.015 . 0 0 "[ . 1]" 1
1453 1 77 GLU HA 1 78 THR H . . 2.880 2.303 2.149 2.619 . 0 0 "[ . 1]" 1
1454 1 77 GLU QB 1 78 THR H . . 4.310 3.038 2.039 3.724 . 0 0 "[ . 1]" 1
1455 1 77 GLU QG 1 78 THR H . . 4.520 3.498 2.073 4.445 . 0 0 "[ . 1]" 1
1456 1 78 THR H 1 78 THR MG . . 4.190 2.639 2.029 3.902 . 0 0 "[ . 1]" 1
1457 1 78 THR HA 1 78 THR MG . . 3.560 2.724 2.177 3.207 . 0 0 "[ . 1]" 1
1458 1 78 THR HA 1 79 LEU H . . 3.120 2.375 2.202 2.593 . 0 0 "[ . 1]" 1
1459 1 78 THR MG 1 79 LEU H . . 4.320 3.551 3.126 3.882 . 0 0 "[ . 1]" 1
1460 1 79 LEU H 1 79 LEU QB . . 3.220 2.498 2.131 2.917 . 0 0 "[ . 1]" 1
1461 1 79 LEU H 1 79 LEU HG . . 4.850 4.068 2.196 4.797 . 0 0 "[ . 1]" 1
1462 1 79 LEU HA 1 79 LEU MD1 . . 3.980 3.179 2.209 3.901 . 0 0 "[ . 1]" 1
1463 1 79 LEU HA 1 79 LEU QD . . 2.770 2.365 1.975 2.757 . 0 0 "[ . 1]" 1
1464 1 79 LEU HA 1 79 LEU MD2 . . 3.980 2.792 1.995 3.885 . 0 0 "[ . 1]" 1
1465 1 79 LEU HA 1 80 LEU H . . 3.300 2.362 2.140 2.922 . 0 0 "[ . 1]" 1
1466 1 79 LEU QB 1 80 LEU H . . 3.950 3.472 2.090 3.924 . 0 0 "[ . 1]" 1
1467 1 80 LEU H 1 80 LEU QB . . 3.340 2.539 2.122 3.112 . 0 0 "[ . 1]" 1
1468 1 80 LEU HA 1 81 SER H . . 3.170 2.327 2.139 2.968 . 0 0 "[ . 1]" 1
1469 1 83 GLU H 1 83 GLU QB . . 3.470 2.359 2.235 2.625 . 0 0 "[ . 1]" 1
1470 1 83 GLU QB 1 84 LYS HA . . 4.160 3.969 3.875 4.160 . 0 0 "[ . 1]" 1
1471 1 84 LYS H 1 84 LYS QB . . 3.860 2.264 2.139 2.468 . 0 0 "[ . 1]" 1
1472 1 84 LYS H 1 85 ALA H . . 4.270 2.717 2.560 3.079 . 0 0 "[ . 1]" 1
1473 1 84 LYS HA 1 85 ALA MB . . 5.190 4.831 4.057 5.035 . 0 0 "[ . 1]" 1
1474 1 84 LYS QB 1 85 ALA H . . 3.890 2.679 2.041 3.508 . 0 0 "[ . 1]" 1
1475 1 85 ALA MB 1 86 LYS H . . 3.330 2.916 2.543 3.462 0.132 9 0 "[ . 1]" 1
1476 1 86 LYS H 1 86 LYS QE . . 5.300 4.893 4.534 5.301 0.001 6 0 "[ . 1]" 1
1477 1 86 LYS H 1 86 LYS QG . . 3.660 2.708 2.082 3.793 0.133 7 0 "[ . 1]" 1
1478 1 86 LYS H 1 87 ARG H . . 4.700 4.074 2.411 4.594 . 0 0 "[ . 1]" 1
1479 1 86 LYS QB 1 87 ARG H . . 4.150 2.897 2.156 3.831 . 0 0 "[ . 1]" 1
1480 1 86 LYS HG2 1 87 ARG H . . 5.500 4.407 2.873 5.431 . 0 0 "[ . 1]" 1
1481 1 86 LYS HG3 1 87 ARG H . . 5.500 4.406 3.156 5.163 . 0 0 "[ . 1]" 1
1482 1 87 ARG H 1 87 ARG QB . . 3.650 2.559 2.237 3.155 . 0 0 "[ . 1]" 1
1483 1 87 ARG H 1 87 ARG HD2 . . 5.500 4.498 3.570 5.103 . 0 0 "[ . 1]" 1
1484 1 87 ARG H 1 87 ARG HD3 . . 5.500 4.704 1.935 5.491 . 0 0 "[ . 1]" 1
1485 1 87 ARG H 1 87 ARG QG . . 5.110 3.500 2.117 4.355 . 0 0 "[ . 1]" 1
1486 1 87 ARG HA 1 87 ARG HD2 . . 5.370 4.498 3.865 5.369 . 0 0 "[ . 1]" 1
1487 1 87 ARG HA 1 87 ARG HD3 . . 5.370 3.917 3.133 4.446 . 0 0 "[ . 1]" 1
1488 1 87 ARG HA 1 87 ARG QG . . 3.740 2.749 2.165 3.428 . 0 0 "[ . 1]" 1
1489 1 87 ARG HA 1 88 HIS QB . . 5.050 4.289 4.054 4.835 . 0 0 "[ . 1]" 1
1490 1 87 ARG QB 1 87 ARG QD . . 3.240 2.118 1.960 2.231 . 0 0 "[ . 1]" 1
1491 1 87 ARG HD2 1 89 GLU HA . . 5.500 4.682 3.279 5.284 . 0 0 "[ . 1]" 1
1492 1 87 ARG HD3 1 89 GLU HA . . 5.500 4.473 3.389 5.500 0.000 4 0 "[ . 1]" 1
1493 1 88 HIS HA 1 88 HIS HD2 . . 5.170 3.562 2.148 4.838 . 0 0 "[ . 1]" 1
1494 1 88 HIS QB 1 89 GLU H . . 4.290 2.951 2.177 4.012 . 0 0 "[ . 1]" 1
1495 1 88 HIS HB2 1 89 GLU H . . 5.100 3.583 2.216 4.639 . 0 0 "[ . 1]" 1
1496 1 88 HIS HB3 1 89 GLU H . . 5.100 3.451 2.377 4.657 . 0 0 "[ . 1]" 1
1497 1 89 GLU H 1 89 GLU HB2 . . 4.140 2.865 2.184 4.055 . 0 0 "[ . 1]" 1
1498 1 89 GLU H 1 89 GLU QB . . 3.380 2.550 2.128 3.320 . 0 0 "[ . 1]" 1
1499 1 89 GLU H 1 89 GLU HB3 . . 4.140 3.190 2.700 3.829 . 0 0 "[ . 1]" 1
1500 1 89 GLU H 1 89 GLU QG . . 3.810 3.210 2.027 3.853 0.043 6 0 "[ . 1]" 1
1501 1 89 GLU HA 1 89 GLU QG . . 3.830 2.629 2.132 3.445 . 0 0 "[ . 1]" 1
1502 1 89 GLU HA 1 90 ALA H . . 3.390 2.754 2.151 3.452 0.062 6 0 "[ . 1]" 1
1503 1 89 GLU HA 1 91 TRP HD1 . . 5.500 4.229 2.307 5.362 . 0 0 "[ . 1]" 1
1504 1 89 GLU QB 1 91 TRP HD1 . . 5.340 4.230 2.465 5.332 . 0 0 "[ . 1]" 1
1505 1 89 GLU QG 1 90 ALA HA . . 5.500 4.830 3.935 5.585 0.085 8 0 "[ . 1]" 1
1506 1 89 GLU QG 1 90 ALA MB . . 5.380 4.454 2.454 5.375 . 0 0 "[ . 1]" 1
1507 1 90 ALA H 1 90 ALA MB . . 3.350 2.557 2.027 2.907 . 0 0 "[ . 1]" 1
1508 1 90 ALA H 1 91 TRP H . . 4.630 3.769 2.641 4.609 . 0 0 "[ . 1]" 1
1509 1 90 ALA HA 1 91 TRP H . . 3.470 2.508 2.144 3.553 0.083 4 0 "[ . 1]" 1
1510 1 90 ALA HA 1 91 TRP HD1 . . 5.500 4.288 3.132 5.337 . 0 0 "[ . 1]" 1
1511 1 90 ALA MB 1 91 TRP H . . 3.770 3.046 2.047 3.712 . 0 0 "[ . 1]" 1
1512 1 90 ALA MB 1 91 TRP HD1 . . 4.850 4.394 3.006 4.849 . 0 0 "[ . 1]" 1
1513 1 91 TRP H 1 91 TRP QB . . 3.410 2.825 2.567 3.375 . 0 0 "[ . 1]" 1
1514 1 91 TRP H 1 91 TRP HD1 . . 4.130 3.716 3.182 4.100 . 0 0 "[ . 1]" 1
1515 1 91 TRP H 1 92 ILE H . . 4.400 3.994 2.135 4.405 0.005 8 0 "[ . 1]" 1
1516 1 91 TRP HA 1 91 TRP HD1 . . 4.420 3.997 3.622 4.392 . 0 0 "[ . 1]" 1
1517 1 91 TRP HA 1 91 TRP HE3 . . 4.410 3.517 2.777 4.342 . 0 0 "[ . 1]" 1
1518 1 91 TRP HA 1 92 ILE QG . . 5.240 3.534 3.042 5.180 . 0 0 "[ . 1]" 1
1519 1 91 TRP QB 1 91 TRP HD1 . . 3.150 2.616 2.529 2.774 . 0 0 "[ . 1]" 1
1520 1 91 TRP QB 1 91 TRP HE3 . . 3.330 2.570 2.403 2.737 . 0 0 "[ . 1]" 1
1521 1 91 TRP QB 1 92 ILE H . . 4.100 2.595 1.951 3.926 . 0 0 "[ . 1]" 1
1522 1 91 TRP HE3 1 92 ILE HB . . 5.150 4.827 4.038 5.164 0.014 2 0 "[ . 1]" 1
1523 1 91 TRP HE3 1 92 ILE QG . . 5.130 4.573 2.704 5.107 . 0 0 "[ . 1]" 1
1524 1 92 ILE H 1 92 ILE HB . . 3.890 2.841 2.556 3.726 . 0 0 "[ . 1]" 1
1525 1 92 ILE H 1 92 ILE MD . . 4.840 3.506 2.158 4.346 . 0 0 "[ . 1]" 1
1526 1 92 ILE H 1 92 ILE HG12 . . 4.490 3.798 2.756 4.231 . 0 0 "[ . 1]" 1
1527 1 92 ILE H 1 92 ILE HG13 . . 4.490 3.072 2.181 4.171 . 0 0 "[ . 1]" 1
1528 1 92 ILE H 1 92 ILE MG . . 4.540 3.895 3.804 3.977 . 0 0 "[ . 1]" 1
1529 1 92 ILE H 1 93 THR H . . 4.450 3.151 1.921 4.432 . 0 0 "[ . 1]" 1
1530 1 92 ILE H 1 93 THR HA . . 5.290 4.839 4.129 5.330 0.040 4 0 "[ . 1]" 1
1531 1 92 ILE H 1 93 THR HB . . 5.460 5.199 4.625 5.469 0.009 8 0 "[ . 1]" 1
1532 1 92 ILE HA 1 92 ILE MG . . 3.570 2.285 2.208 2.379 . 0 0 "[ . 1]" 1
1533 1 92 ILE HA 1 93 THR H . . 3.350 2.768 2.145 3.531 0.181 10 0 "[ . 1]" 1
1534 1 92 ILE HA 1 93 THR MG . . 5.370 4.343 3.487 5.463 0.093 10 0 "[ . 1]" 1
1535 1 92 ILE HB 1 92 ILE MD . . 3.620 2.351 2.058 3.216 . 0 0 "[ . 1]" 1
1536 1 92 ILE HB 1 93 THR H . . 4.540 3.700 2.631 4.397 . 0 0 "[ . 1]" 1
1537 1 92 ILE HB 1 93 THR MG . . 5.420 4.714 3.917 5.502 0.082 10 0 "[ . 1]" 1
1538 1 92 ILE QG 1 93 THR H . . 4.880 4.268 3.872 4.532 . 0 0 "[ . 1]" 1
1539 1 92 ILE MG 1 93 THR H . . 4.030 3.275 2.117 4.028 . 0 0 "[ . 1]" 1
1540 1 92 ILE MG 1 93 THR HA . . 4.610 3.890 3.298 4.626 0.016 10 0 "[ . 1]" 1
1541 1 93 THR H 1 93 THR MG . . 3.780 2.689 2.030 3.633 . 0 0 "[ . 1]" 1
1542 1 93 THR HA 1 93 THR MG . . 3.260 2.778 1.957 3.206 . 0 0 "[ . 1]" 1
1543 1 93 THR HA 1 94 LEU H . . 3.270 2.373 2.187 2.988 . 0 0 "[ . 1]" 1
1544 1 93 THR HB 1 94 LEU H . . 4.070 3.587 2.538 4.139 0.069 10 0 "[ . 1]" 1
1545 1 93 THR MG 1 94 LEU H . . 4.270 3.668 3.019 4.423 0.153 10 0 "[ . 1]" 1
1546 1 94 LEU H 1 94 LEU HB2 . . 3.810 3.401 2.718 3.844 0.034 3 0 "[ . 1]" 1
1547 1 94 LEU H 1 94 LEU HB3 . . 3.810 2.901 2.455 3.282 . 0 0 "[ . 1]" 1
1548 1 94 LEU H 1 94 LEU QD . . 4.500 2.754 1.888 3.958 . 0 0 "[ . 1]" 1
1549 1 94 LEU H 1 95 GLU H . . 4.660 3.749 1.892 4.517 . 0 0 "[ . 1]" 1
1550 1 94 LEU HA 1 94 LEU QD . . 3.940 2.855 1.928 3.434 . 0 0 "[ . 1]" 1
1551 1 94 LEU HA 1 95 GLU H . . 3.340 2.843 2.340 3.555 0.215 9 0 "[ . 1]" 1
1552 1 94 LEU QB 1 95 GLU HB2 . . 5.340 4.382 3.661 5.419 0.079 4 0 "[ . 1]" 1
1553 1 94 LEU QB 1 95 GLU HB3 . . 5.340 5.091 3.860 5.403 0.063 6 0 "[ . 1]" 1
1554 1 94 LEU QB 1 95 GLU QG . . 4.760 3.754 2.778 4.791 0.031 10 0 "[ . 1]" 1
1555 1 94 LEU QD 1 95 GLU H . . 4.420 2.936 2.577 3.428 . 0 0 "[ . 1]" 1
1556 1 94 LEU QD 1 95 GLU HA . . 4.510 4.449 4.094 4.623 0.113 10 0 "[ . 1]" 1
1557 1 94 LEU QD 1 95 GLU QG . . 4.250 3.110 1.915 4.247 . 0 0 "[ . 1]" 1
1558 1 94 LEU HG 1 95 GLU H . . 5.090 2.489 1.898 3.366 . 0 0 "[ . 1]" 1
1559 1 94 LEU HG 1 95 GLU HA . . 4.870 4.295 3.506 4.867 . 0 0 "[ . 1]" 1
1560 1 94 LEU HG 1 95 GLU HB2 . . 4.460 3.765 2.790 4.502 0.042 3 0 "[ . 1]" 1
1561 1 94 LEU HG 1 95 GLU HG2 . . 5.500 3.983 2.400 5.493 . 0 0 "[ . 1]" 1
1562 1 94 LEU HG 1 95 GLU HG3 . . 5.500 3.754 2.560 5.477 . 0 0 "[ . 1]" 1
1563 1 95 GLU H 1 95 GLU HB2 . . 4.030 2.951 2.243 4.021 . 0 0 "[ . 1]" 1
1564 1 95 GLU H 1 95 GLU QG . . 4.440 2.548 1.961 3.145 . 0 0 "[ . 1]" 1
1565 1 95 GLU H 1 96 LYS H . . 4.450 3.245 2.614 4.375 . 0 0 "[ . 1]" 1
1566 1 95 GLU HA 1 95 GLU HG2 . . 3.720 2.781 2.316 3.720 0.000 3 0 "[ . 1]" 1
1567 1 95 GLU HA 1 95 GLU HG3 . . 3.720 3.425 2.799 3.726 0.006 4 0 "[ . 1]" 1
1568 1 95 GLU HB2 1 95 GLU QG . . 2.540 2.259 2.149 2.407 . 0 0 "[ . 1]" 1
1569 1 95 GLU HB2 1 96 LYS H . . 4.690 3.025 2.112 4.369 . 0 0 "[ . 1]" 1
1570 1 95 GLU QG 1 96 LYS H . . 4.830 4.069 2.780 4.564 . 0 0 "[ . 1]" 1
1571 1 95 GLU HG2 1 96 LYS H . . 5.500 4.725 3.974 5.388 . 0 0 "[ . 1]" 1
1572 1 95 GLU HG3 1 96 LYS H . . 5.500 4.524 2.838 5.461 . 0 0 "[ . 1]" 1
1573 1 96 LYS H 1 96 LYS QG . . 3.870 2.986 2.088 3.906 0.036 6 0 "[ . 1]" 1
1574 1 96 LYS HA 1 96 LYS HD2 . . 5.500 4.002 2.309 5.010 . 0 0 "[ . 1]" 1
1575 1 96 LYS HA 1 96 LYS QD . . 4.790 3.149 2.284 3.904 . 0 0 "[ . 1]" 1
1576 1 96 LYS HA 1 96 LYS HD3 . . 5.500 3.465 2.402 4.659 . 0 0 "[ . 1]" 1
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