NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
404757 |
1x4d   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1x4d
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 2082
_Distance_constraint_stats_list.Viol_count 525
_Distance_constraint_stats_list.Viol_total 96.546
_Distance_constraint_stats_list.Viol_max 0.185
_Distance_constraint_stats_list.Viol_rms 0.0026
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0092
_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 9 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 ARG 0.879 0.099 20 0 "[ . 1 . 2]"
1 12 VAL 0.957 0.099 20 0 "[ . 1 . 2]"
1 13 GLU 0.127 0.035 9 0 "[ . 1 . 2]"
1 14 THR 1.271 0.185 1 0 "[ . 1 . 2]"
1 15 ARG 1.306 0.185 1 0 "[ . 1 . 2]"
1 16 ARG 0.109 0.016 18 0 "[ . 1 . 2]"
1 17 VAL 0.143 0.010 2 0 "[ . 1 . 2]"
1 18 VAL 0.051 0.009 18 0 "[ . 1 . 2]"
1 19 HIS 0.006 0.006 6 0 "[ . 1 . 2]"
1 20 ILE 0.018 0.006 2 0 "[ . 1 . 2]"
1 21 MET 0.126 0.016 14 0 "[ . 1 . 2]"
1 22 ASP 0.019 0.010 3 0 "[ . 1 . 2]"
1 23 PHE 0.250 0.051 20 0 "[ . 1 . 2]"
1 24 GLN 0.231 0.051 20 0 "[ . 1 . 2]"
1 25 ARG 0.042 0.009 17 0 "[ . 1 . 2]"
1 26 GLY 0.144 0.038 17 0 "[ . 1 . 2]"
1 27 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 ASN 0.015 0.009 17 0 "[ . 1 . 2]"
1 29 LEU 0.153 0.038 17 0 "[ . 1 . 2]"
1 30 ARG 0.005 0.003 7 0 "[ . 1 . 2]"
1 31 TYR 0.056 0.009 17 0 "[ . 1 . 2]"
1 32 GLN 0.040 0.009 12 0 "[ . 1 . 2]"
1 33 LEU 0.137 0.026 2 0 "[ . 1 . 2]"
1 34 LEU 0.034 0.004 7 0 "[ . 1 . 2]"
1 35 GLN 0.050 0.007 12 0 "[ . 1 . 2]"
1 36 LEU 0.022 0.007 9 0 "[ . 1 . 2]"
1 37 VAL 0.028 0.014 6 0 "[ . 1 . 2]"
1 38 GLU 0.023 0.008 4 0 "[ . 1 . 2]"
1 39 PRO 0.021 0.014 6 0 "[ . 1 . 2]"
1 40 PHE 0.047 0.021 4 0 "[ . 1 . 2]"
1 41 GLY 0.101 0.022 14 0 "[ . 1 . 2]"
1 42 VAL 0.302 0.027 9 0 "[ . 1 . 2]"
1 43 ILE 0.061 0.008 4 0 "[ . 1 . 2]"
1 44 SER 0.040 0.006 9 0 "[ . 1 . 2]"
1 45 ASN 0.014 0.004 12 0 "[ . 1 . 2]"
1 46 HIS 0.016 0.003 7 0 "[ . 1 . 2]"
1 47 LEU 0.009 0.003 17 0 "[ . 1 . 2]"
1 48 ILE 0.035 0.006 7 0 "[ . 1 . 2]"
1 49 LEU 0.021 0.003 9 0 "[ . 1 . 2]"
1 50 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 LYS 0.004 0.004 1 0 "[ . 1 . 2]"
1 52 ILE 0.025 0.006 6 0 "[ . 1 . 2]"
1 53 ASN 0.005 0.005 8 0 "[ . 1 . 2]"
1 54 GLU 0.028 0.009 8 0 "[ . 1 . 2]"
1 55 ALA 0.011 0.006 7 0 "[ . 1 . 2]"
1 56 PHE 0.041 0.009 14 0 "[ . 1 . 2]"
1 57 ILE 0.007 0.006 6 0 "[ . 1 . 2]"
1 58 GLU 0.104 0.009 12 0 "[ . 1 . 2]"
1 59 MET 0.057 0.010 2 0 "[ . 1 . 2]"
1 60 ALA 0.177 0.027 9 0 "[ . 1 . 2]"
1 61 THR 0.015 0.010 7 0 "[ . 1 . 2]"
1 62 THR 0.121 0.015 4 0 "[ . 1 . 2]"
1 63 GLU 0.007 0.003 7 0 "[ . 1 . 2]"
1 64 ASP 0.002 0.002 17 0 "[ . 1 . 2]"
1 65 ALA 0.056 0.014 5 0 "[ . 1 . 2]"
1 66 GLN 0.068 0.013 3 0 "[ . 1 . 2]"
1 67 ALA 0.037 0.021 4 0 "[ . 1 . 2]"
1 68 ALA 0.007 0.007 9 0 "[ . 1 . 2]"
1 69 VAL 0.008 0.003 5 0 "[ . 1 . 2]"
1 70 ASP 0.015 0.010 17 0 "[ . 1 . 2]"
1 71 TYR 0.009 0.003 17 0 "[ . 1 . 2]"
1 72 TYR 0.524 0.030 15 0 "[ . 1 . 2]"
1 73 THR 0.186 0.019 6 0 "[ . 1 . 2]"
1 74 THR 0.003 0.003 4 0 "[ . 1 . 2]"
1 75 THR 0.011 0.004 15 0 "[ . 1 . 2]"
1 76 PRO 0.024 0.007 17 0 "[ . 1 . 2]"
1 77 ALA 0.016 0.007 17 0 "[ . 1 . 2]"
1 78 LEU 0.018 0.004 7 0 "[ . 1 . 2]"
1 79 VAL 0.112 0.011 11 0 "[ . 1 . 2]"
1 80 PHE 0.061 0.013 11 0 "[ . 1 . 2]"
1 81 GLY 0.009 0.003 7 0 "[ . 1 . 2]"
1 82 LYS 0.048 0.014 19 0 "[ . 1 . 2]"
1 83 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 VAL 0.033 0.012 14 0 "[ . 1 . 2]"
1 85 ARG 0.094 0.016 14 0 "[ . 1 . 2]"
1 86 VAL 0.018 0.006 2 0 "[ . 1 . 2]"
1 87 HIS 0.016 0.006 6 0 "[ . 1 . 2]"
1 88 LEU 0.033 0.006 7 0 "[ . 1 . 2]"
1 89 SER 0.002 0.002 15 0 "[ . 1 . 2]"
1 90 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 LYS 0.019 0.006 7 0 "[ . 1 . 2]"
1 92 TYR 0.012 0.006 7 0 "[ . 1 . 2]"
1 93 LYS 0.002 0.002 9 0 "[ . 1 . 2]"
1 94 ARG 0.002 0.002 9 0 "[ . 1 . 2]"
1 95 ILE 0.079 0.029 16 0 "[ . 1 . 2]"
1 96 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 9 LYS QB 1 10 GLY QA . . 4.720 3.918 3.457 4.216 . 0 0 "[ . 1 . 2]" 1
2 1 10 GLY QA 1 11 ARG QB . . 5.210 3.798 3.459 4.181 . 0 0 "[ . 1 . 2]" 1
3 1 10 GLY QA 1 12 VAL QG . . 5.370 4.446 4.015 4.853 . 0 0 "[ . 1 . 2]" 1
4 1 11 ARG HA 1 11 ARG QD . . 4.740 3.610 2.755 4.230 . 0 0 "[ . 1 . 2]" 1
5 1 11 ARG HA 1 11 ARG HG2 . . 3.630 2.969 2.127 3.584 . 0 0 "[ . 1 . 2]" 1
6 1 11 ARG HA 1 11 ARG HG3 . . 3.630 2.494 2.065 3.591 . 0 0 "[ . 1 . 2]" 1
7 1 11 ARG HA 1 12 VAL H . . 3.270 2.332 2.186 2.407 . 0 0 "[ . 1 . 2]" 1
8 1 11 ARG HA 1 12 VAL HB . . 5.500 5.544 5.500 5.599 0.099 20 0 "[ . 1 . 2]" 1
9 1 11 ARG HA 1 12 VAL MG1 . . 4.970 4.233 3.307 4.464 . 0 0 "[ . 1 . 2]" 1
10 1 11 ARG HA 1 12 VAL QG . . 4.060 3.055 2.865 3.202 . 0 0 "[ . 1 . 2]" 1
11 1 11 ARG HA 1 12 VAL MG2 . . 4.970 3.180 2.906 4.281 . 0 0 "[ . 1 . 2]" 1
12 1 11 ARG QB 1 12 VAL H . . 4.330 2.940 2.419 3.582 . 0 0 "[ . 1 . 2]" 1
13 1 12 VAL H 1 12 VAL HB . . 3.800 3.711 3.548 3.812 0.012 20 0 "[ . 1 . 2]" 1
14 1 12 VAL H 1 12 VAL MG1 . . 4.110 3.541 2.551 3.677 . 0 0 "[ . 1 . 2]" 1
15 1 12 VAL H 1 12 VAL QG . . 3.540 2.089 1.849 2.287 . 0 0 "[ . 1 . 2]" 1
16 1 12 VAL H 1 12 VAL MG2 . . 4.110 2.114 1.856 2.451 . 0 0 "[ . 1 . 2]" 1
17 1 12 VAL H 1 13 GLU H . . 5.060 3.731 1.793 4.444 . 0 0 "[ . 1 . 2]" 1
18 1 12 VAL HA 1 12 VAL MG1 . . 3.530 2.098 1.980 2.490 . 0 0 "[ . 1 . 2]" 1
19 1 12 VAL HA 1 12 VAL MG2 . . 3.530 3.122 3.081 3.158 . 0 0 "[ . 1 . 2]" 1
20 1 12 VAL HA 1 13 GLU H . . 3.410 2.402 2.142 3.445 0.035 9 0 "[ . 1 . 2]" 1
21 1 12 VAL HA 1 13 GLU QB . . 4.560 4.148 3.872 4.501 . 0 0 "[ . 1 . 2]" 1
22 1 12 VAL HB 1 13 GLU H . . 5.170 3.446 2.696 4.329 . 0 0 "[ . 1 . 2]" 1
23 1 12 VAL HB 1 14 THR HB . . 5.500 4.318 3.105 5.448 . 0 0 "[ . 1 . 2]" 1
24 1 12 VAL HB 1 14 THR MG . . 4.360 2.978 2.064 4.360 0.000 20 0 "[ . 1 . 2]" 1
25 1 12 VAL QG 1 13 GLU H . . 3.610 3.203 2.229 3.627 0.017 6 0 "[ . 1 . 2]" 1
26 1 12 VAL QG 1 13 GLU HA . . 5.440 4.315 3.398 4.591 . 0 0 "[ . 1 . 2]" 1
27 1 12 VAL QG 1 14 THR MG . . 4.860 3.044 2.195 3.841 . 0 0 "[ . 1 . 2]" 1
28 1 12 VAL MG1 1 13 GLU H . . 5.130 3.609 3.036 4.371 . 0 0 "[ . 1 . 2]" 1
29 1 12 VAL MG2 1 13 GLU H . . 5.130 3.971 2.245 4.391 . 0 0 "[ . 1 . 2]" 1
30 1 13 GLU H 1 13 GLU QB . . 3.670 2.458 2.219 3.137 . 0 0 "[ . 1 . 2]" 1
31 1 13 GLU H 1 13 GLU QG . . 4.300 3.589 2.567 4.117 . 0 0 "[ . 1 . 2]" 1
32 1 13 GLU HA 1 13 GLU QG . . 3.500 2.372 2.003 2.621 . 0 0 "[ . 1 . 2]" 1
33 1 13 GLU HA 1 14 THR MG . . 4.610 3.893 3.443 4.248 . 0 0 "[ . 1 . 2]" 1
34 1 13 GLU HA 1 62 THR MG . . 3.620 3.152 2.383 3.626 0.006 14 0 "[ . 1 . 2]" 1
35 1 13 GLU QB 1 62 THR MG . . 3.830 3.259 2.231 3.839 0.009 16 0 "[ . 1 . 2]" 1
36 1 13 GLU QB 1 66 GLN HE21 . . 4.950 4.691 3.827 4.955 0.005 2 0 "[ . 1 . 2]" 1
37 1 13 GLU QB 1 66 GLN HE22 . . 4.810 4.181 2.995 4.823 0.013 3 0 "[ . 1 . 2]" 1
38 1 13 GLU QG 1 62 THR HB . . 5.030 4.283 3.363 5.038 0.008 14 0 "[ . 1 . 2]" 1
39 1 13 GLU QG 1 62 THR MG . . 3.520 2.240 1.771 2.997 . 0 0 "[ . 1 . 2]" 1
40 1 13 GLU QG 1 66 GLN HE21 . . 4.460 3.862 2.846 4.435 . 0 0 "[ . 1 . 2]" 1
41 1 13 GLU QG 1 66 GLN HE22 . . 4.480 3.494 2.099 4.484 0.004 17 0 "[ . 1 . 2]" 1
42 1 14 THR H 1 14 THR MG . . 4.630 2.256 1.952 2.749 . 0 0 "[ . 1 . 2]" 1
43 1 14 THR H 1 15 ARG HA . . 5.500 5.546 5.449 5.685 0.185 1 0 "[ . 1 . 2]" 1
44 1 14 THR HA 1 14 THR MG . . 3.290 3.000 2.491 3.203 . 0 0 "[ . 1 . 2]" 1
45 1 14 THR HA 1 62 THR HB . . 5.500 5.109 4.769 5.503 0.003 2 0 "[ . 1 . 2]" 1
46 1 14 THR HB 1 15 ARG H . . 4.310 3.408 2.117 4.312 0.002 16 0 "[ . 1 . 2]" 1
47 1 14 THR MG 1 15 ARG H . . 4.600 3.690 2.839 4.308 . 0 0 "[ . 1 . 2]" 1
48 1 14 THR MG 1 62 THR HB . . 5.500 5.206 4.231 5.502 0.002 10 0 "[ . 1 . 2]" 1
49 1 15 ARG H 1 15 ARG HG2 . . 5.010 3.753 2.297 4.959 . 0 0 "[ . 1 . 2]" 1
50 1 15 ARG H 1 15 ARG QG . . 4.370 3.063 2.156 3.886 . 0 0 "[ . 1 . 2]" 1
51 1 15 ARG H 1 15 ARG HG3 . . 5.010 3.550 2.190 4.887 . 0 0 "[ . 1 . 2]" 1
52 1 15 ARG HA 1 15 ARG QD . . 4.840 3.672 2.576 4.124 . 0 0 "[ . 1 . 2]" 1
53 1 15 ARG HA 1 15 ARG QG . . 3.570 2.459 2.029 3.386 . 0 0 "[ . 1 . 2]" 1
54 1 15 ARG HA 1 16 ARG H . . 3.520 2.548 2.281 2.972 . 0 0 "[ . 1 . 2]" 1
55 1 15 ARG HA 1 16 ARG HD2 . . 5.110 3.417 2.303 4.101 . 0 0 "[ . 1 . 2]" 1
56 1 15 ARG HA 1 16 ARG QD . . 4.490 3.290 2.290 3.867 . 0 0 "[ . 1 . 2]" 1
57 1 15 ARG HA 1 16 ARG HD3 . . 5.110 4.353 4.018 4.734 . 0 0 "[ . 1 . 2]" 1
58 1 15 ARG HA 1 16 ARG QG . . 4.250 3.447 3.184 3.614 . 0 0 "[ . 1 . 2]" 1
59 1 15 ARG HA 1 62 THR MG . . 5.260 5.063 4.763 5.275 0.015 4 0 "[ . 1 . 2]" 1
60 1 15 ARG QB 1 15 ARG QD . . 3.130 2.142 1.941 2.388 . 0 0 "[ . 1 . 2]" 1
61 1 15 ARG QD 1 17 VAL MG2 . . 4.690 3.780 2.776 4.686 . 0 0 "[ . 1 . 2]" 1
62 1 15 ARG HD2 1 17 VAL MG2 . . 5.500 4.367 2.828 5.230 . 0 0 "[ . 1 . 2]" 1
63 1 15 ARG HD3 1 17 VAL MG2 . . 5.500 4.369 3.028 5.489 . 0 0 "[ . 1 . 2]" 1
64 1 15 ARG QG 1 16 ARG H . . 4.820 3.077 1.974 4.103 . 0 0 "[ . 1 . 2]" 1
65 1 16 ARG H 1 16 ARG HG2 . . 5.160 3.999 3.598 4.390 . 0 0 "[ . 1 . 2]" 1
66 1 16 ARG H 1 16 ARG QG . . 4.320 2.914 2.357 3.341 . 0 0 "[ . 1 . 2]" 1
67 1 16 ARG H 1 16 ARG HG3 . . 5.160 2.996 2.389 3.463 . 0 0 "[ . 1 . 2]" 1
68 1 16 ARG HA 1 16 ARG HG2 . . 4.120 3.818 3.763 3.924 . 0 0 "[ . 1 . 2]" 1
69 1 16 ARG HA 1 16 ARG QG . . 3.510 2.755 2.654 2.938 . 0 0 "[ . 1 . 2]" 1
70 1 16 ARG HA 1 16 ARG HG3 . . 4.120 2.826 2.713 3.034 . 0 0 "[ . 1 . 2]" 1
71 1 16 ARG HA 1 59 MET H . . 5.260 4.471 4.366 4.748 . 0 0 "[ . 1 . 2]" 1
72 1 16 ARG HA 1 62 THR H . . 5.500 5.365 5.137 5.509 0.009 2 0 "[ . 1 . 2]" 1
73 1 16 ARG HA 1 62 THR HA . . 3.770 3.379 3.191 3.561 . 0 0 "[ . 1 . 2]" 1
74 1 16 ARG HA 1 62 THR HB . . 4.090 3.951 3.638 4.101 0.011 18 0 "[ . 1 . 2]" 1
75 1 16 ARG HA 1 65 ALA H . . 5.500 5.397 5.235 5.514 0.014 5 0 "[ . 1 . 2]" 1
76 1 16 ARG HA 1 65 ALA MB . . 3.190 3.027 2.834 3.194 0.004 19 0 "[ . 1 . 2]" 1
77 1 16 ARG HA 1 88 LEU MD1 . . 4.590 2.959 2.805 3.118 . 0 0 "[ . 1 . 2]" 1
78 1 16 ARG HB2 1 16 ARG HD2 . . 3.840 2.309 2.130 3.235 . 0 0 "[ . 1 . 2]" 1
79 1 16 ARG HB2 1 16 ARG HD3 . . 3.840 2.945 2.185 3.113 . 0 0 "[ . 1 . 2]" 1
80 1 16 ARG HB2 1 58 GLU HG3 . . 3.540 3.079 2.603 3.529 . 0 0 "[ . 1 . 2]" 1
81 1 16 ARG HB2 1 59 MET H . . 4.000 2.005 1.898 2.197 . 0 0 "[ . 1 . 2]" 1
82 1 16 ARG HB2 1 62 THR HA . . 4.990 3.916 3.582 4.071 . 0 0 "[ . 1 . 2]" 1
83 1 16 ARG HB2 1 65 ALA MB . . 3.770 3.208 2.848 3.346 . 0 0 "[ . 1 . 2]" 1
84 1 16 ARG HB3 1 16 ARG HD2 . . 3.930 3.526 3.456 3.946 0.016 18 0 "[ . 1 . 2]" 1
85 1 16 ARG HB3 1 16 ARG HD3 . . 3.930 3.866 3.500 3.941 0.011 4 0 "[ . 1 . 2]" 1
86 1 16 ARG HB3 1 58 GLU HA . . 5.250 4.497 4.292 5.011 . 0 0 "[ . 1 . 2]" 1
87 1 16 ARG HB3 1 59 MET H . . 3.620 2.988 2.763 3.575 . 0 0 "[ . 1 . 2]" 1
88 1 16 ARG HB3 1 62 THR HA . . 4.460 2.490 2.026 2.764 . 0 0 "[ . 1 . 2]" 1
89 1 16 ARG HB3 1 62 THR HB . . 5.470 4.200 3.704 4.474 . 0 0 "[ . 1 . 2]" 1
90 1 16 ARG HB3 1 65 ALA MB . . 3.390 2.033 1.931 2.285 . 0 0 "[ . 1 . 2]" 1
91 1 16 ARG QD 1 59 MET H . . 4.490 3.614 3.322 3.888 . 0 0 "[ . 1 . 2]" 1
92 1 16 ARG QD 1 60 ALA HA . . 4.730 3.578 3.180 4.104 . 0 0 "[ . 1 . 2]" 1
93 1 16 ARG QD 1 61 THR HA . . 4.390 3.418 3.030 4.378 . 0 0 "[ . 1 . 2]" 1
94 1 16 ARG QD 1 62 THR H . . 4.260 3.666 3.391 4.072 . 0 0 "[ . 1 . 2]" 1
95 1 16 ARG QD 1 62 THR HA . . 5.340 4.103 3.928 4.393 . 0 0 "[ . 1 . 2]" 1
96 1 16 ARG HD2 1 59 MET H . . 5.180 3.943 3.512 4.874 . 0 0 "[ . 1 . 2]" 1
97 1 16 ARG HD2 1 60 ALA HA . . 5.420 4.942 4.430 5.428 0.008 18 0 "[ . 1 . 2]" 1
98 1 16 ARG HD3 1 59 MET H . . 5.180 4.330 3.381 4.534 . 0 0 "[ . 1 . 2]" 1
99 1 16 ARG HD3 1 60 ALA HA . . 5.420 3.676 3.259 4.248 . 0 0 "[ . 1 . 2]" 1
100 1 16 ARG QG 1 62 THR HA . . 4.020 2.068 1.872 2.382 . 0 0 "[ . 1 . 2]" 1
101 1 16 ARG QG 1 62 THR MG . . 4.190 3.387 3.126 3.529 . 0 0 "[ . 1 . 2]" 1
102 1 16 ARG HG2 1 62 THR H . . 4.890 2.572 2.419 2.710 . 0 0 "[ . 1 . 2]" 1
103 1 16 ARG HG2 1 62 THR HB . . 4.530 3.535 3.225 3.784 . 0 0 "[ . 1 . 2]" 1
104 1 16 ARG HG3 1 62 THR H . . 4.890 2.781 2.574 2.987 . 0 0 "[ . 1 . 2]" 1
105 1 16 ARG HG3 1 62 THR HB . . 4.530 2.317 2.193 2.485 . 0 0 "[ . 1 . 2]" 1
106 1 17 VAL HA 1 17 VAL MG1 . . 3.180 2.392 2.296 2.483 . 0 0 "[ . 1 . 2]" 1
107 1 17 VAL HA 1 17 VAL MG2 . . 2.910 2.346 2.233 2.412 . 0 0 "[ . 1 . 2]" 1
108 1 17 VAL HA 1 18 VAL H . . 3.480 2.196 2.143 2.242 . 0 0 "[ . 1 . 2]" 1
109 1 17 VAL HA 1 18 VAL HB . . 5.270 5.007 4.881 5.091 . 0 0 "[ . 1 . 2]" 1
110 1 17 VAL HA 1 18 VAL MG1 . . 4.060 3.587 3.532 3.643 . 0 0 "[ . 1 . 2]" 1
111 1 17 VAL HA 1 57 ILE H . . 4.690 4.427 4.241 4.664 . 0 0 "[ . 1 . 2]" 1
112 1 17 VAL HA 1 59 MET H . . 4.830 4.174 3.992 4.279 . 0 0 "[ . 1 . 2]" 1
113 1 17 VAL HB 1 18 VAL H . . 4.730 4.442 4.296 4.494 . 0 0 "[ . 1 . 2]" 1
114 1 17 VAL HB 1 89 SER H . . 4.730 4.065 3.758 4.362 . 0 0 "[ . 1 . 2]" 1
115 1 17 VAL HB 1 89 SER QB . . 4.230 2.849 1.992 3.528 . 0 0 "[ . 1 . 2]" 1
116 1 17 VAL MG1 1 18 VAL H . . 3.750 3.234 2.695 3.423 . 0 0 "[ . 1 . 2]" 1
117 1 17 VAL MG1 1 18 VAL HA . . 4.780 3.969 3.779 4.110 . 0 0 "[ . 1 . 2]" 1
118 1 17 VAL MG1 1 19 HIS H . . 3.900 3.739 3.527 3.880 . 0 0 "[ . 1 . 2]" 1
119 1 17 VAL MG1 1 19 HIS HA . . 4.330 3.941 3.747 4.114 . 0 0 "[ . 1 . 2]" 1
120 1 17 VAL MG1 1 19 HIS HB2 . . 5.120 3.462 3.337 3.645 . 0 0 "[ . 1 . 2]" 1
121 1 17 VAL MG1 1 56 PHE H . . 5.500 5.451 5.295 5.509 0.009 14 0 "[ . 1 . 2]" 1
122 1 17 VAL MG1 1 56 PHE HA . . 4.550 3.756 3.589 3.955 . 0 0 "[ . 1 . 2]" 1
123 1 17 VAL MG1 1 56 PHE QB . . 3.200 2.147 1.957 2.254 . 0 0 "[ . 1 . 2]" 1
124 1 17 VAL MG1 1 56 PHE QD . . 3.280 2.934 2.599 3.274 . 0 0 "[ . 1 . 2]" 1
125 1 17 VAL MG1 1 57 ILE H . . 4.160 3.941 3.739 4.152 . 0 0 "[ . 1 . 2]" 1
126 1 17 VAL MG1 1 58 GLU HA . . 4.450 4.399 4.247 4.456 0.006 9 0 "[ . 1 . 2]" 1
127 1 17 VAL MG1 1 58 GLU HB2 . . 4.950 4.445 4.237 4.662 . 0 0 "[ . 1 . 2]" 1
128 1 17 VAL MG1 1 58 GLU HG3 . . 5.480 5.186 4.805 5.480 . 0 0 "[ . 1 . 2]" 1
129 1 17 VAL MG1 1 89 SER H . . 4.040 3.446 3.253 3.733 . 0 0 "[ . 1 . 2]" 1
130 1 17 VAL MG1 1 89 SER QB . . 3.710 2.064 1.801 2.414 . 0 0 "[ . 1 . 2]" 1
131 1 17 VAL MG1 1 92 TYR HB2 . . 5.040 3.027 1.967 4.488 . 0 0 "[ . 1 . 2]" 1
132 1 17 VAL MG1 1 92 TYR HB3 . . 5.040 3.890 2.179 5.043 0.003 8 0 "[ . 1 . 2]" 1
133 1 17 VAL MG1 1 92 TYR QD . . 4.310 3.285 2.508 3.708 . 0 0 "[ . 1 . 2]" 1
134 1 17 VAL MG2 1 58 GLU H . . 5.270 5.260 5.173 5.279 0.009 12 0 "[ . 1 . 2]" 1
135 1 17 VAL MG2 1 58 GLU HA . . 4.450 3.568 3.387 3.671 . 0 0 "[ . 1 . 2]" 1
136 1 17 VAL MG2 1 58 GLU HB2 . . 3.510 3.413 3.319 3.513 0.003 8 0 "[ . 1 . 2]" 1
137 1 17 VAL MG2 1 58 GLU HG2 . . 4.660 4.517 4.285 4.668 0.008 14 0 "[ . 1 . 2]" 1
138 1 17 VAL MG2 1 58 GLU HG3 . . 4.380 3.275 2.851 3.723 . 0 0 "[ . 1 . 2]" 1
139 1 17 VAL MG2 1 59 MET H . . 4.800 4.769 4.652 4.810 0.010 2 0 "[ . 1 . 2]" 1
140 1 17 VAL MG2 1 89 SER QB . . 4.470 3.895 3.304 4.338 . 0 0 "[ . 1 . 2]" 1
141 1 17 VAL MG2 1 91 LYS HA . . 3.990 3.867 2.144 3.995 0.005 4 0 "[ . 1 . 2]" 1
142 1 17 VAL MG2 1 92 TYR QB . . 4.160 2.747 1.820 3.818 . 0 0 "[ . 1 . 2]" 1
143 1 17 VAL MG2 1 92 TYR QD . . 4.380 3.990 3.358 4.380 0.000 9 0 "[ . 1 . 2]" 1
144 1 18 VAL H 1 18 VAL HB . . 3.750 3.040 2.955 3.198 . 0 0 "[ . 1 . 2]" 1
145 1 18 VAL H 1 18 VAL MG1 . . 3.460 1.887 1.838 1.960 . 0 0 "[ . 1 . 2]" 1
146 1 18 VAL H 1 18 VAL MG2 . . 3.950 3.706 3.690 3.740 . 0 0 "[ . 1 . 2]" 1
147 1 18 VAL H 1 37 VAL MG1 . . 5.500 4.879 4.679 5.149 . 0 0 "[ . 1 . 2]" 1
148 1 18 VAL H 1 56 PHE HA . . 4.750 4.534 4.191 4.749 . 0 0 "[ . 1 . 2]" 1
149 1 18 VAL H 1 57 ILE H . . 4.240 3.180 2.994 3.403 . 0 0 "[ . 1 . 2]" 1
150 1 18 VAL H 1 57 ILE HB . . 4.630 3.847 3.736 3.968 . 0 0 "[ . 1 . 2]" 1
151 1 18 VAL H 1 57 ILE MG . . 4.920 4.247 4.120 4.414 . 0 0 "[ . 1 . 2]" 1
152 1 18 VAL H 1 59 MET H . . 4.720 4.534 4.312 4.687 . 0 0 "[ . 1 . 2]" 1
153 1 18 VAL H 1 88 LEU MD2 . . 4.550 3.956 3.710 4.465 . 0 0 "[ . 1 . 2]" 1
154 1 18 VAL HA 1 18 VAL MG1 . . 3.390 3.169 3.162 3.178 . 0 0 "[ . 1 . 2]" 1
155 1 18 VAL HA 1 18 VAL MG2 . . 3.230 2.523 2.484 2.547 . 0 0 "[ . 1 . 2]" 1
156 1 18 VAL HA 1 19 HIS H . . 3.370 2.157 2.144 2.176 . 0 0 "[ . 1 . 2]" 1
157 1 18 VAL HA 1 19 HIS HA . . 4.810 4.418 4.402 4.436 . 0 0 "[ . 1 . 2]" 1
158 1 18 VAL HA 1 19 HIS HB2 . . 5.010 4.727 4.615 4.810 . 0 0 "[ . 1 . 2]" 1
159 1 18 VAL HA 1 19 HIS HB3 . . 4.880 4.559 4.491 4.657 . 0 0 "[ . 1 . 2]" 1
160 1 18 VAL HA 1 20 ILE MD . . 5.330 5.069 4.850 5.300 . 0 0 "[ . 1 . 2]" 1
161 1 18 VAL HA 1 69 VAL MG2 . . 5.060 3.819 3.574 3.967 . 0 0 "[ . 1 . 2]" 1
162 1 18 VAL HA 1 87 HIS H . . 4.930 4.646 4.356 4.867 . 0 0 "[ . 1 . 2]" 1
163 1 18 VAL HA 1 88 LEU HA . . 4.150 2.375 2.204 2.660 . 0 0 "[ . 1 . 2]" 1
164 1 18 VAL HA 1 88 LEU MD2 . . 4.050 2.620 2.294 2.917 . 0 0 "[ . 1 . 2]" 1
165 1 18 VAL HA 1 89 SER H . . 4.280 2.914 2.634 3.213 . 0 0 "[ . 1 . 2]" 1
166 1 18 VAL HB 1 37 VAL MG1 . . 4.130 3.641 3.413 3.927 . 0 0 "[ . 1 . 2]" 1
167 1 18 VAL HB 1 57 ILE H . . 4.980 4.890 4.769 4.975 . 0 0 "[ . 1 . 2]" 1
168 1 18 VAL HB 1 57 ILE HB . . 4.590 4.523 4.482 4.588 . 0 0 "[ . 1 . 2]" 1
169 1 18 VAL HB 1 57 ILE MG . . 5.130 4.920 4.659 5.097 . 0 0 "[ . 1 . 2]" 1
170 1 18 VAL MG1 1 19 HIS H . . 4.470 4.273 4.242 4.294 . 0 0 "[ . 1 . 2]" 1
171 1 18 VAL MG1 1 56 PHE HA . . 4.530 3.769 3.647 3.941 . 0 0 "[ . 1 . 2]" 1
172 1 18 VAL MG1 1 57 ILE H . . 3.600 2.072 1.954 2.211 . 0 0 "[ . 1 . 2]" 1
173 1 18 VAL MG1 1 57 ILE HB . . 3.140 1.820 1.792 1.866 . 0 0 "[ . 1 . 2]" 1
174 1 18 VAL MG1 1 58 GLU HA . . 4.480 3.818 3.727 3.935 . 0 0 "[ . 1 . 2]" 1
175 1 18 VAL MG1 1 59 MET H . . 4.340 4.080 3.912 4.255 . 0 0 "[ . 1 . 2]" 1
176 1 18 VAL MG1 1 59 MET HB2 . . 5.500 4.885 4.657 5.091 . 0 0 "[ . 1 . 2]" 1
177 1 18 VAL MG1 1 59 MET HG2 . . 3.620 2.896 2.736 3.017 . 0 0 "[ . 1 . 2]" 1
178 1 18 VAL MG1 1 59 MET HG3 . . 3.920 3.842 3.719 3.928 0.008 4 0 "[ . 1 . 2]" 1
179 1 18 VAL MG1 1 65 ALA H . . 5.190 5.172 5.028 5.199 0.009 18 0 "[ . 1 . 2]" 1
180 1 18 VAL MG1 1 65 ALA HA . . 3.670 3.497 3.329 3.608 . 0 0 "[ . 1 . 2]" 1
181 1 18 VAL MG1 1 65 ALA MB . . 3.130 2.834 2.582 3.038 . 0 0 "[ . 1 . 2]" 1
182 1 18 VAL MG1 1 68 ALA MB . . 3.780 3.713 3.649 3.787 0.007 9 0 "[ . 1 . 2]" 1
183 1 18 VAL MG2 1 19 HIS H . . 3.520 3.097 2.978 3.222 . 0 0 "[ . 1 . 2]" 1
184 1 18 VAL MG2 1 19 HIS HA . . 4.420 3.842 3.771 3.945 . 0 0 "[ . 1 . 2]" 1
185 1 18 VAL MG2 1 20 ILE H . . 4.750 4.243 4.050 4.395 . 0 0 "[ . 1 . 2]" 1
186 1 18 VAL MG2 1 20 ILE HA . . 4.500 4.253 4.152 4.386 . 0 0 "[ . 1 . 2]" 1
187 1 18 VAL MG2 1 20 ILE HG13 . . 2.960 2.240 2.122 2.368 . 0 0 "[ . 1 . 2]" 1
188 1 18 VAL MG2 1 37 VAL MG1 . . 3.020 2.773 2.653 2.966 . 0 0 "[ . 1 . 2]" 1
189 1 18 VAL MG2 1 56 PHE HA . . 5.100 4.327 4.068 4.532 . 0 0 "[ . 1 . 2]" 1
190 1 18 VAL MG2 1 57 ILE H . . 4.030 3.643 3.447 3.826 . 0 0 "[ . 1 . 2]" 1
191 1 18 VAL MG2 1 68 ALA MB . . 3.370 3.128 2.947 3.299 . 0 0 "[ . 1 . 2]" 1
192 1 18 VAL MG2 1 87 HIS H . . 4.290 3.354 3.082 3.577 . 0 0 "[ . 1 . 2]" 1
193 1 19 HIS H 1 19 HIS HB2 . . 4.060 2.780 2.647 2.884 . 0 0 "[ . 1 . 2]" 1
194 1 19 HIS H 1 19 HIS HB3 . . 3.940 2.421 2.357 2.520 . 0 0 "[ . 1 . 2]" 1
195 1 19 HIS H 1 20 ILE H . . 4.690 4.542 4.493 4.570 . 0 0 "[ . 1 . 2]" 1
196 1 19 HIS H 1 20 ILE HA . . 5.500 5.310 5.230 5.352 . 0 0 "[ . 1 . 2]" 1
197 1 19 HIS H 1 20 ILE HG13 . . 4.970 4.358 4.289 4.445 . 0 0 "[ . 1 . 2]" 1
198 1 19 HIS H 1 21 MET ME . . 5.080 4.315 4.150 4.493 . 0 0 "[ . 1 . 2]" 1
199 1 19 HIS H 1 87 HIS H . . 4.100 3.546 3.255 3.762 . 0 0 "[ . 1 . 2]" 1
200 1 19 HIS H 1 87 HIS HA . . 5.500 5.002 4.841 5.177 . 0 0 "[ . 1 . 2]" 1
201 1 19 HIS H 1 88 LEU H . . 5.500 4.683 4.493 4.961 . 0 0 "[ . 1 . 2]" 1
202 1 19 HIS H 1 88 LEU HA . . 4.750 3.210 2.838 3.487 . 0 0 "[ . 1 . 2]" 1
203 1 19 HIS H 1 88 LEU MD1 . . 5.480 4.869 4.190 5.367 . 0 0 "[ . 1 . 2]" 1
204 1 19 HIS H 1 88 LEU MD2 . . 5.500 4.148 3.840 4.423 . 0 0 "[ . 1 . 2]" 1
205 1 19 HIS H 1 89 SER H . . 5.130 2.420 2.093 2.888 . 0 0 "[ . 1 . 2]" 1
206 1 19 HIS H 1 89 SER QB . . 5.090 3.107 2.695 3.521 . 0 0 "[ . 1 . 2]" 1
207 1 19 HIS HA 1 19 HIS HD2 . . 3.700 2.525 2.388 2.628 . 0 0 "[ . 1 . 2]" 1
208 1 19 HIS HA 1 20 ILE H . . 3.260 2.174 2.151 2.212 . 0 0 "[ . 1 . 2]" 1
209 1 19 HIS HA 1 20 ILE HB . . 4.800 4.694 4.624 4.738 . 0 0 "[ . 1 . 2]" 1
210 1 19 HIS HA 1 20 ILE MD . . 4.300 3.955 3.641 4.268 . 0 0 "[ . 1 . 2]" 1
211 1 19 HIS HA 1 20 ILE HG12 . . 5.500 5.326 5.175 5.490 . 0 0 "[ . 1 . 2]" 1
212 1 19 HIS HA 1 20 ILE HG13 . . 4.230 3.593 3.431 3.797 . 0 0 "[ . 1 . 2]" 1
213 1 19 HIS HA 1 55 ALA H . . 5.150 4.692 4.389 4.954 . 0 0 "[ . 1 . 2]" 1
214 1 19 HIS HA 1 56 PHE QD . . 4.060 2.263 2.037 2.539 . 0 0 "[ . 1 . 2]" 1
215 1 19 HIS HA 1 56 PHE QE . . 4.560 3.736 3.526 4.022 . 0 0 "[ . 1 . 2]" 1
216 1 19 HIS HA 1 87 HIS H . . 5.500 4.888 4.687 5.061 . 0 0 "[ . 1 . 2]" 1
217 1 19 HIS HB2 1 20 ILE H . . 4.670 4.114 4.017 4.218 . 0 0 "[ . 1 . 2]" 1
218 1 19 HIS HB2 1 56 PHE QD . . 3.910 2.210 1.991 2.736 . 0 0 "[ . 1 . 2]" 1
219 1 19 HIS HB2 1 56 PHE QE . . 3.980 2.756 2.339 3.471 . 0 0 "[ . 1 . 2]" 1
220 1 19 HIS HB2 1 87 HIS H . . 5.330 5.103 4.844 5.336 0.006 6 0 "[ . 1 . 2]" 1
221 1 19 HIS HB2 1 89 SER H . . 5.440 3.634 3.226 4.315 . 0 0 "[ . 1 . 2]" 1
222 1 19 HIS HB2 1 89 SER QB . . 4.040 2.426 1.966 3.232 . 0 0 "[ . 1 . 2]" 1
223 1 19 HIS HB3 1 20 ILE H . . 4.820 4.162 4.035 4.292 . 0 0 "[ . 1 . 2]" 1
224 1 19 HIS HB3 1 87 HIS H . . 4.270 3.557 3.253 3.803 . 0 0 "[ . 1 . 2]" 1
225 1 19 HIS HB3 1 87 HIS HB2 . . 4.630 2.627 2.346 2.986 . 0 0 "[ . 1 . 2]" 1
226 1 19 HIS HB3 1 87 HIS QB . . 3.980 2.596 2.327 2.934 . 0 0 "[ . 1 . 2]" 1
227 1 19 HIS HB3 1 87 HIS HB3 . . 4.630 4.100 3.827 4.485 . 0 0 "[ . 1 . 2]" 1
228 1 19 HIS HB3 1 89 SER H . . 5.500 3.540 3.029 4.052 . 0 0 "[ . 1 . 2]" 1
229 1 19 HIS HB3 1 89 SER QB . . 4.270 3.172 2.286 3.955 . 0 0 "[ . 1 . 2]" 1
230 1 19 HIS HD2 1 20 ILE H . . 3.770 2.001 1.901 2.244 . 0 0 "[ . 1 . 2]" 1
231 1 19 HIS HD2 1 20 ILE HA . . 5.250 4.336 4.023 4.583 . 0 0 "[ . 1 . 2]" 1
232 1 19 HIS HD2 1 20 ILE HB . . 5.150 4.536 4.339 4.792 . 0 0 "[ . 1 . 2]" 1
233 1 19 HIS HD2 1 20 ILE HG13 . . 5.500 4.782 4.591 5.031 . 0 0 "[ . 1 . 2]" 1
234 1 19 HIS HD2 1 21 MET ME . . 5.040 3.542 3.230 3.895 . 0 0 "[ . 1 . 2]" 1
235 1 19 HIS HD2 1 21 MET HG2 . . 5.360 4.304 3.959 4.525 . 0 0 "[ . 1 . 2]" 1
236 1 19 HIS HD2 1 21 MET HG3 . . 4.430 3.334 2.916 3.621 . 0 0 "[ . 1 . 2]" 1
237 1 19 HIS HD2 1 54 GLU HA . . 5.500 3.940 3.593 4.158 . 0 0 "[ . 1 . 2]" 1
238 1 19 HIS HD2 1 54 GLU HB3 . . 4.910 4.035 3.663 4.563 . 0 0 "[ . 1 . 2]" 1
239 1 19 HIS HD2 1 55 ALA H . . 4.170 2.884 2.504 3.224 . 0 0 "[ . 1 . 2]" 1
240 1 19 HIS HD2 1 56 PHE QE . . 4.730 2.830 2.596 3.139 . 0 0 "[ . 1 . 2]" 1
241 1 19 HIS HE1 1 21 MET ME . . 4.090 3.332 2.926 3.676 . 0 0 "[ . 1 . 2]" 1
242 1 19 HIS HE1 1 21 MET HG2 . . 5.090 2.344 2.112 2.655 . 0 0 "[ . 1 . 2]" 1
243 1 19 HIS HE1 1 21 MET HG3 . . 5.130 3.257 2.914 3.659 . 0 0 "[ . 1 . 2]" 1
244 1 19 HIS HE1 1 56 PHE QE . . 4.940 4.026 3.648 4.404 . 0 0 "[ . 1 . 2]" 1
245 1 19 HIS HE1 1 56 PHE HZ . . 5.310 4.827 4.391 5.259 . 0 0 "[ . 1 . 2]" 1
246 1 20 ILE H 1 20 ILE HB . . 3.860 2.804 2.720 2.865 . 0 0 "[ . 1 . 2]" 1
247 1 20 ILE H 1 20 ILE MD . . 3.790 3.229 2.889 3.535 . 0 0 "[ . 1 . 2]" 1
248 1 20 ILE H 1 20 ILE HG12 . . 4.550 4.273 4.174 4.422 . 0 0 "[ . 1 . 2]" 1
249 1 20 ILE H 1 20 ILE HG13 . . 4.170 2.867 2.732 3.068 . 0 0 "[ . 1 . 2]" 1
250 1 20 ILE H 1 20 ILE MG . . 4.120 3.920 3.886 3.942 . 0 0 "[ . 1 . 2]" 1
251 1 20 ILE H 1 21 MET H . . 5.100 4.312 4.220 4.384 . 0 0 "[ . 1 . 2]" 1
252 1 20 ILE H 1 21 MET ME . . 4.040 3.446 3.238 3.609 . 0 0 "[ . 1 . 2]" 1
253 1 20 ILE H 1 21 MET HG3 . . 5.470 3.722 3.581 3.898 . 0 0 "[ . 1 . 2]" 1
254 1 20 ILE H 1 55 ALA H . . 4.060 3.093 2.962 3.255 . 0 0 "[ . 1 . 2]" 1
255 1 20 ILE H 1 55 ALA MB . . 4.260 3.697 3.417 3.833 . 0 0 "[ . 1 . 2]" 1
256 1 20 ILE H 1 56 PHE QD . . 5.290 3.896 3.636 4.196 . 0 0 "[ . 1 . 2]" 1
257 1 20 ILE H 1 57 ILE H . . 5.500 4.908 4.722 5.099 . 0 0 "[ . 1 . 2]" 1
258 1 20 ILE HA 1 20 ILE MD . . 4.010 3.877 3.805 3.934 . 0 0 "[ . 1 . 2]" 1
259 1 20 ILE HA 1 20 ILE HG12 . . 3.760 3.103 2.975 3.200 . 0 0 "[ . 1 . 2]" 1
260 1 20 ILE HA 1 20 ILE HG13 . . 3.970 2.648 2.537 2.776 . 0 0 "[ . 1 . 2]" 1
261 1 20 ILE HA 1 20 ILE MG . . 3.240 2.323 2.258 2.402 . 0 0 "[ . 1 . 2]" 1
262 1 20 ILE HA 1 21 MET H . . 3.070 2.157 2.145 2.168 . 0 0 "[ . 1 . 2]" 1
263 1 20 ILE HA 1 21 MET HB2 . . 5.360 4.932 4.860 5.011 . 0 0 "[ . 1 . 2]" 1
264 1 20 ILE HA 1 21 MET ME . . 4.010 2.203 1.963 2.481 . 0 0 "[ . 1 . 2]" 1
265 1 20 ILE HA 1 21 MET HG3 . . 4.790 3.467 3.414 3.508 . 0 0 "[ . 1 . 2]" 1
266 1 20 ILE HA 1 33 LEU MD2 . . 5.420 5.062 4.904 5.251 . 0 0 "[ . 1 . 2]" 1
267 1 20 ILE HA 1 85 ARG H . . 4.620 4.523 4.370 4.623 0.003 16 0 "[ . 1 . 2]" 1
268 1 20 ILE HA 1 86 VAL H . . 5.500 5.002 4.816 5.171 . 0 0 "[ . 1 . 2]" 1
269 1 20 ILE HA 1 86 VAL HA . . 3.850 2.814 2.520 2.956 . 0 0 "[ . 1 . 2]" 1
270 1 20 ILE HA 1 86 VAL MG2 . . 4.070 3.502 3.283 3.746 . 0 0 "[ . 1 . 2]" 1
271 1 20 ILE HA 1 87 HIS H . . 4.420 3.637 3.448 3.921 . 0 0 "[ . 1 . 2]" 1
272 1 20 ILE HB 1 20 ILE MD . . 2.720 2.144 2.030 2.228 . 0 0 "[ . 1 . 2]" 1
273 1 20 ILE HB 1 21 MET H . . 4.960 4.072 4.009 4.145 . 0 0 "[ . 1 . 2]" 1
274 1 20 ILE HB 1 23 PHE QD . . 4.910 3.352 2.887 3.654 . 0 0 "[ . 1 . 2]" 1
275 1 20 ILE HB 1 23 PHE QE . . 4.290 3.719 3.312 3.958 . 0 0 "[ . 1 . 2]" 1
276 1 20 ILE HB 1 33 LEU MD1 . . 5.260 3.620 3.396 4.082 . 0 0 "[ . 1 . 2]" 1
277 1 20 ILE HB 1 33 LEU MD2 . . 3.110 3.003 2.774 3.110 . 0 0 "[ . 1 . 2]" 1
278 1 20 ILE HB 1 55 ALA H . . 3.800 3.723 3.552 3.803 0.003 13 0 "[ . 1 . 2]" 1
279 1 20 ILE HB 1 55 ALA MB . . 3.060 2.814 2.665 2.977 . 0 0 "[ . 1 . 2]" 1
280 1 20 ILE HB 1 84 VAL MG2 . . 5.500 5.126 4.700 5.372 . 0 0 "[ . 1 . 2]" 1
281 1 20 ILE HB 1 86 VAL MG2 . . 5.020 4.741 4.566 4.977 . 0 0 "[ . 1 . 2]" 1
282 1 20 ILE MD 1 20 ILE MG . . 2.830 2.651 2.455 2.775 . 0 0 "[ . 1 . 2]" 1
283 1 20 ILE MD 1 21 MET H . . 5.500 5.268 5.234 5.337 . 0 0 "[ . 1 . 2]" 1
284 1 20 ILE MD 1 23 PHE QD . . 5.050 4.751 4.429 5.031 . 0 0 "[ . 1 . 2]" 1
285 1 20 ILE MD 1 23 PHE QE . . 5.110 4.827 4.438 5.072 . 0 0 "[ . 1 . 2]" 1
286 1 20 ILE MD 1 33 LEU HB3 . . 4.130 2.580 2.342 3.016 . 0 0 "[ . 1 . 2]" 1
287 1 20 ILE MD 1 33 LEU MD1 . . 3.840 3.332 2.954 3.625 . 0 0 "[ . 1 . 2]" 1
288 1 20 ILE MD 1 33 LEU MD2 . . 3.080 2.704 2.102 2.908 . 0 0 "[ . 1 . 2]" 1
289 1 20 ILE MD 1 55 ALA H . . 4.710 4.564 4.443 4.708 . 0 0 "[ . 1 . 2]" 1
290 1 20 ILE MD 1 55 ALA MB . . 3.330 2.858 2.655 3.084 . 0 0 "[ . 1 . 2]" 1
291 1 20 ILE MD 1 56 PHE H . . 4.800 4.488 4.310 4.722 . 0 0 "[ . 1 . 2]" 1
292 1 20 ILE MD 1 56 PHE HA . . 4.500 3.484 3.224 3.860 . 0 0 "[ . 1 . 2]" 1
293 1 20 ILE MD 1 57 ILE H . . 4.130 3.238 3.021 3.552 . 0 0 "[ . 1 . 2]" 1
294 1 20 ILE HG12 1 20 ILE MG . . 3.110 2.117 1.965 2.185 . 0 0 "[ . 1 . 2]" 1
295 1 20 ILE HG12 1 21 MET H . . 4.930 4.826 4.737 4.885 . 0 0 "[ . 1 . 2]" 1
296 1 20 ILE HG12 1 33 LEU MD2 . . 4.670 3.865 3.509 4.182 . 0 0 "[ . 1 . 2]" 1
297 1 20 ILE HG12 1 86 VAL HA . . 3.980 3.568 3.141 3.979 . 0 0 "[ . 1 . 2]" 1
298 1 20 ILE HG12 1 86 VAL MG2 . . 3.140 2.704 2.416 3.094 . 0 0 "[ . 1 . 2]" 1
299 1 20 ILE HG12 1 87 HIS H . . 5.320 4.806 4.391 5.186 . 0 0 "[ . 1 . 2]" 1
300 1 20 ILE HG13 1 21 MET H . . 5.200 4.728 4.625 4.843 . 0 0 "[ . 1 . 2]" 1
301 1 20 ILE HG13 1 33 LEU MD2 . . 5.130 4.732 4.506 4.926 . 0 0 "[ . 1 . 2]" 1
302 1 20 ILE HG13 1 86 VAL HA . . 4.610 3.597 3.251 3.952 . 0 0 "[ . 1 . 2]" 1
303 1 20 ILE HG13 1 86 VAL MG1 . . 4.140 3.578 3.194 3.913 . 0 0 "[ . 1 . 2]" 1
304 1 20 ILE HG13 1 86 VAL MG2 . . 3.990 3.735 3.448 3.996 0.006 16 0 "[ . 1 . 2]" 1
305 1 20 ILE HG13 1 87 HIS H . . 5.500 4.038 3.713 4.422 . 0 0 "[ . 1 . 2]" 1
306 1 20 ILE MG 1 21 MET H . . 3.390 2.542 2.226 2.709 . 0 0 "[ . 1 . 2]" 1
307 1 20 ILE MG 1 21 MET HA . . 4.560 3.645 3.535 3.748 . 0 0 "[ . 1 . 2]" 1
308 1 20 ILE MG 1 21 MET ME . . 4.280 3.665 3.427 3.943 . 0 0 "[ . 1 . 2]" 1
309 1 20 ILE MG 1 23 PHE H . . 4.160 3.832 3.290 4.120 . 0 0 "[ . 1 . 2]" 1
310 1 20 ILE MG 1 23 PHE HB3 . . 4.100 2.518 2.345 2.739 . 0 0 "[ . 1 . 2]" 1
311 1 20 ILE MG 1 23 PHE QD . . 3.350 2.421 2.024 2.684 . 0 0 "[ . 1 . 2]" 1
312 1 20 ILE MG 1 23 PHE QE . . 4.190 3.995 3.743 4.190 0.000 20 0 "[ . 1 . 2]" 1
313 1 20 ILE MG 1 33 LEU MD1 . . 4.730 3.761 3.553 4.076 . 0 0 "[ . 1 . 2]" 1
314 1 20 ILE MG 1 33 LEU MD2 . . 2.910 2.173 2.000 2.509 . 0 0 "[ . 1 . 2]" 1
315 1 20 ILE MG 1 55 ALA H . . 4.740 4.655 4.448 4.734 . 0 0 "[ . 1 . 2]" 1
316 1 20 ILE MG 1 55 ALA MB . . 4.650 3.916 3.771 4.020 . 0 0 "[ . 1 . 2]" 1
317 1 20 ILE MG 1 84 VAL HA . . 5.250 4.994 4.742 5.120 . 0 0 "[ . 1 . 2]" 1
318 1 20 ILE MG 1 84 VAL HB . . 3.680 3.031 2.803 3.137 . 0 0 "[ . 1 . 2]" 1
319 1 20 ILE MG 1 84 VAL MG2 . . 2.810 2.537 2.241 2.737 . 0 0 "[ . 1 . 2]" 1
320 1 20 ILE MG 1 85 ARG H . . 3.860 3.417 2.950 3.625 . 0 0 "[ . 1 . 2]" 1
321 1 20 ILE MG 1 86 VAL HA . . 4.100 3.406 3.223 3.636 . 0 0 "[ . 1 . 2]" 1
322 1 20 ILE MG 1 86 VAL MG2 . . 2.520 2.381 2.223 2.526 0.006 2 0 "[ . 1 . 2]" 1
323 1 21 MET H 1 21 MET HB2 . . 3.900 2.986 2.907 3.067 . 0 0 "[ . 1 . 2]" 1
324 1 21 MET H 1 21 MET HB3 . . 3.940 3.860 3.848 3.869 . 0 0 "[ . 1 . 2]" 1
325 1 21 MET H 1 21 MET ME . . 3.840 2.175 1.942 2.529 . 0 0 "[ . 1 . 2]" 1
326 1 21 MET H 1 21 MET HG2 . . 4.250 4.137 4.089 4.191 . 0 0 "[ . 1 . 2]" 1
327 1 21 MET H 1 21 MET HG3 . . 3.910 2.723 2.676 2.767 . 0 0 "[ . 1 . 2]" 1
328 1 21 MET H 1 22 ASP H . . 4.790 4.423 4.331 4.459 . 0 0 "[ . 1 . 2]" 1
329 1 21 MET H 1 23 PHE QD . . 4.910 3.669 3.463 3.967 . 0 0 "[ . 1 . 2]" 1
330 1 21 MET H 1 55 ALA H . . 5.500 5.282 5.161 5.389 . 0 0 "[ . 1 . 2]" 1
331 1 21 MET H 1 84 VAL HB . . 4.370 3.905 3.701 4.094 . 0 0 "[ . 1 . 2]" 1
332 1 21 MET H 1 84 VAL MG2 . . 4.900 4.339 4.123 4.586 . 0 0 "[ . 1 . 2]" 1
333 1 21 MET H 1 85 ARG H . . 4.010 3.020 2.907 3.094 . 0 0 "[ . 1 . 2]" 1
334 1 21 MET H 1 86 VAL HA . . 4.350 4.102 3.785 4.255 . 0 0 "[ . 1 . 2]" 1
335 1 21 MET H 1 86 VAL MG2 . . 5.270 4.319 4.088 4.573 . 0 0 "[ . 1 . 2]" 1
336 1 21 MET H 1 87 HIS H . . 5.380 5.103 4.867 5.331 . 0 0 "[ . 1 . 2]" 1
337 1 21 MET HA 1 21 MET HG2 . . 3.940 3.480 3.321 3.616 . 0 0 "[ . 1 . 2]" 1
338 1 21 MET HA 1 21 MET HG3 . . 3.590 2.808 2.772 2.853 . 0 0 "[ . 1 . 2]" 1
339 1 21 MET HA 1 22 ASP H . . 3.550 2.538 2.413 2.733 . 0 0 "[ . 1 . 2]" 1
340 1 21 MET HA 1 22 ASP HA . . 4.680 4.632 4.573 4.690 0.010 3 0 "[ . 1 . 2]" 1
341 1 21 MET HA 1 23 PHE H . . 4.130 3.016 2.913 3.192 . 0 0 "[ . 1 . 2]" 1
342 1 21 MET HA 1 23 PHE QE . . 5.020 3.048 2.719 3.420 . 0 0 "[ . 1 . 2]" 1
343 1 21 MET HA 1 54 GLU HA . . 3.790 3.085 2.881 3.185 . 0 0 "[ . 1 . 2]" 1
344 1 21 MET HA 1 54 GLU QG . . 3.880 3.702 3.512 3.888 0.008 8 0 "[ . 1 . 2]" 1
345 1 21 MET HA 1 55 ALA H . . 4.100 3.909 3.715 4.037 . 0 0 "[ . 1 . 2]" 1
346 1 21 MET HB2 1 21 MET ME . . 3.620 3.367 3.159 3.619 . 0 0 "[ . 1 . 2]" 1
347 1 21 MET HB2 1 21 MET HG2 . . 2.940 2.788 2.734 2.851 . 0 0 "[ . 1 . 2]" 1
348 1 21 MET HB2 1 22 ASP H . . 4.090 2.951 2.530 3.243 . 0 0 "[ . 1 . 2]" 1
349 1 21 MET HB2 1 22 ASP HA . . 4.780 4.560 4.382 4.700 . 0 0 "[ . 1 . 2]" 1
350 1 21 MET HB2 1 23 PHE H . . 4.970 4.754 4.571 4.952 . 0 0 "[ . 1 . 2]" 1
351 1 21 MET HB2 1 54 GLU HA . . 5.500 5.391 5.277 5.475 . 0 0 "[ . 1 . 2]" 1
352 1 21 MET HB2 1 85 ARG H . . 5.150 4.087 3.951 4.213 . 0 0 "[ . 1 . 2]" 1
353 1 21 MET HB2 1 85 ARG HB2 . . 3.760 2.721 2.471 3.098 . 0 0 "[ . 1 . 2]" 1
354 1 21 MET HB3 1 22 ASP H . . 4.310 2.416 2.204 2.605 . 0 0 "[ . 1 . 2]" 1
355 1 21 MET HB3 1 22 ASP HA . . 4.770 4.512 4.412 4.615 . 0 0 "[ . 1 . 2]" 1
356 1 21 MET HB3 1 22 ASP HB2 . . 4.800 4.483 4.215 4.773 . 0 0 "[ . 1 . 2]" 1
357 1 21 MET HB3 1 54 GLU HA . . 4.560 4.027 3.899 4.166 . 0 0 "[ . 1 . 2]" 1
358 1 21 MET HB3 1 54 GLU QG . . 3.340 3.210 2.992 3.349 0.009 8 0 "[ . 1 . 2]" 1
359 1 21 MET HB3 1 85 ARG H . . 5.500 5.450 5.369 5.507 0.007 4 0 "[ . 1 . 2]" 1
360 1 21 MET ME 1 21 MET HG3 . . 3.440 2.156 2.002 2.255 . 0 0 "[ . 1 . 2]" 1
361 1 21 MET ME 1 56 PHE QE . . 4.780 4.693 4.506 4.780 0.000 20 0 "[ . 1 . 2]" 1
362 1 21 MET ME 1 86 VAL H . . 4.300 3.824 3.560 4.148 . 0 0 "[ . 1 . 2]" 1
363 1 21 MET ME 1 86 VAL HA . . 4.430 3.078 2.783 3.561 . 0 0 "[ . 1 . 2]" 1
364 1 21 MET ME 1 87 HIS H . . 4.110 2.816 2.517 3.216 . 0 0 "[ . 1 . 2]" 1
365 1 21 MET ME 1 87 HIS HB2 . . 4.200 2.714 2.508 2.949 . 0 0 "[ . 1 . 2]" 1
366 1 21 MET ME 1 87 HIS QB . . 3.570 2.674 2.479 2.894 . 0 0 "[ . 1 . 2]" 1
367 1 21 MET ME 1 87 HIS HB3 . . 4.200 4.040 3.885 4.203 0.003 15 0 "[ . 1 . 2]" 1
368 1 21 MET ME 1 87 HIS HD2 . . 4.380 4.209 3.911 4.361 . 0 0 "[ . 1 . 2]" 1
369 1 21 MET ME 1 87 HIS HE1 . . 4.300 3.454 2.917 4.053 . 0 0 "[ . 1 . 2]" 1
370 1 21 MET HG2 1 22 ASP H . . 5.020 4.572 4.378 4.756 . 0 0 "[ . 1 . 2]" 1
371 1 21 MET HG2 1 54 GLU HA . . 4.340 4.068 3.653 4.305 . 0 0 "[ . 1 . 2]" 1
372 1 21 MET HG2 1 54 GLU QG . . 4.730 2.868 2.552 3.175 . 0 0 "[ . 1 . 2]" 1
373 1 21 MET HG2 1 55 ALA H . . 5.370 5.071 4.838 5.229 . 0 0 "[ . 1 . 2]" 1
374 1 21 MET HG3 1 22 ASP H . . 4.830 4.647 4.531 4.720 . 0 0 "[ . 1 . 2]" 1
375 1 21 MET HG3 1 54 GLU HA . . 5.280 3.844 3.675 4.015 . 0 0 "[ . 1 . 2]" 1
376 1 21 MET HG3 1 55 ALA H . . 4.170 4.154 4.127 4.170 . 14 0 "[ . 1 . 2]" 1
377 1 21 MET HG3 1 85 ARG H . . 5.500 5.482 5.402 5.516 0.016 14 0 "[ . 1 . 2]" 1
378 1 22 ASP H 1 23 PHE H . . 3.410 2.647 2.462 2.886 . 0 0 "[ . 1 . 2]" 1
379 1 22 ASP H 1 53 ASN HB2 . . 4.830 3.365 2.749 4.183 . 0 0 "[ . 1 . 2]" 1
380 1 22 ASP H 1 53 ASN HB3 . . 4.880 3.404 3.065 3.769 . 0 0 "[ . 1 . 2]" 1
381 1 22 ASP H 1 54 GLU HA . . 5.060 4.915 4.676 5.055 . 0 0 "[ . 1 . 2]" 1
382 1 22 ASP H 1 54 GLU QG . . 5.040 4.647 4.446 4.891 . 0 0 "[ . 1 . 2]" 1
383 1 22 ASP HA 1 23 PHE H . . 3.510 3.172 2.998 3.457 . 0 0 "[ . 1 . 2]" 1
384 1 22 ASP HA 1 53 ASN HB2 . . 4.520 4.063 3.750 4.525 0.005 8 0 "[ . 1 . 2]" 1
385 1 22 ASP HA 1 53 ASN HB3 . . 4.460 4.078 3.893 4.406 . 0 0 "[ . 1 . 2]" 1
386 1 22 ASP HA 1 53 ASN QD . . 4.360 3.648 3.117 4.294 . 0 0 "[ . 1 . 2]" 1
387 1 22 ASP HA 1 84 VAL MG1 . . 5.360 4.437 4.050 4.673 . 0 0 "[ . 1 . 2]" 1
388 1 22 ASP HB2 1 23 PHE H . . 4.690 3.997 3.692 4.385 . 0 0 "[ . 1 . 2]" 1
389 1 22 ASP HB2 1 84 VAL HA . . 3.940 2.763 2.201 3.539 . 0 0 "[ . 1 . 2]" 1
390 1 22 ASP HB2 1 84 VAL HB . . 4.820 3.449 2.956 4.224 . 0 0 "[ . 1 . 2]" 1
391 1 22 ASP HB2 1 85 ARG H . . 3.910 2.804 2.235 3.580 . 0 0 "[ . 1 . 2]" 1
392 1 22 ASP HB3 1 23 PHE H . . 4.940 3.935 3.118 4.319 . 0 0 "[ . 1 . 2]" 1
393 1 22 ASP HB3 1 84 VAL HA . . 3.690 2.109 1.990 2.495 . 0 0 "[ . 1 . 2]" 1
394 1 22 ASP HB3 1 84 VAL HB . . 4.740 3.260 2.505 3.903 . 0 0 "[ . 1 . 2]" 1
395 1 22 ASP HB3 1 84 VAL MG1 . . 4.080 2.854 2.093 3.498 . 0 0 "[ . 1 . 2]" 1
396 1 22 ASP HB3 1 85 ARG H . . 4.990 3.395 2.600 4.039 . 0 0 "[ . 1 . 2]" 1
397 1 23 PHE H 1 23 PHE HB2 . . 3.990 3.669 3.578 3.749 . 0 0 "[ . 1 . 2]" 1
398 1 23 PHE H 1 23 PHE HB3 . . 3.710 2.636 2.389 2.819 . 0 0 "[ . 1 . 2]" 1
399 1 23 PHE H 1 23 PHE QD . . 3.180 2.428 2.172 2.766 . 0 0 "[ . 1 . 2]" 1
400 1 23 PHE H 1 23 PHE QE . . 4.390 4.204 4.052 4.375 . 0 0 "[ . 1 . 2]" 1
401 1 23 PHE H 1 24 GLN H . . 4.670 4.547 4.454 4.646 . 0 0 "[ . 1 . 2]" 1
402 1 23 PHE H 1 53 ASN HB2 . . 4.540 4.034 3.523 4.526 . 0 0 "[ . 1 . 2]" 1
403 1 23 PHE H 1 53 ASN HB3 . . 3.890 2.841 2.369 3.645 . 0 0 "[ . 1 . 2]" 1
404 1 23 PHE H 1 79 VAL MG1 . . 5.500 5.425 5.145 5.511 0.011 11 0 "[ . 1 . 2]" 1
405 1 23 PHE H 1 79 VAL MG2 . . 5.500 5.404 5.130 5.510 0.010 15 0 "[ . 1 . 2]" 1
406 1 23 PHE H 1 84 VAL HB . . 5.250 3.877 2.978 4.337 . 0 0 "[ . 1 . 2]" 1
407 1 23 PHE H 1 84 VAL MG1 . . 4.260 3.525 3.117 3.763 . 0 0 "[ . 1 . 2]" 1
408 1 23 PHE H 1 84 VAL MG2 . . 5.500 5.009 4.216 5.446 . 0 0 "[ . 1 . 2]" 1
409 1 23 PHE H 1 85 ARG H . . 5.500 4.703 3.955 5.173 . 0 0 "[ . 1 . 2]" 1
410 1 23 PHE HA 1 24 GLN H . . 3.100 2.225 2.176 2.351 . 0 0 "[ . 1 . 2]" 1
411 1 23 PHE HA 1 24 GLN HB2 . . 4.820 4.599 4.459 4.871 0.051 20 0 "[ . 1 . 2]" 1
412 1 23 PHE HA 1 24 GLN QG . . 3.760 3.720 3.647 3.783 0.023 20 0 "[ . 1 . 2]" 1
413 1 23 PHE HA 1 33 LEU MD2 . . 4.940 4.281 4.007 4.729 . 0 0 "[ . 1 . 2]" 1
414 1 23 PHE HA 1 79 VAL HB . . 4.660 3.331 3.124 3.455 . 0 0 "[ . 1 . 2]" 1
415 1 23 PHE HA 1 79 VAL MG1 . . 4.730 3.420 3.169 3.550 . 0 0 "[ . 1 . 2]" 1
416 1 23 PHE HA 1 79 VAL MG2 . . 4.470 3.957 3.769 4.151 . 0 0 "[ . 1 . 2]" 1
417 1 23 PHE HA 1 84 VAL MG1 . . 3.150 2.081 1.902 2.259 . 0 0 "[ . 1 . 2]" 1
418 1 23 PHE HA 1 84 VAL MG2 . . 5.050 4.370 3.988 4.646 . 0 0 "[ . 1 . 2]" 1
419 1 23 PHE HB2 1 24 GLN H . . 3.640 2.988 2.598 3.170 . 0 0 "[ . 1 . 2]" 1
420 1 23 PHE HB2 1 29 LEU MD2 . . 3.940 3.276 2.951 3.491 . 0 0 "[ . 1 . 2]" 1
421 1 23 PHE HB2 1 33 LEU MD2 . . 4.610 2.360 2.067 2.819 . 0 0 "[ . 1 . 2]" 1
422 1 23 PHE HB2 1 79 VAL HB . . 4.610 3.674 3.441 3.976 . 0 0 "[ . 1 . 2]" 1
423 1 23 PHE HB2 1 79 VAL MG1 . . 3.590 2.424 2.239 2.654 . 0 0 "[ . 1 . 2]" 1
424 1 23 PHE HB2 1 79 VAL MG2 . . 4.700 3.396 3.054 3.651 . 0 0 "[ . 1 . 2]" 1
425 1 23 PHE HB2 1 80 PHE QD . . 5.500 4.819 4.672 5.005 . 0 0 "[ . 1 . 2]" 1
426 1 23 PHE HB2 1 84 VAL MG1 . . 3.730 3.050 2.752 3.402 . 0 0 "[ . 1 . 2]" 1
427 1 23 PHE HB3 1 24 GLN H . . 4.240 4.148 3.922 4.243 0.003 11 0 "[ . 1 . 2]" 1
428 1 23 PHE HB3 1 29 LEU MD2 . . 4.870 4.655 4.388 4.851 . 0 0 "[ . 1 . 2]" 1
429 1 23 PHE HB3 1 33 LEU MD2 . . 4.690 2.708 2.387 3.086 . 0 0 "[ . 1 . 2]" 1
430 1 23 PHE HB3 1 79 VAL HB . . 4.890 4.138 3.935 4.278 . 0 0 "[ . 1 . 2]" 1
431 1 23 PHE HB3 1 79 VAL MG1 . . 3.950 3.550 3.346 3.695 . 0 0 "[ . 1 . 2]" 1
432 1 23 PHE HB3 1 79 VAL MG2 . . 4.160 3.362 3.118 3.653 . 0 0 "[ . 1 . 2]" 1
433 1 23 PHE HB3 1 84 VAL MG1 . . 3.310 2.535 2.295 2.793 . 0 0 "[ . 1 . 2]" 1
434 1 23 PHE HB3 1 84 VAL MG2 . . 4.810 3.587 3.179 3.852 . 0 0 "[ . 1 . 2]" 1
435 1 23 PHE QD 1 24 GLN H . . 4.300 3.492 3.186 3.707 . 0 0 "[ . 1 . 2]" 1
436 1 23 PHE QD 1 25 ARG H . . 5.170 4.978 4.636 5.157 . 0 0 "[ . 1 . 2]" 1
437 1 23 PHE QD 1 25 ARG HA . . 5.060 4.212 4.059 4.368 . 0 0 "[ . 1 . 2]" 1
438 1 23 PHE QD 1 25 ARG QD . . 4.730 4.503 4.198 4.735 0.005 15 0 "[ . 1 . 2]" 1
439 1 23 PHE QD 1 25 ARG HG2 . . 4.540 3.342 3.096 3.634 . 0 0 "[ . 1 . 2]" 1
440 1 23 PHE QD 1 25 ARG HG3 . . 5.280 4.631 4.167 5.040 . 0 0 "[ . 1 . 2]" 1
441 1 23 PHE QD 1 29 LEU MD1 . . 3.840 3.412 3.096 3.782 . 0 0 "[ . 1 . 2]" 1
442 1 23 PHE QD 1 29 LEU MD2 . . 3.500 2.397 2.048 2.816 . 0 0 "[ . 1 . 2]" 1
443 1 23 PHE QD 1 33 LEU MD1 . . 5.010 2.883 2.670 3.229 . 0 0 "[ . 1 . 2]" 1
444 1 23 PHE QD 1 33 LEU MD2 . . 3.840 2.877 2.647 3.156 . 0 0 "[ . 1 . 2]" 1
445 1 23 PHE QD 1 48 ILE MG . . 4.680 4.403 4.206 4.677 . 0 0 "[ . 1 . 2]" 1
446 1 23 PHE QD 1 53 ASN HB3 . . 4.780 3.688 3.518 3.887 . 0 0 "[ . 1 . 2]" 1
447 1 23 PHE QD 1 55 ALA H . . 4.570 3.970 3.720 4.073 . 0 0 "[ . 1 . 2]" 1
448 1 23 PHE QD 1 55 ALA MB . . 4.270 3.723 3.514 3.918 . 0 0 "[ . 1 . 2]" 1
449 1 23 PHE QD 1 79 VAL MG1 . . 4.230 3.832 3.588 4.125 . 0 0 "[ . 1 . 2]" 1
450 1 23 PHE QD 1 79 VAL MG2 . . 4.920 4.729 4.500 4.926 0.006 14 0 "[ . 1 . 2]" 1
451 1 23 PHE QD 1 84 VAL MG1 . . 4.210 4.152 3.888 4.222 0.012 14 0 "[ . 1 . 2]" 1
452 1 23 PHE QD 1 84 VAL MG2 . . 4.920 4.781 4.470 4.926 0.006 2 0 "[ . 1 . 2]" 1
453 1 23 PHE QE 1 25 ARG QD . . 3.990 2.973 2.452 3.362 . 0 0 "[ . 1 . 2]" 1
454 1 23 PHE QE 1 25 ARG HG2 . . 4.250 2.913 2.541 3.240 . 0 0 "[ . 1 . 2]" 1
455 1 23 PHE QE 1 25 ARG HG3 . . 4.990 4.041 3.671 4.538 . 0 0 "[ . 1 . 2]" 1
456 1 23 PHE QE 1 29 LEU MD1 . . 3.580 2.676 2.167 3.234 . 0 0 "[ . 1 . 2]" 1
457 1 23 PHE QE 1 29 LEU MD2 . . 4.190 3.551 3.030 4.179 . 0 0 "[ . 1 . 2]" 1
458 1 23 PHE QE 1 33 LEU MD1 . . 4.370 2.703 2.429 3.312 . 0 0 "[ . 1 . 2]" 1
459 1 23 PHE QE 1 33 LEU MD2 . . 4.260 3.751 3.394 4.078 . 0 0 "[ . 1 . 2]" 1
460 1 23 PHE QE 1 48 ILE MD . . 4.810 4.332 4.030 4.734 . 0 0 "[ . 1 . 2]" 1
461 1 23 PHE QE 1 48 ILE MG . . 3.460 2.756 2.501 3.016 . 0 0 "[ . 1 . 2]" 1
462 1 23 PHE QE 1 53 ASN HA . . 3.940 3.471 3.030 3.816 . 0 0 "[ . 1 . 2]" 1
463 1 23 PHE QE 1 53 ASN HB3 . . 4.490 3.944 3.617 4.175 . 0 0 "[ . 1 . 2]" 1
464 1 23 PHE QE 1 54 GLU H . . 3.970 3.670 3.454 3.908 . 0 0 "[ . 1 . 2]" 1
465 1 23 PHE QE 1 54 GLU HA . . 3.790 2.282 2.004 2.604 . 0 0 "[ . 1 . 2]" 1
466 1 23 PHE QE 1 55 ALA H . . 3.690 2.037 1.892 2.213 . 0 0 "[ . 1 . 2]" 1
467 1 23 PHE QE 1 55 ALA MB . . 3.310 2.535 2.269 2.823 . 0 0 "[ . 1 . 2]" 1
468 1 23 PHE HZ 1 33 LEU MD1 . . 4.560 3.434 3.016 4.022 . 0 0 "[ . 1 . 2]" 1
469 1 23 PHE HZ 1 48 ILE MG . . 3.460 2.560 2.195 2.901 . 0 0 "[ . 1 . 2]" 1
470 1 23 PHE HZ 1 53 ASN HA . . 4.080 3.320 2.687 3.767 . 0 0 "[ . 1 . 2]" 1
471 1 23 PHE HZ 1 54 GLU H . . 3.690 3.340 2.754 3.690 0.000 18 0 "[ . 1 . 2]" 1
472 1 23 PHE HZ 1 55 ALA H . . 4.070 3.633 3.331 3.919 . 0 0 "[ . 1 . 2]" 1
473 1 23 PHE HZ 1 55 ALA MB . . 3.710 2.132 1.977 2.714 . 0 0 "[ . 1 . 2]" 1
474 1 24 GLN H 1 24 GLN HB2 . . 3.550 2.507 2.418 2.790 . 0 0 "[ . 1 . 2]" 1
475 1 24 GLN H 1 24 GLN HB3 . . 3.820 3.669 3.632 3.783 . 0 0 "[ . 1 . 2]" 1
476 1 24 GLN H 1 24 GLN QG . . 3.460 2.708 2.532 3.086 . 0 0 "[ . 1 . 2]" 1
477 1 24 GLN H 1 25 ARG H . . 4.530 4.468 4.419 4.509 . 0 0 "[ . 1 . 2]" 1
478 1 24 GLN H 1 29 LEU MD2 . . 4.740 4.025 3.541 4.265 . 0 0 "[ . 1 . 2]" 1
479 1 24 GLN H 1 79 VAL HB . . 4.200 3.994 3.786 4.200 . 0 0 "[ . 1 . 2]" 1
480 1 24 GLN H 1 79 VAL MG1 . . 4.210 3.183 2.871 3.451 . 0 0 "[ . 1 . 2]" 1
481 1 24 GLN H 1 79 VAL MG2 . . 5.230 4.894 4.660 5.110 . 0 0 "[ . 1 . 2]" 1
482 1 24 GLN H 1 80 PHE QD . . 4.490 3.431 3.003 3.653 . 0 0 "[ . 1 . 2]" 1
483 1 24 GLN H 1 84 VAL MG1 . . 4.000 3.715 3.503 3.890 . 0 0 "[ . 1 . 2]" 1
484 1 24 GLN HA 1 24 GLN QE . . 5.140 3.581 1.950 4.386 . 0 0 "[ . 1 . 2]" 1
485 1 24 GLN HA 1 24 GLN QG . . 3.440 2.711 2.357 2.936 . 0 0 "[ . 1 . 2]" 1
486 1 24 GLN HA 1 25 ARG H . . 2.720 2.606 2.483 2.675 . 0 0 "[ . 1 . 2]" 1
487 1 24 GLN HA 1 25 ARG HG3 . . 4.080 3.776 3.507 3.975 . 0 0 "[ . 1 . 2]" 1
488 1 24 GLN HA 1 53 ASN QD . . 4.260 3.354 2.220 4.001 . 0 0 "[ . 1 . 2]" 1
489 1 24 GLN HB2 1 25 ARG H . . 3.370 3.220 3.018 3.338 . 0 0 "[ . 1 . 2]" 1
490 1 24 GLN HB2 1 80 PHE QB . . 5.220 3.451 3.096 3.699 . 0 0 "[ . 1 . 2]" 1
491 1 24 GLN HB2 1 80 PHE QD . . 3.850 3.041 2.450 3.159 . 0 0 "[ . 1 . 2]" 1
492 1 24 GLN HB2 1 82 LYS QE . . 4.210 2.266 1.989 3.083 . 0 0 "[ . 1 . 2]" 1
493 1 24 GLN HB3 1 25 ARG H . . 3.170 2.050 1.901 2.383 . 0 0 "[ . 1 . 2]" 1
494 1 24 GLN HB3 1 80 PHE QD . . 4.450 4.348 4.084 4.445 . 0 0 "[ . 1 . 2]" 1
495 1 24 GLN QG 1 25 ARG H . . 4.100 4.017 3.874 4.103 0.003 3 0 "[ . 1 . 2]" 1
496 1 24 GLN QG 1 79 VAL MG1 . . 5.050 4.922 4.654 5.049 . 0 0 "[ . 1 . 2]" 1
497 1 24 GLN QG 1 80 PHE QB . . 4.750 4.296 3.966 4.533 . 0 0 "[ . 1 . 2]" 1
498 1 24 GLN QG 1 80 PHE QD . . 4.690 4.653 4.341 4.703 0.013 11 0 "[ . 1 . 2]" 1
499 1 24 GLN QG 1 82 LYS QB . . 4.930 4.411 4.000 4.697 . 0 0 "[ . 1 . 2]" 1
500 1 24 GLN QG 1 82 LYS HD2 . . 4.510 3.908 3.433 4.519 0.009 14 0 "[ . 1 . 2]" 1
501 1 24 GLN QG 1 82 LYS HD3 . . 4.510 4.363 3.951 4.524 0.014 19 0 "[ . 1 . 2]" 1
502 1 24 GLN QG 1 82 LYS QE . . 4.430 1.913 1.817 2.089 . 0 0 "[ . 1 . 2]" 1
503 1 24 GLN QG 1 82 LYS HG3 . . 4.430 3.040 2.479 3.455 . 0 0 "[ . 1 . 2]" 1
504 1 24 GLN QG 1 84 VAL MG1 . . 4.770 4.545 4.305 4.761 . 0 0 "[ . 1 . 2]" 1
505 1 25 ARG H 1 25 ARG HB2 . . 2.910 2.745 2.642 2.880 . 0 0 "[ . 1 . 2]" 1
506 1 25 ARG H 1 25 ARG QD . . 4.950 4.683 4.583 4.767 . 0 0 "[ . 1 . 2]" 1
507 1 25 ARG H 1 25 ARG HG2 . . 3.540 3.380 3.193 3.539 . 0 0 "[ . 1 . 2]" 1
508 1 25 ARG H 1 25 ARG HG3 . . 3.230 3.108 2.992 3.214 . 0 0 "[ . 1 . 2]" 1
509 1 25 ARG H 1 26 GLY H . . 4.690 4.468 4.425 4.507 . 0 0 "[ . 1 . 2]" 1
510 1 25 ARG H 1 80 PHE QE . . 5.260 4.566 4.222 4.743 . 0 0 "[ . 1 . 2]" 1
511 1 25 ARG HA 1 25 ARG QD . . 3.860 3.585 3.486 3.726 . 0 0 "[ . 1 . 2]" 1
512 1 25 ARG HA 1 25 ARG HG2 . . 3.770 2.504 2.405 2.583 . 0 0 "[ . 1 . 2]" 1
513 1 25 ARG HA 1 25 ARG HG3 . . 3.920 3.575 3.472 3.631 . 0 0 "[ . 1 . 2]" 1
514 1 25 ARG HA 1 26 GLY H . . 3.110 2.448 2.401 2.522 . 0 0 "[ . 1 . 2]" 1
515 1 25 ARG HA 1 29 LEU MD1 . . 3.840 3.698 3.594 3.754 . 0 0 "[ . 1 . 2]" 1
516 1 25 ARG HA 1 29 LEU MD2 . . 3.860 2.807 2.267 3.222 . 0 0 "[ . 1 . 2]" 1
517 1 25 ARG HA 1 80 PHE QE . . 4.140 2.608 2.334 2.896 . 0 0 "[ . 1 . 2]" 1
518 1 25 ARG HA 1 80 PHE HZ . . 5.470 4.502 4.113 4.750 . 0 0 "[ . 1 . 2]" 1
519 1 25 ARG HB2 1 25 ARG QD . . 3.060 2.880 2.752 3.060 . 0 0 "[ . 1 . 2]" 1
520 1 25 ARG HB2 1 25 ARG HG3 . . 3.000 2.257 2.236 2.295 . 0 0 "[ . 1 . 2]" 1
521 1 25 ARG HB2 1 26 GLY H . . 3.520 3.418 3.208 3.529 0.009 17 0 "[ . 1 . 2]" 1
522 1 25 ARG HB3 1 25 ARG QD . . 3.240 1.992 1.950 2.045 . 0 0 "[ . 1 . 2]" 1
523 1 25 ARG HB3 1 25 ARG HG3 . . 3.000 2.944 2.919 2.975 . 0 0 "[ . 1 . 2]" 1
524 1 25 ARG HB3 1 26 GLY H . . 3.140 2.390 2.253 2.477 . 0 0 "[ . 1 . 2]" 1
525 1 25 ARG HB3 1 29 LEU MD1 . . 4.820 4.022 3.675 4.275 . 0 0 "[ . 1 . 2]" 1
526 1 25 ARG QD 1 26 GLY H . . 4.140 4.040 3.862 4.133 . 0 0 "[ . 1 . 2]" 1
527 1 25 ARG QD 1 29 LEU MD1 . . 3.420 2.902 2.438 3.204 . 0 0 "[ . 1 . 2]" 1
528 1 25 ARG QD 1 29 LEU MD2 . . 4.770 4.316 3.770 4.760 . 0 0 "[ . 1 . 2]" 1
529 1 25 ARG HG2 1 26 GLY H . . 4.530 4.369 4.225 4.455 . 0 0 "[ . 1 . 2]" 1
530 1 25 ARG HG2 1 29 LEU MD1 . . 3.650 3.298 3.037 3.473 . 0 0 "[ . 1 . 2]" 1
531 1 25 ARG HG3 1 29 LEU MD1 . . 4.830 4.691 4.420 4.838 0.008 17 0 "[ . 1 . 2]" 1
532 1 26 GLY H 1 29 LEU H . . 4.190 3.619 3.114 4.129 . 0 0 "[ . 1 . 2]" 1
533 1 26 GLY H 1 29 LEU QB . . 4.230 2.206 1.879 2.535 . 0 0 "[ . 1 . 2]" 1
534 1 26 GLY H 1 29 LEU MD1 . . 4.600 4.446 4.309 4.563 . 0 0 "[ . 1 . 2]" 1
535 1 26 GLY H 1 29 LEU MD2 . . 4.820 4.165 3.882 4.416 . 0 0 "[ . 1 . 2]" 1
536 1 26 GLY H 1 29 LEU HG . . 5.440 3.562 3.414 3.737 . 0 0 "[ . 1 . 2]" 1
537 1 26 GLY H 1 80 PHE HZ . . 4.220 3.770 3.120 4.012 . 0 0 "[ . 1 . 2]" 1
538 1 26 GLY QA 1 29 LEU H . . 5.340 4.583 4.005 5.046 . 0 0 "[ . 1 . 2]" 1
539 1 26 GLY QA 1 29 LEU HG . . 5.340 5.346 5.338 5.378 0.038 17 0 "[ . 1 . 2]" 1
540 1 26 GLY QA 1 80 PHE QE . . 4.640 3.505 3.001 3.756 . 0 0 "[ . 1 . 2]" 1
541 1 26 GLY QA 1 80 PHE HZ . . 4.210 3.027 2.346 3.383 . 0 0 "[ . 1 . 2]" 1
542 1 26 GLY HA2 1 80 PHE HZ . . 5.050 4.634 3.920 5.049 . 0 0 "[ . 1 . 2]" 1
543 1 26 GLY HA3 1 80 PHE HZ . . 5.050 3.070 2.364 3.455 . 0 0 "[ . 1 . 2]" 1
544 1 27 LYS HA 1 27 LYS QG . . 3.570 2.818 2.110 3.374 . 0 0 "[ . 1 . 2]" 1
545 1 27 LYS HA 1 29 LEU H . . 4.420 3.925 3.397 4.295 . 0 0 "[ . 1 . 2]" 1
546 1 27 LYS QG 1 28 ASN QB . . 4.530 3.631 2.327 4.526 . 0 0 "[ . 1 . 2]" 1
547 1 28 ASN HA 1 29 LEU H . . 3.310 2.878 2.755 3.017 . 0 0 "[ . 1 . 2]" 1
548 1 28 ASN HA 1 31 TYR QD . . 5.500 5.220 4.703 5.501 0.001 17 0 "[ . 1 . 2]" 1
549 1 28 ASN QB 1 29 LEU H . . 4.430 3.827 3.711 4.011 . 0 0 "[ . 1 . 2]" 1
550 1 28 ASN QB 1 31 TYR H . . 3.870 3.777 3.677 3.879 0.009 17 0 "[ . 1 . 2]" 1
551 1 28 ASN QB 1 31 TYR HB2 . . 3.880 3.639 3.480 3.881 0.001 15 0 "[ . 1 . 2]" 1
552 1 28 ASN QB 1 31 TYR HB3 . . 4.090 2.469 2.314 2.703 . 0 0 "[ . 1 . 2]" 1
553 1 28 ASN QB 1 31 TYR QD . . 3.950 3.233 2.643 3.716 . 0 0 "[ . 1 . 2]" 1
554 1 28 ASN QB 1 32 GLN H . . 4.610 4.047 3.739 4.350 . 0 0 "[ . 1 . 2]" 1
555 1 28 ASN QB 1 32 GLN HE21 . . 4.330 3.471 3.204 3.827 . 0 0 "[ . 1 . 2]" 1
556 1 28 ASN QB 1 32 GLN HG2 . . 4.310 3.592 3.256 3.899 . 0 0 "[ . 1 . 2]" 1
557 1 28 ASN QB 1 32 GLN HG3 . . 5.080 4.224 3.762 4.558 . 0 0 "[ . 1 . 2]" 1
558 1 28 ASN HB2 1 29 LEU H . . 5.250 4.165 3.977 4.387 . 0 0 "[ . 1 . 2]" 1
559 1 28 ASN HB2 1 31 TYR QD . . 4.600 3.998 2.945 4.599 . 0 0 "[ . 1 . 2]" 1
560 1 28 ASN HB2 1 32 GLN HE21 . . 4.920 3.631 3.311 4.086 . 0 0 "[ . 1 . 2]" 1
561 1 28 ASN HB3 1 29 LEU H . . 5.250 4.467 4.313 4.643 . 0 0 "[ . 1 . 2]" 1
562 1 28 ASN HB3 1 31 TYR QD . . 4.600 3.491 2.794 4.601 0.001 15 0 "[ . 1 . 2]" 1
563 1 28 ASN HB3 1 32 GLN HE21 . . 4.920 4.470 4.036 4.846 . 0 0 "[ . 1 . 2]" 1
564 1 29 LEU H 1 29 LEU QB . . 2.950 2.219 2.197 2.230 . 0 0 "[ . 1 . 2]" 1
565 1 29 LEU H 1 29 LEU MD1 . . 4.340 3.993 3.855 4.169 . 0 0 "[ . 1 . 2]" 1
566 1 29 LEU H 1 29 LEU MD2 . . 4.240 4.077 3.973 4.144 . 0 0 "[ . 1 . 2]" 1
567 1 29 LEU H 1 29 LEU HG . . 4.640 4.601 4.561 4.614 . 0 0 "[ . 1 . 2]" 1
568 1 29 LEU H 1 30 ARG H . . 4.150 2.912 2.813 3.022 . 0 0 "[ . 1 . 2]" 1
569 1 29 LEU H 1 30 ARG HA . . 5.500 5.433 5.357 5.501 0.001 18 0 "[ . 1 . 2]" 1
570 1 29 LEU H 1 80 PHE QE . . 4.690 4.110 3.834 4.430 . 0 0 "[ . 1 . 2]" 1
571 1 29 LEU H 1 80 PHE HZ . . 4.050 3.494 2.945 3.942 . 0 0 "[ . 1 . 2]" 1
572 1 29 LEU HA 1 29 LEU MD1 . . 4.080 3.404 3.260 3.487 . 0 0 "[ . 1 . 2]" 1
573 1 29 LEU HA 1 29 LEU MD2 . . 3.230 2.073 1.931 2.189 . 0 0 "[ . 1 . 2]" 1
574 1 29 LEU HA 1 29 LEU HG . . 4.150 3.718 3.571 3.795 . 0 0 "[ . 1 . 2]" 1
575 1 29 LEU HA 1 31 TYR H . . 4.660 3.810 3.643 4.030 . 0 0 "[ . 1 . 2]" 1
576 1 29 LEU HA 1 32 GLN H . . 4.040 3.014 2.890 3.165 . 0 0 "[ . 1 . 2]" 1
577 1 29 LEU HA 1 32 GLN HB2 . . 3.650 2.680 2.407 2.844 . 0 0 "[ . 1 . 2]" 1
578 1 29 LEU HA 1 32 GLN HE21 . . 5.260 4.740 4.508 5.060 . 0 0 "[ . 1 . 2]" 1
579 1 29 LEU HA 1 79 VAL MG1 . . 4.880 4.618 4.461 4.835 . 0 0 "[ . 1 . 2]" 1
580 1 29 LEU HA 1 80 PHE QD . . 5.500 4.499 4.332 4.657 . 0 0 "[ . 1 . 2]" 1
581 1 29 LEU HA 1 80 PHE QE . . 3.810 2.800 2.613 3.007 . 0 0 "[ . 1 . 2]" 1
582 1 29 LEU HA 1 80 PHE HZ . . 3.780 3.192 2.690 3.486 . 0 0 "[ . 1 . 2]" 1
583 1 29 LEU QB 1 29 LEU MD1 . . 3.100 2.058 1.982 2.108 . 0 0 "[ . 1 . 2]" 1
584 1 29 LEU QB 1 29 LEU MD2 . . 3.070 2.440 2.345 2.513 . 0 0 "[ . 1 . 2]" 1
585 1 29 LEU QB 1 30 ARG H . . 3.690 2.232 2.039 2.358 . 0 0 "[ . 1 . 2]" 1
586 1 29 LEU QB 1 80 PHE QE . . 4.100 2.310 1.974 2.575 . 0 0 "[ . 1 . 2]" 1
587 1 29 LEU QB 1 80 PHE HZ . . 3.810 3.191 2.686 3.471 . 0 0 "[ . 1 . 2]" 1
588 1 29 LEU MD1 1 30 ARG H . . 4.280 2.373 2.056 2.743 . 0 0 "[ . 1 . 2]" 1
589 1 29 LEU MD1 1 30 ARG HA . . 5.100 2.318 2.130 2.678 . 0 0 "[ . 1 . 2]" 1
590 1 29 LEU MD1 1 32 GLN H . . 5.280 4.387 4.181 4.649 . 0 0 "[ . 1 . 2]" 1
591 1 29 LEU MD1 1 32 GLN HB2 . . 4.610 4.037 3.739 4.227 . 0 0 "[ . 1 . 2]" 1
592 1 29 LEU MD1 1 33 LEU MD1 . . 2.920 1.959 1.752 2.203 . 0 0 "[ . 1 . 2]" 1
593 1 29 LEU MD1 1 33 LEU MD2 . . 5.120 3.697 3.424 3.886 . 0 0 "[ . 1 . 2]" 1
594 1 29 LEU MD1 1 80 PHE QE . . 5.400 4.391 4.209 4.527 . 0 0 "[ . 1 . 2]" 1
595 1 29 LEU MD2 1 30 ARG H . . 5.500 3.843 3.713 4.042 . 0 0 "[ . 1 . 2]" 1
596 1 29 LEU MD2 1 30 ARG HA . . 4.820 3.944 3.718 4.248 . 0 0 "[ . 1 . 2]" 1
597 1 29 LEU MD2 1 32 GLN H . . 4.620 3.505 3.250 3.728 . 0 0 "[ . 1 . 2]" 1
598 1 29 LEU MD2 1 32 GLN HB2 . . 3.620 2.161 1.955 2.427 . 0 0 "[ . 1 . 2]" 1
599 1 29 LEU MD2 1 32 GLN HB3 . . 4.450 3.482 3.377 3.697 . 0 0 "[ . 1 . 2]" 1
600 1 29 LEU MD2 1 32 GLN HG2 . . 4.480 4.026 3.852 4.296 . 0 0 "[ . 1 . 2]" 1
601 1 29 LEU MD2 1 33 LEU H . . 3.640 2.987 2.455 3.340 . 0 0 "[ . 1 . 2]" 1
602 1 29 LEU MD2 1 33 LEU MD1 . . 3.220 2.434 2.053 2.807 . 0 0 "[ . 1 . 2]" 1
603 1 29 LEU MD2 1 33 LEU MD2 . . 3.210 2.814 2.683 2.956 . 0 0 "[ . 1 . 2]" 1
604 1 29 LEU MD2 1 33 LEU HG . . 3.480 2.082 1.807 2.333 . 0 0 "[ . 1 . 2]" 1
605 1 29 LEU MD2 1 80 PHE QD . . 4.640 2.913 2.644 3.202 . 0 0 "[ . 1 . 2]" 1
606 1 29 LEU MD2 1 80 PHE QE . . 3.310 2.087 1.979 2.357 . 0 0 "[ . 1 . 2]" 1
607 1 29 LEU MD2 1 80 PHE HZ . . 4.280 3.916 3.683 4.180 . 0 0 "[ . 1 . 2]" 1
608 1 29 LEU HG 1 30 ARG HA . . 5.500 5.190 5.042 5.456 . 0 0 "[ . 1 . 2]" 1
609 1 29 LEU HG 1 33 LEU MD1 . . 3.990 3.677 3.350 3.988 . 0 0 "[ . 1 . 2]" 1
610 1 29 LEU HG 1 33 LEU MD2 . . 5.030 4.972 4.743 5.034 0.004 7 0 "[ . 1 . 2]" 1
611 1 29 LEU HG 1 33 LEU HG . . 4.700 4.502 3.962 4.707 0.007 4 0 "[ . 1 . 2]" 1
612 1 29 LEU HG 1 80 PHE QE . . 5.500 3.373 3.092 3.679 . 0 0 "[ . 1 . 2]" 1
613 1 30 ARG H 1 30 ARG HB2 . . 3.400 2.446 2.274 2.602 . 0 0 "[ . 1 . 2]" 1
614 1 30 ARG H 1 30 ARG HB3 . . 3.480 2.672 2.491 2.874 . 0 0 "[ . 1 . 2]" 1
615 1 30 ARG H 1 30 ARG HG2 . . 4.680 4.474 4.413 4.602 . 0 0 "[ . 1 . 2]" 1
616 1 30 ARG H 1 31 TYR H . . 4.040 2.910 2.825 2.993 . 0 0 "[ . 1 . 2]" 1
617 1 30 ARG H 1 32 GLN H . . 5.500 4.388 4.271 4.536 . 0 0 "[ . 1 . 2]" 1
618 1 30 ARG H 1 48 ILE MD . . 4.430 3.703 3.438 3.937 . 0 0 "[ . 1 . 2]" 1
619 1 30 ARG HA 1 30 ARG QD . . 4.790 4.207 4.048 4.348 . 0 0 "[ . 1 . 2]" 1
620 1 30 ARG HA 1 30 ARG HG2 . . 3.450 2.896 2.506 3.289 . 0 0 "[ . 1 . 2]" 1
621 1 30 ARG HA 1 30 ARG HG3 . . 3.430 2.801 2.372 3.087 . 0 0 "[ . 1 . 2]" 1
622 1 30 ARG HA 1 32 GLN H . . 4.870 4.618 4.485 4.769 . 0 0 "[ . 1 . 2]" 1
623 1 30 ARG HA 1 33 LEU H . . 4.180 3.922 3.678 4.104 . 0 0 "[ . 1 . 2]" 1
624 1 30 ARG HA 1 33 LEU MD1 . . 4.050 3.176 2.752 3.628 . 0 0 "[ . 1 . 2]" 1
625 1 30 ARG HA 1 34 LEU MD1 . . 4.960 3.968 3.758 4.144 . 0 0 "[ . 1 . 2]" 1
626 1 30 ARG HA 1 48 ILE MD . . 3.290 2.255 1.995 2.457 . 0 0 "[ . 1 . 2]" 1
627 1 30 ARG HA 1 48 ILE MG . . 5.460 4.179 3.927 4.412 . 0 0 "[ . 1 . 2]" 1
628 1 30 ARG HB2 1 30 ARG QD . . 3.280 2.896 2.495 3.262 . 0 0 "[ . 1 . 2]" 1
629 1 30 ARG HB2 1 31 TYR H . . 4.220 4.020 3.842 4.162 . 0 0 "[ . 1 . 2]" 1
630 1 30 ARG HB2 1 48 ILE MD . . 4.090 2.656 2.137 3.089 . 0 0 "[ . 1 . 2]" 1
631 1 30 ARG HB3 1 30 ARG QD . . 3.120 2.590 2.318 2.904 . 0 0 "[ . 1 . 2]" 1
632 1 30 ARG HB3 1 31 TYR H . . 3.320 2.885 2.699 3.071 . 0 0 "[ . 1 . 2]" 1
633 1 30 ARG HB3 1 31 TYR HB2 . . 4.770 4.508 4.285 4.733 . 0 0 "[ . 1 . 2]" 1
634 1 30 ARG HB3 1 31 TYR HB3 . . 5.050 4.673 4.533 4.838 . 0 0 "[ . 1 . 2]" 1
635 1 30 ARG HB3 1 48 ILE MD . . 4.130 3.872 3.519 4.129 . 0 0 "[ . 1 . 2]" 1
636 1 30 ARG HD2 1 34 LEU MD1 . . 4.070 2.901 2.185 3.653 . 0 0 "[ . 1 . 2]" 1
637 1 30 ARG HD2 1 46 HIS HE1 . . 4.420 3.647 2.744 4.423 0.003 7 0 "[ . 1 . 2]" 1
638 1 30 ARG HD2 1 48 ILE MD . . 4.580 4.293 3.564 4.573 . 0 0 "[ . 1 . 2]" 1
639 1 30 ARG HD3 1 34 LEU MD1 . . 4.070 3.538 2.349 4.019 . 0 0 "[ . 1 . 2]" 1
640 1 30 ARG HD3 1 46 HIS HE1 . . 4.420 3.605 2.463 4.392 . 0 0 "[ . 1 . 2]" 1
641 1 30 ARG HD3 1 48 ILE MD . . 4.580 3.844 3.200 4.437 . 0 0 "[ . 1 . 2]" 1
642 1 30 ARG HG2 1 31 TYR H . . 4.510 4.056 3.655 4.455 . 0 0 "[ . 1 . 2]" 1
643 1 30 ARG HG2 1 31 TYR HA . . 4.520 3.920 3.496 4.454 . 0 0 "[ . 1 . 2]" 1
644 1 30 ARG HG2 1 34 LEU MD1 . . 3.200 1.972 1.785 2.121 . 0 0 "[ . 1 . 2]" 1
645 1 30 ARG HG3 1 34 LEU MD1 . . 4.140 2.954 2.351 3.530 . 0 0 "[ . 1 . 2]" 1
646 1 31 TYR H 1 31 TYR HB2 . . 3.110 2.965 2.808 3.106 . 0 0 "[ . 1 . 2]" 1
647 1 31 TYR H 1 31 TYR HB3 . . 2.940 2.264 2.193 2.351 . 0 0 "[ . 1 . 2]" 1
648 1 31 TYR H 1 31 TYR QD . . 4.100 3.971 3.795 4.097 . 0 0 "[ . 1 . 2]" 1
649 1 31 TYR H 1 32 GLN H . . 3.030 2.418 2.278 2.637 . 0 0 "[ . 1 . 2]" 1
650 1 31 TYR H 1 32 GLN HG2 . . 4.420 4.195 4.026 4.421 0.001 20 0 "[ . 1 . 2]" 1
651 1 31 TYR H 1 33 LEU H . . 4.510 4.044 3.802 4.308 . 0 0 "[ . 1 . 2]" 1
652 1 31 TYR H 1 34 LEU MD1 . . 5.500 4.285 4.042 4.464 . 0 0 "[ . 1 . 2]" 1
653 1 31 TYR H 1 48 ILE MD . . 5.500 5.056 4.791 5.315 . 0 0 "[ . 1 . 2]" 1
654 1 31 TYR HA 1 31 TYR QD . . 3.530 3.068 2.892 3.211 . 0 0 "[ . 1 . 2]" 1
655 1 31 TYR HA 1 31 TYR QE . . 5.010 4.912 4.813 5.015 0.005 9 0 "[ . 1 . 2]" 1
656 1 31 TYR HA 1 33 LEU H . . 4.660 4.229 3.903 4.658 . 0 0 "[ . 1 . 2]" 1
657 1 31 TYR HA 1 34 LEU H . . 3.710 3.321 3.147 3.679 . 0 0 "[ . 1 . 2]" 1
658 1 31 TYR HA 1 34 LEU HB2 . . 3.990 2.405 2.263 2.605 . 0 0 "[ . 1 . 2]" 1
659 1 31 TYR HA 1 34 LEU HB3 . . 4.390 4.053 3.884 4.308 . 0 0 "[ . 1 . 2]" 1
660 1 31 TYR HA 1 34 LEU MD1 . . 4.030 2.644 2.298 2.835 . 0 0 "[ . 1 . 2]" 1
661 1 31 TYR HA 1 34 LEU HG . . 4.360 3.964 3.761 4.284 . 0 0 "[ . 1 . 2]" 1
662 1 31 TYR HA 1 35 GLN H . . 3.990 3.847 3.661 3.995 0.005 4 0 "[ . 1 . 2]" 1
663 1 31 TYR HB2 1 32 GLN H . . 4.160 4.046 3.933 4.160 0.000 19 0 "[ . 1 . 2]" 1
664 1 31 TYR HB3 1 32 GLN H . . 3.300 2.745 2.563 2.928 . 0 0 "[ . 1 . 2]" 1
665 1 31 TYR HB3 1 34 LEU MD1 . . 5.480 5.073 4.791 5.248 . 0 0 "[ . 1 . 2]" 1
666 1 31 TYR QD 1 32 GLN H . . 4.210 2.872 2.637 3.112 . 0 0 "[ . 1 . 2]" 1
667 1 31 TYR QD 1 32 GLN HA . . 4.240 2.957 2.544 3.361 . 0 0 "[ . 1 . 2]" 1
668 1 31 TYR QD 1 32 GLN HB2 . . 4.750 4.662 4.424 4.752 0.002 14 0 "[ . 1 . 2]" 1
669 1 31 TYR QD 1 32 GLN HG2 . . 4.400 2.481 2.263 2.732 . 0 0 "[ . 1 . 2]" 1
670 1 31 TYR QD 1 32 GLN HG3 . . 4.460 4.193 3.980 4.391 . 0 0 "[ . 1 . 2]" 1
671 1 31 TYR QD 1 33 LEU H . . 5.430 5.073 4.728 5.413 . 0 0 "[ . 1 . 2]" 1
672 1 31 TYR QD 1 34 LEU MD1 . . 4.560 4.452 4.202 4.559 . 0 0 "[ . 1 . 2]" 1
673 1 31 TYR QD 1 35 GLN H . . 5.500 4.647 4.380 4.770 . 0 0 "[ . 1 . 2]" 1
674 1 31 TYR QD 1 35 GLN QB . . 5.340 3.815 3.149 4.468 . 0 0 "[ . 1 . 2]" 1
675 1 31 TYR QD 1 35 GLN QG . . 3.910 3.441 2.796 3.912 0.002 15 0 "[ . 1 . 2]" 1
676 1 31 TYR QE 1 32 GLN H . . 5.400 4.959 4.709 5.165 . 0 0 "[ . 1 . 2]" 1
677 1 31 TYR QE 1 32 GLN HA . . 4.420 3.766 3.481 3.966 . 0 0 "[ . 1 . 2]" 1
678 1 31 TYR QE 1 32 GLN HG2 . . 5.080 4.190 3.844 4.580 . 0 0 "[ . 1 . 2]" 1
679 1 31 TYR QE 1 35 GLN H . . 5.280 5.197 4.963 5.286 0.006 20 0 "[ . 1 . 2]" 1
680 1 31 TYR QE 1 35 GLN QB . . 4.410 3.478 2.739 4.094 . 0 0 "[ . 1 . 2]" 1
681 1 31 TYR QE 1 35 GLN HE21 . . 4.070 3.297 2.360 4.071 0.001 12 0 "[ . 1 . 2]" 1
682 1 31 TYR QE 1 35 GLN QG . . 3.770 3.164 2.417 3.717 . 0 0 "[ . 1 . 2]" 1
683 1 32 GLN H 1 32 GLN HB2 . . 3.270 2.571 2.507 2.644 . 0 0 "[ . 1 . 2]" 1
684 1 32 GLN H 1 32 GLN HB3 . . 3.640 3.590 3.587 3.594 . 0 0 "[ . 1 . 2]" 1
685 1 32 GLN H 1 32 GLN HE21 . . 4.550 4.341 4.127 4.456 . 0 0 "[ . 1 . 2]" 1
686 1 32 GLN H 1 32 GLN HG2 . . 3.420 2.193 2.031 2.308 . 0 0 "[ . 1 . 2]" 1
687 1 32 GLN H 1 32 GLN HG3 . . 3.240 3.026 2.825 3.194 . 0 0 "[ . 1 . 2]" 1
688 1 32 GLN H 1 33 LEU H . . 3.340 2.780 2.612 2.926 . 0 0 "[ . 1 . 2]" 1
689 1 32 GLN H 1 79 VAL MG1 . . 5.120 5.108 4.999 5.128 0.008 20 0 "[ . 1 . 2]" 1
690 1 32 GLN HA 1 32 GLN HE21 . . 4.270 4.084 3.850 4.247 . 0 0 "[ . 1 . 2]" 1
691 1 32 GLN HA 1 32 GLN HE22 . . 5.180 4.670 4.429 4.897 . 0 0 "[ . 1 . 2]" 1
692 1 32 GLN HA 1 32 GLN HG2 . . 3.390 2.623 2.518 2.730 . 0 0 "[ . 1 . 2]" 1
693 1 32 GLN HA 1 32 GLN HG3 . . 3.840 3.765 3.718 3.798 . 0 0 "[ . 1 . 2]" 1
694 1 32 GLN HA 1 35 GLN H . . 4.380 3.741 3.562 3.865 . 0 0 "[ . 1 . 2]" 1
695 1 32 GLN HA 1 35 GLN QB . . 3.450 3.032 2.485 3.402 . 0 0 "[ . 1 . 2]" 1
696 1 32 GLN HA 1 35 GLN HG2 . . 4.070 2.686 1.998 3.963 . 0 0 "[ . 1 . 2]" 1
697 1 32 GLN HA 1 35 GLN QG . . 3.270 2.485 1.985 3.273 0.003 14 0 "[ . 1 . 2]" 1
698 1 32 GLN HA 1 35 GLN HG3 . . 4.070 3.478 3.204 3.808 . 0 0 "[ . 1 . 2]" 1
699 1 32 GLN HA 1 79 VAL MG1 . . 4.610 4.357 4.197 4.546 . 0 0 "[ . 1 . 2]" 1
700 1 32 GLN HB2 1 32 GLN HG3 . . 2.990 2.225 2.206 2.255 . 0 0 "[ . 1 . 2]" 1
701 1 32 GLN HB2 1 33 LEU H . . 4.370 2.643 2.330 2.941 . 0 0 "[ . 1 . 2]" 1
702 1 32 GLN HB2 1 79 VAL MG1 . . 3.450 3.004 2.911 3.100 . 0 0 "[ . 1 . 2]" 1
703 1 32 GLN HB3 1 32 GLN HG2 . . 2.990 2.913 2.855 2.960 . 0 0 "[ . 1 . 2]" 1
704 1 32 GLN HB3 1 33 LEU H . . 4.120 3.703 3.421 4.006 . 0 0 "[ . 1 . 2]" 1
705 1 32 GLN HB3 1 33 LEU MD2 . . 4.750 4.291 3.980 4.520 . 0 0 "[ . 1 . 2]" 1
706 1 32 GLN HB3 1 79 VAL HA . . 4.120 3.958 3.830 4.046 . 0 0 "[ . 1 . 2]" 1
707 1 32 GLN HB3 1 79 VAL MG1 . . 3.780 2.291 2.180 2.474 . 0 0 "[ . 1 . 2]" 1
708 1 32 GLN HB3 1 79 VAL MG2 . . 4.130 3.845 3.609 3.992 . 0 0 "[ . 1 . 2]" 1
709 1 32 GLN HB3 1 80 PHE H . . 4.630 3.708 3.520 3.835 . 0 0 "[ . 1 . 2]" 1
710 1 32 GLN HE21 1 80 PHE HA . . 5.500 4.878 4.655 5.310 . 0 0 "[ . 1 . 2]" 1
711 1 32 GLN HE22 1 80 PHE H . . 5.180 4.231 3.885 4.645 . 0 0 "[ . 1 . 2]" 1
712 1 32 GLN HG2 1 33 LEU H . . 4.500 4.391 4.278 4.499 . 0 0 "[ . 1 . 2]" 1
713 1 32 GLN HG2 1 79 VAL MG1 . . 4.810 4.661 4.569 4.776 . 0 0 "[ . 1 . 2]" 1
714 1 32 GLN HG2 1 80 PHE HZ . . 5.410 4.464 4.007 4.898 . 0 0 "[ . 1 . 2]" 1
715 1 32 GLN HG3 1 33 LEU H . . 4.630 4.585 4.441 4.639 0.009 12 0 "[ . 1 . 2]" 1
716 1 32 GLN HG3 1 80 PHE H . . 5.500 4.965 4.600 5.317 . 0 0 "[ . 1 . 2]" 1
717 1 32 GLN HG3 1 80 PHE QD . . 4.660 3.910 3.712 4.131 . 0 0 "[ . 1 . 2]" 1
718 1 32 GLN HG3 1 80 PHE QE . . 3.920 3.146 2.971 3.384 . 0 0 "[ . 1 . 2]" 1
719 1 32 GLN HG3 1 80 PHE HZ . . 4.580 3.197 2.809 3.665 . 0 0 "[ . 1 . 2]" 1
720 1 33 LEU H 1 33 LEU HB2 . . 2.920 2.458 2.346 2.549 . 0 0 "[ . 1 . 2]" 1
721 1 33 LEU H 1 33 LEU HB3 . . 3.610 3.602 3.571 3.636 0.026 2 0 "[ . 1 . 2]" 1
722 1 33 LEU H 1 33 LEU MD1 . . 3.940 3.592 3.281 3.795 . 0 0 "[ . 1 . 2]" 1
723 1 33 LEU H 1 33 LEU MD2 . . 3.780 3.555 3.342 3.749 . 0 0 "[ . 1 . 2]" 1
724 1 33 LEU H 1 33 LEU HG . . 3.090 2.403 2.171 2.733 . 0 0 "[ . 1 . 2]" 1
725 1 33 LEU H 1 36 LEU MD1 . . 4.620 4.558 4.351 4.620 . 0 0 "[ . 1 . 2]" 1
726 1 33 LEU H 1 48 ILE MD . . 5.070 4.896 4.662 5.072 0.002 7 0 "[ . 1 . 2]" 1
727 1 33 LEU H 1 57 ILE MD . . 5.240 4.781 4.525 5.032 . 0 0 "[ . 1 . 2]" 1
728 1 33 LEU H 1 79 VAL MG1 . . 5.420 4.380 3.976 4.699 . 0 0 "[ . 1 . 2]" 1
729 1 33 LEU H 1 79 VAL MG2 . . 5.500 5.170 4.898 5.376 . 0 0 "[ . 1 . 2]" 1
730 1 33 LEU HA 1 33 LEU MD1 . . 4.100 3.897 3.840 3.954 . 0 0 "[ . 1 . 2]" 1
731 1 33 LEU HA 1 33 LEU MD2 . . 3.090 2.154 2.007 2.311 . 0 0 "[ . 1 . 2]" 1
732 1 33 LEU HA 1 33 LEU HG . . 3.920 3.055 2.973 3.147 . 0 0 "[ . 1 . 2]" 1
733 1 33 LEU HA 1 36 LEU H . . 4.050 3.760 3.693 3.883 . 0 0 "[ . 1 . 2]" 1
734 1 33 LEU HA 1 36 LEU HB2 . . 4.930 3.820 3.643 3.939 . 0 0 "[ . 1 . 2]" 1
735 1 33 LEU HA 1 36 LEU HB3 . . 5.030 5.023 4.960 5.037 0.007 9 0 "[ . 1 . 2]" 1
736 1 33 LEU HA 1 36 LEU MD1 . . 3.380 2.055 1.975 2.316 . 0 0 "[ . 1 . 2]" 1
737 1 33 LEU HA 1 36 LEU HG . . 3.830 2.770 2.600 3.022 . 0 0 "[ . 1 . 2]" 1
738 1 33 LEU HB2 1 33 LEU MD1 . . 3.320 2.202 2.120 2.357 . 0 0 "[ . 1 . 2]" 1
739 1 33 LEU HB2 1 33 LEU MD2 . . 3.500 3.175 3.155 3.188 . 0 0 "[ . 1 . 2]" 1
740 1 33 LEU HB2 1 34 LEU MD1 . . 5.130 4.671 4.597 4.765 . 0 0 "[ . 1 . 2]" 1
741 1 33 LEU HB2 1 34 LEU MD2 . . 5.430 4.376 4.198 4.624 . 0 0 "[ . 1 . 2]" 1
742 1 33 LEU HB2 1 57 ILE MD . . 4.100 3.129 2.872 3.451 . 0 0 "[ . 1 . 2]" 1
743 1 33 LEU HB3 1 33 LEU MD1 . . 3.260 2.481 2.345 2.575 . 0 0 "[ . 1 . 2]" 1
744 1 33 LEU HB3 1 33 LEU MD2 . . 3.190 2.260 2.167 2.326 . 0 0 "[ . 1 . 2]" 1
745 1 33 LEU HB3 1 34 LEU H . . 3.680 3.572 3.240 3.683 0.003 7 0 "[ . 1 . 2]" 1
746 1 33 LEU HB3 1 57 ILE MD . . 4.360 2.555 2.216 2.736 . 0 0 "[ . 1 . 2]" 1
747 1 33 LEU MD1 1 34 LEU H . . 4.860 4.327 4.094 4.545 . 0 0 "[ . 1 . 2]" 1
748 1 33 LEU MD1 1 48 ILE HA . . 4.880 4.541 4.391 4.699 . 0 0 "[ . 1 . 2]" 1
749 1 33 LEU MD1 1 48 ILE HB . . 4.910 4.848 4.746 4.915 0.005 4 0 "[ . 1 . 2]" 1
750 1 33 LEU MD1 1 48 ILE MD . . 3.240 2.324 2.108 2.600 . 0 0 "[ . 1 . 2]" 1
751 1 33 LEU MD1 1 48 ILE HG12 . . 4.220 3.376 3.158 3.567 . 0 0 "[ . 1 . 2]" 1
752 1 33 LEU MD1 1 48 ILE HG13 . . 4.660 4.580 4.416 4.661 0.001 10 0 "[ . 1 . 2]" 1
753 1 33 LEU MD1 1 48 ILE MG . . 3.290 2.603 2.400 2.777 . 0 0 "[ . 1 . 2]" 1
754 1 33 LEU MD1 1 55 ALA HA . . 5.230 4.611 4.434 4.792 . 0 0 "[ . 1 . 2]" 1
755 1 33 LEU MD1 1 55 ALA MB . . 3.190 2.188 2.028 2.337 . 0 0 "[ . 1 . 2]" 1
756 1 33 LEU MD1 1 57 ILE MD . . 4.240 3.761 3.451 3.963 . 0 0 "[ . 1 . 2]" 1
757 1 33 LEU MD1 1 79 VAL MG1 . . 5.490 4.306 4.100 4.503 . 0 0 "[ . 1 . 2]" 1
758 1 33 LEU MD1 1 79 VAL MG2 . . 5.300 4.943 4.753 5.212 . 0 0 "[ . 1 . 2]" 1
759 1 33 LEU MD2 1 36 LEU MD1 . . 3.470 2.399 2.207 2.616 . 0 0 "[ . 1 . 2]" 1
760 1 33 LEU MD2 1 36 LEU HG . . 4.790 4.134 4.004 4.300 . 0 0 "[ . 1 . 2]" 1
761 1 33 LEU MD2 1 48 ILE MD . . 5.090 4.741 4.553 4.931 . 0 0 "[ . 1 . 2]" 1
762 1 33 LEU MD2 1 48 ILE MG . . 5.500 4.554 4.429 4.745 . 0 0 "[ . 1 . 2]" 1
763 1 33 LEU MD2 1 55 ALA MB . . 3.970 3.286 2.984 3.554 . 0 0 "[ . 1 . 2]" 1
764 1 33 LEU MD2 1 79 VAL HB . . 4.640 4.236 3.999 4.442 . 0 0 "[ . 1 . 2]" 1
765 1 33 LEU MD2 1 79 VAL MG1 . . 2.890 2.449 2.294 2.643 . 0 0 "[ . 1 . 2]" 1
766 1 33 LEU MD2 1 79 VAL MG2 . . 3.240 2.731 2.552 3.035 . 0 0 "[ . 1 . 2]" 1
767 1 33 LEU HG 1 79 VAL MG2 . . 4.850 4.547 4.344 4.851 0.001 16 0 "[ . 1 . 2]" 1
768 1 34 LEU H 1 34 LEU HB2 . . 3.430 2.377 2.328 2.471 . 0 0 "[ . 1 . 2]" 1
769 1 34 LEU H 1 34 LEU HB3 . . 3.670 3.572 3.560 3.586 . 0 0 "[ . 1 . 2]" 1
770 1 34 LEU H 1 34 LEU MD1 . . 3.520 3.494 3.400 3.524 0.004 7 0 "[ . 1 . 2]" 1
771 1 34 LEU H 1 34 LEU MD2 . . 3.770 3.667 3.522 3.752 . 0 0 "[ . 1 . 2]" 1
772 1 34 LEU H 1 34 LEU HG . . 2.890 2.464 2.254 2.559 . 0 0 "[ . 1 . 2]" 1
773 1 34 LEU HA 1 34 LEU MD1 . . 3.910 3.884 3.869 3.907 . 0 0 "[ . 1 . 2]" 1
774 1 34 LEU HA 1 34 LEU MD2 . . 3.190 2.223 2.012 2.363 . 0 0 "[ . 1 . 2]" 1
775 1 34 LEU HA 1 34 LEU HG . . 4.020 2.899 2.810 2.957 . 0 0 "[ . 1 . 2]" 1
776 1 34 LEU HA 1 36 LEU H . . 4.260 3.534 3.444 3.597 . 0 0 "[ . 1 . 2]" 1
777 1 34 LEU HA 1 37 VAL H . . 3.930 3.544 3.394 3.654 . 0 0 "[ . 1 . 2]" 1
778 1 34 LEU HA 1 37 VAL MG1 . . 4.360 3.935 3.757 4.251 . 0 0 "[ . 1 . 2]" 1
779 1 34 LEU HA 1 37 VAL MG2 . . 3.390 2.459 2.335 2.614 . 0 0 "[ . 1 . 2]" 1
780 1 34 LEU HA 1 43 ILE MD . . 3.500 3.227 3.018 3.403 . 0 0 "[ . 1 . 2]" 1
781 1 34 LEU HA 1 57 ILE MD . . 3.240 2.192 1.991 2.344 . 0 0 "[ . 1 . 2]" 1
782 1 34 LEU HA 1 57 ILE MG . . 4.320 3.501 3.201 3.690 . 0 0 "[ . 1 . 2]" 1
783 1 34 LEU HB2 1 34 LEU MD1 . . 3.050 2.171 2.107 2.276 . 0 0 "[ . 1 . 2]" 1
784 1 34 LEU HB2 1 34 LEU MD2 . . 3.370 3.176 3.164 3.187 . 0 0 "[ . 1 . 2]" 1
785 1 34 LEU HB2 1 34 LEU HG . . 2.880 2.530 2.517 2.546 . 0 0 "[ . 1 . 2]" 1
786 1 34 LEU HB2 1 35 GLN H . . 4.460 2.982 2.755 3.110 . 0 0 "[ . 1 . 2]" 1
787 1 34 LEU HB2 1 37 VAL MG2 . . 5.040 4.675 4.543 4.776 . 0 0 "[ . 1 . 2]" 1
788 1 34 LEU HB2 1 38 GLU HG2 . . 5.440 5.196 4.769 5.410 . 0 0 "[ . 1 . 2]" 1
789 1 34 LEU HB2 1 38 GLU HG3 . . 4.930 3.984 3.562 4.302 . 0 0 "[ . 1 . 2]" 1
790 1 34 LEU HB2 1 43 ILE MD . . 4.230 4.221 4.172 4.233 0.003 18 0 "[ . 1 . 2]" 1
791 1 34 LEU HB3 1 34 LEU MD1 . . 3.520 2.521 2.450 2.560 . 0 0 "[ . 1 . 2]" 1
792 1 34 LEU HB3 1 35 GLN HA . . 4.470 4.405 4.267 4.473 0.003 12 0 "[ . 1 . 2]" 1
793 1 34 LEU HB3 1 43 ILE MD . . 3.210 2.668 2.586 2.756 . 0 0 "[ . 1 . 2]" 1
794 1 34 LEU MD1 1 43 ILE MD . . 3.780 3.744 3.659 3.782 0.002 20 0 "[ . 1 . 2]" 1
795 1 34 LEU MD1 1 46 HIS QB . . 5.340 3.658 3.220 3.935 . 0 0 "[ . 1 . 2]" 1
796 1 34 LEU MD1 1 46 HIS HE1 . . 4.370 3.855 2.794 4.368 . 0 0 "[ . 1 . 2]" 1
797 1 34 LEU MD1 1 48 ILE MD . . 4.190 3.983 3.733 4.193 0.003 17 0 "[ . 1 . 2]" 1
798 1 34 LEU MD2 1 37 VAL MG2 . . 3.550 2.904 2.763 3.003 . 0 0 "[ . 1 . 2]" 1
799 1 34 LEU MD2 1 38 GLU HG2 . . 4.720 4.550 4.351 4.710 . 0 0 "[ . 1 . 2]" 1
800 1 34 LEU MD2 1 43 ILE HB . . 4.320 4.032 3.637 4.315 . 0 0 "[ . 1 . 2]" 1
801 1 34 LEU MD2 1 43 ILE MD . . 2.940 2.113 1.926 2.398 . 0 0 "[ . 1 . 2]" 1
802 1 34 LEU MD2 1 43 ILE MG . . 3.320 1.883 1.744 2.011 . 0 0 "[ . 1 . 2]" 1
803 1 34 LEU MD2 1 46 HIS HA . . 4.840 4.248 3.962 4.548 . 0 0 "[ . 1 . 2]" 1
804 1 34 LEU MD2 1 46 HIS HB2 . . 4.260 2.923 2.502 3.396 . 0 0 "[ . 1 . 2]" 1
805 1 34 LEU MD2 1 46 HIS QB . . 3.630 2.132 1.913 2.412 . 0 0 "[ . 1 . 2]" 1
806 1 34 LEU MD2 1 46 HIS HB3 . . 4.260 2.192 1.959 2.504 . 0 0 "[ . 1 . 2]" 1
807 1 34 LEU MD2 1 46 HIS HD2 . . 4.950 3.609 2.865 4.325 . 0 0 "[ . 1 . 2]" 1
808 1 34 LEU MD2 1 47 LEU H . . 5.500 5.090 4.695 5.403 . 0 0 "[ . 1 . 2]" 1
809 1 34 LEU MD2 1 57 ILE MD . . 2.660 2.197 1.975 2.410 . 0 0 "[ . 1 . 2]" 1
810 1 34 LEU MD2 1 57 ILE HG12 . . 3.400 2.108 1.974 2.268 . 0 0 "[ . 1 . 2]" 1
811 1 34 LEU MD2 1 57 ILE HG13 . . 4.540 3.535 3.345 3.692 . 0 0 "[ . 1 . 2]" 1
812 1 34 LEU MD2 1 57 ILE MG . . 3.290 2.379 2.174 2.642 . 0 0 "[ . 1 . 2]" 1
813 1 34 LEU MD2 1 58 GLU H . . 5.500 4.861 4.711 5.008 . 0 0 "[ . 1 . 2]" 1
814 1 34 LEU HG 1 57 ILE MD . . 3.220 3.001 2.644 3.185 . 0 0 "[ . 1 . 2]" 1
815 1 35 GLN H 1 35 GLN QB . . 2.620 2.301 2.129 2.420 . 0 0 "[ . 1 . 2]" 1
816 1 35 GLN H 1 35 GLN HE21 . . 5.060 4.770 3.871 5.060 . 0 0 "[ . 1 . 2]" 1
817 1 35 GLN H 1 35 GLN HG2 . . 4.340 2.989 2.577 3.273 . 0 0 "[ . 1 . 2]" 1
818 1 35 GLN H 1 35 GLN QG . . 3.480 2.626 2.444 2.949 . 0 0 "[ . 1 . 2]" 1
819 1 35 GLN H 1 35 GLN HG3 . . 4.340 3.225 2.616 4.117 . 0 0 "[ . 1 . 2]" 1
820 1 35 GLN H 1 36 LEU H . . 3.270 2.564 2.484 2.694 . 0 0 "[ . 1 . 2]" 1
821 1 35 GLN H 1 36 LEU HG . . 5.190 3.860 3.641 4.166 . 0 0 "[ . 1 . 2]" 1
822 1 35 GLN H 1 38 GLU QB . . 4.650 4.208 4.021 4.280 . 0 0 "[ . 1 . 2]" 1
823 1 35 GLN H 1 38 GLU HG3 . . 5.290 4.742 4.459 4.939 . 0 0 "[ . 1 . 2]" 1
824 1 35 GLN H 1 57 ILE MD . . 5.500 4.626 4.494 4.803 . 0 0 "[ . 1 . 2]" 1
825 1 35 GLN HA 1 35 GLN HE21 . . 4.580 3.602 2.314 4.449 . 0 0 "[ . 1 . 2]" 1
826 1 35 GLN HA 1 35 GLN HE22 . . 5.500 4.520 2.986 5.507 0.007 12 0 "[ . 1 . 2]" 1
827 1 35 GLN HA 1 35 GLN QG . . 3.510 3.116 2.597 3.392 . 0 0 "[ . 1 . 2]" 1
828 1 35 GLN HA 1 37 VAL H . . 3.890 3.701 3.580 3.797 . 0 0 "[ . 1 . 2]" 1
829 1 35 GLN HA 1 37 VAL MG2 . . 4.900 4.600 4.397 4.892 . 0 0 "[ . 1 . 2]" 1
830 1 35 GLN HA 1 38 GLU H . . 3.450 3.120 3.053 3.179 . 0 0 "[ . 1 . 2]" 1
831 1 35 GLN HA 1 38 GLU HA . . 5.110 4.802 4.765 4.818 . 0 0 "[ . 1 . 2]" 1
832 1 35 GLN HA 1 38 GLU QB . . 2.900 1.983 1.957 1.996 . 0 0 "[ . 1 . 2]" 1
833 1 35 GLN HA 1 38 GLU HG2 . . 4.660 4.527 4.428 4.597 . 0 0 "[ . 1 . 2]" 1
834 1 35 GLN HA 1 38 GLU HG3 . . 4.270 3.293 3.137 3.463 . 0 0 "[ . 1 . 2]" 1
835 1 35 GLN HA 1 39 PRO HD2 . . 4.970 3.359 3.227 3.523 . 0 0 "[ . 1 . 2]" 1
836 1 35 GLN HA 1 43 ILE MD . . 5.310 4.959 4.767 5.082 . 0 0 "[ . 1 . 2]" 1
837 1 35 GLN QB 1 35 GLN HE21 . . 4.200 2.419 1.880 3.709 . 0 0 "[ . 1 . 2]" 1
838 1 35 GLN QB 1 36 LEU H . . 3.880 3.521 3.190 3.749 . 0 0 "[ . 1 . 2]" 1
839 1 35 GLN QB 1 39 PRO HD3 . . 5.330 4.045 3.782 4.441 . 0 0 "[ . 1 . 2]" 1
840 1 35 GLN HE22 1 35 GLN QG . . 3.530 3.384 3.255 3.442 . 0 0 "[ . 1 . 2]" 1
841 1 36 LEU H 1 36 LEU HB2 . . 3.110 2.505 2.424 2.577 . 0 0 "[ . 1 . 2]" 1
842 1 36 LEU H 1 36 LEU HB3 . . 3.740 3.622 3.606 3.632 . 0 0 "[ . 1 . 2]" 1
843 1 36 LEU H 1 36 LEU MD1 . . 3.780 3.569 3.472 3.665 . 0 0 "[ . 1 . 2]" 1
844 1 36 LEU H 1 36 LEU MD2 . . 3.600 3.523 3.357 3.601 0.001 9 0 "[ . 1 . 2]" 1
845 1 36 LEU H 1 36 LEU HG . . 2.970 2.365 2.235 2.507 . 0 0 "[ . 1 . 2]" 1
846 1 36 LEU H 1 37 VAL MG1 . . 4.130 3.825 3.682 4.084 . 0 0 "[ . 1 . 2]" 1
847 1 36 LEU H 1 37 VAL MG2 . . 3.880 3.710 3.472 3.814 . 0 0 "[ . 1 . 2]" 1
848 1 36 LEU H 1 38 GLU H . . 3.710 3.603 3.495 3.701 . 0 0 "[ . 1 . 2]" 1
849 1 36 LEU H 1 57 ILE MD . . 4.320 4.125 3.975 4.288 . 0 0 "[ . 1 . 2]" 1
850 1 36 LEU HA 1 36 LEU MD1 . . 4.040 3.920 3.888 3.948 . 0 0 "[ . 1 . 2]" 1
851 1 36 LEU HA 1 36 LEU MD2 . . 3.310 2.226 2.043 2.421 . 0 0 "[ . 1 . 2]" 1
852 1 36 LEU HA 1 36 LEU HG . . 3.700 3.089 3.042 3.178 . 0 0 "[ . 1 . 2]" 1
853 1 36 LEU HA 1 37 VAL MG1 . . 4.450 4.295 4.161 4.409 . 0 0 "[ . 1 . 2]" 1
854 1 36 LEU HB2 1 36 LEU MD1 . . 3.020 2.239 2.124 2.331 . 0 0 "[ . 1 . 2]" 1
855 1 36 LEU HB2 1 36 LEU MD2 . . 3.540 3.183 3.168 3.191 . 0 0 "[ . 1 . 2]" 1
856 1 36 LEU HB2 1 37 VAL H . . 3.640 3.202 3.129 3.287 . 0 0 "[ . 1 . 2]" 1
857 1 36 LEU HB2 1 37 VAL MG1 . . 3.910 2.690 2.580 2.864 . 0 0 "[ . 1 . 2]" 1
858 1 36 LEU HB2 1 37 VAL MG2 . . 4.190 4.059 3.835 4.164 . 0 0 "[ . 1 . 2]" 1
859 1 36 LEU HB2 1 57 ILE MD . . 3.930 3.756 3.546 3.927 . 0 0 "[ . 1 . 2]" 1
860 1 36 LEU HB3 1 36 LEU MD1 . . 3.430 2.432 2.351 2.547 . 0 0 "[ . 1 . 2]" 1
861 1 36 LEU HB3 1 36 LEU MD2 . . 3.160 2.263 2.151 2.363 . 0 0 "[ . 1 . 2]" 1
862 1 36 LEU HB3 1 37 VAL MG1 . . 4.080 3.487 3.303 3.629 . 0 0 "[ . 1 . 2]" 1
863 1 36 LEU MD1 1 37 VAL H . . 5.080 4.860 4.759 4.976 . 0 0 "[ . 1 . 2]" 1
864 1 36 LEU MD1 1 37 VAL MG1 . . 4.240 4.011 3.905 4.166 . 0 0 "[ . 1 . 2]" 1
865 1 36 LEU MD2 1 37 VAL H . . 4.930 4.789 4.730 4.834 . 0 0 "[ . 1 . 2]" 1
866 1 36 LEU HG 1 79 VAL MG2 . . 4.520 3.761 3.577 3.934 . 0 0 "[ . 1 . 2]" 1
867 1 37 VAL H 1 37 VAL MG1 . . 3.270 2.693 2.581 2.873 . 0 0 "[ . 1 . 2]" 1
868 1 37 VAL H 1 37 VAL MG2 . . 3.080 2.198 1.920 2.362 . 0 0 "[ . 1 . 2]" 1
869 1 37 VAL H 1 38 GLU H . . 3.190 1.805 1.796 1.847 . 0 0 "[ . 1 . 2]" 1
870 1 37 VAL H 1 38 GLU QB . . 3.600 3.485 3.458 3.544 . 0 0 "[ . 1 . 2]" 1
871 1 37 VAL H 1 39 PRO HD2 . . 5.380 3.093 2.970 3.249 . 0 0 "[ . 1 . 2]" 1
872 1 37 VAL H 1 43 ILE MD . . 4.310 4.017 3.924 4.167 . 0 0 "[ . 1 . 2]" 1
873 1 37 VAL HA 1 37 VAL MG1 . . 3.340 2.451 2.373 2.528 . 0 0 "[ . 1 . 2]" 1
874 1 37 VAL HA 1 37 VAL MG2 . . 3.460 3.194 3.183 3.201 . 0 0 "[ . 1 . 2]" 1
875 1 37 VAL HA 1 39 PRO HD2 . . 4.690 3.711 3.680 3.754 . 0 0 "[ . 1 . 2]" 1
876 1 37 VAL HA 1 39 PRO HD3 . . 5.480 5.458 5.429 5.494 0.014 6 0 "[ . 1 . 2]" 1
877 1 37 VAL HA 1 39 PRO QG . . 4.470 4.344 4.294 4.455 . 0 0 "[ . 1 . 2]" 1
878 1 37 VAL HA 1 40 PHE H . . 4.700 3.376 3.312 3.449 . 0 0 "[ . 1 . 2]" 1
879 1 37 VAL HA 1 40 PHE HA . . 5.500 4.934 4.868 5.057 . 0 0 "[ . 1 . 2]" 1
880 1 37 VAL HA 1 40 PHE HB2 . . 4.960 2.120 2.055 2.241 . 0 0 "[ . 1 . 2]" 1
881 1 37 VAL HA 1 40 PHE HB3 . . 4.960 3.660 3.583 3.798 . 0 0 "[ . 1 . 2]" 1
882 1 37 VAL HA 1 40 PHE QD . . 3.160 2.094 2.003 2.214 . 0 0 "[ . 1 . 2]" 1
883 1 37 VAL HA 1 40 PHE QE . . 4.060 4.016 3.900 4.062 0.002 4 0 "[ . 1 . 2]" 1
884 1 37 VAL HA 1 59 MET ME . . 4.480 3.404 3.266 3.604 . 0 0 "[ . 1 . 2]" 1
885 1 37 VAL HA 1 68 ALA MB . . 4.200 2.482 2.295 2.610 . 0 0 "[ . 1 . 2]" 1
886 1 37 VAL HB 1 38 GLU H . . 4.800 4.100 3.975 4.336 . 0 0 "[ . 1 . 2]" 1
887 1 37 VAL HB 1 40 PHE QD . . 4.420 4.350 4.251 4.410 . 0 0 "[ . 1 . 2]" 1
888 1 37 VAL HB 1 43 ILE MD . . 4.530 3.627 3.443 3.881 . 0 0 "[ . 1 . 2]" 1
889 1 37 VAL HB 1 57 ILE MD . . 4.640 4.413 4.195 4.520 . 0 0 "[ . 1 . 2]" 1
890 1 37 VAL HB 1 59 MET ME . . 3.250 2.135 1.962 2.337 . 0 0 "[ . 1 . 2]" 1
891 1 37 VAL HB 1 68 ALA MB . . 3.910 3.263 3.068 3.446 . 0 0 "[ . 1 . 2]" 1
892 1 37 VAL MG1 1 38 GLU H . . 4.220 3.920 3.812 4.044 . 0 0 "[ . 1 . 2]" 1
893 1 37 VAL MG1 1 39 PRO HD2 . . 5.500 4.945 4.842 5.006 . 0 0 "[ . 1 . 2]" 1
894 1 37 VAL MG1 1 40 PHE H . . 5.500 5.179 5.079 5.313 . 0 0 "[ . 1 . 2]" 1
895 1 37 VAL MG1 1 40 PHE QD . . 4.700 3.964 3.866 4.102 . 0 0 "[ . 1 . 2]" 1
896 1 37 VAL MG1 1 57 ILE MD . . 2.870 2.523 2.314 2.783 . 0 0 "[ . 1 . 2]" 1
897 1 37 VAL MG1 1 68 ALA H . . 5.030 4.532 4.373 4.688 . 0 0 "[ . 1 . 2]" 1
898 1 37 VAL MG1 1 68 ALA HA . . 4.430 4.293 4.001 4.421 . 0 0 "[ . 1 . 2]" 1
899 1 37 VAL MG1 1 68 ALA MB . . 2.840 2.081 1.882 2.188 . 0 0 "[ . 1 . 2]" 1
900 1 37 VAL MG2 1 38 GLU H . . 3.520 2.393 2.080 2.840 . 0 0 "[ . 1 . 2]" 1
901 1 37 VAL MG2 1 38 GLU HA . . 3.770 3.079 2.913 3.311 . 0 0 "[ . 1 . 2]" 1
902 1 37 VAL MG2 1 38 GLU QB . . 4.000 3.712 3.567 3.924 . 0 0 "[ . 1 . 2]" 1
903 1 37 VAL MG2 1 40 PHE H . . 5.130 4.497 4.375 4.659 . 0 0 "[ . 1 . 2]" 1
904 1 37 VAL MG2 1 41 GLY H . . 4.980 4.608 4.376 4.945 . 0 0 "[ . 1 . 2]" 1
905 1 37 VAL MG2 1 57 ILE MD . . 2.970 2.290 2.012 2.540 . 0 0 "[ . 1 . 2]" 1
906 1 37 VAL MG2 1 59 MET ME . . 2.900 2.711 2.487 2.896 . 0 0 "[ . 1 . 2]" 1
907 1 38 GLU H 1 38 GLU QB . . 3.080 2.065 2.040 2.083 . 0 0 "[ . 1 . 2]" 1
908 1 38 GLU H 1 38 GLU HG2 . . 3.910 3.684 3.594 3.822 . 0 0 "[ . 1 . 2]" 1
909 1 38 GLU H 1 38 GLU HG3 . . 4.030 3.725 3.604 3.908 . 0 0 "[ . 1 . 2]" 1
910 1 38 GLU H 1 39 PRO HD2 . . 3.990 2.244 2.060 2.304 . 0 0 "[ . 1 . 2]" 1
911 1 38 GLU H 1 39 PRO HD3 . . 3.750 3.280 3.120 3.334 . 0 0 "[ . 1 . 2]" 1
912 1 38 GLU H 1 39 PRO QG . . 4.340 4.129 3.966 4.182 . 0 0 "[ . 1 . 2]" 1
913 1 38 GLU H 1 43 ILE MD . . 3.700 3.260 3.061 3.545 . 0 0 "[ . 1 . 2]" 1
914 1 38 GLU H 1 59 MET ME . . 4.770 4.477 4.338 4.628 . 0 0 "[ . 1 . 2]" 1
915 1 38 GLU HA 1 38 GLU HG2 . . 3.500 2.028 2.018 2.057 . 0 0 "[ . 1 . 2]" 1
916 1 38 GLU HA 1 38 GLU HG3 . . 3.500 3.315 3.265 3.391 . 0 0 "[ . 1 . 2]" 1
917 1 38 GLU HA 1 40 PHE H . . 3.920 3.724 3.693 3.768 . 0 0 "[ . 1 . 2]" 1
918 1 38 GLU HA 1 41 GLY H . . 3.880 3.662 3.558 3.857 . 0 0 "[ . 1 . 2]" 1
919 1 38 GLU HA 1 42 VAL HA . . 5.070 4.438 4.282 4.693 . 0 0 "[ . 1 . 2]" 1
920 1 38 GLU HA 1 43 ILE MD . . 3.330 2.484 1.993 2.721 . 0 0 "[ . 1 . 2]" 1
921 1 38 GLU HA 1 43 ILE HG12 . . 4.100 3.357 3.142 3.519 . 0 0 "[ . 1 . 2]" 1
922 1 38 GLU HA 1 43 ILE HG13 . . 4.120 4.069 3.972 4.126 0.006 9 0 "[ . 1 . 2]" 1
923 1 38 GLU HA 1 59 MET ME . . 3.860 3.694 3.561 3.828 . 0 0 "[ . 1 . 2]" 1
924 1 38 GLU QB 1 39 PRO HD2 . . 3.640 2.518 2.494 2.593 . 0 0 "[ . 1 . 2]" 1
925 1 38 GLU QB 1 39 PRO HD3 . . 3.120 1.899 1.894 1.912 . 0 0 "[ . 1 . 2]" 1
926 1 38 GLU QB 1 40 PHE H . . 5.040 4.100 4.095 4.123 . 0 0 "[ . 1 . 2]" 1
927 1 38 GLU QB 1 41 GLY H . . 5.070 4.881 4.854 4.924 . 0 0 "[ . 1 . 2]" 1
928 1 38 GLU QB 1 43 ILE MD . . 3.680 3.608 3.369 3.688 0.008 4 0 "[ . 1 . 2]" 1
929 1 38 GLU HG2 1 39 PRO HD3 . . 4.770 4.627 4.613 4.665 . 0 0 "[ . 1 . 2]" 1
930 1 38 GLU HG2 1 43 ILE MD . . 3.480 2.637 2.381 2.874 . 0 0 "[ . 1 . 2]" 1
931 1 38 GLU HG2 1 43 ILE HG12 . . 3.900 2.886 2.595 3.097 . 0 0 "[ . 1 . 2]" 1
932 1 38 GLU HG2 1 43 ILE HG13 . . 4.070 2.914 2.704 3.106 . 0 0 "[ . 1 . 2]" 1
933 1 38 GLU HG3 1 39 PRO HD3 . . 4.370 4.295 4.255 4.355 . 0 0 "[ . 1 . 2]" 1
934 1 38 GLU HG3 1 43 ILE MD . . 3.490 3.373 3.210 3.477 . 0 0 "[ . 1 . 2]" 1
935 1 38 GLU HG3 1 43 ILE HG13 . . 4.020 3.738 3.530 4.017 . 0 0 "[ . 1 . 2]" 1
936 1 39 PRO HA 1 41 GLY H . . 4.510 4.071 3.783 4.254 . 0 0 "[ . 1 . 2]" 1
937 1 39 PRO HB2 1 40 PHE HA . . 5.400 4.385 4.351 4.397 . 0 0 "[ . 1 . 2]" 1
938 1 39 PRO HB2 1 40 PHE QD . . 4.660 4.285 4.112 4.452 . 0 0 "[ . 1 . 2]" 1
939 1 39 PRO HB2 1 40 PHE QE . . 5.040 4.573 4.364 4.792 . 0 0 "[ . 1 . 2]" 1
940 1 39 PRO HB3 1 40 PHE QD . . 5.440 5.173 4.992 5.345 . 0 0 "[ . 1 . 2]" 1
941 1 39 PRO HD2 1 40 PHE H . . 4.080 3.013 2.965 3.026 . 0 0 "[ . 1 . 2]" 1
942 1 39 PRO HD2 1 40 PHE QD . . 3.880 2.789 2.611 2.941 . 0 0 "[ . 1 . 2]" 1
943 1 39 PRO HD2 1 41 GLY H . . 5.170 4.751 4.694 4.851 . 0 0 "[ . 1 . 2]" 1
944 1 39 PRO HD2 1 43 ILE MD . . 5.500 4.981 4.763 5.109 . 0 0 "[ . 1 . 2]" 1
945 1 39 PRO HD3 1 40 PHE H . . 4.060 4.035 4.010 4.042 . 0 0 "[ . 1 . 2]" 1
946 1 39 PRO HD3 1 40 PHE QD . . 4.570 4.405 4.216 4.557 . 0 0 "[ . 1 . 2]" 1
947 1 39 PRO QG 1 40 PHE H . . 3.960 3.253 3.188 3.271 . 0 0 "[ . 1 . 2]" 1
948 1 39 PRO QG 1 40 PHE HA . . 4.860 4.497 4.438 4.521 . 0 0 "[ . 1 . 2]" 1
949 1 39 PRO QG 1 40 PHE QB . . 4.890 4.231 4.190 4.294 . 0 0 "[ . 1 . 2]" 1
950 1 39 PRO QG 1 40 PHE QD . . 4.500 2.528 2.349 2.710 . 0 0 "[ . 1 . 2]" 1
951 1 39 PRO QG 1 40 PHE QE . . 4.960 2.719 2.492 2.997 . 0 0 "[ . 1 . 2]" 1
952 1 40 PHE H 1 40 PHE HB2 . . 3.740 2.455 2.372 2.489 . 0 0 "[ . 1 . 2]" 1
953 1 40 PHE H 1 40 PHE QB . . 3.210 2.420 2.342 2.451 . 0 0 "[ . 1 . 2]" 1
954 1 40 PHE H 1 40 PHE HB3 . . 3.740 3.666 3.616 3.687 . 0 0 "[ . 1 . 2]" 1
955 1 40 PHE H 1 40 PHE QD . . 4.130 2.684 2.429 2.855 . 0 0 "[ . 1 . 2]" 1
956 1 40 PHE H 1 41 GLY H . . 2.990 2.048 2.004 2.170 . 0 0 "[ . 1 . 2]" 1
957 1 40 PHE H 1 43 ILE MD . . 5.500 5.054 4.814 5.208 . 0 0 "[ . 1 . 2]" 1
958 1 40 PHE H 1 59 MET ME . . 4.000 3.765 3.663 3.872 . 0 0 "[ . 1 . 2]" 1
959 1 40 PHE H 1 68 ALA MB . . 5.100 4.891 4.768 5.018 . 0 0 "[ . 1 . 2]" 1
960 1 40 PHE HA 1 40 PHE QD . . 3.440 2.926 2.831 3.050 . 0 0 "[ . 1 . 2]" 1
961 1 40 PHE HA 1 40 PHE QE . . 4.720 4.597 4.548 4.647 . 0 0 "[ . 1 . 2]" 1
962 1 40 PHE HA 1 59 MET ME . . 4.840 4.759 4.653 4.844 0.004 6 0 "[ . 1 . 2]" 1
963 1 40 PHE HA 1 67 ALA MB . . 5.090 4.111 3.854 4.348 . 0 0 "[ . 1 . 2]" 1
964 1 40 PHE HA 1 68 ALA MB . . 5.260 5.071 4.853 5.256 . 0 0 "[ . 1 . 2]" 1
965 1 40 PHE QB 1 41 GLY H . . 3.690 3.053 2.896 3.248 . 0 0 "[ . 1 . 2]" 1
966 1 40 PHE QB 1 67 ALA MB . . 3.830 2.885 2.540 3.112 . 0 0 "[ . 1 . 2]" 1
967 1 40 PHE HB2 1 41 GLY H . . 4.410 3.171 2.992 3.393 . 0 0 "[ . 1 . 2]" 1
968 1 40 PHE HB2 1 59 MET ME . . 4.060 2.942 2.798 3.123 . 0 0 "[ . 1 . 2]" 1
969 1 40 PHE HB2 1 68 ALA H . . 4.440 4.307 4.172 4.434 . 0 0 "[ . 1 . 2]" 1
970 1 40 PHE HB2 1 68 ALA MB . . 3.830 2.862 2.674 3.038 . 0 0 "[ . 1 . 2]" 1
971 1 40 PHE HB3 1 41 GLY H . . 4.410 3.988 3.859 4.146 . 0 0 "[ . 1 . 2]" 1
972 1 40 PHE HB3 1 59 MET ME . . 4.060 3.598 3.368 3.749 . 0 0 "[ . 1 . 2]" 1
973 1 40 PHE HB3 1 68 ALA H . . 4.440 3.334 3.197 3.502 . 0 0 "[ . 1 . 2]" 1
974 1 40 PHE HB3 1 68 ALA MB . . 3.830 3.112 2.831 3.385 . 0 0 "[ . 1 . 2]" 1
975 1 40 PHE QD 1 67 ALA MB . . 3.310 2.263 1.973 2.476 . 0 0 "[ . 1 . 2]" 1
976 1 40 PHE QD 1 68 ALA H . . 3.960 3.686 3.527 3.909 . 0 0 "[ . 1 . 2]" 1
977 1 40 PHE QD 1 68 ALA HA . . 4.250 3.049 2.875 3.302 . 0 0 "[ . 1 . 2]" 1
978 1 40 PHE QD 1 68 ALA MB . . 3.470 3.221 3.086 3.371 . 0 0 "[ . 1 . 2]" 1
979 1 40 PHE QD 1 71 TYR HB3 . . 5.500 4.872 4.402 5.204 . 0 0 "[ . 1 . 2]" 1
980 1 40 PHE QE 1 67 ALA MB . . 3.920 3.767 3.475 3.941 0.021 4 0 "[ . 1 . 2]" 1
981 1 40 PHE QE 1 68 ALA HA . . 4.160 3.180 3.011 3.356 . 0 0 "[ . 1 . 2]" 1
982 1 40 PHE QE 1 68 ALA MB . . 5.500 3.952 3.782 4.076 . 0 0 "[ . 1 . 2]" 1
983 1 40 PHE QE 1 71 TYR H . . 4.550 4.235 3.654 4.552 0.002 9 0 "[ . 1 . 2]" 1
984 1 40 PHE QE 1 71 TYR HB2 . . 4.480 2.176 1.996 2.412 . 0 0 "[ . 1 . 2]" 1
985 1 40 PHE QE 1 71 TYR HB3 . . 4.780 3.272 2.619 3.609 . 0 0 "[ . 1 . 2]" 1
986 1 40 PHE QE 1 71 TYR QD . . 4.580 3.143 2.335 3.498 . 0 0 "[ . 1 . 2]" 1
987 1 40 PHE QE 1 71 TYR QE . . 4.220 4.124 3.812 4.222 0.002 14 0 "[ . 1 . 2]" 1
988 1 40 PHE HZ 1 68 ALA HA . . 5.030 3.866 3.616 4.099 . 0 0 "[ . 1 . 2]" 1
989 1 40 PHE HZ 1 71 TYR H . . 5.500 5.019 4.659 5.502 0.002 17 0 "[ . 1 . 2]" 1
990 1 40 PHE HZ 1 71 TYR HB2 . . 4.600 2.713 2.275 3.100 . 0 0 "[ . 1 . 2]" 1
991 1 40 PHE HZ 1 71 TYR HB3 . . 4.670 2.902 2.558 3.503 . 0 0 "[ . 1 . 2]" 1
992 1 40 PHE HZ 1 71 TYR QD . . 4.450 2.725 2.346 3.033 . 0 0 "[ . 1 . 2]" 1
993 1 40 PHE HZ 1 71 TYR QE . . 5.030 3.675 3.456 3.950 . 0 0 "[ . 1 . 2]" 1
994 1 41 GLY H 1 42 VAL H . . 4.310 4.272 4.210 4.315 0.005 17 0 "[ . 1 . 2]" 1
995 1 41 GLY H 1 42 VAL MG1 . . 5.500 5.451 5.366 5.486 . 0 0 "[ . 1 . 2]" 1
996 1 41 GLY H 1 43 ILE MD . . 5.040 4.666 4.390 4.942 . 0 0 "[ . 1 . 2]" 1
997 1 41 GLY H 1 59 MET ME . . 3.420 2.890 2.686 3.269 . 0 0 "[ . 1 . 2]" 1
998 1 41 GLY H 1 64 ASP HB3 . . 4.920 3.932 3.686 4.141 . 0 0 "[ . 1 . 2]" 1
999 1 41 GLY HA2 1 42 VAL H . . 3.200 2.920 2.824 2.987 . 0 0 "[ . 1 . 2]" 1
1000 1 41 GLY HA2 1 42 VAL HA . . 5.500 4.418 4.383 4.439 . 0 0 "[ . 1 . 2]" 1
1001 1 41 GLY HA2 1 42 VAL HB . . 4.960 4.840 4.815 4.900 . 0 0 "[ . 1 . 2]" 1
1002 1 41 GLY HA2 1 42 VAL MG1 . . 4.060 3.899 3.834 3.941 . 0 0 "[ . 1 . 2]" 1
1003 1 41 GLY HA2 1 59 MET ME . . 3.960 3.573 3.390 3.847 . 0 0 "[ . 1 . 2]" 1
1004 1 41 GLY HA2 1 64 ASP HB2 . . 5.150 4.933 4.727 5.152 0.002 17 0 "[ . 1 . 2]" 1
1005 1 41 GLY HA2 1 64 ASP HB3 . . 4.280 3.655 3.487 3.892 . 0 0 "[ . 1 . 2]" 1
1006 1 41 GLY HA3 1 42 VAL H . . 3.020 2.265 2.224 2.333 . 0 0 "[ . 1 . 2]" 1
1007 1 41 GLY HA3 1 42 VAL HB . . 5.310 5.158 5.092 5.232 . 0 0 "[ . 1 . 2]" 1
1008 1 41 GLY HA3 1 42 VAL MG1 . . 3.790 3.703 3.629 3.746 . 0 0 "[ . 1 . 2]" 1
1009 1 41 GLY HA3 1 42 VAL MG2 . . 5.500 5.499 5.454 5.522 0.022 14 0 "[ . 1 . 2]" 1
1010 1 41 GLY HA3 1 43 ILE MD . . 5.500 5.302 5.113 5.457 . 0 0 "[ . 1 . 2]" 1
1011 1 41 GLY HA3 1 59 MET ME . . 3.410 2.242 2.078 2.499 . 0 0 "[ . 1 . 2]" 1
1012 1 41 GLY HA3 1 64 ASP HB2 . . 4.680 3.297 3.087 3.486 . 0 0 "[ . 1 . 2]" 1
1013 1 41 GLY HA3 1 64 ASP HB3 . . 4.320 2.115 2.001 2.374 . 0 0 "[ . 1 . 2]" 1
1014 1 42 VAL H 1 42 VAL HB . . 3.280 3.219 3.149 3.302 0.022 9 0 "[ . 1 . 2]" 1
1015 1 42 VAL H 1 42 VAL MG1 . . 3.070 1.917 1.835 1.980 . 0 0 "[ . 1 . 2]" 1
1016 1 42 VAL H 1 42 VAL MG2 . . 3.750 3.691 3.644 3.710 . 0 0 "[ . 1 . 2]" 1
1017 1 42 VAL H 1 43 ILE H . . 4.560 4.526 4.497 4.544 . 0 0 "[ . 1 . 2]" 1
1018 1 42 VAL H 1 59 MET HA . . 5.200 4.789 4.550 4.968 . 0 0 "[ . 1 . 2]" 1
1019 1 42 VAL H 1 59 MET HB3 . . 5.230 3.900 3.704 4.069 . 0 0 "[ . 1 . 2]" 1
1020 1 42 VAL H 1 59 MET ME . . 3.270 2.646 2.369 2.900 . 0 0 "[ . 1 . 2]" 1
1021 1 42 VAL H 1 60 ALA H . . 3.710 3.682 3.596 3.729 0.019 9 0 "[ . 1 . 2]" 1
1022 1 42 VAL H 1 60 ALA MB . . 3.840 3.697 3.445 3.835 . 0 0 "[ . 1 . 2]" 1
1023 1 42 VAL H 1 64 ASP HB2 . . 5.100 4.153 3.967 4.485 . 0 0 "[ . 1 . 2]" 1
1024 1 42 VAL H 1 64 ASP HB3 . . 5.500 3.834 3.597 4.116 . 0 0 "[ . 1 . 2]" 1
1025 1 42 VAL HA 1 42 VAL MG1 . . 3.340 3.164 3.146 3.169 . 0 0 "[ . 1 . 2]" 1
1026 1 42 VAL HA 1 42 VAL MG2 . . 3.170 2.533 2.505 2.592 . 0 0 "[ . 1 . 2]" 1
1027 1 42 VAL HA 1 43 ILE H . . 2.980 2.264 2.206 2.309 . 0 0 "[ . 1 . 2]" 1
1028 1 42 VAL HA 1 43 ILE HA . . 5.500 4.352 4.346 4.359 . 0 0 "[ . 1 . 2]" 1
1029 1 42 VAL HA 1 43 ILE HB . . 5.110 4.879 4.755 5.016 . 0 0 "[ . 1 . 2]" 1
1030 1 42 VAL HA 1 43 ILE HG12 . . 3.880 3.377 3.231 3.595 . 0 0 "[ . 1 . 2]" 1
1031 1 42 VAL HA 1 59 MET ME . . 4.280 3.809 3.475 4.092 . 0 0 "[ . 1 . 2]" 1
1032 1 42 VAL HA 1 60 ALA MB . . 4.870 4.797 4.650 4.897 0.027 9 0 "[ . 1 . 2]" 1
1033 1 42 VAL HB 1 43 ILE H . . 4.580 3.724 3.647 3.840 . 0 0 "[ . 1 . 2]" 1
1034 1 42 VAL HB 1 60 ALA H . . 5.390 5.241 5.103 5.398 0.008 9 0 "[ . 1 . 2]" 1
1035 1 42 VAL HB 1 60 ALA MB . . 4.030 3.922 3.838 4.047 0.017 9 0 "[ . 1 . 2]" 1
1036 1 42 VAL MG1 1 43 ILE H . . 4.140 4.003 3.927 4.098 . 0 0 "[ . 1 . 2]" 1
1037 1 42 VAL MG1 1 59 MET HA . . 4.570 4.114 3.933 4.330 . 0 0 "[ . 1 . 2]" 1
1038 1 42 VAL MG1 1 60 ALA H . . 4.230 2.392 2.188 2.639 . 0 0 "[ . 1 . 2]" 1
1039 1 42 VAL MG1 1 60 ALA MB . . 3.430 1.691 1.633 1.725 . 0 0 "[ . 1 . 2]" 1
1040 1 42 VAL MG2 1 43 ILE H . . 3.050 2.031 1.889 2.272 . 0 0 "[ . 1 . 2]" 1
1041 1 42 VAL MG2 1 43 ILE HA . . 4.100 3.614 3.503 3.742 . 0 0 "[ . 1 . 2]" 1
1042 1 42 VAL MG2 1 44 SER H . . 4.780 3.789 3.512 4.081 . 0 0 "[ . 1 . 2]" 1
1043 1 42 VAL MG2 1 44 SER HA . . 3.860 3.533 3.331 3.736 . 0 0 "[ . 1 . 2]" 1
1044 1 42 VAL MG2 1 44 SER HB2 . . 4.480 4.397 4.197 4.484 0.004 6 0 "[ . 1 . 2]" 1
1045 1 42 VAL MG2 1 44 SER HB3 . . 5.500 5.323 5.183 5.458 . 0 0 "[ . 1 . 2]" 1
1046 1 42 VAL MG2 1 59 MET HA . . 5.210 4.588 4.402 4.811 . 0 0 "[ . 1 . 2]" 1
1047 1 42 VAL MG2 1 60 ALA H . . 4.260 3.540 3.340 3.676 . 0 0 "[ . 1 . 2]" 1
1048 1 42 VAL MG2 1 60 ALA HA . . 4.650 4.632 4.543 4.665 0.015 4 0 "[ . 1 . 2]" 1
1049 1 42 VAL MG2 1 60 ALA MB . . 3.140 2.507 2.401 2.646 . 0 0 "[ . 1 . 2]" 1
1050 1 42 VAL MG2 1 61 THR H . . 5.500 5.425 5.162 5.510 0.010 7 0 "[ . 1 . 2]" 1
1051 1 43 ILE H 1 43 ILE HB . . 2.980 2.673 2.564 2.801 . 0 0 "[ . 1 . 2]" 1
1052 1 43 ILE H 1 43 ILE MD . . 3.790 3.312 3.118 3.497 . 0 0 "[ . 1 . 2]" 1
1053 1 43 ILE H 1 43 ILE HG12 . . 3.190 2.107 1.897 2.323 . 0 0 "[ . 1 . 2]" 1
1054 1 43 ILE H 1 43 ILE HG13 . . 3.950 3.583 3.439 3.754 . 0 0 "[ . 1 . 2]" 1
1055 1 43 ILE H 1 43 ILE MG . . 4.160 3.811 3.786 3.831 . 0 0 "[ . 1 . 2]" 1
1056 1 43 ILE H 1 44 SER H . . 5.050 4.363 4.238 4.494 . 0 0 "[ . 1 . 2]" 1
1057 1 43 ILE H 1 59 MET ME . . 4.830 4.493 4.198 4.728 . 0 0 "[ . 1 . 2]" 1
1058 1 43 ILE HA 1 43 ILE MD . . 3.720 2.296 2.145 2.425 . 0 0 "[ . 1 . 2]" 1
1059 1 43 ILE HA 1 43 ILE HG12 . . 3.410 3.129 3.045 3.222 . 0 0 "[ . 1 . 2]" 1
1060 1 43 ILE HA 1 43 ILE MG . . 3.250 2.215 2.077 2.326 . 0 0 "[ . 1 . 2]" 1
1061 1 43 ILE HA 1 44 SER H . . 3.300 2.149 2.138 2.180 . 0 0 "[ . 1 . 2]" 1
1062 1 43 ILE HA 1 44 SER HB2 . . 4.370 4.210 4.151 4.257 . 0 0 "[ . 1 . 2]" 1
1063 1 43 ILE HA 1 45 ASN H . . 4.070 3.940 3.698 4.074 0.004 12 0 "[ . 1 . 2]" 1
1064 1 43 ILE HA 1 57 ILE MG . . 4.300 3.621 3.415 3.778 . 0 0 "[ . 1 . 2]" 1
1065 1 43 ILE HA 1 59 MET HA . . 3.640 3.284 2.972 3.513 . 0 0 "[ . 1 . 2]" 1
1066 1 43 ILE HA 1 59 MET ME . . 4.900 3.864 3.741 4.004 . 0 0 "[ . 1 . 2]" 1
1067 1 43 ILE HA 1 60 ALA H . . 4.410 4.326 4.153 4.414 0.004 9 0 "[ . 1 . 2]" 1
1068 1 43 ILE HA 1 60 ALA MB . . 5.080 4.966 4.804 5.065 . 0 0 "[ . 1 . 2]" 1
1069 1 43 ILE HB 1 44 SER H . . 4.500 4.213 4.043 4.341 . 0 0 "[ . 1 . 2]" 1
1070 1 43 ILE HB 1 44 SER HA . . 5.120 4.847 4.713 4.969 . 0 0 "[ . 1 . 2]" 1
1071 1 43 ILE HB 1 45 ASN H . . 5.500 5.213 4.877 5.483 . 0 0 "[ . 1 . 2]" 1
1072 1 43 ILE MD 1 44 SER H . . 4.910 3.981 3.793 4.149 . 0 0 "[ . 1 . 2]" 1
1073 1 43 ILE MD 1 57 ILE MD . . 3.950 3.693 3.540 3.946 . 0 0 "[ . 1 . 2]" 1
1074 1 43 ILE MD 1 59 MET HA . . 4.850 4.371 4.211 4.524 . 0 0 "[ . 1 . 2]" 1
1075 1 43 ILE MD 1 59 MET ME . . 2.990 2.866 2.746 2.955 . 0 0 "[ . 1 . 2]" 1
1076 1 43 ILE HG12 1 44 SER H . . 5.410 5.132 5.066 5.197 . 0 0 "[ . 1 . 2]" 1
1077 1 43 ILE MG 1 44 SER H . . 3.490 2.887 2.604 3.176 . 0 0 "[ . 1 . 2]" 1
1078 1 43 ILE MG 1 44 SER HA . . 4.710 4.223 3.986 4.437 . 0 0 "[ . 1 . 2]" 1
1079 1 43 ILE MG 1 44 SER HB3 . . 5.500 5.168 5.040 5.341 . 0 0 "[ . 1 . 2]" 1
1080 1 43 ILE MG 1 45 ASN H . . 3.330 3.036 2.774 3.269 . 0 0 "[ . 1 . 2]" 1
1081 1 43 ILE MG 1 45 ASN HA . . 4.850 3.521 3.428 3.658 . 0 0 "[ . 1 . 2]" 1
1082 1 43 ILE MG 1 46 HIS H . . 4.430 3.756 3.598 3.897 . 0 0 "[ . 1 . 2]" 1
1083 1 43 ILE MG 1 46 HIS HA . . 4.980 4.520 4.174 4.778 . 0 0 "[ . 1 . 2]" 1
1084 1 43 ILE MG 1 46 HIS HB2 . . 4.790 4.404 4.039 4.790 . 0 0 "[ . 1 . 2]" 1
1085 1 43 ILE MG 1 46 HIS QB . . 4.060 2.997 2.699 3.335 . 0 0 "[ . 1 . 2]" 1
1086 1 43 ILE MG 1 46 HIS HB3 . . 4.790 3.050 2.741 3.403 . 0 0 "[ . 1 . 2]" 1
1087 1 43 ILE MG 1 46 HIS HD2 . . 5.500 5.475 5.379 5.503 0.003 14 0 "[ . 1 . 2]" 1
1088 1 43 ILE MG 1 57 ILE HA . . 5.160 4.664 4.359 4.983 . 0 0 "[ . 1 . 2]" 1
1089 1 43 ILE MG 1 58 GLU H . . 4.520 4.169 3.914 4.393 . 0 0 "[ . 1 . 2]" 1
1090 1 43 ILE MG 1 59 MET HA . . 5.330 4.503 4.192 4.733 . 0 0 "[ . 1 . 2]" 1
1091 1 44 SER H 1 44 SER HB2 . . 3.690 2.187 2.111 2.309 . 0 0 "[ . 1 . 2]" 1
1092 1 44 SER H 1 44 SER HB3 . . 3.530 3.342 3.270 3.385 . 0 0 "[ . 1 . 2]" 1
1093 1 44 SER H 1 45 ASN H . . 3.310 2.357 2.177 2.493 . 0 0 "[ . 1 . 2]" 1
1094 1 44 SER H 1 45 ASN HA . . 5.320 4.761 4.554 4.938 . 0 0 "[ . 1 . 2]" 1
1095 1 44 SER H 1 57 ILE MG . . 4.230 3.963 3.839 4.081 . 0 0 "[ . 1 . 2]" 1
1096 1 44 SER H 1 58 GLU HB3 . . 5.100 4.288 4.108 4.467 . 0 0 "[ . 1 . 2]" 1
1097 1 44 SER H 1 59 MET HA . . 3.840 2.716 2.552 3.008 . 0 0 "[ . 1 . 2]" 1
1098 1 44 SER H 1 59 MET ME . . 5.080 4.922 4.724 5.061 . 0 0 "[ . 1 . 2]" 1
1099 1 44 SER H 1 60 ALA H . . 4.160 3.702 3.083 4.160 . 0 0 "[ . 1 . 2]" 1
1100 1 44 SER H 1 60 ALA HA . . 5.360 4.897 4.566 5.152 . 0 0 "[ . 1 . 2]" 1
1101 1 44 SER H 1 60 ALA MB . . 5.230 4.302 3.927 4.658 . 0 0 "[ . 1 . 2]" 1
1102 1 44 SER HA 1 60 ALA MB . . 4.770 4.068 3.807 4.240 . 0 0 "[ . 1 . 2]" 1
1103 1 44 SER HB2 1 45 ASN H . . 3.970 2.968 2.848 3.167 . 0 0 "[ . 1 . 2]" 1
1104 1 44 SER HB2 1 45 ASN QB . . 5.340 4.349 4.268 4.493 . 0 0 "[ . 1 . 2]" 1
1105 1 44 SER HB2 1 45 ASN QD . . 5.340 5.201 4.810 5.339 . 0 0 "[ . 1 . 2]" 1
1106 1 44 SER HB2 1 58 GLU H . . 5.200 5.084 4.984 5.176 . 0 0 "[ . 1 . 2]" 1
1107 1 44 SER HB2 1 58 GLU HB2 . . 5.220 5.205 5.144 5.226 0.006 9 0 "[ . 1 . 2]" 1
1108 1 44 SER HB2 1 58 GLU HB3 . . 4.240 3.661 3.541 3.758 . 0 0 "[ . 1 . 2]" 1
1109 1 44 SER HB2 1 58 GLU HG2 . . 4.470 3.322 3.011 3.594 . 0 0 "[ . 1 . 2]" 1
1110 1 44 SER HB2 1 60 ALA H . . 5.460 3.309 2.915 3.573 . 0 0 "[ . 1 . 2]" 1
1111 1 44 SER HB2 1 60 ALA HA . . 4.180 3.197 2.951 3.302 . 0 0 "[ . 1 . 2]" 1
1112 1 44 SER HB2 1 60 ALA MB . . 4.480 3.677 3.462 3.842 . 0 0 "[ . 1 . 2]" 1
1113 1 44 SER HB3 1 45 ASN H . . 3.620 2.940 2.788 3.082 . 0 0 "[ . 1 . 2]" 1
1114 1 44 SER HB3 1 45 ASN QB . . 5.340 3.077 2.995 3.230 . 0 0 "[ . 1 . 2]" 1
1115 1 44 SER HB3 1 58 GLU H . . 5.500 5.356 5.168 5.460 . 0 0 "[ . 1 . 2]" 1
1116 1 44 SER HB3 1 58 GLU HB2 . . 5.000 4.956 4.745 5.002 0.002 6 0 "[ . 1 . 2]" 1
1117 1 44 SER HB3 1 58 GLU HB3 . . 4.210 3.338 3.086 3.425 . 0 0 "[ . 1 . 2]" 1
1118 1 44 SER HB3 1 58 GLU HG2 . . 4.430 3.200 2.899 3.643 . 0 0 "[ . 1 . 2]" 1
1119 1 44 SER HB3 1 59 MET HA . . 4.870 4.674 4.554 4.842 . 0 0 "[ . 1 . 2]" 1
1120 1 44 SER HB3 1 60 ALA H . . 5.330 4.967 4.589 5.268 . 0 0 "[ . 1 . 2]" 1
1121 1 44 SER HB3 1 60 ALA HA . . 4.240 4.046 3.791 4.231 . 0 0 "[ . 1 . 2]" 1
1122 1 44 SER HB3 1 60 ALA MB . . 4.740 4.585 4.313 4.745 0.005 12 0 "[ . 1 . 2]" 1
1123 1 45 ASN H 1 45 ASN HB2 . . 4.200 3.034 2.974 3.093 . 0 0 "[ . 1 . 2]" 1
1124 1 45 ASN H 1 45 ASN HB3 . . 4.200 3.817 3.664 3.930 . 0 0 "[ . 1 . 2]" 1
1125 1 45 ASN H 1 46 HIS HA . . 5.100 4.524 4.495 4.546 . 0 0 "[ . 1 . 2]" 1
1126 1 45 ASN H 1 57 ILE MG . . 3.970 3.764 3.551 3.915 . 0 0 "[ . 1 . 2]" 1
1127 1 45 ASN H 1 58 GLU H . . 4.020 3.200 3.114 3.323 . 0 0 "[ . 1 . 2]" 1
1128 1 45 ASN H 1 58 GLU HB2 . . 4.780 4.311 4.005 4.496 . 0 0 "[ . 1 . 2]" 1
1129 1 45 ASN H 1 58 GLU HB3 . . 3.180 2.695 2.399 2.948 . 0 0 "[ . 1 . 2]" 1
1130 1 45 ASN H 1 58 GLU HG3 . . 5.500 5.248 4.888 5.496 . 0 0 "[ . 1 . 2]" 1
1131 1 45 ASN H 1 59 MET HA . . 5.420 4.350 4.224 4.614 . 0 0 "[ . 1 . 2]" 1
1132 1 45 ASN H 1 95 ILE MD . . 5.500 4.745 4.140 5.177 . 0 0 "[ . 1 . 2]" 1
1133 1 45 ASN HA 1 45 ASN QD . . 4.590 3.653 3.075 3.927 . 0 0 "[ . 1 . 2]" 1
1134 1 45 ASN QB 1 46 HIS H . . 4.160 3.332 3.222 3.449 . 0 0 "[ . 1 . 2]" 1
1135 1 45 ASN QB 1 58 GLU H . . 4.510 4.143 4.023 4.194 . 0 0 "[ . 1 . 2]" 1
1136 1 45 ASN QB 1 58 GLU HB2 . . 3.960 3.758 3.491 3.964 0.004 6 0 "[ . 1 . 2]" 1
1137 1 45 ASN QB 1 58 GLU HB3 . . 3.840 2.779 2.592 2.929 . 0 0 "[ . 1 . 2]" 1
1138 1 45 ASN QB 1 95 ILE HB . . 3.720 2.495 1.966 3.393 . 0 0 "[ . 1 . 2]" 1
1139 1 45 ASN QB 1 95 ILE MD . . 3.630 2.994 2.002 3.615 . 0 0 "[ . 1 . 2]" 1
1140 1 45 ASN QB 1 96 LYS QB . . 5.070 3.765 2.411 5.065 . 0 0 "[ . 1 . 2]" 1
1141 1 45 ASN HB2 1 46 HIS H . . 4.780 4.428 4.334 4.470 . 0 0 "[ . 1 . 2]" 1
1142 1 45 ASN HB2 1 58 GLU H . . 5.130 4.700 4.507 4.958 . 0 0 "[ . 1 . 2]" 1
1143 1 45 ASN HB2 1 58 GLU HB2 . . 4.840 4.157 3.656 4.506 . 0 0 "[ . 1 . 2]" 1
1144 1 45 ASN HB2 1 58 GLU HB3 . . 4.400 2.911 2.636 3.132 . 0 0 "[ . 1 . 2]" 1
1145 1 45 ASN HB2 1 95 ILE HB . . 4.280 3.584 3.060 4.271 . 0 0 "[ . 1 . 2]" 1
1146 1 45 ASN HB2 1 95 ILE MG . . 4.540 3.625 2.497 4.354 . 0 0 "[ . 1 . 2]" 1
1147 1 45 ASN HB3 1 46 HIS H . . 4.780 3.445 3.323 3.588 . 0 0 "[ . 1 . 2]" 1
1148 1 45 ASN HB3 1 58 GLU H . . 5.130 4.619 4.443 4.900 . 0 0 "[ . 1 . 2]" 1
1149 1 45 ASN HB3 1 58 GLU HB2 . . 4.840 4.326 3.873 4.645 . 0 0 "[ . 1 . 2]" 1
1150 1 45 ASN HB3 1 58 GLU HB3 . . 4.400 3.580 3.196 3.855 . 0 0 "[ . 1 . 2]" 1
1151 1 45 ASN HB3 1 95 ILE HB . . 4.280 2.564 1.990 3.706 . 0 0 "[ . 1 . 2]" 1
1152 1 45 ASN HB3 1 95 ILE MG . . 4.540 2.221 1.800 2.908 . 0 0 "[ . 1 . 2]" 1
1153 1 45 ASN QD 1 95 ILE HB . . 5.160 4.311 3.400 4.900 . 0 0 "[ . 1 . 2]" 1
1154 1 45 ASN QD 1 95 ILE MG . . 4.580 4.217 3.678 4.553 . 0 0 "[ . 1 . 2]" 1
1155 1 45 ASN HD21 1 95 ILE MG . . 5.230 4.621 3.832 5.017 . 0 0 "[ . 1 . 2]" 1
1156 1 45 ASN HD22 1 95 ILE MG . . 5.230 4.899 4.449 5.232 0.002 20 0 "[ . 1 . 2]" 1
1157 1 46 HIS HA 1 47 LEU HB2 . . 4.920 4.415 4.348 4.491 . 0 0 "[ . 1 . 2]" 1
1158 1 46 HIS HA 1 47 LEU HB3 . . 5.290 4.357 4.280 4.420 . 0 0 "[ . 1 . 2]" 1
1159 1 46 HIS HA 1 57 ILE HA . . 3.630 2.066 2.007 2.147 . 0 0 "[ . 1 . 2]" 1
1160 1 46 HIS HA 1 57 ILE HG12 . . 4.310 3.555 3.172 3.833 . 0 0 "[ . 1 . 2]" 1
1161 1 46 HIS HA 1 57 ILE HG13 . . 4.630 3.932 3.729 4.187 . 0 0 "[ . 1 . 2]" 1
1162 1 46 HIS HA 1 57 ILE MG . . 4.030 3.475 3.166 3.700 . 0 0 "[ . 1 . 2]" 1
1163 1 46 HIS HA 1 58 GLU H . . 4.010 2.708 2.573 2.971 . 0 0 "[ . 1 . 2]" 1
1164 1 46 HIS HA 1 58 GLU HB2 . . 5.430 4.560 4.240 4.833 . 0 0 "[ . 1 . 2]" 1
1165 1 46 HIS HA 1 95 ILE MD . . 3.590 3.221 2.908 3.570 . 0 0 "[ . 1 . 2]" 1
1166 1 46 HIS QB 1 57 ILE MD . . 3.800 3.408 3.275 3.584 . 0 0 "[ . 1 . 2]" 1
1167 1 46 HIS QB 1 57 ILE HG13 . . 4.290 2.830 2.361 3.141 . 0 0 "[ . 1 . 2]" 1
1168 1 46 HIS QB 1 57 ILE MG . . 3.440 2.883 2.628 3.131 . 0 0 "[ . 1 . 2]" 1
1169 1 46 HIS QB 1 58 GLU H . . 5.340 3.685 3.467 3.987 . 0 0 "[ . 1 . 2]" 1
1170 1 46 HIS QB 1 95 ILE MD . . 5.250 4.644 4.343 4.968 . 0 0 "[ . 1 . 2]" 1
1171 1 46 HIS HB2 1 47 LEU H . . 5.120 2.587 2.342 2.778 . 0 0 "[ . 1 . 2]" 1
1172 1 46 HIS HB2 1 57 ILE HA . . 4.310 2.995 2.577 3.411 . 0 0 "[ . 1 . 2]" 1
1173 1 46 HIS HB2 1 57 ILE MD . . 4.410 3.711 3.510 4.120 . 0 0 "[ . 1 . 2]" 1
1174 1 46 HIS HB2 1 57 ILE HG12 . . 4.250 2.306 2.042 2.759 . 0 0 "[ . 1 . 2]" 1
1175 1 46 HIS HB2 1 57 ILE MG . . 4.010 3.681 3.406 4.008 . 0 0 "[ . 1 . 2]" 1
1176 1 46 HIS HB3 1 47 LEU H . . 5.120 3.908 3.667 4.047 . 0 0 "[ . 1 . 2]" 1
1177 1 46 HIS HB3 1 57 ILE HA . . 4.310 3.232 2.714 3.784 . 0 0 "[ . 1 . 2]" 1
1178 1 46 HIS HB3 1 57 ILE MD . . 4.410 4.015 3.683 4.286 . 0 0 "[ . 1 . 2]" 1
1179 1 46 HIS HB3 1 57 ILE HG12 . . 4.250 2.519 2.040 2.857 . 0 0 "[ . 1 . 2]" 1
1180 1 46 HIS HB3 1 57 ILE MG . . 4.010 3.033 2.672 3.342 . 0 0 "[ . 1 . 2]" 1
1181 1 46 HIS HD2 1 48 ILE H . . 5.360 4.683 4.235 5.288 . 0 0 "[ . 1 . 2]" 1
1182 1 46 HIS HD2 1 48 ILE HB . . 5.330 4.896 4.424 5.271 . 0 0 "[ . 1 . 2]" 1
1183 1 46 HIS HD2 1 48 ILE MD . . 3.790 2.305 1.965 2.900 . 0 0 "[ . 1 . 2]" 1
1184 1 46 HIS HD2 1 48 ILE HG12 . . 4.560 2.892 2.571 3.581 . 0 0 "[ . 1 . 2]" 1
1185 1 46 HIS HD2 1 48 ILE HG13 . . 4.300 2.659 2.133 3.110 . 0 0 "[ . 1 . 2]" 1
1186 1 46 HIS HD2 1 48 ILE MG . . 5.210 4.580 4.265 5.208 . 0 0 "[ . 1 . 2]" 1
1187 1 47 LEU H 1 47 LEU HB2 . . 4.130 3.333 3.194 3.436 . 0 0 "[ . 1 . 2]" 1
1188 1 47 LEU H 1 47 LEU HB3 . . 4.160 2.730 2.596 2.812 . 0 0 "[ . 1 . 2]" 1
1189 1 47 LEU H 1 47 LEU MD1 . . 4.920 4.676 4.542 4.741 . 0 0 "[ . 1 . 2]" 1
1190 1 47 LEU H 1 55 ALA MB . . 4.770 4.068 3.891 4.286 . 0 0 "[ . 1 . 2]" 1
1191 1 47 LEU H 1 56 PHE H . . 4.070 2.945 2.729 3.127 . 0 0 "[ . 1 . 2]" 1
1192 1 47 LEU H 1 56 PHE QB . . 5.090 3.898 3.595 4.119 . 0 0 "[ . 1 . 2]" 1
1193 1 47 LEU H 1 56 PHE QD . . 5.500 4.731 4.252 5.130 . 0 0 "[ . 1 . 2]" 1
1194 1 47 LEU H 1 57 ILE H . . 5.500 4.793 4.672 4.909 . 0 0 "[ . 1 . 2]" 1
1195 1 47 LEU H 1 57 ILE HA . . 5.320 3.279 3.159 3.455 . 0 0 "[ . 1 . 2]" 1
1196 1 47 LEU H 1 57 ILE HG12 . . 5.060 4.239 3.889 4.478 . 0 0 "[ . 1 . 2]" 1
1197 1 47 LEU H 1 57 ILE HG13 . . 4.130 3.831 3.667 4.089 . 0 0 "[ . 1 . 2]" 1
1198 1 47 LEU H 1 95 ILE MD . . 4.000 3.758 3.412 3.977 . 0 0 "[ . 1 . 2]" 1
1199 1 47 LEU H 1 95 ILE MG . . 5.300 3.697 2.931 4.406 . 0 0 "[ . 1 . 2]" 1
1200 1 47 LEU HA 1 47 LEU MD1 . . 3.870 3.783 3.740 3.807 . 0 0 "[ . 1 . 2]" 1
1201 1 47 LEU HA 1 47 LEU MD2 . . 3.430 3.226 3.134 3.364 . 0 0 "[ . 1 . 2]" 1
1202 1 47 LEU HA 1 47 LEU HG . . 3.800 2.650 2.600 2.690 . 0 0 "[ . 1 . 2]" 1
1203 1 47 LEU HA 1 48 ILE H . . 3.130 2.149 2.140 2.171 . 0 0 "[ . 1 . 2]" 1
1204 1 47 LEU HA 1 48 ILE HB . . 5.500 4.946 4.908 4.998 . 0 0 "[ . 1 . 2]" 1
1205 1 47 LEU HA 1 95 ILE MG . . 4.490 3.410 2.802 3.773 . 0 0 "[ . 1 . 2]" 1
1206 1 47 LEU HB2 1 47 LEU MD1 . . 3.140 2.286 2.124 2.322 . 0 0 "[ . 1 . 2]" 1
1207 1 47 LEU HB2 1 48 ILE H . . 4.240 4.173 4.059 4.234 . 0 0 "[ . 1 . 2]" 1
1208 1 47 LEU HB2 1 56 PHE H . . 4.920 4.809 4.624 4.921 0.001 10 0 "[ . 1 . 2]" 1
1209 1 47 LEU HB2 1 56 PHE QB . . 4.440 4.317 4.096 4.441 0.001 20 0 "[ . 1 . 2]" 1
1210 1 47 LEU HB2 1 56 PHE QD . . 4.710 4.521 4.068 4.705 . 0 0 "[ . 1 . 2]" 1
1211 1 47 LEU HB2 1 95 ILE MG . . 4.060 2.043 1.855 2.445 . 0 0 "[ . 1 . 2]" 1
1212 1 47 LEU HB3 1 47 LEU MD1 . . 2.890 2.403 2.358 2.492 . 0 0 "[ . 1 . 2]" 1
1213 1 47 LEU HB3 1 47 LEU MD2 . . 2.860 2.171 2.128 2.202 . 0 0 "[ . 1 . 2]" 1
1214 1 47 LEU HB3 1 48 ILE H . . 4.410 4.263 4.207 4.327 . 0 0 "[ . 1 . 2]" 1
1215 1 47 LEU HB3 1 55 ALA HA . . 5.500 4.614 4.465 4.783 . 0 0 "[ . 1 . 2]" 1
1216 1 47 LEU HB3 1 56 PHE H . . 4.910 3.207 2.962 3.326 . 0 0 "[ . 1 . 2]" 1
1217 1 47 LEU HB3 1 56 PHE QB . . 4.270 2.876 2.673 3.086 . 0 0 "[ . 1 . 2]" 1
1218 1 47 LEU HB3 1 56 PHE QD . . 4.680 2.935 2.418 3.181 . 0 0 "[ . 1 . 2]" 1
1219 1 47 LEU HB3 1 92 TYR QE . . 5.500 4.555 3.217 5.248 . 0 0 "[ . 1 . 2]" 1
1220 1 47 LEU HB3 1 95 ILE MG . . 3.480 3.195 2.902 3.471 . 0 0 "[ . 1 . 2]" 1
1221 1 47 LEU MD1 1 48 ILE H . . 4.780 4.519 4.353 4.625 . 0 0 "[ . 1 . 2]" 1
1222 1 47 LEU MD1 1 49 LEU H . . 5.500 5.032 4.712 5.452 . 0 0 "[ . 1 . 2]" 1
1223 1 47 LEU MD1 1 49 LEU MD1 . . 4.240 4.184 3.915 4.242 0.002 9 0 "[ . 1 . 2]" 1
1224 1 47 LEU MD1 1 55 ALA HA . . 5.500 5.335 5.173 5.474 . 0 0 "[ . 1 . 2]" 1
1225 1 47 LEU MD1 1 56 PHE H . . 4.970 4.816 4.606 4.970 . 0 0 "[ . 1 . 2]" 1
1226 1 47 LEU MD1 1 56 PHE QB . . 3.980 3.797 3.516 3.976 . 0 0 "[ . 1 . 2]" 1
1227 1 47 LEU MD1 1 56 PHE QD . . 3.780 3.216 2.952 3.491 . 0 0 "[ . 1 . 2]" 1
1228 1 47 LEU MD1 1 56 PHE QE . . 4.360 4.090 3.570 4.330 . 0 0 "[ . 1 . 2]" 1
1229 1 47 LEU MD1 1 92 TYR QB . . 5.340 4.361 3.035 5.336 . 0 0 "[ . 1 . 2]" 1
1230 1 47 LEU MD1 1 92 TYR QD . . 4.160 3.268 2.005 4.088 . 0 0 "[ . 1 . 2]" 1
1231 1 47 LEU MD1 1 92 TYR QE . . 4.370 2.902 2.324 3.780 . 0 0 "[ . 1 . 2]" 1
1232 1 47 LEU MD2 1 48 ILE H . . 3.340 2.767 2.528 2.981 . 0 0 "[ . 1 . 2]" 1
1233 1 47 LEU MD2 1 49 LEU HA . . 3.950 3.400 3.259 3.634 . 0 0 "[ . 1 . 2]" 1
1234 1 47 LEU MD2 1 49 LEU HG . . 3.290 2.133 1.936 2.403 . 0 0 "[ . 1 . 2]" 1
1235 1 47 LEU MD2 1 55 ALA H . . 5.500 5.215 5.014 5.416 . 0 0 "[ . 1 . 2]" 1
1236 1 47 LEU MD2 1 55 ALA HA . . 3.870 2.923 2.817 3.055 . 0 0 "[ . 1 . 2]" 1
1237 1 47 LEU MD2 1 56 PHE H . . 4.010 2.893 2.647 3.170 . 0 0 "[ . 1 . 2]" 1
1238 1 47 LEU MD2 1 56 PHE QB . . 4.150 3.473 3.278 3.776 . 0 0 "[ . 1 . 2]" 1
1239 1 47 LEU MD2 1 56 PHE QD . . 4.000 2.071 1.959 2.269 . 0 0 "[ . 1 . 2]" 1
1240 1 47 LEU MD2 1 56 PHE QE . . 3.670 3.012 2.424 3.260 . 0 0 "[ . 1 . 2]" 1
1241 1 47 LEU MD2 1 92 TYR QE . . 3.910 3.572 2.552 3.913 0.003 17 0 "[ . 1 . 2]" 1
1242 1 47 LEU HG 1 48 ILE H . . 3.920 3.028 2.797 3.168 . 0 0 "[ . 1 . 2]" 1
1243 1 47 LEU HG 1 49 LEU MD2 . . 3.450 3.365 3.173 3.451 0.001 13 0 "[ . 1 . 2]" 1
1244 1 47 LEU HG 1 56 PHE QD . . 4.780 4.696 4.429 4.778 . 0 0 "[ . 1 . 2]" 1
1245 1 48 ILE H 1 48 ILE HB . . 3.530 2.974 2.894 3.042 . 0 0 "[ . 1 . 2]" 1
1246 1 48 ILE H 1 48 ILE MD . . 4.320 4.040 3.887 4.180 . 0 0 "[ . 1 . 2]" 1
1247 1 48 ILE H 1 48 ILE HG12 . . 3.450 3.336 3.173 3.439 . 0 0 "[ . 1 . 2]" 1
1248 1 48 ILE H 1 48 ILE HG13 . . 3.490 2.489 2.325 2.690 . 0 0 "[ . 1 . 2]" 1
1249 1 48 ILE H 1 48 ILE MG . . 3.990 3.942 3.918 3.965 . 0 0 "[ . 1 . 2]" 1
1250 1 48 ILE HA 1 48 ILE MD . . 3.920 3.864 3.760 3.925 0.005 12 0 "[ . 1 . 2]" 1
1251 1 48 ILE HA 1 48 ILE HG12 . . 3.500 2.746 2.662 2.805 . 0 0 "[ . 1 . 2]" 1
1252 1 48 ILE HA 1 48 ILE HG13 . . 3.890 3.446 3.352 3.538 . 0 0 "[ . 1 . 2]" 1
1253 1 48 ILE HA 1 48 ILE MG . . 3.330 2.154 2.034 2.277 . 0 0 "[ . 1 . 2]" 1
1254 1 48 ILE HA 1 49 LEU H . . 3.130 2.166 2.140 2.199 . 0 0 "[ . 1 . 2]" 1
1255 1 48 ILE HA 1 49 LEU HB2 . . 4.910 4.734 4.636 4.843 . 0 0 "[ . 1 . 2]" 1
1256 1 48 ILE HA 1 49 LEU HG . . 4.270 3.761 3.506 3.934 . 0 0 "[ . 1 . 2]" 1
1257 1 48 ILE HA 1 55 ALA HA . . 3.560 2.664 2.522 2.767 . 0 0 "[ . 1 . 2]" 1
1258 1 48 ILE HA 1 55 ALA MB . . 3.600 2.628 2.416 2.836 . 0 0 "[ . 1 . 2]" 1
1259 1 48 ILE HA 1 56 PHE H . . 4.240 3.810 3.684 3.923 . 0 0 "[ . 1 . 2]" 1
1260 1 48 ILE HB 1 48 ILE MD . . 2.920 2.470 2.395 2.573 . 0 0 "[ . 1 . 2]" 1
1261 1 48 ILE HB 1 48 ILE HG13 . . 2.920 2.409 2.350 2.461 . 0 0 "[ . 1 . 2]" 1
1262 1 48 ILE HB 1 49 LEU H . . 4.840 4.181 4.006 4.267 . 0 0 "[ . 1 . 2]" 1
1263 1 48 ILE HB 1 49 LEU HA . . 5.500 4.924 4.709 5.048 . 0 0 "[ . 1 . 2]" 1
1264 1 48 ILE HB 1 55 ALA MB . . 4.620 4.382 4.260 4.533 . 0 0 "[ . 1 . 2]" 1
1265 1 48 ILE MD 1 48 ILE MG . . 2.700 1.923 1.855 2.001 . 0 0 "[ . 1 . 2]" 1
1266 1 48 ILE MD 1 49 LEU H . . 5.500 5.416 5.282 5.501 0.001 11 0 "[ . 1 . 2]" 1
1267 1 48 ILE MD 1 55 ALA HA . . 5.500 5.323 5.102 5.492 . 0 0 "[ . 1 . 2]" 1
1268 1 48 ILE MD 1 55 ALA MB . . 3.610 3.410 3.095 3.616 0.006 7 0 "[ . 1 . 2]" 1
1269 1 48 ILE MD 1 56 PHE H . . 5.500 5.444 5.296 5.503 0.003 4 0 "[ . 1 . 2]" 1
1270 1 48 ILE HG12 1 55 ALA HA . . 4.480 4.254 4.044 4.466 . 0 0 "[ . 1 . 2]" 1
1271 1 48 ILE HG12 1 55 ALA MB . . 3.070 2.661 2.430 2.961 . 0 0 "[ . 1 . 2]" 1
1272 1 48 ILE HG13 1 48 ILE MG . . 3.250 3.188 3.173 3.201 . 0 0 "[ . 1 . 2]" 1
1273 1 48 ILE MG 1 49 LEU H . . 3.630 3.077 2.738 3.315 . 0 0 "[ . 1 . 2]" 1
1274 1 48 ILE MG 1 54 GLU H . . 5.430 4.648 4.450 4.821 . 0 0 "[ . 1 . 2]" 1
1275 1 48 ILE MG 1 55 ALA H . . 5.480 4.873 4.628 5.108 . 0 0 "[ . 1 . 2]" 1
1276 1 48 ILE MG 1 55 ALA HA . . 4.220 3.600 3.405 3.801 . 0 0 "[ . 1 . 2]" 1
1277 1 48 ILE MG 1 55 ALA MB . . 3.260 2.195 1.988 2.346 . 0 0 "[ . 1 . 2]" 1
1278 1 48 ILE MG 1 56 PHE H . . 4.880 4.763 4.634 4.872 . 0 0 "[ . 1 . 2]" 1
1279 1 49 LEU H 1 49 LEU HB2 . . 3.640 2.648 2.536 2.709 . 0 0 "[ . 1 . 2]" 1
1280 1 49 LEU H 1 49 LEU HB3 . . 3.880 3.594 3.576 3.651 . 0 0 "[ . 1 . 2]" 1
1281 1 49 LEU H 1 49 LEU MD1 . . 4.010 3.387 3.191 3.621 . 0 0 "[ . 1 . 2]" 1
1282 1 49 LEU H 1 49 LEU MD2 . . 4.020 3.268 3.101 3.559 . 0 0 "[ . 1 . 2]" 1
1283 1 49 LEU H 1 49 LEU HG . . 2.920 2.006 1.904 2.220 . 0 0 "[ . 1 . 2]" 1
1284 1 49 LEU H 1 52 ILE MD . . 5.130 4.028 3.903 4.152 . 0 0 "[ . 1 . 2]" 1
1285 1 49 LEU H 1 54 GLU H . . 5.450 4.485 4.104 4.838 . 0 0 "[ . 1 . 2]" 1
1286 1 49 LEU H 1 55 ALA HA . . 3.790 3.289 3.146 3.497 . 0 0 "[ . 1 . 2]" 1
1287 1 49 LEU H 1 55 ALA MB . . 3.950 3.865 3.647 3.953 0.003 9 0 "[ . 1 . 2]" 1
1288 1 49 LEU H 1 56 PHE H . . 5.500 5.008 4.727 5.325 . 0 0 "[ . 1 . 2]" 1
1289 1 49 LEU HA 1 49 LEU MD1 . . 4.010 3.961 3.888 4.010 0.000 17 0 "[ . 1 . 2]" 1
1290 1 49 LEU HA 1 49 LEU MD2 . . 3.160 2.435 2.169 2.699 . 0 0 "[ . 1 . 2]" 1
1291 1 49 LEU HA 1 49 LEU HG . . 4.150 3.138 3.025 3.274 . 0 0 "[ . 1 . 2]" 1
1292 1 49 LEU HB2 1 49 LEU MD1 . . 3.450 2.159 1.977 2.357 . 0 0 "[ . 1 . 2]" 1
1293 1 49 LEU HB2 1 49 LEU MD2 . . 3.590 3.166 3.111 3.193 . 0 0 "[ . 1 . 2]" 1
1294 1 49 LEU HB2 1 52 ILE H . . 4.340 3.024 2.868 3.180 . 0 0 "[ . 1 . 2]" 1
1295 1 49 LEU HB2 1 52 ILE MD . . 3.560 2.018 1.966 2.091 . 0 0 "[ . 1 . 2]" 1
1296 1 49 LEU HB2 1 52 ILE HG12 . . 4.720 4.191 4.019 4.323 . 0 0 "[ . 1 . 2]" 1
1297 1 49 LEU HB2 1 52 ILE HG13 . . 4.950 4.911 4.835 4.952 0.002 14 0 "[ . 1 . 2]" 1
1298 1 49 LEU HB2 1 52 ILE MG . . 4.940 4.677 4.554 4.903 . 0 0 "[ . 1 . 2]" 1
1299 1 49 LEU HB2 1 54 GLU H . . 4.010 3.573 3.109 3.715 . 0 0 "[ . 1 . 2]" 1
1300 1 49 LEU HB3 1 49 LEU MD1 . . 2.890 2.520 2.295 2.670 . 0 0 "[ . 1 . 2]" 1
1301 1 49 LEU HB3 1 49 LEU MD2 . . 3.070 2.178 2.024 2.333 . 0 0 "[ . 1 . 2]" 1
1302 1 49 LEU HB3 1 52 ILE H . . 3.730 3.582 3.180 3.710 . 0 0 "[ . 1 . 2]" 1
1303 1 49 LEU HB3 1 52 ILE MD . . 3.030 2.951 2.640 3.026 . 0 0 "[ . 1 . 2]" 1
1304 1 49 LEU MD1 1 52 ILE H . . 3.920 3.872 3.689 3.922 0.002 9 0 "[ . 1 . 2]" 1
1305 1 49 LEU MD1 1 52 ILE MD . . 2.820 1.803 1.757 1.884 . 0 0 "[ . 1 . 2]" 1
1306 1 49 LEU MD1 1 52 ILE HG13 . . 3.830 3.773 3.672 3.833 0.003 6 0 "[ . 1 . 2]" 1
1307 1 49 LEU MD1 1 54 GLU H . . 3.820 3.696 3.355 3.814 . 0 0 "[ . 1 . 2]" 1
1308 1 49 LEU MD1 1 54 GLU HA . . 5.260 4.585 4.277 4.803 . 0 0 "[ . 1 . 2]" 1
1309 1 49 LEU MD1 1 54 GLU HB2 . . 3.210 2.327 1.995 2.619 . 0 0 "[ . 1 . 2]" 1
1310 1 49 LEU MD1 1 54 GLU HB3 . . 4.080 2.845 2.564 3.159 . 0 0 "[ . 1 . 2]" 1
1311 1 49 LEU MD1 1 54 GLU QG . . 4.140 3.899 3.697 4.134 . 0 0 "[ . 1 . 2]" 1
1312 1 49 LEU MD1 1 55 ALA H . . 5.500 5.022 4.695 5.365 . 0 0 "[ . 1 . 2]" 1
1313 1 49 LEU MD1 1 55 ALA HA . . 4.810 4.302 3.808 4.670 . 0 0 "[ . 1 . 2]" 1
1314 1 49 LEU MD1 1 56 PHE QD . . 4.360 4.062 3.832 4.341 . 0 0 "[ . 1 . 2]" 1
1315 1 49 LEU MD1 1 56 PHE QE . . 3.570 2.342 2.049 2.822 . 0 0 "[ . 1 . 2]" 1
1316 1 49 LEU MD1 1 56 PHE HZ . . 4.180 3.595 2.924 3.995 . 0 0 "[ . 1 . 2]" 1
1317 1 49 LEU MD2 1 51 LYS QG . . 5.340 4.585 3.896 5.221 . 0 0 "[ . 1 . 2]" 1
1318 1 49 LEU MD2 1 55 ALA HA . . 5.300 5.086 4.904 5.264 . 0 0 "[ . 1 . 2]" 1
1319 1 49 LEU MD2 1 56 PHE QD . . 4.660 4.363 4.174 4.627 . 0 0 "[ . 1 . 2]" 1
1320 1 49 LEU MD2 1 56 PHE QE . . 3.840 3.629 3.248 3.809 . 0 0 "[ . 1 . 2]" 1
1321 1 49 LEU HG 1 55 ALA HA . . 4.520 3.847 3.649 3.985 . 0 0 "[ . 1 . 2]" 1
1322 1 49 LEU HG 1 56 PHE QD . . 4.620 4.141 3.959 4.593 . 0 0 "[ . 1 . 2]" 1
1323 1 49 LEU HG 1 56 PHE QE . . 4.310 3.420 2.783 3.883 . 0 0 "[ . 1 . 2]" 1
1324 1 50 ASN QB 1 51 LYS QG . . 4.220 3.947 3.560 4.219 . 0 0 "[ . 1 . 2]" 1
1325 1 51 LYS HA 1 51 LYS QD . . 3.780 3.283 2.354 3.761 . 0 0 "[ . 1 . 2]" 1
1326 1 51 LYS HA 1 51 LYS QE . . 5.230 4.156 2.412 5.022 . 0 0 "[ . 1 . 2]" 1
1327 1 51 LYS HA 1 51 LYS HG2 . . 3.650 2.429 2.129 3.562 . 0 0 "[ . 1 . 2]" 1
1328 1 51 LYS HA 1 51 LYS QG . . 3.150 2.283 2.093 2.438 . 0 0 "[ . 1 . 2]" 1
1329 1 51 LYS HA 1 51 LYS HG3 . . 3.650 3.380 2.343 3.654 0.004 1 0 "[ . 1 . 2]" 1
1330 1 51 LYS HA 1 52 ILE MD . . 5.500 4.428 4.241 4.607 . 0 0 "[ . 1 . 2]" 1
1331 1 51 LYS HA 1 52 ILE MG . . 5.070 3.863 3.796 3.953 . 0 0 "[ . 1 . 2]" 1
1332 1 51 LYS QB 1 52 ILE H . . 3.150 2.566 2.341 2.726 . 0 0 "[ . 1 . 2]" 1
1333 1 51 LYS QB 1 52 ILE MD . . 3.110 2.452 2.270 2.607 . 0 0 "[ . 1 . 2]" 1
1334 1 51 LYS QB 1 52 ILE MG . . 2.850 2.303 2.114 2.544 . 0 0 "[ . 1 . 2]" 1
1335 1 51 LYS HB2 1 51 LYS QD . . 3.650 2.915 2.045 3.424 . 0 0 "[ . 1 . 2]" 1
1336 1 51 LYS HB3 1 51 LYS QD . . 3.650 2.193 1.968 3.277 . 0 0 "[ . 1 . 2]" 1
1337 1 51 LYS QD 1 52 ILE MG . . 4.780 3.814 3.259 4.443 . 0 0 "[ . 1 . 2]" 1
1338 1 51 LYS QG 1 52 ILE MG . . 4.780 4.193 4.062 4.345 . 0 0 "[ . 1 . 2]" 1
1339 1 51 LYS HG2 1 52 ILE MD . . 5.500 4.955 4.667 5.185 . 0 0 "[ . 1 . 2]" 1
1340 1 51 LYS HG2 1 52 ILE MG . . 5.500 4.763 4.380 5.024 . 0 0 "[ . 1 . 2]" 1
1341 1 51 LYS HG3 1 52 ILE MD . . 5.500 4.488 3.950 5.009 . 0 0 "[ . 1 . 2]" 1
1342 1 51 LYS HG3 1 52 ILE MG . . 5.500 4.672 4.498 4.899 . 0 0 "[ . 1 . 2]" 1
1343 1 52 ILE H 1 52 ILE MD . . 3.620 1.833 1.742 1.922 . 0 0 "[ . 1 . 2]" 1
1344 1 52 ILE H 1 52 ILE HG12 . . 3.580 3.458 3.366 3.580 0.000 10 0 "[ . 1 . 2]" 1
1345 1 52 ILE H 1 52 ILE HG13 . . 4.170 4.065 3.996 4.149 . 0 0 "[ . 1 . 2]" 1
1346 1 52 ILE H 1 52 ILE MG . . 3.950 2.670 2.442 2.920 . 0 0 "[ . 1 . 2]" 1
1347 1 52 ILE H 1 53 ASN H . . 4.640 4.352 4.281 4.438 . 0 0 "[ . 1 . 2]" 1
1348 1 52 ILE H 1 54 GLU H . . 4.670 3.834 3.735 3.926 . 0 0 "[ . 1 . 2]" 1
1349 1 52 ILE HA 1 52 ILE MD . . 4.050 3.482 3.404 3.523 . 0 0 "[ . 1 . 2]" 1
1350 1 52 ILE HA 1 52 ILE MG . . 3.170 2.528 2.369 2.584 . 0 0 "[ . 1 . 2]" 1
1351 1 52 ILE HA 1 53 ASN H . . 3.390 2.688 2.538 2.798 . 0 0 "[ . 1 . 2]" 1
1352 1 52 ILE HA 1 53 ASN HB2 . . 5.130 4.895 4.549 5.109 . 0 0 "[ . 1 . 2]" 1
1353 1 52 ILE HB 1 53 ASN H . . 3.810 2.047 1.915 2.279 . 0 0 "[ . 1 . 2]" 1
1354 1 52 ILE HB 1 54 GLU H . . 4.750 4.189 4.048 4.359 . 0 0 "[ . 1 . 2]" 1
1355 1 52 ILE HB 1 54 GLU QG . . 4.050 3.762 3.582 4.018 . 0 0 "[ . 1 . 2]" 1
1356 1 52 ILE MD 1 53 ASN H . . 5.080 3.802 3.551 3.968 . 0 0 "[ . 1 . 2]" 1
1357 1 52 ILE MD 1 53 ASN HA . . 4.710 4.360 4.043 4.551 . 0 0 "[ . 1 . 2]" 1
1358 1 52 ILE MD 1 54 GLU H . . 3.750 2.403 2.251 2.521 . 0 0 "[ . 1 . 2]" 1
1359 1 52 ILE MD 1 54 GLU HA . . 4.340 4.318 4.228 4.346 0.006 6 0 "[ . 1 . 2]" 1
1360 1 52 ILE MD 1 54 GLU HB2 . . 4.680 2.019 1.930 2.085 . 0 0 "[ . 1 . 2]" 1
1361 1 52 ILE MD 1 54 GLU HB3 . . 3.460 3.370 3.229 3.450 . 0 0 "[ . 1 . 2]" 1
1362 1 52 ILE MD 1 54 GLU QG . . 3.690 3.072 2.907 3.256 . 0 0 "[ . 1 . 2]" 1
1363 1 52 ILE MD 1 55 ALA H . . 5.500 5.419 5.227 5.484 . 0 0 "[ . 1 . 2]" 1
1364 1 52 ILE HG12 1 53 ASN H . . 4.980 2.476 2.243 2.707 . 0 0 "[ . 1 . 2]" 1
1365 1 52 ILE HG12 1 53 ASN HB2 . . 5.180 4.267 4.175 4.401 . 0 0 "[ . 1 . 2]" 1
1366 1 52 ILE HG12 1 54 GLU H . . 5.380 2.030 1.900 2.220 . 0 0 "[ . 1 . 2]" 1
1367 1 52 ILE HG12 1 54 GLU QG . . 4.540 2.330 2.128 2.758 . 0 0 "[ . 1 . 2]" 1
1368 1 52 ILE HG13 1 52 ILE MG . . 3.310 2.309 2.227 2.415 . 0 0 "[ . 1 . 2]" 1
1369 1 52 ILE HG13 1 53 ASN H . . 4.880 3.577 3.374 3.915 . 0 0 "[ . 1 . 2]" 1
1370 1 52 ILE HG13 1 54 GLU H . . 4.050 3.676 3.534 3.893 . 0 0 "[ . 1 . 2]" 1
1371 1 52 ILE HG13 1 54 GLU HB3 . . 4.730 4.210 3.968 4.337 . 0 0 "[ . 1 . 2]" 1
1372 1 52 ILE HG13 1 54 GLU QG . . 4.100 2.166 2.012 2.428 . 0 0 "[ . 1 . 2]" 1
1373 1 52 ILE MG 1 53 ASN H . . 3.910 3.681 3.594 3.820 . 0 0 "[ . 1 . 2]" 1
1374 1 52 ILE MG 1 54 GLU H . . 4.710 4.624 4.503 4.702 . 0 0 "[ . 1 . 2]" 1
1375 1 52 ILE MG 1 54 GLU QG . . 4.130 4.044 3.915 4.128 . 0 0 "[ . 1 . 2]" 1
1376 1 53 ASN H 1 53 ASN HB2 . . 4.100 2.426 2.228 2.584 . 0 0 "[ . 1 . 2]" 1
1377 1 53 ASN H 1 54 GLU H . . 3.970 3.287 3.164 3.407 . 0 0 "[ . 1 . 2]" 1
1378 1 53 ASN HA 1 53 ASN HD22 . . 5.500 4.632 4.489 4.771 . 0 0 "[ . 1 . 2]" 1
1379 1 53 ASN HA 1 54 GLU H . . 3.110 2.674 2.615 2.717 . 0 0 "[ . 1 . 2]" 1
1380 1 53 ASN HA 1 54 GLU HA . . 5.500 4.443 4.430 4.458 . 0 0 "[ . 1 . 2]" 1
1381 1 53 ASN HB2 1 53 ASN HD22 . . 4.080 3.521 3.437 3.602 . 0 0 "[ . 1 . 2]" 1
1382 1 53 ASN HB2 1 54 GLU H . . 4.990 4.355 4.297 4.387 . 0 0 "[ . 1 . 2]" 1
1383 1 53 ASN HB3 1 54 GLU H . . 4.830 4.406 4.350 4.456 . 0 0 "[ . 1 . 2]" 1
1384 1 54 GLU H 1 54 GLU HB3 . . 3.810 3.651 3.591 3.695 . 0 0 "[ . 1 . 2]" 1
1385 1 54 GLU H 1 54 GLU QG . . 3.950 3.281 3.185 3.731 . 0 0 "[ . 1 . 2]" 1
1386 1 54 GLU H 1 55 ALA H . . 4.620 4.319 4.155 4.439 . 0 0 "[ . 1 . 2]" 1
1387 1 54 GLU HA 1 54 GLU QG . . 3.600 2.216 2.110 2.778 . 0 0 "[ . 1 . 2]" 1
1388 1 54 GLU HA 1 55 ALA H . . 3.270 2.151 2.138 2.189 . 0 0 "[ . 1 . 2]" 1
1389 1 54 GLU HA 1 55 ALA MB . . 4.160 3.975 3.921 4.063 . 0 0 "[ . 1 . 2]" 1
1390 1 54 GLU HB2 1 55 ALA H . . 4.530 4.368 4.202 4.501 . 0 0 "[ . 1 . 2]" 1
1391 1 54 GLU HB3 1 55 ALA H . . 3.960 3.402 3.098 3.730 . 0 0 "[ . 1 . 2]" 1
1392 1 54 GLU HB3 1 55 ALA HA . . 5.050 4.317 4.138 4.474 . 0 0 "[ . 1 . 2]" 1
1393 1 54 GLU HB3 1 56 PHE QE . . 4.880 3.255 2.732 3.576 . 0 0 "[ . 1 . 2]" 1
1394 1 54 GLU QG 1 55 ALA H . . 4.290 3.928 3.762 4.074 . 0 0 "[ . 1 . 2]" 1
1395 1 55 ALA H 1 55 ALA MB . . 3.370 2.586 2.410 2.710 . 0 0 "[ . 1 . 2]" 1
1396 1 55 ALA HA 1 56 PHE H . . 3.210 2.333 2.266 2.426 . 0 0 "[ . 1 . 2]" 1
1397 1 55 ALA HA 1 56 PHE QB . . 5.260 4.478 4.426 4.572 . 0 0 "[ . 1 . 2]" 1
1398 1 55 ALA HA 1 56 PHE QD . . 4.400 3.429 2.991 3.871 . 0 0 "[ . 1 . 2]" 1
1399 1 55 ALA HA 1 56 PHE QE . . 5.100 4.086 3.645 4.424 . 0 0 "[ . 1 . 2]" 1
1400 1 55 ALA MB 1 56 PHE H . . 3.360 2.560 2.322 2.811 . 0 0 "[ . 1 . 2]" 1
1401 1 55 ALA MB 1 56 PHE HA . . 4.290 3.924 3.862 3.983 . 0 0 "[ . 1 . 2]" 1
1402 1 56 PHE H 1 56 PHE QB . . 3.640 2.884 2.764 3.003 . 0 0 "[ . 1 . 2]" 1
1403 1 56 PHE H 1 56 PHE QD . . 3.780 2.951 2.600 3.328 . 0 0 "[ . 1 . 2]" 1
1404 1 56 PHE H 1 56 PHE QE . . 5.020 4.711 4.423 4.934 . 0 0 "[ . 1 . 2]" 1
1405 1 56 PHE H 1 57 ILE H . . 4.960 4.152 4.037 4.287 . 0 0 "[ . 1 . 2]" 1
1406 1 56 PHE H 1 57 ILE MD . . 5.500 5.233 4.994 5.440 . 0 0 "[ . 1 . 2]" 1
1407 1 56 PHE H 1 57 ILE HG13 . . 5.280 4.120 3.952 4.318 . 0 0 "[ . 1 . 2]" 1
1408 1 56 PHE H 1 95 ILE MD . . 5.260 4.812 4.329 5.141 . 0 0 "[ . 1 . 2]" 1
1409 1 56 PHE HA 1 56 PHE QD . . 4.280 2.947 2.675 3.204 . 0 0 "[ . 1 . 2]" 1
1410 1 56 PHE HA 1 57 ILE H . . 3.340 2.147 2.139 2.175 . 0 0 "[ . 1 . 2]" 1
1411 1 56 PHE HA 1 57 ILE HB . . 4.540 4.508 4.461 4.546 0.006 6 0 "[ . 1 . 2]" 1
1412 1 56 PHE HA 1 57 ILE HG13 . . 5.060 4.000 3.826 4.221 . 0 0 "[ . 1 . 2]" 1
1413 1 56 PHE QB 1 57 ILE H . . 4.220 3.264 3.048 3.425 . 0 0 "[ . 1 . 2]" 1
1414 1 56 PHE QB 1 57 ILE HG13 . . 5.160 5.017 4.873 5.141 . 0 0 "[ . 1 . 2]" 1
1415 1 56 PHE QB 1 95 ILE MD . . 3.440 2.899 2.407 3.442 0.002 20 0 "[ . 1 . 2]" 1
1416 1 56 PHE QB 1 95 ILE MG . . 4.780 4.549 4.184 4.782 0.002 9 0 "[ . 1 . 2]" 1
1417 1 56 PHE QD 1 57 ILE H . . 4.720 4.533 4.320 4.703 . 0 0 "[ . 1 . 2]" 1
1418 1 56 PHE QD 1 95 ILE MD . . 4.540 4.368 4.064 4.537 . 0 0 "[ . 1 . 2]" 1
1419 1 57 ILE H 1 57 ILE HB . . 3.980 2.486 2.412 2.559 . 0 0 "[ . 1 . 2]" 1
1420 1 57 ILE H 1 57 ILE MD . . 4.640 3.674 3.546 3.782 . 0 0 "[ . 1 . 2]" 1
1421 1 57 ILE H 1 57 ILE HG12 . . 4.610 4.191 4.045 4.333 . 0 0 "[ . 1 . 2]" 1
1422 1 57 ILE H 1 57 ILE HG13 . . 4.140 2.909 2.769 3.063 . 0 0 "[ . 1 . 2]" 1
1423 1 57 ILE H 1 57 ILE MG . . 4.300 3.767 3.720 3.806 . 0 0 "[ . 1 . 2]" 1
1424 1 57 ILE H 1 58 GLU H . . 5.500 4.445 4.322 4.502 . 0 0 "[ . 1 . 2]" 1
1425 1 57 ILE H 1 95 ILE MD . . 5.400 4.860 4.249 5.354 . 0 0 "[ . 1 . 2]" 1
1426 1 57 ILE HA 1 57 ILE MD . . 3.860 3.837 3.805 3.857 . 0 0 "[ . 1 . 2]" 1
1427 1 57 ILE HA 1 57 ILE HG12 . . 3.910 2.689 2.606 2.755 . 0 0 "[ . 1 . 2]" 1
1428 1 57 ILE HA 1 57 ILE HG13 . . 3.780 2.654 2.532 2.758 . 0 0 "[ . 1 . 2]" 1
1429 1 57 ILE HA 1 57 ILE MG . . 3.360 2.413 2.361 2.471 . 0 0 "[ . 1 . 2]" 1
1430 1 57 ILE HA 1 58 GLU H . . 3.320 2.171 2.140 2.198 . 0 0 "[ . 1 . 2]" 1
1431 1 57 ILE HA 1 95 ILE MD . . 4.050 3.787 3.370 4.043 . 0 0 "[ . 1 . 2]" 1
1432 1 57 ILE HB 1 57 ILE MD . . 3.140 2.297 2.227 2.344 . 0 0 "[ . 1 . 2]" 1
1433 1 57 ILE MD 1 57 ILE MG . . 2.920 2.239 2.079 2.366 . 0 0 "[ . 1 . 2]" 1
1434 1 57 ILE HG12 1 58 GLU H . . 5.420 4.255 4.084 4.462 . 0 0 "[ . 1 . 2]" 1
1435 1 57 ILE HG13 1 57 ILE MG . . 3.440 3.163 3.146 3.182 . 0 0 "[ . 1 . 2]" 1
1436 1 57 ILE HG13 1 58 GLU H . . 5.500 4.708 4.583 4.862 . 0 0 "[ . 1 . 2]" 1
1437 1 57 ILE MG 1 58 GLU H . . 3.520 2.299 2.064 2.727 . 0 0 "[ . 1 . 2]" 1
1438 1 57 ILE MG 1 59 MET HA . . 4.400 3.858 3.751 3.982 . 0 0 "[ . 1 . 2]" 1
1439 1 57 ILE MG 1 59 MET HB2 . . 5.500 5.061 4.905 5.267 . 0 0 "[ . 1 . 2]" 1
1440 1 57 ILE MG 1 59 MET HG2 . . 4.420 3.128 2.919 3.320 . 0 0 "[ . 1 . 2]" 1
1441 1 58 GLU H 1 58 GLU HB2 . . 3.900 2.802 2.723 2.909 . 0 0 "[ . 1 . 2]" 1
1442 1 58 GLU H 1 58 GLU HB3 . . 3.810 2.604 2.523 2.656 . 0 0 "[ . 1 . 2]" 1
1443 1 58 GLU H 1 58 GLU HG3 . . 4.770 4.564 4.467 4.717 . 0 0 "[ . 1 . 2]" 1
1444 1 58 GLU H 1 95 ILE MD . . 4.170 3.321 2.760 3.696 . 0 0 "[ . 1 . 2]" 1
1445 1 58 GLU HA 1 58 GLU HG3 . . 4.110 2.507 2.299 2.848 . 0 0 "[ . 1 . 2]" 1
1446 1 58 GLU HA 1 59 MET H . . 3.250 2.145 2.139 2.164 . 0 0 "[ . 1 . 2]" 1
1447 1 58 GLU HB2 1 95 ILE MD . . 3.240 2.166 1.888 2.505 . 0 0 "[ . 1 . 2]" 1
1448 1 58 GLU HB2 1 95 ILE QG . . 5.290 3.920 2.688 4.613 . 0 0 "[ . 1 . 2]" 1
1449 1 58 GLU HB3 1 95 ILE MD . . 3.830 3.105 2.640 3.539 . 0 0 "[ . 1 . 2]" 1
1450 1 58 GLU HG2 1 59 MET H . . 4.340 3.490 2.551 4.181 . 0 0 "[ . 1 . 2]" 1
1451 1 58 GLU HG2 1 95 ILE MD . . 4.620 4.438 4.097 4.626 0.006 14 0 "[ . 1 . 2]" 1
1452 1 59 MET H 1 59 MET HB2 . . 3.880 2.532 2.438 2.616 . 0 0 "[ . 1 . 2]" 1
1453 1 59 MET H 1 59 MET ME . . 5.010 4.877 4.769 4.978 . 0 0 "[ . 1 . 2]" 1
1454 1 59 MET H 1 59 MET HG2 . . 3.590 2.440 2.245 2.560 . 0 0 "[ . 1 . 2]" 1
1455 1 59 MET H 1 59 MET HG3 . . 4.320 3.808 3.683 3.916 . 0 0 "[ . 1 . 2]" 1
1456 1 59 MET H 1 60 ALA H . . 4.590 4.572 4.553 4.590 . 0 0 "[ . 1 . 2]" 1
1457 1 59 MET H 1 61 THR H . . 5.500 4.975 4.635 5.127 . 0 0 "[ . 1 . 2]" 1
1458 1 59 MET H 1 65 ALA H . . 4.960 4.805 4.648 4.945 . 0 0 "[ . 1 . 2]" 1
1459 1 59 MET H 1 65 ALA MB . . 4.170 3.244 3.036 3.413 . 0 0 "[ . 1 . 2]" 1
1460 1 59 MET HA 1 59 MET ME . . 3.720 3.409 3.283 3.572 . 0 0 "[ . 1 . 2]" 1
1461 1 59 MET HA 1 60 ALA H . . 3.190 2.327 2.218 2.438 . 0 0 "[ . 1 . 2]" 1
1462 1 59 MET HA 1 60 ALA HA . . 4.980 4.311 4.305 4.321 . 0 0 "[ . 1 . 2]" 1
1463 1 59 MET HA 1 60 ALA MB . . 4.130 4.032 3.969 4.101 . 0 0 "[ . 1 . 2]" 1
1464 1 59 MET HA 1 61 THR H . . 4.570 4.033 3.724 4.184 . 0 0 "[ . 1 . 2]" 1
1465 1 59 MET HB2 1 59 MET ME . . 3.780 3.571 3.426 3.699 . 0 0 "[ . 1 . 2]" 1
1466 1 59 MET HB2 1 60 ALA H . . 4.020 3.713 3.485 3.965 . 0 0 "[ . 1 . 2]" 1
1467 1 59 MET HB2 1 60 ALA MB . . 5.200 5.037 4.890 5.186 . 0 0 "[ . 1 . 2]" 1
1468 1 59 MET HB2 1 61 THR H . . 3.960 3.140 2.951 3.391 . 0 0 "[ . 1 . 2]" 1
1469 1 59 MET HB2 1 62 THR H . . 5.170 5.068 4.883 5.152 . 0 0 "[ . 1 . 2]" 1
1470 1 59 MET HB2 1 65 ALA H . . 3.650 2.649 2.471 2.841 . 0 0 "[ . 1 . 2]" 1
1471 1 59 MET HB2 1 65 ALA MB . . 3.720 2.397 2.183 2.681 . 0 0 "[ . 1 . 2]" 1
1472 1 59 MET HB3 1 59 MET ME . . 3.100 2.283 2.070 2.493 . 0 0 "[ . 1 . 2]" 1
1473 1 59 MET HB3 1 60 ALA H . . 3.570 2.644 2.378 2.959 . 0 0 "[ . 1 . 2]" 1
1474 1 59 MET HB3 1 60 ALA MB . . 4.570 4.172 4.065 4.315 . 0 0 "[ . 1 . 2]" 1
1475 1 59 MET HB3 1 61 THR H . . 3.580 2.668 2.517 2.863 . 0 0 "[ . 1 . 2]" 1
1476 1 59 MET HB3 1 64 ASP H . . 4.980 4.224 4.034 4.632 . 0 0 "[ . 1 . 2]" 1
1477 1 59 MET HB3 1 65 ALA H . . 3.700 3.156 2.920 3.428 . 0 0 "[ . 1 . 2]" 1
1478 1 59 MET HB3 1 65 ALA MB . . 4.640 3.668 3.466 3.888 . 0 0 "[ . 1 . 2]" 1
1479 1 59 MET ME 1 59 MET HG2 . . 3.980 3.360 3.331 3.380 . 0 0 "[ . 1 . 2]" 1
1480 1 59 MET ME 1 59 MET HG3 . . 3.130 2.362 2.255 2.445 . 0 0 "[ . 1 . 2]" 1
1481 1 59 MET ME 1 60 ALA H . . 3.970 3.729 3.476 3.910 . 0 0 "[ . 1 . 2]" 1
1482 1 59 MET ME 1 61 THR H . . 4.390 4.228 4.073 4.379 . 0 0 "[ . 1 . 2]" 1
1483 1 59 MET ME 1 64 ASP H . . 4.590 4.453 4.313 4.572 . 0 0 "[ . 1 . 2]" 1
1484 1 59 MET ME 1 64 ASP HA . . 4.000 3.850 3.720 3.971 . 0 0 "[ . 1 . 2]" 1
1485 1 59 MET ME 1 64 ASP HB2 . . 3.100 2.201 1.976 2.452 . 0 0 "[ . 1 . 2]" 1
1486 1 59 MET ME 1 64 ASP HB3 . . 3.240 1.936 1.793 2.053 . 0 0 "[ . 1 . 2]" 1
1487 1 59 MET ME 1 65 ALA H . . 3.900 3.478 3.348 3.679 . 0 0 "[ . 1 . 2]" 1
1488 1 59 MET ME 1 65 ALA HA . . 4.420 3.716 3.526 3.934 . 0 0 "[ . 1 . 2]" 1
1489 1 59 MET ME 1 65 ALA MB . . 4.120 4.066 3.974 4.123 0.003 20 0 "[ . 1 . 2]" 1
1490 1 59 MET ME 1 68 ALA MB . . 3.920 3.694 3.419 3.858 . 0 0 "[ . 1 . 2]" 1
1491 1 59 MET HG2 1 60 ALA H . . 5.060 4.953 4.823 5.055 . 0 0 "[ . 1 . 2]" 1
1492 1 59 MET HG2 1 65 ALA H . . 5.270 3.566 3.362 3.815 . 0 0 "[ . 1 . 2]" 1
1493 1 59 MET HG2 1 65 ALA HA . . 3.780 3.314 3.076 3.555 . 0 0 "[ . 1 . 2]" 1
1494 1 59 MET HG2 1 65 ALA MB . . 3.440 2.499 2.216 2.758 . 0 0 "[ . 1 . 2]" 1
1495 1 59 MET HG3 1 60 ALA H . . 5.500 4.964 4.791 5.184 . 0 0 "[ . 1 . 2]" 1
1496 1 59 MET HG3 1 65 ALA H . . 3.840 2.241 2.036 2.399 . 0 0 "[ . 1 . 2]" 1
1497 1 59 MET HG3 1 65 ALA HA . . 3.610 2.449 2.291 2.650 . 0 0 "[ . 1 . 2]" 1
1498 1 59 MET HG3 1 65 ALA MB . . 3.230 2.438 2.283 2.630 . 0 0 "[ . 1 . 2]" 1
1499 1 59 MET HG3 1 66 GLN H . . 5.500 4.832 4.639 5.059 . 0 0 "[ . 1 . 2]" 1
1500 1 60 ALA H 1 60 ALA MB . . 3.090 2.129 2.034 2.233 . 0 0 "[ . 1 . 2]" 1
1501 1 60 ALA H 1 61 THR H . . 3.520 2.576 2.415 2.708 . 0 0 "[ . 1 . 2]" 1
1502 1 60 ALA H 1 61 THR MG . . 4.850 4.462 4.182 4.624 . 0 0 "[ . 1 . 2]" 1
1503 1 60 ALA HA 1 61 THR MG . . 4.040 4.005 3.950 4.043 0.003 6 0 "[ . 1 . 2]" 1
1504 1 60 ALA MB 1 61 THR H . . 3.490 2.904 2.759 3.125 . 0 0 "[ . 1 . 2]" 1
1505 1 60 ALA MB 1 61 THR MG . . 3.300 2.533 2.354 2.748 . 0 0 "[ . 1 . 2]" 1
1506 1 61 THR H 1 61 THR HB . . 4.170 3.895 3.873 3.931 . 0 0 "[ . 1 . 2]" 1
1507 1 61 THR H 1 61 THR MG . . 3.540 3.007 2.901 3.118 . 0 0 "[ . 1 . 2]" 1
1508 1 61 THR H 1 62 THR H . . 4.390 4.229 4.142 4.299 . 0 0 "[ . 1 . 2]" 1
1509 1 61 THR H 1 62 THR HA . . 4.970 4.844 4.756 4.918 . 0 0 "[ . 1 . 2]" 1
1510 1 61 THR H 1 64 ASP H . . 4.460 4.001 3.888 4.207 . 0 0 "[ . 1 . 2]" 1
1511 1 61 THR H 1 64 ASP HB2 . . 4.030 3.609 3.293 3.818 . 0 0 "[ . 1 . 2]" 1
1512 1 61 THR H 1 64 ASP HB3 . . 5.500 4.994 4.809 5.241 . 0 0 "[ . 1 . 2]" 1
1513 1 61 THR H 1 65 ALA H . . 5.170 4.477 4.347 4.565 . 0 0 "[ . 1 . 2]" 1
1514 1 61 THR HA 1 61 THR MG . . 2.900 2.417 2.381 2.464 . 0 0 "[ . 1 . 2]" 1
1515 1 61 THR HA 1 62 THR H . . 3.180 2.157 2.141 2.172 . 0 0 "[ . 1 . 2]" 1
1516 1 61 THR HA 1 63 GLU H . . 4.840 3.750 3.626 4.008 . 0 0 "[ . 1 . 2]" 1
1517 1 61 THR HB 1 62 THR H . . 3.570 3.233 3.122 3.415 . 0 0 "[ . 1 . 2]" 1
1518 1 61 THR HB 1 63 GLU H . . 3.640 2.652 2.472 3.036 . 0 0 "[ . 1 . 2]" 1
1519 1 61 THR HB 1 63 GLU HB3 . . 5.070 4.591 4.295 4.763 . 0 0 "[ . 1 . 2]" 1
1520 1 61 THR MG 1 62 THR H . . 4.190 4.000 3.916 4.124 . 0 0 "[ . 1 . 2]" 1
1521 1 61 THR MG 1 63 GLU H . . 4.590 4.257 4.111 4.579 . 0 0 "[ . 1 . 2]" 1
1522 1 61 THR MG 1 63 GLU HB2 . . 4.580 4.116 3.981 4.272 . 0 0 "[ . 1 . 2]" 1
1523 1 61 THR MG 1 64 ASP H . . 5.000 4.686 4.429 4.835 . 0 0 "[ . 1 . 2]" 1
1524 1 62 THR H 1 62 THR HB . . 3.730 2.650 2.500 2.860 . 0 0 "[ . 1 . 2]" 1
1525 1 62 THR H 1 62 THR MG . . 3.260 2.157 1.941 2.326 . 0 0 "[ . 1 . 2]" 1
1526 1 62 THR H 1 63 GLU H . . 3.850 2.802 2.717 2.966 . 0 0 "[ . 1 . 2]" 1
1527 1 62 THR H 1 64 ASP H . . 4.950 4.474 4.279 4.606 . 0 0 "[ . 1 . 2]" 1
1528 1 62 THR HA 1 62 THR MG . . 3.310 3.179 3.139 3.195 . 0 0 "[ . 1 . 2]" 1
1529 1 62 THR HA 1 64 ASP H . . 4.980 3.971 3.649 4.167 . 0 0 "[ . 1 . 2]" 1
1530 1 62 THR HA 1 64 ASP HB2 . . 5.500 4.980 4.779 5.093 . 0 0 "[ . 1 . 2]" 1
1531 1 62 THR HA 1 65 ALA H . . 4.000 3.586 3.395 3.749 . 0 0 "[ . 1 . 2]" 1
1532 1 62 THR HA 1 65 ALA MB . . 3.300 2.935 2.770 3.099 . 0 0 "[ . 1 . 2]" 1
1533 1 62 THR HA 1 66 GLN H . . 4.890 3.666 3.542 3.881 . 0 0 "[ . 1 . 2]" 1
1534 1 62 THR HA 1 88 LEU MD1 . . 4.550 4.450 4.321 4.555 0.005 6 0 "[ . 1 . 2]" 1
1535 1 62 THR HB 1 63 GLU H . . 4.440 4.170 4.051 4.302 . 0 0 "[ . 1 . 2]" 1
1536 1 62 THR HB 1 66 GLN HE21 . . 5.280 3.752 3.291 4.171 . 0 0 "[ . 1 . 2]" 1
1537 1 62 THR HB 1 66 GLN HE22 . . 5.300 5.161 4.740 5.295 . 0 0 "[ . 1 . 2]" 1
1538 1 62 THR HB 1 66 GLN HG3 . . 4.820 4.303 3.831 4.816 . 0 0 "[ . 1 . 2]" 1
1539 1 62 THR MG 1 63 GLU H . . 3.290 2.117 1.902 2.371 . 0 0 "[ . 1 . 2]" 1
1540 1 62 THR MG 1 63 GLU HB2 . . 5.500 3.961 3.416 4.359 . 0 0 "[ . 1 . 2]" 1
1541 1 62 THR MG 1 63 GLU HB3 . . 5.140 4.873 4.659 5.067 . 0 0 "[ . 1 . 2]" 1
1542 1 62 THR MG 1 63 GLU QG . . 3.490 2.963 2.529 3.421 . 0 0 "[ . 1 . 2]" 1
1543 1 62 THR MG 1 66 GLN H . . 5.150 5.060 4.897 5.153 0.003 5 0 "[ . 1 . 2]" 1
1544 1 62 THR MG 1 66 GLN HE21 . . 3.800 2.996 2.378 3.449 . 0 0 "[ . 1 . 2]" 1
1545 1 62 THR MG 1 66 GLN HE22 . . 3.880 3.574 3.165 3.858 . 0 0 "[ . 1 . 2]" 1
1546 1 62 THR MG 1 66 GLN HG3 . . 4.440 3.965 3.661 4.257 . 0 0 "[ . 1 . 2]" 1
1547 1 63 GLU H 1 63 GLU HB2 . . 3.420 2.320 2.091 2.511 . 0 0 "[ . 1 . 2]" 1
1548 1 63 GLU H 1 63 GLU HB3 . . 3.640 3.538 3.388 3.613 . 0 0 "[ . 1 . 2]" 1
1549 1 63 GLU H 1 63 GLU HG2 . . 4.080 3.282 2.367 4.068 . 0 0 "[ . 1 . 2]" 1
1550 1 63 GLU H 1 63 GLU QG . . 3.530 2.642 2.133 3.187 . 0 0 "[ . 1 . 2]" 1
1551 1 63 GLU H 1 63 GLU HG3 . . 4.080 3.061 2.152 3.992 . 0 0 "[ . 1 . 2]" 1
1552 1 63 GLU H 1 64 ASP H . . 3.700 2.715 2.562 3.019 . 0 0 "[ . 1 . 2]" 1
1553 1 63 GLU H 1 65 ALA H . . 5.170 4.763 4.599 4.976 . 0 0 "[ . 1 . 2]" 1
1554 1 63 GLU H 1 66 GLN H . . 5.030 4.951 4.872 5.019 . 0 0 "[ . 1 . 2]" 1
1555 1 63 GLU HA 1 63 GLU HG2 . . 3.780 2.533 2.072 3.370 . 0 0 "[ . 1 . 2]" 1
1556 1 63 GLU HA 1 63 GLU QG . . 3.220 2.338 2.043 2.765 . 0 0 "[ . 1 . 2]" 1
1557 1 63 GLU HA 1 63 GLU HG3 . . 3.780 3.199 2.224 3.735 . 0 0 "[ . 1 . 2]" 1
1558 1 63 GLU HA 1 66 GLN H . . 4.230 4.181 4.057 4.233 0.003 7 0 "[ . 1 . 2]" 1
1559 1 63 GLU HA 1 66 GLN HB2 . . 4.130 3.040 2.842 3.156 . 0 0 "[ . 1 . 2]" 1
1560 1 63 GLU HA 1 66 GLN HB3 . . 4.720 4.540 4.327 4.699 . 0 0 "[ . 1 . 2]" 1
1561 1 63 GLU HA 1 66 GLN HE21 . . 5.040 4.758 3.845 5.032 . 0 0 "[ . 1 . 2]" 1
1562 1 63 GLU HA 1 66 GLN HG3 . . 5.150 4.120 3.944 4.273 . 0 0 "[ . 1 . 2]" 1
1563 1 63 GLU HA 1 67 ALA H . . 4.870 4.341 4.170 4.530 . 0 0 "[ . 1 . 2]" 1
1564 1 63 GLU HB2 1 64 ASP H . . 4.300 2.866 2.574 3.131 . 0 0 "[ . 1 . 2]" 1
1565 1 63 GLU HB3 1 64 ASP H . . 4.330 3.529 3.042 3.951 . 0 0 "[ . 1 . 2]" 1
1566 1 63 GLU QG 1 64 ASP H . . 4.710 4.317 4.072 4.578 . 0 0 "[ . 1 . 2]" 1
1567 1 64 ASP H 1 64 ASP HB2 . . 4.190 2.657 2.476 2.818 . 0 0 "[ . 1 . 2]" 1
1568 1 64 ASP H 1 65 ALA H . . 3.330 2.800 2.598 2.944 . 0 0 "[ . 1 . 2]" 1
1569 1 64 ASP H 1 65 ALA MB . . 4.410 4.280 4.116 4.410 . 0 0 "[ . 1 . 2]" 1
1570 1 64 ASP H 1 66 GLN H . . 4.330 4.106 3.897 4.294 . 0 0 "[ . 1 . 2]" 1
1571 1 64 ASP H 1 66 GLN HB2 . . 5.430 4.885 4.717 5.062 . 0 0 "[ . 1 . 2]" 1
1572 1 64 ASP H 1 67 ALA H . . 5.500 4.634 4.539 4.711 . 0 0 "[ . 1 . 2]" 1
1573 1 64 ASP H 1 67 ALA MB . . 4.750 4.615 4.497 4.750 0.000 8 0 "[ . 1 . 2]" 1
1574 1 64 ASP HA 1 66 GLN H . . 5.000 4.631 4.427 4.779 . 0 0 "[ . 1 . 2]" 1
1575 1 64 ASP HA 1 67 ALA H . . 4.000 3.503 3.360 3.652 . 0 0 "[ . 1 . 2]" 1
1576 1 64 ASP HA 1 67 ALA MB . . 3.400 2.618 2.460 2.814 . 0 0 "[ . 1 . 2]" 1
1577 1 64 ASP HA 1 68 ALA H . . 4.660 4.140 3.917 4.397 . 0 0 "[ . 1 . 2]" 1
1578 1 64 ASP HB2 1 65 ALA H . . 3.680 2.041 1.925 2.175 . 0 0 "[ . 1 . 2]" 1
1579 1 64 ASP HB2 1 65 ALA MB . . 4.820 3.651 3.589 3.722 . 0 0 "[ . 1 . 2]" 1
1580 1 64 ASP HB3 1 65 ALA H . . 4.050 3.337 3.169 3.502 . 0 0 "[ . 1 . 2]" 1
1581 1 65 ALA H 1 65 ALA MB . . 3.070 2.115 2.043 2.202 . 0 0 "[ . 1 . 2]" 1
1582 1 65 ALA H 1 66 GLN H . . 3.480 3.000 2.911 3.073 . 0 0 "[ . 1 . 2]" 1
1583 1 65 ALA H 1 67 ALA H . . 4.410 4.261 4.150 4.344 . 0 0 "[ . 1 . 2]" 1
1584 1 65 ALA H 1 88 LEU MD1 . . 5.500 5.447 5.357 5.500 0.000 6 0 "[ . 1 . 2]" 1
1585 1 65 ALA HA 1 68 ALA H . . 4.050 3.489 3.351 3.633 . 0 0 "[ . 1 . 2]" 1
1586 1 65 ALA HA 1 68 ALA MB . . 3.790 2.619 2.496 2.739 . 0 0 "[ . 1 . 2]" 1
1587 1 65 ALA HA 1 88 LEU MD2 . . 4.560 3.293 3.072 3.555 . 0 0 "[ . 1 . 2]" 1
1588 1 65 ALA MB 1 66 GLN H . . 3.440 2.357 2.245 2.513 . 0 0 "[ . 1 . 2]" 1
1589 1 65 ALA MB 1 66 GLN HA . . 4.690 3.686 3.618 3.744 . 0 0 "[ . 1 . 2]" 1
1590 1 65 ALA MB 1 66 GLN HG3 . . 4.510 3.568 3.426 3.729 . 0 0 "[ . 1 . 2]" 1
1591 1 65 ALA MB 1 67 ALA H . . 4.480 4.403 4.297 4.457 . 0 0 "[ . 1 . 2]" 1
1592 1 65 ALA MB 1 88 LEU MD1 . . 3.140 2.643 2.492 2.852 . 0 0 "[ . 1 . 2]" 1
1593 1 65 ALA MB 1 88 LEU MD2 . . 3.080 2.018 1.835 2.341 . 0 0 "[ . 1 . 2]" 1
1594 1 66 GLN H 1 66 GLN HB2 . . 3.050 2.382 2.326 2.454 . 0 0 "[ . 1 . 2]" 1
1595 1 66 GLN H 1 66 GLN HB3 . . 3.720 3.573 3.559 3.586 . 0 0 "[ . 1 . 2]" 1
1596 1 66 GLN H 1 66 GLN HE21 . . 5.070 4.623 4.431 4.738 . 0 0 "[ . 1 . 2]" 1
1597 1 66 GLN H 1 66 GLN HG2 . . 3.510 3.334 3.200 3.475 . 0 0 "[ . 1 . 2]" 1
1598 1 66 GLN H 1 66 GLN HG3 . . 3.490 2.512 2.384 2.595 . 0 0 "[ . 1 . 2]" 1
1599 1 66 GLN H 1 67 ALA H . . 3.460 2.767 2.674 2.849 . 0 0 "[ . 1 . 2]" 1
1600 1 66 GLN H 1 67 ALA MB . . 4.450 4.365 4.292 4.434 . 0 0 "[ . 1 . 2]" 1
1601 1 66 GLN H 1 68 ALA H . . 4.790 4.347 4.184 4.519 . 0 0 "[ . 1 . 2]" 1
1602 1 66 GLN H 1 88 LEU MD1 . . 4.540 4.105 3.859 4.347 . 0 0 "[ . 1 . 2]" 1
1603 1 66 GLN H 1 88 LEU MD2 . . 4.310 3.158 2.862 3.466 . 0 0 "[ . 1 . 2]" 1
1604 1 66 GLN HA 1 66 GLN HB3 . . 2.930 2.561 2.525 2.589 . 0 0 "[ . 1 . 2]" 1
1605 1 66 GLN HA 1 66 GLN HG2 . . 3.820 2.307 2.271 2.374 . 0 0 "[ . 1 . 2]" 1
1606 1 66 GLN HA 1 66 GLN HG3 . . 3.940 3.180 3.049 3.275 . 0 0 "[ . 1 . 2]" 1
1607 1 66 GLN HA 1 69 VAL H . . 4.040 3.729 3.607 3.911 . 0 0 "[ . 1 . 2]" 1
1608 1 66 GLN HA 1 69 VAL HB . . 3.680 3.258 3.089 3.419 . 0 0 "[ . 1 . 2]" 1
1609 1 66 GLN HA 1 69 VAL MG1 . . 4.790 4.482 4.364 4.657 . 0 0 "[ . 1 . 2]" 1
1610 1 66 GLN HA 1 69 VAL MG2 . . 3.970 3.163 2.679 3.450 . 0 0 "[ . 1 . 2]" 1
1611 1 66 GLN HA 1 88 LEU MD1 . . 4.100 3.809 3.569 4.046 . 0 0 "[ . 1 . 2]" 1
1612 1 66 GLN HA 1 88 LEU MD2 . . 3.470 2.330 1.951 2.677 . 0 0 "[ . 1 . 2]" 1
1613 1 66 GLN HB2 1 67 ALA H . . 3.300 2.708 2.616 2.799 . 0 0 "[ . 1 . 2]" 1
1614 1 66 GLN HB2 1 68 ALA H . . 5.500 5.199 5.009 5.350 . 0 0 "[ . 1 . 2]" 1
1615 1 66 GLN HB3 1 66 GLN HE22 . . 4.910 4.489 4.291 4.613 . 0 0 "[ . 1 . 2]" 1
1616 1 66 GLN HB3 1 66 GLN HG2 . . 2.690 2.580 2.506 2.616 . 0 0 "[ . 1 . 2]" 1
1617 1 66 GLN HB3 1 67 ALA H . . 3.720 3.527 3.401 3.659 . 0 0 "[ . 1 . 2]" 1
1618 1 66 GLN HB3 1 67 ALA MB . . 5.230 4.637 4.500 4.733 . 0 0 "[ . 1 . 2]" 1
1619 1 66 GLN HB3 1 88 LEU MD2 . . 4.870 4.552 4.161 4.843 . 0 0 "[ . 1 . 2]" 1
1620 1 66 GLN HE22 1 66 GLN HG2 . . 4.080 3.826 3.754 3.969 . 0 0 "[ . 1 . 2]" 1
1621 1 66 GLN HE22 1 66 GLN HG3 . . 3.830 3.467 3.440 3.498 . 0 0 "[ . 1 . 2]" 1
1622 1 66 GLN HE22 1 88 LEU MD1 . . 5.500 5.368 4.869 5.505 0.005 4 0 "[ . 1 . 2]" 1
1623 1 66 GLN HG2 1 67 ALA H . . 4.970 4.941 4.897 4.972 0.002 15 0 "[ . 1 . 2]" 1
1624 1 66 GLN HG2 1 88 LEU MD1 . . 3.340 3.119 2.729 3.338 . 0 0 "[ . 1 . 2]" 1
1625 1 66 GLN HG2 1 88 LEU MD2 . . 3.650 3.451 3.036 3.656 0.006 7 0 "[ . 1 . 2]" 1
1626 1 66 GLN HG3 1 67 ALA H . . 4.590 4.543 4.452 4.592 0.002 9 0 "[ . 1 . 2]" 1
1627 1 66 GLN HG3 1 88 LEU MD1 . . 4.130 3.590 3.191 3.836 . 0 0 "[ . 1 . 2]" 1
1628 1 66 GLN HG3 1 88 LEU MD2 . . 4.540 3.962 3.643 4.249 . 0 0 "[ . 1 . 2]" 1
1629 1 67 ALA H 1 67 ALA MB . . 2.930 2.084 2.028 2.238 . 0 0 "[ . 1 . 2]" 1
1630 1 67 ALA H 1 68 ALA H . . 3.210 2.669 2.596 2.765 . 0 0 "[ . 1 . 2]" 1
1631 1 67 ALA H 1 68 ALA MB . . 4.280 4.248 4.186 4.279 . 0 0 "[ . 1 . 2]" 1
1632 1 67 ALA HA 1 70 ASP H . . 4.600 3.209 2.986 3.444 . 0 0 "[ . 1 . 2]" 1
1633 1 67 ALA HA 1 70 ASP HB2 . . 3.730 2.704 2.498 2.876 . 0 0 "[ . 1 . 2]" 1
1634 1 67 ALA HA 1 70 ASP HB3 . . 3.790 3.504 3.086 3.786 . 0 0 "[ . 1 . 2]" 1
1635 1 67 ALA MB 1 68 ALA H . . 3.280 2.567 2.434 2.666 . 0 0 "[ . 1 . 2]" 1
1636 1 67 ALA MB 1 68 ALA HA . . 4.350 3.702 3.620 3.789 . 0 0 "[ . 1 . 2]" 1
1637 1 67 ALA MB 1 68 ALA MB . . 4.020 3.833 3.779 3.898 . 0 0 "[ . 1 . 2]" 1
1638 1 67 ALA MB 1 70 ASP HB2 . . 5.130 4.195 3.941 4.395 . 0 0 "[ . 1 . 2]" 1
1639 1 67 ALA MB 1 70 ASP HB3 . . 5.140 4.391 4.084 4.627 . 0 0 "[ . 1 . 2]" 1
1640 1 68 ALA H 1 68 ALA MB . . 3.000 2.187 2.079 2.233 . 0 0 "[ . 1 . 2]" 1
1641 1 68 ALA H 1 69 VAL H . . 3.570 2.783 2.699 2.890 . 0 0 "[ . 1 . 2]" 1
1642 1 68 ALA H 1 69 VAL HB . . 5.110 4.978 4.883 5.070 . 0 0 "[ . 1 . 2]" 1
1643 1 68 ALA H 1 69 VAL MG2 . . 4.570 4.372 4.209 4.536 . 0 0 "[ . 1 . 2]" 1
1644 1 68 ALA H 1 70 ASP H . . 5.120 4.320 4.159 4.496 . 0 0 "[ . 1 . 2]" 1
1645 1 68 ALA HA 1 70 ASP H . . 5.070 4.517 4.293 4.742 . 0 0 "[ . 1 . 2]" 1
1646 1 68 ALA HA 1 71 TYR H . . 3.920 3.775 3.659 3.886 . 0 0 "[ . 1 . 2]" 1
1647 1 68 ALA HA 1 71 TYR HB2 . . 4.230 3.604 3.270 4.224 . 0 0 "[ . 1 . 2]" 1
1648 1 68 ALA HA 1 71 TYR HB3 . . 3.870 3.324 2.893 3.652 . 0 0 "[ . 1 . 2]" 1
1649 1 68 ALA MB 1 69 VAL H . . 3.410 2.773 2.511 2.943 . 0 0 "[ . 1 . 2]" 1
1650 1 68 ALA MB 1 69 VAL HA . . 4.880 3.870 3.818 3.928 . 0 0 "[ . 1 . 2]" 1
1651 1 68 ALA MB 1 69 VAL MG2 . . 3.630 3.195 3.059 3.344 . 0 0 "[ . 1 . 2]" 1
1652 1 68 ALA MB 1 70 ASP H . . 4.810 4.654 4.527 4.797 . 0 0 "[ . 1 . 2]" 1
1653 1 68 ALA MB 1 71 TYR H . . 5.140 4.657 4.527 4.759 . 0 0 "[ . 1 . 2]" 1
1654 1 69 VAL H 1 69 VAL HB . . 3.230 2.419 2.346 2.511 . 0 0 "[ . 1 . 2]" 1
1655 1 69 VAL H 1 69 VAL MG1 . . 3.920 3.742 3.711 3.767 . 0 0 "[ . 1 . 2]" 1
1656 1 69 VAL H 1 69 VAL MG2 . . 3.060 2.395 2.211 2.536 . 0 0 "[ . 1 . 2]" 1
1657 1 69 VAL H 1 70 ASP H . . 3.340 2.513 2.357 2.680 . 0 0 "[ . 1 . 2]" 1
1658 1 69 VAL H 1 70 ASP HB2 . . 4.810 4.385 4.216 4.622 . 0 0 "[ . 1 . 2]" 1
1659 1 69 VAL H 1 70 ASP HB3 . . 5.500 5.342 5.075 5.494 . 0 0 "[ . 1 . 2]" 1
1660 1 69 VAL H 1 71 TYR H . . 3.950 3.851 3.755 3.939 . 0 0 "[ . 1 . 2]" 1
1661 1 69 VAL H 1 86 VAL MG1 . . 4.920 4.060 3.779 4.353 . 0 0 "[ . 1 . 2]" 1
1662 1 69 VAL H 1 88 LEU MD2 . . 4.610 3.584 3.221 3.854 . 0 0 "[ . 1 . 2]" 1
1663 1 69 VAL HA 1 69 VAL MG1 . . 3.000 2.453 2.378 2.517 . 0 0 "[ . 1 . 2]" 1
1664 1 69 VAL HA 1 69 VAL MG2 . . 3.120 2.337 2.237 2.408 . 0 0 "[ . 1 . 2]" 1
1665 1 69 VAL HA 1 71 TYR H . . 4.970 3.635 3.525 3.806 . 0 0 "[ . 1 . 2]" 1
1666 1 69 VAL HA 1 72 TYR H . . 4.280 3.341 3.218 3.477 . 0 0 "[ . 1 . 2]" 1
1667 1 69 VAL HA 1 72 TYR HB2 . . 4.800 4.225 3.882 4.770 . 0 0 "[ . 1 . 2]" 1
1668 1 69 VAL HA 1 72 TYR HB3 . . 4.800 2.889 2.711 3.112 . 0 0 "[ . 1 . 2]" 1
1669 1 69 VAL HA 1 86 VAL HB . . 4.780 3.708 3.468 3.931 . 0 0 "[ . 1 . 2]" 1
1670 1 69 VAL HA 1 86 VAL MG1 . . 3.540 2.192 1.986 2.586 . 0 0 "[ . 1 . 2]" 1
1671 1 69 VAL HB 1 70 ASP H . . 3.820 2.664 2.490 2.870 . 0 0 "[ . 1 . 2]" 1
1672 1 69 VAL HB 1 70 ASP HB2 . . 5.050 4.249 4.140 4.390 . 0 0 "[ . 1 . 2]" 1
1673 1 69 VAL HB 1 88 LEU HB2 . . 4.780 3.723 3.541 3.844 . 0 0 "[ . 1 . 2]" 1
1674 1 69 VAL HB 1 88 LEU MD2 . . 3.650 3.355 2.567 3.652 0.002 7 0 "[ . 1 . 2]" 1
1675 1 69 VAL HB 1 88 LEU HG . . 5.460 4.329 3.999 4.732 . 0 0 "[ . 1 . 2]" 1
1676 1 69 VAL MG1 1 70 ASP H . . 3.990 3.303 3.090 3.442 . 0 0 "[ . 1 . 2]" 1
1677 1 69 VAL MG1 1 70 ASP HA . . 4.220 3.264 3.078 3.396 . 0 0 "[ . 1 . 2]" 1
1678 1 69 VAL MG1 1 70 ASP HB3 . . 5.500 5.360 5.161 5.487 . 0 0 "[ . 1 . 2]" 1
1679 1 69 VAL MG1 1 72 TYR QB . . 4.420 3.410 3.106 3.844 . 0 0 "[ . 1 . 2]" 1
1680 1 69 VAL MG1 1 86 VAL MG1 . . 3.070 2.950 2.739 3.071 0.001 10 0 "[ . 1 . 2]" 1
1681 1 69 VAL MG1 1 87 HIS H . . 5.240 4.855 4.627 5.082 . 0 0 "[ . 1 . 2]" 1
1682 1 69 VAL MG1 1 87 HIS HA . . 3.290 3.006 2.726 3.240 . 0 0 "[ . 1 . 2]" 1
1683 1 69 VAL MG1 1 87 HIS QB . . 4.860 4.532 4.209 4.787 . 0 0 "[ . 1 . 2]" 1
1684 1 69 VAL MG1 1 88 LEU H . . 3.630 3.543 3.212 3.630 . 0 0 "[ . 1 . 2]" 1
1685 1 69 VAL MG1 1 88 LEU HB2 . . 3.480 3.031 2.702 3.309 . 0 0 "[ . 1 . 2]" 1
1686 1 69 VAL MG1 1 88 LEU HB3 . . 4.680 4.409 3.980 4.661 . 0 0 "[ . 1 . 2]" 1
1687 1 69 VAL MG2 1 70 ASP H . . 4.020 3.928 3.821 4.017 . 0 0 "[ . 1 . 2]" 1
1688 1 69 VAL MG2 1 71 TYR H . . 5.140 5.007 4.912 5.118 . 0 0 "[ . 1 . 2]" 1
1689 1 69 VAL MG2 1 87 HIS H . . 4.100 3.912 3.661 4.103 0.003 5 0 "[ . 1 . 2]" 1
1690 1 69 VAL MG2 1 87 HIS HA . . 3.380 2.938 2.501 3.214 . 0 0 "[ . 1 . 2]" 1
1691 1 69 VAL MG2 1 88 LEU H . . 3.570 3.130 2.802 3.390 . 0 0 "[ . 1 . 2]" 1
1692 1 69 VAL MG2 1 88 LEU HA . . 3.940 3.025 2.807 3.141 . 0 0 "[ . 1 . 2]" 1
1693 1 69 VAL MG2 1 88 LEU HB2 . . 3.220 2.025 1.923 2.308 . 0 0 "[ . 1 . 2]" 1
1694 1 69 VAL MG2 1 88 LEU HB3 . . 3.860 3.564 3.415 3.807 . 0 0 "[ . 1 . 2]" 1
1695 1 69 VAL MG2 1 88 LEU MD2 . . 2.980 1.807 1.686 1.958 . 0 0 "[ . 1 . 2]" 1
1696 1 70 ASP H 1 70 ASP HB2 . . 3.420 2.122 2.076 2.252 . 0 0 "[ . 1 . 2]" 1
1697 1 70 ASP H 1 70 ASP HB3 . . 3.520 3.076 2.874 3.180 . 0 0 "[ . 1 . 2]" 1
1698 1 70 ASP H 1 71 TYR H . . 3.460 2.648 2.535 2.714 . 0 0 "[ . 1 . 2]" 1
1699 1 70 ASP H 1 71 TYR HA . . 5.320 5.215 5.107 5.287 . 0 0 "[ . 1 . 2]" 1
1700 1 70 ASP H 1 72 TYR H . . 5.500 4.197 4.089 4.307 . 0 0 "[ . 1 . 2]" 1
1701 1 70 ASP H 1 73 THR MG . . 5.020 4.475 4.037 4.982 . 0 0 "[ . 1 . 2]" 1
1702 1 70 ASP HA 1 72 TYR H . . 4.470 3.916 3.723 4.155 . 0 0 "[ . 1 . 2]" 1
1703 1 70 ASP HA 1 73 THR H . . 4.220 3.444 3.338 3.552 . 0 0 "[ . 1 . 2]" 1
1704 1 70 ASP HA 1 73 THR HG1 . . 5.130 4.953 4.766 5.123 . 0 0 "[ . 1 . 2]" 1
1705 1 70 ASP HA 1 73 THR MG . . 3.570 2.121 1.904 2.620 . 0 0 "[ . 1 . 2]" 1
1706 1 70 ASP HB2 1 71 TYR H . . 4.110 3.796 3.675 3.914 . 0 0 "[ . 1 . 2]" 1
1707 1 70 ASP HB2 1 73 THR MG . . 5.500 4.319 4.083 4.560 . 0 0 "[ . 1 . 2]" 1
1708 1 70 ASP HB3 1 71 TYR H . . 3.450 3.367 3.137 3.453 0.003 17 0 "[ . 1 . 2]" 1
1709 1 70 ASP HB3 1 73 THR H . . 5.500 5.465 5.406 5.510 0.010 17 0 "[ . 1 . 2]" 1
1710 1 70 ASP HB3 1 73 THR MG . . 4.810 4.007 3.861 4.200 . 0 0 "[ . 1 . 2]" 1
1711 1 71 TYR H 1 71 TYR HB2 . . 3.130 2.718 2.427 3.075 . 0 0 "[ . 1 . 2]" 1
1712 1 71 TYR H 1 71 TYR HB3 . . 3.050 2.493 2.219 2.776 . 0 0 "[ . 1 . 2]" 1
1713 1 71 TYR H 1 71 TYR QD . . 4.370 4.171 3.933 4.248 . 0 0 "[ . 1 . 2]" 1
1714 1 71 TYR H 1 72 TYR H . . 3.400 2.319 2.238 2.426 . 0 0 "[ . 1 . 2]" 1
1715 1 71 TYR H 1 73 THR H . . 4.530 3.891 3.803 4.063 . 0 0 "[ . 1 . 2]" 1
1716 1 71 TYR HA 1 71 TYR QD . . 3.610 2.600 2.147 3.101 . 0 0 "[ . 1 . 2]" 1
1717 1 71 TYR HA 1 71 TYR QE . . 5.110 4.573 4.306 4.902 . 0 0 "[ . 1 . 2]" 1
1718 1 71 TYR HA 1 73 THR H . . 5.130 4.059 3.905 4.196 . 0 0 "[ . 1 . 2]" 1
1719 1 71 TYR HA 1 74 THR MG . . 4.810 4.015 3.552 4.454 . 0 0 "[ . 1 . 2]" 1
1720 1 71 TYR HB2 1 72 TYR H . . 4.350 4.129 3.891 4.340 . 0 0 "[ . 1 . 2]" 1
1721 1 71 TYR HB3 1 72 TYR H . . 3.320 3.118 2.796 3.305 . 0 0 "[ . 1 . 2]" 1
1722 1 71 TYR QD 1 72 TYR H . . 4.470 4.204 3.509 4.470 0.000 17 0 "[ . 1 . 2]" 1
1723 1 71 TYR QD 1 72 TYR HA . . 5.460 4.083 3.320 4.609 . 0 0 "[ . 1 . 2]" 1
1724 1 71 TYR QD 1 75 THR HB . . 5.280 3.276 2.763 3.809 . 0 0 "[ . 1 . 2]" 1
1725 1 71 TYR QD 1 75 THR MG . . 4.500 3.928 3.485 4.246 . 0 0 "[ . 1 . 2]" 1
1726 1 71 TYR QE 1 75 THR HB . . 4.800 3.166 2.383 3.792 . 0 0 "[ . 1 . 2]" 1
1727 1 71 TYR QE 1 75 THR MG . . 3.600 2.739 2.039 3.291 . 0 0 "[ . 1 . 2]" 1
1728 1 72 TYR H 1 72 TYR HB2 . . 3.680 3.204 3.054 3.453 . 0 0 "[ . 1 . 2]" 1
1729 1 72 TYR H 1 72 TYR QB . . 3.070 2.144 2.078 2.194 . 0 0 "[ . 1 . 2]" 1
1730 1 72 TYR H 1 72 TYR HB3 . . 3.680 2.179 2.098 2.234 . 0 0 "[ . 1 . 2]" 1
1731 1 72 TYR H 1 73 THR H . . 3.240 2.314 2.170 2.460 . 0 0 "[ . 1 . 2]" 1
1732 1 72 TYR H 1 73 THR MG . . 5.040 3.718 3.361 4.179 . 0 0 "[ . 1 . 2]" 1
1733 1 72 TYR H 1 74 THR H . . 4.380 3.919 3.707 4.069 . 0 0 "[ . 1 . 2]" 1
1734 1 72 TYR H 1 77 ALA MB . . 5.180 4.936 4.767 5.083 . 0 0 "[ . 1 . 2]" 1
1735 1 72 TYR H 1 86 VAL MG1 . . 4.540 4.238 3.950 4.524 . 0 0 "[ . 1 . 2]" 1
1736 1 72 TYR H 1 86 VAL MG2 . . 5.500 5.049 4.822 5.207 . 0 0 "[ . 1 . 2]" 1
1737 1 72 TYR HA 1 72 TYR HD1 . . 3.990 3.359 3.124 4.020 0.030 15 0 "[ . 1 . 2]" 1
1738 1 72 TYR HA 1 72 TYR HD2 . . 4.400 4.314 3.973 4.425 0.025 3 0 "[ . 1 . 2]" 1
1739 1 72 TYR HA 1 74 THR H . . 4.410 4.213 3.448 4.413 0.003 4 0 "[ . 1 . 2]" 1
1740 1 72 TYR HA 1 75 THR H . . 3.840 3.492 3.129 3.717 . 0 0 "[ . 1 . 2]" 1
1741 1 72 TYR HA 1 75 THR HB . . 4.530 4.222 3.954 4.446 . 0 0 "[ . 1 . 2]" 1
1742 1 72 TYR HA 1 75 THR MG . . 4.820 4.662 4.543 4.780 . 0 0 "[ . 1 . 2]" 1
1743 1 72 TYR HA 1 77 ALA MB . . 4.130 3.047 2.925 3.428 . 0 0 "[ . 1 . 2]" 1
1744 1 72 TYR HA 1 86 VAL MG1 . . 5.430 5.077 4.873 5.410 . 0 0 "[ . 1 . 2]" 1
1745 1 72 TYR HA 1 86 VAL MG2 . . 4.910 4.496 4.232 4.883 . 0 0 "[ . 1 . 2]" 1
1746 1 72 TYR QB 1 73 THR H . . 3.940 3.168 2.997 3.414 . 0 0 "[ . 1 . 2]" 1
1747 1 72 TYR QB 1 73 THR MG . . 5.320 4.577 4.019 5.089 . 0 0 "[ . 1 . 2]" 1
1748 1 72 TYR QB 1 77 ALA H . . 5.340 4.121 3.767 4.354 . 0 0 "[ . 1 . 2]" 1
1749 1 72 TYR QB 1 77 ALA MB . . 3.680 2.687 2.471 2.825 . 0 0 "[ . 1 . 2]" 1
1750 1 72 TYR QB 1 86 VAL MG1 . . 3.720 2.831 2.669 3.088 . 0 0 "[ . 1 . 2]" 1
1751 1 72 TYR QB 1 86 VAL MG2 . . 3.600 2.656 2.425 2.952 . 0 0 "[ . 1 . 2]" 1
1752 1 72 TYR HB2 1 73 THR H . . 4.640 4.317 4.234 4.404 . 0 0 "[ . 1 . 2]" 1
1753 1 72 TYR HB2 1 77 ALA MB . . 4.550 2.719 2.502 2.862 . 0 0 "[ . 1 . 2]" 1
1754 1 72 TYR HB2 1 86 VAL HB . . 4.200 2.447 2.179 2.903 . 0 0 "[ . 1 . 2]" 1
1755 1 72 TYR HB2 1 86 VAL MG1 . . 4.300 3.385 3.070 4.011 . 0 0 "[ . 1 . 2]" 1
1756 1 72 TYR HB2 1 86 VAL MG2 . . 4.160 2.734 2.466 3.140 . 0 0 "[ . 1 . 2]" 1
1757 1 72 TYR HB3 1 73 THR H . . 4.640 3.261 3.065 3.561 . 0 0 "[ . 1 . 2]" 1
1758 1 72 TYR HB3 1 77 ALA MB . . 4.550 4.204 3.828 4.380 . 0 0 "[ . 1 . 2]" 1
1759 1 72 TYR HB3 1 86 VAL HB . . 4.200 2.584 2.414 2.763 . 0 0 "[ . 1 . 2]" 1
1760 1 72 TYR HB3 1 86 VAL MG1 . . 4.300 3.053 2.899 3.341 . 0 0 "[ . 1 . 2]" 1
1761 1 72 TYR HB3 1 86 VAL MG2 . . 4.160 3.658 3.238 3.954 . 0 0 "[ . 1 . 2]" 1
1762 1 72 TYR HD1 1 73 THR HA . . 5.500 4.909 3.049 5.519 0.019 6 0 "[ . 1 . 2]" 1
1763 1 72 TYR HD2 1 73 THR HA . . 5.500 4.114 3.576 5.506 0.006 15 0 "[ . 1 . 2]" 1
1764 1 73 THR H 1 73 THR HB . . 2.980 2.649 2.410 2.931 . 0 0 "[ . 1 . 2]" 1
1765 1 73 THR H 1 73 THR HG1 . . 4.620 4.538 4.446 4.591 . 0 0 "[ . 1 . 2]" 1
1766 1 73 THR H 1 73 THR MG . . 3.480 2.139 1.877 2.479 . 0 0 "[ . 1 . 2]" 1
1767 1 73 THR H 1 74 THR H . . 3.540 2.378 2.272 2.549 . 0 0 "[ . 1 . 2]" 1
1768 1 73 THR H 1 74 THR HA . . 5.400 5.066 4.984 5.155 . 0 0 "[ . 1 . 2]" 1
1769 1 73 THR H 1 74 THR MG . . 4.640 4.116 3.528 4.476 . 0 0 "[ . 1 . 2]" 1
1770 1 73 THR H 1 75 THR H . . 3.980 3.718 3.444 3.956 . 0 0 "[ . 1 . 2]" 1
1771 1 73 THR HA 1 73 THR MG . . 3.310 3.192 3.170 3.207 . 0 0 "[ . 1 . 2]" 1
1772 1 73 THR HA 1 74 THR MG . . 4.950 4.688 4.402 4.879 . 0 0 "[ . 1 . 2]" 1
1773 1 73 THR HA 1 75 THR H . . 5.500 4.555 4.056 4.949 . 0 0 "[ . 1 . 2]" 1
1774 1 73 THR HB 1 74 THR H . . 4.440 3.996 3.811 4.265 . 0 0 "[ . 1 . 2]" 1
1775 1 73 THR HB 1 74 THR MG . . 4.740 4.517 4.244 4.740 . 0 0 "[ . 1 . 2]" 1
1776 1 73 THR HG1 1 74 THR H . . 5.050 4.779 4.409 4.991 . 0 0 "[ . 1 . 2]" 1
1777 1 73 THR HG1 1 74 THR MG . . 5.260 4.048 3.395 4.449 . 0 0 "[ . 1 . 2]" 1
1778 1 73 THR MG 1 74 THR H . . 4.310 2.077 1.898 2.672 . 0 0 "[ . 1 . 2]" 1
1779 1 73 THR MG 1 74 THR HA . . 4.660 3.476 3.115 3.875 . 0 0 "[ . 1 . 2]" 1
1780 1 73 THR MG 1 74 THR HB . . 5.300 4.245 4.094 4.526 . 0 0 "[ . 1 . 2]" 1
1781 1 73 THR MG 1 74 THR MG . . 3.490 2.025 1.785 2.282 . 0 0 "[ . 1 . 2]" 1
1782 1 73 THR MG 1 75 THR H . . 5.500 3.989 3.844 4.220 . 0 0 "[ . 1 . 2]" 1
1783 1 74 THR H 1 74 THR HB . . 4.160 3.687 3.627 3.800 . 0 0 "[ . 1 . 2]" 1
1784 1 74 THR H 1 74 THR MG . . 3.940 2.628 2.094 3.111 . 0 0 "[ . 1 . 2]" 1
1785 1 74 THR H 1 75 THR H . . 2.800 2.166 1.827 2.328 . 0 0 "[ . 1 . 2]" 1
1786 1 74 THR H 1 75 THR HB . . 5.150 4.620 4.364 4.805 . 0 0 "[ . 1 . 2]" 1
1787 1 74 THR HA 1 74 THR HB . . 2.940 2.465 2.337 2.556 . 0 0 "[ . 1 . 2]" 1
1788 1 74 THR HA 1 74 THR MG . . 2.830 2.333 2.162 2.589 . 0 0 "[ . 1 . 2]" 1
1789 1 74 THR HB 1 75 THR H . . 4.210 3.888 3.628 4.134 . 0 0 "[ . 1 . 2]" 1
1790 1 74 THR MG 1 75 THR H . . 4.580 3.965 3.531 4.235 . 0 0 "[ . 1 . 2]" 1
1791 1 75 THR H 1 75 THR HB . . 3.370 2.731 2.622 2.940 . 0 0 "[ . 1 . 2]" 1
1792 1 75 THR H 1 75 THR HG1 . . 4.200 3.230 2.855 4.107 . 0 0 "[ . 1 . 2]" 1
1793 1 75 THR H 1 75 THR MG . . 4.020 3.873 3.835 3.937 . 0 0 "[ . 1 . 2]" 1
1794 1 75 THR H 1 76 PRO HD2 . . 4.900 4.816 4.772 4.836 . 0 0 "[ . 1 . 2]" 1
1795 1 75 THR H 1 76 PRO QD . . 4.300 4.261 4.172 4.304 0.004 15 0 "[ . 1 . 2]" 1
1796 1 75 THR H 1 76 PRO HD3 . . 4.900 4.752 4.604 4.826 . 0 0 "[ . 1 . 2]" 1
1797 1 75 THR HA 1 75 THR MG . . 3.210 2.479 2.456 2.486 . 0 0 "[ . 1 . 2]" 1
1798 1 75 THR HA 1 76 PRO HD2 . . 3.230 2.183 2.176 2.186 . 0 0 "[ . 1 . 2]" 1
1799 1 75 THR HA 1 76 PRO HD3 . . 3.230 2.254 2.253 2.255 . 0 0 "[ . 1 . 2]" 1
1800 1 75 THR HA 1 76 PRO HG2 . . 4.370 4.339 4.332 4.343 . 0 0 "[ . 1 . 2]" 1
1801 1 75 THR HA 1 76 PRO HG3 . . 4.420 4.362 4.359 4.365 . 0 0 "[ . 1 . 2]" 1
1802 1 75 THR HB 1 76 PRO QD . . 4.370 3.786 3.782 3.789 . 0 0 "[ . 1 . 2]" 1
1803 1 75 THR MG 1 76 PRO HA . . 5.240 3.928 3.916 3.968 . 0 0 "[ . 1 . 2]" 1
1804 1 75 THR MG 1 76 PRO HB2 . . 4.620 4.236 4.229 4.269 . 0 0 "[ . 1 . 2]" 1
1805 1 75 THR MG 1 76 PRO HB3 . . 5.500 4.506 4.496 4.541 . 0 0 "[ . 1 . 2]" 1
1806 1 75 THR MG 1 76 PRO HD2 . . 3.380 1.819 1.816 1.826 . 0 0 "[ . 1 . 2]" 1
1807 1 75 THR MG 1 76 PRO HD3 . . 3.380 3.150 3.142 3.160 . 0 0 "[ . 1 . 2]" 1
1808 1 75 THR MG 1 76 PRO HG2 . . 4.290 2.929 2.915 2.955 . 0 0 "[ . 1 . 2]" 1
1809 1 75 THR MG 1 76 PRO HG3 . . 4.280 3.886 3.878 3.902 . 0 0 "[ . 1 . 2]" 1
1810 1 75 THR MG 1 77 ALA MB . . 4.660 4.597 4.546 4.654 . 0 0 "[ . 1 . 2]" 1
1811 1 75 THR MG 1 78 LEU HG . . 5.290 5.192 4.964 5.293 0.003 9 0 "[ . 1 . 2]" 1
1812 1 76 PRO HA 1 77 ALA H . . 2.850 2.152 2.151 2.153 . 0 0 "[ . 1 . 2]" 1
1813 1 76 PRO HA 1 77 ALA HA . . 4.730 4.407 4.401 4.410 . 0 0 "[ . 1 . 2]" 1
1814 1 76 PRO HA 1 77 ALA MB . . 4.240 3.986 3.951 4.009 . 0 0 "[ . 1 . 2]" 1
1815 1 76 PRO HA 1 78 LEU MD2 . . 4.730 4.609 4.504 4.700 . 0 0 "[ . 1 . 2]" 1
1816 1 76 PRO HB2 1 77 ALA H . . 3.740 3.678 3.614 3.702 . 0 0 "[ . 1 . 2]" 1
1817 1 76 PRO HB2 1 77 ALA MB . . 5.200 5.082 5.056 5.101 . 0 0 "[ . 1 . 2]" 1
1818 1 76 PRO HB2 1 78 LEU MD1 . . 4.070 3.782 3.605 3.861 . 0 0 "[ . 1 . 2]" 1
1819 1 76 PRO HB2 1 78 LEU MD2 . . 3.070 2.960 2.738 3.070 . 0 0 "[ . 1 . 2]" 1
1820 1 76 PRO HB3 1 77 ALA H . . 4.110 4.101 4.055 4.117 0.007 17 0 "[ . 1 . 2]" 1
1821 1 76 PRO HB3 1 78 LEU MD1 . . 5.270 5.022 4.807 5.137 . 0 0 "[ . 1 . 2]" 1
1822 1 76 PRO HB3 1 78 LEU MD2 . . 4.480 4.125 3.991 4.232 . 0 0 "[ . 1 . 2]" 1
1823 1 76 PRO HB3 1 78 LEU HG . . 4.900 4.517 4.346 4.670 . 0 0 "[ . 1 . 2]" 1
1824 1 76 PRO QD 1 77 ALA H . . 4.960 4.932 4.924 4.952 . 0 0 "[ . 1 . 2]" 1
1825 1 76 PRO HG2 1 78 LEU MD2 . . 4.860 4.524 4.206 4.650 . 0 0 "[ . 1 . 2]" 1
1826 1 76 PRO HG3 1 78 LEU MD1 . . 4.750 4.671 4.542 4.750 . 0 0 "[ . 1 . 2]" 1
1827 1 76 PRO HG3 1 78 LEU MD2 . . 5.170 4.904 4.617 5.028 . 0 0 "[ . 1 . 2]" 1
1828 1 77 ALA H 1 77 ALA MB . . 3.190 2.263 2.203 2.300 . 0 0 "[ . 1 . 2]" 1
1829 1 77 ALA H 1 78 LEU H . . 4.460 4.080 3.977 4.199 . 0 0 "[ . 1 . 2]" 1
1830 1 77 ALA H 1 78 LEU MD2 . . 4.440 4.343 4.215 4.399 . 0 0 "[ . 1 . 2]" 1
1831 1 77 ALA H 1 84 VAL H . . 4.670 4.277 4.152 4.389 . 0 0 "[ . 1 . 2]" 1
1832 1 77 ALA H 1 84 VAL MG2 . . 4.830 4.289 3.967 4.556 . 0 0 "[ . 1 . 2]" 1
1833 1 77 ALA H 1 86 VAL MG2 . . 5.190 4.669 4.414 4.873 . 0 0 "[ . 1 . 2]" 1
1834 1 77 ALA HA 1 78 LEU H . . 2.890 2.253 2.200 2.301 . 0 0 "[ . 1 . 2]" 1
1835 1 77 ALA HA 1 78 LEU HB2 . . 4.830 4.652 4.614 4.687 . 0 0 "[ . 1 . 2]" 1
1836 1 77 ALA HA 1 78 LEU MD2 . . 4.820 4.736 4.567 4.816 . 0 0 "[ . 1 . 2]" 1
1837 1 77 ALA HA 1 78 LEU HG . . 4.720 4.437 4.314 4.594 . 0 0 "[ . 1 . 2]" 1
1838 1 77 ALA HA 1 84 VAL MG2 . . 4.730 4.433 4.198 4.703 . 0 0 "[ . 1 . 2]" 1
1839 1 77 ALA HA 1 86 VAL MG2 . . 5.160 5.028 4.792 5.152 . 0 0 "[ . 1 . 2]" 1
1840 1 77 ALA MB 1 78 LEU H . . 3.720 3.578 3.506 3.628 . 0 0 "[ . 1 . 2]" 1
1841 1 77 ALA MB 1 78 LEU HG . . 5.500 5.231 5.147 5.348 . 0 0 "[ . 1 . 2]" 1
1842 1 77 ALA MB 1 83 PRO HA . . 4.750 4.553 4.377 4.700 . 0 0 "[ . 1 . 2]" 1
1843 1 77 ALA MB 1 84 VAL H . . 3.650 3.461 3.275 3.637 . 0 0 "[ . 1 . 2]" 1
1844 1 77 ALA MB 1 84 VAL HB . . 5.180 4.829 4.562 5.109 . 0 0 "[ . 1 . 2]" 1
1845 1 77 ALA MB 1 84 VAL MG2 . . 2.670 2.270 1.997 2.576 . 0 0 "[ . 1 . 2]" 1
1846 1 77 ALA MB 1 86 VAL HB . . 4.250 4.013 3.823 4.151 . 0 0 "[ . 1 . 2]" 1
1847 1 77 ALA MB 1 86 VAL MG2 . . 3.000 2.534 2.403 2.649 . 0 0 "[ . 1 . 2]" 1
1848 1 78 LEU H 1 78 LEU HB2 . . 3.960 2.418 2.378 2.447 . 0 0 "[ . 1 . 2]" 1
1849 1 78 LEU H 1 78 LEU MD1 . . 4.200 3.898 3.826 4.033 . 0 0 "[ . 1 . 2]" 1
1850 1 78 LEU H 1 78 LEU MD2 . . 3.570 3.453 3.332 3.570 . 0 0 "[ . 1 . 2]" 1
1851 1 78 LEU H 1 78 LEU HG . . 3.580 2.651 2.537 2.814 . 0 0 "[ . 1 . 2]" 1
1852 1 78 LEU H 1 84 VAL H . . 5.500 5.299 5.184 5.436 . 0 0 "[ . 1 . 2]" 1
1853 1 78 LEU H 1 84 VAL MG2 . . 5.030 4.795 4.574 5.034 0.004 7 0 "[ . 1 . 2]" 1
1854 1 78 LEU HA 1 78 LEU MD1 . . 4.150 3.808 3.771 3.836 . 0 0 "[ . 1 . 2]" 1
1855 1 78 LEU HA 1 78 LEU MD2 . . 3.090 2.056 1.969 2.129 . 0 0 "[ . 1 . 2]" 1
1856 1 78 LEU HA 1 78 LEU HG . . 4.210 3.195 3.159 3.233 . 0 0 "[ . 1 . 2]" 1
1857 1 78 LEU HA 1 79 VAL H . . 3.040 2.152 2.145 2.156 . 0 0 "[ . 1 . 2]" 1
1858 1 78 LEU HA 1 79 VAL MG2 . . 4.920 3.840 3.691 4.031 . 0 0 "[ . 1 . 2]" 1
1859 1 78 LEU HA 1 82 LYS H . . 5.130 4.445 4.223 4.581 . 0 0 "[ . 1 . 2]" 1
1860 1 78 LEU HA 1 83 PRO HA . . 3.690 2.207 2.021 2.436 . 0 0 "[ . 1 . 2]" 1
1861 1 78 LEU HA 1 84 VAL H . . 3.780 3.636 3.512 3.725 . 0 0 "[ . 1 . 2]" 1
1862 1 78 LEU HA 1 84 VAL MG1 . . 4.500 3.760 3.537 4.075 . 0 0 "[ . 1 . 2]" 1
1863 1 78 LEU HB2 1 78 LEU MD1 . . 3.290 2.455 2.423 2.494 . 0 0 "[ . 1 . 2]" 1
1864 1 78 LEU HB2 1 79 VAL H . . 4.490 4.397 4.368 4.415 . 0 0 "[ . 1 . 2]" 1
1865 1 78 LEU HB2 1 81 GLY H . . 5.170 4.379 4.290 4.565 . 0 0 "[ . 1 . 2]" 1
1866 1 78 LEU HB2 1 81 GLY HA2 . . 4.500 4.302 4.193 4.458 . 0 0 "[ . 1 . 2]" 1
1867 1 78 LEU HB2 1 82 LYS H . . 5.500 5.461 5.353 5.501 0.001 20 0 "[ . 1 . 2]" 1
1868 1 78 LEU HB3 1 79 VAL H . . 4.520 3.666 3.599 3.688 . 0 0 "[ . 1 . 2]" 1
1869 1 78 LEU HB3 1 81 GLY H . . 4.110 3.352 3.287 3.402 . 0 0 "[ . 1 . 2]" 1
1870 1 78 LEU HB3 1 81 GLY HA2 . . 4.460 3.201 3.098 3.281 . 0 0 "[ . 1 . 2]" 1
1871 1 78 LEU HB3 1 81 GLY HA3 . . 4.850 4.590 4.514 4.700 . 0 0 "[ . 1 . 2]" 1
1872 1 78 LEU HB3 1 82 LYS H . . 3.980 3.882 3.747 3.931 . 0 0 "[ . 1 . 2]" 1
1873 1 78 LEU MD1 1 79 VAL H . . 5.440 5.240 5.185 5.274 . 0 0 "[ . 1 . 2]" 1
1874 1 78 LEU MD1 1 81 GLY H . . 5.300 4.770 4.697 4.806 . 0 0 "[ . 1 . 2]" 1
1875 1 78 LEU MD1 1 81 GLY HA2 . . 3.820 3.599 3.470 3.673 . 0 0 "[ . 1 . 2]" 1
1876 1 78 LEU MD1 1 81 GLY HA3 . . 4.870 4.847 4.734 4.873 0.003 7 0 "[ . 1 . 2]" 1
1877 1 78 LEU MD1 1 82 LYS H . . 5.170 5.032 4.860 5.104 . 0 0 "[ . 1 . 2]" 1
1878 1 78 LEU MD1 1 83 PRO HA . . 4.620 4.554 4.402 4.619 . 0 0 "[ . 1 . 2]" 1
1879 1 78 LEU MD2 1 79 VAL H . . 3.690 3.623 3.521 3.690 0.000 14 0 "[ . 1 . 2]" 1
1880 1 78 LEU MD2 1 81 GLY H . . 5.070 4.779 4.717 4.832 . 0 0 "[ . 1 . 2]" 1
1881 1 78 LEU MD2 1 81 GLY HA2 . . 4.800 4.656 4.573 4.731 . 0 0 "[ . 1 . 2]" 1
1882 1 78 LEU MD2 1 81 GLY HA3 . . 5.500 5.481 5.406 5.502 0.002 20 0 "[ . 1 . 2]" 1
1883 1 78 LEU MD2 1 82 LYS H . . 4.350 4.236 3.982 4.318 . 0 0 "[ . 1 . 2]" 1
1884 1 78 LEU MD2 1 82 LYS HA . . 4.220 3.026 2.809 3.153 . 0 0 "[ . 1 . 2]" 1
1885 1 78 LEU MD2 1 83 PRO HA . . 3.170 1.974 1.836 2.058 . 0 0 "[ . 1 . 2]" 1
1886 1 78 LEU MD2 1 83 PRO HB2 . . 3.780 3.418 3.219 3.592 . 0 0 "[ . 1 . 2]" 1
1887 1 78 LEU MD2 1 83 PRO QB . . 3.030 2.125 1.881 2.356 . 0 0 "[ . 1 . 2]" 1
1888 1 78 LEU MD2 1 83 PRO HB3 . . 3.780 2.147 1.894 2.390 . 0 0 "[ . 1 . 2]" 1
1889 1 78 LEU MD2 1 83 PRO HD2 . . 3.910 3.583 3.323 3.794 . 0 0 "[ . 1 . 2]" 1
1890 1 78 LEU MD2 1 83 PRO HD3 . . 4.760 2.407 2.084 2.645 . 0 0 "[ . 1 . 2]" 1
1891 1 78 LEU MD2 1 83 PRO QG . . 4.090 3.228 2.940 3.472 . 0 0 "[ . 1 . 2]" 1
1892 1 78 LEU MD2 1 84 VAL H . . 3.850 3.690 3.528 3.795 . 0 0 "[ . 1 . 2]" 1
1893 1 78 LEU HG 1 83 PRO HA . . 5.380 4.120 3.973 4.251 . 0 0 "[ . 1 . 2]" 1
1894 1 79 VAL H 1 79 VAL HB . . 3.340 2.489 2.422 2.547 . 0 0 "[ . 1 . 2]" 1
1895 1 79 VAL H 1 79 VAL MG2 . . 3.420 2.528 2.359 2.705 . 0 0 "[ . 1 . 2]" 1
1896 1 79 VAL H 1 80 PHE H . . 4.700 4.430 4.412 4.452 . 0 0 "[ . 1 . 2]" 1
1897 1 79 VAL H 1 82 LYS H . . 3.710 3.663 3.405 3.719 0.009 19 0 "[ . 1 . 2]" 1
1898 1 79 VAL H 1 82 LYS QB . . 5.140 4.835 4.737 4.912 . 0 0 "[ . 1 . 2]" 1
1899 1 79 VAL H 1 82 LYS HG2 . . 4.570 3.641 3.386 3.979 . 0 0 "[ . 1 . 2]" 1
1900 1 79 VAL H 1 83 PRO HA . . 4.000 3.373 3.192 3.577 . 0 0 "[ . 1 . 2]" 1
1901 1 79 VAL H 1 84 VAL H . . 4.460 3.996 3.842 4.112 . 0 0 "[ . 1 . 2]" 1
1902 1 79 VAL H 1 84 VAL MG1 . . 3.350 2.381 2.174 2.678 . 0 0 "[ . 1 . 2]" 1
1903 1 79 VAL H 1 84 VAL MG2 . . 4.760 3.181 2.812 3.469 . 0 0 "[ . 1 . 2]" 1
1904 1 79 VAL HA 1 79 VAL MG1 . . 3.360 2.418 2.344 2.478 . 0 0 "[ . 1 . 2]" 1
1905 1 79 VAL HA 1 79 VAL MG2 . . 3.300 2.371 2.209 2.464 . 0 0 "[ . 1 . 2]" 1
1906 1 79 VAL HA 1 80 PHE H . . 3.170 2.142 2.140 2.146 . 0 0 "[ . 1 . 2]" 1
1907 1 79 VAL HA 1 80 PHE HA . . 4.550 4.366 4.364 4.369 . 0 0 "[ . 1 . 2]" 1
1908 1 79 VAL HA 1 80 PHE QD . . 5.190 5.182 5.108 5.194 0.004 7 0 "[ . 1 . 2]" 1
1909 1 79 VAL HA 1 81 GLY H . . 4.400 3.375 3.350 3.397 . 0 0 "[ . 1 . 2]" 1
1910 1 79 VAL HA 1 82 LYS H . . 4.900 4.673 4.463 4.761 . 0 0 "[ . 1 . 2]" 1
1911 1 79 VAL HA 1 84 VAL MG1 . . 4.490 4.135 3.910 4.417 . 0 0 "[ . 1 . 2]" 1
1912 1 79 VAL HB 1 80 PHE H . . 4.440 4.266 4.224 4.322 . 0 0 "[ . 1 . 2]" 1
1913 1 79 VAL HB 1 84 VAL MG1 . . 3.290 1.953 1.842 2.124 . 0 0 "[ . 1 . 2]" 1
1914 1 79 VAL HB 1 84 VAL MG2 . . 4.010 3.247 3.006 3.478 . 0 0 "[ . 1 . 2]" 1
1915 1 79 VAL MG1 1 80 PHE H . . 3.830 2.740 2.608 2.822 . 0 0 "[ . 1 . 2]" 1
1916 1 79 VAL MG1 1 80 PHE HA . . 4.480 3.887 3.803 3.960 . 0 0 "[ . 1 . 2]" 1
1917 1 79 VAL MG1 1 80 PHE HB2 . . 5.300 2.455 2.319 2.563 . 0 0 "[ . 1 . 2]" 1
1918 1 79 VAL MG1 1 80 PHE QB . . 4.500 2.434 2.303 2.538 . 0 0 "[ . 1 . 2]" 1
1919 1 79 VAL MG1 1 80 PHE HB3 . . 5.300 4.023 3.916 4.108 . 0 0 "[ . 1 . 2]" 1
1920 1 79 VAL MG1 1 80 PHE QD . . 3.330 2.601 2.500 2.753 . 0 0 "[ . 1 . 2]" 1
1921 1 79 VAL MG1 1 80 PHE QE . . 4.230 4.057 3.855 4.145 . 0 0 "[ . 1 . 2]" 1
1922 1 79 VAL MG2 1 80 PHE H . . 4.320 4.032 3.911 4.116 . 0 0 "[ . 1 . 2]" 1
1923 1 79 VAL MG2 1 80 PHE QD . . 5.390 5.204 5.111 5.289 . 0 0 "[ . 1 . 2]" 1
1924 1 79 VAL MG2 1 84 VAL HB . . 4.780 3.523 3.207 3.820 . 0 0 "[ . 1 . 2]" 1
1925 1 79 VAL MG2 1 84 VAL MG1 . . 2.910 2.148 1.855 2.488 . 0 0 "[ . 1 . 2]" 1
1926 1 79 VAL MG2 1 84 VAL MG2 . . 3.110 1.820 1.723 1.996 . 0 0 "[ . 1 . 2]" 1
1927 1 80 PHE H 1 80 PHE QD . . 4.120 3.919 3.784 3.998 . 0 0 "[ . 1 . 2]" 1
1928 1 80 PHE H 1 81 GLY H . . 4.030 2.663 2.650 2.675 . 0 0 "[ . 1 . 2]" 1
1929 1 80 PHE H 1 81 GLY HA3 . . 5.500 5.232 5.206 5.248 . 0 0 "[ . 1 . 2]" 1
1930 1 80 PHE H 1 82 LYS H . . 4.480 4.410 4.276 4.474 . 0 0 "[ . 1 . 2]" 1
1931 1 80 PHE HA 1 80 PHE QD . . 3.560 2.114 1.996 2.266 . 0 0 "[ . 1 . 2]" 1
1932 1 80 PHE HA 1 82 LYS H . . 4.950 4.630 4.606 4.671 . 0 0 "[ . 1 . 2]" 1
1933 1 80 PHE QD 1 81 GLY H . . 5.040 4.864 4.838 4.890 . 0 0 "[ . 1 . 2]" 1
1934 1 81 GLY H 1 82 LYS H . . 3.800 2.366 2.209 2.420 . 0 0 "[ . 1 . 2]" 1
1935 1 81 GLY H 1 82 LYS QD . . 5.320 3.570 3.358 3.843 . 0 0 "[ . 1 . 2]" 1
1936 1 81 GLY HA2 1 82 LYS QD . . 5.040 4.478 4.140 4.758 . 0 0 "[ . 1 . 2]" 1
1937 1 81 GLY HA3 1 82 LYS QD . . 4.330 3.481 3.055 3.772 . 0 0 "[ . 1 . 2]" 1
1938 1 82 LYS H 1 82 LYS HB2 . . 3.820 3.663 3.563 3.756 . 0 0 "[ . 1 . 2]" 1
1939 1 82 LYS H 1 82 LYS QB . . 3.190 2.968 2.882 3.053 . 0 0 "[ . 1 . 2]" 1
1940 1 82 LYS H 1 82 LYS HB3 . . 3.820 3.141 3.007 3.308 . 0 0 "[ . 1 . 2]" 1
1941 1 82 LYS H 1 82 LYS QD . . 3.190 1.955 1.881 2.101 . 0 0 "[ . 1 . 2]" 1
1942 1 82 LYS H 1 82 LYS QE . . 5.260 3.652 3.430 3.964 . 0 0 "[ . 1 . 2]" 1
1943 1 82 LYS H 1 82 LYS HG2 . . 3.480 2.231 2.106 2.491 . 0 0 "[ . 1 . 2]" 1
1944 1 82 LYS H 1 82 LYS HG3 . . 3.950 3.644 3.508 3.813 . 0 0 "[ . 1 . 2]" 1
1945 1 82 LYS H 1 83 PRO HD2 . . 4.880 4.822 4.805 4.833 . 0 0 "[ . 1 . 2]" 1
1946 1 82 LYS H 1 83 PRO HD3 . . 5.200 4.998 4.949 5.038 . 0 0 "[ . 1 . 2]" 1
1947 1 82 LYS HA 1 82 LYS HD2 . . 4.400 4.083 3.426 4.395 . 0 0 "[ . 1 . 2]" 1
1948 1 82 LYS HA 1 82 LYS QD . . 3.790 3.623 3.282 3.791 0.001 12 0 "[ . 1 . 2]" 1
1949 1 82 LYS HA 1 82 LYS HD3 . . 4.400 4.117 3.937 4.365 . 0 0 "[ . 1 . 2]" 1
1950 1 82 LYS HA 1 82 LYS HG2 . . 3.720 3.629 3.598 3.685 . 0 0 "[ . 1 . 2]" 1
1951 1 82 LYS HA 1 82 LYS HG3 . . 4.250 4.223 4.193 4.246 . 0 0 "[ . 1 . 2]" 1
1952 1 82 LYS HA 1 83 PRO HD2 . . 3.140 2.354 2.301 2.414 . 0 0 "[ . 1 . 2]" 1
1953 1 82 LYS HA 1 83 PRO HD3 . . 3.150 2.285 2.269 2.306 . 0 0 "[ . 1 . 2]" 1
1954 1 82 LYS HA 1 83 PRO QG . . 4.380 3.974 3.942 4.011 . 0 0 "[ . 1 . 2]" 1
1955 1 82 LYS QB 1 83 PRO HD3 . . 3.580 3.397 3.308 3.492 . 0 0 "[ . 1 . 2]" 1
1956 1 82 LYS HB2 1 83 PRO HD3 . . 4.370 3.599 3.452 3.809 . 0 0 "[ . 1 . 2]" 1
1957 1 82 LYS HB3 1 83 PRO HD3 . . 4.370 4.185 4.041 4.366 . 0 0 "[ . 1 . 2]" 1
1958 1 82 LYS QE 1 82 LYS HG2 . . 3.180 2.670 2.505 2.984 . 0 0 "[ . 1 . 2]" 1
1959 1 82 LYS QE 1 82 LYS HG3 . . 3.110 2.175 1.971 2.313 . 0 0 "[ . 1 . 2]" 1
1960 1 82 LYS HG2 1 83 PRO HD2 . . 5.040 4.441 4.249 4.684 . 0 0 "[ . 1 . 2]" 1
1961 1 82 LYS HG3 1 83 PRO HD2 . . 4.820 4.394 4.133 4.721 . 0 0 "[ . 1 . 2]" 1
1962 1 83 PRO HA 1 84 VAL H . . 2.870 2.243 2.217 2.274 . 0 0 "[ . 1 . 2]" 1
1963 1 83 PRO HA 1 84 VAL HA . . 4.840 4.448 4.431 4.461 . 0 0 "[ . 1 . 2]" 1
1964 1 83 PRO HA 1 84 VAL MG1 . . 3.920 3.575 3.399 3.779 . 0 0 "[ . 1 . 2]" 1
1965 1 83 PRO HA 1 84 VAL MG2 . . 3.870 3.794 3.585 3.870 . 0 0 "[ . 1 . 2]" 1
1966 1 83 PRO QB 1 84 VAL MG2 . . 5.310 4.615 4.529 4.694 . 0 0 "[ . 1 . 2]" 1
1967 1 83 PRO HB2 1 84 VAL H . . 3.940 3.071 2.970 3.169 . 0 0 "[ . 1 . 2]" 1
1968 1 83 PRO HB3 1 84 VAL H . . 3.940 3.707 3.649 3.766 . 0 0 "[ . 1 . 2]" 1
1969 1 83 PRO QG 1 84 VAL H . . 4.570 4.446 4.391 4.498 . 0 0 "[ . 1 . 2]" 1
1970 1 84 VAL H 1 84 VAL MG1 . . 3.450 3.001 2.875 3.203 . 0 0 "[ . 1 . 2]" 1
1971 1 84 VAL H 1 84 VAL MG2 . . 3.060 2.351 2.136 2.507 . 0 0 "[ . 1 . 2]" 1
1972 1 84 VAL H 1 85 ARG H . . 4.550 4.371 4.327 4.405 . 0 0 "[ . 1 . 2]" 1
1973 1 84 VAL HA 1 84 VAL MG1 . . 3.050 2.319 2.197 2.392 . 0 0 "[ . 1 . 2]" 1
1974 1 84 VAL HA 1 84 VAL MG2 . . 3.700 3.193 3.184 3.203 . 0 0 "[ . 1 . 2]" 1
1975 1 84 VAL HA 1 85 ARG H . . 3.280 2.647 2.546 2.728 . 0 0 "[ . 1 . 2]" 1
1976 1 84 VAL HB 1 85 ARG H . . 3.270 1.974 1.900 2.079 . 0 0 "[ . 1 . 2]" 1
1977 1 84 VAL MG1 1 85 ARG H . . 4.010 3.592 3.525 3.659 . 0 0 "[ . 1 . 2]" 1
1978 1 84 VAL MG2 1 85 ARG H . . 3.890 2.835 2.549 3.239 . 0 0 "[ . 1 . 2]" 1
1979 1 84 VAL MG2 1 86 VAL HA . . 5.500 4.601 4.405 4.859 . 0 0 "[ . 1 . 2]" 1
1980 1 84 VAL MG2 1 86 VAL HB . . 5.500 4.706 4.498 4.929 . 0 0 "[ . 1 . 2]" 1
1981 1 85 ARG H 1 85 ARG HB2 . . 3.490 2.440 2.336 2.572 . 0 0 "[ . 1 . 2]" 1
1982 1 85 ARG H 1 85 ARG HB3 . . 3.760 3.620 3.477 3.736 . 0 0 "[ . 1 . 2]" 1
1983 1 85 ARG H 1 85 ARG QD . . 4.950 4.601 4.057 4.930 . 0 0 "[ . 1 . 2]" 1
1984 1 85 ARG H 1 85 ARG QG . . 3.590 3.238 2.847 3.577 . 0 0 "[ . 1 . 2]" 1
1985 1 85 ARG H 1 86 VAL H . . 4.600 4.458 4.342 4.511 . 0 0 "[ . 1 . 2]" 1
1986 1 85 ARG HA 1 85 ARG QG . . 3.290 2.241 2.056 2.417 . 0 0 "[ . 1 . 2]" 1
1987 1 85 ARG HA 1 86 VAL H . . 2.810 2.209 2.159 2.270 . 0 0 "[ . 1 . 2]" 1
1988 1 85 ARG HA 1 86 VAL MG2 . . 4.340 3.709 3.533 3.871 . 0 0 "[ . 1 . 2]" 1
1989 1 85 ARG HB2 1 86 VAL H . . 4.570 4.189 4.053 4.335 . 0 0 "[ . 1 . 2]" 1
1990 1 85 ARG HB3 1 86 VAL H . . 3.660 3.052 2.836 3.275 . 0 0 "[ . 1 . 2]" 1
1991 1 85 ARG HB3 1 86 VAL HA . . 5.300 4.280 4.173 4.462 . 0 0 "[ . 1 . 2]" 1
1992 1 85 ARG HB3 1 87 HIS HE1 . . 4.240 3.541 3.038 4.024 . 0 0 "[ . 1 . 2]" 1
1993 1 85 ARG QD 1 87 HIS HE1 . . 4.240 2.651 2.145 3.699 . 0 0 "[ . 1 . 2]" 1
1994 1 85 ARG HD2 1 87 HIS HE1 . . 4.920 3.196 2.384 4.823 . 0 0 "[ . 1 . 2]" 1
1995 1 85 ARG HD3 1 87 HIS HE1 . . 4.920 3.124 2.173 3.952 . 0 0 "[ . 1 . 2]" 1
1996 1 85 ARG QG 1 86 VAL H . . 4.090 3.745 3.476 4.087 . 0 0 "[ . 1 . 2]" 1
1997 1 85 ARG QG 1 87 HIS HE1 . . 4.910 4.326 3.436 4.895 . 0 0 "[ . 1 . 2]" 1
1998 1 86 VAL H 1 86 VAL HB . . 3.420 2.720 2.617 2.793 . 0 0 "[ . 1 . 2]" 1
1999 1 86 VAL H 1 86 VAL MG1 . . 3.890 3.859 3.802 3.891 0.001 2 0 "[ . 1 . 2]" 1
2000 1 86 VAL H 1 86 VAL MG2 . . 3.500 3.047 2.933 3.147 . 0 0 "[ . 1 . 2]" 1
2001 1 86 VAL H 1 87 HIS H . . 4.560 4.130 3.910 4.303 . 0 0 "[ . 1 . 2]" 1
2002 1 86 VAL H 1 87 HIS HA . . 5.500 4.824 4.696 4.968 . 0 0 "[ . 1 . 2]" 1
2003 1 86 VAL H 1 87 HIS HD2 . . 4.600 3.758 3.031 4.205 . 0 0 "[ . 1 . 2]" 1
2004 1 86 VAL HA 1 86 VAL MG1 . . 3.320 2.393 2.331 2.490 . 0 0 "[ . 1 . 2]" 1
2005 1 86 VAL HA 1 86 VAL MG2 . . 3.220 2.264 2.193 2.419 . 0 0 "[ . 1 . 2]" 1
2006 1 86 VAL HA 1 87 HIS H . . 2.980 2.148 2.139 2.176 . 0 0 "[ . 1 . 2]" 1
2007 1 86 VAL HA 1 87 HIS HA . . 4.880 4.394 4.389 4.415 . 0 0 "[ . 1 . 2]" 1
2008 1 86 VAL HB 1 87 HIS H . . 4.990 4.340 4.127 4.457 . 0 0 "[ . 1 . 2]" 1
2009 1 86 VAL MG1 1 87 HIS H . . 3.450 2.869 2.513 3.215 . 0 0 "[ . 1 . 2]" 1
2010 1 86 VAL MG1 1 87 HIS HA . . 4.160 3.544 3.404 3.677 . 0 0 "[ . 1 . 2]" 1
2011 1 86 VAL MG2 1 87 HIS H . . 4.110 4.044 3.976 4.111 0.001 14 0 "[ . 1 . 2]" 1
2012 1 87 HIS H 1 87 HIS HB2 . . 3.960 2.708 2.617 2.823 . 0 0 "[ . 1 . 2]" 1
2013 1 87 HIS H 1 87 HIS HB3 . . 3.960 3.811 3.766 3.867 . 0 0 "[ . 1 . 2]" 1
2014 1 87 HIS H 1 87 HIS HD2 . . 5.270 4.068 3.502 4.400 . 0 0 "[ . 1 . 2]" 1
2015 1 87 HIS HA 1 87 HIS HD2 . . 4.340 2.448 2.329 2.591 . 0 0 "[ . 1 . 2]" 1
2016 1 87 HIS HA 1 88 LEU H . . 3.340 2.417 2.288 2.496 . 0 0 "[ . 1 . 2]" 1
2017 1 87 HIS HA 1 88 LEU HB2 . . 4.360 4.076 4.035 4.112 . 0 0 "[ . 1 . 2]" 1
2018 1 87 HIS QB 1 88 LEU H . . 3.360 2.390 2.218 2.679 . 0 0 "[ . 1 . 2]" 1
2019 1 87 HIS HB2 1 88 LEU H . . 3.910 3.560 3.270 3.819 . 0 0 "[ . 1 . 2]" 1
2020 1 87 HIS HB3 1 88 LEU H . . 3.910 2.430 2.246 2.739 . 0 0 "[ . 1 . 2]" 1
2021 1 87 HIS HD2 1 88 LEU H . . 5.500 4.460 4.276 4.810 . 0 0 "[ . 1 . 2]" 1
2022 1 88 LEU H 1 88 LEU HB2 . . 3.320 2.491 2.270 2.712 . 0 0 "[ . 1 . 2]" 1
2023 1 88 LEU H 1 88 LEU HB3 . . 3.420 2.951 2.877 3.085 . 0 0 "[ . 1 . 2]" 1
2024 1 88 LEU H 1 88 LEU MD2 . . 4.000 3.791 3.440 3.943 . 0 0 "[ . 1 . 2]" 1
2025 1 88 LEU H 1 88 LEU HG . . 5.030 4.744 4.592 4.879 . 0 0 "[ . 1 . 2]" 1
2026 1 88 LEU HA 1 88 LEU MD1 . . 3.260 2.573 2.272 2.776 . 0 0 "[ . 1 . 2]" 1
2027 1 88 LEU HA 1 88 LEU MD2 . . 3.320 1.950 1.898 1.985 . 0 0 "[ . 1 . 2]" 1
2028 1 88 LEU HA 1 88 LEU HG . . 3.870 3.646 3.610 3.679 . 0 0 "[ . 1 . 2]" 1
2029 1 88 LEU HA 1 89 SER H . . 3.270 2.302 2.199 2.428 . 0 0 "[ . 1 . 2]" 1
2030 1 88 LEU HB2 1 88 LEU MD2 . . 3.230 2.386 2.330 2.444 . 0 0 "[ . 1 . 2]" 1
2031 1 88 LEU HB2 1 89 SER H . . 4.720 4.648 4.620 4.656 . 0 0 "[ . 1 . 2]" 1
2032 1 88 LEU HB3 1 88 LEU MD2 . . 3.380 3.182 3.173 3.195 . 0 0 "[ . 1 . 2]" 1
2033 1 88 LEU MD1 1 89 SER H . . 3.610 3.348 3.062 3.584 . 0 0 "[ . 1 . 2]" 1
2034 1 88 LEU MD2 1 89 SER H . . 3.960 3.792 3.373 3.962 0.002 15 0 "[ . 1 . 2]" 1
2035 1 89 SER H 1 89 SER QB . . 3.510 2.146 2.054 2.343 . 0 0 "[ . 1 . 2]" 1
2036 1 90 GLN HA 1 90 GLN QG . . 3.720 2.916 2.154 3.573 . 0 0 "[ . 1 . 2]" 1
2037 1 91 LYS HA 1 91 LYS QE . . 5.050 4.663 3.786 5.050 0.000 1 0 "[ . 1 . 2]" 1
2038 1 91 LYS HA 1 91 LYS HG2 . . 4.200 3.044 2.047 4.204 0.004 7 0 "[ . 1 . 2]" 1
2039 1 91 LYS HA 1 91 LYS QG . . 3.540 2.751 2.022 3.408 . 0 0 "[ . 1 . 2]" 1
2040 1 91 LYS HA 1 91 LYS HG3 . . 4.200 3.439 2.932 3.768 . 0 0 "[ . 1 . 2]" 1
2041 1 91 LYS QB 1 92 TYR QD . . 4.750 3.876 2.002 4.708 . 0 0 "[ . 1 . 2]" 1
2042 1 91 LYS QD 1 92 TYR QD . . 5.270 3.108 2.412 3.963 . 0 0 "[ . 1 . 2]" 1
2043 1 91 LYS QD 1 92 TYR QE . . 4.830 3.877 2.992 4.576 . 0 0 "[ . 1 . 2]" 1
2044 1 91 LYS HD2 1 92 TYR QE . . 5.500 4.320 3.043 5.498 . 0 0 "[ . 1 . 2]" 1
2045 1 91 LYS HD3 1 92 TYR QE . . 5.500 4.751 3.298 5.506 0.006 7 0 "[ . 1 . 2]" 1
2046 1 91 LYS QE 1 91 LYS HG2 . . 3.640 2.764 2.136 3.371 . 0 0 "[ . 1 . 2]" 1
2047 1 91 LYS QE 1 91 LYS QG . . 3.130 2.169 1.947 2.549 . 0 0 "[ . 1 . 2]" 1
2048 1 91 LYS QE 1 91 LYS HG3 . . 3.640 2.522 1.985 3.503 . 0 0 "[ . 1 . 2]" 1
2049 1 91 LYS QE 1 92 TYR QE . . 5.030 4.167 2.120 5.022 . 0 0 "[ . 1 . 2]" 1
2050 1 92 TYR H 1 92 TYR QD . . 5.040 3.664 2.027 4.421 . 0 0 "[ . 1 . 2]" 1
2051 1 92 TYR HA 1 92 TYR QD . . 3.830 2.413 1.998 3.684 . 0 0 "[ . 1 . 2]" 1
2052 1 92 TYR QD 1 93 LYS H . . 5.500 4.043 1.943 4.989 . 0 0 "[ . 1 . 2]" 1
2053 1 93 LYS H 1 94 ARG QB . . 5.340 4.555 3.533 5.342 0.002 9 0 "[ . 1 . 2]" 1
2054 1 93 LYS HA 1 93 LYS QD . . 4.030 3.504 2.523 3.994 . 0 0 "[ . 1 . 2]" 1
2055 1 93 LYS HA 1 93 LYS HG2 . . 3.770 2.663 2.047 3.736 . 0 0 "[ . 1 . 2]" 1
2056 1 93 LYS HA 1 93 LYS HG3 . . 3.770 2.786 2.028 3.526 . 0 0 "[ . 1 . 2]" 1
2057 1 94 ARG HA 1 94 ARG QD . . 3.690 3.051 2.042 3.622 . 0 0 "[ . 1 . 2]" 1
2058 1 94 ARG QB 1 95 ILE H . . 4.270 3.354 2.107 4.009 . 0 0 "[ . 1 . 2]" 1
2059 1 94 ARG HB2 1 95 ILE H . . 5.090 4.112 3.045 4.670 . 0 0 "[ . 1 . 2]" 1
2060 1 94 ARG HB3 1 95 ILE H . . 5.090 3.598 2.121 4.386 . 0 0 "[ . 1 . 2]" 1
2061 1 95 ILE H 1 95 ILE HB . . 3.910 2.877 2.416 3.767 . 0 0 "[ . 1 . 2]" 1
2062 1 95 ILE H 1 95 ILE MD . . 5.030 3.847 2.821 4.440 . 0 0 "[ . 1 . 2]" 1
2063 1 95 ILE H 1 95 ILE HG12 . . 4.780 3.511 2.614 4.278 . 0 0 "[ . 1 . 2]" 1
2064 1 95 ILE H 1 95 ILE QG . . 4.050 2.512 1.883 3.139 . 0 0 "[ . 1 . 2]" 1
2065 1 95 ILE H 1 95 ILE HG13 . . 4.780 2.739 1.898 4.269 . 0 0 "[ . 1 . 2]" 1
2066 1 95 ILE H 1 95 ILE MG . . 4.750 3.846 3.720 4.045 . 0 0 "[ . 1 . 2]" 1
2067 1 95 ILE HA 1 95 ILE MD . . 4.060 3.663 2.363 3.865 . 0 0 "[ . 1 . 2]" 1
2068 1 95 ILE HA 1 95 ILE HG12 . . 3.840 2.559 2.226 3.033 . 0 0 "[ . 1 . 2]" 1
2069 1 95 ILE HA 1 95 ILE HG13 . . 3.840 3.056 2.601 3.855 0.015 20 0 "[ . 1 . 2]" 1
2070 1 95 ILE HA 1 95 ILE MG . . 3.350 2.364 2.149 2.522 . 0 0 "[ . 1 . 2]" 1
2071 1 95 ILE HB 1 95 ILE MD . . 3.150 2.448 2.022 3.179 0.029 16 0 "[ . 1 . 2]" 1
2072 1 95 ILE HB 1 96 LYS H . . 5.190 3.379 1.900 4.415 . 0 0 "[ . 1 . 2]" 1
2073 1 95 ILE MG 1 96 LYS H . . 5.260 2.813 1.925 3.421 . 0 0 "[ . 1 . 2]" 1
2074 1 95 ILE MG 1 96 LYS HA . . 4.440 3.611 3.041 4.364 . 0 0 "[ . 1 . 2]" 1
2075 1 95 ILE MG 1 96 LYS HB2 . . 5.080 3.456 2.143 5.074 . 0 0 "[ . 1 . 2]" 1
2076 1 95 ILE MG 1 96 LYS QB . . 4.450 3.278 2.122 4.192 . 0 0 "[ . 1 . 2]" 1
2077 1 95 ILE MG 1 96 LYS HB3 . . 5.080 4.422 3.407 5.080 . 0 0 "[ . 1 . 2]" 1
2078 1 96 LYS HA 1 96 LYS QG . . 3.620 2.363 2.008 3.301 . 0 0 "[ . 1 . 2]" 1
2079 1 98 GLY QA 1 99 PRO HD2 . . 3.060 2.101 1.948 2.553 . 0 0 "[ . 1 . 2]" 1
2080 1 98 GLY QA 1 99 PRO QD . . 2.630 1.973 1.899 2.185 . 0 0 "[ . 1 . 2]" 1
2081 1 98 GLY QA 1 99 PRO HD3 . . 3.060 2.487 2.237 2.893 . 0 0 "[ . 1 . 2]" 1
2082 1 98 GLY QA 1 99 PRO QG . . 4.690 3.723 3.656 3.981 . 0 0 "[ . 1 . 2]" 1
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