NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
415095 |
2d89   |
11145 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2d89
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 2296
_Distance_constraint_stats_list.Viol_count 712
_Distance_constraint_stats_list.Viol_total 136.824
_Distance_constraint_stats_list.Viol_max 0.163
_Distance_constraint_stats_list.Viol_rms 0.0024
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0096
_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 8 PRO 0.005 0.003 11 0 "[ . 1 . 2]"
1 11 SER 0.006 0.004 16 0 "[ . 1 . 2]"
1 12 GLN 0.004 0.004 17 0 "[ . 1 . 2]"
1 13 SER 0.012 0.007 17 0 "[ . 1 . 2]"
1 14 LEU 0.038 0.017 17 0 "[ . 1 . 2]"
1 15 LEU 0.009 0.007 17 0 "[ . 1 . 2]"
1 16 VAL 0.113 0.056 17 0 "[ . 1 . 2]"
1 17 TRP 0.114 0.024 17 0 "[ . 1 . 2]"
1 18 CYS 0.046 0.024 17 0 "[ . 1 . 2]"
1 19 LYS 0.286 0.059 19 0 "[ . 1 . 2]"
1 20 GLU 0.031 0.024 17 0 "[ . 1 . 2]"
1 21 VAL 0.413 0.102 9 0 "[ . 1 . 2]"
1 22 THR 0.266 0.102 9 0 "[ . 1 . 2]"
1 23 LYS 0.153 0.026 14 0 "[ . 1 . 2]"
1 24 ASN 0.024 0.013 14 0 "[ . 1 . 2]"
1 25 TYR 0.170 0.032 17 0 "[ . 1 . 2]"
1 26 ARG 0.054 0.020 17 0 "[ . 1 . 2]"
1 27 GLY 0.027 0.015 15 0 "[ . 1 . 2]"
1 28 VAL 0.215 0.055 12 0 "[ . 1 . 2]"
1 29 LYS 0.294 0.065 7 0 "[ . 1 . 2]"
1 30 ILE 0.118 0.051 17 0 "[ . 1 . 2]"
1 31 THR 0.001 0.001 6 0 "[ . 1 . 2]"
1 32 ASN 0.266 0.068 18 0 "[ . 1 . 2]"
1 33 PHE 0.261 0.163 20 0 "[ . 1 . 2]"
1 34 THR 0.189 0.068 18 0 "[ . 1 . 2]"
1 35 THR 0.002 0.001 1 0 "[ . 1 . 2]"
1 36 SER 0.165 0.163 20 0 "[ . 1 . 2]"
1 37 TRP 0.086 0.015 20 0 "[ . 1 . 2]"
1 38 ARG 0.017 0.007 15 0 "[ . 1 . 2]"
1 39 ASN 0.035 0.009 15 0 "[ . 1 . 2]"
1 40 GLY 0.007 0.003 13 0 "[ . 1 . 2]"
1 41 LEU 0.067 0.015 15 0 "[ . 1 . 2]"
1 42 SER 0.031 0.014 17 0 "[ . 1 . 2]"
1 43 PHE 0.008 0.003 13 0 "[ . 1 . 2]"
1 44 CYS 0.142 0.017 16 0 "[ . 1 . 2]"
1 45 ALA 0.068 0.011 9 0 "[ . 1 . 2]"
1 46 ILE 0.156 0.017 16 0 "[ . 1 . 2]"
1 47 LEU 0.148 0.015 17 0 "[ . 1 . 2]"
1 48 HIS 0.047 0.008 16 0 "[ . 1 . 2]"
1 49 HIS 0.014 0.005 6 0 "[ . 1 . 2]"
1 50 PHE 0.045 0.009 16 0 "[ . 1 . 2]"
1 51 ARG 0.446 0.088 5 0 "[ . 1 . 2]"
1 52 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 ASP 0.415 0.088 5 0 "[ . 1 . 2]"
1 54 LEU 0.041 0.015 2 0 "[ . 1 . 2]"
1 55 ILE 0.552 0.021 1 0 "[ . 1 . 2]"
1 56 ASP 0.027 0.011 13 0 "[ . 1 . 2]"
1 57 TYR 0.110 0.012 18 0 "[ . 1 . 2]"
1 58 LYS 0.278 0.021 1 0 "[ . 1 . 2]"
1 59 SER 0.368 0.073 11 0 "[ . 1 . 2]"
1 60 LEU 0.929 0.070 11 0 "[ . 1 . 2]"
1 61 ASN 0.247 0.032 9 0 "[ . 1 . 2]"
1 62 PRO 0.013 0.004 11 0 "[ . 1 . 2]"
1 63 GLN 0.193 0.025 16 0 "[ . 1 . 2]"
1 64 ASP 0.014 0.006 11 0 "[ . 1 . 2]"
1 65 ILE 0.098 0.009 15 0 "[ . 1 . 2]"
1 66 LYS 0.143 0.049 16 0 "[ . 1 . 2]"
1 67 GLU 0.082 0.055 19 0 "[ . 1 . 2]"
1 68 ASN 0.153 0.050 15 0 "[ . 1 . 2]"
1 69 ASN 0.003 0.002 14 0 "[ . 1 . 2]"
1 70 LYS 0.020 0.009 15 0 "[ . 1 . 2]"
1 71 LYS 0.356 0.067 15 0 "[ . 1 . 2]"
1 72 ALA 0.251 0.072 14 0 "[ . 1 . 2]"
1 73 TYR 0.020 0.007 16 0 "[ . 1 . 2]"
1 74 ASP 0.048 0.022 15 0 "[ . 1 . 2]"
1 75 GLY 0.003 0.002 2 0 "[ . 1 . 2]"
1 76 PHE 0.064 0.022 15 0 "[ . 1 . 2]"
1 77 ALA 0.190 0.072 14 0 "[ . 1 . 2]"
1 78 SER 0.010 0.006 5 0 "[ . 1 . 2]"
1 79 ILE 0.043 0.022 5 0 "[ . 1 . 2]"
1 80 GLY 0.022 0.022 5 0 "[ . 1 . 2]"
1 81 ILE 0.094 0.034 20 0 "[ . 1 . 2]"
1 82 SER 0.086 0.034 20 0 "[ . 1 . 2]"
1 83 ARG 0.450 0.143 6 0 "[ . 1 . 2]"
1 84 LEU 0.441 0.143 6 0 "[ . 1 . 2]"
1 85 LEU 0.055 0.013 16 0 "[ . 1 . 2]"
1 86 GLU 0.020 0.010 16 0 "[ . 1 . 2]"
1 87 PRO 0.024 0.009 15 0 "[ . 1 . 2]"
1 88 SER 0.111 0.049 16 0 "[ . 1 . 2]"
1 89 ASP 0.002 0.002 10 0 "[ . 1 . 2]"
1 90 MET 0.017 0.013 16 0 "[ . 1 . 2]"
1 91 VAL 0.052 0.020 15 0 "[ . 1 . 2]"
1 92 LEU 0.023 0.020 15 0 "[ . 1 . 2]"
1 93 LEU 0.043 0.012 10 0 "[ . 1 . 2]"
1 94 ALA 0.031 0.012 10 0 "[ . 1 . 2]"
1 95 ILE 0.212 0.037 10 0 "[ . 1 . 2]"
1 96 PRO 0.197 0.037 10 0 "[ . 1 . 2]"
1 97 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 LYS 0.006 0.003 2 0 "[ . 1 . 2]"
1 99 LEU 0.379 0.132 10 0 "[ . 1 . 2]"
1 100 THR 0.094 0.041 12 0 "[ . 1 . 2]"
1 101 VAL 0.022 0.006 15 0 "[ . 1 . 2]"
1 102 MET 0.020 0.007 20 0 "[ . 1 . 2]"
1 103 THR 0.001 0.000 7 0 "[ . 1 . 2]"
1 104 TYR 0.022 0.008 15 0 "[ . 1 . 2]"
1 105 LEU 0.001 0.001 5 0 "[ . 1 . 2]"
1 106 TYR 0.016 0.004 16 0 "[ . 1 . 2]"
1 107 GLN 0.020 0.014 15 0 "[ . 1 . 2]"
1 108 ILE 0.008 0.004 11 0 "[ . 1 . 2]"
1 109 ARG 0.051 0.007 16 0 "[ . 1 . 2]"
1 110 ALA 0.024 0.014 15 0 "[ . 1 . 2]"
1 111 HIS 0.001 0.001 9 0 "[ . 1 . 2]"
1 112 PHE 0.003 0.002 8 0 "[ . 1 . 2]"
1 113 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 114 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 GLY 0.005 0.003 11 0 "[ . 1 . 2]"
1 116 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 8 PRO QD 1 115 GLY QA . . 3.120 2.891 1.865 3.123 0.003 11 0 "[ . 1 . 2]" 1
2 1 8 PRO QD 1 116 PRO HA . . 5.350 4.382 2.640 5.208 . 0 0 "[ . 1 . 2]" 1
3 1 8 PRO QD 1 116 PRO QB . . 4.270 3.951 2.776 4.269 . 0 0 "[ . 1 . 2]" 1
4 1 8 PRO QG 1 115 GLY HA2 . . 4.620 3.764 2.054 4.611 . 0 0 "[ . 1 . 2]" 1
5 1 8 PRO QG 1 115 GLY HA3 . . 4.620 3.394 2.357 4.604 . 0 0 "[ . 1 . 2]" 1
6 1 11 SER HA 1 14 LEU HB2 . . 4.690 4.326 3.873 4.658 . 0 0 "[ . 1 . 2]" 1
7 1 11 SER HA 1 14 LEU QB . . 3.980 3.478 2.749 3.958 . 0 0 "[ . 1 . 2]" 1
8 1 11 SER HA 1 14 LEU HB3 . . 4.690 3.728 2.793 4.591 . 0 0 "[ . 1 . 2]" 1
9 1 11 SER HA 1 102 MET ME . . 3.820 3.415 2.700 3.822 0.002 7 0 "[ . 1 . 2]" 1
10 1 11 SER HA 1 106 TYR QE . . 4.490 4.061 3.454 4.494 0.004 16 0 "[ . 1 . 2]" 1
11 1 11 SER QB 1 33 PHE QE . . 4.610 4.126 3.578 4.594 . 0 0 "[ . 1 . 2]" 1
12 1 11 SER QB 1 102 MET ME . . 3.420 2.745 2.173 3.268 . 0 0 "[ . 1 . 2]" 1
13 1 12 GLN H 1 12 GLN QG . . 4.350 3.938 2.702 4.086 . 0 0 "[ . 1 . 2]" 1
14 1 12 GLN HA 1 12 GLN QG . . 3.510 2.651 2.394 3.317 . 0 0 "[ . 1 . 2]" 1
15 1 12 GLN HA 1 15 LEU H . . 4.050 3.677 3.411 3.875 . 0 0 "[ . 1 . 2]" 1
16 1 12 GLN HA 1 15 LEU HB2 . . 4.390 3.384 3.004 3.865 . 0 0 "[ . 1 . 2]" 1
17 1 12 GLN HA 1 15 LEU HB3 . . 4.390 2.916 2.484 3.639 . 0 0 "[ . 1 . 2]" 1
18 1 12 GLN HA 1 15 LEU MD2 . . 4.400 3.434 2.817 4.217 . 0 0 "[ . 1 . 2]" 1
19 1 12 GLN QB 1 12 GLN QE . . 3.860 3.435 2.919 3.689 . 0 0 "[ . 1 . 2]" 1
20 1 12 GLN QB 1 12 GLN HE22 . . 4.450 4.078 3.743 4.364 . 0 0 "[ . 1 . 2]" 1
21 1 12 GLN QE 1 16 VAL MG1 . . 4.300 4.009 3.380 4.267 . 0 0 "[ . 1 . 2]" 1
22 1 12 GLN QG 1 16 VAL MG1 . . 4.440 4.350 4.058 4.444 0.004 17 0 "[ . 1 . 2]" 1
23 1 12 GLN QG 1 16 VAL MG2 . . 4.040 2.092 1.843 2.389 . 0 0 "[ . 1 . 2]" 1
24 1 13 SER HA 1 16 VAL MG2 . . 3.990 3.034 2.653 3.358 . 0 0 "[ . 1 . 2]" 1
25 1 13 SER QB 1 16 VAL HB . . 5.340 4.736 4.055 5.255 . 0 0 "[ . 1 . 2]" 1
26 1 13 SER QB 1 16 VAL MG2 . . 4.830 4.658 4.281 4.835 0.005 17 0 "[ . 1 . 2]" 1
27 1 13 SER HB2 1 16 VAL MG2 . . 5.500 5.272 4.924 5.507 0.007 17 0 "[ . 1 . 2]" 1
28 1 13 SER HB3 1 16 VAL MG2 . . 5.500 5.202 4.703 5.480 . 0 0 "[ . 1 . 2]" 1
29 1 14 LEU H 1 14 LEU MD2 . . 4.690 4.161 4.073 4.242 . 0 0 "[ . 1 . 2]" 1
30 1 14 LEU H 1 15 LEU H . . 4.190 2.930 2.727 3.132 . 0 0 "[ . 1 . 2]" 1
31 1 14 LEU HA 1 14 LEU MD1 . . 3.270 2.291 2.026 2.520 . 0 0 "[ . 1 . 2]" 1
32 1 14 LEU HA 1 14 LEU MD2 . . 4.160 3.926 3.804 3.999 . 0 0 "[ . 1 . 2]" 1
33 1 14 LEU HA 1 14 LEU HG . . 4.110 3.134 2.894 3.294 . 0 0 "[ . 1 . 2]" 1
34 1 14 LEU QB 1 14 LEU MD1 . . 3.140 2.202 2.122 2.302 . 0 0 "[ . 1 . 2]" 1
35 1 14 LEU QB 1 15 LEU H . . 3.890 2.183 1.934 2.516 . 0 0 "[ . 1 . 2]" 1
36 1 14 LEU QB 1 33 PHE HZ . . 4.330 3.023 2.213 3.645 . 0 0 "[ . 1 . 2]" 1
37 1 14 LEU QB 1 106 TYR QD . . 4.530 3.578 3.186 4.066 . 0 0 "[ . 1 . 2]" 1
38 1 14 LEU QB 1 106 TYR QE . . 3.550 2.517 2.130 3.125 . 0 0 "[ . 1 . 2]" 1
39 1 14 LEU HB2 1 15 LEU H . . 4.530 3.653 3.461 3.925 . 0 0 "[ . 1 . 2]" 1
40 1 14 LEU HB2 1 106 TYR QE . . 4.400 2.564 2.164 3.220 . 0 0 "[ . 1 . 2]" 1
41 1 14 LEU HB3 1 15 LEU H . . 4.530 2.201 1.944 2.547 . 0 0 "[ . 1 . 2]" 1
42 1 14 LEU HB3 1 106 TYR QE . . 4.400 3.728 3.166 4.222 . 0 0 "[ . 1 . 2]" 1
43 1 14 LEU MD1 1 15 LEU H . . 4.720 4.253 4.038 4.535 . 0 0 "[ . 1 . 2]" 1
44 1 14 LEU MD1 1 17 TRP H . . 4.790 4.555 4.329 4.801 0.011 17 0 "[ . 1 . 2]" 1
45 1 14 LEU MD1 1 17 TRP HE3 . . 3.750 3.222 2.536 3.492 . 0 0 "[ . 1 . 2]" 1
46 1 14 LEU MD1 1 18 CYS H . . 4.240 4.052 3.753 4.240 . 0 0 "[ . 1 . 2]" 1
47 1 14 LEU MD1 1 33 PHE HZ . . 4.710 4.045 3.692 4.506 . 0 0 "[ . 1 . 2]" 1
48 1 14 LEU MD1 1 102 MET ME . . 4.650 4.528 4.208 4.652 0.002 20 0 "[ . 1 . 2]" 1
49 1 14 LEU MD1 1 105 LEU H . . 5.070 4.986 4.594 5.061 . 0 0 "[ . 1 . 2]" 1
50 1 14 LEU MD1 1 105 LEU HA . . 4.670 4.175 3.960 4.376 . 0 0 "[ . 1 . 2]" 1
51 1 14 LEU MD1 1 105 LEU HB2 . . 3.410 3.208 2.694 3.377 . 0 0 "[ . 1 . 2]" 1
52 1 14 LEU MD1 1 105 LEU HB3 . . 4.230 2.031 1.928 2.275 . 0 0 "[ . 1 . 2]" 1
53 1 14 LEU MD1 1 105 LEU MD1 . . 4.270 3.065 2.559 3.545 . 0 0 "[ . 1 . 2]" 1
54 1 14 LEU MD1 1 106 TYR H . . 4.190 3.431 3.070 3.783 . 0 0 "[ . 1 . 2]" 1
55 1 14 LEU MD1 1 106 TYR HA . . 3.580 2.818 2.421 3.234 . 0 0 "[ . 1 . 2]" 1
56 1 14 LEU MD1 1 106 TYR QD . . 3.770 3.015 2.382 3.713 . 0 0 "[ . 1 . 2]" 1
57 1 14 LEU MD1 1 106 TYR QE . . 4.350 3.497 2.931 3.981 . 0 0 "[ . 1 . 2]" 1
58 1 14 LEU MD1 1 109 ARG H . . 4.450 4.024 3.514 4.334 . 0 0 "[ . 1 . 2]" 1
59 1 14 LEU MD1 1 109 ARG HB3 . . 4.610 2.933 2.602 3.216 . 0 0 "[ . 1 . 2]" 1
60 1 14 LEU MD1 1 109 ARG QD . . 3.710 2.501 1.803 3.699 . 0 0 "[ . 1 . 2]" 1
61 1 14 LEU MD2 1 15 LEU H . . 4.620 3.679 3.356 4.093 . 0 0 "[ . 1 . 2]" 1
62 1 14 LEU MD2 1 33 PHE HB3 . . 5.060 4.763 4.548 4.979 . 0 0 "[ . 1 . 2]" 1
63 1 14 LEU MD2 1 33 PHE QD . . 3.760 3.525 3.274 3.746 . 0 0 "[ . 1 . 2]" 1
64 1 14 LEU MD2 1 33 PHE QE . . 3.840 2.529 1.992 2.852 . 0 0 "[ . 1 . 2]" 1
65 1 14 LEU MD2 1 33 PHE HZ . . 4.210 2.751 2.373 3.193 . 0 0 "[ . 1 . 2]" 1
66 1 14 LEU MD2 1 102 MET HA . . 3.770 3.007 2.492 3.434 . 0 0 "[ . 1 . 2]" 1
67 1 14 LEU MD2 1 102 MET HB3 . . 4.630 3.440 3.082 3.961 . 0 0 "[ . 1 . 2]" 1
68 1 14 LEU MD2 1 102 MET ME . . 3.300 2.247 1.963 2.395 . 0 0 "[ . 1 . 2]" 1
69 1 14 LEU MD2 1 102 MET HG2 . . 4.470 2.944 2.674 4.114 . 0 0 "[ . 1 . 2]" 1
70 1 14 LEU MD2 1 102 MET QG . . 3.850 2.885 2.642 3.702 . 0 0 "[ . 1 . 2]" 1
71 1 14 LEU MD2 1 102 MET HG3 . . 4.470 4.317 4.103 4.472 0.002 15 0 "[ . 1 . 2]" 1
72 1 14 LEU MD2 1 105 LEU H . . 5.190 4.675 4.149 5.020 . 0 0 "[ . 1 . 2]" 1
73 1 14 LEU MD2 1 105 LEU HB3 . . 3.790 2.815 2.267 3.252 . 0 0 "[ . 1 . 2]" 1
74 1 14 LEU MD2 1 106 TYR H . . 3.820 3.305 2.745 3.663 . 0 0 "[ . 1 . 2]" 1
75 1 14 LEU MD2 1 106 TYR HA . . 4.250 3.750 3.379 4.172 . 0 0 "[ . 1 . 2]" 1
76 1 14 LEU MD2 1 106 TYR QB . . 4.480 4.319 3.913 4.482 0.002 15 0 "[ . 1 . 2]" 1
77 1 14 LEU MD2 1 106 TYR QD . . 4.020 3.384 2.613 3.596 . 0 0 "[ . 1 . 2]" 1
78 1 14 LEU MD2 1 106 TYR QE . . 3.940 3.025 2.043 3.343 . 0 0 "[ . 1 . 2]" 1
79 1 14 LEU HG 1 15 LEU H . . 4.300 3.210 2.719 3.839 . 0 0 "[ . 1 . 2]" 1
80 1 14 LEU HG 1 15 LEU HA . . 4.380 3.422 2.982 4.105 . 0 0 "[ . 1 . 2]" 1
81 1 14 LEU HG 1 17 TRP H . . 5.350 5.188 4.839 5.367 0.017 17 0 "[ . 1 . 2]" 1
82 1 14 LEU HG 1 18 CYS H . . 4.890 4.548 4.121 4.891 0.001 14 0 "[ . 1 . 2]" 1
83 1 14 LEU HG 1 33 PHE QE . . 4.320 2.785 2.335 3.094 . 0 0 "[ . 1 . 2]" 1
84 1 14 LEU HG 1 33 PHE HZ . . 4.110 2.446 1.999 3.038 . 0 0 "[ . 1 . 2]" 1
85 1 15 LEU H 1 15 LEU HB2 . . 3.510 2.273 2.183 2.411 . 0 0 "[ . 1 . 2]" 1
86 1 15 LEU H 1 15 LEU HB3 . . 3.510 2.811 2.606 2.910 . 0 0 "[ . 1 . 2]" 1
87 1 15 LEU H 1 15 LEU MD1 . . 4.290 3.768 3.595 3.955 . 0 0 "[ . 1 . 2]" 1
88 1 15 LEU H 1 15 LEU MD2 . . 4.620 4.307 4.202 4.365 . 0 0 "[ . 1 . 2]" 1
89 1 15 LEU H 1 15 LEU HG . . 4.770 4.489 4.456 4.506 . 0 0 "[ . 1 . 2]" 1
90 1 15 LEU H 1 16 VAL H . . 3.800 2.902 2.727 3.311 . 0 0 "[ . 1 . 2]" 1
91 1 15 LEU H 1 16 VAL MG2 . . 4.850 4.358 4.070 4.571 . 0 0 "[ . 1 . 2]" 1
92 1 15 LEU H 1 33 PHE QE . . 4.360 3.585 3.104 3.882 . 0 0 "[ . 1 . 2]" 1
93 1 15 LEU H 1 33 PHE HZ . . 3.840 2.638 2.127 3.218 . 0 0 "[ . 1 . 2]" 1
94 1 15 LEU HA 1 15 LEU MD1 . . 3.200 2.402 2.157 2.535 . 0 0 "[ . 1 . 2]" 1
95 1 15 LEU HA 1 15 LEU MD2 . . 4.230 3.865 3.817 3.921 . 0 0 "[ . 1 . 2]" 1
96 1 15 LEU HA 1 15 LEU HG . . 3.870 2.680 2.552 2.940 . 0 0 "[ . 1 . 2]" 1
97 1 15 LEU HA 1 16 VAL MG2 . . 5.500 4.796 4.646 4.973 . 0 0 "[ . 1 . 2]" 1
98 1 15 LEU HA 1 18 CYS H . . 4.320 4.025 3.736 4.228 . 0 0 "[ . 1 . 2]" 1
99 1 15 LEU HA 1 33 PHE QE . . 4.240 3.335 3.017 3.709 . 0 0 "[ . 1 . 2]" 1
100 1 15 LEU HA 1 33 PHE HZ . . 3.900 2.216 1.999 2.650 . 0 0 "[ . 1 . 2]" 1
101 1 15 LEU QB 1 15 LEU MD1 . . 3.170 2.153 2.046 2.241 . 0 0 "[ . 1 . 2]" 1
102 1 15 LEU QB 1 16 VAL H . . 3.540 2.633 1.993 2.982 . 0 0 "[ . 1 . 2]" 1
103 1 15 LEU QB 1 16 VAL MG2 . . 3.760 2.923 2.796 3.127 . 0 0 "[ . 1 . 2]" 1
104 1 15 LEU QB 1 33 PHE QE . . 4.250 2.639 2.343 2.946 . 0 0 "[ . 1 . 2]" 1
105 1 15 LEU QB 1 33 PHE HZ . . 3.850 2.743 2.486 3.068 . 0 0 "[ . 1 . 2]" 1
106 1 15 LEU HB2 1 15 LEU MD2 . . 3.390 2.628 2.544 2.727 . 0 0 "[ . 1 . 2]" 1
107 1 15 LEU HB2 1 16 VAL H . . 4.160 3.788 3.503 3.906 . 0 0 "[ . 1 . 2]" 1
108 1 15 LEU HB2 1 33 PHE HZ . . 4.550 2.783 2.515 3.125 . 0 0 "[ . 1 . 2]" 1
109 1 15 LEU HB3 1 15 LEU MD2 . . 3.390 2.083 1.977 2.198 . 0 0 "[ . 1 . 2]" 1
110 1 15 LEU HB3 1 16 VAL H . . 4.160 2.691 2.004 3.094 . 0 0 "[ . 1 . 2]" 1
111 1 15 LEU HB3 1 33 PHE HZ . . 4.550 4.162 3.899 4.548 . 0 0 "[ . 1 . 2]" 1
112 1 15 LEU MD1 1 16 VAL MG2 . . 5.230 5.046 4.865 5.151 . 0 0 "[ . 1 . 2]" 1
113 1 15 LEU MD1 1 19 LYS QD . . 3.610 3.403 3.031 3.617 0.007 17 0 "[ . 1 . 2]" 1
114 1 15 LEU MD1 1 19 LYS QE . . 4.870 4.506 2.874 4.868 . 0 0 "[ . 1 . 2]" 1
115 1 15 LEU MD1 1 30 ILE MG . . 2.810 1.944 1.666 2.213 . 0 0 "[ . 1 . 2]" 1
116 1 15 LEU MD1 1 31 THR H . . 5.020 4.744 4.378 5.012 . 0 0 "[ . 1 . 2]" 1
117 1 15 LEU MD1 1 31 THR HA . . 4.430 3.774 3.510 4.120 . 0 0 "[ . 1 . 2]" 1
118 1 15 LEU MD1 1 32 ASN H . . 4.400 4.144 3.777 4.401 0.001 9 0 "[ . 1 . 2]" 1
119 1 15 LEU MD1 1 32 ASN HA . . 4.860 3.701 3.365 4.075 . 0 0 "[ . 1 . 2]" 1
120 1 15 LEU MD1 1 33 PHE QE . . 3.920 2.349 1.974 2.873 . 0 0 "[ . 1 . 2]" 1
121 1 15 LEU MD1 1 33 PHE HZ . . 3.900 2.606 2.289 3.163 . 0 0 "[ . 1 . 2]" 1
122 1 15 LEU MD1 1 36 SER QB . . 5.500 4.973 4.509 5.328 . 0 0 "[ . 1 . 2]" 1
123 1 15 LEU MD1 1 37 TRP HE1 . . 4.770 4.150 3.778 4.578 . 0 0 "[ . 1 . 2]" 1
124 1 15 LEU MD2 1 16 VAL H . . 4.650 4.203 3.183 4.614 . 0 0 "[ . 1 . 2]" 1
125 1 15 LEU MD2 1 16 VAL MG2 . . 4.150 3.452 2.907 3.683 . 0 0 "[ . 1 . 2]" 1
126 1 15 LEU MD2 1 19 LYS QD . . 3.810 2.640 2.227 3.263 . 0 0 "[ . 1 . 2]" 1
127 1 15 LEU MD2 1 19 LYS QE . . 3.700 3.256 1.832 3.701 0.001 4 0 "[ . 1 . 2]" 1
128 1 15 LEU MD2 1 31 THR HA . . 4.420 4.148 3.744 4.420 . 0 0 "[ . 1 . 2]" 1
129 1 15 LEU MD2 1 33 PHE QE . . 4.540 4.091 3.697 4.533 . 0 0 "[ . 1 . 2]" 1
130 1 15 LEU MD2 1 33 PHE HZ . . 5.020 4.717 4.500 4.989 . 0 0 "[ . 1 . 2]" 1
131 1 15 LEU HG 1 16 VAL H . . 4.820 4.296 3.610 4.669 . 0 0 "[ . 1 . 2]" 1
132 1 15 LEU HG 1 16 VAL HA . . 4.840 4.351 3.915 4.713 . 0 0 "[ . 1 . 2]" 1
133 1 15 LEU HG 1 16 VAL MG2 . . 4.670 4.348 3.919 4.605 . 0 0 "[ . 1 . 2]" 1
134 1 15 LEU HG 1 19 LYS QE . . 4.200 3.799 2.386 4.164 . 0 0 "[ . 1 . 2]" 1
135 1 15 LEU HG 1 33 PHE HZ . . 5.150 4.356 4.097 4.832 . 0 0 "[ . 1 . 2]" 1
136 1 16 VAL H 1 16 VAL HB . . 3.320 2.553 2.488 2.768 . 0 0 "[ . 1 . 2]" 1
137 1 16 VAL H 1 16 VAL MG1 . . 3.960 3.776 3.750 3.804 . 0 0 "[ . 1 . 2]" 1
138 1 16 VAL H 1 16 VAL MG2 . . 3.190 2.293 1.991 2.465 . 0 0 "[ . 1 . 2]" 1
139 1 16 VAL H 1 17 TRP H . . 3.600 2.553 2.251 3.094 . 0 0 "[ . 1 . 2]" 1
140 1 16 VAL H 1 19 LYS QD . . 4.880 4.340 3.944 4.909 0.029 17 0 "[ . 1 . 2]" 1
141 1 16 VAL HA 1 16 VAL MG1 . . 3.240 2.351 2.228 2.453 . 0 0 "[ . 1 . 2]" 1
142 1 16 VAL HA 1 16 VAL MG2 . . 3.030 2.390 2.299 2.486 . 0 0 "[ . 1 . 2]" 1
143 1 16 VAL HA 1 19 LYS H . . 4.530 3.493 3.084 3.795 . 0 0 "[ . 1 . 2]" 1
144 1 16 VAL HA 1 19 LYS QB . . 3.610 2.501 2.167 2.731 . 0 0 "[ . 1 . 2]" 1
145 1 16 VAL HA 1 19 LYS QD . . 3.600 2.616 2.110 3.531 . 0 0 "[ . 1 . 2]" 1
146 1 16 VAL HA 1 19 LYS QG . . 4.990 3.772 2.360 4.208 . 0 0 "[ . 1 . 2]" 1
147 1 16 VAL HB 1 17 TRP H . . 3.530 2.501 2.154 2.958 . 0 0 "[ . 1 . 2]" 1
148 1 16 VAL HB 1 17 TRP HA . . 4.530 4.123 3.971 4.296 . 0 0 "[ . 1 . 2]" 1
149 1 16 VAL HB 1 17 TRP HB2 . . 4.600 4.369 4.252 4.577 . 0 0 "[ . 1 . 2]" 1
150 1 16 VAL HB 1 18 CYS H . . 5.460 5.105 4.766 5.290 . 0 0 "[ . 1 . 2]" 1
151 1 16 VAL MG1 1 17 TRP H . . 3.940 3.446 3.180 3.733 . 0 0 "[ . 1 . 2]" 1
152 1 16 VAL MG1 1 17 TRP HA . . 4.100 3.593 3.343 3.837 . 0 0 "[ . 1 . 2]" 1
153 1 16 VAL MG1 1 19 LYS H . . 4.960 4.650 4.273 4.951 . 0 0 "[ . 1 . 2]" 1
154 1 16 VAL MG1 1 19 LYS QD . . 4.530 4.071 3.329 4.496 . 0 0 "[ . 1 . 2]" 1
155 1 16 VAL MG1 1 20 GLU H . . 4.780 3.717 3.268 4.209 . 0 0 "[ . 1 . 2]" 1
156 1 16 VAL MG1 1 20 GLU HB3 . . 4.470 4.200 3.860 4.468 . 0 0 "[ . 1 . 2]" 1
157 1 16 VAL MG1 1 20 GLU QG . . 3.990 3.820 3.525 3.992 0.002 17 0 "[ . 1 . 2]" 1
158 1 16 VAL MG2 1 17 TRP H . . 4.020 3.763 3.567 3.952 . 0 0 "[ . 1 . 2]" 1
159 1 16 VAL MG2 1 17 TRP HA . . 5.500 5.354 5.290 5.422 . 0 0 "[ . 1 . 2]" 1
160 1 16 VAL MG2 1 18 CYS H . . 5.500 5.428 5.176 5.504 0.004 14 0 "[ . 1 . 2]" 1
161 1 16 VAL MG2 1 19 LYS QD . . 4.080 3.530 2.971 4.136 0.056 17 0 "[ . 1 . 2]" 1
162 1 17 TRP H 1 17 TRP HB2 . . 3.390 2.426 2.314 2.552 . 0 0 "[ . 1 . 2]" 1
163 1 17 TRP H 1 17 TRP HB3 . . 3.420 2.687 2.535 2.872 . 0 0 "[ . 1 . 2]" 1
164 1 17 TRP H 1 18 CYS H . . 3.500 2.931 2.584 3.128 . 0 0 "[ . 1 . 2]" 1
165 1 17 TRP HA 1 17 TRP HD1 . . 3.900 3.044 2.839 3.257 . 0 0 "[ . 1 . 2]" 1
166 1 17 TRP HA 1 17 TRP HE1 . . 5.150 4.988 4.844 5.112 . 0 0 "[ . 1 . 2]" 1
167 1 17 TRP HA 1 20 GLU H . . 4.090 3.816 3.504 4.066 . 0 0 "[ . 1 . 2]" 1
168 1 17 TRP HA 1 20 GLU HB2 . . 3.970 3.220 2.785 3.580 . 0 0 "[ . 1 . 2]" 1
169 1 17 TRP HA 1 20 GLU HB3 . . 4.030 3.247 2.852 3.625 . 0 0 "[ . 1 . 2]" 1
170 1 17 TRP HA 1 20 GLU QG . . 4.720 4.535 4.166 4.720 0.000 10 0 "[ . 1 . 2]" 1
171 1 17 TRP HA 1 21 VAL H . . 4.730 4.326 4.027 4.732 0.002 14 0 "[ . 1 . 2]" 1
172 1 17 TRP HA 1 21 VAL MG1 . . 4.660 3.945 3.673 4.201 . 0 0 "[ . 1 . 2]" 1
173 1 17 TRP HB2 1 18 CYS H . . 3.860 3.780 3.626 3.884 0.024 17 0 "[ . 1 . 2]" 1
174 1 17 TRP HB3 1 17 TRP HE3 . . 3.940 2.510 2.445 2.596 . 0 0 "[ . 1 . 2]" 1
175 1 17 TRP HB3 1 18 CYS H . . 3.320 2.469 2.310 2.669 . 0 0 "[ . 1 . 2]" 1
176 1 17 TRP HD1 1 109 ARG HB2 . . 5.090 5.071 4.972 5.097 0.007 16 0 "[ . 1 . 2]" 1
177 1 17 TRP HD1 1 109 ARG QD . . 5.120 4.593 3.767 5.122 0.002 16 0 "[ . 1 . 2]" 1
178 1 17 TRP HE1 1 21 VAL MG1 . . 4.250 4.033 3.128 4.269 0.019 17 0 "[ . 1 . 2]" 1
179 1 17 TRP HE1 1 50 PHE QE . . 5.380 4.847 4.122 5.380 . 18 0 "[ . 1 . 2]" 1
180 1 17 TRP HE1 1 109 ARG HG2 . . 4.640 3.845 3.092 4.591 . 0 0 "[ . 1 . 2]" 1
181 1 17 TRP HE1 1 109 ARG QG . . 4.070 3.225 3.007 3.577 . 0 0 "[ . 1 . 2]" 1
182 1 17 TRP HE1 1 109 ARG HG3 . . 4.640 3.789 3.084 4.615 . 0 0 "[ . 1 . 2]" 1
183 1 17 TRP HE1 1 112 PHE HB2 . . 4.350 3.831 3.295 4.297 . 0 0 "[ . 1 . 2]" 1
184 1 17 TRP HE3 1 18 CYS H . . 3.670 3.073 2.704 3.429 . 0 0 "[ . 1 . 2]" 1
185 1 17 TRP HE3 1 18 CYS HA . . 4.090 2.966 2.477 3.296 . 0 0 "[ . 1 . 2]" 1
186 1 17 TRP HE3 1 18 CYS QB . . 3.880 3.169 2.733 3.858 . 0 0 "[ . 1 . 2]" 1
187 1 17 TRP HE3 1 105 LEU MD2 . . 4.490 4.050 3.635 4.451 . 0 0 "[ . 1 . 2]" 1
188 1 17 TRP HH2 1 21 VAL MG1 . . 4.580 4.270 3.721 4.588 0.008 17 0 "[ . 1 . 2]" 1
189 1 17 TRP HH2 1 21 VAL MG2 . . 4.710 4.415 3.941 4.701 . 0 0 "[ . 1 . 2]" 1
190 1 17 TRP HH2 1 46 ILE MD . . 3.910 3.607 2.847 3.911 0.001 8 0 "[ . 1 . 2]" 1
191 1 17 TRP HH2 1 46 ILE MG . . 3.540 2.119 1.956 2.379 . 0 0 "[ . 1 . 2]" 1
192 1 17 TRP HH2 1 50 PHE QE . . 4.170 3.149 2.693 3.857 . 0 0 "[ . 1 . 2]" 1
193 1 17 TRP HH2 1 108 ILE MG . . 3.800 2.136 1.901 2.424 . 0 0 "[ . 1 . 2]" 1
194 1 17 TRP HH2 1 109 ARG HA . . 4.310 3.242 3.021 3.714 . 0 0 "[ . 1 . 2]" 1
195 1 17 TRP HZ2 1 21 VAL MG1 . . 4.470 3.886 3.460 4.205 . 0 0 "[ . 1 . 2]" 1
196 1 17 TRP HZ2 1 21 VAL MG2 . . 5.500 5.095 4.385 5.403 . 0 0 "[ . 1 . 2]" 1
197 1 17 TRP HZ2 1 46 ILE MG . . 4.740 3.758 3.140 4.090 . 0 0 "[ . 1 . 2]" 1
198 1 17 TRP HZ2 1 50 PHE QE . . 3.940 3.503 3.059 3.934 . 0 0 "[ . 1 . 2]" 1
199 1 17 TRP HZ2 1 108 ILE MG . . 4.050 3.630 3.038 3.937 . 0 0 "[ . 1 . 2]" 1
200 1 17 TRP HZ2 1 109 ARG HA . . 4.260 2.753 2.380 3.139 . 0 0 "[ . 1 . 2]" 1
201 1 17 TRP HZ2 1 109 ARG HB2 . . 5.500 4.544 3.702 5.027 . 0 0 "[ . 1 . 2]" 1
202 1 17 TRP HZ2 1 112 PHE HB2 . . 4.450 2.327 2.001 3.213 . 0 0 "[ . 1 . 2]" 1
203 1 17 TRP HZ2 1 112 PHE HB3 . . 4.580 3.283 2.310 4.396 . 0 0 "[ . 1 . 2]" 1
204 1 17 TRP HZ2 1 112 PHE QD . . 4.610 2.936 2.252 3.587 . 0 0 "[ . 1 . 2]" 1
205 1 17 TRP HZ3 1 46 ILE MD . . 3.720 1.986 1.875 2.086 . 0 0 "[ . 1 . 2]" 1
206 1 17 TRP HZ3 1 46 ILE HG12 . . 4.830 3.226 2.741 3.900 . 0 0 "[ . 1 . 2]" 1
207 1 17 TRP HZ3 1 105 LEU MD2 . . 4.060 3.568 2.720 4.058 . 0 0 "[ . 1 . 2]" 1
208 1 17 TRP HZ3 1 108 ILE MG . . 4.620 2.977 2.343 3.649 . 0 0 "[ . 1 . 2]" 1
209 1 17 TRP HZ3 1 109 ARG H . . 4.700 4.325 3.947 4.665 . 0 0 "[ . 1 . 2]" 1
210 1 18 CYS H 1 18 CYS HB2 . . 3.740 2.889 2.331 3.595 . 0 0 "[ . 1 . 2]" 1
211 1 18 CYS H 1 18 CYS QB . . 2.870 2.498 2.211 2.759 . 0 0 "[ . 1 . 2]" 1
212 1 18 CYS H 1 18 CYS HB3 . . 3.740 2.939 2.480 3.601 . 0 0 "[ . 1 . 2]" 1
213 1 18 CYS H 1 19 LYS H . . 3.610 2.738 2.502 3.002 . 0 0 "[ . 1 . 2]" 1
214 1 18 CYS H 1 21 VAL MG1 . . 4.870 4.761 4.578 4.874 0.004 9 0 "[ . 1 . 2]" 1
215 1 18 CYS H 1 21 VAL MG2 . . 5.470 4.720 4.419 5.036 . 0 0 "[ . 1 . 2]" 1
216 1 18 CYS H 1 30 ILE MD . . 5.500 4.828 4.190 5.078 . 0 0 "[ . 1 . 2]" 1
217 1 18 CYS H 1 33 PHE HZ . . 5.500 5.437 5.208 5.505 0.005 15 0 "[ . 1 . 2]" 1
218 1 18 CYS HA 1 20 GLU H . . 4.660 3.949 3.685 4.403 . 0 0 "[ . 1 . 2]" 1
219 1 18 CYS HA 1 21 VAL H . . 4.370 3.636 3.327 4.021 . 0 0 "[ . 1 . 2]" 1
220 1 18 CYS HA 1 21 VAL HB . . 5.500 5.211 5.025 5.461 . 0 0 "[ . 1 . 2]" 1
221 1 18 CYS HA 1 21 VAL MG1 . . 3.580 3.210 2.847 3.458 . 0 0 "[ . 1 . 2]" 1
222 1 18 CYS HA 1 22 THR MG . . 4.580 3.573 3.204 4.165 . 0 0 "[ . 1 . 2]" 1
223 1 18 CYS HA 1 30 ILE MD . . 4.410 4.241 4.035 4.409 . 0 0 "[ . 1 . 2]" 1
224 1 18 CYS HA 1 46 ILE MD . . 4.140 3.119 2.799 3.443 . 0 0 "[ . 1 . 2]" 1
225 1 18 CYS QB 1 19 LYS H . . 3.650 2.492 1.887 3.485 . 0 0 "[ . 1 . 2]" 1
226 1 18 CYS QB 1 21 VAL MG1 . . 5.340 4.817 4.551 5.085 . 0 0 "[ . 1 . 2]" 1
227 1 18 CYS QB 1 30 ILE MD . . 3.530 2.630 2.293 2.971 . 0 0 "[ . 1 . 2]" 1
228 1 18 CYS QB 1 30 ILE HG12 . . 3.600 2.508 2.058 2.816 . 0 0 "[ . 1 . 2]" 1
229 1 18 CYS QB 1 30 ILE HG13 . . 4.710 3.998 3.594 4.394 . 0 0 "[ . 1 . 2]" 1
230 1 18 CYS QB 1 30 ILE MG . . 3.670 3.231 2.837 3.590 . 0 0 "[ . 1 . 2]" 1
231 1 18 CYS QB 1 37 TRP HZ2 . . 3.660 3.149 2.852 3.568 . 0 0 "[ . 1 . 2]" 1
232 1 18 CYS QB 1 46 ILE MD . . 3.870 2.633 2.271 3.039 . 0 0 "[ . 1 . 2]" 1
233 1 18 CYS QB 1 46 ILE MG . . 5.090 4.843 4.305 5.090 0.000 4 0 "[ . 1 . 2]" 1
234 1 18 CYS QB 1 105 LEU MD1 . . 4.780 4.287 3.896 4.715 . 0 0 "[ . 1 . 2]" 1
235 1 18 CYS QB 1 105 LEU MD2 . . 4.360 3.633 3.076 4.117 . 0 0 "[ . 1 . 2]" 1
236 1 18 CYS HB2 1 19 LYS H . . 4.360 3.144 1.900 3.768 . 0 0 "[ . 1 . 2]" 1
237 1 18 CYS HB2 1 30 ILE HG12 . . 4.160 3.045 2.321 3.877 . 0 0 "[ . 1 . 2]" 1
238 1 18 CYS HB2 1 30 ILE MG . . 4.440 3.729 2.972 4.355 . 0 0 "[ . 1 . 2]" 1
239 1 18 CYS HB2 1 37 TRP HH2 . . 4.300 2.836 2.111 3.896 . 0 0 "[ . 1 . 2]" 1
240 1 18 CYS HB2 1 37 TRP HZ2 . . 4.180 3.556 3.276 4.031 . 0 0 "[ . 1 . 2]" 1
241 1 18 CYS HB2 1 46 ILE MD . . 4.430 3.237 2.543 4.384 . 0 0 "[ . 1 . 2]" 1
242 1 18 CYS HB3 1 19 LYS H . . 4.360 3.108 1.998 4.105 . 0 0 "[ . 1 . 2]" 1
243 1 18 CYS HB3 1 30 ILE HG12 . . 4.160 3.025 2.082 3.830 . 0 0 "[ . 1 . 2]" 1
244 1 18 CYS HB3 1 30 ILE MG . . 4.440 3.742 3.119 4.301 . 0 0 "[ . 1 . 2]" 1
245 1 18 CYS HB3 1 37 TRP HH2 . . 4.300 2.798 1.998 3.778 . 0 0 "[ . 1 . 2]" 1
246 1 18 CYS HB3 1 37 TRP HZ2 . . 4.180 3.530 3.136 3.980 . 0 0 "[ . 1 . 2]" 1
247 1 18 CYS HB3 1 46 ILE MD . . 4.430 3.217 2.369 4.195 . 0 0 "[ . 1 . 2]" 1
248 1 19 LYS H 1 19 LYS HB2 . . 3.970 2.509 2.318 2.713 . 0 0 "[ . 1 . 2]" 1
249 1 19 LYS H 1 19 LYS QB . . 3.360 2.462 2.290 2.636 . 0 0 "[ . 1 . 2]" 1
250 1 19 LYS H 1 19 LYS HB3 . . 3.970 3.589 3.560 3.613 . 0 0 "[ . 1 . 2]" 1
251 1 19 LYS H 1 19 LYS QD . . 4.010 3.470 3.208 4.039 0.029 17 0 "[ . 1 . 2]" 1
252 1 19 LYS H 1 19 LYS HG2 . . 3.930 3.574 2.822 3.885 . 0 0 "[ . 1 . 2]" 1
253 1 19 LYS H 1 19 LYS QG . . 3.420 2.182 1.932 2.542 . 0 0 "[ . 1 . 2]" 1
254 1 19 LYS H 1 19 LYS HG3 . . 3.930 2.203 1.949 2.577 . 0 0 "[ . 1 . 2]" 1
255 1 19 LYS H 1 20 GLU HB2 . . 5.000 4.796 4.549 4.983 . 0 0 "[ . 1 . 2]" 1
256 1 19 LYS H 1 21 VAL H . . 4.980 4.762 4.265 4.970 . 0 0 "[ . 1 . 2]" 1
257 1 19 LYS H 1 28 VAL MG1 . . 5.500 5.357 4.985 5.493 . 0 0 "[ . 1 . 2]" 1
258 1 19 LYS H 1 30 ILE MD . . 4.250 3.062 2.315 3.511 . 0 0 "[ . 1 . 2]" 1
259 1 19 LYS HA 1 19 LYS HG2 . . 3.610 2.710 2.607 2.848 . 0 0 "[ . 1 . 2]" 1
260 1 19 LYS HA 1 19 LYS HG3 . . 3.610 2.839 2.689 3.376 . 0 0 "[ . 1 . 2]" 1
261 1 19 LYS HA 1 21 VAL H . . 5.190 4.955 4.663 5.209 0.019 17 0 "[ . 1 . 2]" 1
262 1 19 LYS HA 1 22 THR H . . 4.220 3.599 3.408 3.882 . 0 0 "[ . 1 . 2]" 1
263 1 19 LYS HA 1 22 THR HB . . 4.670 4.435 4.257 4.633 . 0 0 "[ . 1 . 2]" 1
264 1 19 LYS HA 1 22 THR HG1 . . 3.680 2.119 1.999 2.311 . 0 0 "[ . 1 . 2]" 1
265 1 19 LYS HA 1 22 THR MG . . 4.250 4.007 3.802 4.250 0.000 3 0 "[ . 1 . 2]" 1
266 1 19 LYS HA 1 28 VAL MG1 . . 4.590 3.596 3.380 3.998 . 0 0 "[ . 1 . 2]" 1
267 1 19 LYS HA 1 30 ILE HB . . 4.680 4.312 4.009 4.682 0.002 15 0 "[ . 1 . 2]" 1
268 1 19 LYS HA 1 30 ILE MD . . 3.340 2.319 1.980 2.603 . 0 0 "[ . 1 . 2]" 1
269 1 19 LYS QB 1 19 LYS QE . . 3.280 2.643 2.204 3.339 0.059 19 0 "[ . 1 . 2]" 1
270 1 19 LYS QB 1 20 GLU H . . 3.480 2.885 2.531 3.095 . 0 0 "[ . 1 . 2]" 1
271 1 19 LYS QB 1 30 ILE MD . . 4.700 3.433 3.105 3.735 . 0 0 "[ . 1 . 2]" 1
272 1 19 LYS QD 1 20 GLU H . . 5.030 4.834 4.509 5.054 0.024 17 0 "[ . 1 . 2]" 1
273 1 19 LYS QD 1 30 ILE MD . . 4.690 3.646 3.200 3.961 . 0 0 "[ . 1 . 2]" 1
274 1 19 LYS QE 1 30 ILE MD . . 4.330 3.889 3.283 4.381 0.051 17 0 "[ . 1 . 2]" 1
275 1 19 LYS QG 1 20 GLU H . . 4.530 4.221 3.773 4.380 . 0 0 "[ . 1 . 2]" 1
276 1 19 LYS QG 1 30 ILE HB . . 3.950 2.153 1.932 2.714 . 0 0 "[ . 1 . 2]" 1
277 1 19 LYS QG 1 30 ILE MD . . 3.660 1.997 1.717 2.283 . 0 0 "[ . 1 . 2]" 1
278 1 19 LYS QG 1 30 ILE MG . . 3.790 3.183 2.831 3.694 . 0 0 "[ . 1 . 2]" 1
279 1 19 LYS HG2 1 30 ILE MD . . 4.470 2.173 1.910 2.543 . 0 0 "[ . 1 . 2]" 1
280 1 19 LYS HG3 1 30 ILE MD . . 4.470 2.385 1.835 2.860 . 0 0 "[ . 1 . 2]" 1
281 1 20 GLU H 1 20 GLU HB2 . . 3.180 2.353 2.186 2.616 . 0 0 "[ . 1 . 2]" 1
282 1 20 GLU H 1 20 GLU HB3 . . 3.630 2.763 2.527 2.928 . 0 0 "[ . 1 . 2]" 1
283 1 20 GLU H 1 20 GLU QG . . 4.210 3.979 3.832 4.099 . 0 0 "[ . 1 . 2]" 1
284 1 20 GLU H 1 21 VAL H . . 3.390 2.737 2.585 3.091 . 0 0 "[ . 1 . 2]" 1
285 1 20 GLU H 1 21 VAL MG1 . . 4.610 4.078 3.892 4.324 . 0 0 "[ . 1 . 2]" 1
286 1 20 GLU H 1 21 VAL MG2 . . 4.620 4.090 3.863 4.402 . 0 0 "[ . 1 . 2]" 1
287 1 20 GLU H 1 22 THR H . . 4.770 3.625 3.475 3.834 . 0 0 "[ . 1 . 2]" 1
288 1 20 GLU HA 1 20 GLU QG . . 3.510 2.416 2.173 2.886 . 0 0 "[ . 1 . 2]" 1
289 1 20 GLU HA 1 22 THR H . . 4.530 4.014 3.861 4.147 . 0 0 "[ . 1 . 2]" 1
290 1 20 GLU HA 1 23 LYS H . . 4.310 3.905 3.569 4.210 . 0 0 "[ . 1 . 2]" 1
291 1 20 GLU HA 1 23 LYS QD . . 4.160 3.185 2.241 4.083 . 0 0 "[ . 1 . 2]" 1
292 1 20 GLU HA 1 23 LYS QE . . 5.160 4.354 2.183 5.165 0.005 15 0 "[ . 1 . 2]" 1
293 1 20 GLU HB2 1 21 VAL H . . 3.750 3.451 3.242 3.733 . 0 0 "[ . 1 . 2]" 1
294 1 20 GLU HB3 1 21 VAL H . . 3.590 2.173 1.909 2.392 . 0 0 "[ . 1 . 2]" 1
295 1 20 GLU HB3 1 21 VAL MG1 . . 4.350 2.698 2.525 2.937 . 0 0 "[ . 1 . 2]" 1
296 1 20 GLU HB3 1 21 VAL MG2 . . 4.610 4.301 4.144 4.469 . 0 0 "[ . 1 . 2]" 1
297 1 20 GLU QG 1 21 VAL H . . 4.080 3.705 3.409 3.965 . 0 0 "[ . 1 . 2]" 1
298 1 20 GLU QG 1 21 VAL MG1 . . 4.220 3.764 3.450 4.137 . 0 0 "[ . 1 . 2]" 1
299 1 20 GLU QG 1 23 LYS QD . . 4.330 3.309 2.243 4.328 . 0 0 "[ . 1 . 2]" 1
300 1 21 VAL H 1 21 VAL HB . . 3.680 3.595 3.555 3.624 . 0 0 "[ . 1 . 2]" 1
301 1 21 VAL H 1 21 VAL MG1 . . 3.140 1.998 1.825 2.213 . 0 0 "[ . 1 . 2]" 1
302 1 21 VAL H 1 21 VAL MG2 . . 3.380 2.478 2.318 2.698 . 0 0 "[ . 1 . 2]" 1
303 1 21 VAL H 1 22 THR H . . 3.490 2.626 2.440 2.781 . 0 0 "[ . 1 . 2]" 1
304 1 21 VAL H 1 22 THR HG1 . . 4.460 4.124 3.808 4.469 0.009 20 0 "[ . 1 . 2]" 1
305 1 21 VAL H 1 22 THR MG . . 4.590 4.152 3.898 4.486 . 0 0 "[ . 1 . 2]" 1
306 1 21 VAL H 1 23 LYS H . . 4.440 4.315 4.141 4.436 . 0 0 "[ . 1 . 2]" 1
307 1 21 VAL HA 1 21 VAL MG1 . . 3.510 2.474 2.352 2.536 . 0 0 "[ . 1 . 2]" 1
308 1 21 VAL HA 1 21 VAL MG2 . . 3.290 3.176 3.165 3.187 . 0 0 "[ . 1 . 2]" 1
309 1 21 VAL HA 1 22 THR MG . . 4.890 4.590 4.440 4.745 . 0 0 "[ . 1 . 2]" 1
310 1 21 VAL HA 1 23 LYS H . . 4.410 3.718 3.521 3.873 . 0 0 "[ . 1 . 2]" 1
311 1 21 VAL HB 1 22 THR H . . 4.480 4.172 4.033 4.331 . 0 0 "[ . 1 . 2]" 1
312 1 21 VAL HB 1 49 HIS HD2 . . 4.570 2.255 2.001 2.577 . 0 0 "[ . 1 . 2]" 1
313 1 21 VAL HB 1 50 PHE QE . . 4.720 4.134 3.395 4.720 . 14 0 "[ . 1 . 2]" 1
314 1 21 VAL MG1 1 22 THR H . . 3.910 3.824 3.703 3.936 0.026 5 0 "[ . 1 . 2]" 1
315 1 21 VAL MG1 1 22 THR MG . . 4.140 4.103 3.968 4.242 0.102 9 0 "[ . 1 . 2]" 1
316 1 21 VAL MG1 1 23 LYS H . . 5.140 5.129 5.058 5.166 0.026 14 0 "[ . 1 . 2]" 1
317 1 21 VAL MG1 1 46 ILE HA . . 4.260 4.138 3.914 4.263 0.003 4 0 "[ . 1 . 2]" 1
318 1 21 VAL MG1 1 46 ILE MD . . 4.670 4.419 4.238 4.546 . 0 0 "[ . 1 . 2]" 1
319 1 21 VAL MG1 1 46 ILE HG12 . . 3.680 3.604 3.478 3.697 0.017 16 0 "[ . 1 . 2]" 1
320 1 21 VAL MG1 1 46 ILE HG13 . . 5.310 4.973 4.758 5.127 . 0 0 "[ . 1 . 2]" 1
321 1 21 VAL MG1 1 46 ILE MG . . 3.600 3.232 2.923 3.604 0.004 20 0 "[ . 1 . 2]" 1
322 1 21 VAL MG1 1 49 HIS HB2 . . 4.670 4.331 4.030 4.584 . 0 0 "[ . 1 . 2]" 1
323 1 21 VAL MG1 1 50 PHE QE . . 3.880 3.361 2.642 3.797 . 0 0 "[ . 1 . 2]" 1
324 1 21 VAL MG1 1 50 PHE HZ . . 4.010 2.908 2.348 3.525 . 0 0 "[ . 1 . 2]" 1
325 1 21 VAL MG2 1 22 THR H . . 4.230 2.299 1.990 2.654 . 0 0 "[ . 1 . 2]" 1
326 1 21 VAL MG2 1 46 ILE H . . 4.780 3.918 3.667 4.158 . 0 0 "[ . 1 . 2]" 1
327 1 21 VAL MG2 1 46 ILE HA . . 3.700 2.009 1.856 2.225 . 0 0 "[ . 1 . 2]" 1
328 1 21 VAL MG2 1 46 ILE MD . . 3.970 3.317 3.136 3.455 . 0 0 "[ . 1 . 2]" 1
329 1 21 VAL MG2 1 46 ILE HG12 . . 4.560 1.961 1.850 2.065 . 0 0 "[ . 1 . 2]" 1
330 1 21 VAL MG2 1 46 ILE HG13 . . 4.140 2.906 2.671 3.051 . 0 0 "[ . 1 . 2]" 1
331 1 21 VAL MG2 1 46 ILE MG . . 3.710 2.418 2.064 2.864 . 0 0 "[ . 1 . 2]" 1
332 1 21 VAL MG2 1 49 HIS H . . 4.780 4.340 4.028 4.612 . 0 0 "[ . 1 . 2]" 1
333 1 21 VAL MG2 1 49 HIS HB2 . . 4.290 2.928 2.664 3.330 . 0 0 "[ . 1 . 2]" 1
334 1 21 VAL MG2 1 49 HIS HD2 . . 4.350 3.902 3.741 4.185 . 0 0 "[ . 1 . 2]" 1
335 1 21 VAL MG2 1 50 PHE QD . . 5.200 5.020 4.653 5.204 0.004 9 0 "[ . 1 . 2]" 1
336 1 21 VAL MG2 1 50 PHE QE . . 3.910 3.784 3.440 3.909 . 0 0 "[ . 1 . 2]" 1
337 1 21 VAL MG2 1 50 PHE HZ . . 4.550 4.387 3.796 4.559 0.009 16 0 "[ . 1 . 2]" 1
338 1 21 VAL MG2 1 108 ILE MG . . 5.500 5.202 4.896 5.504 0.004 20 0 "[ . 1 . 2]" 1
339 1 22 THR H 1 22 THR HG1 . . 3.300 1.975 1.897 2.235 . 0 0 "[ . 1 . 2]" 1
340 1 22 THR H 1 22 THR MG . . 3.520 2.637 2.379 2.792 . 0 0 "[ . 1 . 2]" 1
341 1 22 THR H 1 23 LYS H . . 3.290 2.620 2.371 2.871 . 0 0 "[ . 1 . 2]" 1
342 1 22 THR H 1 23 LYS QB . . 4.500 4.307 3.977 4.509 0.009 8 0 "[ . 1 . 2]" 1
343 1 22 THR H 1 23 LYS QG . . 4.850 4.239 3.979 4.641 . 0 0 "[ . 1 . 2]" 1
344 1 22 THR H 1 30 ILE MD . . 4.640 4.479 4.294 4.644 0.004 20 0 "[ . 1 . 2]" 1
345 1 22 THR H 1 45 ALA MB . . 5.440 5.253 5.051 5.436 . 0 0 "[ . 1 . 2]" 1
346 1 22 THR HA 1 22 THR MG . . 3.430 2.368 2.270 2.430 . 0 0 "[ . 1 . 2]" 1
347 1 22 THR HA 1 25 TYR QD . . 3.530 2.493 2.144 2.944 . 0 0 "[ . 1 . 2]" 1
348 1 22 THR HA 1 25 TYR QE . . 4.270 2.947 2.621 3.210 . 0 0 "[ . 1 . 2]" 1
349 1 22 THR HA 1 28 VAL MG2 . . 4.260 4.127 3.761 4.265 0.005 17 0 "[ . 1 . 2]" 1
350 1 22 THR HA 1 45 ALA MB . . 4.170 3.738 3.406 3.942 . 0 0 "[ . 1 . 2]" 1
351 1 22 THR HB 1 25 TYR H . . 4.610 4.491 4.204 4.619 0.009 15 0 "[ . 1 . 2]" 1
352 1 22 THR HB 1 25 TYR QD . . 4.510 3.629 3.317 3.906 . 0 0 "[ . 1 . 2]" 1
353 1 22 THR HB 1 28 VAL H . . 5.500 5.420 5.231 5.523 0.023 9 0 "[ . 1 . 2]" 1
354 1 22 THR HB 1 28 VAL HB . . 4.500 2.723 2.375 2.910 . 0 0 "[ . 1 . 2]" 1
355 1 22 THR HB 1 28 VAL MG1 . . 3.310 1.926 1.828 2.021 . 0 0 "[ . 1 . 2]" 1
356 1 22 THR HB 1 28 VAL MG2 . . 3.970 2.615 2.292 2.936 . 0 0 "[ . 1 . 2]" 1
357 1 22 THR HB 1 30 ILE MD . . 4.570 3.759 3.408 4.125 . 0 0 "[ . 1 . 2]" 1
358 1 22 THR HB 1 45 ALA MB . . 4.020 3.266 3.073 3.591 . 0 0 "[ . 1 . 2]" 1
359 1 22 THR HG1 1 22 THR MG . . 3.160 2.534 2.331 2.933 . 0 0 "[ . 1 . 2]" 1
360 1 22 THR HG1 1 23 LYS H . . 4.140 3.697 3.490 3.938 . 0 0 "[ . 1 . 2]" 1
361 1 22 THR HG1 1 30 ILE MD . . 3.570 2.966 2.587 3.315 . 0 0 "[ . 1 . 2]" 1
362 1 22 THR MG 1 23 LYS H . . 4.440 4.298 4.236 4.341 . 0 0 "[ . 1 . 2]" 1
363 1 22 THR MG 1 25 TYR QD . . 4.480 3.582 3.372 3.799 . 0 0 "[ . 1 . 2]" 1
364 1 22 THR MG 1 30 ILE MD . . 3.350 3.092 2.728 3.334 . 0 0 "[ . 1 . 2]" 1
365 1 22 THR MG 1 42 SER HA . . 4.320 3.043 2.622 3.347 . 0 0 "[ . 1 . 2]" 1
366 1 22 THR MG 1 45 ALA H . . 4.520 4.418 4.225 4.523 0.003 13 0 "[ . 1 . 2]" 1
367 1 22 THR MG 1 45 ALA MB . . 3.260 1.897 1.764 2.082 . 0 0 "[ . 1 . 2]" 1
368 1 22 THR MG 1 46 ILE H . . 3.760 3.307 3.048 3.443 . 0 0 "[ . 1 . 2]" 1
369 1 22 THR MG 1 46 ILE HA . . 4.050 3.076 2.884 3.287 . 0 0 "[ . 1 . 2]" 1
370 1 22 THR MG 1 46 ILE HB . . 4.670 4.594 4.441 4.678 0.008 15 0 "[ . 1 . 2]" 1
371 1 22 THR MG 1 46 ILE MD . . 3.750 3.621 3.424 3.752 0.002 17 0 "[ . 1 . 2]" 1
372 1 22 THR MG 1 46 ILE HG13 . . 3.660 2.697 2.535 2.802 . 0 0 "[ . 1 . 2]" 1
373 1 22 THR MG 1 57 TYR QE . . 5.330 4.869 4.713 5.080 . 0 0 "[ . 1 . 2]" 1
374 1 23 LYS H 1 23 LYS HB2 . . 3.640 2.964 2.176 3.613 . 0 0 "[ . 1 . 2]" 1
375 1 23 LYS H 1 23 LYS QB . . 3.020 2.335 2.155 2.540 . 0 0 "[ . 1 . 2]" 1
376 1 23 LYS H 1 23 LYS HB3 . . 3.640 2.956 2.353 3.527 . 0 0 "[ . 1 . 2]" 1
377 1 23 LYS H 1 23 LYS QD . . 4.570 3.925 3.412 4.586 0.016 7 0 "[ . 1 . 2]" 1
378 1 23 LYS H 1 23 LYS QG . . 3.580 2.482 1.974 3.004 . 0 0 "[ . 1 . 2]" 1
379 1 23 LYS H 1 24 ASN H . . 4.530 3.273 2.426 4.528 . 0 0 "[ . 1 . 2]" 1
380 1 23 LYS HA 1 23 LYS HG2 . . 4.180 3.105 2.155 3.796 . 0 0 "[ . 1 . 2]" 1
381 1 23 LYS HA 1 23 LYS HG3 . . 4.180 3.454 2.512 3.858 . 0 0 "[ . 1 . 2]" 1
382 1 23 LYS HA 1 24 ASN HA . . 5.110 4.503 4.363 4.622 . 0 0 "[ . 1 . 2]" 1
383 1 23 LYS HB2 1 24 ASN H . . 4.650 3.651 2.456 4.486 . 0 0 "[ . 1 . 2]" 1
384 1 23 LYS HB3 1 24 ASN H . . 4.650 3.708 2.732 4.284 . 0 0 "[ . 1 . 2]" 1
385 1 23 LYS QD 1 24 ASN QD . . 4.620 3.731 2.803 4.559 . 0 0 "[ . 1 . 2]" 1
386 1 23 LYS QE 1 23 LYS HG2 . . 3.920 2.746 2.097 3.503 . 0 0 "[ . 1 . 2]" 1
387 1 23 LYS QE 1 23 LYS QG . . 3.190 2.306 2.045 2.682 . 0 0 "[ . 1 . 2]" 1
388 1 23 LYS QE 1 23 LYS HG3 . . 3.920 2.772 2.238 3.491 . 0 0 "[ . 1 . 2]" 1
389 1 23 LYS QE 1 24 ASN QD . . 4.630 3.572 2.112 4.643 0.013 14 0 "[ . 1 . 2]" 1
390 1 23 LYS QG 1 24 ASN H . . 4.700 3.404 1.972 4.376 . 0 0 "[ . 1 . 2]" 1
391 1 23 LYS QG 1 24 ASN QD . . 4.570 3.401 2.122 4.489 . 0 0 "[ . 1 . 2]" 1
392 1 24 ASN H 1 24 ASN QB . . 3.680 2.862 2.278 3.469 . 0 0 "[ . 1 . 2]" 1
393 1 24 ASN H 1 25 TYR H . . 3.470 2.952 2.471 3.478 0.008 14 0 "[ . 1 . 2]" 1
394 1 24 ASN H 1 25 TYR QD . . 4.880 3.083 2.373 4.139 . 0 0 "[ . 1 . 2]" 1
395 1 24 ASN HA 1 25 TYR HA . . 5.500 4.478 4.423 4.575 . 0 0 "[ . 1 . 2]" 1
396 1 25 TYR H 1 25 TYR HB2 . . 3.640 2.392 2.227 2.501 . 0 0 "[ . 1 . 2]" 1
397 1 25 TYR H 1 25 TYR QB . . 2.940 2.359 2.203 2.462 . 0 0 "[ . 1 . 2]" 1
398 1 25 TYR H 1 25 TYR HB3 . . 3.640 3.594 3.477 3.672 0.032 17 0 "[ . 1 . 2]" 1
399 1 25 TYR H 1 25 TYR QD . . 3.170 2.865 2.794 2.932 . 0 0 "[ . 1 . 2]" 1
400 1 25 TYR H 1 25 TYR QE . . 5.180 5.165 5.100 5.199 0.019 8 0 "[ . 1 . 2]" 1
401 1 25 TYR H 1 26 ARG HA . . 5.430 5.098 4.883 5.445 0.015 15 0 "[ . 1 . 2]" 1
402 1 25 TYR H 1 28 VAL HB . . 4.850 4.124 3.348 4.672 . 0 0 "[ . 1 . 2]" 1
403 1 25 TYR H 1 28 VAL MG2 . . 4.680 4.259 3.532 4.580 . 0 0 "[ . 1 . 2]" 1
404 1 25 TYR HA 1 25 TYR QD . . 3.970 2.930 2.521 3.064 . 0 0 "[ . 1 . 2]" 1
405 1 25 TYR HA 1 26 ARG H . . 3.200 2.537 2.208 2.645 . 0 0 "[ . 1 . 2]" 1
406 1 25 TYR HA 1 28 VAL MG2 . . 4.370 4.098 3.841 4.295 . 0 0 "[ . 1 . 2]" 1
407 1 25 TYR HA 1 57 TYR QE . . 5.500 4.677 4.327 5.300 . 0 0 "[ . 1 . 2]" 1
408 1 25 TYR QB 1 26 ARG H . . 4.230 2.161 1.975 3.005 . 0 0 "[ . 1 . 2]" 1
409 1 25 TYR QB 1 28 VAL H . . 4.520 3.968 3.629 4.326 . 0 0 "[ . 1 . 2]" 1
410 1 25 TYR QB 1 28 VAL HB . . 3.970 2.528 2.137 2.798 . 0 0 "[ . 1 . 2]" 1
411 1 25 TYR QB 1 28 VAL MG1 . . 4.560 3.254 3.057 3.462 . 0 0 "[ . 1 . 2]" 1
412 1 25 TYR QB 1 28 VAL MG2 . . 3.260 1.861 1.729 2.006 . 0 0 "[ . 1 . 2]" 1
413 1 25 TYR HB2 1 26 ARG H . . 4.910 3.618 3.440 4.236 . 0 0 "[ . 1 . 2]" 1
414 1 25 TYR HB2 1 28 VAL H . . 5.220 4.474 3.922 4.946 . 0 0 "[ . 1 . 2]" 1
415 1 25 TYR HB2 1 28 VAL HB . . 4.750 2.633 2.171 2.973 . 0 0 "[ . 1 . 2]" 1
416 1 25 TYR HB2 1 28 VAL MG2 . . 3.780 2.424 2.092 2.689 . 0 0 "[ . 1 . 2]" 1
417 1 25 TYR HB2 1 45 ALA MB . . 4.170 4.028 3.861 4.181 0.011 9 0 "[ . 1 . 2]" 1
418 1 25 TYR HB3 1 26 ARG H . . 4.910 2.180 1.985 3.074 . 0 0 "[ . 1 . 2]" 1
419 1 25 TYR HB3 1 28 VAL H . . 5.220 4.462 4.206 5.152 . 0 0 "[ . 1 . 2]" 1
420 1 25 TYR HB3 1 28 VAL HB . . 4.750 3.319 2.900 3.791 . 0 0 "[ . 1 . 2]" 1
421 1 25 TYR HB3 1 28 VAL MG2 . . 3.780 1.941 1.831 2.080 . 0 0 "[ . 1 . 2]" 1
422 1 25 TYR HB3 1 45 ALA MB . . 4.170 3.603 3.248 3.755 . 0 0 "[ . 1 . 2]" 1
423 1 25 TYR QD 1 26 ARG H . . 4.900 3.427 3.115 3.888 . 0 0 "[ . 1 . 2]" 1
424 1 25 TYR QD 1 28 VAL MG2 . . 4.110 2.648 2.344 3.285 . 0 0 "[ . 1 . 2]" 1
425 1 25 TYR QD 1 45 ALA HA . . 4.670 3.436 3.149 3.755 . 0 0 "[ . 1 . 2]" 1
426 1 25 TYR QD 1 45 ALA MB . . 3.890 2.237 1.974 2.575 . 0 0 "[ . 1 . 2]" 1
427 1 25 TYR QD 1 57 TYR QD . . 4.330 4.048 3.723 4.323 . 0 0 "[ . 1 . 2]" 1
428 1 25 TYR QD 1 57 TYR QE . . 4.190 2.913 2.353 3.476 . 0 0 "[ . 1 . 2]" 1
429 1 25 TYR QE 1 45 ALA HA . . 4.340 2.317 1.998 3.418 . 0 0 "[ . 1 . 2]" 1
430 1 25 TYR QE 1 45 ALA MB . . 4.480 2.580 2.214 3.393 . 0 0 "[ . 1 . 2]" 1
431 1 25 TYR QE 1 48 HIS H . . 4.880 4.509 4.136 4.860 . 0 0 "[ . 1 . 2]" 1
432 1 25 TYR QE 1 48 HIS QB . . 3.910 2.551 2.269 2.990 . 0 0 "[ . 1 . 2]" 1
433 1 25 TYR QE 1 49 HIS H . . 4.310 3.883 3.310 4.279 . 0 0 "[ . 1 . 2]" 1
434 1 25 TYR QE 1 49 HIS HA . . 4.240 3.526 3.125 3.855 . 0 0 "[ . 1 . 2]" 1
435 1 25 TYR QE 1 49 HIS HB2 . . 4.570 3.404 2.880 3.782 . 0 0 "[ . 1 . 2]" 1
436 1 25 TYR QE 1 49 HIS HB3 . . 5.180 4.807 4.411 5.086 . 0 0 "[ . 1 . 2]" 1
437 1 26 ARG H 1 26 ARG QB . . 3.330 2.411 2.228 2.601 . 0 0 "[ . 1 . 2]" 1
438 1 26 ARG H 1 26 ARG QD . . 4.860 4.062 2.420 4.880 0.020 17 0 "[ . 1 . 2]" 1
439 1 26 ARG H 1 26 ARG QG . . 4.420 3.639 2.443 4.084 . 0 0 "[ . 1 . 2]" 1
440 1 26 ARG H 1 57 TYR QE . . 4.360 3.087 2.310 3.473 . 0 0 "[ . 1 . 2]" 1
441 1 26 ARG HA 1 26 ARG HG2 . . 4.070 3.210 2.595 3.824 . 0 0 "[ . 1 . 2]" 1
442 1 26 ARG HA 1 26 ARG QG . . 3.380 2.465 2.180 2.801 . 0 0 "[ . 1 . 2]" 1
443 1 26 ARG HA 1 26 ARG HG3 . . 4.070 2.802 2.201 3.749 . 0 0 "[ . 1 . 2]" 1
444 1 26 ARG QB 1 26 ARG QD . . 3.480 2.320 2.071 2.700 . 0 0 "[ . 1 . 2]" 1
445 1 26 ARG QB 1 57 TYR QE . . 4.020 3.331 1.972 4.022 0.002 2 0 "[ . 1 . 2]" 1
446 1 27 GLY QA 1 41 LEU MD1 . . 3.780 3.716 3.539 3.795 0.015 15 0 "[ . 1 . 2]" 1
447 1 27 GLY QA 1 41 LEU MD2 . . 5.180 5.095 4.569 5.182 0.002 16 0 "[ . 1 . 2]" 1
448 1 28 VAL H 1 28 VAL HB . . 2.900 2.731 2.592 2.902 0.002 7 0 "[ . 1 . 2]" 1
449 1 28 VAL H 1 28 VAL MG1 . . 4.120 3.886 3.823 3.949 . 0 0 "[ . 1 . 2]" 1
450 1 28 VAL H 1 28 VAL MG2 . . 2.950 2.766 2.441 2.962 0.012 15 0 "[ . 1 . 2]" 1
451 1 28 VAL H 1 29 LYS H . . 4.580 3.841 3.625 4.136 . 0 0 "[ . 1 . 2]" 1
452 1 28 VAL H 1 29 LYS HA . . 5.500 4.801 4.610 5.062 . 0 0 "[ . 1 . 2]" 1
453 1 28 VAL HA 1 28 VAL MG1 . . 3.160 2.280 2.162 2.366 . 0 0 "[ . 1 . 2]" 1
454 1 28 VAL HA 1 28 VAL MG2 . . 3.150 2.389 2.253 2.534 . 0 0 "[ . 1 . 2]" 1
455 1 28 VAL HA 1 29 LYS H . . 3.080 2.237 2.142 2.310 . 0 0 "[ . 1 . 2]" 1
456 1 28 VAL HA 1 29 LYS QB . . 4.570 4.355 4.185 4.617 0.047 19 0 "[ . 1 . 2]" 1
457 1 28 VAL HA 1 30 ILE MD . . 4.740 3.967 3.316 4.553 . 0 0 "[ . 1 . 2]" 1
458 1 28 VAL HA 1 42 SER HG . . 4.690 4.126 3.451 4.532 . 0 0 "[ . 1 . 2]" 1
459 1 28 VAL HB 1 29 LYS H . . 4.600 4.425 4.214 4.498 . 0 0 "[ . 1 . 2]" 1
460 1 28 VAL HB 1 30 ILE MD . . 5.140 3.943 3.480 4.293 . 0 0 "[ . 1 . 2]" 1
461 1 28 VAL HB 1 45 ALA MB . . 4.800 4.457 4.187 4.806 0.006 14 0 "[ . 1 . 2]" 1
462 1 28 VAL MG1 1 29 LYS H . . 3.470 3.273 2.892 3.470 . 16 0 "[ . 1 . 2]" 1
463 1 28 VAL MG1 1 29 LYS HA . . 4.250 3.865 3.632 4.091 . 0 0 "[ . 1 . 2]" 1
464 1 28 VAL MG1 1 30 ILE MD . . 2.820 1.898 1.723 2.391 . 0 0 "[ . 1 . 2]" 1
465 1 28 VAL MG1 1 30 ILE HG13 . . 4.040 3.293 2.705 3.872 . 0 0 "[ . 1 . 2]" 1
466 1 28 VAL MG1 1 42 SER H . . 4.920 4.247 3.563 4.675 . 0 0 "[ . 1 . 2]" 1
467 1 28 VAL MG1 1 42 SER HA . . 3.860 2.870 2.389 3.166 . 0 0 "[ . 1 . 2]" 1
468 1 28 VAL MG1 1 42 SER HB2 . . 5.170 4.560 4.176 4.859 . 0 0 "[ . 1 . 2]" 1
469 1 28 VAL MG1 1 42 SER HB3 . . 3.990 3.751 3.295 3.983 . 0 0 "[ . 1 . 2]" 1
470 1 28 VAL MG1 1 42 SER HG . . 4.240 3.045 2.560 3.483 . 0 0 "[ . 1 . 2]" 1
471 1 28 VAL MG2 1 29 LYS H . . 4.280 4.268 4.196 4.335 0.055 12 0 "[ . 1 . 2]" 1
472 1 28 VAL MG2 1 57 TYR QE . . 4.290 3.240 3.055 3.490 . 0 0 "[ . 1 . 2]" 1
473 1 29 LYS H 1 29 LYS QB . . 3.630 2.585 2.357 3.129 . 0 0 "[ . 1 . 2]" 1
474 1 29 LYS H 1 30 ILE MD . . 4.850 3.916 2.743 4.481 . 0 0 "[ . 1 . 2]" 1
475 1 29 LYS H 1 30 ILE HG13 . . 4.920 4.664 3.867 4.926 0.006 14 0 "[ . 1 . 2]" 1
476 1 29 LYS HA 1 29 LYS QD . . 4.500 3.657 2.061 4.426 . 0 0 "[ . 1 . 2]" 1
477 1 29 LYS HA 1 29 LYS HG2 . . 4.120 3.271 2.168 4.185 0.065 7 0 "[ . 1 . 2]" 1
478 1 29 LYS HA 1 29 LYS QG . . 3.540 2.694 2.130 3.393 . 0 0 "[ . 1 . 2]" 1
479 1 29 LYS HA 1 29 LYS HG3 . . 4.120 2.929 2.408 3.719 . 0 0 "[ . 1 . 2]" 1
480 1 29 LYS HA 1 31 THR H . . 5.140 4.707 4.217 5.114 . 0 0 "[ . 1 . 2]" 1
481 1 29 LYS QD 1 31 THR HB . . 5.030 4.268 3.307 5.021 . 0 0 "[ . 1 . 2]" 1
482 1 29 LYS QE 1 29 LYS HG2 . . 3.670 2.545 2.054 3.309 . 0 0 "[ . 1 . 2]" 1
483 1 29 LYS QE 1 29 LYS HG3 . . 3.670 2.810 2.092 3.486 . 0 0 "[ . 1 . 2]" 1
484 1 29 LYS QE 1 31 THR MG . . 3.550 3.173 2.144 3.551 0.001 6 0 "[ . 1 . 2]" 1
485 1 30 ILE HA 1 30 ILE MD . . 3.630 3.393 3.317 3.492 . 0 0 "[ . 1 . 2]" 1
486 1 30 ILE HA 1 30 ILE HG12 . . 4.050 3.510 3.421 3.559 . 0 0 "[ . 1 . 2]" 1
487 1 30 ILE HA 1 30 ILE HG13 . . 3.910 2.345 2.292 2.453 . 0 0 "[ . 1 . 2]" 1
488 1 30 ILE HA 1 30 ILE MG . . 3.390 2.373 2.295 2.458 . 0 0 "[ . 1 . 2]" 1
489 1 30 ILE HA 1 31 THR H . . 3.260 2.427 2.280 2.672 . 0 0 "[ . 1 . 2]" 1
490 1 30 ILE HA 1 32 ASN H . . 3.610 3.318 3.088 3.576 . 0 0 "[ . 1 . 2]" 1
491 1 30 ILE HB 1 30 ILE MD . . 3.320 2.125 2.081 2.242 . 0 0 "[ . 1 . 2]" 1
492 1 30 ILE MD 1 31 THR H . . 5.290 4.888 4.717 5.056 . 0 0 "[ . 1 . 2]" 1
493 1 30 ILE MD 1 36 SER QB . . 5.500 4.990 4.154 5.494 . 0 0 "[ . 1 . 2]" 1
494 1 30 ILE MD 1 37 TRP HH2 . . 4.810 4.524 3.974 4.785 . 0 0 "[ . 1 . 2]" 1
495 1 30 ILE MD 1 37 TRP HZ2 . . 4.590 4.512 4.224 4.599 0.009 20 0 "[ . 1 . 2]" 1
496 1 30 ILE MD 1 42 SER HA . . 4.500 4.199 3.884 4.440 . 0 0 "[ . 1 . 2]" 1
497 1 30 ILE MD 1 42 SER HB2 . . 4.950 4.687 4.471 4.905 . 0 0 "[ . 1 . 2]" 1
498 1 30 ILE MD 1 42 SER HB3 . . 3.740 3.603 3.243 3.743 0.003 7 0 "[ . 1 . 2]" 1
499 1 30 ILE MD 1 42 SER HG . . 3.990 3.713 3.401 4.004 0.014 17 0 "[ . 1 . 2]" 1
500 1 30 ILE HG12 1 30 ILE MG . . 3.120 2.054 1.991 2.181 . 0 0 "[ . 1 . 2]" 1
501 1 30 ILE HG12 1 36 SER QB . . 5.500 4.931 3.910 5.500 0.000 12 0 "[ . 1 . 2]" 1
502 1 30 ILE HG12 1 37 TRP HE1 . . 5.350 4.622 4.368 4.769 . 0 0 "[ . 1 . 2]" 1
503 1 30 ILE HG12 1 37 TRP HH2 . . 4.050 3.635 3.173 3.977 . 0 0 "[ . 1 . 2]" 1
504 1 30 ILE HG12 1 37 TRP HZ2 . . 3.650 3.012 2.672 3.193 . 0 0 "[ . 1 . 2]" 1
505 1 30 ILE HG12 1 42 SER HB2 . . 5.240 4.467 4.035 4.920 . 0 0 "[ . 1 . 2]" 1
506 1 30 ILE HG12 1 42 SER HB3 . . 4.120 3.415 3.036 3.854 . 0 0 "[ . 1 . 2]" 1
507 1 30 ILE HG13 1 30 ILE MG . . 3.690 2.671 2.574 2.732 . 0 0 "[ . 1 . 2]" 1
508 1 30 ILE MG 1 31 THR H . . 4.120 3.619 3.370 3.923 . 0 0 "[ . 1 . 2]" 1
509 1 30 ILE MG 1 31 THR HA . . 4.610 4.162 3.939 4.476 . 0 0 "[ . 1 . 2]" 1
510 1 30 ILE MG 1 32 ASN H . . 3.650 3.246 2.957 3.529 . 0 0 "[ . 1 . 2]" 1
511 1 30 ILE MG 1 32 ASN HA . . 4.520 4.272 4.128 4.452 . 0 0 "[ . 1 . 2]" 1
512 1 30 ILE MG 1 36 SER QB . . 4.160 3.300 2.815 3.587 . 0 0 "[ . 1 . 2]" 1
513 1 30 ILE MG 1 37 TRP HE1 . . 3.560 2.650 2.364 3.008 . 0 0 "[ . 1 . 2]" 1
514 1 30 ILE MG 1 37 TRP HH2 . . 4.330 3.977 3.710 4.332 0.002 1 0 "[ . 1 . 2]" 1
515 1 30 ILE MG 1 37 TRP HZ2 . . 3.420 2.198 1.954 2.559 . 0 0 "[ . 1 . 2]" 1
516 1 31 THR H 1 31 THR MG . . 3.860 2.512 1.874 3.788 . 0 0 "[ . 1 . 2]" 1
517 1 31 THR H 1 32 ASN H . . 3.050 2.376 2.143 2.616 . 0 0 "[ . 1 . 2]" 1
518 1 31 THR H 1 36 SER QB . . 4.370 3.161 2.619 3.795 . 0 0 "[ . 1 . 2]" 1
519 1 31 THR HA 1 31 THR MG . . 3.300 2.753 2.158 3.206 . 0 0 "[ . 1 . 2]" 1
520 1 31 THR MG 1 32 ASN H . . 4.270 3.058 1.870 4.177 . 0 0 "[ . 1 . 2]" 1
521 1 32 ASN H 1 33 PHE H . . 4.910 4.392 4.332 4.437 . 0 0 "[ . 1 . 2]" 1
522 1 32 ASN H 1 36 SER H . . 4.920 4.029 3.569 4.370 . 0 0 "[ . 1 . 2]" 1
523 1 32 ASN H 1 36 SER QB . . 3.660 2.476 2.007 3.039 . 0 0 "[ . 1 . 2]" 1
524 1 32 ASN H 1 37 TRP HE1 . . 4.930 4.687 4.419 4.945 0.015 20 0 "[ . 1 . 2]" 1
525 1 32 ASN HA 1 33 PHE H . . 3.550 2.525 2.244 2.641 . 0 0 "[ . 1 . 2]" 1
526 1 32 ASN HA 1 34 THR H . . 4.390 4.264 3.840 4.388 . 0 0 "[ . 1 . 2]" 1
527 1 32 ASN QB 1 33 PHE H . . 3.100 2.281 2.095 2.864 . 0 0 "[ . 1 . 2]" 1
528 1 32 ASN QB 1 33 PHE HB2 . . 4.650 4.439 4.326 4.679 0.029 20 0 "[ . 1 . 2]" 1
529 1 32 ASN QB 1 36 SER H . . 4.660 3.044 2.483 3.554 . 0 0 "[ . 1 . 2]" 1
530 1 32 ASN HB2 1 33 PHE H . . 3.540 2.978 2.172 3.578 0.038 20 0 "[ . 1 . 2]" 1
531 1 32 ASN HB2 1 34 THR H . . 3.770 2.547 2.082 2.743 . 0 0 "[ . 1 . 2]" 1
532 1 32 ASN HB3 1 33 PHE H . . 3.540 2.483 2.130 3.535 . 0 0 "[ . 1 . 2]" 1
533 1 32 ASN HB3 1 34 THR H . . 3.770 3.299 2.889 3.838 0.068 18 0 "[ . 1 . 2]" 1
534 1 32 ASN QD 1 34 THR H . . 4.670 4.356 4.122 4.633 . 0 0 "[ . 1 . 2]" 1
535 1 32 ASN QD 1 35 THR H . . 3.880 3.698 3.358 3.876 . 0 0 "[ . 1 . 2]" 1
536 1 32 ASN QD 1 35 THR MG . . 4.510 3.764 3.051 4.280 . 0 0 "[ . 1 . 2]" 1
537 1 32 ASN QD 1 36 SER H . . 3.910 3.467 2.866 3.912 0.002 20 0 "[ . 1 . 2]" 1
538 1 33 PHE H 1 33 PHE HB2 . . 3.900 2.435 2.273 2.526 . 0 0 "[ . 1 . 2]" 1
539 1 33 PHE H 1 33 PHE QD . . 4.310 3.448 3.055 3.814 . 0 0 "[ . 1 . 2]" 1
540 1 33 PHE H 1 34 THR H . . 3.470 2.568 2.230 3.197 . 0 0 "[ . 1 . 2]" 1
541 1 33 PHE H 1 34 THR MG . . 4.260 3.638 3.379 4.150 . 0 0 "[ . 1 . 2]" 1
542 1 33 PHE H 1 36 SER QB . . 4.740 4.534 4.005 4.903 0.163 20 0 "[ . 1 . 2]" 1
543 1 33 PHE HA 1 33 PHE QD . . 3.830 2.463 2.174 2.740 . 0 0 "[ . 1 . 2]" 1
544 1 33 PHE HA 1 37 TRP HD1 . . 3.570 2.122 1.998 2.394 . 0 0 "[ . 1 . 2]" 1
545 1 33 PHE HA 1 37 TRP HE1 . . 3.070 1.968 1.897 2.096 . 0 0 "[ . 1 . 2]" 1
546 1 33 PHE HA 1 101 VAL MG1 . . 4.240 3.504 3.305 3.834 . 0 0 "[ . 1 . 2]" 1
547 1 33 PHE HB2 1 34 THR H . . 4.550 4.087 3.750 4.271 . 0 0 "[ . 1 . 2]" 1
548 1 33 PHE HB2 1 34 THR MG . . 4.540 3.906 3.553 4.345 . 0 0 "[ . 1 . 2]" 1
549 1 33 PHE HB2 1 37 TRP HE1 . . 4.590 4.561 4.489 4.597 0.007 11 0 "[ . 1 . 2]" 1
550 1 33 PHE HB2 1 98 LYS HA . . 4.630 4.013 3.752 4.328 . 0 0 "[ . 1 . 2]" 1
551 1 33 PHE HB2 1 98 LYS HG2 . . 4.500 3.089 2.578 3.829 . 0 0 "[ . 1 . 2]" 1
552 1 33 PHE HB2 1 98 LYS HG3 . . 4.270 2.420 2.017 3.492 . 0 0 "[ . 1 . 2]" 1
553 1 33 PHE HB2 1 101 VAL MG1 . . 4.920 4.541 4.141 4.896 . 0 0 "[ . 1 . 2]" 1
554 1 33 PHE HB2 1 102 MET ME . . 4.730 3.991 3.612 4.322 . 0 0 "[ . 1 . 2]" 1
555 1 33 PHE HB2 1 102 MET HG2 . . 4.670 3.606 3.240 4.207 . 0 0 "[ . 1 . 2]" 1
556 1 33 PHE HB2 1 102 MET HG3 . . 4.670 3.127 2.549 3.908 . 0 0 "[ . 1 . 2]" 1
557 1 33 PHE HB3 1 34 THR H . . 4.400 4.331 4.198 4.401 0.001 12 0 "[ . 1 . 2]" 1
558 1 33 PHE HB3 1 34 THR MG . . 5.120 4.094 3.841 4.403 . 0 0 "[ . 1 . 2]" 1
559 1 33 PHE HB3 1 98 LYS HA . . 4.520 3.572 3.251 3.826 . 0 0 "[ . 1 . 2]" 1
560 1 33 PHE HB3 1 98 LYS HG2 . . 5.300 3.454 2.917 4.127 . 0 0 "[ . 1 . 2]" 1
561 1 33 PHE HB3 1 98 LYS HG3 . . 4.270 3.305 2.851 4.270 . 0 0 "[ . 1 . 2]" 1
562 1 33 PHE HB3 1 101 VAL MG1 . . 4.000 3.060 2.614 3.466 . 0 0 "[ . 1 . 2]" 1
563 1 33 PHE HB3 1 102 MET H . . 4.610 3.632 3.334 3.992 . 0 0 "[ . 1 . 2]" 1
564 1 33 PHE HB3 1 102 MET ME . . 4.750 4.234 3.962 4.524 . 0 0 "[ . 1 . 2]" 1
565 1 33 PHE HB3 1 102 MET HG2 . . 4.540 2.948 2.240 3.429 . 0 0 "[ . 1 . 2]" 1
566 1 33 PHE HB3 1 102 MET QG . . 3.810 2.329 2.025 2.703 . 0 0 "[ . 1 . 2]" 1
567 1 33 PHE HB3 1 102 MET HG3 . . 4.540 2.506 2.108 3.495 . 0 0 "[ . 1 . 2]" 1
568 1 33 PHE HB3 1 105 LEU MD1 . . 5.110 3.672 3.200 4.160 . 0 0 "[ . 1 . 2]" 1
569 1 33 PHE QD 1 37 TRP HE1 . . 4.660 2.279 1.950 2.705 . 0 0 "[ . 1 . 2]" 1
570 1 33 PHE QD 1 98 LYS HE2 . . 5.500 4.769 3.981 5.503 0.003 2 0 "[ . 1 . 2]" 1
571 1 33 PHE QD 1 98 LYS QE . . 4.690 3.734 2.662 4.687 . 0 0 "[ . 1 . 2]" 1
572 1 33 PHE QD 1 98 LYS HE3 . . 5.500 4.079 2.704 5.332 . 0 0 "[ . 1 . 2]" 1
573 1 33 PHE QD 1 101 VAL MG1 . . 3.650 3.091 2.755 3.351 . 0 0 "[ . 1 . 2]" 1
574 1 33 PHE QD 1 102 MET H . . 5.100 4.807 4.451 5.098 . 0 0 "[ . 1 . 2]" 1
575 1 33 PHE QD 1 102 MET HA . . 4.630 3.874 3.519 4.241 . 0 0 "[ . 1 . 2]" 1
576 1 33 PHE QD 1 102 MET ME . . 3.640 2.782 2.013 3.217 . 0 0 "[ . 1 . 2]" 1
577 1 33 PHE QD 1 102 MET HG2 . . 4.630 3.213 2.963 3.566 . 0 0 "[ . 1 . 2]" 1
578 1 33 PHE QD 1 102 MET HG3 . . 4.630 3.673 3.251 4.124 . 0 0 "[ . 1 . 2]" 1
579 1 33 PHE QD 1 105 LEU MD1 . . 3.560 2.109 1.856 2.557 . 0 0 "[ . 1 . 2]" 1
580 1 33 PHE QE 1 37 TRP HE1 . . 4.810 3.407 3.146 3.746 . 0 0 "[ . 1 . 2]" 1
581 1 33 PHE QE 1 102 MET ME . . 3.740 2.634 2.086 3.107 . 0 0 "[ . 1 . 2]" 1
582 1 33 PHE QE 1 105 LEU MD1 . . 3.680 2.021 1.848 2.278 . 0 0 "[ . 1 . 2]" 1
583 1 33 PHE HZ 1 102 MET ME . . 4.770 3.643 3.113 3.995 . 0 0 "[ . 1 . 2]" 1
584 1 34 THR H 1 34 THR HB . . 4.110 3.748 3.633 3.799 . 0 0 "[ . 1 . 2]" 1
585 1 34 THR H 1 34 THR MG . . 3.610 3.165 2.761 3.523 . 0 0 "[ . 1 . 2]" 1
586 1 34 THR H 1 35 THR H . . 3.760 2.466 2.207 2.607 . 0 0 "[ . 1 . 2]" 1
587 1 34 THR H 1 35 THR MG . . 4.590 4.501 4.329 4.591 0.001 1 0 "[ . 1 . 2]" 1
588 1 34 THR H 1 36 SER H . . 3.800 3.166 2.593 3.607 . 0 0 "[ . 1 . 2]" 1
589 1 34 THR H 1 36 SER QB . . 4.660 3.528 3.238 4.034 . 0 0 "[ . 1 . 2]" 1
590 1 34 THR H 1 37 TRP HD1 . . 3.830 3.088 2.792 3.457 . 0 0 "[ . 1 . 2]" 1
591 1 34 THR H 1 37 TRP HE1 . . 5.180 4.558 4.328 4.890 . 0 0 "[ . 1 . 2]" 1
592 1 34 THR H 1 95 ILE MG . . 5.500 5.077 4.815 5.410 . 0 0 "[ . 1 . 2]" 1
593 1 34 THR H 1 101 VAL MG1 . . 5.240 4.819 4.441 5.141 . 0 0 "[ . 1 . 2]" 1
594 1 34 THR H 1 101 VAL MG2 . . 5.500 5.145 4.941 5.324 . 0 0 "[ . 1 . 2]" 1
595 1 34 THR HA 1 34 THR MG . . 3.300 2.180 2.020 2.391 . 0 0 "[ . 1 . 2]" 1
596 1 34 THR HA 1 37 TRP H . . 4.720 4.459 4.115 4.634 . 0 0 "[ . 1 . 2]" 1
597 1 34 THR HA 1 95 ILE MG . . 4.490 4.004 3.759 4.399 . 0 0 "[ . 1 . 2]" 1
598 1 34 THR HA 1 96 PRO HB2 . . 4.160 3.740 3.523 3.908 . 0 0 "[ . 1 . 2]" 1
599 1 34 THR HA 1 96 PRO HB3 . . 5.190 4.794 4.571 4.927 . 0 0 "[ . 1 . 2]" 1
600 1 34 THR HA 1 96 PRO HD2 . . 4.610 3.697 3.502 3.902 . 0 0 "[ . 1 . 2]" 1
601 1 34 THR HA 1 98 LYS QB . . 4.760 4.482 4.191 4.719 . 0 0 "[ . 1 . 2]" 1
602 1 34 THR HB 1 35 THR H . . 3.410 2.922 2.582 3.299 . 0 0 "[ . 1 . 2]" 1
603 1 34 THR HB 1 35 THR HA . . 4.390 4.153 3.899 4.371 . 0 0 "[ . 1 . 2]" 1
604 1 34 THR HB 1 35 THR MG . . 3.850 3.190 2.947 3.736 . 0 0 "[ . 1 . 2]" 1
605 1 34 THR HB 1 95 ILE MD . . 4.250 3.582 3.192 4.165 . 0 0 "[ . 1 . 2]" 1
606 1 34 THR HB 1 95 ILE MG . . 3.230 2.040 1.864 2.366 . 0 0 "[ . 1 . 2]" 1
607 1 34 THR HB 1 96 PRO HD2 . . 4.140 2.410 2.170 2.625 . 0 0 "[ . 1 . 2]" 1
608 1 34 THR HB 1 96 PRO HD3 . . 4.680 4.106 3.779 4.356 . 0 0 "[ . 1 . 2]" 1
609 1 34 THR HB 1 96 PRO HG2 . . 4.470 2.613 2.176 2.951 . 0 0 "[ . 1 . 2]" 1
610 1 34 THR HB 1 96 PRO QG . . 3.900 2.578 2.154 2.904 . 0 0 "[ . 1 . 2]" 1
611 1 34 THR HB 1 96 PRO HG3 . . 4.470 3.958 3.447 4.323 . 0 0 "[ . 1 . 2]" 1
612 1 34 THR HB 1 101 VAL MG2 . . 5.290 4.825 4.413 5.138 . 0 0 "[ . 1 . 2]" 1
613 1 34 THR MG 1 35 THR H . . 4.030 3.766 3.676 3.992 . 0 0 "[ . 1 . 2]" 1
614 1 34 THR MG 1 96 PRO HD2 . . 4.250 3.703 3.159 4.033 . 0 0 "[ . 1 . 2]" 1
615 1 34 THR MG 1 98 LYS H . . 3.440 2.499 2.150 2.906 . 0 0 "[ . 1 . 2]" 1
616 1 34 THR MG 1 98 LYS HA . . 3.480 2.300 2.036 2.619 . 0 0 "[ . 1 . 2]" 1
617 1 34 THR MG 1 98 LYS QB . . 3.170 2.077 1.907 2.289 . 0 0 "[ . 1 . 2]" 1
618 1 34 THR MG 1 101 VAL MG1 . . 5.180 4.542 4.081 4.913 . 0 0 "[ . 1 . 2]" 1
619 1 34 THR MG 1 102 MET H . . 5.500 5.337 4.900 5.507 0.007 20 0 "[ . 1 . 2]" 1
620 1 35 THR H 1 35 THR HB . . 3.770 3.637 3.610 3.657 . 0 0 "[ . 1 . 2]" 1
621 1 35 THR H 1 35 THR MG . . 3.050 2.409 2.123 2.614 . 0 0 "[ . 1 . 2]" 1
622 1 35 THR H 1 36 SER H . . 3.640 2.496 2.303 2.637 . 0 0 "[ . 1 . 2]" 1
623 1 35 THR H 1 36 SER QB . . 4.850 4.190 4.041 4.422 . 0 0 "[ . 1 . 2]" 1
624 1 35 THR H 1 37 TRP H . . 4.950 3.978 3.843 4.142 . 0 0 "[ . 1 . 2]" 1
625 1 35 THR H 1 38 ARG HB3 . . 5.240 4.929 4.761 5.135 . 0 0 "[ . 1 . 2]" 1
626 1 35 THR H 1 95 ILE MG . . 4.330 3.871 3.454 4.141 . 0 0 "[ . 1 . 2]" 1
627 1 35 THR H 1 96 PRO HD2 . . 4.500 4.178 3.854 4.415 . 0 0 "[ . 1 . 2]" 1
628 1 35 THR HA 1 35 THR MG . . 3.160 2.318 2.192 2.426 . 0 0 "[ . 1 . 2]" 1
629 1 35 THR HA 1 37 TRP H . . 4.420 3.738 3.597 3.902 . 0 0 "[ . 1 . 2]" 1
630 1 35 THR HA 1 38 ARG H . . 3.820 2.753 2.656 2.928 . 0 0 "[ . 1 . 2]" 1
631 1 35 THR HA 1 38 ARG HA . . 4.370 4.107 3.934 4.264 . 0 0 "[ . 1 . 2]" 1
632 1 35 THR HA 1 38 ARG HB2 . . 4.110 2.141 2.014 2.395 . 0 0 "[ . 1 . 2]" 1
633 1 35 THR HA 1 95 ILE MD . . 4.270 3.758 3.368 4.237 . 0 0 "[ . 1 . 2]" 1
634 1 35 THR HA 1 96 PRO HD2 . . 4.340 3.580 3.236 3.819 . 0 0 "[ . 1 . 2]" 1
635 1 35 THR HB 1 36 SER H . . 4.480 3.586 3.265 4.101 . 0 0 "[ . 1 . 2]" 1
636 1 35 THR MG 1 36 SER H . . 4.160 3.852 3.738 4.158 . 0 0 "[ . 1 . 2]" 1
637 1 35 THR MG 1 37 TRP H . . 5.360 5.120 4.999 5.266 . 0 0 "[ . 1 . 2]" 1
638 1 35 THR MG 1 38 ARG H . . 4.870 4.644 4.540 4.766 . 0 0 "[ . 1 . 2]" 1
639 1 35 THR MG 1 38 ARG QD . . 4.550 3.112 2.740 3.980 . 0 0 "[ . 1 . 2]" 1
640 1 35 THR MG 1 95 ILE HA . . 3.640 3.439 3.115 3.640 0.000 17 0 "[ . 1 . 2]" 1
641 1 35 THR MG 1 95 ILE MD . . 3.290 1.848 1.688 2.374 . 0 0 "[ . 1 . 2]" 1
642 1 35 THR MG 1 95 ILE MG . . 3.220 2.673 2.154 3.049 . 0 0 "[ . 1 . 2]" 1
643 1 35 THR MG 1 96 PRO HD2 . . 4.030 3.204 2.897 3.560 . 0 0 "[ . 1 . 2]" 1
644 1 35 THR MG 1 96 PRO HD3 . . 4.310 4.054 3.768 4.229 . 0 0 "[ . 1 . 2]" 1
645 1 36 SER H 1 36 SER QB . . 3.300 2.259 2.144 2.573 . 0 0 "[ . 1 . 2]" 1
646 1 36 SER H 1 37 TRP H . . 3.600 2.833 2.465 2.959 . 0 0 "[ . 1 . 2]" 1
647 1 36 SER H 1 37 TRP HB2 . . 5.500 5.333 4.999 5.491 . 0 0 "[ . 1 . 2]" 1
648 1 36 SER H 1 37 TRP HD1 . . 4.160 3.865 3.183 4.073 . 0 0 "[ . 1 . 2]" 1
649 1 36 SER H 1 38 ARG H . . 4.580 3.959 3.627 4.079 . 0 0 "[ . 1 . 2]" 1
650 1 36 SER QB 1 37 TRP H . . 3.930 2.893 2.762 3.070 . 0 0 "[ . 1 . 2]" 1
651 1 36 SER QB 1 37 TRP HD1 . . 3.980 2.793 2.551 3.024 . 0 0 "[ . 1 . 2]" 1
652 1 36 SER QB 1 37 TRP HE1 . . 3.610 3.262 2.965 3.533 . 0 0 "[ . 1 . 2]" 1
653 1 37 TRP H 1 37 TRP HB2 . . 3.410 2.659 2.602 2.770 . 0 0 "[ . 1 . 2]" 1
654 1 37 TRP H 1 37 TRP HB3 . . 3.940 3.729 3.689 3.784 . 0 0 "[ . 1 . 2]" 1
655 1 37 TRP H 1 37 TRP HD1 . . 3.430 2.435 2.248 2.670 . 0 0 "[ . 1 . 2]" 1
656 1 37 TRP H 1 37 TRP HE1 . . 4.880 4.672 4.564 4.867 . 0 0 "[ . 1 . 2]" 1
657 1 37 TRP H 1 38 ARG H . . 3.060 2.020 1.943 2.131 . 0 0 "[ . 1 . 2]" 1
658 1 37 TRP H 1 38 ARG HB2 . . 4.650 4.480 4.263 4.636 . 0 0 "[ . 1 . 2]" 1
659 1 37 TRP H 1 38 ARG HB3 . . 4.220 4.148 4.039 4.224 0.004 13 0 "[ . 1 . 2]" 1
660 1 37 TRP H 1 39 ASN H . . 4.520 4.393 4.289 4.529 0.009 15 0 "[ . 1 . 2]" 1
661 1 37 TRP HA 1 37 TRP HE3 . . 4.490 3.391 3.228 3.628 . 0 0 "[ . 1 . 2]" 1
662 1 37 TRP HA 1 42 SER H . . 4.690 3.732 3.409 4.004 . 0 0 "[ . 1 . 2]" 1
663 1 37 TRP HA 1 42 SER HB2 . . 4.530 3.521 2.893 3.958 . 0 0 "[ . 1 . 2]" 1
664 1 37 TRP HA 1 42 SER HG . . 4.500 4.331 3.955 4.511 0.011 17 0 "[ . 1 . 2]" 1
665 1 37 TRP HB2 1 37 TRP HE1 . . 5.040 4.815 4.799 4.842 . 0 0 "[ . 1 . 2]" 1
666 1 37 TRP HB2 1 38 ARG H . . 4.060 3.049 2.893 3.391 . 0 0 "[ . 1 . 2]" 1
667 1 37 TRP HB2 1 101 VAL MG1 . . 4.300 2.774 2.578 2.945 . 0 0 "[ . 1 . 2]" 1
668 1 37 TRP HB2 1 101 VAL MG2 . . 4.380 3.462 3.260 3.738 . 0 0 "[ . 1 . 2]" 1
669 1 37 TRP HB3 1 43 PHE HZ . . 4.720 3.657 3.331 4.004 . 0 0 "[ . 1 . 2]" 1
670 1 37 TRP HB3 1 90 MET ME . . 3.790 3.193 2.953 3.376 . 0 0 "[ . 1 . 2]" 1
671 1 37 TRP HB3 1 101 VAL MG1 . . 4.610 3.279 3.023 3.562 . 0 0 "[ . 1 . 2]" 1
672 1 37 TRP HD1 1 38 ARG H . . 4.580 4.132 4.026 4.268 . 0 0 "[ . 1 . 2]" 1
673 1 37 TRP HD1 1 101 VAL MG1 . . 4.260 3.267 2.879 3.600 . 0 0 "[ . 1 . 2]" 1
674 1 37 TRP HE1 1 101 VAL MG1 . . 4.420 4.072 3.646 4.331 . 0 0 "[ . 1 . 2]" 1
675 1 37 TRP HE1 1 105 LEU MD1 . . 4.340 3.286 3.043 3.603 . 0 0 "[ . 1 . 2]" 1
676 1 37 TRP HE3 1 42 SER HB2 . . 4.630 2.630 2.345 2.870 . 0 0 "[ . 1 . 2]" 1
677 1 37 TRP HE3 1 42 SER HB3 . . 4.740 3.841 3.281 4.152 . 0 0 "[ . 1 . 2]" 1
678 1 37 TRP HE3 1 43 PHE H . . 4.200 2.941 2.545 3.294 . 0 0 "[ . 1 . 2]" 1
679 1 37 TRP HH2 1 46 ILE MD . . 3.350 2.193 1.999 2.459 . 0 0 "[ . 1 . 2]" 1
680 1 37 TRP HH2 1 105 LEU MD1 . . 4.590 3.234 2.795 3.739 . 0 0 "[ . 1 . 2]" 1
681 1 37 TRP HH2 1 105 LEU MD2 . . 4.110 2.336 2.066 2.803 . 0 0 "[ . 1 . 2]" 1
682 1 37 TRP HZ2 1 46 ILE MD . . 4.670 4.309 4.016 4.579 . 0 0 "[ . 1 . 2]" 1
683 1 37 TRP HZ2 1 105 LEU MD1 . . 4.150 2.642 2.220 2.934 . 0 0 "[ . 1 . 2]" 1
684 1 37 TRP HZ2 1 105 LEU MD2 . . 4.470 3.321 2.948 3.666 . 0 0 "[ . 1 . 2]" 1
685 1 37 TRP HZ3 1 43 PHE H . . 4.560 3.572 3.293 4.089 . 0 0 "[ . 1 . 2]" 1
686 1 37 TRP HZ3 1 46 ILE MD . . 3.530 2.091 1.944 2.423 . 0 0 "[ . 1 . 2]" 1
687 1 37 TRP HZ3 1 105 LEU MD2 . . 4.000 2.458 2.087 2.810 . 0 0 "[ . 1 . 2]" 1
688 1 38 ARG H 1 38 ARG HB2 . . 3.280 2.679 2.547 2.819 . 0 0 "[ . 1 . 2]" 1
689 1 38 ARG H 1 38 ARG HB3 . . 3.110 2.450 2.324 2.585 . 0 0 "[ . 1 . 2]" 1
690 1 38 ARG H 1 38 ARG QD . . 4.790 4.527 4.437 4.680 . 0 0 "[ . 1 . 2]" 1
691 1 38 ARG H 1 38 ARG HG2 . . 5.170 4.425 4.307 4.504 . 0 0 "[ . 1 . 2]" 1
692 1 38 ARG H 1 38 ARG HG3 . . 4.620 4.478 4.451 4.520 . 0 0 "[ . 1 . 2]" 1
693 1 38 ARG H 1 39 ASN H . . 3.530 3.059 2.897 3.168 . 0 0 "[ . 1 . 2]" 1
694 1 38 ARG H 1 40 GLY H . . 4.730 4.537 4.311 4.690 . 0 0 "[ . 1 . 2]" 1
695 1 38 ARG H 1 90 MET ME . . 4.600 3.440 3.229 3.673 . 0 0 "[ . 1 . 2]" 1
696 1 38 ARG HA 1 38 ARG QD . . 4.670 3.816 3.664 4.253 . 0 0 "[ . 1 . 2]" 1
697 1 38 ARG HA 1 38 ARG HG2 . . 4.060 3.548 2.902 3.707 . 0 0 "[ . 1 . 2]" 1
698 1 38 ARG HA 1 38 ARG HG3 . . 3.880 2.692 2.585 2.937 . 0 0 "[ . 1 . 2]" 1
699 1 38 ARG HA 1 90 MET ME . . 3.370 2.033 1.873 2.352 . 0 0 "[ . 1 . 2]" 1
700 1 38 ARG HA 1 96 PRO QG . . 4.010 2.907 2.387 3.296 . 0 0 "[ . 1 . 2]" 1
701 1 38 ARG HB2 1 39 ASN H . . 4.240 3.928 3.805 4.088 . 0 0 "[ . 1 . 2]" 1
702 1 38 ARG HB2 1 90 MET ME . . 4.570 3.987 3.735 4.249 . 0 0 "[ . 1 . 2]" 1
703 1 38 ARG HB2 1 96 PRO HD2 . . 4.400 3.323 2.929 3.660 . 0 0 "[ . 1 . 2]" 1
704 1 38 ARG HB2 1 96 PRO HD3 . . 4.370 2.695 2.404 3.042 . 0 0 "[ . 1 . 2]" 1
705 1 38 ARG HB2 1 96 PRO QG . . 4.140 2.772 2.423 3.077 . 0 0 "[ . 1 . 2]" 1
706 1 38 ARG HB3 1 38 ARG QD . . 3.700 2.771 2.272 2.998 . 0 0 "[ . 1 . 2]" 1
707 1 38 ARG HB3 1 38 ARG HE . . 5.460 3.740 2.251 4.964 . 0 0 "[ . 1 . 2]" 1
708 1 38 ARG HB3 1 39 ASN H . . 3.360 2.561 2.369 2.807 . 0 0 "[ . 1 . 2]" 1
709 1 38 ARG QD 1 39 ASN H . . 4.880 4.691 3.713 4.878 . 0 0 "[ . 1 . 2]" 1
710 1 38 ARG QD 1 65 ILE MD . . 4.090 3.683 2.664 4.097 0.007 15 0 "[ . 1 . 2]" 1
711 1 38 ARG QD 1 94 ALA HA . . 4.160 3.873 3.480 4.157 . 0 0 "[ . 1 . 2]" 1
712 1 38 ARG QD 1 95 ILE HA . . 4.870 3.136 2.656 4.874 0.004 14 0 "[ . 1 . 2]" 1
713 1 38 ARG QD 1 96 PRO HD3 . . 4.710 2.630 2.092 4.229 . 0 0 "[ . 1 . 2]" 1
714 1 38 ARG HG2 1 39 ASN H . . 4.180 3.163 2.790 3.522 . 0 0 "[ . 1 . 2]" 1
715 1 38 ARG HG2 1 65 ILE MD . . 3.940 3.018 2.602 3.279 . 0 0 "[ . 1 . 2]" 1
716 1 38 ARG HG2 1 65 ILE MG . . 4.210 2.780 2.390 3.200 . 0 0 "[ . 1 . 2]" 1
717 1 38 ARG HG3 1 65 ILE MD . . 4.050 3.606 3.230 4.041 . 0 0 "[ . 1 . 2]" 1
718 1 38 ARG HG3 1 65 ILE MG . . 4.160 2.785 2.348 3.857 . 0 0 "[ . 1 . 2]" 1
719 1 38 ARG HG3 1 90 MET HA . . 4.560 4.087 3.840 4.372 . 0 0 "[ . 1 . 2]" 1
720 1 39 ASN H 1 39 ASN HB2 . . 3.640 3.528 3.499 3.578 . 0 0 "[ . 1 . 2]" 1
721 1 39 ASN H 1 39 ASN QB . . 3.120 2.778 2.622 2.873 . 0 0 "[ . 1 . 2]" 1
722 1 39 ASN H 1 39 ASN HB3 . . 3.640 2.909 2.696 3.053 . 0 0 "[ . 1 . 2]" 1
723 1 39 ASN H 1 39 ASN HD21 . . 4.440 4.025 3.872 4.411 . 0 0 "[ . 1 . 2]" 1
724 1 39 ASN H 1 39 ASN HD22 . . 4.810 3.854 3.727 4.273 . 0 0 "[ . 1 . 2]" 1
725 1 39 ASN H 1 40 GLY H . . 3.430 2.718 2.501 2.928 . 0 0 "[ . 1 . 2]" 1
726 1 39 ASN H 1 40 GLY QA . . 4.600 4.473 4.335 4.602 0.002 10 0 "[ . 1 . 2]" 1
727 1 39 ASN H 1 65 ILE MD . . 5.320 4.954 4.638 5.129 . 0 0 "[ . 1 . 2]" 1
728 1 39 ASN H 1 65 ILE MG . . 4.610 4.009 3.780 4.249 . 0 0 "[ . 1 . 2]" 1
729 1 39 ASN HA 1 39 ASN HD21 . . 4.650 4.544 4.484 4.633 . 0 0 "[ . 1 . 2]" 1
730 1 39 ASN HA 1 65 ILE H . . 5.340 4.880 4.707 5.132 . 0 0 "[ . 1 . 2]" 1
731 1 39 ASN HA 1 65 ILE HA . . 3.870 2.247 2.000 2.620 . 0 0 "[ . 1 . 2]" 1
732 1 39 ASN HA 1 65 ILE MD . . 3.570 3.493 3.183 3.572 0.002 19 0 "[ . 1 . 2]" 1
733 1 39 ASN HA 1 65 ILE HG12 . . 4.150 2.244 2.054 2.581 . 0 0 "[ . 1 . 2]" 1
734 1 39 ASN HA 1 65 ILE HG13 . . 4.220 3.832 3.575 4.106 . 0 0 "[ . 1 . 2]" 1
735 1 39 ASN HA 1 65 ILE MG . . 3.530 2.248 1.983 2.564 . 0 0 "[ . 1 . 2]" 1
736 1 39 ASN HA 1 69 ASN HD22 . . 4.820 3.761 3.551 3.976 . 0 0 "[ . 1 . 2]" 1
737 1 39 ASN QB 1 39 ASN HD22 . . 3.490 3.213 3.213 3.214 . 0 0 "[ . 1 . 2]" 1
738 1 39 ASN QB 1 65 ILE MD . . 3.930 3.852 3.593 3.933 0.003 9 0 "[ . 1 . 2]" 1
739 1 39 ASN QB 1 65 ILE HG12 . . 4.550 2.852 2.548 3.060 . 0 0 "[ . 1 . 2]" 1
740 1 39 ASN QB 1 65 ILE HG13 . . 4.870 4.131 3.753 4.514 . 0 0 "[ . 1 . 2]" 1
741 1 39 ASN HB2 1 39 ASN HD22 . . 4.000 3.670 3.507 3.731 . 0 0 "[ . 1 . 2]" 1
742 1 39 ASN HB2 1 40 GLY H . . 4.720 3.145 2.993 3.334 . 0 0 "[ . 1 . 2]" 1
743 1 39 ASN HB3 1 39 ASN HD22 . . 4.000 3.557 3.507 3.728 . 0 0 "[ . 1 . 2]" 1
744 1 39 ASN HB3 1 40 GLY H . . 4.720 3.926 3.815 4.061 . 0 0 "[ . 1 . 2]" 1
745 1 39 ASN HD21 1 41 LEU QB . . 4.670 4.121 2.726 4.498 . 0 0 "[ . 1 . 2]" 1
746 1 39 ASN HD21 1 41 LEU MD1 . . 4.060 2.682 2.022 3.195 . 0 0 "[ . 1 . 2]" 1
747 1 39 ASN HD21 1 41 LEU HG . . 4.810 3.038 1.957 3.527 . 0 0 "[ . 1 . 2]" 1
748 1 39 ASN HD21 1 62 PRO HB2 . . 4.560 3.499 2.875 3.938 . 0 0 "[ . 1 . 2]" 1
749 1 39 ASN HD21 1 62 PRO HB3 . . 4.350 2.963 2.542 3.216 . 0 0 "[ . 1 . 2]" 1
750 1 39 ASN HD22 1 41 LEU QB . . 4.780 3.320 1.926 3.691 . 0 0 "[ . 1 . 2]" 1
751 1 39 ASN HD22 1 41 LEU MD1 . . 3.820 2.532 1.880 2.940 . 0 0 "[ . 1 . 2]" 1
752 1 39 ASN HD22 1 62 PRO HB2 . . 5.360 4.981 4.208 5.349 . 0 0 "[ . 1 . 2]" 1
753 1 39 ASN HD22 1 62 PRO HB3 . . 4.360 4.085 3.336 4.364 0.004 11 0 "[ . 1 . 2]" 1
754 1 40 GLY H 1 41 LEU H . . 3.700 2.046 1.878 2.291 . 0 0 "[ . 1 . 2]" 1
755 1 40 GLY H 1 41 LEU HA . . 4.800 4.675 4.553 4.797 . 0 0 "[ . 1 . 2]" 1
756 1 40 GLY H 1 41 LEU QB . . 4.320 3.941 3.803 4.104 . 0 0 "[ . 1 . 2]" 1
757 1 40 GLY H 1 42 SER H . . 4.660 4.215 3.560 4.489 . 0 0 "[ . 1 . 2]" 1
758 1 40 GLY H 1 43 PHE H . . 4.860 4.727 4.204 4.863 0.003 13 0 "[ . 1 . 2]" 1
759 1 40 GLY H 1 43 PHE QD . . 4.410 4.188 3.914 4.346 . 0 0 "[ . 1 . 2]" 1
760 1 40 GLY H 1 69 ASN HD21 . . 4.640 4.233 3.937 4.499 . 0 0 "[ . 1 . 2]" 1
761 1 40 GLY H 1 69 ASN HD22 . . 3.860 3.294 2.978 3.553 . 0 0 "[ . 1 . 2]" 1
762 1 40 GLY H 1 90 MET ME . . 4.500 4.281 3.903 4.480 . 0 0 "[ . 1 . 2]" 1
763 1 40 GLY QA 1 42 SER H . . 5.410 4.337 3.816 4.581 . 0 0 "[ . 1 . 2]" 1
764 1 40 GLY QA 1 43 PHE H . . 4.240 3.392 3.001 3.549 . 0 0 "[ . 1 . 2]" 1
765 1 40 GLY QA 1 43 PHE QD . . 4.390 2.116 1.986 2.494 . 0 0 "[ . 1 . 2]" 1
766 1 40 GLY QA 1 44 CYS H . . 4.640 4.100 3.729 4.248 . 0 0 "[ . 1 . 2]" 1
767 1 40 GLY QA 1 68 ASN HB2 . . 4.300 2.934 2.572 3.144 . 0 0 "[ . 1 . 2]" 1
768 1 40 GLY QA 1 68 ASN HB3 . . 4.250 2.298 2.038 2.819 . 0 0 "[ . 1 . 2]" 1
769 1 40 GLY QA 1 69 ASN HD21 . . 4.690 2.376 2.177 2.860 . 0 0 "[ . 1 . 2]" 1
770 1 40 GLY QA 1 69 ASN HD22 . . 4.390 2.374 2.124 2.648 . 0 0 "[ . 1 . 2]" 1
771 1 41 LEU H 1 41 LEU QB . . 3.180 2.325 2.213 2.502 . 0 0 "[ . 1 . 2]" 1
772 1 41 LEU H 1 41 LEU MD1 . . 4.080 3.814 3.595 3.991 . 0 0 "[ . 1 . 2]" 1
773 1 41 LEU H 1 41 LEU MD2 . . 3.790 3.532 2.788 3.743 . 0 0 "[ . 1 . 2]" 1
774 1 41 LEU H 1 41 LEU HG . . 3.260 2.676 2.152 2.911 . 0 0 "[ . 1 . 2]" 1
775 1 41 LEU H 1 42 SER H . . 3.510 2.726 2.296 3.099 . 0 0 "[ . 1 . 2]" 1
776 1 41 LEU H 1 43 PHE H . . 4.720 3.791 3.437 4.320 . 0 0 "[ . 1 . 2]" 1
777 1 41 LEU H 1 44 CYS HB2 . . 5.500 5.448 5.138 5.503 0.003 1 0 "[ . 1 . 2]" 1
778 1 41 LEU H 1 68 ASN HB3 . . 5.200 4.247 3.477 4.647 . 0 0 "[ . 1 . 2]" 1
779 1 41 LEU H 1 68 ASN HD21 . . 4.750 3.814 2.725 4.355 . 0 0 "[ . 1 . 2]" 1
780 1 41 LEU HA 1 41 LEU MD2 . . 3.060 1.993 1.907 2.128 . 0 0 "[ . 1 . 2]" 1
781 1 41 LEU HA 1 44 CYS H . . 3.720 3.588 3.312 3.721 0.001 7 0 "[ . 1 . 2]" 1
782 1 41 LEU HA 1 44 CYS HB2 . . 4.210 3.132 3.046 3.211 . 0 0 "[ . 1 . 2]" 1
783 1 41 LEU HA 1 44 CYS HB3 . . 4.840 4.802 4.705 4.850 0.010 16 0 "[ . 1 . 2]" 1
784 1 41 LEU HA 1 44 CYS HG . . 4.300 4.163 3.922 4.298 . 0 0 "[ . 1 . 2]" 1
785 1 41 LEU HA 1 45 ALA H . . 4.270 3.964 3.548 4.203 . 0 0 "[ . 1 . 2]" 1
786 1 41 LEU HA 1 45 ALA MB . . 4.530 4.299 3.954 4.439 . 0 0 "[ . 1 . 2]" 1
787 1 41 LEU HA 1 57 TYR QE . . 4.210 2.919 2.541 3.306 . 0 0 "[ . 1 . 2]" 1
788 1 41 LEU HA 1 60 LEU MD1 . . 4.360 4.030 3.810 4.236 . 0 0 "[ . 1 . 2]" 1
789 1 41 LEU HA 1 68 ASN HD21 . . 4.520 3.552 2.891 3.982 . 0 0 "[ . 1 . 2]" 1
790 1 41 LEU QB 1 41 LEU MD1 . . 3.170 2.083 2.015 2.099 . 0 0 "[ . 1 . 2]" 1
791 1 41 LEU QB 1 41 LEU MD2 . . 3.270 2.314 2.243 2.434 . 0 0 "[ . 1 . 2]" 1
792 1 41 LEU QB 1 42 SER H . . 3.560 2.189 2.012 2.602 . 0 0 "[ . 1 . 2]" 1
793 1 41 LEU QB 1 43 PHE H . . 4.680 4.348 4.046 4.587 . 0 0 "[ . 1 . 2]" 1
794 1 41 LEU QB 1 44 CYS HB2 . . 5.330 4.850 4.746 4.952 . 0 0 "[ . 1 . 2]" 1
795 1 41 LEU QB 1 45 ALA H . . 4.690 4.547 4.385 4.649 . 0 0 "[ . 1 . 2]" 1
796 1 41 LEU QB 1 57 TYR QD . . 5.280 4.890 4.647 5.073 . 0 0 "[ . 1 . 2]" 1
797 1 41 LEU QB 1 57 TYR QE . . 4.000 2.937 2.652 3.234 . 0 0 "[ . 1 . 2]" 1
798 1 41 LEU MD1 1 62 PRO HA . . 3.410 2.842 2.361 3.137 . 0 0 "[ . 1 . 2]" 1
799 1 41 LEU MD1 1 62 PRO HB2 . . 4.010 3.569 3.373 3.786 . 0 0 "[ . 1 . 2]" 1
800 1 41 LEU MD1 1 62 PRO HB3 . . 3.500 2.013 1.924 2.187 . 0 0 "[ . 1 . 2]" 1
801 1 41 LEU MD1 1 62 PRO HD2 . . 4.710 4.379 3.722 4.712 0.002 4 0 "[ . 1 . 2]" 1
802 1 41 LEU MD1 1 62 PRO HD3 . . 3.710 2.989 2.197 3.412 . 0 0 "[ . 1 . 2]" 1
803 1 41 LEU MD1 1 62 PRO HG2 . . 4.660 4.399 3.997 4.592 . 0 0 "[ . 1 . 2]" 1
804 1 41 LEU MD1 1 62 PRO HG3 . . 3.900 3.429 3.076 3.679 . 0 0 "[ . 1 . 2]" 1
805 1 41 LEU MD1 1 68 ASN HD22 . . 4.820 4.438 4.094 4.711 . 0 0 "[ . 1 . 2]" 1
806 1 41 LEU MD2 1 42 SER H . . 4.700 4.503 4.417 4.681 . 0 0 "[ . 1 . 2]" 1
807 1 41 LEU MD2 1 44 CYS HB2 . . 4.520 4.044 3.822 4.167 . 0 0 "[ . 1 . 2]" 1
808 1 41 LEU MD2 1 44 CYS HG . . 5.000 4.795 4.576 4.996 . 0 0 "[ . 1 . 2]" 1
809 1 41 LEU MD2 1 57 TYR QE . . 3.760 3.032 2.698 3.274 . 0 0 "[ . 1 . 2]" 1
810 1 41 LEU MD2 1 60 LEU HA . . 5.500 5.284 4.967 5.501 0.001 17 0 "[ . 1 . 2]" 1
811 1 41 LEU MD2 1 60 LEU HB3 . . 3.660 3.337 3.049 3.523 . 0 0 "[ . 1 . 2]" 1
812 1 41 LEU MD2 1 61 ASN H . . 4.190 3.463 3.068 3.747 . 0 0 "[ . 1 . 2]" 1
813 1 41 LEU MD2 1 62 PRO HA . . 3.910 2.699 2.409 2.957 . 0 0 "[ . 1 . 2]" 1
814 1 41 LEU MD2 1 62 PRO HB2 . . 4.760 4.638 4.408 4.763 0.003 20 0 "[ . 1 . 2]" 1
815 1 41 LEU MD2 1 62 PRO HB3 . . 4.260 3.441 3.200 3.659 . 0 0 "[ . 1 . 2]" 1
816 1 41 LEU MD2 1 62 PRO HG3 . . 5.500 4.549 4.376 4.735 . 0 0 "[ . 1 . 2]" 1
817 1 41 LEU MD2 1 68 ASN HA . . 5.500 5.194 4.856 5.474 . 0 0 "[ . 1 . 2]" 1
818 1 41 LEU MD2 1 68 ASN HB2 . . 4.840 4.612 4.380 4.835 . 0 0 "[ . 1 . 2]" 1
819 1 41 LEU MD2 1 68 ASN HB3 . . 4.570 3.850 3.571 4.162 . 0 0 "[ . 1 . 2]" 1
820 1 41 LEU MD2 1 68 ASN HD21 . . 4.340 2.439 2.101 2.785 . 0 0 "[ . 1 . 2]" 1
821 1 41 LEU MD2 1 68 ASN HD22 . . 3.830 2.317 1.977 2.657 . 0 0 "[ . 1 . 2]" 1
822 1 41 LEU HG 1 62 PRO HA . . 4.230 3.043 2.487 3.301 . 0 0 "[ . 1 . 2]" 1
823 1 41 LEU HG 1 68 ASN HD22 . . 5.350 3.786 3.315 4.224 . 0 0 "[ . 1 . 2]" 1
824 1 42 SER H 1 42 SER HB2 . . 3.550 2.583 2.395 2.815 . 0 0 "[ . 1 . 2]" 1
825 1 42 SER H 1 42 SER HB3 . . 3.880 3.593 3.567 3.608 . 0 0 "[ . 1 . 2]" 1
826 1 42 SER H 1 42 SER HG . . 3.690 2.127 1.899 2.421 . 0 0 "[ . 1 . 2]" 1
827 1 42 SER H 1 43 PHE H . . 3.510 2.799 2.517 2.988 . 0 0 "[ . 1 . 2]" 1
828 1 42 SER H 1 45 ALA MB . . 5.040 4.266 4.141 4.379 . 0 0 "[ . 1 . 2]" 1
829 1 42 SER HA 1 45 ALA H . . 4.440 3.486 3.227 3.976 . 0 0 "[ . 1 . 2]" 1
830 1 42 SER HA 1 45 ALA MB . . 3.620 2.408 2.228 2.715 . 0 0 "[ . 1 . 2]" 1
831 1 42 SER HA 1 46 ILE H . . 4.750 3.784 3.284 4.385 . 0 0 "[ . 1 . 2]" 1
832 1 42 SER HB2 1 43 PHE H . . 3.780 2.724 2.341 3.097 . 0 0 "[ . 1 . 2]" 1
833 1 42 SER HB2 1 45 ALA MB . . 5.500 4.913 4.740 5.170 . 0 0 "[ . 1 . 2]" 1
834 1 42 SER HB3 1 43 PHE H . . 4.130 3.761 3.525 3.982 . 0 0 "[ . 1 . 2]" 1
835 1 42 SER HG 1 43 PHE H . . 4.480 4.253 4.086 4.413 . 0 0 "[ . 1 . 2]" 1
836 1 43 PHE H 1 43 PHE HB2 . . 3.760 2.249 2.181 2.318 . 0 0 "[ . 1 . 2]" 1
837 1 43 PHE H 1 43 PHE QB . . 3.220 2.225 2.160 2.290 . 0 0 "[ . 1 . 2]" 1
838 1 43 PHE H 1 43 PHE HB3 . . 3.760 3.530 3.490 3.563 . 0 0 "[ . 1 . 2]" 1
839 1 43 PHE H 1 43 PHE QD . . 3.810 3.268 3.094 3.480 . 0 0 "[ . 1 . 2]" 1
840 1 43 PHE H 1 44 CYS H . . 3.570 2.760 2.474 2.941 . 0 0 "[ . 1 . 2]" 1
841 1 43 PHE H 1 45 ALA H . . 4.660 4.045 3.721 4.605 . 0 0 "[ . 1 . 2]" 1
842 1 43 PHE H 1 45 ALA MB . . 4.790 4.588 4.447 4.776 . 0 0 "[ . 1 . 2]" 1
843 1 43 PHE HA 1 46 ILE H . . 4.510 4.002 3.800 4.234 . 0 0 "[ . 1 . 2]" 1
844 1 43 PHE QB 1 44 CYS H . . 3.730 2.517 2.358 2.653 . 0 0 "[ . 1 . 2]" 1
845 1 43 PHE QB 1 72 ALA H . . 5.290 4.309 4.113 4.502 . 0 0 "[ . 1 . 2]" 1
846 1 43 PHE QB 1 72 ALA MB . . 3.130 2.128 1.978 2.313 . 0 0 "[ . 1 . 2]" 1
847 1 43 PHE QB 1 76 PHE QE . . 4.100 2.671 2.268 2.947 . 0 0 "[ . 1 . 2]" 1
848 1 43 PHE HB2 1 44 CYS H . . 4.520 2.635 2.449 2.781 . 0 0 "[ . 1 . 2]" 1
849 1 43 PHE HB2 1 72 ALA MB . . 3.950 3.310 3.055 3.580 . 0 0 "[ . 1 . 2]" 1
850 1 43 PHE HB3 1 44 CYS H . . 4.520 3.201 2.990 3.366 . 0 0 "[ . 1 . 2]" 1
851 1 43 PHE HB3 1 72 ALA MB . . 3.950 2.155 1.998 2.343 . 0 0 "[ . 1 . 2]" 1
852 1 43 PHE QD 1 44 CYS H . . 4.640 4.450 4.328 4.553 . 0 0 "[ . 1 . 2]" 1
853 1 43 PHE QD 1 46 ILE MD . . 3.930 3.517 3.239 3.820 . 0 0 "[ . 1 . 2]" 1
854 1 43 PHE QD 1 72 ALA MB . . 4.010 3.509 3.255 3.709 . 0 0 "[ . 1 . 2]" 1
855 1 43 PHE QD 1 73 TYR QE . . 4.760 4.526 4.034 4.759 . 0 0 "[ . 1 . 2]" 1
856 1 43 PHE QD 1 76 PHE QE . . 4.640 2.767 2.311 3.641 . 0 0 "[ . 1 . 2]" 1
857 1 43 PHE QD 1 90 MET ME . . 4.010 3.593 3.349 3.837 . 0 0 "[ . 1 . 2]" 1
858 1 43 PHE QD 1 105 LEU MD2 . . 3.900 3.237 2.597 3.743 . 0 0 "[ . 1 . 2]" 1
859 1 43 PHE QD 1 108 ILE MD . . 4.230 3.750 3.413 4.169 . 0 0 "[ . 1 . 2]" 1
860 1 43 PHE QD 1 108 ILE HG12 . . 5.470 4.257 3.981 4.680 . 0 0 "[ . 1 . 2]" 1
861 1 43 PHE QD 1 108 ILE MG . . 5.500 4.684 4.388 5.039 . 0 0 "[ . 1 . 2]" 1
862 1 43 PHE QE 1 73 TYR QE . . 4.470 4.183 3.770 4.470 0.000 12 0 "[ . 1 . 2]" 1
863 1 43 PHE QE 1 85 LEU MD2 . . 4.020 2.996 2.740 3.394 . 0 0 "[ . 1 . 2]" 1
864 1 43 PHE QE 1 90 MET ME . . 3.160 2.502 1.888 2.820 . 0 0 "[ . 1 . 2]" 1
865 1 43 PHE QE 1 101 VAL MG1 . . 4.170 3.087 2.738 3.425 . 0 0 "[ . 1 . 2]" 1
866 1 43 PHE QE 1 104 TYR QD . . 3.890 2.709 2.364 3.426 . 0 0 "[ . 1 . 2]" 1
867 1 43 PHE QE 1 105 LEU H . . 4.530 4.213 3.740 4.523 . 0 0 "[ . 1 . 2]" 1
868 1 43 PHE QE 1 105 LEU MD1 . . 4.640 3.920 3.431 4.379 . 0 0 "[ . 1 . 2]" 1
869 1 43 PHE QE 1 105 LEU MD2 . . 3.570 2.445 1.993 2.972 . 0 0 "[ . 1 . 2]" 1
870 1 43 PHE QE 1 105 LEU HG . . 4.270 2.723 2.143 3.385 . 0 0 "[ . 1 . 2]" 1
871 1 43 PHE HZ 1 85 LEU MD2 . . 3.690 3.208 2.879 3.662 . 0 0 "[ . 1 . 2]" 1
872 1 43 PHE HZ 1 90 MET ME . . 4.570 4.065 3.275 4.458 . 0 0 "[ . 1 . 2]" 1
873 1 43 PHE HZ 1 101 VAL HA . . 4.700 3.862 3.551 4.252 . 0 0 "[ . 1 . 2]" 1
874 1 43 PHE HZ 1 101 VAL MG1 . . 3.560 2.484 2.253 2.741 . 0 0 "[ . 1 . 2]" 1
875 1 43 PHE HZ 1 101 VAL MG2 . . 4.070 3.985 3.799 4.072 0.002 12 0 "[ . 1 . 2]" 1
876 1 43 PHE HZ 1 104 TYR QD . . 4.280 2.684 2.062 3.214 . 0 0 "[ . 1 . 2]" 1
877 1 43 PHE HZ 1 105 LEU MD2 . . 4.320 3.734 3.199 4.143 . 0 0 "[ . 1 . 2]" 1
878 1 44 CYS H 1 44 CYS HB2 . . 3.640 2.322 2.273 2.386 . 0 0 "[ . 1 . 2]" 1
879 1 44 CYS H 1 44 CYS HB3 . . 3.600 3.565 3.547 3.585 . 0 0 "[ . 1 . 2]" 1
880 1 44 CYS H 1 44 CYS HG . . 3.180 2.994 2.733 3.183 0.003 14 0 "[ . 1 . 2]" 1
881 1 44 CYS H 1 45 ALA H . . 3.480 2.550 2.386 2.792 . 0 0 "[ . 1 . 2]" 1
882 1 44 CYS H 1 45 ALA MB . . 4.270 4.159 4.034 4.279 0.009 9 0 "[ . 1 . 2]" 1
883 1 44 CYS H 1 46 ILE H . . 4.650 4.308 4.095 4.464 . 0 0 "[ . 1 . 2]" 1
884 1 44 CYS H 1 55 ILE MG . . 5.250 5.192 4.905 5.254 0.004 8 0 "[ . 1 . 2]" 1
885 1 44 CYS H 1 57 TYR QE . . 4.660 4.285 4.086 4.497 . 0 0 "[ . 1 . 2]" 1
886 1 44 CYS H 1 60 LEU MD1 . . 4.940 4.717 4.553 4.866 . 0 0 "[ . 1 . 2]" 1
887 1 44 CYS H 1 72 ALA MB . . 4.360 3.753 3.574 4.015 . 0 0 "[ . 1 . 2]" 1
888 1 44 CYS HA 1 44 CYS HG . . 4.150 3.653 3.536 3.787 . 0 0 "[ . 1 . 2]" 1
889 1 44 CYS HA 1 45 ALA MB . . 5.020 5.001 4.983 5.015 . 0 0 "[ . 1 . 2]" 1
890 1 44 CYS HA 1 46 ILE H . . 4.960 4.504 3.834 4.901 . 0 0 "[ . 1 . 2]" 1
891 1 44 CYS HA 1 47 LEU H . . 3.880 3.753 3.260 3.890 0.010 16 0 "[ . 1 . 2]" 1
892 1 44 CYS HA 1 47 LEU HB2 . . 4.270 4.046 3.754 4.238 . 0 0 "[ . 1 . 2]" 1
893 1 44 CYS HA 1 47 LEU QB . . 3.620 3.030 2.927 3.156 . 0 0 "[ . 1 . 2]" 1
894 1 44 CYS HA 1 47 LEU HB3 . . 4.270 3.132 3.041 3.274 . 0 0 "[ . 1 . 2]" 1
895 1 44 CYS HA 1 47 LEU MD2 . . 4.050 3.767 3.603 3.958 . 0 0 "[ . 1 . 2]" 1
896 1 44 CYS HA 1 48 HIS H . . 4.570 4.233 4.022 4.470 . 0 0 "[ . 1 . 2]" 1
897 1 44 CYS HA 1 55 ILE MD . . 4.200 3.592 3.399 3.857 . 0 0 "[ . 1 . 2]" 1
898 1 44 CYS HA 1 55 ILE MG . . 3.670 3.359 3.094 3.641 . 0 0 "[ . 1 . 2]" 1
899 1 44 CYS HA 1 60 LEU MD1 . . 4.910 4.588 4.451 4.824 . 0 0 "[ . 1 . 2]" 1
900 1 44 CYS HA 1 72 ALA MB . . 3.580 3.059 2.806 3.463 . 0 0 "[ . 1 . 2]" 1
901 1 44 CYS HB2 1 45 ALA H . . 4.000 2.714 2.285 2.939 . 0 0 "[ . 1 . 2]" 1
902 1 44 CYS HB2 1 55 ILE MG . . 4.390 4.063 3.667 4.240 . 0 0 "[ . 1 . 2]" 1
903 1 44 CYS HB2 1 57 TYR QD . . 3.470 2.096 1.998 2.338 . 0 0 "[ . 1 . 2]" 1
904 1 44 CYS HB2 1 57 TYR QE . . 4.010 3.289 2.899 3.518 . 0 0 "[ . 1 . 2]" 1
905 1 44 CYS HB2 1 60 LEU MD1 . . 3.500 2.898 2.767 3.001 . 0 0 "[ . 1 . 2]" 1
906 1 44 CYS HB2 1 60 LEU MD2 . . 5.500 5.456 5.324 5.517 0.017 16 0 "[ . 1 . 2]" 1
907 1 44 CYS HB2 1 72 ALA MB . . 5.500 4.797 4.576 5.026 . 0 0 "[ . 1 . 2]" 1
908 1 44 CYS HB3 1 45 ALA H . . 4.550 3.516 3.151 3.739 . 0 0 "[ . 1 . 2]" 1
909 1 44 CYS HB3 1 55 ILE QG . . 5.100 3.805 3.515 4.002 . 0 0 "[ . 1 . 2]" 1
910 1 44 CYS HB3 1 55 ILE MG . . 3.910 2.802 2.359 3.022 . 0 0 "[ . 1 . 2]" 1
911 1 44 CYS HB3 1 57 TYR QD . . 4.510 2.111 2.002 2.392 . 0 0 "[ . 1 . 2]" 1
912 1 44 CYS HB3 1 57 TYR QE . . 4.870 4.261 4.026 4.462 . 0 0 "[ . 1 . 2]" 1
913 1 44 CYS HB3 1 60 LEU MD1 . . 3.750 2.671 2.483 2.951 . 0 0 "[ . 1 . 2]" 1
914 1 44 CYS HG 1 45 ALA H . . 5.020 4.917 4.611 5.029 0.009 15 0 "[ . 1 . 2]" 1
915 1 44 CYS HG 1 60 LEU MD1 . . 4.450 3.253 2.975 3.420 . 0 0 "[ . 1 . 2]" 1
916 1 44 CYS HG 1 68 ASN HB2 . . 5.060 4.432 4.208 4.689 . 0 0 "[ . 1 . 2]" 1
917 1 44 CYS HG 1 69 ASN H . . 5.030 4.667 4.362 4.940 . 0 0 "[ . 1 . 2]" 1
918 1 44 CYS HG 1 72 ALA H . . 4.220 3.757 3.477 4.017 . 0 0 "[ . 1 . 2]" 1
919 1 44 CYS HG 1 72 ALA MB . . 3.770 3.613 3.448 3.764 . 0 0 "[ . 1 . 2]" 1
920 1 45 ALA H 1 45 ALA MB . . 2.990 2.147 2.024 2.238 . 0 0 "[ . 1 . 2]" 1
921 1 45 ALA H 1 46 ILE H . . 3.580 2.832 2.622 3.088 . 0 0 "[ . 1 . 2]" 1
922 1 45 ALA H 1 47 LEU H . . 4.800 4.616 4.427 4.805 0.005 9 0 "[ . 1 . 2]" 1
923 1 45 ALA H 1 57 TYR QD . . 4.300 2.852 2.430 3.160 . 0 0 "[ . 1 . 2]" 1
924 1 45 ALA H 1 57 TYR QE . . 3.620 2.744 2.177 3.118 . 0 0 "[ . 1 . 2]" 1
925 1 45 ALA HA 1 48 HIS H . . 4.380 3.561 3.383 3.798 . 0 0 "[ . 1 . 2]" 1
926 1 45 ALA HA 1 57 TYR QD . . 3.780 3.066 2.886 3.330 . 0 0 "[ . 1 . 2]" 1
927 1 45 ALA HA 1 57 TYR QE . . 3.810 3.451 3.198 3.731 . 0 0 "[ . 1 . 2]" 1
928 1 45 ALA MB 1 46 ILE H . . 3.410 2.422 2.238 2.692 . 0 0 "[ . 1 . 2]" 1
929 1 45 ALA MB 1 46 ILE HA . . 4.710 3.712 3.569 3.822 . 0 0 "[ . 1 . 2]" 1
930 1 45 ALA MB 1 46 ILE HB . . 4.680 4.521 4.351 4.608 . 0 0 "[ . 1 . 2]" 1
931 1 45 ALA MB 1 46 ILE HG13 . . 4.760 3.221 3.024 3.495 . 0 0 "[ . 1 . 2]" 1
932 1 45 ALA MB 1 47 LEU H . . 4.920 4.776 4.571 4.931 0.011 11 0 "[ . 1 . 2]" 1
933 1 45 ALA MB 1 48 HIS H . . 5.050 4.513 4.389 4.679 . 0 0 "[ . 1 . 2]" 1
934 1 45 ALA MB 1 49 HIS H . . 5.220 4.691 4.494 4.932 . 0 0 "[ . 1 . 2]" 1
935 1 45 ALA MB 1 57 TYR QD . . 4.080 3.384 3.183 3.694 . 0 0 "[ . 1 . 2]" 1
936 1 45 ALA MB 1 57 TYR QE . . 3.450 2.199 1.995 2.574 . 0 0 "[ . 1 . 2]" 1
937 1 46 ILE H 1 46 ILE HB . . 3.360 2.477 2.373 2.600 . 0 0 "[ . 1 . 2]" 1
938 1 46 ILE H 1 46 ILE MD . . 3.540 3.348 3.122 3.517 . 0 0 "[ . 1 . 2]" 1
939 1 46 ILE H 1 46 ILE HG12 . . 3.810 3.644 3.425 3.810 . 0 0 "[ . 1 . 2]" 1
940 1 46 ILE H 1 46 ILE HG13 . . 3.340 2.229 1.992 2.475 . 0 0 "[ . 1 . 2]" 1
941 1 46 ILE H 1 47 LEU H . . 3.480 2.959 2.749 3.114 . 0 0 "[ . 1 . 2]" 1
942 1 46 ILE H 1 48 HIS H . . 4.900 3.912 3.690 4.162 . 0 0 "[ . 1 . 2]" 1
943 1 46 ILE H 1 55 ILE MD . . 5.500 5.457 5.259 5.512 0.012 11 0 "[ . 1 . 2]" 1
944 1 46 ILE HA 1 46 ILE MD . . 4.140 3.837 3.806 3.888 . 0 0 "[ . 1 . 2]" 1
945 1 46 ILE HA 1 46 ILE HG12 . . 3.750 2.643 2.532 2.771 . 0 0 "[ . 1 . 2]" 1
946 1 46 ILE HA 1 46 ILE HG13 . . 4.000 2.709 2.574 2.811 . 0 0 "[ . 1 . 2]" 1
947 1 46 ILE HA 1 46 ILE MG . . 3.400 2.454 2.300 2.523 . 0 0 "[ . 1 . 2]" 1
948 1 46 ILE HA 1 49 HIS H . . 4.010 3.405 3.281 3.496 . 0 0 "[ . 1 . 2]" 1
949 1 46 ILE HA 1 49 HIS HB2 . . 4.200 2.999 2.808 3.270 . 0 0 "[ . 1 . 2]" 1
950 1 46 ILE HA 1 50 PHE H . . 5.500 4.914 4.633 5.122 . 0 0 "[ . 1 . 2]" 1
951 1 46 ILE HB 1 46 ILE MD . . 3.500 2.279 2.127 2.379 . 0 0 "[ . 1 . 2]" 1
952 1 46 ILE HB 1 47 LEU H . . 3.500 2.264 2.072 2.422 . 0 0 "[ . 1 . 2]" 1
953 1 46 ILE HB 1 76 PHE HZ . . 4.210 2.589 2.093 2.925 . 0 0 "[ . 1 . 2]" 1
954 1 46 ILE MD 1 76 PHE QE . . 4.450 4.223 3.970 4.425 . 0 0 "[ . 1 . 2]" 1
955 1 46 ILE MD 1 105 LEU MD1 . . 4.650 4.259 3.993 4.608 . 0 0 "[ . 1 . 2]" 1
956 1 46 ILE MD 1 105 LEU MD2 . . 3.210 2.692 2.421 3.041 . 0 0 "[ . 1 . 2]" 1
957 1 46 ILE MD 1 108 ILE MD . . 5.500 4.597 4.248 4.993 . 0 0 "[ . 1 . 2]" 1
958 1 46 ILE MD 1 108 ILE HG12 . . 5.250 4.746 4.492 5.068 . 0 0 "[ . 1 . 2]" 1
959 1 46 ILE MD 1 108 ILE MG . . 3.740 3.274 2.913 3.582 . 0 0 "[ . 1 . 2]" 1
960 1 46 ILE MD 1 109 ARG HA . . 5.500 5.455 5.283 5.503 0.003 9 0 "[ . 1 . 2]" 1
961 1 46 ILE HG12 1 46 ILE MG . . 3.420 2.268 2.127 2.357 . 0 0 "[ . 1 . 2]" 1
962 1 46 ILE HG13 1 46 ILE MG . . 3.730 3.177 3.143 3.195 . 0 0 "[ . 1 . 2]" 1
963 1 46 ILE HG13 1 47 LEU H . . 4.440 4.317 4.155 4.427 . 0 0 "[ . 1 . 2]" 1
964 1 46 ILE MG 1 47 LEU H . . 3.810 2.861 2.585 3.063 . 0 0 "[ . 1 . 2]" 1
965 1 46 ILE MG 1 47 LEU HA . . 4.400 3.074 2.860 3.386 . 0 0 "[ . 1 . 2]" 1
966 1 46 ILE MG 1 47 LEU QB . . 4.880 3.704 3.439 3.972 . 0 0 "[ . 1 . 2]" 1
967 1 46 ILE MG 1 47 LEU MD1 . . 4.250 4.027 3.802 4.263 0.013 15 0 "[ . 1 . 2]" 1
968 1 46 ILE MG 1 50 PHE QD . . 3.600 3.284 2.853 3.606 0.006 20 0 "[ . 1 . 2]" 1
969 1 46 ILE MG 1 50 PHE QE . . 3.240 1.948 1.771 2.234 . 0 0 "[ . 1 . 2]" 1
970 1 46 ILE MG 1 108 ILE MD . . 5.500 5.043 4.587 5.319 . 0 0 "[ . 1 . 2]" 1
971 1 46 ILE MG 1 108 ILE HG12 . . 5.080 4.512 4.053 4.960 . 0 0 "[ . 1 . 2]" 1
972 1 46 ILE MG 1 108 ILE MG . . 3.100 2.455 2.033 2.781 . 0 0 "[ . 1 . 2]" 1
973 1 46 ILE MG 1 112 PHE HB2 . . 5.500 5.144 4.613 5.414 . 0 0 "[ . 1 . 2]" 1
974 1 47 LEU H 1 47 LEU HB2 . . 3.420 2.421 2.336 2.481 . 0 0 "[ . 1 . 2]" 1
975 1 47 LEU H 1 47 LEU HB3 . . 3.420 2.593 2.532 2.704 . 0 0 "[ . 1 . 2]" 1
976 1 47 LEU H 1 47 LEU MD1 . . 4.120 3.947 3.791 4.025 . 0 0 "[ . 1 . 2]" 1
977 1 47 LEU H 1 47 LEU MD2 . . 4.380 4.233 4.206 4.268 . 0 0 "[ . 1 . 2]" 1
978 1 47 LEU H 1 47 LEU HG . . 4.640 4.515 4.486 4.542 . 0 0 "[ . 1 . 2]" 1
979 1 47 LEU H 1 48 HIS H . . 3.600 2.712 2.585 2.822 . 0 0 "[ . 1 . 2]" 1
980 1 47 LEU H 1 48 HIS HA . . 5.450 5.304 5.195 5.397 . 0 0 "[ . 1 . 2]" 1
981 1 47 LEU H 1 48 HIS QB . . 4.910 4.476 4.354 4.591 . 0 0 "[ . 1 . 2]" 1
982 1 47 LEU H 1 49 HIS H . . 4.740 4.224 4.044 4.528 . 0 0 "[ . 1 . 2]" 1
983 1 47 LEU H 1 72 ALA MB . . 5.200 4.828 4.614 5.061 . 0 0 "[ . 1 . 2]" 1
984 1 47 LEU H 1 76 PHE HZ . . 3.880 2.629 2.173 3.078 . 0 0 "[ . 1 . 2]" 1
985 1 47 LEU H 1 108 ILE MG . . 5.500 4.840 4.430 5.111 . 0 0 "[ . 1 . 2]" 1
986 1 47 LEU HA 1 47 LEU MD1 . . 3.200 2.241 2.086 2.354 . 0 0 "[ . 1 . 2]" 1
987 1 47 LEU HA 1 47 LEU HG . . 4.100 3.043 2.921 3.130 . 0 0 "[ . 1 . 2]" 1
988 1 47 LEU HA 1 50 PHE QE . . 4.440 3.762 3.277 4.443 0.003 16 0 "[ . 1 . 2]" 1
989 1 47 LEU HA 1 51 ARG H . . 4.860 4.280 3.960 4.464 . 0 0 "[ . 1 . 2]" 1
990 1 47 LEU HA 1 55 ILE MD . . 5.120 3.769 3.613 3.903 . 0 0 "[ . 1 . 2]" 1
991 1 47 LEU HA 1 76 PHE QE . . 4.570 3.185 2.795 3.548 . 0 0 "[ . 1 . 2]" 1
992 1 47 LEU HA 1 108 ILE MG . . 5.500 4.757 4.364 5.077 . 0 0 "[ . 1 . 2]" 1
993 1 47 LEU QB 1 47 LEU MD2 . . 3.090 2.054 2.018 2.078 . 0 0 "[ . 1 . 2]" 1
994 1 47 LEU QB 1 48 HIS H . . 3.390 2.816 2.565 2.952 . 0 0 "[ . 1 . 2]" 1
995 1 47 LEU QB 1 76 PHE QE . . 4.630 2.704 2.416 2.996 . 0 0 "[ . 1 . 2]" 1
996 1 47 LEU HB2 1 48 HIS H . . 4.050 3.991 3.843 4.056 0.006 2 0 "[ . 1 . 2]" 1
997 1 47 LEU HB3 1 48 HIS H . . 4.050 2.880 2.605 3.033 . 0 0 "[ . 1 . 2]" 1
998 1 47 LEU MD1 1 48 HIS H . . 5.320 4.701 4.642 4.781 . 0 0 "[ . 1 . 2]" 1
999 1 47 LEU MD1 1 51 ARG H . . 4.610 4.264 3.891 4.608 . 0 0 "[ . 1 . 2]" 1
1000 1 47 LEU MD1 1 51 ARG QB . . 4.360 3.784 3.208 4.246 . 0 0 "[ . 1 . 2]" 1
1001 1 47 LEU MD1 1 54 LEU QB . . 4.520 3.421 3.228 3.669 . 0 0 "[ . 1 . 2]" 1
1002 1 47 LEU MD1 1 76 PHE H . . 4.280 3.730 3.261 4.016 . 0 0 "[ . 1 . 2]" 1
1003 1 47 LEU MD1 1 76 PHE HA . . 4.600 3.139 2.719 3.501 . 0 0 "[ . 1 . 2]" 1
1004 1 47 LEU MD1 1 76 PHE QD . . 3.770 2.756 2.405 3.196 . 0 0 "[ . 1 . 2]" 1
1005 1 47 LEU MD1 1 76 PHE QE . . 4.370 2.425 2.087 2.767 . 0 0 "[ . 1 . 2]" 1
1006 1 47 LEU MD1 1 79 ILE MD . . 3.930 3.630 2.910 3.930 0.000 20 0 "[ . 1 . 2]" 1
1007 1 47 LEU MD1 1 108 ILE MG . . 4.460 4.097 3.694 4.448 . 0 0 "[ . 1 . 2]" 1
1008 1 47 LEU MD1 1 112 PHE QE . . 4.390 3.382 2.772 3.767 . 0 0 "[ . 1 . 2]" 1
1009 1 47 LEU MD1 1 112 PHE HZ . . 4.420 2.741 1.874 3.381 . 0 0 "[ . 1 . 2]" 1
1010 1 47 LEU MD2 1 48 HIS H . . 4.940 4.557 4.263 4.747 . 0 0 "[ . 1 . 2]" 1
1011 1 47 LEU MD2 1 54 LEU QB . . 3.720 2.357 2.158 2.634 . 0 0 "[ . 1 . 2]" 1
1012 1 47 LEU MD2 1 55 ILE HA . . 4.730 4.435 4.281 4.597 . 0 0 "[ . 1 . 2]" 1
1013 1 47 LEU MD2 1 55 ILE HB . . 4.420 4.329 4.248 4.406 . 0 0 "[ . 1 . 2]" 1
1014 1 47 LEU MD2 1 55 ILE MD . . 3.490 2.490 2.337 2.633 . 0 0 "[ . 1 . 2]" 1
1015 1 47 LEU MD2 1 55 ILE MG . . 3.330 3.309 3.142 3.345 0.015 17 0 "[ . 1 . 2]" 1
1016 1 47 LEU MD2 1 72 ALA H . . 5.050 4.875 4.661 5.052 0.002 11 0 "[ . 1 . 2]" 1
1017 1 47 LEU MD2 1 72 ALA HA . . 3.320 2.716 2.493 2.947 . 0 0 "[ . 1 . 2]" 1
1018 1 47 LEU MD2 1 72 ALA MB . . 3.790 3.583 3.395 3.792 0.002 12 0 "[ . 1 . 2]" 1
1019 1 47 LEU MD2 1 75 GLY H . . 4.000 3.406 3.025 3.751 . 0 0 "[ . 1 . 2]" 1
1020 1 47 LEU MD2 1 75 GLY HA2 . . 3.940 3.385 3.099 3.861 . 0 0 "[ . 1 . 2]" 1
1021 1 47 LEU MD2 1 75 GLY QA . . 3.380 2.053 1.764 2.476 . 0 0 "[ . 1 . 2]" 1
1022 1 47 LEU MD2 1 75 GLY HA3 . . 3.940 2.070 1.774 2.506 . 0 0 "[ . 1 . 2]" 1
1023 1 47 LEU MD2 1 76 PHE H . . 3.860 2.776 2.443 3.018 . 0 0 "[ . 1 . 2]" 1
1024 1 47 LEU MD2 1 77 ALA H . . 5.500 5.202 4.850 5.498 . 0 0 "[ . 1 . 2]" 1
1025 1 47 LEU HG 1 48 HIS H . . 4.330 4.177 3.956 4.336 0.006 8 0 "[ . 1 . 2]" 1
1026 1 47 LEU HG 1 48 HIS HA . . 5.050 4.017 3.853 4.146 . 0 0 "[ . 1 . 2]" 1
1027 1 47 LEU HG 1 55 ILE MD . . 3.700 2.106 1.925 2.368 . 0 0 "[ . 1 . 2]" 1
1028 1 48 HIS H 1 48 HIS QB . . 3.080 2.258 2.191 2.296 . 0 0 "[ . 1 . 2]" 1
1029 1 48 HIS H 1 48 HIS HD2 . . 5.220 5.017 4.731 5.220 . 0 0 "[ . 1 . 2]" 1
1030 1 48 HIS H 1 49 HIS H . . 3.570 2.488 2.368 2.634 . 0 0 "[ . 1 . 2]" 1
1031 1 48 HIS H 1 49 HIS HB2 . . 4.770 4.598 4.457 4.775 0.005 14 0 "[ . 1 . 2]" 1
1032 1 48 HIS H 1 55 ILE MD . . 3.590 2.504 2.247 2.683 . 0 0 "[ . 1 . 2]" 1
1033 1 48 HIS H 1 57 TYR HB2 . . 5.080 4.985 4.787 5.088 0.008 16 0 "[ . 1 . 2]" 1
1034 1 48 HIS HA 1 48 HIS HD2 . . 4.110 3.452 3.062 3.886 . 0 0 "[ . 1 . 2]" 1
1035 1 48 HIS HA 1 50 PHE H . . 4.820 4.446 4.055 4.827 0.007 4 0 "[ . 1 . 2]" 1
1036 1 48 HIS HA 1 51 ARG H . . 3.750 3.439 3.119 3.712 . 0 0 "[ . 1 . 2]" 1
1037 1 48 HIS HA 1 52 PRO HA . . 3.510 2.673 2.085 3.091 . 0 0 "[ . 1 . 2]" 1
1038 1 48 HIS HA 1 54 LEU H . . 5.120 4.426 3.987 4.999 . 0 0 "[ . 1 . 2]" 1
1039 1 48 HIS HA 1 54 LEU QB . . 4.860 3.892 3.483 4.213 . 0 0 "[ . 1 . 2]" 1
1040 1 48 HIS HA 1 55 ILE H . . 4.290 3.999 3.837 4.170 . 0 0 "[ . 1 . 2]" 1
1041 1 48 HIS HA 1 55 ILE HB . . 5.410 4.433 4.219 4.683 . 0 0 "[ . 1 . 2]" 1
1042 1 48 HIS HA 1 55 ILE MD . . 3.310 2.163 2.018 2.348 . 0 0 "[ . 1 . 2]" 1
1043 1 48 HIS QB 1 55 ILE MD . . 3.280 2.319 2.058 2.630 . 0 0 "[ . 1 . 2]" 1
1044 1 48 HIS QB 1 57 TYR H . . 4.790 4.078 3.725 4.425 . 0 0 "[ . 1 . 2]" 1
1045 1 48 HIS HD2 1 52 PRO HA . . 3.700 3.088 2.725 3.590 . 0 0 "[ . 1 . 2]" 1
1046 1 48 HIS HD2 1 52 PRO QB . . 5.340 4.225 3.459 4.959 . 0 0 "[ . 1 . 2]" 1
1047 1 48 HIS HD2 1 55 ILE HB . . 5.500 2.905 2.403 3.657 . 0 0 "[ . 1 . 2]" 1
1048 1 48 HIS HD2 1 55 ILE MD . . 3.440 2.636 1.996 3.272 . 0 0 "[ . 1 . 2]" 1
1049 1 48 HIS HD2 1 56 ASP HA . . 4.690 4.371 3.983 4.693 0.003 1 0 "[ . 1 . 2]" 1
1050 1 48 HIS HD2 1 57 TYR H . . 3.690 2.722 2.234 3.114 . 0 0 "[ . 1 . 2]" 1
1051 1 49 HIS H 1 49 HIS HB2 . . 3.230 2.354 2.261 2.544 . 0 0 "[ . 1 . 2]" 1
1052 1 49 HIS H 1 49 HIS HB3 . . 3.040 2.734 2.522 2.852 . 0 0 "[ . 1 . 2]" 1
1053 1 49 HIS H 1 50 PHE H . . 3.550 2.864 2.676 2.994 . 0 0 "[ . 1 . 2]" 1
1054 1 49 HIS H 1 50 PHE HA . . 5.500 5.424 5.279 5.505 0.005 6 0 "[ . 1 . 2]" 1
1055 1 49 HIS H 1 51 ARG H . . 4.580 4.234 3.912 4.463 . 0 0 "[ . 1 . 2]" 1
1056 1 49 HIS H 1 55 ILE MD . . 4.590 4.294 4.161 4.483 . 0 0 "[ . 1 . 2]" 1
1057 1 49 HIS HA 1 51 ARG H . . 5.450 4.875 4.545 5.136 . 0 0 "[ . 1 . 2]" 1
1058 1 49 HIS HB3 1 50 PHE H . . 3.770 2.386 2.094 2.657 . 0 0 "[ . 1 . 2]" 1
1059 1 49 HIS HB3 1 51 ARG H . . 5.210 4.891 4.604 5.136 . 0 0 "[ . 1 . 2]" 1
1060 1 49 HIS HD2 1 50 PHE H . . 5.030 4.500 3.902 4.843 . 0 0 "[ . 1 . 2]" 1
1061 1 49 HIS HD2 1 50 PHE QD . . 4.750 4.334 3.562 4.702 . 0 0 "[ . 1 . 2]" 1
1062 1 49 HIS HD2 1 50 PHE QE . . 4.400 3.883 3.000 4.374 . 0 0 "[ . 1 . 2]" 1
1063 1 50 PHE H 1 50 PHE HB2 . . 4.160 2.628 2.511 2.768 . 0 0 "[ . 1 . 2]" 1
1064 1 50 PHE H 1 50 PHE QB . . 3.290 2.567 2.465 2.680 . 0 0 "[ . 1 . 2]" 1
1065 1 50 PHE H 1 50 PHE HB3 . . 4.160 3.605 3.579 3.640 . 0 0 "[ . 1 . 2]" 1
1066 1 50 PHE H 1 50 PHE QD . . 3.430 2.180 1.898 2.867 . 0 0 "[ . 1 . 2]" 1
1067 1 50 PHE H 1 50 PHE QE . . 4.270 3.958 3.794 4.175 . 0 0 "[ . 1 . 2]" 1
1068 1 50 PHE H 1 51 ARG H . . 3.120 2.588 2.424 2.791 . 0 0 "[ . 1 . 2]" 1
1069 1 50 PHE H 1 51 ARG HA . . 5.330 5.117 5.008 5.263 . 0 0 "[ . 1 . 2]" 1
1070 1 50 PHE H 1 52 PRO HD3 . . 5.500 5.159 4.597 5.498 . 0 0 "[ . 1 . 2]" 1
1071 1 50 PHE HA 1 50 PHE QD . . 3.390 2.938 2.295 3.150 . 0 0 "[ . 1 . 2]" 1
1072 1 50 PHE HA 1 50 PHE QE . . 5.120 4.750 4.605 4.875 . 0 0 "[ . 1 . 2]" 1
1073 1 50 PHE QB 1 51 ARG H . . 3.410 2.415 2.291 2.637 . 0 0 "[ . 1 . 2]" 1
1074 1 50 PHE HB2 1 51 ARG H . . 3.940 2.449 2.320 2.679 . 0 0 "[ . 1 . 2]" 1
1075 1 50 PHE HB3 1 51 ARG H . . 3.940 3.677 3.554 3.943 0.003 20 0 "[ . 1 . 2]" 1
1076 1 50 PHE QD 1 51 ARG H . . 4.260 3.630 3.365 4.127 . 0 0 "[ . 1 . 2]" 1
1077 1 50 PHE QE 1 112 PHE HB3 . . 4.510 3.125 2.186 4.399 . 0 0 "[ . 1 . 2]" 1
1078 1 50 PHE HZ 1 112 PHE HB3 . . 5.150 3.517 3.063 4.404 . 0 0 "[ . 1 . 2]" 1
1079 1 50 PHE HZ 1 112 PHE QD . . 5.200 3.613 3.032 4.190 . 0 0 "[ . 1 . 2]" 1
1080 1 51 ARG H 1 51 ARG QB . . 3.440 2.595 2.469 2.702 . 0 0 "[ . 1 . 2]" 1
1081 1 51 ARG H 1 51 ARG QG . . 4.680 4.029 3.594 4.321 . 0 0 "[ . 1 . 2]" 1
1082 1 51 ARG H 1 52 PRO HD3 . . 4.090 3.871 3.445 4.026 . 0 0 "[ . 1 . 2]" 1
1083 1 51 ARG HA 1 51 ARG HD2 . . 4.200 2.813 2.021 4.034 . 0 0 "[ . 1 . 2]" 1
1084 1 51 ARG HA 1 51 ARG HD3 . . 4.200 2.846 1.971 3.809 . 0 0 "[ . 1 . 2]" 1
1085 1 51 ARG HA 1 51 ARG HE . . 4.690 4.140 2.041 4.673 . 0 0 "[ . 1 . 2]" 1
1086 1 51 ARG HA 1 52 PRO HD2 . . 3.760 1.924 1.914 1.980 . 0 0 "[ . 1 . 2]" 1
1087 1 51 ARG HA 1 52 PRO HD3 . . 3.830 2.532 2.445 2.745 . 0 0 "[ . 1 . 2]" 1
1088 1 51 ARG HA 1 52 PRO QG . . 4.750 3.783 3.767 3.841 . 0 0 "[ . 1 . 2]" 1
1089 1 51 ARG HA 1 53 ASP H . . 4.320 3.322 3.150 3.872 . 0 0 "[ . 1 . 2]" 1
1090 1 51 ARG QB 1 51 ARG HE . . 4.000 3.262 1.955 4.029 0.029 9 0 "[ . 1 . 2]" 1
1091 1 51 ARG QB 1 54 LEU MD1 . . 3.890 1.911 1.728 2.071 . 0 0 "[ . 1 . 2]" 1
1092 1 51 ARG HE 1 54 LEU MD1 . . 5.480 4.299 2.186 5.291 . 0 0 "[ . 1 . 2]" 1
1093 1 51 ARG HE 1 54 LEU MD2 . . 5.500 4.807 4.027 5.501 0.001 9 0 "[ . 1 . 2]" 1
1094 1 51 ARG HE 1 54 LEU HG . . 4.750 4.127 2.935 4.699 . 0 0 "[ . 1 . 2]" 1
1095 1 51 ARG QG 1 52 PRO HD2 . . 4.600 3.576 2.992 4.287 . 0 0 "[ . 1 . 2]" 1
1096 1 51 ARG QG 1 53 ASP H . . 4.390 3.237 1.924 4.478 0.088 5 0 "[ . 1 . 2]" 1
1097 1 52 PRO HA 1 55 ILE H . . 4.480 4.169 3.671 4.452 . 0 0 "[ . 1 . 2]" 1
1098 1 52 PRO HA 1 55 ILE MD . . 4.040 3.531 2.900 3.899 . 0 0 "[ . 1 . 2]" 1
1099 1 52 PRO HD2 1 53 ASP H . . 4.290 2.986 2.697 3.068 . 0 0 "[ . 1 . 2]" 1
1100 1 52 PRO HD3 1 53 ASP H . . 4.640 4.020 3.850 4.063 . 0 0 "[ . 1 . 2]" 1
1101 1 52 PRO QG 1 53 ASP H . . 3.690 3.173 2.033 3.323 . 0 0 "[ . 1 . 2]" 1
1102 1 53 ASP H 1 53 ASP QB . . 3.510 2.473 2.158 2.911 . 0 0 "[ . 1 . 2]" 1
1103 1 53 ASP H 1 54 LEU H . . 3.240 2.387 1.971 2.851 . 0 0 "[ . 1 . 2]" 1
1104 1 53 ASP H 1 55 ILE H . . 4.660 4.238 3.790 4.668 0.008 16 0 "[ . 1 . 2]" 1
1105 1 53 ASP QB 1 54 LEU H . . 4.330 3.305 2.557 4.030 . 0 0 "[ . 1 . 2]" 1
1106 1 54 LEU H 1 54 LEU HB2 . . 3.730 2.304 2.161 2.556 . 0 0 "[ . 1 . 2]" 1
1107 1 54 LEU H 1 54 LEU QB . . 3.050 2.276 2.141 2.514 . 0 0 "[ . 1 . 2]" 1
1108 1 54 LEU H 1 54 LEU HB3 . . 3.730 3.549 3.477 3.718 . 0 0 "[ . 1 . 2]" 1
1109 1 54 LEU H 1 54 LEU MD1 . . 4.260 3.916 3.553 4.220 . 0 0 "[ . 1 . 2]" 1
1110 1 54 LEU H 1 54 LEU MD2 . . 4.190 3.976 3.692 4.191 0.001 6 0 "[ . 1 . 2]" 1
1111 1 54 LEU H 1 54 LEU HG . . 3.540 3.127 2.720 3.544 0.004 16 0 "[ . 1 . 2]" 1
1112 1 54 LEU H 1 55 ILE H . . 2.940 2.417 1.937 2.935 . 0 0 "[ . 1 . 2]" 1
1113 1 54 LEU H 1 55 ILE MD . . 4.290 3.308 2.850 3.680 . 0 0 "[ . 1 . 2]" 1
1114 1 54 LEU HA 1 54 LEU MD1 . . 4.180 3.812 3.781 3.834 . 0 0 "[ . 1 . 2]" 1
1115 1 54 LEU HA 1 54 LEU MD2 . . 2.890 2.062 1.934 2.290 . 0 0 "[ . 1 . 2]" 1
1116 1 54 LEU HA 1 54 LEU HG . . 4.250 2.796 2.582 3.075 . 0 0 "[ . 1 . 2]" 1
1117 1 54 LEU QB 1 54 LEU MD2 . . 2.980 2.263 2.194 2.321 . 0 0 "[ . 1 . 2]" 1
1118 1 54 LEU QB 1 55 ILE H . . 3.220 2.714 2.571 2.859 . 0 0 "[ . 1 . 2]" 1
1119 1 54 LEU QB 1 55 ILE MD . . 3.380 2.090 1.908 2.248 . 0 0 "[ . 1 . 2]" 1
1120 1 54 LEU HB2 1 54 LEU MD1 . . 3.340 2.245 2.067 2.418 . 0 0 "[ . 1 . 2]" 1
1121 1 54 LEU HB2 1 54 LEU MD2 . . 3.430 3.177 3.163 3.183 . 0 0 "[ . 1 . 2]" 1
1122 1 54 LEU HB2 1 55 ILE H . . 3.800 2.859 2.648 2.962 . 0 0 "[ . 1 . 2]" 1
1123 1 54 LEU HB3 1 54 LEU MD1 . . 3.340 2.418 2.216 2.558 . 0 0 "[ . 1 . 2]" 1
1124 1 54 LEU HB3 1 54 LEU MD2 . . 3.430 2.317 2.237 2.386 . 0 0 "[ . 1 . 2]" 1
1125 1 54 LEU HB3 1 55 ILE H . . 3.800 3.389 3.220 3.763 . 0 0 "[ . 1 . 2]" 1
1126 1 54 LEU MD1 1 55 ILE H . . 5.200 4.673 4.483 4.869 . 0 0 "[ . 1 . 2]" 1
1127 1 54 LEU MD1 1 75 GLY QA . . 4.140 3.761 3.065 4.119 . 0 0 "[ . 1 . 2]" 1
1128 1 54 LEU MD2 1 55 ILE H . . 4.650 4.634 4.572 4.665 0.015 2 0 "[ . 1 . 2]" 1
1129 1 55 ILE H 1 55 ILE HB . . 3.950 2.996 2.954 3.039 . 0 0 "[ . 1 . 2]" 1
1130 1 55 ILE H 1 55 ILE MD . . 3.110 2.170 2.092 2.248 . 0 0 "[ . 1 . 2]" 1
1131 1 55 ILE H 1 55 ILE MG . . 4.630 3.910 3.883 3.935 . 0 0 "[ . 1 . 2]" 1
1132 1 55 ILE H 1 56 ASP H . . 4.600 4.429 4.394 4.479 . 0 0 "[ . 1 . 2]" 1
1133 1 55 ILE H 1 56 ASP HA . . 4.970 4.922 4.853 4.981 0.011 13 0 "[ . 1 . 2]" 1
1134 1 55 ILE HA 1 55 ILE MD . . 3.940 3.662 3.610 3.683 . 0 0 "[ . 1 . 2]" 1
1135 1 55 ILE HA 1 55 ILE QG . . 3.450 2.681 2.660 2.708 . 0 0 "[ . 1 . 2]" 1
1136 1 55 ILE HA 1 71 LYS HB3 . . 4.720 4.208 3.968 4.411 . 0 0 "[ . 1 . 2]" 1
1137 1 55 ILE HB 1 55 ILE MD . . 3.560 2.119 2.077 2.173 . 0 0 "[ . 1 . 2]" 1
1138 1 55 ILE HB 1 60 LEU MD1 . . 4.920 3.965 3.814 4.065 . 0 0 "[ . 1 . 2]" 1
1139 1 55 ILE MD 1 57 TYR H . . 4.180 3.758 3.678 3.848 . 0 0 "[ . 1 . 2]" 1
1140 1 55 ILE MD 1 57 TYR HB2 . . 4.050 3.745 3.680 3.825 . 0 0 "[ . 1 . 2]" 1
1141 1 55 ILE MD 1 57 TYR QD . . 4.810 4.802 4.720 4.822 0.012 18 0 "[ . 1 . 2]" 1
1142 1 55 ILE MD 1 58 LYS H . . 5.500 5.508 5.447 5.521 0.021 1 0 "[ . 1 . 2]" 1
1143 1 55 ILE MD 1 60 LEU MD1 . . 5.200 4.991 4.857 5.085 . 0 0 "[ . 1 . 2]" 1
1144 1 55 ILE QG 1 55 ILE MG . . 3.130 1.954 1.943 1.989 . 0 0 "[ . 1 . 2]" 1
1145 1 55 ILE QG 1 56 ASP H . . 4.210 4.090 4.042 4.178 . 0 0 "[ . 1 . 2]" 1
1146 1 55 ILE QG 1 57 TYR H . . 5.340 4.496 4.455 4.551 . 0 0 "[ . 1 . 2]" 1
1147 1 55 ILE HG12 1 56 ASP H . . 4.790 4.617 4.538 4.777 . 0 0 "[ . 1 . 2]" 1
1148 1 55 ILE HG13 1 56 ASP H . . 4.790 4.566 4.536 4.621 . 0 0 "[ . 1 . 2]" 1
1149 1 55 ILE MG 1 56 ASP H . . 4.340 1.838 1.796 1.932 . 0 0 "[ . 1 . 2]" 1
1150 1 55 ILE MG 1 57 TYR HA . . 5.320 3.953 3.831 4.051 . 0 0 "[ . 1 . 2]" 1
1151 1 55 ILE MG 1 57 TYR QD . . 5.350 4.292 4.048 4.527 . 0 0 "[ . 1 . 2]" 1
1152 1 55 ILE MG 1 58 LYS H . . 5.500 5.192 5.092 5.300 . 0 0 "[ . 1 . 2]" 1
1153 1 55 ILE MG 1 60 LEU MD1 . . 3.280 2.388 2.290 2.503 . 0 0 "[ . 1 . 2]" 1
1154 1 55 ILE MG 1 68 ASN HA . . 5.000 4.699 4.516 4.903 . 0 0 "[ . 1 . 2]" 1
1155 1 55 ILE MG 1 71 LYS H . . 5.500 4.977 4.793 5.145 . 0 0 "[ . 1 . 2]" 1
1156 1 55 ILE MG 1 71 LYS HA . . 4.230 4.069 3.849 4.238 0.008 2 0 "[ . 1 . 2]" 1
1157 1 55 ILE MG 1 71 LYS HB2 . . 4.030 3.015 2.813 3.165 . 0 0 "[ . 1 . 2]" 1
1158 1 55 ILE MG 1 71 LYS HB3 . . 3.270 2.157 1.988 2.301 . 0 0 "[ . 1 . 2]" 1
1159 1 55 ILE MG 1 71 LYS QD . . 3.440 2.228 1.925 2.764 . 0 0 "[ . 1 . 2]" 1
1160 1 55 ILE MG 1 71 LYS QE . . 4.210 3.352 2.053 4.109 . 0 0 "[ . 1 . 2]" 1
1161 1 55 ILE MG 1 71 LYS QG . . 4.460 3.510 2.586 3.804 . 0 0 "[ . 1 . 2]" 1
1162 1 55 ILE MG 1 72 ALA H . . 4.230 4.021 3.777 4.234 0.004 7 0 "[ . 1 . 2]" 1
1163 1 55 ILE MG 1 72 ALA HA . . 3.920 3.806 3.569 3.923 0.003 20 0 "[ . 1 . 2]" 1
1164 1 55 ILE MG 1 72 ALA MB . . 4.320 4.185 3.916 4.317 . 0 0 "[ . 1 . 2]" 1
1165 1 56 ASP H 1 60 LEU MD1 . . 4.810 3.322 3.197 3.476 . 0 0 "[ . 1 . 2]" 1
1166 1 56 ASP HA 1 57 TYR H . . 3.190 2.955 2.904 3.000 . 0 0 "[ . 1 . 2]" 1
1167 1 56 ASP HA 1 58 LYS H . . 4.090 3.077 3.001 3.195 . 0 0 "[ . 1 . 2]" 1
1168 1 56 ASP QB 1 57 TYR H . . 3.970 3.762 3.722 3.806 . 0 0 "[ . 1 . 2]" 1
1169 1 56 ASP HB2 1 57 TYR H . . 4.610 4.220 4.005 4.521 . 0 0 "[ . 1 . 2]" 1
1170 1 56 ASP HB3 1 57 TYR H . . 4.610 4.282 3.994 4.512 . 0 0 "[ . 1 . 2]" 1
1171 1 57 TYR H 1 57 TYR HB2 . . 3.400 2.388 2.309 2.452 . 0 0 "[ . 1 . 2]" 1
1172 1 57 TYR H 1 57 TYR HB3 . . 3.360 2.686 2.606 2.772 . 0 0 "[ . 1 . 2]" 1
1173 1 57 TYR H 1 57 TYR QD . . 4.270 4.171 4.120 4.193 . 0 0 "[ . 1 . 2]" 1
1174 1 57 TYR H 1 58 LYS H . . 3.390 2.745 2.690 2.797 . 0 0 "[ . 1 . 2]" 1
1175 1 57 TYR H 1 58 LYS QB . . 5.310 4.816 4.679 5.163 . 0 0 "[ . 1 . 2]" 1
1176 1 57 TYR H 1 58 LYS QG . . 4.600 4.185 3.707 4.449 . 0 0 "[ . 1 . 2]" 1
1177 1 57 TYR HA 1 57 TYR QD . . 3.770 3.129 3.048 3.167 . 0 0 "[ . 1 . 2]" 1
1178 1 57 TYR HA 1 59 SER H . . 4.480 3.736 3.534 3.950 . 0 0 "[ . 1 . 2]" 1
1179 1 57 TYR HA 1 60 LEU H . . 3.920 3.142 3.057 3.228 . 0 0 "[ . 1 . 2]" 1
1180 1 57 TYR HA 1 60 LEU MD1 . . 3.360 2.227 2.105 2.319 . 0 0 "[ . 1 . 2]" 1
1181 1 57 TYR HA 1 60 LEU MD2 . . 4.080 3.661 3.622 3.745 . 0 0 "[ . 1 . 2]" 1
1182 1 57 TYR HA 1 60 LEU HG . . 3.560 2.005 1.977 2.113 . 0 0 "[ . 1 . 2]" 1
1183 1 57 TYR HB2 1 58 LYS H . . 4.650 4.050 3.934 4.133 . 0 0 "[ . 1 . 2]" 1
1184 1 57 TYR HB3 1 58 LYS H . . 3.500 3.057 2.914 3.146 . 0 0 "[ . 1 . 2]" 1
1185 1 57 TYR HB3 1 59 SER H . . 5.500 5.082 4.875 5.252 . 0 0 "[ . 1 . 2]" 1
1186 1 57 TYR QD 1 58 LYS H . . 4.080 3.917 3.775 4.064 . 0 0 "[ . 1 . 2]" 1
1187 1 57 TYR QD 1 58 LYS HA . . 3.840 3.259 3.100 3.474 . 0 0 "[ . 1 . 2]" 1
1188 1 57 TYR QD 1 60 LEU MD1 . . 3.630 2.836 2.655 2.991 . 0 0 "[ . 1 . 2]" 1
1189 1 57 TYR QD 1 60 LEU HG . . 5.500 4.610 4.472 4.674 . 0 0 "[ . 1 . 2]" 1
1190 1 57 TYR QE 1 58 LYS HA . . 5.500 5.068 4.850 5.391 . 0 0 "[ . 1 . 2]" 1
1191 1 57 TYR QE 1 60 LEU MD1 . . 4.690 4.166 3.865 4.288 . 0 0 "[ . 1 . 2]" 1
1192 1 58 LYS H 1 58 LYS HB2 . . 3.650 3.550 2.891 3.597 . 0 0 "[ . 1 . 2]" 1
1193 1 58 LYS H 1 58 LYS HB3 . . 3.650 2.532 2.350 3.529 . 0 0 "[ . 1 . 2]" 1
1194 1 58 LYS H 1 58 LYS QE . . 5.270 4.545 2.818 5.036 . 0 0 "[ . 1 . 2]" 1
1195 1 58 LYS H 1 58 LYS HG2 . . 4.130 2.356 1.930 3.422 . 0 0 "[ . 1 . 2]" 1
1196 1 58 LYS H 1 58 LYS QG . . 3.430 2.212 1.898 2.486 . 0 0 "[ . 1 . 2]" 1
1197 1 58 LYS H 1 58 LYS HG3 . . 4.130 3.238 2.028 3.753 . 0 0 "[ . 1 . 2]" 1
1198 1 58 LYS H 1 59 SER H . . 3.300 2.641 2.537 2.733 . 0 0 "[ . 1 . 2]" 1
1199 1 58 LYS H 1 60 LEU H . . 4.460 4.146 3.951 4.306 . 0 0 "[ . 1 . 2]" 1
1200 1 58 LYS HA 1 60 LEU H . . 4.240 4.200 4.115 4.258 0.018 2 0 "[ . 1 . 2]" 1
1201 1 58 LYS QB 1 59 SER H . . 3.770 3.541 2.806 3.685 . 0 0 "[ . 1 . 2]" 1
1202 1 58 LYS QB 1 60 LEU H . . 5.340 5.077 4.759 5.145 . 0 0 "[ . 1 . 2]" 1
1203 1 58 LYS HB2 1 59 SER H . . 4.360 3.949 2.858 4.191 . 0 0 "[ . 1 . 2]" 1
1204 1 58 LYS HB3 1 59 SER H . . 4.360 4.037 3.930 4.158 . 0 0 "[ . 1 . 2]" 1
1205 1 58 LYS QE 1 58 LYS QG . . 3.310 2.292 2.093 2.699 . 0 0 "[ . 1 . 2]" 1
1206 1 58 LYS QG 1 59 SER H . . 3.680 2.405 2.126 3.580 . 0 0 "[ . 1 . 2]" 1
1207 1 58 LYS HG2 1 59 SER H . . 4.450 2.946 2.170 4.457 0.007 1 0 "[ . 1 . 2]" 1
1208 1 58 LYS HG3 1 59 SER H . . 4.450 2.720 2.329 3.771 . 0 0 "[ . 1 . 2]" 1
1209 1 59 SER H 1 59 SER HB2 . . 3.700 3.037 2.535 3.773 0.073 11 0 "[ . 1 . 2]" 1
1210 1 59 SER H 1 59 SER QB . . 2.960 2.623 2.490 2.998 0.038 11 0 "[ . 1 . 2]" 1
1211 1 59 SER H 1 59 SER HB3 . . 3.700 3.030 2.661 3.706 0.006 16 0 "[ . 1 . 2]" 1
1212 1 59 SER H 1 60 LEU HB3 . . 5.500 5.450 5.341 5.570 0.070 11 0 "[ . 1 . 2]" 1
1213 1 59 SER H 1 60 LEU MD1 . . 5.290 4.900 4.824 4.991 . 0 0 "[ . 1 . 2]" 1
1214 1 59 SER H 1 60 LEU MD2 . . 4.500 4.198 4.125 4.339 . 0 0 "[ . 1 . 2]" 1
1215 1 59 SER H 1 60 LEU HG . . 3.840 3.552 3.468 3.651 . 0 0 "[ . 1 . 2]" 1
1216 1 59 SER HB2 1 60 LEU H . . 5.250 4.467 4.074 4.614 . 0 0 "[ . 1 . 2]" 1
1217 1 59 SER HB3 1 60 LEU H . . 5.250 4.199 3.964 4.616 . 0 0 "[ . 1 . 2]" 1
1218 1 60 LEU H 1 60 LEU HB2 . . 3.470 2.261 2.207 2.315 . 0 0 "[ . 1 . 2]" 1
1219 1 60 LEU H 1 60 LEU HB3 . . 3.690 3.541 3.506 3.574 . 0 0 "[ . 1 . 2]" 1
1220 1 60 LEU H 1 60 LEU MD1 . . 4.150 4.145 4.087 4.168 0.018 14 0 "[ . 1 . 2]" 1
1221 1 60 LEU H 1 60 LEU MD2 . . 3.660 3.667 3.601 3.697 0.037 14 0 "[ . 1 . 2]" 1
1222 1 60 LEU H 1 60 LEU HG . . 3.130 3.136 3.088 3.176 0.046 14 0 "[ . 1 . 2]" 1
1223 1 60 LEU H 1 61 ASN H . . 4.640 4.472 4.458 4.515 . 0 0 "[ . 1 . 2]" 1
1224 1 60 LEU HA 1 60 LEU MD1 . . 4.110 3.727 3.716 3.743 . 0 0 "[ . 1 . 2]" 1
1225 1 60 LEU HA 1 60 LEU MD2 . . 3.020 1.913 1.888 1.934 . 0 0 "[ . 1 . 2]" 1
1226 1 60 LEU HA 1 60 LEU HG . . 4.200 3.100 3.055 3.132 . 0 0 "[ . 1 . 2]" 1
1227 1 60 LEU HA 1 61 ASN H . . 2.890 2.632 2.543 2.657 . 0 0 "[ . 1 . 2]" 1
1228 1 60 LEU HA 1 61 ASN HB2 . . 4.730 4.038 4.021 4.056 . 0 0 "[ . 1 . 2]" 1
1229 1 60 LEU HA 1 68 ASN HD22 . . 5.330 5.186 4.838 5.335 0.005 20 0 "[ . 1 . 2]" 1
1230 1 60 LEU HB2 1 60 LEU MD1 . . 3.270 2.408 2.384 2.427 . 0 0 "[ . 1 . 2]" 1
1231 1 60 LEU HB2 1 61 ASN H . . 3.670 3.428 3.376 3.574 . 0 0 "[ . 1 . 2]" 1
1232 1 60 LEU HB3 1 60 LEU MD1 . . 3.410 2.278 2.221 2.311 . 0 0 "[ . 1 . 2]" 1
1233 1 60 LEU HB3 1 61 ASN H . . 3.950 1.950 1.902 2.127 . 0 0 "[ . 1 . 2]" 1
1234 1 60 LEU HB3 1 63 GLN HE21 . . 4.970 4.539 4.510 4.578 . 0 0 "[ . 1 . 2]" 1
1235 1 60 LEU HB3 1 63 GLN HE22 . . 4.970 4.955 4.855 4.976 0.006 18 0 "[ . 1 . 2]" 1
1236 1 60 LEU MD1 1 63 GLN HE21 . . 5.500 5.498 5.457 5.525 0.025 16 0 "[ . 1 . 2]" 1
1237 1 60 LEU MD1 1 63 GLN HE22 . . 5.500 5.246 5.198 5.288 . 0 0 "[ . 1 . 2]" 1
1238 1 60 LEU MD1 1 71 LYS HB2 . . 5.400 3.823 3.613 4.120 . 0 0 "[ . 1 . 2]" 1
1239 1 60 LEU MD2 1 61 ASN H . . 3.620 2.802 2.714 2.874 . 0 0 "[ . 1 . 2]" 1
1240 1 60 LEU MD2 1 67 GLU QG . . 5.340 3.613 3.209 4.101 . 0 0 "[ . 1 . 2]" 1
1241 1 60 LEU MD2 1 71 LYS HD2 . . 3.640 2.409 1.984 3.610 . 0 0 "[ . 1 . 2]" 1
1242 1 60 LEU MD2 1 71 LYS HD3 . . 3.640 3.130 2.626 3.601 . 0 0 "[ . 1 . 2]" 1
1243 1 60 LEU MD2 1 71 LYS QE . . 3.840 2.636 1.942 3.544 . 0 0 "[ . 1 . 2]" 1
1244 1 60 LEU MD2 1 71 LYS QG . . 4.520 3.868 3.565 4.362 . 0 0 "[ . 1 . 2]" 1
1245 1 60 LEU HG 1 61 ASN H . . 4.950 4.568 4.511 4.644 . 0 0 "[ . 1 . 2]" 1
1246 1 61 ASN H 1 61 ASN HB2 . . 3.360 2.995 2.895 3.032 . 0 0 "[ . 1 . 2]" 1
1247 1 61 ASN H 1 61 ASN HB3 . . 4.080 3.894 3.829 3.917 . 0 0 "[ . 1 . 2]" 1
1248 1 61 ASN H 1 61 ASN HD22 . . 5.500 5.512 5.500 5.532 0.032 9 0 "[ . 1 . 2]" 1
1249 1 61 ASN H 1 62 PRO HA . . 5.330 4.870 4.852 4.929 . 0 0 "[ . 1 . 2]" 1
1250 1 61 ASN H 1 62 PRO HD3 . . 5.500 4.813 4.792 4.877 . 0 0 "[ . 1 . 2]" 1
1251 1 61 ASN H 1 64 ASP H . . 4.860 4.254 4.073 4.416 . 0 0 "[ . 1 . 2]" 1
1252 1 61 ASN H 1 68 ASN HD22 . . 4.260 2.895 2.576 3.233 . 0 0 "[ . 1 . 2]" 1
1253 1 61 ASN HA 1 62 PRO HD2 . . 3.200 2.501 2.493 2.521 . 0 0 "[ . 1 . 2]" 1
1254 1 61 ASN HA 1 62 PRO HD3 . . 3.140 2.344 2.339 2.354 . 0 0 "[ . 1 . 2]" 1
1255 1 61 ASN HA 1 62 PRO HG2 . . 4.660 4.596 4.588 4.612 . 0 0 "[ . 1 . 2]" 1
1256 1 61 ASN HA 1 62 PRO HG3 . . 4.640 4.536 4.530 4.549 . 0 0 "[ . 1 . 2]" 1
1257 1 61 ASN HA 1 63 GLN H . . 4.270 3.891 3.887 3.901 . 0 0 "[ . 1 . 2]" 1
1258 1 61 ASN HB2 1 62 PRO HD2 . . 4.200 3.590 3.567 3.599 . 0 0 "[ . 1 . 2]" 1
1259 1 61 ASN HB2 1 62 PRO HD3 . . 4.920 4.682 4.666 4.688 . 0 0 "[ . 1 . 2]" 1
1260 1 61 ASN HB2 1 63 GLN H . . 4.190 3.186 3.177 3.203 . 0 0 "[ . 1 . 2]" 1
1261 1 61 ASN HB2 1 64 ASP H . . 4.730 4.448 4.307 4.635 . 0 0 "[ . 1 . 2]" 1
1262 1 61 ASN HB3 1 61 ASN HD22 . . 3.790 3.678 3.676 3.680 . 0 0 "[ . 1 . 2]" 1
1263 1 61 ASN HB3 1 62 PRO HD2 . . 4.030 1.992 1.970 1.999 . 0 0 "[ . 1 . 2]" 1
1264 1 61 ASN HB3 1 62 PRO HD3 . . 4.680 3.441 3.423 3.448 . 0 0 "[ . 1 . 2]" 1
1265 1 61 ASN HB3 1 63 GLN H . . 4.540 2.335 2.326 2.380 . 0 0 "[ . 1 . 2]" 1
1266 1 61 ASN HB3 1 63 GLN HA . . 5.150 4.850 4.833 4.865 . 0 0 "[ . 1 . 2]" 1
1267 1 61 ASN HB3 1 64 ASP H . . 4.630 4.406 4.303 4.523 . 0 0 "[ . 1 . 2]" 1
1268 1 61 ASN HD21 1 62 PRO HG3 . . 4.460 4.147 4.077 4.189 . 0 0 "[ . 1 . 2]" 1
1269 1 61 ASN HD21 1 63 GLN H . . 4.850 4.598 4.580 4.629 . 0 0 "[ . 1 . 2]" 1
1270 1 62 PRO HA 1 63 GLN H . . 3.390 3.283 3.247 3.291 . 0 0 "[ . 1 . 2]" 1
1271 1 62 PRO HA 1 64 ASP H . . 4.270 3.511 3.336 3.702 . 0 0 "[ . 1 . 2]" 1
1272 1 62 PRO HA 1 68 ASN HD21 . . 4.850 3.481 3.248 3.728 . 0 0 "[ . 1 . 2]" 1
1273 1 62 PRO HA 1 68 ASN HD22 . . 3.730 3.301 3.069 3.534 . 0 0 "[ . 1 . 2]" 1
1274 1 62 PRO HB2 1 63 GLN H . . 4.270 3.989 3.977 4.042 . 0 0 "[ . 1 . 2]" 1
1275 1 62 PRO HD2 1 63 GLN H . . 4.370 3.063 3.045 3.144 . 0 0 "[ . 1 . 2]" 1
1276 1 62 PRO HD3 1 63 GLN H . . 4.540 4.062 4.053 4.104 . 0 0 "[ . 1 . 2]" 1
1277 1 62 PRO HG2 1 63 GLN H . . 4.330 3.395 3.370 3.501 . 0 0 "[ . 1 . 2]" 1
1278 1 62 PRO HG3 1 63 GLN H . . 5.140 4.655 4.636 4.736 . 0 0 "[ . 1 . 2]" 1
1279 1 63 GLN H 1 63 GLN HB2 . . 3.720 3.596 3.591 3.603 . 0 0 "[ . 1 . 2]" 1
1280 1 63 GLN H 1 63 GLN HB3 . . 3.120 2.812 2.798 2.867 . 0 0 "[ . 1 . 2]" 1
1281 1 63 GLN H 1 63 GLN QE . . 4.300 2.907 2.765 3.004 . 0 0 "[ . 1 . 2]" 1
1282 1 63 GLN H 1 63 GLN HG2 . . 4.150 3.494 3.477 3.520 . 0 0 "[ . 1 . 2]" 1
1283 1 63 GLN H 1 63 GLN QG . . 3.360 1.901 1.873 1.936 . 0 0 "[ . 1 . 2]" 1
1284 1 63 GLN H 1 63 GLN HG3 . . 4.150 1.910 1.881 1.945 . 0 0 "[ . 1 . 2]" 1
1285 1 63 GLN H 1 64 ASP H . . 3.070 2.420 2.322 2.470 . 0 0 "[ . 1 . 2]" 1
1286 1 63 GLN H 1 64 ASP HB2 . . 4.700 4.318 4.265 4.351 . 0 0 "[ . 1 . 2]" 1
1287 1 63 GLN HA 1 63 GLN QG . . 3.560 3.501 3.489 3.512 . 0 0 "[ . 1 . 2]" 1
1288 1 63 GLN HA 1 65 ILE H . . 5.500 5.497 5.462 5.509 0.009 15 0 "[ . 1 . 2]" 1
1289 1 63 GLN HB2 1 64 ASP H . . 4.540 4.050 3.910 4.191 . 0 0 "[ . 1 . 2]" 1
1290 1 63 GLN HB3 1 64 ASP H . . 4.380 4.295 4.211 4.381 0.001 6 0 "[ . 1 . 2]" 1
1291 1 63 GLN QE 1 64 ASP H . . 3.950 2.725 2.585 2.849 . 0 0 "[ . 1 . 2]" 1
1292 1 63 GLN QG 1 64 ASP H . . 4.490 3.273 3.101 3.485 . 0 0 "[ . 1 . 2]" 1
1293 1 64 ASP H 1 64 ASP HB2 . . 3.400 2.359 2.282 2.454 . 0 0 "[ . 1 . 2]" 1
1294 1 64 ASP H 1 64 ASP HB3 . . 3.760 3.563 3.528 3.609 . 0 0 "[ . 1 . 2]" 1
1295 1 64 ASP H 1 68 ASN H . . 5.490 5.128 5.052 5.234 . 0 0 "[ . 1 . 2]" 1
1296 1 64 ASP H 1 68 ASN HD21 . . 4.710 4.154 3.724 4.594 . 0 0 "[ . 1 . 2]" 1
1297 1 64 ASP H 1 68 ASN HD22 . . 4.190 3.392 2.967 3.738 . 0 0 "[ . 1 . 2]" 1
1298 1 64 ASP HA 1 65 ILE H . . 3.050 2.142 2.140 2.144 . 0 0 "[ . 1 . 2]" 1
1299 1 64 ASP HA 1 66 LYS H . . 4.180 3.971 3.801 4.148 . 0 0 "[ . 1 . 2]" 1
1300 1 64 ASP HB2 1 65 ILE H . . 4.550 4.507 4.496 4.521 . 0 0 "[ . 1 . 2]" 1
1301 1 64 ASP HB2 1 67 GLU H . . 5.270 5.078 4.947 5.209 . 0 0 "[ . 1 . 2]" 1
1302 1 64 ASP HB2 1 67 GLU HB2 . . 5.130 5.048 4.714 5.136 0.006 11 0 "[ . 1 . 2]" 1
1303 1 64 ASP HB2 1 67 GLU HB3 . . 4.160 3.524 3.477 3.657 . 0 0 "[ . 1 . 2]" 1
1304 1 64 ASP HB2 1 68 ASN H . . 4.110 3.388 3.289 3.541 . 0 0 "[ . 1 . 2]" 1
1305 1 64 ASP HB2 1 68 ASN HD22 . . 4.500 3.244 2.925 3.547 . 0 0 "[ . 1 . 2]" 1
1306 1 64 ASP HB3 1 65 ILE H . . 4.460 3.649 3.623 3.677 . 0 0 "[ . 1 . 2]" 1
1307 1 64 ASP HB3 1 67 GLU H . . 3.980 3.341 3.196 3.459 . 0 0 "[ . 1 . 2]" 1
1308 1 64 ASP HB3 1 67 GLU HA . . 5.500 4.762 4.693 4.840 . 0 0 "[ . 1 . 2]" 1
1309 1 64 ASP HB3 1 67 GLU HB2 . . 3.680 3.570 3.180 3.682 0.002 12 0 "[ . 1 . 2]" 1
1310 1 64 ASP HB3 1 67 GLU HB3 . . 3.660 2.052 1.999 2.240 . 0 0 "[ . 1 . 2]" 1
1311 1 64 ASP HB3 1 67 GLU HG2 . . 4.940 3.839 3.546 4.202 . 0 0 "[ . 1 . 2]" 1
1312 1 64 ASP HB3 1 67 GLU QG . . 4.180 3.683 3.454 3.968 . 0 0 "[ . 1 . 2]" 1
1313 1 64 ASP HB3 1 67 GLU HG3 . . 4.940 4.784 4.384 4.941 0.001 9 0 "[ . 1 . 2]" 1
1314 1 64 ASP HB3 1 68 ASN H . . 3.750 1.991 1.898 2.153 . 0 0 "[ . 1 . 2]" 1
1315 1 64 ASP HB3 1 68 ASN HA . . 5.150 4.091 3.944 4.349 . 0 0 "[ . 1 . 2]" 1
1316 1 64 ASP HB3 1 68 ASN HB2 . . 5.500 3.424 3.166 3.688 . 0 0 "[ . 1 . 2]" 1
1317 1 64 ASP HB3 1 68 ASN HD22 . . 4.950 4.280 4.021 4.588 . 0 0 "[ . 1 . 2]" 1
1318 1 65 ILE H 1 65 ILE HB . . 3.010 2.532 2.441 2.600 . 0 0 "[ . 1 . 2]" 1
1319 1 65 ILE H 1 65 ILE MD . . 3.990 3.886 3.744 3.993 0.003 14 0 "[ . 1 . 2]" 1
1320 1 65 ILE H 1 65 ILE HG12 . . 3.950 3.666 3.444 3.891 . 0 0 "[ . 1 . 2]" 1
1321 1 65 ILE H 1 65 ILE HG13 . . 3.230 2.564 2.425 2.715 . 0 0 "[ . 1 . 2]" 1
1322 1 65 ILE H 1 65 ILE MG . . 3.930 3.799 3.760 3.823 . 0 0 "[ . 1 . 2]" 1
1323 1 65 ILE H 1 66 LYS H . . 3.640 2.269 2.185 2.378 . 0 0 "[ . 1 . 2]" 1
1324 1 65 ILE H 1 66 LYS HA . . 5.330 4.937 4.889 5.011 . 0 0 "[ . 1 . 2]" 1
1325 1 65 ILE H 1 67 GLU H . . 4.580 3.665 3.306 3.907 . 0 0 "[ . 1 . 2]" 1
1326 1 65 ILE H 1 67 GLU HB3 . . 5.090 4.806 4.505 5.081 . 0 0 "[ . 1 . 2]" 1
1327 1 65 ILE HA 1 65 ILE MD . . 3.970 3.791 3.725 3.846 . 0 0 "[ . 1 . 2]" 1
1328 1 65 ILE HA 1 65 ILE HG12 . . 3.460 2.491 2.397 2.566 . 0 0 "[ . 1 . 2]" 1
1329 1 65 ILE HA 1 65 ILE HG13 . . 3.910 3.085 2.872 3.230 . 0 0 "[ . 1 . 2]" 1
1330 1 65 ILE HA 1 65 ILE MG . . 3.420 2.403 2.311 2.469 . 0 0 "[ . 1 . 2]" 1
1331 1 65 ILE HA 1 68 ASN H . . 4.740 4.492 4.233 4.636 . 0 0 "[ . 1 . 2]" 1
1332 1 65 ILE HA 1 68 ASN HB3 . . 4.730 4.698 4.603 4.733 0.003 12 0 "[ . 1 . 2]" 1
1333 1 65 ILE HA 1 68 ASN HD21 . . 4.740 4.322 3.924 4.736 . 0 0 "[ . 1 . 2]" 1
1334 1 65 ILE HA 1 69 ASN H . . 4.710 4.273 4.066 4.520 . 0 0 "[ . 1 . 2]" 1
1335 1 65 ILE HA 1 69 ASN HD21 . . 4.470 3.408 3.136 3.571 . 0 0 "[ . 1 . 2]" 1
1336 1 65 ILE HA 1 69 ASN HD22 . . 5.100 4.157 3.799 4.431 . 0 0 "[ . 1 . 2]" 1
1337 1 65 ILE HB 1 65 ILE MD . . 3.110 2.472 2.352 2.573 . 0 0 "[ . 1 . 2]" 1
1338 1 65 ILE HB 1 66 LYS H . . 3.030 2.480 2.300 2.667 . 0 0 "[ . 1 . 2]" 1
1339 1 65 ILE HB 1 91 VAL HA . . 4.410 4.165 3.898 4.378 . 0 0 "[ . 1 . 2]" 1
1340 1 65 ILE HB 1 91 VAL MG1 . . 3.650 3.589 3.260 3.654 0.004 18 0 "[ . 1 . 2]" 1
1341 1 65 ILE HB 1 91 VAL MG2 . . 3.200 2.137 1.959 2.450 . 0 0 "[ . 1 . 2]" 1
1342 1 65 ILE MD 1 66 LYS H . . 4.630 4.530 4.380 4.627 . 0 0 "[ . 1 . 2]" 1
1343 1 65 ILE MD 1 91 VAL HA . . 3.620 3.434 3.215 3.629 0.009 15 0 "[ . 1 . 2]" 1
1344 1 65 ILE MD 1 91 VAL HB . . 5.500 5.351 5.175 5.498 . 0 0 "[ . 1 . 2]" 1
1345 1 65 ILE MG 1 66 LYS H . . 3.730 3.369 3.074 3.537 . 0 0 "[ . 1 . 2]" 1
1346 1 65 ILE MG 1 66 LYS HA . . 4.230 3.475 3.170 3.659 . 0 0 "[ . 1 . 2]" 1
1347 1 65 ILE MG 1 69 ASN H . . 4.870 4.707 4.570 4.813 . 0 0 "[ . 1 . 2]" 1
1348 1 65 ILE MG 1 69 ASN HD21 . . 3.670 3.387 2.937 3.672 0.002 14 0 "[ . 1 . 2]" 1
1349 1 65 ILE MG 1 69 ASN HD22 . . 3.690 3.528 3.368 3.688 . 0 0 "[ . 1 . 2]" 1
1350 1 65 ILE MG 1 90 MET H . . 4.970 4.645 4.256 4.892 . 0 0 "[ . 1 . 2]" 1
1351 1 65 ILE MG 1 90 MET HA . . 4.690 4.348 3.996 4.586 . 0 0 "[ . 1 . 2]" 1
1352 1 65 ILE MG 1 90 MET HB2 . . 3.760 2.574 2.211 2.901 . 0 0 "[ . 1 . 2]" 1
1353 1 65 ILE MG 1 90 MET HB3 . . 3.660 2.685 2.292 2.861 . 0 0 "[ . 1 . 2]" 1
1354 1 65 ILE MG 1 90 MET HG2 . . 4.950 4.612 4.199 4.885 . 0 0 "[ . 1 . 2]" 1
1355 1 65 ILE MG 1 90 MET HG3 . . 4.270 3.769 3.316 4.069 . 0 0 "[ . 1 . 2]" 1
1356 1 65 ILE MG 1 91 VAL H . . 4.180 3.380 3.015 3.874 . 0 0 "[ . 1 . 2]" 1
1357 1 65 ILE MG 1 91 VAL HA . . 3.530 2.860 2.620 3.202 . 0 0 "[ . 1 . 2]" 1
1358 1 66 LYS H 1 66 LYS QB . . 3.160 2.242 2.174 2.272 . 0 0 "[ . 1 . 2]" 1
1359 1 66 LYS H 1 66 LYS QD . . 4.840 4.554 4.277 4.803 . 0 0 "[ . 1 . 2]" 1
1360 1 66 LYS H 1 66 LYS QE . . 4.870 4.500 4.100 4.788 . 0 0 "[ . 1 . 2]" 1
1361 1 66 LYS H 1 66 LYS HG2 . . 4.800 4.513 4.330 4.630 . 0 0 "[ . 1 . 2]" 1
1362 1 66 LYS H 1 66 LYS QG . . 4.180 3.961 3.915 3.992 . 0 0 "[ . 1 . 2]" 1
1363 1 66 LYS H 1 66 LYS HG3 . . 4.800 4.398 4.228 4.597 . 0 0 "[ . 1 . 2]" 1
1364 1 66 LYS H 1 67 GLU H . . 3.150 2.563 2.439 2.736 . 0 0 "[ . 1 . 2]" 1
1365 1 66 LYS H 1 88 SER HA . . 5.500 5.451 5.186 5.517 0.017 16 0 "[ . 1 . 2]" 1
1366 1 66 LYS H 1 91 VAL MG2 . . 3.390 2.775 2.540 2.932 . 0 0 "[ . 1 . 2]" 1
1367 1 66 LYS HA 1 66 LYS QD . . 4.380 3.926 3.656 4.305 . 0 0 "[ . 1 . 2]" 1
1368 1 66 LYS HA 1 66 LYS QE . . 4.590 4.313 3.882 4.617 0.027 16 0 "[ . 1 . 2]" 1
1369 1 66 LYS HA 1 66 LYS HG2 . . 3.920 3.145 2.757 3.584 . 0 0 "[ . 1 . 2]" 1
1370 1 66 LYS HA 1 66 LYS QG . . 3.370 2.341 2.168 2.575 . 0 0 "[ . 1 . 2]" 1
1371 1 66 LYS HA 1 66 LYS HG3 . . 3.920 2.434 2.210 2.773 . 0 0 "[ . 1 . 2]" 1
1372 1 66 LYS HA 1 69 ASN H . . 4.530 4.053 3.839 4.264 . 0 0 "[ . 1 . 2]" 1
1373 1 66 LYS HA 1 69 ASN QB . . 4.320 3.096 2.864 3.265 . 0 0 "[ . 1 . 2]" 1
1374 1 66 LYS HA 1 69 ASN HD21 . . 4.730 4.204 3.914 4.490 . 0 0 "[ . 1 . 2]" 1
1375 1 66 LYS HA 1 87 PRO HB2 . . 4.140 2.637 2.377 3.010 . 0 0 "[ . 1 . 2]" 1
1376 1 66 LYS HA 1 87 PRO HB3 . . 4.100 3.764 3.512 4.073 . 0 0 "[ . 1 . 2]" 1
1377 1 66 LYS HA 1 87 PRO QG . . 5.350 4.411 4.166 4.707 . 0 0 "[ . 1 . 2]" 1
1378 1 66 LYS HA 1 91 VAL MG2 . . 3.480 2.876 2.767 3.091 . 0 0 "[ . 1 . 2]" 1
1379 1 66 LYS QB 1 66 LYS QE . . 4.430 2.189 1.966 2.437 . 0 0 "[ . 1 . 2]" 1
1380 1 66 LYS QB 1 67 GLU H . . 2.990 2.421 2.207 2.739 . 0 0 "[ . 1 . 2]" 1
1381 1 66 LYS QB 1 88 SER HA . . 4.690 3.220 2.574 3.531 . 0 0 "[ . 1 . 2]" 1
1382 1 66 LYS QB 1 91 VAL MG2 . . 3.360 1.941 1.756 2.109 . 0 0 "[ . 1 . 2]" 1
1383 1 66 LYS QD 1 87 PRO HB2 . . 4.560 4.005 3.586 4.328 . 0 0 "[ . 1 . 2]" 1
1384 1 66 LYS QD 1 88 SER H . . 4.420 3.826 3.239 4.420 . 0 0 "[ . 1 . 2]" 1
1385 1 66 LYS QD 1 88 SER HA . . 4.370 2.616 1.887 3.721 . 0 0 "[ . 1 . 2]" 1
1386 1 66 LYS QD 1 88 SER QB . . 4.150 2.495 1.840 3.825 . 0 0 "[ . 1 . 2]" 1
1387 1 66 LYS QD 1 91 VAL MG2 . . 3.970 3.209 2.222 3.971 0.001 18 0 "[ . 1 . 2]" 1
1388 1 66 LYS QE 1 88 SER H . . 5.230 4.740 3.987 5.279 0.049 16 0 "[ . 1 . 2]" 1
1389 1 66 LYS QE 1 88 SER HA . . 4.250 3.088 1.984 4.033 . 0 0 "[ . 1 . 2]" 1
1390 1 66 LYS QE 1 88 SER QB . . 3.680 3.083 2.027 3.693 0.013 16 0 "[ . 1 . 2]" 1
1391 1 66 LYS QE 1 91 VAL MG2 . . 4.040 3.219 2.137 4.028 . 0 0 "[ . 1 . 2]" 1
1392 1 66 LYS QG 1 67 GLU H . . 4.220 3.707 3.192 4.036 . 0 0 "[ . 1 . 2]" 1
1393 1 66 LYS QG 1 87 PRO HB3 . . 4.370 3.746 3.494 4.072 . 0 0 "[ . 1 . 2]" 1
1394 1 66 LYS QG 1 88 SER H . . 4.620 3.011 2.695 3.310 . 0 0 "[ . 1 . 2]" 1
1395 1 66 LYS QG 1 88 SER QB . . 4.470 3.118 2.787 3.737 . 0 0 "[ . 1 . 2]" 1
1396 1 66 LYS HG2 1 87 PRO HB2 . . 4.290 2.806 2.146 3.609 . 0 0 "[ . 1 . 2]" 1
1397 1 66 LYS HG2 1 87 PRO HB3 . . 5.190 4.421 3.732 5.103 . 0 0 "[ . 1 . 2]" 1
1398 1 66 LYS HG2 1 88 SER HA . . 4.630 3.784 3.400 4.518 . 0 0 "[ . 1 . 2]" 1
1399 1 66 LYS HG3 1 87 PRO HB2 . . 4.290 2.387 1.997 2.715 . 0 0 "[ . 1 . 2]" 1
1400 1 66 LYS HG3 1 87 PRO HB3 . . 5.190 4.124 3.677 4.475 . 0 0 "[ . 1 . 2]" 1
1401 1 66 LYS HG3 1 88 SER HA . . 4.630 2.253 1.996 3.369 . 0 0 "[ . 1 . 2]" 1
1402 1 67 GLU H 1 67 GLU HB2 . . 3.620 2.464 2.213 2.612 . 0 0 "[ . 1 . 2]" 1
1403 1 67 GLU H 1 67 GLU HB3 . . 3.170 2.594 2.437 2.901 . 0 0 "[ . 1 . 2]" 1
1404 1 67 GLU H 1 67 GLU HG2 . . 4.890 4.533 4.427 4.633 . 0 0 "[ . 1 . 2]" 1
1405 1 67 GLU H 1 67 GLU QG . . 4.280 3.990 3.955 4.041 . 0 0 "[ . 1 . 2]" 1
1406 1 67 GLU H 1 67 GLU HG3 . . 4.890 4.431 4.396 4.487 . 0 0 "[ . 1 . 2]" 1
1407 1 67 GLU H 1 68 ASN H . . 3.220 2.954 2.762 3.092 . 0 0 "[ . 1 . 2]" 1
1408 1 67 GLU H 1 68 ASN HB2 . . 5.500 4.668 4.521 4.843 . 0 0 "[ . 1 . 2]" 1
1409 1 67 GLU H 1 91 VAL MG2 . . 4.680 4.606 4.384 4.683 0.003 19 0 "[ . 1 . 2]" 1
1410 1 67 GLU HA 1 70 LYS H . . 3.830 3.442 3.178 3.650 . 0 0 "[ . 1 . 2]" 1
1411 1 67 GLU HA 1 70 LYS HB3 . . 3.420 2.430 2.293 2.611 . 0 0 "[ . 1 . 2]" 1
1412 1 67 GLU HA 1 70 LYS QG . . 4.180 3.950 3.686 4.182 0.002 17 0 "[ . 1 . 2]" 1
1413 1 67 GLU HB2 1 68 ASN H . . 3.700 3.549 3.272 3.664 . 0 0 "[ . 1 . 2]" 1
1414 1 67 GLU HB3 1 68 ASN H . . 3.540 2.071 1.968 2.223 . 0 0 "[ . 1 . 2]" 1
1415 1 67 GLU QG 1 68 ASN H . . 4.360 3.189 2.764 3.679 . 0 0 "[ . 1 . 2]" 1
1416 1 67 GLU QG 1 69 ASN H . . 5.340 5.158 4.898 5.338 . 0 0 "[ . 1 . 2]" 1
1417 1 67 GLU QG 1 71 LYS H . . 4.750 3.808 3.543 4.173 . 0 0 "[ . 1 . 2]" 1
1418 1 67 GLU QG 1 71 LYS QE . . 3.570 2.997 1.725 3.625 0.055 19 0 "[ . 1 . 2]" 1
1419 1 67 GLU HG2 1 71 LYS H . . 5.500 4.741 3.667 5.502 0.002 17 0 "[ . 1 . 2]" 1
1420 1 67 GLU HG3 1 71 LYS H . . 5.500 4.160 3.632 5.005 . 0 0 "[ . 1 . 2]" 1
1421 1 68 ASN H 1 68 ASN HB2 . . 3.740 2.414 2.306 2.510 . 0 0 "[ . 1 . 2]" 1
1422 1 68 ASN H 1 68 ASN HB3 . . 3.800 3.601 3.559 3.622 . 0 0 "[ . 1 . 2]" 1
1423 1 68 ASN H 1 69 ASN H . . 3.310 3.102 2.988 3.212 . 0 0 "[ . 1 . 2]" 1
1424 1 68 ASN H 1 70 LYS H . . 4.680 4.508 4.349 4.657 . 0 0 "[ . 1 . 2]" 1
1425 1 68 ASN H 1 71 LYS H . . 5.380 4.805 4.696 4.945 . 0 0 "[ . 1 . 2]" 1
1426 1 68 ASN HA 1 68 ASN HD22 . . 4.630 4.479 4.400 4.558 . 0 0 "[ . 1 . 2]" 1
1427 1 68 ASN HA 1 69 ASN HA . . 4.850 4.768 4.717 4.799 . 0 0 "[ . 1 . 2]" 1
1428 1 68 ASN HA 1 71 LYS H . . 4.010 3.851 3.674 4.013 0.003 15 0 "[ . 1 . 2]" 1
1429 1 68 ASN HA 1 71 LYS HB2 . . 4.010 3.198 2.859 3.369 . 0 0 "[ . 1 . 2]" 1
1430 1 68 ASN HA 1 71 LYS HB3 . . 4.740 4.613 4.364 4.790 0.050 15 0 "[ . 1 . 2]" 1
1431 1 68 ASN HA 1 71 LYS HD2 . . 4.630 3.219 2.074 4.506 . 0 0 "[ . 1 . 2]" 1
1432 1 68 ASN HA 1 71 LYS QD . . 3.910 3.044 2.064 3.949 0.039 2 0 "[ . 1 . 2]" 1
1433 1 68 ASN HA 1 71 LYS HD3 . . 4.630 4.080 2.614 4.675 0.045 15 0 "[ . 1 . 2]" 1
1434 1 68 ASN HA 1 71 LYS QE . . 5.340 4.303 1.873 5.190 . 0 0 "[ . 1 . 2]" 1
1435 1 68 ASN HA 1 72 ALA H . . 4.930 4.703 4.548 4.909 . 0 0 "[ . 1 . 2]" 1
1436 1 68 ASN HB2 1 69 ASN H . . 3.870 2.550 2.362 2.740 . 0 0 "[ . 1 . 2]" 1
1437 1 68 ASN HB3 1 69 ASN H . . 3.710 3.153 2.917 3.485 . 0 0 "[ . 1 . 2]" 1
1438 1 69 ASN H 1 69 ASN HB2 . . 3.560 2.226 2.178 2.295 . 0 0 "[ . 1 . 2]" 1
1439 1 69 ASN H 1 69 ASN HB3 . . 3.560 3.518 3.483 3.551 . 0 0 "[ . 1 . 2]" 1
1440 1 69 ASN H 1 69 ASN HD21 . . 3.470 2.214 1.940 2.620 . 0 0 "[ . 1 . 2]" 1
1441 1 69 ASN H 1 70 LYS H . . 3.460 2.759 2.562 2.899 . 0 0 "[ . 1 . 2]" 1
1442 1 69 ASN H 1 70 LYS HB2 . . 5.500 5.196 4.981 5.416 . 0 0 "[ . 1 . 2]" 1
1443 1 69 ASN H 1 70 LYS HB3 . . 4.900 4.786 4.534 4.900 . 0 0 "[ . 1 . 2]" 1
1444 1 69 ASN H 1 71 LYS HB2 . . 5.500 5.171 4.940 5.442 . 0 0 "[ . 1 . 2]" 1
1445 1 69 ASN HA 1 69 ASN HD21 . . 4.690 3.274 3.008 3.700 . 0 0 "[ . 1 . 2]" 1
1446 1 69 ASN HA 1 72 ALA H . . 4.220 3.675 3.453 3.832 . 0 0 "[ . 1 . 2]" 1
1447 1 69 ASN HA 1 72 ALA MB . . 3.700 3.002 2.818 3.190 . 0 0 "[ . 1 . 2]" 1
1448 1 69 ASN HA 1 73 TYR QE . . 4.450 4.198 3.967 4.329 . 0 0 "[ . 1 . 2]" 1
1449 1 69 ASN QB 1 70 LYS H . . 3.460 2.479 2.353 2.599 . 0 0 "[ . 1 . 2]" 1
1450 1 69 ASN QB 1 70 LYS HA . . 4.540 3.776 3.724 3.821 . 0 0 "[ . 1 . 2]" 1
1451 1 69 ASN QB 1 71 LYS H . . 5.340 4.666 4.537 4.914 . 0 0 "[ . 1 . 2]" 1
1452 1 69 ASN QB 1 73 TYR QE . . 3.740 2.110 1.984 2.686 . 0 0 "[ . 1 . 2]" 1
1453 1 69 ASN QB 1 87 PRO HA . . 3.470 2.120 1.919 2.330 . 0 0 "[ . 1 . 2]" 1
1454 1 69 ASN QB 1 87 PRO QD . . 4.930 3.785 3.553 4.076 . 0 0 "[ . 1 . 2]" 1
1455 1 69 ASN QB 1 90 MET HG3 . . 4.630 3.588 3.346 3.783 . 0 0 "[ . 1 . 2]" 1
1456 1 69 ASN HB2 1 70 LYS H . . 3.950 2.604 2.468 2.736 . 0 0 "[ . 1 . 2]" 1
1457 1 69 ASN HB2 1 73 TYR QE . . 4.440 3.535 3.358 4.109 . 0 0 "[ . 1 . 2]" 1
1458 1 69 ASN HB3 1 70 LYS H . . 3.950 3.120 2.933 3.309 . 0 0 "[ . 1 . 2]" 1
1459 1 69 ASN HB3 1 73 TYR QE . . 4.440 2.128 1.997 2.723 . 0 0 "[ . 1 . 2]" 1
1460 1 69 ASN HD22 1 90 MET HB3 . . 4.980 4.369 4.076 4.625 . 0 0 "[ . 1 . 2]" 1
1461 1 69 ASN HD22 1 90 MET ME . . 4.810 2.668 2.211 3.119 . 0 0 "[ . 1 . 2]" 1
1462 1 69 ASN HD22 1 90 MET HG3 . . 4.530 3.363 3.033 3.793 . 0 0 "[ . 1 . 2]" 1
1463 1 70 LYS H 1 70 LYS HB2 . . 3.270 2.563 2.479 2.708 . 0 0 "[ . 1 . 2]" 1
1464 1 70 LYS H 1 70 LYS HB3 . . 3.890 2.492 2.370 2.582 . 0 0 "[ . 1 . 2]" 1
1465 1 70 LYS H 1 70 LYS QG . . 4.160 3.998 3.941 4.044 . 0 0 "[ . 1 . 2]" 1
1466 1 70 LYS H 1 71 LYS H . . 3.490 2.867 2.664 2.973 . 0 0 "[ . 1 . 2]" 1
1467 1 70 LYS H 1 72 ALA H . . 4.800 4.579 4.186 4.796 . 0 0 "[ . 1 . 2]" 1
1468 1 70 LYS H 1 87 PRO HB2 . . 4.290 3.158 2.891 3.416 . 0 0 "[ . 1 . 2]" 1
1469 1 70 LYS H 1 87 PRO HB3 . . 4.010 2.354 1.957 2.743 . 0 0 "[ . 1 . 2]" 1
1470 1 70 LYS H 1 87 PRO QG . . 4.240 3.746 3.343 4.039 . 0 0 "[ . 1 . 2]" 1
1471 1 70 LYS HA 1 70 LYS QG . . 3.530 2.713 2.404 2.978 . 0 0 "[ . 1 . 2]" 1
1472 1 70 LYS HA 1 72 ALA H . . 5.500 4.609 4.112 4.897 . 0 0 "[ . 1 . 2]" 1
1473 1 70 LYS HA 1 73 TYR H . . 4.190 3.924 3.621 4.193 0.003 12 0 "[ . 1 . 2]" 1
1474 1 70 LYS HA 1 73 TYR QD . . 4.670 2.123 2.001 2.679 . 0 0 "[ . 1 . 2]" 1
1475 1 70 LYS HA 1 73 TYR QE . . 4.550 3.649 3.503 4.094 . 0 0 "[ . 1 . 2]" 1
1476 1 70 LYS HA 1 74 ASP H . . 4.660 4.198 3.942 4.584 . 0 0 "[ . 1 . 2]" 1
1477 1 70 LYS HA 1 87 PRO HA . . 5.210 4.972 4.626 5.219 0.009 15 0 "[ . 1 . 2]" 1
1478 1 70 LYS HA 1 87 PRO HB2 . . 4.950 4.107 3.814 4.371 . 0 0 "[ . 1 . 2]" 1
1479 1 70 LYS HA 1 87 PRO QG . . 3.790 2.737 2.361 3.092 . 0 0 "[ . 1 . 2]" 1
1480 1 70 LYS HB2 1 87 PRO HB3 . . 4.590 2.884 2.360 3.315 . 0 0 "[ . 1 . 2]" 1
1481 1 70 LYS HB3 1 71 LYS H . . 3.070 2.527 2.317 2.743 . 0 0 "[ . 1 . 2]" 1
1482 1 70 LYS QD 1 87 PRO HB3 . . 5.270 4.254 3.644 5.271 0.001 18 0 "[ . 1 . 2]" 1
1483 1 70 LYS QE 1 70 LYS QG . . 3.160 2.267 2.076 2.555 . 0 0 "[ . 1 . 2]" 1
1484 1 70 LYS QG 1 71 LYS HA . . 3.960 3.497 3.288 3.965 0.005 18 0 "[ . 1 . 2]" 1
1485 1 70 LYS QG 1 87 PRO QG . . 4.540 3.701 2.986 4.320 . 0 0 "[ . 1 . 2]" 1
1486 1 71 LYS H 1 71 LYS HB2 . . 3.170 2.530 2.328 2.735 . 0 0 "[ . 1 . 2]" 1
1487 1 71 LYS H 1 71 LYS HB3 . . 3.980 3.584 3.559 3.600 . 0 0 "[ . 1 . 2]" 1
1488 1 71 LYS H 1 71 LYS QD . . 4.440 4.020 3.365 4.331 . 0 0 "[ . 1 . 2]" 1
1489 1 71 LYS H 1 71 LYS QE . . 5.340 4.537 2.923 5.070 . 0 0 "[ . 1 . 2]" 1
1490 1 71 LYS H 1 71 LYS HG2 . . 4.030 3.070 2.508 3.939 . 0 0 "[ . 1 . 2]" 1
1491 1 71 LYS H 1 71 LYS QG . . 3.530 2.272 1.868 2.551 . 0 0 "[ . 1 . 2]" 1
1492 1 71 LYS H 1 71 LYS HG3 . . 4.030 2.357 1.885 2.636 . 0 0 "[ . 1 . 2]" 1
1493 1 71 LYS H 1 72 ALA H . . 3.350 2.965 2.800 3.107 . 0 0 "[ . 1 . 2]" 1
1494 1 71 LYS H 1 73 TYR H . . 5.500 4.852 4.625 5.029 . 0 0 "[ . 1 . 2]" 1
1495 1 71 LYS HA 1 71 LYS QD . . 4.500 3.919 3.722 4.219 . 0 0 "[ . 1 . 2]" 1
1496 1 71 LYS HA 1 71 LYS QE . . 4.450 4.138 3.233 4.484 0.034 2 0 "[ . 1 . 2]" 1
1497 1 71 LYS HA 1 71 LYS HG2 . . 4.010 2.438 2.268 2.790 . 0 0 "[ . 1 . 2]" 1
1498 1 71 LYS HA 1 71 LYS QG . . 3.450 2.352 2.223 2.519 . 0 0 "[ . 1 . 2]" 1
1499 1 71 LYS HA 1 71 LYS HG3 . . 4.010 3.253 2.509 3.540 . 0 0 "[ . 1 . 2]" 1
1500 1 71 LYS HA 1 74 ASP H . . 4.460 3.943 3.815 4.172 . 0 0 "[ . 1 . 2]" 1
1501 1 71 LYS HA 1 74 ASP HB2 . . 4.510 3.392 2.671 3.949 . 0 0 "[ . 1 . 2]" 1
1502 1 71 LYS HA 1 74 ASP HB3 . . 4.510 3.611 2.985 4.473 . 0 0 "[ . 1 . 2]" 1
1503 1 71 LYS HB2 1 71 LYS QE . . 4.640 3.855 1.978 4.270 . 0 0 "[ . 1 . 2]" 1
1504 1 71 LYS HB2 1 72 ALA H . . 3.410 2.373 2.172 2.674 . 0 0 "[ . 1 . 2]" 1
1505 1 71 LYS HB2 1 72 ALA HA . . 4.470 4.297 4.080 4.537 0.067 15 0 "[ . 1 . 2]" 1
1506 1 71 LYS HB3 1 72 ALA H . . 4.440 3.339 2.931 3.840 . 0 0 "[ . 1 . 2]" 1
1507 1 71 LYS QD 1 72 ALA H . . 5.310 4.681 4.151 5.060 . 0 0 "[ . 1 . 2]" 1
1508 1 71 LYS QE 1 71 LYS QG . . 2.950 2.212 2.036 2.564 . 0 0 "[ . 1 . 2]" 1
1509 1 71 LYS QG 1 72 ALA H . . 4.190 3.973 3.711 4.183 . 0 0 "[ . 1 . 2]" 1
1510 1 72 ALA H 1 72 ALA MB . . 2.820 2.097 2.030 2.211 . 0 0 "[ . 1 . 2]" 1
1511 1 72 ALA H 1 73 TYR H . . 3.330 3.063 2.821 3.271 . 0 0 "[ . 1 . 2]" 1
1512 1 72 ALA H 1 73 TYR QB . . 5.160 4.918 4.735 5.084 . 0 0 "[ . 1 . 2]" 1
1513 1 72 ALA H 1 74 ASP H . . 4.730 4.176 3.853 4.484 . 0 0 "[ . 1 . 2]" 1
1514 1 72 ALA HA 1 76 PHE H . . 3.900 3.545 3.185 3.747 . 0 0 "[ . 1 . 2]" 1
1515 1 72 ALA MB 1 73 TYR H . . 3.110 2.223 2.140 2.382 . 0 0 "[ . 1 . 2]" 1
1516 1 72 ALA MB 1 73 TYR QB . . 4.380 4.251 4.192 4.330 . 0 0 "[ . 1 . 2]" 1
1517 1 72 ALA MB 1 73 TYR QD . . 4.030 3.457 3.039 3.764 . 0 0 "[ . 1 . 2]" 1
1518 1 72 ALA MB 1 73 TYR QE . . 4.440 4.007 3.711 4.280 . 0 0 "[ . 1 . 2]" 1
1519 1 72 ALA MB 1 74 ASP H . . 4.500 4.246 4.059 4.459 . 0 0 "[ . 1 . 2]" 1
1520 1 72 ALA MB 1 75 GLY H . . 4.550 4.391 4.256 4.496 . 0 0 "[ . 1 . 2]" 1
1521 1 72 ALA MB 1 76 PHE HB2 . . 4.480 3.949 3.753 4.154 . 0 0 "[ . 1 . 2]" 1
1522 1 72 ALA MB 1 76 PHE QD . . 4.620 2.087 1.968 2.286 . 0 0 "[ . 1 . 2]" 1
1523 1 72 ALA MB 1 76 PHE QE . . 3.670 2.042 1.804 2.326 . 0 0 "[ . 1 . 2]" 1
1524 1 72 ALA MB 1 77 ALA H . . 5.500 5.503 5.451 5.572 0.072 14 0 "[ . 1 . 2]" 1
1525 1 72 ALA MB 1 104 TYR QE . . 4.460 3.840 3.489 4.158 . 0 0 "[ . 1 . 2]" 1
1526 1 73 TYR H 1 73 TYR QB . . 3.250 2.697 2.618 2.793 . 0 0 "[ . 1 . 2]" 1
1527 1 73 TYR H 1 73 TYR QD . . 3.410 2.826 2.383 3.022 . 0 0 "[ . 1 . 2]" 1
1528 1 73 TYR H 1 73 TYR QE . . 4.500 4.079 3.885 4.261 . 0 0 "[ . 1 . 2]" 1
1529 1 73 TYR H 1 74 ASP H . . 3.350 3.013 2.810 3.155 . 0 0 "[ . 1 . 2]" 1
1530 1 73 TYR H 1 75 GLY H . . 4.500 4.439 4.308 4.502 0.002 2 0 "[ . 1 . 2]" 1
1531 1 73 TYR HA 1 73 TYR QD . . 3.910 2.121 2.007 2.231 . 0 0 "[ . 1 . 2]" 1
1532 1 73 TYR HA 1 76 PHE H . . 4.420 3.857 3.646 4.150 . 0 0 "[ . 1 . 2]" 1
1533 1 73 TYR HA 1 76 PHE QD . . 4.390 3.148 2.862 3.580 . 0 0 "[ . 1 . 2]" 1
1534 1 73 TYR HA 1 77 ALA H . . 4.590 3.380 3.074 4.025 . 0 0 "[ . 1 . 2]" 1
1535 1 73 TYR QB 1 74 ASP H . . 3.750 2.551 2.263 2.946 . 0 0 "[ . 1 . 2]" 1
1536 1 73 TYR QB 1 75 GLY H . . 5.430 4.775 4.591 4.957 . 0 0 "[ . 1 . 2]" 1
1537 1 73 TYR QB 1 83 ARG HA . . 4.890 4.389 3.884 4.793 . 0 0 "[ . 1 . 2]" 1
1538 1 73 TYR QB 1 83 ARG QB . . 4.500 2.824 2.092 3.943 . 0 0 "[ . 1 . 2]" 1
1539 1 73 TYR QD 1 74 ASP H . . 4.670 4.265 4.018 4.502 . 0 0 "[ . 1 . 2]" 1
1540 1 73 TYR QD 1 76 PHE QD . . 4.480 3.500 3.138 3.895 . 0 0 "[ . 1 . 2]" 1
1541 1 73 TYR QD 1 87 PRO HA . . 5.120 4.505 4.173 4.808 . 0 0 "[ . 1 . 2]" 1
1542 1 73 TYR QD 1 87 PRO HD2 . . 4.650 3.918 3.750 4.233 . 0 0 "[ . 1 . 2]" 1
1543 1 73 TYR QD 1 87 PRO QD . . 3.970 2.245 2.031 2.610 . 0 0 "[ . 1 . 2]" 1
1544 1 73 TYR QD 1 87 PRO HD3 . . 4.650 2.259 2.039 2.634 . 0 0 "[ . 1 . 2]" 1
1545 1 73 TYR QD 1 87 PRO HG2 . . 4.510 4.387 4.057 4.517 0.007 16 0 "[ . 1 . 2]" 1
1546 1 73 TYR QD 1 87 PRO HG3 . . 4.510 2.870 2.517 3.156 . 0 0 "[ . 1 . 2]" 1
1547 1 73 TYR QD 1 104 TYR QE . . 4.090 2.777 2.177 3.379 . 0 0 "[ . 1 . 2]" 1
1548 1 73 TYR QE 1 76 PHE QD . . 5.140 4.812 4.502 5.130 . 0 0 "[ . 1 . 2]" 1
1549 1 73 TYR QE 1 85 LEU HB2 . . 4.680 4.318 3.678 4.676 . 0 0 "[ . 1 . 2]" 1
1550 1 73 TYR QE 1 85 LEU MD2 . . 4.020 3.725 3.390 4.020 . 0 0 "[ . 1 . 2]" 1
1551 1 73 TYR QE 1 85 LEU HG . . 4.670 4.400 4.051 4.672 0.002 11 0 "[ . 1 . 2]" 1
1552 1 73 TYR QE 1 86 GLU HA . . 4.140 3.238 2.844 3.428 . 0 0 "[ . 1 . 2]" 1
1553 1 73 TYR QE 1 87 PRO HA . . 3.580 2.428 2.149 2.688 . 0 0 "[ . 1 . 2]" 1
1554 1 73 TYR QE 1 87 PRO QD . . 3.870 2.109 1.986 2.450 . 0 0 "[ . 1 . 2]" 1
1555 1 73 TYR QE 1 87 PRO HG2 . . 4.530 4.120 3.908 4.519 . 0 0 "[ . 1 . 2]" 1
1556 1 73 TYR QE 1 87 PRO HG3 . . 4.530 3.404 3.115 3.907 . 0 0 "[ . 1 . 2]" 1
1557 1 73 TYR QE 1 90 MET ME . . 4.890 4.429 4.273 4.603 . 0 0 "[ . 1 . 2]" 1
1558 1 73 TYR QE 1 104 TYR QE . . 4.000 2.226 2.010 2.586 . 0 0 "[ . 1 . 2]" 1
1559 1 74 ASP H 1 74 ASP HB2 . . 3.770 2.357 2.179 2.694 . 0 0 "[ . 1 . 2]" 1
1560 1 74 ASP H 1 74 ASP QB . . 3.240 2.227 2.153 2.357 . 0 0 "[ . 1 . 2]" 1
1561 1 74 ASP H 1 74 ASP HB3 . . 3.770 2.946 2.504 3.577 . 0 0 "[ . 1 . 2]" 1
1562 1 74 ASP H 1 75 GLY H . . 3.380 2.683 2.375 2.896 . 0 0 "[ . 1 . 2]" 1
1563 1 74 ASP H 1 76 PHE H . . 4.500 4.353 3.921 4.522 0.022 15 0 "[ . 1 . 2]" 1
1564 1 74 ASP QB 1 75 GLY H . . 3.290 2.527 2.437 2.703 . 0 0 "[ . 1 . 2]" 1
1565 1 74 ASP HB2 1 75 GLY H . . 3.960 3.427 2.577 3.892 . 0 0 "[ . 1 . 2]" 1
1566 1 74 ASP HB3 1 75 GLY H . . 3.960 2.764 2.476 3.419 . 0 0 "[ . 1 . 2]" 1
1567 1 75 GLY H 1 76 PHE H . . 3.330 2.667 2.492 2.807 . 0 0 "[ . 1 . 2]" 1
1568 1 75 GLY H 1 76 PHE HB2 . . 5.500 4.639 4.514 4.819 . 0 0 "[ . 1 . 2]" 1
1569 1 75 GLY H 1 76 PHE QD . . 5.310 4.853 4.560 5.022 . 0 0 "[ . 1 . 2]" 1
1570 1 75 GLY H 1 77 ALA H . . 4.300 4.140 3.862 4.301 0.001 4 0 "[ . 1 . 2]" 1
1571 1 75 GLY QA 1 77 ALA H . . 4.650 4.190 3.795 4.349 . 0 0 "[ . 1 . 2]" 1
1572 1 75 GLY QA 1 78 SER H . . 3.940 3.371 3.190 3.569 . 0 0 "[ . 1 . 2]" 1
1573 1 75 GLY HA2 1 78 SER H . . 4.770 3.492 3.280 3.713 . 0 0 "[ . 1 . 2]" 1
1574 1 75 GLY HA3 1 78 SER H . . 4.770 4.454 4.339 4.678 . 0 0 "[ . 1 . 2]" 1
1575 1 76 PHE H 1 76 PHE HB2 . . 3.410 2.422 2.317 2.498 . 0 0 "[ . 1 . 2]" 1
1576 1 76 PHE H 1 76 PHE HB3 . . 3.700 3.584 3.560 3.592 . 0 0 "[ . 1 . 2]" 1
1577 1 76 PHE H 1 76 PHE QD . . 3.680 3.121 2.876 3.234 . 0 0 "[ . 1 . 2]" 1
1578 1 76 PHE H 1 77 ALA H . . 3.500 2.833 2.556 2.988 . 0 0 "[ . 1 . 2]" 1
1579 1 76 PHE H 1 77 ALA MB . . 4.810 4.478 4.258 4.577 . 0 0 "[ . 1 . 2]" 1
1580 1 76 PHE H 1 78 SER H . . 4.740 3.896 3.718 4.064 . 0 0 "[ . 1 . 2]" 1
1581 1 76 PHE H 1 79 ILE MD . . 5.500 5.314 4.165 5.501 0.001 15 0 "[ . 1 . 2]" 1
1582 1 76 PHE H 1 81 ILE HB . . 5.270 5.086 4.911 5.234 . 0 0 "[ . 1 . 2]" 1
1583 1 76 PHE H 1 81 ILE MD . . 4.880 4.743 4.495 4.883 0.003 8 0 "[ . 1 . 2]" 1
1584 1 76 PHE HA 1 76 PHE QD . . 3.770 2.152 1.997 2.386 . 0 0 "[ . 1 . 2]" 1
1585 1 76 PHE HA 1 79 ILE MD . . 3.790 2.918 1.971 3.137 . 0 0 "[ . 1 . 2]" 1
1586 1 76 PHE HA 1 79 ILE HG12 . . 4.380 2.937 2.605 3.901 . 0 0 "[ . 1 . 2]" 1
1587 1 76 PHE HA 1 79 ILE QG . . 3.780 2.853 2.555 3.619 . 0 0 "[ . 1 . 2]" 1
1588 1 76 PHE HA 1 79 ILE HG13 . . 4.380 3.918 3.560 4.290 . 0 0 "[ . 1 . 2]" 1
1589 1 76 PHE HA 1 81 ILE MD . . 4.070 2.678 2.283 3.002 . 0 0 "[ . 1 . 2]" 1
1590 1 76 PHE HB2 1 77 ALA H . . 3.810 2.514 2.358 2.905 . 0 0 "[ . 1 . 2]" 1
1591 1 76 PHE HB2 1 77 ALA MB . . 4.680 3.891 3.786 4.118 . 0 0 "[ . 1 . 2]" 1
1592 1 76 PHE HB2 1 81 ILE H . . 5.500 5.457 5.323 5.503 0.003 15 0 "[ . 1 . 2]" 1
1593 1 76 PHE HB2 1 81 ILE HB . . 4.360 3.446 3.206 3.624 . 0 0 "[ . 1 . 2]" 1
1594 1 76 PHE HB2 1 81 ILE MD . . 4.250 3.664 3.434 3.911 . 0 0 "[ . 1 . 2]" 1
1595 1 76 PHE HB2 1 81 ILE MG . . 4.320 3.490 2.879 3.802 . 0 0 "[ . 1 . 2]" 1
1596 1 76 PHE HB2 1 104 TYR QE . . 4.520 4.362 4.228 4.528 0.008 15 0 "[ . 1 . 2]" 1
1597 1 76 PHE HB3 1 77 ALA H . . 4.120 3.388 3.167 3.708 . 0 0 "[ . 1 . 2]" 1
1598 1 76 PHE HB3 1 77 ALA MB . . 5.330 4.481 4.326 4.639 . 0 0 "[ . 1 . 2]" 1
1599 1 76 PHE HB3 1 81 ILE H . . 4.670 4.540 4.344 4.670 . 0 0 "[ . 1 . 2]" 1
1600 1 76 PHE HB3 1 81 ILE HB . . 3.950 2.219 1.999 2.398 . 0 0 "[ . 1 . 2]" 1
1601 1 76 PHE HB3 1 81 ILE MD . . 4.550 2.139 1.963 2.468 . 0 0 "[ . 1 . 2]" 1
1602 1 76 PHE HB3 1 81 ILE MG . . 3.800 2.394 2.086 2.711 . 0 0 "[ . 1 . 2]" 1
1603 1 76 PHE QD 1 77 ALA H . . 4.580 4.305 4.116 4.572 . 0 0 "[ . 1 . 2]" 1
1604 1 76 PHE QD 1 79 ILE MD . . 3.680 3.107 2.598 3.377 . 0 0 "[ . 1 . 2]" 1
1605 1 76 PHE QD 1 79 ILE QG . . 5.180 4.068 3.729 4.332 . 0 0 "[ . 1 . 2]" 1
1606 1 76 PHE QD 1 81 ILE HB . . 4.940 4.177 3.912 4.390 . 0 0 "[ . 1 . 2]" 1
1607 1 76 PHE QD 1 81 ILE MD . . 3.450 2.263 1.981 2.662 . 0 0 "[ . 1 . 2]" 1
1608 1 76 PHE QD 1 81 ILE MG . . 4.450 3.868 3.621 4.169 . 0 0 "[ . 1 . 2]" 1
1609 1 76 PHE QD 1 104 TYR QE . . 4.210 3.598 3.235 3.979 . 0 0 "[ . 1 . 2]" 1
1610 1 76 PHE QD 1 108 ILE MD . . 5.400 3.941 3.529 4.163 . 0 0 "[ . 1 . 2]" 1
1611 1 76 PHE QD 1 108 ILE HG12 . . 4.880 3.386 3.008 3.585 . 0 0 "[ . 1 . 2]" 1
1612 1 76 PHE QD 1 108 ILE MG . . 4.710 3.054 2.412 3.435 . 0 0 "[ . 1 . 2]" 1
1613 1 76 PHE QE 1 108 ILE HG12 . . 4.580 3.375 3.049 3.595 . 0 0 "[ . 1 . 2]" 1
1614 1 76 PHE QE 1 108 ILE MG . . 4.100 2.405 1.996 2.776 . 0 0 "[ . 1 . 2]" 1
1615 1 77 ALA H 1 77 ALA MB . . 2.960 2.177 2.037 2.240 . 0 0 "[ . 1 . 2]" 1
1616 1 77 ALA H 1 78 SER H . . 3.330 2.587 2.505 2.664 . 0 0 "[ . 1 . 2]" 1
1617 1 77 ALA H 1 78 SER QB . . 4.600 4.321 4.206 4.606 0.006 5 0 "[ . 1 . 2]" 1
1618 1 77 ALA H 1 79 ILE H . . 4.580 4.536 4.403 4.585 0.005 15 0 "[ . 1 . 2]" 1
1619 1 77 ALA H 1 80 GLY H . . 5.170 4.975 4.796 5.118 . 0 0 "[ . 1 . 2]" 1
1620 1 77 ALA HA 1 80 GLY H . . 3.410 3.096 2.776 3.326 . 0 0 "[ . 1 . 2]" 1
1621 1 77 ALA HA 1 81 ILE H . . 3.360 2.193 1.898 3.241 . 0 0 "[ . 1 . 2]" 1
1622 1 77 ALA MB 1 78 SER H . . 3.300 3.015 2.753 3.305 0.005 6 0 "[ . 1 . 2]" 1
1623 1 77 ALA MB 1 78 SER HA . . 4.400 3.893 3.777 4.014 . 0 0 "[ . 1 . 2]" 1
1624 1 77 ALA MB 1 80 GLY H . . 4.620 4.374 4.081 4.607 . 0 0 "[ . 1 . 2]" 1
1625 1 77 ALA MB 1 82 SER HA . . 4.030 3.645 3.007 4.032 0.002 5 0 "[ . 1 . 2]" 1
1626 1 77 ALA MB 1 83 ARG H . . 4.540 3.544 2.855 4.405 . 0 0 "[ . 1 . 2]" 1
1627 1 77 ALA MB 1 83 ARG QD . . 4.590 2.954 1.714 4.591 0.001 16 0 "[ . 1 . 2]" 1
1628 1 78 SER H 1 78 SER QB . . 2.980 2.233 2.177 2.432 . 0 0 "[ . 1 . 2]" 1
1629 1 78 SER H 1 79 ILE H . . 3.410 2.688 2.318 2.986 . 0 0 "[ . 1 . 2]" 1
1630 1 78 SER H 1 79 ILE MG . . 4.920 4.677 4.458 4.884 . 0 0 "[ . 1 . 2]" 1
1631 1 78 SER H 1 80 GLY H . . 4.280 3.966 3.704 4.207 . 0 0 "[ . 1 . 2]" 1
1632 1 78 SER QB 1 79 ILE H . . 3.940 2.608 2.349 3.037 . 0 0 "[ . 1 . 2]" 1
1633 1 78 SER QB 1 79 ILE MG . . 4.550 3.222 3.022 3.578 . 0 0 "[ . 1 . 2]" 1
1634 1 78 SER QB 1 80 GLY H . . 4.960 4.620 4.524 4.865 . 0 0 "[ . 1 . 2]" 1
1635 1 79 ILE H 1 79 ILE HB . . 3.940 3.598 3.582 3.616 . 0 0 "[ . 1 . 2]" 1
1636 1 79 ILE H 1 79 ILE HG12 . . 3.480 1.946 1.897 2.181 . 0 0 "[ . 1 . 2]" 1
1637 1 79 ILE H 1 79 ILE QG . . 2.960 1.888 1.845 2.160 . 0 0 "[ . 1 . 2]" 1
1638 1 79 ILE H 1 79 ILE HG13 . . 3.480 2.613 2.249 3.470 . 0 0 "[ . 1 . 2]" 1
1639 1 79 ILE H 1 79 ILE MG . . 3.260 2.711 2.427 3.129 . 0 0 "[ . 1 . 2]" 1
1640 1 79 ILE H 1 80 GLY H . . 3.130 2.404 2.037 2.591 . 0 0 "[ . 1 . 2]" 1
1641 1 79 ILE H 1 80 GLY QA . . 5.290 4.394 4.139 4.516 . 0 0 "[ . 1 . 2]" 1
1642 1 79 ILE H 1 81 ILE H . . 4.040 3.718 3.146 3.959 . 0 0 "[ . 1 . 2]" 1
1643 1 79 ILE HA 1 79 ILE MG . . 3.200 2.201 2.046 2.309 . 0 0 "[ . 1 . 2]" 1
1644 1 79 ILE HB 1 79 ILE MD . . 3.350 2.368 2.219 3.178 . 0 0 "[ . 1 . 2]" 1
1645 1 79 ILE HB 1 80 GLY H . . 4.670 3.657 3.548 3.836 . 0 0 "[ . 1 . 2]" 1
1646 1 79 ILE MD 1 80 GLY H . . 4.180 3.756 3.197 4.116 . 0 0 "[ . 1 . 2]" 1
1647 1 79 ILE MD 1 80 GLY QA . . 4.770 4.549 4.413 4.792 0.022 5 0 "[ . 1 . 2]" 1
1648 1 79 ILE MD 1 81 ILE H . . 4.490 3.951 3.274 4.200 . 0 0 "[ . 1 . 2]" 1
1649 1 79 ILE MD 1 81 ILE MD . . 3.300 1.945 1.789 2.560 . 0 0 "[ . 1 . 2]" 1
1650 1 79 ILE MD 1 81 ILE QG . . 4.570 2.180 1.982 2.829 . 0 0 "[ . 1 . 2]" 1
1651 1 79 ILE MD 1 111 HIS HD2 . . 4.040 3.074 2.509 4.036 . 0 0 "[ . 1 . 2]" 1
1652 1 79 ILE MD 1 112 PHE QE . . 3.590 3.310 2.267 3.589 . 0 0 "[ . 1 . 2]" 1
1653 1 79 ILE MD 1 112 PHE HZ . . 3.650 3.338 2.919 3.652 0.002 8 0 "[ . 1 . 2]" 1
1654 1 79 ILE QG 1 79 ILE MG . . 3.320 2.242 2.090 2.458 . 0 0 "[ . 1 . 2]" 1
1655 1 79 ILE QG 1 80 GLY H . . 3.750 2.047 1.869 2.414 . 0 0 "[ . 1 . 2]" 1
1656 1 79 ILE QG 1 80 GLY QA . . 5.110 3.575 3.415 3.756 . 0 0 "[ . 1 . 2]" 1
1657 1 79 ILE QG 1 81 ILE H . . 4.310 2.662 2.006 3.003 . 0 0 "[ . 1 . 2]" 1
1658 1 79 ILE QG 1 81 ILE MD . . 4.020 2.842 2.481 3.237 . 0 0 "[ . 1 . 2]" 1
1659 1 79 ILE HG12 1 80 GLY H . . 4.470 3.062 1.897 3.408 . 0 0 "[ . 1 . 2]" 1
1660 1 79 ILE HG13 1 80 GLY H . . 4.470 2.161 1.899 3.595 . 0 0 "[ . 1 . 2]" 1
1661 1 79 ILE MG 1 80 GLY H . . 4.450 4.103 3.985 4.241 . 0 0 "[ . 1 . 2]" 1
1662 1 80 GLY H 1 81 ILE H . . 3.150 1.848 1.795 2.017 . 0 0 "[ . 1 . 2]" 1
1663 1 80 GLY H 1 81 ILE HB . . 5.250 3.936 3.821 4.049 . 0 0 "[ . 1 . 2]" 1
1664 1 80 GLY H 1 81 ILE MD . . 4.860 4.481 4.209 4.822 . 0 0 "[ . 1 . 2]" 1
1665 1 80 GLY H 1 81 ILE QG . . 4.650 3.253 2.882 3.932 . 0 0 "[ . 1 . 2]" 1
1666 1 81 ILE H 1 81 ILE HB . . 3.260 2.541 2.465 2.620 . 0 0 "[ . 1 . 2]" 1
1667 1 81 ILE H 1 81 ILE MD . . 4.080 3.867 3.426 4.079 . 0 0 "[ . 1 . 2]" 1
1668 1 81 ILE H 1 81 ILE HG12 . . 3.910 3.694 3.290 3.910 . 1 0 "[ . 1 . 2]" 1
1669 1 81 ILE H 1 81 ILE QG . . 3.420 2.511 2.070 2.754 . 0 0 "[ . 1 . 2]" 1
1670 1 81 ILE H 1 81 ILE HG13 . . 3.910 2.558 2.086 2.823 . 0 0 "[ . 1 . 2]" 1
1671 1 81 ILE H 1 81 ILE MG . . 3.890 3.800 3.753 3.841 . 0 0 "[ . 1 . 2]" 1
1672 1 81 ILE H 1 82 SER H . . 4.480 4.095 3.910 4.268 . 0 0 "[ . 1 . 2]" 1
1673 1 81 ILE HA 1 81 ILE MD . . 4.020 3.802 3.737 3.856 . 0 0 "[ . 1 . 2]" 1
1674 1 81 ILE HA 1 81 ILE HG12 . . 4.000 2.500 2.387 2.596 . 0 0 "[ . 1 . 2]" 1
1675 1 81 ILE HA 1 81 ILE HG13 . . 4.000 3.040 2.808 3.241 . 0 0 "[ . 1 . 2]" 1
1676 1 81 ILE HA 1 81 ILE MG . . 3.340 2.391 2.312 2.456 . 0 0 "[ . 1 . 2]" 1
1677 1 81 ILE HA 1 82 SER H . . 2.780 2.214 2.173 2.273 . 0 0 "[ . 1 . 2]" 1
1678 1 81 ILE HB 1 81 ILE MD . . 3.510 2.444 2.297 2.572 . 0 0 "[ . 1 . 2]" 1
1679 1 81 ILE HB 1 82 SER H . . 4.550 4.450 4.395 4.508 . 0 0 "[ . 1 . 2]" 1
1680 1 81 ILE MD 1 81 ILE MG . . 3.100 1.964 1.884 2.108 . 0 0 "[ . 1 . 2]" 1
1681 1 81 ILE MD 1 82 SER H . . 5.500 5.457 5.326 5.534 0.034 20 0 "[ . 1 . 2]" 1
1682 1 81 ILE MD 1 107 GLN HB2 . . 4.890 4.501 4.219 4.828 . 0 0 "[ . 1 . 2]" 1
1683 1 81 ILE MD 1 108 ILE H . . 4.580 4.093 3.830 4.304 . 0 0 "[ . 1 . 2]" 1
1684 1 81 ILE MD 1 108 ILE HA . . 3.340 2.202 1.971 2.409 . 0 0 "[ . 1 . 2]" 1
1685 1 81 ILE MD 1 108 ILE HB . . 4.570 4.282 4.116 4.458 . 0 0 "[ . 1 . 2]" 1
1686 1 81 ILE MD 1 108 ILE MD . . 4.040 3.382 3.184 3.615 . 0 0 "[ . 1 . 2]" 1
1687 1 81 ILE MD 1 108 ILE HG12 . . 3.880 3.182 2.844 3.467 . 0 0 "[ . 1 . 2]" 1
1688 1 81 ILE MD 1 108 ILE HG13 . . 4.520 2.055 1.935 2.385 . 0 0 "[ . 1 . 2]" 1
1689 1 81 ILE MD 1 108 ILE MG . . 3.860 2.850 2.661 3.063 . 0 0 "[ . 1 . 2]" 1
1690 1 81 ILE MD 1 111 HIS H . . 4.460 4.375 4.130 4.453 . 0 0 "[ . 1 . 2]" 1
1691 1 81 ILE MD 1 111 HIS HA . . 5.310 5.068 4.725 5.308 . 0 0 "[ . 1 . 2]" 1
1692 1 81 ILE MD 1 111 HIS QB . . 3.450 2.587 2.345 2.748 . 0 0 "[ . 1 . 2]" 1
1693 1 81 ILE MD 1 111 HIS HD2 . . 4.160 3.715 2.113 4.155 . 0 0 "[ . 1 . 2]" 1
1694 1 81 ILE MD 1 112 PHE H . . 4.730 4.571 4.219 4.730 . 0 0 "[ . 1 . 2]" 1
1695 1 81 ILE MD 1 112 PHE QD . . 4.730 4.076 3.109 4.675 . 0 0 "[ . 1 . 2]" 1
1696 1 81 ILE MD 1 112 PHE QE . . 4.020 3.280 2.202 3.949 . 0 0 "[ . 1 . 2]" 1
1697 1 81 ILE MD 1 112 PHE HZ . . 5.170 4.301 3.866 4.887 . 0 0 "[ . 1 . 2]" 1
1698 1 81 ILE QG 1 82 SER H . . 5.090 4.333 4.228 4.416 . 0 0 "[ . 1 . 2]" 1
1699 1 81 ILE QG 1 111 HIS QB . . 4.350 2.994 2.612 3.447 . 0 0 "[ . 1 . 2]" 1
1700 1 81 ILE MG 1 82 SER H . . 3.460 3.221 3.024 3.427 . 0 0 "[ . 1 . 2]" 1
1701 1 81 ILE MG 1 83 ARG HA . . 4.370 3.970 3.556 4.343 . 0 0 "[ . 1 . 2]" 1
1702 1 81 ILE MG 1 84 LEU H . . 5.020 4.807 4.237 5.035 0.015 16 0 "[ . 1 . 2]" 1
1703 1 81 ILE MG 1 104 TYR QD . . 3.970 3.749 3.547 3.894 . 0 0 "[ . 1 . 2]" 1
1704 1 81 ILE MG 1 104 TYR QE . . 3.440 2.284 2.008 2.498 . 0 0 "[ . 1 . 2]" 1
1705 1 81 ILE MG 1 107 GLN HB2 . . 3.980 3.024 2.780 3.372 . 0 0 "[ . 1 . 2]" 1
1706 1 81 ILE MG 1 107 GLN HB3 . . 3.810 2.915 2.547 3.428 . 0 0 "[ . 1 . 2]" 1
1707 1 81 ILE MG 1 107 GLN HG3 . . 4.420 4.051 3.789 4.420 . 0 0 "[ . 1 . 2]" 1
1708 1 81 ILE MG 1 108 ILE H . . 4.300 3.681 3.411 3.996 . 0 0 "[ . 1 . 2]" 1
1709 1 81 ILE MG 1 108 ILE HA . . 4.190 3.275 2.894 3.767 . 0 0 "[ . 1 . 2]" 1
1710 1 81 ILE MG 1 108 ILE HB . . 5.070 4.699 4.472 4.950 . 0 0 "[ . 1 . 2]" 1
1711 1 81 ILE MG 1 108 ILE MD . . 3.540 2.599 2.333 2.822 . 0 0 "[ . 1 . 2]" 1
1712 1 81 ILE MG 1 108 ILE HG12 . . 4.450 3.582 3.228 3.874 . 0 0 "[ . 1 . 2]" 1
1713 1 81 ILE MG 1 108 ILE HG13 . . 3.730 2.309 1.983 2.623 . 0 0 "[ . 1 . 2]" 1
1714 1 81 ILE MG 1 111 HIS QB . . 4.700 4.096 3.830 4.465 . 0 0 "[ . 1 . 2]" 1
1715 1 82 SER H 1 82 SER HB2 . . 3.660 2.624 2.252 3.601 . 0 0 "[ . 1 . 2]" 1
1716 1 82 SER H 1 82 SER QB . . 3.020 2.401 2.227 2.664 . 0 0 "[ . 1 . 2]" 1
1717 1 82 SER H 1 82 SER HB3 . . 3.660 3.363 2.410 3.617 . 0 0 "[ . 1 . 2]" 1
1718 1 82 SER HA 1 83 ARG H . . 2.760 2.215 2.139 2.562 . 0 0 "[ . 1 . 2]" 1
1719 1 82 SER QB 1 83 ARG H . . 3.530 3.092 2.077 3.547 0.017 6 0 "[ . 1 . 2]" 1
1720 1 82 SER QB 1 84 LEU QD . . 3.960 2.864 2.321 3.705 . 0 0 "[ . 1 . 2]" 1
1721 1 83 ARG H 1 83 ARG HB2 . . 3.680 3.163 2.284 3.652 . 0 0 "[ . 1 . 2]" 1
1722 1 83 ARG H 1 83 ARG QB . . 3.030 2.579 2.258 2.978 . 0 0 "[ . 1 . 2]" 1
1723 1 83 ARG H 1 83 ARG HB3 . . 3.680 3.099 2.312 3.663 . 0 0 "[ . 1 . 2]" 1
1724 1 83 ARG H 1 83 ARG HD2 . . 4.570 3.815 1.924 4.501 . 0 0 "[ . 1 . 2]" 1
1725 1 83 ARG H 1 83 ARG QD . . 3.930 3.093 1.870 3.955 0.025 10 0 "[ . 1 . 2]" 1
1726 1 83 ARG H 1 83 ARG HD3 . . 4.570 3.514 1.878 4.570 . 0 0 "[ . 1 . 2]" 1
1727 1 83 ARG H 1 83 ARG HG2 . . 4.490 2.948 1.903 4.399 . 0 0 "[ . 1 . 2]" 1
1728 1 83 ARG H 1 83 ARG QG . . 3.820 2.291 1.887 3.631 . 0 0 "[ . 1 . 2]" 1
1729 1 83 ARG H 1 83 ARG HG3 . . 4.490 3.000 1.902 4.058 . 0 0 "[ . 1 . 2]" 1
1730 1 83 ARG H 1 84 LEU H . . 4.500 4.371 3.703 4.643 0.143 6 0 "[ . 1 . 2]" 1
1731 1 83 ARG HA 1 84 LEU H . . 3.170 2.181 2.141 2.376 . 0 0 "[ . 1 . 2]" 1
1732 1 83 ARG HA 1 84 LEU HB2 . . 4.660 4.564 4.256 4.671 0.011 15 0 "[ . 1 . 2]" 1
1733 1 83 ARG HA 1 85 LEU H . . 4.260 4.003 3.669 4.263 0.003 8 0 "[ . 1 . 2]" 1
1734 1 83 ARG HA 1 104 TYR QE . . 3.620 2.661 1.997 3.510 . 0 0 "[ . 1 . 2]" 1
1735 1 83 ARG QB 1 83 ARG QD . . 3.180 2.195 2.023 2.414 . 0 0 "[ . 1 . 2]" 1
1736 1 83 ARG QB 1 84 LEU H . . 3.950 3.354 2.734 3.880 . 0 0 "[ . 1 . 2]" 1
1737 1 83 ARG QB 1 85 LEU H . . 4.400 4.185 3.791 4.394 . 0 0 "[ . 1 . 2]" 1
1738 1 84 LEU H 1 84 LEU HB2 . . 3.800 2.487 2.230 2.776 . 0 0 "[ . 1 . 2]" 1
1739 1 84 LEU H 1 84 LEU HB3 . . 3.980 3.651 3.521 3.840 . 0 0 "[ . 1 . 2]" 1
1740 1 84 LEU H 1 84 LEU MD1 . . 4.480 3.232 1.894 4.098 . 0 0 "[ . 1 . 2]" 1
1741 1 84 LEU H 1 84 LEU QD . . 3.750 2.806 1.891 3.491 . 0 0 "[ . 1 . 2]" 1
1742 1 84 LEU H 1 84 LEU MD2 . . 4.480 3.706 2.080 4.487 0.007 8 0 "[ . 1 . 2]" 1
1743 1 84 LEU H 1 84 LEU HG . . 4.120 3.063 2.278 4.045 . 0 0 "[ . 1 . 2]" 1
1744 1 84 LEU H 1 85 LEU H . . 3.250 2.321 2.040 2.855 . 0 0 "[ . 1 . 2]" 1
1745 1 84 LEU H 1 104 TYR QE . . 4.230 3.100 2.700 3.422 . 0 0 "[ . 1 . 2]" 1
1746 1 84 LEU HA 1 84 LEU QD . . 2.990 2.354 1.897 2.963 . 0 0 "[ . 1 . 2]" 1
1747 1 84 LEU HA 1 84 LEU HG . . 4.000 2.934 2.273 3.689 . 0 0 "[ . 1 . 2]" 1
1748 1 84 LEU HB2 1 85 LEU H . . 3.990 2.468 2.271 2.748 . 0 0 "[ . 1 . 2]" 1
1749 1 84 LEU HB2 1 104 TYR HB2 . . 4.420 2.362 2.116 2.602 . 0 0 "[ . 1 . 2]" 1
1750 1 84 LEU HB2 1 104 TYR QD . . 3.910 2.820 2.101 3.136 . 0 0 "[ . 1 . 2]" 1
1751 1 84 LEU HB2 1 104 TYR QE . . 5.380 4.370 3.649 4.681 . 0 0 "[ . 1 . 2]" 1
1752 1 84 LEU HB3 1 84 LEU MD1 . . 3.280 2.661 2.164 3.190 . 0 0 "[ . 1 . 2]" 1
1753 1 84 LEU HB3 1 84 LEU MD2 . . 3.280 2.305 2.018 3.145 . 0 0 "[ . 1 . 2]" 1
1754 1 84 LEU HB3 1 85 LEU H . . 4.100 3.480 3.069 3.846 . 0 0 "[ . 1 . 2]" 1
1755 1 84 LEU HB3 1 104 TYR HB2 . . 4.630 3.592 2.411 4.121 . 0 0 "[ . 1 . 2]" 1
1756 1 84 LEU QD 1 85 LEU H . . 4.510 3.814 3.523 4.076 . 0 0 "[ . 1 . 2]" 1
1757 1 84 LEU QD 1 103 THR H . . 5.390 5.102 4.912 5.227 . 0 0 "[ . 1 . 2]" 1
1758 1 84 LEU QD 1 103 THR HA . . 4.700 4.610 4.377 4.700 . 0 0 "[ . 1 . 2]" 1
1759 1 84 LEU QD 1 103 THR MG . . 3.380 2.267 1.908 2.654 . 0 0 "[ . 1 . 2]" 1
1760 1 84 LEU QD 1 104 TYR H . . 3.680 3.346 2.878 3.619 . 0 0 "[ . 1 . 2]" 1
1761 1 84 LEU QD 1 104 TYR HA . . 3.130 2.193 1.926 3.126 . 0 0 "[ . 1 . 2]" 1
1762 1 84 LEU QD 1 104 TYR HB2 . . 3.490 2.784 2.294 3.458 . 0 0 "[ . 1 . 2]" 1
1763 1 84 LEU QD 1 104 TYR HB3 . . 4.670 4.002 3.668 4.630 . 0 0 "[ . 1 . 2]" 1
1764 1 84 LEU QD 1 104 TYR QD . . 3.220 2.207 1.870 2.795 . 0 0 "[ . 1 . 2]" 1
1765 1 84 LEU QD 1 104 TYR QE . . 4.770 3.521 2.746 4.102 . 0 0 "[ . 1 . 2]" 1
1766 1 84 LEU QD 1 107 GLN HG2 . . 4.360 3.357 2.931 3.913 . 0 0 "[ . 1 . 2]" 1
1767 1 84 LEU QD 1 107 GLN HG3 . . 4.610 2.390 2.084 2.930 . 0 0 "[ . 1 . 2]" 1
1768 1 84 LEU MD1 1 104 TYR HB2 . . 4.920 3.005 2.299 3.888 . 0 0 "[ . 1 . 2]" 1
1769 1 84 LEU MD1 1 104 TYR QD . . 4.000 2.281 1.887 3.972 . 0 0 "[ . 1 . 2]" 1
1770 1 84 LEU MD1 1 104 TYR QE . . 5.500 3.782 2.759 5.492 . 0 0 "[ . 1 . 2]" 1
1771 1 84 LEU MD2 1 104 TYR HB2 . . 4.920 4.257 2.948 4.918 . 0 0 "[ . 1 . 2]" 1
1772 1 84 LEU MD2 1 104 TYR QD . . 4.000 3.681 2.855 4.002 0.002 5 0 "[ . 1 . 2]" 1
1773 1 84 LEU MD2 1 104 TYR QE . . 5.500 4.771 3.482 5.452 . 0 0 "[ . 1 . 2]" 1
1774 1 84 LEU HG 1 85 LEU H . . 5.010 4.437 4.041 5.017 0.007 20 0 "[ . 1 . 2]" 1
1775 1 84 LEU HG 1 104 TYR QD . . 4.530 3.139 2.346 4.531 0.001 13 0 "[ . 1 . 2]" 1
1776 1 85 LEU H 1 85 LEU HB2 . . 3.590 2.518 2.308 2.710 . 0 0 "[ . 1 . 2]" 1
1777 1 85 LEU H 1 85 LEU HB3 . . 3.620 2.685 2.598 2.818 . 0 0 "[ . 1 . 2]" 1
1778 1 85 LEU H 1 85 LEU MD1 . . 4.160 3.964 3.731 4.128 . 0 0 "[ . 1 . 2]" 1
1779 1 85 LEU H 1 85 LEU HG . . 4.700 4.567 4.530 4.631 . 0 0 "[ . 1 . 2]" 1
1780 1 85 LEU H 1 86 GLU H . . 4.760 4.580 4.507 4.622 . 0 0 "[ . 1 . 2]" 1
1781 1 85 LEU H 1 100 THR MG . . 4.630 4.442 4.095 4.633 0.003 13 0 "[ . 1 . 2]" 1
1782 1 85 LEU H 1 104 TYR QE . . 4.640 4.286 4.146 4.469 . 0 0 "[ . 1 . 2]" 1
1783 1 85 LEU HA 1 85 LEU MD1 . . 3.110 2.025 1.949 2.181 . 0 0 "[ . 1 . 2]" 1
1784 1 85 LEU HA 1 85 LEU MD2 . . 3.980 3.848 3.774 3.884 . 0 0 "[ . 1 . 2]" 1
1785 1 85 LEU HA 1 85 LEU HG . . 4.120 2.913 2.784 3.012 . 0 0 "[ . 1 . 2]" 1
1786 1 85 LEU HA 1 86 GLU H . . 3.040 2.293 2.208 2.370 . 0 0 "[ . 1 . 2]" 1
1787 1 85 LEU HA 1 86 GLU QB . . 5.340 4.397 4.252 4.468 . 0 0 "[ . 1 . 2]" 1
1788 1 85 LEU HA 1 86 GLU QG . . 4.680 3.699 3.471 4.453 . 0 0 "[ . 1 . 2]" 1
1789 1 85 LEU HB2 1 85 LEU MD1 . . 3.620 2.323 2.242 2.386 . 0 0 "[ . 1 . 2]" 1
1790 1 85 LEU HB2 1 85 LEU MD2 . . 3.430 2.368 2.194 2.511 . 0 0 "[ . 1 . 2]" 1
1791 1 85 LEU HB2 1 86 GLU H . . 4.200 4.074 3.966 4.210 0.010 16 0 "[ . 1 . 2]" 1
1792 1 85 LEU HB2 1 90 MET ME . . 4.990 4.853 4.560 5.003 0.013 16 0 "[ . 1 . 2]" 1
1793 1 85 LEU HB2 1 101 VAL H . . 5.380 5.234 4.929 5.386 0.006 15 0 "[ . 1 . 2]" 1
1794 1 85 LEU HB2 1 104 TYR QD . . 4.120 3.791 3.455 4.071 . 0 0 "[ . 1 . 2]" 1
1795 1 85 LEU HB3 1 86 GLU H . . 4.380 3.618 3.297 3.848 . 0 0 "[ . 1 . 2]" 1
1796 1 85 LEU MD1 1 86 GLU H . . 3.990 2.668 2.267 3.074 . 0 0 "[ . 1 . 2]" 1
1797 1 85 LEU MD1 1 90 MET ME . . 3.990 3.855 3.554 3.991 0.001 8 0 "[ . 1 . 2]" 1
1798 1 85 LEU MD1 1 90 MET HG2 . . 4.330 4.036 3.567 4.312 . 0 0 "[ . 1 . 2]" 1
1799 1 85 LEU MD1 1 97 ASP HB2 . . 4.750 4.281 3.462 4.676 . 0 0 "[ . 1 . 2]" 1
1800 1 85 LEU MD1 1 100 THR H . . 5.500 5.253 5.019 5.422 . 0 0 "[ . 1 . 2]" 1
1801 1 85 LEU MD1 1 100 THR HB . . 3.920 3.073 2.782 3.485 . 0 0 "[ . 1 . 2]" 1
1802 1 85 LEU MD1 1 100 THR MG . . 2.960 1.959 1.807 2.228 . 0 0 "[ . 1 . 2]" 1
1803 1 85 LEU MD1 1 101 VAL H . . 4.160 3.573 3.098 4.006 . 0 0 "[ . 1 . 2]" 1
1804 1 85 LEU MD1 1 101 VAL HA . . 3.920 3.433 2.942 3.787 . 0 0 "[ . 1 . 2]" 1
1805 1 85 LEU MD1 1 101 VAL MG1 . . 4.620 4.348 3.984 4.619 . 0 0 "[ . 1 . 2]" 1
1806 1 85 LEU MD2 1 90 MET ME . . 3.180 1.872 1.774 1.983 . 0 0 "[ . 1 . 2]" 1
1807 1 85 LEU MD2 1 101 VAL H . . 4.670 4.069 3.634 4.388 . 0 0 "[ . 1 . 2]" 1
1808 1 85 LEU MD2 1 101 VAL HA . . 3.640 2.774 2.600 2.987 . 0 0 "[ . 1 . 2]" 1
1809 1 85 LEU MD2 1 101 VAL MG2 . . 3.360 2.033 1.827 2.353 . 0 0 "[ . 1 . 2]" 1
1810 1 85 LEU MD2 1 104 TYR H . . 5.500 5.464 5.372 5.501 0.001 16 0 "[ . 1 . 2]" 1
1811 1 85 LEU MD2 1 104 TYR HB2 . . 4.580 4.517 4.352 4.583 0.003 17 0 "[ . 1 . 2]" 1
1812 1 85 LEU MD2 1 104 TYR QD . . 3.800 3.714 3.175 3.799 . 0 0 "[ . 1 . 2]" 1
1813 1 85 LEU MD2 1 104 TYR QE . . 5.180 4.866 4.071 5.030 . 0 0 "[ . 1 . 2]" 1
1814 1 85 LEU HG 1 86 GLU H . . 3.940 2.265 2.051 2.570 . 0 0 "[ . 1 . 2]" 1
1815 1 85 LEU HG 1 90 MET ME . . 4.200 3.572 3.395 3.782 . 0 0 "[ . 1 . 2]" 1
1816 1 85 LEU HG 1 100 THR MG . . 4.640 4.416 4.244 4.641 0.001 12 0 "[ . 1 . 2]" 1
1817 1 86 GLU H 1 86 GLU HB2 . . 3.730 2.535 2.397 2.600 . 0 0 "[ . 1 . 2]" 1
1818 1 86 GLU H 1 86 GLU QB . . 3.250 2.493 2.365 2.554 . 0 0 "[ . 1 . 2]" 1
1819 1 86 GLU H 1 86 GLU HB3 . . 3.730 3.700 3.630 3.740 0.010 19 0 "[ . 1 . 2]" 1
1820 1 86 GLU H 1 86 GLU QG . . 3.740 2.829 2.484 3.530 . 0 0 "[ . 1 . 2]" 1
1821 1 86 GLU H 1 87 PRO QD . . 4.940 4.362 4.339 4.374 . 0 0 "[ . 1 . 2]" 1
1822 1 86 GLU H 1 89 ASP H . . 5.390 4.834 4.560 5.075 . 0 0 "[ . 1 . 2]" 1
1823 1 86 GLU H 1 89 ASP QB . . 4.450 3.237 2.816 3.847 . 0 0 "[ . 1 . 2]" 1
1824 1 86 GLU H 1 90 MET HG2 . . 5.250 4.463 4.095 4.714 . 0 0 "[ . 1 . 2]" 1
1825 1 86 GLU HA 1 87 PRO HD2 . . 3.920 2.305 2.238 2.365 . 0 0 "[ . 1 . 2]" 1
1826 1 86 GLU HA 1 87 PRO HD3 . . 3.920 2.269 2.254 2.285 . 0 0 "[ . 1 . 2]" 1
1827 1 86 GLU HA 1 87 PRO QG . . 4.480 3.943 3.905 3.979 . 0 0 "[ . 1 . 2]" 1
1828 1 86 GLU HA 1 88 SER H . . 4.720 4.404 4.184 4.526 . 0 0 "[ . 1 . 2]" 1
1829 1 86 GLU QB 1 87 PRO QD . . 4.150 2.177 2.051 2.390 . 0 0 "[ . 1 . 2]" 1
1830 1 86 GLU QB 1 88 SER H . . 3.690 3.091 2.869 3.213 . 0 0 "[ . 1 . 2]" 1
1831 1 86 GLU QB 1 89 ASP H . . 3.880 2.589 2.460 2.765 . 0 0 "[ . 1 . 2]" 1
1832 1 86 GLU HB2 1 88 SER H . . 4.440 4.246 4.038 4.435 . 0 0 "[ . 1 . 2]" 1
1833 1 86 GLU HB2 1 89 ASP H . . 4.430 2.866 2.663 3.152 . 0 0 "[ . 1 . 2]" 1
1834 1 86 GLU HB3 1 88 SER H . . 4.440 3.178 2.917 3.316 . 0 0 "[ . 1 . 2]" 1
1835 1 86 GLU HB3 1 89 ASP H . . 4.430 2.983 2.705 3.260 . 0 0 "[ . 1 . 2]" 1
1836 1 86 GLU QG 1 87 PRO HD2 . . 4.960 3.633 2.853 4.009 . 0 0 "[ . 1 . 2]" 1
1837 1 86 GLU QG 1 87 PRO QD . . 4.110 3.473 2.773 3.829 . 0 0 "[ . 1 . 2]" 1
1838 1 86 GLU QG 1 87 PRO HD3 . . 4.960 4.424 3.778 4.853 . 0 0 "[ . 1 . 2]" 1
1839 1 86 GLU QG 1 89 ASP H . . 4.620 4.451 4.305 4.619 . 0 0 "[ . 1 . 2]" 1
1840 1 87 PRO HA 1 90 MET HG2 . . 4.530 3.633 3.233 4.016 . 0 0 "[ . 1 . 2]" 1
1841 1 87 PRO HA 1 90 MET HG3 . . 4.720 3.203 2.927 3.537 . 0 0 "[ . 1 . 2]" 1
1842 1 87 PRO HB2 1 88 SER H . . 4.060 2.959 2.864 3.154 . 0 0 "[ . 1 . 2]" 1
1843 1 87 PRO HB3 1 88 SER H . . 4.130 3.924 3.869 4.035 . 0 0 "[ . 1 . 2]" 1
1844 1 87 PRO QD 1 88 SER H . . 4.210 2.678 2.617 2.715 . 0 0 "[ . 1 . 2]" 1
1845 1 87 PRO QG 1 88 SER H . . 3.780 1.965 1.884 2.147 . 0 0 "[ . 1 . 2]" 1
1846 1 88 SER H 1 88 SER HB2 . . 3.720 3.259 2.472 3.596 . 0 0 "[ . 1 . 2]" 1
1847 1 88 SER H 1 88 SER HB3 . . 3.720 2.667 2.332 3.595 . 0 0 "[ . 1 . 2]" 1
1848 1 88 SER H 1 89 ASP H . . 3.610 2.762 2.581 2.962 . 0 0 "[ . 1 . 2]" 1
1849 1 88 SER H 1 90 MET H . . 4.780 4.393 4.142 4.557 . 0 0 "[ . 1 . 2]" 1
1850 1 88 SER H 1 91 VAL MG2 . . 4.950 4.755 4.466 4.952 0.002 11 0 "[ . 1 . 2]" 1
1851 1 88 SER HA 1 90 MET H . . 4.670 4.329 4.066 4.542 . 0 0 "[ . 1 . 2]" 1
1852 1 88 SER HA 1 90 MET HB2 . . 4.900 4.733 4.529 4.886 . 0 0 "[ . 1 . 2]" 1
1853 1 88 SER HA 1 91 VAL H . . 3.910 3.382 3.230 3.584 . 0 0 "[ . 1 . 2]" 1
1854 1 88 SER HA 1 91 VAL HB . . 3.810 3.246 2.990 3.422 . 0 0 "[ . 1 . 2]" 1
1855 1 88 SER HA 1 91 VAL MG1 . . 4.660 4.518 4.251 4.659 . 0 0 "[ . 1 . 2]" 1
1856 1 88 SER HA 1 91 VAL MG2 . . 3.530 2.704 2.257 3.027 . 0 0 "[ . 1 . 2]" 1
1857 1 88 SER QB 1 91 VAL MG2 . . 4.650 4.205 3.825 4.435 . 0 0 "[ . 1 . 2]" 1
1858 1 88 SER QB 1 92 LEU MD1 . . 3.970 3.258 2.706 3.700 . 0 0 "[ . 1 . 2]" 1
1859 1 88 SER HB2 1 89 ASP H . . 4.790 3.451 2.480 3.894 . 0 0 "[ . 1 . 2]" 1
1860 1 88 SER HB2 1 92 LEU MD1 . . 4.730 3.585 2.741 4.660 . 0 0 "[ . 1 . 2]" 1
1861 1 88 SER HB3 1 89 ASP H . . 4.790 3.493 2.309 3.940 . 0 0 "[ . 1 . 2]" 1
1862 1 88 SER HB3 1 92 LEU MD1 . . 4.730 4.212 3.123 4.732 0.002 12 0 "[ . 1 . 2]" 1
1863 1 89 ASP H 1 89 ASP HB2 . . 3.810 2.512 2.201 3.487 . 0 0 "[ . 1 . 2]" 1
1864 1 89 ASP H 1 89 ASP QB . . 3.250 2.278 2.149 2.535 . 0 0 "[ . 1 . 2]" 1
1865 1 89 ASP H 1 89 ASP HB3 . . 3.810 3.238 2.175 3.619 . 0 0 "[ . 1 . 2]" 1
1866 1 89 ASP H 1 90 MET H . . 3.420 2.999 2.780 3.122 . 0 0 "[ . 1 . 2]" 1
1867 1 89 ASP HA 1 92 LEU H . . 4.040 3.337 2.996 3.580 . 0 0 "[ . 1 . 2]" 1
1868 1 89 ASP HA 1 92 LEU HB2 . . 4.590 2.633 2.364 2.943 . 0 0 "[ . 1 . 2]" 1
1869 1 89 ASP HA 1 92 LEU QB . . 3.900 2.603 2.344 2.900 . 0 0 "[ . 1 . 2]" 1
1870 1 89 ASP HA 1 92 LEU HB3 . . 4.590 4.097 3.848 4.376 . 0 0 "[ . 1 . 2]" 1
1871 1 89 ASP HA 1 92 LEU MD1 . . 3.810 2.067 1.892 2.298 . 0 0 "[ . 1 . 2]" 1
1872 1 89 ASP HA 1 92 LEU MD2 . . 4.320 4.131 3.921 4.317 . 0 0 "[ . 1 . 2]" 1
1873 1 89 ASP HA 1 92 LEU HG . . 4.180 2.726 2.348 3.067 . 0 0 "[ . 1 . 2]" 1
1874 1 89 ASP HA 1 93 LEU H . . 4.270 3.909 3.534 4.253 . 0 0 "[ . 1 . 2]" 1
1875 1 89 ASP HA 1 93 LEU HG . . 4.510 4.272 3.641 4.512 0.002 10 0 "[ . 1 . 2]" 1
1876 1 89 ASP QB 1 90 MET H . . 3.890 2.598 2.312 3.321 . 0 0 "[ . 1 . 2]" 1
1877 1 89 ASP QB 1 92 LEU MD1 . . 4.730 3.609 3.146 3.882 . 0 0 "[ . 1 . 2]" 1
1878 1 89 ASP QB 1 93 LEU QD . . 3.460 3.145 2.806 3.441 . 0 0 "[ . 1 . 2]" 1
1879 1 89 ASP HB2 1 90 MET H . . 4.740 2.997 2.486 3.946 . 0 0 "[ . 1 . 2]" 1
1880 1 89 ASP HB3 1 90 MET H . . 4.740 3.120 2.337 3.573 . 0 0 "[ . 1 . 2]" 1
1881 1 90 MET H 1 90 MET HB2 . . 3.600 2.583 2.515 2.672 . 0 0 "[ . 1 . 2]" 1
1882 1 90 MET H 1 90 MET HB3 . . 3.830 3.591 3.588 3.599 . 0 0 "[ . 1 . 2]" 1
1883 1 90 MET H 1 90 MET ME . . 4.840 4.706 4.599 4.843 0.003 16 0 "[ . 1 . 2]" 1
1884 1 90 MET H 1 90 MET HG2 . . 3.380 2.027 1.900 2.178 . 0 0 "[ . 1 . 2]" 1
1885 1 90 MET H 1 90 MET HG3 . . 3.830 3.326 3.227 3.419 . 0 0 "[ . 1 . 2]" 1
1886 1 90 MET H 1 91 VAL H . . 3.420 2.823 2.654 2.928 . 0 0 "[ . 1 . 2]" 1
1887 1 90 MET H 1 91 VAL MG2 . . 4.350 4.148 3.956 4.321 . 0 0 "[ . 1 . 2]" 1
1888 1 90 MET H 1 92 LEU H . . 4.410 4.347 4.254 4.405 . 0 0 "[ . 1 . 2]" 1
1889 1 90 MET H 1 92 LEU HG . . 5.460 5.032 4.786 5.345 . 0 0 "[ . 1 . 2]" 1
1890 1 90 MET HA 1 90 MET ME . . 4.540 4.356 4.158 4.455 . 0 0 "[ . 1 . 2]" 1
1891 1 90 MET HA 1 92 LEU H . . 4.960 4.781 4.538 4.952 . 0 0 "[ . 1 . 2]" 1
1892 1 90 MET HB2 1 90 MET ME . . 4.370 3.891 3.693 3.999 . 0 0 "[ . 1 . 2]" 1
1893 1 90 MET HB2 1 91 VAL H . . 4.700 2.651 2.454 3.120 . 0 0 "[ . 1 . 2]" 1
1894 1 90 MET HB3 1 91 VAL H . . 4.350 3.703 3.473 4.081 . 0 0 "[ . 1 . 2]" 1
1895 1 90 MET ME 1 90 MET HG2 . . 3.360 3.059 2.961 3.234 . 0 0 "[ . 1 . 2]" 1
1896 1 90 MET ME 1 90 MET HG3 . . 3.300 2.204 2.082 2.243 . 0 0 "[ . 1 . 2]" 1
1897 1 90 MET ME 1 96 PRO HB2 . . 4.330 4.121 3.790 4.329 . 0 0 "[ . 1 . 2]" 1
1898 1 90 MET ME 1 96 PRO HB3 . . 4.050 3.740 3.497 3.994 . 0 0 "[ . 1 . 2]" 1
1899 1 90 MET ME 1 96 PRO HD3 . . 5.000 4.752 4.433 4.979 . 0 0 "[ . 1 . 2]" 1
1900 1 90 MET ME 1 96 PRO QG . . 4.340 3.167 2.933 3.380 . 0 0 "[ . 1 . 2]" 1
1901 1 90 MET ME 1 101 VAL MG2 . . 3.170 2.794 2.249 3.154 . 0 0 "[ . 1 . 2]" 1
1902 1 90 MET HG2 1 91 VAL H . . 4.470 4.293 4.195 4.457 . 0 0 "[ . 1 . 2]" 1
1903 1 91 VAL H 1 91 VAL HB . . 3.200 2.596 2.500 2.726 . 0 0 "[ . 1 . 2]" 1
1904 1 91 VAL H 1 91 VAL MG1 . . 3.910 3.778 3.764 3.829 . 0 0 "[ . 1 . 2]" 1
1905 1 91 VAL H 1 91 VAL MG2 . . 3.120 2.124 1.911 2.467 . 0 0 "[ . 1 . 2]" 1
1906 1 91 VAL H 1 92 LEU H . . 3.240 2.559 2.205 2.681 . 0 0 "[ . 1 . 2]" 1
1907 1 91 VAL H 1 92 LEU HG . . 4.120 3.996 3.559 4.121 0.001 12 0 "[ . 1 . 2]" 1
1908 1 91 VAL H 1 93 LEU H . . 4.740 4.456 3.754 4.741 0.001 20 0 "[ . 1 . 2]" 1
1909 1 91 VAL HA 1 91 VAL MG1 . . 2.980 2.359 2.158 2.439 . 0 0 "[ . 1 . 2]" 1
1910 1 91 VAL HA 1 91 VAL MG2 . . 3.620 2.402 2.300 2.528 . 0 0 "[ . 1 . 2]" 1
1911 1 91 VAL HB 1 92 LEU H . . 3.310 2.470 2.362 2.611 . 0 0 "[ . 1 . 2]" 1
1912 1 91 VAL HB 1 92 LEU MD1 . . 5.060 4.951 4.764 5.080 0.020 15 0 "[ . 1 . 2]" 1
1913 1 91 VAL HB 1 92 LEU MD2 . . 4.300 3.699 3.266 4.143 . 0 0 "[ . 1 . 2]" 1
1914 1 91 VAL HB 1 93 LEU H . . 5.500 5.284 4.792 5.484 . 0 0 "[ . 1 . 2]" 1
1915 1 91 VAL MG1 1 92 LEU H . . 3.920 3.501 3.311 3.725 . 0 0 "[ . 1 . 2]" 1
1916 1 91 VAL MG1 1 92 LEU HA . . 3.960 3.673 3.424 3.934 . 0 0 "[ . 1 . 2]" 1
1917 1 91 VAL MG2 1 92 LEU H . . 3.990 3.676 3.553 3.766 . 0 0 "[ . 1 . 2]" 1
1918 1 92 LEU H 1 92 LEU HB2 . . 3.700 2.647 2.524 2.715 . 0 0 "[ . 1 . 2]" 1
1919 1 92 LEU H 1 92 LEU QB . . 2.990 2.581 2.476 2.638 . 0 0 "[ . 1 . 2]" 1
1920 1 92 LEU H 1 92 LEU HB3 . . 3.700 3.586 3.578 3.598 . 0 0 "[ . 1 . 2]" 1
1921 1 92 LEU H 1 92 LEU MD1 . . 3.760 3.518 3.340 3.621 . 0 0 "[ . 1 . 2]" 1
1922 1 92 LEU H 1 92 LEU MD2 . . 3.930 3.090 2.770 3.385 . 0 0 "[ . 1 . 2]" 1
1923 1 92 LEU H 1 92 LEU HG . . 3.150 2.009 1.933 2.180 . 0 0 "[ . 1 . 2]" 1
1924 1 92 LEU H 1 93 LEU H . . 3.290 3.036 2.742 3.212 . 0 0 "[ . 1 . 2]" 1
1925 1 92 LEU HA 1 92 LEU MD1 . . 4.120 3.905 3.871 3.937 . 0 0 "[ . 1 . 2]" 1
1926 1 92 LEU HA 1 92 LEU MD2 . . 2.980 2.181 1.997 2.402 . 0 0 "[ . 1 . 2]" 1
1927 1 92 LEU QB 1 92 LEU MD2 . . 3.070 2.236 2.117 2.328 . 0 0 "[ . 1 . 2]" 1
1928 1 92 LEU QB 1 93 LEU H . . 3.420 2.174 1.916 2.840 . 0 0 "[ . 1 . 2]" 1
1929 1 92 LEU HB2 1 92 LEU MD1 . . 3.270 2.212 2.058 2.369 . 0 0 "[ . 1 . 2]" 1
1930 1 92 LEU HB2 1 93 LEU H . . 4.120 2.204 1.932 2.909 . 0 0 "[ . 1 . 2]" 1
1931 1 92 LEU HB3 1 92 LEU MD1 . . 3.270 2.430 2.304 2.567 . 0 0 "[ . 1 . 2]" 1
1932 1 92 LEU HB3 1 93 LEU H . . 4.120 3.356 3.093 3.967 . 0 0 "[ . 1 . 2]" 1
1933 1 93 LEU H 1 93 LEU HB2 . . 3.690 3.567 2.343 3.697 0.007 6 0 "[ . 1 . 2]" 1
1934 1 93 LEU H 1 93 LEU HB3 . . 3.690 2.886 2.617 3.568 . 0 0 "[ . 1 . 2]" 1
1935 1 93 LEU H 1 93 LEU MD1 . . 3.960 3.227 2.301 3.579 . 0 0 "[ . 1 . 2]" 1
1936 1 93 LEU H 1 93 LEU QD . . 3.290 2.878 2.283 3.177 . 0 0 "[ . 1 . 2]" 1
1937 1 93 LEU H 1 93 LEU MD2 . . 3.960 3.386 3.113 3.846 . 0 0 "[ . 1 . 2]" 1
1938 1 93 LEU H 1 93 LEU HG . . 2.840 2.016 1.890 2.581 . 0 0 "[ . 1 . 2]" 1
1939 1 93 LEU H 1 94 ALA H . . 4.640 4.535 4.386 4.621 . 0 0 "[ . 1 . 2]" 1
1940 1 93 LEU HA 1 93 LEU QD . . 3.640 3.313 2.407 3.406 . 0 0 "[ . 1 . 2]" 1
1941 1 93 LEU HA 1 93 LEU HG . . 4.110 3.640 2.802 3.776 . 0 0 "[ . 1 . 2]" 1
1942 1 93 LEU HA 1 94 ALA H . . 3.260 2.490 2.254 2.653 . 0 0 "[ . 1 . 2]" 1
1943 1 93 LEU HA 1 94 ALA MB . . 4.100 4.040 3.956 4.112 0.012 10 0 "[ . 1 . 2]" 1
1944 1 93 LEU HA 1 95 ILE H . . 5.500 4.949 4.369 5.231 . 0 0 "[ . 1 . 2]" 1
1945 1 93 LEU QB 1 93 LEU QD . . 2.620 1.838 1.746 1.900 . 0 0 "[ . 1 . 2]" 1
1946 1 93 LEU QB 1 94 ALA H . . 3.770 2.233 1.905 2.766 . 0 0 "[ . 1 . 2]" 1
1947 1 93 LEU QB 1 95 ILE H . . 3.710 3.432 2.994 3.711 0.001 18 0 "[ . 1 . 2]" 1
1948 1 93 LEU HB2 1 94 ALA H . . 4.290 2.314 1.919 4.001 . 0 0 "[ . 1 . 2]" 1
1949 1 93 LEU HB3 1 94 ALA H . . 4.290 3.578 2.819 3.876 . 0 0 "[ . 1 . 2]" 1
1950 1 93 LEU QD 1 94 ALA H . . 4.040 2.788 2.474 3.195 . 0 0 "[ . 1 . 2]" 1
1951 1 93 LEU QD 1 94 ALA MB . . 4.360 3.663 3.412 4.195 . 0 0 "[ . 1 . 2]" 1
1952 1 93 LEU QD 1 95 ILE H . . 3.820 2.731 2.442 3.821 0.001 20 0 "[ . 1 . 2]" 1
1953 1 93 LEU QD 1 96 PRO HA . . 3.630 2.112 1.904 3.413 . 0 0 "[ . 1 . 2]" 1
1954 1 93 LEU QD 1 97 ASP H . . 4.290 3.701 3.231 4.013 . 0 0 "[ . 1 . 2]" 1
1955 1 94 ALA H 1 94 ALA MB . . 3.250 2.172 2.079 2.298 . 0 0 "[ . 1 . 2]" 1
1956 1 94 ALA H 1 95 ILE H . . 3.530 2.638 2.437 2.919 . 0 0 "[ . 1 . 2]" 1
1957 1 94 ALA MB 1 95 ILE H . . 3.250 2.230 1.882 2.480 . 0 0 "[ . 1 . 2]" 1
1958 1 94 ALA MB 1 95 ILE MD . . 3.530 3.188 2.565 3.473 . 0 0 "[ . 1 . 2]" 1
1959 1 95 ILE H 1 95 ILE HB . . 3.290 2.657 2.574 2.755 . 0 0 "[ . 1 . 2]" 1
1960 1 95 ILE H 1 95 ILE MD . . 4.120 3.613 3.062 3.897 . 0 0 "[ . 1 . 2]" 1
1961 1 95 ILE H 1 95 ILE HG12 . . 4.320 2.664 2.361 2.954 . 0 0 "[ . 1 . 2]" 1
1962 1 95 ILE H 1 95 ILE QG . . 3.730 2.626 2.341 2.902 . 0 0 "[ . 1 . 2]" 1
1963 1 95 ILE H 1 95 ILE HG13 . . 4.320 3.997 3.606 4.254 . 0 0 "[ . 1 . 2]" 1
1964 1 95 ILE H 1 95 ILE MG . . 3.890 3.854 3.822 3.898 0.008 20 0 "[ . 1 . 2]" 1
1965 1 95 ILE H 1 96 PRO HD2 . . 5.040 4.801 4.750 4.823 . 0 0 "[ . 1 . 2]" 1
1966 1 95 ILE H 1 96 PRO HD3 . . 4.700 4.661 4.508 4.737 0.037 10 0 "[ . 1 . 2]" 1
1967 1 95 ILE HA 1 95 ILE MD . . 3.810 2.104 2.003 2.412 . 0 0 "[ . 1 . 2]" 1
1968 1 95 ILE HA 1 95 ILE HG12 . . 4.080 3.076 2.904 3.336 . 0 0 "[ . 1 . 2]" 1
1969 1 95 ILE HA 1 95 ILE HG13 . . 4.080 3.748 3.623 3.861 . 0 0 "[ . 1 . 2]" 1
1970 1 95 ILE HA 1 95 ILE MG . . 3.240 2.356 2.244 2.448 . 0 0 "[ . 1 . 2]" 1
1971 1 95 ILE HA 1 96 PRO HD2 . . 3.600 2.042 2.008 2.099 . 0 0 "[ . 1 . 2]" 1
1972 1 95 ILE HA 1 96 PRO HD3 . . 3.480 2.280 2.260 2.297 . 0 0 "[ . 1 . 2]" 1
1973 1 95 ILE HA 1 96 PRO QG . . 4.160 3.806 3.791 3.832 . 0 0 "[ . 1 . 2]" 1
1974 1 95 ILE HB 1 95 ILE MD . . 3.270 3.214 3.182 3.231 . 0 0 "[ . 1 . 2]" 1
1975 1 95 ILE MD 1 96 PRO HD2 . . 4.600 2.896 2.529 3.244 . 0 0 "[ . 1 . 2]" 1
1976 1 95 ILE MG 1 96 PRO HA . . 4.460 4.179 4.004 4.347 . 0 0 "[ . 1 . 2]" 1
1977 1 95 ILE MG 1 96 PRO HD2 . . 3.790 2.048 1.935 2.271 . 0 0 "[ . 1 . 2]" 1
1978 1 95 ILE MG 1 96 PRO HD3 . . 3.880 3.413 3.283 3.573 . 0 0 "[ . 1 . 2]" 1
1979 1 95 ILE MG 1 96 PRO QG . . 4.610 3.188 2.991 3.317 . 0 0 "[ . 1 . 2]" 1
1980 1 96 PRO HA 1 97 ASP H . . 3.170 2.492 2.249 2.714 . 0 0 "[ . 1 . 2]" 1
1981 1 96 PRO HA 1 101 VAL MG2 . . 5.500 4.468 4.248 4.693 . 0 0 "[ . 1 . 2]" 1
1982 1 96 PRO HB2 1 97 ASP H . . 4.230 2.411 1.919 3.050 . 0 0 "[ . 1 . 2]" 1
1983 1 96 PRO HB2 1 101 VAL H . . 5.040 4.330 4.088 4.780 . 0 0 "[ . 1 . 2]" 1
1984 1 96 PRO HB3 1 97 ASP H . . 4.070 3.364 3.152 3.694 . 0 0 "[ . 1 . 2]" 1
1985 1 96 PRO HG2 1 101 VAL MG2 . . 4.640 2.995 2.827 3.255 . 0 0 "[ . 1 . 2]" 1
1986 1 96 PRO HG3 1 101 VAL MG2 . . 4.640 3.298 3.118 3.665 . 0 0 "[ . 1 . 2]" 1
1987 1 97 ASP H 1 97 ASP HB2 . . 3.460 2.299 2.200 2.423 . 0 0 "[ . 1 . 2]" 1
1988 1 97 ASP H 1 97 ASP HB3 . . 3.640 3.555 3.498 3.632 . 0 0 "[ . 1 . 2]" 1
1989 1 97 ASP H 1 98 LYS H . . 4.960 4.205 4.089 4.392 . 0 0 "[ . 1 . 2]" 1
1990 1 97 ASP H 1 100 THR HB . . 4.630 3.554 3.143 3.910 . 0 0 "[ . 1 . 2]" 1
1991 1 97 ASP H 1 101 VAL H . . 5.410 4.233 3.857 4.738 . 0 0 "[ . 1 . 2]" 1
1992 1 97 ASP H 1 101 VAL MG2 . . 4.440 3.372 3.043 3.884 . 0 0 "[ . 1 . 2]" 1
1993 1 97 ASP HA 1 98 LYS H . . 2.810 2.183 2.146 2.217 . 0 0 "[ . 1 . 2]" 1
1994 1 97 ASP HA 1 99 LEU H . . 4.130 3.924 3.668 4.122 . 0 0 "[ . 1 . 2]" 1
1995 1 97 ASP HB2 1 98 LYS H . . 5.070 4.546 4.437 4.588 . 0 0 "[ . 1 . 2]" 1
1996 1 97 ASP HB2 1 100 THR H . . 4.000 3.258 2.925 3.596 . 0 0 "[ . 1 . 2]" 1
1997 1 97 ASP HB2 1 100 THR HB . . 3.900 2.589 2.191 2.979 . 0 0 "[ . 1 . 2]" 1
1998 1 97 ASP HB2 1 100 THR MG . . 4.430 3.734 3.435 4.192 . 0 0 "[ . 1 . 2]" 1
1999 1 97 ASP HB2 1 101 VAL H . . 4.580 4.059 3.540 4.387 . 0 0 "[ . 1 . 2]" 1
2000 1 97 ASP HB3 1 98 LYS H . . 4.090 3.855 3.675 3.964 . 0 0 "[ . 1 . 2]" 1
2001 1 97 ASP HB3 1 100 THR H . . 4.330 2.466 2.230 2.763 . 0 0 "[ . 1 . 2]" 1
2002 1 97 ASP HB3 1 100 THR HB . . 4.230 3.355 2.667 3.677 . 0 0 "[ . 1 . 2]" 1
2003 1 97 ASP HB3 1 100 THR MG . . 4.890 4.537 3.967 4.862 . 0 0 "[ . 1 . 2]" 1
2004 1 97 ASP HB3 1 101 VAL H . . 4.890 4.391 3.883 4.755 . 0 0 "[ . 1 . 2]" 1
2005 1 98 LYS H 1 98 LYS QB . . 3.040 2.236 2.132 2.290 . 0 0 "[ . 1 . 2]" 1
2006 1 98 LYS H 1 98 LYS HG3 . . 4.840 4.386 3.992 4.653 . 0 0 "[ . 1 . 2]" 1
2007 1 98 LYS HA 1 98 LYS HG2 . . 3.950 2.819 2.569 2.935 . 0 0 "[ . 1 . 2]" 1
2008 1 98 LYS HA 1 98 LYS HG3 . . 3.780 2.856 2.409 3.677 . 0 0 "[ . 1 . 2]" 1
2009 1 98 LYS HA 1 101 VAL HB . . 3.790 2.904 2.567 3.094 . 0 0 "[ . 1 . 2]" 1
2010 1 98 LYS HA 1 101 VAL MG1 . . 4.480 4.176 3.849 4.353 . 0 0 "[ . 1 . 2]" 1
2011 1 98 LYS HA 1 101 VAL MG2 . . 4.040 3.258 2.865 3.722 . 0 0 "[ . 1 . 2]" 1
2012 1 98 LYS HA 1 102 MET H . . 4.100 3.654 3.436 3.905 . 0 0 "[ . 1 . 2]" 1
2013 1 98 LYS QB 1 99 LEU H . . 2.780 2.399 2.201 2.709 . 0 0 "[ . 1 . 2]" 1
2014 1 98 LYS QE 1 98 LYS HG3 . . 3.730 2.750 2.083 3.347 . 0 0 "[ . 1 . 2]" 1
2015 1 98 LYS QE 1 99 LEU H . . 5.070 4.578 3.539 5.049 . 0 0 "[ . 1 . 2]" 1
2016 1 98 LYS QE 1 99 LEU MD2 . . 4.240 3.543 2.946 4.242 0.002 15 0 "[ . 1 . 2]" 1
2017 1 98 LYS QE 1 102 MET ME . . 4.240 3.362 2.606 4.164 . 0 0 "[ . 1 . 2]" 1
2018 1 98 LYS HE2 1 98 LYS HG2 . . 3.710 2.653 2.101 3.685 . 0 0 "[ . 1 . 2]" 1
2019 1 98 LYS HE2 1 99 LEU MD2 . . 4.930 3.741 3.062 4.896 . 0 0 "[ . 1 . 2]" 1
2020 1 98 LYS HE3 1 98 LYS HG2 . . 3.710 2.904 2.095 3.651 . 0 0 "[ . 1 . 2]" 1
2021 1 98 LYS HE3 1 99 LEU MD2 . . 4.930 4.605 3.828 4.910 . 0 0 "[ . 1 . 2]" 1
2022 1 98 LYS HG2 1 99 LEU H . . 4.180 3.805 3.260 4.169 . 0 0 "[ . 1 . 2]" 1
2023 1 98 LYS HG2 1 101 VAL MG1 . . 5.500 5.343 4.821 5.499 . 0 0 "[ . 1 . 2]" 1
2024 1 98 LYS HG2 1 102 MET HB2 . . 4.060 3.825 3.344 4.051 . 0 0 "[ . 1 . 2]" 1
2025 1 98 LYS HG2 1 102 MET ME . . 4.350 4.252 3.887 4.351 0.001 20 0 "[ . 1 . 2]" 1
2026 1 98 LYS HG2 1 102 MET QG . . 4.540 2.447 2.091 2.863 . 0 0 "[ . 1 . 2]" 1
2027 1 99 LEU H 1 99 LEU QB . . 3.050 2.559 2.309 2.790 . 0 0 "[ . 1 . 2]" 1
2028 1 99 LEU H 1 99 LEU MD1 . . 3.980 3.490 3.258 3.990 0.010 10 0 "[ . 1 . 2]" 1
2029 1 99 LEU H 1 99 LEU MD2 . . 4.040 3.050 1.834 3.487 . 0 0 "[ . 1 . 2]" 1
2030 1 99 LEU H 1 99 LEU HG . . 3.480 2.112 1.905 3.499 0.019 10 0 "[ . 1 . 2]" 1
2031 1 99 LEU H 1 100 THR H . . 3.270 2.906 2.741 3.279 0.009 10 0 "[ . 1 . 2]" 1
2032 1 99 LEU HA 1 99 LEU MD2 . . 3.150 2.277 1.966 3.200 0.050 12 0 "[ . 1 . 2]" 1
2033 1 99 LEU HA 1 99 LEU HG . . 3.580 3.168 2.959 3.712 0.132 10 0 "[ . 1 . 2]" 1
2034 1 99 LEU HA 1 102 MET H . . 4.320 4.201 4.013 4.316 . 0 0 "[ . 1 . 2]" 1
2035 1 99 LEU HA 1 102 MET HB3 . . 4.810 4.492 4.329 4.761 . 0 0 "[ . 1 . 2]" 1
2036 1 99 LEU HA 1 103 THR H . . 4.500 4.204 3.812 4.374 . 0 0 "[ . 1 . 2]" 1
2037 1 99 LEU QB 1 99 LEU MD1 . . 2.920 2.053 1.934 2.143 . 0 0 "[ . 1 . 2]" 1
2038 1 99 LEU QB 1 100 THR H . . 3.220 2.343 2.047 2.719 . 0 0 "[ . 1 . 2]" 1
2039 1 99 LEU QB 1 100 THR HA . . 4.690 3.797 3.660 3.842 . 0 0 "[ . 1 . 2]" 1
2040 1 99 LEU QB 1 100 THR MG . . 5.060 4.960 4.791 5.101 0.041 12 0 "[ . 1 . 2]" 1
2041 1 99 LEU QB 1 101 VAL H . . 5.500 4.950 4.667 5.165 . 0 0 "[ . 1 . 2]" 1
2042 1 99 LEU MD1 1 100 THR H . . 4.470 4.118 3.026 4.340 . 0 0 "[ . 1 . 2]" 1
2043 1 99 LEU HG 1 100 THR H . . 4.330 4.043 1.973 4.366 0.036 10 0 "[ . 1 . 2]" 1
2044 1 100 THR H 1 100 THR HB . . 3.240 2.610 2.369 2.796 . 0 0 "[ . 1 . 2]" 1
2045 1 100 THR H 1 100 THR MG . . 3.770 3.760 3.727 3.767 . 0 0 "[ . 1 . 2]" 1
2046 1 100 THR H 1 101 VAL H . . 3.400 2.972 2.783 3.217 . 0 0 "[ . 1 . 2]" 1
2047 1 100 THR H 1 101 VAL HB . . 5.190 4.988 4.873 5.192 0.002 10 0 "[ . 1 . 2]" 1
2048 1 100 THR H 1 102 MET H . . 4.600 4.547 4.410 4.601 0.001 20 0 "[ . 1 . 2]" 1
2049 1 100 THR HA 1 100 THR MG . . 3.190 2.354 2.218 2.514 . 0 0 "[ . 1 . 2]" 1
2050 1 100 THR HA 1 103 THR H . . 4.150 3.705 3.318 4.085 . 0 0 "[ . 1 . 2]" 1
2051 1 100 THR HA 1 103 THR HB . . 3.710 2.990 2.581 3.266 . 0 0 "[ . 1 . 2]" 1
2052 1 100 THR HB 1 101 VAL H . . 3.280 2.118 1.905 2.376 . 0 0 "[ . 1 . 2]" 1
2053 1 100 THR HB 1 101 VAL HA . . 4.650 4.115 3.981 4.410 . 0 0 "[ . 1 . 2]" 1
2054 1 100 THR HB 1 101 VAL MG2 . . 4.330 3.099 2.931 3.332 . 0 0 "[ . 1 . 2]" 1
2055 1 100 THR MG 1 101 VAL H . . 4.120 3.084 2.440 3.315 . 0 0 "[ . 1 . 2]" 1
2056 1 100 THR MG 1 101 VAL HA . . 4.680 3.399 2.825 3.684 . 0 0 "[ . 1 . 2]" 1
2057 1 100 THR MG 1 104 TYR H . . 4.640 4.065 3.777 4.415 . 0 0 "[ . 1 . 2]" 1
2058 1 100 THR MG 1 104 TYR HB2 . . 4.500 3.899 3.635 4.187 . 0 0 "[ . 1 . 2]" 1
2059 1 101 VAL H 1 101 VAL HB . . 3.160 2.634 2.513 2.727 . 0 0 "[ . 1 . 2]" 1
2060 1 101 VAL H 1 101 VAL MG1 . . 3.780 3.773 3.760 3.784 0.004 10 0 "[ . 1 . 2]" 1
2061 1 101 VAL H 1 101 VAL MG2 . . 3.050 2.052 1.899 2.296 . 0 0 "[ . 1 . 2]" 1
2062 1 101 VAL H 1 102 MET H . . 3.390 3.103 2.910 3.177 . 0 0 "[ . 1 . 2]" 1
2063 1 101 VAL H 1 102 MET QG . . 5.340 5.072 4.679 5.341 0.001 6 0 "[ . 1 . 2]" 1
2064 1 101 VAL HA 1 101 VAL MG1 . . 3.330 2.447 2.396 2.474 . 0 0 "[ . 1 . 2]" 1
2065 1 101 VAL HA 1 101 VAL MG2 . . 3.180 2.358 2.251 2.425 . 0 0 "[ . 1 . 2]" 1
2066 1 101 VAL HA 1 104 TYR H . . 4.560 3.579 3.419 3.728 . 0 0 "[ . 1 . 2]" 1
2067 1 101 VAL HA 1 104 TYR HB3 . . 4.140 3.134 2.716 3.393 . 0 0 "[ . 1 . 2]" 1
2068 1 101 VAL HA 1 105 LEU H . . 4.830 4.205 4.038 4.357 . 0 0 "[ . 1 . 2]" 1
2069 1 101 VAL HB 1 102 MET H . . 3.390 2.181 2.096 2.294 . 0 0 "[ . 1 . 2]" 1
2070 1 101 VAL MG1 1 102 MET H . . 3.840 3.065 2.845 3.204 . 0 0 "[ . 1 . 2]" 1
2071 1 101 VAL MG1 1 102 MET HA . . 4.250 3.305 3.021 3.428 . 0 0 "[ . 1 . 2]" 1
2072 1 101 VAL MG1 1 103 THR H . . 4.850 4.808 4.707 4.850 0.000 7 0 "[ . 1 . 2]" 1
2073 1 101 VAL MG1 1 105 LEU H . . 4.440 3.658 3.454 4.066 . 0 0 "[ . 1 . 2]" 1
2074 1 101 VAL MG1 1 105 LEU HB2 . . 4.100 3.874 3.560 4.090 . 0 0 "[ . 1 . 2]" 1
2075 1 101 VAL MG1 1 105 LEU MD1 . . 3.100 2.293 1.963 2.615 . 0 0 "[ . 1 . 2]" 1
2076 1 101 VAL MG1 1 105 LEU MD2 . . 4.850 3.890 3.640 4.257 . 0 0 "[ . 1 . 2]" 1
2077 1 101 VAL MG1 1 105 LEU HG . . 3.970 2.869 2.634 3.310 . 0 0 "[ . 1 . 2]" 1
2078 1 101 VAL MG2 1 102 MET H . . 3.890 3.696 3.650 3.765 . 0 0 "[ . 1 . 2]" 1
2079 1 101 VAL MG2 1 104 TYR H . . 5.500 5.305 5.144 5.429 . 0 0 "[ . 1 . 2]" 1
2080 1 101 VAL MG2 1 105 LEU MD1 . . 4.930 4.623 4.400 4.905 . 0 0 "[ . 1 . 2]" 1
2081 1 102 MET H 1 102 MET HB2 . . 3.240 2.379 2.291 2.504 . 0 0 "[ . 1 . 2]" 1
2082 1 102 MET H 1 102 MET HB3 . . 3.610 3.577 3.554 3.605 . 0 0 "[ . 1 . 2]" 1
2083 1 102 MET H 1 102 MET ME . . 5.280 4.959 4.774 5.085 . 0 0 "[ . 1 . 2]" 1
2084 1 102 MET H 1 102 MET HG2 . . 3.720 3.431 2.468 3.669 . 0 0 "[ . 1 . 2]" 1
2085 1 102 MET H 1 102 MET HG3 . . 3.720 2.563 2.293 3.620 . 0 0 "[ . 1 . 2]" 1
2086 1 102 MET H 1 103 THR H . . 3.470 2.936 2.684 3.066 . 0 0 "[ . 1 . 2]" 1
2087 1 102 MET H 1 105 LEU MD1 . . 4.610 4.105 3.938 4.316 . 0 0 "[ . 1 . 2]" 1
2088 1 102 MET HA 1 102 MET ME . . 4.590 3.804 3.554 4.065 . 0 0 "[ . 1 . 2]" 1
2089 1 102 MET HA 1 102 MET HG2 . . 4.070 2.351 2.174 2.713 . 0 0 "[ . 1 . 2]" 1
2090 1 102 MET HA 1 102 MET QG . . 3.430 2.275 2.132 2.648 . 0 0 "[ . 1 . 2]" 1
2091 1 102 MET HA 1 102 MET HG3 . . 4.070 3.053 2.870 3.693 . 0 0 "[ . 1 . 2]" 1
2092 1 102 MET HA 1 105 LEU H . . 3.990 3.596 3.322 3.908 . 0 0 "[ . 1 . 2]" 1
2093 1 102 MET HA 1 105 LEU HB2 . . 4.080 2.581 2.405 2.776 . 0 0 "[ . 1 . 2]" 1
2094 1 102 MET HA 1 105 LEU HB3 . . 4.490 4.111 3.908 4.343 . 0 0 "[ . 1 . 2]" 1
2095 1 102 MET HA 1 105 LEU MD1 . . 3.810 2.498 2.248 2.745 . 0 0 "[ . 1 . 2]" 1
2096 1 102 MET HA 1 106 TYR H . . 4.230 4.035 3.819 4.220 . 0 0 "[ . 1 . 2]" 1
2097 1 102 MET HB2 1 103 THR H . . 3.600 2.617 2.500 2.749 . 0 0 "[ . 1 . 2]" 1
2098 1 102 MET HB3 1 103 THR H . . 3.860 3.313 3.048 3.650 . 0 0 "[ . 1 . 2]" 1
2099 1 102 MET HB3 1 106 TYR QD . . 4.520 3.675 3.206 4.329 . 0 0 "[ . 1 . 2]" 1
2100 1 102 MET HB3 1 106 TYR QE . . 3.920 2.750 2.121 3.106 . 0 0 "[ . 1 . 2]" 1
2101 1 102 MET ME 1 102 MET HG2 . . 3.760 2.258 2.014 3.218 . 0 0 "[ . 1 . 2]" 1
2102 1 102 MET ME 1 102 MET QG . . 3.150 2.164 1.992 2.380 . 0 0 "[ . 1 . 2]" 1
2103 1 102 MET ME 1 102 MET HG3 . . 3.760 3.193 2.033 3.394 . 0 0 "[ . 1 . 2]" 1
2104 1 102 MET ME 1 106 TYR QD . . 5.350 4.696 4.339 5.114 . 0 0 "[ . 1 . 2]" 1
2105 1 102 MET ME 1 106 TYR QE . . 3.700 3.220 2.776 3.693 . 0 0 "[ . 1 . 2]" 1
2106 1 102 MET QG 1 103 THR H . . 4.640 4.211 4.117 4.297 . 0 0 "[ . 1 . 2]" 1
2107 1 102 MET QG 1 106 TYR QE . . 5.340 4.486 3.895 4.832 . 0 0 "[ . 1 . 2]" 1
2108 1 102 MET HG2 1 103 THR H . . 5.500 4.929 4.575 5.050 . 0 0 "[ . 1 . 2]" 1
2109 1 102 MET HG3 1 103 THR H . . 5.500 4.582 4.419 4.956 . 0 0 "[ . 1 . 2]" 1
2110 1 103 THR H 1 103 THR HB . . 3.190 2.614 2.534 2.716 . 0 0 "[ . 1 . 2]" 1
2111 1 103 THR H 1 103 THR HG1 . . 3.720 2.738 1.961 3.550 . 0 0 "[ . 1 . 2]" 1
2112 1 103 THR H 1 103 THR MG . . 3.970 3.765 3.754 3.770 . 0 0 "[ . 1 . 2]" 1
2113 1 103 THR H 1 104 TYR HB2 . . 5.500 5.274 5.139 5.378 . 0 0 "[ . 1 . 2]" 1
2114 1 103 THR H 1 106 TYR H . . 5.490 5.040 4.758 5.202 . 0 0 "[ . 1 . 2]" 1
2115 1 103 THR HA 1 103 THR MG . . 3.150 2.381 2.295 2.463 . 0 0 "[ . 1 . 2]" 1
2116 1 103 THR HA 1 106 TYR H . . 4.540 3.961 3.708 4.200 . 0 0 "[ . 1 . 2]" 1
2117 1 103 THR HA 1 106 TYR QB . . 3.740 3.127 2.738 3.518 . 0 0 "[ . 1 . 2]" 1
2118 1 103 THR HA 1 106 TYR QD . . 3.590 2.195 1.998 2.482 . 0 0 "[ . 1 . 2]" 1
2119 1 103 THR HB 1 104 TYR H . . 3.290 2.429 2.172 2.815 . 0 0 "[ . 1 . 2]" 1
2120 1 103 THR MG 1 104 TYR H . . 3.640 3.349 3.105 3.560 . 0 0 "[ . 1 . 2]" 1
2121 1 103 THR MG 1 104 TYR HA . . 4.300 3.453 3.263 3.690 . 0 0 "[ . 1 . 2]" 1
2122 1 103 THR MG 1 104 TYR QD . . 4.980 4.847 4.651 4.980 . 0 0 "[ . 1 . 2]" 1
2123 1 103 THR MG 1 105 LEU H . . 5.280 5.154 4.959 5.271 . 0 0 "[ . 1 . 2]" 1
2124 1 103 THR MG 1 106 TYR H . . 5.500 5.080 4.813 5.360 . 0 0 "[ . 1 . 2]" 1
2125 1 103 THR MG 1 106 TYR QB . . 4.150 3.895 3.621 4.119 . 0 0 "[ . 1 . 2]" 1
2126 1 103 THR MG 1 106 TYR QD . . 4.090 3.913 3.571 4.072 . 0 0 "[ . 1 . 2]" 1
2127 1 103 THR MG 1 107 GLN H . . 4.950 4.748 4.603 4.917 . 0 0 "[ . 1 . 2]" 1
2128 1 103 THR MG 1 107 GLN HG2 . . 4.280 3.729 3.419 4.230 . 0 0 "[ . 1 . 2]" 1
2129 1 103 THR MG 1 107 GLN HG3 . . 4.480 4.057 3.792 4.368 . 0 0 "[ . 1 . 2]" 1
2130 1 104 TYR H 1 104 TYR HB2 . . 3.120 2.524 2.405 2.636 . 0 0 "[ . 1 . 2]" 1
2131 1 104 TYR H 1 104 TYR HB3 . . 3.900 2.546 2.436 2.662 . 0 0 "[ . 1 . 2]" 1
2132 1 104 TYR H 1 104 TYR QD . . 4.410 4.181 4.138 4.208 . 0 0 "[ . 1 . 2]" 1
2133 1 104 TYR H 1 105 LEU H . . 3.540 2.783 2.516 2.994 . 0 0 "[ . 1 . 2]" 1
2134 1 104 TYR H 1 105 LEU HB2 . . 4.980 4.608 4.376 4.822 . 0 0 "[ . 1 . 2]" 1
2135 1 104 TYR H 1 105 LEU HG . . 5.500 5.194 4.886 5.456 . 0 0 "[ . 1 . 2]" 1
2136 1 104 TYR H 1 106 TYR H . . 5.500 4.533 4.255 4.711 . 0 0 "[ . 1 . 2]" 1
2137 1 104 TYR HA 1 104 TYR QD . . 3.220 2.155 2.013 2.301 . 0 0 "[ . 1 . 2]" 1
2138 1 104 TYR HA 1 104 TYR QE . . 4.560 4.401 4.298 4.485 . 0 0 "[ . 1 . 2]" 1
2139 1 104 TYR HA 1 106 TYR H . . 5.190 4.779 4.600 5.028 . 0 0 "[ . 1 . 2]" 1
2140 1 104 TYR HA 1 107 GLN H . . 4.730 3.670 3.568 3.799 . 0 0 "[ . 1 . 2]" 1
2141 1 104 TYR HA 1 107 GLN HB2 . . 4.420 3.553 3.365 3.806 . 0 0 "[ . 1 . 2]" 1
2142 1 104 TYR HA 1 107 GLN HG2 . . 4.580 3.090 2.668 3.800 . 0 0 "[ . 1 . 2]" 1
2143 1 104 TYR HA 1 107 GLN HG3 . . 3.650 2.612 2.003 2.882 . 0 0 "[ . 1 . 2]" 1
2144 1 104 TYR HB2 1 105 LEU H . . 3.870 3.771 3.609 3.871 0.001 5 0 "[ . 1 . 2]" 1
2145 1 104 TYR HB3 1 105 LEU H . . 4.410 2.404 2.179 2.581 . 0 0 "[ . 1 . 2]" 1
2146 1 104 TYR QD 1 105 LEU H . . 4.220 3.811 3.415 4.047 . 0 0 "[ . 1 . 2]" 1
2147 1 104 TYR QD 1 105 LEU HG . . 4.830 4.028 3.651 4.372 . 0 0 "[ . 1 . 2]" 1
2148 1 104 TYR QD 1 107 GLN H . . 5.030 4.826 4.611 4.958 . 0 0 "[ . 1 . 2]" 1
2149 1 104 TYR QD 1 107 GLN HG2 . . 4.730 4.208 3.839 4.646 . 0 0 "[ . 1 . 2]" 1
2150 1 104 TYR QD 1 108 ILE MD . . 4.040 3.050 2.894 3.210 . 0 0 "[ . 1 . 2]" 1
2151 1 104 TYR QE 1 107 GLN HB2 . . 5.310 4.124 3.875 4.299 . 0 0 "[ . 1 . 2]" 1
2152 1 104 TYR QE 1 107 GLN HG3 . . 5.050 4.426 4.049 4.824 . 0 0 "[ . 1 . 2]" 1
2153 1 104 TYR QE 1 108 ILE MD . . 4.020 2.823 2.597 3.090 . 0 0 "[ . 1 . 2]" 1
2154 1 104 TYR QE 1 108 ILE HG13 . . 5.500 4.414 4.032 4.756 . 0 0 "[ . 1 . 2]" 1
2155 1 105 LEU H 1 105 LEU HB2 . . 3.370 2.276 2.211 2.445 . 0 0 "[ . 1 . 2]" 1
2156 1 105 LEU H 1 105 LEU HB3 . . 3.630 3.540 3.511 3.589 . 0 0 "[ . 1 . 2]" 1
2157 1 105 LEU H 1 105 LEU MD1 . . 3.780 3.544 3.355 3.667 . 0 0 "[ . 1 . 2]" 1
2158 1 105 LEU H 1 105 LEU MD2 . . 3.990 3.857 3.684 3.988 . 0 0 "[ . 1 . 2]" 1
2159 1 105 LEU H 1 105 LEU HG . . 3.390 2.708 2.363 2.845 . 0 0 "[ . 1 . 2]" 1
2160 1 105 LEU H 1 106 TYR H . . 3.550 3.007 2.849 3.197 . 0 0 "[ . 1 . 2]" 1
2161 1 105 LEU H 1 107 GLN H . . 4.570 4.236 4.093 4.392 . 0 0 "[ . 1 . 2]" 1
2162 1 105 LEU H 1 108 ILE MD . . 4.650 3.804 3.679 3.971 . 0 0 "[ . 1 . 2]" 1
2163 1 105 LEU HA 1 105 LEU MD1 . . 4.320 3.831 3.814 3.875 . 0 0 "[ . 1 . 2]" 1
2164 1 105 LEU HA 1 105 LEU MD2 . . 3.240 2.129 1.976 2.300 . 0 0 "[ . 1 . 2]" 1
2165 1 105 LEU HA 1 105 LEU HG . . 4.170 2.697 2.587 2.777 . 0 0 "[ . 1 . 2]" 1
2166 1 105 LEU HA 1 108 ILE H . . 3.910 3.393 3.159 3.576 . 0 0 "[ . 1 . 2]" 1
2167 1 105 LEU HA 1 108 ILE HB . . 3.880 3.142 2.911 3.320 . 0 0 "[ . 1 . 2]" 1
2168 1 105 LEU HA 1 108 ILE MD . . 3.520 2.021 1.946 2.252 . 0 0 "[ . 1 . 2]" 1
2169 1 105 LEU HA 1 108 ILE MG . . 4.650 4.517 4.353 4.649 . 0 0 "[ . 1 . 2]" 1
2170 1 105 LEU HA 1 109 ARG H . . 4.650 4.075 3.904 4.323 . 0 0 "[ . 1 . 2]" 1
2171 1 105 LEU HB2 1 105 LEU MD1 . . 3.620 2.203 2.100 2.318 . 0 0 "[ . 1 . 2]" 1
2172 1 105 LEU HB2 1 105 LEU MD2 . . 3.660 3.175 3.160 3.187 . 0 0 "[ . 1 . 2]" 1
2173 1 105 LEU HB2 1 106 TYR H . . 3.770 2.457 2.305 2.571 . 0 0 "[ . 1 . 2]" 1
2174 1 105 LEU HB2 1 106 TYR QD . . 5.500 4.652 4.421 4.853 . 0 0 "[ . 1 . 2]" 1
2175 1 105 LEU HB3 1 105 LEU MD1 . . 3.550 2.479 2.382 2.563 . 0 0 "[ . 1 . 2]" 1
2176 1 105 LEU HB3 1 106 TYR H . . 4.080 2.949 2.807 3.163 . 0 0 "[ . 1 . 2]" 1
2177 1 105 LEU MD2 1 106 TYR H . . 4.620 4.501 4.428 4.620 . 0 0 "[ . 1 . 2]" 1
2178 1 105 LEU MD2 1 108 ILE H . . 4.880 4.660 4.384 4.856 . 0 0 "[ . 1 . 2]" 1
2179 1 105 LEU MD2 1 108 ILE HB . . 4.010 3.367 3.096 3.619 . 0 0 "[ . 1 . 2]" 1
2180 1 105 LEU MD2 1 108 ILE MD . . 3.310 3.080 2.845 3.224 . 0 0 "[ . 1 . 2]" 1
2181 1 105 LEU MD2 1 109 ARG H . . 4.790 4.226 3.895 4.558 . 0 0 "[ . 1 . 2]" 1
2182 1 105 LEU HG 1 106 TYR H . . 4.710 4.631 4.479 4.698 . 0 0 "[ . 1 . 2]" 1
2183 1 105 LEU HG 1 108 ILE MD . . 4.370 4.020 3.865 4.196 . 0 0 "[ . 1 . 2]" 1
2184 1 106 TYR H 1 106 TYR QB . . 2.970 2.395 2.277 2.583 . 0 0 "[ . 1 . 2]" 1
2185 1 106 TYR H 1 106 TYR QD . . 3.810 3.150 2.909 3.317 . 0 0 "[ . 1 . 2]" 1
2186 1 106 TYR H 1 107 GLN H . . 3.420 2.948 2.817 3.051 . 0 0 "[ . 1 . 2]" 1
2187 1 106 TYR H 1 108 ILE H . . 4.840 4.692 4.486 4.837 . 0 0 "[ . 1 . 2]" 1
2188 1 106 TYR H 1 109 ARG H . . 5.190 5.002 4.831 5.138 . 0 0 "[ . 1 . 2]" 1
2189 1 106 TYR H 1 109 ARG HB3 . . 5.500 4.918 4.666 5.140 . 0 0 "[ . 1 . 2]" 1
2190 1 106 TYR H 1 109 ARG QD . . 5.500 5.401 5.229 5.503 0.003 8 0 "[ . 1 . 2]" 1
2191 1 106 TYR HA 1 106 TYR QD . . 3.120 2.179 2.000 2.503 . 0 0 "[ . 1 . 2]" 1
2192 1 106 TYR HA 1 106 TYR QE . . 4.440 4.270 4.177 4.364 . 0 0 "[ . 1 . 2]" 1
2193 1 106 TYR HA 1 109 ARG H . . 5.210 3.851 3.726 4.118 . 0 0 "[ . 1 . 2]" 1
2194 1 106 TYR HA 1 109 ARG HB2 . . 5.410 4.189 3.949 4.373 . 0 0 "[ . 1 . 2]" 1
2195 1 106 TYR HA 1 109 ARG HB3 . . 4.470 2.764 2.607 2.918 . 0 0 "[ . 1 . 2]" 1
2196 1 106 TYR HA 1 109 ARG QD . . 4.480 3.132 2.851 3.446 . 0 0 "[ . 1 . 2]" 1
2197 1 106 TYR HA 1 110 ALA H . . 5.230 3.893 3.581 4.126 . 0 0 "[ . 1 . 2]" 1
2198 1 106 TYR QB 1 107 GLN H . . 3.340 2.681 2.559 2.818 . 0 0 "[ . 1 . 2]" 1
2199 1 106 TYR QB 1 107 GLN HG2 . . 4.610 3.388 3.200 3.663 . 0 0 "[ . 1 . 2]" 1
2200 1 106 TYR QB 1 107 GLN HG3 . . 5.230 4.813 3.838 5.056 . 0 0 "[ . 1 . 2]" 1
2201 1 106 TYR QD 1 107 GLN H . . 4.800 4.526 4.380 4.657 . 0 0 "[ . 1 . 2]" 1
2202 1 106 TYR QD 1 107 GLN HG2 . . 5.380 5.223 4.887 5.344 . 0 0 "[ . 1 . 2]" 1
2203 1 106 TYR QD 1 109 ARG HB3 . . 4.790 3.961 3.637 4.235 . 0 0 "[ . 1 . 2]" 1
2204 1 107 GLN H 1 107 GLN HB2 . . 3.250 2.602 2.515 2.718 . 0 0 "[ . 1 . 2]" 1
2205 1 107 GLN H 1 107 GLN HB3 . . 3.750 3.589 3.584 3.596 . 0 0 "[ . 1 . 2]" 1
2206 1 107 GLN H 1 107 GLN HG2 . . 3.480 2.067 1.901 2.732 . 0 0 "[ . 1 . 2]" 1
2207 1 107 GLN H 1 107 GLN HG3 . . 3.560 3.227 2.192 3.445 . 0 0 "[ . 1 . 2]" 1
2208 1 107 GLN H 1 108 ILE H . . 3.420 2.832 2.620 2.986 . 0 0 "[ . 1 . 2]" 1
2209 1 107 GLN H 1 108 ILE HA . . 5.500 5.392 5.242 5.504 0.004 11 0 "[ . 1 . 2]" 1
2210 1 107 GLN H 1 108 ILE MD . . 4.070 3.546 3.458 3.715 . 0 0 "[ . 1 . 2]" 1
2211 1 107 GLN H 1 109 ARG H . . 4.520 4.426 4.090 4.522 0.002 17 0 "[ . 1 . 2]" 1
2212 1 107 GLN H 1 110 ALA MB . . 4.850 4.434 4.256 4.673 . 0 0 "[ . 1 . 2]" 1
2213 1 107 GLN HA 1 107 GLN HG2 . . 4.020 2.894 2.523 3.039 . 0 0 "[ . 1 . 2]" 1
2214 1 107 GLN HA 1 107 GLN HG3 . . 3.930 3.794 3.498 3.855 . 0 0 "[ . 1 . 2]" 1
2215 1 107 GLN HA 1 110 ALA MB . . 3.210 2.649 2.304 2.820 . 0 0 "[ . 1 . 2]" 1
2216 1 107 GLN HB2 1 108 ILE H . . 3.880 2.293 2.129 2.524 . 0 0 "[ . 1 . 2]" 1
2217 1 107 GLN HB2 1 110 ALA MB . . 5.230 5.059 4.803 5.228 . 0 0 "[ . 1 . 2]" 1
2218 1 107 GLN HB3 1 107 GLN QE . . 4.480 3.587 2.320 4.012 . 0 0 "[ . 1 . 2]" 1
2219 1 107 GLN HB3 1 108 ILE H . . 4.130 3.468 3.304 3.700 . 0 0 "[ . 1 . 2]" 1
2220 1 107 GLN HB3 1 110 ALA MB . . 4.680 4.514 4.201 4.694 0.014 15 0 "[ . 1 . 2]" 1
2221 1 107 GLN HG2 1 108 ILE H . . 4.700 4.166 3.990 4.559 . 0 0 "[ . 1 . 2]" 1
2222 1 107 GLN HG3 1 108 ILE H . . 4.770 4.437 3.733 4.722 . 0 0 "[ . 1 . 2]" 1
2223 1 108 ILE H 1 108 ILE HB . . 3.330 2.506 2.391 2.606 . 0 0 "[ . 1 . 2]" 1
2224 1 108 ILE H 1 108 ILE MD . . 3.340 1.884 1.791 2.014 . 0 0 "[ . 1 . 2]" 1
2225 1 108 ILE H 1 108 ILE HG12 . . 4.380 3.832 3.709 3.991 . 0 0 "[ . 1 . 2]" 1
2226 1 108 ILE H 1 108 ILE HG13 . . 3.390 2.995 2.826 3.279 . 0 0 "[ . 1 . 2]" 1
2227 1 108 ILE H 1 108 ILE MG . . 3.960 3.757 3.732 3.769 . 0 0 "[ . 1 . 2]" 1
2228 1 108 ILE H 1 109 ARG H . . 3.550 2.887 2.703 2.993 . 0 0 "[ . 1 . 2]" 1
2229 1 108 ILE HA 1 108 ILE MD . . 3.900 3.298 3.132 3.412 . 0 0 "[ . 1 . 2]" 1
2230 1 108 ILE HA 1 108 ILE HG12 . . 3.800 3.500 3.420 3.561 . 0 0 "[ . 1 . 2]" 1
2231 1 108 ILE HA 1 108 ILE MG . . 3.460 2.450 2.388 2.499 . 0 0 "[ . 1 . 2]" 1
2232 1 108 ILE HA 1 111 HIS H . . 3.870 3.467 3.244 3.669 . 0 0 "[ . 1 . 2]" 1
2233 1 108 ILE HA 1 111 HIS QB . . 3.870 2.788 2.524 3.158 . 0 0 "[ . 1 . 2]" 1
2234 1 108 ILE HA 1 112 PHE H . . 4.570 4.234 3.784 4.500 . 0 0 "[ . 1 . 2]" 1
2235 1 108 ILE HA 1 112 PHE QD . . 4.840 3.949 3.050 4.482 . 0 0 "[ . 1 . 2]" 1
2236 1 108 ILE HB 1 108 ILE MD . . 3.410 2.127 2.085 2.235 . 0 0 "[ . 1 . 2]" 1
2237 1 108 ILE HB 1 109 ARG H . . 3.480 2.293 2.157 2.505 . 0 0 "[ . 1 . 2]" 1
2238 1 108 ILE MD 1 108 ILE MG . . 3.270 3.151 3.090 3.191 . 0 0 "[ . 1 . 2]" 1
2239 1 108 ILE MD 1 109 ARG H . . 4.030 3.580 3.402 3.778 . 0 0 "[ . 1 . 2]" 1
2240 1 108 ILE HG12 1 108 ILE MG . . 2.910 2.149 2.021 2.225 . 0 0 "[ . 1 . 2]" 1
2241 1 108 ILE MG 1 109 ARG H . . 3.660 3.040 2.842 3.288 . 0 0 "[ . 1 . 2]" 1
2242 1 108 ILE MG 1 109 ARG HA . . 4.550 3.206 3.016 3.417 . 0 0 "[ . 1 . 2]" 1
2243 1 108 ILE MG 1 109 ARG HB2 . . 5.500 4.214 3.919 4.423 . 0 0 "[ . 1 . 2]" 1
2244 1 108 ILE MG 1 110 ALA H . . 4.850 4.681 4.544 4.834 . 0 0 "[ . 1 . 2]" 1
2245 1 108 ILE MG 1 111 HIS QB . . 4.570 3.677 3.455 4.062 . 0 0 "[ . 1 . 2]" 1
2246 1 108 ILE MG 1 112 PHE H . . 4.690 3.956 3.517 4.287 . 0 0 "[ . 1 . 2]" 1
2247 1 108 ILE MG 1 112 PHE HB2 . . 4.550 4.026 3.214 4.385 . 0 0 "[ . 1 . 2]" 1
2248 1 108 ILE MG 1 112 PHE QD . . 3.300 2.439 2.033 2.705 . 0 0 "[ . 1 . 2]" 1
2249 1 108 ILE MG 1 112 PHE QE . . 3.350 2.394 1.898 2.919 . 0 0 "[ . 1 . 2]" 1
2250 1 109 ARG H 1 109 ARG HB2 . . 3.600 2.674 2.594 2.777 . 0 0 "[ . 1 . 2]" 1
2251 1 109 ARG H 1 109 ARG HB3 . . 3.380 2.386 2.295 2.472 . 0 0 "[ . 1 . 2]" 1
2252 1 109 ARG H 1 109 ARG QD . . 4.660 4.200 3.941 4.461 . 0 0 "[ . 1 . 2]" 1
2253 1 109 ARG H 1 110 ALA H . . 3.480 2.771 2.641 2.864 . 0 0 "[ . 1 . 2]" 1
2254 1 109 ARG H 1 111 HIS H . . 4.750 4.360 4.161 4.632 . 0 0 "[ . 1 . 2]" 1
2255 1 109 ARG HA 1 109 ARG QD . . 4.910 3.972 3.605 4.231 . 0 0 "[ . 1 . 2]" 1
2256 1 109 ARG HA 1 109 ARG HG2 . . 4.030 2.887 2.616 3.230 . 0 0 "[ . 1 . 2]" 1
2257 1 109 ARG HA 1 109 ARG QG . . 3.490 2.618 2.561 2.678 . 0 0 "[ . 1 . 2]" 1
2258 1 109 ARG HA 1 109 ARG HG3 . . 4.030 3.176 2.833 3.680 . 0 0 "[ . 1 . 2]" 1
2259 1 109 ARG HA 1 110 ALA MB . . 5.500 5.014 4.994 5.030 . 0 0 "[ . 1 . 2]" 1
2260 1 109 ARG HA 1 112 PHE H . . 4.680 3.928 3.717 4.093 . 0 0 "[ . 1 . 2]" 1
2261 1 109 ARG HA 1 112 PHE HB2 . . 5.060 3.418 2.842 3.790 . 0 0 "[ . 1 . 2]" 1
2262 1 109 ARG HA 1 112 PHE QD . . 5.170 3.692 3.117 4.409 . 0 0 "[ . 1 . 2]" 1
2263 1 109 ARG HA 1 113 SER H . . 4.640 3.660 3.303 3.975 . 0 0 "[ . 1 . 2]" 1
2264 1 109 ARG HB2 1 110 ALA H . . 4.110 4.052 3.971 4.114 0.004 12 0 "[ . 1 . 2]" 1
2265 1 109 ARG HB3 1 110 ALA H . . 3.570 2.771 2.646 2.873 . 0 0 "[ . 1 . 2]" 1
2266 1 109 ARG QG 1 110 ALA H . . 4.640 3.657 3.223 4.043 . 0 0 "[ . 1 . 2]" 1
2267 1 110 ALA H 1 110 ALA MB . . 2.830 2.165 2.034 2.245 . 0 0 "[ . 1 . 2]" 1
2268 1 110 ALA H 1 111 HIS H . . 3.350 2.631 2.494 2.794 . 0 0 "[ . 1 . 2]" 1
2269 1 110 ALA MB 1 111 HIS H . . 3.240 2.529 2.312 2.792 . 0 0 "[ . 1 . 2]" 1
2270 1 110 ALA MB 1 111 HIS HA . . 4.340 3.760 3.647 3.862 . 0 0 "[ . 1 . 2]" 1
2271 1 110 ALA MB 1 111 HIS QB . . 4.380 3.962 3.773 4.289 . 0 0 "[ . 1 . 2]" 1
2272 1 110 ALA MB 1 112 PHE H . . 4.880 4.733 4.528 4.879 . 0 0 "[ . 1 . 2]" 1
2273 1 110 ALA MB 1 113 SER H . . 5.110 4.882 4.645 5.105 . 0 0 "[ . 1 . 2]" 1
2274 1 111 HIS H 1 111 HIS QB . . 2.840 2.261 2.157 2.625 . 0 0 "[ . 1 . 2]" 1
2275 1 111 HIS H 1 112 PHE H . . 3.390 2.932 2.678 3.103 . 0 0 "[ . 1 . 2]" 1
2276 1 111 HIS H 1 112 PHE HB2 . . 5.150 5.015 4.738 5.151 0.001 9 0 "[ . 1 . 2]" 1
2277 1 111 HIS H 1 112 PHE QD . . 5.080 4.653 3.823 5.078 . 0 0 "[ . 1 . 2]" 1
2278 1 111 HIS QB 1 112 PHE H . . 3.030 2.284 1.953 2.532 . 0 0 "[ . 1 . 2]" 1
2279 1 111 HIS QB 1 112 PHE QE . . 4.890 4.052 3.319 4.580 . 0 0 "[ . 1 . 2]" 1
2280 1 111 HIS HD2 1 112 PHE H . . 4.370 3.663 2.658 4.353 . 0 0 "[ . 1 . 2]" 1
2281 1 111 HIS HD2 1 112 PHE QD . . 4.400 3.618 2.788 4.263 . 0 0 "[ . 1 . 2]" 1
2282 1 111 HIS HD2 1 112 PHE QE . . 4.500 3.870 3.064 4.443 . 0 0 "[ . 1 . 2]" 1
2283 1 112 PHE H 1 112 PHE HB2 . . 3.300 2.374 2.312 2.486 . 0 0 "[ . 1 . 2]" 1
2284 1 112 PHE H 1 112 PHE HB3 . . 3.950 3.581 3.558 3.604 . 0 0 "[ . 1 . 2]" 1
2285 1 112 PHE H 1 112 PHE QD . . 3.550 2.586 1.908 3.064 . 0 0 "[ . 1 . 2]" 1
2286 1 112 PHE H 1 113 SER H . . 3.140 2.678 2.456 2.838 . 0 0 "[ . 1 . 2]" 1
2287 1 112 PHE HA 1 112 PHE QD . . 3.360 2.683 2.233 3.124 . 0 0 "[ . 1 . 2]" 1
2288 1 112 PHE HA 1 112 PHE QE . . 4.710 4.496 4.331 4.654 . 0 0 "[ . 1 . 2]" 1
2289 1 112 PHE HB2 1 113 SER H . . 4.020 2.427 2.204 2.683 . 0 0 "[ . 1 . 2]" 1
2290 1 112 PHE HB3 1 113 SER H . . 3.910 3.307 3.026 3.573 . 0 0 "[ . 1 . 2]" 1
2291 1 112 PHE QD 1 113 SER H . . 4.340 4.135 3.981 4.288 . 0 0 "[ . 1 . 2]" 1
2292 1 113 SER H 1 113 SER HB2 . . 3.780 2.901 2.353 3.772 . 0 0 "[ . 1 . 2]" 1
2293 1 113 SER H 1 113 SER QB . . 2.920 2.463 2.253 2.838 . 0 0 "[ . 1 . 2]" 1
2294 1 113 SER H 1 113 SER HB3 . . 3.780 2.825 2.370 3.696 . 0 0 "[ . 1 . 2]" 1
2295 1 114 SER QB 1 115 GLY H . . 4.700 3.106 2.076 3.935 . 0 0 "[ . 1 . 2]" 1
2296 1 115 GLY QA 1 116 PRO QD . . 2.980 1.975 1.857 2.310 . 0 0 "[ . 1 . 2]" 1
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