NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
458277 |
2kqy   |
16617 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kqy
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 1911
_Distance_constraint_stats_list.Viol_count 1706
_Distance_constraint_stats_list.Viol_total 1521.207
_Distance_constraint_stats_list.Viol_max 0.481
_Distance_constraint_stats_list.Viol_rms 0.0157
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0020
_Distance_constraint_stats_list.Viol_average_violations_only 0.0446
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 ILE 0.290 0.031 10 0 "[ . 1 . 2]"
1 3 THR 0.036 0.017 8 0 "[ . 1 . 2]"
1 4 ASP 0.025 0.020 6 0 "[ . 1 . 2]"
1 5 ILE 0.907 0.092 1 0 "[ . 1 . 2]"
1 6 LEU 0.038 0.017 8 0 "[ . 1 . 2]"
1 7 SER 0.315 0.050 8 0 "[ . 1 . 2]"
1 8 ALA 0.058 0.023 9 0 "[ . 1 . 2]"
1 9 LYS 0.002 0.002 14 0 "[ . 1 . 2]"
1 10 ASP 1.584 0.101 10 0 "[ . 1 . 2]"
1 11 ILE 0.498 0.067 6 0 "[ . 1 . 2]"
1 12 GLU 1.336 0.148 11 0 "[ . 1 . 2]"
1 13 SER 1.244 0.148 11 0 "[ . 1 . 2]"
1 14 ALA 0.261 0.037 4 0 "[ . 1 . 2]"
1 15 LEU 0.380 0.042 15 0 "[ . 1 . 2]"
1 16 SER 1.737 0.284 20 0 "[ . 1 . 2]"
1 17 SER 1.326 0.244 20 0 "[ . 1 . 2]"
1 18 CYS 1.368 0.244 20 0 "[ . 1 . 2]"
1 19 GLN 1.381 0.167 4 0 "[ . 1 . 2]"
1 20 ALA 0.819 0.115 3 0 "[ . 1 . 2]"
1 21 ALA 0.409 0.068 12 0 "[ . 1 . 2]"
1 22 ASP 0.285 0.084 10 0 "[ . 1 . 2]"
1 23 SER 2.972 0.254 10 0 "[ . 1 . 2]"
1 24 PHE 0.752 0.270 18 0 "[ . 1 . 2]"
1 25 ASN 3.049 0.254 10 0 "[ . 1 . 2]"
1 26 TYR 0.559 0.099 10 0 "[ . 1 . 2]"
1 27 LYS 4.955 0.400 5 0 "[ . 1 . 2]"
1 28 SER 2.151 0.188 11 0 "[ . 1 . 2]"
1 29 PHE 1.987 0.253 13 0 "[ . 1 . 2]"
1 30 PHE 11.473 0.416 8 0 "[ . 1 . 2]"
1 31 SER 3.628 0.195 4 0 "[ . 1 . 2]"
1 32 THR 1.507 0.266 4 0 "[ . 1 . 2]"
1 33 VAL 1.226 0.101 10 0 "[ . 1 . 2]"
1 34 GLY 0.713 0.266 4 0 "[ . 1 . 2]"
1 35 LEU 2.406 0.242 19 0 "[ . 1 . 2]"
1 36 SER 0.115 0.043 20 0 "[ . 1 . 2]"
1 37 SER 0.051 0.035 19 0 "[ . 1 . 2]"
1 38 LYS 1.746 0.368 12 0 "[ . 1 . 2]"
1 39 THR 0.906 0.368 12 0 "[ . 1 . 2]"
1 40 PRO 0.467 0.122 19 0 "[ . 1 . 2]"
1 41 ASP 0.870 0.098 16 0 "[ . 1 . 2]"
1 42 GLN 2.378 0.152 12 0 "[ . 1 . 2]"
1 43 ILE 0.990 0.102 6 0 "[ . 1 . 2]"
1 44 LYS 1.543 0.143 1 0 "[ . 1 . 2]"
1 45 LYS 2.010 0.152 16 0 "[ . 1 . 2]"
1 46 VAL 0.323 0.044 15 0 "[ . 1 . 2]"
1 47 PHE 3.520 0.164 15 0 "[ . 1 . 2]"
1 48 GLY 0.372 0.094 12 0 "[ . 1 . 2]"
1 49 ILE 0.979 0.097 19 0 "[ . 1 . 2]"
1 50 LEU 2.143 0.147 9 0 "[ . 1 . 2]"
1 51 ASP 1.045 0.138 17 0 "[ . 1 . 2]"
1 52 GLN 0.980 0.193 16 0 "[ . 1 . 2]"
1 53 ASP 0.733 0.129 16 0 "[ . 1 . 2]"
1 54 LYS 4.921 0.481 20 0 "[ . 1 . 2]"
1 55 SER 0.792 0.178 17 0 "[ . 1 . 2]"
1 56 GLY 0.261 0.055 7 0 "[ . 1 . 2]"
1 57 PHE 1.676 0.251 17 0 "[ . 1 . 2]"
1 58 ILE 0.694 0.251 17 0 "[ . 1 . 2]"
1 59 GLU 0.464 0.151 18 0 "[ . 1 . 2]"
1 60 GLU 0.632 0.151 18 0 "[ . 1 . 2]"
1 61 GLU 0.296 0.089 7 0 "[ . 1 . 2]"
1 62 GLU 1.952 0.101 18 0 "[ . 1 . 2]"
1 63 LEU 0.440 0.063 7 0 "[ . 1 . 2]"
1 64 GLN 2.623 0.110 11 0 "[ . 1 . 2]"
1 65 LEU 2.802 0.101 18 0 "[ . 1 . 2]"
1 66 PHE 2.844 0.085 19 0 "[ . 1 . 2]"
1 67 LEU 0.353 0.060 9 0 "[ . 1 . 2]"
1 68 LYS 2.273 0.250 9 0 "[ . 1 . 2]"
1 69 ASN 2.183 0.147 9 0 "[ . 1 . 2]"
1 70 PHE 0.596 0.085 19 0 "[ . 1 . 2]"
1 71 SER 1.069 0.164 19 0 "[ . 1 . 2]"
1 72 SER 0.771 0.164 19 0 "[ . 1 . 2]"
1 73 SER 0.372 0.118 11 0 "[ . 1 . 2]"
1 74 ALA 1.253 0.251 9 0 "[ . 1 . 2]"
1 75 ARG 0.981 0.250 9 0 "[ . 1 . 2]"
1 76 VAL 1.741 0.251 9 0 "[ . 1 . 2]"
1 77 LEU 4.816 0.179 18 0 "[ . 1 . 2]"
1 78 THR 3.296 0.179 18 0 "[ . 1 . 2]"
1 79 SER 0.247 0.069 4 0 "[ . 1 . 2]"
1 80 ALA 0.066 0.026 12 0 "[ . 1 . 2]"
1 81 GLU 0.394 0.096 5 0 "[ . 1 . 2]"
1 82 THR 0.546 0.069 4 0 "[ . 1 . 2]"
1 83 LYS 0.590 0.032 12 0 "[ . 1 . 2]"
1 84 ALA 0.070 0.024 4 0 "[ . 1 . 2]"
1 85 PHE 1.322 0.129 14 0 "[ . 1 . 2]"
1 86 LEU 0.818 0.050 7 0 "[ . 1 . 2]"
1 87 ALA 0.377 0.032 12 0 "[ . 1 . 2]"
1 88 ALA 0.255 0.028 12 0 "[ . 1 . 2]"
1 89 GLY 2.071 0.129 14 0 "[ . 1 . 2]"
1 90 ASP 1.080 0.051 18 0 "[ . 1 . 2]"
1 91 THR 1.809 0.276 14 0 "[ . 1 . 2]"
1 92 ASP 0.120 0.037 13 0 "[ . 1 . 2]"
1 93 GLY 0.303 0.151 6 0 "[ . 1 . 2]"
1 94 ASP 0.017 0.011 6 0 "[ . 1 . 2]"
1 95 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 LYS 0.377 0.082 16 0 "[ . 1 . 2]"
1 97 ILE 0.501 0.100 16 0 "[ . 1 . 2]"
1 98 GLY 0.202 0.068 17 0 "[ . 1 . 2]"
1 99 VAL 2.538 0.164 15 0 "[ . 1 . 2]"
1 100 GLU 0.855 0.146 14 0 "[ . 1 . 2]"
1 101 GLU 2.470 0.276 14 0 "[ . 1 . 2]"
1 102 PHE 0.927 0.079 15 0 "[ . 1 . 2]"
1 103 GLN 1.136 0.079 10 0 "[ . 1 . 2]"
1 104 SER 0.966 0.109 15 0 "[ . 1 . 2]"
1 105 LEU 1.027 0.151 19 0 "[ . 1 . 2]"
1 106 VAL 0.756 0.151 19 0 "[ . 1 . 2]"
1 107 LYS 1.388 0.122 19 0 "[ . 1 . 2]"
1 108 ALA 0.060 0.014 19 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 2 ILE HA 1 2 ILE MD . . 4.550 1.985 1.945 2.063 . 0 0 "[ . 1 . 2]" 1
2 1 2 ILE HA 1 2 ILE HG12 . . 4.190 3.705 3.675 3.735 . 0 0 "[ . 1 . 2]" 1
3 1 2 ILE HA 1 2 ILE HG13 . . 3.950 3.030 2.826 3.217 . 0 0 "[ . 1 . 2]" 1
4 1 2 ILE HA 1 3 THR MG . . 5.500 5.045 4.921 5.076 . 0 0 "[ . 1 . 2]" 1
5 1 2 ILE HA 1 4 ASP H . . 4.990 3.656 3.535 3.892 . 0 0 "[ . 1 . 2]" 1
6 1 2 ILE HA 1 5 ILE H . . 4.260 3.737 3.652 3.808 . 0 0 "[ . 1 . 2]" 1
7 1 2 ILE HA 1 5 ILE HB . . 5.500 4.524 4.236 4.769 . 0 0 "[ . 1 . 2]" 1
8 1 2 ILE HA 1 5 ILE MD . . 5.500 3.742 3.521 4.264 . 0 0 "[ . 1 . 2]" 1
9 1 2 ILE HA 1 6 LEU H . . 5.500 4.285 4.046 4.463 . 0 0 "[ . 1 . 2]" 1
10 1 2 ILE HA 1 6 LEU HB2 . . 5.500 4.870 4.567 5.162 . 0 0 "[ . 1 . 2]" 1
11 1 2 ILE HA 1 46 VAL HA . . 5.390 4.927 4.491 5.342 . 0 0 "[ . 1 . 2]" 1
12 1 2 ILE HA 1 46 VAL QG . . 5.480 4.064 3.864 4.347 . 0 0 "[ . 1 . 2]" 1
13 1 2 ILE HA 1 49 ILE MD . . 4.460 2.669 2.033 3.056 . 0 0 "[ . 1 . 2]" 1
14 1 2 ILE HB 1 2 ILE MD . . 3.730 2.411 2.356 2.489 . 0 0 "[ . 1 . 2]" 1
15 1 2 ILE HB 1 2 ILE HG12 . . 2.800 2.478 2.424 2.563 . 0 0 "[ . 1 . 2]" 1
16 1 2 ILE HB 1 3 THR H . . 4.280 4.078 3.968 4.158 . 0 0 "[ . 1 . 2]" 1
17 1 2 ILE HB 1 3 THR MG . . 5.500 5.059 4.950 5.152 . 0 0 "[ . 1 . 2]" 1
18 1 2 ILE HB 1 5 ILE QG . . 5.340 5.253 4.790 5.365 0.025 3 0 "[ . 1 . 2]" 1
19 1 2 ILE HB 1 49 ILE MD . . 2.920 2.161 1.938 2.703 . 0 0 "[ . 1 . 2]" 1
20 1 2 ILE MD 1 5 ILE HB . . 5.500 2.895 2.423 3.421 . 0 0 "[ . 1 . 2]" 1
21 1 2 ILE MD 1 6 LEU H . . 5.500 3.320 2.817 3.767 . 0 0 "[ . 1 . 2]" 1
22 1 2 ILE MD 1 46 VAL H . . 5.500 4.438 4.084 4.598 . 0 0 "[ . 1 . 2]" 1
23 1 2 ILE MD 1 46 VAL HA . . 5.100 2.439 2.029 2.651 . 0 0 "[ . 1 . 2]" 1
24 1 2 ILE MD 1 46 VAL QG . . 3.990 1.662 1.608 1.716 . 0 0 "[ . 1 . 2]" 1
25 1 2 ILE HG12 1 6 LEU HB2 . . 4.600 3.402 3.178 3.711 . 0 0 "[ . 1 . 2]" 1
26 1 2 ILE HG12 1 46 VAL QG . . 4.150 2.870 2.323 3.273 . 0 0 "[ . 1 . 2]" 1
27 1 2 ILE HG12 1 49 ILE MD . . 5.330 3.434 2.925 3.792 . 0 0 "[ . 1 . 2]" 1
28 1 2 ILE HG13 1 2 ILE MG . . 3.710 2.339 2.281 2.460 . 0 0 "[ . 1 . 2]" 1
29 1 2 ILE HG13 1 3 THR H . . 4.530 4.074 3.902 4.297 . 0 0 "[ . 1 . 2]" 1
30 1 2 ILE HG13 1 3 THR MG . . 5.210 4.531 4.307 4.911 . 0 0 "[ . 1 . 2]" 1
31 1 2 ILE HG13 1 5 ILE QG . . 4.400 4.261 3.869 4.431 0.031 10 0 "[ . 1 . 2]" 1
32 1 2 ILE HG13 1 6 LEU H . . 4.060 2.954 2.720 3.206 . 0 0 "[ . 1 . 2]" 1
33 1 2 ILE HG13 1 6 LEU HB2 . . 4.400 2.179 1.999 2.407 . 0 0 "[ . 1 . 2]" 1
34 1 2 ILE HG13 1 6 LEU MD2 . . 3.940 2.984 2.805 3.274 . 0 0 "[ . 1 . 2]" 1
35 1 2 ILE HG13 1 11 ILE MD . . 4.220 3.244 2.923 3.833 . 0 0 "[ . 1 . 2]" 1
36 1 2 ILE HG13 1 46 VAL HA . . 5.500 5.322 4.850 5.525 0.025 15 0 "[ . 1 . 2]" 1
37 1 2 ILE HG13 1 46 VAL QG . . 4.180 3.394 3.043 3.497 . 0 0 "[ . 1 . 2]" 1
38 1 2 ILE HG13 1 49 ILE MD . . 5.390 3.984 3.784 4.185 . 0 0 "[ . 1 . 2]" 1
39 1 2 ILE MG 1 3 THR H . . 2.400 2.067 1.924 2.261 . 0 0 "[ . 1 . 2]" 1
40 1 2 ILE MG 1 3 THR MG . . 3.000 2.552 2.461 2.654 . 0 0 "[ . 1 . 2]" 1
41 1 2 ILE MG 1 4 ASP H . . 5.500 4.273 4.158 4.355 . 0 0 "[ . 1 . 2]" 1
42 1 2 ILE MG 1 6 LEU H . . 5.460 4.344 3.888 4.605 . 0 0 "[ . 1 . 2]" 1
43 1 2 ILE MG 1 49 ILE MD . . 5.500 3.494 3.172 4.047 . 0 0 "[ . 1 . 2]" 1
44 1 3 THR H 1 3 THR HB . . 3.860 3.616 3.610 3.618 . 0 0 "[ . 1 . 2]" 1
45 1 3 THR H 1 3 THR MG . . 3.300 2.280 2.078 2.446 . 0 0 "[ . 1 . 2]" 1
46 1 3 THR H 1 4 ASP H . . 3.460 2.707 2.586 2.748 . 0 0 "[ . 1 . 2]" 1
47 1 3 THR H 1 4 ASP HB2 . . 5.390 4.706 4.506 4.764 . 0 0 "[ . 1 . 2]" 1
48 1 3 THR H 1 5 ILE H . . 4.720 4.268 4.170 4.352 . 0 0 "[ . 1 . 2]" 1
49 1 3 THR H 1 6 LEU H . . 5.210 4.803 4.702 5.024 . 0 0 "[ . 1 . 2]" 1
50 1 3 THR H 1 6 LEU HB2 . . 5.390 5.281 5.075 5.407 0.017 8 0 "[ . 1 . 2]" 1
51 1 3 THR HA 1 5 ILE H . . 3.950 3.578 3.521 3.654 . 0 0 "[ . 1 . 2]" 1
52 1 3 THR HA 1 6 LEU H . . 3.630 3.320 3.236 3.596 . 0 0 "[ . 1 . 2]" 1
53 1 3 THR HA 1 8 ALA H . . 5.220 4.150 3.819 4.448 . 0 0 "[ . 1 . 2]" 1
54 1 3 THR MG 1 4 ASP H . . 4.970 4.014 3.904 4.063 . 0 0 "[ . 1 . 2]" 1
55 1 3 THR MG 1 6 LEU HB2 . . 5.270 4.962 4.907 5.006 . 0 0 "[ . 1 . 2]" 1
56 1 3 THR MG 1 6 LEU HB3 . . 5.500 5.022 4.913 5.131 . 0 0 "[ . 1 . 2]" 1
57 1 3 THR MG 1 8 ALA H . . 4.670 3.378 3.041 3.893 . 0 0 "[ . 1 . 2]" 1
58 1 3 THR MG 1 8 ALA HA . . 5.220 3.699 3.341 4.252 . 0 0 "[ . 1 . 2]" 1
59 1 4 ASP H 1 4 ASP HB2 . . 3.150 2.262 2.069 2.309 . 0 0 "[ . 1 . 2]" 1
60 1 4 ASP H 1 5 ILE H . . 2.850 2.658 2.613 2.716 . 0 0 "[ . 1 . 2]" 1
61 1 4 ASP H 1 5 ILE QG . . 3.880 3.705 3.619 3.812 . 0 0 "[ . 1 . 2]" 1
62 1 4 ASP HB2 1 5 ILE H . . 3.720 3.214 3.073 3.569 . 0 0 "[ . 1 . 2]" 1
63 1 4 ASP HB2 1 5 ILE MD . . 5.500 4.080 3.123 4.206 . 0 0 "[ . 1 . 2]" 1
64 1 4 ASP HB2 1 5 ILE QG . . 4.250 3.043 2.945 3.830 . 0 0 "[ . 1 . 2]" 1
65 1 4 ASP HB3 1 5 ILE H . . 3.840 3.765 3.281 3.860 0.020 6 0 "[ . 1 . 2]" 1
66 1 4 ASP HB3 1 5 ILE HG12 . . 4.640 3.467 3.281 3.557 . 0 0 "[ . 1 . 2]" 1
67 1 4 ASP HB3 1 5 ILE QG . . 3.850 3.251 3.179 3.358 . 0 0 "[ . 1 . 2]" 1
68 1 4 ASP HB3 1 5 ILE HG13 . . 4.640 3.960 3.778 4.611 . 0 0 "[ . 1 . 2]" 1
69 1 4 ASP HB3 1 5 ILE MG . . 5.500 5.054 4.812 5.116 . 0 0 "[ . 1 . 2]" 1
70 1 5 ILE H 1 5 ILE HB . . 3.340 2.955 2.916 2.984 . 0 0 "[ . 1 . 2]" 1
71 1 5 ILE H 1 5 ILE MD . . 5.180 3.766 2.964 3.881 . 0 0 "[ . 1 . 2]" 1
72 1 5 ILE H 1 5 ILE HG12 . . 3.810 3.060 2.079 3.233 . 0 0 "[ . 1 . 2]" 1
73 1 5 ILE H 1 5 ILE QG . . 3.280 2.174 2.068 2.228 . 0 0 "[ . 1 . 2]" 1
74 1 5 ILE H 1 5 ILE HG13 . . 3.810 2.373 2.156 3.693 . 0 0 "[ . 1 . 2]" 1
75 1 5 ILE H 1 6 LEU H . . 2.930 2.151 2.084 2.321 . 0 0 "[ . 1 . 2]" 1
76 1 5 ILE HA 1 5 ILE HG12 . . 3.860 2.877 2.798 3.425 . 0 0 "[ . 1 . 2]" 1
77 1 5 ILE HA 1 5 ILE QG . . 3.290 2.749 2.681 3.224 . 0 0 "[ . 1 . 2]" 1
78 1 5 ILE HA 1 5 ILE HG13 . . 3.860 3.495 3.428 3.930 0.070 8 0 "[ . 1 . 2]" 1
79 1 5 ILE HA 1 5 ILE MG . . 3.610 2.196 2.023 2.229 . 0 0 "[ . 1 . 2]" 1
80 1 5 ILE HA 1 42 GLN QG . . 5.340 5.366 5.336 5.432 0.092 1 0 "[ . 1 . 2]" 1
81 1 5 ILE HB 1 6 LEU H . . 3.590 2.428 2.206 2.497 . 0 0 "[ . 1 . 2]" 1
82 1 5 ILE HB 1 46 VAL QG . . 4.930 2.890 2.002 3.285 . 0 0 "[ . 1 . 2]" 1
83 1 5 ILE MD 1 42 GLN HB3 . . 5.280 3.281 2.395 4.241 . 0 0 "[ . 1 . 2]" 1
84 1 5 ILE MD 1 45 LYS HB2 . . 4.800 2.861 2.480 3.302 . 0 0 "[ . 1 . 2]" 1
85 1 5 ILE MD 1 45 LYS HB3 . . 4.030 2.453 1.982 3.038 . 0 0 "[ . 1 . 2]" 1
86 1 5 ILE MD 1 45 LYS QG . . 5.340 3.599 3.219 3.940 . 0 0 "[ . 1 . 2]" 1
87 1 5 ILE MD 1 46 VAL HA . . 5.500 3.593 3.185 4.551 . 0 0 "[ . 1 . 2]" 1
88 1 5 ILE QG 1 5 ILE MG . . 2.720 2.324 2.253 2.362 . 0 0 "[ . 1 . 2]" 1
89 1 5 ILE QG 1 6 LEU H . . 4.290 3.288 3.190 3.343 . 0 0 "[ . 1 . 2]" 1
90 1 5 ILE QG 1 45 LYS HB3 . . 5.340 4.301 2.818 5.021 . 0 0 "[ . 1 . 2]" 1
91 1 5 ILE MG 1 42 GLN HB2 . . 4.450 3.117 2.669 3.335 . 0 0 "[ . 1 . 2]" 1
92 1 5 ILE MG 1 42 GLN HB3 . . 3.960 1.966 1.862 2.189 . 0 0 "[ . 1 . 2]" 1
93 1 5 ILE MG 1 42 GLN QE . . 5.340 2.822 1.907 4.014 . 0 0 "[ . 1 . 2]" 1
94 1 5 ILE MG 1 42 GLN QG . . 4.560 3.046 2.830 3.575 . 0 0 "[ . 1 . 2]" 1
95 1 6 LEU H 1 6 LEU HB2 . . 2.700 2.182 2.086 2.224 . 0 0 "[ . 1 . 2]" 1
96 1 6 LEU H 1 6 LEU HB3 . . 4.120 3.410 3.348 3.467 . 0 0 "[ . 1 . 2]" 1
97 1 6 LEU H 1 6 LEU MD1 . . 4.530 2.706 2.537 2.822 . 0 0 "[ . 1 . 2]" 1
98 1 6 LEU H 1 6 LEU MD2 . . 5.500 3.963 3.834 4.022 . 0 0 "[ . 1 . 2]" 1
99 1 6 LEU H 1 6 LEU HG . . 4.640 4.462 4.350 4.532 . 0 0 "[ . 1 . 2]" 1
100 1 6 LEU H 1 7 SER H . . 4.550 4.478 4.439 4.523 . 0 0 "[ . 1 . 2]" 1
101 1 6 LEU H 1 11 ILE MD . . 4.980 4.181 3.956 4.326 . 0 0 "[ . 1 . 2]" 1
102 1 6 LEU HA 1 6 LEU MD1 . . 4.030 2.189 1.952 2.309 . 0 0 "[ . 1 . 2]" 1
103 1 6 LEU HA 1 7 SER H . . 3.100 2.619 2.580 2.674 . 0 0 "[ . 1 . 2]" 1
104 1 6 LEU HB2 1 6 LEU MD1 . . 3.350 2.450 2.400 2.561 . 0 0 "[ . 1 . 2]" 1
105 1 6 LEU HB2 1 7 SER H . . 3.810 3.603 3.491 3.670 . 0 0 "[ . 1 . 2]" 1
106 1 6 LEU HB2 1 11 ILE MD . . 2.700 2.658 2.524 2.702 0.002 4 0 "[ . 1 . 2]" 1
107 1 6 LEU HB3 1 7 SER H . . 3.100 2.079 1.936 2.168 . 0 0 "[ . 1 . 2]" 1
108 1 6 LEU MD1 1 7 SER H . . 5.500 3.927 3.766 4.009 . 0 0 "[ . 1 . 2]" 1
109 1 6 LEU MD1 1 35 LEU HA . . 3.500 2.832 2.326 3.100 . 0 0 "[ . 1 . 2]" 1
110 1 6 LEU MD1 1 38 LYS QE . . 3.910 2.666 2.302 3.464 . 0 0 "[ . 1 . 2]" 1
111 1 6 LEU MD1 1 38 LYS QG . . 3.940 2.696 2.392 2.888 . 0 0 "[ . 1 . 2]" 1
112 1 6 LEU MD2 1 7 SER H . . 5.050 3.875 3.787 4.064 . 0 0 "[ . 1 . 2]" 1
113 1 6 LEU MD2 1 33 VAL MG2 . . 3.660 1.951 1.808 2.314 . 0 0 "[ . 1 . 2]" 1
114 1 6 LEU MD2 1 35 LEU H . . 5.480 3.486 2.883 4.645 . 0 0 "[ . 1 . 2]" 1
115 1 6 LEU MD2 1 35 LEU HA . . 5.500 3.993 3.675 4.584 . 0 0 "[ . 1 . 2]" 1
116 1 6 LEU HG 1 7 SER H . . 4.420 3.001 2.815 3.166 . 0 0 "[ . 1 . 2]" 1
117 1 7 SER H 1 7 SER HB2 . . 3.240 2.428 2.401 2.511 . 0 0 "[ . 1 . 2]" 1
118 1 7 SER H 1 7 SER HB3 . . 3.710 3.498 3.365 3.703 . 0 0 "[ . 1 . 2]" 1
119 1 7 SER H 1 8 ALA H . . 4.600 4.357 4.298 4.398 . 0 0 "[ . 1 . 2]" 1
120 1 7 SER H 1 10 ASP H . . 4.610 4.231 4.045 4.448 . 0 0 "[ . 1 . 2]" 1
121 1 7 SER H 1 10 ASP QB . . 3.960 3.034 2.544 3.363 . 0 0 "[ . 1 . 2]" 1
122 1 7 SER H 1 11 ILE H . . 4.290 4.084 3.785 4.306 0.016 6 0 "[ . 1 . 2]" 1
123 1 7 SER H 1 11 ILE HA . . 5.500 5.282 5.018 5.486 . 0 0 "[ . 1 . 2]" 1
124 1 7 SER H 1 11 ILE MD . . 4.180 3.205 2.963 3.396 . 0 0 "[ . 1 . 2]" 1
125 1 7 SER H 1 11 ILE HG13 . . 3.110 2.985 2.724 3.128 0.018 6 0 "[ . 1 . 2]" 1
126 1 7 SER H 1 33 VAL HA . . 5.440 4.844 4.348 5.287 . 0 0 "[ . 1 . 2]" 1
127 1 7 SER H 1 33 VAL MG2 . . 4.120 3.172 2.861 3.459 . 0 0 "[ . 1 . 2]" 1
128 1 7 SER H 1 34 GLY HA3 . . 5.500 4.788 4.112 5.476 . 0 0 "[ . 1 . 2]" 1
129 1 7 SER HA 1 7 SER HB3 . . 2.820 2.733 2.549 2.824 0.004 1 0 "[ . 1 . 2]" 1
130 1 7 SER HA 1 8 ALA H . . 3.060 2.151 2.138 2.163 . 0 0 "[ . 1 . 2]" 1
131 1 7 SER HA 1 8 ALA MB . . 5.500 3.923 3.914 3.935 . 0 0 "[ . 1 . 2]" 1
132 1 7 SER HA 1 9 LYS H . . 4.730 3.729 3.541 4.181 . 0 0 "[ . 1 . 2]" 1
133 1 7 SER HA 1 10 ASP H . . 4.700 4.348 4.233 4.534 . 0 0 "[ . 1 . 2]" 1
134 1 7 SER HB2 1 8 ALA H . . 4.600 4.433 4.361 4.503 . 0 0 "[ . 1 . 2]" 1
135 1 7 SER HB2 1 9 LYS H . . 5.500 4.281 4.044 4.612 . 0 0 "[ . 1 . 2]" 1
136 1 7 SER HB2 1 10 ASP H . . 3.680 3.564 3.038 3.699 0.019 15 0 "[ . 1 . 2]" 1
137 1 7 SER HB2 1 10 ASP QB . . 2.390 2.361 2.045 2.440 0.050 8 0 "[ . 1 . 2]" 1
138 1 7 SER HB2 1 11 ILE H . . 4.710 4.485 4.071 4.726 0.016 14 0 "[ . 1 . 2]" 1
139 1 7 SER HB3 1 9 LYS H . . 3.300 2.662 2.440 3.037 . 0 0 "[ . 1 . 2]" 1
140 1 7 SER HB3 1 10 ASP H . . 3.710 2.610 2.249 2.995 . 0 0 "[ . 1 . 2]" 1
141 1 7 SER HB3 1 10 ASP QB . . 3.970 2.803 2.480 3.608 . 0 0 "[ . 1 . 2]" 1
142 1 7 SER HB3 1 11 ILE MD . . 5.500 4.746 4.586 4.971 . 0 0 "[ . 1 . 2]" 1
143 1 7 SER HB3 1 33 VAL MG2 . . 5.500 5.158 5.033 5.186 . 0 0 "[ . 1 . 2]" 1
144 1 8 ALA H 1 9 LYS H . . 3.810 2.655 2.599 2.857 . 0 0 "[ . 1 . 2]" 1
145 1 8 ALA H 1 9 LYS HB2 . . 5.500 4.660 4.549 4.887 . 0 0 "[ . 1 . 2]" 1
146 1 8 ALA H 1 9 LYS HB3 . . 5.500 5.362 5.160 5.493 . 0 0 "[ . 1 . 2]" 1
147 1 8 ALA H 1 10 ASP H . . 4.690 4.012 3.901 4.076 . 0 0 "[ . 1 . 2]" 1
148 1 8 ALA H 1 11 ILE HB . . 5.500 5.348 4.916 5.523 0.023 9 0 "[ . 1 . 2]" 1
149 1 8 ALA H 1 11 ILE MD . . 4.440 3.415 3.046 3.781 . 0 0 "[ . 1 . 2]" 1
150 1 8 ALA HA 1 11 ILE H . . 3.830 3.390 3.019 3.616 . 0 0 "[ . 1 . 2]" 1
151 1 8 ALA HA 1 11 ILE HB . . 3.510 2.889 2.366 3.161 . 0 0 "[ . 1 . 2]" 1
152 1 8 ALA HA 1 11 ILE MD . . 3.310 2.108 1.959 2.399 . 0 0 "[ . 1 . 2]" 1
153 1 8 ALA HA 1 11 ILE MG . . 5.500 4.259 3.874 4.479 . 0 0 "[ . 1 . 2]" 1
154 1 8 ALA HA 1 12 GLU H . . 5.500 4.030 3.433 4.465 . 0 0 "[ . 1 . 2]" 1
155 1 8 ALA HA 1 12 GLU QB . . 5.340 5.072 4.403 5.347 0.007 16 0 "[ . 1 . 2]" 1
156 1 8 ALA MB 1 9 LYS H . . 5.500 2.935 2.541 3.119 . 0 0 "[ . 1 . 2]" 1
157 1 9 LYS H 1 9 LYS HB2 . . 3.290 2.363 2.165 2.562 . 0 0 "[ . 1 . 2]" 1
158 1 9 LYS H 1 9 LYS QB . . 2.800 2.254 2.114 2.346 . 0 0 "[ . 1 . 2]" 1
159 1 9 LYS H 1 9 LYS HB3 . . 3.290 2.873 2.720 2.957 . 0 0 "[ . 1 . 2]" 1
160 1 9 LYS H 1 9 LYS HD2 . . 5.500 4.739 4.121 5.409 . 0 0 "[ . 1 . 2]" 1
161 1 9 LYS H 1 9 LYS HD3 . . 5.500 4.817 3.857 5.502 0.002 14 0 "[ . 1 . 2]" 1
162 1 9 LYS H 1 9 LYS HG2 . . 5.500 4.605 4.304 4.711 . 0 0 "[ . 1 . 2]" 1
163 1 9 LYS H 1 9 LYS HG3 . . 5.500 4.420 4.215 4.625 . 0 0 "[ . 1 . 2]" 1
164 1 9 LYS H 1 10 ASP H . . 3.450 2.402 2.226 2.650 . 0 0 "[ . 1 . 2]" 1
165 1 9 LYS HA 1 9 LYS HG2 . . 3.800 3.128 2.147 3.648 . 0 0 "[ . 1 . 2]" 1
166 1 9 LYS HA 1 9 LYS QG . . 3.200 2.316 2.103 2.634 . 0 0 "[ . 1 . 2]" 1
167 1 9 LYS HA 1 9 LYS HG3 . . 3.800 2.511 2.124 3.451 . 0 0 "[ . 1 . 2]" 1
168 1 9 LYS HA 1 10 ASP HA . . 4.760 4.547 4.486 4.598 . 0 0 "[ . 1 . 2]" 1
169 1 9 LYS QB 1 10 ASP H . . 3.680 3.285 3.056 3.473 . 0 0 "[ . 1 . 2]" 1
170 1 10 ASP H 1 10 ASP HB2 . . 3.830 2.535 2.246 2.691 . 0 0 "[ . 1 . 2]" 1
171 1 10 ASP H 1 10 ASP QB . . 3.120 2.490 2.215 2.638 . 0 0 "[ . 1 . 2]" 1
172 1 10 ASP H 1 10 ASP HB3 . . 3.830 3.648 3.069 3.794 . 0 0 "[ . 1 . 2]" 1
173 1 10 ASP H 1 11 ILE H . . 3.140 2.005 1.880 2.107 . 0 0 "[ . 1 . 2]" 1
174 1 10 ASP H 1 11 ILE HA . . 4.730 4.699 4.587 4.797 0.067 6 0 "[ . 1 . 2]" 1
175 1 10 ASP H 1 11 ILE HB . . 4.430 4.184 4.019 4.319 . 0 0 "[ . 1 . 2]" 1
176 1 10 ASP H 1 11 ILE MD . . 5.170 4.058 3.868 4.262 . 0 0 "[ . 1 . 2]" 1
177 1 10 ASP H 1 11 ILE HG13 . . 3.870 3.755 3.676 3.869 . 0 0 "[ . 1 . 2]" 1
178 1 10 ASP H 1 12 GLU H . . 4.230 3.924 3.720 4.059 . 0 0 "[ . 1 . 2]" 1
179 1 10 ASP H 1 13 SER H . . 4.900 4.420 4.165 4.730 . 0 0 "[ . 1 . 2]" 1
180 1 10 ASP H 1 13 SER QB . . 5.230 4.616 4.222 5.133 . 0 0 "[ . 1 . 2]" 1
181 1 10 ASP H 1 33 VAL HA . . 5.500 4.632 4.478 4.992 . 0 0 "[ . 1 . 2]" 1
182 1 10 ASP H 1 33 VAL MG2 . . 4.770 4.383 3.820 4.548 . 0 0 "[ . 1 . 2]" 1
183 1 10 ASP HA 1 12 GLU H . . 5.010 4.670 4.285 4.928 . 0 0 "[ . 1 . 2]" 1
184 1 10 ASP HA 1 13 SER H . . 3.770 3.427 3.244 3.719 . 0 0 "[ . 1 . 2]" 1
185 1 10 ASP HA 1 13 SER QB . . 2.770 2.448 2.188 2.790 0.020 11 0 "[ . 1 . 2]" 1
186 1 10 ASP HA 1 14 ALA MB . . 5.500 4.249 3.759 4.912 . 0 0 "[ . 1 . 2]" 1
187 1 10 ASP HA 1 33 VAL H . . 5.500 5.543 5.473 5.601 0.101 10 0 "[ . 1 . 2]" 1
188 1 10 ASP HA 1 33 VAL HA . . 5.500 3.531 3.221 3.861 . 0 0 "[ . 1 . 2]" 1
189 1 10 ASP QB 1 11 ILE H . . 3.550 2.793 2.714 3.003 . 0 0 "[ . 1 . 2]" 1
190 1 10 ASP QB 1 13 SER H . . 5.340 4.766 4.597 5.104 . 0 0 "[ . 1 . 2]" 1
191 1 10 ASP QB 1 33 VAL H . . 4.520 4.138 3.884 4.567 0.047 14 0 "[ . 1 . 2]" 1
192 1 10 ASP QB 1 33 VAL HA . . 3.430 1.942 1.905 1.986 . 0 0 "[ . 1 . 2]" 1
193 1 10 ASP QB 1 33 VAL HB . . 5.340 3.934 3.442 4.119 . 0 0 "[ . 1 . 2]" 1
194 1 10 ASP QB 1 33 VAL MG2 . . 3.580 2.772 1.927 3.162 . 0 0 "[ . 1 . 2]" 1
195 1 10 ASP QB 1 34 GLY H . . 5.000 4.316 3.953 4.779 . 0 0 "[ . 1 . 2]" 1
196 1 10 ASP HB2 1 11 ILE H . . 4.320 2.925 2.774 3.493 . 0 0 "[ . 1 . 2]" 1
197 1 10 ASP HB2 1 33 VAL HA . . 4.090 2.886 2.528 3.655 . 0 0 "[ . 1 . 2]" 1
198 1 10 ASP HB2 1 33 VAL MG2 . . 4.100 3.134 2.547 3.875 . 0 0 "[ . 1 . 2]" 1
199 1 10 ASP HB3 1 11 ILE H . . 4.320 3.758 2.961 4.072 . 0 0 "[ . 1 . 2]" 1
200 1 10 ASP HB3 1 33 VAL HA . . 4.090 1.982 1.964 2.010 . 0 0 "[ . 1 . 2]" 1
201 1 10 ASP HB3 1 33 VAL MG2 . . 4.100 3.319 1.946 3.797 . 0 0 "[ . 1 . 2]" 1
202 1 11 ILE H 1 11 ILE HB . . 2.550 2.496 2.460 2.537 . 0 0 "[ . 1 . 2]" 1
203 1 11 ILE H 1 11 ILE MD . . 3.980 3.133 3.013 3.252 . 0 0 "[ . 1 . 2]" 1
204 1 11 ILE H 1 11 ILE HG13 . . 2.550 2.233 2.116 2.397 . 0 0 "[ . 1 . 2]" 1
205 1 11 ILE H 1 12 GLU H . . 3.320 2.746 2.573 2.935 . 0 0 "[ . 1 . 2]" 1
206 1 11 ILE H 1 12 GLU QB . . 5.010 4.744 4.487 4.991 . 0 0 "[ . 1 . 2]" 1
207 1 11 ILE H 1 13 SER H . . 4.060 3.780 3.626 3.967 . 0 0 "[ . 1 . 2]" 1
208 1 11 ILE H 1 33 VAL HA . . 4.690 3.865 3.576 4.556 . 0 0 "[ . 1 . 2]" 1
209 1 11 ILE H 1 33 VAL MG2 . . 4.180 3.165 2.807 3.340 . 0 0 "[ . 1 . 2]" 1
210 1 11 ILE HA 1 11 ILE HG13 . . 2.850 2.669 2.612 2.734 . 0 0 "[ . 1 . 2]" 1
211 1 11 ILE HA 1 12 GLU HA . . 5.500 4.735 4.678 4.812 . 0 0 "[ . 1 . 2]" 1
212 1 11 ILE HA 1 13 SER H . . 4.750 4.151 3.990 4.324 . 0 0 "[ . 1 . 2]" 1
213 1 11 ILE HA 1 14 ALA H . . 4.150 3.750 3.507 4.000 . 0 0 "[ . 1 . 2]" 1
214 1 11 ILE HA 1 14 ALA MB . . 4.800 2.998 2.647 3.226 . 0 0 "[ . 1 . 2]" 1
215 1 11 ILE HA 1 15 LEU H . . 4.990 4.642 4.017 5.001 0.011 12 0 "[ . 1 . 2]" 1
216 1 11 ILE HA 1 15 LEU HG . . 4.620 4.403 3.899 4.643 0.023 11 0 "[ . 1 . 2]" 1
217 1 11 ILE HA 1 33 VAL H . . 5.130 4.702 4.442 5.137 0.007 6 0 "[ . 1 . 2]" 1
218 1 11 ILE HA 1 33 VAL HB . . 5.500 2.303 2.010 2.683 . 0 0 "[ . 1 . 2]" 1
219 1 11 ILE HA 1 33 VAL MG1 . . 5.500 3.782 3.464 3.998 . 0 0 "[ . 1 . 2]" 1
220 1 11 ILE HA 1 33 VAL MG2 . . 3.520 2.132 2.013 2.528 . 0 0 "[ . 1 . 2]" 1
221 1 11 ILE HB 1 12 GLU H . . 3.390 2.392 2.172 2.664 . 0 0 "[ . 1 . 2]" 1
222 1 11 ILE HB 1 12 GLU QB . . 4.500 4.158 3.775 4.518 0.018 6 0 "[ . 1 . 2]" 1
223 1 11 ILE MD 1 12 GLU H . . 5.500 4.182 4.028 4.379 . 0 0 "[ . 1 . 2]" 1
224 1 11 ILE MD 1 70 PHE HD2 . . 5.500 4.728 4.299 5.014 . 0 0 "[ . 1 . 2]" 1
225 1 11 ILE HG12 1 33 VAL MG2 . . 3.060 2.046 1.926 2.455 . 0 0 "[ . 1 . 2]" 1
226 1 11 ILE HG13 1 33 VAL MG2 . . 3.360 2.053 1.933 2.359 . 0 0 "[ . 1 . 2]" 1
227 1 11 ILE MG 1 12 GLU H . . 3.620 3.163 2.891 3.408 . 0 0 "[ . 1 . 2]" 1
228 1 11 ILE MG 1 12 GLU HA . . 3.480 3.296 3.098 3.369 . 0 0 "[ . 1 . 2]" 1
229 1 11 ILE MG 1 12 GLU QB . . 5.220 4.143 3.607 4.549 . 0 0 "[ . 1 . 2]" 1
230 1 11 ILE MG 1 15 LEU H . . 5.500 4.433 3.980 4.799 . 0 0 "[ . 1 . 2]" 1
231 1 12 GLU H 1 12 GLU QB . . 2.990 2.372 2.175 2.613 . 0 0 "[ . 1 . 2]" 1
232 1 12 GLU H 1 12 GLU QG . . 3.360 2.401 1.923 2.897 . 0 0 "[ . 1 . 2]" 1
233 1 12 GLU H 1 13 SER QB . . 4.900 4.443 4.165 4.767 . 0 0 "[ . 1 . 2]" 1
234 1 12 GLU H 1 15 LEU H . . 5.330 4.942 4.597 5.147 . 0 0 "[ . 1 . 2]" 1
235 1 12 GLU HA 1 12 GLU QG . . 3.480 2.847 2.220 3.436 . 0 0 "[ . 1 . 2]" 1
236 1 12 GLU HA 1 14 ALA H . . 3.700 3.575 3.433 3.731 0.031 6 0 "[ . 1 . 2]" 1
237 1 12 GLU HA 1 15 LEU H . . 3.840 3.350 3.182 3.457 . 0 0 "[ . 1 . 2]" 1
238 1 12 GLU HA 1 15 LEU HB2 . . 3.600 2.720 2.335 3.068 . 0 0 "[ . 1 . 2]" 1
239 1 12 GLU HA 1 15 LEU MD1 . . 4.320 2.447 1.971 3.244 . 0 0 "[ . 1 . 2]" 1
240 1 12 GLU HA 1 15 LEU HG . . 4.220 3.535 3.150 4.129 . 0 0 "[ . 1 . 2]" 1
241 1 12 GLU HB2 1 13 SER HA . . 5.500 4.657 4.236 4.894 . 0 0 "[ . 1 . 2]" 1
242 1 12 GLU HB2 1 14 ALA H . . 5.500 5.042 4.754 5.357 . 0 0 "[ . 1 . 2]" 1
243 1 12 GLU HB2 1 15 LEU HB2 . . 5.500 5.059 4.294 5.526 0.026 6 0 "[ . 1 . 2]" 1
244 1 12 GLU HB3 1 13 SER HA . . 5.500 4.997 4.228 5.648 0.148 11 0 "[ . 1 . 2]" 1
245 1 12 GLU HB3 1 14 ALA H . . 5.500 5.208 4.920 5.416 . 0 0 "[ . 1 . 2]" 1
246 1 12 GLU HB3 1 15 LEU HB2 . . 5.500 4.894 4.320 5.507 0.007 2 0 "[ . 1 . 2]" 1
247 1 12 GLU QG 1 13 SER H . . 5.120 3.337 2.161 4.488 . 0 0 "[ . 1 . 2]" 1
248 1 13 SER H 1 13 SER HB2 . . 3.630 2.552 2.275 3.546 . 0 0 "[ . 1 . 2]" 1
249 1 13 SER H 1 13 SER QB . . 3.070 2.337 2.239 2.549 . 0 0 "[ . 1 . 2]" 1
250 1 13 SER H 1 13 SER HB3 . . 3.630 3.064 2.264 3.641 0.011 3 0 "[ . 1 . 2]" 1
251 1 13 SER H 1 14 ALA H . . 3.350 2.481 2.342 2.574 . 0 0 "[ . 1 . 2]" 1
252 1 13 SER H 1 14 ALA MB . . 4.660 3.996 3.853 4.102 . 0 0 "[ . 1 . 2]" 1
253 1 13 SER H 1 15 LEU H . . 4.180 4.009 3.789 4.186 0.006 11 0 "[ . 1 . 2]" 1
254 1 13 SER H 1 33 VAL HB . . 5.500 5.377 5.061 5.524 0.024 13 0 "[ . 1 . 2]" 1
255 1 13 SER HA 1 14 ALA H . . 3.320 3.250 3.151 3.353 0.033 6 0 "[ . 1 . 2]" 1
256 1 13 SER HA 1 16 SER H . . 5.500 4.649 3.721 5.075 . 0 0 "[ . 1 . 2]" 1
257 1 14 ALA H 1 14 ALA MB . . 3.450 2.488 2.355 2.623 . 0 0 "[ . 1 . 2]" 1
258 1 14 ALA H 1 15 LEU H . . 2.890 1.931 1.850 2.158 . 0 0 "[ . 1 . 2]" 1
259 1 14 ALA H 1 15 LEU HG . . 4.360 4.226 3.887 4.375 0.015 4 0 "[ . 1 . 2]" 1
260 1 14 ALA H 1 16 SER H . . 4.430 4.242 3.761 4.452 0.022 4 0 "[ . 1 . 2]" 1
261 1 14 ALA H 1 17 SER H . . 5.120 4.760 4.114 5.157 0.037 4 0 "[ . 1 . 2]" 1
262 1 14 ALA H 1 33 VAL HB . . 4.620 4.226 4.059 4.398 . 0 0 "[ . 1 . 2]" 1
263 1 14 ALA HA 1 17 SER H . . 3.900 3.563 2.893 3.909 0.009 18 0 "[ . 1 . 2]" 1
264 1 14 ALA HA 1 17 SER QB . . 3.870 2.185 1.875 2.647 . 0 0 "[ . 1 . 2]" 1
265 1 14 ALA HA 1 18 CYS H . . 5.070 4.315 3.374 5.053 . 0 0 "[ . 1 . 2]" 1
266 1 14 ALA HA 1 33 VAL H . . 5.500 4.369 3.983 4.566 . 0 0 "[ . 1 . 2]" 1
267 1 14 ALA HA 1 33 VAL MG1 . . 5.500 5.052 4.731 5.160 . 0 0 "[ . 1 . 2]" 1
268 1 14 ALA MB 1 15 LEU H . . 4.360 3.085 2.667 3.423 . 0 0 "[ . 1 . 2]" 1
269 1 14 ALA MB 1 15 LEU HA . . 5.500 3.917 3.752 4.044 . 0 0 "[ . 1 . 2]" 1
270 1 14 ALA MB 1 15 LEU HG . . 5.010 4.086 3.518 4.369 . 0 0 "[ . 1 . 2]" 1
271 1 14 ALA MB 1 17 SER QB . . 5.340 3.596 2.921 4.030 . 0 0 "[ . 1 . 2]" 1
272 1 14 ALA MB 1 32 THR HA . . 5.050 2.915 2.319 3.752 . 0 0 "[ . 1 . 2]" 1
273 1 14 ALA MB 1 33 VAL H . . 2.960 2.133 1.899 2.464 . 0 0 "[ . 1 . 2]" 1
274 1 14 ALA MB 1 33 VAL HA . . 4.160 2.876 2.572 3.227 . 0 0 "[ . 1 . 2]" 1
275 1 14 ALA MB 1 33 VAL HB . . 3.570 2.030 1.894 2.517 . 0 0 "[ . 1 . 2]" 1
276 1 14 ALA MB 1 34 GLY H . . 5.500 4.346 4.123 4.625 . 0 0 "[ . 1 . 2]" 1
277 1 15 LEU H 1 15 LEU HB2 . . 3.470 2.190 2.121 2.385 . 0 0 "[ . 1 . 2]" 1
278 1 15 LEU H 1 15 LEU HB3 . . 3.730 3.485 3.419 3.579 . 0 0 "[ . 1 . 2]" 1
279 1 15 LEU H 1 15 LEU MD1 . . 4.780 3.719 3.210 3.985 . 0 0 "[ . 1 . 2]" 1
280 1 15 LEU H 1 15 LEU MD2 . . 5.500 4.008 3.806 4.222 . 0 0 "[ . 1 . 2]" 1
281 1 15 LEU H 1 15 LEU HG . . 3.270 3.030 2.559 3.312 0.042 15 0 "[ . 1 . 2]" 1
282 1 15 LEU H 1 16 SER H . . 3.270 2.759 2.340 3.150 . 0 0 "[ . 1 . 2]" 1
283 1 15 LEU H 1 17 SER H . . 4.490 3.716 3.139 4.329 . 0 0 "[ . 1 . 2]" 1
284 1 15 LEU HA 1 15 LEU MD2 . . 3.520 2.203 1.979 2.515 . 0 0 "[ . 1 . 2]" 1
285 1 15 LEU HA 1 15 LEU HG . . 4.170 2.697 2.525 2.910 . 0 0 "[ . 1 . 2]" 1
286 1 15 LEU HA 1 18 CYS H . . 5.280 4.805 3.626 5.322 0.042 10 0 "[ . 1 . 2]" 1
287 1 15 LEU HB2 1 15 LEU MD1 . . 2.550 2.225 1.988 2.381 . 0 0 "[ . 1 . 2]" 1
288 1 15 LEU HB2 1 16 SER H . . 3.000 2.515 2.322 2.945 . 0 0 "[ . 1 . 2]" 1
289 1 15 LEU HB3 1 15 LEU MD2 . . 2.630 2.239 2.076 2.359 . 0 0 "[ . 1 . 2]" 1
290 1 15 LEU HB3 1 16 SER H . . 3.530 2.871 2.489 3.493 . 0 0 "[ . 1 . 2]" 1
291 1 15 LEU HB3 1 16 SER HA . . 4.460 4.121 3.966 4.329 . 0 0 "[ . 1 . 2]" 1
292 1 15 LEU HB3 1 17 SER H . . 5.500 4.843 4.617 5.202 . 0 0 "[ . 1 . 2]" 1
293 1 15 LEU MD1 1 70 PHE HB2 . . 4.550 2.995 2.284 3.899 . 0 0 "[ . 1 . 2]" 1
294 1 15 LEU MD1 1 70 PHE HB3 . . 4.700 2.325 1.968 3.143 . 0 0 "[ . 1 . 2]" 1
295 1 15 LEU MD1 1 71 SER H . . 4.140 3.225 2.622 3.979 . 0 0 "[ . 1 . 2]" 1
296 1 15 LEU MD1 1 71 SER QB . . 4.670 2.220 1.878 2.898 . 0 0 "[ . 1 . 2]" 1
297 1 15 LEU MD2 1 67 LEU HA . . 4.940 3.728 2.748 4.399 . 0 0 "[ . 1 . 2]" 1
298 1 15 LEU MD2 1 70 PHE HB2 . . 3.850 2.261 1.980 2.954 . 0 0 "[ . 1 . 2]" 1
299 1 15 LEU MD2 1 70 PHE HD1 . . 5.500 4.113 3.813 4.553 . 0 0 "[ . 1 . 2]" 1
300 1 15 LEU MD2 1 70 PHE HD2 . . 4.810 3.191 2.078 3.610 . 0 0 "[ . 1 . 2]" 1
301 1 15 LEU MD2 1 71 SER H . . 5.500 3.412 2.646 4.622 . 0 0 "[ . 1 . 2]" 1
302 1 15 LEU MD2 1 71 SER QB . . 5.040 2.809 2.023 4.482 . 0 0 "[ . 1 . 2]" 1
303 1 16 SER H 1 16 SER HB2 . . 3.370 2.858 2.236 3.654 0.284 20 0 "[ . 1 . 2]" 1
304 1 16 SER H 1 16 SER QB . . 2.860 2.504 2.068 2.995 0.135 11 0 "[ . 1 . 2]" 1
305 1 16 SER H 1 16 SER HB3 . . 3.370 3.051 2.095 3.549 0.179 4 0 "[ . 1 . 2]" 1
306 1 16 SER H 1 17 SER H . . 3.250 2.643 1.864 3.178 . 0 0 "[ . 1 . 2]" 1
307 1 16 SER H 1 17 SER HA . . 5.080 4.810 4.449 5.099 0.019 18 0 "[ . 1 . 2]" 1
308 1 16 SER H 1 18 CYS H . . 5.060 4.698 3.765 5.073 0.013 19 0 "[ . 1 . 2]" 1
309 1 16 SER HA 1 17 SER QB . . 5.340 4.977 4.667 5.350 0.010 6 0 "[ . 1 . 2]" 1
310 1 16 SER HA 1 19 GLN H . . 4.470 3.893 3.235 4.373 . 0 0 "[ . 1 . 2]" 1
311 1 16 SER HA 1 19 GLN QB . . 4.530 2.909 1.980 3.912 . 0 0 "[ . 1 . 2]" 1
312 1 16 SER HA 1 19 GLN HG2 . . 2.880 2.475 1.978 2.887 0.007 2 0 "[ . 1 . 2]" 1
313 1 16 SER HA 1 19 GLN QG . . 2.390 2.072 1.923 2.386 . 0 0 "[ . 1 . 2]" 1
314 1 16 SER HA 1 19 GLN HG3 . . 2.880 2.383 1.992 2.882 0.002 18 0 "[ . 1 . 2]" 1
315 1 16 SER QB 1 19 GLN H . . 5.340 5.099 4.277 5.442 0.102 4 0 "[ . 1 . 2]" 1
316 1 16 SER QB 1 19 GLN QG . . 4.760 3.547 2.662 4.224 . 0 0 "[ . 1 . 2]" 1
317 1 16 SER HB2 1 17 SER H . . 5.410 4.239 3.865 4.564 . 0 0 "[ . 1 . 2]" 1
318 1 16 SER HB3 1 17 SER H . . 5.410 4.147 2.978 4.672 . 0 0 "[ . 1 . 2]" 1
319 1 17 SER H 1 17 SER QB . . 2.840 2.256 2.053 2.584 . 0 0 "[ . 1 . 2]" 1
320 1 17 SER H 1 18 CYS H . . 3.120 2.351 1.879 2.887 . 0 0 "[ . 1 . 2]" 1
321 1 17 SER HA 1 19 GLN H . . 4.530 4.005 3.776 4.455 . 0 0 "[ . 1 . 2]" 1
322 1 17 SER QB 1 18 CYS H . . 2.970 2.850 2.490 3.214 0.244 20 0 "[ . 1 . 2]" 1
323 1 17 SER HB2 1 18 CYS HA . . 5.500 5.147 4.657 5.521 0.021 10 0 "[ . 1 . 2]" 1
324 1 17 SER HB2 1 19 GLN H . . 5.500 5.405 4.754 5.667 0.167 4 0 "[ . 1 . 2]" 1
325 1 17 SER HB3 1 18 CYS HA . . 5.500 4.589 4.049 5.281 . 0 0 "[ . 1 . 2]" 1
326 1 17 SER HB3 1 19 GLN H . . 5.500 5.280 4.609 5.532 0.032 6 0 "[ . 1 . 2]" 1
327 1 18 CYS H 1 18 CYS HB2 . . 4.080 3.114 2.575 3.817 . 0 0 "[ . 1 . 2]" 1
328 1 18 CYS H 1 18 CYS QB . . 3.400 2.714 2.530 3.024 . 0 0 "[ . 1 . 2]" 1
329 1 18 CYS H 1 18 CYS HB3 . . 4.080 3.387 2.766 3.846 . 0 0 "[ . 1 . 2]" 1
330 1 18 CYS H 1 19 GLN H . . 3.130 2.837 2.350 3.178 0.048 11 0 "[ . 1 . 2]" 1
331 1 18 CYS H 1 19 GLN HA . . 5.500 4.781 4.490 5.111 . 0 0 "[ . 1 . 2]" 1
332 1 18 CYS H 1 19 GLN QG . . 3.940 3.309 2.718 3.946 0.006 7 0 "[ . 1 . 2]" 1
333 1 18 CYS H 1 20 ALA H . . 5.050 4.804 4.255 5.092 0.042 19 0 "[ . 1 . 2]" 1
334 1 18 CYS H 1 23 SER QB . . 5.340 4.817 4.279 5.377 0.037 12 0 "[ . 1 . 2]" 1
335 1 18 CYS HA 1 20 ALA H . . 4.260 3.447 3.132 3.836 . 0 0 "[ . 1 . 2]" 1
336 1 18 CYS HA 1 20 ALA MB . . 5.500 4.684 4.328 4.819 . 0 0 "[ . 1 . 2]" 1
337 1 18 CYS HA 1 23 SER H . . 5.240 4.741 3.927 5.262 0.022 9 0 "[ . 1 . 2]" 1
338 1 18 CYS HA 1 23 SER HB2 . . 4.760 4.635 3.757 4.794 0.034 2 0 "[ . 1 . 2]" 1
339 1 18 CYS HA 1 23 SER QB . . 4.070 3.118 2.978 3.771 . 0 0 "[ . 1 . 2]" 1
340 1 18 CYS HA 1 23 SER HB3 . . 4.760 3.272 3.009 4.788 0.028 4 0 "[ . 1 . 2]" 1
341 1 18 CYS HA 1 24 PHE HA . . 5.500 3.544 2.711 4.267 . 0 0 "[ . 1 . 2]" 1
342 1 18 CYS QB 1 19 GLN QG . . 5.160 4.464 3.354 5.174 0.014 18 0 "[ . 1 . 2]" 1
343 1 18 CYS HB2 1 19 GLN H . . 4.790 4.319 4.059 4.623 . 0 0 "[ . 1 . 2]" 1
344 1 18 CYS HB3 1 19 GLN H . . 4.790 4.522 4.283 4.655 . 0 0 "[ . 1 . 2]" 1
345 1 19 GLN H 1 19 GLN QB . . 3.550 2.671 2.273 3.056 . 0 0 "[ . 1 . 2]" 1
346 1 19 GLN H 1 19 GLN QE . . 5.000 4.181 2.211 5.003 0.003 15 0 "[ . 1 . 2]" 1
347 1 19 GLN H 1 19 GLN QG . . 3.250 2.592 1.936 3.306 0.056 17 0 "[ . 1 . 2]" 1
348 1 19 GLN H 1 20 ALA H . . 3.470 2.197 1.885 2.526 . 0 0 "[ . 1 . 2]" 1
349 1 19 GLN H 1 20 ALA MB . . 5.500 3.607 3.297 3.759 . 0 0 "[ . 1 . 2]" 1
350 1 19 GLN H 1 23 SER H . . 5.500 5.414 5.001 5.624 0.124 4 0 "[ . 1 . 2]" 1
351 1 19 GLN H 1 24 PHE H . . 5.500 5.218 4.784 5.542 0.042 19 0 "[ . 1 . 2]" 1
352 1 19 GLN QG 1 20 ALA H . . 4.470 4.089 2.400 4.520 0.050 14 0 "[ . 1 . 2]" 1
353 1 20 ALA H 1 21 ALA H . . 4.720 4.374 3.782 4.609 . 0 0 "[ . 1 . 2]" 1
354 1 20 ALA H 1 23 SER H . . 4.820 3.946 3.275 4.486 . 0 0 "[ . 1 . 2]" 1
355 1 20 ALA H 1 23 SER HA . . 5.500 5.480 5.275 5.615 0.115 3 0 "[ . 1 . 2]" 1
356 1 20 ALA H 1 23 SER QB . . 4.420 2.661 2.349 3.477 . 0 0 "[ . 1 . 2]" 1
357 1 20 ALA HA 1 21 ALA H . . 2.930 2.585 2.275 2.741 . 0 0 "[ . 1 . 2]" 1
358 1 20 ALA HA 1 21 ALA HA . . 5.500 4.362 4.308 4.542 . 0 0 "[ . 1 . 2]" 1
359 1 20 ALA HA 1 21 ALA MB . . 4.660 4.062 3.710 4.266 . 0 0 "[ . 1 . 2]" 1
360 1 20 ALA HA 1 22 ASP H . . 5.100 4.396 3.918 5.184 0.084 10 0 "[ . 1 . 2]" 1
361 1 20 ALA HA 1 23 SER H . . 5.500 4.961 4.411 5.364 . 0 0 "[ . 1 . 2]" 1
362 1 20 ALA HA 1 23 SER QB . . 4.880 4.191 4.052 4.441 . 0 0 "[ . 1 . 2]" 1
363 1 20 ALA MB 1 23 SER H . . 4.940 2.706 1.928 3.379 . 0 0 "[ . 1 . 2]" 1
364 1 20 ALA MB 1 23 SER HA . . 5.500 3.768 3.551 4.343 . 0 0 "[ . 1 . 2]" 1
365 1 20 ALA MB 1 23 SER HB2 . . 4.360 1.971 1.863 3.010 . 0 0 "[ . 1 . 2]" 1
366 1 20 ALA MB 1 23 SER QB . . 3.650 1.869 1.818 2.131 . 0 0 "[ . 1 . 2]" 1
367 1 20 ALA MB 1 23 SER HB3 . . 4.360 2.620 1.850 3.033 . 0 0 "[ . 1 . 2]" 1
368 1 21 ALA H 1 21 ALA MB . . 3.090 2.284 2.051 2.882 . 0 0 "[ . 1 . 2]" 1
369 1 21 ALA H 1 22 ASP H . . 4.540 2.470 2.129 4.162 . 0 0 "[ . 1 . 2]" 1
370 1 21 ALA HA 1 22 ASP H . . 3.570 3.332 2.245 3.571 0.001 11 0 "[ . 1 . 2]" 1
371 1 21 ALA HA 1 22 ASP HA . . 4.940 4.543 4.445 4.800 . 0 0 "[ . 1 . 2]" 1
372 1 21 ALA HA 1 22 ASP QB . . 5.340 4.831 3.736 5.315 . 0 0 "[ . 1 . 2]" 1
373 1 21 ALA HA 1 23 SER H . . 4.560 4.409 3.993 4.628 0.068 12 0 "[ . 1 . 2]" 1
374 1 21 ALA MB 1 22 ASP H . . 3.800 3.007 2.372 3.660 . 0 0 "[ . 1 . 2]" 1
375 1 21 ALA MB 1 22 ASP QB . . 4.130 3.543 3.201 3.872 . 0 0 "[ . 1 . 2]" 1
376 1 22 ASP H 1 22 ASP HB2 . . 4.160 3.225 2.416 3.878 . 0 0 "[ . 1 . 2]" 1
377 1 22 ASP H 1 22 ASP QB . . 3.460 2.854 2.382 3.288 . 0 0 "[ . 1 . 2]" 1
378 1 22 ASP H 1 22 ASP HB3 . . 4.160 3.333 2.570 4.017 . 0 0 "[ . 1 . 2]" 1
379 1 22 ASP H 1 23 SER H . . 3.460 2.529 1.964 3.035 . 0 0 "[ . 1 . 2]" 1
380 1 22 ASP H 1 23 SER HB2 . . 5.260 4.105 3.678 5.278 0.018 10 0 "[ . 1 . 2]" 1
381 1 22 ASP H 1 23 SER HB3 . . 5.260 4.574 3.576 5.282 0.022 9 0 "[ . 1 . 2]" 1
382 1 22 ASP H 1 24 PHE H . . 4.920 4.564 3.891 4.974 0.054 12 0 "[ . 1 . 2]" 1
383 1 22 ASP HA 1 24 PHE H . . 4.240 3.889 3.435 4.268 0.028 7 0 "[ . 1 . 2]" 1
384 1 22 ASP HB2 1 23 SER H . . 5.500 4.399 3.960 4.649 . 0 0 "[ . 1 . 2]" 1
385 1 22 ASP HB3 1 23 SER H . . 5.500 4.280 3.380 4.661 . 0 0 "[ . 1 . 2]" 1
386 1 23 SER H 1 23 SER HB2 . . 3.720 2.805 2.259 3.783 0.063 4 0 "[ . 1 . 2]" 1
387 1 23 SER H 1 23 SER HB3 . . 3.720 2.722 2.284 3.724 0.004 9 0 "[ . 1 . 2]" 1
388 1 23 SER H 1 24 PHE H . . 3.440 2.226 1.880 3.035 . 0 0 "[ . 1 . 2]" 1
389 1 23 SER H 1 24 PHE HA . . 5.500 4.877 4.569 5.289 . 0 0 "[ . 1 . 2]" 1
390 1 23 SER H 1 25 ASN H . . 5.500 5.568 5.415 5.754 0.254 10 0 "[ . 1 . 2]" 1
391 1 24 PHE H 1 24 PHE HB2 . . 3.480 2.676 2.156 2.919 . 0 0 "[ . 1 . 2]" 1
392 1 24 PHE H 1 24 PHE QB . . 2.950 2.315 2.109 2.811 . 0 0 "[ . 1 . 2]" 1
393 1 24 PHE H 1 24 PHE HB3 . . 3.480 2.674 2.392 3.750 0.270 18 0 "[ . 1 . 2]" 1
394 1 24 PHE H 1 24 PHE HD1 . . 5.500 4.739 4.540 4.915 . 0 0 "[ . 1 . 2]" 1
395 1 24 PHE H 1 24 PHE HD2 . . 5.300 4.680 4.191 4.899 . 0 0 "[ . 1 . 2]" 1
396 1 24 PHE H 1 25 ASN H . . 4.460 3.916 3.021 4.239 . 0 0 "[ . 1 . 2]" 1
397 1 24 PHE HA 1 24 PHE HE1 . . 4.770 4.585 4.472 4.763 . 0 0 "[ . 1 . 2]" 1
398 1 24 PHE HA 1 25 ASN H . . 2.970 2.322 2.210 2.615 . 0 0 "[ . 1 . 2]" 1
399 1 24 PHE QB 1 24 PHE HD2 . . 3.220 2.261 2.250 2.273 . 0 0 "[ . 1 . 2]" 1
400 1 24 PHE QB 1 25 ASN HA . . 5.240 4.623 4.388 4.800 . 0 0 "[ . 1 . 2]" 1
401 1 24 PHE HD1 1 25 ASN H . . 4.200 3.615 3.098 3.948 . 0 0 "[ . 1 . 2]" 1
402 1 24 PHE HD1 1 25 ASN HA . . 5.390 4.893 4.019 5.398 0.008 19 0 "[ . 1 . 2]" 1
403 1 24 PHE HD1 1 29 PHE H . . 5.130 4.236 3.298 4.642 . 0 0 "[ . 1 . 2]" 1
404 1 24 PHE HD1 1 29 PHE HA . . 5.500 4.752 3.835 5.507 0.007 13 0 "[ . 1 . 2]" 1
405 1 24 PHE HE1 1 29 PHE HB2 . . 3.930 2.570 1.993 3.186 . 0 0 "[ . 1 . 2]" 1
406 1 24 PHE HE1 1 29 PHE HB3 . . 5.330 4.177 3.443 4.935 . 0 0 "[ . 1 . 2]" 1
407 1 25 ASN H 1 25 ASN HB2 . . 3.780 3.216 2.338 3.865 0.085 7 0 "[ . 1 . 2]" 1
408 1 25 ASN H 1 25 ASN QB . . 3.310 2.620 2.234 3.067 . 0 0 "[ . 1 . 2]" 1
409 1 25 ASN H 1 25 ASN HB3 . . 3.780 2.851 2.486 3.401 . 0 0 "[ . 1 . 2]" 1
410 1 25 ASN H 1 26 TYR H . . 4.630 4.495 4.390 4.609 . 0 0 "[ . 1 . 2]" 1
411 1 25 ASN H 1 27 LYS H . . 4.970 4.498 4.131 5.022 0.052 12 0 "[ . 1 . 2]" 1
412 1 25 ASN H 1 28 SER QB . . 2.680 2.260 1.823 2.714 0.034 12 0 "[ . 1 . 2]" 1
413 1 25 ASN H 1 29 PHE H . . 4.830 4.531 3.779 4.867 0.037 12 0 "[ . 1 . 2]" 1
414 1 25 ASN HA 1 26 TYR H . . 2.720 2.517 2.289 2.726 0.006 20 0 "[ . 1 . 2]" 1
415 1 25 ASN HA 1 26 TYR HA . . 5.500 4.303 4.291 4.324 . 0 0 "[ . 1 . 2]" 1
416 1 25 ASN HA 1 26 TYR HD2 . . 5.230 4.465 4.144 4.740 . 0 0 "[ . 1 . 2]" 1
417 1 25 ASN HA 1 27 LYS H . . 4.390 4.236 3.986 4.490 0.100 20 0 "[ . 1 . 2]" 1
418 1 25 ASN HA 1 28 SER H . . 4.970 4.622 4.418 4.883 . 0 0 "[ . 1 . 2]" 1
419 1 25 ASN QB 1 25 ASN QD . . 2.950 2.188 2.066 2.578 . 0 0 "[ . 1 . 2]" 1
420 1 25 ASN QB 1 26 TYR H . . 3.590 2.596 1.998 3.461 . 0 0 "[ . 1 . 2]" 1
421 1 25 ASN QB 1 27 LYS H . . 3.760 2.788 2.350 3.386 . 0 0 "[ . 1 . 2]" 1
422 1 25 ASN QB 1 28 SER H . . 4.080 3.319 2.325 4.061 . 0 0 "[ . 1 . 2]" 1
423 1 25 ASN QB 1 28 SER QB . . 3.890 3.713 1.997 4.078 0.188 11 0 "[ . 1 . 2]" 1
424 1 25 ASN QD 1 27 LYS H . . 3.800 2.679 1.891 3.057 . 0 0 "[ . 1 . 2]" 1
425 1 25 ASN QD 1 27 LYS QB . . 4.360 2.246 1.833 3.424 . 0 0 "[ . 1 . 2]" 1
426 1 25 ASN QD 1 28 SER H . . 4.230 3.274 1.854 4.288 0.058 4 0 "[ . 1 . 2]" 1
427 1 26 TYR H 1 26 TYR HB3 . . 3.240 2.628 2.363 2.721 . 0 0 "[ . 1 . 2]" 1
428 1 26 TYR H 1 26 TYR HD2 . . 3.290 2.451 2.262 2.803 . 0 0 "[ . 1 . 2]" 1
429 1 26 TYR H 1 27 LYS H . . 3.560 2.694 2.595 2.790 . 0 0 "[ . 1 . 2]" 1
430 1 26 TYR H 1 27 LYS HA . . 5.500 5.287 5.160 5.378 . 0 0 "[ . 1 . 2]" 1
431 1 26 TYR H 1 27 LYS QB . . 4.970 4.490 4.298 4.672 . 0 0 "[ . 1 . 2]" 1
432 1 26 TYR H 1 28 SER H . . 4.690 4.354 4.119 4.574 . 0 0 "[ . 1 . 2]" 1
433 1 26 TYR HA 1 26 TYR HB2 . . 2.690 2.511 2.392 2.573 . 0 0 "[ . 1 . 2]" 1
434 1 26 TYR HA 1 26 TYR HD1 . . 5.120 4.161 4.037 4.244 . 0 0 "[ . 1 . 2]" 1
435 1 26 TYR HA 1 26 TYR HD2 . . 4.730 4.222 4.123 4.346 . 0 0 "[ . 1 . 2]" 1
436 1 26 TYR HA 1 27 LYS HA . . 5.500 4.751 4.685 4.803 . 0 0 "[ . 1 . 2]" 1
437 1 26 TYR HA 1 28 SER H . . 4.880 4.468 4.201 4.717 . 0 0 "[ . 1 . 2]" 1
438 1 26 TYR HA 1 29 PHE H . . 4.240 3.635 3.341 3.850 . 0 0 "[ . 1 . 2]" 1
439 1 26 TYR HA 1 29 PHE HB2 . . 4.000 3.810 3.454 4.023 0.023 6 0 "[ . 1 . 2]" 1
440 1 26 TYR HA 1 29 PHE HB3 . . 4.010 3.158 2.728 3.596 . 0 0 "[ . 1 . 2]" 1
441 1 26 TYR HA 1 30 PHE H . . 4.970 4.819 3.849 5.069 0.099 10 0 "[ . 1 . 2]" 1
442 1 26 TYR HB2 1 26 TYR HD1 . . 3.260 2.514 2.444 2.636 . 0 0 "[ . 1 . 2]" 1
443 1 26 TYR HB2 1 27 LYS H . . 4.080 3.830 3.654 4.056 . 0 0 "[ . 1 . 2]" 1
444 1 26 TYR HB3 1 26 TYR HD2 . . 3.300 2.368 2.314 2.417 . 0 0 "[ . 1 . 2]" 1
445 1 26 TYR HB3 1 27 LYS H . . 4.350 4.110 3.938 4.230 . 0 0 "[ . 1 . 2]" 1
446 1 26 TYR HD1 1 27 LYS H . . 4.300 3.008 2.703 3.725 . 0 0 "[ . 1 . 2]" 1
447 1 26 TYR HD1 1 27 LYS HA . . 3.590 2.999 2.721 3.227 . 0 0 "[ . 1 . 2]" 1
448 1 26 TYR HD1 1 27 LYS QB . . 5.500 3.858 2.986 4.663 . 0 0 "[ . 1 . 2]" 1
449 1 26 TYR HD1 1 27 LYS HG2 . . 4.930 3.004 1.998 4.230 . 0 0 "[ . 1 . 2]" 1
450 1 26 TYR HD1 1 27 LYS QG . . 4.130 2.625 1.986 3.404 . 0 0 "[ . 1 . 2]" 1
451 1 26 TYR HD1 1 27 LYS HG3 . . 4.930 3.482 2.080 4.399 . 0 0 "[ . 1 . 2]" 1
452 1 26 TYR HE1 1 27 LYS HE2 . . 5.500 4.092 2.911 5.507 0.007 12 0 "[ . 1 . 2]" 1
453 1 26 TYR HE1 1 27 LYS HE3 . . 5.500 4.238 2.758 5.505 0.005 3 0 "[ . 1 . 2]" 1
454 1 26 TYR HE1 1 27 LYS HG2 . . 4.550 2.841 2.118 4.388 . 0 0 "[ . 1 . 2]" 1
455 1 26 TYR HE1 1 27 LYS HG3 . . 4.550 2.647 2.028 3.283 . 0 0 "[ . 1 . 2]" 1
456 1 27 LYS H 1 27 LYS QB . . 3.240 2.157 2.057 2.236 . 0 0 "[ . 1 . 2]" 1
457 1 27 LYS H 1 27 LYS HG2 . . 4.550 3.541 2.919 4.291 . 0 0 "[ . 1 . 2]" 1
458 1 27 LYS H 1 27 LYS QG . . 3.770 3.013 2.779 3.691 . 0 0 "[ . 1 . 2]" 1
459 1 27 LYS H 1 27 LYS HG3 . . 4.550 3.443 2.940 4.090 . 0 0 "[ . 1 . 2]" 1
460 1 27 LYS H 1 28 SER H . . 3.280 2.554 2.353 2.695 . 0 0 "[ . 1 . 2]" 1
461 1 27 LYS H 1 28 SER HA . . 5.490 5.172 5.014 5.290 . 0 0 "[ . 1 . 2]" 1
462 1 27 LYS H 1 29 PHE H . . 4.230 4.063 3.877 4.263 0.033 16 0 "[ . 1 . 2]" 1
463 1 27 LYS H 1 29 PHE HB3 . . 5.500 5.251 4.933 5.533 0.033 13 0 "[ . 1 . 2]" 1
464 1 27 LYS H 1 30 PHE H . . 5.140 4.898 4.502 5.135 . 0 0 "[ . 1 . 2]" 1
465 1 27 LYS HA 1 27 LYS HE2 . . 5.500 4.399 2.173 5.499 . 0 0 "[ . 1 . 2]" 1
466 1 27 LYS HA 1 27 LYS HE3 . . 5.500 4.692 2.542 5.473 . 0 0 "[ . 1 . 2]" 1
467 1 27 LYS HA 1 27 LYS QG . . 2.520 2.240 2.071 2.411 . 0 0 "[ . 1 . 2]" 1
468 1 27 LYS HA 1 30 PHE H . . 4.100 3.406 3.008 3.644 . 0 0 "[ . 1 . 2]" 1
469 1 27 LYS HA 1 30 PHE QB . . 3.450 2.889 2.094 3.466 0.016 4 0 "[ . 1 . 2]" 1
470 1 27 LYS HA 1 30 PHE HD1 . . 5.170 5.332 4.446 5.570 0.400 5 0 "[ . 1 . 2]" 1
471 1 27 LYS HA 1 30 PHE HD2 . . 5.500 2.801 1.982 5.551 0.051 8 0 "[ . 1 . 2]" 1
472 1 27 LYS QB 1 28 SER H . . 3.510 2.649 2.497 2.849 . 0 0 "[ . 1 . 2]" 1
473 1 27 LYS QB 1 29 PHE H . . 5.380 4.634 4.362 4.829 . 0 0 "[ . 1 . 2]" 1
474 1 27 LYS QB 1 30 PHE H . . 5.390 4.675 4.413 4.965 . 0 0 "[ . 1 . 2]" 1
475 1 27 LYS QG 1 28 SER H . . 4.850 4.352 4.202 4.513 . 0 0 "[ . 1 . 2]" 1
476 1 28 SER H 1 28 SER HA . . 2.920 2.795 2.759 2.848 . 0 0 "[ . 1 . 2]" 1
477 1 28 SER H 1 28 SER QB . . 3.050 2.172 2.066 2.371 . 0 0 "[ . 1 . 2]" 1
478 1 28 SER H 1 29 PHE H . . 3.400 2.706 2.528 2.852 . 0 0 "[ . 1 . 2]" 1
479 1 28 SER H 1 29 PHE HA . . 5.500 5.302 5.162 5.415 . 0 0 "[ . 1 . 2]" 1
480 1 28 SER H 1 29 PHE HB2 . . 5.240 5.148 5.006 5.271 0.031 14 0 "[ . 1 . 2]" 1
481 1 28 SER H 1 30 PHE H . . 4.150 4.059 3.903 4.289 0.139 13 0 "[ . 1 . 2]" 1
482 1 28 SER H 1 30 PHE QB . . 5.340 5.075 4.757 5.356 0.016 10 0 "[ . 1 . 2]" 1
483 1 28 SER H 1 31 SER H . . 4.950 4.901 4.735 5.022 0.072 4 0 "[ . 1 . 2]" 1
484 1 28 SER HA 1 30 PHE H . . 4.740 4.035 3.767 4.491 . 0 0 "[ . 1 . 2]" 1
485 1 28 SER HA 1 31 SER H . . 3.920 3.408 3.140 3.942 0.022 18 0 "[ . 1 . 2]" 1
486 1 28 SER HA 1 32 THR H . . 4.960 4.912 4.633 5.024 0.064 9 0 "[ . 1 . 2]" 1
487 1 28 SER HA 1 32 THR HA . . 5.430 4.847 3.996 5.477 0.047 10 0 "[ . 1 . 2]" 1
488 1 28 SER QB 1 29 PHE H . . 4.050 2.730 2.448 3.317 . 0 0 "[ . 1 . 2]" 1
489 1 28 SER HB2 1 29 PHE H . . 4.620 3.446 2.737 3.914 . 0 0 "[ . 1 . 2]" 1
490 1 28 SER HB2 1 30 PHE H . . 5.500 5.340 4.934 5.537 0.037 16 0 "[ . 1 . 2]" 1
491 1 28 SER HB3 1 29 PHE H . . 4.620 2.985 2.488 3.817 . 0 0 "[ . 1 . 2]" 1
492 1 28 SER HB3 1 30 PHE H . . 5.500 5.020 4.709 5.508 0.008 17 0 "[ . 1 . 2]" 1
493 1 29 PHE H 1 29 PHE HB2 . . 2.700 2.620 2.449 2.740 0.040 8 0 "[ . 1 . 2]" 1
494 1 29 PHE H 1 29 PHE HB3 . . 2.760 2.476 2.375 2.663 . 0 0 "[ . 1 . 2]" 1
495 1 29 PHE H 1 29 PHE HD1 . . 5.190 4.565 4.417 4.766 . 0 0 "[ . 1 . 2]" 1
496 1 29 PHE H 1 29 PHE HD2 . . 5.500 4.833 4.710 4.947 . 0 0 "[ . 1 . 2]" 1
497 1 29 PHE H 1 30 PHE H . . 3.610 2.570 2.255 2.766 . 0 0 "[ . 1 . 2]" 1
498 1 29 PHE H 1 30 PHE QB . . 4.950 4.566 4.066 4.883 . 0 0 "[ . 1 . 2]" 1
499 1 29 PHE H 1 31 SER H . . 4.440 4.211 3.896 4.479 0.039 16 0 "[ . 1 . 2]" 1
500 1 29 PHE H 1 32 THR H . . 5.500 5.250 5.009 5.474 . 0 0 "[ . 1 . 2]" 1
501 1 29 PHE HB2 1 29 PHE HD2 . . 2.650 2.388 2.336 2.865 0.215 13 0 "[ . 1 . 2]" 1
502 1 29 PHE HB2 1 30 PHE H . . 4.280 4.083 3.798 4.186 . 0 0 "[ . 1 . 2]" 1
503 1 29 PHE HB3 1 30 PHE H . . 3.550 2.938 2.511 3.069 . 0 0 "[ . 1 . 2]" 1
504 1 29 PHE HD1 1 30 PHE H . . 4.150 3.657 3.342 4.403 0.253 13 0 "[ . 1 . 2]" 1
505 1 29 PHE HD1 1 30 PHE HA . . 4.840 3.194 2.939 4.544 . 0 0 "[ . 1 . 2]" 1
506 1 29 PHE HD1 1 31 SER H . . 5.500 5.542 5.371 5.607 0.107 14 0 "[ . 1 . 2]" 1
507 1 30 PHE H 1 30 PHE HB2 . . 3.540 2.477 2.193 2.642 . 0 0 "[ . 1 . 2]" 1
508 1 30 PHE H 1 30 PHE QB . . 3.060 2.375 2.172 2.522 . 0 0 "[ . 1 . 2]" 1
509 1 30 PHE H 1 30 PHE HB3 . . 3.540 3.373 2.452 3.629 0.089 9 0 "[ . 1 . 2]" 1
510 1 30 PHE H 1 30 PHE HD1 . . 4.200 3.863 3.290 4.616 0.416 8 0 "[ . 1 . 2]" 1
511 1 30 PHE H 1 30 PHE HD2 . . 4.460 3.953 3.591 4.838 0.378 15 0 "[ . 1 . 2]" 1
512 1 30 PHE H 1 31 SER H . . 3.480 2.483 2.351 2.701 . 0 0 "[ . 1 . 2]" 1
513 1 30 PHE H 1 31 SER HA . . 5.330 5.136 5.050 5.278 . 0 0 "[ . 1 . 2]" 1
514 1 30 PHE H 1 32 THR H . . 4.150 4.005 3.705 4.188 0.038 8 0 "[ . 1 . 2]" 1
515 1 30 PHE HA 1 30 PHE HD1 . . 4.580 2.386 1.964 4.037 . 0 0 "[ . 1 . 2]" 1
516 1 30 PHE HA 1 30 PHE HD2 . . 4.870 4.328 3.122 4.697 . 0 0 "[ . 1 . 2]" 1
517 1 30 PHE HA 1 31 SER HA . . 4.880 4.591 4.518 4.659 . 0 0 "[ . 1 . 2]" 1
518 1 30 PHE HA 1 32 THR H . . 5.160 3.843 3.599 4.157 . 0 0 "[ . 1 . 2]" 1
519 1 30 PHE QB 1 31 SER H . . 3.200 2.614 2.229 2.945 . 0 0 "[ . 1 . 2]" 1
520 1 30 PHE HB2 1 31 SER H . . 3.670 2.957 2.428 3.813 0.143 15 0 "[ . 1 . 2]" 1
521 1 30 PHE HB3 1 31 SER H . . 3.670 3.459 2.248 3.835 0.165 9 0 "[ . 1 . 2]" 1
522 1 31 SER H 1 31 SER HB2 . . 3.360 2.774 2.154 3.544 0.184 8 0 "[ . 1 . 2]" 1
523 1 31 SER H 1 31 SER QB . . 2.810 2.463 2.127 3.005 0.195 4 0 "[ . 1 . 2]" 1
524 1 31 SER H 1 31 SER HB3 . . 3.360 2.888 2.495 3.415 0.055 18 0 "[ . 1 . 2]" 1
525 1 31 SER H 1 32 THR H . . 3.190 2.730 2.456 3.094 . 0 0 "[ . 1 . 2]" 1
526 1 31 SER QB 1 32 THR H . . 4.460 3.785 3.480 4.008 . 0 0 "[ . 1 . 2]" 1
527 1 31 SER HB2 1 32 THR H . . 5.220 4.422 3.893 4.598 . 0 0 "[ . 1 . 2]" 1
528 1 31 SER HB3 1 32 THR H . . 5.220 4.149 3.717 4.668 . 0 0 "[ . 1 . 2]" 1
529 1 32 THR H 1 32 THR HB . . 3.380 2.945 2.415 3.484 0.104 12 0 "[ . 1 . 2]" 1
530 1 32 THR H 1 34 GLY H . . 5.080 4.859 4.488 5.099 0.019 18 0 "[ . 1 . 2]" 1
531 1 32 THR HA 1 33 VAL H . . 3.100 2.458 2.343 2.704 . 0 0 "[ . 1 . 2]" 1
532 1 32 THR HB 1 34 GLY H . . 3.910 2.793 2.268 4.176 0.266 4 0 "[ . 1 . 2]" 1
533 1 32 THR HB 1 35 LEU H . . 5.460 4.972 4.044 5.480 0.020 4 0 "[ . 1 . 2]" 1
534 1 32 THR HB 1 36 SER H . . 5.500 4.562 3.687 5.543 0.043 20 0 "[ . 1 . 2]" 1
535 1 32 THR MG 1 36 SER H . . 5.500 3.766 2.746 4.918 . 0 0 "[ . 1 . 2]" 1
536 1 33 VAL H 1 33 VAL HB . . 3.150 2.627 2.570 2.676 . 0 0 "[ . 1 . 2]" 1
537 1 33 VAL H 1 33 VAL MG1 . . 3.260 2.076 1.903 2.205 . 0 0 "[ . 1 . 2]" 1
538 1 33 VAL H 1 34 GLY H . . 3.490 2.806 2.696 2.877 . 0 0 "[ . 1 . 2]" 1
539 1 33 VAL HA 1 33 VAL MG2 . . 3.550 2.376 2.322 2.451 . 0 0 "[ . 1 . 2]" 1
540 1 33 VAL HA 1 34 GLY HA3 . . 4.720 4.527 4.501 4.556 . 0 0 "[ . 1 . 2]" 1
541 1 33 VAL HA 1 35 LEU H . . 5.500 4.730 4.384 5.142 . 0 0 "[ . 1 . 2]" 1
542 1 33 VAL HB 1 33 VAL MG1 . . 2.400 2.107 2.085 2.130 . 0 0 "[ . 1 . 2]" 1
543 1 33 VAL HB 1 35 LEU H . . 5.050 4.612 4.352 5.129 0.079 20 0 "[ . 1 . 2]" 1
544 1 33 VAL MG1 1 34 GLY H . . 3.470 2.018 1.913 2.169 . 0 0 "[ . 1 . 2]" 1
545 1 33 VAL MG1 1 35 LEU H . . 3.250 2.028 1.880 2.258 . 0 0 "[ . 1 . 2]" 1
546 1 33 VAL MG1 1 35 LEU HB2 . . 3.850 2.294 1.955 2.694 . 0 0 "[ . 1 . 2]" 1
547 1 33 VAL MG1 1 35 LEU HB3 . . 4.130 3.234 2.919 3.553 . 0 0 "[ . 1 . 2]" 1
548 1 33 VAL MG1 1 36 SER H . . 4.150 2.900 2.539 3.183 . 0 0 "[ . 1 . 2]" 1
549 1 33 VAL MG1 1 37 SER H . . 5.260 4.447 4.070 4.813 . 0 0 "[ . 1 . 2]" 1
550 1 33 VAL MG2 1 35 LEU H . . 4.250 2.761 2.221 3.917 . 0 0 "[ . 1 . 2]" 1
551 1 33 VAL MG2 1 35 LEU HA . . 5.500 4.555 4.164 5.097 . 0 0 "[ . 1 . 2]" 1
552 1 34 GLY H 1 35 LEU H . . 3.400 2.534 2.087 2.895 . 0 0 "[ . 1 . 2]" 1
553 1 34 GLY H 1 35 LEU HA . . 5.360 4.991 4.792 5.183 . 0 0 "[ . 1 . 2]" 1
554 1 35 LEU H 1 35 LEU HA . . 2.850 2.800 2.747 2.947 0.097 20 0 "[ . 1 . 2]" 1
555 1 35 LEU H 1 35 LEU HB2 . . 2.550 2.141 2.044 2.615 0.065 4 0 "[ . 1 . 2]" 1
556 1 35 LEU H 1 35 LEU HB3 . . 3.320 3.186 3.016 3.380 0.060 16 0 "[ . 1 . 2]" 1
557 1 35 LEU H 1 38 LYS HB2 . . 5.310 5.046 4.751 5.286 . 0 0 "[ . 1 . 2]" 1
558 1 35 LEU H 1 38 LYS HG2 . . 5.500 4.533 4.067 5.262 . 0 0 "[ . 1 . 2]" 1
559 1 35 LEU H 1 38 LYS HG3 . . 5.500 4.364 3.788 5.007 . 0 0 "[ . 1 . 2]" 1
560 1 35 LEU HA 1 35 LEU QD . . 4.040 2.029 1.941 2.161 . 0 0 "[ . 1 . 2]" 1
561 1 35 LEU HA 1 37 SER H . . 5.500 3.831 3.644 3.985 . 0 0 "[ . 1 . 2]" 1
562 1 35 LEU HA 1 38 LYS H . . 5.500 3.735 3.149 4.107 . 0 0 "[ . 1 . 2]" 1
563 1 35 LEU HA 1 38 LYS HB2 . . 3.770 2.620 2.253 2.842 . 0 0 "[ . 1 . 2]" 1
564 1 35 LEU HA 1 38 LYS HB3 . . 4.120 4.019 3.658 4.177 0.057 13 0 "[ . 1 . 2]" 1
565 1 35 LEU HA 1 38 LYS QE . . 4.230 4.229 4.005 4.472 0.242 19 0 "[ . 1 . 2]" 1
566 1 35 LEU HA 1 38 LYS QG . . 2.730 2.248 1.924 2.459 . 0 0 "[ . 1 . 2]" 1
567 1 35 LEU HA 1 42 GLN HB2 . . 5.500 5.536 5.330 5.613 0.113 7 0 "[ . 1 . 2]" 1
568 1 35 LEU HA 1 43 ILE HA . . 5.300 4.722 4.469 5.049 . 0 0 "[ . 1 . 2]" 1
569 1 35 LEU HA 1 43 ILE MD . . 5.500 4.613 4.366 4.855 . 0 0 "[ . 1 . 2]" 1
570 1 35 LEU HA 1 106 VAL MG1 . . 5.500 3.551 3.272 3.698 . 0 0 "[ . 1 . 2]" 1
571 1 35 LEU HB2 1 36 SER H . . 4.180 3.147 2.822 3.360 . 0 0 "[ . 1 . 2]" 1
572 1 35 LEU HB2 1 106 VAL MG1 . . 5.500 3.582 3.376 3.751 . 0 0 "[ . 1 . 2]" 1
573 1 35 LEU HB3 1 36 SER H . . 3.470 2.571 2.360 2.855 . 0 0 "[ . 1 . 2]" 1
574 1 35 LEU HB3 1 36 SER HA . . 4.770 3.806 3.750 3.882 . 0 0 "[ . 1 . 2]" 1
575 1 35 LEU HB3 1 37 SER H . . 4.880 4.594 4.495 4.739 . 0 0 "[ . 1 . 2]" 1
576 1 35 LEU HB3 1 106 VAL MG1 . . 4.140 2.121 1.901 2.339 . 0 0 "[ . 1 . 2]" 1
577 1 35 LEU QD 1 38 LYS HB3 . . 5.500 3.708 3.351 4.016 . 0 0 "[ . 1 . 2]" 1
578 1 35 LEU QD 1 43 ILE HA . . 2.400 1.992 1.912 2.136 . 0 0 "[ . 1 . 2]" 1
579 1 35 LEU QD 1 43 ILE HG12 . . 4.000 1.984 1.890 2.110 . 0 0 "[ . 1 . 2]" 1
580 1 35 LEU QD 1 44 LYS H . . 5.500 4.750 4.604 4.858 . 0 0 "[ . 1 . 2]" 1
581 1 35 LEU QD 1 46 VAL HB . . 4.950 2.435 2.227 2.683 . 0 0 "[ . 1 . 2]" 1
582 1 35 LEU QD 1 102 PHE QD . . 5.500 4.037 3.710 4.310 . 0 0 "[ . 1 . 2]" 1
583 1 35 LEU QD 1 102 PHE QE . . 3.900 2.489 2.109 2.834 . 0 0 "[ . 1 . 2]" 1
584 1 35 LEU QD 1 106 VAL MG1 . . 4.800 1.823 1.750 1.917 . 0 0 "[ . 1 . 2]" 1
585 1 36 SER H 1 37 SER H . . 3.480 2.608 2.529 2.708 . 0 0 "[ . 1 . 2]" 1
586 1 36 SER H 1 37 SER HA . . 5.320 5.242 5.174 5.334 0.014 9 0 "[ . 1 . 2]" 1
587 1 36 SER H 1 106 VAL MG1 . . 4.750 2.994 2.850 3.160 . 0 0 "[ . 1 . 2]" 1
588 1 36 SER HA 1 43 ILE MD . . 4.820 3.860 3.602 4.428 . 0 0 "[ . 1 . 2]" 1
589 1 36 SER HA 1 106 VAL MG1 . . 3.250 1.913 1.870 2.108 . 0 0 "[ . 1 . 2]" 1
590 1 36 SER HA 1 107 LYS HA . . 4.250 3.142 2.654 3.585 . 0 0 "[ . 1 . 2]" 1
591 1 36 SER HB2 1 107 LYS HA . . 5.500 4.872 3.629 5.531 0.031 15 0 "[ . 1 . 2]" 1
592 1 36 SER HB3 1 107 LYS HA . . 5.500 4.610 3.765 5.508 0.008 1 0 "[ . 1 . 2]" 1
593 1 37 SER H 1 37 SER HB2 . . 4.160 3.164 2.419 3.859 . 0 0 "[ . 1 . 2]" 1
594 1 37 SER H 1 37 SER QB . . 3.490 2.611 2.386 2.986 . 0 0 "[ . 1 . 2]" 1
595 1 37 SER H 1 37 SER HB3 . . 4.160 2.968 2.651 3.738 . 0 0 "[ . 1 . 2]" 1
596 1 37 SER H 1 38 LYS HB2 . . 4.190 4.047 3.915 4.225 0.035 19 0 "[ . 1 . 2]" 1
597 1 37 SER H 1 38 LYS QG . . 4.300 3.882 3.686 4.105 . 0 0 "[ . 1 . 2]" 1
598 1 37 SER H 1 43 ILE MD . . 5.500 5.190 4.961 5.237 . 0 0 "[ . 1 . 2]" 1
599 1 37 SER H 1 106 VAL MG1 . . 5.500 4.133 4.041 4.226 . 0 0 "[ . 1 . 2]" 1
600 1 38 LYS H 1 38 LYS HB2 . . 3.050 2.275 2.160 2.385 . 0 0 "[ . 1 . 2]" 1
601 1 38 LYS H 1 38 LYS QE . . 5.340 5.313 4.845 5.387 0.047 17 0 "[ . 1 . 2]" 1
602 1 38 LYS H 1 38 LYS QG . . 3.930 3.204 2.499 3.401 . 0 0 "[ . 1 . 2]" 1
603 1 38 LYS H 1 39 THR H . . 4.710 4.434 2.965 4.622 . 0 0 "[ . 1 . 2]" 1
604 1 38 LYS H 1 43 ILE MD . . 4.490 3.568 3.204 4.301 . 0 0 "[ . 1 . 2]" 1
605 1 38 LYS H 1 106 VAL MG1 . . 5.330 3.980 3.744 4.358 . 0 0 "[ . 1 . 2]" 1
606 1 38 LYS HA 1 38 LYS QD . . 3.530 2.475 1.962 3.241 . 0 0 "[ . 1 . 2]" 1
607 1 38 LYS HA 1 39 THR H . . 3.150 2.579 2.409 3.518 0.368 12 0 "[ . 1 . 2]" 1
608 1 38 LYS HB2 1 39 THR H . . 3.920 3.604 2.410 3.929 0.009 9 0 "[ . 1 . 2]" 1
609 1 38 LYS HB2 1 43 ILE HG12 . . 3.780 2.910 2.616 3.164 . 0 0 "[ . 1 . 2]" 1
610 1 38 LYS HB2 1 106 VAL MG1 . . 5.270 4.006 3.780 4.323 . 0 0 "[ . 1 . 2]" 1
611 1 38 LYS HB3 1 38 LYS HD2 . . 3.960 2.494 2.258 2.715 . 0 0 "[ . 1 . 2]" 1
612 1 38 LYS HB3 1 38 LYS QD . . 3.410 2.252 2.080 2.418 . 0 0 "[ . 1 . 2]" 1
613 1 38 LYS HB3 1 38 LYS HD3 . . 3.960 2.658 2.160 3.647 . 0 0 "[ . 1 . 2]" 1
614 1 38 LYS HB3 1 39 THR H . . 3.600 2.205 1.998 2.555 . 0 0 "[ . 1 . 2]" 1
615 1 38 LYS HB3 1 39 THR MG . . 5.040 4.185 3.715 4.302 . 0 0 "[ . 1 . 2]" 1
616 1 38 LYS HB3 1 42 GLN HB2 . . 4.170 2.888 2.710 3.068 . 0 0 "[ . 1 . 2]" 1
617 1 38 LYS HB3 1 42 GLN QG . . 4.520 3.974 3.340 4.391 . 0 0 "[ . 1 . 2]" 1
618 1 38 LYS HB3 1 43 ILE H . . 4.540 4.025 3.683 4.336 . 0 0 "[ . 1 . 2]" 1
619 1 38 LYS HB3 1 43 ILE HA . . 5.030 4.808 4.302 5.066 0.036 12 0 "[ . 1 . 2]" 1
620 1 38 LYS HB3 1 43 ILE MD . . 5.500 3.912 3.410 4.371 . 0 0 "[ . 1 . 2]" 1
621 1 38 LYS HB3 1 43 ILE HG12 . . 3.970 3.660 3.017 4.033 0.063 12 0 "[ . 1 . 2]" 1
622 1 38 LYS HB3 1 43 ILE HG13 . . 4.200 3.144 2.578 3.664 . 0 0 "[ . 1 . 2]" 1
623 1 38 LYS QE 1 38 LYS QG . . 2.820 2.118 2.061 2.144 . 0 0 "[ . 1 . 2]" 1
624 1 38 LYS QG 1 39 THR H . . 4.570 3.798 3.618 3.990 . 0 0 "[ . 1 . 2]" 1
625 1 38 LYS QG 1 43 ILE HG12 . . 4.760 4.183 3.863 4.378 . 0 0 "[ . 1 . 2]" 1
626 1 39 THR H 1 39 THR MG . . 3.320 3.041 3.000 3.297 . 0 0 "[ . 1 . 2]" 1
627 1 39 THR H 1 40 PRO QD . . 4.790 4.365 4.186 4.377 . 0 0 "[ . 1 . 2]" 1
628 1 39 THR H 1 42 GLN H . . 4.460 4.270 4.172 4.409 . 0 0 "[ . 1 . 2]" 1
629 1 39 THR H 1 42 GLN HB2 . . 3.940 3.799 3.495 3.974 0.034 19 0 "[ . 1 . 2]" 1
630 1 39 THR H 1 42 GLN QG . . 3.880 3.683 3.191 4.032 0.152 12 0 "[ . 1 . 2]" 1
631 1 39 THR H 1 43 ILE MD . . 5.500 4.697 3.126 4.837 . 0 0 "[ . 1 . 2]" 1
632 1 39 THR HA 1 40 PRO QD . . 3.540 2.102 2.073 2.119 . 0 0 "[ . 1 . 2]" 1
633 1 39 THR HA 1 41 ASP H . . 4.900 4.859 4.768 4.903 0.003 9 0 "[ . 1 . 2]" 1
634 1 39 THR HA 1 42 GLN H . . 5.390 5.325 5.222 5.439 0.049 19 0 "[ . 1 . 2]" 1
635 1 39 THR HB 1 42 GLN H . . 4.860 4.669 4.447 4.812 . 0 0 "[ . 1 . 2]" 1
636 1 39 THR MG 1 40 PRO HA . . 5.500 3.761 3.745 3.812 . 0 0 "[ . 1 . 2]" 1
637 1 39 THR MG 1 40 PRO QD . . 3.210 2.210 2.140 2.406 . 0 0 "[ . 1 . 2]" 1
638 1 39 THR MG 1 40 PRO HG3 . . 5.470 4.200 4.132 4.396 . 0 0 "[ . 1 . 2]" 1
639 1 39 THR MG 1 41 ASP H . . 5.500 2.859 2.724 2.912 . 0 0 "[ . 1 . 2]" 1
640 1 39 THR MG 1 42 GLN H . . 2.670 2.457 2.086 2.635 . 0 0 "[ . 1 . 2]" 1
641 1 39 THR MG 1 42 GLN HG2 . . 5.500 2.994 1.918 3.961 . 0 0 "[ . 1 . 2]" 1
642 1 39 THR MG 1 42 GLN QG . . 4.680 2.368 1.906 2.771 . 0 0 "[ . 1 . 2]" 1
643 1 39 THR MG 1 42 GLN HG3 . . 5.500 3.237 2.314 4.295 . 0 0 "[ . 1 . 2]" 1
644 1 40 PRO HA 1 41 ASP QB . . 4.560 4.369 4.351 4.422 . 0 0 "[ . 1 . 2]" 1
645 1 40 PRO HA 1 43 ILE H . . 4.310 4.177 4.117 4.293 . 0 0 "[ . 1 . 2]" 1
646 1 40 PRO HA 1 43 ILE MD . . 3.300 2.769 2.537 2.981 . 0 0 "[ . 1 . 2]" 1
647 1 40 PRO HA 1 107 LYS HD2 . . 5.500 4.134 3.156 5.506 0.006 10 0 "[ . 1 . 2]" 1
648 1 40 PRO HA 1 107 LYS HD3 . . 5.500 4.816 3.515 5.477 . 0 0 "[ . 1 . 2]" 1
649 1 40 PRO HA 1 107 LYS QG . . 5.340 4.525 3.840 5.462 0.122 19 0 "[ . 1 . 2]" 1
650 1 40 PRO HB2 1 41 ASP QB . . 4.410 4.379 4.289 4.451 0.041 19 0 "[ . 1 . 2]" 1
651 1 40 PRO HB3 1 43 ILE MD . . 4.930 4.139 3.924 4.333 . 0 0 "[ . 1 . 2]" 1
652 1 40 PRO QD 1 41 ASP H . . 4.540 4.368 4.303 4.399 . 0 0 "[ . 1 . 2]" 1
653 1 40 PRO HG2 1 41 ASP QB . . 4.030 3.995 3.915 4.045 0.015 19 0 "[ . 1 . 2]" 1
654 1 41 ASP H 1 41 ASP HA . . 2.850 2.799 2.780 2.839 . 0 0 "[ . 1 . 2]" 1
655 1 41 ASP H 1 41 ASP QB . . 3.220 2.975 2.922 2.996 . 0 0 "[ . 1 . 2]" 1
656 1 41 ASP H 1 42 GLN H . . 3.370 1.963 1.824 2.126 . 0 0 "[ . 1 . 2]" 1
657 1 41 ASP H 1 42 GLN HB2 . . 4.630 4.198 4.050 4.380 . 0 0 "[ . 1 . 2]" 1
658 1 41 ASP H 1 43 ILE H . . 2.550 2.482 2.357 2.593 0.043 20 0 "[ . 1 . 2]" 1
659 1 41 ASP H 1 43 ILE MD . . 4.890 3.707 3.533 3.891 . 0 0 "[ . 1 . 2]" 1
660 1 41 ASP HA 1 42 GLN HA . . 5.200 4.670 4.645 4.704 . 0 0 "[ . 1 . 2]" 1
661 1 41 ASP HA 1 43 ILE H . . 4.430 4.319 4.056 4.469 0.039 14 0 "[ . 1 . 2]" 1
662 1 41 ASP HA 1 44 LYS QD . . 5.340 2.911 2.321 3.819 . 0 0 "[ . 1 . 2]" 1
663 1 41 ASP HA 1 44 LYS HE2 . . 5.500 4.054 3.095 4.602 . 0 0 "[ . 1 . 2]" 1
664 1 41 ASP HA 1 44 LYS HE3 . . 5.500 3.878 2.059 5.492 . 0 0 "[ . 1 . 2]" 1
665 1 41 ASP HA 1 44 LYS HG2 . . 5.500 2.955 2.657 4.036 . 0 0 "[ . 1 . 2]" 1
666 1 41 ASP HA 1 44 LYS HG3 . . 5.500 4.119 3.716 5.301 . 0 0 "[ . 1 . 2]" 1
667 1 41 ASP HA 1 45 LYS H . . 5.250 5.201 4.874 5.348 0.098 16 0 "[ . 1 . 2]" 1
668 1 41 ASP QB 1 42 GLN H . . 3.930 2.694 2.518 2.870 . 0 0 "[ . 1 . 2]" 1
669 1 41 ASP HB2 1 42 GLN H . . 4.550 3.485 3.312 3.662 . 0 0 "[ . 1 . 2]" 1
670 1 41 ASP HB2 1 42 GLN HA . . 5.500 5.421 5.268 5.536 0.036 19 0 "[ . 1 . 2]" 1
671 1 41 ASP HB2 1 43 ILE H . . 5.500 5.346 5.167 5.516 0.016 2 0 "[ . 1 . 2]" 1
672 1 41 ASP HB3 1 42 GLN H . . 4.550 2.815 2.577 3.113 . 0 0 "[ . 1 . 2]" 1
673 1 41 ASP HB3 1 42 GLN HA . . 5.500 4.005 3.915 4.086 . 0 0 "[ . 1 . 2]" 1
674 1 41 ASP HB3 1 43 ILE H . . 5.500 4.920 4.712 5.138 . 0 0 "[ . 1 . 2]" 1
675 1 42 GLN H 1 42 GLN HB2 . . 2.700 2.606 2.482 2.735 0.035 12 0 "[ . 1 . 2]" 1
676 1 42 GLN H 1 42 GLN HB3 . . 3.800 3.629 3.601 3.646 . 0 0 "[ . 1 . 2]" 1
677 1 42 GLN H 1 42 GLN QG . . 2.780 2.207 1.952 2.440 . 0 0 "[ . 1 . 2]" 1
678 1 42 GLN H 1 43 ILE H . . 3.360 2.345 2.263 2.447 . 0 0 "[ . 1 . 2]" 1
679 1 42 GLN H 1 43 ILE HA . . 5.030 4.947 4.860 5.042 0.012 5 0 "[ . 1 . 2]" 1
680 1 42 GLN H 1 43 ILE HB . . 4.840 4.655 4.528 4.763 . 0 0 "[ . 1 . 2]" 1
681 1 42 GLN H 1 43 ILE MD . . 5.500 4.729 4.534 4.868 . 0 0 "[ . 1 . 2]" 1
682 1 42 GLN H 1 45 LYS HB2 . . 5.500 5.360 5.018 5.530 0.030 19 0 "[ . 1 . 2]" 1
683 1 42 GLN HA 1 42 GLN HB3 . . 2.550 2.401 2.344 2.464 . 0 0 "[ . 1 . 2]" 1
684 1 42 GLN HA 1 42 GLN HG2 . . 3.820 3.104 2.536 3.491 . 0 0 "[ . 1 . 2]" 1
685 1 42 GLN HA 1 42 GLN HG3 . . 3.820 3.500 3.009 3.839 0.019 16 0 "[ . 1 . 2]" 1
686 1 42 GLN HA 1 43 ILE H . . 3.550 3.466 3.405 3.499 . 0 0 "[ . 1 . 2]" 1
687 1 42 GLN HA 1 43 ILE HA . . 5.500 4.843 4.784 4.875 . 0 0 "[ . 1 . 2]" 1
688 1 42 GLN HA 1 45 LYS HB3 . . 4.430 4.252 3.850 4.428 . 0 0 "[ . 1 . 2]" 1
689 1 42 GLN HA 1 45 LYS QG . . 5.340 3.411 2.597 3.898 . 0 0 "[ . 1 . 2]" 1
690 1 42 GLN HA 1 46 VAL QG . . 5.500 4.282 4.056 4.380 . 0 0 "[ . 1 . 2]" 1
691 1 42 GLN HB2 1 43 ILE H . . 3.180 2.946 2.799 3.180 0.000 4 0 "[ . 1 . 2]" 1
692 1 42 GLN HB2 1 46 VAL QG . . 5.500 4.200 3.871 4.487 . 0 0 "[ . 1 . 2]" 1
693 1 42 GLN HB3 1 43 ILE H . . 4.200 4.031 3.906 4.210 0.010 4 0 "[ . 1 . 2]" 1
694 1 42 GLN HB3 1 46 VAL H . . 5.500 5.470 5.262 5.539 0.039 4 0 "[ . 1 . 2]" 1
695 1 42 GLN HB3 1 46 VAL QG . . 4.480 3.760 3.621 3.944 . 0 0 "[ . 1 . 2]" 1
696 1 42 GLN QG 1 43 ILE H . . 4.440 3.983 3.752 4.153 . 0 0 "[ . 1 . 2]" 1
697 1 42 GLN HG2 1 43 ILE H . . 5.300 4.498 3.884 5.127 . 0 0 "[ . 1 . 2]" 1
698 1 42 GLN HG3 1 43 ILE H . . 5.300 4.762 4.051 5.280 . 0 0 "[ . 1 . 2]" 1
699 1 43 ILE H 1 43 ILE HB . . 3.040 2.573 2.496 2.628 . 0 0 "[ . 1 . 2]" 1
700 1 43 ILE H 1 43 ILE MD . . 3.930 3.492 3.369 3.573 . 0 0 "[ . 1 . 2]" 1
701 1 43 ILE H 1 43 ILE HG12 . . 3.820 3.330 3.194 3.470 . 0 0 "[ . 1 . 2]" 1
702 1 43 ILE H 1 43 ILE HG13 . . 2.710 2.025 1.906 2.191 . 0 0 "[ . 1 . 2]" 1
703 1 43 ILE H 1 44 LYS H . . 2.850 2.798 2.566 2.944 0.094 5 0 "[ . 1 . 2]" 1
704 1 43 ILE H 1 44 LYS QG . . 4.400 3.822 3.517 4.502 0.102 6 0 "[ . 1 . 2]" 1
705 1 43 ILE H 1 45 LYS H . . 4.950 4.135 3.927 4.281 . 0 0 "[ . 1 . 2]" 1
706 1 43 ILE H 1 46 VAL H . . 5.180 4.945 4.870 5.067 . 0 0 "[ . 1 . 2]" 1
707 1 43 ILE HA 1 43 ILE HG12 . . 3.680 2.565 2.500 2.653 . 0 0 "[ . 1 . 2]" 1
708 1 43 ILE HA 1 43 ILE HG13 . . 4.000 2.988 2.947 3.065 . 0 0 "[ . 1 . 2]" 1
709 1 43 ILE HA 1 44 LYS HA . . 5.500 4.818 4.754 4.858 . 0 0 "[ . 1 . 2]" 1
710 1 43 ILE HA 1 45 LYS H . . 4.570 4.284 4.077 4.476 . 0 0 "[ . 1 . 2]" 1
711 1 43 ILE HA 1 46 VAL H . . 3.860 3.452 3.353 3.595 . 0 0 "[ . 1 . 2]" 1
712 1 43 ILE HA 1 46 VAL HB . . 3.490 3.020 2.914 3.218 . 0 0 "[ . 1 . 2]" 1
713 1 43 ILE HA 1 102 PHE QE . . 4.420 3.805 3.559 3.973 . 0 0 "[ . 1 . 2]" 1
714 1 43 ILE HB 1 43 ILE MD . . 3.610 2.445 2.400 2.474 . 0 0 "[ . 1 . 2]" 1
715 1 43 ILE HB 1 44 LYS H . . 4.170 2.444 2.228 2.781 . 0 0 "[ . 1 . 2]" 1
716 1 43 ILE HB 1 103 GLN HB2 . . 5.500 3.089 2.599 3.560 . 0 0 "[ . 1 . 2]" 1
717 1 43 ILE HB 1 103 GLN HG2 . . 4.860 4.758 4.383 4.872 0.012 4 0 "[ . 1 . 2]" 1
718 1 43 ILE MD 1 43 ILE MG . . 2.760 1.934 1.907 2.017 . 0 0 "[ . 1 . 2]" 1
719 1 43 ILE MD 1 103 GLN H . . 5.500 4.789 4.549 5.078 . 0 0 "[ . 1 . 2]" 1
720 1 43 ILE MD 1 103 GLN HA . . 2.850 2.544 2.330 2.776 . 0 0 "[ . 1 . 2]" 1
721 1 43 ILE MD 1 103 GLN HB2 . . 4.710 2.556 2.449 2.685 . 0 0 "[ . 1 . 2]" 1
722 1 43 ILE MD 1 103 GLN HG3 . . 5.500 4.599 4.504 4.790 . 0 0 "[ . 1 . 2]" 1
723 1 43 ILE MD 1 105 LEU H . . 5.500 5.185 5.120 5.218 . 0 0 "[ . 1 . 2]" 1
724 1 43 ILE MD 1 106 VAL H . . 5.030 4.289 4.140 4.529 . 0 0 "[ . 1 . 2]" 1
725 1 43 ILE MD 1 106 VAL HB . . 4.420 2.440 2.191 2.926 . 0 0 "[ . 1 . 2]" 1
726 1 43 ILE MD 1 106 VAL MG1 . . 3.340 2.585 2.204 2.987 . 0 0 "[ . 1 . 2]" 1
727 1 43 ILE MD 1 107 LYS H . . 4.610 3.084 2.472 3.447 . 0 0 "[ . 1 . 2]" 1
728 1 43 ILE MD 1 107 LYS HG2 . . 5.500 2.689 2.028 3.867 . 0 0 "[ . 1 . 2]" 1
729 1 43 ILE MD 1 107 LYS QG . . 4.600 2.462 1.967 3.659 . 0 0 "[ . 1 . 2]" 1
730 1 43 ILE MD 1 107 LYS HG3 . . 5.500 3.034 2.083 4.578 . 0 0 "[ . 1 . 2]" 1
731 1 43 ILE HG12 1 106 VAL MG1 . . 4.590 2.925 2.691 3.285 . 0 0 "[ . 1 . 2]" 1
732 1 43 ILE MG 1 44 LYS H . . 5.040 3.367 3.170 3.625 . 0 0 "[ . 1 . 2]" 1
733 1 43 ILE MG 1 44 LYS HA . . 5.500 3.545 3.428 3.695 . 0 0 "[ . 1 . 2]" 1
734 1 43 ILE MG 1 46 VAL HB . . 5.500 3.332 3.127 3.527 . 0 0 "[ . 1 . 2]" 1
735 1 43 ILE MG 1 102 PHE QD . . 3.580 1.990 1.882 2.117 . 0 0 "[ . 1 . 2]" 1
736 1 43 ILE MG 1 102 PHE QE . . 5.500 1.975 1.943 2.022 . 0 0 "[ . 1 . 2]" 1
737 1 43 ILE MG 1 103 GLN H . . 5.340 3.215 2.898 3.504 . 0 0 "[ . 1 . 2]" 1
738 1 43 ILE MG 1 103 GLN HA . . 3.040 1.925 1.873 2.069 . 0 0 "[ . 1 . 2]" 1
739 1 43 ILE MG 1 103 GLN HB2 . . 4.760 3.087 2.841 3.340 . 0 0 "[ . 1 . 2]" 1
740 1 43 ILE MG 1 103 GLN HB3 . . 4.710 2.229 1.964 2.503 . 0 0 "[ . 1 . 2]" 1
741 1 43 ILE MG 1 106 VAL H . . 5.500 3.840 3.688 4.088 . 0 0 "[ . 1 . 2]" 1
742 1 43 ILE MG 1 106 VAL HB . . 4.170 2.133 1.952 2.433 . 0 0 "[ . 1 . 2]" 1
743 1 43 ILE MG 1 106 VAL MG1 . . 5.500 2.592 2.367 2.918 . 0 0 "[ . 1 . 2]" 1
744 1 44 LYS H 1 44 LYS HA . . 2.850 2.783 2.754 2.846 . 0 0 "[ . 1 . 2]" 1
745 1 44 LYS H 1 44 LYS HB3 . . 2.700 2.656 2.279 2.746 0.046 11 0 "[ . 1 . 2]" 1
746 1 44 LYS H 1 44 LYS QG . . 3.430 2.032 1.884 2.624 . 0 0 "[ . 1 . 2]" 1
747 1 44 LYS H 1 45 LYS H . . 2.850 2.736 2.526 2.849 . 0 0 "[ . 1 . 2]" 1
748 1 44 LYS H 1 46 VAL H . . 4.450 4.035 3.910 4.211 . 0 0 "[ . 1 . 2]" 1
749 1 44 LYS H 1 46 VAL QG . . 5.500 4.753 4.482 4.939 . 0 0 "[ . 1 . 2]" 1
750 1 44 LYS H 1 99 VAL MG1 . . 5.500 4.444 4.186 4.637 . 0 0 "[ . 1 . 2]" 1
751 1 44 LYS HA 1 47 PHE H . . 3.760 3.274 3.125 3.334 . 0 0 "[ . 1 . 2]" 1
752 1 44 LYS HA 1 47 PHE HB3 . . 3.180 2.574 2.330 2.671 . 0 0 "[ . 1 . 2]" 1
753 1 44 LYS HA 1 47 PHE HD2 . . 4.600 3.450 3.097 3.605 . 0 0 "[ . 1 . 2]" 1
754 1 44 LYS HA 1 99 VAL MG1 . . 3.010 2.435 2.298 2.587 . 0 0 "[ . 1 . 2]" 1
755 1 44 LYS HA 1 102 PHE HB3 . . 4.920 3.923 3.544 4.277 . 0 0 "[ . 1 . 2]" 1
756 1 44 LYS HA 1 103 GLN H . . 5.410 4.560 4.249 4.939 . 0 0 "[ . 1 . 2]" 1
757 1 44 LYS HB2 1 44 LYS QD . . 2.530 2.342 2.022 2.601 0.071 6 0 "[ . 1 . 2]" 1
758 1 44 LYS HB2 1 44 LYS QE . . 5.110 3.163 2.449 3.760 . 0 0 "[ . 1 . 2]" 1
759 1 44 LYS HB2 1 46 VAL H . . 5.500 5.195 5.036 5.393 . 0 0 "[ . 1 . 2]" 1
760 1 44 LYS HB2 1 47 PHE H . . 5.500 4.969 4.802 5.157 . 0 0 "[ . 1 . 2]" 1
761 1 44 LYS HB2 1 99 VAL MG1 . . 4.580 1.899 1.863 1.930 . 0 0 "[ . 1 . 2]" 1
762 1 44 LYS HB3 1 47 PHE H . . 5.500 5.510 5.338 5.643 0.143 1 0 "[ . 1 . 2]" 1
763 1 44 LYS QD 1 99 VAL HB . . 5.340 4.262 3.569 5.058 . 0 0 "[ . 1 . 2]" 1
764 1 44 LYS QD 1 99 VAL MG1 . . 4.730 3.225 2.914 3.561 . 0 0 "[ . 1 . 2]" 1
765 1 44 LYS QD 1 99 VAL MG2 . . 5.340 4.574 4.201 4.893 . 0 0 "[ . 1 . 2]" 1
766 1 44 LYS QE 1 44 LYS QG . . 2.850 2.167 1.960 2.668 . 0 0 "[ . 1 . 2]" 1
767 1 44 LYS QE 1 99 VAL MG1 . . 4.430 3.771 2.994 4.205 . 0 0 "[ . 1 . 2]" 1
768 1 44 LYS QG 1 45 LYS H . . 2.790 1.994 1.897 2.132 . 0 0 "[ . 1 . 2]" 1
769 1 44 LYS QG 1 45 LYS HA . . 5.340 3.580 3.150 3.796 . 0 0 "[ . 1 . 2]" 1
770 1 44 LYS QG 1 45 LYS QG . . 5.180 2.809 2.368 3.266 . 0 0 "[ . 1 . 2]" 1
771 1 44 LYS QG 1 99 VAL MG1 . . 4.280 3.646 3.184 3.787 . 0 0 "[ . 1 . 2]" 1
772 1 44 LYS HG2 1 99 VAL MG1 . . 5.500 4.299 4.122 4.431 . 0 0 "[ . 1 . 2]" 1
773 1 44 LYS HG3 1 99 VAL MG1 . . 5.500 3.967 3.283 4.173 . 0 0 "[ . 1 . 2]" 1
774 1 45 LYS H 1 45 LYS HB2 . . 2.400 2.221 2.103 2.471 0.071 19 0 "[ . 1 . 2]" 1
775 1 45 LYS H 1 45 LYS HB3 . . 3.670 3.500 3.411 3.593 . 0 0 "[ . 1 . 2]" 1
776 1 45 LYS H 1 45 LYS HE2 . . 5.500 4.999 3.667 5.511 0.011 5 0 "[ . 1 . 2]" 1
777 1 45 LYS H 1 45 LYS HE3 . . 5.500 4.928 4.070 5.539 0.039 19 0 "[ . 1 . 2]" 1
778 1 45 LYS H 1 45 LYS HG2 . . 3.960 3.272 2.290 4.097 0.137 16 0 "[ . 1 . 2]" 1
779 1 45 LYS H 1 45 LYS QG . . 3.140 2.828 2.270 3.292 0.152 16 0 "[ . 1 . 2]" 1
780 1 45 LYS H 1 45 LYS HG3 . . 3.960 3.459 2.574 3.979 0.019 9 0 "[ . 1 . 2]" 1
781 1 45 LYS H 1 46 VAL H . . 3.030 2.590 2.526 2.687 . 0 0 "[ . 1 . 2]" 1
782 1 45 LYS H 1 46 VAL QG . . 4.510 3.879 3.739 4.101 . 0 0 "[ . 1 . 2]" 1
783 1 45 LYS H 1 47 PHE H . . 4.440 4.052 3.946 4.401 . 0 0 "[ . 1 . 2]" 1
784 1 45 LYS HA 1 45 LYS QD . . 4.380 3.046 1.968 4.086 . 0 0 "[ . 1 . 2]" 1
785 1 45 LYS HA 1 45 LYS HG2 . . 3.880 2.537 2.217 3.502 . 0 0 "[ . 1 . 2]" 1
786 1 45 LYS HA 1 45 LYS QG . . 3.390 2.391 2.156 2.997 . 0 0 "[ . 1 . 2]" 1
787 1 45 LYS HA 1 45 LYS HG3 . . 3.880 3.315 2.239 3.740 . 0 0 "[ . 1 . 2]" 1
788 1 45 LYS HA 1 46 VAL QG . . 5.380 4.641 4.561 4.733 . 0 0 "[ . 1 . 2]" 1
789 1 45 LYS HA 1 47 PHE H . . 4.730 4.029 3.922 4.617 . 0 0 "[ . 1 . 2]" 1
790 1 45 LYS HA 1 48 GLY HA3 . . 4.280 4.217 4.056 4.319 0.039 18 0 "[ . 1 . 2]" 1
791 1 45 LYS HA 1 49 ILE H . . 5.500 5.548 5.503 5.597 0.097 19 0 "[ . 1 . 2]" 1
792 1 45 LYS HB2 1 45 LYS QG . . 2.450 2.220 2.141 2.461 0.011 16 0 "[ . 1 . 2]" 1
793 1 45 LYS HB2 1 46 VAL H . . 3.640 3.182 3.031 3.348 . 0 0 "[ . 1 . 2]" 1
794 1 45 LYS HB2 1 46 VAL QG . . 4.220 3.474 3.283 3.679 . 0 0 "[ . 1 . 2]" 1
795 1 45 LYS HB3 1 46 VAL H . . 3.950 3.701 3.314 3.989 0.039 19 0 "[ . 1 . 2]" 1
796 1 45 LYS HB3 1 46 VAL QG . . 5.000 3.761 3.437 4.148 . 0 0 "[ . 1 . 2]" 1
797 1 46 VAL H 1 46 VAL HB . . 3.200 2.500 2.449 2.577 . 0 0 "[ . 1 . 2]" 1
798 1 46 VAL H 1 46 VAL QG . . 3.070 2.312 2.156 2.425 . 0 0 "[ . 1 . 2]" 1
799 1 46 VAL H 1 47 PHE H . . 2.720 2.330 2.210 2.466 . 0 0 "[ . 1 . 2]" 1
800 1 46 VAL H 1 47 PHE HB2 . . 5.500 5.224 5.115 5.358 . 0 0 "[ . 1 . 2]" 1
801 1 46 VAL H 1 47 PHE HB3 . . 5.060 4.166 4.040 4.334 . 0 0 "[ . 1 . 2]" 1
802 1 46 VAL H 1 49 ILE MD . . 5.390 4.842 4.445 5.069 . 0 0 "[ . 1 . 2]" 1
803 1 46 VAL H 1 102 PHE QD . . 5.500 5.313 4.901 5.544 0.044 15 0 "[ . 1 . 2]" 1
804 1 46 VAL HA 1 49 ILE MD . . 3.650 2.342 2.056 2.479 . 0 0 "[ . 1 . 2]" 1
805 1 46 VAL HA 1 49 ILE HG13 . . 4.330 2.924 2.631 3.154 . 0 0 "[ . 1 . 2]" 1
806 1 46 VAL HB 1 47 PHE H . . 3.530 3.075 2.536 3.157 . 0 0 "[ . 1 . 2]" 1
807 1 46 VAL HB 1 47 PHE HB2 . . 5.060 4.867 4.688 4.954 . 0 0 "[ . 1 . 2]" 1
808 1 46 VAL HB 1 49 ILE MD . . 5.320 4.910 4.689 5.009 . 0 0 "[ . 1 . 2]" 1
809 1 46 VAL HB 1 102 PHE QE . . 3.920 3.044 2.576 3.222 . 0 0 "[ . 1 . 2]" 1
810 1 46 VAL QG 1 47 PHE H . . 4.470 3.446 3.211 3.490 . 0 0 "[ . 1 . 2]" 1
811 1 46 VAL QG 1 47 PHE HA . . 4.310 3.588 3.532 3.654 . 0 0 "[ . 1 . 2]" 1
812 1 46 VAL QG 1 47 PHE HB3 . . 5.500 4.717 4.653 4.748 . 0 0 "[ . 1 . 2]" 1
813 1 46 VAL QG 1 49 ILE MD . . 3.600 2.828 2.569 2.948 . 0 0 "[ . 1 . 2]" 1
814 1 46 VAL QG 1 102 PHE QE . . 5.500 3.372 2.977 3.529 . 0 0 "[ . 1 . 2]" 1
815 1 47 PHE H 1 47 PHE HB2 . . 3.360 3.156 2.994 3.228 . 0 0 "[ . 1 . 2]" 1
816 1 47 PHE H 1 47 PHE HB3 . . 3.440 2.154 2.135 2.174 . 0 0 "[ . 1 . 2]" 1
817 1 47 PHE H 1 47 PHE HD2 . . 4.550 3.837 3.674 4.065 . 0 0 "[ . 1 . 2]" 1
818 1 47 PHE H 1 48 GLY H . . 2.700 2.378 2.294 2.680 . 0 0 "[ . 1 . 2]" 1
819 1 47 PHE H 1 49 ILE H . . 4.940 4.046 4.006 4.147 . 0 0 "[ . 1 . 2]" 1
820 1 47 PHE H 1 49 ILE MD . . 5.500 5.119 5.062 5.137 . 0 0 "[ . 1 . 2]" 1
821 1 47 PHE H 1 50 LEU MD1 . . 5.500 4.659 4.317 4.835 . 0 0 "[ . 1 . 2]" 1
822 1 47 PHE H 1 99 VAL MG1 . . 5.500 4.317 4.235 4.376 . 0 0 "[ . 1 . 2]" 1
823 1 47 PHE H 1 102 PHE QD . . 4.500 4.371 4.019 4.465 . 0 0 "[ . 1 . 2]" 1
824 1 47 PHE H 1 102 PHE QE . . 4.040 3.969 3.611 4.023 . 0 0 "[ . 1 . 2]" 1
825 1 47 PHE HA 1 47 PHE HE1 . . 5.390 5.282 5.197 5.387 . 0 0 "[ . 1 . 2]" 1
826 1 47 PHE HA 1 49 ILE H . . 4.330 3.528 3.467 3.684 . 0 0 "[ . 1 . 2]" 1
827 1 47 PHE HA 1 50 LEU H . . 4.050 3.413 3.233 3.531 . 0 0 "[ . 1 . 2]" 1
828 1 47 PHE HA 1 50 LEU HB3 . . 5.500 4.800 4.758 4.855 . 0 0 "[ . 1 . 2]" 1
829 1 47 PHE HA 1 50 LEU MD1 . . 4.830 2.344 2.136 2.534 . 0 0 "[ . 1 . 2]" 1
830 1 47 PHE HA 1 50 LEU MD2 . . 5.140 3.041 2.960 3.128 . 0 0 "[ . 1 . 2]" 1
831 1 47 PHE HA 1 50 LEU HG . . 4.300 1.982 1.920 2.065 . 0 0 "[ . 1 . 2]" 1
832 1 47 PHE HA 1 51 ASP H . . 5.220 4.859 4.789 5.007 . 0 0 "[ . 1 . 2]" 1
833 1 47 PHE HA 1 102 PHE QE . . 4.670 3.735 3.648 3.965 . 0 0 "[ . 1 . 2]" 1
834 1 47 PHE HB2 1 47 PHE HD1 . . 3.560 2.518 2.463 2.566 . 0 0 "[ . 1 . 2]" 1
835 1 47 PHE HB2 1 99 VAL HA . . 5.010 4.303 3.985 4.553 . 0 0 "[ . 1 . 2]" 1
836 1 47 PHE HB2 1 102 PHE QD . . 5.500 2.909 2.802 2.943 . 0 0 "[ . 1 . 2]" 1
837 1 47 PHE HB2 1 102 PHE QE . . 4.040 3.231 3.104 3.610 . 0 0 "[ . 1 . 2]" 1
838 1 47 PHE HB3 1 47 PHE HD2 . . 3.300 2.341 2.318 2.374 . 0 0 "[ . 1 . 2]" 1
839 1 47 PHE HB3 1 49 ILE H . . 5.380 5.102 5.051 5.215 . 0 0 "[ . 1 . 2]" 1
840 1 47 PHE HB3 1 99 VAL MG1 . . 4.250 2.947 2.831 3.043 . 0 0 "[ . 1 . 2]" 1
841 1 47 PHE HB3 1 103 GLN H . . 5.500 5.401 5.190 5.574 0.074 6 0 "[ . 1 . 2]" 1
842 1 47 PHE HD1 1 50 LEU MD1 . . 5.450 2.142 1.982 2.367 . 0 0 "[ . 1 . 2]" 1
843 1 47 PHE HD1 1 50 LEU MD2 . . 5.500 4.674 4.565 4.760 . 0 0 "[ . 1 . 2]" 1
844 1 47 PHE HD1 1 51 ASP H . . 5.500 4.473 4.261 4.635 . 0 0 "[ . 1 . 2]" 1
845 1 47 PHE HD1 1 58 ILE MD . . 4.050 2.748 2.135 3.133 . 0 0 "[ . 1 . 2]" 1
846 1 47 PHE HD1 1 97 ILE MG . . 5.500 3.895 3.507 4.097 . 0 0 "[ . 1 . 2]" 1
847 1 47 PHE HD1 1 102 PHE HB2 . . 4.050 3.767 3.454 3.868 . 0 0 "[ . 1 . 2]" 1
848 1 47 PHE HD2 1 99 VAL HA . . 4.080 3.286 2.732 3.391 . 0 0 "[ . 1 . 2]" 1
849 1 47 PHE HD2 1 99 VAL HB . . 4.580 4.568 4.351 4.618 0.038 9 0 "[ . 1 . 2]" 1
850 1 47 PHE HD2 1 99 VAL MG1 . . 3.330 1.885 1.838 1.915 . 0 0 "[ . 1 . 2]" 1
851 1 47 PHE HE1 1 58 ILE MD . . 4.240 2.049 1.936 2.304 . 0 0 "[ . 1 . 2]" 1
852 1 47 PHE HE1 1 58 ILE HG13 . . 5.500 2.652 1.997 3.127 . 0 0 "[ . 1 . 2]" 1
853 1 47 PHE HE1 1 97 ILE MG . . 4.340 3.555 3.164 3.715 . 0 0 "[ . 1 . 2]" 1
854 1 47 PHE HE1 1 102 PHE HB2 . . 4.620 4.664 4.634 4.699 0.079 15 0 "[ . 1 . 2]" 1
855 1 47 PHE HE2 1 99 VAL H . . 4.310 4.199 3.000 4.344 0.034 6 0 "[ . 1 . 2]" 1
856 1 47 PHE HE2 1 99 VAL HA . . 4.160 3.828 3.562 3.930 . 0 0 "[ . 1 . 2]" 1
857 1 47 PHE HE2 1 99 VAL HB . . 4.810 4.890 4.830 4.974 0.164 15 0 "[ . 1 . 2]" 1
858 1 47 PHE HE2 1 99 VAL MG1 . . 5.500 2.203 2.098 2.422 . 0 0 "[ . 1 . 2]" 1
859 1 47 PHE HE2 1 99 VAL MG2 . . 5.500 2.854 2.724 2.965 . 0 0 "[ . 1 . 2]" 1
860 1 48 GLY HA2 1 50 LEU H . . 4.730 3.973 3.775 4.643 . 0 0 "[ . 1 . 2]" 1
861 1 48 GLY HA2 1 51 ASP H . . 4.150 3.893 3.722 4.062 . 0 0 "[ . 1 . 2]" 1
862 1 48 GLY HA2 1 51 ASP QB . . 3.920 3.702 3.390 4.014 0.094 12 0 "[ . 1 . 2]" 1
863 1 49 ILE H 1 49 ILE HB . . 3.140 2.671 2.629 2.740 . 0 0 "[ . 1 . 2]" 1
864 1 49 ILE H 1 49 ILE MD . . 4.830 3.659 3.507 3.734 . 0 0 "[ . 1 . 2]" 1
865 1 49 ILE H 1 49 ILE HG12 . . 3.550 3.351 3.137 3.533 . 0 0 "[ . 1 . 2]" 1
866 1 49 ILE H 1 49 ILE HG13 . . 3.220 2.138 1.951 2.269 . 0 0 "[ . 1 . 2]" 1
867 1 49 ILE H 1 50 LEU MD2 . . 4.020 3.368 3.113 3.755 . 0 0 "[ . 1 . 2]" 1
868 1 49 ILE H 1 51 ASP H . . 4.770 4.348 4.277 4.491 . 0 0 "[ . 1 . 2]" 1
869 1 49 ILE HA 1 49 ILE HG12 . . 3.390 2.658 2.635 2.695 . 0 0 "[ . 1 . 2]" 1
870 1 49 ILE HA 1 49 ILE HG13 . . 3.270 3.186 3.103 3.282 0.012 19 0 "[ . 1 . 2]" 1
871 1 49 ILE HA 1 51 ASP H . . 5.500 4.782 4.525 4.892 . 0 0 "[ . 1 . 2]" 1
872 1 49 ILE HB 1 49 ILE MD . . 3.110 2.385 2.331 2.443 . 0 0 "[ . 1 . 2]" 1
873 1 49 ILE MD 1 49 ILE HG12 . . 2.410 2.074 2.072 2.089 . 0 0 "[ . 1 . 2]" 1
874 1 49 ILE HG12 1 49 ILE MG . . 3.130 2.349 2.256 2.411 . 0 0 "[ . 1 . 2]" 1
875 1 49 ILE HG12 1 50 LEU MD2 . . 5.500 5.155 5.009 5.242 . 0 0 "[ . 1 . 2]" 1
876 1 49 ILE HG13 1 50 LEU H . . 4.490 4.107 3.835 4.243 . 0 0 "[ . 1 . 2]" 1
877 1 50 LEU H 1 50 LEU HB2 . . 3.380 2.878 2.823 2.998 . 0 0 "[ . 1 . 2]" 1
878 1 50 LEU H 1 50 LEU HB3 . . 3.640 3.571 3.496 3.595 . 0 0 "[ . 1 . 2]" 1
879 1 50 LEU H 1 50 LEU MD1 . . 5.470 3.599 3.543 3.635 . 0 0 "[ . 1 . 2]" 1
880 1 50 LEU H 1 50 LEU MD2 . . 4.110 2.536 2.099 2.711 . 0 0 "[ . 1 . 2]" 1
881 1 50 LEU H 1 50 LEU HG . . 2.550 1.920 1.856 1.974 . 0 0 "[ . 1 . 2]" 1
882 1 50 LEU H 1 51 ASP H . . 3.500 2.624 2.472 3.056 . 0 0 "[ . 1 . 2]" 1
883 1 50 LEU H 1 58 ILE MD . . 5.500 3.920 3.591 4.233 . 0 0 "[ . 1 . 2]" 1
884 1 50 LEU HA 1 50 LEU MD2 . . 4.280 2.242 2.189 2.327 . 0 0 "[ . 1 . 2]" 1
885 1 50 LEU HA 1 69 ASN QB . . 5.180 3.199 2.346 4.140 . 0 0 "[ . 1 . 2]" 1
886 1 50 LEU HB2 1 51 ASP H . . 2.400 2.305 2.127 2.404 0.004 17 0 "[ . 1 . 2]" 1
887 1 50 LEU HB2 1 51 ASP HA . . 5.500 3.821 3.782 3.864 . 0 0 "[ . 1 . 2]" 1
888 1 50 LEU HB2 1 58 ILE MD . . 2.760 2.056 1.809 2.215 . 0 0 "[ . 1 . 2]" 1
889 1 50 LEU HB3 1 50 LEU MD1 . . 3.290 2.294 2.240 2.343 . 0 0 "[ . 1 . 2]" 1
890 1 50 LEU HB3 1 51 ASP H . . 4.050 3.728 3.575 3.797 . 0 0 "[ . 1 . 2]" 1
891 1 50 LEU HB3 1 58 ILE MD . . 4.870 3.076 2.886 3.323 . 0 0 "[ . 1 . 2]" 1
892 1 50 LEU HB3 1 69 ASN H . . 5.500 5.557 5.401 5.647 0.147 9 0 "[ . 1 . 2]" 1
893 1 50 LEU MD1 1 51 ASP H . . 4.400 4.086 4.016 4.150 . 0 0 "[ . 1 . 2]" 1
894 1 50 LEU MD1 1 66 PHE HD1 . . 4.680 2.532 2.477 2.637 . 0 0 "[ . 1 . 2]" 1
895 1 50 LEU MD1 1 69 ASN QB . . 5.340 3.981 3.642 4.255 . 0 0 "[ . 1 . 2]" 1
896 1 50 LEU MD2 1 51 ASP H . . 5.490 4.287 4.256 4.353 . 0 0 "[ . 1 . 2]" 1
897 1 50 LEU MD2 1 66 PHE HA . . 4.620 3.995 3.641 4.313 . 0 0 "[ . 1 . 2]" 1
898 1 50 LEU MD2 1 66 PHE HD1 . . 5.500 3.851 3.536 4.063 . 0 0 "[ . 1 . 2]" 1
899 1 50 LEU MD2 1 66 PHE HE1 . . 5.500 3.927 3.580 4.237 . 0 0 "[ . 1 . 2]" 1
900 1 50 LEU MD2 1 69 ASN H . . 5.080 4.291 3.951 4.537 . 0 0 "[ . 1 . 2]" 1
901 1 50 LEU MD2 1 69 ASN HA . . 5.500 4.164 3.814 4.423 . 0 0 "[ . 1 . 2]" 1
902 1 50 LEU MD2 1 69 ASN HB2 . . 4.760 2.396 1.925 2.907 . 0 0 "[ . 1 . 2]" 1
903 1 50 LEU MD2 1 69 ASN QB . . 3.940 2.073 1.879 2.324 . 0 0 "[ . 1 . 2]" 1
904 1 50 LEU MD2 1 69 ASN HB3 . . 4.760 2.356 1.999 2.739 . 0 0 "[ . 1 . 2]" 1
905 1 50 LEU HG 1 66 PHE HD1 . . 5.500 5.532 5.352 5.581 0.081 14 0 "[ . 1 . 2]" 1
906 1 51 ASP H 1 51 ASP HA . . 2.850 2.742 2.694 2.785 . 0 0 "[ . 1 . 2]" 1
907 1 51 ASP H 1 51 ASP QB . . 3.230 2.285 2.067 2.813 . 0 0 "[ . 1 . 2]" 1
908 1 51 ASP H 1 58 ILE MD . . 4.720 2.187 1.975 2.436 . 0 0 "[ . 1 . 2]" 1
909 1 51 ASP HA 1 52 GLN HA . . 5.120 4.417 4.312 4.620 . 0 0 "[ . 1 . 2]" 1
910 1 51 ASP HA 1 53 ASP H . . 4.520 4.417 4.123 4.649 0.129 16 0 "[ . 1 . 2]" 1
911 1 51 ASP HA 1 54 LYS QD . . 5.340 4.941 4.448 5.344 0.004 9 0 "[ . 1 . 2]" 1
912 1 51 ASP HA 1 54 LYS QG . . 5.340 4.704 3.285 5.431 0.091 7 0 "[ . 1 . 2]" 1
913 1 51 ASP HA 1 58 ILE MD . . 5.500 2.329 1.966 3.143 . 0 0 "[ . 1 . 2]" 1
914 1 51 ASP HA 1 58 ILE HG12 . . 3.290 2.275 1.972 2.478 . 0 0 "[ . 1 . 2]" 1
915 1 51 ASP HA 1 58 ILE HG13 . . 5.260 3.340 2.889 3.948 . 0 0 "[ . 1 . 2]" 1
916 1 51 ASP HA 1 58 ILE MG . . 5.500 3.783 3.689 3.977 . 0 0 "[ . 1 . 2]" 1
917 1 51 ASP QB 1 54 LYS QD . . 4.760 3.021 1.949 4.898 0.138 17 0 "[ . 1 . 2]" 1
918 1 52 GLN HA 1 52 GLN HG2 . . 4.010 3.735 3.607 4.095 0.085 5 0 "[ . 1 . 2]" 1
919 1 52 GLN HA 1 52 GLN QG . . 3.450 3.300 3.228 3.347 . 0 0 "[ . 1 . 2]" 1
920 1 52 GLN HA 1 52 GLN HG3 . . 4.010 3.698 3.534 3.939 . 0 0 "[ . 1 . 2]" 1
921 1 52 GLN QB 1 52 GLN QG . . 2.300 2.064 2.020 2.086 . 0 0 "[ . 1 . 2]" 1
922 1 52 GLN HB2 1 53 ASP H . . 4.090 3.292 2.726 3.584 . 0 0 "[ . 1 . 2]" 1
923 1 52 GLN HB3 1 53 ASP H . . 4.090 3.908 3.812 4.023 . 0 0 "[ . 1 . 2]" 1
924 1 52 GLN QG 1 53 ASP H . . 3.880 1.908 1.861 1.989 . 0 0 "[ . 1 . 2]" 1
925 1 52 GLN QG 1 53 ASP QB . . 5.180 3.226 2.378 3.766 . 0 0 "[ . 1 . 2]" 1
926 1 52 GLN QG 1 54 LYS H . . 5.200 3.611 2.949 3.868 . 0 0 "[ . 1 . 2]" 1
927 1 52 GLN QG 1 54 LYS HA . . 5.340 5.250 4.882 5.533 0.193 16 0 "[ . 1 . 2]" 1
928 1 53 ASP H 1 53 ASP HB2 . . 3.800 2.858 2.352 3.791 . 0 0 "[ . 1 . 2]" 1
929 1 53 ASP H 1 53 ASP QB . . 3.260 2.641 2.254 3.257 . 0 0 "[ . 1 . 2]" 1
930 1 53 ASP H 1 53 ASP HB3 . . 3.800 3.313 2.655 3.858 0.058 2 0 "[ . 1 . 2]" 1
931 1 53 ASP H 1 54 LYS H . . 3.240 2.136 1.807 2.357 . 0 0 "[ . 1 . 2]" 1
932 1 53 ASP H 1 54 LYS HA . . 4.630 4.238 3.943 4.601 . 0 0 "[ . 1 . 2]" 1
933 1 53 ASP H 1 54 LYS QB . . 5.170 4.714 4.106 5.074 . 0 0 "[ . 1 . 2]" 1
934 1 53 ASP H 1 54 LYS QG . . 5.340 3.985 2.457 5.202 . 0 0 "[ . 1 . 2]" 1
935 1 53 ASP H 1 55 SER H . . 4.590 3.928 3.013 4.661 0.071 15 0 "[ . 1 . 2]" 1
936 1 54 LYS H 1 54 LYS QD . . 4.350 3.256 2.032 4.090 . 0 0 "[ . 1 . 2]" 1
937 1 54 LYS H 1 54 LYS QG . . 2.770 2.632 1.942 3.171 0.401 5 0 "[ . 1 . 2]" 1
938 1 54 LYS H 1 55 SER H . . 3.460 2.870 2.643 3.015 . 0 0 "[ . 1 . 2]" 1
939 1 54 LYS H 1 55 SER HA . . 5.470 5.120 4.697 5.292 . 0 0 "[ . 1 . 2]" 1
940 1 54 LYS H 1 56 GLY H . . 4.800 4.368 2.939 4.855 0.055 7 0 "[ . 1 . 2]" 1
941 1 54 LYS HA 1 54 LYS QB . . 2.630 2.359 2.275 2.439 . 0 0 "[ . 1 . 2]" 1
942 1 54 LYS HA 1 54 LYS QD . . 2.700 2.512 1.997 3.181 0.481 20 0 "[ . 1 . 2]" 1
943 1 54 LYS HA 1 54 LYS QG . . 3.380 2.730 2.290 3.212 . 0 0 "[ . 1 . 2]" 1
944 1 54 LYS HA 1 56 GLY H . . 4.360 3.388 2.940 4.381 0.021 4 0 "[ . 1 . 2]" 1
945 1 54 LYS HA 1 57 PHE H . . 5.500 5.183 4.366 5.584 0.084 15 0 "[ . 1 . 2]" 1
946 1 54 LYS QD 1 54 LYS QG . . 2.260 2.032 1.997 2.084 . 0 0 "[ . 1 . 2]" 1
947 1 55 SER H 1 55 SER HB2 . . 3.930 3.016 2.312 3.598 . 0 0 "[ . 1 . 2]" 1
948 1 55 SER H 1 55 SER QB . . 3.180 2.668 2.207 3.195 0.015 4 0 "[ . 1 . 2]" 1
949 1 55 SER H 1 55 SER HB3 . . 3.930 3.356 2.230 4.084 0.154 13 0 "[ . 1 . 2]" 1
950 1 55 SER H 1 56 GLY H . . 3.550 2.622 2.312 2.750 . 0 0 "[ . 1 . 2]" 1
951 1 55 SER H 1 56 GLY QA . . 5.040 4.538 4.371 4.659 . 0 0 "[ . 1 . 2]" 1
952 1 55 SER H 1 57 PHE H . . 5.170 4.262 3.194 5.348 0.178 17 0 "[ . 1 . 2]" 1
953 1 55 SER HA 1 57 PHE H . . 5.500 4.860 4.362 5.402 . 0 0 "[ . 1 . 2]" 1
954 1 55 SER QB 1 57 PHE H . . 4.340 3.470 2.706 4.375 0.035 10 0 "[ . 1 . 2]" 1
955 1 56 GLY H 1 57 PHE H . . 3.290 2.773 2.052 3.332 0.042 10 0 "[ . 1 . 2]" 1
956 1 57 PHE H 1 57 PHE HB2 . . 3.390 2.794 2.380 3.037 . 0 0 "[ . 1 . 2]" 1
957 1 57 PHE H 1 57 PHE QD . . 3.660 3.098 2.440 3.495 . 0 0 "[ . 1 . 2]" 1
958 1 57 PHE H 1 57 PHE QE . . 5.470 4.874 4.145 5.272 . 0 0 "[ . 1 . 2]" 1
959 1 57 PHE H 1 58 ILE H . . 4.880 4.333 3.983 4.510 . 0 0 "[ . 1 . 2]" 1
960 1 57 PHE H 1 58 ILE HA . . 5.500 4.843 4.547 5.461 . 0 0 "[ . 1 . 2]" 1
961 1 57 PHE HA 1 57 PHE QD . . 3.230 2.772 2.397 3.002 . 0 0 "[ . 1 . 2]" 1
962 1 57 PHE HA 1 58 ILE H . . 3.280 2.319 2.140 2.702 . 0 0 "[ . 1 . 2]" 1
963 1 57 PHE HA 1 58 ILE HB . . 5.120 4.432 4.331 4.547 . 0 0 "[ . 1 . 2]" 1
964 1 57 PHE HA 1 58 ILE HG13 . . 4.290 4.002 3.474 4.449 0.159 10 0 "[ . 1 . 2]" 1
965 1 57 PHE HA 1 96 LYS QB . . 5.310 3.910 3.119 4.346 . 0 0 "[ . 1 . 2]" 1
966 1 57 PHE HA 1 97 ILE H . . 4.850 4.181 3.303 4.950 0.100 16 0 "[ . 1 . 2]" 1
967 1 57 PHE HA 1 98 GLY QA . . 4.850 2.651 2.304 3.060 . 0 0 "[ . 1 . 2]" 1
968 1 57 PHE HB2 1 59 GLU QG . . 5.340 4.059 2.377 5.401 0.061 13 0 "[ . 1 . 2]" 1
969 1 57 PHE HB2 1 96 LYS QB . . 4.430 2.958 2.209 3.732 . 0 0 "[ . 1 . 2]" 1
970 1 57 PHE HB2 1 96 LYS HD2 . . 3.820 2.733 2.009 3.902 0.082 16 0 "[ . 1 . 2]" 1
971 1 57 PHE HB2 1 96 LYS HD3 . . 3.820 3.101 2.211 3.839 0.019 14 0 "[ . 1 . 2]" 1
972 1 57 PHE HB3 1 57 PHE QD . . 3.440 2.459 2.354 2.653 . 0 0 "[ . 1 . 2]" 1
973 1 57 PHE HB3 1 58 ILE H . . 3.630 2.884 2.011 3.881 0.251 17 0 "[ . 1 . 2]" 1
974 1 57 PHE HB3 1 59 GLU QG . . 5.340 4.372 2.639 5.403 0.063 13 0 "[ . 1 . 2]" 1
975 1 57 PHE HB3 1 96 LYS QB . . 3.590 2.090 1.873 2.483 . 0 0 "[ . 1 . 2]" 1
976 1 57 PHE HB3 1 96 LYS HD2 . . 4.570 2.796 2.031 3.869 . 0 0 "[ . 1 . 2]" 1
977 1 57 PHE HB3 1 96 LYS QD . . 3.870 2.573 1.980 3.450 . 0 0 "[ . 1 . 2]" 1
978 1 57 PHE HB3 1 96 LYS HD3 . . 4.570 3.406 1.987 4.564 . 0 0 "[ . 1 . 2]" 1
979 1 57 PHE HB3 1 96 LYS HG2 . . 5.500 4.223 2.861 4.989 . 0 0 "[ . 1 . 2]" 1
980 1 57 PHE HB3 1 96 LYS HG3 . . 5.500 3.912 1.999 5.104 . 0 0 "[ . 1 . 2]" 1
981 1 57 PHE HB3 1 97 ILE H . . 4.080 3.374 2.604 3.909 . 0 0 "[ . 1 . 2]" 1
982 1 57 PHE HB3 1 98 GLY H . . 5.280 4.920 4.347 5.348 0.068 17 0 "[ . 1 . 2]" 1
983 1 57 PHE QD 1 96 LYS QB . . 4.260 3.587 3.012 4.045 . 0 0 "[ . 1 . 2]" 1
984 1 57 PHE QD 1 97 ILE H . . 5.090 4.387 3.941 5.056 . 0 0 "[ . 1 . 2]" 1
985 1 57 PHE QD 1 98 GLY H . . 4.550 3.363 2.618 4.090 . 0 0 "[ . 1 . 2]" 1
986 1 57 PHE QD 1 98 GLY QA . . 3.020 2.574 2.006 2.879 . 0 0 "[ . 1 . 2]" 1
987 1 57 PHE QE 1 98 GLY QA . . 4.610 3.233 2.587 3.868 . 0 0 "[ . 1 . 2]" 1
988 1 58 ILE H 1 58 ILE HB . . 3.530 2.454 2.201 2.870 . 0 0 "[ . 1 . 2]" 1
989 1 58 ILE H 1 58 ILE MD . . 5.500 3.966 3.560 4.420 . 0 0 "[ . 1 . 2]" 1
990 1 58 ILE H 1 58 ILE HG12 . . 4.300 4.105 3.613 4.341 0.041 11 0 "[ . 1 . 2]" 1
991 1 58 ILE H 1 58 ILE HG13 . . 3.700 2.981 2.352 3.365 . 0 0 "[ . 1 . 2]" 1
992 1 58 ILE H 1 97 ILE H . . 3.890 2.620 1.930 3.908 0.018 16 0 "[ . 1 . 2]" 1
993 1 58 ILE H 1 97 ILE HB . . 4.380 4.002 3.476 4.380 0.000 20 0 "[ . 1 . 2]" 1
994 1 58 ILE HA 1 58 ILE HG12 . . 3.060 2.465 2.372 2.572 . 0 0 "[ . 1 . 2]" 1
995 1 58 ILE HA 1 62 GLU H . . 5.270 4.787 4.488 5.028 . 0 0 "[ . 1 . 2]" 1
996 1 58 ILE HA 1 62 GLU HB2 . . 3.810 3.437 3.046 3.801 . 0 0 "[ . 1 . 2]" 1
997 1 58 ILE HA 1 62 GLU HB3 . . 4.610 3.850 3.307 4.182 . 0 0 "[ . 1 . 2]" 1
998 1 58 ILE HA 1 62 GLU QG . . 5.340 4.432 3.997 4.863 . 0 0 "[ . 1 . 2]" 1
999 1 58 ILE HB 1 97 ILE H . . 4.420 3.305 3.019 3.960 . 0 0 "[ . 1 . 2]" 1
1000 1 58 ILE HB 1 97 ILE HB . . 3.880 3.135 2.912 3.360 . 0 0 "[ . 1 . 2]" 1
1001 1 58 ILE HB 1 97 ILE MG . . 4.990 3.993 3.444 4.133 . 0 0 "[ . 1 . 2]" 1
1002 1 58 ILE MD 1 58 ILE MG . . 3.380 2.043 1.894 2.208 . 0 0 "[ . 1 . 2]" 1
1003 1 58 ILE HG13 1 59 GLU H . . 5.290 4.872 4.705 5.053 . 0 0 "[ . 1 . 2]" 1
1004 1 58 ILE MG 1 62 GLU H . . 5.070 3.259 2.859 3.532 . 0 0 "[ . 1 . 2]" 1
1005 1 58 ILE MG 1 62 GLU HA . . 5.500 4.033 3.853 4.198 . 0 0 "[ . 1 . 2]" 1
1006 1 58 ILE MG 1 62 GLU HB2 . . 3.880 2.464 2.131 2.682 . 0 0 "[ . 1 . 2]" 1
1007 1 58 ILE MG 1 62 GLU HB3 . . 4.080 2.158 1.905 2.380 . 0 0 "[ . 1 . 2]" 1
1008 1 58 ILE MG 1 62 GLU QG . . 5.340 3.684 3.607 3.816 . 0 0 "[ . 1 . 2]" 1
1009 1 58 ILE MG 1 63 LEU H . . 4.300 3.002 2.399 3.199 . 0 0 "[ . 1 . 2]" 1
1010 1 58 ILE MG 1 63 LEU HA . . 4.280 2.602 2.428 2.785 . 0 0 "[ . 1 . 2]" 1
1011 1 58 ILE MG 1 63 LEU HB2 . . 4.950 2.670 2.370 2.968 . 0 0 "[ . 1 . 2]" 1
1012 1 58 ILE MG 1 63 LEU HB3 . . 5.500 4.042 3.816 4.272 . 0 0 "[ . 1 . 2]" 1
1013 1 58 ILE MG 1 63 LEU MD2 . . 5.500 3.732 3.701 3.787 . 0 0 "[ . 1 . 2]" 1
1014 1 58 ILE MG 1 63 LEU HG . . 4.500 4.119 4.004 4.219 . 0 0 "[ . 1 . 2]" 1
1015 1 58 ILE MG 1 97 ILE HB . . 5.500 3.710 3.291 3.891 . 0 0 "[ . 1 . 2]" 1
1016 1 59 GLU H 1 59 GLU QB . . 3.470 2.624 2.098 3.374 . 0 0 "[ . 1 . 2]" 1
1017 1 59 GLU H 1 96 LYS HA . . 5.390 4.381 2.843 4.836 . 0 0 "[ . 1 . 2]" 1
1018 1 59 GLU HA 1 60 GLU H . . 2.880 2.492 2.388 2.724 . 0 0 "[ . 1 . 2]" 1
1019 1 59 GLU QB 1 60 GLU H . . 2.630 2.280 2.068 2.480 . 0 0 "[ . 1 . 2]" 1
1020 1 59 GLU QB 1 61 GLU H . . 4.910 2.449 2.105 2.848 . 0 0 "[ . 1 . 2]" 1
1021 1 59 GLU HB2 1 60 GLU H . . 3.460 3.289 2.310 3.611 0.151 18 0 "[ . 1 . 2]" 1
1022 1 59 GLU HB3 1 60 GLU H . . 3.460 2.381 2.101 3.497 0.037 13 0 "[ . 1 . 2]" 1
1023 1 59 GLU QG 1 96 LYS QB . . 4.850 2.650 1.935 4.148 . 0 0 "[ . 1 . 2]" 1
1024 1 59 GLU QG 1 96 LYS QG . . 4.020 2.856 1.888 4.057 0.037 8 0 "[ . 1 . 2]" 1
1025 1 60 GLU H 1 60 GLU HB2 . . 2.520 2.357 2.261 2.526 0.006 18 0 "[ . 1 . 2]" 1
1026 1 60 GLU H 1 60 GLU HG2 . . 4.570 4.336 4.270 4.419 . 0 0 "[ . 1 . 2]" 1
1027 1 60 GLU H 1 60 GLU HG3 . . 4.740 4.488 4.315 4.596 . 0 0 "[ . 1 . 2]" 1
1028 1 60 GLU H 1 61 GLU H . . 3.970 2.723 2.558 2.879 . 0 0 "[ . 1 . 2]" 1
1029 1 60 GLU H 1 61 GLU HA . . 5.340 5.272 5.079 5.429 0.089 7 0 "[ . 1 . 2]" 1
1030 1 60 GLU H 1 62 GLU H . . 5.080 4.626 4.454 5.039 . 0 0 "[ . 1 . 2]" 1
1031 1 60 GLU H 1 63 LEU HB2 . . 4.550 4.228 4.056 4.488 . 0 0 "[ . 1 . 2]" 1
1032 1 60 GLU H 1 63 LEU HB3 . . 5.500 5.059 4.648 5.525 0.025 18 0 "[ . 1 . 2]" 1
1033 1 60 GLU H 1 96 LYS HA . . 4.630 4.046 3.620 4.593 . 0 0 "[ . 1 . 2]" 1
1034 1 60 GLU HA 1 60 GLU HG2 . . 2.780 2.302 2.224 2.407 . 0 0 "[ . 1 . 2]" 1
1035 1 60 GLU HA 1 60 GLU HG3 . . 3.930 3.441 3.107 3.537 . 0 0 "[ . 1 . 2]" 1
1036 1 60 GLU HA 1 61 GLU QG . . 5.300 5.207 5.073 5.295 . 0 0 "[ . 1 . 2]" 1
1037 1 60 GLU HA 1 62 GLU H . . 4.960 4.490 4.399 4.859 . 0 0 "[ . 1 . 2]" 1
1038 1 60 GLU HA 1 63 LEU H . . 4.080 3.221 3.135 3.370 . 0 0 "[ . 1 . 2]" 1
1039 1 60 GLU HA 1 63 LEU HB2 . . 4.140 2.282 2.172 2.459 . 0 0 "[ . 1 . 2]" 1
1040 1 60 GLU HA 1 63 LEU HB3 . . 2.970 2.393 2.049 2.766 . 0 0 "[ . 1 . 2]" 1
1041 1 60 GLU HA 1 63 LEU MD1 . . 4.370 4.035 3.944 4.078 . 0 0 "[ . 1 . 2]" 1
1042 1 60 GLU HA 1 63 LEU MD2 . . 5.500 2.576 2.445 2.687 . 0 0 "[ . 1 . 2]" 1
1043 1 60 GLU HA 1 63 LEU HG . . 4.660 4.499 4.278 4.670 0.010 18 0 "[ . 1 . 2]" 1
1044 1 60 GLU HA 1 82 THR MG . . 4.810 3.170 2.992 3.281 . 0 0 "[ . 1 . 2]" 1
1045 1 60 GLU HA 1 86 LEU MD1 . . 3.420 2.162 1.977 2.271 . 0 0 "[ . 1 . 2]" 1
1046 1 60 GLU HA 1 86 LEU MD2 . . 5.470 4.707 4.494 4.807 . 0 0 "[ . 1 . 2]" 1
1047 1 60 GLU HB2 1 82 THR MG . . 5.500 4.364 4.291 4.425 . 0 0 "[ . 1 . 2]" 1
1048 1 60 GLU HB2 1 86 LEU MD1 . . 5.490 2.033 1.927 2.156 . 0 0 "[ . 1 . 2]" 1
1049 1 60 GLU HB2 1 86 LEU MD2 . . 4.340 3.825 3.659 4.018 . 0 0 "[ . 1 . 2]" 1
1050 1 60 GLU HB2 1 86 LEU HG . . 5.150 4.645 4.511 4.814 . 0 0 "[ . 1 . 2]" 1
1051 1 60 GLU HB3 1 61 GLU H . . 3.310 3.019 2.476 3.311 0.001 18 0 "[ . 1 . 2]" 1
1052 1 60 GLU HB3 1 82 THR MG . . 5.460 4.564 4.404 4.727 . 0 0 "[ . 1 . 2]" 1
1053 1 60 GLU HG2 1 61 GLU H . . 4.790 4.747 4.375 4.822 0.032 12 0 "[ . 1 . 2]" 1
1054 1 60 GLU HG2 1 63 LEU H . . 5.430 4.791 4.626 5.087 . 0 0 "[ . 1 . 2]" 1
1055 1 60 GLU HG2 1 82 THR MG . . 3.040 2.033 1.944 2.155 . 0 0 "[ . 1 . 2]" 1
1056 1 60 GLU HG2 1 86 LEU MD2 . . 5.500 5.014 4.913 5.055 . 0 0 "[ . 1 . 2]" 1
1057 1 60 GLU HG3 1 61 GLU H . . 5.500 5.370 4.892 5.542 0.042 6 0 "[ . 1 . 2]" 1
1058 1 60 GLU HG3 1 82 THR MG . . 4.030 3.408 3.130 3.582 . 0 0 "[ . 1 . 2]" 1
1059 1 60 GLU HG3 1 86 LEU MD1 . . 4.410 2.634 2.020 2.883 . 0 0 "[ . 1 . 2]" 1
1060 1 60 GLU HG3 1 86 LEU MD2 . . 4.880 4.516 3.886 4.599 . 0 0 "[ . 1 . 2]" 1
1061 1 61 GLU H 1 61 GLU QG . . 3.700 2.258 1.977 2.469 . 0 0 "[ . 1 . 2]" 1
1062 1 61 GLU H 1 62 GLU H . . 3.570 2.699 2.530 3.019 . 0 0 "[ . 1 . 2]" 1
1063 1 61 GLU H 1 63 LEU H . . 4.900 3.600 3.509 3.824 . 0 0 "[ . 1 . 2]" 1
1064 1 61 GLU HB2 1 62 GLU H . . 2.550 2.453 2.169 2.518 . 0 0 "[ . 1 . 2]" 1
1065 1 62 GLU H 1 62 GLU HB2 . . 2.600 2.175 2.100 2.226 . 0 0 "[ . 1 . 2]" 1
1066 1 62 GLU H 1 62 GLU QG . . 4.340 3.827 3.498 4.024 . 0 0 "[ . 1 . 2]" 1
1067 1 62 GLU H 1 63 LEU H . . 3.290 2.361 2.217 2.458 . 0 0 "[ . 1 . 2]" 1
1068 1 62 GLU H 1 63 LEU HA . . 5.190 4.864 4.774 5.004 . 0 0 "[ . 1 . 2]" 1
1069 1 62 GLU H 1 63 LEU HB2 . . 4.380 4.148 4.056 4.409 0.029 13 0 "[ . 1 . 2]" 1
1070 1 62 GLU H 1 63 LEU HB3 . . 5.460 5.021 4.893 5.191 . 0 0 "[ . 1 . 2]" 1
1071 1 62 GLU HA 1 62 GLU QG . . 2.370 2.263 2.083 2.433 0.063 2 0 "[ . 1 . 2]" 1
1072 1 62 GLU HA 1 64 GLN H . . 5.050 3.818 3.629 3.976 . 0 0 "[ . 1 . 2]" 1
1073 1 62 GLU HA 1 65 LEU H . . 3.950 3.883 3.759 3.956 0.006 13 0 "[ . 1 . 2]" 1
1074 1 62 GLU HA 1 65 LEU HB2 . . 4.130 4.127 3.914 4.221 0.091 7 0 "[ . 1 . 2]" 1
1075 1 62 GLU HA 1 65 LEU MD1 . . 3.960 2.322 2.142 2.446 . 0 0 "[ . 1 . 2]" 1
1076 1 62 GLU HA 1 65 LEU HG . . 3.000 2.690 2.478 2.863 . 0 0 "[ . 1 . 2]" 1
1077 1 62 GLU HB2 1 63 LEU H . . 3.720 3.617 3.277 3.748 0.028 17 0 "[ . 1 . 2]" 1
1078 1 62 GLU HB3 1 62 GLU QG . . 2.520 2.185 2.134 2.452 . 0 0 "[ . 1 . 2]" 1
1079 1 62 GLU HB3 1 63 LEU H . . 4.000 3.754 3.308 4.014 0.014 18 0 "[ . 1 . 2]" 1
1080 1 62 GLU HB3 1 65 LEU H . . 4.990 5.034 4.757 5.091 0.101 18 0 "[ . 1 . 2]" 1
1081 1 62 GLU QG 1 63 LEU H . . 5.070 4.795 4.681 4.870 . 0 0 "[ . 1 . 2]" 1
1082 1 62 GLU QG 1 65 LEU MD1 . . 5.340 2.210 1.937 2.679 . 0 0 "[ . 1 . 2]" 1
1083 1 62 GLU QG 1 65 LEU MD2 . . 5.340 4.560 4.374 4.641 . 0 0 "[ . 1 . 2]" 1
1084 1 63 LEU H 1 63 LEU HB2 . . 3.260 2.289 2.159 2.374 . 0 0 "[ . 1 . 2]" 1
1085 1 63 LEU H 1 63 LEU HB3 . . 3.390 2.814 2.708 2.928 . 0 0 "[ . 1 . 2]" 1
1086 1 63 LEU H 1 63 LEU MD1 . . 4.170 3.669 3.455 3.822 . 0 0 "[ . 1 . 2]" 1
1087 1 63 LEU H 1 63 LEU HG . . 4.800 4.567 4.532 4.600 . 0 0 "[ . 1 . 2]" 1
1088 1 63 LEU H 1 64 GLN H . . 3.530 2.444 2.337 2.698 . 0 0 "[ . 1 . 2]" 1
1089 1 63 LEU H 1 64 GLN HA . . 5.410 5.062 4.983 5.280 . 0 0 "[ . 1 . 2]" 1
1090 1 63 LEU H 1 64 GLN HB3 . . 5.500 4.557 4.473 4.857 . 0 0 "[ . 1 . 2]" 1
1091 1 63 LEU H 1 65 LEU H . . 5.070 4.028 3.903 4.203 . 0 0 "[ . 1 . 2]" 1
1092 1 63 LEU H 1 65 LEU HG . . 5.200 4.582 4.286 4.931 . 0 0 "[ . 1 . 2]" 1
1093 1 63 LEU H 1 82 THR MG . . 5.500 4.111 3.956 4.450 . 0 0 "[ . 1 . 2]" 1
1094 1 63 LEU HA 1 63 LEU MD1 . . 3.370 2.175 2.082 2.300 . 0 0 "[ . 1 . 2]" 1
1095 1 63 LEU HA 1 63 LEU MD2 . . 4.780 3.831 3.807 3.860 . 0 0 "[ . 1 . 2]" 1
1096 1 63 LEU HA 1 65 LEU H . . 3.910 3.366 3.303 3.436 . 0 0 "[ . 1 . 2]" 1
1097 1 63 LEU HA 1 66 PHE HB2 . . 4.340 3.772 3.537 3.983 . 0 0 "[ . 1 . 2]" 1
1098 1 63 LEU HA 1 82 THR MG . . 5.500 4.088 3.966 4.268 . 0 0 "[ . 1 . 2]" 1
1099 1 63 LEU HB2 1 63 LEU MD1 . . 3.530 2.249 2.169 2.305 . 0 0 "[ . 1 . 2]" 1
1100 1 63 LEU HB2 1 64 GLN H . . 4.630 3.778 3.599 3.905 . 0 0 "[ . 1 . 2]" 1
1101 1 63 LEU HB3 1 63 LEU MD2 . . 2.890 2.163 2.125 2.220 . 0 0 "[ . 1 . 2]" 1
1102 1 63 LEU HB3 1 64 GLN H . . 5.500 2.974 2.892 3.053 . 0 0 "[ . 1 . 2]" 1
1103 1 63 LEU HB3 1 65 LEU H . . 5.050 4.689 4.643 4.720 . 0 0 "[ . 1 . 2]" 1
1104 1 63 LEU HB3 1 82 THR HA . . 4.740 4.285 4.013 4.726 . 0 0 "[ . 1 . 2]" 1
1105 1 63 LEU HB3 1 82 THR MG . . 3.180 2.116 1.940 2.494 . 0 0 "[ . 1 . 2]" 1
1106 1 63 LEU MD1 1 85 PHE HB3 . . 5.500 4.171 3.992 4.371 . 0 0 "[ . 1 . 2]" 1
1107 1 63 LEU MD1 1 85 PHE HD2 . . 4.530 2.345 2.177 2.546 . 0 0 "[ . 1 . 2]" 1
1108 1 63 LEU MD1 1 85 PHE HE2 . . 4.710 1.987 1.935 2.129 . 0 0 "[ . 1 . 2]" 1
1109 1 63 LEU MD1 1 86 LEU HA . . 3.700 3.587 3.534 3.639 . 0 0 "[ . 1 . 2]" 1
1110 1 63 LEU MD1 1 86 LEU HB3 . . 5.500 5.379 5.352 5.412 . 0 0 "[ . 1 . 2]" 1
1111 1 63 LEU MD1 1 86 LEU MD1 . . 5.360 3.605 3.472 3.743 . 0 0 "[ . 1 . 2]" 1
1112 1 63 LEU MD1 1 86 LEU HG . . 4.030 3.508 3.320 3.629 . 0 0 "[ . 1 . 2]" 1
1113 1 63 LEU MD1 1 97 ILE H . . 5.450 4.190 3.877 4.677 . 0 0 "[ . 1 . 2]" 1
1114 1 63 LEU MD1 1 97 ILE HB . . 3.570 2.934 2.683 3.232 . 0 0 "[ . 1 . 2]" 1
1115 1 63 LEU MD1 1 97 ILE MD . . 3.200 2.083 1.892 2.221 . 0 0 "[ . 1 . 2]" 1
1116 1 63 LEU MD1 1 97 ILE MG . . 5.500 3.655 3.382 3.887 . 0 0 "[ . 1 . 2]" 1
1117 1 63 LEU MD2 1 82 THR HA . . 5.500 3.181 3.040 3.438 . 0 0 "[ . 1 . 2]" 1
1118 1 63 LEU MD2 1 82 THR MG . . 4.660 2.244 2.082 2.373 . 0 0 "[ . 1 . 2]" 1
1119 1 63 LEU MD2 1 85 PHE HB3 . . 4.290 2.630 2.331 2.899 . 0 0 "[ . 1 . 2]" 1
1120 1 63 LEU MD2 1 85 PHE HD2 . . 4.500 2.129 2.008 2.188 . 0 0 "[ . 1 . 2]" 1
1121 1 63 LEU MD2 1 85 PHE HE2 . . 5.500 3.812 3.757 3.858 . 0 0 "[ . 1 . 2]" 1
1122 1 63 LEU MD2 1 86 LEU H . . 4.430 2.580 2.460 2.750 . 0 0 "[ . 1 . 2]" 1
1123 1 63 LEU MD2 1 86 LEU HA . . 5.120 2.398 2.223 2.511 . 0 0 "[ . 1 . 2]" 1
1124 1 63 LEU MD2 1 86 LEU HB2 . . 4.950 1.886 1.856 1.910 . 0 0 "[ . 1 . 2]" 1
1125 1 63 LEU MD2 1 86 LEU HB3 . . 5.390 3.223 3.206 3.242 . 0 0 "[ . 1 . 2]" 1
1126 1 63 LEU MD2 1 86 LEU MD1 . . 5.500 1.876 1.833 1.953 . 0 0 "[ . 1 . 2]" 1
1127 1 63 LEU HG 1 82 THR HA . . 5.400 3.653 3.447 3.818 . 0 0 "[ . 1 . 2]" 1
1128 1 63 LEU HG 1 82 THR HB . . 5.500 5.467 5.192 5.563 0.063 7 0 "[ . 1 . 2]" 1
1129 1 63 LEU HG 1 82 THR MG . . 3.260 2.702 2.426 2.815 . 0 0 "[ . 1 . 2]" 1
1130 1 63 LEU HG 1 85 PHE HB3 . . 5.340 3.522 3.336 3.652 . 0 0 "[ . 1 . 2]" 1
1131 1 64 GLN H 1 64 GLN HB3 . . 2.890 2.397 2.352 2.422 . 0 0 "[ . 1 . 2]" 1
1132 1 64 GLN H 1 64 GLN HG3 . . 4.250 3.628 3.508 3.918 . 0 0 "[ . 1 . 2]" 1
1133 1 64 GLN H 1 65 LEU H . . 3.200 2.635 2.625 2.661 . 0 0 "[ . 1 . 2]" 1
1134 1 64 GLN H 1 65 LEU MD2 . . 5.500 4.364 4.122 4.630 . 0 0 "[ . 1 . 2]" 1
1135 1 64 GLN H 1 82 THR MG . . 4.350 3.130 2.985 3.273 . 0 0 "[ . 1 . 2]" 1
1136 1 64 GLN HA 1 64 GLN HB2 . . 2.400 2.357 2.329 2.371 . 0 0 "[ . 1 . 2]" 1
1137 1 64 GLN HA 1 66 PHE H . . 4.520 3.467 3.432 3.517 . 0 0 "[ . 1 . 2]" 1
1138 1 64 GLN HA 1 77 LEU H . . 3.980 2.706 2.613 2.884 . 0 0 "[ . 1 . 2]" 1
1139 1 64 GLN HA 1 77 LEU HB2 . . 4.220 1.978 1.929 2.067 . 0 0 "[ . 1 . 2]" 1
1140 1 64 GLN HA 1 77 LEU HB3 . . 3.730 3.501 3.473 3.559 . 0 0 "[ . 1 . 2]" 1
1141 1 64 GLN HA 1 77 LEU MD1 . . 3.350 2.444 2.194 2.537 . 0 0 "[ . 1 . 2]" 1
1142 1 64 GLN HA 1 77 LEU MD2 . . 5.500 3.657 3.641 3.693 . 0 0 "[ . 1 . 2]" 1
1143 1 64 GLN HA 1 78 THR H . . 5.500 5.462 5.314 5.548 0.048 15 0 "[ . 1 . 2]" 1
1144 1 64 GLN HA 1 82 THR HA . . 5.500 4.481 4.344 4.621 . 0 0 "[ . 1 . 2]" 1
1145 1 64 GLN HA 1 82 THR MG . . 3.710 2.147 1.960 2.258 . 0 0 "[ . 1 . 2]" 1
1146 1 64 GLN HB2 1 65 LEU H . . 4.830 4.383 4.358 4.489 . 0 0 "[ . 1 . 2]" 1
1147 1 64 GLN HB2 1 65 LEU HG . . 5.260 4.931 4.793 5.060 . 0 0 "[ . 1 . 2]" 1
1148 1 64 GLN HB2 1 76 VAL HA . . 5.500 4.269 4.184 4.390 . 0 0 "[ . 1 . 2]" 1
1149 1 64 GLN HB3 1 64 GLN HG2 . . 2.660 2.468 2.418 2.636 . 0 0 "[ . 1 . 2]" 1
1150 1 64 GLN HB3 1 65 LEU H . . 4.180 4.215 4.161 4.273 0.093 13 0 "[ . 1 . 2]" 1
1151 1 64 GLN HB3 1 65 LEU HG . . 5.500 4.742 4.680 4.810 . 0 0 "[ . 1 . 2]" 1
1152 1 64 GLN HB3 1 82 THR MG . . 3.800 2.927 2.792 3.041 . 0 0 "[ . 1 . 2]" 1
1153 1 64 GLN HG2 1 65 LEU H . . 3.290 3.217 2.890 3.326 0.036 9 0 "[ . 1 . 2]" 1
1154 1 64 GLN HG2 1 65 LEU HB2 . . 5.500 4.974 4.663 5.164 . 0 0 "[ . 1 . 2]" 1
1155 1 64 GLN HG2 1 65 LEU HB3 . . 5.370 5.280 4.793 5.424 0.054 15 0 "[ . 1 . 2]" 1
1156 1 64 GLN HG2 1 65 LEU MD2 . . 5.200 2.636 2.071 3.020 . 0 0 "[ . 1 . 2]" 1
1157 1 64 GLN HG2 1 65 LEU HG . . 4.970 2.610 2.391 2.788 . 0 0 "[ . 1 . 2]" 1
1158 1 64 GLN HG2 1 76 VAL HB . . 5.230 4.116 3.965 4.295 . 0 0 "[ . 1 . 2]" 1
1159 1 64 GLN HG2 1 76 VAL MG1 . . 5.500 3.360 3.187 3.467 . 0 0 "[ . 1 . 2]" 1
1160 1 64 GLN HG2 1 76 VAL MG2 . . 5.500 4.960 4.726 5.112 . 0 0 "[ . 1 . 2]" 1
1161 1 64 GLN HG2 1 82 THR MG . . 5.500 4.613 4.563 4.680 . 0 0 "[ . 1 . 2]" 1
1162 1 64 GLN HG3 1 65 LEU HG . . 4.930 3.045 2.728 3.669 . 0 0 "[ . 1 . 2]" 1
1163 1 64 GLN HG3 1 76 VAL HA . . 4.030 3.994 3.705 4.094 0.064 8 0 "[ . 1 . 2]" 1
1164 1 64 GLN HG3 1 76 VAL HB . . 3.070 2.568 2.275 2.826 . 0 0 "[ . 1 . 2]" 1
1165 1 64 GLN HG3 1 76 VAL MG1 . . 4.050 1.939 1.888 2.017 . 0 0 "[ . 1 . 2]" 1
1166 1 64 GLN HG3 1 77 LEU H . . 4.050 3.760 3.390 3.912 . 0 0 "[ . 1 . 2]" 1
1167 1 64 GLN HG3 1 77 LEU HB2 . . 4.880 4.918 4.658 4.990 0.110 11 0 "[ . 1 . 2]" 1
1168 1 65 LEU H 1 65 LEU HB2 . . 3.340 2.767 2.695 2.879 . 0 0 "[ . 1 . 2]" 1
1169 1 65 LEU H 1 65 LEU MD1 . . 5.160 3.633 3.545 3.818 . 0 0 "[ . 1 . 2]" 1
1170 1 65 LEU H 1 65 LEU MD2 . . 5.500 3.402 3.237 3.563 . 0 0 "[ . 1 . 2]" 1
1171 1 65 LEU H 1 65 LEU HG . . 2.540 2.253 2.107 2.460 . 0 0 "[ . 1 . 2]" 1
1172 1 65 LEU H 1 66 PHE H . . 3.040 2.532 2.437 2.664 . 0 0 "[ . 1 . 2]" 1
1173 1 65 LEU H 1 66 PHE HB2 . . 5.020 4.417 4.322 4.491 . 0 0 "[ . 1 . 2]" 1
1174 1 65 LEU H 1 66 PHE HB3 . . 5.500 4.833 4.726 4.906 . 0 0 "[ . 1 . 2]" 1
1175 1 65 LEU H 1 67 LEU H . . 5.500 4.705 4.611 4.814 . 0 0 "[ . 1 . 2]" 1
1176 1 65 LEU H 1 77 LEU H . . 5.500 4.570 4.527 4.626 . 0 0 "[ . 1 . 2]" 1
1177 1 65 LEU H 1 77 LEU HB2 . . 5.430 5.195 5.132 5.248 . 0 0 "[ . 1 . 2]" 1
1178 1 65 LEU H 1 77 LEU MD1 . . 4.610 4.217 4.105 4.284 . 0 0 "[ . 1 . 2]" 1
1179 1 65 LEU H 1 77 LEU MD2 . . 5.500 4.919 4.785 4.984 . 0 0 "[ . 1 . 2]" 1
1180 1 65 LEU HA 1 67 LEU H . . 4.700 3.307 3.117 3.503 . 0 0 "[ . 1 . 2]" 1
1181 1 65 LEU HA 1 68 LYS H . . 4.080 3.515 3.133 3.715 . 0 0 "[ . 1 . 2]" 1
1182 1 65 LEU HA 1 68 LYS QD . . 5.220 3.819 3.127 4.490 . 0 0 "[ . 1 . 2]" 1
1183 1 65 LEU HA 1 76 VAL MG1 . . 4.700 2.585 2.436 2.776 . 0 0 "[ . 1 . 2]" 1
1184 1 65 LEU HB2 1 65 LEU MD1 . . 2.520 2.226 2.099 2.308 . 0 0 "[ . 1 . 2]" 1
1185 1 65 LEU HB2 1 66 PHE H . . 4.230 3.912 3.858 4.032 . 0 0 "[ . 1 . 2]" 1
1186 1 65 LEU HB2 1 68 LYS H . . 5.500 4.621 4.323 4.827 . 0 0 "[ . 1 . 2]" 1
1187 1 65 LEU HB3 1 68 LYS H . . 4.190 4.079 3.838 4.200 0.010 15 0 "[ . 1 . 2]" 1
1188 1 65 LEU HB3 1 68 LYS HA . . 5.500 5.399 5.147 5.523 0.023 9 0 "[ . 1 . 2]" 1
1189 1 65 LEU HB3 1 68 LYS QB . . 3.480 2.793 2.303 3.087 . 0 0 "[ . 1 . 2]" 1
1190 1 65 LEU HB3 1 68 LYS HG3 . . 3.180 2.197 1.979 2.573 . 0 0 "[ . 1 . 2]" 1
1191 1 65 LEU HB3 1 76 VAL MG1 . . 4.400 3.813 3.673 3.983 . 0 0 "[ . 1 . 2]" 1
1192 1 65 LEU MD1 1 68 LYS HG3 . . 4.440 3.967 3.735 4.171 . 0 0 "[ . 1 . 2]" 1
1193 1 65 LEU MD2 1 66 PHE H . . 5.500 4.651 4.582 4.743 . 0 0 "[ . 1 . 2]" 1
1194 1 65 LEU MD2 1 68 LYS H . . 5.500 5.040 4.684 5.165 . 0 0 "[ . 1 . 2]" 1
1195 1 65 LEU MD2 1 68 LYS QD . . 4.770 3.814 2.154 4.409 . 0 0 "[ . 1 . 2]" 1
1196 1 65 LEU MD2 1 68 LYS HE2 . . 5.420 4.082 2.650 4.875 . 0 0 "[ . 1 . 2]" 1
1197 1 65 LEU MD2 1 68 LYS QE . . 4.590 3.300 2.550 4.195 . 0 0 "[ . 1 . 2]" 1
1198 1 65 LEU MD2 1 68 LYS HE3 . . 5.420 3.668 2.889 4.603 . 0 0 "[ . 1 . 2]" 1
1199 1 65 LEU MD2 1 76 VAL HA . . 5.500 3.697 3.434 3.851 . 0 0 "[ . 1 . 2]" 1
1200 1 65 LEU HG 1 76 VAL MG1 . . 5.420 3.683 3.510 3.900 . 0 0 "[ . 1 . 2]" 1
1201 1 66 PHE H 1 66 PHE HB2 . . 3.980 2.618 2.568 2.709 . 0 0 "[ . 1 . 2]" 1
1202 1 66 PHE H 1 66 PHE HB3 . . 2.550 2.456 2.407 2.500 . 0 0 "[ . 1 . 2]" 1
1203 1 66 PHE H 1 66 PHE HD2 . . 4.650 4.615 4.506 4.677 0.027 14 0 "[ . 1 . 2]" 1
1204 1 66 PHE H 1 67 LEU H . . 4.050 2.580 2.464 2.606 . 0 0 "[ . 1 . 2]" 1
1205 1 66 PHE H 1 69 ASN H . . 5.500 5.423 5.121 5.584 0.084 19 0 "[ . 1 . 2]" 1
1206 1 66 PHE H 1 77 LEU HB2 . . 4.730 4.762 4.715 4.781 0.051 15 0 "[ . 1 . 2]" 1
1207 1 66 PHE H 1 77 LEU HB3 . . 5.480 5.492 5.446 5.527 0.047 14 0 "[ . 1 . 2]" 1
1208 1 66 PHE H 1 77 LEU MD1 . . 4.580 3.132 3.013 3.201 . 0 0 "[ . 1 . 2]" 1
1209 1 66 PHE H 1 77 LEU MD2 . . 4.880 3.118 2.958 3.235 . 0 0 "[ . 1 . 2]" 1
1210 1 66 PHE HA 1 66 PHE HB2 . . 3.010 2.428 2.401 2.449 . 0 0 "[ . 1 . 2]" 1
1211 1 66 PHE HA 1 66 PHE HD1 . . 3.960 2.874 2.770 3.014 . 0 0 "[ . 1 . 2]" 1
1212 1 66 PHE HA 1 68 LYS H . . 4.490 3.606 3.479 3.883 . 0 0 "[ . 1 . 2]" 1
1213 1 66 PHE HA 1 69 ASN H . . 3.940 3.717 3.486 3.840 . 0 0 "[ . 1 . 2]" 1
1214 1 66 PHE HA 1 69 ASN QB . . 5.340 3.843 3.213 4.252 . 0 0 "[ . 1 . 2]" 1
1215 1 66 PHE HA 1 70 PHE H . . 5.500 5.386 4.999 5.585 0.085 19 0 "[ . 1 . 2]" 1
1216 1 66 PHE HA 1 77 LEU MD1 . . 5.500 4.545 4.446 4.615 . 0 0 "[ . 1 . 2]" 1
1217 1 66 PHE HA 1 77 LEU MD2 . . 4.790 4.410 4.341 4.498 . 0 0 "[ . 1 . 2]" 1
1218 1 66 PHE HB2 1 66 PHE HD1 . . 3.230 2.472 2.419 2.514 . 0 0 "[ . 1 . 2]" 1
1219 1 66 PHE HB3 1 66 PHE HD2 . . 3.460 2.371 2.343 2.413 . 0 0 "[ . 1 . 2]" 1
1220 1 66 PHE HB3 1 67 LEU H . . 3.910 3.022 2.838 3.227 . 0 0 "[ . 1 . 2]" 1
1221 1 66 PHE HB3 1 67 LEU MD2 . . 5.500 4.662 4.079 4.972 . 0 0 "[ . 1 . 2]" 1
1222 1 66 PHE HB3 1 77 LEU MD1 . . 3.340 2.049 1.958 2.212 . 0 0 "[ . 1 . 2]" 1
1223 1 66 PHE HB3 1 77 LEU MD2 . . 4.820 1.998 1.961 2.115 . 0 0 "[ . 1 . 2]" 1
1224 1 66 PHE HD2 1 67 LEU H . . 4.210 3.910 3.691 4.142 . 0 0 "[ . 1 . 2]" 1
1225 1 66 PHE HD2 1 67 LEU HA . . 3.680 3.620 3.396 3.693 0.013 19 0 "[ . 1 . 2]" 1
1226 1 66 PHE HD2 1 67 LEU HG . . 3.860 3.075 2.686 3.266 . 0 0 "[ . 1 . 2]" 1
1227 1 66 PHE HD2 1 68 LYS H . . 5.500 5.527 5.490 5.550 0.050 14 0 "[ . 1 . 2]" 1
1228 1 66 PHE HD2 1 77 LEU MD2 . . 5.500 2.617 2.475 2.792 . 0 0 "[ . 1 . 2]" 1
1229 1 67 LEU H 1 67 LEU HB2 . . 4.000 2.245 2.163 2.427 . 0 0 "[ . 1 . 2]" 1
1230 1 67 LEU H 1 67 LEU QB . . 3.370 2.220 2.142 2.393 . 0 0 "[ . 1 . 2]" 1
1231 1 67 LEU H 1 67 LEU HB3 . . 4.000 3.526 3.468 3.630 . 0 0 "[ . 1 . 2]" 1
1232 1 67 LEU H 1 67 LEU MD1 . . 4.710 3.840 3.741 3.969 . 0 0 "[ . 1 . 2]" 1
1233 1 67 LEU H 1 67 LEU MD2 . . 5.140 3.961 3.729 4.096 . 0 0 "[ . 1 . 2]" 1
1234 1 67 LEU H 1 67 LEU HG . . 3.470 3.032 2.669 3.279 . 0 0 "[ . 1 . 2]" 1
1235 1 67 LEU H 1 68 LYS H . . 3.450 2.454 2.276 2.532 . 0 0 "[ . 1 . 2]" 1
1236 1 67 LEU H 1 68 LYS HA . . 5.500 4.934 4.841 5.033 . 0 0 "[ . 1 . 2]" 1
1237 1 67 LEU H 1 68 LYS QD . . 5.340 4.710 4.018 5.362 0.022 19 0 "[ . 1 . 2]" 1
1238 1 67 LEU H 1 68 LYS HG2 . . 4.270 3.449 3.209 3.972 . 0 0 "[ . 1 . 2]" 1
1239 1 67 LEU H 1 69 ASN H . . 4.780 4.216 3.974 4.579 . 0 0 "[ . 1 . 2]" 1
1240 1 67 LEU H 1 70 PHE HD1 . . 5.500 5.263 5.083 5.376 . 0 0 "[ . 1 . 2]" 1
1241 1 67 LEU H 1 74 ALA MB . . 5.500 4.621 4.411 4.805 . 0 0 "[ . 1 . 2]" 1
1242 1 67 LEU H 1 76 VAL HA . . 5.500 4.065 3.736 4.276 . 0 0 "[ . 1 . 2]" 1
1243 1 67 LEU H 1 76 VAL MG1 . . 5.500 4.867 4.584 5.092 . 0 0 "[ . 1 . 2]" 1
1244 1 67 LEU H 1 77 LEU MD1 . . 5.420 4.168 3.967 4.368 . 0 0 "[ . 1 . 2]" 1
1245 1 67 LEU H 1 77 LEU MD2 . . 4.720 2.609 2.428 2.848 . 0 0 "[ . 1 . 2]" 1
1246 1 67 LEU H 1 77 LEU HG . . 4.540 3.521 3.313 3.718 . 0 0 "[ . 1 . 2]" 1
1247 1 67 LEU HA 1 67 LEU MD2 . . 3.750 2.188 2.116 2.269 . 0 0 "[ . 1 . 2]" 1
1248 1 67 LEU HA 1 69 ASN H . . 4.500 3.872 3.751 4.511 0.011 4 0 "[ . 1 . 2]" 1
1249 1 67 LEU HA 1 70 PHE H . . 3.940 3.543 3.387 3.850 . 0 0 "[ . 1 . 2]" 1
1250 1 67 LEU HA 1 70 PHE HB2 . . 4.310 3.201 2.718 3.574 . 0 0 "[ . 1 . 2]" 1
1251 1 67 LEU HA 1 70 PHE HD1 . . 3.800 3.595 3.031 3.860 0.060 9 0 "[ . 1 . 2]" 1
1252 1 67 LEU QB 1 67 LEU MD1 . . 2.380 2.045 2.030 2.068 . 0 0 "[ . 1 . 2]" 1
1253 1 67 LEU QB 1 67 LEU MD2 . . 2.540 2.188 2.170 2.222 . 0 0 "[ . 1 . 2]" 1
1254 1 67 LEU QB 1 67 LEU HG . . 2.630 2.376 2.358 2.386 . 0 0 "[ . 1 . 2]" 1
1255 1 67 LEU QB 1 68 LYS H . . 4.190 3.358 3.049 3.483 . 0 0 "[ . 1 . 2]" 1
1256 1 67 LEU QB 1 74 ALA MB . . 3.380 1.906 1.831 2.072 . 0 0 "[ . 1 . 2]" 1
1257 1 67 LEU QB 1 76 VAL HA . . 5.340 3.363 3.018 3.656 . 0 0 "[ . 1 . 2]" 1
1258 1 67 LEU QB 1 77 LEU MD2 . . 5.340 2.642 2.385 3.080 . 0 0 "[ . 1 . 2]" 1
1259 1 67 LEU HB2 1 68 LYS H . . 5.000 3.581 3.225 3.760 . 0 0 "[ . 1 . 2]" 1
1260 1 67 LEU HB3 1 68 LYS H . . 5.000 4.067 3.757 4.260 . 0 0 "[ . 1 . 2]" 1
1261 1 67 LEU MD1 1 76 VAL H . . 5.220 4.043 3.495 4.384 . 0 0 "[ . 1 . 2]" 1
1262 1 67 LEU MD1 1 76 VAL HA . . 5.500 3.940 3.654 4.275 . 0 0 "[ . 1 . 2]" 1
1263 1 67 LEU MD1 1 77 LEU MD1 . . 5.500 4.377 4.334 4.414 . 0 0 "[ . 1 . 2]" 1
1264 1 67 LEU MD1 1 77 LEU MD2 . . 4.040 2.131 2.047 2.222 . 0 0 "[ . 1 . 2]" 1
1265 1 67 LEU MD2 1 68 LYS H . . 5.500 4.799 4.767 4.816 . 0 0 "[ . 1 . 2]" 1
1266 1 67 LEU MD2 1 74 ALA MB . . 5.030 2.763 2.436 3.147 . 0 0 "[ . 1 . 2]" 1
1267 1 67 LEU HG 1 68 LYS H . . 5.120 4.960 4.638 5.076 . 0 0 "[ . 1 . 2]" 1
1268 1 67 LEU HG 1 77 LEU MD2 . . 4.230 2.015 1.938 2.130 . 0 0 "[ . 1 . 2]" 1
1269 1 68 LYS H 1 68 LYS QB . . 3.140 2.552 2.446 2.706 . 0 0 "[ . 1 . 2]" 1
1270 1 68 LYS H 1 68 LYS HD2 . . 5.500 4.213 3.629 4.893 . 0 0 "[ . 1 . 2]" 1
1271 1 68 LYS H 1 68 LYS HD3 . . 5.500 4.160 3.816 4.712 . 0 0 "[ . 1 . 2]" 1
1272 1 68 LYS H 1 68 LYS HG2 . . 2.400 2.359 2.089 2.491 0.091 9 0 "[ . 1 . 2]" 1
1273 1 68 LYS H 1 69 ASN H . . 3.320 2.216 2.084 2.379 . 0 0 "[ . 1 . 2]" 1
1274 1 68 LYS H 1 69 ASN HA . . 5.500 4.879 4.769 5.043 . 0 0 "[ . 1 . 2]" 1
1275 1 68 LYS H 1 76 VAL HA . . 5.500 5.155 4.628 5.484 . 0 0 "[ . 1 . 2]" 1
1276 1 68 LYS HA 1 68 LYS HG2 . . 3.860 3.036 2.711 3.277 . 0 0 "[ . 1 . 2]" 1
1277 1 68 LYS HA 1 70 PHE H . . 3.950 3.850 3.474 3.980 0.030 10 0 "[ . 1 . 2]" 1
1278 1 68 LYS HA 1 71 SER H . . 3.830 3.767 3.382 3.907 0.077 19 0 "[ . 1 . 2]" 1
1279 1 68 LYS HA 1 72 SER H . . 5.500 5.032 2.502 5.550 0.050 5 0 "[ . 1 . 2]" 1
1280 1 68 LYS HA 1 73 SER H . . 5.500 5.105 3.682 5.618 0.118 11 0 "[ . 1 . 2]" 1
1281 1 68 LYS HA 1 74 ALA MB . . 5.190 4.395 3.555 4.736 . 0 0 "[ . 1 . 2]" 1
1282 1 68 LYS QB 1 68 LYS HG3 . . 2.350 2.160 2.144 2.189 . 0 0 "[ . 1 . 2]" 1
1283 1 68 LYS QB 1 70 PHE H . . 5.340 4.633 4.283 4.762 . 0 0 "[ . 1 . 2]" 1
1284 1 68 LYS QD 1 75 ARG H . . 5.190 4.788 4.044 5.440 0.250 9 0 "[ . 1 . 2]" 1
1285 1 68 LYS QD 1 76 VAL MG1 . . 4.290 3.459 2.499 3.856 . 0 0 "[ . 1 . 2]" 1
1286 1 68 LYS QE 1 75 ARG HA . . 4.530 2.943 2.408 3.667 . 0 0 "[ . 1 . 2]" 1
1287 1 68 LYS QE 1 76 VAL H . . 5.340 5.057 3.959 5.394 0.054 6 0 "[ . 1 . 2]" 1
1288 1 68 LYS QE 1 76 VAL MG1 . . 4.740 3.178 2.493 3.922 . 0 0 "[ . 1 . 2]" 1
1289 1 68 LYS HE2 1 75 ARG HA . . 5.350 3.468 2.434 4.816 . 0 0 "[ . 1 . 2]" 1
1290 1 68 LYS HE2 1 76 VAL MG1 . . 5.500 3.745 2.625 4.877 . 0 0 "[ . 1 . 2]" 1
1291 1 68 LYS HE3 1 75 ARG HA . . 5.350 3.932 2.540 4.957 . 0 0 "[ . 1 . 2]" 1
1292 1 68 LYS HE3 1 76 VAL MG1 . . 5.500 3.688 2.564 4.324 . 0 0 "[ . 1 . 2]" 1
1293 1 68 LYS HG2 1 69 ASN H . . 4.520 4.262 4.002 4.429 . 0 0 "[ . 1 . 2]" 1
1294 1 68 LYS HG2 1 76 VAL MG1 . . 4.900 3.609 3.228 4.002 . 0 0 "[ . 1 . 2]" 1
1295 1 68 LYS HG3 1 76 VAL MG1 . . 4.550 3.531 2.891 4.138 . 0 0 "[ . 1 . 2]" 1
1296 1 69 ASN H 1 69 ASN HB2 . . 3.570 2.745 2.397 2.932 . 0 0 "[ . 1 . 2]" 1
1297 1 69 ASN H 1 69 ASN QB . . 2.910 2.526 2.221 2.808 . 0 0 "[ . 1 . 2]" 1
1298 1 69 ASN H 1 69 ASN HB3 . . 3.570 3.205 2.308 3.650 0.080 2 0 "[ . 1 . 2]" 1
1299 1 69 ASN H 1 70 PHE H . . 3.240 2.347 2.259 2.545 . 0 0 "[ . 1 . 2]" 1
1300 1 69 ASN H 1 70 PHE HA . . 5.200 5.001 4.860 5.182 . 0 0 "[ . 1 . 2]" 1
1301 1 69 ASN H 1 70 PHE HB2 . . 4.780 4.441 4.063 4.697 . 0 0 "[ . 1 . 2]" 1
1302 1 69 ASN H 1 70 PHE HD1 . . 3.600 3.189 2.825 3.585 . 0 0 "[ . 1 . 2]" 1
1303 1 69 ASN H 1 71 SER H . . 4.380 4.062 3.821 4.400 0.020 12 0 "[ . 1 . 2]" 1
1304 1 69 ASN HA 1 70 PHE H . . 3.490 3.369 3.131 3.456 . 0 0 "[ . 1 . 2]" 1
1305 1 69 ASN QB 1 70 PHE H . . 3.610 3.186 2.987 3.579 . 0 0 "[ . 1 . 2]" 1
1306 1 69 ASN QB 1 70 PHE HD1 . . 2.840 2.550 2.258 2.842 0.002 10 0 "[ . 1 . 2]" 1
1307 1 70 PHE H 1 70 PHE HB2 . . 3.150 2.522 2.418 2.681 . 0 0 "[ . 1 . 2]" 1
1308 1 70 PHE H 1 70 PHE HD1 . . 3.240 2.485 2.196 2.899 . 0 0 "[ . 1 . 2]" 1
1309 1 70 PHE H 1 71 SER H . . 3.030 2.171 1.894 2.341 . 0 0 "[ . 1 . 2]" 1
1310 1 70 PHE H 1 71 SER HA . . 4.900 4.754 4.537 4.900 . 0 0 "[ . 1 . 2]" 1
1311 1 70 PHE H 1 71 SER QB . . 4.960 4.416 3.856 4.933 . 0 0 "[ . 1 . 2]" 1
1312 1 70 PHE HA 1 70 PHE HD1 . . 4.440 3.661 3.420 3.931 . 0 0 "[ . 1 . 2]" 1
1313 1 70 PHE HA 1 70 PHE HD2 . . 4.130 3.390 3.105 3.592 . 0 0 "[ . 1 . 2]" 1
1314 1 70 PHE HA 1 71 SER QB . . 5.340 5.058 4.959 5.351 0.011 2 0 "[ . 1 . 2]" 1
1315 1 70 PHE HB2 1 71 SER H . . 3.400 2.462 2.342 2.657 . 0 0 "[ . 1 . 2]" 1
1316 1 70 PHE HB3 1 71 SER H . . 5.500 3.423 3.259 3.603 . 0 0 "[ . 1 . 2]" 1
1317 1 70 PHE HD1 1 71 SER H . . 4.340 4.078 3.744 4.337 . 0 0 "[ . 1 . 2]" 1
1318 1 71 SER H 1 71 SER HB2 . . 3.990 2.927 2.246 3.822 . 0 0 "[ . 1 . 2]" 1
1319 1 71 SER H 1 71 SER QB . . 3.420 2.528 2.196 3.130 . 0 0 "[ . 1 . 2]" 1
1320 1 71 SER H 1 71 SER HB3 . . 3.990 2.963 2.648 3.481 . 0 0 "[ . 1 . 2]" 1
1321 1 71 SER H 1 72 SER H . . 4.510 4.164 2.112 4.525 0.015 13 0 "[ . 1 . 2]" 1
1322 1 71 SER H 1 72 SER HA . . 5.010 4.906 4.349 5.032 0.022 13 0 "[ . 1 . 2]" 1
1323 1 71 SER H 1 74 ALA H . . 5.280 5.230 4.717 5.336 0.056 11 0 "[ . 1 . 2]" 1
1324 1 71 SER H 1 74 ALA MB . . 4.650 4.388 4.134 4.491 . 0 0 "[ . 1 . 2]" 1
1325 1 71 SER HA 1 72 SER H . . 3.390 2.553 2.274 3.554 0.164 19 0 "[ . 1 . 2]" 1
1326 1 71 SER QB 1 72 SER H . . 3.170 2.876 2.325 3.170 0.000 8 0 "[ . 1 . 2]" 1
1327 1 71 SER QB 1 73 SER H . . 4.370 2.628 2.040 3.104 . 0 0 "[ . 1 . 2]" 1
1328 1 71 SER QB 1 74 ALA H . . 3.380 2.723 1.983 3.380 . 0 0 "[ . 1 . 2]" 1
1329 1 71 SER QB 1 74 ALA MB . . 4.510 2.828 2.291 3.805 . 0 0 "[ . 1 . 2]" 1
1330 1 71 SER HB2 1 74 ALA MB . . 5.130 3.616 2.844 4.178 . 0 0 "[ . 1 . 2]" 1
1331 1 71 SER HB3 1 74 ALA MB . . 5.130 3.068 2.336 4.381 . 0 0 "[ . 1 . 2]" 1
1332 1 72 SER H 1 72 SER QB . . 3.680 2.708 2.341 3.431 . 0 0 "[ . 1 . 2]" 1
1333 1 72 SER H 1 73 SER H . . 3.970 2.270 1.957 2.629 . 0 0 "[ . 1 . 2]" 1
1334 1 72 SER H 1 74 ALA H . . 4.900 4.042 3.672 4.327 . 0 0 "[ . 1 . 2]" 1
1335 1 72 SER H 1 74 ALA MB . . 5.500 4.955 4.238 5.149 . 0 0 "[ . 1 . 2]" 1
1336 1 73 SER H 1 73 SER HB2 . . 3.000 2.883 2.681 3.003 0.003 20 0 "[ . 1 . 2]" 1
1337 1 73 SER H 1 73 SER QB . . 2.600 2.455 2.160 2.658 0.058 19 0 "[ . 1 . 2]" 1
1338 1 73 SER H 1 73 SER HB3 . . 3.000 2.687 2.216 3.000 0.000 19 0 "[ . 1 . 2]" 1
1339 1 73 SER H 1 74 ALA H . . 2.700 2.065 1.843 2.596 . 0 0 "[ . 1 . 2]" 1
1340 1 73 SER H 1 74 ALA MB . . 4.630 3.715 3.427 4.166 . 0 0 "[ . 1 . 2]" 1
1341 1 73 SER HA 1 73 SER QB . . 2.590 2.398 2.239 2.473 . 0 0 "[ . 1 . 2]" 1
1342 1 73 SER QB 1 74 ALA H . . 3.710 2.630 2.407 2.848 . 0 0 "[ . 1 . 2]" 1
1343 1 74 ALA H 1 74 ALA MB . . 3.080 2.149 2.027 2.233 . 0 0 "[ . 1 . 2]" 1
1344 1 74 ALA H 1 75 ARG H . . 4.580 4.455 4.321 4.594 0.014 4 0 "[ . 1 . 2]" 1
1345 1 74 ALA HA 1 74 ALA MB . . 2.600 2.109 2.083 2.127 . 0 0 "[ . 1 . 2]" 1
1346 1 74 ALA HA 1 75 ARG H . . 2.970 2.297 2.153 2.691 . 0 0 "[ . 1 . 2]" 1
1347 1 74 ALA HA 1 75 ARG QG . . 5.340 3.402 3.296 3.546 . 0 0 "[ . 1 . 2]" 1
1348 1 74 ALA HA 1 76 VAL H . . 4.900 4.737 3.985 5.151 0.251 9 0 "[ . 1 . 2]" 1
1349 1 74 ALA MB 1 75 ARG H . . 3.820 2.931 1.905 3.442 . 0 0 "[ . 1 . 2]" 1
1350 1 74 ALA MB 1 76 VAL H . . 5.500 3.896 3.351 4.206 . 0 0 "[ . 1 . 2]" 1
1351 1 74 ALA MB 1 76 VAL HA . . 5.050 4.351 4.176 4.616 . 0 0 "[ . 1 . 2]" 1
1352 1 75 ARG H 1 75 ARG HB2 . . 3.620 3.507 2.945 3.607 . 0 0 "[ . 1 . 2]" 1
1353 1 75 ARG H 1 75 ARG QB . . 3.160 2.868 2.581 3.202 0.042 13 0 "[ . 1 . 2]" 1
1354 1 75 ARG H 1 75 ARG HB3 . . 3.620 3.092 2.646 3.582 . 0 0 "[ . 1 . 2]" 1
1355 1 75 ARG H 1 75 ARG HD2 . . 4.650 4.303 3.696 4.678 0.028 13 0 "[ . 1 . 2]" 1
1356 1 75 ARG H 1 75 ARG HD3 . . 4.650 4.341 3.137 4.667 0.017 13 0 "[ . 1 . 2]" 1
1357 1 75 ARG H 1 75 ARG QG . . 2.550 1.906 1.789 1.985 . 0 0 "[ . 1 . 2]" 1
1358 1 75 ARG H 1 76 VAL H . . 4.480 2.968 2.397 3.319 . 0 0 "[ . 1 . 2]" 1
1359 1 75 ARG HA 1 75 ARG HD2 . . 5.500 4.937 4.544 5.484 . 0 0 "[ . 1 . 2]" 1
1360 1 75 ARG HA 1 75 ARG HD3 . . 5.500 4.877 4.207 5.510 0.010 12 0 "[ . 1 . 2]" 1
1361 1 75 ARG HA 1 76 VAL MG2 . . 4.320 4.078 3.906 4.131 . 0 0 "[ . 1 . 2]" 1
1362 1 75 ARG QB 1 75 ARG QD . . 2.660 2.123 1.964 2.395 . 0 0 "[ . 1 . 2]" 1
1363 1 75 ARG QB 1 76 VAL H . . 3.420 2.483 1.921 3.150 . 0 0 "[ . 1 . 2]" 1
1364 1 75 ARG HB2 1 75 ARG HD2 . . 3.840 2.751 2.035 3.605 . 0 0 "[ . 1 . 2]" 1
1365 1 75 ARG HB2 1 75 ARG HD3 . . 3.840 2.817 2.035 3.755 . 0 0 "[ . 1 . 2]" 1
1366 1 75 ARG HB2 1 76 VAL H . . 3.930 2.535 1.931 3.338 . 0 0 "[ . 1 . 2]" 1
1367 1 75 ARG HB3 1 75 ARG HD2 . . 3.840 3.324 2.442 3.909 0.069 6 0 "[ . 1 . 2]" 1
1368 1 75 ARG HB3 1 75 ARG HD3 . . 3.840 3.077 2.067 3.676 . 0 0 "[ . 1 . 2]" 1
1369 1 75 ARG HB3 1 76 VAL H . . 3.930 3.666 3.462 3.865 . 0 0 "[ . 1 . 2]" 1
1370 1 75 ARG QD 1 76 VAL H . . 4.390 2.968 2.381 4.062 . 0 0 "[ . 1 . 2]" 1
1371 1 75 ARG QD 1 76 VAL MG2 . . 4.330 2.754 2.344 3.826 . 0 0 "[ . 1 . 2]" 1
1372 1 75 ARG HD2 1 76 VAL H . . 5.090 3.339 2.451 4.581 . 0 0 "[ . 1 . 2]" 1
1373 1 75 ARG HD3 1 76 VAL H . . 5.090 3.723 2.414 5.083 . 0 0 "[ . 1 . 2]" 1
1374 1 75 ARG QG 1 76 VAL H . . 2.980 1.952 1.865 3.099 0.119 11 0 "[ . 1 . 2]" 1
1375 1 75 ARG QG 1 76 VAL HA . . 5.340 4.560 4.164 5.502 0.162 11 0 "[ . 1 . 2]" 1
1376 1 75 ARG QG 1 76 VAL MG2 . . 5.340 3.303 1.921 4.060 . 0 0 "[ . 1 . 2]" 1
1377 1 76 VAL H 1 76 VAL HB . . 3.960 3.878 3.866 3.902 . 0 0 "[ . 1 . 2]" 1
1378 1 76 VAL H 1 76 VAL MG2 . . 3.570 2.422 2.360 2.512 . 0 0 "[ . 1 . 2]" 1
1379 1 76 VAL H 1 77 LEU H . . 4.440 4.366 4.288 4.385 . 0 0 "[ . 1 . 2]" 1
1380 1 76 VAL HA 1 76 VAL MG1 . . 2.400 2.121 2.064 2.180 . 0 0 "[ . 1 . 2]" 1
1381 1 76 VAL HA 1 77 LEU H . . 3.260 2.398 2.279 2.547 . 0 0 "[ . 1 . 2]" 1
1382 1 76 VAL HB 1 77 LEU H . . 2.730 2.421 2.088 2.748 0.018 9 0 "[ . 1 . 2]" 1
1383 1 76 VAL MG1 1 77 LEU H . . 3.630 3.347 3.183 3.417 . 0 0 "[ . 1 . 2]" 1
1384 1 76 VAL MG2 1 77 LEU H . . 4.960 3.728 3.526 3.962 . 0 0 "[ . 1 . 2]" 1
1385 1 77 LEU H 1 77 LEU HB2 . . 2.690 2.563 2.457 2.620 . 0 0 "[ . 1 . 2]" 1
1386 1 77 LEU H 1 77 LEU HB3 . . 3.820 3.588 3.584 3.597 . 0 0 "[ . 1 . 2]" 1
1387 1 77 LEU H 1 77 LEU MD1 . . 4.490 3.818 3.779 3.864 . 0 0 "[ . 1 . 2]" 1
1388 1 77 LEU H 1 77 LEU MD2 . . 5.100 2.656 2.506 3.056 . 0 0 "[ . 1 . 2]" 1
1389 1 77 LEU H 1 77 LEU HG . . 3.560 2.293 2.210 2.430 . 0 0 "[ . 1 . 2]" 1
1390 1 77 LEU H 1 78 THR H . . 4.800 4.629 4.593 4.643 . 0 0 "[ . 1 . 2]" 1
1391 1 77 LEU HA 1 77 LEU MD2 . . 3.760 2.034 2.011 2.069 . 0 0 "[ . 1 . 2]" 1
1392 1 77 LEU HA 1 78 THR H . . 3.290 2.427 2.385 2.497 . 0 0 "[ . 1 . 2]" 1
1393 1 77 LEU HA 1 78 THR MG . . 5.500 3.917 3.144 4.154 . 0 0 "[ . 1 . 2]" 1
1394 1 77 LEU HA 1 81 GLU H . . 5.500 4.961 4.803 5.082 . 0 0 "[ . 1 . 2]" 1
1395 1 77 LEU HA 1 81 GLU HG2 . . 5.500 5.196 4.976 5.441 . 0 0 "[ . 1 . 2]" 1
1396 1 77 LEU HA 1 82 THR H . . 5.440 4.533 4.428 4.615 . 0 0 "[ . 1 . 2]" 1
1397 1 77 LEU HB2 1 78 THR H . . 3.850 3.517 3.365 3.614 . 0 0 "[ . 1 . 2]" 1
1398 1 77 LEU HB2 1 82 THR HA . . 5.010 3.992 3.888 4.098 . 0 0 "[ . 1 . 2]" 1
1399 1 77 LEU HB2 1 82 THR HB . . 4.870 4.206 4.117 4.250 . 0 0 "[ . 1 . 2]" 1
1400 1 77 LEU HB3 1 77 LEU MD1 . . 3.570 2.138 2.114 2.193 . 0 0 "[ . 1 . 2]" 1
1401 1 77 LEU HB3 1 78 THR H . . 3.730 2.366 2.232 2.456 . 0 0 "[ . 1 . 2]" 1
1402 1 77 LEU HB3 1 78 THR HA . . 5.500 4.515 4.470 4.557 . 0 0 "[ . 1 . 2]" 1
1403 1 77 LEU HB3 1 80 ALA H . . 5.270 4.658 4.596 4.703 . 0 0 "[ . 1 . 2]" 1
1404 1 77 LEU HB3 1 81 GLU H . . 4.460 3.861 3.776 4.047 . 0 0 "[ . 1 . 2]" 1
1405 1 77 LEU HB3 1 81 GLU HG2 . . 5.370 5.060 4.860 5.313 . 0 0 "[ . 1 . 2]" 1
1406 1 77 LEU HB3 1 82 THR H . . 4.190 2.371 2.316 2.434 . 0 0 "[ . 1 . 2]" 1
1407 1 77 LEU HB3 1 82 THR HA . . 4.960 3.496 3.383 3.580 . 0 0 "[ . 1 . 2]" 1
1408 1 77 LEU MD1 1 78 THR H . . 4.600 4.091 3.981 4.167 . 0 0 "[ . 1 . 2]" 1
1409 1 77 LEU MD1 1 81 GLU H . . 5.290 4.533 4.494 4.599 . 0 0 "[ . 1 . 2]" 1
1410 1 77 LEU MD1 1 82 THR H . . 4.690 2.760 2.701 2.828 . 0 0 "[ . 1 . 2]" 1
1411 1 77 LEU MD1 1 82 THR HA . . 4.110 1.885 1.869 1.902 . 0 0 "[ . 1 . 2]" 1
1412 1 77 LEU MD1 1 82 THR HB . . 4.770 3.732 3.683 3.787 . 0 0 "[ . 1 . 2]" 1
1413 1 77 LEU MD1 1 82 THR MG . . 4.220 1.947 1.866 2.059 . 0 0 "[ . 1 . 2]" 1
1414 1 77 LEU MD1 1 85 PHE H . . 5.500 4.549 4.486 4.607 . 0 0 "[ . 1 . 2]" 1
1415 1 77 LEU MD2 1 78 THR H . . 4.330 3.524 3.378 3.594 . 0 0 "[ . 1 . 2]" 1
1416 1 77 LEU MD2 1 81 GLU HB2 . . 5.370 2.499 2.365 2.637 . 0 0 "[ . 1 . 2]" 1
1417 1 77 LEU MD2 1 81 GLU HB3 . . 5.500 2.314 2.029 2.578 . 0 0 "[ . 1 . 2]" 1
1418 1 77 LEU MD2 1 82 THR H . . 5.400 4.078 3.929 4.169 . 0 0 "[ . 1 . 2]" 1
1419 1 77 LEU MD2 1 82 THR HA . . 5.500 4.267 4.221 4.308 . 0 0 "[ . 1 . 2]" 1
1420 1 77 LEU HG 1 78 THR H . . 4.840 4.976 4.914 5.019 0.179 18 0 "[ . 1 . 2]" 1
1421 1 78 THR H 1 78 THR MG . . 4.220 2.229 2.140 2.362 . 0 0 "[ . 1 . 2]" 1
1422 1 78 THR H 1 79 SER H . . 4.790 4.351 4.314 4.378 . 0 0 "[ . 1 . 2]" 1
1423 1 78 THR H 1 79 SER HA . . 5.500 5.185 5.132 5.237 . 0 0 "[ . 1 . 2]" 1
1424 1 78 THR H 1 80 ALA MB . . 5.500 4.702 4.607 4.787 . 0 0 "[ . 1 . 2]" 1
1425 1 78 THR H 1 81 GLU H . . 3.920 2.923 2.805 3.041 . 0 0 "[ . 1 . 2]" 1
1426 1 78 THR H 1 81 GLU HA . . 5.180 4.886 4.771 5.062 . 0 0 "[ . 1 . 2]" 1
1427 1 78 THR H 1 81 GLU HB2 . . 3.670 2.220 2.082 2.443 . 0 0 "[ . 1 . 2]" 1
1428 1 78 THR H 1 81 GLU HG2 . . 4.760 4.333 3.773 4.635 . 0 0 "[ . 1 . 2]" 1
1429 1 78 THR H 1 81 GLU HG3 . . 4.280 2.804 2.095 3.150 . 0 0 "[ . 1 . 2]" 1
1430 1 78 THR H 1 82 THR H . . 4.530 3.147 2.998 3.278 . 0 0 "[ . 1 . 2]" 1
1431 1 78 THR HA 1 79 SER H . . 3.570 2.722 2.691 2.763 . 0 0 "[ . 1 . 2]" 1
1432 1 78 THR HA 1 79 SER HA . . 4.330 4.331 4.329 4.336 0.006 13 0 "[ . 1 . 2]" 1
1433 1 78 THR HA 1 80 ALA H . . 4.780 4.501 4.419 4.554 . 0 0 "[ . 1 . 2]" 1
1434 1 78 THR HA 1 81 GLU H . . 5.000 4.886 4.832 5.067 0.067 6 0 "[ . 1 . 2]" 1
1435 1 78 THR HB 1 81 GLU H . . 4.870 4.859 4.801 4.966 0.096 5 0 "[ . 1 . 2]" 1
1436 1 78 THR MG 1 79 SER H . . 4.870 2.648 2.350 3.744 . 0 0 "[ . 1 . 2]" 1
1437 1 78 THR MG 1 81 GLU H . . 4.080 2.574 2.179 3.914 . 0 0 "[ . 1 . 2]" 1
1438 1 78 THR MG 1 81 GLU HG2 . . 5.500 3.643 3.390 3.847 . 0 0 "[ . 1 . 2]" 1
1439 1 78 THR MG 1 81 GLU HG3 . . 4.600 2.198 2.050 2.406 . 0 0 "[ . 1 . 2]" 1
1440 1 79 SER H 1 79 SER QB . . 3.670 2.443 2.223 2.670 . 0 0 "[ . 1 . 2]" 1
1441 1 79 SER H 1 80 ALA H . . 3.740 3.582 3.477 3.638 . 0 0 "[ . 1 . 2]" 1
1442 1 79 SER H 1 81 GLU H . . 4.800 4.639 4.556 4.795 . 0 0 "[ . 1 . 2]" 1
1443 1 79 SER HA 1 82 THR H . . 4.670 4.660 4.611 4.739 0.069 4 0 "[ . 1 . 2]" 1
1444 1 79 SER HB2 1 80 ALA MB . . 5.500 4.460 3.918 5.093 . 0 0 "[ . 1 . 2]" 1
1445 1 79 SER HB3 1 80 ALA MB . . 5.500 4.652 3.883 5.192 . 0 0 "[ . 1 . 2]" 1
1446 1 80 ALA H 1 81 GLU H . . 3.430 1.975 1.919 2.187 . 0 0 "[ . 1 . 2]" 1
1447 1 80 ALA H 1 81 GLU HB2 . . 5.060 4.085 3.995 4.196 . 0 0 "[ . 1 . 2]" 1
1448 1 80 ALA H 1 81 GLU HG3 . . 4.560 4.244 3.863 4.492 . 0 0 "[ . 1 . 2]" 1
1449 1 80 ALA H 1 82 THR H . . 3.670 2.912 2.868 2.972 . 0 0 "[ . 1 . 2]" 1
1450 1 80 ALA H 1 83 LYS H . . 3.450 3.189 3.072 3.331 . 0 0 "[ . 1 . 2]" 1
1451 1 80 ALA H 1 83 LYS HB2 . . 4.600 4.095 3.913 4.276 . 0 0 "[ . 1 . 2]" 1
1452 1 80 ALA H 1 83 LYS QG . . 5.340 3.301 2.979 3.551 . 0 0 "[ . 1 . 2]" 1
1453 1 80 ALA H 1 84 ALA H . . 4.830 4.605 4.493 4.747 . 0 0 "[ . 1 . 2]" 1
1454 1 80 ALA HA 1 83 LYS H . . 4.150 3.887 3.723 3.945 . 0 0 "[ . 1 . 2]" 1
1455 1 80 ALA HA 1 83 LYS HB2 . . 3.000 2.948 2.767 3.026 0.026 12 0 "[ . 1 . 2]" 1
1456 1 80 ALA MB 1 81 GLU H . . 3.000 2.723 2.505 2.762 . 0 0 "[ . 1 . 2]" 1
1457 1 80 ALA MB 1 81 GLU HG2 . . 3.890 3.563 3.214 3.749 . 0 0 "[ . 1 . 2]" 1
1458 1 80 ALA MB 1 81 GLU HG3 . . 4.080 3.485 3.124 3.743 . 0 0 "[ . 1 . 2]" 1
1459 1 80 ALA MB 1 82 THR H . . 5.500 4.701 4.594 4.749 . 0 0 "[ . 1 . 2]" 1
1460 1 80 ALA MB 1 84 ALA H . . 5.500 4.607 4.489 4.689 . 0 0 "[ . 1 . 2]" 1
1461 1 81 GLU H 1 81 GLU HB2 . . 3.620 2.512 2.397 2.698 . 0 0 "[ . 1 . 2]" 1
1462 1 81 GLU H 1 81 GLU HB3 . . 3.640 3.610 3.600 3.633 . 0 0 "[ . 1 . 2]" 1
1463 1 81 GLU H 1 81 GLU HG2 . . 3.760 3.159 2.639 3.419 . 0 0 "[ . 1 . 2]" 1
1464 1 81 GLU H 1 81 GLU HG3 . . 3.570 2.446 2.155 2.667 . 0 0 "[ . 1 . 2]" 1
1465 1 81 GLU H 1 82 THR H . . 3.530 2.524 2.441 2.624 . 0 0 "[ . 1 . 2]" 1
1466 1 81 GLU H 1 82 THR HA . . 5.500 5.156 5.092 5.235 . 0 0 "[ . 1 . 2]" 1
1467 1 81 GLU H 1 83 LYS H . . 4.500 3.807 3.700 3.908 . 0 0 "[ . 1 . 2]" 1
1468 1 81 GLU HA 1 81 GLU HG2 . . 3.380 2.459 2.351 2.603 . 0 0 "[ . 1 . 2]" 1
1469 1 81 GLU HA 1 81 GLU HG3 . . 3.750 3.378 3.247 3.603 . 0 0 "[ . 1 . 2]" 1
1470 1 81 GLU HA 1 82 THR HA . . 5.500 4.764 4.746 4.785 . 0 0 "[ . 1 . 2]" 1
1471 1 81 GLU HB2 1 81 GLU HG3 . . 2.400 2.316 2.276 2.403 0.003 6 0 "[ . 1 . 2]" 1
1472 1 81 GLU HB2 1 82 THR H . . 3.830 2.436 2.377 2.503 . 0 0 "[ . 1 . 2]" 1
1473 1 81 GLU HB3 1 82 THR H . . 3.990 3.552 3.419 3.752 . 0 0 "[ . 1 . 2]" 1
1474 1 81 GLU HB3 1 82 THR HA . . 5.460 4.426 4.300 4.657 . 0 0 "[ . 1 . 2]" 1
1475 1 81 GLU HG2 1 82 THR H . . 4.880 4.726 4.491 4.826 . 0 0 "[ . 1 . 2]" 1
1476 1 81 GLU HG3 1 82 THR H . . 4.440 4.138 3.866 4.345 . 0 0 "[ . 1 . 2]" 1
1477 1 82 THR H 1 82 THR HB . . 3.290 3.101 3.060 3.139 . 0 0 "[ . 1 . 2]" 1
1478 1 82 THR H 1 83 LYS H . . 3.420 2.614 2.556 2.670 . 0 0 "[ . 1 . 2]" 1
1479 1 82 THR H 1 83 LYS HA . . 5.500 5.239 5.189 5.284 . 0 0 "[ . 1 . 2]" 1
1480 1 82 THR H 1 84 ALA H . . 4.520 4.272 4.225 4.323 . 0 0 "[ . 1 . 2]" 1
1481 1 82 THR H 1 85 PHE HB2 . . 5.500 5.299 5.217 5.383 . 0 0 "[ . 1 . 2]" 1
1482 1 82 THR H 1 85 PHE HB3 . . 5.500 5.116 5.040 5.218 . 0 0 "[ . 1 . 2]" 1
1483 1 82 THR HA 1 82 THR MG . . 3.630 2.042 2.024 2.062 . 0 0 "[ . 1 . 2]" 1
1484 1 82 THR HA 1 83 LYS H . . 3.520 3.518 3.505 3.524 0.004 18 0 "[ . 1 . 2]" 1
1485 1 82 THR HA 1 83 LYS HA . . 4.970 4.743 4.738 4.749 . 0 0 "[ . 1 . 2]" 1
1486 1 82 THR HA 1 84 ALA H . . 5.230 4.719 4.686 4.757 . 0 0 "[ . 1 . 2]" 1
1487 1 82 THR HA 1 85 PHE H . . 4.470 3.657 3.635 3.675 . 0 0 "[ . 1 . 2]" 1
1488 1 82 THR HA 1 85 PHE HB3 . . 3.360 2.742 2.694 2.777 . 0 0 "[ . 1 . 2]" 1
1489 1 82 THR HA 1 85 PHE HD2 . . 5.330 4.227 4.144 4.461 . 0 0 "[ . 1 . 2]" 1
1490 1 82 THR HB 1 83 LYS H . . 3.340 2.880 2.824 2.987 . 0 0 "[ . 1 . 2]" 1
1491 1 82 THR HB 1 83 LYS HA . . 4.220 3.900 3.890 3.909 . 0 0 "[ . 1 . 2]" 1
1492 1 82 THR HB 1 83 LYS QG . . 4.320 3.225 3.112 3.316 . 0 0 "[ . 1 . 2]" 1
1493 1 82 THR MG 1 83 LYS H . . 5.500 4.136 4.103 4.194 . 0 0 "[ . 1 . 2]" 1
1494 1 82 THR MG 1 85 PHE H . . 5.500 4.817 4.773 4.849 . 0 0 "[ . 1 . 2]" 1
1495 1 82 THR MG 1 86 LEU H . . 5.300 4.068 4.023 4.101 . 0 0 "[ . 1 . 2]" 1
1496 1 82 THR MG 1 86 LEU HA . . 5.500 5.172 5.147 5.191 . 0 0 "[ . 1 . 2]" 1
1497 1 82 THR MG 1 86 LEU HB2 . . 5.500 3.399 3.364 3.444 . 0 0 "[ . 1 . 2]" 1
1498 1 82 THR MG 1 86 LEU HB3 . . 5.500 4.724 4.674 4.779 . 0 0 "[ . 1 . 2]" 1
1499 1 82 THR MG 1 86 LEU MD1 . . 4.640 3.113 3.050 3.176 . 0 0 "[ . 1 . 2]" 1
1500 1 83 LYS H 1 83 LYS HB2 . . 2.550 2.536 2.483 2.576 0.026 20 0 "[ . 1 . 2]" 1
1501 1 83 LYS H 1 83 LYS HD2 . . 5.500 4.660 4.399 4.869 . 0 0 "[ . 1 . 2]" 1
1502 1 83 LYS H 1 83 LYS HD3 . . 5.500 4.313 3.928 4.841 . 0 0 "[ . 1 . 2]" 1
1503 1 83 LYS H 1 83 LYS QG . . 2.520 2.203 2.117 2.333 . 0 0 "[ . 1 . 2]" 1
1504 1 83 LYS H 1 84 ALA H . . 2.700 2.601 2.587 2.610 . 0 0 "[ . 1 . 2]" 1
1505 1 83 LYS H 1 84 ALA HA . . 5.500 5.224 5.213 5.232 . 0 0 "[ . 1 . 2]" 1
1506 1 83 LYS H 1 84 ALA MB . . 4.850 4.293 4.275 4.306 . 0 0 "[ . 1 . 2]" 1
1507 1 83 LYS H 1 85 PHE H . . 4.530 3.707 3.670 3.728 . 0 0 "[ . 1 . 2]" 1
1508 1 83 LYS H 1 86 LEU HB2 . . 5.500 5.211 5.147 5.273 . 0 0 "[ . 1 . 2]" 1
1509 1 83 LYS HA 1 83 LYS QD . . 3.960 2.870 2.197 3.796 . 0 0 "[ . 1 . 2]" 1
1510 1 83 LYS HA 1 83 LYS QG . . 2.810 2.650 2.405 2.818 0.008 5 0 "[ . 1 . 2]" 1
1511 1 83 LYS HA 1 84 ALA HA . . 4.960 4.748 4.742 4.756 . 0 0 "[ . 1 . 2]" 1
1512 1 83 LYS HA 1 85 PHE H . . 4.390 3.699 3.658 3.725 . 0 0 "[ . 1 . 2]" 1
1513 1 83 LYS HA 1 86 LEU H . . 4.110 3.453 3.409 3.494 . 0 0 "[ . 1 . 2]" 1
1514 1 83 LYS HA 1 86 LEU HB3 . . 3.830 3.237 3.143 3.292 . 0 0 "[ . 1 . 2]" 1
1515 1 83 LYS HA 1 86 LEU MD2 . . 5.500 4.741 4.601 4.896 . 0 0 "[ . 1 . 2]" 1
1516 1 83 LYS HA 1 87 ALA H . . 3.510 3.227 3.182 3.264 . 0 0 "[ . 1 . 2]" 1
1517 1 83 LYS HA 1 87 ALA MB . . 4.920 3.680 3.615 3.765 . 0 0 "[ . 1 . 2]" 1
1518 1 83 LYS HA 1 88 ALA H . . 5.500 5.507 5.476 5.528 0.028 12 0 "[ . 1 . 2]" 1
1519 1 83 LYS HB2 1 83 LYS HD2 . . 4.130 3.300 2.757 3.692 . 0 0 "[ . 1 . 2]" 1
1520 1 83 LYS HB2 1 83 LYS QD . . 3.530 3.029 2.611 3.271 . 0 0 "[ . 1 . 2]" 1
1521 1 83 LYS HB2 1 83 LYS HD3 . . 4.130 3.549 3.230 3.817 . 0 0 "[ . 1 . 2]" 1
1522 1 83 LYS HB2 1 84 ALA H . . 2.550 2.449 2.411 2.476 . 0 0 "[ . 1 . 2]" 1
1523 1 83 LYS HB2 1 84 ALA MB . . 4.220 3.740 3.700 3.782 . 0 0 "[ . 1 . 2]" 1
1524 1 83 LYS HB2 1 85 PHE H . . 4.750 4.558 4.531 4.579 . 0 0 "[ . 1 . 2]" 1
1525 1 83 LYS HB2 1 87 ALA H . . 5.500 5.510 5.487 5.532 0.032 12 0 "[ . 1 . 2]" 1
1526 1 83 LYS HB3 1 83 LYS HD2 . . 2.910 2.593 2.289 2.900 . 0 0 "[ . 1 . 2]" 1
1527 1 83 LYS HB3 1 83 LYS QD . . 2.520 2.220 2.118 2.310 . 0 0 "[ . 1 . 2]" 1
1528 1 83 LYS HB3 1 83 LYS HD3 . . 2.910 2.544 2.187 2.908 . 0 0 "[ . 1 . 2]" 1
1529 1 83 LYS HB3 1 84 ALA HA . . 5.360 4.462 4.402 4.507 . 0 0 "[ . 1 . 2]" 1
1530 1 83 LYS QE 1 83 LYS QG . . 2.490 2.178 2.058 2.359 . 0 0 "[ . 1 . 2]" 1
1531 1 83 LYS QG 1 84 ALA H . . 4.400 3.877 3.825 3.950 . 0 0 "[ . 1 . 2]" 1
1532 1 84 ALA H 1 84 ALA MB . . 2.960 2.209 2.190 2.221 . 0 0 "[ . 1 . 2]" 1
1533 1 84 ALA H 1 85 PHE H . . 3.130 2.602 2.595 2.611 . 0 0 "[ . 1 . 2]" 1
1534 1 84 ALA H 1 85 PHE HA . . 5.400 5.181 5.171 5.192 . 0 0 "[ . 1 . 2]" 1
1535 1 84 ALA H 1 85 PHE HB2 . . 4.830 4.758 4.706 4.796 . 0 0 "[ . 1 . 2]" 1
1536 1 84 ALA H 1 86 LEU H . . 4.930 4.405 4.382 4.418 . 0 0 "[ . 1 . 2]" 1
1537 1 84 ALA H 1 87 ALA H . . 5.150 5.038 5.009 5.080 . 0 0 "[ . 1 . 2]" 1
1538 1 84 ALA H 1 87 ALA MB . . 5.500 4.896 4.833 4.944 . 0 0 "[ . 1 . 2]" 1
1539 1 84 ALA HA 1 85 PHE HA . . 5.130 4.580 4.568 4.585 . 0 0 "[ . 1 . 2]" 1
1540 1 84 ALA HA 1 86 LEU H . . 5.070 4.894 4.848 4.927 . 0 0 "[ . 1 . 2]" 1
1541 1 84 ALA HA 1 87 ALA H . . 4.450 4.442 4.404 4.474 0.024 4 0 "[ . 1 . 2]" 1
1542 1 84 ALA HA 1 87 ALA MB . . 3.720 3.537 3.492 3.609 . 0 0 "[ . 1 . 2]" 1
1543 1 84 ALA MB 1 85 PHE H . . 3.370 3.153 3.134 3.179 . 0 0 "[ . 1 . 2]" 1
1544 1 84 ALA MB 1 85 PHE HA . . 5.350 4.027 4.013 4.048 . 0 0 "[ . 1 . 2]" 1
1545 1 84 ALA MB 1 85 PHE HB2 . . 4.140 3.981 3.962 3.993 . 0 0 "[ . 1 . 2]" 1
1546 1 85 PHE H 1 85 PHE HB2 . . 3.010 2.788 2.744 2.825 . 0 0 "[ . 1 . 2]" 1
1547 1 85 PHE H 1 85 PHE HB3 . . 3.310 2.620 2.596 2.663 . 0 0 "[ . 1 . 2]" 1
1548 1 85 PHE H 1 85 PHE HD1 . . 5.030 4.856 4.786 4.947 . 0 0 "[ . 1 . 2]" 1
1549 1 85 PHE H 1 85 PHE HD2 . . 5.500 4.750 4.675 4.829 . 0 0 "[ . 1 . 2]" 1
1550 1 85 PHE H 1 86 LEU H . . 2.730 2.218 2.173 2.239 . 0 0 "[ . 1 . 2]" 1
1551 1 85 PHE H 1 86 LEU HB2 . . 5.020 4.284 4.207 4.349 . 0 0 "[ . 1 . 2]" 1
1552 1 85 PHE H 1 86 LEU HB3 . . 4.740 4.685 4.635 4.743 0.003 16 0 "[ . 1 . 2]" 1
1553 1 85 PHE H 1 87 ALA H . . 4.050 3.793 3.721 3.837 . 0 0 "[ . 1 . 2]" 1
1554 1 85 PHE H 1 87 ALA MB . . 5.270 4.632 4.585 4.669 . 0 0 "[ . 1 . 2]" 1
1555 1 85 PHE H 1 88 ALA H . . 4.440 4.214 4.188 4.234 . 0 0 "[ . 1 . 2]" 1
1556 1 85 PHE H 1 88 ALA MB . . 5.500 4.158 4.132 4.190 . 0 0 "[ . 1 . 2]" 1
1557 1 85 PHE HA 1 85 PHE HE1 . . 5.160 4.752 4.687 4.919 . 0 0 "[ . 1 . 2]" 1
1558 1 85 PHE HA 1 88 ALA H . . 4.110 3.678 3.644 3.716 . 0 0 "[ . 1 . 2]" 1
1559 1 85 PHE HA 1 88 ALA HA . . 5.500 5.461 5.393 5.523 0.023 9 0 "[ . 1 . 2]" 1
1560 1 85 PHE HA 1 88 ALA MB . . 3.370 2.528 2.443 2.608 . 0 0 "[ . 1 . 2]" 1
1561 1 85 PHE HB3 1 86 LEU H . . 3.080 2.449 2.423 2.484 . 0 0 "[ . 1 . 2]" 1
1562 1 85 PHE HB3 1 86 LEU HA . . 4.590 4.157 4.109 4.179 . 0 0 "[ . 1 . 2]" 1
1563 1 85 PHE HB3 1 86 LEU HB2 . . 5.500 3.893 3.869 3.933 . 0 0 "[ . 1 . 2]" 1
1564 1 85 PHE HB3 1 89 GLY H . . 5.500 5.563 5.527 5.629 0.129 14 0 "[ . 1 . 2]" 1
1565 1 85 PHE HD1 1 88 ALA MB . . 5.310 4.482 4.314 4.842 . 0 0 "[ . 1 . 2]" 1
1566 1 85 PHE HD2 1 86 LEU H . . 4.830 3.633 3.512 3.763 . 0 0 "[ . 1 . 2]" 1
1567 1 85 PHE HD2 1 89 GLY H . . 5.500 5.397 5.078 5.500 0.000 5 0 "[ . 1 . 2]" 1
1568 1 85 PHE HD2 1 97 ILE MD . . 5.220 2.993 2.428 3.249 . 0 0 "[ . 1 . 2]" 1
1569 1 86 LEU H 1 86 LEU HB2 . . 3.290 2.232 2.196 2.273 . 0 0 "[ . 1 . 2]" 1
1570 1 86 LEU H 1 86 LEU HB3 . . 3.350 2.830 2.781 2.879 . 0 0 "[ . 1 . 2]" 1
1571 1 86 LEU H 1 86 LEU MD1 . . 4.860 3.988 3.952 4.021 . 0 0 "[ . 1 . 2]" 1
1572 1 86 LEU H 1 86 LEU MD2 . . 4.890 4.294 4.265 4.314 . 0 0 "[ . 1 . 2]" 1
1573 1 86 LEU H 1 86 LEU HG . . 4.630 4.263 4.205 4.308 . 0 0 "[ . 1 . 2]" 1
1574 1 86 LEU H 1 87 ALA H . . 2.850 2.742 2.698 2.781 . 0 0 "[ . 1 . 2]" 1
1575 1 86 LEU H 1 87 ALA HA . . 5.500 5.324 5.290 5.352 . 0 0 "[ . 1 . 2]" 1
1576 1 86 LEU H 1 87 ALA MB . . 5.500 4.397 4.359 4.424 . 0 0 "[ . 1 . 2]" 1
1577 1 86 LEU H 1 88 ALA H . . 5.080 3.681 3.656 3.701 . 0 0 "[ . 1 . 2]" 1
1578 1 86 LEU H 1 89 GLY H . . 5.340 4.480 4.423 4.513 . 0 0 "[ . 1 . 2]" 1
1579 1 86 LEU H 1 97 ILE MD . . 4.760 4.148 4.037 4.278 . 0 0 "[ . 1 . 2]" 1
1580 1 86 LEU HA 1 86 LEU HB2 . . 2.620 2.623 2.599 2.648 0.028 17 0 "[ . 1 . 2]" 1
1581 1 86 LEU HA 1 86 LEU MD1 . . 4.670 3.614 3.564 3.675 . 0 0 "[ . 1 . 2]" 1
1582 1 86 LEU HA 1 86 LEU MD2 . . 4.390 3.054 2.914 3.157 . 0 0 "[ . 1 . 2]" 1
1583 1 86 LEU HA 1 86 LEU HG . . 2.550 2.303 2.277 2.326 . 0 0 "[ . 1 . 2]" 1
1584 1 86 LEU HA 1 88 ALA H . . 4.820 3.826 3.759 3.876 . 0 0 "[ . 1 . 2]" 1
1585 1 86 LEU HA 1 89 GLY HA3 . . 5.500 4.042 3.975 4.122 . 0 0 "[ . 1 . 2]" 1
1586 1 86 LEU HA 1 90 ASP H . . 4.230 3.016 2.831 3.098 . 0 0 "[ . 1 . 2]" 1
1587 1 86 LEU HA 1 97 ILE MD . . 2.820 1.916 1.894 1.947 . 0 0 "[ . 1 . 2]" 1
1588 1 86 LEU HA 1 97 ILE MG . . 5.500 4.888 4.807 4.984 . 0 0 "[ . 1 . 2]" 1
1589 1 86 LEU HB2 1 87 ALA H . . 4.260 3.428 3.380 3.477 . 0 0 "[ . 1 . 2]" 1
1590 1 86 LEU HB2 1 87 ALA HA . . 5.500 5.470 5.442 5.492 . 0 0 "[ . 1 . 2]" 1
1591 1 86 LEU HB3 1 87 ALA H . . 2.550 2.272 2.231 2.335 . 0 0 "[ . 1 . 2]" 1
1592 1 86 LEU HB3 1 88 ALA H . . 4.710 4.441 4.418 4.463 . 0 0 "[ . 1 . 2]" 1
1593 1 86 LEU MD1 1 87 ALA H . . 5.500 4.513 4.459 4.555 . 0 0 "[ . 1 . 2]" 1
1594 1 86 LEU MD1 1 90 ASP HB2 . . 5.500 4.643 4.474 4.742 . 0 0 "[ . 1 . 2]" 1
1595 1 86 LEU MD1 1 95 GLY QA . . 5.340 3.497 2.991 4.429 . 0 0 "[ . 1 . 2]" 1
1596 1 86 LEU MD2 1 87 ALA H . . 5.210 3.290 3.198 3.428 . 0 0 "[ . 1 . 2]" 1
1597 1 86 LEU MD2 1 87 ALA HA . . 4.890 3.090 2.991 3.215 . 0 0 "[ . 1 . 2]" 1
1598 1 86 LEU MD2 1 90 ASP HB2 . . 4.200 2.601 2.421 2.738 . 0 0 "[ . 1 . 2]" 1
1599 1 86 LEU MD2 1 90 ASP HB3 . . 4.630 2.371 2.147 2.557 . 0 0 "[ . 1 . 2]" 1
1600 1 86 LEU MD2 1 95 GLY H . . 5.500 3.760 2.758 4.811 . 0 0 "[ . 1 . 2]" 1
1601 1 86 LEU MD2 1 95 GLY HA2 . . 5.500 2.467 1.887 3.516 . 0 0 "[ . 1 . 2]" 1
1602 1 86 LEU MD2 1 95 GLY QA . . 4.780 2.430 1.865 3.431 . 0 0 "[ . 1 . 2]" 1
1603 1 86 LEU MD2 1 95 GLY HA3 . . 5.500 3.697 2.930 4.783 . 0 0 "[ . 1 . 2]" 1
1604 1 86 LEU HG 1 87 ALA H . . 4.750 4.706 4.625 4.778 0.028 17 0 "[ . 1 . 2]" 1
1605 1 86 LEU HG 1 90 ASP HB2 . . 4.250 3.542 3.237 3.774 . 0 0 "[ . 1 . 2]" 1
1606 1 86 LEU HG 1 90 ASP HB3 . . 3.790 3.809 3.602 3.840 0.050 7 0 "[ . 1 . 2]" 1
1607 1 86 LEU HG 1 97 ILE MD . . 3.780 3.001 2.793 3.190 . 0 0 "[ . 1 . 2]" 1
1608 1 87 ALA H 1 87 ALA MB . . 3.000 2.236 2.222 2.245 . 0 0 "[ . 1 . 2]" 1
1609 1 87 ALA H 1 88 ALA H . . 3.480 2.611 2.588 2.619 . 0 0 "[ . 1 . 2]" 1
1610 1 87 ALA H 1 89 GLY H . . 4.630 4.128 4.054 4.154 . 0 0 "[ . 1 . 2]" 1
1611 1 87 ALA HA 1 89 GLY H . . 4.450 4.291 4.147 4.334 . 0 0 "[ . 1 . 2]" 1
1612 1 87 ALA HA 1 90 ASP HB3 . . 4.310 3.629 3.458 3.845 . 0 0 "[ . 1 . 2]" 1
1613 1 87 ALA MB 1 88 ALA H . . 3.380 3.073 3.028 3.171 . 0 0 "[ . 1 . 2]" 1
1614 1 87 ALA MB 1 89 GLY H . . 5.500 4.667 4.633 4.689 . 0 0 "[ . 1 . 2]" 1
1615 1 88 ALA H 1 88 ALA MB . . 3.060 2.338 2.319 2.406 . 0 0 "[ . 1 . 2]" 1
1616 1 88 ALA H 1 89 GLY H . . 2.400 2.146 2.020 2.192 . 0 0 "[ . 1 . 2]" 1
1617 1 88 ALA H 1 89 GLY HA2 . . 5.050 4.873 4.762 4.914 . 0 0 "[ . 1 . 2]" 1
1618 1 88 ALA H 1 89 GLY HA3 . . 5.500 4.486 4.351 4.534 . 0 0 "[ . 1 . 2]" 1
1619 1 88 ALA H 1 90 ASP H . . 4.650 4.123 3.912 4.267 . 0 0 "[ . 1 . 2]" 1
1620 1 88 ALA H 1 105 LEU MD1 . . 4.270 3.717 3.538 3.842 . 0 0 "[ . 1 . 2]" 1
1621 1 88 ALA HA 1 105 LEU MD1 . . 4.510 3.616 3.539 3.754 . 0 0 "[ . 1 . 2]" 1
1622 1 88 ALA MB 1 89 GLY H . . 3.440 2.834 2.804 3.003 . 0 0 "[ . 1 . 2]" 1
1623 1 88 ALA MB 1 89 GLY HA2 . . 4.530 3.968 3.956 4.042 . 0 0 "[ . 1 . 2]" 1
1624 1 88 ALA MB 1 89 GLY HA3 . . 4.680 4.168 4.148 4.186 . 0 0 "[ . 1 . 2]" 1
1625 1 88 ALA MB 1 105 LEU MD1 . . 3.620 1.923 1.886 1.982 . 0 0 "[ . 1 . 2]" 1
1626 1 89 GLY H 1 90 ASP H . . 2.850 2.505 2.327 2.606 . 0 0 "[ . 1 . 2]" 1
1627 1 89 GLY H 1 90 ASP HB3 . . 4.560 4.285 4.213 4.359 . 0 0 "[ . 1 . 2]" 1
1628 1 89 GLY H 1 91 THR MG . . 5.500 4.905 4.490 5.178 . 0 0 "[ . 1 . 2]" 1
1629 1 89 GLY H 1 105 LEU HB2 . . 4.900 4.633 4.418 4.952 0.052 19 0 "[ . 1 . 2]" 1
1630 1 89 GLY H 1 105 LEU MD1 . . 3.730 2.808 2.619 2.923 . 0 0 "[ . 1 . 2]" 1
1631 1 89 GLY H 1 105 LEU HG . . 5.500 5.471 4.227 5.585 0.085 15 0 "[ . 1 . 2]" 1
1632 1 89 GLY HA2 1 97 ILE MD . . 4.160 3.482 3.357 3.688 . 0 0 "[ . 1 . 2]" 1
1633 1 89 GLY HA2 1 97 ILE HG12 . . 5.360 4.668 4.403 4.900 . 0 0 "[ . 1 . 2]" 1
1634 1 89 GLY HA2 1 97 ILE MG . . 5.500 4.321 4.177 4.630 . 0 0 "[ . 1 . 2]" 1
1635 1 89 GLY HA2 1 105 LEU H . . 5.210 4.662 4.386 4.960 . 0 0 "[ . 1 . 2]" 1
1636 1 89 GLY HA2 1 105 LEU HB2 . . 3.810 2.232 2.005 2.529 . 0 0 "[ . 1 . 2]" 1
1637 1 89 GLY HA2 1 105 LEU HB3 . . 3.750 3.463 3.149 3.774 0.024 2 0 "[ . 1 . 2]" 1
1638 1 89 GLY HA2 1 105 LEU MD1 . . 3.750 2.268 2.133 2.378 . 0 0 "[ . 1 . 2]" 1
1639 1 89 GLY HA3 1 90 ASP H . . 2.700 2.582 2.522 2.633 . 0 0 "[ . 1 . 2]" 1
1640 1 89 GLY HA3 1 91 THR MG . . 5.500 4.765 4.495 5.116 . 0 0 "[ . 1 . 2]" 1
1641 1 89 GLY HA3 1 97 ILE MD . . 5.500 2.019 1.899 2.233 . 0 0 "[ . 1 . 2]" 1
1642 1 89 GLY HA3 1 97 ILE MG . . 4.750 3.353 3.255 3.631 . 0 0 "[ . 1 . 2]" 1
1643 1 89 GLY HA3 1 105 LEU HB2 . . 5.500 3.455 3.179 3.739 . 0 0 "[ . 1 . 2]" 1
1644 1 89 GLY HA3 1 105 LEU MD1 . . 3.140 2.306 2.111 2.404 . 0 0 "[ . 1 . 2]" 1
1645 1 90 ASP H 1 90 ASP HB2 . . 3.350 2.738 2.647 2.786 . 0 0 "[ . 1 . 2]" 1
1646 1 90 ASP H 1 90 ASP HB3 . . 3.140 2.346 2.305 2.423 . 0 0 "[ . 1 . 2]" 1
1647 1 90 ASP H 1 91 THR H . . 4.740 4.335 4.299 4.466 . 0 0 "[ . 1 . 2]" 1
1648 1 90 ASP H 1 91 THR MG . . 5.500 4.530 4.183 4.908 . 0 0 "[ . 1 . 2]" 1
1649 1 90 ASP H 1 97 ILE MD . . 2.690 1.969 1.887 2.312 . 0 0 "[ . 1 . 2]" 1
1650 1 90 ASP H 1 97 ILE HG12 . . 2.890 2.476 2.322 2.586 . 0 0 "[ . 1 . 2]" 1
1651 1 90 ASP H 1 101 GLU HB3 . . 5.500 4.564 4.142 4.850 . 0 0 "[ . 1 . 2]" 1
1652 1 90 ASP HA 1 91 THR H . . 3.230 2.168 2.138 2.180 . 0 0 "[ . 1 . 2]" 1
1653 1 90 ASP HA 1 92 ASP H . . 3.980 3.783 3.533 3.990 0.010 7 0 "[ . 1 . 2]" 1
1654 1 90 ASP HA 1 93 GLY H . . 4.680 4.175 3.462 4.605 . 0 0 "[ . 1 . 2]" 1
1655 1 90 ASP HA 1 101 GLU HA . . 5.220 5.224 5.004 5.271 0.051 18 0 "[ . 1 . 2]" 1
1656 1 90 ASP HB2 1 91 THR H . . 4.490 4.324 4.182 4.408 . 0 0 "[ . 1 . 2]" 1
1657 1 90 ASP HB2 1 96 LYS H . . 4.240 3.672 2.627 4.231 . 0 0 "[ . 1 . 2]" 1
1658 1 90 ASP HB2 1 97 ILE MD . . 5.500 3.260 3.063 3.637 . 0 0 "[ . 1 . 2]" 1
1659 1 90 ASP HB2 1 97 ILE HG12 . . 2.640 2.456 2.262 2.636 . 0 0 "[ . 1 . 2]" 1
1660 1 90 ASP HB2 1 97 ILE HG13 . . 4.760 2.418 1.970 2.696 . 0 0 "[ . 1 . 2]" 1
1661 1 90 ASP HB2 1 97 ILE MG . . 5.500 4.438 4.303 4.567 . 0 0 "[ . 1 . 2]" 1
1662 1 90 ASP HB2 1 101 GLU HB2 . . 5.500 5.416 5.193 5.523 0.023 17 0 "[ . 1 . 2]" 1
1663 1 90 ASP HB2 1 101 GLU HB3 . . 5.500 5.121 4.893 5.204 . 0 0 "[ . 1 . 2]" 1
1664 1 90 ASP HB3 1 91 THR H . . 4.790 4.520 4.433 4.549 . 0 0 "[ . 1 . 2]" 1
1665 1 90 ASP HB3 1 96 LYS H . . 5.500 4.848 3.777 5.515 0.015 7 0 "[ . 1 . 2]" 1
1666 1 90 ASP HB3 1 97 ILE HG13 . . 5.500 3.713 3.430 3.859 . 0 0 "[ . 1 . 2]" 1
1667 1 91 THR H 1 91 THR HB . . 3.960 3.707 3.567 3.801 . 0 0 "[ . 1 . 2]" 1
1668 1 91 THR H 1 91 THR MG . . 3.670 3.007 2.413 3.345 . 0 0 "[ . 1 . 2]" 1
1669 1 91 THR H 1 92 ASP HA . . 4.780 4.700 4.586 4.817 0.037 13 0 "[ . 1 . 2]" 1
1670 1 91 THR H 1 93 GLY H . . 4.660 3.479 3.106 3.847 . 0 0 "[ . 1 . 2]" 1
1671 1 91 THR H 1 93 GLY QA . . 5.340 4.866 4.427 5.491 0.151 6 0 "[ . 1 . 2]" 1
1672 1 91 THR H 1 97 ILE MG . . 5.310 4.702 4.513 5.036 . 0 0 "[ . 1 . 2]" 1
1673 1 91 THR H 1 101 GLU H . . 5.500 5.569 5.512 5.776 0.276 14 0 "[ . 1 . 2]" 1
1674 1 91 THR H 1 101 GLU HA . . 5.070 4.178 4.022 4.355 . 0 0 "[ . 1 . 2]" 1
1675 1 91 THR H 1 101 GLU HB3 . . 4.130 2.361 2.133 2.992 . 0 0 "[ . 1 . 2]" 1
1676 1 91 THR H 1 101 GLU HG2 . . 4.480 2.881 2.034 4.398 . 0 0 "[ . 1 . 2]" 1
1677 1 91 THR H 1 101 GLU QG . . 3.700 2.603 2.026 2.975 . 0 0 "[ . 1 . 2]" 1
1678 1 91 THR H 1 101 GLU HG3 . . 4.480 3.726 2.588 4.219 . 0 0 "[ . 1 . 2]" 1
1679 1 91 THR HA 1 91 THR MG . . 3.300 2.285 2.152 2.491 . 0 0 "[ . 1 . 2]" 1
1680 1 91 THR HA 1 93 GLY H . . 4.690 4.051 3.714 4.640 . 0 0 "[ . 1 . 2]" 1
1681 1 91 THR HB 1 92 ASP H . . 4.050 3.576 3.196 3.927 . 0 0 "[ . 1 . 2]" 1
1682 1 91 THR HB 1 92 ASP HA . . 5.500 4.417 4.063 4.761 . 0 0 "[ . 1 . 2]" 1
1683 1 91 THR HB 1 92 ASP QB . . 5.340 4.616 3.619 5.360 0.020 20 0 "[ . 1 . 2]" 1
1684 1 91 THR HB 1 93 GLY H . . 5.500 5.273 5.060 5.535 0.035 14 0 "[ . 1 . 2]" 1
1685 1 91 THR HB 1 101 GLU QG . . 5.340 4.409 3.662 5.368 0.028 14 0 "[ . 1 . 2]" 1
1686 1 91 THR MG 1 92 ASP H . . 5.390 3.998 3.585 4.122 . 0 0 "[ . 1 . 2]" 1
1687 1 91 THR MG 1 101 GLU HB3 . . 5.230 3.634 2.925 4.237 . 0 0 "[ . 1 . 2]" 1
1688 1 91 THR MG 1 101 GLU QG . . 5.340 4.094 3.525 4.641 . 0 0 "[ . 1 . 2]" 1
1689 1 92 ASP H 1 93 GLY H . . 3.060 2.664 1.970 2.985 . 0 0 "[ . 1 . 2]" 1
1690 1 92 ASP H 1 101 GLU HA . . 5.370 4.702 3.994 5.387 0.017 14 0 "[ . 1 . 2]" 1
1691 1 92 ASP H 1 101 GLU QG . . 4.310 2.232 1.876 2.992 . 0 0 "[ . 1 . 2]" 1
1692 1 93 GLY H 1 101 GLU QG . . 5.290 4.277 2.757 5.302 0.012 20 0 "[ . 1 . 2]" 1
1693 1 94 ASP H 1 94 ASP QB . . 3.620 2.745 2.194 3.430 . 0 0 "[ . 1 . 2]" 1
1694 1 94 ASP HA 1 94 ASP QB . . 2.420 2.341 2.179 2.431 0.011 6 0 "[ . 1 . 2]" 1
1695 1 94 ASP HA 1 96 LYS H . . 5.110 4.326 3.883 5.102 . 0 0 "[ . 1 . 2]" 1
1696 1 94 ASP QB 1 96 LYS H . . 5.340 4.169 2.725 5.308 . 0 0 "[ . 1 . 2]" 1
1697 1 95 GLY QA 1 96 LYS QG . . 5.180 3.587 3.180 4.018 . 0 0 "[ . 1 . 2]" 1
1698 1 96 LYS H 1 96 LYS HB2 . . 4.090 3.301 2.612 4.047 . 0 0 "[ . 1 . 2]" 1
1699 1 96 LYS H 1 96 LYS QB . . 3.490 2.967 2.562 3.407 . 0 0 "[ . 1 . 2]" 1
1700 1 96 LYS H 1 96 LYS HB3 . . 4.090 3.631 3.131 3.960 . 0 0 "[ . 1 . 2]" 1
1701 1 96 LYS H 1 96 LYS QG . . 2.910 2.431 1.827 2.925 0.015 5 0 "[ . 1 . 2]" 1
1702 1 96 LYS H 1 97 ILE H . . 5.030 4.429 4.227 4.532 . 0 0 "[ . 1 . 2]" 1
1703 1 96 LYS HA 1 97 ILE H . . 3.260 2.435 2.205 2.581 . 0 0 "[ . 1 . 2]" 1
1704 1 96 LYS QB 1 96 LYS QD . . 2.360 2.123 2.026 2.248 . 0 0 "[ . 1 . 2]" 1
1705 1 96 LYS QB 1 97 ILE H . . 3.160 2.396 2.065 2.979 . 0 0 "[ . 1 . 2]" 1
1706 1 96 LYS HB2 1 97 ILE H . . 3.710 2.887 2.081 3.715 0.005 12 0 "[ . 1 . 2]" 1
1707 1 96 LYS HB3 1 97 ILE H . . 3.710 3.019 2.254 3.786 0.076 8 0 "[ . 1 . 2]" 1
1708 1 96 LYS QD 1 97 ILE H . . 4.890 4.378 2.838 4.855 . 0 0 "[ . 1 . 2]" 1
1709 1 97 ILE H 1 97 ILE HB . . 3.200 2.691 2.411 2.779 . 0 0 "[ . 1 . 2]" 1
1710 1 97 ILE H 1 97 ILE HG12 . . 4.290 4.126 3.667 4.280 . 0 0 "[ . 1 . 2]" 1
1711 1 97 ILE H 1 97 ILE HG13 . . 3.950 3.134 2.487 3.338 . 0 0 "[ . 1 . 2]" 1
1712 1 97 ILE H 1 97 ILE MG . . 4.500 3.831 3.676 3.866 . 0 0 "[ . 1 . 2]" 1
1713 1 97 ILE HA 1 98 GLY H . . 3.170 2.191 2.144 2.246 . 0 0 "[ . 1 . 2]" 1
1714 1 97 ILE HA 1 101 GLU H . . 5.330 5.256 5.042 5.395 0.065 16 0 "[ . 1 . 2]" 1
1715 1 97 ILE HB 1 97 ILE MD . . 2.700 2.443 2.412 2.474 . 0 0 "[ . 1 . 2]" 1
1716 1 97 ILE HB 1 98 GLY H . . 4.910 4.148 3.965 4.380 . 0 0 "[ . 1 . 2]" 1
1717 1 97 ILE MD 1 97 ILE MG . . 2.920 1.883 1.871 1.898 . 0 0 "[ . 1 . 2]" 1
1718 1 97 ILE MD 1 105 LEU HB2 . . 5.500 4.774 4.523 5.055 . 0 0 "[ . 1 . 2]" 1
1719 1 97 ILE MD 1 105 LEU HB3 . . 5.490 4.839 4.587 5.122 . 0 0 "[ . 1 . 2]" 1
1720 1 97 ILE HG13 1 98 GLY H . . 5.190 4.974 4.866 5.063 . 0 0 "[ . 1 . 2]" 1
1721 1 97 ILE MG 1 98 GLY H . . 4.270 2.490 2.171 2.781 . 0 0 "[ . 1 . 2]" 1
1722 1 97 ILE MG 1 98 GLY QA . . 5.290 3.374 3.220 3.536 . 0 0 "[ . 1 . 2]" 1
1723 1 97 ILE MG 1 99 VAL H . . 5.500 4.609 4.472 4.871 . 0 0 "[ . 1 . 2]" 1
1724 1 97 ILE MG 1 99 VAL HA . . 5.500 4.359 4.240 4.582 . 0 0 "[ . 1 . 2]" 1
1725 1 97 ILE MG 1 101 GLU H . . 4.190 3.934 3.867 4.060 . 0 0 "[ . 1 . 2]" 1
1726 1 97 ILE MG 1 101 GLU HB2 . . 3.890 2.127 1.979 2.377 . 0 0 "[ . 1 . 2]" 1
1727 1 97 ILE MG 1 101 GLU HG2 . . 5.500 4.555 3.905 4.894 . 0 0 "[ . 1 . 2]" 1
1728 1 97 ILE MG 1 101 GLU QG . . 4.760 3.950 3.548 4.197 . 0 0 "[ . 1 . 2]" 1
1729 1 97 ILE MG 1 101 GLU HG3 . . 5.500 4.399 4.071 5.072 . 0 0 "[ . 1 . 2]" 1
1730 1 97 ILE MG 1 102 PHE H . . 4.090 3.253 3.052 3.403 . 0 0 "[ . 1 . 2]" 1
1731 1 97 ILE MG 1 102 PHE HA . . 4.170 2.791 2.513 3.078 . 0 0 "[ . 1 . 2]" 1
1732 1 97 ILE MG 1 102 PHE HB2 . . 3.590 2.585 2.248 2.842 . 0 0 "[ . 1 . 2]" 1
1733 1 97 ILE MG 1 102 PHE QD . . 3.670 2.662 2.419 2.937 . 0 0 "[ . 1 . 2]" 1
1734 1 98 GLY H 1 99 VAL H . . 4.420 3.673 3.538 4.475 0.055 14 0 "[ . 1 . 2]" 1
1735 1 98 GLY H 1 101 GLU H . . 4.320 3.608 3.436 3.835 . 0 0 "[ . 1 . 2]" 1
1736 1 98 GLY H 1 101 GLU HA . . 5.500 5.314 4.660 5.522 0.022 7 0 "[ . 1 . 2]" 1
1737 1 98 GLY H 1 101 GLU HB2 . . 3.470 2.512 1.937 2.735 . 0 0 "[ . 1 . 2]" 1
1738 1 98 GLY H 1 101 GLU HG2 . . 4.920 4.196 2.020 4.915 . 0 0 "[ . 1 . 2]" 1
1739 1 98 GLY H 1 101 GLU QG . . 4.320 3.331 1.944 3.809 . 0 0 "[ . 1 . 2]" 1
1740 1 98 GLY H 1 101 GLU HG3 . . 4.920 3.690 2.533 4.707 . 0 0 "[ . 1 . 2]" 1
1741 1 98 GLY H 1 102 PHE H . . 5.090 4.239 3.687 4.552 . 0 0 "[ . 1 . 2]" 1
1742 1 98 GLY QA 1 99 VAL H . . 3.360 2.121 2.109 2.283 . 0 0 "[ . 1 . 2]" 1
1743 1 98 GLY QA 1 99 VAL HA . . 5.070 3.950 3.941 3.972 . 0 0 "[ . 1 . 2]" 1
1744 1 98 GLY QA 1 99 VAL HB . . 5.480 5.133 5.125 5.141 . 0 0 "[ . 1 . 2]" 1
1745 1 98 GLY QA 1 99 VAL MG2 . . 4.700 3.048 3.019 3.221 . 0 0 "[ . 1 . 2]" 1
1746 1 98 GLY QA 1 100 GLU H . . 5.250 4.100 4.016 4.130 . 0 0 "[ . 1 . 2]" 1
1747 1 98 GLY QA 1 101 GLU HB2 . . 5.500 4.245 3.457 4.453 . 0 0 "[ . 1 . 2]" 1
1748 1 98 GLY QA 1 101 GLU QG . . 5.340 4.243 2.623 4.916 . 0 0 "[ . 1 . 2]" 1
1749 1 99 VAL H 1 99 VAL HB . . 3.920 3.419 3.383 3.472 . 0 0 "[ . 1 . 2]" 1
1750 1 99 VAL H 1 99 VAL MG2 . . 3.840 1.899 1.720 1.956 . 0 0 "[ . 1 . 2]" 1
1751 1 99 VAL H 1 100 GLU H . . 3.250 2.329 2.253 3.101 . 0 0 "[ . 1 . 2]" 1
1752 1 99 VAL H 1 100 GLU HB2 . . 4.690 4.003 3.925 4.836 0.146 14 0 "[ . 1 . 2]" 1
1753 1 99 VAL H 1 101 GLU H . . 3.810 3.299 3.103 3.969 0.159 14 0 "[ . 1 . 2]" 1
1754 1 99 VAL H 1 102 PHE H . . 4.910 4.158 3.965 4.598 . 0 0 "[ . 1 . 2]" 1
1755 1 99 VAL HA 1 99 VAL MG1 . . 3.090 2.008 1.981 2.042 . 0 0 "[ . 1 . 2]" 1
1756 1 99 VAL HA 1 100 GLU HA . . 4.790 4.804 4.783 4.837 0.047 17 0 "[ . 1 . 2]" 1
1757 1 99 VAL HA 1 102 PHE H . . 3.950 3.226 3.148 3.409 . 0 0 "[ . 1 . 2]" 1
1758 1 99 VAL HA 1 102 PHE HB2 . . 3.930 3.016 2.859 3.395 . 0 0 "[ . 1 . 2]" 1
1759 1 99 VAL HA 1 102 PHE HB3 . . 4.070 2.579 2.397 2.959 . 0 0 "[ . 1 . 2]" 1
1760 1 99 VAL HB 1 100 GLU H . . 4.170 2.685 2.484 2.730 . 0 0 "[ . 1 . 2]" 1
1761 1 99 VAL HB 1 100 GLU HA . . 5.500 3.760 3.722 3.773 . 0 0 "[ . 1 . 2]" 1
1762 1 99 VAL HB 1 100 GLU QG . . 5.340 4.263 4.147 4.338 . 0 0 "[ . 1 . 2]" 1
1763 1 99 VAL HB 1 101 GLU H . . 5.500 4.816 4.727 5.145 . 0 0 "[ . 1 . 2]" 1
1764 1 99 VAL MG1 1 99 VAL MG2 . . 2.880 2.084 2.063 2.092 . 0 0 "[ . 1 . 2]" 1
1765 1 99 VAL MG1 1 100 GLU H . . 5.500 4.003 3.880 4.023 . 0 0 "[ . 1 . 2]" 1
1766 1 99 VAL MG1 1 100 GLU HA . . 5.500 5.006 4.991 5.022 . 0 0 "[ . 1 . 2]" 1
1767 1 99 VAL MG1 1 102 PHE H . . 5.500 4.713 4.633 4.892 . 0 0 "[ . 1 . 2]" 1
1768 1 99 VAL MG1 1 102 PHE HB3 . . 5.500 3.605 3.492 4.053 . 0 0 "[ . 1 . 2]" 1
1769 1 99 VAL MG1 1 103 GLN H . . 5.420 4.542 4.224 4.865 . 0 0 "[ . 1 . 2]" 1
1770 1 99 VAL MG1 1 103 GLN HG2 . . 5.500 4.692 4.224 4.972 . 0 0 "[ . 1 . 2]" 1
1771 1 99 VAL MG2 1 100 GLU H . . 3.450 2.106 1.930 2.153 . 0 0 "[ . 1 . 2]" 1
1772 1 99 VAL MG2 1 100 GLU HA . . 5.500 4.321 4.277 4.343 . 0 0 "[ . 1 . 2]" 1
1773 1 99 VAL MG2 1 100 GLU HB2 . . 4.770 3.528 3.380 3.608 . 0 0 "[ . 1 . 2]" 1
1774 1 99 VAL MG2 1 100 GLU QG . . 4.220 4.008 3.925 4.027 . 0 0 "[ . 1 . 2]" 1
1775 1 99 VAL MG2 1 101 GLU H . . 5.500 4.205 3.965 4.468 . 0 0 "[ . 1 . 2]" 1
1776 1 100 GLU H 1 100 GLU HB2 . . 2.920 2.082 2.077 2.103 . 0 0 "[ . 1 . 2]" 1
1777 1 100 GLU H 1 100 GLU QG . . 3.330 3.196 3.120 3.222 . 0 0 "[ . 1 . 2]" 1
1778 1 100 GLU H 1 101 GLU H . . 3.280 2.724 2.667 2.899 . 0 0 "[ . 1 . 2]" 1
1779 1 100 GLU H 1 102 PHE H . . 4.360 3.993 3.904 4.176 . 0 0 "[ . 1 . 2]" 1
1780 1 100 GLU HA 1 100 GLU QG . . 3.170 2.191 2.074 2.584 . 0 0 "[ . 1 . 2]" 1
1781 1 100 GLU HA 1 103 GLN H . . 4.160 4.135 3.868 4.239 0.079 10 0 "[ . 1 . 2]" 1
1782 1 100 GLU HA 1 103 GLN HG2 . . 3.820 2.684 2.330 2.853 . 0 0 "[ . 1 . 2]" 1
1783 1 100 GLU HA 1 103 GLN HG3 . . 4.450 3.388 2.804 3.553 . 0 0 "[ . 1 . 2]" 1
1784 1 100 GLU HB2 1 100 GLU QG . . 2.610 2.212 2.162 2.256 . 0 0 "[ . 1 . 2]" 1
1785 1 100 GLU HB2 1 101 GLU H . . 3.410 3.254 2.944 3.356 . 0 0 "[ . 1 . 2]" 1
1786 1 100 GLU HB2 1 102 PHE H . . 5.500 5.162 5.007 5.294 . 0 0 "[ . 1 . 2]" 1
1787 1 100 GLU HB3 1 100 GLU QG . . 2.560 2.430 2.299 2.478 . 0 0 "[ . 1 . 2]" 1
1788 1 100 GLU HB3 1 102 PHE H . . 5.500 5.111 4.874 5.276 . 0 0 "[ . 1 . 2]" 1
1789 1 101 GLU H 1 101 GLU HB2 . . 3.080 2.635 2.536 2.786 . 0 0 "[ . 1 . 2]" 1
1790 1 101 GLU H 1 101 GLU HG2 . . 3.860 3.360 1.979 3.868 0.008 16 0 "[ . 1 . 2]" 1
1791 1 101 GLU H 1 101 GLU QG . . 3.180 2.302 1.969 2.963 . 0 0 "[ . 1 . 2]" 1
1792 1 101 GLU H 1 101 GLU HG3 . . 3.860 2.559 2.050 3.736 . 0 0 "[ . 1 . 2]" 1
1793 1 101 GLU H 1 102 PHE H . . 3.560 2.317 2.201 2.626 . 0 0 "[ . 1 . 2]" 1
1794 1 101 GLU H 1 102 PHE HB2 . . 5.270 4.545 4.417 4.892 . 0 0 "[ . 1 . 2]" 1
1795 1 101 GLU H 1 102 PHE HB3 . . 5.500 4.610 4.389 4.985 . 0 0 "[ . 1 . 2]" 1
1796 1 101 GLU H 1 103 GLN H . . 4.810 4.547 4.218 4.809 . 0 0 "[ . 1 . 2]" 1
1797 1 101 GLU H 1 103 GLN HG2 . . 5.160 4.686 4.548 4.840 . 0 0 "[ . 1 . 2]" 1
1798 1 101 GLU HA 1 101 GLU HG2 . . 3.780 3.049 2.730 3.680 . 0 0 "[ . 1 . 2]" 1
1799 1 101 GLU HA 1 101 GLU QG . . 3.210 2.657 2.486 3.237 0.027 3 0 "[ . 1 . 2]" 1
1800 1 101 GLU HA 1 101 GLU HG3 . . 3.780 3.092 2.532 3.885 0.105 6 0 "[ . 1 . 2]" 1
1801 1 101 GLU HB2 1 102 PHE H . . 3.340 3.098 2.784 3.313 . 0 0 "[ . 1 . 2]" 1
1802 1 101 GLU HB2 1 102 PHE HA . . 5.500 4.230 4.103 4.393 . 0 0 "[ . 1 . 2]" 1
1803 1 101 GLU HB3 1 101 GLU QG . . 2.460 2.256 2.142 2.330 . 0 0 "[ . 1 . 2]" 1
1804 1 101 GLU HB3 1 102 PHE HA . . 5.500 4.775 4.573 4.960 . 0 0 "[ . 1 . 2]" 1
1805 1 101 GLU HG2 1 102 PHE H . . 5.500 4.987 3.910 5.345 . 0 0 "[ . 1 . 2]" 1
1806 1 101 GLU HG3 1 102 PHE H . . 5.500 4.451 4.021 5.378 . 0 0 "[ . 1 . 2]" 1
1807 1 102 PHE H 1 102 PHE HB2 . . 3.410 2.597 2.441 2.808 . 0 0 "[ . 1 . 2]" 1
1808 1 102 PHE H 1 102 PHE HB3 . . 3.550 2.531 2.436 2.624 . 0 0 "[ . 1 . 2]" 1
1809 1 102 PHE H 1 102 PHE QD . . 5.410 4.194 4.161 4.215 . 0 0 "[ . 1 . 2]" 1
1810 1 102 PHE H 1 103 GLN H . . 3.600 2.729 2.446 2.923 . 0 0 "[ . 1 . 2]" 1
1811 1 102 PHE H 1 103 GLN HB3 . . 5.500 5.252 4.875 5.468 . 0 0 "[ . 1 . 2]" 1
1812 1 102 PHE H 1 103 GLN HG2 . . 4.500 3.805 3.600 4.100 . 0 0 "[ . 1 . 2]" 1
1813 1 102 PHE H 1 104 SER H . . 4.500 3.670 3.362 3.864 . 0 0 "[ . 1 . 2]" 1
1814 1 102 PHE H 1 104 SER HB2 . . 5.500 5.255 5.010 5.503 0.003 14 0 "[ . 1 . 2]" 1
1815 1 102 PHE H 1 104 SER HB3 . . 5.500 4.704 4.406 5.020 . 0 0 "[ . 1 . 2]" 1
1816 1 102 PHE H 1 105 LEU H . . 5.360 4.986 4.780 5.252 . 0 0 "[ . 1 . 2]" 1
1817 1 102 PHE HA 1 102 PHE QD . . 3.320 2.787 2.543 2.971 . 0 0 "[ . 1 . 2]" 1
1818 1 102 PHE HA 1 102 PHE QE . . 5.500 4.601 4.518 4.721 . 0 0 "[ . 1 . 2]" 1
1819 1 102 PHE HA 1 105 LEU H . . 4.370 3.768 3.679 3.970 . 0 0 "[ . 1 . 2]" 1
1820 1 102 PHE HA 1 105 LEU MD1 . . 5.070 4.350 3.938 4.748 . 0 0 "[ . 1 . 2]" 1
1821 1 102 PHE HB2 1 102 PHE QD . . 3.450 2.440 2.370 2.538 . 0 0 "[ . 1 . 2]" 1
1822 1 102 PHE HB3 1 103 GLN H . . 3.260 2.140 2.053 2.361 . 0 0 "[ . 1 . 2]" 1
1823 1 102 PHE HB3 1 104 SER H . . 5.020 4.526 4.406 4.643 . 0 0 "[ . 1 . 2]" 1
1824 1 102 PHE QD 1 103 GLN H . . 4.070 2.948 2.730 3.121 . 0 0 "[ . 1 . 2]" 1
1825 1 102 PHE QD 1 103 GLN HA . . 4.550 3.129 2.909 3.472 . 0 0 "[ . 1 . 2]" 1
1826 1 102 PHE QD 1 104 SER H . . 5.500 5.101 4.902 5.287 . 0 0 "[ . 1 . 2]" 1
1827 1 103 GLN H 1 103 GLN HB3 . . 2.830 2.605 2.518 2.659 . 0 0 "[ . 1 . 2]" 1
1828 1 103 GLN H 1 103 GLN HG2 . . 2.930 2.075 1.948 2.362 . 0 0 "[ . 1 . 2]" 1
1829 1 103 GLN H 1 103 GLN HG3 . . 3.100 3.063 2.826 3.138 0.038 18 0 "[ . 1 . 2]" 1
1830 1 103 GLN H 1 104 SER H . . 3.530 2.704 2.582 2.775 . 0 0 "[ . 1 . 2]" 1
1831 1 103 GLN H 1 104 SER QB . . 5.340 4.459 4.339 4.520 . 0 0 "[ . 1 . 2]" 1
1832 1 103 GLN H 1 105 LEU H . . 4.390 4.126 4.034 4.228 . 0 0 "[ . 1 . 2]" 1
1833 1 103 GLN H 1 106 VAL HB . . 5.500 5.260 5.048 5.455 . 0 0 "[ . 1 . 2]" 1
1834 1 103 GLN HA 1 103 GLN HG2 . . 3.970 3.761 3.694 3.910 . 0 0 "[ . 1 . 2]" 1
1835 1 103 GLN HA 1 103 GLN HG3 . . 3.980 3.727 3.622 3.784 . 0 0 "[ . 1 . 2]" 1
1836 1 103 GLN HA 1 105 LEU H . . 4.670 3.581 3.419 3.680 . 0 0 "[ . 1 . 2]" 1
1837 1 103 GLN HA 1 106 VAL H . . 4.060 3.133 3.013 3.441 . 0 0 "[ . 1 . 2]" 1
1838 1 103 GLN HA 1 106 VAL HA . . 5.370 5.166 5.020 5.401 0.031 19 0 "[ . 1 . 2]" 1
1839 1 103 GLN HA 1 106 VAL HB . . 3.670 2.614 2.437 2.699 . 0 0 "[ . 1 . 2]" 1
1840 1 103 GLN HA 1 106 VAL MG1 . . 5.500 4.082 3.908 4.187 . 0 0 "[ . 1 . 2]" 1
1841 1 103 GLN HA 1 107 LYS H . . 4.780 3.533 3.352 3.671 . 0 0 "[ . 1 . 2]" 1
1842 1 103 GLN HB2 1 104 SER H . . 4.650 3.826 3.638 4.057 . 0 0 "[ . 1 . 2]" 1
1843 1 103 GLN HB2 1 105 LEU H . . 5.120 5.055 5.006 5.172 0.052 15 0 "[ . 1 . 2]" 1
1844 1 103 GLN HB3 1 104 SER H . . 4.400 4.087 3.998 4.238 . 0 0 "[ . 1 . 2]" 1
1845 1 103 GLN HB3 1 105 LEU H . . 5.500 5.426 5.395 5.472 . 0 0 "[ . 1 . 2]" 1
1846 1 103 GLN HB3 1 107 LYS H . . 5.500 5.478 5.170 5.528 0.028 19 0 "[ . 1 . 2]" 1
1847 1 103 GLN HG2 1 104 SER H . . 3.490 3.006 2.799 3.302 . 0 0 "[ . 1 . 2]" 1
1848 1 103 GLN HG3 1 104 SER H . . 2.740 2.334 2.118 2.739 . 0 0 "[ . 1 . 2]" 1
1849 1 103 GLN HG3 1 104 SER QB . . 4.570 3.286 3.134 3.456 . 0 0 "[ . 1 . 2]" 1
1850 1 104 SER H 1 104 SER HA . . 2.920 2.822 2.781 2.873 . 0 0 "[ . 1 . 2]" 1
1851 1 104 SER H 1 104 SER HB2 . . 3.480 2.578 2.374 2.836 . 0 0 "[ . 1 . 2]" 1
1852 1 104 SER H 1 104 SER QB . . 2.970 2.253 2.230 2.278 . 0 0 "[ . 1 . 2]" 1
1853 1 104 SER H 1 104 SER HB3 . . 3.480 2.516 2.333 2.710 . 0 0 "[ . 1 . 2]" 1
1854 1 104 SER H 1 105 LEU HB2 . . 5.500 5.080 4.610 5.331 . 0 0 "[ . 1 . 2]" 1
1855 1 104 SER H 1 106 VAL H . . 4.470 4.283 4.109 4.515 0.045 19 0 "[ . 1 . 2]" 1
1856 1 104 SER H 1 106 VAL HB . . 5.500 5.507 5.383 5.546 0.046 8 0 "[ . 1 . 2]" 1
1857 1 104 SER HA 1 106 VAL H . . 5.480 4.833 4.688 5.158 . 0 0 "[ . 1 . 2]" 1
1858 1 104 SER HA 1 107 LYS H . . 4.550 4.300 4.089 4.547 . 0 0 "[ . 1 . 2]" 1
1859 1 104 SER HA 1 107 LYS QB . . 4.460 3.766 3.276 4.569 0.109 15 0 "[ . 1 . 2]" 1
1860 1 104 SER HA 1 107 LYS HG2 . . 5.500 4.747 2.735 5.523 0.023 4 0 "[ . 1 . 2]" 1
1861 1 104 SER HA 1 107 LYS HG3 . . 5.500 4.150 3.733 4.572 . 0 0 "[ . 1 . 2]" 1
1862 1 104 SER QB 1 105 LEU H . . 3.960 3.139 2.989 3.386 . 0 0 "[ . 1 . 2]" 1
1863 1 104 SER HB2 1 105 LEU H . . 4.550 4.215 4.034 4.423 . 0 0 "[ . 1 . 2]" 1
1864 1 104 SER HB3 1 105 LEU H . . 4.550 3.240 3.081 3.515 . 0 0 "[ . 1 . 2]" 1
1865 1 105 LEU H 1 105 LEU HB2 . . 3.330 2.974 2.557 3.228 . 0 0 "[ . 1 . 2]" 1
1866 1 105 LEU H 1 105 LEU HB3 . . 3.190 2.416 2.322 2.748 . 0 0 "[ . 1 . 2]" 1
1867 1 105 LEU H 1 106 VAL H . . 3.380 2.190 1.969 2.377 . 0 0 "[ . 1 . 2]" 1
1868 1 105 LEU H 1 106 VAL HA . . 5.190 4.859 4.671 4.997 . 0 0 "[ . 1 . 2]" 1
1869 1 105 LEU H 1 107 LYS H . . 4.230 3.815 3.550 4.177 . 0 0 "[ . 1 . 2]" 1
1870 1 105 LEU HA 1 105 LEU HG . . 3.680 2.638 2.518 2.711 . 0 0 "[ . 1 . 2]" 1
1871 1 105 LEU HA 1 106 VAL HA . . 5.030 4.812 4.788 4.843 . 0 0 "[ . 1 . 2]" 1
1872 1 105 LEU HA 1 107 LYS H . . 5.340 4.616 4.300 5.081 . 0 0 "[ . 1 . 2]" 1
1873 1 105 LEU HA 1 108 ALA H . . 4.310 3.559 3.417 3.641 . 0 0 "[ . 1 . 2]" 1
1874 1 105 LEU HA 1 108 ALA MB . . 3.890 2.742 2.420 3.009 . 0 0 "[ . 1 . 2]" 1
1875 1 105 LEU HB2 1 106 VAL H . . 4.940 3.919 3.465 4.047 . 0 0 "[ . 1 . 2]" 1
1876 1 105 LEU HB3 1 105 LEU MD1 . . 3.490 2.591 2.273 2.653 . 0 0 "[ . 1 . 2]" 1
1877 1 105 LEU HB3 1 106 VAL H . . 3.000 2.585 2.224 2.747 . 0 0 "[ . 1 . 2]" 1
1878 1 105 LEU MD2 1 106 VAL H . . 5.160 2.620 2.401 3.390 . 0 0 "[ . 1 . 2]" 1
1879 1 105 LEU MD2 1 106 VAL HA . . 5.500 2.608 2.546 3.118 . 0 0 "[ . 1 . 2]" 1
1880 1 105 LEU MD2 1 108 ALA H . . 5.500 4.512 3.726 4.616 . 0 0 "[ . 1 . 2]" 1
1881 1 105 LEU MD2 1 108 ALA MB . . 5.500 4.290 3.085 4.479 . 0 0 "[ . 1 . 2]" 1
1882 1 105 LEU HG 1 106 VAL H . . 4.720 4.296 4.091 4.871 0.151 19 0 "[ . 1 . 2]" 1
1883 1 106 VAL H 1 106 VAL HB . . 2.900 2.571 2.375 2.681 . 0 0 "[ . 1 . 2]" 1
1884 1 106 VAL H 1 107 LYS H . . 3.260 2.780 2.654 2.946 . 0 0 "[ . 1 . 2]" 1
1885 1 106 VAL H 1 107 LYS HA . . 5.440 5.357 5.263 5.470 0.030 19 0 "[ . 1 . 2]" 1
1886 1 106 VAL H 1 107 LYS QB . . 5.160 4.759 4.561 4.980 . 0 0 "[ . 1 . 2]" 1
1887 1 106 VAL H 1 107 LYS QG . . 5.340 4.422 4.187 4.806 . 0 0 "[ . 1 . 2]" 1
1888 1 106 VAL H 1 108 ALA MB . . 5.500 4.760 4.533 5.025 . 0 0 "[ . 1 . 2]" 1
1889 1 106 VAL HA 1 106 VAL MG1 . . 3.110 2.302 2.197 2.495 . 0 0 "[ . 1 . 2]" 1
1890 1 106 VAL HA 1 108 ALA H . . 4.950 3.777 3.665 3.926 . 0 0 "[ . 1 . 2]" 1
1891 1 106 VAL HB 1 107 LYS H . . 3.900 2.460 2.220 2.625 . 0 0 "[ . 1 . 2]" 1
1892 1 106 VAL HB 1 108 ALA H . . 5.500 4.613 4.457 4.720 . 0 0 "[ . 1 . 2]" 1
1893 1 106 VAL MG1 1 107 LYS H . . 4.970 3.337 2.701 3.654 . 0 0 "[ . 1 . 2]" 1
1894 1 106 VAL MG1 1 107 LYS HA . . 4.910 3.521 2.967 3.803 . 0 0 "[ . 1 . 2]" 1
1895 1 106 VAL MG1 1 107 LYS QG . . 4.920 3.978 3.545 4.690 . 0 0 "[ . 1 . 2]" 1
1896 1 106 VAL MG1 1 108 ALA H . . 5.500 4.532 4.322 4.634 . 0 0 "[ . 1 . 2]" 1
1897 1 107 LYS H 1 107 LYS QB . . 2.510 2.390 2.213 2.531 0.021 1 0 "[ . 1 . 2]" 1
1898 1 107 LYS H 1 107 LYS QG . . 2.680 2.362 1.999 2.686 0.006 15 0 "[ . 1 . 2]" 1
1899 1 107 LYS H 1 108 ALA H . . 3.410 2.645 2.562 2.699 . 0 0 "[ . 1 . 2]" 1
1900 1 107 LYS HA 1 107 LYS QB . . 2.520 2.329 2.165 2.447 . 0 0 "[ . 1 . 2]" 1
1901 1 107 LYS HA 1 107 LYS HE2 . . 5.500 4.438 2.001 5.336 . 0 0 "[ . 1 . 2]" 1
1902 1 107 LYS HA 1 107 LYS HE3 . . 5.500 4.564 2.615 5.513 0.013 16 0 "[ . 1 . 2]" 1
1903 1 107 LYS HA 1 107 LYS QG . . 3.490 2.665 2.238 3.331 . 0 0 "[ . 1 . 2]" 1
1904 1 107 LYS HA 1 108 ALA H . . 3.490 3.408 3.340 3.434 . 0 0 "[ . 1 . 2]" 1
1905 1 107 LYS HA 1 108 ALA HA . . 4.670 4.637 4.544 4.683 0.013 1 0 "[ . 1 . 2]" 1
1906 1 107 LYS HA 1 108 ALA MB . . 5.500 4.931 4.843 4.950 . 0 0 "[ . 1 . 2]" 1
1907 1 107 LYS QB 1 107 LYS QD . . 3.250 2.220 2.077 2.474 . 0 0 "[ . 1 . 2]" 1
1908 1 107 LYS QB 1 108 ALA H . . 3.740 3.214 3.009 3.754 0.014 19 0 "[ . 1 . 2]" 1
1909 1 107 LYS HB2 1 108 ALA H . . 4.370 3.447 3.099 4.379 0.009 19 0 "[ . 1 . 2]" 1
1910 1 107 LYS HB3 1 108 ALA H . . 4.370 4.024 3.859 4.176 . 0 0 "[ . 1 . 2]" 1
1911 1 108 ALA H 1 108 ALA MB . . 3.360 2.321 2.252 2.441 . 0 0 "[ . 1 . 2]" 1
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