Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
566283 | 2mbf RC | 19398 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mbf
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 1239
_Distance_constraint_stats_list.Viol_count 2574
_Distance_constraint_stats_list.Viol_total 2808.317
_Distance_constraint_stats_list.Viol_max 0.359
_Distance_constraint_stats_list.Viol_rms 0.0225
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0057
_Distance_constraint_stats_list.Viol_average_violations_only 0.0546
_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 1 ASN 1.256 0.074 17 0 "[ . 1 . 2]"
1 2 PRO 3.823 0.103 3 0 "[ . 1 . 2]"
1 3 TRP 6.262 0.187 13 0 "[ . 1 . 2]"
1 4 GLY 0.857 0.197 15 0 "[ . 1 . 2]"
1 5 ALA 0.777 0.085 12 0 "[ . 1 . 2]"
1 6 GLU 2.008 0.197 15 0 "[ . 1 . 2]"
1 7 SER 2.695 0.121 18 0 "[ . 1 . 2]"
1 8 TYR 4.242 0.136 19 0 "[ . 1 . 2]"
1 9 SER 3.767 0.177 11 0 "[ . 1 . 2]"
1 10 ASP 1.807 0.085 9 0 "[ . 1 . 2]"
1 11 LEU 8.594 0.136 19 0 "[ . 1 . 2]"
1 12 ILE 8.478 0.187 13 0 "[ . 1 . 2]"
1 13 ALA 2.482 0.103 5 0 "[ . 1 . 2]"
1 14 LYS 7.062 0.296 9 0 "[ . 1 . 2]"
1 15 ALA 2.014 0.096 19 0 "[ . 1 . 2]"
1 16 LEU 6.983 0.184 2 0 "[ . 1 . 2]"
1 17 LYS 6.365 0.359 2 0 "[ . 1 . 2]"
1 18 SER 2.283 0.132 9 0 "[ . 1 . 2]"
1 19 THR 3.738 0.150 2 0 "[ . 1 . 2]"
1 20 PHE 3.402 0.160 5 0 "[ . 1 . 2]"
1 21 ASP 2.282 0.150 2 0 "[ . 1 . 2]"
1 22 GLY 0.219 0.049 5 0 "[ . 1 . 2]"
1 23 ARG 2.924 0.182 3 0 "[ . 1 . 2]"
1 24 MET 6.122 0.163 7 0 "[ . 1 . 2]"
1 25 ARG 5.330 0.303 18 0 "[ . 1 . 2]"
1 26 LEU 8.678 0.222 17 0 "[ . 1 . 2]"
1 27 ASN 1.045 0.108 7 0 "[ . 1 . 2]"
1 28 GLU 0.397 0.224 20 0 "[ . 1 . 2]"
1 29 ILE 7.525 0.163 7 0 "[ . 1 . 2]"
1 30 TYR 6.434 0.269 7 0 "[ . 1 . 2]"
1 31 ASN 1.560 0.107 3 0 "[ . 1 . 2]"
1 32 TRP 8.281 0.160 16 0 "[ . 1 . 2]"
1 33 PHE 1.977 0.092 13 0 "[ . 1 . 2]"
1 34 ALA 1.962 0.082 20 0 "[ . 1 . 2]"
1 35 SER 1.212 0.094 20 0 "[ . 1 . 2]"
1 36 ASN 2.480 0.137 4 0 "[ . 1 . 2]"
1 37 VAL 1.877 0.067 13 0 "[ . 1 . 2]"
1 38 PRO 1.537 0.120 6 0 "[ . 1 . 2]"
1 39 TYR 4.677 0.160 19 0 "[ . 1 . 2]"
1 40 PHE 1.435 0.080 8 0 "[ . 1 . 2]"
1 41 GLY 1.216 0.094 20 0 "[ . 1 . 2]"
1 42 ASN 2.760 0.169 13 0 "[ . 1 . 2]"
1 43 ARG 1.376 0.123 6 0 "[ . 1 . 2]"
1 44 THR 2.283 0.285 2 0 "[ . 1 . 2]"
1 45 SER 1.643 0.179 5 0 "[ . 1 . 2]"
1 46 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 GLU 0.322 0.106 5 0 "[ . 1 . 2]"
1 48 GLN 4.782 0.352 6 0 "[ . 1 . 2]"
1 49 SER 0.416 0.060 9 0 "[ . 1 . 2]"
1 50 ALA 0.993 0.105 20 0 "[ . 1 . 2]"
1 51 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 TRP 6.581 0.133 7 0 "[ . 1 . 2]"
1 53 LYS 5.751 0.269 7 0 "[ . 1 . 2]"
1 54 ASN 0.431 0.092 7 0 "[ . 1 . 2]"
1 55 SER 0.341 0.121 13 0 "[ . 1 . 2]"
1 56 ILE 3.778 0.162 2 0 "[ . 1 . 2]"
1 57 ARG 4.622 0.168 13 0 "[ . 1 . 2]"
1 58 HIS 0.250 0.063 17 0 "[ . 1 . 2]"
1 59 ASN 3.563 0.177 11 0 "[ . 1 . 2]"
1 60 LEU 4.625 0.154 4 0 "[ . 1 . 2]"
1 61 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 LEU 1.311 0.161 16 0 "[ . 1 . 2]"
1 63 HIS 0.231 0.106 14 0 "[ . 1 . 2]"
1 64 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 ARG 1.859 0.188 11 0 "[ . 1 . 2]"
1 66 PHE 1.508 0.176 18 0 "[ . 1 . 2]"
1 67 MET 1.664 0.136 18 0 "[ . 1 . 2]"
1 68 ARG 2.064 0.145 20 0 "[ . 1 . 2]"
1 69 ILE 6.166 0.187 10 0 "[ . 1 . 2]"
1 70 GLN 1.037 0.145 7 0 "[ . 1 . 2]"
1 71 ASN 1.887 0.126 9 0 "[ . 1 . 2]"
1 72 GLU 1.633 0.156 9 0 "[ . 1 . 2]"
1 73 GLY 0.563 0.141 9 0 "[ . 1 . 2]"
1 74 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 LYS 0.751 0.140 14 0 "[ . 1 . 2]"
1 77 SER 0.074 0.074 13 0 "[ . 1 . 2]"
1 78 SER 0.445 0.096 7 0 "[ . 1 . 2]"
1 79 TRP 3.896 0.324 11 0 "[ . 1 . 2]"
1 80 TRP 7.152 0.222 17 0 "[ . 1 . 2]"
1 81 VAL 0.598 0.092 2 0 "[ . 1 . 2]"
1 82 ILE 0.657 0.051 8 0 "[ . 1 . 2]"
1 83 ASN 5.542 0.188 11 0 "[ . 1 . 2]"
1 84 PRO 0.326 0.073 11 0 "[ . 1 . 2]"
1 85 ASP 0.299 0.104 5 0 "[ . 1 . 2]"
1 86 ALA 2.589 0.198 7 0 "[ . 1 . 2]"
1 87 LYS 3.416 0.260 4 0 "[ . 1 . 2]"
1 88 PRO 0.607 0.152 11 0 "[ . 1 . 2]"
1 89 GLY 0.142 0.086 18 0 "[ . 1 . 2]"
1 90 ARG 0.052 0.047 10 0 "[ . 1 . 2]"
1 91 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 PRO 0.057 0.057 3 0 "[ . 1 . 2]"
1 93 ARG 0.196 0.139 12 0 "[ . 1 . 2]"
1 94 ARG 0.147 0.139 12 0 "[ . 1 . 2]"
1 95 GLN 0.137 0.099 5 0 "[ . 1 . 2]"
1 96 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 SER 0.137 0.099 5 0 "[ . 1 . 2]"
1 98 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 THR 0.579 0.077 2 0 "[ . 1 . 2]"
1 100 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 ASN HA 1 1 ASN HD21 . . 4.870 4.088 3.865 4.513 . 0 0 "[ . 1 . 2]" 1
2 1 1 ASN HA 1 1 ASN HD22 . . 5.220 4.519 4.319 4.798 . 0 0 "[ . 1 . 2]" 1
3 1 1 ASN HA 1 2 PRO HD2 . . 3.480 2.341 2.217 2.548 . 0 0 "[ . 1 . 2]" 1
4 1 1 ASN HA 1 2 PRO HD3 . . 3.100 2.445 2.279 2.607 . 0 0 "[ . 1 . 2]" 1
5 1 1 ASN HA 1 4 GLY H . . 4.700 4.661 4.517 4.746 0.046 1 0 "[ . 1 . 2]" 1
6 1 1 ASN HB2 1 1 ASN HD21 . . 3.370 2.238 2.199 2.277 . 0 0 "[ . 1 . 2]" 1
7 1 1 ASN HB2 1 1 ASN HD22 . . 3.750 3.467 3.445 3.485 . 0 0 "[ . 1 . 2]" 1
8 1 1 ASN HB2 1 2 PRO HD2 . . 4.120 3.744 3.644 3.866 . 0 0 "[ . 1 . 2]" 1
9 1 1 ASN HB2 1 4 GLY H . . 3.820 2.614 2.302 2.895 . 0 0 "[ . 1 . 2]" 1
10 1 1 ASN HB2 1 7 SER HA . . 5.110 4.884 4.475 5.127 0.017 5 0 "[ . 1 . 2]" 1
11 1 1 ASN HB3 1 1 ASN HD22 . . 4.290 3.991 3.785 4.057 . 0 0 "[ . 1 . 2]" 1
12 1 1 ASN HB3 1 2 PRO HD2 . . 3.490 2.243 2.086 2.377 . 0 0 "[ . 1 . 2]" 1
13 1 1 ASN HB3 1 2 PRO HD3 . . 3.710 3.707 3.509 3.760 0.050 11 0 "[ . 1 . 2]" 1
14 1 1 ASN HB3 1 4 GLY H . . 4.780 3.347 3.128 3.640 . 0 0 "[ . 1 . 2]" 1
15 1 1 ASN HD21 1 6 GLU H . . 4.930 4.518 3.477 4.941 0.011 5 0 "[ . 1 . 2]" 1
16 1 1 ASN HD22 1 5 ALA MB . . 5.060 5.082 4.950 5.134 0.074 17 0 "[ . 1 . 2]" 1
17 1 1 ASN HD22 1 7 SER HA . . 3.790 3.206 2.581 3.739 . 0 0 "[ . 1 . 2]" 1
18 1 2 PRO HA 1 2 PRO HD2 . . 4.780 4.092 4.050 4.136 . 0 0 "[ . 1 . 2]" 1
19 1 2 PRO HA 1 2 PRO HD3 . . 4.490 3.465 3.320 3.633 . 0 0 "[ . 1 . 2]" 1
20 1 2 PRO HA 1 2 PRO HG2 . . 4.110 3.799 3.696 3.858 . 0 0 "[ . 1 . 2]" 1
21 1 2 PRO HA 1 2 PRO HG3 . . 4.210 4.055 3.961 4.125 . 0 0 "[ . 1 . 2]" 1
22 1 2 PRO HA 1 3 TRP H . . 5.040 3.461 2.781 3.545 . 0 0 "[ . 1 . 2]" 1
23 1 2 PRO HA 1 4 GLY H . . 4.580 4.553 4.411 4.608 0.028 11 0 "[ . 1 . 2]" 1
24 1 2 PRO HB2 1 2 PRO HD2 . . 4.340 4.066 4.030 4.099 . 0 0 "[ . 1 . 2]" 1
25 1 2 PRO HB2 1 39 TYR QE . . 4.140 2.170 2.110 2.238 . 0 0 "[ . 1 . 2]" 1
26 1 2 PRO HB3 1 39 TYR QE . . 3.830 2.714 2.360 3.123 . 0 0 "[ . 1 . 2]" 1
27 1 2 PRO HG2 1 39 TYR QE . . 4.320 4.364 4.330 4.393 0.073 4 0 "[ . 1 . 2]" 1
28 1 2 PRO HG2 1 52 TRP HE3 . . 5.240 5.273 5.244 5.312 0.072 18 0 "[ . 1 . 2]" 1
29 1 2 PRO HG3 1 39 TYR QE . . 5.030 4.292 4.148 4.472 . 0 0 "[ . 1 . 2]" 1
30 1 2 PRO HG3 1 52 TRP HE3 . . 4.860 4.948 4.915 4.963 0.103 3 0 "[ . 1 . 2]" 1
31 1 3 TRP HA 1 3 TRP HD1 . . 4.460 4.367 4.312 4.453 . 0 0 "[ . 1 . 2]" 1
32 1 3 TRP HA 1 4 GLY H . . 3.980 3.524 3.478 3.556 . 0 0 "[ . 1 . 2]" 1
33 1 3 TRP HA 1 37 VAL MG1 . . 4.930 2.881 2.556 3.201 . 0 0 "[ . 1 . 2]" 1
34 1 3 TRP HA 1 39 TYR H . . 4.980 5.051 5.009 5.095 0.115 14 0 "[ . 1 . 2]" 1
35 1 3 TRP HB2 1 3 TRP HD1 . . 3.470 2.848 2.757 3.035 . 0 0 "[ . 1 . 2]" 1
36 1 3 TRP HB2 1 4 GLY H . . 4.810 3.829 3.620 3.946 . 0 0 "[ . 1 . 2]" 1
37 1 3 TRP HB2 1 37 VAL MG1 . . 3.720 2.589 2.437 2.778 . 0 0 "[ . 1 . 2]" 1
38 1 3 TRP HB2 1 39 TYR QD . . 5.440 5.396 5.105 5.515 0.075 13 0 "[ . 1 . 2]" 1
39 1 3 TRP HB3 1 3 TRP HD1 . . 3.960 3.898 3.868 3.933 . 0 0 "[ . 1 . 2]" 1
40 1 3 TRP HB3 1 4 GLY H . . 4.710 4.191 4.102 4.255 . 0 0 "[ . 1 . 2]" 1
41 1 3 TRP HB3 1 37 VAL MG1 . . 4.090 2.352 2.075 2.495 . 0 0 "[ . 1 . 2]" 1
42 1 3 TRP HB3 1 39 TYR QD . . 5.180 4.198 3.940 4.356 . 0 0 "[ . 1 . 2]" 1
43 1 3 TRP HB3 1 40 PHE QE . . 4.550 2.162 1.835 3.225 . 0 0 "[ . 1 . 2]" 1
44 1 3 TRP HD1 1 5 ALA H . . 4.360 3.592 3.129 3.839 . 0 0 "[ . 1 . 2]" 1
45 1 3 TRP HD1 1 6 GLU H . . 4.160 3.149 2.835 3.541 . 0 0 "[ . 1 . 2]" 1
46 1 3 TRP HD1 1 6 GLU QB . . 5.180 3.122 2.460 3.997 . 0 0 "[ . 1 . 2]" 1
47 1 3 TRP HD1 1 11 LEU MD1 . . 3.390 2.967 2.813 3.167 . 0 0 "[ . 1 . 2]" 1
48 1 3 TRP HD1 1 11 LEU MD2 . . 4.990 4.480 4.220 4.600 . 0 0 "[ . 1 . 2]" 1
49 1 3 TRP HD1 1 11 LEU HG . . 4.480 4.541 4.502 4.565 0.085 12 0 "[ . 1 . 2]" 1
50 1 3 TRP HE1 1 6 GLU H . . 4.530 3.204 2.288 3.504 . 0 0 "[ . 1 . 2]" 1
51 1 3 TRP HE1 1 6 GLU QB . . 4.160 2.489 1.908 3.132 . 0 0 "[ . 1 . 2]" 1
52 1 3 TRP HE1 1 6 GLU QG . . 5.010 4.372 3.813 4.729 . 0 0 "[ . 1 . 2]" 1
53 1 3 TRP HE1 1 7 SER HA . . 4.470 3.603 3.147 4.094 . 0 0 "[ . 1 . 2]" 1
54 1 3 TRP HE1 1 11 LEU MD1 . . 3.900 3.110 2.865 3.357 . 0 0 "[ . 1 . 2]" 1
55 1 3 TRP HE1 1 11 LEU MD2 . . 5.000 4.516 4.012 4.803 . 0 0 "[ . 1 . 2]" 1
56 1 3 TRP HH2 1 7 SER HA . . 5.010 4.976 4.786 5.043 0.033 1 0 "[ . 1 . 2]" 1
57 1 3 TRP HH2 1 8 TYR H . . 3.580 3.630 3.596 3.649 0.069 13 0 "[ . 1 . 2]" 1
58 1 3 TRP HH2 1 8 TYR HA . . 3.910 1.965 1.892 2.097 . 0 0 "[ . 1 . 2]" 1
59 1 3 TRP HH2 1 8 TYR HB3 . . 3.800 3.126 2.985 3.223 . 0 0 "[ . 1 . 2]" 1
60 1 3 TRP HH2 1 12 ILE MD . . 4.250 4.342 4.294 4.437 0.187 13 0 "[ . 1 . 2]" 1
61 1 3 TRP HH2 1 56 ILE HA . . 5.100 4.969 4.471 5.164 0.064 7 0 "[ . 1 . 2]" 1
62 1 3 TRP HH2 1 56 ILE HG12 . . 4.590 3.971 3.458 4.246 . 0 0 "[ . 1 . 2]" 1
63 1 3 TRP HH2 1 56 ILE HG13 . . 4.650 4.461 4.177 4.660 0.010 18 0 "[ . 1 . 2]" 1
64 1 3 TRP HZ2 1 7 SER HA . . 4.190 2.920 2.628 3.153 . 0 0 "[ . 1 . 2]" 1
65 1 3 TRP HZ2 1 8 TYR H . . 4.120 2.716 2.560 2.896 . 0 0 "[ . 1 . 2]" 1
66 1 3 TRP HZ2 1 8 TYR HA . . 4.690 2.294 2.158 2.500 . 0 0 "[ . 1 . 2]" 1
67 1 3 TRP HZ3 1 56 ILE MD . . 3.530 3.301 2.684 3.599 0.069 18 0 "[ . 1 . 2]" 1
68 1 3 TRP HZ3 1 56 ILE HG12 . . 4.770 3.779 3.033 4.116 . 0 0 "[ . 1 . 2]" 1
69 1 3 TRP HZ3 1 56 ILE HG13 . . 4.610 3.641 3.167 4.048 . 0 0 "[ . 1 . 2]" 1
70 1 4 GLY H 1 5 ALA H . . 4.630 4.115 3.907 4.217 . 0 0 "[ . 1 . 2]" 1
71 1 4 GLY HA2 1 5 ALA H . . 3.320 3.147 3.043 3.322 0.002 15 0 "[ . 1 . 2]" 1
72 1 4 GLY HA2 1 6 GLU H . . 5.120 4.956 4.578 5.317 0.197 15 0 "[ . 1 . 2]" 1
73 1 4 GLY HA3 1 5 ALA H . . 3.420 2.163 2.080 2.223 . 0 0 "[ . 1 . 2]" 1
74 1 5 ALA H 1 5 ALA MB . . 2.930 2.370 2.304 2.508 . 0 0 "[ . 1 . 2]" 1
75 1 5 ALA H 1 6 GLU H . . 3.400 2.327 2.052 3.427 0.027 12 0 "[ . 1 . 2]" 1
76 1 5 ALA HA 1 6 GLU H . . 3.880 3.402 2.100 3.568 . 0 0 "[ . 1 . 2]" 1
77 1 5 ALA MB 1 6 GLU H . . 3.390 2.971 2.694 3.475 0.085 12 0 "[ . 1 . 2]" 1
78 1 6 GLU H 1 6 GLU QB . . 3.050 2.490 2.349 2.681 . 0 0 "[ . 1 . 2]" 1
79 1 6 GLU H 1 6 GLU QG . . 3.200 2.682 2.218 3.262 0.062 12 0 "[ . 1 . 2]" 1
80 1 6 GLU H 1 11 LEU MD1 . . 4.990 4.615 4.236 5.002 0.012 18 0 "[ . 1 . 2]" 1
81 1 6 GLU HA 1 6 GLU QG . . 3.310 2.505 2.351 2.814 . 0 0 "[ . 1 . 2]" 1
82 1 6 GLU HA 1 7 SER H . . 2.860 2.396 2.266 2.536 . 0 0 "[ . 1 . 2]" 1
83 1 6 GLU HA 1 10 ASP HB2 . . 4.310 4.062 3.909 4.247 . 0 0 "[ . 1 . 2]" 1
84 1 6 GLU HA 1 10 ASP HB3 . . 4.580 4.624 4.587 4.665 0.085 9 0 "[ . 1 . 2]" 1
85 1 6 GLU QB 1 7 SER H . . 3.610 2.444 2.177 2.772 . 0 0 "[ . 1 . 2]" 1
86 1 6 GLU QB 1 10 ASP HB2 . . 3.870 2.647 2.197 3.298 . 0 0 "[ . 1 . 2]" 1
87 1 6 GLU QB 1 10 ASP HB3 . . 3.780 3.014 2.474 3.689 . 0 0 "[ . 1 . 2]" 1
88 1 6 GLU QB 1 11 LEU H . . 4.120 3.695 3.568 3.823 . 0 0 "[ . 1 . 2]" 1
89 1 6 GLU QB 1 11 LEU MD1 . . 4.260 2.868 2.455 3.217 . 0 0 "[ . 1 . 2]" 1
90 1 6 GLU QB 1 11 LEU MD2 . . 3.600 2.708 2.494 3.065 . 0 0 "[ . 1 . 2]" 1
91 1 6 GLU QB 1 11 LEU HG . . 3.920 2.398 2.051 2.745 . 0 0 "[ . 1 . 2]" 1
92 1 6 GLU QG 1 7 SER H . . 4.120 3.922 3.661 4.193 0.073 11 0 "[ . 1 . 2]" 1
93 1 6 GLU QG 1 10 ASP HB2 . . 4.510 4.341 3.964 4.537 0.027 9 0 "[ . 1 . 2]" 1
94 1 6 GLU QG 1 11 LEU MD2 . . 3.830 3.028 2.017 3.830 0.000 7 0 "[ . 1 . 2]" 1
95 1 7 SER H 1 7 SER HB2 . . 3.970 2.503 2.350 2.886 . 0 0 "[ . 1 . 2]" 1
96 1 7 SER H 1 10 ASP H . . 4.060 3.694 3.400 3.984 . 0 0 "[ . 1 . 2]" 1
97 1 7 SER H 1 10 ASP HB2 . . 3.390 2.195 2.105 2.306 . 0 0 "[ . 1 . 2]" 1
98 1 7 SER H 1 10 ASP HB3 . . 3.800 3.458 3.258 3.585 . 0 0 "[ . 1 . 2]" 1
99 1 7 SER H 1 11 LEU H . . 4.090 4.167 4.127 4.211 0.121 18 0 "[ . 1 . 2]" 1
100 1 7 SER HA 1 8 TYR H . . 3.220 2.393 2.320 2.464 . 0 0 "[ . 1 . 2]" 1
101 1 7 SER HB3 1 9 SER H . . 3.580 3.375 3.122 3.649 0.069 11 0 "[ . 1 . 2]" 1
102 1 7 SER HB3 1 10 ASP H . . 3.460 3.330 2.521 3.541 0.081 3 0 "[ . 1 . 2]" 1
103 1 8 TYR H 1 8 TYR HB2 . . 3.290 2.487 2.385 2.565 . 0 0 "[ . 1 . 2]" 1
104 1 8 TYR H 1 8 TYR HB3 . . 3.700 3.588 3.551 3.611 . 0 0 "[ . 1 . 2]" 1
105 1 8 TYR H 1 8 TYR QD . . 4.040 1.897 1.780 2.092 . 0 0 "[ . 1 . 2]" 1
106 1 8 TYR H 1 8 TYR QE . . 4.500 4.078 3.913 4.243 . 0 0 "[ . 1 . 2]" 1
107 1 8 TYR H 1 9 SER H . . 3.410 2.895 2.763 3.074 . 0 0 "[ . 1 . 2]" 1
108 1 8 TYR H 1 11 LEU H . . 4.880 4.906 4.841 4.976 0.096 14 0 "[ . 1 . 2]" 1
109 1 8 TYR HA 1 8 TYR QD . . 3.650 3.145 3.088 3.189 . 0 0 "[ . 1 . 2]" 1
110 1 8 TYR HA 1 11 LEU H . . 4.290 3.637 3.545 3.716 . 0 0 "[ . 1 . 2]" 1
111 1 8 TYR HA 1 11 LEU HB2 . . 4.120 3.341 3.204 3.419 . 0 0 "[ . 1 . 2]" 1
112 1 8 TYR HA 1 11 LEU MD1 . . 3.930 4.025 3.979 4.066 0.136 19 0 "[ . 1 . 2]" 1
113 1 8 TYR HB2 1 8 TYR QD . . 3.460 2.529 2.456 2.589 . 0 0 "[ . 1 . 2]" 1
114 1 8 TYR HB2 1 9 SER H . . 3.780 2.209 2.041 2.427 . 0 0 "[ . 1 . 2]" 1
115 1 8 TYR HB2 1 12 ILE MD . . 4.600 3.227 3.045 3.530 . 0 0 "[ . 1 . 2]" 1
116 1 8 TYR HB2 1 59 ASN HD21 . . 5.450 3.285 2.964 4.323 . 0 0 "[ . 1 . 2]" 1
117 1 8 TYR HB2 1 59 ASN HD22 . . 5.010 3.617 2.987 4.092 . 0 0 "[ . 1 . 2]" 1
118 1 8 TYR HB3 1 8 TYR QD . . 3.420 2.281 2.242 2.319 . 0 0 "[ . 1 . 2]" 1
119 1 8 TYR HB3 1 9 SER H . . 4.000 3.141 2.990 3.311 . 0 0 "[ . 1 . 2]" 1
120 1 8 TYR HB3 1 12 ILE H . . 4.950 4.680 4.606 4.781 . 0 0 "[ . 1 . 2]" 1
121 1 8 TYR HB3 1 12 ILE MD . . 4.310 2.095 1.969 2.276 . 0 0 "[ . 1 . 2]" 1
122 1 8 TYR HB3 1 59 ASN HD21 . . 5.050 3.417 2.768 5.076 0.026 13 0 "[ . 1 . 2]" 1
123 1 8 TYR HB3 1 59 ASN HD22 . . 5.270 4.343 4.027 4.708 . 0 0 "[ . 1 . 2]" 1
124 1 8 TYR QD 1 9 SER H . . 4.440 3.947 3.674 4.165 . 0 0 "[ . 1 . 2]" 1
125 1 8 TYR QD 1 12 ILE HG12 . . 4.650 4.674 4.548 4.755 0.105 11 0 "[ . 1 . 2]" 1
126 1 8 TYR QD 1 56 ILE HA . . 4.430 2.504 2.124 2.834 . 0 0 "[ . 1 . 2]" 1
127 1 8 TYR QD 1 56 ILE MD . . 4.470 3.761 3.359 4.151 . 0 0 "[ . 1 . 2]" 1
128 1 8 TYR QD 1 56 ILE HG12 . . 4.090 2.365 2.009 2.909 . 0 0 "[ . 1 . 2]" 1
129 1 8 TYR QD 1 56 ILE HG13 . . 4.200 2.807 2.316 3.187 . 0 0 "[ . 1 . 2]" 1
130 1 8 TYR QE 1 55 SER H . . 4.720 4.524 4.261 4.711 . 0 0 "[ . 1 . 2]" 1
131 1 8 TYR QE 1 56 ILE H . . 4.660 3.419 3.115 4.082 . 0 0 "[ . 1 . 2]" 1
132 1 9 SER H 1 10 ASP H . . 3.360 2.870 2.761 2.947 . 0 0 "[ . 1 . 2]" 1
133 1 9 SER H 1 59 ASN HD21 . . 5.210 5.270 4.971 5.387 0.177 11 0 "[ . 1 . 2]" 1
134 1 9 SER HA 1 10 ASP H . . 3.590 3.537 3.496 3.575 . 0 0 "[ . 1 . 2]" 1
135 1 9 SER HA 1 12 ILE HB . . 5.290 2.196 2.045 2.385 . 0 0 "[ . 1 . 2]" 1
136 1 9 SER HA 1 12 ILE MD . . 4.380 2.208 2.051 2.659 . 0 0 "[ . 1 . 2]" 1
137 1 9 SER QB 1 12 ILE H . . 4.830 4.854 4.836 4.901 0.071 12 0 "[ . 1 . 2]" 1
138 1 9 SER QB 1 12 ILE HB . . 4.060 3.994 3.902 4.078 0.018 5 0 "[ . 1 . 2]" 1
139 1 9 SER QB 1 12 ILE MD . . 3.720 3.761 3.356 3.864 0.144 14 0 "[ . 1 . 2]" 1
140 1 9 SER QB 1 12 ILE MG . . 5.490 4.763 4.613 4.960 . 0 0 "[ . 1 . 2]" 1
141 1 9 SER QB 1 13 ALA H . . 4.520 4.486 4.332 4.578 0.058 13 0 "[ . 1 . 2]" 1
142 1 10 ASP H 1 10 ASP HB2 . . 3.320 2.413 2.276 2.510 . 0 0 "[ . 1 . 2]" 1
143 1 10 ASP H 1 10 ASP HB3 . . 3.640 3.638 3.590 3.668 0.028 1 0 "[ . 1 . 2]" 1
144 1 10 ASP HA 1 11 LEU H . . 3.780 3.566 3.541 3.592 . 0 0 "[ . 1 . 2]" 1
145 1 10 ASP HA 1 13 ALA H . . 4.130 3.849 3.612 4.147 0.017 8 0 "[ . 1 . 2]" 1
146 1 10 ASP HA 1 13 ALA MB . . 3.540 3.120 2.819 3.488 . 0 0 "[ . 1 . 2]" 1
147 1 10 ASP HB2 1 11 LEU H . . 3.630 2.513 2.302 2.755 . 0 0 "[ . 1 . 2]" 1
148 1 10 ASP HB3 1 11 LEU H . . 3.890 3.309 3.089 3.470 . 0 0 "[ . 1 . 2]" 1
149 1 11 LEU H 1 11 LEU HB2 . . 3.350 2.372 2.332 2.455 . 0 0 "[ . 1 . 2]" 1
150 1 11 LEU H 1 11 LEU HB3 . . 3.450 3.558 3.547 3.577 0.127 18 0 "[ . 1 . 2]" 1
151 1 11 LEU H 1 11 LEU MD1 . . 3.950 3.786 3.738 3.867 . 0 0 "[ . 1 . 2]" 1
152 1 11 LEU H 1 11 LEU MD2 . . 4.910 3.331 3.127 3.505 . 0 0 "[ . 1 . 2]" 1
153 1 11 LEU H 1 11 LEU HG . . 3.210 2.618 2.497 2.751 . 0 0 "[ . 1 . 2]" 1
154 1 11 LEU H 1 12 ILE H . . 3.270 2.570 2.508 2.628 . 0 0 "[ . 1 . 2]" 1
155 1 11 LEU H 1 14 LYS H . . 5.020 4.746 4.490 4.897 . 0 0 "[ . 1 . 2]" 1
156 1 11 LEU HA 1 11 LEU HB3 . . 2.940 2.468 2.436 2.508 . 0 0 "[ . 1 . 2]" 1
157 1 11 LEU HA 1 11 LEU MD1 . . 4.240 3.731 3.703 3.754 . 0 0 "[ . 1 . 2]" 1
158 1 11 LEU HA 1 11 LEU MD2 . . 2.940 1.978 1.935 2.025 . 0 0 "[ . 1 . 2]" 1
159 1 11 LEU HA 1 11 LEU HG . . 3.350 3.216 3.135 3.302 . 0 0 "[ . 1 . 2]" 1
160 1 11 LEU HA 1 12 ILE H . . 4.440 3.506 3.487 3.526 . 0 0 "[ . 1 . 2]" 1
161 1 11 LEU HA 1 13 ALA H . . 4.710 4.242 4.106 4.363 . 0 0 "[ . 1 . 2]" 1
162 1 11 LEU HA 1 14 LYS H . . 4.070 3.039 2.796 3.205 . 0 0 "[ . 1 . 2]" 1
163 1 11 LEU HA 1 14 LYS QB . . 3.830 2.678 2.064 2.994 . 0 0 "[ . 1 . 2]" 1
164 1 11 LEU HA 1 14 LYS HG2 . . 4.960 4.204 3.948 4.468 . 0 0 "[ . 1 . 2]" 1
165 1 11 LEU HA 1 32 TRP HH2 . . 4.700 3.528 3.100 4.074 . 0 0 "[ . 1 . 2]" 1
166 1 11 LEU HB2 1 11 LEU MD2 . . 3.150 3.183 3.173 3.191 0.041 12 0 "[ . 1 . 2]" 1
167 1 11 LEU HB2 1 12 ILE H . . 4.030 2.831 2.766 2.923 . 0 0 "[ . 1 . 2]" 1
168 1 11 LEU HB3 1 11 LEU MD1 . . 2.960 2.235 2.210 2.262 . 0 0 "[ . 1 . 2]" 1
169 1 11 LEU HB3 1 11 LEU MD2 . . 2.950 2.456 2.424 2.513 . 0 0 "[ . 1 . 2]" 1
170 1 11 LEU HB3 1 12 ILE H . . 4.150 3.685 3.630 3.738 . 0 0 "[ . 1 . 2]" 1
171 1 11 LEU HB3 1 32 TRP HZ3 . . 3.950 2.292 2.060 2.710 . 0 0 "[ . 1 . 2]" 1
172 1 11 LEU MD1 1 11 LEU MD2 . . 2.940 2.070 2.054 2.082 . 0 0 "[ . 1 . 2]" 1
173 1 11 LEU MD1 1 32 TRP HZ3 . . 4.660 2.614 2.373 2.871 . 0 0 "[ . 1 . 2]" 1
174 1 11 LEU MD1 1 33 PHE QD . . 4.400 2.922 2.732 3.165 . 0 0 "[ . 1 . 2]" 1
175 1 11 LEU MD1 1 37 VAL MG1 . . 4.140 3.987 3.607 4.172 0.032 15 0 "[ . 1 . 2]" 1
176 1 11 LEU MD1 1 37 VAL MG2 . . 3.220 2.734 2.442 2.937 . 0 0 "[ . 1 . 2]" 1
177 1 11 LEU MD1 1 40 PHE QE . . 4.110 3.592 3.237 3.860 . 0 0 "[ . 1 . 2]" 1
178 1 11 LEU MD2 1 14 LYS HD2 . . 4.300 2.138 1.903 2.544 . 0 0 "[ . 1 . 2]" 1
179 1 11 LEU MD2 1 14 LYS HD3 . . 3.650 3.025 1.965 3.675 0.025 17 0 "[ . 1 . 2]" 1
180 1 11 LEU MD2 1 14 LYS QE . . 3.920 2.964 1.895 3.786 . 0 0 "[ . 1 . 2]" 1
181 1 11 LEU MD2 1 14 LYS HG3 . . 4.210 3.247 2.915 4.286 0.076 19 0 "[ . 1 . 2]" 1
182 1 11 LEU MD2 1 32 TRP HH2 . . 4.420 2.112 1.950 2.304 . 0 0 "[ . 1 . 2]" 1
183 1 11 LEU MD2 1 32 TRP HZ2 . . 4.150 4.100 3.888 4.203 0.053 10 0 "[ . 1 . 2]" 1
184 1 11 LEU MD2 1 32 TRP HZ3 . . 3.830 3.078 2.704 3.446 . 0 0 "[ . 1 . 2]" 1
185 1 12 ILE H 1 12 ILE HB . . 3.380 2.572 2.516 2.692 . 0 0 "[ . 1 . 2]" 1
186 1 12 ILE H 1 12 ILE MD . . 3.610 3.515 3.452 3.566 . 0 0 "[ . 1 . 2]" 1
187 1 12 ILE H 1 12 ILE HG12 . . 4.430 3.463 3.389 3.533 . 0 0 "[ . 1 . 2]" 1
188 1 12 ILE H 1 12 ILE HG13 . . 5.130 2.128 2.025 2.195 . 0 0 "[ . 1 . 2]" 1
189 1 12 ILE H 1 12 ILE MG . . 4.240 3.783 3.756 3.816 . 0 0 "[ . 1 . 2]" 1
190 1 12 ILE H 1 13 ALA H . . 3.470 2.668 2.573 2.744 . 0 0 "[ . 1 . 2]" 1
191 1 12 ILE HA 1 12 ILE MD . . 3.920 3.879 3.847 3.907 . 0 0 "[ . 1 . 2]" 1
192 1 12 ILE HA 1 12 ILE HG12 . . 4.150 2.624 2.579 2.706 . 0 0 "[ . 1 . 2]" 1
193 1 12 ILE HA 1 12 ILE HG13 . . 3.810 2.963 2.872 3.063 . 0 0 "[ . 1 . 2]" 1
194 1 12 ILE HA 1 12 ILE MG . . 3.600 2.425 2.364 2.457 . 0 0 "[ . 1 . 2]" 1
195 1 12 ILE HA 1 13 ALA H . . 4.340 3.530 3.502 3.559 . 0 0 "[ . 1 . 2]" 1
196 1 12 ILE HA 1 15 ALA H . . 4.080 3.304 3.151 3.488 . 0 0 "[ . 1 . 2]" 1
197 1 12 ILE HA 1 15 ALA MB . . 3.550 2.645 2.513 2.799 . 0 0 "[ . 1 . 2]" 1
198 1 12 ILE HA 1 16 LEU H . . 4.740 4.059 3.840 4.305 . 0 0 "[ . 1 . 2]" 1
199 1 12 ILE HA 1 29 ILE MG . . 3.960 3.021 2.797 3.164 . 0 0 "[ . 1 . 2]" 1
200 1 12 ILE HB 1 12 ILE MD . . 3.530 2.372 2.343 2.394 . 0 0 "[ . 1 . 2]" 1
201 1 12 ILE HB 1 13 ALA H . . 3.240 2.572 2.473 2.643 . 0 0 "[ . 1 . 2]" 1
202 1 12 ILE HB 1 80 TRP HH2 . . 4.780 4.200 3.728 4.861 0.081 5 0 "[ . 1 . 2]" 1
203 1 12 ILE MD 1 12 ILE MG . . 3.140 2.015 1.931 2.181 . 0 0 "[ . 1 . 2]" 1
204 1 12 ILE MD 1 13 ALA H . . 4.440 4.481 4.444 4.526 0.086 20 0 "[ . 1 . 2]" 1
205 1 12 ILE MD 1 56 ILE HA . . 3.660 3.006 2.718 3.223 . 0 0 "[ . 1 . 2]" 1
206 1 12 ILE MD 1 59 ASN HB2 . . 3.780 3.180 2.606 3.569 . 0 0 "[ . 1 . 2]" 1
207 1 12 ILE MD 1 59 ASN HB3 . . 3.980 3.521 2.870 4.000 0.020 6 0 "[ . 1 . 2]" 1
208 1 12 ILE MD 1 60 LEU H . . 4.270 4.121 3.602 4.341 0.071 8 0 "[ . 1 . 2]" 1
209 1 12 ILE MD 1 60 LEU HA . . 4.940 4.217 3.141 4.660 . 0 0 "[ . 1 . 2]" 1
210 1 12 ILE MD 1 60 LEU MD1 . . 4.340 3.610 3.297 4.038 . 0 0 "[ . 1 . 2]" 1
211 1 12 ILE MD 1 60 LEU MD2 . . 3.620 2.411 1.784 2.995 . 0 0 "[ . 1 . 2]" 1
212 1 12 ILE MD 1 80 TRP HH2 . . 4.250 4.118 3.860 4.382 0.132 13 0 "[ . 1 . 2]" 1
213 1 12 ILE MD 1 80 TRP HZ2 . . 4.610 3.794 3.297 4.622 0.012 5 0 "[ . 1 . 2]" 1
214 1 12 ILE HG13 1 12 ILE MG . . 3.140 3.182 3.166 3.204 0.064 5 0 "[ . 1 . 2]" 1
215 1 12 ILE MG 1 13 ALA H . . 4.000 3.398 3.257 3.505 . 0 0 "[ . 1 . 2]" 1
216 1 12 ILE MG 1 16 LEU H . . 4.710 3.806 3.691 3.942 . 0 0 "[ . 1 . 2]" 1
217 1 12 ILE MG 1 16 LEU HA . . 5.220 5.118 4.816 5.334 0.114 5 0 "[ . 1 . 2]" 1
218 1 12 ILE MG 1 16 LEU HB2 . . 4.080 3.718 3.085 4.100 0.020 11 0 "[ . 1 . 2]" 1
219 1 12 ILE MG 1 16 LEU QD . . 3.130 2.454 2.047 3.145 0.015 13 0 "[ . 1 . 2]" 1
220 1 12 ILE MG 1 16 LEU HG . . 3.680 3.731 3.541 3.819 0.139 13 0 "[ . 1 . 2]" 1
221 1 12 ILE MG 1 29 ILE MD . . 3.450 2.501 2.239 2.896 . 0 0 "[ . 1 . 2]" 1
222 1 12 ILE MG 1 60 LEU MD1 . . 4.270 3.748 3.358 4.264 . 0 0 "[ . 1 . 2]" 1
223 1 12 ILE MG 1 60 LEU MD2 . . 3.250 2.392 1.965 2.819 . 0 0 "[ . 1 . 2]" 1
224 1 12 ILE MG 1 80 TRP HH2 . . 4.020 2.348 1.915 3.258 . 0 0 "[ . 1 . 2]" 1
225 1 12 ILE MG 1 80 TRP HZ2 . . 4.640 2.513 1.880 4.285 . 0 0 "[ . 1 . 2]" 1
226 1 12 ILE MG 1 82 ILE MD . . 4.360 3.474 2.873 4.334 . 0 0 "[ . 1 . 2]" 1
227 1 13 ALA H 1 13 ALA MB . . 2.860 2.265 2.234 2.314 . 0 0 "[ . 1 . 2]" 1
228 1 13 ALA H 1 14 LYS H . . 3.400 2.747 2.631 2.821 . 0 0 "[ . 1 . 2]" 1
229 1 13 ALA H 1 15 ALA H . . 4.310 4.171 4.095 4.229 . 0 0 "[ . 1 . 2]" 1
230 1 13 ALA HA 1 14 LYS H . . 4.380 3.549 3.506 3.577 . 0 0 "[ . 1 . 2]" 1
231 1 13 ALA HA 1 15 ALA H . . 4.980 4.318 4.209 4.447 . 0 0 "[ . 1 . 2]" 1
232 1 13 ALA HA 1 16 LEU H . . 4.050 3.390 3.153 3.595 . 0 0 "[ . 1 . 2]" 1
233 1 13 ALA HA 1 16 LEU HB2 . . 3.650 2.462 2.133 2.803 . 0 0 "[ . 1 . 2]" 1
234 1 13 ALA HA 1 16 LEU HB3 . . 4.590 3.569 2.870 4.050 . 0 0 "[ . 1 . 2]" 1
235 1 13 ALA HA 1 16 LEU HG . . 3.760 3.705 3.271 3.830 0.070 14 0 "[ . 1 . 2]" 1
236 1 13 ALA HA 1 17 LYS H . . 4.660 3.903 3.700 4.155 . 0 0 "[ . 1 . 2]" 1
237 1 13 ALA HA 1 20 PHE QE . . 3.900 3.730 3.261 3.935 0.035 18 0 "[ . 1 . 2]" 1
238 1 13 ALA HA 1 82 ILE MD . . 3.490 2.228 1.944 2.571 . 0 0 "[ . 1 . 2]" 1
239 1 13 ALA MB 1 14 LYS H . . 3.780 2.622 2.444 2.780 . 0 0 "[ . 1 . 2]" 1
240 1 13 ALA MB 1 20 PHE QE . . 3.680 3.643 3.093 3.783 0.103 5 0 "[ . 1 . 2]" 1
241 1 13 ALA MB 1 82 ILE MD . . 3.180 2.574 2.306 2.902 . 0 0 "[ . 1 . 2]" 1
242 1 14 LYS H 1 14 LYS QB . . 3.160 2.529 2.242 2.623 . 0 0 "[ . 1 . 2]" 1
243 1 14 LYS H 1 14 LYS HG2 . . 4.310 3.532 3.273 4.359 0.049 19 0 "[ . 1 . 2]" 1
244 1 14 LYS H 1 14 LYS HG3 . . 4.520 2.492 2.174 4.467 . 0 0 "[ . 1 . 2]" 1
245 1 14 LYS H 1 15 ALA H . . 3.580 2.650 2.439 2.763 . 0 0 "[ . 1 . 2]" 1
246 1 14 LYS HA 1 14 LYS HG2 . . 3.390 2.618 2.476 3.167 . 0 0 "[ . 1 . 2]" 1
247 1 14 LYS HA 1 14 LYS HG3 . . 3.660 3.150 2.600 3.306 . 0 0 "[ . 1 . 2]" 1
248 1 14 LYS HA 1 17 LYS H . . 3.960 3.264 2.943 3.518 . 0 0 "[ . 1 . 2]" 1
249 1 14 LYS HA 1 17 LYS HB2 . . 3.760 2.480 2.048 3.886 0.126 10 0 "[ . 1 . 2]" 1
250 1 14 LYS HA 1 17 LYS HB3 . . 3.860 3.411 1.997 3.903 0.043 16 0 "[ . 1 . 2]" 1
251 1 14 LYS HA 1 17 LYS QD . . 4.280 2.880 2.040 4.329 0.049 17 0 "[ . 1 . 2]" 1
252 1 14 LYS QB 1 14 LYS QE . . 3.060 2.883 1.863 3.356 0.296 9 0 "[ . 1 . 2]" 1
253 1 14 LYS QB 1 15 ALA H . . 3.470 2.612 2.382 2.728 . 0 0 "[ . 1 . 2]" 1
254 1 14 LYS QB 1 32 TRP HH2 . . 3.530 2.802 2.612 3.240 . 0 0 "[ . 1 . 2]" 1
255 1 14 LYS QB 1 32 TRP HZ2 . . 4.490 2.285 2.076 3.632 . 0 0 "[ . 1 . 2]" 1
256 1 14 LYS HD2 1 14 LYS HG2 . . 2.950 2.861 2.500 2.997 0.047 6 0 "[ . 1 . 2]" 1
257 1 14 LYS HD2 1 32 TRP HH2 . . 3.600 2.813 1.978 3.742 0.142 10 0 "[ . 1 . 2]" 1
258 1 14 LYS HD2 1 32 TRP HZ2 . . 5.050 3.648 2.577 4.629 . 0 0 "[ . 1 . 2]" 1
259 1 14 LYS HD3 1 32 TRP HH2 . . 4.340 2.845 2.027 3.778 . 0 0 "[ . 1 . 2]" 1
260 1 14 LYS HD3 1 32 TRP HZ2 . . 4.760 2.811 2.478 3.327 . 0 0 "[ . 1 . 2]" 1
261 1 14 LYS QE 1 14 LYS HG2 . . 3.260 2.383 2.190 3.286 0.026 19 0 "[ . 1 . 2]" 1
262 1 14 LYS QE 1 14 LYS HG3 . . 3.260 2.851 2.121 3.305 0.045 2 0 "[ . 1 . 2]" 1
263 1 14 LYS QE 1 32 TRP HH2 . . 4.210 3.816 2.787 4.268 0.058 13 0 "[ . 1 . 2]" 1
264 1 14 LYS QE 1 32 TRP HZ2 . . 4.280 3.787 2.033 4.440 0.160 16 0 "[ . 1 . 2]" 1
265 1 14 LYS HG2 1 32 TRP HH2 . . 5.280 4.841 3.183 5.150 . 0 0 "[ . 1 . 2]" 1
266 1 14 LYS HG2 1 32 TRP HZ2 . . 5.220 4.307 1.993 4.634 . 0 0 "[ . 1 . 2]" 1
267 1 14 LYS HG3 1 32 TRP HH2 . . 4.400 4.340 4.093 4.458 0.058 13 0 "[ . 1 . 2]" 1
268 1 14 LYS HG3 1 32 TRP HZ2 . . 4.650 4.585 3.490 4.738 0.088 13 0 "[ . 1 . 2]" 1
269 1 15 ALA H 1 15 ALA MB . . 3.030 2.259 2.230 2.289 . 0 0 "[ . 1 . 2]" 1
270 1 15 ALA H 1 16 LEU H . . 3.490 2.654 2.469 2.743 . 0 0 "[ . 1 . 2]" 1
271 1 15 ALA H 1 32 TRP HH2 . . 4.890 4.826 4.699 4.917 0.027 18 0 "[ . 1 . 2]" 1
272 1 15 ALA HA 1 16 LEU H . . 4.550 3.499 3.453 3.527 . 0 0 "[ . 1 . 2]" 1
273 1 15 ALA HA 1 18 SER H . . 3.680 3.700 3.562 3.746 0.066 1 0 "[ . 1 . 2]" 1
274 1 15 ALA HA 1 18 SER HB3 . . 5.160 3.832 3.508 4.802 . 0 0 "[ . 1 . 2]" 1
275 1 15 ALA HA 1 32 TRP HD1 . . 3.880 2.968 2.640 3.256 . 0 0 "[ . 1 . 2]" 1
276 1 15 ALA HA 1 32 TRP HE1 . . 3.720 3.052 2.774 3.322 . 0 0 "[ . 1 . 2]" 1
277 1 15 ALA MB 1 16 LEU H . . 2.980 2.296 2.210 2.518 . 0 0 "[ . 1 . 2]" 1
278 1 15 ALA MB 1 29 ILE HA . . 4.130 2.428 2.229 2.795 . 0 0 "[ . 1 . 2]" 1
279 1 15 ALA MB 1 32 TRP H . . 4.340 4.249 4.128 4.365 0.025 19 0 "[ . 1 . 2]" 1
280 1 15 ALA MB 1 32 TRP HA . . 4.580 4.645 4.624 4.676 0.096 19 0 "[ . 1 . 2]" 1
281 1 15 ALA MB 1 32 TRP HB2 . . 3.990 2.784 2.736 2.823 . 0 0 "[ . 1 . 2]" 1
282 1 15 ALA MB 1 32 TRP HB3 . . 4.100 2.468 2.331 2.624 . 0 0 "[ . 1 . 2]" 1
283 1 15 ALA MB 1 32 TRP HD1 . . 4.280 3.713 3.502 3.969 . 0 0 "[ . 1 . 2]" 1
284 1 15 ALA MB 1 32 TRP HE1 . . 4.670 4.326 4.099 4.606 . 0 0 "[ . 1 . 2]" 1
285 1 15 ALA MB 1 32 TRP HE3 . . 3.980 3.002 2.743 3.333 . 0 0 "[ . 1 . 2]" 1
286 1 15 ALA MB 1 32 TRP HZ3 . . 5.260 4.161 3.946 4.521 . 0 0 "[ . 1 . 2]" 1
287 1 15 ALA MB 1 33 PHE QD . . 4.510 3.885 3.524 4.377 . 0 0 "[ . 1 . 2]" 1
288 1 16 LEU H 1 16 LEU HB2 . . 2.830 2.133 1.886 2.296 . 0 0 "[ . 1 . 2]" 1
289 1 16 LEU H 1 16 LEU HB3 . . 3.610 3.303 2.839 3.561 . 0 0 "[ . 1 . 2]" 1
290 1 16 LEU H 1 16 LEU QD . . 4.580 2.640 2.171 3.387 . 0 0 "[ . 1 . 2]" 1
291 1 16 LEU H 1 16 LEU HG . . 4.630 4.047 3.891 4.325 . 0 0 "[ . 1 . 2]" 1
292 1 16 LEU H 1 17 LYS H . . 3.160 2.706 2.556 2.846 . 0 0 "[ . 1 . 2]" 1
293 1 16 LEU H 1 18 SER H . . 4.610 4.190 3.913 4.327 . 0 0 "[ . 1 . 2]" 1
294 1 16 LEU HA 1 16 LEU QD . . 3.610 1.936 1.863 1.982 . 0 0 "[ . 1 . 2]" 1
295 1 16 LEU HA 1 17 LYS H . . 4.240 3.544 3.482 3.642 . 0 0 "[ . 1 . 2]" 1
296 1 16 LEU HA 1 18 SER H . . 4.470 3.866 3.577 4.016 . 0 0 "[ . 1 . 2]" 1
297 1 16 LEU HA 1 19 THR MG . . 4.080 3.316 2.911 3.985 . 0 0 "[ . 1 . 2]" 1
298 1 16 LEU HA 1 24 MET HG2 . . 4.380 4.057 2.707 4.511 0.131 4 0 "[ . 1 . 2]" 1
299 1 16 LEU HA 1 24 MET HG3 . . 5.300 3.746 2.261 4.527 . 0 0 "[ . 1 . 2]" 1
300 1 16 LEU HB2 1 17 LYS H . . 3.020 2.938 2.653 3.204 0.184 2 0 "[ . 1 . 2]" 1
301 1 16 LEU HB2 1 20 PHE QD . . 4.280 3.594 2.927 4.287 0.007 12 0 "[ . 1 . 2]" 1
302 1 16 LEU HB2 1 20 PHE QE . . 4.400 3.560 2.888 4.432 0.032 14 0 "[ . 1 . 2]" 1
303 1 16 LEU HB3 1 17 LYS H . . 4.380 3.018 2.344 3.631 . 0 0 "[ . 1 . 2]" 1
304 1 16 LEU HB3 1 20 PHE QD . . 4.500 2.250 1.958 2.765 . 0 0 "[ . 1 . 2]" 1
305 1 16 LEU QD 1 17 LYS H . . 4.240 3.881 3.658 4.012 . 0 0 "[ . 1 . 2]" 1
306 1 16 LEU QD 1 19 THR H . . 5.150 4.388 3.905 4.783 . 0 0 "[ . 1 . 2]" 1
307 1 16 LEU QD 1 19 THR MG . . 4.060 3.287 2.912 3.840 . 0 0 "[ . 1 . 2]" 1
308 1 16 LEU QD 1 20 PHE QD . . 3.420 3.166 2.417 3.549 0.129 16 0 "[ . 1 . 2]" 1
309 1 16 LEU QD 1 23 ARG HA . . 3.780 3.509 2.937 3.810 0.030 5 0 "[ . 1 . 2]" 1
310 1 16 LEU QD 1 23 ARG QB . . 4.600 4.369 3.700 4.662 0.062 8 0 "[ . 1 . 2]" 1
311 1 16 LEU QD 1 24 MET H . . 4.270 2.920 2.566 3.265 . 0 0 "[ . 1 . 2]" 1
312 1 16 LEU QD 1 24 MET HB2 . . 3.850 2.056 1.747 2.413 . 0 0 "[ . 1 . 2]" 1
313 1 16 LEU QD 1 24 MET HB3 . . 3.310 2.355 2.064 3.027 . 0 0 "[ . 1 . 2]" 1
314 1 16 LEU QD 1 24 MET HG2 . . 3.770 3.513 2.754 3.822 0.052 2 0 "[ . 1 . 2]" 1
315 1 16 LEU QD 1 24 MET HG3 . . 4.130 3.517 2.109 4.119 . 0 0 "[ . 1 . 2]" 1
316 1 16 LEU QD 1 25 ARG H . . 5.020 4.948 4.749 5.079 0.059 1 0 "[ . 1 . 2]" 1
317 1 16 LEU QD 1 80 TRP QB . . 4.620 4.180 2.694 4.750 0.130 10 0 "[ . 1 . 2]" 1
318 1 16 LEU QD 1 80 TRP HE3 . . 4.480 3.319 1.870 3.903 . 0 0 "[ . 1 . 2]" 1
319 1 16 LEU QD 1 81 VAL HA . . 4.350 2.329 1.915 2.701 . 0 0 "[ . 1 . 2]" 1
320 1 16 LEU QD 1 82 ILE H . . 3.630 2.926 2.170 3.351 . 0 0 "[ . 1 . 2]" 1
321 1 16 LEU HG 1 20 PHE QE . . 3.990 3.852 3.561 4.013 0.023 10 0 "[ . 1 . 2]" 1
322 1 16 LEU HG 1 81 VAL HA . . 3.990 3.870 3.591 4.082 0.092 2 0 "[ . 1 . 2]" 1
323 1 16 LEU HG 1 82 ILE H . . 4.320 3.649 2.761 4.034 . 0 0 "[ . 1 . 2]" 1
324 1 16 LEU HG 1 82 ILE HG13 . . 4.170 2.111 1.831 2.454 . 0 0 "[ . 1 . 2]" 1
325 1 17 LYS H 1 17 LYS HB2 . . 3.490 2.444 2.274 3.564 0.074 10 0 "[ . 1 . 2]" 1
326 1 17 LYS H 1 17 LYS HB3 . . 3.510 3.209 1.991 3.593 0.083 5 0 "[ . 1 . 2]" 1
327 1 17 LYS H 1 17 LYS QD . . 4.840 3.971 3.475 4.585 . 0 0 "[ . 1 . 2]" 1
328 1 17 LYS H 1 17 LYS HG2 . . 3.460 3.272 2.247 3.819 0.359 2 0 "[ . 1 . 2]" 1
329 1 17 LYS H 1 17 LYS HG3 . . 4.330 3.099 2.260 4.286 . 0 0 "[ . 1 . 2]" 1
330 1 17 LYS H 1 18 SER H . . 3.340 2.832 2.595 2.947 . 0 0 "[ . 1 . 2]" 1
331 1 17 LYS H 1 19 THR H . . 4.610 4.368 4.154 4.508 . 0 0 "[ . 1 . 2]" 1
332 1 17 LYS H 1 82 ILE MD . . 4.740 4.697 4.230 4.781 0.041 20 0 "[ . 1 . 2]" 1
333 1 17 LYS HA 1 17 LYS QD . . 4.330 3.753 1.901 4.228 . 0 0 "[ . 1 . 2]" 1
334 1 17 LYS HA 1 17 LYS HG2 . . 3.570 2.659 2.352 3.712 0.142 10 0 "[ . 1 . 2]" 1
335 1 17 LYS HA 1 17 LYS HG3 . . 3.420 3.073 2.583 3.622 0.202 3 0 "[ . 1 . 2]" 1
336 1 17 LYS HA 1 18 SER H . . 4.350 3.445 3.308 3.509 . 0 0 "[ . 1 . 2]" 1
337 1 17 LYS HA 1 19 THR H . . 4.260 3.587 3.300 3.876 . 0 0 "[ . 1 . 2]" 1
338 1 17 LYS HA 1 20 PHE QE . . 4.110 4.060 2.717 4.228 0.118 7 0 "[ . 1 . 2]" 1
339 1 17 LYS HB2 1 17 LYS QD . . 3.440 2.650 2.284 3.408 . 0 0 "[ . 1 . 2]" 1
340 1 17 LYS HB2 1 17 LYS QE . . 4.030 3.581 2.808 4.116 0.086 17 0 "[ . 1 . 2]" 1
341 1 17 LYS HB2 1 17 LYS HG2 . . 3.000 2.840 2.397 3.008 0.008 15 0 "[ . 1 . 2]" 1
342 1 17 LYS HB2 1 18 SER H . . 4.130 3.538 3.121 4.208 0.078 10 0 "[ . 1 . 2]" 1
343 1 17 LYS HB3 1 17 LYS QD . . 2.980 2.571 2.258 2.958 . 0 0 "[ . 1 . 2]" 1
344 1 17 LYS HB3 1 17 LYS QE . . 4.020 3.063 1.945 4.068 0.048 19 0 "[ . 1 . 2]" 1
345 1 17 LYS HB3 1 17 LYS HG2 . . 2.980 2.517 2.086 2.998 0.018 3 0 "[ . 1 . 2]" 1
346 1 17 LYS HB3 1 18 SER H . . 4.860 3.783 2.968 4.237 . 0 0 "[ . 1 . 2]" 1
347 1 17 LYS QD 1 17 LYS HG3 . . 2.590 2.271 2.167 2.460 . 0 0 "[ . 1 . 2]" 1
348 1 17 LYS QE 1 17 LYS HG2 . . 2.990 2.475 2.301 3.017 0.027 19 0 "[ . 1 . 2]" 1
349 1 17 LYS QE 1 17 LYS HG3 . . 3.580 2.915 2.312 3.479 . 0 0 "[ . 1 . 2]" 1
350 1 18 SER H 1 18 SER HB2 . . 4.010 3.253 2.353 3.701 . 0 0 "[ . 1 . 2]" 1
351 1 18 SER H 1 18 SER HB3 . . 3.330 2.658 2.392 3.462 0.132 9 0 "[ . 1 . 2]" 1
352 1 18 SER H 1 19 THR H . . 3.190 2.579 2.431 2.652 . 0 0 "[ . 1 . 2]" 1
353 1 18 SER H 1 32 TRP HE1 . . 4.890 4.835 4.496 4.959 0.069 16 0 "[ . 1 . 2]" 1
354 1 18 SER HA 1 19 THR H . . 4.040 3.372 3.238 3.482 . 0 0 "[ . 1 . 2]" 1
355 1 18 SER HB2 1 32 TRP HD1 . . 4.240 3.833 2.969 4.272 0.032 20 0 "[ . 1 . 2]" 1
356 1 18 SER HB2 1 32 TRP HE1 . . 4.610 4.159 2.574 4.720 0.110 1 0 "[ . 1 . 2]" 1
357 1 18 SER HB3 1 32 TRP HD1 . . 4.240 3.463 3.014 3.996 . 0 0 "[ . 1 . 2]" 1
358 1 18 SER HB3 1 32 TRP HE1 . . 4.360 3.593 3.137 4.431 0.071 16 0 "[ . 1 . 2]" 1
359 1 19 THR H 1 19 THR HB . . 4.050 3.360 3.241 3.621 . 0 0 "[ . 1 . 2]" 1
360 1 19 THR H 1 19 THR MG . . 3.450 2.449 2.339 2.825 . 0 0 "[ . 1 . 2]" 1
361 1 19 THR H 1 20 PHE H . . 4.060 2.210 2.041 3.061 . 0 0 "[ . 1 . 2]" 1
362 1 19 THR HA 1 19 THR MG . . 3.300 3.201 3.175 3.225 . 0 0 "[ . 1 . 2]" 1
363 1 19 THR HA 1 20 PHE H . . 2.900 2.742 2.423 2.829 . 0 0 "[ . 1 . 2]" 1
364 1 19 THR MG 1 20 PHE H . . 4.260 3.699 3.575 4.275 0.015 5 0 "[ . 1 . 2]" 1
365 1 19 THR MG 1 21 ASP H . . 4.340 4.449 4.412 4.490 0.150 2 0 "[ . 1 . 2]" 1
366 1 19 THR MG 1 22 GLY H . . 4.290 3.837 3.357 4.067 . 0 0 "[ . 1 . 2]" 1
367 1 19 THR MG 1 22 GLY QA . . 4.730 4.307 3.432 4.724 . 0 0 "[ . 1 . 2]" 1
368 1 19 THR MG 1 23 ARG H . . 3.230 3.233 2.646 3.331 0.101 12 0 "[ . 1 . 2]" 1
369 1 19 THR MG 1 24 MET H . . 4.630 3.931 3.702 4.400 . 0 0 "[ . 1 . 2]" 1
370 1 19 THR MG 1 24 MET ME . . 3.130 2.953 1.964 3.196 0.066 1 0 "[ . 1 . 2]" 1
371 1 19 THR MG 1 24 MET HG2 . . 3.810 3.284 1.886 3.841 0.031 9 0 "[ . 1 . 2]" 1
372 1 19 THR MG 1 24 MET HG3 . . 3.780 2.619 1.934 3.831 0.051 5 0 "[ . 1 . 2]" 1
373 1 20 PHE H 1 20 PHE HB2 . . 3.430 2.157 2.081 2.300 . 0 0 "[ . 1 . 2]" 1
374 1 20 PHE H 1 20 PHE HB3 . . 3.340 2.823 2.652 3.500 0.160 5 0 "[ . 1 . 2]" 1
375 1 20 PHE H 1 21 ASP H . . 3.610 2.578 2.283 2.716 . 0 0 "[ . 1 . 2]" 1
376 1 20 PHE HA 1 21 ASP H . . 3.610 3.362 3.306 3.406 . 0 0 "[ . 1 . 2]" 1
377 1 20 PHE HB2 1 21 ASP H . . 3.860 3.719 2.877 3.885 0.025 17 0 "[ . 1 . 2]" 1
378 1 20 PHE HB3 1 21 ASP H . . 3.660 3.043 2.783 3.724 0.064 5 0 "[ . 1 . 2]" 1
379 1 20 PHE QD 1 82 ILE HG13 . . 5.140 4.991 4.615 5.169 0.029 3 0 "[ . 1 . 2]" 1
380 1 20 PHE QE 1 82 ILE MD . . 3.870 1.983 1.836 2.459 . 0 0 "[ . 1 . 2]" 1
381 1 20 PHE QE 1 82 ILE HG12 . . 5.300 4.672 4.336 4.997 . 0 0 "[ . 1 . 2]" 1
382 1 20 PHE QE 1 82 ILE HG13 . . 4.400 3.663 3.100 4.246 . 0 0 "[ . 1 . 2]" 1
383 1 20 PHE HZ 1 82 ILE MD . . 4.350 3.044 2.344 3.855 . 0 0 "[ . 1 . 2]" 1
384 1 21 ASP H 1 21 ASP HB2 . . 3.850 2.931 2.466 3.706 . 0 0 "[ . 1 . 2]" 1
385 1 21 ASP H 1 21 ASP HB3 . . 3.740 3.237 2.497 3.738 . 0 0 "[ . 1 . 2]" 1
386 1 21 ASP H 1 22 GLY H . . 2.970 2.378 2.197 2.563 . 0 0 "[ . 1 . 2]" 1
387 1 21 ASP HA 1 22 GLY H . . 3.900 3.295 3.150 3.410 . 0 0 "[ . 1 . 2]" 1
388 1 21 ASP HB3 1 22 GLY H . . 4.970 4.120 3.166 4.304 . 0 0 "[ . 1 . 2]" 1
389 1 22 GLY H 1 23 ARG H . . 3.260 3.205 2.900 3.309 0.049 5 0 "[ . 1 . 2]" 1
390 1 22 GLY QA 1 23 ARG H . . 3.630 2.146 2.089 2.270 . 0 0 "[ . 1 . 2]" 1
391 1 23 ARG H 1 23 ARG HD2 . . 4.600 4.121 2.119 4.782 0.182 3 0 "[ . 1 . 2]" 1
392 1 23 ARG H 1 23 ARG HD3 . . 5.230 4.586 2.446 5.129 . 0 0 "[ . 1 . 2]" 1
393 1 23 ARG H 1 23 ARG QG . . 3.380 2.646 2.188 3.324 . 0 0 "[ . 1 . 2]" 1
394 1 23 ARG H 1 81 VAL MG1 . . 4.760 4.420 4.060 4.687 . 0 0 "[ . 1 . 2]" 1
395 1 23 ARG HA 1 23 ARG HD2 . . 5.500 4.639 3.807 5.474 . 0 0 "[ . 1 . 2]" 1
396 1 23 ARG HA 1 23 ARG HD3 . . 5.500 4.846 4.056 5.466 . 0 0 "[ . 1 . 2]" 1
397 1 23 ARG HA 1 24 MET H . . 3.870 2.389 2.203 2.493 . 0 0 "[ . 1 . 2]" 1
398 1 23 ARG HA 1 81 VAL HA . . 4.370 4.243 3.549 4.414 0.044 9 0 "[ . 1 . 2]" 1
399 1 23 ARG HA 1 81 VAL MG1 . . 3.620 2.147 1.896 2.498 . 0 0 "[ . 1 . 2]" 1
400 1 23 ARG HA 1 81 VAL MG2 . . 5.150 4.832 4.327 5.190 0.040 18 0 "[ . 1 . 2]" 1
401 1 23 ARG QB 1 23 ARG HD2 . . 3.800 2.797 2.307 3.460 . 0 0 "[ . 1 . 2]" 1
402 1 23 ARG QB 1 23 ARG HD3 . . 3.750 2.744 2.333 3.501 . 0 0 "[ . 1 . 2]" 1
403 1 23 ARG QB 1 23 ARG HE . . 4.480 3.198 1.879 4.280 . 0 0 "[ . 1 . 2]" 1
404 1 23 ARG QB 1 81 VAL MG1 . . 3.900 2.377 1.999 2.809 . 0 0 "[ . 1 . 2]" 1
405 1 23 ARG HD3 1 79 TRP HE1 . . 4.900 4.520 3.568 5.013 0.113 18 0 "[ . 1 . 2]" 1
406 1 24 MET H 1 24 MET HG2 . . 5.420 4.411 3.687 4.640 . 0 0 "[ . 1 . 2]" 1
407 1 24 MET H 1 24 MET HG3 . . 5.140 4.595 3.762 4.776 . 0 0 "[ . 1 . 2]" 1
408 1 24 MET H 1 25 ARG H . . 4.740 4.306 4.229 4.434 . 0 0 "[ . 1 . 2]" 1
409 1 24 MET HA 1 24 MET HG2 . . 4.180 2.828 2.171 3.051 . 0 0 "[ . 1 . 2]" 1
410 1 24 MET HA 1 24 MET HG3 . . 3.810 2.713 2.353 3.614 . 0 0 "[ . 1 . 2]" 1
411 1 24 MET HA 1 25 ARG H . . 3.330 2.173 2.033 2.304 . 0 0 "[ . 1 . 2]" 1
412 1 24 MET HB2 1 25 ARG H . . 4.180 4.178 3.902 4.283 0.103 18 0 "[ . 1 . 2]" 1
413 1 24 MET HB2 1 29 ILE MD . . 4.450 4.071 3.305 4.503 0.053 4 0 "[ . 1 . 2]" 1
414 1 24 MET HB2 1 29 ILE HG13 . . 4.280 4.303 3.884 4.374 0.094 4 0 "[ . 1 . 2]" 1
415 1 24 MET HB3 1 25 ARG H . . 4.800 3.443 2.616 3.734 . 0 0 "[ . 1 . 2]" 1
416 1 24 MET HB3 1 29 ILE H . . 4.440 4.433 3.726 4.603 0.163 7 0 "[ . 1 . 2]" 1
417 1 24 MET HB3 1 29 ILE MD . . 4.160 2.872 2.197 3.724 . 0 0 "[ . 1 . 2]" 1
418 1 24 MET ME 1 24 MET HG2 . . 3.940 2.544 2.288 2.586 . 0 0 "[ . 1 . 2]" 1
419 1 24 MET ME 1 24 MET HG3 . . 3.830 2.406 2.333 2.544 . 0 0 "[ . 1 . 2]" 1
420 1 24 MET ME 1 25 ARG H . . 4.340 4.309 3.697 4.438 0.098 5 0 "[ . 1 . 2]" 1
421 1 24 MET ME 1 32 TRP H . . 4.580 3.736 3.292 4.600 0.020 5 0 "[ . 1 . 2]" 1
422 1 24 MET ME 1 32 TRP HA . . 4.860 4.214 3.951 4.508 . 0 0 "[ . 1 . 2]" 1
423 1 24 MET ME 1 32 TRP HB3 . . 4.300 3.459 3.052 4.321 0.021 5 0 "[ . 1 . 2]" 1
424 1 24 MET ME 1 32 TRP HD1 . . 3.330 3.102 2.613 3.344 0.014 3 0 "[ . 1 . 2]" 1
425 1 24 MET HG2 1 25 ARG H . . 4.540 3.032 2.437 4.331 . 0 0 "[ . 1 . 2]" 1
426 1 24 MET HG3 1 25 ARG H . . 5.230 3.454 2.934 4.686 . 0 0 "[ . 1 . 2]" 1
427 1 25 ARG H 1 25 ARG HB3 . . 3.840 3.570 2.401 3.738 . 0 0 "[ . 1 . 2]" 1
428 1 25 ARG H 1 25 ARG QG . . 3.880 2.669 2.007 3.917 0.037 14 0 "[ . 1 . 2]" 1
429 1 25 ARG H 1 28 GLU H . . 4.500 3.917 3.533 4.254 . 0 0 "[ . 1 . 2]" 1
430 1 25 ARG H 1 28 GLU HB2 . . 3.950 2.583 1.876 2.932 . 0 0 "[ . 1 . 2]" 1
431 1 25 ARG H 1 28 GLU HB3 . . 4.650 3.851 1.843 4.331 . 0 0 "[ . 1 . 2]" 1
432 1 25 ARG H 1 28 GLU HG2 . . 5.230 4.319 3.052 5.250 0.020 2 0 "[ . 1 . 2]" 1
433 1 25 ARG H 1 29 ILE MD . . 5.100 5.017 4.576 5.143 0.043 15 0 "[ . 1 . 2]" 1
434 1 25 ARG HA 1 25 ARG HD2 . . 3.930 3.696 2.250 4.233 0.303 18 0 "[ . 1 . 2]" 1
435 1 25 ARG HA 1 25 ARG HD3 . . 4.420 4.118 2.358 4.584 0.164 1 0 "[ . 1 . 2]" 1
436 1 25 ARG HA 1 26 LEU H . . 3.470 2.219 2.054 2.327 . 0 0 "[ . 1 . 2]" 1
437 1 25 ARG HA 1 27 ASN H . . 4.430 4.189 3.829 4.436 0.006 20 0 "[ . 1 . 2]" 1
438 1 25 ARG HB2 1 25 ARG HD2 . . 4.280 3.059 2.213 3.766 . 0 0 "[ . 1 . 2]" 1
439 1 25 ARG HB2 1 25 ARG HD3 . . 4.260 3.476 2.457 4.237 . 0 0 "[ . 1 . 2]" 1
440 1 25 ARG HB2 1 26 LEU H . . 3.790 3.816 3.581 3.883 0.093 14 0 "[ . 1 . 2]" 1
441 1 25 ARG HB2 1 27 ASN H . . 4.410 3.628 2.976 4.426 0.016 14 0 "[ . 1 . 2]" 1
442 1 25 ARG HB2 1 28 GLU H . . 4.810 2.584 1.818 4.136 . 0 0 "[ . 1 . 2]" 1
443 1 25 ARG HB3 1 25 ARG HD2 . . 4.050 2.648 2.244 3.819 . 0 0 "[ . 1 . 2]" 1
444 1 25 ARG HB3 1 26 LEU H . . 4.770 2.816 2.560 3.810 . 0 0 "[ . 1 . 2]" 1
445 1 25 ARG HB3 1 27 ASN H . . 3.430 2.905 2.252 3.496 0.066 14 0 "[ . 1 . 2]" 1
446 1 25 ARG HB3 1 28 GLU H . . 4.380 3.209 2.456 3.559 . 0 0 "[ . 1 . 2]" 1
447 1 25 ARG QG 1 26 LEU H . . 4.740 3.896 2.383 4.699 . 0 0 "[ . 1 . 2]" 1
448 1 26 LEU H 1 26 LEU QB . . 3.050 2.154 2.071 2.207 . 0 0 "[ . 1 . 2]" 1
449 1 26 LEU H 1 26 LEU MD1 . . 4.640 4.148 4.069 4.293 . 0 0 "[ . 1 . 2]" 1
450 1 26 LEU H 1 26 LEU MD2 . . 4.560 4.040 3.700 4.112 . 0 0 "[ . 1 . 2]" 1
451 1 26 LEU H 1 26 LEU HG . . 4.590 4.478 4.346 4.594 0.004 20 0 "[ . 1 . 2]" 1
452 1 26 LEU H 1 27 ASN H . . 3.900 2.746 2.577 2.915 . 0 0 "[ . 1 . 2]" 1
453 1 26 LEU H 1 80 TRP HD1 . . 4.110 4.096 3.873 4.257 0.147 15 0 "[ . 1 . 2]" 1
454 1 26 LEU HA 1 26 LEU MD1 . . 4.120 2.259 2.096 2.709 . 0 0 "[ . 1 . 2]" 1
455 1 26 LEU HA 1 26 LEU MD2 . . 3.670 3.595 2.373 3.772 0.102 5 0 "[ . 1 . 2]" 1
456 1 26 LEU HA 1 26 LEU HG . . 4.410 3.545 3.416 3.946 . 0 0 "[ . 1 . 2]" 1
457 1 26 LEU HA 1 27 ASN H . . 4.560 3.508 3.425 3.574 . 0 0 "[ . 1 . 2]" 1
458 1 26 LEU HA 1 29 ILE H . . 4.180 3.446 3.229 3.920 . 0 0 "[ . 1 . 2]" 1
459 1 26 LEU HA 1 29 ILE HB . . 4.220 2.939 2.503 3.619 . 0 0 "[ . 1 . 2]" 1
460 1 26 LEU HA 1 29 ILE MD . . 3.220 2.085 1.892 2.370 . 0 0 "[ . 1 . 2]" 1
461 1 26 LEU HA 1 80 TRP HD1 . . 4.150 3.656 3.089 4.105 . 0 0 "[ . 1 . 2]" 1
462 1 26 LEU QB 1 26 LEU MD1 . . 3.270 2.418 2.278 2.541 . 0 0 "[ . 1 . 2]" 1
463 1 26 LEU QB 1 80 TRP HD1 . . 3.840 2.493 2.247 3.550 . 0 0 "[ . 1 . 2]" 1
464 1 26 LEU QB 1 80 TRP HE1 . . 4.280 3.692 3.079 4.415 0.135 20 0 "[ . 1 . 2]" 1
465 1 26 LEU MD1 1 30 TYR H . . 4.200 4.053 3.640 4.242 0.042 20 0 "[ . 1 . 2]" 1
466 1 26 LEU MD1 1 30 TYR QD . . 3.920 3.908 3.419 4.041 0.121 6 0 "[ . 1 . 2]" 1
467 1 26 LEU MD1 1 30 TYR QE . . 3.850 2.953 1.953 3.271 . 0 0 "[ . 1 . 2]" 1
468 1 26 LEU MD1 1 57 ARG QD . . 4.000 3.398 2.339 4.130 0.130 6 0 "[ . 1 . 2]" 1
469 1 26 LEU MD1 1 57 ARG HG3 . . 4.560 4.413 3.513 4.701 0.141 12 0 "[ . 1 . 2]" 1
470 1 26 LEU MD1 1 60 LEU MD1 . . 4.020 2.109 1.718 2.729 . 0 0 "[ . 1 . 2]" 1
471 1 26 LEU MD1 1 80 TRP HD1 . . 4.410 3.159 2.608 4.469 0.059 8 0 "[ . 1 . 2]" 1
472 1 26 LEU MD1 1 80 TRP HE1 . . 5.070 2.513 1.738 4.631 . 0 0 "[ . 1 . 2]" 1
473 1 26 LEU MD2 1 30 TYR QE . . 4.490 3.888 3.537 4.551 0.061 8 0 "[ . 1 . 2]" 1
474 1 26 LEU MD2 1 57 ARG QD . . 4.580 2.787 1.878 3.819 . 0 0 "[ . 1 . 2]" 1
475 1 26 LEU MD2 1 57 ARG HG3 . . 4.300 4.013 3.001 4.388 0.088 7 0 "[ . 1 . 2]" 1
476 1 26 LEU MD2 1 60 LEU MD1 . . 3.540 2.797 1.830 3.431 . 0 0 "[ . 1 . 2]" 1
477 1 26 LEU MD2 1 80 TRP QB . . 4.110 4.231 3.910 4.332 0.222 17 0 "[ . 1 . 2]" 1
478 1 26 LEU MD2 1 80 TRP HE1 . . 4.850 3.542 2.176 4.157 . 0 0 "[ . 1 . 2]" 1
479 1 26 LEU HG 1 27 ASN H . . 4.830 4.017 3.601 4.735 . 0 0 "[ . 1 . 2]" 1
480 1 26 LEU HG 1 30 TYR QE . . 3.950 2.801 2.268 4.105 0.155 20 0 "[ . 1 . 2]" 1
481 1 27 ASN H 1 27 ASN QB . . 3.200 2.514 2.362 2.691 . 0 0 "[ . 1 . 2]" 1
482 1 27 ASN H 1 27 ASN HD22 . . 4.910 4.412 3.260 4.926 0.016 17 0 "[ . 1 . 2]" 1
483 1 27 ASN H 1 28 GLU H . . 3.910 2.603 2.517 2.687 . 0 0 "[ . 1 . 2]" 1
484 1 27 ASN H 1 29 ILE H . . 5.070 4.187 3.998 4.301 . 0 0 "[ . 1 . 2]" 1
485 1 27 ASN HA 1 28 GLU H . . 4.500 3.494 3.450 3.565 . 0 0 "[ . 1 . 2]" 1
486 1 27 ASN HA 1 29 ILE H . . 5.130 4.383 4.012 4.561 . 0 0 "[ . 1 . 2]" 1
487 1 27 ASN HA 1 30 TYR H . . 4.260 3.409 3.147 3.609 . 0 0 "[ . 1 . 2]" 1
488 1 27 ASN HA 1 30 TYR HB2 . . 4.030 3.025 2.886 3.099 . 0 0 "[ . 1 . 2]" 1
489 1 27 ASN HA 1 30 TYR HB3 . . 4.520 4.563 4.445 4.628 0.108 7 0 "[ . 1 . 2]" 1
490 1 27 ASN HA 1 30 TYR QD . . 3.240 1.904 1.752 2.047 . 0 0 "[ . 1 . 2]" 1
491 1 27 ASN HA 1 30 TYR QE . . 4.130 3.350 3.074 3.669 . 0 0 "[ . 1 . 2]" 1
492 1 27 ASN QB 1 28 GLU H . . 4.140 2.964 2.544 3.672 . 0 0 "[ . 1 . 2]" 1
493 1 27 ASN QB 1 30 TYR QD . . 4.090 3.598 3.000 3.957 . 0 0 "[ . 1 . 2]" 1
494 1 28 GLU H 1 28 GLU HB2 . . 3.720 2.462 2.378 2.520 . 0 0 "[ . 1 . 2]" 1
495 1 28 GLU H 1 28 GLU HB3 . . 4.120 3.548 2.249 3.648 . 0 0 "[ . 1 . 2]" 1
496 1 28 GLU H 1 28 GLU HG2 . . 4.110 3.235 2.288 4.147 0.037 20 0 "[ . 1 . 2]" 1
497 1 28 GLU H 1 28 GLU HG3 . . 3.840 2.883 2.209 4.064 0.224 20 0 "[ . 1 . 2]" 1
498 1 28 GLU H 1 29 ILE H . . 3.350 2.560 2.474 2.639 . 0 0 "[ . 1 . 2]" 1
499 1 28 GLU H 1 30 TYR H . . 4.490 4.111 3.986 4.246 . 0 0 "[ . 1 . 2]" 1
500 1 28 GLU HA 1 28 GLU HG2 . . 3.500 2.668 2.399 3.127 . 0 0 "[ . 1 . 2]" 1
501 1 28 GLU HA 1 28 GLU HG3 . . 3.680 3.195 2.298 3.691 0.011 11 0 "[ . 1 . 2]" 1
502 1 28 GLU HA 1 29 ILE H . . 4.100 3.508 3.461 3.547 . 0 0 "[ . 1 . 2]" 1
503 1 28 GLU HA 1 31 ASN H . . 3.970 3.029 2.794 3.275 . 0 0 "[ . 1 . 2]" 1
504 1 28 GLU HA 1 31 ASN QB . . 3.230 2.269 1.922 2.485 . 0 0 "[ . 1 . 2]" 1
505 1 28 GLU HA 1 31 ASN HD22 . . 4.770 3.519 2.762 4.804 0.034 14 0 "[ . 1 . 2]" 1
506 1 28 GLU HA 1 32 TRP H . . 4.950 4.009 3.700 4.292 . 0 0 "[ . 1 . 2]" 1
507 1 28 GLU HB2 1 29 ILE H . . 3.980 2.801 2.541 3.993 0.013 20 0 "[ . 1 . 2]" 1
508 1 28 GLU HB3 1 28 GLU HG3 . . 3.040 2.827 2.421 3.019 . 0 0 "[ . 1 . 2]" 1
509 1 28 GLU HB3 1 29 ILE H . . 4.300 3.642 2.781 3.841 . 0 0 "[ . 1 . 2]" 1
510 1 28 GLU HG2 1 29 ILE H . . 5.430 4.773 3.751 5.175 . 0 0 "[ . 1 . 2]" 1
511 1 28 GLU HG3 1 29 ILE H . . 5.260 4.594 4.162 5.210 . 0 0 "[ . 1 . 2]" 1
512 1 29 ILE H 1 29 ILE HB . . 3.340 2.441 2.400 2.515 . 0 0 "[ . 1 . 2]" 1
513 1 29 ILE H 1 29 ILE MD . . 3.880 3.467 3.377 3.587 . 0 0 "[ . 1 . 2]" 1
514 1 29 ILE H 1 29 ILE HG12 . . 3.790 3.383 3.340 3.486 . 0 0 "[ . 1 . 2]" 1
515 1 29 ILE H 1 29 ILE HG13 . . 3.300 2.094 2.013 2.206 . 0 0 "[ . 1 . 2]" 1
516 1 29 ILE H 1 29 ILE MG . . 4.270 3.778 3.757 3.811 . 0 0 "[ . 1 . 2]" 1
517 1 29 ILE H 1 30 TYR H . . 3.370 2.813 2.674 2.936 . 0 0 "[ . 1 . 2]" 1
518 1 29 ILE HA 1 29 ILE MD . . 4.150 3.774 3.732 3.837 . 0 0 "[ . 1 . 2]" 1
519 1 29 ILE HA 1 29 ILE HG12 . . 3.590 2.471 2.399 2.537 . 0 0 "[ . 1 . 2]" 1
520 1 29 ILE HA 1 29 ILE HG13 . . 3.840 2.889 2.836 3.002 . 0 0 "[ . 1 . 2]" 1
521 1 29 ILE HA 1 29 ILE MG . . 3.200 2.564 2.485 2.617 . 0 0 "[ . 1 . 2]" 1
522 1 29 ILE HA 1 30 TYR H . . 4.490 3.532 3.503 3.556 . 0 0 "[ . 1 . 2]" 1
523 1 29 ILE HA 1 31 ASN H . . 5.170 4.403 4.215 4.489 . 0 0 "[ . 1 . 2]" 1
524 1 29 ILE HA 1 32 TRP H . . 3.880 3.406 3.248 3.519 . 0 0 "[ . 1 . 2]" 1
525 1 29 ILE HA 1 32 TRP HB2 . . 3.730 3.188 2.850 3.426 . 0 0 "[ . 1 . 2]" 1
526 1 29 ILE HA 1 32 TRP HB3 . . 4.370 2.954 2.747 3.127 . 0 0 "[ . 1 . 2]" 1
527 1 29 ILE HA 1 33 PHE H . . 4.540 4.459 4.180 4.570 0.030 20 0 "[ . 1 . 2]" 1
528 1 29 ILE HB 1 29 ILE MD . . 3.430 2.373 2.341 2.441 . 0 0 "[ . 1 . 2]" 1
529 1 29 ILE HB 1 30 TYR H . . 3.550 2.459 2.381 2.517 . 0 0 "[ . 1 . 2]" 1
530 1 29 ILE MD 1 29 ILE MG . . 2.840 1.947 1.893 2.003 . 0 0 "[ . 1 . 2]" 1
531 1 29 ILE MD 1 30 TYR H . . 4.410 4.441 4.386 4.484 0.074 13 0 "[ . 1 . 2]" 1
532 1 29 ILE MD 1 60 LEU MD1 . . 3.350 3.165 2.331 3.422 0.072 16 0 "[ . 1 . 2]" 1
533 1 29 ILE MD 1 60 LEU MD2 . . 3.650 3.303 1.974 3.726 0.076 9 0 "[ . 1 . 2]" 1
534 1 29 ILE MD 1 80 TRP HD1 . . 3.770 3.555 3.310 3.784 0.014 5 0 "[ . 1 . 2]" 1
535 1 29 ILE HG12 1 29 ILE MG . . 2.620 2.403 2.350 2.458 . 0 0 "[ . 1 . 2]" 1
536 1 29 ILE HG13 1 29 ILE MG . . 3.450 3.247 3.224 3.265 . 0 0 "[ . 1 . 2]" 1
537 1 29 ILE MG 1 30 TYR H . . 4.420 3.192 3.073 3.302 . 0 0 "[ . 1 . 2]" 1
538 1 29 ILE MG 1 33 PHE QD . . 3.710 2.824 2.513 3.015 . 0 0 "[ . 1 . 2]" 1
539 1 29 ILE MG 1 56 ILE MD . . 3.300 2.681 2.547 2.946 . 0 0 "[ . 1 . 2]" 1
540 1 29 ILE MG 1 56 ILE HG12 . . 4.180 4.282 4.228 4.342 0.162 2 0 "[ . 1 . 2]" 1
541 1 29 ILE MG 1 56 ILE MG . . 3.180 2.578 2.239 2.737 . 0 0 "[ . 1 . 2]" 1
542 1 29 ILE MG 1 60 LEU MD1 . . 3.610 3.587 2.585 3.745 0.135 14 0 "[ . 1 . 2]" 1
543 1 30 TYR H 1 30 TYR HB2 . . 3.790 2.547 2.458 2.637 . 0 0 "[ . 1 . 2]" 1
544 1 30 TYR H 1 30 TYR QD . . 3.840 3.193 3.100 3.268 . 0 0 "[ . 1 . 2]" 1
545 1 30 TYR HA 1 30 TYR QD . . 3.220 2.192 2.095 2.339 . 0 0 "[ . 1 . 2]" 1
546 1 30 TYR HA 1 30 TYR QE . . 4.470 4.427 4.358 4.482 0.012 1 0 "[ . 1 . 2]" 1
547 1 30 TYR HA 1 31 ASN H . . 3.400 3.461 3.439 3.475 0.075 3 0 "[ . 1 . 2]" 1
548 1 30 TYR HA 1 32 TRP H . . 4.720 4.251 4.104 4.373 . 0 0 "[ . 1 . 2]" 1
549 1 30 TYR HA 1 33 PHE H . . 4.080 3.586 3.478 3.697 . 0 0 "[ . 1 . 2]" 1
550 1 30 TYR HA 1 33 PHE HB2 . . 4.820 3.177 3.013 3.346 . 0 0 "[ . 1 . 2]" 1
551 1 30 TYR HA 1 52 TRP HH2 . . 4.030 2.691 2.411 3.073 . 0 0 "[ . 1 . 2]" 1
552 1 30 TYR HA 1 56 ILE MD . . 4.310 3.275 3.162 3.388 . 0 0 "[ . 1 . 2]" 1
553 1 30 TYR HB2 1 30 TYR QD . . 3.380 2.269 2.209 2.299 . 0 0 "[ . 1 . 2]" 1
554 1 30 TYR HB2 1 31 ASN H . . 3.600 2.538 2.392 2.787 . 0 0 "[ . 1 . 2]" 1
555 1 30 TYR HB3 1 30 TYR QD . . 3.490 2.748 2.695 2.783 . 0 0 "[ . 1 . 2]" 1
556 1 30 TYR HB3 1 31 ASN H . . 4.270 3.593 3.482 3.829 . 0 0 "[ . 1 . 2]" 1
557 1 30 TYR HB3 1 52 TRP HH2 . . 4.250 2.950 2.549 3.391 . 0 0 "[ . 1 . 2]" 1
558 1 30 TYR QD 1 31 ASN H . . 4.330 4.267 4.153 4.342 0.012 2 0 "[ . 1 . 2]" 1
559 1 30 TYR QD 1 53 LYS HA . . 4.660 3.314 2.829 3.570 . 0 0 "[ . 1 . 2]" 1
560 1 30 TYR QD 1 53 LYS HB3 . . 4.610 4.271 3.943 4.879 0.269 7 0 "[ . 1 . 2]" 1
561 1 30 TYR QD 1 53 LYS HE2 . . 3.760 3.031 2.808 3.238 . 0 0 "[ . 1 . 2]" 1
562 1 30 TYR QD 1 53 LYS HG3 . . 4.290 4.067 2.826 4.296 0.006 4 0 "[ . 1 . 2]" 1
563 1 30 TYR QD 1 56 ILE HB . . 4.150 3.851 3.517 3.981 . 0 0 "[ . 1 . 2]" 1
564 1 30 TYR QD 1 56 ILE MD . . 3.090 2.129 1.974 2.343 . 0 0 "[ . 1 . 2]" 1
565 1 30 TYR QD 1 56 ILE MG . . 3.450 3.437 3.183 3.512 0.062 8 0 "[ . 1 . 2]" 1
566 1 30 TYR QE 1 53 LYS HA . . 3.600 2.353 2.145 2.557 . 0 0 "[ . 1 . 2]" 1
567 1 30 TYR QE 1 53 LYS HB2 . . 5.190 4.446 4.225 4.608 . 0 0 "[ . 1 . 2]" 1
568 1 30 TYR QE 1 53 LYS HB3 . . 5.470 3.245 2.923 4.713 . 0 0 "[ . 1 . 2]" 1
569 1 30 TYR QE 1 53 LYS QD . . 4.830 3.272 3.041 3.775 . 0 0 "[ . 1 . 2]" 1
570 1 30 TYR QE 1 53 LYS HG2 . . 4.560 3.087 2.949 3.422 . 0 0 "[ . 1 . 2]" 1
571 1 30 TYR QE 1 53 LYS HG3 . . 4.330 4.317 2.735 4.450 0.120 6 0 "[ . 1 . 2]" 1
572 1 30 TYR QE 1 56 ILE H . . 4.500 4.146 3.833 4.453 . 0 0 "[ . 1 . 2]" 1
573 1 30 TYR QE 1 56 ILE HB . . 3.270 2.058 1.831 2.361 . 0 0 "[ . 1 . 2]" 1
574 1 30 TYR QE 1 56 ILE MD . . 3.590 2.435 2.179 2.774 . 0 0 "[ . 1 . 2]" 1
575 1 30 TYR QE 1 56 ILE HG13 . . 5.240 4.020 3.764 4.264 . 0 0 "[ . 1 . 2]" 1
576 1 30 TYR QE 1 56 ILE MG . . 3.120 2.526 2.347 2.784 . 0 0 "[ . 1 . 2]" 1
577 1 30 TYR QE 1 57 ARG H . . 4.300 3.745 3.209 4.277 . 0 0 "[ . 1 . 2]" 1
578 1 31 ASN H 1 31 ASN QB . . 3.070 2.468 2.163 2.577 . 0 0 "[ . 1 . 2]" 1
579 1 31 ASN H 1 31 ASN HD21 . . 4.330 3.789 2.388 4.437 0.107 3 0 "[ . 1 . 2]" 1
580 1 31 ASN H 1 32 TRP H . . 3.620 2.668 2.521 2.769 . 0 0 "[ . 1 . 2]" 1
581 1 31 ASN H 1 33 PHE H . . 4.480 4.384 4.310 4.481 0.001 4 0 "[ . 1 . 2]" 1
582 1 31 ASN H 1 34 ALA MB . . 5.100 4.685 4.499 4.921 . 0 0 "[ . 1 . 2]" 1
583 1 31 ASN HA 1 34 ALA H . . 4.020 3.421 3.294 3.546 . 0 0 "[ . 1 . 2]" 1
584 1 31 ASN HA 1 34 ALA MB . . 3.430 2.516 2.319 2.791 . 0 0 "[ . 1 . 2]" 1
585 1 31 ASN HA 1 35 SER H . . 4.640 3.986 3.798 4.216 . 0 0 "[ . 1 . 2]" 1
586 1 31 ASN QB 1 31 ASN HD22 . . 3.810 3.232 3.171 3.477 . 0 0 "[ . 1 . 2]" 1
587 1 31 ASN QB 1 32 TRP H . . 3.460 2.714 2.558 2.813 . 0 0 "[ . 1 . 2]" 1
588 1 31 ASN QB 1 34 ALA H . . 4.930 4.896 4.770 4.980 0.050 16 0 "[ . 1 . 2]" 1
589 1 31 ASN QB 1 34 ALA MB . . 4.840 4.010 3.780 4.212 . 0 0 "[ . 1 . 2]" 1
590 1 32 TRP H 1 32 TRP HB2 . . 3.440 2.524 2.494 2.573 . 0 0 "[ . 1 . 2]" 1
591 1 32 TRP H 1 32 TRP HB3 . . 3.410 2.544 2.509 2.577 . 0 0 "[ . 1 . 2]" 1
592 1 32 TRP H 1 32 TRP HE3 . . 5.080 4.703 4.614 4.765 . 0 0 "[ . 1 . 2]" 1
593 1 32 TRP H 1 33 PHE H . . 3.440 2.765 2.723 2.829 . 0 0 "[ . 1 . 2]" 1
594 1 32 TRP HA 1 32 TRP HD1 . . 3.830 3.303 3.177 3.386 . 0 0 "[ . 1 . 2]" 1
595 1 32 TRP HA 1 32 TRP HE3 . . 4.400 4.415 4.372 4.440 0.040 4 0 "[ . 1 . 2]" 1
596 1 32 TRP HA 1 33 PHE H . . 4.490 3.542 3.521 3.558 . 0 0 "[ . 1 . 2]" 1
597 1 32 TRP HA 1 35 SER H . . 4.220 3.626 3.437 3.788 . 0 0 "[ . 1 . 2]" 1
598 1 32 TRP HA 1 35 SER QB . . 3.530 2.918 2.584 3.220 . 0 0 "[ . 1 . 2]" 1
599 1 32 TRP HA 1 36 ASN HD21 . . 3.880 2.863 2.493 3.550 . 0 0 "[ . 1 . 2]" 1
600 1 32 TRP HA 1 36 ASN HD22 . . 4.060 3.489 3.113 4.067 0.007 8 0 "[ . 1 . 2]" 1
601 1 32 TRP HB2 1 32 TRP HD1 . . 4.000 2.650 2.610 2.688 . 0 0 "[ . 1 . 2]" 1
602 1 32 TRP HB2 1 33 PHE H . . 4.230 3.748 3.687 3.802 . 0 0 "[ . 1 . 2]" 1
603 1 32 TRP HB3 1 33 PHE H . . 4.220 2.376 2.302 2.433 . 0 0 "[ . 1 . 2]" 1
604 1 32 TRP HD1 1 36 ASN HD21 . . 4.690 3.886 3.680 4.388 . 0 0 "[ . 1 . 2]" 1
605 1 32 TRP HD1 1 36 ASN HD22 . . 4.330 3.369 3.154 3.751 . 0 0 "[ . 1 . 2]" 1
606 1 32 TRP HE1 1 36 ASN HB2 . . 4.830 4.845 4.605 4.922 0.092 1 0 "[ . 1 . 2]" 1
607 1 32 TRP HE1 1 36 ASN HD21 . . 4.360 4.215 3.911 4.497 0.137 4 0 "[ . 1 . 2]" 1
608 1 32 TRP HE1 1 36 ASN HD22 . . 3.990 3.570 3.290 3.997 0.007 18 0 "[ . 1 . 2]" 1
609 1 32 TRP HE3 1 33 PHE H . . 3.980 2.657 2.596 2.722 . 0 0 "[ . 1 . 2]" 1
610 1 32 TRP HE3 1 34 ALA H . . 4.790 4.846 4.821 4.872 0.082 20 0 "[ . 1 . 2]" 1
611 1 32 TRP HE3 1 37 VAL MG2 . . 4.300 4.062 3.898 4.301 0.001 4 0 "[ . 1 . 2]" 1
612 1 32 TRP HH2 1 37 VAL MG2 . . 4.060 4.020 3.837 4.127 0.067 13 0 "[ . 1 . 2]" 1
613 1 32 TRP HZ2 1 36 ASN HB2 . . 5.300 4.346 4.055 4.627 . 0 0 "[ . 1 . 2]" 1
614 1 32 TRP HZ2 1 36 ASN HB3 . . 4.830 4.424 4.200 4.761 . 0 0 "[ . 1 . 2]" 1
615 1 33 PHE H 1 33 PHE HB2 . . 3.520 2.444 2.379 2.501 . 0 0 "[ . 1 . 2]" 1
616 1 33 PHE H 1 33 PHE HB3 . . 4.170 3.620 3.599 3.646 . 0 0 "[ . 1 . 2]" 1
617 1 33 PHE H 1 33 PHE QD . . 3.290 2.267 2.098 2.517 . 0 0 "[ . 1 . 2]" 1
618 1 33 PHE H 1 34 ALA H . . 3.440 2.683 2.621 2.750 . 0 0 "[ . 1 . 2]" 1
619 1 33 PHE H 1 37 VAL MG2 . . 5.090 5.081 4.962 5.127 0.037 11 0 "[ . 1 . 2]" 1
620 1 33 PHE H 1 52 TRP HH2 . . 4.540 4.038 3.646 4.428 . 0 0 "[ . 1 . 2]" 1
621 1 33 PHE HA 1 33 PHE QD . . 4.010 3.008 2.778 3.107 . 0 0 "[ . 1 . 2]" 1
622 1 33 PHE HA 1 34 ALA H . . 4.920 3.468 3.446 3.486 . 0 0 "[ . 1 . 2]" 1
623 1 33 PHE HA 1 36 ASN H . . 3.370 3.438 3.407 3.462 0.092 13 0 "[ . 1 . 2]" 1
624 1 33 PHE HA 1 36 ASN HB2 . . 5.000 3.436 3.278 3.595 . 0 0 "[ . 1 . 2]" 1
625 1 33 PHE HA 1 36 ASN HB3 . . 5.200 5.014 4.823 5.197 . 0 0 "[ . 1 . 2]" 1
626 1 33 PHE HA 1 37 VAL H . . 4.140 3.415 3.310 3.602 . 0 0 "[ . 1 . 2]" 1
627 1 33 PHE HA 1 37 VAL HB . . 4.920 3.556 3.419 3.721 . 0 0 "[ . 1 . 2]" 1
628 1 33 PHE HA 1 37 VAL MG2 . . 3.650 2.626 2.495 2.689 . 0 0 "[ . 1 . 2]" 1
629 1 33 PHE HB2 1 34 ALA H . . 4.210 2.605 2.519 2.706 . 0 0 "[ . 1 . 2]" 1
630 1 33 PHE HB2 1 52 TRP HH2 . . 4.570 2.401 2.125 2.648 . 0 0 "[ . 1 . 2]" 1
631 1 33 PHE HB2 1 56 ILE MD . . 4.700 3.815 3.536 4.049 . 0 0 "[ . 1 . 2]" 1
632 1 33 PHE HB3 1 34 ALA H . . 3.750 3.454 3.381 3.599 . 0 0 "[ . 1 . 2]" 1
633 1 33 PHE QD 1 37 VAL MG2 . . 4.570 2.739 2.373 3.003 . 0 0 "[ . 1 . 2]" 1
634 1 33 PHE QD 1 52 TRP HH2 . . 3.910 3.891 3.502 3.980 0.070 13 0 "[ . 1 . 2]" 1
635 1 33 PHE QD 1 56 ILE MD . . 3.650 3.084 2.838 3.279 . 0 0 "[ . 1 . 2]" 1
636 1 34 ALA H 1 34 ALA MB . . 2.810 2.255 2.221 2.275 . 0 0 "[ . 1 . 2]" 1
637 1 34 ALA H 1 35 SER H . . 3.180 2.644 2.547 2.759 . 0 0 "[ . 1 . 2]" 1
638 1 34 ALA H 1 36 ASN H . . 4.420 4.174 4.058 4.268 . 0 0 "[ . 1 . 2]" 1
639 1 34 ALA H 1 52 TRP HH2 . . 4.190 3.055 2.920 3.280 . 0 0 "[ . 1 . 2]" 1
640 1 34 ALA HA 1 35 SER H . . 4.690 3.474 3.436 3.524 . 0 0 "[ . 1 . 2]" 1
641 1 34 ALA HA 1 40 PHE H . . 3.940 3.972 3.917 4.016 0.076 2 0 "[ . 1 . 2]" 1
642 1 34 ALA HA 1 40 PHE HB2 . . 3.750 2.070 1.944 2.153 . 0 0 "[ . 1 . 2]" 1
643 1 34 ALA HA 1 40 PHE HB3 . . 3.540 2.414 2.221 2.591 . 0 0 "[ . 1 . 2]" 1
644 1 34 ALA HA 1 40 PHE QD . . 3.990 3.887 3.449 4.022 0.032 14 0 "[ . 1 . 2]" 1
645 1 34 ALA HA 1 41 GLY H . . 3.720 3.087 2.923 3.237 . 0 0 "[ . 1 . 2]" 1
646 1 34 ALA HA 1 41 GLY QA . . 3.590 3.081 2.944 3.295 . 0 0 "[ . 1 . 2]" 1
647 1 34 ALA MB 1 35 SER H . . 3.320 2.559 2.429 2.687 . 0 0 "[ . 1 . 2]" 1
648 1 34 ALA MB 1 40 PHE HB2 . . 5.180 3.616 3.552 3.707 . 0 0 "[ . 1 . 2]" 1
649 1 34 ALA MB 1 41 GLY H . . 4.380 4.136 4.007 4.223 . 0 0 "[ . 1 . 2]" 1
650 1 34 ALA MB 1 41 GLY QA . . 3.520 2.618 2.423 2.741 . 0 0 "[ . 1 . 2]" 1
651 1 34 ALA MB 1 52 TRP HZ2 . . 4.140 2.909 2.690 3.163 . 0 0 "[ . 1 . 2]" 1
652 1 35 SER H 1 35 SER QB . . 2.940 2.410 2.241 2.497 . 0 0 "[ . 1 . 2]" 1
653 1 35 SER H 1 36 ASN H . . 3.260 2.597 2.551 2.657 . 0 0 "[ . 1 . 2]" 1
654 1 35 SER H 1 37 VAL H . . 4.330 3.974 3.887 4.058 . 0 0 "[ . 1 . 2]" 1
655 1 35 SER H 1 41 GLY QA . . 4.910 4.971 4.917 5.004 0.094 20 0 "[ . 1 . 2]" 1
656 1 35 SER HA 1 36 ASN H . . 4.090 3.586 3.557 3.626 . 0 0 "[ . 1 . 2]" 1
657 1 35 SER QB 1 36 ASN H . . 4.170 2.721 2.595 2.939 . 0 0 "[ . 1 . 2]" 1
658 1 36 ASN H 1 36 ASN HB2 . . 3.340 2.517 2.440 2.587 . 0 0 "[ . 1 . 2]" 1
659 1 36 ASN H 1 36 ASN HB3 . . 3.720 3.699 3.655 3.736 0.016 18 0 "[ . 1 . 2]" 1
660 1 36 ASN H 1 36 ASN HD21 . . 3.680 2.447 2.116 2.638 . 0 0 "[ . 1 . 2]" 1
661 1 36 ASN H 1 36 ASN HD22 . . 4.150 3.910 3.812 4.049 . 0 0 "[ . 1 . 2]" 1
662 1 36 ASN H 1 37 VAL H . . 3.060 2.334 2.219 2.420 . 0 0 "[ . 1 . 2]" 1
663 1 36 ASN HA 1 36 ASN HD21 . . 4.460 3.589 2.817 3.833 . 0 0 "[ . 1 . 2]" 1
664 1 36 ASN HA 1 36 ASN HD22 . . 4.660 4.182 3.847 4.332 . 0 0 "[ . 1 . 2]" 1
665 1 36 ASN HA 1 37 VAL H . . 4.320 3.421 3.342 3.479 . 0 0 "[ . 1 . 2]" 1
666 1 36 ASN HB2 1 36 ASN HD22 . . 4.000 3.514 3.409 3.745 . 0 0 "[ . 1 . 2]" 1
667 1 36 ASN HB2 1 37 VAL H . . 4.700 3.295 3.175 3.505 . 0 0 "[ . 1 . 2]" 1
668 1 36 ASN HB3 1 37 VAL H . . 4.490 4.018 3.930 4.193 . 0 0 "[ . 1 . 2]" 1
669 1 37 VAL H 1 37 VAL HB . . 3.540 2.585 2.503 2.685 . 0 0 "[ . 1 . 2]" 1
670 1 37 VAL H 1 37 VAL MG1 . . 4.180 3.832 3.798 3.876 . 0 0 "[ . 1 . 2]" 1
671 1 37 VAL H 1 37 VAL MG2 . . 3.470 2.603 2.513 2.775 . 0 0 "[ . 1 . 2]" 1
672 1 37 VAL H 1 38 PRO HD3 . . 4.520 4.423 4.220 4.570 0.050 20 0 "[ . 1 . 2]" 1
673 1 37 VAL H 1 40 PHE H . . 5.060 4.605 4.497 4.698 . 0 0 "[ . 1 . 2]" 1
674 1 37 VAL HA 1 37 VAL MG1 . . 3.750 2.409 2.398 2.424 . 0 0 "[ . 1 . 2]" 1
675 1 37 VAL HA 1 37 VAL MG2 . . 3.370 2.423 2.389 2.460 . 0 0 "[ . 1 . 2]" 1
676 1 37 VAL HA 1 38 PRO HD2 . . 3.670 2.090 1.998 2.205 . 0 0 "[ . 1 . 2]" 1
677 1 37 VAL HA 1 38 PRO HD3 . . 3.480 2.235 2.157 2.290 . 0 0 "[ . 1 . 2]" 1
678 1 37 VAL HB 1 40 PHE H . . 4.350 2.974 2.864 3.100 . 0 0 "[ . 1 . 2]" 1
679 1 37 VAL HB 1 40 PHE HB3 . . 4.370 4.361 4.213 4.428 0.058 3 0 "[ . 1 . 2]" 1
680 1 37 VAL HB 1 40 PHE QD . . 3.440 1.894 1.821 1.986 . 0 0 "[ . 1 . 2]" 1
681 1 37 VAL HB 1 40 PHE QE . . 3.980 3.629 3.383 3.842 . 0 0 "[ . 1 . 2]" 1
682 1 37 VAL MG1 1 37 VAL MG2 . . 2.810 2.091 2.080 2.113 . 0 0 "[ . 1 . 2]" 1
683 1 37 VAL MG1 1 38 PRO HD2 . . 4.070 2.413 2.226 2.682 . 0 0 "[ . 1 . 2]" 1
684 1 37 VAL MG1 1 38 PRO HD3 . . 4.220 3.647 3.525 3.803 . 0 0 "[ . 1 . 2]" 1
685 1 37 VAL MG1 1 39 TYR H . . 3.420 2.033 1.901 2.188 . 0 0 "[ . 1 . 2]" 1
686 1 37 VAL MG1 1 40 PHE H . . 3.850 2.369 2.269 2.466 . 0 0 "[ . 1 . 2]" 1
687 1 37 VAL MG1 1 40 PHE QD . . 3.650 2.749 2.563 3.109 . 0 0 "[ . 1 . 2]" 1
688 1 37 VAL MG1 1 40 PHE QE . . 3.880 2.830 2.603 3.158 . 0 0 "[ . 1 . 2]" 1
689 1 37 VAL MG1 1 41 GLY H . . 4.810 4.145 3.994 4.283 . 0 0 "[ . 1 . 2]" 1
690 1 37 VAL MG2 1 38 PRO HD3 . . 4.230 4.268 4.232 4.297 0.067 13 0 "[ . 1 . 2]" 1
691 1 37 VAL MG2 1 40 PHE QD . . 3.340 2.754 2.626 2.997 . 0 0 "[ . 1 . 2]" 1
692 1 37 VAL MG2 1 40 PHE QE . . 4.520 2.905 2.762 3.029 . 0 0 "[ . 1 . 2]" 1
693 1 38 PRO HA 1 38 PRO HD2 . . 4.170 4.032 3.979 4.080 . 0 0 "[ . 1 . 2]" 1
694 1 38 PRO HA 1 38 PRO HD3 . . 4.310 3.527 3.462 3.602 . 0 0 "[ . 1 . 2]" 1
695 1 38 PRO HA 1 38 PRO HG3 . . 4.020 3.704 3.255 3.996 . 0 0 "[ . 1 . 2]" 1
696 1 38 PRO HA 1 39 TYR H . . 4.780 3.527 3.460 3.561 . 0 0 "[ . 1 . 2]" 1
697 1 38 PRO HA 1 41 GLY H . . 4.050 3.285 3.055 3.504 . 0 0 "[ . 1 . 2]" 1
698 1 38 PRO HA 1 41 GLY QA . . 4.050 3.413 3.024 3.865 . 0 0 "[ . 1 . 2]" 1
699 1 38 PRO HA 1 42 ASN H . . 4.920 4.564 4.289 4.923 0.003 20 0 "[ . 1 . 2]" 1
700 1 38 PRO HB2 1 38 PRO HD2 . . 4.140 3.765 3.413 4.004 . 0 0 "[ . 1 . 2]" 1
701 1 38 PRO HB2 1 39 TYR H . . 4.210 3.093 2.678 3.440 . 0 0 "[ . 1 . 2]" 1
702 1 38 PRO HB3 1 38 PRO HD3 . . 3.610 3.413 3.065 3.730 0.120 6 0 "[ . 1 . 2]" 1
703 1 38 PRO HB3 1 39 TYR H . . 4.240 4.166 3.997 4.261 0.021 13 0 "[ . 1 . 2]" 1
704 1 38 PRO HD2 1 39 TYR H . . 5.500 2.922 2.756 3.088 . 0 0 "[ . 1 . 2]" 1
705 1 38 PRO HD3 1 39 TYR H . . 5.270 4.078 3.926 4.219 . 0 0 "[ . 1 . 2]" 1
706 1 39 TYR H 1 39 TYR HB2 . . 3.320 2.459 2.355 2.613 . 0 0 "[ . 1 . 2]" 1
707 1 39 TYR H 1 39 TYR HB3 . . 3.360 2.477 2.395 2.557 . 0 0 "[ . 1 . 2]" 1
708 1 39 TYR H 1 39 TYR QD . . 4.500 4.134 4.082 4.178 . 0 0 "[ . 1 . 2]" 1
709 1 39 TYR H 1 40 PHE H . . 3.900 2.705 2.583 2.849 . 0 0 "[ . 1 . 2]" 1
710 1 39 TYR HA 1 39 TYR QD . . 4.500 2.616 2.416 2.797 . 0 0 "[ . 1 . 2]" 1
711 1 39 TYR HA 1 39 TYR QE . . 4.480 4.541 4.486 4.586 0.106 19 0 "[ . 1 . 2]" 1
712 1 39 TYR HA 1 40 PHE H . . 4.340 3.552 3.524 3.582 . 0 0 "[ . 1 . 2]" 1
713 1 39 TYR HA 1 42 ASN HB2 . . 5.210 4.125 3.223 5.370 0.160 19 0 "[ . 1 . 2]" 1
714 1 39 TYR HA 1 42 ASN HB3 . . 4.830 4.257 2.780 4.881 0.051 9 0 "[ . 1 . 2]" 1
715 1 39 TYR HA 1 42 ASN HD21 . . 4.610 3.300 2.465 4.613 0.003 18 0 "[ . 1 . 2]" 1
716 1 39 TYR HA 1 42 ASN HD22 . . 5.040 3.957 1.708 5.067 0.027 3 0 "[ . 1 . 2]" 1
717 1 39 TYR HB2 1 39 TYR QE . . 4.440 4.397 4.343 4.440 . 0 0 "[ . 1 . 2]" 1
718 1 39 TYR HB2 1 40 PHE H . . 4.340 3.882 3.726 4.077 . 0 0 "[ . 1 . 2]" 1
719 1 39 TYR HB3 1 40 PHE H . . 4.010 2.600 2.446 2.837 . 0 0 "[ . 1 . 2]" 1
720 1 39 TYR QD 1 40 PHE H . . 4.480 3.675 3.421 3.939 . 0 0 "[ . 1 . 2]" 1
721 1 39 TYR QE 1 43 ARG QD . . 4.320 3.245 2.816 4.327 0.007 8 0 "[ . 1 . 2]" 1
722 1 40 PHE H 1 40 PHE HB2 . . 3.870 2.451 2.343 2.496 . 0 0 "[ . 1 . 2]" 1
723 1 40 PHE H 1 40 PHE HB3 . . 4.210 3.621 3.567 3.660 . 0 0 "[ . 1 . 2]" 1
724 1 40 PHE H 1 40 PHE QD . . 3.880 3.165 3.015 3.281 . 0 0 "[ . 1 . 2]" 1
725 1 40 PHE H 1 41 GLY H . . 3.160 2.422 2.333 2.506 . 0 0 "[ . 1 . 2]" 1
726 1 40 PHE H 1 42 ASN H . . 4.420 3.972 3.792 4.131 . 0 0 "[ . 1 . 2]" 1
727 1 40 PHE HA 1 40 PHE QD . . 3.810 2.061 1.974 2.225 . 0 0 "[ . 1 . 2]" 1
728 1 40 PHE HA 1 41 GLY H . . 4.870 3.428 3.388 3.455 . 0 0 "[ . 1 . 2]" 1
729 1 40 PHE HA 1 43 ARG H . . 4.340 2.863 2.683 3.035 . 0 0 "[ . 1 . 2]" 1
730 1 40 PHE HA 1 43 ARG HB2 . . 4.580 2.399 2.087 2.657 . 0 0 "[ . 1 . 2]" 1
731 1 40 PHE HA 1 43 ARG HB3 . . 4.230 4.096 3.636 4.310 0.080 8 0 "[ . 1 . 2]" 1
732 1 40 PHE HA 1 52 TRP HE1 . . 4.750 4.034 3.769 4.310 . 0 0 "[ . 1 . 2]" 1
733 1 40 PHE HB2 1 41 GLY H . . 3.920 3.029 2.840 3.099 . 0 0 "[ . 1 . 2]" 1
734 1 40 PHE HB3 1 40 PHE QE . . 4.490 4.430 4.413 4.440 . 0 0 "[ . 1 . 2]" 1
735 1 40 PHE HB3 1 41 GLY H . . 4.230 3.919 3.787 3.987 . 0 0 "[ . 1 . 2]" 1
736 1 40 PHE HB3 1 52 TRP HZ2 . . 4.340 2.863 2.660 3.004 . 0 0 "[ . 1 . 2]" 1
737 1 40 PHE QD 1 41 GLY H . . 4.910 4.504 4.447 4.573 . 0 0 "[ . 1 . 2]" 1
738 1 40 PHE QD 1 52 TRP HB2 . . 4.410 4.367 4.203 4.479 0.069 14 0 "[ . 1 . 2]" 1
739 1 40 PHE QD 1 52 TRP HD1 . . 4.130 3.738 3.502 4.016 . 0 0 "[ . 1 . 2]" 1
740 1 40 PHE QD 1 52 TRP HE1 . . 4.900 3.311 3.113 3.533 . 0 0 "[ . 1 . 2]" 1
741 1 40 PHE QE 1 52 TRP HB2 . . 4.090 2.883 2.692 3.105 . 0 0 "[ . 1 . 2]" 1
742 1 41 GLY H 1 42 ASN H . . 3.460 2.675 2.565 2.840 . 0 0 "[ . 1 . 2]" 1
743 1 41 GLY H 1 43 ARG H . . 4.580 3.902 3.796 3.959 . 0 0 "[ . 1 . 2]" 1
744 1 41 GLY QA 1 42 ASN H . . 3.580 2.823 2.742 2.922 . 0 0 "[ . 1 . 2]" 1
745 1 41 GLY QA 1 43 ARG H . . 4.500 3.578 3.481 3.668 . 0 0 "[ . 1 . 2]" 1
746 1 41 GLY QA 1 44 THR MG . . 3.660 2.380 2.040 3.664 0.004 2 0 "[ . 1 . 2]" 1
747 1 42 ASN H 1 42 ASN HB2 . . 3.540 2.867 2.288 3.658 0.118 12 0 "[ . 1 . 2]" 1
748 1 42 ASN H 1 42 ASN HB3 . . 3.560 2.936 1.988 3.602 0.042 6 0 "[ . 1 . 2]" 1
749 1 42 ASN H 1 42 ASN HD21 . . 3.730 3.300 2.447 3.850 0.120 7 0 "[ . 1 . 2]" 1
750 1 42 ASN H 1 42 ASN HD22 . . 4.820 4.287 3.440 4.989 0.169 13 0 "[ . 1 . 2]" 1
751 1 42 ASN H 1 43 ARG H . . 3.210 2.370 2.232 2.477 . 0 0 "[ . 1 . 2]" 1
752 1 42 ASN HB2 1 43 ARG H . . 4.540 3.923 3.178 4.456 . 0 0 "[ . 1 . 2]" 1
753 1 42 ASN HB3 1 42 ASN HD22 . . 4.130 3.727 3.397 4.073 . 0 0 "[ . 1 . 2]" 1
754 1 42 ASN HB3 1 43 ARG H . . 4.490 4.001 3.380 4.495 0.005 18 0 "[ . 1 . 2]" 1
755 1 43 ARG H 1 43 ARG HB2 . . 4.340 2.623 2.483 2.700 . 0 0 "[ . 1 . 2]" 1
756 1 43 ARG H 1 43 ARG HB3 . . 4.130 3.753 3.665 3.827 . 0 0 "[ . 1 . 2]" 1
757 1 43 ARG H 1 43 ARG QG . . 4.460 3.122 2.911 3.269 . 0 0 "[ . 1 . 2]" 1
758 1 43 ARG H 1 44 THR H . . 3.840 3.193 2.279 3.609 . 0 0 "[ . 1 . 2]" 1
759 1 43 ARG H 1 52 TRP HE1 . . 4.870 4.660 4.501 4.841 . 0 0 "[ . 1 . 2]" 1
760 1 43 ARG HA 1 43 ARG QD . . 4.200 3.857 2.299 4.002 . 0 0 "[ . 1 . 2]" 1
761 1 43 ARG HA 1 44 THR H . . 3.270 2.506 2.250 3.207 . 0 0 "[ . 1 . 2]" 1
762 1 43 ARG HA 1 45 SER H . . 3.710 3.325 3.014 3.600 . 0 0 "[ . 1 . 2]" 1
763 1 43 ARG HA 1 48 GLN QB . . 4.000 2.161 1.838 2.584 . 0 0 "[ . 1 . 2]" 1
764 1 43 ARG HA 1 48 GLN HE21 . . 4.100 2.368 1.870 2.669 . 0 0 "[ . 1 . 2]" 1
765 1 43 ARG HA 1 48 GLN HE22 . . 4.240 3.695 2.669 4.273 0.033 7 0 "[ . 1 . 2]" 1
766 1 43 ARG HA 1 48 GLN QG . . 4.630 3.802 2.780 4.535 . 0 0 "[ . 1 . 2]" 1
767 1 43 ARG HA 1 49 SER QB . . 4.530 4.501 4.304 4.590 0.060 9 0 "[ . 1 . 2]" 1
768 1 43 ARG HA 1 52 TRP HE1 . . 4.820 4.378 4.149 4.581 . 0 0 "[ . 1 . 2]" 1
769 1 43 ARG HB2 1 43 ARG QD . . 3.740 2.490 2.318 3.526 . 0 0 "[ . 1 . 2]" 1
770 1 43 ARG HB2 1 52 TRP HE1 . . 3.540 2.622 2.399 2.988 . 0 0 "[ . 1 . 2]" 1
771 1 43 ARG HB3 1 43 ARG QD . . 2.880 2.314 2.166 2.848 . 0 0 "[ . 1 . 2]" 1
772 1 43 ARG HB3 1 44 THR H . . 4.810 4.233 4.053 4.423 . 0 0 "[ . 1 . 2]" 1
773 1 43 ARG HB3 1 48 GLN HE21 . . 4.830 3.748 3.221 4.576 . 0 0 "[ . 1 . 2]" 1
774 1 43 ARG HB3 1 52 TRP HD1 . . 3.640 3.172 2.788 3.478 . 0 0 "[ . 1 . 2]" 1
775 1 43 ARG HB3 1 52 TRP HE1 . . 3.580 2.278 1.898 2.557 . 0 0 "[ . 1 . 2]" 1
776 1 43 ARG QD 1 48 GLN HE21 . . 5.150 4.236 3.587 5.167 0.017 4 0 "[ . 1 . 2]" 1
777 1 43 ARG QD 1 52 TRP HD1 . . 3.900 2.596 1.994 4.023 0.123 6 0 "[ . 1 . 2]" 1
778 1 43 ARG QG 1 49 SER HA . . 4.810 4.664 4.370 4.847 0.037 8 0 "[ . 1 . 2]" 1
779 1 43 ARG QG 1 52 TRP HD1 . . 4.380 4.308 3.611 4.488 0.108 7 0 "[ . 1 . 2]" 1
780 1 43 ARG QG 1 52 TRP HE1 . . 4.710 4.191 3.565 4.404 . 0 0 "[ . 1 . 2]" 1
781 1 44 THR H 1 44 THR MG . . 3.270 2.874 2.348 3.555 0.285 2 0 "[ . 1 . 2]" 1
782 1 44 THR H 1 45 SER H . . 2.970 2.265 1.964 2.973 0.003 6 0 "[ . 1 . 2]" 1
783 1 44 THR H 1 48 GLN QB . . 4.800 3.429 2.942 4.482 . 0 0 "[ . 1 . 2]" 1
784 1 44 THR H 1 48 GLN HE21 . . 4.380 4.212 3.090 4.471 0.091 17 0 "[ . 1 . 2]" 1
785 1 44 THR HA 1 44 THR HB . . 2.790 2.562 2.506 2.924 0.134 2 0 "[ . 1 . 2]" 1
786 1 44 THR HA 1 44 THR MG . . 3.380 2.221 2.080 2.298 . 0 0 "[ . 1 . 2]" 1
787 1 44 THR HA 1 49 SER QB . . 4.570 2.679 2.301 3.029 . 0 0 "[ . 1 . 2]" 1
788 1 44 THR HA 1 52 TRP HE1 . . 4.600 4.178 3.730 4.481 . 0 0 "[ . 1 . 2]" 1
789 1 44 THR HA 1 52 TRP HZ2 . . 3.730 3.699 3.427 3.809 0.079 6 0 "[ . 1 . 2]" 1
790 1 44 THR MG 1 45 SER H . . 4.310 4.282 4.159 4.363 0.053 13 0 "[ . 1 . 2]" 1
791 1 44 THR MG 1 52 TRP HZ2 . . 3.750 3.773 3.678 3.813 0.063 2 0 "[ . 1 . 2]" 1
792 1 45 SER H 1 48 GLN H . . 4.140 4.153 4.052 4.208 0.068 9 0 "[ . 1 . 2]" 1
793 1 45 SER H 1 48 GLN HA . . 5.170 5.213 5.097 5.349 0.179 5 0 "[ . 1 . 2]" 1
794 1 45 SER H 1 48 GLN QB . . 3.430 2.248 2.096 2.445 . 0 0 "[ . 1 . 2]" 1
795 1 45 SER H 1 48 GLN QG . . 4.620 3.435 2.787 4.159 . 0 0 "[ . 1 . 2]" 1
796 1 46 GLN HA 1 46 GLN QG . . 3.670 2.470 2.347 3.341 . 0 0 "[ . 1 . 2]" 1
797 1 46 GLN HA 1 47 GLU H . . 4.030 3.567 3.517 3.604 . 0 0 "[ . 1 . 2]" 1
798 1 46 GLN HA 1 48 GLN H . . 5.460 4.283 3.977 4.651 . 0 0 "[ . 1 . 2]" 1
799 1 46 GLN HA 1 49 SER H . . 4.440 3.749 3.252 4.085 . 0 0 "[ . 1 . 2]" 1
800 1 46 GLN HA 1 50 ALA H . . 4.700 4.256 3.712 4.611 . 0 0 "[ . 1 . 2]" 1
801 1 46 GLN HB2 1 46 GLN QG . . 2.530 2.343 2.325 2.379 . 0 0 "[ . 1 . 2]" 1
802 1 46 GLN HB3 1 46 GLN QG . . 2.670 2.329 2.165 2.369 . 0 0 "[ . 1 . 2]" 1
803 1 47 GLU H 1 47 GLU HB2 . . 2.970 2.518 2.440 2.725 . 0 0 "[ . 1 . 2]" 1
804 1 47 GLU H 1 47 GLU HB3 . . 4.080 3.627 3.588 3.671 . 0 0 "[ . 1 . 2]" 1
805 1 47 GLU H 1 47 GLU QG . . 3.620 2.337 2.202 2.786 . 0 0 "[ . 1 . 2]" 1
806 1 47 GLU H 1 48 GLN H . . 3.400 2.383 2.210 2.626 . 0 0 "[ . 1 . 2]" 1
807 1 47 GLU H 1 49 SER H . . 4.420 4.051 3.868 4.230 . 0 0 "[ . 1 . 2]" 1
808 1 47 GLU HA 1 47 GLU HB2 . . 3.130 3.020 3.007 3.032 . 0 0 "[ . 1 . 2]" 1
809 1 47 GLU HA 1 47 GLU QG . . 3.410 2.562 2.383 2.983 . 0 0 "[ . 1 . 2]" 1
810 1 47 GLU HA 1 48 GLN H . . 3.810 3.401 3.282 3.493 . 0 0 "[ . 1 . 2]" 1
811 1 47 GLU HA 1 50 ALA H . . 4.160 3.371 3.076 3.992 . 0 0 "[ . 1 . 2]" 1
812 1 47 GLU HB2 1 47 GLU QG . . 2.720 2.295 2.149 2.403 . 0 0 "[ . 1 . 2]" 1
813 1 47 GLU HB2 1 48 GLN H . . 4.020 2.970 2.502 3.289 . 0 0 "[ . 1 . 2]" 1
814 1 47 GLU HB3 1 47 GLU QG . . 2.800 2.329 2.145 2.370 . 0 0 "[ . 1 . 2]" 1
815 1 47 GLU QG 1 48 GLN H . . 4.110 4.106 4.025 4.216 0.106 5 0 "[ . 1 . 2]" 1
816 1 48 GLN H 1 48 GLN QB . . 3.100 2.374 2.294 2.471 . 0 0 "[ . 1 . 2]" 1
817 1 48 GLN H 1 48 GLN QG . . 3.320 2.451 2.213 2.578 . 0 0 "[ . 1 . 2]" 1
818 1 48 GLN H 1 49 SER H . . 3.080 2.518 2.384 2.702 . 0 0 "[ . 1 . 2]" 1
819 1 48 GLN H 1 50 ALA H . . 4.400 3.927 3.652 4.163 . 0 0 "[ . 1 . 2]" 1
820 1 48 GLN HA 1 48 GLN HE21 . . 4.850 3.431 2.808 4.250 . 0 0 "[ . 1 . 2]" 1
821 1 48 GLN HA 1 48 GLN HE22 . . 4.980 4.219 3.358 5.332 0.352 6 0 "[ . 1 . 2]" 1
822 1 48 GLN HA 1 48 GLN QG . . 3.250 2.560 2.135 2.851 . 0 0 "[ . 1 . 2]" 1
823 1 48 GLN HA 1 49 SER H . . 3.820 3.453 3.363 3.530 . 0 0 "[ . 1 . 2]" 1
824 1 48 GLN HA 1 50 ALA H . . 4.970 4.442 4.144 4.915 . 0 0 "[ . 1 . 2]" 1
825 1 48 GLN QB 1 49 SER H . . 3.730 2.888 2.633 3.202 . 0 0 "[ . 1 . 2]" 1
826 1 48 GLN QB 1 50 ALA H . . 4.960 4.698 4.468 4.929 . 0 0 "[ . 1 . 2]" 1
827 1 48 GLN QG 1 49 SER H . . 4.430 4.240 4.070 4.392 . 0 0 "[ . 1 . 2]" 1
828 1 49 SER H 1 50 ALA H . . 3.130 2.177 2.091 2.291 . 0 0 "[ . 1 . 2]" 1
829 1 49 SER H 1 52 TRP HE1 . . 5.360 4.393 4.228 4.510 . 0 0 "[ . 1 . 2]" 1
830 1 49 SER HA 1 50 ALA H . . 4.180 3.429 3.321 3.509 . 0 0 "[ . 1 . 2]" 1
831 1 49 SER HA 1 51 GLY H . . 4.820 4.184 3.794 4.406 . 0 0 "[ . 1 . 2]" 1
832 1 49 SER HA 1 52 TRP H . . 4.050 3.683 3.480 3.951 . 0 0 "[ . 1 . 2]" 1
833 1 49 SER HA 1 52 TRP HD1 . . 3.190 2.547 2.343 2.850 . 0 0 "[ . 1 . 2]" 1
834 1 49 SER HA 1 52 TRP HE1 . . 3.260 1.826 1.701 2.032 . 0 0 "[ . 1 . 2]" 1
835 1 49 SER HA 1 53 LYS H . . 4.390 4.221 4.032 4.377 . 0 0 "[ . 1 . 2]" 1
836 1 49 SER QB 1 50 ALA H . . 4.840 3.506 2.825 3.774 . 0 0 "[ . 1 . 2]" 1
837 1 49 SER QB 1 52 TRP HE1 . . 4.020 2.542 2.188 2.957 . 0 0 "[ . 1 . 2]" 1
838 1 49 SER QB 1 52 TRP HZ2 . . 4.060 3.063 2.745 3.830 . 0 0 "[ . 1 . 2]" 1
839 1 50 ALA H 1 50 ALA MB . . 2.920 2.210 2.186 2.224 . 0 0 "[ . 1 . 2]" 1
840 1 50 ALA H 1 51 GLY H . . 3.900 2.939 2.797 3.133 . 0 0 "[ . 1 . 2]" 1
841 1 50 ALA H 1 52 TRP H . . 4.840 4.652 4.539 4.801 . 0 0 "[ . 1 . 2]" 1
842 1 50 ALA HA 1 51 GLY H . . 4.550 3.532 3.434 3.576 . 0 0 "[ . 1 . 2]" 1
843 1 50 ALA HA 1 53 LYS H . . 4.090 3.698 3.496 3.937 . 0 0 "[ . 1 . 2]" 1
844 1 50 ALA HA 1 53 LYS HB2 . . 4.080 2.619 2.189 3.610 . 0 0 "[ . 1 . 2]" 1
845 1 50 ALA HA 1 53 LYS HB3 . . 4.570 4.016 2.437 4.550 . 0 0 "[ . 1 . 2]" 1
846 1 50 ALA HA 1 53 LYS QD . . 4.320 2.515 2.168 3.285 . 0 0 "[ . 1 . 2]" 1
847 1 50 ALA HA 1 54 ASN H . . 4.190 4.098 3.777 4.237 0.047 18 0 "[ . 1 . 2]" 1
848 1 50 ALA MB 1 51 GLY H . . 3.680 2.557 2.289 2.952 . 0 0 "[ . 1 . 2]" 1
849 1 50 ALA MB 1 52 TRP H . . 5.500 4.728 4.517 4.933 . 0 0 "[ . 1 . 2]" 1
850 1 50 ALA MB 1 53 LYS H . . 4.670 4.712 4.646 4.775 0.105 20 0 "[ . 1 . 2]" 1
851 1 50 ALA MB 1 54 ASN H . . 4.820 4.573 4.431 4.673 . 0 0 "[ . 1 . 2]" 1
852 1 51 GLY H 1 52 TRP H . . 3.390 2.766 2.622 2.899 . 0 0 "[ . 1 . 2]" 1
853 1 51 GLY HA2 1 52 TRP H . . 4.320 3.573 3.556 3.592 . 0 0 "[ . 1 . 2]" 1
854 1 51 GLY HA2 1 54 ASN H . . 4.330 3.336 3.215 3.451 . 0 0 "[ . 1 . 2]" 1
855 1 51 GLY HA2 1 54 ASN QB . . 4.050 2.631 2.401 2.735 . 0 0 "[ . 1 . 2]" 1
856 1 51 GLY HA3 1 52 TRP H . . 4.240 2.802 2.710 2.901 . 0 0 "[ . 1 . 2]" 1
857 1 51 GLY HA3 1 53 LYS H . . 4.980 4.602 4.497 4.686 . 0 0 "[ . 1 . 2]" 1
858 1 52 TRP H 1 52 TRP HB3 . . 3.700 2.798 2.752 2.851 . 0 0 "[ . 1 . 2]" 1
859 1 52 TRP H 1 52 TRP HD1 . . 3.600 2.505 2.324 2.650 . 0 0 "[ . 1 . 2]" 1
860 1 52 TRP H 1 53 LYS H . . 3.280 2.549 2.494 2.616 . 0 0 "[ . 1 . 2]" 1
861 1 52 TRP HA 1 52 TRP HD1 . . 4.260 4.352 4.311 4.393 0.133 7 0 "[ . 1 . 2]" 1
862 1 52 TRP HA 1 53 LYS H . . 4.470 3.493 3.461 3.534 . 0 0 "[ . 1 . 2]" 1
863 1 52 TRP HA 1 54 ASN H . . 4.900 3.942 3.831 4.106 . 0 0 "[ . 1 . 2]" 1
864 1 52 TRP HA 1 55 SER H . . 3.730 3.058 2.773 3.351 . 0 0 "[ . 1 . 2]" 1
865 1 52 TRP HA 1 55 SER HB2 . . 4.040 2.893 2.275 3.561 . 0 0 "[ . 1 . 2]" 1
866 1 52 TRP HA 1 56 ILE H . . 4.770 4.274 3.987 4.466 . 0 0 "[ . 1 . 2]" 1
867 1 52 TRP HB2 1 52 TRP HD1 . . 3.800 3.764 3.734 3.799 . 0 0 "[ . 1 . 2]" 1
868 1 52 TRP HB3 1 52 TRP HD1 . . 3.470 2.645 2.605 2.694 . 0 0 "[ . 1 . 2]" 1
869 1 52 TRP HH2 1 56 ILE MD . . 4.120 4.074 3.940 4.142 0.022 10 0 "[ . 1 . 2]" 1
870 1 53 LYS H 1 53 LYS HB2 . . 3.280 2.413 2.149 2.475 . 0 0 "[ . 1 . 2]" 1
871 1 53 LYS H 1 53 LYS HB3 . . 3.620 3.494 2.061 3.605 . 0 0 "[ . 1 . 2]" 1
872 1 53 LYS H 1 53 LYS QD . . 4.040 3.814 3.609 4.104 0.064 7 0 "[ . 1 . 2]" 1
873 1 53 LYS H 1 53 LYS HE2 . . 5.040 5.127 5.057 5.179 0.139 19 0 "[ . 1 . 2]" 1
874 1 53 LYS H 1 53 LYS HE3 . . 4.760 4.559 3.858 4.749 . 0 0 "[ . 1 . 2]" 1
875 1 53 LYS H 1 53 LYS HG3 . . 3.800 2.355 2.214 4.006 0.206 7 0 "[ . 1 . 2]" 1
876 1 53 LYS HA 1 53 LYS QD . . 4.180 3.957 3.894 4.198 0.018 7 0 "[ . 1 . 2]" 1
877 1 53 LYS HA 1 53 LYS HE2 . . 4.670 4.698 4.271 4.754 0.084 3 0 "[ . 1 . 2]" 1
878 1 53 LYS HA 1 53 LYS HG2 . . 4.030 2.468 2.383 3.205 . 0 0 "[ . 1 . 2]" 1
879 1 53 LYS HA 1 53 LYS HG3 . . 3.800 2.931 2.452 3.021 . 0 0 "[ . 1 . 2]" 1
880 1 53 LYS HA 1 54 ASN H . . 4.520 3.533 3.476 3.570 . 0 0 "[ . 1 . 2]" 1
881 1 53 LYS HA 1 56 ILE H . . 4.200 3.399 3.261 3.532 . 0 0 "[ . 1 . 2]" 1
882 1 53 LYS HA 1 56 ILE HB . . 4.280 2.753 2.549 2.906 . 0 0 "[ . 1 . 2]" 1
883 1 53 LYS HA 1 56 ILE MD . . 4.070 2.721 2.435 2.987 . 0 0 "[ . 1 . 2]" 1
884 1 53 LYS HB2 1 53 LYS QD . . 3.920 2.405 2.340 2.700 . 0 0 "[ . 1 . 2]" 1
885 1 53 LYS HB2 1 53 LYS HE2 . . 4.560 4.406 2.909 4.528 . 0 0 "[ . 1 . 2]" 1
886 1 53 LYS HB2 1 53 LYS HE3 . . 5.090 4.123 1.920 4.342 . 0 0 "[ . 1 . 2]" 1
887 1 53 LYS HB2 1 54 ASN H . . 3.640 2.718 2.530 3.732 0.092 7 0 "[ . 1 . 2]" 1
888 1 53 LYS HB3 1 53 LYS HE2 . . 4.650 4.113 4.030 4.161 . 0 0 "[ . 1 . 2]" 1
889 1 53 LYS HB3 1 53 LYS HE3 . . 5.170 4.491 3.036 4.604 . 0 0 "[ . 1 . 2]" 1
890 1 53 LYS HB3 1 54 ASN H . . 4.030 3.567 2.457 3.789 . 0 0 "[ . 1 . 2]" 1
891 1 53 LYS HE3 1 53 LYS HG2 . . 4.370 3.056 2.828 3.782 . 0 0 "[ . 1 . 2]" 1
892 1 53 LYS HG2 1 54 ASN H . . 4.970 4.910 3.732 5.011 0.041 13 0 "[ . 1 . 2]" 1
893 1 53 LYS HG3 1 54 ASN H . . 5.130 4.358 4.282 4.562 . 0 0 "[ . 1 . 2]" 1
894 1 54 ASN H 1 54 ASN QB . . 2.810 2.285 2.208 2.486 . 0 0 "[ . 1 . 2]" 1
895 1 54 ASN H 1 55 SER H . . 3.180 2.660 2.578 2.834 . 0 0 "[ . 1 . 2]" 1
896 1 54 ASN HA 1 55 SER H . . 4.610 3.491 3.412 3.565 . 0 0 "[ . 1 . 2]" 1
897 1 54 ASN HA 1 56 ILE H . . 5.000 4.480 4.269 4.688 . 0 0 "[ . 1 . 2]" 1
898 1 54 ASN HA 1 57 ARG H . . 3.960 3.529 3.238 3.879 . 0 0 "[ . 1 . 2]" 1
899 1 54 ASN HA 1 57 ARG HB3 . . 4.480 3.605 2.669 4.519 0.039 16 0 "[ . 1 . 2]" 1
900 1 54 ASN QB 1 55 SER H . . 3.180 2.644 2.301 2.887 . 0 0 "[ . 1 . 2]" 1
901 1 55 SER H 1 55 SER HB2 . . 3.340 2.487 2.430 2.577 . 0 0 "[ . 1 . 2]" 1
902 1 55 SER H 1 55 SER HB3 . . 4.270 3.494 2.603 3.586 . 0 0 "[ . 1 . 2]" 1
903 1 55 SER H 1 56 ILE H . . 3.500 2.684 2.535 2.785 . 0 0 "[ . 1 . 2]" 1
904 1 55 SER HA 1 56 ILE H . . 4.430 3.558 3.528 3.592 . 0 0 "[ . 1 . 2]" 1
905 1 55 SER HA 1 58 HIS H . . 3.990 3.520 3.214 3.970 . 0 0 "[ . 1 . 2]" 1
906 1 55 SER HA 1 58 HIS QB . . 3.670 2.736 2.272 3.087 . 0 0 "[ . 1 . 2]" 1
907 1 55 SER HA 1 59 ASN HD21 . . 4.970 4.619 4.049 5.091 0.121 13 0 "[ . 1 . 2]" 1
908 1 55 SER HB2 1 56 ILE H . . 3.870 2.650 2.353 3.793 . 0 0 "[ . 1 . 2]" 1
909 1 55 SER HB3 1 56 ILE H . . 4.290 3.653 2.503 3.901 . 0 0 "[ . 1 . 2]" 1
910 1 55 SER HB3 1 59 ASN HD21 . . 4.750 4.233 3.687 4.808 0.058 13 0 "[ . 1 . 2]" 1
911 1 56 ILE H 1 56 ILE HB . . 3.300 2.412 2.322 2.486 . 0 0 "[ . 1 . 2]" 1
912 1 56 ILE H 1 56 ILE MD . . 3.930 3.619 3.541 3.726 . 0 0 "[ . 1 . 2]" 1
913 1 56 ILE H 1 56 ILE HG12 . . 4.030 3.688 3.586 3.789 . 0 0 "[ . 1 . 2]" 1
914 1 56 ILE H 1 56 ILE HG13 . . 3.540 2.395 2.303 2.539 . 0 0 "[ . 1 . 2]" 1
915 1 56 ILE H 1 56 ILE MG . . 4.100 3.767 3.730 3.804 . 0 0 "[ . 1 . 2]" 1
916 1 56 ILE H 1 57 ARG H . . 3.500 2.717 2.565 2.857 . 0 0 "[ . 1 . 2]" 1
917 1 56 ILE HA 1 56 ILE MD . . 4.150 3.838 3.808 3.880 . 0 0 "[ . 1 . 2]" 1
918 1 56 ILE HA 1 56 ILE HG12 . . 3.790 2.565 2.504 2.648 . 0 0 "[ . 1 . 2]" 1
919 1 56 ILE HA 1 56 ILE HG13 . . 4.020 2.875 2.788 2.964 . 0 0 "[ . 1 . 2]" 1
920 1 56 ILE HA 1 56 ILE MG . . 3.480 2.557 2.486 2.619 . 0 0 "[ . 1 . 2]" 1
921 1 56 ILE HA 1 57 ARG H . . 3.870 3.572 3.498 3.652 . 0 0 "[ . 1 . 2]" 1
922 1 56 ILE HA 1 59 ASN H . . 4.620 3.540 3.330 3.798 . 0 0 "[ . 1 . 2]" 1
923 1 56 ILE HA 1 59 ASN HB2 . . 4.170 3.010 2.549 3.137 . 0 0 "[ . 1 . 2]" 1
924 1 56 ILE HA 1 59 ASN HB3 . . 4.670 4.667 4.050 4.765 0.095 11 0 "[ . 1 . 2]" 1
925 1 56 ILE HA 1 60 LEU H . . 4.940 4.217 4.011 4.430 . 0 0 "[ . 1 . 2]" 1
926 1 56 ILE HB 1 56 ILE MD . . 3.630 2.423 2.391 2.447 . 0 0 "[ . 1 . 2]" 1
927 1 56 ILE HB 1 57 ARG H . . 2.970 2.563 2.435 2.810 . 0 0 "[ . 1 . 2]" 1
928 1 56 ILE MD 1 56 ILE MG . . 3.020 1.944 1.899 1.998 . 0 0 "[ . 1 . 2]" 1
929 1 56 ILE MD 1 57 ARG H . . 4.880 4.574 4.441 4.810 . 0 0 "[ . 1 . 2]" 1
930 1 56 ILE HG12 1 56 ILE MG . . 3.330 2.299 2.240 2.354 . 0 0 "[ . 1 . 2]" 1
931 1 56 ILE MG 1 57 ARG H . . 3.830 3.164 3.001 3.299 . 0 0 "[ . 1 . 2]" 1
932 1 56 ILE MG 1 60 LEU H . . 4.540 4.022 3.713 4.260 . 0 0 "[ . 1 . 2]" 1
933 1 56 ILE MG 1 60 LEU MD1 . . 3.350 2.244 1.947 2.451 . 0 0 "[ . 1 . 2]" 1
934 1 56 ILE MG 1 60 LEU MD2 . . 4.110 3.092 2.133 3.662 . 0 0 "[ . 1 . 2]" 1
935 1 57 ARG H 1 57 ARG HB2 . . 4.010 2.157 1.922 2.414 . 0 0 "[ . 1 . 2]" 1
936 1 57 ARG H 1 57 ARG HB3 . . 3.570 3.178 2.574 3.627 0.057 16 0 "[ . 1 . 2]" 1
937 1 57 ARG H 1 57 ARG QD . . 5.200 3.963 2.106 4.561 . 0 0 "[ . 1 . 2]" 1
938 1 57 ARG H 1 57 ARG HG2 . . 4.060 3.201 2.188 4.132 0.072 16 0 "[ . 1 . 2]" 1
939 1 57 ARG H 1 57 ARG HG3 . . 4.050 3.899 3.353 4.218 0.168 13 0 "[ . 1 . 2]" 1
940 1 57 ARG H 1 58 HIS H . . 3.500 2.702 2.526 2.797 . 0 0 "[ . 1 . 2]" 1
941 1 57 ARG H 1 60 LEU MD1 . . 4.960 4.046 3.659 4.323 . 0 0 "[ . 1 . 2]" 1
942 1 57 ARG HA 1 57 ARG QD . . 4.320 2.366 1.960 3.314 . 0 0 "[ . 1 . 2]" 1
943 1 57 ARG HA 1 57 ARG HG2 . . 4.100 2.663 2.368 3.568 . 0 0 "[ . 1 . 2]" 1
944 1 57 ARG HA 1 57 ARG HG3 . . 3.640 3.581 2.332 3.711 0.071 18 0 "[ . 1 . 2]" 1
945 1 57 ARG HA 1 58 HIS H . . 4.300 3.515 3.447 3.595 . 0 0 "[ . 1 . 2]" 1
946 1 57 ARG HA 1 60 LEU H . . 4.280 3.462 3.162 3.816 . 0 0 "[ . 1 . 2]" 1
947 1 57 ARG HA 1 60 LEU HB2 . . 4.240 2.646 2.275 3.398 . 0 0 "[ . 1 . 2]" 1
948 1 57 ARG HA 1 60 LEU MD1 . . 3.630 2.195 1.809 2.452 . 0 0 "[ . 1 . 2]" 1
949 1 57 ARG HB2 1 57 ARG QD . . 3.770 3.354 2.596 3.518 . 0 0 "[ . 1 . 2]" 1
950 1 57 ARG HB2 1 57 ARG HG2 . . 2.400 2.426 2.386 2.494 0.094 11 0 "[ . 1 . 2]" 1
951 1 57 ARG HB2 1 58 HIS H . . 3.570 3.120 2.553 3.610 0.040 2 0 "[ . 1 . 2]" 1
952 1 57 ARG HB3 1 57 ARG QD . . 3.770 2.676 2.229 3.468 . 0 0 "[ . 1 . 2]" 1
953 1 57 ARG HB3 1 58 HIS H . . 3.900 3.099 2.512 3.750 . 0 0 "[ . 1 . 2]" 1
954 1 57 ARG HG3 1 58 HIS H . . 5.050 4.964 4.811 5.113 0.063 17 0 "[ . 1 . 2]" 1
955 1 58 HIS H 1 58 HIS QB . . 2.950 2.337 2.178 2.625 . 0 0 "[ . 1 . 2]" 1
956 1 58 HIS H 1 59 ASN H . . 3.360 2.757 2.529 2.888 . 0 0 "[ . 1 . 2]" 1
957 1 58 HIS HA 1 59 ASN H . . 4.300 3.547 3.491 3.598 . 0 0 "[ . 1 . 2]" 1
958 1 58 HIS HA 1 61 SER H . . 4.810 3.632 3.284 4.203 . 0 0 "[ . 1 . 2]" 1
959 1 58 HIS QB 1 59 ASN H . . 3.450 2.494 2.324 2.796 . 0 0 "[ . 1 . 2]" 1
960 1 59 ASN H 1 59 ASN HB2 . . 3.310 2.383 2.288 2.518 . 0 0 "[ . 1 . 2]" 1
961 1 59 ASN H 1 59 ASN HB3 . . 3.750 3.607 3.529 3.670 . 0 0 "[ . 1 . 2]" 1
962 1 59 ASN H 1 59 ASN HD21 . . 3.440 2.941 2.397 3.502 0.062 10 0 "[ . 1 . 2]" 1
963 1 59 ASN H 1 59 ASN HD22 . . 3.960 3.925 3.722 4.038 0.078 12 0 "[ . 1 . 2]" 1
964 1 59 ASN HA 1 59 ASN HD21 . . 4.840 3.888 1.997 4.371 . 0 0 "[ . 1 . 2]" 1
965 1 59 ASN HA 1 60 LEU H . . 4.660 3.485 3.433 3.524 . 0 0 "[ . 1 . 2]" 1
966 1 59 ASN HA 1 62 LEU H . . 4.280 3.250 2.937 3.513 . 0 0 "[ . 1 . 2]" 1
967 1 59 ASN HA 1 62 LEU HB3 . . 4.210 3.567 2.040 4.258 0.048 18 0 "[ . 1 . 2]" 1
968 1 59 ASN HA 1 62 LEU QD . . 3.730 2.498 2.025 3.018 . 0 0 "[ . 1 . 2]" 1
969 1 59 ASN HA 1 62 LEU HG . . 4.140 3.253 2.037 4.201 0.061 13 0 "[ . 1 . 2]" 1
970 1 59 ASN HB2 1 60 LEU H . . 4.390 2.882 2.526 3.084 . 0 0 "[ . 1 . 2]" 1
971 1 59 ASN HB3 1 60 LEU H . . 4.810 3.651 3.545 3.755 . 0 0 "[ . 1 . 2]" 1
972 1 60 LEU H 1 60 LEU HB3 . . 4.340 3.595 3.555 3.616 . 0 0 "[ . 1 . 2]" 1
973 1 60 LEU H 1 60 LEU MD1 . . 3.900 3.620 3.475 3.702 . 0 0 "[ . 1 . 2]" 1
974 1 60 LEU H 1 60 LEU MD2 . . 4.460 3.441 3.130 3.662 . 0 0 "[ . 1 . 2]" 1
975 1 60 LEU H 1 60 LEU HG . . 3.690 2.363 2.030 2.535 . 0 0 "[ . 1 . 2]" 1
976 1 60 LEU H 1 61 SER H . . 3.900 2.705 2.570 2.873 . 0 0 "[ . 1 . 2]" 1
977 1 60 LEU H 1 62 LEU H . . 4.750 3.989 3.817 4.215 . 0 0 "[ . 1 . 2]" 1
978 1 60 LEU HA 1 60 LEU MD1 . . 4.290 3.868 3.846 3.899 . 0 0 "[ . 1 . 2]" 1
979 1 60 LEU HA 1 60 LEU MD2 . . 3.590 2.051 1.942 2.222 . 0 0 "[ . 1 . 2]" 1
980 1 60 LEU HB2 1 60 LEU MD1 . . 3.510 2.311 2.205 2.389 . 0 0 "[ . 1 . 2]" 1
981 1 60 LEU HB2 1 61 SER H . . 4.760 2.734 2.243 3.123 . 0 0 "[ . 1 . 2]" 1
982 1 60 LEU HB3 1 60 LEU MD2 . . 3.400 2.338 2.297 2.410 . 0 0 "[ . 1 . 2]" 1
983 1 60 LEU MD1 1 80 TRP QB . . 5.100 4.374 4.024 4.730 . 0 0 "[ . 1 . 2]" 1
984 1 60 LEU MD1 1 80 TRP HD1 . . 4.680 3.531 3.010 3.815 . 0 0 "[ . 1 . 2]" 1
985 1 60 LEU MD1 1 80 TRP HE1 . . 4.850 2.511 2.046 3.106 . 0 0 "[ . 1 . 2]" 1
986 1 60 LEU MD1 1 80 TRP HZ2 . . 4.590 3.311 2.975 4.084 . 0 0 "[ . 1 . 2]" 1
987 1 60 LEU MD2 1 80 TRP QB . . 4.180 4.288 4.236 4.334 0.154 4 0 "[ . 1 . 2]" 1
988 1 60 LEU MD2 1 80 TRP HD1 . . 4.610 4.461 3.950 4.662 0.052 14 0 "[ . 1 . 2]" 1
989 1 60 LEU MD2 1 80 TRP HH2 . . 4.830 3.109 2.866 3.462 . 0 0 "[ . 1 . 2]" 1
990 1 60 LEU MD2 1 80 TRP HZ2 . . 3.930 2.374 2.220 2.608 . 0 0 "[ . 1 . 2]" 1
991 1 61 SER H 1 61 SER QB . . 3.730 2.448 2.234 2.905 . 0 0 "[ . 1 . 2]" 1
992 1 61 SER H 1 62 LEU H . . 3.910 2.477 2.300 2.677 . 0 0 "[ . 1 . 2]" 1
993 1 61 SER HA 1 62 LEU H . . 4.420 3.355 3.148 3.543 . 0 0 "[ . 1 . 2]" 1
994 1 61 SER QB 1 62 LEU H . . 4.260 3.291 2.712 4.008 . 0 0 "[ . 1 . 2]" 1
995 1 62 LEU H 1 62 LEU HB2 . . 3.660 2.582 2.108 3.674 0.014 4 0 "[ . 1 . 2]" 1
996 1 62 LEU H 1 62 LEU HB3 . . 3.980 3.209 2.184 3.713 . 0 0 "[ . 1 . 2]" 1
997 1 62 LEU H 1 62 LEU QD . . 4.400 3.384 2.781 3.754 . 0 0 "[ . 1 . 2]" 1
998 1 62 LEU H 1 62 LEU HG . . 3.940 3.083 2.156 4.101 0.161 16 0 "[ . 1 . 2]" 1
999 1 62 LEU HA 1 62 LEU QD . . 3.200 2.165 1.977 3.323 0.123 4 0 "[ . 1 . 2]" 1
1000 1 62 LEU HA 1 62 LEU HG . . 4.170 3.150 2.468 3.764 . 0 0 "[ . 1 . 2]" 1
1001 1 63 HIS HA 1 65 ARG H . . 3.960 3.734 3.363 4.066 0.106 14 0 "[ . 1 . 2]" 1
1002 1 63 HIS QB 1 65 ARG H . . 4.140 2.706 2.068 3.672 . 0 0 "[ . 1 . 2]" 1
1003 1 64 SER HA 1 65 ARG H . . 4.190 3.018 2.282 3.447 . 0 0 "[ . 1 . 2]" 1
1004 1 64 SER HA 1 66 PHE H . . 3.880 3.069 2.803 3.428 . 0 0 "[ . 1 . 2]" 1
1005 1 64 SER QB 1 65 ARG H . . 4.350 3.599 3.026 3.948 . 0 0 "[ . 1 . 2]" 1
1006 1 64 SER QB 1 66 PHE H . . 5.020 4.371 3.934 4.991 . 0 0 "[ . 1 . 2]" 1
1007 1 65 ARG H 1 65 ARG HB2 . . 3.700 2.705 2.423 3.665 . 0 0 "[ . 1 . 2]" 1
1008 1 65 ARG H 1 65 ARG HB3 . . 3.620 3.222 2.307 3.661 0.041 20 0 "[ . 1 . 2]" 1
1009 1 65 ARG H 1 65 ARG QG . . 4.750 2.761 1.900 4.044 . 0 0 "[ . 1 . 2]" 1
1010 1 65 ARG H 1 66 PHE H . . 3.760 2.457 2.269 2.776 . 0 0 "[ . 1 . 2]" 1
1011 1 65 ARG HA 1 65 ARG HD2 . . 4.730 4.293 2.123 4.794 0.064 13 0 "[ . 1 . 2]" 1
1012 1 65 ARG HA 1 65 ARG HD3 . . 4.930 4.381 2.030 4.947 0.017 8 0 "[ . 1 . 2]" 1
1013 1 65 ARG HA 1 65 ARG QG . . 3.570 2.656 2.368 3.537 . 0 0 "[ . 1 . 2]" 1
1014 1 65 ARG HA 1 66 PHE H . . 4.460 3.188 3.062 3.423 . 0 0 "[ . 1 . 2]" 1
1015 1 65 ARG HA 1 83 ASN HD21 . . 4.260 3.440 2.924 4.357 0.097 17 0 "[ . 1 . 2]" 1
1016 1 65 ARG HA 1 83 ASN HD22 . . 4.630 4.278 2.416 4.818 0.188 11 0 "[ . 1 . 2]" 1
1017 1 65 ARG HB2 1 65 ARG HD2 . . 4.140 2.975 2.430 3.689 . 0 0 "[ . 1 . 2]" 1
1018 1 65 ARG HB2 1 65 ARG HD3 . . 4.300 3.076 2.380 3.820 . 0 0 "[ . 1 . 2]" 1
1019 1 65 ARG HB2 1 65 ARG QG . . 2.520 2.322 2.176 2.414 . 0 0 "[ . 1 . 2]" 1
1020 1 65 ARG HB2 1 66 PHE H . . 4.430 3.823 2.987 4.436 0.006 2 0 "[ . 1 . 2]" 1
1021 1 65 ARG HB3 1 65 ARG HD2 . . 4.140 3.076 2.398 3.835 . 0 0 "[ . 1 . 2]" 1
1022 1 65 ARG HB3 1 65 ARG HD3 . . 4.360 3.048 2.366 3.727 . 0 0 "[ . 1 . 2]" 1
1023 1 65 ARG HB3 1 66 PHE H . . 4.500 4.075 3.297 4.517 0.017 3 0 "[ . 1 . 2]" 1
1024 1 66 PHE H 1 66 PHE QD . . 4.180 3.401 2.157 4.172 . 0 0 "[ . 1 . 2]" 1
1025 1 66 PHE H 1 83 ASN HB3 . . 5.140 4.435 3.716 5.161 0.021 5 0 "[ . 1 . 2]" 1
1026 1 66 PHE HA 1 66 PHE QD . . 3.960 3.009 2.430 3.744 . 0 0 "[ . 1 . 2]" 1
1027 1 66 PHE HA 1 67 MET H . . 3.690 2.247 2.111 2.500 . 0 0 "[ . 1 . 2]" 1
1028 1 66 PHE HA 1 82 ILE HA . . 4.180 2.760 1.948 3.640 . 0 0 "[ . 1 . 2]" 1
1029 1 66 PHE HA 1 83 ASN H . . 4.210 2.623 1.844 3.335 . 0 0 "[ . 1 . 2]" 1
1030 1 66 PHE HA 1 83 ASN HB2 . . 5.140 4.016 2.265 5.307 0.167 2 0 "[ . 1 . 2]" 1
1031 1 66 PHE HA 1 83 ASN HB3 . . 5.080 3.722 2.166 4.727 . 0 0 "[ . 1 . 2]" 1
1032 1 66 PHE QB 1 67 MET H . . 4.340 3.105 2.363 3.777 . 0 0 "[ . 1 . 2]" 1
1033 1 66 PHE QD 1 67 MET H . . 4.610 3.291 2.549 4.329 . 0 0 "[ . 1 . 2]" 1
1034 1 66 PHE QD 1 82 ILE HG12 . . 5.340 4.528 1.949 5.391 0.051 8 0 "[ . 1 . 2]" 1
1035 1 66 PHE QD 1 83 ASN H . . 5.170 4.942 3.793 5.346 0.176 18 0 "[ . 1 . 2]" 1
1036 1 67 MET H 1 67 MET QG . . 4.150 2.971 2.187 4.051 . 0 0 "[ . 1 . 2]" 1
1037 1 67 MET H 1 81 VAL H . . 4.510 3.484 2.990 4.318 . 0 0 "[ . 1 . 2]" 1
1038 1 67 MET H 1 81 VAL MG2 . . 4.530 3.454 2.806 4.182 . 0 0 "[ . 1 . 2]" 1
1039 1 67 MET HA 1 67 MET QG . . 3.900 2.908 2.351 3.571 . 0 0 "[ . 1 . 2]" 1
1040 1 67 MET QB 1 68 ARG H . . 4.070 2.960 2.636 3.723 . 0 0 "[ . 1 . 2]" 1
1041 1 67 MET QB 1 83 ASN H . . 5.260 4.307 2.821 5.015 . 0 0 "[ . 1 . 2]" 1
1042 1 67 MET QB 1 83 ASN HA . . 4.630 3.631 2.204 4.517 . 0 0 "[ . 1 . 2]" 1
1043 1 67 MET QB 1 83 ASN HB2 . . 4.840 3.171 1.848 4.851 0.011 9 0 "[ . 1 . 2]" 1
1044 1 67 MET QB 1 83 ASN HB3 . . 4.500 4.069 2.433 4.636 0.136 18 0 "[ . 1 . 2]" 1
1045 1 67 MET QG 1 68 ARG H . . 4.280 4.160 2.876 4.414 0.134 20 0 "[ . 1 . 2]" 1
1046 1 67 MET QG 1 83 ASN HA . . 4.340 3.203 2.346 4.200 . 0 0 "[ . 1 . 2]" 1
1047 1 67 MET QG 1 83 ASN HB2 . . 2.840 2.433 1.791 2.953 0.113 7 0 "[ . 1 . 2]" 1
1048 1 68 ARG H 1 68 ARG HG3 . . 4.260 3.511 2.320 4.405 0.145 20 0 "[ . 1 . 2]" 1
1049 1 68 ARG HA 1 68 ARG HG2 . . 4.410 3.433 2.487 3.852 . 0 0 "[ . 1 . 2]" 1
1050 1 68 ARG HA 1 68 ARG HG3 . . 3.750 3.278 2.436 3.777 0.027 15 0 "[ . 1 . 2]" 1
1051 1 68 ARG HA 1 69 ILE H . . 3.380 2.211 2.056 2.364 . 0 0 "[ . 1 . 2]" 1
1052 1 68 ARG HA 1 80 TRP HA . . 4.200 2.811 1.944 4.170 . 0 0 "[ . 1 . 2]" 1
1053 1 68 ARG HA 1 81 VAL H . . 5.260 3.480 2.845 4.265 . 0 0 "[ . 1 . 2]" 1
1054 1 68 ARG QB 1 68 ARG HD2 . . 3.740 2.766 2.333 3.464 . 0 0 "[ . 1 . 2]" 1
1055 1 68 ARG HG2 1 69 ILE H . . 4.950 4.319 2.638 5.016 0.066 4 0 "[ . 1 . 2]" 1
1056 1 68 ARG HG3 1 69 ILE H . . 4.720 3.889 2.827 4.793 0.073 1 0 "[ . 1 . 2]" 1
1057 1 69 ILE H 1 69 ILE HB . . 4.210 2.963 2.536 3.313 . 0 0 "[ . 1 . 2]" 1
1058 1 69 ILE H 1 69 ILE MD . . 4.680 4.395 3.426 4.689 0.009 13 0 "[ . 1 . 2]" 1
1059 1 69 ILE H 1 69 ILE HG12 . . 4.630 4.099 2.574 4.375 . 0 0 "[ . 1 . 2]" 1
1060 1 69 ILE H 1 69 ILE HG13 . . 4.400 4.221 2.640 4.539 0.139 9 0 "[ . 1 . 2]" 1
1061 1 69 ILE H 1 69 ILE MG . . 4.740 2.331 1.825 3.843 . 0 0 "[ . 1 . 2]" 1
1062 1 69 ILE H 1 79 TRP H . . 4.380 4.226 3.529 4.530 0.150 3 0 "[ . 1 . 2]" 1
1063 1 69 ILE HA 1 69 ILE MD . . 4.180 3.737 2.113 3.859 . 0 0 "[ . 1 . 2]" 1
1064 1 69 ILE HA 1 69 ILE HG12 . . 4.110 3.089 2.493 3.373 . 0 0 "[ . 1 . 2]" 1
1065 1 69 ILE HA 1 69 ILE MG . . 3.540 3.045 2.380 3.221 . 0 0 "[ . 1 . 2]" 1
1066 1 69 ILE HA 1 70 GLN H . . 3.240 2.136 2.032 2.258 . 0 0 "[ . 1 . 2]" 1
1067 1 69 ILE HB 1 70 GLN H . . 4.620 4.060 3.842 4.248 . 0 0 "[ . 1 . 2]" 1
1068 1 69 ILE MD 1 69 ILE MG . . 2.510 1.906 1.786 2.049 . 0 0 "[ . 1 . 2]" 1
1069 1 69 ILE MD 1 70 GLN H . . 4.600 4.310 3.665 4.745 0.145 7 0 "[ . 1 . 2]" 1
1070 1 69 ILE MD 1 79 TRP QB . . 5.000 4.532 3.891 5.187 0.187 10 0 "[ . 1 . 2]" 1
1071 1 69 ILE HG12 1 70 GLN H . . 5.290 3.305 2.666 5.093 . 0 0 "[ . 1 . 2]" 1
1072 1 69 ILE HG12 1 79 TRP HE1 . . 4.700 4.470 2.947 4.828 0.128 11 0 "[ . 1 . 2]" 1
1073 1 69 ILE HG13 1 70 GLN H . . 5.070 3.258 2.574 5.172 0.102 15 0 "[ . 1 . 2]" 1
1074 1 69 ILE MG 1 70 GLN H . . 4.030 3.678 2.284 4.115 0.085 8 0 "[ . 1 . 2]" 1
1075 1 69 ILE MG 1 71 ASN H . . 4.740 4.729 4.502 4.842 0.102 20 0 "[ . 1 . 2]" 1
1076 1 69 ILE MG 1 79 TRP HD1 . . 4.200 2.928 1.733 4.180 . 0 0 "[ . 1 . 2]" 1
1077 1 70 GLN H 1 70 GLN HB2 . . 4.060 3.064 2.394 3.806 . 0 0 "[ . 1 . 2]" 1
1078 1 70 GLN H 1 70 GLN HB3 . . 3.940 2.877 2.418 3.750 . 0 0 "[ . 1 . 2]" 1
1079 1 70 GLN H 1 70 GLN QG . . 4.440 3.179 1.980 4.052 . 0 0 "[ . 1 . 2]" 1
1080 1 70 GLN HA 1 71 ASN H . . 2.980 2.084 2.004 2.185 . 0 0 "[ . 1 . 2]" 1
1081 1 70 GLN HB2 1 71 ASN H . . 4.160 3.777 2.849 4.201 0.041 8 0 "[ . 1 . 2]" 1
1082 1 70 GLN HB3 1 71 ASN H . . 4.490 3.972 3.208 4.264 . 0 0 "[ . 1 . 2]" 1
1083 1 70 GLN QG 1 71 ASN H . . 4.300 3.639 2.701 4.299 . 0 0 "[ . 1 . 2]" 1
1084 1 71 ASN H 1 71 ASN HB2 . . 3.810 3.209 2.478 3.833 0.023 10 0 "[ . 1 . 2]" 1
1085 1 71 ASN H 1 71 ASN HB3 . . 3.760 2.738 2.364 3.698 . 0 0 "[ . 1 . 2]" 1
1086 1 71 ASN HA 1 72 GLU H . . 3.100 2.342 1.991 3.226 0.126 9 0 "[ . 1 . 2]" 1
1087 1 71 ASN HA 1 79 TRP HE1 . . 4.280 3.860 2.256 4.398 0.118 19 0 "[ . 1 . 2]" 1
1088 1 71 ASN HB2 1 72 GLU H . . 4.280 3.436 2.179 4.319 0.039 4 0 "[ . 1 . 2]" 1
1089 1 71 ASN HB2 1 79 TRP HE1 . . 4.910 3.439 1.897 4.950 0.040 7 0 "[ . 1 . 2]" 1
1090 1 71 ASN HB3 1 72 GLU H . . 4.120 3.840 1.910 4.241 0.121 7 0 "[ . 1 . 2]" 1
1091 1 72 GLU H 1 72 GLU HB2 . . 4.020 2.812 2.438 3.899 . 0 0 "[ . 1 . 2]" 1
1092 1 72 GLU H 1 72 GLU HB3 . . 3.600 3.178 2.388 3.679 0.079 14 0 "[ . 1 . 2]" 1
1093 1 72 GLU H 1 72 GLU QG . . 3.980 2.904 2.070 4.136 0.156 9 0 "[ . 1 . 2]" 1
1094 1 72 GLU HA 1 72 GLU QG . . 3.550 2.673 2.394 3.560 0.010 3 0 "[ . 1 . 2]" 1
1095 1 72 GLU HA 1 73 GLY H . . 3.200 2.573 2.086 3.341 0.141 9 0 "[ . 1 . 2]" 1
1096 1 72 GLU HB2 1 73 GLY H . . 4.540 3.830 2.292 4.541 0.001 1 0 "[ . 1 . 2]" 1
1097 1 72 GLU HB3 1 73 GLY H . . 4.690 3.779 2.009 4.471 . 0 0 "[ . 1 . 2]" 1
1098 1 72 GLU QG 1 73 GLY H . . 4.840 3.776 2.541 4.640 . 0 0 "[ . 1 . 2]" 1
1099 1 73 GLY HA2 1 74 ALA H . . 3.700 2.943 2.096 3.506 . 0 0 "[ . 1 . 2]" 1
1100 1 73 GLY HA3 1 74 ALA H . . 3.710 2.760 2.139 3.539 . 0 0 "[ . 1 . 2]" 1
1101 1 74 ALA H 1 74 ALA MB . . 3.590 2.534 2.188 2.991 . 0 0 "[ . 1 . 2]" 1
1102 1 74 ALA HA 1 75 GLY H . . 3.960 2.657 2.099 3.500 . 0 0 "[ . 1 . 2]" 1
1103 1 74 ALA MB 1 75 GLY H . . 4.620 2.850 1.832 3.544 . 0 0 "[ . 1 . 2]" 1
1104 1 75 GLY HA2 1 76 LYS H . . 4.540 2.737 2.141 3.577 . 0 0 "[ . 1 . 2]" 1
1105 1 76 LYS HA 1 76 LYS QD . . 3.440 2.513 2.001 3.580 0.140 14 0 "[ . 1 . 2]" 1
1106 1 76 LYS HA 1 76 LYS QE . . 5.070 4.033 1.753 4.560 . 0 0 "[ . 1 . 2]" 1
1107 1 76 LYS HA 1 76 LYS HG2 . . 4.210 3.425 2.261 3.798 . 0 0 "[ . 1 . 2]" 1
1108 1 76 LYS HA 1 76 LYS HG3 . . 3.780 3.156 2.518 3.834 0.054 8 0 "[ . 1 . 2]" 1
1109 1 76 LYS HA 1 77 SER H . . 3.620 3.199 2.169 3.574 . 0 0 "[ . 1 . 2]" 1
1110 1 76 LYS HB2 1 76 LYS QD . . 3.420 2.772 2.300 3.442 0.022 8 0 "[ . 1 . 2]" 1
1111 1 76 LYS HB2 1 77 SER H . . 4.230 3.080 1.823 4.304 0.074 13 0 "[ . 1 . 2]" 1
1112 1 76 LYS HB2 1 78 SER H . . 5.500 5.084 3.653 5.596 0.096 7 0 "[ . 1 . 2]" 1
1113 1 76 LYS HB3 1 76 LYS QD . . 3.430 2.904 2.092 3.360 . 0 0 "[ . 1 . 2]" 1
1114 1 76 LYS HB3 1 78 SER H . . 5.440 4.652 2.685 5.504 0.064 9 0 "[ . 1 . 2]" 1
1115 1 76 LYS QD 1 76 LYS HG2 . . 2.740 2.344 2.221 2.422 . 0 0 "[ . 1 . 2]" 1
1116 1 77 SER H 1 77 SER QB . . 3.800 2.804 2.315 3.382 . 0 0 "[ . 1 . 2]" 1
1117 1 77 SER HA 1 78 SER H . . 3.780 2.550 2.085 3.610 . 0 0 "[ . 1 . 2]" 1
1118 1 77 SER QB 1 78 SER H . . 4.180 3.616 1.950 4.062 . 0 0 "[ . 1 . 2]" 1
1119 1 79 TRP H 1 79 TRP HD1 . . 4.120 3.311 2.471 4.444 0.324 11 0 "[ . 1 . 2]" 1
1120 1 79 TRP QB 1 79 TRP HD1 . . 3.590 2.745 2.278 3.245 . 0 0 "[ . 1 . 2]" 1
1121 1 80 TRP HA 1 81 VAL H . . 3.900 2.347 2.138 2.517 . 0 0 "[ . 1 . 2]" 1
1122 1 80 TRP QB 1 80 TRP HD1 . . 3.530 2.502 2.257 2.652 . 0 0 "[ . 1 . 2]" 1
1123 1 80 TRP QB 1 80 TRP HZ3 . . 4.870 4.742 4.632 4.890 0.020 4 0 "[ . 1 . 2]" 1
1124 1 80 TRP QB 1 81 VAL H . . 4.470 2.929 2.399 3.848 . 0 0 "[ . 1 . 2]" 1
1125 1 81 VAL H 1 81 VAL MG1 . . 4.210 3.090 2.952 3.209 . 0 0 "[ . 1 . 2]" 1
1126 1 81 VAL H 1 81 VAL MG2 . . 3.630 2.318 2.155 2.411 . 0 0 "[ . 1 . 2]" 1
1127 1 81 VAL HA 1 81 VAL MG1 . . 3.460 2.376 2.325 2.415 . 0 0 "[ . 1 . 2]" 1
1128 1 81 VAL HA 1 81 VAL MG2 . . 3.380 3.232 3.219 3.241 . 0 0 "[ . 1 . 2]" 1
1129 1 81 VAL HA 1 82 ILE H . . 3.470 2.350 2.142 2.415 . 0 0 "[ . 1 . 2]" 1
1130 1 81 VAL HB 1 82 ILE H . . 3.510 2.513 2.375 2.935 . 0 0 "[ . 1 . 2]" 1
1131 1 81 VAL MG1 1 81 VAL MG2 . . 2.650 2.078 2.059 2.087 . 0 0 "[ . 1 . 2]" 1
1132 1 81 VAL MG1 1 82 ILE H . . 4.200 3.682 3.568 3.750 . 0 0 "[ . 1 . 2]" 1
1133 1 81 VAL MG2 1 82 ILE H . . 4.090 3.523 3.372 3.873 . 0 0 "[ . 1 . 2]" 1
1134 1 81 VAL MG2 1 84 PRO HD3 . . 5.050 4.023 2.848 4.661 . 0 0 "[ . 1 . 2]" 1
1135 1 82 ILE H 1 82 ILE HB . . 3.350 2.507 2.363 2.592 . 0 0 "[ . 1 . 2]" 1
1136 1 82 ILE H 1 82 ILE HG12 . . 3.950 3.603 3.361 3.795 . 0 0 "[ . 1 . 2]" 1
1137 1 82 ILE H 1 82 ILE HG13 . . 4.180 2.415 2.141 2.635 . 0 0 "[ . 1 . 2]" 1
1138 1 82 ILE HA 1 82 ILE MD . . 4.050 3.844 3.777 3.906 . 0 0 "[ . 1 . 2]" 1
1139 1 82 ILE HA 1 82 ILE HG12 . . 4.160 2.523 2.422 2.650 . 0 0 "[ . 1 . 2]" 1
1140 1 82 ILE HA 1 82 ILE HG13 . . 3.530 3.041 2.889 3.174 . 0 0 "[ . 1 . 2]" 1
1141 1 82 ILE HA 1 82 ILE MG . . 3.580 2.449 2.334 2.542 . 0 0 "[ . 1 . 2]" 1
1142 1 82 ILE HA 1 83 ASN H . . 3.540 2.121 1.962 2.274 . 0 0 "[ . 1 . 2]" 1
1143 1 82 ILE HB 1 82 ILE MD . . 3.150 2.461 2.426 2.497 . 0 0 "[ . 1 . 2]" 1
1144 1 82 ILE HB 1 82 ILE HG12 . . 3.010 3.020 3.012 3.027 0.017 20 0 "[ . 1 . 2]" 1
1145 1 82 ILE HB 1 83 ASN H . . 5.050 4.121 4.000 4.272 . 0 0 "[ . 1 . 2]" 1
1146 1 82 ILE MD 1 82 ILE MG . . 2.570 1.944 1.913 1.982 . 0 0 "[ . 1 . 2]" 1
1147 1 82 ILE HG12 1 82 ILE MG . . 3.260 2.399 2.355 2.480 . 0 0 "[ . 1 . 2]" 1
1148 1 82 ILE HG13 1 82 ILE MG . . 3.560 3.210 3.190 3.219 . 0 0 "[ . 1 . 2]" 1
1149 1 82 ILE HG13 1 83 ASN H . . 5.110 4.995 4.773 5.151 0.041 10 0 "[ . 1 . 2]" 1
1150 1 82 ILE MG 1 83 ASN H . . 3.630 2.598 2.381 2.879 . 0 0 "[ . 1 . 2]" 1
1151 1 83 ASN H 1 83 ASN HB2 . . 3.750 2.875 2.448 3.730 . 0 0 "[ . 1 . 2]" 1
1152 1 83 ASN H 1 83 ASN HB3 . . 4.120 2.410 2.149 2.740 . 0 0 "[ . 1 . 2]" 1
1153 1 83 ASN H 1 86 ALA MB . . 4.170 3.949 3.429 4.340 0.170 10 0 "[ . 1 . 2]" 1
1154 1 83 ASN HA 1 84 PRO HD2 . . 3.310 2.082 1.963 2.179 . 0 0 "[ . 1 . 2]" 1
1155 1 83 ASN HA 1 84 PRO HD3 . . 3.460 2.349 2.120 2.491 . 0 0 "[ . 1 . 2]" 1
1156 1 83 ASN HA 1 85 ASP H . . 4.470 3.719 3.450 4.027 . 0 0 "[ . 1 . 2]" 1
1157 1 83 ASN HA 1 86 ALA H . . 4.810 4.568 4.318 4.814 0.004 9 0 "[ . 1 . 2]" 1
1158 1 83 ASN HB2 1 83 ASN HD22 . . 4.290 3.691 3.368 3.989 . 0 0 "[ . 1 . 2]" 1
1159 1 83 ASN HB2 1 84 PRO HD2 . . 4.130 3.692 2.757 4.159 0.029 14 0 "[ . 1 . 2]" 1
1160 1 83 ASN HB2 1 86 ALA MB . . 3.740 3.735 3.318 3.903 0.163 9 0 "[ . 1 . 2]" 1
1161 1 83 ASN HB3 1 83 ASN HD22 . . 4.140 3.558 3.414 3.805 . 0 0 "[ . 1 . 2]" 1
1162 1 83 ASN HB3 1 84 PRO HD2 . . 4.470 4.298 3.670 4.511 0.041 7 0 "[ . 1 . 2]" 1
1163 1 83 ASN HB3 1 86 ALA MB . . 4.320 2.814 2.036 4.355 0.035 5 0 "[ . 1 . 2]" 1
1164 1 83 ASN HD21 1 86 ALA HA . . 5.150 4.589 3.476 5.324 0.174 5 0 "[ . 1 . 2]" 1
1165 1 83 ASN HD21 1 86 ALA MB . . 4.060 2.290 1.570 3.089 . 0 0 "[ . 1 . 2]" 1
1166 1 83 ASN HD22 1 85 ASP H . . 4.890 4.036 3.177 4.994 0.104 5 0 "[ . 1 . 2]" 1
1167 1 83 ASN HD22 1 86 ALA MB . . 4.790 2.506 1.626 3.291 . 0 0 "[ . 1 . 2]" 1
1168 1 84 PRO HA 1 84 PRO HD2 . . 4.430 4.094 4.077 4.119 . 0 0 "[ . 1 . 2]" 1
1169 1 84 PRO HA 1 85 ASP H . . 3.920 3.426 3.303 3.507 . 0 0 "[ . 1 . 2]" 1
1170 1 84 PRO HA 1 86 ALA H . . 4.880 3.722 3.384 4.195 . 0 0 "[ . 1 . 2]" 1
1171 1 84 PRO HA 1 87 LYS H . . 4.510 3.827 3.334 4.538 0.028 10 0 "[ . 1 . 2]" 1
1172 1 84 PRO HA 1 87 LYS HG2 . . 4.420 3.318 2.206 4.473 0.053 3 0 "[ . 1 . 2]" 1
1173 1 84 PRO HA 1 87 LYS HG3 . . 4.680 2.954 1.939 4.753 0.073 11 0 "[ . 1 . 2]" 1
1174 1 84 PRO HB2 1 84 PRO HD2 . . 4.150 4.038 4.012 4.055 . 0 0 "[ . 1 . 2]" 1
1175 1 84 PRO HB2 1 84 PRO HD3 . . 4.190 3.913 3.867 3.954 . 0 0 "[ . 1 . 2]" 1
1176 1 84 PRO HB2 1 85 ASP H . . 4.810 3.552 3.372 3.791 . 0 0 "[ . 1 . 2]" 1
1177 1 84 PRO HB3 1 84 PRO HD3 . . 3.440 2.979 2.904 3.044 . 0 0 "[ . 1 . 2]" 1
1178 1 84 PRO HB3 1 85 ASP H . . 4.910 4.271 4.182 4.390 . 0 0 "[ . 1 . 2]" 1
1179 1 84 PRO HD2 1 85 ASP H . . 4.020 2.783 2.404 3.065 . 0 0 "[ . 1 . 2]" 1
1180 1 84 PRO HD3 1 85 ASP H . . 4.660 3.903 3.678 4.102 . 0 0 "[ . 1 . 2]" 1
1181 1 84 PRO QG 1 85 ASP H . . 3.900 2.716 2.487 3.023 . 0 0 "[ . 1 . 2]" 1
1182 1 85 ASP H 1 85 ASP HB2 . . 4.090 2.639 2.426 2.859 . 0 0 "[ . 1 . 2]" 1
1183 1 85 ASP H 1 85 ASP HB3 . . 3.610 2.773 2.348 3.637 0.027 15 0 "[ . 1 . 2]" 1
1184 1 85 ASP H 1 86 ALA H . . 3.810 2.367 2.095 2.515 . 0 0 "[ . 1 . 2]" 1
1185 1 85 ASP HA 1 86 ALA H . . 3.910 3.343 3.198 3.467 . 0 0 "[ . 1 . 2]" 1
1186 1 85 ASP HB2 1 86 ALA H . . 5.060 3.991 3.058 4.356 . 0 0 "[ . 1 . 2]" 1
1187 1 85 ASP HB3 1 86 ALA H . . 4.860 3.529 3.150 4.287 . 0 0 "[ . 1 . 2]" 1
1188 1 86 ALA H 1 86 ALA MB . . 3.310 2.372 2.227 2.567 . 0 0 "[ . 1 . 2]" 1
1189 1 86 ALA H 1 87 LYS H . . 4.090 2.348 1.917 3.271 . 0 0 "[ . 1 . 2]" 1
1190 1 86 ALA HA 1 87 LYS H . . 3.190 3.126 2.445 3.388 0.198 7 0 "[ . 1 . 2]" 1
1191 1 86 ALA MB 1 87 LYS H . . 4.000 3.268 2.039 3.684 . 0 0 "[ . 1 . 2]" 1
1192 1 87 LYS H 1 87 LYS HB2 . . 4.160 3.398 2.426 3.959 . 0 0 "[ . 1 . 2]" 1
1193 1 87 LYS H 1 87 LYS HB3 . . 3.730 3.227 2.605 3.696 . 0 0 "[ . 1 . 2]" 1
1194 1 87 LYS H 1 87 LYS HG2 . . 4.330 3.580 2.248 4.347 0.017 3 0 "[ . 1 . 2]" 1
1195 1 87 LYS H 1 87 LYS HG3 . . 5.430 2.763 2.024 4.570 . 0 0 "[ . 1 . 2]" 1
1196 1 87 LYS HA 1 87 LYS HG3 . . 4.510 3.659 2.554 3.856 . 0 0 "[ . 1 . 2]" 1
1197 1 87 LYS HA 1 88 PRO HD2 . . 3.710 2.697 2.007 3.862 0.152 11 0 "[ . 1 . 2]" 1
1198 1 87 LYS HA 1 88 PRO HD3 . . 3.770 2.268 1.919 3.869 0.099 3 0 "[ . 1 . 2]" 1
1199 1 87 LYS HB2 1 87 LYS QD . . 3.080 2.604 2.288 3.303 0.223 10 0 "[ . 1 . 2]" 1
1200 1 87 LYS HB2 1 87 LYS QE . . 4.120 3.726 1.977 4.170 0.050 11 0 "[ . 1 . 2]" 1
1201 1 87 LYS HB2 1 87 LYS HG2 . . 2.990 2.516 2.222 2.992 0.002 4 0 "[ . 1 . 2]" 1
1202 1 87 LYS HB3 1 87 LYS HG2 . . 2.790 2.495 2.343 2.940 0.150 10 0 "[ . 1 . 2]" 1
1203 1 87 LYS HB3 1 87 LYS HG3 . . 2.620 2.541 2.357 2.880 0.260 4 0 "[ . 1 . 2]" 1
1204 1 88 PRO HA 1 88 PRO HD2 . . 4.540 3.997 3.889 4.112 . 0 0 "[ . 1 . 2]" 1
1205 1 88 PRO HA 1 89 GLY H . . 3.430 2.615 2.138 3.516 0.086 18 0 "[ . 1 . 2]" 1
1206 1 88 PRO HB2 1 88 PRO QG . . 2.400 2.212 2.176 2.266 . 0 0 "[ . 1 . 2]" 1
1207 1 88 PRO HB3 1 88 PRO HD2 . . 4.010 3.899 3.845 4.016 0.006 3 0 "[ . 1 . 2]" 1
1208 1 88 PRO HB3 1 88 PRO HD3 . . 4.180 3.548 2.943 4.051 . 0 0 "[ . 1 . 2]" 1
1209 1 88 PRO HB3 1 88 PRO QG . . 2.400 2.210 2.170 2.253 . 0 0 "[ . 1 . 2]" 1
1210 1 89 GLY QA 1 90 ARG H . . 3.600 2.400 2.084 2.891 . 0 0 "[ . 1 . 2]" 1
1211 1 90 ARG H 1 90 ARG QG . . 4.980 3.165 1.932 4.246 . 0 0 "[ . 1 . 2]" 1
1212 1 90 ARG HA 1 90 ARG QD . . 4.300 3.849 2.119 4.347 0.047 10 0 "[ . 1 . 2]" 1
1213 1 90 ARG HA 1 90 ARG QG . . 3.930 2.720 2.362 3.533 . 0 0 "[ . 1 . 2]" 1
1214 1 90 ARG HA 1 91 ASN H . . 4.580 2.398 2.079 3.507 . 0 0 "[ . 1 . 2]" 1
1215 1 90 ARG QB 1 90 ARG QG . . 2.400 2.066 1.995 2.091 . 0 0 "[ . 1 . 2]" 1
1216 1 92 PRO HA 1 92 PRO QD . . 4.240 3.410 3.196 3.506 . 0 0 "[ . 1 . 2]" 1
1217 1 92 PRO HA 1 93 ARG H . . 3.360 2.269 2.110 3.417 0.057 3 0 "[ . 1 . 2]" 1
1218 1 92 PRO HB2 1 92 PRO QD . . 3.840 3.274 2.840 3.551 . 0 0 "[ . 1 . 2]" 1
1219 1 92 PRO HB3 1 92 PRO QD . . 3.760 3.194 2.848 3.530 . 0 0 "[ . 1 . 2]" 1
1220 1 92 PRO HB3 1 93 ARG H . . 4.870 3.821 2.936 4.296 . 0 0 "[ . 1 . 2]" 1
1221 1 92 PRO QD 1 93 ARG H . . 5.040 4.714 2.922 4.980 . 0 0 "[ . 1 . 2]" 1
1222 1 93 ARG HA 1 93 ARG QD . . 4.590 3.860 2.114 4.561 . 0 0 "[ . 1 . 2]" 1
1223 1 93 ARG QG 1 94 ARG H . . 4.520 3.809 1.869 4.659 0.139 12 0 "[ . 1 . 2]" 1
1224 1 94 ARG HA 1 95 GLN H . . 4.020 2.344 2.049 3.485 . 0 0 "[ . 1 . 2]" 1
1225 1 94 ARG HB2 1 94 ARG QG . . 2.400 2.315 2.155 2.387 . 0 0 "[ . 1 . 2]" 1
1226 1 94 ARG HB3 1 94 ARG QD . . 3.670 2.760 2.336 3.509 . 0 0 "[ . 1 . 2]" 1
1227 1 94 ARG HB3 1 94 ARG QG . . 2.400 2.301 2.168 2.408 0.008 18 0 "[ . 1 . 2]" 1
1228 1 95 GLN HA 1 96 ARG H . . 3.790 2.552 2.029 3.550 . 0 0 "[ . 1 . 2]" 1
1229 1 95 GLN HA 1 97 SER H . . 4.630 3.936 2.805 4.729 0.099 5 0 "[ . 1 . 2]" 1
1230 1 95 GLN HB3 1 95 GLN QG . . 2.780 2.317 2.172 2.406 . 0 0 "[ . 1 . 2]" 1
1231 1 98 ALA HA 1 99 THR H . . 3.910 2.606 2.086 3.555 . 0 0 "[ . 1 . 2]" 1
1232 1 98 ALA MB 1 99 THR H . . 4.990 2.906 1.941 3.606 . 0 0 "[ . 1 . 2]" 1
1233 1 99 THR HA 1 99 THR HB . . 2.960 2.755 2.403 3.037 0.077 2 0 "[ . 1 . 2]" 1
1234 1 99 THR HA 1 100 LEU H . . 3.880 2.328 2.063 3.541 . 0 0 "[ . 1 . 2]" 1
1235 1 100 LEU HA 1 101 GLU H . . 4.370 2.565 2.058 3.574 . 0 0 "[ . 1 . 2]" 1
1236 1 100 LEU QB 1 100 LEU MD1 . . 2.530 2.193 2.062 2.375 . 0 0 "[ . 1 . 2]" 1
1237 1 100 LEU MD1 1 100 LEU MD2 . . 2.400 2.074 2.045 2.096 . 0 0 "[ . 1 . 2]" 1
1238 1 101 GLU HB2 1 101 GLU QG . . 2.660 2.321 2.155 2.372 . 0 0 "[ . 1 . 2]" 1
1239 1 101 GLU HB3 1 101 GLU QG . . 2.760 2.301 2.160 2.398 . 0 0 "[ . 1 . 2]" 1
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