NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
650695 |
6y96   |
34498 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6y96
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 1812
_Distance_constraint_stats_list.Viol_count 3169
_Distance_constraint_stats_list.Viol_total 3923.768
_Distance_constraint_stats_list.Viol_max 1.346
_Distance_constraint_stats_list.Viol_rms 0.0251
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0054
_Distance_constraint_stats_list.Viol_average_violations_only 0.0619
_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 3 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 LEU 0.539 0.199 11 0 "[ . 1 . 2]"
1 7 VAL 1.537 0.199 11 0 "[ . 1 . 2]"
1 8 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 PHE 3.488 0.197 16 0 "[ . 1 . 2]"
1 10 ARG 4.524 0.268 5 0 "[ . 1 . 2]"
1 11 ILE 3.880 0.314 20 0 "[ . 1 . 2]"
1 12 ASP 1.965 0.314 20 0 "[ . 1 . 2]"
1 13 GLU 2.501 0.198 20 0 "[ . 1 . 2]"
1 14 SER 2.616 0.241 19 0 "[ . 1 . 2]"
1 15 GLY 0.195 0.156 1 0 "[ . 1 . 2]"
1 16 ARG 1.149 0.156 1 0 "[ . 1 . 2]"
1 17 ALA 1.115 0.157 2 0 "[ . 1 . 2]"
1 18 ALA 0.065 0.020 4 0 "[ . 1 . 2]"
1 19 CYS 0.065 0.020 4 0 "[ . 1 . 2]"
1 20 VAL 0.816 0.157 2 0 "[ . 1 . 2]"
1 21 ASN 0.087 0.087 9 0 "[ . 1 . 2]"
1 22 ALA 0.733 0.119 17 0 "[ . 1 . 2]"
1 23 VAL 1.097 0.221 12 0 "[ . 1 . 2]"
1 24 ARG 2.072 0.221 12 0 "[ . 1 . 2]"
1 25 GLN 2.187 0.231 18 0 "[ . 1 . 2]"
1 26 LYS 2.648 0.195 1 0 "[ . 1 . 2]"
1 27 LYS 8.696 0.226 4 0 "[ . 1 . 2]"
1 28 ARG 3.464 0.216 6 0 "[ . 1 . 2]"
1 29 ALA 3.189 0.154 12 0 "[ . 1 . 2]"
1 30 THR 7.249 0.125 4 0 "[ . 1 . 2]"
1 31 VAL 4.930 0.194 16 0 "[ . 1 . 2]"
1 32 ASP 2.485 0.138 6 0 "[ . 1 . 2]"
1 33 SER 5.014 0.178 2 0 "[ . 1 . 2]"
1 34 ILE 7.884 0.146 10 0 "[ . 1 . 2]"
1 35 LYS 4.870 0.193 16 0 "[ . 1 . 2]"
1 36 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 GLN 6.223 0.144 20 0 "[ . 1 . 2]"
1 38 PHE 10.732 0.187 1 0 "[ . 1 . 2]"
1 39 GLY 1.720 0.089 19 0 "[ . 1 . 2]"
1 40 PHE 7.085 0.161 16 0 "[ . 1 . 2]"
1 41 LEU 10.091 0.293 16 0 "[ . 1 . 2]"
1 42 ASN 0.852 0.154 12 0 "[ . 1 . 2]"
1 43 PHE 6.777 0.164 14 0 "[ . 1 . 2]"
1 44 GLU 4.406 0.266 12 0 "[ . 1 . 2]"
1 45 VAL 5.291 0.351 18 0 "[ . 1 . 2]"
1 46 GLU 7.566 1.346 17 1 "[ . 1 . + 2]"
1 47 ASP 4.807 0.194 16 0 "[ . 1 . 2]"
1 48 GLY 3.755 0.351 18 0 "[ . 1 . 2]"
1 49 LYS 12.874 1.346 17 1 "[ . 1 . + 2]"
1 50 LYS 2.852 0.138 6 0 "[ . 1 . 2]"
1 51 LEU 6.730 0.136 6 0 "[ . 1 . 2]"
1 52 PHE 1.616 0.095 15 0 "[ . 1 . 2]"
1 53 PHE 9.170 0.293 16 0 "[ . 1 . 2]"
1 54 HIS 5.157 0.187 1 0 "[ . 1 . 2]"
1 55 MET 6.405 0.214 13 0 "[ . 1 . 2]"
1 56 SER 0.344 0.125 15 0 "[ . 1 . 2]"
1 57 GLU 3.016 0.198 18 0 "[ . 1 . 2]"
1 58 VAL 11.061 0.244 14 0 "[ . 1 . 2]"
1 59 GLN 2.844 0.262 11 0 "[ . 1 . 2]"
1 60 GLY 0.723 0.162 11 0 "[ . 1 . 2]"
1 61 ASN 3.662 0.394 4 0 "[ . 1 . 2]"
1 62 THR 5.099 0.394 4 0 "[ . 1 . 2]"
1 63 VAL 1.125 0.290 7 0 "[ . 1 . 2]"
1 64 ALA 1.810 0.225 15 0 "[ . 1 . 2]"
1 65 LEU 12.544 0.333 11 0 "[ . 1 . 2]"
1 66 HIS 1.555 0.069 20 0 "[ . 1 . 2]"
1 67 PRO 1.499 0.093 1 0 "[ . 1 . 2]"
1 68 GLY 0.915 0.060 10 0 "[ . 1 . 2]"
1 69 ASP 1.624 0.155 11 0 "[ . 1 . 2]"
1 70 THR 5.073 0.134 12 0 "[ . 1 . 2]"
1 71 VAL 12.542 0.333 11 0 "[ . 1 . 2]"
1 72 GLU 5.765 0.324 18 0 "[ . 1 . 2]"
1 73 PHE 10.014 0.186 11 0 "[ . 1 . 2]"
1 74 SER 14.342 0.302 14 0 "[ . 1 . 2]"
1 75 VAL 2.763 0.105 1 0 "[ . 1 . 2]"
1 76 VAL 1.142 0.106 6 0 "[ . 1 . 2]"
1 77 THR 1.750 0.186 7 0 "[ . 1 . 2]"
1 78 ASN 5.541 0.309 9 0 "[ . 1 . 2]"
1 79 GLN 1.051 0.203 13 0 "[ . 1 . 2]"
1 80 ARG 1.672 0.203 13 0 "[ . 1 . 2]"
1 81 ASN 0.117 0.059 7 0 "[ . 1 . 2]"
1 82 GLY 2.506 0.186 7 0 "[ . 1 . 2]"
1 83 LYS 8.543 0.309 9 0 "[ . 1 . 2]"
1 84 SER 1.232 0.247 9 0 "[ . 1 . 2]"
1 85 SER 2.163 0.084 5 0 "[ . 1 . 2]"
1 86 ALA 8.865 0.302 14 0 "[ . 1 . 2]"
1 87 CYS 4.672 0.198 18 0 "[ . 1 . 2]"
1 88 ASN 0.337 0.195 13 0 "[ . 1 . 2]"
1 89 VAL 14.351 0.165 11 0 "[ . 1 . 2]"
1 90 LEU 8.933 0.262 16 0 "[ . 1 . 2]"
1 91 LYS 4.126 0.170 10 0 "[ . 1 . 2]"
1 92 ILE 10.405 0.216 6 0 "[ . 1 . 2]"
1 93 ASN 1.071 0.157 18 0 "[ . 1 . 2]"
1 94 ASP 0.858 0.157 18 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 3 LYS HA 1 3 LYS HG2 . . 4.210 3.007 2.321 3.803 . 0 0 "[ . 1 . 2]" 1
2 1 3 LYS HA 1 3 LYS QG . . 3.660 2.623 2.294 3.348 . 0 0 "[ . 1 . 2]" 1
3 1 3 LYS HA 1 3 LYS HG3 . . 4.210 3.187 2.380 3.858 . 0 0 "[ . 1 . 2]" 1
4 1 3 LYS HA 1 4 GLY H . . 3.300 2.333 2.131 3.005 . 0 0 "[ . 1 . 2]" 1
5 1 3 LYS QB 1 4 GLY H . . 4.310 3.452 2.207 3.997 . 0 0 "[ . 1 . 2]" 1
6 1 3 LYS HB2 1 4 GLY H . . 5.100 4.207 3.266 4.676 . 0 0 "[ . 1 . 2]" 1
7 1 3 LYS HB3 1 4 GLY H . . 5.100 3.761 2.229 4.477 . 0 0 "[ . 1 . 2]" 1
8 1 6 LEU HA 1 6 LEU QD . . 3.320 2.251 1.903 3.369 0.049 15 0 "[ . 1 . 2]" 1
9 1 6 LEU HA 1 7 VAL HB . . 5.500 4.886 4.455 5.699 0.199 11 0 "[ . 1 . 2]" 1
10 1 6 LEU QB 1 6 LEU QD . . 2.760 1.955 1.914 2.064 . 0 0 "[ . 1 . 2]" 1
11 1 6 LEU QB 1 7 VAL HA . . 5.240 4.358 3.917 4.746 . 0 0 "[ . 1 . 2]" 1
12 1 7 VAL H 1 7 VAL QG . . 4.060 2.071 1.776 2.748 . 0 0 "[ . 1 . 2]" 1
13 1 7 VAL HA 1 7 VAL QG . . 2.980 2.287 2.132 2.369 . 0 0 "[ . 1 . 2]" 1
14 1 7 VAL HA 1 9 PHE QB . . 5.500 4.985 4.335 5.584 0.084 12 0 "[ . 1 . 2]" 1
15 1 7 VAL QG 1 9 PHE H . . 3.910 2.817 1.741 3.901 . 0 0 "[ . 1 . 2]" 1
16 1 7 VAL QG 1 9 PHE QB . . 3.780 2.441 1.840 3.853 0.073 16 0 "[ . 1 . 2]" 1
17 1 7 VAL QG 1 9 PHE QD . . 4.450 2.992 1.931 3.499 . 0 0 "[ . 1 . 2]" 1
18 1 7 VAL QG 1 9 PHE QE . . 4.800 4.331 2.717 4.934 0.134 9 0 "[ . 1 . 2]" 1
19 1 8 SER H 1 9 PHE H . . 4.270 3.524 2.443 4.187 . 0 0 "[ . 1 . 2]" 1
20 1 9 PHE H 1 9 PHE QB . . 3.340 2.648 2.219 3.014 . 0 0 "[ . 1 . 2]" 1
21 1 9 PHE H 1 10 ARG HG2 . . 5.500 5.131 4.271 5.623 0.123 9 0 "[ . 1 . 2]" 1
22 1 9 PHE H 1 10 ARG HG3 . . 5.500 4.672 2.968 5.607 0.107 12 0 "[ . 1 . 2]" 1
23 1 9 PHE HA 1 10 ARG QB . . 5.340 4.943 4.621 5.361 0.021 17 0 "[ . 1 . 2]" 1
24 1 9 PHE QB 1 10 ARG HA . . 4.770 4.577 4.239 4.819 0.049 3 0 "[ . 1 . 2]" 1
25 1 9 PHE QB 1 10 ARG QB . . 4.300 4.106 3.621 4.497 0.197 16 0 "[ . 1 . 2]" 1
26 1 9 PHE QB 1 10 ARG HG2 . . 5.300 4.101 3.389 5.362 0.062 18 0 "[ . 1 . 2]" 1
27 1 9 PHE QB 1 10 ARG QG . . 4.610 3.513 2.709 4.645 0.035 18 0 "[ . 1 . 2]" 1
28 1 9 PHE QB 1 10 ARG HG3 . . 5.300 4.199 2.768 5.344 0.044 12 0 "[ . 1 . 2]" 1
29 1 9 PHE QD 1 10 ARG HG2 . . 5.110 2.896 2.099 4.097 . 0 0 "[ . 1 . 2]" 1
30 1 9 PHE QD 1 10 ARG QG . . 4.310 2.706 1.972 3.756 . 0 0 "[ . 1 . 2]" 1
31 1 9 PHE QD 1 10 ARG HG3 . . 5.110 3.518 2.393 4.453 . 0 0 "[ . 1 . 2]" 1
32 1 9 PHE QE 1 10 ARG HG2 . . 5.500 3.925 2.580 5.111 . 0 0 "[ . 1 . 2]" 1
33 1 9 PHE QE 1 10 ARG HG3 . . 5.500 4.619 3.028 5.641 0.141 7 0 "[ . 1 . 2]" 1
34 1 10 ARG H 1 10 ARG HG2 . . 5.350 3.728 2.893 4.343 . 0 0 "[ . 1 . 2]" 1
35 1 10 ARG H 1 10 ARG QG . . 4.680 2.821 1.760 4.049 . 0 0 "[ . 1 . 2]" 1
36 1 10 ARG H 1 10 ARG HG3 . . 5.350 3.280 1.767 4.839 . 0 0 "[ . 1 . 2]" 1
37 1 10 ARG HA 1 10 ARG HD2 . . 4.950 3.771 1.977 5.218 0.268 5 0 "[ . 1 . 2]" 1
38 1 10 ARG HA 1 10 ARG QD . . 4.070 3.074 1.731 3.963 . 0 0 "[ . 1 . 2]" 1
39 1 10 ARG HA 1 10 ARG HD3 . . 4.950 3.561 1.746 4.797 . 0 0 "[ . 1 . 2]" 1
40 1 10 ARG QB 1 10 ARG QD . . 2.880 2.299 2.107 2.674 . 0 0 "[ . 1 . 2]" 1
41 1 10 ARG QD 1 11 ILE HA . . 4.900 4.145 3.096 5.079 0.179 15 0 "[ . 1 . 2]" 1
42 1 10 ARG QD 1 11 ILE MG . . 5.340 5.153 4.417 5.558 0.218 12 0 "[ . 1 . 2]" 1
43 1 10 ARG HD2 1 11 ILE MD . . 5.500 4.251 2.213 5.536 0.036 2 0 "[ . 1 . 2]" 1
44 1 10 ARG HD3 1 11 ILE MD . . 5.500 4.573 2.295 5.574 0.074 20 0 "[ . 1 . 2]" 1
45 1 11 ILE HA 1 11 ILE MD . . 3.920 2.723 2.077 3.897 . 0 0 "[ . 1 . 2]" 1
46 1 11 ILE HA 1 11 ILE QG . . 3.710 2.767 2.359 3.058 . 0 0 "[ . 1 . 2]" 1
47 1 11 ILE HA 1 11 ILE MG . . 3.050 2.350 2.164 2.452 . 0 0 "[ . 1 . 2]" 1
48 1 11 ILE HA 1 12 ASP H . . 3.460 2.195 2.098 2.351 . 0 0 "[ . 1 . 2]" 1
49 1 11 ILE HA 1 12 ASP HA . . 4.890 4.339 4.260 4.422 . 0 0 "[ . 1 . 2]" 1
50 1 11 ILE HA 1 12 ASP QB . . 5.500 4.380 4.060 4.603 . 0 0 "[ . 1 . 2]" 1
51 1 11 ILE HA 1 13 GLU QG . . 5.440 4.281 3.400 4.873 . 0 0 "[ . 1 . 2]" 1
52 1 11 ILE HA 1 14 SER QB . . 4.840 4.731 4.266 4.987 0.147 9 0 "[ . 1 . 2]" 1
53 1 11 ILE HB 1 11 ILE MD . . 3.490 2.831 2.292 3.245 . 0 0 "[ . 1 . 2]" 1
54 1 11 ILE QG 1 11 ILE MG . . 3.320 2.221 2.056 2.340 . 0 0 "[ . 1 . 2]" 1
55 1 11 ILE QG 1 14 SER QB . . 4.790 4.247 2.895 4.832 0.042 13 0 "[ . 1 . 2]" 1
56 1 11 ILE HG12 1 13 GLU QG . . 5.500 5.023 3.792 5.640 0.140 18 0 "[ . 1 . 2]" 1
57 1 11 ILE HG12 1 14 SER QB . . 5.500 4.640 2.966 5.578 0.078 13 0 "[ . 1 . 2]" 1
58 1 11 ILE HG13 1 13 GLU QG . . 5.500 4.739 4.033 5.532 0.032 15 0 "[ . 1 . 2]" 1
59 1 11 ILE HG13 1 14 SER QB . . 5.500 4.989 3.959 5.601 0.101 7 0 "[ . 1 . 2]" 1
60 1 11 ILE MG 1 12 ASP H . . 4.340 2.555 1.967 3.092 . 0 0 "[ . 1 . 2]" 1
61 1 11 ILE MG 1 12 ASP HA . . 5.500 4.061 3.564 4.371 . 0 0 "[ . 1 . 2]" 1
62 1 11 ILE MG 1 12 ASP QB . . 4.260 3.927 3.127 4.574 0.314 20 0 "[ . 1 . 2]" 1
63 1 11 ILE MG 1 13 GLU HA . . 4.430 4.281 3.756 4.585 0.155 7 0 "[ . 1 . 2]" 1
64 1 11 ILE MG 1 13 GLU QB . . 4.080 3.455 2.442 3.988 . 0 0 "[ . 1 . 2]" 1
65 1 11 ILE MG 1 13 GLU QG . . 3.230 1.933 1.757 2.283 . 0 0 "[ . 1 . 2]" 1
66 1 11 ILE MG 1 14 SER QB . . 4.330 3.212 2.087 4.269 . 0 0 "[ . 1 . 2]" 1
67 1 12 ASP H 1 12 ASP QB . . 3.740 2.459 2.223 3.065 . 0 0 "[ . 1 . 2]" 1
68 1 12 ASP HA 1 13 GLU QG . . 5.350 5.015 4.497 5.369 0.019 14 0 "[ . 1 . 2]" 1
69 1 12 ASP HA 1 90 LEU QD . . 5.200 4.454 3.819 5.196 . 0 0 "[ . 1 . 2]" 1
70 1 12 ASP QB 1 13 GLU H . . 4.340 2.839 2.351 3.724 . 0 0 "[ . 1 . 2]" 1
71 1 12 ASP QB 1 13 GLU QG . . 5.210 4.199 2.727 5.208 . 0 0 "[ . 1 . 2]" 1
72 1 12 ASP QB 1 14 SER QB . . 5.500 5.469 4.998 5.741 0.241 19 0 "[ . 1 . 2]" 1
73 1 13 GLU HA 1 13 GLU QG . . 3.370 3.293 2.635 3.460 0.090 9 0 "[ . 1 . 2]" 1
74 1 13 GLU HA 1 90 LEU QD . . 4.460 3.375 1.725 4.594 0.134 6 0 "[ . 1 . 2]" 1
75 1 13 GLU QB 1 14 SER HA . . 5.500 4.476 3.971 4.698 . 0 0 "[ . 1 . 2]" 1
76 1 13 GLU QB 1 90 LEU HB2 . . 3.890 3.773 3.051 4.088 0.198 20 0 "[ . 1 . 2]" 1
77 1 13 GLU QB 1 90 LEU HB3 . . 4.280 3.389 2.204 4.160 . 0 0 "[ . 1 . 2]" 1
78 1 13 GLU QB 1 92 ILE MD . . 3.730 2.996 2.073 3.307 . 0 0 "[ . 1 . 2]" 1
79 1 13 GLU QB 1 92 ILE HG12 . . 5.310 5.151 4.113 5.442 0.132 19 0 "[ . 1 . 2]" 1
80 1 13 GLU QB 1 92 ILE HG13 . . 5.500 5.384 4.438 5.614 0.114 10 0 "[ . 1 . 2]" 1
81 1 13 GLU QG 1 14 SER HA . . 5.500 4.065 3.139 5.572 0.072 18 0 "[ . 1 . 2]" 1
82 1 13 GLU QG 1 14 SER QB . . 5.340 4.235 3.371 5.217 . 0 0 "[ . 1 . 2]" 1
83 1 13 GLU QG 1 90 LEU QD . . 5.440 3.591 1.804 4.878 . 0 0 "[ . 1 . 2]" 1
84 1 13 GLU QG 1 90 LEU HG . . 5.120 4.322 2.246 5.178 0.058 9 0 "[ . 1 . 2]" 1
85 1 14 SER HA 1 14 SER QB . . 2.560 2.376 2.190 2.454 . 0 0 "[ . 1 . 2]" 1
86 1 14 SER QB 1 15 GLY H . . 4.170 3.152 2.646 3.647 . 0 0 "[ . 1 . 2]" 1
87 1 14 SER QB 1 16 ARG QB . . 5.500 4.855 3.227 5.544 0.044 19 0 "[ . 1 . 2]" 1
88 1 14 SER QB 1 16 ARG HD2 . . 5.500 4.537 3.015 5.589 0.089 17 0 "[ . 1 . 2]" 1
89 1 14 SER QB 1 16 ARG HD3 . . 5.500 4.618 3.189 5.633 0.133 10 0 "[ . 1 . 2]" 1
90 1 14 SER QB 1 16 ARG HG2 . . 5.500 4.052 2.526 5.512 0.012 1 0 "[ . 1 . 2]" 1
91 1 14 SER QB 1 16 ARG HG3 . . 5.500 4.478 2.286 5.594 0.094 18 0 "[ . 1 . 2]" 1
92 1 15 GLY QA 1 16 ARG QB . . 5.340 4.464 4.239 4.710 . 0 0 "[ . 1 . 2]" 1
93 1 15 GLY QA 1 16 ARG QG . . 4.760 4.221 3.768 4.916 0.156 1 0 "[ . 1 . 2]" 1
94 1 16 ARG H 1 16 ARG QB . . 2.950 2.467 2.078 2.786 . 0 0 "[ . 1 . 2]" 1
95 1 16 ARG H 1 16 ARG HG2 . . 4.540 2.752 1.811 4.481 . 0 0 "[ . 1 . 2]" 1
96 1 16 ARG H 1 16 ARG QG . . 3.880 2.307 1.792 3.456 . 0 0 "[ . 1 . 2]" 1
97 1 16 ARG H 1 16 ARG HG3 . . 4.540 3.114 1.994 3.771 . 0 0 "[ . 1 . 2]" 1
98 1 16 ARG HA 1 16 ARG HG2 . . 4.120 2.950 2.481 3.685 . 0 0 "[ . 1 . 2]" 1
99 1 16 ARG HA 1 16 ARG QG . . 3.330 2.759 2.153 3.339 0.009 5 0 "[ . 1 . 2]" 1
100 1 16 ARG HA 1 16 ARG HG3 . . 4.120 3.444 2.269 3.887 . 0 0 "[ . 1 . 2]" 1
101 1 16 ARG QB 1 16 ARG HD2 . . 3.890 2.974 2.159 3.425 . 0 0 "[ . 1 . 2]" 1
102 1 16 ARG QB 1 16 ARG QD . . 3.380 2.428 2.103 2.829 . 0 0 "[ . 1 . 2]" 1
103 1 16 ARG QB 1 16 ARG HD3 . . 3.890 2.817 2.242 3.503 . 0 0 "[ . 1 . 2]" 1
104 1 16 ARG QB 1 17 ALA H . . 4.010 3.282 2.529 3.791 . 0 0 "[ . 1 . 2]" 1
105 1 16 ARG QB 1 17 ALA HA . . 5.110 4.529 4.402 4.850 . 0 0 "[ . 1 . 2]" 1
106 1 16 ARG QB 1 17 ALA MB . . 4.790 4.527 3.880 4.888 0.098 1 0 "[ . 1 . 2]" 1
107 1 17 ALA H 1 17 ALA MB . . 3.610 2.251 2.205 2.297 . 0 0 "[ . 1 . 2]" 1
108 1 17 ALA HA 1 20 VAL HB . . 4.280 3.819 3.184 4.337 0.057 12 0 "[ . 1 . 2]" 1
109 1 17 ALA HA 1 20 VAL QG . . 3.550 3.527 3.252 3.707 0.157 2 0 "[ . 1 . 2]" 1
110 1 18 ALA H 1 18 ALA MB . . 3.230 2.242 2.229 2.266 . 0 0 "[ . 1 . 2]" 1
111 1 18 ALA MB 1 19 CYS H . . 4.100 2.843 2.600 3.084 . 0 0 "[ . 1 . 2]" 1
112 1 18 ALA MB 1 19 CYS HA . . 4.360 4.298 4.152 4.380 0.020 4 0 "[ . 1 . 2]" 1
113 1 19 CYS H 1 19 CYS QB . . 3.750 2.853 2.630 3.273 . 0 0 "[ . 1 . 2]" 1
114 1 19 CYS H 1 20 VAL H . . 4.640 4.203 4.135 4.354 . 0 0 "[ . 1 . 2]" 1
115 1 19 CYS QB 1 20 VAL H . . 4.090 3.419 3.089 3.742 . 0 0 "[ . 1 . 2]" 1
116 1 20 VAL H 1 20 VAL HB . . 3.760 3.458 3.288 3.559 . 0 0 "[ . 1 . 2]" 1
117 1 20 VAL H 1 20 VAL QG . . 3.160 2.593 2.401 2.642 . 0 0 "[ . 1 . 2]" 1
118 1 20 VAL H 1 21 ASN H . . 4.730 4.237 4.071 4.361 . 0 0 "[ . 1 . 2]" 1
119 1 20 VAL HA 1 20 VAL HB . . 2.810 2.473 2.428 2.531 . 0 0 "[ . 1 . 2]" 1
120 1 20 VAL HA 1 20 VAL QG . . 2.700 2.298 2.219 2.351 . 0 0 "[ . 1 . 2]" 1
121 1 20 VAL HA 1 21 ASN QB . . 5.020 4.136 3.942 4.373 . 0 0 "[ . 1 . 2]" 1
122 1 20 VAL QG 1 21 ASN HA . . 4.350 3.513 3.256 3.825 . 0 0 "[ . 1 . 2]" 1
123 1 20 VAL QG 1 21 ASN QB . . 5.340 3.767 3.393 4.146 . 0 0 "[ . 1 . 2]" 1
124 1 20 VAL QG 1 22 ALA H . . 5.080 2.813 1.615 4.604 . 0 0 "[ . 1 . 2]" 1
125 1 21 ASN HA 1 22 ALA HA . . 5.500 4.525 4.356 4.702 . 0 0 "[ . 1 . 2]" 1
126 1 21 ASN QB 1 22 ALA MB . . 4.890 3.552 3.105 4.315 . 0 0 "[ . 1 . 2]" 1
127 1 21 ASN QB 1 76 VAL QG . . 5.340 4.253 3.420 5.427 0.087 9 0 "[ . 1 . 2]" 1
128 1 22 ALA H 1 76 VAL HB . . 5.500 4.732 3.785 5.566 0.066 4 0 "[ . 1 . 2]" 1
129 1 22 ALA HA 1 23 VAL H . . 3.510 2.728 2.132 3.215 . 0 0 "[ . 1 . 2]" 1
130 1 22 ALA HA 1 23 VAL QG . . 3.800 3.410 3.245 3.576 . 0 0 "[ . 1 . 2]" 1
131 1 22 ALA HA 1 76 VAL HA . . 4.880 4.531 3.827 4.934 0.054 18 0 "[ . 1 . 2]" 1
132 1 22 ALA HA 1 76 VAL HB . . 3.600 3.119 2.096 3.644 0.044 14 0 "[ . 1 . 2]" 1
133 1 22 ALA HA 1 76 VAL QG . . 3.570 3.169 2.545 3.607 0.037 9 0 "[ . 1 . 2]" 1
134 1 22 ALA MB 1 23 VAL H . . 3.940 2.573 1.771 3.594 . 0 0 "[ . 1 . 2]" 1
135 1 22 ALA MB 1 23 VAL HA . . 5.060 4.421 3.982 4.965 . 0 0 "[ . 1 . 2]" 1
136 1 22 ALA MB 1 23 VAL HB . . 4.920 4.493 4.105 5.039 0.119 17 0 "[ . 1 . 2]" 1
137 1 22 ALA MB 1 74 SER HA . . 4.450 3.844 3.499 4.451 0.001 12 0 "[ . 1 . 2]" 1
138 1 22 ALA MB 1 74 SER HB2 . . 3.640 2.841 2.148 3.644 0.004 14 0 "[ . 1 . 2]" 1
139 1 22 ALA MB 1 74 SER HB3 . . 3.640 2.135 1.816 2.892 . 0 0 "[ . 1 . 2]" 1
140 1 22 ALA MB 1 75 VAL H . . 4.370 3.747 3.083 4.409 0.039 12 0 "[ . 1 . 2]" 1
141 1 22 ALA MB 1 76 VAL H . . 5.500 3.815 3.288 4.260 . 0 0 "[ . 1 . 2]" 1
142 1 22 ALA MB 1 76 VAL HA . . 4.090 3.301 2.828 4.025 . 0 0 "[ . 1 . 2]" 1
143 1 22 ALA MB 1 76 VAL HB . . 3.710 2.280 1.926 2.771 . 0 0 "[ . 1 . 2]" 1
144 1 22 ALA MB 1 76 VAL QG . . 3.470 2.926 2.364 3.324 . 0 0 "[ . 1 . 2]" 1
145 1 22 ALA MB 1 87 CYS H . . 5.280 4.530 3.704 5.021 . 0 0 "[ . 1 . 2]" 1
146 1 22 ALA MB 1 87 CYS QB . . 4.270 3.296 2.079 4.127 . 0 0 "[ . 1 . 2]" 1
147 1 23 VAL H 1 23 VAL HB . . 3.840 3.179 2.576 3.813 . 0 0 "[ . 1 . 2]" 1
148 1 23 VAL H 1 23 VAL QG . . 3.510 2.150 1.768 2.636 . 0 0 "[ . 1 . 2]" 1
149 1 23 VAL HA 1 23 VAL MG1 . . 3.150 2.310 2.210 2.387 . 0 0 "[ . 1 . 2]" 1
150 1 23 VAL HA 1 23 VAL QG . . 2.640 2.150 2.115 2.262 . 0 0 "[ . 1 . 2]" 1
151 1 23 VAL HA 1 23 VAL MG2 . . 3.150 2.639 2.416 3.207 0.057 18 0 "[ . 1 . 2]" 1
152 1 23 VAL HA 1 24 ARG QB . . 4.990 4.455 4.293 4.837 . 0 0 "[ . 1 . 2]" 1
153 1 23 VAL HA 1 24 ARG QG . . 4.790 3.653 3.180 5.011 0.221 12 0 "[ . 1 . 2]" 1
154 1 23 VAL HB 1 24 ARG QD . . 4.630 4.222 2.292 4.684 0.054 8 0 "[ . 1 . 2]" 1
155 1 23 VAL HB 1 24 ARG QG . . 4.020 3.754 2.333 4.085 0.065 10 0 "[ . 1 . 2]" 1
156 1 23 VAL QG 1 24 ARG QB . . 4.690 3.990 3.411 4.801 0.111 15 0 "[ . 1 . 2]" 1
157 1 23 VAL QG 1 24 ARG QD . . 5.170 3.376 2.476 4.254 . 0 0 "[ . 1 . 2]" 1
158 1 24 ARG H 1 24 ARG QG . . 4.460 2.855 1.629 3.267 . 0 0 "[ . 1 . 2]" 1
159 1 24 ARG HA 1 24 ARG QD . . 4.030 3.809 3.658 4.236 0.206 18 0 "[ . 1 . 2]" 1
160 1 24 ARG HA 1 24 ARG QG . . 3.400 3.432 3.294 3.475 0.075 20 0 "[ . 1 . 2]" 1
161 1 24 ARG HA 1 25 GLN H . . 3.480 2.935 2.551 3.468 . 0 0 "[ . 1 . 2]" 1
162 1 24 ARG HB2 1 24 ARG QD . . 3.540 2.521 2.213 3.558 0.018 12 0 "[ . 1 . 2]" 1
163 1 24 ARG HB3 1 24 ARG QD . . 3.540 3.299 2.361 3.557 0.017 20 0 "[ . 1 . 2]" 1
164 1 24 ARG QD 1 25 GLN QB . . 4.170 3.452 3.018 4.310 0.140 18 0 "[ . 1 . 2]" 1
165 1 24 ARG QD 1 25 GLN QG . . 5.270 4.972 4.581 5.339 0.069 12 0 "[ . 1 . 2]" 1
166 1 24 ARG QG 1 25 GLN H . . 4.370 4.027 2.399 4.465 0.095 16 0 "[ . 1 . 2]" 1
167 1 25 GLN H 1 25 GLN QB . . 3.830 2.419 2.237 2.585 . 0 0 "[ . 1 . 2]" 1
168 1 25 GLN H 1 25 GLN QG . . 4.460 4.121 3.966 4.235 . 0 0 "[ . 1 . 2]" 1
169 1 25 GLN HA 1 25 GLN QG . . 3.270 2.829 2.283 3.022 . 0 0 "[ . 1 . 2]" 1
170 1 25 GLN HA 1 26 LYS H . . 3.470 2.285 2.149 2.678 . 0 0 "[ . 1 . 2]" 1
171 1 25 GLN QB 1 26 LYS H . . 4.460 3.979 3.903 4.039 . 0 0 "[ . 1 . 2]" 1
172 1 25 GLN QB 1 74 SER HA . . 4.720 4.435 4.202 4.714 . 0 0 "[ . 1 . 2]" 1
173 1 25 GLN QB 1 74 SER HB2 . . 5.500 5.548 5.288 5.731 0.231 18 0 "[ . 1 . 2]" 1
174 1 25 GLN QB 1 74 SER QB . . 4.720 4.126 3.841 4.868 0.148 14 0 "[ . 1 . 2]" 1
175 1 25 GLN QB 1 74 SER HB3 . . 5.500 4.306 3.922 5.582 0.082 10 0 "[ . 1 . 2]" 1
176 1 25 GLN QG 1 27 LYS QD . . 5.090 4.193 3.606 4.665 . 0 0 "[ . 1 . 2]" 1
177 1 25 GLN QG 1 27 LYS QE . . 4.230 2.899 2.158 3.479 . 0 0 "[ . 1 . 2]" 1
178 1 25 GLN QG 1 27 LYS HG2 . . 5.500 2.902 2.518 3.292 . 0 0 "[ . 1 . 2]" 1
179 1 25 GLN QG 1 74 SER HA . . 4.970 4.415 3.995 4.921 . 0 0 "[ . 1 . 2]" 1
180 1 25 GLN QG 1 74 SER QB . . 5.340 4.986 4.487 5.398 0.058 10 0 "[ . 1 . 2]" 1
181 1 25 GLN QG 1 75 VAL QG . . 3.630 2.102 1.829 2.701 . 0 0 "[ . 1 . 2]" 1
182 1 26 LYS H 1 26 LYS QB . . 3.770 2.508 2.319 2.748 . 0 0 "[ . 1 . 2]" 1
183 1 26 LYS H 1 26 LYS QG . . 4.890 2.853 2.437 4.122 . 0 0 "[ . 1 . 2]" 1
184 1 26 LYS HA 1 26 LYS QG . . 3.400 2.454 2.302 2.610 . 0 0 "[ . 1 . 2]" 1
185 1 26 LYS HA 1 27 LYS H . . 2.880 2.107 2.055 2.157 . 0 0 "[ . 1 . 2]" 1
186 1 26 LYS HA 1 72 GLU HG3 . . 5.470 4.878 4.379 5.565 0.095 20 0 "[ . 1 . 2]" 1
187 1 26 LYS HA 1 73 PHE HA . . 5.500 5.126 4.979 5.267 . 0 0 "[ . 1 . 2]" 1
188 1 26 LYS HA 1 74 SER HA . . 3.080 2.180 1.981 2.368 . 0 0 "[ . 1 . 2]" 1
189 1 26 LYS HA 1 74 SER HB2 . . 4.730 4.458 3.250 4.798 0.068 20 0 "[ . 1 . 2]" 1
190 1 26 LYS HA 1 74 SER QB . . 3.930 3.443 3.178 3.693 . 0 0 "[ . 1 . 2]" 1
191 1 26 LYS HA 1 74 SER HB3 . . 4.730 3.741 3.323 4.764 0.034 10 0 "[ . 1 . 2]" 1
192 1 26 LYS HA 1 75 VAL H . . 4.420 3.647 3.312 3.885 . 0 0 "[ . 1 . 2]" 1
193 1 26 LYS HA 1 75 VAL QG . . 4.410 4.257 3.788 4.446 0.036 1 0 "[ . 1 . 2]" 1
194 1 26 LYS QB 1 27 LYS H . . 3.910 3.298 3.016 3.772 . 0 0 "[ . 1 . 2]" 1
195 1 26 LYS QB 1 72 GLU HG3 . . 4.150 3.245 2.477 4.215 0.065 11 0 "[ . 1 . 2]" 1
196 1 26 LYS QB 1 73 PHE H . . 4.450 3.891 3.580 4.636 0.186 11 0 "[ . 1 . 2]" 1
197 1 26 LYS QB 1 73 PHE HA . . 5.340 5.021 4.761 5.351 0.011 11 0 "[ . 1 . 2]" 1
198 1 26 LYS QB 1 74 SER H . . 5.500 5.592 5.510 5.695 0.195 1 0 "[ . 1 . 2]" 1
199 1 26 LYS QB 1 74 SER HA . . 4.840 4.089 3.839 4.218 . 0 0 "[ . 1 . 2]" 1
200 1 26 LYS QG 1 72 GLU HG3 . . 5.130 4.134 2.336 5.156 0.026 15 0 "[ . 1 . 2]" 1
201 1 26 LYS QG 1 74 SER HA . . 4.150 3.667 3.072 4.201 0.051 10 0 "[ . 1 . 2]" 1
202 1 26 LYS QG 1 74 SER QB . . 4.780 3.491 2.493 4.805 0.025 11 0 "[ . 1 . 2]" 1
203 1 27 LYS H 1 27 LYS HB2 . . 3.520 2.357 2.256 2.507 . 0 0 "[ . 1 . 2]" 1
204 1 27 LYS H 1 27 LYS HB3 . . 3.750 3.591 3.533 3.688 . 0 0 "[ . 1 . 2]" 1
205 1 27 LYS H 1 27 LYS QE . . 4.820 4.881 4.767 4.996 0.176 3 0 "[ . 1 . 2]" 1
206 1 27 LYS H 1 28 ARG HA . . 5.400 5.038 4.840 5.199 . 0 0 "[ . 1 . 2]" 1
207 1 27 LYS H 1 72 GLU HG3 . . 5.500 4.946 4.486 5.546 0.046 20 0 "[ . 1 . 2]" 1
208 1 27 LYS H 1 73 PHE QE . . 4.900 4.487 4.352 4.630 . 0 0 "[ . 1 . 2]" 1
209 1 27 LYS H 1 75 VAL HB . . 4.590 4.655 4.623 4.695 0.105 1 0 "[ . 1 . 2]" 1
210 1 27 LYS HA 1 27 LYS QD . . 3.230 1.980 1.851 2.162 . 0 0 "[ . 1 . 2]" 1
211 1 27 LYS HA 1 27 LYS QE . . 4.580 3.843 3.664 4.040 . 0 0 "[ . 1 . 2]" 1
212 1 27 LYS HA 1 27 LYS HG2 . . 3.260 2.896 2.769 3.003 . 0 0 "[ . 1 . 2]" 1
213 1 27 LYS HA 1 28 ARG H . . 2.770 2.297 2.231 2.378 . 0 0 "[ . 1 . 2]" 1
214 1 27 LYS HA 1 28 ARG HA . . 4.770 4.423 4.383 4.463 . 0 0 "[ . 1 . 2]" 1
215 1 27 LYS HA 1 43 PHE QE . . 5.500 5.169 4.822 5.421 . 0 0 "[ . 1 . 2]" 1
216 1 27 LYS HA 1 73 PHE QE . . 5.170 5.019 4.929 5.138 . 0 0 "[ . 1 . 2]" 1
217 1 27 LYS HA 1 73 PHE HZ . . 5.500 5.347 5.228 5.519 0.019 16 0 "[ . 1 . 2]" 1
218 1 27 LYS HB2 1 27 LYS HE2 . . 5.460 4.911 4.553 5.493 0.033 12 0 "[ . 1 . 2]" 1
219 1 27 LYS HB2 1 27 LYS HE3 . . 5.460 4.777 4.630 5.461 0.001 7 0 "[ . 1 . 2]" 1
220 1 27 LYS HB2 1 28 ARG H . . 4.210 3.992 3.812 4.105 . 0 0 "[ . 1 . 2]" 1
221 1 27 LYS HB2 1 29 ALA MB . . 5.500 4.944 4.795 5.070 . 0 0 "[ . 1 . 2]" 1
222 1 27 LYS HB2 1 43 PHE QE . . 5.280 4.612 4.121 4.901 . 0 0 "[ . 1 . 2]" 1
223 1 27 LYS HB2 1 73 PHE H . . 5.500 4.175 3.976 4.399 . 0 0 "[ . 1 . 2]" 1
224 1 27 LYS HB2 1 73 PHE QB . . 5.500 4.710 4.532 4.820 . 0 0 "[ . 1 . 2]" 1
225 1 27 LYS HB2 1 73 PHE QD . . 3.700 3.199 3.053 3.302 . 0 0 "[ . 1 . 2]" 1
226 1 27 LYS HB2 1 73 PHE QE . . 4.050 2.578 2.373 2.792 . 0 0 "[ . 1 . 2]" 1
227 1 27 LYS HB2 1 73 PHE HZ . . 4.700 3.486 3.389 3.582 . 0 0 "[ . 1 . 2]" 1
228 1 27 LYS HB2 1 75 VAL MG1 . . 4.940 3.407 3.129 3.661 . 0 0 "[ . 1 . 2]" 1
229 1 27 LYS HB2 1 75 VAL QG . . 3.470 3.333 3.087 3.523 0.053 20 0 "[ . 1 . 2]" 1
230 1 27 LYS HB2 1 75 VAL MG2 . . 4.940 4.759 4.584 4.896 . 0 0 "[ . 1 . 2]" 1
231 1 27 LYS HB3 1 27 LYS QD . . 3.730 2.381 2.316 2.435 . 0 0 "[ . 1 . 2]" 1
232 1 27 LYS HB3 1 27 LYS HE2 . . 5.070 4.650 4.485 4.830 . 0 0 "[ . 1 . 2]" 1
233 1 27 LYS HB3 1 27 LYS QE . . 4.320 4.016 3.894 4.201 . 0 0 "[ . 1 . 2]" 1
234 1 27 LYS HB3 1 27 LYS HE3 . . 5.070 4.402 4.186 4.796 . 0 0 "[ . 1 . 2]" 1
235 1 27 LYS HB3 1 28 ARG H . . 2.950 2.811 2.583 2.980 0.030 12 0 "[ . 1 . 2]" 1
236 1 27 LYS HB3 1 28 ARG HA . . 4.860 4.342 4.228 4.490 . 0 0 "[ . 1 . 2]" 1
237 1 27 LYS HB3 1 29 ALA MB . . 4.110 4.040 3.882 4.137 0.027 17 0 "[ . 1 . 2]" 1
238 1 27 LYS HB3 1 43 PHE HB2 . . 5.500 5.260 5.038 5.450 . 0 0 "[ . 1 . 2]" 1
239 1 27 LYS HB3 1 43 PHE QD . . 4.870 3.986 3.703 4.191 . 0 0 "[ . 1 . 2]" 1
240 1 27 LYS HB3 1 43 PHE QE . . 4.270 3.463 2.931 3.826 . 0 0 "[ . 1 . 2]" 1
241 1 27 LYS HB3 1 43 PHE HZ . . 5.240 4.527 4.208 5.032 . 0 0 "[ . 1 . 2]" 1
242 1 27 LYS HB3 1 73 PHE QD . . 4.480 4.404 4.244 4.511 0.031 8 0 "[ . 1 . 2]" 1
243 1 27 LYS HB3 1 73 PHE QE . . 4.060 3.157 3.014 3.297 . 0 0 "[ . 1 . 2]" 1
244 1 27 LYS HB3 1 73 PHE HZ . . 4.180 2.970 2.861 3.169 . 0 0 "[ . 1 . 2]" 1
245 1 27 LYS HB3 1 74 SER HA . . 5.500 5.673 5.606 5.726 0.226 4 0 "[ . 1 . 2]" 1
246 1 27 LYS HB3 1 75 VAL MG1 . . 5.500 4.262 4.019 4.475 . 0 0 "[ . 1 . 2]" 1
247 1 27 LYS HB3 1 75 VAL QG . . 4.810 4.114 3.901 4.292 . 0 0 "[ . 1 . 2]" 1
248 1 27 LYS HB3 1 75 VAL MG2 . . 5.500 5.440 5.167 5.548 0.048 19 0 "[ . 1 . 2]" 1
249 1 27 LYS QD 1 28 ARG H . . 5.500 3.217 3.005 3.358 . 0 0 "[ . 1 . 2]" 1
250 1 27 LYS QD 1 43 PHE QD . . 4.500 4.321 3.895 4.558 0.058 6 0 "[ . 1 . 2]" 1
251 1 27 LYS QD 1 43 PHE QE . . 4.240 2.552 2.151 2.918 . 0 0 "[ . 1 . 2]" 1
252 1 27 LYS QD 1 43 PHE HZ . . 3.960 3.177 2.687 3.824 . 0 0 "[ . 1 . 2]" 1
253 1 27 LYS QD 1 75 VAL QG . . 4.090 3.617 3.336 3.834 . 0 0 "[ . 1 . 2]" 1
254 1 27 LYS QE 1 27 LYS HG2 . . 3.470 2.369 2.241 2.461 . 0 0 "[ . 1 . 2]" 1
255 1 27 LYS QE 1 28 ARG H . . 5.340 5.272 4.900 5.414 0.074 17 0 "[ . 1 . 2]" 1
256 1 27 LYS QE 1 43 PHE QE . . 4.050 3.663 3.228 4.123 0.073 20 0 "[ . 1 . 2]" 1
257 1 27 LYS QE 1 43 PHE HZ . . 3.800 2.918 2.180 3.836 0.036 7 0 "[ . 1 . 2]" 1
258 1 27 LYS QE 1 75 VAL H . . 5.340 5.002 4.611 5.372 0.032 2 0 "[ . 1 . 2]" 1
259 1 27 LYS QE 1 75 VAL QG . . 3.780 2.710 2.407 3.145 . 0 0 "[ . 1 . 2]" 1
260 1 27 LYS HE2 1 43 PHE HZ . . 4.640 4.253 3.841 4.628 . 0 0 "[ . 1 . 2]" 1
261 1 27 LYS HE3 1 43 PHE HZ . . 4.640 3.088 2.191 4.407 . 0 0 "[ . 1 . 2]" 1
262 1 27 LYS HG2 1 73 PHE HZ . . 5.500 5.553 5.513 5.592 0.092 7 0 "[ . 1 . 2]" 1
263 1 27 LYS HG2 1 74 SER HA . . 4.720 4.310 4.032 4.582 . 0 0 "[ . 1 . 2]" 1
264 1 27 LYS HG3 1 43 PHE QE . . 3.840 3.359 2.849 3.702 . 0 0 "[ . 1 . 2]" 1
265 1 27 LYS HG3 1 43 PHE HZ . . 4.170 3.079 2.578 3.498 . 0 0 "[ . 1 . 2]" 1
266 1 27 LYS HG3 1 73 PHE HZ . . 5.500 4.467 4.387 4.607 . 0 0 "[ . 1 . 2]" 1
267 1 27 LYS HG3 1 75 VAL HB . . 4.630 2.891 2.469 3.267 . 0 0 "[ . 1 . 2]" 1
268 1 28 ARG H 1 28 ARG HD2 . . 5.500 5.357 5.089 5.478 . 0 0 "[ . 1 . 2]" 1
269 1 28 ARG H 1 28 ARG QG . . 3.610 3.112 2.948 3.414 . 0 0 "[ . 1 . 2]" 1
270 1 28 ARG H 1 29 ALA H . . 4.650 4.329 4.265 4.397 . 0 0 "[ . 1 . 2]" 1
271 1 28 ARG HA 1 28 ARG HD2 . . 4.410 3.867 3.210 4.189 . 0 0 "[ . 1 . 2]" 1
272 1 28 ARG HA 1 28 ARG HD3 . . 4.510 4.324 2.655 4.605 0.095 18 0 "[ . 1 . 2]" 1
273 1 28 ARG HA 1 28 ARG HG2 . . 3.370 2.344 2.244 2.600 . 0 0 "[ . 1 . 2]" 1
274 1 28 ARG HA 1 28 ARG QG . . 3.280 2.299 2.186 2.555 . 0 0 "[ . 1 . 2]" 1
275 1 28 ARG HA 1 29 ALA H . . 2.710 2.129 2.098 2.195 . 0 0 "[ . 1 . 2]" 1
276 1 28 ARG HA 1 29 ALA HA . . 4.880 4.413 4.386 4.458 . 0 0 "[ . 1 . 2]" 1
277 1 28 ARG HA 1 29 ALA MB . . 4.340 3.956 3.882 4.040 . 0 0 "[ . 1 . 2]" 1
278 1 28 ARG HA 1 71 VAL QG . . 4.560 4.065 3.665 4.307 . 0 0 "[ . 1 . 2]" 1
279 1 28 ARG HA 1 72 GLU HA . . 2.600 2.249 2.134 2.361 . 0 0 "[ . 1 . 2]" 1
280 1 28 ARG HA 1 73 PHE QD . . 4.070 3.489 3.306 3.840 . 0 0 "[ . 1 . 2]" 1
281 1 28 ARG HA 1 73 PHE QE . . 3.700 3.119 2.942 3.408 . 0 0 "[ . 1 . 2]" 1
282 1 28 ARG HA 1 73 PHE HZ . . 4.920 4.643 4.482 4.890 . 0 0 "[ . 1 . 2]" 1
283 1 28 ARG HA 1 92 ILE MD . . 5.490 5.440 5.107 5.565 0.075 17 0 "[ . 1 . 2]" 1
284 1 28 ARG HA 1 92 ILE HG13 . . 5.290 4.509 4.139 4.657 . 0 0 "[ . 1 . 2]" 1
285 1 28 ARG HA 1 92 ILE MG . . 5.500 5.393 4.909 5.544 0.044 4 0 "[ . 1 . 2]" 1
286 1 28 ARG QB 1 28 ARG HD2 . . 2.970 2.205 1.973 2.336 . 0 0 "[ . 1 . 2]" 1
287 1 28 ARG QB 1 29 ALA HA . . 4.610 4.037 3.916 4.097 . 0 0 "[ . 1 . 2]" 1
288 1 28 ARG QB 1 70 THR MG . . 3.890 3.278 3.051 3.479 . 0 0 "[ . 1 . 2]" 1
289 1 28 ARG QB 1 72 GLU HA . . 4.170 3.684 3.450 4.142 . 0 0 "[ . 1 . 2]" 1
290 1 28 ARG QB 1 73 PHE QE . . 5.070 4.669 4.548 4.848 . 0 0 "[ . 1 . 2]" 1
291 1 28 ARG QB 1 92 ILE MD . . 4.930 4.598 4.266 4.751 . 0 0 "[ . 1 . 2]" 1
292 1 28 ARG QB 1 92 ILE HG13 . . 5.430 3.711 3.344 3.999 . 0 0 "[ . 1 . 2]" 1
293 1 28 ARG HD2 1 70 THR MG . . 3.670 3.689 3.250 3.801 0.131 8 0 "[ . 1 . 2]" 1
294 1 28 ARG HD2 1 72 GLU HA . . 4.620 4.001 3.472 4.500 . 0 0 "[ . 1 . 2]" 1
295 1 28 ARG HD2 1 92 ILE HB . . 4.350 4.162 3.830 4.370 0.020 1 0 "[ . 1 . 2]" 1
296 1 28 ARG HD2 1 92 ILE MD . . 3.740 3.122 2.743 3.414 . 0 0 "[ . 1 . 2]" 1
297 1 28 ARG HD2 1 92 ILE HG12 . . 4.420 4.158 3.741 4.490 0.070 6 0 "[ . 1 . 2]" 1
298 1 28 ARG HD2 1 92 ILE HG13 . . 3.320 2.415 2.003 2.765 . 0 0 "[ . 1 . 2]" 1
299 1 28 ARG HD2 1 92 ILE MG . . 4.190 2.595 2.228 2.803 . 0 0 "[ . 1 . 2]" 1
300 1 28 ARG HD3 1 28 ARG HG2 . . 2.800 2.349 2.204 2.433 . 0 0 "[ . 1 . 2]" 1
301 1 28 ARG HD3 1 72 GLU HA . . 5.080 3.984 2.637 4.477 . 0 0 "[ . 1 . 2]" 1
302 1 28 ARG HD3 1 72 GLU HG2 . . 5.500 4.983 4.007 5.545 0.045 1 0 "[ . 1 . 2]" 1
303 1 28 ARG HD3 1 92 ILE MD . . 4.120 2.896 2.482 3.253 . 0 0 "[ . 1 . 2]" 1
304 1 28 ARG HD3 1 92 ILE HG12 . . 5.130 4.471 3.604 4.951 . 0 0 "[ . 1 . 2]" 1
305 1 28 ARG HD3 1 92 ILE HG13 . . 3.600 2.993 1.972 3.435 . 0 0 "[ . 1 . 2]" 1
306 1 28 ARG HD3 1 92 ILE MG . . 4.650 3.604 3.054 3.946 . 0 0 "[ . 1 . 2]" 1
307 1 28 ARG QG 1 72 GLU HA . . 3.460 2.397 2.030 3.348 . 0 0 "[ . 1 . 2]" 1
308 1 28 ARG QG 1 72 GLU HG3 . . 4.220 3.757 3.162 4.262 0.042 20 0 "[ . 1 . 2]" 1
309 1 28 ARG QG 1 92 ILE MD . . 4.560 3.903 3.379 4.092 . 0 0 "[ . 1 . 2]" 1
310 1 28 ARG QG 1 92 ILE HG13 . . 4.290 3.492 2.638 4.044 . 0 0 "[ . 1 . 2]" 1
311 1 28 ARG HG2 1 72 GLU HA . . 3.370 2.416 2.039 3.401 0.031 2 0 "[ . 1 . 2]" 1
312 1 28 ARG HG2 1 92 ILE MD . . 4.290 4.115 3.528 4.506 0.216 6 0 "[ . 1 . 2]" 1
313 1 28 ARG HG2 1 92 ILE HG13 . . 4.330 3.602 2.668 4.358 0.028 6 0 "[ . 1 . 2]" 1
314 1 28 ARG HG2 1 92 ILE MG . . 4.940 4.660 4.037 5.035 0.095 20 0 "[ . 1 . 2]" 1
315 1 29 ALA H 1 29 ALA MB . . 2.900 2.776 2.732 2.858 . 0 0 "[ . 1 . 2]" 1
316 1 29 ALA H 1 71 VAL QG . . 3.560 3.091 2.773 3.333 . 0 0 "[ . 1 . 2]" 1
317 1 29 ALA H 1 73 PHE H . . 4.870 4.708 4.538 4.912 0.042 11 0 "[ . 1 . 2]" 1
318 1 29 ALA H 1 73 PHE QE . . 3.360 2.175 2.027 2.404 . 0 0 "[ . 1 . 2]" 1
319 1 29 ALA HA 1 30 THR H . . 2.930 2.603 2.577 2.624 . 0 0 "[ . 1 . 2]" 1
320 1 29 ALA HA 1 30 THR HA . . 5.230 4.350 4.314 4.383 . 0 0 "[ . 1 . 2]" 1
321 1 29 ALA HA 1 30 THR HB . . 5.470 5.436 5.316 5.520 0.050 19 0 "[ . 1 . 2]" 1
322 1 29 ALA HA 1 30 THR MG . . 4.920 4.926 4.742 5.006 0.086 1 0 "[ . 1 . 2]" 1
323 1 29 ALA HA 1 41 LEU QD . . 5.440 5.189 5.110 5.573 0.133 16 0 "[ . 1 . 2]" 1
324 1 29 ALA HA 1 43 PHE QD . . 5.500 5.121 4.830 5.371 . 0 0 "[ . 1 . 2]" 1
325 1 29 ALA HA 1 70 THR HA . . 5.500 5.112 4.944 5.244 . 0 0 "[ . 1 . 2]" 1
326 1 29 ALA HA 1 70 THR MG . . 4.190 3.702 3.535 3.897 . 0 0 "[ . 1 . 2]" 1
327 1 29 ALA HA 1 71 VAL QG . . 5.230 4.743 4.496 4.960 . 0 0 "[ . 1 . 2]" 1
328 1 29 ALA HA 1 73 PHE QE . . 4.320 3.840 3.765 3.913 . 0 0 "[ . 1 . 2]" 1
329 1 29 ALA HA 1 73 PHE HZ . . 5.370 4.883 4.711 5.068 . 0 0 "[ . 1 . 2]" 1
330 1 29 ALA MB 1 30 THR H . . 2.960 2.080 2.020 2.127 . 0 0 "[ . 1 . 2]" 1
331 1 29 ALA MB 1 30 THR HA . . 4.740 4.121 4.100 4.149 . 0 0 "[ . 1 . 2]" 1
332 1 29 ALA MB 1 30 THR HB . . 5.280 4.680 4.588 4.767 . 0 0 "[ . 1 . 2]" 1
333 1 29 ALA MB 1 30 THR MG . . 5.040 4.868 4.793 4.895 . 0 0 "[ . 1 . 2]" 1
334 1 29 ALA MB 1 31 VAL H . . 5.180 5.207 5.107 5.237 0.057 2 0 "[ . 1 . 2]" 1
335 1 29 ALA MB 1 31 VAL HA . . 5.500 5.058 4.918 5.138 . 0 0 "[ . 1 . 2]" 1
336 1 29 ALA MB 1 41 LEU HB2 . . 3.410 3.400 3.154 3.467 0.057 6 0 "[ . 1 . 2]" 1
337 1 29 ALA MB 1 41 LEU HB3 . . 3.340 2.665 2.267 2.743 . 0 0 "[ . 1 . 2]" 1
338 1 29 ALA MB 1 41 LEU MD1 . . 4.160 3.305 3.181 3.749 . 0 0 "[ . 1 . 2]" 1
339 1 29 ALA MB 1 41 LEU QD . . 3.450 3.084 2.977 3.491 0.041 16 0 "[ . 1 . 2]" 1
340 1 29 ALA MB 1 41 LEU MD2 . . 4.160 3.695 3.587 4.163 0.003 16 0 "[ . 1 . 2]" 1
341 1 29 ALA MB 1 42 ASN H . . 3.850 3.358 3.095 3.500 . 0 0 "[ . 1 . 2]" 1
342 1 29 ALA MB 1 42 ASN QB . . 3.880 3.356 3.117 4.034 0.154 12 0 "[ . 1 . 2]" 1
343 1 29 ALA MB 1 43 PHE HA . . 4.150 4.197 4.062 4.268 0.118 2 0 "[ . 1 . 2]" 1
344 1 29 ALA MB 1 43 PHE HB2 . . 3.250 2.827 2.713 2.922 . 0 0 "[ . 1 . 2]" 1
345 1 29 ALA MB 1 43 PHE QD . . 3.330 2.756 2.577 2.940 . 0 0 "[ . 1 . 2]" 1
346 1 29 ALA MB 1 43 PHE QE . . 4.890 4.332 4.091 4.560 . 0 0 "[ . 1 . 2]" 1
347 1 29 ALA MB 1 51 LEU QD . . 4.260 4.204 4.045 4.299 0.039 9 0 "[ . 1 . 2]" 1
348 1 29 ALA MB 1 70 THR HA . . 5.500 5.314 5.195 5.427 . 0 0 "[ . 1 . 2]" 1
349 1 29 ALA MB 1 71 VAL QG . . 4.050 3.551 3.248 3.815 . 0 0 "[ . 1 . 2]" 1
350 1 29 ALA MB 1 73 PHE QD . . 4.080 3.908 3.843 3.980 . 0 0 "[ . 1 . 2]" 1
351 1 29 ALA MB 1 73 PHE QE . . 2.860 1.921 1.859 1.995 . 0 0 "[ . 1 . 2]" 1
352 1 29 ALA MB 1 73 PHE HZ . . 3.180 2.352 2.215 2.511 . 0 0 "[ . 1 . 2]" 1
353 1 30 THR H 1 30 THR HB . . 3.840 3.075 2.977 3.188 . 0 0 "[ . 1 . 2]" 1
354 1 30 THR H 1 30 THR MG . . 3.720 3.714 3.634 3.753 0.033 15 0 "[ . 1 . 2]" 1
355 1 30 THR H 1 31 VAL H . . 4.530 4.509 4.496 4.526 . 0 0 "[ . 1 . 2]" 1
356 1 30 THR H 1 41 LEU HB2 . . 5.500 5.587 5.554 5.625 0.125 4 0 "[ . 1 . 2]" 1
357 1 30 THR H 1 42 ASN H . . 3.840 3.583 3.364 3.763 . 0 0 "[ . 1 . 2]" 1
358 1 30 THR H 1 70 THR HA . . 4.710 4.597 4.471 4.702 . 0 0 "[ . 1 . 2]" 1
359 1 30 THR HA 1 30 THR HB . . 2.930 2.923 2.876 2.954 0.024 1 0 "[ . 1 . 2]" 1
360 1 30 THR HA 1 30 THR MG . . 2.620 2.170 2.153 2.191 . 0 0 "[ . 1 . 2]" 1
361 1 30 THR HA 1 31 VAL H . . 2.940 2.244 2.216 2.267 . 0 0 "[ . 1 . 2]" 1
362 1 30 THR HA 1 31 VAL MG2 . . 3.900 3.596 3.515 3.679 . 0 0 "[ . 1 . 2]" 1
363 1 30 THR HA 1 41 LEU QD . . 4.450 4.088 3.977 4.171 . 0 0 "[ . 1 . 2]" 1
364 1 30 THR HA 1 68 GLY HA2 . . 5.500 5.512 5.478 5.548 0.048 19 0 "[ . 1 . 2]" 1
365 1 30 THR HA 1 69 ASP H . . 5.500 5.297 5.005 5.505 0.005 12 0 "[ . 1 . 2]" 1
366 1 30 THR HA 1 70 THR H . . 4.810 4.576 4.341 4.698 . 0 0 "[ . 1 . 2]" 1
367 1 30 THR HA 1 70 THR HA . . 2.710 2.091 1.995 2.177 . 0 0 "[ . 1 . 2]" 1
368 1 30 THR HA 1 70 THR HB . . 5.350 5.085 5.001 5.182 . 0 0 "[ . 1 . 2]" 1
369 1 30 THR HA 1 70 THR MG . . 3.260 3.305 3.259 3.341 0.081 4 0 "[ . 1 . 2]" 1
370 1 30 THR HA 1 71 VAL HA . . 5.500 5.565 5.505 5.596 0.096 9 0 "[ . 1 . 2]" 1
371 1 30 THR HA 1 71 VAL QG . . 3.710 3.085 2.991 3.157 . 0 0 "[ . 1 . 2]" 1
372 1 30 THR HB 1 31 VAL MG2 . . 5.390 5.041 4.909 5.147 . 0 0 "[ . 1 . 2]" 1
373 1 30 THR HB 1 42 ASN QB . . 4.300 3.760 3.374 4.243 . 0 0 "[ . 1 . 2]" 1
374 1 30 THR HB 1 68 GLY HA2 . . 4.170 4.183 4.037 4.230 0.060 10 0 "[ . 1 . 2]" 1
375 1 30 THR HB 1 70 THR HA . . 4.520 4.559 4.521 4.603 0.083 8 0 "[ . 1 . 2]" 1
376 1 30 THR MG 1 31 VAL H . . 3.530 2.577 2.504 2.725 . 0 0 "[ . 1 . 2]" 1
377 1 30 THR MG 1 31 VAL HB . . 4.520 4.134 4.009 4.361 . 0 0 "[ . 1 . 2]" 1
378 1 30 THR MG 1 41 LEU QD . . 5.260 4.909 4.821 4.968 . 0 0 "[ . 1 . 2]" 1
379 1 30 THR MG 1 42 ASN QB . . 5.450 4.937 4.690 5.410 . 0 0 "[ . 1 . 2]" 1
380 1 30 THR MG 1 68 GLY H . . 4.510 3.838 3.607 4.129 . 0 0 "[ . 1 . 2]" 1
381 1 30 THR MG 1 68 GLY HA2 . . 4.260 3.093 2.908 3.359 . 0 0 "[ . 1 . 2]" 1
382 1 30 THR MG 1 68 GLY HA3 . . 4.510 4.183 4.044 4.393 . 0 0 "[ . 1 . 2]" 1
383 1 30 THR MG 1 69 ASP H . . 4.290 3.675 3.445 3.861 . 0 0 "[ . 1 . 2]" 1
384 1 30 THR MG 1 69 ASP HB2 . . 4.800 4.825 4.710 4.912 0.112 2 0 "[ . 1 . 2]" 1
385 1 30 THR MG 1 69 ASP HB3 . . 4.810 4.683 4.532 4.825 0.015 4 0 "[ . 1 . 2]" 1
386 1 30 THR MG 1 70 THR H . . 4.120 3.304 3.040 3.438 . 0 0 "[ . 1 . 2]" 1
387 1 30 THR MG 1 70 THR HA . . 3.050 2.260 2.175 2.363 . 0 0 "[ . 1 . 2]" 1
388 1 30 THR MG 1 70 THR HB . . 4.340 4.233 4.153 4.296 . 0 0 "[ . 1 . 2]" 1
389 1 30 THR MG 1 71 VAL H . . 5.500 4.006 3.931 4.088 . 0 0 "[ . 1 . 2]" 1
390 1 30 THR MG 1 71 VAL QG . . 4.370 3.936 3.816 4.028 . 0 0 "[ . 1 . 2]" 1
391 1 31 VAL H 1 31 VAL HB . . 3.150 2.616 2.578 2.651 . 0 0 "[ . 1 . 2]" 1
392 1 31 VAL H 1 31 VAL MG2 . . 2.930 1.997 1.950 2.051 . 0 0 "[ . 1 . 2]" 1
393 1 31 VAL H 1 32 ASP H . . 5.500 4.438 4.385 4.498 . 0 0 "[ . 1 . 2]" 1
394 1 31 VAL H 1 41 LEU HA . . 4.690 4.667 4.604 4.737 0.047 19 0 "[ . 1 . 2]" 1
395 1 31 VAL H 1 68 GLY H . . 4.100 3.470 3.150 3.688 . 0 0 "[ . 1 . 2]" 1
396 1 31 VAL H 1 69 ASP H . . 4.330 3.689 3.373 3.942 . 0 0 "[ . 1 . 2]" 1
397 1 31 VAL H 1 69 ASP HB2 . . 5.490 4.832 4.359 5.502 0.012 11 0 "[ . 1 . 2]" 1
398 1 31 VAL H 1 70 THR HA . . 3.900 3.501 3.391 3.627 . 0 0 "[ . 1 . 2]" 1
399 1 31 VAL HA 1 31 VAL MG1 . . 2.920 2.351 2.333 2.374 . 0 0 "[ . 1 . 2]" 1
400 1 31 VAL HA 1 31 VAL MG2 . . 2.880 2.435 2.402 2.459 . 0 0 "[ . 1 . 2]" 1
401 1 31 VAL HA 1 32 ASP H . . 3.070 2.094 2.066 2.132 . 0 0 "[ . 1 . 2]" 1
402 1 31 VAL HA 1 32 ASP HA . . 5.000 4.379 4.348 4.409 . 0 0 "[ . 1 . 2]" 1
403 1 31 VAL HA 1 32 ASP HB2 . . 5.080 4.626 4.400 4.834 . 0 0 "[ . 1 . 2]" 1
404 1 31 VAL HA 1 32 ASP HB3 . . 4.380 4.407 4.313 4.515 0.135 6 0 "[ . 1 . 2]" 1
405 1 31 VAL HA 1 33 SER H . . 3.770 3.821 3.780 3.878 0.108 8 0 "[ . 1 . 2]" 1
406 1 31 VAL HA 1 40 PHE H . . 4.900 4.705 4.582 4.812 . 0 0 "[ . 1 . 2]" 1
407 1 31 VAL HA 1 41 LEU H . . 5.310 4.761 4.677 4.851 . 0 0 "[ . 1 . 2]" 1
408 1 31 VAL HA 1 41 LEU HA . . 5.230 2.224 2.098 2.332 . 0 0 "[ . 1 . 2]" 1
409 1 31 VAL HA 1 41 LEU HB2 . . 4.800 4.694 4.632 4.804 0.004 12 0 "[ . 1 . 2]" 1
410 1 31 VAL HA 1 41 LEU HB3 . . 3.920 3.427 3.338 3.596 . 0 0 "[ . 1 . 2]" 1
411 1 31 VAL HA 1 41 LEU QD . . 2.960 1.913 1.853 1.992 . 0 0 "[ . 1 . 2]" 1
412 1 31 VAL HA 1 41 LEU HG . . 4.550 4.071 3.980 4.247 . 0 0 "[ . 1 . 2]" 1
413 1 31 VAL HA 1 42 ASN H . . 4.130 3.720 3.518 3.932 . 0 0 "[ . 1 . 2]" 1
414 1 31 VAL HA 1 53 PHE QD . . 5.500 5.568 5.524 5.694 0.194 16 0 "[ . 1 . 2]" 1
415 1 31 VAL HA 1 53 PHE QE . . 5.210 3.862 3.766 3.928 . 0 0 "[ . 1 . 2]" 1
416 1 31 VAL HA 1 53 PHE HZ . . 5.480 5.393 5.118 5.526 0.046 20 0 "[ . 1 . 2]" 1
417 1 31 VAL HA 1 71 VAL QG . . 4.420 3.516 3.396 3.634 . 0 0 "[ . 1 . 2]" 1
418 1 31 VAL HB 1 32 ASP HA . . 5.210 5.121 4.981 5.226 0.016 12 0 "[ . 1 . 2]" 1
419 1 31 VAL HB 1 34 ILE MD . . 4.360 4.310 4.121 4.400 0.040 10 0 "[ . 1 . 2]" 1
420 1 31 VAL HB 1 41 LEU QD . . 4.570 3.979 3.893 4.056 . 0 0 "[ . 1 . 2]" 1
421 1 31 VAL HB 1 67 PRO HA . . 2.920 2.004 1.906 2.154 . 0 0 "[ . 1 . 2]" 1
422 1 31 VAL HB 1 68 GLY H . . 3.260 1.844 1.628 2.140 . 0 0 "[ . 1 . 2]" 1
423 1 31 VAL HB 1 68 GLY HA2 . . 4.510 3.975 3.760 4.160 . 0 0 "[ . 1 . 2]" 1
424 1 31 VAL HB 1 69 ASP H . . 3.590 2.795 2.492 3.223 . 0 0 "[ . 1 . 2]" 1
425 1 31 VAL HB 1 69 ASP HB2 . . 5.160 4.283 3.744 5.060 . 0 0 "[ . 1 . 2]" 1
426 1 31 VAL HB 1 71 VAL QG . . 5.130 3.832 3.704 3.912 . 0 0 "[ . 1 . 2]" 1
427 1 31 VAL MG1 1 32 ASP H . . 3.510 2.856 2.750 2.978 . 0 0 "[ . 1 . 2]" 1
428 1 31 VAL MG1 1 33 SER H . . 3.190 2.363 2.228 2.524 . 0 0 "[ . 1 . 2]" 1
429 1 31 VAL MG1 1 33 SER HA . . 3.230 3.170 2.967 3.298 0.068 20 0 "[ . 1 . 2]" 1
430 1 31 VAL MG1 1 34 ILE HB . . 4.360 3.741 3.607 3.878 . 0 0 "[ . 1 . 2]" 1
431 1 31 VAL MG1 1 39 GLY HA2 . . 4.210 3.887 3.776 3.987 . 0 0 "[ . 1 . 2]" 1
432 1 31 VAL MG1 1 39 GLY HA3 . . 4.280 3.608 3.490 3.718 . 0 0 "[ . 1 . 2]" 1
433 1 31 VAL MG1 1 40 PHE H . . 3.720 2.869 2.762 3.017 . 0 0 "[ . 1 . 2]" 1
434 1 31 VAL MG1 1 40 PHE QD . . 5.500 4.841 4.709 5.024 . 0 0 "[ . 1 . 2]" 1
435 1 31 VAL MG1 1 41 LEU HA . . 4.300 3.628 3.455 3.781 . 0 0 "[ . 1 . 2]" 1
436 1 31 VAL MG1 1 41 LEU QD . . 3.390 2.518 2.454 2.576 . 0 0 "[ . 1 . 2]" 1
437 1 31 VAL MG1 1 53 PHE QD . . 5.200 4.704 4.616 4.836 . 0 0 "[ . 1 . 2]" 1
438 1 31 VAL MG1 1 53 PHE QE . . 3.480 2.774 2.671 2.901 . 0 0 "[ . 1 . 2]" 1
439 1 31 VAL MG1 1 53 PHE HZ . . 3.560 3.195 3.027 3.373 . 0 0 "[ . 1 . 2]" 1
440 1 31 VAL MG1 1 67 PRO HA . . 2.890 1.938 1.867 2.023 . 0 0 "[ . 1 . 2]" 1
441 1 31 VAL MG1 1 67 PRO HD3 . . 5.290 3.826 3.503 3.987 . 0 0 "[ . 1 . 2]" 1
442 1 31 VAL MG1 1 68 GLY H . . 3.590 2.955 2.753 3.130 . 0 0 "[ . 1 . 2]" 1
443 1 31 VAL MG1 1 71 VAL QG . . 3.710 3.655 3.595 3.712 0.002 1 0 "[ . 1 . 2]" 1
444 1 31 VAL MG2 1 34 ILE MD . . 3.580 3.199 3.008 3.325 . 0 0 "[ . 1 . 2]" 1
445 1 31 VAL MG2 1 34 ILE HG13 . . 4.520 3.990 3.868 4.156 . 0 0 "[ . 1 . 2]" 1
446 1 31 VAL MG2 1 39 GLY HA3 . . 4.820 4.784 4.585 4.864 0.044 15 0 "[ . 1 . 2]" 1
447 1 31 VAL MG2 1 41 LEU HB3 . . 4.460 4.380 4.268 4.540 0.080 16 0 "[ . 1 . 2]" 1
448 1 31 VAL MG2 1 41 LEU QD . . 2.850 2.064 1.983 2.175 . 0 0 "[ . 1 . 2]" 1
449 1 31 VAL MG2 1 41 LEU HG . . 4.540 4.330 4.073 4.470 . 0 0 "[ . 1 . 2]" 1
450 1 31 VAL MG2 1 53 PHE QD . . 5.500 4.748 4.629 4.895 . 0 0 "[ . 1 . 2]" 1
451 1 31 VAL MG2 1 53 PHE QE . . 3.560 2.904 2.770 3.043 . 0 0 "[ . 1 . 2]" 1
452 1 31 VAL MG2 1 53 PHE HZ . . 3.550 3.251 3.032 3.416 . 0 0 "[ . 1 . 2]" 1
453 1 31 VAL MG2 1 65 LEU HA . . 5.050 4.864 4.622 5.045 . 0 0 "[ . 1 . 2]" 1
454 1 31 VAL MG2 1 65 LEU HG . . 4.700 3.937 3.484 4.225 . 0 0 "[ . 1 . 2]" 1
455 1 31 VAL MG2 1 67 PRO HB2 . . 5.500 5.453 5.295 5.561 0.061 20 0 "[ . 1 . 2]" 1
456 1 31 VAL MG2 1 69 ASP HB3 . . 4.690 3.780 3.238 4.331 . 0 0 "[ . 1 . 2]" 1
457 1 31 VAL MG2 1 71 VAL HA . . 4.940 4.702 4.643 4.784 . 0 0 "[ . 1 . 2]" 1
458 1 31 VAL MG2 1 71 VAL QG . . 2.770 1.836 1.758 1.934 . 0 0 "[ . 1 . 2]" 1
459 1 31 VAL MG2 1 89 VAL MG1 . . 3.890 3.678 3.464 3.905 0.015 2 0 "[ . 1 . 2]" 1
460 1 32 ASP H 1 32 ASP HB2 . . 3.550 2.698 2.485 2.909 . 0 0 "[ . 1 . 2]" 1
461 1 32 ASP H 1 32 ASP HB3 . . 3.410 2.354 2.231 2.476 . 0 0 "[ . 1 . 2]" 1
462 1 32 ASP H 1 33 SER H . . 3.130 2.500 2.380 2.606 . 0 0 "[ . 1 . 2]" 1
463 1 32 ASP H 1 40 PHE H . . 4.770 4.232 4.113 4.431 . 0 0 "[ . 1 . 2]" 1
464 1 32 ASP H 1 41 LEU HA . . 3.570 1.835 1.688 1.981 . 0 0 "[ . 1 . 2]" 1
465 1 32 ASP H 1 41 LEU QD . . 3.880 3.152 2.951 3.271 . 0 0 "[ . 1 . 2]" 1
466 1 32 ASP H 1 41 LEU HG . . 5.500 4.591 4.402 5.397 . 0 0 "[ . 1 . 2]" 1
467 1 32 ASP H 1 42 ASN H . . 3.840 3.143 2.850 3.326 . 0 0 "[ . 1 . 2]" 1
468 1 32 ASP H 1 68 GLY H . . 5.130 4.757 4.581 5.023 . 0 0 "[ . 1 . 2]" 1
469 1 32 ASP HA 1 32 ASP HB2 . . 3.020 2.414 2.338 2.501 . 0 0 "[ . 1 . 2]" 1
470 1 32 ASP HA 1 42 ASN H . . 4.660 4.235 3.946 4.437 . 0 0 "[ . 1 . 2]" 1
471 1 32 ASP HA 1 42 ASN HA . . 5.500 5.039 4.760 5.366 . 0 0 "[ . 1 . 2]" 1
472 1 32 ASP HB2 1 33 SER H . . 4.360 3.897 3.763 4.045 . 0 0 "[ . 1 . 2]" 1
473 1 32 ASP HB2 1 41 LEU HA . . 5.500 3.404 2.985 3.838 . 0 0 "[ . 1 . 2]" 1
474 1 32 ASP HB2 1 41 LEU QD . . 5.440 5.035 4.718 5.375 . 0 0 "[ . 1 . 2]" 1
475 1 32 ASP HB2 1 42 ASN H . . 3.950 3.091 2.614 3.428 . 0 0 "[ . 1 . 2]" 1
476 1 32 ASP HB2 1 42 ASN HA . . 3.830 2.944 2.532 3.221 . 0 0 "[ . 1 . 2]" 1
477 1 32 ASP HB2 1 42 ASN QB . . 4.010 2.836 2.373 3.787 . 0 0 "[ . 1 . 2]" 1
478 1 32 ASP HB2 1 50 LYS HD2 . . 4.400 3.574 2.572 4.538 0.138 6 0 "[ . 1 . 2]" 1
479 1 32 ASP HB2 1 50 LYS HE2 . . 5.500 4.541 2.261 5.575 0.075 8 0 "[ . 1 . 2]" 1
480 1 32 ASP HB2 1 50 LYS HE3 . . 5.500 3.978 2.448 5.558 0.058 14 0 "[ . 1 . 2]" 1
481 1 32 ASP HB3 1 33 SER H . . 3.190 2.564 2.429 2.742 . 0 0 "[ . 1 . 2]" 1
482 1 32 ASP HB3 1 33 SER HA . . 5.500 4.926 4.797 5.106 . 0 0 "[ . 1 . 2]" 1
483 1 32 ASP HB3 1 33 SER QB . . 5.340 4.076 3.661 4.540 . 0 0 "[ . 1 . 2]" 1
484 1 32 ASP HB3 1 40 PHE H . . 4.910 4.407 4.129 4.631 . 0 0 "[ . 1 . 2]" 1
485 1 32 ASP HB3 1 40 PHE HA . . 5.490 4.664 4.397 4.798 . 0 0 "[ . 1 . 2]" 1
486 1 32 ASP HB3 1 40 PHE HB2 . . 3.980 2.863 2.509 3.130 . 0 0 "[ . 1 . 2]" 1
487 1 32 ASP HB3 1 40 PHE QB . . 3.340 2.698 2.392 2.916 . 0 0 "[ . 1 . 2]" 1
488 1 32 ASP HB3 1 40 PHE HB3 . . 3.980 3.307 3.016 3.503 . 0 0 "[ . 1 . 2]" 1
489 1 32 ASP HB3 1 40 PHE QD . . 4.990 4.785 4.494 5.007 0.017 6 0 "[ . 1 . 2]" 1
490 1 32 ASP HB3 1 41 LEU HB3 . . 5.500 5.535 5.435 5.586 0.086 5 0 "[ . 1 . 2]" 1
491 1 32 ASP HB3 1 42 ASN H . . 4.510 4.097 3.954 4.332 . 0 0 "[ . 1 . 2]" 1
492 1 32 ASP HB3 1 42 ASN HA . . 4.600 4.178 3.857 4.447 . 0 0 "[ . 1 . 2]" 1
493 1 32 ASP HB3 1 50 LYS HD2 . . 4.900 4.028 2.829 4.950 0.050 2 0 "[ . 1 . 2]" 1
494 1 33 SER H 1 34 ILE H . . 4.430 4.312 4.238 4.354 . 0 0 "[ . 1 . 2]" 1
495 1 33 SER H 1 34 ILE HB . . 5.500 5.593 5.542 5.632 0.132 10 0 "[ . 1 . 2]" 1
496 1 33 SER H 1 34 ILE HG13 . . 4.720 4.144 4.078 4.214 . 0 0 "[ . 1 . 2]" 1
497 1 33 SER H 1 40 PHE H . . 3.530 2.962 2.855 3.035 . 0 0 "[ . 1 . 2]" 1
498 1 33 SER H 1 40 PHE HA . . 5.340 4.816 4.688 5.009 . 0 0 "[ . 1 . 2]" 1
499 1 33 SER H 1 40 PHE QD . . 4.510 4.181 3.869 4.362 . 0 0 "[ . 1 . 2]" 1
500 1 33 SER H 1 41 LEU H . . 5.500 5.090 4.960 5.285 . 0 0 "[ . 1 . 2]" 1
501 1 33 SER H 1 41 LEU HA . . 4.370 4.014 3.814 4.192 . 0 0 "[ . 1 . 2]" 1
502 1 33 SER H 1 41 LEU QD . . 5.110 4.361 4.034 4.501 . 0 0 "[ . 1 . 2]" 1
503 1 33 SER HA 1 33 SER HB2 . . 2.960 2.814 2.512 3.029 0.069 20 0 "[ . 1 . 2]" 1
504 1 33 SER HA 1 33 SER QB . . 2.570 2.315 2.191 2.493 . 0 0 "[ . 1 . 2]" 1
505 1 33 SER HA 1 33 SER HB3 . . 2.960 2.483 2.377 2.986 0.026 2 0 "[ . 1 . 2]" 1
506 1 33 SER HA 1 34 ILE H . . 2.720 2.402 2.321 2.483 . 0 0 "[ . 1 . 2]" 1
507 1 33 SER HA 1 34 ILE HB . . 4.390 4.264 4.195 4.340 . 0 0 "[ . 1 . 2]" 1
508 1 33 SER HA 1 34 ILE MD . . 5.150 5.113 4.914 5.188 0.038 20 0 "[ . 1 . 2]" 1
509 1 33 SER HA 1 67 PRO HB2 . . 3.370 3.003 2.608 3.338 . 0 0 "[ . 1 . 2]" 1
510 1 33 SER HA 1 67 PRO HB3 . . 3.750 2.513 2.117 2.765 . 0 0 "[ . 1 . 2]" 1
511 1 33 SER HA 1 67 PRO HD3 . . 5.500 5.361 4.898 5.593 0.093 1 0 "[ . 1 . 2]" 1
512 1 33 SER QB 1 34 ILE H . . 3.040 2.441 2.266 2.956 . 0 0 "[ . 1 . 2]" 1
513 1 33 SER QB 1 34 ILE HB . . 5.340 4.861 4.726 5.197 . 0 0 "[ . 1 . 2]" 1
514 1 33 SER QB 1 35 LYS HA . . 5.340 5.335 5.078 5.518 0.178 2 0 "[ . 1 . 2]" 1
515 1 33 SER QB 1 35 LYS QE . . 3.800 2.495 1.939 3.222 . 0 0 "[ . 1 . 2]" 1
516 1 33 SER QB 1 35 LYS HG2 . . 4.150 3.517 3.219 3.894 . 0 0 "[ . 1 . 2]" 1
517 1 33 SER QB 1 40 PHE H . . 5.340 4.340 3.855 4.923 . 0 0 "[ . 1 . 2]" 1
518 1 33 SER QB 1 40 PHE QD . . 4.420 3.442 2.551 4.302 . 0 0 "[ . 1 . 2]" 1
519 1 33 SER QB 1 67 PRO HB3 . . 4.880 4.303 3.874 4.643 . 0 0 "[ . 1 . 2]" 1
520 1 33 SER HB2 1 34 ILE H . . 3.880 3.179 2.383 3.904 0.024 2 0 "[ . 1 . 2]" 1
521 1 33 SER HB2 1 35 LYS QE . . 4.390 3.161 1.950 4.362 . 0 0 "[ . 1 . 2]" 1
522 1 33 SER HB3 1 34 ILE H . . 3.880 2.969 2.288 3.763 . 0 0 "[ . 1 . 2]" 1
523 1 33 SER HB3 1 35 LYS QE . . 4.390 3.096 2.232 4.163 . 0 0 "[ . 1 . 2]" 1
524 1 34 ILE H 1 34 ILE HB . . 2.980 2.679 2.591 2.741 . 0 0 "[ . 1 . 2]" 1
525 1 34 ILE H 1 34 ILE HG13 . . 3.710 3.629 3.472 3.717 0.007 7 0 "[ . 1 . 2]" 1
526 1 34 ILE H 1 34 ILE MG . . 3.890 3.672 3.639 3.709 . 0 0 "[ . 1 . 2]" 1
527 1 34 ILE H 1 35 LYS H . . 4.340 4.246 4.127 4.322 . 0 0 "[ . 1 . 2]" 1
528 1 34 ILE H 1 35 LYS QE . . 4.880 3.557 3.072 4.376 . 0 0 "[ . 1 . 2]" 1
529 1 34 ILE H 1 67 PRO HB3 . . 3.890 2.947 2.704 3.331 . 0 0 "[ . 1 . 2]" 1
530 1 34 ILE HA 1 34 ILE MD . . 3.840 3.750 3.731 3.771 . 0 0 "[ . 1 . 2]" 1
531 1 34 ILE HA 1 34 ILE HG12 . . 3.340 2.398 2.336 2.451 . 0 0 "[ . 1 . 2]" 1
532 1 34 ILE HA 1 34 ILE HG13 . . 3.530 2.649 2.580 2.717 . 0 0 "[ . 1 . 2]" 1
533 1 34 ILE HA 1 34 ILE MG . . 2.900 2.672 2.634 2.709 . 0 0 "[ . 1 . 2]" 1
534 1 34 ILE HA 1 35 LYS H . . 2.830 2.128 2.105 2.152 . 0 0 "[ . 1 . 2]" 1
535 1 34 ILE HA 1 38 PHE H . . 4.940 4.973 4.853 5.036 0.096 6 0 "[ . 1 . 2]" 1
536 1 34 ILE HA 1 39 GLY HA2 . . 3.480 1.952 1.908 2.015 . 0 0 "[ . 1 . 2]" 1
537 1 34 ILE HA 1 39 GLY HA3 . . 3.470 3.460 3.430 3.491 0.021 8 0 "[ . 1 . 2]" 1
538 1 34 ILE HA 1 40 PHE H . . 3.930 3.176 3.039 3.328 . 0 0 "[ . 1 . 2]" 1
539 1 34 ILE HA 1 40 PHE QD . . 4.330 3.252 3.065 3.409 . 0 0 "[ . 1 . 2]" 1
540 1 34 ILE HA 1 40 PHE QE . . 5.140 4.343 4.155 4.488 . 0 0 "[ . 1 . 2]" 1
541 1 34 ILE HA 1 53 PHE QE . . 5.500 5.358 5.245 5.473 . 0 0 "[ . 1 . 2]" 1
542 1 34 ILE HA 1 53 PHE HZ . . 5.500 5.304 5.163 5.488 . 0 0 "[ . 1 . 2]" 1
543 1 34 ILE HA 1 67 PRO HD3 . . 5.500 5.450 4.922 5.571 0.071 5 0 "[ . 1 . 2]" 1
544 1 34 ILE HB 1 34 ILE MD . . 3.150 2.441 2.402 2.491 . 0 0 "[ . 1 . 2]" 1
545 1 34 ILE HB 1 35 LYS HA . . 5.300 5.239 5.165 5.314 0.014 8 0 "[ . 1 . 2]" 1
546 1 34 ILE HB 1 39 GLY HA3 . . 5.230 5.200 5.129 5.247 0.017 15 0 "[ . 1 . 2]" 1
547 1 34 ILE HB 1 40 PHE H . . 5.500 5.287 5.096 5.471 . 0 0 "[ . 1 . 2]" 1
548 1 34 ILE HB 1 67 PRO HB3 . . 3.490 2.890 2.515 3.401 . 0 0 "[ . 1 . 2]" 1
549 1 34 ILE HB 1 67 PRO HD2 . . 4.750 4.294 3.736 4.449 . 0 0 "[ . 1 . 2]" 1
550 1 34 ILE HB 1 67 PRO HD3 . . 4.650 2.647 2.064 2.806 . 0 0 "[ . 1 . 2]" 1
551 1 34 ILE MD 1 39 GLY HA2 . . 4.200 3.895 3.773 4.026 . 0 0 "[ . 1 . 2]" 1
552 1 34 ILE MD 1 39 GLY HA3 . . 4.010 3.458 3.273 3.555 . 0 0 "[ . 1 . 2]" 1
553 1 34 ILE MD 1 41 LEU QD . . 5.440 4.560 4.342 4.685 . 0 0 "[ . 1 . 2]" 1
554 1 34 ILE MD 1 53 PHE QE . . 4.200 3.472 3.332 3.581 . 0 0 "[ . 1 . 2]" 1
555 1 34 ILE MD 1 53 PHE HZ . . 3.610 2.454 2.258 2.668 . 0 0 "[ . 1 . 2]" 1
556 1 34 ILE MD 1 55 MET QG . . 5.340 4.378 3.529 5.173 . 0 0 "[ . 1 . 2]" 1
557 1 34 ILE MD 1 58 VAL QG . . 3.490 3.509 3.275 3.617 0.127 8 0 "[ . 1 . 2]" 1
558 1 34 ILE MD 1 65 LEU HB3 . . 3.370 3.367 3.127 3.507 0.137 14 0 "[ . 1 . 2]" 1
559 1 34 ILE MD 1 65 LEU HG . . 4.480 4.493 4.361 4.626 0.146 10 0 "[ . 1 . 2]" 1
560 1 34 ILE MD 1 66 HIS HB2 . . 5.290 5.058 4.761 5.258 . 0 0 "[ . 1 . 2]" 1
561 1 34 ILE MD 1 66 HIS HB3 . . 5.040 4.607 4.229 4.864 . 0 0 "[ . 1 . 2]" 1
562 1 34 ILE MD 1 67 PRO HA . . 4.270 3.376 3.120 3.615 . 0 0 "[ . 1 . 2]" 1
563 1 34 ILE MD 1 67 PRO HB3 . . 4.620 3.403 3.158 3.792 . 0 0 "[ . 1 . 2]" 1
564 1 34 ILE MD 1 67 PRO HD2 . . 4.150 3.480 3.291 3.608 . 0 0 "[ . 1 . 2]" 1
565 1 34 ILE MD 1 67 PRO HD3 . . 3.630 2.048 1.938 2.165 . 0 0 "[ . 1 . 2]" 1
566 1 34 ILE MD 1 89 VAL MG1 . . 5.050 4.739 4.572 4.970 . 0 0 "[ . 1 . 2]" 1
567 1 34 ILE HG12 1 38 PHE H . . 5.130 5.187 5.152 5.216 0.086 13 0 "[ . 1 . 2]" 1
568 1 34 ILE HG12 1 39 GLY HA3 . . 4.840 2.313 2.184 2.390 . 0 0 "[ . 1 . 2]" 1
569 1 34 ILE HG12 1 53 PHE HZ . . 5.500 3.229 3.053 3.450 . 0 0 "[ . 1 . 2]" 1
570 1 34 ILE HG13 1 39 GLY HA2 . . 4.960 3.047 2.914 3.259 . 0 0 "[ . 1 . 2]" 1
571 1 34 ILE HG13 1 39 GLY HA3 . . 4.920 3.272 3.195 3.402 . 0 0 "[ . 1 . 2]" 1
572 1 34 ILE HG13 1 40 PHE H . . 4.840 3.348 3.143 3.601 . 0 0 "[ . 1 . 2]" 1
573 1 34 ILE HG13 1 53 PHE HZ . . 5.320 3.642 3.437 3.817 . 0 0 "[ . 1 . 2]" 1
574 1 34 ILE HG13 1 67 PRO HA . . 4.930 3.635 3.359 3.913 . 0 0 "[ . 1 . 2]" 1
575 1 34 ILE HG13 1 67 PRO HB3 . . 4.980 3.198 2.913 3.620 . 0 0 "[ . 1 . 2]" 1
576 1 34 ILE HG13 1 67 PRO HD3 . . 4.790 3.768 3.416 3.904 . 0 0 "[ . 1 . 2]" 1
577 1 34 ILE MG 1 35 LYS H . . 2.990 2.625 2.492 2.901 . 0 0 "[ . 1 . 2]" 1
578 1 34 ILE MG 1 35 LYS HA . . 3.760 3.477 3.376 3.626 . 0 0 "[ . 1 . 2]" 1
579 1 34 ILE MG 1 36 GLY H . . 5.150 2.992 2.792 3.359 . 0 0 "[ . 1 . 2]" 1
580 1 34 ILE MG 1 37 GLN HA . . 4.640 4.531 4.305 4.696 0.056 20 0 "[ . 1 . 2]" 1
581 1 34 ILE MG 1 38 PHE H . . 4.390 3.514 3.299 3.678 . 0 0 "[ . 1 . 2]" 1
582 1 34 ILE MG 1 39 GLY H . . 5.030 4.786 4.620 4.929 . 0 0 "[ . 1 . 2]" 1
583 1 34 ILE MG 1 39 GLY HA2 . . 5.180 3.422 3.314 3.554 . 0 0 "[ . 1 . 2]" 1
584 1 34 ILE MG 1 40 PHE QD . . 5.500 5.245 5.131 5.379 . 0 0 "[ . 1 . 2]" 1
585 1 34 ILE MG 1 40 PHE QE . . 5.500 5.534 5.480 5.558 0.058 7 0 "[ . 1 . 2]" 1
586 1 34 ILE MG 1 53 PHE QE . . 5.330 4.843 4.651 5.050 . 0 0 "[ . 1 . 2]" 1
587 1 34 ILE MG 1 53 PHE HZ . . 5.310 4.809 4.608 5.027 . 0 0 "[ . 1 . 2]" 1
588 1 34 ILE MG 1 67 PRO HB3 . . 4.970 4.474 4.165 4.900 . 0 0 "[ . 1 . 2]" 1
589 1 34 ILE MG 1 67 PRO HD3 . . 5.500 3.440 3.153 3.728 . 0 0 "[ . 1 . 2]" 1
590 1 35 LYS H 1 35 LYS HB2 . . 3.600 2.608 2.503 2.675 . 0 0 "[ . 1 . 2]" 1
591 1 35 LYS H 1 35 LYS HD3 . . 4.280 4.104 3.826 4.296 0.016 14 0 "[ . 1 . 2]" 1
592 1 35 LYS H 1 35 LYS HG2 . . 3.740 2.944 2.746 3.209 . 0 0 "[ . 1 . 2]" 1
593 1 35 LYS H 1 36 GLY QA . . 5.340 4.766 4.704 4.847 . 0 0 "[ . 1 . 2]" 1
594 1 35 LYS H 1 38 PHE H . . 4.170 3.335 3.172 3.428 . 0 0 "[ . 1 . 2]" 1
595 1 35 LYS H 1 39 GLY H . . 4.920 4.649 4.612 4.697 . 0 0 "[ . 1 . 2]" 1
596 1 35 LYS H 1 39 GLY HA2 . . 4.070 2.977 2.859 3.086 . 0 0 "[ . 1 . 2]" 1
597 1 35 LYS H 1 39 GLY HA3 . . 4.810 4.516 4.441 4.661 . 0 0 "[ . 1 . 2]" 1
598 1 35 LYS HA 1 35 LYS HD3 . . 3.500 1.938 1.865 2.124 . 0 0 "[ . 1 . 2]" 1
599 1 35 LYS HA 1 35 LYS QE . . 3.590 3.724 3.622 3.783 0.193 16 0 "[ . 1 . 2]" 1
600 1 35 LYS HA 1 35 LYS HG2 . . 3.280 3.044 2.924 3.209 . 0 0 "[ . 1 . 2]" 1
601 1 35 LYS HA 1 36 GLY QA . . 4.910 3.910 3.894 3.932 . 0 0 "[ . 1 . 2]" 1
602 1 35 LYS HA 1 40 PHE QE . . 5.500 4.973 4.772 5.154 . 0 0 "[ . 1 . 2]" 1
603 1 35 LYS HB2 1 36 GLY H . . 5.500 4.471 4.427 4.518 . 0 0 "[ . 1 . 2]" 1
604 1 35 LYS HB2 1 38 PHE HA . . 5.500 5.567 5.384 5.652 0.152 19 0 "[ . 1 . 2]" 1
605 1 35 LYS HB2 1 38 PHE QD . . 5.220 4.480 4.277 4.767 . 0 0 "[ . 1 . 2]" 1
606 1 35 LYS HB2 1 40 PHE QE . . 4.970 2.457 2.216 2.673 . 0 0 "[ . 1 . 2]" 1
607 1 35 LYS HB2 1 40 PHE HZ . . 4.960 4.234 4.046 4.415 . 0 0 "[ . 1 . 2]" 1
608 1 35 LYS HB3 1 36 GLY H . . 5.500 4.010 3.791 4.113 . 0 0 "[ . 1 . 2]" 1
609 1 35 LYS HD2 1 35 LYS HG3 . . 2.450 2.365 2.306 2.428 . 0 0 "[ . 1 . 2]" 1
610 1 35 LYS HD2 1 40 PHE QE . . 5.500 5.007 4.605 5.375 . 0 0 "[ . 1 . 2]" 1
611 1 35 LYS HD3 1 40 PHE QE . . 5.500 5.047 4.811 5.377 . 0 0 "[ . 1 . 2]" 1
612 1 35 LYS QE 1 35 LYS HG2 . . 3.420 2.317 2.239 2.435 . 0 0 "[ . 1 . 2]" 1
613 1 35 LYS QE 1 40 PHE QD . . 5.410 4.429 3.844 5.036 . 0 0 "[ . 1 . 2]" 1
614 1 35 LYS QE 1 40 PHE QE . . 5.500 4.470 3.988 4.839 . 0 0 "[ . 1 . 2]" 1
615 1 35 LYS HG2 1 38 PHE HB2 . . 5.500 5.153 4.847 5.390 . 0 0 "[ . 1 . 2]" 1
616 1 35 LYS HG2 1 40 PHE QE . . 4.260 2.736 2.424 3.100 . 0 0 "[ . 1 . 2]" 1
617 1 35 LYS HG2 1 40 PHE HZ . . 5.500 5.021 4.651 5.356 . 0 0 "[ . 1 . 2]" 1
618 1 35 LYS HG3 1 38 PHE HB2 . . 5.500 5.219 4.931 5.466 . 0 0 "[ . 1 . 2]" 1
619 1 35 LYS HG3 1 40 PHE QE . . 4.390 2.782 2.340 3.160 . 0 0 "[ . 1 . 2]" 1
620 1 35 LYS HG3 1 40 PHE HZ . . 5.500 4.393 3.959 4.773 . 0 0 "[ . 1 . 2]" 1
621 1 36 GLY QA 1 37 GLN HA . . 4.960 3.943 3.925 3.979 . 0 0 "[ . 1 . 2]" 1
622 1 36 GLY QA 1 37 GLN QG . . 4.720 3.387 3.166 3.742 . 0 0 "[ . 1 . 2]" 1
623 1 36 GLY QA 1 38 PHE H . . 4.820 3.463 3.383 3.526 . 0 0 "[ . 1 . 2]" 1
624 1 37 GLN H 1 37 GLN QG . . 5.030 2.373 2.064 2.809 . 0 0 "[ . 1 . 2]" 1
625 1 37 GLN H 1 38 PHE H . . 4.350 2.498 2.334 2.619 . 0 0 "[ . 1 . 2]" 1
626 1 37 GLN HA 1 37 GLN HB2 . . 2.980 3.015 2.989 3.026 0.046 12 0 "[ . 1 . 2]" 1
627 1 37 GLN HA 1 37 GLN QG . . 3.470 2.890 2.515 3.238 . 0 0 "[ . 1 . 2]" 1
628 1 37 GLN HA 1 38 PHE H . . 3.570 3.168 3.106 3.229 . 0 0 "[ . 1 . 2]" 1
629 1 37 GLN HA 1 38 PHE HA . . 4.420 4.463 4.442 4.481 0.061 5 0 "[ . 1 . 2]" 1
630 1 37 GLN HA 1 38 PHE QD . . 5.380 4.753 4.603 4.879 . 0 0 "[ . 1 . 2]" 1
631 1 37 GLN HA 1 54 HIS HD2 . . 5.500 4.539 4.141 5.024 . 0 0 "[ . 1 . 2]" 1
632 1 37 GLN HA 1 55 MET H . . 4.810 3.905 3.754 4.023 . 0 0 "[ . 1 . 2]" 1
633 1 37 GLN HA 1 55 MET HB2 . . 4.090 2.800 2.412 3.097 . 0 0 "[ . 1 . 2]" 1
634 1 37 GLN HA 1 55 MET QB . . 3.590 2.727 2.295 3.020 . 0 0 "[ . 1 . 2]" 1
635 1 37 GLN HA 1 55 MET HB3 . . 4.090 3.837 2.739 4.184 0.094 4 0 "[ . 1 . 2]" 1
636 1 37 GLN HA 1 55 MET HG2 . . 4.600 3.457 2.418 4.677 0.077 20 0 "[ . 1 . 2]" 1
637 1 37 GLN HA 1 55 MET QG . . 3.850 2.791 2.054 3.991 0.141 11 0 "[ . 1 . 2]" 1
638 1 37 GLN HA 1 55 MET HG3 . . 4.600 3.212 2.222 4.681 0.081 15 0 "[ . 1 . 2]" 1
639 1 37 GLN HB2 1 37 GLN QG . . 2.730 2.222 2.151 2.430 . 0 0 "[ . 1 . 2]" 1
640 1 37 GLN HB2 1 38 PHE H . . 4.150 3.779 3.690 3.885 . 0 0 "[ . 1 . 2]" 1
641 1 37 GLN HB2 1 38 PHE HA . . 4.890 4.525 4.314 4.645 . 0 0 "[ . 1 . 2]" 1
642 1 37 GLN HB2 1 38 PHE QD . . 4.710 3.097 2.883 3.277 . 0 0 "[ . 1 . 2]" 1
643 1 37 GLN HB2 1 38 PHE HZ . . 5.120 4.381 4.012 4.654 . 0 0 "[ . 1 . 2]" 1
644 1 37 GLN HB2 1 54 HIS HA . . 5.500 5.011 4.758 5.259 . 0 0 "[ . 1 . 2]" 1
645 1 37 GLN HB2 1 54 HIS HD2 . . 4.660 2.950 2.684 3.294 . 0 0 "[ . 1 . 2]" 1
646 1 37 GLN HB2 1 54 HIS HE1 . . 5.180 5.213 4.965 5.278 0.098 8 0 "[ . 1 . 2]" 1
647 1 37 GLN HB3 1 38 PHE H . . 4.630 4.451 4.333 4.547 . 0 0 "[ . 1 . 2]" 1
648 1 37 GLN HB3 1 38 PHE QD . . 4.780 4.545 4.269 4.759 . 0 0 "[ . 1 . 2]" 1
649 1 37 GLN HB3 1 54 HIS HD2 . . 4.800 3.094 2.542 3.617 . 0 0 "[ . 1 . 2]" 1
650 1 37 GLN HB3 1 54 HIS HE1 . . 5.500 4.400 4.059 4.919 . 0 0 "[ . 1 . 2]" 1
651 1 37 GLN HB3 1 55 MET HA . . 5.500 5.466 5.136 5.561 0.061 10 0 "[ . 1 . 2]" 1
652 1 37 GLN QG 1 38 PHE H . . 4.650 4.391 4.136 4.644 . 0 0 "[ . 1 . 2]" 1
653 1 37 GLN QG 1 38 PHE QD . . 4.620 4.205 3.724 4.610 . 0 0 "[ . 1 . 2]" 1
654 1 37 GLN QG 1 38 PHE HZ . . 5.500 5.578 5.438 5.644 0.144 20 0 "[ . 1 . 2]" 1
655 1 37 GLN QG 1 54 HIS HD2 . . 5.120 4.605 4.430 4.833 . 0 0 "[ . 1 . 2]" 1
656 1 37 GLN QG 1 54 HIS HE1 . . 5.500 5.268 4.891 5.605 0.105 11 0 "[ . 1 . 2]" 1
657 1 38 PHE H 1 38 PHE HB2 . . 3.270 2.681 2.638 2.749 . 0 0 "[ . 1 . 2]" 1
658 1 38 PHE H 1 38 PHE HB3 . . 3.880 3.801 3.778 3.843 . 0 0 "[ . 1 . 2]" 1
659 1 38 PHE H 1 38 PHE QD . . 3.650 3.009 2.854 3.180 . 0 0 "[ . 1 . 2]" 1
660 1 38 PHE H 1 55 MET H . . 4.880 4.843 4.620 4.919 0.039 4 0 "[ . 1 . 2]" 1
661 1 38 PHE HA 1 38 PHE QD . . 3.920 2.889 2.816 2.954 . 0 0 "[ . 1 . 2]" 1
662 1 38 PHE HA 1 39 GLY H . . 3.140 2.159 2.143 2.178 . 0 0 "[ . 1 . 2]" 1
663 1 38 PHE HA 1 39 GLY HA2 . . 4.570 4.353 4.338 4.372 . 0 0 "[ . 1 . 2]" 1
664 1 38 PHE HA 1 40 PHE QE . . 5.500 5.540 5.487 5.574 0.074 20 0 "[ . 1 . 2]" 1
665 1 38 PHE HA 1 53 PHE QD . . 5.420 4.463 4.275 4.765 . 0 0 "[ . 1 . 2]" 1
666 1 38 PHE HA 1 53 PHE QE . . 5.290 4.845 4.628 5.187 . 0 0 "[ . 1 . 2]" 1
667 1 38 PHE HA 1 54 HIS HA . . 3.470 2.468 2.351 2.617 . 0 0 "[ . 1 . 2]" 1
668 1 38 PHE HA 1 54 HIS HD2 . . 5.500 3.412 3.157 3.732 . 0 0 "[ . 1 . 2]" 1
669 1 38 PHE HA 1 55 MET H . . 3.840 3.246 3.018 3.386 . 0 0 "[ . 1 . 2]" 1
670 1 38 PHE HA 1 55 MET QB . . 5.340 4.406 3.788 4.874 . 0 0 "[ . 1 . 2]" 1
671 1 38 PHE HA 1 58 VAL QG . . 5.440 5.328 5.143 5.583 0.143 20 0 "[ . 1 . 2]" 1
672 1 38 PHE HB2 1 39 GLY H . . 3.960 4.018 3.989 4.049 0.089 19 0 "[ . 1 . 2]" 1
673 1 38 PHE HB2 1 54 HIS HA . . 5.440 5.043 4.929 5.167 . 0 0 "[ . 1 . 2]" 1
674 1 38 PHE HB2 1 54 HIS HD2 . . 5.360 4.988 4.838 5.103 . 0 0 "[ . 1 . 2]" 1
675 1 38 PHE HB3 1 39 GLY HA3 . . 5.060 5.020 4.935 5.064 0.004 1 0 "[ . 1 . 2]" 1
676 1 38 PHE HB3 1 40 PHE QE . . 4.240 3.744 3.637 3.833 . 0 0 "[ . 1 . 2]" 1
677 1 38 PHE HB3 1 40 PHE HZ . . 4.520 3.949 3.748 4.126 . 0 0 "[ . 1 . 2]" 1
678 1 38 PHE HB3 1 54 HIS HA . . 4.270 4.117 4.009 4.284 0.014 14 0 "[ . 1 . 2]" 1
679 1 38 PHE HB3 1 54 HIS HD2 . . 4.830 4.797 4.651 4.884 0.054 19 0 "[ . 1 . 2]" 1
680 1 38 PHE QD 1 39 GLY H . . 3.920 3.780 3.656 3.922 0.002 2 0 "[ . 1 . 2]" 1
681 1 38 PHE QD 1 54 HIS H . . 5.010 4.369 4.172 4.566 . 0 0 "[ . 1 . 2]" 1
682 1 38 PHE QD 1 54 HIS HA . . 3.940 2.808 2.645 2.985 . 0 0 "[ . 1 . 2]" 1
683 1 38 PHE QD 1 54 HIS HB2 . . 4.800 3.404 3.238 3.644 . 0 0 "[ . 1 . 2]" 1
684 1 38 PHE HZ 1 54 HIS HA . . 5.160 5.272 5.219 5.347 0.187 1 0 "[ . 1 . 2]" 1
685 1 38 PHE HZ 1 54 HIS HB2 . . 4.650 4.585 4.377 4.691 0.041 20 0 "[ . 1 . 2]" 1
686 1 39 GLY H 1 52 PHE HA . . 5.060 4.586 4.491 4.673 . 0 0 "[ . 1 . 2]" 1
687 1 39 GLY H 1 53 PHE H . . 3.730 2.759 2.686 2.899 . 0 0 "[ . 1 . 2]" 1
688 1 39 GLY H 1 53 PHE QD . . 4.490 3.576 3.423 3.745 . 0 0 "[ . 1 . 2]" 1
689 1 39 GLY H 1 54 HIS HA . . 4.220 3.538 3.401 3.649 . 0 0 "[ . 1 . 2]" 1
690 1 39 GLY HA2 1 40 PHE H . . 3.260 2.300 2.268 2.347 . 0 0 "[ . 1 . 2]" 1
691 1 39 GLY HA2 1 40 PHE HA . . 4.670 4.417 4.401 4.454 . 0 0 "[ . 1 . 2]" 1
692 1 39 GLY HA2 1 40 PHE QD . . 4.360 3.148 3.081 3.193 . 0 0 "[ . 1 . 2]" 1
693 1 39 GLY HA2 1 41 LEU QD . . 5.440 5.106 4.632 5.215 . 0 0 "[ . 1 . 2]" 1
694 1 39 GLY HA2 1 53 PHE QD . . 5.170 4.944 4.861 5.033 . 0 0 "[ . 1 . 2]" 1
695 1 39 GLY HA2 1 53 PHE QE . . 4.430 4.107 4.015 4.169 . 0 0 "[ . 1 . 2]" 1
696 1 39 GLY HA2 1 53 PHE HZ . . 4.420 4.172 4.083 4.294 . 0 0 "[ . 1 . 2]" 1
697 1 39 GLY HA3 1 40 PHE H . . 3.220 2.822 2.775 2.877 . 0 0 "[ . 1 . 2]" 1
698 1 39 GLY HA3 1 40 PHE QD . . 4.540 4.543 4.486 4.586 0.046 20 0 "[ . 1 . 2]" 1
699 1 39 GLY HA3 1 53 PHE QB . . 5.500 4.979 4.876 5.093 . 0 0 "[ . 1 . 2]" 1
700 1 39 GLY HA3 1 53 PHE QD . . 5.500 3.713 3.602 3.817 . 0 0 "[ . 1 . 2]" 1
701 1 39 GLY HA3 1 53 PHE QE . . 4.450 2.841 2.733 2.897 . 0 0 "[ . 1 . 2]" 1
702 1 39 GLY HA3 1 53 PHE HZ . . 4.560 2.648 2.561 2.771 . 0 0 "[ . 1 . 2]" 1
703 1 39 GLY HA3 1 58 VAL QG . . 4.690 4.573 4.391 4.706 0.016 5 0 "[ . 1 . 2]" 1
704 1 40 PHE H 1 40 PHE QD . . 3.670 2.774 2.654 2.885 . 0 0 "[ . 1 . 2]" 1
705 1 40 PHE H 1 41 LEU H . . 4.570 4.359 4.258 4.407 . 0 0 "[ . 1 . 2]" 1
706 1 40 PHE H 1 41 LEU QD . . 5.070 3.929 3.403 4.100 . 0 0 "[ . 1 . 2]" 1
707 1 40 PHE H 1 53 PHE QE . . 4.420 3.564 3.391 3.771 . 0 0 "[ . 1 . 2]" 1
708 1 40 PHE HA 1 40 PHE QD . . 3.380 3.047 3.005 3.120 . 0 0 "[ . 1 . 2]" 1
709 1 40 PHE HA 1 41 LEU H . . 3.090 2.223 2.142 2.296 . 0 0 "[ . 1 . 2]" 1
710 1 40 PHE HA 1 41 LEU HB3 . . 5.500 5.544 5.517 5.661 0.161 16 0 "[ . 1 . 2]" 1
711 1 40 PHE HA 1 41 LEU MD1 . . 5.250 4.474 3.651 4.667 . 0 0 "[ . 1 . 2]" 1
712 1 40 PHE HA 1 41 LEU QD . . 4.560 3.755 2.640 3.890 . 0 0 "[ . 1 . 2]" 1
713 1 40 PHE HA 1 41 LEU MD2 . . 5.250 4.041 2.708 4.227 . 0 0 "[ . 1 . 2]" 1
714 1 40 PHE HA 1 41 LEU HG . . 5.500 3.309 3.092 5.592 0.092 16 0 "[ . 1 . 2]" 1
715 1 40 PHE HA 1 50 LYS HB3 . . 5.500 5.126 4.250 5.535 0.035 8 0 "[ . 1 . 2]" 1
716 1 40 PHE HA 1 50 LYS HG3 . . 5.500 4.278 3.780 5.029 . 0 0 "[ . 1 . 2]" 1
717 1 40 PHE HA 1 51 LEU H . . 5.500 5.184 4.806 5.382 . 0 0 "[ . 1 . 2]" 1
718 1 40 PHE HA 1 51 LEU HB2 . . 5.500 5.249 5.112 5.369 . 0 0 "[ . 1 . 2]" 1
719 1 40 PHE HA 1 51 LEU HB3 . . 5.440 4.452 4.228 4.587 . 0 0 "[ . 1 . 2]" 1
720 1 40 PHE HA 1 52 PHE QB . . 4.070 3.843 3.726 3.941 . 0 0 "[ . 1 . 2]" 1
721 1 40 PHE HA 1 52 PHE QD . . 5.500 5.503 5.412 5.556 0.056 16 0 "[ . 1 . 2]" 1
722 1 40 PHE HA 1 53 PHE QB . . 4.840 4.964 4.920 4.997 0.157 2 0 "[ . 1 . 2]" 1
723 1 40 PHE HA 1 53 PHE QD . . 4.330 3.544 3.307 3.670 . 0 0 "[ . 1 . 2]" 1
724 1 40 PHE HA 1 53 PHE QE . . 4.870 4.053 3.783 4.206 . 0 0 "[ . 1 . 2]" 1
725 1 40 PHE QB 1 41 LEU HA . . 4.710 4.197 4.131 4.284 . 0 0 "[ . 1 . 2]" 1
726 1 40 PHE QB 1 50 LYS HB3 . . 3.850 3.229 2.391 3.798 . 0 0 "[ . 1 . 2]" 1
727 1 40 PHE QB 1 52 PHE HA . . 4.940 3.721 3.634 3.809 . 0 0 "[ . 1 . 2]" 1
728 1 40 PHE QD 1 50 LYS HB3 . . 3.940 2.801 2.397 3.196 . 0 0 "[ . 1 . 2]" 1
729 1 40 PHE QD 1 51 LEU HB3 . . 5.500 5.569 5.482 5.620 0.120 18 0 "[ . 1 . 2]" 1
730 1 40 PHE QD 1 52 PHE HA . . 4.300 2.941 2.832 3.075 . 0 0 "[ . 1 . 2]" 1
731 1 40 PHE QD 1 52 PHE QB . . 3.630 2.674 2.472 2.796 . 0 0 "[ . 1 . 2]" 1
732 1 40 PHE QE 1 52 PHE QB . . 3.840 2.350 2.256 2.468 . 0 0 "[ . 1 . 2]" 1
733 1 40 PHE HZ 1 52 PHE QB . . 3.950 3.694 3.501 3.929 . 0 0 "[ . 1 . 2]" 1
734 1 41 LEU H 1 41 LEU HB2 . . 3.780 2.811 2.732 2.877 . 0 0 "[ . 1 . 2]" 1
735 1 41 LEU H 1 41 LEU MD1 . . 4.310 3.584 3.021 3.723 . 0 0 "[ . 1 . 2]" 1
736 1 41 LEU H 1 41 LEU QD . . 3.730 3.150 1.908 3.284 . 0 0 "[ . 1 . 2]" 1
737 1 41 LEU H 1 41 LEU MD2 . . 4.310 3.521 1.929 3.666 . 0 0 "[ . 1 . 2]" 1
738 1 41 LEU H 1 42 ASN H . . 4.800 4.484 4.433 4.521 . 0 0 "[ . 1 . 2]" 1
739 1 41 LEU H 1 43 PHE H . . 4.680 4.305 4.192 4.469 . 0 0 "[ . 1 . 2]" 1
740 1 41 LEU H 1 50 LYS HG3 . . 4.400 3.338 3.027 3.724 . 0 0 "[ . 1 . 2]" 1
741 1 41 LEU H 1 51 LEU H . . 4.310 3.717 3.147 3.949 . 0 0 "[ . 1 . 2]" 1
742 1 41 LEU H 1 51 LEU HB2 . . 3.570 3.534 3.411 3.613 0.043 15 0 "[ . 1 . 2]" 1
743 1 41 LEU HA 1 41 LEU HG . . 4.000 3.183 3.122 3.763 . 0 0 "[ . 1 . 2]" 1
744 1 41 LEU HA 1 42 ASN H . . 2.980 2.321 2.272 2.367 . 0 0 "[ . 1 . 2]" 1
745 1 41 LEU HA 1 71 VAL QG . . 5.230 4.408 4.273 4.522 . 0 0 "[ . 1 . 2]" 1
746 1 41 LEU HB2 1 41 LEU MD1 . . 3.300 2.277 2.214 3.165 . 0 0 "[ . 1 . 2]" 1
747 1 41 LEU HB2 1 41 LEU QD . . 2.790 2.186 2.170 2.204 . 0 0 "[ . 1 . 2]" 1
748 1 41 LEU HB2 1 41 LEU MD2 . . 3.300 3.106 2.210 3.170 . 0 0 "[ . 1 . 2]" 1
749 1 41 LEU HB2 1 42 ASN H . . 3.860 3.574 3.497 3.687 . 0 0 "[ . 1 . 2]" 1
750 1 41 LEU HB2 1 42 ASN HA . . 5.040 4.857 4.792 4.919 . 0 0 "[ . 1 . 2]" 1
751 1 41 LEU HB2 1 43 PHE H . . 3.980 3.750 3.655 3.844 . 0 0 "[ . 1 . 2]" 1
752 1 41 LEU HB2 1 43 PHE HA . . 5.500 5.344 5.266 5.421 . 0 0 "[ . 1 . 2]" 1
753 1 41 LEU HB2 1 43 PHE HB2 . . 4.160 3.300 3.147 3.388 . 0 0 "[ . 1 . 2]" 1
754 1 41 LEU HB2 1 43 PHE HB3 . . 4.210 3.351 3.203 3.488 . 0 0 "[ . 1 . 2]" 1
755 1 41 LEU HB2 1 43 PHE QD . . 5.180 4.969 4.865 5.077 . 0 0 "[ . 1 . 2]" 1
756 1 41 LEU HB2 1 51 LEU HB3 . . 3.960 3.053 2.768 3.275 . 0 0 "[ . 1 . 2]" 1
757 1 41 LEU HB2 1 51 LEU QD . . 4.740 3.378 3.131 3.517 . 0 0 "[ . 1 . 2]" 1
758 1 41 LEU HB2 1 53 PHE QD . . 5.360 4.728 4.613 4.838 . 0 0 "[ . 1 . 2]" 1
759 1 41 LEU HB2 1 71 VAL QG . . 5.070 4.473 4.257 4.682 . 0 0 "[ . 1 . 2]" 1
760 1 41 LEU HB2 1 73 PHE QB . . 5.500 5.592 5.523 5.635 0.135 17 0 "[ . 1 . 2]" 1
761 1 41 LEU HB2 1 73 PHE QE . . 3.980 4.033 3.697 4.106 0.126 10 0 "[ . 1 . 2]" 1
762 1 41 LEU HB2 1 73 PHE HZ . . 4.100 4.075 3.720 4.165 0.065 19 0 "[ . 1 . 2]" 1
763 1 41 LEU HB3 1 41 LEU MD1 . . 3.500 2.532 2.482 2.564 . 0 0 "[ . 1 . 2]" 1
764 1 41 LEU HB3 1 41 LEU QD . . 3.000 2.076 2.043 2.394 . 0 0 "[ . 1 . 2]" 1
765 1 41 LEU HB3 1 41 LEU MD2 . . 3.500 2.227 2.154 3.144 . 0 0 "[ . 1 . 2]" 1
766 1 41 LEU HB3 1 42 ASN H . . 4.010 2.781 2.676 2.942 . 0 0 "[ . 1 . 2]" 1
767 1 41 LEU HB3 1 42 ASN HA . . 5.150 5.028 4.899 5.122 . 0 0 "[ . 1 . 2]" 1
768 1 41 LEU HB3 1 43 PHE HB2 . . 4.360 4.019 3.793 4.149 . 0 0 "[ . 1 . 2]" 1
769 1 41 LEU HB3 1 43 PHE HB3 . . 5.230 4.698 4.563 4.835 . 0 0 "[ . 1 . 2]" 1
770 1 41 LEU HB3 1 53 PHE QD . . 5.480 5.165 5.091 5.513 0.033 16 0 "[ . 1 . 2]" 1
771 1 41 LEU HB3 1 53 PHE QE . . 5.310 4.884 4.700 5.003 . 0 0 "[ . 1 . 2]" 1
772 1 41 LEU HB3 1 71 VAL QG . . 4.590 3.484 3.271 3.660 . 0 0 "[ . 1 . 2]" 1
773 1 41 LEU HB3 1 73 PHE QE . . 5.220 3.641 3.202 3.775 . 0 0 "[ . 1 . 2]" 1
774 1 41 LEU QD 1 42 ASN H . . 4.000 3.762 3.685 3.862 . 0 0 "[ . 1 . 2]" 1
775 1 41 LEU QD 1 43 PHE H . . 5.200 4.908 4.674 5.006 . 0 0 "[ . 1 . 2]" 1
776 1 41 LEU QD 1 43 PHE HB2 . . 4.410 4.091 3.977 4.344 . 0 0 "[ . 1 . 2]" 1
777 1 41 LEU QD 1 43 PHE HB3 . . 4.620 4.045 3.925 4.157 . 0 0 "[ . 1 . 2]" 1
778 1 41 LEU QD 1 43 PHE QD . . 5.440 4.857 4.740 5.107 . 0 0 "[ . 1 . 2]" 1
779 1 41 LEU QD 1 51 LEU HA . . 4.970 4.970 4.507 5.037 0.067 4 0 "[ . 1 . 2]" 1
780 1 41 LEU QD 1 51 LEU HB2 . . 3.760 3.555 3.322 3.704 . 0 0 "[ . 1 . 2]" 1
781 1 41 LEU QD 1 51 LEU HB3 . . 3.000 2.612 2.277 2.699 . 0 0 "[ . 1 . 2]" 1
782 1 41 LEU QD 1 51 LEU QD . . 2.980 2.553 2.292 2.785 . 0 0 "[ . 1 . 2]" 1
783 1 41 LEU QD 1 53 PHE H . . 5.300 4.729 4.012 4.893 . 0 0 "[ . 1 . 2]" 1
784 1 41 LEU QD 1 53 PHE HA . . 5.380 5.208 4.821 5.353 . 0 0 "[ . 1 . 2]" 1
785 1 41 LEU QD 1 53 PHE QB . . 3.950 3.228 2.960 3.354 . 0 0 "[ . 1 . 2]" 1
786 1 41 LEU QD 1 53 PHE QE . . 3.000 1.880 1.721 1.941 . 0 0 "[ . 1 . 2]" 1
787 1 41 LEU QD 1 53 PHE HZ . . 3.970 3.506 3.149 3.641 . 0 0 "[ . 1 . 2]" 1
788 1 41 LEU QD 1 58 VAL QG . . 5.370 4.652 4.550 4.811 . 0 0 "[ . 1 . 2]" 1
789 1 41 LEU QD 1 65 LEU QD . . 3.740 3.389 3.228 3.549 . 0 0 "[ . 1 . 2]" 1
790 1 41 LEU QD 1 71 VAL H . . 5.440 4.194 4.115 4.327 . 0 0 "[ . 1 . 2]" 1
791 1 41 LEU QD 1 71 VAL HA . . 5.440 5.046 4.924 5.314 . 0 0 "[ . 1 . 2]" 1
792 1 41 LEU QD 1 71 VAL HB . . 4.410 3.726 3.517 3.957 . 0 0 "[ . 1 . 2]" 1
793 1 41 LEU QD 1 71 VAL QG . . 2.580 1.785 1.703 1.887 . 0 0 "[ . 1 . 2]" 1
794 1 41 LEU QD 1 73 PHE H . . 5.440 4.723 4.564 5.499 0.059 16 0 "[ . 1 . 2]" 1
795 1 41 LEU QD 1 73 PHE HA . . 5.400 4.706 4.620 5.310 . 0 0 "[ . 1 . 2]" 1
796 1 41 LEU QD 1 73 PHE QB . . 4.060 2.703 2.626 3.250 . 0 0 "[ . 1 . 2]" 1
797 1 41 LEU QD 1 73 PHE QD . . 3.310 2.517 2.427 3.233 . 0 0 "[ . 1 . 2]" 1
798 1 41 LEU QD 1 73 PHE QE . . 3.490 2.721 2.651 3.403 . 0 0 "[ . 1 . 2]" 1
799 1 41 LEU QD 1 73 PHE HZ . . 4.240 3.489 3.391 4.130 . 0 0 "[ . 1 . 2]" 1
800 1 41 LEU QD 1 86 ALA HA . . 4.540 4.056 3.962 4.371 . 0 0 "[ . 1 . 2]" 1
801 1 41 LEU QD 1 86 ALA MB . . 2.760 2.081 1.988 2.227 . 0 0 "[ . 1 . 2]" 1
802 1 41 LEU QD 1 89 VAL MG1 . . 3.590 3.020 2.746 3.247 . 0 0 "[ . 1 . 2]" 1
803 1 41 LEU QD 1 89 VAL MG2 . . 3.360 2.904 2.777 3.158 . 0 0 "[ . 1 . 2]" 1
804 1 41 LEU MD1 1 42 ASN H . . 5.080 4.795 3.819 4.966 . 0 0 "[ . 1 . 2]" 1
805 1 41 LEU MD1 1 43 PHE HB2 . . 5.500 4.270 4.092 5.566 0.066 16 0 "[ . 1 . 2]" 1
806 1 41 LEU MD1 1 53 PHE QD . . 3.450 2.572 2.430 3.034 . 0 0 "[ . 1 . 2]" 1
807 1 41 LEU MD1 1 53 PHE QE . . 3.780 3.365 1.752 3.541 . 0 0 "[ . 1 . 2]" 1
808 1 41 LEU MD1 1 53 PHE HZ . . 5.250 5.109 3.229 5.277 0.027 20 0 "[ . 1 . 2]" 1
809 1 41 LEU MD1 1 71 VAL QG . . 3.580 2.562 1.894 2.821 . 0 0 "[ . 1 . 2]" 1
810 1 41 LEU MD1 1 73 PHE QB . . 4.890 2.793 2.665 4.341 . 0 0 "[ . 1 . 2]" 1
811 1 41 LEU MD1 1 73 PHE QD . . 4.100 2.583 2.465 3.814 . 0 0 "[ . 1 . 2]" 1
812 1 41 LEU MD1 1 73 PHE QE . . 4.200 2.796 2.703 3.918 . 0 0 "[ . 1 . 2]" 1
813 1 41 LEU MD1 1 73 PHE HZ . . 5.220 3.596 3.441 5.299 0.079 16 0 "[ . 1 . 2]" 1
814 1 41 LEU MD1 1 89 VAL MG1 . . 4.520 3.606 3.326 3.847 . 0 0 "[ . 1 . 2]" 1
815 1 41 LEU MD1 1 89 VAL MG2 . . 4.080 3.079 2.905 4.015 . 0 0 "[ . 1 . 2]" 1
816 1 41 LEU MD2 1 42 ASN H . . 5.080 3.972 3.832 4.847 . 0 0 "[ . 1 . 2]" 1
817 1 41 LEU MD2 1 43 PHE HB2 . . 5.500 5.460 4.534 5.577 0.077 9 0 "[ . 1 . 2]" 1
818 1 41 LEU MD2 1 53 PHE QD . . 3.450 2.782 1.729 2.948 . 0 0 "[ . 1 . 2]" 1
819 1 41 LEU MD2 1 53 PHE QE . . 3.780 1.929 1.834 2.519 . 0 0 "[ . 1 . 2]" 1
820 1 41 LEU MD2 1 53 PHE HZ . . 5.250 3.624 3.443 4.372 . 0 0 "[ . 1 . 2]" 1
821 1 41 LEU MD2 1 71 VAL QG . . 3.580 1.890 1.742 3.341 . 0 0 "[ . 1 . 2]" 1
822 1 41 LEU MD2 1 73 PHE QB . . 4.890 4.039 3.357 4.210 . 0 0 "[ . 1 . 2]" 1
823 1 41 LEU MD2 1 73 PHE QD . . 4.100 3.698 3.492 3.830 . 0 0 "[ . 1 . 2]" 1
824 1 41 LEU MD2 1 73 PHE QE . . 4.200 3.876 3.737 3.975 . 0 0 "[ . 1 . 2]" 1
825 1 41 LEU MD2 1 73 PHE HZ . . 5.220 5.182 4.308 5.312 0.092 18 0 "[ . 1 . 2]" 1
826 1 41 LEU MD2 1 89 VAL MG1 . . 4.520 3.254 2.906 3.757 . 0 0 "[ . 1 . 2]" 1
827 1 41 LEU MD2 1 89 VAL MG2 . . 4.080 3.639 3.304 3.752 . 0 0 "[ . 1 . 2]" 1
828 1 41 LEU HG 1 51 LEU QD . . 5.040 4.235 3.993 4.414 . 0 0 "[ . 1 . 2]" 1
829 1 41 LEU HG 1 53 PHE QB . . 5.450 4.267 4.061 5.403 . 0 0 "[ . 1 . 2]" 1
830 1 41 LEU HG 1 53 PHE QD . . 4.070 2.416 2.227 4.117 0.047 16 0 "[ . 1 . 2]" 1
831 1 41 LEU HG 1 53 PHE QE . . 3.930 2.893 2.556 3.912 . 0 0 "[ . 1 . 2]" 1
832 1 41 LEU HG 1 53 PHE HZ . . 5.500 5.311 5.006 5.793 0.293 16 0 "[ . 1 . 2]" 1
833 1 41 LEU HG 1 71 VAL QG . . 4.580 3.930 2.550 4.153 . 0 0 "[ . 1 . 2]" 1
834 1 41 LEU HG 1 73 PHE QE . . 5.290 5.172 2.813 5.317 0.027 7 0 "[ . 1 . 2]" 1
835 1 41 LEU HG 1 89 VAL MG2 . . 5.100 4.794 4.614 4.964 . 0 0 "[ . 1 . 2]" 1
836 1 42 ASN H 1 42 ASN QB . . 2.970 2.315 2.081 2.652 . 0 0 "[ . 1 . 2]" 1
837 1 42 ASN H 1 43 PHE H . . 3.930 3.794 3.744 3.840 . 0 0 "[ . 1 . 2]" 1
838 1 42 ASN HA 1 43 PHE HA . . 4.690 4.318 4.292 4.362 . 0 0 "[ . 1 . 2]" 1
839 1 42 ASN HA 1 50 LYS HA . . 4.830 4.726 3.917 4.958 0.128 6 0 "[ . 1 . 2]" 1
840 1 42 ASN HA 1 50 LYS HD2 . . 3.760 2.483 1.839 3.178 . 0 0 "[ . 1 . 2]" 1
841 1 42 ASN QB 1 43 PHE HA . . 4.780 4.616 4.304 4.738 . 0 0 "[ . 1 . 2]" 1
842 1 43 PHE H 1 43 PHE HB2 . . 3.400 3.153 3.100 3.232 . 0 0 "[ . 1 . 2]" 1
843 1 43 PHE H 1 43 PHE HB3 . . 3.250 2.958 2.857 3.014 . 0 0 "[ . 1 . 2]" 1
844 1 43 PHE H 1 43 PHE QD . . 4.660 4.434 4.403 4.473 . 0 0 "[ . 1 . 2]" 1
845 1 43 PHE H 1 44 GLU H . . 4.470 3.753 3.643 3.944 . 0 0 "[ . 1 . 2]" 1
846 1 43 PHE H 1 44 GLU QG . . 4.960 4.074 3.457 4.969 0.009 9 0 "[ . 1 . 2]" 1
847 1 43 PHE H 1 50 LYS HD2 . . 3.540 3.039 2.492 3.565 0.025 9 0 "[ . 1 . 2]" 1
848 1 43 PHE H 1 51 LEU H . . 3.590 2.936 2.616 3.101 . 0 0 "[ . 1 . 2]" 1
849 1 43 PHE HA 1 43 PHE QD . . 3.620 2.968 2.849 3.103 . 0 0 "[ . 1 . 2]" 1
850 1 43 PHE HA 1 43 PHE QE . . 4.670 4.592 4.537 4.651 . 0 0 "[ . 1 . 2]" 1
851 1 43 PHE HA 1 44 GLU H . . 2.780 2.175 2.124 2.217 . 0 0 "[ . 1 . 2]" 1
852 1 43 PHE HA 1 44 GLU QB . . 5.070 4.386 4.277 4.551 . 0 0 "[ . 1 . 2]" 1
853 1 43 PHE HA 1 44 GLU QG . . 4.890 4.257 3.647 4.988 0.098 3 0 "[ . 1 . 2]" 1
854 1 43 PHE HA 1 51 LEU HB2 . . 5.500 4.719 4.602 4.932 . 0 0 "[ . 1 . 2]" 1
855 1 43 PHE HA 1 51 LEU HG . . 5.500 5.531 5.364 5.570 0.070 16 0 "[ . 1 . 2]" 1
856 1 43 PHE HA 1 73 PHE HZ . . 5.220 5.064 4.856 5.213 . 0 0 "[ . 1 . 2]" 1
857 1 43 PHE HB2 1 45 VAL QG . . 5.130 4.912 4.582 5.161 0.031 11 0 "[ . 1 . 2]" 1
858 1 43 PHE HB2 1 51 LEU HB2 . . 3.730 3.562 3.495 3.641 . 0 0 "[ . 1 . 2]" 1
859 1 43 PHE HB2 1 51 LEU HB3 . . 4.900 4.685 4.554 4.883 . 0 0 "[ . 1 . 2]" 1
860 1 43 PHE HB2 1 51 LEU QD . . 4.130 3.008 2.895 3.076 . 0 0 "[ . 1 . 2]" 1
861 1 43 PHE HB2 1 73 PHE QE . . 4.850 3.776 3.686 3.874 . 0 0 "[ . 1 . 2]" 1
862 1 43 PHE HB2 1 73 PHE HZ . . 4.520 2.753 2.559 2.897 . 0 0 "[ . 1 . 2]" 1
863 1 43 PHE HB3 1 44 GLU H . . 4.630 4.342 4.243 4.377 . 0 0 "[ . 1 . 2]" 1
864 1 43 PHE HB3 1 51 LEU H . . 4.370 3.458 3.288 3.606 . 0 0 "[ . 1 . 2]" 1
865 1 43 PHE HB3 1 51 LEU HA . . 4.660 4.718 4.631 4.796 0.136 6 0 "[ . 1 . 2]" 1
866 1 43 PHE HB3 1 51 LEU HB2 . . 4.220 2.096 2.027 2.192 . 0 0 "[ . 1 . 2]" 1
867 1 43 PHE HB3 1 51 LEU HB3 . . 4.620 3.463 3.332 3.721 . 0 0 "[ . 1 . 2]" 1
868 1 43 PHE HB3 1 51 LEU MD1 . . 4.310 1.978 1.862 2.104 . 0 0 "[ . 1 . 2]" 1
869 1 43 PHE HB3 1 51 LEU MD2 . . 4.310 4.259 4.193 4.302 . 0 0 "[ . 1 . 2]" 1
870 1 43 PHE HB3 1 51 LEU HG . . 3.200 3.036 2.949 3.143 . 0 0 "[ . 1 . 2]" 1
871 1 43 PHE HB3 1 73 PHE QD . . 5.500 5.592 5.529 5.664 0.164 14 0 "[ . 1 . 2]" 1
872 1 43 PHE HB3 1 73 PHE QE . . 4.500 3.844 3.769 3.932 . 0 0 "[ . 1 . 2]" 1
873 1 43 PHE HB3 1 73 PHE HZ . . 4.360 3.670 3.426 3.810 . 0 0 "[ . 1 . 2]" 1
874 1 43 PHE QD 1 44 GLU H . . 4.250 4.080 3.862 4.203 . 0 0 "[ . 1 . 2]" 1
875 1 43 PHE QD 1 44 GLU HA . . 5.040 4.445 4.174 4.743 . 0 0 "[ . 1 . 2]" 1
876 1 43 PHE QD 1 45 VAL HA . . 4.600 3.669 3.230 4.027 . 0 0 "[ . 1 . 2]" 1
877 1 43 PHE QD 1 45 VAL HB . . 5.130 4.707 4.322 5.069 . 0 0 "[ . 1 . 2]" 1
878 1 43 PHE QD 1 45 VAL QG . . 3.170 2.041 1.836 2.269 . 0 0 "[ . 1 . 2]" 1
879 1 43 PHE QD 1 51 LEU H . . 4.870 4.513 4.202 4.696 . 0 0 "[ . 1 . 2]" 1
880 1 43 PHE QD 1 51 LEU HB2 . . 3.720 3.551 3.363 3.717 . 0 0 "[ . 1 . 2]" 1
881 1 43 PHE QD 1 51 LEU MD1 . . 4.060 2.381 2.137 2.599 . 0 0 "[ . 1 . 2]" 1
882 1 43 PHE QD 1 51 LEU QD . . 3.470 2.362 2.126 2.566 . 0 0 "[ . 1 . 2]" 1
883 1 43 PHE QD 1 51 LEU MD2 . . 4.060 3.955 3.810 4.081 0.021 4 0 "[ . 1 . 2]" 1
884 1 43 PHE QD 1 51 LEU HG . . 4.090 2.513 2.302 2.672 . 0 0 "[ . 1 . 2]" 1
885 1 43 PHE QD 1 75 VAL QG . . 3.940 3.649 3.170 3.959 0.019 18 0 "[ . 1 . 2]" 1
886 1 43 PHE QE 1 45 VAL HA . . 4.210 3.286 2.866 3.608 . 0 0 "[ . 1 . 2]" 1
887 1 43 PHE QE 1 45 VAL HB . . 5.100 4.424 4.068 5.175 0.075 7 0 "[ . 1 . 2]" 1
888 1 43 PHE QE 1 45 VAL QG . . 3.220 2.230 2.026 2.642 . 0 0 "[ . 1 . 2]" 1
889 1 43 PHE QE 1 51 LEU MD1 . . 5.000 3.513 3.264 3.699 . 0 0 "[ . 1 . 2]" 1
890 1 43 PHE QE 1 51 LEU QD . . 3.630 3.440 3.208 3.599 . 0 0 "[ . 1 . 2]" 1
891 1 43 PHE QE 1 51 LEU MD2 . . 5.000 4.918 4.690 5.052 0.052 19 0 "[ . 1 . 2]" 1
892 1 43 PHE QE 1 75 VAL HB . . 5.500 4.038 3.717 4.413 . 0 0 "[ . 1 . 2]" 1
893 1 43 PHE QE 1 75 VAL MG1 . . 4.460 3.742 3.127 4.163 . 0 0 "[ . 1 . 2]" 1
894 1 43 PHE QE 1 75 VAL QG . . 3.270 2.629 2.165 2.980 . 0 0 "[ . 1 . 2]" 1
895 1 43 PHE QE 1 75 VAL MG2 . . 4.460 2.686 2.208 3.052 . 0 0 "[ . 1 . 2]" 1
896 1 43 PHE HZ 1 45 VAL HA . . 5.500 5.217 4.881 5.540 0.040 18 0 "[ . 1 . 2]" 1
897 1 43 PHE HZ 1 45 VAL QG . . 5.010 4.339 4.100 4.633 . 0 0 "[ . 1 . 2]" 1
898 1 43 PHE HZ 1 51 LEU QD . . 4.900 4.685 4.543 4.874 . 0 0 "[ . 1 . 2]" 1
899 1 43 PHE HZ 1 75 VAL MG1 . . 4.480 3.709 3.116 4.269 . 0 0 "[ . 1 . 2]" 1
900 1 43 PHE HZ 1 75 VAL QG . . 3.760 3.385 2.970 3.801 0.041 6 0 "[ . 1 . 2]" 1
901 1 43 PHE HZ 1 75 VAL MG2 . . 4.480 3.936 3.451 4.280 . 0 0 "[ . 1 . 2]" 1
902 1 44 GLU H 1 44 GLU QB . . 3.140 2.382 2.306 2.535 . 0 0 "[ . 1 . 2]" 1
903 1 44 GLU H 1 44 GLU QG . . 3.310 2.755 2.161 3.371 0.061 4 0 "[ . 1 . 2]" 1
904 1 44 GLU H 1 45 VAL H . . 4.600 4.234 4.138 4.356 . 0 0 "[ . 1 . 2]" 1
905 1 44 GLU H 1 45 VAL QG . . 4.660 4.538 4.385 4.731 0.071 7 0 "[ . 1 . 2]" 1
906 1 44 GLU HA 1 44 GLU QG . . 3.400 2.405 2.281 2.477 . 0 0 "[ . 1 . 2]" 1
907 1 44 GLU HA 1 45 VAL QG . . 4.240 3.294 3.177 3.435 . 0 0 "[ . 1 . 2]" 1
908 1 44 GLU HA 1 49 LYS H . . 3.630 3.782 3.697 3.896 0.266 12 0 "[ . 1 . 2]" 1
909 1 44 GLU HA 1 50 LYS HD3 . . 4.600 4.226 3.626 4.630 0.030 13 0 "[ . 1 . 2]" 1
910 1 44 GLU QB 1 45 VAL H . . 3.850 3.564 3.421 3.625 . 0 0 "[ . 1 . 2]" 1
911 1 44 GLU QB 1 45 VAL QG . . 4.490 4.251 4.175 4.527 0.037 8 0 "[ . 1 . 2]" 1
912 1 44 GLU QB 1 48 GLY QA . . 3.300 2.429 1.926 3.268 . 0 0 "[ . 1 . 2]" 1
913 1 44 GLU QG 1 45 VAL H . . 4.410 4.242 4.025 4.405 . 0 0 "[ . 1 . 2]" 1
914 1 44 GLU QG 1 48 GLY H . . 4.500 4.072 3.346 4.625 0.125 11 0 "[ . 1 . 2]" 1
915 1 44 GLU QG 1 48 GLY QA . . 3.220 2.527 1.782 3.275 0.055 14 0 "[ . 1 . 2]" 1
916 1 44 GLU QG 1 49 LYS H . . 4.340 3.942 3.291 4.370 0.030 5 0 "[ . 1 . 2]" 1
917 1 44 GLU QG 1 49 LYS HA . . 5.340 4.728 3.977 5.186 . 0 0 "[ . 1 . 2]" 1
918 1 44 GLU QG 1 50 LYS HA . . 4.360 3.215 2.467 4.088 . 0 0 "[ . 1 . 2]" 1
919 1 44 GLU QG 1 50 LYS HB2 . . 5.500 4.345 3.455 5.473 . 0 0 "[ . 1 . 2]" 1
920 1 44 GLU QG 1 50 LYS HD2 . . 4.530 3.873 2.506 4.623 0.093 1 0 "[ . 1 . 2]" 1
921 1 44 GLU QG 1 50 LYS HD3 . . 4.710 2.969 2.224 3.415 . 0 0 "[ . 1 . 2]" 1
922 1 44 GLU QG 1 50 LYS HE2 . . 5.500 4.187 3.088 5.286 . 0 0 "[ . 1 . 2]" 1
923 1 44 GLU QG 1 50 LYS HE3 . . 5.500 4.455 3.365 5.358 . 0 0 "[ . 1 . 2]" 1
924 1 45 VAL H 1 45 VAL HB . . 3.930 3.507 2.535 3.646 . 0 0 "[ . 1 . 2]" 1
925 1 45 VAL H 1 45 VAL QG . . 3.050 1.814 1.644 1.965 . 0 0 "[ . 1 . 2]" 1
926 1 45 VAL H 1 49 LYS QB . . 3.700 3.025 2.566 3.376 . 0 0 "[ . 1 . 2]" 1
927 1 45 VAL HA 1 45 VAL HB . . 2.790 2.553 2.448 2.995 0.205 7 0 "[ . 1 . 2]" 1
928 1 45 VAL HA 1 45 VAL QG . . 2.570 2.244 2.128 2.317 . 0 0 "[ . 1 . 2]" 1
929 1 45 VAL HA 1 49 LYS QB . . 5.160 4.837 4.173 5.194 0.034 16 0 "[ . 1 . 2]" 1
930 1 45 VAL HB 1 49 LYS QB . . 4.910 4.205 1.960 4.746 . 0 0 "[ . 1 . 2]" 1
931 1 45 VAL HB 1 83 LYS HA . . 4.300 4.301 3.669 4.417 0.117 6 0 "[ . 1 . 2]" 1
932 1 45 VAL HB 1 84 SER H . . 4.960 3.701 3.026 4.327 . 0 0 "[ . 1 . 2]" 1
933 1 45 VAL HB 1 84 SER QB . . 3.870 3.490 2.514 3.957 0.087 7 0 "[ . 1 . 2]" 1
934 1 45 VAL QG 1 46 GLU H . . 3.180 2.096 1.555 2.853 . 0 0 "[ . 1 . 2]" 1
935 1 45 VAL QG 1 46 GLU HA . . 4.240 3.815 3.424 3.994 . 0 0 "[ . 1 . 2]" 1
936 1 45 VAL QG 1 46 GLU QG . . 4.280 3.929 2.136 4.369 0.089 8 0 "[ . 1 . 2]" 1
937 1 45 VAL QG 1 48 GLY H . . 5.120 5.084 4.711 5.471 0.351 18 0 "[ . 1 . 2]" 1
938 1 45 VAL QG 1 49 LYS H . . 4.160 3.841 3.456 4.277 0.117 7 0 "[ . 1 . 2]" 1
939 1 45 VAL QG 1 49 LYS HA . . 5.030 4.322 4.046 5.030 . 8 0 "[ . 1 . 2]" 1
940 1 45 VAL QG 1 49 LYS QB . . 3.550 2.129 1.822 3.048 . 0 0 "[ . 1 . 2]" 1
941 1 45 VAL QG 1 49 LYS QE . . 4.440 3.984 2.907 4.577 0.137 7 0 "[ . 1 . 2]" 1
942 1 45 VAL QG 1 50 LYS HA . . 5.070 4.355 4.067 4.603 . 0 0 "[ . 1 . 2]" 1
943 1 45 VAL QG 1 51 LEU H . . 4.010 3.853 3.456 4.034 0.024 4 0 "[ . 1 . 2]" 1
944 1 45 VAL QG 1 51 LEU HA . . 3.550 3.374 2.912 3.626 0.076 5 0 "[ . 1 . 2]" 1
945 1 45 VAL QG 1 51 LEU HB2 . . 4.000 3.716 3.297 4.023 0.023 11 0 "[ . 1 . 2]" 1
946 1 45 VAL QG 1 51 LEU QD . . 3.270 2.349 2.089 2.594 . 0 0 "[ . 1 . 2]" 1
947 1 45 VAL QG 1 73 PHE QE . . 5.210 4.663 4.343 5.016 . 0 0 "[ . 1 . 2]" 1
948 1 45 VAL QG 1 83 LYS HA . . 3.580 2.839 2.510 3.261 . 0 0 "[ . 1 . 2]" 1
949 1 45 VAL QG 1 84 SER H . . 3.500 2.033 1.655 2.581 . 0 0 "[ . 1 . 2]" 1
950 1 45 VAL QG 1 84 SER QB . . 3.140 1.845 1.754 1.955 . 0 0 "[ . 1 . 2]" 1
951 1 45 VAL QG 1 85 SER HA . . 5.010 4.761 4.345 5.044 0.034 17 0 "[ . 1 . 2]" 1
952 1 46 GLU H 1 46 GLU QB . . 3.330 2.555 2.225 3.276 . 0 0 "[ . 1 . 2]" 1
953 1 46 GLU H 1 46 GLU QG . . 3.560 3.771 2.593 3.953 0.393 14 0 "[ . 1 . 2]" 1
954 1 46 GLU HA 1 46 GLU QG . . 3.450 2.988 2.563 3.346 . 0 0 "[ . 1 . 2]" 1
955 1 46 GLU HA 1 47 ASP H . . 2.570 2.323 2.158 2.619 0.049 13 0 "[ . 1 . 2]" 1
956 1 46 GLU HA 1 47 ASP QB . . 5.430 4.144 3.829 4.483 . 0 0 "[ . 1 . 2]" 1
957 1 46 GLU HA 1 49 LYS QB . . 5.500 4.250 3.870 4.959 . 0 0 "[ . 1 . 2]" 1
958 1 46 GLU QB 1 47 ASP H . . 3.880 3.590 2.843 3.955 0.075 6 0 "[ . 1 . 2]" 1
959 1 46 GLU QB 1 49 LYS HA . . 5.500 5.261 4.561 6.846 1.346 17 1 "[ . 1 . + 2]" 1
960 1 46 GLU QG 1 47 ASP H . . 4.330 2.892 1.714 4.057 . 0 0 "[ . 1 . 2]" 1
961 1 46 GLU QG 1 47 ASP QB . . 4.400 2.496 2.149 3.216 . 0 0 "[ . 1 . 2]" 1
962 1 46 GLU QG 1 49 LYS HA . . 5.500 5.428 4.801 5.610 0.110 15 0 "[ . 1 . 2]" 1
963 1 46 GLU QG 1 49 LYS QB . . 4.890 3.610 3.031 4.076 . 0 0 "[ . 1 . 2]" 1
964 1 47 ASP H 1 47 ASP QB . . 3.240 2.661 2.125 3.071 . 0 0 "[ . 1 . 2]" 1
965 1 47 ASP HA 1 47 ASP QB . . 2.610 2.400 2.347 2.500 . 0 0 "[ . 1 . 2]" 1
966 1 47 ASP HA 1 48 GLY H . . 2.920 2.786 2.359 3.085 0.165 17 0 "[ . 1 . 2]" 1
967 1 47 ASP HA 1 49 LYS H . . 4.800 4.437 3.947 4.805 0.005 11 0 "[ . 1 . 2]" 1
968 1 47 ASP QB 1 48 GLY H . . 4.020 3.831 3.623 4.038 0.018 18 0 "[ . 1 . 2]" 1
969 1 47 ASP QB 1 48 GLY HA2 . . 5.500 5.354 5.196 5.514 0.014 18 0 "[ . 1 . 2]" 1
970 1 47 ASP QB 1 48 GLY QA . . 4.650 4.364 4.131 4.484 . 0 0 "[ . 1 . 2]" 1
971 1 47 ASP QB 1 48 GLY HA3 . . 5.500 4.626 4.337 4.828 . 0 0 "[ . 1 . 2]" 1
972 1 47 ASP QB 1 49 LYS H . . 4.160 4.047 3.632 4.333 0.173 12 0 "[ . 1 . 2]" 1
973 1 47 ASP QB 1 49 LYS HA . . 5.500 5.442 4.772 5.694 0.194 16 0 "[ . 1 . 2]" 1
974 1 47 ASP QB 1 49 LYS QB . . 4.690 4.666 3.986 4.865 0.175 7 0 "[ . 1 . 2]" 1
975 1 47 ASP QB 1 49 LYS HG2 . . 4.280 3.674 3.139 4.312 0.032 20 0 "[ . 1 . 2]" 1
976 1 47 ASP QB 1 49 LYS HG3 . . 4.990 4.433 2.416 5.024 0.034 18 0 "[ . 1 . 2]" 1
977 1 48 GLY H 1 49 LYS H . . 3.080 2.348 2.109 2.502 . 0 0 "[ . 1 . 2]" 1
978 1 48 GLY H 1 49 LYS QB . . 4.380 4.210 3.889 4.452 0.072 19 0 "[ . 1 . 2]" 1
979 1 48 GLY H 1 49 LYS HG2 . . 5.500 4.801 4.162 5.495 . 0 0 "[ . 1 . 2]" 1
980 1 48 GLY QA 1 49 LYS HA . . 4.230 4.105 4.026 4.176 . 0 0 "[ . 1 . 2]" 1
981 1 48 GLY HA2 1 49 LYS H . . 3.550 3.085 2.947 3.280 . 0 0 "[ . 1 . 2]" 1
982 1 48 GLY HA2 1 49 LYS HA . . 4.900 4.703 4.612 4.834 . 0 0 "[ . 1 . 2]" 1
983 1 48 GLY HA2 1 49 LYS QB . . 5.500 4.970 4.836 5.111 . 0 0 "[ . 1 . 2]" 1
984 1 48 GLY HA3 1 49 LYS H . . 3.550 3.417 3.300 3.506 . 0 0 "[ . 1 . 2]" 1
985 1 48 GLY HA3 1 49 LYS HA . . 4.900 4.527 4.432 4.621 . 0 0 "[ . 1 . 2]" 1
986 1 48 GLY HA3 1 49 LYS QB . . 5.500 5.276 5.057 5.437 . 0 0 "[ . 1 . 2]" 1
987 1 49 LYS H 1 49 LYS QB . . 2.860 2.236 2.041 2.373 . 0 0 "[ . 1 . 2]" 1
988 1 49 LYS H 1 49 LYS QE . . 5.340 5.229 4.774 5.559 0.219 20 0 "[ . 1 . 2]" 1
989 1 49 LYS H 1 49 LYS HG2 . . 3.820 2.941 2.505 3.731 . 0 0 "[ . 1 . 2]" 1
990 1 49 LYS H 1 50 LYS H . . 4.770 4.354 4.299 4.434 . 0 0 "[ . 1 . 2]" 1
991 1 49 LYS HA 1 49 LYS QB . . 2.680 2.458 2.389 2.537 . 0 0 "[ . 1 . 2]" 1
992 1 49 LYS HA 1 49 LYS QD . . 4.090 2.376 1.948 4.045 . 0 0 "[ . 1 . 2]" 1
993 1 49 LYS HA 1 49 LYS HE2 . . 5.500 4.797 4.302 5.620 0.120 17 0 "[ . 1 . 2]" 1
994 1 49 LYS HA 1 49 LYS QE . . 4.830 4.003 3.042 4.859 0.029 1 0 "[ . 1 . 2]" 1
995 1 49 LYS HA 1 49 LYS HE3 . . 5.500 4.364 3.111 5.594 0.094 1 0 "[ . 1 . 2]" 1
996 1 49 LYS HA 1 49 LYS HG2 . . 3.380 2.683 2.302 2.973 . 0 0 "[ . 1 . 2]" 1
997 1 49 LYS HA 1 50 LYS H . . 2.670 2.159 2.125 2.197 . 0 0 "[ . 1 . 2]" 1
998 1 49 LYS QB 1 49 LYS QE . . 4.130 2.923 1.880 3.662 . 0 0 "[ . 1 . 2]" 1
999 1 49 LYS QE 1 49 LYS HG3 . . 3.490 2.422 2.176 3.430 . 0 0 "[ . 1 . 2]" 1
1000 1 49 LYS QE 1 83 LYS HA . . 4.460 4.124 3.173 4.590 0.130 3 0 "[ . 1 . 2]" 1
1001 1 49 LYS QE 1 83 LYS QB . . 4.610 2.312 1.918 4.245 . 0 0 "[ . 1 . 2]" 1
1002 1 49 LYS QE 1 83 LYS QG . . 3.320 3.424 3.314 3.583 0.263 13 0 "[ . 1 . 2]" 1
1003 1 49 LYS HG3 1 83 LYS HA . . 5.500 4.379 3.415 5.574 0.074 17 0 "[ . 1 . 2]" 1
1004 1 50 LYS H 1 50 LYS HB2 . . 3.540 2.271 2.082 2.401 . 0 0 "[ . 1 . 2]" 1
1005 1 50 LYS H 1 50 LYS HD3 . . 4.230 4.011 3.334 4.307 0.077 16 0 "[ . 1 . 2]" 1
1006 1 50 LYS HA 1 50 LYS HD3 . . 3.580 2.204 1.948 2.645 . 0 0 "[ . 1 . 2]" 1
1007 1 50 LYS HA 1 51 LEU H . . 2.860 2.170 2.131 2.247 . 0 0 "[ . 1 . 2]" 1
1008 1 50 LYS HB2 1 50 LYS HD3 . . 3.240 2.683 2.398 2.962 . 0 0 "[ . 1 . 2]" 1
1009 1 50 LYS HB2 1 50 LYS QE . . 4.330 2.796 1.928 4.167 . 0 0 "[ . 1 . 2]" 1
1010 1 50 LYS HB3 1 51 LEU H . . 3.960 3.892 3.145 4.062 0.102 11 0 "[ . 1 . 2]" 1
1011 1 51 LEU H 1 51 LEU HB3 . . 3.750 3.336 3.257 3.397 . 0 0 "[ . 1 . 2]" 1
1012 1 51 LEU H 1 51 LEU MD1 . . 4.280 4.090 4.020 4.180 . 0 0 "[ . 1 . 2]" 1
1013 1 51 LEU H 1 51 LEU MD2 . . 4.280 4.001 3.927 4.105 . 0 0 "[ . 1 . 2]" 1
1014 1 51 LEU H 1 51 LEU HG . . 4.120 3.458 3.298 3.679 . 0 0 "[ . 1 . 2]" 1
1015 1 51 LEU HA 1 51 LEU MD1 . . 3.860 3.738 3.726 3.759 . 0 0 "[ . 1 . 2]" 1
1016 1 51 LEU HA 1 51 LEU QD . . 2.720 1.847 1.827 1.899 . 0 0 "[ . 1 . 2]" 1
1017 1 51 LEU HA 1 51 LEU MD2 . . 3.860 1.851 1.831 1.904 . 0 0 "[ . 1 . 2]" 1
1018 1 51 LEU HA 1 51 LEU HG . . 3.480 2.703 2.654 2.747 . 0 0 "[ . 1 . 2]" 1
1019 1 51 LEU HA 1 52 PHE H . . 2.910 2.146 2.119 2.182 . 0 0 "[ . 1 . 2]" 1
1020 1 51 LEU HB2 1 51 LEU MD1 . . 3.220 2.421 2.364 2.453 . 0 0 "[ . 1 . 2]" 1
1021 1 51 LEU HB2 1 51 LEU MD2 . . 3.220 3.196 3.189 3.202 . 0 0 "[ . 1 . 2]" 1
1022 1 51 LEU HB3 1 51 LEU MD1 . . 3.220 2.300 2.276 2.334 . 0 0 "[ . 1 . 2]" 1
1023 1 51 LEU HB3 1 51 LEU QD . . 2.800 2.102 2.087 2.113 . 0 0 "[ . 1 . 2]" 1
1024 1 51 LEU HB3 1 51 LEU MD2 . . 3.220 2.432 2.379 2.470 . 0 0 "[ . 1 . 2]" 1
1025 1 51 LEU HB3 1 52 PHE H . . 3.570 3.532 3.357 3.616 0.046 13 0 "[ . 1 . 2]" 1
1026 1 51 LEU HB3 1 53 PHE QD . . 4.940 4.480 4.294 4.642 . 0 0 "[ . 1 . 2]" 1
1027 1 51 LEU HB3 1 85 SER HA . . 5.430 4.736 4.512 4.995 . 0 0 "[ . 1 . 2]" 1
1028 1 51 LEU HB3 1 86 ALA HA . . 5.500 5.245 4.951 5.525 0.025 14 0 "[ . 1 . 2]" 1
1029 1 51 LEU HB3 1 86 ALA MB . . 3.370 3.238 2.916 3.394 0.024 13 0 "[ . 1 . 2]" 1
1030 1 51 LEU QD 1 52 PHE H . . 3.280 2.497 2.274 2.688 . 0 0 "[ . 1 . 2]" 1
1031 1 51 LEU QD 1 52 PHE QD . . 4.410 3.721 3.541 3.889 . 0 0 "[ . 1 . 2]" 1
1032 1 51 LEU QD 1 53 PHE QB . . 4.700 4.134 3.941 4.282 . 0 0 "[ . 1 . 2]" 1
1033 1 51 LEU QD 1 73 PHE QB . . 4.510 3.926 3.790 4.038 . 0 0 "[ . 1 . 2]" 1
1034 1 51 LEU QD 1 73 PHE QD . . 3.460 2.777 2.670 2.868 . 0 0 "[ . 1 . 2]" 1
1035 1 51 LEU QD 1 73 PHE QE . . 3.210 2.059 1.981 2.138 . 0 0 "[ . 1 . 2]" 1
1036 1 51 LEU QD 1 73 PHE HZ . . 4.190 3.145 3.037 3.233 . 0 0 "[ . 1 . 2]" 1
1037 1 51 LEU QD 1 75 VAL HA . . 3.660 3.030 2.858 3.245 . 0 0 "[ . 1 . 2]" 1
1038 1 51 LEU QD 1 75 VAL HB . . 3.870 2.737 2.375 3.113 . 0 0 "[ . 1 . 2]" 1
1039 1 51 LEU QD 1 75 VAL QG . . 3.160 2.316 1.951 2.795 . 0 0 "[ . 1 . 2]" 1
1040 1 51 LEU QD 1 84 SER HA . . 4.470 3.954 3.758 4.131 . 0 0 "[ . 1 . 2]" 1
1041 1 51 LEU QD 1 84 SER QB . . 2.860 2.175 1.952 2.502 . 0 0 "[ . 1 . 2]" 1
1042 1 51 LEU QD 1 85 SER H . . 3.500 2.902 2.799 2.999 . 0 0 "[ . 1 . 2]" 1
1043 1 51 LEU QD 1 85 SER HA . . 2.850 2.207 2.061 2.314 . 0 0 "[ . 1 . 2]" 1
1044 1 51 LEU QD 1 86 ALA HA . . 3.500 3.191 3.088 3.287 . 0 0 "[ . 1 . 2]" 1
1045 1 51 LEU QD 1 86 ALA MB . . 3.380 2.534 2.351 2.759 . 0 0 "[ . 1 . 2]" 1
1046 1 51 LEU MD1 1 53 PHE QD . . 5.500 5.181 4.890 5.420 . 0 0 "[ . 1 . 2]" 1
1047 1 51 LEU MD1 1 73 PHE QB . . 5.190 4.085 3.920 4.208 . 0 0 "[ . 1 . 2]" 1
1048 1 51 LEU MD1 1 73 PHE QD . . 4.500 2.813 2.699 2.912 . 0 0 "[ . 1 . 2]" 1
1049 1 51 LEU MD1 1 73 PHE QE . . 4.440 2.064 1.985 2.143 . 0 0 "[ . 1 . 2]" 1
1050 1 51 LEU MD1 1 75 VAL HA . . 4.170 3.279 3.088 3.478 . 0 0 "[ . 1 . 2]" 1
1051 1 51 LEU MD1 1 84 SER QB . . 4.150 3.390 3.208 3.737 . 0 0 "[ . 1 . 2]" 1
1052 1 51 LEU MD1 1 85 SER HA . . 4.300 4.304 4.063 4.355 0.055 19 0 "[ . 1 . 2]" 1
1053 1 51 LEU MD1 1 86 ALA HA . . 4.090 3.543 3.351 3.729 . 0 0 "[ . 1 . 2]" 1
1054 1 51 LEU MD2 1 53 PHE QD . . 5.500 5.099 4.835 5.276 . 0 0 "[ . 1 . 2]" 1
1055 1 51 LEU MD2 1 73 PHE QB . . 5.190 5.088 4.927 5.228 0.038 17 0 "[ . 1 . 2]" 1
1056 1 51 LEU MD2 1 73 PHE QD . . 4.500 4.284 4.158 4.418 . 0 0 "[ . 1 . 2]" 1
1057 1 51 LEU MD2 1 73 PHE QE . . 4.440 4.228 4.098 4.383 . 0 0 "[ . 1 . 2]" 1
1058 1 51 LEU MD2 1 75 VAL HA . . 4.170 3.571 3.370 3.884 . 0 0 "[ . 1 . 2]" 1
1059 1 51 LEU MD2 1 84 SER QB . . 4.150 2.203 1.965 2.542 . 0 0 "[ . 1 . 2]" 1
1060 1 51 LEU MD2 1 85 SER HA . . 4.300 2.214 2.066 2.324 . 0 0 "[ . 1 . 2]" 1
1061 1 51 LEU MD2 1 86 ALA HA . . 4.090 3.632 3.503 3.807 . 0 0 "[ . 1 . 2]" 1
1062 1 51 LEU HG 1 84 SER QB . . 4.730 3.446 3.286 3.679 . 0 0 "[ . 1 . 2]" 1
1063 1 51 LEU HG 1 85 SER H . . 5.500 5.536 5.463 5.576 0.076 4 0 "[ . 1 . 2]" 1
1064 1 51 LEU HG 1 85 SER HA . . 5.500 4.993 4.778 5.214 . 0 0 "[ . 1 . 2]" 1
1065 1 52 PHE H 1 52 PHE QB . . 3.340 2.690 2.558 2.819 . 0 0 "[ . 1 . 2]" 1
1066 1 52 PHE H 1 52 PHE QD . . 4.100 2.313 2.079 2.526 . 0 0 "[ . 1 . 2]" 1
1067 1 52 PHE H 1 53 PHE H . . 4.630 4.499 4.474 4.523 . 0 0 "[ . 1 . 2]" 1
1068 1 52 PHE HA 1 53 PHE H . . 3.130 2.309 2.273 2.353 . 0 0 "[ . 1 . 2]" 1
1069 1 52 PHE HA 1 53 PHE QD . . 5.500 3.830 3.648 3.984 . 0 0 "[ . 1 . 2]" 1
1070 1 52 PHE HA 1 86 ALA MB . . 4.780 4.592 4.365 4.775 . 0 0 "[ . 1 . 2]" 1
1071 1 52 PHE QB 1 53 PHE H . . 3.300 2.661 2.558 2.738 . 0 0 "[ . 1 . 2]" 1
1072 1 52 PHE QB 1 85 SER HA . . 5.500 5.040 4.874 5.247 . 0 0 "[ . 1 . 2]" 1
1073 1 52 PHE QD 1 53 PHE H . . 3.820 3.153 3.024 3.344 . 0 0 "[ . 1 . 2]" 1
1074 1 52 PHE QD 1 53 PHE HA . . 3.900 3.336 3.140 3.801 . 0 0 "[ . 1 . 2]" 1
1075 1 52 PHE QD 1 54 HIS H . . 5.370 4.415 4.218 4.803 . 0 0 "[ . 1 . 2]" 1
1076 1 52 PHE QD 1 85 SER HA . . 4.390 3.850 3.501 4.155 . 0 0 "[ . 1 . 2]" 1
1077 1 52 PHE QD 1 85 SER QB . . 4.400 4.113 3.598 4.429 0.029 16 0 "[ . 1 . 2]" 1
1078 1 52 PHE QE 1 53 PHE HA . . 4.900 4.168 3.984 4.403 . 0 0 "[ . 1 . 2]" 1
1079 1 52 PHE QE 1 54 HIS HB3 . . 5.500 5.541 5.303 5.595 0.095 15 0 "[ . 1 . 2]" 1
1080 1 52 PHE QE 1 85 SER HA . . 5.340 3.961 3.603 4.283 . 0 0 "[ . 1 . 2]" 1
1081 1 52 PHE QE 1 85 SER QB . . 4.280 3.360 2.573 3.839 . 0 0 "[ . 1 . 2]" 1
1082 1 52 PHE HZ 1 85 SER QB . . 4.800 3.488 2.697 4.129 . 0 0 "[ . 1 . 2]" 1
1083 1 53 PHE H 1 53 PHE QD . . 3.660 3.258 3.161 3.356 . 0 0 "[ . 1 . 2]" 1
1084 1 53 PHE H 1 86 ALA MB . . 4.530 4.377 4.147 4.486 . 0 0 "[ . 1 . 2]" 1
1085 1 53 PHE H 1 89 VAL MG2 . . 5.500 5.340 5.222 5.508 0.008 6 0 "[ . 1 . 2]" 1
1086 1 53 PHE HA 1 53 PHE QD . . 3.760 3.729 3.716 3.751 . 0 0 "[ . 1 . 2]" 1
1087 1 53 PHE HA 1 54 HIS H . . 3.160 2.330 2.249 2.396 . 0 0 "[ . 1 . 2]" 1
1088 1 53 PHE HA 1 54 HIS HB3 . . 5.170 4.782 4.722 4.879 . 0 0 "[ . 1 . 2]" 1
1089 1 53 PHE HA 1 85 SER HA . . 5.320 4.592 4.241 4.875 . 0 0 "[ . 1 . 2]" 1
1090 1 53 PHE HA 1 86 ALA H . . 3.830 3.195 3.012 3.476 . 0 0 "[ . 1 . 2]" 1
1091 1 53 PHE HA 1 86 ALA MB . . 3.930 3.598 3.419 3.727 . 0 0 "[ . 1 . 2]" 1
1092 1 53 PHE QB 1 54 HIS H . . 3.380 2.693 2.532 2.817 . 0 0 "[ . 1 . 2]" 1
1093 1 53 PHE QB 1 54 HIS HA . . 5.500 4.628 4.569 4.673 . 0 0 "[ . 1 . 2]" 1
1094 1 53 PHE QB 1 57 GLU HB3 . . 4.480 4.068 3.827 4.290 . 0 0 "[ . 1 . 2]" 1
1095 1 53 PHE QB 1 58 VAL QG . . 5.440 4.351 4.188 4.870 . 0 0 "[ . 1 . 2]" 1
1096 1 53 PHE QB 1 86 ALA H . . 3.770 2.833 2.637 3.024 . 0 0 "[ . 1 . 2]" 1
1097 1 53 PHE QB 1 86 ALA HA . . 5.020 4.122 4.036 4.253 . 0 0 "[ . 1 . 2]" 1
1098 1 53 PHE QB 1 86 ALA MB . . 3.010 1.780 1.735 1.853 . 0 0 "[ . 1 . 2]" 1
1099 1 53 PHE QB 1 87 CYS HA . . 4.600 4.242 3.960 4.460 . 0 0 "[ . 1 . 2]" 1
1100 1 53 PHE QB 1 89 VAL HA . . 5.500 5.555 5.453 5.630 0.130 6 0 "[ . 1 . 2]" 1
1101 1 53 PHE QB 1 89 VAL HB . . 5.250 4.538 4.409 4.678 . 0 0 "[ . 1 . 2]" 1
1102 1 53 PHE QB 1 89 VAL MG1 . . 4.900 4.206 4.044 4.352 . 0 0 "[ . 1 . 2]" 1
1103 1 53 PHE QB 1 89 VAL MG2 . . 3.300 2.458 2.354 2.580 . 0 0 "[ . 1 . 2]" 1
1104 1 53 PHE QD 1 54 HIS H . . 4.340 3.261 3.019 3.465 . 0 0 "[ . 1 . 2]" 1
1105 1 53 PHE QD 1 54 HIS HA . . 4.920 3.739 3.502 3.976 . 0 0 "[ . 1 . 2]" 1
1106 1 53 PHE QD 1 55 MET HA . . 3.850 3.391 3.230 3.542 . 0 0 "[ . 1 . 2]" 1
1107 1 53 PHE QD 1 57 GLU HB2 . . 4.630 3.362 3.165 3.526 . 0 0 "[ . 1 . 2]" 1
1108 1 53 PHE QD 1 57 GLU HB3 . . 4.880 4.868 4.734 4.933 0.053 14 0 "[ . 1 . 2]" 1
1109 1 53 PHE QD 1 58 VAL H . . 5.010 4.264 4.006 4.564 . 0 0 "[ . 1 . 2]" 1
1110 1 53 PHE QD 1 58 VAL HA . . 5.120 4.683 4.442 4.976 . 0 0 "[ . 1 . 2]" 1
1111 1 53 PHE QD 1 58 VAL QG . . 3.920 2.755 2.592 3.475 . 0 0 "[ . 1 . 2]" 1
1112 1 53 PHE QD 1 65 LEU QD . . 5.440 4.495 4.132 4.804 . 0 0 "[ . 1 . 2]" 1
1113 1 53 PHE QD 1 71 VAL QG . . 5.350 4.359 4.210 4.531 . 0 0 "[ . 1 . 2]" 1
1114 1 53 PHE QD 1 73 PHE QB . . 5.500 4.712 4.498 4.892 . 0 0 "[ . 1 . 2]" 1
1115 1 53 PHE QD 1 86 ALA MB . . 3.380 2.800 2.723 2.889 . 0 0 "[ . 1 . 2]" 1
1116 1 53 PHE QD 1 89 VAL HB . . 4.700 4.252 4.028 4.430 . 0 0 "[ . 1 . 2]" 1
1117 1 53 PHE QD 1 89 VAL MG2 . . 3.340 2.836 2.646 2.943 . 0 0 "[ . 1 . 2]" 1
1118 1 53 PHE QE 1 54 HIS HA . . 5.500 5.108 4.895 5.320 . 0 0 "[ . 1 . 2]" 1
1119 1 53 PHE QE 1 55 MET HA . . 4.000 3.078 2.763 3.244 . 0 0 "[ . 1 . 2]" 1
1120 1 53 PHE QE 1 55 MET HG2 . . 5.500 4.528 3.555 5.571 0.071 13 0 "[ . 1 . 2]" 1
1121 1 53 PHE QE 1 55 MET HG3 . . 5.500 4.785 3.778 5.618 0.118 14 0 "[ . 1 . 2]" 1
1122 1 53 PHE QE 1 57 GLU HB2 . . 5.190 5.150 4.734 5.250 0.060 12 0 "[ . 1 . 2]" 1
1123 1 53 PHE QE 1 58 VAL HA . . 5.130 4.302 3.841 4.567 . 0 0 "[ . 1 . 2]" 1
1124 1 53 PHE QE 1 58 VAL QG . . 2.940 1.869 1.766 1.954 . 0 0 "[ . 1 . 2]" 1
1125 1 53 PHE QE 1 65 LEU HB3 . . 4.990 4.360 4.038 4.870 . 0 0 "[ . 1 . 2]" 1
1126 1 53 PHE QE 1 65 LEU QD . . 3.560 3.053 2.586 3.424 . 0 0 "[ . 1 . 2]" 1
1127 1 53 PHE QE 1 71 VAL QG . . 4.450 3.523 3.376 3.645 . 0 0 "[ . 1 . 2]" 1
1128 1 53 PHE QE 1 86 ALA MB . . 4.330 4.437 4.384 4.510 0.180 19 0 "[ . 1 . 2]" 1
1129 1 53 PHE QE 1 89 VAL HB . . 5.140 4.440 4.189 4.673 . 0 0 "[ . 1 . 2]" 1
1130 1 53 PHE QE 1 89 VAL MG1 . . 3.900 3.258 2.980 3.489 . 0 0 "[ . 1 . 2]" 1
1131 1 53 PHE QE 1 89 VAL MG2 . . 4.250 3.562 3.466 3.746 . 0 0 "[ . 1 . 2]" 1
1132 1 53 PHE HZ 1 55 MET HA . . 5.500 5.481 5.159 5.609 0.109 16 0 "[ . 1 . 2]" 1
1133 1 53 PHE HZ 1 58 VAL QG . . 3.890 3.279 3.044 3.427 . 0 0 "[ . 1 . 2]" 1
1134 1 53 PHE HZ 1 65 LEU HB3 . . 4.800 4.368 4.133 4.658 . 0 0 "[ . 1 . 2]" 1
1135 1 53 PHE HZ 1 65 LEU QD . . 3.350 2.365 2.146 2.652 . 0 0 "[ . 1 . 2]" 1
1136 1 53 PHE HZ 1 65 LEU HG . . 5.390 4.508 3.730 5.394 0.004 13 0 "[ . 1 . 2]" 1
1137 1 53 PHE HZ 1 71 VAL QG . . 4.780 3.982 3.675 4.141 . 0 0 "[ . 1 . 2]" 1
1138 1 53 PHE HZ 1 89 VAL MG1 . . 4.310 3.422 3.222 3.695 . 0 0 "[ . 1 . 2]" 1
1139 1 53 PHE HZ 1 89 VAL MG2 . . 5.240 4.392 4.231 4.618 . 0 0 "[ . 1 . 2]" 1
1140 1 54 HIS H 1 54 HIS QB . . 3.180 2.361 2.328 2.405 . 0 0 "[ . 1 . 2]" 1
1141 1 54 HIS H 1 55 MET H . . 4.860 4.544 4.479 4.564 . 0 0 "[ . 1 . 2]" 1
1142 1 54 HIS H 1 57 GLU HB3 . . 5.500 5.072 4.891 5.502 0.002 8 0 "[ . 1 . 2]" 1
1143 1 54 HIS H 1 85 SER QB . . 5.500 4.964 4.675 5.329 . 0 0 "[ . 1 . 2]" 1
1144 1 54 HIS H 1 86 ALA MB . . 5.500 4.858 4.718 5.101 . 0 0 "[ . 1 . 2]" 1
1145 1 54 HIS HA 1 54 HIS HD2 . . 4.050 2.505 2.270 2.751 . 0 0 "[ . 1 . 2]" 1
1146 1 54 HIS HA 1 55 MET QB . . 4.710 4.232 4.021 4.415 . 0 0 "[ . 1 . 2]" 1
1147 1 54 HIS QB 1 55 MET H . . 4.110 3.485 3.392 3.596 . 0 0 "[ . 1 . 2]" 1
1148 1 54 HIS QB 1 56 SER H . . 4.310 2.831 2.545 3.162 . 0 0 "[ . 1 . 2]" 1
1149 1 54 HIS HB2 1 54 HIS HD2 . . 3.790 3.179 2.991 3.378 . 0 0 "[ . 1 . 2]" 1
1150 1 54 HIS HB3 1 56 SER QB . . 5.320 3.088 2.587 4.129 . 0 0 "[ . 1 . 2]" 1
1151 1 54 HIS HE1 1 55 MET QB . . 5.340 4.736 4.357 5.260 . 0 0 "[ . 1 . 2]" 1
1152 1 54 HIS HE1 1 56 SER H . . 4.720 4.173 3.663 4.729 0.009 19 0 "[ . 1 . 2]" 1
1153 1 54 HIS HE1 1 56 SER QB . . 3.610 3.126 2.629 3.711 0.101 3 0 "[ . 1 . 2]" 1
1154 1 55 MET H 1 55 MET HB2 . . 3.440 2.236 2.047 2.628 . 0 0 "[ . 1 . 2]" 1
1155 1 55 MET H 1 55 MET QB . . 2.960 2.152 2.027 2.236 . 0 0 "[ . 1 . 2]" 1
1156 1 55 MET H 1 55 MET HB3 . . 3.440 3.196 2.319 3.523 0.083 17 0 "[ . 1 . 2]" 1
1157 1 55 MET H 1 55 MET HG2 . . 5.330 3.637 2.581 4.538 . 0 0 "[ . 1 . 2]" 1
1158 1 55 MET H 1 55 MET QG . . 4.600 3.238 2.538 4.007 . 0 0 "[ . 1 . 2]" 1
1159 1 55 MET H 1 55 MET HG3 . . 5.330 3.942 2.843 4.567 . 0 0 "[ . 1 . 2]" 1
1160 1 55 MET H 1 56 SER H . . 4.070 2.795 2.727 2.854 . 0 0 "[ . 1 . 2]" 1
1161 1 55 MET H 1 56 SER QB . . 5.280 4.536 4.407 4.945 . 0 0 "[ . 1 . 2]" 1
1162 1 55 MET HA 1 57 GLU H . . 4.090 3.795 3.631 4.058 . 0 0 "[ . 1 . 2]" 1
1163 1 55 MET HA 1 58 VAL HB . . 4.180 2.518 2.208 2.739 . 0 0 "[ . 1 . 2]" 1
1164 1 55 MET HA 1 58 VAL MG1 . . 3.690 3.752 3.614 3.904 0.214 13 0 "[ . 1 . 2]" 1
1165 1 55 MET HA 1 58 VAL QG . . 2.910 2.229 2.015 2.765 . 0 0 "[ . 1 . 2]" 1
1166 1 55 MET HA 1 58 VAL MG2 . . 3.690 2.249 2.024 2.853 . 0 0 "[ . 1 . 2]" 1
1167 1 55 MET HA 1 65 LEU QD . . 5.440 5.150 4.496 5.560 0.120 5 0 "[ . 1 . 2]" 1
1168 1 55 MET HA 1 89 VAL HB . . 5.500 5.541 5.384 5.627 0.127 6 0 "[ . 1 . 2]" 1
1169 1 55 MET HA 1 89 VAL MG1 . . 5.500 5.432 5.237 5.566 0.066 13 0 "[ . 1 . 2]" 1
1170 1 55 MET HA 1 89 VAL MG2 . . 5.500 5.279 5.111 5.439 . 0 0 "[ . 1 . 2]" 1
1171 1 55 MET QB 1 56 SER H . . 4.110 3.301 2.993 3.471 . 0 0 "[ . 1 . 2]" 1
1172 1 55 MET QB 1 56 SER QB . . 5.090 4.458 4.280 4.836 . 0 0 "[ . 1 . 2]" 1
1173 1 55 MET QB 1 57 GLU H . . 5.310 4.856 4.680 5.089 . 0 0 "[ . 1 . 2]" 1
1174 1 55 MET QB 1 58 VAL H . . 5.210 4.590 4.359 4.918 . 0 0 "[ . 1 . 2]" 1
1175 1 55 MET QB 1 58 VAL HB . . 4.670 3.677 3.316 4.229 . 0 0 "[ . 1 . 2]" 1
1176 1 55 MET QB 1 58 VAL QG . . 4.150 3.447 3.281 3.684 . 0 0 "[ . 1 . 2]" 1
1177 1 55 MET QB 1 62 THR MG . . 3.820 2.491 1.819 3.886 0.066 11 0 "[ . 1 . 2]" 1
1178 1 55 MET HB2 1 56 SER H . . 4.710 3.784 3.360 4.342 . 0 0 "[ . 1 . 2]" 1
1179 1 55 MET HB2 1 58 VAL MG1 . . 6.550 5.236 4.530 5.489 . 0 0 "[ . 1 . 2]" 1
1180 1 55 MET HB2 1 58 VAL MG2 . . 6.550 4.350 3.746 4.818 . 0 0 "[ . 1 . 2]" 1
1181 1 55 MET HB3 1 56 SER H . . 4.710 3.773 3.061 4.124 . 0 0 "[ . 1 . 2]" 1
1182 1 55 MET HB3 1 58 VAL MG1 . . 6.550 4.434 3.752 5.547 . 0 0 "[ . 1 . 2]" 1
1183 1 55 MET HB3 1 58 VAL MG2 . . 6.550 4.138 3.713 4.989 . 0 0 "[ . 1 . 2]" 1
1184 1 55 MET QG 1 58 VAL QG . . 3.980 2.805 2.164 3.497 . 0 0 "[ . 1 . 2]" 1
1185 1 55 MET HG2 1 58 VAL MG1 . . 5.270 4.188 2.508 5.210 . 0 0 "[ . 1 . 2]" 1
1186 1 55 MET HG2 1 58 VAL MG2 . . 5.270 3.511 2.297 4.078 . 0 0 "[ . 1 . 2]" 1
1187 1 55 MET HG3 1 58 VAL MG1 . . 5.270 4.170 2.733 5.078 . 0 0 "[ . 1 . 2]" 1
1188 1 55 MET HG3 1 58 VAL MG2 . . 5.270 3.613 2.299 4.459 . 0 0 "[ . 1 . 2]" 1
1189 1 56 SER H 1 56 SER QB . . 3.750 2.316 2.121 2.799 . 0 0 "[ . 1 . 2]" 1
1190 1 56 SER H 1 57 GLU H . . 3.760 2.414 2.195 2.696 . 0 0 "[ . 1 . 2]" 1
1191 1 56 SER H 1 58 VAL H . . 5.100 3.739 3.476 4.037 . 0 0 "[ . 1 . 2]" 1
1192 1 56 SER H 1 58 VAL HB . . 5.400 4.565 4.353 4.902 . 0 0 "[ . 1 . 2]" 1
1193 1 56 SER QB 1 57 GLU H . . 4.200 2.923 2.787 3.273 . 0 0 "[ . 1 . 2]" 1
1194 1 56 SER QB 1 57 GLU HB2 . . 5.050 4.844 4.555 5.175 0.125 15 0 "[ . 1 . 2]" 1
1195 1 56 SER QB 1 57 GLU QG . . 4.960 3.851 3.097 4.592 . 0 0 "[ . 1 . 2]" 1
1196 1 56 SER QB 1 58 VAL H . . 4.930 4.523 4.436 4.624 . 0 0 "[ . 1 . 2]" 1
1197 1 57 GLU H 1 57 GLU HB2 . . 3.330 2.437 2.300 2.598 . 0 0 "[ . 1 . 2]" 1
1198 1 57 GLU H 1 57 GLU HB3 . . 3.780 3.608 3.547 3.637 . 0 0 "[ . 1 . 2]" 1
1199 1 57 GLU H 1 57 GLU QG . . 3.650 3.053 2.066 3.459 . 0 0 "[ . 1 . 2]" 1
1200 1 57 GLU H 1 58 VAL H . . 3.120 2.360 2.226 2.446 . 0 0 "[ . 1 . 2]" 1
1201 1 57 GLU H 1 87 CYS HA . . 5.500 5.600 5.519 5.698 0.198 18 0 "[ . 1 . 2]" 1
1202 1 57 GLU H 1 89 VAL MG2 . . 4.740 4.590 4.344 4.749 0.009 20 0 "[ . 1 . 2]" 1
1203 1 57 GLU HA 1 57 GLU QG . . 3.780 2.571 2.377 3.069 . 0 0 "[ . 1 . 2]" 1
1204 1 57 GLU HA 1 58 VAL QG . . 5.440 4.910 4.857 4.981 . 0 0 "[ . 1 . 2]" 1
1205 1 57 GLU HA 1 87 CYS HA . . 5.300 4.666 4.284 4.939 . 0 0 "[ . 1 . 2]" 1
1206 1 57 GLU HA 1 89 VAL MG2 . . 4.910 4.542 4.321 4.727 . 0 0 "[ . 1 . 2]" 1
1207 1 57 GLU HB2 1 58 VAL HA . . 5.180 4.370 4.074 4.600 . 0 0 "[ . 1 . 2]" 1
1208 1 57 GLU HB2 1 58 VAL QG . . 5.010 3.988 3.729 4.743 . 0 0 "[ . 1 . 2]" 1
1209 1 57 GLU HB2 1 87 CYS HA . . 3.780 3.601 3.410 3.857 0.077 13 0 "[ . 1 . 2]" 1
1210 1 57 GLU HB2 1 88 ASN HA . . 5.500 5.073 4.754 5.517 0.017 4 0 "[ . 1 . 2]" 1
1211 1 57 GLU HB2 1 89 VAL HB . . 5.280 3.663 3.087 3.907 . 0 0 "[ . 1 . 2]" 1
1212 1 57 GLU HB2 1 89 VAL MG2 . . 3.720 2.715 2.254 2.989 . 0 0 "[ . 1 . 2]" 1
1213 1 57 GLU HB3 1 87 CYS HA . . 3.840 2.637 2.274 2.877 . 0 0 "[ . 1 . 2]" 1
1214 1 57 GLU HB3 1 88 ASN H . . 4.180 2.164 2.003 2.421 . 0 0 "[ . 1 . 2]" 1
1215 1 57 GLU HB3 1 89 VAL H . . 3.680 2.481 2.083 2.860 . 0 0 "[ . 1 . 2]" 1
1216 1 57 GLU HB3 1 89 VAL HB . . 4.120 3.691 3.489 3.849 . 0 0 "[ . 1 . 2]" 1
1217 1 57 GLU HB3 1 89 VAL MG1 . . 5.500 4.952 4.770 5.085 . 0 0 "[ . 1 . 2]" 1
1218 1 57 GLU HB3 1 89 VAL MG2 . . 3.890 2.582 2.378 2.765 . 0 0 "[ . 1 . 2]" 1
1219 1 57 GLU QG 1 58 VAL H . . 4.950 4.585 4.069 4.806 . 0 0 "[ . 1 . 2]" 1
1220 1 57 GLU QG 1 87 CYS HA . . 2.860 2.074 1.930 2.355 . 0 0 "[ . 1 . 2]" 1
1221 1 57 GLU QG 1 89 VAL HB . . 5.340 5.223 4.788 5.392 0.052 11 0 "[ . 1 . 2]" 1
1222 1 57 GLU QG 1 89 VAL MG2 . . 4.140 3.706 3.217 3.930 . 0 0 "[ . 1 . 2]" 1
1223 1 58 VAL H 1 58 VAL HB . . 2.780 2.117 2.056 2.201 . 0 0 "[ . 1 . 2]" 1
1224 1 58 VAL H 1 58 VAL MG1 . . 3.520 3.526 3.118 3.607 0.087 3 0 "[ . 1 . 2]" 1
1225 1 58 VAL H 1 58 VAL MG2 . . 3.520 2.786 2.547 3.350 . 0 0 "[ . 1 . 2]" 1
1226 1 58 VAL H 1 89 VAL HB . . 4.220 3.870 3.740 4.006 . 0 0 "[ . 1 . 2]" 1
1227 1 58 VAL H 1 89 VAL MG1 . . 4.800 4.882 4.811 4.945 0.145 20 0 "[ . 1 . 2]" 1
1228 1 58 VAL HA 1 58 VAL MG1 . . 3.000 2.768 2.679 3.044 0.044 20 0 "[ . 1 . 2]" 1
1229 1 58 VAL HA 1 58 VAL MG2 . . 3.000 2.164 2.082 2.205 . 0 0 "[ . 1 . 2]" 1
1230 1 58 VAL HA 1 65 LEU HB2 . . 5.000 4.423 4.092 4.884 . 0 0 "[ . 1 . 2]" 1
1231 1 58 VAL HA 1 65 LEU HB3 . . 5.500 4.921 4.659 5.401 . 0 0 "[ . 1 . 2]" 1
1232 1 58 VAL HA 1 89 VAL HB . . 2.910 1.981 1.864 2.093 . 0 0 "[ . 1 . 2]" 1
1233 1 58 VAL HA 1 89 VAL MG1 . . 3.250 2.854 2.700 3.064 . 0 0 "[ . 1 . 2]" 1
1234 1 58 VAL HA 1 89 VAL MG2 . . 4.280 3.586 3.427 3.724 . 0 0 "[ . 1 . 2]" 1
1235 1 58 VAL HB 1 62 THR HB . . 5.500 5.105 4.206 5.744 0.244 14 0 "[ . 1 . 2]" 1
1236 1 58 VAL HB 1 62 THR MG . . 4.520 3.560 3.014 4.044 . 0 0 "[ . 1 . 2]" 1
1237 1 58 VAL HB 1 65 LEU QD . . 5.110 4.604 3.736 5.189 0.079 18 0 "[ . 1 . 2]" 1
1238 1 58 VAL HB 1 89 VAL HB . . 4.500 4.599 4.527 4.647 0.147 2 0 "[ . 1 . 2]" 1
1239 1 58 VAL HB 1 89 VAL MG1 . . 4.980 4.876 4.705 4.991 0.011 3 0 "[ . 1 . 2]" 1
1240 1 58 VAL HB 1 89 VAL MG2 . . 5.230 5.266 5.167 5.324 0.094 10 0 "[ . 1 . 2]" 1
1241 1 58 VAL QG 1 59 GLN H . . 3.230 2.175 2.061 2.428 . 0 0 "[ . 1 . 2]" 1
1242 1 58 VAL QG 1 59 GLN QB . . 3.710 3.173 2.768 3.377 . 0 0 "[ . 1 . 2]" 1
1243 1 58 VAL QG 1 60 GLY H . . 4.620 3.893 3.620 4.587 . 0 0 "[ . 1 . 2]" 1
1244 1 58 VAL QG 1 60 GLY QA . . 4.250 4.266 4.002 4.412 0.162 11 0 "[ . 1 . 2]" 1
1245 1 58 VAL QG 1 62 THR HA . . 3.120 2.024 1.800 2.268 . 0 0 "[ . 1 . 2]" 1
1246 1 58 VAL QG 1 62 THR HB . . 3.870 3.702 3.223 3.963 0.093 18 0 "[ . 1 . 2]" 1
1247 1 58 VAL QG 1 62 THR MG . . 3.160 2.999 2.246 3.264 0.104 10 0 "[ . 1 . 2]" 1
1248 1 58 VAL QG 1 64 ALA MB . . 4.830 3.546 3.242 4.181 . 0 0 "[ . 1 . 2]" 1
1249 1 58 VAL QG 1 65 LEU HA . . 4.790 4.103 3.973 4.374 . 0 0 "[ . 1 . 2]" 1
1250 1 58 VAL QG 1 65 LEU HB3 . . 2.870 2.396 2.233 2.671 . 0 0 "[ . 1 . 2]" 1
1251 1 58 VAL QG 1 65 LEU QD . . 2.840 2.271 1.599 2.728 . 0 0 "[ . 1 . 2]" 1
1252 1 58 VAL QG 1 65 LEU HG . . 3.540 2.840 2.109 3.691 0.151 3 0 "[ . 1 . 2]" 1
1253 1 58 VAL QG 1 71 VAL QG . . 4.330 4.086 3.958 4.231 . 0 0 "[ . 1 . 2]" 1
1254 1 58 VAL QG 1 89 VAL HB . . 3.240 2.904 2.655 3.195 . 0 0 "[ . 1 . 2]" 1
1255 1 58 VAL QG 1 89 VAL MG1 . . 3.010 2.543 2.385 2.693 . 0 0 "[ . 1 . 2]" 1
1256 1 58 VAL QG 1 89 VAL MG2 . . 3.870 3.294 3.166 3.657 . 0 0 "[ . 1 . 2]" 1
1257 1 58 VAL MG1 1 62 THR HA . . 4.250 2.034 1.803 2.284 . 0 0 "[ . 1 . 2]" 1
1258 1 58 VAL MG1 1 62 THR HB . . 5.340 3.891 3.371 4.167 . 0 0 "[ . 1 . 2]" 1
1259 1 58 VAL MG1 1 62 THR MG . . 4.350 3.096 2.301 3.398 . 0 0 "[ . 1 . 2]" 1
1260 1 58 VAL MG1 1 65 LEU HA . . 5.500 4.433 4.237 5.477 . 0 0 "[ . 1 . 2]" 1
1261 1 58 VAL MG1 1 65 LEU HB2 . . 3.150 2.138 1.912 3.170 0.020 20 0 "[ . 1 . 2]" 1
1262 1 58 VAL MG1 1 65 LEU HB3 . . 3.690 2.803 2.450 3.516 . 0 0 "[ . 1 . 2]" 1
1263 1 58 VAL MG2 1 62 THR HA . . 4.250 3.654 3.466 3.931 . 0 0 "[ . 1 . 2]" 1
1264 1 58 VAL MG2 1 62 THR HB . . 5.340 4.661 4.102 4.961 . 0 0 "[ . 1 . 2]" 1
1265 1 58 VAL MG2 1 62 THR MG . . 4.350 4.083 3.072 4.378 0.028 19 0 "[ . 1 . 2]" 1
1266 1 58 VAL MG2 1 65 LEU HA . . 5.500 4.908 4.584 5.103 . 0 0 "[ . 1 . 2]" 1
1267 1 58 VAL MG2 1 65 LEU HB2 . . 3.150 2.985 2.557 3.186 0.036 14 0 "[ . 1 . 2]" 1
1268 1 58 VAL MG2 1 65 LEU HB3 . . 3.690 2.641 2.258 2.999 . 0 0 "[ . 1 . 2]" 1
1269 1 59 GLN H 1 59 GLN HA . . 2.890 2.792 2.703 2.820 . 0 0 "[ . 1 . 2]" 1
1270 1 59 GLN H 1 59 GLN HB2 . . 3.610 2.226 2.037 2.412 . 0 0 "[ . 1 . 2]" 1
1271 1 59 GLN H 1 59 GLN QB . . 3.060 2.124 2.013 2.201 . 0 0 "[ . 1 . 2]" 1
1272 1 59 GLN H 1 59 GLN HB3 . . 3.610 2.740 2.510 3.155 . 0 0 "[ . 1 . 2]" 1
1273 1 59 GLN H 1 59 GLN HG2 . . 4.660 4.219 3.713 4.407 . 0 0 "[ . 1 . 2]" 1
1274 1 59 GLN H 1 59 GLN QG . . 4.060 3.836 3.488 3.949 . 0 0 "[ . 1 . 2]" 1
1275 1 59 GLN H 1 59 GLN HG3 . . 4.660 4.414 4.232 4.511 . 0 0 "[ . 1 . 2]" 1
1276 1 59 GLN H 1 60 GLY H . . 4.760 4.217 4.077 4.657 . 0 0 "[ . 1 . 2]" 1
1277 1 59 GLN H 1 89 VAL HB . . 3.930 3.594 3.366 3.816 . 0 0 "[ . 1 . 2]" 1
1278 1 59 GLN H 1 89 VAL MG1 . . 4.140 3.243 2.837 3.719 . 0 0 "[ . 1 . 2]" 1
1279 1 59 GLN H 1 90 LEU HA . . 3.920 3.703 3.294 3.974 0.054 20 0 "[ . 1 . 2]" 1
1280 1 59 GLN HA 1 59 GLN QG . . 3.350 2.307 2.211 2.397 . 0 0 "[ . 1 . 2]" 1
1281 1 59 GLN HA 1 60 GLY H . . 3.450 2.250 2.164 2.411 . 0 0 "[ . 1 . 2]" 1
1282 1 59 GLN HA 1 60 GLY QA . . 4.290 3.841 3.809 3.898 . 0 0 "[ . 1 . 2]" 1
1283 1 59 GLN HA 1 90 LEU HA . . 4.090 3.673 3.216 4.016 . 0 0 "[ . 1 . 2]" 1
1284 1 59 GLN HA 1 90 LEU QD . . 3.250 2.993 2.143 3.289 0.039 15 0 "[ . 1 . 2]" 1
1285 1 59 GLN QB 1 59 GLN QG . . 2.370 2.012 2.002 2.045 . 0 0 "[ . 1 . 2]" 1
1286 1 59 GLN QB 1 60 GLY QA . . 5.180 4.306 4.048 4.446 . 0 0 "[ . 1 . 2]" 1
1287 1 59 GLN QB 1 64 ALA MB . . 4.850 3.470 3.152 3.830 . 0 0 "[ . 1 . 2]" 1
1288 1 59 GLN QB 1 65 LEU H . . 5.320 5.170 4.774 5.395 0.075 3 0 "[ . 1 . 2]" 1
1289 1 59 GLN QB 1 65 LEU HB2 . . 3.790 3.628 3.179 3.919 0.129 4 0 "[ . 1 . 2]" 1
1290 1 59 GLN QB 1 65 LEU QD . . 3.040 2.711 2.016 3.129 0.089 11 0 "[ . 1 . 2]" 1
1291 1 59 GLN QB 1 90 LEU HA . . 3.740 2.037 1.819 2.463 . 0 0 "[ . 1 . 2]" 1
1292 1 59 GLN QB 1 90 LEU QD . . 4.040 2.891 2.583 3.523 . 0 0 "[ . 1 . 2]" 1
1293 1 59 GLN QB 1 91 LYS HG2 . . 5.340 3.876 3.192 4.579 . 0 0 "[ . 1 . 2]" 1
1294 1 59 GLN QB 1 91 LYS HG3 . . 5.340 4.418 3.852 4.992 . 0 0 "[ . 1 . 2]" 1
1295 1 59 GLN QG 1 60 GLY H . . 4.210 3.776 2.439 4.237 0.027 15 0 "[ . 1 . 2]" 1
1296 1 59 GLN QG 1 60 GLY QA . . 5.080 4.302 3.661 4.968 . 0 0 "[ . 1 . 2]" 1
1297 1 59 GLN QG 1 65 LEU QD . . 4.260 4.090 3.643 4.341 0.081 2 0 "[ . 1 . 2]" 1
1298 1 59 GLN QG 1 90 LEU HA . . 4.370 2.458 2.159 2.820 . 0 0 "[ . 1 . 2]" 1
1299 1 59 GLN QG 1 90 LEU HB2 . . 4.490 4.479 3.950 4.752 0.262 11 0 "[ . 1 . 2]" 1
1300 1 59 GLN QG 1 90 LEU HB3 . . 4.110 3.459 3.196 3.698 . 0 0 "[ . 1 . 2]" 1
1301 1 59 GLN QG 1 90 LEU QD . . 3.250 2.013 1.698 2.731 . 0 0 "[ . 1 . 2]" 1
1302 1 59 GLN QG 1 90 LEU HG . . 4.760 3.629 1.811 4.388 . 0 0 "[ . 1 . 2]" 1
1303 1 59 GLN QG 1 91 LYS HB2 . . 3.730 3.093 2.403 3.755 0.025 13 0 "[ . 1 . 2]" 1
1304 1 60 GLY H 1 90 LEU QD . . 5.140 4.506 3.535 4.930 . 0 0 "[ . 1 . 2]" 1
1305 1 61 ASN HA 1 62 THR MG . . 5.130 3.356 3.081 3.677 . 0 0 "[ . 1 . 2]" 1
1306 1 61 ASN QB 1 62 THR MG . . 4.280 4.453 4.173 4.674 0.394 4 0 "[ . 1 . 2]" 1
1307 1 61 ASN QB 1 64 ALA MB . . 3.660 2.253 1.873 3.259 . 0 0 "[ . 1 . 2]" 1
1308 1 61 ASN QB 1 65 LEU H . . 5.130 4.938 4.667 5.164 0.034 4 0 "[ . 1 . 2]" 1
1309 1 62 THR HA 1 62 THR MG . . 3.150 2.357 2.247 2.440 . 0 0 "[ . 1 . 2]" 1
1310 1 62 THR HB 1 63 VAL H . . 4.670 3.998 3.637 4.233 . 0 0 "[ . 1 . 2]" 1
1311 1 62 THR MG 1 63 VAL H . . 3.970 3.897 3.719 4.030 0.060 16 0 "[ . 1 . 2]" 1
1312 1 63 VAL H 1 63 VAL HB . . 3.200 2.693 2.338 3.490 0.290 7 0 "[ . 1 . 2]" 1
1313 1 63 VAL H 1 63 VAL QG . . 3.060 2.080 1.649 2.392 . 0 0 "[ . 1 . 2]" 1
1314 1 63 VAL HA 1 63 VAL MG1 . . 3.220 2.392 2.231 3.201 . 0 0 "[ . 1 . 2]" 1
1315 1 63 VAL HA 1 63 VAL QG . . 2.680 2.148 2.132 2.217 . 0 0 "[ . 1 . 2]" 1
1316 1 63 VAL HA 1 63 VAL MG2 . . 3.220 2.537 2.222 3.176 . 0 0 "[ . 1 . 2]" 1
1317 1 63 VAL HA 1 64 ALA HA . . 5.050 4.613 4.510 4.702 . 0 0 "[ . 1 . 2]" 1
1318 1 63 VAL HA 1 64 ALA MB . . 5.110 4.845 4.739 4.941 . 0 0 "[ . 1 . 2]" 1
1319 1 63 VAL HB 1 64 ALA H . . 4.020 3.762 3.382 4.147 0.127 7 0 "[ . 1 . 2]" 1
1320 1 63 VAL HB 1 64 ALA MB . . 4.900 4.464 4.057 5.125 0.225 15 0 "[ . 1 . 2]" 1
1321 1 63 VAL QG 1 64 ALA H . . 3.760 3.547 2.742 3.732 . 0 0 "[ . 1 . 2]" 1
1322 1 63 VAL QG 1 64 ALA HA . . 4.790 3.930 3.002 4.136 . 0 0 "[ . 1 . 2]" 1
1323 1 63 VAL MG1 1 64 ALA H . . 4.440 4.093 2.778 4.362 . 0 0 "[ . 1 . 2]" 1
1324 1 63 VAL MG2 1 64 ALA H . . 4.440 4.000 3.108 4.252 . 0 0 "[ . 1 . 2]" 1
1325 1 64 ALA H 1 64 ALA MB . . 3.030 2.331 2.252 2.424 . 0 0 "[ . 1 . 2]" 1
1326 1 64 ALA HA 1 65 LEU HA . . 4.720 4.541 4.423 4.624 . 0 0 "[ . 1 . 2]" 1
1327 1 64 ALA HA 1 65 LEU QD . . 5.440 5.358 5.045 5.653 0.213 20 0 "[ . 1 . 2]" 1
1328 1 64 ALA HA 1 66 HIS HD2 . . 4.860 4.499 3.478 4.895 0.035 15 0 "[ . 1 . 2]" 1
1329 1 64 ALA MB 1 65 LEU QD . . 4.600 4.042 3.796 4.322 . 0 0 "[ . 1 . 2]" 1
1330 1 65 LEU H 1 65 LEU HB3 . . 3.100 2.849 2.700 2.989 . 0 0 "[ . 1 . 2]" 1
1331 1 65 LEU H 1 65 LEU QD . . 3.930 3.731 3.586 3.946 0.016 10 0 "[ . 1 . 2]" 1
1332 1 65 LEU H 1 66 HIS H . . 4.650 4.378 4.206 4.478 . 0 0 "[ . 1 . 2]" 1
1333 1 65 LEU HA 1 65 LEU QD . . 2.970 2.295 1.829 2.983 0.013 10 0 "[ . 1 . 2]" 1
1334 1 65 LEU HA 1 65 LEU HG . . 3.830 3.096 2.183 3.693 . 0 0 "[ . 1 . 2]" 1
1335 1 65 LEU HA 1 66 HIS H . . 2.820 2.191 2.169 2.211 . 0 0 "[ . 1 . 2]" 1
1336 1 65 LEU HA 1 66 HIS HD2 . . 5.360 4.111 3.181 5.398 0.038 6 0 "[ . 1 . 2]" 1
1337 1 65 LEU HA 1 91 LYS HD3 . . 4.110 3.377 2.283 4.187 0.077 5 0 "[ . 1 . 2]" 1
1338 1 65 LEU HA 1 91 LYS HG2 . . 3.640 2.638 2.071 3.058 . 0 0 "[ . 1 . 2]" 1
1339 1 65 LEU HB3 1 65 LEU QD . . 2.750 2.141 2.029 2.277 . 0 0 "[ . 1 . 2]" 1
1340 1 65 LEU HB3 1 66 HIS H . . 4.540 3.978 3.842 4.057 . 0 0 "[ . 1 . 2]" 1
1341 1 65 LEU HB3 1 71 VAL QG . . 4.750 4.578 4.417 4.667 . 0 0 "[ . 1 . 2]" 1
1342 1 65 LEU HB3 1 89 VAL MG1 . . 5.350 4.277 4.002 4.556 . 0 0 "[ . 1 . 2]" 1
1343 1 65 LEU QD 1 66 HIS H . . 4.070 2.628 2.097 3.499 . 0 0 "[ . 1 . 2]" 1
1344 1 65 LEU QD 1 71 VAL HA . . 4.530 3.794 3.307 4.435 . 0 0 "[ . 1 . 2]" 1
1345 1 65 LEU QD 1 71 VAL HB . . 3.300 2.996 2.649 3.339 0.039 6 0 "[ . 1 . 2]" 1
1346 1 65 LEU QD 1 71 VAL QG . . 2.850 1.693 1.557 1.929 . 0 0 "[ . 1 . 2]" 1
1347 1 65 LEU QD 1 89 VAL HB . . 4.770 3.859 3.050 4.496 . 0 0 "[ . 1 . 2]" 1
1348 1 65 LEU QD 1 89 VAL MG1 . . 3.220 2.169 1.710 2.600 . 0 0 "[ . 1 . 2]" 1
1349 1 65 LEU QD 1 90 LEU H . . 4.700 4.378 3.809 4.755 0.055 18 0 "[ . 1 . 2]" 1
1350 1 65 LEU QD 1 90 LEU HA . . 4.560 3.774 3.040 4.377 . 0 0 "[ . 1 . 2]" 1
1351 1 65 LEU QD 1 91 LYS HA . . 3.710 2.701 2.233 3.296 . 0 0 "[ . 1 . 2]" 1
1352 1 65 LEU QD 1 91 LYS HB2 . . 3.860 3.088 2.264 3.569 . 0 0 "[ . 1 . 2]" 1
1353 1 65 LEU QD 1 91 LYS HD2 . . 3.820 3.339 2.688 3.759 . 0 0 "[ . 1 . 2]" 1
1354 1 65 LEU QD 1 91 LYS HD3 . . 3.710 3.207 2.739 3.880 0.170 10 0 "[ . 1 . 2]" 1
1355 1 65 LEU QD 1 91 LYS QE . . 4.800 4.292 3.961 4.671 . 0 0 "[ . 1 . 2]" 1
1356 1 65 LEU QD 1 91 LYS HG2 . . 3.130 1.971 1.723 2.535 . 0 0 "[ . 1 . 2]" 1
1357 1 65 LEU MD1 1 66 HIS H . . 4.830 3.278 2.118 4.753 . 0 0 "[ . 1 . 2]" 1
1358 1 65 LEU MD1 1 69 ASP HB2 . . 5.500 4.634 3.261 5.573 0.073 13 0 "[ . 1 . 2]" 1
1359 1 65 LEU MD1 1 89 VAL HB . . 5.500 4.266 3.178 5.080 . 0 0 "[ . 1 . 2]" 1
1360 1 65 LEU MD1 1 89 VAL MG1 . . 3.980 2.423 1.754 2.895 . 0 0 "[ . 1 . 2]" 1
1361 1 65 LEU MD2 1 66 HIS H . . 4.830 2.921 2.417 3.629 . 0 0 "[ . 1 . 2]" 1
1362 1 65 LEU MD2 1 69 ASP HB2 . . 5.500 4.152 3.210 4.691 . 0 0 "[ . 1 . 2]" 1
1363 1 65 LEU MD2 1 89 VAL HB . . 5.500 4.517 3.755 5.093 . 0 0 "[ . 1 . 2]" 1
1364 1 65 LEU MD2 1 89 VAL MG1 . . 3.980 2.501 2.005 2.944 . 0 0 "[ . 1 . 2]" 1
1365 1 65 LEU HG 1 66 HIS H . . 4.820 4.128 3.045 4.834 0.014 14 0 "[ . 1 . 2]" 1
1366 1 65 LEU HG 1 71 VAL HA . . 5.500 5.643 5.275 5.833 0.333 11 0 "[ . 1 . 2]" 1
1367 1 65 LEU HG 1 71 VAL QG . . 3.830 2.904 2.501 3.284 . 0 0 "[ . 1 . 2]" 1
1368 1 65 LEU HG 1 89 VAL MG1 . . 3.640 2.806 2.037 3.790 0.150 10 0 "[ . 1 . 2]" 1
1369 1 65 LEU HG 1 90 LEU HA . . 5.500 5.533 5.183 5.762 0.262 16 0 "[ . 1 . 2]" 1
1370 1 66 HIS H 1 66 HIS HB2 . . 3.160 2.650 2.572 2.777 . 0 0 "[ . 1 . 2]" 1
1371 1 66 HIS H 1 66 HIS HB3 . . 3.720 3.767 3.734 3.789 0.069 20 0 "[ . 1 . 2]" 1
1372 1 66 HIS H 1 67 PRO HD3 . . 5.210 5.051 4.991 5.131 . 0 0 "[ . 1 . 2]" 1
1373 1 66 HIS H 1 69 ASP H . . 4.820 4.490 4.178 4.789 . 0 0 "[ . 1 . 2]" 1
1374 1 66 HIS H 1 71 VAL QG . . 5.500 4.161 3.944 4.452 . 0 0 "[ . 1 . 2]" 1
1375 1 66 HIS HB2 1 66 HIS HD2 . . 3.610 2.734 2.653 2.962 . 0 0 "[ . 1 . 2]" 1
1376 1 66 HIS HB2 1 67 PRO HA . . 5.500 5.238 4.995 5.428 . 0 0 "[ . 1 . 2]" 1
1377 1 66 HIS HB2 1 67 PRO HD2 . . 3.870 3.672 3.526 3.742 . 0 0 "[ . 1 . 2]" 1
1378 1 66 HIS HB2 1 67 PRO HD3 . . 4.780 4.798 4.708 4.830 0.050 9 0 "[ . 1 . 2]" 1
1379 1 66 HIS HB3 1 67 PRO HD2 . . 3.530 2.147 1.932 2.315 . 0 0 "[ . 1 . 2]" 1
1380 1 66 HIS HB3 1 67 PRO HD3 . . 3.770 3.638 3.490 3.807 0.037 5 0 "[ . 1 . 2]" 1
1381 1 67 PRO HA 1 68 GLY H . . 2.920 2.183 2.144 2.226 . 0 0 "[ . 1 . 2]" 1
1382 1 67 PRO HA 1 68 GLY HA3 . . 4.510 4.430 4.407 4.462 . 0 0 "[ . 1 . 2]" 1
1383 1 67 PRO HA 1 69 ASP H . . 3.900 3.332 3.178 3.616 . 0 0 "[ . 1 . 2]" 1
1384 1 67 PRO HB2 1 68 GLY H . . 4.240 3.420 3.171 3.771 . 0 0 "[ . 1 . 2]" 1
1385 1 67 PRO HB2 1 68 GLY HA2 . . 5.500 4.692 4.568 4.854 . 0 0 "[ . 1 . 2]" 1
1386 1 67 PRO QG 1 68 GLY HA3 . . 5.500 4.832 4.727 4.938 . 0 0 "[ . 1 . 2]" 1
1387 1 68 GLY H 1 69 ASP H . . 3.260 2.535 2.346 2.696 . 0 0 "[ . 1 . 2]" 1
1388 1 68 GLY H 1 69 ASP HB2 . . 5.210 4.663 4.354 5.014 . 0 0 "[ . 1 . 2]" 1
1389 1 69 ASP H 1 69 ASP HB2 . . 3.440 2.325 2.185 2.501 . 0 0 "[ . 1 . 2]" 1
1390 1 69 ASP H 1 69 ASP HB3 . . 3.630 3.306 2.752 3.605 . 0 0 "[ . 1 . 2]" 1
1391 1 69 ASP H 1 70 THR H . . 5.040 4.584 4.551 4.623 . 0 0 "[ . 1 . 2]" 1
1392 1 69 ASP HA 1 70 THR H . . 2.890 2.305 2.214 2.398 . 0 0 "[ . 1 . 2]" 1
1393 1 69 ASP HB2 1 70 THR H . . 4.400 4.079 3.941 4.247 . 0 0 "[ . 1 . 2]" 1
1394 1 69 ASP HB2 1 71 VAL QG . . 4.270 3.759 3.034 4.425 0.155 11 0 "[ . 1 . 2]" 1
1395 1 69 ASP HB3 1 70 THR H . . 3.420 3.012 2.696 3.386 . 0 0 "[ . 1 . 2]" 1
1396 1 69 ASP HB3 1 71 VAL QG . . 4.330 3.191 2.980 3.642 . 0 0 "[ . 1 . 2]" 1
1397 1 69 ASP HB3 1 91 LYS HG2 . . 5.200 4.440 3.402 4.994 . 0 0 "[ . 1 . 2]" 1
1398 1 70 THR H 1 70 THR HB . . 3.120 2.752 2.691 2.819 . 0 0 "[ . 1 . 2]" 1
1399 1 70 THR H 1 70 THR MG . . 3.840 3.774 3.721 3.805 . 0 0 "[ . 1 . 2]" 1
1400 1 70 THR H 1 71 VAL QG . . 4.390 4.108 3.963 4.245 . 0 0 "[ . 1 . 2]" 1
1401 1 70 THR H 1 91 LYS HD2 . . 5.500 4.503 3.968 4.949 . 0 0 "[ . 1 . 2]" 1
1402 1 70 THR H 1 92 ILE HB . . 4.920 4.535 4.415 4.700 . 0 0 "[ . 1 . 2]" 1
1403 1 70 THR H 1 92 ILE MG . . 5.040 4.926 4.802 5.057 0.017 15 0 "[ . 1 . 2]" 1
1404 1 70 THR H 1 94 ASP H . . 5.390 4.720 4.026 5.440 0.050 4 0 "[ . 1 . 2]" 1
1405 1 70 THR HA 1 70 THR MG . . 2.860 2.241 2.193 2.289 . 0 0 "[ . 1 . 2]" 1
1406 1 70 THR HA 1 71 VAL H . . 2.880 2.212 2.179 2.250 . 0 0 "[ . 1 . 2]" 1
1407 1 70 THR HA 1 71 VAL HA . . 4.950 4.427 4.395 4.459 . 0 0 "[ . 1 . 2]" 1
1408 1 70 THR HA 1 71 VAL QG . . 4.420 3.218 3.106 3.283 . 0 0 "[ . 1 . 2]" 1
1409 1 70 THR HB 1 71 VAL H . . 4.110 3.850 3.746 3.936 . 0 0 "[ . 1 . 2]" 1
1410 1 70 THR HB 1 71 VAL HA . . 5.080 4.420 4.299 4.528 . 0 0 "[ . 1 . 2]" 1
1411 1 70 THR HB 1 92 ILE H . . 4.620 3.726 3.432 3.924 . 0 0 "[ . 1 . 2]" 1
1412 1 70 THR HB 1 92 ILE HB . . 3.310 2.349 2.273 2.449 . 0 0 "[ . 1 . 2]" 1
1413 1 70 THR HB 1 92 ILE MD . . 4.880 4.968 4.912 5.014 0.134 12 0 "[ . 1 . 2]" 1
1414 1 70 THR HB 1 92 ILE HG12 . . 4.900 4.768 4.678 4.900 . 0 0 "[ . 1 . 2]" 1
1415 1 70 THR HB 1 92 ILE HG13 . . 4.610 4.623 4.533 4.685 0.075 19 0 "[ . 1 . 2]" 1
1416 1 70 THR HB 1 92 ILE MG . . 2.980 2.623 2.524 2.736 . 0 0 "[ . 1 . 2]" 1
1417 1 70 THR HB 1 93 ASN H . . 4.970 4.697 4.093 5.038 0.068 8 0 "[ . 1 . 2]" 1
1418 1 70 THR MG 1 71 VAL H . . 3.210 2.473 2.323 2.602 . 0 0 "[ . 1 . 2]" 1
1419 1 70 THR MG 1 71 VAL HA . . 4.330 3.859 3.762 4.003 . 0 0 "[ . 1 . 2]" 1
1420 1 70 THR MG 1 71 VAL QG . . 3.980 3.733 3.637 3.821 . 0 0 "[ . 1 . 2]" 1
1421 1 70 THR MG 1 92 ILE HB . . 3.100 2.369 2.124 2.590 . 0 0 "[ . 1 . 2]" 1
1422 1 70 THR MG 1 92 ILE MG . . 2.980 2.446 2.302 2.658 . 0 0 "[ . 1 . 2]" 1
1423 1 70 THR MG 1 93 ASN H . . 5.500 5.289 4.704 5.550 0.050 3 0 "[ . 1 . 2]" 1
1424 1 71 VAL H 1 71 VAL QG . . 2.930 2.232 2.200 2.263 . 0 0 "[ . 1 . 2]" 1
1425 1 71 VAL H 1 89 VAL MG1 . . 5.500 5.483 5.394 5.540 0.040 5 0 "[ . 1 . 2]" 1
1426 1 71 VAL H 1 92 ILE H . . 4.530 4.444 4.216 4.596 0.066 13 0 "[ . 1 . 2]" 1
1427 1 71 VAL HA 1 71 VAL HB . . 2.920 2.420 2.351 2.490 . 0 0 "[ . 1 . 2]" 1
1428 1 71 VAL HA 1 71 VAL QG . . 2.790 2.314 2.245 2.400 . 0 0 "[ . 1 . 2]" 1
1429 1 71 VAL HA 1 72 GLU H . . 2.930 2.291 2.182 2.379 . 0 0 "[ . 1 . 2]" 1
1430 1 71 VAL HA 1 72 GLU HA . . 4.430 4.387 4.325 4.430 . 0 0 "[ . 1 . 2]" 1
1431 1 71 VAL HA 1 72 GLU HG2 . . 5.500 5.546 4.686 5.824 0.324 18 0 "[ . 1 . 2]" 1
1432 1 71 VAL HA 1 89 VAL MG1 . . 4.660 4.284 4.080 4.478 . 0 0 "[ . 1 . 2]" 1
1433 1 71 VAL HA 1 90 LEU H . . 5.170 4.577 4.283 4.779 . 0 0 "[ . 1 . 2]" 1
1434 1 71 VAL HA 1 91 LYS HA . . 4.730 2.925 2.699 3.042 . 0 0 "[ . 1 . 2]" 1
1435 1 71 VAL HA 1 91 LYS HB3 . . 5.500 5.520 5.323 5.625 0.125 18 0 "[ . 1 . 2]" 1
1436 1 71 VAL HA 1 91 LYS HD3 . . 5.500 5.327 4.909 5.533 0.033 7 0 "[ . 1 . 2]" 1
1437 1 71 VAL HA 1 92 ILE H . . 3.410 2.364 1.855 2.625 . 0 0 "[ . 1 . 2]" 1
1438 1 71 VAL HA 1 92 ILE HA . . 4.920 4.499 4.307 4.648 . 0 0 "[ . 1 . 2]" 1
1439 1 71 VAL HA 1 92 ILE HB . . 4.020 2.844 2.620 2.998 . 0 0 "[ . 1 . 2]" 1
1440 1 71 VAL HA 1 92 ILE MD . . 4.050 4.000 3.876 4.100 0.050 19 0 "[ . 1 . 2]" 1
1441 1 71 VAL HA 1 92 ILE HG12 . . 3.480 2.335 2.183 2.471 . 0 0 "[ . 1 . 2]" 1
1442 1 71 VAL HA 1 92 ILE HG13 . . 3.480 3.382 3.083 3.507 0.027 5 0 "[ . 1 . 2]" 1
1443 1 71 VAL HA 1 92 ILE MG . . 4.260 4.320 4.139 4.427 0.167 6 0 "[ . 1 . 2]" 1
1444 1 71 VAL HB 1 72 GLU H . . 3.210 2.471 2.293 2.650 . 0 0 "[ . 1 . 2]" 1
1445 1 71 VAL HB 1 72 GLU HA . . 5.120 4.434 4.300 4.606 . 0 0 "[ . 1 . 2]" 1
1446 1 71 VAL HB 1 73 PHE QB . . 5.350 4.343 4.010 4.647 . 0 0 "[ . 1 . 2]" 1
1447 1 71 VAL HB 1 73 PHE QD . . 4.650 3.898 3.430 4.186 . 0 0 "[ . 1 . 2]" 1
1448 1 71 VAL HB 1 89 VAL HA . . 4.940 3.962 3.761 4.333 . 0 0 "[ . 1 . 2]" 1
1449 1 71 VAL HB 1 89 VAL MG1 . . 2.960 2.326 2.223 2.444 . 0 0 "[ . 1 . 2]" 1
1450 1 71 VAL HB 1 89 VAL MG2 . . 4.990 4.282 3.943 4.493 . 0 0 "[ . 1 . 2]" 1
1451 1 71 VAL HB 1 90 LEU H . . 4.080 3.548 3.345 3.712 . 0 0 "[ . 1 . 2]" 1
1452 1 71 VAL HB 1 92 ILE HB . . 5.370 5.215 5.059 5.319 . 0 0 "[ . 1 . 2]" 1
1453 1 71 VAL HB 1 92 ILE MD . . 5.500 5.431 5.253 5.527 0.027 6 0 "[ . 1 . 2]" 1
1454 1 71 VAL QG 1 72 GLU HA . . 4.340 3.522 3.199 3.791 . 0 0 "[ . 1 . 2]" 1
1455 1 71 VAL QG 1 73 PHE H . . 4.740 4.324 3.980 4.624 . 0 0 "[ . 1 . 2]" 1
1456 1 71 VAL QG 1 73 PHE HA . . 4.970 4.818 4.510 5.016 0.046 15 0 "[ . 1 . 2]" 1
1457 1 71 VAL QG 1 73 PHE QB . . 4.910 3.300 2.984 3.544 . 0 0 "[ . 1 . 2]" 1
1458 1 71 VAL QG 1 73 PHE QD . . 3.020 2.058 1.805 2.359 . 0 0 "[ . 1 . 2]" 1
1459 1 71 VAL QG 1 73 PHE QE . . 3.710 3.056 2.649 3.264 . 0 0 "[ . 1 . 2]" 1
1460 1 71 VAL QG 1 73 PHE HZ . . 5.500 4.948 4.606 5.177 . 0 0 "[ . 1 . 2]" 1
1461 1 71 VAL QG 1 86 ALA MB . . 5.330 4.190 3.929 4.423 . 0 0 "[ . 1 . 2]" 1
1462 1 71 VAL QG 1 89 VAL HA . . 4.590 4.075 3.820 4.265 . 0 0 "[ . 1 . 2]" 1
1463 1 71 VAL QG 1 89 VAL HB . . 5.030 4.680 4.507 4.847 . 0 0 "[ . 1 . 2]" 1
1464 1 71 VAL QG 1 89 VAL MG1 . . 2.830 2.372 2.242 2.538 . 0 0 "[ . 1 . 2]" 1
1465 1 71 VAL QG 1 89 VAL MG2 . . 3.840 3.543 3.377 3.772 . 0 0 "[ . 1 . 2]" 1
1466 1 71 VAL QG 1 90 LEU H . . 4.070 4.090 3.980 4.144 0.074 7 0 "[ . 1 . 2]" 1
1467 1 71 VAL QG 1 90 LEU HA . . 5.500 4.881 4.456 5.220 . 0 0 "[ . 1 . 2]" 1
1468 1 71 VAL QG 1 91 LYS HB2 . . 5.350 4.662 4.218 5.045 . 0 0 "[ . 1 . 2]" 1
1469 1 71 VAL QG 1 91 LYS HB3 . . 5.500 4.863 4.288 5.242 . 0 0 "[ . 1 . 2]" 1
1470 1 71 VAL QG 1 91 LYS HD2 . . 4.530 3.001 2.269 4.205 . 0 0 "[ . 1 . 2]" 1
1471 1 71 VAL QG 1 91 LYS HD3 . . 4.590 3.577 3.045 4.047 . 0 0 "[ . 1 . 2]" 1
1472 1 71 VAL QG 1 91 LYS HG2 . . 3.780 3.389 3.033 3.815 0.035 19 0 "[ . 1 . 2]" 1
1473 1 71 VAL QG 1 92 ILE HB . . 4.960 4.041 3.917 4.129 . 0 0 "[ . 1 . 2]" 1
1474 1 71 VAL QG 1 92 ILE HG12 . . 4.800 3.963 3.800 4.092 . 0 0 "[ . 1 . 2]" 1
1475 1 71 VAL QG 1 92 ILE HG13 . . 5.050 4.530 4.376 4.650 . 0 0 "[ . 1 . 2]" 1
1476 1 71 VAL QG 1 92 ILE MG . . 4.860 4.834 4.753 4.893 0.033 9 0 "[ . 1 . 2]" 1
1477 1 72 GLU H 1 72 GLU QB . . 3.410 2.424 2.284 2.745 . 0 0 "[ . 1 . 2]" 1
1478 1 72 GLU H 1 72 GLU HG2 . . 3.890 3.374 2.668 3.695 . 0 0 "[ . 1 . 2]" 1
1479 1 72 GLU H 1 73 PHE QD . . 4.780 4.169 4.060 4.285 . 0 0 "[ . 1 . 2]" 1
1480 1 72 GLU H 1 89 VAL MG1 . . 3.970 3.785 3.359 3.973 0.003 4 0 "[ . 1 . 2]" 1
1481 1 72 GLU H 1 92 ILE H . . 4.340 4.142 3.486 4.356 0.016 15 0 "[ . 1 . 2]" 1
1482 1 72 GLU H 1 92 ILE MD . . 5.500 3.559 3.337 3.720 . 0 0 "[ . 1 . 2]" 1
1483 1 72 GLU H 1 92 ILE HG12 . . 3.690 2.427 2.285 2.582 . 0 0 "[ . 1 . 2]" 1
1484 1 72 GLU H 1 92 ILE HG13 . . 4.040 3.295 3.084 3.508 . 0 0 "[ . 1 . 2]" 1
1485 1 72 GLU HA 1 72 GLU HG2 . . 3.860 3.775 3.578 3.895 0.035 12 0 "[ . 1 . 2]" 1
1486 1 72 GLU HA 1 72 GLU HG3 . . 3.830 3.181 2.966 3.598 . 0 0 "[ . 1 . 2]" 1
1487 1 72 GLU HA 1 73 PHE H . . 2.800 2.224 2.155 2.330 . 0 0 "[ . 1 . 2]" 1
1488 1 72 GLU HA 1 73 PHE HA . . 4.870 4.436 4.388 4.481 . 0 0 "[ . 1 . 2]" 1
1489 1 72 GLU HA 1 73 PHE QB . . 5.110 4.277 4.192 4.367 . 0 0 "[ . 1 . 2]" 1
1490 1 72 GLU HA 1 73 PHE QD . . 3.440 2.986 2.755 3.181 . 0 0 "[ . 1 . 2]" 1
1491 1 72 GLU HA 1 73 PHE QE . . 4.500 4.119 3.883 4.293 . 0 0 "[ . 1 . 2]" 1
1492 1 72 GLU HA 1 90 LEU HB2 . . 5.500 4.976 4.534 5.499 . 0 0 "[ . 1 . 2]" 1
1493 1 72 GLU HA 1 92 ILE MD . . 4.340 4.284 4.061 4.400 0.060 20 0 "[ . 1 . 2]" 1
1494 1 72 GLU HA 1 92 ILE HG12 . . 5.050 4.154 3.954 4.304 . 0 0 "[ . 1 . 2]" 1
1495 1 72 GLU HA 1 92 ILE HG13 . . 4.350 3.587 3.385 3.749 . 0 0 "[ . 1 . 2]" 1
1496 1 72 GLU HA 1 92 ILE MG . . 5.310 5.214 4.957 5.366 0.056 20 0 "[ . 1 . 2]" 1
1497 1 72 GLU QB 1 73 PHE H . . 3.680 3.277 2.808 3.565 . 0 0 "[ . 1 . 2]" 1
1498 1 72 GLU QB 1 73 PHE QD . . 5.410 4.653 4.417 4.792 . 0 0 "[ . 1 . 2]" 1
1499 1 72 GLU QB 1 90 LEU H . . 4.340 3.677 3.338 4.330 . 0 0 "[ . 1 . 2]" 1
1500 1 72 GLU QB 1 90 LEU HB3 . . 4.160 3.673 2.947 4.311 0.151 20 0 "[ . 1 . 2]" 1
1501 1 72 GLU QB 1 90 LEU QD . . 4.330 3.952 3.626 4.565 0.235 20 0 "[ . 1 . 2]" 1
1502 1 72 GLU QB 1 92 ILE HB . . 5.500 4.393 4.178 4.595 . 0 0 "[ . 1 . 2]" 1
1503 1 72 GLU HG2 1 89 VAL HA . . 5.110 4.362 3.846 5.005 . 0 0 "[ . 1 . 2]" 1
1504 1 72 GLU HG2 1 90 LEU HA . . 5.350 4.746 4.385 5.182 . 0 0 "[ . 1 . 2]" 1
1505 1 72 GLU HG2 1 90 LEU HB2 . . 4.150 2.033 1.665 2.300 . 0 0 "[ . 1 . 2]" 1
1506 1 72 GLU HG2 1 90 LEU HB3 . . 4.390 3.542 2.562 3.981 . 0 0 "[ . 1 . 2]" 1
1507 1 72 GLU HG2 1 90 LEU QD . . 3.520 2.673 2.174 3.342 . 0 0 "[ . 1 . 2]" 1
1508 1 72 GLU HG2 1 92 ILE MD . . 4.090 3.560 2.522 3.966 . 0 0 "[ . 1 . 2]" 1
1509 1 72 GLU HG2 1 92 ILE HG12 . . 5.020 4.430 3.325 4.844 . 0 0 "[ . 1 . 2]" 1
1510 1 72 GLU HG2 1 92 ILE HG13 . . 4.990 4.768 3.855 5.042 0.052 1 0 "[ . 1 . 2]" 1
1511 1 72 GLU HG3 1 73 PHE H . . 3.520 2.744 2.344 3.440 . 0 0 "[ . 1 . 2]" 1
1512 1 72 GLU HG3 1 73 PHE HA . . 5.000 3.517 2.984 3.902 . 0 0 "[ . 1 . 2]" 1
1513 1 72 GLU HG3 1 73 PHE QB . . 5.260 4.772 4.375 5.069 . 0 0 "[ . 1 . 2]" 1
1514 1 72 GLU HG3 1 90 LEU H . . 4.640 3.926 3.248 4.524 . 0 0 "[ . 1 . 2]" 1
1515 1 72 GLU HG3 1 90 LEU HB2 . . 4.470 3.625 2.475 3.935 . 0 0 "[ . 1 . 2]" 1
1516 1 72 GLU HG3 1 90 LEU HB3 . . 5.500 5.199 3.988 5.549 0.049 13 0 "[ . 1 . 2]" 1
1517 1 72 GLU HG3 1 92 ILE MD . . 4.490 4.349 3.894 4.543 0.053 17 0 "[ . 1 . 2]" 1
1518 1 72 GLU HG3 1 92 ILE HG13 . . 5.260 5.184 4.919 5.376 0.116 12 0 "[ . 1 . 2]" 1
1519 1 73 PHE H 1 73 PHE QD . . 3.810 2.910 2.788 3.090 . 0 0 "[ . 1 . 2]" 1
1520 1 73 PHE H 1 74 SER H . . 4.510 4.343 4.304 4.370 . 0 0 "[ . 1 . 2]" 1
1521 1 73 PHE H 1 89 VAL HA . . 4.820 4.759 4.652 4.830 0.010 20 0 "[ . 1 . 2]" 1
1522 1 73 PHE H 1 89 VAL MG2 . . 5.500 5.202 5.022 5.322 . 0 0 "[ . 1 . 2]" 1
1523 1 73 PHE HA 1 73 PHE QD . . 3.880 3.708 3.690 3.726 . 0 0 "[ . 1 . 2]" 1
1524 1 73 PHE HA 1 74 SER HA . . 4.550 4.434 4.402 4.452 . 0 0 "[ . 1 . 2]" 1
1525 1 73 PHE HA 1 86 ALA HA . . 4.980 4.975 4.891 5.049 0.069 13 0 "[ . 1 . 2]" 1
1526 1 73 PHE HA 1 86 ALA MB . . 4.290 3.998 3.895 4.096 . 0 0 "[ . 1 . 2]" 1
1527 1 73 PHE HA 1 88 ASN HA . . 5.500 5.130 4.989 5.312 . 0 0 "[ . 1 . 2]" 1
1528 1 73 PHE HA 1 88 ASN QB . . 4.300 3.676 3.380 3.897 . 0 0 "[ . 1 . 2]" 1
1529 1 73 PHE HA 1 89 VAL HA . . 3.160 2.743 2.587 2.921 . 0 0 "[ . 1 . 2]" 1
1530 1 73 PHE HA 1 89 VAL HB . . 5.500 5.468 5.305 5.580 0.080 18 0 "[ . 1 . 2]" 1
1531 1 73 PHE HA 1 89 VAL MG2 . . 3.610 3.396 3.172 3.518 . 0 0 "[ . 1 . 2]" 1
1532 1 73 PHE QB 1 74 SER HA . . 5.300 4.254 4.218 4.297 . 0 0 "[ . 1 . 2]" 1
1533 1 73 PHE QB 1 74 SER QB . . 5.340 4.422 4.232 4.604 . 0 0 "[ . 1 . 2]" 1
1534 1 73 PHE QB 1 86 ALA HA . . 4.760 2.747 2.631 2.847 . 0 0 "[ . 1 . 2]" 1
1535 1 73 PHE QB 1 86 ALA MB . . 3.270 1.860 1.744 2.028 . 0 0 "[ . 1 . 2]" 1
1536 1 73 PHE QB 1 87 CYS HA . . 5.100 4.694 4.574 4.812 . 0 0 "[ . 1 . 2]" 1
1537 1 73 PHE QB 1 89 VAL HA . . 3.390 2.881 2.761 3.081 . 0 0 "[ . 1 . 2]" 1
1538 1 73 PHE QB 1 89 VAL HB . . 5.250 4.759 4.646 4.847 . 0 0 "[ . 1 . 2]" 1
1539 1 73 PHE QB 1 89 VAL MG1 . . 4.240 3.249 2.954 3.437 . 0 0 "[ . 1 . 2]" 1
1540 1 73 PHE QB 1 89 VAL MG2 . . 3.110 2.203 2.106 2.299 . 0 0 "[ . 1 . 2]" 1
1541 1 73 PHE QD 1 74 SER H . . 3.840 3.074 2.961 3.198 . 0 0 "[ . 1 . 2]" 1
1542 1 73 PHE QD 1 74 SER HA . . 4.330 3.822 3.618 3.949 . 0 0 "[ . 1 . 2]" 1
1543 1 73 PHE QD 1 75 VAL HA . . 4.150 3.488 3.312 3.643 . 0 0 "[ . 1 . 2]" 1
1544 1 73 PHE QD 1 75 VAL HB . . 4.570 3.446 3.172 3.748 . 0 0 "[ . 1 . 2]" 1
1545 1 73 PHE QD 1 86 ALA HA . . 3.730 2.799 2.660 2.992 . 0 0 "[ . 1 . 2]" 1
1546 1 73 PHE QD 1 86 ALA MB . . 2.890 2.599 2.478 2.800 . 0 0 "[ . 1 . 2]" 1
1547 1 73 PHE QD 1 87 CYS H . . 4.190 3.953 3.696 4.171 . 0 0 "[ . 1 . 2]" 1
1548 1 73 PHE QD 1 89 VAL HA . . 4.590 4.481 4.340 4.613 0.023 2 0 "[ . 1 . 2]" 1
1549 1 73 PHE QD 1 89 VAL MG1 . . 4.370 4.048 3.709 4.247 . 0 0 "[ . 1 . 2]" 1
1550 1 73 PHE QD 1 89 VAL MG2 . . 4.690 3.960 3.896 4.009 . 0 0 "[ . 1 . 2]" 1
1551 1 73 PHE QE 1 75 VAL HA . . 4.830 4.268 4.083 4.385 . 0 0 "[ . 1 . 2]" 1
1552 1 73 PHE QE 1 75 VAL HB . . 4.660 2.878 2.468 3.185 . 0 0 "[ . 1 . 2]" 1
1553 1 73 PHE QE 1 86 ALA HA . . 5.290 4.735 4.593 4.899 . 0 0 "[ . 1 . 2]" 1
1554 1 73 PHE QE 1 86 ALA MB . . 4.100 3.945 3.662 4.076 . 0 0 "[ . 1 . 2]" 1
1555 1 73 PHE QE 1 89 VAL MG2 . . 5.500 5.584 5.542 5.623 0.123 5 0 "[ . 1 . 2]" 1
1556 1 73 PHE HZ 1 86 ALA MB . . 5.190 5.129 4.898 5.215 0.025 3 0 "[ . 1 . 2]" 1
1557 1 74 SER H 1 74 SER HB2 . . 4.130 2.830 2.691 3.106 . 0 0 "[ . 1 . 2]" 1
1558 1 74 SER H 1 74 SER QB . . 3.420 2.709 2.587 2.892 . 0 0 "[ . 1 . 2]" 1
1559 1 74 SER H 1 74 SER HB3 . . 4.130 3.678 2.769 3.867 . 0 0 "[ . 1 . 2]" 1
1560 1 74 SER H 1 86 ALA H . . 5.500 5.749 5.699 5.802 0.302 14 0 "[ . 1 . 2]" 1
1561 1 74 SER H 1 86 ALA HA . . 4.540 3.007 2.950 3.056 . 0 0 "[ . 1 . 2]" 1
1562 1 74 SER H 1 86 ALA MB . . 3.930 3.382 3.269 3.459 . 0 0 "[ . 1 . 2]" 1
1563 1 74 SER H 1 87 CYS H . . 3.560 2.098 1.909 2.298 . 0 0 "[ . 1 . 2]" 1
1564 1 74 SER H 1 89 VAL HA . . 5.060 4.841 4.653 5.092 0.032 12 0 "[ . 1 . 2]" 1
1565 1 74 SER H 1 89 VAL MG2 . . 4.400 4.088 3.962 4.262 . 0 0 "[ . 1 . 2]" 1
1566 1 74 SER HA 1 75 VAL H . . 2.990 2.147 2.102 2.209 . 0 0 "[ . 1 . 2]" 1
1567 1 74 SER HA 1 75 VAL HB . . 5.430 4.492 4.325 4.582 . 0 0 "[ . 1 . 2]" 1
1568 1 74 SER HA 1 75 VAL QG . . 4.050 3.554 3.428 3.639 . 0 0 "[ . 1 . 2]" 1
1569 1 74 SER QB 1 75 VAL H . . 3.850 3.284 3.034 3.793 . 0 0 "[ . 1 . 2]" 1
1570 1 74 SER QB 1 75 VAL QG . . 4.840 4.317 4.086 4.725 . 0 0 "[ . 1 . 2]" 1
1571 1 74 SER QB 1 76 VAL HB . . 5.140 4.197 3.896 4.533 . 0 0 "[ . 1 . 2]" 1
1572 1 74 SER QB 1 76 VAL QG . . 4.110 3.904 3.694 4.097 . 0 0 "[ . 1 . 2]" 1
1573 1 74 SER QB 1 86 ALA MB . . 5.340 5.137 4.959 5.373 0.033 18 0 "[ . 1 . 2]" 1
1574 1 74 SER QB 1 87 CYS HA . . 5.040 4.574 4.449 4.800 . 0 0 "[ . 1 . 2]" 1
1575 1 74 SER QB 1 87 CYS QB . . 3.470 2.275 1.995 2.602 . 0 0 "[ . 1 . 2]" 1
1576 1 74 SER QB 1 88 ASN QB . . 4.410 3.510 2.869 3.997 . 0 0 "[ . 1 . 2]" 1
1577 1 74 SER HB2 1 75 VAL H . . 4.410 4.123 3.824 4.422 0.012 14 0 "[ . 1 . 2]" 1
1578 1 74 SER HB2 1 87 CYS HB2 . . 5.040 2.633 2.015 4.243 . 0 0 "[ . 1 . 2]" 1
1579 1 74 SER HB2 1 87 CYS HB3 . . 5.040 3.722 2.492 5.134 0.094 10 0 "[ . 1 . 2]" 1
1580 1 74 SER HB3 1 75 VAL H . . 4.410 3.462 3.176 4.129 . 0 0 "[ . 1 . 2]" 1
1581 1 74 SER HB3 1 87 CYS HB2 . . 5.040 3.756 2.510 5.102 0.062 20 0 "[ . 1 . 2]" 1
1582 1 74 SER HB3 1 87 CYS HB3 . . 5.040 4.881 3.939 5.182 0.142 12 0 "[ . 1 . 2]" 1
1583 1 75 VAL H 1 75 VAL HB . . 3.150 2.845 2.753 2.985 . 0 0 "[ . 1 . 2]" 1
1584 1 75 VAL H 1 75 VAL QG . . 3.040 1.898 1.812 1.970 . 0 0 "[ . 1 . 2]" 1
1585 1 75 VAL HA 1 75 VAL MG1 . . 3.310 3.216 3.197 3.231 . 0 0 "[ . 1 . 2]" 1
1586 1 75 VAL HA 1 75 VAL QG . . 2.740 2.353 2.309 2.408 . 0 0 "[ . 1 . 2]" 1
1587 1 75 VAL HA 1 75 VAL MG2 . . 3.310 2.420 2.365 2.490 . 0 0 "[ . 1 . 2]" 1
1588 1 75 VAL HA 1 76 VAL QG . . 4.430 3.698 3.653 3.749 . 0 0 "[ . 1 . 2]" 1
1589 1 75 VAL HA 1 85 SER HA . . 5.500 5.222 5.030 5.510 0.010 18 0 "[ . 1 . 2]" 1
1590 1 75 VAL HA 1 86 ALA HA . . 3.880 3.361 3.094 3.696 . 0 0 "[ . 1 . 2]" 1
1591 1 75 VAL HB 1 84 SER QB . . 5.500 4.325 4.053 4.788 . 0 0 "[ . 1 . 2]" 1
1592 1 75 VAL HB 1 85 SER H . . 5.500 5.535 5.436 5.584 0.084 5 0 "[ . 1 . 2]" 1
1593 1 75 VAL HB 1 86 ALA HA . . 5.500 4.904 4.575 5.237 . 0 0 "[ . 1 . 2]" 1
1594 1 75 VAL QG 1 84 SER HA . . 4.390 4.140 3.877 4.320 . 0 0 "[ . 1 . 2]" 1
1595 1 75 VAL QG 1 84 SER QB . . 2.890 2.137 1.909 2.596 . 0 0 "[ . 1 . 2]" 1
1596 1 75 VAL MG1 1 76 VAL HA . . 4.320 4.193 4.053 4.278 . 0 0 "[ . 1 . 2]" 1
1597 1 75 VAL MG2 1 76 VAL HA . . 4.320 3.865 3.712 4.019 . 0 0 "[ . 1 . 2]" 1
1598 1 76 VAL H 1 76 VAL HB . . 3.470 3.029 2.960 3.108 . 0 0 "[ . 1 . 2]" 1
1599 1 76 VAL H 1 76 VAL QG . . 2.960 1.993 1.931 2.056 . 0 0 "[ . 1 . 2]" 1
1600 1 76 VAL H 1 77 THR H . . 4.350 4.318 4.107 4.412 0.062 20 0 "[ . 1 . 2]" 1
1601 1 76 VAL H 1 84 SER HA . . 5.040 4.588 4.370 4.820 . 0 0 "[ . 1 . 2]" 1
1602 1 76 VAL H 1 84 SER QB . . 4.330 3.512 3.000 4.374 0.044 17 0 "[ . 1 . 2]" 1
1603 1 76 VAL H 1 86 ALA HA . . 5.020 4.040 3.806 4.305 . 0 0 "[ . 1 . 2]" 1
1604 1 76 VAL HA 1 76 VAL HB . . 2.890 2.418 2.398 2.450 . 0 0 "[ . 1 . 2]" 1
1605 1 76 VAL HA 1 76 VAL QG . . 2.600 2.345 2.316 2.369 . 0 0 "[ . 1 . 2]" 1
1606 1 76 VAL HA 1 77 THR H . . 2.820 2.133 2.108 2.163 . 0 0 "[ . 1 . 2]" 1
1607 1 76 VAL HA 1 77 THR HA . . 5.000 4.365 4.327 4.410 . 0 0 "[ . 1 . 2]" 1
1608 1 76 VAL HA 1 77 THR HB . . 4.810 4.699 4.568 4.755 . 0 0 "[ . 1 . 2]" 1
1609 1 76 VAL HB 1 85 SER H . . 5.500 5.128 4.829 5.349 . 0 0 "[ . 1 . 2]" 1
1610 1 76 VAL HB 1 87 CYS QB . . 4.960 4.215 3.706 4.720 . 0 0 "[ . 1 . 2]" 1
1611 1 76 VAL QG 1 77 THR H . . 3.130 2.817 2.550 3.129 . 0 0 "[ . 1 . 2]" 1
1612 1 76 VAL QG 1 77 THR HB . . 5.500 4.269 3.989 4.613 . 0 0 "[ . 1 . 2]" 1
1613 1 76 VAL QG 1 78 ASN HB2 . . 5.420 5.326 4.890 5.526 0.106 6 0 "[ . 1 . 2]" 1
1614 1 76 VAL QG 1 84 SER HA . . 4.710 3.840 3.547 4.018 . 0 0 "[ . 1 . 2]" 1
1615 1 76 VAL QG 1 85 SER H . . 3.680 2.845 2.527 3.011 . 0 0 "[ . 1 . 2]" 1
1616 1 76 VAL QG 1 86 ALA HA . . 5.240 4.134 3.765 4.424 . 0 0 "[ . 1 . 2]" 1
1617 1 76 VAL QG 1 87 CYS QB . . 3.540 3.130 2.608 3.490 . 0 0 "[ . 1 . 2]" 1
1618 1 77 THR H 1 77 THR HB . . 3.250 2.588 2.503 2.689 . 0 0 "[ . 1 . 2]" 1
1619 1 77 THR H 1 84 SER HA . . 5.010 4.397 4.227 4.611 . 0 0 "[ . 1 . 2]" 1
1620 1 77 THR HA 1 77 THR MG . . 2.750 2.341 2.284 2.385 . 0 0 "[ . 1 . 2]" 1
1621 1 77 THR HA 1 78 ASN H . . 2.920 2.153 2.093 2.242 . 0 0 "[ . 1 . 2]" 1
1622 1 77 THR HA 1 78 ASN HA . . 5.330 4.385 4.350 4.416 . 0 0 "[ . 1 . 2]" 1
1623 1 77 THR HA 1 84 SER HA . . 2.740 2.017 1.810 2.230 . 0 0 "[ . 1 . 2]" 1
1624 1 77 THR HA 1 84 SER QB . . 3.690 2.895 2.471 3.405 . 0 0 "[ . 1 . 2]" 1
1625 1 77 THR HB 1 78 ASN HA . . 5.190 5.087 4.921 5.205 0.015 4 0 "[ . 1 . 2]" 1
1626 1 77 THR HB 1 84 SER HA . . 5.240 5.024 4.820 5.239 . 0 0 "[ . 1 . 2]" 1
1627 1 77 THR MG 1 78 ASN H . . 3.370 2.677 2.476 2.783 . 0 0 "[ . 1 . 2]" 1
1628 1 77 THR MG 1 78 ASN HB3 . . 4.830 4.748 3.826 4.888 0.058 16 0 "[ . 1 . 2]" 1
1629 1 77 THR MG 1 79 GLN HA . . 4.340 3.625 3.378 4.160 . 0 0 "[ . 1 . 2]" 1
1630 1 77 THR MG 1 82 GLY H . . 4.230 3.707 3.516 3.891 . 0 0 "[ . 1 . 2]" 1
1631 1 77 THR MG 1 82 GLY HA2 . . 4.120 2.866 2.170 3.167 . 0 0 "[ . 1 . 2]" 1
1632 1 77 THR MG 1 82 GLY QA . . 3.440 2.811 2.143 3.090 . 0 0 "[ . 1 . 2]" 1
1633 1 77 THR MG 1 82 GLY HA3 . . 4.120 4.084 3.308 4.306 0.186 7 0 "[ . 1 . 2]" 1
1634 1 77 THR MG 1 83 LYS HA . . 4.170 3.682 3.138 4.152 . 0 0 "[ . 1 . 2]" 1
1635 1 77 THR MG 1 84 SER HA . . 4.090 3.583 3.354 3.788 . 0 0 "[ . 1 . 2]" 1
1636 1 78 ASN H 1 78 ASN HB2 . . 3.270 2.312 2.238 2.415 . 0 0 "[ . 1 . 2]" 1
1637 1 78 ASN H 1 78 ASN HB3 . . 3.580 3.478 2.679 3.589 0.009 19 0 "[ . 1 . 2]" 1
1638 1 78 ASN H 1 79 GLN HA . . 5.500 5.278 5.149 5.454 . 0 0 "[ . 1 . 2]" 1
1639 1 78 ASN H 1 83 LYS H . . 4.030 4.013 2.980 4.149 0.119 1 0 "[ . 1 . 2]" 1
1640 1 78 ASN H 1 83 LYS QB . . 4.920 4.898 3.866 5.043 0.123 18 0 "[ . 1 . 2]" 1
1641 1 78 ASN H 1 83 LYS HG2 . . 5.500 5.193 4.394 5.809 0.309 9 0 "[ . 1 . 2]" 1
1642 1 78 ASN H 1 83 LYS HG3 . . 5.500 4.391 3.799 5.337 . 0 0 "[ . 1 . 2]" 1
1643 1 78 ASN H 1 84 SER H . . 4.670 4.339 4.154 4.575 . 0 0 "[ . 1 . 2]" 1
1644 1 78 ASN H 1 84 SER HA . . 3.820 2.432 2.161 3.089 . 0 0 "[ . 1 . 2]" 1
1645 1 78 ASN HA 1 79 GLN HA . . 4.600 4.384 4.324 4.452 . 0 0 "[ . 1 . 2]" 1
1646 1 78 ASN HA 1 79 GLN QB . . 5.340 4.469 4.358 4.577 . 0 0 "[ . 1 . 2]" 1
1647 1 78 ASN HB2 1 80 ARG H . . 5.120 4.243 3.873 4.557 . 0 0 "[ . 1 . 2]" 1
1648 1 78 ASN HB2 1 81 ASN QB . . 4.670 2.564 1.891 4.183 . 0 0 "[ . 1 . 2]" 1
1649 1 78 ASN HB2 1 82 GLY QA . . 4.410 4.275 3.996 4.530 0.120 10 0 "[ . 1 . 2]" 1
1650 1 78 ASN HB2 1 83 LYS H . . 3.380 2.964 2.694 3.392 0.012 10 0 "[ . 1 . 2]" 1
1651 1 78 ASN HB2 1 83 LYS HA . . 4.720 4.773 4.597 4.834 0.114 8 0 "[ . 1 . 2]" 1
1652 1 78 ASN HB2 1 83 LYS QB . . 4.640 4.501 2.847 4.832 0.192 7 0 "[ . 1 . 2]" 1
1653 1 78 ASN HB2 1 83 LYS QG . . 4.410 3.067 2.443 4.443 0.033 9 0 "[ . 1 . 2]" 1
1654 1 78 ASN HB3 1 79 GLN QG . . 5.500 4.732 4.310 5.567 0.067 9 0 "[ . 1 . 2]" 1
1655 1 78 ASN HB3 1 80 ARG HA . . 5.500 5.334 5.006 5.542 0.042 9 0 "[ . 1 . 2]" 1
1656 1 78 ASN HB3 1 80 ARG QB . . 4.310 3.587 3.042 4.258 . 0 0 "[ . 1 . 2]" 1
1657 1 78 ASN HB3 1 82 GLY QA . . 5.050 4.859 3.198 5.109 0.059 12 0 "[ . 1 . 2]" 1
1658 1 78 ASN HB3 1 83 LYS QG . . 5.340 4.095 3.045 4.801 . 0 0 "[ . 1 . 2]" 1
1659 1 79 GLN H 1 79 GLN QG . . 4.790 2.068 1.709 2.806 . 0 0 "[ . 1 . 2]" 1
1660 1 79 GLN HA 1 79 GLN QG . . 3.380 3.359 3.335 3.472 0.092 16 0 "[ . 1 . 2]" 1
1661 1 79 GLN HA 1 81 ASN H . . 5.500 4.658 4.220 5.178 . 0 0 "[ . 1 . 2]" 1
1662 1 79 GLN QB 1 79 GLN QG . . 2.380 2.070 2.005 2.089 . 0 0 "[ . 1 . 2]" 1
1663 1 79 GLN QB 1 80 ARG H . . 4.440 3.668 3.525 3.808 . 0 0 "[ . 1 . 2]" 1
1664 1 79 GLN QB 1 80 ARG HA . . 4.930 4.403 4.213 4.523 . 0 0 "[ . 1 . 2]" 1
1665 1 79 GLN QB 1 80 ARG QB . . 4.650 4.608 4.342 4.804 0.154 20 0 "[ . 1 . 2]" 1
1666 1 79 GLN QG 1 80 ARG H . . 4.770 2.661 2.307 3.015 . 0 0 "[ . 1 . 2]" 1
1667 1 79 GLN QG 1 80 ARG HA . . 4.610 3.783 3.433 4.813 0.203 13 0 "[ . 1 . 2]" 1
1668 1 80 ARG H 1 80 ARG QB . . 3.230 2.297 2.185 2.346 . 0 0 "[ . 1 . 2]" 1
1669 1 80 ARG H 1 80 ARG QD . . 5.500 4.479 4.205 4.715 . 0 0 "[ . 1 . 2]" 1
1670 1 80 ARG H 1 80 ARG QG . . 4.300 4.028 3.904 4.092 . 0 0 "[ . 1 . 2]" 1
1671 1 80 ARG H 1 81 ASN H . . 4.150 2.349 2.172 2.589 . 0 0 "[ . 1 . 2]" 1
1672 1 80 ARG HA 1 80 ARG QD . . 3.770 2.535 1.971 3.902 0.132 14 0 "[ . 1 . 2]" 1
1673 1 80 ARG HA 1 80 ARG QG . . 3.580 2.906 2.532 3.087 . 0 0 "[ . 1 . 2]" 1
1674 1 80 ARG QB 1 80 ARG QD . . 3.230 2.412 2.122 2.845 . 0 0 "[ . 1 . 2]" 1
1675 1 80 ARG QB 1 81 ASN H . . 3.750 2.603 2.189 2.801 . 0 0 "[ . 1 . 2]" 1
1676 1 80 ARG QB 1 81 ASN HA . . 5.020 4.198 3.928 4.447 . 0 0 "[ . 1 . 2]" 1
1677 1 80 ARG QB 1 82 GLY H . . 4.580 4.560 4.140 4.670 0.090 6 0 "[ . 1 . 2]" 1
1678 1 80 ARG QG 1 81 ASN H . . 4.030 3.660 3.125 4.038 0.008 20 0 "[ . 1 . 2]" 1
1679 1 80 ARG QG 1 81 ASN HA . . 4.930 3.647 2.993 4.797 . 0 0 "[ . 1 . 2]" 1
1680 1 81 ASN H 1 82 GLY H . . 3.390 2.221 2.012 2.557 . 0 0 "[ . 1 . 2]" 1
1681 1 81 ASN H 1 82 GLY QA . . 5.340 4.174 3.950 4.463 . 0 0 "[ . 1 . 2]" 1
1682 1 81 ASN H 1 83 LYS H . . 4.650 4.113 3.438 4.421 . 0 0 "[ . 1 . 2]" 1
1683 1 81 ASN HA 1 83 LYS QG . . 5.270 4.528 4.110 5.113 . 0 0 "[ . 1 . 2]" 1
1684 1 81 ASN QB 1 82 GLY H . . 3.960 2.934 2.772 3.404 . 0 0 "[ . 1 . 2]" 1
1685 1 81 ASN QB 1 83 LYS H . . 3.630 2.618 2.189 3.020 . 0 0 "[ . 1 . 2]" 1
1686 1 81 ASN QB 1 83 LYS QB . . 4.850 3.934 2.936 4.909 0.059 7 0 "[ . 1 . 2]" 1
1687 1 81 ASN QB 1 83 LYS QG . . 4.150 2.318 1.877 3.210 . 0 0 "[ . 1 . 2]" 1
1688 1 81 ASN HB2 1 82 GLY H . . 4.690 3.186 2.854 4.034 . 0 0 "[ . 1 . 2]" 1
1689 1 81 ASN HB2 1 83 LYS H . . 4.480 3.058 2.260 4.528 0.048 7 0 "[ . 1 . 2]" 1
1690 1 81 ASN HB3 1 82 GLY H . . 4.690 3.771 2.831 4.222 . 0 0 "[ . 1 . 2]" 1
1691 1 81 ASN HB3 1 83 LYS H . . 4.480 3.069 2.460 3.893 . 0 0 "[ . 1 . 2]" 1
1692 1 82 GLY H 1 83 LYS H . . 3.420 2.760 2.407 3.048 . 0 0 "[ . 1 . 2]" 1
1693 1 82 GLY H 1 83 LYS HA . . 5.500 5.137 4.931 5.293 . 0 0 "[ . 1 . 2]" 1
1694 1 82 GLY H 1 83 LYS QG . . 4.500 4.128 3.642 4.507 0.007 7 0 "[ . 1 . 2]" 1
1695 1 82 GLY QA 1 83 LYS QB . . 5.340 4.474 4.372 4.642 . 0 0 "[ . 1 . 2]" 1
1696 1 82 GLY QA 1 83 LYS QG . . 4.690 4.290 3.986 4.554 . 0 0 "[ . 1 . 2]" 1
1697 1 83 LYS H 1 83 LYS QB . . 3.220 2.760 2.354 2.972 . 0 0 "[ . 1 . 2]" 1
1698 1 83 LYS H 1 83 LYS QG . . 3.030 2.058 1.723 2.539 . 0 0 "[ . 1 . 2]" 1
1699 1 83 LYS H 1 84 SER H . . 4.640 4.549 4.489 4.615 . 0 0 "[ . 1 . 2]" 1
1700 1 83 LYS HA 1 83 LYS QD . . 4.470 4.236 3.859 4.512 0.042 2 0 "[ . 1 . 2]" 1
1701 1 83 LYS HA 1 83 LYS QG . . 3.680 3.287 2.229 3.373 . 0 0 "[ . 1 . 2]" 1
1702 1 83 LYS HA 1 84 SER H . . 2.840 2.377 2.099 2.604 . 0 0 "[ . 1 . 2]" 1
1703 1 83 LYS QB 1 84 SER H . . 5.060 2.503 2.134 2.990 . 0 0 "[ . 1 . 2]" 1
1704 1 83 LYS QB 1 84 SER HA . . 5.440 4.478 4.202 4.719 . 0 0 "[ . 1 . 2]" 1
1705 1 83 LYS QB 1 84 SER QB . . 4.840 4.513 4.178 4.852 0.012 9 0 "[ . 1 . 2]" 1
1706 1 83 LYS QG 1 84 SER H . . 4.530 3.744 3.252 4.092 . 0 0 "[ . 1 . 2]" 1
1707 1 83 LYS QG 1 84 SER QB . . 5.340 5.262 4.767 5.587 0.247 9 0 "[ . 1 . 2]" 1
1708 1 84 SER H 1 84 SER QB . . 3.240 2.501 2.273 2.697 . 0 0 "[ . 1 . 2]" 1
1709 1 84 SER HA 1 85 SER H . . 2.880 2.549 2.434 2.636 . 0 0 "[ . 1 . 2]" 1
1710 1 84 SER QB 1 85 SER H . . 3.080 2.361 2.071 3.077 . 0 0 "[ . 1 . 2]" 1
1711 1 85 SER H 1 86 ALA H . . 4.450 4.332 4.237 4.392 . 0 0 "[ . 1 . 2]" 1
1712 1 85 SER HA 1 86 ALA H . . 2.920 2.323 2.223 2.441 . 0 0 "[ . 1 . 2]" 1
1713 1 85 SER HA 1 86 ALA HA . . 5.090 4.359 4.319 4.404 . 0 0 "[ . 1 . 2]" 1
1714 1 85 SER HA 1 86 ALA MB . . 4.240 3.921 3.873 4.001 . 0 0 "[ . 1 . 2]" 1
1715 1 85 SER QB 1 86 ALA H . . 3.120 2.717 2.523 2.970 . 0 0 "[ . 1 . 2]" 1
1716 1 85 SER QB 1 86 ALA HA . . 5.360 4.416 4.231 4.693 . 0 0 "[ . 1 . 2]" 1
1717 1 86 ALA H 1 86 ALA MB . . 2.920 2.204 2.075 2.312 . 0 0 "[ . 1 . 2]" 1
1718 1 86 ALA H 1 87 CYS H . . 5.080 4.366 4.267 4.412 . 0 0 "[ . 1 . 2]" 1
1719 1 86 ALA HA 1 87 CYS H . . 2.980 2.119 2.095 2.139 . 0 0 "[ . 1 . 2]" 1
1720 1 86 ALA HA 1 87 CYS HA . . 4.490 4.388 4.370 4.400 . 0 0 "[ . 1 . 2]" 1
1721 1 86 ALA HA 1 89 VAL MG2 . . 4.640 4.252 4.113 4.384 . 0 0 "[ . 1 . 2]" 1
1722 1 86 ALA MB 1 87 CYS H . . 3.500 3.261 3.201 3.333 . 0 0 "[ . 1 . 2]" 1
1723 1 86 ALA MB 1 87 CYS HA . . 4.640 4.070 3.982 4.145 . 0 0 "[ . 1 . 2]" 1
1724 1 86 ALA MB 1 87 CYS QB . . 5.100 4.862 4.675 4.925 . 0 0 "[ . 1 . 2]" 1
1725 1 86 ALA MB 1 89 VAL H . . 5.020 5.079 4.985 5.130 0.110 2 0 "[ . 1 . 2]" 1
1726 1 86 ALA MB 1 89 VAL HB . . 5.390 4.835 4.667 4.966 . 0 0 "[ . 1 . 2]" 1
1727 1 86 ALA MB 1 89 VAL MG2 . . 2.850 2.304 2.198 2.384 . 0 0 "[ . 1 . 2]" 1
1728 1 87 CYS H 1 87 CYS QB . . 3.650 2.442 2.352 2.526 . 0 0 "[ . 1 . 2]" 1
1729 1 87 CYS H 1 88 ASN H . . 4.960 4.466 4.446 4.496 . 0 0 "[ . 1 . 2]" 1
1730 1 87 CYS H 1 89 VAL MG2 . . 4.390 4.164 4.009 4.304 . 0 0 "[ . 1 . 2]" 1
1731 1 87 CYS HA 1 88 ASN H . . 3.340 2.263 2.195 2.374 . 0 0 "[ . 1 . 2]" 1
1732 1 87 CYS HA 1 89 VAL H . . 4.320 4.248 3.853 4.380 0.060 19 0 "[ . 1 . 2]" 1
1733 1 87 CYS HA 1 89 VAL MG2 . . 3.740 3.438 3.251 3.641 . 0 0 "[ . 1 . 2]" 1
1734 1 87 CYS QB 1 88 ASN H . . 3.610 2.841 2.544 3.253 . 0 0 "[ . 1 . 2]" 1
1735 1 87 CYS QB 1 88 ASN HA . . 4.570 4.494 4.349 4.765 0.195 13 0 "[ . 1 . 2]" 1
1736 1 87 CYS HB2 1 88 ASN H . . 4.350 4.008 3.712 4.196 . 0 0 "[ . 1 . 2]" 1
1737 1 87 CYS HB3 1 88 ASN H . . 4.350 2.908 2.591 3.388 . 0 0 "[ . 1 . 2]" 1
1738 1 88 ASN H 1 88 ASN QB . . 3.680 3.123 2.883 3.380 . 0 0 "[ . 1 . 2]" 1
1739 1 88 ASN H 1 89 VAL H . . 3.620 2.978 2.743 3.131 . 0 0 "[ . 1 . 2]" 1
1740 1 88 ASN H 1 89 VAL HB . . 5.300 5.107 4.940 5.295 . 0 0 "[ . 1 . 2]" 1
1741 1 88 ASN H 1 89 VAL MG2 . . 4.480 3.667 3.542 3.855 . 0 0 "[ . 1 . 2]" 1
1742 1 88 ASN H 1 90 LEU QD . . 5.440 5.013 4.738 5.280 . 0 0 "[ . 1 . 2]" 1
1743 1 88 ASN HA 1 89 VAL H . . 3.000 2.425 2.333 2.585 . 0 0 "[ . 1 . 2]" 1
1744 1 88 ASN QB 1 89 VAL HA . . 4.780 4.541 4.395 4.744 . 0 0 "[ . 1 . 2]" 1
1745 1 89 VAL H 1 89 VAL HB . . 3.030 2.449 2.373 2.518 . 0 0 "[ . 1 . 2]" 1
1746 1 89 VAL H 1 89 VAL MG2 . . 2.940 2.419 2.284 2.536 . 0 0 "[ . 1 . 2]" 1
1747 1 89 VAL H 1 90 LEU H . . 4.720 4.303 4.198 4.446 . 0 0 "[ . 1 . 2]" 1
1748 1 89 VAL HA 1 89 VAL MG1 . . 3.020 2.458 2.386 2.516 . 0 0 "[ . 1 . 2]" 1
1749 1 89 VAL HA 1 89 VAL MG2 . . 2.980 2.354 2.292 2.418 . 0 0 "[ . 1 . 2]" 1
1750 1 89 VAL HA 1 90 LEU H . . 2.900 2.122 2.097 2.166 . 0 0 "[ . 1 . 2]" 1
1751 1 89 VAL HA 1 90 LEU HA . . 4.820 4.389 4.359 4.423 . 0 0 "[ . 1 . 2]" 1
1752 1 89 VAL HA 1 90 LEU HB3 . . 5.500 5.605 5.533 5.665 0.165 11 0 "[ . 1 . 2]" 1
1753 1 89 VAL HA 1 90 LEU QD . . 4.330 3.491 3.251 3.994 . 0 0 "[ . 1 . 2]" 1
1754 1 89 VAL HB 1 90 LEU HA . . 5.500 4.976 4.857 5.092 . 0 0 "[ . 1 . 2]" 1
1755 1 89 VAL HB 1 90 LEU QD . . 5.380 4.492 4.203 4.710 . 0 0 "[ . 1 . 2]" 1
1756 1 89 VAL MG1 1 90 LEU H . . 3.340 3.087 2.810 3.289 . 0 0 "[ . 1 . 2]" 1
1757 1 89 VAL MG1 1 90 LEU HA . . 4.410 3.779 3.615 3.909 . 0 0 "[ . 1 . 2]" 1
1758 1 89 VAL MG1 1 90 LEU HB3 . . 5.500 5.397 5.190 5.522 0.022 12 0 "[ . 1 . 2]" 1
1759 1 89 VAL MG1 1 91 LYS H . . 4.880 4.686 4.427 4.859 . 0 0 "[ . 1 . 2]" 1
1760 1 89 VAL MG1 1 91 LYS HG2 . . 5.500 4.835 4.381 5.272 . 0 0 "[ . 1 . 2]" 1
1761 1 89 VAL MG1 1 92 ILE HG12 . . 5.500 5.528 5.246 5.650 0.150 7 0 "[ . 1 . 2]" 1
1762 1 89 VAL MG2 1 90 LEU QD . . 5.440 4.543 4.345 4.819 . 0 0 "[ . 1 . 2]" 1
1763 1 90 LEU H 1 90 LEU HB2 . . 3.450 2.345 2.203 2.458 . 0 0 "[ . 1 . 2]" 1
1764 1 90 LEU H 1 90 LEU HB3 . . 3.610 3.544 3.410 3.641 0.031 11 0 "[ . 1 . 2]" 1
1765 1 90 LEU H 1 91 LYS H . . 4.710 4.514 4.484 4.564 . 0 0 "[ . 1 . 2]" 1
1766 1 90 LEU HA 1 90 LEU QD . . 2.830 2.051 1.911 2.486 . 0 0 "[ . 1 . 2]" 1
1767 1 90 LEU HA 1 91 LYS HA . . 5.030 4.323 4.212 4.393 . 0 0 "[ . 1 . 2]" 1
1768 1 90 LEU HA 1 91 LYS HB2 . . 4.690 4.205 4.027 4.286 . 0 0 "[ . 1 . 2]" 1
1769 1 90 LEU HB2 1 92 ILE MD . . 4.250 3.472 3.122 3.844 . 0 0 "[ . 1 . 2]" 1
1770 1 90 LEU HB3 1 90 LEU QD . . 2.960 2.297 2.203 2.339 . 0 0 "[ . 1 . 2]" 1
1771 1 90 LEU HB3 1 91 LYS H . . 3.340 2.848 2.631 3.021 . 0 0 "[ . 1 . 2]" 1
1772 1 90 LEU HB3 1 91 LYS HA . . 5.500 4.592 4.486 4.682 . 0 0 "[ . 1 . 2]" 1
1773 1 90 LEU HB3 1 92 ILE HA . . 5.500 4.984 4.638 5.456 . 0 0 "[ . 1 . 2]" 1
1774 1 90 LEU HB3 1 92 ILE MD . . 4.570 3.195 2.924 3.508 . 0 0 "[ . 1 . 2]" 1
1775 1 90 LEU QD 1 91 LYS H . . 3.790 3.190 2.751 3.852 0.062 3 0 "[ . 1 . 2]" 1
1776 1 90 LEU MD1 1 91 LYS H . . 4.390 3.327 2.784 4.348 . 0 0 "[ . 1 . 2]" 1
1777 1 90 LEU MD2 1 91 LYS H . . 4.390 4.406 4.075 4.533 0.143 13 0 "[ . 1 . 2]" 1
1778 1 91 LYS H 1 91 LYS HB2 . . 3.060 2.185 2.095 2.402 . 0 0 "[ . 1 . 2]" 1
1779 1 91 LYS H 1 91 LYS QE . . 4.930 4.862 4.567 5.095 0.165 17 0 "[ . 1 . 2]" 1
1780 1 91 LYS H 1 92 ILE H . . 4.710 4.461 4.234 4.550 . 0 0 "[ . 1 . 2]" 1
1781 1 91 LYS HA 1 91 LYS HD2 . . 3.490 2.087 1.884 2.665 . 0 0 "[ . 1 . 2]" 1
1782 1 91 LYS HA 1 91 LYS HE2 . . 5.500 4.066 3.197 4.573 . 0 0 "[ . 1 . 2]" 1
1783 1 91 LYS HA 1 91 LYS HE3 . . 5.500 3.975 3.269 4.977 . 0 0 "[ . 1 . 2]" 1
1784 1 91 LYS HA 1 91 LYS HG2 . . 3.140 2.515 2.344 2.668 . 0 0 "[ . 1 . 2]" 1
1785 1 91 LYS HA 1 92 ILE H . . 2.880 2.140 2.089 2.188 . 0 0 "[ . 1 . 2]" 1
1786 1 91 LYS HB3 1 91 LYS QE . . 4.210 2.105 1.872 2.370 . 0 0 "[ . 1 . 2]" 1
1787 1 91 LYS HD2 1 92 ILE HB . . 4.900 4.609 4.094 4.905 0.005 20 0 "[ . 1 . 2]" 1
1788 1 91 LYS QE 1 92 ILE H . . 4.770 3.302 2.913 4.084 . 0 0 "[ . 1 . 2]" 1
1789 1 91 LYS QE 1 92 ILE MG . . 5.340 5.060 4.437 5.398 0.058 20 0 "[ . 1 . 2]" 1
1790 1 91 LYS HE2 1 92 ILE HA . . 5.500 5.131 4.053 5.607 0.107 7 0 "[ . 1 . 2]" 1
1791 1 91 LYS HE3 1 92 ILE HA . . 5.500 4.674 3.765 5.615 0.115 4 0 "[ . 1 . 2]" 1
1792 1 92 ILE H 1 92 ILE HB . . 3.240 2.527 2.433 2.691 . 0 0 "[ . 1 . 2]" 1
1793 1 92 ILE H 1 92 ILE HG12 . . 3.150 2.779 2.401 2.922 . 0 0 "[ . 1 . 2]" 1
1794 1 92 ILE H 1 92 ILE HG13 . . 4.310 4.067 3.762 4.189 . 0 0 "[ . 1 . 2]" 1
1795 1 92 ILE H 1 92 ILE MG . . 3.930 3.796 3.739 3.885 . 0 0 "[ . 1 . 2]" 1
1796 1 92 ILE HA 1 92 ILE MD . . 2.780 2.022 1.921 2.109 . 0 0 "[ . 1 . 2]" 1
1797 1 92 ILE HA 1 92 ILE HG12 . . 3.700 3.000 2.903 3.052 . 0 0 "[ . 1 . 2]" 1
1798 1 92 ILE HA 1 92 ILE HG13 . . 3.890 3.715 3.634 3.762 . 0 0 "[ . 1 . 2]" 1
1799 1 92 ILE HA 1 92 ILE MG . . 2.820 2.456 2.417 2.517 . 0 0 "[ . 1 . 2]" 1
1800 1 92 ILE HA 1 93 ASN H . . 3.030 2.168 2.094 2.252 . 0 0 "[ . 1 . 2]" 1
1801 1 92 ILE HB 1 92 ILE MD . . 3.230 3.227 3.215 3.239 0.009 1 0 "[ . 1 . 2]" 1
1802 1 92 ILE HB 1 93 ASN H . . 4.200 4.159 3.942 4.284 0.084 3 0 "[ . 1 . 2]" 1
1803 1 92 ILE MD 1 92 ILE MG . . 2.600 1.935 1.859 2.005 . 0 0 "[ . 1 . 2]" 1
1804 1 92 ILE MD 1 93 ASN H . . 4.400 3.540 3.294 3.702 . 0 0 "[ . 1 . 2]" 1
1805 1 92 ILE HG12 1 92 ILE MG . . 3.200 3.202 3.186 3.212 0.012 10 0 "[ . 1 . 2]" 1
1806 1 92 ILE HG13 1 92 ILE MG . . 3.160 2.360 2.295 2.412 . 0 0 "[ . 1 . 2]" 1
1807 1 92 ILE HG13 1 93 ASN H . . 5.500 5.313 5.190 5.529 0.029 20 0 "[ . 1 . 2]" 1
1808 1 92 ILE MG 1 93 ASN H . . 3.700 2.605 2.328 2.930 . 0 0 "[ . 1 . 2]" 1
1809 1 92 ILE MG 1 94 ASP H . . 4.120 3.925 3.197 4.199 0.079 2 0 "[ . 1 . 2]" 1
1810 1 93 ASN H 1 93 ASN QB . . 3.250 2.539 2.326 2.919 . 0 0 "[ . 1 . 2]" 1
1811 1 93 ASN H 1 94 ASP H . . 4.440 4.362 4.062 4.468 0.028 4 0 "[ . 1 . 2]" 1
1812 1 93 ASN QB 1 94 ASP H . . 3.490 3.348 2.862 3.647 0.157 18 0 "[ . 1 . 2]" 1
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