NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
518034 |
2l39   |
17174 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l39
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 3062
_Distance_constraint_stats_list.Viol_count 5919
_Distance_constraint_stats_list.Viol_total 8683.077
_Distance_constraint_stats_list.Viol_max 0.974
_Distance_constraint_stats_list.Viol_rms 0.0294
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0071
_Distance_constraint_stats_list.Viol_average_violations_only 0.0733
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 2.518 0.102 19 0 "[ . 1 . 2]"
1 3 VAL 1.475 0.094 18 0 "[ . 1 . 2]"
1 4 VAL 5.502 0.470 10 0 "[ . 1 . 2]"
1 5 GLY 2.091 0.091 3 0 "[ . 1 . 2]"
1 6 GLY 2.287 0.095 5 0 "[ . 1 . 2]"
1 7 LEU 6.224 0.627 10 1 "[ . + . 2]"
1 8 GLY 2.235 0.152 19 0 "[ . 1 . 2]"
1 9 GLY 2.160 0.086 2 0 "[ . 1 . 2]"
1 10 TYR 8.465 0.106 7 0 "[ . 1 . 2]"
1 11 MET 7.150 0.200 17 0 "[ . 1 . 2]"
1 12 LEU 6.747 0.108 10 0 "[ . 1 . 2]"
1 13 GLY 3.908 0.106 1 0 "[ . 1 . 2]"
1 14 SER 9.080 0.952 6 3 "[ -.+ *1 . 2]"
1 15 ALA 9.253 0.333 14 0 "[ . 1 . 2]"
1 16 MET 13.565 0.635 18 3 "[ -. *1 . + 2]"
1 17 SER 7.445 0.703 19 2 "[ . 1 . -+2]"
1 18 ARG 17.228 0.703 19 3 "[ . 1 - . +*]"
1 19 PRO 6.523 0.869 1 2 "[+ . 1 -. 2]"
1 20 MET 9.599 0.869 1 3 "[+ . 1 * -. 2]"
1 21 ILE 13.813 0.703 12 1 "[ . 1 + . 2]"
1 22 HIS 3.787 0.095 5 0 "[ . 1 . 2]"
1 23 PHE 15.452 0.122 8 0 "[ . 1 . 2]"
1 24 GLY 2.319 0.102 6 0 "[ . 1 . 2]"
1 25 ASN 4.538 0.117 20 0 "[ . 1 . 2]"
1 26 ASP 1.067 0.087 20 0 "[ . 1 . 2]"
1 27 TRP 11.530 0.112 16 0 "[ . 1 . 2]"
1 28 GLU 13.205 0.165 8 0 "[ . 1 . 2]"
1 29 ASP 3.464 0.165 8 0 "[ . 1 . 2]"
1 30 ARG 3.718 0.111 16 0 "[ . 1 . 2]"
1 31 TYR 11.693 0.131 18 0 "[ . 1 . 2]"
1 32 TYR 15.637 0.128 15 0 "[ . 1 . 2]"
1 33 ARG 3.274 0.098 2 0 "[ . 1 . 2]"
1 34 GLU 1.331 0.098 19 0 "[ . 1 . 2]"
1 35 ASN 2.871 0.123 18 0 "[ . 1 . 2]"
1 36 MET 9.600 0.697 12 4 "[ . 1 + *. -*]"
1 37 TYR 4.868 0.387 18 0 "[ . 1 . 2]"
1 38 ARG 3.916 0.387 18 0 "[ . 1 . 2]"
1 39 TYR 8.026 0.127 16 0 "[ . 1 . 2]"
1 40 PRO 5.058 0.640 12 1 "[ . 1 + . 2]"
1 41 ASN 8.689 0.507 13 1 "[ . 1 + . 2]"
1 42 GLN 10.025 0.098 10 0 "[ . 1 . 2]"
1 43 VAL 1.791 0.101 15 0 "[ . 1 . 2]"
1 44 TYR 7.479 0.109 9 0 "[ . 1 . 2]"
1 45 TYR 14.467 0.438 6 0 "[ . 1 . 2]"
1 46 ARG 8.089 0.115 8 0 "[ . 1 . 2]"
1 47 PRO 2.032 0.106 12 0 "[ . 1 . 2]"
1 48 VAL 5.287 0.130 8 0 "[ . 1 . 2]"
1 49 ASP 4.400 0.614 11 1 "[ . 1+ . 2]"
1 50 GLN 7.762 0.614 11 1 "[ . 1+ . 2]"
1 51 TYR 12.222 0.387 6 0 "[ . 1 . 2]"
1 52 SER 1.548 0.097 8 0 "[ . 1 . 2]"
1 53 ASN 4.679 0.112 17 0 "[ . 1 . 2]"
1 54 GLN 4.585 0.094 15 0 "[ . 1 . 2]"
1 55 ASN 2.484 0.094 15 0 "[ . 1 . 2]"
1 56 ASN 3.290 0.387 6 0 "[ . 1 . 2]"
1 57 PHE 10.522 0.136 15 0 "[ . 1 . 2]"
1 58 VAL 8.017 0.136 15 0 "[ . 1 . 2]"
1 59 HIS 4.970 0.109 11 0 "[ . 1 . 2]"
1 60 ASP 9.878 0.768 19 3 "[ . * 1- . +2]"
1 61 CYS 8.526 0.318 14 0 "[ . 1 . 2]"
1 62 VAL 12.029 0.740 17 1 "[ . 1 . + 2]"
1 63 ASN 10.236 0.755 14 1 "[ . 1 +. 2]"
1 64 ILE 14.919 0.768 19 1 "[ . 1 . +2]"
1 65 THR 5.818 0.136 7 0 "[ . 1 . 2]"
1 66 ILE 10.640 0.258 12 0 "[ . 1 . 2]"
1 67 LYS 14.751 0.755 14 1 "[ . 1 +. 2]"
1 68 GLN 6.748 0.109 9 0 "[ . 1 . 2]"
1 69 HIS 11.125 0.127 17 0 "[ . 1 . 2]"
1 70 THR 12.106 0.141 20 0 "[ . 1 . 2]"
1 71 VAL 7.662 0.137 7 0 "[ . 1 . 2]"
1 72 THR 3.205 0.131 4 0 "[ . 1 . 2]"
1 73 THR 8.744 0.135 15 0 "[ . 1 . 2]"
1 74 THR 10.317 0.117 13 0 "[ . 1 . 2]"
1 75 THR 3.556 0.130 9 0 "[ . 1 . 2]"
1 76 LYS 7.235 0.130 9 0 "[ . 1 . 2]"
1 77 GLY 3.423 0.107 19 0 "[ . 1 . 2]"
1 78 GLU 12.244 0.258 13 0 "[ . 1 . 2]"
1 79 ASN 8.553 0.370 16 0 "[ . 1 . 2]"
1 80 PHE 8.413 0.370 16 0 "[ . 1 . 2]"
1 81 THR 7.113 0.142 19 0 "[ . 1 . 2]"
1 82 GLU 8.468 0.113 14 0 "[ . 1 . 2]"
1 83 THR 9.413 0.131 18 0 "[ . 1 . 2]"
1 84 ASP 1.980 0.084 7 0 "[ . 1 . 2]"
1 85 VAL 7.221 0.108 2 0 "[ . 1 . 2]"
1 86 LYS 10.117 0.128 17 0 "[ . 1 . 2]"
1 87 MET 12.403 0.119 4 0 "[ . 1 . 2]"
1 88 MET 5.408 0.640 12 1 "[ . 1 + . 2]"
1 89 GLU 5.900 0.740 17 1 "[ . 1 . + 2]"
1 90 ARG 8.048 0.687 5 1 "[ + 1 . 2]"
1 91 VAL 4.212 0.127 2 0 "[ . 1 . 2]"
1 92 VAL 2.658 0.099 7 0 "[ . 1 . 2]"
1 93 GLU 5.671 0.884 18 2 "[ . 1 .- + 2]"
1 94 GLN 11.556 0.687 5 2 "[ + 1 . - 2]"
1 95 MET 8.866 0.637 17 3 "[ -. *1 . + 2]"
1 96 CYS 6.347 0.884 18 2 "[ . 1 .- + 2]"
1 97 VAL 3.592 0.407 5 0 "[ . 1 . 2]"
1 98 THR 10.250 0.113 15 0 "[ . 1 . 2]"
1 99 GLN 16.387 0.952 6 4 "[ *.+ *1 . *]"
1 100 TYR 8.524 0.112 6 0 "[ . 1 . 2]"
1 101 GLN 6.603 0.110 13 0 "[ . 1 . 2]"
1 102 LYS 10.061 0.670 6 1 "[ .+ 1 . 2]"
1 103 GLU 5.785 0.745 20 1 "[ . 1 . +]"
1 104 SER 1.133 0.099 15 0 "[ . 1 . 2]"
1 105 GLN 9.942 0.324 11 0 "[ . 1 . 2]"
1 106 ALA 7.705 0.117 13 0 "[ . 1 . 2]"
1 107 TYR 9.777 0.126 11 0 "[ . 1 . 2]"
1 108 TYR 10.005 0.324 11 0 "[ . 1 . 2]"
1 109 ASP 4.371 0.116 12 0 "[ . 1 . 2]"
1 110 GLY 8.101 0.974 8 3 "[ * + 1 .- 2]"
1 111 ARG 8.632 0.116 12 0 "[ . 1 . 2]"
1 112 ARG 4.943 0.974 8 3 "[ * + 1 .- 2]"
1 113 SER 2.161 0.110 19 0 "[ . 1 . 2]"
1 114 SER 1.824 0.110 19 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 SER H 1 4 VAL H . . 4.770 4.133 3.186 4.734 . 0 0 "[ . 1 . 2]" 1
2 1 2 SER H 1 4 VAL HA . . 5.500 5.222 4.123 5.589 0.089 19 0 "[ . 1 . 2]" 1
3 1 2 SER HA 1 3 VAL H . . 3.190 2.686 2.230 3.280 0.090 5 0 "[ . 1 . 2]" 1
4 1 2 SER HA 1 3 VAL HB . . 5.500 4.892 4.239 5.594 0.094 18 0 "[ . 1 . 2]" 1
5 1 2 SER HA 1 3 VAL QG . . 5.220 3.706 3.020 4.087 . 0 0 "[ . 1 . 2]" 1
6 1 2 SER QB 1 3 VAL H . . 4.150 2.947 1.792 3.928 . 0 0 "[ . 1 . 2]" 1
7 1 2 SER QB 1 3 VAL QG . . 5.240 3.805 2.564 4.428 . 0 0 "[ . 1 . 2]" 1
8 1 2 SER QB 1 4 VAL H . . 5.180 3.684 2.962 4.547 . 0 0 "[ . 1 . 2]" 1
9 1 2 SER QB 1 5 GLY H . . 4.940 2.615 2.301 3.756 . 0 0 "[ . 1 . 2]" 1
10 1 2 SER QB 1 6 GLY H . . 4.470 4.501 4.153 4.565 0.095 5 0 "[ . 1 . 2]" 1
11 1 2 SER QB 1 12 LEU HB3 . . 5.500 5.287 4.318 5.602 0.102 19 0 "[ . 1 . 2]" 1
12 1 2 SER QB 1 12 LEU QD . . 5.500 4.264 2.718 5.231 . 0 0 "[ . 1 . 2]" 1
13 1 3 VAL H 1 3 VAL HB . . 3.800 3.022 2.215 3.888 0.088 12 0 "[ . 1 . 2]" 1
14 1 3 VAL H 1 3 VAL QG . . 4.000 2.348 1.894 3.161 . 0 0 "[ . 1 . 2]" 1
15 1 3 VAL H 1 5 GLY H . . 3.790 3.714 3.018 3.877 0.087 14 0 "[ . 1 . 2]" 1
16 1 3 VAL HA 1 4 VAL H . . 2.870 2.391 2.192 2.844 . 0 0 "[ . 1 . 2]" 1
17 1 3 VAL QG 1 4 VAL H . . 4.300 3.635 3.374 3.796 . 0 0 "[ . 1 . 2]" 1
18 1 3 VAL QG 1 5 GLY H . . 5.500 3.647 2.381 4.235 . 0 0 "[ . 1 . 2]" 1
19 1 3 VAL QG 1 6 GLY QA . . 5.500 3.586 2.307 5.463 . 0 0 "[ . 1 . 2]" 1
20 1 4 VAL H 1 4 VAL HB . . 3.640 3.134 2.576 3.720 0.080 19 0 "[ . 1 . 2]" 1
21 1 4 VAL H 1 4 VAL QG . . 3.760 2.777 2.221 3.207 . 0 0 "[ . 1 . 2]" 1
22 1 4 VAL H 1 5 GLY H . . 3.870 3.055 2.883 3.288 . 0 0 "[ . 1 . 2]" 1
23 1 4 VAL H 1 11 MET HA . . 5.010 4.671 3.861 5.097 0.087 4 0 "[ . 1 . 2]" 1
24 1 4 VAL HA 1 4 VAL QG . . 3.330 2.215 2.092 2.372 . 0 0 "[ . 1 . 2]" 1
25 1 4 VAL HA 1 5 GLY H . . 2.990 3.041 2.892 3.081 0.091 3 0 "[ . 1 . 2]" 1
26 1 4 VAL HA 1 6 GLY H . . 4.400 4.339 3.059 4.483 0.083 14 0 "[ . 1 . 2]" 1
27 1 4 VAL HA 1 12 LEU HB2 . . 4.700 2.792 2.087 4.732 0.032 19 0 "[ . 1 . 2]" 1
28 1 4 VAL HB 1 5 GLY H . . 4.710 4.396 3.995 4.757 0.047 18 0 "[ . 1 . 2]" 1
29 1 4 VAL HB 1 7 LEU HB3 . . 5.300 5.053 4.054 5.770 0.470 10 0 "[ . 1 . 2]" 1
30 1 4 VAL HB 1 7 LEU QD . . 5.500 4.161 3.092 4.672 . 0 0 "[ . 1 . 2]" 1
31 1 4 VAL HB 1 12 LEU HB2 . . 5.500 4.517 3.747 5.310 . 0 0 "[ . 1 . 2]" 1
32 1 4 VAL QG 1 5 GLY H . . 4.700 3.588 3.207 3.877 . 0 0 "[ . 1 . 2]" 1
33 1 4 VAL QG 1 6 GLY H . . 5.500 3.160 2.396 4.111 . 0 0 "[ . 1 . 2]" 1
34 1 4 VAL QG 1 7 LEU H . . 5.430 3.302 1.918 4.817 . 0 0 "[ . 1 . 2]" 1
35 1 4 VAL QG 1 7 LEU HB2 . . 3.750 2.093 1.806 2.991 . 0 0 "[ . 1 . 2]" 1
36 1 4 VAL QG 1 7 LEU HB3 . . 3.810 3.119 2.766 3.815 0.005 19 0 "[ . 1 . 2]" 1
37 1 4 VAL QG 1 7 LEU QD . . 3.640 2.101 1.950 2.327 . 0 0 "[ . 1 . 2]" 1
38 1 4 VAL QG 1 7 LEU HG . . 4.060 2.534 2.191 3.853 . 0 0 "[ . 1 . 2]" 1
39 1 4 VAL QG 1 9 GLY H . . 5.500 3.843 2.979 4.645 . 0 0 "[ . 1 . 2]" 1
40 1 4 VAL QG 1 9 GLY HA2 . . 5.500 4.165 3.431 4.795 . 0 0 "[ . 1 . 2]" 1
41 1 4 VAL QG 1 10 TYR QB . . 5.500 2.199 1.902 2.660 . 0 0 "[ . 1 . 2]" 1
42 1 4 VAL QG 1 11 MET HA . . 5.500 2.362 1.818 2.782 . 0 0 "[ . 1 . 2]" 1
43 1 4 VAL QG 1 11 MET ME . . 5.190 4.829 4.437 5.052 . 0 0 "[ . 1 . 2]" 1
44 1 4 VAL QG 1 11 MET QG . . 4.430 3.657 2.963 4.096 . 0 0 "[ . 1 . 2]" 1
45 1 4 VAL QG 1 12 LEU H . . 5.500 2.593 2.083 3.035 . 0 0 "[ . 1 . 2]" 1
46 1 4 VAL QG 1 12 LEU HB2 . . 2.400 2.403 2.144 2.488 0.088 14 0 "[ . 1 . 2]" 1
47 1 4 VAL QG 1 44 TYR HB2 . . 5.500 4.879 4.544 5.301 . 0 0 "[ . 1 . 2]" 1
48 1 4 VAL QG 1 44 TYR HB3 . . 5.280 3.653 3.259 4.110 . 0 0 "[ . 1 . 2]" 1
49 1 4 VAL QG 1 44 TYR QD . . 4.260 2.172 1.983 2.688 . 0 0 "[ . 1 . 2]" 1
50 1 4 VAL QG 1 44 TYR QE . . 5.340 2.620 1.951 3.159 . 0 0 "[ . 1 . 2]" 1
51 1 4 VAL QG 1 68 GLN HE21 . . 5.500 4.350 4.034 4.845 . 0 0 "[ . 1 . 2]" 1
52 1 4 VAL QG 1 68 GLN HG2 . . 5.500 5.276 4.797 5.518 0.018 19 0 "[ . 1 . 2]" 1
53 1 5 GLY H 1 6 GLY H . . 4.120 2.564 2.204 2.930 . 0 0 "[ . 1 . 2]" 1
54 1 6 GLY H 1 6 GLY QA . . 2.760 2.275 2.159 2.499 . 0 0 "[ . 1 . 2]" 1
55 1 6 GLY QA 1 7 LEU H . . 3.100 2.307 2.094 3.026 . 0 0 "[ . 1 . 2]" 1
56 1 6 GLY QA 1 7 LEU HB2 . . 5.400 4.501 4.099 4.778 . 0 0 "[ . 1 . 2]" 1
57 1 6 GLY QA 1 7 LEU HB3 . . 5.500 5.432 5.226 5.564 0.064 12 0 "[ . 1 . 2]" 1
58 1 6 GLY QA 1 7 LEU QD . . 5.500 3.865 2.661 4.293 . 0 0 "[ . 1 . 2]" 1
59 1 6 GLY QA 1 7 LEU HG . . 5.380 4.644 3.963 5.457 0.077 6 0 "[ . 1 . 2]" 1
60 1 7 LEU H 1 7 LEU HB2 . . 3.810 2.924 2.387 3.576 . 0 0 "[ . 1 . 2]" 1
61 1 7 LEU H 1 7 LEU HB3 . . 3.870 3.817 3.626 3.956 0.086 6 0 "[ . 1 . 2]" 1
62 1 7 LEU H 1 7 LEU HG . . 4.320 3.574 3.067 4.391 0.071 10 0 "[ . 1 . 2]" 1
63 1 7 LEU HA 1 7 LEU QD . . 3.530 2.118 2.002 2.757 . 0 0 "[ . 1 . 2]" 1
64 1 7 LEU HA 1 8 GLY H . . 3.160 2.520 2.315 3.246 0.086 19 0 "[ . 1 . 2]" 1
65 1 7 LEU HA 1 8 GLY HA2 . . 4.670 4.393 4.244 4.822 0.152 19 0 "[ . 1 . 2]" 1
66 1 7 LEU HA 1 8 GLY HA3 . . 4.730 4.422 4.317 4.630 . 0 0 "[ . 1 . 2]" 1
67 1 7 LEU HA 1 9 GLY H . . 5.500 4.811 4.351 5.586 0.086 2 0 "[ . 1 . 2]" 1
68 1 7 LEU HA 1 10 TYR H . . 5.480 5.060 4.889 5.301 . 0 0 "[ . 1 . 2]" 1
69 1 7 LEU HA 1 10 TYR QB . . 5.500 4.740 4.532 5.030 . 0 0 "[ . 1 . 2]" 1
70 1 7 LEU HA 1 10 TYR QD . . 4.130 4.170 3.865 4.217 0.087 13 0 "[ . 1 . 2]" 1
71 1 7 LEU HB2 1 7 LEU HG . . 2.400 2.403 2.276 3.027 0.627 10 1 "[ . + . 2]" 1
72 1 7 LEU HB2 1 8 GLY H . . 4.450 3.570 3.339 3.737 . 0 0 "[ . 1 . 2]" 1
73 1 7 LEU HB2 1 8 GLY HA2 . . 5.500 5.317 5.128 5.514 0.014 10 0 "[ . 1 . 2]" 1
74 1 7 LEU HB2 1 8 GLY HA3 . . 5.500 5.489 5.021 5.582 0.082 9 0 "[ . 1 . 2]" 1
75 1 7 LEU HB2 1 9 GLY H . . 5.500 4.052 3.278 5.238 . 0 0 "[ . 1 . 2]" 1
76 1 7 LEU HB2 1 10 TYR H . . 5.270 3.365 3.037 3.772 . 0 0 "[ . 1 . 2]" 1
77 1 7 LEU HB2 1 10 TYR HA . . 5.500 5.390 5.065 5.579 0.079 3 0 "[ . 1 . 2]" 1
78 1 7 LEU HB2 1 10 TYR QB . . 4.730 2.561 2.175 2.968 . 0 0 "[ . 1 . 2]" 1
79 1 7 LEU HB2 1 10 TYR QD . . 5.270 3.528 3.150 3.778 . 0 0 "[ . 1 . 2]" 1
80 1 7 LEU HB3 1 8 GLY H . . 4.410 2.345 1.967 4.074 . 0 0 "[ . 1 . 2]" 1
81 1 7 LEU HB3 1 8 GLY HA3 . . 5.500 4.363 4.183 4.564 . 0 0 "[ . 1 . 2]" 1
82 1 7 LEU HB3 1 9 GLY H . . 5.500 3.922 3.005 4.362 . 0 0 "[ . 1 . 2]" 1
83 1 7 LEU HB3 1 10 TYR H . . 5.190 3.003 2.564 3.413 . 0 0 "[ . 1 . 2]" 1
84 1 7 LEU HB3 1 10 TYR HA . . 5.500 5.026 4.784 5.257 . 0 0 "[ . 1 . 2]" 1
85 1 7 LEU HB3 1 10 TYR QB . . 5.000 2.382 2.166 2.686 . 0 0 "[ . 1 . 2]" 1
86 1 7 LEU HB3 1 10 TYR QD . . 3.910 2.209 2.049 2.447 . 0 0 "[ . 1 . 2]" 1
87 1 7 LEU HB3 1 10 TYR QE . . 5.500 4.074 3.802 4.397 . 0 0 "[ . 1 . 2]" 1
88 1 7 LEU QD 1 8 GLY H . . 5.310 3.141 2.746 4.369 . 0 0 "[ . 1 . 2]" 1
89 1 7 LEU QD 1 10 TYR QB . . 4.920 2.193 1.962 3.344 . 0 0 "[ . 1 . 2]" 1
90 1 7 LEU QD 1 10 TYR QD . . 4.570 2.914 2.721 3.465 . 0 0 "[ . 1 . 2]" 1
91 1 7 LEU QD 1 44 TYR HB3 . . 5.500 2.723 2.307 4.301 . 0 0 "[ . 1 . 2]" 1
92 1 7 LEU QD 1 44 TYR QD . . 4.370 2.231 1.943 3.326 . 0 0 "[ . 1 . 2]" 1
93 1 7 LEU QD 1 44 TYR QE . . 4.200 3.153 2.395 3.474 . 0 0 "[ . 1 . 2]" 1
94 1 7 LEU QD 1 64 ILE MD . . 4.360 3.029 2.413 3.769 . 0 0 "[ . 1 . 2]" 1
95 1 7 LEU QD 1 64 ILE MG . . 4.240 2.153 1.872 2.762 . 0 0 "[ . 1 . 2]" 1
96 1 7 LEU QD 1 68 GLN HA . . 5.500 4.043 3.823 4.174 . 0 0 "[ . 1 . 2]" 1
97 1 7 LEU QD 1 68 GLN HB2 . . 4.560 3.864 3.212 4.208 . 0 0 "[ . 1 . 2]" 1
98 1 7 LEU QD 1 68 GLN HB3 . . 4.540 4.007 3.791 4.109 . 0 0 "[ . 1 . 2]" 1
99 1 7 LEU QD 1 68 GLN HE21 . . 5.500 3.216 2.404 4.083 . 0 0 "[ . 1 . 2]" 1
100 1 7 LEU QD 1 68 GLN QE . . 5.100 2.840 2.154 3.788 . 0 0 "[ . 1 . 2]" 1
101 1 7 LEU QD 1 68 GLN HE22 . . 5.500 3.175 2.433 4.486 . 0 0 "[ . 1 . 2]" 1
102 1 7 LEU QD 1 68 GLN HG2 . . 4.700 2.310 2.126 2.535 . 0 0 "[ . 1 . 2]" 1
103 1 7 LEU QD 1 68 GLN HG3 . . 5.500 2.197 2.082 2.487 . 0 0 "[ . 1 . 2]" 1
104 1 7 LEU QD 1 71 VAL HB . . 5.500 5.329 4.972 5.415 . 0 0 "[ . 1 . 2]" 1
105 1 7 LEU HG 1 8 GLY H . . 5.500 4.710 3.298 5.122 . 0 0 "[ . 1 . 2]" 1
106 1 7 LEU HG 1 10 TYR QB . . 5.500 3.753 2.210 4.148 . 0 0 "[ . 1 . 2]" 1
107 1 7 LEU HG 1 10 TYR QD . . 5.500 4.778 3.668 5.147 . 0 0 "[ . 1 . 2]" 1
108 1 7 LEU HG 1 44 TYR HB3 . . 5.500 4.933 3.815 5.577 0.077 19 0 "[ . 1 . 2]" 1
109 1 7 LEU HG 1 68 GLN QE . . 5.500 3.563 2.644 4.825 . 0 0 "[ . 1 . 2]" 1
110 1 8 GLY H 1 8 GLY HA3 . . 2.900 2.326 2.178 2.994 0.094 19 0 "[ . 1 . 2]" 1
111 1 8 GLY H 1 9 GLY H . . 3.610 3.413 2.308 3.695 0.085 4 0 "[ . 1 . 2]" 1
112 1 8 GLY H 1 10 TYR H . . 5.500 3.623 2.971 4.088 . 0 0 "[ . 1 . 2]" 1
113 1 8 GLY H 1 10 TYR QD . . 5.500 2.431 1.804 4.008 . 0 0 "[ . 1 . 2]" 1
114 1 8 GLY H 1 10 TYR QE . . 5.330 3.348 2.726 5.174 . 0 0 "[ . 1 . 2]" 1
115 1 8 GLY HA2 1 9 GLY H . . 3.470 2.772 2.367 3.381 . 0 0 "[ . 1 . 2]" 1
116 1 8 GLY HA2 1 10 TYR H . . 4.830 4.492 4.212 4.872 0.042 9 0 "[ . 1 . 2]" 1
117 1 8 GLY HA2 1 10 TYR QD . . 5.500 4.310 4.028 4.786 . 0 0 "[ . 1 . 2]" 1
118 1 8 GLY HA2 1 10 TYR QE . . 5.500 4.967 4.321 5.587 0.087 5 0 "[ . 1 . 2]" 1
119 1 8 GLY HA3 1 10 TYR H . . 5.080 4.355 3.739 4.767 . 0 0 "[ . 1 . 2]" 1
120 1 8 GLY HA3 1 10 TYR QD . . 4.310 3.469 3.147 3.935 . 0 0 "[ . 1 . 2]" 1
121 1 8 GLY HA3 1 10 TYR QE . . 5.010 3.428 2.685 4.130 . 0 0 "[ . 1 . 2]" 1
122 1 9 GLY H 1 9 GLY HA3 . . 2.880 2.894 2.541 2.959 0.079 9 0 "[ . 1 . 2]" 1
123 1 9 GLY H 1 10 TYR H . . 3.470 2.449 1.719 2.847 . 0 0 "[ . 1 . 2]" 1
124 1 9 GLY H 1 10 TYR QB . . 5.140 4.284 3.629 4.680 . 0 0 "[ . 1 . 2]" 1
125 1 9 GLY H 1 10 TYR QD . . 4.410 3.512 2.529 3.893 . 0 0 "[ . 1 . 2]" 1
126 1 9 GLY H 1 10 TYR QE . . 5.500 5.196 4.108 5.570 0.070 11 0 "[ . 1 . 2]" 1
127 1 9 GLY HA2 1 10 TYR HA . . 5.500 4.789 4.710 4.892 . 0 0 "[ . 1 . 2]" 1
128 1 9 GLY HA2 1 10 TYR QD . . 5.500 4.863 4.392 5.091 . 0 0 "[ . 1 . 2]" 1
129 1 9 GLY HA3 1 10 TYR H . . 3.580 3.404 3.298 3.488 . 0 0 "[ . 1 . 2]" 1
130 1 9 GLY HA3 1 10 TYR QD . . 5.470 4.594 3.879 4.986 . 0 0 "[ . 1 . 2]" 1
131 1 9 GLY HA3 1 46 ARG HD2 . . 5.500 4.416 3.445 5.105 . 0 0 "[ . 1 . 2]" 1
132 1 9 GLY HA3 1 46 ARG HD3 . . 5.500 5.064 4.101 5.566 0.066 13 0 "[ . 1 . 2]" 1
133 1 9 GLY HA3 1 46 ARG HE . . 5.500 4.308 3.195 5.565 0.065 20 0 "[ . 1 . 2]" 1
134 1 10 TYR H 1 10 TYR QB . . 3.130 2.288 2.208 2.397 . 0 0 "[ . 1 . 2]" 1
135 1 10 TYR H 1 10 TYR QD . . 3.040 2.127 1.949 2.238 . 0 0 "[ . 1 . 2]" 1
136 1 10 TYR H 1 10 TYR QE . . 4.230 4.271 4.087 4.319 0.089 9 0 "[ . 1 . 2]" 1
137 1 10 TYR H 1 11 MET H . . 4.780 4.547 4.440 4.603 . 0 0 "[ . 1 . 2]" 1
138 1 10 TYR H 1 11 MET QG . . 5.500 5.342 5.128 5.565 0.065 6 0 "[ . 1 . 2]" 1
139 1 10 TYR HA 1 10 TYR QD . . 3.280 3.111 3.030 3.196 . 0 0 "[ . 1 . 2]" 1
140 1 10 TYR HA 1 10 TYR QE . . 4.830 4.553 4.436 4.667 . 0 0 "[ . 1 . 2]" 1
141 1 10 TYR HA 1 11 MET H . . 3.050 2.565 2.468 2.654 . 0 0 "[ . 1 . 2]" 1
142 1 10 TYR HA 1 11 MET HB2 . . 5.080 4.749 4.610 4.977 . 0 0 "[ . 1 . 2]" 1
143 1 10 TYR HA 1 11 MET QG . . 5.000 4.068 3.839 4.610 . 0 0 "[ . 1 . 2]" 1
144 1 10 TYR HA 1 45 TYR H . . 5.170 4.602 4.355 4.890 . 0 0 "[ . 1 . 2]" 1
145 1 10 TYR HA 1 46 ARG HA . . 4.120 2.387 2.194 2.714 . 0 0 "[ . 1 . 2]" 1
146 1 10 TYR HA 1 46 ARG HE . . 5.370 4.373 3.079 5.442 0.072 13 0 "[ . 1 . 2]" 1
147 1 10 TYR HA 1 46 ARG HG2 . . 4.370 3.543 3.010 3.837 . 0 0 "[ . 1 . 2]" 1
148 1 10 TYR HA 1 46 ARG HG3 . . 4.700 4.784 4.743 4.797 0.097 3 0 "[ . 1 . 2]" 1
149 1 10 TYR HA 1 47 PRO HD2 . . 5.500 3.884 3.604 4.349 . 0 0 "[ . 1 . 2]" 1
150 1 10 TYR HA 1 47 PRO HD3 . . 5.270 3.361 3.057 3.739 . 0 0 "[ . 1 . 2]" 1
151 1 10 TYR QB 1 11 MET H . . 3.660 2.243 2.079 2.416 . 0 0 "[ . 1 . 2]" 1
152 1 10 TYR QB 1 11 MET HA . . 5.500 3.953 3.794 4.065 . 0 0 "[ . 1 . 2]" 1
153 1 10 TYR QB 1 11 MET ME . . 5.020 4.754 4.393 4.966 . 0 0 "[ . 1 . 2]" 1
154 1 10 TYR QB 1 12 LEU H . . 5.500 5.055 4.667 5.273 . 0 0 "[ . 1 . 2]" 1
155 1 10 TYR QB 1 44 TYR HA . . 5.120 4.073 3.696 4.374 . 0 0 "[ . 1 . 2]" 1
156 1 10 TYR QB 1 44 TYR QD . . 3.470 3.450 3.224 3.571 0.101 19 0 "[ . 1 . 2]" 1
157 1 10 TYR QB 1 44 TYR QE . . 5.500 5.136 4.628 5.404 . 0 0 "[ . 1 . 2]" 1
158 1 10 TYR QB 1 45 TYR H . . 4.290 3.238 2.922 3.554 . 0 0 "[ . 1 . 2]" 1
159 1 10 TYR QB 1 64 ILE MD . . 5.500 4.424 4.101 4.787 . 0 0 "[ . 1 . 2]" 1
160 1 10 TYR QB 1 64 ILE MG . . 4.560 3.382 3.097 3.672 . 0 0 "[ . 1 . 2]" 1
161 1 10 TYR QD 1 11 MET H . . 3.900 3.675 3.528 3.906 0.006 10 0 "[ . 1 . 2]" 1
162 1 10 TYR QD 1 44 TYR QB . . 3.800 3.514 3.225 3.791 . 0 0 "[ . 1 . 2]" 1
163 1 10 TYR QD 1 45 TYR H . . 4.050 3.537 3.083 3.814 . 0 0 "[ . 1 . 2]" 1
164 1 10 TYR QD 1 45 TYR HA . . 3.580 2.842 2.506 3.059 . 0 0 "[ . 1 . 2]" 1
165 1 10 TYR QD 1 46 ARG H . . 4.480 3.860 3.439 4.141 . 0 0 "[ . 1 . 2]" 1
166 1 10 TYR QD 1 46 ARG HE . . 5.500 5.100 4.637 5.591 0.091 9 0 "[ . 1 . 2]" 1
167 1 10 TYR QD 1 46 ARG HG2 . . 3.940 2.795 2.536 3.032 . 0 0 "[ . 1 . 2]" 1
168 1 10 TYR QD 1 46 ARG HG3 . . 5.500 4.258 3.925 4.493 . 0 0 "[ . 1 . 2]" 1
169 1 10 TYR QD 1 64 ILE HB . . 5.500 4.275 4.071 4.611 . 0 0 "[ . 1 . 2]" 1
170 1 10 TYR QD 1 64 ILE MD . . 4.030 3.502 3.305 3.726 . 0 0 "[ . 1 . 2]" 1
171 1 10 TYR QD 1 64 ILE QG . . 5.500 3.411 2.950 3.805 . 0 0 "[ . 1 . 2]" 1
172 1 10 TYR QD 1 64 ILE HG13 . . 4.130 3.466 2.983 3.886 . 0 0 "[ . 1 . 2]" 1
173 1 10 TYR QD 1 64 ILE MG . . 3.350 2.790 2.634 3.004 . 0 0 "[ . 1 . 2]" 1
174 1 10 TYR QE 1 44 TYR QB . . 5.120 4.911 4.450 5.226 0.106 7 0 "[ . 1 . 2]" 1
175 1 10 TYR QE 1 45 TYR HA . . 3.860 3.813 3.408 3.959 0.099 14 0 "[ . 1 . 2]" 1
176 1 10 TYR QE 1 46 ARG H . . 4.390 4.324 3.947 4.474 0.084 20 0 "[ . 1 . 2]" 1
177 1 10 TYR QE 1 46 ARG HD3 . . 3.210 2.884 2.723 3.258 0.048 11 0 "[ . 1 . 2]" 1
178 1 10 TYR QE 1 46 ARG HG2 . . 3.980 2.460 2.282 2.900 . 0 0 "[ . 1 . 2]" 1
179 1 10 TYR QE 1 46 ARG HG3 . . 3.690 3.230 2.806 3.531 . 0 0 "[ . 1 . 2]" 1
180 1 10 TYR QE 1 60 ASP HB2 . . 5.130 3.944 2.741 5.203 0.073 20 0 "[ . 1 . 2]" 1
181 1 10 TYR QE 1 60 ASP HB3 . . 5.500 3.044 2.230 4.174 . 0 0 "[ . 1 . 2]" 1
182 1 10 TYR QE 1 64 ILE HB . . 5.080 4.154 3.885 4.422 . 0 0 "[ . 1 . 2]" 1
183 1 10 TYR QE 1 64 ILE MD . . 3.480 2.608 2.485 2.730 . 0 0 "[ . 1 . 2]" 1
184 1 10 TYR QE 1 64 ILE QG . . 5.420 2.181 2.094 2.423 . 0 0 "[ . 1 . 2]" 1
185 1 10 TYR QE 1 64 ILE HG13 . . 3.470 2.196 2.107 2.444 . 0 0 "[ . 1 . 2]" 1
186 1 10 TYR QE 1 64 ILE MG . . 4.450 3.304 2.904 3.726 . 0 0 "[ . 1 . 2]" 1
187 1 11 MET H 1 11 MET HB2 . . 3.760 2.629 2.501 2.786 . 0 0 "[ . 1 . 2]" 1
188 1 11 MET H 1 11 MET ME . . 4.920 3.182 2.912 3.536 . 0 0 "[ . 1 . 2]" 1
189 1 11 MET H 1 11 MET QG . . 3.850 3.226 3.031 3.611 . 0 0 "[ . 1 . 2]" 1
190 1 11 MET H 1 12 LEU H . . 5.290 4.355 4.202 4.468 . 0 0 "[ . 1 . 2]" 1
191 1 11 MET H 1 44 TYR HA . . 5.030 4.252 3.955 4.524 . 0 0 "[ . 1 . 2]" 1
192 1 11 MET H 1 44 TYR HB3 . . 5.500 4.754 4.415 5.109 . 0 0 "[ . 1 . 2]" 1
193 1 11 MET H 1 44 TYR QD . . 5.100 4.889 4.245 5.175 0.075 5 0 "[ . 1 . 2]" 1
194 1 11 MET H 1 45 TYR H . . 3.700 2.692 2.370 2.898 . 0 0 "[ . 1 . 2]" 1
195 1 11 MET H 1 45 TYR QD . . 5.500 4.376 4.223 4.555 . 0 0 "[ . 1 . 2]" 1
196 1 11 MET H 1 47 PRO HD3 . . 5.500 4.376 3.884 4.915 . 0 0 "[ . 1 . 2]" 1
197 1 11 MET HA 1 11 MET ME . . 4.700 4.253 4.023 4.480 . 0 0 "[ . 1 . 2]" 1
198 1 11 MET HA 1 11 MET QG . . 3.510 2.465 2.274 2.600 . 0 0 "[ . 1 . 2]" 1
199 1 11 MET HA 1 12 LEU H . . 2.840 2.321 2.197 2.454 . 0 0 "[ . 1 . 2]" 1
200 1 11 MET HB2 1 11 MET ME . . 3.960 2.075 1.932 2.200 . 0 0 "[ . 1 . 2]" 1
201 1 11 MET HB2 1 12 LEU H . . 4.520 3.822 3.477 4.277 . 0 0 "[ . 1 . 2]" 1
202 1 11 MET HB2 1 45 TYR H . . 4.820 3.657 3.277 3.937 . 0 0 "[ . 1 . 2]" 1
203 1 11 MET HB2 1 45 TYR QD . . 5.500 3.765 3.448 4.045 . 0 0 "[ . 1 . 2]" 1
204 1 11 MET HB2 1 45 TYR QE . . 3.750 3.255 2.922 3.510 . 0 0 "[ . 1 . 2]" 1
205 1 11 MET HB2 1 46 ARG HA . . 4.930 4.924 4.671 5.004 0.074 11 0 "[ . 1 . 2]" 1
206 1 11 MET HB3 1 11 MET ME . . 4.440 3.349 2.902 3.490 . 0 0 "[ . 1 . 2]" 1
207 1 11 MET HB3 1 12 LEU H . . 3.850 2.736 2.282 3.411 . 0 0 "[ . 1 . 2]" 1
208 1 11 MET HB3 1 45 TYR H . . 5.400 4.855 4.438 5.166 . 0 0 "[ . 1 . 2]" 1
209 1 11 MET HB3 1 45 TYR QD . . 5.500 4.937 4.416 5.387 . 0 0 "[ . 1 . 2]" 1
210 1 11 MET HB3 1 45 TYR QE . . 4.310 3.866 3.441 4.382 0.072 12 0 "[ . 1 . 2]" 1
211 1 11 MET ME 1 45 TYR HB2 . . 4.960 4.232 4.077 4.381 . 0 0 "[ . 1 . 2]" 1
212 1 11 MET ME 1 45 TYR HB3 . . 4.870 5.050 4.958 5.070 0.200 17 0 "[ . 1 . 2]" 1
213 1 11 MET ME 1 45 TYR QD . . 4.540 2.491 2.191 2.730 . 0 0 "[ . 1 . 2]" 1
214 1 11 MET ME 1 45 TYR QE . . 3.680 2.111 2.038 2.352 . 0 0 "[ . 1 . 2]" 1
215 1 11 MET ME 1 46 ARG HA . . 4.560 3.159 2.937 3.336 . 0 0 "[ . 1 . 2]" 1
216 1 11 MET ME 1 47 PRO HA . . 3.680 2.071 1.952 2.227 . 0 0 "[ . 1 . 2]" 1
217 1 11 MET ME 1 47 PRO HD2 . . 5.500 3.597 3.453 3.817 . 0 0 "[ . 1 . 2]" 1
218 1 11 MET ME 1 47 PRO HD3 . . 3.920 2.223 2.022 2.577 . 0 0 "[ . 1 . 2]" 1
219 1 11 MET ME 1 47 PRO HG3 . . 3.260 3.307 3.065 3.364 0.104 12 0 "[ . 1 . 2]" 1
220 1 11 MET ME 1 48 VAL H . . 5.430 3.697 3.432 4.139 . 0 0 "[ . 1 . 2]" 1
221 1 11 MET ME 1 103 GLU QG . . 3.620 3.202 2.530 3.500 . 0 0 "[ . 1 . 2]" 1
222 1 11 MET QG 1 12 LEU H . . 4.740 3.942 3.602 4.364 . 0 0 "[ . 1 . 2]" 1
223 1 11 MET QG 1 45 TYR H . . 5.500 5.265 4.976 5.591 0.091 2 0 "[ . 1 . 2]" 1
224 1 11 MET QG 1 45 TYR QD . . 5.500 5.051 4.665 5.531 0.031 5 0 "[ . 1 . 2]" 1
225 1 11 MET QG 1 45 TYR QE . . 5.130 4.413 4.059 4.851 . 0 0 "[ . 1 . 2]" 1
226 1 11 MET QG 1 47 PRO HD2 . . 5.360 5.131 4.818 5.466 0.106 12 0 "[ . 1 . 2]" 1
227 1 11 MET QG 1 47 PRO HD3 . . 4.660 3.522 3.164 4.055 . 0 0 "[ . 1 . 2]" 1
228 1 12 LEU H 1 12 LEU HB2 . . 3.390 2.954 2.719 3.365 . 0 0 "[ . 1 . 2]" 1
229 1 12 LEU H 1 12 LEU HB3 . . 3.150 2.436 2.230 2.736 . 0 0 "[ . 1 . 2]" 1
230 1 12 LEU H 1 12 LEU QD . . 4.960 3.765 3.343 3.998 . 0 0 "[ . 1 . 2]" 1
231 1 12 LEU H 1 12 LEU HG . . 5.330 4.463 4.291 4.752 . 0 0 "[ . 1 . 2]" 1
232 1 12 LEU H 1 13 GLY H . . 5.100 4.365 3.950 4.634 . 0 0 "[ . 1 . 2]" 1
233 1 12 LEU H 1 44 TYR HA . . 5.500 4.809 4.611 4.997 . 0 0 "[ . 1 . 2]" 1
234 1 12 LEU H 1 44 TYR QD . . 5.500 4.881 4.240 5.413 . 0 0 "[ . 1 . 2]" 1
235 1 12 LEU H 1 44 TYR QE . . 5.500 5.445 4.715 5.593 0.093 11 0 "[ . 1 . 2]" 1
236 1 12 LEU H 1 45 TYR H . . 5.500 5.089 4.912 5.217 . 0 0 "[ . 1 . 2]" 1
237 1 12 LEU H 1 45 TYR QE . . 5.500 5.017 4.673 5.510 0.010 3 0 "[ . 1 . 2]" 1
238 1 12 LEU HA 1 12 LEU QD . . 3.550 2.272 2.119 2.736 . 0 0 "[ . 1 . 2]" 1
239 1 12 LEU HA 1 13 GLY H . . 3.190 2.200 2.088 2.349 . 0 0 "[ . 1 . 2]" 1
240 1 12 LEU HA 1 13 GLY HA3 . . 5.030 4.380 4.307 4.509 . 0 0 "[ . 1 . 2]" 1
241 1 12 LEU HA 1 42 GLN HB2 . . 5.500 5.433 5.136 5.575 0.075 15 0 "[ . 1 . 2]" 1
242 1 12 LEU HA 1 42 GLN HB3 . . 5.470 4.917 4.496 5.526 0.056 9 0 "[ . 1 . 2]" 1
243 1 12 LEU HA 1 44 TYR HA . . 3.670 2.446 2.258 2.698 . 0 0 "[ . 1 . 2]" 1
244 1 12 LEU HA 1 44 TYR QD . . 4.000 3.492 2.699 3.913 . 0 0 "[ . 1 . 2]" 1
245 1 12 LEU HA 1 44 TYR QE . . 5.150 4.342 3.667 4.657 . 0 0 "[ . 1 . 2]" 1
246 1 12 LEU HA 1 45 TYR H . . 4.300 3.862 3.610 4.038 . 0 0 "[ . 1 . 2]" 1
247 1 12 LEU HA 1 45 TYR QD . . 4.390 4.336 4.138 4.475 0.085 3 0 "[ . 1 . 2]" 1
248 1 12 LEU HA 1 45 TYR QE . . 5.350 4.236 3.885 4.584 . 0 0 "[ . 1 . 2]" 1
249 1 12 LEU HB2 1 13 GLY H . . 4.940 4.213 3.852 4.422 . 0 0 "[ . 1 . 2]" 1
250 1 12 LEU HB2 1 44 TYR QD . . 5.490 3.540 2.807 4.403 . 0 0 "[ . 1 . 2]" 1
251 1 12 LEU HB2 1 44 TYR QE . . 3.480 3.145 2.261 3.564 0.084 3 0 "[ . 1 . 2]" 1
252 1 12 LEU HB3 1 13 GLY H . . 5.230 4.229 3.923 4.468 . 0 0 "[ . 1 . 2]" 1
253 1 12 LEU HB3 1 13 GLY HA2 . . 5.500 5.243 4.748 5.567 0.067 19 0 "[ . 1 . 2]" 1
254 1 12 LEU HB3 1 42 GLN HE22 . . 5.500 5.038 4.265 5.555 0.055 9 0 "[ . 1 . 2]" 1
255 1 12 LEU HB3 1 44 TYR QE . . 5.500 4.699 3.910 5.215 . 0 0 "[ . 1 . 2]" 1
256 1 12 LEU QD 1 13 GLY H . . 4.140 2.354 1.718 3.121 . 0 0 "[ . 1 . 2]" 1
257 1 12 LEU QD 1 13 GLY HA3 . . 5.500 3.815 3.269 4.552 . 0 0 "[ . 1 . 2]" 1
258 1 12 LEU QD 1 14 SER HA . . 5.500 3.775 2.142 4.852 . 0 0 "[ . 1 . 2]" 1
259 1 12 LEU QD 1 15 ALA MB . . 5.500 4.810 4.311 5.201 . 0 0 "[ . 1 . 2]" 1
260 1 12 LEU QD 1 42 GLN H . . 5.500 4.383 3.947 4.889 . 0 0 "[ . 1 . 2]" 1
261 1 12 LEU QD 1 42 GLN HA . . 5.300 3.903 3.391 4.648 . 0 0 "[ . 1 . 2]" 1
262 1 12 LEU QD 1 42 GLN HB2 . . 4.250 2.241 1.950 2.704 . 0 0 "[ . 1 . 2]" 1
263 1 12 LEU QD 1 42 GLN HB3 . . 4.150 2.305 1.920 2.932 . 0 0 "[ . 1 . 2]" 1
264 1 12 LEU QD 1 42 GLN HE21 . . 4.650 2.655 1.689 3.084 . 0 0 "[ . 1 . 2]" 1
265 1 12 LEU QD 1 42 GLN HE22 . . 4.150 2.440 1.945 2.995 . 0 0 "[ . 1 . 2]" 1
266 1 12 LEU QD 1 42 GLN HG2 . . 5.280 3.790 3.233 4.165 . 0 0 "[ . 1 . 2]" 1
267 1 12 LEU QD 1 42 GLN HG3 . . 5.500 3.751 3.397 4.131 . 0 0 "[ . 1 . 2]" 1
268 1 12 LEU QD 1 43 VAL H . . 5.200 3.081 2.625 3.924 . 0 0 "[ . 1 . 2]" 1
269 1 12 LEU QD 1 43 VAL HA . . 5.500 3.822 3.333 4.379 . 0 0 "[ . 1 . 2]" 1
270 1 12 LEU QD 1 43 VAL QG . . 5.500 3.930 3.691 4.432 . 0 0 "[ . 1 . 2]" 1
271 1 12 LEU QD 1 44 TYR HA . . 4.940 3.362 2.855 4.107 . 0 0 "[ . 1 . 2]" 1
272 1 12 LEU QD 1 44 TYR QD . . 4.000 3.047 2.735 3.623 . 0 0 "[ . 1 . 2]" 1
273 1 12 LEU QD 1 44 TYR QE . . 3.360 2.655 2.443 3.109 . 0 0 "[ . 1 . 2]" 1
274 1 12 LEU QD 1 45 TYR H . . 5.500 5.001 4.582 5.350 . 0 0 "[ . 1 . 2]" 1
275 1 12 LEU QD 1 45 TYR QE . . 5.500 4.620 3.946 5.270 . 0 0 "[ . 1 . 2]" 1
276 1 12 LEU HG 1 13 GLY H . . 5.190 3.500 2.582 4.198 . 0 0 "[ . 1 . 2]" 1
277 1 12 LEU HG 1 13 GLY HA2 . . 5.500 4.984 4.393 5.606 0.106 1 0 "[ . 1 . 2]" 1
278 1 12 LEU HG 1 14 SER HA . . 5.500 4.719 3.558 5.570 0.070 7 0 "[ . 1 . 2]" 1
279 1 12 LEU HG 1 42 GLN HB3 . . 4.610 3.358 2.667 4.493 . 0 0 "[ . 1 . 2]" 1
280 1 12 LEU HG 1 42 GLN HE21 . . 4.680 3.275 2.358 4.732 0.052 5 0 "[ . 1 . 2]" 1
281 1 12 LEU HG 1 42 GLN HE22 . . 4.810 3.449 2.759 4.875 0.065 4 0 "[ . 1 . 2]" 1
282 1 12 LEU HG 1 42 GLN HG3 . . 5.500 5.318 4.839 5.597 0.097 14 0 "[ . 1 . 2]" 1
283 1 12 LEU HG 1 44 TYR QE . . 4.860 4.678 2.709 4.968 0.108 10 0 "[ . 1 . 2]" 1
284 1 13 GLY H 1 14 SER H . . 4.650 4.530 4.158 4.708 0.058 13 0 "[ . 1 . 2]" 1
285 1 13 GLY H 1 42 GLN HB2 . . 5.500 4.680 4.139 5.283 . 0 0 "[ . 1 . 2]" 1
286 1 13 GLY H 1 43 VAL H . . 4.650 3.019 2.688 3.380 . 0 0 "[ . 1 . 2]" 1
287 1 13 GLY H 1 43 VAL QG . . 5.090 3.460 2.990 3.755 . 0 0 "[ . 1 . 2]" 1
288 1 13 GLY H 1 44 TYR HA . . 4.780 3.304 2.981 3.709 . 0 0 "[ . 1 . 2]" 1
289 1 13 GLY H 1 44 TYR QD . . 5.100 4.809 4.503 5.160 0.060 2 0 "[ . 1 . 2]" 1
290 1 13 GLY H 1 45 TYR H . . 5.500 4.499 3.760 5.256 . 0 0 "[ . 1 . 2]" 1
291 1 13 GLY H 1 45 TYR QD . . 4.310 3.519 2.934 4.119 . 0 0 "[ . 1 . 2]" 1
292 1 13 GLY H 1 45 TYR QE . . 3.480 2.973 2.574 3.312 . 0 0 "[ . 1 . 2]" 1
293 1 13 GLY HA2 1 14 SER H . . 2.940 2.386 2.099 2.621 . 0 0 "[ . 1 . 2]" 1
294 1 13 GLY HA2 1 43 VAL H . . 5.470 4.643 4.332 4.884 . 0 0 "[ . 1 . 2]" 1
295 1 13 GLY HA2 1 43 VAL QG . . 5.500 4.316 3.624 4.762 . 0 0 "[ . 1 . 2]" 1
296 1 13 GLY HA2 1 45 TYR QD . . 4.440 4.426 4.040 4.535 0.095 19 0 "[ . 1 . 2]" 1
297 1 13 GLY HA2 1 45 TYR QE . . 3.170 2.319 2.153 2.451 . 0 0 "[ . 1 . 2]" 1
298 1 13 GLY HA2 1 99 GLN HE21 . . 5.500 3.869 3.203 4.733 . 0 0 "[ . 1 . 2]" 1
299 1 13 GLY HA2 1 99 GLN HE22 . . 5.200 3.838 3.140 4.932 . 0 0 "[ . 1 . 2]" 1
300 1 13 GLY HA3 1 14 SER H . . 3.340 2.955 2.490 3.402 0.062 10 0 "[ . 1 . 2]" 1
301 1 13 GLY HA3 1 42 GLN HA . . 4.560 4.427 3.941 4.637 0.077 7 0 "[ . 1 . 2]" 1
302 1 13 GLY HA3 1 42 GLN HB2 . . 5.500 5.532 5.268 5.592 0.092 5 0 "[ . 1 . 2]" 1
303 1 13 GLY HA3 1 42 GLN HB3 . . 5.430 4.107 3.570 4.765 . 0 0 "[ . 1 . 2]" 1
304 1 13 GLY HA3 1 43 VAL H . . 5.000 3.057 2.787 3.295 . 0 0 "[ . 1 . 2]" 1
305 1 13 GLY HA3 1 43 VAL QG . . 5.240 2.933 2.201 3.462 . 0 0 "[ . 1 . 2]" 1
306 1 13 GLY HA3 1 45 TYR QD . . 4.690 3.712 3.068 4.091 . 0 0 "[ . 1 . 2]" 1
307 1 13 GLY HA3 1 45 TYR QE . . 3.400 2.379 2.084 2.974 . 0 0 "[ . 1 . 2]" 1
308 1 13 GLY HA3 1 99 GLN HE21 . . 5.500 4.048 2.986 5.062 . 0 0 "[ . 1 . 2]" 1
309 1 13 GLY HA3 1 99 GLN HE22 . . 4.980 4.295 3.489 4.983 0.003 6 0 "[ . 1 . 2]" 1
310 1 14 SER H 1 14 SER HB2 . . 3.260 2.815 2.208 3.569 0.309 10 0 "[ . 1 . 2]" 1
311 1 14 SER H 1 14 SER HB3 . . 3.560 3.329 2.506 3.621 0.061 12 0 "[ . 1 . 2]" 1
312 1 14 SER H 1 15 ALA H . . 4.790 4.613 4.498 4.690 . 0 0 "[ . 1 . 2]" 1
313 1 14 SER H 1 16 MET ME . . 5.500 4.740 3.885 5.570 0.070 1 0 "[ . 1 . 2]" 1
314 1 14 SER H 1 42 GLN HE21 . . 5.370 4.667 4.309 5.436 0.066 18 0 "[ . 1 . 2]" 1
315 1 14 SER H 1 43 VAL QG . . 5.500 5.064 4.391 5.326 . 0 0 "[ . 1 . 2]" 1
316 1 14 SER H 1 45 TYR QE . . 4.330 4.367 4.107 4.433 0.103 9 0 "[ . 1 . 2]" 1
317 1 14 SER H 1 99 GLN HE21 . . 5.490 4.738 3.250 5.548 0.058 18 0 "[ . 1 . 2]" 1
318 1 14 SER H 1 99 GLN HE22 . . 4.610 4.269 3.161 5.562 0.952 6 3 "[ -.+ *1 . 2]" 1
319 1 14 SER HA 1 15 ALA H . . 2.660 2.368 2.167 2.560 . 0 0 "[ . 1 . 2]" 1
320 1 14 SER HA 1 15 ALA MB . . 4.350 4.086 3.954 4.201 . 0 0 "[ . 1 . 2]" 1
321 1 14 SER HA 1 42 GLN HB2 . . 5.500 5.417 4.336 5.588 0.088 19 0 "[ . 1 . 2]" 1
322 1 14 SER HA 1 42 GLN HB3 . . 5.500 3.933 2.762 4.332 . 0 0 "[ . 1 . 2]" 1
323 1 14 SER HA 1 42 GLN HE21 . . 4.020 2.481 2.017 2.986 . 0 0 "[ . 1 . 2]" 1
324 1 14 SER HA 1 42 GLN HE22 . . 4.470 3.627 2.727 4.344 . 0 0 "[ . 1 . 2]" 1
325 1 14 SER HA 1 42 GLN HG3 . . 5.310 5.259 4.795 5.399 0.089 7 0 "[ . 1 . 2]" 1
326 1 14 SER HB2 1 15 ALA H . . 3.540 3.359 2.587 3.873 0.333 14 0 "[ . 1 . 2]" 1
327 1 14 SER HB2 1 15 ALA MB . . 5.340 4.764 4.130 5.290 . 0 0 "[ . 1 . 2]" 1
328 1 14 SER HB3 1 15 ALA MB . . 5.210 4.437 3.858 5.252 0.042 3 0 "[ . 1 . 2]" 1
329 1 15 ALA H 1 15 ALA MB . . 2.980 2.221 2.115 2.340 . 0 0 "[ . 1 . 2]" 1
330 1 15 ALA H 1 42 GLN HE21 . . 4.510 3.242 1.979 4.202 . 0 0 "[ . 1 . 2]" 1
331 1 15 ALA H 1 42 GLN HE22 . . 4.980 4.202 3.095 4.890 . 0 0 "[ . 1 . 2]" 1
332 1 15 ALA H 1 42 GLN HG2 . . 5.120 3.072 2.784 3.341 . 0 0 "[ . 1 . 2]" 1
333 1 15 ALA H 1 42 GLN HG3 . . 4.780 4.596 4.026 4.821 0.041 7 0 "[ . 1 . 2]" 1
334 1 15 ALA HA 1 16 MET H . . 2.850 2.148 2.053 2.248 . 0 0 "[ . 1 . 2]" 1
335 1 15 ALA HA 1 16 MET HA . . 4.740 4.423 4.352 4.552 . 0 0 "[ . 1 . 2]" 1
336 1 15 ALA HA 1 16 MET HB2 . . 5.500 5.507 4.763 5.600 0.100 9 0 "[ . 1 . 2]" 1
337 1 15 ALA HA 1 16 MET HB3 . . 5.500 4.755 4.292 5.580 0.080 18 0 "[ . 1 . 2]" 1
338 1 15 ALA HA 1 16 MET ME . . 5.490 5.206 4.810 5.566 0.076 14 0 "[ . 1 . 2]" 1
339 1 15 ALA HA 1 16 MET HG2 . . 5.080 3.695 3.305 4.272 . 0 0 "[ . 1 . 2]" 1
340 1 15 ALA HA 1 16 MET HG3 . . 5.250 4.996 4.214 5.334 0.084 2 0 "[ . 1 . 2]" 1
341 1 15 ALA HA 1 41 ASN HB2 . . 5.500 3.823 2.958 5.063 . 0 0 "[ . 1 . 2]" 1
342 1 15 ALA HA 1 41 ASN HB3 . . 5.040 2.523 2.194 3.374 . 0 0 "[ . 1 . 2]" 1
343 1 15 ALA HA 1 41 ASN HD21 . . 5.500 4.282 3.739 5.313 . 0 0 "[ . 1 . 2]" 1
344 1 15 ALA HA 1 41 ASN HD22 . . 5.500 5.458 4.830 5.598 0.098 19 0 "[ . 1 . 2]" 1
345 1 15 ALA HA 1 42 GLN H . . 5.500 4.278 3.985 4.629 . 0 0 "[ . 1 . 2]" 1
346 1 15 ALA HA 1 42 GLN HA . . 3.880 3.025 2.728 3.414 . 0 0 "[ . 1 . 2]" 1
347 1 15 ALA HA 1 42 GLN HB2 . . 4.610 4.679 4.635 4.704 0.094 5 0 "[ . 1 . 2]" 1
348 1 15 ALA HA 1 42 GLN HB3 . . 4.160 3.998 3.518 4.231 0.071 20 0 "[ . 1 . 2]" 1
349 1 15 ALA HA 1 42 GLN HE21 . . 5.440 4.222 3.081 4.691 . 0 0 "[ . 1 . 2]" 1
350 1 15 ALA HA 1 42 GLN HE22 . . 5.500 5.440 4.721 5.582 0.082 2 0 "[ . 1 . 2]" 1
351 1 15 ALA HA 1 42 GLN HG2 . . 3.850 2.151 1.988 2.334 . 0 0 "[ . 1 . 2]" 1
352 1 15 ALA HA 1 42 GLN HG3 . . 3.560 3.284 2.454 3.654 0.094 4 0 "[ . 1 . 2]" 1
353 1 15 ALA MB 1 16 MET H . . 3.640 2.960 2.755 3.266 . 0 0 "[ . 1 . 2]" 1
354 1 15 ALA MB 1 16 MET HA . . 5.060 4.016 3.800 4.226 . 0 0 "[ . 1 . 2]" 1
355 1 15 ALA MB 1 16 MET HG2 . . 5.500 4.767 4.467 5.358 . 0 0 "[ . 1 . 2]" 1
356 1 15 ALA MB 1 17 SER H . . 5.500 5.496 5.034 5.601 0.101 14 0 "[ . 1 . 2]" 1
357 1 15 ALA MB 1 41 ASN HB2 . . 5.500 3.008 2.387 3.803 . 0 0 "[ . 1 . 2]" 1
358 1 15 ALA MB 1 41 ASN HB3 . . 5.500 2.237 2.066 2.530 . 0 0 "[ . 1 . 2]" 1
359 1 15 ALA MB 1 41 ASN HD21 . . 4.050 3.617 3.071 4.223 0.173 3 0 "[ . 1 . 2]" 1
360 1 15 ALA MB 1 41 ASN HD22 . . 4.330 4.068 3.431 4.404 0.074 6 0 "[ . 1 . 2]" 1
361 1 15 ALA MB 1 42 GLN HA . . 5.500 4.417 4.179 4.766 . 0 0 "[ . 1 . 2]" 1
362 1 15 ALA MB 1 42 GLN HB2 . . 4.890 4.893 4.723 4.988 0.098 10 0 "[ . 1 . 2]" 1
363 1 15 ALA MB 1 42 GLN HB3 . . 5.500 4.567 4.091 4.858 . 0 0 "[ . 1 . 2]" 1
364 1 15 ALA MB 1 42 GLN HE21 . . 5.340 3.802 2.792 4.237 . 0 0 "[ . 1 . 2]" 1
365 1 15 ALA MB 1 42 GLN HE22 . . 5.500 4.268 3.608 4.604 . 0 0 "[ . 1 . 2]" 1
366 1 15 ALA MB 1 42 GLN HG2 . . 4.680 2.439 2.151 2.939 . 0 0 "[ . 1 . 2]" 1
367 1 15 ALA MB 1 42 GLN HG3 . . 4.460 3.032 2.657 3.443 . 0 0 "[ . 1 . 2]" 1
368 1 16 MET H 1 16 MET HB2 . . 4.180 3.735 2.873 3.976 . 0 0 "[ . 1 . 2]" 1
369 1 16 MET H 1 16 MET HB3 . . 3.790 3.502 3.114 3.864 0.074 3 0 "[ . 1 . 2]" 1
370 1 16 MET H 1 16 MET ME . . 5.090 4.600 3.915 4.882 . 0 0 "[ . 1 . 2]" 1
371 1 16 MET H 1 16 MET HG2 . . 4.130 2.482 2.027 3.056 . 0 0 "[ . 1 . 2]" 1
372 1 16 MET H 1 16 MET HG3 . . 4.180 3.405 3.038 3.767 . 0 0 "[ . 1 . 2]" 1
373 1 16 MET H 1 17 SER H . . 4.620 4.382 4.135 4.502 . 0 0 "[ . 1 . 2]" 1
374 1 16 MET H 1 41 ASN H . . 5.490 5.556 5.479 5.582 0.092 9 0 "[ . 1 . 2]" 1
375 1 16 MET H 1 41 ASN HB2 . . 4.970 4.374 3.946 5.050 0.080 15 0 "[ . 1 . 2]" 1
376 1 16 MET H 1 41 ASN HB3 . . 4.200 2.751 2.216 3.609 . 0 0 "[ . 1 . 2]" 1
377 1 16 MET H 1 41 ASN HD21 . . 5.500 2.981 2.277 4.993 . 0 0 "[ . 1 . 2]" 1
378 1 16 MET H 1 41 ASN HD22 . . 5.230 4.315 3.433 5.022 . 0 0 "[ . 1 . 2]" 1
379 1 16 MET H 1 42 GLN HA . . 4.560 3.952 3.380 4.409 . 0 0 "[ . 1 . 2]" 1
380 1 16 MET H 1 42 GLN HG2 . . 5.500 4.194 3.955 4.370 . 0 0 "[ . 1 . 2]" 1
381 1 16 MET H 1 42 GLN HG3 . . 5.410 4.991 4.123 5.463 0.053 9 0 "[ . 1 . 2]" 1
382 1 16 MET H 1 95 MET ME . . 5.360 4.355 3.837 4.922 . 0 0 "[ . 1 . 2]" 1
383 1 16 MET HA 1 16 MET HG2 . . 4.070 3.657 2.767 3.922 . 0 0 "[ . 1 . 2]" 1
384 1 16 MET HA 1 16 MET HG3 . . 4.120 3.981 3.650 4.194 0.074 2 0 "[ . 1 . 2]" 1
385 1 16 MET HA 1 17 SER H . . 2.800 2.310 2.077 2.580 . 0 0 "[ . 1 . 2]" 1
386 1 16 MET HB2 1 17 SER H . . 3.930 2.721 2.401 3.486 . 0 0 "[ . 1 . 2]" 1
387 1 16 MET HB2 1 17 SER HB2 . . 5.500 5.180 4.284 6.135 0.635 18 1 "[ . 1 . + 2]" 1
388 1 16 MET HB2 1 17 SER HB3 . . 5.500 5.284 4.584 6.126 0.626 18 1 "[ . 1 . + 2]" 1
389 1 16 MET HB3 1 16 MET ME . . 3.630 3.237 2.452 3.979 0.349 3 0 "[ . 1 . 2]" 1
390 1 16 MET HB3 1 17 SER H . . 3.910 3.657 2.595 3.991 0.081 15 0 "[ . 1 . 2]" 1
391 1 16 MET HB3 1 98 THR MG . . 5.010 4.874 4.159 5.112 0.102 9 0 "[ . 1 . 2]" 1
392 1 16 MET ME 1 16 MET HG2 . . 3.160 2.759 2.195 3.270 0.110 12 0 "[ . 1 . 2]" 1
393 1 16 MET ME 1 16 MET HG3 . . 3.480 2.519 2.102 3.331 . 0 0 "[ . 1 . 2]" 1
394 1 16 MET ME 1 42 GLN HA . . 4.520 4.330 3.689 4.601 0.081 12 0 "[ . 1 . 2]" 1
395 1 16 MET ME 1 43 VAL H . . 4.840 4.477 3.810 4.920 0.080 12 0 "[ . 1 . 2]" 1
396 1 16 MET ME 1 43 VAL QG . . 4.030 2.939 2.412 3.564 . 0 0 "[ . 1 . 2]" 1
397 1 16 MET ME 1 95 MET H . . 5.500 4.833 4.468 5.299 . 0 0 "[ . 1 . 2]" 1
398 1 16 MET ME 1 95 MET HA . . 4.000 2.817 2.265 3.616 . 0 0 "[ . 1 . 2]" 1
399 1 16 MET ME 1 95 MET HB3 . . 2.930 2.143 1.975 2.408 . 0 0 "[ . 1 . 2]" 1
400 1 16 MET ME 1 95 MET HG3 . . 4.270 4.330 3.817 4.806 0.536 9 2 "[ -. +1 . 2]" 1
401 1 16 MET ME 1 96 CYS H . . 5.500 4.595 4.257 4.905 . 0 0 "[ . 1 . 2]" 1
402 1 16 MET ME 1 98 THR H . . 5.230 4.297 3.784 4.815 . 0 0 "[ . 1 . 2]" 1
403 1 16 MET ME 1 98 THR HA . . 5.500 5.157 4.701 5.591 0.091 19 0 "[ . 1 . 2]" 1
404 1 16 MET ME 1 98 THR HB . . 3.600 2.963 2.354 3.682 0.082 13 0 "[ . 1 . 2]" 1
405 1 16 MET ME 1 98 THR MG . . 3.420 2.473 1.982 3.000 . 0 0 "[ . 1 . 2]" 1
406 1 16 MET ME 1 99 GLN H . . 3.820 3.322 2.754 3.781 . 0 0 "[ . 1 . 2]" 1
407 1 16 MET ME 1 99 GLN HA . . 4.360 3.865 3.277 4.348 . 0 0 "[ . 1 . 2]" 1
408 1 16 MET ME 1 99 GLN HE22 . . 5.500 4.725 4.153 5.817 0.317 11 0 "[ . 1 . 2]" 1
409 1 16 MET ME 1 102 LYS QD . . 4.600 3.854 2.898 4.619 0.019 8 0 "[ . 1 . 2]" 1
410 1 16 MET ME 1 102 LYS QE . . 4.320 4.143 3.651 4.426 0.106 3 0 "[ . 1 . 2]" 1
411 1 16 MET HG2 1 17 SER H . . 5.240 4.784 4.179 5.182 . 0 0 "[ . 1 . 2]" 1
412 1 16 MET HG2 1 41 ASN HB3 . . 5.500 4.848 4.051 5.583 0.083 9 0 "[ . 1 . 2]" 1
413 1 16 MET HG2 1 42 GLN HA . . 5.290 3.923 2.940 4.372 . 0 0 "[ . 1 . 2]" 1
414 1 16 MET HG3 1 17 SER H . . 5.080 4.409 3.530 5.156 0.076 18 0 "[ . 1 . 2]" 1
415 1 16 MET HG3 1 42 GLN HA . . 5.500 5.040 3.884 5.574 0.074 16 0 "[ . 1 . 2]" 1
416 1 16 MET HG3 1 43 VAL QG . . 5.500 4.609 4.118 5.226 . 0 0 "[ . 1 . 2]" 1
417 1 16 MET HG3 1 95 MET ME . . 4.090 3.905 2.801 4.182 0.092 12 0 "[ . 1 . 2]" 1
418 1 16 MET HG3 1 98 THR MG . . 5.500 4.946 4.107 5.571 0.071 20 0 "[ . 1 . 2]" 1
419 1 17 SER H 1 17 SER HB3 . . 3.200 2.926 2.572 3.524 0.324 13 0 "[ . 1 . 2]" 1
420 1 17 SER HA 1 18 ARG H . . 2.780 2.156 1.900 2.339 . 0 0 "[ . 1 . 2]" 1
421 1 17 SER HA 1 18 ARG HB2 . . 4.990 4.944 4.630 5.358 0.368 13 0 "[ . 1 . 2]" 1
422 1 17 SER HA 1 18 ARG HG3 . . 5.090 4.170 3.285 5.793 0.703 19 1 "[ . 1 . +2]" 1
423 1 17 SER HB2 1 18 ARG H . . 3.980 3.765 2.821 4.272 0.292 16 0 "[ . 1 . 2]" 1
424 1 17 SER HB3 1 18 ARG H . . 4.190 3.810 2.838 4.257 0.067 18 0 "[ . 1 . 2]" 1
425 1 18 ARG H 1 18 ARG HB2 . . 3.480 2.814 2.425 3.366 . 0 0 "[ . 1 . 2]" 1
426 1 18 ARG H 1 18 ARG HD2 . . 5.290 3.365 2.014 4.506 . 0 0 "[ . 1 . 2]" 1
427 1 18 ARG H 1 18 ARG HD3 . . 5.070 4.223 3.644 4.675 . 0 0 "[ . 1 . 2]" 1
428 1 18 ARG H 1 18 ARG HE . . 5.500 3.923 2.252 5.248 . 0 0 "[ . 1 . 2]" 1
429 1 18 ARG H 1 18 ARG HG2 . . 4.350 3.358 1.681 4.165 . 0 0 "[ . 1 . 2]" 1
430 1 18 ARG H 1 18 ARG HG3 . . 3.620 2.554 1.810 3.617 . 0 0 "[ . 1 . 2]" 1
431 1 18 ARG H 1 19 PRO HD2 . . 5.500 4.957 4.842 5.128 . 0 0 "[ . 1 . 2]" 1
432 1 18 ARG H 1 19 PRO HD3 . . 5.100 4.748 4.474 4.978 . 0 0 "[ . 1 . 2]" 1
433 1 18 ARG H 1 41 ASN HA . . 5.500 5.421 5.060 5.583 0.083 19 0 "[ . 1 . 2]" 1
434 1 18 ARG HA 1 18 ARG HD2 . . 5.140 4.503 3.922 5.212 0.072 10 0 "[ . 1 . 2]" 1
435 1 18 ARG HA 1 18 ARG HD3 . . 5.500 4.582 3.296 4.997 . 0 0 "[ . 1 . 2]" 1
436 1 18 ARG HA 1 18 ARG HE . . 5.500 5.050 3.430 5.553 0.053 18 0 "[ . 1 . 2]" 1
437 1 18 ARG HA 1 18 ARG HG2 . . 3.700 3.178 2.482 3.581 . 0 0 "[ . 1 . 2]" 1
438 1 18 ARG HA 1 18 ARG HG3 . . 3.270 2.908 2.413 3.797 0.527 19 2 "[ . 1 - . +2]" 1
439 1 18 ARG HA 1 19 PRO HD2 . . 3.290 2.323 2.155 2.547 . 0 0 "[ . 1 . 2]" 1
440 1 18 ARG HA 1 19 PRO HD3 . . 3.440 2.299 2.006 2.492 . 0 0 "[ . 1 . 2]" 1
441 1 18 ARG HA 1 19 PRO QG . . 4.800 3.961 3.874 4.050 . 0 0 "[ . 1 . 2]" 1
442 1 18 ARG HA 1 41 ASN HA . . 4.890 4.928 4.671 4.986 0.096 9 0 "[ . 1 . 2]" 1
443 1 18 ARG HA 1 91 VAL QG . . 5.130 3.273 2.928 3.622 . 0 0 "[ . 1 . 2]" 1
444 1 18 ARG HA 1 95 MET ME . . 4.320 4.211 3.753 4.427 0.107 10 0 "[ . 1 . 2]" 1
445 1 18 ARG HA 1 95 MET HG2 . . 5.500 4.216 3.647 4.884 . 0 0 "[ . 1 . 2]" 1
446 1 18 ARG HA 1 95 MET HG3 . . 5.500 4.172 3.648 4.589 . 0 0 "[ . 1 . 2]" 1
447 1 18 ARG HB2 1 18 ARG HE . . 5.460 4.398 3.688 5.066 . 0 0 "[ . 1 . 2]" 1
448 1 18 ARG HB2 1 19 PRO HD3 . . 5.140 4.788 4.323 5.114 . 0 0 "[ . 1 . 2]" 1
449 1 18 ARG HB2 1 36 MET QB . . 2.860 2.777 2.411 2.907 0.047 18 0 "[ . 1 . 2]" 1
450 1 18 ARG HB2 1 41 ASN HD22 . . 5.500 5.482 5.119 6.007 0.507 13 1 "[ . 1 + . 2]" 1
451 1 18 ARG HB2 1 91 VAL QG . . 4.540 3.634 2.968 3.948 . 0 0 "[ . 1 . 2]" 1
452 1 18 ARG HB3 1 18 ARG HD2 . . 3.920 3.338 2.776 3.718 . 0 0 "[ . 1 . 2]" 1
453 1 18 ARG HB3 1 18 ARG HE . . 5.290 4.655 4.069 5.220 . 0 0 "[ . 1 . 2]" 1
454 1 18 ARG HB3 1 18 ARG HG2 . . 2.440 2.360 2.112 3.028 0.588 19 1 "[ . 1 . +2]" 1
455 1 18 ARG HB3 1 19 PRO HD3 . . 4.280 4.002 3.494 4.326 0.046 7 0 "[ . 1 . 2]" 1
456 1 18 ARG HB3 1 91 VAL QG . . 4.110 2.396 2.106 2.656 . 0 0 "[ . 1 . 2]" 1
457 1 18 ARG HD2 1 36 MET QB . . 5.310 3.034 2.178 3.921 . 0 0 "[ . 1 . 2]" 1
458 1 18 ARG HD2 1 36 MET ME . . 5.020 3.938 2.639 4.925 . 0 0 "[ . 1 . 2]" 1
459 1 18 ARG HD2 1 36 MET HG2 . . 5.500 4.411 3.629 5.515 0.015 1 0 "[ . 1 . 2]" 1
460 1 18 ARG HD2 1 36 MET HG3 . . 5.500 2.979 2.085 4.072 . 0 0 "[ . 1 . 2]" 1
461 1 18 ARG HD2 1 37 TYR HA . . 5.430 3.450 2.088 4.729 . 0 0 "[ . 1 . 2]" 1
462 1 18 ARG HD3 1 36 MET HA . . 5.500 4.170 3.502 4.871 . 0 0 "[ . 1 . 2]" 1
463 1 18 ARG HD3 1 36 MET QB . . 5.410 2.761 2.067 3.700 . 0 0 "[ . 1 . 2]" 1
464 1 18 ARG HD3 1 36 MET ME . . 4.740 4.414 3.685 5.096 0.356 3 0 "[ . 1 . 2]" 1
465 1 18 ARG HD3 1 36 MET HG2 . . 4.990 4.635 3.683 5.554 0.564 20 2 "[ . 1 . -+]" 1
466 1 18 ARG HD3 1 36 MET HG3 . . 4.170 3.233 2.077 4.368 0.198 19 0 "[ . 1 . 2]" 1
467 1 18 ARG HD3 1 37 TYR HA . . 5.500 2.915 2.071 3.694 . 0 0 "[ . 1 . 2]" 1
468 1 18 ARG HD3 1 37 TYR QD . . 5.500 4.405 3.592 5.597 0.097 19 0 "[ . 1 . 2]" 1
469 1 18 ARG HD3 1 91 VAL QG . . 5.500 3.721 2.476 4.595 . 0 0 "[ . 1 . 2]" 1
470 1 18 ARG HE 1 36 MET HG3 . . 5.370 4.926 4.241 5.425 0.055 15 0 "[ . 1 . 2]" 1
471 1 18 ARG HE 1 37 TYR HA . . 5.500 3.141 2.069 4.343 . 0 0 "[ . 1 . 2]" 1
472 1 18 ARG HE 1 37 TYR QD . . 5.500 5.017 4.216 5.591 0.091 20 0 "[ . 1 . 2]" 1
473 1 18 ARG HE 1 41 ASN HB2 . . 5.500 4.810 4.278 5.574 0.074 12 0 "[ . 1 . 2]" 1
474 1 18 ARG HE 1 41 ASN HB3 . . 5.500 4.991 3.851 5.571 0.071 9 0 "[ . 1 . 2]" 1
475 1 18 ARG HE 1 41 ASN HD21 . . 3.610 3.433 2.317 3.696 0.086 20 0 "[ . 1 . 2]" 1
476 1 18 ARG HG2 1 19 PRO HD2 . . 5.500 4.501 3.545 5.277 . 0 0 "[ . 1 . 2]" 1
477 1 18 ARG HG2 1 36 MET QB . . 5.430 3.447 2.648 4.723 . 0 0 "[ . 1 . 2]" 1
478 1 18 ARG HG2 1 91 VAL QG . . 4.400 3.153 2.220 4.468 0.068 10 0 "[ . 1 . 2]" 1
479 1 18 ARG HG3 1 19 PRO HD2 . . 5.500 4.669 3.969 5.418 . 0 0 "[ . 1 . 2]" 1
480 1 18 ARG HG3 1 19 PRO HD3 . . 5.370 5.092 4.445 5.782 0.412 13 0 "[ . 1 . 2]" 1
481 1 19 PRO HA 1 20 MET H . . 2.810 2.464 2.196 2.711 . 0 0 "[ . 1 . 2]" 1
482 1 19 PRO HA 1 20 MET HA . . 5.190 4.527 4.436 4.619 . 0 0 "[ . 1 . 2]" 1
483 1 19 PRO HA 1 20 MET QB . . 4.650 4.471 4.118 4.700 0.050 2 0 "[ . 1 . 2]" 1
484 1 19 PRO HA 1 20 MET ME . . 5.500 5.320 4.750 5.603 0.103 1 0 "[ . 1 . 2]" 1
485 1 19 PRO HA 1 20 MET HG3 . . 5.430 5.485 4.778 6.299 0.869 1 2 "[+ . 1 -. 2]" 1
486 1 19 PRO HA 1 21 ILE HG13 . . 5.500 5.005 4.803 5.251 . 0 0 "[ . 1 . 2]" 1
487 1 19 PRO HB2 1 20 MET H . . 4.060 2.553 2.141 3.057 . 0 0 "[ . 1 . 2]" 1
488 1 19 PRO HB2 1 20 MET HA . . 5.500 4.306 4.158 4.549 . 0 0 "[ . 1 . 2]" 1
489 1 19 PRO HB2 1 21 ILE H . . 5.500 4.363 3.528 5.052 . 0 0 "[ . 1 . 2]" 1
490 1 19 PRO HB2 1 21 ILE HB . . 5.500 5.221 4.753 5.562 0.062 8 0 "[ . 1 . 2]" 1
491 1 19 PRO HB2 1 21 ILE MD . . 3.970 3.721 3.449 4.004 0.034 12 0 "[ . 1 . 2]" 1
492 1 19 PRO HB2 1 21 ILE HG12 . . 4.570 3.290 3.019 3.635 . 0 0 "[ . 1 . 2]" 1
493 1 19 PRO HB2 1 21 ILE HG13 . . 4.950 2.787 2.339 3.132 . 0 0 "[ . 1 . 2]" 1
494 1 19 PRO HB2 1 21 ILE MG . . 5.350 5.080 4.843 5.369 0.019 8 0 "[ . 1 . 2]" 1
495 1 19 PRO HB2 1 91 VAL HA . . 5.500 5.353 5.076 5.572 0.072 12 0 "[ . 1 . 2]" 1
496 1 19 PRO HB2 1 91 VAL QG . . 5.420 4.936 4.581 5.252 . 0 0 "[ . 1 . 2]" 1
497 1 19 PRO HB2 1 94 GLN HB3 . . 5.350 3.918 3.606 4.343 . 0 0 "[ . 1 . 2]" 1
498 1 19 PRO HB2 1 94 GLN HE22 . . 5.500 5.109 3.942 5.585 0.085 14 0 "[ . 1 . 2]" 1
499 1 19 PRO HB2 1 94 GLN HG2 . . 4.390 3.045 2.258 3.815 . 0 0 "[ . 1 . 2]" 1
500 1 19 PRO HB2 1 94 GLN HG3 . . 5.380 4.481 3.417 5.094 . 0 0 "[ . 1 . 2]" 1
501 1 19 PRO HB3 1 20 MET H . . 4.140 3.365 3.085 3.747 . 0 0 "[ . 1 . 2]" 1
502 1 19 PRO HB3 1 21 ILE MD . . 5.170 4.656 4.419 4.956 . 0 0 "[ . 1 . 2]" 1
503 1 19 PRO HB3 1 21 ILE HG12 . . 5.500 4.788 4.388 5.157 . 0 0 "[ . 1 . 2]" 1
504 1 19 PRO HB3 1 21 ILE HG13 . . 5.360 4.382 4.005 4.746 . 0 0 "[ . 1 . 2]" 1
505 1 19 PRO HB3 1 94 GLN HG2 . . 3.350 3.190 2.790 3.422 0.072 5 0 "[ . 1 . 2]" 1
506 1 19 PRO HD2 1 91 VAL HA . . 4.620 3.357 2.922 3.781 . 0 0 "[ . 1 . 2]" 1
507 1 19 PRO HD2 1 91 VAL QG . . 4.970 2.356 2.044 2.543 . 0 0 "[ . 1 . 2]" 1
508 1 19 PRO HD2 1 94 GLN HB3 . . 5.500 4.165 3.780 4.524 . 0 0 "[ . 1 . 2]" 1
509 1 19 PRO HD2 1 95 MET ME . . 4.770 4.286 3.790 4.643 . 0 0 "[ . 1 . 2]" 1
510 1 19 PRO HD2 1 95 MET HG2 . . 5.080 4.053 3.065 5.124 0.044 19 0 "[ . 1 . 2]" 1
511 1 19 PRO HD2 1 95 MET HG3 . . 4.860 3.410 2.779 4.161 . 0 0 "[ . 1 . 2]" 1
512 1 19 PRO HD3 1 91 VAL QG . . 3.930 3.708 3.102 3.953 0.023 14 0 "[ . 1 . 2]" 1
513 1 19 PRO HD3 1 95 MET HA . . 5.500 4.719 4.219 5.512 0.012 12 0 "[ . 1 . 2]" 1
514 1 19 PRO HD3 1 95 MET ME . . 5.010 4.451 4.108 4.696 . 0 0 "[ . 1 . 2]" 1
515 1 19 PRO HD3 1 95 MET HG2 . . 4.400 2.927 2.313 3.679 . 0 0 "[ . 1 . 2]" 1
516 1 19 PRO HD3 1 95 MET HG3 . . 4.530 3.028 2.312 3.587 . 0 0 "[ . 1 . 2]" 1
517 1 19 PRO QG 1 20 MET H . . 5.500 4.187 3.837 4.604 . 0 0 "[ . 1 . 2]" 1
518 1 19 PRO QG 1 21 ILE MD . . 4.150 2.223 2.040 2.443 . 0 0 "[ . 1 . 2]" 1
519 1 19 PRO QG 1 21 ILE HG12 . . 5.030 3.233 3.028 3.466 . 0 0 "[ . 1 . 2]" 1
520 1 19 PRO QG 1 21 ILE HG13 . . 5.210 2.385 2.188 2.746 . 0 0 "[ . 1 . 2]" 1
521 1 19 PRO QG 1 21 ILE MG . . 5.500 4.663 4.523 4.866 . 0 0 "[ . 1 . 2]" 1
522 1 19 PRO QG 1 91 VAL HA . . 4.590 2.992 2.726 3.219 . 0 0 "[ . 1 . 2]" 1
523 1 19 PRO QG 1 91 VAL QG . . 4.130 3.092 2.569 3.410 . 0 0 "[ . 1 . 2]" 1
524 1 19 PRO QG 1 94 GLN HG2 . . 4.390 2.556 2.322 2.868 . 0 0 "[ . 1 . 2]" 1
525 1 19 PRO QG 1 95 MET H . . 5.500 3.822 3.186 4.288 . 0 0 "[ . 1 . 2]" 1
526 1 19 PRO QG 1 95 MET HA . . 5.500 4.232 3.780 4.959 . 0 0 "[ . 1 . 2]" 1
527 1 19 PRO QG 1 95 MET HG2 . . 4.520 3.486 2.697 4.119 . 0 0 "[ . 1 . 2]" 1
528 1 19 PRO QG 1 95 MET HG3 . . 4.810 3.159 2.429 3.821 . 0 0 "[ . 1 . 2]" 1
529 1 20 MET H 1 20 MET QB . . 3.120 2.395 2.201 2.555 . 0 0 "[ . 1 . 2]" 1
530 1 20 MET H 1 20 MET ME . . 4.990 4.545 4.110 5.063 0.073 15 0 "[ . 1 . 2]" 1
531 1 20 MET H 1 20 MET HG2 . . 4.800 3.360 2.973 4.441 . 0 0 "[ . 1 . 2]" 1
532 1 20 MET H 1 20 MET HG3 . . 4.500 3.975 3.374 4.521 0.021 12 0 "[ . 1 . 2]" 1
533 1 20 MET H 1 21 ILE H . . 4.780 4.127 3.446 4.492 . 0 0 "[ . 1 . 2]" 1
534 1 20 MET H 1 21 ILE HA . . 5.500 4.870 4.124 5.311 . 0 0 "[ . 1 . 2]" 1
535 1 20 MET H 1 21 ILE MD . . 5.500 5.428 5.083 5.585 0.085 1 0 "[ . 1 . 2]" 1
536 1 20 MET H 1 21 ILE HG12 . . 5.500 5.023 4.670 5.366 . 0 0 "[ . 1 . 2]" 1
537 1 20 MET H 1 32 TYR QE . . 5.500 4.856 4.531 5.043 . 0 0 "[ . 1 . 2]" 1
538 1 20 MET H 1 36 MET ME . . 5.500 5.229 4.472 5.606 0.106 17 0 "[ . 1 . 2]" 1
539 1 20 MET HA 1 20 MET ME . . 4.070 2.648 2.018 3.799 . 0 0 "[ . 1 . 2]" 1
540 1 20 MET HA 1 21 ILE H . . 3.080 2.202 2.093 2.412 . 0 0 "[ . 1 . 2]" 1
541 1 20 MET HA 1 21 ILE HA . . 4.540 4.467 4.404 4.513 . 0 0 "[ . 1 . 2]" 1
542 1 20 MET HA 1 21 ILE HB . . 5.500 4.653 4.291 4.848 . 0 0 "[ . 1 . 2]" 1
543 1 20 MET HA 1 21 ILE HG12 . . 5.500 5.292 5.015 5.505 0.005 12 0 "[ . 1 . 2]" 1
544 1 20 MET HA 1 21 ILE HG13 . . 4.090 3.994 3.693 4.176 0.086 3 0 "[ . 1 . 2]" 1
545 1 20 MET HA 1 32 TYR QD . . 4.400 4.239 3.853 4.461 0.061 4 0 "[ . 1 . 2]" 1
546 1 20 MET HA 1 32 TYR QE . . 2.930 2.261 2.057 2.508 . 0 0 "[ . 1 . 2]" 1
547 1 20 MET HA 1 36 MET ME . . 4.530 3.894 3.147 4.466 . 0 0 "[ . 1 . 2]" 1
548 1 20 MET QB 1 21 ILE H . . 4.360 3.499 2.948 3.907 . 0 0 "[ . 1 . 2]" 1
549 1 20 MET QB 1 21 ILE HA . . 5.440 4.332 3.956 4.531 . 0 0 "[ . 1 . 2]" 1
550 1 20 MET QB 1 22 HIS H . . 5.500 5.522 5.360 5.595 0.095 5 0 "[ . 1 . 2]" 1
551 1 20 MET QB 1 22 HIS HE1 . . 5.500 3.269 2.366 4.235 . 0 0 "[ . 1 . 2]" 1
552 1 20 MET QB 1 32 TYR QE . . 5.320 4.226 4.035 4.503 . 0 0 "[ . 1 . 2]" 1
553 1 20 MET HB3 1 22 HIS HE1 . . 4.920 3.365 2.395 4.342 . 0 0 "[ . 1 . 2]" 1
554 1 20 MET ME 1 20 MET HG3 . . 3.630 3.054 2.095 3.467 . 0 0 "[ . 1 . 2]" 1
555 1 20 MET ME 1 21 ILE H . . 5.030 3.938 2.631 5.125 0.095 18 0 "[ . 1 . 2]" 1
556 1 20 MET ME 1 32 TYR QD . . 4.510 3.436 2.162 4.607 0.097 10 0 "[ . 1 . 2]" 1
557 1 20 MET ME 1 32 TYR QE . . 4.690 2.880 2.041 4.359 . 0 0 "[ . 1 . 2]" 1
558 1 20 MET ME 1 33 ARG HA . . 4.510 3.320 2.204 3.844 . 0 0 "[ . 1 . 2]" 1
559 1 20 MET ME 1 33 ARG QD . . 4.510 4.013 3.223 4.357 . 0 0 "[ . 1 . 2]" 1
560 1 20 MET ME 1 33 ARG HE . . 5.500 3.447 2.567 4.888 . 0 0 "[ . 1 . 2]" 1
561 1 20 MET ME 1 33 ARG HG3 . . 5.010 4.532 4.017 4.983 . 0 0 "[ . 1 . 2]" 1
562 1 20 MET ME 1 36 MET ME . . 3.240 2.171 1.793 3.300 0.060 13 0 "[ . 1 . 2]" 1
563 1 20 MET HG2 1 21 ILE H . . 5.050 4.757 3.432 5.753 0.703 12 1 "[ . 1 + . 2]" 1
564 1 20 MET HG2 1 36 MET ME . . 3.910 3.691 3.084 4.607 0.697 12 2 "[ . 1 + -. 2]" 1
565 1 20 MET HG3 1 22 HIS HE1 . . 5.500 5.047 4.249 5.582 0.082 18 0 "[ . 1 . 2]" 1
566 1 20 MET HG3 1 36 MET ME . . 5.500 4.666 3.222 5.333 . 0 0 "[ . 1 . 2]" 1
567 1 21 ILE H 1 21 ILE HB . . 3.480 2.630 2.389 2.911 . 0 0 "[ . 1 . 2]" 1
568 1 21 ILE H 1 21 ILE MD . . 5.130 3.899 3.483 4.341 . 0 0 "[ . 1 . 2]" 1
569 1 21 ILE H 1 21 ILE HG12 . . 4.390 3.885 3.325 4.221 . 0 0 "[ . 1 . 2]" 1
570 1 21 ILE H 1 21 ILE HG13 . . 4.130 2.768 2.033 3.275 . 0 0 "[ . 1 . 2]" 1
571 1 21 ILE H 1 21 ILE MG . . 4.670 3.848 3.761 3.948 . 0 0 "[ . 1 . 2]" 1
572 1 21 ILE H 1 22 HIS H . . 4.940 4.385 4.190 4.591 . 0 0 "[ . 1 . 2]" 1
573 1 21 ILE H 1 32 TYR QD . . 4.710 3.824 3.290 4.384 . 0 0 "[ . 1 . 2]" 1
574 1 21 ILE H 1 32 TYR QE . . 3.140 2.301 2.040 2.606 . 0 0 "[ . 1 . 2]" 1
575 1 21 ILE H 1 91 VAL QG . . 5.500 4.942 4.333 5.477 . 0 0 "[ . 1 . 2]" 1
576 1 21 ILE HA 1 21 ILE MD . . 4.020 3.911 3.776 3.997 . 0 0 "[ . 1 . 2]" 1
577 1 21 ILE HA 1 21 ILE HG13 . . 4.010 3.158 2.893 3.306 . 0 0 "[ . 1 . 2]" 1
578 1 21 ILE HA 1 21 ILE MG . . 3.620 2.367 2.213 2.661 . 0 0 "[ . 1 . 2]" 1
579 1 21 ILE HA 1 22 HIS H . . 2.860 2.261 2.143 2.349 . 0 0 "[ . 1 . 2]" 1
580 1 21 ILE HA 1 22 HIS HA . . 5.490 4.404 4.332 4.469 . 0 0 "[ . 1 . 2]" 1
581 1 21 ILE HA 1 22 HIS HB2 . . 5.080 4.480 4.196 4.976 . 0 0 "[ . 1 . 2]" 1
582 1 21 ILE HA 1 22 HIS HB3 . . 5.500 5.540 5.391 5.580 0.080 5 0 "[ . 1 . 2]" 1
583 1 21 ILE HA 1 22 HIS HD2 . . 4.510 3.542 2.652 4.111 . 0 0 "[ . 1 . 2]" 1
584 1 21 ILE HA 1 94 GLN HE21 . . 5.500 4.416 3.140 5.564 0.064 12 0 "[ . 1 . 2]" 1
585 1 21 ILE HA 1 94 GLN HE22 . . 5.500 3.973 3.102 4.720 . 0 0 "[ . 1 . 2]" 1
586 1 21 ILE HB 1 22 HIS H . . 4.290 3.874 3.718 4.220 . 0 0 "[ . 1 . 2]" 1
587 1 21 ILE HB 1 23 PHE QD . . 4.900 4.327 4.130 4.544 . 0 0 "[ . 1 . 2]" 1
588 1 21 ILE HB 1 23 PHE QE . . 3.540 2.759 2.490 3.001 . 0 0 "[ . 1 . 2]" 1
589 1 21 ILE HB 1 23 PHE HZ . . 4.110 3.733 3.411 3.946 . 0 0 "[ . 1 . 2]" 1
590 1 21 ILE HB 1 32 TYR QD . . 4.550 4.244 3.804 4.436 . 0 0 "[ . 1 . 2]" 1
591 1 21 ILE HB 1 32 TYR QE . . 4.140 3.403 3.146 3.595 . 0 0 "[ . 1 . 2]" 1
592 1 21 ILE HB 1 90 ARG HB3 . . 4.260 3.335 3.117 3.555 . 0 0 "[ . 1 . 2]" 1
593 1 21 ILE MD 1 21 ILE MG . . 3.550 2.052 1.988 2.158 . 0 0 "[ . 1 . 2]" 1
594 1 21 ILE MD 1 22 HIS H . . 5.500 4.912 4.750 5.274 . 0 0 "[ . 1 . 2]" 1
595 1 21 ILE MD 1 23 PHE QE . . 3.920 4.009 3.925 4.042 0.122 8 0 "[ . 1 . 2]" 1
596 1 21 ILE MD 1 23 PHE HZ . . 3.790 3.810 3.499 3.893 0.103 18 0 "[ . 1 . 2]" 1
597 1 21 ILE MD 1 32 TYR QD . . 4.630 4.366 4.113 4.633 0.003 17 0 "[ . 1 . 2]" 1
598 1 21 ILE MD 1 32 TYR QE . . 3.950 2.771 2.584 3.010 . 0 0 "[ . 1 . 2]" 1
599 1 21 ILE MD 1 90 ARG H . . 5.500 4.386 4.178 4.467 . 0 0 "[ . 1 . 2]" 1
600 1 21 ILE MD 1 90 ARG HA . . 5.320 3.200 3.023 3.325 . 0 0 "[ . 1 . 2]" 1
601 1 21 ILE MD 1 90 ARG HB2 . . 4.930 2.875 2.723 3.032 . 0 0 "[ . 1 . 2]" 1
602 1 21 ILE MD 1 90 ARG HB3 . . 4.100 2.020 1.916 2.153 . 0 0 "[ . 1 . 2]" 1
603 1 21 ILE MD 1 90 ARG QD . . 5.470 3.143 2.604 3.481 . 0 0 "[ . 1 . 2]" 1
604 1 21 ILE MD 1 90 ARG HE . . 5.500 4.996 4.368 5.606 0.106 1 0 "[ . 1 . 2]" 1
605 1 21 ILE MD 1 90 ARG HG2 . . 5.210 4.485 4.343 4.650 . 0 0 "[ . 1 . 2]" 1
606 1 21 ILE MD 1 90 ARG HG3 . . 5.220 4.097 3.899 4.346 . 0 0 "[ . 1 . 2]" 1
607 1 21 ILE MD 1 91 VAL H . . 4.500 3.027 2.956 3.125 . 0 0 "[ . 1 . 2]" 1
608 1 21 ILE MD 1 91 VAL HA . . 3.670 2.073 1.955 2.215 . 0 0 "[ . 1 . 2]" 1
609 1 21 ILE MD 1 91 VAL HB . . 4.410 3.781 3.538 4.259 . 0 0 "[ . 1 . 2]" 1
610 1 21 ILE MD 1 91 VAL QG . . 4.040 2.932 2.590 3.226 . 0 0 "[ . 1 . 2]" 1
611 1 21 ILE MD 1 94 GLN H . . 5.500 2.972 2.773 3.058 . 0 0 "[ . 1 . 2]" 1
612 1 21 ILE MD 1 94 GLN HB2 . . 4.130 2.184 2.006 2.443 . 0 0 "[ . 1 . 2]" 1
613 1 21 ILE MD 1 94 GLN HE21 . . 5.500 3.491 2.412 4.328 . 0 0 "[ . 1 . 2]" 1
614 1 21 ILE MD 1 94 GLN HE22 . . 4.490 3.963 3.423 4.328 . 0 0 "[ . 1 . 2]" 1
615 1 21 ILE MD 1 94 GLN HG2 . . 4.760 3.559 2.874 4.208 . 0 0 "[ . 1 . 2]" 1
616 1 21 ILE MD 1 94 GLN HG3 . . 4.460 4.276 4.008 4.508 0.048 5 0 "[ . 1 . 2]" 1
617 1 21 ILE MD 1 95 MET H . . 5.500 4.325 3.985 4.648 . 0 0 "[ . 1 . 2]" 1
618 1 21 ILE MD 1 95 MET ME . . 5.500 5.248 4.934 5.620 0.120 17 0 "[ . 1 . 2]" 1
619 1 21 ILE HG12 1 32 TYR QE . . 5.420 4.986 4.791 5.128 . 0 0 "[ . 1 . 2]" 1
620 1 21 ILE HG12 1 91 VAL HA . . 5.230 4.682 4.545 4.857 . 0 0 "[ . 1 . 2]" 1
621 1 21 ILE HG12 1 94 GLN HA . . 5.500 5.296 5.106 5.487 . 0 0 "[ . 1 . 2]" 1
622 1 21 ILE HG12 1 94 GLN HB2 . . 5.500 3.001 2.709 3.253 . 0 0 "[ . 1 . 2]" 1
623 1 21 ILE HG12 1 94 GLN HE21 . . 5.500 2.858 1.750 3.973 . 0 0 "[ . 1 . 2]" 1
624 1 21 ILE HG12 1 94 GLN HE22 . . 5.490 3.062 2.407 3.788 . 0 0 "[ . 1 . 2]" 1
625 1 21 ILE HG12 1 94 GLN HG2 . . 5.500 3.355 2.405 4.196 . 0 0 "[ . 1 . 2]" 1
626 1 21 ILE HG13 1 22 HIS H . . 5.500 5.078 4.821 5.233 . 0 0 "[ . 1 . 2]" 1
627 1 21 ILE HG13 1 23 PHE QE . . 5.500 5.020 4.820 5.193 . 0 0 "[ . 1 . 2]" 1
628 1 21 ILE HG13 1 32 TYR QD . . 5.500 5.431 5.163 5.597 0.097 17 0 "[ . 1 . 2]" 1
629 1 21 ILE HG13 1 32 TYR QE . . 4.300 3.722 3.500 3.875 . 0 0 "[ . 1 . 2]" 1
630 1 21 ILE HG13 1 91 VAL H . . 5.500 5.574 5.557 5.581 0.081 13 0 "[ . 1 . 2]" 1
631 1 21 ILE HG13 1 91 VAL HA . . 5.500 3.911 3.709 4.029 . 0 0 "[ . 1 . 2]" 1
632 1 21 ILE HG13 1 91 VAL QG . . 5.150 3.921 3.638 4.289 . 0 0 "[ . 1 . 2]" 1
633 1 21 ILE HG13 1 94 GLN H . . 5.450 5.504 5.319 5.540 0.090 4 0 "[ . 1 . 2]" 1
634 1 21 ILE HG13 1 94 GLN HE22 . . 5.500 4.738 4.050 5.514 0.014 14 0 "[ . 1 . 2]" 1
635 1 21 ILE HG13 1 94 GLN HG3 . . 5.500 5.369 4.820 5.580 0.080 7 0 "[ . 1 . 2]" 1
636 1 21 ILE MG 1 22 HIS H . . 3.680 2.264 2.115 2.592 . 0 0 "[ . 1 . 2]" 1
637 1 21 ILE MG 1 22 HIS HA . . 5.500 3.948 3.722 4.258 . 0 0 "[ . 1 . 2]" 1
638 1 21 ILE MG 1 22 HIS HB2 . . 5.500 4.281 3.942 4.657 . 0 0 "[ . 1 . 2]" 1
639 1 21 ILE MG 1 22 HIS HB3 . . 5.500 5.134 4.881 5.522 0.022 20 0 "[ . 1 . 2]" 1
640 1 21 ILE MG 1 23 PHE H . . 5.500 4.685 4.407 5.016 . 0 0 "[ . 1 . 2]" 1
641 1 21 ILE MG 1 23 PHE HA . . 4.990 4.265 4.004 4.546 . 0 0 "[ . 1 . 2]" 1
642 1 21 ILE MG 1 23 PHE QE . . 3.430 3.370 2.811 3.542 0.112 8 0 "[ . 1 . 2]" 1
643 1 21 ILE MG 1 32 TYR QE . . 4.660 4.384 3.909 4.610 . 0 0 "[ . 1 . 2]" 1
644 1 21 ILE MG 1 90 ARG HA . . 5.500 3.933 3.759 4.117 . 0 0 "[ . 1 . 2]" 1
645 1 21 ILE MG 1 90 ARG HB2 . . 5.180 3.540 3.144 3.757 . 0 0 "[ . 1 . 2]" 1
646 1 21 ILE MG 1 90 ARG HB3 . . 4.610 2.134 1.990 2.301 . 0 0 "[ . 1 . 2]" 1
647 1 21 ILE MG 1 90 ARG QD . . 5.150 2.252 1.941 2.623 . 0 0 "[ . 1 . 2]" 1
648 1 21 ILE MG 1 90 ARG HE . . 4.670 4.155 2.513 4.775 0.105 11 0 "[ . 1 . 2]" 1
649 1 21 ILE MG 1 90 ARG HG2 . . 4.970 4.238 3.905 4.523 . 0 0 "[ . 1 . 2]" 1
650 1 21 ILE MG 1 90 ARG HG3 . . 4.490 3.316 2.620 3.811 . 0 0 "[ . 1 . 2]" 1
651 1 21 ILE MG 1 91 VAL HA . . 5.350 4.886 4.772 4.976 . 0 0 "[ . 1 . 2]" 1
652 1 21 ILE MG 1 91 VAL QG . . 5.110 4.977 4.819 5.037 . 0 0 "[ . 1 . 2]" 1
653 1 21 ILE MG 1 94 GLN HE21 . . 5.500 3.442 2.680 4.301 . 0 0 "[ . 1 . 2]" 1
654 1 21 ILE MG 1 94 GLN HE22 . . 4.460 3.143 2.626 3.895 . 0 0 "[ . 1 . 2]" 1
655 1 21 ILE MG 1 94 GLN HG2 . . 5.500 4.996 4.263 5.607 0.107 5 0 "[ . 1 . 2]" 1
656 1 21 ILE MG 1 94 GLN HG3 . . 5.500 5.461 5.201 5.594 0.094 4 0 "[ . 1 . 2]" 1
657 1 22 HIS H 1 22 HIS HB2 . . 3.570 2.563 2.435 2.850 . 0 0 "[ . 1 . 2]" 1
658 1 22 HIS H 1 22 HIS HB3 . . 3.820 3.696 3.612 3.769 . 0 0 "[ . 1 . 2]" 1
659 1 22 HIS H 1 22 HIS HD2 . . 3.980 3.028 2.303 3.839 . 0 0 "[ . 1 . 2]" 1
660 1 22 HIS H 1 23 PHE H . . 5.060 4.415 4.184 4.553 . 0 0 "[ . 1 . 2]" 1
661 1 22 HIS H 1 23 PHE QD . . 5.300 4.474 4.196 4.782 . 0 0 "[ . 1 . 2]" 1
662 1 22 HIS H 1 94 GLN HE22 . . 5.500 4.958 4.454 5.568 0.068 4 0 "[ . 1 . 2]" 1
663 1 22 HIS HA 1 22 HIS HD2 . . 4.270 4.305 3.977 4.358 0.088 3 0 "[ . 1 . 2]" 1
664 1 22 HIS HA 1 23 PHE H . . 3.070 2.280 2.128 2.479 . 0 0 "[ . 1 . 2]" 1
665 1 22 HIS HA 1 23 PHE HA . . 4.650 4.493 4.390 4.593 . 0 0 "[ . 1 . 2]" 1
666 1 22 HIS HA 1 23 PHE QD . . 3.790 2.726 2.324 3.228 . 0 0 "[ . 1 . 2]" 1
667 1 22 HIS HA 1 24 GLY H . . 4.550 3.863 3.522 4.154 . 0 0 "[ . 1 . 2]" 1
668 1 22 HIS HB2 1 22 HIS HD2 . . 3.520 2.638 2.504 2.920 . 0 0 "[ . 1 . 2]" 1
669 1 22 HIS HB2 1 23 PHE H . . 4.680 3.965 3.479 4.572 . 0 0 "[ . 1 . 2]" 1
670 1 22 HIS HB2 1 23 PHE HA . . 5.500 5.118 4.755 5.424 . 0 0 "[ . 1 . 2]" 1
671 1 22 HIS HB2 1 24 GLY H . . 5.320 4.288 3.477 4.893 . 0 0 "[ . 1 . 2]" 1
672 1 22 HIS HB3 1 22 HIS HE1 . . 5.150 4.931 4.844 5.068 . 0 0 "[ . 1 . 2]" 1
673 1 22 HIS HB3 1 23 PHE H . . 4.740 3.020 2.347 3.901 . 0 0 "[ . 1 . 2]" 1
674 1 22 HIS HB3 1 24 GLY H . . 3.910 3.219 2.818 3.650 . 0 0 "[ . 1 . 2]" 1
675 1 23 PHE H 1 23 PHE HB2 . . 3.640 2.511 2.256 2.772 . 0 0 "[ . 1 . 2]" 1
676 1 23 PHE H 1 23 PHE HB3 . . 3.910 3.660 3.494 3.823 . 0 0 "[ . 1 . 2]" 1
677 1 23 PHE H 1 23 PHE QD . . 3.240 2.512 1.883 2.908 . 0 0 "[ . 1 . 2]" 1
678 1 23 PHE H 1 24 GLY H . . 3.510 2.087 1.740 2.652 . 0 0 "[ . 1 . 2]" 1
679 1 23 PHE H 1 24 GLY HA2 . . 5.500 4.407 3.995 4.981 . 0 0 "[ . 1 . 2]" 1
680 1 23 PHE H 1 24 GLY HA3 . . 5.500 4.839 4.515 5.326 . 0 0 "[ . 1 . 2]" 1
681 1 23 PHE H 1 25 ASN H . . 4.700 4.599 4.253 4.780 0.080 4 0 "[ . 1 . 2]" 1
682 1 23 PHE H 1 28 GLU HB2 . . 5.500 4.899 4.552 5.590 0.090 20 0 "[ . 1 . 2]" 1
683 1 23 PHE H 1 28 GLU HB3 . . 5.500 5.142 4.879 5.530 0.030 16 0 "[ . 1 . 2]" 1
684 1 23 PHE H 1 29 ASP H . . 5.320 4.412 4.129 4.958 . 0 0 "[ . 1 . 2]" 1
685 1 23 PHE H 1 29 ASP HA . . 4.780 3.889 2.973 4.473 . 0 0 "[ . 1 . 2]" 1
686 1 23 PHE HA 1 23 PHE QD . . 3.360 3.200 3.081 3.298 . 0 0 "[ . 1 . 2]" 1
687 1 23 PHE HA 1 23 PHE QE . . 5.140 4.811 4.518 5.028 . 0 0 "[ . 1 . 2]" 1
688 1 23 PHE HA 1 24 GLY HA3 . . 4.570 4.550 4.459 4.643 0.073 18 0 "[ . 1 . 2]" 1
689 1 23 PHE HA 1 25 ASN H . . 4.780 4.454 4.263 4.648 . 0 0 "[ . 1 . 2]" 1
690 1 23 PHE HA 1 25 ASN QD . . 5.500 4.388 4.167 4.634 . 0 0 "[ . 1 . 2]" 1
691 1 23 PHE HA 1 90 ARG QD . . 5.500 4.850 4.146 5.333 . 0 0 "[ . 1 . 2]" 1
692 1 23 PHE HA 1 90 ARG HG3 . . 5.500 5.237 4.810 5.561 0.061 11 0 "[ . 1 . 2]" 1
693 1 23 PHE HB2 1 24 GLY H . . 4.290 3.473 3.261 3.648 . 0 0 "[ . 1 . 2]" 1
694 1 23 PHE HB2 1 28 GLU HB2 . . 4.190 2.548 2.206 3.390 . 0 0 "[ . 1 . 2]" 1
695 1 23 PHE HB2 1 28 GLU HB3 . . 4.280 2.712 2.510 3.023 . 0 0 "[ . 1 . 2]" 1
696 1 23 PHE HB2 1 29 ASP H . . 4.800 3.006 2.640 3.550 . 0 0 "[ . 1 . 2]" 1
697 1 23 PHE HB2 1 86 LYS QD . . 5.500 5.333 4.997 5.589 0.089 9 0 "[ . 1 . 2]" 1
698 1 23 PHE HB3 1 24 GLY H . . 4.480 4.191 4.043 4.304 . 0 0 "[ . 1 . 2]" 1
699 1 23 PHE HB3 1 25 ASN H . . 4.150 3.538 3.268 3.731 . 0 0 "[ . 1 . 2]" 1
700 1 23 PHE HB3 1 25 ASN QB . . 5.110 4.315 3.957 4.654 . 0 0 "[ . 1 . 2]" 1
701 1 23 PHE HB3 1 25 ASN QD . . 5.500 2.759 2.093 3.005 . 0 0 "[ . 1 . 2]" 1
702 1 23 PHE HB3 1 28 GLU H . . 5.500 5.115 4.757 5.567 0.067 16 0 "[ . 1 . 2]" 1
703 1 23 PHE HB3 1 28 GLU HB2 . . 4.370 2.903 2.509 3.387 . 0 0 "[ . 1 . 2]" 1
704 1 23 PHE HB3 1 28 GLU HB3 . . 4.190 2.715 2.427 3.139 . 0 0 "[ . 1 . 2]" 1
705 1 23 PHE HB3 1 28 GLU HG2 . . 5.500 4.725 4.497 5.104 . 0 0 "[ . 1 . 2]" 1
706 1 23 PHE HB3 1 29 ASP H . . 5.500 4.428 3.826 4.915 . 0 0 "[ . 1 . 2]" 1
707 1 23 PHE HB3 1 90 ARG HG3 . . 5.500 5.569 5.414 5.588 0.088 14 0 "[ . 1 . 2]" 1
708 1 23 PHE QD 1 24 GLY H . . 4.340 4.424 4.393 4.442 0.102 6 0 "[ . 1 . 2]" 1
709 1 23 PHE QD 1 25 ASN QD . . 4.440 4.135 3.436 4.316 . 0 0 "[ . 1 . 2]" 1
710 1 23 PHE QD 1 28 GLU HB2 . . 5.130 3.984 3.752 4.372 . 0 0 "[ . 1 . 2]" 1
711 1 23 PHE QD 1 28 GLU HB3 . . 4.290 3.027 2.668 3.447 . 0 0 "[ . 1 . 2]" 1
712 1 23 PHE QD 1 29 ASP H . . 4.470 4.165 3.834 4.554 0.084 16 0 "[ . 1 . 2]" 1
713 1 23 PHE QD 1 29 ASP HA . . 3.150 2.612 2.331 3.233 0.083 16 0 "[ . 1 . 2]" 1
714 1 23 PHE QD 1 32 TYR HB2 . . 4.200 4.052 3.669 4.282 0.082 11 0 "[ . 1 . 2]" 1
715 1 23 PHE QD 1 32 TYR HB3 . . 4.980 3.856 3.561 4.152 . 0 0 "[ . 1 . 2]" 1
716 1 23 PHE QD 1 86 LYS QD . . 5.500 2.772 2.339 3.210 . 0 0 "[ . 1 . 2]" 1
717 1 23 PHE QD 1 86 LYS QE . . 5.500 4.747 4.388 5.024 . 0 0 "[ . 1 . 2]" 1
718 1 23 PHE QD 1 87 MET ME . . 4.100 3.279 2.867 3.696 . 0 0 "[ . 1 . 2]" 1
719 1 23 PHE QE 1 32 TYR H . . 4.900 4.943 4.752 5.003 0.103 16 0 "[ . 1 . 2]" 1
720 1 23 PHE QE 1 32 TYR HA . . 4.710 4.800 4.781 4.814 0.104 4 0 "[ . 1 . 2]" 1
721 1 23 PHE QE 1 32 TYR HB2 . . 3.670 2.933 2.851 3.027 . 0 0 "[ . 1 . 2]" 1
722 1 23 PHE QE 1 32 TYR HB3 . . 3.530 3.133 2.862 3.335 . 0 0 "[ . 1 . 2]" 1
723 1 23 PHE QE 1 32 TYR QD . . 3.480 2.954 2.888 3.049 . 0 0 "[ . 1 . 2]" 1
724 1 23 PHE QE 1 33 ARG H . . 5.280 5.193 4.969 5.342 0.062 16 0 "[ . 1 . 2]" 1
725 1 23 PHE QE 1 87 MET H . . 5.500 4.372 4.170 4.686 . 0 0 "[ . 1 . 2]" 1
726 1 23 PHE QE 1 87 MET HA . . 3.890 2.632 2.422 2.898 . 0 0 "[ . 1 . 2]" 1
727 1 23 PHE QE 1 87 MET HB3 . . 4.420 4.438 4.220 4.512 0.092 10 0 "[ . 1 . 2]" 1
728 1 23 PHE QE 1 87 MET ME . . 3.970 3.319 2.344 3.622 . 0 0 "[ . 1 . 2]" 1
729 1 23 PHE QE 1 90 ARG HB2 . . 4.470 3.374 2.931 3.599 . 0 0 "[ . 1 . 2]" 1
730 1 23 PHE QE 1 90 ARG HB3 . . 4.230 3.966 3.647 4.104 . 0 0 "[ . 1 . 2]" 1
731 1 23 PHE QE 1 90 ARG QD . . 5.160 4.039 3.835 4.265 . 0 0 "[ . 1 . 2]" 1
732 1 23 PHE QE 1 90 ARG HG2 . . 4.240 3.370 2.946 3.656 . 0 0 "[ . 1 . 2]" 1
733 1 23 PHE QE 1 90 ARG HG3 . . 5.220 2.317 2.107 2.492 . 0 0 "[ . 1 . 2]" 1
734 1 23 PHE HZ 1 32 TYR HB2 . . 4.520 3.282 2.926 3.536 . 0 0 "[ . 1 . 2]" 1
735 1 23 PHE HZ 1 32 TYR HB3 . . 5.180 4.501 4.085 4.819 . 0 0 "[ . 1 . 2]" 1
736 1 23 PHE HZ 1 32 TYR QD . . 4.210 2.496 2.313 2.706 . 0 0 "[ . 1 . 2]" 1
737 1 23 PHE HZ 1 87 MET HA . . 3.890 2.330 2.218 2.605 . 0 0 "[ . 1 . 2]" 1
738 1 23 PHE HZ 1 87 MET HB3 . . 3.900 3.700 3.434 3.854 . 0 0 "[ . 1 . 2]" 1
739 1 23 PHE HZ 1 87 MET ME . . 4.210 4.211 3.378 4.322 0.112 9 0 "[ . 1 . 2]" 1
740 1 23 PHE HZ 1 87 MET HG2 . . 4.970 5.034 5.017 5.045 0.075 11 0 "[ . 1 . 2]" 1
741 1 23 PHE HZ 1 90 ARG HB2 . . 4.520 2.574 2.350 2.878 . 0 0 "[ . 1 . 2]" 1
742 1 23 PHE HZ 1 90 ARG HB3 . . 4.070 3.423 3.231 3.680 . 0 0 "[ . 1 . 2]" 1
743 1 23 PHE HZ 1 90 ARG QD . . 5.160 4.466 4.079 4.659 . 0 0 "[ . 1 . 2]" 1
744 1 23 PHE HZ 1 90 ARG HG2 . . 5.220 4.208 3.734 4.872 . 0 0 "[ . 1 . 2]" 1
745 1 23 PHE HZ 1 90 ARG HG3 . . 5.500 2.986 2.440 3.646 . 0 0 "[ . 1 . 2]" 1
746 1 23 PHE HZ 1 91 VAL H . . 5.080 4.202 3.912 4.437 . 0 0 "[ . 1 . 2]" 1
747 1 23 PHE HZ 1 91 VAL QG . . 5.400 4.757 4.509 5.074 . 0 0 "[ . 1 . 2]" 1
748 1 24 GLY H 1 25 ASN H . . 3.650 3.551 3.215 3.708 0.058 6 0 "[ . 1 . 2]" 1
749 1 24 GLY HA2 1 25 ASN HA . . 5.500 4.725 4.612 4.966 . 0 0 "[ . 1 . 2]" 1
750 1 24 GLY HA3 1 25 ASN HA . . 5.500 4.362 4.193 4.669 . 0 0 "[ . 1 . 2]" 1
751 1 24 GLY HA3 1 25 ASN QB . . 5.500 5.090 4.922 5.248 . 0 0 "[ . 1 . 2]" 1
752 1 24 GLY HA3 1 25 ASN QD . . 5.500 4.169 3.729 4.832 . 0 0 "[ . 1 . 2]" 1
753 1 25 ASN H 1 25 ASN QB . . 3.470 2.794 2.560 2.911 . 0 0 "[ . 1 . 2]" 1
754 1 25 ASN H 1 25 ASN QD . . 3.630 2.074 1.786 2.879 . 0 0 "[ . 1 . 2]" 1
755 1 25 ASN H 1 26 ASP H . . 4.590 4.504 4.219 4.622 0.032 5 0 "[ . 1 . 2]" 1
756 1 25 ASN H 1 26 ASP HA . . 5.500 5.500 5.354 5.579 0.079 2 0 "[ . 1 . 2]" 1
757 1 25 ASN H 1 27 TRP HE1 . . 5.310 5.391 5.379 5.399 0.089 7 0 "[ . 1 . 2]" 1
758 1 25 ASN H 1 28 GLU H . . 4.960 4.714 4.506 5.050 0.090 20 0 "[ . 1 . 2]" 1
759 1 25 ASN H 1 28 GLU HB2 . . 5.310 3.562 3.352 4.227 . 0 0 "[ . 1 . 2]" 1
760 1 25 ASN H 1 28 GLU HB3 . . 4.830 4.884 4.718 4.912 0.082 20 0 "[ . 1 . 2]" 1
761 1 25 ASN H 1 29 ASP H . . 4.860 4.670 4.300 4.927 0.067 14 0 "[ . 1 . 2]" 1
762 1 25 ASN HA 1 26 ASP H . . 2.820 2.174 2.070 2.552 . 0 0 "[ . 1 . 2]" 1
763 1 25 ASN HA 1 26 ASP HA . . 5.160 4.397 4.260 4.554 . 0 0 "[ . 1 . 2]" 1
764 1 25 ASN HA 1 26 ASP QB . . 4.480 4.168 3.606 4.542 0.062 9 0 "[ . 1 . 2]" 1
765 1 25 ASN HA 1 27 TRP H . . 4.390 3.877 3.682 4.270 . 0 0 "[ . 1 . 2]" 1
766 1 25 ASN HA 1 28 GLU H . . 5.500 4.628 4.481 5.208 . 0 0 "[ . 1 . 2]" 1
767 1 25 ASN QB 1 26 ASP H . . 3.690 2.873 2.019 3.161 . 0 0 "[ . 1 . 2]" 1
768 1 25 ASN QB 1 27 TRP H . . 3.410 2.549 2.243 2.747 . 0 0 "[ . 1 . 2]" 1
769 1 25 ASN QB 1 27 TRP HE1 . . 5.500 2.248 2.054 2.473 . 0 0 "[ . 1 . 2]" 1
770 1 25 ASN QB 1 28 GLU H . . 4.120 2.170 1.962 2.593 . 0 0 "[ . 1 . 2]" 1
771 1 25 ASN QB 1 28 GLU HB2 . . 3.910 2.299 2.050 2.861 . 0 0 "[ . 1 . 2]" 1
772 1 25 ASN QB 1 28 GLU HB3 . . 4.130 3.881 3.646 4.247 0.117 20 0 "[ . 1 . 2]" 1
773 1 25 ASN QB 1 28 GLU HG2 . . 5.500 3.989 3.801 5.098 . 0 0 "[ . 1 . 2]" 1
774 1 25 ASN QB 1 28 GLU HG3 . . 4.920 2.488 2.285 3.723 . 0 0 "[ . 1 . 2]" 1
775 1 25 ASN QB 1 29 ASP H . . 5.500 3.577 3.255 3.877 . 0 0 "[ . 1 . 2]" 1
776 1 25 ASN HB3 1 27 TRP HD1 . . 3.780 2.734 2.471 3.802 0.022 20 0 "[ . 1 . 2]" 1
777 1 25 ASN QD 1 26 ASP H . . 5.500 5.253 4.727 5.314 . 0 0 "[ . 1 . 2]" 1
778 1 25 ASN QD 1 27 TRP H . . 5.500 5.104 4.661 5.268 . 0 0 "[ . 1 . 2]" 1
779 1 25 ASN QD 1 27 TRP HE1 . . 4.900 4.045 3.563 4.308 . 0 0 "[ . 1 . 2]" 1
780 1 25 ASN QD 1 27 TRP HZ2 . . 3.950 3.799 3.687 3.869 . 0 0 "[ . 1 . 2]" 1
781 1 25 ASN QD 1 28 GLU H . . 5.500 4.002 3.684 4.207 . 0 0 "[ . 1 . 2]" 1
782 1 25 ASN QD 1 28 GLU HB2 . . 5.300 2.616 2.251 2.808 . 0 0 "[ . 1 . 2]" 1
783 1 25 ASN QD 1 28 GLU HB3 . . 5.170 3.538 2.511 3.805 . 0 0 "[ . 1 . 2]" 1
784 1 25 ASN QD 1 28 GLU HG2 . . 5.500 4.048 3.914 4.227 . 0 0 "[ . 1 . 2]" 1
785 1 25 ASN QD 1 28 GLU HG3 . . 5.320 3.061 2.847 3.287 . 0 0 "[ . 1 . 2]" 1
786 1 26 ASP H 1 26 ASP QB . . 2.940 2.313 2.150 2.528 . 0 0 "[ . 1 . 2]" 1
787 1 26 ASP H 1 27 TRP H . . 3.580 2.730 1.997 2.977 . 0 0 "[ . 1 . 2]" 1
788 1 26 ASP H 1 27 TRP HA . . 5.500 5.261 4.579 5.481 . 0 0 "[ . 1 . 2]" 1
789 1 26 ASP H 1 27 TRP QB . . 5.410 4.861 3.938 5.096 . 0 0 "[ . 1 . 2]" 1
790 1 26 ASP H 1 27 TRP HD1 . . 5.500 3.710 2.566 4.078 . 0 0 "[ . 1 . 2]" 1
791 1 26 ASP H 1 28 GLU H . . 5.250 4.303 3.553 4.566 . 0 0 "[ . 1 . 2]" 1
792 1 26 ASP H 1 29 ASP H . . 5.500 4.824 4.217 5.228 . 0 0 "[ . 1 . 2]" 1
793 1 26 ASP HA 1 28 GLU H . . 5.500 4.454 4.185 4.821 . 0 0 "[ . 1 . 2]" 1
794 1 26 ASP HA 1 29 ASP H . . 4.040 3.567 3.092 4.102 0.062 20 0 "[ . 1 . 2]" 1
795 1 26 ASP HA 1 29 ASP HB2 . . 3.910 3.262 2.277 3.963 0.053 2 0 "[ . 1 . 2]" 1
796 1 26 ASP HA 1 29 ASP HB3 . . 4.050 2.710 2.328 3.246 . 0 0 "[ . 1 . 2]" 1
797 1 26 ASP HA 1 30 ARG H . . 4.430 3.748 3.365 4.122 . 0 0 "[ . 1 . 2]" 1
798 1 26 ASP QB 1 27 TRP H . . 3.320 3.075 2.813 3.407 0.087 20 0 "[ . 1 . 2]" 1
799 1 26 ASP QB 1 27 TRP HA . . 4.540 4.024 3.621 4.408 . 0 0 "[ . 1 . 2]" 1
800 1 26 ASP QB 1 27 TRP QB . . 5.500 4.042 3.662 4.362 . 0 0 "[ . 1 . 2]" 1
801 1 26 ASP QB 1 28 GLU H . . 5.310 4.899 4.657 5.186 . 0 0 "[ . 1 . 2]" 1
802 1 27 TRP H 1 27 TRP QB . . 2.980 2.712 2.589 2.997 0.017 20 0 "[ . 1 . 2]" 1
803 1 27 TRP H 1 27 TRP HD1 . . 3.700 2.428 2.275 2.776 . 0 0 "[ . 1 . 2]" 1
804 1 27 TRP H 1 28 GLU H . . 3.300 2.290 1.924 2.460 . 0 0 "[ . 1 . 2]" 1
805 1 27 TRP H 1 28 GLU HB2 . . 5.500 4.213 3.435 4.512 . 0 0 "[ . 1 . 2]" 1
806 1 27 TRP H 1 28 GLU HG2 . . 5.500 5.585 5.580 5.591 0.091 2 0 "[ . 1 . 2]" 1
807 1 27 TRP H 1 29 ASP H . . 5.090 3.856 3.062 4.139 . 0 0 "[ . 1 . 2]" 1
808 1 27 TRP HA 1 27 TRP HD1 . . 4.330 4.394 4.378 4.403 0.073 10 0 "[ . 1 . 2]" 1
809 1 27 TRP HA 1 27 TRP HE3 . . 4.420 4.327 4.214 4.457 0.037 8 0 "[ . 1 . 2]" 1
810 1 27 TRP HA 1 29 ASP H . . 5.220 4.644 4.531 4.950 . 0 0 "[ . 1 . 2]" 1
811 1 27 TRP HA 1 30 ARG H . . 4.320 3.555 3.323 3.955 . 0 0 "[ . 1 . 2]" 1
812 1 27 TRP HA 1 30 ARG QB . . 3.680 2.772 2.158 3.758 0.078 9 0 "[ . 1 . 2]" 1
813 1 27 TRP HA 1 30 ARG HE . . 5.500 5.223 4.159 5.580 0.080 5 0 "[ . 1 . 2]" 1
814 1 27 TRP HA 1 30 ARG QG . . 5.180 4.141 2.789 4.963 . 0 0 "[ . 1 . 2]" 1
815 1 27 TRP HA 1 31 TYR H . . 4.840 3.796 3.600 4.326 . 0 0 "[ . 1 . 2]" 1
816 1 27 TRP HA 1 31 TYR HB3 . . 5.500 5.208 4.993 5.541 0.041 11 0 "[ . 1 . 2]" 1
817 1 27 TRP QB 1 27 TRP HD1 . . 2.980 2.597 2.532 2.670 . 0 0 "[ . 1 . 2]" 1
818 1 27 TRP QB 1 27 TRP HE3 . . 3.090 2.656 2.546 2.739 . 0 0 "[ . 1 . 2]" 1
819 1 27 TRP QB 1 28 GLU H . . 4.140 3.560 3.449 3.662 . 0 0 "[ . 1 . 2]" 1
820 1 27 TRP HE1 1 28 GLU HG3 . . 5.500 3.840 3.735 3.991 . 0 0 "[ . 1 . 2]" 1
821 1 27 TRP HE3 1 28 GLU H . . 3.920 3.703 3.552 3.779 . 0 0 "[ . 1 . 2]" 1
822 1 27 TRP HE3 1 28 GLU HA . . 4.050 3.118 2.893 3.326 . 0 0 "[ . 1 . 2]" 1
823 1 27 TRP HE3 1 28 GLU HB2 . . 5.070 5.025 4.577 5.115 0.045 16 0 "[ . 1 . 2]" 1
824 1 27 TRP HE3 1 28 GLU HB3 . . 5.390 5.224 5.090 5.393 0.003 20 0 "[ . 1 . 2]" 1
825 1 27 TRP HE3 1 28 GLU HG2 . . 3.510 3.340 3.214 3.581 0.071 20 0 "[ . 1 . 2]" 1
826 1 27 TRP HE3 1 28 GLU HG3 . . 3.390 3.465 3.446 3.472 0.082 6 0 "[ . 1 . 2]" 1
827 1 27 TRP HE3 1 31 TYR H . . 5.110 4.834 4.420 5.180 0.070 3 0 "[ . 1 . 2]" 1
828 1 27 TRP HE3 1 31 TYR HB2 . . 4.630 3.834 3.392 4.100 . 0 0 "[ . 1 . 2]" 1
829 1 27 TRP HE3 1 31 TYR HB3 . . 4.520 3.962 3.580 4.208 . 0 0 "[ . 1 . 2]" 1
830 1 27 TRP HE3 1 83 THR MG . . 4.550 3.949 3.656 4.189 . 0 0 "[ . 1 . 2]" 1
831 1 27 TRP HE3 1 87 MET ME . . 5.160 4.209 3.927 4.958 . 0 0 "[ . 1 . 2]" 1
832 1 27 TRP HH2 1 28 GLU HG2 . . 4.970 3.355 3.186 3.507 . 0 0 "[ . 1 . 2]" 1
833 1 27 TRP HH2 1 83 THR MG . . 3.230 3.290 3.159 3.342 0.112 16 0 "[ . 1 . 2]" 1
834 1 27 TRP HH2 1 87 MET ME . . 5.110 4.625 4.274 5.125 0.015 20 0 "[ . 1 . 2]" 1
835 1 27 TRP HZ3 1 28 GLU H . . 5.140 5.140 4.939 5.210 0.070 12 0 "[ . 1 . 2]" 1
836 1 27 TRP HZ3 1 28 GLU HA . . 4.180 3.838 3.664 3.995 . 0 0 "[ . 1 . 2]" 1
837 1 27 TRP HZ3 1 28 GLU HB2 . . 5.500 5.542 5.112 5.582 0.082 16 0 "[ . 1 . 2]" 1
838 1 27 TRP HZ3 1 28 GLU HG2 . . 4.020 2.756 2.670 2.867 . 0 0 "[ . 1 . 2]" 1
839 1 27 TRP HZ3 1 28 GLU HG3 . . 4.380 3.587 3.246 3.665 . 0 0 "[ . 1 . 2]" 1
840 1 27 TRP HZ3 1 31 TYR HB2 . . 5.400 5.231 4.819 5.464 0.064 16 0 "[ . 1 . 2]" 1
841 1 27 TRP HZ3 1 31 TYR HB3 . . 5.030 4.872 4.455 5.116 0.086 20 0 "[ . 1 . 2]" 1
842 1 27 TRP HZ3 1 83 THR MG . . 3.460 2.254 2.097 2.475 . 0 0 "[ . 1 . 2]" 1
843 1 27 TRP HZ3 1 86 LYS QD . . 5.330 4.515 3.968 5.382 0.052 20 0 "[ . 1 . 2]" 1
844 1 27 TRP HZ3 1 87 MET ME . . 4.240 3.629 3.298 4.316 0.076 20 0 "[ . 1 . 2]" 1
845 1 28 GLU H 1 28 GLU HB2 . . 4.120 2.236 1.865 2.319 . 0 0 "[ . 1 . 2]" 1
846 1 28 GLU H 1 28 GLU HB3 . . 3.430 3.488 3.263 3.511 0.081 19 0 "[ . 1 . 2]" 1
847 1 28 GLU H 1 28 GLU HG2 . . 4.220 3.495 3.380 3.662 . 0 0 "[ . 1 . 2]" 1
848 1 28 GLU H 1 28 GLU HG3 . . 3.740 2.508 2.337 2.756 . 0 0 "[ . 1 . 2]" 1
849 1 28 GLU H 1 29 ASP H . . 3.080 2.586 2.404 2.787 . 0 0 "[ . 1 . 2]" 1
850 1 28 GLU H 1 29 ASP HB2 . . 5.500 4.699 4.243 5.391 . 0 0 "[ . 1 . 2]" 1
851 1 28 GLU H 1 29 ASP HB3 . . 5.500 4.812 4.123 5.470 . 0 0 "[ . 1 . 2]" 1
852 1 28 GLU H 1 87 MET ME . . 5.500 4.392 4.255 4.635 . 0 0 "[ . 1 . 2]" 1
853 1 28 GLU HA 1 28 GLU HG2 . . 3.730 2.255 2.192 2.351 . 0 0 "[ . 1 . 2]" 1
854 1 28 GLU HA 1 28 GLU HG3 . . 4.110 3.016 2.925 3.076 . 0 0 "[ . 1 . 2]" 1
855 1 28 GLU HA 1 29 ASP HA . . 5.500 4.915 4.829 4.997 . 0 0 "[ . 1 . 2]" 1
856 1 28 GLU HA 1 30 ARG H . . 4.970 4.690 4.477 4.847 . 0 0 "[ . 1 . 2]" 1
857 1 28 GLU HA 1 31 TYR H . . 4.070 3.468 3.332 3.610 . 0 0 "[ . 1 . 2]" 1
858 1 28 GLU HA 1 31 TYR HB2 . . 4.250 3.801 3.598 3.960 . 0 0 "[ . 1 . 2]" 1
859 1 28 GLU HA 1 31 TYR HB3 . . 3.790 2.608 2.471 2.758 . 0 0 "[ . 1 . 2]" 1
860 1 28 GLU HA 1 31 TYR QD . . 4.370 3.809 3.411 4.063 . 0 0 "[ . 1 . 2]" 1
861 1 28 GLU HA 1 32 TYR H . . 4.860 3.751 3.451 3.927 . 0 0 "[ . 1 . 2]" 1
862 1 28 GLU HA 1 83 THR MG . . 5.500 4.448 4.066 4.718 . 0 0 "[ . 1 . 2]" 1
863 1 28 GLU HA 1 87 MET ME . . 3.640 2.193 2.029 2.675 . 0 0 "[ . 1 . 2]" 1
864 1 28 GLU HB2 1 29 ASP H . . 4.550 2.509 2.356 2.710 . 0 0 "[ . 1 . 2]" 1
865 1 28 GLU HB2 1 29 ASP HB3 . . 5.370 5.123 4.478 5.535 0.165 8 0 "[ . 1 . 2]" 1
866 1 28 GLU HB2 1 31 TYR H . . 5.500 5.540 5.418 5.575 0.075 10 0 "[ . 1 . 2]" 1
867 1 28 GLU HB2 1 87 MET ME . . 3.650 3.587 3.370 3.733 0.083 11 0 "[ . 1 . 2]" 1
868 1 28 GLU HB3 1 32 TYR H . . 5.500 4.848 4.703 5.098 . 0 0 "[ . 1 . 2]" 1
869 1 28 GLU HB3 1 86 LYS QD . . 3.720 3.698 3.307 3.819 0.099 16 0 "[ . 1 . 2]" 1
870 1 28 GLU HB3 1 87 MET ME . . 3.670 2.181 2.019 2.359 . 0 0 "[ . 1 . 2]" 1
871 1 28 GLU HG2 1 31 TYR HB2 . . 5.500 5.548 5.331 5.586 0.086 4 0 "[ . 1 . 2]" 1
872 1 28 GLU HG2 1 83 THR MG . . 5.500 3.700 2.971 3.951 . 0 0 "[ . 1 . 2]" 1
873 1 28 GLU HG2 1 87 MET ME . . 2.470 2.384 2.233 2.573 0.103 16 0 "[ . 1 . 2]" 1
874 1 28 GLU HG3 1 29 ASP H . . 5.500 4.417 4.333 4.540 . 0 0 "[ . 1 . 2]" 1
875 1 28 GLU HG3 1 86 LYS QD . . 4.320 4.367 4.160 4.421 0.101 19 0 "[ . 1 . 2]" 1
876 1 28 GLU HG3 1 87 MET ME . . 4.180 3.693 3.463 3.922 . 0 0 "[ . 1 . 2]" 1
877 1 29 ASP H 1 29 ASP HB2 . . 3.650 2.288 2.101 2.839 . 0 0 "[ . 1 . 2]" 1
878 1 29 ASP H 1 29 ASP HB3 . . 3.280 2.678 2.203 3.044 . 0 0 "[ . 1 . 2]" 1
879 1 29 ASP HA 1 31 TYR H . . 5.500 4.662 4.418 4.869 . 0 0 "[ . 1 . 2]" 1
880 1 29 ASP HA 1 32 TYR H . . 4.190 3.851 3.679 4.112 . 0 0 "[ . 1 . 2]" 1
881 1 29 ASP HA 1 32 TYR HB2 . . 4.600 3.909 3.567 4.241 . 0 0 "[ . 1 . 2]" 1
882 1 29 ASP HA 1 32 TYR HB3 . . 5.020 2.804 2.456 3.160 . 0 0 "[ . 1 . 2]" 1
883 1 29 ASP HA 1 32 TYR QD . . 4.110 3.904 3.456 4.163 0.053 16 0 "[ . 1 . 2]" 1
884 1 29 ASP HA 1 33 ARG H . . 5.020 4.162 3.761 4.511 . 0 0 "[ . 1 . 2]" 1
885 1 29 ASP HA 1 33 ARG HG2 . . 4.590 4.625 4.355 4.676 0.086 12 0 "[ . 1 . 2]" 1
886 1 29 ASP HA 1 87 MET ME . . 4.950 4.692 4.120 5.003 0.053 19 0 "[ . 1 . 2]" 1
887 1 29 ASP HB2 1 30 ARG HA . . 5.500 5.519 5.061 5.579 0.079 18 0 "[ . 1 . 2]" 1
888 1 29 ASP HB2 1 30 ARG QB . . 5.270 5.175 4.739 5.353 0.083 2 0 "[ . 1 . 2]" 1
889 1 29 ASP HB3 1 30 ARG HA . . 4.970 4.127 3.540 4.442 . 0 0 "[ . 1 . 2]" 1
890 1 30 ARG H 1 30 ARG QB . . 2.940 2.202 2.109 2.294 . 0 0 "[ . 1 . 2]" 1
891 1 30 ARG H 1 30 ARG QD . . 5.330 4.568 4.357 4.830 . 0 0 "[ . 1 . 2]" 1
892 1 30 ARG H 1 30 ARG QG . . 4.560 3.864 2.958 4.060 . 0 0 "[ . 1 . 2]" 1
893 1 30 ARG H 1 31 TYR H . . 3.380 2.809 2.540 2.979 . 0 0 "[ . 1 . 2]" 1
894 1 30 ARG H 1 32 TYR H . . 4.990 4.375 4.156 4.601 . 0 0 "[ . 1 . 2]" 1
895 1 30 ARG HA 1 30 ARG QD . . 4.680 2.747 2.204 3.383 . 0 0 "[ . 1 . 2]" 1
896 1 30 ARG HA 1 30 ARG QG . . 3.900 2.816 2.045 3.433 . 0 0 "[ . 1 . 2]" 1
897 1 30 ARG HA 1 31 TYR HA . . 5.450 4.734 4.581 4.843 . 0 0 "[ . 1 . 2]" 1
898 1 30 ARG HA 1 32 TYR H . . 5.500 4.626 4.422 4.868 . 0 0 "[ . 1 . 2]" 1
899 1 30 ARG HA 1 33 ARG H . . 3.980 3.712 3.431 4.044 0.064 4 0 "[ . 1 . 2]" 1
900 1 30 ARG HA 1 33 ARG QD . . 4.720 2.744 2.205 3.858 . 0 0 "[ . 1 . 2]" 1
901 1 30 ARG HA 1 33 ARG HE . . 5.500 4.626 3.277 5.445 . 0 0 "[ . 1 . 2]" 1
902 1 30 ARG HA 1 33 ARG HG2 . . 3.710 2.697 2.340 3.069 . 0 0 "[ . 1 . 2]" 1
903 1 30 ARG HA 1 33 ARG HG3 . . 3.630 2.523 2.109 3.333 . 0 0 "[ . 1 . 2]" 1
904 1 30 ARG HA 1 34 GLU H . . 4.730 4.235 3.874 4.808 0.078 17 0 "[ . 1 . 2]" 1
905 1 30 ARG HA 1 34 GLU QG . . 5.500 4.027 3.274 4.773 . 0 0 "[ . 1 . 2]" 1
906 1 30 ARG QB 1 30 ARG HE . . 4.830 2.638 1.974 4.037 . 0 0 "[ . 1 . 2]" 1
907 1 30 ARG QB 1 31 TYR H . . 3.390 2.720 2.367 3.489 0.099 9 0 "[ . 1 . 2]" 1
908 1 30 ARG QB 1 31 TYR HB3 . . 5.500 4.805 4.413 5.583 0.083 9 0 "[ . 1 . 2]" 1
909 1 30 ARG QD 1 31 TYR H . . 5.210 4.160 3.406 4.461 . 0 0 "[ . 1 . 2]" 1
910 1 30 ARG QD 1 31 TYR HA . . 4.020 3.789 3.000 4.131 0.111 16 0 "[ . 1 . 2]" 1
911 1 30 ARG QD 1 33 ARG QD . . 3.800 3.170 2.281 3.597 . 0 0 "[ . 1 . 2]" 1
912 1 30 ARG QD 1 34 GLU H . . 5.500 3.919 3.478 4.624 . 0 0 "[ . 1 . 2]" 1
913 1 30 ARG QD 1 34 GLU QG . . 4.430 2.183 1.839 2.677 . 0 0 "[ . 1 . 2]" 1
914 1 30 ARG QG 1 31 TYR H . . 5.500 3.730 2.359 4.612 . 0 0 "[ . 1 . 2]" 1
915 1 30 ARG QG 1 31 TYR HA . . 5.500 4.009 3.050 5.222 . 0 0 "[ . 1 . 2]" 1
916 1 30 ARG QG 1 34 GLU H . . 5.500 4.871 4.489 5.370 . 0 0 "[ . 1 . 2]" 1
917 1 30 ARG QG 1 34 GLU QG . . 5.090 3.449 2.624 4.156 . 0 0 "[ . 1 . 2]" 1
918 1 31 TYR H 1 31 TYR HB2 . . 3.400 2.595 2.476 2.714 . 0 0 "[ . 1 . 2]" 1
919 1 31 TYR H 1 31 TYR HB3 . . 3.450 2.379 2.311 2.442 . 0 0 "[ . 1 . 2]" 1
920 1 31 TYR H 1 31 TYR QD . . 4.090 4.158 4.128 4.183 0.093 9 0 "[ . 1 . 2]" 1
921 1 31 TYR H 1 32 TYR H . . 3.500 2.729 2.604 2.896 . 0 0 "[ . 1 . 2]" 1
922 1 31 TYR H 1 33 ARG H . . 5.050 4.469 4.289 4.699 . 0 0 "[ . 1 . 2]" 1
923 1 31 TYR H 1 87 MET ME . . 4.870 4.208 3.948 4.935 0.065 20 0 "[ . 1 . 2]" 1
924 1 31 TYR HA 1 31 TYR QD . . 3.440 2.769 2.430 3.169 . 0 0 "[ . 1 . 2]" 1
925 1 31 TYR HA 1 33 ARG HG3 . . 5.500 4.961 4.731 5.152 . 0 0 "[ . 1 . 2]" 1
926 1 31 TYR HA 1 34 GLU H . . 4.370 3.494 3.254 3.741 . 0 0 "[ . 1 . 2]" 1
927 1 31 TYR HA 1 34 GLU QB . . 3.410 2.616 2.049 3.156 . 0 0 "[ . 1 . 2]" 1
928 1 31 TYR HA 1 34 GLU QG . . 5.500 3.724 3.039 4.272 . 0 0 "[ . 1 . 2]" 1
929 1 31 TYR HA 1 35 ASN H . . 5.300 4.680 4.261 4.993 . 0 0 "[ . 1 . 2]" 1
930 1 31 TYR HA 1 35 ASN HD21 . . 4.270 3.181 2.808 4.266 . 0 0 "[ . 1 . 2]" 1
931 1 31 TYR HA 1 35 ASN HD22 . . 4.700 3.654 2.906 4.230 . 0 0 "[ . 1 . 2]" 1
932 1 31 TYR HB2 1 32 TYR H . . 4.670 3.957 3.811 4.118 . 0 0 "[ . 1 . 2]" 1
933 1 31 TYR HB2 1 87 MET ME . . 5.300 4.132 3.800 5.053 . 0 0 "[ . 1 . 2]" 1
934 1 31 TYR HB3 1 32 TYR H . . 3.910 2.613 2.395 2.837 . 0 0 "[ . 1 . 2]" 1
935 1 31 TYR HB3 1 32 TYR HA . . 5.500 4.458 4.190 4.698 . 0 0 "[ . 1 . 2]" 1
936 1 31 TYR HB3 1 83 THR MG . . 5.500 4.466 4.001 4.943 . 0 0 "[ . 1 . 2]" 1
937 1 31 TYR HB3 1 87 MET ME . . 3.940 2.667 2.315 3.676 . 0 0 "[ . 1 . 2]" 1
938 1 31 TYR QD 1 32 TYR H . . 4.150 3.324 2.986 3.856 . 0 0 "[ . 1 . 2]" 1
939 1 31 TYR QD 1 32 TYR HA . . 3.750 3.506 3.127 3.834 0.084 4 0 "[ . 1 . 2]" 1
940 1 31 TYR QD 1 32 TYR HB3 . . 5.060 4.996 4.784 5.148 0.088 20 0 "[ . 1 . 2]" 1
941 1 31 TYR QD 1 32 TYR QD . . 5.440 5.219 4.756 5.548 0.108 2 0 "[ . 1 . 2]" 1
942 1 31 TYR QD 1 34 GLU QB . . 4.510 4.117 3.497 4.608 0.098 19 0 "[ . 1 . 2]" 1
943 1 31 TYR QD 1 35 ASN HB2 . . 5.120 4.368 3.986 5.224 0.104 14 0 "[ . 1 . 2]" 1
944 1 31 TYR QD 1 35 ASN HD21 . . 5.080 3.259 2.727 3.862 . 0 0 "[ . 1 . 2]" 1
945 1 31 TYR QD 1 35 ASN HD22 . . 4.290 3.032 2.666 3.881 . 0 0 "[ . 1 . 2]" 1
946 1 31 TYR QD 1 83 THR MG . . 3.570 3.456 3.070 3.671 0.101 17 0 "[ . 1 . 2]" 1
947 1 31 TYR QD 1 87 MET ME . . 3.180 2.200 1.989 2.942 . 0 0 "[ . 1 . 2]" 1
948 1 31 TYR QD 1 87 MET HG2 . . 4.050 3.108 2.698 3.630 . 0 0 "[ . 1 . 2]" 1
949 1 31 TYR QD 1 87 MET HG3 . . 3.050 2.289 2.053 2.875 . 0 0 "[ . 1 . 2]" 1
950 1 31 TYR QE 1 32 TYR HA . . 4.460 4.493 4.296 4.565 0.105 4 0 "[ . 1 . 2]" 1
951 1 31 TYR QE 1 35 ASN HB2 . . 4.310 3.911 3.654 4.397 0.087 18 0 "[ . 1 . 2]" 1
952 1 31 TYR QE 1 35 ASN HB3 . . 4.390 4.309 4.019 4.472 0.082 18 0 "[ . 1 . 2]" 1
953 1 31 TYR QE 1 35 ASN HD22 . . 4.160 2.977 2.442 3.896 . 0 0 "[ . 1 . 2]" 1
954 1 31 TYR QE 1 39 TYR QE . . 4.630 4.098 3.481 4.447 . 0 0 "[ . 1 . 2]" 1
955 1 31 TYR QE 1 83 THR HB . . 5.500 4.623 4.322 5.098 . 0 0 "[ . 1 . 2]" 1
956 1 31 TYR QE 1 83 THR MG . . 3.260 3.335 3.121 3.391 0.131 18 0 "[ . 1 . 2]" 1
957 1 31 TYR QE 1 84 ASP HA . . 3.840 2.436 2.026 2.829 . 0 0 "[ . 1 . 2]" 1
958 1 31 TYR QE 1 87 MET H . . 4.820 4.491 3.955 4.898 0.078 16 0 "[ . 1 . 2]" 1
959 1 31 TYR QE 1 87 MET HB2 . . 5.350 3.707 3.207 4.137 . 0 0 "[ . 1 . 2]" 1
960 1 31 TYR QE 1 87 MET ME . . 3.990 3.564 3.292 4.094 0.104 16 0 "[ . 1 . 2]" 1
961 1 31 TYR QE 1 87 MET HG2 . . 3.760 2.767 2.227 3.374 . 0 0 "[ . 1 . 2]" 1
962 1 31 TYR QE 1 87 MET HG3 . . 3.730 2.451 2.067 2.846 . 0 0 "[ . 1 . 2]" 1
963 1 32 TYR H 1 32 TYR HB2 . . 3.450 2.568 2.409 2.825 . 0 0 "[ . 1 . 2]" 1
964 1 32 TYR H 1 32 TYR HB3 . . 3.330 2.265 2.165 2.306 . 0 0 "[ . 1 . 2]" 1
965 1 32 TYR H 1 32 TYR QD . . 4.080 4.104 4.060 4.144 0.064 2 0 "[ . 1 . 2]" 1
966 1 32 TYR H 1 33 ARG H . . 3.610 2.970 2.800 3.072 . 0 0 "[ . 1 . 2]" 1
967 1 32 TYR H 1 34 GLU H . . 5.220 4.185 3.948 4.467 . 0 0 "[ . 1 . 2]" 1
968 1 32 TYR H 1 34 GLU QB . . 5.500 5.063 4.542 5.567 0.067 19 0 "[ . 1 . 2]" 1
969 1 32 TYR H 1 87 MET ME . . 4.100 3.111 2.852 3.970 . 0 0 "[ . 1 . 2]" 1
970 1 32 TYR HA 1 32 TYR QD . . 3.120 2.895 2.730 3.149 0.029 2 0 "[ . 1 . 2]" 1
971 1 32 TYR HA 1 32 TYR QE . . 4.920 4.824 4.679 4.994 0.074 4 0 "[ . 1 . 2]" 1
972 1 32 TYR HA 1 35 ASN HB2 . . 4.880 3.728 3.268 4.706 . 0 0 "[ . 1 . 2]" 1
973 1 32 TYR HA 1 35 ASN HB3 . . 5.390 5.155 4.694 5.483 0.093 17 0 "[ . 1 . 2]" 1
974 1 32 TYR HA 1 35 ASN HD21 . . 5.500 4.626 4.271 5.236 . 0 0 "[ . 1 . 2]" 1
975 1 32 TYR HA 1 36 MET H . . 5.270 4.428 4.096 4.972 . 0 0 "[ . 1 . 2]" 1
976 1 32 TYR HA 1 36 MET HA . . 5.360 4.672 4.259 5.083 . 0 0 "[ . 1 . 2]" 1
977 1 32 TYR HA 1 36 MET QB . . 5.450 4.713 4.241 5.074 . 0 0 "[ . 1 . 2]" 1
978 1 32 TYR HA 1 39 TYR QE . . 4.020 2.947 2.553 3.250 . 0 0 "[ . 1 . 2]" 1
979 1 32 TYR HA 1 87 MET ME . . 4.700 3.923 3.654 4.449 . 0 0 "[ . 1 . 2]" 1
980 1 32 TYR HA 1 87 MET HG2 . . 5.300 4.402 4.132 4.880 . 0 0 "[ . 1 . 2]" 1
981 1 32 TYR HA 1 87 MET HG3 . . 5.500 2.786 2.405 3.726 . 0 0 "[ . 1 . 2]" 1
982 1 32 TYR HB2 1 33 ARG H . . 3.870 3.831 3.716 3.924 0.054 4 0 "[ . 1 . 2]" 1
983 1 32 TYR HB2 1 87 MET ME . . 4.830 3.130 2.945 3.435 . 0 0 "[ . 1 . 2]" 1
984 1 32 TYR HB2 1 87 MET HG2 . . 5.330 4.540 4.223 4.798 . 0 0 "[ . 1 . 2]" 1
985 1 32 TYR HB3 1 33 ARG H . . 4.320 2.446 2.276 2.743 . 0 0 "[ . 1 . 2]" 1
986 1 32 TYR HB3 1 87 MET ME . . 3.950 4.046 4.009 4.069 0.119 4 0 "[ . 1 . 2]" 1
987 1 32 TYR QD 1 33 ARG H . . 3.770 2.651 2.477 2.802 . 0 0 "[ . 1 . 2]" 1
988 1 32 TYR QD 1 33 ARG HA . . 4.000 3.280 3.045 3.627 . 0 0 "[ . 1 . 2]" 1
989 1 32 TYR QD 1 33 ARG HB2 . . 5.500 4.369 3.777 4.834 . 0 0 "[ . 1 . 2]" 1
990 1 32 TYR QD 1 33 ARG HG2 . . 4.300 3.826 2.938 4.390 0.090 1 0 "[ . 1 . 2]" 1
991 1 32 TYR QD 1 33 ARG HG3 . . 4.820 4.472 3.754 4.918 0.098 2 0 "[ . 1 . 2]" 1
992 1 32 TYR QD 1 36 MET ME . . 4.980 4.163 3.494 4.804 . 0 0 "[ . 1 . 2]" 1
993 1 32 TYR QD 1 39 TYR QE . . 3.330 3.293 2.830 3.436 0.106 14 0 "[ . 1 . 2]" 1
994 1 32 TYR QD 1 87 MET HB2 . . 4.570 3.828 3.625 3.975 . 0 0 "[ . 1 . 2]" 1
995 1 32 TYR QD 1 87 MET HB3 . . 4.210 2.124 2.000 2.287 . 0 0 "[ . 1 . 2]" 1
996 1 32 TYR QD 1 87 MET ME . . 4.690 4.360 3.873 4.785 0.095 2 0 "[ . 1 . 2]" 1
997 1 32 TYR QD 1 87 MET HG2 . . 5.190 4.538 4.249 4.831 . 0 0 "[ . 1 . 2]" 1
998 1 32 TYR QD 1 87 MET HG3 . . 5.500 3.747 3.330 4.340 . 0 0 "[ . 1 . 2]" 1
999 1 32 TYR QD 1 88 MET H . . 5.350 5.266 4.968 5.437 0.087 16 0 "[ . 1 . 2]" 1
1000 1 32 TYR QD 1 90 ARG HB3 . . 5.500 5.094 4.618 5.529 0.029 17 0 "[ . 1 . 2]" 1
1001 1 32 TYR QD 1 91 VAL HB . . 5.500 4.269 3.872 5.627 0.127 2 0 "[ . 1 . 2]" 1
1002 1 32 TYR QD 1 91 VAL QG . . 3.870 3.704 3.083 3.856 . 0 0 "[ . 1 . 2]" 1
1003 1 32 TYR QE 1 33 ARG H . . 5.090 4.812 4.561 5.008 . 0 0 "[ . 1 . 2]" 1
1004 1 32 TYR QE 1 33 ARG HA . . 4.520 4.115 3.835 4.519 . 0 0 "[ . 1 . 2]" 1
1005 1 32 TYR QE 1 36 MET HA . . 4.770 4.701 4.378 4.875 0.105 12 0 "[ . 1 . 2]" 1
1006 1 32 TYR QE 1 36 MET QB . . 4.970 3.857 3.494 4.237 . 0 0 "[ . 1 . 2]" 1
1007 1 32 TYR QE 1 36 MET ME . . 3.550 3.314 2.572 3.678 0.128 15 0 "[ . 1 . 2]" 1
1008 1 32 TYR QE 1 39 TYR QB . . 5.310 5.386 5.240 5.422 0.112 10 0 "[ . 1 . 2]" 1
1009 1 32 TYR QE 1 87 MET HB2 . . 5.500 5.262 5.007 5.559 0.059 11 0 "[ . 1 . 2]" 1
1010 1 32 TYR QE 1 90 ARG H . . 5.480 5.026 4.504 5.506 0.026 16 0 "[ . 1 . 2]" 1
1011 1 32 TYR QE 1 91 VAL H . . 4.690 2.949 2.404 3.369 . 0 0 "[ . 1 . 2]" 1
1012 1 32 TYR QE 1 91 VAL HB . . 4.280 2.620 2.281 4.041 . 0 0 "[ . 1 . 2]" 1
1013 1 32 TYR QE 1 91 VAL QG . . 3.020 2.160 1.969 2.336 . 0 0 "[ . 1 . 2]" 1
1014 1 33 ARG H 1 33 ARG HB2 . . 3.750 3.660 3.593 3.717 . 0 0 "[ . 1 . 2]" 1
1015 1 33 ARG H 1 33 ARG HB3 . . 3.740 2.755 2.414 3.174 . 0 0 "[ . 1 . 2]" 1
1016 1 33 ARG H 1 33 ARG QD . . 5.500 4.035 3.761 4.353 . 0 0 "[ . 1 . 2]" 1
1017 1 33 ARG H 1 33 ARG HG2 . . 3.180 2.671 2.059 3.202 0.022 19 0 "[ . 1 . 2]" 1
1018 1 33 ARG H 1 33 ARG HG3 . . 4.210 2.417 1.968 2.972 . 0 0 "[ . 1 . 2]" 1
1019 1 33 ARG HA 1 33 ARG QD . . 4.660 4.328 3.696 4.489 . 0 0 "[ . 1 . 2]" 1
1020 1 33 ARG HA 1 33 ARG HE . . 5.500 4.934 3.901 5.597 0.097 19 0 "[ . 1 . 2]" 1
1021 1 33 ARG HA 1 33 ARG HG3 . . 3.880 3.658 3.577 3.714 . 0 0 "[ . 1 . 2]" 1
1022 1 33 ARG HA 1 35 ASN H . . 5.060 3.741 3.529 3.982 . 0 0 "[ . 1 . 2]" 1
1023 1 33 ARG HA 1 36 MET H . . 4.700 3.362 3.089 3.506 . 0 0 "[ . 1 . 2]" 1
1024 1 33 ARG HA 1 36 MET HA . . 4.910 4.843 4.157 4.993 0.083 17 0 "[ . 1 . 2]" 1
1025 1 33 ARG HA 1 36 MET QB . . 5.060 2.858 2.220 3.268 . 0 0 "[ . 1 . 2]" 1
1026 1 33 ARG HA 1 36 MET ME . . 3.840 2.730 2.109 3.708 . 0 0 "[ . 1 . 2]" 1
1027 1 33 ARG HA 1 36 MET HG2 . . 4.230 3.367 2.325 4.036 . 0 0 "[ . 1 . 2]" 1
1028 1 33 ARG HA 1 36 MET HG3 . . 5.260 4.750 4.076 5.313 0.053 15 0 "[ . 1 . 2]" 1
1029 1 33 ARG HB3 1 33 ARG HE . . 5.500 3.250 2.257 4.165 . 0 0 "[ . 1 . 2]" 1
1030 1 33 ARG HG3 1 34 GLU QG . . 5.500 3.262 2.299 4.533 . 0 0 "[ . 1 . 2]" 1
1031 1 34 GLU H 1 34 GLU QB . . 3.060 2.291 2.094 2.638 . 0 0 "[ . 1 . 2]" 1
1032 1 34 GLU H 1 34 GLU QG . . 3.650 2.709 2.317 3.191 . 0 0 "[ . 1 . 2]" 1
1033 1 34 GLU H 1 35 ASN H . . 3.380 2.635 2.206 2.823 . 0 0 "[ . 1 . 2]" 1
1034 1 34 GLU H 1 35 ASN HD21 . . 5.120 3.910 3.486 4.657 . 0 0 "[ . 1 . 2]" 1
1035 1 34 GLU H 1 35 ASN HD22 . . 5.500 4.883 3.858 5.365 . 0 0 "[ . 1 . 2]" 1
1036 1 34 GLU HA 1 34 GLU QG . . 3.360 2.375 2.066 2.931 . 0 0 "[ . 1 . 2]" 1
1037 1 34 GLU HA 1 35 ASN HA . . 5.100 4.555 4.387 4.669 . 0 0 "[ . 1 . 2]" 1
1038 1 34 GLU HA 1 35 ASN HD21 . . 5.500 4.821 4.405 5.235 . 0 0 "[ . 1 . 2]" 1
1039 1 34 GLU HA 1 35 ASN HD22 . . 5.500 5.338 5.057 5.578 0.078 17 0 "[ . 1 . 2]" 1
1040 1 34 GLU HA 1 36 MET H . . 4.590 4.443 3.932 4.669 0.079 13 0 "[ . 1 . 2]" 1
1041 1 34 GLU HA 1 37 TYR QE . . 4.490 4.024 3.617 4.558 0.068 15 0 "[ . 1 . 2]" 1
1042 1 34 GLU QB 1 35 ASN H . . 3.870 3.274 2.916 3.665 . 0 0 "[ . 1 . 2]" 1
1043 1 34 GLU QB 1 35 ASN HA . . 5.410 4.259 3.897 4.679 . 0 0 "[ . 1 . 2]" 1
1044 1 34 GLU QB 1 35 ASN HD21 . . 4.520 2.719 2.298 3.611 . 0 0 "[ . 1 . 2]" 1
1045 1 34 GLU QB 1 35 ASN HD22 . . 4.680 2.952 2.449 3.591 . 0 0 "[ . 1 . 2]" 1
1046 1 34 GLU QG 1 35 ASN H . . 5.500 4.527 4.260 4.683 . 0 0 "[ . 1 . 2]" 1
1047 1 35 ASN H 1 35 ASN HB2 . . 3.630 2.754 2.442 3.682 0.052 17 0 "[ . 1 . 2]" 1
1048 1 35 ASN H 1 35 ASN HB3 . . 3.810 3.748 3.642 3.853 0.043 19 0 "[ . 1 . 2]" 1
1049 1 35 ASN H 1 35 ASN HD21 . . 4.010 3.089 2.509 3.754 . 0 0 "[ . 1 . 2]" 1
1050 1 35 ASN H 1 35 ASN HD22 . . 4.890 4.274 3.668 4.682 . 0 0 "[ . 1 . 2]" 1
1051 1 35 ASN H 1 36 MET H . . 3.000 2.111 1.831 2.361 . 0 0 "[ . 1 . 2]" 1
1052 1 35 ASN H 1 36 MET HA . . 5.330 4.330 4.105 4.467 . 0 0 "[ . 1 . 2]" 1
1053 1 35 ASN H 1 36 MET QB . . 5.320 4.103 3.759 4.382 . 0 0 "[ . 1 . 2]" 1
1054 1 35 ASN HA 1 35 ASN HD22 . . 5.500 4.313 3.994 4.811 . 0 0 "[ . 1 . 2]" 1
1055 1 35 ASN HA 1 36 MET HA . . 5.500 4.915 4.839 4.977 . 0 0 "[ . 1 . 2]" 1
1056 1 35 ASN HA 1 37 TYR H . . 4.640 3.810 3.606 4.001 . 0 0 "[ . 1 . 2]" 1
1057 1 35 ASN HA 1 37 TYR QD . . 3.790 3.690 3.391 3.864 0.074 20 0 "[ . 1 . 2]" 1
1058 1 35 ASN HA 1 37 TYR QE . . 3.410 3.012 2.699 3.237 . 0 0 "[ . 1 . 2]" 1
1059 1 35 ASN HA 1 38 ARG HB2 . . 5.500 4.201 3.733 4.471 . 0 0 "[ . 1 . 2]" 1
1060 1 35 ASN HA 1 38 ARG HB3 . . 5.500 5.430 4.982 5.568 0.068 20 0 "[ . 1 . 2]" 1
1061 1 35 ASN HA 1 38 ARG HD2 . . 5.040 3.239 2.322 3.824 . 0 0 "[ . 1 . 2]" 1
1062 1 35 ASN HA 1 38 ARG HD3 . . 4.610 3.630 3.167 4.560 . 0 0 "[ . 1 . 2]" 1
1063 1 35 ASN HA 1 38 ARG HG3 . . 5.030 2.854 2.197 3.890 . 0 0 "[ . 1 . 2]" 1
1064 1 35 ASN HB2 1 36 MET H . . 4.260 3.770 3.554 4.230 . 0 0 "[ . 1 . 2]" 1
1065 1 35 ASN HB2 1 38 ARG HD2 . . 5.060 4.637 3.534 5.127 0.067 11 0 "[ . 1 . 2]" 1
1066 1 35 ASN HB2 1 38 ARG HD3 . . 5.000 4.081 2.881 5.123 0.123 18 0 "[ . 1 . 2]" 1
1067 1 35 ASN HB3 1 36 MET H . . 5.400 4.345 4.195 4.750 . 0 0 "[ . 1 . 2]" 1
1068 1 35 ASN HB3 1 38 ARG HD2 . . 5.260 3.254 2.365 3.780 . 0 0 "[ . 1 . 2]" 1
1069 1 35 ASN HB3 1 38 ARG HD3 . . 5.100 2.592 2.189 4.367 . 0 0 "[ . 1 . 2]" 1
1070 1 35 ASN HB3 1 38 ARG HE . . 5.500 4.950 3.191 5.486 . 0 0 "[ . 1 . 2]" 1
1071 1 35 ASN HB3 1 39 TYR QE . . 4.470 3.768 3.321 4.497 0.027 17 0 "[ . 1 . 2]" 1
1072 1 35 ASN HD21 1 36 MET H . . 5.500 4.998 4.714 5.548 0.048 17 0 "[ . 1 . 2]" 1
1073 1 36 MET H 1 36 MET QB . . 3.560 2.466 2.323 2.713 . 0 0 "[ . 1 . 2]" 1
1074 1 36 MET H 1 36 MET ME . . 5.150 4.116 3.682 4.770 . 0 0 "[ . 1 . 2]" 1
1075 1 36 MET H 1 36 MET HG2 . . 3.570 2.369 2.195 2.701 . 0 0 "[ . 1 . 2]" 1
1076 1 36 MET H 1 36 MET HG3 . . 4.180 3.431 2.788 3.762 . 0 0 "[ . 1 . 2]" 1
1077 1 36 MET H 1 37 TYR H . . 4.110 3.099 2.945 3.230 . 0 0 "[ . 1 . 2]" 1
1078 1 36 MET H 1 37 TYR QD . . 5.500 4.629 4.469 4.815 . 0 0 "[ . 1 . 2]" 1
1079 1 36 MET H 1 37 TYR QE . . 5.410 4.216 3.999 4.418 . 0 0 "[ . 1 . 2]" 1
1080 1 36 MET H 1 39 TYR QD . . 5.260 4.753 4.312 5.020 . 0 0 "[ . 1 . 2]" 1
1081 1 36 MET HA 1 36 MET ME . . 5.420 4.401 4.068 4.744 . 0 0 "[ . 1 . 2]" 1
1082 1 36 MET HA 1 39 TYR H . . 4.520 3.898 3.618 4.117 . 0 0 "[ . 1 . 2]" 1
1083 1 36 MET HA 1 39 TYR QB . . 4.420 3.667 3.323 3.918 . 0 0 "[ . 1 . 2]" 1
1084 1 36 MET HA 1 39 TYR QD . . 3.090 2.282 2.093 2.529 . 0 0 "[ . 1 . 2]" 1
1085 1 36 MET HA 1 39 TYR QE . . 3.740 2.742 2.401 3.183 . 0 0 "[ . 1 . 2]" 1
1086 1 36 MET QB 1 36 MET ME . . 3.510 2.265 2.056 2.583 . 0 0 "[ . 1 . 2]" 1
1087 1 36 MET QB 1 37 TYR H . . 4.750 3.507 3.344 3.720 . 0 0 "[ . 1 . 2]" 1
1088 1 36 MET QB 1 39 TYR QD . . 4.160 3.678 3.396 3.864 . 0 0 "[ . 1 . 2]" 1
1089 1 36 MET ME 1 36 MET HG2 . . 3.390 2.820 2.329 3.442 0.052 6 0 "[ . 1 . 2]" 1
1090 1 36 MET ME 1 37 TYR H . . 5.430 4.907 4.504 5.265 . 0 0 "[ . 1 . 2]" 1
1091 1 36 MET ME 1 37 TYR QD . . 4.730 4.478 3.794 4.823 0.093 7 0 "[ . 1 . 2]" 1
1092 1 36 MET ME 1 37 TYR QE . . 4.090 4.073 2.945 4.215 0.125 17 0 "[ . 1 . 2]" 1
1093 1 36 MET HG2 1 37 TYR H . . 4.410 2.864 2.198 3.528 . 0 0 "[ . 1 . 2]" 1
1094 1 36 MET HG2 1 37 TYR QD . . 4.700 3.362 2.970 4.215 . 0 0 "[ . 1 . 2]" 1
1095 1 36 MET HG3 1 37 TYR H . . 4.160 2.429 2.019 3.010 . 0 0 "[ . 1 . 2]" 1
1096 1 36 MET HG3 1 37 TYR HA . . 5.500 3.728 3.350 4.181 . 0 0 "[ . 1 . 2]" 1
1097 1 36 MET HG3 1 37 TYR QD . . 4.420 2.511 2.327 2.923 . 0 0 "[ . 1 . 2]" 1
1098 1 37 TYR H 1 37 TYR HB2 . . 4.130 3.365 3.249 3.481 . 0 0 "[ . 1 . 2]" 1
1099 1 37 TYR H 1 37 TYR HB3 . . 3.450 3.206 3.026 3.337 . 0 0 "[ . 1 . 2]" 1
1100 1 37 TYR H 1 37 TYR QD . . 2.870 2.690 2.605 2.737 . 0 0 "[ . 1 . 2]" 1
1101 1 37 TYR H 1 37 TYR QE . . 3.810 3.556 3.435 3.677 . 0 0 "[ . 1 . 2]" 1
1102 1 37 TYR H 1 38 ARG HG3 . . 5.500 4.050 3.813 4.455 . 0 0 "[ . 1 . 2]" 1
1103 1 37 TYR HA 1 37 TYR QD . . 3.610 3.522 3.287 3.674 0.064 1 0 "[ . 1 . 2]" 1
1104 1 37 TYR HA 1 39 TYR H . . 4.750 4.001 3.267 4.412 . 0 0 "[ . 1 . 2]" 1
1105 1 37 TYR QD 1 38 ARG HA . . 4.450 4.339 3.900 4.529 0.079 7 0 "[ . 1 . 2]" 1
1106 1 37 TYR QD 1 38 ARG HD2 . . 5.010 4.451 3.938 5.142 0.132 18 0 "[ . 1 . 2]" 1
1107 1 37 TYR QD 1 38 ARG HG2 . . 4.850 3.582 2.548 4.246 . 0 0 "[ . 1 . 2]" 1
1108 1 37 TYR QD 1 38 ARG HG3 . . 4.630 2.850 2.590 3.129 . 0 0 "[ . 1 . 2]" 1
1109 1 37 TYR QE 1 38 ARG HD2 . . 4.690 4.536 3.852 5.077 0.387 18 0 "[ . 1 . 2]" 1
1110 1 37 TYR QE 1 38 ARG HG2 . . 5.500 4.952 3.633 5.547 0.047 2 0 "[ . 1 . 2]" 1
1111 1 37 TYR QE 1 38 ARG HG3 . . 4.120 3.926 3.143 4.183 0.063 7 0 "[ . 1 . 2]" 1
1112 1 38 ARG H 1 38 ARG HB2 . . 3.500 2.524 2.350 2.617 . 0 0 "[ . 1 . 2]" 1
1113 1 38 ARG H 1 38 ARG HB3 . . 4.160 3.624 3.573 3.682 . 0 0 "[ . 1 . 2]" 1
1114 1 38 ARG H 1 38 ARG HD2 . . 4.720 4.445 3.509 4.782 0.062 1 0 "[ . 1 . 2]" 1
1115 1 38 ARG H 1 38 ARG HD3 . . 4.560 4.195 3.973 4.795 0.235 18 0 "[ . 1 . 2]" 1
1116 1 38 ARG H 1 38 ARG HG2 . . 4.650 3.443 2.985 4.054 . 0 0 "[ . 1 . 2]" 1
1117 1 38 ARG H 1 38 ARG HG3 . . 3.690 2.305 2.115 2.767 . 0 0 "[ . 1 . 2]" 1
1118 1 38 ARG H 1 39 TYR H . . 3.200 2.383 2.152 2.555 . 0 0 "[ . 1 . 2]" 1
1119 1 38 ARG H 1 39 TYR HA . . 5.500 5.071 4.882 5.219 . 0 0 "[ . 1 . 2]" 1
1120 1 38 ARG H 1 39 TYR QB . . 5.500 4.406 4.218 4.581 . 0 0 "[ . 1 . 2]" 1
1121 1 38 ARG H 1 39 TYR QD . . 5.120 4.486 4.277 4.612 . 0 0 "[ . 1 . 2]" 1
1122 1 38 ARG HA 1 38 ARG HD2 . . 5.450 4.868 4.444 5.018 . 0 0 "[ . 1 . 2]" 1
1123 1 38 ARG HA 1 38 ARG HD3 . . 5.500 4.628 4.052 4.728 . 0 0 "[ . 1 . 2]" 1
1124 1 38 ARG HA 1 38 ARG HE . . 5.500 4.466 3.683 5.333 . 0 0 "[ . 1 . 2]" 1
1125 1 38 ARG HA 1 38 ARG HG2 . . 3.630 2.593 2.498 2.760 . 0 0 "[ . 1 . 2]" 1
1126 1 38 ARG HA 1 38 ARG HG3 . . 3.960 3.174 2.676 3.487 . 0 0 "[ . 1 . 2]" 1
1127 1 38 ARG HA 1 39 TYR QD . . 5.500 5.385 4.961 5.572 0.072 13 0 "[ . 1 . 2]" 1
1128 1 38 ARG HA 1 80 PHE QE . . 5.100 4.960 4.484 5.187 0.087 16 0 "[ . 1 . 2]" 1
1129 1 38 ARG HB2 1 38 ARG HD3 . . 4.180 2.535 2.313 3.564 . 0 0 "[ . 1 . 2]" 1
1130 1 38 ARG HB2 1 38 ARG HE . . 4.800 3.836 3.380 4.484 . 0 0 "[ . 1 . 2]" 1
1131 1 38 ARG HB2 1 39 TYR H . . 4.490 2.839 2.363 3.553 . 0 0 "[ . 1 . 2]" 1
1132 1 38 ARG HB2 1 39 TYR QD . . 5.500 3.761 3.214 4.232 . 0 0 "[ . 1 . 2]" 1
1133 1 38 ARG HB2 1 39 TYR QE . . 5.500 3.709 3.206 4.323 . 0 0 "[ . 1 . 2]" 1
1134 1 38 ARG HB3 1 38 ARG HE . . 4.440 2.921 2.231 4.640 0.200 2 0 "[ . 1 . 2]" 1
1135 1 38 ARG HB3 1 39 TYR H . . 5.090 3.890 3.525 4.374 . 0 0 "[ . 1 . 2]" 1
1136 1 38 ARG HB3 1 39 TYR QD . . 4.770 4.450 3.918 4.847 0.077 18 0 "[ . 1 . 2]" 1
1137 1 38 ARG HB3 1 80 PHE QE . . 4.530 2.981 2.485 3.646 . 0 0 "[ . 1 . 2]" 1
1138 1 38 ARG HG3 1 39 TYR H . . 5.420 4.267 3.999 4.615 . 0 0 "[ . 1 . 2]" 1
1139 1 39 TYR H 1 39 TYR QB . . 3.320 2.450 2.355 2.530 . 0 0 "[ . 1 . 2]" 1
1140 1 39 TYR H 1 39 TYR QD . . 5.000 3.104 2.946 3.434 . 0 0 "[ . 1 . 2]" 1
1141 1 39 TYR H 1 40 PRO HD2 . . 5.500 4.991 4.876 5.040 . 0 0 "[ . 1 . 2]" 1
1142 1 39 TYR H 1 40 PRO HD3 . . 5.160 4.989 4.924 5.113 . 0 0 "[ . 1 . 2]" 1
1143 1 39 TYR HA 1 39 TYR QD . . 2.710 2.222 2.111 2.342 . 0 0 "[ . 1 . 2]" 1
1144 1 39 TYR HA 1 40 PRO HD2 . . 3.980 3.058 2.724 3.412 . 0 0 "[ . 1 . 2]" 1
1145 1 39 TYR HA 1 40 PRO HD3 . . 3.500 2.337 2.256 2.493 . 0 0 "[ . 1 . 2]" 1
1146 1 39 TYR HA 1 40 PRO HG2 . . 5.500 4.940 4.730 5.165 . 0 0 "[ . 1 . 2]" 1
1147 1 39 TYR HA 1 40 PRO HG3 . . 5.350 4.599 4.475 4.725 . 0 0 "[ . 1 . 2]" 1
1148 1 39 TYR HA 1 69 HIS HD2 . . 4.350 4.050 3.673 4.434 0.084 17 0 "[ . 1 . 2]" 1
1149 1 39 TYR HA 1 69 HIS HE1 . . 5.090 4.106 3.224 4.869 . 0 0 "[ . 1 . 2]" 1
1150 1 39 TYR HA 1 80 PHE QE . . 4.740 3.901 3.496 4.315 . 0 0 "[ . 1 . 2]" 1
1151 1 39 TYR HA 1 88 MET ME . . 5.370 4.189 3.336 4.783 . 0 0 "[ . 1 . 2]" 1
1152 1 39 TYR HA 1 88 MET HG2 . . 5.500 4.220 2.887 4.849 . 0 0 "[ . 1 . 2]" 1
1153 1 39 TYR HA 1 88 MET HG3 . . 5.500 3.307 2.867 4.311 . 0 0 "[ . 1 . 2]" 1
1154 1 39 TYR QB 1 40 PRO HD3 . . 4.220 2.875 2.516 3.215 . 0 0 "[ . 1 . 2]" 1
1155 1 39 TYR QB 1 40 PRO HG2 . . 5.500 4.073 3.963 4.176 . 0 0 "[ . 1 . 2]" 1
1156 1 39 TYR QB 1 88 MET HA . . 5.030 2.915 2.659 3.544 . 0 0 "[ . 1 . 2]" 1
1157 1 39 TYR QB 1 88 MET HG2 . . 4.930 3.042 2.058 3.905 . 0 0 "[ . 1 . 2]" 1
1158 1 39 TYR QB 1 88 MET HG3 . . 4.570 2.363 2.047 3.578 . 0 0 "[ . 1 . 2]" 1
1159 1 39 TYR QB 1 91 VAL QG . . 4.080 2.075 1.910 2.232 . 0 0 "[ . 1 . 2]" 1
1160 1 39 TYR QB 1 92 VAL QG . . 5.500 3.568 3.439 3.680 . 0 0 "[ . 1 . 2]" 1
1161 1 39 TYR QD 1 40 PRO HD2 . . 5.080 4.077 3.850 4.241 . 0 0 "[ . 1 . 2]" 1
1162 1 39 TYR QD 1 40 PRO HD3 . . 3.700 3.773 3.698 3.796 0.096 9 0 "[ . 1 . 2]" 1
1163 1 39 TYR QD 1 80 PHE QD . . 4.580 4.044 3.577 4.379 . 0 0 "[ . 1 . 2]" 1
1164 1 39 TYR QD 1 80 PHE QE . . 3.630 3.120 2.448 3.668 0.038 4 0 "[ . 1 . 2]" 1
1165 1 39 TYR QD 1 84 ASP HB3 . . 4.720 4.512 4.057 4.804 0.084 7 0 "[ . 1 . 2]" 1
1166 1 39 TYR QD 1 88 MET H . . 5.500 4.388 4.153 4.709 . 0 0 "[ . 1 . 2]" 1
1167 1 39 TYR QD 1 88 MET HA . . 5.310 3.534 3.269 3.990 . 0 0 "[ . 1 . 2]" 1
1168 1 39 TYR QD 1 88 MET ME . . 3.900 3.266 2.306 3.940 0.040 11 0 "[ . 1 . 2]" 1
1169 1 39 TYR QD 1 88 MET HG2 . . 4.420 3.912 2.621 4.488 0.068 7 0 "[ . 1 . 2]" 1
1170 1 39 TYR QD 1 88 MET HG3 . . 5.500 2.755 2.323 3.273 . 0 0 "[ . 1 . 2]" 1
1171 1 39 TYR QD 1 91 VAL H . . 4.990 5.039 4.835 5.082 0.092 8 0 "[ . 1 . 2]" 1
1172 1 39 TYR QD 1 91 VAL HB . . 4.950 3.388 3.085 4.430 . 0 0 "[ . 1 . 2]" 1
1173 1 39 TYR QD 1 91 VAL QG . . 3.350 2.369 2.140 2.566 . 0 0 "[ . 1 . 2]" 1
1174 1 39 TYR QD 1 92 VAL QG . . 4.940 4.911 4.776 4.979 0.039 8 0 "[ . 1 . 2]" 1
1175 1 39 TYR QE 1 80 PHE QD . . 3.490 3.107 2.380 3.560 0.070 9 0 "[ . 1 . 2]" 1
1176 1 39 TYR QE 1 80 PHE QE . . 5.070 2.894 2.388 3.404 . 0 0 "[ . 1 . 2]" 1
1177 1 39 TYR QE 1 84 ASP HA . . 3.930 3.525 3.228 3.821 . 0 0 "[ . 1 . 2]" 1
1178 1 39 TYR QE 1 84 ASP HB2 . . 5.060 4.331 3.932 4.951 . 0 0 "[ . 1 . 2]" 1
1179 1 39 TYR QE 1 84 ASP HB3 . . 3.290 2.689 2.213 3.261 . 0 0 "[ . 1 . 2]" 1
1180 1 39 TYR QE 1 87 MET H . . 5.500 4.923 4.766 5.052 . 0 0 "[ . 1 . 2]" 1
1181 1 39 TYR QE 1 87 MET HB2 . . 3.770 2.956 2.658 3.139 . 0 0 "[ . 1 . 2]" 1
1182 1 39 TYR QE 1 87 MET HB3 . . 3.750 2.438 2.201 2.758 . 0 0 "[ . 1 . 2]" 1
1183 1 39 TYR QE 1 87 MET ME . . 5.500 5.310 5.147 5.585 0.085 4 0 "[ . 1 . 2]" 1
1184 1 39 TYR QE 1 87 MET HG2 . . 5.500 4.437 4.174 4.772 . 0 0 "[ . 1 . 2]" 1
1185 1 39 TYR QE 1 88 MET H . . 4.750 4.179 3.904 4.581 . 0 0 "[ . 1 . 2]" 1
1186 1 39 TYR QE 1 88 MET HA . . 5.500 4.574 4.268 5.066 . 0 0 "[ . 1 . 2]" 1
1187 1 39 TYR QE 1 88 MET ME . . 4.310 4.024 3.286 4.437 0.127 16 0 "[ . 1 . 2]" 1
1188 1 39 TYR QE 1 91 VAL QG . . 4.360 3.826 3.269 4.096 . 0 0 "[ . 1 . 2]" 1
1189 1 40 PRO HA 1 41 ASN H . . 2.970 2.271 2.175 2.485 . 0 0 "[ . 1 . 2]" 1
1190 1 40 PRO HA 1 42 GLN H . . 3.970 3.640 3.440 3.885 . 0 0 "[ . 1 . 2]" 1
1191 1 40 PRO HA 1 69 HIS HE1 . . 4.010 3.290 2.866 3.729 . 0 0 "[ . 1 . 2]" 1
1192 1 40 PRO HA 1 92 VAL QG . . 5.500 5.260 4.897 5.464 . 0 0 "[ . 1 . 2]" 1
1193 1 40 PRO HB2 1 41 ASN H . . 4.320 3.296 2.888 3.832 . 0 0 "[ . 1 . 2]" 1
1194 1 40 PRO HB2 1 42 GLN H . . 4.020 2.338 2.008 2.735 . 0 0 "[ . 1 . 2]" 1
1195 1 40 PRO HB2 1 42 GLN HG3 . . 5.020 4.463 3.249 5.093 0.073 11 0 "[ . 1 . 2]" 1
1196 1 40 PRO HB2 1 65 THR MG . . 3.600 3.216 2.596 3.557 . 0 0 "[ . 1 . 2]" 1
1197 1 40 PRO HB2 1 69 HIS HE1 . . 5.190 5.097 4.789 5.259 0.069 15 0 "[ . 1 . 2]" 1
1198 1 40 PRO HB2 1 91 VAL QG . . 5.500 5.095 4.729 5.390 . 0 0 "[ . 1 . 2]" 1
1199 1 40 PRO HB2 1 92 VAL QG . . 4.090 3.855 3.430 4.116 0.026 18 0 "[ . 1 . 2]" 1
1200 1 40 PRO HB2 1 95 MET ME . . 4.480 4.078 3.517 4.425 . 0 0 "[ . 1 . 2]" 1
1201 1 40 PRO HB3 1 41 ASN H . . 4.260 3.806 3.477 4.117 . 0 0 "[ . 1 . 2]" 1
1202 1 40 PRO HB3 1 42 GLN H . . 4.030 3.789 3.549 4.040 0.010 8 0 "[ . 1 . 2]" 1
1203 1 40 PRO HB3 1 65 THR MG . . 4.470 3.720 3.290 4.065 . 0 0 "[ . 1 . 2]" 1
1204 1 40 PRO HB3 1 69 HIS HA . . 5.500 4.894 4.560 5.250 . 0 0 "[ . 1 . 2]" 1
1205 1 40 PRO HB3 1 69 HIS QB . . 5.500 3.179 2.619 3.685 . 0 0 "[ . 1 . 2]" 1
1206 1 40 PRO HB3 1 69 HIS HE1 . . 4.490 3.490 3.233 3.753 . 0 0 "[ . 1 . 2]" 1
1207 1 40 PRO HB3 1 92 VAL QG . . 4.900 4.642 4.310 4.836 . 0 0 "[ . 1 . 2]" 1
1208 1 40 PRO HD2 1 69 HIS HD2 . . 4.550 4.532 4.239 4.621 0.071 8 0 "[ . 1 . 2]" 1
1209 1 40 PRO HD2 1 88 MET ME . . 5.360 4.644 4.238 5.050 . 0 0 "[ . 1 . 2]" 1
1210 1 40 PRO HD2 1 88 MET HG3 . . 5.130 2.888 2.199 4.341 . 0 0 "[ . 1 . 2]" 1
1211 1 40 PRO HD2 1 91 VAL QG . . 5.230 2.963 2.732 3.208 . 0 0 "[ . 1 . 2]" 1
1212 1 40 PRO HD2 1 92 VAL QG . . 4.520 2.825 2.581 3.118 . 0 0 "[ . 1 . 2]" 1
1213 1 40 PRO HD2 1 95 MET ME . . 5.500 4.371 3.859 4.826 . 0 0 "[ . 1 . 2]" 1
1214 1 40 PRO HD3 1 69 HIS HD2 . . 5.400 2.938 2.660 3.208 . 0 0 "[ . 1 . 2]" 1
1215 1 40 PRO HD3 1 69 HIS HE1 . . 4.630 3.931 3.336 4.384 . 0 0 "[ . 1 . 2]" 1
1216 1 40 PRO HD3 1 80 PHE QE . . 4.870 4.499 3.841 4.923 0.053 8 0 "[ . 1 . 2]" 1
1217 1 40 PRO HD3 1 88 MET HA . . 5.500 4.980 4.428 5.555 0.055 12 0 "[ . 1 . 2]" 1
1218 1 40 PRO HD3 1 88 MET ME . . 5.500 3.929 3.450 4.381 . 0 0 "[ . 1 . 2]" 1
1219 1 40 PRO HD3 1 88 MET HG2 . . 5.110 3.284 2.336 3.917 . 0 0 "[ . 1 . 2]" 1
1220 1 40 PRO HD3 1 88 MET HG3 . . 5.500 3.086 2.398 4.530 . 0 0 "[ . 1 . 2]" 1
1221 1 40 PRO HD3 1 91 VAL QG . . 5.500 4.268 4.054 4.569 . 0 0 "[ . 1 . 2]" 1
1222 1 40 PRO HD3 1 92 VAL QG . . 5.180 3.892 3.635 4.226 . 0 0 "[ . 1 . 2]" 1
1223 1 40 PRO HG2 1 65 THR MG . . 2.460 2.351 2.080 2.542 0.082 7 0 "[ . 1 . 2]" 1
1224 1 40 PRO HG2 1 69 HIS QB . . 5.500 3.892 3.679 4.147 . 0 0 "[ . 1 . 2]" 1
1225 1 40 PRO HG2 1 91 VAL QG . . 4.690 3.906 3.614 4.195 . 0 0 "[ . 1 . 2]" 1
1226 1 40 PRO HG2 1 92 VAL QG . . 3.760 2.305 1.982 2.540 . 0 0 "[ . 1 . 2]" 1
1227 1 40 PRO HG3 1 65 THR MG . . 4.220 2.471 2.171 2.804 . 0 0 "[ . 1 . 2]" 1
1228 1 40 PRO HG3 1 69 HIS QB . . 4.620 2.421 2.208 2.612 . 0 0 "[ . 1 . 2]" 1
1229 1 40 PRO HG3 1 69 HIS HD2 . . 4.070 3.573 2.962 4.133 0.063 3 0 "[ . 1 . 2]" 1
1230 1 40 PRO HG3 1 69 HIS HE1 . . 4.590 4.601 4.425 4.667 0.077 11 0 "[ . 1 . 2]" 1
1231 1 40 PRO HG3 1 88 MET HG3 . . 5.500 4.690 4.085 6.140 0.640 12 1 "[ . 1 + . 2]" 1
1232 1 40 PRO HG3 1 92 VAL QG . . 3.780 3.353 3.070 3.742 . 0 0 "[ . 1 . 2]" 1
1233 1 41 ASN H 1 41 ASN HB2 . . 3.910 2.171 2.016 2.340 . 0 0 "[ . 1 . 2]" 1
1234 1 41 ASN H 1 41 ASN HD21 . . 5.500 4.741 4.032 4.958 . 0 0 "[ . 1 . 2]" 1
1235 1 41 ASN H 1 41 ASN HD22 . . 5.500 5.366 4.970 5.601 0.101 15 0 "[ . 1 . 2]" 1
1236 1 41 ASN H 1 42 GLN H . . 2.970 2.476 2.037 2.835 . 0 0 "[ . 1 . 2]" 1
1237 1 41 ASN H 1 42 GLN HA . . 5.190 5.051 4.734 5.259 0.069 11 0 "[ . 1 . 2]" 1
1238 1 41 ASN H 1 42 GLN HG2 . . 5.500 4.651 3.779 5.254 . 0 0 "[ . 1 . 2]" 1
1239 1 41 ASN H 1 42 GLN HG3 . . 5.390 3.360 2.980 3.756 . 0 0 "[ . 1 . 2]" 1
1240 1 41 ASN H 1 95 MET ME . . 4.530 4.390 4.078 4.613 0.083 13 0 "[ . 1 . 2]" 1
1241 1 41 ASN HA 1 41 ASN HD21 . . 3.610 2.637 2.004 3.669 0.059 9 0 "[ . 1 . 2]" 1
1242 1 41 ASN HA 1 41 ASN HD22 . . 5.380 3.682 3.430 3.987 . 0 0 "[ . 1 . 2]" 1
1243 1 41 ASN HA 1 95 MET ME . . 3.810 2.776 2.228 3.278 . 0 0 "[ . 1 . 2]" 1
1244 1 41 ASN HB2 1 42 GLN H . . 4.030 3.610 3.007 4.093 0.063 10 0 "[ . 1 . 2]" 1
1245 1 41 ASN HB2 1 42 GLN HG3 . . 3.690 3.210 2.439 3.769 0.079 6 0 "[ . 1 . 2]" 1
1246 1 41 ASN HB2 1 95 MET ME . . 5.500 5.068 4.705 5.414 . 0 0 "[ . 1 . 2]" 1
1247 1 41 ASN HB3 1 41 ASN HD22 . . 4.150 3.569 3.388 3.991 . 0 0 "[ . 1 . 2]" 1
1248 1 41 ASN HB3 1 95 MET ME . . 5.500 4.649 4.168 5.273 . 0 0 "[ . 1 . 2]" 1
1249 1 42 GLN H 1 42 GLN HB2 . . 3.570 2.821 2.598 3.138 . 0 0 "[ . 1 . 2]" 1
1250 1 42 GLN H 1 42 GLN HG2 . . 4.580 3.657 3.220 4.204 . 0 0 "[ . 1 . 2]" 1
1251 1 42 GLN H 1 42 GLN HG3 . . 5.050 2.722 2.429 3.009 . 0 0 "[ . 1 . 2]" 1
1252 1 42 GLN H 1 43 VAL H . . 5.210 4.427 4.326 4.519 . 0 0 "[ . 1 . 2]" 1
1253 1 42 GLN H 1 43 VAL QG . . 5.500 4.253 3.889 5.022 . 0 0 "[ . 1 . 2]" 1
1254 1 42 GLN H 1 95 MET ME . . 3.990 3.351 2.755 4.000 0.010 3 0 "[ . 1 . 2]" 1
1255 1 42 GLN HA 1 43 VAL H . . 3.110 2.454 2.228 2.644 . 0 0 "[ . 1 . 2]" 1
1256 1 42 GLN HA 1 43 VAL QG . . 4.980 3.363 3.012 4.164 . 0 0 "[ . 1 . 2]" 1
1257 1 42 GLN HA 1 95 MET ME . . 4.680 3.609 3.022 3.909 . 0 0 "[ . 1 . 2]" 1
1258 1 42 GLN HB2 1 42 GLN HE21 . . 4.730 3.581 2.981 4.342 . 0 0 "[ . 1 . 2]" 1
1259 1 42 GLN HB2 1 42 GLN HE22 . . 5.240 4.304 3.938 4.719 . 0 0 "[ . 1 . 2]" 1
1260 1 42 GLN HB2 1 43 VAL H . . 4.530 3.449 3.026 3.963 . 0 0 "[ . 1 . 2]" 1
1261 1 42 GLN HB2 1 43 VAL QG . . 5.320 4.597 4.373 4.874 . 0 0 "[ . 1 . 2]" 1
1262 1 42 GLN HB3 1 42 GLN HE21 . . 4.690 2.580 1.953 3.543 . 0 0 "[ . 1 . 2]" 1
1263 1 42 GLN HB3 1 42 GLN HE22 . . 5.030 3.851 3.554 4.449 . 0 0 "[ . 1 . 2]" 1
1264 1 42 GLN HB3 1 43 VAL H . . 4.000 2.733 2.150 3.515 . 0 0 "[ . 1 . 2]" 1
1265 1 42 GLN HE21 1 43 VAL H . . 5.500 5.078 4.436 5.580 0.080 1 0 "[ . 1 . 2]" 1
1266 1 42 GLN HG2 1 43 VAL H . . 5.370 4.679 4.205 5.156 . 0 0 "[ . 1 . 2]" 1
1267 1 43 VAL H 1 43 VAL QG . . 3.350 2.320 2.078 2.815 . 0 0 "[ . 1 . 2]" 1
1268 1 43 VAL HA 1 44 TYR H . . 3.150 2.471 2.299 2.643 . 0 0 "[ . 1 . 2]" 1
1269 1 43 VAL HA 1 44 TYR QD . . 4.210 2.966 2.566 3.736 . 0 0 "[ . 1 . 2]" 1
1270 1 43 VAL HA 1 65 THR HA . . 5.500 4.407 4.135 4.664 . 0 0 "[ . 1 . 2]" 1
1271 1 43 VAL HA 1 65 THR HG1 . . 4.360 3.469 3.055 3.864 . 0 0 "[ . 1 . 2]" 1
1272 1 43 VAL HA 1 65 THR MG . . 3.360 2.317 2.087 2.725 . 0 0 "[ . 1 . 2]" 1
1273 1 43 VAL HA 1 92 VAL QG . . 4.620 3.466 3.066 4.082 . 0 0 "[ . 1 . 2]" 1
1274 1 43 VAL HA 1 95 MET ME . . 5.500 4.345 3.889 4.619 . 0 0 "[ . 1 . 2]" 1
1275 1 43 VAL HB 1 44 TYR H . . 3.510 2.667 2.272 3.608 0.098 18 0 "[ . 1 . 2]" 1
1276 1 43 VAL HB 1 61 CYS HA . . 5.500 4.579 3.690 5.592 0.092 18 0 "[ . 1 . 2]" 1
1277 1 43 VAL HB 1 65 THR HB . . 5.460 4.328 3.736 5.545 0.085 15 0 "[ . 1 . 2]" 1
1278 1 43 VAL HB 1 65 THR HG1 . . 4.450 3.258 2.799 4.551 0.101 15 0 "[ . 1 . 2]" 1
1279 1 43 VAL HB 1 65 THR MG . . 4.150 3.387 2.777 4.062 . 0 0 "[ . 1 . 2]" 1
1280 1 43 VAL HB 1 92 VAL QG . . 4.990 3.121 2.178 3.872 . 0 0 "[ . 1 . 2]" 1
1281 1 43 VAL HB 1 95 MET ME . . 4.650 4.263 2.664 4.729 0.079 17 0 "[ . 1 . 2]" 1
1282 1 43 VAL QG 1 44 TYR H . . 4.870 2.839 1.843 3.288 . 0 0 "[ . 1 . 2]" 1
1283 1 43 VAL QG 1 44 TYR HA . . 5.500 3.818 3.566 4.117 . 0 0 "[ . 1 . 2]" 1
1284 1 43 VAL QG 1 44 TYR QD . . 5.500 4.291 3.665 4.707 . 0 0 "[ . 1 . 2]" 1
1285 1 43 VAL QG 1 45 TYR H . . 5.500 4.218 3.722 4.522 . 0 0 "[ . 1 . 2]" 1
1286 1 43 VAL QG 1 45 TYR HB3 . . 4.840 3.174 2.745 3.444 . 0 0 "[ . 1 . 2]" 1
1287 1 43 VAL QG 1 45 TYR QD . . 3.160 2.286 2.075 2.591 . 0 0 "[ . 1 . 2]" 1
1288 1 43 VAL QG 1 45 TYR QE . . 3.620 3.457 3.190 3.698 0.078 15 0 "[ . 1 . 2]" 1
1289 1 43 VAL QG 1 57 PHE QE . . 5.500 3.681 3.307 4.245 . 0 0 "[ . 1 . 2]" 1
1290 1 43 VAL QG 1 61 CYS HA . . 4.200 3.936 2.611 4.226 0.026 8 0 "[ . 1 . 2]" 1
1291 1 43 VAL QG 1 65 THR HG1 . . 5.500 3.534 2.276 3.911 . 0 0 "[ . 1 . 2]" 1
1292 1 43 VAL QG 1 65 THR MG . . 4.740 2.680 2.321 3.046 . 0 0 "[ . 1 . 2]" 1
1293 1 43 VAL QG 1 92 VAL QG . . 5.400 2.252 1.856 2.717 . 0 0 "[ . 1 . 2]" 1
1294 1 43 VAL QG 1 95 MET H . . 5.100 3.918 3.529 4.343 . 0 0 "[ . 1 . 2]" 1
1295 1 43 VAL QG 1 95 MET HA . . 5.160 4.258 3.980 4.727 . 0 0 "[ . 1 . 2]" 1
1296 1 43 VAL QG 1 95 MET HB2 . . 3.560 2.401 2.107 3.054 . 0 0 "[ . 1 . 2]" 1
1297 1 43 VAL QG 1 95 MET HB3 . . 3.730 2.677 2.352 3.405 . 0 0 "[ . 1 . 2]" 1
1298 1 43 VAL QG 1 95 MET ME . . 3.100 2.181 1.873 3.055 . 0 0 "[ . 1 . 2]" 1
1299 1 43 VAL QG 1 95 MET HG2 . . 5.500 4.451 4.149 5.146 . 0 0 "[ . 1 . 2]" 1
1300 1 43 VAL QG 1 95 MET HG3 . . 5.500 4.148 3.529 5.052 . 0 0 "[ . 1 . 2]" 1
1301 1 43 VAL QG 1 96 CYS H . . 4.340 3.024 2.641 3.446 . 0 0 "[ . 1 . 2]" 1
1302 1 43 VAL QG 1 96 CYS HA . . 3.880 2.437 2.113 2.900 . 0 0 "[ . 1 . 2]" 1
1303 1 43 VAL QG 1 99 GLN H . . 5.180 4.083 3.804 4.378 . 0 0 "[ . 1 . 2]" 1
1304 1 43 VAL QG 1 99 GLN HA . . 5.080 4.780 4.523 5.048 . 0 0 "[ . 1 . 2]" 1
1305 1 43 VAL QG 1 99 GLN HB2 . . 4.070 2.990 2.597 3.559 . 0 0 "[ . 1 . 2]" 1
1306 1 43 VAL QG 1 99 GLN HB3 . . 4.130 3.528 2.969 4.086 . 0 0 "[ . 1 . 2]" 1
1307 1 43 VAL QG 1 99 GLN HE21 . . 5.500 4.481 4.028 4.920 . 0 0 "[ . 1 . 2]" 1
1308 1 43 VAL QG 1 99 GLN HE22 . . 5.500 5.080 4.683 5.449 . 0 0 "[ . 1 . 2]" 1
1309 1 43 VAL QG 1 99 GLN HG2 . . 4.010 2.472 2.169 3.086 . 0 0 "[ . 1 . 2]" 1
1310 1 43 VAL QG 1 99 GLN HG3 . . 4.830 2.508 2.083 3.813 . 0 0 "[ . 1 . 2]" 1
1311 1 43 VAL QG 1 100 TYR H . . 5.500 5.013 4.769 5.339 . 0 0 "[ . 1 . 2]" 1
1312 1 44 TYR H 1 44 TYR HB2 . . 4.100 2.454 2.244 2.681 . 0 0 "[ . 1 . 2]" 1
1313 1 44 TYR H 1 44 TYR QD . . 3.710 2.881 2.384 3.175 . 0 0 "[ . 1 . 2]" 1
1314 1 44 TYR H 1 44 TYR QE . . 5.180 5.108 4.599 5.274 0.094 9 0 "[ . 1 . 2]" 1
1315 1 44 TYR H 1 61 CYS HA . . 5.400 3.766 3.112 4.349 . 0 0 "[ . 1 . 2]" 1
1316 1 44 TYR H 1 64 ILE HB . . 5.500 4.374 4.176 4.667 . 0 0 "[ . 1 . 2]" 1
1317 1 44 TYR H 1 64 ILE MG . . 5.500 4.187 3.986 4.457 . 0 0 "[ . 1 . 2]" 1
1318 1 44 TYR H 1 65 THR HA . . 4.760 3.997 3.699 4.756 . 0 0 "[ . 1 . 2]" 1
1319 1 44 TYR H 1 65 THR HB . . 4.900 4.050 3.856 4.525 . 0 0 "[ . 1 . 2]" 1
1320 1 44 TYR H 1 65 THR HG1 . . 3.760 2.295 2.140 2.564 . 0 0 "[ . 1 . 2]" 1
1321 1 44 TYR H 1 65 THR MG . . 3.980 3.429 3.113 4.007 0.027 10 0 "[ . 1 . 2]" 1
1322 1 44 TYR H 1 92 VAL QG . . 5.500 4.165 3.656 4.730 . 0 0 "[ . 1 . 2]" 1
1323 1 44 TYR HA 1 44 TYR QD . . 3.890 3.082 2.558 3.222 . 0 0 "[ . 1 . 2]" 1
1324 1 44 TYR HA 1 44 TYR QE . . 4.840 4.767 4.546 4.870 0.030 15 0 "[ . 1 . 2]" 1
1325 1 44 TYR HA 1 45 TYR H . . 3.080 2.285 2.242 2.372 . 0 0 "[ . 1 . 2]" 1
1326 1 44 TYR HA 1 45 TYR QD . . 3.860 3.301 2.950 3.774 . 0 0 "[ . 1 . 2]" 1
1327 1 44 TYR HA 1 45 TYR QE . . 4.820 4.528 3.908 4.900 0.080 18 0 "[ . 1 . 2]" 1
1328 1 44 TYR HA 1 64 ILE MG . . 5.500 4.190 4.082 4.335 . 0 0 "[ . 1 . 2]" 1
1329 1 44 TYR HB2 1 64 ILE HB . . 4.670 3.078 2.660 3.427 . 0 0 "[ . 1 . 2]" 1
1330 1 44 TYR HB2 1 64 ILE MG . . 3.650 2.153 2.028 2.319 . 0 0 "[ . 1 . 2]" 1
1331 1 44 TYR HB2 1 65 THR H . . 4.930 3.579 3.351 3.957 . 0 0 "[ . 1 . 2]" 1
1332 1 44 TYR HB2 1 65 THR HA . . 4.240 3.117 2.728 3.507 . 0 0 "[ . 1 . 2]" 1
1333 1 44 TYR HB2 1 65 THR HB . . 5.500 4.660 4.380 4.955 . 0 0 "[ . 1 . 2]" 1
1334 1 44 TYR HB2 1 65 THR HG1 . . 5.500 3.163 2.914 3.421 . 0 0 "[ . 1 . 2]" 1
1335 1 44 TYR HB2 1 68 GLN HG2 . . 5.500 4.815 4.371 5.563 0.063 2 0 "[ . 1 . 2]" 1
1336 1 44 TYR HB3 1 45 TYR H . . 4.100 3.489 2.993 3.859 . 0 0 "[ . 1 . 2]" 1
1337 1 44 TYR HB3 1 64 ILE MD . . 5.500 4.644 4.372 4.880 . 0 0 "[ . 1 . 2]" 1
1338 1 44 TYR HB3 1 64 ILE MG . . 4.320 2.166 2.045 2.437 . 0 0 "[ . 1 . 2]" 1
1339 1 44 TYR HB3 1 68 GLN HG3 . . 5.500 3.919 3.631 4.319 . 0 0 "[ . 1 . 2]" 1
1340 1 44 TYR QD 1 64 ILE MG . . 3.890 3.284 3.065 3.497 . 0 0 "[ . 1 . 2]" 1
1341 1 44 TYR QD 1 65 THR H . . 5.140 4.509 4.029 5.106 . 0 0 "[ . 1 . 2]" 1
1342 1 44 TYR QD 1 65 THR HA . . 3.010 2.514 2.133 3.094 0.084 4 0 "[ . 1 . 2]" 1
1343 1 44 TYR QD 1 65 THR HB . . 5.400 4.348 3.979 4.933 . 0 0 "[ . 1 . 2]" 1
1344 1 44 TYR QD 1 65 THR HG1 . . 5.030 3.688 3.203 4.361 . 0 0 "[ . 1 . 2]" 1
1345 1 44 TYR QD 1 65 THR MG . . 3.370 2.436 2.190 2.931 . 0 0 "[ . 1 . 2]" 1
1346 1 44 TYR QD 1 68 GLN H . . 5.500 5.002 4.478 5.311 . 0 0 "[ . 1 . 2]" 1
1347 1 44 TYR QD 1 68 GLN HB2 . . 4.450 3.429 2.607 3.758 . 0 0 "[ . 1 . 2]" 1
1348 1 44 TYR QD 1 68 GLN HB3 . . 4.450 4.059 3.408 4.385 . 0 0 "[ . 1 . 2]" 1
1349 1 44 TYR QD 1 68 GLN HG2 . . 4.770 4.342 3.931 4.691 . 0 0 "[ . 1 . 2]" 1
1350 1 44 TYR QD 1 68 GLN HG3 . . 5.500 3.069 2.571 3.367 . 0 0 "[ . 1 . 2]" 1
1351 1 44 TYR QE 1 64 ILE MG . . 5.500 4.633 4.263 4.900 . 0 0 "[ . 1 . 2]" 1
1352 1 44 TYR QE 1 65 THR HA . . 4.960 3.857 3.266 4.701 . 0 0 "[ . 1 . 2]" 1
1353 1 44 TYR QE 1 65 THR MG . . 5.370 3.278 2.642 4.228 . 0 0 "[ . 1 . 2]" 1
1354 1 44 TYR QE 1 68 GLN HA . . 5.500 5.320 4.658 5.572 0.072 18 0 "[ . 1 . 2]" 1
1355 1 44 TYR QE 1 68 GLN HB2 . . 4.730 3.433 2.748 4.343 . 0 0 "[ . 1 . 2]" 1
1356 1 44 TYR QE 1 68 GLN HB3 . . 3.670 3.112 2.134 3.503 . 0 0 "[ . 1 . 2]" 1
1357 1 44 TYR QE 1 68 GLN HE21 . . 2.490 2.541 2.370 2.599 0.109 9 0 "[ . 1 . 2]" 1
1358 1 44 TYR QE 1 68 GLN HG2 . . 5.200 4.529 4.081 4.727 . 0 0 "[ . 1 . 2]" 1
1359 1 44 TYR QE 1 68 GLN HG3 . . 3.550 3.062 2.671 3.324 . 0 0 "[ . 1 . 2]" 1
1360 1 44 TYR QE 1 69 HIS HA . . 5.200 4.891 4.364 5.302 0.102 5 0 "[ . 1 . 2]" 1
1361 1 45 TYR H 1 45 TYR QD . . 3.320 2.763 2.435 3.086 . 0 0 "[ . 1 . 2]" 1
1362 1 45 TYR H 1 45 TYR QE . . 4.180 4.136 3.989 4.281 0.101 8 0 "[ . 1 . 2]" 1
1363 1 45 TYR H 1 46 ARG H . . 5.500 4.477 4.402 4.543 . 0 0 "[ . 1 . 2]" 1
1364 1 45 TYR H 1 46 ARG HA . . 5.460 4.916 4.762 5.116 . 0 0 "[ . 1 . 2]" 1
1365 1 45 TYR H 1 64 ILE MG . . 5.500 4.526 4.179 4.896 . 0 0 "[ . 1 . 2]" 1
1366 1 45 TYR HA 1 45 TYR QD . . 4.050 3.850 3.791 3.885 . 0 0 "[ . 1 . 2]" 1
1367 1 45 TYR HA 1 46 ARG H . . 3.210 2.516 2.328 2.624 . 0 0 "[ . 1 . 2]" 1
1368 1 45 TYR HA 1 64 ILE MD . . 5.220 5.318 5.250 5.333 0.113 17 0 "[ . 1 . 2]" 1
1369 1 45 TYR HB2 1 46 ARG H . . 3.720 2.344 2.194 2.715 . 0 0 "[ . 1 . 2]" 1
1370 1 45 TYR HB2 1 57 PHE QE . . 3.730 3.006 2.843 3.130 . 0 0 "[ . 1 . 2]" 1
1371 1 45 TYR HB2 1 57 PHE HZ . . 3.650 2.860 2.558 3.253 . 0 0 "[ . 1 . 2]" 1
1372 1 45 TYR HB3 1 46 ARG H . . 4.110 3.720 3.593 3.966 . 0 0 "[ . 1 . 2]" 1
1373 1 45 TYR HB3 1 57 PHE QE . . 5.270 2.856 2.377 3.372 . 0 0 "[ . 1 . 2]" 1
1374 1 45 TYR HB3 1 57 PHE HZ . . 3.850 3.312 2.829 3.670 . 0 0 "[ . 1 . 2]" 1
1375 1 45 TYR QD 1 46 ARG H . . 3.800 3.386 3.061 3.870 0.070 14 0 "[ . 1 . 2]" 1
1376 1 45 TYR QD 1 47 PRO HA . . 4.420 3.599 3.148 3.888 . 0 0 "[ . 1 . 2]" 1
1377 1 45 TYR QD 1 47 PRO HD3 . . 5.120 4.950 4.586 5.184 0.064 13 0 "[ . 1 . 2]" 1
1378 1 45 TYR QD 1 48 VAL H . . 5.500 4.644 4.102 5.553 0.053 5 0 "[ . 1 . 2]" 1
1379 1 45 TYR QD 1 57 PHE QE . . 3.270 2.795 2.499 3.206 . 0 0 "[ . 1 . 2]" 1
1380 1 45 TYR QD 1 57 PHE HZ . . 3.610 2.760 2.442 3.078 . 0 0 "[ . 1 . 2]" 1
1381 1 45 TYR QD 1 99 GLN HG2 . . 4.040 4.051 3.268 4.144 0.104 16 0 "[ . 1 . 2]" 1
1382 1 45 TYR QD 1 99 GLN HG3 . . 4.440 2.759 2.517 3.518 . 0 0 "[ . 1 . 2]" 1
1383 1 45 TYR QD 1 103 GLU QG . . 4.990 3.135 2.468 3.653 . 0 0 "[ . 1 . 2]" 1
1384 1 45 TYR QE 1 47 PRO HA . . 4.530 3.825 3.265 4.280 . 0 0 "[ . 1 . 2]" 1
1385 1 45 TYR QE 1 47 PRO HB3 . . 5.500 4.968 4.427 5.385 . 0 0 "[ . 1 . 2]" 1
1386 1 45 TYR QE 1 48 VAL H . . 5.430 4.884 4.235 5.513 0.083 20 0 "[ . 1 . 2]" 1
1387 1 45 TYR QE 1 57 PHE QE . . 4.540 4.039 3.684 4.597 0.057 20 0 "[ . 1 . 2]" 1
1388 1 45 TYR QE 1 99 GLN HE21 . . 3.180 3.021 2.416 3.618 0.438 6 0 "[ . 1 . 2]" 1
1389 1 45 TYR QE 1 99 GLN HE22 . . 5.480 3.561 3.139 4.414 . 0 0 "[ . 1 . 2]" 1
1390 1 45 TYR QE 1 99 GLN HG2 . . 4.060 3.895 3.200 4.142 0.082 7 0 "[ . 1 . 2]" 1
1391 1 45 TYR QE 1 99 GLN HG3 . . 5.500 2.806 2.245 3.285 . 0 0 "[ . 1 . 2]" 1
1392 1 45 TYR QE 1 103 GLU HB2 . . 5.500 4.558 4.253 5.072 . 0 0 "[ . 1 . 2]" 1
1393 1 45 TYR QE 1 103 GLU QG . . 3.510 2.301 2.125 2.671 . 0 0 "[ . 1 . 2]" 1
1394 1 46 ARG H 1 46 ARG HD2 . . 5.500 4.613 4.225 5.231 . 0 0 "[ . 1 . 2]" 1
1395 1 46 ARG H 1 46 ARG HG2 . . 5.500 2.921 2.595 3.234 . 0 0 "[ . 1 . 2]" 1
1396 1 46 ARG H 1 46 ARG HG3 . . 4.680 3.875 3.340 4.156 . 0 0 "[ . 1 . 2]" 1
1397 1 46 ARG H 1 47 PRO HD3 . . 5.500 5.056 4.854 5.190 . 0 0 "[ . 1 . 2]" 1
1398 1 46 ARG H 1 51 TYR QE . . 4.590 4.078 3.810 4.390 . 0 0 "[ . 1 . 2]" 1
1399 1 46 ARG HA 1 46 ARG HE . . 4.460 3.870 2.726 4.542 0.082 1 0 "[ . 1 . 2]" 1
1400 1 46 ARG HA 1 46 ARG HG2 . . 4.040 2.792 2.403 3.067 . 0 0 "[ . 1 . 2]" 1
1401 1 46 ARG HA 1 47 PRO HD2 . . 3.770 2.456 2.333 2.641 . 0 0 "[ . 1 . 2]" 1
1402 1 46 ARG HA 1 47 PRO HD3 . . 3.390 2.383 2.272 2.539 . 0 0 "[ . 1 . 2]" 1
1403 1 46 ARG HA 1 47 PRO HG3 . . 5.100 4.574 4.459 4.659 . 0 0 "[ . 1 . 2]" 1
1404 1 46 ARG HA 1 50 GLN HE22 . . 4.880 4.535 3.805 4.948 0.068 10 0 "[ . 1 . 2]" 1
1405 1 46 ARG QB 1 47 PRO HD2 . . 3.900 2.280 2.143 2.532 . 0 0 "[ . 1 . 2]" 1
1406 1 46 ARG QB 1 47 PRO HD3 . . 4.260 3.562 3.374 3.670 . 0 0 "[ . 1 . 2]" 1
1407 1 46 ARG QB 1 51 TYR QE . . 4.780 2.298 2.112 2.463 . 0 0 "[ . 1 . 2]" 1
1408 1 46 ARG HB2 1 51 TYR QD . . 5.330 4.398 3.744 4.841 . 0 0 "[ . 1 . 2]" 1
1409 1 46 ARG HB2 1 51 TYR QE . . 3.550 2.474 2.228 2.691 . 0 0 "[ . 1 . 2]" 1
1410 1 46 ARG HD2 1 47 PRO HD2 . . 5.500 3.138 2.623 3.900 . 0 0 "[ . 1 . 2]" 1
1411 1 46 ARG HD2 1 64 ILE MD . . 5.500 5.568 5.227 5.615 0.115 8 0 "[ . 1 . 2]" 1
1412 1 46 ARG HD3 1 47 PRO HD2 . . 5.500 4.563 4.172 4.998 . 0 0 "[ . 1 . 2]" 1
1413 1 46 ARG HD3 1 64 ILE MD . . 5.500 4.543 4.376 5.059 . 0 0 "[ . 1 . 2]" 1
1414 1 46 ARG HE 1 47 PRO HG2 . . 5.370 4.507 3.455 5.266 . 0 0 "[ . 1 . 2]" 1
1415 1 46 ARG HE 1 50 GLN HE21 . . 3.850 3.448 2.510 3.925 0.075 8 0 "[ . 1 . 2]" 1
1416 1 46 ARG HE 1 50 GLN HE22 . . 3.380 2.351 1.912 3.373 . 0 0 "[ . 1 . 2]" 1
1417 1 46 ARG HG2 1 47 PRO HD2 . . 5.170 4.401 4.093 4.679 . 0 0 "[ . 1 . 2]" 1
1418 1 46 ARG HG2 1 47 PRO HD3 . . 5.290 5.029 4.681 5.274 . 0 0 "[ . 1 . 2]" 1
1419 1 46 ARG HG2 1 51 TYR QE . . 4.870 4.900 4.652 4.973 0.103 7 0 "[ . 1 . 2]" 1
1420 1 46 ARG HG3 1 47 PRO HD2 . . 5.500 4.508 4.173 4.905 . 0 0 "[ . 1 . 2]" 1
1421 1 46 ARG HG3 1 51 TYR QE . . 4.830 4.402 4.044 4.609 . 0 0 "[ . 1 . 2]" 1
1422 1 46 ARG HG3 1 64 ILE MD . . 5.210 5.065 4.721 5.306 0.096 12 0 "[ . 1 . 2]" 1
1423 1 46 ARG HG3 1 64 ILE QG . . 5.420 5.143 4.659 5.506 0.086 12 0 "[ . 1 . 2]" 1
1424 1 47 PRO HA 1 48 VAL H . . 2.870 2.154 2.040 2.714 . 0 0 "[ . 1 . 2]" 1
1425 1 47 PRO HA 1 48 VAL QG . . 4.700 3.764 3.171 4.248 . 0 0 "[ . 1 . 2]" 1
1426 1 47 PRO HA 1 49 ASP H . . 5.340 3.685 3.412 4.476 . 0 0 "[ . 1 . 2]" 1
1427 1 47 PRO HA 1 57 PHE QE . . 5.190 4.239 3.215 4.915 . 0 0 "[ . 1 . 2]" 1
1428 1 47 PRO HB2 1 49 ASP H . . 4.110 2.418 2.015 2.979 . 0 0 "[ . 1 . 2]" 1
1429 1 47 PRO HB2 1 50 GLN HE21 . . 5.500 4.345 3.924 4.833 . 0 0 "[ . 1 . 2]" 1
1430 1 47 PRO HB3 1 48 VAL H . . 4.140 3.838 3.217 4.045 . 0 0 "[ . 1 . 2]" 1
1431 1 47 PRO HB3 1 50 GLN HE21 . . 5.500 5.139 4.788 5.565 0.065 3 0 "[ . 1 . 2]" 1
1432 1 47 PRO HD2 1 50 GLN H . . 5.500 5.266 4.912 5.486 . 0 0 "[ . 1 . 2]" 1
1433 1 47 PRO HD2 1 50 GLN HE21 . . 5.460 2.636 2.129 3.021 . 0 0 "[ . 1 . 2]" 1
1434 1 47 PRO HD2 1 50 GLN HE22 . . 5.430 2.705 1.997 3.413 . 0 0 "[ . 1 . 2]" 1
1435 1 47 PRO HD3 1 50 GLN HE22 . . 5.500 4.359 3.739 5.179 . 0 0 "[ . 1 . 2]" 1
1436 1 47 PRO HG2 1 48 VAL H . . 5.500 4.937 4.291 5.234 . 0 0 "[ . 1 . 2]" 1
1437 1 47 PRO HG2 1 50 GLN QB . . 3.840 3.767 3.316 3.839 . 0 0 "[ . 1 . 2]" 1
1438 1 47 PRO HG2 1 50 GLN HE21 . . 4.740 2.473 1.872 3.044 . 0 0 "[ . 1 . 2]" 1
1439 1 47 PRO HG2 1 50 GLN HE22 . . 5.240 3.316 2.808 4.206 . 0 0 "[ . 1 . 2]" 1
1440 1 48 VAL H 1 48 VAL HB . . 3.260 2.339 1.995 3.356 0.096 14 0 "[ . 1 . 2]" 1
1441 1 48 VAL H 1 48 VAL QG . . 3.450 2.374 1.720 2.916 . 0 0 "[ . 1 . 2]" 1
1442 1 48 VAL H 1 49 ASP H . . 3.860 2.702 2.333 2.942 . 0 0 "[ . 1 . 2]" 1
1443 1 48 VAL H 1 51 TYR QD . . 5.500 5.401 4.842 5.613 0.113 5 0 "[ . 1 . 2]" 1
1444 1 48 VAL H 1 57 PHE QD . . 5.280 4.794 4.212 5.368 0.088 5 0 "[ . 1 . 2]" 1
1445 1 48 VAL H 1 57 PHE QE . . 5.500 3.870 3.269 4.405 . 0 0 "[ . 1 . 2]" 1
1446 1 48 VAL H 1 103 GLU HB2 . . 5.500 4.553 4.133 5.064 . 0 0 "[ . 1 . 2]" 1
1447 1 48 VAL H 1 103 GLU HB3 . . 5.500 3.304 2.838 3.785 . 0 0 "[ . 1 . 2]" 1
1448 1 48 VAL H 1 103 GLU QG . . 4.550 3.603 2.841 4.026 . 0 0 "[ . 1 . 2]" 1
1449 1 48 VAL HA 1 50 GLN H . . 4.630 3.692 3.421 4.078 . 0 0 "[ . 1 . 2]" 1
1450 1 48 VAL HA 1 50 GLN QG . . 5.500 5.195 3.924 5.593 0.093 18 0 "[ . 1 . 2]" 1
1451 1 48 VAL HA 1 51 TYR H . . 5.420 3.098 2.805 3.327 . 0 0 "[ . 1 . 2]" 1
1452 1 48 VAL HA 1 51 TYR HA . . 5.500 5.389 5.036 5.590 0.090 17 0 "[ . 1 . 2]" 1
1453 1 48 VAL HA 1 51 TYR QD . . 3.740 3.473 2.872 3.806 0.066 18 0 "[ . 1 . 2]" 1
1454 1 48 VAL HA 1 51 TYR QE . . 4.090 3.340 2.875 4.095 0.005 13 0 "[ . 1 . 2]" 1
1455 1 48 VAL HA 1 52 SER HA . . 4.070 3.628 2.901 4.155 0.085 4 0 "[ . 1 . 2]" 1
1456 1 48 VAL HA 1 57 PHE QD . . 4.180 4.130 3.690 4.281 0.101 4 0 "[ . 1 . 2]" 1
1457 1 48 VAL HA 1 57 PHE QE . . 5.090 4.722 4.452 5.052 . 0 0 "[ . 1 . 2]" 1
1458 1 48 VAL HA 1 100 TYR QD . . 5.500 5.239 4.900 5.562 0.062 9 0 "[ . 1 . 2]" 1
1459 1 48 VAL HA 1 100 TYR QE . . 5.500 5.226 4.720 5.598 0.098 10 0 "[ . 1 . 2]" 1
1460 1 48 VAL HB 1 49 ASP HA . . 5.500 4.872 4.507 5.241 . 0 0 "[ . 1 . 2]" 1
1461 1 48 VAL HB 1 57 PHE QE . . 5.500 4.567 3.921 5.076 . 0 0 "[ . 1 . 2]" 1
1462 1 48 VAL HB 1 103 GLU HB2 . . 4.390 4.145 3.659 4.491 0.101 20 0 "[ . 1 . 2]" 1
1463 1 48 VAL HB 1 104 SER QB . . 5.500 5.011 4.527 5.322 . 0 0 "[ . 1 . 2]" 1
1464 1 48 VAL HB 1 107 TYR HB2 . . 5.500 4.143 3.255 4.963 . 0 0 "[ . 1 . 2]" 1
1465 1 48 VAL QG 1 49 ASP H . . 3.860 3.296 2.399 3.673 . 0 0 "[ . 1 . 2]" 1
1466 1 48 VAL QG 1 49 ASP HA . . 4.890 3.550 3.229 3.792 . 0 0 "[ . 1 . 2]" 1
1467 1 48 VAL QG 1 49 ASP HB2 . . 5.500 4.816 3.600 5.418 . 0 0 "[ . 1 . 2]" 1
1468 1 48 VAL QG 1 49 ASP HB3 . . 5.500 5.026 3.787 5.416 . 0 0 "[ . 1 . 2]" 1
1469 1 48 VAL QG 1 50 GLN H . . 5.500 4.397 4.258 4.649 . 0 0 "[ . 1 . 2]" 1
1470 1 48 VAL QG 1 51 TYR H . . 5.500 3.851 3.577 4.319 . 0 0 "[ . 1 . 2]" 1
1471 1 48 VAL QG 1 51 TYR QD . . 4.350 4.002 3.517 4.241 . 0 0 "[ . 1 . 2]" 1
1472 1 48 VAL QG 1 51 TYR QE . . 5.120 3.382 2.283 4.167 . 0 0 "[ . 1 . 2]" 1
1473 1 48 VAL QG 1 52 SER HA . . 5.110 2.352 1.899 2.880 . 0 0 "[ . 1 . 2]" 1
1474 1 48 VAL QG 1 52 SER HB2 . . 4.800 3.441 2.329 4.718 . 0 0 "[ . 1 . 2]" 1
1475 1 48 VAL QG 1 52 SER HB3 . . 4.960 3.500 2.102 4.761 . 0 0 "[ . 1 . 2]" 1
1476 1 48 VAL QG 1 57 PHE QD . . 3.910 2.426 2.093 2.926 . 0 0 "[ . 1 . 2]" 1
1477 1 48 VAL QG 1 57 PHE QE . . 3.560 2.396 2.109 2.869 . 0 0 "[ . 1 . 2]" 1
1478 1 48 VAL QG 1 100 TYR HA . . 4.320 3.370 3.030 3.678 . 0 0 "[ . 1 . 2]" 1
1479 1 48 VAL QG 1 100 TYR HB2 . . 5.500 4.457 4.025 4.804 . 0 0 "[ . 1 . 2]" 1
1480 1 48 VAL QG 1 100 TYR QD . . 3.300 2.521 2.122 2.772 . 0 0 "[ . 1 . 2]" 1
1481 1 48 VAL QG 1 100 TYR QE . . 3.050 2.748 2.423 3.027 . 0 0 "[ . 1 . 2]" 1
1482 1 48 VAL QG 1 103 GLU HA . . 5.110 4.054 3.394 4.310 . 0 0 "[ . 1 . 2]" 1
1483 1 48 VAL QG 1 103 GLU HB2 . . 4.000 2.831 2.194 3.471 . 0 0 "[ . 1 . 2]" 1
1484 1 48 VAL QG 1 103 GLU HB3 . . 4.100 2.187 1.869 2.616 . 0 0 "[ . 1 . 2]" 1
1485 1 48 VAL QG 1 103 GLU QG . . 4.950 3.276 2.735 4.003 . 0 0 "[ . 1 . 2]" 1
1486 1 48 VAL QG 1 104 SER H . . 4.020 2.994 2.561 3.807 . 0 0 "[ . 1 . 2]" 1
1487 1 48 VAL QG 1 104 SER HA . . 3.760 2.204 1.981 2.807 . 0 0 "[ . 1 . 2]" 1
1488 1 48 VAL QG 1 104 SER QB . . 4.660 3.007 2.527 3.392 . 0 0 "[ . 1 . 2]" 1
1489 1 48 VAL QG 1 107 TYR H . . 5.400 4.146 3.686 4.437 . 0 0 "[ . 1 . 2]" 1
1490 1 48 VAL QG 1 107 TYR HB2 . . 4.050 2.842 2.434 3.278 . 0 0 "[ . 1 . 2]" 1
1491 1 48 VAL QG 1 107 TYR HB3 . . 4.550 3.123 2.507 3.592 . 0 0 "[ . 1 . 2]" 1
1492 1 48 VAL QG 1 107 TYR QD . . 3.610 2.613 2.036 3.021 . 0 0 "[ . 1 . 2]" 1
1493 1 48 VAL QG 1 107 TYR QE . . 4.340 3.768 2.739 4.313 . 0 0 "[ . 1 . 2]" 1
1494 1 48 VAL QG 1 108 TYR H . . 5.500 5.473 5.234 5.630 0.130 8 0 "[ . 1 . 2]" 1
1495 1 49 ASP H 1 49 ASP HB2 . . 4.110 2.667 2.123 3.606 . 0 0 "[ . 1 . 2]" 1
1496 1 49 ASP H 1 49 ASP HB3 . . 3.730 2.750 2.153 3.638 . 0 0 "[ . 1 . 2]" 1
1497 1 49 ASP H 1 51 TYR H . . 5.500 4.312 4.183 4.449 . 0 0 "[ . 1 . 2]" 1
1498 1 49 ASP H 1 51 TYR QD . . 5.500 5.275 4.766 5.597 0.097 17 0 "[ . 1 . 2]" 1
1499 1 49 ASP H 1 107 TYR QE . . 5.040 3.192 2.801 3.512 . 0 0 "[ . 1 . 2]" 1
1500 1 49 ASP HA 1 51 TYR H . . 4.600 4.288 3.766 4.672 0.072 17 0 "[ . 1 . 2]" 1
1501 1 49 ASP HA 1 107 TYR QE . . 4.230 2.991 2.113 4.294 0.064 1 0 "[ . 1 . 2]" 1
1502 1 49 ASP HB2 1 50 GLN H . . 3.850 3.736 2.493 4.267 0.417 2 0 "[ . 1 . 2]" 1
1503 1 49 ASP HB2 1 107 TYR QE . . 3.990 2.995 2.174 4.116 0.126 11 0 "[ . 1 . 2]" 1
1504 1 49 ASP HB3 1 50 GLN H . . 4.520 3.236 2.416 4.119 . 0 0 "[ . 1 . 2]" 1
1505 1 49 ASP HB3 1 50 GLN QG . . 4.830 3.684 2.486 5.444 0.614 11 1 "[ . 1+ . 2]" 1
1506 1 49 ASP HB3 1 107 TYR QE . . 4.310 3.515 2.174 4.224 . 0 0 "[ . 1 . 2]" 1
1507 1 50 GLN H 1 50 GLN QB . . 3.550 2.414 2.214 2.728 . 0 0 "[ . 1 . 2]" 1
1508 1 50 GLN H 1 50 GLN HE21 . . 5.500 3.507 2.983 4.024 . 0 0 "[ . 1 . 2]" 1
1509 1 50 GLN H 1 50 GLN QG . . 3.720 2.285 1.892 2.617 . 0 0 "[ . 1 . 2]" 1
1510 1 50 GLN H 1 51 TYR H . . 3.610 2.519 2.078 2.796 . 0 0 "[ . 1 . 2]" 1
1511 1 50 GLN H 1 51 TYR QD . . 3.840 3.367 3.028 3.851 0.011 17 0 "[ . 1 . 2]" 1
1512 1 50 GLN H 1 51 TYR QE . . 4.740 4.469 4.161 4.805 0.065 13 0 "[ . 1 . 2]" 1
1513 1 50 GLN H 1 107 TYR QE . . 5.500 5.387 5.138 5.587 0.087 19 0 "[ . 1 . 2]" 1
1514 1 50 GLN HA 1 50 GLN HE21 . . 5.500 4.893 4.631 5.577 0.077 11 0 "[ . 1 . 2]" 1
1515 1 50 GLN HA 1 50 GLN QG . . 3.840 2.649 2.382 3.339 . 0 0 "[ . 1 . 2]" 1
1516 1 50 GLN HA 1 51 TYR QD . . 5.030 4.568 4.262 5.073 0.043 8 0 "[ . 1 . 2]" 1
1517 1 50 GLN QB 1 51 TYR H . . 5.500 3.231 2.837 3.943 . 0 0 "[ . 1 . 2]" 1
1518 1 50 GLN QB 1 51 TYR QD . . 4.120 2.447 1.991 3.885 . 0 0 "[ . 1 . 2]" 1
1519 1 50 GLN QB 1 51 TYR QE . . 5.500 3.964 3.275 5.139 . 0 0 "[ . 1 . 2]" 1
1520 1 50 GLN HE21 1 51 TYR H . . 5.030 4.986 4.523 5.119 0.089 17 0 "[ . 1 . 2]" 1
1521 1 50 GLN HE21 1 51 TYR QD . . 4.680 3.387 2.633 4.383 . 0 0 "[ . 1 . 2]" 1
1522 1 50 GLN HE21 1 51 TYR QE . . 4.500 3.480 2.609 4.424 . 0 0 "[ . 1 . 2]" 1
1523 1 50 GLN HE22 1 51 TYR QD . . 4.910 4.668 3.813 5.004 0.094 6 0 "[ . 1 . 2]" 1
1524 1 50 GLN QG 1 51 TYR QD . . 4.700 3.683 1.852 4.318 . 0 0 "[ . 1 . 2]" 1
1525 1 50 GLN QG 1 51 TYR QE . . 5.060 4.669 2.880 5.161 0.101 10 0 "[ . 1 . 2]" 1
1526 1 51 TYR H 1 51 TYR HB3 . . 3.770 3.407 3.243 3.604 . 0 0 "[ . 1 . 2]" 1
1527 1 51 TYR H 1 51 TYR QD . . 3.500 2.718 2.222 3.219 . 0 0 "[ . 1 . 2]" 1
1528 1 51 TYR H 1 51 TYR QE . . 5.500 4.397 3.871 4.736 . 0 0 "[ . 1 . 2]" 1
1529 1 51 TYR H 1 52 SER H . . 5.500 3.546 1.938 4.410 . 0 0 "[ . 1 . 2]" 1
1530 1 51 TYR HA 1 51 TYR QD . . 4.170 3.750 3.707 3.799 . 0 0 "[ . 1 . 2]" 1
1531 1 51 TYR HB2 1 52 SER HA . . 5.500 4.890 4.270 5.554 0.054 19 0 "[ . 1 . 2]" 1
1532 1 51 TYR HB2 1 53 ASN H . . 4.800 3.746 2.857 4.433 . 0 0 "[ . 1 . 2]" 1
1533 1 51 TYR HB3 1 53 ASN H . . 5.500 5.090 4.443 5.568 0.068 9 0 "[ . 1 . 2]" 1
1534 1 51 TYR QD 1 52 SER H . . 5.130 3.143 2.337 3.752 . 0 0 "[ . 1 . 2]" 1
1535 1 51 TYR QD 1 52 SER HA . . 4.700 3.939 3.101 4.486 . 0 0 "[ . 1 . 2]" 1
1536 1 51 TYR QD 1 53 ASN QB . . 3.370 2.553 2.106 3.364 . 0 0 "[ . 1 . 2]" 1
1537 1 51 TYR QD 1 56 ASN H . . 5.080 4.761 4.119 5.168 0.088 10 0 "[ . 1 . 2]" 1
1538 1 51 TYR QD 1 56 ASN HB2 . . 3.450 3.011 2.330 3.837 0.387 6 0 "[ . 1 . 2]" 1
1539 1 51 TYR QD 1 56 ASN HB3 . . 4.300 3.740 2.791 4.225 . 0 0 "[ . 1 . 2]" 1
1540 1 51 TYR QE 1 52 SER HA . . 4.760 4.434 3.347 4.853 0.093 17 0 "[ . 1 . 2]" 1
1541 1 51 TYR QE 1 53 ASN HA . . 4.820 4.919 4.901 4.932 0.112 17 0 "[ . 1 . 2]" 1
1542 1 51 TYR QE 1 53 ASN QB . . 5.500 3.202 2.230 4.802 . 0 0 "[ . 1 . 2]" 1
1543 1 51 TYR QE 1 56 ASN HB2 . . 3.650 3.214 2.224 3.974 0.324 6 0 "[ . 1 . 2]" 1
1544 1 51 TYR QE 1 56 ASN HB3 . . 5.500 3.669 2.403 4.662 . 0 0 "[ . 1 . 2]" 1
1545 1 51 TYR QE 1 57 PHE QD . . 3.270 3.068 2.436 3.361 0.091 1 0 "[ . 1 . 2]" 1
1546 1 51 TYR QE 1 57 PHE QE . . 4.380 4.492 4.451 4.508 0.128 5 0 "[ . 1 . 2]" 1
1547 1 52 SER H 1 53 ASN H . . 5.500 3.035 1.807 3.858 . 0 0 "[ . 1 . 2]" 1
1548 1 52 SER HA 1 53 ASN QB . . 5.210 4.836 4.526 5.020 . 0 0 "[ . 1 . 2]" 1
1549 1 52 SER HB2 1 100 TYR QE . . 5.500 5.076 4.074 5.594 0.094 18 0 "[ . 1 . 2]" 1
1550 1 52 SER HB3 1 53 ASN H . . 5.500 4.438 3.879 4.696 . 0 0 "[ . 1 . 2]" 1
1551 1 52 SER HB3 1 100 TYR QE . . 5.500 4.949 4.134 5.597 0.097 8 0 "[ . 1 . 2]" 1
1552 1 53 ASN H 1 54 GLN H . . 5.500 4.462 4.156 4.737 . 0 0 "[ . 1 . 2]" 1
1553 1 53 ASN H 1 56 ASN H . . 5.450 5.153 4.735 5.509 0.059 2 0 "[ . 1 . 2]" 1
1554 1 53 ASN H 1 56 ASN HB2 . . 5.010 4.245 3.589 5.078 0.068 11 0 "[ . 1 . 2]" 1
1555 1 53 ASN H 1 56 ASN HB3 . . 5.500 5.394 3.881 5.598 0.098 7 0 "[ . 1 . 2]" 1
1556 1 53 ASN HA 1 54 GLN H . . 3.060 2.345 2.055 2.607 . 0 0 "[ . 1 . 2]" 1
1557 1 53 ASN HA 1 54 GLN HA . . 5.500 4.445 4.339 4.562 . 0 0 "[ . 1 . 2]" 1
1558 1 53 ASN HA 1 54 GLN QB . . 5.500 4.220 3.995 4.411 . 0 0 "[ . 1 . 2]" 1
1559 1 53 ASN HA 1 55 ASN H . . 4.450 4.228 3.899 4.518 0.068 20 0 "[ . 1 . 2]" 1
1560 1 53 ASN HA 1 100 TYR QE . . 4.310 4.187 3.402 4.414 0.104 10 0 "[ . 1 . 2]" 1
1561 1 53 ASN QB 1 54 GLN H . . 3.390 2.545 1.991 2.845 . 0 0 "[ . 1 . 2]" 1
1562 1 53 ASN QB 1 54 GLN QB . . 4.790 4.242 3.994 4.357 . 0 0 "[ . 1 . 2]" 1
1563 1 53 ASN QB 1 55 ASN H . . 4.040 2.817 2.172 3.184 . 0 0 "[ . 1 . 2]" 1
1564 1 53 ASN QB 1 56 ASN H . . 3.670 2.379 1.894 3.468 . 0 0 "[ . 1 . 2]" 1
1565 1 53 ASN QD 1 54 GLN H . . 5.500 4.076 3.267 4.753 . 0 0 "[ . 1 . 2]" 1
1566 1 53 ASN QD 1 55 ASN H . . 5.500 4.018 3.166 4.833 . 0 0 "[ . 1 . 2]" 1
1567 1 53 ASN QD 1 55 ASN QB . . 5.450 3.628 2.304 4.391 . 0 0 "[ . 1 . 2]" 1
1568 1 53 ASN QD 1 56 ASN H . . 5.420 3.199 1.665 4.092 . 0 0 "[ . 1 . 2]" 1
1569 1 53 ASN QD 1 56 ASN HD21 . . 4.340 3.200 2.079 3.951 . 0 0 "[ . 1 . 2]" 1
1570 1 53 ASN QD 1 56 ASN HD22 . . 4.150 3.423 2.440 4.100 . 0 0 "[ . 1 . 2]" 1
1571 1 54 GLN H 1 54 GLN QB . . 3.300 2.385 2.253 2.505 . 0 0 "[ . 1 . 2]" 1
1572 1 54 GLN H 1 54 GLN HG2 . . 4.360 4.428 4.377 4.450 0.090 14 0 "[ . 1 . 2]" 1
1573 1 54 GLN H 1 54 GLN HG3 . . 5.000 4.539 4.430 4.686 . 0 0 "[ . 1 . 2]" 1
1574 1 54 GLN H 1 55 ASN H . . 3.420 2.294 1.738 2.574 . 0 0 "[ . 1 . 2]" 1
1575 1 54 GLN H 1 55 ASN HA . . 5.500 4.904 4.374 5.168 . 0 0 "[ . 1 . 2]" 1
1576 1 54 GLN H 1 55 ASN QB . . 5.420 4.169 3.497 4.617 . 0 0 "[ . 1 . 2]" 1
1577 1 54 GLN H 1 56 ASN HB2 . . 5.500 5.435 5.142 5.594 0.094 11 0 "[ . 1 . 2]" 1
1578 1 54 GLN H 1 100 TYR QE . . 4.590 4.184 3.725 4.596 0.006 7 0 "[ . 1 . 2]" 1
1579 1 54 GLN HA 1 58 VAL H . . 4.870 3.873 3.488 4.374 . 0 0 "[ . 1 . 2]" 1
1580 1 54 GLN HA 1 58 VAL MG2 . . 5.370 3.517 3.166 3.787 . 0 0 "[ . 1 . 2]" 1
1581 1 54 GLN HA 1 100 TYR QD . . 4.610 3.428 3.112 3.877 . 0 0 "[ . 1 . 2]" 1
1582 1 54 GLN HA 1 100 TYR QE . . 3.960 3.326 3.063 3.739 . 0 0 "[ . 1 . 2]" 1
1583 1 54 GLN QB 1 55 ASN H . . 3.530 2.549 2.246 2.911 . 0 0 "[ . 1 . 2]" 1
1584 1 54 GLN QB 1 55 ASN HA . . 5.280 4.049 3.872 4.164 . 0 0 "[ . 1 . 2]" 1
1585 1 54 GLN QB 1 58 VAL MG2 . . 4.600 4.086 3.704 4.232 . 0 0 "[ . 1 . 2]" 1
1586 1 54 GLN QB 1 100 TYR QE . . 3.620 2.439 2.119 2.687 . 0 0 "[ . 1 . 2]" 1
1587 1 54 GLN HE21 1 55 ASN HA . . 5.500 5.242 4.816 5.594 0.094 15 0 "[ . 1 . 2]" 1
1588 1 54 GLN HE21 1 58 VAL MG2 . . 4.470 3.186 2.325 3.769 . 0 0 "[ . 1 . 2]" 1
1589 1 54 GLN HE21 1 97 VAL HA . . 5.500 4.782 2.676 5.583 0.083 9 0 "[ . 1 . 2]" 1
1590 1 54 GLN HE21 1 97 VAL QG . . 4.430 3.163 1.976 4.109 . 0 0 "[ . 1 . 2]" 1
1591 1 54 GLN HE21 1 100 TYR QD . . 5.500 4.786 2.912 5.503 0.003 13 0 "[ . 1 . 2]" 1
1592 1 54 GLN HE21 1 100 TYR QE . . 5.500 5.222 4.065 5.592 0.092 14 0 "[ . 1 . 2]" 1
1593 1 54 GLN HE22 1 58 VAL MG2 . . 5.500 4.392 3.899 4.952 . 0 0 "[ . 1 . 2]" 1
1594 1 54 GLN HE22 1 97 VAL HA . . 5.500 5.163 3.537 5.569 0.069 2 0 "[ . 1 . 2]" 1
1595 1 54 GLN HE22 1 97 VAL QG . . 4.440 3.161 2.001 3.800 . 0 0 "[ . 1 . 2]" 1
1596 1 54 GLN HE22 1 100 TYR QD . . 5.500 4.825 3.277 5.564 0.064 1 0 "[ . 1 . 2]" 1
1597 1 54 GLN HE22 1 100 TYR QE . . 5.500 4.981 3.815 5.565 0.065 1 0 "[ . 1 . 2]" 1
1598 1 54 GLN HG2 1 55 ASN H . . 4.580 3.738 3.418 4.215 . 0 0 "[ . 1 . 2]" 1
1599 1 54 GLN HG2 1 55 ASN HA . . 4.680 3.566 3.026 3.974 . 0 0 "[ . 1 . 2]" 1
1600 1 54 GLN HG2 1 58 VAL MG2 . . 4.030 2.643 2.151 3.109 . 0 0 "[ . 1 . 2]" 1
1601 1 54 GLN HG2 1 100 TYR QD . . 4.710 4.487 4.136 4.796 0.086 6 0 "[ . 1 . 2]" 1
1602 1 54 GLN HG2 1 100 TYR QE . . 5.500 4.655 4.369 5.111 . 0 0 "[ . 1 . 2]" 1
1603 1 54 GLN HG3 1 55 ASN H . . 5.170 4.629 4.052 4.956 . 0 0 "[ . 1 . 2]" 1
1604 1 54 GLN HG3 1 55 ASN HA . . 5.500 4.892 3.850 5.367 . 0 0 "[ . 1 . 2]" 1
1605 1 54 GLN HG3 1 58 VAL H . . 4.770 4.250 3.691 4.818 0.048 20 0 "[ . 1 . 2]" 1
1606 1 54 GLN HG3 1 58 VAL MG2 . . 3.360 2.651 2.179 3.031 . 0 0 "[ . 1 . 2]" 1
1607 1 54 GLN HG3 1 100 TYR HB2 . . 5.500 4.157 3.659 4.742 . 0 0 "[ . 1 . 2]" 1
1608 1 54 GLN HG3 1 100 TYR HB3 . . 5.500 3.877 3.269 4.516 . 0 0 "[ . 1 . 2]" 1
1609 1 54 GLN HG3 1 100 TYR QD . . 4.400 2.891 2.554 3.396 . 0 0 "[ . 1 . 2]" 1
1610 1 54 GLN HG3 1 100 TYR QE . . 4.180 3.470 2.890 4.085 . 0 0 "[ . 1 . 2]" 1
1611 1 55 ASN H 1 55 ASN QB . . 3.070 2.259 2.121 2.431 . 0 0 "[ . 1 . 2]" 1
1612 1 55 ASN H 1 55 ASN HD21 . . 4.960 4.818 4.538 5.030 0.070 15 0 "[ . 1 . 2]" 1
1613 1 55 ASN H 1 55 ASN HD22 . . 5.500 5.109 4.753 5.414 . 0 0 "[ . 1 . 2]" 1
1614 1 55 ASN H 1 56 ASN H . . 3.290 2.940 2.747 3.135 . 0 0 "[ . 1 . 2]" 1
1615 1 55 ASN H 1 56 ASN HB2 . . 5.500 5.083 4.736 5.397 . 0 0 "[ . 1 . 2]" 1
1616 1 55 ASN H 1 58 VAL H . . 5.500 4.862 4.626 5.063 . 0 0 "[ . 1 . 2]" 1
1617 1 55 ASN H 1 58 VAL MG2 . . 5.500 4.952 4.740 5.144 . 0 0 "[ . 1 . 2]" 1
1618 1 55 ASN HA 1 55 ASN HD22 . . 5.500 3.560 3.312 5.062 . 0 0 "[ . 1 . 2]" 1
1619 1 55 ASN HA 1 58 VAL H . . 4.270 3.578 3.028 3.912 . 0 0 "[ . 1 . 2]" 1
1620 1 55 ASN HA 1 58 VAL HB . . 3.470 3.099 2.375 3.550 0.080 11 0 "[ . 1 . 2]" 1
1621 1 55 ASN HA 1 58 VAL MG2 . . 4.310 3.856 3.237 4.316 0.006 11 0 "[ . 1 . 2]" 1
1622 1 55 ASN QB 1 56 ASN H . . 3.580 2.713 2.319 3.282 . 0 0 "[ . 1 . 2]" 1
1623 1 55 ASN QB 1 56 ASN HA . . 5.490 3.921 3.665 4.460 . 0 0 "[ . 1 . 2]" 1
1624 1 55 ASN QB 1 59 HIS HE1 . . 4.750 4.184 3.114 4.690 . 0 0 "[ . 1 . 2]" 1
1625 1 55 ASN HD21 1 59 HIS HB3 . . 5.500 5.545 5.043 5.588 0.088 14 0 "[ . 1 . 2]" 1
1626 1 55 ASN HD21 1 59 HIS HD2 . . 3.450 3.151 2.225 3.529 0.079 8 0 "[ . 1 . 2]" 1
1627 1 56 ASN H 1 56 ASN HB2 . . 3.220 2.441 2.146 2.679 . 0 0 "[ . 1 . 2]" 1
1628 1 56 ASN H 1 56 ASN HB3 . . 3.920 3.573 2.991 3.715 . 0 0 "[ . 1 . 2]" 1
1629 1 56 ASN H 1 56 ASN HD21 . . 4.870 3.568 2.309 4.483 . 0 0 "[ . 1 . 2]" 1
1630 1 56 ASN H 1 56 ASN HD22 . . 5.470 4.372 3.674 5.268 . 0 0 "[ . 1 . 2]" 1
1631 1 56 ASN H 1 57 PHE H . . 3.720 2.726 2.511 2.999 . 0 0 "[ . 1 . 2]" 1
1632 1 56 ASN H 1 58 VAL H . . 5.070 4.607 4.065 4.960 . 0 0 "[ . 1 . 2]" 1
1633 1 56 ASN HA 1 56 ASN HD22 . . 5.270 4.340 3.513 4.820 . 0 0 "[ . 1 . 2]" 1
1634 1 56 ASN HA 1 58 VAL H . . 5.500 4.942 4.549 5.273 . 0 0 "[ . 1 . 2]" 1
1635 1 56 ASN HA 1 59 HIS H . . 4.250 3.762 3.469 4.256 0.006 2 0 "[ . 1 . 2]" 1
1636 1 56 ASN HA 1 59 HIS HB2 . . 3.680 2.895 2.399 3.756 0.076 12 0 "[ . 1 . 2]" 1
1637 1 56 ASN HB2 1 57 PHE H . . 5.500 3.086 2.293 3.751 . 0 0 "[ . 1 . 2]" 1
1638 1 57 PHE H 1 58 VAL H . . 3.990 2.753 2.227 3.251 . 0 0 "[ . 1 . 2]" 1
1639 1 57 PHE QD 1 58 VAL H . . 3.890 3.216 3.018 3.398 . 0 0 "[ . 1 . 2]" 1
1640 1 57 PHE QD 1 58 VAL HA . . 3.680 2.779 2.594 3.039 . 0 0 "[ . 1 . 2]" 1
1641 1 57 PHE QD 1 58 VAL MG1 . . 5.500 4.528 4.297 4.848 . 0 0 "[ . 1 . 2]" 1
1642 1 57 PHE QD 1 58 VAL MG2 . . 3.340 2.928 2.718 3.062 . 0 0 "[ . 1 . 2]" 1
1643 1 57 PHE QD 1 61 CYS HB2 . . 5.500 3.172 2.297 3.897 . 0 0 "[ . 1 . 2]" 1
1644 1 57 PHE QD 1 61 CYS HB3 . . 5.500 3.532 2.364 4.796 . 0 0 "[ . 1 . 2]" 1
1645 1 57 PHE QD 1 96 CYS HA . . 5.500 4.775 4.045 5.169 . 0 0 "[ . 1 . 2]" 1
1646 1 57 PHE QD 1 96 CYS HB3 . . 5.500 4.067 2.566 4.979 . 0 0 "[ . 1 . 2]" 1
1647 1 57 PHE QD 1 100 TYR H . . 4.720 4.303 3.892 4.549 . 0 0 "[ . 1 . 2]" 1
1648 1 57 PHE QD 1 100 TYR HA . . 5.500 3.629 3.226 4.033 . 0 0 "[ . 1 . 2]" 1
1649 1 57 PHE QD 1 100 TYR HB2 . . 4.530 2.931 2.740 3.112 . 0 0 "[ . 1 . 2]" 1
1650 1 57 PHE QD 1 100 TYR HB3 . . 5.340 4.230 3.856 4.417 . 0 0 "[ . 1 . 2]" 1
1651 1 57 PHE QD 1 100 TYR QD . . 3.870 2.571 2.061 2.860 . 0 0 "[ . 1 . 2]" 1
1652 1 57 PHE QD 1 100 TYR QE . . 4.920 4.072 3.668 4.446 . 0 0 "[ . 1 . 2]" 1
1653 1 57 PHE QE 1 58 VAL HA . . 4.720 4.496 4.073 4.736 0.016 11 0 "[ . 1 . 2]" 1
1654 1 57 PHE QE 1 58 VAL MG2 . . 4.210 4.324 4.275 4.346 0.136 15 0 "[ . 1 . 2]" 1
1655 1 57 PHE QE 1 61 CYS HA . . 4.610 4.707 4.689 4.730 0.120 13 0 "[ . 1 . 2]" 1
1656 1 57 PHE QE 1 61 CYS HB3 . . 5.500 3.982 2.881 4.819 . 0 0 "[ . 1 . 2]" 1
1657 1 57 PHE QE 1 96 CYS HA . . 4.390 3.318 2.617 3.822 . 0 0 "[ . 1 . 2]" 1
1658 1 57 PHE QE 1 96 CYS HB2 . . 4.980 4.454 4.147 4.968 . 0 0 "[ . 1 . 2]" 1
1659 1 57 PHE QE 1 96 CYS HB3 . . 5.310 4.082 2.535 4.977 . 0 0 "[ . 1 . 2]" 1
1660 1 57 PHE QE 1 99 GLN HB2 . . 4.690 3.237 2.311 4.287 . 0 0 "[ . 1 . 2]" 1
1661 1 57 PHE QE 1 99 GLN HB3 . . 4.080 2.917 2.366 3.389 . 0 0 "[ . 1 . 2]" 1
1662 1 57 PHE QE 1 99 GLN HG3 . . 5.310 4.046 3.713 4.505 . 0 0 "[ . 1 . 2]" 1
1663 1 57 PHE QE 1 100 TYR H . . 3.870 3.349 3.028 3.777 . 0 0 "[ . 1 . 2]" 1
1664 1 57 PHE QE 1 100 TYR HA . . 5.010 2.981 2.485 3.489 . 0 0 "[ . 1 . 2]" 1
1665 1 57 PHE QE 1 100 TYR HB2 . . 3.790 3.369 3.016 3.602 . 0 0 "[ . 1 . 2]" 1
1666 1 57 PHE QE 1 100 TYR HB3 . . 4.460 4.424 4.187 4.555 0.095 8 0 "[ . 1 . 2]" 1
1667 1 57 PHE QE 1 100 TYR QD . . 4.510 3.532 3.167 3.865 . 0 0 "[ . 1 . 2]" 1
1668 1 57 PHE QE 1 103 GLU HB2 . . 4.530 3.113 2.445 3.728 . 0 0 "[ . 1 . 2]" 1
1669 1 57 PHE QE 1 103 GLU HB3 . . 5.280 3.552 2.886 4.099 . 0 0 "[ . 1 . 2]" 1
1670 1 57 PHE QE 1 103 GLU QG . . 5.360 2.832 2.273 3.533 . 0 0 "[ . 1 . 2]" 1
1671 1 57 PHE HZ 1 99 GLN HA . . 5.310 4.596 4.126 4.973 . 0 0 "[ . 1 . 2]" 1
1672 1 57 PHE HZ 1 99 GLN HB2 . . 4.610 3.733 2.735 4.691 0.081 13 0 "[ . 1 . 2]" 1
1673 1 57 PHE HZ 1 99 GLN HB3 . . 4.140 2.443 2.021 3.039 . 0 0 "[ . 1 . 2]" 1
1674 1 57 PHE HZ 1 99 GLN HG3 . . 3.710 3.695 2.981 3.800 0.090 1 0 "[ . 1 . 2]" 1
1675 1 57 PHE HZ 1 100 TYR H . . 4.390 3.765 3.552 3.951 . 0 0 "[ . 1 . 2]" 1
1676 1 57 PHE HZ 1 100 TYR HA . . 5.300 3.292 2.965 3.599 . 0 0 "[ . 1 . 2]" 1
1677 1 57 PHE HZ 1 103 GLU HB2 . . 4.060 3.946 3.628 4.139 0.079 14 0 "[ . 1 . 2]" 1
1678 1 57 PHE HZ 1 103 GLU QG . . 4.710 3.310 2.850 3.898 . 0 0 "[ . 1 . 2]" 1
1679 1 58 VAL H 1 58 VAL HB . . 3.240 2.477 2.157 2.632 . 0 0 "[ . 1 . 2]" 1
1680 1 58 VAL H 1 58 VAL MG1 . . 4.430 3.768 3.650 3.816 . 0 0 "[ . 1 . 2]" 1
1681 1 58 VAL H 1 58 VAL MG2 . . 3.470 2.107 2.005 2.380 . 0 0 "[ . 1 . 2]" 1
1682 1 58 VAL H 1 59 HIS H . . 3.580 2.853 2.714 3.053 . 0 0 "[ . 1 . 2]" 1
1683 1 58 VAL H 1 59 HIS HB2 . . 5.500 4.995 4.818 5.274 . 0 0 "[ . 1 . 2]" 1
1684 1 58 VAL H 1 60 ASP H . . 5.160 4.281 3.865 4.620 . 0 0 "[ . 1 . 2]" 1
1685 1 58 VAL H 1 100 TYR QD . . 5.500 5.476 5.217 5.588 0.088 10 0 "[ . 1 . 2]" 1
1686 1 58 VAL HA 1 58 VAL MG1 . . 3.670 2.446 2.333 2.769 . 0 0 "[ . 1 . 2]" 1
1687 1 58 VAL HA 1 58 VAL MG2 . . 3.390 2.304 2.193 2.386 . 0 0 "[ . 1 . 2]" 1
1688 1 58 VAL HA 1 61 CYS H . . 4.140 3.410 3.114 3.624 . 0 0 "[ . 1 . 2]" 1
1689 1 58 VAL HA 1 61 CYS HA . . 5.350 4.865 4.644 5.110 . 0 0 "[ . 1 . 2]" 1
1690 1 58 VAL HA 1 61 CYS HB2 . . 3.930 2.888 1.917 4.021 0.091 20 0 "[ . 1 . 2]" 1
1691 1 58 VAL HA 1 61 CYS HB3 . . 3.690 2.701 1.952 3.616 . 0 0 "[ . 1 . 2]" 1
1692 1 58 VAL HA 1 62 VAL H . . 4.500 3.668 3.213 3.958 . 0 0 "[ . 1 . 2]" 1
1693 1 58 VAL HA 1 93 GLU HA . . 4.990 4.754 4.382 4.955 . 0 0 "[ . 1 . 2]" 1
1694 1 58 VAL HA 1 96 CYS HB3 . . 3.820 3.464 2.383 3.914 0.094 8 0 "[ . 1 . 2]" 1
1695 1 58 VAL HB 1 59 HIS H . . 3.510 2.926 2.705 3.126 . 0 0 "[ . 1 . 2]" 1
1696 1 58 VAL HB 1 59 HIS HD2 . . 4.760 2.880 2.482 3.155 . 0 0 "[ . 1 . 2]" 1
1697 1 58 VAL HB 1 60 ASP H . . 5.330 5.140 4.869 5.393 0.063 7 0 "[ . 1 . 2]" 1
1698 1 58 VAL MG1 1 59 HIS H . . 4.260 3.605 3.174 3.870 . 0 0 "[ . 1 . 2]" 1
1699 1 58 VAL MG1 1 59 HIS HA . . 4.490 3.576 3.086 3.913 . 0 0 "[ . 1 . 2]" 1
1700 1 58 VAL MG1 1 59 HIS HB2 . . 5.500 5.271 4.786 5.570 0.070 11 0 "[ . 1 . 2]" 1
1701 1 58 VAL MG1 1 59 HIS HD2 . . 4.080 3.042 2.214 4.071 . 0 0 "[ . 1 . 2]" 1
1702 1 58 VAL MG1 1 61 CYS HB2 . . 5.500 4.395 3.179 5.444 . 0 0 "[ . 1 . 2]" 1
1703 1 58 VAL MG1 1 62 VAL H . . 4.660 3.838 3.563 4.035 . 0 0 "[ . 1 . 2]" 1
1704 1 58 VAL MG1 1 62 VAL MG2 . . 2.610 2.471 2.118 2.670 0.060 19 0 "[ . 1 . 2]" 1
1705 1 58 VAL MG1 1 63 ASN H . . 5.500 5.545 5.161 5.607 0.107 9 0 "[ . 1 . 2]" 1
1706 1 58 VAL MG1 1 93 GLU HA . . 3.800 2.835 2.479 3.689 . 0 0 "[ . 1 . 2]" 1
1707 1 58 VAL MG1 1 93 GLU HB3 . . 4.820 4.469 4.141 4.843 0.023 7 0 "[ . 1 . 2]" 1
1708 1 58 VAL MG1 1 93 GLU HG2 . . 3.980 3.066 2.277 3.584 . 0 0 "[ . 1 . 2]" 1
1709 1 58 VAL MG1 1 93 GLU HG3 . . 3.880 2.410 1.995 3.508 . 0 0 "[ . 1 . 2]" 1
1710 1 58 VAL MG1 1 96 CYS HB2 . . 4.280 3.660 2.392 4.353 0.073 13 0 "[ . 1 . 2]" 1
1711 1 58 VAL MG1 1 96 CYS HB3 . . 4.100 3.218 2.678 4.158 0.058 7 0 "[ . 1 . 2]" 1
1712 1 58 VAL MG2 1 59 HIS HD2 . . 4.530 4.485 4.143 4.639 0.109 11 0 "[ . 1 . 2]" 1
1713 1 58 VAL MG2 1 61 CYS H . . 5.500 5.066 4.841 5.283 . 0 0 "[ . 1 . 2]" 1
1714 1 58 VAL MG2 1 61 CYS HB2 . . 5.070 4.327 3.670 5.108 0.038 20 0 "[ . 1 . 2]" 1
1715 1 58 VAL MG2 1 61 CYS HB3 . . 5.500 4.151 3.543 4.754 . 0 0 "[ . 1 . 2]" 1
1716 1 58 VAL MG2 1 62 VAL H . . 5.500 5.258 4.896 5.509 0.009 2 0 "[ . 1 . 2]" 1
1717 1 58 VAL MG2 1 96 CYS HA . . 5.090 4.714 4.193 5.156 0.066 6 0 "[ . 1 . 2]" 1
1718 1 58 VAL MG2 1 96 CYS HB2 . . 5.500 3.779 2.580 4.521 . 0 0 "[ . 1 . 2]" 1
1719 1 58 VAL MG2 1 96 CYS HB3 . . 4.120 2.967 2.239 3.500 . 0 0 "[ . 1 . 2]" 1
1720 1 58 VAL MG2 1 97 VAL H . . 4.240 3.832 3.293 4.286 0.046 10 0 "[ . 1 . 2]" 1
1721 1 58 VAL MG2 1 97 VAL QG . . 4.120 2.749 2.178 3.312 . 0 0 "[ . 1 . 2]" 1
1722 1 58 VAL MG2 1 100 TYR H . . 5.480 4.645 4.283 5.141 . 0 0 "[ . 1 . 2]" 1
1723 1 58 VAL MG2 1 100 TYR HB2 . . 4.940 3.593 3.205 4.026 . 0 0 "[ . 1 . 2]" 1
1724 1 58 VAL MG2 1 100 TYR HB3 . . 5.150 3.809 3.334 4.295 . 0 0 "[ . 1 . 2]" 1
1725 1 58 VAL MG2 1 100 TYR QD . . 4.180 4.128 3.860 4.292 0.112 6 0 "[ . 1 . 2]" 1
1726 1 59 HIS H 1 59 HIS HB2 . . 3.070 2.375 2.241 2.483 . 0 0 "[ . 1 . 2]" 1
1727 1 59 HIS H 1 59 HIS HB3 . . 3.530 3.556 3.481 3.592 0.062 12 0 "[ . 1 . 2]" 1
1728 1 59 HIS H 1 59 HIS HD2 . . 4.340 2.549 2.334 2.890 . 0 0 "[ . 1 . 2]" 1
1729 1 59 HIS H 1 60 ASP H . . 3.600 2.705 2.556 2.806 . 0 0 "[ . 1 . 2]" 1
1730 1 59 HIS H 1 62 VAL H . . 5.500 4.900 4.632 5.116 . 0 0 "[ . 1 . 2]" 1
1731 1 59 HIS HA 1 59 HIS HD2 . . 3.770 2.877 2.493 3.731 . 0 0 "[ . 1 . 2]" 1
1732 1 59 HIS HA 1 60 ASP HA . . 4.650 4.641 4.445 4.718 0.068 13 0 "[ . 1 . 2]" 1
1733 1 59 HIS HA 1 62 VAL H . . 4.320 3.931 3.587 4.188 . 0 0 "[ . 1 . 2]" 1
1734 1 59 HIS HA 1 62 VAL HB . . 3.640 3.382 2.790 3.708 0.068 19 0 "[ . 1 . 2]" 1
1735 1 59 HIS HA 1 62 VAL MG2 . . 4.370 4.019 3.552 4.440 0.070 16 0 "[ . 1 . 2]" 1
1736 1 59 HIS HA 1 63 ASN H . . 4.680 4.026 3.645 4.462 . 0 0 "[ . 1 . 2]" 1
1737 1 59 HIS HB2 1 59 HIS HD2 . . 3.590 3.450 2.952 3.663 0.073 2 0 "[ . 1 . 2]" 1
1738 1 59 HIS HB2 1 60 ASP H . . 3.650 3.177 2.793 3.515 . 0 0 "[ . 1 . 2]" 1
1739 1 59 HIS HB2 1 60 ASP HA . . 5.500 4.831 4.482 5.099 . 0 0 "[ . 1 . 2]" 1
1740 1 59 HIS HB3 1 60 ASP H . . 4.040 3.937 3.480 4.121 0.081 16 0 "[ . 1 . 2]" 1
1741 1 60 ASP H 1 60 ASP HB2 . . 3.240 2.612 2.161 3.769 0.529 7 2 "[ . + 1- . 2]" 1
1742 1 60 ASP H 1 60 ASP HB3 . . 3.760 3.189 2.499 3.566 . 0 0 "[ . 1 . 2]" 1
1743 1 60 ASP H 1 61 CYS H . . 3.560 2.257 2.026 2.356 . 0 0 "[ . 1 . 2]" 1
1744 1 60 ASP H 1 61 CYS HA . . 4.870 4.881 4.691 4.951 0.081 15 0 "[ . 1 . 2]" 1
1745 1 60 ASP H 1 62 VAL H . . 4.930 3.856 3.570 4.115 . 0 0 "[ . 1 . 2]" 1
1746 1 60 ASP H 1 62 VAL HB . . 5.500 5.184 4.666 5.559 0.059 9 0 "[ . 1 . 2]" 1
1747 1 60 ASP H 1 63 ASN HB3 . . 5.500 5.298 4.677 5.554 0.054 5 0 "[ . 1 . 2]" 1
1748 1 60 ASP H 1 64 ILE H . . 5.500 5.541 5.376 5.591 0.091 14 0 "[ . 1 . 2]" 1
1749 1 60 ASP HA 1 62 VAL H . . 4.290 4.347 4.120 4.376 0.086 13 0 "[ . 1 . 2]" 1
1750 1 60 ASP HA 1 63 ASN H . . 3.890 3.698 3.032 3.945 0.055 2 0 "[ . 1 . 2]" 1
1751 1 60 ASP HA 1 63 ASN HB2 . . 3.820 3.784 3.406 3.896 0.076 16 0 "[ . 1 . 2]" 1
1752 1 60 ASP HA 1 63 ASN HB3 . . 3.730 2.719 2.126 2.991 . 0 0 "[ . 1 . 2]" 1
1753 1 60 ASP HA 1 63 ASN HD21 . . 5.500 4.854 3.824 5.593 0.093 15 0 "[ . 1 . 2]" 1
1754 1 60 ASP HA 1 64 ILE H . . 4.700 3.396 3.154 3.745 . 0 0 "[ . 1 . 2]" 1
1755 1 60 ASP HA 1 64 ILE MD . . 5.500 4.041 3.714 4.494 . 0 0 "[ . 1 . 2]" 1
1756 1 60 ASP HA 1 64 ILE QG . . 5.500 2.800 2.516 3.357 . 0 0 "[ . 1 . 2]" 1
1757 1 60 ASP HB2 1 61 CYS H . . 3.980 3.187 2.605 4.168 0.188 7 0 "[ . 1 . 2]" 1
1758 1 60 ASP HB2 1 64 ILE MD . . 5.410 4.689 2.935 5.499 0.089 20 0 "[ . 1 . 2]" 1
1759 1 60 ASP HB3 1 61 CYS H . . 4.100 3.061 2.543 4.045 . 0 0 "[ . 1 . 2]" 1
1760 1 60 ASP HB3 1 64 ILE MD . . 4.300 4.113 3.582 5.068 0.768 19 1 "[ . 1 . +2]" 1
1761 1 60 ASP HB3 1 64 ILE QG . . 5.050 2.962 2.370 4.043 . 0 0 "[ . 1 . 2]" 1
1762 1 61 CYS H 1 61 CYS HB2 . . 3.410 2.514 1.982 3.471 0.061 8 0 "[ . 1 . 2]" 1
1763 1 61 CYS H 1 61 CYS HB3 . . 3.210 2.825 2.073 3.489 0.279 2 0 "[ . 1 . 2]" 1
1764 1 61 CYS H 1 62 VAL H . . 3.400 3.013 2.828 3.171 . 0 0 "[ . 1 . 2]" 1
1765 1 61 CYS HA 1 62 VAL HA . . 5.460 4.796 4.704 4.851 . 0 0 "[ . 1 . 2]" 1
1766 1 61 CYS HA 1 62 VAL MG2 . . 5.500 5.060 4.832 5.346 . 0 0 "[ . 1 . 2]" 1
1767 1 61 CYS HA 1 64 ILE H . . 4.970 4.350 3.899 4.637 . 0 0 "[ . 1 . 2]" 1
1768 1 61 CYS HA 1 64 ILE HB . . 4.440 3.434 3.001 3.748 . 0 0 "[ . 1 . 2]" 1
1769 1 61 CYS HA 1 64 ILE QG . . 5.500 4.084 3.606 4.490 . 0 0 "[ . 1 . 2]" 1
1770 1 61 CYS HA 1 64 ILE MG . . 4.600 4.516 4.135 4.702 0.102 15 0 "[ . 1 . 2]" 1
1771 1 61 CYS HA 1 65 THR H . . 4.440 4.209 3.998 4.485 0.045 9 0 "[ . 1 . 2]" 1
1772 1 61 CYS HA 1 65 THR HB . . 5.280 5.260 5.041 5.354 0.074 20 0 "[ . 1 . 2]" 1
1773 1 61 CYS HA 1 92 VAL QG . . 5.500 4.705 3.944 5.397 . 0 0 "[ . 1 . 2]" 1
1774 1 61 CYS HB2 1 62 VAL H . . 3.810 3.381 2.328 4.022 0.212 17 0 "[ . 1 . 2]" 1
1775 1 61 CYS HB2 1 62 VAL MG2 . . 5.500 4.335 3.039 5.314 . 0 0 "[ . 1 . 2]" 1
1776 1 61 CYS HB2 1 96 CYS HB2 . . 5.010 4.099 3.119 5.110 0.100 17 0 "[ . 1 . 2]" 1
1777 1 61 CYS HB2 1 96 CYS HB3 . . 4.460 3.896 2.678 4.778 0.318 14 0 "[ . 1 . 2]" 1
1778 1 61 CYS HB3 1 62 VAL H . . 4.050 2.861 2.230 3.663 . 0 0 "[ . 1 . 2]" 1
1779 1 61 CYS HB3 1 62 VAL MG2 . . 5.500 3.594 2.804 4.812 . 0 0 "[ . 1 . 2]" 1
1780 1 61 CYS HB3 1 96 CYS HB2 . . 5.500 3.364 2.098 4.428 . 0 0 "[ . 1 . 2]" 1
1781 1 62 VAL H 1 62 VAL HB . . 3.150 2.419 2.210 2.503 . 0 0 "[ . 1 . 2]" 1
1782 1 62 VAL H 1 62 VAL MG1 . . 4.080 3.784 3.704 3.841 . 0 0 "[ . 1 . 2]" 1
1783 1 62 VAL H 1 62 VAL MG2 . . 3.300 2.462 2.267 2.662 . 0 0 "[ . 1 . 2]" 1
1784 1 62 VAL H 1 63 ASN H . . 3.430 2.899 2.717 3.072 . 0 0 "[ . 1 . 2]" 1
1785 1 62 VAL H 1 63 ASN HA . . 5.500 5.370 5.199 5.532 0.032 8 0 "[ . 1 . 2]" 1
1786 1 62 VAL H 1 63 ASN HB3 . . 5.500 5.024 4.532 5.330 . 0 0 "[ . 1 . 2]" 1
1787 1 62 VAL H 1 64 ILE H . . 5.500 4.183 3.998 4.388 . 0 0 "[ . 1 . 2]" 1
1788 1 62 VAL H 1 65 THR H . . 5.500 4.750 4.602 4.890 . 0 0 "[ . 1 . 2]" 1
1789 1 62 VAL H 1 92 VAL QG . . 4.740 3.948 3.530 4.364 . 0 0 "[ . 1 . 2]" 1
1790 1 62 VAL HA 1 62 VAL MG1 . . 3.220 2.480 2.343 2.781 . 0 0 "[ . 1 . 2]" 1
1791 1 62 VAL HA 1 62 VAL MG2 . . 3.230 2.368 2.272 2.488 . 0 0 "[ . 1 . 2]" 1
1792 1 62 VAL HA 1 63 ASN HA . . 5.350 4.733 4.549 4.849 . 0 0 "[ . 1 . 2]" 1
1793 1 62 VAL HA 1 64 ILE H . . 5.500 4.541 4.337 4.713 . 0 0 "[ . 1 . 2]" 1
1794 1 62 VAL HA 1 64 ILE HB . . 5.500 5.561 5.466 5.588 0.088 7 0 "[ . 1 . 2]" 1
1795 1 62 VAL HA 1 65 THR H . . 4.710 3.674 3.556 3.781 . 0 0 "[ . 1 . 2]" 1
1796 1 62 VAL HA 1 65 THR HB . . 3.980 3.111 2.916 3.214 . 0 0 "[ . 1 . 2]" 1
1797 1 62 VAL HA 1 65 THR HG1 . . 4.960 3.640 3.432 3.887 . 0 0 "[ . 1 . 2]" 1
1798 1 62 VAL HA 1 65 THR MG . . 4.530 4.482 4.255 4.580 0.050 10 0 "[ . 1 . 2]" 1
1799 1 62 VAL HA 1 66 ILE H . . 4.830 3.721 3.595 3.896 . 0 0 "[ . 1 . 2]" 1
1800 1 62 VAL HA 1 66 ILE MD . . 5.190 3.564 2.496 3.983 . 0 0 "[ . 1 . 2]" 1
1801 1 62 VAL HA 1 66 ILE QG . . 5.270 2.974 2.821 3.595 . 0 0 "[ . 1 . 2]" 1
1802 1 62 VAL HA 1 66 ILE MG . . 5.500 5.580 5.504 5.613 0.113 14 0 "[ . 1 . 2]" 1
1803 1 62 VAL HA 1 92 VAL QG . . 2.940 2.029 1.843 2.308 . 0 0 "[ . 1 . 2]" 1
1804 1 62 VAL HB 1 63 ASN H . . 3.330 2.261 2.115 2.426 . 0 0 "[ . 1 . 2]" 1
1805 1 62 VAL HB 1 63 ASN HB2 . . 4.840 4.235 3.835 4.646 . 0 0 "[ . 1 . 2]" 1
1806 1 62 VAL HB 1 63 ASN HB3 . . 5.030 4.963 4.643 5.103 0.073 4 0 "[ . 1 . 2]" 1
1807 1 62 VAL HB 1 64 ILE H . . 5.500 4.979 4.793 5.129 . 0 0 "[ . 1 . 2]" 1
1808 1 62 VAL HB 1 92 VAL QG . . 5.050 4.226 4.020 4.669 . 0 0 "[ . 1 . 2]" 1
1809 1 62 VAL HB 1 93 GLU HA . . 5.500 5.388 4.972 5.572 0.072 13 0 "[ . 1 . 2]" 1
1810 1 62 VAL MG1 1 63 ASN H . . 4.040 2.773 2.415 3.017 . 0 0 "[ . 1 . 2]" 1
1811 1 62 VAL MG1 1 63 ASN HA . . 4.040 3.039 2.500 3.248 . 0 0 "[ . 1 . 2]" 1
1812 1 62 VAL MG1 1 63 ASN HB2 . . 5.110 3.988 3.374 4.341 . 0 0 "[ . 1 . 2]" 1
1813 1 62 VAL MG1 1 63 ASN HB3 . . 5.290 4.862 4.379 5.130 . 0 0 "[ . 1 . 2]" 1
1814 1 62 VAL MG1 1 65 THR MG . . 5.140 5.203 4.993 5.276 0.136 7 0 "[ . 1 . 2]" 1
1815 1 62 VAL MG1 1 66 ILE H . . 5.250 3.919 3.817 4.087 . 0 0 "[ . 1 . 2]" 1
1816 1 62 VAL MG1 1 66 ILE HB . . 4.750 3.562 3.330 3.890 . 0 0 "[ . 1 . 2]" 1
1817 1 62 VAL MG1 1 66 ILE MD . . 3.480 2.625 1.731 3.038 . 0 0 "[ . 1 . 2]" 1
1818 1 62 VAL MG1 1 66 ILE QG . . 3.420 2.133 1.962 3.302 . 0 0 "[ . 1 . 2]" 1
1819 1 62 VAL MG1 1 89 GLU HA . . 3.750 2.301 2.112 3.318 . 0 0 "[ . 1 . 2]" 1
1820 1 62 VAL MG1 1 89 GLU HB2 . . 5.070 4.050 3.683 5.017 . 0 0 "[ . 1 . 2]" 1
1821 1 62 VAL MG1 1 89 GLU HB3 . . 5.050 2.796 2.283 4.238 . 0 0 "[ . 1 . 2]" 1
1822 1 62 VAL MG1 1 89 GLU HG2 . . 4.210 2.693 2.191 3.236 . 0 0 "[ . 1 . 2]" 1
1823 1 62 VAL MG1 1 89 GLU HG3 . . 4.580 3.881 3.559 4.203 . 0 0 "[ . 1 . 2]" 1
1824 1 62 VAL MG1 1 93 GLU H . . 4.980 4.303 3.800 4.997 0.017 7 0 "[ . 1 . 2]" 1
1825 1 62 VAL MG2 1 63 ASN H . . 4.510 3.847 3.753 3.938 . 0 0 "[ . 1 . 2]" 1
1826 1 62 VAL MG2 1 65 THR HB . . 5.500 4.805 4.565 4.947 . 0 0 "[ . 1 . 2]" 1
1827 1 62 VAL MG2 1 65 THR MG . . 5.430 5.350 5.010 5.521 0.091 18 0 "[ . 1 . 2]" 1
1828 1 62 VAL MG2 1 66 ILE H . . 5.500 5.349 5.237 5.451 . 0 0 "[ . 1 . 2]" 1
1829 1 62 VAL MG2 1 66 ILE MD . . 3.950 3.900 2.796 4.064 0.114 20 0 "[ . 1 . 2]" 1
1830 1 62 VAL MG2 1 66 ILE QG . . 5.000 3.890 3.756 4.173 . 0 0 "[ . 1 . 2]" 1
1831 1 62 VAL MG2 1 89 GLU HA . . 5.070 3.269 2.980 3.915 . 0 0 "[ . 1 . 2]" 1
1832 1 62 VAL MG2 1 89 GLU HG3 . . 5.500 5.566 5.268 6.240 0.740 17 1 "[ . 1 . + 2]" 1
1833 1 62 VAL MG2 1 90 ARG HA . . 5.500 4.715 4.453 5.040 . 0 0 "[ . 1 . 2]" 1
1834 1 62 VAL MG2 1 92 VAL H . . 5.130 4.601 4.334 5.229 0.099 7 0 "[ . 1 . 2]" 1
1835 1 62 VAL MG2 1 92 VAL QG . . 3.240 2.298 2.003 2.831 . 0 0 "[ . 1 . 2]" 1
1836 1 62 VAL MG2 1 93 GLU H . . 4.030 2.917 2.638 3.546 . 0 0 "[ . 1 . 2]" 1
1837 1 62 VAL MG2 1 93 GLU HA . . 3.140 2.597 2.202 2.792 . 0 0 "[ . 1 . 2]" 1
1838 1 62 VAL MG2 1 93 GLU HB2 . . 3.270 2.353 2.064 2.714 . 0 0 "[ . 1 . 2]" 1
1839 1 62 VAL MG2 1 93 GLU HB3 . . 4.500 3.695 3.343 4.080 . 0 0 "[ . 1 . 2]" 1
1840 1 62 VAL MG2 1 93 GLU HG3 . . 4.010 3.301 2.740 3.950 . 0 0 "[ . 1 . 2]" 1
1841 1 63 ASN H 1 63 ASN HB2 . . 3.140 2.375 2.129 2.626 . 0 0 "[ . 1 . 2]" 1
1842 1 63 ASN H 1 63 ASN HB3 . . 3.080 2.766 2.417 2.898 . 0 0 "[ . 1 . 2]" 1
1843 1 63 ASN H 1 64 ILE H . . 3.520 3.050 2.913 3.211 . 0 0 "[ . 1 . 2]" 1
1844 1 63 ASN H 1 64 ILE HB . . 5.400 5.211 5.066 5.390 . 0 0 "[ . 1 . 2]" 1
1845 1 63 ASN H 1 64 ILE QG . . 5.500 4.491 4.333 4.656 . 0 0 "[ . 1 . 2]" 1
1846 1 63 ASN H 1 65 THR H . . 5.100 4.521 4.379 4.594 . 0 0 "[ . 1 . 2]" 1
1847 1 63 ASN H 1 66 ILE H . . 5.500 4.782 4.700 4.883 . 0 0 "[ . 1 . 2]" 1
1848 1 63 ASN H 1 66 ILE MD . . 5.500 5.447 3.804 5.602 0.102 20 0 "[ . 1 . 2]" 1
1849 1 63 ASN H 1 66 ILE QG . . 5.500 4.165 4.046 5.302 . 0 0 "[ . 1 . 2]" 1
1850 1 63 ASN H 1 92 VAL QG . . 5.500 4.874 4.705 5.117 . 0 0 "[ . 1 . 2]" 1
1851 1 63 ASN HA 1 63 ASN HD22 . . 5.500 4.209 3.691 4.605 . 0 0 "[ . 1 . 2]" 1
1852 1 63 ASN HA 1 64 ILE HA . . 5.500 4.813 4.753 4.877 . 0 0 "[ . 1 . 2]" 1
1853 1 63 ASN HA 1 66 ILE H . . 4.540 3.731 3.521 4.008 . 0 0 "[ . 1 . 2]" 1
1854 1 63 ASN HA 1 66 ILE HB . . 3.850 2.706 2.395 3.484 . 0 0 "[ . 1 . 2]" 1
1855 1 63 ASN HA 1 66 ILE MD . . 4.810 4.797 3.168 4.920 0.110 15 0 "[ . 1 . 2]" 1
1856 1 63 ASN HA 1 66 ILE QG . . 5.330 3.342 3.082 4.285 . 0 0 "[ . 1 . 2]" 1
1857 1 63 ASN HA 1 66 ILE MG . . 5.290 4.044 3.509 4.905 . 0 0 "[ . 1 . 2]" 1
1858 1 63 ASN HA 1 67 LYS H . . 4.670 4.603 4.306 4.735 0.065 5 0 "[ . 1 . 2]" 1
1859 1 63 ASN HB2 1 64 ILE H . . 3.780 3.821 3.709 3.851 0.071 8 0 "[ . 1 . 2]" 1
1860 1 63 ASN HB2 1 64 ILE MD . . 5.500 5.494 5.167 5.598 0.098 20 0 "[ . 1 . 2]" 1
1861 1 63 ASN HB2 1 64 ILE QG . . 4.950 4.531 4.310 4.703 . 0 0 "[ . 1 . 2]" 1
1862 1 63 ASN HB3 1 64 ILE H . . 3.760 2.604 2.444 2.878 . 0 0 "[ . 1 . 2]" 1
1863 1 63 ASN HB3 1 64 ILE HA . . 5.170 4.249 4.128 4.469 . 0 0 "[ . 1 . 2]" 1
1864 1 63 ASN HB3 1 64 ILE HB . . 5.250 4.775 4.591 4.960 . 0 0 "[ . 1 . 2]" 1
1865 1 63 ASN HB3 1 64 ILE MD . . 5.210 4.075 3.883 4.192 . 0 0 "[ . 1 . 2]" 1
1866 1 63 ASN HB3 1 64 ILE QG . . 4.920 2.923 2.763 3.098 . 0 0 "[ . 1 . 2]" 1
1867 1 63 ASN HD21 1 64 ILE MD . . 5.500 3.637 2.735 4.894 . 0 0 "[ . 1 . 2]" 1
1868 1 63 ASN HD21 1 67 LYS QE . . 5.500 5.497 4.845 6.255 0.755 14 1 "[ . 1 +. 2]" 1
1869 1 63 ASN HD22 1 64 ILE HA . . 5.500 4.723 3.661 5.420 . 0 0 "[ . 1 . 2]" 1
1870 1 63 ASN HD22 1 64 ILE MD . . 5.500 4.593 3.667 5.471 . 0 0 "[ . 1 . 2]" 1
1871 1 63 ASN HD22 1 67 LYS HB3 . . 5.500 4.700 3.817 5.393 . 0 0 "[ . 1 . 2]" 1
1872 1 63 ASN HD22 1 67 LYS HG3 . . 5.500 4.734 3.879 5.573 0.073 19 0 "[ . 1 . 2]" 1
1873 1 64 ILE H 1 64 ILE HB . . 3.290 2.418 2.329 2.507 . 0 0 "[ . 1 . 2]" 1
1874 1 64 ILE H 1 64 ILE MD . . 4.660 3.668 3.444 3.811 . 0 0 "[ . 1 . 2]" 1
1875 1 64 ILE H 1 64 ILE HG12 . . 3.560 2.203 2.058 2.399 . 0 0 "[ . 1 . 2]" 1
1876 1 64 ILE H 1 64 ILE QG . . 3.960 2.172 2.040 2.354 . 0 0 "[ . 1 . 2]" 1
1877 1 64 ILE H 1 64 ILE MG . . 4.210 3.768 3.738 3.839 . 0 0 "[ . 1 . 2]" 1
1878 1 64 ILE H 1 65 THR H . . 3.540 2.681 2.543 2.803 . 0 0 "[ . 1 . 2]" 1
1879 1 64 ILE H 1 65 THR HG1 . . 5.500 4.388 4.268 4.531 . 0 0 "[ . 1 . 2]" 1
1880 1 64 ILE H 1 66 ILE H . . 5.200 4.119 3.945 4.256 . 0 0 "[ . 1 . 2]" 1
1881 1 64 ILE HA 1 64 ILE MD . . 3.520 2.405 2.285 2.533 . 0 0 "[ . 1 . 2]" 1
1882 1 64 ILE HA 1 64 ILE QG . . 3.790 2.769 2.635 2.867 . 0 0 "[ . 1 . 2]" 1
1883 1 64 ILE HA 1 65 THR HA . . 5.160 4.738 4.623 4.812 . 0 0 "[ . 1 . 2]" 1
1884 1 64 ILE HA 1 65 THR HG1 . . 5.500 5.563 5.513 5.596 0.096 18 0 "[ . 1 . 2]" 1
1885 1 64 ILE HA 1 67 LYS H . . 3.680 3.476 3.334 3.620 . 0 0 "[ . 1 . 2]" 1
1886 1 64 ILE HA 1 67 LYS HB2 . . 3.710 3.688 3.346 3.786 0.076 4 0 "[ . 1 . 2]" 1
1887 1 64 ILE HA 1 67 LYS HB3 . . 3.620 2.450 2.283 2.620 . 0 0 "[ . 1 . 2]" 1
1888 1 64 ILE HA 1 67 LYS QD . . 4.880 3.395 2.648 4.059 . 0 0 "[ . 1 . 2]" 1
1889 1 64 ILE HA 1 67 LYS QE . . 5.500 3.744 2.624 5.056 . 0 0 "[ . 1 . 2]" 1
1890 1 64 ILE HA 1 67 LYS HG2 . . 5.500 5.193 4.779 5.410 . 0 0 "[ . 1 . 2]" 1
1891 1 64 ILE HA 1 67 LYS HG3 . . 5.500 4.779 4.011 5.300 . 0 0 "[ . 1 . 2]" 1
1892 1 64 ILE HA 1 68 GLN HG2 . . 5.500 4.365 3.776 5.280 . 0 0 "[ . 1 . 2]" 1
1893 1 64 ILE HB 1 64 ILE MD . . 3.660 3.256 3.222 3.290 . 0 0 "[ . 1 . 2]" 1
1894 1 64 ILE HB 1 65 THR H . . 3.720 2.669 2.598 2.752 . 0 0 "[ . 1 . 2]" 1
1895 1 64 ILE HB 1 65 THR HA . . 5.400 4.443 4.346 4.576 . 0 0 "[ . 1 . 2]" 1
1896 1 64 ILE HB 1 65 THR HB . . 5.420 4.963 4.834 5.106 . 0 0 "[ . 1 . 2]" 1
1897 1 64 ILE HB 1 65 THR HG1 . . 5.500 3.612 3.503 3.721 . 0 0 "[ . 1 . 2]" 1
1898 1 64 ILE HB 1 66 ILE H . . 5.500 5.064 4.897 5.210 . 0 0 "[ . 1 . 2]" 1
1899 1 64 ILE MD 1 64 ILE MG . . 3.410 2.000 1.973 2.045 . 0 0 "[ . 1 . 2]" 1
1900 1 64 ILE MD 1 65 THR H . . 5.500 4.977 4.888 5.052 . 0 0 "[ . 1 . 2]" 1
1901 1 64 ILE MD 1 67 LYS H . . 5.500 5.422 5.264 5.563 0.063 9 0 "[ . 1 . 2]" 1
1902 1 64 ILE MD 1 67 LYS HB2 . . 4.980 4.921 4.531 5.073 0.093 17 0 "[ . 1 . 2]" 1
1903 1 64 ILE MD 1 67 LYS HB3 . . 5.150 4.026 3.827 4.200 . 0 0 "[ . 1 . 2]" 1
1904 1 64 ILE MD 1 67 LYS QD . . 5.150 3.575 3.035 4.133 . 0 0 "[ . 1 . 2]" 1
1905 1 64 ILE MD 1 67 LYS QE . . 5.070 3.820 2.951 4.756 . 0 0 "[ . 1 . 2]" 1
1906 1 64 ILE MD 1 68 GLN H . . 5.500 5.318 5.079 5.512 0.012 20 0 "[ . 1 . 2]" 1
1907 1 64 ILE MD 1 68 GLN HG2 . . 5.500 4.710 4.280 5.293 . 0 0 "[ . 1 . 2]" 1
1908 1 64 ILE QG 1 65 THR H . . 5.410 4.091 4.024 4.165 . 0 0 "[ . 1 . 2]" 1
1909 1 64 ILE QG 1 67 LYS HB3 . . 4.850 4.923 4.774 4.953 0.103 20 0 "[ . 1 . 2]" 1
1910 1 64 ILE QG 1 67 LYS QD . . 5.500 5.134 4.556 5.574 0.074 5 0 "[ . 1 . 2]" 1
1911 1 64 ILE HG13 1 65 THR H . . 5.130 4.834 4.732 4.913 . 0 0 "[ . 1 . 2]" 1
1912 1 64 ILE MG 1 65 THR H . . 4.200 3.489 3.390 3.659 . 0 0 "[ . 1 . 2]" 1
1913 1 64 ILE MG 1 65 THR HA . . 4.550 3.507 3.339 3.660 . 0 0 "[ . 1 . 2]" 1
1914 1 64 ILE MG 1 65 THR HB . . 5.500 5.193 5.068 5.310 . 0 0 "[ . 1 . 2]" 1
1915 1 64 ILE MG 1 65 THR HG1 . . 5.160 4.178 3.986 4.318 . 0 0 "[ . 1 . 2]" 1
1916 1 64 ILE MG 1 65 THR MG . . 5.500 4.848 4.661 5.065 . 0 0 "[ . 1 . 2]" 1
1917 1 64 ILE MG 1 66 ILE H . . 5.400 5.210 5.058 5.399 . 0 0 "[ . 1 . 2]" 1
1918 1 64 ILE MG 1 67 LYS H . . 5.500 4.503 4.330 4.660 . 0 0 "[ . 1 . 2]" 1
1919 1 64 ILE MG 1 67 LYS HB2 . . 5.500 5.268 4.924 5.432 . 0 0 "[ . 1 . 2]" 1
1920 1 64 ILE MG 1 67 LYS HB3 . . 5.500 3.896 3.594 4.074 . 0 0 "[ . 1 . 2]" 1
1921 1 64 ILE MG 1 67 LYS QE . . 5.500 3.625 2.672 5.083 . 0 0 "[ . 1 . 2]" 1
1922 1 64 ILE MG 1 68 GLN H . . 5.470 3.789 3.603 3.939 . 0 0 "[ . 1 . 2]" 1
1923 1 64 ILE MG 1 68 GLN HA . . 5.500 5.047 4.836 5.187 . 0 0 "[ . 1 . 2]" 1
1924 1 64 ILE MG 1 68 GLN HB2 . . 5.440 3.560 2.881 3.801 . 0 0 "[ . 1 . 2]" 1
1925 1 64 ILE MG 1 68 GLN HB3 . . 4.930 4.685 4.172 4.916 . 0 0 "[ . 1 . 2]" 1
1926 1 64 ILE MG 1 68 GLN HE21 . . 5.500 5.158 4.786 5.570 0.070 4 0 "[ . 1 . 2]" 1
1927 1 64 ILE MG 1 68 GLN HG2 . . 4.580 2.953 2.581 3.639 . 0 0 "[ . 1 . 2]" 1
1928 1 64 ILE MG 1 68 GLN HG3 . . 4.980 3.134 2.793 3.644 . 0 0 "[ . 1 . 2]" 1
1929 1 65 THR H 1 65 THR HB . . 3.340 2.494 2.381 2.597 . 0 0 "[ . 1 . 2]" 1
1930 1 65 THR H 1 65 THR HG1 . . 3.320 2.190 2.062 2.369 . 0 0 "[ . 1 . 2]" 1
1931 1 65 THR H 1 65 THR MG . . 4.430 3.772 3.743 3.811 . 0 0 "[ . 1 . 2]" 1
1932 1 65 THR H 1 66 ILE H . . 3.740 2.571 2.439 2.710 . 0 0 "[ . 1 . 2]" 1
1933 1 65 THR H 1 66 ILE HB . . 5.500 4.789 4.356 5.194 . 0 0 "[ . 1 . 2]" 1
1934 1 65 THR H 1 66 ILE QG . . 5.070 4.015 3.834 4.257 . 0 0 "[ . 1 . 2]" 1
1935 1 65 THR HA 1 65 THR MG . . 3.480 2.369 2.285 2.494 . 0 0 "[ . 1 . 2]" 1
1936 1 65 THR HA 1 66 ILE MD . . 5.500 5.038 4.622 5.613 0.113 12 0 "[ . 1 . 2]" 1
1937 1 65 THR HA 1 67 LYS H . . 5.500 3.674 3.513 3.926 . 0 0 "[ . 1 . 2]" 1
1938 1 65 THR HA 1 68 GLN H . . 4.870 3.233 3.045 3.551 . 0 0 "[ . 1 . 2]" 1
1939 1 65 THR HA 1 68 GLN HB2 . . 5.160 2.585 2.124 3.058 . 0 0 "[ . 1 . 2]" 1
1940 1 65 THR HA 1 68 GLN HB3 . . 4.540 4.082 3.602 4.478 . 0 0 "[ . 1 . 2]" 1
1941 1 65 THR HA 1 68 GLN HG2 . . 5.400 4.521 3.986 5.443 0.043 4 0 "[ . 1 . 2]" 1
1942 1 65 THR HA 1 69 HIS QB . . 5.500 3.886 3.565 4.074 . 0 0 "[ . 1 . 2]" 1
1943 1 65 THR HA 1 92 VAL QG . . 5.060 4.280 4.142 4.456 . 0 0 "[ . 1 . 2]" 1
1944 1 65 THR HB 1 66 ILE H . . 3.670 2.584 2.350 2.791 . 0 0 "[ . 1 . 2]" 1
1945 1 65 THR HB 1 66 ILE HB . . 5.350 5.014 4.362 5.431 0.081 15 0 "[ . 1 . 2]" 1
1946 1 65 THR HB 1 66 ILE MD . . 5.500 3.310 2.777 4.009 . 0 0 "[ . 1 . 2]" 1
1947 1 65 THR HB 1 66 ILE QG . . 5.420 3.357 2.857 3.928 . 0 0 "[ . 1 . 2]" 1
1948 1 65 THR HB 1 67 LYS H . . 5.270 4.758 4.614 4.840 . 0 0 "[ . 1 . 2]" 1
1949 1 65 THR HB 1 69 HIS QB . . 5.500 4.983 4.711 5.254 . 0 0 "[ . 1 . 2]" 1
1950 1 65 THR HB 1 92 VAL HB . . 5.500 3.859 3.259 4.352 . 0 0 "[ . 1 . 2]" 1
1951 1 65 THR HB 1 92 VAL QG . . 3.470 2.083 1.933 2.319 . 0 0 "[ . 1 . 2]" 1
1952 1 65 THR HG1 1 66 ILE H . . 4.770 3.998 3.851 4.222 . 0 0 "[ . 1 . 2]" 1
1953 1 65 THR HG1 1 92 VAL QG . . 4.600 3.031 2.561 3.566 . 0 0 "[ . 1 . 2]" 1
1954 1 65 THR MG 1 66 ILE H . . 4.390 3.573 3.357 3.783 . 0 0 "[ . 1 . 2]" 1
1955 1 65 THR MG 1 66 ILE HA . . 4.490 3.864 3.551 4.156 . 0 0 "[ . 1 . 2]" 1
1956 1 65 THR MG 1 66 ILE MD . . 5.070 3.197 2.626 4.056 . 0 0 "[ . 1 . 2]" 1
1957 1 65 THR MG 1 66 ILE QG . . 5.500 4.156 3.151 4.563 . 0 0 "[ . 1 . 2]" 1
1958 1 65 THR MG 1 68 GLN HB2 . . 4.680 4.038 3.536 4.716 0.036 4 0 "[ . 1 . 2]" 1
1959 1 65 THR MG 1 69 HIS H . . 5.500 3.850 3.593 4.133 . 0 0 "[ . 1 . 2]" 1
1960 1 65 THR MG 1 69 HIS QB . . 4.740 2.895 2.633 3.081 . 0 0 "[ . 1 . 2]" 1
1961 1 65 THR MG 1 69 HIS HD2 . . 5.310 4.871 4.460 5.212 . 0 0 "[ . 1 . 2]" 1
1962 1 65 THR MG 1 91 VAL QG . . 4.480 4.465 4.295 4.526 0.046 11 0 "[ . 1 . 2]" 1
1963 1 65 THR MG 1 92 VAL H . . 5.500 5.053 4.851 5.281 . 0 0 "[ . 1 . 2]" 1
1964 1 65 THR MG 1 92 VAL HB . . 5.500 3.477 2.337 4.288 . 0 0 "[ . 1 . 2]" 1
1965 1 65 THR MG 1 92 VAL QG . . 3.340 1.936 1.800 2.000 . 0 0 "[ . 1 . 2]" 1
1966 1 66 ILE H 1 66 ILE HB . . 3.120 2.577 2.178 2.867 . 0 0 "[ . 1 . 2]" 1
1967 1 66 ILE H 1 66 ILE MD . . 4.430 2.902 2.384 3.397 . 0 0 "[ . 1 . 2]" 1
1968 1 66 ILE H 1 66 ILE QG . . 3.620 2.104 2.003 2.243 . 0 0 "[ . 1 . 2]" 1
1969 1 66 ILE H 1 66 ILE MG . . 4.150 3.761 3.648 3.808 . 0 0 "[ . 1 . 2]" 1
1970 1 66 ILE H 1 67 LYS H . . 3.370 2.791 2.704 2.888 . 0 0 "[ . 1 . 2]" 1
1971 1 66 ILE H 1 92 VAL QG . . 4.740 3.454 3.212 3.663 . 0 0 "[ . 1 . 2]" 1
1972 1 66 ILE HA 1 66 ILE MD . . 4.100 2.414 2.169 3.806 . 0 0 "[ . 1 . 2]" 1
1973 1 66 ILE HA 1 66 ILE QG . . 3.840 3.162 2.491 3.439 . 0 0 "[ . 1 . 2]" 1
1974 1 66 ILE HA 1 66 ILE MG . . 3.430 2.403 2.255 2.613 . 0 0 "[ . 1 . 2]" 1
1975 1 66 ILE HA 1 67 LYS HA . . 4.940 4.603 4.464 4.724 . 0 0 "[ . 1 . 2]" 1
1976 1 66 ILE HA 1 69 HIS H . . 4.270 4.091 3.670 4.332 0.062 2 0 "[ . 1 . 2]" 1
1977 1 66 ILE HA 1 69 HIS QB . . 3.800 3.436 2.882 3.881 0.081 13 0 "[ . 1 . 2]" 1
1978 1 66 ILE HA 1 69 HIS HD2 . . 4.510 4.585 4.564 4.602 0.092 17 0 "[ . 1 . 2]" 1
1979 1 66 ILE HA 1 70 THR H . . 5.150 4.523 3.948 4.883 . 0 0 "[ . 1 . 2]" 1
1980 1 66 ILE HA 1 88 MET ME . . 4.520 3.376 2.649 3.839 . 0 0 "[ . 1 . 2]" 1
1981 1 66 ILE HB 1 66 ILE MD . . 3.530 3.227 2.313 3.295 . 0 0 "[ . 1 . 2]" 1
1982 1 66 ILE HB 1 67 LYS H . . 3.750 3.507 3.141 3.815 0.065 7 0 "[ . 1 . 2]" 1
1983 1 66 ILE HB 1 67 LYS HA . . 5.500 4.792 4.538 5.058 . 0 0 "[ . 1 . 2]" 1
1984 1 66 ILE MD 1 66 ILE MG . . 2.920 2.177 2.096 2.305 . 0 0 "[ . 1 . 2]" 1
1985 1 66 ILE MD 1 67 LYS H . . 5.360 4.737 4.508 5.008 . 0 0 "[ . 1 . 2]" 1
1986 1 66 ILE MD 1 85 VAL HA . . 5.260 3.695 3.250 4.798 . 0 0 "[ . 1 . 2]" 1
1987 1 66 ILE MD 1 88 MET H . . 5.500 4.443 4.087 4.976 . 0 0 "[ . 1 . 2]" 1
1988 1 66 ILE MD 1 88 MET HA . . 5.500 4.030 3.702 4.514 . 0 0 "[ . 1 . 2]" 1
1989 1 66 ILE MD 1 88 MET HB2 . . 4.250 3.376 2.230 4.320 0.070 7 0 "[ . 1 . 2]" 1
1990 1 66 ILE MD 1 88 MET HB3 . . 4.060 2.327 2.075 3.043 . 0 0 "[ . 1 . 2]" 1
1991 1 66 ILE MD 1 88 MET ME . . 4.390 2.857 2.244 4.038 . 0 0 "[ . 1 . 2]" 1
1992 1 66 ILE MD 1 88 MET HG2 . . 5.370 2.930 2.071 5.111 . 0 0 "[ . 1 . 2]" 1
1993 1 66 ILE MD 1 89 GLU H . . 4.430 3.043 2.751 3.430 . 0 0 "[ . 1 . 2]" 1
1994 1 66 ILE MD 1 89 GLU HA . . 3.240 2.175 2.021 2.313 . 0 0 "[ . 1 . 2]" 1
1995 1 66 ILE MD 1 89 GLU HB2 . . 4.870 4.328 4.036 4.685 . 0 0 "[ . 1 . 2]" 1
1996 1 66 ILE MD 1 89 GLU HG2 . . 3.670 2.639 1.952 3.536 . 0 0 "[ . 1 . 2]" 1
1997 1 66 ILE MD 1 89 GLU HG3 . . 4.170 3.591 2.362 4.258 0.088 7 0 "[ . 1 . 2]" 1
1998 1 66 ILE MD 1 90 ARG H . . 5.500 4.772 4.540 5.008 . 0 0 "[ . 1 . 2]" 1
1999 1 66 ILE MD 1 92 VAL H . . 5.380 4.074 3.664 4.667 . 0 0 "[ . 1 . 2]" 1
2000 1 66 ILE MD 1 92 VAL HB . . 4.410 3.507 2.396 4.471 0.061 18 0 "[ . 1 . 2]" 1
2001 1 66 ILE MD 1 92 VAL QG . . 3.190 2.232 1.940 2.992 . 0 0 "[ . 1 . 2]" 1
2002 1 66 ILE MD 1 93 GLU H . . 5.500 4.761 4.221 5.296 . 0 0 "[ . 1 . 2]" 1
2003 1 66 ILE QG 1 66 ILE MG . . 3.330 2.170 2.087 2.307 . 0 0 "[ . 1 . 2]" 1
2004 1 66 ILE QG 1 67 LYS H . . 5.080 4.417 4.232 4.527 . 0 0 "[ . 1 . 2]" 1
2005 1 66 ILE QG 1 89 GLU HA . . 5.430 3.115 2.523 3.729 . 0 0 "[ . 1 . 2]" 1
2006 1 66 ILE QG 1 89 GLU HG2 . . 3.480 2.341 2.117 3.432 . 0 0 "[ . 1 . 2]" 1
2007 1 66 ILE QG 1 89 GLU HG3 . . 5.500 3.719 3.140 4.170 . 0 0 "[ . 1 . 2]" 1
2008 1 66 ILE QG 1 92 VAL QG . . 4.440 2.900 2.175 3.203 . 0 0 "[ . 1 . 2]" 1
2009 1 66 ILE MG 1 67 LYS H . . 4.270 4.183 3.968 4.364 0.094 15 0 "[ . 1 . 2]" 1
2010 1 66 ILE MG 1 67 LYS HA . . 4.330 4.225 3.938 4.422 0.092 5 0 "[ . 1 . 2]" 1
2011 1 66 ILE MG 1 67 LYS HB2 . . 5.500 4.842 4.445 5.368 . 0 0 "[ . 1 . 2]" 1
2012 1 66 ILE MG 1 69 HIS QB . . 5.210 4.917 4.056 5.310 0.100 6 0 "[ . 1 . 2]" 1
2013 1 66 ILE MG 1 70 THR H . . 5.500 5.319 4.829 5.583 0.083 7 0 "[ . 1 . 2]" 1
2014 1 66 ILE MG 1 70 THR HB . . 5.500 4.252 3.993 4.640 . 0 0 "[ . 1 . 2]" 1
2015 1 66 ILE MG 1 70 THR MG . . 4.050 3.887 3.371 4.191 0.141 20 0 "[ . 1 . 2]" 1
2016 1 66 ILE MG 1 88 MET HB2 . . 5.500 4.489 3.414 5.532 0.032 20 0 "[ . 1 . 2]" 1
2017 1 66 ILE MG 1 88 MET HB3 . . 5.500 3.779 3.016 4.443 . 0 0 "[ . 1 . 2]" 1
2018 1 66 ILE MG 1 88 MET ME . . 3.650 2.671 2.034 3.335 . 0 0 "[ . 1 . 2]" 1
2019 1 66 ILE MG 1 88 MET HG2 . . 5.500 4.787 3.587 5.758 0.258 12 0 "[ . 1 . 2]" 1
2020 1 66 ILE MG 1 89 GLU HA . . 4.900 4.581 4.051 4.993 0.093 20 0 "[ . 1 . 2]" 1
2021 1 66 ILE MG 1 89 GLU HG3 . . 5.500 3.813 3.215 4.164 . 0 0 "[ . 1 . 2]" 1
2022 1 67 LYS H 1 67 LYS HB2 . . 3.410 2.975 2.779 3.181 . 0 0 "[ . 1 . 2]" 1
2023 1 67 LYS H 1 67 LYS HB3 . . 3.150 2.374 2.217 2.634 . 0 0 "[ . 1 . 2]" 1
2024 1 67 LYS H 1 67 LYS QD . . 4.960 4.328 3.631 5.020 0.060 15 0 "[ . 1 . 2]" 1
2025 1 67 LYS H 1 67 LYS QE . . 5.500 4.593 3.383 5.603 0.103 12 0 "[ . 1 . 2]" 1
2026 1 67 LYS H 1 67 LYS HG2 . . 4.290 4.363 4.209 4.383 0.093 5 0 "[ . 1 . 2]" 1
2027 1 67 LYS H 1 67 LYS HG3 . . 4.820 4.722 4.574 4.868 0.048 7 0 "[ . 1 . 2]" 1
2028 1 67 LYS H 1 68 GLN H . . 3.510 2.209 2.037 2.362 . 0 0 "[ . 1 . 2]" 1
2029 1 67 LYS H 1 69 HIS H . . 3.580 3.636 3.465 3.664 0.084 9 0 "[ . 1 . 2]" 1
2030 1 67 LYS H 1 70 THR HB . . 5.500 4.470 4.166 4.777 . 0 0 "[ . 1 . 2]" 1
2031 1 67 LYS HA 1 67 LYS QD . . 4.270 4.051 3.578 4.359 0.089 4 0 "[ . 1 . 2]" 1
2032 1 67 LYS HA 1 67 LYS QE . . 5.500 4.388 3.534 5.271 . 0 0 "[ . 1 . 2]" 1
2033 1 67 LYS HA 1 67 LYS HG2 . . 3.810 2.622 2.292 3.001 . 0 0 "[ . 1 . 2]" 1
2034 1 67 LYS HA 1 67 LYS HG3 . . 4.000 3.313 2.905 3.776 . 0 0 "[ . 1 . 2]" 1
2035 1 67 LYS HA 1 70 THR H . . 4.350 3.534 3.323 3.728 . 0 0 "[ . 1 . 2]" 1
2036 1 67 LYS HA 1 70 THR HA . . 5.220 5.287 5.099 5.315 0.095 4 0 "[ . 1 . 2]" 1
2037 1 67 LYS HA 1 70 THR HB . . 3.960 2.406 2.218 2.620 . 0 0 "[ . 1 . 2]" 1
2038 1 67 LYS HA 1 70 THR MG . . 4.380 3.534 3.211 3.719 . 0 0 "[ . 1 . 2]" 1
2039 1 67 LYS HB3 1 67 LYS QD . . 3.580 2.389 2.159 2.796 . 0 0 "[ . 1 . 2]" 1
2040 1 67 LYS HB3 1 68 GLN H . . 4.050 2.651 2.408 2.973 . 0 0 "[ . 1 . 2]" 1
2041 1 67 LYS QD 1 68 GLN HG2 . . 4.310 3.532 2.203 4.395 0.085 19 0 "[ . 1 . 2]" 1
2042 1 67 LYS QD 1 71 VAL MG1 . . 4.430 4.000 3.052 4.547 0.117 12 0 "[ . 1 . 2]" 1
2043 1 67 LYS QD 1 71 VAL MG2 . . 4.060 3.065 2.399 3.940 . 0 0 "[ . 1 . 2]" 1
2044 1 67 LYS QE 1 67 LYS HG2 . . 3.890 2.564 2.172 3.397 . 0 0 "[ . 1 . 2]" 1
2045 1 67 LYS QE 1 68 GLN H . . 5.500 3.576 2.268 5.020 . 0 0 "[ . 1 . 2]" 1
2046 1 67 LYS QE 1 71 VAL HB . . 5.490 3.707 2.383 5.118 . 0 0 "[ . 1 . 2]" 1
2047 1 67 LYS QE 1 71 VAL MG1 . . 5.500 3.644 2.819 4.664 . 0 0 "[ . 1 . 2]" 1
2048 1 67 LYS QE 1 71 VAL MG2 . . 4.720 3.056 2.173 4.125 . 0 0 "[ . 1 . 2]" 1
2049 1 67 LYS QE 1 72 THR MG . . 5.500 5.342 4.369 5.631 0.131 4 0 "[ . 1 . 2]" 1
2050 1 67 LYS HG2 1 68 GLN H . . 5.480 3.956 3.421 4.305 . 0 0 "[ . 1 . 2]" 1
2051 1 67 LYS HG2 1 71 VAL H . . 5.500 4.769 3.781 5.205 . 0 0 "[ . 1 . 2]" 1
2052 1 67 LYS HG2 1 71 VAL HB . . 4.350 3.636 3.099 3.896 . 0 0 "[ . 1 . 2]" 1
2053 1 67 LYS HG2 1 71 VAL MG1 . . 4.060 4.107 3.475 4.161 0.101 1 0 "[ . 1 . 2]" 1
2054 1 67 LYS HG2 1 71 VAL MG2 . . 3.720 2.217 2.100 2.381 . 0 0 "[ . 1 . 2]" 1
2055 1 67 LYS HG3 1 68 GLN H . . 5.150 4.826 4.475 5.187 0.037 20 0 "[ . 1 . 2]" 1
2056 1 67 LYS HG3 1 71 VAL MG2 . . 3.600 3.341 2.647 3.566 . 0 0 "[ . 1 . 2]" 1
2057 1 68 GLN H 1 68 GLN HB2 . . 3.820 2.226 2.023 2.330 . 0 0 "[ . 1 . 2]" 1
2058 1 68 GLN H 1 68 GLN HB3 . . 3.740 3.498 3.137 3.585 . 0 0 "[ . 1 . 2]" 1
2059 1 68 GLN H 1 68 GLN HE21 . . 5.500 5.508 5.354 5.574 0.074 11 0 "[ . 1 . 2]" 1
2060 1 68 GLN H 1 68 GLN HG2 . . 3.480 2.887 2.590 3.559 0.079 4 0 "[ . 1 . 2]" 1
2061 1 68 GLN H 1 68 GLN HG3 . . 4.220 3.914 3.768 4.298 0.078 4 0 "[ . 1 . 2]" 1
2062 1 68 GLN H 1 69 HIS H . . 3.370 2.710 2.553 2.852 . 0 0 "[ . 1 . 2]" 1
2063 1 68 GLN H 1 69 HIS QB . . 5.330 4.412 4.207 4.626 . 0 0 "[ . 1 . 2]" 1
2064 1 68 GLN H 1 70 THR H . . 3.770 3.835 3.713 3.852 0.082 12 0 "[ . 1 . 2]" 1
2065 1 68 GLN H 1 71 VAL H . . 5.130 4.878 4.493 5.118 . 0 0 "[ . 1 . 2]" 1
2066 1 68 GLN HA 1 68 GLN HE21 . . 5.320 4.041 3.775 4.210 . 0 0 "[ . 1 . 2]" 1
2067 1 68 GLN HA 1 68 GLN QE . . 5.010 3.618 3.309 3.847 . 0 0 "[ . 1 . 2]" 1
2068 1 68 GLN HA 1 68 GLN HE22 . . 5.500 4.088 3.637 4.449 . 0 0 "[ . 1 . 2]" 1
2069 1 68 GLN HA 1 68 GLN HG2 . . 3.880 2.729 2.392 2.944 . 0 0 "[ . 1 . 2]" 1
2070 1 68 GLN HA 1 71 VAL H . . 4.140 3.427 3.203 3.559 . 0 0 "[ . 1 . 2]" 1
2071 1 68 GLN HA 1 71 VAL HB . . 3.310 2.553 2.247 2.970 . 0 0 "[ . 1 . 2]" 1
2072 1 68 GLN HA 1 71 VAL MG1 . . 4.770 3.796 3.461 4.287 . 0 0 "[ . 1 . 2]" 1
2073 1 68 GLN HA 1 71 VAL MG2 . . 3.990 3.744 3.472 4.056 0.066 20 0 "[ . 1 . 2]" 1
2074 1 68 GLN HA 1 72 THR MG . . 5.500 3.363 2.748 4.129 . 0 0 "[ . 1 . 2]" 1
2075 1 68 GLN HB2 1 68 GLN HE22 . . 5.500 5.015 4.872 5.105 . 0 0 "[ . 1 . 2]" 1
2076 1 68 GLN HB2 1 69 HIS H . . 4.670 2.770 2.558 3.224 . 0 0 "[ . 1 . 2]" 1
2077 1 68 GLN HB2 1 71 VAL H . . 5.500 5.536 5.444 5.580 0.080 4 0 "[ . 1 . 2]" 1
2078 1 68 GLN HB3 1 69 HIS H . . 4.140 3.255 2.838 3.497 . 0 0 "[ . 1 . 2]" 1
2079 1 68 GLN HB3 1 69 HIS HA . . 5.320 4.023 3.833 4.308 . 0 0 "[ . 1 . 2]" 1
2080 1 68 GLN HB3 1 72 THR MG . . 3.700 3.416 2.684 3.783 0.083 8 0 "[ . 1 . 2]" 1
2081 1 68 GLN QE 1 71 VAL MG1 . . 5.500 4.647 3.627 5.240 . 0 0 "[ . 1 . 2]" 1
2082 1 68 GLN QE 1 72 THR MG . . 5.500 2.578 2.115 3.420 . 0 0 "[ . 1 . 2]" 1
2083 1 68 GLN HE21 1 72 THR H . . 5.500 5.506 5.122 5.574 0.074 14 0 "[ . 1 . 2]" 1
2084 1 68 GLN HE21 1 72 THR MG . . 5.500 3.232 2.857 3.735 . 0 0 "[ . 1 . 2]" 1
2085 1 68 GLN HE22 1 71 VAL MG1 . . 5.500 4.876 3.738 5.580 0.080 14 0 "[ . 1 . 2]" 1
2086 1 68 GLN HE22 1 72 THR MG . . 5.500 2.784 2.140 3.994 . 0 0 "[ . 1 . 2]" 1
2087 1 68 GLN HG2 1 69 HIS H . . 5.500 4.763 4.648 4.973 . 0 0 "[ . 1 . 2]" 1
2088 1 68 GLN HG3 1 69 HIS H . . 5.500 5.059 4.900 5.208 . 0 0 "[ . 1 . 2]" 1
2089 1 69 HIS H 1 69 HIS QB . . 3.430 2.176 2.124 2.219 . 0 0 "[ . 1 . 2]" 1
2090 1 69 HIS H 1 69 HIS HB3 . . 3.110 2.402 2.280 2.635 . 0 0 "[ . 1 . 2]" 1
2091 1 69 HIS H 1 69 HIS HD2 . . 5.240 4.824 4.588 5.072 . 0 0 "[ . 1 . 2]" 1
2092 1 69 HIS H 1 70 THR MG . . 5.500 5.584 5.418 5.611 0.111 14 0 "[ . 1 . 2]" 1
2093 1 69 HIS H 1 71 VAL H . . 4.760 4.048 3.781 4.208 . 0 0 "[ . 1 . 2]" 1
2094 1 69 HIS HA 1 69 HIS HD2 . . 4.930 4.365 4.028 4.636 . 0 0 "[ . 1 . 2]" 1
2095 1 69 HIS HA 1 72 THR H . . 5.240 3.982 3.038 4.416 . 0 0 "[ . 1 . 2]" 1
2096 1 69 HIS HA 1 72 THR MG . . 5.500 3.885 2.224 5.301 . 0 0 "[ . 1 . 2]" 1
2097 1 69 HIS HA 1 73 THR MG . . 5.500 4.280 3.785 5.458 . 0 0 "[ . 1 . 2]" 1
2098 1 69 HIS QB 1 70 THR HA . . 5.250 4.675 4.104 4.944 . 0 0 "[ . 1 . 2]" 1
2099 1 69 HIS QB 1 80 PHE QD . . 5.500 4.883 4.364 5.347 . 0 0 "[ . 1 . 2]" 1
2100 1 69 HIS HB3 1 69 HIS HD2 . . 3.110 2.564 2.479 2.711 . 0 0 "[ . 1 . 2]" 1
2101 1 69 HIS HB3 1 70 THR H . . 3.830 3.385 2.529 3.831 0.001 7 0 "[ . 1 . 2]" 1
2102 1 69 HIS HB3 1 71 VAL H . . 5.500 5.270 4.935 5.579 0.079 20 0 "[ . 1 . 2]" 1
2103 1 69 HIS HD2 1 70 THR MG . . 5.500 5.577 5.218 5.627 0.127 17 0 "[ . 1 . 2]" 1
2104 1 69 HIS HD2 1 73 THR MG . . 4.770 4.776 4.478 4.869 0.099 3 0 "[ . 1 . 2]" 1
2105 1 69 HIS HD2 1 80 PHE QD . . 3.570 3.298 2.984 3.666 0.096 12 0 "[ . 1 . 2]" 1
2106 1 69 HIS HD2 1 80 PHE QE . . 3.460 2.591 2.268 2.951 . 0 0 "[ . 1 . 2]" 1
2107 1 69 HIS HD2 1 88 MET ME . . 3.350 2.748 2.067 3.447 0.097 12 0 "[ . 1 . 2]" 1
2108 1 69 HIS HE1 1 73 THR MG . . 3.800 3.692 3.157 3.883 0.083 5 0 "[ . 1 . 2]" 1
2109 1 69 HIS HE1 1 80 PHE QE . . 4.860 4.224 3.969 4.749 . 0 0 "[ . 1 . 2]" 1
2110 1 70 THR H 1 70 THR HB . . 3.760 2.403 2.232 2.725 . 0 0 "[ . 1 . 2]" 1
2111 1 70 THR H 1 70 THR MG . . 3.970 3.741 3.668 3.840 . 0 0 "[ . 1 . 2]" 1
2112 1 70 THR H 1 71 VAL H . . 3.440 2.273 1.953 2.838 . 0 0 "[ . 1 . 2]" 1
2113 1 70 THR H 1 71 VAL MG2 . . 5.500 3.849 3.575 4.451 . 0 0 "[ . 1 . 2]" 1
2114 1 70 THR H 1 72 THR H . . 4.100 4.054 3.606 4.190 0.090 15 0 "[ . 1 . 2]" 1
2115 1 70 THR HA 1 70 THR MG . . 3.350 2.460 2.276 2.674 . 0 0 "[ . 1 . 2]" 1
2116 1 70 THR HA 1 71 VAL MG2 . . 5.150 4.576 4.256 4.931 . 0 0 "[ . 1 . 2]" 1
2117 1 70 THR HA 1 74 THR H . . 3.250 3.304 3.194 3.344 0.094 7 0 "[ . 1 . 2]" 1
2118 1 70 THR HA 1 80 PHE QD . . 3.780 3.630 3.094 3.878 0.098 15 0 "[ . 1 . 2]" 1
2119 1 70 THR HA 1 88 MET ME . . 5.500 4.825 4.483 5.164 . 0 0 "[ . 1 . 2]" 1
2120 1 70 THR HB 1 71 VAL H . . 3.940 3.554 2.502 3.887 . 0 0 "[ . 1 . 2]" 1
2121 1 70 THR HB 1 71 VAL MG2 . . 5.500 3.374 2.660 3.817 . 0 0 "[ . 1 . 2]" 1
2122 1 70 THR MG 1 71 VAL H . . 4.380 4.084 3.297 4.318 . 0 0 "[ . 1 . 2]" 1
2123 1 70 THR MG 1 71 VAL MG2 . . 3.210 3.268 3.091 3.347 0.137 7 0 "[ . 1 . 2]" 1
2124 1 70 THR MG 1 80 PHE HB2 . . 4.960 3.891 2.960 4.207 . 0 0 "[ . 1 . 2]" 1
2125 1 70 THR MG 1 80 PHE HB3 . . 5.500 5.320 4.424 5.601 0.101 1 0 "[ . 1 . 2]" 1
2126 1 70 THR MG 1 80 PHE QD . . 4.040 3.862 2.803 4.128 0.088 1 0 "[ . 1 . 2]" 1
2127 1 71 VAL H 1 71 VAL HB . . 3.170 2.463 2.174 2.635 . 0 0 "[ . 1 . 2]" 1
2128 1 71 VAL H 1 71 VAL MG2 . . 3.200 2.950 2.305 3.172 . 0 0 "[ . 1 . 2]" 1
2129 1 71 VAL HA 1 71 VAL MG1 . . 3.260 2.588 2.474 2.701 . 0 0 "[ . 1 . 2]" 1
2130 1 71 VAL HA 1 71 VAL MG2 . . 3.100 2.303 2.255 2.384 . 0 0 "[ . 1 . 2]" 1
2131 1 71 VAL HA 1 74 THR H . . 4.570 3.693 3.399 4.155 . 0 0 "[ . 1 . 2]" 1
2132 1 71 VAL HA 1 74 THR HB . . 3.940 3.986 3.734 4.031 0.091 20 0 "[ . 1 . 2]" 1
2133 1 71 VAL HA 1 74 THR MG . . 4.770 2.173 2.022 2.391 . 0 0 "[ . 1 . 2]" 1
2134 1 71 VAL HB 1 72 THR H . . 3.530 2.654 2.249 3.246 . 0 0 "[ . 1 . 2]" 1
2135 1 71 VAL HB 1 72 THR HA . . 5.260 4.805 4.571 5.047 . 0 0 "[ . 1 . 2]" 1
2136 1 71 VAL HB 1 72 THR MG . . 4.670 3.663 3.005 4.700 0.030 7 0 "[ . 1 . 2]" 1
2137 1 71 VAL HB 1 73 THR H . . 5.470 4.859 4.599 5.351 . 0 0 "[ . 1 . 2]" 1
2138 1 71 VAL MG1 1 72 THR H . . 3.760 3.094 2.782 3.642 . 0 0 "[ . 1 . 2]" 1
2139 1 71 VAL MG1 1 72 THR HA . . 4.230 3.538 3.297 3.817 . 0 0 "[ . 1 . 2]" 1
2140 1 71 VAL MG1 1 74 THR MG . . 3.710 3.785 3.627 3.827 0.117 13 0 "[ . 1 . 2]" 1
2141 1 71 VAL MG2 1 74 THR MG . . 3.550 3.426 3.256 3.649 0.099 6 0 "[ . 1 . 2]" 1
2142 1 72 THR H 1 72 THR HB . . 3.540 3.115 1.950 3.605 0.065 13 0 "[ . 1 . 2]" 1
2143 1 72 THR H 1 72 THR MG . . 3.720 2.307 1.951 2.787 . 0 0 "[ . 1 . 2]" 1
2144 1 72 THR HA 1 72 THR HB . . 2.630 2.477 2.216 2.693 0.063 7 0 "[ . 1 . 2]" 1
2145 1 73 THR H 1 73 THR HA . . 2.940 2.932 2.834 2.975 0.035 14 0 "[ . 1 . 2]" 1
2146 1 73 THR H 1 73 THR HB . . 3.800 2.927 2.518 3.330 . 0 0 "[ . 1 . 2]" 1
2147 1 73 THR H 1 73 THR MG . . 4.270 3.951 3.792 4.124 . 0 0 "[ . 1 . 2]" 1
2148 1 73 THR H 1 74 THR H . . 3.310 1.995 1.868 2.192 . 0 0 "[ . 1 . 2]" 1
2149 1 73 THR H 1 74 THR HA . . 4.510 4.515 4.352 4.595 0.085 15 0 "[ . 1 . 2]" 1
2150 1 73 THR H 1 74 THR HB . . 5.360 4.203 3.865 4.431 . 0 0 "[ . 1 . 2]" 1
2151 1 73 THR H 1 74 THR MG . . 4.400 3.411 2.936 3.944 . 0 0 "[ . 1 . 2]" 1
2152 1 73 THR H 1 78 GLU H . . 5.500 5.566 5.515 5.595 0.095 13 0 "[ . 1 . 2]" 1
2153 1 73 THR H 1 78 GLU QB . . 5.500 4.329 4.027 4.737 . 0 0 "[ . 1 . 2]" 1
2154 1 73 THR HA 1 73 THR MG . . 3.380 2.339 2.266 2.482 . 0 0 "[ . 1 . 2]" 1
2155 1 73 THR HA 1 74 THR H . . 3.550 3.621 3.603 3.634 0.084 1 0 "[ . 1 . 2]" 1
2156 1 73 THR HA 1 76 LYS HB2 . . 4.160 3.164 2.582 3.821 . 0 0 "[ . 1 . 2]" 1
2157 1 73 THR HA 1 76 LYS HB3 . . 5.360 4.743 4.241 5.292 . 0 0 "[ . 1 . 2]" 1
2158 1 73 THR HA 1 76 LYS QD . . 4.700 3.614 2.170 4.767 0.067 18 0 "[ . 1 . 2]" 1
2159 1 73 THR HA 1 76 LYS QE . . 4.720 3.087 1.881 4.790 0.070 7 0 "[ . 1 . 2]" 1
2160 1 73 THR HA 1 76 LYS HG2 . . 5.110 4.669 4.047 5.179 0.069 18 0 "[ . 1 . 2]" 1
2161 1 73 THR HA 1 76 LYS HG3 . . 4.800 3.041 2.371 3.819 . 0 0 "[ . 1 . 2]" 1
2162 1 73 THR HA 1 77 GLY H . . 4.730 4.485 3.980 4.810 0.080 10 0 "[ . 1 . 2]" 1
2163 1 73 THR HA 1 78 GLU H . . 5.500 4.491 4.147 4.865 . 0 0 "[ . 1 . 2]" 1
2164 1 73 THR HA 1 78 GLU QB . . 4.100 3.699 3.409 4.155 0.055 15 0 "[ . 1 . 2]" 1
2165 1 73 THR HB 1 74 THR H . . 4.150 2.753 2.483 3.055 . 0 0 "[ . 1 . 2]" 1
2166 1 73 THR HB 1 74 THR HA . . 4.170 4.213 4.117 4.255 0.085 4 0 "[ . 1 . 2]" 1
2167 1 73 THR HB 1 74 THR MG . . 5.180 4.888 4.539 5.202 0.022 6 0 "[ . 1 . 2]" 1
2168 1 73 THR HB 1 78 GLU QB . . 3.690 2.517 2.194 2.876 . 0 0 "[ . 1 . 2]" 1
2169 1 73 THR HB 1 78 GLU HG2 . . 4.610 3.239 2.394 4.408 . 0 0 "[ . 1 . 2]" 1
2170 1 73 THR HB 1 78 GLU HG3 . . 4.530 3.637 2.325 4.488 . 0 0 "[ . 1 . 2]" 1
2171 1 73 THR HB 1 80 PHE QD . . 5.430 4.833 4.406 5.144 . 0 0 "[ . 1 . 2]" 1
2172 1 73 THR HB 1 80 PHE QE . . 4.490 4.011 3.184 4.567 0.077 15 0 "[ . 1 . 2]" 1
2173 1 73 THR MG 1 74 THR H . . 4.400 4.032 3.798 4.236 . 0 0 "[ . 1 . 2]" 1
2174 1 73 THR MG 1 74 THR HA . . 4.670 4.450 4.115 4.699 0.029 19 0 "[ . 1 . 2]" 1
2175 1 73 THR MG 1 75 THR H . . 5.500 5.346 5.204 5.567 0.067 13 0 "[ . 1 . 2]" 1
2176 1 73 THR MG 1 76 LYS QE . . 5.500 3.061 1.955 4.573 . 0 0 "[ . 1 . 2]" 1
2177 1 73 THR MG 1 77 GLY H . . 5.500 4.168 3.446 4.981 . 0 0 "[ . 1 . 2]" 1
2178 1 73 THR MG 1 78 GLU H . . 5.500 3.620 3.206 4.062 . 0 0 "[ . 1 . 2]" 1
2179 1 73 THR MG 1 78 GLU HA . . 5.500 4.320 3.911 4.476 . 0 0 "[ . 1 . 2]" 1
2180 1 73 THR MG 1 78 GLU QB . . 3.610 2.125 1.913 2.231 . 0 0 "[ . 1 . 2]" 1
2181 1 73 THR MG 1 79 ASN H . . 5.500 5.361 5.034 5.563 0.063 15 0 "[ . 1 . 2]" 1
2182 1 73 THR MG 1 80 PHE QD . . 4.980 4.907 4.364 5.115 0.135 15 0 "[ . 1 . 2]" 1
2183 1 73 THR MG 1 80 PHE QE . . 4.020 3.398 2.757 3.985 . 0 0 "[ . 1 . 2]" 1
2184 1 74 THR H 1 74 THR HB . . 3.700 2.338 2.200 2.524 . 0 0 "[ . 1 . 2]" 1
2185 1 74 THR H 1 74 THR MG . . 3.760 2.514 2.124 2.776 . 0 0 "[ . 1 . 2]" 1
2186 1 74 THR H 1 75 THR H . . 3.440 2.840 2.608 3.284 . 0 0 "[ . 1 . 2]" 1
2187 1 74 THR H 1 75 THR HB . . 5.100 4.529 4.161 5.103 0.003 13 0 "[ . 1 . 2]" 1
2188 1 74 THR H 1 78 GLU H . . 5.300 4.262 4.085 4.450 . 0 0 "[ . 1 . 2]" 1
2189 1 74 THR H 1 78 GLU QB . . 5.500 3.148 2.675 4.020 . 0 0 "[ . 1 . 2]" 1
2190 1 74 THR HA 1 74 THR MG . . 3.370 3.240 3.204 3.269 . 0 0 "[ . 1 . 2]" 1
2191 1 74 THR HA 1 75 THR H . . 3.590 3.541 3.434 3.613 0.023 13 0 "[ . 1 . 2]" 1
2192 1 74 THR HA 1 76 LYS H . . 4.860 3.552 3.230 3.930 . 0 0 "[ . 1 . 2]" 1
2193 1 74 THR HA 1 77 GLY H . . 4.770 3.390 2.744 4.082 . 0 0 "[ . 1 . 2]" 1
2194 1 74 THR HA 1 78 GLU H . . 3.870 2.261 2.012 2.499 . 0 0 "[ . 1 . 2]" 1
2195 1 74 THR HA 1 78 GLU QB . . 3.660 2.545 2.137 3.068 . 0 0 "[ . 1 . 2]" 1
2196 1 74 THR HA 1 79 ASN H . . 4.780 4.729 4.272 4.862 0.082 2 0 "[ . 1 . 2]" 1
2197 1 74 THR HB 1 75 THR H . . 3.990 3.988 3.742 4.071 0.081 9 0 "[ . 1 . 2]" 1
2198 1 74 THR HB 1 78 GLU QB . . 5.490 3.513 2.610 4.532 . 0 0 "[ . 1 . 2]" 1
2199 1 74 THR HB 1 78 GLU HG2 . . 5.500 5.170 2.676 5.581 0.081 12 0 "[ . 1 . 2]" 1
2200 1 74 THR HB 1 78 GLU HG3 . . 5.500 5.193 3.759 5.579 0.079 11 0 "[ . 1 . 2]" 1
2201 1 74 THR HB 1 79 ASN HA . . 3.750 3.733 3.175 3.842 0.092 20 0 "[ . 1 . 2]" 1
2202 1 74 THR MG 1 75 THR H . . 3.800 2.361 2.037 2.669 . 0 0 "[ . 1 . 2]" 1
2203 1 74 THR MG 1 78 GLU H . . 5.500 4.997 4.690 5.241 . 0 0 "[ . 1 . 2]" 1
2204 1 75 THR H 1 75 THR HB . . 3.070 2.203 1.983 2.508 . 0 0 "[ . 1 . 2]" 1
2205 1 75 THR HA 1 75 THR MG . . 3.150 2.686 2.461 2.917 . 0 0 "[ . 1 . 2]" 1
2206 1 75 THR HA 1 76 LYS H . . 3.580 3.546 3.441 3.636 0.056 6 0 "[ . 1 . 2]" 1
2207 1 75 THR HB 1 76 LYS H . . 4.060 3.086 2.804 3.420 . 0 0 "[ . 1 . 2]" 1
2208 1 75 THR HB 1 76 LYS HB2 . . 5.500 4.933 4.196 5.439 . 0 0 "[ . 1 . 2]" 1
2209 1 75 THR HB 1 76 LYS HG2 . . 5.500 4.378 3.497 5.062 . 0 0 "[ . 1 . 2]" 1
2210 1 75 THR MG 1 76 LYS H . . 4.640 3.450 3.094 3.746 . 0 0 "[ . 1 . 2]" 1
2211 1 75 THR MG 1 76 LYS HA . . 5.350 3.448 2.900 3.807 . 0 0 "[ . 1 . 2]" 1
2212 1 75 THR MG 1 76 LYS QD . . 5.010 4.062 3.559 4.356 . 0 0 "[ . 1 . 2]" 1
2213 1 75 THR MG 1 76 LYS QE . . 4.950 4.828 4.396 5.070 0.120 14 0 "[ . 1 . 2]" 1
2214 1 75 THR MG 1 76 LYS HG2 . . 2.950 2.949 2.591 3.050 0.100 10 0 "[ . 1 . 2]" 1
2215 1 75 THR MG 1 76 LYS HG3 . . 2.920 2.847 2.302 3.050 0.130 9 0 "[ . 1 . 2]" 1
2216 1 76 LYS H 1 76 LYS HB2 . . 3.410 2.539 2.353 2.645 . 0 0 "[ . 1 . 2]" 1
2217 1 76 LYS H 1 76 LYS HB3 . . 3.860 3.673 3.573 3.736 . 0 0 "[ . 1 . 2]" 1
2218 1 76 LYS H 1 76 LYS QD . . 4.760 4.349 3.836 4.696 . 0 0 "[ . 1 . 2]" 1
2219 1 76 LYS H 1 76 LYS HG2 . . 4.070 3.679 3.491 4.057 . 0 0 "[ . 1 . 2]" 1
2220 1 76 LYS H 1 76 LYS HG3 . . 4.560 2.667 2.397 3.079 . 0 0 "[ . 1 . 2]" 1
2221 1 76 LYS H 1 77 GLY H . . 3.280 2.458 1.944 2.973 . 0 0 "[ . 1 . 2]" 1
2222 1 76 LYS H 1 77 GLY HA2 . . 5.500 4.713 4.419 4.925 . 0 0 "[ . 1 . 2]" 1
2223 1 76 LYS H 1 78 GLU H . . 3.280 3.310 3.210 3.368 0.088 6 0 "[ . 1 . 2]" 1
2224 1 76 LYS HA 1 76 LYS QD . . 4.320 4.083 3.768 4.355 0.035 14 0 "[ . 1 . 2]" 1
2225 1 76 LYS HA 1 76 LYS QE . . 5.500 4.275 3.797 4.536 . 0 0 "[ . 1 . 2]" 1
2226 1 76 LYS HA 1 76 LYS HG2 . . 4.150 2.559 2.316 2.777 . 0 0 "[ . 1 . 2]" 1
2227 1 76 LYS HA 1 76 LYS HG3 . . 3.630 3.230 3.032 3.372 . 0 0 "[ . 1 . 2]" 1
2228 1 76 LYS HA 1 77 GLY HA2 . . 5.150 4.717 4.579 4.907 . 0 0 "[ . 1 . 2]" 1
2229 1 76 LYS HA 1 78 GLU H . . 5.060 5.130 5.076 5.153 0.093 6 0 "[ . 1 . 2]" 1
2230 1 76 LYS HB2 1 77 GLY H . . 4.710 2.651 1.853 3.526 . 0 0 "[ . 1 . 2]" 1
2231 1 76 LYS HB2 1 77 GLY HA2 . . 5.500 4.984 4.626 5.438 . 0 0 "[ . 1 . 2]" 1
2232 1 76 LYS HB2 1 77 GLY HA3 . . 5.320 4.318 4.161 4.631 . 0 0 "[ . 1 . 2]" 1
2233 1 76 LYS HB2 1 78 GLU H . . 4.410 3.718 3.400 4.229 . 0 0 "[ . 1 . 2]" 1
2234 1 76 LYS HB3 1 76 LYS QD . . 3.150 2.665 2.250 3.161 0.011 11 0 "[ . 1 . 2]" 1
2235 1 76 LYS HB3 1 77 GLY H . . 4.800 3.607 2.873 4.350 . 0 0 "[ . 1 . 2]" 1
2236 1 76 LYS HB3 1 78 GLU H . . 5.160 5.009 4.781 5.244 0.084 16 0 "[ . 1 . 2]" 1
2237 1 76 LYS QE 1 77 GLY HA3 . . 5.500 5.562 5.241 5.603 0.103 5 0 "[ . 1 . 2]" 1
2238 1 76 LYS HG3 1 77 GLY H . . 5.500 4.391 4.039 4.971 . 0 0 "[ . 1 . 2]" 1
2239 1 77 GLY H 1 78 GLU H . . 3.250 1.918 1.634 2.268 . 0 0 "[ . 1 . 2]" 1
2240 1 77 GLY H 1 78 GLU HA . . 5.500 4.486 4.274 4.885 . 0 0 "[ . 1 . 2]" 1
2241 1 77 GLY H 1 78 GLU QB . . 5.090 3.454 3.152 3.919 . 0 0 "[ . 1 . 2]" 1
2242 1 77 GLY HA2 1 78 GLU QB . . 4.850 4.898 4.650 4.957 0.107 19 0 "[ . 1 . 2]" 1
2243 1 77 GLY HA3 1 78 GLU QB . . 5.500 4.625 4.248 4.961 . 0 0 "[ . 1 . 2]" 1
2244 1 78 GLU H 1 78 GLU QB . . 3.060 2.102 1.888 2.335 . 0 0 "[ . 1 . 2]" 1
2245 1 78 GLU H 1 78 GLU HG3 . . 4.490 4.504 4.330 4.748 0.258 13 0 "[ . 1 . 2]" 1
2246 1 78 GLU H 1 79 ASN H . . 4.630 4.608 4.470 4.688 0.058 11 0 "[ . 1 . 2]" 1
2247 1 78 GLU HA 1 78 GLU HG2 . . 3.930 3.345 2.519 3.908 . 0 0 "[ . 1 . 2]" 1
2248 1 78 GLU HA 1 78 GLU HG3 . . 3.610 3.091 2.457 3.861 0.251 5 0 "[ . 1 . 2]" 1
2249 1 78 GLU HA 1 79 ASN H . . 2.780 2.357 2.159 2.502 . 0 0 "[ . 1 . 2]" 1
2250 1 78 GLU HA 1 79 ASN HA . . 4.510 4.532 4.288 4.574 0.064 16 0 "[ . 1 . 2]" 1
2251 1 78 GLU HA 1 79 ASN HB2 . . 5.060 4.718 4.275 4.980 . 0 0 "[ . 1 . 2]" 1
2252 1 78 GLU HA 1 79 ASN HB3 . . 4.760 4.538 4.126 4.848 0.088 12 0 "[ . 1 . 2]" 1
2253 1 78 GLU HA 1 80 PHE H . . 5.290 4.595 3.786 5.343 0.053 17 0 "[ . 1 . 2]" 1
2254 1 78 GLU QB 1 79 ASN H . . 3.420 3.217 2.850 3.378 . 0 0 "[ . 1 . 2]" 1
2255 1 78 GLU QB 1 79 ASN HA . . 4.950 4.124 3.504 4.877 . 0 0 "[ . 1 . 2]" 1
2256 1 78 GLU QB 1 79 ASN HB2 . . 5.500 5.243 4.888 5.585 0.085 9 0 "[ . 1 . 2]" 1
2257 1 78 GLU QB 1 79 ASN HB3 . . 5.500 5.508 5.154 5.619 0.119 6 0 "[ . 1 . 2]" 1
2258 1 78 GLU QB 1 80 PHE H . . 5.400 4.629 4.067 5.240 . 0 0 "[ . 1 . 2]" 1
2259 1 78 GLU QB 1 80 PHE QD . . 4.270 4.145 3.606 4.387 0.117 13 0 "[ . 1 . 2]" 1
2260 1 78 GLU QB 1 80 PHE QE . . 4.540 3.837 3.346 4.347 . 0 0 "[ . 1 . 2]" 1
2261 1 78 GLU HG2 1 79 ASN H . . 4.160 3.299 1.739 4.209 0.049 20 0 "[ . 1 . 2]" 1
2262 1 78 GLU HG2 1 79 ASN HA . . 5.500 4.910 3.385 5.570 0.070 10 0 "[ . 1 . 2]" 1
2263 1 78 GLU HG2 1 80 PHE H . . 5.500 4.497 2.802 5.560 0.060 15 0 "[ . 1 . 2]" 1
2264 1 78 GLU HG2 1 80 PHE QD . . 5.500 3.318 2.579 4.211 . 0 0 "[ . 1 . 2]" 1
2265 1 78 GLU HG2 1 80 PHE QE . . 5.500 2.686 2.097 4.701 . 0 0 "[ . 1 . 2]" 1
2266 1 78 GLU HG3 1 79 ASN H . . 4.570 2.811 1.885 4.218 . 0 0 "[ . 1 . 2]" 1
2267 1 78 GLU HG3 1 79 ASN HA . . 5.500 4.547 3.394 5.552 0.052 13 0 "[ . 1 . 2]" 1
2268 1 78 GLU HG3 1 80 PHE H . . 5.500 4.012 2.853 5.109 . 0 0 "[ . 1 . 2]" 1
2269 1 78 GLU HG3 1 80 PHE QD . . 5.410 3.075 2.567 3.585 . 0 0 "[ . 1 . 2]" 1
2270 1 78 GLU HG3 1 80 PHE QE . . 4.300 2.778 2.152 3.882 . 0 0 "[ . 1 . 2]" 1
2271 1 79 ASN H 1 79 ASN HB2 . . 3.640 3.587 3.295 3.711 0.071 20 0 "[ . 1 . 2]" 1
2272 1 79 ASN H 1 79 ASN HB3 . . 3.510 3.048 2.724 3.377 . 0 0 "[ . 1 . 2]" 1
2273 1 79 ASN H 1 79 ASN HD21 . . 5.500 4.896 4.527 5.250 . 0 0 "[ . 1 . 2]" 1
2274 1 79 ASN H 1 80 PHE H . . 3.130 2.550 1.766 3.214 0.084 20 0 "[ . 1 . 2]" 1
2275 1 79 ASN H 1 80 PHE HA . . 4.720 4.041 3.849 4.265 . 0 0 "[ . 1 . 2]" 1
2276 1 79 ASN H 1 80 PHE QD . . 5.150 4.023 3.295 4.618 . 0 0 "[ . 1 . 2]" 1
2277 1 79 ASN HA 1 79 ASN HD21 . . 4.850 4.226 2.752 4.562 . 0 0 "[ . 1 . 2]" 1
2278 1 79 ASN HA 1 79 ASN HD22 . . 5.500 4.589 4.118 4.872 . 0 0 "[ . 1 . 2]" 1
2279 1 79 ASN HA 1 80 PHE HB2 . . 5.500 4.723 4.505 4.936 . 0 0 "[ . 1 . 2]" 1
2280 1 79 ASN HB2 1 81 THR MG . . 5.410 5.493 5.374 5.552 0.142 19 0 "[ . 1 . 2]" 1
2281 1 79 ASN HB3 1 80 PHE HA . . 5.500 4.616 3.992 5.157 . 0 0 "[ . 1 . 2]" 1
2282 1 79 ASN HB3 1 81 THR MG . . 5.500 4.462 4.250 4.892 . 0 0 "[ . 1 . 2]" 1
2283 1 79 ASN HD21 1 80 PHE HA . . 5.010 4.632 3.840 5.380 0.370 16 0 "[ . 1 . 2]" 1
2284 1 79 ASN HD21 1 81 THR MG . . 5.120 2.743 2.444 4.554 . 0 0 "[ . 1 . 2]" 1
2285 1 79 ASN HD22 1 81 THR HA . . 4.500 3.627 2.840 4.129 . 0 0 "[ . 1 . 2]" 1
2286 1 79 ASN HD22 1 81 THR MG . . 5.500 2.857 2.162 3.920 . 0 0 "[ . 1 . 2]" 1
2287 1 80 PHE H 1 80 PHE HB2 . . 3.590 3.031 2.259 3.642 0.052 19 0 "[ . 1 . 2]" 1
2288 1 80 PHE H 1 80 PHE QD . . 3.890 3.207 2.374 3.691 . 0 0 "[ . 1 . 2]" 1
2289 1 80 PHE H 1 81 THR H . . 4.800 3.985 3.456 4.494 . 0 0 "[ . 1 . 2]" 1
2290 1 80 PHE H 1 81 THR MG . . 5.500 5.102 4.491 5.569 0.069 12 0 "[ . 1 . 2]" 1
2291 1 80 PHE H 1 84 ASP HB2 . . 5.500 5.112 4.809 5.395 . 0 0 "[ . 1 . 2]" 1
2292 1 80 PHE H 1 85 VAL MG2 . . 5.500 4.847 4.204 5.483 . 0 0 "[ . 1 . 2]" 1
2293 1 80 PHE HA 1 80 PHE QD . . 3.320 2.513 2.239 2.970 . 0 0 "[ . 1 . 2]" 1
2294 1 80 PHE HA 1 81 THR H . . 3.050 2.143 2.040 2.180 . 0 0 "[ . 1 . 2]" 1
2295 1 80 PHE HA 1 81 THR MG . . 4.420 4.379 4.145 4.516 0.096 3 0 "[ . 1 . 2]" 1
2296 1 80 PHE HA 1 84 ASP H . . 5.390 4.935 4.732 5.151 . 0 0 "[ . 1 . 2]" 1
2297 1 80 PHE HA 1 84 ASP HB2 . . 4.400 2.810 2.582 3.038 . 0 0 "[ . 1 . 2]" 1
2298 1 80 PHE HA 1 84 ASP HB3 . . 4.890 3.477 3.101 3.832 . 0 0 "[ . 1 . 2]" 1
2299 1 80 PHE HA 1 85 VAL H . . 5.500 4.787 4.604 5.020 . 0 0 "[ . 1 . 2]" 1
2300 1 80 PHE HA 1 85 VAL MG2 . . 5.500 4.072 3.878 4.285 . 0 0 "[ . 1 . 2]" 1
2301 1 80 PHE HA 1 88 MET ME . . 5.500 4.425 4.120 4.759 . 0 0 "[ . 1 . 2]" 1
2302 1 80 PHE HB2 1 81 THR H . . 4.640 4.475 4.336 4.588 . 0 0 "[ . 1 . 2]" 1
2303 1 80 PHE HB2 1 84 ASP HB2 . . 4.720 4.158 3.818 4.773 0.053 13 0 "[ . 1 . 2]" 1
2304 1 80 PHE HB2 1 84 ASP HB3 . . 4.930 4.677 4.148 5.000 0.070 12 0 "[ . 1 . 2]" 1
2305 1 80 PHE HB2 1 85 VAL H . . 5.500 4.766 4.406 5.092 . 0 0 "[ . 1 . 2]" 1
2306 1 80 PHE HB2 1 85 VAL MG2 . . 4.290 2.720 2.475 2.924 . 0 0 "[ . 1 . 2]" 1
2307 1 80 PHE HB2 1 88 MET ME . . 5.140 2.521 2.178 2.860 . 0 0 "[ . 1 . 2]" 1
2308 1 80 PHE HB3 1 81 THR H . . 3.990 3.715 3.427 3.866 . 0 0 "[ . 1 . 2]" 1
2309 1 80 PHE HB3 1 84 ASP HA . . 5.240 4.942 4.655 5.136 . 0 0 "[ . 1 . 2]" 1
2310 1 80 PHE HB3 1 84 ASP HB2 . . 3.800 2.539 2.157 3.167 . 0 0 "[ . 1 . 2]" 1
2311 1 80 PHE HB3 1 84 ASP HB3 . . 4.330 3.024 2.448 3.371 . 0 0 "[ . 1 . 2]" 1
2312 1 80 PHE HB3 1 85 VAL H . . 5.340 3.369 3.146 3.586 . 0 0 "[ . 1 . 2]" 1
2313 1 80 PHE HB3 1 85 VAL HA . . 5.400 3.588 3.207 3.956 . 0 0 "[ . 1 . 2]" 1
2314 1 80 PHE HB3 1 85 VAL HB . . 5.170 4.598 4.295 4.970 . 0 0 "[ . 1 . 2]" 1
2315 1 80 PHE HB3 1 85 VAL MG2 . . 3.980 2.360 2.203 2.557 . 0 0 "[ . 1 . 2]" 1
2316 1 80 PHE HB3 1 88 MET ME . . 4.190 2.540 2.147 2.859 . 0 0 "[ . 1 . 2]" 1
2317 1 80 PHE QD 1 81 THR H . . 4.350 4.078 3.848 4.427 0.077 18 0 "[ . 1 . 2]" 1
2318 1 80 PHE QD 1 84 ASP HA . . 5.190 4.408 4.093 4.579 . 0 0 "[ . 1 . 2]" 1
2319 1 80 PHE QD 1 84 ASP HB2 . . 3.880 2.846 2.611 3.139 . 0 0 "[ . 1 . 2]" 1
2320 1 80 PHE QD 1 84 ASP HB3 . . 3.880 2.085 2.003 2.195 . 0 0 "[ . 1 . 2]" 1
2321 1 80 PHE QD 1 85 VAL H . . 4.760 4.793 4.453 4.856 0.096 8 0 "[ . 1 . 2]" 1
2322 1 80 PHE QD 1 85 VAL MG2 . . 4.130 4.041 3.839 4.183 0.053 14 0 "[ . 1 . 2]" 1
2323 1 80 PHE QD 1 88 MET ME . . 3.710 2.503 2.299 2.928 . 0 0 "[ . 1 . 2]" 1
2324 1 80 PHE QE 1 88 MET ME . . 4.520 3.414 3.047 4.037 . 0 0 "[ . 1 . 2]" 1
2325 1 81 THR H 1 81 THR MG . . 3.360 2.801 2.459 3.177 . 0 0 "[ . 1 . 2]" 1
2326 1 81 THR H 1 82 GLU H . . 5.110 4.621 4.559 4.687 . 0 0 "[ . 1 . 2]" 1
2327 1 81 THR H 1 83 THR H . . 5.500 5.180 4.922 5.500 0.000 20 0 "[ . 1 . 2]" 1
2328 1 81 THR H 1 84 ASP H . . 4.200 3.852 3.414 4.165 . 0 0 "[ . 1 . 2]" 1
2329 1 81 THR H 1 84 ASP HB2 . . 3.590 2.767 2.368 2.992 . 0 0 "[ . 1 . 2]" 1
2330 1 81 THR H 1 84 ASP HB3 . . 4.160 4.122 3.892 4.229 0.069 4 0 "[ . 1 . 2]" 1
2331 1 81 THR H 1 85 VAL H . . 4.990 4.413 4.137 4.671 . 0 0 "[ . 1 . 2]" 1
2332 1 81 THR H 1 85 VAL MG2 . . 5.500 4.257 3.979 4.610 . 0 0 "[ . 1 . 2]" 1
2333 1 81 THR HA 1 81 THR MG . . 3.140 2.152 2.092 2.246 . 0 0 "[ . 1 . 2]" 1
2334 1 81 THR HA 1 82 GLU H . . 3.110 2.563 2.436 2.657 . 0 0 "[ . 1 . 2]" 1
2335 1 81 THR HA 1 82 GLU HB2 . . 5.220 4.829 4.522 5.038 . 0 0 "[ . 1 . 2]" 1
2336 1 81 THR HA 1 82 GLU HB3 . . 5.290 4.801 4.602 4.956 . 0 0 "[ . 1 . 2]" 1
2337 1 81 THR HA 1 84 ASP H . . 4.860 4.748 4.646 4.900 0.040 8 0 "[ . 1 . 2]" 1
2338 1 81 THR HA 1 85 VAL MG2 . . 5.500 4.061 3.783 4.346 . 0 0 "[ . 1 . 2]" 1
2339 1 81 THR HB 1 82 GLU H . . 3.050 2.429 2.279 2.718 . 0 0 "[ . 1 . 2]" 1
2340 1 81 THR HB 1 82 GLU HA . . 5.460 4.682 4.605 4.824 . 0 0 "[ . 1 . 2]" 1
2341 1 81 THR HB 1 82 GLU HB2 . . 5.000 4.769 4.483 4.980 . 0 0 "[ . 1 . 2]" 1
2342 1 81 THR HB 1 82 GLU HB3 . . 4.970 3.750 3.576 3.916 . 0 0 "[ . 1 . 2]" 1
2343 1 81 THR HB 1 82 GLU HG2 . . 5.500 5.539 5.344 5.575 0.075 7 0 "[ . 1 . 2]" 1
2344 1 81 THR HB 1 83 THR H . . 3.710 2.856 2.679 2.955 . 0 0 "[ . 1 . 2]" 1
2345 1 81 THR HB 1 83 THR HA . . 5.500 5.574 5.467 5.599 0.099 1 0 "[ . 1 . 2]" 1
2346 1 81 THR HB 1 83 THR HB . . 5.230 4.173 3.971 4.338 . 0 0 "[ . 1 . 2]" 1
2347 1 81 THR HB 1 84 ASP H . . 4.950 3.666 3.426 3.957 . 0 0 "[ . 1 . 2]" 1
2348 1 81 THR MG 1 82 GLU H . . 4.170 3.109 2.876 3.391 . 0 0 "[ . 1 . 2]" 1
2349 1 81 THR MG 1 82 GLU HA . . 5.500 5.302 5.089 5.510 0.010 15 0 "[ . 1 . 2]" 1
2350 1 81 THR MG 1 82 GLU HB3 . . 4.640 4.607 4.245 4.753 0.113 14 0 "[ . 1 . 2]" 1
2351 1 81 THR MG 1 83 THR H . . 5.100 4.466 4.273 4.575 . 0 0 "[ . 1 . 2]" 1
2352 1 81 THR MG 1 83 THR HB . . 5.500 5.354 4.899 5.588 0.088 1 0 "[ . 1 . 2]" 1
2353 1 81 THR MG 1 84 ASP H . . 5.370 4.867 4.567 5.050 . 0 0 "[ . 1 . 2]" 1
2354 1 81 THR MG 1 84 ASP HB2 . . 5.250 4.947 4.532 5.333 0.083 8 0 "[ . 1 . 2]" 1
2355 1 82 GLU H 1 82 GLU HB2 . . 3.470 2.515 2.269 2.665 . 0 0 "[ . 1 . 2]" 1
2356 1 82 GLU H 1 82 GLU HB3 . . 3.220 2.251 2.180 2.332 . 0 0 "[ . 1 . 2]" 1
2357 1 82 GLU H 1 82 GLU HG2 . . 4.160 4.235 4.222 4.245 0.085 16 0 "[ . 1 . 2]" 1
2358 1 82 GLU H 1 82 GLU HG3 . . 4.420 4.391 4.268 4.468 0.048 2 0 "[ . 1 . 2]" 1
2359 1 82 GLU H 1 83 THR H . . 3.560 2.987 2.924 3.088 . 0 0 "[ . 1 . 2]" 1
2360 1 82 GLU H 1 83 THR HA . . 5.500 5.432 5.369 5.539 0.039 10 0 "[ . 1 . 2]" 1
2361 1 82 GLU H 1 83 THR HB . . 5.340 5.375 5.273 5.413 0.073 9 0 "[ . 1 . 2]" 1
2362 1 82 GLU H 1 84 ASP H . . 5.140 4.320 4.208 4.427 . 0 0 "[ . 1 . 2]" 1
2363 1 82 GLU H 1 85 VAL H . . 5.500 4.695 4.626 4.782 . 0 0 "[ . 1 . 2]" 1
2364 1 82 GLU H 1 85 VAL MG1 . . 5.500 5.557 5.243 5.601 0.101 5 0 "[ . 1 . 2]" 1
2365 1 82 GLU H 1 85 VAL MG2 . . 5.500 4.558 4.244 4.788 . 0 0 "[ . 1 . 2]" 1
2366 1 82 GLU HA 1 82 GLU HG2 . . 3.660 3.353 3.114 3.487 . 0 0 "[ . 1 . 2]" 1
2367 1 82 GLU HA 1 82 GLU HG3 . . 4.060 2.648 2.545 2.745 . 0 0 "[ . 1 . 2]" 1
2368 1 82 GLU HA 1 83 THR HA . . 5.180 4.684 4.582 4.843 . 0 0 "[ . 1 . 2]" 1
2369 1 82 GLU HA 1 84 ASP H . . 5.390 4.345 4.083 4.572 . 0 0 "[ . 1 . 2]" 1
2370 1 82 GLU HA 1 85 VAL HA . . 5.450 5.341 5.121 5.517 0.067 3 0 "[ . 1 . 2]" 1
2371 1 82 GLU HA 1 85 VAL HB . . 2.880 2.370 2.144 2.542 . 0 0 "[ . 1 . 2]" 1
2372 1 82 GLU HA 1 85 VAL MG1 . . 4.520 3.463 3.125 3.572 . 0 0 "[ . 1 . 2]" 1
2373 1 82 GLU HA 1 85 VAL MG2 . . 3.660 3.447 3.180 3.641 . 0 0 "[ . 1 . 2]" 1
2374 1 82 GLU HA 1 86 LYS H . . 4.740 3.899 3.555 4.128 . 0 0 "[ . 1 . 2]" 1
2375 1 82 GLU HB2 1 83 THR H . . 4.210 4.007 3.870 4.168 . 0 0 "[ . 1 . 2]" 1
2376 1 82 GLU HB2 1 83 THR HA . . 5.500 5.533 5.360 5.581 0.081 15 0 "[ . 1 . 2]" 1
2377 1 82 GLU HB3 1 83 THR H . . 3.750 2.622 2.423 2.815 . 0 0 "[ . 1 . 2]" 1
2378 1 82 GLU HG2 1 83 THR H . . 5.250 3.180 2.976 3.437 . 0 0 "[ . 1 . 2]" 1
2379 1 82 GLU HG2 1 83 THR HA . . 5.500 3.167 2.847 3.619 . 0 0 "[ . 1 . 2]" 1
2380 1 82 GLU HG2 1 85 VAL MG1 . . 5.500 5.434 5.168 5.582 0.082 3 0 "[ . 1 . 2]" 1
2381 1 82 GLU HG2 1 86 LYS QE . . 5.240 3.906 3.301 4.794 . 0 0 "[ . 1 . 2]" 1
2382 1 82 GLU HG3 1 83 THR H . . 4.950 4.313 4.154 4.468 . 0 0 "[ . 1 . 2]" 1
2383 1 82 GLU HG3 1 83 THR HA . . 5.500 4.370 4.083 4.583 . 0 0 "[ . 1 . 2]" 1
2384 1 82 GLU HG3 1 85 VAL H . . 5.500 5.533 5.213 5.591 0.091 8 0 "[ . 1 . 2]" 1
2385 1 82 GLU HG3 1 85 VAL HB . . 4.800 4.327 3.990 4.540 . 0 0 "[ . 1 . 2]" 1
2386 1 82 GLU HG3 1 85 VAL MG1 . . 5.500 4.405 4.094 4.684 . 0 0 "[ . 1 . 2]" 1
2387 1 82 GLU HG3 1 86 LYS QE . . 5.150 4.433 3.566 5.227 0.077 7 0 "[ . 1 . 2]" 1
2388 1 83 THR H 1 83 THR HB . . 3.660 2.612 2.424 2.694 . 0 0 "[ . 1 . 2]" 1
2389 1 83 THR H 1 83 THR MG . . 4.660 3.766 3.671 3.829 . 0 0 "[ . 1 . 2]" 1
2390 1 83 THR H 1 84 ASP H . . 3.570 2.710 2.611 2.801 . 0 0 "[ . 1 . 2]" 1
2391 1 83 THR H 1 84 ASP HB2 . . 5.500 4.935 4.581 5.174 . 0 0 "[ . 1 . 2]" 1
2392 1 83 THR H 1 86 LYS H . . 4.750 4.735 4.605 4.819 0.069 11 0 "[ . 1 . 2]" 1
2393 1 83 THR HA 1 83 THR MG . . 3.470 2.417 2.326 2.645 . 0 0 "[ . 1 . 2]" 1
2394 1 83 THR HA 1 86 LYS H . . 4.270 3.480 3.221 3.723 . 0 0 "[ . 1 . 2]" 1
2395 1 83 THR HA 1 86 LYS HB2 . . 3.970 3.367 2.652 3.794 . 0 0 "[ . 1 . 2]" 1
2396 1 83 THR HA 1 86 LYS HB3 . . 4.260 2.903 2.345 3.206 . 0 0 "[ . 1 . 2]" 1
2397 1 83 THR HA 1 86 LYS QD . . 4.750 3.690 2.830 4.337 . 0 0 "[ . 1 . 2]" 1
2398 1 83 THR HA 1 86 LYS QE . . 5.480 3.382 2.157 4.200 . 0 0 "[ . 1 . 2]" 1
2399 1 83 THR HA 1 86 LYS HG2 . . 5.500 5.140 4.215 5.534 0.034 17 0 "[ . 1 . 2]" 1
2400 1 83 THR HA 1 86 LYS HG3 . . 5.400 5.320 4.734 5.488 0.088 16 0 "[ . 1 . 2]" 1
2401 1 83 THR HA 1 87 MET H . . 4.780 4.725 4.451 4.845 0.065 11 0 "[ . 1 . 2]" 1
2402 1 83 THR HB 1 84 ASP H . . 3.510 2.889 2.645 3.153 . 0 0 "[ . 1 . 2]" 1
2403 1 83 THR HB 1 84 ASP HA . . 5.500 4.361 4.076 4.724 . 0 0 "[ . 1 . 2]" 1
2404 1 83 THR MG 1 84 ASP H . . 4.760 3.859 3.696 3.987 . 0 0 "[ . 1 . 2]" 1
2405 1 83 THR MG 1 84 ASP HA . . 5.120 3.924 3.564 4.098 . 0 0 "[ . 1 . 2]" 1
2406 1 83 THR MG 1 85 VAL H . . 5.500 5.393 5.193 5.546 0.046 17 0 "[ . 1 . 2]" 1
2407 1 83 THR MG 1 86 LYS H . . 5.500 4.898 4.582 5.167 . 0 0 "[ . 1 . 2]" 1
2408 1 83 THR MG 1 86 LYS QD . . 5.500 3.495 2.870 4.297 . 0 0 "[ . 1 . 2]" 1
2409 1 83 THR MG 1 86 LYS QE . . 5.500 3.758 2.152 4.627 . 0 0 "[ . 1 . 2]" 1
2410 1 83 THR MG 1 87 MET H . . 5.100 4.780 4.399 5.093 . 0 0 "[ . 1 . 2]" 1
2411 1 83 THR MG 1 87 MET ME . . 3.420 2.753 2.365 3.535 0.115 16 0 "[ . 1 . 2]" 1
2412 1 83 THR MG 1 87 MET HG2 . . 4.270 3.716 3.478 3.987 . 0 0 "[ . 1 . 2]" 1
2413 1 83 THR MG 1 87 MET HG3 . . 4.410 4.425 4.212 4.509 0.099 9 0 "[ . 1 . 2]" 1
2414 1 84 ASP H 1 84 ASP HB2 . . 3.540 2.464 2.172 2.651 . 0 0 "[ . 1 . 2]" 1
2415 1 84 ASP H 1 84 ASP HB3 . . 4.120 3.552 3.352 3.635 . 0 0 "[ . 1 . 2]" 1
2416 1 84 ASP H 1 85 VAL H . . 3.510 2.407 2.224 2.620 . 0 0 "[ . 1 . 2]" 1
2417 1 84 ASP H 1 85 VAL HB . . 5.110 4.236 3.932 4.485 . 0 0 "[ . 1 . 2]" 1
2418 1 84 ASP H 1 85 VAL MG2 . . 5.300 4.273 4.098 4.449 . 0 0 "[ . 1 . 2]" 1
2419 1 84 ASP H 1 86 LYS H . . 4.410 3.945 3.702 4.073 . 0 0 "[ . 1 . 2]" 1
2420 1 84 ASP H 1 87 MET H . . 5.500 4.929 4.731 5.205 . 0 0 "[ . 1 . 2]" 1
2421 1 84 ASP HA 1 86 LYS H . . 5.500 4.487 4.278 4.706 . 0 0 "[ . 1 . 2]" 1
2422 1 84 ASP HA 1 87 MET H . . 4.130 3.531 3.243 3.792 . 0 0 "[ . 1 . 2]" 1
2423 1 84 ASP HA 1 87 MET HB2 . . 4.660 3.356 3.065 3.670 . 0 0 "[ . 1 . 2]" 1
2424 1 84 ASP HA 1 87 MET HG2 . . 5.040 3.059 2.640 3.467 . 0 0 "[ . 1 . 2]" 1
2425 1 84 ASP HA 1 87 MET HG3 . . 4.010 3.718 2.778 4.047 0.037 7 0 "[ . 1 . 2]" 1
2426 1 84 ASP HA 1 88 MET H . . 4.980 4.401 4.181 4.664 . 0 0 "[ . 1 . 2]" 1
2427 1 84 ASP HA 1 88 MET ME . . 5.460 5.201 4.603 5.529 0.069 4 0 "[ . 1 . 2]" 1
2428 1 84 ASP HB2 1 85 VAL H . . 4.120 2.539 2.235 2.998 . 0 0 "[ . 1 . 2]" 1
2429 1 84 ASP HB2 1 85 VAL MG2 . . 5.420 3.425 3.036 3.961 . 0 0 "[ . 1 . 2]" 1
2430 1 84 ASP HB2 1 88 MET ME . . 5.230 4.197 3.645 4.986 . 0 0 "[ . 1 . 2]" 1
2431 1 84 ASP HB3 1 85 VAL H . . 4.350 3.568 3.126 3.906 . 0 0 "[ . 1 . 2]" 1
2432 1 84 ASP HB3 1 85 VAL MG2 . . 5.490 4.336 3.771 4.884 . 0 0 "[ . 1 . 2]" 1
2433 1 84 ASP HB3 1 88 MET ME . . 4.190 3.961 3.502 4.273 0.083 18 0 "[ . 1 . 2]" 1
2434 1 85 VAL H 1 85 VAL HB . . 2.980 2.246 2.137 2.438 . 0 0 "[ . 1 . 2]" 1
2435 1 85 VAL H 1 85 VAL MG1 . . 4.110 3.689 3.607 3.762 . 0 0 "[ . 1 . 2]" 1
2436 1 85 VAL H 1 85 VAL MG2 . . 3.170 2.424 2.184 2.660 . 0 0 "[ . 1 . 2]" 1
2437 1 85 VAL H 1 86 LYS H . . 3.150 2.838 2.679 3.036 . 0 0 "[ . 1 . 2]" 1
2438 1 85 VAL H 1 88 MET H . . 5.490 4.751 4.584 4.942 . 0 0 "[ . 1 . 2]" 1
2439 1 85 VAL H 1 88 MET HB2 . . 5.500 5.079 4.623 5.376 . 0 0 "[ . 1 . 2]" 1
2440 1 85 VAL H 1 88 MET ME . . 4.560 4.046 3.531 4.418 . 0 0 "[ . 1 . 2]" 1
2441 1 85 VAL HA 1 85 VAL MG1 . . 3.470 2.660 2.495 2.832 . 0 0 "[ . 1 . 2]" 1
2442 1 85 VAL HA 1 85 VAL MG2 . . 3.240 2.262 2.159 2.345 . 0 0 "[ . 1 . 2]" 1
2443 1 85 VAL HA 1 86 LYS HA . . 5.210 4.878 4.794 4.961 . 0 0 "[ . 1 . 2]" 1
2444 1 85 VAL HA 1 87 MET H . . 5.500 4.227 4.078 4.387 . 0 0 "[ . 1 . 2]" 1
2445 1 85 VAL HA 1 87 MET HB2 . . 5.030 5.080 5.018 5.108 0.078 3 0 "[ . 1 . 2]" 1
2446 1 85 VAL HA 1 88 MET H . . 4.240 3.197 3.083 3.380 . 0 0 "[ . 1 . 2]" 1
2447 1 85 VAL HA 1 88 MET HB2 . . 3.900 2.826 2.304 3.374 . 0 0 "[ . 1 . 2]" 1
2448 1 85 VAL HA 1 88 MET HB3 . . 4.180 2.987 2.307 4.247 0.067 12 0 "[ . 1 . 2]" 1
2449 1 85 VAL HA 1 88 MET ME . . 3.270 2.278 1.988 2.428 . 0 0 "[ . 1 . 2]" 1
2450 1 85 VAL HA 1 89 GLU H . . 4.780 3.664 3.525 3.900 . 0 0 "[ . 1 . 2]" 1
2451 1 85 VAL HA 1 89 GLU HG3 . . 5.500 4.191 3.713 4.814 . 0 0 "[ . 1 . 2]" 1
2452 1 85 VAL HB 1 86 LYS H . . 3.490 2.827 2.666 3.026 . 0 0 "[ . 1 . 2]" 1
2453 1 85 VAL MG1 1 86 LYS H . . 4.320 3.111 2.854 3.453 . 0 0 "[ . 1 . 2]" 1
2454 1 85 VAL MG1 1 86 LYS HA . . 4.450 3.343 3.132 3.638 . 0 0 "[ . 1 . 2]" 1
2455 1 85 VAL MG1 1 86 LYS HG3 . . 5.500 5.558 5.356 5.608 0.108 2 0 "[ . 1 . 2]" 1
2456 1 85 VAL MG1 1 87 MET H . . 5.500 4.894 4.747 5.091 . 0 0 "[ . 1 . 2]" 1
2457 1 85 VAL MG1 1 88 MET H . . 5.500 4.662 4.551 4.899 . 0 0 "[ . 1 . 2]" 1
2458 1 85 VAL MG1 1 89 GLU H . . 5.010 3.642 3.445 3.973 . 0 0 "[ . 1 . 2]" 1
2459 1 85 VAL MG1 1 89 GLU HG3 . . 4.360 2.309 2.149 2.549 . 0 0 "[ . 1 . 2]" 1
2460 1 85 VAL MG2 1 86 LYS H . . 4.470 4.141 4.069 4.238 . 0 0 "[ . 1 . 2]" 1
2461 1 85 VAL MG2 1 87 MET H . . 5.500 5.488 5.384 5.572 0.072 18 0 "[ . 1 . 2]" 1
2462 1 85 VAL MG2 1 88 MET HB2 . . 5.500 4.215 3.778 4.690 . 0 0 "[ . 1 . 2]" 1
2463 1 85 VAL MG2 1 88 MET ME . . 3.940 2.349 1.998 2.674 . 0 0 "[ . 1 . 2]" 1
2464 1 85 VAL MG2 1 89 GLU H . . 5.500 4.994 4.832 5.231 . 0 0 "[ . 1 . 2]" 1
2465 1 86 LYS H 1 86 LYS HB2 . . 3.210 2.486 2.174 2.780 . 0 0 "[ . 1 . 2]" 1
2466 1 86 LYS H 1 86 LYS HB3 . . 3.490 2.413 2.141 2.604 . 0 0 "[ . 1 . 2]" 1
2467 1 86 LYS H 1 86 LYS QD . . 4.870 4.595 4.158 4.952 0.082 18 0 "[ . 1 . 2]" 1
2468 1 86 LYS H 1 86 LYS QE . . 5.500 4.375 3.778 5.212 . 0 0 "[ . 1 . 2]" 1
2469 1 86 LYS H 1 86 LYS HG2 . . 4.400 4.405 4.151 4.473 0.073 9 0 "[ . 1 . 2]" 1
2470 1 86 LYS H 1 87 MET H . . 3.410 2.903 2.775 2.997 . 0 0 "[ . 1 . 2]" 1
2471 1 86 LYS H 1 87 MET HG2 . . 5.500 4.492 4.178 4.698 . 0 0 "[ . 1 . 2]" 1
2472 1 86 LYS H 1 88 MET H . . 4.990 4.326 4.200 4.488 . 0 0 "[ . 1 . 2]" 1
2473 1 86 LYS H 1 89 GLU H . . 5.500 4.729 4.638 4.844 . 0 0 "[ . 1 . 2]" 1
2474 1 86 LYS HA 1 86 LYS QD . . 4.320 4.318 4.129 4.396 0.076 10 0 "[ . 1 . 2]" 1
2475 1 86 LYS HA 1 86 LYS HG2 . . 3.820 3.208 3.041 3.648 . 0 0 "[ . 1 . 2]" 1
2476 1 86 LYS HA 1 86 LYS HG3 . . 4.030 2.769 2.442 2.961 . 0 0 "[ . 1 . 2]" 1
2477 1 86 LYS HA 1 88 MET H . . 5.500 4.642 4.541 4.758 . 0 0 "[ . 1 . 2]" 1
2478 1 86 LYS HA 1 89 GLU H . . 4.100 3.679 3.446 3.962 . 0 0 "[ . 1 . 2]" 1
2479 1 86 LYS HA 1 89 GLU HB2 . . 3.530 2.902 2.507 3.186 . 0 0 "[ . 1 . 2]" 1
2480 1 86 LYS HA 1 89 GLU HG2 . . 4.530 4.577 4.110 4.658 0.128 17 0 "[ . 1 . 2]" 1
2481 1 86 LYS HA 1 89 GLU HG3 . . 4.570 3.019 2.381 3.425 . 0 0 "[ . 1 . 2]" 1
2482 1 86 LYS HA 1 90 ARG H . . 5.200 4.429 4.182 4.842 . 0 0 "[ . 1 . 2]" 1
2483 1 86 LYS HA 1 90 ARG HG2 . . 5.500 4.518 4.137 4.964 . 0 0 "[ . 1 . 2]" 1
2484 1 86 LYS HA 1 90 ARG HG3 . . 5.500 5.391 4.968 5.574 0.074 20 0 "[ . 1 . 2]" 1
2485 1 86 LYS HB2 1 86 LYS QE . . 5.060 2.302 1.966 3.268 . 0 0 "[ . 1 . 2]" 1
2486 1 86 LYS HB2 1 87 MET H . . 4.110 3.971 3.737 4.178 0.068 2 0 "[ . 1 . 2]" 1
2487 1 86 LYS HB2 1 87 MET HG2 . . 5.490 5.147 4.472 5.478 . 0 0 "[ . 1 . 2]" 1
2488 1 86 LYS HB3 1 87 MET H . . 3.480 2.661 2.420 2.959 . 0 0 "[ . 1 . 2]" 1
2489 1 86 LYS HB3 1 87 MET ME . . 3.760 3.326 2.699 3.835 0.075 18 0 "[ . 1 . 2]" 1
2490 1 86 LYS HB3 1 87 MET HG2 . . 4.770 3.441 2.780 3.909 . 0 0 "[ . 1 . 2]" 1
2491 1 86 LYS QD 1 86 LYS HG3 . . 2.400 2.411 2.159 2.509 0.109 9 0 "[ . 1 . 2]" 1
2492 1 86 LYS QD 1 87 MET H . . 5.500 4.409 4.004 4.957 . 0 0 "[ . 1 . 2]" 1
2493 1 86 LYS QD 1 87 MET HA . . 5.500 4.885 4.514 5.202 . 0 0 "[ . 1 . 2]" 1
2494 1 86 LYS QD 1 87 MET ME . . 3.250 2.508 1.928 3.120 . 0 0 "[ . 1 . 2]" 1
2495 1 86 LYS HG2 1 87 MET H . . 5.380 3.600 3.048 4.012 . 0 0 "[ . 1 . 2]" 1
2496 1 86 LYS HG2 1 87 MET ME . . 3.410 3.258 2.556 3.498 0.088 14 0 "[ . 1 . 2]" 1
2497 1 86 LYS HG2 1 87 MET HG2 . . 5.500 4.248 3.371 4.723 . 0 0 "[ . 1 . 2]" 1
2498 1 86 LYS HG3 1 87 MET H . . 5.500 4.681 4.026 4.999 . 0 0 "[ . 1 . 2]" 1
2499 1 86 LYS HG3 1 87 MET HA . . 5.500 5.093 4.132 5.561 0.061 9 0 "[ . 1 . 2]" 1
2500 1 86 LYS HG3 1 89 GLU HB2 . . 5.500 4.786 4.439 5.122 . 0 0 "[ . 1 . 2]" 1
2501 1 87 MET H 1 87 MET HB3 . . 3.530 3.588 3.561 3.602 0.072 20 0 "[ . 1 . 2]" 1
2502 1 87 MET H 1 87 MET ME . . 4.950 3.726 3.132 3.858 . 0 0 "[ . 1 . 2]" 1
2503 1 87 MET H 1 87 MET HG2 . . 3.730 2.171 1.945 2.377 . 0 0 "[ . 1 . 2]" 1
2504 1 87 MET H 1 87 MET HG3 . . 3.880 3.648 3.245 3.830 . 0 0 "[ . 1 . 2]" 1
2505 1 87 MET H 1 88 MET H . . 3.400 2.568 2.422 2.661 . 0 0 "[ . 1 . 2]" 1
2506 1 87 MET H 1 88 MET HA . . 5.500 5.220 5.121 5.346 . 0 0 "[ . 1 . 2]" 1
2507 1 87 MET HA 1 87 MET ME . . 4.600 3.819 2.700 4.063 . 0 0 "[ . 1 . 2]" 1
2508 1 87 MET HA 1 87 MET HG2 . . 4.160 3.281 3.006 3.412 . 0 0 "[ . 1 . 2]" 1
2509 1 87 MET HA 1 87 MET HG3 . . 3.720 3.736 3.662 3.804 0.084 16 0 "[ . 1 . 2]" 1
2510 1 87 MET HA 1 88 MET HA . . 5.500 4.806 4.743 4.850 . 0 0 "[ . 1 . 2]" 1
2511 1 87 MET HA 1 89 GLU H . . 5.210 4.585 4.436 4.867 . 0 0 "[ . 1 . 2]" 1
2512 1 87 MET HA 1 90 ARG H . . 4.150 3.630 3.420 3.994 . 0 0 "[ . 1 . 2]" 1
2513 1 87 MET HA 1 90 ARG HB2 . . 4.230 3.068 2.803 3.345 . 0 0 "[ . 1 . 2]" 1
2514 1 87 MET HA 1 91 VAL QG . . 5.500 4.786 4.156 5.031 . 0 0 "[ . 1 . 2]" 1
2515 1 87 MET HB2 1 88 MET H . . 4.530 2.470 2.267 2.649 . 0 0 "[ . 1 . 2]" 1
2516 1 87 MET HB2 1 91 VAL QG . . 5.500 4.782 4.085 5.003 . 0 0 "[ . 1 . 2]" 1
2517 1 87 MET HB3 1 88 MET H . . 3.700 3.636 3.531 3.759 0.059 6 0 "[ . 1 . 2]" 1
2518 1 87 MET ME 1 87 MET HG2 . . 3.850 2.386 2.109 2.520 . 0 0 "[ . 1 . 2]" 1
2519 1 87 MET ME 1 87 MET HG3 . . 3.420 2.791 2.644 3.330 . 0 0 "[ . 1 . 2]" 1
2520 1 87 MET HG2 1 88 MET H . . 5.430 4.081 3.954 4.318 . 0 0 "[ . 1 . 2]" 1
2521 1 87 MET HG3 1 88 MET H . . 5.120 4.842 4.391 5.099 . 0 0 "[ . 1 . 2]" 1
2522 1 88 MET H 1 88 MET HB2 . . 3.300 2.304 2.163 2.520 . 0 0 "[ . 1 . 2]" 1
2523 1 88 MET H 1 88 MET HB3 . . 3.740 2.958 2.451 3.668 . 0 0 "[ . 1 . 2]" 1
2524 1 88 MET H 1 88 MET ME . . 4.740 3.880 3.426 4.093 . 0 0 "[ . 1 . 2]" 1
2525 1 88 MET H 1 88 MET HG2 . . 4.810 4.275 3.571 4.525 . 0 0 "[ . 1 . 2]" 1
2526 1 88 MET H 1 88 MET HG3 . . 4.470 3.779 2.470 4.297 . 0 0 "[ . 1 . 2]" 1
2527 1 88 MET H 1 89 GLU H . . 3.520 2.766 2.657 2.850 . 0 0 "[ . 1 . 2]" 1
2528 1 88 MET H 1 89 GLU HA . . 5.320 5.355 5.287 5.386 0.066 16 0 "[ . 1 . 2]" 1
2529 1 88 MET H 1 90 ARG H . . 5.120 4.247 4.056 4.530 . 0 0 "[ . 1 . 2]" 1
2530 1 88 MET H 1 91 VAL QG . . 5.500 4.456 3.763 4.741 . 0 0 "[ . 1 . 2]" 1
2531 1 88 MET HA 1 88 MET ME . . 5.500 4.353 4.165 4.531 . 0 0 "[ . 1 . 2]" 1
2532 1 88 MET HA 1 88 MET HG2 . . 3.860 2.764 2.259 3.290 . 0 0 "[ . 1 . 2]" 1
2533 1 88 MET HA 1 90 ARG H . . 5.190 4.330 3.601 4.571 . 0 0 "[ . 1 . 2]" 1
2534 1 88 MET HA 1 91 VAL H . . 4.110 3.461 3.025 3.687 . 0 0 "[ . 1 . 2]" 1
2535 1 88 MET HA 1 91 VAL HB . . 3.710 3.005 2.721 3.836 0.126 2 0 "[ . 1 . 2]" 1
2536 1 88 MET HA 1 91 VAL QG . . 3.660 2.239 1.769 2.608 . 0 0 "[ . 1 . 2]" 1
2537 1 88 MET HA 1 92 VAL H . . 4.380 3.679 3.032 4.103 . 0 0 "[ . 1 . 2]" 1
2538 1 88 MET HA 1 92 VAL QG . . 4.350 3.270 2.664 3.588 . 0 0 "[ . 1 . 2]" 1
2539 1 88 MET HB2 1 88 MET ME . . 4.730 2.322 2.087 2.715 . 0 0 "[ . 1 . 2]" 1
2540 1 88 MET HB2 1 89 GLU H . . 3.850 3.405 2.514 3.906 0.056 4 0 "[ . 1 . 2]" 1
2541 1 88 MET HB2 1 91 VAL QG . . 5.500 4.336 3.855 4.596 . 0 0 "[ . 1 . 2]" 1
2542 1 88 MET HB2 1 92 VAL QG . . 5.340 4.431 3.737 4.853 . 0 0 "[ . 1 . 2]" 1
2543 1 88 MET HB3 1 88 MET ME . . 3.310 2.516 2.174 3.047 . 0 0 "[ . 1 . 2]" 1
2544 1 88 MET HB3 1 89 GLU H . . 4.020 2.848 2.430 3.593 . 0 0 "[ . 1 . 2]" 1
2545 1 88 MET HB3 1 89 GLU HA . . 5.290 4.196 3.816 4.491 . 0 0 "[ . 1 . 2]" 1
2546 1 88 MET HB3 1 91 VAL QG . . 4.970 4.245 3.419 4.745 . 0 0 "[ . 1 . 2]" 1
2547 1 88 MET HB3 1 92 VAL QG . . 5.110 3.666 2.417 4.469 . 0 0 "[ . 1 . 2]" 1
2548 1 88 MET ME 1 88 MET HG2 . . 3.580 3.159 2.473 3.450 . 0 0 "[ . 1 . 2]" 1
2549 1 88 MET ME 1 88 MET HG3 . . 3.590 2.910 2.391 3.472 . 0 0 "[ . 1 . 2]" 1
2550 1 88 MET ME 1 89 GLU H . . 5.350 4.422 4.157 4.610 . 0 0 "[ . 1 . 2]" 1
2551 1 88 MET ME 1 89 GLU HG3 . . 5.500 5.238 4.625 5.590 0.090 1 0 "[ . 1 . 2]" 1
2552 1 88 MET HG2 1 89 GLU H . . 5.500 4.485 4.006 5.278 . 0 0 "[ . 1 . 2]" 1
2553 1 88 MET HG2 1 91 VAL QG . . 5.500 3.319 2.693 4.080 . 0 0 "[ . 1 . 2]" 1
2554 1 88 MET HG2 1 92 VAL QG . . 4.060 2.792 2.146 3.926 . 0 0 "[ . 1 . 2]" 1
2555 1 88 MET HG3 1 91 VAL QG . . 4.630 3.419 2.774 4.460 . 0 0 "[ . 1 . 2]" 1
2556 1 88 MET HG3 1 92 VAL QG . . 4.900 3.681 3.005 4.762 . 0 0 "[ . 1 . 2]" 1
2557 1 89 GLU H 1 89 GLU HB2 . . 3.140 2.532 2.113 2.737 . 0 0 "[ . 1 . 2]" 1
2558 1 89 GLU H 1 89 GLU HB3 . . 3.570 3.597 3.414 3.641 0.071 18 0 "[ . 1 . 2]" 1
2559 1 89 GLU H 1 89 GLU HG2 . . 3.910 2.976 2.528 3.692 . 0 0 "[ . 1 . 2]" 1
2560 1 89 GLU H 1 89 GLU HG3 . . 3.720 2.682 2.389 3.497 . 0 0 "[ . 1 . 2]" 1
2561 1 89 GLU H 1 90 ARG H . . 3.430 2.836 2.735 2.907 . 0 0 "[ . 1 . 2]" 1
2562 1 89 GLU H 1 90 ARG HG2 . . 5.500 4.866 4.453 5.106 . 0 0 "[ . 1 . 2]" 1
2563 1 89 GLU H 1 91 VAL QG . . 5.500 4.763 4.405 5.030 . 0 0 "[ . 1 . 2]" 1
2564 1 89 GLU HA 1 89 GLU HG2 . . 3.150 2.438 2.200 2.684 . 0 0 "[ . 1 . 2]" 1
2565 1 89 GLU HA 1 89 GLU HG3 . . 4.000 3.456 3.044 3.727 . 0 0 "[ . 1 . 2]" 1
2566 1 89 GLU HA 1 90 ARG HA . . 5.500 4.753 4.605 4.839 . 0 0 "[ . 1 . 2]" 1
2567 1 89 GLU HA 1 92 VAL H . . 4.460 3.943 3.771 4.320 . 0 0 "[ . 1 . 2]" 1
2568 1 89 GLU HA 1 92 VAL QG . . 4.770 2.979 2.140 3.811 . 0 0 "[ . 1 . 2]" 1
2569 1 89 GLU HA 1 93 GLU H . . 4.620 3.828 3.644 4.054 . 0 0 "[ . 1 . 2]" 1
2570 1 89 GLU HB2 1 90 ARG H . . 3.590 2.658 2.230 3.330 . 0 0 "[ . 1 . 2]" 1
2571 1 89 GLU HB2 1 90 ARG HB2 . . 5.030 4.719 4.349 5.079 0.049 12 0 "[ . 1 . 2]" 1
2572 1 89 GLU HB3 1 90 ARG H . . 4.200 3.554 2.865 4.035 . 0 0 "[ . 1 . 2]" 1
2573 1 89 GLU HG2 1 90 ARG H . . 4.880 4.822 4.562 5.066 0.186 17 0 "[ . 1 . 2]" 1
2574 1 89 GLU HG3 1 90 ARG H . . 5.480 4.520 4.161 4.905 . 0 0 "[ . 1 . 2]" 1
2575 1 90 ARG H 1 90 ARG HB2 . . 3.150 2.315 2.130 2.416 . 0 0 "[ . 1 . 2]" 1
2576 1 90 ARG H 1 90 ARG HB3 . . 3.500 3.542 3.454 3.577 0.077 11 0 "[ . 1 . 2]" 1
2577 1 90 ARG H 1 90 ARG QD . . 5.500 4.160 3.920 4.389 . 0 0 "[ . 1 . 2]" 1
2578 1 90 ARG H 1 90 ARG HG2 . . 3.690 2.552 2.299 2.815 . 0 0 "[ . 1 . 2]" 1
2579 1 90 ARG H 1 90 ARG HG3 . . 4.110 3.578 3.131 3.859 . 0 0 "[ . 1 . 2]" 1
2580 1 90 ARG H 1 91 VAL H . . 3.270 2.696 2.347 2.861 . 0 0 "[ . 1 . 2]" 1
2581 1 90 ARG H 1 91 VAL HA . . 5.500 5.256 4.914 5.417 . 0 0 "[ . 1 . 2]" 1
2582 1 90 ARG H 1 91 VAL HB . . 5.500 4.598 4.125 5.591 0.091 2 0 "[ . 1 . 2]" 1
2583 1 90 ARG H 1 91 VAL QG . . 5.500 4.471 3.825 4.649 . 0 0 "[ . 1 . 2]" 1
2584 1 90 ARG H 1 92 VAL H . . 4.960 4.189 3.799 4.525 . 0 0 "[ . 1 . 2]" 1
2585 1 90 ARG H 1 92 VAL QG . . 5.500 4.667 4.078 5.214 . 0 0 "[ . 1 . 2]" 1
2586 1 90 ARG H 1 93 GLU H . . 5.310 4.503 4.228 4.626 . 0 0 "[ . 1 . 2]" 1
2587 1 90 ARG HA 1 90 ARG QD . . 3.840 2.512 2.035 3.109 . 0 0 "[ . 1 . 2]" 1
2588 1 90 ARG HA 1 90 ARG HE . . 5.370 3.672 2.033 5.244 . 0 0 "[ . 1 . 2]" 1
2589 1 90 ARG HA 1 90 ARG HG2 . . 3.910 2.842 2.582 3.147 . 0 0 "[ . 1 . 2]" 1
2590 1 90 ARG HA 1 90 ARG HG3 . . 3.880 3.770 3.712 3.844 . 0 0 "[ . 1 . 2]" 1
2591 1 90 ARG HA 1 91 VAL HA . . 5.500 4.819 4.736 4.919 . 0 0 "[ . 1 . 2]" 1
2592 1 90 ARG HA 1 92 VAL H . . 5.500 4.607 4.233 4.840 . 0 0 "[ . 1 . 2]" 1
2593 1 90 ARG HA 1 93 GLU H . . 3.870 3.429 3.181 3.663 . 0 0 "[ . 1 . 2]" 1
2594 1 90 ARG HA 1 93 GLU HB2 . . 3.800 3.382 2.940 3.735 . 0 0 "[ . 1 . 2]" 1
2595 1 90 ARG HA 1 93 GLU HG2 . . 5.150 4.806 4.296 5.195 0.045 11 0 "[ . 1 . 2]" 1
2596 1 90 ARG HA 1 94 GLN H . . 4.830 3.675 3.475 3.793 . 0 0 "[ . 1 . 2]" 1
2597 1 90 ARG HB2 1 90 ARG HE . . 5.500 4.617 3.985 5.111 . 0 0 "[ . 1 . 2]" 1
2598 1 90 ARG HB2 1 91 VAL H . . 3.530 2.370 2.232 2.657 . 0 0 "[ . 1 . 2]" 1
2599 1 90 ARG HB2 1 91 VAL QG . . 4.950 4.267 3.995 4.448 . 0 0 "[ . 1 . 2]" 1
2600 1 90 ARG HB2 1 94 GLN H . . 5.500 5.582 5.566 5.595 0.095 6 0 "[ . 1 . 2]" 1
2601 1 90 ARG HB3 1 90 ARG HE . . 5.090 4.096 3.519 4.594 . 0 0 "[ . 1 . 2]" 1
2602 1 90 ARG HB3 1 91 VAL H . . 3.830 3.326 3.126 3.573 . 0 0 "[ . 1 . 2]" 1
2603 1 90 ARG HB3 1 91 VAL HA . . 5.290 4.241 4.110 4.388 . 0 0 "[ . 1 . 2]" 1
2604 1 90 ARG QD 1 91 VAL H . . 5.500 4.977 4.788 5.223 . 0 0 "[ . 1 . 2]" 1
2605 1 90 ARG QD 1 93 GLU HB3 . . 4.750 3.960 3.357 4.637 . 0 0 "[ . 1 . 2]" 1
2606 1 90 ARG QD 1 94 GLN HB2 . . 5.500 4.821 4.088 5.389 . 0 0 "[ . 1 . 2]" 1
2607 1 90 ARG QD 1 94 GLN HE22 . . 5.500 5.252 3.873 6.187 0.687 5 1 "[ + 1 . 2]" 1
2608 1 90 ARG HG2 1 91 VAL H . . 4.930 4.514 4.357 4.710 . 0 0 "[ . 1 . 2]" 1
2609 1 90 ARG HG3 1 91 VAL H . . 5.290 4.753 4.508 5.074 . 0 0 "[ . 1 . 2]" 1
2610 1 91 VAL H 1 91 VAL HB . . 3.160 2.149 1.926 3.259 0.099 2 0 "[ . 1 . 2]" 1
2611 1 91 VAL H 1 91 VAL QG . . 3.500 2.804 2.265 2.902 . 0 0 "[ . 1 . 2]" 1
2612 1 91 VAL H 1 92 VAL H . . 3.290 2.977 2.767 3.241 . 0 0 "[ . 1 . 2]" 1
2613 1 91 VAL HA 1 94 GLN H . . 4.100 3.832 3.577 4.045 . 0 0 "[ . 1 . 2]" 1
2614 1 91 VAL HA 1 94 GLN HB3 . . 3.900 3.566 3.191 3.814 . 0 0 "[ . 1 . 2]" 1
2615 1 91 VAL HA 1 95 MET HG3 . . 5.500 4.051 3.197 4.342 . 0 0 "[ . 1 . 2]" 1
2616 1 91 VAL HB 1 92 VAL H . . 3.600 3.431 2.654 3.645 0.045 16 0 "[ . 1 . 2]" 1
2617 1 91 VAL HB 1 92 VAL QG . . 4.870 3.998 3.125 4.296 . 0 0 "[ . 1 . 2]" 1
2618 1 91 VAL QG 1 92 VAL H . . 3.790 2.272 2.085 2.418 . 0 0 "[ . 1 . 2]" 1
2619 1 91 VAL QG 1 92 VAL HA . . 3.830 3.259 3.082 3.779 . 0 0 "[ . 1 . 2]" 1
2620 1 91 VAL QG 1 92 VAL QG . . 4.280 2.059 1.993 2.167 . 0 0 "[ . 1 . 2]" 1
2621 1 91 VAL QG 1 94 GLN HB3 . . 5.500 4.458 4.116 4.724 . 0 0 "[ . 1 . 2]" 1
2622 1 91 VAL QG 1 95 MET ME . . 3.340 2.329 2.091 2.979 . 0 0 "[ . 1 . 2]" 1
2623 1 91 VAL QG 1 95 MET HG2 . . 5.450 4.615 3.927 4.953 . 0 0 "[ . 1 . 2]" 1
2624 1 91 VAL QG 1 95 MET HG3 . . 4.750 3.601 2.992 3.887 . 0 0 "[ . 1 . 2]" 1
2625 1 92 VAL H 1 92 VAL HB . . 3.420 2.803 2.104 3.508 0.088 14 0 "[ . 1 . 2]" 1
2626 1 92 VAL H 1 92 VAL QG . . 3.320 2.127 1.938 2.431 . 0 0 "[ . 1 . 2]" 1
2627 1 92 VAL H 1 93 GLU H . . 3.070 2.693 2.522 2.990 . 0 0 "[ . 1 . 2]" 1
2628 1 92 VAL H 1 93 GLU HB2 . . 5.500 5.120 4.715 5.549 0.049 17 0 "[ . 1 . 2]" 1
2629 1 92 VAL H 1 94 GLN H . . 5.030 4.421 4.223 4.639 . 0 0 "[ . 1 . 2]" 1
2630 1 92 VAL H 1 95 MET ME . . 4.790 3.893 3.598 4.556 . 0 0 "[ . 1 . 2]" 1
2631 1 92 VAL HA 1 92 VAL QG . . 3.240 2.264 2.130 2.465 . 0 0 "[ . 1 . 2]" 1
2632 1 92 VAL HA 1 94 GLN H . . 5.050 4.661 4.414 5.010 . 0 0 "[ . 1 . 2]" 1
2633 1 92 VAL HA 1 95 MET H . . 3.860 3.432 3.155 3.812 . 0 0 "[ . 1 . 2]" 1
2634 1 92 VAL HA 1 95 MET HB2 . . 3.460 2.542 2.321 2.755 . 0 0 "[ . 1 . 2]" 1
2635 1 92 VAL HA 1 95 MET HB3 . . 4.210 4.152 3.889 4.277 0.067 14 0 "[ . 1 . 2]" 1
2636 1 92 VAL HA 1 95 MET ME . . 3.090 2.308 1.995 3.108 0.018 17 0 "[ . 1 . 2]" 1
2637 1 92 VAL HA 1 95 MET HG2 . . 5.500 5.004 4.357 5.536 0.036 13 0 "[ . 1 . 2]" 1
2638 1 92 VAL HA 1 95 MET HG3 . . 4.620 3.693 2.760 4.387 . 0 0 "[ . 1 . 2]" 1
2639 1 92 VAL HB 1 93 GLU H . . 3.880 3.284 2.626 3.967 0.087 12 0 "[ . 1 . 2]" 1
2640 1 92 VAL QG 1 93 GLU H . . 4.280 2.812 2.282 3.345 . 0 0 "[ . 1 . 2]" 1
2641 1 92 VAL QG 1 93 GLU HA . . 4.700 3.462 3.201 3.724 . 0 0 "[ . 1 . 2]" 1
2642 1 92 VAL QG 1 94 GLN H . . 5.500 4.751 4.492 5.086 . 0 0 "[ . 1 . 2]" 1
2643 1 92 VAL QG 1 95 MET ME . . 4.240 2.668 2.277 3.162 . 0 0 "[ . 1 . 2]" 1
2644 1 92 VAL QG 1 95 MET HG3 . . 5.500 4.747 3.960 5.211 . 0 0 "[ . 1 . 2]" 1
2645 1 92 VAL QG 1 96 CYS H . . 4.630 4.224 3.899 4.505 . 0 0 "[ . 1 . 2]" 1
2646 1 92 VAL QG 1 96 CYS HB2 . . 5.500 3.817 3.054 4.990 . 0 0 "[ . 1 . 2]" 1
2647 1 93 GLU H 1 93 GLU HB2 . . 3.070 2.549 2.350 2.792 . 0 0 "[ . 1 . 2]" 1
2648 1 93 GLU H 1 93 GLU HB3 . . 3.250 2.490 2.240 2.748 . 0 0 "[ . 1 . 2]" 1
2649 1 93 GLU H 1 93 GLU HG2 . . 4.430 4.477 4.423 4.585 0.155 9 0 "[ . 1 . 2]" 1
2650 1 93 GLU H 1 93 GLU HG3 . . 4.640 4.493 4.286 4.685 0.045 12 0 "[ . 1 . 2]" 1
2651 1 93 GLU H 1 94 GLN H . . 3.530 2.973 2.879 3.085 . 0 0 "[ . 1 . 2]" 1
2652 1 93 GLU H 1 96 CYS H . . 5.500 4.569 4.329 4.695 . 0 0 "[ . 1 . 2]" 1
2653 1 93 GLU HA 1 93 GLU HG2 . . 3.920 2.943 2.615 3.321 . 0 0 "[ . 1 . 2]" 1
2654 1 93 GLU HA 1 93 GLU HG3 . . 3.610 2.906 2.426 3.678 0.068 17 0 "[ . 1 . 2]" 1
2655 1 93 GLU HA 1 94 GLN HA . . 5.500 4.688 4.620 4.755 . 0 0 "[ . 1 . 2]" 1
2656 1 93 GLU HA 1 95 MET HB2 . . 5.500 5.458 5.180 5.573 0.073 13 0 "[ . 1 . 2]" 1
2657 1 93 GLU HA 1 96 CYS H . . 4.300 3.398 3.196 3.715 . 0 0 "[ . 1 . 2]" 1
2658 1 93 GLU HA 1 96 CYS HB3 . . 4.460 3.060 2.124 4.267 . 0 0 "[ . 1 . 2]" 1
2659 1 93 GLU HB2 1 94 GLN H . . 4.230 3.881 3.691 4.042 . 0 0 "[ . 1 . 2]" 1
2660 1 93 GLU HB2 1 94 GLN HA . . 5.500 5.532 5.451 5.578 0.078 16 0 "[ . 1 . 2]" 1
2661 1 93 GLU HB3 1 94 GLN H . . 4.140 2.483 2.220 2.722 . 0 0 "[ . 1 . 2]" 1
2662 1 93 GLU HB3 1 96 CYS H . . 5.500 5.391 5.216 5.543 0.043 13 0 "[ . 1 . 2]" 1
2663 1 93 GLU HG2 1 94 GLN H . . 5.000 3.681 3.212 3.930 . 0 0 "[ . 1 . 2]" 1
2664 1 93 GLU HG2 1 94 GLN HA . . 5.420 3.583 3.165 3.940 . 0 0 "[ . 1 . 2]" 1
2665 1 93 GLU HG2 1 96 CYS HB3 . . 5.500 4.811 3.741 6.384 0.884 18 2 "[ . 1 .- + 2]" 1
2666 1 93 GLU HG3 1 94 GLN H . . 5.060 4.661 4.392 4.937 . 0 0 "[ . 1 . 2]" 1
2667 1 93 GLU HG3 1 94 GLN HA . . 5.500 5.085 4.417 5.526 0.026 4 0 "[ . 1 . 2]" 1
2668 1 94 GLN H 1 94 GLN HB2 . . 2.940 2.224 1.957 2.478 . 0 0 "[ . 1 . 2]" 1
2669 1 94 GLN H 1 94 GLN HG3 . . 4.930 4.390 4.291 4.495 . 0 0 "[ . 1 . 2]" 1
2670 1 94 GLN H 1 95 MET H . . 3.100 2.772 2.696 2.871 . 0 0 "[ . 1 . 2]" 1
2671 1 94 GLN H 1 95 MET HG3 . . 5.500 4.674 4.387 4.955 . 0 0 "[ . 1 . 2]" 1
2672 1 94 GLN H 1 96 CYS H . . 4.800 4.138 4.004 4.330 . 0 0 "[ . 1 . 2]" 1
2673 1 94 GLN H 1 97 VAL H . . 5.500 4.835 4.743 4.985 . 0 0 "[ . 1 . 2]" 1
2674 1 94 GLN H 1 97 VAL QG . . 5.220 4.526 4.078 5.032 . 0 0 "[ . 1 . 2]" 1
2675 1 94 GLN HA 1 94 GLN HB2 . . 3.010 2.584 2.489 2.717 . 0 0 "[ . 1 . 2]" 1
2676 1 94 GLN HA 1 94 GLN HE21 . . 5.450 3.892 2.721 4.861 . 0 0 "[ . 1 . 2]" 1
2677 1 94 GLN HA 1 94 GLN HE22 . . 5.500 4.776 4.172 5.426 . 0 0 "[ . 1 . 2]" 1
2678 1 94 GLN HA 1 94 GLN HG2 . . 3.800 3.516 3.167 3.817 0.017 1 0 "[ . 1 . 2]" 1
2679 1 94 GLN HA 1 94 GLN HG3 . . 3.960 2.433 2.204 2.882 . 0 0 "[ . 1 . 2]" 1
2680 1 94 GLN HA 1 96 CYS H . . 5.370 4.287 4.052 4.475 . 0 0 "[ . 1 . 2]" 1
2681 1 94 GLN HA 1 97 VAL H . . 3.950 3.387 3.222 3.560 . 0 0 "[ . 1 . 2]" 1
2682 1 94 GLN HA 1 97 VAL HB . . 3.330 2.966 2.493 3.402 0.072 4 0 "[ . 1 . 2]" 1
2683 1 94 GLN HA 1 97 VAL QG . . 3.900 2.693 2.094 3.126 . 0 0 "[ . 1 . 2]" 1
2684 1 94 GLN HB3 1 95 MET H . . 3.930 2.930 2.637 3.441 . 0 0 "[ . 1 . 2]" 1
2685 1 94 GLN HB3 1 95 MET HG3 . . 3.600 3.662 3.093 4.237 0.637 17 1 "[ . 1 . + 2]" 1
2686 1 94 GLN HE22 1 97 VAL QG . . 5.500 5.150 4.293 5.907 0.407 5 0 "[ . 1 . 2]" 1
2687 1 94 GLN HG3 1 97 VAL HB . . 4.530 4.068 3.545 4.607 0.077 18 0 "[ . 1 . 2]" 1
2688 1 94 GLN HG3 1 97 VAL QG . . 5.500 3.617 2.847 4.573 . 0 0 "[ . 1 . 2]" 1
2689 1 95 MET H 1 95 MET HB2 . . 4.130 2.371 2.247 2.590 . 0 0 "[ . 1 . 2]" 1
2690 1 95 MET H 1 95 MET ME . . 4.300 3.829 3.641 4.263 . 0 0 "[ . 1 . 2]" 1
2691 1 95 MET H 1 95 MET HG2 . . 3.940 3.460 2.622 3.913 . 0 0 "[ . 1 . 2]" 1
2692 1 95 MET H 1 95 MET HG3 . . 3.760 2.569 2.371 2.876 . 0 0 "[ . 1 . 2]" 1
2693 1 95 MET H 1 96 CYS H . . 3.360 2.453 2.066 2.696 . 0 0 "[ . 1 . 2]" 1
2694 1 95 MET H 1 96 CYS HB2 . . 5.500 4.626 4.242 5.097 . 0 0 "[ . 1 . 2]" 1
2695 1 95 MET H 1 97 VAL H . . 4.870 4.067 3.794 4.273 . 0 0 "[ . 1 . 2]" 1
2696 1 95 MET HA 1 95 MET ME . . 5.100 4.443 4.200 4.498 . 0 0 "[ . 1 . 2]" 1
2697 1 95 MET HA 1 95 MET HG2 . . 3.530 2.354 2.171 2.491 . 0 0 "[ . 1 . 2]" 1
2698 1 95 MET HA 1 95 MET HG3 . . 3.900 3.108 2.747 3.575 . 0 0 "[ . 1 . 2]" 1
2699 1 95 MET HA 1 97 VAL H . . 5.400 4.432 4.108 4.639 . 0 0 "[ . 1 . 2]" 1
2700 1 95 MET HA 1 98 THR H . . 4.080 3.562 3.242 3.806 . 0 0 "[ . 1 . 2]" 1
2701 1 95 MET HA 1 98 THR HB . . 3.210 3.036 2.638 3.290 0.080 14 0 "[ . 1 . 2]" 1
2702 1 95 MET HA 1 98 THR MG . . 4.760 4.098 3.349 4.568 . 0 0 "[ . 1 . 2]" 1
2703 1 95 MET HA 1 99 GLN H . . 5.080 4.455 4.006 4.988 . 0 0 "[ . 1 . 2]" 1
2704 1 95 MET HB2 1 95 MET ME . . 3.060 2.282 2.126 2.771 . 0 0 "[ . 1 . 2]" 1
2705 1 95 MET HB2 1 96 CYS H . . 3.800 2.826 2.619 3.018 . 0 0 "[ . 1 . 2]" 1
2706 1 95 MET HB2 1 96 CYS HA . . 4.970 4.549 4.357 4.765 . 0 0 "[ . 1 . 2]" 1
2707 1 95 MET HB3 1 95 MET ME . . 2.750 2.703 2.264 2.842 0.092 8 0 "[ . 1 . 2]" 1
2708 1 95 MET HB3 1 96 CYS H . . 4.200 3.739 3.480 3.915 . 0 0 "[ . 1 . 2]" 1
2709 1 95 MET HB3 1 98 THR H . . 5.460 5.356 5.092 5.532 0.072 17 0 "[ . 1 . 2]" 1
2710 1 95 MET HB3 1 98 THR HB . . 5.210 4.663 4.347 5.213 0.003 15 0 "[ . 1 . 2]" 1
2711 1 95 MET ME 1 95 MET HG2 . . 3.670 3.401 3.192 3.461 . 0 0 "[ . 1 . 2]" 1
2712 1 95 MET ME 1 95 MET HG3 . . 3.920 2.629 2.144 3.162 . 0 0 "[ . 1 . 2]" 1
2713 1 95 MET ME 1 96 CYS H . . 5.260 4.581 4.238 5.209 . 0 0 "[ . 1 . 2]" 1
2714 1 95 MET HG2 1 96 CYS H . . 5.500 4.981 4.679 5.131 . 0 0 "[ . 1 . 2]" 1
2715 1 95 MET HG3 1 96 CYS H . . 5.500 4.503 4.306 4.663 . 0 0 "[ . 1 . 2]" 1
2716 1 96 CYS H 1 96 CYS HB2 . . 3.320 2.422 2.114 2.590 . 0 0 "[ . 1 . 2]" 1
2717 1 96 CYS H 1 96 CYS HB3 . . 3.800 2.912 2.361 3.591 . 0 0 "[ . 1 . 2]" 1
2718 1 96 CYS H 1 97 VAL H . . 3.480 2.687 2.469 2.849 . 0 0 "[ . 1 . 2]" 1
2719 1 96 CYS H 1 97 VAL HA . . 5.500 5.290 5.060 5.424 . 0 0 "[ . 1 . 2]" 1
2720 1 96 CYS H 1 97 VAL HB . . 5.500 4.706 4.226 5.204 . 0 0 "[ . 1 . 2]" 1
2721 1 96 CYS H 1 97 VAL QG . . 4.530 4.218 3.961 4.429 . 0 0 "[ . 1 . 2]" 1
2722 1 96 CYS H 1 98 THR H . . 4.950 4.223 3.842 4.553 . 0 0 "[ . 1 . 2]" 1
2723 1 96 CYS H 1 99 GLN H . . 5.500 4.590 4.351 4.851 . 0 0 "[ . 1 . 2]" 1
2724 1 96 CYS HA 1 98 THR H . . 5.500 4.230 3.859 4.534 . 0 0 "[ . 1 . 2]" 1
2725 1 96 CYS HA 1 99 GLN H . . 3.890 2.945 2.727 3.240 . 0 0 "[ . 1 . 2]" 1
2726 1 96 CYS HA 1 99 GLN HA . . 5.200 4.904 4.516 5.240 0.040 10 0 "[ . 1 . 2]" 1
2727 1 96 CYS HA 1 99 GLN HB2 . . 4.160 2.310 1.994 2.744 . 0 0 "[ . 1 . 2]" 1
2728 1 96 CYS HA 1 99 GLN HB3 . . 3.790 3.470 2.453 4.233 0.443 10 0 "[ . 1 . 2]" 1
2729 1 96 CYS HA 1 99 GLN HG2 . . 5.500 3.543 2.737 4.512 . 0 0 "[ . 1 . 2]" 1
2730 1 96 CYS HA 1 99 GLN HG3 . . 5.500 3.993 3.534 4.862 . 0 0 "[ . 1 . 2]" 1
2731 1 96 CYS HA 1 100 TYR H . . 4.930 3.743 3.199 4.309 . 0 0 "[ . 1 . 2]" 1
2732 1 96 CYS HB2 1 97 VAL H . . 4.330 3.403 2.337 4.057 . 0 0 "[ . 1 . 2]" 1
2733 1 96 CYS HB3 1 97 VAL H . . 4.480 2.994 2.407 3.868 . 0 0 "[ . 1 . 2]" 1
2734 1 97 VAL H 1 97 VAL HB . . 3.190 2.357 2.010 2.753 . 0 0 "[ . 1 . 2]" 1
2735 1 97 VAL H 1 97 VAL QG . . 3.280 2.318 2.035 2.874 . 0 0 "[ . 1 . 2]" 1
2736 1 97 VAL H 1 98 THR H . . 3.570 2.840 2.599 2.998 . 0 0 "[ . 1 . 2]" 1
2737 1 97 VAL H 1 98 THR HB . . 5.500 4.712 4.068 4.961 . 0 0 "[ . 1 . 2]" 1
2738 1 97 VAL H 1 99 GLN H . . 5.490 4.211 4.034 4.397 . 0 0 "[ . 1 . 2]" 1
2739 1 97 VAL HA 1 97 VAL QG . . 3.150 2.117 2.021 2.207 . 0 0 "[ . 1 . 2]" 1
2740 1 97 VAL HA 1 99 GLN H . . 5.500 4.623 4.480 4.890 . 0 0 "[ . 1 . 2]" 1
2741 1 97 VAL HA 1 100 TYR H . . 4.650 3.820 3.359 4.156 . 0 0 "[ . 1 . 2]" 1
2742 1 97 VAL HA 1 100 TYR HB2 . . 4.380 4.257 3.597 4.449 0.069 20 0 "[ . 1 . 2]" 1
2743 1 97 VAL HA 1 100 TYR HB3 . . 3.860 3.045 2.408 3.345 . 0 0 "[ . 1 . 2]" 1
2744 1 97 VAL HA 1 100 TYR QD . . 4.780 3.801 3.319 4.222 . 0 0 "[ . 1 . 2]" 1
2745 1 97 VAL HB 1 98 THR H . . 3.390 2.939 2.422 3.446 0.056 15 0 "[ . 1 . 2]" 1
2746 1 97 VAL HB 1 98 THR HA . . 5.490 4.876 4.411 5.516 0.026 15 0 "[ . 1 . 2]" 1
2747 1 97 VAL HB 1 98 THR HB . . 4.930 4.860 4.392 5.032 0.102 17 0 "[ . 1 . 2]" 1
2748 1 97 VAL HB 1 99 GLN H . . 5.500 5.325 4.903 5.566 0.066 7 0 "[ . 1 . 2]" 1
2749 1 97 VAL QG 1 98 THR H . . 4.210 2.992 2.012 3.494 . 0 0 "[ . 1 . 2]" 1
2750 1 97 VAL QG 1 98 THR HA . . 4.400 3.521 3.066 3.818 . 0 0 "[ . 1 . 2]" 1
2751 1 97 VAL QG 1 98 THR HB . . 5.500 4.343 2.834 5.028 . 0 0 "[ . 1 . 2]" 1
2752 1 97 VAL QG 1 100 TYR HB3 . . 5.000 4.026 3.367 4.307 . 0 0 "[ . 1 . 2]" 1
2753 1 97 VAL QG 1 100 TYR QD . . 4.770 3.782 2.834 4.274 . 0 0 "[ . 1 . 2]" 1
2754 1 97 VAL QG 1 101 GLN HB2 . . 5.500 4.397 4.055 4.852 . 0 0 "[ . 1 . 2]" 1
2755 1 97 VAL QG 1 101 GLN HE21 . . 4.280 2.229 1.729 2.618 . 0 0 "[ . 1 . 2]" 1
2756 1 97 VAL QG 1 101 GLN HE22 . . 4.490 3.161 2.542 3.893 . 0 0 "[ . 1 . 2]" 1
2757 1 97 VAL QG 1 101 GLN HG2 . . 4.740 4.355 3.737 4.714 . 0 0 "[ . 1 . 2]" 1
2758 1 97 VAL QG 1 101 GLN HG3 . . 4.450 3.199 2.595 3.725 . 0 0 "[ . 1 . 2]" 1
2759 1 98 THR H 1 98 THR HB . . 3.270 2.157 1.807 2.375 . 0 0 "[ . 1 . 2]" 1
2760 1 98 THR H 1 98 THR MG . . 4.310 3.592 3.125 3.729 . 0 0 "[ . 1 . 2]" 1
2761 1 98 THR H 1 99 GLN H . . 3.720 2.714 2.494 2.953 . 0 0 "[ . 1 . 2]" 1
2762 1 98 THR HA 1 98 THR MG . . 3.360 2.677 2.402 3.076 . 0 0 "[ . 1 . 2]" 1
2763 1 98 THR HA 1 99 GLN HA . . 5.200 4.800 4.663 4.925 . 0 0 "[ . 1 . 2]" 1
2764 1 98 THR HA 1 100 TYR H . . 5.500 4.662 4.377 4.904 . 0 0 "[ . 1 . 2]" 1
2765 1 98 THR HA 1 101 GLN H . . 4.050 3.374 3.140 3.571 . 0 0 "[ . 1 . 2]" 1
2766 1 98 THR HA 1 101 GLN HB2 . . 3.600 2.424 2.213 2.708 . 0 0 "[ . 1 . 2]" 1
2767 1 98 THR HA 1 101 GLN HB3 . . 4.210 4.046 3.763 4.286 0.076 1 0 "[ . 1 . 2]" 1
2768 1 98 THR HA 1 101 GLN HE21 . . 5.500 3.114 2.327 3.926 . 0 0 "[ . 1 . 2]" 1
2769 1 98 THR HA 1 101 GLN HE22 . . 5.500 4.129 2.896 5.422 . 0 0 "[ . 1 . 2]" 1
2770 1 98 THR HA 1 101 GLN HG2 . . 4.790 4.854 4.671 4.882 0.092 2 0 "[ . 1 . 2]" 1
2771 1 98 THR HA 1 101 GLN HG3 . . 4.790 3.569 3.162 3.867 . 0 0 "[ . 1 . 2]" 1
2772 1 98 THR HA 1 102 LYS H . . 5.040 3.921 3.713 4.248 . 0 0 "[ . 1 . 2]" 1
2773 1 98 THR HA 1 102 LYS HG2 . . 5.500 5.547 5.305 5.586 0.086 16 0 "[ . 1 . 2]" 1
2774 1 98 THR HA 1 102 LYS HG3 . . 5.500 4.010 3.829 4.167 . 0 0 "[ . 1 . 2]" 1
2775 1 98 THR HB 1 99 GLN H . . 3.610 2.840 2.451 3.402 . 0 0 "[ . 1 . 2]" 1
2776 1 98 THR HB 1 99 GLN HA . . 5.440 4.714 4.183 5.157 . 0 0 "[ . 1 . 2]" 1
2777 1 98 THR MG 1 99 GLN H . . 4.440 3.052 2.322 3.380 . 0 0 "[ . 1 . 2]" 1
2778 1 98 THR MG 1 99 GLN HA . . 4.580 3.237 2.729 3.563 . 0 0 "[ . 1 . 2]" 1
2779 1 98 THR MG 1 99 GLN HB3 . . 5.500 5.182 4.187 5.485 . 0 0 "[ . 1 . 2]" 1
2780 1 98 THR MG 1 99 GLN HG2 . . 4.350 4.377 3.816 4.463 0.113 15 0 "[ . 1 . 2]" 1
2781 1 98 THR MG 1 100 TYR H . . 5.500 5.041 4.479 5.259 . 0 0 "[ . 1 . 2]" 1
2782 1 98 THR MG 1 101 GLN H . . 5.500 4.789 4.583 5.012 . 0 0 "[ . 1 . 2]" 1
2783 1 98 THR MG 1 101 GLN HB2 . . 4.650 3.913 3.621 4.343 . 0 0 "[ . 1 . 2]" 1
2784 1 98 THR MG 1 101 GLN HB3 . . 5.500 5.016 4.504 5.577 0.077 15 0 "[ . 1 . 2]" 1
2785 1 98 THR MG 1 101 GLN HE21 . . 5.500 5.159 4.374 5.596 0.096 8 0 "[ . 1 . 2]" 1
2786 1 98 THR MG 1 101 GLN HG3 . . 5.500 5.544 5.284 5.610 0.110 13 0 "[ . 1 . 2]" 1
2787 1 98 THR MG 1 102 LYS H . . 5.210 3.921 3.685 4.347 . 0 0 "[ . 1 . 2]" 1
2788 1 98 THR MG 1 102 LYS HB2 . . 4.280 4.207 3.625 4.385 0.105 16 0 "[ . 1 . 2]" 1
2789 1 98 THR MG 1 102 LYS HB3 . . 5.500 4.985 4.575 5.292 . 0 0 "[ . 1 . 2]" 1
2790 1 98 THR MG 1 102 LYS QD . . 3.610 2.514 2.014 3.341 . 0 0 "[ . 1 . 2]" 1
2791 1 98 THR MG 1 102 LYS QE . . 4.100 2.794 1.876 3.966 . 0 0 "[ . 1 . 2]" 1
2792 1 98 THR MG 1 102 LYS HG2 . . 5.350 3.756 3.295 4.305 . 0 0 "[ . 1 . 2]" 1
2793 1 98 THR MG 1 102 LYS HG3 . . 3.200 2.706 2.179 3.168 . 0 0 "[ . 1 . 2]" 1
2794 1 99 GLN H 1 99 GLN HB2 . . 3.470 2.251 1.958 2.496 . 0 0 "[ . 1 . 2]" 1
2795 1 99 GLN H 1 99 GLN HB3 . . 3.660 3.345 2.773 3.647 . 0 0 "[ . 1 . 2]" 1
2796 1 99 GLN H 1 100 TYR H . . 3.840 2.896 2.686 3.052 . 0 0 "[ . 1 . 2]" 1
2797 1 99 GLN H 1 102 LYS H . . 5.500 4.819 4.661 5.025 . 0 0 "[ . 1 . 2]" 1
2798 1 99 GLN HA 1 99 GLN HE21 . . 5.030 3.100 2.403 3.850 . 0 0 "[ . 1 . 2]" 1
2799 1 99 GLN HA 1 99 GLN HE22 . . 5.140 3.526 3.021 3.868 . 0 0 "[ . 1 . 2]" 1
2800 1 99 GLN HA 1 102 LYS H . . 3.910 3.541 3.328 3.887 . 0 0 "[ . 1 . 2]" 1
2801 1 99 GLN HA 1 102 LYS HB2 . . 3.660 2.836 2.514 3.134 . 0 0 "[ . 1 . 2]" 1
2802 1 99 GLN HA 1 102 LYS QD . . 4.080 2.797 2.264 3.421 . 0 0 "[ . 1 . 2]" 1
2803 1 99 GLN HA 1 102 LYS QE . . 4.960 4.242 3.275 4.958 . 0 0 "[ . 1 . 2]" 1
2804 1 99 GLN HA 1 102 LYS HG2 . . 5.500 4.978 4.615 5.267 . 0 0 "[ . 1 . 2]" 1
2805 1 99 GLN HA 1 102 LYS HG3 . . 5.100 3.650 3.196 4.131 . 0 0 "[ . 1 . 2]" 1
2806 1 99 GLN HA 1 103 GLU H . . 4.500 3.976 3.686 4.204 . 0 0 "[ . 1 . 2]" 1
2807 1 99 GLN HA 1 103 GLU HB2 . . 5.500 5.137 4.813 5.569 0.069 1 0 "[ . 1 . 2]" 1
2808 1 99 GLN HA 1 103 GLU QG . . 5.500 4.753 4.267 5.345 . 0 0 "[ . 1 . 2]" 1
2809 1 99 GLN HB2 1 100 TYR H . . 4.510 2.961 2.409 3.666 . 0 0 "[ . 1 . 2]" 1
2810 1 99 GLN HB3 1 100 TYR H . . 4.020 2.991 2.412 3.564 . 0 0 "[ . 1 . 2]" 1
2811 1 99 GLN HE21 1 102 LYS QD . . 5.320 4.029 3.544 4.536 . 0 0 "[ . 1 . 2]" 1
2812 1 99 GLN HE21 1 103 GLU H . . 5.500 5.094 4.124 6.245 0.745 20 1 "[ . 1 . +]" 1
2813 1 99 GLN HE21 1 103 GLU QG . . 4.680 4.023 3.257 5.106 0.426 20 0 "[ . 1 . 2]" 1
2814 1 99 GLN HE22 1 102 LYS HB2 . . 5.500 4.061 3.404 4.659 . 0 0 "[ . 1 . 2]" 1
2815 1 99 GLN HE22 1 102 LYS QD . . 4.900 3.563 2.571 4.546 . 0 0 "[ . 1 . 2]" 1
2816 1 99 GLN HE22 1 102 LYS QE . . 5.500 4.393 2.578 6.170 0.670 6 1 "[ .+ 1 . 2]" 1
2817 1 99 GLN HE22 1 103 GLU QG . . 5.200 4.406 2.863 5.091 . 0 0 "[ . 1 . 2]" 1
2818 1 100 TYR H 1 100 TYR HB2 . . 3.870 2.674 2.468 2.835 . 0 0 "[ . 1 . 2]" 1
2819 1 100 TYR H 1 100 TYR HB3 . . 3.500 2.331 2.189 2.424 . 0 0 "[ . 1 . 2]" 1
2820 1 100 TYR H 1 100 TYR QD . . 4.170 4.179 4.078 4.231 0.061 12 0 "[ . 1 . 2]" 1
2821 1 100 TYR H 1 101 GLN H . . 3.560 2.830 2.664 2.992 . 0 0 "[ . 1 . 2]" 1
2822 1 100 TYR H 1 102 LYS H . . 4.740 4.402 4.202 4.687 . 0 0 "[ . 1 . 2]" 1
2823 1 100 TYR HA 1 100 TYR QD . . 3.210 2.562 2.353 2.912 . 0 0 "[ . 1 . 2]" 1
2824 1 100 TYR HA 1 100 TYR QE . . 5.500 4.692 4.589 4.885 . 0 0 "[ . 1 . 2]" 1
2825 1 100 TYR HA 1 101 GLN HA . . 5.500 4.790 4.715 4.859 . 0 0 "[ . 1 . 2]" 1
2826 1 100 TYR HA 1 102 LYS H . . 5.500 4.627 4.338 4.989 . 0 0 "[ . 1 . 2]" 1
2827 1 100 TYR HA 1 103 GLU H . . 4.440 3.556 3.296 3.702 . 0 0 "[ . 1 . 2]" 1
2828 1 100 TYR HA 1 103 GLU HA . . 5.500 5.494 5.298 5.583 0.083 15 0 "[ . 1 . 2]" 1
2829 1 100 TYR HA 1 103 GLU HB2 . . 4.790 2.619 2.471 2.772 . 0 0 "[ . 1 . 2]" 1
2830 1 100 TYR HA 1 103 GLU HB3 . . 4.320 3.987 3.705 4.396 0.076 20 0 "[ . 1 . 2]" 1
2831 1 100 TYR HA 1 103 GLU QG . . 5.500 3.923 3.524 4.331 . 0 0 "[ . 1 . 2]" 1
2832 1 100 TYR HA 1 104 SER H . . 4.800 3.710 3.476 3.895 . 0 0 "[ . 1 . 2]" 1
2833 1 100 TYR HB2 1 101 GLN H . . 4.570 3.981 3.810 4.195 . 0 0 "[ . 1 . 2]" 1
2834 1 100 TYR HB3 1 101 GLN H . . 4.170 2.606 2.339 2.894 . 0 0 "[ . 1 . 2]" 1
2835 1 100 TYR HB3 1 101 GLN HA . . 5.500 4.508 4.211 4.779 . 0 0 "[ . 1 . 2]" 1
2836 1 100 TYR HB3 1 101 GLN HG3 . . 4.920 3.987 3.598 4.412 . 0 0 "[ . 1 . 2]" 1
2837 1 100 TYR QD 1 101 GLN H . . 3.920 3.417 2.960 3.717 . 0 0 "[ . 1 . 2]" 1
2838 1 100 TYR QD 1 101 GLN HA . . 3.930 3.889 3.492 4.032 0.102 1 0 "[ . 1 . 2]" 1
2839 1 100 TYR QD 1 101 GLN HE21 . . 5.280 5.019 4.434 5.357 0.077 9 0 "[ . 1 . 2]" 1
2840 1 100 TYR QD 1 101 GLN HG2 . . 4.230 3.907 2.827 4.300 0.070 10 0 "[ . 1 . 2]" 1
2841 1 100 TYR QD 1 101 GLN HG3 . . 4.820 3.326 2.652 3.695 . 0 0 "[ . 1 . 2]" 1
2842 1 100 TYR QD 1 104 SER H . . 5.320 4.186 3.733 4.595 . 0 0 "[ . 1 . 2]" 1
2843 1 100 TYR QD 1 104 SER QB . . 5.200 3.706 3.045 4.142 . 0 0 "[ . 1 . 2]" 1
2844 1 100 TYR QE 1 101 GLN HA . . 5.500 4.599 3.906 5.020 . 0 0 "[ . 1 . 2]" 1
2845 1 100 TYR QE 1 101 GLN HG2 . . 5.500 4.554 3.207 5.190 . 0 0 "[ . 1 . 2]" 1
2846 1 100 TYR QE 1 104 SER H . . 5.500 4.868 4.359 5.514 0.014 13 0 "[ . 1 . 2]" 1
2847 1 100 TYR QE 1 104 SER QB . . 4.090 3.419 2.855 3.885 . 0 0 "[ . 1 . 2]" 1
2848 1 101 GLN H 1 101 GLN HB2 . . 3.730 2.425 2.322 2.509 . 0 0 "[ . 1 . 2]" 1
2849 1 101 GLN H 1 101 GLN HB3 . . 3.950 3.606 3.557 3.659 . 0 0 "[ . 1 . 2]" 1
2850 1 101 GLN H 1 101 GLN HE21 . . 5.500 4.176 3.525 4.800 . 0 0 "[ . 1 . 2]" 1
2851 1 101 GLN H 1 101 GLN HG2 . . 3.870 3.584 3.022 3.826 . 0 0 "[ . 1 . 2]" 1
2852 1 101 GLN H 1 101 GLN HG3 . . 3.520 2.595 2.429 2.851 . 0 0 "[ . 1 . 2]" 1
2853 1 101 GLN H 1 102 LYS H . . 3.530 2.886 2.775 3.079 . 0 0 "[ . 1 . 2]" 1
2854 1 101 GLN HA 1 101 GLN HE21 . . 5.500 5.049 4.785 5.324 . 0 0 "[ . 1 . 2]" 1
2855 1 101 GLN HA 1 101 GLN HG2 . . 3.610 2.371 2.197 2.698 . 0 0 "[ . 1 . 2]" 1
2856 1 101 GLN HA 1 101 GLN HG3 . . 4.000 3.012 2.759 3.475 . 0 0 "[ . 1 . 2]" 1
2857 1 101 GLN HA 1 102 LYS HA . . 4.810 4.842 4.783 4.883 0.073 14 0 "[ . 1 . 2]" 1
2858 1 101 GLN HA 1 104 SER H . . 4.460 3.768 3.370 4.012 . 0 0 "[ . 1 . 2]" 1
2859 1 101 GLN HA 1 104 SER QB . . 3.810 3.123 2.583 3.548 . 0 0 "[ . 1 . 2]" 1
2860 1 101 GLN HA 1 105 GLN H . . 4.760 3.469 3.141 3.754 . 0 0 "[ . 1 . 2]" 1
2861 1 101 GLN HB2 1 102 LYS H . . 3.810 2.667 2.403 2.891 . 0 0 "[ . 1 . 2]" 1
2862 1 101 GLN HB2 1 102 LYS HA . . 5.500 4.655 4.362 4.865 . 0 0 "[ . 1 . 2]" 1
2863 1 101 GLN HB2 1 103 GLU H . . 5.500 5.327 5.039 5.562 0.062 8 0 "[ . 1 . 2]" 1
2864 1 101 GLN HB3 1 102 LYS H . . 4.010 3.368 2.986 3.661 . 0 0 "[ . 1 . 2]" 1
2865 1 101 GLN HB3 1 102 LYS HA . . 4.960 4.284 4.060 4.481 . 0 0 "[ . 1 . 2]" 1
2866 1 101 GLN HB3 1 102 LYS HG3 . . 5.200 4.352 3.799 4.798 . 0 0 "[ . 1 . 2]" 1
2867 1 101 GLN HG2 1 102 LYS H . . 5.030 4.995 4.851 5.094 0.064 8 0 "[ . 1 . 2]" 1
2868 1 101 GLN HG3 1 102 LYS H . . 5.500 4.625 4.448 4.818 . 0 0 "[ . 1 . 2]" 1
2869 1 102 LYS H 1 102 LYS HB2 . . 3.590 2.486 2.361 2.620 . 0 0 "[ . 1 . 2]" 1
2870 1 102 LYS H 1 102 LYS HB3 . . 3.630 3.597 3.530 3.660 0.030 2 0 "[ . 1 . 2]" 1
2871 1 102 LYS H 1 102 LYS QD . . 4.970 3.730 3.336 4.031 . 0 0 "[ . 1 . 2]" 1
2872 1 102 LYS H 1 102 LYS HG2 . . 3.970 3.444 3.087 3.756 . 0 0 "[ . 1 . 2]" 1
2873 1 102 LYS H 1 102 LYS HG3 . . 4.570 2.262 1.995 2.521 . 0 0 "[ . 1 . 2]" 1
2874 1 102 LYS H 1 103 GLU H . . 3.360 2.893 2.786 3.048 . 0 0 "[ . 1 . 2]" 1
2875 1 102 LYS HA 1 102 LYS QD . . 4.370 4.122 3.918 4.352 . 0 0 "[ . 1 . 2]" 1
2876 1 102 LYS HA 1 102 LYS QE . . 5.500 4.707 4.168 5.165 . 0 0 "[ . 1 . 2]" 1
2877 1 102 LYS HA 1 102 LYS HG2 . . 3.940 2.598 2.331 2.895 . 0 0 "[ . 1 . 2]" 1
2878 1 102 LYS HA 1 102 LYS HG3 . . 4.030 3.097 2.800 3.290 . 0 0 "[ . 1 . 2]" 1
2879 1 102 LYS HA 1 105 GLN QB . . 3.750 2.683 2.388 3.494 . 0 0 "[ . 1 . 2]" 1
2880 1 102 LYS HA 1 105 GLN HE21 . . 5.500 5.321 3.231 5.578 0.078 6 0 "[ . 1 . 2]" 1
2881 1 102 LYS HA 1 105 GLN HE22 . . 5.000 4.989 4.280 5.088 0.088 8 0 "[ . 1 . 2]" 1
2882 1 102 LYS HA 1 106 ALA H . . 4.240 3.611 3.188 3.920 . 0 0 "[ . 1 . 2]" 1
2883 1 102 LYS HA 1 106 ALA MB . . 3.850 3.922 3.635 3.964 0.114 11 0 "[ . 1 . 2]" 1
2884 1 102 LYS HB2 1 102 LYS QE . . 4.670 3.640 2.486 4.304 . 0 0 "[ . 1 . 2]" 1
2885 1 102 LYS HB2 1 103 GLU H . . 3.560 2.488 2.332 2.823 . 0 0 "[ . 1 . 2]" 1
2886 1 102 LYS HB2 1 103 GLU HB2 . . 4.660 4.510 4.331 4.742 0.082 20 0 "[ . 1 . 2]" 1
2887 1 102 LYS HB3 1 102 LYS QD . . 3.820 2.651 2.237 3.158 . 0 0 "[ . 1 . 2]" 1
2888 1 102 LYS HB3 1 102 LYS QE . . 4.710 3.431 2.113 4.216 . 0 0 "[ . 1 . 2]" 1
2889 1 102 LYS HB3 1 103 GLU H . . 3.830 3.469 3.231 3.760 . 0 0 "[ . 1 . 2]" 1
2890 1 102 LYS HB3 1 106 ALA MB . . 4.180 4.099 3.686 4.281 0.101 3 0 "[ . 1 . 2]" 1
2891 1 102 LYS QD 1 102 LYS HG2 . . 2.400 2.414 2.325 2.577 0.177 7 0 "[ . 1 . 2]" 1
2892 1 102 LYS QE 1 102 LYS HG3 . . 3.690 2.934 2.343 3.580 . 0 0 "[ . 1 . 2]" 1
2893 1 102 LYS HG2 1 103 GLU H . . 5.500 5.017 4.888 5.188 . 0 0 "[ . 1 . 2]" 1
2894 1 102 LYS HG3 1 103 GLU H . . 5.200 4.415 4.276 4.667 . 0 0 "[ . 1 . 2]" 1
2895 1 103 GLU H 1 103 GLU HB2 . . 3.600 2.218 2.126 2.518 . 0 0 "[ . 1 . 2]" 1
2896 1 103 GLU H 1 103 GLU HB3 . . 3.470 3.467 3.379 3.543 0.073 1 0 "[ . 1 . 2]" 1
2897 1 103 GLU H 1 103 GLU QG . . 3.690 3.040 2.700 3.537 . 0 0 "[ . 1 . 2]" 1
2898 1 103 GLU H 1 106 ALA H . . 5.300 4.831 4.663 5.136 . 0 0 "[ . 1 . 2]" 1
2899 1 103 GLU HA 1 103 GLU QG . . 3.880 2.478 2.079 2.998 . 0 0 "[ . 1 . 2]" 1
2900 1 103 GLU HA 1 106 ALA MB . . 3.740 2.957 2.611 3.251 . 0 0 "[ . 1 . 2]" 1
2901 1 103 GLU HA 1 107 TYR QD . . 4.800 4.695 3.633 4.899 0.099 8 0 "[ . 1 . 2]" 1
2902 1 103 GLU HB2 1 104 SER H . . 4.310 2.736 2.485 3.301 . 0 0 "[ . 1 . 2]" 1
2903 1 103 GLU HB2 1 104 SER HA . . 5.500 4.801 4.490 5.202 . 0 0 "[ . 1 . 2]" 1
2904 1 103 GLU HB3 1 104 SER H . . 3.970 3.019 2.622 3.549 . 0 0 "[ . 1 . 2]" 1
2905 1 103 GLU HB3 1 104 SER HA . . 5.270 3.966 3.714 4.306 . 0 0 "[ . 1 . 2]" 1
2906 1 103 GLU HB3 1 104 SER QB . . 5.500 4.442 3.890 5.095 . 0 0 "[ . 1 . 2]" 1
2907 1 103 GLU QG 1 104 SER H . . 5.220 4.373 4.227 4.660 . 0 0 "[ . 1 . 2]" 1
2908 1 104 SER H 1 104 SER QB . . 3.720 2.186 2.005 2.779 . 0 0 "[ . 1 . 2]" 1
2909 1 104 SER H 1 105 GLN H . . 3.410 2.826 2.528 3.083 . 0 0 "[ . 1 . 2]" 1
2910 1 104 SER H 1 105 GLN QB . . 5.260 4.407 3.958 4.583 . 0 0 "[ . 1 . 2]" 1
2911 1 104 SER H 1 106 ALA MB . . 5.500 4.811 4.559 5.100 . 0 0 "[ . 1 . 2]" 1
2912 1 104 SER H 1 107 TYR H . . 5.020 4.637 4.465 4.906 . 0 0 "[ . 1 . 2]" 1
2913 1 104 SER HA 1 105 GLN QB . . 5.500 5.198 5.097 5.265 . 0 0 "[ . 1 . 2]" 1
2914 1 104 SER HA 1 107 TYR H . . 4.030 3.369 3.146 3.701 . 0 0 "[ . 1 . 2]" 1
2915 1 104 SER HA 1 107 TYR HB2 . . 4.120 2.820 2.281 3.601 . 0 0 "[ . 1 . 2]" 1
2916 1 104 SER HA 1 107 TYR HB3 . . 3.660 3.274 2.896 3.570 . 0 0 "[ . 1 . 2]" 1
2917 1 104 SER HA 1 107 TYR QD . . 4.260 4.250 3.714 4.359 0.099 15 0 "[ . 1 . 2]" 1
2918 1 104 SER HA 1 108 TYR H . . 4.990 4.613 4.194 4.843 . 0 0 "[ . 1 . 2]" 1
2919 1 104 SER HA 1 108 TYR QD . . 4.450 3.852 3.406 4.351 . 0 0 "[ . 1 . 2]" 1
2920 1 104 SER HA 1 108 TYR QE . . 4.740 4.145 3.508 4.688 . 0 0 "[ . 1 . 2]" 1
2921 1 104 SER QB 1 105 GLN H . . 4.130 2.558 1.981 3.068 . 0 0 "[ . 1 . 2]" 1
2922 1 104 SER QB 1 105 GLN HA . . 4.040 3.873 3.753 3.991 . 0 0 "[ . 1 . 2]" 1
2923 1 104 SER QB 1 105 GLN QB . . 5.470 3.948 3.531 4.371 . 0 0 "[ . 1 . 2]" 1
2924 1 104 SER QB 1 107 TYR H . . 5.500 4.835 4.685 4.944 . 0 0 "[ . 1 . 2]" 1
2925 1 104 SER QB 1 108 TYR QD . . 4.710 2.750 2.248 3.639 . 0 0 "[ . 1 . 2]" 1
2926 1 104 SER QB 1 108 TYR QE . . 4.740 2.581 2.181 3.861 . 0 0 "[ . 1 . 2]" 1
2927 1 105 GLN H 1 105 GLN QB . . 2.880 2.198 2.140 2.261 . 0 0 "[ . 1 . 2]" 1
2928 1 105 GLN H 1 105 GLN HG2 . . 4.830 4.436 4.327 4.505 . 0 0 "[ . 1 . 2]" 1
2929 1 105 GLN H 1 108 TYR QD . . 3.560 3.649 3.630 3.663 0.103 19 0 "[ . 1 . 2]" 1
2930 1 105 GLN HA 1 105 GLN HE21 . . 5.500 3.884 3.595 4.351 . 0 0 "[ . 1 . 2]" 1
2931 1 105 GLN HA 1 105 GLN HG2 . . 3.740 2.626 2.457 2.838 . 0 0 "[ . 1 . 2]" 1
2932 1 105 GLN HA 1 105 GLN HG3 . . 3.640 3.640 3.555 3.717 0.077 13 0 "[ . 1 . 2]" 1
2933 1 105 GLN HA 1 107 TYR H . . 4.610 4.570 3.965 4.682 0.072 19 0 "[ . 1 . 2]" 1
2934 1 105 GLN HA 1 108 TYR H . . 4.210 3.370 3.129 3.787 . 0 0 "[ . 1 . 2]" 1
2935 1 105 GLN HA 1 108 TYR HB2 . . 4.260 2.322 2.118 2.890 . 0 0 "[ . 1 . 2]" 1
2936 1 105 GLN HA 1 108 TYR HB3 . . 4.610 3.846 3.556 4.432 . 0 0 "[ . 1 . 2]" 1
2937 1 105 GLN HA 1 108 TYR QD . . 4.620 2.554 2.110 3.037 . 0 0 "[ . 1 . 2]" 1
2938 1 105 GLN HA 1 108 TYR QE . . 5.500 4.801 4.313 5.344 . 0 0 "[ . 1 . 2]" 1
2939 1 105 GLN HA 1 109 ASP H . . 5.260 4.507 3.864 4.917 . 0 0 "[ . 1 . 2]" 1
2940 1 105 GLN QB 1 105 GLN HE21 . . 4.220 3.349 1.909 3.694 . 0 0 "[ . 1 . 2]" 1
2941 1 105 GLN QB 1 106 ALA HA . . 4.680 4.357 4.233 4.631 . 0 0 "[ . 1 . 2]" 1
2942 1 105 GLN QB 1 106 ALA MB . . 4.680 3.867 3.703 4.222 . 0 0 "[ . 1 . 2]" 1
2943 1 105 GLN QB 1 107 TYR H . . 5.500 4.813 4.529 5.075 . 0 0 "[ . 1 . 2]" 1
2944 1 105 GLN HE21 1 107 TYR H . . 5.500 5.254 4.502 5.548 0.048 16 0 "[ . 1 . 2]" 1
2945 1 105 GLN HE21 1 109 ASP H . . 5.500 4.039 3.379 5.583 0.083 15 0 "[ . 1 . 2]" 1
2946 1 105 GLN HE22 1 106 ALA MB . . 5.500 3.150 2.622 3.440 . 0 0 "[ . 1 . 2]" 1
2947 1 105 GLN HE22 1 108 TYR H . . 5.500 5.582 5.530 5.824 0.324 11 0 "[ . 1 . 2]" 1
2948 1 105 GLN HE22 1 110 GLY H . . 5.200 4.028 3.616 4.706 . 0 0 "[ . 1 . 2]" 1
2949 1 105 GLN HE22 1 110 GLY QA . . 5.500 4.403 3.824 5.156 . 0 0 "[ . 1 . 2]" 1
2950 1 105 GLN HG2 1 106 ALA H . . 4.110 4.179 4.066 4.205 0.095 15 0 "[ . 1 . 2]" 1
2951 1 105 GLN HG2 1 106 ALA HA . . 5.500 4.462 4.097 4.826 . 0 0 "[ . 1 . 2]" 1
2952 1 105 GLN HG2 1 106 ALA MB . . 5.500 5.097 4.826 5.367 . 0 0 "[ . 1 . 2]" 1
2953 1 105 GLN HG2 1 109 ASP QB . . 4.330 3.379 2.564 4.182 . 0 0 "[ . 1 . 2]" 1
2954 1 105 GLN HG3 1 106 ALA HA . . 5.500 5.524 5.440 5.573 0.073 10 0 "[ . 1 . 2]" 1
2955 1 105 GLN HG3 1 106 ALA MB . . 5.500 5.544 5.364 5.617 0.117 13 0 "[ . 1 . 2]" 1
2956 1 106 ALA H 1 106 ALA MB . . 3.040 2.196 2.127 2.260 . 0 0 "[ . 1 . 2]" 1
2957 1 106 ALA H 1 107 TYR H . . 3.150 2.796 2.672 2.891 . 0 0 "[ . 1 . 2]" 1
2958 1 106 ALA H 1 107 TYR HA . . 5.500 5.352 5.239 5.505 0.005 15 0 "[ . 1 . 2]" 1
2959 1 106 ALA H 1 107 TYR HB2 . . 5.120 4.682 4.469 4.900 . 0 0 "[ . 1 . 2]" 1
2960 1 106 ALA H 1 109 ASP H . . 5.170 4.941 4.658 5.137 . 0 0 "[ . 1 . 2]" 1
2961 1 106 ALA H 1 110 GLY H . . 4.990 5.043 4.874 5.079 0.089 19 0 "[ . 1 . 2]" 1
2962 1 106 ALA HA 1 108 TYR H . . 5.310 3.738 3.576 3.949 . 0 0 "[ . 1 . 2]" 1
2963 1 106 ALA HA 1 109 ASP H . . 4.100 3.492 3.129 3.732 . 0 0 "[ . 1 . 2]" 1
2964 1 106 ALA HA 1 109 ASP QB . . 3.490 3.487 3.166 3.594 0.104 14 0 "[ . 1 . 2]" 1
2965 1 106 ALA HA 1 110 GLY H . . 3.650 2.528 2.373 2.732 . 0 0 "[ . 1 . 2]" 1
2966 1 106 ALA HA 1 110 GLY QA . . 3.660 3.264 2.826 3.650 . 0 0 "[ . 1 . 2]" 1
2967 1 106 ALA HA 1 111 ARG H . . 5.140 4.489 3.548 5.171 0.031 19 0 "[ . 1 . 2]" 1
2968 1 106 ALA MB 1 107 TYR H . . 3.660 2.555 2.421 3.003 . 0 0 "[ . 1 . 2]" 1
2969 1 106 ALA MB 1 107 TYR HA . . 4.310 4.011 3.813 4.211 . 0 0 "[ . 1 . 2]" 1
2970 1 106 ALA MB 1 107 TYR HB2 . . 5.410 3.975 3.666 4.116 . 0 0 "[ . 1 . 2]" 1
2971 1 106 ALA MB 1 107 TYR HB3 . . 5.500 5.177 4.791 5.302 . 0 0 "[ . 1 . 2]" 1
2972 1 106 ALA MB 1 107 TYR QD . . 5.500 4.542 4.255 5.015 . 0 0 "[ . 1 . 2]" 1
2973 1 106 ALA MB 1 108 TYR H . . 5.500 4.248 4.112 4.523 . 0 0 "[ . 1 . 2]" 1
2974 1 106 ALA MB 1 109 ASP H . . 5.500 4.642 4.485 4.929 . 0 0 "[ . 1 . 2]" 1
2975 1 106 ALA MB 1 109 ASP QB . . 5.240 4.816 4.528 4.955 . 0 0 "[ . 1 . 2]" 1
2976 1 106 ALA MB 1 110 GLY H . . 5.500 3.918 3.742 4.154 . 0 0 "[ . 1 . 2]" 1
2977 1 106 ALA MB 1 110 GLY QA . . 5.500 3.647 3.187 4.165 . 0 0 "[ . 1 . 2]" 1
2978 1 107 TYR H 1 107 TYR HB2 . . 3.100 2.085 1.983 2.212 . 0 0 "[ . 1 . 2]" 1
2979 1 107 TYR H 1 107 TYR HB3 . . 3.150 3.145 2.714 3.230 0.080 19 0 "[ . 1 . 2]" 1
2980 1 107 TYR H 1 107 TYR QD . . 4.150 3.733 3.439 4.104 . 0 0 "[ . 1 . 2]" 1
2981 1 107 TYR H 1 108 TYR H . . 3.020 2.791 2.311 3.007 . 0 0 "[ . 1 . 2]" 1
2982 1 107 TYR H 1 109 ASP H . . 4.380 4.317 3.783 4.431 0.051 17 0 "[ . 1 . 2]" 1
2983 1 107 TYR HA 1 107 TYR QD . . 3.030 2.592 2.300 2.910 . 0 0 "[ . 1 . 2]" 1
2984 1 107 TYR HA 1 107 TYR QE . . 4.510 4.250 4.063 4.454 . 0 0 "[ . 1 . 2]" 1
2985 1 107 TYR HA 1 109 ASP H . . 4.940 4.040 3.824 4.648 . 0 0 "[ . 1 . 2]" 1
2986 1 107 TYR HA 1 110 GLY H . . 4.760 4.703 4.148 4.840 0.080 5 0 "[ . 1 . 2]" 1
2987 1 107 TYR HA 1 111 ARG HA . . 2.400 2.453 2.208 2.500 0.100 14 0 "[ . 1 . 2]" 1
2988 1 107 TYR HB3 1 108 TYR H . . 3.890 3.693 3.403 3.912 0.022 4 0 "[ . 1 . 2]" 1
2989 1 107 TYR HB3 1 108 TYR QE . . 5.310 5.134 4.666 5.387 0.077 14 0 "[ . 1 . 2]" 1
2990 1 107 TYR QD 1 108 TYR H . . 4.820 4.798 4.615 4.869 0.049 17 0 "[ . 1 . 2]" 1
2991 1 107 TYR QD 1 108 TYR HA . . 4.710 4.731 4.474 4.822 0.112 19 0 "[ . 1 . 2]" 1
2992 1 107 TYR QD 1 111 ARG QD . . 4.570 3.397 2.675 4.217 . 0 0 "[ . 1 . 2]" 1
2993 1 107 TYR QE 1 111 ARG QD . . 4.190 4.014 3.388 4.299 0.109 14 0 "[ . 1 . 2]" 1
2994 1 107 TYR QE 1 111 ARG QG . . 5.090 5.107 4.586 5.195 0.105 4 0 "[ . 1 . 2]" 1
2995 1 108 TYR H 1 108 TYR HB2 . . 3.050 2.351 2.274 2.411 . 0 0 "[ . 1 . 2]" 1
2996 1 108 TYR H 1 108 TYR HB3 . . 3.520 3.562 3.501 3.593 0.073 5 0 "[ . 1 . 2]" 1
2997 1 108 TYR H 1 108 TYR QD . . 4.400 3.621 3.417 3.773 . 0 0 "[ . 1 . 2]" 1
2998 1 108 TYR H 1 109 ASP H . . 3.300 2.106 1.900 2.280 . 0 0 "[ . 1 . 2]" 1
2999 1 108 TYR H 1 109 ASP QB . . 5.260 3.834 3.442 4.151 . 0 0 "[ . 1 . 2]" 1
3000 1 108 TYR H 1 110 GLY QA . . 5.340 5.371 5.104 5.435 0.095 12 0 "[ . 1 . 2]" 1
3001 1 108 TYR HA 1 108 TYR QD . . 3.000 2.360 2.105 2.671 . 0 0 "[ . 1 . 2]" 1
3002 1 108 TYR HA 1 108 TYR QE . . 4.640 4.367 4.250 4.519 . 0 0 "[ . 1 . 2]" 1
3003 1 108 TYR HA 1 109 ASP H . . 3.580 3.400 3.199 3.575 . 0 0 "[ . 1 . 2]" 1
3004 1 108 TYR HA 1 111 ARG HB2 . . 5.500 5.395 4.941 5.582 0.082 8 0 "[ . 1 . 2]" 1
3005 1 108 TYR HA 1 111 ARG HB3 . . 4.910 4.071 3.759 4.268 . 0 0 "[ . 1 . 2]" 1
3006 1 108 TYR HA 1 111 ARG QG . . 5.080 4.816 3.747 5.177 0.097 8 0 "[ . 1 . 2]" 1
3007 1 108 TYR HB2 1 109 ASP H . . 3.810 3.305 2.795 3.615 . 0 0 "[ . 1 . 2]" 1
3008 1 108 TYR HB2 1 110 GLY H . . 5.500 5.204 4.807 5.464 . 0 0 "[ . 1 . 2]" 1
3009 1 108 TYR HB3 1 109 ASP H . . 3.940 3.859 3.367 4.026 0.086 12 0 "[ . 1 . 2]" 1
3010 1 108 TYR HB3 1 109 ASP QB . . 4.240 3.860 2.762 4.339 0.099 2 0 "[ . 1 . 2]" 1
3011 1 109 ASP H 1 109 ASP QB . . 2.970 2.503 2.211 2.731 . 0 0 "[ . 1 . 2]" 1
3012 1 109 ASP H 1 110 GLY H . . 3.320 2.229 1.825 2.453 . 0 0 "[ . 1 . 2]" 1
3013 1 109 ASP H 1 110 GLY QA . . 5.310 4.058 3.909 4.250 . 0 0 "[ . 1 . 2]" 1
3014 1 109 ASP HA 1 110 GLY H . . 3.600 3.584 3.383 3.641 0.041 5 0 "[ . 1 . 2]" 1
3015 1 109 ASP HA 1 111 ARG H . . 5.500 4.414 3.757 5.537 0.037 7 0 "[ . 1 . 2]" 1
3016 1 109 ASP HA 1 111 ARG HB3 . . 5.500 5.108 4.798 5.539 0.039 15 0 "[ . 1 . 2]" 1
3017 1 109 ASP HA 1 111 ARG HE . . 5.380 4.459 3.546 5.474 0.094 14 0 "[ . 1 . 2]" 1
3018 1 109 ASP HA 1 111 ARG QG . . 5.500 4.244 3.909 4.564 . 0 0 "[ . 1 . 2]" 1
3019 1 109 ASP QB 1 110 GLY H . . 3.790 2.303 2.068 3.021 . 0 0 "[ . 1 . 2]" 1
3020 1 109 ASP QB 1 110 GLY QA . . 4.880 3.636 3.319 4.021 . 0 0 "[ . 1 . 2]" 1
3021 1 109 ASP QB 1 111 ARG H . . 4.860 4.564 4.287 4.927 0.067 11 0 "[ . 1 . 2]" 1
3022 1 109 ASP QB 1 111 ARG QG . . 5.280 5.331 5.081 5.396 0.116 12 0 "[ . 1 . 2]" 1
3023 1 110 GLY H 1 110 GLY QA . . 2.770 2.235 2.147 2.325 . 0 0 "[ . 1 . 2]" 1
3024 1 110 GLY H 1 111 ARG HB3 . . 5.500 4.355 3.481 4.736 . 0 0 "[ . 1 . 2]" 1
3025 1 110 GLY QA 1 111 ARG H . . 3.560 2.632 2.329 2.914 . 0 0 "[ . 1 . 2]" 1
3026 1 110 GLY QA 1 111 ARG HA . . 4.150 4.193 4.139 4.234 0.084 13 0 "[ . 1 . 2]" 1
3027 1 110 GLY QA 1 111 ARG QG . . 5.500 4.161 3.825 4.491 . 0 0 "[ . 1 . 2]" 1
3028 1 110 GLY QA 1 112 ARG H . . 4.720 3.294 3.026 3.579 . 0 0 "[ . 1 . 2]" 1
3029 1 110 GLY QA 1 112 ARG HB3 . . 5.500 5.620 5.056 6.474 0.974 8 3 "[ * + 1 .- 2]" 1
3030 1 111 ARG H 1 111 ARG HB2 . . 3.880 3.648 3.463 3.883 0.003 15 0 "[ . 1 . 2]" 1
3031 1 111 ARG H 1 111 ARG HB3 . . 3.450 2.560 2.219 2.864 . 0 0 "[ . 1 . 2]" 1
3032 1 111 ARG H 1 111 ARG QD . . 5.260 4.402 3.360 5.122 . 0 0 "[ . 1 . 2]" 1
3033 1 111 ARG H 1 111 ARG HE . . 5.500 4.577 3.619 5.565 0.065 13 0 "[ . 1 . 2]" 1
3034 1 111 ARG H 1 111 ARG QG . . 3.830 2.565 2.023 3.459 . 0 0 "[ . 1 . 2]" 1
3035 1 111 ARG H 1 112 ARG H . . 3.730 3.107 2.655 3.389 . 0 0 "[ . 1 . 2]" 1
3036 1 111 ARG H 1 113 SER H . . 5.170 5.025 4.315 5.244 0.074 13 0 "[ . 1 . 2]" 1
3037 1 111 ARG HA 1 111 ARG QD . . 4.340 4.276 4.082 4.410 0.070 17 0 "[ . 1 . 2]" 1
3038 1 111 ARG HA 1 111 ARG QG . . 3.570 3.385 3.345 3.419 . 0 0 "[ . 1 . 2]" 1
3039 1 111 ARG HA 1 112 ARG H . . 3.190 3.037 2.742 3.273 0.083 16 0 "[ . 1 . 2]" 1
3040 1 111 ARG HB2 1 111 ARG HE . . 5.500 4.043 3.154 4.622 . 0 0 "[ . 1 . 2]" 1
3041 1 111 ARG HB2 1 112 ARG H . . 4.940 4.485 4.235 4.599 . 0 0 "[ . 1 . 2]" 1
3042 1 111 ARG HB2 1 112 ARG QD . . 5.500 4.967 4.301 5.574 0.074 8 0 "[ . 1 . 2]" 1
3043 1 111 ARG HB3 1 111 ARG HE . . 5.500 3.346 2.549 4.690 . 0 0 "[ . 1 . 2]" 1
3044 1 111 ARG HB3 1 111 ARG QG . . 2.600 2.292 2.184 2.415 . 0 0 "[ . 1 . 2]" 1
3045 1 111 ARG HB3 1 112 ARG H . . 4.760 4.542 4.290 4.683 . 0 0 "[ . 1 . 2]" 1
3046 1 111 ARG QD 1 112 ARG QG . . 5.500 3.883 3.228 4.209 . 0 0 "[ . 1 . 2]" 1
3047 1 111 ARG QG 1 112 ARG H . . 5.310 3.636 2.944 3.982 . 0 0 "[ . 1 . 2]" 1
3048 1 111 ARG QG 1 112 ARG QG . . 2.400 2.333 2.118 2.464 0.064 19 0 "[ . 1 . 2]" 1
3049 1 112 ARG H 1 112 ARG HB2 . . 3.630 2.638 2.294 2.984 . 0 0 "[ . 1 . 2]" 1
3050 1 112 ARG H 1 112 ARG HB3 . . 4.080 3.722 3.549 3.866 . 0 0 "[ . 1 . 2]" 1
3051 1 112 ARG H 1 112 ARG QD . . 5.500 3.734 1.752 4.557 . 0 0 "[ . 1 . 2]" 1
3052 1 112 ARG H 1 112 ARG QG . . 4.860 3.138 2.373 3.437 . 0 0 "[ . 1 . 2]" 1
3053 1 112 ARG H 1 113 SER HA . . 5.130 4.639 4.253 5.014 . 0 0 "[ . 1 . 2]" 1
3054 1 112 ARG HA 1 112 ARG QD . . 4.230 2.837 2.126 4.145 . 0 0 "[ . 1 . 2]" 1
3055 1 112 ARG HA 1 112 ARG QG . . 4.000 2.774 2.312 3.050 . 0 0 "[ . 1 . 2]" 1
3056 1 112 ARG HA 1 113 SER H . . 3.350 3.089 2.507 3.403 0.053 8 0 "[ . 1 . 2]" 1
3057 1 112 ARG HA 1 114 SER H . . 4.620 4.144 3.401 4.700 0.080 8 0 "[ . 1 . 2]" 1
3058 1 112 ARG HB2 1 112 ARG QG . . 2.690 2.276 2.156 2.576 . 0 0 "[ . 1 . 2]" 1
3059 1 112 ARG HB2 1 113 SER H . . 5.210 3.944 3.151 4.419 . 0 0 "[ . 1 . 2]" 1
3060 1 112 ARG HB3 1 113 SER H . . 5.070 4.419 4.181 4.609 . 0 0 "[ . 1 . 2]" 1
3061 1 113 SER HA 1 114 SER QB . . 3.820 3.891 3.685 3.930 0.110 19 0 "[ . 1 . 2]" 1
3062 1 113 SER HB2 1 114 SER H . . 5.500 4.319 3.037 4.684 . 0 0 "[ . 1 . 2]" 1
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