NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
467091 |
2ku6   |
16723 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ku6
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 2745
_Distance_constraint_stats_list.Viol_count 5537
_Distance_constraint_stats_list.Viol_total 9851.930
_Distance_constraint_stats_list.Viol_max 2.689
_Distance_constraint_stats_list.Viol_rms 0.0525
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0090
_Distance_constraint_stats_list.Viol_average_violations_only 0.0890
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 SER 3.678 0.125 1 0 "[ . 1 . 2]"
1 2 VAL 6.408 0.125 1 0 "[ . 1 . 2]"
1 3 VAL 5.304 0.147 8 0 "[ . 1 . 2]"
1 4 GLY 5.687 0.123 17 0 "[ . 1 . 2]"
1 5 GLY 2.839 0.110 12 0 "[ . 1 . 2]"
1 6 LEU 6.422 0.399 11 0 "[ . 1 . 2]"
1 7 GLY 1.142 0.077 6 0 "[ . 1 . 2]"
1 8 GLY 2.185 0.087 6 0 "[ . 1 . 2]"
1 9 TYR 9.462 0.174 11 0 "[ . 1 . 2]"
1 10 MET 3.597 0.106 16 0 "[ . 1 . 2]"
1 11 LEU 12.235 0.909 16 1 "[ . 1 .+ 2]"
1 12 GLY 0.535 0.196 3 0 "[ . 1 . 2]"
1 13 SER 3.820 0.909 16 1 "[ . 1 .+ 2]"
1 14 ALA 7.175 0.422 19 0 "[ . 1 . 2]"
1 15 MET 12.646 0.145 9 0 "[ . 1 . 2]"
1 16 SER 1.039 0.079 13 0 "[ . 1 . 2]"
1 17 ARG 12.883 0.922 15 8 "[* *-* *1 * + * 2]"
1 18 PRO 5.141 0.272 1 0 "[ . 1 . 2]"
1 19 MET 4.914 0.133 15 0 "[ . 1 . 2]"
1 20 ILE 9.294 0.147 12 0 "[ . 1 . 2]"
1 21 HIS 4.674 0.110 8 0 "[ . 1 . 2]"
1 22 PHE 9.640 0.611 2 1 "[ + . 1 . 2]"
1 23 GLY 0.772 0.078 16 0 "[ . 1 . 2]"
1 24 ASN 8.257 0.107 11 0 "[ . 1 . 2]"
1 25 ASP 3.069 0.098 2 0 "[ . 1 . 2]"
1 26 TRP 8.583 0.107 11 0 "[ . 1 . 2]"
1 27 GLU 4.747 0.092 10 0 "[ . 1 . 2]"
1 28 ASP 2.523 0.090 14 0 "[ . 1 . 2]"
1 29 ARG 6.945 0.683 9 1 "[ . +1 . 2]"
1 30 TYR 10.059 0.127 9 0 "[ . 1 . 2]"
1 31 TYR 12.158 0.475 8 0 "[ . 1 . 2]"
1 32 ARG 5.730 0.686 13 2 "[ . - 1 + . 2]"
1 33 GLU 4.199 0.103 13 0 "[ . 1 . 2]"
1 34 ASN 4.703 0.165 13 0 "[ . 1 . 2]"
1 35 MET 13.106 0.922 15 4 "[ .- *1 + * 2]"
1 36 TYR 5.446 0.143 14 0 "[ . 1 . 2]"
1 37 ARG 40.822 2.689 8 18 "[*-* ***+********* **]"
1 38 TYR 8.137 0.152 16 0 "[ . 1 . 2]"
1 39 PRO 5.884 0.111 18 0 "[ . 1 . 2]"
1 40 ASN 7.286 0.787 19 3 "[ - 1 . +*]"
1 41 GLN 17.132 0.787 19 3 "[ - 1 . +*]"
1 42 VAL 4.394 0.119 8 0 "[ . 1 . 2]"
1 43 TYR 8.478 0.104 10 0 "[ . 1 . 2]"
1 44 TYR 2.611 0.105 10 0 "[ . 1 . 2]"
1 45 ARG 7.398 0.111 18 0 "[ . 1 . 2]"
1 46 PRO 1.691 0.641 12 1 "[ . 1 + . 2]"
1 47 VAL 5.871 0.329 20 0 "[ . 1 . 2]"
1 48 SER 2.203 0.574 6 3 "[ -.+ 1* . 2]"
1 49 GLN 3.938 0.641 12 1 "[ . 1 + . 2]"
1 50 TYR 12.645 0.308 2 0 "[ . 1 . 2]"
1 51 SER 3.905 0.882 17 1 "[ . 1 . + 2]"
1 52 ASN 6.060 0.474 2 0 "[ . 1 . 2]"
1 53 GLN 9.920 0.542 3 1 "[ + . 1 . 2]"
1 54 LYS 6.858 0.841 17 1 "[ . 1 . + 2]"
1 55 ASN 8.843 0.882 17 1 "[ . 1 . + 2]"
1 56 PHE 3.331 0.111 12 0 "[ . 1 . 2]"
1 57 VAL 3.482 0.841 17 1 "[ . 1 . + 2]"
1 58 HIS 6.361 0.471 11 0 "[ . 1 . 2]"
1 59 ASP 5.457 0.721 8 3 "[* . + 1- . 2]"
1 60 CYS 8.136 0.756 8 3 "[* . + 1- . 2]"
1 61 VAL 4.547 0.128 11 0 "[ . 1 . 2]"
1 62 ASN 8.003 0.123 16 0 "[ . 1 . 2]"
1 63 ILE 6.871 0.107 4 0 "[ . 1 . 2]"
1 64 THR 6.166 0.384 19 0 "[ . 1 . 2]"
1 65 ILE 19.702 0.653 8 5 "[ * -. + 1 *.* 2]"
1 66 LYS 10.096 0.131 15 0 "[ . 1 . 2]"
1 67 GLN 6.478 0.115 18 0 "[ . 1 . 2]"
1 68 HIS 11.806 0.136 8 0 "[ . 1 . 2]"
1 69 THR 8.102 0.129 18 0 "[ . 1 . 2]"
1 70 VAL 1.607 0.100 11 0 "[ . 1 . 2]"
1 71 THR 7.601 0.147 8 0 "[ . 1 . 2]"
1 72 THR 9.590 0.134 17 0 "[ . 1 . 2]"
1 73 THR 8.586 0.151 6 0 "[ . 1 . 2]"
1 74 THR 7.250 0.131 8 0 "[ . 1 . 2]"
1 75 LYS 10.427 0.134 17 0 "[ . 1 . 2]"
1 76 GLY 7.938 0.124 17 0 "[ . 1 . 2]"
1 77 GLU 13.573 0.151 6 0 "[ . 1 . 2]"
1 78 ASN 8.794 0.388 18 0 "[ . 1 . 2]"
1 79 PHE 47.767 2.689 8 18 "[*-* ***+********* **]"
1 80 THR 2.120 0.093 7 0 "[ . 1 . 2]"
1 81 GLU 7.225 0.105 2 0 "[ . 1 . 2]"
1 82 THR 5.989 0.117 4 0 "[ . 1 . 2]"
1 83 ASP 3.567 0.111 2 0 "[ . 1 . 2]"
1 84 VAL 9.668 0.164 7 0 "[ . 1 . 2]"
1 85 LYS 9.433 0.164 7 0 "[ . 1 . 2]"
1 86 MET 11.659 0.329 4 0 "[ . 1 . 2]"
1 87 MET 16.416 0.651 4 1 "[ +. 1 . 2]"
1 88 GLU 23.720 0.653 8 8 "[ * -. +*1 *.*** 2]"
1 89 ARG 17.039 0.717 2 5 "[ + *. -1 .** 2]"
1 90 VAL 9.242 0.717 2 1 "[ + . 1 . 2]"
1 91 VAL 7.490 0.449 7 0 "[ . 1 . 2]"
1 92 GLU 2.529 0.449 7 0 "[ . 1 . 2]"
1 93 GLN 7.591 0.272 1 0 "[ . 1 . 2]"
1 94 MET 14.210 0.285 13 0 "[ . 1 . 2]"
1 95 CYS 8.997 0.756 8 2 "[ . + 1- . 2]"
1 96 VAL 2.331 0.127 3 0 "[ . 1 . 2]"
1 97 THR 16.474 0.898 13 3 "[ . * + . * 2]"
1 98 GLN 1.793 0.096 6 0 "[ . 1 . 2]"
1 99 TYR 12.434 0.767 19 4 "[ ** . 1 . - +2]"
1 100 GLN 14.355 0.890 17 3 "[ * . 1 . + *2]"
1 101 LYS 16.533 0.898 13 4 "[ . * + . * *2]"
1 102 GLU 1.610 0.111 14 0 "[ . 1 . 2]"
1 103 SER 4.895 0.489 1 0 "[ . 1 . 2]"
1 104 GLN 8.713 0.118 14 0 "[ . 1 . 2]"
1 105 ALA 4.813 0.118 14 0 "[ . 1 . 2]"
1 106 TYR 11.864 0.574 6 3 "[ -.+ 1* . 2]"
1 107 TYR 13.339 0.489 1 0 "[ . 1 . 2]"
1 108 ASP 6.508 0.287 3 0 "[ . 1 . 2]"
1 109 GLY 6.825 0.289 17 0 "[ . 1 . 2]"
1 110 ARG 6.712 0.657 8 3 "[ . + 1 .* - 2]"
1 111 ARG 20.902 0.886 7 7 "[ * . +* * * .* - 2]"
1 112 SER 5.181 0.776 10 4 "[ - . * + * . 2]"
1 113 SER 1.114 0.103 15 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 SER H1 1 2 VAL H . . 4.550 4.250 3.396 4.563 0.013 10 0 "[ . 1 . 2]" 1
2 1 1 SER H1 1 2 VAL HB . . 5.360 4.653 3.576 5.384 0.024 6 0 "[ . 1 . 2]" 1
3 1 1 SER H1 1 70 VAL QG . . 5.500 4.299 2.478 5.182 . 0 0 "[ . 1 . 2]" 1
4 1 1 SER HA 1 2 VAL H . . 2.940 2.338 2.203 2.678 . 0 0 "[ . 1 . 2]" 1
5 1 1 SER HA 1 2 VAL HB . . 5.140 4.594 4.036 5.144 0.004 5 0 "[ . 1 . 2]" 1
6 1 1 SER HA 1 70 VAL QG . . 5.500 4.376 2.684 4.947 . 0 0 "[ . 1 . 2]" 1
7 1 1 SER QB 1 2 VAL H . . 3.930 3.031 2.074 3.601 . 0 0 "[ . 1 . 2]" 1
8 1 1 SER QB 1 2 VAL HA . . 3.960 3.957 3.645 4.062 0.102 9 0 "[ . 1 . 2]" 1
9 1 1 SER QB 1 2 VAL HB . . 5.030 4.824 3.299 5.083 0.053 8 0 "[ . 1 . 2]" 1
10 1 1 SER QB 1 2 VAL MG1 . . 4.580 4.506 3.034 4.705 0.125 1 0 "[ . 1 . 2]" 1
11 1 1 SER QB 1 4 GLY H . . 4.680 4.279 3.422 4.754 0.074 7 0 "[ . 1 . 2]" 1
12 1 1 SER QB 1 70 VAL HB . . 4.850 3.864 2.165 4.934 0.084 8 0 "[ . 1 . 2]" 1
13 1 1 SER QB 1 71 THR HA . . 4.310 4.190 3.556 4.408 0.098 1 0 "[ . 1 . 2]" 1
14 1 2 VAL H 1 2 VAL HB . . 3.400 3.333 3.014 3.487 0.087 20 0 "[ . 1 . 2]" 1
15 1 2 VAL H 1 2 VAL MG1 . . 3.630 2.444 2.076 3.474 . 0 0 "[ . 1 . 2]" 1
16 1 2 VAL H 1 3 VAL HA . . 5.500 4.944 3.937 5.556 0.056 18 0 "[ . 1 . 2]" 1
17 1 2 VAL H 1 4 GLY H . . 3.710 3.382 2.611 3.794 0.084 3 0 "[ . 1 . 2]" 1
18 1 2 VAL H 1 4 GLY QA . . 5.500 3.978 2.938 5.379 . 0 0 "[ . 1 . 2]" 1
19 1 2 VAL HA 1 2 VAL MG2 . . 3.530 2.404 2.207 2.533 . 0 0 "[ . 1 . 2]" 1
20 1 2 VAL HA 1 3 VAL H . . 2.800 2.245 2.057 2.578 . 0 0 "[ . 1 . 2]" 1
21 1 2 VAL HA 1 3 VAL QG . . 5.050 3.514 2.898 4.242 . 0 0 "[ . 1 . 2]" 1
22 1 2 VAL HA 1 4 GLY H . . 4.800 4.309 3.425 4.883 0.083 8 0 "[ . 1 . 2]" 1
23 1 2 VAL HA 1 71 THR H . . 5.280 5.236 4.421 5.366 0.086 11 0 "[ . 1 . 2]" 1
24 1 2 VAL HA 1 71 THR HA . . 4.410 3.580 2.168 4.491 0.081 11 0 "[ . 1 . 2]" 1
25 1 2 VAL MG1 1 4 GLY QA . . 4.340 4.208 2.834 4.463 0.123 17 0 "[ . 1 . 2]" 1
26 1 2 VAL MG2 1 3 VAL H . . 3.890 3.255 2.065 4.009 0.119 15 0 "[ . 1 . 2]" 1
27 1 3 VAL H 1 3 VAL HB . . 3.640 3.395 2.774 3.713 0.073 11 0 "[ . 1 . 2]" 1
28 1 3 VAL H 1 3 VAL QG . . 3.530 2.342 1.932 2.774 . 0 0 "[ . 1 . 2]" 1
29 1 3 VAL H 1 4 GLY H . . 3.700 3.143 2.712 3.778 0.078 6 0 "[ . 1 . 2]" 1
30 1 3 VAL H 1 4 GLY QA . . 5.500 4.754 4.434 5.164 . 0 0 "[ . 1 . 2]" 1
31 1 3 VAL H 1 71 THR H . . 5.160 4.985 3.943 5.248 0.088 17 0 "[ . 1 . 2]" 1
32 1 3 VAL H 1 71 THR HB . . 5.500 3.760 2.763 4.626 . 0 0 "[ . 1 . 2]" 1
33 1 3 VAL H 1 71 THR MG . . 5.500 3.997 3.269 4.802 . 0 0 "[ . 1 . 2]" 1
34 1 3 VAL HA 1 4 GLY H . . 2.790 2.649 2.195 2.874 0.084 11 0 "[ . 1 . 2]" 1
35 1 3 VAL HA 1 4 GLY QA . . 4.940 4.122 3.860 4.298 . 0 0 "[ . 1 . 2]" 1
36 1 3 VAL HA 1 5 GLY H . . 4.180 4.108 3.404 4.271 0.091 4 0 "[ . 1 . 2]" 1
37 1 3 VAL HA 1 6 LEU QD . . 5.490 3.202 2.244 4.961 . 0 0 "[ . 1 . 2]" 1
38 1 3 VAL HA 1 71 THR MG . . 5.000 4.792 3.657 5.147 0.147 8 0 "[ . 1 . 2]" 1
39 1 3 VAL HB 1 4 GLY H . . 5.400 4.335 3.755 4.609 . 0 0 "[ . 1 . 2]" 1
40 1 3 VAL HB 1 4 GLY QA . . 4.800 4.854 4.322 4.921 0.121 4 0 "[ . 1 . 2]" 1
41 1 3 VAL HB 1 6 LEU QD . . 4.960 2.992 1.833 4.193 . 0 0 "[ . 1 . 2]" 1
42 1 3 VAL HB 1 6 LEU HG . . 5.500 4.432 2.229 5.583 0.083 19 0 "[ . 1 . 2]" 1
43 1 3 VAL QG 1 4 GLY H . . 4.080 3.678 3.315 3.820 . 0 0 "[ . 1 . 2]" 1
44 1 3 VAL QG 1 4 GLY QA . . 4.040 3.845 3.251 4.014 . 0 0 "[ . 1 . 2]" 1
45 1 3 VAL QG 1 5 GLY H . . 5.190 3.392 2.229 4.188 . 0 0 "[ . 1 . 2]" 1
46 1 3 VAL QG 1 5 GLY QA . . 4.620 4.110 2.349 4.630 0.010 3 0 "[ . 1 . 2]" 1
47 1 3 VAL QG 1 6 LEU H . . 5.340 4.093 2.921 5.271 . 0 0 "[ . 1 . 2]" 1
48 1 3 VAL QG 1 6 LEU HB2 . . 5.500 4.515 4.186 5.054 . 0 0 "[ . 1 . 2]" 1
49 1 3 VAL QG 1 6 LEU HB3 . . 4.980 4.486 3.312 4.984 0.004 11 0 "[ . 1 . 2]" 1
50 1 3 VAL QG 1 6 LEU QD . . 3.410 1.976 1.731 2.608 . 0 0 "[ . 1 . 2]" 1
51 1 3 VAL QG 1 6 LEU HG . . 3.680 2.605 2.154 3.720 0.040 11 0 "[ . 1 . 2]" 1
52 1 3 VAL QG 1 63 ILE MG . . 4.600 3.915 2.066 4.388 . 0 0 "[ . 1 . 2]" 1
53 1 3 VAL QG 1 67 GLN HA . . 4.890 3.870 2.071 4.849 . 0 0 "[ . 1 . 2]" 1
54 1 3 VAL QG 1 67 GLN QE . . 4.910 2.672 1.623 3.897 . 0 0 "[ . 1 . 2]" 1
55 1 3 VAL QG 1 67 GLN HG3 . . 4.340 3.231 2.130 4.259 . 0 0 "[ . 1 . 2]" 1
56 1 3 VAL QG 1 71 THR HB . . 5.070 3.510 1.860 5.046 . 0 0 "[ . 1 . 2]" 1
57 1 3 VAL QG 1 71 THR MG . . 3.530 2.917 2.180 3.596 0.066 16 0 "[ . 1 . 2]" 1
58 1 4 GLY H 1 5 GLY H . . 3.640 3.552 2.581 3.736 0.096 5 0 "[ . 1 . 2]" 1
59 1 4 GLY QA 1 6 LEU QD . . 4.310 4.041 3.329 4.323 0.013 18 0 "[ . 1 . 2]" 1
60 1 5 GLY H 1 5 GLY QA . . 2.650 2.430 2.194 2.540 . 0 0 "[ . 1 . 2]" 1
61 1 5 GLY H 1 6 LEU HG . . 5.500 3.723 2.758 5.517 0.017 11 0 "[ . 1 . 2]" 1
62 1 5 GLY QA 1 6 LEU H . . 2.930 2.273 2.033 3.010 0.080 12 0 "[ . 1 . 2]" 1
63 1 5 GLY QA 1 6 LEU HB2 . . 5.290 5.232 4.580 5.400 0.110 12 0 "[ . 1 . 2]" 1
64 1 5 GLY QA 1 6 LEU QD . . 3.990 3.060 2.250 3.947 . 0 0 "[ . 1 . 2]" 1
65 1 5 GLY QA 1 6 LEU HG . . 4.760 4.150 3.315 4.850 0.090 11 0 "[ . 1 . 2]" 1
66 1 6 LEU H 1 6 LEU HB3 . . 3.340 3.116 2.699 3.739 0.399 11 0 "[ . 1 . 2]" 1
67 1 6 LEU H 1 6 LEU QD . . 4.900 2.265 1.604 3.633 . 0 0 "[ . 1 . 2]" 1
68 1 6 LEU H 1 6 LEU HG . . 4.180 2.937 1.855 4.090 . 0 0 "[ . 1 . 2]" 1
69 1 6 LEU H 1 9 TYR H . . 5.390 5.434 5.003 5.484 0.094 6 0 "[ . 1 . 2]" 1
70 1 6 LEU HA 1 6 LEU QD . . 3.360 3.075 2.119 3.286 . 0 0 "[ . 1 . 2]" 1
71 1 6 LEU HA 1 7 GLY H . . 3.080 2.234 2.078 2.369 . 0 0 "[ . 1 . 2]" 1
72 1 6 LEU HA 1 7 GLY HA2 . . 5.380 4.485 4.280 4.603 . 0 0 "[ . 1 . 2]" 1
73 1 6 LEU HA 1 7 GLY HA3 . . 5.410 4.432 4.288 4.553 . 0 0 "[ . 1 . 2]" 1
74 1 6 LEU HA 1 8 GLY H . . 4.920 4.476 4.141 4.732 . 0 0 "[ . 1 . 2]" 1
75 1 6 LEU HA 1 9 TYR H . . 5.290 3.796 3.402 4.361 . 0 0 "[ . 1 . 2]" 1
76 1 6 LEU HA 1 9 TYR HB2 . . 5.060 3.539 2.915 3.974 . 0 0 "[ . 1 . 2]" 1
77 1 6 LEU HA 1 9 TYR HB3 . . 5.360 4.617 4.091 5.295 . 0 0 "[ . 1 . 2]" 1
78 1 6 LEU HA 1 9 TYR QD . . 3.410 3.115 2.856 3.469 0.059 12 0 "[ . 1 . 2]" 1
79 1 6 LEU HA 1 9 TYR QE . . 4.470 3.378 3.072 4.189 . 0 0 "[ . 1 . 2]" 1
80 1 6 LEU HA 1 43 TYR HB2 . . 4.940 4.954 4.346 5.029 0.089 15 0 "[ . 1 . 2]" 1
81 1 6 LEU HA 1 43 TYR HB3 . . 5.000 4.922 4.403 5.085 0.085 15 0 "[ . 1 . 2]" 1
82 1 6 LEU HB2 1 7 GLY H . . 4.250 3.928 3.572 4.286 0.036 8 0 "[ . 1 . 2]" 1
83 1 6 LEU HB2 1 7 GLY HA2 . . 5.500 5.019 4.767 5.532 0.032 6 0 "[ . 1 . 2]" 1
84 1 6 LEU HB2 1 8 GLY H . . 5.500 3.605 3.040 4.342 . 0 0 "[ . 1 . 2]" 1
85 1 6 LEU HB2 1 9 TYR H . . 4.980 2.502 2.020 3.090 . 0 0 "[ . 1 . 2]" 1
86 1 6 LEU HB2 1 9 TYR HA . . 5.430 4.688 4.264 5.604 0.174 11 0 "[ . 1 . 2]" 1
87 1 6 LEU HB2 1 9 TYR HB2 . . 4.150 2.304 2.084 3.392 . 0 0 "[ . 1 . 2]" 1
88 1 6 LEU HB2 1 9 TYR HB3 . . 5.320 3.972 3.649 5.098 . 0 0 "[ . 1 . 2]" 1
89 1 6 LEU HB3 1 7 GLY H . . 4.660 4.107 3.012 4.496 . 0 0 "[ . 1 . 2]" 1
90 1 6 LEU HB3 1 8 GLY H . . 5.500 5.051 3.895 5.583 0.083 6 0 "[ . 1 . 2]" 1
91 1 6 LEU HB3 1 9 TYR H . . 5.280 3.722 2.847 4.552 . 0 0 "[ . 1 . 2]" 1
92 1 6 LEU HB3 1 9 TYR HB2 . . 4.650 2.434 2.009 3.416 . 0 0 "[ . 1 . 2]" 1
93 1 6 LEU HB3 1 9 TYR QD . . 5.410 2.837 2.468 3.395 . 0 0 "[ . 1 . 2]" 1
94 1 6 LEU HB3 1 43 TYR HB2 . . 5.290 3.452 3.211 3.865 . 0 0 "[ . 1 . 2]" 1
95 1 6 LEU HB3 1 43 TYR HB3 . . 5.330 3.216 2.747 4.157 . 0 0 "[ . 1 . 2]" 1
96 1 6 LEU QD 1 7 GLY H . . 5.470 4.416 3.945 4.665 . 0 0 "[ . 1 . 2]" 1
97 1 6 LEU QD 1 9 TYR HB2 . . 4.420 2.972 2.388 3.747 . 0 0 "[ . 1 . 2]" 1
98 1 6 LEU QD 1 9 TYR HB3 . . 5.500 4.102 3.570 4.546 . 0 0 "[ . 1 . 2]" 1
99 1 6 LEU QD 1 9 TYR QD . . 4.210 3.621 3.219 3.924 . 0 0 "[ . 1 . 2]" 1
100 1 6 LEU QD 1 43 TYR HB3 . . 4.580 2.963 2.318 3.540 . 0 0 "[ . 1 . 2]" 1
101 1 6 LEU QD 1 43 TYR QD . . 4.900 3.016 2.424 3.460 . 0 0 "[ . 1 . 2]" 1
102 1 6 LEU QD 1 67 GLN QE . . 5.500 3.191 1.729 4.271 . 0 0 "[ . 1 . 2]" 1
103 1 6 LEU QD 1 67 GLN HG2 . . 5.410 3.313 2.464 4.220 . 0 0 "[ . 1 . 2]" 1
104 1 6 LEU QD 1 67 GLN HG3 . . 5.470 3.060 2.191 3.854 . 0 0 "[ . 1 . 2]" 1
105 1 6 LEU HG 1 7 GLY H . . 5.500 5.182 4.896 5.555 0.055 12 0 "[ . 1 . 2]" 1
106 1 6 LEU HG 1 8 GLY H . . 5.500 4.974 4.150 5.587 0.087 6 0 "[ . 1 . 2]" 1
107 1 7 GLY H 1 7 GLY HA2 . . 2.900 2.874 2.751 2.933 0.033 10 0 "[ . 1 . 2]" 1
108 1 7 GLY H 1 9 TYR H . . 5.500 3.830 3.239 4.203 . 0 0 "[ . 1 . 2]" 1
109 1 7 GLY H 1 9 TYR HA . . 5.500 5.387 4.793 5.577 0.077 6 0 "[ . 1 . 2]" 1
110 1 7 GLY H 1 9 TYR QD . . 3.660 2.979 2.479 3.373 . 0 0 "[ . 1 . 2]" 1
111 1 7 GLY H 1 9 TYR QE . . 4.390 2.634 2.133 3.301 . 0 0 "[ . 1 . 2]" 1
112 1 7 GLY HA2 1 8 GLY H . . 3.460 2.608 2.439 3.021 . 0 0 "[ . 1 . 2]" 1
113 1 7 GLY HA2 1 45 ARG QD . . 4.930 4.718 4.052 4.878 . 0 0 "[ . 1 . 2]" 1
114 1 7 GLY HA3 1 9 TYR H . . 4.860 4.620 3.987 4.937 0.077 1 0 "[ . 1 . 2]" 1
115 1 7 GLY HA3 1 9 TYR QD . . 4.170 3.726 3.085 4.245 0.075 3 0 "[ . 1 . 2]" 1
116 1 7 GLY HA3 1 9 TYR QE . . 4.750 3.272 2.494 4.157 . 0 0 "[ . 1 . 2]" 1
117 1 7 GLY HA3 1 45 ARG QD . . 5.240 3.556 2.534 4.169 . 0 0 "[ . 1 . 2]" 1
118 1 8 GLY H 1 8 GLY HA3 . . 2.860 2.909 2.844 2.943 0.083 3 0 "[ . 1 . 2]" 1
119 1 8 GLY H 1 9 TYR H . . 3.380 2.481 2.147 2.785 . 0 0 "[ . 1 . 2]" 1
120 1 8 GLY H 1 9 TYR HA . . 5.500 5.071 4.748 5.302 . 0 0 "[ . 1 . 2]" 1
121 1 8 GLY H 1 9 TYR QD . . 4.340 3.933 3.093 4.373 0.033 18 0 "[ . 1 . 2]" 1
122 1 8 GLY H 1 45 ARG QD . . 5.500 4.747 3.883 5.388 . 0 0 "[ . 1 . 2]" 1
123 1 8 GLY HA2 1 9 TYR HA . . 5.370 4.726 4.559 4.839 . 0 0 "[ . 1 . 2]" 1
124 1 8 GLY HA2 1 9 TYR HB2 . . 5.500 5.240 4.783 5.560 0.060 3 0 "[ . 1 . 2]" 1
125 1 8 GLY HA2 1 9 TYR QD . . 5.140 4.683 4.305 4.945 . 0 0 "[ . 1 . 2]" 1
126 1 8 GLY HA3 1 9 TYR H . . 3.580 3.565 3.472 3.645 0.065 19 0 "[ . 1 . 2]" 1
127 1 8 GLY HA3 1 9 TYR HA . . 5.120 4.650 4.426 4.787 . 0 0 "[ . 1 . 2]" 1
128 1 8 GLY HA3 1 45 ARG QD . . 4.760 3.972 2.614 4.699 . 0 0 "[ . 1 . 2]" 1
129 1 8 GLY HA3 1 45 ARG HE . . 5.390 4.451 3.130 5.466 0.076 3 0 "[ . 1 . 2]" 1
130 1 9 TYR H 1 9 TYR HB2 . . 3.290 2.478 2.135 2.714 . 0 0 "[ . 1 . 2]" 1
131 1 9 TYR H 1 9 TYR HB3 . . 4.040 3.597 3.394 3.762 . 0 0 "[ . 1 . 2]" 1
132 1 9 TYR H 1 9 TYR QD . . 2.970 2.604 2.229 2.915 . 0 0 "[ . 1 . 2]" 1
133 1 9 TYR H 1 9 TYR QE . . 5.140 4.630 4.339 4.869 . 0 0 "[ . 1 . 2]" 1
134 1 9 TYR H 1 10 MET H . . 4.840 4.560 4.467 4.647 . 0 0 "[ . 1 . 2]" 1
135 1 9 TYR H 1 45 ARG HA . . 5.500 5.551 5.403 5.584 0.084 16 0 "[ . 1 . 2]" 1
136 1 9 TYR H 1 45 ARG HG2 . . 5.500 4.600 3.997 5.555 0.055 11 0 "[ . 1 . 2]" 1
137 1 9 TYR H 1 63 ILE MG . . 5.500 5.469 5.231 5.589 0.089 11 0 "[ . 1 . 2]" 1
138 1 9 TYR HA 1 9 TYR QD . . 3.170 2.579 2.244 2.760 . 0 0 "[ . 1 . 2]" 1
139 1 9 TYR HA 1 9 TYR QE . . 4.630 4.651 4.467 4.731 0.101 7 0 "[ . 1 . 2]" 1
140 1 9 TYR HA 1 10 MET H . . 3.170 2.475 2.231 2.724 . 0 0 "[ . 1 . 2]" 1
141 1 9 TYR HA 1 10 MET QB . . 5.500 3.727 3.274 4.235 . 0 0 "[ . 1 . 2]" 1
142 1 9 TYR HA 1 10 MET HG2 . . 5.360 4.587 3.878 5.057 . 0 0 "[ . 1 . 2]" 1
143 1 9 TYR HA 1 45 ARG HA . . 4.220 2.817 2.642 3.008 . 0 0 "[ . 1 . 2]" 1
144 1 9 TYR HA 1 45 ARG HB2 . . 5.490 4.631 3.914 5.079 . 0 0 "[ . 1 . 2]" 1
145 1 9 TYR HA 1 45 ARG HG2 . . 4.540 2.778 2.182 3.953 . 0 0 "[ . 1 . 2]" 1
146 1 9 TYR HA 1 45 ARG HG3 . . 4.450 3.481 2.131 4.386 . 0 0 "[ . 1 . 2]" 1
147 1 9 TYR HA 1 46 PRO QD . . 5.220 4.183 3.813 4.518 . 0 0 "[ . 1 . 2]" 1
148 1 9 TYR HB2 1 10 MET H . . 4.460 3.455 3.200 3.856 . 0 0 "[ . 1 . 2]" 1
149 1 9 TYR HB2 1 43 TYR HB2 . . 5.230 3.575 3.247 3.947 . 0 0 "[ . 1 . 2]" 1
150 1 9 TYR HB2 1 43 TYR HB3 . . 3.630 2.366 2.119 2.638 . 0 0 "[ . 1 . 2]" 1
151 1 9 TYR HB2 1 63 ILE QG . . 5.500 5.528 5.077 5.590 0.090 11 0 "[ . 1 . 2]" 1
152 1 9 TYR HB2 1 63 ILE MG . . 5.500 4.099 3.768 4.409 . 0 0 "[ . 1 . 2]" 1
153 1 9 TYR HB3 1 10 MET H . . 3.970 2.276 2.028 2.717 . 0 0 "[ . 1 . 2]" 1
154 1 9 TYR HB3 1 63 ILE MG . . 5.490 4.672 4.175 5.088 . 0 0 "[ . 1 . 2]" 1
155 1 9 TYR QD 1 10 MET H . . 4.720 4.254 4.123 4.494 . 0 0 "[ . 1 . 2]" 1
156 1 9 TYR QD 1 43 TYR HA . . 4.480 4.198 3.957 4.531 0.051 18 0 "[ . 1 . 2]" 1
157 1 9 TYR QD 1 43 TYR HB2 . . 3.370 2.313 2.057 2.542 . 0 0 "[ . 1 . 2]" 1
158 1 9 TYR QD 1 44 TYR H . . 4.590 4.247 3.861 4.640 0.050 6 0 "[ . 1 . 2]" 1
159 1 9 TYR QD 1 45 ARG HA . . 4.160 4.189 3.836 4.265 0.105 8 0 "[ . 1 . 2]" 1
160 1 9 TYR QD 1 45 ARG QD . . 2.760 2.351 1.993 2.702 . 0 0 "[ . 1 . 2]" 1
161 1 9 TYR QD 1 45 ARG HG2 . . 3.970 2.732 2.072 3.802 . 0 0 "[ . 1 . 2]" 1
162 1 9 TYR QD 1 45 ARG HG3 . . 3.670 2.653 2.031 3.506 . 0 0 "[ . 1 . 2]" 1
163 1 9 TYR QD 1 63 ILE HB . . 3.850 3.499 3.246 3.786 . 0 0 "[ . 1 . 2]" 1
164 1 9 TYR QD 1 63 ILE MD . . 5.170 4.990 4.446 5.247 0.077 1 0 "[ . 1 . 2]" 1
165 1 9 TYR QD 1 63 ILE QG . . 5.500 3.718 3.302 3.955 . 0 0 "[ . 1 . 2]" 1
166 1 9 TYR QD 1 63 ILE MG . . 3.320 2.763 2.214 3.127 . 0 0 "[ . 1 . 2]" 1
167 1 9 TYR QE 1 43 TYR HB2 . . 4.420 4.231 3.925 4.499 0.079 6 0 "[ . 1 . 2]" 1
168 1 9 TYR QE 1 45 ARG HA . . 5.500 5.453 5.228 5.583 0.083 7 0 "[ . 1 . 2]" 1
169 1 9 TYR QE 1 45 ARG HB2 . . 5.210 4.249 3.209 5.247 0.037 5 0 "[ . 1 . 2]" 1
170 1 9 TYR QE 1 45 ARG QD . . 3.170 2.626 2.173 3.200 0.030 19 0 "[ . 1 . 2]" 1
171 1 9 TYR QE 1 45 ARG HG3 . . 3.630 2.903 2.306 3.713 0.083 16 0 "[ . 1 . 2]" 1
172 1 9 TYR QE 1 59 ASP QB . . 5.060 3.668 2.825 4.229 . 0 0 "[ . 1 . 2]" 1
173 1 9 TYR QE 1 60 CYS HA . . 4.500 2.540 2.071 3.463 . 0 0 "[ . 1 . 2]" 1
174 1 9 TYR QE 1 60 CYS HB2 . . 5.050 4.249 3.755 5.092 0.042 11 0 "[ . 1 . 2]" 1
175 1 9 TYR QE 1 63 ILE H . . 4.790 4.207 3.906 4.690 . 0 0 "[ . 1 . 2]" 1
176 1 9 TYR QE 1 63 ILE HA . . 5.450 5.237 4.995 5.513 0.063 20 0 "[ . 1 . 2]" 1
177 1 9 TYR QE 1 63 ILE HB . . 3.570 2.563 2.210 2.932 . 0 0 "[ . 1 . 2]" 1
178 1 9 TYR QE 1 63 ILE MD . . 4.970 4.034 3.724 4.230 . 0 0 "[ . 1 . 2]" 1
179 1 9 TYR QE 1 63 ILE QG . . 3.430 2.383 2.010 2.592 . 0 0 "[ . 1 . 2]" 1
180 1 9 TYR QE 1 63 ILE MG . . 3.330 3.040 2.525 3.398 0.068 10 0 "[ . 1 . 2]" 1
181 1 10 MET H 1 10 MET QB . . 3.830 2.566 2.074 3.057 . 0 0 "[ . 1 . 2]" 1
182 1 10 MET H 1 10 MET ME . . 4.870 4.589 4.331 4.742 . 0 0 "[ . 1 . 2]" 1
183 1 10 MET H 1 10 MET HG2 . . 4.130 3.629 2.430 4.204 0.074 20 0 "[ . 1 . 2]" 1
184 1 10 MET H 1 11 LEU H . . 5.430 4.399 4.307 4.470 . 0 0 "[ . 1 . 2]" 1
185 1 10 MET H 1 43 TYR HA . . 5.160 3.579 3.256 4.092 . 0 0 "[ . 1 . 2]" 1
186 1 10 MET H 1 43 TYR QD . . 4.750 4.519 4.153 4.845 0.095 13 0 "[ . 1 . 2]" 1
187 1 10 MET H 1 44 TYR H . . 3.860 2.391 2.178 2.795 . 0 0 "[ . 1 . 2]" 1
188 1 10 MET H 1 44 TYR QD . . 4.810 4.074 3.851 4.250 . 0 0 "[ . 1 . 2]" 1
189 1 10 MET H 1 45 ARG HA . . 4.700 3.738 3.378 3.934 . 0 0 "[ . 1 . 2]" 1
190 1 10 MET HA 1 10 MET HG3 . . 3.930 3.641 3.507 3.765 . 0 0 "[ . 1 . 2]" 1
191 1 10 MET HA 1 11 LEU H . . 2.980 2.372 2.252 2.516 . 0 0 "[ . 1 . 2]" 1
192 1 10 MET HA 1 43 TYR QD . . 5.160 4.266 3.283 4.728 . 0 0 "[ . 1 . 2]" 1
193 1 10 MET QB 1 10 MET ME . . 4.390 2.188 2.099 2.329 . 0 0 "[ . 1 . 2]" 1
194 1 10 MET QB 1 11 LEU H . . 4.060 3.126 2.293 3.631 . 0 0 "[ . 1 . 2]" 1
195 1 10 MET QB 1 44 TYR H . . 5.130 3.869 3.374 4.667 . 0 0 "[ . 1 . 2]" 1
196 1 10 MET QB 1 44 TYR QE . . 4.420 3.413 2.607 4.283 . 0 0 "[ . 1 . 2]" 1
197 1 10 MET QB 1 45 ARG HA . . 5.500 3.863 3.097 5.194 . 0 0 "[ . 1 . 2]" 1
198 1 10 MET ME 1 10 MET HG2 . . 3.880 3.408 2.848 3.513 . 0 0 "[ . 1 . 2]" 1
199 1 10 MET ME 1 11 LEU H . . 5.500 2.782 1.983 3.864 . 0 0 "[ . 1 . 2]" 1
200 1 10 MET ME 1 11 LEU HA . . 5.290 3.909 3.655 4.249 . 0 0 "[ . 1 . 2]" 1
201 1 10 MET ME 1 11 LEU MD2 . . 5.500 5.321 5.000 5.441 . 0 0 "[ . 1 . 2]" 1
202 1 10 MET ME 1 11 LEU HG . . 4.980 5.057 4.881 5.086 0.106 16 0 "[ . 1 . 2]" 1
203 1 10 MET ME 1 12 GLY HA3 . . 5.500 4.136 3.269 4.690 . 0 0 "[ . 1 . 2]" 1
204 1 10 MET ME 1 13 SER QB . . 4.570 4.144 4.006 4.425 . 0 0 "[ . 1 . 2]" 1
205 1 10 MET ME 1 44 TYR QE . . 3.970 2.564 2.033 3.680 . 0 0 "[ . 1 . 2]" 1
206 1 10 MET HG2 1 11 LEU H . . 5.500 4.495 3.915 5.056 . 0 0 "[ . 1 . 2]" 1
207 1 10 MET HG2 1 45 ARG HA . . 5.230 4.683 3.396 5.296 0.066 5 0 "[ . 1 . 2]" 1
208 1 10 MET HG3 1 45 ARG HA . . 5.050 4.956 4.449 5.136 0.086 12 0 "[ . 1 . 2]" 1
209 1 11 LEU H 1 11 LEU HB2 . . 3.170 2.684 2.391 2.887 . 0 0 "[ . 1 . 2]" 1
210 1 11 LEU H 1 11 LEU HB3 . . 3.490 2.697 2.601 2.781 . 0 0 "[ . 1 . 2]" 1
211 1 11 LEU H 1 11 LEU MD1 . . 5.100 4.063 3.823 4.179 . 0 0 "[ . 1 . 2]" 1
212 1 11 LEU H 1 11 LEU MD2 . . 5.060 4.469 4.293 4.602 . 0 0 "[ . 1 . 2]" 1
213 1 11 LEU H 1 11 LEU HG . . 5.020 4.535 4.458 4.620 . 0 0 "[ . 1 . 2]" 1
214 1 11 LEU H 1 12 GLY H . . 5.350 4.409 4.255 4.619 . 0 0 "[ . 1 . 2]" 1
215 1 11 LEU H 1 43 TYR HA . . 5.500 4.602 4.333 4.889 . 0 0 "[ . 1 . 2]" 1
216 1 11 LEU H 1 43 TYR QD . . 4.390 3.943 3.042 4.465 0.075 20 0 "[ . 1 . 2]" 1
217 1 11 LEU H 1 43 TYR QE . . 5.500 4.951 3.759 5.543 0.043 1 0 "[ . 1 . 2]" 1
218 1 11 LEU H 1 44 TYR QE . . 5.400 4.678 4.232 5.242 . 0 0 "[ . 1 . 2]" 1
219 1 11 LEU HA 1 11 LEU MD1 . . 3.590 2.054 2.011 2.133 . 0 0 "[ . 1 . 2]" 1
220 1 11 LEU HA 1 11 LEU MD2 . . 4.580 3.812 3.786 3.855 . 0 0 "[ . 1 . 2]" 1
221 1 11 LEU HA 1 12 GLY H . . 3.370 2.159 2.072 2.265 . 0 0 "[ . 1 . 2]" 1
222 1 11 LEU HA 1 12 GLY HA3 . . 5.500 4.391 4.303 4.499 . 0 0 "[ . 1 . 2]" 1
223 1 11 LEU HA 1 42 VAL H . . 5.040 4.127 3.968 4.332 . 0 0 "[ . 1 . 2]" 1
224 1 11 LEU HA 1 43 TYR HA . . 3.730 2.793 2.456 3.088 . 0 0 "[ . 1 . 2]" 1
225 1 11 LEU HA 1 43 TYR HB3 . . 5.400 4.824 4.297 5.163 . 0 0 "[ . 1 . 2]" 1
226 1 11 LEU HA 1 43 TYR QD . . 3.890 3.304 2.851 3.665 . 0 0 "[ . 1 . 2]" 1
227 1 11 LEU HA 1 44 TYR H . . 4.350 3.821 3.444 4.058 . 0 0 "[ . 1 . 2]" 1
228 1 11 LEU HA 1 44 TYR QD . . 3.960 3.565 3.208 3.991 0.031 11 0 "[ . 1 . 2]" 1
229 1 11 LEU HB2 1 11 LEU MD2 . . 3.570 2.422 2.282 2.528 . 0 0 "[ . 1 . 2]" 1
230 1 11 LEU HB2 1 12 GLY H . . 5.450 4.450 4.317 4.599 . 0 0 "[ . 1 . 2]" 1
231 1 11 LEU HB2 1 13 SER HA . . 5.290 5.415 5.339 6.199 0.909 16 1 "[ . 1 .+ 2]" 1
232 1 11 LEU HB2 1 43 TYR HA . . 5.300 4.290 4.084 4.517 . 0 0 "[ . 1 . 2]" 1
233 1 11 LEU HB2 1 43 TYR QE . . 3.760 2.698 2.144 3.035 . 0 0 "[ . 1 . 2]" 1
234 1 11 LEU HB3 1 11 LEU MD2 . . 3.450 2.382 2.342 2.444 . 0 0 "[ . 1 . 2]" 1
235 1 11 LEU HB3 1 12 GLY H . . 5.400 4.190 3.801 4.291 . 0 0 "[ . 1 . 2]" 1
236 1 11 LEU HB3 1 43 TYR HA . . 5.500 5.468 5.219 5.569 0.069 11 0 "[ . 1 . 2]" 1
237 1 11 LEU HB3 1 43 TYR QD . . 4.450 4.476 4.256 4.536 0.086 10 0 "[ . 1 . 2]" 1
238 1 11 LEU HB3 1 43 TYR QE . . 5.080 4.254 3.820 4.520 . 0 0 "[ . 1 . 2]" 1
239 1 11 LEU MD1 1 12 GLY H . . 4.100 3.007 2.701 3.275 . 0 0 "[ . 1 . 2]" 1
240 1 11 LEU MD1 1 12 GLY HA3 . . 5.500 4.740 4.401 5.011 . 0 0 "[ . 1 . 2]" 1
241 1 11 LEU MD1 1 41 GLN H . . 5.500 4.700 4.275 4.861 . 0 0 "[ . 1 . 2]" 1
242 1 11 LEU MD1 1 41 GLN HA . . 5.490 3.624 3.117 3.921 . 0 0 "[ . 1 . 2]" 1
243 1 11 LEU MD1 1 41 GLN HB2 . . 4.600 3.372 2.310 3.630 . 0 0 "[ . 1 . 2]" 1
244 1 11 LEU MD1 1 41 GLN HB3 . . 4.810 2.034 1.915 2.132 . 0 0 "[ . 1 . 2]" 1
245 1 11 LEU MD1 1 41 GLN HE21 . . 4.870 4.183 3.084 4.968 0.098 18 0 "[ . 1 . 2]" 1
246 1 11 LEU MD1 1 41 GLN HE22 . . 5.440 4.705 4.423 5.161 . 0 0 "[ . 1 . 2]" 1
247 1 11 LEU MD1 1 42 VAL H . . 5.220 2.274 1.901 2.553 . 0 0 "[ . 1 . 2]" 1
248 1 11 LEU MD1 1 43 TYR H . . 5.500 3.671 3.411 3.869 . 0 0 "[ . 1 . 2]" 1
249 1 11 LEU MD1 1 43 TYR HA . . 4.790 2.848 2.496 3.091 . 0 0 "[ . 1 . 2]" 1
250 1 11 LEU MD1 1 43 TYR QD . . 4.160 2.519 2.205 2.776 . 0 0 "[ . 1 . 2]" 1
251 1 11 LEU MD1 1 43 TYR QE . . 3.270 2.586 2.395 2.846 . 0 0 "[ . 1 . 2]" 1
252 1 11 LEU MD1 1 44 TYR H . . 5.500 4.537 4.233 4.779 . 0 0 "[ . 1 . 2]" 1
253 1 11 LEU MD1 1 44 TYR QD . . 5.110 4.444 4.056 4.912 . 0 0 "[ . 1 . 2]" 1
254 1 11 LEU MD2 1 12 GLY H . . 5.470 4.605 4.089 4.904 . 0 0 "[ . 1 . 2]" 1
255 1 11 LEU MD2 1 41 GLN HB3 . . 5.170 2.643 2.395 2.995 . 0 0 "[ . 1 . 2]" 1
256 1 11 LEU MD2 1 41 GLN HE21 . . 5.500 4.784 4.078 5.537 0.037 10 0 "[ . 1 . 2]" 1
257 1 11 LEU MD2 1 41 GLN HG3 . . 5.500 2.441 2.190 2.979 . 0 0 "[ . 1 . 2]" 1
258 1 11 LEU MD2 1 42 VAL H . . 5.500 4.495 4.136 4.969 . 0 0 "[ . 1 . 2]" 1
259 1 11 LEU MD2 1 42 VAL HA . . 5.380 5.486 5.459 5.499 0.119 8 0 "[ . 1 . 2]" 1
260 1 11 LEU MD2 1 43 TYR QD . . 4.360 4.079 3.741 4.453 0.093 16 0 "[ . 1 . 2]" 1
261 1 11 LEU MD2 1 43 TYR QE . . 3.410 2.674 2.309 3.257 . 0 0 "[ . 1 . 2]" 1
262 1 11 LEU HG 1 12 GLY H . . 5.500 3.118 2.398 3.533 . 0 0 "[ . 1 . 2]" 1
263 1 11 LEU HG 1 12 GLY HA2 . . 5.500 4.897 4.660 5.330 . 0 0 "[ . 1 . 2]" 1
264 1 11 LEU HG 1 12 GLY HA3 . . 4.960 4.632 4.021 5.005 0.045 3 0 "[ . 1 . 2]" 1
265 1 11 LEU HG 1 41 GLN HB2 . . 5.130 4.452 3.560 5.024 . 0 0 "[ . 1 . 2]" 1
266 1 11 LEU HG 1 41 GLN HB3 . . 5.500 3.275 2.578 3.930 . 0 0 "[ . 1 . 2]" 1
267 1 11 LEU HG 1 41 GLN HE21 . . 4.780 4.164 3.286 4.840 0.060 12 0 "[ . 1 . 2]" 1
268 1 11 LEU HG 1 41 GLN HE22 . . 4.630 4.665 4.365 4.863 0.233 9 0 "[ . 1 . 2]" 1
269 1 11 LEU HG 1 43 TYR QE . . 4.650 4.710 4.574 4.748 0.098 16 0 "[ . 1 . 2]" 1
270 1 12 GLY H 1 13 SER H . . 4.830 2.704 2.495 3.101 . 0 0 "[ . 1 . 2]" 1
271 1 12 GLY H 1 13 SER HA . . 5.120 4.827 4.683 4.994 . 0 0 "[ . 1 . 2]" 1
272 1 12 GLY H 1 15 MET ME . . 5.500 5.152 4.739 5.573 0.073 16 0 "[ . 1 . 2]" 1
273 1 12 GLY H 1 41 GLN HE21 . . 5.500 4.490 3.247 5.696 0.196 3 0 "[ . 1 . 2]" 1
274 1 12 GLY H 1 41 GLN HG3 . . 5.500 4.634 3.880 5.442 . 0 0 "[ . 1 . 2]" 1
275 1 12 GLY H 1 42 VAL H . . 4.750 3.498 3.007 3.938 . 0 0 "[ . 1 . 2]" 1
276 1 12 GLY H 1 42 VAL QG . . 5.500 3.555 3.130 4.031 . 0 0 "[ . 1 . 2]" 1
277 1 12 GLY H 1 43 TYR HA . . 4.700 4.149 3.658 4.641 . 0 0 "[ . 1 . 2]" 1
278 1 12 GLY H 1 44 TYR QD . . 4.030 2.995 2.452 3.570 . 0 0 "[ . 1 . 2]" 1
279 1 12 GLY H 1 44 TYR QE . . 3.450 2.756 1.828 3.521 0.071 18 0 "[ . 1 . 2]" 1
280 1 12 GLY HA2 1 44 TYR QE . . 3.180 2.369 2.029 3.195 0.015 11 0 "[ . 1 . 2]" 1
281 1 12 GLY HA2 1 98 GLN QE . . 5.400 3.969 3.363 4.680 . 0 0 "[ . 1 . 2]" 1
282 1 12 GLY HA3 1 13 SER H . . 3.580 3.068 2.228 3.240 . 0 0 "[ . 1 . 2]" 1
283 1 12 GLY HA3 1 42 VAL H . . 5.120 4.674 4.139 5.184 0.064 1 0 "[ . 1 . 2]" 1
284 1 12 GLY HA3 1 42 VAL QG . . 5.490 4.004 3.201 4.735 . 0 0 "[ . 1 . 2]" 1
285 1 12 GLY HA3 1 44 TYR QD . . 4.990 3.950 3.273 4.552 . 0 0 "[ . 1 . 2]" 1
286 1 12 GLY HA3 1 44 TYR QE . . 3.300 2.839 2.316 3.230 . 0 0 "[ . 1 . 2]" 1
287 1 12 GLY HA3 1 98 GLN QE . . 5.250 3.886 2.894 4.406 . 0 0 "[ . 1 . 2]" 1
288 1 13 SER H 1 13 SER QB . . 3.470 2.936 2.734 3.122 . 0 0 "[ . 1 . 2]" 1
289 1 13 SER H 1 14 ALA H . . 4.990 4.241 3.521 4.550 . 0 0 "[ . 1 . 2]" 1
290 1 13 SER H 1 15 MET ME . . 5.500 5.505 5.159 5.601 0.101 20 0 "[ . 1 . 2]" 1
291 1 13 SER H 1 41 GLN HG2 . . 5.500 4.243 3.778 5.163 . 0 0 "[ . 1 . 2]" 1
292 1 13 SER H 1 42 VAL H . . 5.150 4.364 4.082 4.720 . 0 0 "[ . 1 . 2]" 1
293 1 13 SER H 1 44 TYR QE . . 5.100 4.656 4.256 5.018 . 0 0 "[ . 1 . 2]" 1
294 1 13 SER HA 1 14 ALA H . . 2.720 2.361 1.920 2.672 . 0 0 "[ . 1 . 2]" 1
295 1 13 SER HA 1 14 ALA MB . . 4.430 4.123 3.838 4.318 . 0 0 "[ . 1 . 2]" 1
296 1 13 SER HA 1 41 GLN HE21 . . 4.340 3.926 3.328 4.434 0.094 3 0 "[ . 1 . 2]" 1
297 1 13 SER HA 1 41 GLN HE22 . . 4.790 4.232 3.794 4.594 . 0 0 "[ . 1 . 2]" 1
298 1 13 SER HA 1 41 GLN HG3 . . 5.010 2.809 2.359 3.783 . 0 0 "[ . 1 . 2]" 1
299 1 13 SER QB 1 14 ALA H . . 3.590 3.073 2.544 3.466 . 0 0 "[ . 1 . 2]" 1
300 1 13 SER QB 1 14 ALA MB . . 5.140 4.364 4.075 4.614 . 0 0 "[ . 1 . 2]" 1
301 1 13 SER QB 1 41 GLN HE21 . . 5.500 4.964 4.656 5.668 0.168 3 0 "[ . 1 . 2]" 1
302 1 14 ALA H 1 14 ALA MB . . 2.990 2.230 2.176 2.361 . 0 0 "[ . 1 . 2]" 1
303 1 14 ALA H 1 41 GLN HE21 . . 5.080 4.343 3.821 5.153 0.073 13 0 "[ . 1 . 2]" 1
304 1 14 ALA H 1 41 GLN HE22 . . 5.090 4.659 3.600 5.173 0.083 12 0 "[ . 1 . 2]" 1
305 1 14 ALA HA 1 15 MET H . . 2.900 2.165 2.101 2.247 . 0 0 "[ . 1 . 2]" 1
306 1 14 ALA HA 1 15 MET HA . . 5.100 4.428 4.322 4.488 . 0 0 "[ . 1 . 2]" 1
307 1 14 ALA HA 1 15 MET HG2 . . 5.080 4.330 3.825 4.592 . 0 0 "[ . 1 . 2]" 1
308 1 14 ALA HA 1 15 MET HG3 . . 5.500 4.958 4.332 5.539 0.039 16 0 "[ . 1 . 2]" 1
309 1 14 ALA HA 1 40 ASN H . . 5.450 5.508 5.381 5.546 0.096 8 0 "[ . 1 . 2]" 1
310 1 14 ALA HA 1 40 ASN QB . . 5.140 4.284 3.557 4.806 . 0 0 "[ . 1 . 2]" 1
311 1 14 ALA HA 1 40 ASN HD22 . . 5.500 2.975 1.921 4.396 . 0 0 "[ . 1 . 2]" 1
312 1 14 ALA HA 1 41 GLN HE21 . . 4.260 3.343 2.164 4.502 0.242 20 0 "[ . 1 . 2]" 1
313 1 14 ALA HA 1 41 GLN HE22 . . 4.430 3.720 2.125 4.507 0.077 7 0 "[ . 1 . 2]" 1
314 1 14 ALA HA 1 41 GLN HG2 . . 3.800 2.745 1.968 3.897 0.097 11 0 "[ . 1 . 2]" 1
315 1 14 ALA HA 1 41 GLN HG3 . . 5.380 3.718 2.735 4.656 . 0 0 "[ . 1 . 2]" 1
316 1 14 ALA MB 1 15 MET H . . 3.870 3.304 3.175 3.464 . 0 0 "[ . 1 . 2]" 1
317 1 14 ALA MB 1 15 MET HA . . 5.470 4.306 4.071 4.483 . 0 0 "[ . 1 . 2]" 1
318 1 14 ALA MB 1 15 MET HG2 . . 5.500 5.450 5.047 5.602 0.102 17 0 "[ . 1 . 2]" 1
319 1 14 ALA MB 1 40 ASN H . . 5.500 5.459 4.971 5.614 0.114 16 0 "[ . 1 . 2]" 1
320 1 14 ALA MB 1 40 ASN QB . . 5.500 4.282 3.075 4.898 . 0 0 "[ . 1 . 2]" 1
321 1 14 ALA MB 1 40 ASN HD21 . . 4.390 3.197 2.216 3.898 . 0 0 "[ . 1 . 2]" 1
322 1 14 ALA MB 1 40 ASN HD22 . . 4.070 2.557 1.838 4.492 0.422 19 0 "[ . 1 . 2]" 1
323 1 14 ALA MB 1 41 GLN HE21 . . 5.500 4.697 3.849 5.604 0.104 20 0 "[ . 1 . 2]" 1
324 1 14 ALA MB 1 41 GLN HE22 . . 5.500 5.008 3.817 5.610 0.110 7 0 "[ . 1 . 2]" 1
325 1 14 ALA MB 1 41 GLN HG3 . . 5.010 4.344 3.597 5.105 0.095 16 0 "[ . 1 . 2]" 1
326 1 15 MET H 1 15 MET HB2 . . 3.760 3.813 3.712 3.905 0.145 9 0 "[ . 1 . 2]" 1
327 1 15 MET H 1 15 MET ME . . 5.040 4.790 4.638 4.946 . 0 0 "[ . 1 . 2]" 1
328 1 15 MET H 1 15 MET HG2 . . 4.180 2.795 1.935 3.136 . 0 0 "[ . 1 . 2]" 1
329 1 15 MET H 1 15 MET HG3 . . 4.000 2.945 2.395 3.453 . 0 0 "[ . 1 . 2]" 1
330 1 15 MET H 1 16 SER H . . 4.670 4.274 4.120 4.374 . 0 0 "[ . 1 . 2]" 1
331 1 15 MET H 1 16 SER HA . . 5.500 5.546 5.460 5.579 0.079 13 0 "[ . 1 . 2]" 1
332 1 15 MET H 1 40 ASN QB . . 4.190 3.873 3.444 4.128 . 0 0 "[ . 1 . 2]" 1
333 1 15 MET H 1 40 ASN HD21 . . 5.130 2.783 2.131 4.631 . 0 0 "[ . 1 . 2]" 1
334 1 15 MET H 1 40 ASN HD22 . . 5.500 3.078 2.441 4.439 . 0 0 "[ . 1 . 2]" 1
335 1 15 MET H 1 41 GLN HA . . 4.770 4.520 4.023 4.861 0.091 11 0 "[ . 1 . 2]" 1
336 1 15 MET HA 1 15 MET HG2 . . 4.230 4.000 3.613 4.126 . 0 0 "[ . 1 . 2]" 1
337 1 15 MET HA 1 15 MET HG3 . . 4.190 3.691 3.580 3.905 . 0 0 "[ . 1 . 2]" 1
338 1 15 MET HA 1 16 SER H . . 3.120 2.746 2.494 2.969 . 0 0 "[ . 1 . 2]" 1
339 1 15 MET HA 1 16 SER HA . . 5.110 4.414 4.196 4.630 . 0 0 "[ . 1 . 2]" 1
340 1 15 MET HB2 1 15 MET ME . . 4.370 3.435 2.747 4.095 . 0 0 "[ . 1 . 2]" 1
341 1 15 MET HB2 1 16 SER H . . 3.530 2.043 1.923 2.177 . 0 0 "[ . 1 . 2]" 1
342 1 15 MET HB2 1 16 SER QB . . 5.500 3.802 3.271 4.374 . 0 0 "[ . 1 . 2]" 1
343 1 15 MET HB2 1 97 THR MG . . 5.500 3.907 3.191 4.502 . 0 0 "[ . 1 . 2]" 1
344 1 15 MET HB2 1 101 LYS QD . . 4.990 4.328 3.718 5.066 0.076 6 0 "[ . 1 . 2]" 1
345 1 15 MET HB3 1 16 SER H . . 4.100 3.554 3.455 3.660 . 0 0 "[ . 1 . 2]" 1
346 1 15 MET ME 1 16 SER H . . 5.500 4.350 3.913 4.792 . 0 0 "[ . 1 . 2]" 1
347 1 15 MET ME 1 16 SER QB . . 5.140 4.114 3.229 4.799 . 0 0 "[ . 1 . 2]" 1
348 1 15 MET ME 1 41 GLN HA . . 4.560 4.350 3.954 4.658 0.098 14 0 "[ . 1 . 2]" 1
349 1 15 MET ME 1 42 VAL H . . 5.360 4.601 4.340 4.887 . 0 0 "[ . 1 . 2]" 1
350 1 15 MET ME 1 42 VAL QG . . 3.830 2.940 2.618 3.228 . 0 0 "[ . 1 . 2]" 1
351 1 15 MET ME 1 94 MET H . . 4.530 4.610 4.390 4.651 0.121 18 0 "[ . 1 . 2]" 1
352 1 15 MET ME 1 94 MET HA . . 3.860 2.502 2.187 2.785 . 0 0 "[ . 1 . 2]" 1
353 1 15 MET ME 1 94 MET ME . . 5.500 4.509 4.164 4.935 . 0 0 "[ . 1 . 2]" 1
354 1 15 MET ME 1 94 MET QG . . 4.390 3.403 2.788 3.808 . 0 0 "[ . 1 . 2]" 1
355 1 15 MET ME 1 95 CYS H . . 4.250 4.342 4.243 4.365 0.115 20 0 "[ . 1 . 2]" 1
356 1 15 MET ME 1 95 CYS HA . . 5.500 3.862 3.598 4.228 . 0 0 "[ . 1 . 2]" 1
357 1 15 MET ME 1 97 THR H . . 4.760 3.959 3.747 4.294 . 0 0 "[ . 1 . 2]" 1
358 1 15 MET ME 1 97 THR HA . . 5.100 4.479 4.278 4.621 . 0 0 "[ . 1 . 2]" 1
359 1 15 MET ME 1 97 THR HB . . 3.530 2.584 2.240 3.001 . 0 0 "[ . 1 . 2]" 1
360 1 15 MET ME 1 97 THR MG . . 3.320 2.154 1.974 2.356 . 0 0 "[ . 1 . 2]" 1
361 1 15 MET ME 1 98 GLN H . . 3.560 2.196 2.092 2.320 . 0 0 "[ . 1 . 2]" 1
362 1 15 MET ME 1 98 GLN HA . . 3.820 2.683 2.500 2.900 . 0 0 "[ . 1 . 2]" 1
363 1 15 MET ME 1 98 GLN HB2 . . 2.460 2.039 1.890 2.135 . 0 0 "[ . 1 . 2]" 1
364 1 15 MET ME 1 98 GLN QE . . 5.470 4.100 3.849 4.377 . 0 0 "[ . 1 . 2]" 1
365 1 15 MET ME 1 98 GLN HG2 . . 4.620 3.418 2.495 3.985 . 0 0 "[ . 1 . 2]" 1
366 1 15 MET ME 1 99 TYR H . . 4.190 4.310 4.300 4.317 0.127 16 0 "[ . 1 . 2]" 1
367 1 15 MET ME 1 101 LYS QD . . 4.130 3.295 2.759 4.211 0.081 11 0 "[ . 1 . 2]" 1
368 1 15 MET ME 1 101 LYS QE . . 4.110 3.735 2.398 4.224 0.114 12 0 "[ . 1 . 2]" 1
369 1 15 MET ME 1 101 LYS HG3 . . 5.500 4.013 3.683 4.406 . 0 0 "[ . 1 . 2]" 1
370 1 15 MET HG2 1 16 SER H . . 4.860 4.039 3.808 4.423 . 0 0 "[ . 1 . 2]" 1
371 1 15 MET HG2 1 41 GLN HA . . 5.500 3.830 3.041 4.317 . 0 0 "[ . 1 . 2]" 1
372 1 15 MET HG2 1 94 MET QG . . 5.230 3.646 2.891 5.046 . 0 0 "[ . 1 . 2]" 1
373 1 15 MET HG3 1 16 SER H . . 5.130 2.863 2.498 3.499 . 0 0 "[ . 1 . 2]" 1
374 1 15 MET HG3 1 16 SER HA . . 5.500 4.568 4.354 4.930 . 0 0 "[ . 1 . 2]" 1
375 1 15 MET HG3 1 17 ARG H . . 5.500 5.440 5.116 5.573 0.073 11 0 "[ . 1 . 2]" 1
376 1 15 MET HG3 1 17 ARG HA . . 5.500 5.231 4.611 5.591 0.091 13 0 "[ . 1 . 2]" 1
377 1 15 MET HG3 1 41 GLN HA . . 5.500 4.864 4.156 5.563 0.063 5 0 "[ . 1 . 2]" 1
378 1 15 MET HG3 1 94 MET QG . . 5.500 3.182 2.591 4.186 . 0 0 "[ . 1 . 2]" 1
379 1 15 MET HG3 1 97 THR MG . . 5.500 4.074 3.132 4.683 . 0 0 "[ . 1 . 2]" 1
380 1 16 SER H 1 16 SER QB . . 3.360 2.383 1.965 2.965 . 0 0 "[ . 1 . 2]" 1
381 1 16 SER H 1 17 ARG H . . 4.720 4.387 4.142 4.633 . 0 0 "[ . 1 . 2]" 1
382 1 16 SER H 1 97 THR MG . . 5.500 3.868 3.302 4.297 . 0 0 "[ . 1 . 2]" 1
383 1 16 SER HA 1 17 ARG H . . 2.860 2.095 1.939 2.260 . 0 0 "[ . 1 . 2]" 1
384 1 16 SER HA 1 17 ARG HB3 . . 4.760 4.490 3.940 4.804 0.044 6 0 "[ . 1 . 2]" 1
385 1 16 SER QB 1 17 ARG H . . 3.920 3.481 2.907 3.776 . 0 0 "[ . 1 . 2]" 1
386 1 16 SER QB 1 94 MET HA . . 4.470 4.314 3.797 4.435 . 0 0 "[ . 1 . 2]" 1
387 1 17 ARG H 1 17 ARG HB3 . . 3.590 2.464 2.123 2.754 . 0 0 "[ . 1 . 2]" 1
388 1 17 ARG H 1 17 ARG HD3 . . 4.940 5.063 4.473 5.839 0.899 1 5 "[+ *- 1 * . * 2]" 1
389 1 17 ARG H 1 18 PRO HD2 . . 5.320 5.037 4.907 5.246 . 0 0 "[ . 1 . 2]" 1
390 1 17 ARG HA 1 17 ARG HD3 . . 5.500 3.560 2.199 5.239 . 0 0 "[ . 1 . 2]" 1
391 1 17 ARG HA 1 18 PRO HD2 . . 3.560 2.332 2.178 2.579 . 0 0 "[ . 1 . 2]" 1
392 1 17 ARG HA 1 18 PRO HD3 . . 3.500 2.445 2.324 2.623 . 0 0 "[ . 1 . 2]" 1
393 1 17 ARG HA 1 94 MET QG . . 5.500 4.219 3.628 4.812 . 0 0 "[ . 1 . 2]" 1
394 1 17 ARG HB2 1 17 ARG HD2 . . 4.080 2.986 2.225 3.825 . 0 0 "[ . 1 . 2]" 1
395 1 17 ARG HB2 1 17 ARG HD3 . . 4.200 2.871 2.169 3.688 . 0 0 "[ . 1 . 2]" 1
396 1 17 ARG HB2 1 17 ARG HE . . 5.500 4.325 2.918 4.693 . 0 0 "[ . 1 . 2]" 1
397 1 17 ARG HB2 1 40 ASN QB . . 5.410 4.399 3.341 5.151 . 0 0 "[ . 1 . 2]" 1
398 1 17 ARG HB2 1 40 ASN HD21 . . 5.360 4.982 4.046 5.752 0.392 19 0 "[ . 1 . 2]" 1
399 1 17 ARG HB3 1 17 ARG HE . . 5.500 4.855 4.003 5.263 . 0 0 "[ . 1 . 2]" 1
400 1 17 ARG HD2 1 18 PRO HD2 . . 5.500 3.471 2.072 5.535 0.035 7 0 "[ . 1 . 2]" 1
401 1 17 ARG HD2 1 35 MET ME . . 4.980 4.066 2.511 5.018 0.038 13 0 "[ . 1 . 2]" 1
402 1 17 ARG HD2 1 35 MET QG . . 5.500 5.302 3.385 6.422 0.922 15 4 "[ .- *1 + * 2]" 1
403 1 17 ARG HE 1 35 MET HB2 . . 5.500 4.369 3.394 5.571 0.071 10 0 "[ . 1 . 2]" 1
404 1 17 ARG HE 1 35 MET ME . . 4.500 3.312 2.246 4.604 0.104 3 0 "[ . 1 . 2]" 1
405 1 17 ARG HE 1 35 MET QG . . 4.900 3.838 2.837 4.714 . 0 0 "[ . 1 . 2]" 1
406 1 17 ARG HE 1 36 TYR HA . . 4.780 4.215 2.925 4.821 0.041 19 0 "[ . 1 . 2]" 1
407 1 17 ARG HE 1 40 ASN QB . . 5.500 4.859 3.824 5.390 . 0 0 "[ . 1 . 2]" 1
408 1 17 ARG QG 1 35 MET ME . . 3.280 2.923 2.095 3.407 0.127 11 0 "[ . 1 . 2]" 1
409 1 18 PRO HA 1 19 MET H . . 2.850 2.164 1.997 2.318 . 0 0 "[ . 1 . 2]" 1
410 1 18 PRO HA 1 19 MET HA . . 4.860 4.385 4.164 4.557 . 0 0 "[ . 1 . 2]" 1
411 1 18 PRO HA 1 19 MET QB . . 5.110 4.167 3.776 4.729 . 0 0 "[ . 1 . 2]" 1
412 1 18 PRO HA 1 19 MET QG . . 5.390 4.645 4.235 4.826 . 0 0 "[ . 1 . 2]" 1
413 1 18 PRO HA 1 20 ILE MD . . 5.300 5.369 5.049 5.422 0.122 5 0 "[ . 1 . 2]" 1
414 1 18 PRO HB2 1 19 MET H . . 4.110 3.380 2.818 4.015 . 0 0 "[ . 1 . 2]" 1
415 1 18 PRO HB2 1 20 ILE H . . 5.500 5.010 3.548 5.581 0.081 1 0 "[ . 1 . 2]" 1
416 1 18 PRO HB2 1 20 ILE MD . . 3.940 3.329 2.912 3.606 . 0 0 "[ . 1 . 2]" 1
417 1 18 PRO HB2 1 20 ILE QG . . 5.060 2.983 2.542 3.333 . 0 0 "[ . 1 . 2]" 1
418 1 18 PRO HB2 1 20 ILE MG . . 5.500 5.396 5.029 5.606 0.106 16 0 "[ . 1 . 2]" 1
419 1 18 PRO HB2 1 93 GLN HB3 . . 4.940 4.213 3.384 4.829 . 0 0 "[ . 1 . 2]" 1
420 1 18 PRO HB2 1 93 GLN HE21 . . 5.500 5.159 4.632 5.564 0.064 5 0 "[ . 1 . 2]" 1
421 1 18 PRO HB2 1 93 GLN HG2 . . 4.980 3.286 2.798 3.895 . 0 0 "[ . 1 . 2]" 1
422 1 18 PRO HB2 1 93 GLN HG3 . . 4.760 3.009 2.142 3.883 . 0 0 "[ . 1 . 2]" 1
423 1 18 PRO HB2 1 94 MET QG . . 5.500 4.794 3.983 5.302 . 0 0 "[ . 1 . 2]" 1
424 1 18 PRO HB3 1 19 MET H . . 4.350 3.934 3.526 4.312 . 0 0 "[ . 1 . 2]" 1
425 1 18 PRO HB3 1 20 ILE MD . . 5.100 4.555 3.950 4.957 . 0 0 "[ . 1 . 2]" 1
426 1 18 PRO HB3 1 93 GLN HG2 . . 3.250 3.316 3.132 3.522 0.272 1 0 "[ . 1 . 2]" 1
427 1 18 PRO HB3 1 93 GLN HG3 . . 3.440 2.938 2.043 3.464 0.024 11 0 "[ . 1 . 2]" 1
428 1 18 PRO HB3 1 94 MET ME . . 4.870 4.677 4.100 4.975 0.105 17 0 "[ . 1 . 2]" 1
429 1 18 PRO HD2 1 90 VAL QG . . 4.760 3.731 3.298 4.368 . 0 0 "[ . 1 . 2]" 1
430 1 18 PRO HD2 1 94 MET QG . . 4.910 4.177 3.686 4.456 . 0 0 "[ . 1 . 2]" 1
431 1 18 PRO HD3 1 90 VAL QG . . 5.290 3.910 3.673 4.280 . 0 0 "[ . 1 . 2]" 1
432 1 18 PRO HD3 1 94 MET ME . . 5.040 3.992 3.173 4.329 . 0 0 "[ . 1 . 2]" 1
433 1 18 PRO HD3 1 94 MET QG . . 5.130 2.670 2.303 2.920 . 0 0 "[ . 1 . 2]" 1
434 1 18 PRO QG 1 19 MET H . . 5.200 4.554 4.230 4.790 . 0 0 "[ . 1 . 2]" 1
435 1 18 PRO QG 1 20 ILE QG . . 5.500 4.210 3.753 4.613 . 0 0 "[ . 1 . 2]" 1
436 1 18 PRO QG 1 90 VAL HA . . 4.450 3.250 2.785 3.820 . 0 0 "[ . 1 . 2]" 1
437 1 18 PRO QG 1 90 VAL QG . . 4.200 1.980 1.793 2.447 . 0 0 "[ . 1 . 2]" 1
438 1 18 PRO QG 1 93 GLN HG2 . . 5.500 4.520 3.864 5.179 . 0 0 "[ . 1 . 2]" 1
439 1 18 PRO QG 1 94 MET H . . 5.300 4.170 3.370 4.673 . 0 0 "[ . 1 . 2]" 1
440 1 18 PRO QG 1 94 MET QG . . 4.970 3.210 2.213 3.662 . 0 0 "[ . 1 . 2]" 1
441 1 19 MET H 1 19 MET QB . . 3.320 2.724 2.162 3.308 . 0 0 "[ . 1 . 2]" 1
442 1 19 MET H 1 19 MET ME . . 4.780 4.590 4.246 4.867 0.087 7 0 "[ . 1 . 2]" 1
443 1 19 MET H 1 19 MET QG . . 4.440 3.431 2.594 3.878 . 0 0 "[ . 1 . 2]" 1
444 1 19 MET H 1 20 ILE H . . 4.880 4.068 3.050 4.407 . 0 0 "[ . 1 . 2]" 1
445 1 19 MET H 1 20 ILE MD . . 5.500 5.034 4.572 5.577 0.077 8 0 "[ . 1 . 2]" 1
446 1 19 MET H 1 20 ILE QG . . 5.370 3.608 3.214 4.141 . 0 0 "[ . 1 . 2]" 1
447 1 19 MET H 1 90 VAL QG . . 5.500 5.037 4.631 5.348 . 0 0 "[ . 1 . 2]" 1
448 1 19 MET HA 1 19 MET ME . . 3.820 2.763 2.103 3.915 0.095 10 0 "[ . 1 . 2]" 1
449 1 19 MET HA 1 20 ILE H . . 3.300 2.169 2.037 2.441 . 0 0 "[ . 1 . 2]" 1
450 1 19 MET HA 1 20 ILE HA . . 5.020 4.415 4.319 4.484 . 0 0 "[ . 1 . 2]" 1
451 1 19 MET HA 1 20 ILE HB . . 5.500 4.679 4.307 4.950 . 0 0 "[ . 1 . 2]" 1
452 1 19 MET HA 1 20 ILE QG . . 5.500 3.189 2.506 3.625 . 0 0 "[ . 1 . 2]" 1
453 1 19 MET HA 1 20 ILE MG . . 5.500 5.280 5.001 5.404 . 0 0 "[ . 1 . 2]" 1
454 1 19 MET HA 1 31 TYR QE . . 2.980 2.514 2.082 3.069 0.089 2 0 "[ . 1 . 2]" 1
455 1 19 MET HA 1 90 VAL QG . . 5.500 4.608 3.797 5.180 . 0 0 "[ . 1 . 2]" 1
456 1 19 MET QB 1 19 MET ME . . 2.400 2.248 2.037 2.490 0.090 15 0 "[ . 1 . 2]" 1
457 1 19 MET QB 1 20 ILE H . . 4.470 3.237 2.347 3.901 . 0 0 "[ . 1 . 2]" 1
458 1 19 MET QB 1 20 ILE QG . . 5.500 4.463 3.935 4.944 . 0 0 "[ . 1 . 2]" 1
459 1 19 MET QB 1 31 TYR QE . . 5.500 3.915 2.046 5.186 . 0 0 "[ . 1 . 2]" 1
460 1 19 MET ME 1 19 MET QG . . 2.910 2.503 2.221 2.749 . 0 0 "[ . 1 . 2]" 1
461 1 19 MET ME 1 20 ILE H . . 5.500 2.560 1.865 3.318 . 0 0 "[ . 1 . 2]" 1
462 1 19 MET ME 1 20 ILE HA . . 4.220 3.957 3.289 4.300 0.080 3 0 "[ . 1 . 2]" 1
463 1 19 MET ME 1 20 ILE QG . . 5.000 4.392 3.793 4.795 . 0 0 "[ . 1 . 2]" 1
464 1 19 MET ME 1 21 HIS H . . 4.730 4.290 3.718 4.743 0.013 9 0 "[ . 1 . 2]" 1
465 1 19 MET ME 1 21 HIS HB2 . . 4.290 4.258 3.725 4.400 0.110 8 0 "[ . 1 . 2]" 1
466 1 19 MET ME 1 21 HIS HD2 . . 5.060 4.981 4.082 5.166 0.106 12 0 "[ . 1 . 2]" 1
467 1 19 MET ME 1 31 TYR QD . . 4.090 3.040 2.283 3.673 . 0 0 "[ . 1 . 2]" 1
468 1 19 MET ME 1 31 TYR QE . . 4.530 2.718 2.058 3.367 . 0 0 "[ . 1 . 2]" 1
469 1 19 MET ME 1 32 ARG HE . . 5.500 4.403 2.647 5.552 0.052 15 0 "[ . 1 . 2]" 1
470 1 19 MET ME 1 35 MET ME . . 3.320 3.229 2.576 3.453 0.133 15 0 "[ . 1 . 2]" 1
471 1 19 MET QG 1 20 ILE H . . 4.750 3.768 3.186 4.295 . 0 0 "[ . 1 . 2]" 1
472 1 19 MET QG 1 20 ILE QG . . 5.500 4.888 4.466 5.092 . 0 0 "[ . 1 . 2]" 1
473 1 19 MET QG 1 35 MET ME . . 3.770 2.963 2.139 3.590 . 0 0 "[ . 1 . 2]" 1
474 1 20 ILE H 1 20 ILE HB . . 3.780 2.881 2.710 3.135 . 0 0 "[ . 1 . 2]" 1
475 1 20 ILE H 1 20 ILE MD . . 5.470 3.908 3.595 4.220 . 0 0 "[ . 1 . 2]" 1
476 1 20 ILE H 1 20 ILE QG . . 4.330 2.505 1.890 2.802 . 0 0 "[ . 1 . 2]" 1
477 1 20 ILE H 1 21 HIS H . . 5.000 4.216 3.868 4.583 . 0 0 "[ . 1 . 2]" 1
478 1 20 ILE H 1 31 TYR QD . . 4.950 3.485 3.055 4.224 . 0 0 "[ . 1 . 2]" 1
479 1 20 ILE H 1 31 TYR QE . . 3.270 2.643 2.017 3.169 . 0 0 "[ . 1 . 2]" 1
480 1 20 ILE H 1 35 MET ME . . 4.750 4.506 3.622 4.870 0.120 8 0 "[ . 1 . 2]" 1
481 1 20 ILE HA 1 20 ILE MD . . 4.130 4.067 3.941 4.173 0.043 13 0 "[ . 1 . 2]" 1
482 1 20 ILE HA 1 21 HIS H . . 2.870 2.230 2.028 2.467 . 0 0 "[ . 1 . 2]" 1
483 1 20 ILE HA 1 21 HIS HB2 . . 5.500 5.565 5.527 5.584 0.084 4 0 "[ . 1 . 2]" 1
484 1 20 ILE HA 1 21 HIS HB3 . . 4.730 4.232 4.124 4.455 . 0 0 "[ . 1 . 2]" 1
485 1 20 ILE HA 1 21 HIS HD2 . . 4.150 3.495 3.017 4.141 . 0 0 "[ . 1 . 2]" 1
486 1 20 ILE HA 1 22 PHE QE . . 5.490 4.925 4.679 5.287 . 0 0 "[ . 1 . 2]" 1
487 1 20 ILE HB 1 21 HIS H . . 4.300 3.763 3.288 4.075 . 0 0 "[ . 1 . 2]" 1
488 1 20 ILE HB 1 22 PHE QD . . 4.720 3.754 3.194 4.002 . 0 0 "[ . 1 . 2]" 1
489 1 20 ILE HB 1 22 PHE QE . . 3.440 2.378 2.073 2.736 . 0 0 "[ . 1 . 2]" 1
490 1 20 ILE HB 1 22 PHE HZ . . 4.030 3.096 2.735 3.576 . 0 0 "[ . 1 . 2]" 1
491 1 20 ILE HB 1 31 TYR QD . . 4.280 3.909 3.426 4.350 0.070 17 0 "[ . 1 . 2]" 1
492 1 20 ILE HB 1 31 TYR QE . . 4.040 3.980 3.651 4.138 0.098 15 0 "[ . 1 . 2]" 1
493 1 20 ILE HB 1 90 VAL QG . . 5.130 4.202 3.910 4.587 . 0 0 "[ . 1 . 2]" 1
494 1 20 ILE MD 1 20 ILE MG . . 3.630 2.055 1.985 2.185 . 0 0 "[ . 1 . 2]" 1
495 1 20 ILE MD 1 21 HIS H . . 5.340 5.163 4.859 5.419 0.079 18 0 "[ . 1 . 2]" 1
496 1 20 ILE MD 1 22 PHE QD . . 5.020 4.607 4.353 4.948 . 0 0 "[ . 1 . 2]" 1
497 1 20 ILE MD 1 22 PHE QE . . 4.040 3.107 2.875 3.650 . 0 0 "[ . 1 . 2]" 1
498 1 20 ILE MD 1 22 PHE HZ . . 3.780 2.428 2.185 3.008 . 0 0 "[ . 1 . 2]" 1
499 1 20 ILE MD 1 31 TYR QD . . 4.570 3.593 3.096 4.254 . 0 0 "[ . 1 . 2]" 1
500 1 20 ILE MD 1 31 TYR QE . . 3.980 2.762 2.340 3.513 . 0 0 "[ . 1 . 2]" 1
501 1 20 ILE MD 1 86 MET ME . . 5.500 5.337 4.875 5.647 0.147 12 0 "[ . 1 . 2]" 1
502 1 20 ILE MD 1 89 ARG H . . 5.470 3.587 3.312 4.100 . 0 0 "[ . 1 . 2]" 1
503 1 20 ILE MD 1 89 ARG HB2 . . 5.220 2.123 1.981 3.218 . 0 0 "[ . 1 . 2]" 1
504 1 20 ILE MD 1 89 ARG HB3 . . 4.180 3.022 2.113 4.067 . 0 0 "[ . 1 . 2]" 1
505 1 20 ILE MD 1 89 ARG HD2 . . 5.500 4.724 3.827 5.162 . 0 0 "[ . 1 . 2]" 1
506 1 20 ILE MD 1 89 ARG HD3 . . 5.500 3.996 2.693 4.792 . 0 0 "[ . 1 . 2]" 1
507 1 20 ILE MD 1 89 ARG HE . . 5.500 5.183 4.299 5.592 0.092 8 0 "[ . 1 . 2]" 1
508 1 20 ILE MD 1 89 ARG HG2 . . 5.350 3.291 2.016 4.037 . 0 0 "[ . 1 . 2]" 1
509 1 20 ILE MD 1 89 ARG HG3 . . 5.410 3.962 2.229 4.726 . 0 0 "[ . 1 . 2]" 1
510 1 20 ILE MD 1 90 VAL H . . 4.170 2.531 2.186 2.967 . 0 0 "[ . 1 . 2]" 1
511 1 20 ILE MD 1 90 VAL HA . . 3.680 2.331 2.065 2.571 . 0 0 "[ . 1 . 2]" 1
512 1 20 ILE MD 1 90 VAL HB . . 5.040 3.670 2.994 4.190 . 0 0 "[ . 1 . 2]" 1
513 1 20 ILE MD 1 90 VAL QG . . 4.260 1.928 1.777 2.197 . 0 0 "[ . 1 . 2]" 1
514 1 20 ILE MD 1 93 GLN H . . 5.500 4.692 4.125 5.008 . 0 0 "[ . 1 . 2]" 1
515 1 20 ILE MD 1 93 GLN HB2 . . 5.300 4.832 4.186 5.329 0.029 14 0 "[ . 1 . 2]" 1
516 1 20 ILE MD 1 93 GLN HE21 . . 5.500 3.516 2.704 4.125 . 0 0 "[ . 1 . 2]" 1
517 1 20 ILE MD 1 93 GLN HE22 . . 5.500 4.806 3.252 5.585 0.085 6 0 "[ . 1 . 2]" 1
518 1 20 ILE MD 1 93 GLN HG2 . . 4.730 3.287 2.618 3.798 . 0 0 "[ . 1 . 2]" 1
519 1 20 ILE MD 1 93 GLN HG3 . . 4.470 3.983 2.662 4.616 0.146 8 0 "[ . 1 . 2]" 1
520 1 20 ILE QG 1 21 HIS H . . 5.240 4.615 4.445 4.800 . 0 0 "[ . 1 . 2]" 1
521 1 20 ILE QG 1 22 PHE QE . . 4.260 4.034 2.985 4.149 . 0 0 "[ . 1 . 2]" 1
522 1 20 ILE QG 1 22 PHE HZ . . 5.330 4.173 3.661 4.685 . 0 0 "[ . 1 . 2]" 1
523 1 20 ILE QG 1 31 TYR QD . . 4.990 4.326 3.660 4.677 . 0 0 "[ . 1 . 2]" 1
524 1 20 ILE QG 1 31 TYR QE . . 4.230 3.316 2.833 3.895 . 0 0 "[ . 1 . 2]" 1
525 1 20 ILE QG 1 90 VAL H . . 5.380 4.362 3.874 4.898 . 0 0 "[ . 1 . 2]" 1
526 1 20 ILE QG 1 90 VAL HA . . 5.470 3.371 2.963 3.872 . 0 0 "[ . 1 . 2]" 1
527 1 20 ILE QG 1 90 VAL QG . . 4.770 2.798 2.249 3.214 . 0 0 "[ . 1 . 2]" 1
528 1 20 ILE QG 1 93 GLN HE21 . . 5.100 3.593 3.384 4.138 . 0 0 "[ . 1 . 2]" 1
529 1 20 ILE QG 1 93 GLN HE22 . . 5.500 4.736 3.639 5.052 . 0 0 "[ . 1 . 2]" 1
530 1 20 ILE QG 1 93 GLN HG2 . . 5.440 3.227 2.818 3.753 . 0 0 "[ . 1 . 2]" 1
531 1 20 ILE QG 1 93 GLN HG3 . . 5.330 3.185 2.704 3.704 . 0 0 "[ . 1 . 2]" 1
532 1 20 ILE MG 1 21 HIS H . . 3.680 2.499 1.959 2.967 . 0 0 "[ . 1 . 2]" 1
533 1 20 ILE MG 1 21 HIS HA . . 4.990 4.280 4.003 4.680 . 0 0 "[ . 1 . 2]" 1
534 1 20 ILE MG 1 21 HIS HD2 . . 5.140 3.935 3.286 4.594 . 0 0 "[ . 1 . 2]" 1
535 1 20 ILE MG 1 22 PHE H . . 5.080 2.434 1.964 4.719 . 0 0 "[ . 1 . 2]" 1
536 1 20 ILE MG 1 22 PHE HA . . 5.320 3.396 3.085 3.865 . 0 0 "[ . 1 . 2]" 1
537 1 20 ILE MG 1 22 PHE QD . . 3.910 3.308 3.087 3.617 . 0 0 "[ . 1 . 2]" 1
538 1 20 ILE MG 1 22 PHE QE . . 3.490 2.940 2.766 3.143 . 0 0 "[ . 1 . 2]" 1
539 1 20 ILE MG 1 22 PHE HZ . . 3.540 3.095 2.812 3.515 . 0 0 "[ . 1 . 2]" 1
540 1 20 ILE MG 1 86 MET HA . . 5.500 4.557 3.994 5.173 . 0 0 "[ . 1 . 2]" 1
541 1 20 ILE MG 1 86 MET ME . . 5.500 5.489 5.221 5.621 0.121 12 0 "[ . 1 . 2]" 1
542 1 20 ILE MG 1 89 ARG HB2 . . 5.020 3.039 2.491 3.584 . 0 0 "[ . 1 . 2]" 1
543 1 20 ILE MG 1 89 ARG HB3 . . 5.060 3.431 2.778 4.346 . 0 0 "[ . 1 . 2]" 1
544 1 20 ILE MG 1 89 ARG HD3 . . 5.350 4.599 2.771 5.440 0.090 11 0 "[ . 1 . 2]" 1
545 1 20 ILE MG 1 89 ARG HE . . 5.500 4.925 3.666 5.622 0.122 12 0 "[ . 1 . 2]" 1
546 1 20 ILE MG 1 89 ARG HG2 . . 5.200 3.424 2.909 4.075 . 0 0 "[ . 1 . 2]" 1
547 1 20 ILE MG 1 89 ARG HG3 . . 5.460 3.952 2.263 5.340 . 0 0 "[ . 1 . 2]" 1
548 1 20 ILE MG 1 90 VAL QG . . 5.300 4.282 4.133 4.455 . 0 0 "[ . 1 . 2]" 1
549 1 20 ILE MG 1 93 GLN HE21 . . 5.500 3.826 3.028 4.253 . 0 0 "[ . 1 . 2]" 1
550 1 20 ILE MG 1 93 GLN HE22 . . 5.500 4.420 2.862 4.971 . 0 0 "[ . 1 . 2]" 1
551 1 20 ILE MG 1 93 GLN HG2 . . 5.500 4.613 4.201 4.997 . 0 0 "[ . 1 . 2]" 1
552 1 21 HIS H 1 21 HIS HB2 . . 3.820 3.785 3.613 3.889 0.069 5 0 "[ . 1 . 2]" 1
553 1 21 HIS H 1 21 HIS HB3 . . 3.540 2.885 2.555 3.129 . 0 0 "[ . 1 . 2]" 1
554 1 21 HIS H 1 21 HIS HD2 . . 3.720 2.184 1.952 2.620 . 0 0 "[ . 1 . 2]" 1
555 1 21 HIS H 1 22 PHE H . . 4.980 2.156 1.746 4.437 . 0 0 "[ . 1 . 2]" 1
556 1 21 HIS H 1 22 PHE QD . . 4.850 4.196 3.771 4.930 0.080 4 0 "[ . 1 . 2]" 1
557 1 21 HIS H 1 22 PHE QE . . 5.430 4.854 4.364 5.291 . 0 0 "[ . 1 . 2]" 1
558 1 21 HIS HA 1 22 PHE QD . . 3.840 3.037 2.641 3.368 . 0 0 "[ . 1 . 2]" 1
559 1 21 HIS HA 1 23 GLY H . . 4.390 4.166 3.854 4.404 0.014 13 0 "[ . 1 . 2]" 1
560 1 21 HIS HB2 1 22 PHE H . . 4.690 4.316 3.062 4.450 . 0 0 "[ . 1 . 2]" 1
561 1 21 HIS HB2 1 23 GLY H . . 3.880 3.706 3.328 3.958 0.078 16 0 "[ . 1 . 2]" 1
562 1 21 HIS HB3 1 21 HIS HD2 . . 3.400 2.920 2.791 3.380 . 0 0 "[ . 1 . 2]" 1
563 1 21 HIS HB3 1 22 PHE H . . 4.840 4.257 4.160 4.413 . 0 0 "[ . 1 . 2]" 1
564 1 21 HIS HB3 1 23 GLY H . . 5.200 4.614 4.406 4.944 . 0 0 "[ . 1 . 2]" 1
565 1 21 HIS HD2 1 22 PHE H . . 4.860 3.481 2.999 4.923 0.063 4 0 "[ . 1 . 2]" 1
566 1 21 HIS HD2 1 22 PHE HA . . 5.340 5.127 4.620 5.405 0.065 1 0 "[ . 1 . 2]" 1
567 1 21 HIS HD2 1 23 GLY H . . 4.980 4.269 3.630 5.044 0.064 4 0 "[ . 1 . 2]" 1
568 1 21 HIS HE1 1 23 GLY HA2 . . 5.000 3.042 2.394 5.058 0.058 4 0 "[ . 1 . 2]" 1
569 1 22 PHE H 1 22 PHE HB2 . . 3.850 3.494 2.616 3.712 . 0 0 "[ . 1 . 2]" 1
570 1 22 PHE H 1 22 PHE HB3 . . 3.960 3.950 3.785 4.036 0.076 8 0 "[ . 1 . 2]" 1
571 1 22 PHE H 1 22 PHE QD . . 3.960 3.207 2.937 3.408 . 0 0 "[ . 1 . 2]" 1
572 1 22 PHE H 1 22 PHE QE . . 5.500 4.454 4.196 5.055 . 0 0 "[ . 1 . 2]" 1
573 1 22 PHE H 1 23 GLY H . . 3.500 3.038 2.043 3.256 . 0 0 "[ . 1 . 2]" 1
574 1 22 PHE H 1 23 GLY HA3 . . 5.500 5.440 4.735 5.569 0.069 10 0 "[ . 1 . 2]" 1
575 1 22 PHE H 1 24 ASN H . . 4.830 4.745 3.343 4.914 0.084 15 0 "[ . 1 . 2]" 1
576 1 22 PHE H 1 28 ASP HA . . 5.500 5.172 3.559 5.543 0.043 5 0 "[ . 1 . 2]" 1
577 1 22 PHE HA 1 22 PHE QD . . 3.300 2.942 2.764 3.234 . 0 0 "[ . 1 . 2]" 1
578 1 22 PHE HA 1 22 PHE QE . . 5.010 4.648 4.412 4.911 . 0 0 "[ . 1 . 2]" 1
579 1 22 PHE HA 1 24 ASN H . . 4.830 4.464 4.000 4.762 . 0 0 "[ . 1 . 2]" 1
580 1 22 PHE HB2 1 23 GLY H . . 4.350 3.679 3.266 3.994 . 0 0 "[ . 1 . 2]" 1
581 1 22 PHE HB2 1 27 GLU HB2 . . 4.500 2.568 2.190 3.176 . 0 0 "[ . 1 . 2]" 1
582 1 22 PHE HB2 1 27 GLU HB3 . . 4.590 2.957 2.591 3.496 . 0 0 "[ . 1 . 2]" 1
583 1 22 PHE HB2 1 28 ASP H . . 4.760 3.608 2.943 4.122 . 0 0 "[ . 1 . 2]" 1
584 1 22 PHE HB2 1 86 MET ME . . 5.500 4.620 4.224 4.986 . 0 0 "[ . 1 . 2]" 1
585 1 22 PHE HB3 1 23 GLY H . . 4.750 4.355 4.126 4.539 . 0 0 "[ . 1 . 2]" 1
586 1 22 PHE HB3 1 24 ASN H . . 4.240 3.907 2.973 4.312 0.072 19 0 "[ . 1 . 2]" 1
587 1 22 PHE HB3 1 24 ASN HD21 . . 5.500 3.901 3.002 5.575 0.075 7 0 "[ . 1 . 2]" 1
588 1 22 PHE HB3 1 24 ASN HD22 . . 5.490 4.924 4.056 5.570 0.080 8 0 "[ . 1 . 2]" 1
589 1 22 PHE HB3 1 27 GLU HB2 . . 4.510 3.047 2.514 3.928 . 0 0 "[ . 1 . 2]" 1
590 1 22 PHE HB3 1 27 GLU HB3 . . 4.660 3.222 2.663 3.995 . 0 0 "[ . 1 . 2]" 1
591 1 22 PHE QD 1 23 GLY H . . 4.860 4.637 4.287 4.902 0.042 18 0 "[ . 1 . 2]" 1
592 1 22 PHE QD 1 27 GLU HB2 . . 4.420 3.837 3.446 4.198 . 0 0 "[ . 1 . 2]" 1
593 1 22 PHE QD 1 27 GLU HB3 . . 3.940 3.273 2.979 3.683 . 0 0 "[ . 1 . 2]" 1
594 1 22 PHE QD 1 28 ASP H . . 4.160 4.070 3.762 4.250 0.090 14 0 "[ . 1 . 2]" 1
595 1 22 PHE QD 1 28 ASP HA . . 3.180 2.630 2.283 2.999 . 0 0 "[ . 1 . 2]" 1
596 1 22 PHE QD 1 28 ASP HB2 . . 4.300 3.898 3.353 4.390 0.090 2 0 "[ . 1 . 2]" 1
597 1 22 PHE QD 1 31 TYR H . . 5.500 4.813 4.560 5.239 . 0 0 "[ . 1 . 2]" 1
598 1 22 PHE QD 1 31 TYR HB3 . . 4.500 3.566 3.122 3.854 . 0 0 "[ . 1 . 2]" 1
599 1 22 PHE QD 1 86 MET HA . . 4.850 4.721 4.406 4.937 0.087 1 0 "[ . 1 . 2]" 1
600 1 22 PHE QD 1 86 MET ME . . 4.240 3.788 3.509 4.102 . 0 0 "[ . 1 . 2]" 1
601 1 22 PHE QE 1 28 ASP HA . . 4.420 4.042 3.286 4.483 0.063 2 0 "[ . 1 . 2]" 1
602 1 22 PHE QE 1 31 TYR H . . 4.750 4.609 4.337 4.845 0.095 4 0 "[ . 1 . 2]" 1
603 1 22 PHE QE 1 31 TYR HB2 . . 3.600 2.418 2.149 2.732 . 0 0 "[ . 1 . 2]" 1
604 1 22 PHE QE 1 31 TYR HB3 . . 3.520 2.925 2.682 3.123 . 0 0 "[ . 1 . 2]" 1
605 1 22 PHE QE 1 31 TYR QD . . 3.330 2.969 2.736 3.237 . 0 0 "[ . 1 . 2]" 1
606 1 22 PHE QE 1 32 ARG H . . 5.210 5.255 5.035 5.303 0.093 12 0 "[ . 1 . 2]" 1
607 1 22 PHE QE 1 86 MET H . . 5.500 5.079 4.663 5.434 . 0 0 "[ . 1 . 2]" 1
608 1 22 PHE QE 1 86 MET HA . . 3.850 2.566 2.275 2.991 . 0 0 "[ . 1 . 2]" 1
609 1 22 PHE QE 1 86 MET ME . . 3.710 3.509 3.109 3.741 0.031 5 0 "[ . 1 . 2]" 1
610 1 22 PHE QE 1 86 MET QG . . 5.420 4.285 4.068 4.497 . 0 0 "[ . 1 . 2]" 1
611 1 22 PHE QE 1 89 ARG HB2 . . 4.350 3.991 3.374 4.961 0.611 2 1 "[ + . 1 . 2]" 1
612 1 22 PHE QE 1 89 ARG HD2 . . 5.440 4.622 3.518 5.410 . 0 0 "[ . 1 . 2]" 1
613 1 22 PHE QE 1 89 ARG HD3 . . 5.500 3.409 2.002 4.561 . 0 0 "[ . 1 . 2]" 1
614 1 22 PHE QE 1 89 ARG HE . . 5.500 3.179 2.311 4.135 . 0 0 "[ . 1 . 2]" 1
615 1 22 PHE QE 1 89 ARG HG2 . . 4.840 3.258 2.249 4.434 . 0 0 "[ . 1 . 2]" 1
616 1 22 PHE QE 1 89 ARG HG3 . . 5.170 4.127 2.515 5.255 0.085 4 0 "[ . 1 . 2]" 1
617 1 22 PHE HZ 1 31 TYR HB2 . . 4.590 3.876 3.310 4.165 . 0 0 "[ . 1 . 2]" 1
618 1 22 PHE HZ 1 31 TYR HB3 . . 5.500 5.079 4.522 5.429 . 0 0 "[ . 1 . 2]" 1
619 1 22 PHE HZ 1 31 TYR QD . . 4.220 3.296 2.682 3.598 . 0 0 "[ . 1 . 2]" 1
620 1 22 PHE HZ 1 31 TYR QE . . 4.200 4.054 3.592 4.294 0.094 2 0 "[ . 1 . 2]" 1
621 1 22 PHE HZ 1 86 MET H . . 5.050 5.033 4.883 5.134 0.084 2 0 "[ . 1 . 2]" 1
622 1 22 PHE HZ 1 86 MET HA . . 3.790 2.343 2.081 2.530 . 0 0 "[ . 1 . 2]" 1
623 1 22 PHE HZ 1 86 MET HB2 . . 3.900 3.949 3.883 3.987 0.087 18 0 "[ . 1 . 2]" 1
624 1 22 PHE HZ 1 86 MET HB3 . . 4.330 2.336 2.224 2.461 . 0 0 "[ . 1 . 2]" 1
625 1 22 PHE HZ 1 86 MET ME . . 4.010 3.963 3.576 4.117 0.107 8 0 "[ . 1 . 2]" 1
626 1 22 PHE HZ 1 86 MET QG . . 5.160 4.051 3.779 4.371 . 0 0 "[ . 1 . 2]" 1
627 1 22 PHE HZ 1 89 ARG HB2 . . 4.860 4.096 3.422 4.983 0.123 2 0 "[ . 1 . 2]" 1
628 1 22 PHE HZ 1 89 ARG HD3 . . 5.340 4.480 2.260 5.415 0.075 11 0 "[ . 1 . 2]" 1
629 1 22 PHE HZ 1 89 ARG HG2 . . 5.500 4.341 2.805 5.552 0.052 5 0 "[ . 1 . 2]" 1
630 1 22 PHE HZ 1 90 VAL QG . . 4.170 3.901 3.446 4.186 0.016 5 0 "[ . 1 . 2]" 1
631 1 23 GLY H 1 24 ASN H . . 3.220 2.675 2.290 2.874 . 0 0 "[ . 1 . 2]" 1
632 1 24 ASN H 1 24 ASN QB . . 3.560 2.406 2.171 2.722 . 0 0 "[ . 1 . 2]" 1
633 1 24 ASN H 1 24 ASN HD21 . . 4.750 4.587 3.912 4.826 0.076 2 0 "[ . 1 . 2]" 1
634 1 24 ASN H 1 25 ASP H . . 4.630 4.436 4.319 4.579 . 0 0 "[ . 1 . 2]" 1
635 1 24 ASN H 1 25 ASP HA . . 5.140 4.988 4.756 5.211 0.071 16 0 "[ . 1 . 2]" 1
636 1 24 ASN H 1 26 TRP H . . 5.500 5.334 4.604 5.586 0.086 1 0 "[ . 1 . 2]" 1
637 1 24 ASN H 1 27 GLU H . . 5.320 5.010 4.542 5.387 0.067 4 0 "[ . 1 . 2]" 1
638 1 24 ASN H 1 27 GLU HB2 . . 4.630 4.045 3.779 4.407 . 0 0 "[ . 1 . 2]" 1
639 1 24 ASN H 1 27 GLU HB3 . . 5.320 5.323 5.189 5.397 0.077 14 0 "[ . 1 . 2]" 1
640 1 24 ASN H 1 28 ASP H . . 4.910 3.890 3.542 4.548 . 0 0 "[ . 1 . 2]" 1
641 1 24 ASN HA 1 24 ASN HD22 . . 5.500 4.366 3.692 4.846 . 0 0 "[ . 1 . 2]" 1
642 1 24 ASN HA 1 25 ASP H . . 2.890 2.372 2.130 2.619 . 0 0 "[ . 1 . 2]" 1
643 1 24 ASN HA 1 25 ASP QB . . 4.610 4.295 3.897 4.664 0.054 7 0 "[ . 1 . 2]" 1
644 1 24 ASN HA 1 26 TRP H . . 4.760 4.072 3.705 4.373 . 0 0 "[ . 1 . 2]" 1
645 1 24 ASN QB 1 25 ASP H . . 3.670 2.772 2.121 3.586 . 0 0 "[ . 1 . 2]" 1
646 1 24 ASN QB 1 25 ASP HA . . 5.140 4.180 3.987 4.586 . 0 0 "[ . 1 . 2]" 1
647 1 24 ASN QB 1 26 TRP H . . 4.490 2.563 2.057 3.163 . 0 0 "[ . 1 . 2]" 1
648 1 24 ASN QB 1 26 TRP QB . . 5.210 4.401 3.776 4.796 . 0 0 "[ . 1 . 2]" 1
649 1 24 ASN QB 1 26 TRP HD1 . . 3.640 3.354 2.194 3.747 0.107 11 0 "[ . 1 . 2]" 1
650 1 24 ASN QB 1 26 TRP HE1 . . 5.270 4.336 3.338 4.909 . 0 0 "[ . 1 . 2]" 1
651 1 24 ASN QB 1 27 GLU H . . 4.430 2.125 1.865 2.498 . 0 0 "[ . 1 . 2]" 1
652 1 24 ASN QB 1 27 GLU HB2 . . 4.250 2.061 1.969 2.189 . 0 0 "[ . 1 . 2]" 1
653 1 24 ASN QB 1 27 GLU HB3 . . 4.470 3.540 3.309 3.857 . 0 0 "[ . 1 . 2]" 1
654 1 24 ASN QB 1 27 GLU HG2 . . 5.500 4.309 3.845 4.515 . 0 0 "[ . 1 . 2]" 1
655 1 24 ASN QB 1 27 GLU HG3 . . 5.140 3.150 2.593 3.540 . 0 0 "[ . 1 . 2]" 1
656 1 24 ASN QB 1 28 ASP HB2 . . 4.230 3.707 2.821 4.306 0.076 6 0 "[ . 1 . 2]" 1
657 1 24 ASN HD21 1 25 ASP H . . 5.500 4.878 3.090 5.588 0.088 18 0 "[ . 1 . 2]" 1
658 1 24 ASN HD21 1 26 TRP H . . 5.500 4.729 3.763 5.396 . 0 0 "[ . 1 . 2]" 1
659 1 24 ASN HD21 1 26 TRP HD1 . . 4.150 3.995 2.963 4.234 0.084 16 0 "[ . 1 . 2]" 1
660 1 24 ASN HD21 1 26 TRP HE1 . . 5.500 3.561 2.805 4.043 . 0 0 "[ . 1 . 2]" 1
661 1 24 ASN HD21 1 27 GLU H . . 5.500 3.615 3.297 4.072 . 0 0 "[ . 1 . 2]" 1
662 1 24 ASN HD21 1 27 GLU HB2 . . 5.400 2.880 2.347 4.045 . 0 0 "[ . 1 . 2]" 1
663 1 24 ASN HD21 1 27 GLU HB3 . . 5.500 4.176 3.584 5.559 0.059 1 0 "[ . 1 . 2]" 1
664 1 24 ASN HD21 1 27 GLU HG2 . . 5.500 4.191 3.407 5.535 0.035 14 0 "[ . 1 . 2]" 1
665 1 24 ASN HD21 1 27 GLU HG3 . . 5.500 2.681 1.734 4.042 . 0 0 "[ . 1 . 2]" 1
666 1 24 ASN HD21 1 28 ASP H . . 5.500 5.090 4.746 5.570 0.070 5 0 "[ . 1 . 2]" 1
667 1 24 ASN HD22 1 27 GLU H . . 5.500 4.315 3.658 5.001 . 0 0 "[ . 1 . 2]" 1
668 1 24 ASN HD22 1 27 GLU HB2 . . 5.100 4.025 3.769 4.240 . 0 0 "[ . 1 . 2]" 1
669 1 24 ASN HD22 1 27 GLU HB3 . . 5.180 5.245 5.033 5.272 0.092 10 0 "[ . 1 . 2]" 1
670 1 24 ASN HD22 1 27 GLU HG2 . . 5.500 4.812 4.338 5.430 . 0 0 "[ . 1 . 2]" 1
671 1 24 ASN HD22 1 27 GLU HG3 . . 4.410 3.197 2.722 3.835 . 0 0 "[ . 1 . 2]" 1
672 1 25 ASP H 1 25 ASP QB . . 3.000 2.331 2.080 2.559 . 0 0 "[ . 1 . 2]" 1
673 1 25 ASP H 1 26 TRP H . . 3.560 2.334 1.984 2.676 . 0 0 "[ . 1 . 2]" 1
674 1 25 ASP H 1 26 TRP QB . . 5.500 4.427 4.112 4.765 . 0 0 "[ . 1 . 2]" 1
675 1 25 ASP H 1 26 TRP HD1 . . 5.500 3.760 3.326 4.449 . 0 0 "[ . 1 . 2]" 1
676 1 25 ASP H 1 27 GLU H . . 5.330 4.134 3.530 4.534 . 0 0 "[ . 1 . 2]" 1
677 1 25 ASP HA 1 26 TRP HA . . 4.770 4.551 4.332 4.734 . 0 0 "[ . 1 . 2]" 1
678 1 25 ASP HA 1 26 TRP QB . . 5.230 5.200 5.043 5.314 0.084 17 0 "[ . 1 . 2]" 1
679 1 25 ASP HA 1 27 GLU H . . 5.500 5.080 4.641 5.409 . 0 0 "[ . 1 . 2]" 1
680 1 25 ASP HA 1 28 ASP H . . 4.120 4.131 3.787 4.203 0.083 2 0 "[ . 1 . 2]" 1
681 1 25 ASP HA 1 28 ASP HB2 . . 4.220 4.128 3.916 4.287 0.067 3 0 "[ . 1 . 2]" 1
682 1 25 ASP HA 1 28 ASP HB3 . . 3.990 3.136 2.742 3.785 . 0 0 "[ . 1 . 2]" 1
683 1 25 ASP HA 1 29 ARG H . . 4.540 4.007 3.524 4.444 . 0 0 "[ . 1 . 2]" 1
684 1 25 ASP QB 1 26 TRP H . . 3.380 2.809 2.333 3.478 0.098 12 0 "[ . 1 . 2]" 1
685 1 25 ASP QB 1 26 TRP HA . . 4.550 3.996 3.360 4.602 0.052 4 0 "[ . 1 . 2]" 1
686 1 25 ASP QB 1 26 TRP QB . . 5.140 3.657 3.250 4.186 . 0 0 "[ . 1 . 2]" 1
687 1 25 ASP QB 1 29 ARG H . . 5.500 5.183 4.642 5.598 0.098 2 0 "[ . 1 . 2]" 1
688 1 26 TRP H 1 26 TRP QB . . 2.990 2.589 2.294 2.972 . 0 0 "[ . 1 . 2]" 1
689 1 26 TRP H 1 26 TRP HD1 . . 3.570 2.623 2.307 3.059 . 0 0 "[ . 1 . 2]" 1
690 1 26 TRP H 1 27 GLU H . . 3.380 2.496 2.073 2.804 . 0 0 "[ . 1 . 2]" 1
691 1 26 TRP HA 1 26 TRP HD1 . . 4.510 4.525 4.394 4.587 0.077 15 0 "[ . 1 . 2]" 1
692 1 26 TRP HA 1 26 TRP HE3 . . 4.940 4.074 3.799 4.313 . 0 0 "[ . 1 . 2]" 1
693 1 26 TRP HA 1 29 ARG H . . 4.150 3.581 3.054 3.816 . 0 0 "[ . 1 . 2]" 1
694 1 26 TRP HA 1 29 ARG QB . . 3.750 3.762 3.210 3.851 0.101 12 0 "[ . 1 . 2]" 1
695 1 26 TRP HA 1 29 ARG HD2 . . 5.500 3.028 2.599 3.291 . 0 0 "[ . 1 . 2]" 1
696 1 26 TRP HA 1 29 ARG HD3 . . 4.770 2.936 2.270 4.091 . 0 0 "[ . 1 . 2]" 1
697 1 26 TRP HA 1 29 ARG HE . . 5.500 5.189 4.670 5.505 0.005 10 0 "[ . 1 . 2]" 1
698 1 26 TRP HA 1 29 ARG HG3 . . 5.500 3.909 3.271 4.406 . 0 0 "[ . 1 . 2]" 1
699 1 26 TRP HA 1 30 TYR H . . 5.080 3.907 3.694 4.199 . 0 0 "[ . 1 . 2]" 1
700 1 26 TRP QB 1 26 TRP HD1 . . 2.880 2.669 2.524 2.801 . 0 0 "[ . 1 . 2]" 1
701 1 26 TRP QB 1 26 TRP HE3 . . 3.040 2.635 2.508 2.788 . 0 0 "[ . 1 . 2]" 1
702 1 26 TRP QB 1 27 GLU H . . 4.310 3.470 3.329 3.608 . 0 0 "[ . 1 . 2]" 1
703 1 26 TRP QB 1 27 GLU HG2 . . 5.500 5.188 4.639 5.560 0.060 15 0 "[ . 1 . 2]" 1
704 1 26 TRP QB 1 27 GLU HG3 . . 5.260 4.716 4.434 5.330 0.070 1 0 "[ . 1 . 2]" 1
705 1 26 TRP QB 1 29 ARG HD2 . . 4.530 4.238 3.182 4.551 0.021 10 0 "[ . 1 . 2]" 1
706 1 26 TRP QB 1 29 ARG HD3 . . 4.600 3.674 3.116 4.621 0.021 9 0 "[ . 1 . 2]" 1
707 1 26 TRP HD1 1 27 GLU H . . 4.320 3.219 2.871 3.690 . 0 0 "[ . 1 . 2]" 1
708 1 26 TRP HD1 1 27 GLU HB2 . . 5.080 4.973 4.651 5.153 0.073 7 0 "[ . 1 . 2]" 1
709 1 26 TRP HE1 1 27 GLU HG3 . . 5.500 3.085 2.716 3.467 . 0 0 "[ . 1 . 2]" 1
710 1 26 TRP HE3 1 27 GLU HA . . 4.170 3.576 3.211 3.910 . 0 0 "[ . 1 . 2]" 1
711 1 26 TRP HE3 1 27 GLU HG2 . . 4.460 4.060 3.574 4.412 . 0 0 "[ . 1 . 2]" 1
712 1 26 TRP HE3 1 30 TYR HB3 . . 4.570 3.969 3.238 4.639 0.069 3 0 "[ . 1 . 2]" 1
713 1 26 TRP HE3 1 82 THR MG . . 4.450 4.225 3.867 4.541 0.091 8 0 "[ . 1 . 2]" 1
714 1 26 TRP HH2 1 27 GLU HA . . 5.010 5.023 4.588 5.091 0.081 8 0 "[ . 1 . 2]" 1
715 1 26 TRP HH2 1 27 GLU HG2 . . 5.200 3.453 3.220 3.811 . 0 0 "[ . 1 . 2]" 1
716 1 26 TRP HH2 1 82 THR MG . . 3.180 2.455 2.127 3.132 . 0 0 "[ . 1 . 2]" 1
717 1 26 TRP HH2 1 86 MET ME . . 4.900 4.189 3.237 4.977 0.077 7 0 "[ . 1 . 2]" 1
718 1 26 TRP HZ2 1 27 GLU HG2 . . 5.020 3.411 2.969 3.899 . 0 0 "[ . 1 . 2]" 1
719 1 26 TRP HZ2 1 27 GLU HG3 . . 4.930 3.345 3.034 3.855 . 0 0 "[ . 1 . 2]" 1
720 1 26 TRP HZ3 1 27 GLU HA . . 4.960 4.132 3.837 4.513 . 0 0 "[ . 1 . 2]" 1
721 1 26 TRP HZ3 1 27 GLU HG2 . . 4.010 3.796 3.156 4.078 0.068 4 0 "[ . 1 . 2]" 1
722 1 26 TRP HZ3 1 27 GLU HG3 . . 5.500 4.942 4.100 5.328 . 0 0 "[ . 1 . 2]" 1
723 1 26 TRP HZ3 1 30 TYR HB3 . . 5.210 4.449 3.544 5.257 0.047 3 0 "[ . 1 . 2]" 1
724 1 26 TRP HZ3 1 82 THR MG . . 3.480 2.312 2.068 2.690 . 0 0 "[ . 1 . 2]" 1
725 1 26 TRP HZ3 1 86 MET ME . . 4.270 3.892 3.142 4.376 0.106 18 0 "[ . 1 . 2]" 1
726 1 27 GLU H 1 27 GLU HB2 . . 3.570 2.410 2.245 2.622 . 0 0 "[ . 1 . 2]" 1
727 1 27 GLU H 1 27 GLU HB3 . . 3.950 3.588 3.522 3.653 . 0 0 "[ . 1 . 2]" 1
728 1 27 GLU H 1 27 GLU HG2 . . 4.610 3.368 2.811 3.841 . 0 0 "[ . 1 . 2]" 1
729 1 27 GLU H 1 27 GLU HG3 . . 4.450 2.473 2.129 2.979 . 0 0 "[ . 1 . 2]" 1
730 1 27 GLU H 1 28 ASP H . . 3.210 2.700 2.425 2.896 . 0 0 "[ . 1 . 2]" 1
731 1 27 GLU H 1 28 ASP HA . . 5.500 5.329 5.113 5.529 0.029 13 0 "[ . 1 . 2]" 1
732 1 27 GLU HA 1 27 GLU HG2 . . 3.840 2.325 2.176 2.454 . 0 0 "[ . 1 . 2]" 1
733 1 27 GLU HA 1 30 TYR H . . 4.200 3.670 3.327 3.990 . 0 0 "[ . 1 . 2]" 1
734 1 27 GLU HA 1 30 TYR HB2 . . 3.980 3.698 3.253 4.039 0.059 10 0 "[ . 1 . 2]" 1
735 1 27 GLU HA 1 30 TYR HB3 . . 4.440 2.581 2.271 2.944 . 0 0 "[ . 1 . 2]" 1
736 1 27 GLU HA 1 30 TYR QD . . 4.410 3.974 3.289 4.414 0.004 8 0 "[ . 1 . 2]" 1
737 1 27 GLU HA 1 31 TYR H . . 4.700 3.782 3.470 4.149 . 0 0 "[ . 1 . 2]" 1
738 1 27 GLU HA 1 31 TYR HB2 . . 5.050 4.771 4.403 5.047 . 0 0 "[ . 1 . 2]" 1
739 1 27 GLU HA 1 86 MET ME . . 3.520 2.379 2.132 2.876 . 0 0 "[ . 1 . 2]" 1
740 1 27 GLU HB2 1 28 ASP H . . 3.200 2.914 2.537 3.151 . 0 0 "[ . 1 . 2]" 1
741 1 27 GLU HB2 1 28 ASP HA . . 5.320 4.635 4.419 4.907 . 0 0 "[ . 1 . 2]" 1
742 1 27 GLU HB2 1 86 MET ME . . 3.750 3.635 3.526 3.840 0.090 12 0 "[ . 1 . 2]" 1
743 1 27 GLU HB3 1 28 ASP H . . 4.260 3.766 3.388 3.980 . 0 0 "[ . 1 . 2]" 1
744 1 27 GLU HB3 1 86 MET ME . . 3.200 2.243 2.095 2.429 . 0 0 "[ . 1 . 2]" 1
745 1 27 GLU HG2 1 86 MET ME . . 4.020 2.460 2.173 3.248 . 0 0 "[ . 1 . 2]" 1
746 1 27 GLU HG3 1 86 MET ME . . 4.750 3.784 3.615 4.223 . 0 0 "[ . 1 . 2]" 1
747 1 28 ASP H 1 28 ASP HB2 . . 3.400 2.482 2.282 2.733 . 0 0 "[ . 1 . 2]" 1
748 1 28 ASP H 1 28 ASP HB3 . . 3.730 2.481 2.229 2.706 . 0 0 "[ . 1 . 2]" 1
749 1 28 ASP H 1 31 TYR H . . 5.300 4.735 4.579 4.911 . 0 0 "[ . 1 . 2]" 1
750 1 28 ASP HA 1 29 ARG HA . . 4.970 4.754 4.644 4.826 . 0 0 "[ . 1 . 2]" 1
751 1 28 ASP HA 1 30 TYR H . . 5.500 4.518 4.312 4.736 . 0 0 "[ . 1 . 2]" 1
752 1 28 ASP HA 1 31 TYR H . . 4.740 3.780 3.492 4.120 . 0 0 "[ . 1 . 2]" 1
753 1 28 ASP HA 1 31 TYR HB2 . . 4.490 3.926 3.573 4.529 0.039 13 0 "[ . 1 . 2]" 1
754 1 28 ASP HA 1 31 TYR HB3 . . 5.030 2.867 2.582 3.218 . 0 0 "[ . 1 . 2]" 1
755 1 28 ASP HA 1 31 TYR QD . . 4.510 4.218 3.812 4.596 0.086 7 0 "[ . 1 . 2]" 1
756 1 28 ASP HA 1 32 ARG H . . 5.280 3.946 3.680 4.079 . 0 0 "[ . 1 . 2]" 1
757 1 28 ASP HA 1 86 MET ME . . 5.500 4.730 4.316 5.518 0.018 12 0 "[ . 1 . 2]" 1
758 1 28 ASP HB3 1 29 ARG H . . 3.300 2.292 2.148 2.485 . 0 0 "[ . 1 . 2]" 1
759 1 28 ASP HB3 1 29 ARG HA . . 5.500 4.267 4.058 4.515 . 0 0 "[ . 1 . 2]" 1
760 1 28 ASP HB3 1 29 ARG HG2 . . 5.500 4.862 4.302 5.273 . 0 0 "[ . 1 . 2]" 1
761 1 29 ARG H 1 29 ARG QB . . 2.970 2.346 2.204 2.479 . 0 0 "[ . 1 . 2]" 1
762 1 29 ARG H 1 29 ARG HD2 . . 4.890 4.159 4.023 4.580 . 0 0 "[ . 1 . 2]" 1
763 1 29 ARG H 1 29 ARG HG2 . . 3.950 2.674 2.332 3.018 . 0 0 "[ . 1 . 2]" 1
764 1 29 ARG H 1 29 ARG HG3 . . 4.740 3.887 3.487 4.197 . 0 0 "[ . 1 . 2]" 1
765 1 29 ARG H 1 30 TYR H . . 3.540 2.813 2.715 2.997 . 0 0 "[ . 1 . 2]" 1
766 1 29 ARG H 1 30 TYR HA . . 5.500 5.426 5.357 5.521 0.021 12 0 "[ . 1 . 2]" 1
767 1 29 ARG H 1 31 TYR H . . 5.070 4.508 4.358 4.833 . 0 0 "[ . 1 . 2]" 1
768 1 29 ARG HA 1 29 ARG HD2 . . 4.850 4.892 4.731 5.533 0.683 9 1 "[ . +1 . 2]" 1
769 1 29 ARG HA 1 29 ARG HG2 . . 4.110 3.776 3.722 3.840 . 0 0 "[ . 1 . 2]" 1
770 1 29 ARG HA 1 29 ARG HG3 . . 4.050 3.700 3.613 3.862 . 0 0 "[ . 1 . 2]" 1
771 1 29 ARG HA 1 31 TYR H . . 5.500 4.725 4.569 4.993 . 0 0 "[ . 1 . 2]" 1
772 1 29 ARG HA 1 32 ARG H . . 4.100 3.599 3.324 3.995 . 0 0 "[ . 1 . 2]" 1
773 1 29 ARG HA 1 32 ARG HB2 . . 4.480 2.876 2.235 4.814 0.334 13 0 "[ . 1 . 2]" 1
774 1 29 ARG HA 1 32 ARG QD . . 5.210 3.184 2.048 4.408 . 0 0 "[ . 1 . 2]" 1
775 1 29 ARG HA 1 32 ARG HE . . 5.500 3.740 3.110 4.405 . 0 0 "[ . 1 . 2]" 1
776 1 29 ARG HA 1 32 ARG HG3 . . 5.140 3.823 2.340 4.716 . 0 0 "[ . 1 . 2]" 1
777 1 29 ARG HA 1 33 GLU H . . 4.770 4.050 3.803 4.761 . 0 0 "[ . 1 . 2]" 1
778 1 29 ARG HA 1 33 GLU HG2 . . 5.230 4.238 3.771 5.276 0.046 8 0 "[ . 1 . 2]" 1
779 1 29 ARG HA 1 33 GLU HG3 . . 5.500 4.692 3.550 5.528 0.028 5 0 "[ . 1 . 2]" 1
780 1 29 ARG QB 1 29 ARG HD2 . . 3.700 2.451 2.279 3.341 . 0 0 "[ . 1 . 2]" 1
781 1 29 ARG QB 1 29 ARG HD3 . . 3.860 3.314 2.707 3.385 . 0 0 "[ . 1 . 2]" 1
782 1 29 ARG QB 1 29 ARG HE . . 4.430 2.641 2.075 3.485 . 0 0 "[ . 1 . 2]" 1
783 1 29 ARG QB 1 30 TYR H . . 3.740 3.505 3.376 3.576 . 0 0 "[ . 1 . 2]" 1
784 1 29 ARG QB 1 32 ARG HE . . 5.140 4.862 4.202 5.235 0.095 14 0 "[ . 1 . 2]" 1
785 1 29 ARG HD3 1 30 TYR H . . 5.320 4.381 4.190 4.516 . 0 0 "[ . 1 . 2]" 1
786 1 29 ARG HD3 1 30 TYR HB2 . . 4.660 4.739 4.721 4.787 0.127 9 0 "[ . 1 . 2]" 1
787 1 29 ARG HE 1 33 GLU HG3 . . 5.500 4.275 3.620 5.571 0.071 9 0 "[ . 1 . 2]" 1
788 1 29 ARG HG2 1 30 TYR H . . 4.900 2.324 2.130 2.547 . 0 0 "[ . 1 . 2]" 1
789 1 29 ARG HG2 1 33 GLU HG3 . . 5.500 5.548 5.350 5.594 0.094 14 0 "[ . 1 . 2]" 1
790 1 29 ARG HG3 1 30 TYR H . . 4.600 2.751 2.291 3.253 . 0 0 "[ . 1 . 2]" 1
791 1 29 ARG HG3 1 30 TYR HA . . 5.500 3.200 3.069 3.340 . 0 0 "[ . 1 . 2]" 1
792 1 29 ARG HG3 1 30 TYR HB2 . . 4.820 3.613 3.169 4.134 . 0 0 "[ . 1 . 2]" 1
793 1 29 ARG HG3 1 33 GLU H . . 5.500 5.158 4.894 5.573 0.073 10 0 "[ . 1 . 2]" 1
794 1 29 ARG HG3 1 33 GLU HG2 . . 5.500 4.787 4.019 5.583 0.083 8 0 "[ . 1 . 2]" 1
795 1 29 ARG HG3 1 33 GLU HG3 . . 5.340 3.946 3.740 4.184 . 0 0 "[ . 1 . 2]" 1
796 1 30 TYR H 1 30 TYR HB2 . . 3.580 2.557 2.453 2.679 . 0 0 "[ . 1 . 2]" 1
797 1 30 TYR H 1 30 TYR HB3 . . 3.510 2.349 2.223 2.425 . 0 0 "[ . 1 . 2]" 1
798 1 30 TYR H 1 30 TYR QD . . 4.470 4.150 4.016 4.217 . 0 0 "[ . 1 . 2]" 1
799 1 30 TYR H 1 31 TYR H . . 3.660 2.726 2.630 2.885 . 0 0 "[ . 1 . 2]" 1
800 1 30 TYR H 1 31 TYR HB3 . . 5.500 4.712 4.539 4.940 . 0 0 "[ . 1 . 2]" 1
801 1 30 TYR H 1 33 GLU HG3 . . 5.500 5.323 4.702 5.571 0.071 4 0 "[ . 1 . 2]" 1
802 1 30 TYR HA 1 30 TYR QD . . 3.430 3.038 2.490 3.324 . 0 0 "[ . 1 . 2]" 1
803 1 30 TYR HA 1 30 TYR QE . . 5.140 4.813 4.402 5.016 . 0 0 "[ . 1 . 2]" 1
804 1 30 TYR HA 1 32 ARG H . . 5.500 4.805 4.570 5.009 . 0 0 "[ . 1 . 2]" 1
805 1 30 TYR HA 1 33 GLU H . . 4.490 3.644 3.328 3.926 . 0 0 "[ . 1 . 2]" 1
806 1 30 TYR HA 1 33 GLU QB . . 3.590 2.872 2.418 3.354 . 0 0 "[ . 1 . 2]" 1
807 1 30 TYR HA 1 33 GLU HG3 . . 5.260 3.695 2.511 4.542 . 0 0 "[ . 1 . 2]" 1
808 1 30 TYR HA 1 34 ASN H . . 5.440 4.639 4.118 5.122 . 0 0 "[ . 1 . 2]" 1
809 1 30 TYR HA 1 34 ASN HD21 . . 4.340 3.304 2.651 4.112 . 0 0 "[ . 1 . 2]" 1
810 1 30 TYR HA 1 34 ASN HD22 . . 4.760 4.009 3.260 4.696 . 0 0 "[ . 1 . 2]" 1
811 1 30 TYR HB2 1 31 TYR H . . 3.970 3.760 3.632 3.914 . 0 0 "[ . 1 . 2]" 1
812 1 30 TYR HB2 1 31 TYR HA . . 5.500 5.575 5.504 5.597 0.097 5 0 "[ . 1 . 2]" 1
813 1 30 TYR HB3 1 31 TYR H . . 4.880 2.347 2.206 2.521 . 0 0 "[ . 1 . 2]" 1
814 1 30 TYR HB3 1 31 TYR HA . . 5.500 4.336 4.268 4.475 . 0 0 "[ . 1 . 2]" 1
815 1 30 TYR HB3 1 86 MET ME . . 5.500 2.946 2.451 3.613 . 0 0 "[ . 1 . 2]" 1
816 1 30 TYR QD 1 31 TYR H . . 3.900 2.804 2.714 2.974 . 0 0 "[ . 1 . 2]" 1
817 1 30 TYR QD 1 31 TYR HA . . 3.680 2.833 2.547 3.313 . 0 0 "[ . 1 . 2]" 1
818 1 30 TYR QD 1 31 TYR HB3 . . 4.530 4.527 4.350 4.618 0.088 12 0 "[ . 1 . 2]" 1
819 1 30 TYR QD 1 33 GLU H . . 5.500 5.408 5.036 5.584 0.084 4 0 "[ . 1 . 2]" 1
820 1 30 TYR QD 1 33 GLU QB . . 4.900 4.646 3.738 5.003 0.103 13 0 "[ . 1 . 2]" 1
821 1 30 TYR QD 1 34 ASN H . . 5.110 5.065 4.571 5.208 0.098 10 0 "[ . 1 . 2]" 1
822 1 30 TYR QD 1 34 ASN QB . . 4.700 4.023 3.509 4.580 . 0 0 "[ . 1 . 2]" 1
823 1 30 TYR QD 1 34 ASN HD21 . . 5.410 3.610 2.705 4.223 . 0 0 "[ . 1 . 2]" 1
824 1 30 TYR QD 1 34 ASN HD22 . . 5.210 4.037 2.672 5.259 0.049 19 0 "[ . 1 . 2]" 1
825 1 30 TYR QD 1 82 THR MG . . 3.580 3.464 3.136 3.697 0.117 4 0 "[ . 1 . 2]" 1
826 1 30 TYR QD 1 86 MET ME . . 3.130 2.204 1.950 2.522 . 0 0 "[ . 1 . 2]" 1
827 1 30 TYR QD 1 86 MET QG . . 3.830 2.828 2.508 3.257 . 0 0 "[ . 1 . 2]" 1
828 1 30 TYR QE 1 31 TYR H . . 4.940 5.009 4.821 5.037 0.097 2 0 "[ . 1 . 2]" 1
829 1 30 TYR QE 1 31 TYR HA . . 4.420 4.041 3.739 4.399 . 0 0 "[ . 1 . 2]" 1
830 1 30 TYR QE 1 34 ASN QB . . 4.340 3.734 2.908 4.153 . 0 0 "[ . 1 . 2]" 1
831 1 30 TYR QE 1 82 THR HB . . 5.500 3.600 3.097 4.723 . 0 0 "[ . 1 . 2]" 1
832 1 30 TYR QE 1 82 THR MG . . 3.380 2.970 2.725 3.326 . 0 0 "[ . 1 . 2]" 1
833 1 30 TYR QE 1 83 ASP HA . . 3.800 2.655 2.293 3.405 . 0 0 "[ . 1 . 2]" 1
834 1 30 TYR QE 1 86 MET HB2 . . 4.060 4.135 3.933 4.166 0.106 5 0 "[ . 1 . 2]" 1
835 1 30 TYR QE 1 86 MET ME . . 3.830 3.076 2.420 3.347 . 0 0 "[ . 1 . 2]" 1
836 1 30 TYR QE 1 86 MET QG . . 3.720 2.414 2.021 2.693 . 0 0 "[ . 1 . 2]" 1
837 1 31 TYR H 1 31 TYR HB2 . . 3.540 2.495 2.381 2.640 . 0 0 "[ . 1 . 2]" 1
838 1 31 TYR H 1 31 TYR HB3 . . 3.580 2.473 2.336 2.591 . 0 0 "[ . 1 . 2]" 1
839 1 31 TYR H 1 31 TYR QD . . 4.520 4.148 4.094 4.229 . 0 0 "[ . 1 . 2]" 1
840 1 31 TYR H 1 32 ARG H . . 3.800 2.958 2.780 3.136 . 0 0 "[ . 1 . 2]" 1
841 1 31 TYR H 1 33 GLU H . . 5.500 4.333 4.203 4.445 . 0 0 "[ . 1 . 2]" 1
842 1 31 TYR H 1 33 GLU QB . . 5.380 5.189 4.955 5.462 0.082 10 0 "[ . 1 . 2]" 1
843 1 31 TYR H 1 34 ASN HD21 . . 5.500 5.066 4.321 5.573 0.073 11 0 "[ . 1 . 2]" 1
844 1 31 TYR H 1 86 MET ME . . 3.910 3.135 2.339 4.007 0.097 18 0 "[ . 1 . 2]" 1
845 1 31 TYR HA 1 31 TYR QD . . 3.100 2.715 2.341 3.004 . 0 0 "[ . 1 . 2]" 1
846 1 31 TYR HA 1 31 TYR QE . . 5.120 4.528 4.343 4.685 . 0 0 "[ . 1 . 2]" 1
847 1 31 TYR HA 1 34 ASN H . . 4.010 3.532 3.376 3.747 . 0 0 "[ . 1 . 2]" 1
848 1 31 TYR HA 1 34 ASN QB . . 5.260 3.556 2.975 4.686 . 0 0 "[ . 1 . 2]" 1
849 1 31 TYR HA 1 34 ASN HD21 . . 5.500 4.301 2.934 5.146 . 0 0 "[ . 1 . 2]" 1
850 1 31 TYR HA 1 35 MET HB3 . . 5.310 4.304 3.761 4.818 . 0 0 "[ . 1 . 2]" 1
851 1 31 TYR HA 1 38 TYR QE . . 3.730 3.678 3.281 3.836 0.106 5 0 "[ . 1 . 2]" 1
852 1 31 TYR HA 1 86 MET ME . . 5.450 3.667 2.861 4.593 . 0 0 "[ . 1 . 2]" 1
853 1 31 TYR HB2 1 32 ARG H . . 3.830 3.819 3.688 3.900 0.070 5 0 "[ . 1 . 2]" 1
854 1 31 TYR HB2 1 86 MET ME . . 4.850 2.603 2.126 3.601 . 0 0 "[ . 1 . 2]" 1
855 1 31 TYR HB3 1 32 ARG H . . 4.560 2.416 2.280 2.549 . 0 0 "[ . 1 . 2]" 1
856 1 31 TYR HB3 1 86 MET ME . . 5.250 3.937 3.401 4.816 . 0 0 "[ . 1 . 2]" 1
857 1 31 TYR QD 1 32 ARG H . . 3.860 3.030 2.691 3.375 . 0 0 "[ . 1 . 2]" 1
858 1 31 TYR QD 1 32 ARG HA . . 4.190 3.234 2.965 3.683 . 0 0 "[ . 1 . 2]" 1
859 1 31 TYR QD 1 32 ARG HG2 . . 5.120 3.644 3.055 4.506 . 0 0 "[ . 1 . 2]" 1
860 1 31 TYR QD 1 32 ARG HG3 . . 4.420 3.041 2.360 4.895 0.475 8 0 "[ . 1 . 2]" 1
861 1 31 TYR QD 1 38 TYR QE . . 3.190 2.666 2.340 3.051 . 0 0 "[ . 1 . 2]" 1
862 1 31 TYR QD 1 86 MET H . . 5.500 5.520 5.322 5.593 0.093 6 0 "[ . 1 . 2]" 1
863 1 31 TYR QD 1 86 MET HB2 . . 3.790 3.075 2.645 3.370 . 0 0 "[ . 1 . 2]" 1
864 1 31 TYR QD 1 86 MET HB3 . . 3.400 2.134 2.065 2.224 . 0 0 "[ . 1 . 2]" 1
865 1 31 TYR QD 1 86 MET ME . . 4.440 3.723 3.142 4.497 0.057 18 0 "[ . 1 . 2]" 1
866 1 31 TYR QD 1 86 MET QG . . 5.500 3.247 2.814 3.620 . 0 0 "[ . 1 . 2]" 1
867 1 31 TYR QD 1 87 MET H . . 5.080 5.121 4.924 5.181 0.101 18 0 "[ . 1 . 2]" 1
868 1 31 TYR QD 1 90 VAL QG . . 4.070 3.651 3.404 3.996 . 0 0 "[ . 1 . 2]" 1
869 1 31 TYR QE 1 32 ARG H . . 5.500 5.100 4.880 5.519 0.019 7 0 "[ . 1 . 2]" 1
870 1 31 TYR QE 1 32 ARG HA . . 4.800 4.131 3.721 4.861 0.061 7 0 "[ . 1 . 2]" 1
871 1 31 TYR QE 1 35 MET HB2 . . 5.500 3.192 2.751 3.772 . 0 0 "[ . 1 . 2]" 1
872 1 31 TYR QE 1 35 MET ME . . 3.460 2.559 2.050 3.451 . 0 0 "[ . 1 . 2]" 1
873 1 31 TYR QE 1 35 MET QG . . 4.810 4.313 3.672 4.650 . 0 0 "[ . 1 . 2]" 1
874 1 31 TYR QE 1 38 TYR QD . . 2.920 2.738 2.390 3.028 0.108 16 0 "[ . 1 . 2]" 1
875 1 31 TYR QE 1 86 MET QG . . 5.500 4.925 4.549 5.256 . 0 0 "[ . 1 . 2]" 1
876 1 31 TYR QE 1 90 VAL H . . 4.540 4.616 4.446 4.643 0.103 20 0 "[ . 1 . 2]" 1
877 1 31 TYR QE 1 90 VAL HB . . 5.350 4.326 3.848 4.574 . 0 0 "[ . 1 . 2]" 1
878 1 31 TYR QE 1 90 VAL QG . . 3.090 1.970 1.844 2.172 . 0 0 "[ . 1 . 2]" 1
879 1 32 ARG H 1 32 ARG HB2 . . 3.840 2.578 2.268 3.670 . 0 0 "[ . 1 . 2]" 1
880 1 32 ARG H 1 32 ARG HB3 . . 3.590 3.524 2.600 3.656 0.066 5 0 "[ . 1 . 2]" 1
881 1 32 ARG H 1 32 ARG QD . . 5.200 3.846 3.058 4.341 . 0 0 "[ . 1 . 2]" 1
882 1 32 ARG H 1 32 ARG HG2 . . 4.340 3.509 2.590 4.015 . 0 0 "[ . 1 . 2]" 1
883 1 32 ARG H 1 32 ARG HG3 . . 4.340 2.336 2.080 2.694 . 0 0 "[ . 1 . 2]" 1
884 1 32 ARG H 1 34 ASN H . . 4.810 4.217 4.039 4.345 . 0 0 "[ . 1 . 2]" 1
885 1 32 ARG HA 1 32 ARG HG2 . . 3.330 2.690 2.313 4.016 0.686 13 2 "[ . - 1 + . 2]" 1
886 1 32 ARG HA 1 34 ASN H . . 5.280 4.039 3.639 4.449 . 0 0 "[ . 1 . 2]" 1
887 1 32 ARG HA 1 35 MET H . . 4.840 3.644 3.244 4.281 . 0 0 "[ . 1 . 2]" 1
888 1 32 ARG HA 1 35 MET HB3 . . 5.060 2.988 2.102 3.599 . 0 0 "[ . 1 . 2]" 1
889 1 32 ARG HA 1 35 MET ME . . 4.120 3.440 1.993 4.203 0.083 9 0 "[ . 1 . 2]" 1
890 1 32 ARG HA 1 35 MET QG . . 4.540 3.054 2.565 3.868 . 0 0 "[ . 1 . 2]" 1
891 1 32 ARG HB2 1 33 GLU HG3 . . 5.500 4.931 4.206 5.223 . 0 0 "[ . 1 . 2]" 1
892 1 32 ARG HB3 1 32 ARG HE . . 5.500 3.801 2.436 4.786 . 0 0 "[ . 1 . 2]" 1
893 1 32 ARG HB3 1 34 ASN H . . 5.500 5.383 5.097 5.665 0.165 13 0 "[ . 1 . 2]" 1
894 1 32 ARG QD 1 33 GLU H . . 5.380 4.800 3.290 5.198 . 0 0 "[ . 1 . 2]" 1
895 1 33 GLU H 1 33 GLU QB . . 3.080 2.337 2.229 2.584 . 0 0 "[ . 1 . 2]" 1
896 1 33 GLU H 1 33 GLU HG2 . . 4.050 2.575 2.242 3.626 . 0 0 "[ . 1 . 2]" 1
897 1 33 GLU H 1 33 GLU HG3 . . 3.610 3.313 2.396 3.592 . 0 0 "[ . 1 . 2]" 1
898 1 33 GLU H 1 34 ASN H . . 3.480 2.685 2.436 2.899 . 0 0 "[ . 1 . 2]" 1
899 1 33 GLU H 1 34 ASN HD21 . . 5.340 4.179 3.523 5.137 . 0 0 "[ . 1 . 2]" 1
900 1 33 GLU H 1 34 ASN HD22 . . 5.500 5.142 4.375 5.559 0.059 19 0 "[ . 1 . 2]" 1
901 1 33 GLU HA 1 33 GLU HG2 . . 3.530 2.680 2.275 2.909 . 0 0 "[ . 1 . 2]" 1
902 1 33 GLU HA 1 33 GLU HG3 . . 3.820 3.679 2.945 3.879 0.059 12 0 "[ . 1 . 2]" 1
903 1 33 GLU HA 1 35 MET H . . 4.780 4.441 3.939 4.801 0.021 7 0 "[ . 1 . 2]" 1
904 1 33 GLU HA 1 36 TYR QE . . 5.000 4.474 3.041 5.092 0.092 15 0 "[ . 1 . 2]" 1
905 1 33 GLU QB 1 34 ASN H . . 3.770 3.061 2.778 3.579 . 0 0 "[ . 1 . 2]" 1
906 1 33 GLU QB 1 34 ASN QB . . 5.230 3.939 3.304 4.600 . 0 0 "[ . 1 . 2]" 1
907 1 33 GLU QB 1 34 ASN HD21 . . 4.580 2.837 2.414 3.904 . 0 0 "[ . 1 . 2]" 1
908 1 33 GLU QB 1 34 ASN HD22 . . 4.770 3.158 2.599 4.378 . 0 0 "[ . 1 . 2]" 1
909 1 33 GLU HG3 1 34 ASN H . . 5.460 5.186 4.667 5.486 0.026 17 0 "[ . 1 . 2]" 1
910 1 33 GLU HG3 1 34 ASN HD22 . . 5.500 5.184 4.276 5.590 0.090 9 0 "[ . 1 . 2]" 1
911 1 34 ASN H 1 34 ASN QB . . 3.630 2.620 2.249 3.096 . 0 0 "[ . 1 . 2]" 1
912 1 34 ASN H 1 34 ASN HD21 . . 4.020 3.083 2.381 3.646 . 0 0 "[ . 1 . 2]" 1
913 1 34 ASN H 1 34 ASN HD22 . . 4.530 4.222 3.222 4.596 0.066 11 0 "[ . 1 . 2]" 1
914 1 34 ASN H 1 35 MET H . . 3.210 2.340 1.957 2.951 . 0 0 "[ . 1 . 2]" 1
915 1 34 ASN H 1 35 MET HA . . 5.330 4.372 4.012 4.731 . 0 0 "[ . 1 . 2]" 1
916 1 34 ASN H 1 35 MET HB3 . . 5.010 4.114 3.533 4.547 . 0 0 "[ . 1 . 2]" 1
917 1 34 ASN HA 1 35 MET HA . . 4.570 4.643 4.500 4.661 0.091 7 0 "[ . 1 . 2]" 1
918 1 34 ASN HA 1 36 TYR QD . . 3.670 3.289 2.527 3.769 0.099 7 0 "[ . 1 . 2]" 1
919 1 34 ASN HA 1 36 TYR QE . . 3.350 2.527 2.075 2.917 . 0 0 "[ . 1 . 2]" 1
920 1 34 ASN HA 1 37 ARG QD . . 5.020 3.425 2.433 4.560 . 0 0 "[ . 1 . 2]" 1
921 1 34 ASN HA 1 37 ARG HG3 . . 5.500 3.977 2.519 5.568 0.068 18 0 "[ . 1 . 2]" 1
922 1 34 ASN QB 1 35 MET H . . 4.700 3.691 3.375 4.076 . 0 0 "[ . 1 . 2]" 1
923 1 34 ASN QB 1 35 MET HA . . 5.500 4.165 3.801 4.676 . 0 0 "[ . 1 . 2]" 1
924 1 34 ASN QB 1 36 TYR QE . . 5.160 4.238 3.688 4.693 . 0 0 "[ . 1 . 2]" 1
925 1 34 ASN QB 1 37 ARG QD . . 5.220 2.836 2.028 3.611 . 0 0 "[ . 1 . 2]" 1
926 1 34 ASN HD21 1 35 MET H . . 5.500 5.166 4.350 5.562 0.062 15 0 "[ . 1 . 2]" 1
927 1 35 MET H 1 35 MET HB2 . . 4.090 3.586 3.511 3.699 . 0 0 "[ . 1 . 2]" 1
928 1 35 MET H 1 35 MET HB3 . . 3.650 2.504 2.232 3.013 . 0 0 "[ . 1 . 2]" 1
929 1 35 MET H 1 35 MET ME . . 4.830 4.443 3.712 4.818 . 0 0 "[ . 1 . 2]" 1
930 1 35 MET H 1 35 MET QG . . 3.670 2.277 1.910 2.668 . 0 0 "[ . 1 . 2]" 1
931 1 35 MET H 1 36 TYR H . . 4.470 2.914 2.133 3.237 . 0 0 "[ . 1 . 2]" 1
932 1 35 MET H 1 36 TYR QD . . 5.500 3.494 2.626 4.124 . 0 0 "[ . 1 . 2]" 1
933 1 35 MET H 1 36 TYR QE . . 5.390 4.432 3.618 5.013 . 0 0 "[ . 1 . 2]" 1
934 1 35 MET H 1 38 TYR QE . . 5.090 4.713 4.155 5.174 0.084 11 0 "[ . 1 . 2]" 1
935 1 35 MET HA 1 37 ARG H . . 4.900 3.755 3.362 4.054 . 0 0 "[ . 1 . 2]" 1
936 1 35 MET HA 1 38 TYR H . . 4.520 3.967 3.520 4.424 . 0 0 "[ . 1 . 2]" 1
937 1 35 MET HA 1 38 TYR QD . . 2.960 2.743 2.277 3.045 0.085 2 0 "[ . 1 . 2]" 1
938 1 35 MET HA 1 38 TYR QE . . 3.720 2.647 2.144 3.339 . 0 0 "[ . 1 . 2]" 1
939 1 35 MET HB2 1 35 MET ME . . 3.120 2.527 2.064 3.234 0.114 1 0 "[ . 1 . 2]" 1
940 1 35 MET HB2 1 36 TYR H . . 5.210 4.191 3.824 4.422 . 0 0 "[ . 1 . 2]" 1
941 1 35 MET HB3 1 35 MET ME . . 4.620 2.902 2.439 3.481 . 0 0 "[ . 1 . 2]" 1
942 1 35 MET HB3 1 36 TYR H . . 4.740 4.314 3.996 4.575 . 0 0 "[ . 1 . 2]" 1
943 1 35 MET ME 1 35 MET QG . . 2.640 2.219 1.920 2.630 . 0 0 "[ . 1 . 2]" 1
944 1 35 MET ME 1 36 TYR QD . . 5.500 5.575 5.100 5.643 0.143 14 0 "[ . 1 . 2]" 1
945 1 35 MET QG 1 36 TYR H . . 4.260 2.760 2.203 3.809 . 0 0 "[ . 1 . 2]" 1
946 1 35 MET QG 1 36 TYR HA . . 5.480 3.591 3.192 4.354 . 0 0 "[ . 1 . 2]" 1
947 1 35 MET QG 1 36 TYR HB2 . . 5.500 4.852 4.462 5.315 . 0 0 "[ . 1 . 2]" 1
948 1 35 MET QG 1 36 TYR QD . . 4.150 3.276 2.734 3.774 . 0 0 "[ . 1 . 2]" 1
949 1 36 TYR H 1 36 TYR HB3 . . 3.590 2.650 2.302 3.233 . 0 0 "[ . 1 . 2]" 1
950 1 36 TYR H 1 36 TYR QD . . 2.850 2.121 1.746 2.941 0.091 16 0 "[ . 1 . 2]" 1
951 1 36 TYR H 1 36 TYR QE . . 4.770 3.889 3.676 4.163 . 0 0 "[ . 1 . 2]" 1
952 1 36 TYR H 1 37 ARG HE . . 5.370 5.262 4.064 5.463 0.093 10 0 "[ . 1 . 2]" 1
953 1 36 TYR H 1 37 ARG HG3 . . 5.500 4.501 3.725 5.549 0.049 18 0 "[ . 1 . 2]" 1
954 1 36 TYR HA 1 36 TYR QD . . 4.560 3.754 3.732 3.790 . 0 0 "[ . 1 . 2]" 1
955 1 36 TYR HA 1 38 TYR H . . 4.750 4.015 3.496 4.517 . 0 0 "[ . 1 . 2]" 1
956 1 36 TYR QD 1 37 ARG HA . . 5.500 3.303 2.861 3.983 . 0 0 "[ . 1 . 2]" 1
957 1 36 TYR QD 1 37 ARG QD . . 4.620 4.018 3.293 4.490 . 0 0 "[ . 1 . 2]" 1
958 1 36 TYR QD 1 37 ARG HE . . 4.300 4.013 2.716 4.403 0.103 4 0 "[ . 1 . 2]" 1
959 1 36 TYR QD 1 37 ARG HG3 . . 4.290 3.516 2.578 4.397 0.107 13 0 "[ . 1 . 2]" 1
960 1 36 TYR QE 1 37 ARG H . . 5.500 4.307 4.048 4.699 . 0 0 "[ . 1 . 2]" 1
961 1 36 TYR QE 1 37 ARG HA . . 4.910 4.287 3.679 4.906 . 0 0 "[ . 1 . 2]" 1
962 1 36 TYR QE 1 37 ARG QD . . 4.240 3.230 2.376 3.967 . 0 0 "[ . 1 . 2]" 1
963 1 36 TYR QE 1 37 ARG HE . . 5.280 2.845 2.137 4.093 . 0 0 "[ . 1 . 2]" 1
964 1 36 TYR QE 1 37 ARG HG2 . . 3.870 3.369 2.451 3.948 0.078 18 0 "[ . 1 . 2]" 1
965 1 36 TYR QE 1 37 ARG HG3 . . 4.050 3.150 2.383 4.130 0.080 10 0 "[ . 1 . 2]" 1
966 1 37 ARG H 1 37 ARG HB2 . . 3.580 2.505 2.250 2.664 . 0 0 "[ . 1 . 2]" 1
967 1 37 ARG H 1 37 ARG HB3 . . 4.140 3.589 3.469 3.709 . 0 0 "[ . 1 . 2]" 1
968 1 37 ARG H 1 37 ARG QD . . 4.690 3.337 2.099 4.217 . 0 0 "[ . 1 . 2]" 1
969 1 37 ARG H 1 37 ARG HG2 . . 4.890 3.295 2.132 4.259 . 0 0 "[ . 1 . 2]" 1
970 1 37 ARG H 1 37 ARG HG3 . . 3.820 2.832 2.085 3.394 . 0 0 "[ . 1 . 2]" 1
971 1 37 ARG H 1 38 TYR H . . 3.440 2.534 2.190 2.726 . 0 0 "[ . 1 . 2]" 1
972 1 37 ARG HA 1 37 ARG HE . . 5.250 4.433 2.474 5.337 0.087 15 0 "[ . 1 . 2]" 1
973 1 37 ARG HA 1 37 ARG HG2 . . 3.630 3.008 2.448 3.605 . 0 0 "[ . 1 . 2]" 1
974 1 37 ARG HA 1 37 ARG HG3 . . 4.090 3.068 2.272 3.886 . 0 0 "[ . 1 . 2]" 1
975 1 37 ARG HA 1 79 PHE HZ . . 5.380 4.277 3.682 5.408 0.028 18 0 "[ . 1 . 2]" 1
976 1 37 ARG HB2 1 38 TYR H . . 4.500 2.863 2.442 3.414 . 0 0 "[ . 1 . 2]" 1
977 1 37 ARG HB2 1 38 TYR QD . . 5.500 3.660 3.326 4.070 . 0 0 "[ . 1 . 2]" 1
978 1 37 ARG HB3 1 37 ARG HE . . 5.070 4.373 3.271 5.135 0.065 9 0 "[ . 1 . 2]" 1
979 1 37 ARG HB3 1 38 TYR H . . 5.040 3.866 3.587 4.281 . 0 0 "[ . 1 . 2]" 1
980 1 37 ARG HB3 1 38 TYR QD . . 5.500 4.286 3.852 4.755 . 0 0 "[ . 1 . 2]" 1
981 1 37 ARG HB3 1 79 PHE QE . . 4.130 2.531 2.098 3.763 . 0 0 "[ . 1 . 2]" 1
982 1 37 ARG HB3 1 79 PHE HZ . . 3.910 2.779 2.151 3.954 0.044 16 0 "[ . 1 . 2]" 1
983 1 37 ARG HG2 1 79 PHE QE . . 4.960 4.387 3.009 5.065 0.105 16 0 "[ . 1 . 2]" 1
984 1 37 ARG HG3 1 38 TYR H . . 5.500 4.663 4.157 5.348 . 0 0 "[ . 1 . 2]" 1
985 1 37 ARG QH2 1 79 PHE QD . . 4.370 6.172 3.670 7.059 2.689 8 18 "[*-* ***+********* **]" 1
986 1 38 TYR H 1 38 TYR QB . . 3.500 2.518 2.353 2.696 . 0 0 "[ . 1 . 2]" 1
987 1 38 TYR H 1 38 TYR QD . . 4.380 3.092 2.942 3.275 . 0 0 "[ . 1 . 2]" 1
988 1 38 TYR H 1 38 TYR QE . . 5.500 4.334 4.122 4.608 . 0 0 "[ . 1 . 2]" 1
989 1 38 TYR HA 1 38 TYR QD . . 2.750 2.354 2.158 2.678 . 0 0 "[ . 1 . 2]" 1
990 1 38 TYR HA 1 38 TYR QE . . 5.300 4.584 4.351 4.850 . 0 0 "[ . 1 . 2]" 1
991 1 38 TYR HA 1 39 PRO HD2 . . 3.970 2.596 2.335 2.862 . 0 0 "[ . 1 . 2]" 1
992 1 38 TYR HA 1 39 PRO HD3 . . 3.630 2.235 2.055 2.395 . 0 0 "[ . 1 . 2]" 1
993 1 38 TYR HA 1 39 PRO HG2 . . 5.500 4.624 4.511 4.732 . 0 0 "[ . 1 . 2]" 1
994 1 38 TYR HA 1 39 PRO HG3 . . 5.430 4.460 4.233 4.661 . 0 0 "[ . 1 . 2]" 1
995 1 38 TYR HA 1 68 HIS HE1 . . 4.850 3.675 3.088 4.599 . 0 0 "[ . 1 . 2]" 1
996 1 38 TYR HA 1 79 PHE QE . . 4.460 4.187 3.581 4.545 0.085 12 0 "[ . 1 . 2]" 1
997 1 38 TYR HA 1 87 MET ME . . 5.500 5.267 4.591 5.602 0.102 19 0 "[ . 1 . 2]" 1
998 1 38 TYR QB 1 39 PRO HD3 . . 4.930 3.521 3.158 4.076 . 0 0 "[ . 1 . 2]" 1
999 1 38 TYR QB 1 68 HIS HE1 . . 5.400 4.004 2.941 5.057 . 0 0 "[ . 1 . 2]" 1
1000 1 38 TYR QB 1 90 VAL QG . . 4.170 2.036 1.893 2.234 . 0 0 "[ . 1 . 2]" 1
1001 1 38 TYR QD 1 39 PRO HD2 . . 5.080 3.979 3.620 4.199 . 0 0 "[ . 1 . 2]" 1
1002 1 38 TYR QD 1 39 PRO HD3 . . 4.910 4.025 3.641 4.465 . 0 0 "[ . 1 . 2]" 1
1003 1 38 TYR QD 1 79 PHE QD . . 4.590 4.293 3.596 4.692 0.102 16 0 "[ . 1 . 2]" 1
1004 1 38 TYR QD 1 79 PHE QE . . 4.460 3.092 2.470 4.326 . 0 0 "[ . 1 . 2]" 1
1005 1 38 TYR QD 1 83 ASP HB3 . . 5.300 4.683 4.432 4.986 . 0 0 "[ . 1 . 2]" 1
1006 1 38 TYR QD 1 87 MET H . . 4.660 4.655 3.996 4.756 0.096 19 0 "[ . 1 . 2]" 1
1007 1 38 TYR QD 1 87 MET HB3 . . 3.780 2.715 2.042 3.059 . 0 0 "[ . 1 . 2]" 1
1008 1 38 TYR QD 1 87 MET ME . . 4.880 3.976 3.021 4.291 . 0 0 "[ . 1 . 2]" 1
1009 1 38 TYR QD 1 87 MET QG . . 5.340 3.908 3.164 4.397 . 0 0 "[ . 1 . 2]" 1
1010 1 38 TYR QD 1 90 VAL H . . 5.500 5.585 5.537 5.608 0.108 10 0 "[ . 1 . 2]" 1
1011 1 38 TYR QD 1 90 VAL HB . . 4.400 4.171 3.963 4.330 . 0 0 "[ . 1 . 2]" 1
1012 1 38 TYR QD 1 90 VAL QG . . 3.300 2.227 2.101 2.678 . 0 0 "[ . 1 . 2]" 1
1013 1 38 TYR QD 1 91 VAL MG2 . . 5.500 4.875 4.613 5.299 . 0 0 "[ . 1 . 2]" 1
1014 1 38 TYR QE 1 79 PHE QD . . 3.860 2.874 2.317 3.963 0.103 16 0 "[ . 1 . 2]" 1
1015 1 38 TYR QE 1 79 PHE QE . . 5.090 2.689 2.354 4.545 . 0 0 "[ . 1 . 2]" 1
1016 1 38 TYR QE 1 83 ASP HA . . 4.060 3.748 3.438 4.109 0.049 2 0 "[ . 1 . 2]" 1
1017 1 38 TYR QE 1 83 ASP HB2 . . 5.500 4.121 3.880 4.837 . 0 0 "[ . 1 . 2]" 1
1018 1 38 TYR QE 1 83 ASP HB3 . . 3.220 2.490 2.208 3.280 0.060 16 0 "[ . 1 . 2]" 1
1019 1 38 TYR QE 1 86 MET H . . 5.140 5.077 4.294 5.231 0.091 8 0 "[ . 1 . 2]" 1
1020 1 38 TYR QE 1 86 MET HB2 . . 3.600 3.220 2.838 3.686 0.086 6 0 "[ . 1 . 2]" 1
1021 1 38 TYR QE 1 86 MET HB3 . . 5.020 3.734 3.040 4.072 . 0 0 "[ . 1 . 2]" 1
1022 1 38 TYR QE 1 87 MET H . . 4.470 3.796 2.716 4.040 . 0 0 "[ . 1 . 2]" 1
1023 1 38 TYR QE 1 87 MET HB3 . . 3.350 2.908 2.481 3.396 0.046 3 0 "[ . 1 . 2]" 1
1024 1 38 TYR QE 1 87 MET ME . . 4.070 4.063 3.512 4.222 0.152 16 0 "[ . 1 . 2]" 1
1025 1 38 TYR QE 1 87 MET QG . . 5.300 3.444 2.980 4.215 . 0 0 "[ . 1 . 2]" 1
1026 1 38 TYR QE 1 90 VAL HB . . 5.500 5.409 5.006 5.607 0.107 6 0 "[ . 1 . 2]" 1
1027 1 38 TYR QE 1 90 VAL QG . . 3.700 3.278 3.019 3.614 . 0 0 "[ . 1 . 2]" 1
1028 1 39 PRO HA 1 40 ASN H . . 2.990 2.442 2.172 2.685 . 0 0 "[ . 1 . 2]" 1
1029 1 39 PRO HA 1 41 GLN H . . 4.010 3.939 3.647 4.088 0.078 12 0 "[ . 1 . 2]" 1
1030 1 39 PRO HA 1 94 MET ME . . 4.920 4.839 4.393 5.020 0.100 9 0 "[ . 1 . 2]" 1
1031 1 39 PRO HB2 1 40 ASN H . . 4.300 3.066 2.770 3.438 . 0 0 "[ . 1 . 2]" 1
1032 1 39 PRO HB2 1 41 GLN H . . 3.600 2.201 1.872 2.443 . 0 0 "[ . 1 . 2]" 1
1033 1 39 PRO HB2 1 64 THR MG . . 3.960 3.693 3.010 4.046 0.086 4 0 "[ . 1 . 2]" 1
1034 1 39 PRO HB2 1 91 VAL MG2 . . 4.700 4.234 3.553 4.707 0.007 6 0 "[ . 1 . 2]" 1
1035 1 39 PRO HB3 1 40 ASN H . . 3.910 3.508 3.018 3.966 0.056 9 0 "[ . 1 . 2]" 1
1036 1 39 PRO HB3 1 41 GLN H . . 4.210 3.694 2.778 4.133 . 0 0 "[ . 1 . 2]" 1
1037 1 39 PRO HB3 1 64 THR MG . . 5.500 4.473 3.700 4.987 . 0 0 "[ . 1 . 2]" 1
1038 1 39 PRO HB3 1 91 VAL MG2 . . 5.270 5.207 4.767 5.371 0.101 19 0 "[ . 1 . 2]" 1
1039 1 39 PRO HD2 1 64 THR MG . . 5.500 4.299 4.007 4.847 . 0 0 "[ . 1 . 2]" 1
1040 1 39 PRO HD2 1 68 HIS HD2 . . 4.250 3.807 3.267 4.249 . 0 0 "[ . 1 . 2]" 1
1041 1 39 PRO HD2 1 90 VAL QG . . 5.500 3.525 3.102 3.936 . 0 0 "[ . 1 . 2]" 1
1042 1 39 PRO HD2 1 91 VAL HA . . 5.500 5.513 4.998 5.586 0.086 9 0 "[ . 1 . 2]" 1
1043 1 39 PRO HD2 1 91 VAL MG2 . . 4.870 3.054 2.900 3.348 . 0 0 "[ . 1 . 2]" 1
1044 1 39 PRO HD3 1 68 HIS HD2 . . 5.200 3.855 3.253 4.704 . 0 0 "[ . 1 . 2]" 1
1045 1 39 PRO HD3 1 68 HIS HE1 . . 4.700 3.929 3.146 4.458 . 0 0 "[ . 1 . 2]" 1
1046 1 39 PRO HD3 1 79 PHE QE . . 4.950 4.829 4.521 5.061 0.111 18 0 "[ . 1 . 2]" 1
1047 1 39 PRO HD3 1 90 VAL QG . . 5.500 4.790 4.364 5.203 . 0 0 "[ . 1 . 2]" 1
1048 1 39 PRO HD3 1 91 VAL MG2 . . 5.380 4.325 4.085 4.710 . 0 0 "[ . 1 . 2]" 1
1049 1 39 PRO HG2 1 68 HIS HB3 . . 5.500 3.739 3.095 4.054 . 0 0 "[ . 1 . 2]" 1
1050 1 39 PRO HG2 1 68 HIS HD2 . . 5.500 3.092 2.386 3.432 . 0 0 "[ . 1 . 2]" 1
1051 1 39 PRO HG2 1 90 VAL QG . . 4.710 4.583 3.801 4.746 0.036 15 0 "[ . 1 . 2]" 1
1052 1 39 PRO HG2 1 91 VAL MG2 . . 4.500 2.911 2.460 3.262 . 0 0 "[ . 1 . 2]" 1
1053 1 39 PRO HG3 1 40 ASN H . . 5.500 5.380 5.054 5.591 0.091 9 0 "[ . 1 . 2]" 1
1054 1 39 PRO HG3 1 68 HIS H . . 5.500 4.448 3.907 5.314 . 0 0 "[ . 1 . 2]" 1
1055 1 39 PRO HG3 1 68 HIS HA . . 4.590 4.672 4.644 4.683 0.093 8 0 "[ . 1 . 2]" 1
1056 1 39 PRO HG3 1 68 HIS HB2 . . 5.500 3.194 2.687 3.496 . 0 0 "[ . 1 . 2]" 1
1057 1 39 PRO HG3 1 68 HIS HB3 . . 5.500 2.396 2.222 2.741 . 0 0 "[ . 1 . 2]" 1
1058 1 39 PRO HG3 1 68 HIS HD2 . . 4.020 3.062 2.456 4.084 0.064 4 0 "[ . 1 . 2]" 1
1059 1 39 PRO HG3 1 91 VAL MG2 . . 5.290 4.197 3.512 4.705 . 0 0 "[ . 1 . 2]" 1
1060 1 40 ASN H 1 40 ASN HD21 . . 5.500 4.733 3.283 5.215 . 0 0 "[ . 1 . 2]" 1
1061 1 40 ASN H 1 41 GLN H . . 3.060 2.619 2.265 2.899 . 0 0 "[ . 1 . 2]" 1
1062 1 40 ASN H 1 94 MET ME . . 4.580 4.097 3.629 4.483 . 0 0 "[ . 1 . 2]" 1
1063 1 40 ASN HA 1 94 MET ME . . 3.920 2.670 2.104 3.176 . 0 0 "[ . 1 . 2]" 1
1064 1 40 ASN QB 1 41 GLN H . . 5.500 4.050 3.730 4.145 . 0 0 "[ . 1 . 2]" 1
1065 1 40 ASN HD22 1 41 GLN HE21 . . 5.500 5.494 4.134 6.287 0.787 19 3 "[ - 1 . +*]" 1
1066 1 41 GLN H 1 42 VAL H . . 5.110 4.415 4.346 4.496 . 0 0 "[ . 1 . 2]" 1
1067 1 41 GLN H 1 42 VAL QG . . 5.220 3.857 3.511 4.804 . 0 0 "[ . 1 . 2]" 1
1068 1 41 GLN H 1 64 THR MG . . 5.500 4.187 3.680 4.630 . 0 0 "[ . 1 . 2]" 1
1069 1 41 GLN H 1 94 MET HB2 . . 5.120 5.146 4.942 5.209 0.089 19 0 "[ . 1 . 2]" 1
1070 1 41 GLN H 1 94 MET HB3 . . 5.480 5.419 4.977 5.560 0.080 4 0 "[ . 1 . 2]" 1
1071 1 41 GLN H 1 94 MET ME . . 4.090 2.442 2.018 2.806 . 0 0 "[ . 1 . 2]" 1
1072 1 41 GLN HA 1 41 GLN HE21 . . 5.140 2.616 2.008 3.041 . 0 0 "[ . 1 . 2]" 1
1073 1 41 GLN HA 1 41 GLN HG2 . . 3.770 3.120 2.621 3.668 . 0 0 "[ . 1 . 2]" 1
1074 1 41 GLN HA 1 42 VAL H . . 3.200 2.362 2.045 2.570 . 0 0 "[ . 1 . 2]" 1
1075 1 41 GLN HA 1 42 VAL QG . . 4.960 3.041 2.743 3.927 . 0 0 "[ . 1 . 2]" 1
1076 1 41 GLN HA 1 94 MET HB2 . . 4.820 4.113 3.668 4.326 . 0 0 "[ . 1 . 2]" 1
1077 1 41 GLN HA 1 94 MET HB3 . . 4.070 3.739 3.338 4.145 0.075 11 0 "[ . 1 . 2]" 1
1078 1 41 GLN HB2 1 41 GLN HE22 . . 5.390 5.062 4.705 5.272 . 0 0 "[ . 1 . 2]" 1
1079 1 41 GLN HB2 1 42 VAL H . . 4.430 4.101 3.548 4.318 . 0 0 "[ . 1 . 2]" 1
1080 1 41 GLN HB3 1 42 VAL H . . 4.290 2.897 2.292 3.279 . 0 0 "[ . 1 . 2]" 1
1081 1 41 GLN HB3 1 64 THR MG . . 4.890 4.652 4.194 5.274 0.384 19 0 "[ . 1 . 2]" 1
1082 1 41 GLN HE21 1 94 MET HB3 . . 4.410 4.574 4.433 4.695 0.285 13 0 "[ . 1 . 2]" 1
1083 1 41 GLN HE22 1 94 MET HB3 . . 4.610 4.336 3.915 4.678 0.068 16 0 "[ . 1 . 2]" 1
1084 1 42 VAL H 1 42 VAL QG . . 3.440 2.297 2.114 2.640 . 0 0 "[ . 1 . 2]" 1
1085 1 42 VAL H 1 64 THR MG . . 5.500 4.315 4.188 4.535 . 0 0 "[ . 1 . 2]" 1
1086 1 42 VAL H 1 94 MET HB2 . . 5.500 4.626 4.054 5.098 . 0 0 "[ . 1 . 2]" 1
1087 1 42 VAL H 1 94 MET ME . . 4.930 4.087 3.572 4.688 . 0 0 "[ . 1 . 2]" 1
1088 1 42 VAL HA 1 43 TYR H . . 3.190 2.261 2.133 2.374 . 0 0 "[ . 1 . 2]" 1
1089 1 42 VAL HA 1 43 TYR HB2 . . 5.470 4.734 4.629 4.960 . 0 0 "[ . 1 . 2]" 1
1090 1 42 VAL HA 1 43 TYR QD . . 4.520 4.052 3.620 4.392 . 0 0 "[ . 1 . 2]" 1
1091 1 42 VAL HA 1 43 TYR QE . . 4.910 4.719 4.022 4.989 0.079 16 0 "[ . 1 . 2]" 1
1092 1 42 VAL HA 1 64 THR MG . . 3.590 2.168 1.982 2.579 . 0 0 "[ . 1 . 2]" 1
1093 1 42 VAL HA 1 91 VAL MG1 . . 5.500 3.962 3.545 4.397 . 0 0 "[ . 1 . 2]" 1
1094 1 42 VAL HA 1 91 VAL MG2 . . 5.500 4.657 3.971 5.299 . 0 0 "[ . 1 . 2]" 1
1095 1 42 VAL HB 1 43 TYR H . . 3.340 2.792 2.450 3.444 0.104 10 0 "[ . 1 . 2]" 1
1096 1 42 VAL HB 1 44 TYR QD . . 5.500 4.952 3.640 5.605 0.105 10 0 "[ . 1 . 2]" 1
1097 1 42 VAL HB 1 64 THR H . . 5.100 5.081 4.532 5.211 0.111 10 0 "[ . 1 . 2]" 1
1098 1 42 VAL HB 1 64 THR HB . . 5.500 3.983 3.360 4.364 . 0 0 "[ . 1 . 2]" 1
1099 1 42 VAL HB 1 64 THR MG . . 4.230 3.324 2.607 3.910 . 0 0 "[ . 1 . 2]" 1
1100 1 42 VAL HB 1 91 VAL MG1 . . 5.500 3.518 2.653 4.101 . 0 0 "[ . 1 . 2]" 1
1101 1 42 VAL QG 1 43 TYR H . . 4.750 3.274 2.140 3.491 . 0 0 "[ . 1 . 2]" 1
1102 1 42 VAL QG 1 43 TYR HA . . 5.500 4.091 3.768 4.415 . 0 0 "[ . 1 . 2]" 1
1103 1 42 VAL QG 1 44 TYR HB2 . . 5.500 4.442 3.953 5.193 . 0 0 "[ . 1 . 2]" 1
1104 1 42 VAL QG 1 44 TYR HB3 . . 5.500 3.059 2.523 3.983 . 0 0 "[ . 1 . 2]" 1
1105 1 42 VAL QG 1 44 TYR QD . . 3.100 3.063 2.624 3.196 0.096 2 0 "[ . 1 . 2]" 1
1106 1 42 VAL QG 1 44 TYR QE . . 5.190 4.448 3.114 4.846 . 0 0 "[ . 1 . 2]" 1
1107 1 42 VAL QG 1 64 THR HB . . 5.500 3.276 2.203 3.870 . 0 0 "[ . 1 . 2]" 1
1108 1 42 VAL QG 1 64 THR MG . . 3.620 2.079 1.958 2.502 . 0 0 "[ . 1 . 2]" 1
1109 1 42 VAL QG 1 91 VAL H . . 5.500 5.034 4.568 5.404 . 0 0 "[ . 1 . 2]" 1
1110 1 42 VAL QG 1 91 VAL HA . . 4.070 2.931 2.319 3.504 . 0 0 "[ . 1 . 2]" 1
1111 1 42 VAL QG 1 91 VAL MG1 . . 3.750 2.034 1.906 2.243 . 0 0 "[ . 1 . 2]" 1
1112 1 42 VAL QG 1 94 MET H . . 4.880 3.729 3.446 4.099 . 0 0 "[ . 1 . 2]" 1
1113 1 42 VAL QG 1 94 MET HA . . 5.500 4.059 3.778 4.279 . 0 0 "[ . 1 . 2]" 1
1114 1 42 VAL QG 1 94 MET HB2 . . 3.780 2.079 1.959 2.336 . 0 0 "[ . 1 . 2]" 1
1115 1 42 VAL QG 1 94 MET HB3 . . 5.080 2.820 2.328 3.223 . 0 0 "[ . 1 . 2]" 1
1116 1 42 VAL QG 1 94 MET ME . . 3.310 2.013 1.842 3.067 . 0 0 "[ . 1 . 2]" 1
1117 1 42 VAL QG 1 94 MET QG . . 5.500 3.562 3.274 3.990 . 0 0 "[ . 1 . 2]" 1
1118 1 42 VAL QG 1 95 CYS H . . 4.390 2.585 2.313 2.813 . 0 0 "[ . 1 . 2]" 1
1119 1 42 VAL QG 1 95 CYS HA . . 3.860 2.162 1.985 2.432 . 0 0 "[ . 1 . 2]" 1
1120 1 42 VAL QG 1 95 CYS HB3 . . 5.500 3.613 3.363 3.828 . 0 0 "[ . 1 . 2]" 1
1121 1 42 VAL QG 1 97 THR MG . . 5.500 5.179 4.852 5.398 . 0 0 "[ . 1 . 2]" 1
1122 1 42 VAL QG 1 98 GLN H . . 5.500 4.191 3.917 4.329 . 0 0 "[ . 1 . 2]" 1
1123 1 42 VAL QG 1 98 GLN HA . . 5.500 5.160 4.780 5.434 . 0 0 "[ . 1 . 2]" 1
1124 1 42 VAL QG 1 98 GLN HB2 . . 4.390 3.166 2.725 3.531 . 0 0 "[ . 1 . 2]" 1
1125 1 42 VAL QG 1 98 GLN HB3 . . 5.030 3.449 3.096 3.642 . 0 0 "[ . 1 . 2]" 1
1126 1 42 VAL QG 1 98 GLN HG2 . . 4.260 3.539 3.085 3.903 . 0 0 "[ . 1 . 2]" 1
1127 1 42 VAL QG 1 98 GLN HG3 . . 5.270 4.228 2.933 4.903 . 0 0 "[ . 1 . 2]" 1
1128 1 42 VAL QG 1 99 TYR H . . 5.500 4.977 4.613 5.274 . 0 0 "[ . 1 . 2]" 1
1129 1 43 TYR H 1 43 TYR QD . . 3.420 2.951 2.633 3.372 . 0 0 "[ . 1 . 2]" 1
1130 1 43 TYR H 1 43 TYR QE . . 5.500 4.564 4.287 4.833 . 0 0 "[ . 1 . 2]" 1
1131 1 43 TYR H 1 44 TYR H . . 4.610 4.386 4.187 4.481 . 0 0 "[ . 1 . 2]" 1
1132 1 43 TYR H 1 63 ILE MG . . 5.500 4.250 3.671 4.683 . 0 0 "[ . 1 . 2]" 1
1133 1 43 TYR H 1 64 THR H . . 5.100 4.064 3.559 4.236 . 0 0 "[ . 1 . 2]" 1
1134 1 43 TYR H 1 64 THR HA . . 4.810 3.971 3.640 4.618 . 0 0 "[ . 1 . 2]" 1
1135 1 43 TYR H 1 64 THR HB . . 4.680 3.903 3.581 4.202 . 0 0 "[ . 1 . 2]" 1
1136 1 43 TYR H 1 64 THR MG . . 4.390 3.299 2.777 3.896 . 0 0 "[ . 1 . 2]" 1
1137 1 43 TYR H 1 91 VAL MG1 . . 5.500 4.734 4.172 5.183 . 0 0 "[ . 1 . 2]" 1
1138 1 43 TYR HA 1 43 TYR QD . . 3.810 2.606 2.322 2.803 . 0 0 "[ . 1 . 2]" 1
1139 1 43 TYR HA 1 44 TYR H . . 3.220 2.249 2.197 2.308 . 0 0 "[ . 1 . 2]" 1
1140 1 43 TYR HA 1 44 TYR QD . . 3.640 3.429 3.224 3.674 0.034 7 0 "[ . 1 . 2]" 1
1141 1 43 TYR HB2 1 44 TYR H . . 4.610 4.324 4.223 4.407 . 0 0 "[ . 1 . 2]" 1
1142 1 43 TYR HB2 1 63 ILE HB . . 4.850 3.891 3.125 4.189 . 0 0 "[ . 1 . 2]" 1
1143 1 43 TYR HB2 1 63 ILE QG . . 5.200 4.874 4.186 5.136 . 0 0 "[ . 1 . 2]" 1
1144 1 43 TYR HB2 1 63 ILE MG . . 3.750 2.695 2.299 3.164 . 0 0 "[ . 1 . 2]" 1
1145 1 43 TYR HB2 1 64 THR HA . . 5.080 4.286 3.806 4.838 . 0 0 "[ . 1 . 2]" 1
1146 1 43 TYR HB3 1 63 ILE MG . . 4.560 3.722 3.324 4.326 . 0 0 "[ . 1 . 2]" 1
1147 1 43 TYR QD 1 63 ILE MG . . 3.750 2.584 2.181 2.965 . 0 0 "[ . 1 . 2]" 1
1148 1 43 TYR QD 1 64 THR H . . 5.500 3.812 3.006 4.146 . 0 0 "[ . 1 . 2]" 1
1149 1 43 TYR QD 1 64 THR HA . . 3.110 2.367 2.161 2.619 . 0 0 "[ . 1 . 2]" 1
1150 1 43 TYR QD 1 64 THR HB . . 5.410 4.455 4.063 4.793 . 0 0 "[ . 1 . 2]" 1
1151 1 43 TYR QD 1 64 THR MG . . 4.430 3.485 2.860 3.957 . 0 0 "[ . 1 . 2]" 1
1152 1 43 TYR QD 1 67 GLN H . . 5.500 5.095 4.868 5.362 . 0 0 "[ . 1 . 2]" 1
1153 1 43 TYR QD 1 67 GLN HB2 . . 4.440 3.950 3.249 4.520 0.080 11 0 "[ . 1 . 2]" 1
1154 1 43 TYR QD 1 67 GLN HB3 . . 5.500 4.756 4.008 5.229 . 0 0 "[ . 1 . 2]" 1
1155 1 43 TYR QD 1 67 GLN HG2 . . 5.320 3.162 2.702 3.861 . 0 0 "[ . 1 . 2]" 1
1156 1 43 TYR QD 1 67 GLN HG3 . . 3.270 3.138 2.201 3.367 0.097 14 0 "[ . 1 . 2]" 1
1157 1 43 TYR QE 1 63 ILE MG . . 4.430 4.246 3.770 4.534 0.104 15 0 "[ . 1 . 2]" 1
1158 1 43 TYR QE 1 64 THR HA . . 3.660 3.020 2.380 3.339 . 0 0 "[ . 1 . 2]" 1
1159 1 43 TYR QE 1 64 THR MG . . 5.500 3.432 2.727 4.186 . 0 0 "[ . 1 . 2]" 1
1160 1 43 TYR QE 1 67 GLN H . . 4.870 4.888 4.717 4.973 0.103 11 0 "[ . 1 . 2]" 1
1161 1 43 TYR QE 1 67 GLN HB2 . . 3.670 2.729 2.388 3.241 . 0 0 "[ . 1 . 2]" 1
1162 1 43 TYR QE 1 67 GLN HB3 . . 3.520 3.051 2.220 3.595 0.075 19 0 "[ . 1 . 2]" 1
1163 1 43 TYR QE 1 67 GLN HG2 . . 3.780 3.242 2.752 3.864 0.084 8 0 "[ . 1 . 2]" 1
1164 1 43 TYR QE 1 67 GLN HG3 . . 3.360 2.476 2.054 3.050 . 0 0 "[ . 1 . 2]" 1
1165 1 44 TYR H 1 44 TYR QD . . 3.270 2.300 1.941 2.513 . 0 0 "[ . 1 . 2]" 1
1166 1 44 TYR H 1 44 TYR QE . . 4.270 4.072 3.853 4.232 . 0 0 "[ . 1 . 2]" 1
1167 1 44 TYR H 1 45 ARG H . . 5.500 4.511 4.457 4.626 . 0 0 "[ . 1 . 2]" 1
1168 1 44 TYR HA 1 45 ARG H . . 3.450 2.492 2.318 2.640 . 0 0 "[ . 1 . 2]" 1
1169 1 44 TYR HA 1 45 ARG HA . . 4.750 4.529 4.477 4.567 . 0 0 "[ . 1 . 2]" 1
1170 1 44 TYR HB2 1 45 ARG H . . 3.840 2.636 2.459 2.828 . 0 0 "[ . 1 . 2]" 1
1171 1 44 TYR HB2 1 56 PHE QE . . 4.020 3.324 2.940 3.562 . 0 0 "[ . 1 . 2]" 1
1172 1 44 TYR HB2 1 56 PHE HZ . . 3.560 3.339 2.752 3.633 0.073 3 0 "[ . 1 . 2]" 1
1173 1 44 TYR HB3 1 45 ARG H . . 4.390 3.997 3.874 4.151 . 0 0 "[ . 1 . 2]" 1
1174 1 44 TYR HB3 1 56 PHE QE . . 5.420 3.749 3.248 4.205 . 0 0 "[ . 1 . 2]" 1
1175 1 44 TYR HB3 1 56 PHE HZ . . 5.380 4.058 3.526 4.479 . 0 0 "[ . 1 . 2]" 1
1176 1 44 TYR QD 1 45 ARG H . . 3.970 3.308 2.946 3.723 . 0 0 "[ . 1 . 2]" 1
1177 1 44 TYR QD 1 46 PRO HA . . 4.900 3.379 2.752 4.098 . 0 0 "[ . 1 . 2]" 1
1178 1 44 TYR QD 1 47 VAL H . . 4.260 4.236 3.797 4.347 0.087 12 0 "[ . 1 . 2]" 1
1179 1 44 TYR QD 1 47 VAL QG . . 5.500 4.806 3.923 5.121 . 0 0 "[ . 1 . 2]" 1
1180 1 44 TYR QD 1 56 PHE QE . . 3.290 2.527 2.242 2.812 . 0 0 "[ . 1 . 2]" 1
1181 1 44 TYR QD 1 56 PHE HZ . . 3.800 2.563 2.228 2.839 . 0 0 "[ . 1 . 2]" 1
1182 1 44 TYR QD 1 102 GLU HG3 . . 4.140 3.800 3.270 4.225 0.085 20 0 "[ . 1 . 2]" 1
1183 1 44 TYR QE 1 46 PRO HA . . 5.040 2.891 2.166 3.585 . 0 0 "[ . 1 . 2]" 1
1184 1 44 TYR QE 1 47 VAL H . . 4.370 3.883 3.449 4.383 0.013 11 0 "[ . 1 . 2]" 1
1185 1 44 TYR QE 1 56 PHE QE . . 4.640 3.418 3.018 3.818 . 0 0 "[ . 1 . 2]" 1
1186 1 44 TYR QE 1 56 PHE HZ . . 4.510 3.401 2.874 3.931 . 0 0 "[ . 1 . 2]" 1
1187 1 44 TYR QE 1 102 GLU HG2 . . 5.500 3.832 3.170 4.363 . 0 0 "[ . 1 . 2]" 1
1188 1 44 TYR QE 1 102 GLU HG3 . . 3.560 2.478 2.302 2.979 . 0 0 "[ . 1 . 2]" 1
1189 1 45 ARG H 1 45 ARG HB2 . . 4.030 2.470 2.150 3.221 . 0 0 "[ . 1 . 2]" 1
1190 1 45 ARG H 1 45 ARG HG2 . . 5.380 3.770 3.118 4.696 . 0 0 "[ . 1 . 2]" 1
1191 1 45 ARG H 1 45 ARG HG3 . . 4.800 3.626 2.867 4.196 . 0 0 "[ . 1 . 2]" 1
1192 1 45 ARG H 1 46 PRO QD . . 5.500 4.424 4.313 4.527 . 0 0 "[ . 1 . 2]" 1
1193 1 45 ARG H 1 50 TYR QE . . 3.650 3.468 2.809 3.753 0.103 12 0 "[ . 1 . 2]" 1
1194 1 45 ARG H 1 56 PHE QE . . 4.930 4.543 4.106 4.991 0.061 9 0 "[ . 1 . 2]" 1
1195 1 45 ARG HA 1 45 ARG QD . . 4.890 3.613 2.335 4.082 . 0 0 "[ . 1 . 2]" 1
1196 1 45 ARG HA 1 45 ARG HG2 . . 4.170 2.412 2.105 2.738 . 0 0 "[ . 1 . 2]" 1
1197 1 45 ARG HA 1 46 PRO QD . . 3.520 2.235 2.005 2.396 . 0 0 "[ . 1 . 2]" 1
1198 1 45 ARG HA 1 46 PRO HG2 . . 5.310 4.838 4.601 5.012 . 0 0 "[ . 1 . 2]" 1
1199 1 45 ARG HA 1 50 TYR QE . . 4.800 4.385 4.083 4.706 . 0 0 "[ . 1 . 2]" 1
1200 1 45 ARG HB2 1 45 ARG HE . . 5.500 3.964 2.589 4.534 . 0 0 "[ . 1 . 2]" 1
1201 1 45 ARG HB2 1 46 PRO QD . . 4.090 3.491 2.909 3.967 . 0 0 "[ . 1 . 2]" 1
1202 1 45 ARG HB2 1 50 TYR QE . . 2.940 2.285 1.929 3.035 0.095 18 0 "[ . 1 . 2]" 1
1203 1 45 ARG HB3 1 45 ARG HE . . 5.460 3.258 2.392 4.110 . 0 0 "[ . 1 . 2]" 1
1204 1 45 ARG HB3 1 46 PRO QD . . 4.220 2.140 1.905 2.857 . 0 0 "[ . 1 . 2]" 1
1205 1 45 ARG HB3 1 50 TYR QE . . 3.410 2.557 1.897 3.517 0.107 5 0 "[ . 1 . 2]" 1
1206 1 45 ARG QD 1 46 PRO QD . . 5.500 3.256 2.354 3.929 . 0 0 "[ . 1 . 2]" 1
1207 1 45 ARG QD 1 49 GLN HE21 . . 5.500 2.688 1.954 3.491 . 0 0 "[ . 1 . 2]" 1
1208 1 45 ARG QD 1 49 GLN QG . . 4.940 4.191 3.484 4.718 . 0 0 "[ . 1 . 2]" 1
1209 1 45 ARG HE 1 49 GLN HE21 . . 4.660 3.543 1.981 4.720 0.060 6 0 "[ . 1 . 2]" 1
1210 1 45 ARG HE 1 49 GLN HE22 . . 5.500 3.509 2.327 4.996 . 0 0 "[ . 1 . 2]" 1
1211 1 45 ARG HG2 1 46 PRO QD . . 5.340 3.197 1.967 4.199 . 0 0 "[ . 1 . 2]" 1
1212 1 45 ARG HG2 1 50 TYR QE . . 4.690 4.623 4.143 4.764 0.074 8 0 "[ . 1 . 2]" 1
1213 1 45 ARG HG3 1 46 PRO QD . . 5.500 4.030 3.126 4.719 . 0 0 "[ . 1 . 2]" 1
1214 1 45 ARG HG3 1 50 TYR QE . . 4.650 4.172 3.082 4.761 0.111 18 0 "[ . 1 . 2]" 1
1215 1 46 PRO HA 1 47 VAL H . . 3.000 2.194 1.909 2.339 . 0 0 "[ . 1 . 2]" 1
1216 1 46 PRO HA 1 47 VAL HB . . 4.790 4.584 4.280 4.897 0.107 1 0 "[ . 1 . 2]" 1
1217 1 46 PRO HA 1 47 VAL QG . . 4.720 3.792 3.092 4.050 . 0 0 "[ . 1 . 2]" 1
1218 1 46 PRO HA 1 48 SER H . . 4.890 3.890 3.604 4.189 . 0 0 "[ . 1 . 2]" 1
1219 1 46 PRO HA 1 49 GLN QG . . 5.500 4.774 4.531 5.199 . 0 0 "[ . 1 . 2]" 1
1220 1 46 PRO HB2 1 47 VAL H . . 4.340 3.392 3.087 3.826 . 0 0 "[ . 1 . 2]" 1
1221 1 46 PRO HB2 1 47 VAL QG . . 5.340 4.291 3.972 4.653 . 0 0 "[ . 1 . 2]" 1
1222 1 46 PRO HB2 1 48 SER H . . 5.250 2.647 2.403 3.036 . 0 0 "[ . 1 . 2]" 1
1223 1 46 PRO HB2 1 49 GLN QG . . 4.980 3.691 3.169 4.274 . 0 0 "[ . 1 . 2]" 1
1224 1 46 PRO HB3 1 47 VAL H . . 4.750 3.827 3.628 4.073 . 0 0 "[ . 1 . 2]" 1
1225 1 46 PRO QD 1 47 VAL H . . 5.500 4.947 4.808 5.003 . 0 0 "[ . 1 . 2]" 1
1226 1 46 PRO QD 1 49 GLN HE21 . . 5.240 2.803 1.861 3.758 . 0 0 "[ . 1 . 2]" 1
1227 1 46 PRO QD 1 49 GLN HE22 . . 5.290 3.710 2.674 4.000 . 0 0 "[ . 1 . 2]" 1
1228 1 46 PRO QD 1 49 GLN QG . . 5.500 2.750 2.164 3.781 . 0 0 "[ . 1 . 2]" 1
1229 1 46 PRO QD 1 50 TYR QE . . 5.350 3.887 3.509 4.171 . 0 0 "[ . 1 . 2]" 1
1230 1 46 PRO HG2 1 49 GLN HE22 . . 5.500 4.497 3.609 4.885 . 0 0 "[ . 1 . 2]" 1
1231 1 46 PRO HG3 1 49 GLN HE21 . . 5.500 4.948 3.538 6.141 0.641 12 1 "[ . 1 + . 2]" 1
1232 1 46 PRO HG3 1 49 GLN HE22 . . 5.500 5.384 4.566 5.577 0.077 17 0 "[ . 1 . 2]" 1
1233 1 47 VAL H 1 47 VAL HB . . 3.430 2.642 2.452 3.023 . 0 0 "[ . 1 . 2]" 1
1234 1 47 VAL H 1 47 VAL QG . . 3.500 2.056 1.713 2.279 . 0 0 "[ . 1 . 2]" 1
1235 1 47 VAL H 1 48 SER H . . 4.040 2.782 2.615 3.034 . 0 0 "[ . 1 . 2]" 1
1236 1 47 VAL H 1 49 GLN H . . 5.500 4.549 4.265 4.946 . 0 0 "[ . 1 . 2]" 1
1237 1 47 VAL H 1 50 TYR QD . . 4.880 4.368 4.062 4.593 . 0 0 "[ . 1 . 2]" 1
1238 1 47 VAL H 1 50 TYR QE . . 5.280 5.259 4.857 5.376 0.096 9 0 "[ . 1 . 2]" 1
1239 1 47 VAL H 1 56 PHE QE . . 5.400 2.738 2.292 3.390 . 0 0 "[ . 1 . 2]" 1
1240 1 47 VAL HA 1 49 GLN QG . . 5.500 4.512 3.642 4.716 . 0 0 "[ . 1 . 2]" 1
1241 1 47 VAL HA 1 50 TYR H . . 4.140 3.200 2.687 3.840 . 0 0 "[ . 1 . 2]" 1
1242 1 47 VAL HA 1 50 TYR QD . . 2.960 2.087 1.901 2.331 . 0 0 "[ . 1 . 2]" 1
1243 1 47 VAL HA 1 56 PHE QD . . 4.020 2.551 2.108 2.998 . 0 0 "[ . 1 . 2]" 1
1244 1 47 VAL HA 1 56 PHE QE . . 4.470 3.471 3.202 3.752 . 0 0 "[ . 1 . 2]" 1
1245 1 47 VAL HA 1 99 TYR QD . . 4.800 4.767 4.357 4.892 0.092 5 0 "[ . 1 . 2]" 1
1246 1 47 VAL HA 1 99 TYR QE . . 4.780 4.543 4.266 4.830 0.050 18 0 "[ . 1 . 2]" 1
1247 1 47 VAL HB 1 48 SER H . . 4.670 4.066 2.681 4.508 . 0 0 "[ . 1 . 2]" 1
1248 1 47 VAL HB 1 50 TYR QD . . 4.550 4.313 3.885 4.651 0.101 3 0 "[ . 1 . 2]" 1
1249 1 47 VAL HB 1 56 PHE QE . . 4.260 2.910 2.380 4.371 0.111 12 0 "[ . 1 . 2]" 1
1250 1 47 VAL HB 1 99 TYR QD . . 4.730 3.657 3.009 4.844 0.114 12 0 "[ . 1 . 2]" 1
1251 1 47 VAL HB 1 99 TYR QE . . 4.050 3.805 3.385 4.168 0.118 1 0 "[ . 1 . 2]" 1
1252 1 47 VAL HB 1 102 GLU HB3 . . 4.770 3.496 2.443 4.823 0.053 12 0 "[ . 1 . 2]" 1
1253 1 47 VAL QG 1 48 SER H . . 4.470 2.876 2.540 3.294 . 0 0 "[ . 1 . 2]" 1
1254 1 47 VAL QG 1 48 SER HA . . 4.700 3.556 3.183 4.202 . 0 0 "[ . 1 . 2]" 1
1255 1 47 VAL QG 1 48 SER HB3 . . 5.500 4.367 3.808 5.114 . 0 0 "[ . 1 . 2]" 1
1256 1 47 VAL QG 1 49 GLN H . . 5.500 4.176 3.954 4.582 . 0 0 "[ . 1 . 2]" 1
1257 1 47 VAL QG 1 50 TYR H . . 5.500 3.576 3.209 4.126 . 0 0 "[ . 1 . 2]" 1
1258 1 47 VAL QG 1 50 TYR HB2 . . 5.500 2.584 2.130 3.290 . 0 0 "[ . 1 . 2]" 1
1259 1 47 VAL QG 1 50 TYR HB3 . . 4.800 3.789 2.965 4.678 . 0 0 "[ . 1 . 2]" 1
1260 1 47 VAL QG 1 50 TYR QD . . 3.990 3.469 3.227 3.659 . 0 0 "[ . 1 . 2]" 1
1261 1 47 VAL QG 1 51 SER HB2 . . 5.180 5.079 4.504 5.509 0.329 20 0 "[ . 1 . 2]" 1
1262 1 47 VAL QG 1 51 SER HB3 . . 5.500 5.190 4.628 5.502 0.002 5 0 "[ . 1 . 2]" 1
1263 1 47 VAL QG 1 56 PHE HB2 . . 4.740 3.369 2.585 3.812 . 0 0 "[ . 1 . 2]" 1
1264 1 47 VAL QG 1 56 PHE QD . . 4.190 2.857 2.217 3.250 . 0 0 "[ . 1 . 2]" 1
1265 1 47 VAL QG 1 56 PHE QE . . 3.890 3.092 1.974 3.583 . 0 0 "[ . 1 . 2]" 1
1266 1 47 VAL QG 1 99 TYR HA . . 4.750 4.005 3.250 4.333 . 0 0 "[ . 1 . 2]" 1
1267 1 47 VAL QG 1 99 TYR QD . . 3.210 2.953 2.111 3.242 0.032 14 0 "[ . 1 . 2]" 1
1268 1 47 VAL QG 1 99 TYR QE . . 3.060 2.075 1.780 2.458 . 0 0 "[ . 1 . 2]" 1
1269 1 47 VAL QG 1 102 GLU H . . 5.500 4.645 4.349 5.016 . 0 0 "[ . 1 . 2]" 1
1270 1 47 VAL QG 1 102 GLU HA . . 5.190 3.876 3.566 4.300 . 0 0 "[ . 1 . 2]" 1
1271 1 47 VAL QG 1 102 GLU HB2 . . 4.020 3.237 2.764 3.531 . 0 0 "[ . 1 . 2]" 1
1272 1 47 VAL QG 1 102 GLU HB3 . . 4.140 2.215 1.915 2.485 . 0 0 "[ . 1 . 2]" 1
1273 1 47 VAL QG 1 102 GLU HG2 . . 5.480 4.598 4.152 4.948 . 0 0 "[ . 1 . 2]" 1
1274 1 47 VAL QG 1 102 GLU HG3 . . 5.190 3.923 3.301 4.259 . 0 0 "[ . 1 . 2]" 1
1275 1 47 VAL QG 1 103 SER H . . 4.770 3.518 3.069 3.926 . 0 0 "[ . 1 . 2]" 1
1276 1 47 VAL QG 1 103 SER HA . . 3.880 2.447 2.112 2.814 . 0 0 "[ . 1 . 2]" 1
1277 1 47 VAL QG 1 103 SER QB . . 4.810 3.427 2.893 3.958 . 0 0 "[ . 1 . 2]" 1
1278 1 47 VAL QG 1 104 GLN H . . 5.500 4.937 4.231 5.321 . 0 0 "[ . 1 . 2]" 1
1279 1 47 VAL QG 1 106 TYR H . . 5.500 3.482 3.132 3.835 . 0 0 "[ . 1 . 2]" 1
1280 1 47 VAL QG 1 106 TYR HB2 . . 3.990 3.351 2.874 3.781 . 0 0 "[ . 1 . 2]" 1
1281 1 47 VAL QG 1 106 TYR HB3 . . 4.320 2.514 2.087 2.902 . 0 0 "[ . 1 . 2]" 1
1282 1 47 VAL QG 1 106 TYR QD . . 3.410 2.508 2.162 2.943 . 0 0 "[ . 1 . 2]" 1
1283 1 47 VAL QG 1 106 TYR QE . . 3.990 2.794 2.533 3.133 . 0 0 "[ . 1 . 2]" 1
1284 1 48 SER H 1 48 SER HB3 . . 4.040 2.637 2.390 2.928 . 0 0 "[ . 1 . 2]" 1
1285 1 48 SER H 1 49 GLN H . . 4.730 2.872 2.732 3.023 . 0 0 "[ . 1 . 2]" 1
1286 1 48 SER H 1 49 GLN HA . . 5.500 5.468 5.352 5.571 0.071 19 0 "[ . 1 . 2]" 1
1287 1 48 SER HA 1 49 GLN QG . . 5.100 4.769 4.438 4.942 . 0 0 "[ . 1 . 2]" 1
1288 1 48 SER HA 1 106 TYR HB2 . . 5.500 4.226 2.663 5.442 . 0 0 "[ . 1 . 2]" 1
1289 1 48 SER HA 1 106 TYR QE . . 4.280 3.479 2.324 4.364 0.084 14 0 "[ . 1 . 2]" 1
1290 1 48 SER HB2 1 49 GLN H . . 4.880 3.980 3.681 4.146 . 0 0 "[ . 1 . 2]" 1
1291 1 48 SER HB3 1 49 GLN H . . 5.380 3.854 2.630 4.540 . 0 0 "[ . 1 . 2]" 1
1292 1 48 SER HB3 1 106 TYR QD . . 4.910 4.003 2.288 5.484 0.574 6 3 "[ -.+ 1* . 2]" 1
1293 1 49 GLN H 1 49 GLN HB2 . . 4.140 2.843 2.488 3.433 . 0 0 "[ . 1 . 2]" 1
1294 1 49 GLN H 1 49 GLN HB3 . . 4.140 3.597 3.227 3.761 . 0 0 "[ . 1 . 2]" 1
1295 1 49 GLN H 1 49 GLN QG . . 3.390 2.161 1.749 2.401 . 0 0 "[ . 1 . 2]" 1
1296 1 49 GLN H 1 50 TYR H . . 3.790 2.472 2.279 2.712 . 0 0 "[ . 1 . 2]" 1
1297 1 49 GLN H 1 50 TYR QD . . 3.930 3.331 2.839 3.663 . 0 0 "[ . 1 . 2]" 1
1298 1 49 GLN H 1 50 TYR QE . . 4.740 4.506 4.151 4.826 0.086 10 0 "[ . 1 . 2]" 1
1299 1 49 GLN HA 1 49 GLN HE21 . . 5.390 5.268 4.947 5.457 0.067 18 0 "[ . 1 . 2]" 1
1300 1 49 GLN HA 1 49 GLN QG . . 3.930 2.851 2.629 3.272 . 0 0 "[ . 1 . 2]" 1
1301 1 49 GLN HB2 1 49 GLN HE22 . . 5.060 4.534 3.791 5.074 0.014 14 0 "[ . 1 . 2]" 1
1302 1 49 GLN HB2 1 50 TYR H . . 5.500 3.175 2.013 4.178 . 0 0 "[ . 1 . 2]" 1
1303 1 49 GLN HB2 1 50 TYR QD . . 4.050 3.283 2.612 4.144 0.094 12 0 "[ . 1 . 2]" 1
1304 1 49 GLN HB2 1 50 TYR QE . . 5.500 3.499 2.717 4.441 . 0 0 "[ . 1 . 2]" 1
1305 1 49 GLN HB3 1 50 TYR H . . 4.700 4.186 3.291 4.741 0.041 12 0 "[ . 1 . 2]" 1
1306 1 49 GLN HB3 1 50 TYR QE . . 5.500 4.814 3.878 5.520 0.020 4 0 "[ . 1 . 2]" 1
1307 1 49 GLN HE21 1 50 TYR QE . . 4.030 4.054 3.567 4.138 0.108 14 0 "[ . 1 . 2]" 1
1308 1 49 GLN QG 1 50 TYR H . . 5.450 3.830 2.487 4.251 . 0 0 "[ . 1 . 2]" 1
1309 1 49 GLN QG 1 50 TYR QD . . 4.780 3.683 2.367 4.072 . 0 0 "[ . 1 . 2]" 1
1310 1 49 GLN QG 1 50 TYR QE . . 5.500 3.396 2.781 3.953 . 0 0 "[ . 1 . 2]" 1
1311 1 50 TYR H 1 50 TYR HB2 . . 3.660 2.590 2.430 2.792 . 0 0 "[ . 1 . 2]" 1
1312 1 50 TYR H 1 50 TYR QD . . 3.350 2.729 2.200 3.409 0.059 4 0 "[ . 1 . 2]" 1
1313 1 50 TYR H 1 50 TYR QE . . 5.500 4.619 3.990 5.165 . 0 0 "[ . 1 . 2]" 1
1314 1 50 TYR H 1 51 SER H . . 5.060 4.196 2.357 4.617 . 0 0 "[ . 1 . 2]" 1
1315 1 50 TYR H 1 51 SER HA . . 5.500 4.869 3.897 5.421 . 0 0 "[ . 1 . 2]" 1
1316 1 50 TYR H 1 52 ASN H . . 5.500 5.421 4.591 5.584 0.084 18 0 "[ . 1 . 2]" 1
1317 1 50 TYR HA 1 50 TYR QD . . 3.250 2.931 2.528 3.325 0.075 17 0 "[ . 1 . 2]" 1
1318 1 50 TYR HA 1 51 SER HA . . 4.790 4.639 4.496 4.912 0.122 1 0 "[ . 1 . 2]" 1
1319 1 50 TYR HA 1 51 SER HB2 . . 5.420 5.119 4.351 5.728 0.308 2 0 "[ . 1 . 2]" 1
1320 1 50 TYR HA 1 52 ASN H . . 5.390 4.327 3.865 4.695 . 0 0 "[ . 1 . 2]" 1
1321 1 50 TYR HA 1 55 ASN HB2 . . 5.500 4.390 3.650 4.830 . 0 0 "[ . 1 . 2]" 1
1322 1 50 TYR HB2 1 52 ASN H . . 4.960 3.440 2.416 4.302 . 0 0 "[ . 1 . 2]" 1
1323 1 50 TYR HB3 1 52 ASN H . . 4.520 2.771 2.411 3.116 . 0 0 "[ . 1 . 2]" 1
1324 1 50 TYR HB3 1 55 ASN QD . . 5.500 4.002 2.913 4.966 . 0 0 "[ . 1 . 2]" 1
1325 1 50 TYR QD 1 51 SER H . . 4.470 3.830 3.378 4.218 . 0 0 "[ . 1 . 2]" 1
1326 1 50 TYR QD 1 55 ASN HA . . 4.310 4.288 4.027 4.408 0.098 7 0 "[ . 1 . 2]" 1
1327 1 50 TYR QD 1 55 ASN HB2 . . 3.340 2.535 1.952 3.412 0.072 1 0 "[ . 1 . 2]" 1
1328 1 50 TYR QD 1 55 ASN HB3 . . 3.290 2.692 2.040 3.460 0.170 18 0 "[ . 1 . 2]" 1
1329 1 50 TYR QD 1 56 PHE HB2 . . 4.220 3.864 3.532 4.106 . 0 0 "[ . 1 . 2]" 1
1330 1 50 TYR QD 1 99 TYR QE . . 5.360 5.346 4.946 5.488 0.128 12 0 "[ . 1 . 2]" 1
1331 1 50 TYR QE 1 55 ASN HA . . 4.350 4.422 4.164 4.459 0.109 20 0 "[ . 1 . 2]" 1
1332 1 50 TYR QE 1 56 PHE HB2 . . 5.060 4.840 4.453 5.131 0.071 9 0 "[ . 1 . 2]" 1
1333 1 50 TYR QE 1 56 PHE QE . . 4.920 4.856 4.455 5.026 0.106 17 0 "[ . 1 . 2]" 1
1334 1 51 SER H 1 52 ASN H . . 4.720 2.141 1.665 2.667 . 0 0 "[ . 1 . 2]" 1
1335 1 51 SER H 1 52 ASN HA . . 5.500 4.603 4.302 5.192 . 0 0 "[ . 1 . 2]" 1
1336 1 51 SER HB2 1 52 ASN H . . 4.760 4.509 3.366 4.789 0.029 7 0 "[ . 1 . 2]" 1
1337 1 51 SER HB3 1 52 ASN H . . 5.130 4.403 4.028 4.735 . 0 0 "[ . 1 . 2]" 1
1338 1 51 SER HB3 1 55 ASN QD . . 5.500 5.320 3.917 6.382 0.882 17 1 "[ . 1 . + 2]" 1
1339 1 52 ASN H 1 53 GLN H . . 5.500 4.312 4.214 4.507 . 0 0 "[ . 1 . 2]" 1
1340 1 52 ASN H 1 55 ASN H . . 5.500 4.477 3.972 5.037 . 0 0 "[ . 1 . 2]" 1
1341 1 52 ASN H 1 55 ASN HB2 . . 4.940 3.989 3.135 5.013 0.073 7 0 "[ . 1 . 2]" 1
1342 1 52 ASN HA 1 52 ASN HD22 . . 5.500 4.439 3.834 4.899 . 0 0 "[ . 1 . 2]" 1
1343 1 52 ASN HA 1 53 GLN H . . 3.100 2.494 2.227 2.961 . 0 0 "[ . 1 . 2]" 1
1344 1 52 ASN HA 1 53 GLN HA . . 4.970 4.389 4.190 4.592 . 0 0 "[ . 1 . 2]" 1
1345 1 52 ASN HA 1 53 GLN QB . . 4.880 4.213 3.974 4.538 . 0 0 "[ . 1 . 2]" 1
1346 1 52 ASN HA 1 54 LYS H . . 4.730 4.527 4.147 4.813 0.083 12 0 "[ . 1 . 2]" 1
1347 1 52 ASN HA 1 55 ASN QD . . 4.830 4.538 3.632 4.752 . 0 0 "[ . 1 . 2]" 1
1348 1 52 ASN HB2 1 53 GLN H . . 3.930 3.621 2.505 3.995 0.065 19 0 "[ . 1 . 2]" 1
1349 1 52 ASN HB2 1 54 LYS H . . 4.550 4.154 2.437 4.628 0.078 20 0 "[ . 1 . 2]" 1
1350 1 52 ASN HB3 1 53 GLN H . . 3.440 2.653 1.922 3.264 . 0 0 "[ . 1 . 2]" 1
1351 1 52 ASN HB3 1 53 GLN HA . . 4.160 4.312 4.243 4.634 0.474 2 0 "[ . 1 . 2]" 1
1352 1 52 ASN HB3 1 53 GLN QB . . 5.160 4.394 3.904 4.840 . 0 0 "[ . 1 . 2]" 1
1353 1 52 ASN HB3 1 54 LYS H . . 3.940 2.957 2.457 3.484 . 0 0 "[ . 1 . 2]" 1
1354 1 52 ASN HD21 1 53 GLN H . . 5.500 4.162 2.675 5.020 . 0 0 "[ . 1 . 2]" 1
1355 1 52 ASN HD21 1 54 LYS HB2 . . 5.500 4.554 2.914 5.910 0.410 7 0 "[ . 1 . 2]" 1
1356 1 52 ASN HD21 1 54 LYS HB3 . . 5.500 3.374 2.153 5.445 . 0 0 "[ . 1 . 2]" 1
1357 1 52 ASN HD21 1 55 ASN H . . 5.500 3.606 2.283 5.439 . 0 0 "[ . 1 . 2]" 1
1358 1 52 ASN HD21 1 55 ASN QD . . 5.200 3.006 1.922 4.391 . 0 0 "[ . 1 . 2]" 1
1359 1 52 ASN HD22 1 54 LYS H . . 5.500 4.334 2.791 5.581 0.081 2 0 "[ . 1 . 2]" 1
1360 1 52 ASN HD22 1 54 LYS HB3 . . 5.500 4.120 2.580 5.470 . 0 0 "[ . 1 . 2]" 1
1361 1 52 ASN HD22 1 55 ASN H . . 5.500 4.750 3.121 5.563 0.063 3 0 "[ . 1 . 2]" 1
1362 1 52 ASN HD22 1 55 ASN QD . . 4.880 3.893 2.398 4.807 . 0 0 "[ . 1 . 2]" 1
1363 1 53 GLN H 1 53 GLN QB . . 3.120 2.335 2.218 2.616 . 0 0 "[ . 1 . 2]" 1
1364 1 53 GLN H 1 53 GLN HG2 . . 5.250 4.574 4.329 4.675 . 0 0 "[ . 1 . 2]" 1
1365 1 53 GLN H 1 53 GLN HG3 . . 5.250 4.510 4.166 4.656 . 0 0 "[ . 1 . 2]" 1
1366 1 53 GLN H 1 54 LYS H . . 3.540 2.444 2.006 2.813 . 0 0 "[ . 1 . 2]" 1
1367 1 53 GLN H 1 55 ASN H . . 4.050 4.093 3.468 4.141 0.091 6 0 "[ . 1 . 2]" 1
1368 1 53 GLN H 1 57 VAL QG . . 5.500 5.269 4.910 5.393 . 0 0 "[ . 1 . 2]" 1
1369 1 53 GLN H 1 99 TYR QE . . 5.130 4.334 3.877 5.025 . 0 0 "[ . 1 . 2]" 1
1370 1 53 GLN HA 1 53 GLN HG2 . . 3.990 3.180 2.872 3.384 . 0 0 "[ . 1 . 2]" 1
1371 1 53 GLN HA 1 53 GLN HG3 . . 4.100 2.472 2.243 2.882 . 0 0 "[ . 1 . 2]" 1
1372 1 53 GLN HA 1 54 LYS HA . . 5.500 4.784 4.641 4.879 . 0 0 "[ . 1 . 2]" 1
1373 1 53 GLN HA 1 56 PHE H . . 5.500 3.497 3.078 3.931 . 0 0 "[ . 1 . 2]" 1
1374 1 53 GLN HA 1 56 PHE HB2 . . 5.500 3.765 3.162 4.244 . 0 0 "[ . 1 . 2]" 1
1375 1 53 GLN HA 1 56 PHE HB3 . . 4.260 2.904 2.615 3.645 . 0 0 "[ . 1 . 2]" 1
1376 1 53 GLN HA 1 57 VAL QG . . 4.970 3.375 3.116 3.694 . 0 0 "[ . 1 . 2]" 1
1377 1 53 GLN HA 1 99 TYR QD . . 5.170 3.580 3.296 3.888 . 0 0 "[ . 1 . 2]" 1
1378 1 53 GLN HA 1 99 TYR QE . . 3.300 3.146 2.958 3.338 0.038 16 0 "[ . 1 . 2]" 1
1379 1 53 GLN QB 1 53 GLN HE22 . . 5.020 3.935 3.663 4.183 . 0 0 "[ . 1 . 2]" 1
1380 1 53 GLN QB 1 54 LYS H . . 4.100 2.623 2.239 3.111 . 0 0 "[ . 1 . 2]" 1
1381 1 53 GLN QB 1 99 TYR QD . . 4.080 3.637 3.241 4.151 0.071 16 0 "[ . 1 . 2]" 1
1382 1 53 GLN QB 1 99 TYR QE . . 3.460 2.634 2.182 3.262 . 0 0 "[ . 1 . 2]" 1
1383 1 53 GLN QB 1 100 GLN HE21 . . 5.500 5.235 4.343 5.606 0.106 17 0 "[ . 1 . 2]" 1
1384 1 53 GLN HE21 1 57 VAL QG . . 4.520 3.431 2.753 4.520 . 5 0 "[ . 1 . 2]" 1
1385 1 53 GLN HE21 1 96 VAL QG . . 4.400 2.357 1.973 3.125 . 0 0 "[ . 1 . 2]" 1
1386 1 53 GLN HE21 1 99 TYR QD . . 5.030 3.358 1.962 5.112 0.082 12 0 "[ . 1 . 2]" 1
1387 1 53 GLN HE21 1 100 GLN HE21 . . 4.780 3.574 2.704 4.672 . 0 0 "[ . 1 . 2]" 1
1388 1 53 GLN HE21 1 100 GLN HE22 . . 4.910 4.668 4.040 4.993 0.083 4 0 "[ . 1 . 2]" 1
1389 1 53 GLN HE22 1 57 VAL QG . . 5.450 4.498 4.075 4.960 . 0 0 "[ . 1 . 2]" 1
1390 1 53 GLN HE22 1 96 VAL QG . . 4.410 2.522 2.100 3.104 . 0 0 "[ . 1 . 2]" 1
1391 1 53 GLN HE22 1 99 TYR QD . . 5.200 3.896 2.649 4.949 . 0 0 "[ . 1 . 2]" 1
1392 1 53 GLN HE22 1 100 GLN HE21 . . 4.060 2.724 1.735 4.093 0.033 19 0 "[ . 1 . 2]" 1
1393 1 53 GLN HE22 1 100 GLN HE22 . . 4.010 3.423 2.366 3.981 . 0 0 "[ . 1 . 2]" 1
1394 1 53 GLN HG2 1 54 LYS H . . 5.500 4.091 3.255 4.525 . 0 0 "[ . 1 . 2]" 1
1395 1 53 GLN HG2 1 54 LYS HA . . 5.500 4.151 3.163 4.572 . 0 0 "[ . 1 . 2]" 1
1396 1 53 GLN HG2 1 57 VAL QG . . 3.140 2.301 2.163 2.553 . 0 0 "[ . 1 . 2]" 1
1397 1 53 GLN HG2 1 96 VAL HA . . 5.500 4.174 3.966 4.801 . 0 0 "[ . 1 . 2]" 1
1398 1 53 GLN HG2 1 96 VAL QG . . 3.390 3.267 2.785 3.517 0.127 3 0 "[ . 1 . 2]" 1
1399 1 53 GLN HG2 1 99 TYR HB2 . . 5.500 4.881 4.424 5.623 0.123 3 0 "[ . 1 . 2]" 1
1400 1 53 GLN HG2 1 99 TYR HB3 . . 5.500 4.538 4.014 5.354 . 0 0 "[ . 1 . 2]" 1
1401 1 53 GLN HG2 1 99 TYR QD . . 3.870 4.001 3.953 4.412 0.542 3 1 "[ + . 1 . 2]" 1
1402 1 53 GLN HG2 1 99 TYR QE . . 5.500 4.586 4.301 4.830 . 0 0 "[ . 1 . 2]" 1
1403 1 53 GLN HG3 1 54 LYS H . . 5.430 4.836 4.218 5.085 . 0 0 "[ . 1 . 2]" 1
1404 1 53 GLN HG3 1 54 LYS HA . . 5.500 5.371 4.268 5.578 0.078 7 0 "[ . 1 . 2]" 1
1405 1 53 GLN HG3 1 57 VAL H . . 5.500 4.834 4.408 5.547 0.047 10 0 "[ . 1 . 2]" 1
1406 1 53 GLN HG3 1 57 VAL QG . . 4.130 2.714 2.446 3.284 . 0 0 "[ . 1 . 2]" 1
1407 1 53 GLN HG3 1 99 TYR HB3 . . 5.500 3.295 2.725 3.818 . 0 0 "[ . 1 . 2]" 1
1408 1 53 GLN HG3 1 99 TYR QD . . 4.540 2.533 2.320 2.851 . 0 0 "[ . 1 . 2]" 1
1409 1 53 GLN HG3 1 99 TYR QE . . 4.210 3.289 2.852 3.656 . 0 0 "[ . 1 . 2]" 1
1410 1 54 LYS H 1 54 LYS HB2 . . 3.090 2.476 2.256 2.997 . 0 0 "[ . 1 . 2]" 1
1411 1 54 LYS H 1 54 LYS HB3 . . 3.020 2.583 2.192 2.816 . 0 0 "[ . 1 . 2]" 1
1412 1 54 LYS H 1 54 LYS HG3 . . 4.920 4.540 4.053 4.662 . 0 0 "[ . 1 . 2]" 1
1413 1 54 LYS H 1 55 ASN H . . 3.470 2.928 2.711 3.135 . 0 0 "[ . 1 . 2]" 1
1414 1 54 LYS H 1 55 ASN HA . . 5.500 5.509 5.408 5.570 0.070 16 0 "[ . 1 . 2]" 1
1415 1 54 LYS H 1 57 VAL QG . . 5.500 4.562 3.734 4.821 . 0 0 "[ . 1 . 2]" 1
1416 1 54 LYS HA 1 54 LYS QD . . 4.590 3.278 2.694 3.687 . 0 0 "[ . 1 . 2]" 1
1417 1 54 LYS HA 1 54 LYS QE . . 5.500 4.595 4.018 5.055 . 0 0 "[ . 1 . 2]" 1
1418 1 54 LYS HA 1 55 ASN HA . . 4.860 4.742 4.607 4.862 0.002 1 0 "[ . 1 . 2]" 1
1419 1 54 LYS HA 1 56 PHE H . . 5.500 3.994 3.488 4.378 . 0 0 "[ . 1 . 2]" 1
1420 1 54 LYS HA 1 57 VAL H . . 4.510 3.307 2.668 3.574 . 0 0 "[ . 1 . 2]" 1
1421 1 54 LYS HA 1 57 VAL HA . . 5.500 5.381 4.732 5.579 0.079 3 0 "[ . 1 . 2]" 1
1422 1 54 LYS HA 1 57 VAL HB . . 3.930 2.813 2.282 4.026 0.096 12 0 "[ . 1 . 2]" 1
1423 1 54 LYS HA 1 57 VAL QG . . 4.520 3.463 1.883 3.844 . 0 0 "[ . 1 . 2]" 1
1424 1 54 LYS HA 1 58 HIS H . . 4.720 3.731 3.272 4.543 . 0 0 "[ . 1 . 2]" 1
1425 1 54 LYS HB2 1 55 ASN H . . 4.080 3.895 3.688 4.161 0.081 12 0 "[ . 1 . 2]" 1
1426 1 54 LYS HB3 1 55 ASN H . . 4.090 2.618 2.328 2.987 . 0 0 "[ . 1 . 2]" 1
1427 1 54 LYS QD 1 55 ASN HA . . 5.500 2.793 2.400 3.194 . 0 0 "[ . 1 . 2]" 1
1428 1 54 LYS QD 1 55 ASN HB3 . . 4.600 4.322 3.571 4.696 0.096 15 0 "[ . 1 . 2]" 1
1429 1 54 LYS QD 1 55 ASN QD . . 5.370 4.253 3.428 4.753 . 0 0 "[ . 1 . 2]" 1
1430 1 54 LYS QD 1 58 HIS QB . . 5.280 2.162 2.014 2.404 . 0 0 "[ . 1 . 2]" 1
1431 1 54 LYS QD 1 58 HIS HD2 . . 4.910 4.989 4.877 5.015 0.105 15 0 "[ . 1 . 2]" 1
1432 1 54 LYS QE 1 54 LYS HG2 . . 3.630 2.536 2.186 3.092 . 0 0 "[ . 1 . 2]" 1
1433 1 54 LYS QE 1 54 LYS HG3 . . 3.820 2.316 2.070 3.294 . 0 0 "[ . 1 . 2]" 1
1434 1 54 LYS QE 1 58 HIS QB . . 3.660 3.095 2.197 3.709 0.049 11 0 "[ . 1 . 2]" 1
1435 1 54 LYS HG2 1 55 ASN H . . 5.210 4.683 4.171 4.972 . 0 0 "[ . 1 . 2]" 1
1436 1 54 LYS HG2 1 55 ASN HA . . 5.500 5.063 4.550 5.571 0.071 7 0 "[ . 1 . 2]" 1
1437 1 54 LYS HG2 1 57 VAL HB . . 5.500 4.828 3.950 6.341 0.841 17 1 "[ . 1 . + 2]" 1
1438 1 54 LYS HG2 1 58 HIS QB . . 5.500 3.589 2.648 4.560 . 0 0 "[ . 1 . 2]" 1
1439 1 54 LYS HG3 1 55 ASN H . . 5.250 4.718 2.715 5.046 . 0 0 "[ . 1 . 2]" 1
1440 1 55 ASN H 1 55 ASN HB2 . . 3.370 2.960 2.476 3.781 0.411 18 0 "[ . 1 . 2]" 1
1441 1 55 ASN H 1 55 ASN HB3 . . 3.840 3.517 3.044 3.754 . 0 0 "[ . 1 . 2]" 1
1442 1 55 ASN H 1 55 ASN QD . . 4.710 3.213 2.290 3.860 . 0 0 "[ . 1 . 2]" 1
1443 1 55 ASN H 1 56 PHE H . . 3.840 2.754 2.494 2.856 . 0 0 "[ . 1 . 2]" 1
1444 1 55 ASN H 1 57 VAL H . . 5.290 4.282 4.058 4.548 . 0 0 "[ . 1 . 2]" 1
1445 1 55 ASN HA 1 57 VAL H . . 5.500 4.505 3.967 4.927 . 0 0 "[ . 1 . 2]" 1
1446 1 55 ASN HA 1 58 HIS H . . 4.280 3.834 3.159 4.087 . 0 0 "[ . 1 . 2]" 1
1447 1 55 ASN HA 1 58 HIS QB . . 4.190 3.317 2.379 3.867 . 0 0 "[ . 1 . 2]" 1
1448 1 56 PHE H 1 57 VAL H . . 3.920 2.315 1.937 2.532 . 0 0 "[ . 1 . 2]" 1
1449 1 56 PHE H 1 57 VAL HB . . 5.500 4.405 4.058 5.572 0.072 12 0 "[ . 1 . 2]" 1
1450 1 56 PHE H 1 58 HIS H . . 5.500 3.945 3.428 4.198 . 0 0 "[ . 1 . 2]" 1
1451 1 56 PHE HB2 1 57 VAL H . . 4.680 3.897 3.653 4.112 . 0 0 "[ . 1 . 2]" 1
1452 1 56 PHE HB2 1 57 VAL QG . . 5.500 4.174 3.728 4.470 . 0 0 "[ . 1 . 2]" 1
1453 1 56 PHE HB2 1 99 TYR QE . . 3.940 3.267 2.878 3.752 . 0 0 "[ . 1 . 2]" 1
1454 1 56 PHE HB3 1 57 VAL H . . 3.960 2.646 2.273 3.049 . 0 0 "[ . 1 . 2]" 1
1455 1 56 PHE HB3 1 57 VAL QG . . 5.360 2.643 2.148 2.971 . 0 0 "[ . 1 . 2]" 1
1456 1 56 PHE HB3 1 99 TYR QD . . 5.330 3.006 2.612 3.365 . 0 0 "[ . 1 . 2]" 1
1457 1 56 PHE HB3 1 99 TYR QE . . 5.500 3.746 3.395 4.322 . 0 0 "[ . 1 . 2]" 1
1458 1 56 PHE QD 1 57 VAL H . . 4.270 3.400 2.685 3.862 . 0 0 "[ . 1 . 2]" 1
1459 1 56 PHE QD 1 57 VAL HA . . 4.080 2.988 2.620 3.315 . 0 0 "[ . 1 . 2]" 1
1460 1 56 PHE QD 1 57 VAL HB . . 5.420 4.492 3.979 4.829 . 0 0 "[ . 1 . 2]" 1
1461 1 56 PHE QD 1 57 VAL QG . . 3.560 2.292 2.075 2.684 . 0 0 "[ . 1 . 2]" 1
1462 1 56 PHE QD 1 99 TYR H . . 5.180 4.427 4.096 4.947 . 0 0 "[ . 1 . 2]" 1
1463 1 56 PHE QD 1 99 TYR HB2 . . 5.500 2.582 2.329 2.890 . 0 0 "[ . 1 . 2]" 1
1464 1 56 PHE QD 1 99 TYR HB3 . . 4.440 4.095 3.908 4.329 . 0 0 "[ . 1 . 2]" 1
1465 1 56 PHE QD 1 99 TYR QD . . 3.730 2.927 2.683 3.201 . 0 0 "[ . 1 . 2]" 1
1466 1 56 PHE QE 1 57 VAL HA . . 4.900 4.662 4.058 4.987 0.087 4 0 "[ . 1 . 2]" 1
1467 1 56 PHE QE 1 57 VAL QG . . 4.280 3.678 3.205 4.065 . 0 0 "[ . 1 . 2]" 1
1468 1 56 PHE QE 1 95 CYS HA . . 4.750 3.611 3.300 4.022 . 0 0 "[ . 1 . 2]" 1
1469 1 56 PHE QE 1 98 GLN HB2 . . 5.030 4.378 3.862 5.115 0.085 20 0 "[ . 1 . 2]" 1
1470 1 56 PHE QE 1 98 GLN HB3 . . 5.500 2.739 2.187 3.560 . 0 0 "[ . 1 . 2]" 1
1471 1 56 PHE QE 1 98 GLN HG3 . . 4.940 3.840 3.315 4.724 . 0 0 "[ . 1 . 2]" 1
1472 1 56 PHE QE 1 99 TYR H . . 4.470 2.984 2.797 3.244 . 0 0 "[ . 1 . 2]" 1
1473 1 56 PHE QE 1 99 TYR HA . . 5.500 3.192 2.851 3.480 . 0 0 "[ . 1 . 2]" 1
1474 1 56 PHE QE 1 99 TYR HB2 . . 5.500 2.735 2.431 3.050 . 0 0 "[ . 1 . 2]" 1
1475 1 56 PHE QE 1 99 TYR HB3 . . 4.180 4.080 3.854 4.254 0.074 12 0 "[ . 1 . 2]" 1
1476 1 56 PHE QE 1 99 TYR QD . . 4.450 3.457 3.166 3.667 . 0 0 "[ . 1 . 2]" 1
1477 1 56 PHE QE 1 102 GLU HG3 . . 4.640 3.513 2.745 4.383 . 0 0 "[ . 1 . 2]" 1
1478 1 56 PHE HZ 1 98 GLN HA . . 5.500 5.228 4.783 5.579 0.079 20 0 "[ . 1 . 2]" 1
1479 1 56 PHE HZ 1 98 GLN HB2 . . 5.280 4.938 4.531 5.360 0.080 14 0 "[ . 1 . 2]" 1
1480 1 56 PHE HZ 1 98 GLN HB3 . . 3.990 3.444 2.925 3.855 . 0 0 "[ . 1 . 2]" 1
1481 1 56 PHE HZ 1 98 GLN HG3 . . 3.610 2.977 2.238 3.695 0.085 20 0 "[ . 1 . 2]" 1
1482 1 56 PHE HZ 1 99 TYR H . . 4.610 4.153 3.895 4.360 . 0 0 "[ . 1 . 2]" 1
1483 1 56 PHE HZ 1 99 TYR HA . . 5.470 3.106 2.810 3.336 . 0 0 "[ . 1 . 2]" 1
1484 1 56 PHE HZ 1 99 TYR QD . . 5.370 4.198 3.811 4.540 . 0 0 "[ . 1 . 2]" 1
1485 1 56 PHE HZ 1 102 GLU HG3 . . 4.210 2.938 2.255 4.275 0.065 20 0 "[ . 1 . 2]" 1
1486 1 57 VAL H 1 57 VAL HB . . 3.330 2.387 2.180 3.403 0.073 12 0 "[ . 1 . 2]" 1
1487 1 57 VAL H 1 57 VAL QG . . 3.460 2.284 1.999 2.579 . 0 0 "[ . 1 . 2]" 1
1488 1 57 VAL H 1 58 HIS H . . 3.830 2.613 2.353 2.864 . 0 0 "[ . 1 . 2]" 1
1489 1 57 VAL H 1 58 HIS HA . . 5.500 5.005 4.787 5.206 . 0 0 "[ . 1 . 2]" 1
1490 1 57 VAL H 1 60 CYS H . . 5.500 5.486 5.327 5.573 0.073 13 0 "[ . 1 . 2]" 1
1491 1 57 VAL HA 1 57 VAL QG . . 3.320 2.161 2.094 2.445 . 0 0 "[ . 1 . 2]" 1
1492 1 57 VAL HA 1 60 CYS H . . 5.000 4.229 3.959 4.366 . 0 0 "[ . 1 . 2]" 1
1493 1 57 VAL HA 1 60 CYS HA . . 5.500 5.494 5.334 5.598 0.098 8 0 "[ . 1 . 2]" 1
1494 1 57 VAL HA 1 60 CYS HB3 . . 4.160 2.684 2.322 3.606 . 0 0 "[ . 1 . 2]" 1
1495 1 57 VAL HA 1 61 VAL H . . 4.680 3.926 3.674 4.345 . 0 0 "[ . 1 . 2]" 1
1496 1 57 VAL HA 1 92 GLU QG . . 5.500 5.168 4.824 5.391 . 0 0 "[ . 1 . 2]" 1
1497 1 57 VAL HA 1 95 CYS HB3 . . 4.030 3.403 2.456 4.090 0.060 14 0 "[ . 1 . 2]" 1
1498 1 57 VAL HB 1 58 HIS H . . 3.640 3.252 2.765 3.738 0.098 12 0 "[ . 1 . 2]" 1
1499 1 57 VAL QG 1 58 HIS H . . 4.160 3.468 2.305 3.790 . 0 0 "[ . 1 . 2]" 1
1500 1 57 VAL QG 1 58 HIS HA . . 4.270 3.702 3.024 4.149 . 0 0 "[ . 1 . 2]" 1
1501 1 57 VAL QG 1 58 HIS HD2 . . 5.500 4.804 4.540 4.996 . 0 0 "[ . 1 . 2]" 1
1502 1 57 VAL QG 1 61 VAL H . . 4.500 3.929 3.473 4.311 . 0 0 "[ . 1 . 2]" 1
1503 1 57 VAL QG 1 92 GLU HA . . 5.270 3.194 2.812 3.773 . 0 0 "[ . 1 . 2]" 1
1504 1 57 VAL QG 1 92 GLU QG . . 3.690 2.348 2.053 2.606 . 0 0 "[ . 1 . 2]" 1
1505 1 57 VAL QG 1 95 CYS H . . 5.500 4.562 4.290 5.011 . 0 0 "[ . 1 . 2]" 1
1506 1 57 VAL QG 1 95 CYS HA . . 5.290 4.103 3.810 4.337 . 0 0 "[ . 1 . 2]" 1
1507 1 57 VAL QG 1 95 CYS HB2 . . 3.760 3.157 2.237 3.647 . 0 0 "[ . 1 . 2]" 1
1508 1 57 VAL QG 1 95 CYS HB3 . . 4.080 2.436 2.038 2.822 . 0 0 "[ . 1 . 2]" 1
1509 1 57 VAL QG 1 96 VAL H . . 4.680 3.350 3.065 3.663 . 0 0 "[ . 1 . 2]" 1
1510 1 57 VAL QG 1 96 VAL HA . . 3.290 2.547 2.032 3.112 . 0 0 "[ . 1 . 2]" 1
1511 1 57 VAL QG 1 96 VAL QG . . 3.120 2.288 1.965 2.649 . 0 0 "[ . 1 . 2]" 1
1512 1 57 VAL QG 1 98 GLN HB3 . . 5.500 5.165 4.715 5.423 . 0 0 "[ . 1 . 2]" 1
1513 1 57 VAL QG 1 99 TYR H . . 5.260 4.246 3.846 4.753 . 0 0 "[ . 1 . 2]" 1
1514 1 57 VAL QG 1 99 TYR HB2 . . 5.500 2.929 2.532 3.630 . 0 0 "[ . 1 . 2]" 1
1515 1 57 VAL QG 1 99 TYR HB3 . . 5.360 3.359 2.964 4.054 . 0 0 "[ . 1 . 2]" 1
1516 1 57 VAL QG 1 99 TYR QD . . 4.250 3.731 3.482 4.215 . 0 0 "[ . 1 . 2]" 1
1517 1 57 VAL QG 1 99 TYR QE . . 4.910 4.714 4.435 4.940 0.030 7 0 "[ . 1 . 2]" 1
1518 1 58 HIS H 1 58 HIS QB . . 3.660 2.360 2.225 2.448 . 0 0 "[ . 1 . 2]" 1
1519 1 58 HIS H 1 58 HIS HD2 . . 4.780 2.502 2.002 2.949 . 0 0 "[ . 1 . 2]" 1
1520 1 58 HIS H 1 59 ASP H . . 3.830 3.755 3.436 3.889 0.059 15 0 "[ . 1 . 2]" 1
1521 1 58 HIS H 1 60 CYS H . . 5.500 3.867 3.471 4.150 . 0 0 "[ . 1 . 2]" 1
1522 1 58 HIS H 1 61 VAL MG2 . . 5.500 4.992 4.582 5.288 . 0 0 "[ . 1 . 2]" 1
1523 1 58 HIS HA 1 59 ASP HA . . 4.740 4.663 4.561 4.773 0.033 13 0 "[ . 1 . 2]" 1
1524 1 58 HIS HA 1 60 CYS H . . 5.240 4.274 4.102 4.513 . 0 0 "[ . 1 . 2]" 1
1525 1 58 HIS HA 1 61 VAL H . . 4.560 4.405 4.034 4.633 0.073 5 0 "[ . 1 . 2]" 1
1526 1 58 HIS HA 1 61 VAL HB . . 4.150 4.172 3.802 4.231 0.081 11 0 "[ . 1 . 2]" 1
1527 1 58 HIS HA 1 61 VAL MG2 . . 4.650 4.440 3.848 4.639 . 0 0 "[ . 1 . 2]" 1
1528 1 58 HIS QB 1 58 HIS HD2 . . 3.390 3.264 3.164 3.330 . 0 0 "[ . 1 . 2]" 1
1529 1 58 HIS QB 1 59 ASP H . . 3.840 2.605 2.422 2.762 . 0 0 "[ . 1 . 2]" 1
1530 1 58 HIS HD2 1 59 ASP QB . . 4.320 3.748 3.144 4.165 . 0 0 "[ . 1 . 2]" 1
1531 1 58 HIS HD2 1 60 CYS HA . . 4.780 4.859 4.773 4.874 0.094 18 0 "[ . 1 . 2]" 1
1532 1 58 HIS HD2 1 60 CYS HB2 . . 4.680 3.896 2.985 5.151 0.471 11 0 "[ . 1 . 2]" 1
1533 1 58 HIS HD2 1 61 VAL H . . 4.980 4.727 4.478 4.905 . 0 0 "[ . 1 . 2]" 1
1534 1 59 ASP H 1 59 ASP QB . . 3.380 2.093 1.948 2.494 . 0 0 "[ . 1 . 2]" 1
1535 1 59 ASP H 1 60 CYS H . . 3.690 2.527 2.303 2.773 . 0 0 "[ . 1 . 2]" 1
1536 1 59 ASP H 1 60 CYS HB2 . . 5.500 5.139 4.591 6.221 0.721 8 3 "[* . + 1- . 2]" 1
1537 1 59 ASP H 1 61 VAL H . . 5.190 4.534 4.281 4.667 . 0 0 "[ . 1 . 2]" 1
1538 1 59 ASP H 1 61 VAL HB . . 5.500 5.494 5.140 5.574 0.074 18 0 "[ . 1 . 2]" 1
1539 1 59 ASP HA 1 61 VAL H . . 5.500 4.060 3.838 4.252 . 0 0 "[ . 1 . 2]" 1
1540 1 59 ASP HA 1 61 VAL MG1 . . 5.500 5.097 4.849 5.338 . 0 0 "[ . 1 . 2]" 1
1541 1 59 ASP HA 1 61 VAL MG2 . . 5.500 5.527 5.410 5.605 0.105 10 0 "[ . 1 . 2]" 1
1542 1 59 ASP HA 1 62 ASN H . . 3.950 2.634 2.467 2.741 . 0 0 "[ . 1 . 2]" 1
1543 1 59 ASP HA 1 62 ASN HA . . 4.470 4.543 4.526 4.566 0.096 13 0 "[ . 1 . 2]" 1
1544 1 59 ASP HA 1 62 ASN HB2 . . 3.790 2.776 2.431 3.093 . 0 0 "[ . 1 . 2]" 1
1545 1 59 ASP HA 1 62 ASN HB3 . . 3.550 2.169 2.012 2.394 . 0 0 "[ . 1 . 2]" 1
1546 1 59 ASP HA 1 62 ASN HD21 . . 4.960 3.639 3.405 4.137 . 0 0 "[ . 1 . 2]" 1
1547 1 59 ASP HA 1 62 ASN HD22 . . 5.500 5.213 4.994 5.554 0.054 5 0 "[ . 1 . 2]" 1
1548 1 59 ASP HA 1 63 ILE H . . 4.940 3.410 3.138 3.879 . 0 0 "[ . 1 . 2]" 1
1549 1 59 ASP HA 1 63 ILE MD . . 5.500 4.811 4.327 5.270 . 0 0 "[ . 1 . 2]" 1
1550 1 59 ASP HA 1 63 ILE QG . . 5.500 3.958 3.425 4.398 . 0 0 "[ . 1 . 2]" 1
1551 1 59 ASP QB 1 60 CYS H . . 3.750 3.215 2.934 3.520 . 0 0 "[ . 1 . 2]" 1
1552 1 59 ASP QB 1 63 ILE H . . 5.500 4.047 3.608 4.611 . 0 0 "[ . 1 . 2]" 1
1553 1 59 ASP QB 1 63 ILE MD . . 5.500 3.926 3.353 4.565 . 0 0 "[ . 1 . 2]" 1
1554 1 60 CYS H 1 60 CYS HB2 . . 3.540 2.816 2.410 3.594 0.054 11 0 "[ . 1 . 2]" 1
1555 1 60 CYS H 1 60 CYS HB3 . . 3.510 2.458 2.037 2.742 . 0 0 "[ . 1 . 2]" 1
1556 1 60 CYS H 1 61 VAL H . . 3.630 2.725 2.569 3.019 . 0 0 "[ . 1 . 2]" 1
1557 1 60 CYS H 1 61 VAL HA . . 5.500 5.341 5.187 5.546 0.046 6 0 "[ . 1 . 2]" 1
1558 1 60 CYS H 1 61 VAL HB . . 5.000 4.571 4.304 4.996 . 0 0 "[ . 1 . 2]" 1
1559 1 60 CYS H 1 61 VAL MG2 . . 4.850 4.521 4.314 4.859 0.009 6 0 "[ . 1 . 2]" 1
1560 1 60 CYS H 1 63 ILE H . . 5.500 4.687 4.585 4.783 . 0 0 "[ . 1 . 2]" 1
1561 1 60 CYS HA 1 61 VAL MG2 . . 5.330 5.139 5.028 5.268 . 0 0 "[ . 1 . 2]" 1
1562 1 60 CYS HA 1 63 ILE H . . 5.110 3.879 3.564 4.151 . 0 0 "[ . 1 . 2]" 1
1563 1 60 CYS HA 1 63 ILE HB . . 4.750 3.178 2.853 3.492 . 0 0 "[ . 1 . 2]" 1
1564 1 60 CYS HA 1 63 ILE QG . . 5.470 3.872 3.195 4.200 . 0 0 "[ . 1 . 2]" 1
1565 1 60 CYS HA 1 63 ILE MG . . 4.680 4.361 3.795 4.743 0.063 12 0 "[ . 1 . 2]" 1
1566 1 60 CYS HB2 1 61 VAL H . . 4.280 3.853 3.731 3.979 . 0 0 "[ . 1 . 2]" 1
1567 1 60 CYS HB2 1 61 VAL MG2 . . 5.110 4.899 4.541 5.192 0.082 12 0 "[ . 1 . 2]" 1
1568 1 60 CYS HB3 1 61 VAL H . . 3.990 2.758 2.370 3.793 . 0 0 "[ . 1 . 2]" 1
1569 1 60 CYS HB3 1 61 VAL MG2 . . 5.140 3.727 3.190 5.130 . 0 0 "[ . 1 . 2]" 1
1570 1 60 CYS HB3 1 95 CYS HB2 . . 5.500 4.993 4.143 6.256 0.756 8 2 "[ . + 1- . 2]" 1
1571 1 61 VAL H 1 61 VAL HB . . 3.200 2.296 2.162 2.495 . 0 0 "[ . 1 . 2]" 1
1572 1 61 VAL H 1 61 VAL MG1 . . 4.160 3.725 3.672 3.794 . 0 0 "[ . 1 . 2]" 1
1573 1 61 VAL H 1 61 VAL MG2 . . 3.220 2.347 2.251 2.539 . 0 0 "[ . 1 . 2]" 1
1574 1 61 VAL H 1 62 ASN H . . 3.550 2.810 2.657 2.914 . 0 0 "[ . 1 . 2]" 1
1575 1 61 VAL H 1 62 ASN HB2 . . 5.340 5.171 4.963 5.393 0.053 6 0 "[ . 1 . 2]" 1
1576 1 61 VAL H 1 63 ILE H . . 5.500 4.375 4.140 4.536 . 0 0 "[ . 1 . 2]" 1
1577 1 61 VAL HA 1 61 VAL MG1 . . 3.350 2.604 2.495 2.755 . 0 0 "[ . 1 . 2]" 1
1578 1 61 VAL HA 1 61 VAL MG2 . . 3.620 2.284 2.182 2.358 . 0 0 "[ . 1 . 2]" 1
1579 1 61 VAL HA 1 64 THR H . . 4.850 3.963 3.682 4.109 . 0 0 "[ . 1 . 2]" 1
1580 1 61 VAL HA 1 64 THR HB . . 3.950 3.157 2.988 3.708 . 0 0 "[ . 1 . 2]" 1
1581 1 61 VAL HA 1 65 ILE H . . 4.780 3.916 3.725 4.145 . 0 0 "[ . 1 . 2]" 1
1582 1 61 VAL HA 1 65 ILE HG13 . . 5.290 3.996 3.476 4.754 . 0 0 "[ . 1 . 2]" 1
1583 1 61 VAL HA 1 91 VAL HB . . 4.380 4.132 3.687 4.437 0.057 14 0 "[ . 1 . 2]" 1
1584 1 61 VAL HA 1 91 VAL MG1 . . 2.970 1.987 1.899 2.059 . 0 0 "[ . 1 . 2]" 1
1585 1 61 VAL HA 1 92 GLU H . . 5.500 5.145 4.786 5.409 . 0 0 "[ . 1 . 2]" 1
1586 1 61 VAL HB 1 62 ASN H . . 3.340 2.492 2.358 2.626 . 0 0 "[ . 1 . 2]" 1
1587 1 61 VAL HB 1 62 ASN HB2 . . 5.150 4.380 4.096 4.652 . 0 0 "[ . 1 . 2]" 1
1588 1 61 VAL HB 1 65 ILE MD . . 5.500 4.551 4.260 4.950 . 0 0 "[ . 1 . 2]" 1
1589 1 61 VAL HB 1 91 VAL MG1 . . 5.500 4.123 3.849 4.354 . 0 0 "[ . 1 . 2]" 1
1590 1 61 VAL MG1 1 62 ASN H . . 4.070 2.963 2.768 3.104 . 0 0 "[ . 1 . 2]" 1
1591 1 61 VAL MG1 1 62 ASN HA . . 4.120 3.093 2.857 3.301 . 0 0 "[ . 1 . 2]" 1
1592 1 61 VAL MG1 1 65 ILE H . . 5.500 4.090 3.857 4.294 . 0 0 "[ . 1 . 2]" 1
1593 1 61 VAL MG1 1 65 ILE HG13 . . 4.670 2.915 2.258 3.469 . 0 0 "[ . 1 . 2]" 1
1594 1 61 VAL MG1 1 88 GLU HA . . 3.980 3.485 3.090 3.948 . 0 0 "[ . 1 . 2]" 1
1595 1 61 VAL MG1 1 88 GLU HB3 . . 5.030 4.519 3.871 5.104 0.074 16 0 "[ . 1 . 2]" 1
1596 1 61 VAL MG1 1 91 VAL H . . 5.500 4.461 4.102 4.790 . 0 0 "[ . 1 . 2]" 1
1597 1 61 VAL MG1 1 92 GLU H . . 5.270 3.472 3.157 3.916 . 0 0 "[ . 1 . 2]" 1
1598 1 61 VAL MG2 1 62 ASN H . . 4.460 3.943 3.849 4.022 . 0 0 "[ . 1 . 2]" 1
1599 1 61 VAL MG2 1 64 THR HB . . 5.200 4.804 4.631 5.021 . 0 0 "[ . 1 . 2]" 1
1600 1 61 VAL MG2 1 64 THR MG . . 5.430 5.149 4.973 5.539 0.109 10 0 "[ . 1 . 2]" 1
1601 1 61 VAL MG2 1 65 ILE H . . 5.500 5.409 5.255 5.533 0.033 9 0 "[ . 1 . 2]" 1
1602 1 61 VAL MG2 1 65 ILE MD . . 4.180 4.210 3.995 4.308 0.128 11 0 "[ . 1 . 2]" 1
1603 1 61 VAL MG2 1 91 VAL MG1 . . 3.160 2.319 2.142 2.506 . 0 0 "[ . 1 . 2]" 1
1604 1 61 VAL MG2 1 92 GLU H . . 4.030 3.256 3.005 3.523 . 0 0 "[ . 1 . 2]" 1
1605 1 61 VAL MG2 1 92 GLU HA . . 2.960 2.099 1.971 2.313 . 0 0 "[ . 1 . 2]" 1
1606 1 61 VAL MG2 1 92 GLU HB2 . . 4.370 2.912 2.382 3.431 . 0 0 "[ . 1 . 2]" 1
1607 1 61 VAL MG2 1 92 GLU HB3 . . 4.620 4.028 3.683 4.267 . 0 0 "[ . 1 . 2]" 1
1608 1 61 VAL MG2 1 93 GLN H . . 5.120 4.926 4.791 5.120 0.000 17 0 "[ . 1 . 2]" 1
1609 1 61 VAL MG2 1 95 CYS HA . . 5.500 4.964 4.501 5.563 0.063 1 0 "[ . 1 . 2]" 1
1610 1 61 VAL MG2 1 95 CYS HB3 . . 4.440 3.130 2.671 3.708 . 0 0 "[ . 1 . 2]" 1
1611 1 62 ASN H 1 62 ASN HB2 . . 3.160 2.474 2.313 2.612 . 0 0 "[ . 1 . 2]" 1
1612 1 62 ASN H 1 63 ILE H . . 3.660 2.927 2.768 3.063 . 0 0 "[ . 1 . 2]" 1
1613 1 62 ASN H 1 65 ILE H . . 5.500 4.786 4.730 4.895 . 0 0 "[ . 1 . 2]" 1
1614 1 62 ASN H 1 65 ILE MD . . 5.290 4.570 4.226 4.962 . 0 0 "[ . 1 . 2]" 1
1615 1 62 ASN H 1 91 VAL MG1 . . 5.500 4.697 4.492 4.898 . 0 0 "[ . 1 . 2]" 1
1616 1 62 ASN HA 1 62 ASN HD22 . . 5.500 4.685 4.467 4.826 . 0 0 "[ . 1 . 2]" 1
1617 1 62 ASN HA 1 63 ILE HA . . 5.500 4.790 4.673 4.895 . 0 0 "[ . 1 . 2]" 1
1618 1 62 ASN HA 1 65 ILE H . . 4.820 3.694 3.484 3.914 . 0 0 "[ . 1 . 2]" 1
1619 1 62 ASN HA 1 65 ILE HB . . 4.140 2.453 2.252 2.656 . 0 0 "[ . 1 . 2]" 1
1620 1 62 ASN HA 1 65 ILE MD . . 5.270 3.088 2.659 3.561 . 0 0 "[ . 1 . 2]" 1
1621 1 62 ASN HA 1 66 LYS H . . 4.750 3.803 3.593 3.985 . 0 0 "[ . 1 . 2]" 1
1622 1 62 ASN HA 1 91 VAL MG1 . . 5.500 4.832 4.531 5.126 . 0 0 "[ . 1 . 2]" 1
1623 1 62 ASN HB2 1 63 ILE H . . 3.800 3.863 3.813 3.880 0.080 19 0 "[ . 1 . 2]" 1
1624 1 62 ASN HB2 1 63 ILE MD . . 5.420 5.210 4.391 5.514 0.094 6 0 "[ . 1 . 2]" 1
1625 1 62 ASN HB2 1 65 ILE HB . . 5.090 4.928 4.726 5.126 0.036 3 0 "[ . 1 . 2]" 1
1626 1 62 ASN HB2 1 65 ILE MG . . 5.140 4.953 4.682 5.202 0.062 2 0 "[ . 1 . 2]" 1
1627 1 62 ASN HB3 1 63 ILE H . . 3.670 2.496 2.395 2.663 . 0 0 "[ . 1 . 2]" 1
1628 1 62 ASN HB3 1 63 ILE HA . . 4.850 4.206 4.064 4.363 . 0 0 "[ . 1 . 2]" 1
1629 1 62 ASN HB3 1 63 ILE HB . . 5.140 4.720 4.288 4.980 . 0 0 "[ . 1 . 2]" 1
1630 1 62 ASN HB3 1 63 ILE MD . . 5.290 3.776 2.825 4.235 . 0 0 "[ . 1 . 2]" 1
1631 1 62 ASN HB3 1 65 ILE H . . 5.500 5.558 5.491 5.576 0.076 10 0 "[ . 1 . 2]" 1
1632 1 62 ASN HB3 1 65 ILE HB . . 5.340 5.133 4.959 5.385 0.045 11 0 "[ . 1 . 2]" 1
1633 1 62 ASN HB3 1 65 ILE MG . . 5.280 5.377 5.173 5.403 0.123 16 0 "[ . 1 . 2]" 1
1634 1 62 ASN HB3 1 66 LYS QD . . 5.420 5.043 4.239 5.511 0.091 7 0 "[ . 1 . 2]" 1
1635 1 62 ASN HD21 1 63 ILE H . . 5.500 3.989 3.121 4.801 . 0 0 "[ . 1 . 2]" 1
1636 1 62 ASN HD21 1 63 ILE MD . . 5.450 3.207 2.553 4.094 . 0 0 "[ . 1 . 2]" 1
1637 1 62 ASN HD21 1 63 ILE QG . . 5.500 3.876 2.283 5.090 . 0 0 "[ . 1 . 2]" 1
1638 1 62 ASN HD21 1 66 LYS QD . . 5.500 4.556 3.839 4.954 . 0 0 "[ . 1 . 2]" 1
1639 1 62 ASN HD22 1 63 ILE MD . . 5.500 3.834 3.125 4.843 . 0 0 "[ . 1 . 2]" 1
1640 1 62 ASN HD22 1 66 LYS QD . . 5.320 3.410 2.897 3.660 . 0 0 "[ . 1 . 2]" 1
1641 1 62 ASN HD22 1 66 LYS QE . . 5.500 5.413 4.249 5.602 0.102 4 0 "[ . 1 . 2]" 1
1642 1 63 ILE H 1 63 ILE HB . . 3.360 2.423 2.187 2.582 . 0 0 "[ . 1 . 2]" 1
1643 1 63 ILE H 1 63 ILE MD . . 4.610 3.354 2.887 3.772 . 0 0 "[ . 1 . 2]" 1
1644 1 63 ILE H 1 63 ILE QG . . 3.550 2.566 2.330 2.769 . 0 0 "[ . 1 . 2]" 1
1645 1 63 ILE H 1 63 ILE MG . . 4.300 3.789 3.629 3.874 . 0 0 "[ . 1 . 2]" 1
1646 1 63 ILE H 1 64 THR H . . 3.620 2.901 2.755 3.357 . 0 0 "[ . 1 . 2]" 1
1647 1 63 ILE H 1 65 ILE H . . 5.500 4.137 3.891 4.258 . 0 0 "[ . 1 . 2]" 1
1648 1 63 ILE HA 1 63 ILE MD . . 3.580 2.104 2.043 2.211 . 0 0 "[ . 1 . 2]" 1
1649 1 63 ILE HA 1 63 ILE QG . . 3.850 3.007 2.771 3.137 . 0 0 "[ . 1 . 2]" 1
1650 1 63 ILE HA 1 64 THR HB . . 5.500 5.591 5.578 5.597 0.097 20 0 "[ . 1 . 2]" 1
1651 1 63 ILE HA 1 66 LYS H . . 4.020 3.413 3.108 3.667 . 0 0 "[ . 1 . 2]" 1
1652 1 63 ILE HA 1 66 LYS QB . . 4.080 2.790 2.285 3.166 . 0 0 "[ . 1 . 2]" 1
1653 1 63 ILE HA 1 66 LYS QD . . 5.150 4.640 3.698 5.218 0.068 10 0 "[ . 1 . 2]" 1
1654 1 63 ILE HA 1 66 LYS HG2 . . 5.490 4.806 4.295 5.358 . 0 0 "[ . 1 . 2]" 1
1655 1 63 ILE HA 1 67 GLN H . . 5.050 4.093 3.849 4.284 . 0 0 "[ . 1 . 2]" 1
1656 1 63 ILE HB 1 64 THR H . . 3.790 2.595 2.438 2.919 . 0 0 "[ . 1 . 2]" 1
1657 1 63 ILE MD 1 63 ILE MG . . 3.880 2.221 2.118 2.456 . 0 0 "[ . 1 . 2]" 1
1658 1 63 ILE MD 1 64 THR H . . 5.500 4.740 4.654 4.894 . 0 0 "[ . 1 . 2]" 1
1659 1 63 ILE MD 1 66 LYS H . . 5.500 4.815 4.502 5.028 . 0 0 "[ . 1 . 2]" 1
1660 1 63 ILE MD 1 66 LYS QB . . 5.470 3.506 3.067 3.723 . 0 0 "[ . 1 . 2]" 1
1661 1 63 ILE MD 1 66 LYS QD . . 4.960 4.781 3.934 5.067 0.107 4 0 "[ . 1 . 2]" 1
1662 1 63 ILE MD 1 67 GLN QE . . 5.190 4.333 3.048 5.030 . 0 0 "[ . 1 . 2]" 1
1663 1 63 ILE MD 1 67 GLN HG2 . . 5.500 4.745 4.267 5.175 . 0 0 "[ . 1 . 2]" 1
1664 1 63 ILE QG 1 64 THR H . . 5.290 4.263 4.082 4.607 . 0 0 "[ . 1 . 2]" 1
1665 1 63 ILE MG 1 64 THR H . . 4.240 3.006 2.660 3.205 . 0 0 "[ . 1 . 2]" 1
1666 1 63 ILE MG 1 64 THR HA . . 4.750 3.204 3.010 3.375 . 0 0 "[ . 1 . 2]" 1
1667 1 63 ILE MG 1 64 THR HB . . 4.840 4.667 4.087 4.917 0.077 18 0 "[ . 1 . 2]" 1
1668 1 63 ILE MG 1 66 LYS H . . 5.500 4.866 4.583 5.088 . 0 0 "[ . 1 . 2]" 1
1669 1 63 ILE MG 1 66 LYS QB . . 5.500 4.175 3.695 4.416 . 0 0 "[ . 1 . 2]" 1
1670 1 63 ILE MG 1 67 GLN H . . 5.490 4.202 4.018 4.337 . 0 0 "[ . 1 . 2]" 1
1671 1 63 ILE MG 1 67 GLN HA . . 5.500 5.238 5.023 5.505 0.005 13 0 "[ . 1 . 2]" 1
1672 1 63 ILE MG 1 67 GLN HB2 . . 5.500 4.483 3.962 5.239 . 0 0 "[ . 1 . 2]" 1
1673 1 63 ILE MG 1 67 GLN QE . . 5.500 3.452 2.051 4.458 . 0 0 "[ . 1 . 2]" 1
1674 1 63 ILE MG 1 67 GLN HG2 . . 4.810 2.696 2.248 3.315 . 0 0 "[ . 1 . 2]" 1
1675 1 63 ILE MG 1 67 GLN HG3 . . 5.150 3.407 2.880 3.791 . 0 0 "[ . 1 . 2]" 1
1676 1 64 THR H 1 64 THR HB . . 3.380 2.269 2.065 2.393 . 0 0 "[ . 1 . 2]" 1
1677 1 64 THR H 1 64 THR MG . . 4.770 3.682 3.518 3.742 . 0 0 "[ . 1 . 2]" 1
1678 1 64 THR H 1 67 GLN HG2 . . 5.500 4.519 4.164 5.007 . 0 0 "[ . 1 . 2]" 1
1679 1 64 THR HA 1 64 THR MG . . 3.710 2.461 2.351 2.716 . 0 0 "[ . 1 . 2]" 1
1680 1 64 THR HA 1 65 ILE HA . . 5.140 4.876 4.807 4.932 . 0 0 "[ . 1 . 2]" 1
1681 1 64 THR HA 1 68 HIS HD2 . . 4.500 4.472 4.268 4.572 0.072 11 0 "[ . 1 . 2]" 1
1682 1 64 THR HB 1 65 ILE H . . 3.660 2.489 2.292 2.781 . 0 0 "[ . 1 . 2]" 1
1683 1 64 THR HB 1 65 ILE HA . . 5.180 4.453 4.230 4.855 . 0 0 "[ . 1 . 2]" 1
1684 1 64 THR HB 1 65 ILE HG13 . . 5.500 3.924 3.576 4.352 . 0 0 "[ . 1 . 2]" 1
1685 1 64 THR HB 1 91 VAL MG1 . . 3.500 2.199 1.991 2.734 . 0 0 "[ . 1 . 2]" 1
1686 1 64 THR HB 1 91 VAL MG2 . . 5.500 3.553 2.759 3.985 . 0 0 "[ . 1 . 2]" 1
1687 1 64 THR MG 1 65 ILE H . . 4.680 3.317 2.868 3.669 . 0 0 "[ . 1 . 2]" 1
1688 1 64 THR MG 1 65 ILE HA . . 4.840 3.525 3.246 3.751 . 0 0 "[ . 1 . 2]" 1
1689 1 64 THR MG 1 65 ILE HG13 . . 4.620 3.968 3.299 4.442 . 0 0 "[ . 1 . 2]" 1
1690 1 64 THR MG 1 67 GLN HG2 . . 4.980 4.654 4.130 5.078 0.098 6 0 "[ . 1 . 2]" 1
1691 1 64 THR MG 1 68 HIS H . . 5.250 4.246 3.923 4.982 . 0 0 "[ . 1 . 2]" 1
1692 1 64 THR MG 1 68 HIS HB2 . . 5.500 5.526 5.024 5.616 0.116 18 0 "[ . 1 . 2]" 1
1693 1 64 THR MG 1 68 HIS HB3 . . 5.500 4.221 3.710 4.402 . 0 0 "[ . 1 . 2]" 1
1694 1 64 THR MG 1 68 HIS HD2 . . 3.170 2.757 2.603 2.984 . 0 0 "[ . 1 . 2]" 1
1695 1 64 THR MG 1 91 VAL HA . . 5.500 4.008 3.566 4.275 . 0 0 "[ . 1 . 2]" 1
1696 1 64 THR MG 1 91 VAL MG1 . . 3.790 2.258 2.072 2.793 . 0 0 "[ . 1 . 2]" 1
1697 1 64 THR MG 1 91 VAL MG2 . . 3.870 2.296 1.888 2.877 . 0 0 "[ . 1 . 2]" 1
1698 1 65 ILE H 1 65 ILE HB . . 3.170 2.148 2.065 2.206 . 0 0 "[ . 1 . 2]" 1
1699 1 65 ILE H 1 65 ILE MD . . 4.580 3.790 3.559 3.969 . 0 0 "[ . 1 . 2]" 1
1700 1 65 ILE H 1 65 ILE HG12 . . 4.280 3.720 3.143 4.189 . 0 0 "[ . 1 . 2]" 1
1701 1 65 ILE H 1 65 ILE HG13 . . 3.610 2.646 2.390 3.201 . 0 0 "[ . 1 . 2]" 1
1702 1 65 ILE H 1 65 ILE MG . . 4.140 3.601 3.434 3.686 . 0 0 "[ . 1 . 2]" 1
1703 1 65 ILE H 1 66 LYS H . . 3.400 2.854 2.709 2.974 . 0 0 "[ . 1 . 2]" 1
1704 1 65 ILE H 1 91 VAL MG1 . . 3.940 2.810 2.553 3.025 . 0 0 "[ . 1 . 2]" 1
1705 1 65 ILE H 1 91 VAL MG2 . . 5.500 3.820 3.550 4.018 . 0 0 "[ . 1 . 2]" 1
1706 1 65 ILE HA 1 65 ILE MD . . 4.380 3.639 3.513 3.700 . 0 0 "[ . 1 . 2]" 1
1707 1 65 ILE HA 1 65 ILE HG12 . . 3.730 2.216 2.106 2.313 . 0 0 "[ . 1 . 2]" 1
1708 1 65 ILE HA 1 65 ILE HG13 . . 4.220 2.723 2.393 3.234 . 0 0 "[ . 1 . 2]" 1
1709 1 65 ILE HA 1 65 ILE MG . . 3.450 2.867 2.778 3.044 . 0 0 "[ . 1 . 2]" 1
1710 1 65 ILE HA 1 66 LYS HA . . 4.690 4.564 4.476 4.664 . 0 0 "[ . 1 . 2]" 1
1711 1 65 ILE HA 1 67 GLN H . . 4.420 4.198 4.022 4.428 0.008 11 0 "[ . 1 . 2]" 1
1712 1 65 ILE HA 1 68 HIS H . . 4.460 3.729 3.461 3.937 . 0 0 "[ . 1 . 2]" 1
1713 1 65 ILE HA 1 68 HIS HB3 . . 4.710 4.758 4.621 4.792 0.082 9 0 "[ . 1 . 2]" 1
1714 1 65 ILE HA 1 68 HIS HD2 . . 4.420 2.362 2.231 2.531 . 0 0 "[ . 1 . 2]" 1
1715 1 65 ILE HA 1 69 THR H . . 5.100 4.438 3.985 5.160 0.060 13 0 "[ . 1 . 2]" 1
1716 1 65 ILE HA 1 69 THR MG . . 5.380 5.106 4.672 5.314 . 0 0 "[ . 1 . 2]" 1
1717 1 65 ILE HA 1 87 MET ME . . 4.560 3.781 3.393 4.366 . 0 0 "[ . 1 . 2]" 1
1718 1 65 ILE HB 1 65 ILE MD . . 3.570 2.422 2.213 2.738 . 0 0 "[ . 1 . 2]" 1
1719 1 65 ILE HB 1 66 LYS H . . 3.530 2.647 2.411 3.026 . 0 0 "[ . 1 . 2]" 1
1720 1 65 ILE HB 1 66 LYS QD . . 4.840 4.090 2.885 4.921 0.081 1 0 "[ . 1 . 2]" 1
1721 1 65 ILE HB 1 69 THR MG . . 5.500 5.464 4.994 5.603 0.103 9 0 "[ . 1 . 2]" 1
1722 1 65 ILE HB 1 87 MET ME . . 5.110 5.010 4.674 5.242 0.132 16 0 "[ . 1 . 2]" 1
1723 1 65 ILE MD 1 65 ILE MG . . 2.910 1.980 1.877 2.067 . 0 0 "[ . 1 . 2]" 1
1724 1 65 ILE MD 1 66 LYS H . . 5.500 4.599 4.447 4.784 . 0 0 "[ . 1 . 2]" 1
1725 1 65 ILE MD 1 66 LYS HA . . 5.500 5.621 5.609 5.631 0.131 15 0 "[ . 1 . 2]" 1
1726 1 65 ILE MD 1 66 LYS QD . . 5.460 4.907 4.199 5.554 0.094 12 0 "[ . 1 . 2]" 1
1727 1 65 ILE MD 1 66 LYS QE . . 5.210 4.871 4.093 5.314 0.104 11 0 "[ . 1 . 2]" 1
1728 1 65 ILE MD 1 87 MET H . . 5.500 5.558 5.032 5.614 0.114 19 0 "[ . 1 . 2]" 1
1729 1 65 ILE MD 1 87 MET HB2 . . 4.890 4.085 3.553 4.427 . 0 0 "[ . 1 . 2]" 1
1730 1 65 ILE MD 1 87 MET HB3 . . 5.330 5.252 4.777 5.433 0.103 10 0 "[ . 1 . 2]" 1
1731 1 65 ILE MD 1 87 MET ME . . 4.240 3.463 2.943 4.090 . 0 0 "[ . 1 . 2]" 1
1732 1 65 ILE MD 1 87 MET QG . . 5.060 3.515 2.616 4.237 . 0 0 "[ . 1 . 2]" 1
1733 1 65 ILE MD 1 88 GLU H . . 4.700 3.799 3.209 4.066 . 0 0 "[ . 1 . 2]" 1
1734 1 65 ILE MD 1 88 GLU HA . . 3.230 2.010 1.873 2.323 . 0 0 "[ . 1 . 2]" 1
1735 1 65 ILE MD 1 88 GLU HB2 . . 5.500 4.330 4.082 4.630 . 0 0 "[ . 1 . 2]" 1
1736 1 65 ILE MD 1 88 GLU HB3 . . 5.160 3.888 3.123 4.242 . 0 0 "[ . 1 . 2]" 1
1737 1 65 ILE MD 1 88 GLU HG2 . . 4.220 2.616 2.328 2.876 . 0 0 "[ . 1 . 2]" 1
1738 1 65 ILE MD 1 88 GLU HG3 . . 3.580 3.696 2.733 4.233 0.653 8 5 "[ * -. + 1 *.* 2]" 1
1739 1 65 ILE MD 1 89 ARG H . . 5.500 4.801 4.616 4.996 . 0 0 "[ . 1 . 2]" 1
1740 1 65 ILE MD 1 90 VAL H . . 5.500 5.458 5.171 5.595 0.095 1 0 "[ . 1 . 2]" 1
1741 1 65 ILE MD 1 91 VAL H . . 5.030 4.149 3.877 4.426 . 0 0 "[ . 1 . 2]" 1
1742 1 65 ILE MD 1 91 VAL HB . . 4.860 2.940 2.708 3.174 . 0 0 "[ . 1 . 2]" 1
1743 1 65 ILE MD 1 91 VAL MG1 . . 3.630 3.329 2.981 3.608 . 0 0 "[ . 1 . 2]" 1
1744 1 65 ILE HG12 1 65 ILE MG . . 3.430 2.655 2.494 2.875 . 0 0 "[ . 1 . 2]" 1
1745 1 65 ILE HG12 1 66 LYS H . . 5.500 4.889 4.750 5.027 . 0 0 "[ . 1 . 2]" 1
1746 1 65 ILE HG12 1 68 HIS HD2 . . 4.110 4.073 3.819 4.175 0.065 12 0 "[ . 1 . 2]" 1
1747 1 65 ILE HG12 1 68 HIS HE1 . . 4.690 4.226 3.592 4.766 0.076 8 0 "[ . 1 . 2]" 1
1748 1 65 ILE HG12 1 87 MET QG . . 5.240 3.992 2.711 4.598 . 0 0 "[ . 1 . 2]" 1
1749 1 65 ILE HG13 1 91 VAL MG1 . . 4.640 2.289 2.062 2.701 . 0 0 "[ . 1 . 2]" 1
1750 1 65 ILE MG 1 66 LYS H . . 4.220 2.533 2.382 2.848 . 0 0 "[ . 1 . 2]" 1
1751 1 65 ILE MG 1 66 LYS HA . . 4.570 2.804 2.748 2.876 . 0 0 "[ . 1 . 2]" 1
1752 1 65 ILE MG 1 66 LYS QB . . 4.930 3.507 3.194 4.016 . 0 0 "[ . 1 . 2]" 1
1753 1 65 ILE MG 1 66 LYS QD . . 5.500 2.517 2.047 3.363 . 0 0 "[ . 1 . 2]" 1
1754 1 65 ILE MG 1 66 LYS QE . . 5.500 2.364 1.837 2.819 . 0 0 "[ . 1 . 2]" 1
1755 1 65 ILE MG 1 66 LYS HG2 . . 5.500 4.704 4.389 5.018 . 0 0 "[ . 1 . 2]" 1
1756 1 65 ILE MG 1 66 LYS HG3 . . 4.650 4.303 3.933 4.572 . 0 0 "[ . 1 . 2]" 1
1757 1 65 ILE MG 1 67 GLN H . . 5.500 4.540 4.392 4.685 . 0 0 "[ . 1 . 2]" 1
1758 1 65 ILE MG 1 69 THR H . . 5.500 4.373 3.754 4.921 . 0 0 "[ . 1 . 2]" 1
1759 1 65 ILE MG 1 69 THR HA . . 5.500 5.151 4.773 5.563 0.063 20 0 "[ . 1 . 2]" 1
1760 1 65 ILE MG 1 69 THR HB . . 5.500 3.071 2.544 3.435 . 0 0 "[ . 1 . 2]" 1
1761 1 65 ILE MG 1 69 THR MG . . 3.620 2.882 2.346 3.168 . 0 0 "[ . 1 . 2]" 1
1762 1 65 ILE MG 1 87 MET ME . . 3.420 2.648 2.122 3.119 . 0 0 "[ . 1 . 2]" 1
1763 1 65 ILE MG 1 88 GLU HG2 . . 5.450 4.081 3.797 4.494 . 0 0 "[ . 1 . 2]" 1
1764 1 66 LYS H 1 66 LYS QB . . 3.160 2.152 2.082 2.263 . 0 0 "[ . 1 . 2]" 1
1765 1 66 LYS H 1 66 LYS QD . . 4.940 3.052 2.230 3.783 . 0 0 "[ . 1 . 2]" 1
1766 1 66 LYS H 1 66 LYS HG2 . . 4.450 4.356 4.023 4.523 0.073 14 0 "[ . 1 . 2]" 1
1767 1 66 LYS H 1 66 LYS HG3 . . 4.560 4.326 3.998 4.464 . 0 0 "[ . 1 . 2]" 1
1768 1 66 LYS H 1 67 GLN H . . 3.300 2.774 2.669 2.945 . 0 0 "[ . 1 . 2]" 1
1769 1 66 LYS H 1 69 THR MG . . 5.320 5.031 4.808 5.258 . 0 0 "[ . 1 . 2]" 1
1770 1 66 LYS HA 1 66 LYS QD . . 4.560 2.890 2.433 3.329 . 0 0 "[ . 1 . 2]" 1
1771 1 66 LYS HA 1 66 LYS QE . . 4.470 2.236 1.906 3.077 . 0 0 "[ . 1 . 2]" 1
1772 1 66 LYS HA 1 66 LYS HG2 . . 4.130 3.620 3.538 3.733 . 0 0 "[ . 1 . 2]" 1
1773 1 66 LYS HA 1 66 LYS HG3 . . 4.070 2.511 2.269 2.728 . 0 0 "[ . 1 . 2]" 1
1774 1 66 LYS HA 1 69 THR H . . 4.150 3.213 2.606 3.690 . 0 0 "[ . 1 . 2]" 1
1775 1 66 LYS HA 1 69 THR HB . . 3.970 2.095 1.934 2.513 . 0 0 "[ . 1 . 2]" 1
1776 1 66 LYS HA 1 69 THR MG . . 4.400 3.151 2.632 3.593 . 0 0 "[ . 1 . 2]" 1
1777 1 66 LYS HA 1 70 VAL QG . . 5.500 2.928 2.488 3.319 . 0 0 "[ . 1 . 2]" 1
1778 1 66 LYS QB 1 67 GLN H . . 3.450 3.049 2.706 3.235 . 0 0 "[ . 1 . 2]" 1
1779 1 66 LYS QB 1 67 GLN QE . . 5.500 3.597 2.657 4.471 . 0 0 "[ . 1 . 2]" 1
1780 1 66 LYS QB 1 69 THR H . . 5.500 4.763 4.377 4.979 . 0 0 "[ . 1 . 2]" 1
1781 1 66 LYS QB 1 70 VAL QG . . 4.880 3.374 2.698 3.753 . 0 0 "[ . 1 . 2]" 1
1782 1 66 LYS QD 1 69 THR HB . . 4.970 4.308 3.584 5.040 0.070 20 0 "[ . 1 . 2]" 1
1783 1 66 LYS QD 1 69 THR MG . . 3.820 3.899 3.694 3.949 0.129 18 0 "[ . 1 . 2]" 1
1784 1 66 LYS QD 1 70 VAL QG . . 4.080 3.603 3.376 3.843 . 0 0 "[ . 1 . 2]" 1
1785 1 66 LYS QE 1 66 LYS HG3 . . 3.710 2.281 2.088 2.498 . 0 0 "[ . 1 . 2]" 1
1786 1 66 LYS QE 1 69 THR H . . 4.820 4.619 4.316 4.927 0.107 15 0 "[ . 1 . 2]" 1
1787 1 66 LYS QE 1 69 THR HB . . 5.500 2.786 2.457 3.307 . 0 0 "[ . 1 . 2]" 1
1788 1 66 LYS QE 1 69 THR MG . . 4.100 2.176 1.855 2.761 . 0 0 "[ . 1 . 2]" 1
1789 1 66 LYS QE 1 70 VAL HA . . 5.500 5.433 4.949 5.591 0.091 14 0 "[ . 1 . 2]" 1
1790 1 66 LYS QE 1 70 VAL HB . . 4.800 4.579 3.716 4.889 0.089 20 0 "[ . 1 . 2]" 1
1791 1 66 LYS QE 1 70 VAL QG . . 5.060 2.517 1.939 2.818 . 0 0 "[ . 1 . 2]" 1
1792 1 66 LYS HG2 1 67 GLN H . . 5.500 5.461 5.182 5.577 0.077 10 0 "[ . 1 . 2]" 1
1793 1 66 LYS HG2 1 70 VAL QG . . 4.950 3.291 2.783 3.561 . 0 0 "[ . 1 . 2]" 1
1794 1 66 LYS HG3 1 67 GLN H . . 5.330 5.104 4.777 5.391 0.061 6 0 "[ . 1 . 2]" 1
1795 1 66 LYS HG3 1 70 VAL QG . . 4.480 2.114 1.908 2.258 . 0 0 "[ . 1 . 2]" 1
1796 1 66 LYS HG3 1 71 THR H . . 5.500 5.336 4.693 5.578 0.078 12 0 "[ . 1 . 2]" 1
1797 1 67 GLN H 1 67 GLN HB2 . . 3.200 2.550 2.290 2.738 . 0 0 "[ . 1 . 2]" 1
1798 1 67 GLN H 1 67 GLN HB3 . . 4.160 3.628 3.541 3.691 . 0 0 "[ . 1 . 2]" 1
1799 1 67 GLN H 1 67 GLN QE . . 5.500 3.628 2.666 4.528 . 0 0 "[ . 1 . 2]" 1
1800 1 67 GLN H 1 67 GLN HG2 . . 3.710 2.707 2.045 3.061 . 0 0 "[ . 1 . 2]" 1
1801 1 67 GLN H 1 67 GLN HG3 . . 4.180 3.899 3.036 4.192 0.012 14 0 "[ . 1 . 2]" 1
1802 1 67 GLN H 1 68 HIS H . . 3.870 2.808 2.614 3.011 . 0 0 "[ . 1 . 2]" 1
1803 1 67 GLN H 1 68 HIS HB3 . . 5.480 5.103 4.692 5.390 . 0 0 "[ . 1 . 2]" 1
1804 1 67 GLN H 1 68 HIS HD2 . . 4.350 4.410 4.282 4.432 0.082 10 0 "[ . 1 . 2]" 1
1805 1 67 GLN H 1 69 THR H . . 4.050 3.837 3.688 4.123 0.073 13 0 "[ . 1 . 2]" 1
1806 1 67 GLN H 1 70 VAL H . . 5.050 4.791 4.547 4.932 . 0 0 "[ . 1 . 2]" 1
1807 1 67 GLN H 1 70 VAL QG . . 5.500 5.029 3.940 5.251 . 0 0 "[ . 1 . 2]" 1
1808 1 67 GLN HA 1 67 GLN QE . . 4.640 2.592 1.956 3.756 . 0 0 "[ . 1 . 2]" 1
1809 1 67 GLN HA 1 67 GLN HG2 . . 3.920 3.370 2.748 3.721 . 0 0 "[ . 1 . 2]" 1
1810 1 67 GLN HA 1 69 THR H . . 5.140 4.038 3.581 4.544 . 0 0 "[ . 1 . 2]" 1
1811 1 67 GLN HA 1 71 THR H . . 3.940 2.839 2.489 3.522 . 0 0 "[ . 1 . 2]" 1
1812 1 67 GLN HA 1 71 THR HB . . 5.250 2.203 1.890 2.604 . 0 0 "[ . 1 . 2]" 1
1813 1 67 GLN HA 1 71 THR MG . . 4.120 2.880 1.891 3.601 . 0 0 "[ . 1 . 2]" 1
1814 1 67 GLN HB2 1 68 HIS H . . 4.160 2.645 2.013 3.471 . 0 0 "[ . 1 . 2]" 1
1815 1 67 GLN HB2 1 68 HIS HD2 . . 4.590 4.152 3.605 4.391 . 0 0 "[ . 1 . 2]" 1
1816 1 67 GLN HB2 1 69 THR H . . 5.500 4.817 4.438 5.328 . 0 0 "[ . 1 . 2]" 1
1817 1 67 GLN HB2 1 71 THR HB . . 5.420 4.766 4.292 5.510 0.090 8 0 "[ . 1 . 2]" 1
1818 1 67 GLN HB2 1 71 THR MG . . 4.610 3.968 3.584 4.725 0.115 18 0 "[ . 1 . 2]" 1
1819 1 67 GLN HB3 1 68 HIS H . . 4.300 3.553 3.093 4.208 . 0 0 "[ . 1 . 2]" 1
1820 1 67 GLN HB3 1 68 HIS HA . . 4.930 4.395 3.910 4.845 . 0 0 "[ . 1 . 2]" 1
1821 1 67 GLN HB3 1 68 HIS HD2 . . 5.500 5.509 5.183 5.579 0.079 18 0 "[ . 1 . 2]" 1
1822 1 67 GLN HB3 1 71 THR MG . . 3.930 2.681 2.203 3.528 . 0 0 "[ . 1 . 2]" 1
1823 1 67 GLN QE 1 70 VAL QG . . 5.500 4.612 3.713 5.038 . 0 0 "[ . 1 . 2]" 1
1824 1 67 GLN QE 1 71 THR MG . . 5.500 3.543 2.054 4.888 . 0 0 "[ . 1 . 2]" 1
1825 1 67 GLN HG2 1 68 HIS H . . 5.020 4.528 4.081 5.076 0.056 16 0 "[ . 1 . 2]" 1
1826 1 67 GLN HG3 1 68 HIS H . . 5.500 5.048 4.094 5.595 0.095 18 0 "[ . 1 . 2]" 1
1827 1 68 HIS H 1 68 HIS HB2 . . 3.880 3.669 3.467 3.932 0.052 18 0 "[ . 1 . 2]" 1
1828 1 68 HIS H 1 68 HIS HB3 . . 3.430 2.506 2.178 3.023 . 0 0 "[ . 1 . 2]" 1
1829 1 68 HIS H 1 68 HIS HD2 . . 3.860 2.733 2.446 3.369 . 0 0 "[ . 1 . 2]" 1
1830 1 68 HIS H 1 69 THR H . . 3.470 2.564 1.863 3.070 . 0 0 "[ . 1 . 2]" 1
1831 1 68 HIS HA 1 69 THR HB . . 5.500 5.498 5.201 5.573 0.073 4 0 "[ . 1 . 2]" 1
1832 1 68 HIS HA 1 71 THR H . . 5.440 4.767 4.346 5.138 . 0 0 "[ . 1 . 2]" 1
1833 1 68 HIS HA 1 71 THR MG . . 5.140 3.279 2.783 3.778 . 0 0 "[ . 1 . 2]" 1
1834 1 68 HIS HA 1 72 THR H . . 5.270 3.520 3.222 3.994 . 0 0 "[ . 1 . 2]" 1
1835 1 68 HIS HA 1 72 THR MG . . 5.210 3.823 3.181 4.724 . 0 0 "[ . 1 . 2]" 1
1836 1 68 HIS HB2 1 68 HIS HE1 . . 4.970 4.810 4.734 4.933 . 0 0 "[ . 1 . 2]" 1
1837 1 68 HIS HB2 1 69 THR H . . 4.880 4.442 4.140 4.598 . 0 0 "[ . 1 . 2]" 1
1838 1 68 HIS HB2 1 71 THR MG . . 5.500 5.109 4.717 5.378 . 0 0 "[ . 1 . 2]" 1
1839 1 68 HIS HB3 1 68 HIS HD2 . . 3.590 2.649 2.558 2.803 . 0 0 "[ . 1 . 2]" 1
1840 1 68 HIS HB3 1 69 THR H . . 4.520 4.241 3.984 4.507 . 0 0 "[ . 1 . 2]" 1
1841 1 68 HIS HB3 1 71 THR MG . . 4.610 4.703 4.430 4.746 0.136 8 0 "[ . 1 . 2]" 1
1842 1 68 HIS HD2 1 69 THR H . . 5.060 4.401 3.966 5.071 0.011 13 0 "[ . 1 . 2]" 1
1843 1 68 HIS HD2 1 69 THR HB . . 5.410 5.438 5.194 5.490 0.080 13 0 "[ . 1 . 2]" 1
1844 1 68 HIS HE1 1 87 MET ME . . 4.750 2.176 1.989 2.715 . 0 0 "[ . 1 . 2]" 1
1845 1 68 HIS HE1 1 87 MET QG . . 4.180 3.145 2.235 3.900 . 0 0 "[ . 1 . 2]" 1
1846 1 69 THR H 1 69 THR HB . . 3.570 2.255 2.138 2.792 . 0 0 "[ . 1 . 2]" 1
1847 1 69 THR H 1 69 THR MG . . 3.870 3.691 3.446 3.942 0.072 13 0 "[ . 1 . 2]" 1
1848 1 69 THR H 1 70 VAL H . . 3.220 2.279 1.762 2.542 . 0 0 "[ . 1 . 2]" 1
1849 1 69 THR H 1 70 VAL HB . . 5.500 4.556 4.233 5.581 0.081 11 0 "[ . 1 . 2]" 1
1850 1 69 THR H 1 70 VAL QG . . 5.490 3.886 3.506 4.069 . 0 0 "[ . 1 . 2]" 1
1851 1 69 THR H 1 71 THR H . . 3.890 3.930 3.400 3.977 0.087 17 0 "[ . 1 . 2]" 1
1852 1 69 THR H 1 79 PHE QD . . 4.990 4.994 4.863 5.079 0.089 17 0 "[ . 1 . 2]" 1
1853 1 69 THR HA 1 69 THR MG . . 3.310 2.639 2.486 2.935 . 0 0 "[ . 1 . 2]" 1
1854 1 69 THR HA 1 70 VAL QG . . 4.410 4.193 4.040 4.375 . 0 0 "[ . 1 . 2]" 1
1855 1 69 THR HA 1 79 PHE QD . . 3.640 2.493 2.120 2.812 . 0 0 "[ . 1 . 2]" 1
1856 1 69 THR HB 1 70 VAL H . . 3.640 3.265 2.753 3.705 0.065 20 0 "[ . 1 . 2]" 1
1857 1 69 THR HB 1 70 VAL QG . . 4.630 3.053 2.525 3.762 . 0 0 "[ . 1 . 2]" 1
1858 1 69 THR MG 1 70 VAL H . . 4.110 3.896 3.585 4.169 0.059 5 0 "[ . 1 . 2]" 1
1859 1 69 THR MG 1 70 VAL HA . . 4.840 4.160 3.768 4.505 . 0 0 "[ . 1 . 2]" 1
1860 1 69 THR MG 1 70 VAL HB . . 5.500 4.599 4.193 5.110 . 0 0 "[ . 1 . 2]" 1
1861 1 69 THR MG 1 70 VAL QG . . 3.340 2.434 2.036 2.962 . 0 0 "[ . 1 . 2]" 1
1862 1 69 THR MG 1 79 PHE H . . 5.500 4.419 3.917 5.050 . 0 0 "[ . 1 . 2]" 1
1863 1 69 THR MG 1 79 PHE HB2 . . 5.500 3.357 2.779 3.937 . 0 0 "[ . 1 . 2]" 1
1864 1 69 THR MG 1 79 PHE HB3 . . 4.840 4.488 3.685 4.948 0.108 14 0 "[ . 1 . 2]" 1
1865 1 69 THR MG 1 79 PHE QD . . 4.010 3.700 3.129 4.069 0.059 3 0 "[ . 1 . 2]" 1
1866 1 70 VAL H 1 70 VAL HB . . 3.250 2.742 2.566 3.350 0.100 11 0 "[ . 1 . 2]" 1
1867 1 70 VAL H 1 70 VAL QG . . 3.180 2.834 2.186 3.002 . 0 0 "[ . 1 . 2]" 1
1868 1 70 VAL H 1 71 THR H . . 3.330 2.145 1.926 2.290 . 0 0 "[ . 1 . 2]" 1
1869 1 70 VAL H 1 71 THR HB . . 5.190 3.791 3.451 4.024 . 0 0 "[ . 1 . 2]" 1
1870 1 70 VAL HA 1 70 VAL QG . . 3.050 2.124 2.070 2.195 . 0 0 "[ . 1 . 2]" 1
1871 1 70 VAL HA 1 72 THR H . . 5.140 4.076 3.731 4.383 . 0 0 "[ . 1 . 2]" 1
1872 1 70 VAL HA 1 73 THR H . . 4.670 3.069 2.565 3.302 . 0 0 "[ . 1 . 2]" 1
1873 1 70 VAL HA 1 73 THR HB . . 3.990 2.296 1.938 2.774 . 0 0 "[ . 1 . 2]" 1
1874 1 70 VAL HA 1 73 THR MG . . 5.060 2.221 1.919 2.396 . 0 0 "[ . 1 . 2]" 1
1875 1 70 VAL HA 1 74 THR H . . 5.330 4.517 4.202 5.110 . 0 0 "[ . 1 . 2]" 1
1876 1 70 VAL HB 1 71 THR H . . 3.470 2.524 2.264 3.277 . 0 0 "[ . 1 . 2]" 1
1877 1 70 VAL HB 1 71 THR HA . . 5.050 4.475 4.167 4.932 . 0 0 "[ . 1 . 2]" 1
1878 1 70 VAL HB 1 71 THR HB . . 5.170 4.065 3.565 4.918 . 0 0 "[ . 1 . 2]" 1
1879 1 70 VAL HB 1 72 THR H . . 5.500 4.845 4.610 5.143 . 0 0 "[ . 1 . 2]" 1
1880 1 70 VAL QG 1 71 THR H . . 4.090 2.995 1.737 3.389 . 0 0 "[ . 1 . 2]" 1
1881 1 70 VAL QG 1 71 THR HA . . 4.210 3.507 2.977 4.042 . 0 0 "[ . 1 . 2]" 1
1882 1 70 VAL QG 1 72 THR H . . 4.960 4.417 4.016 4.584 . 0 0 "[ . 1 . 2]" 1
1883 1 70 VAL QG 1 73 THR H . . 5.500 4.130 3.782 4.285 . 0 0 "[ . 1 . 2]" 1
1884 1 70 VAL QG 1 73 THR HB . . 5.500 3.612 3.038 3.967 . 0 0 "[ . 1 . 2]" 1
1885 1 70 VAL QG 1 73 THR MG . . 3.350 2.733 2.179 3.038 . 0 0 "[ . 1 . 2]" 1
1886 1 70 VAL QG 1 74 THR H . . 5.500 4.792 4.432 5.316 . 0 0 "[ . 1 . 2]" 1
1887 1 71 THR H 1 71 THR HB . . 3.060 1.943 1.815 2.044 . 0 0 "[ . 1 . 2]" 1
1888 1 71 THR H 1 71 THR MG . . 3.760 3.181 2.668 3.558 . 0 0 "[ . 1 . 2]" 1
1889 1 71 THR H 1 73 THR HB . . 5.500 4.944 4.464 5.415 . 0 0 "[ . 1 . 2]" 1
1890 1 71 THR HA 1 73 THR H . . 5.300 4.307 4.130 4.621 . 0 0 "[ . 1 . 2]" 1
1891 1 71 THR MG 1 72 THR H . . 4.310 2.974 2.627 3.287 . 0 0 "[ . 1 . 2]" 1
1892 1 71 THR MG 1 72 THR HB . . 5.420 4.228 3.915 4.562 . 0 0 "[ . 1 . 2]" 1
1893 1 72 THR H 1 72 THR HA . . 2.920 2.966 2.920 2.998 0.078 9 0 "[ . 1 . 2]" 1
1894 1 72 THR H 1 72 THR HB . . 3.770 2.592 2.461 2.787 . 0 0 "[ . 1 . 2]" 1
1895 1 72 THR H 1 72 THR MG . . 3.800 3.822 3.741 3.873 0.073 17 0 "[ . 1 . 2]" 1
1896 1 72 THR H 1 73 THR H . . 3.400 2.127 2.018 2.254 . 0 0 "[ . 1 . 2]" 1
1897 1 72 THR H 1 73 THR HA . . 4.570 4.651 4.617 4.664 0.094 2 0 "[ . 1 . 2]" 1
1898 1 72 THR HA 1 72 THR MG . . 3.600 2.368 2.235 2.500 . 0 0 "[ . 1 . 2]" 1
1899 1 72 THR HA 1 73 THR H . . 3.410 3.484 3.463 3.493 0.083 14 0 "[ . 1 . 2]" 1
1900 1 72 THR HA 1 74 THR MG . . 3.390 3.050 2.354 3.479 0.089 9 0 "[ . 1 . 2]" 1
1901 1 72 THR HA 1 75 LYS HB3 . . 4.620 4.556 4.238 4.719 0.099 17 0 "[ . 1 . 2]" 1
1902 1 72 THR HA 1 75 LYS QD . . 4.250 4.203 3.919 4.336 0.086 9 0 "[ . 1 . 2]" 1
1903 1 72 THR HA 1 75 LYS QE . . 5.500 5.123 1.892 5.600 0.100 5 0 "[ . 1 . 2]" 1
1904 1 72 THR HA 1 75 LYS HG2 . . 5.480 3.064 2.778 4.146 . 0 0 "[ . 1 . 2]" 1
1905 1 72 THR HA 1 77 GLU QG . . 5.040 4.860 4.658 5.141 0.101 13 0 "[ . 1 . 2]" 1
1906 1 72 THR HB 1 73 THR H . . 4.270 3.262 3.053 3.522 . 0 0 "[ . 1 . 2]" 1
1907 1 72 THR HB 1 73 THR HA . . 4.340 4.267 3.932 4.400 0.060 5 0 "[ . 1 . 2]" 1
1908 1 72 THR HB 1 77 GLU QB . . 3.950 2.710 2.314 3.239 . 0 0 "[ . 1 . 2]" 1
1909 1 72 THR HB 1 77 GLU QG . . 4.810 2.593 2.200 3.814 . 0 0 "[ . 1 . 2]" 1
1910 1 72 THR HB 1 79 PHE QE . . 4.440 3.820 3.266 4.418 . 0 0 "[ . 1 . 2]" 1
1911 1 72 THR MG 1 73 THR H . . 4.600 4.197 3.927 4.335 . 0 0 "[ . 1 . 2]" 1
1912 1 72 THR MG 1 73 THR HA . . 4.710 4.253 3.995 4.370 . 0 0 "[ . 1 . 2]" 1
1913 1 72 THR MG 1 74 THR H . . 5.430 4.834 4.316 5.123 . 0 0 "[ . 1 . 2]" 1
1914 1 72 THR MG 1 75 LYS HB2 . . 4.740 4.706 4.517 4.874 0.134 17 0 "[ . 1 . 2]" 1
1915 1 72 THR MG 1 75 LYS QE . . 5.380 3.188 1.699 3.740 . 0 0 "[ . 1 . 2]" 1
1916 1 72 THR MG 1 75 LYS HG2 . . 4.230 2.424 2.210 2.918 . 0 0 "[ . 1 . 2]" 1
1917 1 72 THR MG 1 75 LYS HG3 . . 5.120 2.939 2.629 3.718 . 0 0 "[ . 1 . 2]" 1
1918 1 72 THR MG 1 77 GLU H . . 5.320 3.855 3.493 4.075 . 0 0 "[ . 1 . 2]" 1
1919 1 72 THR MG 1 77 GLU QB . . 3.790 2.099 1.996 2.287 . 0 0 "[ . 1 . 2]" 1
1920 1 72 THR MG 1 79 PHE QD . . 5.470 5.376 4.779 5.579 0.109 4 0 "[ . 1 . 2]" 1
1921 1 72 THR MG 1 79 PHE QE . . 4.180 3.988 3.397 4.293 0.113 18 0 "[ . 1 . 2]" 1
1922 1 73 THR H 1 73 THR HB . . 3.090 2.084 1.817 2.323 . 0 0 "[ . 1 . 2]" 1
1923 1 73 THR H 1 73 THR MG . . 3.750 2.890 2.613 3.391 . 0 0 "[ . 1 . 2]" 1
1924 1 73 THR H 1 74 THR H . . 3.080 2.605 2.409 2.899 . 0 0 "[ . 1 . 2]" 1
1925 1 73 THR H 1 77 GLU H . . 4.650 4.525 4.166 4.705 0.055 7 0 "[ . 1 . 2]" 1
1926 1 73 THR H 1 77 GLU QB . . 5.500 3.305 3.123 3.437 . 0 0 "[ . 1 . 2]" 1
1927 1 73 THR HA 1 73 THR MG . . 3.510 3.144 3.005 3.238 . 0 0 "[ . 1 . 2]" 1
1928 1 73 THR HA 1 74 THR H . . 3.390 3.344 3.088 3.423 0.033 16 0 "[ . 1 . 2]" 1
1929 1 73 THR HA 1 76 GLY HA2 . . 4.620 4.092 3.479 4.494 . 0 0 "[ . 1 . 2]" 1
1930 1 73 THR HA 1 77 GLU H . . 4.190 2.143 1.798 2.396 . 0 0 "[ . 1 . 2]" 1
1931 1 73 THR HA 1 77 GLU QB . . 4.760 2.136 1.928 2.392 . 0 0 "[ . 1 . 2]" 1
1932 1 73 THR HB 1 74 THR H . . 3.660 3.736 3.708 3.755 0.095 9 0 "[ . 1 . 2]" 1
1933 1 73 THR HB 1 77 GLU QG . . 5.340 5.037 4.522 5.437 0.097 17 0 "[ . 1 . 2]" 1
1934 1 73 THR HB 1 79 PHE QD . . 5.380 5.229 4.850 5.481 0.101 10 0 "[ . 1 . 2]" 1
1935 1 73 THR MG 1 77 GLU H . . 5.460 4.609 4.277 4.844 . 0 0 "[ . 1 . 2]" 1
1936 1 73 THR MG 1 77 GLU QB . . 4.340 4.473 4.422 4.491 0.151 6 0 "[ . 1 . 2]" 1
1937 1 74 THR H 1 74 THR HA . . 2.910 2.789 2.714 2.908 . 0 0 "[ . 1 . 2]" 1
1938 1 74 THR H 1 74 THR HB . . 3.190 1.980 1.763 2.562 . 0 0 "[ . 1 . 2]" 1
1939 1 74 THR H 1 74 THR MG . . 3.620 2.843 2.052 3.377 . 0 0 "[ . 1 . 2]" 1
1940 1 74 THR H 1 75 LYS HB3 . . 5.500 5.436 4.628 5.575 0.075 3 0 "[ . 1 . 2]" 1
1941 1 74 THR H 1 75 LYS HG3 . . 5.500 5.097 4.835 5.593 0.093 17 0 "[ . 1 . 2]" 1
1942 1 74 THR H 1 77 GLU QB . . 5.500 4.382 4.010 4.516 . 0 0 "[ . 1 . 2]" 1
1943 1 74 THR HA 1 77 GLU H . . 5.310 5.330 5.021 5.392 0.082 18 0 "[ . 1 . 2]" 1
1944 1 74 THR HB 1 76 GLY H . . 4.910 4.995 4.962 5.010 0.100 19 0 "[ . 1 . 2]" 1
1945 1 74 THR MG 1 75 LYS H . . 4.420 2.275 1.823 2.495 . 0 0 "[ . 1 . 2]" 1
1946 1 74 THR MG 1 75 LYS HB2 . . 5.500 4.375 4.163 4.579 . 0 0 "[ . 1 . 2]" 1
1947 1 74 THR MG 1 75 LYS HB3 . . 5.260 3.005 2.683 3.279 . 0 0 "[ . 1 . 2]" 1
1948 1 74 THR MG 1 75 LYS QD . . 4.800 4.638 3.928 4.908 0.108 12 0 "[ . 1 . 2]" 1
1949 1 74 THR MG 1 75 LYS QE . . 5.500 5.091 2.041 5.606 0.106 6 0 "[ . 1 . 2]" 1
1950 1 74 THR MG 1 75 LYS HG2 . . 3.730 3.429 3.123 3.811 0.081 17 0 "[ . 1 . 2]" 1
1951 1 74 THR MG 1 76 GLY H . . 5.340 4.155 3.654 4.367 . 0 0 "[ . 1 . 2]" 1
1952 1 74 THR MG 1 77 GLU H . . 5.480 5.053 4.448 5.250 . 0 0 "[ . 1 . 2]" 1
1953 1 74 THR MG 1 77 GLU QB . . 4.980 4.987 4.475 5.111 0.131 8 0 "[ . 1 . 2]" 1
1954 1 75 LYS H 1 75 LYS HB2 . . 3.820 3.640 3.490 3.720 . 0 0 "[ . 1 . 2]" 1
1955 1 75 LYS H 1 75 LYS HB3 . . 3.380 2.686 2.212 2.858 . 0 0 "[ . 1 . 2]" 1
1956 1 75 LYS H 1 75 LYS QD . . 5.050 4.098 3.848 4.260 . 0 0 "[ . 1 . 2]" 1
1957 1 75 LYS H 1 75 LYS HG2 . . 4.150 2.478 2.237 2.626 . 0 0 "[ . 1 . 2]" 1
1958 1 75 LYS H 1 75 LYS HG3 . . 4.790 2.708 2.374 3.877 . 0 0 "[ . 1 . 2]" 1
1959 1 75 LYS H 1 76 GLY H . . 3.270 2.481 2.293 2.573 . 0 0 "[ . 1 . 2]" 1
1960 1 75 LYS H 1 76 GLY HA2 . . 5.300 4.830 4.633 4.909 . 0 0 "[ . 1 . 2]" 1
1961 1 75 LYS H 1 76 GLY HA3 . . 5.100 5.134 4.984 5.170 0.070 13 0 "[ . 1 . 2]" 1
1962 1 75 LYS H 1 77 GLU QB . . 5.300 3.875 3.612 4.635 . 0 0 "[ . 1 . 2]" 1
1963 1 75 LYS HA 1 75 LYS QD . . 4.910 4.455 4.248 4.537 . 0 0 "[ . 1 . 2]" 1
1964 1 75 LYS HA 1 75 LYS HG2 . . 4.150 3.955 3.731 4.025 . 0 0 "[ . 1 . 2]" 1
1965 1 75 LYS HA 1 75 LYS HG3 . . 3.860 3.676 3.585 3.856 . 0 0 "[ . 1 . 2]" 1
1966 1 75 LYS HA 1 76 GLY H . . 3.400 3.241 3.135 3.466 0.066 4 0 "[ . 1 . 2]" 1
1967 1 75 LYS HA 1 76 GLY HA2 . . 4.890 4.919 4.817 4.973 0.083 19 0 "[ . 1 . 2]" 1
1968 1 75 LYS HA 1 77 GLU H . . 5.500 4.830 4.631 5.312 . 0 0 "[ . 1 . 2]" 1
1969 1 75 LYS HB2 1 75 LYS QD . . 3.320 2.437 2.155 2.567 . 0 0 "[ . 1 . 2]" 1
1970 1 75 LYS HB2 1 76 GLY H . . 4.560 4.369 4.058 4.466 . 0 0 "[ . 1 . 2]" 1
1971 1 75 LYS HB2 1 77 GLU H . . 5.150 4.940 4.690 5.219 0.069 17 0 "[ . 1 . 2]" 1
1972 1 75 LYS HB3 1 75 LYS QD . . 2.870 2.802 2.478 2.939 0.069 8 0 "[ . 1 . 2]" 1
1973 1 75 LYS HB3 1 76 GLY H . . 4.540 4.351 3.850 4.479 . 0 0 "[ . 1 . 2]" 1
1974 1 75 LYS HB3 1 77 GLU H . . 5.010 5.074 4.914 5.099 0.089 19 0 "[ . 1 . 2]" 1
1975 1 75 LYS QD 1 76 GLY H . . 5.060 5.091 4.356 5.166 0.106 10 0 "[ . 1 . 2]" 1
1976 1 75 LYS QD 1 77 GLU QG . . 4.870 4.270 3.073 4.975 0.105 11 0 "[ . 1 . 2]" 1
1977 1 75 LYS QE 1 76 GLY HA2 . . 5.500 5.201 4.756 5.611 0.111 4 0 "[ . 1 . 2]" 1
1978 1 75 LYS QE 1 76 GLY HA3 . . 5.500 4.369 3.823 5.624 0.124 17 0 "[ . 1 . 2]" 1
1979 1 75 LYS QE 1 77 GLU QG . . 5.340 4.210 2.909 4.817 . 0 0 "[ . 1 . 2]" 1
1980 1 75 LYS HG2 1 76 GLY H . . 5.450 4.068 2.194 4.422 . 0 0 "[ . 1 . 2]" 1
1981 1 75 LYS HG2 1 77 GLU QG . . 5.500 4.904 4.245 5.199 . 0 0 "[ . 1 . 2]" 1
1982 1 75 LYS HG3 1 76 GLY H . . 4.540 3.210 3.114 3.764 . 0 0 "[ . 1 . 2]" 1
1983 1 75 LYS HG3 1 76 GLY HA3 . . 5.500 4.416 3.947 4.688 . 0 0 "[ . 1 . 2]" 1
1984 1 75 LYS HG3 1 77 GLU QB . . 4.750 2.593 2.179 3.806 . 0 0 "[ . 1 . 2]" 1
1985 1 76 GLY H 1 77 GLU H . . 3.350 2.210 2.026 2.339 . 0 0 "[ . 1 . 2]" 1
1986 1 76 GLY H 1 77 GLU HA . . 5.500 4.889 4.701 4.987 . 0 0 "[ . 1 . 2]" 1
1987 1 76 GLY H 1 78 ASN HD21 . . 5.500 5.393 4.771 5.593 0.093 18 0 "[ . 1 . 2]" 1
1988 1 76 GLY HA2 1 77 GLU HA . . 4.700 4.723 4.561 4.776 0.076 1 0 "[ . 1 . 2]" 1
1989 1 76 GLY HA2 1 78 ASN HD21 . . 4.330 3.594 2.850 4.378 0.048 6 0 "[ . 1 . 2]" 1
1990 1 76 GLY HA3 1 77 GLU HA . . 4.530 4.564 4.422 4.612 0.082 19 0 "[ . 1 . 2]" 1
1991 1 76 GLY HA3 1 77 GLU QB . . 5.270 4.985 4.876 5.156 . 0 0 "[ . 1 . 2]" 1
1992 1 77 GLU H 1 77 GLU QB . . 3.090 2.122 2.018 2.257 . 0 0 "[ . 1 . 2]" 1
1993 1 77 GLU H 1 78 ASN H . . 4.230 4.200 3.836 4.324 0.094 10 0 "[ . 1 . 2]" 1
1994 1 77 GLU H 1 78 ASN HD21 . . 5.060 4.841 4.185 5.135 0.075 14 0 "[ . 1 . 2]" 1
1995 1 77 GLU HA 1 77 GLU QG . . 3.470 2.673 2.181 2.981 . 0 0 "[ . 1 . 2]" 1
1996 1 77 GLU HA 1 78 ASN H . . 2.770 2.172 1.995 2.308 . 0 0 "[ . 1 . 2]" 1
1997 1 77 GLU HA 1 78 ASN HA . . 4.490 4.439 4.346 4.503 0.013 15 0 "[ . 1 . 2]" 1
1998 1 77 GLU HA 1 78 ASN HB2 . . 5.500 4.780 4.239 5.595 0.095 11 0 "[ . 1 . 2]" 1
1999 1 77 GLU HA 1 78 ASN HB3 . . 5.500 5.342 4.462 5.591 0.091 2 0 "[ . 1 . 2]" 1
2000 1 77 GLU HA 1 78 ASN HD21 . . 5.500 4.896 3.336 5.537 0.037 9 0 "[ . 1 . 2]" 1
2001 1 77 GLU HA 1 79 PHE H . . 5.190 4.858 4.393 5.256 0.066 9 0 "[ . 1 . 2]" 1
2002 1 77 GLU QB 1 78 ASN HA . . 4.550 4.609 4.548 4.641 0.091 5 0 "[ . 1 . 2]" 1
2003 1 77 GLU QB 1 79 PHE H . . 5.260 4.664 4.115 5.016 . 0 0 "[ . 1 . 2]" 1
2004 1 77 GLU QB 1 79 PHE QD . . 4.210 4.026 3.223 4.315 0.105 6 0 "[ . 1 . 2]" 1
2005 1 77 GLU QB 1 79 PHE QE . . 4.290 3.840 3.362 4.340 0.050 13 0 "[ . 1 . 2]" 1
2006 1 77 GLU QG 1 78 ASN H . . 4.020 3.647 2.518 4.097 0.077 17 0 "[ . 1 . 2]" 1
2007 1 77 GLU QG 1 79 PHE H . . 5.500 3.887 3.175 4.564 . 0 0 "[ . 1 . 2]" 1
2008 1 77 GLU QG 1 79 PHE QD . . 4.840 3.001 2.438 3.807 . 0 0 "[ . 1 . 2]" 1
2009 1 77 GLU QG 1 79 PHE QE . . 4.130 2.282 2.073 3.380 . 0 0 "[ . 1 . 2]" 1
2010 1 77 GLU QG 1 79 PHE HZ . . 5.400 3.536 2.822 4.252 . 0 0 "[ . 1 . 2]" 1
2011 1 78 ASN H 1 78 ASN HB2 . . 3.380 2.814 2.107 3.752 0.372 18 0 "[ . 1 . 2]" 1
2012 1 78 ASN H 1 78 ASN HB3 . . 4.010 3.409 3.041 3.773 . 0 0 "[ . 1 . 2]" 1
2013 1 78 ASN H 1 78 ASN HD21 . . 5.140 3.696 2.281 4.361 . 0 0 "[ . 1 . 2]" 1
2014 1 78 ASN H 1 79 PHE H . . 4.180 3.755 3.539 4.247 0.067 5 0 "[ . 1 . 2]" 1
2015 1 78 ASN H 1 79 PHE HA . . 5.500 4.873 4.400 5.286 . 0 0 "[ . 1 . 2]" 1
2016 1 78 ASN H 1 79 PHE QD . . 5.210 5.157 4.514 5.306 0.096 12 0 "[ . 1 . 2]" 1
2017 1 78 ASN HA 1 78 ASN HD21 . . 4.730 3.367 1.885 4.287 . 0 0 "[ . 1 . 2]" 1
2018 1 78 ASN HA 1 78 ASN HD22 . . 5.500 4.205 3.243 5.225 . 0 0 "[ . 1 . 2]" 1
2019 1 78 ASN HA 1 79 PHE H . . 2.840 2.213 2.057 2.384 . 0 0 "[ . 1 . 2]" 1
2020 1 78 ASN HA 1 79 PHE HA . . 4.800 4.531 4.465 4.623 . 0 0 "[ . 1 . 2]" 1
2021 1 78 ASN HA 1 79 PHE HB2 . . 5.470 4.352 4.223 4.594 . 0 0 "[ . 1 . 2]" 1
2022 1 78 ASN HA 1 79 PHE QD . . 4.950 4.529 4.084 5.018 0.068 2 0 "[ . 1 . 2]" 1
2023 1 78 ASN HB2 1 79 PHE H . . 4.780 4.444 3.987 4.681 . 0 0 "[ . 1 . 2]" 1
2024 1 78 ASN HB3 1 79 PHE H . . 4.160 4.225 4.004 4.548 0.388 18 0 "[ . 1 . 2]" 1
2025 1 79 PHE H 1 79 PHE HB2 . . 3.360 2.290 2.159 2.387 . 0 0 "[ . 1 . 2]" 1
2026 1 79 PHE H 1 79 PHE HB3 . . 3.950 3.533 3.458 3.621 . 0 0 "[ . 1 . 2]" 1
2027 1 79 PHE H 1 79 PHE QD . . 3.840 2.826 2.520 3.103 . 0 0 "[ . 1 . 2]" 1
2028 1 79 PHE H 1 80 THR H . . 4.960 4.456 4.346 4.594 . 0 0 "[ . 1 . 2]" 1
2029 1 79 PHE H 1 84 VAL QG . . 5.500 4.703 4.323 5.097 . 0 0 "[ . 1 . 2]" 1
2030 1 79 PHE HA 1 79 PHE QD . . 3.200 2.583 2.264 2.888 . 0 0 "[ . 1 . 2]" 1
2031 1 79 PHE HA 1 80 THR H . . 3.230 2.166 2.103 2.233 . 0 0 "[ . 1 . 2]" 1
2032 1 79 PHE HA 1 80 THR HA . . 5.470 4.496 4.434 4.586 . 0 0 "[ . 1 . 2]" 1
2033 1 79 PHE HA 1 80 THR MG . . 4.340 3.848 3.518 4.157 . 0 0 "[ . 1 . 2]" 1
2034 1 79 PHE HA 1 83 ASP H . . 5.500 5.176 4.879 5.552 0.052 2 0 "[ . 1 . 2]" 1
2035 1 79 PHE HA 1 83 ASP HB2 . . 5.210 3.130 2.678 3.628 . 0 0 "[ . 1 . 2]" 1
2036 1 79 PHE HA 1 83 ASP HB3 . . 4.920 3.834 3.181 4.456 . 0 0 "[ . 1 . 2]" 1
2037 1 79 PHE HA 1 84 VAL QG . . 5.500 4.342 4.012 4.694 . 0 0 "[ . 1 . 2]" 1
2038 1 79 PHE HB2 1 80 THR H . . 4.760 4.487 4.359 4.574 . 0 0 "[ . 1 . 2]" 1
2039 1 79 PHE HB2 1 83 ASP HB3 . . 5.500 4.857 4.360 5.307 . 0 0 "[ . 1 . 2]" 1
2040 1 79 PHE HB2 1 84 VAL QG . . 4.590 3.024 2.709 3.470 . 0 0 "[ . 1 . 2]" 1
2041 1 79 PHE HB3 1 80 THR H . . 4.550 3.659 3.387 3.795 . 0 0 "[ . 1 . 2]" 1
2042 1 79 PHE HB3 1 80 THR MG . . 5.500 5.412 5.164 5.593 0.093 7 0 "[ . 1 . 2]" 1
2043 1 79 PHE HB3 1 83 ASP H . . 5.500 4.778 4.521 5.196 . 0 0 "[ . 1 . 2]" 1
2044 1 79 PHE HB3 1 83 ASP HB3 . . 4.700 3.199 2.623 3.670 . 0 0 "[ . 1 . 2]" 1
2045 1 79 PHE HB3 1 84 VAL H . . 5.250 3.563 3.253 4.059 . 0 0 "[ . 1 . 2]" 1
2046 1 79 PHE HB3 1 84 VAL QG . . 4.020 2.396 2.213 2.556 . 0 0 "[ . 1 . 2]" 1
2047 1 79 PHE HB3 1 87 MET ME . . 5.500 3.018 2.624 3.691 . 0 0 "[ . 1 . 2]" 1
2048 1 79 PHE HB3 1 87 MET QG . . 5.130 4.284 3.620 4.705 . 0 0 "[ . 1 . 2]" 1
2049 1 79 PHE QD 1 80 THR H . . 4.110 3.923 3.454 4.190 0.080 7 0 "[ . 1 . 2]" 1
2050 1 79 PHE QD 1 83 ASP H . . 5.500 5.048 4.729 5.343 . 0 0 "[ . 1 . 2]" 1
2051 1 79 PHE QD 1 83 ASP HB2 . . 5.050 2.714 2.394 3.234 . 0 0 "[ . 1 . 2]" 1
2052 1 79 PHE QD 1 83 ASP HB3 . . 3.740 2.062 1.970 2.236 . 0 0 "[ . 1 . 2]" 1
2053 1 79 PHE QD 1 84 VAL HA . . 4.810 4.909 4.877 4.926 0.116 16 0 "[ . 1 . 2]" 1
2054 1 79 PHE QD 1 84 VAL QG . . 4.100 4.006 3.842 4.126 0.026 5 0 "[ . 1 . 2]" 1
2055 1 79 PHE QD 1 87 MET ME . . 3.760 3.320 2.887 3.870 0.110 2 0 "[ . 1 . 2]" 1
2056 1 79 PHE QE 1 87 MET ME . . 4.570 4.051 3.404 4.649 0.079 10 0 "[ . 1 . 2]" 1
2057 1 80 THR H 1 80 THR MG . . 3.440 2.349 2.079 2.644 . 0 0 "[ . 1 . 2]" 1
2058 1 80 THR H 1 82 THR H . . 5.420 5.120 4.902 5.379 . 0 0 "[ . 1 . 2]" 1
2059 1 80 THR H 1 83 ASP H . . 4.400 3.866 3.541 4.344 . 0 0 "[ . 1 . 2]" 1
2060 1 80 THR H 1 83 ASP HB2 . . 3.720 2.773 2.443 3.006 . 0 0 "[ . 1 . 2]" 1
2061 1 80 THR H 1 83 ASP HB3 . . 4.230 4.188 3.803 4.311 0.081 11 0 "[ . 1 . 2]" 1
2062 1 80 THR H 1 84 VAL H . . 5.300 4.496 4.125 4.873 . 0 0 "[ . 1 . 2]" 1
2063 1 80 THR H 1 84 VAL QG . . 5.500 4.357 4.020 4.700 . 0 0 "[ . 1 . 2]" 1
2064 1 80 THR HA 1 80 THR MG . . 3.300 2.356 2.181 2.537 . 0 0 "[ . 1 . 2]" 1
2065 1 80 THR HA 1 81 GLU H . . 3.260 2.598 2.430 2.778 . 0 0 "[ . 1 . 2]" 1
2066 1 80 THR HA 1 81 GLU HA . . 4.790 4.319 4.144 4.467 . 0 0 "[ . 1 . 2]" 1
2067 1 80 THR HA 1 81 GLU HG2 . . 5.460 5.208 4.886 5.540 0.080 7 0 "[ . 1 . 2]" 1
2068 1 80 THR HA 1 82 THR H . . 4.720 4.506 4.157 4.792 0.072 3 0 "[ . 1 . 2]" 1
2069 1 80 THR HB 1 81 GLU H . . 3.150 2.574 2.374 2.917 . 0 0 "[ . 1 . 2]" 1
2070 1 80 THR HB 1 81 GLU HA . . 5.500 4.878 4.697 5.041 . 0 0 "[ . 1 . 2]" 1
2071 1 80 THR HB 1 81 GLU HB3 . . 5.140 4.973 4.688 5.210 0.070 2 0 "[ . 1 . 2]" 1
2072 1 80 THR MG 1 81 GLU H . . 4.290 3.813 3.518 4.079 . 0 0 "[ . 1 . 2]" 1
2073 1 80 THR MG 1 81 GLU HG2 . . 5.500 5.377 5.054 5.592 0.092 8 0 "[ . 1 . 2]" 1
2074 1 80 THR MG 1 82 THR H . . 5.100 4.515 4.134 4.907 . 0 0 "[ . 1 . 2]" 1
2075 1 80 THR MG 1 82 THR HB . . 5.450 4.893 4.291 5.532 0.082 6 0 "[ . 1 . 2]" 1
2076 1 80 THR MG 1 83 ASP H . . 5.090 4.725 4.318 5.043 . 0 0 "[ . 1 . 2]" 1
2077 1 81 GLU H 1 81 GLU HB2 . . 3.660 3.678 3.619 3.723 0.063 18 0 "[ . 1 . 2]" 1
2078 1 81 GLU H 1 81 GLU HB3 . . 3.560 2.499 2.395 2.621 . 0 0 "[ . 1 . 2]" 1
2079 1 81 GLU H 1 81 GLU HG2 . . 4.270 2.709 2.456 3.090 . 0 0 "[ . 1 . 2]" 1
2080 1 81 GLU H 1 81 GLU HG3 . . 4.180 3.902 3.665 4.153 . 0 0 "[ . 1 . 2]" 1
2081 1 81 GLU H 1 82 THR H . . 3.600 2.791 2.584 2.974 . 0 0 "[ . 1 . 2]" 1
2082 1 81 GLU H 1 82 THR HB . . 5.500 5.296 5.067 5.534 0.034 5 0 "[ . 1 . 2]" 1
2083 1 81 GLU H 1 83 ASP H . . 5.250 4.143 4.002 4.330 . 0 0 "[ . 1 . 2]" 1
2084 1 81 GLU H 1 84 VAL QG . . 5.500 3.956 3.685 4.500 . 0 0 "[ . 1 . 2]" 1
2085 1 81 GLU HA 1 81 GLU HG3 . . 4.060 3.720 3.521 3.825 . 0 0 "[ . 1 . 2]" 1
2086 1 81 GLU HA 1 82 THR HA . . 5.500 4.748 4.628 4.837 . 0 0 "[ . 1 . 2]" 1
2087 1 81 GLU HA 1 83 ASP H . . 5.260 3.677 3.545 3.842 . 0 0 "[ . 1 . 2]" 1
2088 1 81 GLU HA 1 84 VAL H . . 3.930 3.033 2.776 3.311 . 0 0 "[ . 1 . 2]" 1
2089 1 81 GLU HA 1 84 VAL QG . . 3.380 2.091 1.876 2.691 . 0 0 "[ . 1 . 2]" 1
2090 1 81 GLU HA 1 85 LYS H . . 5.350 3.652 3.462 3.840 . 0 0 "[ . 1 . 2]" 1
2091 1 81 GLU HB2 1 82 THR H . . 4.440 3.983 3.895 4.097 . 0 0 "[ . 1 . 2]" 1
2092 1 81 GLU HB2 1 83 ASP H . . 5.130 5.152 5.075 5.201 0.071 8 0 "[ . 1 . 2]" 1
2093 1 81 GLU HB2 1 84 VAL H . . 5.180 4.944 4.694 5.186 0.006 7 0 "[ . 1 . 2]" 1
2094 1 81 GLU HB2 1 84 VAL QG . . 4.660 2.903 2.659 3.387 . 0 0 "[ . 1 . 2]" 1
2095 1 81 GLU HB2 1 85 LYS QB . . 4.540 4.631 4.619 4.645 0.105 2 0 "[ . 1 . 2]" 1
2096 1 81 GLU HB2 1 85 LYS HG2 . . 5.060 4.152 3.135 4.568 . 0 0 "[ . 1 . 2]" 1
2097 1 81 GLU HB2 1 85 LYS HG3 . . 5.500 3.080 2.775 4.886 . 0 0 "[ . 1 . 2]" 1
2098 1 81 GLU HB3 1 82 THR H . . 3.870 3.921 3.715 3.954 0.084 13 0 "[ . 1 . 2]" 1
2099 1 81 GLU HB3 1 84 VAL QG . . 5.220 3.633 3.301 4.044 . 0 0 "[ . 1 . 2]" 1
2100 1 81 GLU HB3 1 85 LYS QD . . 4.950 4.863 4.486 5.030 0.080 7 0 "[ . 1 . 2]" 1
2101 1 81 GLU HG2 1 82 THR H . . 4.000 2.402 2.219 2.515 . 0 0 "[ . 1 . 2]" 1
2102 1 81 GLU HG2 1 82 THR HB . . 5.500 4.771 4.440 5.133 . 0 0 "[ . 1 . 2]" 1
2103 1 81 GLU HG2 1 83 ASP H . . 4.880 4.903 4.732 4.967 0.087 18 0 "[ . 1 . 2]" 1
2104 1 81 GLU HG2 1 85 LYS QD . . 5.010 4.885 3.714 5.095 0.085 17 0 "[ . 1 . 2]" 1
2105 1 81 GLU HG2 1 85 LYS QE . . 4.300 4.145 3.748 4.399 0.099 8 0 "[ . 1 . 2]" 1
2106 1 81 GLU HG3 1 82 THR H . . 5.320 2.790 2.530 3.216 . 0 0 "[ . 1 . 2]" 1
2107 1 81 GLU HG3 1 82 THR HA . . 4.820 3.165 2.754 3.596 . 0 0 "[ . 1 . 2]" 1
2108 1 81 GLU HG3 1 82 THR MG . . 5.500 4.294 4.014 4.573 . 0 0 "[ . 1 . 2]" 1
2109 1 81 GLU HG3 1 85 LYS QD . . 5.200 3.373 2.234 3.653 . 0 0 "[ . 1 . 2]" 1
2110 1 81 GLU HG3 1 85 LYS QE . . 5.450 2.633 2.127 3.509 . 0 0 "[ . 1 . 2]" 1
2111 1 81 GLU HG3 1 85 LYS HG2 . . 5.410 4.954 2.599 5.441 0.031 2 0 "[ . 1 . 2]" 1
2112 1 81 GLU HG3 1 85 LYS HG3 . . 5.070 3.693 3.167 3.978 . 0 0 "[ . 1 . 2]" 1
2113 1 82 THR H 1 82 THR HB . . 3.200 2.743 2.533 2.925 . 0 0 "[ . 1 . 2]" 1
2114 1 82 THR H 1 82 THR MG . . 4.610 3.717 3.628 3.798 . 0 0 "[ . 1 . 2]" 1
2115 1 82 THR H 1 83 ASP H . . 3.600 2.732 2.629 2.842 . 0 0 "[ . 1 . 2]" 1
2116 1 82 THR H 1 83 ASP HA . . 5.430 5.395 5.313 5.472 0.042 13 0 "[ . 1 . 2]" 1
2117 1 82 THR H 1 83 ASP HB2 . . 5.500 4.940 4.603 5.211 . 0 0 "[ . 1 . 2]" 1
2118 1 82 THR H 1 84 VAL QG . . 5.500 4.461 4.203 4.901 . 0 0 "[ . 1 . 2]" 1
2119 1 82 THR HA 1 84 VAL H . . 5.500 4.717 4.576 4.917 . 0 0 "[ . 1 . 2]" 1
2120 1 82 THR HA 1 84 VAL QG . . 4.920 4.695 4.526 4.837 . 0 0 "[ . 1 . 2]" 1
2121 1 82 THR HA 1 85 LYS H . . 4.370 3.762 3.399 4.076 . 0 0 "[ . 1 . 2]" 1
2122 1 82 THR HA 1 85 LYS QB . . 4.330 3.156 2.511 4.438 0.108 8 0 "[ . 1 . 2]" 1
2123 1 82 THR HA 1 85 LYS QD . . 4.590 4.328 3.042 4.658 0.068 9 0 "[ . 1 . 2]" 1
2124 1 82 THR HA 1 85 LYS QE . . 4.400 2.374 1.962 2.699 . 0 0 "[ . 1 . 2]" 1
2125 1 82 THR HA 1 85 LYS HG3 . . 5.500 3.790 2.288 4.127 . 0 0 "[ . 1 . 2]" 1
2126 1 82 THR HA 1 86 MET QG . . 5.500 4.031 3.698 4.316 . 0 0 "[ . 1 . 2]" 1
2127 1 82 THR HB 1 83 ASP H . . 3.630 3.349 3.092 3.528 . 0 0 "[ . 1 . 2]" 1
2128 1 82 THR HB 1 83 ASP HB2 . . 5.500 5.221 4.801 5.584 0.084 10 0 "[ . 1 . 2]" 1
2129 1 82 THR HB 1 85 LYS QE . . 5.240 4.976 4.498 5.320 0.080 19 0 "[ . 1 . 2]" 1
2130 1 82 THR HB 1 86 MET ME . . 5.130 4.988 4.509 5.213 0.083 2 0 "[ . 1 . 2]" 1
2131 1 82 THR HB 1 86 MET QG . . 5.500 5.089 4.962 5.146 . 0 0 "[ . 1 . 2]" 1
2132 1 82 THR MG 1 83 ASP H . . 4.860 4.210 4.089 4.301 . 0 0 "[ . 1 . 2]" 1
2133 1 82 THR MG 1 83 ASP HA . . 5.500 4.409 4.268 4.586 . 0 0 "[ . 1 . 2]" 1
2134 1 82 THR MG 1 85 LYS H . . 5.500 5.281 4.996 5.497 . 0 0 "[ . 1 . 2]" 1
2135 1 82 THR MG 1 85 LYS QD . . 5.500 5.139 3.841 5.452 . 0 0 "[ . 1 . 2]" 1
2136 1 82 THR MG 1 85 LYS QE . . 4.840 3.300 2.272 3.619 . 0 0 "[ . 1 . 2]" 1
2137 1 82 THR MG 1 85 LYS HG3 . . 5.500 5.353 3.884 5.600 0.100 10 0 "[ . 1 . 2]" 1
2138 1 82 THR MG 1 86 MET H . . 5.500 5.553 5.419 5.600 0.100 12 0 "[ . 1 . 2]" 1
2139 1 82 THR MG 1 86 MET ME . . 3.420 2.825 2.370 3.143 . 0 0 "[ . 1 . 2]" 1
2140 1 82 THR MG 1 86 MET QG . . 4.400 3.727 3.520 3.926 . 0 0 "[ . 1 . 2]" 1
2141 1 83 ASP H 1 83 ASP HB2 . . 3.760 2.460 2.289 2.664 . 0 0 "[ . 1 . 2]" 1
2142 1 83 ASP H 1 84 VAL H . . 3.610 2.269 2.083 2.446 . 0 0 "[ . 1 . 2]" 1
2143 1 83 ASP H 1 84 VAL QG . . 5.440 3.670 3.372 4.108 . 0 0 "[ . 1 . 2]" 1
2144 1 83 ASP H 1 85 LYS H . . 4.990 3.789 3.623 4.150 . 0 0 "[ . 1 . 2]" 1
2145 1 83 ASP H 1 85 LYS QE . . 5.310 5.056 4.765 5.389 0.079 9 0 "[ . 1 . 2]" 1
2146 1 83 ASP H 1 86 MET QG . . 5.500 4.348 4.158 4.559 . 0 0 "[ . 1 . 2]" 1
2147 1 83 ASP HA 1 86 MET H . . 4.220 3.708 3.480 4.027 . 0 0 "[ . 1 . 2]" 1
2148 1 83 ASP HA 1 86 MET HB2 . . 4.130 3.432 3.092 3.774 . 0 0 "[ . 1 . 2]" 1
2149 1 83 ASP HA 1 86 MET HB3 . . 5.000 4.840 4.591 5.058 0.058 20 0 "[ . 1 . 2]" 1
2150 1 83 ASP HA 1 86 MET QG . . 5.420 2.634 2.271 2.841 . 0 0 "[ . 1 . 2]" 1
2151 1 83 ASP HA 1 87 MET H . . 5.480 4.214 3.896 4.512 . 0 0 "[ . 1 . 2]" 1
2152 1 83 ASP HB2 1 84 VAL H . . 4.010 2.578 2.273 2.952 . 0 0 "[ . 1 . 2]" 1
2153 1 83 ASP HB2 1 84 VAL QG . . 5.500 3.501 3.037 4.061 . 0 0 "[ . 1 . 2]" 1
2154 1 83 ASP HB2 1 87 MET ME . . 5.500 4.642 4.094 5.292 . 0 0 "[ . 1 . 2]" 1
2155 1 83 ASP HB2 1 87 MET QG . . 5.500 4.720 4.313 5.204 . 0 0 "[ . 1 . 2]" 1
2156 1 83 ASP HB3 1 84 VAL H . . 4.590 3.327 2.634 3.732 . 0 0 "[ . 1 . 2]" 1
2157 1 83 ASP HB3 1 84 VAL QG . . 5.390 4.005 3.584 4.346 . 0 0 "[ . 1 . 2]" 1
2158 1 83 ASP HB3 1 87 MET ME . . 4.400 4.210 3.708 4.511 0.111 2 0 "[ . 1 . 2]" 1
2159 1 84 VAL H 1 84 VAL HB . . 3.530 3.121 1.928 3.613 0.083 3 0 "[ . 1 . 2]" 1
2160 1 84 VAL H 1 84 VAL QG . . 3.190 2.222 1.942 2.663 . 0 0 "[ . 1 . 2]" 1
2161 1 84 VAL H 1 85 LYS H . . 3.670 2.878 2.701 3.163 . 0 0 "[ . 1 . 2]" 1
2162 1 84 VAL H 1 87 MET ME . . 4.580 4.136 3.738 4.643 0.063 13 0 "[ . 1 . 2]" 1
2163 1 84 VAL HA 1 84 VAL QG . . 3.250 2.333 2.131 2.457 . 0 0 "[ . 1 . 2]" 1
2164 1 84 VAL HA 1 85 LYS QB . . 5.230 5.325 5.305 5.353 0.123 8 0 "[ . 1 . 2]" 1
2165 1 84 VAL HA 1 86 MET H . . 5.500 3.805 3.604 4.048 . 0 0 "[ . 1 . 2]" 1
2166 1 84 VAL HA 1 87 MET H . . 4.640 3.452 3.217 3.794 . 0 0 "[ . 1 . 2]" 1
2167 1 84 VAL HA 1 87 MET HB2 . . 4.540 4.608 4.581 4.626 0.086 5 0 "[ . 1 . 2]" 1
2168 1 84 VAL HA 1 87 MET HB3 . . 4.320 4.102 3.613 4.345 0.025 3 0 "[ . 1 . 2]" 1
2169 1 84 VAL HA 1 87 MET ME . . 3.320 2.410 2.089 3.117 . 0 0 "[ . 1 . 2]" 1
2170 1 84 VAL HA 1 88 GLU H . . 4.800 3.739 3.572 3.999 . 0 0 "[ . 1 . 2]" 1
2171 1 84 VAL HA 1 88 GLU HA . . 5.500 5.569 5.409 5.593 0.093 16 0 "[ . 1 . 2]" 1
2172 1 84 VAL HA 1 88 GLU HG2 . . 5.500 4.201 3.235 5.358 . 0 0 "[ . 1 . 2]" 1
2173 1 84 VAL HB 1 85 LYS H . . 3.990 3.669 2.789 4.052 0.062 19 0 "[ . 1 . 2]" 1
2174 1 84 VAL HB 1 85 LYS HG2 . . 5.500 5.361 4.040 5.582 0.082 20 0 "[ . 1 . 2]" 1
2175 1 84 VAL QG 1 85 LYS H . . 4.310 2.330 2.163 2.515 . 0 0 "[ . 1 . 2]" 1
2176 1 84 VAL QG 1 85 LYS HA . . 4.670 3.105 2.996 3.199 . 0 0 "[ . 1 . 2]" 1
2177 1 84 VAL QG 1 85 LYS QD . . 4.160 3.953 3.782 4.203 0.043 7 0 "[ . 1 . 2]" 1
2178 1 84 VAL QG 1 85 LYS QE . . 5.500 4.337 4.015 5.091 . 0 0 "[ . 1 . 2]" 1
2179 1 84 VAL QG 1 85 LYS HG2 . . 3.960 3.058 2.680 3.275 . 0 0 "[ . 1 . 2]" 1
2180 1 84 VAL QG 1 85 LYS HG3 . . 3.700 2.621 2.218 3.864 0.164 7 0 "[ . 1 . 2]" 1
2181 1 84 VAL QG 1 86 MET H . . 5.500 4.186 4.104 4.250 . 0 0 "[ . 1 . 2]" 1
2182 1 84 VAL QG 1 87 MET ME . . 3.700 2.274 1.934 2.779 . 0 0 "[ . 1 . 2]" 1
2183 1 84 VAL QG 1 87 MET QG . . 4.210 3.269 3.104 3.468 . 0 0 "[ . 1 . 2]" 1
2184 1 84 VAL QG 1 88 GLU H . . 5.500 4.335 4.037 4.485 . 0 0 "[ . 1 . 2]" 1
2185 1 84 VAL QG 1 88 GLU HB2 . . 5.120 4.333 3.982 4.862 . 0 0 "[ . 1 . 2]" 1
2186 1 84 VAL QG 1 88 GLU HG2 . . 4.110 3.585 2.887 4.115 0.005 1 0 "[ . 1 . 2]" 1
2187 1 84 VAL QG 1 88 GLU HG3 . . 4.230 2.923 2.553 3.307 . 0 0 "[ . 1 . 2]" 1
2188 1 85 LYS H 1 85 LYS QB . . 3.630 2.295 2.142 2.843 . 0 0 "[ . 1 . 2]" 1
2189 1 85 LYS H 1 85 LYS QD . . 5.500 4.189 3.854 4.310 . 0 0 "[ . 1 . 2]" 1
2190 1 85 LYS H 1 85 LYS QE . . 5.500 3.755 3.408 4.368 . 0 0 "[ . 1 . 2]" 1
2191 1 85 LYS H 1 85 LYS HG2 . . 4.040 3.235 2.211 3.497 . 0 0 "[ . 1 . 2]" 1
2192 1 85 LYS H 1 85 LYS HG3 . . 4.520 2.321 2.081 2.424 . 0 0 "[ . 1 . 2]" 1
2193 1 85 LYS H 1 86 MET H . . 3.260 2.767 2.638 2.869 . 0 0 "[ . 1 . 2]" 1
2194 1 85 LYS H 1 86 MET QG . . 5.500 3.781 3.690 3.901 . 0 0 "[ . 1 . 2]" 1
2195 1 85 LYS H 1 87 MET H . . 5.300 4.599 4.422 4.758 . 0 0 "[ . 1 . 2]" 1
2196 1 85 LYS HA 1 85 LYS HG2 . . 4.200 2.479 2.253 3.655 . 0 0 "[ . 1 . 2]" 1
2197 1 85 LYS HA 1 85 LYS HG3 . . 4.090 3.176 2.977 3.847 . 0 0 "[ . 1 . 2]" 1
2198 1 85 LYS HA 1 88 GLU H . . 4.240 3.833 3.436 4.242 0.002 18 0 "[ . 1 . 2]" 1
2199 1 85 LYS HA 1 88 GLU HB2 . . 3.790 2.880 2.503 3.853 0.063 2 0 "[ . 1 . 2]" 1
2200 1 85 LYS HA 1 88 GLU HG2 . . 4.580 4.333 3.817 4.709 0.129 18 0 "[ . 1 . 2]" 1
2201 1 85 LYS HA 1 88 GLU HG3 . . 5.250 3.185 2.266 3.949 . 0 0 "[ . 1 . 2]" 1
2202 1 85 LYS QB 1 86 MET H . . 3.630 3.166 2.828 3.733 0.103 7 0 "[ . 1 . 2]" 1
2203 1 85 LYS QE 1 86 MET ME . . 5.500 4.562 3.094 5.561 0.061 1 0 "[ . 1 . 2]" 1
2204 1 85 LYS HG2 1 86 MET H . . 5.390 5.084 4.419 5.269 . 0 0 "[ . 1 . 2]" 1
2205 1 86 MET H 1 86 MET QG . . 3.540 2.086 1.907 2.309 . 0 0 "[ . 1 . 2]" 1
2206 1 86 MET H 1 87 MET H . . 3.760 2.405 2.265 2.553 . 0 0 "[ . 1 . 2]" 1
2207 1 86 MET H 1 87 MET QG . . 4.300 3.490 3.174 3.983 . 0 0 "[ . 1 . 2]" 1
2208 1 86 MET H 1 88 GLU H . . 4.230 3.586 3.406 3.742 . 0 0 "[ . 1 . 2]" 1
2209 1 86 MET H 1 88 GLU HB2 . . 5.500 4.545 4.219 5.392 . 0 0 "[ . 1 . 2]" 1
2210 1 86 MET H 1 88 GLU HG3 . . 5.500 5.176 4.259 5.829 0.329 4 0 "[ . 1 . 2]" 1
2211 1 86 MET H 1 89 ARG H . . 5.500 5.119 4.843 5.305 . 0 0 "[ . 1 . 2]" 1
2212 1 86 MET HA 1 86 MET ME . . 4.840 4.143 3.636 4.420 . 0 0 "[ . 1 . 2]" 1
2213 1 86 MET HA 1 86 MET QG . . 3.810 3.187 3.084 3.284 . 0 0 "[ . 1 . 2]" 1
2214 1 86 MET HA 1 87 MET HA . . 5.200 4.774 4.674 4.872 . 0 0 "[ . 1 . 2]" 1
2215 1 86 MET HA 1 88 GLU H . . 5.040 4.308 4.118 4.497 . 0 0 "[ . 1 . 2]" 1
2216 1 86 MET HA 1 89 ARG H . . 4.360 3.941 3.691 4.103 . 0 0 "[ . 1 . 2]" 1
2217 1 86 MET HA 1 89 ARG HD3 . . 3.960 3.318 1.908 4.027 0.067 20 0 "[ . 1 . 2]" 1
2218 1 86 MET HA 1 89 ARG HE . . 5.050 4.287 3.267 5.111 0.061 15 0 "[ . 1 . 2]" 1
2219 1 86 MET HB2 1 87 MET H . . 4.350 2.372 2.120 2.802 . 0 0 "[ . 1 . 2]" 1
2220 1 86 MET HB2 1 87 MET QG . . 4.750 4.152 3.782 4.489 . 0 0 "[ . 1 . 2]" 1
2221 1 86 MET HB3 1 86 MET ME . . 4.020 3.379 2.890 3.978 . 0 0 "[ . 1 . 2]" 1
2222 1 86 MET HB3 1 87 MET H . . 4.640 3.697 3.463 4.098 . 0 0 "[ . 1 . 2]" 1
2223 1 86 MET ME 1 86 MET QG . . 3.520 2.180 2.060 2.282 . 0 0 "[ . 1 . 2]" 1
2224 1 86 MET QG 1 87 MET H . . 5.120 3.527 3.347 3.691 . 0 0 "[ . 1 . 2]" 1
2225 1 86 MET QG 1 87 MET QG . . 5.390 4.708 4.536 4.987 . 0 0 "[ . 1 . 2]" 1
2226 1 87 MET H 1 87 MET HB2 . . 4.110 3.578 3.428 3.675 . 0 0 "[ . 1 . 2]" 1
2227 1 87 MET H 1 87 MET HB3 . . 3.710 2.553 2.228 2.804 . 0 0 "[ . 1 . 2]" 1
2228 1 87 MET H 1 87 MET ME . . 5.500 4.455 4.237 4.631 . 0 0 "[ . 1 . 2]" 1
2229 1 87 MET H 1 87 MET QG . . 5.010 2.120 1.795 2.541 . 0 0 "[ . 1 . 2]" 1
2230 1 87 MET H 1 88 GLU H . . 3.710 2.791 2.694 2.985 . 0 0 "[ . 1 . 2]" 1
2231 1 87 MET H 1 88 GLU HA . . 5.500 5.322 5.105 5.557 0.057 18 0 "[ . 1 . 2]" 1
2232 1 87 MET H 1 89 ARG H . . 5.320 4.293 4.137 4.605 . 0 0 "[ . 1 . 2]" 1
2233 1 87 MET H 1 90 VAL QG . . 5.500 3.818 3.448 4.057 . 0 0 "[ . 1 . 2]" 1
2234 1 87 MET HA 1 89 ARG H . . 5.320 3.517 3.262 4.031 . 0 0 "[ . 1 . 2]" 1
2235 1 87 MET HA 1 89 ARG HD3 . . 5.500 5.543 5.339 5.595 0.095 20 0 "[ . 1 . 2]" 1
2236 1 87 MET HA 1 90 VAL H . . 4.090 2.588 2.200 3.134 . 0 0 "[ . 1 . 2]" 1
2237 1 87 MET HA 1 90 VAL HB . . 3.870 2.480 1.870 3.963 0.093 5 0 "[ . 1 . 2]" 1
2238 1 87 MET HA 1 90 VAL QG . . 3.700 2.151 1.830 2.522 . 0 0 "[ . 1 . 2]" 1
2239 1 87 MET HA 1 91 VAL H . . 4.410 3.512 3.243 3.718 . 0 0 "[ . 1 . 2]" 1
2240 1 87 MET HA 1 91 VAL MG2 . . 4.770 4.092 3.501 4.846 0.076 20 0 "[ . 1 . 2]" 1
2241 1 87 MET HB2 1 88 GLU H . . 4.060 3.941 3.740 4.108 0.048 20 0 "[ . 1 . 2]" 1
2242 1 87 MET HB2 1 90 VAL QG . . 5.500 3.352 2.664 3.967 . 0 0 "[ . 1 . 2]" 1
2243 1 87 MET HB2 1 91 VAL HB . . 4.610 4.464 3.741 4.676 0.066 4 0 "[ . 1 . 2]" 1
2244 1 87 MET HB2 1 91 VAL MG2 . . 3.940 3.218 2.584 4.022 0.082 7 0 "[ . 1 . 2]" 1
2245 1 87 MET HB3 1 87 MET ME . . 3.440 3.498 2.817 3.569 0.129 10 0 "[ . 1 . 2]" 1
2246 1 87 MET HB3 1 88 GLU H . . 4.390 4.142 3.949 4.323 . 0 0 "[ . 1 . 2]" 1
2247 1 87 MET HB3 1 90 VAL QG . . 5.500 3.442 3.045 3.781 . 0 0 "[ . 1 . 2]" 1
2248 1 87 MET HB3 1 91 VAL MG2 . . 5.500 4.562 4.011 5.464 . 0 0 "[ . 1 . 2]" 1
2249 1 87 MET ME 1 88 GLU HA . . 5.380 5.111 4.736 5.490 0.110 13 0 "[ . 1 . 2]" 1
2250 1 87 MET QG 1 88 GLU HG3 . . 4.050 3.912 2.611 4.701 0.651 4 1 "[ +. 1 . 2]" 1
2251 1 87 MET QG 1 91 VAL MG2 . . 5.360 4.646 4.015 5.071 . 0 0 "[ . 1 . 2]" 1
2252 1 88 GLU H 1 88 GLU HB2 . . 3.170 2.297 2.169 2.811 . 0 0 "[ . 1 . 2]" 1
2253 1 88 GLU H 1 88 GLU HB3 . . 3.550 3.521 3.465 3.617 0.067 2 0 "[ . 1 . 2]" 1
2254 1 88 GLU H 1 88 GLU HG2 . . 3.850 2.883 2.371 3.738 . 0 0 "[ . 1 . 2]" 1
2255 1 88 GLU H 1 88 GLU HG3 . . 4.080 3.107 2.440 3.651 . 0 0 "[ . 1 . 2]" 1
2256 1 88 GLU H 1 89 ARG H . . 3.580 2.828 2.739 3.050 . 0 0 "[ . 1 . 2]" 1
2257 1 88 GLU H 1 90 VAL H . . 4.370 4.178 4.053 4.371 0.001 18 0 "[ . 1 . 2]" 1
2258 1 88 GLU HA 1 88 GLU HG2 . . 4.040 2.459 2.224 2.747 . 0 0 "[ . 1 . 2]" 1
2259 1 88 GLU HA 1 88 GLU HG3 . . 3.200 3.404 2.716 3.713 0.513 18 1 "[ . 1 . + 2]" 1
2260 1 88 GLU HA 1 90 VAL H . . 5.400 4.762 4.446 5.071 . 0 0 "[ . 1 . 2]" 1
2261 1 88 GLU HA 1 91 VAL H . . 4.700 4.336 4.022 4.573 . 0 0 "[ . 1 . 2]" 1
2262 1 88 GLU HA 1 91 VAL MG1 . . 5.020 4.929 4.586 5.101 0.081 16 0 "[ . 1 . 2]" 1
2263 1 88 GLU HB2 1 89 ARG H . . 3.680 3.245 2.749 3.676 . 0 0 "[ . 1 . 2]" 1
2264 1 88 GLU HB2 1 89 ARG HD3 . . 5.200 3.177 2.188 4.866 . 0 0 "[ . 1 . 2]" 1
2265 1 88 GLU HB3 1 89 ARG H . . 4.590 3.895 3.447 4.265 . 0 0 "[ . 1 . 2]" 1
2266 1 88 GLU HG2 1 89 ARG H . . 5.500 4.950 4.609 5.261 . 0 0 "[ . 1 . 2]" 1
2267 1 88 GLU HG3 1 89 ARG H . . 4.940 5.182 4.220 5.568 0.628 16 4 "[ *. -1 .+* 2]" 1
2268 1 89 ARG H 1 89 ARG HB2 . . 3.180 2.774 2.423 3.654 0.474 2 0 "[ . 1 . 2]" 1
2269 1 89 ARG H 1 89 ARG HB3 . . 3.600 3.628 2.853 3.690 0.090 16 0 "[ . 1 . 2]" 1
2270 1 89 ARG H 1 89 ARG HD2 . . 5.500 2.839 1.779 3.359 . 0 0 "[ . 1 . 2]" 1
2271 1 89 ARG H 1 89 ARG HD3 . . 5.500 2.613 2.211 3.189 . 0 0 "[ . 1 . 2]" 1
2272 1 89 ARG H 1 89 ARG HG3 . . 3.870 3.810 3.176 4.283 0.413 8 0 "[ . 1 . 2]" 1
2273 1 89 ARG H 1 90 VAL H . . 3.390 2.179 1.948 2.349 . 0 0 "[ . 1 . 2]" 1
2274 1 89 ARG H 1 90 VAL QG . . 5.150 3.667 3.344 3.924 . 0 0 "[ . 1 . 2]" 1
2275 1 89 ARG H 1 91 VAL H . . 4.930 4.087 3.709 4.642 . 0 0 "[ . 1 . 2]" 1
2276 1 89 ARG HA 1 89 ARG HD2 . . 3.890 3.157 2.387 3.918 0.028 4 0 "[ . 1 . 2]" 1
2277 1 89 ARG HA 1 89 ARG HG2 . . 4.060 3.794 3.581 3.947 . 0 0 "[ . 1 . 2]" 1
2278 1 89 ARG HA 1 89 ARG HG3 . . 3.880 3.189 2.325 4.146 0.266 2 0 "[ . 1 . 2]" 1
2279 1 89 ARG HA 1 90 VAL HA . . 5.500 4.858 4.698 4.972 . 0 0 "[ . 1 . 2]" 1
2280 1 89 ARG HA 1 90 VAL QG . . 5.500 4.923 4.716 5.101 . 0 0 "[ . 1 . 2]" 1
2281 1 89 ARG HA 1 91 VAL H . . 5.500 4.622 4.399 4.992 . 0 0 "[ . 1 . 2]" 1
2282 1 89 ARG HA 1 92 GLU HB2 . . 4.690 2.788 2.247 3.181 . 0 0 "[ . 1 . 2]" 1
2283 1 89 ARG HA 1 92 GLU QG . . 4.990 4.288 3.670 4.614 . 0 0 "[ . 1 . 2]" 1
2284 1 89 ARG HA 1 93 GLN H . . 4.790 4.087 3.843 4.392 . 0 0 "[ . 1 . 2]" 1
2285 1 89 ARG HA 1 93 GLN HE22 . . 5.500 4.719 3.885 5.657 0.157 18 0 "[ . 1 . 2]" 1
2286 1 89 ARG HB2 1 89 ARG HE . . 5.270 4.435 3.467 5.079 . 0 0 "[ . 1 . 2]" 1
2287 1 89 ARG HB2 1 90 VAL H . . 3.780 2.949 2.530 3.567 . 0 0 "[ . 1 . 2]" 1
2288 1 89 ARG HB3 1 89 ARG HE . . 5.500 4.651 2.543 5.337 . 0 0 "[ . 1 . 2]" 1
2289 1 89 ARG HB3 1 90 VAL H . . 4.380 3.996 3.545 4.409 0.029 6 0 "[ . 1 . 2]" 1
2290 1 89 ARG HB3 1 90 VAL HA . . 5.020 4.826 4.285 5.737 0.717 2 1 "[ + . 1 . 2]" 1
2291 1 89 ARG HD2 1 90 VAL H . . 4.980 4.711 3.538 5.054 0.074 6 0 "[ . 1 . 2]" 1
2292 1 89 ARG HG2 1 90 VAL H . . 5.500 4.543 2.086 5.476 . 0 0 "[ . 1 . 2]" 1
2293 1 89 ARG HG3 1 90 VAL H . . 5.010 5.014 3.727 5.343 0.333 14 0 "[ . 1 . 2]" 1
2294 1 90 VAL H 1 90 VAL HB . . 3.440 2.710 2.335 3.526 0.086 9 0 "[ . 1 . 2]" 1
2295 1 90 VAL H 1 90 VAL QG . . 3.730 2.139 1.919 2.418 . 0 0 "[ . 1 . 2]" 1
2296 1 90 VAL H 1 91 VAL H . . 3.410 2.977 2.714 3.174 . 0 0 "[ . 1 . 2]" 1
2297 1 90 VAL H 1 91 VAL MG2 . . 5.450 4.724 4.217 5.293 . 0 0 "[ . 1 . 2]" 1
2298 1 90 VAL HA 1 91 VAL MG2 . . 5.500 4.977 4.847 5.224 . 0 0 "[ . 1 . 2]" 1
2299 1 90 VAL HA 1 93 GLN H . . 4.320 3.421 3.174 3.611 . 0 0 "[ . 1 . 2]" 1
2300 1 90 VAL HA 1 93 GLN HE21 . . 5.480 4.092 3.441 4.923 . 0 0 "[ . 1 . 2]" 1
2301 1 90 VAL HA 1 93 GLN HG2 . . 3.920 2.561 2.171 2.983 . 0 0 "[ . 1 . 2]" 1
2302 1 90 VAL HA 1 93 GLN HG3 . . 4.890 3.670 2.501 4.245 . 0 0 "[ . 1 . 2]" 1
2303 1 90 VAL HB 1 91 VAL H . . 3.850 2.694 2.159 3.927 0.077 3 0 "[ . 1 . 2]" 1
2304 1 90 VAL HB 1 91 VAL MG2 . . 5.500 3.474 2.793 4.580 . 0 0 "[ . 1 . 2]" 1
2305 1 90 VAL HB 1 93 GLN H . . 5.500 5.358 4.863 5.559 0.059 4 0 "[ . 1 . 2]" 1
2306 1 90 VAL QG 1 91 VAL H . . 3.850 2.711 2.038 3.060 . 0 0 "[ . 1 . 2]" 1
2307 1 90 VAL QG 1 91 VAL MG2 . . 3.890 2.569 2.118 2.921 . 0 0 "[ . 1 . 2]" 1
2308 1 90 VAL QG 1 93 GLN H . . 5.500 4.376 4.094 4.581 . 0 0 "[ . 1 . 2]" 1
2309 1 90 VAL QG 1 93 GLN HB2 . . 5.500 4.070 3.528 4.586 . 0 0 "[ . 1 . 2]" 1
2310 1 90 VAL QG 1 94 MET H . . 5.130 4.349 4.074 4.589 . 0 0 "[ . 1 . 2]" 1
2311 1 90 VAL QG 1 94 MET ME . . 3.590 2.624 2.086 3.338 . 0 0 "[ . 1 . 2]" 1
2312 1 90 VAL QG 1 94 MET QG . . 4.910 4.098 3.565 4.448 . 0 0 "[ . 1 . 2]" 1
2313 1 91 VAL H 1 91 VAL HB . . 3.210 2.239 2.080 2.468 . 0 0 "[ . 1 . 2]" 1
2314 1 91 VAL H 1 91 VAL MG1 . . 4.330 3.654 3.509 3.779 . 0 0 "[ . 1 . 2]" 1
2315 1 91 VAL H 1 91 VAL MG2 . . 3.450 2.430 2.127 2.877 . 0 0 "[ . 1 . 2]" 1
2316 1 91 VAL H 1 92 GLU H . . 3.250 2.642 2.495 2.760 . 0 0 "[ . 1 . 2]" 1
2317 1 91 VAL H 1 92 GLU HB3 . . 5.060 5.128 4.872 5.509 0.449 7 0 "[ . 1 . 2]" 1
2318 1 91 VAL H 1 93 GLN H . . 5.110 4.273 4.010 4.447 . 0 0 "[ . 1 . 2]" 1
2319 1 91 VAL H 1 94 MET ME . . 5.240 4.114 3.696 4.479 . 0 0 "[ . 1 . 2]" 1
2320 1 91 VAL HA 1 91 VAL MG2 . . 3.380 2.240 2.121 2.372 . 0 0 "[ . 1 . 2]" 1
2321 1 91 VAL HA 1 93 GLN H . . 5.190 4.308 4.033 4.560 . 0 0 "[ . 1 . 2]" 1
2322 1 91 VAL HA 1 94 MET HB2 . . 4.290 3.830 3.373 4.264 . 0 0 "[ . 1 . 2]" 1
2323 1 91 VAL HA 1 94 MET ME . . 3.310 2.048 1.874 2.634 . 0 0 "[ . 1 . 2]" 1
2324 1 91 VAL HA 1 94 MET QG . . 5.120 4.393 3.228 4.739 . 0 0 "[ . 1 . 2]" 1
2325 1 91 VAL HA 1 95 CYS H . . 4.700 4.101 3.891 4.351 . 0 0 "[ . 1 . 2]" 1
2326 1 91 VAL HB 1 92 GLU H . . 4.140 2.983 2.682 3.296 . 0 0 "[ . 1 . 2]" 1
2327 1 91 VAL MG1 1 92 GLU H . . 4.470 3.390 3.043 3.722 . 0 0 "[ . 1 . 2]" 1
2328 1 91 VAL MG1 1 92 GLU HA . . 4.930 3.661 3.252 4.009 . 0 0 "[ . 1 . 2]" 1
2329 1 91 VAL MG1 1 95 CYS H . . 4.650 4.157 3.986 4.525 . 0 0 "[ . 1 . 2]" 1
2330 1 91 VAL MG2 1 92 GLU H . . 4.560 4.133 3.832 4.341 . 0 0 "[ . 1 . 2]" 1
2331 1 91 VAL MG2 1 93 GLN H . . 5.500 5.504 5.330 5.588 0.088 4 0 "[ . 1 . 2]" 1
2332 1 91 VAL MG2 1 94 MET ME . . 4.280 2.395 2.025 2.830 . 0 0 "[ . 1 . 2]" 1
2333 1 91 VAL MG2 1 95 CYS H . . 5.500 5.468 5.122 5.601 0.101 15 0 "[ . 1 . 2]" 1
2334 1 92 GLU H 1 92 GLU HB2 . . 3.150 2.302 2.042 2.542 . 0 0 "[ . 1 . 2]" 1
2335 1 92 GLU H 1 92 GLU HB3 . . 3.180 2.813 2.577 3.078 . 0 0 "[ . 1 . 2]" 1
2336 1 92 GLU H 1 92 GLU QG . . 4.470 3.855 3.651 3.950 . 0 0 "[ . 1 . 2]" 1
2337 1 92 GLU H 1 93 GLN H . . 3.570 2.921 2.750 3.195 . 0 0 "[ . 1 . 2]" 1
2338 1 92 GLU H 1 95 CYS H . . 5.500 4.881 4.691 5.104 . 0 0 "[ . 1 . 2]" 1
2339 1 92 GLU H 1 95 CYS HB2 . . 5.500 5.115 4.601 5.578 0.078 1 0 "[ . 1 . 2]" 1
2340 1 92 GLU HA 1 92 GLU QG . . 3.840 2.224 2.119 2.345 . 0 0 "[ . 1 . 2]" 1
2341 1 92 GLU HA 1 95 CYS H . . 4.310 3.586 3.376 3.783 . 0 0 "[ . 1 . 2]" 1
2342 1 92 GLU HA 1 95 CYS HA . . 5.500 5.328 5.065 5.572 0.072 8 0 "[ . 1 . 2]" 1
2343 1 92 GLU HA 1 95 CYS HB3 . . 4.550 3.326 2.341 4.222 . 0 0 "[ . 1 . 2]" 1
2344 1 92 GLU HA 1 96 VAL H . . 5.210 3.753 3.457 3.899 . 0 0 "[ . 1 . 2]" 1
2345 1 92 GLU HB2 1 93 GLN H . . 4.410 3.871 3.553 4.183 . 0 0 "[ . 1 . 2]" 1
2346 1 92 GLU HB3 1 93 GLN H . . 4.300 2.770 2.566 3.166 . 0 0 "[ . 1 . 2]" 1
2347 1 92 GLU QG 1 93 GLN H . . 5.250 4.086 3.718 4.418 . 0 0 "[ . 1 . 2]" 1
2348 1 92 GLU QG 1 95 CYS HB2 . . 5.420 4.148 3.165 4.960 . 0 0 "[ . 1 . 2]" 1
2349 1 92 GLU QG 1 95 CYS HB3 . . 5.500 4.059 3.281 4.966 . 0 0 "[ . 1 . 2]" 1
2350 1 92 GLU QG 1 96 VAL H . . 5.500 3.817 3.526 4.582 . 0 0 "[ . 1 . 2]" 1
2351 1 92 GLU QG 1 96 VAL QG . . 5.500 2.632 1.949 4.015 . 0 0 "[ . 1 . 2]" 1
2352 1 93 GLN H 1 93 GLN HB2 . . 2.950 2.644 2.509 2.784 . 0 0 "[ . 1 . 2]" 1
2353 1 93 GLN H 1 93 GLN HB3 . . 3.580 3.641 3.625 3.653 0.073 6 0 "[ . 1 . 2]" 1
2354 1 93 GLN H 1 93 GLN HE21 . . 5.020 3.336 2.734 4.131 . 0 0 "[ . 1 . 2]" 1
2355 1 93 GLN H 1 93 GLN HG2 . . 3.840 2.478 2.118 2.766 . 0 0 "[ . 1 . 2]" 1
2356 1 93 GLN H 1 93 GLN HG3 . . 4.060 3.872 3.527 4.069 0.009 20 0 "[ . 1 . 2]" 1
2357 1 93 GLN H 1 94 MET H . . 3.480 3.064 2.774 3.228 . 0 0 "[ . 1 . 2]" 1
2358 1 93 GLN H 1 94 MET QG . . 5.500 5.036 4.150 5.334 . 0 0 "[ . 1 . 2]" 1
2359 1 93 GLN H 1 95 CYS H . . 4.840 4.215 3.973 4.403 . 0 0 "[ . 1 . 2]" 1
2360 1 93 GLN H 1 96 VAL H . . 5.500 4.698 4.570 4.865 . 0 0 "[ . 1 . 2]" 1
2361 1 93 GLN HA 1 93 GLN HE21 . . 4.950 4.021 3.421 4.630 . 0 0 "[ . 1 . 2]" 1
2362 1 93 GLN HA 1 93 GLN HE22 . . 5.500 3.908 3.287 4.394 . 0 0 "[ . 1 . 2]" 1
2363 1 93 GLN HA 1 93 GLN HG2 . . 3.770 3.502 3.240 3.655 . 0 0 "[ . 1 . 2]" 1
2364 1 93 GLN HA 1 93 GLN HG3 . . 3.870 3.767 3.635 3.933 0.063 18 0 "[ . 1 . 2]" 1
2365 1 93 GLN HA 1 94 MET QG . . 5.500 5.214 4.840 5.360 . 0 0 "[ . 1 . 2]" 1
2366 1 93 GLN HA 1 95 CYS H . . 5.020 4.494 4.342 4.669 . 0 0 "[ . 1 . 2]" 1
2367 1 93 GLN HA 1 96 VAL H . . 3.970 3.571 3.258 4.020 0.050 18 0 "[ . 1 . 2]" 1
2368 1 93 GLN HA 1 96 VAL HB . . 3.910 2.982 2.604 3.433 . 0 0 "[ . 1 . 2]" 1
2369 1 93 GLN HA 1 96 VAL QG . . 3.920 2.543 2.305 2.923 . 0 0 "[ . 1 . 2]" 1
2370 1 93 GLN HA 1 97 THR H . . 4.670 3.816 3.584 4.271 . 0 0 "[ . 1 . 2]" 1
2371 1 93 GLN HA 1 97 THR HB . . 4.770 4.855 4.840 4.866 0.096 15 0 "[ . 1 . 2]" 1
2372 1 93 GLN HB2 1 93 GLN HG2 . . 3.000 2.343 2.245 2.510 . 0 0 "[ . 1 . 2]" 1
2373 1 93 GLN HB2 1 94 MET H . . 4.240 2.364 2.257 2.490 . 0 0 "[ . 1 . 2]" 1
2374 1 93 GLN HB3 1 93 GLN HG3 . . 3.000 2.324 2.190 2.539 . 0 0 "[ . 1 . 2]" 1
2375 1 93 GLN HB3 1 94 MET H . . 3.380 3.407 3.214 3.462 0.082 9 0 "[ . 1 . 2]" 1
2376 1 93 GLN HB3 1 94 MET HA . . 5.130 4.063 3.910 4.264 . 0 0 "[ . 1 . 2]" 1
2377 1 93 GLN HB3 1 94 MET QG . . 5.500 3.969 3.630 4.273 . 0 0 "[ . 1 . 2]" 1
2378 1 93 GLN HB3 1 95 CYS H . . 5.500 5.431 5.288 5.566 0.066 18 0 "[ . 1 . 2]" 1
2379 1 93 GLN HB3 1 97 THR H . . 5.500 4.859 4.569 5.398 . 0 0 "[ . 1 . 2]" 1
2380 1 93 GLN HE21 1 96 VAL QG . . 5.500 4.884 4.273 5.282 . 0 0 "[ . 1 . 2]" 1
2381 1 93 GLN HE22 1 96 VAL QG . . 5.310 4.216 3.644 5.058 . 0 0 "[ . 1 . 2]" 1
2382 1 93 GLN HG3 1 94 MET H . . 5.250 4.859 4.565 4.984 . 0 0 "[ . 1 . 2]" 1
2383 1 94 MET H 1 94 MET ME . . 4.410 3.315 2.944 3.796 . 0 0 "[ . 1 . 2]" 1
2384 1 94 MET H 1 94 MET QG . . 3.720 2.472 1.827 2.832 . 0 0 "[ . 1 . 2]" 1
2385 1 94 MET H 1 95 CYS H . . 3.410 2.661 2.570 2.793 . 0 0 "[ . 1 . 2]" 1
2386 1 94 MET H 1 96 VAL QG . . 5.500 4.790 4.596 5.010 . 0 0 "[ . 1 . 2]" 1
2387 1 94 MET H 1 97 THR HB . . 5.500 4.725 4.589 4.930 . 0 0 "[ . 1 . 2]" 1
2388 1 94 MET HA 1 94 MET QG . . 3.710 2.517 2.398 2.666 . 0 0 "[ . 1 . 2]" 1
2389 1 94 MET HA 1 96 VAL HB . . 5.500 5.501 5.045 5.597 0.097 11 0 "[ . 1 . 2]" 1
2390 1 94 MET HA 1 96 VAL QG . . 5.280 4.785 4.358 5.160 . 0 0 "[ . 1 . 2]" 1
2391 1 94 MET HA 1 97 THR H . . 4.140 3.427 3.247 3.605 . 0 0 "[ . 1 . 2]" 1
2392 1 94 MET HA 1 97 THR HA . . 5.500 5.220 5.008 5.460 . 0 0 "[ . 1 . 2]" 1
2393 1 94 MET HA 1 97 THR HB . . 3.490 2.263 2.083 2.499 . 0 0 "[ . 1 . 2]" 1
2394 1 94 MET HA 1 97 THR MG . . 5.060 3.364 3.272 3.463 . 0 0 "[ . 1 . 2]" 1
2395 1 94 MET HA 1 98 GLN H . . 5.110 3.707 3.535 3.935 . 0 0 "[ . 1 . 2]" 1
2396 1 94 MET HB2 1 94 MET ME . . 2.650 2.254 2.035 2.640 . 0 0 "[ . 1 . 2]" 1
2397 1 94 MET HB2 1 95 CYS H . . 4.290 2.762 2.592 2.911 . 0 0 "[ . 1 . 2]" 1
2398 1 94 MET HB2 1 95 CYS HA . . 4.060 4.143 4.126 4.155 0.095 19 0 "[ . 1 . 2]" 1
2399 1 94 MET HB2 1 97 THR HB . . 5.170 5.040 4.906 5.206 0.036 2 0 "[ . 1 . 2]" 1
2400 1 94 MET HB2 1 97 THR MG . . 5.500 5.599 5.567 5.618 0.118 10 0 "[ . 1 . 2]" 1
2401 1 94 MET HB3 1 94 MET ME . . 3.260 3.204 2.967 3.356 0.096 10 0 "[ . 1 . 2]" 1
2402 1 94 MET HB3 1 97 THR MG . . 5.050 4.560 4.482 4.613 . 0 0 "[ . 1 . 2]" 1
2403 1 94 MET QG 1 95 CYS H . . 5.500 4.283 3.681 4.442 . 0 0 "[ . 1 . 2]" 1
2404 1 95 CYS H 1 95 CYS HB2 . . 3.430 2.465 2.263 2.698 . 0 0 "[ . 1 . 2]" 1
2405 1 95 CYS H 1 95 CYS HB3 . . 3.790 3.166 2.610 3.633 . 0 0 "[ . 1 . 2]" 1
2406 1 95 CYS H 1 96 VAL H . . 3.620 2.844 2.675 2.950 . 0 0 "[ . 1 . 2]" 1
2407 1 95 CYS H 1 97 THR H . . 4.850 4.220 3.986 4.503 . 0 0 "[ . 1 . 2]" 1
2408 1 95 CYS H 1 97 THR HB . . 5.500 4.822 4.712 4.972 . 0 0 "[ . 1 . 2]" 1
2409 1 95 CYS HA 1 96 VAL QG . . 5.500 4.922 4.648 5.125 . 0 0 "[ . 1 . 2]" 1
2410 1 95 CYS HA 1 97 THR H . . 4.820 4.492 4.056 4.883 0.063 17 0 "[ . 1 . 2]" 1
2411 1 95 CYS HA 1 98 GLN H . . 4.250 3.448 3.062 3.713 . 0 0 "[ . 1 . 2]" 1
2412 1 95 CYS HA 1 98 GLN HB2 . . 4.280 3.355 2.865 3.731 . 0 0 "[ . 1 . 2]" 1
2413 1 95 CYS HA 1 98 GLN HB3 . . 3.900 2.986 2.609 3.473 . 0 0 "[ . 1 . 2]" 1
2414 1 95 CYS HA 1 98 GLN HG3 . . 5.400 5.073 4.276 5.483 0.083 16 0 "[ . 1 . 2]" 1
2415 1 95 CYS HB2 1 96 VAL H . . 4.480 3.130 2.229 3.899 . 0 0 "[ . 1 . 2]" 1
2416 1 95 CYS HB3 1 96 VAL H . . 4.490 2.888 2.413 3.378 . 0 0 "[ . 1 . 2]" 1
2417 1 95 CYS HB3 1 96 VAL HB . . 5.500 4.896 3.901 5.593 0.093 2 0 "[ . 1 . 2]" 1
2418 1 95 CYS HB3 1 96 VAL QG . . 5.500 3.915 3.130 4.737 . 0 0 "[ . 1 . 2]" 1
2419 1 95 CYS HB3 1 97 THR H . . 5.140 5.183 5.043 5.231 0.091 11 0 "[ . 1 . 2]" 1
2420 1 96 VAL H 1 96 VAL HB . . 3.230 2.319 1.912 2.971 . 0 0 "[ . 1 . 2]" 1
2421 1 96 VAL H 1 96 VAL QG . . 3.450 2.460 1.959 2.867 . 0 0 "[ . 1 . 2]" 1
2422 1 96 VAL H 1 97 THR H . . 3.600 2.696 2.577 2.815 . 0 0 "[ . 1 . 2]" 1
2423 1 96 VAL H 1 97 THR HB . . 5.500 4.477 4.304 4.637 . 0 0 "[ . 1 . 2]" 1
2424 1 96 VAL H 1 98 GLN H . . 5.500 4.273 4.135 4.427 . 0 0 "[ . 1 . 2]" 1
2425 1 96 VAL HA 1 96 VAL QG . . 3.270 2.149 2.076 2.238 . 0 0 "[ . 1 . 2]" 1
2426 1 96 VAL HA 1 97 THR HA . . 5.500 4.873 4.764 4.984 . 0 0 "[ . 1 . 2]" 1
2427 1 96 VAL HA 1 98 GLN H . . 5.500 4.725 4.539 4.939 . 0 0 "[ . 1 . 2]" 1
2428 1 96 VAL HA 1 99 TYR H . . 4.360 3.761 3.445 4.137 . 0 0 "[ . 1 . 2]" 1
2429 1 96 VAL HA 1 99 TYR HB2 . . 4.120 3.670 3.392 4.123 0.003 7 0 "[ . 1 . 2]" 1
2430 1 96 VAL HA 1 99 TYR HB3 . . 4.470 2.846 2.503 3.278 . 0 0 "[ . 1 . 2]" 1
2431 1 96 VAL HA 1 99 TYR QD . . 4.760 4.139 3.491 4.561 . 0 0 "[ . 1 . 2]" 1
2432 1 96 VAL HA 1 100 GLN H . . 5.500 4.402 4.135 4.762 . 0 0 "[ . 1 . 2]" 1
2433 1 96 VAL HA 1 100 GLN HG2 . . 5.280 4.504 4.058 5.338 0.058 4 0 "[ . 1 . 2]" 1
2434 1 96 VAL HB 1 97 THR H . . 3.430 2.843 2.353 3.242 . 0 0 "[ . 1 . 2]" 1
2435 1 96 VAL QG 1 97 THR H . . 4.180 2.636 2.007 3.255 . 0 0 "[ . 1 . 2]" 1
2436 1 96 VAL QG 1 97 THR HA . . 5.380 3.532 3.006 4.214 . 0 0 "[ . 1 . 2]" 1
2437 1 96 VAL QG 1 97 THR HB . . 5.500 4.095 3.443 4.848 . 0 0 "[ . 1 . 2]" 1
2438 1 96 VAL QG 1 99 TYR H . . 5.500 4.632 4.418 4.859 . 0 0 "[ . 1 . 2]" 1
2439 1 96 VAL QG 1 99 TYR QD . . 4.640 3.970 3.692 4.438 . 0 0 "[ . 1 . 2]" 1
2440 1 96 VAL QG 1 100 GLN H . . 5.500 4.336 4.060 4.635 . 0 0 "[ . 1 . 2]" 1
2441 1 96 VAL QG 1 100 GLN HE21 . . 4.300 3.045 2.064 4.031 . 0 0 "[ . 1 . 2]" 1
2442 1 96 VAL QG 1 100 GLN HE22 . . 4.760 3.794 2.998 4.382 . 0 0 "[ . 1 . 2]" 1
2443 1 96 VAL QG 1 100 GLN HG2 . . 4.720 3.552 2.836 4.134 . 0 0 "[ . 1 . 2]" 1
2444 1 96 VAL QG 1 100 GLN HG3 . . 4.920 3.248 2.900 3.741 . 0 0 "[ . 1 . 2]" 1
2445 1 97 THR H 1 97 THR HB . . 3.280 2.179 2.061 2.366 . 0 0 "[ . 1 . 2]" 1
2446 1 97 THR H 1 97 THR MG . . 4.460 3.653 3.578 3.735 . 0 0 "[ . 1 . 2]" 1
2447 1 97 THR H 1 98 GLN H . . 3.650 2.841 2.587 3.097 . 0 0 "[ . 1 . 2]" 1
2448 1 97 THR HA 1 97 THR MG . . 3.450 2.606 2.383 2.747 . 0 0 "[ . 1 . 2]" 1
2449 1 97 THR HA 1 99 TYR H . . 5.500 4.477 4.235 4.692 . 0 0 "[ . 1 . 2]" 1
2450 1 97 THR HA 1 100 GLN H . . 4.890 3.332 3.098 3.533 . 0 0 "[ . 1 . 2]" 1
2451 1 97 THR HA 1 100 GLN HB2 . . 3.910 3.028 2.629 3.147 . 0 0 "[ . 1 . 2]" 1
2452 1 97 THR HA 1 100 GLN HB3 . . 4.600 4.533 4.188 4.658 0.058 10 0 "[ . 1 . 2]" 1
2453 1 97 THR HA 1 100 GLN HE21 . . 5.500 5.185 4.322 5.585 0.085 20 0 "[ . 1 . 2]" 1
2454 1 97 THR HA 1 100 GLN HG2 . . 5.290 3.856 2.703 4.342 . 0 0 "[ . 1 . 2]" 1
2455 1 97 THR HA 1 100 GLN HG3 . . 5.500 2.504 2.206 3.052 . 0 0 "[ . 1 . 2]" 1
2456 1 97 THR HA 1 101 LYS H . . 4.660 4.388 4.118 4.727 0.067 12 0 "[ . 1 . 2]" 1
2457 1 97 THR HA 1 101 LYS QD . . 5.210 5.070 4.797 5.294 0.084 2 0 "[ . 1 . 2]" 1
2458 1 97 THR HA 1 101 LYS QE . . 4.400 4.475 4.410 4.504 0.104 6 0 "[ . 1 . 2]" 1
2459 1 97 THR HA 1 101 LYS HG2 . . 5.500 4.285 3.990 4.826 . 0 0 "[ . 1 . 2]" 1
2460 1 97 THR HB 1 98 GLN H . . 3.720 2.595 2.356 2.886 . 0 0 "[ . 1 . 2]" 1
2461 1 97 THR HB 1 100 GLN HG3 . . 5.380 5.379 5.086 5.962 0.582 17 1 "[ . 1 . + 2]" 1
2462 1 97 THR HB 1 101 LYS QD . . 5.190 4.999 4.665 5.280 0.090 13 0 "[ . 1 . 2]" 1
2463 1 97 THR HB 1 101 LYS HG2 . . 5.500 5.659 5.558 6.398 0.898 13 2 "[ . - + . 2]" 1
2464 1 97 THR MG 1 98 GLN H . . 4.660 2.977 2.778 3.175 . 0 0 "[ . 1 . 2]" 1
2465 1 97 THR MG 1 98 GLN HA . . 5.040 3.201 3.069 3.426 . 0 0 "[ . 1 . 2]" 1
2466 1 97 THR MG 1 98 GLN HB2 . . 5.040 4.034 3.757 4.212 . 0 0 "[ . 1 . 2]" 1
2467 1 97 THR MG 1 98 GLN HB3 . . 5.070 4.975 4.685 5.160 0.090 11 0 "[ . 1 . 2]" 1
2468 1 97 THR MG 1 99 TYR H . . 5.500 4.801 4.620 4.918 . 0 0 "[ . 1 . 2]" 1
2469 1 97 THR MG 1 100 GLN HB3 . . 5.500 5.481 5.100 5.596 0.096 14 0 "[ . 1 . 2]" 1
2470 1 97 THR MG 1 101 LYS QB . . 5.090 4.518 4.310 4.648 . 0 0 "[ . 1 . 2]" 1
2471 1 97 THR MG 1 101 LYS QD . . 4.070 2.610 2.334 3.017 . 0 0 "[ . 1 . 2]" 1
2472 1 97 THR MG 1 101 LYS QE . . 4.450 2.164 1.906 2.396 . 0 0 "[ . 1 . 2]" 1
2473 1 97 THR MG 1 101 LYS HG2 . . 3.030 3.162 3.074 3.631 0.601 10 2 "[ . + - . 2]" 1
2474 1 97 THR MG 1 101 LYS HG3 . . 3.680 3.260 2.850 3.657 . 0 0 "[ . 1 . 2]" 1
2475 1 98 GLN H 1 98 GLN HB2 . . 3.700 2.363 2.132 2.486 . 0 0 "[ . 1 . 2]" 1
2476 1 98 GLN H 1 98 GLN HB3 . . 3.860 2.740 2.619 2.956 . 0 0 "[ . 1 . 2]" 1
2477 1 98 GLN H 1 98 GLN HG3 . . 5.310 4.563 4.502 4.639 . 0 0 "[ . 1 . 2]" 1
2478 1 98 GLN H 1 99 TYR H . . 3.930 2.643 2.561 2.717 . 0 0 "[ . 1 . 2]" 1
2479 1 98 GLN H 1 100 GLN H . . 5.500 4.201 4.073 4.310 . 0 0 "[ . 1 . 2]" 1
2480 1 98 GLN HA 1 98 GLN QE . . 5.160 2.984 2.466 3.293 . 0 0 "[ . 1 . 2]" 1
2481 1 98 GLN HA 1 100 GLN H . . 5.430 4.387 4.141 4.547 . 0 0 "[ . 1 . 2]" 1
2482 1 98 GLN HA 1 101 LYS H . . 4.450 3.542 3.264 3.844 . 0 0 "[ . 1 . 2]" 1
2483 1 98 GLN HA 1 101 LYS QB . . 3.800 3.549 2.906 3.896 0.096 6 0 "[ . 1 . 2]" 1
2484 1 98 GLN HA 1 101 LYS QD . . 4.030 2.824 2.070 3.805 . 0 0 "[ . 1 . 2]" 1
2485 1 98 GLN HA 1 101 LYS QE . . 5.170 3.870 1.786 4.559 . 0 0 "[ . 1 . 2]" 1
2486 1 98 GLN HA 1 101 LYS HG3 . . 5.130 2.148 1.994 2.621 . 0 0 "[ . 1 . 2]" 1
2487 1 98 GLN HA 1 102 GLU H . . 5.450 3.953 3.745 4.161 . 0 0 "[ . 1 . 2]" 1
2488 1 98 GLN HB2 1 99 TYR H . . 4.640 3.615 3.313 3.786 . 0 0 "[ . 1 . 2]" 1
2489 1 98 GLN HB3 1 99 TYR H . . 4.210 2.484 2.248 2.677 . 0 0 "[ . 1 . 2]" 1
2490 1 98 GLN QE 1 99 TYR HA . . 5.370 5.007 4.496 5.259 . 0 0 "[ . 1 . 2]" 1
2491 1 98 GLN QE 1 101 LYS QB . . 5.440 2.967 2.226 3.439 . 0 0 "[ . 1 . 2]" 1
2492 1 98 GLN QE 1 101 LYS QD . . 4.650 3.329 2.538 4.262 . 0 0 "[ . 1 . 2]" 1
2493 1 98 GLN QE 1 101 LYS QE . . 5.500 4.684 2.328 5.292 . 0 0 "[ . 1 . 2]" 1
2494 1 98 GLN QE 1 102 GLU H . . 5.380 3.307 2.702 3.783 . 0 0 "[ . 1 . 2]" 1
2495 1 98 GLN QE 1 102 GLU HA . . 5.500 4.049 3.806 4.430 . 0 0 "[ . 1 . 2]" 1
2496 1 98 GLN QE 1 102 GLU HG2 . . 4.820 1.825 1.616 2.617 . 0 0 "[ . 1 . 2]" 1
2497 1 98 GLN QE 1 102 GLU HG3 . . 4.740 2.797 2.269 3.439 . 0 0 "[ . 1 . 2]" 1
2498 1 98 GLN HG3 1 102 GLU HG3 . . 5.500 3.324 2.126 5.383 . 0 0 "[ . 1 . 2]" 1
2499 1 99 TYR H 1 99 TYR HB2 . . 3.700 2.722 2.553 2.839 . 0 0 "[ . 1 . 2]" 1
2500 1 99 TYR H 1 99 TYR HB3 . . 3.360 2.626 2.483 2.737 . 0 0 "[ . 1 . 2]" 1
2501 1 99 TYR H 1 99 TYR QD . . 4.970 4.330 4.229 4.423 . 0 0 "[ . 1 . 2]" 1
2502 1 99 TYR H 1 100 GLN H . . 4.050 2.876 2.725 2.974 . 0 0 "[ . 1 . 2]" 1
2503 1 99 TYR H 1 102 GLU H . . 5.360 4.792 4.646 5.004 . 0 0 "[ . 1 . 2]" 1
2504 1 99 TYR HA 1 99 TYR QD . . 3.100 2.667 2.433 2.935 . 0 0 "[ . 1 . 2]" 1
2505 1 99 TYR HA 1 102 GLU H . . 4.860 3.599 3.240 3.970 . 0 0 "[ . 1 . 2]" 1
2506 1 99 TYR HA 1 102 GLU HB2 . . 5.470 2.638 2.145 3.228 . 0 0 "[ . 1 . 2]" 1
2507 1 99 TYR HA 1 102 GLU HB3 . . 4.520 4.066 3.645 4.575 0.055 4 0 "[ . 1 . 2]" 1
2508 1 99 TYR HA 1 102 GLU HG2 . . 5.500 4.620 3.931 5.515 0.015 20 0 "[ . 1 . 2]" 1
2509 1 99 TYR HA 1 102 GLU HG3 . . 5.500 4.147 3.442 5.168 . 0 0 "[ . 1 . 2]" 1
2510 1 99 TYR HA 1 103 SER H . . 5.110 3.762 3.401 3.993 . 0 0 "[ . 1 . 2]" 1
2511 1 99 TYR HB2 1 100 GLN H . . 4.010 4.018 3.923 4.077 0.067 13 0 "[ . 1 . 2]" 1
2512 1 99 TYR HB3 1 100 GLN H . . 4.920 2.716 2.536 2.850 . 0 0 "[ . 1 . 2]" 1
2513 1 99 TYR QD 1 100 GLN H . . 3.800 3.512 3.331 3.758 . 0 0 "[ . 1 . 2]" 1
2514 1 99 TYR QD 1 100 GLN HA . . 3.940 3.462 2.996 3.768 . 0 0 "[ . 1 . 2]" 1
2515 1 99 TYR QD 1 100 GLN HB2 . . 5.180 5.198 5.008 5.262 0.082 19 0 "[ . 1 . 2]" 1
2516 1 99 TYR QD 1 100 GLN HE21 . . 4.890 3.469 2.299 4.084 . 0 0 "[ . 1 . 2]" 1
2517 1 99 TYR QD 1 100 GLN HG2 . . 5.090 2.847 2.441 3.816 . 0 0 "[ . 1 . 2]" 1
2518 1 99 TYR QD 1 100 GLN HG3 . . 4.300 4.305 3.528 5.067 0.767 19 3 "[ * . 1 . - +2]" 1
2519 1 99 TYR QE 1 100 GLN HA . . 4.770 4.388 4.115 4.616 . 0 0 "[ . 1 . 2]" 1
2520 1 99 TYR QE 1 100 GLN HE21 . . 5.500 4.612 3.553 5.404 . 0 0 "[ . 1 . 2]" 1
2521 1 99 TYR QE 1 103 SER QB . . 4.240 3.580 2.946 4.063 . 0 0 "[ . 1 . 2]" 1
2522 1 100 GLN H 1 100 GLN HB2 . . 4.030 2.640 2.515 2.804 . 0 0 "[ . 1 . 2]" 1
2523 1 100 GLN H 1 100 GLN HB3 . . 4.160 3.627 3.596 3.674 . 0 0 "[ . 1 . 2]" 1
2524 1 100 GLN H 1 100 GLN HE21 . . 5.500 4.503 3.051 4.904 . 0 0 "[ . 1 . 2]" 1
2525 1 100 GLN H 1 100 GLN HG2 . . 3.730 2.432 1.991 2.875 . 0 0 "[ . 1 . 2]" 1
2526 1 100 GLN H 1 100 GLN HG3 . . 4.080 2.712 2.143 3.565 . 0 0 "[ . 1 . 2]" 1
2527 1 100 GLN H 1 101 LYS H . . 3.870 2.651 2.326 2.806 . 0 0 "[ . 1 . 2]" 1
2528 1 100 GLN H 1 101 LYS QD . . 5.500 5.575 5.532 5.597 0.097 9 0 "[ . 1 . 2]" 1
2529 1 100 GLN HA 1 100 GLN HG2 . . 4.120 2.666 2.422 3.230 . 0 0 "[ . 1 . 2]" 1
2530 1 100 GLN HA 1 100 GLN HG3 . . 3.870 3.714 3.348 3.954 0.084 2 0 "[ . 1 . 2]" 1
2531 1 100 GLN HA 1 101 LYS HA . . 4.730 4.736 4.559 4.795 0.065 2 0 "[ . 1 . 2]" 1
2532 1 100 GLN HA 1 101 LYS HG2 . . 5.500 5.378 5.005 5.531 0.031 10 0 "[ . 1 . 2]" 1
2533 1 100 GLN HA 1 103 SER H . . 4.680 3.631 3.032 4.030 . 0 0 "[ . 1 . 2]" 1
2534 1 100 GLN HA 1 103 SER QB . . 3.730 2.695 2.240 3.436 . 0 0 "[ . 1 . 2]" 1
2535 1 100 GLN HA 1 104 GLN H . . 5.420 4.581 3.932 5.380 . 0 0 "[ . 1 . 2]" 1
2536 1 100 GLN HB2 1 101 LYS H . . 3.990 2.790 2.420 3.430 . 0 0 "[ . 1 . 2]" 1
2537 1 100 GLN HB2 1 101 LYS HG3 . . 5.500 4.073 3.831 4.177 . 0 0 "[ . 1 . 2]" 1
2538 1 100 GLN HB2 1 102 GLU H . . 5.500 5.276 5.062 5.568 0.068 12 0 "[ . 1 . 2]" 1
2539 1 100 GLN HB3 1 101 LYS H . . 4.290 3.866 3.542 4.339 0.049 13 0 "[ . 1 . 2]" 1
2540 1 100 GLN HB3 1 101 LYS HG2 . . 5.430 4.638 4.423 5.083 . 0 0 "[ . 1 . 2]" 1
2541 1 100 GLN HB3 1 101 LYS HG3 . . 5.500 5.513 5.335 5.579 0.079 4 0 "[ . 1 . 2]" 1
2542 1 100 GLN HG2 1 101 LYS H . . 5.500 4.507 4.132 4.833 . 0 0 "[ . 1 . 2]" 1
2543 1 100 GLN HG3 1 101 LYS H . . 5.180 4.432 4.107 5.466 0.286 17 0 "[ . 1 . 2]" 1
2544 1 100 GLN HG3 1 101 LYS HG3 . . 5.500 5.587 5.085 6.390 0.890 17 2 "[ . 1 . + -2]" 1
2545 1 101 LYS H 1 101 LYS QB . . 3.270 2.921 2.714 3.026 . 0 0 "[ . 1 . 2]" 1
2546 1 101 LYS H 1 101 LYS QD . . 4.690 3.942 3.780 4.284 . 0 0 "[ . 1 . 2]" 1
2547 1 101 LYS H 1 101 LYS QE . . 5.390 4.316 3.796 4.818 . 0 0 "[ . 1 . 2]" 1
2548 1 101 LYS H 1 101 LYS HG2 . . 4.360 2.410 2.151 3.085 . 0 0 "[ . 1 . 2]" 1
2549 1 101 LYS H 1 101 LYS HG3 . . 4.030 2.139 1.990 2.357 . 0 0 "[ . 1 . 2]" 1
2550 1 101 LYS H 1 102 GLU H . . 3.660 2.588 2.089 2.817 . 0 0 "[ . 1 . 2]" 1
2551 1 101 LYS H 1 102 GLU HG2 . . 5.500 4.960 3.937 5.566 0.066 18 0 "[ . 1 . 2]" 1
2552 1 101 LYS H 1 103 SER H . . 5.500 3.845 3.397 4.149 . 0 0 "[ . 1 . 2]" 1
2553 1 101 LYS HA 1 101 LYS QD . . 4.230 4.214 3.995 4.329 0.099 3 0 "[ . 1 . 2]" 1
2554 1 101 LYS HA 1 101 LYS HG2 . . 3.970 3.067 2.659 3.386 . 0 0 "[ . 1 . 2]" 1
2555 1 101 LYS HA 1 104 GLN H . . 4.470 3.770 3.422 4.020 . 0 0 "[ . 1 . 2]" 1
2556 1 101 LYS HA 1 104 GLN QB . . 3.930 3.564 3.015 4.017 0.087 3 0 "[ . 1 . 2]" 1
2557 1 101 LYS QB 1 101 LYS QD . . 3.210 2.198 2.105 2.298 . 0 0 "[ . 1 . 2]" 1
2558 1 101 LYS QB 1 102 GLU H . . 4.180 2.633 2.342 2.838 . 0 0 "[ . 1 . 2]" 1
2559 1 101 LYS QB 1 102 GLU HG2 . . 5.500 3.543 2.711 4.177 . 0 0 "[ . 1 . 2]" 1
2560 1 101 LYS QB 1 102 GLU HG3 . . 5.500 5.065 4.302 5.562 0.062 18 0 "[ . 1 . 2]" 1
2561 1 101 LYS QD 1 102 GLU H . . 5.400 4.624 4.119 4.977 . 0 0 "[ . 1 . 2]" 1
2562 1 101 LYS HG2 1 102 GLU H . . 5.500 4.315 4.096 4.526 . 0 0 "[ . 1 . 2]" 1
2563 1 101 LYS HG3 1 102 GLU H . . 5.500 3.293 2.790 3.830 . 0 0 "[ . 1 . 2]" 1
2564 1 101 LYS HG3 1 102 GLU HG2 . . 5.500 4.704 3.997 5.523 0.023 15 0 "[ . 1 . 2]" 1
2565 1 102 GLU H 1 102 GLU HB2 . . 3.820 2.253 2.052 2.438 . 0 0 "[ . 1 . 2]" 1
2566 1 102 GLU H 1 102 GLU HB3 . . 3.670 3.510 3.374 3.602 . 0 0 "[ . 1 . 2]" 1
2567 1 102 GLU H 1 102 GLU HG2 . . 3.880 2.677 2.243 3.150 . 0 0 "[ . 1 . 2]" 1
2568 1 102 GLU H 1 102 GLU HG3 . . 4.250 3.702 3.392 4.059 . 0 0 "[ . 1 . 2]" 1
2569 1 102 GLU H 1 104 GLN H . . 5.160 4.501 3.903 4.773 . 0 0 "[ . 1 . 2]" 1
2570 1 102 GLU HA 1 102 GLU HG2 . . 4.050 2.722 2.468 3.100 . 0 0 "[ . 1 . 2]" 1
2571 1 102 GLU HA 1 105 ALA H . . 4.170 3.053 2.624 3.500 . 0 0 "[ . 1 . 2]" 1
2572 1 102 GLU HA 1 105 ALA MB . . 3.890 2.155 1.996 2.365 . 0 0 "[ . 1 . 2]" 1
2573 1 102 GLU HA 1 106 TYR QD . . 5.500 4.913 4.662 5.178 . 0 0 "[ . 1 . 2]" 1
2574 1 102 GLU HB2 1 103 SER H . . 4.390 2.898 2.527 3.429 . 0 0 "[ . 1 . 2]" 1
2575 1 102 GLU HB2 1 105 ALA MB . . 5.500 4.664 4.337 4.926 . 0 0 "[ . 1 . 2]" 1
2576 1 102 GLU HB3 1 103 SER H . . 4.130 3.529 3.015 3.831 . 0 0 "[ . 1 . 2]" 1
2577 1 102 GLU HB3 1 106 TYR QD . . 4.700 4.557 4.210 4.786 0.086 10 0 "[ . 1 . 2]" 1
2578 1 102 GLU HG2 1 103 SER H . . 5.240 4.720 4.375 4.985 . 0 0 "[ . 1 . 2]" 1
2579 1 102 GLU HG3 1 105 ALA MB . . 5.300 4.998 4.206 5.411 0.111 14 0 "[ . 1 . 2]" 1
2580 1 103 SER H 1 103 SER QB . . 3.790 2.293 2.090 2.624 . 0 0 "[ . 1 . 2]" 1
2581 1 103 SER H 1 104 GLN H . . 3.580 2.916 2.601 3.191 . 0 0 "[ . 1 . 2]" 1
2582 1 103 SER H 1 105 ALA MB . . 5.500 4.587 4.463 4.730 . 0 0 "[ . 1 . 2]" 1
2583 1 103 SER H 1 106 TYR H . . 4.870 4.941 4.916 4.952 0.082 12 0 "[ . 1 . 2]" 1
2584 1 103 SER HA 1 105 ALA H . . 4.500 4.025 3.769 4.273 . 0 0 "[ . 1 . 2]" 1
2585 1 103 SER HA 1 106 TYR H . . 4.380 3.930 3.750 4.095 . 0 0 "[ . 1 . 2]" 1
2586 1 103 SER HA 1 106 TYR HB3 . . 4.420 4.379 4.159 4.491 0.071 15 0 "[ . 1 . 2]" 1
2587 1 103 SER HA 1 106 TYR QD . . 4.020 2.209 2.048 2.502 . 0 0 "[ . 1 . 2]" 1
2588 1 103 SER HA 1 107 TYR H . . 5.180 4.361 3.698 5.198 0.018 13 0 "[ . 1 . 2]" 1
2589 1 103 SER HA 1 107 TYR HB3 . . 4.420 4.530 3.946 4.909 0.489 1 0 "[ . 1 . 2]" 1
2590 1 103 SER HA 1 107 TYR QD . . 5.400 5.056 4.540 5.495 0.095 9 0 "[ . 1 . 2]" 1
2591 1 103 SER QB 1 104 GLN H . . 4.310 2.890 2.242 3.742 . 0 0 "[ . 1 . 2]" 1
2592 1 103 SER QB 1 104 GLN HA . . 4.650 4.283 3.740 4.541 . 0 0 "[ . 1 . 2]" 1
2593 1 103 SER QB 1 104 GLN QB . . 5.160 3.884 3.478 4.479 . 0 0 "[ . 1 . 2]" 1
2594 1 103 SER QB 1 105 ALA H . . 5.500 4.565 4.251 4.990 . 0 0 "[ . 1 . 2]" 1
2595 1 103 SER QB 1 107 TYR QD . . 5.480 4.478 2.960 5.192 . 0 0 "[ . 1 . 2]" 1
2596 1 104 GLN H 1 104 GLN QB . . 3.030 2.173 2.060 2.397 . 0 0 "[ . 1 . 2]" 1
2597 1 104 GLN H 1 104 GLN HG3 . . 4.110 4.200 4.186 4.211 0.101 3 0 "[ . 1 . 2]" 1
2598 1 104 GLN H 1 105 ALA MB . . 5.410 4.140 3.666 4.622 . 0 0 "[ . 1 . 2]" 1
2599 1 104 GLN HA 1 104 GLN QE . . 5.500 3.998 2.419 4.332 . 0 0 "[ . 1 . 2]" 1
2600 1 104 GLN HA 1 104 GLN HG2 . . 3.950 3.628 3.162 3.904 . 0 0 "[ . 1 . 2]" 1
2601 1 104 GLN HA 1 104 GLN HG3 . . 3.800 2.629 2.075 3.232 . 0 0 "[ . 1 . 2]" 1
2602 1 104 GLN HA 1 105 ALA H . . 3.590 3.441 3.218 3.579 . 0 0 "[ . 1 . 2]" 1
2603 1 104 GLN HA 1 106 TYR H . . 4.690 4.662 4.407 4.770 0.080 6 0 "[ . 1 . 2]" 1
2604 1 104 GLN HA 1 106 TYR QD . . 4.620 4.479 3.971 4.722 0.102 14 0 "[ . 1 . 2]" 1
2605 1 104 GLN HA 1 106 TYR QE . . 5.380 5.089 4.504 5.448 0.068 15 0 "[ . 1 . 2]" 1
2606 1 104 GLN HA 1 107 TYR H . . 4.340 3.421 3.179 3.711 . 0 0 "[ . 1 . 2]" 1
2607 1 104 GLN HA 1 107 TYR HB2 . . 4.820 3.878 3.485 4.262 . 0 0 "[ . 1 . 2]" 1
2608 1 104 GLN HA 1 107 TYR HB3 . . 4.300 2.333 2.031 2.644 . 0 0 "[ . 1 . 2]" 1
2609 1 104 GLN HA 1 107 TYR QD . . 4.170 3.287 2.623 3.739 . 0 0 "[ . 1 . 2]" 1
2610 1 104 GLN HA 1 107 TYR QE . . 5.500 5.334 4.739 5.585 0.085 20 0 "[ . 1 . 2]" 1
2611 1 104 GLN HA 1 108 ASP HA . . 4.960 3.537 2.997 3.960 . 0 0 "[ . 1 . 2]" 1
2612 1 104 GLN HA 1 108 ASP QB . . 5.050 4.534 4.098 4.906 . 0 0 "[ . 1 . 2]" 1
2613 1 104 GLN QB 1 105 ALA H . . 3.470 3.266 3.009 3.547 0.077 20 0 "[ . 1 . 2]" 1
2614 1 104 GLN QB 1 105 ALA HA . . 4.640 4.391 4.107 4.683 0.043 2 0 "[ . 1 . 2]" 1
2615 1 104 GLN QB 1 105 ALA MB . . 5.040 4.242 3.990 4.603 . 0 0 "[ . 1 . 2]" 1
2616 1 104 GLN QB 1 107 TYR QD . . 5.030 4.500 4.063 4.922 . 0 0 "[ . 1 . 2]" 1
2617 1 104 GLN QB 1 109 GLY H . . 5.500 5.511 5.237 5.596 0.096 18 0 "[ . 1 . 2]" 1
2618 1 104 GLN QE 1 108 ASP H . . 5.500 4.463 3.753 5.020 . 0 0 "[ . 1 . 2]" 1
2619 1 104 GLN QE 1 108 ASP QB . . 5.310 4.479 3.303 5.226 . 0 0 "[ . 1 . 2]" 1
2620 1 104 GLN QE 1 109 GLY H . . 4.980 3.878 3.434 4.187 . 0 0 "[ . 1 . 2]" 1
2621 1 104 GLN QE 1 109 GLY QA . . 4.460 4.111 3.383 4.413 . 0 0 "[ . 1 . 2]" 1
2622 1 104 GLN HG2 1 105 ALA H . . 5.220 5.040 4.709 5.212 . 0 0 "[ . 1 . 2]" 1
2623 1 104 GLN HG2 1 105 ALA MB . . 5.450 5.515 5.265 5.568 0.118 14 0 "[ . 1 . 2]" 1
2624 1 104 GLN HG2 1 108 ASP QB . . 4.740 4.676 3.906 4.840 0.100 19 0 "[ . 1 . 2]" 1
2625 1 104 GLN HG3 1 107 TYR H . . 5.390 5.035 4.539 5.451 0.061 14 0 "[ . 1 . 2]" 1
2626 1 104 GLN HG3 1 108 ASP QB . . 4.310 3.738 3.348 4.382 0.072 1 0 "[ . 1 . 2]" 1
2627 1 105 ALA H 1 105 ALA MB . . 3.130 2.292 2.242 2.390 . 0 0 "[ . 1 . 2]" 1
2628 1 105 ALA H 1 106 TYR H . . 3.350 2.582 2.483 2.713 . 0 0 "[ . 1 . 2]" 1
2629 1 105 ALA H 1 106 TYR HB3 . . 5.500 4.535 4.359 4.674 . 0 0 "[ . 1 . 2]" 1
2630 1 105 ALA H 1 106 TYR QE . . 5.500 5.566 5.414 5.597 0.097 2 0 "[ . 1 . 2]" 1
2631 1 105 ALA H 1 107 TYR H . . 4.560 3.660 3.380 3.950 . 0 0 "[ . 1 . 2]" 1
2632 1 105 ALA H 1 107 TYR HB3 . . 5.490 4.658 4.407 4.861 . 0 0 "[ . 1 . 2]" 1
2633 1 105 ALA H 1 108 ASP QB . . 5.500 5.310 4.791 5.589 0.089 4 0 "[ . 1 . 2]" 1
2634 1 105 ALA HA 1 108 ASP H . . 4.610 4.163 3.904 4.400 . 0 0 "[ . 1 . 2]" 1
2635 1 105 ALA HA 1 108 ASP HA . . 5.180 4.967 4.636 5.249 0.069 17 0 "[ . 1 . 2]" 1
2636 1 105 ALA HA 1 108 ASP QB . . 3.880 3.592 2.888 3.967 0.087 16 0 "[ . 1 . 2]" 1
2637 1 105 ALA MB 1 106 TYR H . . 3.760 2.469 2.201 2.682 . 0 0 "[ . 1 . 2]" 1
2638 1 105 ALA MB 1 106 TYR HA . . 5.150 3.913 3.701 4.102 . 0 0 "[ . 1 . 2]" 1
2639 1 105 ALA MB 1 106 TYR HB2 . . 4.990 4.757 4.491 5.002 0.012 14 0 "[ . 1 . 2]" 1
2640 1 105 ALA MB 1 106 TYR HB3 . . 5.500 3.652 3.304 3.905 . 0 0 "[ . 1 . 2]" 1
2641 1 105 ALA MB 1 106 TYR QD . . 4.340 4.301 4.113 4.437 0.097 5 0 "[ . 1 . 2]" 1
2642 1 105 ALA MB 1 107 TYR H . . 5.500 4.308 4.107 4.616 . 0 0 "[ . 1 . 2]" 1
2643 1 105 ALA MB 1 108 ASP H . . 5.500 5.070 4.889 5.298 . 0 0 "[ . 1 . 2]" 1
2644 1 106 TYR H 1 106 TYR HB2 . . 3.280 3.369 3.360 3.377 0.097 1 0 "[ . 1 . 2]" 1
2645 1 106 TYR H 1 106 TYR HB3 . . 3.330 2.108 2.067 2.158 . 0 0 "[ . 1 . 2]" 1
2646 1 106 TYR H 1 106 TYR QD . . 3.510 2.388 2.262 2.476 . 0 0 "[ . 1 . 2]" 1
2647 1 106 TYR H 1 106 TYR QE . . 4.810 4.707 4.557 4.810 0.000 6 0 "[ . 1 . 2]" 1
2648 1 106 TYR H 1 107 TYR H . . 3.220 2.599 2.379 2.720 . 0 0 "[ . 1 . 2]" 1
2649 1 106 TYR H 1 107 TYR HB2 . . 5.500 4.722 4.406 5.058 . 0 0 "[ . 1 . 2]" 1
2650 1 106 TYR H 1 108 ASP H . . 4.520 4.493 4.289 4.595 0.075 5 0 "[ . 1 . 2]" 1
2651 1 106 TYR HA 1 106 TYR QD . . 3.740 3.698 3.593 3.750 0.010 1 0 "[ . 1 . 2]" 1
2652 1 106 TYR HB2 1 107 TYR H . . 4.320 4.289 4.038 4.405 0.085 10 0 "[ . 1 . 2]" 1
2653 1 106 TYR HB3 1 107 TYR H . . 4.110 3.833 3.584 4.115 0.005 13 0 "[ . 1 . 2]" 1
2654 1 106 TYR QD 1 107 TYR H . . 3.690 2.699 2.197 3.198 . 0 0 "[ . 1 . 2]" 1
2655 1 106 TYR QD 1 107 TYR HB2 . . 4.060 3.206 2.685 3.494 . 0 0 "[ . 1 . 2]" 1
2656 1 106 TYR QD 1 108 ASP H . . 5.130 4.788 4.545 5.003 . 0 0 "[ . 1 . 2]" 1
2657 1 106 TYR QE 1 107 TYR H . . 4.700 4.166 3.590 4.775 0.075 13 0 "[ . 1 . 2]" 1
2658 1 106 TYR QE 1 107 TYR HB2 . . 4.200 2.833 2.432 3.157 . 0 0 "[ . 1 . 2]" 1
2659 1 106 TYR QE 1 107 TYR HB3 . . 4.100 3.974 3.552 4.281 0.181 20 0 "[ . 1 . 2]" 1
2660 1 107 TYR H 1 107 TYR HB2 . . 3.570 2.730 2.443 3.117 . 0 0 "[ . 1 . 2]" 1
2661 1 107 TYR H 1 107 TYR HB3 . . 3.040 2.419 2.295 2.550 . 0 0 "[ . 1 . 2]" 1
2662 1 107 TYR H 1 107 TYR QD . . 4.280 4.241 4.140 4.354 0.074 10 0 "[ . 1 . 2]" 1
2663 1 107 TYR H 1 108 ASP H . . 3.150 2.457 2.081 2.796 . 0 0 "[ . 1 . 2]" 1
2664 1 107 TYR H 1 108 ASP HA . . 5.500 4.649 4.163 5.022 . 0 0 "[ . 1 . 2]" 1
2665 1 107 TYR H 1 108 ASP QB . . 5.310 4.228 3.563 4.910 . 0 0 "[ . 1 . 2]" 1
2666 1 107 TYR HA 1 107 TYR QD . . 2.870 2.264 2.160 2.378 . 0 0 "[ . 1 . 2]" 1
2667 1 107 TYR HA 1 107 TYR QE . . 4.490 4.565 4.508 4.585 0.095 14 0 "[ . 1 . 2]" 1
2668 1 107 TYR HA 1 108 ASP H . . 3.640 3.593 3.472 3.687 0.047 3 0 "[ . 1 . 2]" 1
2669 1 107 TYR HA 1 109 GLY H . . 4.520 4.064 3.741 4.466 . 0 0 "[ . 1 . 2]" 1
2670 1 107 TYR HA 1 110 ARG QB . . 5.500 4.342 3.928 4.722 . 0 0 "[ . 1 . 2]" 1
2671 1 107 TYR HA 1 111 ARG HD2 . . 5.410 3.850 3.101 4.826 . 0 0 "[ . 1 . 2]" 1
2672 1 107 TYR HA 1 111 ARG HG3 . . 5.260 4.898 3.940 5.343 0.083 3 0 "[ . 1 . 2]" 1
2673 1 107 TYR HB2 1 108 ASP H . . 4.040 3.704 3.596 3.832 . 0 0 "[ . 1 . 2]" 1
2674 1 107 TYR HB2 1 108 ASP HA . . 5.500 5.580 5.350 5.787 0.287 3 0 "[ . 1 . 2]" 1
2675 1 107 TYR HB2 1 109 GLY QA . . 5.300 5.444 5.171 5.589 0.289 17 0 "[ . 1 . 2]" 1
2676 1 107 TYR HB3 1 108 ASP H . . 3.960 2.263 2.114 2.443 . 0 0 "[ . 1 . 2]" 1
2677 1 107 TYR HB3 1 109 GLY H . . 5.500 3.188 2.845 3.531 . 0 0 "[ . 1 . 2]" 1
2678 1 107 TYR HB3 1 109 GLY QA . . 5.500 4.779 4.438 5.017 . 0 0 "[ . 1 . 2]" 1
2679 1 107 TYR HB3 1 110 ARG H . . 5.500 5.011 4.832 5.278 . 0 0 "[ . 1 . 2]" 1
2680 1 107 TYR QD 1 108 ASP H . . 4.890 3.904 3.682 4.102 . 0 0 "[ . 1 . 2]" 1
2681 1 107 TYR QD 1 109 GLY QA . . 5.420 3.328 2.916 3.645 . 0 0 "[ . 1 . 2]" 1
2682 1 107 TYR QD 1 110 ARG QB . . 4.650 4.325 4.122 4.559 . 0 0 "[ . 1 . 2]" 1
2683 1 107 TYR QD 1 111 ARG QB . . 5.090 3.986 2.371 4.675 . 0 0 "[ . 1 . 2]" 1
2684 1 107 TYR QD 1 111 ARG HD3 . . 4.550 2.301 1.948 3.183 . 0 0 "[ . 1 . 2]" 1
2685 1 107 TYR QD 1 111 ARG HG3 . . 4.960 4.087 3.008 5.014 0.054 20 0 "[ . 1 . 2]" 1
2686 1 107 TYR QE 1 109 GLY H . . 4.590 3.780 3.561 3.953 . 0 0 "[ . 1 . 2]" 1
2687 1 107 TYR QE 1 109 GLY QA . . 5.050 2.793 2.324 3.118 . 0 0 "[ . 1 . 2]" 1
2688 1 107 TYR QE 1 111 ARG HD2 . . 5.500 4.730 3.134 5.574 0.074 13 0 "[ . 1 . 2]" 1
2689 1 107 TYR QE 1 111 ARG HD3 . . 5.270 3.517 2.182 4.415 . 0 0 "[ . 1 . 2]" 1
2690 1 108 ASP H 1 108 ASP QB . . 3.090 2.673 2.517 2.785 . 0 0 "[ . 1 . 2]" 1
2691 1 108 ASP H 1 109 GLY H . . 3.440 2.983 2.852 3.182 . 0 0 "[ . 1 . 2]" 1
2692 1 108 ASP H 1 109 GLY QA . . 5.250 4.812 4.704 4.988 . 0 0 "[ . 1 . 2]" 1
2693 1 108 ASP H 1 110 ARG H . . 4.760 4.335 4.220 4.468 . 0 0 "[ . 1 . 2]" 1
2694 1 108 ASP HA 1 109 GLY H . . 3.500 2.772 2.461 3.043 . 0 0 "[ . 1 . 2]" 1
2695 1 108 ASP HA 1 110 ARG H . . 5.110 4.279 4.016 4.611 . 0 0 "[ . 1 . 2]" 1
2696 1 108 ASP QB 1 109 GLY H . . 3.860 3.914 3.801 3.955 0.095 15 0 "[ . 1 . 2]" 1
2697 1 108 ASP QB 1 109 GLY QA . . 5.440 4.668 4.563 4.834 . 0 0 "[ . 1 . 2]" 1
2698 1 108 ASP QB 1 110 ARG H . . 4.810 3.658 3.138 4.252 . 0 0 "[ . 1 . 2]" 1
2699 1 108 ASP QB 1 110 ARG HA . . 4.920 4.864 4.430 5.029 0.109 15 0 "[ . 1 . 2]" 1
2700 1 108 ASP QB 1 110 ARG QG . . 4.990 3.530 2.180 5.079 0.089 4 0 "[ . 1 . 2]" 1
2701 1 109 GLY H 1 111 ARG H . . 5.170 4.890 4.426 5.208 0.038 12 0 "[ . 1 . 2]" 1
2702 1 109 GLY QA 1 110 ARG H . . 3.560 2.922 2.716 3.034 . 0 0 "[ . 1 . 2]" 1
2703 1 109 GLY QA 1 110 ARG HA . . 4.280 4.011 3.837 4.174 . 0 0 "[ . 1 . 2]" 1
2704 1 109 GLY QA 1 110 ARG QG . . 5.020 4.901 4.448 5.128 0.108 7 0 "[ . 1 . 2]" 1
2705 1 109 GLY QA 1 111 ARG H . . 5.440 3.429 3.009 3.635 . 0 0 "[ . 1 . 2]" 1
2706 1 109 GLY QA 1 111 ARG HD3 . . 4.660 4.451 3.764 4.756 0.096 1 0 "[ . 1 . 2]" 1
2707 1 109 GLY QA 1 113 SER HA . . 5.500 4.476 2.640 5.603 0.103 15 0 "[ . 1 . 2]" 1
2708 1 110 ARG H 1 110 ARG QB . . 3.390 2.072 1.877 2.406 . 0 0 "[ . 1 . 2]" 1
2709 1 110 ARG H 1 110 ARG HE . . 5.300 4.788 4.361 5.124 . 0 0 "[ . 1 . 2]" 1
2710 1 110 ARG H 1 110 ARG QG . . 3.670 3.280 2.357 3.761 0.091 12 0 "[ . 1 . 2]" 1
2711 1 110 ARG H 1 111 ARG H . . 3.720 3.008 2.492 3.434 . 0 0 "[ . 1 . 2]" 1
2712 1 110 ARG H 1 111 ARG HD2 . . 5.130 3.382 2.605 4.507 . 0 0 "[ . 1 . 2]" 1
2713 1 110 ARG H 1 111 ARG HG2 . . 5.500 4.779 3.372 5.590 0.090 4 0 "[ . 1 . 2]" 1
2714 1 110 ARG HA 1 110 ARG QD . . 4.790 3.700 2.451 4.429 . 0 0 "[ . 1 . 2]" 1
2715 1 110 ARG HA 1 110 ARG HE . . 5.500 4.008 2.043 5.594 0.094 20 0 "[ . 1 . 2]" 1
2716 1 110 ARG HA 1 110 ARG QG . . 3.710 2.457 2.097 3.564 . 0 0 "[ . 1 . 2]" 1
2717 1 110 ARG HA 1 111 ARG H . . 3.260 3.112 2.856 3.305 0.045 13 0 "[ . 1 . 2]" 1
2718 1 110 ARG HA 1 111 ARG HD2 . . 4.830 4.385 3.762 4.916 0.086 6 0 "[ . 1 . 2]" 1
2719 1 110 ARG HA 1 111 ARG HD3 . . 5.410 4.704 4.011 5.467 0.057 3 0 "[ . 1 . 2]" 1
2720 1 110 ARG QB 1 111 ARG H . . 4.890 3.729 3.441 4.130 . 0 0 "[ . 1 . 2]" 1
2721 1 110 ARG QB 1 111 ARG HD2 . . 4.110 2.650 2.019 3.737 . 0 0 "[ . 1 . 2]" 1
2722 1 110 ARG HE 1 111 ARG QB . . 5.500 5.078 4.451 5.407 . 0 0 "[ . 1 . 2]" 1
2723 1 110 ARG HE 1 111 ARG HD2 . . 5.190 3.795 2.999 4.902 . 0 0 "[ . 1 . 2]" 1
2724 1 110 ARG HE 1 111 ARG HD3 . . 4.610 4.751 4.466 5.267 0.657 8 3 "[ . + 1 .* - 2]" 1
2725 1 110 ARG QG 1 111 ARG H . . 5.360 4.508 3.300 4.917 . 0 0 "[ . 1 . 2]" 1
2726 1 111 ARG H 1 111 ARG QB . . 3.840 3.025 2.580 3.441 . 0 0 "[ . 1 . 2]" 1
2727 1 111 ARG H 1 111 ARG HD2 . . 5.500 3.418 2.347 4.379 . 0 0 "[ . 1 . 2]" 1
2728 1 111 ARG H 1 111 ARG HD3 . . 4.880 3.128 2.599 4.144 . 0 0 "[ . 1 . 2]" 1
2729 1 111 ARG H 1 111 ARG HG2 . . 4.960 3.588 2.245 4.826 . 0 0 "[ . 1 . 2]" 1
2730 1 111 ARG H 1 111 ARG HG3 . . 4.020 3.918 3.464 4.419 0.399 13 0 "[ . 1 . 2]" 1
2731 1 111 ARG H 1 112 SER H . . 3.150 2.264 1.645 3.208 0.058 7 0 "[ . 1 . 2]" 1
2732 1 111 ARG H 1 112 SER HA . . 5.220 4.589 3.799 5.013 . 0 0 "[ . 1 . 2]" 1
2733 1 111 ARG H 1 112 SER QB . . 4.510 3.866 3.324 4.450 . 0 0 "[ . 1 . 2]" 1
2734 1 111 ARG H 1 113 SER H . . 3.940 3.620 2.464 4.019 0.079 14 0 "[ . 1 . 2]" 1
2735 1 111 ARG HA 1 111 ARG HD3 . . 4.170 4.341 3.870 5.056 0.886 7 5 "[ * . +* 1 .- * 2]" 1
2736 1 111 ARG HA 1 111 ARG HG3 . . 3.910 3.413 2.398 4.317 0.407 7 0 "[ . 1 . 2]" 1
2737 1 111 ARG HA 1 112 SER H . . 3.130 2.924 2.249 3.217 0.087 3 0 "[ . 1 . 2]" 1
2738 1 111 ARG QB 1 112 SER H . . 4.710 3.794 3.374 4.060 . 0 0 "[ . 1 . 2]" 1
2739 1 111 ARG QB 1 112 SER QB . . 4.720 4.090 3.464 4.476 . 0 0 "[ . 1 . 2]" 1
2740 1 111 ARG HG3 1 112 SER H . . 5.100 5.210 4.764 5.876 0.776 10 4 "[ - . * + * . 2]" 1
2741 1 112 SER H 1 112 SER QB . . 3.890 3.035 2.585 3.481 . 0 0 "[ . 1 . 2]" 1
2742 1 112 SER H 1 113 SER H . . 4.120 2.581 1.726 3.206 . 0 0 "[ . 1 . 2]" 1
2743 1 112 SER H 1 113 SER HA . . 4.690 4.239 3.530 4.766 0.076 16 0 "[ . 1 . 2]" 1
2744 1 112 SER HA 1 113 SER QB . . 4.890 4.665 4.031 4.980 0.090 15 0 "[ . 1 . 2]" 1
2745 1 112 SER QB 1 113 SER H . . 4.260 2.732 1.952 3.875 . 0 0 "[ . 1 . 2]" 1
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