NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
580213 |
2mqd   |
25028 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mqd
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 2000
_Distance_constraint_stats_list.Viol_count 3877
_Distance_constraint_stats_list.Viol_total 6782.693
_Distance_constraint_stats_list.Viol_max 0.999
_Distance_constraint_stats_list.Viol_rms 0.0416
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0085
_Distance_constraint_stats_list.Viol_average_violations_only 0.0875
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 MET 0.449 0.100 16 0 "[ . 1 . 2]"
1 4 LYS 0.877 0.198 3 0 "[ . 1 . 2]"
1 5 PHE 6.056 0.198 3 0 "[ . 1 . 2]"
1 6 THR 4.488 0.125 6 0 "[ . 1 . 2]"
1 7 ASP 2.050 0.556 15 1 "[ . 1 + 2]"
1 8 GLN 6.433 0.556 15 1 "[ . 1 + 2]"
1 9 GLN 3.904 0.125 6 0 "[ . 1 . 2]"
1 10 ILE 2.179 0.102 14 0 "[ . 1 . 2]"
1 11 GLY 0.415 0.072 5 0 "[ . 1 . 2]"
1 12 VAL 1.756 0.097 14 0 "[ . 1 . 2]"
1 13 LEU 1.979 0.106 15 0 "[ . 1 . 2]"
1 14 ALA 1.751 0.121 7 0 "[ . 1 . 2]"
1 15 GLY 2.916 0.092 10 0 "[ . 1 . 2]"
1 16 LEU 3.735 0.637 5 3 "[ + 1 .* -]"
1 17 ALA 2.298 0.121 7 0 "[ . 1 . 2]"
1 18 ILE 17.252 0.854 9 9 "[ -*** *+* * .* 2]"
1 19 SER 7.644 0.458 3 0 "[ . 1 . 2]"
1 20 PRO 10.561 0.637 5 3 "[ + 1 .* -]"
1 21 GLU 1.311 0.115 1 0 "[ . 1 . 2]"
1 22 TRP 11.927 0.997 13 4 "[- . 1 *+ . *]"
1 23 LEU 2.430 0.095 19 0 "[ . 1 . 2]"
1 24 LYS 1.732 0.230 3 0 "[ . 1 . 2]"
1 25 GLN 14.670 0.997 13 4 "[* . 1 *+ . -]"
1 26 ASN 6.794 0.441 20 0 "[ . 1 . 2]"
1 27 ILE 5.161 0.230 3 0 "[ . 1 . 2]"
1 28 ALA 2.371 0.103 18 0 "[ . 1 . 2]"
1 29 ALA 3.144 0.417 19 0 "[ . 1 . 2]"
1 30 ASN 5.457 0.978 7 3 "[ . + 1- * 2]"
1 31 GLN 5.566 0.176 14 0 "[ . 1 . 2]"
1 32 LEU 4.309 0.095 13 0 "[ . 1 . 2]"
1 33 VAL 3.339 0.451 1 0 "[ . 1 . 2]"
1 34 TYR 7.577 0.479 20 0 "[ . 1 . 2]"
1 35 GLY 2.385 0.104 9 0 "[ . 1 . 2]"
1 36 ILE 6.180 0.115 17 0 "[ . 1 . 2]"
1 37 VAL 3.566 0.113 17 0 "[ . 1 . 2]"
1 38 LYS 9.660 0.966 18 4 "[ * - 1 . + *]"
1 39 PRO 9.907 0.944 20 2 "[ * 1 . +]"
1 40 SER 9.553 0.966 18 2 "[ . - 1 . + 2]"
1 41 ASP 2.327 0.112 12 0 "[ . 1 . 2]"
1 42 THR 2.647 0.151 17 0 "[ . 1 . 2]"
1 43 VAL 6.923 0.151 17 0 "[ . 1 . 2]"
1 44 PRO 2.523 0.083 19 0 "[ . 1 . 2]"
1 45 ALA 0.759 0.081 15 0 "[ . 1 . 2]"
1 46 GLY 1.671 0.341 7 0 "[ . 1 . 2]"
1 47 VAL 2.113 0.105 8 0 "[ . 1 . 2]"
1 48 ASP 7.030 0.352 14 0 "[ . 1 . 2]"
1 49 ASP 5.898 0.167 15 0 "[ . 1 . 2]"
1 50 TYR 7.132 0.205 11 0 "[ . 1 . 2]"
1 51 SER 3.728 0.479 20 0 "[ . 1 . 2]"
1 52 TYR 6.071 0.245 20 0 "[ . 1 . 2]"
1 53 LEU 3.839 0.104 20 0 "[ . 1 . 2]"
1 54 VAL 2.361 0.097 10 0 "[ . 1 . 2]"
1 55 ALA 2.773 0.870 13 2 "[ - . 1 + . 2]"
1 56 ALA 4.174 0.237 11 0 "[ . 1 . 2]"
1 57 ASP 3.394 0.113 3 0 "[ . 1 . 2]"
1 58 ASP 3.683 0.870 13 2 "[ - . 1 + . 2]"
1 59 GLN 1.357 0.237 11 0 "[ . 1 . 2]"
1 60 ASP 10.417 0.973 19 6 "[ .- * 1* * * +2]"
1 61 GLY 0.246 0.085 19 0 "[ . 1 . 2]"
1 62 THR 4.779 0.125 9 0 "[ . 1 . 2]"
1 63 ILE 8.751 0.135 8 0 "[ . 1 . 2]"
1 64 ILE 9.158 0.286 2 0 "[ . 1 . 2]"
1 65 PHE 5.756 0.175 20 0 "[ . 1 . 2]"
1 66 PHE 2.563 0.182 8 0 "[ . 1 . 2]"
1 67 LYS 13.394 0.978 15 6 "[ - . * * * *+ 2]"
1 68 ALA 6.666 0.978 15 5 "[ . * * - *+ 2]"
1 69 GLU 2.076 0.375 19 0 "[ . 1 . 2]"
1 70 GLY 0.700 0.663 9 1 "[ . +1 . 2]"
1 71 GLN 5.485 0.999 8 3 "[ . +-1 * . 2]"
1 72 THR 4.271 0.108 9 0 "[ . 1 . 2]"
1 73 VAL 3.383 0.111 9 0 "[ . 1 . 2]"
1 74 ILE 9.059 0.250 3 0 "[ . 1 . 2]"
1 75 ILE 6.694 0.123 9 0 "[ . 1 . 2]"
1 76 LYS 7.771 0.205 11 0 "[ . 1 . 2]"
1 77 TYR 8.846 0.135 11 0 "[ . 1 . 2]"
1 78 THR 7.181 0.119 8 0 "[ . 1 . 2]"
1 79 SER 4.440 0.295 9 0 "[ . 1 . 2]"
1 80 GLN 7.421 0.295 9 0 "[ . 1 . 2]"
1 81 ARG 13.645 0.973 19 5 "[ .- * 1* * +2]"
1 82 ASN 10.927 0.730 3 3 "[ + .- 1 * . 2]"
1 83 THR 6.170 0.730 3 2 "[ + . 1 - . 2]"
1 84 LYS 1.577 0.110 1 0 "[ . 1 . 2]"
1 85 LEU 5.722 0.724 18 1 "[ . 1 . + 2]"
1 86 LYS 5.324 0.724 18 1 "[ . 1 . + 2]"
1 87 ALA 4.309 0.268 4 0 "[ . 1 . 2]"
1 88 LYS 9.953 0.854 9 8 "[ *** -+* * .* 2]"
1 89 ALA 7.431 0.250 3 0 "[ . 1 . 2]"
1 90 LEU 2.658 0.111 9 0 "[ . 1 . 2]"
1 91 THR 3.439 0.372 2 0 "[ . 1 . 2]"
1 92 LEU 12.508 0.999 8 2 "[ . + 1 - . 2]"
1 93 SER 4.412 0.107 14 0 "[ . 1 . 2]"
1 94 GLN 6.474 0.547 3 2 "[ + . 1 .- 2]"
1 95 LEU 2.913 0.129 15 0 "[ . 1 . 2]"
1 96 LYS 3.467 0.386 12 0 "[ . 1 . 2]"
1 97 LYS 7.316 0.545 15 1 "[ . 1 + 2]"
1 98 GLU 6.560 0.581 18 1 "[ . 1 . + 2]"
1 99 PHE 3.928 0.430 18 0 "[ . 1 . 2]"
1 100 TYR 8.022 0.215 9 0 "[ . 1 . 2]"
1 101 GLN 6.494 0.749 20 3 "[- . 1 . *+]"
1 102 THR 5.739 0.749 20 3 "[- . 1 . *+]"
1 103 ARG 3.387 0.243 8 0 "[ . 1 . 2]"
1 104 SER 1.455 0.106 8 0 "[ . 1 . 2]"
1 105 GLN 6.660 0.215 9 0 "[ . 1 . 2]"
1 106 LYS 4.891 0.221 7 0 "[ . 1 . 2]"
1 107 ARG 4.330 0.117 15 0 "[ . 1 . 2]"
1 108 GLU 11.022 0.702 18 2 "[ . 1 - + 2]"
1 109 VAL 7.045 0.108 19 0 "[ . 1 . 2]"
1 110 ASP 4.459 0.107 15 0 "[ . 1 . 2]"
1 111 ASP 1.935 0.311 16 0 "[ . 1 . 2]"
1 112 TYR 7.526 0.312 7 0 "[ . 1 . 2]"
1 113 VAL 4.356 0.096 20 0 "[ . 1 . 2]"
1 114 ALA 2.103 0.096 20 0 "[ . 1 . 2]"
1 115 GLY 0.637 0.087 6 0 "[ . 1 . 2]"
1 116 LEU 2.700 0.104 16 0 "[ . 1 . 2]"
1 117 ARG 5.627 0.978 7 3 "[ . + 1- * 2]"
1 118 THR 5.442 0.113 5 0 "[ . 1 . 2]"
1 119 GLU 4.096 0.451 1 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 MET ME 1 4 LYS HA . . 5.030 4.764 3.917 5.130 0.100 16 0 "[ . 1 . 2]" 1
2 1 4 LYS HA 1 5 PHE H . . 2.870 2.502 2.117 2.894 0.024 13 0 "[ . 1 . 2]" 1
3 1 4 LYS HA 1 5 PHE QD . . 5.190 4.336 3.367 5.122 . 0 0 "[ . 1 . 2]" 1
4 1 4 LYS HB2 1 5 PHE H . . 4.470 3.828 2.297 4.668 0.198 3 0 "[ . 1 . 2]" 1
5 1 5 PHE H 1 5 PHE HB2 . . 3.470 3.058 2.190 3.557 0.087 8 0 "[ . 1 . 2]" 1
6 1 5 PHE H 1 5 PHE HB3 . . 4.130 3.875 3.464 4.148 0.018 9 0 "[ . 1 . 2]" 1
7 1 5 PHE H 1 5 PHE QD . . 5.440 3.002 2.301 4.327 . 0 0 "[ . 1 . 2]" 1
8 1 5 PHE H 1 6 THR H . . 4.950 4.541 4.292 4.717 . 0 0 "[ . 1 . 2]" 1
9 1 5 PHE H 1 6 THR MG . . 4.860 4.771 4.298 4.966 0.106 2 0 "[ . 1 . 2]" 1
10 1 5 PHE H 1 10 ILE MD . . 5.500 4.889 4.031 5.557 0.057 9 0 "[ . 1 . 2]" 1
11 1 5 PHE HA 1 5 PHE QD . . 3.310 2.557 2.173 2.991 . 0 0 "[ . 1 . 2]" 1
12 1 5 PHE HA 1 5 PHE QE . . 4.300 4.386 4.360 4.398 0.098 9 0 "[ . 1 . 2]" 1
13 1 5 PHE HA 1 6 THR H . . 2.950 2.625 2.277 2.840 . 0 0 "[ . 1 . 2]" 1
14 1 5 PHE HA 1 6 THR MG . . 4.030 3.824 3.305 4.111 0.081 9 0 "[ . 1 . 2]" 1
15 1 5 PHE HB2 1 6 THR H . . 4.390 3.624 3.102 4.458 0.068 10 0 "[ . 1 . 2]" 1
16 1 5 PHE HB2 1 10 ILE MD . . 3.660 2.547 2.231 3.080 . 0 0 "[ . 1 . 2]" 1
17 1 5 PHE HB2 1 10 ILE QG . . 4.390 3.128 2.154 3.618 . 0 0 "[ . 1 . 2]" 1
18 1 5 PHE HB2 1 92 LEU MD2 . . 5.230 3.504 2.451 4.667 . 0 0 "[ . 1 . 2]" 1
19 1 5 PHE HB3 1 6 THR H . . 3.980 2.261 1.891 3.511 . 0 0 "[ . 1 . 2]" 1
20 1 5 PHE HB3 1 6 THR MG . . 5.500 4.798 4.283 5.174 . 0 0 "[ . 1 . 2]" 1
21 1 5 PHE HB3 1 9 GLN HB2 . . 4.250 3.290 2.162 4.111 . 0 0 "[ . 1 . 2]" 1
22 1 5 PHE HB3 1 10 ILE H . . 4.580 4.048 3.441 4.484 . 0 0 "[ . 1 . 2]" 1
23 1 5 PHE HB3 1 10 ILE MD . . 3.910 2.572 2.174 3.468 . 0 0 "[ . 1 . 2]" 1
24 1 5 PHE QD 1 6 THR H . . 4.050 3.583 2.012 4.102 0.052 7 0 "[ . 1 . 2]" 1
25 1 5 PHE QD 1 9 GLN HB2 . . 4.520 3.483 2.157 4.393 . 0 0 "[ . 1 . 2]" 1
26 1 5 PHE QD 1 9 GLN HB3 . . 4.290 3.581 2.394 4.380 0.090 3 0 "[ . 1 . 2]" 1
27 1 5 PHE QD 1 10 ILE MD . . 4.610 3.522 2.731 3.982 . 0 0 "[ . 1 . 2]" 1
28 1 5 PHE QD 1 10 ILE QG . . 3.090 2.515 2.029 3.040 . 0 0 "[ . 1 . 2]" 1
29 1 5 PHE QD 1 13 LEU QD . . 3.920 3.533 2.821 3.960 0.040 14 0 "[ . 1 . 2]" 1
30 1 5 PHE QD 1 92 LEU MD1 . . 4.250 3.707 2.373 4.370 0.120 9 0 "[ . 1 . 2]" 1
31 1 5 PHE QD 1 92 LEU MD2 . . 4.030 3.203 2.250 4.141 0.111 9 0 "[ . 1 . 2]" 1
32 1 5 PHE QE 1 13 LEU QD . . 4.210 2.585 2.073 3.669 . 0 0 "[ . 1 . 2]" 1
33 1 5 PHE QE 1 92 LEU MD2 . . 4.540 4.047 2.687 4.637 0.097 17 0 "[ . 1 . 2]" 1
34 1 5 PHE QE 1 96 LYS HA . . 4.410 4.301 3.879 4.502 0.092 14 0 "[ . 1 . 2]" 1
35 1 5 PHE QE 1 96 LYS QB . . 4.050 3.387 2.241 4.139 0.089 9 0 "[ . 1 . 2]" 1
36 1 5 PHE QE 1 96 LYS HE2 . . 5.300 3.930 2.057 5.492 0.192 1 0 "[ . 1 . 2]" 1
37 1 5 PHE QE 1 96 LYS QG . . 4.180 3.644 3.120 4.123 . 0 0 "[ . 1 . 2]" 1
38 1 6 THR H 1 6 THR HB . . 4.070 3.662 3.416 3.881 . 0 0 "[ . 1 . 2]" 1
39 1 6 THR H 1 6 THR MG . . 3.260 3.154 2.263 3.371 0.111 3 0 "[ . 1 . 2]" 1
40 1 6 THR H 1 9 GLN H . . 4.870 3.595 3.178 4.088 . 0 0 "[ . 1 . 2]" 1
41 1 6 THR H 1 9 GLN HB2 . . 4.410 2.348 1.857 2.661 . 0 0 "[ . 1 . 2]" 1
42 1 6 THR H 1 9 GLN HB3 . . 4.020 3.806 3.176 4.087 0.067 9 0 "[ . 1 . 2]" 1
43 1 6 THR H 1 9 GLN QG . . 3.800 2.919 2.001 3.776 . 0 0 "[ . 1 . 2]" 1
44 1 6 THR H 1 10 ILE MD . . 5.500 3.638 3.184 4.315 . 0 0 "[ . 1 . 2]" 1
45 1 6 THR HA 1 6 THR MG . . 3.160 2.290 2.132 2.635 . 0 0 "[ . 1 . 2]" 1
46 1 6 THR HA 1 7 ASP H . . 3.160 2.345 2.213 2.523 . 0 0 "[ . 1 . 2]" 1
47 1 6 THR HB 1 7 ASP H . . 3.190 2.892 2.400 3.259 0.069 14 0 "[ . 1 . 2]" 1
48 1 6 THR HB 1 8 GLN H . . 3.580 3.112 2.462 3.503 . 0 0 "[ . 1 . 2]" 1
49 1 6 THR HB 1 8 GLN HG2 . . 5.240 5.112 4.352 5.335 0.095 6 0 "[ . 1 . 2]" 1
50 1 6 THR HB 1 8 GLN HG3 . . 5.120 4.351 2.999 5.128 0.008 8 0 "[ . 1 . 2]" 1
51 1 6 THR HB 1 9 GLN H . . 4.310 3.558 2.797 4.187 . 0 0 "[ . 1 . 2]" 1
52 1 6 THR HB 1 9 GLN HE21 . . 5.500 5.486 5.074 5.578 0.078 10 0 "[ . 1 . 2]" 1
53 1 6 THR HB 1 9 GLN QG . . 4.260 3.693 3.534 3.907 . 0 0 "[ . 1 . 2]" 1
54 1 6 THR MG 1 7 ASP H . . 4.290 3.631 3.215 4.218 . 0 0 "[ . 1 . 2]" 1
55 1 6 THR MG 1 7 ASP QB . . 5.500 5.149 4.589 5.600 0.100 15 0 "[ . 1 . 2]" 1
56 1 6 THR MG 1 8 GLN H . . 4.670 4.542 3.964 4.757 0.087 2 0 "[ . 1 . 2]" 1
57 1 6 THR MG 1 9 GLN H . . 4.780 4.527 3.943 4.905 0.125 6 0 "[ . 1 . 2]" 1
58 1 6 THR MG 1 9 GLN QG . . 4.500 3.473 2.151 4.055 . 0 0 "[ . 1 . 2]" 1
59 1 7 ASP H 1 7 ASP QB . . 3.170 2.429 2.001 2.709 . 0 0 "[ . 1 . 2]" 1
60 1 7 ASP H 1 8 GLN H . . 3.790 2.832 2.617 3.130 . 0 0 "[ . 1 . 2]" 1
61 1 7 ASP HA 1 9 GLN H . . 4.880 4.488 4.126 4.787 . 0 0 "[ . 1 . 2]" 1
62 1 7 ASP HA 1 10 ILE H . . 4.160 3.556 3.027 3.867 . 0 0 "[ . 1 . 2]" 1
63 1 7 ASP HA 1 10 ILE HB . . 3.210 2.761 2.358 3.285 0.075 13 0 "[ . 1 . 2]" 1
64 1 7 ASP HA 1 10 ILE MD . . 3.590 2.529 2.038 3.636 0.046 14 0 "[ . 1 . 2]" 1
65 1 7 ASP HA 1 10 ILE QG . . 4.420 3.717 2.574 4.214 . 0 0 "[ . 1 . 2]" 1
66 1 7 ASP QB 1 8 GLN H . . 3.610 2.633 2.388 3.117 . 0 0 "[ . 1 . 2]" 1
67 1 7 ASP QB 1 8 GLN HG2 . . 4.890 4.719 3.890 5.446 0.556 15 1 "[ . 1 + 2]" 1
68 1 7 ASP QB 1 8 GLN HG3 . . 5.380 3.903 3.112 5.443 0.063 20 0 "[ . 1 . 2]" 1
69 1 8 GLN H 1 8 GLN HB2 . . 3.440 2.630 2.137 3.153 . 0 0 "[ . 1 . 2]" 1
70 1 8 GLN H 1 8 GLN HB3 . . 4.070 3.547 3.439 3.622 . 0 0 "[ . 1 . 2]" 1
71 1 8 GLN H 1 8 GLN HG2 . . 3.800 3.320 2.587 3.633 . 0 0 "[ . 1 . 2]" 1
72 1 8 GLN H 1 8 GLN HG3 . . 4.230 2.518 1.894 3.489 . 0 0 "[ . 1 . 2]" 1
73 1 8 GLN H 1 9 GLN H . . 3.500 2.861 2.630 3.200 . 0 0 "[ . 1 . 2]" 1
74 1 8 GLN H 1 113 VAL MG1 . . 5.100 4.695 4.360 5.113 0.013 3 0 "[ . 1 . 2]" 1
75 1 8 GLN HA 1 8 GLN HG2 . . 3.580 3.120 2.300 3.799 0.219 13 0 "[ . 1 . 2]" 1
76 1 8 GLN HA 1 8 GLN HG3 . . 3.780 3.063 2.643 3.702 . 0 0 "[ . 1 . 2]" 1
77 1 8 GLN HA 1 11 GLY H . . 4.120 3.737 3.336 4.170 0.050 14 0 "[ . 1 . 2]" 1
78 1 8 GLN HA 1 11 GLY HA3 . . 5.060 4.122 3.526 5.038 . 0 0 "[ . 1 . 2]" 1
79 1 8 GLN HA 1 34 TYR QD . . 4.630 4.153 3.438 4.715 0.085 6 0 "[ . 1 . 2]" 1
80 1 8 GLN HA 1 34 TYR QE . . 4.370 3.740 2.597 4.445 0.075 6 0 "[ . 1 . 2]" 1
81 1 8 GLN HA 1 116 LEU MD2 . . 4.290 3.779 3.316 4.379 0.089 14 0 "[ . 1 . 2]" 1
82 1 8 GLN HB2 1 9 GLN H . . 4.020 2.463 2.036 2.724 . 0 0 "[ . 1 . 2]" 1
83 1 8 GLN HB2 1 113 VAL MG1 . . 3.710 2.714 2.051 3.414 . 0 0 "[ . 1 . 2]" 1
84 1 8 GLN HB3 1 9 GLN H . . 4.490 3.494 2.857 4.012 . 0 0 "[ . 1 . 2]" 1
85 1 8 GLN HB3 1 113 VAL MG1 . . 3.410 2.288 1.989 2.883 . 0 0 "[ . 1 . 2]" 1
86 1 8 GLN HE21 1 9 GLN HE21 . . 5.500 4.211 3.892 5.557 0.057 14 0 "[ . 1 . 2]" 1
87 1 8 GLN HE21 1 9 GLN HE22 . . 5.500 5.519 4.485 5.587 0.087 9 0 "[ . 1 . 2]" 1
88 1 8 GLN HE21 1 113 VAL MG1 . . 5.500 2.562 1.732 3.430 . 0 0 "[ . 1 . 2]" 1
89 1 8 GLN HE21 1 116 LEU MD2 . . 5.500 4.703 3.284 5.588 0.088 16 0 "[ . 1 . 2]" 1
90 1 8 GLN HG2 1 9 GLN H . . 5.330 4.832 4.670 5.015 . 0 0 "[ . 1 . 2]" 1
91 1 8 GLN HG2 1 34 TYR QD . . 4.790 4.301 3.538 4.966 0.176 13 0 "[ . 1 . 2]" 1
92 1 8 GLN HG2 1 113 VAL MG1 . . 4.540 3.844 3.222 4.428 . 0 0 "[ . 1 . 2]" 1
93 1 8 GLN HG3 1 9 GLN H . . 5.350 4.466 4.078 4.875 . 0 0 "[ . 1 . 2]" 1
94 1 8 GLN HG3 1 34 TYR QD . . 5.190 4.766 3.796 5.287 0.097 9 0 "[ . 1 . 2]" 1
95 1 8 GLN HG3 1 113 VAL MG1 . . 4.820 4.379 3.959 4.811 . 0 0 "[ . 1 . 2]" 1
96 1 9 GLN H 1 9 GLN HB2 . . 3.670 2.413 2.257 2.674 . 0 0 "[ . 1 . 2]" 1
97 1 9 GLN H 1 9 GLN HB3 . . 3.690 3.553 3.470 3.625 . 0 0 "[ . 1 . 2]" 1
98 1 9 GLN H 1 9 GLN QG . . 3.880 2.279 2.028 3.420 . 0 0 "[ . 1 . 2]" 1
99 1 9 GLN H 1 10 ILE H . . 3.590 2.629 2.420 2.859 . 0 0 "[ . 1 . 2]" 1
100 1 9 GLN H 1 10 ILE HA . . 5.500 5.280 5.114 5.442 . 0 0 "[ . 1 . 2]" 1
101 1 9 GLN H 1 113 VAL MG1 . . 4.730 3.441 3.048 3.925 . 0 0 "[ . 1 . 2]" 1
102 1 9 GLN H 1 113 VAL MG2 . . 4.960 3.980 3.707 4.302 . 0 0 "[ . 1 . 2]" 1
103 1 9 GLN HA 1 9 GLN QG . . 3.560 2.806 2.657 2.930 . 0 0 "[ . 1 . 2]" 1
104 1 9 GLN HA 1 113 VAL MG1 . . 4.180 2.900 2.437 3.665 . 0 0 "[ . 1 . 2]" 1
105 1 9 GLN HA 1 113 VAL MG2 . . 3.030 2.036 1.920 2.195 . 0 0 "[ . 1 . 2]" 1
106 1 9 GLN HB2 1 10 ILE H . . 4.250 2.642 2.342 2.923 . 0 0 "[ . 1 . 2]" 1
107 1 9 GLN HB2 1 10 ILE QG . . 5.080 3.100 2.697 3.612 . 0 0 "[ . 1 . 2]" 1
108 1 9 GLN HB3 1 10 ILE H . . 3.710 3.657 3.352 3.779 0.069 1 0 "[ . 1 . 2]" 1
109 1 9 GLN HE21 1 113 VAL MG2 . . 5.500 3.327 2.861 3.882 . 0 0 "[ . 1 . 2]" 1
110 1 9 GLN HE22 1 9 GLN QG . . 3.830 3.268 3.177 3.316 . 0 0 "[ . 1 . 2]" 1
111 1 9 GLN HE22 1 113 VAL MG2 . . 5.500 3.102 2.733 3.648 . 0 0 "[ . 1 . 2]" 1
112 1 9 GLN QG 1 113 VAL MG1 . . 4.650 2.603 2.104 3.551 . 0 0 "[ . 1 . 2]" 1
113 1 9 GLN QG 1 113 VAL MG2 . . 3.970 3.247 2.793 3.617 . 0 0 "[ . 1 . 2]" 1
114 1 10 ILE H 1 10 ILE HB . . 3.020 2.412 2.256 2.563 . 0 0 "[ . 1 . 2]" 1
115 1 10 ILE H 1 10 ILE MD . . 3.780 3.409 3.201 3.882 0.102 14 0 "[ . 1 . 2]" 1
116 1 10 ILE H 1 10 ILE QG . . 3.440 2.194 2.019 2.354 . 0 0 "[ . 1 . 2]" 1
117 1 10 ILE H 1 10 ILE MG . . 3.710 3.750 3.681 3.787 0.077 14 0 "[ . 1 . 2]" 1
118 1 10 ILE HA 1 10 ILE QG . . 3.580 2.437 2.283 2.587 . 0 0 "[ . 1 . 2]" 1
119 1 10 ILE HA 1 10 ILE MG . . 3.280 2.456 2.315 2.611 . 0 0 "[ . 1 . 2]" 1
120 1 10 ILE HA 1 13 LEU H . . 4.440 3.468 3.377 3.655 . 0 0 "[ . 1 . 2]" 1
121 1 10 ILE HA 1 13 LEU HB2 . . 3.930 2.792 2.310 3.215 . 0 0 "[ . 1 . 2]" 1
122 1 10 ILE HA 1 13 LEU HB3 . . 4.700 4.275 3.503 4.785 0.085 8 0 "[ . 1 . 2]" 1
123 1 10 ILE HA 1 13 LEU QD . . 3.540 2.961 2.258 3.502 . 0 0 "[ . 1 . 2]" 1
124 1 10 ILE HA 1 14 ALA H . . 4.940 4.041 3.763 4.402 . 0 0 "[ . 1 . 2]" 1
125 1 10 ILE HB 1 10 ILE MD . . 3.180 2.341 2.166 2.800 . 0 0 "[ . 1 . 2]" 1
126 1 10 ILE HB 1 66 PHE QR . . 5.190 3.113 2.213 3.964 . 0 0 "[ . 1 . 2]" 1
127 1 10 ILE MD 1 13 LEU QD . . 5.470 4.963 4.504 5.416 . 0 0 "[ . 1 . 2]" 1
128 1 10 ILE MD 1 66 PHE QR . . 5.300 3.998 3.034 4.897 . 0 0 "[ . 1 . 2]" 1
129 1 10 ILE MD 1 68 ALA H . . 4.680 4.336 3.781 4.766 0.086 13 0 "[ . 1 . 2]" 1
130 1 10 ILE MD 1 68 ALA HA . . 5.420 4.303 3.709 4.891 . 0 0 "[ . 1 . 2]" 1
131 1 10 ILE MD 1 68 ALA MB . . 3.440 2.124 1.885 2.450 . 0 0 "[ . 1 . 2]" 1
132 1 10 ILE QG 1 13 LEU QD . . 5.500 3.744 3.149 4.151 . 0 0 "[ . 1 . 2]" 1
133 1 10 ILE MG 1 13 LEU QD . . 4.470 3.859 3.111 4.459 . 0 0 "[ . 1 . 2]" 1
134 1 10 ILE MG 1 14 ALA H . . 4.770 3.712 3.387 4.145 . 0 0 "[ . 1 . 2]" 1
135 1 10 ILE MG 1 66 PHE QR . . 3.710 2.852 2.257 3.353 . 0 0 "[ . 1 . 2]" 1
136 1 10 ILE MG 1 66 PHE QE . . 4.760 3.418 2.462 4.356 . 0 0 "[ . 1 . 2]" 1
137 1 10 ILE MG 1 68 ALA H . . 4.830 4.141 3.518 4.732 . 0 0 "[ . 1 . 2]" 1
138 1 10 ILE MG 1 68 ALA MB . . 3.720 2.262 1.958 3.620 . 0 0 "[ . 1 . 2]" 1
139 1 11 GLY H 1 12 VAL H . . 4.090 2.877 2.704 3.051 . 0 0 "[ . 1 . 2]" 1
140 1 11 GLY HA2 1 12 VAL HA . . 5.180 4.794 4.693 4.864 . 0 0 "[ . 1 . 2]" 1
141 1 11 GLY HA2 1 14 ALA H . . 4.460 3.578 3.156 3.990 . 0 0 "[ . 1 . 2]" 1
142 1 11 GLY HA2 1 14 ALA MB . . 3.780 2.591 2.265 3.283 . 0 0 "[ . 1 . 2]" 1
143 1 11 GLY HA2 1 15 GLY H . . 5.360 4.033 3.660 4.238 . 0 0 "[ . 1 . 2]" 1
144 1 11 GLY HA2 1 66 PHE QR . . 4.910 2.853 2.372 3.034 . 0 0 "[ . 1 . 2]" 1
145 1 11 GLY HA3 1 14 ALA MB . . 4.890 4.070 3.692 4.736 . 0 0 "[ . 1 . 2]" 1
146 1 11 GLY HA3 1 15 GLY H . . 4.980 4.916 4.609 5.052 0.072 5 0 "[ . 1 . 2]" 1
147 1 11 GLY HA3 1 53 LEU QD . . 4.380 2.724 2.118 3.246 . 0 0 "[ . 1 . 2]" 1
148 1 11 GLY HA3 1 66 PHE QR . . 4.960 2.876 2.424 3.541 . 0 0 "[ . 1 . 2]" 1
149 1 12 VAL H 1 12 VAL HB . . 3.100 2.397 2.277 2.490 . 0 0 "[ . 1 . 2]" 1
150 1 12 VAL H 1 12 VAL MG1 . . 4.050 3.762 3.716 3.793 . 0 0 "[ . 1 . 2]" 1
151 1 12 VAL H 1 12 VAL MG2 . . 3.160 2.287 2.108 2.508 . 0 0 "[ . 1 . 2]" 1
152 1 12 VAL H 1 13 LEU H . . 3.710 2.681 2.352 2.855 . 0 0 "[ . 1 . 2]" 1
153 1 12 VAL H 1 13 LEU QD . . 5.500 4.535 4.110 4.968 . 0 0 "[ . 1 . 2]" 1
154 1 12 VAL HA 1 14 ALA H . . 5.500 4.548 4.326 4.722 . 0 0 "[ . 1 . 2]" 1
155 1 12 VAL HA 1 15 GLY H . . 4.560 3.445 3.198 3.736 . 0 0 "[ . 1 . 2]" 1
156 1 12 VAL HA 1 23 LEU QD . . 3.900 2.448 1.978 3.168 . 0 0 "[ . 1 . 2]" 1
157 1 12 VAL HB 1 13 LEU H . . 3.710 2.664 2.450 2.907 . 0 0 "[ . 1 . 2]" 1
158 1 12 VAL HB 1 13 LEU HA . . 5.150 4.557 4.331 4.712 . 0 0 "[ . 1 . 2]" 1
159 1 12 VAL MG1 1 13 LEU H . . 4.330 3.352 3.094 3.550 . 0 0 "[ . 1 . 2]" 1
160 1 12 VAL MG1 1 23 LEU QD . . 3.230 2.372 2.088 2.793 . 0 0 "[ . 1 . 2]" 1
161 1 12 VAL MG1 1 112 TYR H . . 4.690 4.105 3.862 4.411 . 0 0 "[ . 1 . 2]" 1
162 1 12 VAL MG1 1 112 TYR HA . . 4.600 4.664 4.542 4.697 0.097 14 0 "[ . 1 . 2]" 1
163 1 12 VAL MG1 1 112 TYR HB2 . . 3.070 2.163 2.063 2.255 . 0 0 "[ . 1 . 2]" 1
164 1 12 VAL MG1 1 112 TYR HB3 . . 3.560 2.893 2.742 3.014 . 0 0 "[ . 1 . 2]" 1
165 1 12 VAL MG1 1 112 TYR QD . . 2.590 2.141 1.942 2.468 . 0 0 "[ . 1 . 2]" 1
166 1 12 VAL MG1 1 113 VAL H . . 4.660 3.854 3.567 4.155 . 0 0 "[ . 1 . 2]" 1
167 1 12 VAL MG2 1 23 LEU QD . . 4.560 2.796 2.280 3.497 . 0 0 "[ . 1 . 2]" 1
168 1 12 VAL MG2 1 112 TYR HA . . 5.330 4.342 4.057 4.737 . 0 0 "[ . 1 . 2]" 1
169 1 12 VAL MG2 1 112 TYR HB2 . . 3.420 2.530 2.218 2.962 . 0 0 "[ . 1 . 2]" 1
170 1 12 VAL MG2 1 112 TYR HB3 . . 3.800 2.885 2.559 3.352 . 0 0 "[ . 1 . 2]" 1
171 1 12 VAL MG2 1 112 TYR QD . . 5.270 3.783 3.528 4.083 . 0 0 "[ . 1 . 2]" 1
172 1 12 VAL MG2 1 113 VAL H . . 3.900 3.102 2.819 3.540 . 0 0 "[ . 1 . 2]" 1
173 1 12 VAL MG2 1 113 VAL HA . . 2.870 2.751 2.372 2.962 0.092 3 0 "[ . 1 . 2]" 1
174 1 13 LEU H 1 13 LEU HB2 . . 3.590 2.321 2.059 2.735 . 0 0 "[ . 1 . 2]" 1
175 1 13 LEU H 1 13 LEU HB3 . . 4.020 3.513 3.310 3.693 . 0 0 "[ . 1 . 2]" 1
176 1 13 LEU H 1 13 LEU QD . . 4.050 2.806 2.331 3.222 . 0 0 "[ . 1 . 2]" 1
177 1 13 LEU H 1 14 ALA H . . 3.420 2.732 2.522 2.940 . 0 0 "[ . 1 . 2]" 1
178 1 13 LEU H 1 14 ALA MB . . 4.970 4.366 4.135 4.564 . 0 0 "[ . 1 . 2]" 1
179 1 13 LEU H 1 15 GLY H . . 5.500 4.178 3.963 4.416 . 0 0 "[ . 1 . 2]" 1
180 1 13 LEU H 1 109 VAL MG1 . . 4.500 4.092 3.790 4.463 . 0 0 "[ . 1 . 2]" 1
181 1 13 LEU HA 1 13 LEU QD . . 2.970 2.123 2.038 2.282 . 0 0 "[ . 1 . 2]" 1
182 1 13 LEU HA 1 13 LEU HG . . 3.730 2.929 2.576 3.455 . 0 0 "[ . 1 . 2]" 1
183 1 13 LEU HA 1 16 LEU H . . 4.510 3.333 3.093 3.541 . 0 0 "[ . 1 . 2]" 1
184 1 13 LEU HA 1 16 LEU HB3 . . 4.830 4.147 3.392 4.901 0.071 19 0 "[ . 1 . 2]" 1
185 1 13 LEU HA 1 16 LEU QD . . 3.400 2.804 2.121 3.383 . 0 0 "[ . 1 . 2]" 1
186 1 13 LEU HA 1 17 ALA H . . 4.820 4.701 4.122 4.889 0.069 18 0 "[ . 1 . 2]" 1
187 1 13 LEU HB2 1 14 ALA H . . 3.530 2.781 2.417 3.107 . 0 0 "[ . 1 . 2]" 1
188 1 13 LEU HB3 1 14 ALA H . . 4.150 3.332 2.937 3.810 . 0 0 "[ . 1 . 2]" 1
189 1 13 LEU HB3 1 95 LEU QD . . 5.050 2.429 2.002 2.924 . 0 0 "[ . 1 . 2]" 1
190 1 13 LEU HB3 1 99 PHE QD . . 3.210 3.186 2.446 3.316 0.106 15 0 "[ . 1 . 2]" 1
191 1 13 LEU QD 1 14 ALA H . . 4.550 4.076 3.902 4.190 . 0 0 "[ . 1 . 2]" 1
192 1 13 LEU QD 1 92 LEU HA . . 5.500 4.896 4.229 5.464 . 0 0 "[ . 1 . 2]" 1
193 1 13 LEU QD 1 92 LEU MD2 . . 4.790 4.083 3.353 4.578 . 0 0 "[ . 1 . 2]" 1
194 1 13 LEU QD 1 95 LEU HA . . 5.260 4.076 3.772 4.685 . 0 0 "[ . 1 . 2]" 1
195 1 13 LEU QD 1 95 LEU HB2 . . 4.610 3.154 2.598 4.235 . 0 0 "[ . 1 . 2]" 1
196 1 13 LEU QD 1 95 LEU HB3 . . 4.370 2.397 2.039 3.311 . 0 0 "[ . 1 . 2]" 1
197 1 13 LEU QD 1 96 LYS H . . 5.020 3.817 3.395 4.865 . 0 0 "[ . 1 . 2]" 1
198 1 13 LEU QD 1 96 LYS HA . . 4.400 2.747 2.182 3.459 . 0 0 "[ . 1 . 2]" 1
199 1 13 LEU QD 1 96 LYS QB . . 5.500 3.606 3.182 4.402 . 0 0 "[ . 1 . 2]" 1
200 1 13 LEU QD 1 96 LYS QG . . 5.310 3.836 3.336 4.162 . 0 0 "[ . 1 . 2]" 1
201 1 13 LEU QD 1 99 PHE H . . 4.730 3.718 3.215 4.074 . 0 0 "[ . 1 . 2]" 1
202 1 13 LEU QD 1 99 PHE HA . . 4.660 4.267 3.949 4.552 . 0 0 "[ . 1 . 2]" 1
203 1 13 LEU QD 1 99 PHE QB . . 3.330 2.207 1.943 2.603 . 0 0 "[ . 1 . 2]" 1
204 1 13 LEU QD 1 100 TYR HA . . 4.990 3.902 3.552 4.258 . 0 0 "[ . 1 . 2]" 1
205 1 13 LEU QD 1 100 TYR HB2 . . 3.580 2.340 2.075 2.719 . 0 0 "[ . 1 . 2]" 1
206 1 13 LEU QD 1 100 TYR HB3 . . 4.640 3.409 3.017 3.843 . 0 0 "[ . 1 . 2]" 1
207 1 13 LEU QD 1 100 TYR QD . . 4.070 2.780 2.107 3.118 . 0 0 "[ . 1 . 2]" 1
208 1 13 LEU QD 1 109 VAL MG1 . . 4.760 2.008 1.886 2.600 . 0 0 "[ . 1 . 2]" 1
209 1 13 LEU QD 1 109 VAL MG2 . . 5.210 2.899 2.141 3.500 . 0 0 "[ . 1 . 2]" 1
210 1 13 LEU HG 1 14 ALA H . . 5.400 4.697 4.078 5.252 . 0 0 "[ . 1 . 2]" 1
211 1 13 LEU HG 1 99 PHE QB . . 5.500 3.213 2.054 4.661 . 0 0 "[ . 1 . 2]" 1
212 1 14 ALA H 1 14 ALA MB . . 2.940 2.220 2.126 2.313 . 0 0 "[ . 1 . 2]" 1
213 1 14 ALA H 1 17 ALA MB . . 5.320 5.240 4.726 5.441 0.121 7 0 "[ . 1 . 2]" 1
214 1 14 ALA H 1 75 ILE MD . . 5.120 4.609 4.355 4.967 . 0 0 "[ . 1 . 2]" 1
215 1 14 ALA H 1 95 LEU QD . . 5.210 3.359 2.655 4.024 . 0 0 "[ . 1 . 2]" 1
216 1 14 ALA HA 1 15 GLY HA2 . . 4.900 4.783 4.650 4.895 . 0 0 "[ . 1 . 2]" 1
217 1 14 ALA HA 1 16 LEU H . . 4.860 4.316 3.666 4.638 . 0 0 "[ . 1 . 2]" 1
218 1 14 ALA HA 1 17 ALA H . . 4.010 3.582 3.304 3.896 . 0 0 "[ . 1 . 2]" 1
219 1 14 ALA HA 1 17 ALA MB . . 3.410 3.092 2.715 3.448 0.038 10 0 "[ . 1 . 2]" 1
220 1 14 ALA HA 1 75 ILE MD . . 3.480 2.417 2.103 2.800 . 0 0 "[ . 1 . 2]" 1
221 1 14 ALA HA 1 95 LEU QD . . 3.770 2.394 2.056 3.027 . 0 0 "[ . 1 . 2]" 1
222 1 14 ALA MB 1 15 GLY H . . 3.850 2.646 2.448 2.895 . 0 0 "[ . 1 . 2]" 1
223 1 14 ALA MB 1 15 GLY HA3 . . 5.500 4.274 4.164 4.545 . 0 0 "[ . 1 . 2]" 1
224 1 14 ALA MB 1 18 ILE HB . . 4.830 4.791 4.347 4.933 0.103 19 0 "[ . 1 . 2]" 1
225 1 14 ALA MB 1 66 PHE HA . . 5.500 4.851 4.276 5.245 . 0 0 "[ . 1 . 2]" 1
226 1 14 ALA MB 1 66 PHE HB2 . . 4.720 3.313 2.881 3.715 . 0 0 "[ . 1 . 2]" 1
227 1 15 GLY H 1 16 LEU H . . 3.570 2.675 2.348 2.818 . 0 0 "[ . 1 . 2]" 1
228 1 15 GLY H 1 17 ALA H . . 5.330 4.141 3.658 4.320 . 0 0 "[ . 1 . 2]" 1
229 1 15 GLY H 1 23 LEU QD . . 4.090 3.570 3.200 3.878 . 0 0 "[ . 1 . 2]" 1
230 1 15 GLY H 1 53 LEU QD . . 4.170 3.796 3.379 3.992 . 0 0 "[ . 1 . 2]" 1
231 1 15 GLY HA2 1 18 ILE H . . 4.840 3.051 2.727 3.352 . 0 0 "[ . 1 . 2]" 1
232 1 15 GLY HA2 1 18 ILE HB . . 4.060 2.918 2.564 3.012 . 0 0 "[ . 1 . 2]" 1
233 1 15 GLY HA2 1 23 LEU QD . . 3.920 3.652 3.388 3.951 0.031 9 0 "[ . 1 . 2]" 1
234 1 15 GLY HA2 1 64 ILE MD . . 3.350 2.819 2.166 3.442 0.092 10 0 "[ . 1 . 2]" 1
235 1 15 GLY HA2 1 64 ILE MG . . 4.960 3.364 2.828 3.910 . 0 0 "[ . 1 . 2]" 1
236 1 15 GLY HA3 1 16 LEU QD . . 4.690 4.417 3.885 4.659 . 0 0 "[ . 1 . 2]" 1
237 1 15 GLY HA3 1 17 ALA H . . 4.870 4.551 4.407 4.902 0.032 15 0 "[ . 1 . 2]" 1
238 1 15 GLY HA3 1 18 ILE H . . 4.940 4.283 4.039 4.734 . 0 0 "[ . 1 . 2]" 1
239 1 15 GLY HA3 1 18 ILE HB . . 4.650 4.649 4.294 4.734 0.084 16 0 "[ . 1 . 2]" 1
240 1 15 GLY HA3 1 20 PRO HA . . 5.220 4.889 4.320 5.276 0.056 8 0 "[ . 1 . 2]" 1
241 1 15 GLY HA3 1 22 TRP HZ3 . . 4.690 4.478 4.002 4.769 0.079 10 0 "[ . 1 . 2]" 1
242 1 15 GLY HA3 1 23 LEU QD . . 2.990 2.336 2.003 2.573 . 0 0 "[ . 1 . 2]" 1
243 1 15 GLY HA3 1 53 LEU QD . . 3.500 3.535 3.324 3.571 0.071 7 0 "[ . 1 . 2]" 1
244 1 15 GLY HA3 1 64 ILE MD . . 4.010 3.530 2.657 4.034 0.024 19 0 "[ . 1 . 2]" 1
245 1 16 LEU H 1 16 LEU HB2 . . 3.310 2.323 2.033 2.593 . 0 0 "[ . 1 . 2]" 1
246 1 16 LEU H 1 16 LEU HB3 . . 3.690 3.485 2.992 3.713 0.023 2 0 "[ . 1 . 2]" 1
247 1 16 LEU H 1 16 LEU QD . . 3.700 3.052 2.543 3.452 . 0 0 "[ . 1 . 2]" 1
248 1 16 LEU H 1 17 ALA H . . 3.460 2.670 2.172 2.808 . 0 0 "[ . 1 . 2]" 1
249 1 16 LEU H 1 23 LEU QD . . 3.910 3.316 2.705 3.805 . 0 0 "[ . 1 . 2]" 1
250 1 16 LEU HA 1 16 LEU QD . . 2.990 2.124 2.018 2.321 . 0 0 "[ . 1 . 2]" 1
251 1 16 LEU HA 1 16 LEU HG . . 3.890 2.750 2.309 3.151 . 0 0 "[ . 1 . 2]" 1
252 1 16 LEU HA 1 17 ALA HA . . 5.060 4.715 4.594 4.828 . 0 0 "[ . 1 . 2]" 1
253 1 16 LEU HA 1 20 PRO HA . . 3.370 2.520 2.231 2.884 . 0 0 "[ . 1 . 2]" 1
254 1 16 LEU HA 1 20 PRO HB2 . . 3.850 3.651 3.493 3.850 0.000 6 0 "[ . 1 . 2]" 1
255 1 16 LEU HA 1 20 PRO HB3 . . 3.480 2.107 1.970 2.303 . 0 0 "[ . 1 . 2]" 1
256 1 16 LEU HA 1 20 PRO HG2 . . 5.010 4.955 4.762 5.297 0.287 2 0 "[ . 1 . 2]" 1
257 1 16 LEU HB2 1 17 ALA H . . 4.020 3.275 2.647 3.810 . 0 0 "[ . 1 . 2]" 1
258 1 16 LEU HB2 1 20 PRO HB3 . . 5.160 4.572 4.322 4.888 . 0 0 "[ . 1 . 2]" 1
259 1 16 LEU HB2 1 99 PHE QE . . 5.270 3.942 3.333 4.559 . 0 0 "[ . 1 . 2]" 1
260 1 16 LEU HB3 1 17 ALA H . . 4.190 3.654 3.163 4.232 0.042 2 0 "[ . 1 . 2]" 1
261 1 16 LEU HB3 1 20 PRO HA . . 4.950 4.997 4.445 5.587 0.637 5 3 "[ + 1 .* -]" 1
262 1 16 LEU HB3 1 20 PRO HB3 . . 4.980 3.564 2.903 4.328 . 0 0 "[ . 1 . 2]" 1
263 1 16 LEU HB3 1 99 PHE QE . . 4.380 3.248 2.549 3.558 . 0 0 "[ . 1 . 2]" 1
264 1 16 LEU QD 1 17 ALA H . . 5.010 4.299 4.079 4.454 . 0 0 "[ . 1 . 2]" 1
265 1 16 LEU QD 1 20 PRO HA . . 3.380 2.767 2.556 3.361 . 0 0 "[ . 1 . 2]" 1
266 1 16 LEU QD 1 20 PRO HB2 . . 4.000 3.156 2.756 3.829 . 0 0 "[ . 1 . 2]" 1
267 1 16 LEU QD 1 20 PRO HB3 . . 3.570 2.700 2.105 3.266 . 0 0 "[ . 1 . 2]" 1
268 1 16 LEU QD 1 23 LEU QD . . 3.310 2.244 1.860 3.208 . 0 0 "[ . 1 . 2]" 1
269 1 16 LEU QD 1 24 LYS QD . . 5.500 3.321 2.404 4.239 . 0 0 "[ . 1 . 2]" 1
270 1 16 LEU QD 1 24 LYS HG2 . . 5.140 3.802 3.293 4.463 . 0 0 "[ . 1 . 2]" 1
271 1 16 LEU QD 1 24 LYS HG3 . . 4.700 3.149 2.615 3.651 . 0 0 "[ . 1 . 2]" 1
272 1 16 LEU QD 1 99 PHE H . . 5.070 4.996 4.768 5.066 . 0 0 "[ . 1 . 2]" 1
273 1 16 LEU QD 1 99 PHE QB . . 3.610 2.109 1.935 2.327 . 0 0 "[ . 1 . 2]" 1
274 1 16 LEU QD 1 99 PHE QD . . 2.920 2.683 2.282 2.962 0.042 2 0 "[ . 1 . 2]" 1
275 1 16 LEU QD 1 99 PHE QE . . 4.660 3.771 3.393 4.160 . 0 0 "[ . 1 . 2]" 1
276 1 16 LEU QD 1 109 VAL MG1 . . 3.560 3.215 2.591 3.570 0.010 14 0 "[ . 1 . 2]" 1
277 1 16 LEU QD 1 109 VAL MG2 . . 3.530 2.574 2.144 3.289 . 0 0 "[ . 1 . 2]" 1
278 1 16 LEU QD 1 112 TYR QD . . 4.190 3.176 2.787 3.810 . 0 0 "[ . 1 . 2]" 1
279 1 16 LEU QD 1 112 TYR QE . . 3.800 2.818 2.190 3.587 . 0 0 "[ . 1 . 2]" 1
280 1 16 LEU HG 1 17 ALA H . . 5.030 4.880 4.316 5.113 0.083 9 0 "[ . 1 . 2]" 1
281 1 17 ALA H 1 17 ALA MB . . 2.940 2.277 2.154 2.338 . 0 0 "[ . 1 . 2]" 1
282 1 17 ALA H 1 18 ILE HB . . 5.060 4.615 4.129 5.080 0.020 15 0 "[ . 1 . 2]" 1
283 1 17 ALA H 1 99 PHE QE . . 4.200 3.440 2.939 4.145 . 0 0 "[ . 1 . 2]" 1
284 1 17 ALA HA 1 99 PHE QE . . 3.410 3.221 2.794 3.486 0.076 10 0 "[ . 1 . 2]" 1
285 1 17 ALA MB 1 18 ILE H . . 4.130 3.131 2.872 3.284 . 0 0 "[ . 1 . 2]" 1
286 1 17 ALA MB 1 18 ILE HA . . 5.500 4.196 4.073 4.335 . 0 0 "[ . 1 . 2]" 1
287 1 17 ALA MB 1 18 ILE MD . . 4.190 2.547 1.962 3.554 . 0 0 "[ . 1 . 2]" 1
288 1 17 ALA MB 1 99 PHE QE . . 3.110 2.169 2.001 2.535 . 0 0 "[ . 1 . 2]" 1
289 1 18 ILE H 1 18 ILE HB . . 3.050 2.716 2.605 2.838 . 0 0 "[ . 1 . 2]" 1
290 1 18 ILE H 1 18 ILE MD . . 4.180 3.515 2.887 4.129 . 0 0 "[ . 1 . 2]" 1
291 1 18 ILE H 1 18 ILE HG12 . . 4.210 3.839 2.903 4.800 0.590 9 6 "[ - ** +* .* 2]" 1
292 1 18 ILE H 1 18 ILE MG . . 4.020 3.873 3.817 3.918 . 0 0 "[ . 1 . 2]" 1
293 1 18 ILE H 1 19 SER H . . 3.670 3.707 3.520 3.750 0.080 7 0 "[ . 1 . 2]" 1
294 1 18 ILE H 1 20 PRO HD2 . . 5.320 5.068 4.584 5.607 0.287 2 0 "[ . 1 . 2]" 1
295 1 18 ILE H 1 64 ILE MD . . 5.500 4.243 3.668 4.737 . 0 0 "[ . 1 . 2]" 1
296 1 18 ILE HA 1 18 ILE MD . . 3.050 2.726 2.217 3.159 0.109 16 0 "[ . 1 . 2]" 1
297 1 18 ILE HA 1 18 ILE HG12 . . 4.190 3.454 3.157 3.717 . 0 0 "[ . 1 . 2]" 1
298 1 18 ILE HA 1 18 ILE MG . . 3.170 2.478 2.371 2.577 . 0 0 "[ . 1 . 2]" 1
299 1 18 ILE HA 1 19 SER H . . 3.440 2.217 2.133 2.324 . 0 0 "[ . 1 . 2]" 1
300 1 18 ILE HB 1 64 ILE MD . . 3.980 2.730 2.247 3.405 . 0 0 "[ . 1 . 2]" 1
301 1 18 ILE MD 1 19 SER H . . 5.180 4.537 4.096 4.928 . 0 0 "[ . 1 . 2]" 1
302 1 18 ILE MD 1 64 ILE MD . . 4.910 4.668 4.167 4.999 0.089 15 0 "[ . 1 . 2]" 1
303 1 18 ILE MD 1 75 ILE HB . . 4.920 3.421 2.829 3.929 . 0 0 "[ . 1 . 2]" 1
304 1 18 ILE MD 1 75 ILE MD . . 4.010 2.645 1.927 3.314 . 0 0 "[ . 1 . 2]" 1
305 1 18 ILE MD 1 75 ILE HG12 . . 5.500 4.911 4.108 5.595 0.095 7 0 "[ . 1 . 2]" 1
306 1 18 ILE MD 1 75 ILE HG13 . . 5.500 4.722 4.006 5.403 . 0 0 "[ . 1 . 2]" 1
307 1 18 ILE MD 1 75 ILE MG . . 3.910 2.801 2.105 3.609 . 0 0 "[ . 1 . 2]" 1
308 1 18 ILE MD 1 77 TYR HB3 . . 4.840 4.318 3.554 4.918 0.078 13 0 "[ . 1 . 2]" 1
309 1 18 ILE MD 1 77 TYR QD . . 4.290 3.239 2.654 3.733 . 0 0 "[ . 1 . 2]" 1
310 1 18 ILE MD 1 77 TYR QE . . 3.220 2.836 2.139 3.332 0.112 10 0 "[ . 1 . 2]" 1
311 1 18 ILE MD 1 88 LYS H . . 5.500 5.231 4.491 5.593 0.093 18 0 "[ . 1 . 2]" 1
312 1 18 ILE MD 1 88 LYS QB . . 3.790 2.992 2.667 3.575 . 0 0 "[ . 1 . 2]" 1
313 1 18 ILE MD 1 88 LYS QD . . 3.770 3.394 2.287 3.867 0.097 13 0 "[ . 1 . 2]" 1
314 1 18 ILE MD 1 88 LYS QE . . 3.980 2.671 1.960 3.207 . 0 0 "[ . 1 . 2]" 1
315 1 18 ILE MD 1 88 LYS QG . . 4.520 2.749 2.143 4.047 . 0 0 "[ . 1 . 2]" 1
316 1 18 ILE HG12 1 88 LYS QE . . 4.290 4.569 3.845 5.144 0.854 9 8 "[ *** -+* * .* 2]" 1
317 1 18 ILE MG 1 19 SER H . . 4.010 3.490 3.140 3.714 . 0 0 "[ . 1 . 2]" 1
318 1 18 ILE MG 1 19 SER HA . . 4.930 4.611 4.322 4.817 . 0 0 "[ . 1 . 2]" 1
319 1 18 ILE MG 1 19 SER QB . . 3.520 3.000 2.626 3.443 . 0 0 "[ . 1 . 2]" 1
320 1 18 ILE MG 1 64 ILE HA . . 5.500 4.445 3.876 5.044 . 0 0 "[ . 1 . 2]" 1
321 1 18 ILE MG 1 64 ILE MD . . 3.920 2.323 2.076 2.820 . 0 0 "[ . 1 . 2]" 1
322 1 18 ILE MG 1 64 ILE MG . . 3.670 2.585 2.120 3.022 . 0 0 "[ . 1 . 2]" 1
323 1 18 ILE MG 1 77 TYR H . . 5.500 4.692 4.433 5.125 . 0 0 "[ . 1 . 2]" 1
324 1 18 ILE MG 1 77 TYR HB2 . . 4.090 2.518 2.193 3.023 . 0 0 "[ . 1 . 2]" 1
325 1 18 ILE MG 1 77 TYR HB3 . . 4.390 2.323 2.092 2.714 . 0 0 "[ . 1 . 2]" 1
326 1 18 ILE MG 1 77 TYR QD . . 3.930 2.817 2.437 3.240 . 0 0 "[ . 1 . 2]" 1
327 1 18 ILE MG 1 77 TYR QE . . 4.360 3.739 3.334 4.388 0.028 9 0 "[ . 1 . 2]" 1
328 1 19 SER H 1 19 SER QB . . 3.910 3.053 2.844 3.393 . 0 0 "[ . 1 . 2]" 1
329 1 19 SER H 1 20 PRO HD2 . . 3.480 2.755 2.545 3.368 . 0 0 "[ . 1 . 2]" 1
330 1 19 SER H 1 20 PRO HD3 . . 4.290 2.677 2.551 2.955 . 0 0 "[ . 1 . 2]" 1
331 1 19 SER H 1 64 ILE MD . . 4.790 4.820 4.624 4.888 0.098 8 0 "[ . 1 . 2]" 1
332 1 19 SER HA 1 20 PRO HD2 . . 3.500 2.197 2.092 2.348 . 0 0 "[ . 1 . 2]" 1
333 1 19 SER HA 1 20 PRO HD3 . . 2.980 3.224 2.791 3.438 0.458 3 0 "[ . 1 . 2]" 1
334 1 19 SER HA 1 20 PRO HG2 . . 4.960 4.204 4.086 4.439 . 0 0 "[ . 1 . 2]" 1
335 1 19 SER HA 1 20 PRO HG3 . . 4.850 4.821 4.718 4.994 0.144 3 0 "[ . 1 . 2]" 1
336 1 19 SER QB 1 22 TRP H . . 4.580 3.574 3.233 3.839 . 0 0 "[ . 1 . 2]" 1
337 1 19 SER QB 1 22 TRP HB2 . . 4.090 3.419 3.091 3.802 . 0 0 "[ . 1 . 2]" 1
338 1 19 SER QB 1 22 TRP HE3 . . 3.380 3.180 2.676 3.403 0.023 9 0 "[ . 1 . 2]" 1
339 1 19 SER QB 1 62 THR MG . . 4.720 3.689 3.007 4.120 . 0 0 "[ . 1 . 2]" 1
340 1 19 SER QB 1 64 ILE MD . . 3.980 2.839 2.149 3.461 . 0 0 "[ . 1 . 2]" 1
341 1 19 SER QB 1 64 ILE HG13 . . 5.470 4.804 4.112 5.254 . 0 0 "[ . 1 . 2]" 1
342 1 20 PRO HA 1 23 LEU HB2 . . 4.180 3.925 3.063 4.275 0.095 19 0 "[ . 1 . 2]" 1
343 1 20 PRO HA 1 23 LEU HB3 . . 4.010 2.780 2.379 3.275 . 0 0 "[ . 1 . 2]" 1
344 1 20 PRO HA 1 23 LEU QD . . 4.410 3.168 2.008 4.024 . 0 0 "[ . 1 . 2]" 1
345 1 20 PRO HB2 1 21 GLU H . . 3.570 3.266 2.983 3.606 0.036 2 0 "[ . 1 . 2]" 1
346 1 20 PRO HB3 1 21 GLU H . . 4.470 4.141 4.012 4.270 . 0 0 "[ . 1 . 2]" 1
347 1 20 PRO HD2 1 21 GLU H . . 4.760 2.889 2.524 3.056 . 0 0 "[ . 1 . 2]" 1
348 1 20 PRO HD3 1 21 GLU H . . 4.350 3.970 3.803 4.079 . 0 0 "[ . 1 . 2]" 1
349 1 20 PRO HG2 1 21 GLU H . . 3.920 2.305 2.063 2.436 . 0 0 "[ . 1 . 2]" 1
350 1 20 PRO HG3 1 21 GLU H . . 3.870 3.896 3.677 3.985 0.115 1 0 "[ . 1 . 2]" 1
351 1 21 GLU H 1 21 GLU QB . . 2.970 2.337 1.995 2.710 . 0 0 "[ . 1 . 2]" 1
352 1 21 GLU H 1 21 GLU QG . . 3.640 2.542 1.869 3.748 0.108 2 0 "[ . 1 . 2]" 1
353 1 21 GLU H 1 22 TRP H . . 3.320 2.803 2.570 3.030 . 0 0 "[ . 1 . 2]" 1
354 1 21 GLU HA 1 21 GLU QG . . 3.560 2.490 2.101 3.464 . 0 0 "[ . 1 . 2]" 1
355 1 21 GLU HA 1 24 LYS QD . . 4.430 2.927 2.195 3.546 . 0 0 "[ . 1 . 2]" 1
356 1 21 GLU QB 1 22 TRP H . . 3.390 2.672 2.222 3.478 0.088 11 0 "[ . 1 . 2]" 1
357 1 21 GLU QG 1 22 TRP H . . 5.130 3.939 2.039 4.574 . 0 0 "[ . 1 . 2]" 1
358 1 21 GLU QG 1 24 LYS QD . . 5.500 4.040 3.120 5.253 . 0 0 "[ . 1 . 2]" 1
359 1 22 TRP H 1 22 TRP HB2 . . 3.300 2.653 2.539 2.850 . 0 0 "[ . 1 . 2]" 1
360 1 22 TRP H 1 22 TRP HB3 . . 3.190 2.329 2.210 2.418 . 0 0 "[ . 1 . 2]" 1
361 1 22 TRP HA 1 22 TRP HD1 . . 3.330 3.131 2.893 3.398 0.068 20 0 "[ . 1 . 2]" 1
362 1 22 TRP HA 1 25 GLN HB2 . . 3.800 3.231 2.468 4.797 0.997 13 4 "[- . 1 *+ . *]" 1
363 1 22 TRP HA 1 25 GLN HE21 . . 5.500 3.404 1.889 5.093 . 0 0 "[ . 1 . 2]" 1
364 1 22 TRP HA 1 26 ASN HD21 . . 4.350 3.666 3.158 4.413 0.063 12 0 "[ . 1 . 2]" 1
365 1 22 TRP HA 1 26 ASN HD22 . . 4.740 3.903 3.470 4.253 . 0 0 "[ . 1 . 2]" 1
366 1 22 TRP HB2 1 22 TRP HD1 . . 3.090 2.751 2.676 2.850 . 0 0 "[ . 1 . 2]" 1
367 1 22 TRP HB2 1 22 TRP HE3 . . 4.200 4.110 3.993 4.199 . 0 0 "[ . 1 . 2]" 1
368 1 22 TRP HB2 1 23 LEU H . . 4.010 3.940 3.729 4.078 0.068 20 0 "[ . 1 . 2]" 1
369 1 22 TRP HB3 1 22 TRP HE3 . . 3.120 2.563 2.451 2.659 . 0 0 "[ . 1 . 2]" 1
370 1 22 TRP HB3 1 23 LEU H . . 3.990 2.555 2.267 2.777 . 0 0 "[ . 1 . 2]" 1
371 1 22 TRP HD1 1 25 GLN HE21 . . 4.720 4.486 2.989 5.532 0.812 1 1 "[+ . 1 . 2]" 1
372 1 22 TRP HD1 1 26 ASN HD21 . . 3.600 3.618 3.277 3.684 0.084 12 0 "[ . 1 . 2]" 1
373 1 22 TRP HD1 1 26 ASN HD22 . . 3.400 2.806 2.367 3.325 . 0 0 "[ . 1 . 2]" 1
374 1 22 TRP HD1 1 62 THR MG . . 4.520 4.413 3.819 4.620 0.100 13 0 "[ . 1 . 2]" 1
375 1 22 TRP HE1 1 26 ASN HD21 . . 4.950 3.897 3.476 4.244 . 0 0 "[ . 1 . 2]" 1
376 1 22 TRP HE1 1 26 ASN HD22 . . 4.400 2.767 2.289 3.376 . 0 0 "[ . 1 . 2]" 1
377 1 22 TRP HE1 1 55 ALA H . . 5.450 4.198 3.633 4.840 . 0 0 "[ . 1 . 2]" 1
378 1 22 TRP HE1 1 55 ALA MB . . 4.170 3.125 2.520 3.746 . 0 0 "[ . 1 . 2]" 1
379 1 22 TRP HE1 1 62 THR H . . 4.740 4.362 3.251 4.815 0.075 19 0 "[ . 1 . 2]" 1
380 1 22 TRP HE1 1 62 THR HB . . 3.650 3.071 2.360 3.447 . 0 0 "[ . 1 . 2]" 1
381 1 22 TRP HE1 1 62 THR MG . . 4.680 4.174 3.492 4.732 0.052 5 0 "[ . 1 . 2]" 1
382 1 22 TRP HE3 1 23 LEU H . . 3.230 2.605 2.372 2.952 . 0 0 "[ . 1 . 2]" 1
383 1 22 TRP HE3 1 23 LEU HA . . 3.300 3.198 3.013 3.370 0.070 6 0 "[ . 1 . 2]" 1
384 1 22 TRP HE3 1 23 LEU HB2 . . 3.360 2.817 2.507 3.429 0.069 20 0 "[ . 1 . 2]" 1
385 1 22 TRP HE3 1 23 LEU HB3 . . 3.910 3.647 2.675 3.982 0.072 14 0 "[ . 1 . 2]" 1
386 1 22 TRP HE3 1 23 LEU QD . . 4.670 3.955 3.322 4.166 . 0 0 "[ . 1 . 2]" 1
387 1 22 TRP HE3 1 64 ILE MD . . 4.270 2.918 2.588 3.266 . 0 0 "[ . 1 . 2]" 1
388 1 22 TRP HH2 1 32 LEU QD . . 3.440 2.701 2.273 3.195 . 0 0 "[ . 1 . 2]" 1
389 1 22 TRP HH2 1 53 LEU HB2 . . 3.390 3.089 2.450 3.457 0.067 7 0 "[ . 1 . 2]" 1
390 1 22 TRP HH2 1 53 LEU HB3 . . 3.410 2.704 2.378 3.010 . 0 0 "[ . 1 . 2]" 1
391 1 22 TRP HH2 1 54 VAL H . . 3.820 3.682 3.397 3.887 0.067 13 0 "[ . 1 . 2]" 1
392 1 22 TRP HH2 1 54 VAL HA . . 3.210 2.672 2.327 3.007 . 0 0 "[ . 1 . 2]" 1
393 1 22 TRP HH2 1 55 ALA H . . 5.380 4.484 4.185 5.003 . 0 0 "[ . 1 . 2]" 1
394 1 22 TRP HH2 1 62 THR MG . . 5.500 4.867 4.145 5.572 0.072 1 0 "[ . 1 . 2]" 1
395 1 22 TRP HH2 1 63 ILE HA . . 4.020 3.864 3.538 4.095 0.075 19 0 "[ . 1 . 2]" 1
396 1 22 TRP HH2 1 64 ILE H . . 4.860 3.965 3.697 4.267 . 0 0 "[ . 1 . 2]" 1
397 1 22 TRP HH2 1 64 ILE MD . . 4.030 3.716 3.432 4.115 0.085 5 0 "[ . 1 . 2]" 1
398 1 22 TRP HZ2 1 32 LEU QD . . 3.840 3.516 2.645 3.836 . 0 0 "[ . 1 . 2]" 1
399 1 22 TRP HZ2 1 54 VAL HA . . 3.160 2.341 2.124 2.582 . 0 0 "[ . 1 . 2]" 1
400 1 22 TRP HZ2 1 54 VAL HB . . 4.740 4.727 4.419 4.812 0.072 2 0 "[ . 1 . 2]" 1
401 1 22 TRP HZ2 1 54 VAL QG . . 4.390 3.487 2.936 3.734 . 0 0 "[ . 1 . 2]" 1
402 1 22 TRP HZ2 1 55 ALA H . . 3.090 2.686 2.236 3.145 0.055 13 0 "[ . 1 . 2]" 1
403 1 22 TRP HZ2 1 55 ALA MB . . 3.310 3.164 2.851 3.397 0.087 11 0 "[ . 1 . 2]" 1
404 1 22 TRP HZ2 1 62 THR HB . . 3.850 3.467 2.710 3.915 0.065 17 0 "[ . 1 . 2]" 1
405 1 22 TRP HZ3 1 23 LEU HA . . 5.180 3.884 3.583 4.270 . 0 0 "[ . 1 . 2]" 1
406 1 22 TRP HZ3 1 23 LEU QD . . 4.340 3.537 2.601 4.203 . 0 0 "[ . 1 . 2]" 1
407 1 22 TRP HZ3 1 32 LEU QD . . 3.760 3.221 2.691 3.685 . 0 0 "[ . 1 . 2]" 1
408 1 22 TRP HZ3 1 53 LEU HB2 . . 4.020 3.458 2.839 4.003 . 0 0 "[ . 1 . 2]" 1
409 1 22 TRP HZ3 1 53 LEU QD . . 4.440 3.595 2.709 3.986 . 0 0 "[ . 1 . 2]" 1
410 1 22 TRP HZ3 1 64 ILE MD . . 3.680 2.272 2.062 2.620 . 0 0 "[ . 1 . 2]" 1
411 1 23 LEU H 1 23 LEU HB2 . . 3.480 2.718 2.229 3.469 . 0 0 "[ . 1 . 2]" 1
412 1 23 LEU H 1 23 LEU HB3 . . 3.530 2.368 2.050 2.549 . 0 0 "[ . 1 . 2]" 1
413 1 23 LEU H 1 23 LEU QD . . 4.790 3.709 3.549 3.846 . 0 0 "[ . 1 . 2]" 1
414 1 23 LEU HA 1 23 LEU QD . . 3.980 3.048 2.278 3.216 . 0 0 "[ . 1 . 2]" 1
415 1 23 LEU HA 1 23 LEU HG . . 4.160 3.027 2.348 4.006 . 0 0 "[ . 1 . 2]" 1
416 1 23 LEU HA 1 26 ASN H . . 5.040 3.729 3.460 4.056 . 0 0 "[ . 1 . 2]" 1
417 1 23 LEU HA 1 26 ASN HB2 . . 4.260 3.074 2.578 3.463 . 0 0 "[ . 1 . 2]" 1
418 1 23 LEU HA 1 26 ASN HB3 . . 4.940 4.649 4.230 5.008 0.068 13 0 "[ . 1 . 2]" 1
419 1 23 LEU HA 1 26 ASN HD21 . . 5.170 4.084 3.190 5.231 0.061 8 0 "[ . 1 . 2]" 1
420 1 23 LEU HA 1 27 ILE H . . 4.390 4.161 3.868 4.454 0.064 13 0 "[ . 1 . 2]" 1
421 1 23 LEU HA 1 32 LEU QD . . 3.910 2.651 2.050 3.550 . 0 0 "[ . 1 . 2]" 1
422 1 23 LEU HB3 1 23 LEU QD . . 3.240 2.197 2.115 2.464 . 0 0 "[ . 1 . 2]" 1
423 1 23 LEU HB3 1 24 LYS H . . 3.630 2.745 2.272 3.442 . 0 0 "[ . 1 . 2]" 1
424 1 23 LEU QD 1 24 LYS H . . 3.850 2.933 2.674 3.149 . 0 0 "[ . 1 . 2]" 1
425 1 23 LEU QD 1 24 LYS HA . . 3.350 2.631 2.402 2.862 . 0 0 "[ . 1 . 2]" 1
426 1 23 LEU QD 1 24 LYS HG2 . . 5.500 3.337 2.918 3.792 . 0 0 "[ . 1 . 2]" 1
427 1 23 LEU QD 1 24 LYS HG3 . . 5.030 2.678 2.086 3.187 . 0 0 "[ . 1 . 2]" 1
428 1 23 LEU QD 1 27 ILE MD . . 3.840 3.191 2.059 3.528 . 0 0 "[ . 1 . 2]" 1
429 1 23 LEU QD 1 27 ILE HG12 . . 5.290 2.825 2.423 4.273 . 0 0 "[ . 1 . 2]" 1
430 1 23 LEU QD 1 112 TYR HA . . 4.850 4.426 3.966 4.770 . 0 0 "[ . 1 . 2]" 1
431 1 23 LEU QD 1 112 TYR HB2 . . 3.980 3.611 3.263 3.949 . 0 0 "[ . 1 . 2]" 1
432 1 23 LEU QD 1 112 TYR HB3 . . 4.300 2.724 2.276 3.071 . 0 0 "[ . 1 . 2]" 1
433 1 23 LEU QD 1 112 TYR QD . . 3.610 3.010 2.533 3.248 . 0 0 "[ . 1 . 2]" 1
434 1 23 LEU QD 1 112 TYR QE . . 3.860 3.731 3.376 3.930 0.070 18 0 "[ . 1 . 2]" 1
435 1 24 LYS H 1 24 LYS HB2 . . 3.040 2.370 2.280 2.476 . 0 0 "[ . 1 . 2]" 1
436 1 24 LYS H 1 24 LYS QD . . 4.530 3.542 3.138 3.870 . 0 0 "[ . 1 . 2]" 1
437 1 24 LYS H 1 24 LYS QE . . 5.240 4.657 4.083 5.318 0.078 7 0 "[ . 1 . 2]" 1
438 1 24 LYS H 1 24 LYS HG2 . . 4.010 3.687 3.498 3.929 . 0 0 "[ . 1 . 2]" 1
439 1 24 LYS H 1 24 LYS HG3 . . 3.190 2.382 2.130 2.632 . 0 0 "[ . 1 . 2]" 1
440 1 24 LYS HA 1 24 LYS QD . . 4.790 4.106 3.996 4.230 . 0 0 "[ . 1 . 2]" 1
441 1 24 LYS HA 1 24 LYS HG2 . . 3.500 2.577 2.392 2.849 . 0 0 "[ . 1 . 2]" 1
442 1 24 LYS HA 1 24 LYS HG3 . . 3.570 2.797 2.618 3.118 . 0 0 "[ . 1 . 2]" 1
443 1 24 LYS HA 1 26 ASN H . . 5.190 4.504 4.216 4.732 . 0 0 "[ . 1 . 2]" 1
444 1 24 LYS HA 1 27 ILE H . . 3.620 3.504 3.250 3.677 0.057 6 0 "[ . 1 . 2]" 1
445 1 24 LYS HA 1 27 ILE HB . . 2.990 2.771 2.456 2.941 . 0 0 "[ . 1 . 2]" 1
446 1 24 LYS HA 1 27 ILE MD . . 5.500 4.879 3.346 5.284 . 0 0 "[ . 1 . 2]" 1
447 1 24 LYS HA 1 27 ILE HG12 . . 5.280 3.852 3.240 5.510 0.230 3 0 "[ . 1 . 2]" 1
448 1 24 LYS HA 1 27 ILE MG . . 4.120 4.112 3.748 4.218 0.098 8 0 "[ . 1 . 2]" 1
449 1 24 LYS HA 1 28 ALA H . . 4.680 3.998 3.619 4.291 . 0 0 "[ . 1 . 2]" 1
450 1 24 LYS HA 1 28 ALA MB . . 5.130 4.567 4.223 4.870 . 0 0 "[ . 1 . 2]" 1
451 1 24 LYS HA 1 112 TYR QE . . 5.300 4.021 2.827 4.937 . 0 0 "[ . 1 . 2]" 1
452 1 24 LYS HB2 1 25 GLN H . . 3.750 2.835 2.627 3.102 . 0 0 "[ . 1 . 2]" 1
453 1 24 LYS HB3 1 25 GLN H . . 3.810 3.654 3.320 3.864 0.054 4 0 "[ . 1 . 2]" 1
454 1 24 LYS QD 1 25 GLN H . . 5.500 4.888 4.578 5.294 . 0 0 "[ . 1 . 2]" 1
455 1 24 LYS QE 1 112 TYR QE . . 4.000 3.335 2.531 4.083 0.083 14 0 "[ . 1 . 2]" 1
456 1 24 LYS HG2 1 112 TYR QE . . 5.220 3.192 2.497 4.037 . 0 0 "[ . 1 . 2]" 1
457 1 24 LYS HG3 1 112 TYR QE . . 5.500 4.179 3.821 4.752 . 0 0 "[ . 1 . 2]" 1
458 1 25 GLN H 1 25 GLN HB2 . . 3.150 2.620 2.189 3.657 0.507 1 2 "[+ . 1 . -]" 1
459 1 25 GLN H 1 25 GLN HB3 . . 3.610 3.367 2.518 3.662 0.052 7 0 "[ . 1 . 2]" 1
460 1 25 GLN H 1 25 GLN HG2 . . 3.840 3.400 2.067 3.887 0.047 17 0 "[ . 1 . 2]" 1
461 1 25 GLN H 1 25 GLN HG3 . . 3.860 2.709 2.306 3.622 . 0 0 "[ . 1 . 2]" 1
462 1 25 GLN H 1 26 ASN H . . 3.110 2.639 2.464 2.827 . 0 0 "[ . 1 . 2]" 1
463 1 25 GLN H 1 26 ASN HD21 . . 5.500 4.530 3.995 5.493 . 0 0 "[ . 1 . 2]" 1
464 1 25 GLN H 1 26 ASN HD22 . . 5.500 5.531 5.282 5.589 0.089 17 0 "[ . 1 . 2]" 1
465 1 25 GLN H 1 28 ALA MB . . 4.830 4.743 4.454 4.923 0.093 10 0 "[ . 1 . 2]" 1
466 1 25 GLN HA 1 25 GLN HG2 . . 3.310 2.740 2.267 3.912 0.602 1 2 "[+ . 1 - . 2]" 1
467 1 25 GLN HA 1 25 GLN HG3 . . 3.860 3.131 2.720 3.742 . 0 0 "[ . 1 . 2]" 1
468 1 25 GLN HA 1 28 ALA H . . 3.840 3.528 3.216 3.891 0.051 19 0 "[ . 1 . 2]" 1
469 1 25 GLN HA 1 28 ALA MB . . 3.280 2.667 2.297 2.933 . 0 0 "[ . 1 . 2]" 1
470 1 25 GLN HA 1 29 ALA H . . 5.170 4.711 4.032 5.218 0.048 10 0 "[ . 1 . 2]" 1
471 1 25 GLN HB3 1 26 ASN H . . 3.690 3.569 3.180 4.011 0.321 1 0 "[ . 1 . 2]" 1
472 1 25 GLN HB3 1 26 ASN HA . . 5.450 4.517 3.996 5.760 0.310 12 0 "[ . 1 . 2]" 1
473 1 25 GLN HB3 1 26 ASN HD22 . . 5.430 5.175 3.911 5.871 0.441 20 0 "[ . 1 . 2]" 1
474 1 26 ASN H 1 26 ASN HB2 . . 3.190 2.503 2.291 2.840 . 0 0 "[ . 1 . 2]" 1
475 1 26 ASN H 1 26 ASN HB3 . . 3.710 3.612 3.558 3.670 . 0 0 "[ . 1 . 2]" 1
476 1 26 ASN H 1 26 ASN HD21 . . 4.100 2.632 2.122 3.324 . 0 0 "[ . 1 . 2]" 1
477 1 26 ASN H 1 26 ASN HD22 . . 5.050 3.736 3.472 3.952 . 0 0 "[ . 1 . 2]" 1
478 1 26 ASN H 1 27 ILE H . . 3.450 2.795 2.676 2.921 . 0 0 "[ . 1 . 2]" 1
479 1 26 ASN H 1 27 ILE HB . . 4.970 4.879 4.681 5.022 0.052 5 0 "[ . 1 . 2]" 1
480 1 26 ASN HA 1 29 ALA H . . 3.830 3.546 3.079 3.887 0.057 18 0 "[ . 1 . 2]" 1
481 1 26 ASN HA 1 32 LEU HB2 . . 4.610 4.342 4.101 4.689 0.079 13 0 "[ . 1 . 2]" 1
482 1 26 ASN HB2 1 27 ILE H . . 4.050 2.732 2.274 3.281 . 0 0 "[ . 1 . 2]" 1
483 1 26 ASN HB2 1 32 LEU HB2 . . 4.050 2.768 2.210 3.235 . 0 0 "[ . 1 . 2]" 1
484 1 26 ASN HB2 1 32 LEU QD . . 4.210 2.517 2.145 3.317 . 0 0 "[ . 1 . 2]" 1
485 1 26 ASN HB3 1 27 ILE H . . 4.390 3.636 3.368 3.960 . 0 0 "[ . 1 . 2]" 1
486 1 26 ASN HB3 1 32 LEU HB2 . . 3.780 2.323 2.107 2.787 . 0 0 "[ . 1 . 2]" 1
487 1 26 ASN HB3 1 32 LEU QD . . 4.300 2.982 2.449 3.379 . 0 0 "[ . 1 . 2]" 1
488 1 26 ASN HD21 1 55 ALA MB . . 4.480 3.786 2.764 4.511 0.031 7 0 "[ . 1 . 2]" 1
489 1 26 ASN HD22 1 32 LEU QD . . 5.260 4.595 4.208 5.185 . 0 0 "[ . 1 . 2]" 1
490 1 26 ASN HD22 1 55 ALA MB . . 4.300 3.206 2.703 3.693 . 0 0 "[ . 1 . 2]" 1
491 1 27 ILE H 1 27 ILE HB . . 2.980 2.420 2.279 2.575 . 0 0 "[ . 1 . 2]" 1
492 1 27 ILE H 1 27 ILE MD . . 4.550 3.536 3.343 3.702 . 0 0 "[ . 1 . 2]" 1
493 1 27 ILE H 1 27 ILE HG12 . . 3.840 2.389 2.224 3.572 . 0 0 "[ . 1 . 2]" 1
494 1 27 ILE H 1 27 ILE HG13 . . 3.570 3.566 2.285 3.648 0.078 20 0 "[ . 1 . 2]" 1
495 1 27 ILE H 1 27 ILE MG . . 4.320 3.771 3.719 3.831 . 0 0 "[ . 1 . 2]" 1
496 1 27 ILE H 1 28 ALA H . . 3.230 2.775 2.580 2.880 . 0 0 "[ . 1 . 2]" 1
497 1 27 ILE H 1 28 ALA MB . . 4.450 4.408 4.226 4.491 0.041 1 0 "[ . 1 . 2]" 1
498 1 27 ILE H 1 29 ALA H . . 5.500 4.165 3.888 4.574 . 0 0 "[ . 1 . 2]" 1
499 1 27 ILE H 1 32 LEU HB2 . . 4.590 3.615 3.259 4.173 . 0 0 "[ . 1 . 2]" 1
500 1 27 ILE H 1 32 LEU QD . . 4.830 3.352 2.637 4.299 . 0 0 "[ . 1 . 2]" 1
501 1 27 ILE HA 1 27 ILE MD . . 3.690 2.273 2.103 3.776 0.086 3 0 "[ . 1 . 2]" 1
502 1 27 ILE HA 1 27 ILE HG12 . . 3.550 2.994 2.430 3.122 . 0 0 "[ . 1 . 2]" 1
503 1 27 ILE HA 1 27 ILE HG13 . . 4.000 3.735 2.867 3.841 . 0 0 "[ . 1 . 2]" 1
504 1 27 ILE HA 1 27 ILE MG . . 3.120 2.470 2.305 2.648 . 0 0 "[ . 1 . 2]" 1
505 1 27 ILE HA 1 32 LEU H . . 4.210 3.770 3.381 4.276 0.066 12 0 "[ . 1 . 2]" 1
506 1 27 ILE HA 1 32 LEU HB2 . . 4.460 3.406 3.048 4.267 . 0 0 "[ . 1 . 2]" 1
507 1 27 ILE HB 1 28 ALA H . . 3.430 2.709 2.475 3.001 . 0 0 "[ . 1 . 2]" 1
508 1 27 ILE HB 1 28 ALA HA . . 4.880 4.477 4.277 4.713 . 0 0 "[ . 1 . 2]" 1
509 1 27 ILE HB 1 112 TYR HA . . 5.330 4.467 4.135 4.767 . 0 0 "[ . 1 . 2]" 1
510 1 27 ILE MD 1 27 ILE MG . . 3.290 2.103 2.045 2.155 . 0 0 "[ . 1 . 2]" 1
511 1 27 ILE MD 1 32 LEU HB2 . . 3.630 2.951 2.621 3.698 0.068 3 0 "[ . 1 . 2]" 1
512 1 27 ILE MD 1 112 TYR HA . . 3.510 2.607 2.036 3.016 . 0 0 "[ . 1 . 2]" 1
513 1 27 ILE MD 1 112 TYR HB2 . . 4.400 4.181 3.370 4.484 0.084 19 0 "[ . 1 . 2]" 1
514 1 27 ILE MD 1 112 TYR HB3 . . 3.400 2.904 2.066 3.264 . 0 0 "[ . 1 . 2]" 1
515 1 27 ILE MD 1 112 TYR QD . . 3.990 3.696 2.506 4.094 0.104 12 0 "[ . 1 . 2]" 1
516 1 27 ILE MD 1 113 VAL H . . 5.480 4.888 4.516 5.190 . 0 0 "[ . 1 . 2]" 1
517 1 27 ILE MD 1 115 GLY H . . 4.930 3.458 3.113 4.033 . 0 0 "[ . 1 . 2]" 1
518 1 27 ILE MD 1 115 GLY HA2 . . 4.930 4.181 3.898 4.949 0.019 3 0 "[ . 1 . 2]" 1
519 1 27 ILE MD 1 115 GLY HA3 . . 4.940 2.961 2.635 3.558 . 0 0 "[ . 1 . 2]" 1
520 1 27 ILE MD 1 116 LEU H . . 4.900 3.185 2.541 4.214 . 0 0 "[ . 1 . 2]" 1
521 1 27 ILE MD 1 116 LEU HG . . 5.150 3.954 3.591 5.017 . 0 0 "[ . 1 . 2]" 1
522 1 27 ILE HG12 1 28 ALA H . . 5.390 4.530 4.375 5.162 . 0 0 "[ . 1 . 2]" 1
523 1 27 ILE HG12 1 112 TYR HA . . 4.750 4.621 3.925 4.830 0.080 10 0 "[ . 1 . 2]" 1
524 1 27 ILE HG13 1 112 TYR HA . . 5.080 3.217 2.635 4.828 . 0 0 "[ . 1 . 2]" 1
525 1 27 ILE HG13 1 112 TYR HB3 . . 5.020 2.604 2.248 4.697 . 0 0 "[ . 1 . 2]" 1
526 1 27 ILE MG 1 28 ALA H . . 3.830 3.330 2.907 3.581 . 0 0 "[ . 1 . 2]" 1
527 1 27 ILE MG 1 28 ALA HA . . 4.240 3.385 3.016 3.739 . 0 0 "[ . 1 . 2]" 1
528 1 27 ILE MG 1 28 ALA MB . . 4.240 3.934 3.589 4.211 . 0 0 "[ . 1 . 2]" 1
529 1 27 ILE MG 1 29 ALA H . . 5.500 4.679 4.462 4.953 . 0 0 "[ . 1 . 2]" 1
530 1 27 ILE MG 1 112 TYR HA . . 3.350 2.169 1.976 2.391 . 0 0 "[ . 1 . 2]" 1
531 1 27 ILE MG 1 112 TYR HB3 . . 4.650 3.388 2.880 3.814 . 0 0 "[ . 1 . 2]" 1
532 1 27 ILE MG 1 112 TYR QD . . 3.570 2.089 1.991 2.257 . 0 0 "[ . 1 . 2]" 1
533 1 27 ILE MG 1 115 GLY H . . 5.410 3.848 3.432 4.259 . 0 0 "[ . 1 . 2]" 1
534 1 27 ILE MG 1 115 GLY HA2 . . 4.090 3.820 3.308 4.171 0.081 8 0 "[ . 1 . 2]" 1
535 1 27 ILE MG 1 115 GLY HA3 . . 3.460 2.442 2.075 2.886 . 0 0 "[ . 1 . 2]" 1
536 1 27 ILE MG 1 116 LEU H . . 5.500 4.437 3.797 5.230 . 0 0 "[ . 1 . 2]" 1
537 1 28 ALA H 1 28 ALA MB . . 2.810 2.205 2.141 2.248 . 0 0 "[ . 1 . 2]" 1
538 1 28 ALA H 1 29 ALA H . . 3.430 2.814 2.715 2.980 . 0 0 "[ . 1 . 2]" 1
539 1 28 ALA H 1 29 ALA MB . . 5.170 4.531 4.341 4.813 . 0 0 "[ . 1 . 2]" 1
540 1 28 ALA HA 1 30 ASN H . . 5.010 3.839 3.634 4.091 . 0 0 "[ . 1 . 2]" 1
541 1 28 ALA MB 1 29 ALA H . . 3.310 2.999 2.495 3.383 0.073 18 0 "[ . 1 . 2]" 1
542 1 28 ALA MB 1 29 ALA HA . . 4.270 4.241 3.913 4.373 0.103 18 0 "[ . 1 . 2]" 1
543 1 28 ALA MB 1 30 ASN H . . 4.490 4.475 4.311 4.591 0.101 19 0 "[ . 1 . 2]" 1
544 1 29 ALA H 1 29 ALA MB . . 2.900 2.385 2.173 2.694 . 0 0 "[ . 1 . 2]" 1
545 1 29 ALA H 1 30 ASN H . . 3.410 2.368 2.029 2.846 . 0 0 "[ . 1 . 2]" 1
546 1 29 ALA HA 1 30 ASN HB2 . . 5.020 4.606 4.034 5.437 0.417 19 0 "[ . 1 . 2]" 1
547 1 29 ALA HA 1 30 ASN HB3 . . 5.360 4.786 3.915 5.086 . 0 0 "[ . 1 . 2]" 1
548 1 29 ALA HA 1 31 GLN H . . 4.470 4.540 4.438 4.564 0.094 20 0 "[ . 1 . 2]" 1
549 1 29 ALA MB 1 31 GLN H . . 3.930 3.037 2.528 3.562 . 0 0 "[ . 1 . 2]" 1
550 1 29 ALA MB 1 31 GLN HE21 . . 5.020 4.111 2.956 5.103 0.083 19 0 "[ . 1 . 2]" 1
551 1 29 ALA MB 1 31 GLN HG2 . . 3.620 2.275 1.995 3.047 . 0 0 "[ . 1 . 2]" 1
552 1 29 ALA MB 1 31 GLN HG3 . . 3.510 2.601 2.137 3.630 0.120 14 0 "[ . 1 . 2]" 1
553 1 30 ASN H 1 30 ASN HB2 . . 3.670 2.966 2.739 3.689 0.019 19 0 "[ . 1 . 2]" 1
554 1 30 ASN H 1 30 ASN HB3 . . 3.980 3.669 3.105 3.893 . 0 0 "[ . 1 . 2]" 1
555 1 30 ASN H 1 31 GLN H . . 3.350 2.793 2.355 2.950 . 0 0 "[ . 1 . 2]" 1
556 1 30 ASN H 1 31 GLN QB . . 5.400 4.779 4.303 5.129 . 0 0 "[ . 1 . 2]" 1
557 1 30 ASN H 1 32 LEU H . . 4.850 4.576 4.126 4.928 0.078 3 0 "[ . 1 . 2]" 1
558 1 30 ASN HA 1 30 ASN HD22 . . 4.680 3.983 3.604 4.930 0.250 19 0 "[ . 1 . 2]" 1
559 1 30 ASN HB2 1 31 GLN H . . 4.530 4.569 4.489 4.698 0.168 19 0 "[ . 1 . 2]" 1
560 1 30 ASN HB3 1 31 GLN H . . 4.830 4.273 4.076 4.392 . 0 0 "[ . 1 . 2]" 1
561 1 30 ASN HD21 1 117 ARG HD2 . . 4.050 2.767 1.931 3.832 . 0 0 "[ . 1 . 2]" 1
562 1 30 ASN HD21 1 117 ARG HD3 . . 4.480 4.213 2.809 5.458 0.978 7 3 "[ . + 1- * 2]" 1
563 1 30 ASN HD21 1 117 ARG QG . . 4.980 3.009 2.115 4.062 . 0 0 "[ . 1 . 2]" 1
564 1 30 ASN HD22 1 117 ARG HD3 . . 5.500 4.624 3.889 5.569 0.069 14 0 "[ . 1 . 2]" 1
565 1 30 ASN HD22 1 117 ARG QG . . 5.500 2.668 2.137 4.233 . 0 0 "[ . 1 . 2]" 1
566 1 31 GLN H 1 31 GLN QB . . 3.560 2.415 2.151 2.784 . 0 0 "[ . 1 . 2]" 1
567 1 31 GLN H 1 31 GLN HG2 . . 4.430 2.768 2.103 3.373 . 0 0 "[ . 1 . 2]" 1
568 1 31 GLN H 1 31 GLN HG3 . . 4.390 3.778 2.711 4.161 . 0 0 "[ . 1 . 2]" 1
569 1 31 GLN H 1 32 LEU H . . 3.100 2.541 2.201 2.962 . 0 0 "[ . 1 . 2]" 1
570 1 31 GLN H 1 32 LEU HB3 . . 4.840 4.883 4.617 4.928 0.088 19 0 "[ . 1 . 2]" 1
571 1 31 GLN HA 1 31 GLN HE22 . . 5.500 3.541 3.020 5.589 0.089 14 0 "[ . 1 . 2]" 1
572 1 31 GLN HA 1 31 GLN HG2 . . 3.720 2.985 2.344 3.896 0.176 14 0 "[ . 1 . 2]" 1
573 1 31 GLN HA 1 31 GLN HG3 . . 4.250 3.778 3.609 3.918 . 0 0 "[ . 1 . 2]" 1
574 1 31 GLN HA 1 56 ALA H . . 4.460 3.880 3.383 4.536 0.076 3 0 "[ . 1 . 2]" 1
575 1 31 GLN HA 1 56 ALA MB . . 3.780 3.374 2.782 3.852 0.072 1 0 "[ . 1 . 2]" 1
576 1 31 GLN HA 1 117 ARG HD2 . . 4.800 3.877 2.785 4.869 0.069 8 0 "[ . 1 . 2]" 1
577 1 31 GLN QB 1 31 GLN HE22 . . 4.860 3.801 3.149 4.299 . 0 0 "[ . 1 . 2]" 1
578 1 31 GLN QB 1 32 LEU H . . 5.050 3.320 1.883 4.004 . 0 0 "[ . 1 . 2]" 1
579 1 31 GLN QB 1 55 ALA HA . . 5.070 3.772 3.222 4.138 . 0 0 "[ . 1 . 2]" 1
580 1 31 GLN QB 1 56 ALA H . . 4.210 3.083 2.201 3.514 . 0 0 "[ . 1 . 2]" 1
581 1 31 GLN QB 1 56 ALA MB . . 4.200 3.471 2.376 4.144 . 0 0 "[ . 1 . 2]" 1
582 1 31 GLN HE21 1 32 LEU H . . 5.050 5.088 4.830 5.135 0.085 6 0 "[ . 1 . 2]" 1
583 1 31 GLN HE21 1 56 ALA MB . . 5.380 3.852 2.079 5.448 0.068 1 0 "[ . 1 . 2]" 1
584 1 31 GLN HE22 1 56 ALA MB . . 5.460 3.662 2.214 5.378 . 0 0 "[ . 1 . 2]" 1
585 1 32 LEU H 1 32 LEU HB2 . . 3.610 2.515 2.067 2.930 . 0 0 "[ . 1 . 2]" 1
586 1 32 LEU H 1 32 LEU HB3 . . 3.490 2.771 2.424 3.473 . 0 0 "[ . 1 . 2]" 1
587 1 32 LEU H 1 32 LEU QD . . 5.190 3.830 3.687 4.078 . 0 0 "[ . 1 . 2]" 1
588 1 32 LEU H 1 33 VAL H . . 5.050 4.549 4.137 4.717 . 0 0 "[ . 1 . 2]" 1
589 1 32 LEU H 1 56 ALA MB . . 5.500 5.121 4.358 5.595 0.095 13 0 "[ . 1 . 2]" 1
590 1 32 LEU H 1 117 ARG HD2 . . 5.450 4.353 3.376 5.518 0.068 3 0 "[ . 1 . 2]" 1
591 1 32 LEU H 1 117 ARG HD3 . . 4.940 4.803 3.936 5.023 0.083 20 0 "[ . 1 . 2]" 1
592 1 32 LEU HA 1 32 LEU QD . . 3.030 2.188 2.037 2.453 . 0 0 "[ . 1 . 2]" 1
593 1 32 LEU HA 1 33 VAL H . . 2.960 2.253 2.180 2.350 . 0 0 "[ . 1 . 2]" 1
594 1 32 LEU HA 1 33 VAL QG . . 5.180 3.747 3.341 4.135 . 0 0 "[ . 1 . 2]" 1
595 1 32 LEU HA 1 54 VAL H . . 5.500 4.569 4.165 4.920 . 0 0 "[ . 1 . 2]" 1
596 1 32 LEU HA 1 55 ALA HA . . 3.380 2.312 2.049 2.732 . 0 0 "[ . 1 . 2]" 1
597 1 32 LEU HA 1 56 ALA H . . 5.000 3.662 3.263 4.263 . 0 0 "[ . 1 . 2]" 1
598 1 32 LEU HB2 1 33 VAL H . . 4.770 4.424 4.211 4.583 . 0 0 "[ . 1 . 2]" 1
599 1 32 LEU HB2 1 55 ALA HA . . 5.220 4.714 4.406 5.046 . 0 0 "[ . 1 . 2]" 1
600 1 32 LEU HB3 1 33 VAL H . . 5.060 4.011 3.679 4.421 . 0 0 "[ . 1 . 2]" 1
601 1 32 LEU QD 1 33 VAL H . . 3.560 2.392 1.904 3.114 . 0 0 "[ . 1 . 2]" 1
602 1 32 LEU QD 1 33 VAL HB . . 5.500 4.439 3.942 5.011 . 0 0 "[ . 1 . 2]" 1
603 1 32 LEU QD 1 53 LEU HA . . 5.130 3.424 2.978 3.973 . 0 0 "[ . 1 . 2]" 1
604 1 32 LEU QD 1 53 LEU HB2 . . 4.880 3.630 3.143 4.069 . 0 0 "[ . 1 . 2]" 1
605 1 32 LEU QD 1 53 LEU HB3 . . 4.280 2.296 2.036 2.678 . 0 0 "[ . 1 . 2]" 1
606 1 32 LEU QD 1 53 LEU QD . . 3.400 2.385 1.895 3.233 . 0 0 "[ . 1 . 2]" 1
607 1 32 LEU QD 1 54 VAL H . . 3.930 2.823 2.442 3.391 . 0 0 "[ . 1 . 2]" 1
608 1 32 LEU QD 1 54 VAL HA . . 4.510 3.648 3.328 4.212 . 0 0 "[ . 1 . 2]" 1
609 1 32 LEU QD 1 55 ALA H . . 5.340 4.092 3.451 4.411 . 0 0 "[ . 1 . 2]" 1
610 1 32 LEU QD 1 55 ALA HA . . 3.750 3.136 2.476 3.524 . 0 0 "[ . 1 . 2]" 1
611 1 32 LEU QD 1 55 ALA MB . . 4.300 3.514 2.226 4.003 . 0 0 "[ . 1 . 2]" 1
612 1 32 LEU HG 1 33 VAL H . . 4.280 3.445 2.267 4.338 0.058 19 0 "[ . 1 . 2]" 1
613 1 32 LEU HG 1 53 LEU HB3 . . 5.400 4.371 3.490 5.023 . 0 0 "[ . 1 . 2]" 1
614 1 32 LEU HG 1 54 VAL H . . 5.500 4.539 3.377 5.565 0.065 19 0 "[ . 1 . 2]" 1
615 1 33 VAL H 1 33 VAL HB . . 3.220 2.623 2.484 2.959 . 0 0 "[ . 1 . 2]" 1
616 1 33 VAL H 1 33 VAL QG . . 3.450 2.710 2.324 2.880 . 0 0 "[ . 1 . 2]" 1
617 1 33 VAL H 1 53 LEU HA . . 5.500 4.567 4.162 4.832 . 0 0 "[ . 1 . 2]" 1
618 1 33 VAL H 1 54 VAL H . . 3.830 3.026 2.530 3.386 . 0 0 "[ . 1 . 2]" 1
619 1 33 VAL H 1 54 VAL QG . . 4.460 3.679 3.281 3.993 . 0 0 "[ . 1 . 2]" 1
620 1 33 VAL H 1 55 ALA HA . . 4.170 2.963 2.362 3.722 . 0 0 "[ . 1 . 2]" 1
621 1 33 VAL H 1 56 ALA H . . 4.420 4.129 3.643 4.482 0.062 5 0 "[ . 1 . 2]" 1
622 1 33 VAL HA 1 33 VAL QG . . 3.210 2.162 2.091 2.244 . 0 0 "[ . 1 . 2]" 1
623 1 33 VAL HA 1 34 TYR H . . 2.880 2.246 2.049 2.440 . 0 0 "[ . 1 . 2]" 1
624 1 33 VAL HA 1 34 TYR HB3 . . 4.820 4.165 3.935 4.438 . 0 0 "[ . 1 . 2]" 1
625 1 33 VAL HA 1 116 LEU HB2 . . 4.980 3.956 2.986 4.906 . 0 0 "[ . 1 . 2]" 1
626 1 33 VAL HA 1 117 ARG H . . 3.710 2.784 2.359 3.790 0.080 12 0 "[ . 1 . 2]" 1
627 1 33 VAL HA 1 117 ARG HB2 . . 3.430 2.539 1.982 3.265 . 0 0 "[ . 1 . 2]" 1
628 1 33 VAL HA 1 117 ARG HB3 . . 3.890 3.738 3.180 3.974 0.084 5 0 "[ . 1 . 2]" 1
629 1 33 VAL HA 1 117 ARG QG . . 5.140 4.452 4.049 5.012 . 0 0 "[ . 1 . 2]" 1
630 1 33 VAL HA 1 118 THR HA . . 4.130 3.961 3.672 4.224 0.094 12 0 "[ . 1 . 2]" 1
631 1 33 VAL HB 1 34 TYR H . . 4.540 3.944 3.635 4.388 . 0 0 "[ . 1 . 2]" 1
632 1 33 VAL HB 1 52 TYR QE . . 5.170 4.824 4.209 5.273 0.103 14 0 "[ . 1 . 2]" 1
633 1 33 VAL HB 1 54 VAL H . . 4.260 3.848 3.269 4.357 0.097 10 0 "[ . 1 . 2]" 1
634 1 33 VAL HB 1 54 VAL QG . . 5.160 2.938 2.140 3.720 . 0 0 "[ . 1 . 2]" 1
635 1 33 VAL QG 1 34 TYR H . . 3.290 2.301 1.881 2.923 . 0 0 "[ . 1 . 2]" 1
636 1 33 VAL QG 1 34 TYR HA . . 4.720 3.728 3.480 3.966 . 0 0 "[ . 1 . 2]" 1
637 1 33 VAL QG 1 34 TYR HB3 . . 5.390 4.053 3.743 4.360 . 0 0 "[ . 1 . 2]" 1
638 1 33 VAL QG 1 35 GLY HA2 . . 5.070 4.326 3.643 4.852 . 0 0 "[ . 1 . 2]" 1
639 1 33 VAL QG 1 35 GLY HA3 . . 5.200 3.818 3.143 4.413 . 0 0 "[ . 1 . 2]" 1
640 1 33 VAL QG 1 52 TYR QD . . 5.180 4.752 3.376 5.104 . 0 0 "[ . 1 . 2]" 1
641 1 33 VAL QG 1 52 TYR QE . . 4.100 3.729 2.361 4.137 0.037 6 0 "[ . 1 . 2]" 1
642 1 33 VAL QG 1 54 VAL H . . 5.240 3.929 2.452 4.366 . 0 0 "[ . 1 . 2]" 1
643 1 33 VAL QG 1 55 ALA HA . . 5.070 3.695 2.840 4.359 . 0 0 "[ . 1 . 2]" 1
644 1 33 VAL QG 1 56 ALA H . . 3.840 3.218 2.552 3.902 0.062 13 0 "[ . 1 . 2]" 1
645 1 33 VAL QG 1 56 ALA HA . . 3.690 3.198 2.685 3.715 0.025 13 0 "[ . 1 . 2]" 1
646 1 33 VAL QG 1 56 ALA MB . . 3.250 2.509 2.063 3.324 0.074 13 0 "[ . 1 . 2]" 1
647 1 33 VAL QG 1 117 ARG HB2 . . 3.800 2.375 2.110 2.777 . 0 0 "[ . 1 . 2]" 1
648 1 33 VAL QG 1 117 ARG HB3 . . 4.030 2.830 1.961 3.307 . 0 0 "[ . 1 . 2]" 1
649 1 33 VAL QG 1 117 ARG HD2 . . 4.950 4.149 3.437 4.903 . 0 0 "[ . 1 . 2]" 1
650 1 33 VAL QG 1 117 ARG HD3 . . 4.250 3.029 2.490 3.566 . 0 0 "[ . 1 . 2]" 1
651 1 33 VAL QG 1 118 THR H . . 5.050 3.653 2.546 4.176 . 0 0 "[ . 1 . 2]" 1
652 1 33 VAL QG 1 118 THR HA . . 3.710 2.843 2.451 3.129 . 0 0 "[ . 1 . 2]" 1
653 1 33 VAL QG 1 118 THR HB . . 5.490 4.838 4.414 5.315 . 0 0 "[ . 1 . 2]" 1
654 1 33 VAL QG 1 118 THR MG . . 4.190 4.084 3.822 4.216 0.026 6 0 "[ . 1 . 2]" 1
655 1 33 VAL QG 1 119 GLU H . . 4.120 2.751 2.088 3.198 . 0 0 "[ . 1 . 2]" 1
656 1 33 VAL QG 1 119 GLU HA . . 4.180 3.218 2.507 3.821 . 0 0 "[ . 1 . 2]" 1
657 1 33 VAL QG 1 119 GLU HB3 . . 4.870 4.241 2.203 5.130 0.260 5 0 "[ . 1 . 2]" 1
658 1 33 VAL QG 1 119 GLU HG2 . . 5.500 4.295 2.465 5.951 0.451 1 0 "[ . 1 . 2]" 1
659 1 34 TYR H 1 34 TYR HB2 . . 3.660 3.177 2.677 3.471 . 0 0 "[ . 1 . 2]" 1
660 1 34 TYR H 1 34 TYR HB3 . . 3.380 2.375 2.133 2.544 . 0 0 "[ . 1 . 2]" 1
661 1 34 TYR H 1 53 LEU QD . . 4.600 4.196 3.733 4.617 0.017 17 0 "[ . 1 . 2]" 1
662 1 34 TYR H 1 116 LEU MD1 . . 4.930 3.576 3.046 4.123 . 0 0 "[ . 1 . 2]" 1
663 1 34 TYR H 1 116 LEU MD2 . . 5.500 4.910 4.193 5.589 0.089 6 0 "[ . 1 . 2]" 1
664 1 34 TYR H 1 118 THR HA . . 4.100 2.558 2.298 2.916 . 0 0 "[ . 1 . 2]" 1
665 1 34 TYR H 1 118 THR MG . . 5.500 3.848 3.330 4.276 . 0 0 "[ . 1 . 2]" 1
666 1 34 TYR H 1 119 GLU H . . 4.650 4.506 3.997 4.728 0.078 17 0 "[ . 1 . 2]" 1
667 1 34 TYR HA 1 34 TYR QD . . 3.320 2.859 2.604 3.240 . 0 0 "[ . 1 . 2]" 1
668 1 34 TYR HA 1 35 GLY H . . 3.000 2.332 2.226 2.468 . 0 0 "[ . 1 . 2]" 1
669 1 34 TYR HA 1 35 GLY HA3 . . 4.980 4.451 4.340 4.596 . 0 0 "[ . 1 . 2]" 1
670 1 34 TYR HA 1 52 TYR H . . 5.240 4.537 4.164 4.957 . 0 0 "[ . 1 . 2]" 1
671 1 34 TYR HA 1 53 LEU HA . . 3.920 2.719 2.408 3.230 . 0 0 "[ . 1 . 2]" 1
672 1 34 TYR HA 1 53 LEU QD . . 3.360 2.349 2.158 2.615 . 0 0 "[ . 1 . 2]" 1
673 1 34 TYR HA 1 54 VAL H . . 4.600 4.122 3.752 4.560 . 0 0 "[ . 1 . 2]" 1
674 1 34 TYR HA 1 116 LEU MD1 . . 5.150 4.538 3.990 5.039 . 0 0 "[ . 1 . 2]" 1
675 1 34 TYR HA 1 116 LEU MD2 . . 5.040 4.724 4.337 5.116 0.076 6 0 "[ . 1 . 2]" 1
676 1 34 TYR HB2 1 53 LEU HA . . 4.980 4.439 4.023 5.040 0.060 13 0 "[ . 1 . 2]" 1
677 1 34 TYR HB2 1 53 LEU QD . . 3.700 2.480 2.068 2.922 . 0 0 "[ . 1 . 2]" 1
678 1 34 TYR HB2 1 116 LEU HB2 . . 5.100 3.584 2.826 4.175 . 0 0 "[ . 1 . 2]" 1
679 1 34 TYR HB2 1 116 LEU MD1 . . 4.020 2.644 2.130 3.222 . 0 0 "[ . 1 . 2]" 1
680 1 34 TYR HB2 1 116 LEU MD2 . . 3.770 2.746 2.259 3.188 . 0 0 "[ . 1 . 2]" 1
681 1 34 TYR HB2 1 118 THR HA . . 4.660 4.627 4.165 4.742 0.082 15 0 "[ . 1 . 2]" 1
682 1 34 TYR HB2 1 118 THR MG . . 5.020 4.412 3.574 5.084 0.064 9 0 "[ . 1 . 2]" 1
683 1 34 TYR HB3 1 53 LEU QD . . 4.170 3.829 3.436 4.213 0.043 17 0 "[ . 1 . 2]" 1
684 1 34 TYR HB3 1 116 LEU MD1 . . 5.080 2.319 2.017 2.726 . 0 0 "[ . 1 . 2]" 1
685 1 34 TYR HB3 1 116 LEU MD2 . . 4.070 3.625 2.881 4.107 0.037 11 0 "[ . 1 . 2]" 1
686 1 34 TYR HB3 1 117 ARG H . . 5.500 4.714 3.912 5.585 0.085 12 0 "[ . 1 . 2]" 1
687 1 34 TYR HB3 1 118 THR HA . . 4.230 2.988 2.548 3.145 . 0 0 "[ . 1 . 2]" 1
688 1 34 TYR HB3 1 118 THR MG . . 4.070 3.025 2.325 3.746 . 0 0 "[ . 1 . 2]" 1
689 1 34 TYR QD 1 35 GLY H . . 4.570 3.202 2.340 4.219 . 0 0 "[ . 1 . 2]" 1
690 1 34 TYR QD 1 35 GLY HA3 . . 5.210 4.938 4.562 5.276 0.066 9 0 "[ . 1 . 2]" 1
691 1 34 TYR QD 1 36 ILE MD . . 5.500 4.962 4.543 5.340 . 0 0 "[ . 1 . 2]" 1
692 1 34 TYR QD 1 53 LEU QD . . 3.070 2.466 2.081 3.096 0.026 19 0 "[ . 1 . 2]" 1
693 1 34 TYR QD 1 116 LEU MD1 . . 5.270 3.283 2.073 3.884 . 0 0 "[ . 1 . 2]" 1
694 1 34 TYR QD 1 116 LEU MD2 . . 5.360 3.811 2.838 4.180 . 0 0 "[ . 1 . 2]" 1
695 1 34 TYR QD 1 118 THR HA . . 3.980 3.391 2.820 3.870 . 0 0 "[ . 1 . 2]" 1
696 1 34 TYR QD 1 118 THR HB . . 4.190 4.252 4.071 4.303 0.113 5 0 "[ . 1 . 2]" 1
697 1 34 TYR QD 1 118 THR MG . . 2.970 2.074 1.886 2.406 . 0 0 "[ . 1 . 2]" 1
698 1 34 TYR QE 1 35 GLY HA2 . . 4.400 4.312 3.368 4.504 0.104 9 0 "[ . 1 . 2]" 1
699 1 34 TYR QE 1 36 ILE MD . . 3.600 3.572 2.988 3.712 0.112 9 0 "[ . 1 . 2]" 1
700 1 34 TYR QE 1 36 ILE HG12 . . 5.500 3.918 2.943 4.543 . 0 0 "[ . 1 . 2]" 1
701 1 34 TYR QE 1 36 ILE HG13 . . 5.350 4.939 3.927 5.439 0.089 19 0 "[ . 1 . 2]" 1
702 1 34 TYR QE 1 51 SER HB2 . . 4.010 3.168 2.095 4.088 0.078 3 0 "[ . 1 . 2]" 1
703 1 34 TYR QE 1 51 SER HB3 . . 3.030 2.509 1.947 3.509 0.479 20 0 "[ . 1 . 2]" 1
704 1 35 GLY H 1 51 SER HA . . 5.120 4.485 4.152 4.896 . 0 0 "[ . 1 . 2]" 1
705 1 35 GLY H 1 52 TYR H . . 3.560 2.820 2.596 3.076 . 0 0 "[ . 1 . 2]" 1
706 1 35 GLY H 1 52 TYR QD . . 5.110 4.018 3.547 4.355 . 0 0 "[ . 1 . 2]" 1
707 1 35 GLY H 1 52 TYR QE . . 5.500 4.377 3.950 4.773 . 0 0 "[ . 1 . 2]" 1
708 1 35 GLY H 1 53 LEU HA . . 4.500 3.995 3.712 4.441 . 0 0 "[ . 1 . 2]" 1
709 1 35 GLY H 1 53 LEU QD . . 5.500 3.829 3.304 4.199 . 0 0 "[ . 1 . 2]" 1
710 1 35 GLY HA2 1 36 ILE H . . 3.260 2.492 2.342 2.612 . 0 0 "[ . 1 . 2]" 1
711 1 35 GLY HA2 1 52 TYR QE . . 4.530 4.546 4.368 4.614 0.084 9 0 "[ . 1 . 2]" 1
712 1 35 GLY HA3 1 36 ILE H . . 3.260 2.620 2.433 2.751 . 0 0 "[ . 1 . 2]" 1
713 1 35 GLY HA3 1 36 ILE HB . . 5.200 5.063 4.683 5.271 0.071 20 0 "[ . 1 . 2]" 1
714 1 35 GLY HA3 1 36 ILE MD . . 5.500 5.309 4.815 5.590 0.090 3 0 "[ . 1 . 2]" 1
715 1 35 GLY HA3 1 52 TYR QE . . 5.120 3.205 2.995 3.427 . 0 0 "[ . 1 . 2]" 1
716 1 36 ILE H 1 36 ILE HB . . 3.350 2.475 2.323 2.585 . 0 0 "[ . 1 . 2]" 1
717 1 36 ILE H 1 36 ILE MD . . 4.510 3.975 3.656 4.245 . 0 0 "[ . 1 . 2]" 1
718 1 36 ILE H 1 36 ILE HG12 . . 4.240 2.939 2.756 3.160 . 0 0 "[ . 1 . 2]" 1
719 1 36 ILE H 1 36 ILE HG13 . . 4.010 4.057 3.939 4.085 0.075 16 0 "[ . 1 . 2]" 1
720 1 36 ILE H 1 36 ILE MG . . 4.220 3.783 3.658 3.862 . 0 0 "[ . 1 . 2]" 1
721 1 36 ILE H 1 37 VAL H . . 5.180 4.337 4.163 4.502 . 0 0 "[ . 1 . 2]" 1
722 1 36 ILE H 1 52 TYR QE . . 3.960 3.456 3.032 3.894 . 0 0 "[ . 1 . 2]" 1
723 1 36 ILE HA 1 36 ILE MD . . 3.820 2.263 2.159 2.399 . 0 0 "[ . 1 . 2]" 1
724 1 36 ILE HA 1 36 ILE HG12 . . 4.050 3.045 2.791 3.330 . 0 0 "[ . 1 . 2]" 1
725 1 36 ILE HA 1 36 ILE HG13 . . 3.830 3.818 3.736 3.887 0.057 17 0 "[ . 1 . 2]" 1
726 1 36 ILE HA 1 36 ILE MG . . 3.350 2.503 2.383 2.610 . 0 0 "[ . 1 . 2]" 1
727 1 36 ILE HA 1 37 VAL H . . 2.990 2.098 1.743 2.254 . 0 0 "[ . 1 . 2]" 1
728 1 36 ILE HA 1 37 VAL HA . . 4.370 4.303 4.060 4.407 0.037 10 0 "[ . 1 . 2]" 1
729 1 36 ILE HA 1 37 VAL HB . . 4.850 4.492 4.238 4.963 0.113 17 0 "[ . 1 . 2]" 1
730 1 36 ILE HA 1 37 VAL QG . . 4.160 3.465 2.603 3.859 . 0 0 "[ . 1 . 2]" 1
731 1 36 ILE HA 1 51 SER HA . . 2.930 2.356 2.063 2.708 . 0 0 "[ . 1 . 2]" 1
732 1 36 ILE HA 1 51 SER HB3 . . 5.140 4.386 3.834 5.117 . 0 0 "[ . 1 . 2]" 1
733 1 36 ILE HA 1 52 TYR HB3 . . 5.500 5.309 4.941 5.579 0.079 8 0 "[ . 1 . 2]" 1
734 1 36 ILE HA 1 52 TYR QD . . 3.800 3.352 3.104 3.853 0.053 10 0 "[ . 1 . 2]" 1
735 1 36 ILE HA 1 52 TYR QE . . 4.920 3.941 3.515 4.360 . 0 0 "[ . 1 . 2]" 1
736 1 36 ILE HB 1 36 ILE MD . . 3.590 3.272 3.239 3.299 . 0 0 "[ . 1 . 2]" 1
737 1 36 ILE HB 1 51 SER HA . . 5.450 5.150 4.791 5.485 0.035 15 0 "[ . 1 . 2]" 1
738 1 36 ILE MD 1 37 VAL H . . 5.070 3.613 3.197 3.882 . 0 0 "[ . 1 . 2]" 1
739 1 36 ILE MD 1 38 LYS QE . . 5.500 5.029 4.557 5.584 0.084 5 0 "[ . 1 . 2]" 1
740 1 36 ILE MD 1 49 ASP HA . . 4.160 4.194 3.667 4.275 0.115 17 0 "[ . 1 . 2]" 1
741 1 36 ILE MD 1 51 SER HA . . 4.270 2.210 2.033 3.007 . 0 0 "[ . 1 . 2]" 1
742 1 36 ILE MD 1 51 SER HB3 . . 5.280 3.003 2.158 4.009 . 0 0 "[ . 1 . 2]" 1
743 1 36 ILE MD 1 52 TYR H . . 5.500 3.979 3.645 4.663 . 0 0 "[ . 1 . 2]" 1
744 1 36 ILE HG12 1 37 VAL H . . 5.120 4.941 4.527 5.120 . 0 0 "[ . 1 . 2]" 1
745 1 36 ILE HG12 1 51 SER HA . . 4.670 4.112 3.469 4.538 . 0 0 "[ . 1 . 2]" 1
746 1 36 ILE MG 1 37 VAL H . . 3.380 2.478 2.284 2.701 . 0 0 "[ . 1 . 2]" 1
747 1 36 ILE MG 1 37 VAL HB . . 4.660 3.505 3.090 4.478 . 0 0 "[ . 1 . 2]" 1
748 1 36 ILE MG 1 38 LYS QE . . 5.500 3.070 2.487 3.801 . 0 0 "[ . 1 . 2]" 1
749 1 36 ILE MG 1 49 ASP HA . . 3.810 2.751 2.313 3.487 . 0 0 "[ . 1 . 2]" 1
750 1 36 ILE MG 1 51 SER H . . 5.150 4.864 4.423 5.227 0.077 2 0 "[ . 1 . 2]" 1
751 1 36 ILE MG 1 51 SER HA . . 4.070 3.845 3.540 4.160 0.090 17 0 "[ . 1 . 2]" 1
752 1 37 VAL H 1 37 VAL HB . . 3.410 2.446 2.195 3.251 . 0 0 "[ . 1 . 2]" 1
753 1 37 VAL H 1 37 VAL QG . . 3.010 2.096 1.652 2.414 . 0 0 "[ . 1 . 2]" 1
754 1 37 VAL H 1 43 VAL MG1 . . 4.970 4.887 4.111 5.075 0.105 12 0 "[ . 1 . 2]" 1
755 1 37 VAL H 1 51 SER HA . . 3.620 3.547 3.239 3.688 0.068 13 0 "[ . 1 . 2]" 1
756 1 37 VAL H 1 52 TYR H . . 5.040 4.601 4.299 4.916 . 0 0 "[ . 1 . 2]" 1
757 1 37 VAL H 1 52 TYR QD . . 5.090 3.128 2.816 3.472 . 0 0 "[ . 1 . 2]" 1
758 1 37 VAL HA 1 52 TYR QD . . 3.800 3.234 2.846 3.872 0.072 17 0 "[ . 1 . 2]" 1
759 1 37 VAL HA 1 52 TYR QE . . 3.100 2.914 2.189 3.174 0.074 14 0 "[ . 1 . 2]" 1
760 1 37 VAL HB 1 38 LYS H . . 3.090 2.528 2.257 3.103 0.013 18 0 "[ . 1 . 2]" 1
761 1 37 VAL HB 1 48 ASP HA . . 4.850 3.941 3.530 4.447 . 0 0 "[ . 1 . 2]" 1
762 1 37 VAL HB 1 49 ASP H . . 3.980 3.874 3.542 4.075 0.095 16 0 "[ . 1 . 2]" 1
763 1 37 VAL HB 1 49 ASP HA . . 4.580 3.328 2.342 4.415 . 0 0 "[ . 1 . 2]" 1
764 1 37 VAL HB 1 50 TYR H . . 3.710 3.016 2.329 3.798 0.088 17 0 "[ . 1 . 2]" 1
765 1 37 VAL HB 1 50 TYR HB2 . . 4.900 4.224 3.561 4.988 0.088 13 0 "[ . 1 . 2]" 1
766 1 37 VAL QG 1 38 LYS H . . 3.210 2.384 1.650 2.827 . 0 0 "[ . 1 . 2]" 1
767 1 37 VAL QG 1 38 LYS HA . . 5.320 3.524 3.239 3.914 . 0 0 "[ . 1 . 2]" 1
768 1 37 VAL QG 1 43 VAL HB . . 5.500 2.876 2.312 3.425 . 0 0 "[ . 1 . 2]" 1
769 1 37 VAL QG 1 43 VAL MG1 . . 3.780 1.918 1.773 2.120 . 0 0 "[ . 1 . 2]" 1
770 1 37 VAL QG 1 43 VAL MG2 . . 3.620 2.111 1.912 3.049 . 0 0 "[ . 1 . 2]" 1
771 1 37 VAL QG 1 47 VAL H . . 5.500 4.228 3.778 4.813 . 0 0 "[ . 1 . 2]" 1
772 1 37 VAL QG 1 47 VAL QG . . 3.870 2.232 1.871 2.885 . 0 0 "[ . 1 . 2]" 1
773 1 37 VAL QG 1 48 ASP HA . . 3.460 2.714 2.166 3.447 . 0 0 "[ . 1 . 2]" 1
774 1 37 VAL QG 1 49 ASP H . . 4.110 3.393 2.343 3.802 . 0 0 "[ . 1 . 2]" 1
775 1 37 VAL QG 1 49 ASP HA . . 4.580 3.384 2.012 4.147 . 0 0 "[ . 1 . 2]" 1
776 1 37 VAL QG 1 50 TYR H . . 4.020 2.618 1.638 3.192 . 0 0 "[ . 1 . 2]" 1
777 1 37 VAL QG 1 50 TYR HB2 . . 4.400 2.653 2.242 3.470 . 0 0 "[ . 1 . 2]" 1
778 1 37 VAL QG 1 51 SER HA . . 4.790 3.824 2.916 4.255 . 0 0 "[ . 1 . 2]" 1
779 1 37 VAL QG 1 52 TYR HB3 . . 5.080 3.145 2.840 3.373 . 0 0 "[ . 1 . 2]" 1
780 1 37 VAL QG 1 52 TYR QD . . 2.700 2.416 2.018 2.742 0.042 6 0 "[ . 1 . 2]" 1
781 1 37 VAL QG 1 52 TYR QE . . 4.070 3.605 3.060 3.980 . 0 0 "[ . 1 . 2]" 1
782 1 37 VAL QG 1 65 PHE QD . . 2.970 2.434 2.107 2.716 . 0 0 "[ . 1 . 2]" 1
783 1 37 VAL QG 1 65 PHE QE . . 3.020 2.101 2.012 2.260 . 0 0 "[ . 1 . 2]" 1
784 1 38 LYS H 1 38 LYS HB2 . . 3.450 3.479 3.239 3.543 0.093 3 0 "[ . 1 . 2]" 1
785 1 38 LYS H 1 38 LYS HB3 . . 4.170 4.069 3.965 4.129 . 0 0 "[ . 1 . 2]" 1
786 1 38 LYS H 1 38 LYS HD3 . . 5.050 4.680 2.445 5.130 0.080 1 0 "[ . 1 . 2]" 1
787 1 38 LYS H 1 38 LYS QE . . 4.890 4.683 3.553 4.969 0.079 8 0 "[ . 1 . 2]" 1
788 1 38 LYS H 1 38 LYS HG2 . . 4.080 2.915 2.664 4.160 0.080 20 0 "[ . 1 . 2]" 1
789 1 38 LYS H 1 38 LYS HG3 . . 4.070 3.721 3.121 4.149 0.079 17 0 "[ . 1 . 2]" 1
790 1 38 LYS H 1 39 PRO HD2 . . 5.270 4.775 4.580 5.111 . 0 0 "[ . 1 . 2]" 1
791 1 38 LYS H 1 39 PRO HD3 . . 5.070 4.508 4.089 4.799 . 0 0 "[ . 1 . 2]" 1
792 1 38 LYS H 1 43 VAL MG2 . . 5.160 4.977 3.992 5.266 0.106 2 0 "[ . 1 . 2]" 1
793 1 38 LYS HA 1 38 LYS HD2 . . 4.630 4.036 2.233 4.457 . 0 0 "[ . 1 . 2]" 1
794 1 38 LYS HA 1 38 LYS HD3 . . 4.500 3.284 2.349 4.454 . 0 0 "[ . 1 . 2]" 1
795 1 38 LYS HA 1 38 LYS HG2 . . 4.040 2.446 2.145 3.626 . 0 0 "[ . 1 . 2]" 1
796 1 38 LYS HA 1 38 LYS HG3 . . 4.080 3.488 2.685 3.719 . 0 0 "[ . 1 . 2]" 1
797 1 38 LYS HA 1 39 PRO HD2 . . 3.240 2.641 2.428 3.037 . 0 0 "[ . 1 . 2]" 1
798 1 38 LYS HA 1 39 PRO HD3 . . 2.930 2.463 2.159 2.689 . 0 0 "[ . 1 . 2]" 1
799 1 38 LYS HA 1 39 PRO QG . . 4.730 4.190 4.005 4.336 . 0 0 "[ . 1 . 2]" 1
800 1 38 LYS HB2 1 39 PRO HD2 . . 4.080 3.697 3.557 3.835 . 0 0 "[ . 1 . 2]" 1
801 1 38 LYS HB2 1 40 SER H . . 4.540 3.399 2.716 4.292 . 0 0 "[ . 1 . 2]" 1
802 1 38 LYS HB3 1 39 PRO HD2 . . 3.330 2.121 1.998 2.316 . 0 0 "[ . 1 . 2]" 1
803 1 38 LYS HB3 1 39 PRO HD3 . . 3.700 3.471 3.112 3.752 0.052 16 0 "[ . 1 . 2]" 1
804 1 38 LYS HB3 1 40 SER H . . 4.040 2.908 2.157 4.117 0.077 17 0 "[ . 1 . 2]" 1
805 1 38 LYS HB3 1 40 SER HB3 . . 5.150 4.762 3.629 6.116 0.966 18 2 "[ . - 1 . + 2]" 1
806 1 38 LYS HD2 1 39 PRO HD3 . . 5.500 5.013 3.910 5.573 0.073 8 0 "[ . 1 . 2]" 1
807 1 38 LYS HD3 1 39 PRO HD2 . . 4.050 3.086 2.116 4.994 0.944 20 2 "[ - 1 . +]" 1
808 1 38 LYS HD3 1 39 PRO HD3 . . 4.880 4.076 2.922 5.574 0.694 5 2 "[ + 1 . -]" 1
809 1 38 LYS HG2 1 39 PRO HD2 . . 5.240 3.889 3.098 4.554 . 0 0 "[ . 1 . 2]" 1
810 1 38 LYS HG2 1 39 PRO HD3 . . 4.740 4.425 3.936 5.120 0.380 20 0 "[ . 1 . 2]" 1
811 1 38 LYS HG3 1 39 PRO HD2 . . 5.370 4.463 2.650 5.009 . 0 0 "[ . 1 . 2]" 1
812 1 39 PRO HB3 1 40 SER H . . 4.260 4.464 4.225 4.639 0.379 2 0 "[ . 1 . 2]" 1
813 1 39 PRO HD2 1 40 SER H . . 4.750 3.268 2.521 4.738 . 0 0 "[ . 1 . 2]" 1
814 1 39 PRO HD3 1 40 SER H . . 5.200 4.189 3.753 5.032 . 0 0 "[ . 1 . 2]" 1
815 1 39 PRO HG3 1 40 SER H . . 5.320 4.709 4.003 5.784 0.464 1 0 "[ . 1 . 2]" 1
816 1 40 SER H 1 40 SER HB2 . . 4.190 2.803 2.303 3.494 . 0 0 "[ . 1 . 2]" 1
817 1 40 SER H 1 40 SER HB3 . . 3.560 3.359 2.350 4.011 0.451 18 0 "[ . 1 . 2]" 1
818 1 40 SER H 1 41 ASP H . . 3.610 2.867 1.976 3.666 0.056 3 0 "[ . 1 . 2]" 1
819 1 40 SER H 1 41 ASP HB2 . . 5.500 4.608 4.083 5.159 . 0 0 "[ . 1 . 2]" 1
820 1 40 SER HA 1 40 SER HB3 . . 3.020 2.525 2.219 3.041 0.021 3 0 "[ . 1 . 2]" 1
821 1 40 SER HA 1 41 ASP HA . . 4.570 4.518 4.066 4.645 0.075 16 0 "[ . 1 . 2]" 1
822 1 40 SER HB2 1 41 ASP H . . 4.620 3.606 2.588 4.619 . 0 0 "[ . 1 . 2]" 1
823 1 41 ASP H 1 41 ASP HB2 . . 3.330 2.676 2.137 3.334 0.004 6 0 "[ . 1 . 2]" 1
824 1 41 ASP H 1 41 ASP HB3 . . 3.940 3.275 2.593 3.677 . 0 0 "[ . 1 . 2]" 1
825 1 41 ASP H 1 43 VAL MG1 . . 5.500 4.421 3.439 5.017 . 0 0 "[ . 1 . 2]" 1
826 1 41 ASP HA 1 42 THR H . . 2.890 2.605 2.375 2.917 0.027 3 0 "[ . 1 . 2]" 1
827 1 41 ASP HB2 1 42 THR H . . 4.270 3.839 3.505 4.124 . 0 0 "[ . 1 . 2]" 1
828 1 41 ASP HB2 1 43 VAL MG1 . . 3.860 3.866 3.286 3.965 0.105 14 0 "[ . 1 . 2]" 1
829 1 41 ASP HB3 1 42 THR H . . 3.680 2.674 1.971 3.426 . 0 0 "[ . 1 . 2]" 1
830 1 41 ASP HB3 1 43 VAL MG1 . . 3.500 2.899 2.256 3.612 0.112 12 0 "[ . 1 . 2]" 1
831 1 41 ASP HB3 1 43 VAL MG2 . . 5.110 3.954 2.340 5.160 0.050 12 0 "[ . 1 . 2]" 1
832 1 42 THR H 1 42 THR HB . . 3.620 2.571 2.392 2.870 . 0 0 "[ . 1 . 2]" 1
833 1 42 THR H 1 42 THR MG . . 4.290 3.280 1.863 3.852 . 0 0 "[ . 1 . 2]" 1
834 1 42 THR H 1 43 VAL MG1 . . 4.890 3.791 2.963 4.692 . 0 0 "[ . 1 . 2]" 1
835 1 42 THR HA 1 42 THR MG . . 3.140 2.607 2.230 3.240 0.100 18 0 "[ . 1 . 2]" 1
836 1 42 THR HA 1 43 VAL H . . 2.690 2.274 2.148 2.736 0.046 2 0 "[ . 1 . 2]" 1
837 1 42 THR HA 1 43 VAL MG1 . . 4.770 4.144 3.714 4.565 . 0 0 "[ . 1 . 2]" 1
838 1 42 THR HA 1 43 VAL MG2 . . 4.010 3.626 3.167 4.128 0.118 18 0 "[ . 1 . 2]" 1
839 1 42 THR HB 1 43 VAL H . . 4.880 4.378 4.033 4.582 . 0 0 "[ . 1 . 2]" 1
840 1 42 THR MG 1 43 VAL H . . 3.810 3.365 2.942 3.901 0.091 2 0 "[ . 1 . 2]" 1
841 1 42 THR MG 1 43 VAL HA . . 4.890 3.890 3.369 4.489 . 0 0 "[ . 1 . 2]" 1
842 1 42 THR MG 1 43 VAL MG2 . . 4.520 4.572 4.392 4.671 0.151 17 0 "[ . 1 . 2]" 1
843 1 43 VAL H 1 43 VAL HB . . 4.150 3.779 3.577 3.922 . 0 0 "[ . 1 . 2]" 1
844 1 43 VAL H 1 43 VAL MG1 . . 3.800 3.274 2.730 3.759 . 0 0 "[ . 1 . 2]" 1
845 1 43 VAL H 1 43 VAL MG2 . . 2.980 2.276 1.879 2.625 . 0 0 "[ . 1 . 2]" 1
846 1 43 VAL H 1 44 PRO HD2 . . 5.440 4.878 4.774 4.957 . 0 0 "[ . 1 . 2]" 1
847 1 43 VAL HA 1 43 VAL MG1 . . 3.020 2.229 2.115 2.320 . 0 0 "[ . 1 . 2]" 1
848 1 43 VAL HA 1 43 VAL MG2 . . 3.640 3.247 3.212 3.293 . 0 0 "[ . 1 . 2]" 1
849 1 43 VAL HA 1 44 PRO HD2 . . 3.290 2.496 2.343 2.755 . 0 0 "[ . 1 . 2]" 1
850 1 43 VAL HA 1 44 PRO HD3 . . 3.000 2.358 2.142 2.486 . 0 0 "[ . 1 . 2]" 1
851 1 43 VAL HA 1 44 PRO HG3 . . 4.630 4.571 4.339 4.673 0.043 17 0 "[ . 1 . 2]" 1
852 1 43 VAL HA 1 47 VAL QG . . 4.330 4.190 3.963 4.344 0.014 9 0 "[ . 1 . 2]" 1
853 1 43 VAL HB 1 44 PRO HD2 . . 3.080 2.133 2.017 2.299 . 0 0 "[ . 1 . 2]" 1
854 1 43 VAL HB 1 44 PRO HD3 . . 3.450 3.508 3.291 3.533 0.083 19 0 "[ . 1 . 2]" 1
855 1 43 VAL HB 1 47 VAL QG . . 3.280 2.468 2.090 2.681 . 0 0 "[ . 1 . 2]" 1
856 1 43 VAL MG1 1 44 PRO HD2 . . 3.950 2.911 2.511 3.242 . 0 0 "[ . 1 . 2]" 1
857 1 43 VAL MG1 1 44 PRO HD3 . . 4.090 3.635 3.248 3.953 . 0 0 "[ . 1 . 2]" 1
858 1 43 VAL MG1 1 47 VAL QG . . 3.830 3.190 2.706 3.677 . 0 0 "[ . 1 . 2]" 1
859 1 43 VAL MG1 1 65 PHE QE . . 3.220 2.603 2.166 3.045 . 0 0 "[ . 1 . 2]" 1
860 1 43 VAL MG1 1 65 PHE HZ . . 3.510 2.947 2.387 3.570 0.060 9 0 "[ . 1 . 2]" 1
861 1 43 VAL MG2 1 44 PRO HD2 . . 4.130 3.785 3.642 3.952 . 0 0 "[ . 1 . 2]" 1
862 1 43 VAL MG2 1 44 PRO HD3 . . 4.890 4.629 4.506 4.692 . 0 0 "[ . 1 . 2]" 1
863 1 43 VAL MG2 1 47 VAL QG . . 3.430 3.006 2.576 3.338 . 0 0 "[ . 1 . 2]" 1
864 1 43 VAL MG2 1 48 ASP HA . . 4.270 3.875 2.728 4.343 0.073 14 0 "[ . 1 . 2]" 1
865 1 43 VAL MG2 1 65 PHE QE . . 5.470 4.591 3.884 5.089 . 0 0 "[ . 1 . 2]" 1
866 1 44 PRO HA 1 45 ALA H . . 2.780 2.474 2.319 2.616 . 0 0 "[ . 1 . 2]" 1
867 1 44 PRO HA 1 45 ALA MB . . 4.130 4.133 4.013 4.203 0.073 18 0 "[ . 1 . 2]" 1
868 1 44 PRO HB2 1 45 ALA H . . 3.690 2.573 2.099 2.998 . 0 0 "[ . 1 . 2]" 1
869 1 44 PRO HB2 1 45 ALA MB . . 5.500 4.003 3.549 4.264 . 0 0 "[ . 1 . 2]" 1
870 1 44 PRO HB2 1 47 VAL QG . . 3.690 3.470 2.958 3.657 . 0 0 "[ . 1 . 2]" 1
871 1 44 PRO HB2 1 85 LEU QD . . 3.970 3.115 2.171 3.720 . 0 0 "[ . 1 . 2]" 1
872 1 44 PRO HB3 1 45 ALA H . . 3.640 3.455 3.234 3.673 0.033 17 0 "[ . 1 . 2]" 1
873 1 44 PRO HB3 1 47 VAL QG . . 5.130 4.342 4.048 4.531 . 0 0 "[ . 1 . 2]" 1
874 1 44 PRO HB3 1 85 LEU QD . . 4.330 3.548 2.847 4.119 . 0 0 "[ . 1 . 2]" 1
875 1 44 PRO HD2 1 47 VAL QG . . 3.780 2.503 2.131 2.816 . 0 0 "[ . 1 . 2]" 1
876 1 44 PRO HD2 1 65 PHE QE . . 4.120 3.537 2.814 3.989 . 0 0 "[ . 1 . 2]" 1
877 1 44 PRO HD2 1 65 PHE HZ . . 3.790 3.120 2.440 3.870 0.080 5 0 "[ . 1 . 2]" 1
878 1 44 PRO HD2 1 85 LEU QD . . 5.240 3.596 3.127 3.919 . 0 0 "[ . 1 . 2]" 1
879 1 44 PRO HD3 1 47 VAL QG . . 4.600 3.829 3.527 4.100 . 0 0 "[ . 1 . 2]" 1
880 1 44 PRO HD3 1 65 PHE QE . . 4.440 4.141 3.736 4.491 0.051 4 0 "[ . 1 . 2]" 1
881 1 44 PRO HD3 1 65 PHE HZ . . 4.050 3.494 2.771 4.119 0.069 10 0 "[ . 1 . 2]" 1
882 1 44 PRO HD3 1 85 LEU QD . . 4.680 3.809 3.562 4.164 . 0 0 "[ . 1 . 2]" 1
883 1 44 PRO HG2 1 45 ALA H . . 5.360 4.381 3.917 4.836 . 0 0 "[ . 1 . 2]" 1
884 1 44 PRO HG2 1 47 VAL QG . . 3.670 2.215 1.956 2.582 . 0 0 "[ . 1 . 2]" 1
885 1 44 PRO HG2 1 85 LEU QD . . 4.020 2.290 1.941 2.794 . 0 0 "[ . 1 . 2]" 1
886 1 44 PRO HG3 1 47 VAL QG . . 5.100 3.460 3.182 3.940 . 0 0 "[ . 1 . 2]" 1
887 1 44 PRO HG3 1 65 PHE QE . . 4.630 3.879 3.211 4.680 0.050 5 0 "[ . 1 . 2]" 1
888 1 44 PRO HG3 1 85 LEU QD . . 4.440 2.220 2.033 2.638 . 0 0 "[ . 1 . 2]" 1
889 1 45 ALA H 1 45 ALA MB . . 2.870 2.207 2.137 2.260 . 0 0 "[ . 1 . 2]" 1
890 1 45 ALA HA 1 46 GLY H . . 2.780 2.266 2.070 2.442 . 0 0 "[ . 1 . 2]" 1
891 1 45 ALA HA 1 46 GLY HA2 . . 4.680 4.466 4.294 4.601 . 0 0 "[ . 1 . 2]" 1
892 1 45 ALA HA 1 47 VAL H . . 3.990 3.856 3.507 4.071 0.081 15 0 "[ . 1 . 2]" 1
893 1 45 ALA HA 1 47 VAL QG . . 4.600 3.909 3.460 4.358 . 0 0 "[ . 1 . 2]" 1
894 1 45 ALA MB 1 46 GLY H . . 3.500 2.830 2.393 3.333 . 0 0 "[ . 1 . 2]" 1
895 1 45 ALA MB 1 46 GLY HA2 . . 4.780 4.167 3.899 4.419 . 0 0 "[ . 1 . 2]" 1
896 1 45 ALA MB 1 46 GLY HA3 . . 5.080 3.807 3.417 4.113 . 0 0 "[ . 1 . 2]" 1
897 1 45 ALA MB 1 47 VAL H . . 5.160 4.767 4.424 5.011 . 0 0 "[ . 1 . 2]" 1
898 1 45 ALA MB 1 47 VAL QG . . 5.500 4.373 4.069 4.781 . 0 0 "[ . 1 . 2]" 1
899 1 46 GLY H 1 47 VAL H . . 3.470 2.563 2.212 2.866 . 0 0 "[ . 1 . 2]" 1
900 1 46 GLY H 1 47 VAL QG . . 5.010 3.776 3.289 4.069 . 0 0 "[ . 1 . 2]" 1
901 1 46 GLY H 1 48 ASP H . . 4.750 4.363 3.793 4.827 0.077 7 0 "[ . 1 . 2]" 1
902 1 46 GLY HA2 1 47 VAL QG . . 5.500 4.060 3.780 4.224 . 0 0 "[ . 1 . 2]" 1
903 1 46 GLY HA3 1 47 VAL QG . . 5.300 3.635 3.295 3.988 . 0 0 "[ . 1 . 2]" 1
904 1 46 GLY HA3 1 48 ASP H . . 5.290 5.128 4.660 5.631 0.341 7 0 "[ . 1 . 2]" 1
905 1 47 VAL H 1 47 VAL QG . . 3.180 2.469 2.249 2.760 . 0 0 "[ . 1 . 2]" 1
906 1 47 VAL H 1 48 ASP H . . 3.080 2.509 2.035 3.151 0.071 2 0 "[ . 1 . 2]" 1
907 1 47 VAL HA 1 47 VAL QG . . 3.250 2.263 2.193 2.558 . 0 0 "[ . 1 . 2]" 1
908 1 47 VAL HA 1 48 ASP H . . 3.550 2.757 2.245 3.079 . 0 0 "[ . 1 . 2]" 1
909 1 47 VAL HA 1 49 ASP H . . 5.120 3.502 2.658 3.904 . 0 0 "[ . 1 . 2]" 1
910 1 47 VAL HA 1 50 TYR QD . . 3.840 2.871 2.463 3.203 . 0 0 "[ . 1 . 2]" 1
911 1 47 VAL HA 1 50 TYR QE . . 4.230 3.787 3.141 4.222 . 0 0 "[ . 1 . 2]" 1
912 1 47 VAL HB 1 49 ASP H . . 5.270 4.494 3.847 5.181 . 0 0 "[ . 1 . 2]" 1
913 1 47 VAL HB 1 50 TYR H . . 4.410 3.596 3.036 4.452 0.042 8 0 "[ . 1 . 2]" 1
914 1 47 VAL HB 1 50 TYR HA . . 5.020 5.086 4.990 5.125 0.105 8 0 "[ . 1 . 2]" 1
915 1 47 VAL HB 1 50 TYR HB2 . . 4.230 2.205 2.085 2.709 . 0 0 "[ . 1 . 2]" 1
916 1 47 VAL HB 1 50 TYR HB3 . . 4.230 3.547 3.211 3.926 . 0 0 "[ . 1 . 2]" 1
917 1 47 VAL HB 1 65 PHE QD . . 4.220 3.328 2.503 4.305 0.085 16 0 "[ . 1 . 2]" 1
918 1 47 VAL QG 1 48 ASP H . . 4.320 3.681 3.518 3.922 . 0 0 "[ . 1 . 2]" 1
919 1 47 VAL QG 1 48 ASP HA . . 4.960 3.882 3.459 4.460 . 0 0 "[ . 1 . 2]" 1
920 1 47 VAL QG 1 50 TYR HB2 . . 5.180 2.711 1.887 3.187 . 0 0 "[ . 1 . 2]" 1
921 1 47 VAL QG 1 50 TYR HB3 . . 5.390 3.347 2.294 3.829 . 0 0 "[ . 1 . 2]" 1
922 1 47 VAL QG 1 50 TYR QE . . 4.800 3.752 3.392 4.637 . 0 0 "[ . 1 . 2]" 1
923 1 47 VAL QG 1 65 PHE HB2 . . 4.500 3.206 2.730 3.710 . 0 0 "[ . 1 . 2]" 1
924 1 47 VAL QG 1 65 PHE HB3 . . 4.360 2.892 2.181 3.392 . 0 0 "[ . 1 . 2]" 1
925 1 47 VAL QG 1 65 PHE QD . . 3.800 2.905 2.151 3.285 . 0 0 "[ . 1 . 2]" 1
926 1 47 VAL QG 1 65 PHE QE . . 3.850 3.038 2.567 3.632 . 0 0 "[ . 1 . 2]" 1
927 1 47 VAL QG 1 65 PHE HZ . . 4.740 3.845 3.479 4.392 . 0 0 "[ . 1 . 2]" 1
928 1 47 VAL QG 1 76 LYS HB2 . . 4.660 3.357 2.972 4.040 . 0 0 "[ . 1 . 2]" 1
929 1 47 VAL QG 1 76 LYS HB3 . . 4.590 3.428 2.874 4.019 . 0 0 "[ . 1 . 2]" 1
930 1 47 VAL QG 1 76 LYS HD2 . . 4.310 2.490 2.161 3.908 . 0 0 "[ . 1 . 2]" 1
931 1 47 VAL QG 1 76 LYS HD3 . . 3.670 2.694 2.421 3.145 . 0 0 "[ . 1 . 2]" 1
932 1 47 VAL QG 1 76 LYS HG2 . . 5.340 4.502 4.120 5.226 . 0 0 "[ . 1 . 2]" 1
933 1 47 VAL QG 1 85 LEU QD . . 3.530 2.334 1.974 2.834 . 0 0 "[ . 1 . 2]" 1
934 1 47 VAL QG 1 85 LEU HG . . 5.500 3.538 2.922 4.978 . 0 0 "[ . 1 . 2]" 1
935 1 48 ASP H 1 48 ASP HB2 . . 3.240 2.425 1.990 3.592 0.352 14 0 "[ . 1 . 2]" 1
936 1 48 ASP H 1 48 ASP HB3 . . 3.570 2.986 2.375 3.647 0.077 8 0 "[ . 1 . 2]" 1
937 1 48 ASP H 1 49 ASP H . . 4.640 2.744 2.000 3.088 . 0 0 "[ . 1 . 2]" 1
938 1 48 ASP H 1 50 TYR H . . 4.350 4.142 3.345 4.428 0.078 11 0 "[ . 1 . 2]" 1
939 1 48 ASP HA 1 48 ASP HB3 . . 2.990 2.815 2.414 3.052 0.062 10 0 "[ . 1 . 2]" 1
940 1 48 ASP HA 1 49 ASP H . . 3.170 3.238 3.160 3.260 0.090 2 0 "[ . 1 . 2]" 1
941 1 48 ASP HA 1 49 ASP HA . . 4.520 4.575 4.453 4.613 0.093 17 0 "[ . 1 . 2]" 1
942 1 48 ASP HB2 1 49 ASP H . . 4.060 3.735 3.012 4.122 0.062 16 0 "[ . 1 . 2]" 1
943 1 48 ASP HB3 1 49 ASP H . . 3.970 3.562 2.971 4.137 0.167 15 0 "[ . 1 . 2]" 1
944 1 49 ASP H 1 50 TYR H . . 3.650 1.994 1.711 2.421 . 0 0 "[ . 1 . 2]" 1
945 1 49 ASP H 1 50 TYR HB2 . . 3.980 3.831 3.265 4.050 0.070 13 0 "[ . 1 . 2]" 1
946 1 49 ASP H 1 50 TYR HB3 . . 5.500 5.224 4.862 5.508 0.008 13 0 "[ . 1 . 2]" 1
947 1 49 ASP H 1 50 TYR QD . . 3.470 2.775 2.536 3.222 . 0 0 "[ . 1 . 2]" 1
948 1 49 ASP H 1 50 TYR QE . . 4.880 4.663 4.364 4.974 0.094 13 0 "[ . 1 . 2]" 1
949 1 50 TYR H 1 50 TYR HB2 . . 3.200 2.290 2.181 2.383 . 0 0 "[ . 1 . 2]" 1
950 1 50 TYR H 1 50 TYR HB3 . . 3.830 3.543 3.477 3.592 . 0 0 "[ . 1 . 2]" 1
951 1 50 TYR H 1 50 TYR QD . . 3.120 2.739 2.482 3.154 0.034 2 0 "[ . 1 . 2]" 1
952 1 50 TYR H 1 51 SER H . . 5.420 4.492 4.079 4.678 . 0 0 "[ . 1 . 2]" 1
953 1 50 TYR HA 1 50 TYR QD . . 3.470 2.788 2.570 3.096 . 0 0 "[ . 1 . 2]" 1
954 1 50 TYR HA 1 51 SER H . . 3.090 2.285 2.126 2.398 . 0 0 "[ . 1 . 2]" 1
955 1 50 TYR HA 1 66 PHE H . . 4.510 4.347 3.946 4.589 0.079 10 0 "[ . 1 . 2]" 1
956 1 50 TYR HA 1 67 LYS H . . 5.450 5.086 4.727 5.516 0.066 9 0 "[ . 1 . 2]" 1
957 1 50 TYR HA 1 67 LYS HB2 . . 3.730 2.643 2.142 3.157 . 0 0 "[ . 1 . 2]" 1
958 1 50 TYR HA 1 67 LYS QG . . 4.060 2.828 1.981 3.941 . 0 0 "[ . 1 . 2]" 1
959 1 50 TYR HB2 1 66 PHE H . . 4.620 4.497 4.306 4.692 0.072 16 0 "[ . 1 . 2]" 1
960 1 50 TYR HB3 1 51 SER H . . 3.880 3.155 2.653 3.939 0.059 18 0 "[ . 1 . 2]" 1
961 1 50 TYR HB3 1 66 PHE H . . 3.740 2.818 2.617 2.991 . 0 0 "[ . 1 . 2]" 1
962 1 50 TYR QD 1 51 SER H . . 4.950 4.322 3.925 4.815 . 0 0 "[ . 1 . 2]" 1
963 1 50 TYR QD 1 66 PHE H . . 3.610 3.242 2.648 3.645 0.035 13 0 "[ . 1 . 2]" 1
964 1 50 TYR QD 1 66 PHE HA . . 3.640 2.999 2.743 3.243 . 0 0 "[ . 1 . 2]" 1
965 1 50 TYR QD 1 67 LYS H . . 4.950 3.819 3.256 4.124 . 0 0 "[ . 1 . 2]" 1
966 1 50 TYR QD 1 67 LYS HB2 . . 4.130 2.943 2.807 3.075 . 0 0 "[ . 1 . 2]" 1
967 1 50 TYR QD 1 67 LYS HB3 . . 5.220 3.893 3.519 4.184 . 0 0 "[ . 1 . 2]" 1
968 1 50 TYR QD 1 67 LYS HD2 . . 4.570 3.650 2.599 4.674 0.104 6 0 "[ . 1 . 2]" 1
969 1 50 TYR QD 1 67 LYS HD3 . . 4.860 4.320 2.676 4.955 0.095 1 0 "[ . 1 . 2]" 1
970 1 50 TYR QD 1 67 LYS QE . . 5.080 4.507 2.825 5.190 0.110 18 0 "[ . 1 . 2]" 1
971 1 50 TYR QD 1 67 LYS QG . . 5.500 3.275 2.206 4.368 . 0 0 "[ . 1 . 2]" 1
972 1 50 TYR QD 1 76 LYS HD2 . . 3.540 3.169 2.770 3.617 0.077 12 0 "[ . 1 . 2]" 1
973 1 50 TYR QE 1 67 LYS H . . 5.210 3.574 3.132 4.099 . 0 0 "[ . 1 . 2]" 1
974 1 50 TYR QE 1 67 LYS HA . . 5.100 5.063 4.803 5.178 0.078 17 0 "[ . 1 . 2]" 1
975 1 50 TYR QE 1 67 LYS HB2 . . 3.840 3.184 2.931 3.518 . 0 0 "[ . 1 . 2]" 1
976 1 50 TYR QE 1 67 LYS HB3 . . 5.040 3.238 3.022 3.445 . 0 0 "[ . 1 . 2]" 1
977 1 50 TYR QE 1 67 LYS HD2 . . 4.650 3.755 2.439 4.745 0.095 5 0 "[ . 1 . 2]" 1
978 1 50 TYR QE 1 67 LYS HD3 . . 4.620 4.055 3.012 4.719 0.099 20 0 "[ . 1 . 2]" 1
979 1 50 TYR QE 1 74 ILE HB . . 3.690 2.537 2.083 2.907 . 0 0 "[ . 1 . 2]" 1
980 1 50 TYR QE 1 74 ILE MD . . 5.500 4.279 3.674 5.286 . 0 0 "[ . 1 . 2]" 1
981 1 50 TYR QE 1 74 ILE MG . . 3.660 2.700 2.223 3.254 . 0 0 "[ . 1 . 2]" 1
982 1 50 TYR QE 1 76 LYS H . . 4.570 4.490 4.135 4.663 0.093 16 0 "[ . 1 . 2]" 1
983 1 50 TYR QE 1 76 LYS HD2 . . 5.490 2.692 2.284 3.153 . 0 0 "[ . 1 . 2]" 1
984 1 50 TYR QE 1 76 LYS HD3 . . 4.810 4.238 3.965 4.732 . 0 0 "[ . 1 . 2]" 1
985 1 50 TYR QE 1 76 LYS HG2 . . 4.760 4.215 3.839 4.965 0.205 11 0 "[ . 1 . 2]" 1
986 1 51 SER H 1 51 SER HB2 . . 3.690 2.674 2.054 3.499 . 0 0 "[ . 1 . 2]" 1
987 1 51 SER H 1 51 SER HB3 . . 3.300 3.275 2.232 3.587 0.287 12 0 "[ . 1 . 2]" 1
988 1 51 SER H 1 66 PHE H . . 3.960 3.405 2.953 3.967 0.007 18 0 "[ . 1 . 2]" 1
989 1 51 SER H 1 67 LYS HB2 . . 4.950 3.966 3.429 4.585 . 0 0 "[ . 1 . 2]" 1
990 1 51 SER HA 1 52 TYR H . . 3.290 2.346 2.251 2.421 . 0 0 "[ . 1 . 2]" 1
991 1 51 SER HA 1 52 TYR QD . . 4.880 3.744 3.262 4.271 . 0 0 "[ . 1 . 2]" 1
992 1 51 SER HB2 1 52 TYR H . . 4.060 3.605 2.593 4.116 0.056 2 0 "[ . 1 . 2]" 1
993 1 51 SER HB2 1 66 PHE H . . 5.070 3.758 3.081 4.769 . 0 0 "[ . 1 . 2]" 1
994 1 51 SER HB3 1 52 TYR H . . 3.480 3.153 2.577 3.725 0.245 20 0 "[ . 1 . 2]" 1
995 1 52 TYR H 1 52 TYR QD . . 4.330 2.896 2.349 3.460 . 0 0 "[ . 1 . 2]" 1
996 1 52 TYR HA 1 52 TYR QD . . 4.150 3.777 3.743 3.809 . 0 0 "[ . 1 . 2]" 1
997 1 52 TYR HA 1 53 LEU H . . 3.020 2.330 2.091 2.450 . 0 0 "[ . 1 . 2]" 1
998 1 52 TYR HA 1 63 ILE MD . . 5.470 4.686 4.298 5.296 . 0 0 "[ . 1 . 2]" 1
999 1 52 TYR HA 1 64 ILE H . . 5.280 4.468 4.200 4.713 . 0 0 "[ . 1 . 2]" 1
1000 1 52 TYR HB2 1 53 LEU H . . 3.520 2.483 2.223 3.007 . 0 0 "[ . 1 . 2]" 1
1001 1 52 TYR HB2 1 63 ILE MD . . 4.260 2.608 2.206 3.307 . 0 0 "[ . 1 . 2]" 1
1002 1 52 TYR HB2 1 63 ILE QG . . 4.880 2.635 2.313 3.029 . 0 0 "[ . 1 . 2]" 1
1003 1 52 TYR HB2 1 63 ILE MG . . 5.370 4.687 4.512 4.841 . 0 0 "[ . 1 . 2]" 1
1004 1 52 TYR HB2 1 65 PHE QD . . 3.790 3.833 3.697 3.872 0.082 13 0 "[ . 1 . 2]" 1
1005 1 52 TYR HB3 1 53 LEU H . . 3.990 3.804 3.620 4.063 0.073 20 0 "[ . 1 . 2]" 1
1006 1 52 TYR HB3 1 63 ILE MD . . 4.580 3.417 2.909 4.209 . 0 0 "[ . 1 . 2]" 1
1007 1 52 TYR HB3 1 63 ILE QG . . 5.280 3.889 3.520 4.480 . 0 0 "[ . 1 . 2]" 1
1008 1 52 TYR HB3 1 63 ILE MG . . 5.390 5.471 5.390 5.498 0.108 3 0 "[ . 1 . 2]" 1
1009 1 52 TYR HB3 1 65 PHE QD . . 3.300 2.586 2.348 2.822 . 0 0 "[ . 1 . 2]" 1
1010 1 52 TYR HB3 1 65 PHE QE . . 5.460 3.143 2.881 3.514 . 0 0 "[ . 1 . 2]" 1
1011 1 52 TYR QD 1 53 LEU H . . 5.030 3.341 2.739 4.025 . 0 0 "[ . 1 . 2]" 1
1012 1 52 TYR QD 1 53 LEU HA . . 4.600 3.710 3.006 4.332 . 0 0 "[ . 1 . 2]" 1
1013 1 52 TYR QD 1 54 VAL H . . 4.680 3.886 3.440 4.478 . 0 0 "[ . 1 . 2]" 1
1014 1 52 TYR QD 1 54 VAL HB . . 3.180 2.848 2.509 3.171 . 0 0 "[ . 1 . 2]" 1
1015 1 52 TYR QD 1 54 VAL QG . . 2.830 2.499 2.254 2.850 0.020 18 0 "[ . 1 . 2]" 1
1016 1 52 TYR QD 1 63 ILE MD . . 3.480 2.651 2.140 3.536 0.056 14 0 "[ . 1 . 2]" 1
1017 1 52 TYR QD 1 63 ILE QG . . 5.500 3.117 2.776 3.710 . 0 0 "[ . 1 . 2]" 1
1018 1 52 TYR QE 1 54 VAL HB . . 4.030 3.908 3.410 4.120 0.090 10 0 "[ . 1 . 2]" 1
1019 1 52 TYR QE 1 54 VAL QG . . 2.680 2.118 2.000 2.244 . 0 0 "[ . 1 . 2]" 1
1020 1 52 TYR QE 1 63 ILE MD . . 5.420 3.681 3.142 4.457 . 0 0 "[ . 1 . 2]" 1
1021 1 53 LEU H 1 53 LEU HB2 . . 3.610 2.648 2.530 2.774 . 0 0 "[ . 1 . 2]" 1
1022 1 53 LEU H 1 53 LEU QD . . 4.580 3.245 2.365 3.781 . 0 0 "[ . 1 . 2]" 1
1023 1 53 LEU H 1 53 LEU HG . . 4.250 3.766 3.180 4.336 0.086 8 0 "[ . 1 . 2]" 1
1024 1 53 LEU H 1 63 ILE MD . . 5.370 4.212 3.695 4.844 . 0 0 "[ . 1 . 2]" 1
1025 1 53 LEU H 1 63 ILE MG . . 5.500 5.435 5.131 5.604 0.104 20 0 "[ . 1 . 2]" 1
1026 1 53 LEU H 1 64 ILE H . . 4.060 2.797 2.598 3.033 . 0 0 "[ . 1 . 2]" 1
1027 1 53 LEU H 1 64 ILE HB . . 4.220 3.695 3.264 4.018 . 0 0 "[ . 1 . 2]" 1
1028 1 53 LEU H 1 64 ILE MG . . 5.260 4.569 4.113 5.043 . 0 0 "[ . 1 . 2]" 1
1029 1 53 LEU HA 1 53 LEU QD . . 3.080 2.238 2.143 2.371 . 0 0 "[ . 1 . 2]" 1
1030 1 53 LEU HA 1 54 VAL H . . 2.890 2.248 2.163 2.467 . 0 0 "[ . 1 . 2]" 1
1031 1 53 LEU HA 1 54 VAL HA . . 5.050 4.501 4.452 4.555 . 0 0 "[ . 1 . 2]" 1
1032 1 53 LEU HA 1 54 VAL QG . . 4.730 3.619 3.190 3.940 . 0 0 "[ . 1 . 2]" 1
1033 1 53 LEU HB2 1 54 VAL H . . 4.780 4.204 4.018 4.435 . 0 0 "[ . 1 . 2]" 1
1034 1 53 LEU HB2 1 64 ILE H . . 4.870 3.480 3.202 3.871 . 0 0 "[ . 1 . 2]" 1
1035 1 53 LEU HB2 1 64 ILE MD . . 4.730 3.593 3.013 4.152 . 0 0 "[ . 1 . 2]" 1
1036 1 53 LEU HB3 1 54 VAL H . . 4.350 3.269 3.081 3.487 . 0 0 "[ . 1 . 2]" 1
1037 1 53 LEU QD 1 54 VAL H . . 3.940 3.629 3.182 3.920 . 0 0 "[ . 1 . 2]" 1
1038 1 53 LEU QD 1 66 PHE QD . . 3.280 2.857 2.064 3.356 0.076 7 0 "[ . 1 . 2]" 1
1039 1 53 LEU HG 1 66 PHE QD . . 4.650 4.309 3.048 4.748 0.098 17 0 "[ . 1 . 2]" 1
1040 1 54 VAL H 1 54 VAL HB . . 3.690 3.336 3.191 3.501 . 0 0 "[ . 1 . 2]" 1
1041 1 54 VAL H 1 54 VAL QG . . 3.380 2.440 2.297 2.585 . 0 0 "[ . 1 . 2]" 1
1042 1 54 VAL HA 1 54 VAL QG . . 3.280 2.330 2.206 2.463 . 0 0 "[ . 1 . 2]" 1
1043 1 54 VAL HA 1 55 ALA H . . 2.970 2.525 2.361 2.805 . 0 0 "[ . 1 . 2]" 1
1044 1 54 VAL HA 1 63 ILE HB . . 4.800 4.529 4.102 4.860 0.060 11 0 "[ . 1 . 2]" 1
1045 1 54 VAL HA 1 63 ILE MD . . 4.850 4.607 4.287 4.924 0.074 6 0 "[ . 1 . 2]" 1
1046 1 54 VAL HA 1 63 ILE QG . . 5.020 3.766 2.818 4.490 . 0 0 "[ . 1 . 2]" 1
1047 1 54 VAL HA 1 64 ILE H . . 5.500 4.219 3.878 4.554 . 0 0 "[ . 1 . 2]" 1
1048 1 54 VAL HB 1 55 ALA H . . 4.460 4.081 3.828 4.249 . 0 0 "[ . 1 . 2]" 1
1049 1 54 VAL HB 1 63 ILE HB . . 4.740 3.508 2.921 4.229 . 0 0 "[ . 1 . 2]" 1
1050 1 54 VAL HB 1 63 ILE MD . . 3.660 2.689 2.250 3.104 . 0 0 "[ . 1 . 2]" 1
1051 1 54 VAL HB 1 63 ILE QG . . 2.940 2.485 1.896 2.964 0.024 11 0 "[ . 1 . 2]" 1
1052 1 54 VAL QG 1 55 ALA H . . 3.200 2.169 1.825 2.482 . 0 0 "[ . 1 . 2]" 1
1053 1 54 VAL QG 1 56 ALA HA . . 4.810 3.786 3.255 4.250 . 0 0 "[ . 1 . 2]" 1
1054 1 54 VAL QG 1 59 GLN HA . . 3.740 2.311 1.918 2.937 . 0 0 "[ . 1 . 2]" 1
1055 1 54 VAL QG 1 59 GLN HB3 . . 5.190 3.903 3.011 4.697 . 0 0 "[ . 1 . 2]" 1
1056 1 54 VAL QG 1 59 GLN HE21 . . 5.150 3.957 2.326 5.058 . 0 0 "[ . 1 . 2]" 1
1057 1 54 VAL QG 1 59 GLN HG2 . . 5.110 3.263 2.615 3.804 . 0 0 "[ . 1 . 2]" 1
1058 1 54 VAL QG 1 59 GLN HG3 . . 5.260 3.980 3.194 4.619 . 0 0 "[ . 1 . 2]" 1
1059 1 54 VAL QG 1 62 THR HB . . 5.470 4.478 3.768 5.155 . 0 0 "[ . 1 . 2]" 1
1060 1 54 VAL QG 1 63 ILE HA . . 3.470 3.193 2.479 3.461 . 0 0 "[ . 1 . 2]" 1
1061 1 54 VAL QG 1 63 ILE HB . . 3.890 2.961 2.579 3.224 . 0 0 "[ . 1 . 2]" 1
1062 1 54 VAL QG 1 63 ILE MD . . 3.700 2.672 2.302 2.922 . 0 0 "[ . 1 . 2]" 1
1063 1 54 VAL QG 1 63 ILE QG . . 4.620 3.065 2.181 3.578 . 0 0 "[ . 1 . 2]" 1
1064 1 54 VAL QG 1 63 ILE MG . . 4.960 4.056 3.830 4.226 . 0 0 "[ . 1 . 2]" 1
1065 1 55 ALA H 1 55 ALA MB . . 3.170 2.354 2.086 2.630 . 0 0 "[ . 1 . 2]" 1
1066 1 55 ALA H 1 58 ASP HB2 . . 5.350 3.686 1.907 5.435 0.085 12 0 "[ . 1 . 2]" 1
1067 1 55 ALA HA 1 56 ALA H . . 2.910 2.308 2.127 2.608 . 0 0 "[ . 1 . 2]" 1
1068 1 55 ALA HA 1 56 ALA HA . . 4.800 4.330 4.029 4.584 . 0 0 "[ . 1 . 2]" 1
1069 1 55 ALA HA 1 56 ALA MB . . 4.230 4.058 3.866 4.304 0.074 15 0 "[ . 1 . 2]" 1
1070 1 55 ALA MB 1 56 ALA H . . 3.530 2.704 2.246 3.394 . 0 0 "[ . 1 . 2]" 1
1071 1 55 ALA MB 1 57 ASP H . . 3.820 2.629 2.117 3.124 . 0 0 "[ . 1 . 2]" 1
1072 1 55 ALA MB 1 58 ASP H . . 3.960 2.494 1.735 3.189 . 0 0 "[ . 1 . 2]" 1
1073 1 55 ALA MB 1 58 ASP HB2 . . 3.500 2.651 2.042 4.370 0.870 13 2 "[ - . 1 + . 2]" 1
1074 1 55 ALA MB 1 58 ASP HB3 . . 4.360 3.063 1.928 3.747 . 0 0 "[ . 1 . 2]" 1
1075 1 56 ALA H 1 56 ALA MB . . 2.980 2.218 2.118 2.323 . 0 0 "[ . 1 . 2]" 1
1076 1 56 ALA H 1 57 ASP H . . 4.100 2.735 2.272 3.015 . 0 0 "[ . 1 . 2]" 1
1077 1 56 ALA H 1 58 ASP H . . 5.500 4.234 3.842 4.521 . 0 0 "[ . 1 . 2]" 1
1078 1 56 ALA HA 1 57 ASP H . . 3.320 3.386 3.309 3.404 0.084 20 0 "[ . 1 . 2]" 1
1079 1 56 ALA HA 1 58 ASP H . . 4.470 4.312 3.900 4.558 0.088 4 0 "[ . 1 . 2]" 1
1080 1 56 ALA HA 1 59 GLN HE21 . . 5.410 4.270 2.648 5.647 0.237 11 0 "[ . 1 . 2]" 1
1081 1 56 ALA HA 1 59 GLN HG2 . . 5.060 3.770 2.194 5.084 0.024 9 0 "[ . 1 . 2]" 1
1082 1 56 ALA HA 1 59 GLN HG3 . . 4.760 3.760 2.268 4.568 . 0 0 "[ . 1 . 2]" 1
1083 1 56 ALA MB 1 57 ASP H . . 3.540 3.047 2.700 3.424 . 0 0 "[ . 1 . 2]" 1
1084 1 56 ALA MB 1 57 ASP HA . . 4.090 4.141 4.009 4.203 0.113 3 0 "[ . 1 . 2]" 1
1085 1 56 ALA MB 1 58 ASP H . . 5.120 4.651 4.429 5.014 . 0 0 "[ . 1 . 2]" 1
1086 1 57 ASP H 1 57 ASP HB2 . . 4.180 2.823 2.271 3.779 . 0 0 "[ . 1 . 2]" 1
1087 1 57 ASP H 1 58 ASP H . . 3.350 2.163 1.894 2.427 . 0 0 "[ . 1 . 2]" 1
1088 1 57 ASP HA 1 59 GLN H . . 3.660 3.636 3.139 3.760 0.100 14 0 "[ . 1 . 2]" 1
1089 1 58 ASP H 1 58 ASP HB2 . . 3.710 2.905 2.228 3.863 0.153 13 0 "[ . 1 . 2]" 1
1090 1 58 ASP H 1 58 ASP HB3 . . 3.830 3.275 2.471 3.897 0.067 14 0 "[ . 1 . 2]" 1
1091 1 58 ASP H 1 59 GLN H . . 4.000 2.719 2.334 3.274 . 0 0 "[ . 1 . 2]" 1
1092 1 58 ASP H 1 61 GLY H . . 5.490 5.297 4.913 5.575 0.085 19 0 "[ . 1 . 2]" 1
1093 1 58 ASP HA 1 59 GLN H . . 3.210 2.884 2.599 3.245 0.035 19 0 "[ . 1 . 2]" 1
1094 1 58 ASP HA 1 60 ASP H . . 4.120 3.762 3.031 4.205 0.085 5 0 "[ . 1 . 2]" 1
1095 1 58 ASP HB3 1 59 GLN H . . 5.480 4.379 4.045 4.600 . 0 0 "[ . 1 . 2]" 1
1096 1 59 GLN H 1 59 GLN HB2 . . 3.380 2.527 1.976 2.734 . 0 0 "[ . 1 . 2]" 1
1097 1 59 GLN H 1 59 GLN HB3 . . 3.850 3.617 3.230 3.737 . 0 0 "[ . 1 . 2]" 1
1098 1 59 GLN H 1 59 GLN HG2 . . 3.830 3.338 2.084 3.879 0.049 5 0 "[ . 1 . 2]" 1
1099 1 59 GLN H 1 59 GLN HG3 . . 3.950 2.614 2.119 4.016 0.066 8 0 "[ . 1 . 2]" 1
1100 1 59 GLN H 1 60 ASP H . . 3.340 2.983 2.691 3.199 . 0 0 "[ . 1 . 2]" 1
1101 1 59 GLN H 1 61 GLY H . . 4.960 4.040 3.782 4.406 . 0 0 "[ . 1 . 2]" 1
1102 1 59 GLN HA 1 59 GLN HG2 . . 3.610 2.576 2.196 3.310 . 0 0 "[ . 1 . 2]" 1
1103 1 59 GLN HA 1 59 GLN HG3 . . 3.870 3.110 2.497 3.846 . 0 0 "[ . 1 . 2]" 1
1104 1 59 GLN HA 1 61 GLY H . . 5.490 3.994 3.617 4.378 . 0 0 "[ . 1 . 2]" 1
1105 1 59 GLN HB2 1 60 ASP H . . 4.420 2.993 2.395 3.750 . 0 0 "[ . 1 . 2]" 1
1106 1 60 ASP H 1 60 ASP HB2 . . 3.480 3.359 2.224 4.020 0.540 17 1 "[ . 1 . + 2]" 1
1107 1 60 ASP H 1 60 ASP HB3 . . 3.990 3.074 2.629 3.634 . 0 0 "[ . 1 . 2]" 1
1108 1 60 ASP H 1 61 GLY H . . 3.170 2.329 1.956 2.778 . 0 0 "[ . 1 . 2]" 1
1109 1 60 ASP H 1 61 GLY HA3 . . 5.270 4.325 3.897 4.737 . 0 0 "[ . 1 . 2]" 1
1110 1 60 ASP HA 1 81 ARG HB2 . . 3.980 3.072 2.410 4.069 0.089 8 0 "[ . 1 . 2]" 1
1111 1 60 ASP HA 1 81 ARG HB3 . . 3.530 3.515 2.450 4.042 0.512 6 1 "[ .+ 1 . 2]" 1
1112 1 60 ASP HA 1 81 ARG QD . . 4.390 2.995 2.055 4.448 0.058 14 0 "[ . 1 . 2]" 1
1113 1 60 ASP HA 1 81 ARG QG . . 4.660 3.118 1.969 4.588 . 0 0 "[ . 1 . 2]" 1
1114 1 60 ASP HB2 1 61 GLY H . . 5.020 4.319 3.383 4.672 . 0 0 "[ . 1 . 2]" 1
1115 1 60 ASP HB3 1 61 GLY H . . 4.810 4.343 3.852 4.597 . 0 0 "[ . 1 . 2]" 1
1116 1 60 ASP HB3 1 81 ARG HB2 . . 5.200 5.032 3.854 6.173 0.973 19 4 "[ . * 1- * +2]" 1
1117 1 61 GLY H 1 62 THR H . . 4.050 3.051 2.421 3.898 . 0 0 "[ . 1 . 2]" 1
1118 1 61 GLY HA3 1 62 THR H . . 3.100 2.427 2.204 2.711 . 0 0 "[ . 1 . 2]" 1
1119 1 62 THR H 1 62 THR HB . . 3.120 2.848 2.485 3.182 0.062 9 0 "[ . 1 . 2]" 1
1120 1 62 THR H 1 62 THR MG . . 4.550 3.910 3.704 4.058 . 0 0 "[ . 1 . 2]" 1
1121 1 62 THR HA 1 62 THR MG . . 3.360 2.303 2.141 2.418 . 0 0 "[ . 1 . 2]" 1
1122 1 62 THR HA 1 63 ILE H . . 2.870 2.436 2.257 2.549 . 0 0 "[ . 1 . 2]" 1
1123 1 62 THR HA 1 63 ILE HB . . 5.210 4.591 4.074 4.924 . 0 0 "[ . 1 . 2]" 1
1124 1 62 THR HA 1 63 ILE MG . . 4.360 3.892 3.555 4.241 . 0 0 "[ . 1 . 2]" 1
1125 1 62 THR HB 1 63 ILE H . . 5.180 3.623 3.043 3.888 . 0 0 "[ . 1 . 2]" 1
1126 1 62 THR HB 1 63 ILE HA . . 4.090 4.089 3.694 4.173 0.083 15 0 "[ . 1 . 2]" 1
1127 1 62 THR MG 1 63 ILE H . . 3.330 2.239 2.005 2.745 . 0 0 "[ . 1 . 2]" 1
1128 1 62 THR MG 1 63 ILE MG . . 4.600 4.191 4.004 4.578 . 0 0 "[ . 1 . 2]" 1
1129 1 62 THR MG 1 64 ILE H . . 5.500 4.748 4.221 5.245 . 0 0 "[ . 1 . 2]" 1
1130 1 62 THR MG 1 64 ILE MD . . 4.150 3.538 3.112 4.077 . 0 0 "[ . 1 . 2]" 1
1131 1 62 THR MG 1 64 ILE HG12 . . 4.080 3.786 3.038 4.205 0.125 9 0 "[ . 1 . 2]" 1
1132 1 62 THR MG 1 64 ILE HG13 . . 4.110 3.221 2.726 3.866 . 0 0 "[ . 1 . 2]" 1
1133 1 62 THR MG 1 78 THR H . . 4.490 4.397 3.935 4.609 0.119 8 0 "[ . 1 . 2]" 1
1134 1 62 THR MG 1 79 SER HB2 . . 5.500 5.379 4.183 5.601 0.101 2 0 "[ . 1 . 2]" 1
1135 1 62 THR MG 1 79 SER HB3 . . 5.500 5.037 3.632 5.573 0.073 15 0 "[ . 1 . 2]" 1
1136 1 63 ILE H 1 63 ILE HB . . 3.980 3.426 3.105 3.667 . 0 0 "[ . 1 . 2]" 1
1137 1 63 ILE H 1 63 ILE MG . . 3.380 2.632 2.400 2.889 . 0 0 "[ . 1 . 2]" 1
1138 1 63 ILE H 1 78 THR MG . . 3.950 3.400 2.903 3.780 . 0 0 "[ . 1 . 2]" 1
1139 1 63 ILE HA 1 63 ILE MD . . 3.820 3.693 3.552 3.869 0.049 15 0 "[ . 1 . 2]" 1
1140 1 63 ILE HA 1 63 ILE QG . . 3.600 2.361 2.155 2.473 . 0 0 "[ . 1 . 2]" 1
1141 1 63 ILE HA 1 63 ILE MG . . 3.670 3.283 3.268 3.296 . 0 0 "[ . 1 . 2]" 1
1142 1 63 ILE HA 1 64 ILE H . . 3.090 2.349 2.225 2.456 . 0 0 "[ . 1 . 2]" 1
1143 1 63 ILE HA 1 64 ILE HB . . 4.850 4.727 4.517 4.899 0.049 16 0 "[ . 1 . 2]" 1
1144 1 63 ILE HA 1 64 ILE MD . . 4.720 4.807 4.762 4.831 0.111 14 0 "[ . 1 . 2]" 1
1145 1 63 ILE HA 1 64 ILE HG13 . . 5.350 3.594 3.331 3.841 . 0 0 "[ . 1 . 2]" 1
1146 1 63 ILE HB 1 63 ILE MD . . 3.650 2.330 2.168 2.551 . 0 0 "[ . 1 . 2]" 1
1147 1 63 ILE HB 1 78 THR MG . . 4.810 4.491 4.180 4.910 0.100 8 0 "[ . 1 . 2]" 1
1148 1 63 ILE MD 1 63 ILE MG . . 3.370 2.132 2.053 2.232 . 0 0 "[ . 1 . 2]" 1
1149 1 63 ILE MD 1 64 ILE H . . 4.380 3.953 3.791 4.233 . 0 0 "[ . 1 . 2]" 1
1150 1 63 ILE MD 1 65 PHE QE . . 3.500 2.774 2.327 3.389 . 0 0 "[ . 1 . 2]" 1
1151 1 63 ILE MD 1 65 PHE HZ . . 3.450 2.688 2.455 3.272 . 0 0 "[ . 1 . 2]" 1
1152 1 63 ILE MD 1 78 THR MG . . 4.570 4.546 4.312 4.683 0.113 15 0 "[ . 1 . 2]" 1
1153 1 63 ILE MD 1 81 ARG QD . . 4.610 3.258 2.117 4.745 0.135 8 0 "[ . 1 . 2]" 1
1154 1 63 ILE QG 1 64 ILE H . . 3.590 2.182 2.024 2.471 . 0 0 "[ . 1 . 2]" 1
1155 1 63 ILE QG 1 64 ILE HA . . 4.430 3.821 3.519 4.356 . 0 0 "[ . 1 . 2]" 1
1156 1 63 ILE QG 1 65 PHE QD . . 5.500 3.509 2.985 4.080 . 0 0 "[ . 1 . 2]" 1
1157 1 63 ILE QG 1 65 PHE QE . . 4.930 3.188 2.623 3.919 . 0 0 "[ . 1 . 2]" 1
1158 1 63 ILE MG 1 64 ILE H . . 4.560 3.711 3.360 3.967 . 0 0 "[ . 1 . 2]" 1
1159 1 63 ILE MG 1 64 ILE HA . . 4.480 3.735 3.466 4.104 . 0 0 "[ . 1 . 2]" 1
1160 1 63 ILE MG 1 65 PHE QD . . 4.340 3.236 2.773 3.948 . 0 0 "[ . 1 . 2]" 1
1161 1 63 ILE MG 1 65 PHE QE . . 3.540 2.323 2.107 3.034 . 0 0 "[ . 1 . 2]" 1
1162 1 63 ILE MG 1 77 TYR HA . . 4.580 4.294 3.758 4.656 0.076 10 0 "[ . 1 . 2]" 1
1163 1 63 ILE MG 1 78 THR H . . 3.980 3.963 3.385 4.083 0.103 11 0 "[ . 1 . 2]" 1
1164 1 63 ILE MG 1 78 THR MG . . 3.300 2.184 1.989 2.472 . 0 0 "[ . 1 . 2]" 1
1165 1 63 ILE MG 1 81 ARG HA . . 4.300 2.685 2.012 3.603 . 0 0 "[ . 1 . 2]" 1
1166 1 63 ILE MG 1 81 ARG QD . . 4.040 3.155 1.958 4.145 0.105 20 0 "[ . 1 . 2]" 1
1167 1 64 ILE H 1 64 ILE HB . . 3.470 2.826 2.678 3.003 . 0 0 "[ . 1 . 2]" 1
1168 1 64 ILE H 1 64 ILE MD . . 4.730 4.066 3.889 4.246 . 0 0 "[ . 1 . 2]" 1
1169 1 64 ILE H 1 64 ILE HG12 . . 4.070 4.110 3.740 4.356 0.286 2 0 "[ . 1 . 2]" 1
1170 1 64 ILE H 1 64 ILE HG13 . . 4.320 2.985 2.781 3.217 . 0 0 "[ . 1 . 2]" 1
1171 1 64 ILE H 1 64 ILE MG . . 4.340 3.954 3.876 4.011 . 0 0 "[ . 1 . 2]" 1
1172 1 64 ILE HA 1 64 ILE MD . . 4.260 3.972 3.885 4.040 . 0 0 "[ . 1 . 2]" 1
1173 1 64 ILE HA 1 64 ILE HG13 . . 4.040 3.158 2.896 3.442 . 0 0 "[ . 1 . 2]" 1
1174 1 64 ILE HA 1 64 ILE MG . . 3.280 2.372 2.250 2.507 . 0 0 "[ . 1 . 2]" 1
1175 1 64 ILE HA 1 65 PHE H . . 2.980 2.256 2.160 2.377 . 0 0 "[ . 1 . 2]" 1
1176 1 64 ILE HA 1 65 PHE QD . . 4.880 3.482 3.021 4.313 . 0 0 "[ . 1 . 2]" 1
1177 1 64 ILE HA 1 77 TYR HA . . 3.460 2.479 2.163 2.879 . 0 0 "[ . 1 . 2]" 1
1178 1 64 ILE HA 1 77 TYR HB2 . . 3.860 3.623 3.071 3.912 0.052 9 0 "[ . 1 . 2]" 1
1179 1 64 ILE HA 1 77 TYR HB3 . . 3.780 3.332 2.916 3.838 0.058 5 0 "[ . 1 . 2]" 1
1180 1 64 ILE HB 1 64 ILE MD . . 3.630 2.336 2.195 2.509 . 0 0 "[ . 1 . 2]" 1
1181 1 64 ILE HB 1 65 PHE H . . 5.020 4.084 3.596 4.433 . 0 0 "[ . 1 . 2]" 1
1182 1 64 ILE MD 1 64 ILE MG . . 3.240 2.112 2.068 2.166 . 0 0 "[ . 1 . 2]" 1
1183 1 64 ILE MD 1 77 TYR HB2 . . 5.500 4.147 3.767 4.752 . 0 0 "[ . 1 . 2]" 1
1184 1 64 ILE MD 1 77 TYR HB3 . . 5.100 4.022 3.655 4.576 . 0 0 "[ . 1 . 2]" 1
1185 1 64 ILE HG12 1 77 TYR HB2 . . 4.990 2.915 2.388 3.715 . 0 0 "[ . 1 . 2]" 1
1186 1 64 ILE HG12 1 77 TYR HB3 . . 5.420 3.173 2.499 4.016 . 0 0 "[ . 1 . 2]" 1
1187 1 64 ILE MG 1 65 PHE H . . 3.580 2.582 1.971 3.277 . 0 0 "[ . 1 . 2]" 1
1188 1 64 ILE MG 1 65 PHE HA . . 4.880 3.980 3.610 4.460 . 0 0 "[ . 1 . 2]" 1
1189 1 64 ILE MG 1 66 PHE H . . 5.500 4.796 4.480 5.345 . 0 0 "[ . 1 . 2]" 1
1190 1 64 ILE MG 1 66 PHE QR . . 3.830 3.386 2.261 4.012 0.182 8 0 "[ . 1 . 2]" 1
1191 1 64 ILE MG 1 77 TYR HA . . 4.580 3.104 2.232 3.540 . 0 0 "[ . 1 . 2]" 1
1192 1 64 ILE MG 1 77 TYR HB2 . . 4.040 3.127 2.395 3.464 . 0 0 "[ . 1 . 2]" 1
1193 1 64 ILE MG 1 77 TYR HB3 . . 3.640 2.078 1.959 2.179 . 0 0 "[ . 1 . 2]" 1
1194 1 64 ILE MG 1 77 TYR QD . . 3.330 3.440 3.424 3.465 0.135 11 0 "[ . 1 . 2]" 1
1195 1 65 PHE H 1 65 PHE HB2 . . 3.910 2.526 2.372 2.665 . 0 0 "[ . 1 . 2]" 1
1196 1 65 PHE H 1 65 PHE HB3 . . 3.740 3.674 3.589 3.750 0.010 19 0 "[ . 1 . 2]" 1
1197 1 65 PHE H 1 65 PHE QD . . 3.230 2.669 2.283 3.015 . 0 0 "[ . 1 . 2]" 1
1198 1 65 PHE H 1 65 PHE QE . . 5.500 4.862 4.393 5.274 . 0 0 "[ . 1 . 2]" 1
1199 1 65 PHE H 1 66 PHE H . . 5.230 4.525 4.400 4.694 . 0 0 "[ . 1 . 2]" 1
1200 1 65 PHE H 1 76 LYS HB2 . . 5.500 3.959 3.750 4.566 . 0 0 "[ . 1 . 2]" 1
1201 1 65 PHE H 1 77 TYR HA . . 3.860 3.008 2.717 3.300 . 0 0 "[ . 1 . 2]" 1
1202 1 65 PHE H 1 77 TYR HB2 . . 4.870 4.873 4.571 4.942 0.072 4 0 "[ . 1 . 2]" 1
1203 1 65 PHE H 1 77 TYR HB3 . . 4.750 3.915 3.673 4.179 . 0 0 "[ . 1 . 2]" 1
1204 1 65 PHE H 1 78 THR H . . 5.500 5.202 4.876 5.577 0.077 17 0 "[ . 1 . 2]" 1
1205 1 65 PHE H 1 85 LEU QD . . 4.880 3.834 3.388 4.315 . 0 0 "[ . 1 . 2]" 1
1206 1 65 PHE HA 1 65 PHE QD . . 3.250 3.123 2.880 3.331 0.081 13 0 "[ . 1 . 2]" 1
1207 1 65 PHE HA 1 66 PHE H . . 3.080 2.408 2.354 2.468 . 0 0 "[ . 1 . 2]" 1
1208 1 65 PHE HA 1 66 PHE QD . . 4.390 3.492 2.860 4.293 . 0 0 "[ . 1 . 2]" 1
1209 1 65 PHE HA 1 66 PHE QR . . 4.240 3.415 2.778 4.191 . 0 0 "[ . 1 . 2]" 1
1210 1 65 PHE HB2 1 66 PHE H . . 4.590 3.927 3.766 4.144 . 0 0 "[ . 1 . 2]" 1
1211 1 65 PHE HB2 1 76 LYS HB3 . . 4.170 2.948 2.747 3.200 . 0 0 "[ . 1 . 2]" 1
1212 1 65 PHE HB3 1 66 PHE H . . 4.680 2.842 2.622 3.139 . 0 0 "[ . 1 . 2]" 1
1213 1 65 PHE HB3 1 76 LYS H . . 4.490 4.301 4.058 4.550 0.060 19 0 "[ . 1 . 2]" 1
1214 1 65 PHE HB3 1 76 LYS HB2 . . 4.740 3.132 2.836 3.683 . 0 0 "[ . 1 . 2]" 1
1215 1 65 PHE HB3 1 76 LYS HB3 . . 4.080 4.216 4.147 4.255 0.175 20 0 "[ . 1 . 2]" 1
1216 1 65 PHE HB3 1 85 LEU QD . . 5.450 4.149 3.325 4.672 . 0 0 "[ . 1 . 2]" 1
1217 1 65 PHE QD 1 66 PHE H . . 4.470 4.092 3.868 4.383 . 0 0 "[ . 1 . 2]" 1
1218 1 65 PHE QD 1 76 LYS HB2 . . 5.130 4.175 3.818 4.472 . 0 0 "[ . 1 . 2]" 1
1219 1 65 PHE QD 1 77 TYR HA . . 4.870 3.614 3.249 3.987 . 0 0 "[ . 1 . 2]" 1
1220 1 65 PHE QD 1 85 LEU QD . . 3.100 2.350 2.003 2.658 . 0 0 "[ . 1 . 2]" 1
1221 1 65 PHE QE 1 85 LEU QD . . 3.630 2.389 2.131 3.030 . 0 0 "[ . 1 . 2]" 1
1222 1 66 PHE H 1 66 PHE QD . . 4.260 3.041 2.694 3.405 . 0 0 "[ . 1 . 2]" 1
1223 1 66 PHE HA 1 67 LYS H . . 2.950 2.374 2.291 2.466 . 0 0 "[ . 1 . 2]" 1
1224 1 66 PHE HA 1 67 LYS HA . . 5.030 4.545 4.472 4.618 . 0 0 "[ . 1 . 2]" 1
1225 1 66 PHE HA 1 73 VAL QG . . 4.400 3.705 3.392 4.136 . 0 0 "[ . 1 . 2]" 1
1226 1 66 PHE HA 1 75 ILE HA . . 3.360 2.398 2.134 2.734 . 0 0 "[ . 1 . 2]" 1
1227 1 66 PHE HA 1 75 ILE MG . . 4.520 3.750 3.340 4.396 . 0 0 "[ . 1 . 2]" 1
1228 1 66 PHE HA 1 76 LYS H . . 4.080 2.911 2.512 3.303 . 0 0 "[ . 1 . 2]" 1
1229 1 66 PHE HB2 1 67 LYS H . . 3.860 2.684 2.523 2.948 . 0 0 "[ . 1 . 2]" 1
1230 1 66 PHE HB2 1 73 VAL QG . . 3.750 2.361 2.131 2.819 . 0 0 "[ . 1 . 2]" 1
1231 1 66 PHE HB2 1 75 ILE HA . . 4.370 3.174 2.670 3.606 . 0 0 "[ . 1 . 2]" 1
1232 1 66 PHE HB2 1 75 ILE HG12 . . 5.040 3.337 2.549 4.115 . 0 0 "[ . 1 . 2]" 1
1233 1 66 PHE HB2 1 75 ILE MG . . 5.330 3.687 3.025 4.677 . 0 0 "[ . 1 . 2]" 1
1234 1 66 PHE HB3 1 67 LYS H . . 4.150 3.937 3.735 4.040 . 0 0 "[ . 1 . 2]" 1
1235 1 66 PHE HB3 1 73 VAL QG . . 4.750 3.473 3.190 3.798 . 0 0 "[ . 1 . 2]" 1
1236 1 66 PHE HB3 1 75 ILE HA . . 4.210 2.809 2.476 3.278 . 0 0 "[ . 1 . 2]" 1
1237 1 66 PHE HB3 1 75 ILE HB . . 5.310 5.150 4.893 5.374 0.064 2 0 "[ . 1 . 2]" 1
1238 1 66 PHE HB3 1 75 ILE MD . . 5.350 4.483 3.879 4.808 . 0 0 "[ . 1 . 2]" 1
1239 1 66 PHE HB3 1 75 ILE HG12 . . 4.840 3.397 2.831 3.882 . 0 0 "[ . 1 . 2]" 1
1240 1 66 PHE HB3 1 76 LYS H . . 4.970 3.787 3.449 4.290 . 0 0 "[ . 1 . 2]" 1
1241 1 66 PHE QR 1 73 VAL QG . . 4.340 2.722 2.094 3.342 . 0 0 "[ . 1 . 2]" 1
1242 1 66 PHE QD 1 68 ALA H . . 5.500 3.430 2.818 4.987 . 0 0 "[ . 1 . 2]" 1
1243 1 67 LYS H 1 67 LYS HB2 . . 4.130 3.143 2.827 3.417 . 0 0 "[ . 1 . 2]" 1
1244 1 67 LYS H 1 67 LYS HB3 . . 3.630 3.097 2.762 3.417 . 0 0 "[ . 1 . 2]" 1
1245 1 67 LYS H 1 73 VAL QG . . 3.500 2.766 2.414 3.498 . 0 0 "[ . 1 . 2]" 1
1246 1 67 LYS H 1 74 ILE HB . . 4.500 3.589 3.368 4.104 . 0 0 "[ . 1 . 2]" 1
1247 1 67 LYS H 1 75 ILE H . . 5.100 4.988 4.700 5.176 0.076 17 0 "[ . 1 . 2]" 1
1248 1 67 LYS H 1 75 ILE HA . . 4.550 3.844 3.575 4.235 . 0 0 "[ . 1 . 2]" 1
1249 1 67 LYS HA 1 67 LYS HD2 . . 4.050 3.766 2.146 4.634 0.584 14 2 "[ - . 1 +. 2]" 1
1250 1 67 LYS HA 1 67 LYS HD3 . . 4.880 3.969 3.324 4.676 . 0 0 "[ . 1 . 2]" 1
1251 1 67 LYS HA 1 67 LYS QE . . 4.690 3.513 1.915 4.785 0.095 6 0 "[ . 1 . 2]" 1
1252 1 67 LYS HA 1 67 LYS QG . . 3.800 2.396 2.002 3.075 . 0 0 "[ . 1 . 2]" 1
1253 1 67 LYS HA 1 68 ALA H . . 2.730 2.199 2.098 2.336 . 0 0 "[ . 1 . 2]" 1
1254 1 67 LYS HB2 1 67 LYS HD2 . . 4.090 3.027 2.388 4.172 0.082 4 0 "[ . 1 . 2]" 1
1255 1 67 LYS HB2 1 67 LYS HD3 . . 4.120 3.416 2.613 4.168 0.048 6 0 "[ . 1 . 2]" 1
1256 1 67 LYS HB2 1 67 LYS QE . . 4.740 3.894 3.416 4.224 . 0 0 "[ . 1 . 2]" 1
1257 1 67 LYS HB2 1 68 ALA H . . 4.640 4.458 4.110 4.690 0.050 17 0 "[ . 1 . 2]" 1
1258 1 67 LYS HB2 1 74 ILE HB . . 4.440 4.452 3.846 4.537 0.097 17 0 "[ . 1 . 2]" 1
1259 1 67 LYS HB2 1 74 ILE MG . . 5.500 5.399 4.975 5.585 0.085 17 0 "[ . 1 . 2]" 1
1260 1 67 LYS HB3 1 67 LYS QE . . 4.780 3.781 2.893 4.493 . 0 0 "[ . 1 . 2]" 1
1261 1 67 LYS HB3 1 68 ALA H . . 4.610 4.137 3.730 4.455 . 0 0 "[ . 1 . 2]" 1
1262 1 67 LYS HB3 1 74 ILE HB . . 4.470 3.574 2.963 4.533 0.063 16 0 "[ . 1 . 2]" 1
1263 1 67 LYS HD2 1 68 ALA H . . 4.860 4.837 3.820 5.838 0.978 15 5 "[ . * * - *+ 2]" 1
1264 1 67 LYS HD3 1 69 GLU HG2 . . 5.500 3.694 2.275 5.675 0.175 6 0 "[ . 1 . 2]" 1
1265 1 67 LYS QE 1 69 GLU HG2 . . 4.750 4.000 2.642 4.828 0.078 19 0 "[ . 1 . 2]" 1
1266 1 67 LYS QG 1 68 ALA H . . 4.160 3.154 2.290 4.071 . 0 0 "[ . 1 . 2]" 1
1267 1 68 ALA H 1 68 ALA MB . . 2.820 2.279 2.157 2.390 . 0 0 "[ . 1 . 2]" 1
1268 1 68 ALA H 1 73 VAL QG . . 4.630 3.368 3.064 3.818 . 0 0 "[ . 1 . 2]" 1
1269 1 68 ALA HA 1 69 GLU H . . 2.670 2.180 2.023 2.316 . 0 0 "[ . 1 . 2]" 1
1270 1 68 ALA HA 1 69 GLU HB2 . . 5.260 4.381 3.824 5.635 0.375 19 0 "[ . 1 . 2]" 1
1271 1 68 ALA HA 1 73 VAL HA . . 3.410 2.203 1.972 2.475 . 0 0 "[ . 1 . 2]" 1
1272 1 68 ALA HA 1 73 VAL HB . . 4.960 3.902 2.261 4.730 . 0 0 "[ . 1 . 2]" 1
1273 1 68 ALA HA 1 73 VAL QG . . 3.700 2.226 2.023 2.445 . 0 0 "[ . 1 . 2]" 1
1274 1 68 ALA HA 1 74 ILE H . . 4.060 3.846 3.633 4.149 0.089 17 0 "[ . 1 . 2]" 1
1275 1 68 ALA MB 1 69 GLU H . . 4.040 3.163 2.595 3.626 . 0 0 "[ . 1 . 2]" 1
1276 1 68 ALA MB 1 73 VAL HA . . 3.770 3.727 3.455 3.879 0.109 12 0 "[ . 1 . 2]" 1
1277 1 68 ALA MB 1 73 VAL QG . . 3.090 2.249 2.027 2.553 . 0 0 "[ . 1 . 2]" 1
1278 1 69 GLU H 1 69 GLU HB2 . . 3.640 2.532 2.180 3.689 0.049 19 0 "[ . 1 . 2]" 1
1279 1 69 GLU H 1 69 GLU HB3 . . 3.750 3.518 2.442 3.821 0.071 11 0 "[ . 1 . 2]" 1
1280 1 69 GLU H 1 69 GLU HG2 . . 4.490 3.673 2.545 4.487 . 0 0 "[ . 1 . 2]" 1
1281 1 69 GLU H 1 69 GLU HG3 . . 4.470 3.891 2.551 4.563 0.093 4 0 "[ . 1 . 2]" 1
1282 1 69 GLU H 1 72 THR H . . 4.600 3.534 2.999 4.668 0.068 9 0 "[ . 1 . 2]" 1
1283 1 69 GLU H 1 72 THR HB . . 4.490 3.962 3.509 4.530 0.040 10 0 "[ . 1 . 2]" 1
1284 1 69 GLU H 1 73 VAL H . . 5.140 4.779 4.323 5.119 . 0 0 "[ . 1 . 2]" 1
1285 1 69 GLU H 1 73 VAL QG . . 4.820 3.656 3.132 4.070 . 0 0 "[ . 1 . 2]" 1
1286 1 69 GLU HA 1 69 GLU HG2 . . 3.500 2.660 2.230 3.571 0.071 19 0 "[ . 1 . 2]" 1
1287 1 69 GLU HA 1 69 GLU HG3 . . 4.080 3.474 2.405 3.880 . 0 0 "[ . 1 . 2]" 1
1288 1 69 GLU HB2 1 72 THR HB . . 4.570 3.546 2.624 4.633 0.063 17 0 "[ . 1 . 2]" 1
1289 1 69 GLU HB2 1 74 ILE MD . . 4.870 3.219 2.101 4.750 . 0 0 "[ . 1 . 2]" 1
1290 1 69 GLU HB3 1 72 THR HB . . 4.830 4.301 2.510 4.917 0.087 9 0 "[ . 1 . 2]" 1
1291 1 69 GLU HG2 1 70 GLY H . . 5.500 4.609 2.235 5.413 . 0 0 "[ . 1 . 2]" 1
1292 1 69 GLU HG2 1 74 ILE MD . . 5.490 4.084 2.537 5.566 0.076 12 0 "[ . 1 . 2]" 1
1293 1 69 GLU HG3 1 74 ILE MD . . 5.220 3.325 2.054 4.881 . 0 0 "[ . 1 . 2]" 1
1294 1 70 GLY HA3 1 71 GLN QG . . 5.130 4.417 3.704 5.793 0.663 9 1 "[ . +1 . 2]" 1
1295 1 71 GLN HA 1 71 GLN QG . . 3.410 2.667 2.194 3.144 . 0 0 "[ . 1 . 2]" 1
1296 1 71 GLN HA 1 92 LEU H . . 3.910 3.158 2.619 3.596 . 0 0 "[ . 1 . 2]" 1
1297 1 71 GLN HA 1 92 LEU HB2 . . 4.370 2.626 2.297 3.161 . 0 0 "[ . 1 . 2]" 1
1298 1 71 GLN HA 1 92 LEU MD1 . . 3.450 2.163 2.017 2.597 . 0 0 "[ . 1 . 2]" 1
1299 1 71 GLN HA 1 92 LEU MD2 . . 4.450 4.110 3.635 4.542 0.092 19 0 "[ . 1 . 2]" 1
1300 1 71 GLN HA 1 92 LEU HG . . 4.090 2.633 1.976 3.319 . 0 0 "[ . 1 . 2]" 1
1301 1 71 GLN HA 1 93 SER H . . 4.820 4.731 3.977 4.912 0.092 9 0 "[ . 1 . 2]" 1
1302 1 71 GLN HB2 1 92 LEU H . . 4.930 4.770 3.518 5.010 0.080 10 0 "[ . 1 . 2]" 1
1303 1 71 GLN HB3 1 92 LEU H . . 4.480 3.593 2.026 4.200 . 0 0 "[ . 1 . 2]" 1
1304 1 71 GLN HE21 1 92 LEU HB2 . . 5.300 4.229 2.860 5.329 0.029 12 0 "[ . 1 . 2]" 1
1305 1 71 GLN HE21 1 92 LEU MD1 . . 4.660 3.159 2.464 4.225 . 0 0 "[ . 1 . 2]" 1
1306 1 71 GLN HE21 1 92 LEU MD2 . . 5.500 5.645 5.273 6.499 0.999 8 2 "[ . + 1 - . 2]" 1
1307 1 71 GLN HE22 1 71 GLN QG . . 3.800 3.350 3.231 3.583 . 0 0 "[ . 1 . 2]" 1
1308 1 72 THR H 1 72 THR HB . . 3.360 2.886 2.598 3.203 . 0 0 "[ . 1 . 2]" 1
1309 1 72 THR H 1 72 THR MG . . 4.150 3.925 3.609 4.069 . 0 0 "[ . 1 . 2]" 1
1310 1 72 THR H 1 73 VAL H . . 4.530 4.399 4.280 4.590 0.060 3 0 "[ . 1 . 2]" 1
1311 1 72 THR H 1 92 LEU H . . 4.010 4.083 4.024 4.108 0.098 3 0 "[ . 1 . 2]" 1
1312 1 72 THR H 1 92 LEU MD1 . . 5.160 4.136 3.377 5.268 0.108 9 0 "[ . 1 . 2]" 1
1313 1 72 THR H 1 92 LEU MD2 . . 5.500 4.794 4.282 5.597 0.097 3 0 "[ . 1 . 2]" 1
1314 1 72 THR HA 1 72 THR MG . . 2.990 2.333 2.209 2.500 . 0 0 "[ . 1 . 2]" 1
1315 1 72 THR HA 1 73 VAL H . . 2.930 2.322 2.134 2.516 . 0 0 "[ . 1 . 2]" 1
1316 1 72 THR HA 1 91 THR HA . . 2.750 2.047 1.946 2.183 . 0 0 "[ . 1 . 2]" 1
1317 1 72 THR HA 1 92 LEU H . . 3.210 3.017 2.456 3.298 0.088 9 0 "[ . 1 . 2]" 1
1318 1 72 THR HA 1 92 LEU HG . . 4.480 4.069 3.404 4.574 0.094 3 0 "[ . 1 . 2]" 1
1319 1 72 THR HB 1 73 VAL H . . 4.080 3.751 3.195 4.156 0.076 9 0 "[ . 1 . 2]" 1
1320 1 72 THR HB 1 74 ILE MD . . 4.830 3.320 2.598 4.113 . 0 0 "[ . 1 . 2]" 1
1321 1 72 THR HB 1 89 ALA MB . . 4.840 4.761 3.774 4.941 0.101 19 0 "[ . 1 . 2]" 1
1322 1 72 THR HB 1 91 THR HA . . 5.250 4.800 4.292 5.146 . 0 0 "[ . 1 . 2]" 1
1323 1 72 THR MG 1 73 VAL H . . 3.300 2.378 2.089 2.786 . 0 0 "[ . 1 . 2]" 1
1324 1 72 THR MG 1 74 ILE MD . . 4.040 2.763 2.007 3.493 . 0 0 "[ . 1 . 2]" 1
1325 1 72 THR MG 1 89 ALA HA . . 4.200 3.625 3.111 4.233 0.033 15 0 "[ . 1 . 2]" 1
1326 1 72 THR MG 1 89 ALA MB . . 3.240 2.559 1.938 2.942 . 0 0 "[ . 1 . 2]" 1
1327 1 72 THR MG 1 90 LEU H . . 3.700 3.176 2.736 3.744 0.044 20 0 "[ . 1 . 2]" 1
1328 1 72 THR MG 1 91 THR HA . . 3.890 3.046 2.443 3.635 . 0 0 "[ . 1 . 2]" 1
1329 1 73 VAL H 1 73 VAL HB . . 3.410 2.872 2.503 3.497 0.087 9 0 "[ . 1 . 2]" 1
1330 1 73 VAL H 1 73 VAL QG . . 3.570 2.735 2.212 3.127 . 0 0 "[ . 1 . 2]" 1
1331 1 73 VAL H 1 89 ALA HA . . 4.950 4.140 3.643 4.426 . 0 0 "[ . 1 . 2]" 1
1332 1 73 VAL H 1 89 ALA MB . . 5.500 4.274 3.571 4.780 . 0 0 "[ . 1 . 2]" 1
1333 1 73 VAL H 1 90 LEU H . . 3.830 2.703 2.095 3.260 . 0 0 "[ . 1 . 2]" 1
1334 1 73 VAL H 1 90 LEU QB . . 5.050 3.820 3.472 4.219 . 0 0 "[ . 1 . 2]" 1
1335 1 73 VAL H 1 91 THR HA . . 3.750 3.595 3.317 3.843 0.093 4 0 "[ . 1 . 2]" 1
1336 1 73 VAL H 1 91 THR MG . . 4.860 4.837 4.530 4.957 0.097 16 0 "[ . 1 . 2]" 1
1337 1 73 VAL H 1 92 LEU MD2 . . 5.330 5.015 4.457 5.425 0.095 5 0 "[ . 1 . 2]" 1
1338 1 73 VAL HA 1 73 VAL QG . . 3.310 2.241 2.132 2.505 . 0 0 "[ . 1 . 2]" 1
1339 1 73 VAL HA 1 74 ILE H . . 2.960 2.169 2.013 2.313 . 0 0 "[ . 1 . 2]" 1
1340 1 73 VAL HA 1 74 ILE MD . . 3.950 3.272 2.699 4.048 0.098 12 0 "[ . 1 . 2]" 1
1341 1 73 VAL HB 1 90 LEU H . . 4.200 3.902 3.266 4.311 0.111 9 0 "[ . 1 . 2]" 1
1342 1 73 VAL QG 1 74 ILE H . . 3.880 2.950 2.578 3.614 . 0 0 "[ . 1 . 2]" 1
1343 1 73 VAL QG 1 91 THR HA . . 4.940 4.378 3.448 4.880 . 0 0 "[ . 1 . 2]" 1
1344 1 73 VAL QG 1 92 LEU H . . 4.880 4.083 3.623 4.534 . 0 0 "[ . 1 . 2]" 1
1345 1 73 VAL QG 1 92 LEU HA . . 4.130 3.516 2.775 4.154 0.024 5 0 "[ . 1 . 2]" 1
1346 1 74 ILE H 1 74 ILE HB . . 3.080 2.509 2.228 2.674 . 0 0 "[ . 1 . 2]" 1
1347 1 74 ILE H 1 74 ILE MD . . 4.580 2.345 1.873 3.316 . 0 0 "[ . 1 . 2]" 1
1348 1 74 ILE H 1 74 ILE HG12 . . 3.820 3.531 2.299 3.924 0.104 15 0 "[ . 1 . 2]" 1
1349 1 74 ILE H 1 74 ILE HG13 . . 3.830 3.525 3.079 3.894 0.064 12 0 "[ . 1 . 2]" 1
1350 1 74 ILE H 1 74 ILE MG . . 3.890 3.783 3.687 3.847 . 0 0 "[ . 1 . 2]" 1
1351 1 74 ILE H 1 75 ILE H . . 4.350 4.179 3.900 4.326 . 0 0 "[ . 1 . 2]" 1
1352 1 74 ILE H 1 75 ILE HG13 . . 5.500 5.130 4.802 5.543 0.043 3 0 "[ . 1 . 2]" 1
1353 1 74 ILE HA 1 74 ILE MD . . 3.760 3.096 2.238 3.551 . 0 0 "[ . 1 . 2]" 1
1354 1 74 ILE HA 1 74 ILE HG12 . . 4.020 3.640 3.387 3.844 . 0 0 "[ . 1 . 2]" 1
1355 1 74 ILE HA 1 74 ILE HG13 . . 3.920 2.906 2.340 3.868 . 0 0 "[ . 1 . 2]" 1
1356 1 74 ILE HA 1 74 ILE MG . . 3.210 2.361 2.284 2.578 . 0 0 "[ . 1 . 2]" 1
1357 1 74 ILE HA 1 75 ILE H . . 2.860 2.192 2.129 2.251 . 0 0 "[ . 1 . 2]" 1
1358 1 74 ILE HA 1 75 ILE HG13 . . 4.910 4.004 3.769 4.371 . 0 0 "[ . 1 . 2]" 1
1359 1 74 ILE HA 1 89 ALA HA . . 3.260 2.250 2.043 2.495 . 0 0 "[ . 1 . 2]" 1
1360 1 74 ILE HA 1 89 ALA MB . . 3.740 3.014 2.665 3.323 . 0 0 "[ . 1 . 2]" 1
1361 1 74 ILE HA 1 90 LEU H . . 4.340 3.895 3.602 4.167 . 0 0 "[ . 1 . 2]" 1
1362 1 74 ILE HB 1 74 ILE MD . . 3.740 2.594 2.254 3.296 . 0 0 "[ . 1 . 2]" 1
1363 1 74 ILE HB 1 75 ILE H . . 4.360 4.407 4.287 4.448 0.088 3 0 "[ . 1 . 2]" 1
1364 1 74 ILE HB 1 89 ALA MB . . 5.070 4.890 4.648 5.157 0.087 5 0 "[ . 1 . 2]" 1
1365 1 74 ILE MD 1 74 ILE MG . . 3.530 2.980 2.173 3.296 . 0 0 "[ . 1 . 2]" 1
1366 1 74 ILE MD 1 76 LYS QE . . 5.200 5.097 4.612 5.311 0.111 16 0 "[ . 1 . 2]" 1
1367 1 74 ILE MD 1 89 ALA HA . . 4.260 3.891 2.648 4.347 0.087 8 0 "[ . 1 . 2]" 1
1368 1 74 ILE MD 1 89 ALA MB . . 3.740 3.200 2.010 3.844 0.104 1 0 "[ . 1 . 2]" 1
1369 1 74 ILE HG12 1 74 ILE MG . . 3.630 2.457 2.163 3.236 . 0 0 "[ . 1 . 2]" 1
1370 1 74 ILE HG12 1 89 ALA HA . . 5.120 5.124 4.591 5.370 0.250 3 0 "[ . 1 . 2]" 1
1371 1 74 ILE HG13 1 89 ALA HA . . 5.290 4.020 3.053 5.372 0.082 12 0 "[ . 1 . 2]" 1
1372 1 74 ILE MG 1 75 ILE H . . 3.440 3.301 3.057 3.538 0.098 17 0 "[ . 1 . 2]" 1
1373 1 74 ILE MG 1 75 ILE HA . . 4.920 4.271 4.028 4.503 . 0 0 "[ . 1 . 2]" 1
1374 1 74 ILE MG 1 76 LYS QE . . 4.110 2.287 1.813 2.677 . 0 0 "[ . 1 . 2]" 1
1375 1 74 ILE MG 1 87 ALA HA . . 4.890 3.437 2.598 3.981 . 0 0 "[ . 1 . 2]" 1
1376 1 74 ILE MG 1 88 LYS H . . 4.330 3.743 3.099 4.203 . 0 0 "[ . 1 . 2]" 1
1377 1 74 ILE MG 1 89 ALA HA . . 4.630 3.743 3.441 4.311 . 0 0 "[ . 1 . 2]" 1
1378 1 75 ILE H 1 75 ILE HB . . 3.360 2.709 2.404 2.866 . 0 0 "[ . 1 . 2]" 1
1379 1 75 ILE H 1 75 ILE MD . . 4.930 3.774 3.629 3.905 . 0 0 "[ . 1 . 2]" 1
1380 1 75 ILE H 1 75 ILE HG12 . . 4.560 3.390 3.141 3.642 . 0 0 "[ . 1 . 2]" 1
1381 1 75 ILE H 1 75 ILE HG13 . . 3.810 2.292 2.074 2.524 . 0 0 "[ . 1 . 2]" 1
1382 1 75 ILE H 1 75 ILE MG . . 4.470 3.843 3.724 3.915 . 0 0 "[ . 1 . 2]" 1
1383 1 75 ILE H 1 76 LYS HA . . 5.150 5.176 4.962 5.231 0.081 17 0 "[ . 1 . 2]" 1
1384 1 75 ILE H 1 88 LYS H . . 3.800 3.421 3.090 3.861 0.061 8 0 "[ . 1 . 2]" 1
1385 1 75 ILE H 1 88 LYS QB . . 4.870 3.564 3.074 4.254 . 0 0 "[ . 1 . 2]" 1
1386 1 75 ILE H 1 89 ALA HA . . 4.090 3.029 2.605 3.231 . 0 0 "[ . 1 . 2]" 1
1387 1 75 ILE H 1 89 ALA MB . . 4.670 4.259 3.869 4.559 . 0 0 "[ . 1 . 2]" 1
1388 1 75 ILE H 1 90 LEU QB . . 5.500 5.299 4.757 5.583 0.083 18 0 "[ . 1 . 2]" 1
1389 1 75 ILE H 1 90 LEU QD . . 5.480 4.126 3.465 4.757 . 0 0 "[ . 1 . 2]" 1
1390 1 75 ILE HA 1 75 ILE MD . . 4.380 3.960 3.850 4.050 . 0 0 "[ . 1 . 2]" 1
1391 1 75 ILE HA 1 75 ILE HG12 . . 4.080 2.772 2.545 2.927 . 0 0 "[ . 1 . 2]" 1
1392 1 75 ILE HA 1 75 ILE HG13 . . 4.080 3.368 3.240 3.553 . 0 0 "[ . 1 . 2]" 1
1393 1 75 ILE HA 1 75 ILE MG . . 3.320 2.277 2.160 2.513 . 0 0 "[ . 1 . 2]" 1
1394 1 75 ILE HA 1 76 LYS H . . 2.880 2.190 2.125 2.316 . 0 0 "[ . 1 . 2]" 1
1395 1 75 ILE HA 1 76 LYS HB2 . . 5.120 4.307 4.163 4.629 . 0 0 "[ . 1 . 2]" 1
1396 1 75 ILE HB 1 77 TYR QD . . 3.690 3.254 2.862 3.752 0.062 19 0 "[ . 1 . 2]" 1
1397 1 75 ILE HB 1 77 TYR QE . . 5.450 3.540 2.935 4.310 . 0 0 "[ . 1 . 2]" 1
1398 1 75 ILE HB 1 88 LYS H . . 4.200 3.521 2.912 4.243 0.043 12 0 "[ . 1 . 2]" 1
1399 1 75 ILE MD 1 75 ILE MG . . 2.850 2.066 2.009 2.105 . 0 0 "[ . 1 . 2]" 1
1400 1 75 ILE MD 1 77 TYR QD . . 5.280 4.407 4.064 4.721 . 0 0 "[ . 1 . 2]" 1
1401 1 75 ILE MD 1 88 LYS QB . . 4.240 3.069 2.430 3.499 . 0 0 "[ . 1 . 2]" 1
1402 1 75 ILE MD 1 88 LYS QG . . 4.310 3.083 2.178 4.433 0.123 9 0 "[ . 1 . 2]" 1
1403 1 75 ILE MD 1 89 ALA HA . . 4.970 5.002 4.573 5.069 0.099 13 0 "[ . 1 . 2]" 1
1404 1 75 ILE HG12 1 76 LYS H . . 5.090 4.786 4.580 4.987 . 0 0 "[ . 1 . 2]" 1
1405 1 75 ILE HG13 1 76 LYS H . . 5.490 5.312 5.176 5.487 . 0 0 "[ . 1 . 2]" 1
1406 1 75 ILE HG13 1 89 ALA HA . . 5.460 4.007 3.570 4.210 . 0 0 "[ . 1 . 2]" 1
1407 1 75 ILE HG13 1 90 LEU QB . . 4.100 3.941 3.434 4.193 0.093 18 0 "[ . 1 . 2]" 1
1408 1 75 ILE HG13 1 90 LEU QD . . 2.920 2.810 2.260 3.002 0.082 3 0 "[ . 1 . 2]" 1
1409 1 75 ILE MG 1 76 LYS H . . 3.330 2.605 2.298 2.935 . 0 0 "[ . 1 . 2]" 1
1410 1 75 ILE MG 1 77 TYR H . . 5.090 3.936 3.383 4.638 . 0 0 "[ . 1 . 2]" 1
1411 1 75 ILE MG 1 77 TYR HB3 . . 3.650 2.996 2.594 3.232 . 0 0 "[ . 1 . 2]" 1
1412 1 75 ILE MG 1 77 TYR QD . . 2.820 2.303 2.031 2.646 . 0 0 "[ . 1 . 2]" 1
1413 1 75 ILE MG 1 77 TYR QE . . 4.080 3.792 3.237 4.185 0.105 2 0 "[ . 1 . 2]" 1
1414 1 76 LYS H 1 76 LYS HB2 . . 3.900 2.520 2.287 2.717 . 0 0 "[ . 1 . 2]" 1
1415 1 76 LYS H 1 76 LYS HB3 . . 4.080 3.647 3.552 3.799 . 0 0 "[ . 1 . 2]" 1
1416 1 76 LYS H 1 76 LYS HG2 . . 4.810 4.240 3.919 4.637 . 0 0 "[ . 1 . 2]" 1
1417 1 76 LYS H 1 76 LYS HG3 . . 5.120 3.434 3.067 3.900 . 0 0 "[ . 1 . 2]" 1
1418 1 76 LYS H 1 77 TYR H . . 4.960 4.052 3.826 4.292 . 0 0 "[ . 1 . 2]" 1
1419 1 76 LYS HA 1 76 LYS HD2 . . 4.880 4.682 4.527 4.894 0.014 8 0 "[ . 1 . 2]" 1
1420 1 76 LYS HA 1 76 LYS HD3 . . 4.520 4.281 4.147 4.481 . 0 0 "[ . 1 . 2]" 1
1421 1 76 LYS HA 1 76 LYS QE . . 5.430 4.361 3.921 4.621 . 0 0 "[ . 1 . 2]" 1
1422 1 76 LYS HA 1 76 LYS HG2 . . 4.030 2.383 2.265 2.574 . 0 0 "[ . 1 . 2]" 1
1423 1 76 LYS HA 1 76 LYS HG3 . . 3.470 2.998 2.577 3.235 . 0 0 "[ . 1 . 2]" 1
1424 1 76 LYS HA 1 77 TYR H . . 3.000 2.283 2.212 2.362 . 0 0 "[ . 1 . 2]" 1
1425 1 76 LYS HA 1 77 TYR QD . . 4.160 3.721 3.289 4.225 0.065 10 0 "[ . 1 . 2]" 1
1426 1 76 LYS HA 1 85 LEU HB3 . . 4.790 2.923 2.664 3.314 . 0 0 "[ . 1 . 2]" 1
1427 1 76 LYS HA 1 86 LYS H . . 4.640 3.996 3.566 4.399 . 0 0 "[ . 1 . 2]" 1
1428 1 76 LYS HB2 1 77 TYR H . . 5.020 4.616 4.466 4.694 . 0 0 "[ . 1 . 2]" 1
1429 1 76 LYS HB2 1 85 LEU HB3 . . 3.780 3.859 3.848 3.872 0.092 5 0 "[ . 1 . 2]" 1
1430 1 76 LYS HB2 1 85 LEU QD . . 4.410 3.593 2.728 4.141 . 0 0 "[ . 1 . 2]" 1
1431 1 76 LYS HB3 1 77 TYR H . . 5.250 3.950 3.562 4.215 . 0 0 "[ . 1 . 2]" 1
1432 1 76 LYS HB3 1 85 LEU QD . . 4.390 2.666 1.975 3.111 . 0 0 "[ . 1 . 2]" 1
1433 1 76 LYS HD2 1 85 LEU QD . . 5.320 3.954 3.155 4.849 . 0 0 "[ . 1 . 2]" 1
1434 1 76 LYS HD3 1 85 LEU QD . . 4.920 2.862 2.202 3.909 . 0 0 "[ . 1 . 2]" 1
1435 1 76 LYS QE 1 87 ALA MB . . 4.030 3.592 2.761 4.140 0.110 4 0 "[ . 1 . 2]" 1
1436 1 76 LYS HG3 1 77 TYR H . . 5.390 5.232 4.781 5.477 0.087 13 0 "[ . 1 . 2]" 1
1437 1 77 TYR H 1 77 TYR QD . . 2.820 2.626 2.269 2.899 0.079 4 0 "[ . 1 . 2]" 1
1438 1 77 TYR H 1 77 TYR QE . . 4.010 3.919 3.746 4.103 0.093 10 0 "[ . 1 . 2]" 1
1439 1 77 TYR H 1 85 LEU HA . . 4.490 4.192 3.828 4.537 0.047 7 0 "[ . 1 . 2]" 1
1440 1 77 TYR H 1 85 LEU HB2 . . 4.970 4.725 4.411 5.032 0.062 12 0 "[ . 1 . 2]" 1
1441 1 77 TYR H 1 85 LEU HB3 . . 4.440 3.091 2.756 3.441 . 0 0 "[ . 1 . 2]" 1
1442 1 77 TYR H 1 85 LEU QD . . 4.230 3.788 3.256 4.165 . 0 0 "[ . 1 . 2]" 1
1443 1 77 TYR H 1 86 LYS H . . 3.610 2.844 2.539 3.333 . 0 0 "[ . 1 . 2]" 1
1444 1 77 TYR H 1 86 LYS HB2 . . 4.100 2.792 2.508 3.095 . 0 0 "[ . 1 . 2]" 1
1445 1 77 TYR H 1 86 LYS HB3 . . 4.950 4.058 3.718 4.408 . 0 0 "[ . 1 . 2]" 1
1446 1 77 TYR HA 1 77 TYR QD . . 4.320 3.728 3.690 3.761 . 0 0 "[ . 1 . 2]" 1
1447 1 77 TYR HA 1 78 THR H . . 2.940 2.481 2.390 2.605 . 0 0 "[ . 1 . 2]" 1
1448 1 77 TYR HA 1 78 THR MG . . 4.370 3.470 2.960 3.893 . 0 0 "[ . 1 . 2]" 1
1449 1 77 TYR HA 1 85 LEU QD . . 3.880 2.919 2.516 3.467 . 0 0 "[ . 1 . 2]" 1
1450 1 77 TYR HB2 1 78 THR H . . 3.600 2.415 2.304 2.545 . 0 0 "[ . 1 . 2]" 1
1451 1 77 TYR HB2 1 78 THR MG . . 4.730 4.486 4.130 4.795 0.065 1 0 "[ . 1 . 2]" 1
1452 1 77 TYR HB3 1 78 THR H . . 3.870 3.755 3.662 3.906 0.036 11 0 "[ . 1 . 2]" 1
1453 1 77 TYR QD 1 78 THR H . . 3.450 3.407 2.988 3.529 0.079 15 0 "[ . 1 . 2]" 1
1454 1 77 TYR QD 1 78 THR HA . . 3.850 3.492 3.112 3.924 0.074 11 0 "[ . 1 . 2]" 1
1455 1 77 TYR QD 1 86 LYS HB2 . . 5.220 3.355 3.007 3.612 . 0 0 "[ . 1 . 2]" 1
1456 1 77 TYR QD 1 86 LYS HB3 . . 5.490 4.353 4.057 4.633 . 0 0 "[ . 1 . 2]" 1
1457 1 77 TYR QD 1 86 LYS HD3 . . 5.500 3.141 2.594 3.892 . 0 0 "[ . 1 . 2]" 1
1458 1 77 TYR QD 1 88 LYS H . . 5.320 4.483 3.908 5.066 . 0 0 "[ . 1 . 2]" 1
1459 1 77 TYR QD 1 88 LYS QB . . 5.080 3.622 3.205 4.006 . 0 0 "[ . 1 . 2]" 1
1460 1 77 TYR QE 1 86 LYS HB2 . . 4.550 3.146 2.730 3.318 . 0 0 "[ . 1 . 2]" 1
1461 1 77 TYR QE 1 86 LYS HB3 . . 4.820 3.332 2.905 3.653 . 0 0 "[ . 1 . 2]" 1
1462 1 77 TYR QE 1 86 LYS HD2 . . 4.660 4.597 4.297 4.741 0.081 9 0 "[ . 1 . 2]" 1
1463 1 77 TYR QE 1 86 LYS HD3 . . 4.640 3.174 2.738 3.564 . 0 0 "[ . 1 . 2]" 1
1464 1 77 TYR QE 1 86 LYS HG3 . . 5.500 4.304 3.996 4.748 . 0 0 "[ . 1 . 2]" 1
1465 1 77 TYR QE 1 87 ALA H . . 4.670 4.612 4.246 4.759 0.089 4 0 "[ . 1 . 2]" 1
1466 1 77 TYR QE 1 88 LYS H . . 3.960 3.565 2.814 4.046 0.086 12 0 "[ . 1 . 2]" 1
1467 1 77 TYR QE 1 88 LYS QB . . 3.120 2.137 1.880 3.184 0.064 2 0 "[ . 1 . 2]" 1
1468 1 77 TYR QE 1 88 LYS QD . . 4.640 3.790 2.966 4.602 . 0 0 "[ . 1 . 2]" 1
1469 1 77 TYR QE 1 88 LYS QE . . 4.700 4.210 2.959 4.777 0.077 9 0 "[ . 1 . 2]" 1
1470 1 77 TYR QE 1 88 LYS QG . . 4.200 3.275 2.066 3.977 . 0 0 "[ . 1 . 2]" 1
1471 1 78 THR H 1 78 THR HB . . 4.130 3.393 3.214 3.599 . 0 0 "[ . 1 . 2]" 1
1472 1 78 THR H 1 78 THR MG . . 3.290 2.492 2.168 2.676 . 0 0 "[ . 1 . 2]" 1
1473 1 78 THR HA 1 79 SER H . . 3.180 2.457 2.338 2.682 . 0 0 "[ . 1 . 2]" 1
1474 1 78 THR HA 1 80 GLN H . . 3.780 3.843 3.760 3.872 0.092 13 0 "[ . 1 . 2]" 1
1475 1 78 THR HA 1 85 LEU QD . . 4.690 3.869 3.478 4.400 . 0 0 "[ . 1 . 2]" 1
1476 1 78 THR HB 1 79 SER H . . 3.930 3.779 3.520 3.913 . 0 0 "[ . 1 . 2]" 1
1477 1 78 THR HB 1 80 GLN H . . 3.990 3.975 3.796 4.072 0.082 13 0 "[ . 1 . 2]" 1
1478 1 78 THR HB 1 85 LEU HA . . 3.570 2.458 2.162 2.735 . 0 0 "[ . 1 . 2]" 1
1479 1 78 THR HB 1 85 LEU HB2 . . 5.130 5.147 4.839 5.214 0.084 8 0 "[ . 1 . 2]" 1
1480 1 78 THR HB 1 85 LEU QD . . 3.270 2.106 1.929 2.557 . 0 0 "[ . 1 . 2]" 1
1481 1 78 THR HB 1 85 LEU HG . . 4.990 4.485 3.271 5.038 0.048 1 0 "[ . 1 . 2]" 1
1482 1 78 THR HB 1 86 LYS H . . 4.230 3.896 3.378 4.217 . 0 0 "[ . 1 . 2]" 1
1483 1 78 THR MG 1 79 SER H . . 4.980 3.358 2.983 3.784 . 0 0 "[ . 1 . 2]" 1
1484 1 78 THR MG 1 80 GLN H . . 3.800 2.492 2.240 2.683 . 0 0 "[ . 1 . 2]" 1
1485 1 78 THR MG 1 80 GLN HA . . 4.180 3.972 3.556 4.271 0.091 8 0 "[ . 1 . 2]" 1
1486 1 78 THR MG 1 81 ARG HA . . 3.590 3.004 2.537 3.628 0.038 12 0 "[ . 1 . 2]" 1
1487 1 78 THR MG 1 85 LEU HA . . 4.260 3.906 3.529 4.292 0.032 4 0 "[ . 1 . 2]" 1
1488 1 78 THR MG 1 85 LEU QD . . 2.670 2.227 2.017 2.545 . 0 0 "[ . 1 . 2]" 1
1489 1 79 SER H 1 80 GLN H . . 3.260 2.066 1.610 2.395 . 0 0 "[ . 1 . 2]" 1
1490 1 79 SER HA 1 80 GLN H . . 3.250 3.285 3.014 3.338 0.088 6 0 "[ . 1 . 2]" 1
1491 1 79 SER HB2 1 80 GLN H . . 4.910 4.119 3.452 4.436 . 0 0 "[ . 1 . 2]" 1
1492 1 79 SER HB2 1 80 GLN QG . . 5.200 3.793 2.731 4.606 . 0 0 "[ . 1 . 2]" 1
1493 1 79 SER HB3 1 80 GLN H . . 4.370 4.472 4.330 4.665 0.295 9 0 "[ . 1 . 2]" 1
1494 1 79 SER HB3 1 80 GLN QG . . 5.260 4.988 4.200 5.353 0.093 8 0 "[ . 1 . 2]" 1
1495 1 80 GLN H 1 80 GLN HB2 . . 4.060 2.931 2.608 3.763 . 0 0 "[ . 1 . 2]" 1
1496 1 80 GLN H 1 80 GLN QG . . 3.890 3.527 2.295 3.952 0.062 8 0 "[ . 1 . 2]" 1
1497 1 80 GLN HA 1 80 GLN QG . . 3.570 2.437 2.133 3.112 . 0 0 "[ . 1 . 2]" 1
1498 1 80 GLN HA 1 81 ARG H . . 3.090 2.194 1.745 2.717 . 0 0 "[ . 1 . 2]" 1
1499 1 80 GLN HB2 1 80 GLN HE22 . . 5.500 4.721 4.176 5.481 . 0 0 "[ . 1 . 2]" 1
1500 1 80 GLN HB2 1 81 ARG H . . 4.490 4.079 2.977 4.538 0.048 16 0 "[ . 1 . 2]" 1
1501 1 80 GLN HB2 1 83 THR HB . . 5.120 4.407 3.971 5.068 . 0 0 "[ . 1 . 2]" 1
1502 1 80 GLN HB2 1 83 THR MG . . 4.070 2.688 2.130 3.212 . 0 0 "[ . 1 . 2]" 1
1503 1 80 GLN HB3 1 81 ARG H . . 4.600 3.064 2.044 3.795 . 0 0 "[ . 1 . 2]" 1
1504 1 80 GLN HB3 1 82 ASN H . . 5.120 2.749 1.980 4.576 . 0 0 "[ . 1 . 2]" 1
1505 1 80 GLN HB3 1 83 THR H . . 4.780 3.939 3.207 4.869 0.089 1 0 "[ . 1 . 2]" 1
1506 1 80 GLN HB3 1 83 THR MG . . 4.090 3.161 2.212 4.155 0.065 7 0 "[ . 1 . 2]" 1
1507 1 80 GLN QG 1 81 ARG H . . 4.000 3.846 2.243 4.127 0.127 1 0 "[ . 1 . 2]" 1
1508 1 80 GLN QG 1 82 ASN H . . 5.450 4.433 3.905 4.990 . 0 0 "[ . 1 . 2]" 1
1509 1 80 GLN QG 1 82 ASN HD21 . . 5.010 4.763 3.587 5.118 0.108 8 0 "[ . 1 . 2]" 1
1510 1 81 ARG H 1 81 ARG HB2 . . 3.550 2.371 1.982 3.566 0.016 8 0 "[ . 1 . 2]" 1
1511 1 81 ARG H 1 81 ARG HB3 . . 3.150 2.934 2.442 3.582 0.432 7 0 "[ . 1 . 2]" 1
1512 1 81 ARG H 1 81 ARG QD . . 4.780 4.228 2.435 4.796 0.016 19 0 "[ . 1 . 2]" 1
1513 1 81 ARG H 1 81 ARG QG . . 4.300 3.521 2.009 4.104 . 0 0 "[ . 1 . 2]" 1
1514 1 81 ARG H 1 82 ASN H . . 3.980 2.767 2.372 2.985 . 0 0 "[ . 1 . 2]" 1
1515 1 81 ARG H 1 83 THR H . . 4.800 4.609 4.155 4.887 0.087 20 0 "[ . 1 . 2]" 1
1516 1 81 ARG HA 1 81 ARG QD . . 3.620 3.235 2.127 3.724 0.104 5 0 "[ . 1 . 2]" 1
1517 1 81 ARG HA 1 81 ARG QG . . 3.400 2.480 2.076 3.479 0.079 8 0 "[ . 1 . 2]" 1
1518 1 81 ARG HA 1 82 ASN H . . 3.390 3.410 3.126 3.477 0.087 11 0 "[ . 1 . 2]" 1
1519 1 81 ARG HA 1 83 THR H . . 4.780 3.946 3.511 4.860 0.080 12 0 "[ . 1 . 2]" 1
1520 1 81 ARG HB2 1 81 ARG QG . . 2.710 2.293 2.069 2.493 . 0 0 "[ . 1 . 2]" 1
1521 1 81 ARG HB2 1 82 ASN H . . 4.470 3.715 2.769 4.377 . 0 0 "[ . 1 . 2]" 1
1522 1 81 ARG HB3 1 82 ASN H . . 4.050 3.233 2.242 4.296 0.246 6 0 "[ . 1 . 2]" 1
1523 1 81 ARG HB3 1 82 ASN HA . . 5.500 4.469 4.089 5.575 0.075 8 0 "[ . 1 . 2]" 1
1524 1 81 ARG HB3 1 82 ASN HD21 . . 5.500 4.479 2.732 6.102 0.602 6 1 "[ .+ 1 . 2]" 1
1525 1 81 ARG QG 1 82 ASN H . . 4.530 4.093 1.988 4.629 0.099 6 0 "[ . 1 . 2]" 1
1526 1 82 ASN H 1 82 ASN HB2 . . 3.820 3.417 2.310 3.972 0.152 6 0 "[ . 1 . 2]" 1
1527 1 82 ASN H 1 82 ASN QB . . 3.620 2.738 2.283 3.157 . 0 0 "[ . 1 . 2]" 1
1528 1 82 ASN H 1 82 ASN HB3 . . 3.890 3.129 2.510 3.857 . 0 0 "[ . 1 . 2]" 1
1529 1 82 ASN H 1 83 THR H . . 3.660 2.820 2.167 3.655 . 0 0 "[ . 1 . 2]" 1
1530 1 82 ASN H 1 83 THR HA . . 5.460 5.196 4.773 5.539 0.079 7 0 "[ . 1 . 2]" 1
1531 1 82 ASN HA 1 82 ASN HD21 . . 3.540 3.625 3.612 3.637 0.097 16 0 "[ . 1 . 2]" 1
1532 1 82 ASN HA 1 83 THR H . . 3.060 3.077 2.632 3.159 0.099 11 0 "[ . 1 . 2]" 1
1533 1 82 ASN QB 1 83 THR H . . 5.030 3.948 3.437 4.183 . 0 0 "[ . 1 . 2]" 1
1534 1 82 ASN HB2 1 82 ASN HD22 . . 4.060 3.862 3.343 4.143 0.083 5 0 "[ . 1 . 2]" 1
1535 1 82 ASN HB2 1 83 THR H . . 5.090 4.349 3.731 4.629 . 0 0 "[ . 1 . 2]" 1
1536 1 82 ASN HB2 1 83 THR MG . . 5.500 3.926 2.837 4.695 . 0 0 "[ . 1 . 2]" 1
1537 1 82 ASN HB3 1 83 THR H . . 5.050 4.538 4.022 4.768 . 0 0 "[ . 1 . 2]" 1
1538 1 82 ASN HB3 1 83 THR MG . . 4.640 4.507 2.907 5.370 0.730 3 2 "[ + . 1 - . 2]" 1
1539 1 82 ASN HD21 1 83 THR MG . . 5.320 3.850 1.827 5.410 0.090 19 0 "[ . 1 . 2]" 1
1540 1 83 THR H 1 83 THR HB . . 3.880 3.842 3.595 3.951 0.071 8 0 "[ . 1 . 2]" 1
1541 1 83 THR H 1 83 THR MG . . 4.030 3.091 2.752 3.581 . 0 0 "[ . 1 . 2]" 1
1542 1 83 THR HA 1 83 THR MG . . 3.140 2.336 2.210 2.491 . 0 0 "[ . 1 . 2]" 1
1543 1 83 THR HA 1 84 LYS H . . 3.110 2.398 2.124 2.843 . 0 0 "[ . 1 . 2]" 1
1544 1 83 THR HA 1 84 LYS QB . . 4.460 4.160 3.898 4.426 . 0 0 "[ . 1 . 2]" 1
1545 1 83 THR HB 1 84 LYS H . . 3.320 2.449 1.825 3.145 . 0 0 "[ . 1 . 2]" 1
1546 1 83 THR HB 1 84 LYS QB . . 4.770 4.121 3.635 4.676 . 0 0 "[ . 1 . 2]" 1
1547 1 83 THR MG 1 84 LYS H . . 3.870 3.601 3.169 3.944 0.074 15 0 "[ . 1 . 2]" 1
1548 1 84 LYS H 1 84 LYS QB . . 2.860 2.213 2.034 2.443 . 0 0 "[ . 1 . 2]" 1
1549 1 84 LYS H 1 84 LYS QD . . 4.570 4.344 3.755 4.583 0.013 2 0 "[ . 1 . 2]" 1
1550 1 84 LYS HA 1 84 LYS QG . . 3.650 2.657 2.183 3.408 . 0 0 "[ . 1 . 2]" 1
1551 1 84 LYS HA 1 85 LEU H . . 2.550 2.316 2.088 2.496 . 0 0 "[ . 1 . 2]" 1
1552 1 84 LYS QE 1 84 LYS QG . . 3.310 2.267 2.049 2.796 . 0 0 "[ . 1 . 2]" 1
1553 1 84 LYS QE 1 85 LEU HA . . 5.120 4.738 4.107 5.124 0.004 13 0 "[ . 1 . 2]" 1
1554 1 84 LYS QE 1 85 LEU HB2 . . 3.260 3.273 2.497 3.370 0.110 1 0 "[ . 1 . 2]" 1
1555 1 84 LYS QG 1 85 LEU H . . 3.370 2.571 1.764 3.452 0.082 15 0 "[ . 1 . 2]" 1
1556 1 85 LEU H 1 85 LEU HB2 . . 3.430 2.456 2.253 2.627 . 0 0 "[ . 1 . 2]" 1
1557 1 85 LEU H 1 85 LEU HB3 . . 3.910 3.604 3.540 3.701 . 0 0 "[ . 1 . 2]" 1
1558 1 85 LEU H 1 85 LEU QD . . 3.780 2.408 1.862 3.158 . 0 0 "[ . 1 . 2]" 1
1559 1 85 LEU HA 1 85 LEU QD . . 3.090 2.212 2.052 2.511 . 0 0 "[ . 1 . 2]" 1
1560 1 85 LEU HA 1 85 LEU HG . . 3.940 3.511 2.704 3.816 . 0 0 "[ . 1 . 2]" 1
1561 1 85 LEU HA 1 86 LYS H . . 2.800 2.249 2.118 2.352 . 0 0 "[ . 1 . 2]" 1
1562 1 85 LEU HA 1 86 LYS HD2 . . 3.910 3.781 3.406 4.634 0.724 18 1 "[ . 1 . + 2]" 1
1563 1 85 LEU HB2 1 86 LYS H . . 4.230 3.856 3.584 4.058 . 0 0 "[ . 1 . 2]" 1
1564 1 85 LEU HB3 1 85 LEU QD . . 2.770 2.398 2.158 2.563 . 0 0 "[ . 1 . 2]" 1
1565 1 85 LEU HB3 1 86 LYS H . . 4.010 2.830 2.472 3.085 . 0 0 "[ . 1 . 2]" 1
1566 1 85 LEU QD 1 86 LYS H . . 3.890 3.571 3.330 3.756 . 0 0 "[ . 1 . 2]" 1
1567 1 86 LYS H 1 86 LYS HB2 . . 3.330 2.214 2.090 2.430 . 0 0 "[ . 1 . 2]" 1
1568 1 86 LYS H 1 86 LYS HB3 . . 3.850 3.479 3.383 3.641 . 0 0 "[ . 1 . 2]" 1
1569 1 86 LYS H 1 86 LYS HD2 . . 4.980 2.710 2.236 3.539 . 0 0 "[ . 1 . 2]" 1
1570 1 86 LYS H 1 86 LYS HD3 . . 5.090 2.847 2.467 3.380 . 0 0 "[ . 1 . 2]" 1
1571 1 86 LYS H 1 86 LYS QE . . 4.670 4.462 4.203 4.713 0.043 12 0 "[ . 1 . 2]" 1
1572 1 86 LYS H 1 86 LYS HG2 . . 4.270 4.127 3.980 4.318 0.048 4 0 "[ . 1 . 2]" 1
1573 1 86 LYS H 1 86 LYS HG3 . . 4.230 3.845 3.452 4.260 0.030 18 0 "[ . 1 . 2]" 1
1574 1 86 LYS HA 1 86 LYS HD2 . . 4.260 3.074 2.524 3.647 . 0 0 "[ . 1 . 2]" 1
1575 1 86 LYS HA 1 86 LYS HD3 . . 4.850 3.991 3.320 4.407 . 0 0 "[ . 1 . 2]" 1
1576 1 86 LYS HA 1 86 LYS HG2 . . 3.690 3.634 3.558 3.704 0.014 17 0 "[ . 1 . 2]" 1
1577 1 86 LYS HA 1 86 LYS HG3 . . 3.180 2.403 2.328 2.493 . 0 0 "[ . 1 . 2]" 1
1578 1 86 LYS HA 1 87 ALA H . . 2.730 2.581 2.414 2.787 0.057 10 0 "[ . 1 . 2]" 1
1579 1 86 LYS HA 1 87 ALA HA . . 5.130 4.585 4.534 4.657 . 0 0 "[ . 1 . 2]" 1
1580 1 86 LYS HA 1 87 ALA MB . . 4.200 3.957 3.679 4.116 . 0 0 "[ . 1 . 2]" 1
1581 1 86 LYS HB2 1 86 LYS HD2 . . 3.750 3.131 2.890 3.399 . 0 0 "[ . 1 . 2]" 1
1582 1 86 LYS HB2 1 86 LYS HD3 . . 3.920 2.460 2.318 2.589 . 0 0 "[ . 1 . 2]" 1
1583 1 86 LYS HB2 1 86 LYS QE . . 4.950 3.966 3.771 4.251 . 0 0 "[ . 1 . 2]" 1
1584 1 86 LYS HB2 1 87 ALA H . . 4.160 3.594 3.350 3.758 . 0 0 "[ . 1 . 2]" 1
1585 1 86 LYS HB2 1 87 ALA HA . . 5.010 4.886 4.644 5.278 0.268 4 0 "[ . 1 . 2]" 1
1586 1 86 LYS HB2 1 87 ALA MB . . 5.230 5.288 5.082 5.445 0.215 18 0 "[ . 1 . 2]" 1
1587 1 86 LYS HB3 1 86 LYS HD3 . . 3.620 3.625 3.519 3.713 0.093 4 0 "[ . 1 . 2]" 1
1588 1 86 LYS HB3 1 87 ALA H . . 3.690 2.214 2.021 2.394 . 0 0 "[ . 1 . 2]" 1
1589 1 86 LYS HD2 1 86 LYS HG3 . . 2.930 2.437 2.336 2.545 . 0 0 "[ . 1 . 2]" 1
1590 1 86 LYS HD3 1 87 ALA H . . 5.500 5.479 5.116 5.588 0.088 5 0 "[ . 1 . 2]" 1
1591 1 86 LYS HG2 1 87 ALA H . . 4.730 4.199 3.829 4.385 . 0 0 "[ . 1 . 2]" 1
1592 1 86 LYS HG3 1 87 ALA H . . 4.570 3.630 3.052 4.119 . 0 0 "[ . 1 . 2]" 1
1593 1 87 ALA H 1 87 ALA MB . . 3.090 2.587 2.424 2.770 . 0 0 "[ . 1 . 2]" 1
1594 1 87 ALA H 1 88 LYS H . . 4.940 3.927 2.993 4.506 . 0 0 "[ . 1 . 2]" 1
1595 1 87 ALA HA 1 88 LYS H . . 2.780 2.242 2.127 2.576 . 0 0 "[ . 1 . 2]" 1
1596 1 87 ALA HA 1 88 LYS HA . . 4.630 4.486 4.311 4.702 0.072 8 0 "[ . 1 . 2]" 1
1597 1 87 ALA HA 1 88 LYS QB . . 4.780 4.258 4.058 4.508 . 0 0 "[ . 1 . 2]" 1
1598 1 87 ALA MB 1 88 LYS H . . 3.770 3.431 2.764 3.750 . 0 0 "[ . 1 . 2]" 1
1599 1 88 LYS H 1 88 LYS QB . . 3.420 2.479 2.074 3.015 . 0 0 "[ . 1 . 2]" 1
1600 1 88 LYS H 1 88 LYS QG . . 4.490 4.007 3.469 4.330 . 0 0 "[ . 1 . 2]" 1
1601 1 88 LYS H 1 89 ALA H . . 5.340 4.122 3.609 4.509 . 0 0 "[ . 1 . 2]" 1
1602 1 88 LYS HA 1 88 LYS QD . . 3.570 3.035 2.532 3.677 0.107 9 0 "[ . 1 . 2]" 1
1603 1 88 LYS HA 1 88 LYS QG . . 3.510 2.635 2.072 3.111 . 0 0 "[ . 1 . 2]" 1
1604 1 88 LYS HA 1 89 ALA H . . 2.820 2.279 2.202 2.388 . 0 0 "[ . 1 . 2]" 1
1605 1 88 LYS HA 1 90 LEU QD . . 5.000 3.956 3.561 4.494 . 0 0 "[ . 1 . 2]" 1
1606 1 88 LYS QB 1 88 LYS QE . . 4.290 3.311 2.375 3.610 . 0 0 "[ . 1 . 2]" 1
1607 1 88 LYS QB 1 89 ALA H . . 4.120 3.788 2.610 4.122 0.002 11 0 "[ . 1 . 2]" 1
1608 1 88 LYS QB 1 90 LEU QD . . 4.470 3.159 2.042 3.791 . 0 0 "[ . 1 . 2]" 1
1609 1 88 LYS QD 1 89 ALA H . . 4.660 3.997 3.122 4.727 0.067 1 0 "[ . 1 . 2]" 1
1610 1 88 LYS QD 1 89 ALA MB . . 5.500 5.448 5.007 5.627 0.127 1 0 "[ . 1 . 2]" 1
1611 1 88 LYS QD 1 90 LEU QD . . 4.060 2.496 1.802 3.373 . 0 0 "[ . 1 . 2]" 1
1612 1 88 LYS QE 1 90 LEU QD . . 4.020 2.424 1.747 3.338 . 0 0 "[ . 1 . 2]" 1
1613 1 88 LYS QE 1 90 LEU HG . . 5.060 4.230 3.237 5.130 0.070 14 0 "[ . 1 . 2]" 1
1614 1 88 LYS QG 1 89 ALA H . . 3.910 3.423 2.454 3.991 0.081 6 0 "[ . 1 . 2]" 1
1615 1 88 LYS QG 1 90 LEU QD . . 4.130 2.391 1.869 3.464 . 0 0 "[ . 1 . 2]" 1
1616 1 89 ALA H 1 89 ALA MB . . 3.100 2.462 2.266 2.756 . 0 0 "[ . 1 . 2]" 1
1617 1 89 ALA H 1 90 LEU H . . 4.650 4.303 3.532 4.717 0.067 11 0 "[ . 1 . 2]" 1
1618 1 89 ALA H 1 90 LEU QD . . 5.500 3.486 2.572 4.525 . 0 0 "[ . 1 . 2]" 1
1619 1 89 ALA HA 1 90 LEU H . . 2.740 2.289 2.132 2.560 . 0 0 "[ . 1 . 2]" 1
1620 1 89 ALA HA 1 90 LEU QB . . 4.980 4.410 4.177 4.657 . 0 0 "[ . 1 . 2]" 1
1621 1 89 ALA HA 1 90 LEU QD . . 4.970 3.774 3.178 4.459 . 0 0 "[ . 1 . 2]" 1
1622 1 89 ALA MB 1 90 LEU H . . 3.510 3.265 2.936 3.577 0.067 20 0 "[ . 1 . 2]" 1
1623 1 89 ALA MB 1 90 LEU HA . . 5.440 4.227 3.947 4.428 . 0 0 "[ . 1 . 2]" 1
1624 1 90 LEU H 1 90 LEU QB . . 3.260 2.561 2.269 2.771 . 0 0 "[ . 1 . 2]" 1
1625 1 90 LEU H 1 90 LEU QD . . 4.270 3.091 2.430 3.643 . 0 0 "[ . 1 . 2]" 1
1626 1 90 LEU HA 1 90 LEU QD . . 2.980 2.202 2.070 2.326 . 0 0 "[ . 1 . 2]" 1
1627 1 90 LEU HA 1 91 THR H . . 2.850 2.369 2.167 2.628 . 0 0 "[ . 1 . 2]" 1
1628 1 90 LEU QB 1 91 THR H . . 3.710 2.790 2.247 3.225 . 0 0 "[ . 1 . 2]" 1
1629 1 90 LEU QB 1 94 GLN HB2 . . 4.620 3.036 2.305 4.400 . 0 0 "[ . 1 . 2]" 1
1630 1 90 LEU QB 1 94 GLN HB3 . . 4.850 2.750 2.308 3.352 . 0 0 "[ . 1 . 2]" 1
1631 1 90 LEU QD 1 91 THR H . . 3.950 3.600 3.270 3.862 . 0 0 "[ . 1 . 2]" 1
1632 1 90 LEU QD 1 94 GLN HB2 . . 5.370 3.842 3.151 4.626 . 0 0 "[ . 1 . 2]" 1
1633 1 90 LEU QD 1 94 GLN HB3 . . 5.250 3.284 2.609 3.958 . 0 0 "[ . 1 . 2]" 1
1634 1 90 LEU QD 1 94 GLN QE . . 4.830 3.926 2.794 4.505 . 0 0 "[ . 1 . 2]" 1
1635 1 90 LEU QD 1 94 GLN HG2 . . 5.500 3.572 2.246 5.201 . 0 0 "[ . 1 . 2]" 1
1636 1 91 THR H 1 91 THR MG . . 3.190 2.726 2.488 3.262 0.072 14 0 "[ . 1 . 2]" 1
1637 1 91 THR H 1 94 GLN HB2 . . 4.270 2.531 1.967 3.273 . 0 0 "[ . 1 . 2]" 1
1638 1 91 THR H 1 94 GLN HB3 . . 4.210 3.578 2.549 4.251 0.041 9 0 "[ . 1 . 2]" 1
1639 1 91 THR H 1 95 LEU H . . 5.010 4.621 4.163 5.062 0.052 6 0 "[ . 1 . 2]" 1
1640 1 91 THR HA 1 91 THR MG . . 3.090 2.224 2.140 2.325 . 0 0 "[ . 1 . 2]" 1
1641 1 91 THR HA 1 92 LEU H . . 2.860 2.330 2.248 2.438 . 0 0 "[ . 1 . 2]" 1
1642 1 91 THR HA 1 92 LEU HA . . 4.820 4.447 4.282 4.600 . 0 0 "[ . 1 . 2]" 1
1643 1 91 THR HA 1 92 LEU HB2 . . 4.780 4.601 4.512 4.756 . 0 0 "[ . 1 . 2]" 1
1644 1 91 THR HA 1 92 LEU HG . . 4.680 4.544 4.277 4.745 0.065 20 0 "[ . 1 . 2]" 1
1645 1 91 THR HA 1 93 SER H . . 4.500 4.037 3.684 4.331 . 0 0 "[ . 1 . 2]" 1
1646 1 91 THR HB 1 92 LEU HB2 . . 4.370 4.182 3.842 4.438 0.068 14 0 "[ . 1 . 2]" 1
1647 1 91 THR HB 1 93 SER HB2 . . 3.540 3.453 3.074 3.617 0.077 15 0 "[ . 1 . 2]" 1
1648 1 91 THR HB 1 93 SER HB3 . . 3.540 3.368 2.286 3.621 0.081 15 0 "[ . 1 . 2]" 1
1649 1 91 THR HB 1 94 GLN HB2 . . 4.250 4.102 2.940 4.622 0.372 2 0 "[ . 1 . 2]" 1
1650 1 91 THR MG 1 93 SER H . . 5.020 4.014 3.208 4.466 . 0 0 "[ . 1 . 2]" 1
1651 1 91 THR MG 1 93 SER HB3 . . 4.790 4.325 3.310 4.844 0.054 7 0 "[ . 1 . 2]" 1
1652 1 91 THR MG 1 94 GLN H . . 5.150 4.200 3.909 4.610 . 0 0 "[ . 1 . 2]" 1
1653 1 92 LEU H 1 92 LEU HB2 . . 3.430 2.323 2.209 2.410 . 0 0 "[ . 1 . 2]" 1
1654 1 92 LEU H 1 92 LEU HB3 . . 3.460 3.538 3.518 3.551 0.091 9 0 "[ . 1 . 2]" 1
1655 1 92 LEU H 1 92 LEU MD1 . . 4.090 3.769 3.585 3.933 . 0 0 "[ . 1 . 2]" 1
1656 1 92 LEU H 1 92 LEU MD2 . . 4.160 3.614 3.233 4.039 . 0 0 "[ . 1 . 2]" 1
1657 1 92 LEU H 1 92 LEU HG . . 3.430 2.634 2.327 3.011 . 0 0 "[ . 1 . 2]" 1
1658 1 92 LEU H 1 93 SER H . . 3.650 2.744 2.512 2.902 . 0 0 "[ . 1 . 2]" 1
1659 1 92 LEU H 1 93 SER HB2 . . 5.190 4.758 4.525 4.995 . 0 0 "[ . 1 . 2]" 1
1660 1 92 LEU H 1 93 SER HB3 . . 5.500 5.322 4.680 5.579 0.079 7 0 "[ . 1 . 2]" 1
1661 1 92 LEU HA 1 92 LEU MD2 . . 3.140 2.078 1.985 2.213 . 0 0 "[ . 1 . 2]" 1
1662 1 92 LEU HA 1 92 LEU HG . . 3.330 3.027 2.719 3.227 . 0 0 "[ . 1 . 2]" 1
1663 1 92 LEU HA 1 95 LEU H . . 3.780 3.644 3.308 3.834 0.054 18 0 "[ . 1 . 2]" 1
1664 1 92 LEU HA 1 95 LEU HB2 . . 3.770 3.031 2.347 3.236 . 0 0 "[ . 1 . 2]" 1
1665 1 92 LEU HA 1 95 LEU HB3 . . 4.820 4.688 3.985 4.884 0.064 9 0 "[ . 1 . 2]" 1
1666 1 92 LEU HA 1 95 LEU QD . . 3.470 3.034 2.083 3.516 0.046 14 0 "[ . 1 . 2]" 1
1667 1 92 LEU HA 1 95 LEU HG . . 4.520 4.327 3.672 4.598 0.078 11 0 "[ . 1 . 2]" 1
1668 1 92 LEU HB2 1 92 LEU MD1 . . 3.470 2.346 2.279 2.427 . 0 0 "[ . 1 . 2]" 1
1669 1 92 LEU HB2 1 93 SER H . . 4.030 2.728 2.327 3.204 . 0 0 "[ . 1 . 2]" 1
1670 1 92 LEU HB3 1 93 SER H . . 4.390 3.442 3.037 3.897 . 0 0 "[ . 1 . 2]" 1
1671 1 92 LEU MD1 1 93 SER H . . 5.270 4.649 4.257 5.101 . 0 0 "[ . 1 . 2]" 1
1672 1 92 LEU MD2 1 93 SER H . . 5.500 4.720 4.604 4.848 . 0 0 "[ . 1 . 2]" 1
1673 1 92 LEU MD2 1 93 SER HA . . 5.500 5.540 5.373 5.607 0.107 14 0 "[ . 1 . 2]" 1
1674 1 93 SER H 1 93 SER HB2 . . 3.740 2.227 2.007 2.499 . 0 0 "[ . 1 . 2]" 1
1675 1 93 SER H 1 93 SER HB3 . . 3.310 2.826 2.438 3.038 . 0 0 "[ . 1 . 2]" 1
1676 1 93 SER H 1 94 GLN H . . 3.600 2.812 2.467 3.056 . 0 0 "[ . 1 . 2]" 1
1677 1 93 SER HA 1 93 SER HB2 . . 2.680 2.640 2.472 2.749 0.069 2 0 "[ . 1 . 2]" 1
1678 1 93 SER HA 1 96 LYS QB . . 3.450 2.671 2.341 3.130 . 0 0 "[ . 1 . 2]" 1
1679 1 93 SER HA 1 96 LYS QD . . 4.280 3.727 3.029 4.219 . 0 0 "[ . 1 . 2]" 1
1680 1 93 SER HA 1 97 LYS QE . . 5.030 3.947 3.064 4.950 . 0 0 "[ . 1 . 2]" 1
1681 1 93 SER HB2 1 94 GLN H . . 3.910 3.797 3.468 3.997 0.087 4 0 "[ . 1 . 2]" 1
1682 1 93 SER HB3 1 94 GLN H . . 3.980 2.829 2.300 3.434 . 0 0 "[ . 1 . 2]" 1
1683 1 93 SER HB3 1 96 LYS QB . . 5.280 5.150 4.826 5.373 0.093 14 0 "[ . 1 . 2]" 1
1684 1 94 GLN H 1 94 GLN HB2 . . 3.230 2.168 1.902 2.722 . 0 0 "[ . 1 . 2]" 1
1685 1 94 GLN H 1 94 GLN HB3 . . 3.440 3.179 1.953 3.501 0.061 16 0 "[ . 1 . 2]" 1
1686 1 94 GLN H 1 94 GLN HG3 . . 3.740 3.959 3.787 4.287 0.547 3 2 "[ + . 1 .- 2]" 1
1687 1 94 GLN HA 1 94 GLN HB3 . . 2.930 2.865 2.682 3.060 0.130 2 0 "[ . 1 . 2]" 1
1688 1 94 GLN HA 1 94 GLN QE . . 3.480 3.168 2.266 3.490 0.010 8 0 "[ . 1 . 2]" 1
1689 1 94 GLN HA 1 94 GLN HG3 . . 3.610 2.931 2.053 3.667 0.057 9 0 "[ . 1 . 2]" 1
1690 1 94 GLN HA 1 98 GLU H . . 4.330 4.128 3.696 4.396 0.066 18 0 "[ . 1 . 2]" 1
1691 1 94 GLN HB3 1 95 LEU H . . 3.670 2.563 2.148 2.980 . 0 0 "[ . 1 . 2]" 1
1692 1 95 LEU H 1 95 LEU HB2 . . 3.500 2.422 2.267 2.673 . 0 0 "[ . 1 . 2]" 1
1693 1 95 LEU H 1 95 LEU HB3 . . 3.770 3.588 3.515 3.663 . 0 0 "[ . 1 . 2]" 1
1694 1 95 LEU H 1 95 LEU QD . . 3.960 2.655 1.903 3.427 . 0 0 "[ . 1 . 2]" 1
1695 1 95 LEU H 1 96 LYS H . . 3.440 2.862 2.708 2.986 . 0 0 "[ . 1 . 2]" 1
1696 1 95 LEU HA 1 95 LEU QD . . 2.880 2.123 2.010 2.323 . 0 0 "[ . 1 . 2]" 1
1697 1 95 LEU HA 1 95 LEU HG . . 3.930 3.303 2.619 3.810 . 0 0 "[ . 1 . 2]" 1
1698 1 95 LEU HA 1 98 GLU H . . 4.540 3.473 3.114 3.829 . 0 0 "[ . 1 . 2]" 1
1699 1 95 LEU HA 1 98 GLU HB2 . . 4.130 2.578 2.232 4.190 0.060 15 0 "[ . 1 . 2]" 1
1700 1 95 LEU HA 1 98 GLU HB3 . . 4.110 4.080 3.695 4.239 0.129 15 0 "[ . 1 . 2]" 1
1701 1 95 LEU HA 1 98 GLU HG3 . . 5.120 3.288 1.893 4.470 . 0 0 "[ . 1 . 2]" 1
1702 1 95 LEU HA 1 99 PHE QD . . 3.240 3.170 2.816 3.344 0.104 15 0 "[ . 1 . 2]" 1
1703 1 95 LEU HB2 1 95 LEU QD . . 3.210 2.282 2.212 2.486 . 0 0 "[ . 1 . 2]" 1
1704 1 95 LEU HB2 1 96 LYS H . . 3.720 2.832 2.608 2.973 . 0 0 "[ . 1 . 2]" 1
1705 1 95 LEU HB3 1 96 LYS H . . 3.970 3.601 3.359 3.909 . 0 0 "[ . 1 . 2]" 1
1706 1 95 LEU HB3 1 99 PHE QD . . 5.500 3.528 2.949 4.401 . 0 0 "[ . 1 . 2]" 1
1707 1 95 LEU QD 1 96 LYS H . . 4.960 4.102 3.819 4.320 . 0 0 "[ . 1 . 2]" 1
1708 1 95 LEU QD 1 96 LYS QB . . 5.390 4.998 4.701 5.101 . 0 0 "[ . 1 . 2]" 1
1709 1 95 LEU QD 1 99 PHE QD . . 3.090 2.477 2.050 2.934 . 0 0 "[ . 1 . 2]" 1
1710 1 95 LEU QD 1 99 PHE QE . . 3.250 2.534 2.122 3.347 0.097 15 0 "[ . 1 . 2]" 1
1711 1 96 LYS H 1 96 LYS QB . . 2.960 2.220 2.121 2.288 . 0 0 "[ . 1 . 2]" 1
1712 1 96 LYS H 1 96 LYS QD . . 4.900 4.470 4.018 4.745 . 0 0 "[ . 1 . 2]" 1
1713 1 96 LYS H 1 96 LYS QG . . 4.640 3.987 3.935 4.078 . 0 0 "[ . 1 . 2]" 1
1714 1 96 LYS H 1 97 LYS H . . 3.500 2.629 2.499 2.870 . 0 0 "[ . 1 . 2]" 1
1715 1 96 LYS H 1 97 LYS HB2 . . 4.740 4.471 4.153 4.803 0.063 8 0 "[ . 1 . 2]" 1
1716 1 96 LYS H 1 97 LYS HB3 . . 5.500 5.526 5.009 5.583 0.083 2 0 "[ . 1 . 2]" 1
1717 1 96 LYS HA 1 96 LYS QB . . 2.780 2.375 2.315 2.449 . 0 0 "[ . 1 . 2]" 1
1718 1 96 LYS HA 1 96 LYS QD . . 5.010 3.988 3.309 4.320 . 0 0 "[ . 1 . 2]" 1
1719 1 96 LYS HA 1 96 LYS HE2 . . 5.470 4.940 3.856 5.856 0.386 12 0 "[ . 1 . 2]" 1
1720 1 96 LYS HA 1 96 LYS QG . . 3.260 2.424 2.237 2.576 . 0 0 "[ . 1 . 2]" 1
1721 1 96 LYS HA 1 100 TYR HB2 . . 3.610 2.707 2.200 3.006 . 0 0 "[ . 1 . 2]" 1
1722 1 96 LYS HA 1 100 TYR HB3 . . 3.290 2.477 2.154 3.028 . 0 0 "[ . 1 . 2]" 1
1723 1 96 LYS QB 1 97 LYS H . . 3.450 2.758 2.511 3.527 0.077 15 0 "[ . 1 . 2]" 1
1724 1 96 LYS QB 1 97 LYS QE . . 4.710 3.227 2.361 4.126 . 0 0 "[ . 1 . 2]" 1
1725 1 96 LYS QB 1 100 TYR HB3 . . 4.730 3.878 3.685 4.257 . 0 0 "[ . 1 . 2]" 1
1726 1 96 LYS QD 1 97 LYS QE . . 3.550 3.103 1.849 3.582 0.032 1 0 "[ . 1 . 2]" 1
1727 1 96 LYS QD 1 100 TYR HB3 . . 5.250 4.169 2.802 4.637 . 0 0 "[ . 1 . 2]" 1
1728 1 96 LYS HE2 1 96 LYS QG . . 3.640 2.479 1.995 3.534 . 0 0 "[ . 1 . 2]" 1
1729 1 96 LYS QG 1 97 LYS H . . 5.000 3.982 3.608 4.465 . 0 0 "[ . 1 . 2]" 1
1730 1 96 LYS QG 1 97 LYS QE . . 4.140 3.720 3.108 4.096 . 0 0 "[ . 1 . 2]" 1
1731 1 96 LYS QG 1 100 TYR HA . . 5.310 4.884 4.540 5.230 . 0 0 "[ . 1 . 2]" 1
1732 1 96 LYS QG 1 100 TYR HB2 . . 5.100 3.548 2.922 3.765 . 0 0 "[ . 1 . 2]" 1
1733 1 96 LYS QG 1 100 TYR HB3 . . 4.280 2.297 2.140 2.481 . 0 0 "[ . 1 . 2]" 1
1734 1 96 LYS QG 1 100 TYR QD . . 4.330 2.669 2.190 3.415 . 0 0 "[ . 1 . 2]" 1
1735 1 97 LYS H 1 97 LYS HB2 . . 3.090 2.130 2.028 2.400 . 0 0 "[ . 1 . 2]" 1
1736 1 97 LYS H 1 97 LYS HB3 . . 3.090 3.054 2.673 3.174 0.084 15 0 "[ . 1 . 2]" 1
1737 1 97 LYS H 1 97 LYS QD . . 4.740 3.869 3.292 4.675 . 0 0 "[ . 1 . 2]" 1
1738 1 97 LYS H 1 97 LYS HG2 . . 4.280 4.497 4.318 4.825 0.545 15 1 "[ . 1 + 2]" 1
1739 1 97 LYS HA 1 97 LYS HB3 . . 2.890 2.908 2.829 2.974 0.084 11 0 "[ . 1 . 2]" 1
1740 1 97 LYS HA 1 97 LYS QD . . 4.180 2.990 2.025 3.966 . 0 0 "[ . 1 . 2]" 1
1741 1 97 LYS HA 1 97 LYS HG2 . . 3.840 3.516 3.100 3.633 . 0 0 "[ . 1 . 2]" 1
1742 1 97 LYS HA 1 97 LYS HG3 . . 3.790 2.339 2.106 2.835 . 0 0 "[ . 1 . 2]" 1
1743 1 97 LYS HA 1 100 TYR H . . 4.390 4.044 3.777 4.345 . 0 0 "[ . 1 . 2]" 1
1744 1 97 LYS HA 1 101 GLN HB3 . . 3.980 3.366 2.583 4.051 0.071 15 0 "[ . 1 . 2]" 1
1745 1 97 LYS QD 1 97 LYS HG2 . . 2.510 2.262 2.144 2.489 . 0 0 "[ . 1 . 2]" 1
1746 1 98 GLU H 1 98 GLU HB2 . . 3.100 2.492 2.226 3.525 0.425 15 0 "[ . 1 . 2]" 1
1747 1 98 GLU H 1 98 GLU HB3 . . 3.560 3.537 3.049 3.619 0.059 20 0 "[ . 1 . 2]" 1
1748 1 98 GLU H 1 98 GLU HG2 . . 3.410 2.549 1.800 3.991 0.581 18 1 "[ . 1 . + 2]" 1
1749 1 98 GLU H 1 98 GLU HG3 . . 4.100 3.259 2.126 3.928 . 0 0 "[ . 1 . 2]" 1
1750 1 98 GLU H 1 100 TYR H . . 4.830 4.131 3.535 4.463 . 0 0 "[ . 1 . 2]" 1
1751 1 98 GLU HA 1 98 GLU HB2 . . 2.990 3.016 2.587 3.047 0.057 16 0 "[ . 1 . 2]" 1
1752 1 98 GLU HA 1 98 GLU HG2 . . 3.480 2.913 2.319 3.547 0.067 15 0 "[ . 1 . 2]" 1
1753 1 98 GLU HA 1 98 GLU HG3 . . 3.840 3.620 2.466 3.905 0.065 3 0 "[ . 1 . 2]" 1
1754 1 98 GLU HB2 1 99 PHE H . . 3.820 2.376 1.943 2.759 . 0 0 "[ . 1 . 2]" 1
1755 1 98 GLU HB2 1 99 PHE QD . . 3.360 2.989 2.288 3.444 0.084 13 0 "[ . 1 . 2]" 1
1756 1 98 GLU HB2 1 100 TYR H . . 5.270 4.722 4.247 4.909 . 0 0 "[ . 1 . 2]" 1
1757 1 98 GLU HB3 1 99 PHE H . . 3.700 3.325 2.712 3.523 . 0 0 "[ . 1 . 2]" 1
1758 1 98 GLU HB3 1 99 PHE QB . . 5.300 4.370 3.986 5.164 . 0 0 "[ . 1 . 2]" 1
1759 1 98 GLU HB3 1 99 PHE QD . . 4.300 3.379 3.182 3.642 . 0 0 "[ . 1 . 2]" 1
1760 1 98 GLU HB3 1 99 PHE QE . . 4.540 3.224 2.994 3.768 . 0 0 "[ . 1 . 2]" 1
1761 1 98 GLU HB3 1 100 TYR H . . 5.470 5.476 5.146 5.552 0.082 11 0 "[ . 1 . 2]" 1
1762 1 98 GLU HG2 1 99 PHE H . . 4.730 4.448 3.150 5.128 0.398 18 0 "[ . 1 . 2]" 1
1763 1 98 GLU HG3 1 99 PHE QE . . 5.190 4.079 3.281 5.620 0.430 18 0 "[ . 1 . 2]" 1
1764 1 99 PHE H 1 99 PHE QB . . 3.650 2.521 2.195 2.765 . 0 0 "[ . 1 . 2]" 1
1765 1 99 PHE H 1 99 PHE QD . . 3.340 3.101 2.282 3.409 0.069 14 0 "[ . 1 . 2]" 1
1766 1 99 PHE H 1 100 TYR H . . 3.120 2.518 2.216 2.795 . 0 0 "[ . 1 . 2]" 1
1767 1 99 PHE HA 1 99 PHE QD . . 2.850 2.506 2.266 2.882 0.032 6 0 "[ . 1 . 2]" 1
1768 1 99 PHE HA 1 101 GLN QE . . 4.250 2.680 2.018 3.100 . 0 0 "[ . 1 . 2]" 1
1769 1 99 PHE HA 1 109 VAL MG2 . . 5.500 4.492 4.130 5.276 . 0 0 "[ . 1 . 2]" 1
1770 1 99 PHE QB 1 100 TYR H . . 4.890 3.638 3.168 3.752 . 0 0 "[ . 1 . 2]" 1
1771 1 99 PHE QB 1 101 GLN QE . . 5.500 4.377 3.810 4.733 . 0 0 "[ . 1 . 2]" 1
1772 1 99 PHE QB 1 109 VAL MG1 . . 5.020 3.889 3.287 4.312 . 0 0 "[ . 1 . 2]" 1
1773 1 99 PHE QB 1 109 VAL MG2 . . 4.020 3.354 2.952 3.813 . 0 0 "[ . 1 . 2]" 1
1774 1 100 TYR H 1 100 TYR HB2 . . 3.780 3.023 2.675 3.215 . 0 0 "[ . 1 . 2]" 1
1775 1 100 TYR H 1 100 TYR HB3 . . 3.980 3.184 2.738 3.421 . 0 0 "[ . 1 . 2]" 1
1776 1 100 TYR H 1 101 GLN H . . 3.490 2.488 1.977 3.568 0.078 15 0 "[ . 1 . 2]" 1
1777 1 100 TYR H 1 101 GLN HA . . 4.670 4.304 3.959 4.735 0.065 15 0 "[ . 1 . 2]" 1
1778 1 100 TYR H 1 101 GLN HB3 . . 5.150 4.050 3.201 4.985 . 0 0 "[ . 1 . 2]" 1
1779 1 100 TYR HA 1 100 TYR QD . . 3.100 2.436 2.193 2.709 . 0 0 "[ . 1 . 2]" 1
1780 1 100 TYR HA 1 105 GLN HE21 . . 3.450 2.691 1.887 3.523 0.073 17 0 "[ . 1 . 2]" 1
1781 1 100 TYR HA 1 105 GLN HE22 . . 3.320 3.336 2.617 3.535 0.215 9 0 "[ . 1 . 2]" 1
1782 1 100 TYR HA 1 105 GLN QG . . 3.990 2.676 1.967 3.326 . 0 0 "[ . 1 . 2]" 1
1783 1 100 TYR HA 1 109 VAL MG1 . . 4.980 4.476 3.944 4.916 . 0 0 "[ . 1 . 2]" 1
1784 1 100 TYR HA 1 109 VAL MG2 . . 4.100 3.706 2.968 4.201 0.101 10 0 "[ . 1 . 2]" 1
1785 1 100 TYR QD 1 105 GLN QG . . 2.880 2.806 2.303 2.943 0.063 2 0 "[ . 1 . 2]" 1
1786 1 100 TYR QD 1 106 LYS QE . . 4.460 3.772 2.796 4.574 0.114 15 0 "[ . 1 . 2]" 1
1787 1 100 TYR QD 1 106 LYS HG2 . . 5.060 3.902 2.799 5.127 0.067 7 0 "[ . 1 . 2]" 1
1788 1 100 TYR QD 1 109 VAL HB . . 3.620 3.192 2.790 3.720 0.100 7 0 "[ . 1 . 2]" 1
1789 1 100 TYR QD 1 109 VAL MG1 . . 3.150 2.471 2.098 2.865 . 0 0 "[ . 1 . 2]" 1
1790 1 100 TYR QD 1 109 VAL MG2 . . 3.060 2.611 2.131 3.158 0.098 15 0 "[ . 1 . 2]" 1
1791 1 100 TYR QE 1 106 LYS HA . . 2.920 2.465 2.114 3.007 0.087 15 0 "[ . 1 . 2]" 1
1792 1 100 TYR QE 1 106 LYS QB . . 4.910 3.602 2.786 4.453 . 0 0 "[ . 1 . 2]" 1
1793 1 100 TYR QE 1 106 LYS HD2 . . 5.270 4.644 3.614 5.211 . 0 0 "[ . 1 . 2]" 1
1794 1 100 TYR QE 1 106 LYS HD3 . . 5.140 4.659 2.824 5.342 0.202 6 0 "[ . 1 . 2]" 1
1795 1 100 TYR QE 1 106 LYS QE . . 3.300 2.783 2.373 3.406 0.106 13 0 "[ . 1 . 2]" 1
1796 1 100 TYR QE 1 106 LYS HG2 . . 4.940 3.024 2.729 3.300 . 0 0 "[ . 1 . 2]" 1
1797 1 100 TYR QE 1 109 VAL HB . . 2.720 2.464 2.090 2.786 0.066 7 0 "[ . 1 . 2]" 1
1798 1 100 TYR QE 1 109 VAL MG1 . . 2.800 2.702 2.178 2.898 0.098 3 0 "[ . 1 . 2]" 1
1799 1 100 TYR QE 1 110 ASP H . . 3.660 3.747 3.703 3.767 0.107 15 0 "[ . 1 . 2]" 1
1800 1 101 GLN H 1 101 GLN HB3 . . 3.240 2.779 2.407 3.412 0.172 20 0 "[ . 1 . 2]" 1
1801 1 101 GLN H 1 101 GLN HG2 . . 3.470 3.172 2.097 3.554 0.084 16 0 "[ . 1 . 2]" 1
1802 1 101 GLN H 1 102 THR H . . 3.200 2.705 2.163 3.265 0.065 11 0 "[ . 1 . 2]" 1
1803 1 101 GLN H 1 102 THR MG . . 4.630 3.844 3.172 4.518 . 0 0 "[ . 1 . 2]" 1
1804 1 101 GLN HA 1 105 GLN HE21 . . 5.080 4.753 3.726 5.162 0.082 10 0 "[ . 1 . 2]" 1
1805 1 101 GLN HA 1 105 GLN HE22 . . 5.060 4.564 3.384 5.174 0.114 7 0 "[ . 1 . 2]" 1
1806 1 101 GLN HB2 1 102 THR H . . 4.100 3.685 2.249 4.178 0.078 16 0 "[ . 1 . 2]" 1
1807 1 101 GLN HB2 1 102 THR MG . . 4.990 3.959 2.520 5.028 0.038 16 0 "[ . 1 . 2]" 1
1808 1 101 GLN HB3 1 102 THR H . . 4.180 4.049 3.629 4.248 0.068 4 0 "[ . 1 . 2]" 1
1809 1 101 GLN HB3 1 102 THR MG . . 4.470 4.514 3.949 5.072 0.602 20 1 "[ . 1 . +]" 1
1810 1 101 GLN QE 1 102 THR H . . 4.350 3.665 2.572 4.269 . 0 0 "[ . 1 . 2]" 1
1811 1 101 GLN QE 1 102 THR MG . . 4.490 3.405 2.097 4.104 . 0 0 "[ . 1 . 2]" 1
1812 1 101 GLN QE 1 105 GLN QB . . 5.270 4.329 3.784 5.033 . 0 0 "[ . 1 . 2]" 1
1813 1 101 GLN HG2 1 102 THR H . . 3.860 2.807 1.844 4.609 0.749 20 3 "[- . 1 . *+]" 1
1814 1 102 THR H 1 102 THR HB . . 4.180 3.359 2.657 3.708 . 0 0 "[ . 1 . 2]" 1
1815 1 102 THR H 1 102 THR MG . . 3.160 2.044 1.697 2.447 . 0 0 "[ . 1 . 2]" 1
1816 1 102 THR H 1 105 GLN QB . . 3.780 3.355 2.778 3.889 0.109 20 0 "[ . 1 . 2]" 1
1817 1 102 THR H 1 105 GLN HE22 . . 4.870 2.827 2.169 3.709 . 0 0 "[ . 1 . 2]" 1
1818 1 102 THR H 1 105 GLN QG . . 4.820 3.976 2.048 4.617 . 0 0 "[ . 1 . 2]" 1
1819 1 102 THR HA 1 102 THR MG . . 3.280 2.840 2.381 3.283 0.003 10 0 "[ . 1 . 2]" 1
1820 1 102 THR HA 1 105 GLN H . . 5.020 4.975 4.723 5.102 0.082 4 0 "[ . 1 . 2]" 1
1821 1 102 THR MG 1 105 GLN QG . . 5.500 4.080 2.642 5.049 . 0 0 "[ . 1 . 2]" 1
1822 1 103 ARG HA 1 103 ARG QD . . 4.300 3.785 2.783 4.261 . 0 0 "[ . 1 . 2]" 1
1823 1 103 ARG HA 1 103 ARG HG3 . . 4.040 2.990 2.034 4.283 0.243 8 0 "[ . 1 . 2]" 1
1824 1 103 ARG HA 1 105 GLN H . . 4.230 4.244 3.783 4.310 0.080 5 0 "[ . 1 . 2]" 1
1825 1 103 ARG HA 1 106 LYS H . . 4.040 3.585 3.073 4.065 0.025 7 0 "[ . 1 . 2]" 1
1826 1 103 ARG HA 1 106 LYS QB . . 3.960 3.620 2.193 4.051 0.091 7 0 "[ . 1 . 2]" 1
1827 1 103 ARG HA 1 106 LYS HD2 . . 4.270 2.645 2.140 4.229 . 0 0 "[ . 1 . 2]" 1
1828 1 103 ARG HA 1 106 LYS HD3 . . 4.100 3.492 2.593 4.321 0.221 7 0 "[ . 1 . 2]" 1
1829 1 103 ARG HA 1 106 LYS QE . . 4.270 3.752 2.425 4.370 0.100 5 0 "[ . 1 . 2]" 1
1830 1 103 ARG QB 1 104 SER H . . 4.840 2.838 2.406 3.612 . 0 0 "[ . 1 . 2]" 1
1831 1 103 ARG QB 1 104 SER QB . . 4.620 4.227 3.678 4.546 . 0 0 "[ . 1 . 2]" 1
1832 1 104 SER H 1 104 SER QB . . 3.820 2.261 1.925 2.601 . 0 0 "[ . 1 . 2]" 1
1833 1 104 SER H 1 105 GLN H . . 3.850 2.774 2.365 2.998 . 0 0 "[ . 1 . 2]" 1
1834 1 104 SER HA 1 104 SER QB . . 2.750 2.391 2.141 2.572 . 0 0 "[ . 1 . 2]" 1
1835 1 104 SER HA 1 107 ARG H . . 4.140 3.760 3.343 4.211 0.071 15 0 "[ . 1 . 2]" 1
1836 1 104 SER HA 1 107 ARG QB . . 3.990 3.590 2.794 3.992 0.002 9 0 "[ . 1 . 2]" 1
1837 1 104 SER HA 1 107 ARG QG . . 4.460 4.425 2.780 4.566 0.106 8 0 "[ . 1 . 2]" 1
1838 1 104 SER QB 1 105 GLN H . . 3.610 2.949 2.464 3.690 0.080 2 0 "[ . 1 . 2]" 1
1839 1 105 GLN H 1 105 GLN QB . . 3.390 2.249 2.033 2.739 . 0 0 "[ . 1 . 2]" 1
1840 1 105 GLN H 1 106 LYS H . . 3.120 2.722 2.418 2.919 . 0 0 "[ . 1 . 2]" 1
1841 1 105 GLN HA 1 106 LYS HA . . 4.930 4.844 4.728 4.990 0.060 20 0 "[ . 1 . 2]" 1
1842 1 105 GLN HA 1 106 LYS QB . . 5.500 5.445 5.270 5.564 0.064 12 0 "[ . 1 . 2]" 1
1843 1 105 GLN QB 1 106 LYS H . . 3.510 3.241 2.586 3.603 0.093 15 0 "[ . 1 . 2]" 1
1844 1 105 GLN QB 1 106 LYS HG3 . . 4.960 4.246 3.218 5.033 0.073 10 0 "[ . 1 . 2]" 1
1845 1 106 LYS H 1 106 LYS HB2 . . 3.250 2.575 2.262 2.760 . 0 0 "[ . 1 . 2]" 1
1846 1 106 LYS H 1 106 LYS QB . . 3.650 2.521 2.237 2.684 . 0 0 "[ . 1 . 2]" 1
1847 1 106 LYS H 1 106 LYS HD2 . . 5.070 4.111 2.915 4.854 . 0 0 "[ . 1 . 2]" 1
1848 1 106 LYS H 1 106 LYS HD3 . . 4.840 4.357 3.565 4.901 0.061 17 0 "[ . 1 . 2]" 1
1849 1 106 LYS H 1 106 LYS HG2 . . 4.190 3.381 2.995 4.062 . 0 0 "[ . 1 . 2]" 1
1850 1 106 LYS H 1 106 LYS HG3 . . 3.470 2.274 1.898 2.869 . 0 0 "[ . 1 . 2]" 1
1851 1 106 LYS H 1 107 ARG H . . 3.920 2.717 2.450 2.897 . 0 0 "[ . 1 . 2]" 1
1852 1 106 LYS HA 1 106 LYS HG2 . . 3.610 2.670 2.395 3.037 . 0 0 "[ . 1 . 2]" 1
1853 1 106 LYS HA 1 106 LYS HG3 . . 3.820 3.121 2.320 3.369 . 0 0 "[ . 1 . 2]" 1
1854 1 106 LYS HA 1 109 VAL HB . . 3.890 2.972 2.321 3.985 0.095 7 0 "[ . 1 . 2]" 1
1855 1 106 LYS HA 1 110 ASP H . . 4.520 3.398 2.655 4.277 . 0 0 "[ . 1 . 2]" 1
1856 1 106 LYS QB 1 107 ARG H . . 3.760 3.099 2.747 3.402 . 0 0 "[ . 1 . 2]" 1
1857 1 106 LYS HB2 1 107 ARG H . . 3.490 3.214 2.814 3.562 0.072 10 0 "[ . 1 . 2]" 1
1858 1 106 LYS QE 1 106 LYS HG2 . . 3.660 2.353 2.120 2.827 . 0 0 "[ . 1 . 2]" 1
1859 1 106 LYS HG3 1 107 ARG H . . 5.320 4.530 4.116 4.933 . 0 0 "[ . 1 . 2]" 1
1860 1 107 ARG H 1 107 ARG QB . . 3.010 2.197 1.948 2.569 . 0 0 "[ . 1 . 2]" 1
1861 1 107 ARG H 1 107 ARG QD . . 4.500 3.329 2.558 4.519 0.019 11 0 "[ . 1 . 2]" 1
1862 1 107 ARG H 1 107 ARG QG . . 4.400 3.582 2.233 4.163 . 0 0 "[ . 1 . 2]" 1
1863 1 107 ARG HA 1 107 ARG QD . . 4.030 2.826 2.114 4.147 0.117 15 0 "[ . 1 . 2]" 1
1864 1 107 ARG HA 1 107 ARG QG . . 3.520 2.638 2.239 3.373 . 0 0 "[ . 1 . 2]" 1
1865 1 107 ARG HA 1 110 ASP H . . 4.480 4.223 3.698 4.562 0.082 18 0 "[ . 1 . 2]" 1
1866 1 107 ARG HA 1 110 ASP HB2 . . 4.570 4.414 3.873 4.654 0.084 15 0 "[ . 1 . 2]" 1
1867 1 107 ARG HA 1 110 ASP HB3 . . 3.990 3.633 3.040 4.063 0.073 19 0 "[ . 1 . 2]" 1
1868 1 107 ARG HA 1 111 ASP H . . 4.410 4.200 3.798 4.495 0.085 15 0 "[ . 1 . 2]" 1
1869 1 107 ARG QB 1 108 GLU H . . 3.410 2.487 2.027 3.318 . 0 0 "[ . 1 . 2]" 1
1870 1 107 ARG QG 1 108 GLU H . . 4.680 3.981 1.799 4.672 . 0 0 "[ . 1 . 2]" 1
1871 1 107 ARG QG 1 108 GLU HA . . 5.130 4.978 3.351 5.244 0.114 14 0 "[ . 1 . 2]" 1
1872 1 108 GLU H 1 108 GLU HB2 . . 3.000 2.298 1.993 2.501 . 0 0 "[ . 1 . 2]" 1
1873 1 108 GLU H 1 108 GLU HB3 . . 3.530 3.515 3.230 3.601 0.071 7 0 "[ . 1 . 2]" 1
1874 1 108 GLU H 1 108 GLU HG2 . . 4.040 4.123 3.700 4.742 0.702 18 2 "[ . 1 - + 2]" 1
1875 1 108 GLU H 1 109 VAL H . . 3.490 2.829 2.219 3.367 . 0 0 "[ . 1 . 2]" 1
1876 1 108 GLU H 1 110 ASP H . . 4.720 4.312 3.309 4.768 0.048 19 0 "[ . 1 . 2]" 1
1877 1 108 GLU HA 1 108 GLU HB3 . . 2.990 2.694 2.520 2.911 . 0 0 "[ . 1 . 2]" 1
1878 1 108 GLU HA 1 108 GLU HG2 . . 3.850 3.307 2.695 3.683 . 0 0 "[ . 1 . 2]" 1
1879 1 108 GLU HA 1 108 GLU HG3 . . 4.000 2.295 2.065 2.582 . 0 0 "[ . 1 . 2]" 1
1880 1 108 GLU HA 1 111 ASP H . . 4.270 3.447 3.247 3.561 . 0 0 "[ . 1 . 2]" 1
1881 1 108 GLU HA 1 111 ASP HA . . 5.210 5.202 4.931 5.299 0.089 12 0 "[ . 1 . 2]" 1
1882 1 108 GLU HA 1 111 ASP HB2 . . 3.520 2.787 2.090 3.809 0.289 16 0 "[ . 1 . 2]" 1
1883 1 108 GLU HA 1 111 ASP HB3 . . 4.330 3.066 2.290 4.136 . 0 0 "[ . 1 . 2]" 1
1884 1 108 GLU HB2 1 109 VAL H . . 3.510 2.503 2.221 3.000 . 0 0 "[ . 1 . 2]" 1
1885 1 108 GLU HB2 1 109 VAL MG2 . . 4.910 3.351 2.954 3.792 . 0 0 "[ . 1 . 2]" 1
1886 1 108 GLU HB2 1 112 TYR QE . . 5.420 4.223 3.420 4.757 . 0 0 "[ . 1 . 2]" 1
1887 1 108 GLU HB3 1 109 VAL H . . 3.750 2.937 2.738 3.331 . 0 0 "[ . 1 . 2]" 1
1888 1 108 GLU HB3 1 112 TYR QE . . 3.200 2.889 2.133 3.284 0.084 14 0 "[ . 1 . 2]" 1
1889 1 108 GLU HG2 1 109 VAL H . . 4.710 4.780 4.751 4.793 0.083 6 0 "[ . 1 . 2]" 1
1890 1 108 GLU HG2 1 112 TYR QE . . 4.700 3.837 2.616 4.557 . 0 0 "[ . 1 . 2]" 1
1891 1 108 GLU HG3 1 109 VAL H . . 4.710 4.755 4.471 4.796 0.086 5 0 "[ . 1 . 2]" 1
1892 1 108 GLU HG3 1 111 ASP HB2 . . 5.500 4.711 3.813 5.811 0.311 16 0 "[ . 1 . 2]" 1
1893 1 108 GLU HG3 1 112 TYR QE . . 4.480 4.163 2.693 4.792 0.312 7 0 "[ . 1 . 2]" 1
1894 1 109 VAL H 1 109 VAL HB . . 3.210 2.569 2.367 2.857 . 0 0 "[ . 1 . 2]" 1
1895 1 109 VAL H 1 109 VAL MG1 . . 4.030 3.801 3.749 3.847 . 0 0 "[ . 1 . 2]" 1
1896 1 109 VAL H 1 109 VAL MG2 . . 3.080 2.079 1.905 2.207 . 0 0 "[ . 1 . 2]" 1
1897 1 109 VAL H 1 110 ASP H . . 3.630 2.962 2.707 3.148 . 0 0 "[ . 1 . 2]" 1
1898 1 109 VAL HA 1 109 VAL MG1 . . 3.180 2.472 2.260 2.667 . 0 0 "[ . 1 . 2]" 1
1899 1 109 VAL HA 1 109 VAL MG2 . . 3.030 2.377 2.291 2.489 . 0 0 "[ . 1 . 2]" 1
1900 1 109 VAL HA 1 111 ASP H . . 4.830 4.270 3.880 4.642 . 0 0 "[ . 1 . 2]" 1
1901 1 109 VAL HA 1 112 TYR QD . . 2.520 2.273 1.942 2.587 0.067 8 0 "[ . 1 . 2]" 1
1902 1 109 VAL HA 1 112 TYR QE . . 3.360 3.257 2.708 3.451 0.091 4 0 "[ . 1 . 2]" 1
1903 1 109 VAL HB 1 110 ASP H . . 3.650 2.579 2.309 3.138 . 0 0 "[ . 1 . 2]" 1
1904 1 109 VAL HB 1 110 ASP HB2 . . 4.000 4.053 3.860 4.083 0.083 8 0 "[ . 1 . 2]" 1
1905 1 109 VAL MG1 1 110 ASP H . . 4.120 3.400 3.049 3.934 . 0 0 "[ . 1 . 2]" 1
1906 1 109 VAL MG1 1 110 ASP HA . . 4.150 3.576 3.111 3.997 . 0 0 "[ . 1 . 2]" 1
1907 1 109 VAL MG2 1 110 ASP H . . 4.370 3.929 3.722 4.073 . 0 0 "[ . 1 . 2]" 1
1908 1 109 VAL MG2 1 112 TYR QD . . 3.570 3.517 3.210 3.678 0.108 19 0 "[ . 1 . 2]" 1
1909 1 110 ASP H 1 110 ASP HB2 . . 3.610 2.262 2.056 2.473 . 0 0 "[ . 1 . 2]" 1
1910 1 110 ASP H 1 110 ASP HB3 . . 3.290 2.766 2.453 3.219 . 0 0 "[ . 1 . 2]" 1
1911 1 110 ASP H 1 111 ASP H . . 3.270 2.604 2.178 2.848 . 0 0 "[ . 1 . 2]" 1
1912 1 110 ASP HA 1 113 VAL H . . 3.790 3.253 2.938 3.708 . 0 0 "[ . 1 . 2]" 1
1913 1 110 ASP HA 1 113 VAL HB . . 3.330 2.909 2.412 3.405 0.075 4 0 "[ . 1 . 2]" 1
1914 1 110 ASP HA 1 113 VAL MG2 . . 3.760 2.651 2.175 3.106 . 0 0 "[ . 1 . 2]" 1
1915 1 110 ASP HB2 1 111 ASP H . . 4.070 3.842 3.487 4.110 0.040 1 0 "[ . 1 . 2]" 1
1916 1 111 ASP H 1 111 ASP HB2 . . 3.020 2.434 2.035 2.984 . 0 0 "[ . 1 . 2]" 1
1917 1 111 ASP H 1 111 ASP HB3 . . 3.660 2.991 2.269 3.666 0.006 17 0 "[ . 1 . 2]" 1
1918 1 111 ASP HA 1 114 ALA H . . 3.550 3.286 2.894 3.577 0.027 17 0 "[ . 1 . 2]" 1
1919 1 111 ASP HA 1 114 ALA MB . . 3.240 2.738 2.211 3.283 0.043 17 0 "[ . 1 . 2]" 1
1920 1 111 ASP HB2 1 112 TYR H . . 4.130 3.444 2.550 4.114 . 0 0 "[ . 1 . 2]" 1
1921 1 111 ASP HB3 1 112 TYR H . . 4.020 2.992 2.486 3.731 . 0 0 "[ . 1 . 2]" 1
1922 1 112 TYR H 1 112 TYR HB2 . . 3.200 2.620 2.404 2.738 . 0 0 "[ . 1 . 2]" 1
1923 1 112 TYR H 1 112 TYR HB3 . . 3.850 3.616 3.512 3.674 . 0 0 "[ . 1 . 2]" 1
1924 1 112 TYR H 1 112 TYR QD . . 3.420 2.960 2.567 3.256 . 0 0 "[ . 1 . 2]" 1
1925 1 112 TYR H 1 113 VAL H . . 3.450 2.758 2.602 2.894 . 0 0 "[ . 1 . 2]" 1
1926 1 112 TYR H 1 113 VAL MG2 . . 4.740 4.147 3.826 4.457 . 0 0 "[ . 1 . 2]" 1
1927 1 112 TYR HA 1 112 TYR QD . . 2.540 2.373 2.105 2.602 0.062 15 0 "[ . 1 . 2]" 1
1928 1 112 TYR HA 1 115 GLY H . . 4.130 3.255 2.890 3.669 . 0 0 "[ . 1 . 2]" 1
1929 1 112 TYR HB2 1 113 VAL H . . 3.600 2.801 2.583 2.989 . 0 0 "[ . 1 . 2]" 1
1930 1 112 TYR HB2 1 113 VAL HB . . 5.310 5.168 4.872 5.375 0.065 15 0 "[ . 1 . 2]" 1
1931 1 112 TYR HB3 1 113 VAL H . . 4.100 3.892 3.678 4.054 . 0 0 "[ . 1 . 2]" 1
1932 1 112 TYR HB3 1 113 VAL MG2 . . 5.500 4.393 4.204 4.652 . 0 0 "[ . 1 . 2]" 1
1933 1 112 TYR QD 1 113 VAL H . . 4.490 4.472 4.245 4.567 0.077 13 0 "[ . 1 . 2]" 1
1934 1 113 VAL H 1 113 VAL HB . . 3.150 2.578 2.472 2.689 . 0 0 "[ . 1 . 2]" 1
1935 1 113 VAL H 1 113 VAL MG1 . . 3.970 3.802 3.745 3.848 . 0 0 "[ . 1 . 2]" 1
1936 1 113 VAL H 1 113 VAL MG2 . . 3.080 2.156 1.962 2.313 . 0 0 "[ . 1 . 2]" 1
1937 1 113 VAL H 1 114 ALA H . . 3.510 2.634 2.451 2.736 . 0 0 "[ . 1 . 2]" 1
1938 1 113 VAL H 1 114 ALA HA . . 5.290 5.299 5.130 5.363 0.073 11 0 "[ . 1 . 2]" 1
1939 1 113 VAL H 1 114 ALA MB . . 4.810 4.335 4.153 4.506 . 0 0 "[ . 1 . 2]" 1
1940 1 113 VAL H 1 115 GLY H . . 5.060 4.022 3.807 4.417 . 0 0 "[ . 1 . 2]" 1
1941 1 113 VAL HA 1 113 VAL MG1 . . 3.220 2.327 2.244 2.502 . 0 0 "[ . 1 . 2]" 1
1942 1 113 VAL HA 1 113 VAL MG2 . . 3.140 2.505 2.406 2.659 . 0 0 "[ . 1 . 2]" 1
1943 1 113 VAL HA 1 116 LEU H . . 4.320 4.063 3.622 4.398 0.078 1 0 "[ . 1 . 2]" 1
1944 1 113 VAL HA 1 116 LEU HB3 . . 4.390 4.180 3.405 4.451 0.061 18 0 "[ . 1 . 2]" 1
1945 1 113 VAL HA 1 116 LEU MD1 . . 4.260 3.893 3.146 4.349 0.089 20 0 "[ . 1 . 2]" 1
1946 1 113 VAL HA 1 116 LEU MD2 . . 3.260 2.238 2.109 2.689 . 0 0 "[ . 1 . 2]" 1
1947 1 113 VAL HA 1 116 LEU HG . . 3.570 2.875 2.060 3.568 . 0 0 "[ . 1 . 2]" 1
1948 1 113 VAL HB 1 114 ALA H . . 3.430 3.184 2.774 3.486 0.056 2 0 "[ . 1 . 2]" 1
1949 1 113 VAL HB 1 114 ALA HA . . 4.830 4.695 4.308 4.903 0.073 4 0 "[ . 1 . 2]" 1
1950 1 113 VAL HB 1 114 ALA MB . . 4.560 3.996 3.578 4.239 . 0 0 "[ . 1 . 2]" 1
1951 1 113 VAL MG1 1 114 ALA H . . 4.030 3.942 3.602 4.112 0.082 2 0 "[ . 1 . 2]" 1
1952 1 113 VAL MG1 1 114 ALA HA . . 4.110 4.000 3.618 4.206 0.096 20 0 "[ . 1 . 2]" 1
1953 1 113 VAL MG1 1 114 ALA MB . . 5.030 4.127 3.701 4.361 . 0 0 "[ . 1 . 2]" 1
1954 1 113 VAL MG2 1 114 ALA H . . 4.630 4.083 3.852 4.223 . 0 0 "[ . 1 . 2]" 1
1955 1 114 ALA H 1 114 ALA MB . . 2.770 2.329 2.188 2.442 . 0 0 "[ . 1 . 2]" 1
1956 1 114 ALA MB 1 115 GLY H . . 4.160 3.225 2.868 3.603 . 0 0 "[ . 1 . 2]" 1
1957 1 114 ALA MB 1 115 GLY HA2 . . 5.030 4.198 3.988 4.527 . 0 0 "[ . 1 . 2]" 1
1958 1 114 ALA MB 1 115 GLY HA3 . . 5.090 4.468 4.247 4.723 . 0 0 "[ . 1 . 2]" 1
1959 1 114 ALA MB 1 116 LEU H . . 4.910 4.655 4.339 4.958 0.048 8 0 "[ . 1 . 2]" 1
1960 1 115 GLY H 1 116 LEU H . . 3.320 2.373 1.811 2.927 . 0 0 "[ . 1 . 2]" 1
1961 1 115 GLY H 1 116 LEU HB3 . . 5.500 4.505 3.763 5.163 . 0 0 "[ . 1 . 2]" 1
1962 1 115 GLY H 1 116 LEU MD1 . . 5.500 4.990 3.859 5.587 0.087 6 0 "[ . 1 . 2]" 1
1963 1 115 GLY H 1 116 LEU MD2 . . 5.310 4.498 3.740 4.855 . 0 0 "[ . 1 . 2]" 1
1964 1 115 GLY H 1 116 LEU HG . . 4.980 3.703 2.776 4.401 . 0 0 "[ . 1 . 2]" 1
1965 1 116 LEU H 1 116 LEU HB2 . . 3.730 3.699 3.594 3.802 0.072 5 0 "[ . 1 . 2]" 1
1966 1 116 LEU H 1 116 LEU HB3 . . 3.280 2.834 2.507 3.249 . 0 0 "[ . 1 . 2]" 1
1967 1 116 LEU H 1 116 LEU MD1 . . 4.140 3.373 2.470 3.822 . 0 0 "[ . 1 . 2]" 1
1968 1 116 LEU H 1 116 LEU MD2 . . 3.910 3.531 3.190 3.886 . 0 0 "[ . 1 . 2]" 1
1969 1 116 LEU H 1 116 LEU HG . . 3.380 2.183 1.812 2.644 . 0 0 "[ . 1 . 2]" 1
1970 1 116 LEU H 1 117 ARG H . . 4.960 4.424 2.537 4.679 . 0 0 "[ . 1 . 2]" 1
1971 1 116 LEU HA 1 116 LEU MD1 . . 4.570 3.703 3.557 3.797 . 0 0 "[ . 1 . 2]" 1
1972 1 116 LEU HA 1 116 LEU MD2 . . 4.260 4.072 3.990 4.113 . 0 0 "[ . 1 . 2]" 1
1973 1 116 LEU HA 1 116 LEU HG . . 3.970 3.771 3.687 3.916 . 0 0 "[ . 1 . 2]" 1
1974 1 116 LEU HA 1 117 ARG H . . 2.900 2.361 2.066 2.716 . 0 0 "[ . 1 . 2]" 1
1975 1 116 LEU HB2 1 117 ARG H . . 4.010 2.634 2.114 4.105 0.095 12 0 "[ . 1 . 2]" 1
1976 1 116 LEU HB3 1 116 LEU MD1 . . 3.430 3.241 3.168 3.324 . 0 0 "[ . 1 . 2]" 1
1977 1 116 LEU HB3 1 117 ARG H . . 4.320 3.835 3.552 4.351 0.031 12 0 "[ . 1 . 2]" 1
1978 1 116 LEU MD1 1 117 ARG H . . 3.980 3.200 2.559 3.902 . 0 0 "[ . 1 . 2]" 1
1979 1 116 LEU MD2 1 117 ARG H . . 5.020 4.587 4.166 5.124 0.104 16 0 "[ . 1 . 2]" 1
1980 1 116 LEU HG 1 117 ARG H . . 5.400 4.599 4.209 4.927 . 0 0 "[ . 1 . 2]" 1
1981 1 117 ARG H 1 117 ARG HB2 . . 3.140 2.458 2.096 3.135 . 0 0 "[ . 1 . 2]" 1
1982 1 117 ARG H 1 117 ARG HB3 . . 4.040 3.637 3.368 4.050 0.010 12 0 "[ . 1 . 2]" 1
1983 1 117 ARG H 1 117 ARG HD2 . . 5.320 4.455 2.926 5.119 . 0 0 "[ . 1 . 2]" 1
1984 1 117 ARG H 1 117 ARG HD3 . . 4.990 4.347 3.685 5.054 0.064 12 0 "[ . 1 . 2]" 1
1985 1 117 ARG HA 1 117 ARG QG . . 3.330 2.422 2.130 2.622 . 0 0 "[ . 1 . 2]" 1
1986 1 117 ARG HA 1 118 THR H . . 3.020 2.496 2.287 2.783 . 0 0 "[ . 1 . 2]" 1
1987 1 117 ARG HB2 1 117 ARG HD3 . . 3.080 2.390 2.195 2.592 . 0 0 "[ . 1 . 2]" 1
1988 1 117 ARG HB2 1 118 THR H . . 3.950 3.737 3.241 4.013 0.063 1 0 "[ . 1 . 2]" 1
1989 1 117 ARG HB3 1 118 THR H . . 3.730 2.551 2.011 2.833 . 0 0 "[ . 1 . 2]" 1
1990 1 117 ARG HB3 1 118 THR HA . . 4.530 4.454 3.945 4.606 0.076 13 0 "[ . 1 . 2]" 1
1991 1 117 ARG HB3 1 119 GLU H . . 3.330 2.582 2.103 3.033 . 0 0 "[ . 1 . 2]" 1
1992 1 117 ARG QG 1 118 THR H . . 4.740 3.818 3.066 4.127 . 0 0 "[ . 1 . 2]" 1
1993 1 118 THR H 1 118 THR MG . . 4.340 3.799 3.341 4.038 . 0 0 "[ . 1 . 2]" 1
1994 1 118 THR H 1 119 GLU H . . 3.130 1.968 1.589 2.258 . 0 0 "[ . 1 . 2]" 1
1995 1 118 THR HA 1 118 THR MG . . 3.080 2.250 2.083 2.380 . 0 0 "[ . 1 . 2]" 1
1996 1 118 THR HA 1 119 GLU H . . 3.090 3.112 2.864 3.178 0.088 5 0 "[ . 1 . 2]" 1
1997 1 118 THR HB 1 119 GLU H . . 3.790 3.840 3.560 3.878 0.088 5 0 "[ . 1 . 2]" 1
1998 1 119 GLU H 1 119 GLU HB2 . . 4.070 3.459 2.971 4.058 . 0 0 "[ . 1 . 2]" 1
1999 1 119 GLU H 1 119 GLU HG2 . . 5.290 4.280 2.926 5.356 0.066 15 0 "[ . 1 . 2]" 1
2000 1 119 GLU H 1 119 GLU HG3 . . 5.300 4.457 3.485 5.094 . 0 0 "[ . 1 . 2]" 1
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