NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
523960 |
2llg   |
18047 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2llg
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 2261
_Distance_constraint_stats_list.Viol_count 4174
_Distance_constraint_stats_list.Viol_total 7218.786
_Distance_constraint_stats_list.Viol_max 1.110
_Distance_constraint_stats_list.Viol_rms 0.0464
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0080
_Distance_constraint_stats_list.Viol_average_violations_only 0.0865
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 ASP 0.336 0.199 5 0 "[ . 1 . 2]"
1 3 GLU 3.252 0.524 4 4 "[ +. *- 1 .* 2]"
1 4 VAL 2.696 0.445 8 0 "[ . 1 . 2]"
1 5 LEU 2.791 0.453 17 0 "[ . 1 . 2]"
1 6 ALA 1.686 0.199 7 0 "[ . 1 . 2]"
1 7 THR 3.709 0.453 17 0 "[ . 1 . 2]"
1 8 SER 3.543 0.460 18 0 "[ . 1 . 2]"
1 9 ILE 4.143 0.460 18 0 "[ . 1 . 2]"
1 10 GLY 0.906 0.054 18 0 "[ . 1 . 2]"
1 11 THR 1.007 0.131 16 0 "[ . 1 . 2]"
1 12 TYR 2.728 0.678 17 1 "[ . 1 . + 2]"
1 13 GLU 2.823 0.249 9 0 "[ . 1 . 2]"
1 14 ASN 1.806 0.118 17 0 "[ . 1 . 2]"
1 15 ARG 3.942 0.460 6 0 "[ . 1 . 2]"
1 16 THR 3.685 0.156 1 0 "[ . 1 . 2]"
1 17 LEU 3.021 0.678 17 1 "[ . 1 . + 2]"
1 18 LEU 3.820 0.409 9 0 "[ . 1 . 2]"
1 19 VAL 0.997 0.203 7 0 "[ . 1 . 2]"
1 20 PRO 3.373 0.409 9 0 "[ . 1 . 2]"
1 21 ASP 1.243 0.203 7 0 "[ . 1 . 2]"
1 22 GLY 0.827 0.108 13 0 "[ . 1 . 2]"
1 23 ARG 2.460 0.102 18 0 "[ . 1 . 2]"
1 24 LEU 3.636 0.430 11 0 "[ . 1 . 2]"
1 25 ALA 1.030 0.131 8 0 "[ . 1 . 2]"
1 26 LEU 5.550 0.265 9 0 "[ . 1 . 2]"
1 27 THR 4.779 0.190 15 0 "[ . 1 . 2]"
1 28 ALA 5.576 1.089 20 2 "[ . 1 - +]"
1 29 LEU 6.784 0.614 20 1 "[ . 1 . +]"
1 30 HIS 7.047 0.649 20 1 "[ . 1 . +]"
1 31 LYS 2.610 0.386 8 0 "[ . 1 . 2]"
1 32 GLY 5.632 0.468 7 0 "[ . 1 . 2]"
1 33 LYS 12.424 0.597 16 7 "[ *-*.* 1 * .+ * 2]"
1 34 ASP 7.484 0.597 16 7 "[ *-*.* 1 * .+ * 2]"
1 35 TYR 6.880 1.110 19 1 "[ . 1 . +2]"
1 36 GLN 1.764 0.087 19 0 "[ . 1 . 2]"
1 37 GLY 3.315 0.277 17 0 "[ . 1 . 2]"
1 38 LYS 7.113 0.474 19 0 "[ . 1 . 2]"
1 39 PRO 5.836 0.249 18 0 "[ . 1 . 2]"
1 40 MET 2.979 0.165 17 0 "[ . 1 . 2]"
1 41 PHE 3.609 0.184 20 0 "[ . 1 . 2]"
1 42 TYR 7.867 0.614 20 1 "[ . 1 . +]"
1 43 VAL 4.394 0.393 15 0 "[ . 1 . 2]"
1 44 LEU 10.183 1.089 20 2 "[ . 1 * +]"
1 45 PHE 5.644 0.238 9 0 "[ . 1 . 2]"
1 46 GLU 1.629 0.270 8 0 "[ . 1 . 2]"
1 47 LEU 1.562 0.194 18 0 "[ . 1 . 2]"
1 48 THR 7.001 0.517 5 1 "[ + 1 . 2]"
1 49 ASN 7.266 0.670 3 1 "[ + . 1 . 2]"
1 50 THR 5.295 0.260 12 0 "[ . 1 . 2]"
1 51 THR 6.683 0.546 13 1 "[ . 1 + . 2]"
1 52 GLU 3.166 0.317 16 0 "[ . 1 . 2]"
1 53 LYS 1.872 0.673 3 1 "[ + . 1 . 2]"
1 54 THR 11.350 0.587 14 1 "[ . 1 +. 2]"
1 55 GLN 12.597 0.673 3 2 "[ + . 1 - . 2]"
1 56 ASN 7.415 0.659 2 4 "[ + . - 1* * 2]"
1 57 ILE 2.566 0.573 13 2 "[ . 1 + . -]"
1 58 GLN 2.914 0.555 14 2 "[ . 1 +.- 2]"
1 59 LEU 3.433 0.659 2 4 "[ + . - 1* * 2]"
1 60 MET 2.271 0.168 16 0 "[ . 1 . 2]"
1 61 ILE 6.470 0.573 10 1 "[ . + . 2]"
1 62 GLN 1.717 0.573 10 1 "[ . + . 2]"
1 63 SER 0.095 0.056 15 0 "[ . 1 . 2]"
1 64 PHE 8.868 0.834 17 9 "[ * *.* *1* * - +* 2]"
1 65 MET 9.404 0.834 17 9 "[ * *.* *1* * - +* 2]"
1 66 GLU 9.050 0.833 16 7 "[ - . * 1 ** .+ **2]"
1 67 VAL 6.148 0.436 20 0 "[ . 1 . 2]"
1 68 SER 6.565 0.472 10 0 "[ . 1 . 2]"
1 69 GLN 5.351 0.645 14 1 "[ . 1 +. 2]"
1 70 THR 3.039 0.377 9 0 "[ . 1 . 2]"
1 71 VAL 6.076 0.552 12 2 "[ - 1 + . 2]"
1 72 HIS 1.997 0.755 7 3 "[- . + 1 * 2]"
1 73 GLY 1.258 0.602 17 1 "[ . 1 . + 2]"
1 74 LYS 10.835 0.782 7 5 "[- . + 1 * * * 2]"
1 75 ALA 3.083 0.251 15 0 "[ . 1 . 2]"
1 76 GLN 6.635 0.508 5 1 "[ + 1 . 2]"
1 77 ASN 3.771 0.306 14 0 "[ . 1 . 2]"
1 78 LEU 8.886 0.671 11 3 "[ . 1+ -*. 2]"
1 79 GLN 7.565 0.838 8 8 "[-** .* + ** . *2]"
1 80 TYR 4.076 0.814 19 1 "[ . 1 . +2]"
1 81 ALA 2.378 0.919 19 1 "[ . 1 . +2]"
1 82 VAL 10.261 1.110 19 1 "[ . 1 . +2]"
1 83 LEU 4.382 0.777 19 1 "[ . 1 . +2]"
1 84 THR 6.428 0.801 19 1 "[ . 1 . +2]"
1 85 ASP 1.664 0.293 6 0 "[ . 1 . 2]"
1 86 SER 0.974 0.110 15 0 "[ . 1 . 2]"
1 87 PRO 4.548 0.383 13 0 "[ . 1 . 2]"
1 88 PHE 6.572 0.431 16 0 "[ . 1 . 2]"
1 89 GLN 6.134 0.698 11 2 "[ - 1+ . 2]"
1 90 ASP 2.651 0.508 13 1 "[ . 1 + . 2]"
1 91 LYS 12.446 0.529 18 3 "[ * . 1 - . + 2]"
1 92 LEU 3.386 0.402 6 0 "[ . 1 . 2]"
1 93 ASP 5.102 0.698 11 2 "[ - 1+ . 2]"
1 94 ARG 8.604 0.611 2 6 "[ + * *1 * .* -]"
1 95 LEU 3.148 0.555 14 2 "[ . 1 +.- 2]"
1 96 ALA 0.185 0.054 10 0 "[ . 1 . 2]"
1 97 ASP 0.353 0.041 17 0 "[ . 1 . 2]"
1 98 GLU 8.429 0.516 11 1 "[ . 1+ . 2]"
1 99 ILE 7.005 0.516 11 1 "[ . 1+ . 2]"
1 100 ASN 12.739 0.587 14 7 "[ *. * - +** * 2]"
1 101 PRO 4.399 0.299 3 0 "[ . 1 . 2]"
1 102 GLY 4.490 0.170 17 0 "[ . 1 . 2]"
1 103 GLU 12.229 0.561 15 7 "[ *. * - *+* * 2]"
1 104 THR 1.514 0.291 5 0 "[ . 1 . 2]"
1 105 ILE 7.927 0.859 13 5 "[ -* 1 + .* *2]"
1 106 GLN 4.935 0.859 13 4 "[ .* 1 + .* -2]"
1 107 GLY 4.901 0.529 18 2 "[ - . 1 . + 2]"
1 108 ALA 1.646 0.489 1 0 "[ . 1 . 2]"
1 109 TYR 5.320 0.393 15 0 "[ . 1 . 2]"
1 110 PRO 1.156 0.211 12 0 "[ . 1 . 2]"
1 111 TYR 5.388 0.287 13 0 "[ . 1 . 2]"
1 112 GLU 2.893 0.360 17 0 "[ . 1 . 2]"
1 113 PHE 5.300 0.360 17 0 "[ . 1 . 2]"
1 114 ILE 2.289 0.297 5 0 "[ . 1 . 2]"
1 115 ASN 3.250 0.753 2 1 "[ + . 1 . 2]"
1 116 GLU 0.414 0.068 1 0 "[ . 1 . 2]"
1 117 ASN 10.673 0.626 3 2 "[ + . - 1 . 2]"
1 118 LYS 12.321 0.753 2 3 "[ +* . - 1 . 2]"
1 119 PRO 3.305 0.135 17 0 "[ . 1 . 2]"
1 120 VAL 2.256 0.564 17 1 "[ . 1 . + 2]"
1 121 HIS 3.334 0.410 14 0 "[ . 1 . 2]"
1 122 PHE 4.129 0.564 17 1 "[ . 1 . + 2]"
1 123 LYS 3.219 0.637 10 2 "[ . + - 2]"
1 124 PHE 3.836 0.637 10 3 "[ . +* - 2]"
1 125 ARG 5.369 0.413 18 0 "[ . 1 . 2]"
1 126 ASP 0.266 0.118 4 0 "[ . 1 . 2]"
1 127 ARG 0.266 0.118 4 0 "[ . 1 . 2]"
1 130 SER 5.595 0.868 3 3 "[ + . 1 - * 2]"
1 131 LEU 4.080 0.868 3 3 "[ + . 1 - * 2]"
1 132 ASP 1.914 0.444 11 0 "[ . 1 . 2]"
1 133 GLU 0.030 0.026 13 0 "[ . 1 . 2]"
1 134 PRO 1.075 0.169 11 0 "[ . 1 . 2]"
1 135 ILE 2.052 0.234 10 0 "[ . 1 . 2]"
1 136 ALA 1.609 0.234 10 0 "[ . 1 . 2]"
1 137 SER 2.348 0.655 11 2 "[ . 1+- . 2]"
1 138 GLU 8.360 0.655 11 2 "[ . 1+- . 2]"
1 139 GLU 2.803 0.299 16 0 "[ . 1 . 2]"
1 140 ILE 2.134 0.287 16 0 "[ . 1 . 2]"
1 141 THR 2.130 0.323 13 0 "[ . 1 . 2]"
1 142 ILE 9.829 0.454 10 0 "[ . 1 . 2]"
1 143 THR 3.493 0.454 10 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 ASP HA 1 3 GLU H . . 3.020 2.537 2.146 2.979 . 0 0 "[ . 1 . 2]" 1
2 1 2 ASP QB 1 3 GLU H . . 4.680 3.605 2.211 4.023 . 0 0 "[ . 1 . 2]" 1
3 1 2 ASP HB3 1 3 GLU H . . 4.410 4.090 2.588 4.609 0.199 5 0 "[ . 1 . 2]" 1
4 1 3 GLU H 1 3 GLU HB2 . . 3.240 3.229 2.729 3.764 0.524 4 4 "[ +. *- 1 .* 2]" 1
5 1 3 GLU H 1 3 GLU HB3 . . 3.800 3.455 2.511 3.802 0.002 18 0 "[ . 1 . 2]" 1
6 1 3 GLU H 1 3 GLU QG . . 4.360 3.557 1.998 4.344 . 0 0 "[ . 1 . 2]" 1
7 1 3 GLU H 1 4 VAL H . . 4.050 3.601 2.776 4.053 0.003 4 0 "[ . 1 . 2]" 1
8 1 3 GLU HA 1 4 VAL H . . 2.730 2.314 2.140 2.719 . 0 0 "[ . 1 . 2]" 1
9 1 3 GLU HB3 1 3 GLU QG . . 2.620 2.335 2.131 2.524 . 0 0 "[ . 1 . 2]" 1
10 1 3 GLU QG 1 4 VAL H . . 5.250 3.785 2.811 4.581 . 0 0 "[ . 1 . 2]" 1
11 1 4 VAL H 1 4 VAL HB . . 3.620 3.429 2.629 3.946 0.326 18 0 "[ . 1 . 2]" 1
12 1 4 VAL H 1 4 VAL MG2 . . 3.730 2.416 1.937 3.651 . 0 0 "[ . 1 . 2]" 1
13 1 4 VAL HA 1 4 VAL MG1 . . 3.220 2.315 1.980 3.114 . 0 0 "[ . 1 . 2]" 1
14 1 4 VAL HA 1 4 VAL MG2 . . 3.390 2.951 2.013 3.202 . 0 0 "[ . 1 . 2]" 1
15 1 4 VAL HA 1 5 LEU H . . 2.610 2.416 2.190 2.675 0.065 18 0 "[ . 1 . 2]" 1
16 1 4 VAL HA 1 5 LEU HG . . 4.080 3.808 3.337 4.126 0.046 7 0 "[ . 1 . 2]" 1
17 1 4 VAL HA 1 8 SER H . . 5.420 5.111 4.652 5.453 0.033 17 0 "[ . 1 . 2]" 1
18 1 4 VAL HB 1 5 LEU H . . 4.070 2.799 1.943 3.988 . 0 0 "[ . 1 . 2]" 1
19 1 4 VAL HB 1 8 SER H . . 3.160 3.175 2.780 3.605 0.445 8 0 "[ . 1 . 2]" 1
20 1 4 VAL MG1 1 5 LEU H . . 3.680 3.138 1.896 3.847 0.167 7 0 "[ . 1 . 2]" 1
21 1 4 VAL MG1 1 8 SER H . . 5.110 3.605 1.825 4.820 . 0 0 "[ . 1 . 2]" 1
22 1 5 LEU H 1 5 LEU HB2 . . 2.990 2.669 2.428 3.312 0.322 7 0 "[ . 1 . 2]" 1
23 1 5 LEU H 1 7 THR H . . 4.690 4.272 3.367 5.143 0.453 17 0 "[ . 1 . 2]" 1
24 1 5 LEU H 1 8 SER QB . . 5.340 4.511 1.855 5.530 0.190 8 0 "[ . 1 . 2]" 1
25 1 5 LEU HA 1 5 LEU QD . . 3.340 2.744 1.967 3.185 . 0 0 "[ . 1 . 2]" 1
26 1 5 LEU HA 1 5 LEU HG . . 2.990 2.721 2.552 2.993 0.003 8 0 "[ . 1 . 2]" 1
27 1 5 LEU HA 1 6 ALA H . . 2.610 2.324 2.140 2.801 0.191 17 0 "[ . 1 . 2]" 1
28 1 5 LEU HA 1 6 ALA MB . . 5.060 4.139 3.936 4.474 . 0 0 "[ . 1 . 2]" 1
29 1 5 LEU HB2 1 8 SER H . . 5.340 4.560 3.411 5.355 0.015 6 0 "[ . 1 . 2]" 1
30 1 5 LEU HB3 1 6 ALA H . . 3.480 2.911 1.765 3.661 0.181 8 0 "[ . 1 . 2]" 1
31 1 5 LEU QD 1 6 ALA H . . 4.470 3.741 2.802 4.316 . 0 0 "[ . 1 . 2]" 1
32 1 6 ALA H 1 6 ALA MB . . 2.960 2.672 2.042 2.939 . 0 0 "[ . 1 . 2]" 1
33 1 6 ALA MB 1 7 THR H . . 3.520 3.143 1.993 3.719 0.199 7 0 "[ . 1 . 2]" 1
34 1 6 ALA MB 1 8 SER H . . 5.270 4.215 3.377 5.384 0.114 18 0 "[ . 1 . 2]" 1
35 1 6 ALA MB 1 135 ILE HA . . 5.470 4.783 2.887 5.496 0.026 18 0 "[ . 1 . 2]" 1
36 1 7 THR H 1 7 THR HA . . 2.770 2.481 2.276 2.893 0.123 14 0 "[ . 1 . 2]" 1
37 1 7 THR H 1 7 THR HB . . 4.170 3.788 2.996 4.006 . 0 0 "[ . 1 . 2]" 1
38 1 7 THR H 1 7 THR MG . . 3.590 3.486 2.578 3.946 0.356 18 0 "[ . 1 . 2]" 1
39 1 7 THR H 1 8 SER QB . . 5.500 4.831 3.761 5.503 0.003 3 0 "[ . 1 . 2]" 1
40 1 7 THR HA 1 7 THR MG . . 3.120 2.246 1.958 3.205 0.085 17 0 "[ . 1 . 2]" 1
41 1 7 THR HA 1 8 SER H . . 2.770 2.632 2.262 2.842 0.072 13 0 "[ . 1 . 2]" 1
42 1 7 THR HA 1 8 SER QB . . 4.590 4.081 3.723 4.625 0.035 20 0 "[ . 1 . 2]" 1
43 1 7 THR MG 1 8 SER H . . 4.430 4.111 3.385 4.387 . 0 0 "[ . 1 . 2]" 1
44 1 8 SER H 1 8 SER QB . . 3.000 2.755 2.250 3.052 0.052 1 0 "[ . 1 . 2]" 1
45 1 8 SER H 1 9 ILE HB . . 5.500 5.138 4.432 5.960 0.460 18 0 "[ . 1 . 2]" 1
46 1 8 SER HA 1 8 SER QB . . 2.700 2.425 2.165 2.539 . 0 0 "[ . 1 . 2]" 1
47 1 8 SER HA 1 9 ILE H . . 2.930 2.687 2.158 3.044 0.114 14 0 "[ . 1 . 2]" 1
48 1 8 SER HA 1 9 ILE QG . . 5.250 4.525 3.916 4.826 . 0 0 "[ . 1 . 2]" 1
49 1 8 SER QB 1 9 ILE H . . 3.790 3.733 1.953 3.967 0.177 14 0 "[ . 1 . 2]" 1
50 1 8 SER QB 1 9 ILE MD . . 4.120 3.897 3.076 4.145 0.025 1 0 "[ . 1 . 2]" 1
51 1 9 ILE H 1 9 ILE HB . . 3.310 2.664 2.500 2.883 . 0 0 "[ . 1 . 2]" 1
52 1 9 ILE H 1 9 ILE MD . . 3.960 3.470 2.556 4.006 0.046 17 0 "[ . 1 . 2]" 1
53 1 9 ILE H 1 9 ILE QG . . 3.390 2.794 2.040 3.310 . 0 0 "[ . 1 . 2]" 1
54 1 9 ILE H 1 9 ILE MG . . 3.960 3.844 3.770 3.953 . 0 0 "[ . 1 . 2]" 1
55 1 9 ILE H 1 10 GLY QA . . 5.360 4.339 3.933 4.842 . 0 0 "[ . 1 . 2]" 1
56 1 9 ILE HA 1 9 ILE HB . . 2.970 3.020 3.017 3.021 0.051 1 0 "[ . 1 . 2]" 1
57 1 9 ILE HA 1 9 ILE MD . . 3.650 2.410 1.956 3.736 0.086 13 0 "[ . 1 . 2]" 1
58 1 9 ILE HA 1 9 ILE QG . . 3.750 2.774 2.294 3.024 . 0 0 "[ . 1 . 2]" 1
59 1 9 ILE HA 1 9 ILE MG . . 3.030 2.340 2.259 2.427 . 0 0 "[ . 1 . 2]" 1
60 1 9 ILE HA 1 10 GLY H . . 3.520 3.563 3.557 3.574 0.054 18 0 "[ . 1 . 2]" 1
61 1 9 ILE HB 1 9 ILE MD . . 3.180 2.927 2.010 3.228 0.048 7 0 "[ . 1 . 2]" 1
62 1 9 ILE HB 1 10 GLY H . . 2.950 1.967 1.942 2.275 . 0 0 "[ . 1 . 2]" 1
63 1 9 ILE HB 1 135 ILE MD . . 4.900 4.096 2.395 4.930 0.030 4 0 "[ . 1 . 2]" 1
64 1 9 ILE MD 1 10 GLY H . . 4.770 4.211 3.335 4.549 . 0 0 "[ . 1 . 2]" 1
65 1 9 ILE QG 1 9 ILE MG . . 2.950 2.199 2.034 2.303 . 0 0 "[ . 1 . 2]" 1
66 1 9 ILE QG 1 10 GLY H . . 5.500 3.823 3.650 4.028 . 0 0 "[ . 1 . 2]" 1
67 1 9 ILE MG 1 10 GLY H . . 3.190 2.768 2.423 3.092 . 0 0 "[ . 1 . 2]" 1
68 1 9 ILE MG 1 11 THR H . . 5.500 5.308 4.133 5.514 0.014 20 0 "[ . 1 . 2]" 1
69 1 9 ILE MG 1 19 VAL HA . . 4.390 3.878 3.129 4.397 0.007 20 0 "[ . 1 . 2]" 1
70 1 10 GLY H 1 11 THR H . . 4.570 4.324 3.670 4.585 0.015 19 0 "[ . 1 . 2]" 1
71 1 10 GLY H 1 19 VAL HA . . 5.360 4.945 4.138 5.371 0.011 17 0 "[ . 1 . 2]" 1
72 1 10 GLY H 1 135 ILE MD . . 4.340 3.174 1.949 4.248 . 0 0 "[ . 1 . 2]" 1
73 1 10 GLY QA 1 11 THR H . . 3.260 2.223 2.109 2.282 . 0 0 "[ . 1 . 2]" 1
74 1 10 GLY QA 1 18 LEU QD . . 3.810 3.222 1.940 3.722 . 0 0 "[ . 1 . 2]" 1
75 1 10 GLY QA 1 19 VAL HA . . 3.990 2.991 2.563 3.351 . 0 0 "[ . 1 . 2]" 1
76 1 10 GLY QA 1 135 ILE MD . . 4.090 2.991 2.279 3.994 . 0 0 "[ . 1 . 2]" 1
77 1 11 THR H 1 11 THR MG . . 4.640 3.715 3.278 3.870 . 0 0 "[ . 1 . 2]" 1
78 1 11 THR H 1 17 LEU QD . . 5.140 4.044 2.748 5.098 . 0 0 "[ . 1 . 2]" 1
79 1 11 THR H 1 18 LEU H . . 4.050 3.125 2.654 3.959 . 0 0 "[ . 1 . 2]" 1
80 1 11 THR H 1 18 LEU HB2 . . 4.040 3.750 2.965 4.124 0.084 17 0 "[ . 1 . 2]" 1
81 1 11 THR H 1 18 LEU HB3 . . 4.110 2.700 2.215 3.289 . 0 0 "[ . 1 . 2]" 1
82 1 11 THR H 1 18 LEU QD . . 4.320 3.768 3.193 4.279 . 0 0 "[ . 1 . 2]" 1
83 1 11 THR H 1 19 VAL HA . . 4.570 4.480 3.750 4.596 0.026 4 0 "[ . 1 . 2]" 1
84 1 11 THR HA 1 11 THR MG . . 2.900 2.034 1.967 2.173 . 0 0 "[ . 1 . 2]" 1
85 1 11 THR HA 1 12 TYR H . . 2.810 2.241 2.159 2.430 . 0 0 "[ . 1 . 2]" 1
86 1 11 THR HA 1 12 TYR HA . . 4.480 4.428 4.395 4.495 0.015 13 0 "[ . 1 . 2]" 1
87 1 11 THR HA 1 12 TYR QB . . 5.500 4.062 3.912 4.482 . 0 0 "[ . 1 . 2]" 1
88 1 11 THR HA 1 13 GLU QG . . 5.220 4.995 4.543 5.298 0.078 17 0 "[ . 1 . 2]" 1
89 1 11 THR HA 1 135 ILE MD . . 4.410 3.436 1.943 4.421 0.011 1 0 "[ . 1 . 2]" 1
90 1 11 THR HB 1 12 TYR H . . 3.160 3.059 2.651 3.291 0.131 16 0 "[ . 1 . 2]" 1
91 1 11 THR HB 1 13 GLU QG . . 4.180 3.133 2.782 3.545 . 0 0 "[ . 1 . 2]" 1
92 1 11 THR HB 1 18 LEU H . . 5.260 4.710 3.467 5.297 0.037 17 0 "[ . 1 . 2]" 1
93 1 11 THR HB 1 18 LEU HB3 . . 5.350 4.557 3.673 5.325 . 0 0 "[ . 1 . 2]" 1
94 1 11 THR MG 1 12 TYR H . . 3.450 3.116 2.484 3.481 0.031 16 0 "[ . 1 . 2]" 1
95 1 11 THR MG 1 13 GLU QG . . 4.590 3.705 2.940 4.111 . 0 0 "[ . 1 . 2]" 1
96 1 12 TYR H 1 12 TYR QB . . 3.830 2.581 2.417 2.811 . 0 0 "[ . 1 . 2]" 1
97 1 12 TYR H 1 12 TYR QD . . 5.350 3.977 2.294 4.382 . 0 0 "[ . 1 . 2]" 1
98 1 12 TYR H 1 13 GLU H . . 4.200 3.871 3.228 4.300 0.100 17 0 "[ . 1 . 2]" 1
99 1 12 TYR H 1 13 GLU QG . . 5.500 3.850 3.304 4.533 . 0 0 "[ . 1 . 2]" 1
100 1 12 TYR H 1 136 ALA MB . . 5.500 4.498 3.602 5.381 . 0 0 "[ . 1 . 2]" 1
101 1 12 TYR HA 1 12 TYR QD . . 3.980 2.529 2.008 3.700 . 0 0 "[ . 1 . 2]" 1
102 1 12 TYR HA 1 13 GLU H . . 2.930 2.220 2.142 2.510 . 0 0 "[ . 1 . 2]" 1
103 1 12 TYR HA 1 13 GLU HA . . 4.710 4.339 4.315 4.433 . 0 0 "[ . 1 . 2]" 1
104 1 12 TYR HA 1 13 GLU HB3 . . 4.900 4.701 4.626 4.937 0.037 9 0 "[ . 1 . 2]" 1
105 1 12 TYR HA 1 13 GLU QG . . 4.800 4.137 3.621 4.693 . 0 0 "[ . 1 . 2]" 1
106 1 12 TYR HA 1 16 THR H . . 4.930 4.545 4.142 4.905 . 0 0 "[ . 1 . 2]" 1
107 1 12 TYR HA 1 17 LEU HA . . 4.190 2.562 2.317 3.081 . 0 0 "[ . 1 . 2]" 1
108 1 12 TYR HA 1 17 LEU QD . . 4.330 2.798 1.925 3.505 . 0 0 "[ . 1 . 2]" 1
109 1 12 TYR HA 1 18 LEU H . . 4.330 3.661 2.557 3.943 . 0 0 "[ . 1 . 2]" 1
110 1 12 TYR HA 1 136 ALA MB . . 5.080 4.513 4.094 4.868 . 0 0 "[ . 1 . 2]" 1
111 1 12 TYR QB 1 13 GLU H . . 4.420 3.900 3.234 4.016 . 0 0 "[ . 1 . 2]" 1
112 1 12 TYR QB 1 17 LEU QD . . 3.590 2.148 1.685 2.685 . 0 0 "[ . 1 . 2]" 1
113 1 12 TYR QB 1 135 ILE MD . . 5.400 4.101 3.050 4.948 . 0 0 "[ . 1 . 2]" 1
114 1 12 TYR QB 1 135 ILE MG . . 4.810 3.233 2.152 4.259 . 0 0 "[ . 1 . 2]" 1
115 1 12 TYR QB 1 136 ALA MB . . 3.190 2.209 1.894 2.661 . 0 0 "[ . 1 . 2]" 1
116 1 12 TYR QD 1 13 GLU H . . 4.600 3.706 3.030 4.849 0.249 9 0 "[ . 1 . 2]" 1
117 1 12 TYR QD 1 17 LEU H . . 5.500 4.856 4.060 5.591 0.091 9 0 "[ . 1 . 2]" 1
118 1 12 TYR QD 1 17 LEU HB3 . . 4.920 4.325 2.786 5.598 0.678 17 1 "[ . 1 . + 2]" 1
119 1 12 TYR QD 1 17 LEU QD . . 4.310 2.121 1.901 2.681 . 0 0 "[ . 1 . 2]" 1
120 1 12 TYR QD 1 18 LEU H . . 5.180 4.469 2.168 5.199 0.019 18 0 "[ . 1 . 2]" 1
121 1 12 TYR QD 1 136 ALA MB . . 3.700 2.242 1.881 3.116 . 0 0 "[ . 1 . 2]" 1
122 1 13 GLU H 1 13 GLU HB3 . . 3.740 3.480 3.212 3.613 . 0 0 "[ . 1 . 2]" 1
123 1 13 GLU H 1 13 GLU QG . . 3.800 2.722 2.510 2.852 . 0 0 "[ . 1 . 2]" 1
124 1 13 GLU H 1 14 ASN H . . 4.590 4.360 4.348 4.407 . 0 0 "[ . 1 . 2]" 1
125 1 13 GLU H 1 14 ASN HB2 . . 4.810 4.660 4.458 4.795 . 0 0 "[ . 1 . 2]" 1
126 1 13 GLU H 1 15 ARG H . . 5.160 4.520 4.279 4.931 . 0 0 "[ . 1 . 2]" 1
127 1 13 GLU H 1 16 THR H . . 3.500 3.238 2.990 3.531 0.031 9 0 "[ . 1 . 2]" 1
128 1 13 GLU H 1 16 THR HB . . 4.400 4.093 3.462 4.427 0.027 15 0 "[ . 1 . 2]" 1
129 1 13 GLU H 1 16 THR MG . . 4.840 4.672 4.174 4.848 0.008 9 0 "[ . 1 . 2]" 1
130 1 13 GLU H 1 18 LEU H . . 5.370 4.931 4.310 5.385 0.015 8 0 "[ . 1 . 2]" 1
131 1 13 GLU HA 1 13 GLU QG . . 3.270 3.337 3.324 3.340 0.070 7 0 "[ . 1 . 2]" 1
132 1 13 GLU HA 1 14 ASN H . . 2.830 2.517 2.456 2.603 . 0 0 "[ . 1 . 2]" 1
133 1 13 GLU HA 1 15 ARG H . . 4.080 3.285 3.140 3.478 . 0 0 "[ . 1 . 2]" 1
134 1 13 GLU HA 1 16 THR H . . 5.200 3.954 3.730 4.188 . 0 0 "[ . 1 . 2]" 1
135 1 13 GLU HB2 1 14 ASN H . . 3.640 2.238 2.040 2.339 . 0 0 "[ . 1 . 2]" 1
136 1 13 GLU HB2 1 14 ASN HD21 . . 5.270 4.967 4.814 5.165 . 0 0 "[ . 1 . 2]" 1
137 1 13 GLU HB3 1 13 GLU QG . . 2.610 2.371 2.297 2.496 . 0 0 "[ . 1 . 2]" 1
138 1 13 GLU HB3 1 14 ASN H . . 3.670 3.687 3.525 3.743 0.073 20 0 "[ . 1 . 2]" 1
139 1 13 GLU HB3 1 14 ASN HD22 . . 5.390 5.323 5.223 5.396 0.006 14 0 "[ . 1 . 2]" 1
140 1 13 GLU QG 1 14 ASN H . . 3.790 3.209 2.804 3.360 . 0 0 "[ . 1 . 2]" 1
141 1 13 GLU QG 1 14 ASN HA . . 4.640 4.379 3.990 4.553 . 0 0 "[ . 1 . 2]" 1
142 1 13 GLU QG 1 14 ASN HB2 . . 4.310 3.343 3.138 3.595 . 0 0 "[ . 1 . 2]" 1
143 1 13 GLU QG 1 14 ASN HB3 . . 4.360 4.336 4.180 4.478 0.118 17 0 "[ . 1 . 2]" 1
144 1 13 GLU QG 1 14 ASN HD21 . . 4.380 2.844 2.704 2.986 . 0 0 "[ . 1 . 2]" 1
145 1 13 GLU QG 1 14 ASN HD22 . . 4.480 2.491 2.393 2.605 . 0 0 "[ . 1 . 2]" 1
146 1 14 ASN H 1 14 ASN HA . . 2.710 2.275 2.274 2.278 . 0 0 "[ . 1 . 2]" 1
147 1 14 ASN H 1 14 ASN HB2 . . 3.690 3.687 3.607 3.744 0.054 17 0 "[ . 1 . 2]" 1
148 1 14 ASN H 1 14 ASN HB3 . . 4.200 3.967 3.887 4.016 . 0 0 "[ . 1 . 2]" 1
149 1 14 ASN H 1 14 ASN HD21 . . 5.100 4.766 4.579 4.824 . 0 0 "[ . 1 . 2]" 1
150 1 14 ASN H 1 14 ASN HD22 . . 5.500 4.698 4.626 4.767 . 0 0 "[ . 1 . 2]" 1
151 1 14 ASN H 1 15 ARG H . . 3.620 2.713 2.662 2.774 . 0 0 "[ . 1 . 2]" 1
152 1 14 ASN H 1 15 ARG HA . . 4.940 4.973 4.926 5.040 0.100 17 0 "[ . 1 . 2]" 1
153 1 14 ASN H 1 15 ARG HB2 . . 5.500 5.308 5.108 5.532 0.032 20 0 "[ . 1 . 2]" 1
154 1 14 ASN H 1 16 THR H . . 5.150 4.487 4.088 4.727 . 0 0 "[ . 1 . 2]" 1
155 1 14 ASN HA 1 14 ASN HB3 . . 2.980 2.374 2.326 2.425 . 0 0 "[ . 1 . 2]" 1
156 1 14 ASN HA 1 14 ASN HD21 . . 4.570 4.537 4.474 4.573 0.003 17 0 "[ . 1 . 2]" 1
157 1 14 ASN HA 1 14 ASN HD22 . . 5.210 4.850 4.752 4.936 . 0 0 "[ . 1 . 2]" 1
158 1 14 ASN HA 1 15 ARG H . . 3.260 2.901 2.805 2.981 . 0 0 "[ . 1 . 2]" 1
159 1 14 ASN HA 1 15 ARG HA . . 4.950 4.865 4.815 4.904 . 0 0 "[ . 1 . 2]" 1
160 1 14 ASN HA 1 15 ARG HB2 . . 4.620 4.014 3.880 4.166 . 0 0 "[ . 1 . 2]" 1
161 1 14 ASN HA 1 16 THR H . . 5.040 4.858 4.302 5.069 0.029 9 0 "[ . 1 . 2]" 1
162 1 14 ASN HB2 1 14 ASN HD21 . . 3.330 2.203 2.157 2.224 . 0 0 "[ . 1 . 2]" 1
163 1 14 ASN HB2 1 14 ASN HD22 . . 3.980 3.468 3.450 3.476 . 0 0 "[ . 1 . 2]" 1
164 1 14 ASN HB2 1 15 ARG H . . 4.400 4.108 4.018 4.206 . 0 0 "[ . 1 . 2]" 1
165 1 14 ASN HB2 1 16 THR MG . . 5.500 4.760 4.664 4.960 . 0 0 "[ . 1 . 2]" 1
166 1 14 ASN HB3 1 14 ASN HD21 . . 3.540 2.966 2.928 3.055 . 0 0 "[ . 1 . 2]" 1
167 1 14 ASN HB3 1 14 ASN HD22 . . 4.020 3.801 3.783 3.844 . 0 0 "[ . 1 . 2]" 1
168 1 14 ASN HB3 1 15 ARG H . . 4.840 4.533 4.496 4.570 . 0 0 "[ . 1 . 2]" 1
169 1 14 ASN HD21 1 16 THR MG . . 5.500 5.424 5.326 5.509 0.009 20 0 "[ . 1 . 2]" 1
170 1 15 ARG H 1 15 ARG HB2 . . 3.550 3.170 2.973 3.399 . 0 0 "[ . 1 . 2]" 1
171 1 15 ARG H 1 15 ARG HD3 . . 4.600 3.927 2.210 4.627 0.027 19 0 "[ . 1 . 2]" 1
172 1 15 ARG H 1 16 THR H . . 3.590 2.758 2.635 2.959 . 0 0 "[ . 1 . 2]" 1
173 1 15 ARG HA 1 15 ARG HD2 . . 3.810 3.448 2.241 3.811 0.001 19 0 "[ . 1 . 2]" 1
174 1 15 ARG HA 1 15 ARG HD3 . . 3.750 2.297 1.997 3.210 . 0 0 "[ . 1 . 2]" 1
175 1 15 ARG HA 1 26 LEU H . . 5.040 4.277 3.406 4.838 . 0 0 "[ . 1 . 2]" 1
176 1 15 ARG HA 1 26 LEU HB2 . . 3.660 3.176 2.526 3.674 0.014 15 0 "[ . 1 . 2]" 1
177 1 15 ARG HA 1 26 LEU QD . . 4.110 2.423 1.953 2.812 . 0 0 "[ . 1 . 2]" 1
178 1 15 ARG HB2 1 15 ARG HD3 . . 3.730 3.279 2.430 4.190 0.460 6 0 "[ . 1 . 2]" 1
179 1 15 ARG HB2 1 15 ARG HE . . 4.310 2.924 1.963 4.382 0.072 19 0 "[ . 1 . 2]" 1
180 1 15 ARG HB3 1 15 ARG HE . . 4.390 3.782 2.912 4.429 0.039 17 0 "[ . 1 . 2]" 1
181 1 15 ARG HB3 1 16 THR H . . 4.200 4.267 4.187 4.356 0.156 1 0 "[ . 1 . 2]" 1
182 1 15 ARG HD3 1 26 LEU H . . 5.500 5.012 4.070 5.765 0.265 9 0 "[ . 1 . 2]" 1
183 1 15 ARG HD3 1 26 LEU HB2 . . 4.730 2.903 1.990 3.865 . 0 0 "[ . 1 . 2]" 1
184 1 15 ARG HD3 1 26 LEU QD . . 3.810 2.920 2.073 3.677 . 0 0 "[ . 1 . 2]" 1
185 1 16 THR H 1 16 THR HB . . 3.330 3.007 2.903 3.074 . 0 0 "[ . 1 . 2]" 1
186 1 16 THR H 1 16 THR MG . . 3.920 3.971 3.957 4.011 0.091 3 0 "[ . 1 . 2]" 1
187 1 16 THR H 1 17 LEU H . . 4.940 4.241 3.776 4.449 . 0 0 "[ . 1 . 2]" 1
188 1 16 THR H 1 25 ALA MB . . 5.500 5.246 4.510 5.517 0.017 1 0 "[ . 1 . 2]" 1
189 1 16 THR H 1 26 LEU H . . 5.350 4.414 4.130 4.756 . 0 0 "[ . 1 . 2]" 1
190 1 16 THR H 1 26 LEU QD . . 3.070 3.102 3.063 3.145 0.075 15 0 "[ . 1 . 2]" 1
191 1 16 THR HA 1 16 THR MG . . 3.070 2.369 2.135 2.430 . 0 0 "[ . 1 . 2]" 1
192 1 16 THR HA 1 17 LEU H . . 3.240 2.232 2.146 2.348 . 0 0 "[ . 1 . 2]" 1
193 1 16 THR HA 1 25 ALA HA . . 3.690 1.991 1.957 2.095 . 0 0 "[ . 1 . 2]" 1
194 1 16 THR HA 1 25 ALA MB . . 3.680 3.004 2.008 3.386 . 0 0 "[ . 1 . 2]" 1
195 1 16 THR HA 1 26 LEU H . . 3.800 2.614 2.047 3.265 . 0 0 "[ . 1 . 2]" 1
196 1 16 THR HB 1 17 LEU H . . 4.850 3.966 3.484 4.415 . 0 0 "[ . 1 . 2]" 1
197 1 16 THR HB 1 25 ALA HA . . 5.030 4.595 4.172 4.983 . 0 0 "[ . 1 . 2]" 1
198 1 16 THR HB 1 25 ALA MB . . 5.500 4.325 3.855 4.806 . 0 0 "[ . 1 . 2]" 1
199 1 16 THR MG 1 17 LEU H . . 3.460 2.205 1.903 3.129 . 0 0 "[ . 1 . 2]" 1
200 1 16 THR MG 1 23 ARG QD . . 3.980 3.633 2.729 4.026 0.046 3 0 "[ . 1 . 2]" 1
201 1 16 THR MG 1 23 ARG HE . . 3.810 3.664 2.696 3.840 0.030 16 0 "[ . 1 . 2]" 1
202 1 16 THR MG 1 24 LEU H . . 4.690 4.511 3.510 4.769 0.079 4 0 "[ . 1 . 2]" 1
203 1 16 THR MG 1 25 ALA HA . . 3.460 2.628 1.972 3.415 . 0 0 "[ . 1 . 2]" 1
204 1 16 THR MG 1 25 ALA MB . . 2.990 2.291 1.926 2.941 . 0 0 "[ . 1 . 2]" 1
205 1 17 LEU H 1 17 LEU HB2 . . 3.840 2.656 2.380 3.195 . 0 0 "[ . 1 . 2]" 1
206 1 17 LEU H 1 17 LEU QD . . 4.840 3.638 1.869 3.993 . 0 0 "[ . 1 . 2]" 1
207 1 17 LEU H 1 18 LEU H . . 4.720 4.254 3.796 4.543 . 0 0 "[ . 1 . 2]" 1
208 1 17 LEU H 1 24 LEU H . . 4.390 4.156 2.831 4.452 0.062 16 0 "[ . 1 . 2]" 1
209 1 17 LEU H 1 24 LEU HB2 . . 5.100 4.242 2.575 5.204 0.104 15 0 "[ . 1 . 2]" 1
210 1 17 LEU H 1 24 LEU HB3 . . 5.130 3.726 3.069 4.600 . 0 0 "[ . 1 . 2]" 1
211 1 17 LEU H 1 25 ALA HA . . 3.950 2.557 2.198 3.431 . 0 0 "[ . 1 . 2]" 1
212 1 17 LEU H 1 25 ALA MB . . 4.260 3.546 2.595 4.289 0.029 3 0 "[ . 1 . 2]" 1
213 1 17 LEU H 1 26 LEU H . . 5.190 3.946 3.371 4.658 . 0 0 "[ . 1 . 2]" 1
214 1 17 LEU HA 1 17 LEU QD . . 3.360 2.352 1.849 2.947 . 0 0 "[ . 1 . 2]" 1
215 1 17 LEU HA 1 18 LEU H . . 3.150 2.228 2.142 2.393 . 0 0 "[ . 1 . 2]" 1
216 1 17 LEU HB2 1 18 LEU H . . 5.430 4.329 3.843 4.641 . 0 0 "[ . 1 . 2]" 1
217 1 17 LEU HB2 1 24 LEU H . . 4.810 4.485 3.638 4.912 0.102 18 0 "[ . 1 . 2]" 1
218 1 17 LEU HB3 1 18 LEU H . . 4.730 3.763 3.047 4.469 . 0 0 "[ . 1 . 2]" 1
219 1 17 LEU HB3 1 24 LEU H . . 4.890 3.392 2.390 4.842 . 0 0 "[ . 1 . 2]" 1
220 1 17 LEU QD 1 18 LEU H . . 3.580 2.903 1.897 3.567 . 0 0 "[ . 1 . 2]" 1
221 1 17 LEU QD 1 124 PHE HA . . 5.200 4.312 3.785 4.826 . 0 0 "[ . 1 . 2]" 1
222 1 17 LEU QD 1 124 PHE HB3 . . 3.560 2.689 1.922 3.288 . 0 0 "[ . 1 . 2]" 1
223 1 17 LEU QD 1 124 PHE QD . . 4.390 2.549 1.890 3.492 . 0 0 "[ . 1 . 2]" 1
224 1 18 LEU H 1 18 LEU HB2 . . 3.620 2.655 2.056 3.471 . 0 0 "[ . 1 . 2]" 1
225 1 18 LEU H 1 18 LEU HB3 . . 3.670 2.955 2.382 3.305 . 0 0 "[ . 1 . 2]" 1
226 1 18 LEU H 1 18 LEU HG . . 4.560 4.333 3.747 4.599 0.039 4 0 "[ . 1 . 2]" 1
227 1 18 LEU HA 1 18 LEU QD . . 3.520 2.307 2.091 2.806 . 0 0 "[ . 1 . 2]" 1
228 1 18 LEU HA 1 18 LEU HG . . 3.900 2.715 2.403 3.338 . 0 0 "[ . 1 . 2]" 1
229 1 18 LEU HA 1 19 VAL H . . 3.060 2.175 2.139 2.216 . 0 0 "[ . 1 . 2]" 1
230 1 18 LEU HA 1 23 ARG HA . . 3.960 3.003 2.435 3.416 . 0 0 "[ . 1 . 2]" 1
231 1 18 LEU HA 1 24 LEU H . . 4.520 3.647 3.108 4.051 . 0 0 "[ . 1 . 2]" 1
232 1 18 LEU QD 1 19 VAL H . . 4.060 2.117 1.845 3.068 . 0 0 "[ . 1 . 2]" 1
233 1 18 LEU QD 1 19 VAL HA . . 3.710 3.455 3.111 3.732 0.022 9 0 "[ . 1 . 2]" 1
234 1 18 LEU QD 1 20 PRO HD2 . . 5.050 5.167 4.836 5.459 0.409 9 0 "[ . 1 . 2]" 1
235 1 18 LEU QD 1 22 GLY H . . 5.100 4.855 4.272 5.123 0.023 9 0 "[ . 1 . 2]" 1
236 1 18 LEU QD 1 23 ARG H . . 5.490 5.413 5.073 5.548 0.058 4 0 "[ . 1 . 2]" 1
237 1 18 LEU QD 1 23 ARG QB . . 4.530 3.622 2.769 4.295 . 0 0 "[ . 1 . 2]" 1
238 1 18 LEU QD 1 23 ARG QD . . 3.840 3.465 2.294 3.849 0.009 5 0 "[ . 1 . 2]" 1
239 1 18 LEU HG 1 19 VAL H . . 4.090 3.671 2.400 4.099 0.009 5 0 "[ . 1 . 2]" 1
240 1 18 LEU HG 1 23 ARG HA . . 5.500 4.717 3.782 5.518 0.018 8 0 "[ . 1 . 2]" 1
241 1 19 VAL H 1 19 VAL MG2 . . 3.300 2.296 1.911 2.418 . 0 0 "[ . 1 . 2]" 1
242 1 19 VAL H 1 22 GLY H . . 4.410 4.077 3.729 4.518 0.108 13 0 "[ . 1 . 2]" 1
243 1 19 VAL H 1 23 ARG HA . . 4.190 3.101 2.321 3.768 . 0 0 "[ . 1 . 2]" 1
244 1 19 VAL H 1 24 LEU H . . 5.500 4.278 3.452 4.944 . 0 0 "[ . 1 . 2]" 1
245 1 19 VAL HA 1 20 PRO HD2 . . 3.770 2.431 2.287 2.474 . 0 0 "[ . 1 . 2]" 1
246 1 19 VAL HA 1 20 PRO HD3 . . 3.630 2.313 2.265 2.331 . 0 0 "[ . 1 . 2]" 1
247 1 19 VAL HB 1 20 PRO HD2 . . 3.740 1.993 1.891 2.344 . 0 0 "[ . 1 . 2]" 1
248 1 19 VAL HB 1 20 PRO HD3 . . 3.870 3.441 3.338 3.738 . 0 0 "[ . 1 . 2]" 1
249 1 19 VAL MG2 1 20 PRO HD2 . . 4.610 3.652 3.323 3.919 . 0 0 "[ . 1 . 2]" 1
250 1 19 VAL MG2 1 20 PRO HD3 . . 4.830 4.563 4.313 4.704 . 0 0 "[ . 1 . 2]" 1
251 1 19 VAL MG2 1 20 PRO HG2 . . 5.500 4.878 4.328 5.210 . 0 0 "[ . 1 . 2]" 1
252 1 19 VAL MG2 1 21 ASP HA . . 5.120 4.791 4.223 5.267 0.147 13 0 "[ . 1 . 2]" 1
253 1 19 VAL MG2 1 21 ASP QB . . 4.110 3.134 2.488 4.313 0.203 7 0 "[ . 1 . 2]" 1
254 1 19 VAL MG2 1 22 GLY H . . 3.330 2.145 1.848 3.046 . 0 0 "[ . 1 . 2]" 1
255 1 19 VAL MG2 1 23 ARG HA . . 5.500 3.096 2.089 4.298 . 0 0 "[ . 1 . 2]" 1
256 1 19 VAL MG2 1 64 PHE QD . . 3.880 2.939 2.374 3.492 . 0 0 "[ . 1 . 2]" 1
257 1 19 VAL MG2 1 64 PHE QE . . 4.030 2.267 1.891 3.310 . 0 0 "[ . 1 . 2]" 1
258 1 20 PRO HA 1 22 GLY H . . 4.670 4.368 3.397 4.730 0.060 16 0 "[ . 1 . 2]" 1
259 1 20 PRO HB2 1 21 ASP QB . . 5.040 4.779 3.203 5.088 0.048 11 0 "[ . 1 . 2]" 1
260 1 21 ASP HA 1 60 MET ME . . 5.420 5.291 4.786 5.454 0.034 2 0 "[ . 1 . 2]" 1
261 1 21 ASP QB 1 22 GLY H . . 5.010 2.895 2.571 3.765 . 0 0 "[ . 1 . 2]" 1
262 1 21 ASP QB 1 60 MET ME . . 4.150 3.904 3.209 4.168 0.018 13 0 "[ . 1 . 2]" 1
263 1 21 ASP QB 1 64 PHE QD . . 4.930 4.105 3.530 5.059 0.129 13 0 "[ . 1 . 2]" 1
264 1 21 ASP QB 1 64 PHE QE . . 4.400 2.185 1.896 3.230 . 0 0 "[ . 1 . 2]" 1
265 1 22 GLY H 1 23 ARG QB . . 5.320 4.927 4.585 5.267 . 0 0 "[ . 1 . 2]" 1
266 1 22 GLY H 1 50 THR MG . . 5.500 3.811 2.724 4.956 . 0 0 "[ . 1 . 2]" 1
267 1 22 GLY H 1 64 PHE QE . . 4.450 3.368 2.606 4.549 0.099 3 0 "[ . 1 . 2]" 1
268 1 22 GLY HA2 1 23 ARG H . . 3.540 2.950 2.622 3.261 . 0 0 "[ . 1 . 2]" 1
269 1 22 GLY HA2 1 48 THR H . . 5.500 5.292 4.587 5.558 0.058 15 0 "[ . 1 . 2]" 1
270 1 22 GLY HA2 1 50 THR H . . 4.020 2.782 2.052 3.383 . 0 0 "[ . 1 . 2]" 1
271 1 22 GLY HA2 1 50 THR MG . . 3.510 2.116 1.891 3.427 . 0 0 "[ . 1 . 2]" 1
272 1 22 GLY HA2 1 60 MET ME . . 4.980 3.750 2.988 4.304 . 0 0 "[ . 1 . 2]" 1
273 1 22 GLY HA3 1 50 THR H . . 4.080 3.795 3.015 4.122 0.042 13 0 "[ . 1 . 2]" 1
274 1 22 GLY HA3 1 60 MET ME . . 4.240 3.141 2.297 3.662 . 0 0 "[ . 1 . 2]" 1
275 1 22 GLY HA3 1 64 PHE QE . . 3.990 3.230 2.900 3.780 . 0 0 "[ . 1 . 2]" 1
276 1 23 ARG H 1 23 ARG QB . . 3.660 2.852 2.653 3.111 . 0 0 "[ . 1 . 2]" 1
277 1 23 ARG H 1 23 ARG QD . . 5.280 4.907 4.366 5.324 0.044 18 0 "[ . 1 . 2]" 1
278 1 23 ARG H 1 23 ARG HG2 . . 5.370 4.561 3.233 4.722 . 0 0 "[ . 1 . 2]" 1
279 1 23 ARG H 1 24 LEU H . . 4.970 3.549 3.052 4.154 . 0 0 "[ . 1 . 2]" 1
280 1 23 ARG H 1 47 LEU HA . . 4.820 3.970 3.672 4.325 . 0 0 "[ . 1 . 2]" 1
281 1 23 ARG H 1 47 LEU MD2 . . 3.990 2.511 2.118 2.879 . 0 0 "[ . 1 . 2]" 1
282 1 23 ARG H 1 48 THR H . . 3.670 2.930 2.737 3.129 . 0 0 "[ . 1 . 2]" 1
283 1 23 ARG H 1 48 THR HB . . 3.650 3.690 3.494 3.752 0.102 18 0 "[ . 1 . 2]" 1
284 1 23 ARG H 1 50 THR H . . 5.020 4.276 3.742 4.686 . 0 0 "[ . 1 . 2]" 1
285 1 23 ARG H 1 64 PHE QD . . 5.500 5.509 5.292 5.579 0.079 18 0 "[ . 1 . 2]" 1
286 1 23 ARG H 1 64 PHE QE . . 5.500 4.454 4.206 4.947 . 0 0 "[ . 1 . 2]" 1
287 1 23 ARG HA 1 23 ARG QD . . 4.550 3.562 2.440 4.239 . 0 0 "[ . 1 . 2]" 1
288 1 23 ARG HA 1 23 ARG HG2 . . 4.210 2.573 2.065 3.782 . 0 0 "[ . 1 . 2]" 1
289 1 23 ARG HA 1 23 ARG HG3 . . 3.590 3.181 2.558 3.620 0.030 17 0 "[ . 1 . 2]" 1
290 1 23 ARG HA 1 24 LEU H . . 3.080 2.229 2.149 2.341 . 0 0 "[ . 1 . 2]" 1
291 1 23 ARG QB 1 23 ARG QD . . 3.240 2.169 1.940 2.392 . 0 0 "[ . 1 . 2]" 1
292 1 23 ARG QB 1 24 LEU H . . 4.770 3.908 3.103 4.030 . 0 0 "[ . 1 . 2]" 1
293 1 23 ARG QB 1 48 THR H . . 4.770 3.259 2.828 4.267 . 0 0 "[ . 1 . 2]" 1
294 1 23 ARG QB 1 48 THR HB . . 3.340 2.369 1.937 3.426 0.086 3 0 "[ . 1 . 2]" 1
295 1 23 ARG QB 1 48 THR MG . . 4.490 3.642 3.261 4.517 0.027 3 0 "[ . 1 . 2]" 1
296 1 23 ARG QD 1 24 LEU H . . 5.240 4.581 3.120 5.281 0.041 15 0 "[ . 1 . 2]" 1
297 1 23 ARG QD 1 25 ALA MB . . 5.500 4.143 2.735 5.163 . 0 0 "[ . 1 . 2]" 1
298 1 23 ARG QD 1 48 THR H . . 5.500 4.876 3.997 5.521 0.021 9 0 "[ . 1 . 2]" 1
299 1 23 ARG QD 1 48 THR HB . . 4.420 3.959 2.939 4.437 0.017 16 0 "[ . 1 . 2]" 1
300 1 23 ARG HE 1 25 ALA MB . . 4.770 3.474 2.870 4.465 . 0 0 "[ . 1 . 2]" 1
301 1 23 ARG HE 1 48 THR HB . . 5.500 5.090 4.049 5.525 0.025 16 0 "[ . 1 . 2]" 1
302 1 23 ARG HG2 1 24 LEU H . . 4.700 3.974 3.039 4.725 0.025 19 0 "[ . 1 . 2]" 1
303 1 24 LEU H 1 24 LEU HB2 . . 3.790 2.370 2.214 2.767 . 0 0 "[ . 1 . 2]" 1
304 1 24 LEU H 1 24 LEU HB3 . . 3.820 3.207 2.413 3.678 . 0 0 "[ . 1 . 2]" 1
305 1 24 LEU H 1 24 LEU QD . . 4.390 3.071 2.424 3.752 . 0 0 "[ . 1 . 2]" 1
306 1 24 LEU H 1 24 LEU HG . . 4.380 3.949 3.289 4.520 0.140 18 0 "[ . 1 . 2]" 1
307 1 24 LEU HA 1 24 LEU QD . . 3.260 2.864 2.507 3.023 . 0 0 "[ . 1 . 2]" 1
308 1 24 LEU HA 1 24 LEU HG . . 4.160 2.362 2.210 2.658 . 0 0 "[ . 1 . 2]" 1
309 1 24 LEU HA 1 25 ALA H . . 3.020 2.391 2.166 2.593 . 0 0 "[ . 1 . 2]" 1
310 1 24 LEU HA 1 46 GLU H . . 5.090 3.946 3.618 4.443 . 0 0 "[ . 1 . 2]" 1
311 1 24 LEU HA 1 47 LEU HA . . 4.210 2.280 1.962 2.576 . 0 0 "[ . 1 . 2]" 1
312 1 24 LEU HA 1 47 LEU MD2 . . 3.980 3.107 2.057 3.451 . 0 0 "[ . 1 . 2]" 1
313 1 24 LEU HA 1 48 THR H . . 4.620 3.453 3.116 3.757 . 0 0 "[ . 1 . 2]" 1
314 1 24 LEU HA 1 61 ILE MD . . 5.100 5.051 4.800 5.219 0.119 18 0 "[ . 1 . 2]" 1
315 1 24 LEU HB3 1 25 ALA H . . 4.210 2.856 2.017 4.042 . 0 0 "[ . 1 . 2]" 1
316 1 24 LEU QD 1 25 ALA H . . 3.920 3.198 2.351 3.515 . 0 0 "[ . 1 . 2]" 1
317 1 24 LEU QD 1 45 PHE HB2 . . 3.440 2.478 1.955 2.925 . 0 0 "[ . 1 . 2]" 1
318 1 24 LEU QD 1 45 PHE HB3 . . 3.800 3.249 2.366 3.781 . 0 0 "[ . 1 . 2]" 1
319 1 24 LEU QD 1 45 PHE QR . . 3.490 2.609 2.086 3.098 . 0 0 "[ . 1 . 2]" 1
320 1 24 LEU QD 1 46 GLU H . . 4.480 3.929 3.384 4.413 . 0 0 "[ . 1 . 2]" 1
321 1 24 LEU QD 1 47 LEU HA . . 4.200 3.096 2.435 3.581 . 0 0 "[ . 1 . 2]" 1
322 1 24 LEU QD 1 48 THR H . . 5.500 4.441 4.097 5.025 . 0 0 "[ . 1 . 2]" 1
323 1 24 LEU QD 1 61 ILE MD . . 3.240 2.286 1.880 2.689 . 0 0 "[ . 1 . 2]" 1
324 1 24 LEU QD 1 64 PHE H . . 5.500 4.842 4.282 5.320 . 0 0 "[ . 1 . 2]" 1
325 1 24 LEU QD 1 64 PHE HB2 . . 4.870 3.098 2.505 3.579 . 0 0 "[ . 1 . 2]" 1
326 1 24 LEU QD 1 64 PHE HB3 . . 4.220 2.559 1.906 3.504 . 0 0 "[ . 1 . 2]" 1
327 1 24 LEU QD 1 64 PHE QE . . 5.220 3.950 2.901 5.109 . 0 0 "[ . 1 . 2]" 1
328 1 24 LEU QD 1 65 MET H . . 5.500 3.790 3.303 4.599 . 0 0 "[ . 1 . 2]" 1
329 1 24 LEU QD 1 65 MET HB2 . . 4.310 3.801 2.885 4.740 0.430 11 0 "[ . 1 . 2]" 1
330 1 24 LEU HG 1 25 ALA H . . 4.140 3.198 1.943 4.161 0.021 3 0 "[ . 1 . 2]" 1
331 1 24 LEU HG 1 45 PHE QR . . 4.310 3.582 2.782 4.263 . 0 0 "[ . 1 . 2]" 1
332 1 24 LEU HG 1 47 LEU HA . . 4.370 3.063 1.981 4.177 . 0 0 "[ . 1 . 2]" 1
333 1 24 LEU HG 1 61 ILE MD . . 4.950 3.922 3.028 4.951 0.001 5 0 "[ . 1 . 2]" 1
334 1 25 ALA H 1 25 ALA MB . . 3.000 2.808 2.595 2.905 . 0 0 "[ . 1 . 2]" 1
335 1 25 ALA H 1 26 LEU H . . 5.500 3.895 3.580 4.210 . 0 0 "[ . 1 . 2]" 1
336 1 25 ALA H 1 45 PHE HA . . 5.500 4.014 3.677 4.670 . 0 0 "[ . 1 . 2]" 1
337 1 25 ALA H 1 45 PHE HB2 . . 5.200 3.053 2.451 3.677 . 0 0 "[ . 1 . 2]" 1
338 1 25 ALA H 1 45 PHE HB3 . . 5.400 4.608 3.856 5.335 . 0 0 "[ . 1 . 2]" 1
339 1 25 ALA H 1 45 PHE QD . . 5.500 4.052 3.733 4.636 . 0 0 "[ . 1 . 2]" 1
340 1 25 ALA H 1 46 GLU QG . . 5.470 5.124 4.571 5.484 0.014 10 0 "[ . 1 . 2]" 1
341 1 25 ALA H 1 47 LEU HA . . 4.530 4.074 3.438 4.422 . 0 0 "[ . 1 . 2]" 1
342 1 25 ALA HA 1 26 LEU H . . 3.030 2.173 2.145 2.253 . 0 0 "[ . 1 . 2]" 1
343 1 25 ALA HA 1 26 LEU HB2 . . 5.210 4.591 4.483 4.731 . 0 0 "[ . 1 . 2]" 1
344 1 25 ALA HA 1 26 LEU QD . . 4.410 3.331 2.738 4.256 . 0 0 "[ . 1 . 2]" 1
345 1 25 ALA MB 1 26 LEU H . . 3.380 3.266 2.748 3.511 0.131 8 0 "[ . 1 . 2]" 1
346 1 25 ALA MB 1 45 PHE HA . . 4.890 4.655 4.387 4.960 0.070 15 0 "[ . 1 . 2]" 1
347 1 25 ALA MB 1 46 GLU H . . 4.330 3.204 2.828 3.705 . 0 0 "[ . 1 . 2]" 1
348 1 25 ALA MB 1 46 GLU HB3 . . 3.960 2.092 1.909 2.402 . 0 0 "[ . 1 . 2]" 1
349 1 25 ALA MB 1 46 GLU QG . . 4.000 3.768 3.438 4.032 0.032 4 0 "[ . 1 . 2]" 1
350 1 26 LEU H 1 26 LEU HB2 . . 3.400 2.512 2.376 2.669 . 0 0 "[ . 1 . 2]" 1
351 1 26 LEU H 1 26 LEU HB3 . . 3.950 3.592 3.575 3.628 . 0 0 "[ . 1 . 2]" 1
352 1 26 LEU H 1 26 LEU QD . . 3.580 2.135 1.792 2.794 . 0 0 "[ . 1 . 2]" 1
353 1 26 LEU H 1 26 LEU HG . . 3.820 3.302 2.249 3.935 0.115 4 0 "[ . 1 . 2]" 1
354 1 26 LEU HA 1 26 LEU QD . . 2.960 2.310 1.919 2.908 . 0 0 "[ . 1 . 2]" 1
355 1 26 LEU HA 1 27 THR H . . 3.230 2.158 2.138 2.186 . 0 0 "[ . 1 . 2]" 1
356 1 26 LEU HA 1 27 THR HA . . 4.320 4.413 4.376 4.450 0.130 12 0 "[ . 1 . 2]" 1
357 1 26 LEU HA 1 28 ALA H . . 4.130 4.109 3.710 4.235 0.105 13 0 "[ . 1 . 2]" 1
358 1 26 LEU HA 1 45 PHE HA . . 3.620 2.480 1.981 3.006 . 0 0 "[ . 1 . 2]" 1
359 1 26 LEU HA 1 45 PHE HB3 . . 5.060 3.589 2.856 4.241 . 0 0 "[ . 1 . 2]" 1
360 1 26 LEU HA 1 46 GLU H . . 5.180 3.809 3.315 4.240 . 0 0 "[ . 1 . 2]" 1
361 1 26 LEU HB2 1 27 THR H . . 4.920 4.324 4.043 4.458 . 0 0 "[ . 1 . 2]" 1
362 1 26 LEU HB2 1 27 THR HA . . 5.230 5.031 4.829 5.250 0.020 16 0 "[ . 1 . 2]" 1
363 1 26 LEU HB3 1 26 LEU QD . . 3.030 2.247 1.917 2.499 . 0 0 "[ . 1 . 2]" 1
364 1 26 LEU HB3 1 27 THR H . . 4.000 3.588 3.178 3.831 . 0 0 "[ . 1 . 2]" 1
365 1 26 LEU HB3 1 28 ALA H . . 5.080 4.159 2.778 4.768 . 0 0 "[ . 1 . 2]" 1
366 1 26 LEU QD 1 27 THR H . . 4.820 3.793 3.441 4.236 . 0 0 "[ . 1 . 2]" 1
367 1 26 LEU QD 1 28 ALA H . . 4.960 4.680 3.866 4.857 . 0 0 "[ . 1 . 2]" 1
368 1 26 LEU QD 1 45 PHE HA . . 4.420 3.612 3.032 4.079 . 0 0 "[ . 1 . 2]" 1
369 1 26 LEU QD 1 45 PHE HB2 . . 4.120 3.702 3.048 4.092 . 0 0 "[ . 1 . 2]" 1
370 1 26 LEU QD 1 45 PHE HB3 . . 3.570 3.126 2.484 3.515 . 0 0 "[ . 1 . 2]" 1
371 1 27 THR H 1 27 THR HB . . 4.190 3.597 3.392 3.726 . 0 0 "[ . 1 . 2]" 1
372 1 27 THR H 1 27 THR MG . . 3.300 2.752 2.295 3.229 . 0 0 "[ . 1 . 2]" 1
373 1 27 THR H 1 28 ALA H . . 2.880 2.617 2.208 2.868 . 0 0 "[ . 1 . 2]" 1
374 1 27 THR H 1 28 ALA HA . . 4.880 4.820 4.502 4.995 0.115 16 0 "[ . 1 . 2]" 1
375 1 27 THR H 1 29 LEU HG . . 5.380 5.230 4.757 5.493 0.113 15 0 "[ . 1 . 2]" 1
376 1 27 THR H 1 45 PHE HA . . 3.510 2.438 1.897 2.778 . 0 0 "[ . 1 . 2]" 1
377 1 27 THR H 1 45 PHE HB2 . . 5.080 4.740 3.980 5.098 0.018 19 0 "[ . 1 . 2]" 1
378 1 27 THR H 1 45 PHE HB3 . . 4.780 4.466 3.742 4.869 0.089 5 0 "[ . 1 . 2]" 1
379 1 27 THR H 1 46 GLU H . . 4.550 3.981 3.586 4.300 . 0 0 "[ . 1 . 2]" 1
380 1 27 THR HA 1 27 THR MG . . 2.400 2.225 2.044 2.412 0.012 15 0 "[ . 1 . 2]" 1
381 1 27 THR HA 1 28 ALA H . . 3.520 3.468 2.883 3.572 0.052 14 0 "[ . 1 . 2]" 1
382 1 27 THR HA 1 28 ALA MB . . 4.030 3.992 3.641 4.207 0.177 15 0 "[ . 1 . 2]" 1
383 1 27 THR HB 1 28 ALA H . . 4.350 3.362 2.815 4.327 . 0 0 "[ . 1 . 2]" 1
384 1 27 THR HB 1 28 ALA MB . . 5.170 3.402 3.088 4.070 . 0 0 "[ . 1 . 2]" 1
385 1 27 THR MG 1 28 ALA H . . 4.380 3.937 3.701 4.425 0.045 8 0 "[ . 1 . 2]" 1
386 1 27 THR MG 1 45 PHE HA . . 3.640 3.460 2.092 3.676 0.036 5 0 "[ . 1 . 2]" 1
387 1 27 THR MG 1 46 GLU H . . 4.360 3.485 2.408 3.936 . 0 0 "[ . 1 . 2]" 1
388 1 27 THR MG 1 46 GLU HA . . 4.620 3.727 3.100 4.158 . 0 0 "[ . 1 . 2]" 1
389 1 27 THR MG 1 46 GLU HB2 . . 3.490 2.290 1.929 2.537 . 0 0 "[ . 1 . 2]" 1
390 1 27 THR MG 1 46 GLU HB3 . . 3.850 3.645 2.573 3.908 0.058 13 0 "[ . 1 . 2]" 1
391 1 27 THR MG 1 46 GLU QG . . 3.220 3.176 2.662 3.410 0.190 15 0 "[ . 1 . 2]" 1
392 1 27 THR MG 1 106 GLN HE21 . . 4.510 3.866 3.292 4.549 0.039 8 0 "[ . 1 . 2]" 1
393 1 27 THR MG 1 106 GLN HE22 . . 5.070 2.910 1.896 4.099 . 0 0 "[ . 1 . 2]" 1
394 1 28 ALA H 1 28 ALA MB . . 3.260 2.921 2.899 2.942 . 0 0 "[ . 1 . 2]" 1
395 1 28 ALA H 1 29 LEU H . . 4.430 3.434 3.101 4.361 . 0 0 "[ . 1 . 2]" 1
396 1 28 ALA H 1 29 LEU MD2 . . 5.310 4.635 4.022 5.327 0.017 8 0 "[ . 1 . 2]" 1
397 1 28 ALA H 1 44 LEU HB2 . . 3.910 2.731 2.136 3.992 0.082 6 0 "[ . 1 . 2]" 1
398 1 28 ALA H 1 44 LEU HB3 . . 3.840 2.876 2.109 3.972 0.132 18 0 "[ . 1 . 2]" 1
399 1 28 ALA H 1 45 PHE HA . . 5.080 4.525 3.603 5.077 . 0 0 "[ . 1 . 2]" 1
400 1 28 ALA HA 1 29 LEU H . . 2.860 2.231 2.161 2.554 . 0 0 "[ . 1 . 2]" 1
401 1 28 ALA HA 1 29 LEU HG . . 4.550 3.961 3.377 4.468 . 0 0 "[ . 1 . 2]" 1
402 1 28 ALA HA 1 44 LEU HG . . 5.500 5.615 5.353 6.589 1.089 20 2 "[ . 1 - +]" 1
403 1 28 ALA MB 1 29 LEU H . . 4.330 3.456 2.076 3.641 . 0 0 "[ . 1 . 2]" 1
404 1 28 ALA MB 1 29 LEU HA . . 4.580 4.497 3.904 4.630 0.050 20 0 "[ . 1 . 2]" 1
405 1 29 LEU H 1 29 LEU HB2 . . 3.340 2.642 2.473 2.796 . 0 0 "[ . 1 . 2]" 1
406 1 29 LEU H 1 29 LEU HB3 . . 4.170 3.592 3.560 3.865 . 0 0 "[ . 1 . 2]" 1
407 1 29 LEU H 1 29 LEU MD1 . . 3.820 3.105 2.283 3.920 0.100 15 0 "[ . 1 . 2]" 1
408 1 29 LEU H 1 29 LEU MD2 . . 4.100 3.507 3.116 4.169 0.069 15 0 "[ . 1 . 2]" 1
409 1 29 LEU H 1 29 LEU HG . . 3.810 2.105 1.892 3.132 . 0 0 "[ . 1 . 2]" 1
410 1 29 LEU H 1 30 HIS H . . 4.810 4.565 3.901 4.631 . 0 0 "[ . 1 . 2]" 1
411 1 29 LEU H 1 30 HIS HA . . 5.440 5.510 4.587 5.660 0.220 20 0 "[ . 1 . 2]" 1
412 1 29 LEU H 1 44 LEU H . . 5.500 4.484 4.208 4.958 . 0 0 "[ . 1 . 2]" 1
413 1 29 LEU H 1 44 LEU QD . . 5.500 4.209 2.781 4.525 . 0 0 "[ . 1 . 2]" 1
414 1 29 LEU HA 1 29 LEU MD1 . . 3.890 3.924 3.821 3.978 0.088 1 0 "[ . 1 . 2]" 1
415 1 29 LEU HA 1 29 LEU MD2 . . 3.260 2.536 1.974 3.283 0.023 18 0 "[ . 1 . 2]" 1
416 1 29 LEU HA 1 29 LEU HG . . 3.710 2.950 2.801 3.168 . 0 0 "[ . 1 . 2]" 1
417 1 29 LEU HA 1 30 HIS H . . 3.040 2.194 2.151 2.242 . 0 0 "[ . 1 . 2]" 1
418 1 29 LEU HA 1 30 HIS QB . . 5.150 4.334 3.949 4.410 . 0 0 "[ . 1 . 2]" 1
419 1 29 LEU HA 1 30 HIS HD2 . . 5.230 5.025 4.838 5.244 0.014 17 0 "[ . 1 . 2]" 1
420 1 29 LEU HA 1 42 TYR H . . 5.500 5.458 4.961 5.646 0.146 10 0 "[ . 1 . 2]" 1
421 1 29 LEU HA 1 42 TYR HB3 . . 5.490 5.427 4.885 6.104 0.614 20 1 "[ . 1 . +]" 1
422 1 29 LEU HA 1 43 VAL HA . . 3.880 3.437 2.629 3.882 0.002 18 0 "[ . 1 . 2]" 1
423 1 29 LEU HA 1 43 VAL QG . . 5.350 4.346 3.962 4.722 . 0 0 "[ . 1 . 2]" 1
424 1 29 LEU HA 1 44 LEU H . . 4.090 2.208 1.943 2.633 . 0 0 "[ . 1 . 2]" 1
425 1 29 LEU HA 1 44 LEU QD . . 5.390 2.102 1.942 2.421 . 0 0 "[ . 1 . 2]" 1
426 1 29 LEU HA 1 142 ILE MD . . 5.410 5.213 4.644 5.486 0.076 17 0 "[ . 1 . 2]" 1
427 1 29 LEU HB2 1 29 LEU MD1 . . 2.910 2.183 1.997 2.402 . 0 0 "[ . 1 . 2]" 1
428 1 29 LEU HB2 1 29 LEU MD2 . . 3.280 3.101 2.878 3.195 . 0 0 "[ . 1 . 2]" 1
429 1 29 LEU HB2 1 30 HIS H . . 4.380 3.979 3.717 4.387 0.007 15 0 "[ . 1 . 2]" 1
430 1 29 LEU HB2 1 142 ILE MD . . 4.890 3.651 3.086 4.532 . 0 0 "[ . 1 . 2]" 1
431 1 29 LEU HB3 1 30 HIS H . . 4.170 3.085 2.866 3.766 . 0 0 "[ . 1 . 2]" 1
432 1 29 LEU HB3 1 142 ILE MD . . 4.550 3.219 2.618 3.620 . 0 0 "[ . 1 . 2]" 1
433 1 29 LEU MD1 1 30 HIS H . . 5.370 5.082 4.809 5.488 0.118 15 0 "[ . 1 . 2]" 1
434 1 29 LEU MD1 1 41 PHE QD . . 5.130 5.063 4.115 5.245 0.115 13 0 "[ . 1 . 2]" 1
435 1 29 LEU MD1 1 41 PHE QE . . 3.430 3.253 2.388 3.446 0.016 17 0 "[ . 1 . 2]" 1
436 1 29 LEU MD1 1 41 PHE HZ . . 3.710 3.353 2.431 3.733 0.023 13 0 "[ . 1 . 2]" 1
437 1 29 LEU MD1 1 44 LEU H . . 5.430 4.896 4.595 5.457 0.027 15 0 "[ . 1 . 2]" 1
438 1 29 LEU MD2 1 30 HIS H . . 5.000 3.819 3.267 4.348 . 0 0 "[ . 1 . 2]" 1
439 1 29 LEU MD2 1 41 PHE QD . . 4.750 4.353 3.860 4.771 0.021 12 0 "[ . 1 . 2]" 1
440 1 29 LEU MD2 1 41 PHE QE . . 4.150 2.478 1.953 3.096 . 0 0 "[ . 1 . 2]" 1
441 1 29 LEU MD2 1 41 PHE HZ . . 3.490 1.988 1.871 2.252 . 0 0 "[ . 1 . 2]" 1
442 1 29 LEU MD2 1 43 VAL HA . . 3.200 1.944 1.853 2.311 . 0 0 "[ . 1 . 2]" 1
443 1 29 LEU MD2 1 43 VAL QG . . 3.520 2.114 1.820 2.615 . 0 0 "[ . 1 . 2]" 1
444 1 29 LEU MD2 1 44 LEU H . . 3.600 2.482 2.059 3.220 . 0 0 "[ . 1 . 2]" 1
445 1 29 LEU MD2 1 142 ILE MD . . 3.320 3.277 2.852 3.391 0.071 13 0 "[ . 1 . 2]" 1
446 1 29 LEU HG 1 44 LEU H . . 4.630 4.013 3.321 4.624 . 0 0 "[ . 1 . 2]" 1
447 1 29 LEU HG 1 142 ILE MD . . 5.340 4.854 4.237 5.466 0.126 17 0 "[ . 1 . 2]" 1
448 1 30 HIS H 1 30 HIS QB . . 3.780 2.646 2.339 2.723 . 0 0 "[ . 1 . 2]" 1
449 1 30 HIS H 1 30 HIS HD2 . . 4.330 4.203 3.513 4.387 0.057 20 0 "[ . 1 . 2]" 1
450 1 30 HIS H 1 31 LYS H . . 4.830 4.422 4.369 4.539 . 0 0 "[ . 1 . 2]" 1
451 1 30 HIS H 1 41 PHE QD . . 5.500 4.452 3.676 5.094 . 0 0 "[ . 1 . 2]" 1
452 1 30 HIS H 1 42 TYR H . . 3.810 3.810 3.506 3.935 0.125 15 0 "[ . 1 . 2]" 1
453 1 30 HIS H 1 42 TYR HB2 . . 4.990 3.164 2.673 3.373 . 0 0 "[ . 1 . 2]" 1
454 1 30 HIS H 1 42 TYR HB3 . . 4.350 4.215 3.730 4.818 0.468 20 0 "[ . 1 . 2]" 1
455 1 30 HIS H 1 42 TYR QD . . 4.810 4.705 4.118 5.024 0.214 4 0 "[ . 1 . 2]" 1
456 1 30 HIS H 1 44 LEU QD . . 4.430 1.932 1.844 2.100 . 0 0 "[ . 1 . 2]" 1
457 1 30 HIS H 1 142 ILE MD . . 5.390 5.292 4.993 5.455 0.065 16 0 "[ . 1 . 2]" 1
458 1 30 HIS HA 1 31 LYS H . . 2.810 2.248 2.208 2.310 . 0 0 "[ . 1 . 2]" 1
459 1 30 HIS HA 1 31 LYS QB . . 4.340 4.161 4.028 4.302 . 0 0 "[ . 1 . 2]" 1
460 1 30 HIS HA 1 31 LYS QG . . 4.710 4.232 3.781 4.539 . 0 0 "[ . 1 . 2]" 1
461 1 30 HIS HA 1 142 ILE MG . . 4.820 4.778 4.458 4.996 0.176 20 0 "[ . 1 . 2]" 1
462 1 30 HIS QB 1 30 HIS HD2 . . 3.610 2.630 2.624 2.686 . 0 0 "[ . 1 . 2]" 1
463 1 30 HIS QB 1 31 LYS H . . 3.900 2.805 2.617 3.070 . 0 0 "[ . 1 . 2]" 1
464 1 30 HIS QB 1 42 TYR H . . 5.500 4.438 3.832 5.209 . 0 0 "[ . 1 . 2]" 1
465 1 30 HIS QB 1 42 TYR HB2 . . 4.810 2.981 2.515 4.085 . 0 0 "[ . 1 . 2]" 1
466 1 30 HIS QB 1 42 TYR HB3 . . 5.500 4.144 3.457 5.257 . 0 0 "[ . 1 . 2]" 1
467 1 30 HIS QB 1 42 TYR QD . . 3.990 3.355 2.574 4.247 0.257 18 0 "[ . 1 . 2]" 1
468 1 30 HIS QB 1 44 LEU QD . . 4.670 2.109 1.828 3.037 . 0 0 "[ . 1 . 2]" 1
469 1 30 HIS QB 1 44 LEU HG . . 5.210 3.779 3.165 4.097 . 0 0 "[ . 1 . 2]" 1
470 1 30 HIS QB 1 88 PHE QE . . 4.900 3.443 2.291 4.221 . 0 0 "[ . 1 . 2]" 1
471 1 30 HIS QB 1 88 PHE HZ . . 4.560 3.861 2.899 4.064 . 0 0 "[ . 1 . 2]" 1
472 1 30 HIS HD2 1 44 LEU QD . . 2.930 2.121 1.680 2.358 . 0 0 "[ . 1 . 2]" 1
473 1 30 HIS HD2 1 44 LEU HG . . 3.100 2.356 1.988 3.749 0.649 20 1 "[ . 1 . +]" 1
474 1 30 HIS HD2 1 88 PHE QE . . 3.470 3.133 2.378 3.507 0.037 3 0 "[ . 1 . 2]" 1
475 1 31 LYS H 1 31 LYS QB . . 3.200 2.425 2.145 2.895 . 0 0 "[ . 1 . 2]" 1
476 1 31 LYS H 1 31 LYS QD . . 4.550 4.361 3.975 4.642 0.092 15 0 "[ . 1 . 2]" 1
477 1 31 LYS H 1 31 LYS QG . . 3.950 2.918 2.129 3.520 . 0 0 "[ . 1 . 2]" 1
478 1 31 LYS H 1 32 GLY H . . 4.660 4.527 4.484 4.575 . 0 0 "[ . 1 . 2]" 1
479 1 31 LYS H 1 42 TYR QD . . 5.500 4.809 4.341 5.312 . 0 0 "[ . 1 . 2]" 1
480 1 31 LYS H 1 142 ILE MG . . 4.610 4.502 4.190 4.689 0.079 4 0 "[ . 1 . 2]" 1
481 1 31 LYS HA 1 31 LYS QD . . 4.590 4.047 2.337 4.537 . 0 0 "[ . 1 . 2]" 1
482 1 31 LYS HA 1 31 LYS QE . . 5.500 3.937 3.189 4.551 . 0 0 "[ . 1 . 2]" 1
483 1 31 LYS HA 1 32 GLY H . . 3.090 2.312 2.163 2.604 . 0 0 "[ . 1 . 2]" 1
484 1 31 LYS HA 1 32 GLY HA2 . . 5.070 4.470 4.396 4.673 . 0 0 "[ . 1 . 2]" 1
485 1 31 LYS HA 1 41 PHE HA . . 3.560 2.387 2.131 2.695 . 0 0 "[ . 1 . 2]" 1
486 1 31 LYS HA 1 142 ILE MD . . 5.460 5.448 4.867 5.598 0.138 20 0 "[ . 1 . 2]" 1
487 1 31 LYS HA 1 142 ILE MG . . 4.460 3.915 3.337 4.153 . 0 0 "[ . 1 . 2]" 1
488 1 31 LYS QB 1 31 LYS QE . . 4.000 2.151 1.881 3.291 . 0 0 "[ . 1 . 2]" 1
489 1 31 LYS QB 1 32 GLY H . . 3.250 2.761 2.003 3.203 . 0 0 "[ . 1 . 2]" 1
490 1 31 LYS QB 1 142 ILE MG . . 4.730 3.214 2.267 3.946 . 0 0 "[ . 1 . 2]" 1
491 1 31 LYS QD 1 142 ILE MG . . 4.030 2.631 1.770 3.792 . 0 0 "[ . 1 . 2]" 1
492 1 31 LYS QD 1 143 THR H . . 5.440 3.390 2.782 4.642 . 0 0 "[ . 1 . 2]" 1
493 1 31 LYS QD 1 143 THR HA . . 3.380 2.557 1.944 3.766 0.386 8 0 "[ . 1 . 2]" 1
494 1 31 LYS QD 1 143 THR HB . . 4.960 3.841 1.805 5.081 0.121 20 0 "[ . 1 . 2]" 1
495 1 31 LYS QE 1 32 GLY H . . 4.800 3.682 2.943 4.324 . 0 0 "[ . 1 . 2]" 1
496 1 31 LYS QE 1 113 PHE QD . . 5.060 4.111 3.123 5.039 . 0 0 "[ . 1 . 2]" 1
497 1 31 LYS QE 1 113 PHE QE . . 4.520 2.894 1.973 4.721 0.201 17 0 "[ . 1 . 2]" 1
498 1 31 LYS QE 1 142 ILE MG . . 5.100 3.745 2.721 4.657 . 0 0 "[ . 1 . 2]" 1
499 1 31 LYS QE 1 143 THR HA . . 4.750 3.271 1.962 4.344 . 0 0 "[ . 1 . 2]" 1
500 1 31 LYS QG 1 32 GLY H . . 4.380 3.532 2.986 3.968 . 0 0 "[ . 1 . 2]" 1
501 1 31 LYS QG 1 142 ILE MG . . 3.950 2.591 1.837 3.942 . 0 0 "[ . 1 . 2]" 1
502 1 32 GLY H 1 33 LYS H . . 4.230 4.198 3.889 4.358 0.128 20 0 "[ . 1 . 2]" 1
503 1 32 GLY H 1 40 MET QB . . 3.920 3.030 2.185 3.654 . 0 0 "[ . 1 . 2]" 1
504 1 32 GLY H 1 40 MET ME . . 5.500 4.695 4.191 5.525 0.025 20 0 "[ . 1 . 2]" 1
505 1 32 GLY H 1 41 PHE HA . . 3.620 2.888 2.538 3.420 . 0 0 "[ . 1 . 2]" 1
506 1 32 GLY H 1 41 PHE HB3 . . 5.500 5.532 5.413 5.684 0.184 20 0 "[ . 1 . 2]" 1
507 1 32 GLY H 1 42 TYR H . . 4.830 4.137 3.455 4.864 0.034 20 0 "[ . 1 . 2]" 1
508 1 32 GLY H 1 42 TYR QD . . 5.080 4.002 3.270 5.112 0.032 20 0 "[ . 1 . 2]" 1
509 1 32 GLY H 1 142 ILE MG . . 5.440 5.401 4.799 5.588 0.148 18 0 "[ . 1 . 2]" 1
510 1 32 GLY HA2 1 33 LYS H . . 3.200 2.891 2.737 3.132 . 0 0 "[ . 1 . 2]" 1
511 1 32 GLY HA2 1 42 TYR QE . . 3.990 3.725 3.013 4.458 0.468 7 0 "[ . 1 . 2]" 1
512 1 32 GLY HA3 1 33 LYS H . . 3.390 2.288 2.156 2.401 . 0 0 "[ . 1 . 2]" 1
513 1 32 GLY HA3 1 33 LYS HG3 . . 5.500 5.326 4.736 5.907 0.407 11 0 "[ . 1 . 2]" 1
514 1 33 LYS H 1 33 LYS HB2 . . 3.460 3.088 2.471 3.942 0.482 18 0 "[ . 1 . 2]" 1
515 1 33 LYS H 1 33 LYS HB3 . . 4.010 3.393 2.908 3.788 . 0 0 "[ . 1 . 2]" 1
516 1 33 LYS H 1 33 LYS HG3 . . 4.340 3.638 2.990 4.224 . 0 0 "[ . 1 . 2]" 1
517 1 33 LYS H 1 34 ASP H . . 4.680 4.411 4.104 4.475 . 0 0 "[ . 1 . 2]" 1
518 1 33 LYS H 1 40 MET ME . . 5.380 5.156 4.498 5.398 0.018 6 0 "[ . 1 . 2]" 1
519 1 33 LYS H 1 42 TYR QE . . 4.620 3.710 3.219 4.204 . 0 0 "[ . 1 . 2]" 1
520 1 33 LYS HA 1 33 LYS QD . . 4.640 3.966 2.081 4.403 . 0 0 "[ . 1 . 2]" 1
521 1 33 LYS HA 1 33 LYS HG2 . . 4.040 2.942 2.246 3.872 . 0 0 "[ . 1 . 2]" 1
522 1 33 LYS HA 1 33 LYS HG3 . . 3.800 3.225 2.719 3.742 . 0 0 "[ . 1 . 2]" 1
523 1 33 LYS HA 1 34 ASP H . . 3.140 2.277 2.148 2.368 . 0 0 "[ . 1 . 2]" 1
524 1 33 LYS HA 1 34 ASP HA . . 4.630 4.412 4.378 4.452 . 0 0 "[ . 1 . 2]" 1
525 1 33 LYS HA 1 37 GLY H . . 5.500 5.079 4.650 5.221 . 0 0 "[ . 1 . 2]" 1
526 1 33 LYS HA 1 38 LYS H . . 5.130 3.330 2.972 3.628 . 0 0 "[ . 1 . 2]" 1
527 1 33 LYS HA 1 40 MET H . . 4.740 4.542 4.195 4.834 0.094 18 0 "[ . 1 . 2]" 1
528 1 33 LYS HA 1 40 MET QG . . 5.100 3.419 2.992 3.714 . 0 0 "[ . 1 . 2]" 1
529 1 33 LYS HB2 1 34 ASP H . . 4.150 3.598 2.651 4.401 0.251 19 0 "[ . 1 . 2]" 1
530 1 33 LYS HB2 1 37 GLY QA . . 4.170 2.943 1.917 3.831 . 0 0 "[ . 1 . 2]" 1
531 1 33 LYS HB3 1 34 ASP H . . 4.080 3.363 2.542 4.172 0.092 18 0 "[ . 1 . 2]" 1
532 1 33 LYS HB3 1 34 ASP HA . . 5.220 4.896 4.164 5.817 0.597 16 7 "[ *-*.* 1 * .+ * 2]" 1
533 1 33 LYS HB3 1 37 GLY QA . . 3.690 2.642 1.953 3.592 . 0 0 "[ . 1 . 2]" 1
534 1 33 LYS QD 1 34 ASP H . . 5.400 4.419 3.166 5.094 . 0 0 "[ . 1 . 2]" 1
535 1 33 LYS QD 1 37 GLY H . . 5.440 4.503 4.058 4.971 . 0 0 "[ . 1 . 2]" 1
536 1 33 LYS QD 1 37 GLY QA . . 4.410 2.484 1.931 2.975 . 0 0 "[ . 1 . 2]" 1
537 1 33 LYS QD 1 38 LYS H . . 5.500 4.611 3.129 5.329 . 0 0 "[ . 1 . 2]" 1
538 1 33 LYS QE 1 33 LYS HG3 . . 3.760 2.434 2.053 3.315 . 0 0 "[ . 1 . 2]" 1
539 1 33 LYS QE 1 37 GLY QA . . 4.680 3.922 3.220 4.329 . 0 0 "[ . 1 . 2]" 1
540 1 33 LYS HG2 1 34 ASP H . . 4.630 4.022 3.280 4.849 0.219 17 0 "[ . 1 . 2]" 1
541 1 33 LYS HG2 1 37 GLY QA . . 4.460 3.432 2.395 4.737 0.277 17 0 "[ . 1 . 2]" 1
542 1 33 LYS HG3 1 34 ASP H . . 4.830 4.251 3.397 4.871 0.041 11 0 "[ . 1 . 2]" 1
543 1 34 ASP H 1 34 ASP QB . . 3.790 2.748 2.221 2.939 . 0 0 "[ . 1 . 2]" 1
544 1 34 ASP H 1 36 GLN H . . 5.500 3.929 3.815 4.042 . 0 0 "[ . 1 . 2]" 1
545 1 34 ASP H 1 36 GLN HB2 . . 5.160 5.100 4.914 5.235 0.075 11 0 "[ . 1 . 2]" 1
546 1 34 ASP H 1 37 GLY H . . 4.600 3.269 3.009 3.977 . 0 0 "[ . 1 . 2]" 1
547 1 34 ASP H 1 37 GLY QA . . 5.310 2.720 2.320 3.710 . 0 0 "[ . 1 . 2]" 1
548 1 34 ASP H 1 38 LYS H . . 3.800 2.339 2.055 2.547 . 0 0 "[ . 1 . 2]" 1
549 1 34 ASP H 1 40 MET H . . 5.320 5.018 4.430 5.337 0.017 17 0 "[ . 1 . 2]" 1
550 1 34 ASP H 1 40 MET QG . . 4.350 3.655 2.982 4.220 . 0 0 "[ . 1 . 2]" 1
551 1 34 ASP HA 1 35 TYR H . . 3.570 2.852 2.780 2.888 . 0 0 "[ . 1 . 2]" 1
552 1 34 ASP HA 1 37 GLY H . . 4.460 4.525 4.465 4.714 0.254 19 0 "[ . 1 . 2]" 1
553 1 34 ASP HA 1 40 MET ME . . 5.360 4.941 4.371 5.219 . 0 0 "[ . 1 . 2]" 1
554 1 34 ASP HA 1 83 LEU HA . . 3.430 2.837 2.278 3.050 . 0 0 "[ . 1 . 2]" 1
555 1 34 ASP QB 1 35 TYR H . . 3.670 1.981 1.704 2.110 . 0 0 "[ . 1 . 2]" 1
556 1 34 ASP QB 1 35 TYR QD . . 3.740 3.247 3.114 3.503 . 0 0 "[ . 1 . 2]" 1
557 1 34 ASP QB 1 36 GLN H . . 5.500 3.495 2.424 3.622 . 0 0 "[ . 1 . 2]" 1
558 1 34 ASP QB 1 39 PRO HG2 . . 5.420 3.590 1.932 3.825 . 0 0 "[ . 1 . 2]" 1
559 1 34 ASP QB 1 40 MET ME . . 5.150 3.925 3.555 4.648 . 0 0 "[ . 1 . 2]" 1
560 1 34 ASP QB 1 81 ALA MB . . 4.310 3.688 3.517 3.956 . 0 0 "[ . 1 . 2]" 1
561 1 34 ASP QB 1 82 VAL H . . 5.090 4.870 4.739 4.943 . 0 0 "[ . 1 . 2]" 1
562 1 34 ASP QB 1 83 LEU HB3 . . 4.990 2.737 2.287 4.047 . 0 0 "[ . 1 . 2]" 1
563 1 34 ASP QB 1 84 THR H . . 5.500 4.392 4.071 5.439 . 0 0 "[ . 1 . 2]" 1
564 1 35 TYR H 1 35 TYR HB2 . . 3.930 3.574 3.559 3.588 . 0 0 "[ . 1 . 2]" 1
565 1 35 TYR H 1 35 TYR HB3 . . 3.730 2.719 2.602 2.786 . 0 0 "[ . 1 . 2]" 1
566 1 35 TYR H 1 35 TYR QD . . 2.850 2.472 2.381 2.795 . 0 0 "[ . 1 . 2]" 1
567 1 35 TYR H 1 35 TYR QE . . 3.910 3.948 3.910 4.181 0.271 19 0 "[ . 1 . 2]" 1
568 1 35 TYR H 1 36 GLN H . . 4.210 2.751 2.719 2.768 . 0 0 "[ . 1 . 2]" 1
569 1 35 TYR H 1 37 GLY H . . 5.080 4.160 4.103 4.312 . 0 0 "[ . 1 . 2]" 1
570 1 35 TYR H 1 38 LYS H . . 5.500 5.482 5.420 5.677 0.177 19 0 "[ . 1 . 2]" 1
571 1 35 TYR H 1 82 VAL MG1 . . 5.500 4.176 3.520 4.418 . 0 0 "[ . 1 . 2]" 1
572 1 35 TYR H 1 83 LEU HA . . 4.170 2.405 2.017 2.645 . 0 0 "[ . 1 . 2]" 1
573 1 35 TYR H 1 84 THR H . . 5.110 3.484 3.185 4.554 . 0 0 "[ . 1 . 2]" 1
574 1 35 TYR H 1 84 THR MG . . 5.500 3.835 3.329 4.270 . 0 0 "[ . 1 . 2]" 1
575 1 35 TYR HA 1 35 TYR QD . . 4.200 3.724 3.711 3.727 . 0 0 "[ . 1 . 2]" 1
576 1 35 TYR HA 1 37 GLY H . . 4.570 3.672 3.527 3.853 . 0 0 "[ . 1 . 2]" 1
577 1 35 TYR HA 1 84 THR H . . 4.090 3.118 2.690 4.544 0.454 16 0 "[ . 1 . 2]" 1
578 1 35 TYR HA 1 84 THR HA . . 4.970 4.937 4.761 5.141 0.171 6 0 "[ . 1 . 2]" 1
579 1 35 TYR HA 1 84 THR HB . . 4.750 4.600 3.411 4.825 0.075 10 0 "[ . 1 . 2]" 1
580 1 35 TYR HB2 1 36 GLN H . . 5.440 3.656 3.593 3.944 . 0 0 "[ . 1 . 2]" 1
581 1 35 TYR HB2 1 82 VAL MG1 . . 5.000 4.657 3.848 4.998 . 0 0 "[ . 1 . 2]" 1
582 1 35 TYR HB2 1 83 LEU HA . . 5.120 5.039 4.719 5.161 0.041 20 0 "[ . 1 . 2]" 1
583 1 35 TYR HB2 1 84 THR H . . 5.050 4.930 4.400 5.307 0.257 16 0 "[ . 1 . 2]" 1
584 1 35 TYR HB2 1 84 THR MG . . 3.860 3.424 2.645 3.928 0.068 7 0 "[ . 1 . 2]" 1
585 1 35 TYR HB3 1 36 GLN H . . 5.240 4.121 4.080 4.277 . 0 0 "[ . 1 . 2]" 1
586 1 35 TYR HB3 1 82 VAL MG1 . . 4.100 3.340 2.424 3.817 . 0 0 "[ . 1 . 2]" 1
587 1 35 TYR HB3 1 83 LEU H . . 5.500 5.243 4.453 5.542 0.042 12 0 "[ . 1 . 2]" 1
588 1 35 TYR HB3 1 84 THR H . . 4.620 3.550 2.904 4.039 . 0 0 "[ . 1 . 2]" 1
589 1 35 TYR HB3 1 84 THR MG . . 4.180 2.720 1.902 3.351 . 0 0 "[ . 1 . 2]" 1
590 1 35 TYR QD 1 36 GLN H . . 3.550 2.614 2.460 2.824 . 0 0 "[ . 1 . 2]" 1
591 1 35 TYR QD 1 36 GLN HG2 . . 5.500 2.655 2.373 3.195 . 0 0 "[ . 1 . 2]" 1
592 1 35 TYR QD 1 36 GLN HG3 . . 3.680 2.218 2.045 2.706 . 0 0 "[ . 1 . 2]" 1
593 1 35 TYR QD 1 37 GLY H . . 5.500 4.688 4.596 4.727 . 0 0 "[ . 1 . 2]" 1
594 1 35 TYR QD 1 39 PRO HG2 . . 5.030 4.376 3.970 5.011 . 0 0 "[ . 1 . 2]" 1
595 1 35 TYR QD 1 82 VAL HA . . 5.500 4.436 3.930 4.652 . 0 0 "[ . 1 . 2]" 1
596 1 35 TYR QD 1 82 VAL HB . . 3.040 2.739 2.018 3.906 0.866 19 1 "[ . 1 . +2]" 1
597 1 35 TYR QD 1 82 VAL MG1 . . 3.260 2.277 1.919 2.483 . 0 0 "[ . 1 . 2]" 1
598 1 35 TYR QD 1 82 VAL MG2 . . 5.020 4.096 1.865 4.461 . 0 0 "[ . 1 . 2]" 1
599 1 35 TYR QD 1 83 LEU H . . 5.500 4.085 3.674 4.670 . 0 0 "[ . 1 . 2]" 1
600 1 35 TYR QD 1 83 LEU HA . . 3.850 2.966 2.548 3.897 0.047 19 0 "[ . 1 . 2]" 1
601 1 35 TYR QD 1 84 THR H . . 5.500 4.270 3.733 5.291 . 0 0 "[ . 1 . 2]" 1
602 1 35 TYR QD 1 84 THR MG . . 4.400 4.169 3.476 4.529 0.129 15 0 "[ . 1 . 2]" 1
603 1 35 TYR QE 1 36 GLN H . . 4.520 3.791 3.724 3.968 . 0 0 "[ . 1 . 2]" 1
604 1 35 TYR QE 1 36 GLN HB2 . . 4.590 3.046 2.923 3.188 . 0 0 "[ . 1 . 2]" 1
605 1 35 TYR QE 1 36 GLN HB3 . . 5.040 4.409 4.343 4.479 . 0 0 "[ . 1 . 2]" 1
606 1 35 TYR QE 1 36 GLN HE21 . . 3.680 3.306 2.972 3.551 . 0 0 "[ . 1 . 2]" 1
607 1 35 TYR QE 1 36 GLN HG2 . . 4.060 3.751 3.575 4.082 0.022 10 0 "[ . 1 . 2]" 1
608 1 35 TYR QE 1 36 GLN HG3 . . 3.660 2.122 1.987 2.493 . 0 0 "[ . 1 . 2]" 1
609 1 35 TYR QE 1 39 PRO HG2 . . 5.430 3.678 3.348 4.719 . 0 0 "[ . 1 . 2]" 1
610 1 35 TYR QE 1 81 ALA HA . . 5.030 4.440 3.956 5.173 0.143 19 0 "[ . 1 . 2]" 1
611 1 35 TYR QE 1 82 VAL HB . . 3.190 2.287 1.991 4.300 1.110 19 1 "[ . 1 . +2]" 1
612 1 35 TYR QE 1 82 VAL MG1 . . 3.450 3.406 1.716 3.680 0.230 16 0 "[ . 1 . 2]" 1
613 1 36 GLN H 1 36 GLN HB2 . . 3.560 2.263 2.209 2.422 . 0 0 "[ . 1 . 2]" 1
614 1 36 GLN H 1 36 GLN HB3 . . 3.860 3.503 3.324 3.621 . 0 0 "[ . 1 . 2]" 1
615 1 36 GLN H 1 36 GLN HG2 . . 4.070 3.744 3.577 4.120 0.050 19 0 "[ . 1 . 2]" 1
616 1 36 GLN H 1 36 GLN HG3 . . 3.980 3.556 3.460 3.847 . 0 0 "[ . 1 . 2]" 1
617 1 36 GLN H 1 37 GLY H . . 3.180 2.657 2.506 2.698 . 0 0 "[ . 1 . 2]" 1
618 1 36 GLN H 1 38 LYS H . . 3.970 3.852 3.748 4.019 0.049 18 0 "[ . 1 . 2]" 1
619 1 36 GLN HA 1 36 GLN HE21 . . 5.390 4.848 4.651 5.068 . 0 0 "[ . 1 . 2]" 1
620 1 36 GLN HA 1 36 GLN HG2 . . 3.450 2.123 2.050 2.194 . 0 0 "[ . 1 . 2]" 1
621 1 36 GLN HA 1 36 GLN HG3 . . 3.710 3.336 3.121 3.452 . 0 0 "[ . 1 . 2]" 1
622 1 36 GLN HB2 1 36 GLN HE21 . . 4.180 2.929 2.612 3.558 . 0 0 "[ . 1 . 2]" 1
623 1 36 GLN HB2 1 36 GLN HE22 . . 5.500 4.300 4.126 4.536 . 0 0 "[ . 1 . 2]" 1
624 1 36 GLN HB2 1 37 GLY H . . 5.100 4.041 4.004 4.122 . 0 0 "[ . 1 . 2]" 1
625 1 36 GLN HE21 1 36 GLN HG2 . . 3.660 3.518 3.304 3.553 . 0 0 "[ . 1 . 2]" 1
626 1 36 GLN HE21 1 38 LYS QE . . 5.500 5.048 4.537 5.401 . 0 0 "[ . 1 . 2]" 1
627 1 36 GLN HG2 1 37 GLY H . . 4.900 4.944 4.888 4.986 0.086 19 0 "[ . 1 . 2]" 1
628 1 36 GLN HG3 1 37 GLY H . . 5.500 5.525 5.505 5.587 0.087 19 0 "[ . 1 . 2]" 1
629 1 37 GLY H 1 38 LYS H . . 3.400 3.151 3.108 3.250 . 0 0 "[ . 1 . 2]" 1
630 1 37 GLY QA 1 38 LYS QE . . 5.110 3.713 3.500 4.829 . 0 0 "[ . 1 . 2]" 1
631 1 38 LYS H 1 38 LYS QE . . 4.700 4.140 4.037 4.735 0.035 10 0 "[ . 1 . 2]" 1
632 1 38 LYS H 1 39 PRO HD2 . . 5.180 1.989 1.918 2.204 . 0 0 "[ . 1 . 2]" 1
633 1 38 LYS H 1 39 PRO HG2 . . 4.270 3.718 3.665 3.874 . 0 0 "[ . 1 . 2]" 1
634 1 38 LYS HA 1 38 LYS QE . . 4.180 3.876 3.779 4.283 0.103 19 0 "[ . 1 . 2]" 1
635 1 38 LYS HA 1 38 LYS HG2 . . 3.700 2.816 2.749 3.226 . 0 0 "[ . 1 . 2]" 1
636 1 38 LYS HA 1 38 LYS HG3 . . 3.460 2.265 2.040 2.317 . 0 0 "[ . 1 . 2]" 1
637 1 38 LYS QB 1 38 LYS QE . . 4.040 2.012 1.937 2.050 . 0 0 "[ . 1 . 2]" 1
638 1 38 LYS QB 1 39 PRO HA . . 4.330 3.762 3.756 3.767 . 0 0 "[ . 1 . 2]" 1
639 1 38 LYS QD 1 38 LYS QE . . 2.470 2.072 2.034 2.085 . 0 0 "[ . 1 . 2]" 1
640 1 38 LYS QD 1 39 PRO HD2 . . 4.420 4.606 4.424 4.669 0.249 18 0 "[ . 1 . 2]" 1
641 1 38 LYS QD 1 39 PRO HD3 . . 4.470 3.742 3.633 4.337 . 0 0 "[ . 1 . 2]" 1
642 1 38 LYS QE 1 38 LYS HG3 . . 2.850 2.374 2.257 3.324 0.474 19 0 "[ . 1 . 2]" 1
643 1 38 LYS QE 1 39 PRO HD3 . . 3.880 3.493 3.106 3.559 . 0 0 "[ . 1 . 2]" 1
644 1 38 LYS QE 1 39 PRO HG3 . . 5.030 5.102 4.757 5.168 0.137 8 0 "[ . 1 . 2]" 1
645 1 38 LYS HG2 1 39 PRO HD2 . . 5.500 4.958 4.919 5.001 . 0 0 "[ . 1 . 2]" 1
646 1 38 LYS HG3 1 39 PRO HD2 . . 4.850 4.642 4.600 4.800 . 0 0 "[ . 1 . 2]" 1
647 1 38 LYS HG3 1 39 PRO HD3 . . 4.650 4.479 4.452 4.557 . 0 0 "[ . 1 . 2]" 1
648 1 39 PRO HA 1 40 MET H . . 3.090 2.320 2.153 2.494 . 0 0 "[ . 1 . 2]" 1
649 1 39 PRO HA 1 116 GLU HB3 . . 4.250 3.154 2.872 3.657 . 0 0 "[ . 1 . 2]" 1
650 1 39 PRO HA 1 116 GLU QG . . 4.040 3.908 3.341 3.997 . 0 0 "[ . 1 . 2]" 1
651 1 39 PRO HB2 1 40 MET H . . 4.280 4.142 3.574 4.304 0.024 10 0 "[ . 1 . 2]" 1
652 1 39 PRO HB3 1 116 GLU H . . 5.240 4.381 3.890 4.906 . 0 0 "[ . 1 . 2]" 1
653 1 39 PRO HB3 1 116 GLU HB3 . . 4.180 3.891 3.049 4.248 0.068 1 0 "[ . 1 . 2]" 1
654 1 40 MET H 1 40 MET QG . . 4.340 4.281 4.176 4.338 . 0 0 "[ . 1 . 2]" 1
655 1 40 MET H 1 41 PHE H . . 4.840 4.312 4.190 4.376 . 0 0 "[ . 1 . 2]" 1
656 1 40 MET H 1 113 PHE QD . . 4.700 2.198 1.922 2.698 . 0 0 "[ . 1 . 2]" 1
657 1 40 MET H 1 113 PHE QE . . 4.230 3.964 3.444 4.395 0.165 17 0 "[ . 1 . 2]" 1
658 1 40 MET HA 1 41 PHE H . . 3.490 2.293 2.201 2.412 . 0 0 "[ . 1 . 2]" 1
659 1 40 MET HA 1 113 PHE H . . 4.180 4.070 3.594 4.269 0.089 1 0 "[ . 1 . 2]" 1
660 1 40 MET HA 1 113 PHE HB3 . . 4.800 3.431 3.068 3.885 . 0 0 "[ . 1 . 2]" 1
661 1 40 MET QB 1 41 PHE H . . 4.420 3.330 2.873 3.546 . 0 0 "[ . 1 . 2]" 1
662 1 40 MET QB 1 41 PHE HA . . 4.940 4.136 3.793 4.319 . 0 0 "[ . 1 . 2]" 1
663 1 40 MET ME 1 40 MET QG . . 3.350 2.024 1.962 2.157 . 0 0 "[ . 1 . 2]" 1
664 1 40 MET ME 1 41 PHE H . . 3.340 1.950 1.868 2.068 . 0 0 "[ . 1 . 2]" 1
665 1 40 MET ME 1 41 PHE HA . . 4.240 3.891 3.747 4.264 0.024 19 0 "[ . 1 . 2]" 1
666 1 40 MET ME 1 42 TYR H . . 4.380 4.286 3.745 4.523 0.143 10 0 "[ . 1 . 2]" 1
667 1 40 MET ME 1 42 TYR HA . . 5.210 3.567 2.779 3.811 . 0 0 "[ . 1 . 2]" 1
668 1 40 MET ME 1 42 TYR QE . . 3.580 2.470 1.911 3.222 . 0 0 "[ . 1 . 2]" 1
669 1 40 MET ME 1 83 LEU QD . . 4.180 2.139 1.903 2.711 . 0 0 "[ . 1 . 2]" 1
670 1 40 MET ME 1 110 PRO HD3 . . 5.500 4.356 4.175 4.787 . 0 0 "[ . 1 . 2]" 1
671 1 40 MET ME 1 110 PRO QG . . 3.730 2.951 2.558 3.433 . 0 0 "[ . 1 . 2]" 1
672 1 40 MET ME 1 111 TYR H . . 3.520 3.578 3.362 3.665 0.145 9 0 "[ . 1 . 2]" 1
673 1 40 MET ME 1 113 PHE H . . 5.500 5.123 4.742 5.522 0.022 14 0 "[ . 1 . 2]" 1
674 1 40 MET QG 1 41 PHE H . . 4.420 2.578 2.038 3.320 . 0 0 "[ . 1 . 2]" 1
675 1 41 PHE H 1 41 PHE QD . . 4.310 4.264 3.932 4.426 0.116 19 0 "[ . 1 . 2]" 1
676 1 41 PHE H 1 42 TYR H . . 4.710 4.174 3.742 4.343 . 0 0 "[ . 1 . 2]" 1
677 1 41 PHE H 1 81 ALA MB . . 4.750 3.742 3.353 4.073 . 0 0 "[ . 1 . 2]" 1
678 1 41 PHE H 1 83 LEU QD . . 5.500 4.804 4.566 5.283 . 0 0 "[ . 1 . 2]" 1
679 1 41 PHE H 1 111 TYR H . . 4.450 4.275 4.062 4.525 0.075 12 0 "[ . 1 . 2]" 1
680 1 41 PHE H 1 113 PHE H . . 5.380 5.313 4.835 5.485 0.105 17 0 "[ . 1 . 2]" 1
681 1 41 PHE H 1 113 PHE QD . . 5.430 4.595 4.363 4.810 . 0 0 "[ . 1 . 2]" 1
682 1 41 PHE HA 1 42 TYR H . . 3.290 2.211 2.140 2.308 . 0 0 "[ . 1 . 2]" 1
683 1 41 PHE HA 1 42 TYR QD . . 4.490 4.250 3.249 4.602 0.112 9 0 "[ . 1 . 2]" 1
684 1 41 PHE HA 1 142 ILE MG . . 4.770 4.278 3.805 4.569 . 0 0 "[ . 1 . 2]" 1
685 1 41 PHE HB2 1 42 TYR H . . 4.140 3.829 3.586 4.133 . 0 0 "[ . 1 . 2]" 1
686 1 41 PHE HB2 1 113 PHE QE . . 3.600 2.954 2.753 3.708 0.108 17 0 "[ . 1 . 2]" 1
687 1 41 PHE HB2 1 142 ILE MD . . 5.050 4.040 2.669 4.771 . 0 0 "[ . 1 . 2]" 1
688 1 41 PHE HB2 1 142 ILE MG . . 4.000 3.406 2.404 3.805 . 0 0 "[ . 1 . 2]" 1
689 1 41 PHE HB3 1 42 TYR HA . . 5.310 5.138 5.001 5.313 0.003 19 0 "[ . 1 . 2]" 1
690 1 41 PHE HB3 1 113 PHE QD . . 3.510 2.617 2.437 3.532 0.022 17 0 "[ . 1 . 2]" 1
691 1 41 PHE HB3 1 113 PHE QE . . 4.810 3.268 2.827 4.420 . 0 0 "[ . 1 . 2]" 1
692 1 41 PHE QD 1 42 TYR H . . 5.040 2.576 2.279 2.988 . 0 0 "[ . 1 . 2]" 1
693 1 41 PHE QD 1 42 TYR HA . . 4.790 4.265 3.883 4.458 . 0 0 "[ . 1 . 2]" 1
694 1 41 PHE QD 1 43 VAL QG . . 3.920 3.442 2.979 3.971 0.051 15 0 "[ . 1 . 2]" 1
695 1 41 PHE QD 1 113 PHE QD . . 4.680 3.358 2.877 4.175 . 0 0 "[ . 1 . 2]" 1
696 1 41 PHE QD 1 113 PHE QE . . 5.080 3.420 2.739 4.594 . 0 0 "[ . 1 . 2]" 1
697 1 41 PHE QD 1 142 ILE MD . . 4.000 2.942 2.468 3.570 . 0 0 "[ . 1 . 2]" 1
698 1 41 PHE QD 1 142 ILE MG . . 4.800 2.615 1.864 3.037 . 0 0 "[ . 1 . 2]" 1
699 1 41 PHE QE 1 43 VAL QG . . 3.190 2.265 1.857 2.689 . 0 0 "[ . 1 . 2]" 1
700 1 41 PHE QE 1 67 VAL QG . . 4.740 3.606 3.137 4.099 . 0 0 "[ . 1 . 2]" 1
701 1 41 PHE HZ 1 43 VAL QG . . 3.630 2.575 2.213 3.119 . 0 0 "[ . 1 . 2]" 1
702 1 41 PHE HZ 1 142 ILE MG . . 5.480 4.790 3.771 5.361 . 0 0 "[ . 1 . 2]" 1
703 1 42 TYR H 1 42 TYR HB3 . . 4.060 3.732 3.622 3.837 . 0 0 "[ . 1 . 2]" 1
704 1 42 TYR H 1 42 TYR QD . . 3.750 3.334 2.677 3.783 0.033 4 0 "[ . 1 . 2]" 1
705 1 42 TYR H 1 43 VAL H . . 5.280 4.401 4.228 4.503 . 0 0 "[ . 1 . 2]" 1
706 1 42 TYR H 1 44 LEU QD . . 5.270 4.177 3.857 4.842 . 0 0 "[ . 1 . 2]" 1
707 1 42 TYR H 1 142 ILE MG . . 5.500 4.664 4.133 5.077 . 0 0 "[ . 1 . 2]" 1
708 1 42 TYR HA 1 42 TYR QD . . 4.010 2.415 2.086 3.034 . 0 0 "[ . 1 . 2]" 1
709 1 42 TYR HA 1 42 TYR QE . . 4.920 4.461 4.263 4.746 . 0 0 "[ . 1 . 2]" 1
710 1 42 TYR HA 1 43 VAL H . . 3.080 2.176 2.138 2.253 . 0 0 "[ . 1 . 2]" 1
711 1 42 TYR HA 1 43 VAL HA . . 4.410 4.380 4.370 4.393 . 0 0 "[ . 1 . 2]" 1
712 1 42 TYR HA 1 43 VAL QG . . 4.190 3.402 3.238 3.614 . 0 0 "[ . 1 . 2]" 1
713 1 42 TYR HB2 1 43 VAL H . . 4.490 4.146 3.815 4.374 . 0 0 "[ . 1 . 2]" 1
714 1 42 TYR HB2 1 44 LEU H . . 5.500 4.599 4.089 5.253 . 0 0 "[ . 1 . 2]" 1
715 1 42 TYR HB2 1 44 LEU QD . . 3.690 2.617 2.232 3.432 . 0 0 "[ . 1 . 2]" 1
716 1 42 TYR HB2 1 108 ALA MB . . 4.580 4.506 3.626 4.703 0.123 10 0 "[ . 1 . 2]" 1
717 1 42 TYR HB3 1 43 VAL H . . 4.980 3.173 2.851 3.506 . 0 0 "[ . 1 . 2]" 1
718 1 42 TYR HB3 1 44 LEU QD . . 3.970 2.467 1.975 3.707 . 0 0 "[ . 1 . 2]" 1
719 1 42 TYR HB3 1 108 ALA MB . . 5.500 3.033 2.292 3.196 . 0 0 "[ . 1 . 2]" 1
720 1 42 TYR QD 1 43 VAL H . . 5.010 3.787 3.410 4.330 . 0 0 "[ . 1 . 2]" 1
721 1 42 TYR QD 1 88 PHE QD . . 4.800 3.798 3.146 4.364 . 0 0 "[ . 1 . 2]" 1
722 1 42 TYR QD 1 108 ALA MB . . 3.950 3.372 2.942 3.853 . 0 0 "[ . 1 . 2]" 1
723 1 42 TYR QD 1 110 PRO HA . . 3.950 3.498 2.871 3.942 . 0 0 "[ . 1 . 2]" 1
724 1 42 TYR QD 1 111 TYR H . . 5.500 5.384 4.901 5.593 0.093 16 0 "[ . 1 . 2]" 1
725 1 42 TYR QE 1 86 SER QB . . 5.320 3.274 2.747 3.811 . 0 0 "[ . 1 . 2]" 1
726 1 42 TYR QE 1 87 PRO HD2 . . 5.490 3.697 2.692 4.590 . 0 0 "[ . 1 . 2]" 1
727 1 42 TYR QE 1 88 PHE H . . 5.210 4.261 3.662 4.736 . 0 0 "[ . 1 . 2]" 1
728 1 42 TYR QE 1 88 PHE HB2 . . 4.760 3.482 2.807 4.774 0.014 5 0 "[ . 1 . 2]" 1
729 1 42 TYR QE 1 88 PHE QD . . 3.960 3.841 3.363 4.166 0.206 18 0 "[ . 1 . 2]" 1
730 1 42 TYR QE 1 92 LEU QD . . 2.910 2.181 1.725 2.816 . 0 0 "[ . 1 . 2]" 1
731 1 42 TYR QE 1 92 LEU HG . . 5.360 3.884 3.012 5.035 . 0 0 "[ . 1 . 2]" 1
732 1 43 VAL H 1 43 VAL HB . . 3.330 2.746 2.536 3.114 . 0 0 "[ . 1 . 2]" 1
733 1 43 VAL H 1 43 VAL QG . . 3.310 2.230 1.811 2.468 . 0 0 "[ . 1 . 2]" 1
734 1 43 VAL H 1 44 LEU QD . . 5.500 3.741 3.411 4.725 . 0 0 "[ . 1 . 2]" 1
735 1 43 VAL H 1 109 TYR HB3 . . 5.040 4.397 3.843 4.817 . 0 0 "[ . 1 . 2]" 1
736 1 43 VAL H 1 111 TYR QD . . 5.500 4.713 4.003 5.602 0.102 1 0 "[ . 1 . 2]" 1
737 1 43 VAL H 1 111 TYR QE . . 4.900 4.934 4.556 5.096 0.196 20 0 "[ . 1 . 2]" 1
738 1 43 VAL HA 1 43 VAL QG . . 3.080 2.186 2.096 2.352 . 0 0 "[ . 1 . 2]" 1
739 1 43 VAL HA 1 44 LEU H . . 3.130 2.275 2.188 2.417 . 0 0 "[ . 1 . 2]" 1
740 1 43 VAL HA 1 44 LEU QD . . 3.500 3.444 3.190 3.666 0.166 20 0 "[ . 1 . 2]" 1
741 1 43 VAL HB 1 44 LEU H . . 5.080 4.431 4.366 4.572 . 0 0 "[ . 1 . 2]" 1
742 1 43 VAL HB 1 109 TYR H . . 4.210 3.504 2.679 4.603 0.393 15 0 "[ . 1 . 2]" 1
743 1 43 VAL HB 1 109 TYR HB3 . . 4.030 3.275 2.518 4.362 0.332 15 0 "[ . 1 . 2]" 1
744 1 43 VAL HB 1 111 TYR QD . . 5.070 4.199 3.610 5.137 0.067 1 0 "[ . 1 . 2]" 1
745 1 43 VAL HB 1 111 TYR QE . . 4.250 3.352 2.998 4.084 . 0 0 "[ . 1 . 2]" 1
746 1 43 VAL QG 1 44 LEU H . . 3.640 3.255 3.007 3.454 . 0 0 "[ . 1 . 2]" 1
747 1 43 VAL QG 1 45 PHE HA . . 4.620 4.376 3.919 4.778 0.158 20 0 "[ . 1 . 2]" 1
748 1 43 VAL QG 1 45 PHE HB3 . . 3.610 2.802 2.330 3.302 . 0 0 "[ . 1 . 2]" 1
749 1 43 VAL QG 1 45 PHE QR . . 3.350 1.948 1.815 2.850 . 0 0 "[ . 1 . 2]" 1
750 1 43 VAL QG 1 65 MET ME . . 3.640 1.919 1.747 2.209 . 0 0 "[ . 1 . 2]" 1
751 1 43 VAL QG 1 67 VAL QG . . 4.200 3.300 2.834 3.589 . 0 0 "[ . 1 . 2]" 1
752 1 43 VAL QG 1 109 TYR H . . 5.280 3.255 1.797 3.922 . 0 0 "[ . 1 . 2]" 1
753 1 43 VAL QG 1 109 TYR HB3 . . 3.340 2.820 1.848 3.352 0.012 13 0 "[ . 1 . 2]" 1
754 1 43 VAL QG 1 111 TYR H . . 4.780 3.733 3.117 4.272 . 0 0 "[ . 1 . 2]" 1
755 1 43 VAL QG 1 111 TYR QD . . 3.190 2.336 1.887 3.338 0.148 12 0 "[ . 1 . 2]" 1
756 1 43 VAL QG 1 111 TYR QE . . 3.230 2.115 1.867 2.722 . 0 0 "[ . 1 . 2]" 1
757 1 44 LEU H 1 44 LEU HB2 . . 3.530 2.309 2.229 2.651 . 0 0 "[ . 1 . 2]" 1
758 1 44 LEU H 1 44 LEU HB3 . . 3.690 3.552 3.523 3.580 . 0 0 "[ . 1 . 2]" 1
759 1 44 LEU H 1 44 LEU QD . . 3.420 1.945 1.875 2.161 . 0 0 "[ . 1 . 2]" 1
760 1 44 LEU H 1 44 LEU HG . . 3.840 3.815 2.450 3.974 0.134 6 0 "[ . 1 . 2]" 1
761 1 44 LEU H 1 45 PHE H . . 4.420 4.290 4.088 4.613 0.193 15 0 "[ . 1 . 2]" 1
762 1 44 LEU H 1 45 PHE QD . . 5.500 4.883 4.676 5.068 . 0 0 "[ . 1 . 2]" 1
763 1 44 LEU HA 1 44 LEU QD . . 3.300 2.124 1.917 3.085 . 0 0 "[ . 1 . 2]" 1
764 1 44 LEU HA 1 44 LEU HG . . 3.640 3.591 2.351 3.752 0.112 18 0 "[ . 1 . 2]" 1
765 1 44 LEU HA 1 45 PHE H . . 3.040 2.192 2.144 2.281 . 0 0 "[ . 1 . 2]" 1
766 1 44 LEU HA 1 45 PHE QD . . 4.880 4.304 3.434 4.554 . 0 0 "[ . 1 . 2]" 1
767 1 44 LEU HA 1 107 GLY H . . 5.500 5.150 4.471 5.657 0.157 8 0 "[ . 1 . 2]" 1
768 1 44 LEU HA 1 108 ALA HA . . 3.440 3.221 2.150 3.471 0.031 6 0 "[ . 1 . 2]" 1
769 1 44 LEU HA 1 108 ALA MB . . 3.830 3.447 2.788 3.835 0.005 7 0 "[ . 1 . 2]" 1
770 1 44 LEU HB2 1 45 PHE H . . 4.650 4.469 3.930 4.533 . 0 0 "[ . 1 . 2]" 1
771 1 44 LEU HB3 1 45 PHE H . . 4.100 3.779 2.987 4.049 . 0 0 "[ . 1 . 2]" 1
772 1 44 LEU QD 1 45 PHE H . . 4.030 3.561 3.169 4.175 0.145 20 0 "[ . 1 . 2]" 1
773 1 44 LEU QD 1 45 PHE HA . . 5.500 4.994 4.785 5.192 . 0 0 "[ . 1 . 2]" 1
774 1 44 LEU QD 1 88 PHE HB3 . . 5.350 4.501 3.940 5.142 . 0 0 "[ . 1 . 2]" 1
775 1 44 LEU QD 1 88 PHE QD . . 3.720 3.192 2.910 3.472 . 0 0 "[ . 1 . 2]" 1
776 1 44 LEU QD 1 88 PHE QE . . 3.590 2.284 1.888 3.116 . 0 0 "[ . 1 . 2]" 1
777 1 44 LEU QD 1 88 PHE HZ . . 3.850 3.470 2.679 3.704 . 0 0 "[ . 1 . 2]" 1
778 1 44 LEU QD 1 91 LYS HB2 . . 5.340 4.632 4.056 5.026 . 0 0 "[ . 1 . 2]" 1
779 1 44 LEU QD 1 91 LYS HG2 . . 4.950 4.799 3.506 5.226 0.276 20 0 "[ . 1 . 2]" 1
780 1 44 LEU QD 1 91 LYS HG3 . . 5.370 4.334 3.159 5.264 . 0 0 "[ . 1 . 2]" 1
781 1 44 LEU QD 1 107 GLY H . . 5.500 4.868 4.389 5.302 . 0 0 "[ . 1 . 2]" 1
782 1 44 LEU QD 1 108 ALA H . . 5.500 5.042 4.834 5.211 . 0 0 "[ . 1 . 2]" 1
783 1 44 LEU QD 1 108 ALA HA . . 4.380 3.626 3.259 4.276 . 0 0 "[ . 1 . 2]" 1
784 1 44 LEU QD 1 108 ALA MB . . 3.480 2.660 2.361 3.082 . 0 0 "[ . 1 . 2]" 1
785 1 44 LEU QD 1 109 TYR H . . 5.360 4.359 3.982 5.162 . 0 0 "[ . 1 . 2]" 1
786 1 44 LEU HG 1 88 PHE QE . . 5.240 3.920 2.765 4.762 . 0 0 "[ . 1 . 2]" 1
787 1 44 LEU HG 1 88 PHE HZ . . 4.860 4.726 4.261 4.990 0.130 15 0 "[ . 1 . 2]" 1
788 1 45 PHE H 1 45 PHE QD . . 3.650 3.038 2.527 3.271 . 0 0 "[ . 1 . 2]" 1
789 1 45 PHE H 1 45 PHE QE . . 4.370 4.287 4.066 4.442 0.072 15 0 "[ . 1 . 2]" 1
790 1 45 PHE H 1 46 GLU H . . 4.720 4.450 4.388 4.506 . 0 0 "[ . 1 . 2]" 1
791 1 45 PHE H 1 108 ALA HA . . 3.850 3.255 2.993 3.535 . 0 0 "[ . 1 . 2]" 1
792 1 45 PHE H 1 108 ALA MB . . 4.780 4.322 3.962 4.659 . 0 0 "[ . 1 . 2]" 1
793 1 45 PHE H 1 109 TYR H . . 5.190 5.194 4.805 5.297 0.107 14 0 "[ . 1 . 2]" 1
794 1 45 PHE HA 1 45 PHE QD . . 4.090 3.706 3.687 3.727 . 0 0 "[ . 1 . 2]" 1
795 1 45 PHE HA 1 45 PHE QR . . 4.370 3.658 3.640 3.678 . 0 0 "[ . 1 . 2]" 1
796 1 45 PHE HA 1 46 GLU H . . 3.170 2.374 2.291 2.531 . 0 0 "[ . 1 . 2]" 1
797 1 45 PHE HA 1 46 GLU HB2 . . 5.030 4.166 4.032 4.363 . 0 0 "[ . 1 . 2]" 1
798 1 45 PHE HA 1 46 GLU HB3 . . 5.210 4.933 4.495 5.315 0.105 8 0 "[ . 1 . 2]" 1
799 1 45 PHE HB2 1 46 GLU H . . 3.630 2.530 2.196 2.737 . 0 0 "[ . 1 . 2]" 1
800 1 45 PHE HB2 1 61 ILE MD . . 5.280 4.618 4.109 5.009 . 0 0 "[ . 1 . 2]" 1
801 1 45 PHE HB3 1 46 GLU H . . 3.910 3.823 3.616 3.971 0.061 9 0 "[ . 1 . 2]" 1
802 1 45 PHE QR 1 46 GLU HA . . 4.140 3.401 2.947 3.601 . 0 0 "[ . 1 . 2]" 1
803 1 45 PHE QR 1 47 LEU HA . . 4.570 3.479 3.316 3.890 . 0 0 "[ . 1 . 2]" 1
804 1 45 PHE QR 1 47 LEU HB2 . . 4.390 2.168 1.905 2.670 . 0 0 "[ . 1 . 2]" 1
805 1 45 PHE QR 1 47 LEU HB3 . . 4.130 2.121 1.931 2.518 . 0 0 "[ . 1 . 2]" 1
806 1 45 PHE QR 1 47 LEU HG . . 3.750 3.462 3.191 3.944 0.194 18 0 "[ . 1 . 2]" 1
807 1 45 PHE QR 1 61 ILE HB . . 4.840 4.920 4.606 5.078 0.238 9 0 "[ . 1 . 2]" 1
808 1 45 PHE QR 1 61 ILE MD . . 3.440 2.139 1.963 2.431 . 0 0 "[ . 1 . 2]" 1
809 1 45 PHE QR 1 61 ILE HG13 . . 4.360 3.184 2.941 3.274 . 0 0 "[ . 1 . 2]" 1
810 1 45 PHE QR 1 61 ILE MG . . 3.920 3.039 2.501 3.414 . 0 0 "[ . 1 . 2]" 1
811 1 45 PHE QR 1 107 GLY HA3 . . 4.760 4.091 3.573 4.831 0.071 8 0 "[ . 1 . 2]" 1
812 1 45 PHE QR 1 108 ALA HA . . 3.900 3.256 2.549 3.830 . 0 0 "[ . 1 . 2]" 1
813 1 45 PHE QR 1 108 ALA MB . . 4.770 4.209 3.719 4.585 . 0 0 "[ . 1 . 2]" 1
814 1 45 PHE QR 1 109 TYR HB2 . . 3.940 2.144 1.913 2.776 . 0 0 "[ . 1 . 2]" 1
815 1 45 PHE QR 1 109 TYR HB3 . . 3.800 2.486 1.953 3.600 . 0 0 "[ . 1 . 2]" 1
816 1 45 PHE QD 1 46 GLU H . . 4.110 3.253 2.550 3.706 . 0 0 "[ . 1 . 2]" 1
817 1 45 PHE QD 1 47 LEU H . . 4.210 2.041 1.908 2.270 . 0 0 "[ . 1 . 2]" 1
818 1 45 PHE QD 1 47 LEU HB3 . . 3.530 3.110 2.871 3.402 . 0 0 "[ . 1 . 2]" 1
819 1 45 PHE QD 1 65 MET ME . . 3.730 3.425 2.747 3.738 0.008 15 0 "[ . 1 . 2]" 1
820 1 45 PHE QD 1 107 GLY H . . 4.360 4.065 3.501 4.392 0.032 13 0 "[ . 1 . 2]" 1
821 1 45 PHE QE 1 61 ILE MD . . 3.960 2.169 1.977 2.521 . 0 0 "[ . 1 . 2]" 1
822 1 45 PHE QE 1 61 ILE HG13 . . 3.200 3.220 2.964 3.318 0.118 16 0 "[ . 1 . 2]" 1
823 1 45 PHE QE 1 65 MET ME . . 4.090 3.541 2.921 4.125 0.035 16 0 "[ . 1 . 2]" 1
824 1 45 PHE QE 1 108 ALA HA . . 4.240 3.527 2.721 4.227 . 0 0 "[ . 1 . 2]" 1
825 1 45 PHE QE 1 109 TYR H . . 4.300 3.582 2.867 4.101 . 0 0 "[ . 1 . 2]" 1
826 1 45 PHE QE 1 109 TYR HB3 . . 3.940 2.541 1.957 3.890 . 0 0 "[ . 1 . 2]" 1
827 1 45 PHE QE 1 109 TYR QD . . 3.890 3.475 2.898 3.897 0.007 13 0 "[ . 1 . 2]" 1
828 1 46 GLU H 1 46 GLU HB2 . . 3.630 2.721 2.434 3.256 . 0 0 "[ . 1 . 2]" 1
829 1 46 GLU H 1 46 GLU HB3 . . 3.510 2.829 2.635 3.200 . 0 0 "[ . 1 . 2]" 1
830 1 46 GLU H 1 46 GLU QG . . 4.560 4.077 3.905 4.219 . 0 0 "[ . 1 . 2]" 1
831 1 46 GLU HA 1 46 GLU QG . . 3.720 2.253 2.129 2.489 . 0 0 "[ . 1 . 2]" 1
832 1 46 GLU HA 1 47 LEU H . . 3.110 2.357 2.289 2.420 . 0 0 "[ . 1 . 2]" 1
833 1 46 GLU HA 1 47 LEU HA . . 5.120 4.512 4.468 4.537 . 0 0 "[ . 1 . 2]" 1
834 1 46 GLU HA 1 107 GLY H . . 3.980 3.367 2.964 3.924 . 0 0 "[ . 1 . 2]" 1
835 1 46 GLU QG 1 47 LEU H . . 4.520 3.846 3.651 4.122 . 0 0 "[ . 1 . 2]" 1
836 1 46 GLU QG 1 105 ILE H . . 5.390 4.415 3.598 4.974 . 0 0 "[ . 1 . 2]" 1
837 1 46 GLU QG 1 105 ILE HA . . 4.670 4.476 3.985 4.745 0.075 13 0 "[ . 1 . 2]" 1
838 1 46 GLU QG 1 106 GLN HE21 . . 4.040 3.111 2.028 4.310 0.270 8 0 "[ . 1 . 2]" 1
839 1 46 GLU QG 1 106 GLN HE22 . . 4.890 3.639 2.722 4.896 0.006 15 0 "[ . 1 . 2]" 1
840 1 47 LEU H 1 47 LEU HB2 . . 3.580 2.736 2.671 2.875 . 0 0 "[ . 1 . 2]" 1
841 1 47 LEU H 1 47 LEU HB3 . . 4.050 2.386 2.346 2.446 . 0 0 "[ . 1 . 2]" 1
842 1 47 LEU H 1 107 GLY H . . 4.880 3.669 3.119 4.327 . 0 0 "[ . 1 . 2]" 1
843 1 47 LEU HA 1 47 LEU MD2 . . 3.240 1.981 1.939 2.074 . 0 0 "[ . 1 . 2]" 1
844 1 47 LEU HA 1 47 LEU HG . . 4.160 3.692 3.683 3.711 . 0 0 "[ . 1 . 2]" 1
845 1 47 LEU HA 1 48 THR H . . 3.120 2.143 2.138 2.153 . 0 0 "[ . 1 . 2]" 1
846 1 47 LEU HA 1 48 THR HB . . 5.210 4.903 4.756 5.164 . 0 0 "[ . 1 . 2]" 1
847 1 47 LEU HB2 1 48 THR H . . 5.010 4.319 4.251 4.385 . 0 0 "[ . 1 . 2]" 1
848 1 47 LEU HB2 1 61 ILE MD . . 3.610 2.158 1.922 2.395 . 0 0 "[ . 1 . 2]" 1
849 1 47 LEU HB3 1 47 LEU HG . . 2.840 2.596 2.579 2.606 . 0 0 "[ . 1 . 2]" 1
850 1 47 LEU HB3 1 48 THR H . . 4.320 4.373 4.234 4.402 0.082 20 0 "[ . 1 . 2]" 1
851 1 47 LEU HB3 1 61 ILE MD . . 5.500 2.668 2.031 3.038 . 0 0 "[ . 1 . 2]" 1
852 1 47 LEU MD2 1 48 THR H . . 3.290 2.286 2.031 2.436 . 0 0 "[ . 1 . 2]" 1
853 1 47 LEU MD2 1 60 MET QB . . 4.210 3.390 2.993 3.894 . 0 0 "[ . 1 . 2]" 1
854 1 47 LEU MD2 1 60 MET ME . . 3.420 2.438 1.864 3.129 . 0 0 "[ . 1 . 2]" 1
855 1 47 LEU MD2 1 61 ILE HA . . 4.860 4.557 4.306 4.799 . 0 0 "[ . 1 . 2]" 1
856 1 47 LEU MD2 1 61 ILE MD . . 3.210 3.001 2.741 3.236 0.026 18 0 "[ . 1 . 2]" 1
857 1 47 LEU HG 1 60 MET QB . . 3.620 3.512 3.362 3.590 . 0 0 "[ . 1 . 2]" 1
858 1 47 LEU HG 1 61 ILE H . . 4.570 4.341 4.103 4.578 0.008 5 0 "[ . 1 . 2]" 1
859 1 47 LEU HG 1 61 ILE HA . . 4.790 4.073 3.655 4.446 . 0 0 "[ . 1 . 2]" 1
860 1 47 LEU HG 1 61 ILE MD . . 4.050 1.905 1.865 2.038 . 0 0 "[ . 1 . 2]" 1
861 1 48 THR H 1 48 THR HB . . 3.690 2.775 2.628 3.034 . 0 0 "[ . 1 . 2]" 1
862 1 48 THR H 1 49 ASN H . . 5.150 4.378 4.148 4.516 . 0 0 "[ . 1 . 2]" 1
863 1 48 THR H 1 60 MET ME . . 5.440 4.987 4.289 5.355 . 0 0 "[ . 1 . 2]" 1
864 1 48 THR H 1 61 ILE MD . . 5.500 5.511 5.317 5.589 0.089 8 0 "[ . 1 . 2]" 1
865 1 48 THR HA 1 48 THR MG . . 3.120 2.180 2.080 2.328 . 0 0 "[ . 1 . 2]" 1
866 1 48 THR HA 1 49 ASN H . . 3.150 2.153 2.142 2.183 . 0 0 "[ . 1 . 2]" 1
867 1 48 THR HA 1 49 ASN HB2 . . 5.490 4.422 4.292 4.532 . 0 0 "[ . 1 . 2]" 1
868 1 48 THR HA 1 49 ASN HB3 . . 5.130 4.787 4.704 4.899 . 0 0 "[ . 1 . 2]" 1
869 1 48 THR HA 1 105 ILE HG12 . . 5.290 5.323 4.773 5.807 0.517 5 1 "[ + 1 . 2]" 1
870 1 48 THR HB 1 49 ASN H . . 4.790 4.098 3.951 4.298 . 0 0 "[ . 1 . 2]" 1
871 1 48 THR MG 1 103 GLU HB3 . . 4.960 4.956 4.640 5.025 0.065 8 0 "[ . 1 . 2]" 1
872 1 48 THR MG 1 105 ILE H . . 3.180 3.170 3.043 3.233 0.053 16 0 "[ . 1 . 2]" 1
873 1 49 ASN H 1 49 ASN HB2 . . 3.960 2.453 2.340 2.560 . 0 0 "[ . 1 . 2]" 1
874 1 49 ASN H 1 49 ASN HB3 . . 3.750 2.669 2.596 2.754 . 0 0 "[ . 1 . 2]" 1
875 1 49 ASN H 1 49 ASN HD21 . . 4.880 4.785 4.734 4.847 . 0 0 "[ . 1 . 2]" 1
876 1 49 ASN H 1 50 THR H . . 4.800 3.979 3.669 4.307 . 0 0 "[ . 1 . 2]" 1
877 1 49 ASN H 1 60 MET ME . . 4.620 4.307 3.411 4.645 0.025 16 0 "[ . 1 . 2]" 1
878 1 49 ASN H 1 101 PRO HA . . 5.340 4.572 4.413 4.745 . 0 0 "[ . 1 . 2]" 1
879 1 49 ASN H 1 102 GLY H . . 4.570 4.659 4.602 4.734 0.164 18 0 "[ . 1 . 2]" 1
880 1 49 ASN H 1 103 GLU H . . 5.030 4.958 4.863 5.066 0.036 2 0 "[ . 1 . 2]" 1
881 1 49 ASN HA 1 50 THR H . . 3.160 2.333 2.178 2.489 . 0 0 "[ . 1 . 2]" 1
882 1 49 ASN HA 1 50 THR MG . . 5.000 3.966 3.856 4.309 . 0 0 "[ . 1 . 2]" 1
883 1 49 ASN HA 1 51 THR H . . 4.010 3.164 3.047 3.328 . 0 0 "[ . 1 . 2]" 1
884 1 49 ASN HA 1 51 THR MG . . 5.480 3.713 3.315 5.296 . 0 0 "[ . 1 . 2]" 1
885 1 49 ASN HA 1 60 MET ME . . 3.120 2.197 1.935 2.653 . 0 0 "[ . 1 . 2]" 1
886 1 49 ASN HB2 1 50 THR H . . 5.300 4.626 4.524 4.662 . 0 0 "[ . 1 . 2]" 1
887 1 49 ASN HB2 1 60 MET ME . . 4.210 3.430 2.406 4.065 . 0 0 "[ . 1 . 2]" 1
888 1 49 ASN HB2 1 99 ILE MD . . 3.660 3.698 3.403 3.831 0.171 7 0 "[ . 1 . 2]" 1
889 1 49 ASN HB2 1 101 PRO HA . . 5.270 4.011 3.714 4.113 . 0 0 "[ . 1 . 2]" 1
890 1 49 ASN HB2 1 102 GLY H . . 5.330 5.215 5.007 5.420 0.090 11 0 "[ . 1 . 2]" 1
891 1 49 ASN HB3 1 50 THR H . . 5.400 4.402 4.324 4.440 . 0 0 "[ . 1 . 2]" 1
892 1 49 ASN HB3 1 51 THR H . . 5.500 4.358 4.154 4.520 . 0 0 "[ . 1 . 2]" 1
893 1 49 ASN HB3 1 60 MET ME . . 5.050 4.399 3.653 4.901 . 0 0 "[ . 1 . 2]" 1
894 1 49 ASN HB3 1 99 ILE MD . . 4.000 3.908 3.677 4.203 0.203 11 0 "[ . 1 . 2]" 1
895 1 49 ASN HB3 1 99 ILE QG . . 4.740 4.396 3.522 4.898 0.158 18 0 "[ . 1 . 2]" 1
896 1 49 ASN HB3 1 102 GLY H . . 4.810 3.532 3.334 3.740 . 0 0 "[ . 1 . 2]" 1
897 1 49 ASN HB3 1 103 GLU H . . 4.410 4.422 4.146 4.592 0.182 5 0 "[ . 1 . 2]" 1
898 1 49 ASN HD21 1 51 THR H . . 5.500 4.720 4.187 5.216 . 0 0 "[ . 1 . 2]" 1
899 1 49 ASN HD21 1 54 THR HA . . 4.310 4.283 3.855 4.425 0.115 5 0 "[ . 1 . 2]" 1
900 1 49 ASN HD21 1 99 ILE H . . 5.500 5.032 4.628 5.578 0.078 11 0 "[ . 1 . 2]" 1
901 1 49 ASN HD21 1 99 ILE MD . . 3.810 2.521 1.922 3.403 . 0 0 "[ . 1 . 2]" 1
902 1 49 ASN HD21 1 100 ASN H . . 5.500 3.863 3.381 4.328 . 0 0 "[ . 1 . 2]" 1
903 1 49 ASN HD21 1 100 ASN HA . . 5.500 4.248 3.780 4.645 . 0 0 "[ . 1 . 2]" 1
904 1 49 ASN HD21 1 101 PRO HA . . 4.600 2.343 2.118 2.800 . 0 0 "[ . 1 . 2]" 1
905 1 49 ASN HD21 1 101 PRO HB2 . . 4.830 3.701 3.503 4.013 . 0 0 "[ . 1 . 2]" 1
906 1 49 ASN HD21 1 101 PRO QD . . 5.500 2.365 2.018 2.673 . 0 0 "[ . 1 . 2]" 1
907 1 49 ASN HD21 1 102 GLY H . . 5.500 4.451 4.275 4.928 . 0 0 "[ . 1 . 2]" 1
908 1 49 ASN HD22 1 54 THR HA . . 4.910 4.086 3.420 4.513 . 0 0 "[ . 1 . 2]" 1
909 1 49 ASN HD22 1 55 GLN HE21 . . 5.500 4.202 3.459 6.170 0.670 3 1 "[ + . 1 . 2]" 1
910 1 49 ASN HD22 1 99 ILE MD . . 5.210 2.134 1.933 2.564 . 0 0 "[ . 1 . 2]" 1
911 1 49 ASN HD22 1 101 PRO HA . . 5.500 3.574 3.167 3.799 . 0 0 "[ . 1 . 2]" 1
912 1 49 ASN HD22 1 101 PRO HB2 . . 4.990 4.157 3.869 4.299 . 0 0 "[ . 1 . 2]" 1
913 1 50 THR H 1 50 THR MG . . 3.710 2.239 1.931 2.516 . 0 0 "[ . 1 . 2]" 1
914 1 50 THR H 1 51 THR H . . 3.470 2.597 2.370 2.760 . 0 0 "[ . 1 . 2]" 1
915 1 50 THR H 1 51 THR MG . . 4.720 3.696 3.289 4.809 0.089 3 0 "[ . 1 . 2]" 1
916 1 50 THR H 1 60 MET ME . . 3.590 3.510 3.122 3.659 0.069 11 0 "[ . 1 . 2]" 1
917 1 50 THR HA 1 50 THR MG . . 2.940 2.785 2.196 3.200 0.260 12 0 "[ . 1 . 2]" 1
918 1 50 THR HA 1 51 THR H . . 3.540 3.404 3.339 3.451 . 0 0 "[ . 1 . 2]" 1
919 1 50 THR HA 1 102 GLY H . . 3.910 4.024 3.948 4.080 0.170 17 0 "[ . 1 . 2]" 1
920 1 50 THR MG 1 51 THR H . . 4.940 3.163 2.113 4.226 . 0 0 "[ . 1 . 2]" 1
921 1 51 THR H 1 51 THR MG . . 3.170 2.030 1.887 3.171 0.001 3 0 "[ . 1 . 2]" 1
922 1 51 THR H 1 52 GLU H . . 5.450 4.481 4.430 4.518 . 0 0 "[ . 1 . 2]" 1
923 1 51 THR H 1 60 MET ME . . 5.370 3.743 3.376 4.115 . 0 0 "[ . 1 . 2]" 1
924 1 51 THR H 1 101 PRO HA . . 5.500 4.409 4.198 4.591 . 0 0 "[ . 1 . 2]" 1
925 1 51 THR H 1 102 GLY H . . 5.500 5.459 5.243 5.580 0.080 3 0 "[ . 1 . 2]" 1
926 1 51 THR HA 1 51 THR MG . . 3.090 2.420 2.021 2.497 . 0 0 "[ . 1 . 2]" 1
927 1 51 THR HA 1 52 GLU H . . 3.140 2.736 2.693 2.777 . 0 0 "[ . 1 . 2]" 1
928 1 51 THR HA 1 52 GLU HG2 . . 4.530 4.319 3.902 4.526 . 0 0 "[ . 1 . 2]" 1
929 1 51 THR HB 1 52 GLU H . . 3.020 1.948 1.879 2.005 . 0 0 "[ . 1 . 2]" 1
930 1 51 THR HB 1 52 GLU QB . . 4.590 4.398 4.331 4.574 . 0 0 "[ . 1 . 2]" 1
931 1 51 THR HB 1 53 LYS H . . 3.720 3.083 2.079 3.492 . 0 0 "[ . 1 . 2]" 1
932 1 51 THR HB 1 55 GLN HE21 . . 5.190 4.662 4.402 4.937 . 0 0 "[ . 1 . 2]" 1
933 1 51 THR HB 1 55 GLN HE22 . . 5.310 4.347 3.402 4.581 . 0 0 "[ . 1 . 2]" 1
934 1 51 THR MG 1 52 GLU H . . 4.140 3.523 2.599 3.663 . 0 0 "[ . 1 . 2]" 1
935 1 51 THR MG 1 53 LYS QG . . 4.380 4.208 3.692 4.434 0.054 17 0 "[ . 1 . 2]" 1
936 1 51 THR MG 1 55 GLN HE21 . . 3.790 4.070 3.861 4.336 0.546 13 1 "[ . 1 + . 2]" 1
937 1 51 THR MG 1 55 GLN HE22 . . 4.020 3.823 2.718 4.131 0.111 5 0 "[ . 1 . 2]" 1
938 1 51 THR MG 1 60 MET ME . . 3.860 2.964 2.420 3.889 0.029 3 0 "[ . 1 . 2]" 1
939 1 52 GLU H 1 52 GLU QB . . 3.530 2.675 2.538 2.968 . 0 0 "[ . 1 . 2]" 1
940 1 52 GLU H 1 52 GLU HG2 . . 4.890 3.517 2.244 3.880 . 0 0 "[ . 1 . 2]" 1
941 1 52 GLU H 1 52 GLU HG3 . . 3.580 3.412 3.132 3.695 0.115 13 0 "[ . 1 . 2]" 1
942 1 52 GLU H 1 53 LYS H . . 3.410 2.412 2.180 2.654 . 0 0 "[ . 1 . 2]" 1
943 1 52 GLU H 1 53 LYS QG . . 3.550 3.062 2.640 3.641 0.091 3 0 "[ . 1 . 2]" 1
944 1 52 GLU H 1 55 GLN HE21 . . 5.500 5.567 5.307 5.667 0.167 3 0 "[ . 1 . 2]" 1
945 1 52 GLU H 1 55 GLN HE22 . . 5.500 5.379 4.519 5.647 0.147 18 0 "[ . 1 . 2]" 1
946 1 52 GLU HA 1 52 GLU HG2 . . 3.340 2.551 2.271 3.657 0.317 16 0 "[ . 1 . 2]" 1
947 1 52 GLU HA 1 101 PRO HB2 . . 3.970 2.190 1.972 3.423 . 0 0 "[ . 1 . 2]" 1
948 1 52 GLU HA 1 101 PRO HB3 . . 4.040 3.027 2.801 3.951 . 0 0 "[ . 1 . 2]" 1
949 1 52 GLU QB 1 53 LYS H . . 5.040 3.821 3.687 4.039 . 0 0 "[ . 1 . 2]" 1
950 1 53 LYS H 1 53 LYS HB2 . . 3.540 2.671 2.498 2.937 . 0 0 "[ . 1 . 2]" 1
951 1 53 LYS H 1 53 LYS HB3 . . 3.840 3.776 3.691 3.848 0.008 2 0 "[ . 1 . 2]" 1
952 1 53 LYS H 1 53 LYS QG . . 3.550 2.901 2.615 3.402 . 0 0 "[ . 1 . 2]" 1
953 1 53 LYS H 1 55 GLN HE21 . . 4.590 4.361 4.104 5.263 0.673 3 1 "[ + . 1 . 2]" 1
954 1 53 LYS H 1 55 GLN HE22 . . 5.140 4.740 4.193 5.036 . 0 0 "[ . 1 . 2]" 1
955 1 53 LYS H 1 101 PRO HB2 . . 4.930 3.521 3.040 3.869 . 0 0 "[ . 1 . 2]" 1
956 1 53 LYS H 1 101 PRO HB3 . . 4.070 2.644 2.347 3.015 . 0 0 "[ . 1 . 2]" 1
957 1 53 LYS H 1 101 PRO QD . . 5.500 4.671 4.420 5.105 . 0 0 "[ . 1 . 2]" 1
958 1 53 LYS H 1 101 PRO HG3 . . 5.320 3.548 3.031 4.007 . 0 0 "[ . 1 . 2]" 1
959 1 53 LYS HA 1 53 LYS QG . . 3.400 2.494 2.249 3.069 . 0 0 "[ . 1 . 2]" 1
960 1 53 LYS HA 1 54 THR H . . 2.810 2.355 2.225 2.491 . 0 0 "[ . 1 . 2]" 1
961 1 53 LYS HA 1 55 GLN HE21 . . 5.500 5.125 4.680 5.508 0.008 3 0 "[ . 1 . 2]" 1
962 1 53 LYS HB2 1 53 LYS QG . . 2.720 2.170 2.136 2.263 . 0 0 "[ . 1 . 2]" 1
963 1 53 LYS HB2 1 54 THR H . . 3.620 3.658 3.575 3.755 0.135 9 0 "[ . 1 . 2]" 1
964 1 53 LYS HB2 1 55 GLN HE21 . . 4.040 2.238 1.896 2.743 . 0 0 "[ . 1 . 2]" 1
965 1 53 LYS HB2 1 55 GLN HE22 . . 4.090 2.611 2.325 2.816 . 0 0 "[ . 1 . 2]" 1
966 1 53 LYS HB2 1 55 GLN HG3 . . 5.500 3.853 2.758 4.994 . 0 0 "[ . 1 . 2]" 1
967 1 53 LYS HB3 1 54 THR H . . 3.470 2.568 2.237 3.015 . 0 0 "[ . 1 . 2]" 1
968 1 53 LYS HB3 1 55 GLN HE21 . . 4.310 3.313 2.593 3.855 . 0 0 "[ . 1 . 2]" 1
969 1 53 LYS HB3 1 55 GLN HE22 . . 4.800 3.602 3.293 4.096 . 0 0 "[ . 1 . 2]" 1
970 1 53 LYS QG 1 55 GLN HE21 . . 4.320 3.560 3.049 3.919 . 0 0 "[ . 1 . 2]" 1
971 1 53 LYS QG 1 55 GLN HE22 . . 5.300 3.055 2.434 4.271 . 0 0 "[ . 1 . 2]" 1
972 1 54 THR H 1 54 THR MG . . 4.180 3.867 3.816 3.921 . 0 0 "[ . 1 . 2]" 1
973 1 54 THR H 1 55 GLN H . . 4.870 2.530 2.338 2.664 . 0 0 "[ . 1 . 2]" 1
974 1 54 THR H 1 101 PRO QD . . 4.690 4.910 4.838 4.989 0.299 3 0 "[ . 1 . 2]" 1
975 1 54 THR H 1 101 PRO HG3 . . 5.270 4.011 3.825 4.224 . 0 0 "[ . 1 . 2]" 1
976 1 54 THR HA 1 54 THR MG . . 3.230 2.163 2.084 2.215 . 0 0 "[ . 1 . 2]" 1
977 1 54 THR HA 1 55 GLN H . . 2.980 3.029 2.955 3.062 0.082 6 0 "[ . 1 . 2]" 1
978 1 54 THR HA 1 99 ILE H . . 5.050 3.262 3.132 3.412 . 0 0 "[ . 1 . 2]" 1
979 1 54 THR HA 1 101 PRO QD . . 4.270 2.746 2.621 2.913 . 0 0 "[ . 1 . 2]" 1
980 1 54 THR HA 1 101 PRO HG2 . . 4.870 4.503 4.295 4.664 . 0 0 "[ . 1 . 2]" 1
981 1 54 THR MG 1 98 GLU H . . 4.790 4.850 4.772 4.908 0.118 20 0 "[ . 1 . 2]" 1
982 1 54 THR MG 1 98 GLU HB3 . . 2.860 1.968 1.875 2.124 . 0 0 "[ . 1 . 2]" 1
983 1 54 THR MG 1 98 GLU HG2 . . 4.150 2.994 2.877 3.146 . 0 0 "[ . 1 . 2]" 1
984 1 54 THR MG 1 98 GLU HG3 . . 3.910 3.929 3.867 4.012 0.102 3 0 "[ . 1 . 2]" 1
985 1 54 THR MG 1 99 ILE H . . 3.550 3.148 2.791 3.570 0.020 10 0 "[ . 1 . 2]" 1
986 1 54 THR MG 1 100 ASN H . . 5.500 5.324 4.827 5.523 0.023 15 0 "[ . 1 . 2]" 1
987 1 54 THR MG 1 100 ASN HA . . 4.250 3.968 3.702 4.201 . 0 0 "[ . 1 . 2]" 1
988 1 54 THR MG 1 100 ASN HD21 . . 5.500 4.245 4.014 4.812 . 0 0 "[ . 1 . 2]" 1
989 1 54 THR MG 1 100 ASN HD22 . . 4.780 4.912 4.812 5.367 0.587 14 1 "[ . 1 +. 2]" 1
990 1 55 GLN H 1 55 GLN HB2 . . 4.150 3.225 2.648 3.592 . 0 0 "[ . 1 . 2]" 1
991 1 55 GLN H 1 55 GLN HG2 . . 4.220 2.768 2.020 3.469 . 0 0 "[ . 1 . 2]" 1
992 1 55 GLN H 1 55 GLN HG3 . . 4.170 2.893 1.723 3.904 . 0 0 "[ . 1 . 2]" 1
993 1 55 GLN H 1 56 ASN H . . 5.280 4.564 4.510 4.617 . 0 0 "[ . 1 . 2]" 1
994 1 55 GLN H 1 98 GLU HA . . 5.500 5.562 5.369 5.629 0.129 19 0 "[ . 1 . 2]" 1
995 1 55 GLN H 1 99 ILE MD . . 3.640 2.716 2.422 3.342 . 0 0 "[ . 1 . 2]" 1
996 1 55 GLN H 1 101 PRO QD . . 5.500 5.152 4.937 5.398 . 0 0 "[ . 1 . 2]" 1
997 1 55 GLN HA 1 56 ASN H . . 3.160 2.597 2.472 2.710 . 0 0 "[ . 1 . 2]" 1
998 1 55 GLN HA 1 98 GLU HG2 . . 3.980 3.633 3.326 3.886 . 0 0 "[ . 1 . 2]" 1
999 1 55 GLN HB2 1 56 ASN H . . 4.550 2.475 1.961 3.343 . 0 0 "[ . 1 . 2]" 1
1000 1 55 GLN HB2 1 99 ILE MD . . 4.660 4.055 2.314 4.882 0.222 6 0 "[ . 1 . 2]" 1
1001 1 55 GLN HB3 1 55 GLN HE22 . . 5.490 4.428 4.151 5.383 . 0 0 "[ . 1 . 2]" 1
1002 1 55 GLN HB3 1 56 ASN H . . 3.790 3.001 2.021 3.684 . 0 0 "[ . 1 . 2]" 1
1003 1 55 GLN HB3 1 99 ILE MD . . 5.370 4.466 3.601 5.059 . 0 0 "[ . 1 . 2]" 1
1004 1 55 GLN HG3 1 99 ILE MD . . 5.380 3.896 2.745 4.302 . 0 0 "[ . 1 . 2]" 1
1005 1 56 ASN H 1 56 ASN HB2 . . 3.440 2.236 2.108 2.312 . 0 0 "[ . 1 . 2]" 1
1006 1 56 ASN H 1 56 ASN HB3 . . 3.360 3.106 2.772 3.550 0.190 16 0 "[ . 1 . 2]" 1
1007 1 56 ASN H 1 56 ASN QD . . 5.360 3.962 3.722 4.231 . 0 0 "[ . 1 . 2]" 1
1008 1 56 ASN H 1 57 ILE H . . 5.500 4.617 4.549 4.649 . 0 0 "[ . 1 . 2]" 1
1009 1 56 ASN H 1 59 LEU H . . 5.390 5.258 5.043 5.387 . 0 0 "[ . 1 . 2]" 1
1010 1 56 ASN H 1 59 LEU HB2 . . 4.540 3.982 3.598 4.256 . 0 0 "[ . 1 . 2]" 1
1011 1 56 ASN H 1 59 LEU QD . . 4.910 3.469 1.998 4.450 . 0 0 "[ . 1 . 2]" 1
1012 1 56 ASN HA 1 56 ASN QD . . 4.270 2.370 1.935 2.906 . 0 0 "[ . 1 . 2]" 1
1013 1 56 ASN HA 1 57 ILE HA . . 5.030 4.363 4.340 4.401 . 0 0 "[ . 1 . 2]" 1
1014 1 56 ASN HA 1 57 ILE HG13 . . 4.270 3.425 3.366 3.491 . 0 0 "[ . 1 . 2]" 1
1015 1 56 ASN HA 1 58 GLN H . . 5.180 4.712 4.509 4.954 . 0 0 "[ . 1 . 2]" 1
1016 1 56 ASN HA 1 98 GLU HA . . 3.080 2.418 1.995 2.889 . 0 0 "[ . 1 . 2]" 1
1017 1 56 ASN HA 1 98 GLU HG2 . . 3.980 4.016 3.882 4.084 0.104 13 0 "[ . 1 . 2]" 1
1018 1 56 ASN HA 1 98 GLU HG3 . . 4.030 4.148 4.094 4.224 0.194 11 0 "[ . 1 . 2]" 1
1019 1 56 ASN HA 1 99 ILE H . . 5.000 4.416 3.965 4.803 . 0 0 "[ . 1 . 2]" 1
1020 1 56 ASN HB2 1 57 ILE H . . 5.150 3.809 3.529 4.078 . 0 0 "[ . 1 . 2]" 1
1021 1 56 ASN HB2 1 58 GLN H . . 5.500 5.063 4.631 5.461 . 0 0 "[ . 1 . 2]" 1
1022 1 56 ASN HB2 1 59 LEU H . . 4.860 4.140 3.325 4.583 . 0 0 "[ . 1 . 2]" 1
1023 1 56 ASN HB2 1 59 LEU HB2 . . 4.260 3.383 2.275 4.085 . 0 0 "[ . 1 . 2]" 1
1024 1 56 ASN HB2 1 59 LEU QD . . 4.290 2.728 1.977 3.572 . 0 0 "[ . 1 . 2]" 1
1025 1 56 ASN HB3 1 59 LEU H . . 4.600 2.749 2.445 2.896 . 0 0 "[ . 1 . 2]" 1
1026 1 56 ASN HB3 1 59 LEU HB2 . . 3.750 2.517 1.992 3.241 . 0 0 "[ . 1 . 2]" 1
1027 1 56 ASN HB3 1 59 LEU QD . . 4.410 2.742 2.128 3.527 . 0 0 "[ . 1 . 2]" 1
1028 1 56 ASN HB3 1 59 LEU HG . . 3.960 3.864 3.290 4.619 0.659 2 4 "[ + . - 1* * 2]" 1
1029 1 56 ASN QD 1 57 ILE H . . 4.910 2.944 1.871 3.504 . 0 0 "[ . 1 . 2]" 1
1030 1 56 ASN QD 1 58 GLN H . . 4.770 4.155 3.505 4.625 . 0 0 "[ . 1 . 2]" 1
1031 1 56 ASN QD 1 59 LEU H . . 5.500 4.943 4.241 5.105 . 0 0 "[ . 1 . 2]" 1
1032 1 56 ASN QD 1 59 LEU QD . . 5.500 4.464 4.057 4.942 . 0 0 "[ . 1 . 2]" 1
1033 1 56 ASN QD 1 96 ALA HA . . 3.580 2.433 1.980 3.165 . 0 0 "[ . 1 . 2]" 1
1034 1 56 ASN QD 1 96 ALA MB . . 5.040 3.700 3.417 4.244 . 0 0 "[ . 1 . 2]" 1
1035 1 56 ASN QD 1 97 ASP H . . 5.150 3.075 2.664 3.924 . 0 0 "[ . 1 . 2]" 1
1036 1 56 ASN QD 1 98 GLU HA . . 5.500 3.980 3.465 4.567 . 0 0 "[ . 1 . 2]" 1
1037 1 56 ASN QD 1 98 GLU HG2 . . 5.500 4.953 4.520 5.270 . 0 0 "[ . 1 . 2]" 1
1038 1 56 ASN QD 1 98 GLU HG3 . . 5.470 4.480 4.113 4.858 . 0 0 "[ . 1 . 2]" 1
1039 1 57 ILE H 1 57 ILE HB . . 3.510 2.712 2.533 2.846 . 0 0 "[ . 1 . 2]" 1
1040 1 57 ILE H 1 57 ILE MD . . 3.960 3.480 2.477 3.893 . 0 0 "[ . 1 . 2]" 1
1041 1 57 ILE H 1 57 ILE HG12 . . 3.890 3.450 3.085 3.907 0.017 16 0 "[ . 1 . 2]" 1
1042 1 57 ILE H 1 57 ILE HG13 . . 4.540 2.253 2.053 2.470 . 0 0 "[ . 1 . 2]" 1
1043 1 57 ILE H 1 57 ILE MG . . 4.090 3.830 3.796 3.867 . 0 0 "[ . 1 . 2]" 1
1044 1 57 ILE H 1 58 GLN H . . 4.050 2.352 2.183 2.529 . 0 0 "[ . 1 . 2]" 1
1045 1 57 ILE H 1 97 ASP H . . 5.500 3.840 3.257 4.301 . 0 0 "[ . 1 . 2]" 1
1046 1 57 ILE H 1 98 GLU HA . . 4.210 3.863 3.676 4.053 . 0 0 "[ . 1 . 2]" 1
1047 1 57 ILE H 1 99 ILE H . . 5.500 5.345 4.844 5.536 0.036 8 0 "[ . 1 . 2]" 1
1048 1 57 ILE HA 1 57 ILE MD . . 3.970 3.875 3.839 3.904 . 0 0 "[ . 1 . 2]" 1
1049 1 57 ILE HA 1 57 ILE HG12 . . 3.890 2.809 2.636 3.344 . 0 0 "[ . 1 . 2]" 1
1050 1 57 ILE HA 1 57 ILE HG13 . . 4.040 3.105 2.595 3.412 . 0 0 "[ . 1 . 2]" 1
1051 1 57 ILE HA 1 57 ILE MG . . 3.430 2.173 2.082 2.360 . 0 0 "[ . 1 . 2]" 1
1052 1 57 ILE HA 1 60 MET H . . 4.660 3.844 3.598 4.477 . 0 0 "[ . 1 . 2]" 1
1053 1 57 ILE HB 1 57 ILE MD . . 3.220 2.332 2.101 2.437 . 0 0 "[ . 1 . 2]" 1
1054 1 57 ILE HB 1 58 GLN HA . . 4.680 3.977 3.891 4.161 . 0 0 "[ . 1 . 2]" 1
1055 1 57 ILE HB 1 95 LEU HA . . 4.110 2.763 2.555 2.913 . 0 0 "[ . 1 . 2]" 1
1056 1 57 ILE HB 1 97 ASP H . . 4.540 4.274 3.594 4.569 0.029 11 0 "[ . 1 . 2]" 1
1057 1 57 ILE MD 1 94 ARG H . . 4.970 4.505 4.225 4.988 0.018 14 0 "[ . 1 . 2]" 1
1058 1 57 ILE MD 1 94 ARG HA . . 4.130 2.424 1.922 3.389 . 0 0 "[ . 1 . 2]" 1
1059 1 57 ILE MD 1 94 ARG QB . . 3.600 2.134 1.854 2.623 . 0 0 "[ . 1 . 2]" 1
1060 1 57 ILE MD 1 94 ARG HD2 . . 3.850 3.657 2.892 4.423 0.573 13 2 "[ . 1 + . -]" 1
1061 1 57 ILE MD 1 94 ARG HD3 . . 5.120 3.223 2.170 4.642 . 0 0 "[ . 1 . 2]" 1
1062 1 57 ILE MD 1 94 ARG HE . . 5.170 4.138 2.463 5.181 0.011 13 0 "[ . 1 . 2]" 1
1063 1 57 ILE MD 1 94 ARG HG3 . . 5.360 4.142 3.633 4.737 . 0 0 "[ . 1 . 2]" 1
1064 1 57 ILE MD 1 95 LEU HA . . 4.610 3.602 2.925 3.949 . 0 0 "[ . 1 . 2]" 1
1065 1 57 ILE MD 1 97 ASP H . . 3.950 3.031 2.064 3.544 . 0 0 "[ . 1 . 2]" 1
1066 1 57 ILE MD 1 97 ASP HB2 . . 3.360 3.238 2.408 3.401 0.041 17 0 "[ . 1 . 2]" 1
1067 1 57 ILE MD 1 97 ASP HB3 . . 4.100 2.532 1.951 2.928 . 0 0 "[ . 1 . 2]" 1
1068 1 57 ILE MD 1 98 GLU H . . 4.510 3.679 2.903 4.004 . 0 0 "[ . 1 . 2]" 1
1069 1 57 ILE MD 1 98 GLU HA . . 4.080 3.913 3.325 4.145 0.065 11 0 "[ . 1 . 2]" 1
1070 1 57 ILE HG12 1 57 ILE MG . . 3.590 2.278 1.972 2.413 . 0 0 "[ . 1 . 2]" 1
1071 1 57 ILE HG12 1 98 GLU HA . . 5.500 3.762 3.418 5.095 . 0 0 "[ . 1 . 2]" 1
1072 1 57 ILE HG12 1 99 ILE H . . 5.410 3.740 3.380 5.003 . 0 0 "[ . 1 . 2]" 1
1073 1 57 ILE MG 1 58 GLN H . . 3.950 3.548 3.169 3.863 . 0 0 "[ . 1 . 2]" 1
1074 1 57 ILE MG 1 61 ILE MD . . 4.690 3.626 2.838 4.376 . 0 0 "[ . 1 . 2]" 1
1075 1 57 ILE MG 1 61 ILE HG12 . . 3.820 3.072 2.735 3.870 0.050 16 0 "[ . 1 . 2]" 1
1076 1 58 GLN H 1 58 GLN QB . . 3.240 2.166 2.050 2.244 . 0 0 "[ . 1 . 2]" 1
1077 1 58 GLN H 1 58 GLN HE21 . . 5.500 4.749 3.409 5.511 0.011 19 0 "[ . 1 . 2]" 1
1078 1 58 GLN H 1 58 GLN HG2 . . 5.190 4.117 3.141 4.422 . 0 0 "[ . 1 . 2]" 1
1079 1 58 GLN H 1 59 LEU H . . 3.880 2.747 2.622 2.801 . 0 0 "[ . 1 . 2]" 1
1080 1 58 GLN H 1 95 LEU HA . . 4.250 2.775 2.590 3.170 . 0 0 "[ . 1 . 2]" 1
1081 1 58 GLN H 1 95 LEU HB3 . . 4.260 4.184 3.775 4.312 0.052 16 0 "[ . 1 . 2]" 1
1082 1 58 GLN H 1 95 LEU MD2 . . 4.360 3.846 3.344 4.482 0.122 14 0 "[ . 1 . 2]" 1
1083 1 58 GLN H 1 96 ALA HA . . 5.500 5.113 4.457 5.480 . 0 0 "[ . 1 . 2]" 1
1084 1 58 GLN HA 1 58 GLN HE21 . . 5.500 4.104 2.735 5.239 . 0 0 "[ . 1 . 2]" 1
1085 1 58 GLN HA 1 58 GLN HG2 . . 4.040 3.273 2.416 3.735 . 0 0 "[ . 1 . 2]" 1
1086 1 58 GLN HA 1 58 GLN HG3 . . 3.830 2.847 2.555 3.625 . 0 0 "[ . 1 . 2]" 1
1087 1 58 GLN HA 1 61 ILE HB . . 3.860 2.417 1.997 2.723 . 0 0 "[ . 1 . 2]" 1
1088 1 58 GLN HA 1 61 ILE MD . . 5.110 4.667 4.307 5.023 . 0 0 "[ . 1 . 2]" 1
1089 1 58 GLN HA 1 61 ILE HG12 . . 4.700 3.354 2.837 3.853 . 0 0 "[ . 1 . 2]" 1
1090 1 58 GLN HA 1 61 ILE HG13 . . 4.050 3.648 3.011 4.079 0.029 11 0 "[ . 1 . 2]" 1
1091 1 58 GLN HA 1 61 ILE MG . . 4.090 3.944 3.616 4.212 0.122 10 0 "[ . 1 . 2]" 1
1092 1 58 GLN HA 1 95 LEU MD2 . . 3.600 3.359 2.869 4.155 0.555 14 2 "[ . 1 +.- 2]" 1
1093 1 58 GLN HA 1 109 TYR QD . . 5.500 3.993 3.385 5.221 . 0 0 "[ . 1 . 2]" 1
1094 1 58 GLN HA 1 109 TYR QE . . 4.070 2.756 2.074 4.338 0.268 16 0 "[ . 1 . 2]" 1
1095 1 58 GLN QB 1 59 LEU H . . 3.710 3.061 2.838 3.505 . 0 0 "[ . 1 . 2]" 1
1096 1 58 GLN QB 1 95 LEU HA . . 3.680 2.750 2.399 3.509 . 0 0 "[ . 1 . 2]" 1
1097 1 58 GLN QB 1 95 LEU HB3 . . 3.740 2.501 2.271 3.017 . 0 0 "[ . 1 . 2]" 1
1098 1 58 GLN QB 1 96 ALA HA . . 5.040 4.595 3.865 4.928 . 0 0 "[ . 1 . 2]" 1
1099 1 58 GLN HE21 1 109 TYR QE . . 5.360 3.481 2.299 5.148 . 0 0 "[ . 1 . 2]" 1
1100 1 58 GLN HE22 1 109 TYR QE . . 5.240 4.440 3.851 5.277 0.037 10 0 "[ . 1 . 2]" 1
1101 1 58 GLN HG2 1 109 TYR QE . . 4.580 3.692 2.033 4.585 0.005 5 0 "[ . 1 . 2]" 1
1102 1 58 GLN HG3 1 95 LEU MD2 . . 4.560 3.814 1.971 4.613 0.053 10 0 "[ . 1 . 2]" 1
1103 1 58 GLN HG3 1 109 TYR QE . . 3.240 2.456 1.998 3.447 0.207 10 0 "[ . 1 . 2]" 1
1104 1 59 LEU H 1 59 LEU HB2 . . 3.330 2.048 2.044 2.057 . 0 0 "[ . 1 . 2]" 1
1105 1 59 LEU H 1 59 LEU HB3 . . 3.300 3.267 3.180 3.331 0.031 10 0 "[ . 1 . 2]" 1
1106 1 59 LEU H 1 59 LEU QD . . 4.310 3.132 2.520 3.635 . 0 0 "[ . 1 . 2]" 1
1107 1 59 LEU HA 1 59 LEU QD . . 3.280 2.163 1.890 2.549 . 0 0 "[ . 1 . 2]" 1
1108 1 59 LEU HA 1 59 LEU HG . . 4.110 3.092 2.339 3.643 . 0 0 "[ . 1 . 2]" 1
1109 1 59 LEU HA 1 62 GLN QB . . 3.430 3.310 2.782 3.503 0.073 14 0 "[ . 1 . 2]" 1
1110 1 59 LEU HA 1 62 GLN HE21 . . 4.810 2.965 2.235 3.816 . 0 0 "[ . 1 . 2]" 1
1111 1 59 LEU HA 1 62 GLN HE22 . . 5.500 4.208 3.238 5.073 . 0 0 "[ . 1 . 2]" 1
1112 1 59 LEU HB2 1 60 MET H . . 4.020 3.472 3.296 3.619 . 0 0 "[ . 1 . 2]" 1
1113 1 59 LEU HB3 1 60 MET H . . 3.520 3.329 3.110 3.543 0.023 11 0 "[ . 1 . 2]" 1
1114 1 59 LEU QD 1 60 MET HA . . 4.630 4.324 4.078 4.482 . 0 0 "[ . 1 . 2]" 1
1115 1 59 LEU QD 1 62 GLN HE21 . . 4.960 3.684 2.876 4.432 . 0 0 "[ . 1 . 2]" 1
1116 1 59 LEU QD 1 62 GLN HE22 . . 5.070 4.101 2.843 4.965 . 0 0 "[ . 1 . 2]" 1
1117 1 60 MET H 1 60 MET QB . . 3.570 2.533 2.189 2.735 . 0 0 "[ . 1 . 2]" 1
1118 1 60 MET H 1 60 MET HG2 . . 4.120 3.213 2.536 4.167 0.047 8 0 "[ . 1 . 2]" 1
1119 1 60 MET H 1 60 MET HG3 . . 3.920 2.858 2.147 3.884 . 0 0 "[ . 1 . 2]" 1
1120 1 60 MET HA 1 60 MET ME . . 4.030 4.041 3.900 4.198 0.168 16 0 "[ . 1 . 2]" 1
1121 1 60 MET HA 1 60 MET HG3 . . 4.240 3.436 2.666 3.775 . 0 0 "[ . 1 . 2]" 1
1122 1 60 MET HA 1 63 SER H . . 4.940 3.529 3.309 3.726 . 0 0 "[ . 1 . 2]" 1
1123 1 60 MET HA 1 63 SER HB2 . . 4.200 3.371 2.408 4.219 0.019 15 0 "[ . 1 . 2]" 1
1124 1 60 MET HA 1 63 SER HB3 . . 4.210 3.710 2.794 4.266 0.056 15 0 "[ . 1 . 2]" 1
1125 1 60 MET QB 1 60 MET ME . . 2.400 1.952 1.878 2.010 . 0 0 "[ . 1 . 2]" 1
1126 1 60 MET QB 1 61 ILE H . . 4.080 2.403 2.214 2.830 . 0 0 "[ . 1 . 2]" 1
1127 1 60 MET QB 1 64 PHE QD . . 4.960 2.850 2.392 3.439 . 0 0 "[ . 1 . 2]" 1
1128 1 60 MET ME 1 60 MET HG3 . . 3.930 2.863 2.502 3.401 . 0 0 "[ . 1 . 2]" 1
1129 1 60 MET ME 1 64 PHE QD . . 3.530 3.554 3.285 3.649 0.119 15 0 "[ . 1 . 2]" 1
1130 1 60 MET ME 1 64 PHE QE . . 3.410 1.902 1.871 1.962 . 0 0 "[ . 1 . 2]" 1
1131 1 61 ILE H 1 61 ILE HB . . 3.000 2.540 2.401 2.666 . 0 0 "[ . 1 . 2]" 1
1132 1 61 ILE H 1 61 ILE MD . . 4.040 3.193 2.845 3.750 . 0 0 "[ . 1 . 2]" 1
1133 1 61 ILE H 1 61 ILE HG12 . . 3.600 2.114 1.930 2.384 . 0 0 "[ . 1 . 2]" 1
1134 1 61 ILE H 1 61 ILE HG13 . . 3.840 3.576 3.411 3.633 . 0 0 "[ . 1 . 2]" 1
1135 1 61 ILE H 1 64 PHE QD . . 5.050 3.864 3.395 4.481 . 0 0 "[ . 1 . 2]" 1
1136 1 61 ILE H 1 64 PHE QE . . 5.230 4.964 4.502 5.250 0.020 13 0 "[ . 1 . 2]" 1
1137 1 61 ILE HA 1 61 ILE MD . . 3.280 2.001 1.941 2.199 . 0 0 "[ . 1 . 2]" 1
1138 1 61 ILE HA 1 61 ILE HG13 . . 4.160 3.699 3.672 3.742 . 0 0 "[ . 1 . 2]" 1
1139 1 61 ILE HA 1 61 ILE MG . . 3.310 2.347 2.241 2.444 . 0 0 "[ . 1 . 2]" 1
1140 1 61 ILE HA 1 64 PHE HB2 . . 4.580 2.345 1.975 2.817 . 0 0 "[ . 1 . 2]" 1
1141 1 61 ILE HA 1 65 MET H . . 4.870 3.389 3.042 3.871 . 0 0 "[ . 1 . 2]" 1
1142 1 61 ILE HB 1 62 GLN H . . 3.810 2.764 2.413 3.050 . 0 0 "[ . 1 . 2]" 1
1143 1 61 ILE HB 1 62 GLN HG3 . . 4.760 3.903 3.524 4.327 . 0 0 "[ . 1 . 2]" 1
1144 1 61 ILE HB 1 95 LEU MD2 . . 4.520 4.035 3.561 4.544 0.024 14 0 "[ . 1 . 2]" 1
1145 1 61 ILE HB 1 109 TYR QD . . 5.280 3.014 2.184 4.038 . 0 0 "[ . 1 . 2]" 1
1146 1 61 ILE HB 1 109 TYR QE . . 4.470 2.579 2.107 3.370 . 0 0 "[ . 1 . 2]" 1
1147 1 61 ILE MD 1 61 ILE MG . . 3.410 2.066 1.882 2.151 . 0 0 "[ . 1 . 2]" 1
1148 1 61 ILE MD 1 62 GLN H . . 5.500 4.659 4.541 4.864 . 0 0 "[ . 1 . 2]" 1
1149 1 61 ILE MD 1 95 LEU MD2 . . 4.660 4.655 4.169 4.930 0.270 16 0 "[ . 1 . 2]" 1
1150 1 61 ILE MD 1 109 TYR QD . . 4.450 3.845 3.400 4.110 . 0 0 "[ . 1 . 2]" 1
1151 1 61 ILE MD 1 109 TYR QE . . 5.230 4.892 4.386 5.246 0.016 18 0 "[ . 1 . 2]" 1
1152 1 61 ILE HG12 1 62 GLN H . . 5.500 4.319 4.075 4.525 . 0 0 "[ . 1 . 2]" 1
1153 1 61 ILE HG13 1 109 TYR QD . . 4.950 2.797 2.178 4.107 . 0 0 "[ . 1 . 2]" 1
1154 1 61 ILE MG 1 62 GLN H . . 4.650 3.515 3.189 3.786 . 0 0 "[ . 1 . 2]" 1
1155 1 61 ILE MG 1 62 GLN HA . . 4.390 3.527 3.309 3.725 . 0 0 "[ . 1 . 2]" 1
1156 1 61 ILE MG 1 62 GLN HG2 . . 4.680 4.418 4.027 4.683 0.003 15 0 "[ . 1 . 2]" 1
1157 1 61 ILE MG 1 62 GLN HG3 . . 4.110 4.102 3.694 4.683 0.573 10 1 "[ . + . 2]" 1
1158 1 61 ILE MG 1 63 SER H . . 5.500 4.547 4.379 4.900 . 0 0 "[ . 1 . 2]" 1
1159 1 61 ILE MG 1 64 PHE H . . 5.500 4.118 3.866 4.473 . 0 0 "[ . 1 . 2]" 1
1160 1 61 ILE MG 1 65 MET H . . 4.630 3.164 2.790 3.752 . 0 0 "[ . 1 . 2]" 1
1161 1 61 ILE MG 1 65 MET HB3 . . 5.260 3.794 2.779 5.106 . 0 0 "[ . 1 . 2]" 1
1162 1 61 ILE MG 1 65 MET ME . . 3.140 3.008 2.342 3.234 0.094 11 0 "[ . 1 . 2]" 1
1163 1 61 ILE MG 1 95 LEU MD2 . . 4.990 3.850 3.335 4.020 . 0 0 "[ . 1 . 2]" 1
1164 1 61 ILE MG 1 109 TYR HA . . 5.500 5.120 4.777 5.594 0.094 16 0 "[ . 1 . 2]" 1
1165 1 61 ILE MG 1 109 TYR HB2 . . 5.370 3.217 2.719 3.797 . 0 0 "[ . 1 . 2]" 1
1166 1 61 ILE MG 1 109 TYR HB3 . . 5.240 3.513 2.935 4.445 . 0 0 "[ . 1 . 2]" 1
1167 1 61 ILE MG 1 109 TYR QD . . 3.400 2.179 1.895 2.786 . 0 0 "[ . 1 . 2]" 1
1168 1 61 ILE MG 1 109 TYR QE . . 3.900 2.750 1.964 3.327 . 0 0 "[ . 1 . 2]" 1
1169 1 62 GLN H 1 62 GLN QB . . 3.310 2.212 2.114 2.307 . 0 0 "[ . 1 . 2]" 1
1170 1 62 GLN H 1 62 GLN HE21 . . 5.180 3.956 3.504 4.600 . 0 0 "[ . 1 . 2]" 1
1171 1 62 GLN H 1 62 GLN HG2 . . 3.800 3.801 3.343 3.924 0.124 20 0 "[ . 1 . 2]" 1
1172 1 62 GLN H 1 62 GLN HG3 . . 3.640 2.857 2.619 3.100 . 0 0 "[ . 1 . 2]" 1
1173 1 62 GLN H 1 63 SER H . . 3.500 2.580 2.403 2.721 . 0 0 "[ . 1 . 2]" 1
1174 1 62 GLN H 1 64 PHE QD . . 5.500 5.205 4.762 5.523 0.023 16 0 "[ . 1 . 2]" 1
1175 1 62 GLN H 1 109 TYR QE . . 5.500 4.020 3.415 4.617 . 0 0 "[ . 1 . 2]" 1
1176 1 62 GLN HA 1 62 GLN HG2 . . 3.610 2.324 2.184 2.488 . 0 0 "[ . 1 . 2]" 1
1177 1 62 GLN HA 1 62 GLN HG3 . . 3.850 2.958 2.803 3.352 . 0 0 "[ . 1 . 2]" 1
1178 1 62 GLN HA 1 65 MET H . . 4.890 4.623 3.802 4.910 0.020 14 0 "[ . 1 . 2]" 1
1179 1 62 GLN QB 1 62 GLN HE21 . . 3.590 2.152 1.919 2.913 . 0 0 "[ . 1 . 2]" 1
1180 1 62 GLN QB 1 62 GLN HE22 . . 4.350 3.345 3.260 3.683 . 0 0 "[ . 1 . 2]" 1
1181 1 62 GLN QB 1 63 SER H . . 4.000 3.148 2.775 3.415 . 0 0 "[ . 1 . 2]" 1
1182 1 62 GLN QB 1 63 SER HA . . 4.650 4.106 3.961 4.230 . 0 0 "[ . 1 . 2]" 1
1183 1 62 GLN QB 1 64 PHE H . . 5.140 4.685 4.404 4.930 . 0 0 "[ . 1 . 2]" 1
1184 1 62 GLN HE21 1 109 TYR QE . . 5.500 5.234 4.551 5.519 0.019 6 0 "[ . 1 . 2]" 1
1185 1 62 GLN HG2 1 109 TYR QE . . 5.030 3.983 3.192 4.857 . 0 0 "[ . 1 . 2]" 1
1186 1 62 GLN HG3 1 63 SER H . . 5.500 4.915 4.737 5.121 . 0 0 "[ . 1 . 2]" 1
1187 1 62 GLN HG3 1 109 TYR QE . . 3.700 3.151 2.125 3.737 0.037 20 0 "[ . 1 . 2]" 1
1188 1 63 SER H 1 63 SER HB2 . . 3.600 2.644 2.242 3.559 . 0 0 "[ . 1 . 2]" 1
1189 1 63 SER H 1 63 SER HB3 . . 4.040 3.098 2.463 3.680 . 0 0 "[ . 1 . 2]" 1
1190 1 63 SER H 1 64 PHE QD . . 5.500 4.402 3.794 4.647 . 0 0 "[ . 1 . 2]" 1
1191 1 63 SER H 1 65 MET H . . 5.060 4.401 3.563 4.876 . 0 0 "[ . 1 . 2]" 1
1192 1 64 PHE H 1 64 PHE HB2 . . 3.590 2.356 2.229 2.528 . 0 0 "[ . 1 . 2]" 1
1193 1 64 PHE H 1 64 PHE QD . . 4.620 3.588 3.390 3.744 . 0 0 "[ . 1 . 2]" 1
1194 1 64 PHE H 1 65 MET H . . 3.270 2.602 1.961 2.851 . 0 0 "[ . 1 . 2]" 1
1195 1 64 PHE HA 1 64 PHE QD . . 4.400 2.069 1.967 2.495 . 0 0 "[ . 1 . 2]" 1
1196 1 64 PHE HB2 1 65 MET H . . 4.000 2.295 1.983 2.806 . 0 0 "[ . 1 . 2]" 1
1197 1 64 PHE HB2 1 65 MET HB2 . . 5.030 4.942 3.636 5.864 0.834 17 9 "[ * *.* *1* * - +* 2]" 1
1198 1 64 PHE HB3 1 65 MET H . . 4.390 2.807 2.440 3.703 . 0 0 "[ . 1 . 2]" 1
1199 1 64 PHE HB3 1 125 ARG H . . 5.500 5.216 4.394 5.558 0.058 4 0 "[ . 1 . 2]" 1
1200 1 64 PHE QD 1 65 MET H . . 5.020 4.197 3.984 4.512 . 0 0 "[ . 1 . 2]" 1
1201 1 64 PHE QD 1 125 ARG H . . 5.500 5.165 4.204 5.543 0.043 19 0 "[ . 1 . 2]" 1
1202 1 65 MET H 1 65 MET HB2 . . 3.900 3.213 2.148 3.673 . 0 0 "[ . 1 . 2]" 1
1203 1 65 MET H 1 65 MET HB3 . . 3.550 2.958 2.393 3.404 . 0 0 "[ . 1 . 2]" 1
1204 1 65 MET H 1 65 MET ME . . 4.890 4.412 3.721 4.735 . 0 0 "[ . 1 . 2]" 1
1205 1 65 MET H 1 66 GLU H . . 5.320 4.474 4.185 4.614 . 0 0 "[ . 1 . 2]" 1
1206 1 65 MET HA 1 65 MET ME . . 5.400 4.471 3.917 4.796 . 0 0 "[ . 1 . 2]" 1
1207 1 65 MET HA 1 66 GLU H . . 3.080 2.237 2.142 2.427 . 0 0 "[ . 1 . 2]" 1
1208 1 65 MET HA 1 67 VAL QG . . 5.500 5.139 4.753 5.557 0.057 17 0 "[ . 1 . 2]" 1
1209 1 65 MET HA 1 123 LYS H . . 5.500 5.401 4.513 5.547 0.047 15 0 "[ . 1 . 2]" 1
1210 1 65 MET HA 1 124 PHE HA . . 3.830 2.473 1.954 3.670 . 0 0 "[ . 1 . 2]" 1
1211 1 65 MET HA 1 124 PHE QE . . 4.910 4.348 3.527 4.922 0.012 1 0 "[ . 1 . 2]" 1
1212 1 65 MET HB2 1 66 GLU H . . 4.340 3.531 2.377 4.442 0.102 20 0 "[ . 1 . 2]" 1
1213 1 65 MET HB2 1 124 PHE QD . . 4.630 3.511 2.128 5.222 0.592 11 1 "[ . 1+ . 2]" 1
1214 1 65 MET HB2 1 124 PHE QE . . 4.730 3.497 2.345 4.891 0.161 11 0 "[ . 1 . 2]" 1
1215 1 65 MET HB3 1 124 PHE QD . . 5.200 3.422 2.000 5.223 0.023 16 0 "[ . 1 . 2]" 1
1216 1 65 MET ME 1 66 GLU H . . 5.260 4.568 3.616 5.170 . 0 0 "[ . 1 . 2]" 1
1217 1 65 MET ME 1 67 VAL QG . . 3.310 2.588 2.108 3.251 . 0 0 "[ . 1 . 2]" 1
1218 1 65 MET ME 1 109 TYR HB2 . . 5.500 4.228 2.748 5.163 . 0 0 "[ . 1 . 2]" 1
1219 1 65 MET ME 1 109 TYR HB3 . . 4.950 3.271 2.336 3.905 . 0 0 "[ . 1 . 2]" 1
1220 1 66 GLU H 1 66 GLU HB2 . . 3.660 3.105 2.308 3.771 0.111 1 0 "[ . 1 . 2]" 1
1221 1 66 GLU H 1 66 GLU HB3 . . 3.650 2.930 2.437 3.654 0.004 16 0 "[ . 1 . 2]" 1
1222 1 66 GLU H 1 66 GLU HG2 . . 4.180 4.170 2.130 5.013 0.833 16 7 "[ - . * 1 ** .+ **2]" 1
1223 1 66 GLU H 1 67 VAL H . . 5.030 4.168 3.624 4.534 . 0 0 "[ . 1 . 2]" 1
1224 1 66 GLU H 1 67 VAL QG . . 5.450 4.063 3.458 4.944 . 0 0 "[ . 1 . 2]" 1
1225 1 66 GLU H 1 123 LYS H . . 4.500 3.899 3.224 4.470 . 0 0 "[ . 1 . 2]" 1
1226 1 66 GLU H 1 123 LYS QB . . 4.380 3.701 2.056 4.387 0.007 20 0 "[ . 1 . 2]" 1
1227 1 66 GLU H 1 124 PHE HA . . 4.640 3.146 2.040 4.187 . 0 0 "[ . 1 . 2]" 1
1228 1 66 GLU H 1 124 PHE QD . . 5.500 4.532 3.821 5.351 . 0 0 "[ . 1 . 2]" 1
1229 1 66 GLU HA 1 66 GLU HG2 . . 3.820 3.299 2.514 3.849 0.029 18 0 "[ . 1 . 2]" 1
1230 1 66 GLU HA 1 66 GLU HG3 . . 4.030 2.860 2.065 4.013 . 0 0 "[ . 1 . 2]" 1
1231 1 66 GLU HA 1 67 VAL H . . 2.810 2.240 2.144 2.357 . 0 0 "[ . 1 . 2]" 1
1232 1 66 GLU HA 1 67 VAL QG . . 4.440 3.485 3.182 3.756 . 0 0 "[ . 1 . 2]" 1
1233 1 66 GLU HB2 1 67 VAL H . . 4.640 4.088 2.699 4.668 0.028 13 0 "[ . 1 . 2]" 1
1234 1 66 GLU HG2 1 67 VAL H . . 4.200 4.118 2.824 4.636 0.436 20 0 "[ . 1 . 2]" 1
1235 1 66 GLU HG3 1 67 VAL H . . 4.490 3.740 2.436 4.514 0.024 9 0 "[ . 1 . 2]" 1
1236 1 67 VAL H 1 67 VAL HB . . 3.280 2.843 2.570 3.022 . 0 0 "[ . 1 . 2]" 1
1237 1 67 VAL H 1 67 VAL QG . . 3.500 2.449 1.896 2.895 . 0 0 "[ . 1 . 2]" 1
1238 1 67 VAL H 1 68 SER H . . 4.960 4.397 3.933 4.608 . 0 0 "[ . 1 . 2]" 1
1239 1 67 VAL H 1 111 TYR QE . . 5.500 4.112 2.831 5.556 0.056 12 0 "[ . 1 . 2]" 1
1240 1 67 VAL HA 1 67 VAL QG . . 3.240 2.166 2.035 2.389 . 0 0 "[ . 1 . 2]" 1
1241 1 67 VAL HA 1 68 SER H . . 2.980 2.208 2.141 2.268 . 0 0 "[ . 1 . 2]" 1
1242 1 67 VAL HA 1 120 VAL QG . . 4.480 4.086 3.499 4.437 . 0 0 "[ . 1 . 2]" 1
1243 1 67 VAL HB 1 68 SER H . . 4.380 3.932 3.657 4.316 . 0 0 "[ . 1 . 2]" 1
1244 1 67 VAL HB 1 78 LEU H . . 5.220 4.664 3.801 5.645 0.425 11 0 "[ . 1 . 2]" 1
1245 1 67 VAL HB 1 111 TYR HB2 . . 4.820 4.575 4.218 5.107 0.287 13 0 "[ . 1 . 2]" 1
1246 1 67 VAL HB 1 111 TYR QE . . 4.100 3.445 2.685 4.328 0.228 17 0 "[ . 1 . 2]" 1
1247 1 67 VAL HB 1 120 VAL QG . . 4.810 4.373 3.410 4.772 . 0 0 "[ . 1 . 2]" 1
1248 1 67 VAL QG 1 68 SER H . . 3.510 2.294 1.911 2.899 . 0 0 "[ . 1 . 2]" 1
1249 1 67 VAL QG 1 68 SER HA . . 4.780 3.402 2.930 3.837 . 0 0 "[ . 1 . 2]" 1
1250 1 67 VAL QG 1 78 LEU H . . 4.440 3.823 2.673 4.460 0.020 14 0 "[ . 1 . 2]" 1
1251 1 67 VAL QG 1 78 LEU QB . . 3.660 2.471 1.665 3.275 . 0 0 "[ . 1 . 2]" 1
1252 1 67 VAL QG 1 78 LEU QD . . 3.060 1.789 1.697 1.925 . 0 0 "[ . 1 . 2]" 1
1253 1 67 VAL QG 1 78 LEU HG . . 3.730 3.129 1.969 3.679 . 0 0 "[ . 1 . 2]" 1
1254 1 67 VAL QG 1 111 TYR QD . . 3.310 2.738 2.362 3.032 . 0 0 "[ . 1 . 2]" 1
1255 1 67 VAL QG 1 111 TYR QE . . 3.540 2.640 2.150 2.944 . 0 0 "[ . 1 . 2]" 1
1256 1 67 VAL QG 1 120 VAL HB . . 5.490 4.412 3.814 4.710 . 0 0 "[ . 1 . 2]" 1
1257 1 67 VAL QG 1 120 VAL QG . . 2.920 2.161 1.790 2.381 . 0 0 "[ . 1 . 2]" 1
1258 1 67 VAL QG 1 121 HIS H . . 5.280 4.319 3.158 5.192 . 0 0 "[ . 1 . 2]" 1
1259 1 67 VAL QG 1 122 PHE HA . . 4.640 3.198 2.806 3.530 . 0 0 "[ . 1 . 2]" 1
1260 1 67 VAL QG 1 122 PHE QD . . 4.000 2.718 2.378 3.343 . 0 0 "[ . 1 . 2]" 1
1261 1 67 VAL QG 1 122 PHE QE . . 3.110 2.617 1.936 3.042 . 0 0 "[ . 1 . 2]" 1
1262 1 67 VAL QG 1 123 LYS H . . 4.580 3.796 3.071 4.242 . 0 0 "[ . 1 . 2]" 1
1263 1 68 SER H 1 69 GLN H . . 5.350 3.707 1.703 4.423 . 0 0 "[ . 1 . 2]" 1
1264 1 68 SER H 1 120 VAL QG . . 4.730 3.791 3.073 4.680 . 0 0 "[ . 1 . 2]" 1
1265 1 68 SER H 1 123 LYS H . . 5.310 4.990 3.949 5.373 0.063 16 0 "[ . 1 . 2]" 1
1266 1 68 SER HA 1 69 GLN H . . 3.340 2.615 2.160 3.557 0.217 16 0 "[ . 1 . 2]" 1
1267 1 68 SER HA 1 75 ALA MB . . 4.980 4.842 4.120 5.099 0.119 7 0 "[ . 1 . 2]" 1
1268 1 68 SER HA 1 77 ASN H . . 5.040 4.897 4.375 5.255 0.215 2 0 "[ . 1 . 2]" 1
1269 1 68 SER HA 1 77 ASN HA . . 3.380 3.018 2.380 3.686 0.306 14 0 "[ . 1 . 2]" 1
1270 1 68 SER HA 1 78 LEU H . . 3.760 2.197 1.816 2.697 . 0 0 "[ . 1 . 2]" 1
1271 1 68 SER HA 1 78 LEU QD . . 3.970 2.807 1.860 3.326 . 0 0 "[ . 1 . 2]" 1
1272 1 68 SER HA 1 78 LEU HG . . 3.900 2.894 2.100 4.372 0.472 10 0 "[ . 1 . 2]" 1
1273 1 68 SER HB2 1 69 GLN H . . 3.400 2.830 2.147 3.433 0.033 1 0 "[ . 1 . 2]" 1
1274 1 68 SER HB2 1 75 ALA HA . . 4.500 4.265 3.719 4.526 0.026 16 0 "[ . 1 . 2]" 1
1275 1 68 SER HB2 1 75 ALA MB . . 3.800 2.723 2.212 2.996 . 0 0 "[ . 1 . 2]" 1
1276 1 68 SER HB2 1 76 GLN H . . 4.020 3.339 2.545 3.944 . 0 0 "[ . 1 . 2]" 1
1277 1 68 SER HB2 1 78 LEU H . . 4.870 4.606 3.369 5.228 0.358 16 0 "[ . 1 . 2]" 1
1278 1 68 SER HB3 1 69 GLN H . . 3.720 3.529 2.925 3.754 0.034 9 0 "[ . 1 . 2]" 1
1279 1 68 SER HB3 1 75 ALA MB . . 4.040 3.506 2.038 4.089 0.049 13 0 "[ . 1 . 2]" 1
1280 1 68 SER HB3 1 76 GLN H . . 4.520 3.589 1.945 4.548 0.028 11 0 "[ . 1 . 2]" 1
1281 1 68 SER HB3 1 77 ASN H . . 5.130 4.329 3.141 5.207 0.077 19 0 "[ . 1 . 2]" 1
1282 1 68 SER HB3 1 78 LEU H . . 4.560 3.528 2.347 4.476 . 0 0 "[ . 1 . 2]" 1
1283 1 68 SER HB3 1 78 LEU QD . . 5.380 4.354 3.469 4.808 . 0 0 "[ . 1 . 2]" 1
1284 1 69 GLN H 1 69 GLN HB2 . . 4.070 2.814 2.356 3.263 . 0 0 "[ . 1 . 2]" 1
1285 1 69 GLN H 1 69 GLN HG2 . . 5.500 4.290 3.818 4.700 . 0 0 "[ . 1 . 2]" 1
1286 1 69 GLN H 1 69 GLN HG3 . . 5.350 3.586 3.131 4.404 . 0 0 "[ . 1 . 2]" 1
1287 1 69 GLN H 1 75 ALA HA . . 4.850 4.349 3.659 4.866 0.016 15 0 "[ . 1 . 2]" 1
1288 1 69 GLN H 1 76 GLN H . . 3.920 3.106 2.214 4.228 0.308 19 0 "[ . 1 . 2]" 1
1289 1 69 GLN H 1 78 LEU QD . . 4.220 2.844 1.916 3.930 . 0 0 "[ . 1 . 2]" 1
1290 1 69 GLN H 1 78 LEU HG . . 5.040 3.677 2.294 5.685 0.645 14 1 "[ . 1 +. 2]" 1
1291 1 69 GLN HA 1 69 GLN HE21 . . 5.500 4.357 3.731 4.970 . 0 0 "[ . 1 . 2]" 1
1292 1 69 GLN HA 1 69 GLN HG2 . . 4.140 2.422 2.181 2.671 . 0 0 "[ . 1 . 2]" 1
1293 1 69 GLN HA 1 70 THR H . . 3.220 2.314 2.139 2.616 . 0 0 "[ . 1 . 2]" 1
1294 1 69 GLN HB2 1 69 GLN HE22 . . 5.500 4.472 3.943 4.875 . 0 0 "[ . 1 . 2]" 1
1295 1 69 GLN HB2 1 70 THR H . . 4.370 4.012 3.432 4.485 0.115 5 0 "[ . 1 . 2]" 1
1296 1 69 GLN HB2 1 78 LEU QD . . 4.380 2.002 1.680 2.520 . 0 0 "[ . 1 . 2]" 1
1297 1 69 GLN HB3 1 70 THR H . . 3.530 2.821 1.985 3.561 0.031 5 0 "[ . 1 . 2]" 1
1298 1 69 GLN HB3 1 78 LEU QD . . 4.460 3.167 2.454 3.608 . 0 0 "[ . 1 . 2]" 1
1299 1 69 GLN HE21 1 70 THR H . . 4.940 4.696 3.954 5.200 0.260 2 0 "[ . 1 . 2]" 1
1300 1 69 GLN HE21 1 115 ASN H . . 4.780 4.764 3.973 4.928 0.148 17 0 "[ . 1 . 2]" 1
1301 1 69 GLN HE21 1 115 ASN QB . . 5.260 2.604 2.138 3.181 . 0 0 "[ . 1 . 2]" 1
1302 1 69 GLN HE21 1 118 LYS H . . 4.580 4.019 3.659 4.244 . 0 0 "[ . 1 . 2]" 1
1303 1 69 GLN HE21 1 118 LYS HB2 . . 4.590 2.868 2.238 3.817 . 0 0 "[ . 1 . 2]" 1
1304 1 69 GLN HE21 1 118 LYS HB3 . . 5.250 4.042 3.447 5.372 0.122 2 0 "[ . 1 . 2]" 1
1305 1 69 GLN HE21 1 118 LYS HG2 . . 5.470 5.096 4.527 5.656 0.186 17 0 "[ . 1 . 2]" 1
1306 1 69 GLN HE21 1 120 VAL H . . 5.500 4.632 4.018 5.430 . 0 0 "[ . 1 . 2]" 1
1307 1 69 GLN HE21 1 120 VAL HA . . 4.420 3.491 2.802 4.213 . 0 0 "[ . 1 . 2]" 1
1308 1 69 GLN HE21 1 120 VAL QG . . 3.730 2.890 2.042 3.594 . 0 0 "[ . 1 . 2]" 1
1309 1 69 GLN HE22 1 78 LEU QD . . 5.500 3.923 3.531 4.713 . 0 0 "[ . 1 . 2]" 1
1310 1 69 GLN HE22 1 115 ASN H . . 4.920 3.727 3.301 4.943 0.023 2 0 "[ . 1 . 2]" 1
1311 1 69 GLN HE22 1 115 ASN QB . . 5.200 2.485 2.267 3.069 . 0 0 "[ . 1 . 2]" 1
1312 1 69 GLN HE22 1 116 GLU HA . . 4.970 3.483 2.935 4.148 . 0 0 "[ . 1 . 2]" 1
1313 1 69 GLN HE22 1 117 ASN H . . 5.430 5.091 4.753 5.357 . 0 0 "[ . 1 . 2]" 1
1314 1 69 GLN HE22 1 118 LYS H . . 4.150 3.919 2.970 4.178 0.028 8 0 "[ . 1 . 2]" 1
1315 1 69 GLN HE22 1 118 LYS HB2 . . 4.540 3.657 2.401 3.997 . 0 0 "[ . 1 . 2]" 1
1316 1 69 GLN HE22 1 118 LYS HB3 . . 5.330 5.130 3.816 5.427 0.097 17 0 "[ . 1 . 2]" 1
1317 1 69 GLN HE22 1 120 VAL HA . . 5.330 4.460 3.384 5.348 0.018 4 0 "[ . 1 . 2]" 1
1318 1 69 GLN HE22 1 120 VAL QG . . 4.090 2.984 2.282 4.007 . 0 0 "[ . 1 . 2]" 1
1319 1 69 GLN HG2 1 70 THR H . . 4.630 3.609 2.955 4.339 . 0 0 "[ . 1 . 2]" 1
1320 1 69 GLN HG2 1 78 LEU QD . . 4.190 3.336 2.780 3.776 . 0 0 "[ . 1 . 2]" 1
1321 1 69 GLN HG2 1 120 VAL H . . 5.500 4.775 4.203 5.519 0.019 2 0 "[ . 1 . 2]" 1
1322 1 69 GLN HG2 1 120 VAL HA . . 3.640 2.433 1.965 3.363 . 0 0 "[ . 1 . 2]" 1
1323 1 69 GLN HG2 1 120 VAL QG . . 4.040 2.976 2.121 3.635 . 0 0 "[ . 1 . 2]" 1
1324 1 69 GLN HG2 1 121 HIS H . . 4.680 3.415 1.948 4.688 0.008 6 0 "[ . 1 . 2]" 1
1325 1 69 GLN HG3 1 70 THR H . . 5.130 4.632 4.221 5.154 0.024 11 0 "[ . 1 . 2]" 1
1326 1 69 GLN HG3 1 78 LEU QD . . 3.800 2.062 1.717 2.617 . 0 0 "[ . 1 . 2]" 1
1327 1 69 GLN HG3 1 120 VAL HA . . 4.120 2.922 2.157 3.519 . 0 0 "[ . 1 . 2]" 1
1328 1 69 GLN HG3 1 120 VAL QG . . 4.220 2.653 1.937 3.397 . 0 0 "[ . 1 . 2]" 1
1329 1 69 GLN HG3 1 121 HIS H . . 4.780 3.866 2.937 4.801 0.021 4 0 "[ . 1 . 2]" 1
1330 1 70 THR H 1 70 THR HB . . 3.170 2.947 2.462 3.245 0.075 15 0 "[ . 1 . 2]" 1
1331 1 70 THR H 1 70 THR MG . . 4.490 3.649 3.444 3.831 . 0 0 "[ . 1 . 2]" 1
1332 1 70 THR H 1 75 ALA HA . . 4.950 4.129 3.027 4.826 . 0 0 "[ . 1 . 2]" 1
1333 1 70 THR H 1 75 ALA MB . . 5.500 4.670 3.137 5.542 0.042 15 0 "[ . 1 . 2]" 1
1334 1 70 THR HA 1 70 THR MG . . 2.940 2.110 1.952 2.343 . 0 0 "[ . 1 . 2]" 1
1335 1 70 THR HA 1 71 VAL H . . 2.790 2.221 2.142 2.353 . 0 0 "[ . 1 . 2]" 1
1336 1 70 THR HA 1 71 VAL HA . . 4.950 4.453 4.391 4.560 . 0 0 "[ . 1 . 2]" 1
1337 1 70 THR HA 1 71 VAL HB . . 5.360 4.764 4.485 5.737 0.377 9 0 "[ . 1 . 2]" 1
1338 1 70 THR HA 1 71 VAL QG . . 4.030 3.435 3.211 3.792 . 0 0 "[ . 1 . 2]" 1
1339 1 70 THR HA 1 74 LYS H . . 4.190 3.930 3.301 4.222 0.032 15 0 "[ . 1 . 2]" 1
1340 1 70 THR HA 1 75 ALA HA . . 3.330 2.193 1.948 2.671 . 0 0 "[ . 1 . 2]" 1
1341 1 70 THR HA 1 75 ALA MB . . 4.540 3.552 2.576 4.027 . 0 0 "[ . 1 . 2]" 1
1342 1 70 THR HB 1 71 VAL H . . 4.040 3.691 3.088 4.121 0.081 9 0 "[ . 1 . 2]" 1
1343 1 70 THR HB 1 75 ALA HA . . 5.250 5.057 4.233 5.501 0.251 15 0 "[ . 1 . 2]" 1
1344 1 70 THR MG 1 71 VAL H . . 3.130 2.601 1.991 3.154 0.024 9 0 "[ . 1 . 2]" 1
1345 1 70 THR MG 1 73 GLY H . . 3.140 3.013 2.196 3.169 0.029 15 0 "[ . 1 . 2]" 1
1346 1 70 THR MG 1 73 GLY HA2 . . 3.440 2.911 2.621 3.248 . 0 0 "[ . 1 . 2]" 1
1347 1 70 THR MG 1 73 GLY HA3 . . 4.400 4.236 3.760 4.468 0.068 7 0 "[ . 1 . 2]" 1
1348 1 70 THR MG 1 74 LYS H . . 3.370 2.813 1.968 3.385 0.015 10 0 "[ . 1 . 2]" 1
1349 1 70 THR MG 1 74 LYS HA . . 4.760 3.290 2.175 3.932 . 0 0 "[ . 1 . 2]" 1
1350 1 70 THR MG 1 75 ALA H . . 5.140 3.625 2.606 4.680 . 0 0 "[ . 1 . 2]" 1
1351 1 70 THR MG 1 75 ALA HA . . 3.510 3.424 2.885 3.570 0.060 7 0 "[ . 1 . 2]" 1
1352 1 71 VAL H 1 71 VAL HB . . 3.540 3.323 2.557 3.794 0.254 9 0 "[ . 1 . 2]" 1
1353 1 71 VAL H 1 71 VAL QG . . 3.390 2.429 1.868 2.983 . 0 0 "[ . 1 . 2]" 1
1354 1 71 VAL H 1 73 GLY H . . 4.450 3.346 2.788 3.982 . 0 0 "[ . 1 . 2]" 1
1355 1 71 VAL H 1 74 LYS H . . 3.410 2.454 2.059 2.857 . 0 0 "[ . 1 . 2]" 1
1356 1 71 VAL H 1 74 LYS HB2 . . 4.900 4.610 4.082 5.389 0.489 7 0 "[ . 1 . 2]" 1
1357 1 71 VAL H 1 75 ALA HA . . 3.940 3.407 2.470 3.955 0.015 7 0 "[ . 1 . 2]" 1
1358 1 71 VAL H 1 75 ALA MB . . 5.490 4.759 3.940 5.223 . 0 0 "[ . 1 . 2]" 1
1359 1 71 VAL HA 1 71 VAL QG . . 3.150 2.244 2.058 2.422 . 0 0 "[ . 1 . 2]" 1
1360 1 71 VAL HA 1 73 GLY H . . 4.850 3.575 3.361 4.074 . 0 0 "[ . 1 . 2]" 1
1361 1 71 VAL HA 1 74 LYS H . . 4.340 4.273 4.002 4.892 0.552 12 1 "[ . 1 + . 2]" 1
1362 1 71 VAL HB 1 76 GLN HE21 . . 4.830 4.658 3.728 5.338 0.508 5 1 "[ + 1 . 2]" 1
1363 1 71 VAL HB 1 76 GLN HE22 . . 5.320 4.770 4.149 5.404 0.084 12 0 "[ . 1 . 2]" 1
1364 1 71 VAL QG 1 72 HIS HA . . 4.900 3.898 2.956 4.541 . 0 0 "[ . 1 . 2]" 1
1365 1 71 VAL QG 1 72 HIS QB . . 3.890 2.492 2.151 3.057 . 0 0 "[ . 1 . 2]" 1
1366 1 71 VAL QG 1 72 HIS HD2 . . 3.770 3.133 2.054 3.704 . 0 0 "[ . 1 . 2]" 1
1367 1 71 VAL QG 1 73 GLY H . . 5.030 3.989 3.228 4.279 . 0 0 "[ . 1 . 2]" 1
1368 1 71 VAL QG 1 74 LYS H . . 4.500 3.588 2.651 4.349 . 0 0 "[ . 1 . 2]" 1
1369 1 71 VAL QG 1 76 GLN HB2 . . 3.370 2.511 1.844 3.475 0.105 10 0 "[ . 1 . 2]" 1
1370 1 71 VAL QG 1 76 GLN HE21 . . 4.410 3.011 1.906 3.994 . 0 0 "[ . 1 . 2]" 1
1371 1 71 VAL QG 1 76 GLN HE22 . . 4.560 3.071 2.003 4.038 . 0 0 "[ . 1 . 2]" 1
1372 1 71 VAL QG 1 76 GLN QG . . 3.200 2.656 1.943 3.215 0.015 7 0 "[ . 1 . 2]" 1
1373 1 71 VAL QG 1 77 ASN H . . 5.500 5.007 4.611 5.385 . 0 0 "[ . 1 . 2]" 1
1374 1 71 VAL QG 1 115 ASN HD22 . . 5.500 3.010 1.724 4.241 . 0 0 "[ . 1 . 2]" 1
1375 1 72 HIS HA 1 73 GLY H . . 3.550 3.023 2.639 3.148 . 0 0 "[ . 1 . 2]" 1
1376 1 72 HIS HA 1 74 LYS H . . 4.920 4.631 4.251 4.930 0.010 7 0 "[ . 1 . 2]" 1
1377 1 72 HIS QB 1 73 GLY H . . 5.250 3.689 3.570 3.911 . 0 0 "[ . 1 . 2]" 1
1378 1 72 HIS QB 1 74 LYS H . . 4.680 3.873 3.489 4.182 . 0 0 "[ . 1 . 2]" 1
1379 1 72 HIS QB 1 74 LYS HB2 . . 4.950 4.218 3.536 5.705 0.755 7 3 "[- . + 1 * 2]" 1
1380 1 73 GLY H 1 74 LYS H . . 3.420 2.277 2.027 2.608 . 0 0 "[ . 1 . 2]" 1
1381 1 73 GLY HA2 1 74 LYS HA . . 5.080 4.404 4.350 4.484 . 0 0 "[ . 1 . 2]" 1
1382 1 73 GLY HA3 1 74 LYS HG2 . . 5.200 4.711 4.249 5.802 0.602 17 1 "[ . 1 . + 2]" 1
1383 1 74 LYS H 1 74 LYS HB2 . . 3.250 2.986 2.691 4.032 0.782 7 3 "[* . + 1 - 2]" 1
1384 1 74 LYS H 1 74 LYS QD . . 5.080 4.936 4.329 5.086 0.006 6 0 "[ . 1 . 2]" 1
1385 1 74 LYS H 1 74 LYS HG2 . . 4.010 3.949 2.876 4.606 0.596 17 1 "[ . 1 . + 2]" 1
1386 1 74 LYS H 1 75 ALA H . . 4.500 4.260 4.093 4.445 . 0 0 "[ . 1 . 2]" 1
1387 1 74 LYS HA 1 74 LYS QD . . 3.870 3.404 2.993 4.063 0.193 15 0 "[ . 1 . 2]" 1
1388 1 74 LYS HA 1 74 LYS HG3 . . 3.460 3.420 2.760 3.568 0.108 15 0 "[ . 1 . 2]" 1
1389 1 74 LYS HA 1 75 ALA H . . 2.590 2.251 2.142 2.549 . 0 0 "[ . 1 . 2]" 1
1390 1 74 LYS HB2 1 75 ALA H . . 4.300 3.956 2.216 4.395 0.095 13 0 "[ . 1 . 2]" 1
1391 1 74 LYS HB3 1 75 ALA H . . 3.720 3.223 2.597 3.872 0.152 7 0 "[ . 1 . 2]" 1
1392 1 74 LYS HB3 1 75 ALA MB . . 5.410 4.557 3.930 5.530 0.120 7 0 "[ . 1 . 2]" 1
1393 1 74 LYS QD 1 74 LYS HG2 . . 2.640 2.354 2.148 2.530 . 0 0 "[ . 1 . 2]" 1
1394 1 74 LYS QD 1 75 ALA H . . 4.310 3.649 2.534 4.330 0.020 17 0 "[ . 1 . 2]" 1
1395 1 74 LYS HG2 1 75 ALA H . . 4.430 4.035 3.199 4.642 0.212 7 0 "[ . 1 . 2]" 1
1396 1 75 ALA H 1 75 ALA MB . . 2.850 2.199 2.024 2.356 . 0 0 "[ . 1 . 2]" 1
1397 1 75 ALA HA 1 76 GLN H . . 2.840 2.267 2.142 2.505 . 0 0 "[ . 1 . 2]" 1
1398 1 75 ALA HA 1 76 GLN HB3 . . 4.950 4.461 4.122 5.186 0.236 5 0 "[ . 1 . 2]" 1
1399 1 75 ALA MB 1 76 GLN H . . 3.290 2.780 2.245 3.269 . 0 0 "[ . 1 . 2]" 1
1400 1 76 GLN H 1 76 GLN HB3 . . 3.440 2.887 2.531 3.234 . 0 0 "[ . 1 . 2]" 1
1401 1 76 GLN H 1 76 GLN QG . . 4.510 3.525 2.392 4.219 . 0 0 "[ . 1 . 2]" 1
1402 1 76 GLN H 1 77 ASN H . . 4.420 4.357 4.105 4.466 0.046 4 0 "[ . 1 . 2]" 1
1403 1 76 GLN HA 1 76 GLN QG . . 3.280 2.740 2.064 3.337 0.057 3 0 "[ . 1 . 2]" 1
1404 1 76 GLN HA 1 77 ASN H . . 2.770 2.345 2.152 2.810 0.040 14 0 "[ . 1 . 2]" 1
1405 1 76 GLN HA 1 77 ASN QB . . 4.450 4.331 4.165 4.450 . 0 0 "[ . 1 . 2]" 1
1406 1 76 GLN HA 1 77 ASN HD21 . . 5.500 3.442 3.106 3.805 . 0 0 "[ . 1 . 2]" 1
1407 1 76 GLN HB2 1 76 GLN HE22 . . 5.310 4.309 3.390 4.807 . 0 0 "[ . 1 . 2]" 1
1408 1 76 GLN HB2 1 77 ASN H . . 4.110 3.469 1.915 4.244 0.134 11 0 "[ . 1 . 2]" 1
1409 1 76 GLN HB2 1 77 ASN HD21 . . 5.500 4.843 3.109 5.598 0.098 13 0 "[ . 1 . 2]" 1
1410 1 76 GLN HB2 1 78 LEU QD . . 5.450 4.661 3.029 5.286 . 0 0 "[ . 1 . 2]" 1
1411 1 76 GLN HB3 1 77 ASN H . . 4.080 3.814 2.166 4.340 0.260 9 0 "[ . 1 . 2]" 1
1412 1 76 GLN HE21 1 77 ASN H . . 5.490 5.117 2.970 5.573 0.083 12 0 "[ . 1 . 2]" 1
1413 1 76 GLN HE21 1 78 LEU HA . . 5.400 4.221 3.163 5.331 . 0 0 "[ . 1 . 2]" 1
1414 1 76 GLN HE21 1 78 LEU QD . . 5.500 2.891 1.883 4.117 . 0 0 "[ . 1 . 2]" 1
1415 1 76 GLN HE21 1 114 ILE MD . . 4.300 4.259 3.018 4.597 0.297 5 0 "[ . 1 . 2]" 1
1416 1 76 GLN HE22 1 78 LEU QD . . 5.040 3.846 2.597 4.996 . 0 0 "[ . 1 . 2]" 1
1417 1 76 GLN HE22 1 114 ILE MD . . 4.580 3.765 2.697 4.591 0.011 20 0 "[ . 1 . 2]" 1
1418 1 76 GLN QG 1 77 ASN H . . 3.590 2.606 1.915 3.593 0.003 17 0 "[ . 1 . 2]" 1
1419 1 76 GLN QG 1 78 LEU QD . . 4.250 3.224 1.931 4.159 . 0 0 "[ . 1 . 2]" 1
1420 1 77 ASN H 1 77 ASN QB . . 3.250 2.527 2.204 3.066 . 0 0 "[ . 1 . 2]" 1
1421 1 77 ASN H 1 77 ASN HD21 . . 4.940 1.998 1.838 2.539 . 0 0 "[ . 1 . 2]" 1
1422 1 77 ASN H 1 77 ASN HD22 . . 5.500 3.305 2.875 4.019 . 0 0 "[ . 1 . 2]" 1
1423 1 77 ASN H 1 78 LEU QD . . 5.500 4.702 3.232 5.261 . 0 0 "[ . 1 . 2]" 1
1424 1 77 ASN HA 1 78 LEU H . . 3.400 2.219 2.140 2.642 . 0 0 "[ . 1 . 2]" 1
1425 1 77 ASN QB 1 78 LEU H . . 4.370 3.561 3.204 4.023 . 0 0 "[ . 1 . 2]" 1
1426 1 77 ASN HD21 1 78 LEU H . . 5.500 5.340 4.678 5.609 0.109 9 0 "[ . 1 . 2]" 1
1427 1 78 LEU H 1 78 LEU QD . . 4.410 2.821 1.944 3.221 . 0 0 "[ . 1 . 2]" 1
1428 1 78 LEU H 1 78 LEU HG . . 3.720 2.996 2.159 4.391 0.671 11 2 "[ . 1+ - . 2]" 1
1429 1 78 LEU HA 1 78 LEU QD . . 3.070 1.998 1.761 2.220 . 0 0 "[ . 1 . 2]" 1
1430 1 78 LEU HA 1 79 GLN H . . 3.090 2.157 2.140 2.351 . 0 0 "[ . 1 . 2]" 1
1431 1 78 LEU HA 1 79 GLN QG . . 4.210 3.901 3.663 4.198 . 0 0 "[ . 1 . 2]" 1
1432 1 78 LEU QB 1 111 TYR QD . . 4.660 2.657 1.915 3.940 . 0 0 "[ . 1 . 2]" 1
1433 1 78 LEU QD 1 79 GLN H . . 3.860 3.607 3.380 3.879 0.019 7 0 "[ . 1 . 2]" 1
1434 1 78 LEU QD 1 113 PHE HA . . 3.900 3.534 3.041 3.994 0.094 10 0 "[ . 1 . 2]" 1
1435 1 78 LEU QD 1 114 ILE H . . 4.180 4.088 3.969 4.252 0.072 10 0 "[ . 1 . 2]" 1
1436 1 78 LEU QD 1 115 ASN H . . 4.780 3.776 3.599 3.952 . 0 0 "[ . 1 . 2]" 1
1437 1 79 GLN H 1 79 GLN HB2 . . 3.760 3.021 2.416 3.769 0.009 2 0 "[ . 1 . 2]" 1
1438 1 79 GLN H 1 79 GLN HB3 . . 3.580 3.340 2.569 3.827 0.247 14 0 "[ . 1 . 2]" 1
1439 1 79 GLN H 1 79 GLN HE21 . . 5.500 4.432 2.990 5.257 . 0 0 "[ . 1 . 2]" 1
1440 1 79 GLN H 1 79 GLN QG . . 3.410 2.418 2.000 3.083 . 0 0 "[ . 1 . 2]" 1
1441 1 79 GLN H 1 80 TYR H . . 4.870 4.452 4.340 4.601 . 0 0 "[ . 1 . 2]" 1
1442 1 79 GLN H 1 111 TYR HB3 . . 5.500 4.847 4.156 5.523 0.023 15 0 "[ . 1 . 2]" 1
1443 1 79 GLN H 1 111 TYR QD . . 5.500 4.690 4.095 5.572 0.072 12 0 "[ . 1 . 2]" 1
1444 1 79 GLN H 1 112 GLU H . . 4.720 3.348 2.885 3.908 . 0 0 "[ . 1 . 2]" 1
1445 1 79 GLN H 1 112 GLU QB . . 4.330 2.715 1.975 3.908 . 0 0 "[ . 1 . 2]" 1
1446 1 79 GLN HA 1 79 GLN HE22 . . 5.500 5.491 4.041 6.338 0.838 8 8 "[-** .* + ** . *2]" 1
1447 1 79 GLN HA 1 79 GLN QG . . 3.510 2.869 2.390 3.377 . 0 0 "[ . 1 . 2]" 1
1448 1 79 GLN HA 1 80 TYR H . . 2.720 2.624 2.399 2.726 0.006 14 0 "[ . 1 . 2]" 1
1449 1 79 GLN HB2 1 80 TYR H . . 3.540 2.705 1.918 3.535 . 0 0 "[ . 1 . 2]" 1
1450 1 79 GLN HB3 1 80 TYR H . . 3.870 2.674 1.922 3.690 . 0 0 "[ . 1 . 2]" 1
1451 1 79 GLN QG 1 80 TYR H . . 4.380 3.603 2.549 4.336 . 0 0 "[ . 1 . 2]" 1
1452 1 80 TYR H 1 80 TYR HB2 . . 3.580 2.446 2.353 2.504 . 0 0 "[ . 1 . 2]" 1
1453 1 80 TYR H 1 80 TYR HB3 . . 3.510 2.627 2.561 2.731 . 0 0 "[ . 1 . 2]" 1
1454 1 80 TYR H 1 80 TYR QD . . 4.660 4.173 4.105 4.197 . 0 0 "[ . 1 . 2]" 1
1455 1 80 TYR H 1 81 ALA H . . 4.840 4.523 4.458 4.634 . 0 0 "[ . 1 . 2]" 1
1456 1 80 TYR H 1 109 TYR QE . . 5.500 4.026 3.186 5.050 . 0 0 "[ . 1 . 2]" 1
1457 1 80 TYR H 1 111 TYR HA . . 5.500 4.762 4.276 5.463 . 0 0 "[ . 1 . 2]" 1
1458 1 80 TYR H 1 112 GLU H . . 5.500 5.363 4.960 5.598 0.098 16 0 "[ . 1 . 2]" 1
1459 1 80 TYR HA 1 80 TYR QD . . 3.420 2.651 2.395 3.017 . 0 0 "[ . 1 . 2]" 1
1460 1 80 TYR HA 1 81 ALA H . . 3.030 2.151 2.138 2.256 . 0 0 "[ . 1 . 2]" 1
1461 1 80 TYR HA 1 81 ALA MB . . 4.970 3.925 3.887 3.984 . 0 0 "[ . 1 . 2]" 1
1462 1 80 TYR HA 1 109 TYR QE . . 3.670 3.507 3.076 3.758 0.088 9 0 "[ . 1 . 2]" 1
1463 1 80 TYR HA 1 110 PRO QG . . 4.920 3.699 3.219 4.359 . 0 0 "[ . 1 . 2]" 1
1464 1 80 TYR HA 1 112 GLU H . . 5.090 4.718 4.243 5.101 0.011 2 0 "[ . 1 . 2]" 1
1465 1 80 TYR HB2 1 81 ALA H . . 4.770 4.265 3.983 4.398 . 0 0 "[ . 1 . 2]" 1
1466 1 80 TYR HB2 1 109 TYR QE . . 5.500 3.759 2.943 4.615 . 0 0 "[ . 1 . 2]" 1
1467 1 80 TYR QD 1 81 ALA H . . 3.530 3.490 3.155 3.595 0.065 10 0 "[ . 1 . 2]" 1
1468 1 80 TYR QD 1 82 VAL H . . 5.080 4.484 2.673 4.845 . 0 0 "[ . 1 . 2]" 1
1469 1 80 TYR QD 1 82 VAL HA . . 4.220 3.654 2.611 3.952 . 0 0 "[ . 1 . 2]" 1
1470 1 80 TYR QD 1 82 VAL MG1 . . 5.020 4.846 3.868 5.074 0.054 10 0 "[ . 1 . 2]" 1
1471 1 80 TYR QD 1 82 VAL MG2 . . 3.640 3.261 2.622 4.454 0.814 19 1 "[ . 1 . +2]" 1
1472 1 80 TYR QD 1 110 PRO QG . . 4.190 2.730 2.382 3.098 . 0 0 "[ . 1 . 2]" 1
1473 1 80 TYR QE 1 82 VAL HA . . 3.680 3.147 1.976 3.401 . 0 0 "[ . 1 . 2]" 1
1474 1 80 TYR QE 1 82 VAL MG1 . . 4.330 4.352 4.251 4.633 0.303 19 0 "[ . 1 . 2]" 1
1475 1 80 TYR QE 1 83 LEU H . . 4.260 4.076 3.106 4.318 0.058 12 0 "[ . 1 . 2]" 1
1476 1 80 TYR QE 1 109 TYR HA . . 4.820 4.574 4.117 4.853 0.033 4 0 "[ . 1 . 2]" 1
1477 1 80 TYR QE 1 110 PRO HD2 . . 3.380 2.866 2.547 3.113 . 0 0 "[ . 1 . 2]" 1
1478 1 80 TYR QE 1 110 PRO HD3 . . 3.810 3.867 3.811 4.021 0.211 12 0 "[ . 1 . 2]" 1
1479 1 80 TYR QE 1 110 PRO QG . . 2.870 2.322 2.068 2.749 . 0 0 "[ . 1 . 2]" 1
1480 1 81 ALA H 1 81 ALA MB . . 3.290 2.118 2.073 2.339 . 0 0 "[ . 1 . 2]" 1
1481 1 81 ALA H 1 109 TYR QE . . 5.500 5.271 4.864 5.540 0.040 19 0 "[ . 1 . 2]" 1
1482 1 81 ALA H 1 110 PRO QG . . 5.500 3.140 2.557 3.668 . 0 0 "[ . 1 . 2]" 1
1483 1 81 ALA H 1 111 TYR HA . . 4.350 3.036 1.949 3.681 . 0 0 "[ . 1 . 2]" 1
1484 1 81 ALA H 1 112 GLU H . . 4.620 4.373 3.633 4.674 0.054 14 0 "[ . 1 . 2]" 1
1485 1 81 ALA HA 1 82 VAL H . . 2.980 2.176 2.143 2.310 . 0 0 "[ . 1 . 2]" 1
1486 1 81 ALA HA 1 82 VAL MG2 . . 4.490 3.814 3.505 5.409 0.919 19 1 "[ . 1 . +2]" 1
1487 1 81 ALA HA 1 112 GLU QG . . 4.180 3.162 2.771 4.029 . 0 0 "[ . 1 . 2]" 1
1488 1 81 ALA MB 1 82 VAL H . . 3.450 3.233 2.816 3.633 0.183 19 0 "[ . 1 . 2]" 1
1489 1 81 ALA MB 1 110 PRO QG . . 4.050 3.636 3.202 4.069 0.019 20 0 "[ . 1 . 2]" 1
1490 1 81 ALA MB 1 111 TYR H . . 4.870 3.340 2.915 4.185 . 0 0 "[ . 1 . 2]" 1
1491 1 81 ALA MB 1 111 TYR HA . . 3.770 3.252 2.682 3.823 0.053 10 0 "[ . 1 . 2]" 1
1492 1 81 ALA MB 1 112 GLU H . . 4.410 3.601 2.774 3.943 . 0 0 "[ . 1 . 2]" 1
1493 1 81 ALA MB 1 112 GLU HA . . 4.090 2.262 1.907 2.853 . 0 0 "[ . 1 . 2]" 1
1494 1 81 ALA MB 1 112 GLU QG . . 3.700 3.417 2.799 3.964 0.264 15 0 "[ . 1 . 2]" 1
1495 1 81 ALA MB 1 113 PHE H . . 5.160 2.986 2.667 3.421 . 0 0 "[ . 1 . 2]" 1
1496 1 81 ALA MB 1 113 PHE HB3 . . 5.420 4.876 4.626 5.450 0.030 15 0 "[ . 1 . 2]" 1
1497 1 82 VAL H 1 82 VAL HB . . 3.270 2.505 2.448 2.767 . 0 0 "[ . 1 . 2]" 1
1498 1 82 VAL H 1 82 VAL MG1 . . 3.960 3.674 1.939 3.789 . 0 0 "[ . 1 . 2]" 1
1499 1 82 VAL H 1 82 VAL MG2 . . 3.140 2.319 2.109 3.749 0.609 19 1 "[ . 1 . +2]" 1
1500 1 82 VAL H 1 83 LEU H . . 5.020 4.595 4.433 4.627 . 0 0 "[ . 1 . 2]" 1
1501 1 82 VAL H 1 112 GLU QG . . 5.420 4.319 3.853 5.547 0.127 15 0 "[ . 1 . 2]" 1
1502 1 82 VAL HA 1 82 VAL MG1 . . 3.150 2.393 2.298 3.166 0.016 19 0 "[ . 1 . 2]" 1
1503 1 82 VAL HA 1 82 VAL MG2 . . 3.080 2.340 2.226 2.547 . 0 0 "[ . 1 . 2]" 1
1504 1 82 VAL HA 1 83 LEU H . . 2.890 2.213 2.143 2.260 . 0 0 "[ . 1 . 2]" 1
1505 1 82 VAL HA 1 83 LEU HB3 . . 5.060 4.747 4.569 5.404 0.344 3 0 "[ . 1 . 2]" 1
1506 1 82 VAL HA 1 83 LEU HG . . 4.350 3.474 3.275 3.710 . 0 0 "[ . 1 . 2]" 1
1507 1 82 VAL HB 1 83 LEU H . . 4.970 4.000 3.775 4.281 . 0 0 "[ . 1 . 2]" 1
1508 1 82 VAL HB 1 83 LEU HA . . 4.780 4.705 4.487 5.557 0.777 19 1 "[ . 1 . +2]" 1
1509 1 82 VAL MG1 1 83 LEU H . . 3.440 2.287 2.014 4.040 0.600 19 1 "[ . 1 . +2]" 1
1510 1 82 VAL MG1 1 83 LEU HA . . 4.710 3.397 3.186 4.256 . 0 0 "[ . 1 . 2]" 1
1511 1 82 VAL MG1 1 84 THR H . . 5.500 4.273 2.015 5.986 0.486 19 0 "[ . 1 . 2]" 1
1512 1 82 VAL MG1 1 84 THR MG . . 4.620 4.248 2.771 5.421 0.801 19 1 "[ . 1 . +2]" 1
1513 1 82 VAL MG2 1 83 LEU H . . 3.850 3.785 2.191 3.958 0.108 10 0 "[ . 1 . 2]" 1
1514 1 83 LEU H 1 83 LEU HB2 . . 4.050 3.797 3.302 3.921 . 0 0 "[ . 1 . 2]" 1
1515 1 83 LEU H 1 83 LEU HB3 . . 3.610 3.546 3.454 3.906 0.296 3 0 "[ . 1 . 2]" 1
1516 1 83 LEU H 1 83 LEU QD . . 4.140 2.813 2.016 3.188 . 0 0 "[ . 1 . 2]" 1
1517 1 83 LEU H 1 83 LEU HG . . 3.410 2.381 2.201 2.993 . 0 0 "[ . 1 . 2]" 1
1518 1 83 LEU HA 1 83 LEU QD . . 3.370 3.378 3.282 3.439 0.069 6 0 "[ . 1 . 2]" 1
1519 1 83 LEU HA 1 83 LEU HG . . 4.020 3.598 3.076 3.675 . 0 0 "[ . 1 . 2]" 1
1520 1 83 LEU HA 1 84 THR H . . 3.140 2.273 2.139 3.208 0.068 16 0 "[ . 1 . 2]" 1
1521 1 83 LEU HB2 1 84 THR H . . 3.760 3.062 2.640 4.090 0.330 16 0 "[ . 1 . 2]" 1
1522 1 83 LEU HB2 1 85 ASP H . . 4.380 2.961 2.454 4.006 . 0 0 "[ . 1 . 2]" 1
1523 1 83 LEU HB2 1 86 SER H . . 5.150 5.025 4.373 5.183 0.033 8 0 "[ . 1 . 2]" 1
1524 1 83 LEU HB3 1 84 THR H . . 4.170 3.878 3.159 4.556 0.386 16 0 "[ . 1 . 2]" 1
1525 1 83 LEU HB3 1 85 ASP H . . 5.500 4.566 4.149 5.421 . 0 0 "[ . 1 . 2]" 1
1526 1 83 LEU QD 1 84 THR H . . 5.030 3.688 2.774 4.296 . 0 0 "[ . 1 . 2]" 1
1527 1 83 LEU QD 1 86 SER H . . 4.660 3.140 2.671 4.443 . 0 0 "[ . 1 . 2]" 1
1528 1 83 LEU QD 1 86 SER QB . . 3.800 1.997 1.692 2.743 . 0 0 "[ . 1 . 2]" 1
1529 1 83 LEU HG 1 84 THR H . . 5.130 4.904 4.004 5.158 0.028 10 0 "[ . 1 . 2]" 1
1530 1 84 THR H 1 84 THR HB . . 3.990 3.514 2.702 4.043 0.053 16 0 "[ . 1 . 2]" 1
1531 1 84 THR H 1 84 THR MG . . 3.800 2.247 1.878 2.711 . 0 0 "[ . 1 . 2]" 1
1532 1 84 THR H 1 85 ASP H . . 3.230 2.728 2.374 3.438 0.208 16 0 "[ . 1 . 2]" 1
1533 1 84 THR HA 1 84 THR HB . . 3.010 2.439 2.269 2.547 . 0 0 "[ . 1 . 2]" 1
1534 1 84 THR HA 1 84 THR MG . . 3.030 2.496 2.247 3.173 0.143 15 0 "[ . 1 . 2]" 1
1535 1 84 THR HB 1 85 ASP H . . 3.770 3.713 3.141 4.063 0.293 6 0 "[ . 1 . 2]" 1
1536 1 84 THR MG 1 85 ASP H . . 4.090 3.555 1.824 4.119 0.029 12 0 "[ . 1 . 2]" 1
1537 1 85 ASP H 1 85 ASP QB . . 3.630 3.038 2.775 3.381 . 0 0 "[ . 1 . 2]" 1
1538 1 85 ASP H 1 86 SER H . . 4.160 4.168 3.920 4.270 0.110 15 0 "[ . 1 . 2]" 1
1539 1 85 ASP H 1 86 SER QB . . 5.500 4.627 3.946 5.135 . 0 0 "[ . 1 . 2]" 1
1540 1 85 ASP HA 1 86 SER H . . 2.980 2.207 2.144 2.250 . 0 0 "[ . 1 . 2]" 1
1541 1 85 ASP QB 1 86 SER H . . 3.560 3.326 3.087 3.466 . 0 0 "[ . 1 . 2]" 1
1542 1 86 SER H 1 86 SER QB . . 3.280 2.691 2.400 2.865 . 0 0 "[ . 1 . 2]" 1
1543 1 86 SER H 1 87 PRO HD2 . . 5.240 4.807 4.790 4.833 . 0 0 "[ . 1 . 2]" 1
1544 1 86 SER H 1 88 PHE H . . 5.110 4.996 4.657 5.145 0.035 12 0 "[ . 1 . 2]" 1
1545 1 86 SER H 1 89 GLN H . . 5.390 4.938 4.688 5.339 . 0 0 "[ . 1 . 2]" 1
1546 1 86 SER H 1 89 GLN HB2 . . 5.250 3.733 3.396 4.188 . 0 0 "[ . 1 . 2]" 1
1547 1 86 SER H 1 89 GLN QG . . 5.500 3.580 2.776 4.474 . 0 0 "[ . 1 . 2]" 1
1548 1 86 SER HA 1 87 PRO HD2 . . 3.800 2.379 2.247 2.497 . 0 0 "[ . 1 . 2]" 1
1549 1 86 SER HA 1 87 PRO HD3 . . 3.420 2.294 2.256 2.340 . 0 0 "[ . 1 . 2]" 1
1550 1 86 SER HA 1 87 PRO HG2 . . 4.640 4.495 4.389 4.592 . 0 0 "[ . 1 . 2]" 1
1551 1 86 SER HA 1 87 PRO HG3 . . 4.650 4.460 4.387 4.532 . 0 0 "[ . 1 . 2]" 1
1552 1 86 SER QB 1 88 PHE H . . 5.020 2.758 2.196 3.607 . 0 0 "[ . 1 . 2]" 1
1553 1 86 SER QB 1 89 GLN H . . 4.710 4.158 3.839 4.496 . 0 0 "[ . 1 . 2]" 1
1554 1 86 SER QB 1 89 GLN HB2 . . 4.530 4.143 3.709 4.365 . 0 0 "[ . 1 . 2]" 1
1555 1 86 SER QB 1 92 LEU QD . . 3.880 2.709 1.862 3.484 . 0 0 "[ . 1 . 2]" 1
1556 1 87 PRO HA 1 88 PHE QD . . 5.420 4.935 4.343 5.432 0.012 8 0 "[ . 1 . 2]" 1
1557 1 87 PRO HA 1 89 GLN H . . 4.560 3.669 3.501 3.843 . 0 0 "[ . 1 . 2]" 1
1558 1 87 PRO HA 1 89 GLN HB2 . . 4.700 4.392 4.237 4.719 0.019 5 0 "[ . 1 . 2]" 1
1559 1 87 PRO HB3 1 88 PHE H . . 4.520 4.249 4.176 4.345 . 0 0 "[ . 1 . 2]" 1
1560 1 87 PRO HB3 1 88 PHE QE . . 5.340 5.476 5.096 5.723 0.383 13 0 "[ . 1 . 2]" 1
1561 1 87 PRO HD2 1 88 PHE H . . 4.760 2.682 2.649 2.757 . 0 0 "[ . 1 . 2]" 1
1562 1 87 PRO HD2 1 88 PHE QD . . 5.050 3.810 3.428 4.388 . 0 0 "[ . 1 . 2]" 1
1563 1 87 PRO HD3 1 88 PHE H . . 4.730 3.859 3.840 3.901 . 0 0 "[ . 1 . 2]" 1
1564 1 87 PRO HG2 1 88 PHE H . . 5.100 2.618 2.445 2.865 . 0 0 "[ . 1 . 2]" 1
1565 1 87 PRO HG2 1 88 PHE QD . . 5.100 2.284 1.983 3.343 . 0 0 "[ . 1 . 2]" 1
1566 1 87 PRO HG2 1 88 PHE QE . . 4.830 3.524 3.335 3.966 . 0 0 "[ . 1 . 2]" 1
1567 1 87 PRO HG3 1 88 PHE H . . 5.260 4.066 3.936 4.250 . 0 0 "[ . 1 . 2]" 1
1568 1 87 PRO HG3 1 88 PHE QE . . 4.600 4.500 4.273 4.879 0.279 15 0 "[ . 1 . 2]" 1
1569 1 88 PHE H 1 88 PHE QD . . 4.790 2.783 2.526 3.448 . 0 0 "[ . 1 . 2]" 1
1570 1 88 PHE H 1 89 GLN H . . 4.100 3.056 2.946 3.289 . 0 0 "[ . 1 . 2]" 1
1571 1 88 PHE H 1 89 GLN HB2 . . 5.460 4.522 4.368 4.700 . 0 0 "[ . 1 . 2]" 1
1572 1 88 PHE H 1 92 LEU QD . . 5.440 4.001 3.364 4.261 . 0 0 "[ . 1 . 2]" 1
1573 1 88 PHE HA 1 88 PHE QD . . 3.480 2.771 2.107 3.061 . 0 0 "[ . 1 . 2]" 1
1574 1 88 PHE HA 1 90 ASP H . . 4.550 3.141 2.971 3.422 . 0 0 "[ . 1 . 2]" 1
1575 1 88 PHE HA 1 91 LYS H . . 4.960 3.824 3.514 4.067 . 0 0 "[ . 1 . 2]" 1
1576 1 88 PHE HB3 1 91 LYS H . . 5.410 3.993 3.197 4.459 . 0 0 "[ . 1 . 2]" 1
1577 1 88 PHE HB3 1 91 LYS HB2 . . 5.220 3.876 2.055 5.298 0.078 16 0 "[ . 1 . 2]" 1
1578 1 88 PHE HB3 1 91 LYS HB3 . . 5.420 4.928 3.633 5.445 0.025 19 0 "[ . 1 . 2]" 1
1579 1 88 PHE HB3 1 108 ALA MB . . 4.220 3.690 3.134 4.186 . 0 0 "[ . 1 . 2]" 1
1580 1 88 PHE QD 1 89 GLN H . . 5.500 4.788 4.438 4.981 . 0 0 "[ . 1 . 2]" 1
1581 1 88 PHE QD 1 90 ASP H . . 5.500 5.213 4.859 5.523 0.023 16 0 "[ . 1 . 2]" 1
1582 1 88 PHE QD 1 91 LYS HD2 . . 3.870 2.987 1.991 4.301 0.431 16 0 "[ . 1 . 2]" 1
1583 1 88 PHE QD 1 92 LEU QD . . 5.500 4.307 3.797 4.937 . 0 0 "[ . 1 . 2]" 1
1584 1 88 PHE QD 1 108 ALA MB . . 5.440 3.483 2.803 4.517 . 0 0 "[ . 1 . 2]" 1
1585 1 89 GLN H 1 89 GLN HB2 . . 3.700 2.197 2.102 2.403 . 0 0 "[ . 1 . 2]" 1
1586 1 89 GLN H 1 89 GLN HB3 . . 3.610 3.030 2.796 3.195 . 0 0 "[ . 1 . 2]" 1
1587 1 89 GLN H 1 89 GLN QG . . 4.510 3.828 3.545 4.116 . 0 0 "[ . 1 . 2]" 1
1588 1 89 GLN H 1 90 ASP H . . 4.240 2.474 2.270 2.711 . 0 0 "[ . 1 . 2]" 1
1589 1 89 GLN H 1 92 LEU QD . . 5.500 3.883 3.345 4.085 . 0 0 "[ . 1 . 2]" 1
1590 1 89 GLN HA 1 89 GLN HE21 . . 4.950 2.856 2.053 3.880 . 0 0 "[ . 1 . 2]" 1
1591 1 89 GLN HA 1 89 GLN HE22 . . 4.820 3.718 2.999 4.188 . 0 0 "[ . 1 . 2]" 1
1592 1 89 GLN HA 1 91 LYS H . . 5.130 4.180 3.383 4.992 . 0 0 "[ . 1 . 2]" 1
1593 1 89 GLN HA 1 92 LEU H . . 4.000 3.211 2.809 3.590 . 0 0 "[ . 1 . 2]" 1
1594 1 89 GLN HA 1 92 LEU HB2 . . 3.840 2.225 1.945 2.715 . 0 0 "[ . 1 . 2]" 1
1595 1 89 GLN HA 1 92 LEU HB3 . . 4.040 3.704 3.288 4.117 0.077 12 0 "[ . 1 . 2]" 1
1596 1 89 GLN HA 1 92 LEU QD . . 3.340 2.229 1.942 2.539 . 0 0 "[ . 1 . 2]" 1
1597 1 89 GLN HA 1 92 LEU HG . . 4.500 3.708 1.980 4.559 0.059 14 0 "[ . 1 . 2]" 1
1598 1 89 GLN HA 1 93 ASP H . . 5.040 4.433 3.774 5.052 0.012 10 0 "[ . 1 . 2]" 1
1599 1 89 GLN HB2 1 89 GLN HE22 . . 5.500 4.891 4.557 5.256 . 0 0 "[ . 1 . 2]" 1
1600 1 89 GLN HB2 1 90 ASP H . . 3.740 3.778 3.718 3.878 0.138 13 0 "[ . 1 . 2]" 1
1601 1 89 GLN HB2 1 92 LEU QD . . 4.350 3.915 3.538 4.107 . 0 0 "[ . 1 . 2]" 1
1602 1 89 GLN HB3 1 90 ASP H . . 3.600 3.329 2.910 3.627 0.027 8 0 "[ . 1 . 2]" 1
1603 1 89 GLN HE21 1 92 LEU HB2 . . 4.830 2.863 1.967 4.579 . 0 0 "[ . 1 . 2]" 1
1604 1 89 GLN HE21 1 92 LEU HB3 . . 5.240 3.320 2.341 5.247 0.007 14 0 "[ . 1 . 2]" 1
1605 1 89 GLN HE21 1 92 LEU QD . . 5.150 3.001 2.013 4.777 . 0 0 "[ . 1 . 2]" 1
1606 1 89 GLN HE21 1 93 ASP H . . 5.300 4.290 3.175 5.219 . 0 0 "[ . 1 . 2]" 1
1607 1 89 GLN HE22 1 89 GLN QG . . 3.650 3.293 3.227 3.431 . 0 0 "[ . 1 . 2]" 1
1608 1 89 GLN HE22 1 92 LEU HB2 . . 4.590 3.474 2.804 4.091 . 0 0 "[ . 1 . 2]" 1
1609 1 89 GLN HE22 1 92 LEU HB3 . . 5.500 3.492 2.474 4.446 . 0 0 "[ . 1 . 2]" 1
1610 1 89 GLN HE22 1 92 LEU QD . . 5.500 3.152 1.883 4.542 . 0 0 "[ . 1 . 2]" 1
1611 1 89 GLN HE22 1 93 ASP H . . 4.960 4.681 3.371 5.320 0.360 13 0 "[ . 1 . 2]" 1
1612 1 89 GLN HE22 1 93 ASP HA . . 5.500 5.012 3.568 6.198 0.698 11 2 "[ - 1+ . 2]" 1
1613 1 89 GLN QG 1 90 ASP H . . 5.090 4.633 4.287 4.866 . 0 0 "[ . 1 . 2]" 1
1614 1 90 ASP H 1 90 ASP HB2 . . 3.380 2.175 2.068 3.542 0.162 9 0 "[ . 1 . 2]" 1
1615 1 90 ASP H 1 90 ASP HB3 . . 3.450 3.200 2.268 3.354 . 0 0 "[ . 1 . 2]" 1
1616 1 90 ASP H 1 91 LYS H . . 3.180 2.608 2.391 2.908 . 0 0 "[ . 1 . 2]" 1
1617 1 90 ASP H 1 91 LYS HA . . 5.260 5.218 5.069 5.418 0.158 13 0 "[ . 1 . 2]" 1
1618 1 90 ASP H 1 91 LYS HG3 . . 5.300 4.884 4.115 5.808 0.508 13 1 "[ . 1 + . 2]" 1
1619 1 90 ASP H 1 92 LEU H . . 5.300 3.759 3.552 3.996 . 0 0 "[ . 1 . 2]" 1
1620 1 90 ASP H 1 92 LEU QD . . 5.500 4.517 4.036 4.939 . 0 0 "[ . 1 . 2]" 1
1621 1 90 ASP HA 1 90 ASP HB2 . . 2.880 2.825 2.315 2.909 0.029 3 0 "[ . 1 . 2]" 1
1622 1 90 ASP HB2 1 91 LYS H . . 4.200 3.304 2.679 4.072 . 0 0 "[ . 1 . 2]" 1
1623 1 90 ASP HB3 1 91 LYS H . . 4.800 3.054 2.319 3.734 . 0 0 "[ . 1 . 2]" 1
1624 1 91 LYS H 1 91 LYS HB2 . . 3.530 3.030 2.383 3.727 0.197 14 0 "[ . 1 . 2]" 1
1625 1 91 LYS H 1 91 LYS HD2 . . 4.750 3.590 2.067 4.765 0.015 12 0 "[ . 1 . 2]" 1
1626 1 91 LYS H 1 91 LYS HD3 . . 4.970 3.964 2.633 4.809 . 0 0 "[ . 1 . 2]" 1
1627 1 91 LYS H 1 91 LYS HG2 . . 4.190 2.684 1.881 4.085 . 0 0 "[ . 1 . 2]" 1
1628 1 91 LYS H 1 91 LYS HG3 . . 4.090 2.879 2.166 3.792 . 0 0 "[ . 1 . 2]" 1
1629 1 91 LYS H 1 92 LEU H . . 3.370 2.302 1.862 2.706 . 0 0 "[ . 1 . 2]" 1
1630 1 91 LYS H 1 93 ASP H . . 5.170 4.096 3.657 4.533 . 0 0 "[ . 1 . 2]" 1
1631 1 91 LYS H 1 108 ALA MB . . 4.920 4.498 4.195 4.935 0.015 1 0 "[ . 1 . 2]" 1
1632 1 91 LYS HA 1 91 LYS HD2 . . 5.280 4.483 3.481 5.500 0.220 8 0 "[ . 1 . 2]" 1
1633 1 91 LYS HA 1 91 LYS HD3 . . 5.450 4.337 2.107 5.161 . 0 0 "[ . 1 . 2]" 1
1634 1 91 LYS HA 1 91 LYS HG3 . . 4.180 3.572 2.431 4.231 0.051 7 0 "[ . 1 . 2]" 1
1635 1 91 LYS HA 1 93 ASP H . . 4.870 3.983 3.591 4.820 . 0 0 "[ . 1 . 2]" 1
1636 1 91 LYS HA 1 94 ARG H . . 4.000 3.544 3.038 3.819 . 0 0 "[ . 1 . 2]" 1
1637 1 91 LYS HA 1 94 ARG HD2 . . 4.750 4.055 3.394 4.684 . 0 0 "[ . 1 . 2]" 1
1638 1 91 LYS HA 1 94 ARG HD3 . . 4.660 4.272 2.682 4.767 0.107 13 0 "[ . 1 . 2]" 1
1639 1 91 LYS HA 1 94 ARG HE . . 5.470 3.916 2.705 5.326 . 0 0 "[ . 1 . 2]" 1
1640 1 91 LYS HA 1 94 ARG HG2 . . 4.200 2.158 1.995 2.451 . 0 0 "[ . 1 . 2]" 1
1641 1 91 LYS HA 1 94 ARG HG3 . . 4.240 2.477 2.135 2.890 . 0 0 "[ . 1 . 2]" 1
1642 1 91 LYS HA 1 107 GLY HA2 . . 4.670 3.867 3.603 4.528 . 0 0 "[ . 1 . 2]" 1
1643 1 91 LYS HA 1 107 GLY HA3 . . 4.540 4.591 3.957 4.761 0.221 14 0 "[ . 1 . 2]" 1
1644 1 91 LYS HA 1 108 ALA H . . 5.440 4.110 3.614 4.456 . 0 0 "[ . 1 . 2]" 1
1645 1 91 LYS HA 1 108 ALA MB . . 5.500 4.323 3.977 4.816 . 0 0 "[ . 1 . 2]" 1
1646 1 91 LYS HB2 1 92 LEU H . . 4.900 3.382 2.845 4.162 . 0 0 "[ . 1 . 2]" 1
1647 1 91 LYS HB2 1 107 GLY HA3 . . 5.290 4.691 2.700 5.819 0.529 18 2 "[ - . 1 . + 2]" 1
1648 1 91 LYS HB2 1 108 ALA H . . 5.310 3.271 2.167 4.391 . 0 0 "[ . 1 . 2]" 1
1649 1 91 LYS HB2 1 108 ALA MB . . 4.050 2.350 1.981 2.784 . 0 0 "[ . 1 . 2]" 1
1650 1 91 LYS HB3 1 92 LEU H . . 4.150 4.166 3.890 4.552 0.402 6 0 "[ . 1 . 2]" 1
1651 1 91 LYS HB3 1 107 GLY HA3 . . 4.760 3.962 3.441 4.764 0.004 16 0 "[ . 1 . 2]" 1
1652 1 91 LYS HB3 1 108 ALA H . . 4.700 3.055 1.934 4.373 . 0 0 "[ . 1 . 2]" 1
1653 1 91 LYS HB3 1 108 ALA MB . . 4.730 2.789 1.967 3.861 . 0 0 "[ . 1 . 2]" 1
1654 1 91 LYS HG3 1 108 ALA H . . 5.500 4.723 3.551 5.989 0.489 1 0 "[ . 1 . 2]" 1
1655 1 92 LEU H 1 92 LEU HB2 . . 3.790 2.219 2.099 2.607 . 0 0 "[ . 1 . 2]" 1
1656 1 92 LEU H 1 92 LEU HB3 . . 3.970 3.495 3.409 3.597 . 0 0 "[ . 1 . 2]" 1
1657 1 92 LEU H 1 92 LEU QD . . 3.700 2.791 2.129 3.499 . 0 0 "[ . 1 . 2]" 1
1658 1 92 LEU H 1 92 LEU HG . . 4.120 3.430 2.274 4.284 0.164 15 0 "[ . 1 . 2]" 1
1659 1 92 LEU H 1 93 ASP H . . 3.460 2.571 2.276 2.694 . 0 0 "[ . 1 . 2]" 1
1660 1 92 LEU H 1 93 ASP QB . . 4.960 4.389 4.122 4.744 . 0 0 "[ . 1 . 2]" 1
1661 1 92 LEU H 1 94 ARG H . . 4.950 3.954 3.632 4.159 . 0 0 "[ . 1 . 2]" 1
1662 1 92 LEU H 1 108 ALA MB . . 4.410 4.232 3.832 4.436 0.026 15 0 "[ . 1 . 2]" 1
1663 1 92 LEU HA 1 92 LEU QD . . 3.110 2.092 1.923 2.272 . 0 0 "[ . 1 . 2]" 1
1664 1 92 LEU HA 1 94 ARG H . . 3.910 3.640 3.391 3.953 0.043 9 0 "[ . 1 . 2]" 1
1665 1 92 LEU HA 1 95 LEU H . . 4.970 4.353 3.719 5.030 0.060 13 0 "[ . 1 . 2]" 1
1666 1 92 LEU HA 1 95 LEU MD1 . . 4.710 3.413 2.299 4.198 . 0 0 "[ . 1 . 2]" 1
1667 1 92 LEU HA 1 95 LEU HG . . 4.580 3.330 2.850 3.999 . 0 0 "[ . 1 . 2]" 1
1668 1 92 LEU HA 1 108 ALA MB . . 4.240 3.745 3.260 4.242 0.002 9 0 "[ . 1 . 2]" 1
1669 1 92 LEU HB2 1 93 ASP H . . 3.650 2.968 2.221 3.292 . 0 0 "[ . 1 . 2]" 1
1670 1 92 LEU HB3 1 93 ASP H . . 4.150 3.525 3.133 3.840 . 0 0 "[ . 1 . 2]" 1
1671 1 92 LEU HB3 1 93 ASP HA . . 4.330 4.187 3.933 4.474 0.144 12 0 "[ . 1 . 2]" 1
1672 1 92 LEU QD 1 93 ASP H . . 4.960 4.080 3.888 4.348 . 0 0 "[ . 1 . 2]" 1
1673 1 92 LEU QD 1 110 PRO HD2 . . 3.860 2.746 2.254 3.346 . 0 0 "[ . 1 . 2]" 1
1674 1 92 LEU QD 1 110 PRO HD3 . . 3.530 2.041 1.872 2.550 . 0 0 "[ . 1 . 2]" 1
1675 1 92 LEU QD 1 110 PRO QG . . 2.970 1.917 1.811 2.237 . 0 0 "[ . 1 . 2]" 1
1676 1 93 ASP H 1 93 ASP QB . . 3.210 2.229 2.104 2.518 . 0 0 "[ . 1 . 2]" 1
1677 1 93 ASP H 1 94 ARG H . . 3.580 2.538 2.207 2.743 . 0 0 "[ . 1 . 2]" 1
1678 1 93 ASP H 1 95 LEU H . . 5.340 4.667 4.250 5.009 . 0 0 "[ . 1 . 2]" 1
1679 1 93 ASP QB 1 94 ARG H . . 4.050 3.303 2.986 3.798 . 0 0 "[ . 1 . 2]" 1
1680 1 94 ARG H 1 94 ARG QB . . 3.090 2.508 2.226 2.603 . 0 0 "[ . 1 . 2]" 1
1681 1 94 ARG H 1 94 ARG HD2 . . 4.360 4.425 3.214 4.971 0.611 2 4 "[ + * *1 .- 2]" 1
1682 1 94 ARG H 1 94 ARG HD3 . . 5.240 4.119 3.731 5.046 . 0 0 "[ . 1 . 2]" 1
1683 1 94 ARG H 1 94 ARG HG2 . . 3.590 2.188 1.945 2.779 . 0 0 "[ . 1 . 2]" 1
1684 1 94 ARG H 1 94 ARG HG3 . . 3.750 3.565 3.273 3.751 0.001 14 0 "[ . 1 . 2]" 1
1685 1 94 ARG H 1 95 LEU H . . 3.630 2.786 2.376 3.031 . 0 0 "[ . 1 . 2]" 1
1686 1 94 ARG H 1 95 LEU HG . . 4.740 3.825 3.044 4.556 . 0 0 "[ . 1 . 2]" 1
1687 1 94 ARG HA 1 94 ARG HD2 . . 3.760 3.292 2.031 4.037 0.277 8 0 "[ . 1 . 2]" 1
1688 1 94 ARG HA 1 94 ARG HE . . 4.240 3.547 2.893 4.242 0.002 11 0 "[ . 1 . 2]" 1
1689 1 94 ARG HA 1 94 ARG HG2 . . 3.920 3.023 2.641 3.224 . 0 0 "[ . 1 . 2]" 1
1690 1 94 ARG HA 1 94 ARG HG3 . . 4.000 3.794 3.677 3.861 . 0 0 "[ . 1 . 2]" 1
1691 1 94 ARG HA 1 95 LEU H . . 3.560 3.339 2.926 3.571 0.011 15 0 "[ . 1 . 2]" 1
1692 1 94 ARG HA 1 97 ASP HB2 . . 4.470 2.723 2.069 3.707 . 0 0 "[ . 1 . 2]" 1
1693 1 94 ARG HA 1 97 ASP HB3 . . 4.810 3.251 2.732 3.809 . 0 0 "[ . 1 . 2]" 1
1694 1 94 ARG QB 1 94 ARG HD2 . . 3.200 2.905 2.378 3.223 0.023 12 0 "[ . 1 . 2]" 1
1695 1 94 ARG QB 1 94 ARG HE . . 4.250 3.429 2.016 4.252 0.002 7 0 "[ . 1 . 2]" 1
1696 1 94 ARG QB 1 95 LEU H . . 4.910 2.946 2.156 3.797 . 0 0 "[ . 1 . 2]" 1
1697 1 95 LEU H 1 95 LEU HB2 . . 3.330 2.715 2.520 2.820 . 0 0 "[ . 1 . 2]" 1
1698 1 95 LEU H 1 95 LEU HB3 . . 3.930 3.640 3.557 3.798 . 0 0 "[ . 1 . 2]" 1
1699 1 95 LEU H 1 95 LEU MD1 . . 4.050 3.729 2.706 4.114 0.064 2 0 "[ . 1 . 2]" 1
1700 1 95 LEU H 1 95 LEU MD2 . . 3.920 2.951 2.306 3.802 . 0 0 "[ . 1 . 2]" 1
1701 1 95 LEU H 1 95 LEU HG . . 3.380 2.268 1.931 3.041 . 0 0 "[ . 1 . 2]" 1
1702 1 95 LEU H 1 96 ALA H . . 3.780 2.456 1.865 2.817 . 0 0 "[ . 1 . 2]" 1
1703 1 95 LEU H 1 96 ALA MB . . 5.280 4.237 3.608 4.595 . 0 0 "[ . 1 . 2]" 1
1704 1 95 LEU H 1 97 ASP HB2 . . 5.500 4.641 3.904 5.166 . 0 0 "[ . 1 . 2]" 1
1705 1 95 LEU HA 1 95 LEU MD1 . . 4.420 3.861 3.790 3.979 . 0 0 "[ . 1 . 2]" 1
1706 1 95 LEU HA 1 95 LEU MD2 . . 3.150 2.231 2.019 3.025 . 0 0 "[ . 1 . 2]" 1
1707 1 95 LEU HA 1 96 ALA HA . . 5.270 4.575 4.501 4.636 . 0 0 "[ . 1 . 2]" 1
1708 1 95 LEU HA 1 96 ALA MB . . 5.500 4.894 4.794 4.977 . 0 0 "[ . 1 . 2]" 1
1709 1 95 LEU HA 1 97 ASP H . . 4.650 3.829 3.643 4.272 . 0 0 "[ . 1 . 2]" 1
1710 1 95 LEU HB2 1 95 LEU MD1 . . 3.470 2.347 1.886 2.486 . 0 0 "[ . 1 . 2]" 1
1711 1 95 LEU HB2 1 96 ALA H . . 3.950 2.875 2.405 3.363 . 0 0 "[ . 1 . 2]" 1
1712 1 95 LEU HB2 1 96 ALA MB . . 5.280 3.605 3.337 3.807 . 0 0 "[ . 1 . 2]" 1
1713 1 95 LEU HB2 1 97 ASP H . . 5.120 4.905 4.659 5.122 0.002 2 0 "[ . 1 . 2]" 1
1714 1 95 LEU HB3 1 96 ALA H . . 4.330 3.979 3.435 4.268 . 0 0 "[ . 1 . 2]" 1
1715 1 95 LEU MD1 1 109 TYR HA . . 3.600 2.448 2.050 3.064 . 0 0 "[ . 1 . 2]" 1
1716 1 95 LEU MD1 1 109 TYR QD . . 3.030 2.910 2.452 3.130 0.100 14 0 "[ . 1 . 2]" 1
1717 1 95 LEU MD1 1 109 TYR QE . . 3.450 3.078 2.571 3.457 0.007 14 0 "[ . 1 . 2]" 1
1718 1 95 LEU MD2 1 108 ALA HA . . 5.290 5.036 4.709 5.320 0.030 17 0 "[ . 1 . 2]" 1
1719 1 95 LEU MD2 1 109 TYR HA . . 4.200 2.610 2.073 3.107 . 0 0 "[ . 1 . 2]" 1
1720 1 95 LEU MD2 1 109 TYR HB2 . . 5.180 2.868 2.537 3.443 . 0 0 "[ . 1 . 2]" 1
1721 1 95 LEU MD2 1 109 TYR HB3 . . 4.540 4.042 3.695 4.574 0.034 15 0 "[ . 1 . 2]" 1
1722 1 95 LEU MD2 1 109 TYR QD . . 3.670 2.460 1.962 3.272 . 0 0 "[ . 1 . 2]" 1
1723 1 95 LEU MD2 1 109 TYR QE . . 4.160 2.886 2.460 3.497 . 0 0 "[ . 1 . 2]" 1
1724 1 95 LEU HG 1 96 ALA H . . 4.980 4.155 3.867 4.447 . 0 0 "[ . 1 . 2]" 1
1725 1 95 LEU HG 1 96 ALA MB . . 5.500 5.298 5.026 5.554 0.054 10 0 "[ . 1 . 2]" 1
1726 1 96 ALA H 1 96 ALA MB . . 2.780 2.314 2.152 2.422 . 0 0 "[ . 1 . 2]" 1
1727 1 96 ALA H 1 97 ASP H . . 3.120 2.515 1.884 2.911 . 0 0 "[ . 1 . 2]" 1
1728 1 96 ALA H 1 97 ASP HA . . 5.500 4.866 4.550 5.072 . 0 0 "[ . 1 . 2]" 1
1729 1 96 ALA H 1 97 ASP HB2 . . 5.280 3.776 3.601 3.967 . 0 0 "[ . 1 . 2]" 1
1730 1 96 ALA MB 1 97 ASP H . . 4.100 3.518 3.136 3.660 . 0 0 "[ . 1 . 2]" 1
1731 1 97 ASP H 1 97 ASP HB2 . . 3.190 2.577 2.150 2.819 . 0 0 "[ . 1 . 2]" 1
1732 1 97 ASP H 1 97 ASP HB3 . . 3.310 3.254 3.114 3.351 0.041 17 0 "[ . 1 . 2]" 1
1733 1 97 ASP H 1 98 GLU H . . 4.490 4.366 4.314 4.450 . 0 0 "[ . 1 . 2]" 1
1734 1 97 ASP HA 1 98 GLU H . . 2.930 2.700 2.610 2.763 . 0 0 "[ . 1 . 2]" 1
1735 1 97 ASP HB3 1 98 GLU H . . 3.330 2.233 2.095 2.513 . 0 0 "[ . 1 . 2]" 1
1736 1 98 GLU H 1 98 GLU HB2 . . 3.780 2.498 2.377 2.539 . 0 0 "[ . 1 . 2]" 1
1737 1 98 GLU H 1 98 GLU HB3 . . 3.660 3.653 3.591 3.681 0.021 18 0 "[ . 1 . 2]" 1
1738 1 98 GLU H 1 98 GLU HG2 . . 4.220 3.919 3.759 4.030 . 0 0 "[ . 1 . 2]" 1
1739 1 98 GLU H 1 98 GLU HG3 . . 3.850 2.545 2.340 2.740 . 0 0 "[ . 1 . 2]" 1
1740 1 98 GLU H 1 99 ILE H . . 5.330 4.512 4.464 4.590 . 0 0 "[ . 1 . 2]" 1
1741 1 98 GLU HA 1 98 GLU HG2 . . 3.740 2.803 2.678 2.871 . 0 0 "[ . 1 . 2]" 1
1742 1 98 GLU HA 1 98 GLU HG3 . . 3.660 2.823 2.748 2.892 . 0 0 "[ . 1 . 2]" 1
1743 1 98 GLU HA 1 99 ILE H . . 3.040 2.543 2.371 2.638 . 0 0 "[ . 1 . 2]" 1
1744 1 98 GLU HA 1 99 ILE MD . . 3.820 3.729 3.415 4.336 0.516 11 1 "[ . 1+ . 2]" 1
1745 1 98 GLU HB2 1 99 ILE H . . 3.820 3.322 3.116 3.599 . 0 0 "[ . 1 . 2]" 1
1746 1 98 GLU HG2 1 99 ILE H . . 4.660 4.003 3.762 4.226 . 0 0 "[ . 1 . 2]" 1
1747 1 98 GLU HG3 1 99 ILE H . . 4.650 4.623 4.499 4.781 0.131 10 0 "[ . 1 . 2]" 1
1748 1 99 ILE H 1 99 ILE HB . . 4.100 3.468 3.019 3.719 . 0 0 "[ . 1 . 2]" 1
1749 1 99 ILE H 1 99 ILE MD . . 3.110 2.075 1.870 3.217 0.107 13 0 "[ . 1 . 2]" 1
1750 1 99 ILE H 1 100 ASN H . . 5.500 4.468 4.408 4.512 . 0 0 "[ . 1 . 2]" 1
1751 1 99 ILE HA 1 99 ILE MD . . 3.760 3.685 3.557 4.056 0.296 11 0 "[ . 1 . 2]" 1
1752 1 99 ILE HA 1 100 ASN H . . 3.260 2.542 2.459 2.698 . 0 0 "[ . 1 . 2]" 1
1753 1 99 ILE HA 1 100 ASN HD21 . . 5.500 4.137 3.152 5.053 . 0 0 "[ . 1 . 2]" 1
1754 1 99 ILE HB 1 99 ILE MD . . 2.880 2.341 2.148 2.782 . 0 0 "[ . 1 . 2]" 1
1755 1 99 ILE MD 1 100 ASN H . . 4.480 3.849 3.543 4.490 0.010 13 0 "[ . 1 . 2]" 1
1756 1 99 ILE QG 1 100 ASN H . . 4.550 4.089 3.354 4.322 . 0 0 "[ . 1 . 2]" 1
1757 1 100 ASN H 1 100 ASN HB2 . . 3.660 2.460 2.317 2.708 . 0 0 "[ . 1 . 2]" 1
1758 1 100 ASN H 1 100 ASN HB3 . . 3.810 3.599 3.449 3.798 . 0 0 "[ . 1 . 2]" 1
1759 1 100 ASN H 1 100 ASN HD21 . . 4.340 3.540 2.775 4.134 . 0 0 "[ . 1 . 2]" 1
1760 1 100 ASN H 1 100 ASN HD22 . . 4.770 4.718 4.430 4.870 0.100 10 0 "[ . 1 . 2]" 1
1761 1 100 ASN H 1 101 PRO QD . . 5.500 3.547 3.392 3.638 . 0 0 "[ . 1 . 2]" 1
1762 1 100 ASN H 1 103 GLU H . . 5.500 5.352 5.261 5.480 . 0 0 "[ . 1 . 2]" 1
1763 1 100 ASN H 1 103 GLU HB3 . . 4.500 4.950 4.848 5.061 0.561 15 7 "[ *. * - *+* * 2]" 1
1764 1 100 ASN HA 1 101 PRO HG2 . . 4.390 4.134 4.126 4.148 . 0 0 "[ . 1 . 2]" 1
1765 1 100 ASN HB2 1 103 GLU HB2 . . 4.720 3.989 3.772 4.223 . 0 0 "[ . 1 . 2]" 1
1766 1 100 ASN HB2 1 105 ILE MG . . 5.500 3.191 2.394 4.079 . 0 0 "[ . 1 . 2]" 1
1767 1 100 ASN HB3 1 103 GLU HB2 . . 4.730 2.522 2.156 2.955 . 0 0 "[ . 1 . 2]" 1
1768 1 100 ASN HD21 1 101 PRO QD . . 5.500 3.478 3.146 3.863 . 0 0 "[ . 1 . 2]" 1
1769 1 100 ASN HD21 1 103 GLU HB2 . . 5.500 5.305 4.807 5.621 0.121 5 0 "[ . 1 . 2]" 1
1770 1 100 ASN HD21 1 103 GLU HB3 . . 5.500 5.003 4.667 5.291 . 0 0 "[ . 1 . 2]" 1
1771 1 100 ASN HD22 1 101 PRO QD . . 5.500 4.657 4.520 4.883 . 0 0 "[ . 1 . 2]" 1
1772 1 100 ASN HD22 1 103 GLU HB3 . . 5.500 5.460 5.315 5.577 0.077 13 0 "[ . 1 . 2]" 1
1773 1 100 ASN HD22 1 105 ILE MG . . 5.390 4.877 4.344 5.402 0.012 10 0 "[ . 1 . 2]" 1
1774 1 101 PRO HA 1 102 GLY H . . 3.080 2.242 2.193 2.319 . 0 0 "[ . 1 . 2]" 1
1775 1 101 PRO HA 1 103 GLU H . . 4.100 3.751 3.665 3.864 . 0 0 "[ . 1 . 2]" 1
1776 1 101 PRO HB2 1 102 GLY H . . 4.390 4.040 3.927 4.166 . 0 0 "[ . 1 . 2]" 1
1777 1 102 GLY H 1 103 GLU H . . 3.480 2.052 1.939 2.192 . 0 0 "[ . 1 . 2]" 1
1778 1 102 GLY H 1 103 GLU HB2 . . 5.500 4.724 4.424 5.071 . 0 0 "[ . 1 . 2]" 1
1779 1 102 GLY H 1 103 GLU HB3 . . 5.500 4.731 4.519 5.044 . 0 0 "[ . 1 . 2]" 1
1780 1 103 GLU H 1 103 GLU HB2 . . 3.400 2.857 2.659 3.132 . 0 0 "[ . 1 . 2]" 1
1781 1 103 GLU H 1 103 GLU HB3 . . 3.230 2.794 2.560 2.999 . 0 0 "[ . 1 . 2]" 1
1782 1 103 GLU H 1 103 GLU HG3 . . 4.670 4.532 4.380 4.598 . 0 0 "[ . 1 . 2]" 1
1783 1 103 GLU H 1 104 THR H . . 4.970 4.455 4.332 4.507 . 0 0 "[ . 1 . 2]" 1
1784 1 103 GLU H 1 104 THR HA . . 5.090 4.933 4.846 4.981 . 0 0 "[ . 1 . 2]" 1
1785 1 103 GLU HA 1 104 THR H . . 2.770 2.494 2.334 2.747 . 0 0 "[ . 1 . 2]" 1
1786 1 103 GLU HA 1 104 THR HA . . 4.690 4.418 4.362 4.520 . 0 0 "[ . 1 . 2]" 1
1787 1 103 GLU HA 1 104 THR HB . . 4.700 4.599 4.405 4.708 0.008 2 0 "[ . 1 . 2]" 1
1788 1 103 GLU HB2 1 104 THR H . . 4.140 3.800 3.589 3.882 . 0 0 "[ . 1 . 2]" 1
1789 1 103 GLU HB3 1 104 THR H . . 3.830 3.184 2.414 3.762 . 0 0 "[ . 1 . 2]" 1
1790 1 103 GLU HB3 1 105 ILE MG . . 3.890 2.969 2.705 3.644 . 0 0 "[ . 1 . 2]" 1
1791 1 103 GLU HG2 1 104 THR H . . 3.620 2.546 1.964 3.658 0.038 11 0 "[ . 1 . 2]" 1
1792 1 103 GLU HG2 1 104 THR HA . . 5.420 4.806 4.237 5.711 0.291 5 0 "[ . 1 . 2]" 1
1793 1 103 GLU HG2 1 105 ILE MG . . 3.850 2.486 1.917 3.344 . 0 0 "[ . 1 . 2]" 1
1794 1 103 GLU HG3 1 104 THR H . . 3.840 2.051 1.899 2.408 . 0 0 "[ . 1 . 2]" 1
1795 1 103 GLU HG3 1 104 THR HA . . 4.980 4.731 3.846 5.241 0.261 10 0 "[ . 1 . 2]" 1
1796 1 103 GLU HG3 1 105 ILE MG . . 4.180 3.518 1.937 4.212 0.032 15 0 "[ . 1 . 2]" 1
1797 1 104 THR H 1 104 THR HB . . 3.250 2.990 2.516 3.337 0.087 14 0 "[ . 1 . 2]" 1
1798 1 104 THR H 1 104 THR MG . . 4.200 2.618 1.902 3.864 . 0 0 "[ . 1 . 2]" 1
1799 1 104 THR H 1 105 ILE H . . 4.690 4.052 3.689 4.275 . 0 0 "[ . 1 . 2]" 1
1800 1 104 THR H 1 105 ILE HA . . 5.220 5.079 4.881 5.240 0.020 1 0 "[ . 1 . 2]" 1
1801 1 104 THR HA 1 104 THR MG . . 3.290 2.884 2.314 3.187 . 0 0 "[ . 1 . 2]" 1
1802 1 104 THR HA 1 105 ILE H . . 3.000 2.197 2.142 2.326 . 0 0 "[ . 1 . 2]" 1
1803 1 104 THR HA 1 105 ILE MG . . 3.980 3.841 3.586 4.001 0.021 5 0 "[ . 1 . 2]" 1
1804 1 104 THR HB 1 105 ILE H . . 4.620 4.409 4.262 4.548 . 0 0 "[ . 1 . 2]" 1
1805 1 105 ILE H 1 105 ILE HB . . 3.990 3.913 3.834 3.951 . 0 0 "[ . 1 . 2]" 1
1806 1 105 ILE H 1 105 ILE MD . . 3.920 3.848 3.520 3.969 0.049 8 0 "[ . 1 . 2]" 1
1807 1 105 ILE H 1 105 ILE HG12 . . 3.820 3.510 3.185 3.615 . 0 0 "[ . 1 . 2]" 1
1808 1 105 ILE H 1 105 ILE HG13 . . 4.130 2.303 2.089 2.416 . 0 0 "[ . 1 . 2]" 1
1809 1 105 ILE H 1 105 ILE MG . . 3.620 2.928 2.791 3.017 . 0 0 "[ . 1 . 2]" 1
1810 1 105 ILE H 1 106 GLN H . . 4.940 4.357 4.334 4.404 . 0 0 "[ . 1 . 2]" 1
1811 1 105 ILE HA 1 106 GLN H . . 3.040 2.676 2.587 2.713 . 0 0 "[ . 1 . 2]" 1
1812 1 105 ILE HA 1 106 GLN HB3 . . 4.750 4.587 4.128 5.609 0.859 13 4 "[ .* 1 + .* -2]" 1
1813 1 105 ILE HA 1 106 GLN HE21 . . 5.080 4.444 3.346 5.314 0.234 8 0 "[ . 1 . 2]" 1
1814 1 105 ILE HA 1 106 GLN HG2 . . 4.430 3.798 3.247 4.427 . 0 0 "[ . 1 . 2]" 1
1815 1 105 ILE HB 1 106 GLN H . . 3.360 1.955 1.934 2.027 . 0 0 "[ . 1 . 2]" 1
1816 1 105 ILE MD 1 106 GLN H . . 3.850 2.285 1.985 2.627 . 0 0 "[ . 1 . 2]" 1
1817 1 105 ILE MD 1 106 GLN HB2 . . 5.470 4.642 4.345 4.999 . 0 0 "[ . 1 . 2]" 1
1818 1 105 ILE MD 1 107 GLY H . . 4.500 4.311 4.095 4.502 0.002 13 0 "[ . 1 . 2]" 1
1819 1 105 ILE MD 1 107 GLY HA2 . . 4.480 4.426 4.156 4.614 0.134 8 0 "[ . 1 . 2]" 1
1820 1 105 ILE MD 1 107 GLY HA3 . . 4.370 4.079 3.878 4.272 . 0 0 "[ . 1 . 2]" 1
1821 1 105 ILE HG12 1 105 ILE MG . . 3.320 2.096 1.956 2.173 . 0 0 "[ . 1 . 2]" 1
1822 1 105 ILE HG13 1 105 ILE MG . . 3.040 2.842 2.764 2.968 . 0 0 "[ . 1 . 2]" 1
1823 1 105 ILE HG13 1 106 GLN H . . 4.960 3.531 3.333 3.904 . 0 0 "[ . 1 . 2]" 1
1824 1 105 ILE MG 1 106 GLN H . . 3.980 3.599 3.546 3.647 . 0 0 "[ . 1 . 2]" 1
1825 1 106 GLN H 1 106 GLN HB2 . . 3.980 3.725 2.912 3.994 0.014 17 0 "[ . 1 . 2]" 1
1826 1 106 GLN H 1 106 GLN HE21 . . 5.500 4.457 3.606 5.267 . 0 0 "[ . 1 . 2]" 1
1827 1 106 GLN H 1 106 GLN HG2 . . 3.780 2.790 2.211 3.789 0.009 16 0 "[ . 1 . 2]" 1
1828 1 106 GLN H 1 106 GLN HG3 . . 3.680 3.241 2.405 3.689 0.009 20 0 "[ . 1 . 2]" 1
1829 1 106 GLN H 1 107 GLY H . . 4.850 4.360 4.329 4.421 . 0 0 "[ . 1 . 2]" 1
1830 1 106 GLN HA 1 106 GLN HE21 . . 5.500 4.992 4.118 5.363 . 0 0 "[ . 1 . 2]" 1
1831 1 106 GLN HA 1 106 GLN HG3 . . 3.940 3.708 3.353 3.972 0.032 20 0 "[ . 1 . 2]" 1
1832 1 106 GLN HA 1 107 GLY H . . 3.030 2.653 2.520 2.729 . 0 0 "[ . 1 . 2]" 1
1833 1 106 GLN HB2 1 107 GLY H . . 4.310 2.190 1.935 3.138 . 0 0 "[ . 1 . 2]" 1
1834 1 106 GLN HB3 1 106 GLN HE21 . . 4.180 3.126 2.077 4.443 0.263 16 0 "[ . 1 . 2]" 1
1835 1 106 GLN HG2 1 107 GLY H . . 5.480 4.250 3.765 4.831 . 0 0 "[ . 1 . 2]" 1
1836 1 107 GLY H 1 108 ALA H . . 4.720 4.275 4.039 4.384 . 0 0 "[ . 1 . 2]" 1
1837 1 107 GLY HA2 1 108 ALA H . . 3.560 2.800 2.565 3.089 . 0 0 "[ . 1 . 2]" 1
1838 1 107 GLY HA2 1 108 ALA MB . . 4.720 3.851 3.738 3.974 . 0 0 "[ . 1 . 2]" 1
1839 1 107 GLY HA3 1 108 ALA MB . . 4.840 4.285 4.102 4.451 . 0 0 "[ . 1 . 2]" 1
1840 1 108 ALA H 1 109 TYR H . . 5.360 4.407 4.345 4.486 . 0 0 "[ . 1 . 2]" 1
1841 1 108 ALA HA 1 109 TYR H . . 3.130 2.527 2.311 2.717 . 0 0 "[ . 1 . 2]" 1
1842 1 108 ALA MB 1 109 TYR H . . 3.540 2.236 1.999 2.634 . 0 0 "[ . 1 . 2]" 1
1843 1 109 TYR H 1 109 TYR HB2 . . 4.190 3.224 2.889 3.367 . 0 0 "[ . 1 . 2]" 1
1844 1 109 TYR H 1 109 TYR HB3 . . 3.960 3.253 3.009 3.385 . 0 0 "[ . 1 . 2]" 1
1845 1 109 TYR H 1 109 TYR QD . . 5.500 4.436 4.336 4.506 . 0 0 "[ . 1 . 2]" 1
1846 1 109 TYR HA 1 109 TYR QD . . 3.780 2.697 2.076 3.061 . 0 0 "[ . 1 . 2]" 1
1847 1 109 TYR HA 1 110 PRO HD2 . . 3.690 1.963 1.926 2.050 . 0 0 "[ . 1 . 2]" 1
1848 1 109 TYR HA 1 110 PRO HD3 . . 3.320 2.708 2.609 2.874 . 0 0 "[ . 1 . 2]" 1
1849 1 109 TYR HB3 1 111 TYR QE . . 3.840 2.837 2.063 3.931 0.091 1 0 "[ . 1 . 2]" 1
1850 1 109 TYR QD 1 110 PRO HA . . 4.540 4.353 4.258 4.515 . 0 0 "[ . 1 . 2]" 1
1851 1 109 TYR QD 1 110 PRO HD2 . . 5.170 3.318 2.446 3.961 . 0 0 "[ . 1 . 2]" 1
1852 1 109 TYR QD 1 110 PRO HD3 . . 5.500 4.451 3.854 4.859 . 0 0 "[ . 1 . 2]" 1
1853 1 111 TYR H 1 111 TYR HB2 . . 4.100 2.675 2.358 3.745 . 0 0 "[ . 1 . 2]" 1
1854 1 111 TYR H 1 111 TYR HB3 . . 3.850 3.692 3.229 3.890 0.040 17 0 "[ . 1 . 2]" 1
1855 1 111 TYR H 1 111 TYR QD . . 4.100 3.015 2.692 3.617 . 0 0 "[ . 1 . 2]" 1
1856 1 111 TYR HA 1 112 GLU H . . 3.260 2.451 2.178 2.639 . 0 0 "[ . 1 . 2]" 1
1857 1 111 TYR HA 1 112 GLU QB . . 4.590 4.393 4.216 4.608 0.018 15 0 "[ . 1 . 2]" 1
1858 1 111 TYR HB2 1 112 GLU H . . 4.420 3.465 2.089 4.234 . 0 0 "[ . 1 . 2]" 1
1859 1 111 TYR HB3 1 112 GLU H . . 4.640 2.476 1.974 3.481 . 0 0 "[ . 1 . 2]" 1
1860 1 111 TYR QD 1 112 GLU H . . 4.540 3.587 3.306 3.938 . 0 0 "[ . 1 . 2]" 1
1861 1 112 GLU H 1 112 GLU QB . . 3.380 2.139 2.041 2.682 . 0 0 "[ . 1 . 2]" 1
1862 1 112 GLU H 1 112 GLU QG . . 4.300 3.140 2.056 3.845 . 0 0 "[ . 1 . 2]" 1
1863 1 112 GLU H 1 113 PHE H . . 5.250 4.463 4.286 4.617 . 0 0 "[ . 1 . 2]" 1
1864 1 112 GLU HA 1 113 PHE H . . 3.250 2.156 2.138 2.214 . 0 0 "[ . 1 . 2]" 1
1865 1 112 GLU HA 1 113 PHE QD . . 5.210 5.282 4.977 5.570 0.360 17 0 "[ . 1 . 2]" 1
1866 1 112 GLU QB 1 113 PHE H . . 4.640 3.501 3.312 3.702 . 0 0 "[ . 1 . 2]" 1
1867 1 112 GLU QG 1 113 PHE H . . 4.350 3.603 2.711 4.528 0.178 15 0 "[ . 1 . 2]" 1
1868 1 112 GLU QG 1 114 ILE MD . . 3.580 2.134 1.872 3.459 . 0 0 "[ . 1 . 2]" 1
1869 1 113 PHE H 1 113 PHE HB2 . . 3.640 2.444 2.194 2.744 . 0 0 "[ . 1 . 2]" 1
1870 1 113 PHE H 1 113 PHE HB3 . . 3.980 3.022 2.888 3.143 . 0 0 "[ . 1 . 2]" 1
1871 1 113 PHE H 1 113 PHE QD . . 4.330 4.012 3.668 4.257 . 0 0 "[ . 1 . 2]" 1
1872 1 113 PHE H 1 114 ILE H . . 5.260 2.355 2.142 2.609 . 0 0 "[ . 1 . 2]" 1
1873 1 113 PHE HA 1 113 PHE QD . . 3.430 2.200 1.931 2.317 . 0 0 "[ . 1 . 2]" 1
1874 1 113 PHE HA 1 113 PHE QE . . 4.720 4.177 4.127 4.238 . 0 0 "[ . 1 . 2]" 1
1875 1 113 PHE HA 1 114 ILE H . . 3.150 3.168 3.110 3.208 0.058 8 0 "[ . 1 . 2]" 1
1876 1 113 PHE HA 1 115 ASN H . . 4.020 3.406 3.286 3.658 . 0 0 "[ . 1 . 2]" 1
1877 1 113 PHE HB2 1 114 ILE H . . 5.160 4.155 4.076 4.301 . 0 0 "[ . 1 . 2]" 1
1878 1 113 PHE HB3 1 114 ILE H . . 4.270 3.819 3.750 3.920 . 0 0 "[ . 1 . 2]" 1
1879 1 113 PHE HB3 1 116 GLU H . . 5.250 4.743 4.328 5.035 . 0 0 "[ . 1 . 2]" 1
1880 1 113 PHE HB3 1 116 GLU HB3 . . 5.480 3.667 3.167 4.049 . 0 0 "[ . 1 . 2]" 1
1881 1 113 PHE QD 1 116 GLU HA . . 3.900 3.838 3.584 3.935 0.035 13 0 "[ . 1 . 2]" 1
1882 1 113 PHE QD 1 116 GLU HB2 . . 4.880 3.682 3.178 4.387 . 0 0 "[ . 1 . 2]" 1
1883 1 113 PHE QD 1 116 GLU HB3 . . 4.660 2.759 2.334 3.267 . 0 0 "[ . 1 . 2]" 1
1884 1 113 PHE QD 1 120 VAL QG . . 3.830 3.515 3.207 3.731 . 0 0 "[ . 1 . 2]" 1
1885 1 113 PHE QE 1 116 GLU HA . . 4.060 3.803 3.433 4.079 0.019 15 0 "[ . 1 . 2]" 1
1886 1 113 PHE QE 1 116 GLU HB3 . . 4.760 3.720 3.202 4.451 . 0 0 "[ . 1 . 2]" 1
1887 1 113 PHE QE 1 120 VAL QG . . 3.410 2.471 1.959 3.071 . 0 0 "[ . 1 . 2]" 1
1888 1 113 PHE QE 1 142 ILE H . . 5.320 4.366 3.470 5.441 0.121 12 0 "[ . 1 . 2]" 1
1889 1 113 PHE QE 1 142 ILE HA . . 5.380 5.265 4.521 5.479 0.099 16 0 "[ . 1 . 2]" 1
1890 1 113 PHE QE 1 142 ILE HB . . 4.100 2.927 2.078 3.556 . 0 0 "[ . 1 . 2]" 1
1891 1 113 PHE QE 1 142 ILE MD . . 3.960 3.370 2.777 4.089 0.129 12 0 "[ . 1 . 2]" 1
1892 1 113 PHE QE 1 142 ILE MG . . 4.190 3.598 2.722 4.201 0.011 10 0 "[ . 1 . 2]" 1
1893 1 114 ILE H 1 114 ILE HB . . 3.500 2.661 2.622 2.742 . 0 0 "[ . 1 . 2]" 1
1894 1 114 ILE H 1 114 ILE MD . . 4.180 3.075 2.268 3.564 . 0 0 "[ . 1 . 2]" 1
1895 1 114 ILE H 1 114 ILE HG12 . . 4.570 3.448 3.147 3.637 . 0 0 "[ . 1 . 2]" 1
1896 1 114 ILE H 1 114 ILE HG13 . . 4.160 1.989 1.931 2.208 . 0 0 "[ . 1 . 2]" 1
1897 1 114 ILE H 1 114 ILE MG . . 3.930 3.771 3.762 3.776 . 0 0 "[ . 1 . 2]" 1
1898 1 114 ILE H 1 115 ASN H . . 3.370 2.888 2.824 2.946 . 0 0 "[ . 1 . 2]" 1
1899 1 114 ILE H 1 115 ASN HA . . 5.500 5.461 5.418 5.497 . 0 0 "[ . 1 . 2]" 1
1900 1 114 ILE HA 1 114 ILE MD . . 3.910 3.840 3.686 3.881 . 0 0 "[ . 1 . 2]" 1
1901 1 114 ILE HA 1 114 ILE HG12 . . 3.450 2.832 2.511 3.333 . 0 0 "[ . 1 . 2]" 1
1902 1 114 ILE HA 1 114 ILE HG13 . . 3.780 2.714 2.433 3.055 . 0 0 "[ . 1 . 2]" 1
1903 1 114 ILE HA 1 114 ILE MG . . 3.030 2.347 2.303 2.397 . 0 0 "[ . 1 . 2]" 1
1904 1 114 ILE HA 1 115 ASN HA . . 4.890 4.633 4.581 4.663 . 0 0 "[ . 1 . 2]" 1
1905 1 114 ILE HB 1 115 ASN H . . 3.590 2.754 2.544 2.877 . 0 0 "[ . 1 . 2]" 1
1906 1 114 ILE HG12 1 114 ILE MG . . 2.880 2.240 2.105 2.409 . 0 0 "[ . 1 . 2]" 1
1907 1 114 ILE HG12 1 115 ASN H . . 5.300 5.153 4.930 5.281 . 0 0 "[ . 1 . 2]" 1
1908 1 114 ILE MG 1 115 ASN H . . 3.750 3.567 3.456 3.722 . 0 0 "[ . 1 . 2]" 1
1909 1 114 ILE MG 1 115 ASN QB . . 4.500 4.459 4.047 4.602 0.102 17 0 "[ . 1 . 2]" 1
1910 1 114 ILE MG 1 115 ASN HD21 . . 5.500 4.557 3.138 5.530 0.030 14 0 "[ . 1 . 2]" 1
1911 1 115 ASN H 1 115 ASN QB . . 3.540 2.272 2.197 2.428 . 0 0 "[ . 1 . 2]" 1
1912 1 115 ASN H 1 115 ASN HD22 . . 5.500 5.054 4.619 5.394 . 0 0 "[ . 1 . 2]" 1
1913 1 115 ASN H 1 116 GLU H . . 4.650 3.222 2.945 3.408 . 0 0 "[ . 1 . 2]" 1
1914 1 115 ASN H 1 116 GLU HA . . 5.500 4.720 4.536 4.824 . 0 0 "[ . 1 . 2]" 1
1915 1 115 ASN H 1 118 LYS H . . 5.390 5.430 5.358 5.515 0.125 11 0 "[ . 1 . 2]" 1
1916 1 115 ASN HA 1 115 ASN HD21 . . 4.060 2.419 1.903 3.495 . 0 0 "[ . 1 . 2]" 1
1917 1 115 ASN HA 1 115 ASN HD22 . . 4.530 3.536 3.195 4.023 . 0 0 "[ . 1 . 2]" 1
1918 1 115 ASN HA 1 116 GLU H . . 3.090 2.725 2.639 2.824 . 0 0 "[ . 1 . 2]" 1
1919 1 115 ASN HA 1 117 ASN H . . 3.400 3.202 2.997 3.419 0.019 20 0 "[ . 1 . 2]" 1
1920 1 115 ASN HA 1 118 LYS H . . 3.590 3.567 3.305 3.722 0.132 2 0 "[ . 1 . 2]" 1
1921 1 115 ASN QB 1 115 ASN HD22 . . 3.460 3.359 3.238 3.444 . 0 0 "[ . 1 . 2]" 1
1922 1 115 ASN QB 1 116 GLU H . . 4.500 3.885 3.848 3.910 . 0 0 "[ . 1 . 2]" 1
1923 1 115 ASN QB 1 117 ASN H . . 5.330 4.219 3.881 4.517 . 0 0 "[ . 1 . 2]" 1
1924 1 115 ASN QB 1 118 LYS H . . 3.590 3.034 2.863 3.401 . 0 0 "[ . 1 . 2]" 1
1925 1 115 ASN QB 1 118 LYS HB2 . . 3.930 2.062 1.962 2.809 . 0 0 "[ . 1 . 2]" 1
1926 1 115 ASN QB 1 118 LYS HB3 . . 4.650 3.675 3.506 4.444 . 0 0 "[ . 1 . 2]" 1
1927 1 115 ASN QB 1 118 LYS HD3 . . 5.470 5.118 4.837 5.515 0.045 2 0 "[ . 1 . 2]" 1
1928 1 115 ASN QB 1 118 LYS HG2 . . 3.960 3.140 2.788 3.783 . 0 0 "[ . 1 . 2]" 1
1929 1 115 ASN QB 1 118 LYS HG3 . . 4.830 3.227 2.332 3.971 . 0 0 "[ . 1 . 2]" 1
1930 1 115 ASN HD21 1 117 ASN H . . 5.500 4.690 3.847 5.480 . 0 0 "[ . 1 . 2]" 1
1931 1 115 ASN HD21 1 118 LYS HD3 . . 5.500 4.912 4.327 6.253 0.753 2 1 "[ + . 1 . 2]" 1
1932 1 115 ASN HD21 1 118 LYS HG2 . . 5.090 2.756 2.095 4.099 . 0 0 "[ . 1 . 2]" 1
1933 1 115 ASN HD21 1 118 LYS HG3 . . 5.260 2.724 1.945 4.768 . 0 0 "[ . 1 . 2]" 1
1934 1 115 ASN HD22 1 118 LYS HB2 . . 5.230 4.624 3.659 5.228 . 0 0 "[ . 1 . 2]" 1
1935 1 115 ASN HD22 1 118 LYS QE . . 4.810 4.269 3.688 4.816 0.006 15 0 "[ . 1 . 2]" 1
1936 1 115 ASN HD22 1 118 LYS HG2 . . 5.180 4.091 3.526 4.823 . 0 0 "[ . 1 . 2]" 1
1937 1 115 ASN HD22 1 118 LYS HG3 . . 5.470 3.529 3.027 4.269 . 0 0 "[ . 1 . 2]" 1
1938 1 116 GLU H 1 116 GLU HB2 . . 3.990 3.585 3.575 3.592 . 0 0 "[ . 1 . 2]" 1
1939 1 116 GLU H 1 116 GLU HB3 . . 3.670 2.585 2.401 2.729 . 0 0 "[ . 1 . 2]" 1
1940 1 116 GLU H 1 116 GLU QG . . 3.600 2.336 2.008 3.077 . 0 0 "[ . 1 . 2]" 1
1941 1 116 GLU H 1 117 ASN H . . 3.540 2.683 2.582 2.753 . 0 0 "[ . 1 . 2]" 1
1942 1 116 GLU H 1 117 ASN HD21 . . 5.500 3.623 3.390 4.468 . 0 0 "[ . 1 . 2]" 1
1943 1 116 GLU H 1 117 ASN HD22 . . 5.110 3.848 3.717 3.997 . 0 0 "[ . 1 . 2]" 1
1944 1 116 GLU H 1 118 LYS H . . 4.780 4.103 3.936 4.263 . 0 0 "[ . 1 . 2]" 1
1945 1 116 GLU HB2 1 117 ASN H . . 5.350 3.890 3.603 4.097 . 0 0 "[ . 1 . 2]" 1
1946 1 116 GLU HB3 1 117 ASN H . . 5.100 4.094 3.948 4.304 . 0 0 "[ . 1 . 2]" 1
1947 1 116 GLU QG 1 117 ASN H . . 4.040 2.169 1.913 2.488 . 0 0 "[ . 1 . 2]" 1
1948 1 116 GLU QG 1 117 ASN HB3 . . 5.250 3.917 3.326 4.915 . 0 0 "[ . 1 . 2]" 1
1949 1 116 GLU QG 1 117 ASN HD21 . . 5.140 2.534 2.179 3.459 . 0 0 "[ . 1 . 2]" 1
1950 1 116 GLU QG 1 117 ASN HD22 . . 5.030 3.280 2.189 3.814 . 0 0 "[ . 1 . 2]" 1
1951 1 117 ASN H 1 117 ASN HB2 . . 3.510 3.352 2.797 3.591 0.081 14 0 "[ . 1 . 2]" 1
1952 1 117 ASN H 1 117 ASN HB3 . . 3.120 3.090 2.798 3.583 0.463 13 0 "[ . 1 . 2]" 1
1953 1 117 ASN H 1 117 ASN HD21 . . 4.190 2.001 1.881 3.027 . 0 0 "[ . 1 . 2]" 1
1954 1 117 ASN H 1 117 ASN HD22 . . 4.570 2.787 2.673 3.167 . 0 0 "[ . 1 . 2]" 1
1955 1 117 ASN H 1 118 LYS H . . 3.070 2.470 2.226 2.611 . 0 0 "[ . 1 . 2]" 1
1956 1 117 ASN H 1 118 LYS HG3 . . 5.300 5.545 5.192 5.926 0.626 3 2 "[ + . - 1 . 2]" 1
1957 1 117 ASN HB2 1 118 LYS H . . 4.340 3.623 2.788 4.052 . 0 0 "[ . 1 . 2]" 1
1958 1 117 ASN HB2 1 118 LYS HG3 . . 5.500 5.254 4.381 5.721 0.221 9 0 "[ . 1 . 2]" 1
1959 1 117 ASN HB3 1 117 ASN HD21 . . 3.480 2.615 2.301 3.502 0.022 2 0 "[ . 1 . 2]" 1
1960 1 117 ASN HB3 1 117 ASN HD22 . . 3.900 3.654 3.507 4.071 0.171 2 0 "[ . 1 . 2]" 1
1961 1 117 ASN HD21 1 118 LYS H . . 4.830 3.976 3.172 4.810 . 0 0 "[ . 1 . 2]" 1
1962 1 117 ASN HD22 1 118 LYS H . . 4.910 4.439 4.020 5.058 0.148 11 0 "[ . 1 . 2]" 1
1963 1 118 LYS H 1 118 LYS HB2 . . 3.400 2.620 2.414 2.744 . 0 0 "[ . 1 . 2]" 1
1964 1 118 LYS H 1 118 LYS HB3 . . 3.710 3.708 3.612 3.788 0.078 14 0 "[ . 1 . 2]" 1
1965 1 118 LYS H 1 118 LYS HD2 . . 4.920 4.565 4.350 4.843 . 0 0 "[ . 1 . 2]" 1
1966 1 118 LYS H 1 118 LYS HD3 . . 4.320 3.723 3.308 4.152 . 0 0 "[ . 1 . 2]" 1
1967 1 118 LYS H 1 118 LYS QE . . 4.730 4.705 4.449 4.763 0.033 17 0 "[ . 1 . 2]" 1
1968 1 118 LYS H 1 118 LYS HG2 . . 3.890 2.473 2.141 2.587 . 0 0 "[ . 1 . 2]" 1
1969 1 118 LYS H 1 118 LYS HG3 . . 4.180 3.851 3.570 4.019 . 0 0 "[ . 1 . 2]" 1
1970 1 118 LYS H 1 119 PRO HD2 . . 5.050 4.806 4.778 4.820 . 0 0 "[ . 1 . 2]" 1
1971 1 118 LYS H 1 119 PRO HD3 . . 5.100 5.035 4.995 5.073 . 0 0 "[ . 1 . 2]" 1
1972 1 118 LYS HA 1 118 LYS HD2 . . 3.150 2.722 2.433 3.160 0.010 17 0 "[ . 1 . 2]" 1
1973 1 118 LYS HA 1 118 LYS HD3 . . 3.200 2.463 2.230 2.556 . 0 0 "[ . 1 . 2]" 1
1974 1 118 LYS HA 1 119 PRO HB3 . . 4.770 4.847 4.841 4.853 0.083 11 0 "[ . 1 . 2]" 1
1975 1 118 LYS HA 1 119 PRO HD2 . . 3.240 2.398 2.357 2.435 . 0 0 "[ . 1 . 2]" 1
1976 1 118 LYS HA 1 119 PRO HD3 . . 3.170 2.300 2.285 2.313 . 0 0 "[ . 1 . 2]" 1
1977 1 118 LYS HB2 1 119 PRO HD2 . . 3.700 3.466 3.353 3.571 . 0 0 "[ . 1 . 2]" 1
1978 1 118 LYS HB3 1 118 LYS QE . . 3.730 3.737 3.677 3.803 0.073 2 0 "[ . 1 . 2]" 1
1979 1 118 LYS HB3 1 119 PRO HD2 . . 3.070 1.973 1.922 2.060 . 0 0 "[ . 1 . 2]" 1
1980 1 118 LYS HB3 1 119 PRO HD3 . . 4.300 3.409 3.350 3.494 . 0 0 "[ . 1 . 2]" 1
1981 1 118 LYS HD2 1 119 PRO HD2 . . 4.620 2.931 2.431 3.230 . 0 0 "[ . 1 . 2]" 1
1982 1 118 LYS HD2 1 119 PRO HD3 . . 4.230 3.782 3.242 4.069 . 0 0 "[ . 1 . 2]" 1
1983 1 118 LYS HD3 1 119 PRO HD2 . . 4.320 3.936 3.521 4.218 . 0 0 "[ . 1 . 2]" 1
1984 1 118 LYS HD3 1 119 PRO HD3 . . 4.410 4.210 3.796 4.434 0.024 2 0 "[ . 1 . 2]" 1
1985 1 118 LYS QE 1 118 LYS HG2 . . 2.940 2.577 2.495 2.644 . 0 0 "[ . 1 . 2]" 1
1986 1 118 LYS HG3 1 119 PRO HD2 . . 4.590 4.274 3.958 4.401 . 0 0 "[ . 1 . 2]" 1
1987 1 118 LYS HG3 1 119 PRO HD3 . . 5.500 5.503 5.225 5.594 0.094 9 0 "[ . 1 . 2]" 1
1988 1 119 PRO HA 1 120 VAL H . . 2.970 2.260 2.201 2.408 . 0 0 "[ . 1 . 2]" 1
1989 1 119 PRO HA 1 120 VAL HB . . 4.930 4.774 4.674 4.927 . 0 0 "[ . 1 . 2]" 1
1990 1 119 PRO HA 1 120 VAL QG . . 4.370 3.419 3.287 3.606 . 0 0 "[ . 1 . 2]" 1
1991 1 119 PRO HA 1 140 ILE H . . 5.430 4.547 4.203 4.882 . 0 0 "[ . 1 . 2]" 1
1992 1 119 PRO HA 1 141 THR MG . . 4.140 3.137 2.035 4.240 0.100 17 0 "[ . 1 . 2]" 1
1993 1 119 PRO HB2 1 120 VAL H . . 3.660 3.033 2.594 3.237 . 0 0 "[ . 1 . 2]" 1
1994 1 119 PRO HB2 1 139 GLU HA . . 4.970 4.024 3.568 4.611 . 0 0 "[ . 1 . 2]" 1
1995 1 119 PRO HB2 1 140 ILE H . . 4.700 3.585 3.165 3.916 . 0 0 "[ . 1 . 2]" 1
1996 1 119 PRO HB3 1 120 VAL H . . 3.740 3.689 3.444 3.808 0.068 2 0 "[ . 1 . 2]" 1
1997 1 119 PRO HB3 1 140 ILE H . . 4.640 4.600 4.204 4.775 0.135 17 0 "[ . 1 . 2]" 1
1998 1 119 PRO QG 1 120 VAL H . . 4.640 4.419 4.154 4.532 . 0 0 "[ . 1 . 2]" 1
1999 1 120 VAL H 1 120 VAL HB . . 3.290 2.671 2.504 3.267 . 0 0 "[ . 1 . 2]" 1
2000 1 120 VAL H 1 120 VAL QG . . 3.300 2.360 1.888 2.710 . 0 0 "[ . 1 . 2]" 1
2001 1 120 VAL H 1 122 PHE QD . . 5.500 5.336 4.566 5.534 0.034 11 0 "[ . 1 . 2]" 1
2002 1 120 VAL H 1 139 GLU HA . . 5.050 4.564 4.011 5.043 . 0 0 "[ . 1 . 2]" 1
2003 1 120 VAL H 1 140 ILE H . . 3.820 2.959 2.541 3.373 . 0 0 "[ . 1 . 2]" 1
2004 1 120 VAL H 1 140 ILE MG . . 4.870 4.727 4.415 4.887 0.017 6 0 "[ . 1 . 2]" 1
2005 1 120 VAL H 1 141 THR HA . . 4.110 2.961 2.122 3.785 . 0 0 "[ . 1 . 2]" 1
2006 1 120 VAL H 1 141 THR MG . . 4.760 4.305 3.422 4.851 0.091 17 0 "[ . 1 . 2]" 1
2007 1 120 VAL H 1 142 ILE H . . 4.720 4.148 3.525 4.528 . 0 0 "[ . 1 . 2]" 1
2008 1 120 VAL H 1 142 ILE MD . . 5.500 5.372 4.791 5.562 0.062 10 0 "[ . 1 . 2]" 1
2009 1 120 VAL HA 1 120 VAL QG . . 3.330 2.077 1.995 2.408 . 0 0 "[ . 1 . 2]" 1
2010 1 120 VAL HA 1 121 HIS H . . 3.050 2.188 2.141 2.265 . 0 0 "[ . 1 . 2]" 1
2011 1 120 VAL HB 1 122 PHE QD . . 4.350 3.747 2.876 4.914 0.564 17 1 "[ . 1 . + 2]" 1
2012 1 120 VAL HB 1 122 PHE QE . . 3.600 3.022 2.543 3.979 0.379 17 0 "[ . 1 . 2]" 1
2013 1 120 VAL HB 1 142 ILE MD . . 4.120 3.829 3.243 4.515 0.395 17 0 "[ . 1 . 2]" 1
2014 1 120 VAL QG 1 121 HIS H . . 3.930 3.044 2.207 3.335 . 0 0 "[ . 1 . 2]" 1
2015 1 120 VAL QG 1 122 PHE QD . . 3.990 2.996 2.261 3.355 . 0 0 "[ . 1 . 2]" 1
2016 1 120 VAL QG 1 122 PHE QE . . 3.390 2.589 1.776 3.007 . 0 0 "[ . 1 . 2]" 1
2017 1 120 VAL QG 1 140 ILE H . . 5.050 3.916 2.893 4.278 . 0 0 "[ . 1 . 2]" 1
2018 1 120 VAL QG 1 140 ILE HB . . 4.750 3.974 2.375 4.371 . 0 0 "[ . 1 . 2]" 1
2019 1 120 VAL QG 1 142 ILE MD . . 3.690 3.053 2.427 3.692 0.002 20 0 "[ . 1 . 2]" 1
2020 1 121 HIS H 1 121 HIS HB2 . . 3.180 2.619 2.075 3.590 0.410 14 0 "[ . 1 . 2]" 1
2021 1 121 HIS H 1 121 HIS HB3 . . 3.380 3.040 2.469 3.630 0.250 17 0 "[ . 1 . 2]" 1
2022 1 121 HIS HA 1 122 PHE H . . 2.940 2.323 2.159 2.481 . 0 0 "[ . 1 . 2]" 1
2023 1 121 HIS HA 1 139 GLU HA . . 4.420 2.236 1.957 2.619 . 0 0 "[ . 1 . 2]" 1
2024 1 121 HIS HA 1 139 GLU QB . . 4.150 3.865 2.648 4.221 0.071 13 0 "[ . 1 . 2]" 1
2025 1 121 HIS HA 1 139 GLU QG . . 4.610 2.523 2.044 2.949 . 0 0 "[ . 1 . 2]" 1
2026 1 121 HIS HA 1 140 ILE H . . 4.320 3.627 3.026 4.121 . 0 0 "[ . 1 . 2]" 1
2027 1 121 HIS HB2 1 139 GLU HA . . 5.220 4.638 3.778 5.237 0.017 12 0 "[ . 1 . 2]" 1
2028 1 121 HIS HB2 1 139 GLU QG . . 4.840 3.598 2.431 4.664 . 0 0 "[ . 1 . 2]" 1
2029 1 121 HIS HB3 1 121 HIS HD2 . . 3.540 3.279 2.709 3.907 0.367 20 0 "[ . 1 . 2]" 1
2030 1 121 HIS HB3 1 139 GLU HA . . 5.500 4.683 3.419 5.524 0.024 18 0 "[ . 1 . 2]" 1
2031 1 121 HIS HB3 1 139 GLU QG . . 5.120 3.679 2.117 4.874 . 0 0 "[ . 1 . 2]" 1
2032 1 122 PHE H 1 122 PHE HB2 . . 3.640 2.351 2.159 2.491 . 0 0 "[ . 1 . 2]" 1
2033 1 122 PHE H 1 122 PHE HB3 . . 4.020 3.568 3.456 3.607 . 0 0 "[ . 1 . 2]" 1
2034 1 122 PHE H 1 122 PHE QD . . 4.040 3.066 2.608 3.393 . 0 0 "[ . 1 . 2]" 1
2035 1 122 PHE H 1 123 LYS H . . 4.940 4.388 4.092 4.565 . 0 0 "[ . 1 . 2]" 1
2036 1 122 PHE H 1 137 SER HA . . 5.500 5.415 4.639 5.649 0.149 17 0 "[ . 1 . 2]" 1
2037 1 122 PHE H 1 139 GLU HA . . 3.880 3.049 2.147 3.502 . 0 0 "[ . 1 . 2]" 1
2038 1 122 PHE H 1 139 GLU QG . . 4.720 4.304 3.464 4.633 . 0 0 "[ . 1 . 2]" 1
2039 1 122 PHE H 1 140 ILE H . . 5.260 3.648 3.345 3.930 . 0 0 "[ . 1 . 2]" 1
2040 1 122 PHE H 1 140 ILE MD . . 5.500 4.614 4.025 5.214 . 0 0 "[ . 1 . 2]" 1
2041 1 122 PHE HA 1 123 LYS H . . 3.020 2.169 2.138 2.260 . 0 0 "[ . 1 . 2]" 1
2042 1 122 PHE HB2 1 123 LYS H . . 5.050 4.411 4.202 4.620 . 0 0 "[ . 1 . 2]" 1
2043 1 122 PHE HB2 1 124 PHE QE . . 4.580 3.915 2.760 4.675 0.095 20 0 "[ . 1 . 2]" 1
2044 1 122 PHE HB2 1 138 GLU H . . 4.190 3.917 3.364 4.468 0.278 16 0 "[ . 1 . 2]" 1
2045 1 122 PHE HB2 1 138 GLU HB3 . . 5.290 4.227 3.479 5.176 . 0 0 "[ . 1 . 2]" 1
2046 1 122 PHE HB2 1 140 ILE MD . . 3.920 3.412 2.720 3.936 0.016 16 0 "[ . 1 . 2]" 1
2047 1 122 PHE HB2 1 140 ILE MG . . 5.450 5.420 4.989 5.589 0.139 16 0 "[ . 1 . 2]" 1
2048 1 122 PHE HB3 1 123 LYS H . . 4.610 3.593 3.136 4.072 . 0 0 "[ . 1 . 2]" 1
2049 1 122 PHE HB3 1 124 PHE QE . . 3.820 2.997 1.993 3.850 0.030 20 0 "[ . 1 . 2]" 1
2050 1 122 PHE HB3 1 140 ILE MD . . 5.500 4.347 3.359 4.926 . 0 0 "[ . 1 . 2]" 1
2051 1 122 PHE QD 1 123 LYS H . . 4.960 3.785 3.199 4.255 . 0 0 "[ . 1 . 2]" 1
2052 1 122 PHE QD 1 140 ILE H . . 4.060 3.752 3.003 4.073 0.013 4 0 "[ . 1 . 2]" 1
2053 1 122 PHE QD 1 140 ILE HB . . 4.240 2.346 2.018 2.601 . 0 0 "[ . 1 . 2]" 1
2054 1 122 PHE QD 1 140 ILE MD . . 3.090 2.407 1.955 3.093 0.003 16 0 "[ . 1 . 2]" 1
2055 1 122 PHE QD 1 140 ILE MG . . 4.650 3.705 3.539 3.953 . 0 0 "[ . 1 . 2]" 1
2056 1 122 PHE QD 1 142 ILE HG13 . . 5.380 5.075 4.760 5.461 0.081 13 0 "[ . 1 . 2]" 1
2057 1 122 PHE QE 1 140 ILE H . . 4.940 4.555 3.903 5.054 0.114 17 0 "[ . 1 . 2]" 1
2058 1 122 PHE QE 1 140 ILE HB . . 3.080 2.448 1.986 3.111 0.031 17 0 "[ . 1 . 2]" 1
2059 1 122 PHE QE 1 140 ILE MD . . 3.830 3.207 2.222 3.806 . 0 0 "[ . 1 . 2]" 1
2060 1 122 PHE QE 1 140 ILE HG13 . . 4.900 4.487 3.866 4.938 0.038 17 0 "[ . 1 . 2]" 1
2061 1 122 PHE QE 1 140 ILE MG . . 3.900 3.115 2.666 3.847 . 0 0 "[ . 1 . 2]" 1
2062 1 122 PHE QE 1 142 ILE MD . . 3.410 2.065 1.916 2.867 . 0 0 "[ . 1 . 2]" 1
2063 1 122 PHE QE 1 142 ILE HG12 . . 3.540 3.440 2.412 3.655 0.115 17 0 "[ . 1 . 2]" 1
2064 1 122 PHE QE 1 142 ILE HG13 . . 3.160 2.960 2.661 3.310 0.150 17 0 "[ . 1 . 2]" 1
2065 1 123 LYS H 1 123 LYS QB . . 3.520 2.527 2.153 3.222 . 0 0 "[ . 1 . 2]" 1
2066 1 123 LYS H 1 123 LYS HG2 . . 4.700 4.247 3.105 4.711 0.011 16 0 "[ . 1 . 2]" 1
2067 1 123 LYS H 1 123 LYS HG3 . . 4.720 3.629 1.944 4.701 . 0 0 "[ . 1 . 2]" 1
2068 1 123 LYS HA 1 123 LYS HG2 . . 3.960 2.714 2.151 3.710 . 0 0 "[ . 1 . 2]" 1
2069 1 123 LYS HA 1 123 LYS HG3 . . 4.020 2.804 2.346 3.536 . 0 0 "[ . 1 . 2]" 1
2070 1 123 LYS HA 1 124 PHE H . . 3.290 2.420 2.163 2.585 . 0 0 "[ . 1 . 2]" 1
2071 1 123 LYS HA 1 124 PHE QD . . 4.280 3.134 2.615 3.887 . 0 0 "[ . 1 . 2]" 1
2072 1 123 LYS HA 1 137 SER HA . . 3.270 2.272 1.994 2.656 . 0 0 "[ . 1 . 2]" 1
2073 1 123 LYS HA 1 137 SER QB . . 3.860 2.943 2.252 3.499 . 0 0 "[ . 1 . 2]" 1
2074 1 123 LYS QB 1 124 PHE H . . 4.310 2.658 2.050 3.879 . 0 0 "[ . 1 . 2]" 1
2075 1 123 LYS QB 1 137 SER HA . . 4.960 4.002 3.088 4.722 . 0 0 "[ . 1 . 2]" 1
2076 1 123 LYS QB 1 137 SER QB . . 4.770 3.386 1.893 4.286 . 0 0 "[ . 1 . 2]" 1
2077 1 123 LYS HG2 1 124 PHE H . . 5.080 3.353 1.947 4.934 . 0 0 "[ . 1 . 2]" 1
2078 1 123 LYS HG2 1 137 SER HA . . 5.370 3.647 2.132 5.043 . 0 0 "[ . 1 . 2]" 1
2079 1 123 LYS HG2 1 137 SER QB . . 4.070 2.581 1.948 3.829 . 0 0 "[ . 1 . 2]" 1
2080 1 123 LYS HG3 1 124 PHE H . . 4.420 4.137 2.432 5.057 0.637 10 2 "[ . + - 2]" 1
2081 1 123 LYS HG3 1 137 SER HA . . 5.210 3.797 2.628 5.359 0.149 20 0 "[ . 1 . 2]" 1
2082 1 123 LYS HG3 1 137 SER QB . . 4.100 2.889 1.951 4.115 0.015 20 0 "[ . 1 . 2]" 1
2083 1 124 PHE H 1 124 PHE HB2 . . 3.840 2.841 2.617 2.973 . 0 0 "[ . 1 . 2]" 1
2084 1 124 PHE H 1 124 PHE QD . . 4.220 2.988 2.517 3.316 . 0 0 "[ . 1 . 2]" 1
2085 1 124 PHE H 1 124 PHE QE . . 5.180 4.966 4.475 5.192 0.012 17 0 "[ . 1 . 2]" 1
2086 1 124 PHE H 1 125 ARG H . . 4.690 4.175 3.311 4.502 . 0 0 "[ . 1 . 2]" 1
2087 1 124 PHE H 1 134 PRO HB3 . . 4.530 4.228 3.529 4.556 0.026 16 0 "[ . 1 . 2]" 1
2088 1 124 PHE H 1 136 ALA H . . 4.040 3.486 2.972 4.021 . 0 0 "[ . 1 . 2]" 1
2089 1 124 PHE H 1 137 SER HA . . 4.790 3.798 2.960 4.303 . 0 0 "[ . 1 . 2]" 1
2090 1 124 PHE H 1 137 SER QB . . 5.500 3.726 2.955 4.190 . 0 0 "[ . 1 . 2]" 1
2091 1 124 PHE HA 1 124 PHE QD . . 4.120 2.987 2.806 3.135 . 0 0 "[ . 1 . 2]" 1
2092 1 124 PHE HA 1 124 PHE QE . . 5.410 4.694 4.615 4.812 . 0 0 "[ . 1 . 2]" 1
2093 1 124 PHE HA 1 125 ARG H . . 3.280 2.317 2.140 2.690 . 0 0 "[ . 1 . 2]" 1
2094 1 124 PHE HA 1 125 ARG HA . . 5.380 4.466 4.318 4.725 . 0 0 "[ . 1 . 2]" 1
2095 1 124 PHE HA 1 136 ALA H . . 5.500 5.357 4.781 5.580 0.080 20 0 "[ . 1 . 2]" 1
2096 1 124 PHE HB2 1 125 ARG H . . 5.500 3.903 2.941 4.511 . 0 0 "[ . 1 . 2]" 1
2097 1 124 PHE HB2 1 136 ALA H . . 3.930 3.360 2.039 3.940 0.010 13 0 "[ . 1 . 2]" 1
2098 1 124 PHE HB3 1 125 ARG H . . 4.160 3.002 1.878 4.166 0.006 13 0 "[ . 1 . 2]" 1
2099 1 124 PHE HB3 1 136 ALA H . . 5.180 4.786 3.290 5.192 0.012 15 0 "[ . 1 . 2]" 1
2100 1 124 PHE QD 1 125 ARG H . . 5.250 4.167 3.374 4.847 . 0 0 "[ . 1 . 2]" 1
2101 1 124 PHE QD 1 136 ALA H . . 5.390 4.350 3.189 5.405 0.015 17 0 "[ . 1 . 2]" 1
2102 1 124 PHE QD 1 136 ALA MB . . 3.650 2.487 1.925 3.681 0.031 20 0 "[ . 1 . 2]" 1
2103 1 124 PHE QD 1 137 SER H . . 5.420 4.291 3.559 5.046 . 0 0 "[ . 1 . 2]" 1
2104 1 124 PHE QD 1 137 SER HA . . 4.260 3.495 2.795 4.235 . 0 0 "[ . 1 . 2]" 1
2105 1 124 PHE QE 1 136 ALA MB . . 5.260 3.786 2.780 5.257 . 0 0 "[ . 1 . 2]" 1
2106 1 124 PHE QE 1 137 SER HA . . 4.960 4.290 3.174 4.960 . 0 0 "[ . 1 . 2]" 1
2107 1 125 ARG H 1 125 ARG HG2 . . 4.810 4.335 2.597 5.223 0.413 18 0 "[ . 1 . 2]" 1
2108 1 125 ARG H 1 125 ARG HG3 . . 5.120 4.042 2.201 5.076 . 0 0 "[ . 1 . 2]" 1
2109 1 125 ARG H 1 126 ASP H . . 5.500 3.991 1.843 4.595 . 0 0 "[ . 1 . 2]" 1
2110 1 125 ARG HA 1 125 ARG QD . . 3.750 3.189 2.046 3.798 0.048 16 0 "[ . 1 . 2]" 1
2111 1 125 ARG HA 1 125 ARG HG2 . . 4.000 3.520 2.065 4.227 0.227 15 0 "[ . 1 . 2]" 1
2112 1 125 ARG HA 1 134 PRO HB3 . . 5.010 4.809 4.124 5.179 0.169 11 0 "[ . 1 . 2]" 1
2113 1 125 ARG HA 1 135 ILE H . . 5.410 3.579 2.408 5.234 . 0 0 "[ . 1 . 2]" 1
2114 1 125 ARG HA 1 135 ILE MG . . 4.360 3.243 1.952 4.437 0.077 11 0 "[ . 1 . 2]" 1
2115 1 125 ARG HB2 1 126 ASP H . . 4.620 3.492 2.058 4.325 . 0 0 "[ . 1 . 2]" 1
2116 1 125 ARG HB2 1 135 ILE H . . 5.500 3.576 1.945 5.538 0.038 11 0 "[ . 1 . 2]" 1
2117 1 125 ARG HB3 1 126 ASP H . . 4.580 3.428 2.160 4.540 . 0 0 "[ . 1 . 2]" 1
2118 1 125 ARG QD 1 130 SER HB2 . . 5.480 4.089 2.455 5.300 . 0 0 "[ . 1 . 2]" 1
2119 1 125 ARG QD 1 130 SER HB3 . . 5.150 4.054 1.923 5.526 0.376 11 0 "[ . 1 . 2]" 1
2120 1 125 ARG HG3 1 126 ASP H . . 5.500 3.517 1.944 5.091 . 0 0 "[ . 1 . 2]" 1
2121 1 126 ASP HA 1 127 ARG HE . . 5.100 4.711 3.090 5.126 0.026 19 0 "[ . 1 . 2]" 1
2122 1 126 ASP HA 1 127 ARG QG . . 4.180 4.002 3.549 4.298 0.118 4 0 "[ . 1 . 2]" 1
2123 1 127 ARG HA 1 127 ARG QD . . 4.770 3.536 2.064 4.490 . 0 0 "[ . 1 . 2]" 1
2124 1 130 SER H 1 130 SER HB2 . . 3.820 3.377 2.437 3.894 0.074 4 0 "[ . 1 . 2]" 1
2125 1 130 SER H 1 130 SER HB3 . . 3.830 3.549 2.104 3.951 0.121 2 0 "[ . 1 . 2]" 1
2126 1 130 SER H 1 131 LEU QB . . 5.260 4.910 4.259 5.365 0.105 8 0 "[ . 1 . 2]" 1
2127 1 130 SER H 1 131 LEU MD2 . . 4.980 3.131 2.270 4.049 . 0 0 "[ . 1 . 2]" 1
2128 1 130 SER HA 1 131 LEU HG . . 4.100 3.681 3.126 4.050 . 0 0 "[ . 1 . 2]" 1
2129 1 130 SER HA 1 132 ASP H . . 4.370 4.006 3.542 4.479 0.109 8 0 "[ . 1 . 2]" 1
2130 1 130 SER HB2 1 131 LEU HG . . 5.480 5.328 4.666 6.348 0.868 3 3 "[ + . 1 - * 2]" 1
2131 1 130 SER HB2 1 132 ASP H . . 4.870 4.341 2.597 5.307 0.437 20 0 "[ . 1 . 2]" 1
2132 1 130 SER HB3 1 132 ASP H . . 5.190 4.284 2.294 5.207 0.017 12 0 "[ . 1 . 2]" 1
2133 1 131 LEU HA 1 131 LEU MD1 . . 4.000 3.955 3.826 4.097 0.097 18 0 "[ . 1 . 2]" 1
2134 1 131 LEU HA 1 131 LEU MD2 . . 3.330 2.666 2.089 3.390 0.060 10 0 "[ . 1 . 2]" 1
2135 1 131 LEU QB 1 131 LEU MD1 . . 2.400 2.009 1.916 2.099 . 0 0 "[ . 1 . 2]" 1
2136 1 131 LEU QB 1 132 ASP HA . . 4.340 4.045 3.731 4.371 0.031 5 0 "[ . 1 . 2]" 1
2137 1 131 LEU MD2 1 132 ASP H . . 5.010 4.215 3.426 4.585 . 0 0 "[ . 1 . 2]" 1
2138 1 131 LEU HG 1 132 ASP H . . 3.790 3.474 1.972 4.234 0.444 11 0 "[ . 1 . 2]" 1
2139 1 131 LEU HG 1 132 ASP QB . . 5.230 4.622 3.239 5.171 . 0 0 "[ . 1 . 2]" 1
2140 1 132 ASP H 1 132 ASP QB . . 3.260 2.251 2.046 2.892 . 0 0 "[ . 1 . 2]" 1
2141 1 132 ASP HA 1 133 GLU QG . . 5.410 4.271 3.237 5.334 . 0 0 "[ . 1 . 2]" 1
2142 1 133 GLU HA 1 133 GLU QG . . 3.540 2.723 2.067 3.405 . 0 0 "[ . 1 . 2]" 1
2143 1 133 GLU HA 1 134 PRO HD2 . . 3.230 2.462 2.394 2.533 . 0 0 "[ . 1 . 2]" 1
2144 1 133 GLU HA 1 134 PRO HD3 . . 3.110 2.324 2.295 2.358 . 0 0 "[ . 1 . 2]" 1
2145 1 133 GLU HB2 1 134 PRO HD2 . . 3.590 3.001 1.971 3.616 0.026 13 0 "[ . 1 . 2]" 1
2146 1 133 GLU HB3 1 134 PRO HD2 . . 3.640 2.356 1.961 3.035 . 0 0 "[ . 1 . 2]" 1
2147 1 133 GLU HB3 1 134 PRO HD3 . . 4.140 3.646 3.383 4.045 . 0 0 "[ . 1 . 2]" 1
2148 1 133 GLU QG 1 134 PRO HD2 . . 4.170 3.375 2.131 4.086 . 0 0 "[ . 1 . 2]" 1
2149 1 133 GLU QG 1 134 PRO HD3 . . 4.990 4.181 2.972 4.929 . 0 0 "[ . 1 . 2]" 1
2150 1 134 PRO HA 1 135 ILE H . . 3.180 2.478 2.152 2.569 . 0 0 "[ . 1 . 2]" 1
2151 1 134 PRO HA 1 135 ILE HA . . 4.670 4.354 4.309 4.430 . 0 0 "[ . 1 . 2]" 1
2152 1 134 PRO HA 1 136 ALA H . . 4.310 4.283 3.757 4.372 0.062 20 0 "[ . 1 . 2]" 1
2153 1 134 PRO HB2 1 136 ALA H . . 3.910 2.543 2.358 2.966 . 0 0 "[ . 1 . 2]" 1
2154 1 134 PRO HB3 1 135 ILE H . . 4.230 3.380 3.268 4.097 . 0 0 "[ . 1 . 2]" 1
2155 1 134 PRO HB3 1 136 ALA H . . 4.260 4.174 4.101 4.314 0.054 4 0 "[ . 1 . 2]" 1
2156 1 134 PRO HD2 1 135 ILE H . . 5.500 5.507 5.437 5.541 0.041 16 0 "[ . 1 . 2]" 1
2157 1 134 PRO HG3 1 136 ALA H . . 5.500 4.925 4.395 5.595 0.095 4 0 "[ . 1 . 2]" 1
2158 1 135 ILE H 1 135 ILE HB . . 4.130 2.685 2.477 3.129 . 0 0 "[ . 1 . 2]" 1
2159 1 135 ILE H 1 135 ILE MD . . 4.510 4.307 3.458 4.582 0.072 4 0 "[ . 1 . 2]" 1
2160 1 135 ILE H 1 135 ILE HG13 . . 5.300 4.207 2.078 4.686 . 0 0 "[ . 1 . 2]" 1
2161 1 135 ILE H 1 135 ILE MG . . 4.130 2.288 1.896 3.785 . 0 0 "[ . 1 . 2]" 1
2162 1 135 ILE H 1 136 ALA H . . 3.400 2.328 1.897 2.805 . 0 0 "[ . 1 . 2]" 1
2163 1 135 ILE H 1 136 ALA MB . . 5.270 4.400 4.065 4.817 . 0 0 "[ . 1 . 2]" 1
2164 1 135 ILE HA 1 135 ILE MD . . 3.930 3.439 2.041 3.827 . 0 0 "[ . 1 . 2]" 1
2165 1 135 ILE HA 1 135 ILE HG12 . . 3.670 3.218 2.484 3.647 . 0 0 "[ . 1 . 2]" 1
2166 1 135 ILE HA 1 135 ILE HG13 . . 4.100 2.483 2.233 3.719 . 0 0 "[ . 1 . 2]" 1
2167 1 135 ILE HA 1 135 ILE MG . . 3.200 3.074 2.342 3.202 0.002 20 0 "[ . 1 . 2]" 1
2168 1 135 ILE HA 1 136 ALA HA . . 4.780 4.550 4.521 4.640 . 0 0 "[ . 1 . 2]" 1
2169 1 135 ILE HA 1 136 ALA MB . . 4.840 4.535 4.179 4.722 . 0 0 "[ . 1 . 2]" 1
2170 1 135 ILE HB 1 135 ILE MD . . 3.500 2.317 1.988 3.229 . 0 0 "[ . 1 . 2]" 1
2171 1 135 ILE HB 1 136 ALA H . . 3.970 3.814 2.770 4.078 0.108 16 0 "[ . 1 . 2]" 1
2172 1 135 ILE HG12 1 136 ALA H . . 4.790 4.294 3.616 5.024 0.234 10 0 "[ . 1 . 2]" 1
2173 1 135 ILE HG13 1 135 ILE MG . . 3.140 3.081 2.386 3.203 0.063 1 0 "[ . 1 . 2]" 1
2174 1 135 ILE HG13 1 136 ALA H . . 5.150 4.623 4.258 5.075 . 0 0 "[ . 1 . 2]" 1
2175 1 135 ILE MG 1 136 ALA H . . 4.210 2.350 1.956 3.613 . 0 0 "[ . 1 . 2]" 1
2176 1 135 ILE MG 1 136 ALA HA . . 4.200 3.936 3.707 4.226 0.026 2 0 "[ . 1 . 2]" 1
2177 1 136 ALA H 1 136 ALA MB . . 3.470 2.670 2.484 2.914 . 0 0 "[ . 1 . 2]" 1
2178 1 136 ALA H 1 137 SER H . . 4.550 4.360 4.257 4.431 . 0 0 "[ . 1 . 2]" 1
2179 1 136 ALA H 1 137 SER HA . . 5.500 5.048 4.792 5.191 . 0 0 "[ . 1 . 2]" 1
2180 1 136 ALA H 1 137 SER QB . . 5.500 4.399 3.942 5.135 . 0 0 "[ . 1 . 2]" 1
2181 1 136 ALA HA 1 137 SER H . . 2.790 2.342 2.161 2.715 . 0 0 "[ . 1 . 2]" 1
2182 1 136 ALA MB 1 137 SER H . . 3.030 2.607 2.033 3.039 0.009 19 0 "[ . 1 . 2]" 1
2183 1 136 ALA MB 1 137 SER HA . . 4.640 3.761 3.627 3.952 . 0 0 "[ . 1 . 2]" 1
2184 1 136 ALA MB 1 137 SER QB . . 5.290 4.401 4.235 4.689 . 0 0 "[ . 1 . 2]" 1
2185 1 137 SER H 1 138 GLU H . . 4.710 4.197 4.007 4.360 . 0 0 "[ . 1 . 2]" 1
2186 1 137 SER HA 1 138 GLU H . . 3.080 2.292 2.161 2.943 . 0 0 "[ . 1 . 2]" 1
2187 1 137 SER HA 1 138 GLU HB2 . . 4.960 4.624 3.960 5.615 0.655 11 2 "[ . 1+- . 2]" 1
2188 1 137 SER QB 1 138 GLU H . . 3.650 2.811 1.930 3.392 . 0 0 "[ . 1 . 2]" 1
2189 1 137 SER QB 1 138 GLU HB2 . . 5.500 5.013 4.418 5.731 0.231 11 0 "[ . 1 . 2]" 1
2190 1 138 GLU H 1 138 GLU HB3 . . 4.050 3.185 2.897 3.780 . 0 0 "[ . 1 . 2]" 1
2191 1 138 GLU H 1 138 GLU HG3 . . 5.300 4.699 4.370 4.834 . 0 0 "[ . 1 . 2]" 1
2192 1 138 GLU H 1 139 GLU H . . 4.110 4.145 3.960 4.351 0.241 11 0 "[ . 1 . 2]" 1
2193 1 138 GLU HA 1 138 GLU HG2 . . 3.330 3.473 3.250 3.706 0.376 16 0 "[ . 1 . 2]" 1
2194 1 138 GLU HA 1 138 GLU HG3 . . 3.630 2.689 2.338 3.867 0.237 11 0 "[ . 1 . 2]" 1
2195 1 138 GLU HA 1 139 GLU H . . 2.810 2.216 2.149 2.422 . 0 0 "[ . 1 . 2]" 1
2196 1 138 GLU HB2 1 140 ILE MD . . 5.340 4.786 3.962 5.217 . 0 0 "[ . 1 . 2]" 1
2197 1 138 GLU HB3 1 138 GLU HG2 . . 2.710 2.369 2.218 2.734 0.024 11 0 "[ . 1 . 2]" 1
2198 1 138 GLU HB3 1 139 GLU H . . 4.220 4.044 3.663 4.289 0.069 15 0 "[ . 1 . 2]" 1
2199 1 138 GLU HB3 1 140 ILE MD . . 5.500 3.604 2.579 5.315 . 0 0 "[ . 1 . 2]" 1
2200 1 138 GLU HG2 1 139 GLU H . . 3.630 3.442 2.922 3.929 0.299 16 0 "[ . 1 . 2]" 1
2201 1 138 GLU HG2 1 140 ILE MD . . 4.860 3.218 2.377 4.561 . 0 0 "[ . 1 . 2]" 1
2202 1 138 GLU HG2 1 140 ILE HG12 . . 4.240 3.363 2.783 4.527 0.287 16 0 "[ . 1 . 2]" 1
2203 1 138 GLU HG3 1 139 GLU H . . 3.800 2.593 2.172 3.249 . 0 0 "[ . 1 . 2]" 1
2204 1 138 GLU HG3 1 140 ILE MD . . 4.950 4.326 2.480 4.974 0.024 17 0 "[ . 1 . 2]" 1
2205 1 138 GLU HG3 1 140 ILE HG12 . . 4.520 4.220 2.815 4.534 0.014 19 0 "[ . 1 . 2]" 1
2206 1 138 GLU HG3 1 140 ILE HG13 . . 4.680 3.932 2.009 4.630 . 0 0 "[ . 1 . 2]" 1
2207 1 139 GLU H 1 139 GLU QB . . 3.050 2.312 2.095 2.676 . 0 0 "[ . 1 . 2]" 1
2208 1 139 GLU H 1 139 GLU QG . . 3.920 3.128 2.339 3.721 . 0 0 "[ . 1 . 2]" 1
2209 1 139 GLU H 1 140 ILE H . . 4.840 4.538 4.303 4.596 . 0 0 "[ . 1 . 2]" 1
2210 1 139 GLU H 1 140 ILE MD . . 5.500 5.348 4.873 5.524 0.024 17 0 "[ . 1 . 2]" 1
2211 1 139 GLU H 1 140 ILE HG13 . . 5.500 4.305 3.863 4.532 . 0 0 "[ . 1 . 2]" 1
2212 1 139 GLU HA 1 139 GLU QG . . 3.810 2.248 2.005 2.608 . 0 0 "[ . 1 . 2]" 1
2213 1 139 GLU HA 1 140 ILE H . . 2.750 2.195 2.139 2.282 . 0 0 "[ . 1 . 2]" 1
2214 1 139 GLU HA 1 140 ILE MD . . 5.500 4.968 4.790 5.172 . 0 0 "[ . 1 . 2]" 1
2215 1 139 GLU QB 1 140 ILE H . . 3.770 3.080 2.715 3.582 . 0 0 "[ . 1 . 2]" 1
2216 1 140 ILE H 1 140 ILE HB . . 3.500 2.889 2.757 2.955 . 0 0 "[ . 1 . 2]" 1
2217 1 140 ILE H 1 140 ILE MD . . 4.670 4.301 4.087 4.398 . 0 0 "[ . 1 . 2]" 1
2218 1 140 ILE H 1 140 ILE HG12 . . 4.310 4.055 3.922 4.224 . 0 0 "[ . 1 . 2]" 1
2219 1 140 ILE H 1 140 ILE HG13 . . 4.190 3.058 2.783 3.231 . 0 0 "[ . 1 . 2]" 1
2220 1 140 ILE H 1 140 ILE MG . . 4.160 3.940 3.897 3.979 . 0 0 "[ . 1 . 2]" 1
2221 1 140 ILE H 1 141 THR H . . 4.410 4.194 3.818 4.399 . 0 0 "[ . 1 . 2]" 1
2222 1 140 ILE HA 1 140 ILE MD . . 4.200 3.831 3.801 3.883 . 0 0 "[ . 1 . 2]" 1
2223 1 140 ILE HA 1 140 ILE HG12 . . 3.590 2.546 2.493 2.646 . 0 0 "[ . 1 . 2]" 1
2224 1 140 ILE HA 1 140 ILE HG13 . . 3.310 3.094 2.990 3.180 . 0 0 "[ . 1 . 2]" 1
2225 1 140 ILE HA 1 140 ILE MG . . 3.080 2.350 2.198 2.402 . 0 0 "[ . 1 . 2]" 1
2226 1 140 ILE HA 1 141 THR H . . 2.810 2.182 2.139 2.289 . 0 0 "[ . 1 . 2]" 1
2227 1 140 ILE HB 1 140 ILE MD . . 3.500 2.370 2.312 2.400 . 0 0 "[ . 1 . 2]" 1
2228 1 140 ILE HB 1 141 THR H . . 4.810 4.094 3.685 4.410 . 0 0 "[ . 1 . 2]" 1
2229 1 140 ILE MD 1 140 ILE MG . . 3.030 2.016 1.917 2.092 . 0 0 "[ . 1 . 2]" 1
2230 1 140 ILE MD 1 141 THR H . . 5.440 5.050 4.743 5.406 . 0 0 "[ . 1 . 2]" 1
2231 1 140 ILE HG12 1 141 THR H . . 4.610 4.420 4.198 4.642 0.032 16 0 "[ . 1 . 2]" 1
2232 1 140 ILE HG13 1 141 THR H . . 5.420 5.076 4.981 5.193 . 0 0 "[ . 1 . 2]" 1
2233 1 140 ILE MG 1 141 THR H . . 3.200 2.573 2.069 3.233 0.033 16 0 "[ . 1 . 2]" 1
2234 1 140 ILE MG 1 142 ILE HA . . 3.830 3.612 2.532 3.951 0.121 17 0 "[ . 1 . 2]" 1
2235 1 140 ILE MG 1 142 ILE HG13 . . 4.240 2.997 2.245 4.287 0.047 12 0 "[ . 1 . 2]" 1
2236 1 141 THR H 1 141 THR HB . . 3.440 2.970 2.601 3.556 0.116 17 0 "[ . 1 . 2]" 1
2237 1 141 THR H 1 141 THR MG . . 4.440 3.300 1.897 3.872 . 0 0 "[ . 1 . 2]" 1
2238 1 141 THR HA 1 141 THR MG . . 2.990 2.369 1.962 3.185 0.195 2 0 "[ . 1 . 2]" 1
2239 1 141 THR HA 1 142 ILE H . . 2.960 2.342 2.143 3.283 0.323 13 0 "[ . 1 . 2]" 1
2240 1 141 THR HA 1 142 ILE HG12 . . 5.500 4.842 3.666 5.267 . 0 0 "[ . 1 . 2]" 1
2241 1 142 ILE H 1 142 ILE HB . . 3.420 2.774 2.489 3.622 0.202 13 0 "[ . 1 . 2]" 1
2242 1 142 ILE H 1 142 ILE MD . . 3.810 3.601 2.806 3.829 0.019 16 0 "[ . 1 . 2]" 1
2243 1 142 ILE H 1 142 ILE HG12 . . 3.810 3.336 2.575 3.742 . 0 0 "[ . 1 . 2]" 1
2244 1 142 ILE H 1 142 ILE HG13 . . 4.050 2.575 1.826 4.190 0.140 13 0 "[ . 1 . 2]" 1
2245 1 142 ILE H 1 142 ILE MG . . 4.000 3.835 3.763 3.975 . 0 0 "[ . 1 . 2]" 1
2246 1 142 ILE H 1 143 THR H . . 4.480 4.345 3.448 4.553 0.073 8 0 "[ . 1 . 2]" 1
2247 1 142 ILE HA 1 142 ILE MD . . 4.190 3.596 1.948 3.986 . 0 0 "[ . 1 . 2]" 1
2248 1 142 ILE HA 1 142 ILE HG12 . . 3.680 2.682 2.495 3.065 . 0 0 "[ . 1 . 2]" 1
2249 1 142 ILE HA 1 142 ILE HG13 . . 3.720 3.241 2.998 3.808 0.088 13 0 "[ . 1 . 2]" 1
2250 1 142 ILE HA 1 142 ILE MG . . 3.110 2.268 1.961 2.373 . 0 0 "[ . 1 . 2]" 1
2251 1 142 ILE HA 1 143 THR H . . 2.720 2.228 2.142 2.782 0.062 17 0 "[ . 1 . 2]" 1
2252 1 142 ILE HB 1 142 ILE MD . . 3.100 2.535 2.325 3.228 0.128 20 0 "[ . 1 . 2]" 1
2253 1 142 ILE HB 1 143 THR H . . 4.710 3.995 2.208 4.480 . 0 0 "[ . 1 . 2]" 1
2254 1 142 ILE MD 1 142 ILE MG . . 2.970 1.958 1.886 2.078 . 0 0 "[ . 1 . 2]" 1
2255 1 142 ILE MD 1 143 THR H . . 5.160 4.867 3.656 5.614 0.454 10 0 "[ . 1 . 2]" 1
2256 1 142 ILE HG12 1 143 THR H . . 4.920 4.592 4.304 5.128 0.208 20 0 "[ . 1 . 2]" 1
2257 1 142 ILE MG 1 143 THR H . . 3.320 2.412 1.791 3.502 0.182 10 0 "[ . 1 . 2]" 1
2258 1 142 ILE MG 1 143 THR HA . . 5.170 3.674 3.336 4.752 . 0 0 "[ . 1 . 2]" 1
2259 1 143 THR H 1 143 THR HB . . 3.830 3.519 2.331 3.989 0.159 10 0 "[ . 1 . 2]" 1
2260 1 143 THR H 1 143 THR MG . . 3.810 3.310 2.330 3.971 0.161 1 0 "[ . 1 . 2]" 1
2261 1 143 THR HA 1 143 THR MG . . 3.130 2.437 1.981 3.196 0.066 13 0 "[ . 1 . 2]" 1
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